0 B13R2.328 CC1=C2CCCCC2=NC(=N1)N Z85923113 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.328 CC1=CC2=C(CCCN2)C(=O)N1 Z1262581323 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.328 CC1=CC2=C(CNCC2)C(=C1)Br Z1513696401 [0,0,0,0,0,0|4,0,0]=4 3 B13R2.328 CC1=CC2=C(CNCC2)C(=C1)C Z1762997397 [0,0,0,0,0,0|4,0,0]=4 4 B13R2.328 CC1=CC2=C(CNCC2)C(=C1)F Z2757404849 [0,0,0,0,0,0|4,0,0]=4 5 B13R2.328 CC1=NC2=C(C=CC=C2)C(=O)N1 Z56895688 [0,0,0,0,0,0|1,0,3]=4 6 B13R2.328 CC1=NC2=C(C=CN=C2)C(=O)N1 Z1216862026 [0,0,0,0,0,0|2,0,2]=4 7 B13R2.328 CC1=NC2=C(CCCC2)C(=C1)N Z1198162667 [0,0,0,0,0,0|3,0,0]=3 8 B13R2.328 CC1=NC2=C(CCCC2)C(=N1)Cl Z813020986 [0,0,0,0,0,0|2,0,1]=3 9 B13R2.328 CC1=NC2=C(CCCC2)C(=O)N1 Z57604142 [0,0,0,0,0,0|1,0,0]=1 10 B13R2.328 CC1=NC2=C(CCNC2)C(=O)N1 Z3244745140 [0,0,0,0,0,0|2,0,0]=2 11 B13R2.328 CC1=NC2=C(CNCC2)C(=O)N1 Z4881514263 [0,0,0,0,0,0|1,0,0]=1 12 B13R2.328 ClC1=NC2=C(CCCC2)C(=N1)Cl Z1267863111 [0,0,0,0,0,0|3,0,1]=4 13 B13R2.328 ClC1=NC2=C(CNCC2)C(=N1)Cl Z1741975074 [0,0,0,0,0,0|3,0,1]=4 14 B13R2.328 ClC1=NC2=C(COCC2)C(=N1)Cl Z1267863172 [0,0,0,0,0,0|2,1,1]=4 15 B13R2.328 NC1=NC2=C(CCCC2)C(=N1)N Z56791215 [0,0,0,0,0,0|3,0,1]=4 16 B13R2.328 NC1=NC2=C(CCCC2)C(=O)N1 Z813021734 [0,0,0,0,0,0|2,0,0]=2 17 B13R2.328 NC1=NC2=C(CNCC2)C(=N1)N Z2310717560 [0,0,0,0,0,0|3,0,1]=4 18 B13R2.328 O=C1NC(=O)C2=C(N1)CCCC2 Z1201626926 [0,0,0,0,0,0|2,0,1]=3 19 B13R2.328 O=C1NC(=O)C2=C(N1)CCNC2 Z3013892330 [0,0,0,0,0,0|2,0,1]=3 20 B13R2.328 O=C1NC(=O)C2=C(N1)CNCC2 Z3234815953 [0,0,0,0,0,0|3,0,1]=4 21 B12R2.24 CC1=CC2=C(C=C1)CNCC2 Z1839475447 [1,0,0,0,0,0|3,0,0]=4 22 B12R2.24 CC1=NC2=C(C=C1)CCCN2 Z1198169981 [1,0,0,0,0,0|3,0,0]=4 23 B12R2.24 CC1=NC2=C(C=C1)NCCC2 Z1203748441 [1,0,0,0,0,0|3,0,0]=4 24 B12R2.24 ClC1=NC2=C(C=N1)CCCC2 Z1255459970 [1,0,0,0,0,0|2,0,1]=4 25 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 Z3235028171 [1,0,0,0,0,0|2,0,1]=4 26 B12R2.24 ClC1=NC2=C(C=N1)COCC2 Z1255504384 [1,0,0,0,0,0|1,1,1]=4 27 B12R2.24 NC1=NC2=C(C=C1)CCCC2 Z1198183880 [1,0,0,0,0,0|3,0,0]=4 28 B12R2.24 NC1=NC2=C(C=N1)CNCC2 Z1741974298 [1,0,0,0,0,0|2,0,1]=4 29 B12R2.24 NC1=NC2=C(C=N1)COCC2 Z2690815129 [1,0,0,0,0,0|1,1,1]=4 30 B12R2.24 O=C1C=C2CCCCC2=CN1 Z1203746588 [1,0,0,0,0,0|3,0,0]=4 31 B12R2.24 O=C1C=C2CCOCC2=CN1 Z1509160870 [1,0,0,0,0,0|2,1,0]=4 32 B12R2.24 OC1=NC2=C(C=N1)CCCC2 Z2756994476 [1,0,0,0,0,0|2,0,1]=4 33 B12R2.1081 ClC1=C2CCCCC2=NC=N1 Z813021224 [1,0,0,0,0,0|2,0,1]=4 34 B12R2.1081 ClC1=C2COCCC2=NC=N1 Z1255504385 [1,0,0,0,0,0|1,1,1]=4 35 B12R2.1081 NC1=C2CCCCC2=NC=C1 Z1203583324 [1,0,0,0,0,0|3,0,0]=4 36 B12R2.1081 NC1=C2CCCCC2=NC=N1 Z960787014 [1,0,0,0,0,0|2,0,1]=4 37 B12R2.1081 NC1=C2CNCCC2=NC=C1 Z2461246351 [1,0,0,0,0,0|3,0,0]=4 38 B12R2.1081 NC1=C2CNCCC2=NC=N1 Z3828431628 [1,0,0,0,0,0|2,0,1]=4 39 B12R2.1081 NC1=C2COCCC2=NC=N1 Z1860397365 [1,0,0,0,0,0|1,1,1]=4 40 B12R2.1081 O=C1C=CNC2=C1CCCC2 Z1203745874 [1,0,0,0,0,0|2,0,1]=4 41 B12R2.1081 O=C1NC=CC2=C1CNCC2 Z1860991849 [1,0,0,0,0,0|2,0,0]=3 42 B12R2.1081 O=C1NC=NC2=C1CCCN2 Z1139192314 [1,0,0,0,0,0|2,0,0]=3 43 B12R2.1081 O=C1NC=NC2=C1CNCC2 Z1834265872 [1,0,0,0,0,0|1,0,0]=2 44 B12R2.1081 O=C1NC=NC2=C1COCC2 Z2418193688 [1,0,0,0,0,0|0,1,0]=2 45 B12R2.1081 O=C1NC=NC2=C1SCCC2 Z1509209656 [1,0,0,0,0,0|2,0,0]=3 46 B12R2.1081 O=C1NN=CC2=C1CCCC2 Z2732459810 [1,0,0,0,0,0|3,0,0]=4 47 B12R2.1081 OC1=C2CNCCC2=NC=C1 Z2953972929 [1,0,0,0,0,0|2,0,1]=4 48 B14R2.1019 CC1=C2CCCCC2=NC(=N1)CN Z4658844417 [0,1,0,0,0,0|2,0,1]=4 49 B14R2.1019 ClCC1=NC2=C(COCC2)C(=N1)Cl Z1860394051 [0,1,0,0,0,0|1,1,1]=4 50 B14R2.1019 NCC1=NC2=C(COCC2)C(=O)N1 Z2739891522 [0,1,0,0,0,0|0,1,0]=2 51 B14R2.1146 CC1=NC2=C(CCCC2)C(=C1)C=O Z1511913841 [0,1,0,0,0,0|2,0,0]=3 52 B14R2.7724 CN1NC(=O)C2=C(C1=O)CCCC2 Z2789918418 [0,1,0,0,0,0|3,0,0]=4 53 B14R2.8235 CC1=NC2=C(CN(CC2)C)C(=O)N1 Z1509250266 [0,1,0,0,0,0|1,0,0]=2 54 B12R1.69 CCOCC1=C(N=C(N=C1)C)N Z234853588 [0,0,1,0,0,0|1,1,1]=4 55 B12R1.100 CSCCC1=NC(=CC(=N1)C)Cl Z2512663454 [0,0,1,0,0,0|3,0,0]=4 56 B12R1.1095 CC1=C(C(=O)NC(=N1)N)CCO Z1250132730 [0,0,1,0,0,0|3,0,0]=4 57 B12R2.18 CC1=NC2=C(N1C)CNCC2 Z5219119491 [0,0,0,0,1,0|3,0,0]=4 58 B12R2.18 CC1=NN2CCNCC2=C1Br Z5977582596 [0,0,0,0,1,0|3,0,0]=4 59 B12R2.18 CC1=NN2CCNCC2=C1I Z3013904686 [0,0,0,0,1,0|3,0,0]=4 60 B12R2.18 CC1=NN2CCNCC2=C1O Z4661329371 [0,0,0,0,1,0|2,0,1]=4 61 B12R2.18 CN1N=C2CCCCC2=C1N Z1255381085 [0,0,0,0,1,0|3,0,0]=4 62 B12R2.18 CN1N=C2CCNCC2=C1N Z3023748167 [0,0,0,0,1,0|3,0,0]=4 63 B12R2.246 CC1=CC(=NC2=C1CNC2)C Z4428810916 [0,0,0,0,1,0|3,0,0]=4 64 B12R2.246 CC1=NC(=C2CNCC2=N1)O Z2688065591 [0,0,0,0,1,0|1,0,2]=4 65 B12R2.246 CC1=NC2=C(C=NN2)C(=O)N1 Z732618066 [0,0,0,0,1,0|2,0,1]=4 66 B12R2.246 ClC1=NC(=C2CCCC2=N1)Cl Z596251606 [0,0,0,0,1,0|2,0,1]=4 67 B12R2.246 ClC1=NC(=C2CSCC2=N1)Cl Z1269147937 [0,0,0,0,1,0|2,0,1]=4 68 B12R2.246 NC1=NC(=C2CCCC2=N1)O Z2492774551 [0,0,0,0,1,0|1,0,2]=4 69 B12R2.246 O=C1C=C2CCCN2C(=O)N1 Z1262694529 [0,0,0,0,1,0|3,0,0]=4 70 B12R2.246 O=C1NC(=NC2=C1SC=C2)S Z315923754 [0,0,0,0,1,0|1,0,2]=4 71 B12R2.246 O=C1NC(=O)C2=C(N1)CCC2 Z56871938 [0,0,0,0,1,0|1,0,1]=3 72 B12R2.246 OC1=NC(=C2CSCC2=N1)O Z1255490035 [0,0,0,0,1,0|1,0,2]=4 73 B12R2.246 OC1=NC(=C2SCCC2=N1)O Z1201626972 [0,0,0,0,1,0|1,0,2]=4 74 B14R2.6126 CC1=NC2=C(CCNCC2)C(=N1)Cl Z4664546798 [0,0,0,0,0,1|2,0,1]=4 75 B14R2.6126 CC1=NC2=C(CCNCC2)C(=O)N1 Z4655941953 [0,0,0,0,0,1|1,0,0]=2 76 B11R1.34 CCCC1=CC(=O)NC(=N1)S Z56922173 [1,0,1,0,0,0|1,0,0]=3 77 B11R1.464 CCC1=C(NC(=NC1=O)C)N Z2235790793 [1,0,1,0,0,0|2,0,0]=4 78 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [2,0,0,0,0,0|2,0,0]=4 79 B11R2.20 C1=CC2=C(CCNC2)N=C1 Z2142036515 [2,0,0,0,0,0|2,0,0]=4 80 B11R2.20 C1=CC2=C(CCSC2)N=C1 Z3492694447 [2,0,0,0,0,0|1,0,0]=3 81 B13R1.2808 CC1=NC(=C(C(=O)N1)CC(=O)O)C Z274740218 [0,1,1,0,0,0|2,0,0]=4 82 B13R2.3683 CC1=NC2=C(C=N1)CC(CC2)N Z255150112 [1,1,0,0,0,0|1,0,1]=4 83 B13R2.5179 CC1=NC2=C(C=N1)C(CCC2)N Z905270722 [1,1,0,0,0,0|1,0,1]=4 84 B13R2.371 O=C1NC=C(C2=C1CCCC2)Br Z1861992938 [1,1,0,0,0,0|2,0,0]=4 85 B13R2.135 CN1N=C2CCCCC2=C1C=O Z1813191520 [0,1,0,0,1,0|2,0,0]=4 86 B13R2.135 CN1N=C2CCOCC2=C1C=O Z2933867227 [0,1,0,0,1,0|1,1,0]=4 87 B13R2.135 CN1N=C2CCSCC2=C1C=O Z2718689678 [0,1,0,0,1,0|1,0,0]=3 88 B13R2.623 CC1=CC(=C2CCCC2=C1)C=O Z1511881104 [0,1,0,0,1,0|2,0,0]=4 89 B13R2.654 O=C1NC(=NC2=C1SC=C2)CCl Z56943370 [0,1,0,0,1,0|0,0,2]=4 90 B15R2.988 CC1=NC2=C(CCCC2)C(=C1)C(=O)O Z2941218189 [0,2,0,0,0,0|2,0,0]=4 91 B13R2.13518 O=C1NC(=NC=C1C2CCC2)S Z3910447781 [0,0,1,1,0,0|2,0,0]=4 92 B11R2.10 CC1=CC2=C(S1)CCNC2 Z4511731875 [1,0,0,0,1,0|2,0,0]=4 93 B11R2.10 CC1=NC2=C(N1)CCCC2 Z1255506508 [1,0,0,0,1,0|1,0,0]=3 94 B11R2.10 CC1=NC2=C(N1)CCNC2 Z2309942226 [1,0,0,0,1,0|2,0,0]=4 95 B11R2.10 CC1=NC2=C(S1)CNCC2 Z3371563626 [1,0,0,0,1,0|2,0,0]=4 96 B11R2.10 CC1=NN2CCNCC2=C1 Z3003898189 [1,0,0,0,1,0|2,0,0]=4 97 B11R2.10 CN1C=C2CNCCC2=N1 Z1741974300 [1,0,0,0,1,0|2,0,0]=4 98 B11R2.10 NC1=NC2=C(S1)CSCC2 Z826531524 [1,0,0,0,1,0|2,0,0]=4 99 B11R2.10 SC1=NC2=C(N1)CNCC2 Z4590913977 [1,0,0,0,1,0|2,0,0]=4 100 B11R2.36 BrC1=NC2=C(C=N1)CCC2 Z2311286011 [1,0,0,0,1,0|1,0,1]=4 101 B11R2.36 CC1=NC2=C(C=N1)CNC2 Z4502337634 [1,0,0,0,1,0|1,0,1]=4 102 B11R2.36 ClC1=NC2=C(C=N1)CCC2 Z1255467563 [1,0,0,0,1,0|1,0,1]=4 103 B11R2.36 NC1=NC2=C(C=C1)CCC2 Z1198183883 [1,0,0,0,1,0|2,0,0]=4 104 B11R2.36 NC1=NC2=C(C=N1)CCC2 Z1137168278 [1,0,0,0,1,0|1,0,1]=4 105 B11R2.36 O=C1C=C2CCCC2=CN1 Z1255494860 [1,0,0,0,1,0|2,0,0]=4 106 B11R2.106 ClC1=C2CCCC2=NC=N1 Z813019322 [1,0,0,0,1,0|1,0,1]=4 107 B11R2.106 NC1=C2CCCC2=NC=N1 Z234796414 [1,0,0,0,1,0|1,0,1]=4 108 B11R2.106 O=C1NC=NC2=C1CCC2 Z813020070 [1,0,0,0,1,0|0,0,0]=2 109 B11R2.106 O=C1NC=NC2=C1SC=C2 Z166665672 [1,0,0,0,1,0|0,0,2]=4 110 B11R2.106 O=C1NC=NC2=CSC=C12 Z1198317463 [1,0,0,0,1,0|0,0,2]=4 111 B11R2.8 CN1N=C2CSCC2=C1N Z1198369274 [0,0,0,0,2,0|2,0,0]=4 112 B11R2.202 O=C1NC(=O)C2=C1CCC2 Z1255428736 [0,0,0,0,2,0|1,0,0]=3 113 B13R2.4820 O=C1NC=NC2=C1CCNCC2 Z3300708943 [1,0,0,0,0,1|1,0,0]=3