0 B12R3.321 C1C2CC3CC1CC(C2)C3 Z104474730 [0,0,0,0,0,0|0,0,0]=0 1 B12R3.321 C1C2CC3CC1CC(C2)N3 Z3026105611 [0,0,0,0,0,0|1,0,0]=1 2 B12R3.321 C1N2CN3CN1CN(C2)C3 Z362014242 [0,0,0,0,0,0|4,0,0]=4 3 B13R3.3861 BrC1C2CC3CC(C2)CC1C3 Z56896350 [0,1,0,0,0,0|0,0,0]=1 4 B13R3.3861 NC1C2CC3CC(C2)CC1C3 Z90667176 [0,1,0,0,0,0|0,0,0]=1 5 B13R3.3861 O=C1C2CC3CC(C2)CC1C3 Z56782489 [0,1,0,0,0,0|0,0,1]=2 6 B13R3.3861 O=C1C2CC3CC1CN(C3)C2 Z1238539940 [0,1,0,0,0,0|1,0,1]=3 7 B13R3.3861 OC1C2CC3CC(C2)CC1C3 Z56757309 [0,1,0,0,0,0|0,0,0]=1 8 B13R3.3861 OC1C2CC3CC(C2)CN1C3 Z4908798204 [0,1,0,0,0,0|1,0,0]=2 9 B13R3.3861 O[C@H]1[C@H]2C[C@H]3C[C@@H]1CN(C3)C2 Z2978296137 [0,1,0,0,0,0|1,0,0]=2 10 B13R3.10150 BrC12CC3CC(C1)CC(C3)C2 Z56762205 [0,1,0,0,0,0|0,0,0]=1 11 B13R3.10150 ClC12CC3CC(C1)CC(C3)C2 Z56771135 [0,1,0,0,0,0|0,0,0]=1 12 B13R3.10150 NC12CC3CC(C1)CC(C3)C2 Z1522567174 [0,1,0,0,0,0|0,0,0]=1 13 B13R3.10150 NC12CN3CN(C1)CN(C3)C2 Z57124110 [0,1,0,0,0,0|3,0,0]=4 14 B13R3.10150 OC12CC3CC(C1)CC(C3)C2 Z56771134 [0,1,0,0,0,0|0,0,0]=1 15 B13R3.10150 SC12CC3CC(C1)CC(C3)C2 Z111411218 [0,1,0,0,0,0|0,0,0]=1 16 B11R2.678 C=C1CC2CCCC(C1)N2 Z3768198553 [0,0,1,0,0,0|1,0,2]=4 17 B11R2.678 CC1=CC2CCCC(C1)N2 Z3835770186 [0,0,1,0,0,0|1,0,2]=4 18 B11R2.678 N[C@H]1C[C@@H]2C=CC[C@H](C1)C2 Z5055332020 [0,0,1,0,0,0|1,0,2]=4 19 B11R2.678 N[C@H]1C[C@H]2COC[C@@H](C1)C2 Z4595366328 [0,0,1,0,0,0|2,0,0]=3 20 B11R2.678 O=C1CC2CCCC(C1)C2 Z1255416520 [0,0,1,0,0,0|1,0,1]=3 21 B11R2.678 O=C1CC2CCCC(C1)N2 Z1262564614 [0,0,1,0,0,0|2,0,1]=4 22 B11R2.678 OC1CC2CCCC(C1)N2 Z1262607401 [0,0,1,0,0,0|2,0,0]=3 23 B13R3.1921 C1NC2CC3CC1CC(C3)C2 Z1259335869 [0,0,0,0,0,1|0,0,0]=1 24 B10R2.408 C1CC2CCCC(C1)N2 Z1263820258 [1,0,1,0,0,0|1,0,0]=3 25 B10R2.408 C1CC2CCNC(C1)C2 Z3277762688 [1,0,1,0,0,0|1,0,0]=3 26 B10R2.408 C1CC2CN(C1)CCN2 Z3243810573 [1,0,1,0,0,0|2,0,0]=4 27 B10R2.408 C1CC2CNCC(C1)C2 Z2039477488 [1,0,1,0,0,0|1,0,0]=3 28 B10R2.408 C1CC2COCC(C1)N2 Z2168541803 [1,0,1,0,0,0|2,0,0]=4 29 B10R2.408 C1NCC2CNCC1C2 Z3248014545 [1,0,1,0,0,0|2,0,0]=4 30 B10R2.408 C1NCC2COCC1C2 Z2311219656 [1,0,1,0,0,0|2,0,0]=4 31 B10R2.408 C1NCC2CSCC1C2 Z2940010347 [1,0,1,0,0,0|2,0,0]=4 32 B12R2.29 NC[C@H]1C[C@@H]2C=CC[C@@H](C2)C1 Z5357195226 [0,1,1,0,0,0|0,0,2]=4 33 B12R2.29 O=C[C@H]1C[C@H]2COC[C@@H](C1)C2 Z4521195789 [0,1,1,0,0,0|1,0,1]=4 34 B12R2.29 OC[C@H]1C[C@H]2CNC[C@@H](C1)C2 Z4943542121 [0,1,1,0,0,0|1,0,0]=3 35 B12R2.544 FC1(CC2CCCC(C1)N2)F Z2461243842 [0,1,1,0,0,0|2,0,0]=4 36 B12R2.1153 NC1CC2CCCC(C1)(C2)O Z3445031270 [0,1,1,0,0,0|1,0,0]=3 37 B12R2.1153 O=C1CC2CCCC(C1)(C2)O Z1255491219 [0,1,1,0,0,0|1,0,1]=4 38 B12R2.1154 CN1CC2CCCC(C1)C2N Z5210570996 [0,1,1,0,0,0|1,0,0]=3 39 B12R2.1154 CN1[C@H]2CCC[C@@H]1CC(C2)N Z1198169339 [0,1,1,0,0,0|2,0,0]=4 40 B14R3.4476 CC1NC2CC3CC(C2)CC1C3 Z4722305358 [0,1,0,0,0,1|0,0,0]=2 41 B14R3.4476 O=C1CC2CC3CC(C2)CC1C3 Z56853702 [0,1,0,0,0,1|0,0,0]=2 42 B14R3.4476 O=C1NC2CC3CC(C2)CC1C3 Z235540554 [0,1,0,0,0,1|0,0,1]=3 43 B14R3.14333 CNC1C2CC3CC(C2)CC1C3 Z317046600 [0,2,0,0,0,0|0,0,0]=2 44 B14R3.14333 N#CC1C2CC3CC(C2)CC1C3 Z1436192933 [0,2,0,0,0,0|0,0,0]=2 45 B14R3.14333 NCC1C2CC3CC(C2)CC1C3 Z1431002691 [0,2,0,0,0,0|0,0,0]=2 46 B14R3.14333 O=CC1C2CC3CC(C2)CC1C3 Z1436192934 [0,2,0,0,0,0|0,0,0]=2 47 B14R3.14333 OCC1C2CC3CC(C2)CC1C3 Z1436191609 [0,2,0,0,0,0|0,0,0]=2 48 B14R3.14333 ON=C1C2CC3CC(C2)CC1C3 Z49568474 [0,2,0,0,0,0|0,0,1]=3 49 B14R3.20785 CC1(C2CC3CC(C2)CC1C3)N Z4745561715 [0,2,0,0,0,0|0,0,0]=2 50 B14R3.20785 CC1(C2CC3CC(C2)CC1C3)O Z56762560 [0,2,0,0,0,0|0,0,0]=2 51 B14R3.28204 NC12CC3CC(C1)C(C(C3)C2)O Z3244526663 [0,2,0,0,0,0|0,0,0]=2 52 B14R3.28204 NC1C2CC3CC1CC(C3)(C2)F Z1998636298 [0,2,0,0,0,0|0,0,0]=2 53 B14R3.28204 NC1C2CC3CC1CC(C3)(C2)O Z2736917439 [0,2,0,0,0,0|0,0,0]=2 54 B14R3.28204 NC1C2CC3CC1CC(C3)(C2)O Z3220041497 [0,2,0,0,0,0|0,0,0]=2 55 B14R3.28204 O=C1C2CC3CC1CC(C3)(C2)O Z56782275 [0,2,0,0,0,0|0,0,1]=3 56 B14R3.28204 OC1C2CC3CC1CC(C3)(C2)Cl Z1896382205 [0,2,0,0,0,0|0,0,0]=2 57 B14R3.47333 BrCC12CC3CC(C1)CC(C3)C2 Z56899178 [0,2,0,0,0,0|0,0,0]=2 58 B14R3.47333 C#CC12CC3CC(C1)CC(C3)C2 Z1486012435 [0,2,0,0,0,0|0,0,0]=2 59 B14R3.47333 ClCC12CC3CC(C1)CC(C3)C2 Z56979293 [0,2,0,0,0,0|0,0,0]=2 60 B14R3.47333 N#CC12CC3CC(C1)CC(C3)C2 Z56762557 [0,2,0,0,0,0|0,0,0]=2 61 B14R3.47333 NCC12CC3CC(C1)CC(C3)C2 Z56899180 [0,2,0,0,0,0|0,0,0]=2 62 B14R3.47333 O=CC12CC3CC(C1)CC(C3)C2 Z1079442548 [0,2,0,0,0,0|0,0,0]=2 63 B14R3.47333 O=CC12CC3CC(C1)CC(C3)O2 Z3574404780 [0,2,0,0,0,0|1,0,0]=3 64 B14R3.47333 OCC12CC3CC(C1)CC(C3)C2 Z56782532 [0,2,0,0,0,0|0,0,0]=2 65 B14R3.63177 CC12CC3CC(C1)CC(C3)(C2)C Z1365497409 [0,2,0,0,0,0|0,0,0]=2 66 B14R3.63177 CC12CC3CC(C1)CC(C3)(C2)O Z56783005 [0,2,0,0,0,0|0,0,0]=2 67 B14R3.63177 NC12CC3CC(C1)CC(C3)(C2)F Z2753047591 [0,2,0,0,0,0|0,0,0]=2 68 B14R3.63177 NC12CC3CC(C1)CC(C3)(C2)O Z1203159519 [0,2,0,0,0,0|0,0,0]=2 69 B14R3.63177 OC12CC3CC(C1)CC(C3)(C2)O Z1509059210 [0,2,0,0,0,0|0,0,0]=2 70 B10R1.8 CC1CC(CC(C1)C#N)C Z1249997821 [0,0,2,0,0,0|1,0,1]=4 71 B10R1.8 CC1CC(CC(C1)C=O)C Z1250005172 [0,0,2,0,0,0|1,0,1]=4 72 B10R1.8 CCN1CC(NC(C1)C)C Z1162903461 [0,0,2,0,0,0|2,0,0]=4 73 B10R1.8 CNC1CC(OC(C1)C)C Z1516118836 [0,0,2,0,0,0|2,0,0]=4 74 B10R1.10 CC1CC(CCN1)CCN Z4896293249 [0,0,2,0,0,0|2,0,0]=4 75 B10R1.10 CC1CCCC(C1)CCO Z1217184154 [0,0,2,0,0,0|1,0,0]=3 76 B10R1.10 CC1CCCC(N1)CCO Z1203733624 [0,0,2,0,0,0|2,0,0]=4 77 B10R1.10 CC1CCCN(C1)CCN Z271005842 [0,0,2,0,0,0|2,0,0]=4 78 B10R1.10 CCCN1CCCC(C1)O Z197276296 [0,0,2,0,0,0|2,0,0]=4 79 B10R1.10 CCNC1CCCC(C1)N Z5062701902 [0,0,2,0,0,0|2,0,0]=4 80 B10R1.10 CCSC1CCCC(C1)N Z1245789153 [0,0,2,0,0,0|2,0,0]=4 81 B10R1.10 CN1CCCC(C1)CCO Z976801054 [0,0,2,0,0,0|2,0,0]=4 82 B10R1.10 CNCC1CCCN(C1)C Z763765496 [0,0,2,0,0,0|2,0,0]=4 83 B10R1.18 CC(C)CC1CCCNC1 Z1415893887 [0,0,2,0,0,0|1,0,0]=3 84 B10R1.18 CC(C)CC1CCNCC1 Z1416282958 [0,0,2,0,0,0|1,0,0]=3 85 B10R1.18 CC(C)CC1CNCCO1 Z4628240194 [0,0,2,0,0,0|2,0,0]=4 86 B10R1.18 CC(C)CC1COCCN1 Z799925554 [0,0,2,0,0,0|2,0,0]=4 87 B10R1.18 CC(C)CN1CCNCC1 Z90662165 [0,0,2,0,0,0|2,0,0]=4 88 B10R1.18 CC(C)NC1CCCCC1 Z166605468 [0,0,2,0,0,0|1,0,0]=3 89 B10R1.18 CC(C)NC1CCCOC1 Z5110495008 [0,0,2,0,0,0|2,0,0]=4 90 B10R1.18 CC(C)NC1CCNCC1 Z728910198 [0,0,2,0,0,0|2,0,0]=4 91 B10R1.18 CC(C)NC1CCOCC1 Z3013892334 [0,0,2,0,0,0|2,0,0]=4 92 B10R1.18 CC(N)CC1CCCCC1 Z3235020113 [0,0,2,0,0,0|1,0,0]=3 93 B10R1.18 CC(N)CC1CCOCC1 Z1318147465 [0,0,2,0,0,0|2,0,0]=4 94 B10R1.18 CC(O)CC1CCCCN1 Z1203731039 [0,0,2,0,0,0|2,0,0]=4 95 B10R1.18 CC(O)CC1CCNCC1 Z3269078967 [0,0,2,0,0,0|2,0,0]=4 96 B10R1.18 CN(C)CC1CCCCN1 Z317037110 [0,0,2,0,0,0|2,0,0]=4 97 B10R1.18 CN(C)CC1CCCNC1 Z2417878087 [0,0,2,0,0,0|2,0,0]=4 98 B10R1.18 CN(C)CC1CCCSC1 Z5877597627 [0,0,2,0,0,0|2,0,0]=4 99 B10R1.18 CN(C)CC1CCNCC1 Z317037112 [0,0,2,0,0,0|2,0,0]=4 100 B10R2.2 CN1CC2CCNC2C1 Z255150334 [0,0,1,0,1,0|2,0,0]=4 101 B10R2.2 CN1C[C@@H]2CNC[C@@H]2C1 Z1947775299 [0,0,1,0,1,0|2,0,0]=4 102 B10R2.2 NC1CC2CCCC2C1 Z4137935444 [0,0,1,0,1,0|1,0,0]=3 103 B10R2.2 NC1CC2COCC2C1 Z2681268549 [0,0,1,0,1,0|2,0,0]=4 104 B10R2.2 NC1CC2CSCC2C1 Z3486116904 [0,0,1,0,1,0|2,0,0]=4 105 B10R2.2 NC1C[C@@H]2CSC[C@H]2C1 Z3487320255 [0,0,1,0,1,0|2,0,0]=4 106 B10R2.61 CN1CC2CC1CCN2 Z2867580937 [0,0,1,0,1,0|2,0,0]=4 107 B10R2.61 FC1CC2CNCC1C2 Z4381863906 [0,0,1,0,1,0|2,0,0]=4 108 B10R2.61 OC1CC2CNCC1C2 Z3559692050 [0,0,1,0,1,0|2,0,0]=4 109 B10R2.71 CC1CC2CCC(C1)N2 Z4574895384 [0,0,1,0,1,0|1,0,0]=3 110 B10R2.71 CN1CC2CCC(C1)N2 Z1741982028 [0,0,1,0,1,0|2,0,0]=4 111 B10R2.71 C[C@@H]1C[C@@H]2CC[C@H](C1)N2 Z4500645483 [0,0,1,0,1,0|1,0,0]=3 112 B10R2.71 F[C@H]1C[C@@H]2CC[C@H](C1)N2 Z3244826328 [0,0,1,0,1,0|2,0,0]=4 113 B10R2.71 NC1CC2CCC(C1)C2 Z2900188186 [0,0,1,0,1,0|1,0,0]=3 114 B10R2.71 NC1CC2CCC(C1)S2 Z2904983927 [0,0,1,0,1,0|2,0,0]=4 115 B10R2.71 OC1CC2CCC(C1)N2 Z727903334 [0,0,1,0,1,0|2,0,0]=4 116 B10R2.71 OC1CC2CNC(C1)C2 Z2703607581 [0,0,1,0,1,0|2,0,0]=4 117 B12R2.594 O=C1CC2CCCC(C2)CN1 Z1509223166 [0,0,1,0,0,1|1,0,1]=4