0 B21R2.4531 CC(CCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 11a_100000210052_100011435293 [0,0,1,0,0,0|2,0,1]=4 1 B21R2.4531 CC(CCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100011435293 [0,0,1,0,0,0|2,0,1]=4 2 B21R2.4531 CC(CCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100011435293 [0,0,1,0,0,0|2,0,1]=4 3 B21R2.4531 CC(CCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 527a_100000210052_100011435293 [0,0,1,0,0,0|2,0,1]=4 4 B21R2.4531 CC(NCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 2230a_100015324214_100000184327 [0,0,1,0,0,0|1,0,2]=4 5 B21R2.4531 CC(NCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 34a_100015324214_100000184327 [0,0,1,0,0,0|1,0,2]=4 6 B21R2.4531 CC(OCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 34a_100000210790_100000184327 [0,0,1,0,0,0|2,0,1]=4 7 B21R2.4531 CC(OCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 7a_100000210790_100000184327 [0,0,1,0,0,0|2,0,1]=4 8 B21R2.4531 CC(SCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 11a_100000210052_100000149570 [0,0,1,0,0,0|2,0,1]=4 9 B21R2.4531 CC(SCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100000149570 [0,0,1,0,0,0|2,0,1]=4 10 B21R2.4531 CC(SCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100000149570 [0,0,1,0,0,0|2,0,1]=4 11 B21R2.4531 CC(SCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 527a_100000210052_100000149570 [0,0,1,0,0,0|2,0,1]=4 12 B21R2.4531 CC(SCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 62a_100000184327_100015291786 [0,0,1,0,0,0|2,0,1]=4 13 B21R2.4531 CC(SCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 62a_100000211182_100000184327 [0,0,1,0,0,0|2,0,1]=4 14 B21R2.4531 C[C@H](OCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 11a_100000210052_100000703211 [0,0,1,0,0,0|2,0,1]=4 15 B21R2.4531 C[C@H](OCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100000703211 [0,0,1,0,0,0|2,0,1]=4 16 B21R2.4531 C[C@H](OCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100000703211 [0,0,1,0,0,0|2,0,1]=4 17 B21R2.4531 C[C@H](OCc1ccccc1)C(=O)Nc2ccc(cc2)Cl 527a_100000210052_100000703211 [0,0,1,0,0,0|2,0,1]=4 18 B21R2.4531 Cc1ccc(cc1)NC(=O)C(O)CCc2ccccc2 22a_100000124888_100000242596 [0,0,1,0,0,0|2,0,1]=4 19 B21R2.4531 O=C(Cc1ccc(cc1)Cl)C(O)CCc2ccccc2 1458a_100000242596_100000694040 [0,0,1,0,0,0|2,0,1]=4 20 B21R2.4531 O=C(Nc1ccc(cc1)Br)C(O)CCc2ccccc2 22a_100000210018_100000242596 [0,0,1,0,0,0|1,1,1]=4 21 B21R2.4531 O=C(Nc1ccc(cc1)Cl)C(O)CCc2ccccc2 22a_100000210052_100000242596 [0,0,1,0,0,0|1,0,1]=3 22 B21R2.4531 O=C(Nc1ccc(cc1)F)C(O)CCc2ccccc2 22a_100000185862_100000242596 [0,0,1,0,0,0|1,1,1]=4 23 B21R2.4531 O=C(Nc1ccc(cc1)I)C(O)CCc2ccccc2 22a_100000185761_100000242596 [0,0,1,0,0,0|1,1,1]=4 24 B21R2.4531 O=C(Nc1ccc(cc1)O)C(O)CCc2ccccc2 22a_100000185829_100000242596 [0,0,1,0,0,0|2,0,1]=4 25 B21R2.103324 CC(NC(c1ccccc1)c2cccc(c2)Cl)C(=O)N 2230a_100000741085_100000702099 [0,0,1,0,0,0|1,0,2]=4 26 B21R2.103324 CC(NC(c1ccccc1)c2cccc(c2)Cl)C(=O)N 34a_100000741085_100000702099 [0,0,1,0,0,0|1,0,2]=4 27 B21R2.103324 CC(OC(c1ccccc1)c2cccc(c2)Cl)C(=O)N 34a_100000733576_100000702099 [0,0,1,0,0,0|2,0,1]=4 28 B21R2.103324 CC(OC(c1ccccc1)c2cccc(c2)Cl)C(=O)N 7a_100000733576_100000702099 [0,0,1,0,0,0|2,0,1]=4 29 B21R2.103324 C[C@@H](NC(c1ccccc1)c2cccc(c2)Cl)C(=O)N 270004a_100000119354_100011215489 [0,0,1,0,0,0|1,0,2]=4 30 B21R2.103324 NC(=O)C(F)NC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_100009813875 [0,0,1,0,0,0|1,0,2]=4 31 B21R2.103324 NC(=O)C(F)NC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_100009813875 [0,0,1,0,0,0|1,0,2]=4 32 B21R2.103324 NC(=O)C(F)OC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_100009813875 [0,0,1,0,0,0|2,0,1]=4 33 B21R2.103324 NC(=O)C(F)OC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_100009813875 [0,0,1,0,0,0|2,0,1]=4 34 B21R2.507331 C=C(c1ccccc1)c2cc(ccc2NC(=O)CC)C 271570a_100000068269_100000152038 [0,0,1,0,0,0|3,0,0]=4 35 B21R2.507331 CCC(=O)Nc1ccc(cc1C(O)c2ccccc2)Cl 22a_100000011915_100000210414 [0,0,1,0,0,0|2,0,1]=4 36 B21R2.507331 Cc1ccc(c(c1)C(C)c2ccccc2)NC(=O)CO 22a_100010591190_100000210174 [0,0,1,0,0,0|2,0,1]=4 37 B21R2.507331 O=C(CO)Nc1ccc(cc1C(O)c2ccccc2)Cl 22a_100000011915_100000210174 [0,0,1,0,0,0|1,0,1]=3 38 B22R2.22799 CN(C(=O)C(O)CCc1ccccc1)c2ccc(cc2)Cl 22a_100020629279_100000242596 [0,1,1,0,0,0|1,0,1]=4 39 B22R2.23022 Cc1cc(ccc1Cl)NC(=O)C(O)CCc2ccccc2 22a_100000187808_100000242596 [0,1,1,0,0,0|1,0,1]=4 40 B22R2.23022 O=C(Nc1ccc(c(c1)Br)Cl)C(O)CCc2ccccc2 22a_100000686031_100000242596 [0,1,1,0,0,0|1,0,1]=4 41 B22R2.23022 O=C(Nc1ccc(c(c1)Cl)Cl)C(O)CCc2ccccc2 22a_100000184108_100000242596 [0,1,1,0,0,0|1,0,1]=4 42 B22R2.23022 O=C(Nc1ccc(c(c1)F)Cl)C(O)CCc2ccccc2 22a_100000739366_100000242596 [0,1,1,0,0,0|1,0,1]=4 43 B22R2.23022 O=C(Nc1ccc(c(c1)I)Cl)C(O)CCc2ccccc2 22a_100012360549_100000242596 [0,1,1,0,0,0|1,0,1]=4 44 B22R2.23022 O=C(Nc1ccc(c(c1)O)Cl)C(O)CCc2ccccc2 22a_100011934209_100000242596 [0,1,1,0,0,0|1,0,1]=4 45 B22R2.23700 C[C@@H](NC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100011504567 [0,1,1,0,0,0|1,0,1]=4 46 B22R2.23700 C[C@@H](NC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100011504567 [0,1,1,0,0,0|1,0,1]=4 47 B22R2.23700 C[C@@H](NC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 527a_100000210052_100011504567 [0,1,1,0,0,0|1,0,1]=4 48 B22R2.23700 C[C@@H](OC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 11a_100000210052_200035542198 [0,1,1,0,0,0|2,0,0]=4 49 B22R2.23700 C[C@@H](OC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_200035542198 [0,1,1,0,0,0|2,0,0]=4 50 B22R2.23700 C[C@@H](OC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 22a_100000210052_200035542198 [0,1,1,0,0,0|2,0,0]=4 51 B22R2.23700 C[C@@H](OC(=O)c1ccccc1)C(=O)Nc2ccc(cc2)Cl 527a_100000210052_200035542198 [0,1,1,0,0,0|2,0,0]=4 52 B22R2.23700 O=C(NC(O)C(=O)Cc1ccc(cc1)Cl)c2ccccc2 1458a_100000067094_100000694040 [0,1,1,0,0,0|1,0,1]=4 53 B22R2.308514 Cc1cc(ccc1NC(=O)C(O)CCc2ccccc2)Cl 22a_100000210418_100000242596 [0,1,1,0,0,0|1,0,1]=4 54 B22R2.308514 O=C(Nc1ccc(cc1Cl)Cl)C(O)CCc2ccccc2 22a_100000185861_100000242596 [0,1,1,0,0,0|1,0,1]=4 55 B22R2.308514 O=C(Nc1ccc(cc1F)Cl)C(O)CCc2ccccc2 22a_100000211020_100000242596 [0,1,1,0,0,0|1,0,1]=4 56 B22R2.308514 O=C(Nc1ccc(cc1O)Cl)C(O)CCc2ccccc2 22a_100000185728_100000242596 [0,1,1,0,0,0|1,0,1]=4 57 B22R2.529842 Cc1ccccc1OCC(O)C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100011934399 [0,1,1,0,0,0|2,0,0]=4 58 B22R2.138678 NC(=O)[C@H](CO)NC(c1ccccc1)c2cccc(c2)Cl 270004a_100000729942_100011215489 [0,1,1,0,0,0|0,0,2]=4 59 B22R2.308557 C[C@@H](O)C(=O)Nc1ccc(cc1C(O)c2ccccc2)Cl 22a_100000011915_100000717761 [0,1,1,0,0,0|1,0,1]=4 60 B22R2.308557 C[C@H](O)C(=O)Nc1ccc(cc1C(O)c2ccccc2)Cl 22a_100000011915_217856618621 [0,1,1,0,0,0|1,0,1]=4 61 B22R2.308557 O=C(Nc1ccc(cc1C(O)c2ccccc2)Cl)C(O)O 22a_100000011915_100000233687 [0,1,1,0,0,0|1,0,1]=4 62 B22R2.398685 CNCC(=O)Nc1ccc(cc1C(=O)c2ccccc2)Cl 2230a_106832991635_100000034880 [0,1,1,0,0,0|2,0,0]=4 63 B22R2.398685 CNCC(=O)Nc1ccc(cc1C(=O)c2ccccc2)Cl 7a_106832991635_100000034880 [0,1,1,0,0,0|2,0,0]=4 64 B22R2.398685 COCC(=O)Nc1ccc(cc1C(O)c2ccccc2)Cl 22a_100000011915_100000210968 [0,1,1,0,0,0|1,0,1]=4 65 B22R2.398685 CSCC(=O)Nc1ccc(cc1C(=O)c2ccccc2)Cl 62a_100016996598_200000210301 [0,1,1,0,0,0|1,1,0]=4 66 B22R2.398685 CSCC(=O)Nc1ccc(cc1C(=O)c2ccccc2)Cl 62a_200000210301_100000034880 [0,1,1,0,0,0|1,1,0]=4 67 B22R2.398685 O=C(CCO)Nc1ccc(cc1C(O)c2ccccc2)Cl 22a_100000011915_100011216618 [0,1,1,0,0,0|1,0,1]=4 68 B22R2.398685 [13CH3]SCC(=O)Nc1ccc(cc1C(=O)c2ccccc2)Cl 62a_100016996598_200025704644 [0,1,1,0,0,0|1,1,0]=4 69 B22R2.398685 [13CH3]SCC(=O)Nc1ccc(cc1C(=O)c2ccccc2)Cl 62a_200025704644_100000034880 [0,1,1,0,0,0|1,1,0]=4 70 B22R3.1107949 CNC1N=C(c2ccccc2NC1=O)c3ccccc3 2230a_100020649134_200000210301 [1,1,0,0,0,0|1,0,0]=3 71 B22R3.1107949 [13CH3]NC1N=C(c2ccccc2NC1=O)c3ccccc3 2230a_100020649134_200025704644 [1,1,0,0,0,0|1,0,0]=3 72 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2CCc3ccccc3O2 11a_100000210052_100000065239 [0,0,1,1,0,0|1,0,1]=4 73 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2CCc3ccccc3O2 1626a_100000210052_100000065239 [0,0,1,1,0,0|1,0,1]=4 74 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2CCc3ccccc3O2 22a_100000210052_100000065239 [0,0,1,1,0,0|1,0,1]=4 75 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2CCc3ccccc3O2 527a_100000210052_100000065239 [0,0,1,1,0,0|1,0,1]=4 76 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2COc3ccccc3O2 11a_100000210052_100000182656 [0,0,1,1,0,0|2,0,0]=4 77 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2COc3ccccc3O2 1626a_100000210052_100000182656 [0,0,1,1,0,0|2,0,0]=4 78 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2COc3ccccc3O2 22a_100000210052_100000182656 [0,0,1,1,0,0|2,0,0]=4 79 B22R3.46836 O=C(Nc1ccc(cc1)Cl)C2COc3ccccc3O2 527a_100000210052_100000182656 [0,0,1,1,0,0|2,0,0]=4 80 B22R2.23584 O=C(NCc1ccc(cc1)Cl)C(O)CCc2ccccc2 240690a_100000174871_100000242596 [0,0,1,0,0,1|1,0,1]=4 81 B22R2.23584 O=C(NNc1ccc(cc1)Cl)C(O)CCc2ccccc2 22a_100000683521_100000242596 [0,0,1,0,0,1|1,0,1]=4 82 B22R2.739015 Cc1ccc(c(c1)C(=O)Nc2ccccc2)NC(=O)CO 22a_100000932364_100000210174 [0,0,1,0,0,1|2,0,0]=4