0 B13R1.45 CN(CCC(=O)O)C1=CC=CC=C1 BB58-0842 [1,0,0,0,0,0|2,0,0]=3 1 B13R1.45 O=C(O)CCC(=O)C1=CN=CC=C1 BB54-1177 [1,0,0,0,0,0|1,0,0]=2 2 B13R1.45 O=C(O)CSC(=S)C1=CC=CC=C1 BB12-1361 [1,0,0,0,0,0|1,1,0]=3 3 B13R1.158 CC1=C(CNCC(=O)O)C=CC=C1 BB20-1222 [1,0,0,0,0,0|2,0,1]=4 4 B15R2.6 O=C(O)CCC1=CNC2=CC=CC=C12 BB01-7425 [0,0,0,1,0,0|2,0,0]=3 5 B15R2.6 O=C(O)CCN1N=CC2=C1C=CC=C2 BB01-8274 [0,0,0,1,0,0|3,0,0]=4 6 B15R2.6 O=C(O)CCN1N=NC2=CC=CC=C21 BB55-3559 [0,0,0,1,0,0|3,0,0]=4 7 B15R2.629 O=C(O)CN1NC2=CC=CC=C2C1=O BB55-8850 [0,0,0,1,0,0|2,0,0]=3 8 B15R2.14951 O=C(O)C1=NC2=C(C=CC=C2)C(=O)N1 BB12-2080 [0,0,0,1,0,0|2,0,1]=4 9 B15R2.14951 O=C1NC(C(=O)O)CC2=CC=CC=C12 BB57-6500 [0,0,0,1,0,0|2,0,0]=3 10 B13R1.201 CC(=O)CC(=O)C1=C(Br)C=CC=C1 BB32-3227 [0,0,0,0,1,0|2,0,0]=3 11 B13R1.201 CC(=O)CC(=O)C1=C(F)C=CC=C1 BB31-7739 [0,0,0,0,1,0|2,0,0]=3 12 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Br BB56-0119 [0,0,0,0,1,0|2,0,1]=4 13 B15R1.256 CC1=C(NC(=O)\C=C\C(=O)O)C=CC=C1 BB01-7997 [0,0,0,0,0,1|1,0,2]=4 14 B15R1.256 O=C(O)\C=C\C(=O)NC1=CC=CC=C1F BB01-7514 [0,0,0,0,0,1|1,0,2]=4 15 B12R1.252 O=C(O)CCCC1=CC=CC=N1 BB54-3321 [2,0,0,0,0,0|1,0,1]=4 16 B12R1.252 O=C(O)CCCC1=CC=NC=C1 BB54-3329 [2,0,0,0,0,0|1,0,1]=4 17 B12R1.252 O=C(O)COCC1=CC=CC=C1 BB01-5008 [2,0,0,0,0,0|1,0,1]=4 18 B14R1.163 NNC(=O)CNC(=O)C1=CC=CC=C1 BB12-1198 [1,1,0,0,0,0|2,0,0]=4 19 B14R1.415 CC(CN(C)C1=CC=CC=C1)C(=O)O BB58-0844 [1,1,0,0,0,0|2,0,0]=4 20 B14R1.415 O=C(O)C(=O)CC(=O)C1=CC=CC=C1 BB54-3566 [1,1,0,0,0,0|0,0,1]=3 21 B14R1.417 CC(CC(=O)O)N(C)C1=CC=CC=C1 BB58-0843 [1,1,0,0,0,0|2,0,0]=4 22 B14R1.678 CC(=O)CCC(=O)C1=CC=C(Br)C=C1 BB20-0476 [1,1,0,0,0,0|1,0,0]=3 23 B14R1.678 CC1=CC=C(C(=O)\C=C\C(=O)O)C=C1 BB12-2237 [1,1,0,0,0,0|0,0,2]=4 24 B14R1.813 O=C(O)CCS(=O)(=O)C1=CC=CC=C1 BB01-6419 [1,1,0,0,0,0|1,0,0]=3 25 B14R1.96 COC1=C(CCCC(=O)O)C=CC=C1 BB32-2124 [1,1,0,0,0,0|0,0,1]=3 26 B14R1.161 CC1=C(OCC(O)C(=O)O)C=CC=C1 BB54-2283 [1,1,0,0,0,0|2,0,0]=4 27 B14R1.161 NC(CCC1=C(Cl)C=CC=C1)C(=O)O BB31-1129 [1,1,0,0,0,0|1,0,1]=4 28 B16R1.7458 COC(=O)CCC(=O)NC1=CC=CN=C1Cl BB12-4824 [0,1,0,0,0,1|2,0,0]=4 29 B16R1.11019 CC1=CC=CC=C1CS(=O)(=O)CCC(=O)O BB01-6480 [0,1,0,0,0,1|2,0,0]=4 30 B16R1.11019 O=C(O)CCS(=O)(=O)CC1=C(F)C=CC=C1 BB01-6479 [0,1,0,0,0,1|2,0,0]=4 31 B16R1.40243 O=C(O)CCS(=O)(=O)C1=CC(Cl)=CC=C1Cl BB55-5055 [0,2,0,0,0,0|2,0,0]=4 32 B14R2.68 O=C1CCC(C2=CC=CC=C2)=NN1 BB55-4973 [1,0,0,1,0,0|2,0,0]=4 33 B14R2.768 O=C(O)CN1C=C2C=CC=CC2=N1 BB12-3277 [1,0,0,1,0,0|2,0,0]=4 34 B14R2.5443 O=C(O)C1CC1C2=C(Cl)C=CC=C2 BB31-5556 [1,0,0,1,0,0|1,0,1]=4 35 B14R2.2 O=C(O)CC1=CNC2=CC=CC=C12 BB56-1705 [0,0,0,1,1,0|2,0,0]=4 36 B14R2.2 O=C(O)CC1=NNC2=C1C=CC=C2 BB54-4114 [0,0,0,1,1,0|2,0,0]=4 37 B16R2.477 O=C(O)CCC1COC2=CC=CC=C2O1 BB54-1898 [0,0,0,1,0,1|1,0,1]=4 38 B16R2.3989 O=C(O)CC1=CC2=C(C=CC=C2)OC1=O BB01-4803 [0,0,0,1,0,1|1,0,1]=4 39 B16R2.93202 O=C(O)CN1C(=O)OC2=C(Cl)C=CC=C21 BB54-4213 [0,0,0,1,0,1|2,0,0]=4 40 B16R2.3270 O=C(O)C1CC(C2=CC=CC=C2O)=NO1 BB05-3080 [0,0,0,1,0,1|2,0,0]=4 41 B16R2.3270 O=C(O)C1CC(C2=CC=CC=C2O)=NO1 BB55-4109 [0,0,0,1,0,1|2,0,0]=4 42 B16R2.3356 O=C(O)CCN1NC2=CC=CC=C2C1=O BB26-0659 [0,0,0,1,0,1|1,0,0]=3 43 B16R2.83538 O=C(O)CN1N=CC2=CC=CC=C2C1=O BB55-4898 [0,1,0,1,0,0|2,0,0]=4 44 B16R2.104522 CN1C=C(CCC(=O)O)C2=CC=CC=C21 BB01-1230 [0,1,0,1,0,0|2,0,0]=4 45 B16R2.23501 O=C(O)C1=CC(=O)C2=C(C=CC(Cl)=C2)O1 BB54-3570 [0,1,0,1,0,0|0,0,2]=4 46 B16R2.4003 O=C(O)CCN1C(=O)SC2=CC=CC=C21 BB01-1788 [0,1,0,1,0,0|1,1,0]=4 47 B12R1.54 O=C(O)CCC(=O)C1=CC=CO1 BB54-4290 [1,0,0,0,1,0|1,0,0]=3 48 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [1,0,0,0,1,0|1,0,0]=3 49 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 BB12-1278 [1,0,0,0,1,0|2,0,0]=4 50 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 BB54-0376 [1,0,0,0,1,0|1,0,1]=4 51 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1289 [1,0,0,0,1,0|1,0,1]=4 52 B12R1.125 CC1=CC=CC=C1NCC(=O)O BB12-2586 [1,0,0,0,1,0|2,0,0]=4 53 B12R1.125 CC1=CC=CC=C1OCC(=O)O BB01-6379 [1,0,0,0,1,0|2,0,0]=4 54 B12R1.125 O=C(O)CCN1C=CC=CC1=O BB57-2035 [1,0,0,0,1,0|1,0,1]=4 55 B12R1.125 O=C(O)CNC1=C(Cl)C=CC=C1 BB58-0801 [1,0,0,0,1,0|2,0,0]=4 56 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 BB12-2037 [1,0,0,0,1,0|2,0,0]=4 57 B16R1.7414 NC1=NC=CC=C1NC(=O)CCCC(=O)O BB54-1370 [0,0,0,0,0,2|2,0,0]=4 58 B16R1.7414 O=C(O)CCCC(=O)NC1=CC=CC=C1O BB12-2354 [0,0,0,0,0,2|0,0,0]=2 59 B16R1.7414 O=C(O)COCC(=O)NC1=CC=CC=C1O BB12-2353 [0,0,0,0,0,2|0,0,0]=2