0 B12R2.18 Cn1c2ccccc2oc1=O CSC000171226 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.3085 CN1C(=O)c2ccccc2C1=O CSC000170155 [0,1,0,0,0,0|3,0,0]=4 2 B11R1.36 CN(C)C(=O)c1ccccc1 CSC000159565 [0,0,1,0,0,0|3,0,0]=4 3 B11R1.36 NC(=O)C(O)c1ccccc1 CSC011200849 [0,0,1,0,0,0|0,0,2]=3 4 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 CSC009816934 [0,0,1,0,0,0|0,0,2]=3 5 B11R1.40 CCC(=O)Nc1ccccc1 CSC000153483 [0,0,1,0,0,0|1,0,1]=3 6 B11R1.40 CCC(=O)Nc1ccccn1 CSC000017115 [0,0,1,0,0,0|2,0,1]=4 7 B11R1.40 CCC(=O)Nc1cccnc1 CSC000159158 [0,0,1,0,0,0|2,0,1]=4 8 B11R1.40 CCC(=O)Oc1ccccc1 CSC000001944 [0,0,1,0,0,0|2,0,1]=4 9 B11R1.40 CNC(=O)Nc1ccccc1 CSC000178567 [0,0,1,0,0,0|2,0,0]=3 10 B11R1.40 CNC(=O)Nc1ccccn1 CSC000024314 [0,0,1,0,0,0|3,0,0]=4 11 B11R1.40 CNC(=O)Nc1cccnc1 CSC000233841 [0,0,1,0,0,0|3,0,0]=4 12 B11R1.40 COC(=O)Oc1ccccc1 CSC000020726 [0,0,1,0,0,0|3,0,0]=4 13 B11R1.40 NCC(=O)Nc1ccccc1 CSC000168422 [0,0,1,0,0,0|1,0,1]=3 14 B11R1.40 NCC(=O)Nc1ccncc1 CSC000238581 [0,0,1,0,0,0|2,0,1]=4 15 B11R1.222 CNC(=O)c1ccccc1Br CSC000155073 [0,0,1,0,0,0|3,0,0]=4 16 B11R1.222 CNC(=O)c1ccccc1C CSC000159864 [0,0,1,0,0,0|3,0,0]=4 17 B11R1.222 CNC(=O)c1ccccc1Cl CSC000159797 [0,0,1,0,0,0|3,0,0]=4 18 B11R1.222 CNC(=O)c1ccccc1Cl CSC000159797 [0,0,1,0,0,0|3,0,0]=4 19 B11R1.222 CNC(=O)c1ccccc1I CSC000155083 [0,0,1,0,0,0|3,0,0]=4 20 B11R1.222 CNC(=O)c1ccccc1O CSC000185920 [0,0,1,0,0,0|3,0,0]=4 21 B11R1.222 COC(=O)c1ccccc1Cl CSC000150121 [0,0,1,0,0,0|3,0,0]=4 22 B11R1.222 COC(=O)c1ccccc1I CSC000148710 [0,0,1,0,0,0|3,0,0]=4 23 B11R1.222 NNC(=O)c1ccccc1Cl CSC000186534 [0,0,1,0,0,0|3,0,0]=4 24 B11R1.222 NNC(=O)c1ccccc1I CSC000190081 [0,0,1,0,0,0|3,0,0]=4 25 B11R1.222 NNC(=O)c1ccccc1O CSC000186518 [0,0,1,0,0,0|3,0,0]=4 26 B13R2.32 Cn1ncc2ccccc2c1=O CSC015946782 [0,0,0,0,0,1|2,0,1]=4 27 B10R1.61 NC(=O)c1ccccc1Br CSC000162158 [1,0,1,0,0,0|2,0,0]=4 28 B10R1.61 NC(=O)c1ccccc1Cl CSC000162159 [1,0,1,0,0,0|2,0,0]=4 29 B10R1.61 NC(=O)c1ccccc1I CSC000162227 [1,0,1,0,0,0|2,0,0]=4 30 B12R1.20 NC(=O)C(O)c1ccc(cc1)Cl CSC011626263 [0,1,1,0,0,0|0,0,2]=4 31 B12R1.34 CN(C(=O)CN)c1ccccc1 CSC000174886 [0,1,1,0,0,0|2,0,0]=4 32 B12R1.34 NNC(=O)C(O)c1ccccc1 CSC011203043 [0,1,1,0,0,0|0,0,2]=4 33 B12R1.253 NC(=O)C(F)(F)c1ccccc1 CSC000008717 [0,1,1,0,0,0|1,0,1]=4 34 B12R1.478 CCC(C(=O)N)c1ccccc1 CSC000192809 [0,1,1,0,0,0|1,0,1]=4 35 B12R1.478 COC(C(=O)N)c1ccccc1 CSC011347434 [0,1,1,0,0,0|0,0,2]=4 36 B12R1.32 CCNC(=O)Nc1ccccc1 CSC000163281 [0,1,1,0,0,0|1,0,1]=4 37 B12R1.32 CNCC(=O)Nc1ccccc1 CSC000168086 [0,1,1,0,0,0|1,0,1]=4 38 B12R1.32 NCCC(=O)Nc1ccccc1 CSC011195676 [0,1,1,0,0,0|1,0,1]=4 39 B12R1.43 CC(C)C(=O)Nc1ccccc1 CSC000153472 [0,1,1,0,0,0|1,0,1]=4 40 B12R1.43 NC(=O)C(=O)Nc1ccccc1 CSC000015721 [0,1,1,0,0,0|0,0,0]=2 41 B12R1.49 CCC(=O)Nc1ccc(cc1)Br CSC000153582 [0,1,1,0,0,0|1,0,1]=4 42 B12R1.49 CCC(=O)Nc1ccc(cc1)C CSC000153933 [0,1,1,0,0,0|1,0,1]=4 43 B12R1.49 CCC(=O)Nc1ccc(cc1)Cl CSC000154025 [0,1,1,0,0,0|1,0,1]=4 44 B12R1.49 CCC(=O)Nc1ccc(cc1)F CSC000153719 [0,1,1,0,0,0|1,0,1]=4 45 B12R1.49 CCC(=O)Nc1ccc(cc1)O CSC000243810 [0,1,1,0,0,0|1,0,1]=4 46 B12R1.49 CNC(=O)Nc1ccc(cc1)Br CSC000235171 [0,1,1,0,0,0|2,0,0]=4 47 B12R1.49 CNC(=O)Nc1ccc(cc1)F CSC000178572 [0,1,1,0,0,0|2,0,0]=4 48 B12R1.49 Cc1ccc(cc1)NC(=O)CN CSC000168395 [0,1,1,0,0,0|1,0,1]=4 49 B12R1.49 Cc1ccc(cc1)NC(=O)CO CSC000246325 [0,1,1,0,0,0|0,0,2]=4 50 B12R1.49 NCC(=O)Nc1ccc(cc1)Br CSC000168324 [0,1,1,0,0,0|1,0,1]=4 51 B12R1.49 NCC(=O)Nc1ccc(cc1)Cl CSC000168449 [0,1,1,0,0,0|1,0,1]=4 52 B12R1.49 NCC(=O)Nc1ccc(cc1)F CSC000168424 [0,1,1,0,0,0|1,0,1]=4 53 B12R1.49 NNC(=O)Nc1ccc(cc1)Br CSC000744892 [0,1,1,0,0,0|2,0,0]=4 54 B12R1.49 NNC(=O)Nc1ccc(cc1)Cl CSC000756480 [0,1,1,0,0,0|2,0,0]=4 55 B12R1.50 CCC(=O)Nc1cccc(c1)Br CSC000153628 [0,1,1,0,0,0|1,0,1]=4 56 B12R1.50 CCC(=O)Nc1cccc(c1)C CSC000153655 [0,1,1,0,0,0|1,0,1]=4 57 B12R1.50 CCC(=O)Nc1cccc(c1)Cl CSC000153961 [0,1,1,0,0,0|1,0,1]=4 58 B12R1.50 CCC(=O)Nc1cccc(c1)F CSC000153973 [0,1,1,0,0,0|1,0,1]=4 59 B12R1.50 CCC(=O)Nc1cccc(c1)O CSC000158609 [0,1,1,0,0,0|1,0,1]=4 60 B12R1.50 CNC(=O)Nc1cccc(c1)Br CSC000235173 [0,1,1,0,0,0|2,0,0]=4 61 B12R1.50 CNC(=O)Nc1cccc(c1)C CSC000178579 [0,1,1,0,0,0|2,0,0]=4 62 B12R1.50 CNC(=O)Nc1cccc(c1)Cl CSC000178564 [0,1,1,0,0,0|2,0,0]=4 63 B12R1.50 CNC(=O)Nc1cccc(c1)F CSC000235183 [0,1,1,0,0,0|2,0,0]=4 64 B12R1.50 Cc1cccc(c1)NC(=O)CN CSC000168384 [0,1,1,0,0,0|1,0,1]=4 65 B12R1.50 Cc1cccc(c1)NC(=O)CO CSC000749660 [0,1,1,0,0,0|0,0,2]=4 66 B12R1.50 NCC(=O)Nc1cccc(c1)Br CSC000168392 [0,1,1,0,0,0|1,0,1]=4 67 B12R1.50 NCC(=O)Nc1cccc(c1)Cl CSC000168427 [0,1,1,0,0,0|1,0,1]=4 68 B12R1.50 NCC(=O)Nc1cccc(c1)F CSC000168492 [0,1,1,0,0,0|1,0,1]=4 69 B12R1.50 NNC(=O)Nc1cccc(c1)Cl CSC000752571 [0,1,1,0,0,0|2,0,0]=4 70 B12R1.371 CCC(=O)Nc1ccccc1Br CSC000153536 [0,1,1,0,0,0|1,0,1]=4 71 B12R1.371 CCC(=O)Nc1ccccc1C CSC000153667 [0,1,1,0,0,0|1,0,1]=4 72 B12R1.371 CCC(=O)Nc1ccccc1Cl CSC000153746 [0,1,1,0,0,0|1,0,1]=4 73 B12R1.371 CCC(=O)Nc1ccccc1F CSC000154229 [0,1,1,0,0,0|1,0,1]=4 74 B12R1.371 CCC(=O)Nc1ccccc1I CSC000154056 [0,1,1,0,0,0|1,0,1]=4 75 B12R1.371 CNC(=O)Nc1ccccc1C CSC000235315 [0,1,1,0,0,0|2,0,0]=4 76 B12R1.371 CNC(=O)Nc1ccccc1Cl CSC000178583 [0,1,1,0,0,0|2,0,0]=4 77 B12R1.371 Cc1ccccc1NC(=O)CN CSC000168393 [0,1,1,0,0,0|1,0,1]=4 78 B12R1.371 NCC(=O)Nc1ccccc1Cl CSC000168390 [0,1,1,0,0,0|1,0,1]=4 79 B12R1.371 NCC(=O)Nc1ccccc1F CSC000168463 [0,1,1,0,0,0|1,0,1]=4 80 B12R1.75 CC(=O)Nc1ccccc1C#N CSC000151996 [0,1,1,0,0,0|1,0,1]=4 81 B12R1.75 CCc1ccccc1NC(=O)C CSC000154698 [0,1,1,0,0,0|1,0,1]=4 82 B12R1.75 CCc1ccccc1NC(=O)N CSC011196910 [0,1,1,0,0,0|1,0,1]=4 83 B12R1.24 COC(=O)c1cccc(c1N)Br CSC011356556 [0,1,1,0,0,0|2,0,0]=4 84 B12R1.24 COC(=O)c1cccc(c1N)Cl CSC011356568 [0,1,1,0,0,0|2,0,0]=4 85 B12R1.24 COC(=O)c1cccc(c1N)F CSC000707970 [0,1,1,0,0,0|2,0,0]=4 86 B12R1.24 COC(=O)c1cccc(c1N)I CSC000055437 [0,1,1,0,0,0|2,0,0]=4 87 B12R1.308 CCNC(=O)c1ccccc1N CSC000205978 [0,1,1,0,0,0|1,0,1]=4 88 B12R1.354 COC(=O)c1cc(ccc1N)C CSC000216452 [0,1,1,0,0,0|2,0,0]=4 89 B12R1.354 COC(=O)c1cc(ccc1N)Cl CSC000172362 [0,1,1,0,0,0|2,0,0]=4 90 B12R1.354 COC(=O)c1cc(ccc1N)F CSC000173281 [0,1,1,0,0,0|2,0,0]=4 91 B12R1.1703 COC(=O)c1ccc(cc1N)Cl CSC000170103 [0,1,1,0,0,0|2,0,0]=4 92 B12R1.1703 COC(=O)c1ccc(cc1N)F CSC000740600 [0,1,1,0,0,0|2,0,0]=4 93 B12R1.1703 COC(=O)c1ccc(cc1N)I CSC010172136 [0,1,1,0,0,0|2,0,0]=4 94 B12R1.3441 COC(=O)c1c(cccc1Br)N CSC010253892 [0,1,1,0,0,0|2,0,0]=4 95 B12R2.32 CSc1nc2ccccc2[nH]1 CSC000169833 [1,1,0,0,0,0|1,1,0]=4 96 B14R2.1019 CCc1nc2ccccc2c(=O)[nH]1 CSC011386804 [0,1,0,0,0,1|1,0,1]=4 97 B14R2.1019 CSc1nc2ccccc2c(=O)[nH]1 CSC015683295 [0,1,0,0,0,1|0,1,1]=4 98 B14R2.8235 Cc1ccc2nc([nH]c(=O)c2c1)C CSC011386839 [0,1,0,0,0,1|1,0,1]=4 99 B14R2.8235 Cc1nc2ccc(cc2c(=O)[nH]1)Br CSC000741707 [0,1,0,0,0,1|1,0,1]=4 100 B14R2.8235 Cc1nc2ccc(cc2c(=O)[nH]1)Cl CSC011386830 [0,1,0,0,0,1|1,0,1]=4 101 B14R2.8235 Cc1nc2ccc(cc2c(=O)[nH]1)O CSC011996445 [0,1,0,0,0,1|1,0,1]=4 102 B14R2.450 Cc1c(oc2c1cccc2)C(=O)N CSC000192827 [0,2,0,0,0,0|2,0,0]=4 103 B12R1.107 NC(=O)CS(=O)c1ccccc1 CSC000064346 [0,0,1,0,0,1|1,0,0]=3 104 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [0,0,1,0,0,1|1,0,1]=4 105 B12R1.27 CCC(=O)NNc1ccccc1 CSC000001587 [0,0,1,0,0,1|1,0,1]=4 106 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [0,0,1,0,0,1|2,0,0]=4 107 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [0,0,1,0,0,1|2,0,0]=4 108 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [0,0,1,0,0,1|0,0,2]=4