0 B17R2.246 CC(=O)Nc1ccc(cn1)c2ccccc2 CSC000053787 [0,0,0,0,0,0|3,0,0]=3 1 B17R2.246 CC(=O)Oc1ccc(cc1)c2ccccc2 CSC000002290 [0,0,0,0,0,0|2,0,0]=2 2 B17R2.246 FC(F)Oc1ccc(cc1)c2ccccc2 CSC000007887 [0,0,0,0,0,0|3,0,1]=4 3 B17R2.246 NC(=O)Cc1ccc(cc1)c2ccccc2 CSC000003337 [0,0,0,0,0,0|1,0,0]=1 4 B17R2.246 OC(=O)Cc1ccc(cc1)c2cccnc2 CSC000067272 [0,0,0,0,0,0|1,0,0]=1 5 B17R2.246 OC(=O)Cc1ccc(cc1)c2ccncc2 CSC000049109 [0,0,0,0,0,0|1,0,0]=1 6 B18R2.271 CC(=O)Nc1ccc(cc1)c2ccc(cc2)F CSC015185186 [0,1,0,0,0,0|2,0,0]=3 7 B18R2.271 OC(=O)Cc1ccc(cc1)c2ccc(cc2)Cl CSC000015650 [0,1,0,0,0,0|0,0,0]=1 8 B18R2.2609 CNC(=O)Cc1ccc(cc1)c2ccccc2 CSC046269612 [0,1,0,0,0,0|1,0,0]=2 9 B18R2.2609 COC(=O)Cc1ccc(cc1)c2ccccc2 CSC020647734 [0,1,0,0,0,0|0,0,0]=1 10 B18R2.2609 NNC(=O)Cc1ccc(cc1)c2ccccc2 CSC015184197 [0,1,0,0,0,0|1,0,0]=2 11 B18R2.3884 OC(=O)Cc1ccc(cc1)c2cccc(c2)Cl CSC000015600 [0,1,0,0,0,0|0,0,0]=1 12 B18R2.3884 OC(=O)Cc1ccc(cc1)c2cccc(c2)F CSC000012256 [0,1,0,0,0,0|0,0,0]=1 13 B18R2.4727 OC(=O)Cc1ccc(cc1)c2ccccc2Cl CSC000015594 [0,1,0,0,0,0|0,0,0]=1 14 B18R2.32246 CC(C)(O)Cc1ccc(cc1)c2ccccc2 CSC046119963 [0,1,0,0,0,0|1,0,1]=3 15 B18R2.32246 CS(=O)(=O)Nc1ccc(cc1)c2ccccc2 CSC000386376 [0,1,0,0,0,0|2,0,1]=4 16 B16R2.85 CC(O)c1ccc(cc1)c2ccccc2 CSC011216184 [0,0,0,0,1,0|1,0,1]=3 17 B16R2.85 NC(=O)c1ccc(cc1)c2ccccc2 CSC000003340 [0,0,0,0,1,0|1,0,0]=2 18 B16R2.85 OC(=O)c1ccc(cc1)c2cccnc2 CSC011399805 [0,0,0,0,1,0|1,0,0]=2 19 B16R2.85 OC(=O)c1ccc(cc1)c2ccncc2 CSC011410164 [0,0,0,0,1,0|1,0,0]=2 20 B16R2.85 OC(=O)c1ccc(cc1)c2cncnc2 CSC011688927 [0,0,0,0,1,0|2,0,0]=3 21 B16R2.85 [O-][N+](=O)c1ccc(cc1)c2ccccn2 CSC009992643 [0,0,0,0,1,0|2,0,1]=4 22 B16R2.157 NC(=O)Cc1nc(cs1)c2ccccc2 CSC000011801 [0,0,0,0,1,0|3,0,0]=4 23 B16R2.157 NC(=O)Cn1ccc(n1)c2ccccc2 CSC000071549 [0,0,0,0,1,0|3,0,0]=4 24 B16R2.158 NC(=O)Cc1ccc(cc1)n2cccc2 CSC000045621 [0,0,0,0,1,0|2,0,0]=3 25 B18R2.311 CC(=O)Nc1ccc(cc1)Cc2ccncc2 CSC020600300 [0,0,0,0,0,1|3,0,0]=4 26 B18R2.311 NC(=O)Nc1ccc(cc1)Oc2ccccc2 CSC000624576 [0,0,0,0,0,1|2,0,0]=3 27 B18R2.7098 CC(C)NCc1ccc(cc1)c2ccccc2 CSC000486297 [0,0,0,0,0,1|2,0,1]=4 28 B15R2.1 COc1ccc(cc1)c2ccccc2 CSC000005834 [2,0,0,0,0,0|1,0,1]=4 29 B15R2.1 CSc1ccc(cc1)c2ccccc2 CSC000052044 [2,0,0,0,0,0|1,0,1]=4 30 B15R2.1 NCc1ccc(cc1)c2ccccc2 CSC000168354 [2,0,0,0,0,0|1,0,0]=3 31 B15R2.1 OCc1ccc(cc1)c2ccccn2 CSC000067868 [2,0,0,0,0,0|1,0,0]=3 32 B17R2.30 CCNCc1ccc(cc1)c2ccccc2 CSC000256191 [1,1,0,0,0,0|1,0,1]=4 33 B17R2.30 N#CCOc1ccc(cc1)c2ccccc2 CSC000256687 [1,1,0,0,0,0|1,0,1]=4 34 B17R2.30 NCCOc1ccc(cc1)c2ccccc2 CSC000284922 [1,1,0,0,0,0|1,0,1]=4 35 B17R2.30 OCCOc1ccc(cc1)c2ccccc2 CSC000353643 [1,1,0,0,0,0|0,0,1]=3 36 B17R2.213 Nc1ccc(cc1)c2ccc(cc2)[N+](=O)[O-] CSC000009234 [0,1,0,0,1,0|1,0,1]=4 37 B17R2.213 OC(=O)c1ccc(cc1)c2ccc(cc2)Cl CSC011219960 [0,1,0,0,1,0|0,0,0]=2 38 B17R2.213 OC(=O)c1ccc(cc1)c2ccc(cc2)F CSC011217427 [0,1,0,0,1,0|0,0,0]=2 39 B17R2.213 OC(=O)c1ccc(cn1)c2ccc(cc2)F CSC011781142 [0,1,0,0,1,0|1,0,0]=3 40 B17R2.213 Oc1ccc(cc1)c2ccc(cc2)[N+](=O)[O-] CSC000009330 [0,1,0,0,1,0|1,0,1]=4 41 B17R2.2464 NS(=O)(=O)c1ccc(cc1)c2ccccc2 CSC000262077 [0,1,0,0,1,0|1,0,1]=4 42 B17R2.3358 Cc1cccc(c1)c2ccc(cc2)C(=O)O CSC011216982 [0,1,0,0,1,0|0,0,0]=2 43 B17R2.3358 OC(=O)c1ccc(cc1)c2cccc(c2)Cl CSC011219955 [0,1,0,0,1,0|0,0,0]=2 44 B17R2.3358 OC(=O)c1ccc(cc1)c2cccc(c2)F CSC011217428 [0,1,0,0,1,0|0,0,0]=2 45 B17R2.3358 OC(=O)c1ccc(cc1)c2cccc(c2)O CSC010140794 [0,1,0,0,1,0|0,0,0]=2 46 B17R2.3935 Cc1ccccc1c2ccc(cc2)C(=O)O CSC011216752 [0,1,0,0,1,0|0,0,0]=2 47 B17R2.3935 NC(=O)c1ccc(cc1)c2ccccc2F CSC000023390 [0,1,0,0,1,0|1,0,0]=3 48 B17R2.3935 OC(=O)c1ccc(cc1)c2ccccc2Cl CSC011217429 [0,1,0,0,1,0|0,0,0]=2 49 B17R2.3935 OC(=O)c1ccc(cc1)c2ccccc2F CSC011217417 [0,1,0,0,1,0|0,0,0]=2 50 B17R2.2443 COC(=O)Cc1csc(n1)c2ccccc2 CSC000169096 [0,1,0,0,1,0|2,0,0]=4 51 B17R2.3276 OC(=O)Cn1cc(cn1)c2ccc(cc2)F CSC006004940 [0,1,0,0,1,0|2,0,0]=4 52 B17R2.2445 COC(=O)Cc1ccc(cc1)n2cccc2 CSC000045961 [0,1,0,0,1,0|1,0,0]=3 53 B19R2.2735 CCC(=O)Nc1ccc(cc1)Nc2ccccc2 CSC046261827 [0,1,0,0,0,1|2,0,0]=4 54 B19R2.2735 CCC(=O)Nc1ccc(cc1)Oc2ccccc2 CSC000482252 [0,1,0,0,0,1|2,0,0]=4 55 B19R2.2735 NCC(=O)Nc1ccc(cc1)Oc2ccccc2 CSC000589772 [0,1,0,0,0,1|2,0,0]=4 56 B19R2.7504 CC(=O)Nc1ccc(cc1)Oc2ccccc2Cl CSC046223885 [0,1,0,0,0,1|2,0,0]=4 57 B19R2.12215 CC(=O)Nc1ccc(cc1)Oc2ccc(cc2)Cl CSC046179971 [0,1,0,0,0,1|2,0,0]=4 58 B19R2.12215 CC(=O)Nc1ccc(cc1)Sc2ccc(cc2)Br CSC046196384 [0,1,0,0,0,1|2,0,0]=4 59 B19R2.13479 CC(=O)Oc1ccc(cc1)C(=O)c2ccccc2 CSC020568721 [0,1,0,0,0,1|2,0,0]=4 60 B19R2.337 CC(CO)NCc1ccc(cc1)c2ccccc2 CSC000561378 [0,1,0,0,0,1|1,0,1]=4 61 B19R2.337 CNC(=O)COc1ccc(nc1)c2ccccc2 CSC028231070 [0,1,0,0,0,1|2,0,0]=4 62 B19R2.2631 CC(Oc1ccc(cc1)c2ccccc2)C(=O)N CSC000577350 [0,1,0,0,0,1|1,0,0]=3 63 B19R2.4206 CC(NC(=O)N)c1ccc(cc1)c2ccccc2 CSC046196910 [0,1,0,0,0,1|1,0,0]=3 64 B19R2.297 CC(C)(O)Cc1ccc(cc1)c2ccc(cc2)O CSC063366134 [0,2,0,0,0,0|1,0,1]=4 65 B19R2.378 CCNC(=O)Nc1ccc(cc1)c2ccccc2 CSC000586455 [0,2,0,0,0,0|2,0,0]=4 66 B19R2.378 COCC(=O)Nc1ccc(cc1)c2ccccc2 CSC000384937 [0,2,0,0,0,0|1,0,0]=3 67 B19R2.378 O=C(CC#N)Nc1ccc(cc1)c2ccccc2 CSC000950094 [0,2,0,0,0,0|2,0,0]=4 68 B19R2.91916 OC(=O)Cc1ccc(cc1)c2cc(cc(c2)F)F CSC020627236 [0,2,0,0,0,0|0,0,0]=2 69 B19R3.252868 NC(=O)Nc1ccc2c(c1)oc3c2cccc3 CSC047472467 [0,1,0,1,0,0|2,0,0]=4 70 B15R2.59 NC(=O)c1ccc(o1)c2ccccc2 CSC000010916 [0,0,0,0,2,0|2,0,0]=4 71 B15R2.59 OC(=O)c1cc(c[nH]1)c2ccccc2 CSC000118222 [0,0,0,0,2,0|1,0,0]=3 72 B15R2.60 CC(=O)c1ccc(cc1)c2ccsc2 CSC011216506 [0,0,0,0,2,0|2,0,0]=4 73 B15R2.60 NC(=O)c1ccc(cc1)n2cccc2 CSC000223275 [0,0,0,0,2,0|2,0,0]=4 74 B15R2.60 OC(=O)c1ccc(cc1)c2ccoc2 CSC011954318 [0,0,0,0,2,0|1,0,0]=3 75 B15R2.60 OC(=O)c1ccc(cc1)c2ccsc2 CSC011218173 [0,0,0,0,2,0|1,0,0]=3 76 B15R2.60 OC(=O)c1ccc(nc1)c2ccco2 CSC000068329 [0,0,0,0,2,0|2,0,0]=4 77 B17R2.141 [O-][N+](=O)c1ccc(cc1)Sc2ccccc2 CSC000002582 [0,0,0,0,1,1|1,0,1]=4 78 B19R2.13470 CC(=O)Nc1ccc(cc1)NCc2ccccc2 CSC000223383 [0,0,0,0,0,2|2,0,0]=4 79 B19R2.13470 CC(=O)Nc1ccc(cc1)OCc2ccccc2 CSC000151623 [0,0,0,0,0,2|2,0,0]=4 80 B19R2.13470 CC(=O)Oc1ccc(cc1)OCc2ccccc2 CSC000002407 [0,0,0,0,0,2|2,0,0]=4 81 B19R2.192 CC(O)CNCc1ccc(cc1)c2ccccc2 CSC000490207 [0,0,0,0,0,2|1,0,1]=4 82 B19R2.192 CC(O)CNCc1ccc(cc1)c2ccccc2 CSC000490207 [0,0,0,0,0,2|1,0,1]=4