0 B13R1.382 CCOc1ccccc1C(=O)OC CSC000148976 [1,0,0,0,0,0|2,0,0]=3 1 B13R1.382 CCSc1ccccc1C(=O)NC CSC000019822 [1,0,0,0,0,0|3,0,0]=4 2 B13R1.382 COC(=O)c1ccccc1CC#N CSC000151593 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.547 CNC(=O)c1ccccc1[N+](=O)[O-] CSC000192140 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.547 COC(=O)c1ccccc1C(=O)C CSC010269922 [1,0,0,0,0,0|0,0,0]=1 5 B13R1.547 COC(=O)c1ccccc1[N+](=O)[O-] CSC000149990 [1,0,0,0,0,0|1,0,1]=3 6 B15R1.11752 CCS(=O)(=O)c1ccccc1C(=O)NC CSC000223172 [0,1,0,0,0,0|3,0,0]=4 7 B15R2.22222 COc1ccc(c2c1cccc2)OC CSC000037251 [0,0,0,1,0,0|2,0,0]=3 8 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)NC CSC000205919 [0,0,0,0,0,1|2,0,0]=3 9 B15R1.3847 CCC(=O)Nc1ccccc1C(=O)OC CSC000152667 [0,0,0,0,0,1|1,0,0]=2 10 B15R1.3847 CCC(=O)Oc1ccccc1C(=O)OC CSC034343655 [0,0,0,0,0,1|1,0,0]=2 11 B15R1.3847 COC(=O)Cc1ccccc1C(=O)OC CSC000070244 [0,0,0,0,0,1|0,0,0]=1 12 B12R1.77 CNC(=O)c1ccccc1OC CSC000159813 [2,0,0,0,0,0|1,0,0]=3 13 B12R1.77 CNC(=O)c1ccccc1SC CSC000159722 [2,0,0,0,0,0|1,1,0]=4 14 B12R1.77 COC(=O)c1ccccc1OC CSC000150339 [2,0,0,0,0,0|0,0,0]=2 15 B12R1.77 COC(=O)c1ccccc1SC CSC000151494 [2,0,0,0,0,0|0,1,0]=3 16 B12R1.77 COC(=O)c1cccnc1OC CSC011203184 [2,0,0,0,0,0|1,0,0]=3 17 B12R1.77 COC(=O)c1cccnc1SC CSC000149765 [2,0,0,0,0,0|1,1,0]=4 18 B12R1.77 COC(=O)c1ncccc1OC CSC011997691 [2,0,0,0,0,0|1,0,0]=3 19 B12R1.77 COc1ccccc1C(=O)NN CSC000189102 [2,0,0,0,0,0|2,0,0]=4 20 B14R1.263 CCOC(=O)c1ccccc1OCC CSC000170318 [1,1,0,0,0,0|2,0,0]=4 21 B14R1.744 COC(=O)c1ccccc1OC(=O)C CSC000001831 [1,1,0,0,0,0|2,0,0]=4 22 B14R1.5238 CCOc1ccc(cc1C(=O)OC)Br CSC011840379 [1,1,0,0,0,0|2,0,0]=4 23 B14R1.623 CCOC(=O)c1ccccc1C(=O)C CSC000042901 [1,1,0,0,0,0|0,0,0]=2 24 B14R1.623 CCOC(=O)c1ccccc1[N+](=O)[O-] CSC000169800 [1,1,0,0,0,0|1,0,1]=4 25 B14R1.707 COC(=O)c1cc(ccc1[N+](=O)[O-])C CSC011996004 [1,1,0,0,0,0|1,0,1]=4 26 B14R1.1126 COC(=O)c1ccc(cc1[N+](=O)[O-])Br CSC012359390 [1,1,0,0,0,0|1,0,1]=4 27 B14R1.1126 COC(=O)c1ccc(cc1[N+](=O)[O-])Cl CSC000150773 [1,1,0,0,0,0|1,0,1]=4 28 B14R1.1126 COC(=O)c1ccc(cc1[N+](=O)[O-])F CSC000731495 [1,1,0,0,0,0|1,0,1]=4 29 B14R1.1153 COC(=O)c1cccc(c1[N+](=O)[O-])C CSC000148193 [1,1,0,0,0,0|1,0,1]=4 30 B14R1.1153 COC(=O)c1cccc(c1[N+](=O)[O-])Cl CSC000698587 [1,1,0,0,0,0|1,0,1]=4 31 B14R1.1164 COC(=O)c1c(cccc1[N+](=O)[O-])C CSC000240953 [1,1,0,0,0,0|1,0,1]=4 32 B14R1.1164 COC(=O)c1c(cccc1[N+](=O)[O-])N CSC000078545 [1,1,0,0,0,0|1,0,1]=4 33 B16R1.960 CCNC(=O)c1ccccc1NC(=O)CC CSC048889814 [0,1,0,0,0,1|2,0,0]=4 34 B16R1.960 CCNC(=O)c1ccccc1NC(=O)OC CSC047166723 [0,1,0,0,0,1|1,0,0]=3 35 B16R1.960 CCOC(=O)c1ccccc1NC(=O)CC CSC000250703 [0,1,0,0,0,1|1,0,0]=3 36 B16R1.960 CCOC(=O)c1ccccc1NC(=O)OC CSC037575958 [0,1,0,0,0,1|0,0,0]=2 37 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)NC CSC000271080 [0,1,0,0,0,1|2,0,0]=4 38 B16R1.1556 CCCC(=O)Nc1ccccc1C(=O)OC CSC000152666 [0,1,0,0,0,1|1,0,0]=3 39 B16R1.1556 COCC(=O)Nc1ccccc1C(=O)OC CSC000186598 [0,1,0,0,0,1|0,0,0]=2 40 B16R1.16698 COC(=O)c1ccccc1NC(=O)C(=O)N CSC045717156 [0,1,0,0,0,1|2,0,0]=4 41 B16R1.16698 COC(=O)c1ccccc1NC(=O)C(C)C CSC000152665 [0,1,0,0,0,1|1,0,0]=3 42 B16R1.17282 COC(=O)c1ccccc1S(=O)(=O)N(C)C CSC000165064 [0,2,0,0,0,0|2,0,0]=4 43 B14R2.10782 COC(=O)c1cccc2c1NCC2 CSC000097324 [1,0,0,1,0,0|2,0,0]=4 44 B14R2.10782 COC(=O)c1cccc2c1cc[nH]2 CSC011218648 [1,0,0,1,0,0|2,0,0]=4 45 B14R2.10782 COC(=O)c1cccc2c1cn[nH]2 CSC000062817 [1,0,0,1,0,0|2,0,0]=4 46 B16R2.33942 COC(=O)C1CCC(=O)c2c1cccc2 CSC010234073 [0,0,0,1,0,1|1,0,0]=3 47 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)N CSC000189134 [1,0,0,0,0,1|2,0,0]=4 48 B14R1.3302 COC(=O)Cc1ccccc1[N+](=O)[O-] CSC000171414 [1,0,0,0,0,1|1,0,1]=4 49 B14R1.3302 COC(=O)Nc1ccccc1C(=O)N CSC000216172 [1,0,0,0,0,1|1,0,0]=3 50 B14R1.734 CNC(=O)c1cccc(c1)C(=O)NC CSC000048387 [0,0,0,0,1,1|2,0,0]=4 51 B14R1.734 COC(=O)c1cccc(c1)C(=O)NN CSC016237040 [0,0,0,0,1,1|2,0,0]=4 52 B14R1.734 COC(=O)c1cccc(c1)C(=O)OC CSC000028157 [0,0,0,0,1,1|0,0,0]=2 53 B14R1.734 COC(=O)c1ccnc(c1)C(=O)OC CSC000074146 [0,0,0,0,1,1|1,0,0]=3 54 B14R1.734 COC(=O)c1cncc(c1)C(=O)OC CSC000028622 [0,0,0,0,1,1|1,0,0]=3 55 B16R1.1332 COC(=O)CNc1ccccc1C(=O)OC CSC000020559 [0,0,0,0,0,2|0,0,0]=2 56 B16R1.1332 COC(=O)CSc1ncccc1C(=O)OC CSC028436944 [0,0,0,0,0,2|1,0,0]=3