0 B15R2.33 NC1=C(C2=CC=CC=C2)C=C(Br)C=C1 SBB027166 [0,0,0,0,0,0|3,0,0]=3 1 B15R2.33 NC1=CC=C(Br)N=C1C2=CC=CC=C2 SBB051879 [0,0,0,0,0,0|4,0,0]=4 2 B15R2.33 O=C1C=CC(=O)C(C2=CC=CC=C2)=C1 SBB057667 [0,0,0,0,0,0|2,0,0]=2 3 B15R2.33 O=C1C=CC(Cl)=NN1C2=CC=CC=C2 SBB074380 [0,0,0,0,0,0|2,0,0]=2 4 B15R2.33 O=C1C=CC(O)=NN1C2=CC=CC=C2 SBB090754 [0,0,0,0,0,0|2,0,0]=2 5 B14R2.21 CC1=CC(C2=CC=CC=C2)=CN=N1 SBB088434 [1,0,0,0,0,0|3,0,0]=4 6 B14R2.21 CC1=CC=CC(C2=CC=CC=C2)=C1 SBB055147 [1,0,0,0,0,0|1,0,0]=2 7 B14R2.21 CC1=CC=NC(C2=CC=CC=N2)=C1 SBB059630 [1,0,0,0,0,0|3,0,0]=4 8 B14R2.21 CC1=NC(C2=CC=CC=N2)=CC=C1 SBB059628 [1,0,0,0,0,0|3,0,0]=4 9 B14R2.21 NC1=CC(C2=CC=NC=C2)=CC=C1 SBB051747 [1,0,0,0,0,0|3,0,0]=4 10 B14R2.21 NC1=CC(C2=NC=CC=C2)=CC=C1 SBB051749 [1,0,0,0,0,0|3,0,0]=4 11 B14R2.24 CC1=CC=CC=C1C2=CC=CC=C2 SBB008545 [1,0,0,0,0,0|2,0,0]=3 12 B14R2.24 FC1=CC=CC=C1C2=CC=CC=C2 SBB061479 [1,0,0,0,0,0|2,0,0]=3 13 B14R2.24 IC1=CC=CC=C1C2=CC=CC=C2 SBB059375 [1,0,0,0,0,0|2,0,0]=3 14 B14R2.24 NC1=C(C2=CC=CC=C2)C=CC=C1 SBB003867 [1,0,0,0,0,0|2,0,0]=3 15 B14R2.24 NC1=CC=CN=C1C2=CC=CC=C2 SBB051877 [1,0,0,0,0,0|3,0,0]=4 16 B14R2.24 NC1=CN=CC=C1C2=CC=CC=C2 SBB051878 [1,0,0,0,0,0|3,0,0]=4 17 B14R2.24 OC1=C(C2=CC=CC=C2)C=CC=C1 SBB060430 [1,0,0,0,0,0|1,0,1]=3 18 B16R2.2443 COC1=CC=C(N)C=C1C2=CC=CC=C2 SBB070625 [0,1,0,0,0,0|2,0,1]=4 19 B16R2.2859 NC1=CC=C(F)C=C1C2=CC=C(Cl)C=C2 SBB051736 [0,1,0,0,0,0|3,0,0]=4 20 B14R1.423 CC(=O)OCC(=O)NC1=CC=CC=C1 SBB000311 [0,0,1,0,0,0|2,0,1]=4 21 B14R1.423 OC(=O)\C=C\C(=O)NC1=CC=CC=C1 SBB003637 [0,0,1,0,0,0|2,0,0]=3 22 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2C=CC=C3 SBB054664 [0,0,0,1,0,0|3,0,0]=4 23 B16R3.2583 CC1=CN2C3=CC=CC=C3N=C2CO1 SBB081345 [0,0,0,1,0,0|2,0,1]=4 24 B16R3.2583 NC1=CC=C2NC3=C(C=CC=C3)C2=C1 SBB010689 [0,0,0,1,0,0|3,0,0]=4 25 B14R2.277 CC1=CC=C(C)N1C2=CC=CC=C2 SBB061908 [0,0,0,0,1,0|1,0,0]=2 26 B14R2.277 CC1=NN=C(S)N1C2=CC=CC=C2 SBB004459 [0,0,0,0,1,0|2,1,0]=4 27 B14R2.277 O=C1C=CC(=O)N1C2=CC=CC=C2 SBB007849 [0,0,0,0,1,0|1,0,0]=2 28 B14R2.277 O=C1CNC(=O)N1C2=CC=CC=C2 SBB035891 [0,0,0,0,1,0|2,0,1]=4 29 B14R2.277 O=C1CNC(=S)N1C2=CC=CC=C2 SBB012392 [0,0,0,0,1,0|2,0,1]=4 30 B14R2.277 O=C1CSC(=O)N1C2=CC=CC=C2 SBB035847 [0,0,0,0,1,0|2,0,1]=4 31 B14R2.277 O=C1CSC(=S)N1C2=CC=CC=C2 SBB059346 [0,0,0,0,1,0|2,0,1]=4 32 B14R2.277 O=C1NN=C(S)N1C2=CC=CC=C2 SBB072465 [0,0,0,0,1,0|3,0,0]=4 33 B14R2.277 O=C1NNC(=O)N1C2=CC=CC=C2 SBB057625 [0,0,0,0,1,0|3,0,0]=4 34 B14R2.598 CC1=CC(=O)N(C2=CC=CC=C2)N1 SBB035804 [0,0,0,0,1,0|1,0,0]=2 35 B14R2.598 CC1=CC(C)=NN1C2=CC=CC=C2 SBB029901 [0,0,0,0,1,0|2,0,0]=3 36 B14R2.598 CC1=NN(C2=CC=CC=C2)C(=O)C1 SBB003801 [0,0,0,0,1,0|1,0,1]=3 37 B14R2.598 CC1=NN(C2=CC=CC=C2)C(Cl)=C1 SBB072709 [0,0,0,0,1,0|2,0,0]=3 38 B14R2.598 CC1=NN(C2=CC=CC=C2)C(N)=C1 SBB003817 [0,0,0,0,1,0|2,0,0]=3 39 B14R2.598 CC1=NN(C2=CC=CC=C2)C(O)=C1 SBB021982 [0,0,0,0,1,0|1,0,1]=3 40 B14R2.598 CC1=NN(C2=CC=CC=N2)C(N)=C1 SBB027433 [0,0,0,0,1,0|3,0,0]=4 41 B14R2.598 NC1=NN(C2=CC=CC=C2)C(=O)C1 SBB003791 [0,0,0,0,1,0|2,0,1]=4 42 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 SBB055770 [0,0,0,0,1,0|3,0,0]=4 43 B14R2.598 O=C1CC(=O)N(C2=CC=CC=C2)N1 SBB035840 [0,0,0,0,1,0|2,0,1]=4 44 B14R2.598 O=C1NC(=O)N(C2=CC=CC=C2)N1 SBB057845 [0,0,0,0,1,0|3,0,0]=4 45 B16R2.317 CC1=CC(CC2=CC=CC=C2)=C(C)C=N1 SBB002484 [0,0,0,0,0,1|3,0,0]=4 46 B16R2.317 OC1=CC=C(Cl)C=C1CC2=CC=CC=C2 SBB056562 [0,0,0,0,0,1|2,0,1]=4 47 B13R2.3 C1=CC=C(C2=CC=CC=C2)C=C1 SBB060084 [2,0,0,0,0,0|1,0,0]=3 48 B13R2.3 C1=CC=C(C2=CC=NC=C2)C=C1 SBB008518 [2,0,0,0,0,0|2,0,0]=4 49 B13R2.3 C1=CC=[N+](C2=CC=NC=C2)C=C1 SBB057622 [2,0,0,0,0,0|1,0,1]=4 50 B15R1.111 CC1=CC=C(NC(=O)\C=C\C(=O)O)C=C1 SBB055394 [0,1,1,0,0,0|2,0,0]=4 51 B15R1.111 O=C(O)\C=C/C(=O)NC1=CC=C(I)C=C1 SBB028605 [0,1,1,0,0,0|2,0,0]=4 52 B15R1.111 O=C(O)\C=C\C(=O)NC1=CC=C(Br)C=C1 SBB001060 [0,1,1,0,0,0|2,0,0]=4 53 B15R1.111 O=C(O)\C=C\C(=O)NC1=CC=C(Cl)C=C1 SBB000655 [0,1,1,0,0,0|2,0,0]=4 54 B15R1.111 O=C(O)\C=C\C(=O)NC1=CC=C(F)C=C1 SBB000480 [0,1,1,0,0,0|2,0,0]=4 55 B15R1.120 CC1=CC(NC(=O)\C=C\C(=O)O)=CC=C1 SBB000444 [0,1,1,0,0,0|2,0,0]=4 56 B15R1.120 O=C(O)\C=C/C(=O)NC1=CC(F)=CC=C1 SBB015673 [0,1,1,0,0,0|2,0,0]=4 57 B15R1.120 O=C(O)\C=C\C(=O)NC1=CC=CC(Cl)=C1 SBB000656 [0,1,1,0,0,0|2,0,0]=4 58 B15R1.256 O=C(O)\C=C/C(=O)NC1=C(F)C=CC=C1 SBB015603 [0,1,1,0,0,0|2,0,0]=4 59 B15R1.256 O=C(O)\C=C\C(=O)NC1=C(Cl)C=CC=C1 SBB000657 [0,1,1,0,0,0|2,0,0]=4 60 B15R2.17 NCC1=CC(C2=CC=CC=C2)=CC=C1 SBB007527 [1,1,0,0,0,0|1,0,0]=3 61 B15R2.17 O=CC1=CC=CC(C2=CC=CC=C2)=C1 SBB039016 [1,1,0,0,0,0|1,0,1]=4 62 B15R2.27 CC1=CC(C2=CC=CC=C2)=CC(C)=N1 SBB060071 [1,1,0,0,0,0|2,0,0]=4 63 B15R2.28 FC1=CC=C(C2=CC(Br)=CC=C2)C=C1 SBB100889 [1,1,0,0,0,0|2,0,0]=4 64 B15R2.28 NC1=CC=C(C2=CC(F)=CC=C2)C=C1 SBB007494 [1,1,0,0,0,0|2,0,0]=4 65 B15R2.28 NC1=CC=CC(C2=CC=C(F)C=C2)=C1 SBB010211 [1,1,0,0,0,0|2,0,0]=4 66 B15R2.30 CC1=CC=CC(C2=CC(C)=CC=C2)=C1 SBB008589 [1,1,0,0,0,0|1,0,0]=3 67 B15R2.30 FC1=CC(C2=CC=CC(F)=C2)=CC=C1 SBB091096 [1,1,0,0,0,0|2,0,0]=4 68 B15R2.30 NC1=CC(C2=CC=CC(N)=C2)=CC=C1 SBB019098 [1,1,0,0,0,0|2,0,0]=4 69 B15R2.30 NC1=CC=CC(C2=CC(F)=CC=C2)=C1 SBB007489 [1,1,0,0,0,0|2,0,0]=4 70 B15R2.94 CC1=C(N)C=C(C2=CC=CC=C2)C=C1 SBB017716 [1,1,0,0,0,0|2,0,0]=4 71 B15R2.94 FC1=CC=C(C2=CC=CC=C2)C=C1Br SBB100887 [1,1,0,0,0,0|2,0,0]=4 72 B15R2.94 NC1=C(O)C=CC(C2=CC=CC=C2)=C1 SBB056916 [1,1,0,0,0,0|2,0,0]=4 73 B15R2.94 OC1=C(Br)C=C(C2=CC=CC=C2)C=C1 SBB015391 [1,1,0,0,0,0|2,0,0]=4 74 B15R2.21 NCC1=C(C2=CC=CC=C2)C=CC=C1 SBB017717 [1,1,0,0,0,0|2,0,0]=4 75 B15R2.308 CC1=CC=C(C2=CC=CC=C2N)C=C1 SBB027739 [1,1,0,0,0,0|2,0,0]=4 76 B15R2.389 FC1=CC(Br)=CC=C1C2=CC=CC=C2 SBB059345 [1,1,0,0,0,0|2,0,0]=4 77 B15R2.389 FC1=CC=C(C2=CC=CC=C2)C(F)=C1 SBB091095 [1,1,0,0,0,0|2,0,0]=4 78 B15R2.555 FC1=CC=CC=C1C2=C(F)C=CC=C2 SBB091097 [1,1,0,0,0,0|2,0,0]=4 79 B15R2.555 NC1=CC=CC=C1C2=CC=CC=C2N SBB008458 [1,1,0,0,0,0|2,0,0]=4 80 B15R2.555 OC1=CC=CC=C1C2=C(O)C=CC=C2 SBB058729 [1,1,0,0,0,0|1,0,1]=4 81 B15R2.323 CC1=CC(=O)N(C2=CC=CC=C2)N1C SBB017226 [0,1,0,0,1,0|1,0,0]=3 82 B15R2.323 CC1=CC(=S)N(C2=CC=CC=C2)N1C SBB017272 [0,1,0,0,1,0|1,1,0]=4 83 B15R2.323 O=C1C=C(Br)C(=O)N1C2=CC=CC=C2 SBB019402 [0,1,0,0,1,0|1,0,0]=3 84 B15R2.7148 CC1=CC=C(C)N1C2=CC(N)=CC=C2 SBB010749 [0,1,0,0,1,0|1,0,0]=3 85 B15R2.7148 CC1=CC=CC(N2C(=O)C=CC2=O)=C1 SBB082512 [0,1,0,0,1,0|1,0,0]=3 86 B15R2.7148 CC1=NCC(=O)N1C2=CC(N)=CC=C2 SBB014929 [0,1,0,0,1,0|1,0,1]=4 87 B15R2.7148 O=C1C=CC(=O)N1C2=CC(Cl)=CC=C2 SBB020334 [0,1,0,0,1,0|1,0,0]=3 88 B15R2.7458 CC1=CC=C(C)N1C2=C(N)C=CC=C2 SBB017992 [0,1,0,0,1,0|1,0,0]=3 89 B15R2.7458 CC1=CC=CC=C1N2C(=O)C=CC2=O SBB000264 [0,1,0,0,1,0|1,0,0]=3 90 B15R2.7458 O=C1C=CC(=O)N1C2=C(Cl)C=CC=C2 SBB000469 [0,1,0,0,1,0|1,0,0]=3 91 B15R2.7458 O=C1C=CC(=O)N1C2=C(F)C=CC=C2 SBB082516 [0,1,0,0,1,0|1,0,0]=3 92 B15R2.7458 O=C1C=CC(=O)N1C2=C(I)C=CC=C2 SBB019844 [0,1,0,0,1,0|1,0,0]=3 93 B15R2.7458 O=C1C=CC(=O)N1C2=CC=CC=C2Br SBB017327 [0,1,0,0,1,0|1,0,0]=3 94 B15R2.18925 CC1=CC=C(C)N1C2=CC=C(Br)C=C2 SBB079457 [0,1,0,0,1,0|1,0,0]=3 95 B15R2.18925 CC1=CC=C(C)N1C2=CC=C(N)C=C2 SBB010748 [0,1,0,0,1,0|1,0,0]=3 96 B15R2.18925 CC1=CC=C(N2C(=O)C=CC2=O)C=C1 SBB000265 [0,1,0,0,1,0|1,0,0]=3 97 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(Br)C=C2 SBB061832 [0,1,0,0,1,0|1,0,0]=3 98 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(Cl)C=C2 SBB082505 [0,1,0,0,1,0|1,0,0]=3 99 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(F)C=C2 SBB082506 [0,1,0,0,1,0|1,0,0]=3 100 B15R2.18925 O=C1C=CC(=O)N1C2=CC=C(I)C=C2 SBB002109 [0,1,0,0,1,0|1,0,0]=3 101 B15R2.309 CC1=CC(=O)N(C2=CC=C(Br)C=C2)N1 SBB023394 [0,1,0,0,1,0|1,0,0]=3 102 B15R2.309 CC1=CC(=O)N(C2=CC=C(Cl)C=C2)N1 SBB023400 [0,1,0,0,1,0|1,0,0]=3 103 B15R2.309 CC1=CC(=O)N(C2=CC=C(I)C=C2)N1 SBB023401 [0,1,0,0,1,0|1,0,0]=3 104 B15R2.309 CC1=CC(C)=NN1C2=CC=C(N)C=C2 SBB010767 [0,1,0,0,1,0|2,0,0]=4 105 B15R2.309 CC1=CC=C(N2N=C(C)C=C2N)C=C1 SBB048418 [0,1,0,0,1,0|2,0,0]=4 106 B15R2.309 CC1=CC=C(N2N=C(C)CC2=O)C=C1 SBB003677 [0,1,0,0,1,0|1,0,1]=4 107 B15R2.309 CC1=CC=C(N2NC(C)=CC2=O)C=C1 SBB023392 [0,1,0,0,1,0|1,0,0]=3 108 B15R2.309 CC1=NN(C2=CC=C(Cl)C=C2)C(=O)C1 SBB040981 [0,1,0,0,1,0|1,0,1]=4 109 B15R2.309 CC1=NN(C2=CC=C(Cl)C=C2)C(N)=C1 SBB003472 [0,1,0,0,1,0|2,0,0]=4 110 B15R2.309 CC1=NN(C2=CC=C(F)C=C2)C(N)=C1 SBB023715 [0,1,0,0,1,0|2,0,0]=4 111 B15R2.309 CC1=NN(C2=CC=C(N)C=C2)C(=O)C1 SBB018824 [0,1,0,0,1,0|1,0,1]=4 112 B15R2.321 CC1=NN(C2=CC=CC=C2)C(=O)C1N SBB072453 [0,1,0,0,1,0|1,0,1]=4 113 B15R2.321 CC1=NN(C2=CC=CC=C2)C(C)=C1N SBB035953 [0,1,0,0,1,0|2,0,0]=4 114 B15R2.334 CC1=CC(=O)N(C2=CC=CC(Br)=C2)N1 SBB023399 [0,1,0,0,1,0|1,0,0]=3 115 B15R2.334 CC1=CC(N2N=C(C)CC2=O)=CC=C1 SBB023555 [0,1,0,0,1,0|1,0,1]=4 116 B15R2.334 CC1=CC(N2NC(C)=CC2=O)=CC=C1 SBB023393 [0,1,0,0,1,0|1,0,0]=3 117 B15R2.334 CC1=CC=CC(N2N=C(C)C=C2O)=C1 SBB023421 [0,1,0,0,1,0|1,0,1]=4 118 B15R2.334 CC1=NN(C2=CC(Cl)=CC=C2)C(N)=C1 SBB011183 [0,1,0,0,1,0|2,0,0]=4 119 B15R2.334 CC1=NN(C2=CC=CC(Cl)=C2)C(=O)C1 SBB058487 [0,1,0,0,1,0|1,0,1]=4 120 B15R2.334 CC1=NN(C2=CC=CC(N)=C2)C(=O)C1 SBB300339 [0,1,0,0,1,0|1,0,1]=4 121 B15R2.557 CC1=CC(=O)N(C2=C(Cl)C=CC=C2)N1 SBB003461 [0,1,0,0,1,0|1,0,0]=3 122 B15R2.557 CC1=CC(C)=NN1C2=C(Cl)C=CC=C2 SBB023587 [0,1,0,0,1,0|2,0,0]=4 123 B15R2.557 CC1=CC(C)=NN1C2=C(N)C=CC=C2 SBB014842 [0,1,0,0,1,0|2,0,0]=4 124 B15R2.557 CC1=NN(C2=C(C)C=CC=C2)C(=O)C1 SBB040982 [0,1,0,0,1,0|1,0,1]=4 125 B15R2.557 CC1=NN(C2=C(F)C=CC=C2)C(N)=C1 SBB024008 [0,1,0,0,1,0|2,0,0]=4 126 B17R2.1933 COC1=C(N)C=C(C)C(C2=CC=CC=C2)=C1 SBB017785 [0,2,0,0,0,0|2,0,0]=4 127 B15R2.38 NC1=CC=CC=C1NC2=CC=CC=C2 SBB000244 [0,0,1,1,0,0|2,0,0]=4 128 B15R2.21211 CN1C(=O)C=C(C=O)C2=C1C=CC=C2 SBB013184 [0,0,1,1,0,0|1,0,1]=4 129 B15R2.29 CC1=CC=C(NC2=CC=CC=C2)C=C1 SBB059224 [0,0,1,1,0,0|1,0,0]=3 130 B15R2.29 FC1=CC=C(NC2=CC=CC=C2)C=C1 SBB090586 [0,0,1,1,0,0|2,0,0]=4 131 B15R2.29 NC1=CC=C(NC2=CC=CC=C2)C=C1 SBB056688 [0,0,1,1,0,0|2,0,0]=4 132 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)O2 SBB060835 [1,0,0,1,0,0|1,0,1]=4 133 B15R3.3 C1=CC=C2C(=C1)CC3=C2C=CC=C3 SBB040920 [1,0,0,1,0,0|2,0,0]=4 134 B15R3.3 C1=CC=C2C(=C1)NC3=C2C=CC=C3 SBB040883 [1,0,0,1,0,0|2,0,0]=4 135 B15R3.3 C1=CC=C2C(=C1)SC3=C2C=CC=C3 SBB058907 [1,0,0,1,0,0|1,1,0]=4 136 B17R3.1513 COC1=CC2=C(C=C1)NC3=CC=CC=C32 SBB051117 [0,1,0,1,0,0|2,0,0]=4 137 B13R1.45 CN(C)\C=C/C(=O)C1=CC=CC=C1 SBB023014 [0,0,1,0,1,0|1,0,1]=4 138 B13R1.45 O=C(O)\C=C\C(=O)C1=CC=CC=C1 SBB007952 [0,0,1,0,1,0|2,0,0]=4 139 B13R1.348 N(C(=O)CC(C)=O)C1=CC=CC=C1 SBB003774 [0,0,1,0,1,0|1,0,1]=4 140 B13R2.10 CC1=CN(C2=CC=CC=C2)N=C1 SBB116130 [1,0,0,0,1,0|1,0,0]=3 141 B13R2.10 ClC1=CN(C2=CC=CC=C2)N=C1 SBB089480 [1,0,0,0,1,0|2,0,0]=4 142 B13R2.10 O=C1C=CN(C2=CC=CC=C2)N1 SBB087441 [1,0,0,0,1,0|2,0,0]=4 143 B13R2.15 SC1=NC=CN1C2=CC=CC=C2 SBB071978 [1,0,0,0,1,0|2,0,0]=4 144 B15R2.31 CC1=CC=CC(NC2=CC=CC=C2)=C1 SBB059080 [1,0,0,0,0,1|1,0,0]=3 145 B15R2.31 ClC1=CC(NC2=CC=CC=C2)=CC=C1 SBB058577 [1,0,0,0,0,1|2,0,0]=4 146 B15R2.31 FC1=CC=CC(NC2=CC=CC=C2)=C1 SBB090584 [1,0,0,0,0,1|2,0,0]=4 147 B15R2.31 NC1=CC(NC2=CC=CC=C2)=CC=C1 SBB001601 [1,0,0,0,0,1|2,0,0]=4 148 B15R2.31 NC1=CC(OC2=CC=CC=C2)=CC=C1 SBB071443 [1,0,0,0,0,1|2,0,0]=4 149 B15R2.31 OC1=CC(NC2=CC=CC=C2)=CC=C1 SBB072927 [1,0,0,0,0,1|2,0,0]=4 150 B15R2.325 CC1=NN(CC2=CC=CC=C2)C(N)=C1 SBB004439 [0,0,0,0,1,1|2,0,0]=4