NAME	IC50 (uM)
c1(ncc2c(n1)N(C(N2C)=O)C1CCOCC1)NC1=Cn2ccnc2C=C1C	8.1
c1(nc(c(nc1)C#N)c1cnn(c1)C)N1CCN(C(C1)C)CC1C(C1)C	23
C(c1ccccc1OCCCCCC(=O)O)n1c(ncc1C)c1ccc(cc1)c1occc1	5.5
C(c1ccccc1OCCCC(CC(=O)O)C)n1c(ncc1C)c1ccc(cc1)OC(F)(F)F	10
c12ccccc2[C@@H](CCC1)[N@@](Cc1cc(nc(n1)C)N1CCN(CC1)C)C	8
c12C(N(C(N(c1nc(n2CC#CC)N1CCC[C@H](C1)N)C)=O)CCCN1CCN(CC1)c1onc(n1)c1ccccc1)=O	4.9
c1(nc2ccsc2c(n1)Oc1c(cc(cc1C)C#N)C)NC1CCN(CC1)Cc1ccc(cc1)S(=O)(N)=O	0.13
c1(nc2ccsc2c(n1)Oc1c(cc(cc1C)\C=C\C#N)C)NC1CCN(CC1)Cc1ccc(cc1)S(=O)(N)=O	0.186
c1(nc2sccc2c(n1)Oc1c(cc(cc1C)\C=C\C#N)C)NC1CCN(CC1)Cc1ccc(cc1)S(=O)(N)=O	0.979
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1CCN(CC1)C)C(F)(F)F	0.77
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1CCN(CC1)CCO)C1CC1	0.34
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1CCN(CC1)CCO)[Cl]	0.1
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1CCN(CC1)CCOC)C1CC1	0.08
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1Cc2[nH]ncc2CC1)[Cl]	5.02
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1Cc2cn[nH]c2C1)[Cl]	12.1
c12C=CC=Nn1c(cn2)C#Cc1cc(ccc1C)C(=O)Nc1cc(c(cc1)CN1Cc2cc(ccc2C1)O)[Cl]	0.78
c1c(ccc(c1)F)C(c1ccc(cc1)F)S(CCN1CCN(CC1)CC(Cc1ccccc1)O)=O	0.0415
c1c(ccc(c1)F)C(c1ccc(cc1)F)SCCN1CCN(CC1)CC(C)O	0.126
c1c(ccc(c1)F)C(c1ccc(cc1)F)S(CCN1CCN(CC1)CC(C)O)=O	10.15
c1c(ccc(c1)F)C(c1ccc(cc1)F)SCCN1CC(N(C(C1)C)CC(C)O)C	0.635
c1c(ccc(c1)F)C(c1ccc(cc1)F)S(CCN1CC(N(C(C1)C)CC(C)O)C)=O	7.3
c1c(ccc(c1)F)C(c1ccc(cc1)F)S(CCN1CC(N(C(C1)C)CC(Cc1ccccc1)O)C)=O	0.095
c1(c(cc(cc1F)c1c(c(cnc1)c1ccc(cc1)N1CC(N(C(C1)C)C)C)C)OC)C(N)=O	18.8
c12ccncc1n(cc2c1ccncc1)CC(C)C	30
c12ccncc1n(cc2c1ccncc1)CC1CC1	15.5
c12ccncc1n(cc2c1ccncc1)Cc1ccccc1	5.7
c12ccncc1n(cc2c1ccnc(c1)N)c1ccccc1	0.59
c12ccncc1n(cc2c1ccnc(c1)NC(=O)C1CC1)c1ccccc1	0.13
c12ccncc1n(cc2c1ccnc(c1)NC(=O)NC1CC1)c1ccccc1	1.2
c12ccncc1n(cc2c1ccnc(c1)NC(=O)NC1CC1)C1CCOCC1	4.6
c12ccncc1n(cc2c1ccnc(c1)NC(=O)N1CC(C1)(C)C)C1CCOCC1	3.8
c12ccncc1n(cc2c1ccnc(c1)NC(=O)N1CCOCC1)C1CCOCC1	11
c12ccncc1n(cc2c1ccnc(c1)NC(=O)N1CC(OC(C1)C)C)C1CCOCC1	24
c12c(c(cc(c2cccc1)C)[Br])NC=1NCCN1	7.1
c1(c(c2c(c(c1)C)[nH]cc2)NC=1NCCN1)[Br]	24
c1(c(c2c(c(c1)C)[nH]cc2)CC=1NCCN1)C	7.2
c1(c(c2c(c(c1)C)[nH]cc2)CN1C(COCC1)c1ccccc1)C	2.3
c1(c(c2c(c(c1)C)[nH]cc2)CN1[C@H](C[C@H](CC1)OC)O)C	14
n1c(ncc(c1c1c[nH]c2c1cccc2NC([C@@H](N1CCN(CC1)C)C)=O)C)Nc1cccnc1F	10
n1c(ncc(c1c1c[nH]c2c1cccc2NC([C@@H](N1CCN(CC1)C)C)=O)[Cl])Nc1cn(nc1OC)C	22
n1c(ncc(c1c1c[nH]c2c1cccc2NC([C@@H](N1CCN(CC1)C)C)=O)[Br])Nc1cn(nc1OC)C	15
c12cc(ccc1[nH]nc2C(NCC1CCN(CC1)CCOC)=O)c1c(c(ccc1)F)F	0.044
c12cc(ccc1[nH]nc2C(NCC1CCOCC1)=O)c1c(c(ccc1)F)F	4.1
c12cc(ccc1[nH]nc2C(NCC1COCCC1)=O)c1c(c(ccc1)F)F	22.3
c12cc(ccc1[nH]nc2C(NCC1COCC1)=O)c1c(c(ccc1)F)F	4.3
c12cc(ccc1[nH]nc2C(NCC1OCCC1)=O)c1c(c(ccc1)F)F	11
c12cc(ccc1[nH]nc2C(NC1CCOCC1)=O)c1c(c(ccc1)F)F	1.8
c12cc(ccc1[nH]nc2C(NC1COCCC1)=O)c1c(c(ccc1)F)F	6.6
c12cc(ccc1[nH]nc2C(NC1COCC1)=O)c1c(c(ccc1)F)F	13.3
c12cc(ccc1[nH]nc2C(NC1CCS(CC1)(=O)=O)=O)c1c(c(ccc1)F)F	2.1
c12cc(ccc1[nH]nc2C(NC1CS(CC1)(=O)=O)=O)c1c(c(ccc1)F)F	14.5
c12cc(ccc1[nH]nc2C(NCC1CCOCC1)=O)c1cnccc1	49.3
c12cc(ccc1[nH]nc2C(NCC1CCOCC1)=O)c1cncc(c1)OC(C)C	0.86
c12cc(ccc1[nH]nc2C(NCC1CCOCC1)=O)c1cncc(c1)OC	5.7
c12cc(ccc1[nH]nc2C(NCC1CCOCC1)=O)c1cnccc1COC	47.1
c12cc(ccc1[nH]nc2C(NCC1CCOCC1)=O)c1cnccc1CO	41.3
c12nc(ccc2ncc(c1CCC1(CC2OCC(C2O1)NCc1cc2OCCOc2cn1)O)F)OC	66
c12nc(ccc2ncc(c1CCC1(CC2OCC(C2O1)NCc1nc2NC(COc2cc1)=O)O)F)OC	12
c12nc(ccc2ncc(c1CCC1(CC2OCC(C2O1)NCc1cc2OCCOc2cc1)O)F)OC	20
c12nc(ccc2ncc(c1CCC1(CC2OCC(C2O1)NCc1ccc(cc1)C)O)F)OC	4.2
c12nc(ccc2ncc(c1CCC1(CC2OCC(C2O1)NCc1cc(c(cc1)[Cl])[Cl])O)F)OC	6.1
c12nc(ccc2ncc(c1CCC1OCC(CO1)NCc1nc2NC(COc2cc1)=O)F)OC	1.4
c12nc(ccc2ncc(c1CC[C@@]1(CC[C@H](CC1)NCc1cc2OCCOc2cc1)O)F)OC	2.3
c12nc(ccc2ncc(c1CC[C@@]1(CC[C@H](CC1)NCc1cc(c(cc1)[Cl])[Cl])O)F)OC	8.8
n1c(cnc(c1)OCC#C)C(=O)Nc1cc(c(c(c1)F)F)[C@]1(N=C(S[C@@]2([C@H]1C2)COC)N)C	6.9
c1c(c(cc(c1)C1CC1)F)C(Nc1cc(cc(c1C)c1c(c(ncn1)N)OC[C@@H]1CCCN1C(=O)C=C)F)=O	0.049
c1c(c(cc(c1)C1CC1)F)C(Nc1cc(cc(c1C)c1c(c(ncn1)N)OCCN(C)C(=O)C=C)F)=O	1.4
c1c(c(cc(c1)C1CC1)F)C(Nc1cc(cc(c1C)c1c(c(ncn1)N)OCCN(C)C(=O)CC)F)=O	2.9
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	0.4
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)CC)=O	0.4
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)CCC)=O	1.2
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)COC)=O	1.9
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)CO)=O	1.1
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)COCCCC)=O	0.1
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)CC(OC)=O)=O	0.2
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)(C)C)=O	0.1
c1(ccccc1)N1C(C3(OC2(C1)CCN(CC2)CCc1ccccc1)CC3)=O	1.2
c1(c(cccc1)[Cl])N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	1
c1(c(cccc1)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	1.2
c1(cc(ccc1)OC)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	1
c1(cnccn1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	0.1
c1(cccc(n1)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	1.2
c1(cccc(n1)C(F)(F)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	8.2
c1(c(ccnc1)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	1.1
c1(ccc(nc1)C(F)(F)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	3.3
c1(c(nccc1)C(F)(F)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	3.8
c1(cncc(c1)C(F)(F)F)N1C(C(OC2(C1)CCN(CC2)CCc1ccccc1)C)=O	0.5
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1c(cccc1)F)C)=O	0.8
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1cc(ccc1)F)C)=O	0.6
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccc(cc1)F)C)=O	0.1
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccc(cc1)C#N)C)=O	0.6
c1(ccccc1)N1C(C(OC2(C1)CCN(CC2)CCc1ccccn1)C)=O	2
c1(c(ccnc1)C(F)(F)F)N1C([C@H](OC2(C1)CCN(CC2)CCc1c(cccc1)F)C)=O	6.3
c1(c(cccn1)C(F)(F)F)N1C([C@H](OC2(C1)CCN(CC2)CCc1c(cccc1)F)C)=O	6.6
c1cc(ccc1c1cc2ncn(c2cc1)c1ccc(cc1)C(=O)Nc1cc(on1)C(C)(C)C)S(C)(=O)=O	7.57
C1(N(C(C2C1C2(C)C)=O)Cc1cc2nccc(c2s1)c1c(c(cc(c1)[Cl])C)O[C@H]1[C@H](CNCC1)C)=O	0.4
C1(N(C(CC1)=O)Cc1cc2nccc(c2s1)c1c(c(cc(c1)[Cl])C)CN1[C@H](CNC[C@H]1C)C)=O	2.7
C1(N(C(C2C1C2)=O)Cc1cc2nccc(c2s1)c1c(c(cc(c1)[Cl])C)C[C@@H]1CNCCO1)=O	8
C1(N(C(C2C1C2(C)C)=O)Cc1cc2nccc(c2s1)c1c(c(cc(c1)[Cl])C)C[C@@H]1CNCCO1)=O	4.2
c1cc(ccc1c1cc2ncn(c2cc1)c1ccc(cc1)CC(Nc1cc(on1)C(C)(C)C)=O)S(=O)(=O)C	7.57
n1(c(ccn1)C1C(CCCC1)Oc1cc(c(cc1F)S(Nc1ncsc1)(=O)=O)F)C	94
n1(c(ccn1)C1CCCCCC1Oc1cc(c(c(c1)F)S(Nc1ccncn1)(=O)=O)F)C	96
n1(c(ccn1)C1CCCCC1Oc1cc(c(cc1C)S(Nc1ccncn1)(=O)=O)F)C	90
n1c(ncc(c1c1c(cc(cc1)F)OC)F)Nc1ccc2c(c1)OC(C(=C2N1CCOCC1)C(C)=O)=O	10.08
c12C(NC=Cc1c(cn2C)c1cc2n(ccc2c(c1)NS(CC)(=O)=O)C(C)(c1ccccn1)c1ncccc1)=O	29.2
c1(ccc(cc1)[Cl])C(NC=1N(C(c2c(N1)n(nc2)C(C)(C)C)=O)Cc1ccc(cc1)F)C	11
c12nc(cc(c2ccnc1c1cc[nH]n1)c1ccc(cc1)S(C)(=O)=O)N1CCOCC1	5.8
C=1C(N(c2c(C1)cc(c(c2C)N1CC(CC1)C(C)N)F)C1CC1)=O	49
n12C(=CN=Cc1nnc2c1ccc(cc1)OC(F)F)OCCc1ccccc1	7.4
C12C3C4C1C1C2C3(C41)CCOC=1n2c(nnc2C=NC1)c1ccc(cc1)OC(F)F	4.26
c1(cc(cc(c1)C(C)(C)C#N)C(C)(C)C#N)Nc1ccnc(n1)N1C[C@H](CCC1)N	7.1
c1(cc(nc(c1)C(C)C)C(C)C)Nc1ccnc(n1)N1C[C@H](CCC1)N	3.7
c1(cc(cc(c1)C(C)C)c1ccc2c(c1)[C@@H](CO2)N)COc1ccccc1CC(O)=O	24
c1cc(ccc1c1cc2cc(cc(c2cc1)c1ccc(cc1)C12CCN(CC1)CC2)C(O)=O)C(F)(F)F	16.4
c1(cc(cc(c1)c1ccc(cc1)C12CCN(CC1)CC2)C(O)=O)n1cc(nn1)c1ccc(cc1)C(F)(F)F	16.8
C3C1CN(CC(C1Nc1nc2C(=CC=Cn2n1)OCC(F)(F)F)C3)c1snc(c1)C	2.9
C3C1CN(CC(C1Nc1nc2C(=CC=C(n2n1)C(F)(F)F)OCC(F)(F)F)C3)c1onc(n1)C	8.75
C3C1CN(CC(C1Nc1nc2C(=CC=C(n2n1)C(F)(F)F)OCC(F)F)C3)c1cc(ncn1)C	4.5
c1(c(c(cnc1)c1ccc(cc1)N1CCNCC1)C)c1cc(c(c(c1)OC)OC)OC	8.3
c1(c(c(cnc1)c1ccc(cc1)N1CCN(CC1)C(C)C)C)c1cc(c(c(c1)OC)OC)OC	3.1
c1(c(c(cnc1)c1ccc(cc1)N1CC(NC(C1)C)C)C)c1cc(c(c(c1)OC)OC)OC	5.9
c1(c(c(cnc1)c1ccc(cc1)C1CCN(CC1)C)C)c1cc(c(c(c1)OC)OC)OC	4.8
c1(c(c(cnc1)c1ccc(cc1)C1=CCNCC1)C)c1cc(c(c(c1)OC)OC)OC	3.4
c1(c(c(cnc1)c1ccc(cc1)OC1CCNCC1)C)c1cc(c(c(c1)OC)OC)OC	8.1
c1(c(c(cnc1)c1ccc(cc1)N1CCNCC1)[Cl])c1cc(c(c(c1)OC)OC)OC	2.7
c1(c(c(cnc1)c1ccc(cc1)N1CCNCC1)C#N)c1cc(c(c(c1)OC)OC)OC	6
c1(c(c(cnc1)c1ccc(cc1)N1CCNCC1)C)c1cc(c(c(c1)OC)F)OC	2.5
c1ccc2c(c1OC)C(N1CCc3c(C1N2C)[nH]c1cc(ccc31)OC)=O	20
c1(c(cc(cn1)C#CCOc1ccc(cc1)[Cl])O)C(NCC(=O)O)=O	30
c12c(ccnc1[nH]c(n2)c1c2ccn(c2ccc1)C)n1nc(c(c1)CN(C)C)C	2.6
c12c(ccnc1[nH]c(n2)c1c2ccn(c2ccc1)C)n1ncc(c1)N[C@@H]1CCOC[C@H]1N	9.2
n1c(nccc1n1ncc(c1)CN(C)C)NC1=Cc2c(nc(n2C=C1)C)C(=O)NC	7.1
n1c(nccc1n1ncc(c1)N[C@@H]1CCOC[C@H]1N)Nc1cc2c(nn(c2cc1)C)C(=O)NC	15
n1c(nccc1n1nc(c(c1)N[C@@H]1CCOC[C@H]1N)C)Nc1cc2c(nn(c2cc1)C)C(=O)NC	17
n1c(nccc1n1nc(c(c1)NCC1(N)CC1)C)NC1=Cc2c(nc(n2C=C1)C)C(=O)NC	11
n1c(nccc1n1ncc(c1)N[C@@H]1CCOC[C@H]1N)Nc1cc2c(cn(c2cc1)C)C(=O)C(F)(F)F	4.7
n1c(nccc1n1nc(c(c1)N[C@@H]1CCOC[C@H]1N)C)Nc1cc2c(cn(c2cc1)C)c1nnc(o1)C	11
n1c(nccc1n1nc(c(c1)OC1CNCC1)C)Nc1cc2c(nn(c2cc1)C)C(=O)NC	5.2
n1c(nccc1n1nc(c(c1)OC1CNCCC1)C)Nc1cc2c(nn(c2cc1)C)C(=O)NC	2.5
n1c(nccc1n1nc(c(c1)NC1CNCC1F)C)Nc1cc2c(nn(c2cc1)C)C(=O)NC	19
n1c(nccc1n1nc(c(c1)OC1CNCC1F)C)Nc1cc2c(nn(c2cc1)C)C(=O)NC	3.9
n1c(nccc1n1nc(c(c1)CN1CC(C1)O)C)Nc1cc2c(cc1)n(nc2C(NC)=O)C	12
n1c(nccc1n1nc(c(c1)CN(C)C)C)Nc1cc2c(cc1)n(nc2C(NC)=O)C	3
n1c(nccc1n1ncc(c1)CN(C)C)Nc1cc2c(cc1)n(nc2C(NC)=O)C	4.5
n1c(nccc1n1ncc(c1)[C@H]1N(C[C@H](C1)O)C)NC1=Cc2n(C=C1)c(nc2C(NC)=O)C	12
n1c(nccc1n1ncc(c1)[C@H]1N(C[C@H](C1)F)C)NC1=Cc2n(C=C1)c(nc2C(NC)=O)C	10
n1c(nccc1n1ncc(c1)CN(C)C)Nc1cc2c(c(c1)C)n(nc2C(NC)=O)C	4.9
n1c(nccc1n1ncc(c1)CN(C)C)NC1=Cc2n(C=C1)cnc2C(NC)=O	7.3
n1c(nccc1n1nc(c(c1)CN(C)C)F)Nc1cc2c(cc1)n(nc2C(NC)=O)C	11
n1c(nccc1n1nc(c(c1)CN(C)C)OC)Nc1cc2c(cc1)n(nc2C(NC)=O)C	3.6
n1c(nccc1c1nn(c(c1)CN(C)C)C)Nc1cc2c(c(c1)C)n(nc2C(OC)=O)C	23
n1c(nccc1c1nn(c(c1)CN(C)C)C)Nc1cc2c(cc1)n(nc2c1nnc(o1)C)C	2.2
c12ccc(cc1onc2C1CCN(CC1)CCCOc1ccc(cc1)NC(=O)C)F	2.98
C(Oc1ccc(cc1)NC(=O)C)CCCN1CCC(CC1)c2c1ccc(cc1on2)F	0.37
c12cc(ccc2[C@]2([C@@H](CC1)N(CC2)C([C@H]1[C@H](CC(CC1)C(O)=O)C)=O)S(=O)(=O)c1ccccc1)C(C(F)(F)F)(C(F)(F)F)F	18
c1c(cc(cc1O)F)N1C(c2c(c(cnc2N=C1)c1cc(cc(c1)C)[Cl])CN(CC1CCCN1)C)=O	3.2
C1C(C1)S(=O)(=O)c1ccc(cc1)\C(C(=O)Nc1nccs1)=N/N1CCCC1	17.5
C1C(C1)S(=O)(=O)c1ccc(cc1)\C(C(=O)Nc1ncc(s1)[Cl])=N/N1CCCC1	16.7
C1C(C1)S(=O)(=O)c1ccc(cc1)\C(C(=O)Nc1ncns1)=N/N1CCCC1	5.3
C1C(C1)S(=O)(=O)c1ccc(cc1)\C(C(=O)Nc1ncc(s1)CN1CCN(CC1)C)=N/N1CCCC1	16.9
c12cc(ccc1n1c(CC2)nnc1C1CCC(CC1)c1cc(on1)C)[Cl]	7.6
c12cc(ccc1n1c(CC2)nnc1C1CCC(CC1)Oc1ncccc1)[Cl]	7.2
c12cc(ccc1n1c(nnc1C1CCC(CC1)Oc1ncccc1)CCC2)[Br]	14
n12C=CC=Cc1c(nc2Cc1ccccc1F)c1nc(c(c(n1)N)N(C(=O)OC)C)N	0.4
n12N=CC=Cc1c(nc2Cc1ccccc1F)c1nc(c(c(n1)N)N(C(=O)OC)C)N	16.1
c12cc(ccc1n(nc2Cc1ccccc1F)c1nc(c(c(n1)N)N(C(=O)OC)C)N)[Cl]	6.3
c12cc(ccc1n(nc2Cc1ccccc1F)c1nc(c(c(n1)N)N(C(=O)OC)C)N)F	15.1
c12cc(ccc1n(nc2Cc1ccccc1F)c1nc(c(c(n1)N)N(C(=O)OC)C)N)C#N	7.4
c12ccccc1n(nc2Cc1ccccc1[Cl])c1nc(c(c(n1)N)N(C(=O)OC)C)N	10.9
c12ccccc1n(nc2Cc1cccc(c1F)F)c1nc(c(c(n1)N)N(C(=O)OC)C)N	7.2
c12ccccc1n(nc2Cc1cc(ccc1F)F)c1nc(c(c(n1)N)N(C(=O)OC)C)N	3.4
c12ccccc1n(nc2Cc1cc(cc(c1F)F)F)c1nc(c(c(n1)N)N(C(=O)OC)C)N	28
c12cc(ccc1n(nc2Cc1c(ccc(c1F)F)F)c1nc(c(c(n1)N)N(C(=O)OC)C)N)[Cl]	3.9
c12ccccc1n(nc2Cc1ccccc1F)c1nc(c2c(n1)NC(C2(C)C)=O)N	4.9
c12cc(ccc1n(nc2Cc1ccccc1F)c1nc(c2c(n1)NC(C2(C)C)=O)N)[Cl]	1.5
c12ccccc1n(nc2Cc1c(ccc(c1F)F)F)c1nc(c2c(n1)NC(C2(C)C)=O)N	2
c12cc(ccc1n(nc2Cc1c(ccc(c1F)F)F)c1nc(c2c(n1)NC(C2(C)C)=O)N)[Cl]	1.4
c12cc(ccc1n(nc2CCC)c1nc(c2c(n1)NC(C2(C)C)=O)N)[Cl]	9.6
c12cc(ccc1n(nc2CCCC)c1nc(c2c(n1)NC(C2(C)C)=O)N)[Cl]	12.3
c12cc(ccc1n(nc2CCCCC)c1nc(c2c(n1)NC(C2(C)C)=O)N)[Cl]	9
c12cc(ccc1n(nc2CCCC(F)(F)F)c1nc(c2c(n1)NC(C2(C)C)=O)N)[Cl]	4.1
c12cc(c(cc1C(N(C=N2)c1cc(cc(c1)[Cl])C)C(=O)N(CC1CCCN1)C)c1cc(cc(c1)C#N)F)C	1.58
c12cc(c(cc1C(N(C=N2)c1cc(cc(c1)[Cl])C)C(=O)N(CC1CCCN1)C)c1cc(cc(c1)O)F)C	0.63
c12cc(c(cc1C(N(C=N2)c1cc(cc(c1)[Cl])C)C(=O)N(CC1CCCN1)C)c1c(ccc(c1)O)F)C	0.5
c12cc(c(cc1C(N(C=N2)c1cc(cc(c1)[Cl])C)C(=O)N(CC1CCCN1)C)c1c(c(ccc1)F)O)C	5
c12cc(c(cc1C(N(C=N2)c1cc(cc(c1)[Cl])C)C(=O)N(CC1CCCN1)C)c1cc(cc(c1)C(=O)N)F)C	2.51
c12c(cccc1[nH]c(n2)c1c2c(ccc1)n(cc2)C)n1nc(c(c1)CN(C)C)C	2.6
c12c(cccc1[nH]c(n2)c1c2c(ccc1)n(cc2)C)c1nn(c(c1)CN(C)C)C	13
c12c(cccc1[nH]c(n2)c1c2c(ccc1)n(cc2)C)n1ncc(c1)CN(C)C	16
c12c(cccc1[nH]c(n2)c1c2c(ccc1)n(cc2)C)n1ncc(c1)CN1C[C@H](CC1)O	27
c12c(cccc1[nH]c(n2)c1c2c(ccc1)n(cc2)C)n1nc(c(c1)N[C@H]1[C@H](COCC1)N)C	9.2
c1(c2c(ccc1)scc2)N1CCN(CC1)CCCCN1C(N2C=CC=CC2=N1)=O	3.01
c1(c2c(ccc1)scc2)N1CCN(CC1)CCCCN1C(N2C=C(C=CC2=N1)F)=O	2.2
c1(c2c(ccc1)scc2)N1CCN(CC1)CCCCN1C(N2C(=CC=CC2=N1)C#N)=O	1.05
c1(c(c(ccc1S(=O)(=O)C)O[C@@H](C)C(F)(F)F)C(=O)N1CC(C1)c1ccc(cc1)C(F)(F)F)OC	2.4
c1c(c(ccc1S(=O)(=O)C)O[C@@H](C)C(F)(F)F)C(=O)N1CC(C1)c1ccc(cc1)C(F)(F)F	5.9
c1(c(c(ccc1S(=O)(=O)C)O[C@@H](C)C(F)(F)F)C(=O)N1CC(C1)c1ccccc1)OC	6.8
c12c(c(c(cc1n(cn2)CC1CC1)c1ncc(cc1)c1cn(cn1)C)F)C	11
N1=C(C(N(C=C1)c1c(ccc(c1)C(=O)NC1CC1)C)=O)NC(C)(C)c1c(cccc1)OCCNC	27
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)C	0.8
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)CC	1.1
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)OC	1.5
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)OCC	0.9
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)OC(F)(F)F	1.9
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)F	1.2
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)[Cl]	0.9
c12Nc3ccc(cc3C(=Nc1cc(cc2)[Cl])C=1CCN([C@H](C1)C)C)C#N	0.6
c12Nc3ccc(cc3C(=Nc1cc(cc2)C)C=1CCN([C@H](C1)C)C)F	1.6
c12Nc3ccc(cc3C(=Nc1cc(cc2)C)C=1CCN([C@H](C1)C)C)[Cl]	1.1
c12Nc3ccc(cc3C(=Nc1cccc2)C=1CCN([C@H](C1)C)C)CC	0.6
c12Nc3ccc(cc3C(=Nc1cccc2)C=1CCN([C@H](C1)C)C)[Cl]	0.6
O1C2(CN(C(C1C)=O)Cc1ccccc1)CCN(CC2)CCc1ccccc1	0.1
O1C2(CN(C(C1C)=O)CCc1ccccc1)CCN(CC2)CCc1ccccc1	0.2
O1C2(CN(C(C1C)=O)C1CC1)CCN(CC2)CCc1ccccc1	4.5
O1C2(CN(C(C1C)=O)C(C)C)CCN(CC2)CCc1ccccc1	3.9
O1C2(CN(C(C1C)=O)CC)CCN(CC2)CCc1ccccc1	3.1
O1C2(CN(C(C1CC)=O)C)CCN(CC2)CCc1ccccc1	6.6
O1C2(CN(C(C1C(C)C)=O)C)CCN(CC2)CCc1ccccc1	6.2
O1C2(CN(C(C1C1CC1)=O)C)CCN(CC2)CCc1ccccc1	3.1
O1C2(CN(C([C@H]1C)=O)CC)CCN(CC2)CCc1c(cccc1)F	4
O1C2(CN(C([C@H]1C)=O)CC)CCN(CC2)CCc1cc(ccc1)F	6.6
O1C2(CN(C([C@H]1C)=O)CC)CCN(CC2)CCc1ccc(cc1)F	1.5
O1C2(CN(C([C@H]1C)=O)CC)CCN(CC2)CCc1c(ccc(c1)F)F	2.5
c1c(ccc(c1F)C#N)C=1N=C(N(C(C1c1ccc(c(c1)F)OC)=O)C)CN1CCC(CC1)N	3.4
c1(ccccc1[Cl])CNC(c1cc2C3(C(N(c2cc1)S(c1ccc(cc1)F)(=O)=O)C)CCNCC3)=O	1.1
C12C3C4C1C1C2C3(C41)COC=1n2c(nnc2C=NC1)c1ccc(cc1)OC(F)F	4.3
c12C(N(C(=Nc2cccc1F)C(CC)n1c2ncnc(c2c(n1)c1ccc(c(c1)F)OC)N)C1CC1)=O	13.8
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCC(CN(C)C)(C)O)C#N)C=O)CO	25
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)OCC1CCN(CC1)C)C#N)C=O)C(F)F	10
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)OCC(C)(CN(C)C)C)C#N)C=O)C(F)F	12
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)C1CCN(CC1)C1COC1	28
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)C1CCN(CC1)CC(F)(F)F	0.6
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)N(C(CN(C)C)=O)C	6.8
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)N(C(C)=O)CCN(C)C	11
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)N(S(C)(=O)=O)CCN(C)C	20
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)N1CCN(C(C1)=O)C	22
c12cc(c(nc1N(CCC2)C(=O)Nc1ncc(c(c1)NCCOC)C#N)C=O)N1CC(NC(C1)C)C	13
n1n(c(cc1COCCN1CCCC1)C)c1cc(c(cc1)[Cl])[Cl]	5.1
N1(CCN(CC1)C(C)=O)CCCOCc1nn(c(c1)C)c1cc(c(cc1)[Cl])[Cl]	4.1
c1c(c(c(cc1)[Cl])[Cl])c1c(nc(cn1)N1CCC(CC1)(C)N)N	5.9
c1(c(nc(cn1)N1CCC(CC1)(C)N)N)Sc1cccc(c1[Cl])[Cl]	2.8
c1(c(nc(cn1)N1CCC(CC1)(C)N)N)Sc1ccccc1[Cl]	6.1
c1(c(nc(cn1)N1CCC(CC1)(C)N)N)Sc1cccnc1C(F)(F)F	17.4
c1(c(nc(cn1)N1CCC(CC1)(C)CN)N)Sc1cccc(c1[Cl])[Cl]	2.4
c1(cccc(c1[Cl])[Cl])c1c(nc(cn1)N1CCC(CC1)(C)CN)N	1.7
c1(c(nc(cn1)N1CCC(CC1)(C)CN)N)Sc1cccnc1C(F)(F)F	12.4
c1(c(nc(cn1)N1CCC2(CC1)[C@H](CCC2)N)N)Sc1cccnc1C(F)(F)F	6
c1(cnc(cn1)N1CCC2(CC1)[C@H](CCC2)N)Sc1ccnc(c1[Cl])N	11.7
c12cc(ccc2ncc(c1N(C)C1CCCNC1)NC(=O)Nc1cc(c(nc1)OC)[Cl])F	9
c12cc(ccc2ncc(c1N1[C@H](COCC1)C)NC(=O)Nc1cc(c(nc1)OC1CCN(CC1)C)[Cl])F	16
c1c(nc(cc1)C(F)(F)F)C(Nc1cc2cn(nc2c(c1)C(O)(C)C)CCN(C)C)=O	16.5
c1c(nc(cc1)C(F)(F)F)C(Nc1cc2cn(nc2c(c1)OC)C1CCN(CC1)C)=O	6.9
c12C(N(CCc2ccc(c1)OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C)=O	2.3
c12C(N(C=Cc2ccc(c1)OCCCN1CCC(CC1)c1noc2c1ccc(c2)F)C)=O	0.51
N1([C@H](Cc2c([C@H]1c1ccc(cn1)NC1CN(C1)CCCF)ccc1c2cn[nH]1)C)CC1(CC1)F	9.1
N1([C@H](Cc2c([C@H]1c1ccc(cn1)NC1CN(C1)CCCF)ccc1c2cc[nH]1)C)CC(F)(F)F	13
N1([C@H](Cc2c([C@H]1c1ccc(cn1)N(C1CN(C1)CCCF)C)ccc1c2cn[nH]1)C)CC(F)(F)F	7.7
N1([C@H](Cc2c([C@H]1c1ccc(cn1)NC1CCN(C1)CCCF)ccc1c2cn[nH]1)C)CC(F)(F)F	13
N1([C@H](Cc2c([C@H]1c1ccc(cn1)NC1CN(C1)CCCF)ccc1c2cn[nH]1)C)CC(F)(F)F	22
c1(cc(c(cc1)C(CCC(=O)NC1CCN(CC1)C1CCCCC1)=O)F)F	4.7
C1(CCCCC1)N1CCC(CC1)NC(=O)c1noc(c1)c1c(cc(cc1)F)F	1.5
C1(CCCCC1)N1CCC(C(C1)C(=O)NC(c1ccccn1)C)NC(=O)c1noc(c1)c1c(cc(cc1)F)F	3.4
C1(CCCCC1)N1CCC(C(C1)C(=O)NC(c1ccccc1)CO)NC(=O)c1noc(c1)c1c(cc(cc1)F)F	7.2
C1(CCCCC1)N1CCC(C(C1)C(=O)NCCc1ccccn1)NC(=O)c1noc(c1)c1c(cc(cc1)F)F	0.96
C1(CCCCC1)N1CCC(C(C1)C(=O)NC(c1ccccn1)(C)C)NC(=O)c1noc(c1)c1c(cc(cc1)F)F	1.5
C1(CCCCC1)N1CCC(C(C1)C(=O)NC2(c1ncccn1)CC2)NC(=O)c1noc(c1)c1c(cc(cc1)F)F	2.6
N1(CCC(C(C1)C(=O)NC2(c1ncccn1)CC2)NC(=O)c1noc(c1)c1c(cc(cc1)F)F)CCC	4.5
N1(CCC(C(C1)C(=O)NC2(c1ncccn1)CC2)NC(=O)c1noc(c1)c1c(cc(cc1)F)F)CC1CC1	5.7
N1(CCC(C(C1)C(=O)NC2(c1ncccn1)CC2)NC(=O)c1noc(c1)c1c(cc(cc1)F)F)CC1CCC1	1.4
N1(CCC(C(C1)C(=O)NC2(c1ncccn1)CC2)NC(=O)c1noc(c1)c1c(cc(cc1)F)F)C1CCCC1	9.6
N1(CCC(C(C1)C(=O)NC2(c1ncccn1)CC2)NC(=O)c1noc(c1)c1c(cc(cc1)F)F)CC1(CC1)C	11
c12ccc(cc1C(N(C=N2)CC(C)C(NC)=O)=O)c1cc(c(nc1)OC)NS(c1c(cc(cc1)F)[Cl])(=O)=O	27.5
c12ccccc1CN(C(CO2)c1ccc(cc1)[Cl])C1CCN(CC1)c1nc([nH]n1)N	23
C(Oc1cc(ncc1)C(n1c2nc(nc(c2nc1)N)[Cl])C)C(F)F	18
c12nc(c(cc2nc(c(c1N[C@H](c1c(ccc(c1)C#N)F)C)[Cl])C)F)c1cnc(nc1)C(C)(C)O	5.6
c1(ccccc1)[C@H]1C[C@H]1NCC1CCN(CC1)CCCc1ccc(cc1)C(NO)=O	5.6
CN(C)C(=O)NC1CCC(CC1)CCN1CC(c2c(CC1)ccc(c2)[Cl])C	1.23
c1c(nc(cc1)C(F)(F)F)C(Nc1cc2cn(nc2cc1C(C)(C)O)CCN(C)C)=O	16.5
c12c(nccc1[nH]c(n2)c1cc(c(cc1)F)F)N1CCCN(CC1)C	0.4
c12c(nccc1[nH]c(n2)c1cc(c(cc1)F)F)N1CCC(CC1)C(=O)N1CCN(CC1)C	12
c12c(nccc1[nH]c(n2)c1cc(c(cc1)F)F)N1CCC(CC1)CN1CCOCC1	2
c12c(nccc1[nH]c(c2)c1cc(cc(c1)F)F)N1CCC(CC1)CN1CCN(CC1)C	5
c12c(nccc1[nH]c(n2)c1cc(c(cc1)F)F)N1CCN(CC1)C	3
c12c(nccc1[nH]c(c2)c1cc(c(cc1)F)F)N1CCC(CC1)CN1CCN(CC1)C	9
c12c(nccc1[nH]c(c2)c1cc(c(cc1)F)F)N1CCC(CC1)C(=O)N1CCN(CC1)C	3
c12c(nccc1[nH]c(n2)c1cc(cc(c1)F)F)N1CCCN(CC1)C	0.4
c12c(nccc1[nH]c(c2)c1cc(cc(c1)F)F)N1CCC(CC1)N1CCN(CC1)C	4
c12c(nccc1[nH]c(c2)c1cc(cc(c1)F)F)N1CCC2(CC1)OCCN(C2)C	2
c12c(nccc1[nH]c(c2)c1cc(cc(c1)F)F)N1CCC(CC1)CN1CCOCC1	2
c12c(nccc1[nH]c(n2)c1cc(cc(c1)F)F)N1CCC(CC1)CN1CCN(CC1)CC(F)(F)F	3
c12c(nccc1[nH]c(n2)c1cc(cc(c1)F)F)N1CCC(CC1)CN1CCN(CC1)c1nccn1C	12
N12CCC/C(C1=NO[C@H]([C@H]2C)c1cc(cc(c1)F)F)=C\c1ccc(c(c1)OC)n1cnc(c1)C	2.01
N12CCC/C(C1=NO[C@H]([C@H]2C)c1cc(c(c(c1)F)F)F)=C\c1ccc(c(c1)OC)n1cnc(c1)C	1.61
c1(ccc(c(c1)OC)n1cnc(c1)C)C1=CC2=NO[C@H](CN2CCC1)c1cc(c(c(c1)F)F)F	3.35
c1(ccc(c(c1)OC)n1cnc(c1)C)C1=CC2=NOCC(N2CCC1)c1cc(c(c(c1)F)F)F	2.61
c1(c(c(ncn1)C1CC1)c1nc2C(C(C(=Nc2cn1)NCc1ccc(cn1)S(=O)(=O)C)=O)[C@H](C1CC1)C)C	16
c1(c(ncnc1OC)C1CC1)c1nc2N(C(C(=Nc2cn1)NCc1ccc(cn1)S(CC)(=O)=O)=O)C(C)C	13
c1(c(ncnc1OC)C1CC1)c1nc2N(C(C(=Nc2cn1)NCc1ccc(cn1)S(CC)(=O)=O)=O)C(C)C1CC1	4.4
c1(c(ncnc1OC)C1CC1)c1nc2N(C(C(=Nc2cn1)NCc1ccc(cn1)S(CC)(=O)=O)=O)[C@@H](C)C(F)(F)F	4.7
c1cnc(cc1c1nc(on1)[C@H](NC(c1n(nc(c1)C(F)(F)F)C)=O)C)C(F)(F)F	11.9
c12cc(ccc1C(OC2(C)C)=O)Nc1ncc(c(n1)C[C@H](CO)c1ccccc1)c1nc(no1)C1CCN(CC1)C	2.5
c12cc(ccc1C(OC2(C)C)=O)Nc1ncc(c(n1)C[C@H](CO)c1ccccc1)c1nc(no1)C12CCN(CC1)CC2	0.57
NCc1sc(cn1)S(=O)(=O)c1cc2ccccc2cc1	51
NCc1sc(cn1)S(=O)(=O)c1cc(cc(c1)c1ccccc1)S(=O)(=O)C	10
NCc1sc(cn1)S(=O)(=O)c1cc(cc(c1)c1ccccc1)CC	36
NCc1sc(cn1)S(=O)(=O)c1cc(cc(c1)c1ccc(cc1)C)S(C)(=O)=O	3.2
NCc1sc(cn1)S(=O)(=O)c1cc(cc(c1)c1cnn(c1)C)CC	47
NCc1sc(cn1)S(=O)(=O)c1cc(cc(c1)c1cnn(c1)C)F	66
NCc1scc(n1)S(=O)(=O)c1cc(cc(c1)c1cnn(c1)C)CC	29
c12ccccc1C(C(=CC2=O)NCCC(C)C)=O	30
c1(nc(c2c(n1)[nH]c1c(cc(cc21)F)NC)N1CC\C(CC1)=C(\F)CN)Oc1cnc(nc1)C	18.4
c1(nc(c2c(n1)[nH]c1c(cc(cc21)F)NC)C1C/C(C1)=C(/CN)CCC)Oc1cnc(nc1)C	51.5
c1(nc(c2c(n1)[nH]c1c(cc(cc21)F)NC)C1C/C(C1)=C/C(N)CC)Oc1cnc(nc1)C1CC1	23.4
N1(CCn2c(C1=O)nc1cccc(c21)c1ccccc1)CC1CC1	14
N1(CCn2c(C1=O)nc1cccc(c21)c1cc(ccc1)F)CC1CC1	9.1
N1(CCn2c(C1=O)nc1cccc(c21)c1ccc(cc1)F)CC1CC1	9.6
N1(CCn2c(C1=O)nc1cccc(c21)c1ccc(cc1)[Cl])CC1CC1	9.5
N1(CCn2c(C1=O)nc1cccc(c21)c1ccccc1)C[Br]	15
N1(CCn2c(C1=O)nc1cccc(c21)c1ccccc1F)C[Br]	16
N1(CCn2c(C1=O)nc1cccc(c21)c1ccc(cc1)F)C[Br]	8.6
N1(CCn2c(C1=O)nc1cccc(c21)c1ccc(cc1)[Cl])C[Br]	4.7
N1(CCn2c(C1=O)nc1cccc(c21)c1ccc(cc1F)[Cl])C[Br]	5.6
N1(CCn2c(C1=O)nc1cccc(c21)c1ccc(cc1)[Cl])CC(F)(F)F	3
N1(CCn2c(C1=O)nc1cccc(c21)C1CCC1)CC(F)(F)F	25
N1(CCn2c(C1=O)nc1cccc(c21)C1CC2CCC1C2)CC(F)(F)F	3
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)CN(CC2)C1=CC(OC1)=O	90
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=CC(OC1)=O)=O	31
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)CN(C(C2)=O)C1=CC(OC1)=O	90
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=CC(CC1)=O)=O	83
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=C(C(OC1)=O)C)=O	34
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=CC(OC1C)=O)=O	19
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=C(C(OC1)=O)CC)=O	23
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=C(C(OC1)=O)[Cl])=O	33
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=C(C(OC1C)=O)C)=O	20
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(CC2)C1=C(C(CC1)=O)C)=O	22
c1c(c(c2c(c1)C(OC2)=O)C)[C@@H](O)CN1CCC2(CC1)C(N(C(C2)C)C1=C(C(OC1)=O)C)=O	18
c1(ccc(c(c1)[Cl])[Cl])CC(=O)N1CCN(CC1)C=1C=Cc2n(N1)cnn2	8
c12ccccc2cc(c(n1)OC)c1cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC	8
c12ccccc2C=C(C(N1)=O)c1cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC	28
c12ccccc2C=C(C(N1C)=O)c1cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC	11
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1cnc2c(c1)cccc2	11
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1ccc2c(c1)ccnc2	12
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1ccc2c(c1)cncc2	16
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)scn2	40
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ocn2	58
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)C=1C(NC(=CC1)c1ccccc1)=O	3
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc(cc1)c1ccncc1	6
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc(cc1)c1cnccc1	4
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc(cc1)c1cnccn1	21
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)C	43
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)CC	19
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)C1CC1	4.8
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)OC	3.3
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)N1CCCC1	28
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)c1occn1	15
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc2c(c1)ccc(n2)n1cccn1	1.2
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)cccn2)OC	51
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)OC	16
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)OC	42
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)CC1CC1)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)OC	8.4
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C1CCC1)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)OC	8.9
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C1CC1)OC	11
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1c(cc2c(c1)nccn2)OC	25
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(nc2c(c1)ccnc2)OC	26
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)F	24
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)[Cl]	10
c1(cnc([nH]1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)CC	21
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1c(nc2c(c1)ccnc2)OC	40
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)OC	34
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)OC	51
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)CC)CCCCCC(=O)CC)c1c(nc2c(c1)cccn2)OC	12
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C)F	30
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1c(cc2c(c1)ccc(n2)C1CC1)F	3.3
c1(cnc(o1)C(NC(=O)C1C2(C1)CCN(CC2)C)CCCCCC(=O)CC)c1ccc(cc1)c1cnccc1	4.1
c1(ccc(cc1[Cl])Nc1cc(nc(n1)S(=O)(=O)C)N1CCC(CC1)N)F	19.8
c12cc(cc(c2cc(c2c1CC(=CC2)C(F)(F)F)C(C\C(=N\N=C\c1ccc(cc1)F)N)O)F)F	0.07
c12cc(cc(c2cc(c2c1CC(=CC2)C(F)(F)F)C(C\C(=N\c1ccc(cc1)OC)N)O)F)F	0.19
c12cc(c(cc1CC(C2=O)CC1(CCN(CC1)CCc1ccccc1F)F)OC)OC	9.23
c12cc(c(c(c2N(C(C=C1CN)=O)C1CC1)C)N1CC2(C(C1)C2)N)F	114
c12cc(c(c(c2N(C(C(=C1)O)=O)C1CC1)C)N1CC(CC1)C(C)N)F	25
c12cc(c(c(c2N(C(C(=C1)C(O)=O)=O)C1CC1)C)N1CC(CC1)C(C)N)F	214
c12cc(c(c(c2N(C(C(=C1)C(O)=O)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	109
c12cc(c(c(c2N(C(C(=C1)C(N)=O)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	10
c12cc(c(c(c2N(C(C(=C1)C#N)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	2.7
c12cc(c(c(c2N(C(C(=C1)C=1NC(ON1)=O)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	29
c12cc(c(c(c2N(C(C(=C1)C=1OC(NN1)=O)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	10
c12cc(c(c(c2N(C(C(=C1)c1ncon1)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	12
c12cc(c(c(c2N(C(C(=C1)c1ocnn1)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	8
c12cc(c(c(c2N(C(C=C1c1cc(no1)O)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	17
c12cc(c(c(c2N(C(C=C1C1=NOC(N1)=S)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	18
c12cc(c(c(c2N(C(C=C1C1=NNC(O1)=O)=O)C1CC1)C)N1CC(CC1)C1(CC1)N)F	13
c13cc(c(c2c3N(C(C(=C1)C(O)=O)=O)C(C)CC2)N1CC(CC1)C1(CC1)N)F	297
c13c(c(c(c2c3N(C(C(=C1)C(O)=O)=O)C(CO2)C)N1CC(CC1)C1(CC1)N)F)F	211
c13c(c(c(c2c3N(C(C(=C1)C(O)=O)=O)C(CO2)C)N1CC(CC1)C1(CC1)N)[Cl])F	150
c13ccc(c2c3N(C(C(=C1)C(O)=O)=O)C(CO2)C)N1CC(CC1)C1(CC1)N	90
c13c(cc(c2c3N(C(C(=C1)C(O)=O)=O)C(CO2)C)N1CC(CC1)C1(CC1)N)F	126
c13c(cc(c2c3N(C(C(=C1)C(O)=O)=O)C(CO2)C)N1CC(CC1)C1(CC1)N)[Cl]	42
C1N(CC2(C1CNc1ccccc1)CN(C2)c1ccccc1)Cc1ccc(cc1)O	2.2
C1N(CC2(C1CNc1ccc(cc1)F)CN(C2)c1cc(cc(c1)F)F)C(C(N)c1ccc(cc1)O)=O	1.6
c1(ccc(c(c1)C#N)C(F)(F)F)C2(c1c(c([nH]c1)C(NC(c1n[nH]cn1)C)=O)C)CC2	20.4
c12cc(c(cc2OC2N(C1)C(OC2CNC(=O)C)=O)F)c1cnc(cc1)C#N	17.82
c1c(c(c(cc1\C=C\C#N)C)Oc1cc(cc2c1CSCC2)Nc1ccc(cc1)O)C	19.84
c12ccccc1[nH]c1c2C[C@H](N(C1c1c(cc(cc1F)NC1CN(C1)CCCF)F)CC(CO)(F)F)C	6.1
c12cc(ccc1[nH]c1c2C[C@H](N(C1c1c(cc(cc1F)NC1CN(C1)CCCF)F)CC(CO)(F)F)C)F	2.8
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1C)c1cc(c(cc1)F)C(F)(F)F)C#N)N	3.5
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1C)c1cc(c(cc1)F)C(F)(F)F)C(=O)N)N	1.9
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1C)c1cc(c(cc1)F)C(F)(F)F)c1ccc(cc1)F)N	1.8
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN(C)C)c1cc(c(cc1)F)C(F)(F)F)c1ccc(cc1)F)N	1.2
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)c1ccc(cc1)F)N	1.3
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCCC1)c1cc(c(cc1)F)C(F)(F)F)c1ccc(cc1)F)N	1.5
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN(C)C)c1cc(c(cc1)F)C(F)(F)F)C#N)N	1.6
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN(C)C)c1cc(c(cc1)F)C(F)(F)F)C(=O)N)N	4
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN(C)C)c1cc(c(cc1)F)C(F)(F)F)C=C)N	1.1
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN(C)C)c1cc(c(cc1)F)C(F)(F)F)CC)N	1.3
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN(C)C)c1cc(c(cc1)F)C(F)(F)F)C1CC1)N	0.83
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)[Cl])N	1.9
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)C=C)N	0.93
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)CC)N	1.6
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)C1CCC1)N	1.3
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)C#N)N	0.7
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)C(C)C)N	1.8
c1nc(c(c(n1)N1CCC(CC1)c1nc(cn1CCN1CCC1)c1cc(c(cc1)F)C(F)(F)F)C(=O)N)N	17.4
c1c(ccc(c1)C)Oc1ccc(cc1)c1nnn(n1)CCN	5.8
c1c(ccc(c1)[Cl])Oc1ccc(cc1)c1nnn(n1)CCN	8.5
c1c(ccc(c1)[Cl])Oc1ccc(cc1)c1nnn(n1)CCCN	4.8
N1(c2ccccc2SC(CC1=O)c1ccc(cc1)F)C(=O)C=C	37.5
c12cc(ccc2C2(C(CC1)C(CC2)NC(=O)C(C)(C)O)S(c1ccc(cc1)F)(=O)=O)C(C(F)(F)F)(C(F)(F)F)F	19
c1ccc2c(c1)sc(n2)C(=O)Nc1c(ccs1)C(=O)NC(=O)OCC	18.3
C(=O)(Nc1c(ccs1)C(=O)NC(=O)OCC)c1ccc(cc1)C(=O)N1CCCCC1	23.7
C(=O)(Nc1c(ccs1)C(=O)NC(=O)OCC)c1sc(cc1)C(=O)N1CCCCC1	28.3
C(=O)(Nc1c(ccs1)C(=O)NC(=O)OC)c1ccc(cc1)C(=O)N1CCCCC1	22.6
c1c(c(ccc1c1ccc(nc1)COC1CC(C1)N=C=S)OC)F	19
c1c(nc(cc1)C)C(Oc1c(cc(cc1)C(=O)NC1CC1)c1nnn(c1)C)C	40
n1c(cc(cc1Cc1c2c(ccc1)[nH]cc2)C(=O)NCC)c1nnn(c1)C	32
c12cc(ccc2c(cc(c1)C(O)=O)c1ccc(cc1)C1CCN(CC1)C(C)=O)c1ccc(cc1)C(F)(F)F	16
c1(ncc(c(n1)Oc1c(cc(cc1C)C#N)C)c1ccncc1)NC1CCN(CC1)Cc1ccc(cc1)C(N)=O	1.19
c12cc(ccc2ncc(c1C(CC1OCC(CO1)NCc1cc2OCCOc2cc1)O)F)OC	23
c12cc(ccc2ncc(c1C(CC1OCC(CO1)NCc1cc2OCCOc2cn1)O)F)OC	65
c12cc(ccc2ncc(c1C(CC1OCC(CO1)NCc1nc2NC(COc2cc1)=O)O)F)OC	8.7
c12cc(ccc2ncc(c1C(CC1OCC(CO1)NCc1nc2NC(CSc2cc1)=O)O)F)OC	6.5
c12cc(ccc2ncc(c1C(CC1OCC(CO1)NCc1cc(c(cc1)[Cl])[Cl])O)F)OC	11
c12cc(ccc2ncc(c1C(CC1OCC(CO1)NCc1ccc(cc1)C)O)F)OC	13
c12nc(ccc2ncc(c1C(CC1OCC(CO1)NCc1cc2OCCOc2cc1)O)F)OC	28
c12nc(ccc2ncc(c1C(CC1OCC(CO1)NCc1nc2NC(CSc2cc1)=O)O)F)OC	4.8
c12nc(ccc2ncc(c1C(CC1OCC(CO1)NCc1cc(c(cc1)[Cl])[Cl])O)F)OC	6.9
c12cc(ccc2N=CC(N1CC(C1OCC(CO1)NCc1cc2OCCOc2cc1)O)=O)OC	59
c12cc(ccc2N=CC(N1CC(C1OCC(CO1)NCc1cc2OCCOc2cn1)O)=O)OC	102
c12cc(ccc2N=CC(N1CC(C1OCC(CO1)NCc1nc2NC(COc2cc1)=O)O)=O)OC	84
c12cc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2OCCOc2cc1)O)F)OC	19
c12cc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2OCCOc2cn1)O)F)OC	24
c12cc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2SCCOc2nn1)O)F)OC	62
c12cc(ccc2ncc(c1CC(C1OCC(CO1)NCc1nc2NC(COc2cc1)=O)O)F)OC	9.8
c12cc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc(c(cc1)[Cl])[Cl])O)F)OC	6.6
c12nc(ccc2ccc(c1CC(C1OCC(CO1)NCc1cc2OCCOc2cc1)O)F)OC	13
c12nc(ccc2ccc(c1CC(C1OCC(CO1)NCc1cc2SCCOc2nn1)O)F)OC	84
c12nc(ccc2ccc(c1CC(C1OCC(CO1)NCc1nc2NC(COc2cc1)=O)O)F)OC	7.6
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2OCCOc2cc1)O)F)OC	18
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2OCCOc2cn1)O)F)OC	39
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2CCCOc2cn1)O)F)OC	34
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2SCCOc2nn1)O)F)OC	103
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2SCOc2cn1)O)F)OC	68
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc2OCOc2cn1)O)F)OC	150
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1nc2NC(COc2cc1)=O)O)F)OC	7.5
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1nc2NC(CSc2cc1)=O)O)F)OC	8.4
c12nc(ccc2ncc(c1CC(C1OCC(CO1)NCc1cc(c(cc1)[Cl])[Cl])O)F)OC	5.6
c12ccccc2C(=NN(C1=O)C(C(=O)O)C)Cn1cc2cc(c(cc2n1)[Cl])OCC1CC1	35.8
c1c(nc2c(n1)c(n[nH]2)c1c(c(ccc1)[Cl])[Cl])C1CCC(CC1)(C)N	0.18
c1c(nc2c(n1)c(n[nH]2)c1c(c(ncc1)NC)[Cl])N1CCC(CC1)(C)N	3.5
c1c(nc2c(n1)c(n[nH]2)c1c(c(ccc1)[Cl])[Cl])N1CCC2(CC1)CCCC2N	0.06
c1c(nc2c(n1)c(n[nH]2)c1c(c(ccc1)[Cl])[Cl])N1CCC2(CC1)COCC2N	0.1
c1c(nc2c(n1)c(n[nH]2)c1c(c(ncc1)NCC)[Cl])N1CCC2(CC1)COC(C2N)C	1.3
c1(c(nc2c(n1)c(n[nH]2)c1c(c(ccc1)[Cl])[Cl])N1CCC2(CC1)COC(C2N)C)CO	0.23
c1(c(nc2c(n1)c(n[nH]2)c1c(c(ccc1)NCCC)[Cl])N1CCC2(CC1)COC(C2N)C)CO	1.6
c12c(cc(cc2C=CN(C1=O)c1cccc(c1CO)c1c2c(nc(n1)N)[nH]c(c2)C=1CCN(CC1)C1COC1)C1CC1)F	8.54
C1C(N=C(C(C1)(S(=O)(=O)CC)C)N)(CF)c1cc(ccc1F)NC(=O)c1ncc2c(c1)OC(O2)(F)F	8.6
c12cccc(c2N=C(NC1=O)CCCN1CCC(=CC1)c1ccc(cc1)F)[Cl]	2.6
c12cccc(c2N=C(NC1=O)CCCN1CCN(CC1)c1ccc(cc1F)F)[Cl]	1.4
c12cccc(c2N=C(NC1=O)CCCN1CCN(CC1)c1ncc(n1C)C)[Cl]	1.5
C(N1CCN(CC1)c1ncc(n1C)C)c1ccc2c(c1)NC(c1c2cccc1)=O	3.9
C(N1CCN(CC1)c1ncc(n1C)C)c1ccc2c(c1)NC(c1c2nccc1)=O	11
C(N1CCN(CC1)c1ncc(n1C)C)c1ccc2c(c1)NC(C1=C2CCCC1)=O	3.8
C(N1CCN(CC1)c1ncc(n1C)C)c1ccc2c(c1)NC(C1=C2NCCC1)=O	30
C(N1CCN(CC1)c1ncc(n1C)C)c1ccc2c(c1)NC(C(=C2)CC)=O	12
C(N1CCN(CC1)c1ccc(cc1F)F)c1ccc2c(c1)NC(C(=C2)CC)=O	2.3
C(N1CCN(CC1)c1ccc(cc1)C(NC)=O)c1ccc2c(c1)NC(C(=C2)CC)=O	8.3
C(N1CCN(CC1)c1ccc(nc1)C(NC)=O)c1ccc2c(c1)NC(C(=C2)CC)=O	21
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(NC(=O)C)c1ccc(cn1)S(=O)(CC)=O)=O	16
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(NC(=O)OC)c1ccc(cn1)S(=O)(CC)=O)=O	9.3
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(NC(=O)CC1CC1)c1ccc(cn1)S(=O)(CC)=O)=O	4.1
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(NC(=O)Cc1ccccc1)c1ccc(cn1)S(=O)(CC)=O)=O	5.5
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(NC(=O)Cc1ncccc1)c1ccc(cn1)S(=O)(CC)=O)=O	34
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(NC(=O)Cc1sccn1)c1ccc(cn1)S(=O)(CC)=O)=O	16
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(CC(=O)N(C)C)c1ccc(cc1)S(=O)(CC)=O)=O	8
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C(Cn1cccn1)c1ccc(cc1)S(=O)(CC)=O)=O	2.4
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C2N(C(C)=O)Cc1c2ccc(c1)S(=O)(CC)=O)=O	34
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C2N(C(C)=O)Cc1c2ccc(c1)S(=O)(CC1CC1)=O)=O	18
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C2N(C(=O)OC)Cc1c2ccc(c1)S(=O)(C)=O)=O	14.7
c1(ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O)NC(C2N(C(=O)COC)Cc1c2ccc(c1)S(=O)(CC1CC1)=O)=O	18
c1(nc(c(cc1)n1cnc(c1)C)OC)C1=NOC(C(N1)c1ccc(cc1)[Cl])C1CC1	12
c12c(cncc2nc(c(c1)C#N)c1ccc(cc1)c1c(c(ccc1)[Cl])F)NC(C(N)=O)CC	3.1
c1(cnc(c(c1)OC(C)c1cc(ccc1n1nccc1)F)N)c1c[nH]nc1C	3.8
c12cc(c(nc1ccc(c2)C(N)=O)N)OC(C)c1cc(ccc1n1nccc1)F	24
c12cc(c(nc1ccc(c2)C#N)N)OC(C)c1cc(c(cc1n1nccc1)F)F	19
c12cc(c(nc1ccc(c2)C(N)=O)N)OC(C)c1cc(c(cc1n1nccc1)F)F	4.1
c12cc(c(nc1ccc(c2)F)N)OC(C)c1cc(c(cc1n1nccc1)F)F	4.4
c12cc(c(nc1ccc(c2)C(N)=O)N)OC(C)c1cc2[nH]ncc2cc1n1nccc1	13
c12cc(c(nc1ccc(c2)C(N)=O)N)OC(C)c1ncc(cc1n1nccc1)F	22
c12cc(c(nc1ccc(c2)F)N)OC(C)c1cc2n(ncc2cc1n1nccc1)CCO	8.3
c12cc(c(nc1c(cc(c2)F)F)N)OC(C)c1cc(ccc1n1nccc1)C(=O)O	144
c12cc(c(nc1ccc(c2)F)N)OC(C)C=1NC(C=CC1n1nccc1)=O	43
c12cc(c(nc1c(cc(c2)F)F)N)OC(C)C=1NC(C=CC1n1nccc1)=O	63
c1(ccc(c(c1)C#Cc1n2N=CC=Cc2nc1)C)C(Nc1ccc2c(c1)C(F)(CC2N1CCN(CC1)C)F)=O	11.1
C1C3N(CCN1)C1=Nc2c(cnn2C=C1)C(=O)NC1(CC1)COc1c3cc(cn1)F	6.7
C1C3N(CCO1)C1=Nc2c(cnn2C=C1)C(=O)NC1(CC1)COc1c3cc(cn1)F	13
c1(ccccc1F)N(CC2(N1CCN(CC1)Cc1ccccc1)CC2)C(=O)CC	2.6
c1(cc(ccc1)F)N(CC2(N1CCN(CC1)Cc1ccccc1)CC2)C(=O)CC	1.2
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)Cc1ccccc1)CC2)C(=O)CC	3.5
c1(ccccc1)N(CC2(N1CCN(CC1)Cc1ccccc1)COC2)C(=O)CC	2.9
c1(ccccc1)N(CC2(N1CCN(CC1)Cc1ccccc1)CCOCC2)C(=O)CC	2.3
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)Cc1ccccc1)CCOCC2)C(=O)CC	6.8
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)Cc1ccccc1)CCSCC2)C(=O)CC	3.6
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)Cc1ccccc1)CC(OCC2)(C)C)C(=O)CC	3.2
c1(cccc(n1)C(F)(F)F)N(CC1(CCOCC1)N1CC2CN(CC2C1)Cc1ccccc1)C(=O)CC	3.4
c1(cccc(n1)C(F)(F)F)N(CC2(C1CCN(CC1)Cc1ccccc1)CCOCC2)C(=O)CC	3.9
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)CCCC)CCOCC2)C(=O)CC	2.2
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)CCOCC(C)C)CCOCC2)C(=O)CC	9.5
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)CCOc1ccccc1)CCOCC2)C(=O)CC	2.3
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)CCOCC(F)(F)F)CCOCC2)C(=O)CC	8.7
c1(cccc(n1)C(F)(F)F)N(CC2(N1CCN(CC1)CCOCCC)CCOCC2)C(=O)CC	3.4
c1c2C(=C(C(N(c2sc1)C(C)C)=O)C(NCCCN1CCCCC1)=O)O	1.3
c12ccccc1c(nn2C(C)C)C(NCC1(CCN(CC1)CCCOC)O)=O	1.5
c12ccccc1c(nn2C(C)C)c1nnc(o1)C1CCN(CC1)C1CCC1	2.4
c12ccccc1c(nn2C(C)C)c1nnc(o1)C1CCN(CC1)CCCOC	3
c12ccccc1c(nn2C(C)C)c1nnc(o1)C1CCN(CC1)CC1CCOCC1	8.5
c12ccccc1c(nn2C(C)C)c1nnc(o1)C1CCN(CC1)CC(COC)(C)C	1.4
c12ccccc1c(nn2C(C)C)c1nnc(o1)C1CCN(CC1)CC1(CCCC1)O	1.1
c12ccccc1c(nn2C(C)C)c1noc(n1)C1CCN(CC1)CCCOC	2.8
c12ccccc1c(nn2C(C)C)c1onc(n1)C1CCN(CC1)CCCOC	0.95
c1(c(cc(cc1)C(F)(F)F)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)[Cl]	5
c1(c(cc(cc1)C(F)(F)F)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ncc(c1)c1c(cc(cc1)C(=O)O)C)OC	0.44
c1(c(nc(cc1)C(F)(F)F)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ncc(c1)c1c(cc(cc1)C(=O)O)C)OC	2.5
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	16
c1(c(nc(nc1)N1CC(C1)F)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	19
c1(c(nc(nc1)N1CCOCC1)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	11
c1(c(nc(nc1)CC)CN1C(C(OC1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	19
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(ccc1)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	9.6
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(ccc1)OC(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	17
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1ccc(cc1)OC(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	3.8
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(ccc1)[Cl])C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	15
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(cc(c1)[Cl])C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	20
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(cc(c1)F)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	25
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(cc(c1)[Cl])[Cl])C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	16
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1cc(cc(c1)F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	11
c1(c(nc(nc1)N(C)C)CN1C(C(OC1=O)c1nc(ccc1)C(F)(F)F)C)c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC	22
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ncc1c1c(ccc(c1)c1c(cc(cc1)C(=O)O)C)OC)N(C)C)=O	2
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ccc1c1c(ccc(c1)CCC(=O)O)OC)C(F)(F)F)=O	12
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ccc1c1c(ccc(c1)C1CC(C1)C(=O)O)OC)C(F)(F)F)=O	4
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ccc1c1c(ccc(c1)C1CC(C(C1)O)O)OC)C(F)(F)F)=O	1.4
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ccc1c1c(ccc(c1)C1C(NC(O1)=O)C)OC)C(F)(F)F)=O	5
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ccc1c1c(ccc(c1)C1CNC(OC1(C)C)=O)OC)C(F)(F)F)=O	1.2
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C)c1cc(ccc1c1c(cc(c(c1)c1c(cc(cc1)c1oc(nn1)N)C)F)OC)C(F)(F)F)=O	0.2
C1(N2C(CCC2C(O1)c1cc(cc(c1)C(F)(F)F)C)c1cc(ccc1c1c(cc(c(c1)c1c(cc(cc1)c1oc(nn1)O)C)F)OC)C(F)(F)F)=O	2.3
c1c2c(ccc1)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	0.78
c1c2c(c(cc1)F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	1
c1c2c(cc(c1)F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	0.18
c1c2c(ccc1F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	5.4
c1(c2c(ccc1)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC)F	2.1
c1c2c(cc(c1)C#N)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	0.15
c1c2c(c(cc1F)F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	1.9
c1(c2c(cc(c1)F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC)F	0.57
c1(c2c(ccc1F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC)F	5.4
c1c2c(cc(c1[Cl])[Cl])ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	9.6
c1c2c(cnc1)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	0.058
c1c2c(ccn1)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	1.2
n1c2c(ccc1)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	11
n1c2c(cc(c1)F)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	2.1
n1c2c(cc(c1)C#N)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	0.69
c1c2c(ncc1C#N)ncn2C1CC2C(C2C1)C(NC(=O)c1ccc(cc1)[Cl])CC	5.2
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)CNC(=O)c1ccc(cc1)[Cl]	4.8
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)CNC(c1ccc(cc1)[Cl])C(F)(F)F	0.46
c1c2c(ccc1F)nc(n2C1CC2C(C2C1)C(NC(c1ccc(cc1)[Cl])=O)CC)C	1.1
c1c2c(ccc1C#N)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)[Cl])=O)CC	1.1
c1c2c(ccc1[Cl])ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)C#N)=O)CC	2.6
c1c2c(ccc1C#N)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)C#N)=O)CC	1.2
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)[Cl])=O)CC	0.79
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(c1ccc(c(c1)F)[Cl])=O)CC	0.95
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)C#N)=O)CC	1
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)[Cl])=O)C	0.53
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)[Cl])=O)(C)C	1.4
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C2(NC(c1ccc(cc1)[Cl])=O)CC2	0.56
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(c1ccc(cc1)C#N)=O)C	0.74
c1c2c(cc(c1F)F)ncn2C1CC2C(C2C1)C(NC(=O)C12CC(C1)(F)C2)CC	48
n1c2c(c(cc1)C1CCC(CC1)C(C(=O)Nc1ccc(cc1)[Cl])C)cc(cc2)F	2.4
c12ccccc1nc(c1c2n(cc1)S(c1cccc(c1)F)(=O)=O)N1CCNCC1	0.94
c12c(nc(cc1nc(n2CC1CCC(CC1)C)N1C2CCCC2OCC1)C1=COC(N1)=O)c1cncc(c1)[Cl]	12
c12ccc(cc1onc2C1CCN(CC1)CCCOc1ccc(cc1)CCN1CCCCC1)F	2.29
c12ccc(cc1onc2C1CCN(CC1)CCCOc1ccc(cc1)CN1CCN(CC1)C)F	1.56
C(COc1ccc(cc1)CN1CCN(CC1)C)CCN1CCC(CC1)c2c1ccc(cc1on2)F	1.06
N1(CCOCC1)CCc1ccc(cc1)OCCCN1CCC(CC1)c2c1ccc(cc1on2)F	2.41
c1(ccc(cc1)[Cl])S(N(C(=O)Oc1ccc(cc1)OCc1ccccc1)Nc1ccccc1)(=O)=O	9.6
c1(ccc(cc1)[Cl])S(N(C(=O)Oc1ccc(cc1)OCc1ccccc1)Cc1ccccc1)(=O)=O	5.2
c1(ccc(cc1Cn1nnc(n1)C)[Cl])\C=C\C(N1CCN(CC1)Cc1ccc(cn1)OC)=O	1.9
c1(ccc(cc1Cn1nnc(n1)C)[Cl])\C=C\C(N1CCN(CC1)Cc1onc(c1)C)=O	12
c1(ccc(cc1Cn1nnc(n1)C)[Cl])\C=C\C(N1CCN(C(C1)=O)Cc1onc(c1)C)=O	17
c1(ccc(cc1Cn1nnc(n1)C)[Cl])\C=C\C(N1CCN(CC1)Cc1cnn(c1)C)=O	15
c1(ccc(cc1Cn1nnc(n1)C)[Cl])\C=C\C(N1CCN(CC1)Cc1coc(n1)C)=O	23
c1(ccc(cc1Cn1nnc(n1)C)[Cl])\C=C\C(N1CCC(CC1)Cc1ncc(o1)C)=O	5.2
c1(ccc(cc1Cn1nnc(n1)C)C(F)(F)F)\C=C\C(N1CCC(CC1)c1oc(nn1)C)=O	23
c1(ccc(cc1Cn1nnc(n1)C)C(F)(F)F)\C=C\C(N1CCC(CC1)c1nc(no1)C)=O	14
c1(ccc(cc1Cn1nnc(n1)C)C(F)(F)F)\C=C\C(N1CCC(CC1)n1nc(nc1)C)=O	25
c1(cc(cnc1)C#N)NC(=O)COc1ccc(cc1)C(c1c(ccc(c1)[Cl])[Br])=O	2.7
C1CN(CCC12C(NCC2)=O)c1c(cncc1[Cl])c1oc2ccccc2c1	10.9
C1CN(CCC12C(NCC2)=O)c1c(cncc1[Cl])c1sc2ccccc2c1	14.7
c1cc2n(ccc2cc1NC(=O)C(=O)N1CCN(CC1)Cc1ccc(cc1)C)C	7.5
c1cc2n(ccc2cc1CNC(=O)N1CC(C1)COc1ccc(cc1)C(F)(F)F)C	4.6
c1(ccccc1OC)S(=O)(=O)\C=C\c1c(cccc1)[Cl]	12
c1(ccc(cc1)OCCCN1CCOCC1)S(=O)(=O)\C=C\c1ncccc1F	112
c1(ccccc1[Cl])S(=O)(=O)\C=C\c1ncccc1[Cl]	110
n1cnc2c(c1N)c(cn2C12CCC(CC1)(CC2)NC(OC)=O)c1c(cc(c(c1)N)[Cl])F	6
n1cnc2c(c1N)c(cn2C1CC(C1)N1CCN(CC1)C(C)=O)c1ccc(c(c1)N)[Cl]	7.9
n1cnc2c(c1N)c(cn2C1CCC(CC1)NC(OC)=O)c1ccc(c(c1)N)[Cl]	5.3
n1cnc2c(c1N)c(cn2C12CCC(CC1)(CC2)NC(OC)=O)c1ccc(c(c1)N)[Cl]	3
CCOC(=O)C1(CCN(C)CC1)c1ccccc1	75
CCN(CC)CC(=O)NC1=C(C)C=CC=C1C	262.2
CCCC(CCC)C(=O)O	20
CCC(COC(=O)c1cc(OC)c(OC)c(OC)c1)(c1ccccc1)N(C)C	90
COc1ccc(N(C(C)=O)c2cc3c(cc2[N+](=O)[O-])OC(C)(C)C(O)C3NC2CC2)cc1	44
COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccco1	1.57
COc1ccc2cc3-c4cc5OCOc5cc4CC[n+]3cc2c1OC	3.1
CCCc1nn(C)c2c(=O)[nH]c(nc12)c3cc(ccc3OCC)S(=O)(=O)N4CCN(C)CC4	100
CC(=O)SC1CC2=CC(=O)CCC2(C)C2CCC3C(CCC34CCC(=O)O4)C12	23
COc1ccc(cc1OC)C(=O)N1CCN(CC1)c1ccc2NC(=O)CCc2c1	1.1
CCS(=O)(=O)NC1c2cc(C#N)ccc2C(=O)C(C)(C)C1O	6.6
CCOC(=O)C1=C(COCCN)NC(C)=C(C(=O)OC)C1c1ccccc1Cl	3
CN1CC(=O)C2C(Cc3c([nH]c4ccccc34)C2c2cccc3c2OCO3)C1=O	100
CC(C)N(CCC(C(N)=O)(c1ccccc1)c1ccccn1)C(C)C	92
CN1CCN(CC1)[C@H]1N(O)c2cc(Cl)ccc2Nc2ccccc12	133.3
CCCCCCCCCC[N+](CC)(CC)CC	3.6
CCCCCCCC[N+](CC)(CC)CC	8.4
C/C(=C(/F)C(=O)Nc1ccc(-c2ccc(S(N)(=O)=O)cc2)cc1)c1cccc(C(=N)N)c1	0
COc1ccccc1OCCNCC(O)COc1cccc2c1C1C=CC=CC1=N2	10.42
O=C1N(Cc2ccccc2)C2C[S+]3CCCC3C2N1Cc1ccccc1	10
CC(C)(C)c1cn(-c2ccc(F)cc2)c2ccccc12	100
COc1ccccc1OCCNC[C@@H](O)COc1cccc2[nH]c3ccccc3c12	0.51
CNCCCC1c2ccccc2CCc2ccccc12	1.18
C1CN=C(N1)[C@@H]1CC1(c1ccccc1)c1ccccc1	3.7
CC(C)CC(N(C)C)C1(CCC1)C1=CC=C(Cl)C=C1	3.755
COCCCC\C(c1ccc(cc1)C(F)(F)F)=N/OCCN	3.8
OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12	5.765
COc1ccc(CN(CCN(C)C)c2ccccn2)cc1	6
CC(C)(C)N(CC(O)c1cc(Cl)cc2c1-c1ccc(Cl)cc1/C2=C\c1ccc(Cl)cc1)C(C)(C)C	8.1
CN(C)CCCn1cc(C2C(=O)NC(=O)C2c2c[nH]c3ccccc23)c2ccccc21	1
Cc1ccc(CCN(C)CCCN(C(=O)c2ccc([N+](=O)[O-])cc2)c2ccc(C)c(C)c2)cc1C	0.0198
CC(C)(C)c1ccc(C(=O)CCCN2CCC(OCc3ccccc3)CC2)cc1	0.331
COCC(=O)OC1(CCN(C)CCCC2=NC3C=CC=CC3=N2)CCc2cc(F)ccc2C1C(C)C	1.43
CCN(CC)c1ccc(NC(=O)C2CCc3cccc(OC)c3C2N(C)C(=O)OCC(C)C)cc1	6.1
O=C(Cc1ccc(F)cc1)NC1CCN(CCC(NC(=O)C2CCC2)c2ccccc2)CC1	0
O=C1Nc2ccccc2C1CCCN1CCC(n2c(=O)[nH]c3cc(Cl)ccc32)CC1	0.162
CCCCCCC[N+](CC)(CC)CCCCc1ccc(Cl)cc1	0.0126
COc1ccc(CCN(C)CCCNc2c(Cl)cn[nH]c2=O)cc1OC	6.6
COc1ccc(C(=O)Nc2ccccc2CCC2CCCCN2C)cc1	6
CCOc1cc(N)c(Cl)cc1C(=O)NCC1CN(Cc2ccc(F)cc2)CCO1	7.75
O=C(NC(CCN1CCC(c2noc(Cc3ccccc3)n2)CC1)c1ccccc1)C1CCC1	0
O=C(NC(CCN1CCC(n2cnc(Cc3ccccc3)n2)CC1)c1ccccc1)C1CCC1	0
CCN(CC)CCCN(c1ccccc1)C1CCc2ccccc21	0.23
O=C(CCC[N+]1CCC(O)(c2ccc(Cl)cc2)CC1)c1ccc(F)cc1	0.019
CCC[N+]1C[C@H](CSC)C[C@@H]2c3cccc4c3C(C=N4)C[C@H]21	0.12
CC(C)(C)c1ccc(C(=O)CCC[N+]2CCC(OC(c3ccccc3)c3ccccc3)CC2)cc1	0.331
CC(C)COC[C@@H](CN(Cc1ccccc1)c1ccccc1)[N+]1CCCC1	0.55
C[N+]1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2	0.558
C=C[C@H]1C[N+]2CC[C@H]1C[C@@H]2[C@@H](O)c1ccnc2ccc(OC)cc12	1.07
C[N+]1CC[N+](CCCCN2C(=O)CN(N=Cc3ccc(-c4ccc(Cl)cc4)o3)C2=O)CC1	1.4
C[N+](C)CCCN1c2ccccc2Sc2ccc(Cl)cc21	1.47
CCC(=O)N(c1ccccc1)C1CC[N+](CCc2ccccc2)CC1	1.82
O[C@@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@H]1CCCC[N+]1	2.56
C[N+](C)CCCN1c2ccccc2CCc2ccccc21	3.4
Nc1ccc(C(=O)N2C[C@H]3C[C@@H](C2)C[N+](Cc2ccccc2)C3)cc1	3.63
O=C(NCC1CCCC[N+]1)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F	3.91
O=C(OC1C[C@@H]2CC3C[C@H](C1)[N+]2CC3=O)C1=c2ccccc2=NC1	5.95
C[N+](C)CCC=C1c2ccccc2CCc2ccccc21	10
CC(C)Cn1c(=O)n(C)c(=O)c2[nH]cnc21	10
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H]([NH+](C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)C(=NOCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O	36.5
COC1C(OC(C)=O)CC(=O)OC(C)CC=CC=CC(O)C(C)CC(CC=O)C1OC1OC(C)C(OC2CC(C)(O)C(OC(=O)CC(C)C)C(C)O2)C([N+](C)C)C1O	102
COc1ccc2c3c1O[C@H]1[C@@H](O)C=C[C@H]4[C@@H](C2)[N+](C)CC[C@]314	301
C[N+]1CC[C@]23c4c5ccc(O)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5	1000
Cc1cccc(C[N+]2CC[N+](C(c3ccccc3)c3ccc(Cl)cc3)CC2)c1	0
CCCC(=O)Nc1ccc(OCC(O)C[N+]C(C)C)c(C(C)=O)c1	10000
CC(=O)Nc1nnc(S(N)(=O)=O)s1	10000
CC(=O)Oc1ccccc1C(=O)[O-]	10000
COc1cc(C)c(/C=C\C(C)=C\C=C/C(C)=C/C(=O)[O-])c(C)c1C	10000
Cc1ccc(/C(=C/C[N+]2CCCC2)c2cccc(/C=C\C(=O)[O-])n2)cc1	10000
Nc1nc(=O)c2ncn(COCCO)c2[nH]1	10000
NC1=N[C@@]2(CO1)c3cc(ccc3Oc4c(F)nc(cc24)C5=CCCOC5)c6ncccc6F	15.8489
Oc1ccc(\C=C(/C#N)\C(=O)NCCCc2ccccc2)cc1O	15.8489
CCCN(CCC)[C@@H](C1)CCc(c12)cccc2O	15.8489
COCCOC(=O)C1=C(C)NC(=C(C1c2cccc(c2)[N+](=O)[O-])C(=O)OC(C)C)C	10000
Brc1cc(Br)c(Oc2cc(Br)c(Br)cc2Br)cc1Br	17.7828
ClC1(Cl)C2(Cl)C3(Cl)C4(Cl)C(=O)C5(Cl)C(Cl)(C1(Cl)C35Cl)C24Cl	17.7828
NC1=NC2=C(N=CC(=O)N2)C(=O)N1	17.7828
c1cccc(c12)cnnc2NN	17.7828
CN(C)CCC=C1c2ccccc2CCc3ccccc13	17.7828
CCN1CCN(CC1)c2nc(C)nc(c23)n(C)c(n3)-c4c(Cl)cccc4	10
Clc1ccc(cc1)C(c2ccc(Cl)cc2)C(Cl)(Cl)Cl	10
Oc1c(Br)cc(\C=C\2/C(=O)Nc3ccc(I)cc23)cc1Br	10
Fc1cccc(c1)S(=O)(=O)N2CCC(CCc3ccc(F)cc3F)CC2	10
OC1(CCc2ccc(F)cc2F)CCN(CC1)S(=O)(=O)c3ccc(F)cc3	10
