0 B13R2.3028 CC1c2cc(ccc2NC1=O)Br A2Z00048132 [0,0,0,0,0,0|2,1,0]=3 1 B13R2.3028 CC1c2cc(ccc2NC1=O)N A2Z00047978 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.3028 Cn1c2cc(ccc2oc1=O)N A2Z00046406 [0,0,0,0,0,0|3,0,0]=3 3 B13R2.3028 c1cc2c(cc1Br)C(=O)C(=O)N2 A2Z00097333 [0,0,0,0,0,0|1,1,1]=3 4 B13R2.3028 c1cc2c(cc1Cl)C(=O)C(=O)N2 A2Z00030680 [0,0,0,0,0,0|1,1,1]=3 5 B12R2.18 CC1c2ccccc2NC1=O A2Z00049804 [1,0,0,0,0,0|2,0,0]=3 6 B12R2.18 Cc1c(c2ccccc2[nH]1)Br A2Z00061785 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.18 Cc1c(c2ccccc2[nH]1)I A2Z00061802 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.18 Cc1cc2ccccc2n1C A2Z00049652 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.18 Cn1c2ccccc2[nH]c1=O A2Z00085448 [1,0,0,0,0,0|1,0,0]=2 10 B12R2.606 Cc1cc2cc(ccc2[nH]1)F A2Z00094211 [1,0,0,0,0,0|2,0,0]=3 11 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 A2Z00094309 [1,0,0,0,0,0|1,1,0]=3 12 B12R2.606 c1cc2c(cc1F)sc(n2)N A2Z00070687 [1,0,0,0,0,0|2,0,1]=4 13 B12R2.606 c1cc2c(cc1N)CC(=O)N2 A2Z00095275 [1,0,0,0,0,0|2,0,0]=3 14 B12R2.606 c1cc2c(cc1N)[nH]c(=O)o2 A2Z00046405 [1,0,0,0,0,0|2,0,0]=3 15 B12R2.606 c1cc2c(cc1N)nc([nH]2)Cl A2Z00050311 [1,0,0,0,0,0|2,0,1]=4 16 B12R2.606 c1cc2c(cc1N)oc(=O)[nH]2 A2Z00094049 [1,0,0,0,0,0|2,0,0]=3 17 B12R2.606 c1cc2c(cc1N)sc(=S)[nH]2 A2Z00061225 [1,0,0,0,0,0|2,1,0]=4 18 B12R2.606 c1cc2c(cc1O)sc(=O)o2 A2Z00017241 [1,0,0,0,0,0|3,0,0]=4 19 B14R2.3274 COc1ccc2c(c1)C(=O)C(=O)N2 A2Z00058621 [0,1,0,0,0,0|2,0,1]=4 20 B14R2.4507 CC1(c2cc(ccc2NC1=O)N)C A2Z00048088 [0,1,0,0,0,0|3,0,0]=4 21 B14R2.8716 CN1c2ccc(cc2C(=O)C1=O)Br A2Z00076698 [0,1,0,0,0,0|1,1,1]=4 22 B14R2.8716 CN1c2ccc(cc2C(C1=O)N)Br A2Z00073971 [0,1,0,0,0,0|2,1,0]=4 23 B14R2.9184 Cc1cc(cc2c1NC(=O)C2=O)Br A2Z00058026 [0,1,0,0,0,0|1,1,1]=4 24 B14R2.9184 Cc1cc2c(c(c1)Br)NC(=O)C2=O A2Z00061680 [0,1,0,0,0,0|2,0,1]=4 25 B14R2.19008 Cc1c(c2cc(ccc2[nH]1)F)C=O A2Z00047897 [0,1,0,0,0,0|2,0,1]=4 26 B14R2.19008 c1cc2c(cc1F)c(c([nH]2)Cl)C=O A2Z00073901 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.49 Cc1ccc(cc1)NC(=O)CCl A2Z00075121 [0,0,1,0,0,0|3,0,0]=4 28 B12R1.49 Cc1ccc(cc1)NC(=O)CO A2Z00068361 [0,0,1,0,0,0|2,0,0]=3 29 B12R1.49 Cc1ccc(cc1)NC(=O)CS A2Z00029474 [0,0,1,0,0,0|2,1,0]=4 30 B12R1.49 c1cc(ccc1NC(=O)CO)F A2Z00068363 [0,0,1,0,0,0|1,0,0]=2 31 B12R1.49 c1cc(ccc1NC(=O)CS)F A2Z00064160 [0,0,1,0,0,0|1,1,0]=3 32 B12R1.49 c1cc(ccc1NC(=S)NN)Cl A2Z00085525 [0,0,1,0,0,0|1,2,0]=4 33 B14R2.4513 CN1c2cc(ccc2OCC1=O)N A2Z00067503 [0,0,0,0,0,1|3,0,0]=4 34 B14R2.4513 CN1c2cc(ccc2OCC1=O)N A2Z00068297 [0,0,0,0,0,1|3,0,0]=4 35 B14R2.8235 Cc1cc(=O)c2cc(ccc2[nH]1)F A2Z00097504 [0,0,0,0,0,1|2,0,1]=4 36 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)O A2Z00060377 [0,0,0,0,0,1|2,0,1]=4 37 B14R2.8239 Cc1cc2cc(ccc2[nH]c1=O)N A2Z00094168 [0,0,0,0,0,1|3,0,0]=4 38 B14R2.8239 Cc1ccc2c(c1)OC(C(=O)N2)C A2Z00070126 [0,0,0,0,0,1|3,0,0]=4 39 B14R2.8239 Cc1ccc2c(c1)[nH]c(=O)c(=O)[nH]2 A2Z00096003 [0,0,0,0,0,1|2,0,1]=4 40 B14R2.8239 c1cc2c(cc1Br)CC(C(=O)N2)N A2Z00049874 [0,0,0,0,0,1|2,1,0]=4 41 B14R2.8239 c1cc2c(cc1Cl)CC(C(=O)N2)N A2Z00095012 [0,0,0,0,0,1|2,1,0]=4 42 B11R1.20 Cc1ccc(cc1)NC(=S)N A2Z00075032 [1,0,1,0,0,0|1,1,0]=4 43 B11R1.20 c1cc(ccc1CC(=O)O)O A2Z00062185 [1,0,1,0,0,0|2,0,0]=4 44 B11R1.40 c1ccc(cc1)NC(=O)CN A2Z00044283 [1,0,1,0,0,0|2,0,0]=4 45 B11R1.40 c1ccc(cc1)NC(=O)CO A2Z00068359 [1,0,1,0,0,0|1,0,0]=3 46 B11R1.36 CC(=O)C(c1ccccc1)O A2Z00049601 [1,0,1,0,0,0|2,0,0]=4 47 B11R1.167 c1cc(c(cc1Br)C(=O)O)N A2Z00097335 [1,0,1,0,0,0|1,1,0]=4 48 B11R1.167 c1cc(c(cc1F)[N+](=O)[O-])N A2Z00068291 [1,0,1,0,0,0|0,0,2]=4 49 B11R2.1 c1ccc2c(c1)c(n[nH]2)O A2Z00061517 [2,0,0,0,0,0|2,0,0]=4 50 B11R2.10 c1cc2c([nH]c(=O)o2)nc1 A2Z00069818 [2,0,0,0,0,0|2,0,0]=4 51 B11R2.10 c1ccc2c(c1)[nH]c(n2)Cl A2Z00074312 [2,0,0,0,0,0|1,0,1]=4 52 B11R2.36 Cc1ccc2c(c1)nc[nH]2 A2Z00095954 [2,0,0,0,0,0|1,0,1]=4 53 B11R2.36 c1cc(cc2c1cc[nH]2)Cl A2Z00095941 [2,0,0,0,0,0|1,1,0]=4 54 B11R2.36 c1cc2c(cc1O)[nH]cn2 A2Z00070444 [2,0,0,0,0,0|1,0,1]=4 55 B11R2.36 c1cc2c(cc1O)nc[nH]2 A2Z00062450 [2,0,0,0,0,0|1,0,1]=4 56 B11R2.36 c1cc2c(cc[nH]2)cc1Br A2Z00097905 [2,0,0,0,0,0|1,1,0]=4 57 B11R2.36 c1cc2c(cc[nH]2)cc1N A2Z00096013 [2,0,0,0,0,0|2,0,0]=4 58 B13R1.19 c1cc(ccc1NC(=O)CC#N)F A2Z00025577 [0,1,1,0,0,0|2,0,0]=4 59 B13R1.2679 c1cc(c(cc1F)Cl)NC(=O)CCl A2Z00083396 [0,1,1,0,0,0|2,0,0]=4 60 B13R1.2879 c1cc(c(cc1NC(=O)CN)Cl)F A2Z00049941 [0,1,1,0,0,0|2,0,0]=4 61 B13R2.135 CCN1c2ccccc2CC1=O A2Z00074116 [1,1,0,0,0,0|2,0,0]=4 62 B13R2.135 CCn1c2ccccc2oc1=O A2Z00048030 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.359 CC1(c2ccccc2NC1=O)C A2Z00048073 [1,1,0,0,0,0|2,0,0]=4 64 B13R2.3085 CN1c2ccccc2C(=O)C1=O A2Z00077108 [1,1,0,0,0,0|1,0,1]=4 65 B13R2.4825 c1cc2c(c(c1)Br)NC(=O)C2=O A2Z00094242 [1,1,0,0,0,0|1,0,1]=4 66 B13R2.5190 Cn1c2ccc(cc2oc1=O)N A2Z00046407 [1,1,0,0,0,0|2,0,0]=4 67 B13R2.43 c1cc(cc2c1cc([nH]2)C=O)F A2Z00050318 [1,1,0,0,0,0|1,0,0]=3 68 B13R2.2121 c1cc2c(cc1CO)oc(=O)[nH]2 A2Z00057034 [1,1,0,0,0,0|2,0,0]=4 69 B13R2.5397 Cc1cc2c(c(c1)Br)oc(=O)[nH]2 A2Z00049367 [1,1,0,0,0,0|2,0,0]=4 70 B15R2.13981 CN1c2cc(c(cc2NCC1=O)Cl)Cl A2Z00070104 [0,1,0,0,0,1|1,1,0]=4 71 B15R2.1824 c1cc2c(cc1F)cc(c(=O)[nH]2)C=O A2Z00044949 [0,1,0,0,0,1|1,0,1]=4 72 B15R2.7204 Cc1c(c2cc(ccc2[nH]1)F)C(=O)O A2Z00047898 [0,2,0,0,0,0|2,0,0]=4 73 B13R2.3683 c1cc2c(cc1N)OCC(=O)N2 A2Z00068295 [0,0,1,1,0,0|2,0,0]=4 74 B13R2.3683 c1cc2c(cc1O)OCC(=O)N2 A2Z00069938 [0,0,1,1,0,0|2,0,0]=4 75 B11R1.22 CCC(=O)c1ccc(cc1)F A2Z00094033 [0,0,1,0,1,0|2,0,0]=4 76 B11R1.22 CNC(=O)c1ccc(cc1)Cl A2Z00053054 [0,0,1,0,1,0|1,1,0]=4 77 B11R1.22 c1cc(ccc1C(=O)CCl)F A2Z00094272 [0,0,1,0,1,0|2,0,0]=4 78 B11R1.22 c1cc(ccc1C(=O)CN)F A2Z00094016 [0,0,1,0,1,0|2,0,0]=4 79 B11R1.22 c1cc(ccc1C(=O)NN)Br A2Z00014663 [0,0,1,0,1,0|1,1,0]=4 80 B11R1.22 c1cc(ccc1C(=O)NN)F A2Z00014685 [0,0,1,0,1,0|1,0,0]=3 81 B13R2.32 CN1c2ccccc2CCC1=O A2Z00049373 [1,0,0,0,0,1|2,0,0]=4 82 B13R2.328 c1ccc2c(c1)c(=O)[nH]c(=O)[nH]2 A2Z00061300 [1,0,0,0,0,1|1,0,1]=4 83 B13R2.328 c1ccc2c(c1)c(cc(=O)[nH]2)O A2Z00061526 [1,0,0,0,0,1|1,0,0]=3 84 B13R2.369 CC1C(=O)Nc2ccccc2O1 A2Z00066930 [1,0,0,0,0,1|2,0,0]=4 85 B13R2.369 Cc1cc2ccccc2[nH]c1=O A2Z00094815 [1,0,0,0,0,1|2,0,0]=4 86 B13R2.369 c1ccc2c(c1)CC(C(=O)N2)N A2Z00094761 [1,0,0,0,0,1|2,0,0]=4