0 B13R2.328 CC1=C2C=CC=CC2=NC(=N1)N Z57166964 [0,0,0,0,0,0|1,0,3]=4 1 B13R2.328 CC1=C2CCCCC2=NC(=N1)N Z85923113 [0,0,0,0,0,0|1,0,0]=1 2 B13R2.328 CC1=C2CNCCC2=CC(=C1)Cl Z1949076354 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.328 CC1=C2CNCCC2=CC(=C1)F Z1224524481 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.328 CC1=CC2=C(CNCC2)C(=C1)C Z1762997397 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.328 CC1=NC2=C(CCCC2)C(=C1)N Z1198162667 [0,0,0,0,0,0|4,0,0]=4 6 B13R2.328 CC1=NC2=C(CCCC2)C(=N1)Cl Z813020986 [0,0,0,0,0,0|3,0,0]=3 7 B13R2.328 CC1=NC2=C(CCCC2)C(=O)N1 Z57604142 [0,0,0,0,0,0|3,0,1]=4 8 B13R2.328 CC1=NC2=C(CNCC2)C(=O)N1 Z4881514263 [0,0,0,0,0,0|3,0,1]=4 9 B13R2.328 ClC1=NC2=C(CCCC2)C(=N1)Cl Z1267863111 [0,0,0,0,0,0|3,0,0]=3 10 B13R2.328 ClC1=NC2=C(CCNC2)C(=N1)Cl Z1269131414 [0,0,0,0,0,0|4,0,0]=4 11 B13R2.328 ClC1=NC2=C(CCOC2)C(=N1)Cl Z1269189234 [0,0,0,0,0,0|4,0,0]=4 12 B13R2.328 ClC1=NC2=C(CNCC2)C(=N1)Cl Z1741975074 [0,0,0,0,0,0|3,0,0]=3 13 B13R2.328 ClC1=NC2=C(COCC2)C(=N1)Cl Z1267863172 [0,0,0,0,0,0|2,1,0]=3 14 B13R2.328 NC1=NC2=C(CCCC2)C(=N1)N Z56791215 [0,0,0,0,0,0|2,0,0]=2 15 B13R2.328 NC1=NC2=C(CCCC2)C(=O)N1 Z813021734 [0,0,0,0,0,0|2,0,1]=3 16 B13R2.328 NC1=NC2=C(CCNC2)C(=N1)O Z5023069859 [0,0,0,0,0,0|3,0,0]=3 17 B13R2.328 NC1=NC2=C(CNCC2)C(=N1)N Z2310717560 [0,0,0,0,0,0|2,0,0]=2 18 B12R2.24 ClC1=NC2=C(C=N1)CCCC2 Z1255459970 [1,0,0,0,0,0|2,0,0]=3 19 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 Z3235028171 [1,0,0,0,0,0|2,0,0]=3 20 B12R2.24 ClC1=NC2=C(C=N1)COCC2 Z1255504384 [1,0,0,0,0,0|1,1,0]=3 21 B12R2.24 NC1=CC2=C(C=C1)CCCC2 Z278204684 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.24 NC1=NC2=C(C=C1)CCCC2 Z1198183880 [1,0,0,0,0,0|2,0,0]=3 23 B12R2.24 NC1=NC2=C(C=C1)CCOC2 Z3005683778 [1,0,0,0,0,0|3,0,0]=4 24 B12R2.24 NC1=NC2=C(C=N1)CCNC2 Z1551944574 [1,0,0,0,0,0|2,0,0]=3 25 B12R2.24 NC1=NC2=C(C=N1)CCOC2 Z2732461091 [1,0,0,0,0,0|2,0,0]=3 26 B12R2.24 NC1=NC2=C(C=N1)CNCC2 Z1741974298 [1,0,0,0,0,0|1,0,0]=2 27 B12R2.24 NC1=NC2=C(C=N1)COCC2 Z2690815129 [1,0,0,0,0,0|0,1,0]=2 28 B12R2.24 NC1=NC2=C(CCCC2)N=C1 Z1203641646 [1,0,0,0,0,0|3,0,0]=4 29 B12R2.24 NC1=NC2=C(CCCC2)N=N1 Z381019798 [1,0,0,0,0,0|2,0,0]=3 30 B12R2.24 NC1=NC=C2CCCCC2=C1 Z1198275331 [1,0,0,0,0,0|2,0,0]=3 31 B12R2.24 NC1=NC=C2OCCCC2=C1 Z2235790796 [1,0,0,0,0,0|3,0,0]=4 32 B12R2.24 OC1=NC2=C(C=N1)CCCC2 Z2756994476 [1,0,0,0,0,0|2,0,0]=3 33 B12R2.1081 ClC1=C2CCCCC2=NC=N1 Z813021224 [1,0,0,0,0,0|2,0,0]=3 34 B12R2.1081 ClC1=C2CCNCC2=NC=N1 Z5810322118 [1,0,0,0,0,0|3,0,0]=4 35 B12R2.1081 ClC1=C2COCCC2=NC=N1 Z1255504385 [1,0,0,0,0,0|1,1,0]=3 36 B12R2.1081 NC1=C2CCCCC2=NC=C1 Z1203583324 [1,0,0,0,0,0|3,0,0]=4 37 B12R2.1081 NC1=C2CCCCC2=NC=N1 Z960787014 [1,0,0,0,0,0|2,0,0]=3 38 B12R2.1081 NC1=C2CNCCC2=CC=N1 Z1763544280 [1,0,0,0,0,0|3,0,0]=4 39 B12R2.1081 NC1=C2CNCCC2=NC=C1 Z2461246351 [1,0,0,0,0,0|3,0,0]=4 40 B12R2.1081 NC1=C2CNCCC2=NC=N1 Z3828431628 [1,0,0,0,0,0|2,0,0]=3 41 B12R2.1081 NC1=C2COCCC2=NC=N1 Z1860397365 [1,0,0,0,0,0|1,1,0]=3 42 B12R2.1081 O=C1NC=NC2=C1CNCC2 Z1834265872 [1,0,0,0,0,0|2,0,1]=4 43 B12R2.1081 O=C1NC=NC2=C1COCC2 Z2418193688 [1,0,0,0,0,0|1,1,1]=4 44 B12R2.1081 OC1=C2CNCCC2=NC=C1 Z2953972929 [1,0,0,0,0,0|3,0,0]=4 45 B14R2.1019 CC1=C2CCCCC2=NC(=N1)CN Z4658844417 [0,1,0,0,0,0|1,0,0]=2 46 B14R2.1019 ClCC1=NC2=C(COCC2)C(=N1)Cl Z1860394051 [0,1,0,0,0,0|2,1,0]=4 47 B14R2.1019 NCC1=NC2=C(COCC2)C(=O)N1 Z2739891522 [0,1,0,0,0,0|1,1,1]=4 48 B14R2.8235 CC1CCC2=C(C1)C(=NC(=N2)Cl)Cl Z1267863229 [0,1,0,0,0,0|3,0,0]=4 49 B14R2.8235 CN1CCC2=C(C1)C(=NC(=N2)Cl)Cl Z1322795713 [0,1,0,0,0,0|3,0,0]=4 50 B14R2.29365 CC1CCC2=C(C1)N=C(N=C2Cl)Cl Z2896797726 [0,1,0,0,0,0|3,0,0]=4 51 B12R1.69 CCOCC1=C(N=C(N=C1)C)N Z234853588 [0,0,1,0,0,0|2,1,0]=4 52 B12R1.100 CSCCC1=NC(=CC(=N1)C)Cl Z2512663454 [0,0,1,0,0,0|3,0,0]=4 53 B12R2.18 CC1=C(SC2=C1CCCC2)N Z1258579241 [0,0,0,0,1,0|2,0,0]=3 54 B12R2.18 CC1=NC2=C(N1C)CNCC2 Z5219119491 [0,0,0,0,1,0|3,0,0]=4 55 B12R2.18 CN1C(=NC2=C1CCCC2)N Z3270964012 [0,0,0,0,1,0|2,0,0]=3 56 B12R2.18 CN1C(=NC2=C1CCOC2)N Z3035513729 [0,0,0,0,1,0|3,0,0]=4 57 B12R2.246 CC1=C2CCCC2=CC(=N1)O Z4657503375 [0,0,0,0,1,0|2,0,0]=3 58 B12R2.246 CC1=CC(=NC2=C1CNC2)C Z4428810916 [0,0,0,0,1,0|3,0,0]=4 59 B12R2.246 CC1=CC(=O)NC2=C1CCC2 Z57123329 [0,0,0,0,1,0|2,0,1]=4 60 B12R2.246 CC1=NC(=C2CNCC2=N1)O Z2688065591 [0,0,0,0,1,0|3,0,0]=4 61 B12R2.246 ClC1=NC(=C2CCCC2=N1)Cl Z596251606 [0,0,0,0,1,0|2,0,0]=3 62 B12R2.246 ClC1=NC(=C2COCC2=N1)Cl Z1255417316 [0,0,0,0,1,0|2,1,0]=4 63 B12R2.246 ClC1=NC(=C2CSCC2=N1)Cl Z1269147937 [0,0,0,0,1,0|2,0,0]=3 64 B12R2.246 NC1=NC(=C2CCCC2=N1)O Z2492774551 [0,0,0,0,1,0|1,0,0]=2 65 B12R2.246 NC1=NC(=C2CNCC2=N1)O Z4131026384 [0,0,0,0,1,0|2,0,0]=3 66 B12R2.246 OC1=NC(=C2CNCC2=N1)O Z3570654665 [0,0,0,0,1,0|3,0,0]=4 67 B12R2.246 OC1=NC(=C2CSCC2=N1)O Z1255490035 [0,0,0,0,1,0|2,0,0]=3 68 B12R2.246 OC1=NC(=C2SCCC2=N1)O Z1201626972 [0,0,0,0,1,0|2,0,0]=3 69 B12R2.2028 CN1N=C(C2=C1CCOC2)N Z3242853241 [0,0,0,0,1,0|3,0,0]=4 70 B12R2.2028 CN1N=C(C2=C1CNCC2)O Z1262571810 [0,0,0,0,1,0|3,0,0]=4 71 B14R2.6126 CC1=NC2=C(CCNCC2)C(=N1)Cl Z4664546798 [0,0,0,0,0,1|3,0,0]=4 72 B14R2.6126 ClC1=NC2=C(CCCCC2)C(=N1)Cl Z1267863215 [0,0,0,0,0,1|3,0,0]=4 73 B11R1.34 CCCC1=NC(=NC(=C1)Cl)Cl Z1216824384 [1,0,1,0,0,0|2,0,0]=4 74 B11R1.34 CCOC1=NC(=NC(=N1)C)N Z1198153631 [1,0,1,0,0,0|2,0,0]=4 75 B11R1.34 CSCC1=NC(=NC(=N1)N)N Z742744676 [1,0,1,0,0,0|2,0,0]=4 76 B11R1.34 NCCC1=NC(=NC(=C1)O)N Z5385150450 [1,0,1,0,0,0|2,0,0]=4 77 B11R1.1 CCCCC1=CN=C(N=C1)N Z1137168332 [1,0,1,0,0,0|1,0,0]=3 78 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [1,0,1,0,0,0|2,0,0]=4 79 B11R1.17 CCSCC1=C(N=CC=C1)N Z991493204 [1,0,1,0,0,0|2,0,0]=4 80 B11R1.81 CC1=C(C=NC(=N1)S)CCN Z4919924970 [1,0,1,0,0,0|2,0,0]=4 81 B11R1.81 CCOC1=C(N=C(C=C1)N)C Z2583036218 [1,0,1,0,0,0|1,1,0]=4 82 B11R1.81 COCC1=C(N=C(C=C1)N)C Z1262680326 [1,0,1,0,0,0|1,1,0]=4 83 B11R1.24 CCCCC1=NC(=NC=C1)N Z1262627362 [1,0,1,0,0,0|1,0,0]=3 84 B11R1.24 CCCCC1=NC=NC(=C1)Cl Z1201628792 [1,0,1,0,0,0|2,0,0]=4 85 B11R1.24 COCCC1=CC(=NC=C1)N Z1333211037 [1,0,1,0,0,0|1,1,0]=4 86 B11R1.37 CCC1=C(N=C(N=N1)N)CC Z1262632570 [1,0,1,0,0,0|2,0,0]=4 87 B11R1.464 CC1=NC(=CC(=C1CN)C)N Z3210522108 [1,0,1,0,0,0|2,0,0]=4 88 B11R1.464 CCC1=C(N=C(N=C1C)Cl)Cl Z1238571437 [1,0,1,0,0,0|2,0,0]=4 89 B11R2.20 C1=CC2=C(C=N1)CCCC2 Z104492180 [2,0,0,0,0,0|2,0,0]=4 90 B11R2.20 C1=CC2=C(C=N1)CNCC2 Z3058791291 [2,0,0,0,0,0|2,0,0]=4 91 B11R2.20 C1=CC2=C(C=N1)COCC2 Z4394915129 [2,0,0,0,0,0|1,1,0]=4 92 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [2,0,0,0,0,0|2,0,0]=4 93 B11R2.20 C1=CC2=C(CCNC2)N=C1 Z2142036515 [2,0,0,0,0,0|2,0,0]=4 94 B11R2.20 C1=CC2=C(CCSC2)N=C1 Z3492694447 [2,0,0,0,0,0|1,0,0]=3 95 B11R2.20 C1=NC=NC2=C1CCNC2 Z2724335023 [2,0,0,0,0,0|2,0,0]=4 96 B13R1.1601 CCCCC1=C(N=C(N=C1C)N)O Z1198150627 [0,1,1,0,0,0|1,0,0]=3 97 B13R1.55 COCCSC1=NC(=NC(=C1)Cl)N Z1281747344 [0,1,1,0,0,0|1,1,0]=4 98 B13R1.2808 CC1=NC(=NC(=C1CC(C)C)C)Cl Z1269676855 [0,1,1,0,0,0|2,0,0]=4 99 B13R2.3683 CC1=NC2=C(C=N1)CC(CC2)N Z255150112 [1,1,0,0,0,0|2,0,0]=4 100 B13R2.3683 CC1CCC2=C(C1)C=NC(=C2)N Z2906227881 [1,1,0,0,0,0|2,0,0]=4 101 B13R2.3683 CC1CCC2=C(C1)C=NC(=N2)N Z1137168265 [1,1,0,0,0,0|1,0,0]=3 102 B13R2.5179 CC1=NC2=C(C=N1)C(CCC2)N Z905270722 [1,1,0,0,0,0|2,0,0]=4 103 B13R2.5179 NC1=NC2=C(C=N1)C(=O)CCC2 Z361989360 [1,1,0,0,0,0|1,0,1]=4 104 B13R2.5179 NC1=NC2=C(C=N1)C(=O)NCC2 Z1551937667 [1,1,0,0,0,0|1,0,1]=4 105 B13R2.1613 CNC1=C2CCCCC2=NC=C1 Z2526712456 [1,1,0,0,0,0|2,0,0]=4 106 B13R2.1613 COC1=C2CNCCC2=NC=N1 Z988983954 [1,1,0,0,0,0|1,0,0]=3 107 B13R2.1613 NCC1=C2CCCCC2=NC=C1 Z3305926881 [1,1,0,0,0,0|2,0,0]=4 108 B13R2.135 CCN1C(=NC2=C1CCCC2)N Z3267953741 [0,1,0,0,1,0|2,0,0]=4 109 B13R2.654 CC1=C2CCCC2=CC(=C1)CN Z5081983897 [0,1,0,0,1,0|2,0,0]=4 110 B13R2.3742 CC1SCC2=C(N=C(N=C12)Cl)Cl Z3035821182 [0,1,0,0,1,0|2,0,0]=4 111 B13R2.3729 ClC1=NC2=C(C=N1)CCCCC2 Z1251416049 [0,0,1,1,0,0|2,0,0]=4 112 B13R2.3729 NC1=NC2=C(C=N1)CCCCC2 Z1137168270 [0,0,1,1,0,0|1,0,0]=3 113 B11R2.1 NC1=NC=C2N1CCNC2 Z5115849576 [1,0,0,0,1,0|2,0,0]=4 114 B11R2.10 NC1=NC2=C(S1)CCCC2 Z1741961606 [1,0,0,0,1,0|2,0,0]=4 115 B11R2.10 NC1=NC2=C(S1)COCC2 Z1270207983 [1,0,0,0,1,0|1,1,0]=4 116 B11R2.10 NC1=NC2=C(S1)CSCC2 Z826531524 [1,0,0,0,1,0|1,0,0]=3 117 B11R2.10 NC1=NN2CCCCC2=C1 Z1203641740 [1,0,0,0,1,0|2,0,0]=4 118 B11R2.10 NC1=NN2CCCCC2=N1 Z2240822571 [1,0,0,0,1,0|2,0,0]=4 119 B11R2.10 NC1=NN2CCNCC2=C1 Z2768769199 [1,0,0,0,1,0|2,0,0]=4 120 B11R2.10 NC1=NN2CCNCC2=N1 Z1813081708 [1,0,0,0,1,0|2,0,0]=4 121 B11R2.36 BrC1=NC2=C(C=N1)CCC2 Z2311286011 [1,0,0,0,1,0|1,0,0]=3 122 B11R2.36 CC1=NC2=C(C=N1)CNC2 Z4502337634 [1,0,0,0,1,0|2,0,0]=4 123 B11R2.36 ClC1=NC2=C(C=N1)CCC2 Z1255467563 [1,0,0,0,1,0|1,0,0]=3 124 B11R2.36 ClC1=NC2=C(C=N1)COC2 Z1551918547 [1,0,0,0,1,0|1,1,0]=4 125 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [1,0,0,0,1,0|1,0,0]=3 126 B11R2.36 NC1=NC2=C(C=C1)OCC2 Z1203582734 [1,0,0,0,1,0|1,1,0]=4 127 B11R2.36 NC1=NC2=C(C=N1)CCC2 Z1137168278 [1,0,0,0,1,0|0,0,0]=2 128 B11R2.106 CC1=C2CCNC2=NC=C1 Z1203731311 [1,0,0,0,1,0|2,0,0]=4 129 B11R2.106 CC1=C2CNCC2=NC=C1 Z3595590454 [1,0,0,0,1,0|2,0,0]=4 130 B11R2.106 ClC1=C2CCCC2=NC=N1 Z813019322 [1,0,0,0,1,0|1,0,0]=3 131 B11R2.106 ClC1=C2COCC2=NC=N1 Z1258976763 [1,0,0,0,1,0|1,1,0]=4 132 B11R2.106 NC1=C2CCCC2=NC=N1 Z234796414 [1,0,0,0,1,0|1,0,0]=3 133 B11R2.106 O=C1NC=NC2=C1CCC2 Z813020070 [1,0,0,0,1,0|1,0,1]=4 134 B11R2.202 CN1N=C(C2=C1CNC2)N Z2251852358 [0,0,0,0,2,0|2,0,0]=4 135 B13R2.4820 ClC1=C2CCCCCC2=NC=N1 Z1124749971 [1,0,0,0,0,1|2,0,0]=4 136 B13R2.4820 ClC1=C2CCNCCC2=NC=N1 Z3487363974 [1,0,0,0,0,1|2,0,0]=4