0 B14R1.160 CC(C)CNC(=O)c1ccccc1Cl H56696 [0,0,0,0,0,0|2,0,0]=2 1 B14R1.160 CC(C)CNC(=O)c1ccccc1F H56737 [0,0,0,0,0,0|2,0,0]=2 2 B13R1.45 CC(=O)CCC(=O)c1ccccc1 L13151 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.45 CC(C)COC(=O)c1ccccc1 A10114 [1,0,0,0,0,0|0,0,0]=1 4 B13R1.45 CC(C)NCC(=O)c1ccccc1 H50799 [1,0,0,0,0,0|2,0,0]=3 5 B13R1.45 CN(C)CCC(=O)c1ccccc1 L01179 [1,0,0,0,0,0|2,0,0]=3 6 B13R1.158 CC(C)CNCc1ccccc1F H56201 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.674 CCCNC(=O)c1ccccc1Cl H59736 [1,0,0,0,0,0|2,0,0]=3 8 B13R1.674 CCCNC(=O)c1ccccc1F H59099 [1,0,0,0,0,0|2,0,0]=3 9 B13R1.674 CCCNC(=O)c1cccnc1Cl H57313 [1,0,0,0,0,0|3,0,0]=4 10 B15R1.86 CC(C)CNC(=O)c1ccccc1OC H56997 [0,1,0,0,0,0|2,0,0]=3 11 B15R1.86 CC(C)NCC(=O)c1ccccc1OC H50734 [0,1,0,0,0,0|3,0,0]=4 12 B15R1.8020 CC(C)CNS(=O)(=O)c1ccccc1Br H60733 [0,1,0,0,0,0|3,0,0]=4 13 B13R1.201 CC(C)NC(=O)c1ccccc1Cl H56140 [0,0,0,0,1,0|2,0,0]=3 14 B13R1.201 CC(C)NC(=O)c1ccccc1F H56824 [0,0,0,0,1,0|2,0,0]=3 15 B13R1.201 CC(C)OC(=O)c1ccccc1O B24471 [0,0,0,0,1,0|1,0,0]=2 16 B12R1.30 C#CCOC(=O)c1ccccc1 H53444 [2,0,0,0,0,0|0,0,2]=4 17 B12R1.30 CCCCC(=O)c1ccccc1 A10525 [2,0,0,0,0,0|1,0,0]=3 18 B12R1.30 c1ccc(cc1)C(=O)CCCCl L06383 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.30 c1ccc(cc1)C(=O)NCCCl L06212 [2,0,0,0,0,0|2,0,0]=4 20 B12R1.252 C[C@@H](COCc1ccccc1)O H60523 [2,0,0,0,0,0|1,0,1]=4 21 B12R1.308 CCNC(=O)c1ccccc1Cl H59064 [2,0,0,0,0,0|2,0,0]=4 22 B12R1.308 CCNC(=O)c1ccccc1F H59435 [2,0,0,0,0,0|2,0,0]=4 23 B12R1.308 CCOC(=O)c1ccccc1Br A13166 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.308 CCOC(=O)c1ccccc1C L00598 [2,0,0,0,0,0|1,0,0]=3 25 B12R1.308 CCOC(=O)c1ccccc1Cl A10141 [2,0,0,0,0,0|1,0,0]=3 26 B12R1.308 CCOC(=O)c1ccccc1F A16564 [2,0,0,0,0,0|1,0,0]=3 27 B12R1.308 CCOC(=O)c1ccccc1I L07650 [2,0,0,0,0,0|1,0,0]=3 28 B12R1.308 CCOC(=O)c1ccccc1N A14378 [2,0,0,0,0,0|0,0,0]=2 29 B12R1.308 CCOC(=O)c1ccccc1O A10101 [2,0,0,0,0,0|1,0,0]=3 30 B12R1.308 CCOC(=O)c1ccccc1[Zn+] H58721 [2,0,0,0,0,0|1,0,0]=3 31 B12R1.308 CCOC(=O)c1cccnc1Br H52335 [2,0,0,0,0,0|2,0,0]=4 32 B12R1.308 CCOC(=O)c1cccnc1C L03256 [2,0,0,0,0,0|2,0,0]=4 33 B12R1.308 CCOC(=O)c1cccnc1Cl B20359 [2,0,0,0,0,0|2,0,0]=4 34 B12R1.308 CCOC(=O)c1cccnc1N H64957 [2,0,0,0,0,0|1,0,0]=3 35 B12R1.308 CCOC(=O)c1ccncc1N H64188 [2,0,0,0,0,0|1,0,0]=3 36 B14R1.149 CC(C)CNC(=O)c1cccc(c1)Cl H56024 [1,1,0,0,0,0|1,0,0]=3 37 B14R1.149 CC(C)CNC(=O)c1ccnc(c1)Cl H57388 [1,1,0,0,0,0|2,0,0]=4 38 B14R1.149 Cc1cccc(c1)C(=O)NCC(C)C H56920 [1,1,0,0,0,0|1,0,0]=3 39 B14R1.540 CC(C)C\C=C(\C=O)/c1ccccc1 A13407 [1,1,0,0,0,0|1,0,0]=3 40 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Br H57385 [1,1,0,0,0,0|1,0,0]=3 41 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)Cl H55610 [1,1,0,0,0,0|1,0,0]=3 42 B14R1.678 CC(C)CNC(=O)c1ccc(cc1)F H57562 [1,1,0,0,0,0|1,0,0]=3 43 B14R1.678 CC(C)COC(=O)c1ccc(cc1)O L17587 [1,1,0,0,0,0|0,0,0]=2 44 B14R1.678 Cc1ccc(cc1)C(=O)NCC(C)C H56657 [1,1,0,0,0,0|1,0,0]=3 45 B14R1.3098 CC(C)(C)OOC(=O)c1ccccc1 A17373 [1,1,0,0,0,0|1,0,0]=3 46 B14R1.587 CCC(C)NC(=O)c1ccccc1N H50724 [1,1,0,0,0,0|1,0,0]=3 47 B14R1.918 CCCNC(=O)c1cc(ccc1F)F H61762 [1,1,0,0,0,0|2,0,0]=4 48 B14R1.939 CCCNC(=O)c1ccccc1OC H59834 [1,1,0,0,0,0|2,0,0]=4 49 B14R1.1035 CCCCNC(=O)c1ccccc1Cl H56234 [1,1,0,0,0,0|2,0,0]=4 50 B14R1.1035 CCCCNC(=O)c1ccccc1F H56916 [1,1,0,0,0,0|2,0,0]=4 51 B14R1.8282 CCCNC(=O)c1c(cccc1F)F H59269 [1,1,0,0,0,0|2,0,0]=4 52 B14R1.840 CC(C)NC(=O)c1ccccc1OC H56623 [0,1,0,0,1,0|2,0,0]=4 53 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1Cl H56525 [0,1,0,0,1,0|2,0,0]=4 54 B14R1.4451 CC(C)(C)NC(=O)c1ccccc1F H56039 [0,1,0,0,1,0|2,0,0]=4 55 B14R1.6052 CC(C)NC(=O)c1cc(ccc1F)F H61324 [0,1,0,0,1,0|2,0,0]=4 56 B14R1.423 CC(C)COC(=O)Cc1ccccc1 A19004 [0,0,1,1,0,0|1,0,1]=4 57 B14R2.403 CC1(COC(=N1)c2ccccc2)C B25058 [1,0,0,1,0,0|1,0,0]=3 58 B14R2.403 CC1(COC(=N1)c2cccnc2)C H33997 [1,0,0,1,0,0|2,0,0]=4 59 B12R1.107 CC(=O)CC(=O)c1ccccc1 A14537 [1,0,0,0,1,0|1,0,1]=4 60 B12R1.124 CN(C)C(=O)c1ccccc1Cl H59948 [0,0,0,0,2,0|2,0,0]=4 61 B12R1.124 CN(C)C(=O)c1ccccc1F H59416 [0,0,0,0,2,0|2,0,0]=4