0 B14R2.8239 Cc1cc2cc(ccc2[nH]c1=O)N A2Z00094168 [0,0,0,0,0,0|2,0,0]=2 1 B14R2.8239 Cc1ccc2c(c1)OC(C(=O)N2)C A2Z00070126 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.8239 Cc1ccc2c(c1)[nH]c(=O)c(=O)[nH]2 A2Z00096003 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.8239 c1cc2c(cc1Br)CC(C(=O)N2)N A2Z00049874 [0,0,0,0,0,0|1,1,2]=4 4 B14R2.8239 c1cc2c(cc1Cl)CC(C(=O)N2)N A2Z00095012 [0,0,0,0,0,0|1,0,2]=3 5 B13R2.369 CC1C(=O)Nc2ccccc2O1 A2Z00066930 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.369 Cc1cc2ccccc2[nH]c1=O A2Z00094815 [1,0,0,0,0,0|1,0,0]=2 7 B13R2.369 Cc1cc2ccccc2nc1Cl A2Z00095300 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.369 c1ccc2c(c1)CC(C(=O)N2)N A2Z00094761 [1,0,0,0,0,0|1,0,2]=4 9 B13R2.3683 c1cc2c(cc1Br)CCC(=O)N2 A2Z00097940 [1,0,0,0,0,0|0,1,2]=4 10 B13R2.3683 c1cc2c(cc1N)OCC(=O)N2 A2Z00068295 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.3683 c1cc2c(cc1O)OCC(=O)N2 A2Z00069938 [1,0,0,0,0,0|2,0,1]=4 12 B15R2.1754 c1cc(cc2c1cc(c(=O)[nH]2)C=O)Cl A2Z00044950 [0,1,0,0,0,0|2,0,1]=4 13 B15R2.1754 c1cc(cc2c1cc(c(n2)Cl)C=O)Cl A2Z00094042 [0,1,0,0,0,0|3,0,0]=4 14 B15R2.1824 Cc1ccc2c(c1)cc(c(=O)[nH]2)CN A2Z00046463 [0,1,0,0,0,0|2,0,0]=3 15 B15R2.1824 c1cc2c(cc1Br)cc(c(=O)[nH]2)C=O A2Z00044955 [0,1,0,0,0,0|0,1,1]=3 16 B15R2.1824 c1cc2c(cc1Cl)cc(c(=O)[nH]2)CCl A2Z00046476 [0,1,0,0,0,0|1,0,0]=2 17 B15R2.1824 c1cc2c(cc1F)cc(c(=O)[nH]2)C=O A2Z00044949 [0,1,0,0,0,0|0,1,1]=3 18 B15R2.21336 Cc1cc2cc(ccc2[nH]c1=O)CN A2Z00047874 [0,1,0,0,0,0|2,0,0]=3 19 B15R2.21336 Cc1cc2cc(ccc2[nH]c1=O)OC A2Z00049658 [0,1,0,0,0,0|2,0,0]=3 20 B15R2.62227 Cc1cc2cc(c(=O)[nH]c2cc1C)C A2Z00049657 [0,1,0,0,0,0|2,0,0]=3 21 B15R2.63893 Cc1cc2cc(ccc2n(c1=O)C)N A2Z00049872 [0,1,0,0,0,0|2,0,0]=3 22 B13R1.133 CC(C(=O)Nc1ccc(cn1)Cl)O A2Z00070404 [0,0,1,0,0,0|1,0,2]=4 23 B13R1.133 C\C(=C/c1ccc(cc1)Cl)\C(=O)O A2Z00046437 [0,0,1,0,0,0|3,0,0]=4 24 B13R1.148 C\C(=C/c1cccc(c1)Cl)\C(=O)O A2Z00046436 [0,0,1,0,0,0|2,0,0]=3 25 B13R1.2679 Cc1cc(ccc1NC(=O)CCl)Cl A2Z00098266 [0,0,1,0,0,0|1,0,2]=4 26 B13R2.3028 CC1c2cc(ccc2NC1=O)Br A2Z00048132 [0,0,0,0,1,0|1,1,1]=4 27 B13R2.3028 CC1c2cc(ccc2NC1=O)N A2Z00047978 [0,0,0,0,1,0|2,0,1]=4 28 B13R2.3028 c1cc2c(cc1Br)C(=O)C(=O)N2 A2Z00097333 [0,0,0,0,1,0|0,1,1]=3 29 B13R2.3028 c1cc2c(cc1Cl)C(=O)C(=O)N2 A2Z00030680 [0,0,0,0,1,0|0,0,1]=2 30 B12R1.21 c1cc(ccc1NCC(=O)O)Cl A2Z00056215 [1,0,1,0,0,0|1,0,1]=4 31 B12R1.21 c1cc(ccc1\C=C\C(=O)O)Cl A2Z00034000 [1,0,1,0,0,0|2,0,0]=4 32 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O A2Z00046434 [1,0,1,0,0,0|2,0,0]=4 33 B12R1.43 c1ccnc(c1)NC(=O)C(=O)O A2Z00047055 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.49 Cc1ccc(cc1)NC(=O)CO A2Z00068361 [1,0,1,0,0,0|1,0,1]=4 35 B12R1.49 c1cc(ccc1NC(=O)CO)F A2Z00068363 [1,0,1,0,0,0|0,1,1]=4 36 B12R1.226 c1cc(cc(c1)Cl)\C=C\C(=O)O A2Z00038051 [1,0,1,0,0,0|1,0,0]=3 37 B12R1.226 c1cc(cc(c1)F)\C=C\C(=O)O A2Z00097969 [1,0,1,0,0,0|1,1,0]=4 38 B12R2.24 c1cc2cc(ccc2nc1)Br A2Z00062458 [2,0,0,0,0,0|0,1,1]=4 39 B12R2.24 c1cc2cc(ccc2nc1)Br A2Z00074308 [2,0,0,0,0,0|0,1,1]=4 40 B12R2.24 c1cc2cc(ccc2nc1)O A2Z00094828 [2,0,0,0,0,0|1,0,1]=4 41 B12R2.24 c1ccc2c(c1)CCC(=O)N2 A2Z00074166 [2,0,0,0,0,0|0,0,2]=4 42 B12R2.24 c1ccc2c(c1)NC(=O)CO2 A2Z00083158 [2,0,0,0,0,0|1,0,1]=4 43 B12R2.24 c1ccc2c(c1)NCC(=O)N2 A2Z00039095 [2,0,0,0,0,0|1,0,1]=4 44 B14R1.686 c1cc(c(cc1NC(=O)C(=O)O)F)F A2Z00047056 [0,1,1,0,0,0|1,1,0]=4 45 B14R1.542 c1cc(cc(c1)Cl)\C=C(/C#N)\C(=O)O A2Z00094794 [0,1,1,0,0,0|2,0,0]=4 46 B14R2.1128 c1ccc2c(c1)cc(c(=O)[nH]2)C#N A2Z00044963 [1,1,0,0,0,0|1,0,0]=3 47 B14R2.1128 c1ccc2c(c1)cc(c(=O)[nH]2)C=O A2Z00095263 [1,1,0,0,0,0|0,0,1]=3 48 B14R2.1128 c1ccc2c(c1)cc(c(=O)[nH]2)CN A2Z00046462 [1,1,0,0,0,0|1,0,0]=3 49 B14R2.8188 Cc1cc2ccccc2n(c1=O)C A2Z00095492 [1,1,0,0,0,0|1,0,0]=3 50 B14R2.2332 c1cc(nc2c1cc(cc2)Cl)C=O A2Z00061657 [1,1,0,0,0,0|0,0,1]=3 51 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)Br A2Z00062171 [1,1,0,0,0,0|1,1,0]=4 52 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)F A2Z00097504 [1,1,0,0,0,0|1,1,0]=4 53 B14R2.8235 Cc1cc(c2cc(ccc2n1)Cl)Cl A2Z00061317 [1,1,0,0,0,0|1,0,1]=4 54 B14R2.8235 Cc1cc(c2cc(ccc2n1)Cl)O A2Z00058038 [1,1,0,0,0,0|1,0,1]=4 55 B14R2.3274 COc1ccc2c(c1)C(=O)C(=O)N2 A2Z00058621 [0,1,0,0,1,0|1,0,1]=4 56 B14R2.8716 CN1c2ccc(cc2C(=O)C1=O)Br A2Z00076698 [0,1,0,0,1,0|0,1,1]=4 57 B14R2.9184 Cc1cc(cc2c1NC(=O)C2=O)Br A2Z00058026 [0,1,0,0,1,0|0,1,1]=4 58 B14R2.9184 Cc1cc2c(c(c1)Br)NC(=O)C2=O A2Z00061680 [0,1,0,0,1,0|1,0,1]=4 59 B14R2.19008 c1cc2c(cc1Cl)c(c([nH]2)Cl)C=O A2Z00073900 [0,1,0,0,1,0|1,0,1]=4 60 B16R2.192946 Cc1cc2cc(c(=O)[nH]c2cc1C)C=O A2Z00044946 [0,2,0,0,0,0|1,0,1]=4 61 B16R2.192946 Cc1cc2cc(c(=O)[nH]c2cc1C)CN A2Z00046464 [0,2,0,0,0,0|2,0,0]=4 62 B16R2.192946 Cc1cc2cc(c(=O)[nH]c2cc1C)CO A2Z00046625 [0,2,0,0,0,0|1,0,0]=3 63 B16R2.6538 Cc1ccc2c(c1)cc(c(=O)[nH]2)CCN A2Z00046469 [0,2,0,0,0,0|2,0,0]=4 64 B16R2.23521 CC(=O)c1cc2cc(ccc2oc1=O)Cl A2Z00074030 [0,2,0,0,0,0|1,0,1]=4 65 B16R2.23521 c1cc2c(cc1Br)cc(c(=O)[nH]2)C(=O)O A2Z00044962 [0,2,0,0,0,0|0,1,0]=3 66 B16R2.23521 c1cc2c(cc1F)cc(c(=O)[nH]2)C(=O)O A2Z00044960 [0,2,0,0,0,0|0,1,0]=3 67 B16R2.37661 CCc1cc2cc(ccc2[nH]c1=O)OC A2Z00094885 [0,2,0,0,0,0|2,0,0]=4 68 B16R2.37661 COc1ccc2c(c1)cc(c(=O)[nH]2)C#N A2Z00044965 [0,2,0,0,0,0|2,0,0]=4 69 B16R2.37661 COc1ccc2c(c1)cc(c(=O)[nH]2)C=O A2Z00044952 [0,2,0,0,0,0|1,0,1]=4 70 B16R2.192589 Cc1cc(c2c(c1)cc(c(=O)[nH]2)C=O)C A2Z00044947 [0,2,0,0,0,0|1,0,1]=4 71 B16R2.3885 Cc1cc2cc(ccc2[nH]c1=O)[N+](=O)[O-] A2Z00095536 [0,2,0,0,0,0|2,0,0]=4 72 B14R2.7969 c1cc2cc([nH]c2c(c1)Cl)C(=O)O A2Z00074005 [0,0,1,1,0,0|2,0,0]=4 73 B12R1.20 C=C(c1ccc(cc1)Cl)C(=O)O A2Z00062149 [0,0,1,0,1,0|2,0,0]=4 74 B12R2.606 Cc1cc2cc(ccc2[nH]1)F A2Z00094211 [1,0,0,0,1,0|1,1,0]=4 75 B12R2.18 CC1c2ccccc2NC1=O A2Z00049804 [1,0,0,0,1,0|1,0,1]=4 76 B12R2.18 Cc1c(c2ccccc2[nH]1)Br A2Z00061785 [1,0,0,0,1,0|2,0,0]=4 77 B12R2.18 Cc1c(c2ccccc2[nH]1)I A2Z00061802 [1,0,0,0,1,0|2,0,0]=4 78 B12R2.18 Cn1c2ccccc2[nH]c1=O A2Z00085448 [1,0,0,0,1,0|2,0,0]=4 79 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Cl A2Z00038633 [0,0,1,0,0,1|0,0,2]=4