0 B14R1.420 c1ccc(cc1)C(=O)CCCC(=O)O L04013 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.24 CCCCCC(=O)c1ccccc1 A14712 [1,0,0,0,0,0|1,0,0]=2 2 B13R1.24 CCCCOC(=O)c1ccccc1 A17010 [1,0,0,0,0,0|0,0,0]=1 3 B13R1.337 CN(C)CCNCc1ccccc1 L03126 [1,0,0,0,0,0|2,0,1]=4 4 B15R1.9094 C[N+](C)(C)CCOC(=O)c1ccccc1 A15179 [0,1,0,0,0,0|1,0,0]=2 5 B15R1.9094 C[N+](C)(C)CCOC(=O)c1ccccc1 B22387 [0,1,0,0,0,0|1,0,0]=2 6 B15R2.53147 c1ccc2c(c1)C(OC2=O)CC(=O)O L05984 [0,0,0,1,0,0|2,0,1]=4 7 B13R1.45 CC(=O)CCC(=O)c1ccccc1 L13151 [0,0,0,0,1,0|1,0,1]=3 8 B13R1.45 CC(=O)OCC(=O)c1ccccc1 L15652 [0,0,0,0,1,0|2,0,1]=4 9 B13R1.45 CC(C)COC(=O)c1ccccc1 A10114 [0,0,0,0,1,0|0,0,0]=1 10 B13R1.45 CC(C)NCC(=O)c1ccccc1 H50799 [0,0,0,0,1,0|1,0,0]=2 11 B13R1.45 CC(C)NCC(c1ccccc1)O H50793 [0,0,0,0,1,0|1,0,2]=4 12 B13R1.45 CN(C)CCC(=O)c1ccccc1 L01179 [0,0,0,0,1,0|1,0,0]=2 13 B13R1.45 c1ccc(cc1)C(=O)CCC(=O)O A16636 [0,0,0,0,1,0|2,0,1]=4 14 B12R1.8 CCCCCCc1ccccc1 A12821 [2,0,0,0,0,0|1,0,1]=4 15 B12R1.8 CCCCNCc1ccccc1 A17851 [2,0,0,0,0,0|1,0,1]=4 16 B12R1.8 CCCCOCc1ccccc1 L11747 [2,0,0,0,0,0|0,0,1]=3 17 B12R1.8 c1ccc(cc1)COCCCBr H66278 [2,0,0,0,0,0|1,0,1]=4 18 B12R1.30 C#CCOC(=O)c1ccccc1 H53444 [2,0,0,0,0,0|0,0,2]=4 19 B12R1.30 CCCCC(=O)c1ccccc1 A10525 [2,0,0,0,0,0|0,0,0]=2 20 B12R1.30 CCCCC(c1ccccc1)O L04646 [2,0,0,0,0,0|0,0,2]=4 21 B12R1.30 c1ccc(cc1)C(=O)CCCCl L06383 [2,0,0,0,0,0|1,0,0]=3 22 B12R1.30 c1ccc(cc1)C(=O)NCCCl L06212 [2,0,0,0,0,0|2,0,0]=4 23 B14R1.19 CCCCNC(=O)c1ccc(cc1)Br H57927 [1,1,0,0,0,0|1,0,0]=3 24 B14R1.19 CCCCNC(=O)c1ccc(cc1)C H56730 [1,1,0,0,0,0|1,0,0]=3 25 B14R1.19 CCCCNC(=O)c1ccc(cc1)F H57948 [1,1,0,0,0,0|1,0,0]=3 26 B14R1.19 CCCCOC(=O)c1ccc(cc1)N H54690 [1,1,0,0,0,0|0,0,0]=2 27 B14R1.19 CCCCOC(=O)c1ccc(cc1)O A14043 [1,1,0,0,0,0|0,0,0]=2 28 B14R1.20 CCCCNC(=O)c1cccc(c1)C H56538 [1,1,0,0,0,0|1,0,0]=3 29 B14R1.20 CCCCNC(=O)c1cccc(c1)Cl H56702 [1,1,0,0,0,0|1,0,0]=3 30 B14R1.20 CCCCNC(=O)c1ccnc(c1)Cl H57524 [1,1,0,0,0,0|2,0,0]=4 31 B14R1.38 CCCCCCC(=O)c1ccccc1 A10491 [1,1,0,0,0,0|1,0,0]=3 32 B14R1.38 CCCCCOC(=O)c1ccccc1 A10177 [1,1,0,0,0,0|0,0,0]=2 33 B14R1.46 CCCCNS(=O)(=O)c1ccccc1 H61945 [1,1,0,0,0,0|2,0,0]=4 34 B14R1.1035 CCCCNC(=O)c1ccccc1Cl H56234 [1,1,0,0,0,0|1,0,0]=3 35 B14R1.1035 CCCCNC(=O)c1ccccc1F H56916 [1,1,0,0,0,0|1,0,0]=3 36 B14R1.818 CC(C)CC(=O)OCc1ccccc1 B24852 [1,1,0,0,0,0|0,0,2]=4 37 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Cl H56024 [0,1,0,0,1,0|1,0,0]=3 38 B14R1.149 CC(C)CNC(=O)c1ccnc(c1)Cl H57388 [0,1,0,0,1,0|2,0,0]=4 39 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)C H56920 [0,1,0,0,1,0|1,0,0]=3 40 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl H56696 [0,1,0,0,1,0|1,0,0]=3 41 B14R1.160 CC(C)CNC(=O)c1ccccc1F H56737 [0,1,0,0,1,0|1,0,0]=3 42 B14R1.540 CC(C)C\C=C(\C=O)/c1ccccc1 A13407 [0,1,0,0,1,0|0,0,1]=3 43 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br H57385 [0,1,0,0,1,0|1,0,0]=3 44 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl H55610 [0,1,0,0,1,0|1,0,0]=3 45 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F H57562 [0,1,0,0,1,0|1,0,0]=3 46 B14R1.678 CC(C)COC(=O)c1ccc(cc1)O L17587 [0,1,0,0,1,0|0,0,0]=2 47 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C H56657 [0,1,0,0,1,0|1,0,0]=3 48 B14R1.3098 CC(C)(C)OOC(=O)c1ccccc1 A17373 [0,1,0,0,1,0|1,0,0]=3 49 B14R2.114 c1ccc(cc1)C(=O)C2CCCC2 A19976 [1,0,0,1,0,0|1,0,0]=3 50 B14R2.510 CC\C=C/1\c2ccccc2C(=O)O1 A13319 [1,0,0,1,0,0|0,0,2]=4 51 B14R2.403 CC1(COC(=N1)c2ccccc2)C B25058 [0,0,0,1,1,0|1,0,0]=3 52 B14R2.403 CC1(COC(=N1)c2cccnc2)C H33997 [0,0,0,1,1,0|2,0,0]=4 53 B16R2.236 C[C@@H]1CN(CCN1)C(=O)c2ccccc2 L20059 [0,0,0,1,0,1|1,0,0]=3 54 B12R1.35 CCCCCC(=O)c1ccco1 B22306 [1,0,0,0,1,0|2,0,0]=4 55 B12R1.252 C[C@@H](COCc1ccccc1)O H60523 [1,0,0,0,1,0|1,0,1]=4 56 B12R1.54 CN(C)CCC(=O)c1cccs1 H52377 [0,0,0,0,2,0|2,0,0]=4 57 B12R1.107 CC(=O)CC(=O)c1ccccc1 A14537 [0,0,0,0,2,0|1,0,1]=4