0 B12R1.30 c1cc(cnc1)C(=O)CCC#N A2Z00094287 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.30 c1ccc(cc1)C(=O)CCCCl A2Z00094306 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.30 c1ccc(cc1)C(=O)NCCN A2Z00047087 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.16 CC(CCN)c1ccccc1 A2Z00046307 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.28 c1ccc(cc1)CNCCO A2Z00065097 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.28 c1ccc(cc1)OCCCN A2Z00077141 [1,0,0,0,0,0|3,0,0]=4 6 B11R1.28 c1ccc(cc1)\C=C\CCCl A2Z00049195 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.28 c1ccc(cc1)\C=C\CCN A2Z00048064 [1,0,0,0,0,0|2,0,0]=3 8 B13R1.11 COC(=O)CC(=O)c1ccccc1 A2Z00049206 [0,1,0,0,0,0|2,0,1]=4 9 B13R1.17 CCCOC(=O)c1ccc(cc1)N A2Z00076647 [0,1,0,0,0,0|0,0,0]=1 10 B13R1.45 CC(=O)CCC(=O)c1ccccn1 A2Z00048090 [0,1,0,0,0,0|2,0,1]=4 11 B13R1.45 CC(=O)CCC(=O)c1cccnc1 A2Z00048091 [0,1,0,0,0,0|2,0,1]=4 12 B13R1.45 CC(=O)CCC(=O)c1ccncc1 A2Z00048092 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.45 c1ccc(cc1)C(=O)CCC(=O)O A2Z00097839 [0,1,0,0,0,0|2,0,1]=4 14 B13R1.45 c1ccc(cc1)C(=O)NCC(=O)O A2Z00038585 [0,1,0,0,0,0|2,0,1]=4 15 B13R1.674 C=CCNC(=O)c1ccccc1Br A2Z00033960 [0,1,0,0,0,0|1,0,2]=4 16 B13R2.3 c1ccc(cc1)C2CNCCO2 A2Z00049952 [0,0,0,1,0,0|2,0,1]=4 17 B13R2.3 c1ccc(cc1)C2NCCCO2 A2Z00049390 [0,0,0,1,0,0|1,0,1]=3 18 B13R2.223 CC1(CCCN1)c2ccccc2 A2Z00050320 [0,0,0,1,0,0|2,0,1]=4 19 B13R2.223 c1ccc(cc1)C2(CCCC2)N A2Z00061569 [0,0,0,1,0,0|2,0,1]=4 20 B13R1.44 c1ccc(cc1)NC(=O)CCCN A2Z00007925 [0,0,0,0,0,1|2,0,0]=3 21 B10R1.15 c1cc(cnc1)C(=O)CBr A2Z00094983 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.15 c1ccc(cc1)C(=O)C=O A2Z00094839 [2,0,0,0,0,0|1,0,1]=4 23 B10R1.17 CCNCc1ccccc1 A2Z00093459 [2,0,0,0,0,0|1,0,1]=4 24 B10R1.17 c1ccc(cc1)OCC#N A2Z00093923 [2,0,0,0,0,0|1,0,1]=4 25 B10R1.17 c1ccc(cc1)OCCO A2Z00038602 [2,0,0,0,0,0|1,0,0]=3 26 B10R1.17 c1ccc(cc1)OCCS A2Z00049974 [2,0,0,0,0,0|1,0,0]=3 27 B12R1.16 CCCC(=O)c1ccc(cc1)Cl A2Z00097921 [1,1,0,0,0,0|0,0,0]=2 28 B12R1.16 CCCC(=O)c1ccc(cc1)F A2Z00094271 [1,1,0,0,0,0|0,0,0]=2 29 B12R1.16 CCCC(C)c1ccc(cc1)O A2Z00049608 [1,1,0,0,0,0|1,0,1]=4 30 B12R1.16 CCOC(=O)c1ccc(=O)[nH]n1 A2Z00073873 [1,1,0,0,0,0|2,0,0]=4 31 B12R1.16 CCOC(=O)c1ccc(cc1)F A2Z00094784 [1,1,0,0,0,0|0,0,0]=2 32 B12R1.16 CCOC(=O)c1ccc(cc1)N A2Z00030702 [1,1,0,0,0,0|0,0,0]=2 33 B12R1.16 CCOC(=O)c1cnc(cn1)C A2Z00096117 [1,1,0,0,0,0|2,0,0]=4 34 B12R1.16 c1cc(ccc1C(=O)CCBr)Br A2Z00070059 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.34 CCC(C(=O)c1ccccc1)N A2Z00048079 [1,1,0,0,0,0|0,0,0]=2 36 B12R1.39 c1ccc(cc1)S(=O)(=O)CCN A2Z00046080 [1,1,0,0,0,0|2,0,0]=4 37 B12R1.107 CC(=O)CC(=O)c1ccccc1 A2Z00094722 [1,1,0,0,0,0|0,0,1]=3 38 B12R1.107 CC(C)CC(c1ccccc1)O A2Z00048081 [1,1,0,0,0,0|0,0,2]=4 39 B12R1.107 CN(C)CC(=O)c1ccccc1 A2Z00074274 [1,1,0,0,0,0|1,0,0]=3 40 B12R1.308 CCCC(=O)c1ccccc1F A2Z00048886 [1,1,0,0,0,0|0,0,0]=2 41 B12R1.308 CCOC(=O)c1ccccc1C A2Z00098049 [1,1,0,0,0,0|0,0,0]=2 42 B12R1.308 CCOC(=O)c1ccccc1N A2Z00093475 [1,1,0,0,0,0|0,0,0]=2 43 B12R1.308 CCOC(=O)c1cccnc1N A2Z00061520 [1,1,0,0,0,0|1,0,0]=3 44 B12R1.8 CCCCCCc1ccccc1 A2Z00093559 [1,1,0,0,0,0|1,0,1]=4 45 B12R1.35 c1cc(sc1)C(=O)NCCCO A2Z00097906 [0,1,0,0,1,0|2,0,0]=4 46 B14R1.158 c1ccc(cc1)NC(=O)CCCCBr A2Z00094659 [0,1,0,0,0,1|1,0,0]=3 47 B14R1.19 COCCOC(=O)c1ccc(cc1)N A2Z00056849 [0,2,0,0,0,0|0,0,0]=2 48 B14R1.35 CCNC(C)C(=O)c1ccc(cc1)C A2Z00070032 [0,2,0,0,0,0|2,0,0]=4 49 B14R1.35 CCOC(=O)C(=O)c1ccc(cc1)Cl A2Z00094576 [0,2,0,0,0,0|2,0,0]=4 50 B14R1.35 CCOC(=O)C(=O)c1ccc(cc1)F A2Z00095973 [0,2,0,0,0,0|2,0,0]=4 51 B14R1.926 COc1ccc(cc1)C(=O)CCCCl A2Z00094273 [0,2,0,0,0,0|2,0,0]=4 52 B14R1.420 c1ccc(cc1)C(=O)CCCC(=O)O A2Z00094032 [0,2,0,0,0,0|1,0,1]=4 53 B12R2.2 c1ccc(cc1)C2CCCN2 A2Z00095924 [1,0,0,1,0,0|1,0,1]=4 54 B12R2.1081 c1ccc2c(c1)C(=O)CCN2 A2Z00094292 [1,0,0,1,0,0|1,0,0]=3 55 B14R2.24 c1ccc(cc1)C2C(=O)NCCS2 A2Z00022218 [0,0,0,1,0,1|2,0,0]=4 56 B14R2.24 c1ccc(cc1)N2CCNCC2=O A2Z00048051 [0,0,0,1,0,1|2,0,0]=4 57 B14R2.67 CCCSc1[nH]c2ccccc2n1 A2Z00050727 [0,0,0,1,0,1|1,1,0]=4 58 B14R2.517 CCCn1c2ccccc2nc1S A2Z00099362 [0,0,0,1,0,1|1,1,0]=4 59 B14R2.517 c1ccc2c(c1)[nH]c(=O)n2CCN A2Z00047806 [0,0,0,1,0,1|2,0,0]=4 60 B14R2.7724 Cn1c2ccccc2c(=O)oc1=O A2Z00094248 [0,1,0,1,0,0|1,0,1]=4 61 B14R2.68 CC1COC(CN1)c2ccccc2 A2Z00094302 [0,1,0,1,0,0|1,0,1]=4 62 B14R2.10606 c1cc(ccc1C(=O)C2CCC2)Cl A2Z00094213 [0,1,0,1,0,0|1,0,0]=3 63 B14R2.685 Cc1cccc2c1OCCCC2=O A2Z00097503 [0,1,0,1,0,0|2,0,0]=4 64 B14R2.5637 c1cc2c(cc1Cl)C(=O)NCCC2 A2Z00094766 [0,1,0,1,0,0|1,0,0]=3 65 B14R2.5637 c1cc2c(cc1F)C(=O)NCCC2 A2Z00094762 [0,1,0,1,0,0|1,0,0]=3 66 B14R2.114 c1ccc(cc1)C(=O)C2CCCN2 A2Z00046312 [0,1,0,1,0,0|1,0,0]=3 67 B14R2.29285 CC1(CCC(=O)c2c1cccc2)C A2Z00094226 [0,1,0,1,0,0|1,0,0]=3 68 B14R2.279 c1ccc2c(c1)C(=O)C(CCO2)N A2Z00062243 [0,1,0,1,0,0|2,0,0]=4 69 B10R1.11 CCOC(=O)c1cscn1 A2Z00098039 [1,0,0,0,1,0|2,0,0]=4