0 B14R2.5637 CN1CCCNC2=C1C=C(C=C2)F Z1233258963 [0,0,0,0,0,0|3,1,0]=4 1 B14R2.5637 CN1CCNCC2=C1C=C(C=C2)Br Z2471612850 [0,0,0,0,0,0|3,1,0]=4 2 B14R2.5637 NC1=CC2=C(C=C1)CCCCC2O Z1262627926 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.5637 NC1CCCOC2=C1C=C(C=C2)Br Z3303332200 [0,0,0,0,0,0|3,1,0]=4 4 B14R2.5637 NC1CCCOC2=C1C=C(C=C2)F Z803129954 [0,0,0,0,0,0|3,1,0]=4 5 B14R2.5637 NC1CCCSC2=C1C=C(C=C2)Br Z2679866261 [0,0,0,0,0,0|3,1,0]=4 6 B14R2.5637 O=C1CCCCC2=C1C=C(C=C2)Br Z1008431016 [0,0,0,0,0,0|2,1,1]=4 7 B14R2.5637 O=C1CCCCC2=C1C=C(C=C2)Cl Z1008430994 [0,0,0,0,0,0|2,0,1]=3 8 B14R2.5637 O=C1CCCCC2=C1C=C(C=C2)O Z1513599562 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.5637 O=C1CCCOC2=C1C=C(C=C2)Cl Z382721400 [0,0,0,0,0,0|3,0,1]=4 10 B14R2.5637 O=C1CCCSC2=C1C=C(C=C2)Cl Z384973648 [0,0,0,0,0,0|3,0,1]=4 11 B14R2.5637 OC1CCCCC2=C1C=C(C=C2)Br Z1008483516 [0,0,0,0,0,0|2,1,0]=3 12 B14R2.5637 OC1CCCNC2=C1C=C(C=C2)F Z1262578702 [0,0,0,0,0,0|3,1,0]=4 13 B13R2.3729 BrC1=CC2=C(C=C1)CCCCN2 Z2805897454 [1,0,0,0,0,0|2,1,0]=4 14 B13R2.3729 BrC1=CC2=C(C=C1)CCNCC2 Z3482360593 [1,0,0,0,0,0|0,1,0]=2 15 B13R2.3729 BrC1=CC2=C(C=C1)CNCCC2 Z2737427877 [1,0,0,0,0,0|2,1,0]=4 16 B13R2.3729 BrC1=CC2=C(C=C1)SCCCC2 Z1416181098 [1,0,0,0,0,0|2,1,0]=4 17 B13R2.3729 CC1=CC2=C(C=C1)CCCCN2 Z1255439654 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.3729 ClC1=CC2=C(C=C1)CCCCN2 Z1655103611 [1,0,0,0,0,0|2,0,0]=3 19 B13R2.3729 ClC1=CC2=C(C=C1)CNCCO2 Z3292855287 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.3729 ClC1=CC2=C(C=C1)NCCCC2 Z2568751763 [1,0,0,0,0,0|2,0,0]=3 21 B13R2.3729 ClC1=CC2=C(C=C1)NCCCS2 Z1262602361 [1,0,0,0,0,0|3,0,0]=4 22 B13R2.3729 ClC1=CC2=C(C=C1)OCCCO2 Z382713972 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.3729 ClC1=CC2=C(C=C1)OCCNC2 Z2756841896 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.3729 ClC1=CC2=C(C=C1)SCCCN2 Z1262585685 [1,0,0,0,0,0|3,0,0]=4 25 B13R2.3729 ClC1=NC2=C(C=N1)CCCCC2 Z1251416049 [1,0,0,0,0,0|3,0,0]=4 26 B13R2.3729 NC1=CC2=C(C=C1)CCCCC2 Z2465619886 [1,0,0,0,0,0|2,0,0]=3 27 B13R2.3729 OC1=CC2=C(C=C1)CCCCC2 Z1513804380 [1,0,0,0,0,0|2,0,0]=3 28 B13R2.3729 OC1=CC2=C(C=C1)CCCNC2 Z3244826621 [1,0,0,0,0,0|3,0,0]=4 29 B13R2.3729 OC1=CC2=C(C=C1)CCNCC2 Z744593112 [1,0,0,0,0,0|1,0,0]=2 30 B13R2.3729 OC1=CC2=C(C=C1)NCCCC2 Z2943582595 [1,0,0,0,0,0|3,0,0]=4 31 B13R2.5252 CC1CCCNC2=C1C=CC=C2 Z1262580132 [1,0,0,0,0,0|2,0,0]=3 32 B13R2.5252 CC1CNCCC2=C1C=CC=C2 Z1262566288 [1,0,0,0,0,0|0,0,0]=1 33 B13R2.5252 CN1CCCNC2=C1C=CC=C2 Z1198237679 [1,0,0,0,0,0|3,0,0]=4 34 B13R2.5252 CN1CCNCC2=C1C=CC=C2 Z1080670256 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.5252 NC1CCCOC2=C1C=CC=C2 Z382721416 [1,0,0,0,0,0|3,0,0]=4 36 B13R2.5252 O=C1CCCCC2=C1C=CC=C2 Z56922160 [1,0,0,0,0,0|2,0,1]=4 37 B13R2.5252 O=C1CSCCC2=C1C=CC=C2 Z1407045833 [1,0,0,0,0,0|2,0,1]=4 38 B13R2.5252 OC1CCCCC2=C1C=CC=C2 Z228586126 [1,0,0,0,0,0|2,0,0]=3 39 B13R2.5252 O[C@@H]1CCCSC2=C1C=CC=C2 Z1436075942 [1,0,0,0,0,0|3,0,0]=4 40 B13R2.5252 O[C@H]1CCCSC2=C1C=CC=C2 Z1436075943 [1,0,0,0,0,0|3,0,0]=4 41 B15R2.2820 COC1=CC2=C(C=C1)CCNCC2C Z1494787051 [0,1,0,0,0,0|1,0,0]=2 42 B15R2.50022 CC1C(=O)NCCC2=C1C=C(C=C2)O Z3446459964 [0,1,0,0,0,0|1,0,1]=3 43 B15R2.50087 CC1(CCCNC2=C1C=C(C=C2)Br)C Z5092094476 [0,1,0,0,0,0|2,1,0]=4 44 B15R2.64537 CC1CNCCC2=C1C=C(C(=C2)Br)O Z3481848439 [0,1,0,0,0,0|1,0,0]=2 45 B13R1.9 CCCCCOC1=CC=C(C=C1)N Z4968222963 [0,0,1,0,0,0|3,0,0]=4 46 B13R1.9 CCCCCOC1=CC=C(C=C1)O Z56899109 [0,0,1,0,0,0|3,0,0]=4 47 B13R1.9 CCOCCNC1=CC=C(C=C1)Cl Z2266149364 [0,0,1,0,0,0|3,0,0]=4 48 B13R1.9 NC1=CC=C(C=C1)CCNCCO Z1251358284 [0,0,1,0,0,0|2,0,0]=3 49 B13R1.9 NCCCCCC1=CC=C(C=C1)Br Z3327815448 [0,0,1,0,0,0|2,1,0]=4 50 B13R1.9 NCCCCCC1=CC=C(C=C1)Cl Z4525234042 [0,0,1,0,0,0|2,0,0]=3 51 B13R1.9 NCCCCCC1=CC=C(C=C1)F Z1255496234 [0,0,1,0,0,0|2,1,0]=4 52 B13R1.9 OCCN/N=C/C1=CC=C(C=C1)Cl Z56850515 [0,0,1,0,0,0|2,0,1]=4 53 B13R1.18 CCCCN(C)C1=CC(=NC=C1)Cl Z1329097773 [0,0,1,0,0,0|3,0,0]=4 54 B13R1.18 CCNCC(C)C1=CC(=CC=C1)Br Z3196419994 [0,0,1,0,0,0|0,1,0]=2 55 B13R1.18 CCNCC(O)C1=CC(=CC=C1)O Z56836691 [0,0,1,0,0,0|2,0,0]=3 56 B13R1.2209 COC1=C(C=C(C=C1)Cl)C(O)CN Z1269169332 [0,0,1,0,0,0|2,0,0]=3 57 B13R2.162 CC1=CC2=C(C=C1)CCCC2=O Z1008431156 [0,0,0,0,1,0|2,0,1]=4 58 B13R2.162 CC1=CC2=C(C=C1)CCC[C@@H]2N Z2130641406 [0,0,0,0,1,0|2,0,0]=3 59 B13R2.162 CC1=CC2=C(C=C1)CCNC2=O Z1198164330 [0,0,0,0,1,0|2,0,1]=4 60 B13R2.162 CC1=CC2=C(C=C1)SCCC2N Z384973728 [0,0,0,0,1,0|3,0,0]=4 61 B13R2.162 CC1NCCC2=C1C=C(C=C2)Br Z4189403291 [0,0,0,0,1,0|0,1,0]=2 62 B13R2.162 CC1NCCC2=C1C=C(C=C2)Cl Z4464935751 [0,0,0,0,1,0|0,0,0]=1 63 B13R2.162 CC1NCCC2=C1C=C(C=C2)F Z1268152367 [0,0,0,0,1,0|0,1,0]=2 64 B13R2.162 CN1CCNC2=C1C=C(C=C2)F Z1269766403 [0,0,0,0,1,0|2,1,0]=4 65 B13R2.162 CN1CCNC2=C1C=C(C=C2)O Z4669450352 [0,0,0,0,1,0|3,0,0]=4 66 B13R2.162 NC1=CC2=C(C=C1)CCCC2=O Z1201624068 [0,0,0,0,1,0|2,0,1]=4 67 B13R2.162 NC1=CC2=C(C=C1)CCCC2N Z1262631299 [0,0,0,0,1,0|2,0,0]=3 68 B13R2.162 NC1=CC2=C(C=C1)CCNC2=O Z1269638456 [0,0,0,0,1,0|2,0,1]=4 69 B13R2.162 NC1CCCC2=C1C=C(C=C2)Br Z3234892335 [0,0,0,0,1,0|1,1,0]=3 70 B13R2.162 NC1CCCC2=C1C=C(C=C2)F Z1008463750 [0,0,0,0,1,0|1,1,0]=3 71 B13R2.162 NC1CCOC2=C1C=C(C=C2)Br Z812517124 [0,0,0,0,1,0|2,1,0]=4 72 B13R2.162 NC1CCOC2=C1C=C(C=C2)Cl Z3234952129 [0,0,0,0,1,0|2,0,0]=3 73 B13R2.162 NC1CCOC2=C1C=C(C=C2)F Z1266854953 [0,0,0,0,1,0|2,1,0]=4 74 B13R2.162 NC1CCSC2=C1C=C(C=C2)Br Z812516964 [0,0,0,0,1,0|2,1,0]=4 75 B13R2.162 NC1CCSC2=C1C=C(C=C2)Cl Z147340872 [0,0,0,0,1,0|2,0,0]=3 76 B13R2.162 NC1CCSC2=C1C=C(C=C2)F Z118507072 [0,0,0,0,1,0|2,1,0]=4 77 B13R2.162 N[C@@H]1CCOC2=C1C=C(C=C2)O Z3353639073 [0,0,0,0,1,0|3,0,0]=4 78 B13R2.162 O=C1CCCC2=C1C=C(C=C2)Br Z1008431018 [0,0,0,0,1,0|1,1,1]=4 79 B13R2.162 O=C1CCCC2=C1C=C(C=C2)F Z1008431012 [0,0,0,0,1,0|1,1,1]=4 80 B13R2.162 O=C1CCCC2=C1C=C(C=C2)O Z1198156579 [0,0,0,0,1,0|2,0,1]=4 81 B13R2.162 O=C1CCCC2=C1N=C(C=C2)Cl Z1255495740 [0,0,0,0,1,0|2,0,1]=4 82 B13R2.162 O=C1CCOC2=C1C=C(C=C2)Cl Z382720992 [0,0,0,0,1,0|2,0,1]=4 83 B13R2.162 O=C1CCSC2=C1C=C(C=C2)Cl Z149094956 [0,0,0,0,1,0|2,0,1]=4 84 B13R2.162 O=C1NCCC2=C1C=C(C=C2)Br Z1209452761 [0,0,0,0,1,0|1,1,1]=4 85 B13R2.162 O=C1NCCC2=C1C=C(C=C2)Cl Z1198164332 [0,0,0,0,1,0|1,0,1]=3 86 B13R2.162 O=C1NCCC2=C1C=C(C=C2)F Z1198164337 [0,0,0,0,1,0|1,1,1]=4 87 B13R2.162 OC1CCCC2=C1C=C(C=C2)Cl Z1008483484 [0,0,0,0,1,0|1,0,0]=2 88 B13R2.162 OC1CCOC2=C1C=C(C=C2)Br Z235448344 [0,0,0,0,1,0|2,1,0]=4 89 B12R1.1 CC1=CC=C(C=C1)CNCCO Z57328136 [1,0,1,0,0,0|2,0,0]=4 90 B12R1.1 CCCCOC1=CC=C(C=C1)O Z381414690 [1,0,1,0,0,0|2,0,0]=4 91 B12R1.1 CCCNCC1=CC=C(C=C1)F Z57065603 [1,0,1,0,0,0|0,1,0]=3 92 B12R1.1 CNCCOC1=CC=C(C=C1)Cl Z56963344 [1,0,1,0,0,0|2,0,0]=4 93 B12R1.1 ClC1=CC=C(C=C1)OCCCBr Z90122426 [1,0,1,0,0,0|2,0,0]=4 94 B12R1.1 NC1=CC=C(C=C1)CCCCO Z1262622677 [1,0,1,0,0,0|2,0,0]=4 95 B12R1.1 NCCCCC1=CC=C(C=C1)Br Z5880376049 [1,0,1,0,0,0|1,1,0]=4 96 B12R1.1 NCCCCC1=CC=C(C=C1)Cl Z3234944947 [1,0,1,0,0,0|1,0,0]=3 97 B12R1.1 NCCOCC1=CC=C(C=C1)Cl Z1511495255 [1,0,1,0,0,0|2,0,0]=4 98 B12R1.1 NCCSCC1=CC=C(C=C1)Cl Z1891773800 [1,0,1,0,0,0|2,0,0]=4 99 B12R1.1 OCCCNC1=CC=C(C=C1)Cl Z104647680 [1,0,1,0,0,0|2,0,0]=4 100 B12R1.1 OCCNCC1=CC=C(C=C1)F Z3225797537 [1,0,1,0,0,0|1,1,0]=4 101 B12R1.8 C=CCNCCC1=CC=CC=C1 Z90513756 [1,0,1,0,0,0|0,0,2]=4 102 B12R1.8 CCCCCOC1=CC=CC=C1 Z239095428 [1,0,1,0,0,0|2,0,0]=4 103 B12R1.8 CCCNCCC1=CC=CC=C1 Z90518163 [1,0,1,0,0,0|0,0,0]=2 104 B12R1.8 CCCNCCC1=NC=CC=C1 Z53110779 [1,0,1,0,0,0|1,0,0]=3 105 B12R1.8 CNCCCCC1=CC=CC=C1 Z385446848 [1,0,1,0,0,0|2,0,0]=4 106 B12R1.8 NCCCCCC1=CC=CC=C1 Z820118542 [1,0,1,0,0,0|2,0,0]=4 107 B12R1.8 NCCOCCC1=CC=CC=C1 Z1270210787 [1,0,1,0,0,0|2,0,0]=4 108 B12R1.8 OCCNCCC1=CC=CC=C1 Z90504498 [1,0,1,0,0,0|1,0,0]=3 109 B12R1.17 CCNC(=O)C1=CC(=CC=C1)Cl Z32024415 [1,0,1,0,0,0|1,0,1]=4 110 B12R1.17 CCNC(C)C1=CC(=CC=C1)O Z3479644552 [1,0,1,0,0,0|1,0,0]=3 111 B12R1.17 CNC[C@H](O)C1=CC(=CC=C1)O Z1198723489 [1,0,1,0,0,0|2,0,0]=4 112 B12R1.30 CCCCC(O)C1=CC=CC=C1 Z445987132 [1,0,1,0,0,0|2,0,0]=4 113 B12R1.30 CCCC[C@@H](N)C1=CC=CC=C1 Z1642061107 [1,0,1,0,0,0|2,0,0]=4 114 B12R1.30 CCCC[C@@H](O)C1=CC=CC=C1 Z1127664488 [1,0,1,0,0,0|2,0,0]=4 115 B12R1.30 CCCC[C@H](N)C1=CC=CC=C1 Z1649893428 [1,0,1,0,0,0|2,0,0]=4 116 B12R1.30 CCCC[C@H](O)C1=CC=CC=C1 Z1127664374 [1,0,1,0,0,0|2,0,0]=4 117 B12R1.30 CCCNC(C)C1=CC=CC=C1 Z57397067 [1,0,1,0,0,0|2,0,0]=4 118 B12R1.30 CCNCC(N)C1=CC=CC=C1 Z756920572 [1,0,1,0,0,0|1,0,0]=3 119 B12R1.69 CNCCC1=C(C=C(C=C1)F)F Z3302963389 [1,0,1,0,0,0|1,1,0]=4 120 B12R1.112 CNCC1=C(C=C(C=C1)F)OC Z5451130516 [1,0,1,0,0,0|1,1,0]=4 121 B12R1.112 COC1=C(C=CC(=C1)Br)CCN Z1551924124 [1,0,1,0,0,0|1,1,0]=4 122 B12R1.112 COC1=C(C=CC(=C1)F)CCN Z5577629908 [1,0,1,0,0,0|1,1,0]=4 123 B12R1.121 CNCCC1=C(C=CC=C1)C#N Z3719314609 [1,0,1,0,0,0|1,0,1]=4 124 B12R1.121 CNCCC1=C(C=CC=C1)OC Z159528470 [1,0,1,0,0,0|1,0,0]=3 125 B12R1.46 CC1=CC(=C(C=C1)CN)N(C)C Z972651030 [1,0,1,0,0,0|2,0,0]=4 126 B12R1.46 COC1=C(C=C(C=C1)C)C(C)N Z94601375 [1,0,1,0,0,0|2,0,0]=4 127 B12R1.46 COC1=C(C=C(C=C1)F)C(C)N Z332383672 [1,0,1,0,0,0|1,1,0]=4 128 B12R1.46 COC1=C(C=C(C=C1)N)C(C)C Z3244866812 [1,0,1,0,0,0|2,0,0]=4 129 B12R1.283 CN(C)C1=C(C=CC=N1)CCN Z3379430785 [1,0,1,0,0,0|2,0,0]=4 130 B12R1.283 CNCC1=C(C=CC=C1)C(C)C Z3847495068 [1,0,1,0,0,0|2,0,0]=4 131 B12R1.354 CNC(C)C1=C(C=CC(=C1)F)F Z239629056 [1,0,1,0,0,0|1,1,0]=4 132 B12R1.77 COC1=C(C=CC=C1)C(C)CN Z415655038 [1,0,1,0,0,0|1,0,0]=3 133 B12R1.77 COC1=C(C=CC=C1)C(N)CN Z425861114 [1,0,1,0,0,0|2,0,0]=4 134 B12R1.77 COC1=C(C=CC=C1)C(O)CN Z336086524 [1,0,1,0,0,0|2,0,0]=4 135 B12R1.268 COC1=C(C=C(C=C1)Br)CCN Z1682072470 [1,0,1,0,0,0|1,1,0]=4 136 B12R1.268 COC1=C(C=C(C=C1)C)CCN Z96092050 [1,0,1,0,0,0|2,0,0]=4 137 B12R1.268 COC1=C(C=C(C=C1)Cl)CCN Z1267773768 [1,0,1,0,0,0|1,0,0]=3 138 B12R1.268 COC1=C(C=C(C=C1)F)CCN Z2805877171 [1,0,1,0,0,0|1,1,0]=4 139 B12R1.268 CSC1=C(C=C(C=C1)Br)CCN Z2857139707 [1,0,1,0,0,0|1,1,0]=4 140 B12R2.41 C1=CC2=C(C=C1)CCNCC2 Z368542280 [2,0,0,0,0,0|0,0,0]=2 141 B12R2.41 C1=CC2=C(C=C1)CNCCC2 Z1079126054 [2,0,0,0,0,0|2,0,0]=4 142 B12R2.41 C1=CC2=C(C=C1)NCCCC2 Z374049420 [2,0,0,0,0,0|2,0,0]=4 143 B12R2.41 C1=NC=NC2=C1CCNCC2 Z1198181671 [2,0,0,0,0,0|2,0,0]=4 144 B14R1.13 C/N=C(\N)/NCCC1=CC=C(C=C1)Cl Z991127516 [0,1,1,0,0,0|1,0,1]=4 145 B14R1.13 O=C(CCl)NCCC1=CC=C(C=C1)Cl Z56891264 [0,1,1,0,0,0|1,0,1]=4 146 B14R1.14 C=CCNCCOC1=CC=C(C=C1)Cl Z56878963 [0,1,1,0,0,0|0,0,2]=4 147 B14R1.14 CCCCCCNC1=CC=C(C=C1)Br Z362816618 [0,1,1,0,0,0|1,1,0]=4 148 B14R1.14 CCCCCNCC1=CC=C(C=C1)Cl Z57327263 [0,1,1,0,0,0|1,0,0]=3 149 B14R1.14 CCCCCNCC1=CC=C(C=C1)F Z56175279 [0,1,1,0,0,0|1,1,0]=4 150 B14R1.14 OCCNCCOC1=CC=C(C=C1)I Z56906942 [0,1,1,0,0,0|1,1,0]=4 151 B14R1.33 CCONC(=O)CC1=CC=C(C=C1)Cl Z245505846 [0,1,1,0,0,0|1,0,1]=4 152 B14R1.677 CC(C)CNCCC1=CC=C(C=C1)F Z90518529 [0,1,1,0,0,0|0,1,0]=3 153 B14R1.774 CCCCCCC1=C(C=C(C=C1)O)O Z1197943321 [0,1,1,0,0,0|2,0,0]=4 154 B14R1.126 CCCCC(C)(N)C1=CC(=CC=C1)Br Z992952804 [0,1,1,0,0,0|1,1,0]=4 155 B14R1.149 CC(C)NCC(O)C1=CC(=CC=C1)O Z1198155517 [0,1,1,0,0,0|2,0,0]=4 156 B14R1.941 CCCNC(C)C1=CC(=C(C=C1)Cl)Cl Z451350566 [0,1,1,0,0,0|2,0,0]=4 157 B14R2.380 O=C1CC2=C(C=CC(=C2)O)CCN1 Z1509152364 [1,1,0,0,0,0|1,0,1]=4 158 B14R2.2400 COC1=CC2=C(C=C1)CCNCC2 Z425387736 [1,1,0,0,0,0|1,0,0]=3 159 B14R2.8719 NC1CCCCC2=C1C=CC(=C2)Br Z2581522045 [1,1,0,0,0,0|1,1,0]=4 160 B14R2.685 OC1CCCCC2=C1C=CC=C2Br Z1954811273 [1,1,0,0,0,0|2,0,0]=4 161 B14R2.2014 COC1CNCCC2=C1C=CC=C2 Z3716581996 [1,1,0,0,0,0|0,0,0]=2 162 B14R2.2014 NCC1CCCCC2=C1C=CC=C2 Z5341486855 [1,1,0,0,0,0|1,0,0]=3 163 B14R2.2014 O=CC1CCCCC2=C1C=CC=C2 Z1268606307 [1,1,0,0,0,0|1,0,1]=4 164 B14R2.4510 CN1CCCC(C2=C1C=CC=C2)N Z3218022278 [1,1,0,0,0,0|2,0,0]=4 165 B14R2.142 COC1=CC2=C(C=C1)CCCC2N Z1331054615 [0,1,0,0,1,0|2,0,0]=4 166 B14R2.142 COC1=CC2=C(C=C1)CCC[C@@H]2N Z1492796833 [0,1,0,0,1,0|2,0,0]=4 167 B14R2.142 COC1=CC2=C(C=C1)CCC[C@H]2N Z1483972113 [0,1,0,0,1,0|2,0,0]=4 168 B14R2.4536 CC1(CCSC2=C1C=C(C=C2)Cl)C Z1416179004 [0,1,0,0,1,0|1,0,0]=3 169 B14R2.4536 CC1(CCSC2=C1C=C(C=C2)O)C Z1513902728 [0,1,0,0,1,0|2,0,0]=4 170 B14R2.4536 CC1(CNCC2=C1C=C(C=C2)F)C Z4330191890 [0,1,0,0,1,0|0,1,0]=3 171 B14R2.4536 CC1(CNCC2=C1NC(=O)C=C2)C Z4778786046 [0,1,0,0,1,0|2,0,0]=4 172 B14R2.8045 CC1NCCC2=C1C=C(C=C2Cl)Cl Z1398462033 [0,1,0,0,1,0|0,0,0]=2 173 B14R2.8045 CC1NCCC2=C1C=C(C=C2F)F Z1413780509 [0,1,0,0,1,0|0,1,0]=3 174 B14R2.8045 NC1CCOC2=C1C=C(C=C2Cl)Cl Z384973308 [0,1,0,0,1,0|2,0,0]=4 175 B14R2.8045 N[C@@H]1CCCC2=C1C=C(C=C2F)F Z2418414297 [0,1,0,0,1,0|1,1,0]=4 176 B14R2.11684 CNC1CCOC2=C1C=C(C=C2)Br Z1770193372 [0,1,0,0,1,0|1,1,0]=4 177 B14R2.11684 CNC1CCSC2=C1C=C(C=C2)Br Z431545372 [0,1,0,0,1,0|1,1,0]=4 178 B14R2.11684 N#CC1CCOC2=C1C=C(C=C2)Cl Z1255389158 [0,1,0,0,1,0|1,0,1]=4 179 B14R2.11684 NCC1CCOC2=C1C=C(C=C2)Br Z3489035375 [0,1,0,0,1,0|1,1,0]=4 180 B14R2.28472 CC1NCCC2=C1C=C(C(=C2)O)O Z235344915 [0,1,0,0,1,0|1,0,0]=3 181 B14R2.68 BrC1=CC=C(C=C1)C2CNCCO2 Z397586786 [0,0,1,1,0,0|1,1,0]=4 182 B14R2.68 BrC1=CN=C(C=C1)C2CCCNC2 Z5057613664 [0,0,1,1,0,0|1,1,0]=4 183 B14R2.68 CC1=CC=C(C=C1)C2CCCNC2 Z1160899717 [0,0,1,1,0,0|1,0,0]=3 184 B14R2.68 ClC1=CC=C(C=C1)C2CCCCN2 Z1082216820 [0,0,1,1,0,0|2,0,0]=4 185 B14R2.68 ClC1=CC=C(C=C1)C2CCNCC2 Z1728629233 [0,0,1,1,0,0|2,0,0]=4 186 B14R2.68 ClC1=CC=C(C=C1)C2CNCCN2 Z1198163929 [0,0,1,1,0,0|1,0,0]=3 187 B14R2.68 ClC1=CC=C(C=C1)C2CNCCO2 Z234894847 [0,0,1,1,0,0|1,0,0]=3 188 B14R2.68 ClC1=CC=C(C=C1)C2CSCCN2 Z1210297684 [0,0,1,1,0,0|2,0,0]=4 189 B14R2.68 FC1=CC=C(C=C1)C2CNCCN2 Z1198166224 [0,0,1,1,0,0|1,1,0]=4 190 B14R2.68 FC1=CC=C(C=C1)C2CNCCO2 Z299600002 [0,0,1,1,0,0|1,1,0]=4 191 B14R2.68 IC1=CC=C(C=C1)C2CCCCC2 Z1269153713 [0,0,1,1,0,0|1,1,0]=4 192 B14R2.68 NC1=CC=C(C=C1)C2CNCCO2 Z1278927036 [0,0,1,1,0,0|2,0,0]=4 193 B14R2.68 OC1=CC=C(C=C1)C2CCCCC2 Z104493638 [0,0,1,1,0,0|2,0,0]=4 194 B14R2.68 OC1=CC=C(C=C1)C2CCCNC2 Z3327154941 [0,0,1,1,0,0|1,0,0]=3 195 B14R2.68 OC1=CC=C(C=C1)C2CNCCN2 Z2754867746 [0,0,1,1,0,0|2,0,0]=4 196 B14R2.72 BrC1=CC=C(C=C1)CC2CCCN2 Z281773886 [0,0,1,1,0,0|0,1,0]=3 197 B14R2.72 CC1=CC=C(C=C1)CC2CCCN2 Z382710498 [0,0,1,1,0,0|1,0,0]=3 198 B14R2.72 FC1=CC=C(C=C1)CC2CCCN2 Z281773862 [0,0,1,1,0,0|0,1,0]=3 199 B14R2.926 NC1CCCC1C2=CC=C(C=C2)Cl Z1696290149 [0,0,1,1,0,0|2,0,0]=4 200 B14R2.926 O[C@@H]1CCC[C@H]1C2=CC=C(C=C2)Cl Z2235790511 [0,0,1,1,0,0|2,0,0]=4 201 B14R2.951 FC1=CC=C(C=C1)CCNC2CC2 Z385448452 [0,0,1,1,0,0|0,1,0]=3 202 B14R2.21 BrC1=CC(=CC=C1)C2CNCCO2 Z397586798 [0,0,1,1,0,0|1,1,0]=4 203 B14R2.21 ClC1=CC(=CC=C1)C2CCCCN2 Z1082217152 [0,0,1,1,0,0|2,0,0]=4 204 B14R2.21 ClC1=CC(=CC=C1)C2CCNCC2 Z1741969475 [0,0,1,1,0,0|2,0,0]=4 205 B14R2.21 ClC1=CC(=CC=C1)C2CNCCN2 Z1255457923 [0,0,1,1,0,0|1,0,0]=3 206 B14R2.21 ClC1=CC(=CC=C1)C2CNCCO2 Z397586758 [0,0,1,1,0,0|1,0,0]=3 207 B14R2.21 ClC1=CC(=CC=C1)C2COCCN2 Z3211184189 [0,0,1,1,0,0|2,0,0]=4 208 B14R2.21 FC1=CC(=CC=C1)C2CNCCO2 Z397586684 [0,0,1,1,0,0|1,1,0]=4 209 B14R2.21 OC1=CC(=CC=C1)C2CCCCC2 Z1255421865 [0,0,1,1,0,0|2,0,0]=4 210 B14R2.21 OC1=CC(=CC=C1)C2CNCCO2 Z1198274547 [0,0,1,1,0,0|2,0,0]=4 211 B14R2.22 NC1CCC(C1)C2=CC(=CC=C2)Cl Z2240998878 [0,0,1,1,0,0|2,0,0]=4 212 B14R2.22 O=C1CC(CN1)C2=CC=CC(=C2)Cl Z1198266545 [0,0,1,1,0,0|1,0,1]=4 213 B14R2.4471 FC1(CCNC1)C2=CC(=CC=C2)Cl Z2009833087 [0,0,1,1,0,0|1,0,0]=3 214 B14R2.4471 NC1(CCCC1)C2=CC(=CC=C2)Cl Z381654320 [0,0,1,1,0,0|2,0,0]=4 215 B14R2.4471 OC1(CCCC1)C2=CC(=CC=C2)Cl Z872052596 [0,0,1,1,0,0|2,0,0]=4 216 B14R2.1146 COC1=C2CCNCC2=CC(=C1)Br Z5616127783 [0,0,1,1,0,0|1,1,0]=4 217 B14R2.2332 CCC1CCC2=C(C1)C=CC(=C2)O Z1513908433 [0,0,1,1,0,0|2,0,0]=4 218 B14R2.2332 CCN1CCC2=C(C1)C=CC(=C2)Cl Z1845271710 [0,0,1,1,0,0|2,0,0]=4 219 B14R3.54 C1=CC2=C(C=C1)C3CC(C3)NC2 Z3487835951 [1,0,0,1,0,0|2,0,0]=4 220 B14R3.6020 ClC1=NC2=C(C=N1)C3CCC2C3 Z2901766278 [0,0,0,1,1,0|2,0,0]=4 221 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 Z299596180 [1,0,0,0,1,0|0,1,0]=3 222 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 Z1117899488 [1,0,0,0,1,0|0,1,0]=3 223 B12R2.24 BrC1=CC2=C(C=C1)CNCC2 Z1224524500 [1,0,0,0,1,0|0,1,0]=3 224 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 Z283683538 [1,0,0,0,1,0|1,1,0]=4 225 B12R2.24 CC1=CC2=C(C=C1)CCCN2 Z1166113428 [1,0,0,0,1,0|2,0,0]=4 226 B12R2.24 CC1=CC2=C(C=C1)CNCC2 Z1839475447 [1,0,0,0,1,0|1,0,0]=3 227 B12R2.24 CC1=CC2=C(C=C1)NCCC2 Z104494706 [1,0,0,0,1,0|2,0,0]=4 228 B12R2.24 CC1=CC2=C(C=C1)OCCC2 Z939648534 [1,0,0,0,1,0|2,0,0]=4 229 B12R2.24 ClC1=CC2=C(C=C1)CCCN2 Z3244460786 [1,0,0,0,1,0|1,0,0]=3 230 B12R2.24 ClC1=CC2=C(C=C1)CCNC2 Z1716481593 [1,0,0,0,1,0|0,0,0]=2 231 B12R2.24 ClC1=CC2=C(C=C1)NCCC2 Z259727454 [1,0,0,0,1,0|1,0,0]=3 232 B12R2.24 ClC1=CC2=C(C=C1)OCCN2 Z1198179941 [1,0,0,0,1,0|2,0,0]=4 233 B12R2.24 ClC1=CC2=C(C=C1)OCCO2 Z382713970 [1,0,0,0,1,0|2,0,0]=4 234 B12R2.24 ClC1=CC2=C(C=C1)SCCN2 Z361994002 [1,0,0,0,1,0|2,0,0]=4 235 B12R2.24 ClC1=CC2=C(N=C1)NCCC2 Z1862012742 [1,0,0,0,1,0|2,0,0]=4 236 B12R2.24 ClC1=NC2=C(C=N1)CCCC2 Z1255459970 [1,0,0,0,1,0|2,0,0]=4 237 B12R2.24 ClC1=NC2=C(C=N1)CNCC2 Z3235028171 [1,0,0,0,1,0|2,0,0]=4 238 B12R2.24 ClC1=NC2=C(CCCC2)N=C1 Z1255401581 [1,0,0,0,1,0|2,0,0]=4 239 B12R2.24 ClC1=NN=C2CCCCC2=C1 Z935132528 [1,0,0,0,1,0|2,0,0]=4 240 B12R2.24 ClC1=NN=C2CCNCC2=C1 Z3241251390 [1,0,0,0,1,0|2,0,0]=4 241 B12R2.24 ClC1=NN=C2CNCCC2=C1 Z2418414343 [1,0,0,0,1,0|2,0,0]=4 242 B12R2.24 FC1=CC2=C(C=C1)CCNC2 Z979717316 [1,0,0,0,1,0|0,1,0]=3 243 B12R2.24 FC1=CC2=C(C=C1)CNCC2 Z1198169933 [1,0,0,0,1,0|0,1,0]=3 244 B12R2.24 NC1=CC2=C(C=C1)CCCC2 Z278204684 [1,0,0,0,1,0|1,0,0]=3 245 B12R2.24 NC1=CC2=C(C=C1)OCCC2 Z728136682 [1,0,0,0,1,0|2,0,0]=4 246 B12R2.24 NC1=NC2=C(C=C1)CCCC2 Z1198183880 [1,0,0,0,1,0|2,0,0]=4 247 B12R2.24 NC1=NC=C2CCCCC2=C1 Z1198275331 [1,0,0,0,1,0|2,0,0]=4 248 B12R2.24 O=C1C=C2CCCCC2=CN1 Z1203746588 [1,0,0,0,1,0|2,0,0]=4 249 B12R2.24 O=C1C=CC2=C(N1)CCCC2 Z1198153259 [1,0,0,0,1,0|2,0,0]=4 250 B12R2.24 O=C1C=CC2=C(N1)CCNC2 Z3234963668 [1,0,0,0,1,0|2,0,0]=4 251 B12R2.24 OC1=CC2=C(C=C1)CCCC2 Z57182387 [1,0,0,0,1,0|1,0,0]=3 252 B12R2.24 OC1=CC2=C(C=C1)CCCN2 Z1198176201 [1,0,0,0,1,0|2,0,0]=4 253 B12R2.24 OC1=CC2=C(C=C1)CCNC2 Z382690838 [1,0,0,0,1,0|1,0,0]=3 254 B12R2.24 OC1=CC2=C(C=C1)CCOC2 Z1551961557 [1,0,0,0,1,0|2,0,0]=4 255 B12R2.24 OC1=CC2=C(C=C1)CNCC2 Z3018438111 [1,0,0,0,1,0|1,0,0]=3 256 B12R2.24 OC1=CC2=C(C=C1)COCC2 Z1255359696 [1,0,0,0,1,0|2,0,0]=4 257 B12R2.24 OC1=CC2=C(C=C1)OCCC2 Z1201627010 [1,0,0,0,1,0|2,0,0]=4 258 B12R2.24 OC1=CC2=C(CCCC2)N=C1 Z1255357750 [1,0,0,0,1,0|2,0,0]=4 259 B12R2.1081 CC1CCNC2=C1C=CC=C2 Z382691338 [1,0,0,0,1,0|1,0,0]=3 260 B12R2.1081 CC1CNCC2=C1C=CC=C2 Z1741982189 [1,0,0,0,1,0|0,0,0]=2 261 B12R2.1081 CC1CNCC2=C1N=CN=C2 Z2753228711 [1,0,0,0,1,0|2,0,0]=4 262 B12R2.1081 CN1CCNC2=C1C=CC=C2 Z558641952 [1,0,0,0,1,0|2,0,0]=4 263 B12R2.1081 NC1CCCC2=C1C=CC=C2 Z316170348 [1,0,0,0,1,0|1,0,0]=3 264 B12R2.1081 NC1CCCC2=C1C=CN=C2 Z3244922506 [1,0,0,0,1,0|2,0,0]=4 265 B12R2.1081 NC1CCOC2=C1C=CC=C2 Z85923435 [1,0,0,0,1,0|2,0,0]=4 266 B12R2.1081 NC1CCSC2=C1C=CC=C2 Z57066684 [1,0,0,0,1,0|2,0,0]=4 267 B12R2.1081 NC1COCC2=C1C=CC=C2 Z1198178449 [1,0,0,0,1,0|2,0,0]=4 268 B12R2.1081 NC1CSCC2=C1C=CC=C2 Z1695783215 [1,0,0,0,1,0|2,0,0]=4 269 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 Z1442208747 [1,0,0,0,1,0|2,0,0]=4 270 B12R2.1081 O=C1CCCC2=C1C=CC=C2 Z104477014 [1,0,0,0,1,0|1,0,1]=4 271 B12R2.1081 O=C1NCCC2=C1C=CC=C2 Z56801375 [1,0,0,0,1,0|1,0,1]=4 272 B12R2.1081 OC1CCCC2=C1C=CC=C2 Z56899171 [1,0,0,0,1,0|1,0,0]=3 273 B12R2.1081 OC1CCCC2=C1C=CC=N2 Z1198156585 [1,0,0,0,1,0|2,0,0]=4 274 B12R2.1081 OC1CCCC2=C1C=NC=C2 Z1255398550 [1,0,0,0,1,0|2,0,0]=4 275 B12R2.1081 OC1CCNC2=C1C=CC=C2 Z1198723522 [1,0,0,0,1,0|2,0,0]=4 276 B12R2.1081 OC1CCOC2=C1C=CC=C2 Z335244980 [1,0,0,0,1,0|2,0,0]=4 277 B12R2.1081 OC1CCSC2=C1C=CC=C2 Z57085790 [1,0,0,0,1,0|2,0,0]=4 278 B12R2.1081 OC1COCC2=C1C=CC=C2 Z1255366473 [1,0,0,0,1,0|2,0,0]=4 279 B12R2.1081 OC1CSCC2=C1C=CC=C2 Z445987402 [1,0,0,0,1,0|2,0,0]=4 280 B12R2.1081 O[C@@H]1CCCC2=C1N=CC=C2 Z1255505566 [1,0,0,0,1,0|2,0,0]=4 281 B12R2.1081 O[C@@H]1CCOC2=C1C=CC=C2 Z959151866 [1,0,0,0,1,0|2,0,0]=4 282 B12R2.1081 O[C@@H]1CCSC2=C1C=CC=C2 Z959151622 [1,0,0,0,1,0|2,0,0]=4 283 B12R2.1081 O[C@H]1CCCC2=C1N=CC=C2 Z1216847007 [1,0,0,0,1,0|2,0,0]=4 284 B12R2.1081 O[C@H]1CCOC2=C1C=CC=C2 Z959151868 [1,0,0,0,1,0|2,0,0]=4 285 B12R2.1081 O[C@H]1CCSC2=C1C=CC=C2 Z959151626 [1,0,0,0,1,0|2,0,0]=4 286 B12R2.132 CC1=CC2=C(C=C1)CCC2N Z1259339087 [0,0,0,0,2,0|2,0,0]=4 287 B12R2.132 CN1CCC2=C1C=C(C=C2)N Z334596086 [0,0,0,0,2,0|2,0,0]=4 288 B12R2.132 NC1=CC2=C(C=C1)CCC2O Z1203584428 [0,0,0,0,2,0|2,0,0]=4 289 B12R2.132 NC1CCC2=C1C=C(C=C2)Cl Z2692095081 [0,0,0,0,2,0|1,0,0]=3 290 B12R2.132 NC1CCC2=C1C=C(C=C2)F Z1263820321 [0,0,0,0,2,0|1,1,0]=4 291 B12R2.132 NC1CCC2=C1C=C(C=C2)O Z1198165276 [0,0,0,0,2,0|2,0,0]=4 292 B12R2.132 NC1COC2=C1C=C(C=C2)Cl Z1431002566 [0,0,0,0,2,0|2,0,0]=4 293 B12R2.132 O=C1NCC2=C1C=C(C=C2)Cl Z1198176504 [0,0,0,0,2,0|1,0,1]=4 294 B12R2.132 OC1CCC2=C1C=C(C=C2)F Z815114600 [0,0,0,0,2,0|1,1,0]=4 295 B12R2.202 NC1CCCC2=C1C=C(S2)Cl Z1262644155 [0,0,0,0,2,0|2,0,0]=4 296 B14R1.950 COCC(C)NC1=C(C=CC(=C1)Cl)C Z2696918735 [0,0,1,0,0,1|1,0,0]=3