0 B15R3.794 O=C1CCC2=C3N1CCC3=CC=C2 Z1198154439 [0,0,0,0,0,0|0,0,0]=0 1 B14R3.164 C1=CC2=CC=CC3=C2C(=C1)CC3 Z56926550 [1,0,0,0,0,0|1,0,2]=4 2 B14R2.95 C=CC(=O)N1CCC2=C1C=CC=C2 Z440633700 [0,0,1,0,0,0|0,0,2]=3 3 B14R2.95 CC(CN)N1CCC2=C1C=CC=C2 Z270834258 [0,0,1,0,0,0|2,0,1]=4 4 B14R2.95 CNC(=O)N1C=NC2=C1C=CC=C2 Z1509163297 [0,0,1,0,0,0|2,0,1]=4 5 B14R2.95 CNC(=S)N1CCC2=C1C=CC=C2 Z45823254 [0,0,1,0,0,0|1,1,0]=3 6 B14R2.95 COC(=O)C1CCC2=C1C=CC=C2 Z1079167842 [0,0,1,0,0,0|2,0,0]=3 7 B14R2.95 COC(=O)C1COC2=C1C=CC=C2 Z1197141941 [0,0,1,0,0,0|3,0,0]=4 8 B14R2.95 COC(=O)N1CCC2=C1C=CC=C2 Z57190287 [0,0,1,0,0,0|1,0,0]=2 9 B14R2.95 NCC(=O)N1CCC2=C1C=CC=C2 Z234896403 [0,0,1,0,0,0|1,0,0]=2 10 B14R2.95 O=C(CCl)N1CCC2=C1C=CC=C2 Z56869469 [0,0,1,0,0,0|1,0,0]=2 11 B14R2.95 O=C(CO)N1CCC2=C1C=CC=C2 Z431953002 [0,0,1,0,0,0|1,0,0]=2 12 B14R2.95 O=C(NO)C1CCC2=C1C=CC=C2 Z1776097430 [0,0,1,0,0,0|3,0,0]=4 13 B14R2.8053 CC(=O)N1CCC2=C1C(=CC=C2)N Z1201619740 [0,0,1,0,0,0|1,0,0]=2 14 B14R2.8053 NC(=O)N1CCC2=C1C(=CC=C2)F Z1449633199 [0,0,1,0,0,0|2,0,0]=3 15 B14R2.8053 O=C(O)C1CCC2=C1C(=CC=C2)F Z1251361024 [0,0,1,0,0,0|3,0,0]=4 16 B14R2.8053 O=C(O)C1CCC2=C1C(=CC=C2)O Z1486018098 [0,0,1,0,0,0|3,0,0]=4 17 B14R2.11684 NCC1=C2NC(=O)COC2=CC=C1 Z3061112189 [0,0,1,0,0,0|2,0,0]=3 18 B14R2.11684 O=CC1=C2NC(=O)COC2=CC=C1 Z1813211274 [0,0,1,0,0,0|2,0,1]=4 19 B14R2.28523 CN1C(=O)COC2=C1C(=CC=C2)N Z1255391970 [0,0,1,0,0,0|2,0,0]=3 20 B16R3.153 O=C1CCC2=C3C1=CC=CC3=CC=C2 Z2573662594 [0,0,0,0,0,1|1,0,2]=4 21 B13R2.1 CCNC1CCC2=C1C=CC=C2 Z812517138 [1,0,1,0,0,0|2,0,0]=4 22 B13R2.1 NCCN1CCC2=C1C=CC=C2 Z594038402 [1,0,1,0,0,0|1,0,1]=4 23 B13R2.1 OCCN1CCC2=C1C=CC=C2 Z425793930 [1,0,1,0,0,0|1,0,1]=4 24 B13R2.72 CC(=O)N1CCC2=C1C=CC=C2 Z30624388 [1,0,1,0,0,0|0,0,0]=2 25 B13R2.72 NC(=O)C1CCC2=C1C=CC=C2 Z1127744301 [1,0,1,0,0,0|2,0,0]=4 26 B13R2.72 NC(=O)N1CCC2=C1C=CC=C2 Z198194398 [1,0,1,0,0,0|1,0,0]=3 27 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 Z792377300 [1,0,1,0,0,0|2,0,0]=4 28 B13R2.32 CN1C(=O)C=NC2=C1C=CC=C2 Z54067791 [1,0,1,0,0,0|1,0,1]=4 29 B13R2.32 CN1C(=O)CNC2=C1C=CC=C2 Z1021459514 [1,0,1,0,0,0|1,0,0]=3 30 B13R2.1613 CCC1=C2CNCCC2=CC=C1 Z3066897657 [1,0,1,0,0,0|2,0,0]=4 31 B13R2.1613 CCC1=C2NCCCC2=CC=C1 Z259727430 [1,0,1,0,0,0|0,0,1]=3 32 B13R2.1613 CCC1NCCC2=C1C=CC=C2 Z1267881708 [1,0,1,0,0,0|2,0,0]=4 33 B13R2.1613 CCN1CCNC2=C1C=CC=C2 Z568630904 [1,0,1,0,0,0|1,0,1]=4 34 B13R2.1613 COC1=C2NCCCC2=CC=C1 Z285175138 [1,0,1,0,0,0|1,0,1]=4 35 B13R2.1613 NCC1=C2NCCCC2=CC=C1 Z2583494259 [1,0,1,0,0,0|1,0,1]=4 36 B13R2.162 CC1=C2NC(=O)CNC2=NC=C1 Z1198176103 [1,0,1,0,0,0|2,0,0]=4 37 B13R2.162 CC1=C2NC(=O)COC2=CC=C1 Z3236229774 [1,0,1,0,0,0|1,0,0]=3 38 B13R2.162 NC1=C2NC(=O)COC2=CC=C1 Z1198310512 [1,0,1,0,0,0|2,0,0]=4 39 B13R2.162 NC1=C2NC(=O)OCC2=CC=C1 Z1262673207 [1,0,1,0,0,0|2,0,0]=4 40 B13R2.162 O=C1CCC2=CC=CC(=C2C1)Br Z1269110065 [1,0,1,0,0,0|2,0,0]=4 41 B13R2.162 O=C1CCC2=CC=CC(=C2C1)Cl Z1198163928 [1,0,1,0,0,0|2,0,0]=4 42 B13R2.162 O=C1CCC2=CC=CC(=C2N1)F Z1198183608 [1,0,1,0,0,0|1,0,0]=3 43 B13R2.162 O=C1CCC2=CC=CC(=C2N1)O Z1198166008 [1,0,1,0,0,0|1,0,0]=3 44 B13R2.162 O=C1CNC2=CC=CC(=C2N1)F Z558640102 [1,0,1,0,0,0|2,0,0]=4 45 B13R2.162 O=C1COC2=CC=CC(=C2N1)Br Z1269141567 [1,0,1,0,0,0|2,0,0]=4 46 B13R2.162 O=C1COC2=CC=CC(=C2N1)Cl Z1255424669 [1,0,1,0,0,0|2,0,0]=4 47 B13R2.162 O=C1COC2=CC=CC(=C2N1)F Z1413800305 [1,0,1,0,0,0|2,0,0]=4 48 B13R2.162 O=C1COC2=CC=CC(=C2N1)O Z1198269939 [1,0,1,0,0,0|2,0,0]=4 49 B13R2.4818 CN1CCCC2=C1C(=CC=C2)N Z808240966 [1,0,1,0,0,0|1,0,1]=4 50 B15R2.73 CCCC(=O)N1CCC2=C1C=CC=C2 Z30624411 [0,1,1,0,0,0|0,0,0]=2 51 B15R2.73 CCOC(=O)C1CNC2=C1C=CC=C2 Z3235901484 [0,1,1,0,0,0|2,0,0]=4 52 B15R2.73 COCC(=O)N1CCC2=C1C=CC=C2 Z32329930 [0,1,1,0,0,0|0,0,0]=2 53 B15R2.73 CSCC(=O)N1CCC2=C1C=CC=C2 Z30623717 [0,1,1,0,0,0|0,0,0]=2 54 B15R2.73 O=C(CCCl)N1CCC2=C1C=CC=C2 Z217707220 [0,1,1,0,0,0|0,0,0]=2 55 B15R2.1255 CC(C)C(=O)N1CCC2=C1C=CC=C2 Z30624402 [0,1,1,0,0,0|0,0,0]=2 56 B15R2.1255 CC(Cl)C(=O)N1CCC2=C1C=CC=C2 Z56968826 [0,1,1,0,0,0|0,0,0]=2 57 B15R2.1255 CC(N)C(=O)N1CCC2=C1C=CC=C2 Z234896379 [0,1,1,0,0,0|0,0,0]=2 58 B15R2.19094 C#CC(=O)N1CCC2=C1C=CC(=C2)F Z2015570281 [0,1,1,0,0,0|0,0,2]=4 59 B15R2.19094 C=CC(=O)N1CCC2=C1C=CC(=C2)C Z3462579104 [0,1,1,0,0,0|0,0,2]=4 60 B15R2.19094 C=CC(=O)N1CCC2=C1C=CC(=C2)Cl Z2738283480 [0,1,1,0,0,0|0,0,2]=4 61 B15R2.19094 COC(=O)N1CCC2=C1C=CC(=C2)N Z332726330 [0,1,1,0,0,0|1,0,0]=3 62 B15R2.19094 O=C(CCl)N1CCC2=C1C=CC(=C2)Cl Z1416188799 [0,1,1,0,0,0|1,0,0]=3 63 B15R2.19094 O=C(CCl)N1CCC2=C1C=CC(=C2)F Z2596886123 [0,1,1,0,0,0|1,0,0]=3 64 B15R2.19393 C=CC(=O)N1C2=C(C=CC=C2)CC1C Z440633760 [0,1,1,0,0,0|0,0,2]=4 65 B15R2.19393 CC1CC2=C(N1C(=O)CCl)C=CC=C2 Z56869453 [0,1,1,0,0,0|1,0,0]=3 66 B15R2.19393 CC1CC2=C(N1C(=O)CO)C=CC=C2 Z228585432 [0,1,1,0,0,0|1,0,0]=3 67 B15R2.19393 CCC(=O)N1C2=C(C=CC=C2)CC1C Z27691015 [0,1,1,0,0,0|0,0,0]=2 68 B15R2.19393 COC(=O)C1C2=C(C=CC=C2)CC1N Z3674086233 [0,1,1,0,0,0|2,0,0]=4 69 B15R2.23388 COC(=O)C1CC(C2=C1C=CC=C2)N Z1416174376 [0,1,1,0,0,0|2,0,0]=4 70 B15R2.79417 CCC(=O)N1CCC2=C1C=C(C=C2)N Z332725540 [0,1,1,0,0,0|0,0,0]=2 71 B15R2.5773 CCN1C(=O)CCC2=C1C=CC(=C2)N Z424789464 [0,1,1,0,0,0|0,0,0]=2 72 B15R2.5778 CCN1C(=O)CCC2=C1C=CC=C2O Z1513833150 [0,1,1,0,0,0|0,0,0]=2 73 B15R2.6237 CCN1C(=O)C(=NC2=C1C=CC=C2)O Z1201627647 [0,1,1,0,0,0|1,0,1]=4 74 B15R2.9941 CC1CCC2=C(N1CCN)C=CC=C2 Z425484888 [0,1,1,0,0,0|1,0,1]=4 75 B15R2.9941 NCCN1C(=O)COC2=C1C=CC=C2 Z1695669928 [0,1,1,0,0,0|1,0,0]=3 76 B15R2.9941 O=C1COC2=C(N1CCO)C=CC=C2 Z425794444 [0,1,1,0,0,0|1,0,0]=3 77 B15R2.9941 O=C1NCC2=C(N1CCO)C=CC=C2 Z1127315179 [0,1,1,0,0,0|1,0,0]=3 78 B15R2.9941 O=CCN1C(=O)COC2=C1C=CC=C2 Z906143156 [0,1,1,0,0,0|1,0,1]=4 79 B15R2.19753 O=C(O)CCC1=C2OCOC2=CC=C1 Z1262514530 [0,1,1,0,0,0|2,0,0]=4 80 B15R2.13625 CS(=O)(=O)N1CCC2=C1C(=CC=C2)F Z1449712336 [0,1,1,0,0,0|2,0,0]=4 81 B15R2.20947 COC1=C2C(=CC=C1)CCC2C(=O)O Z1251352964 [0,1,1,0,0,0|2,0,0]=4 82 B15R3.14759 O=C1CC2=C3N1CCCC3=CC=C2 Z1198181116 [1,1,0,0,0,0|0,0,2]=4 83 B17R3.53342 NC1=CC2=C3C(=C1)CCC(=O)N3CCC2 Z1509524210 [0,1,0,0,0,1|0,0,0]=2 84 B17R3.53342 O=C1CCC2=CC(=CC3=C2N1CCC3)Br Z1509645423 [0,1,0,0,0,1|0,0,0]=2 85 B13R1.91 C=CC(=O)NC1=C(C=CC=C1)CC Z440633714 [0,0,2,0,0,0|0,0,2]=4 86 B13R1.91 CCC(=O)NC1=C(C=CC=C1)C#N Z26489203 [0,0,2,0,0,0|1,0,1]=4 87 B13R1.91 CCC(=O)NC1=C(C=CC=C1)SC Z26434996 [0,0,2,0,0,0|1,0,0]=3 88 B13R1.91 CCC1=C(C=CC=C1)NC(=O)CCl Z55993074 [0,0,2,0,0,0|1,0,0]=3 89 B13R1.91 CCC1=C(C=CC=C1)NC(=O)CN Z56983036 [0,0,2,0,0,0|1,0,0]=3 90 B13R1.91 CNC(=O)NC1=C(C=CC=C1)OC Z55293776 [0,0,2,0,0,0|2,0,0]=4 91 B13R1.91 COC1=C(C=CC=C1)NC(=O)CCl Z56862617 [0,0,2,0,0,0|2,0,0]=4 92 B13R1.91 CSC1=C(C=CC=C1)NC(=O)CCl Z56869398 [0,0,2,0,0,0|2,0,0]=4 93 B13R1.532 CCC(C(=O)NC)C1=CC=CC=C1 Z68248483 [0,0,2,0,0,0|2,0,0]=4 94 B13R1.532 CCN(C(=O)CCl)C1=CC=CC=C1 Z56896273 [0,0,2,0,0,0|1,0,0]=3 95 B13R1.532 CCN(C(=O)CN)C1=CC=CC=C1 Z1449746821 [0,0,2,0,0,0|1,0,0]=3 96 B13R1.696 CCC(=O)N(C)C1=C(C=CC=N1)Br Z1653345844 [0,0,2,0,0,0|2,0,0]=4 97 B13R1.718 CCC(=O)NCCC1=CC=CC=C1 Z27761616 [0,0,2,0,0,0|0,0,0]=2 98 B13R1.718 CCC(=O)NOCC1=CC=CC=C1 Z225862544 [0,0,2,0,0,0|1,0,0]=3 99 B13R1.718 NCC(=O)NCCC1=CC=CC=C1 Z234895191 [0,0,2,0,0,0|1,0,0]=3 100 B13R1.718 O=C(CCl)CCCC1=CC=CC=C1 Z1262478900 [0,0,2,0,0,0|2,0,0]=4 101 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 Z56869446 [0,0,2,0,0,0|1,0,0]=3 102 B13R1.718 O=C(CCl)NCCC1=NC=CC=C1 Z299693414 [0,0,2,0,0,0|2,0,0]=4 103 B13R1.718 O=C(CCl)NOCC1=CC=CC=C1 Z147646766 [0,0,2,0,0,0|2,0,0]=4 104 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 Z406377440 [0,0,2,0,0,0|1,0,0]=3 105 B13R1.42 CCNC(=O)NCC1=CC=CC=C1 Z44585735 [0,0,2,0,0,0|1,0,0]=3 106 B13R1.42 CCNC(=O)OCC1=CC=CC=C1 Z32025015 [0,0,2,0,0,0|1,0,0]=3 107 B13R1.42 CCOC(=O)NCC1=CC=CC=C1 Z31478129 [0,0,2,0,0,0|2,0,0]=4 108 B13R1.42 CONC(=O)CCC1=CC=CC=C1 Z254325116 [0,0,2,0,0,0|1,0,0]=3 109 B13R1.15 CC1=CC(=CC=C1)OCC(=O)NN Z56862410 [0,0,2,0,0,0|2,0,0]=4 110 B13R1.15 CNC(=O)/C=C/C1=CC(=CC=C1)C Z32016027 [0,0,2,0,0,0|0,0,2]=4 111 B13R1.15 CNC(=O)CNC1=CC(=CC=C1)C Z104589456 [0,0,2,0,0,0|1,0,0]=3 112 B13R1.15 CNC(=O)CNC1=CC(=CC=C1)F Z104640814 [0,0,2,0,0,0|2,0,0]=4 113 B13R1.15 CNC(=O)COC1=CC(=CC=C1)Br Z19736342 [0,0,2,0,0,0|2,0,0]=4 114 B13R1.15 CNC(=O)COC1=CC(=CC=C1)Cl Z19740536 [0,0,2,0,0,0|2,0,0]=4 115 B13R1.15 CNC(=O)COC1=CC(=CC=C1)F Z19755334 [0,0,2,0,0,0|2,0,0]=4 116 B13R1.15 CNC(=O)COC1=CC(=CC=C1)I Z25075928 [0,0,2,0,0,0|2,0,0]=4 117 B13R1.15 CNC(=O)COC1=CC(=CC=C1)N Z285226606 [0,0,2,0,0,0|2,0,0]=4 118 B13R1.15 COC(=O)CCC1=CC(=CC=C1)N Z1255441375 [0,0,2,0,0,0|2,0,0]=4 119 B13R1.149 CC(=O)NCCC1=CC(=CC=C1)Br Z2286728666 [0,0,2,0,0,0|1,0,0]=3 120 B13R1.149 CC(=O)NCCC1=CC(=CC=C1)Cl Z52318908 [0,0,2,0,0,0|1,0,0]=3 121 B13R1.149 CC(=O)OCCC1=CC(=CC=C1)N Z1262633949 [0,0,2,0,0,0|2,0,0]=4 122 B13R1.149 NC(=O)NCCC1=CC(=CC=C1)Cl Z198195798 [0,0,2,0,0,0|2,0,0]=4 123 B13R1.643 CCC1=CC(=CC=C1)OCC(=O)O Z56910356 [0,0,2,0,0,0|2,0,0]=4 124 B13R1.643 CNC1=CC(=CC=C1)CCC(=O)O Z1623872023 [0,0,2,0,0,0|2,0,0]=4 125 B13R1.643 COC1=CC(=CC=C1)CCC(=O)O Z169916350 [0,0,2,0,0,0|2,0,0]=4 126 B13R1.643 COC1=CC(=CC=C1)CNC(=O)N Z198194944 [0,0,2,0,0,0|2,0,0]=4 127 B13R1.643 COC1=CC(=CC=C1)NCC(=O)N Z104592028 [0,0,2,0,0,0|2,0,0]=4 128 B13R1.643 COC1=CC(=CC=C1)SCC(=O)N Z290601360 [0,0,2,0,0,0|2,0,0]=4 129 B13R1.643 NC(=O)COC1=CC(=CC=C1)CO Z57462495 [0,0,2,0,0,0|2,0,0]=4 130 B13R1.643 NCC1=CC(=CC=C1)OCC(=O)N Z239127266 [0,0,2,0,0,0|2,0,0]=4 131 B13R1.2135 CCC1=C(C(=CC=C1)C)NC(=S)N Z111411718 [0,0,2,0,0,0|1,1,0]=4 132 B15R3.10083 O=C1CCC2=NC3=C(N12)C=CC=C3 Z56822198 [0,0,1,1,0,0|1,0,1]=4 133 B15R3.2013 O=C1CN2CCC1C3=C2C=CC=C3 Z1513599173 [0,0,1,1,0,0|2,0,0]=4 134 B13R2.135 CCC1C(=O)NC2=C1C=CC=C2 Z1201625783 [0,0,1,0,1,0|2,0,0]=4 135 B13R2.135 CCN1C(=NC2=C1C=CC=C2)N Z56921771 [0,0,1,0,1,0|2,0,0]=4 136 B13R2.135 CCN1C(=NC2=C1C=CC=C2)S Z56896246 [0,0,1,0,1,0|1,1,0]=4 137 B13R2.135 CCN1C(=O)NC2=C1C=CC=C2 Z57114989 [0,0,1,0,1,0|1,0,0]=3 138 B13R2.581 N#CC1=CC=CC2=C1NC(=O)C2 Z1201621659 [0,0,1,0,1,0|1,0,1]=4 139 B13R2.581 NCC1=C2NC(=O)CC2=CC=C1 Z4741673841 [0,0,1,0,1,0|1,0,0]=3 140 B13R2.4856 CN1C(=O)NC2=C1C(=CC=C2)N Z5356826373 [0,0,1,0,1,0|2,0,0]=4 141 B15R2.4 CCC(=O)NC1CCC2=C1C=CC=C2 Z195313604 [0,0,1,0,0,1|1,0,0]=3 142 B15R2.1601 C=CC(=O)N1CCC2=C(C1)C=CC=C2 Z440633746 [0,0,1,0,0,1|0,0,2]=4 143 B15R2.1601 CNC(=O)N1CCC2=C(C1)C=CC=C2 Z177087622 [0,0,1,0,0,1|1,0,0]=3 144 B15R2.1601 O=C(CCl)N1CCC2=C(C1)C=CC=C2 Z56896341 [0,0,1,0,0,1|1,0,0]=3 145 B15R2.1601 O=C(CO)N1CCC2=C(C1)C=CC=C2 Z228585440 [0,0,1,0,0,1|1,0,0]=3 146 B15R2.79765 C=CC(=O)N1CCCC2=C1C=CC=C2 Z440633624 [0,0,1,0,0,1|0,0,2]=4 147 B15R2.79765 C=CC(=O)N1CCOC2=C1C=CC=C2 Z440634772 [0,0,1,0,0,1|0,0,2]=4 148 B15R2.79765 C=CC(=O)N1CCSC2=C1C=CC=C2 Z440634350 [0,0,1,0,0,1|0,0,2]=4 149 B15R2.79765 CNC(=O)C1CCCC2=C1C=CC=C2 Z300243698 [0,0,1,0,0,1|2,0,0]=4 150 B15R2.79765 COC(=O)C1CCCC2=C1C=CC=C2 Z308244414 [0,0,1,0,0,1|2,0,0]=4 151 B15R2.79765 COC(=O)C1CCNC2=C1C=CC=C2 Z1255403943 [0,0,1,0,0,1|2,0,0]=4 152 B15R2.79765 COC(=O)C1CCOC2=C1C=CC=C2 Z1100261897 [0,0,1,0,0,1|2,0,0]=4 153 B15R2.79765 COC(=O)C1CNCC2=C1C=CC=C2 Z2234170006 [0,0,1,0,0,1|2,0,0]=4 154 B15R2.79765 COC(=O)C1NCCC2=C1C=CC=C2 Z1276757443 [0,0,1,0,0,1|2,0,0]=4 155 B15R2.79765 NCC(=O)N1CCCC2=C1C=CC=C2 Z818732120 [0,0,1,0,0,1|1,0,0]=3 156 B15R2.79765 NCC(=O)N1CCOC2=C1C=CC=C2 Z1450067678 [0,0,1,0,0,1|1,0,0]=3 157 B15R2.79765 O=C(CCl)N1CCCC2=C1C=CC=C2 Z56896325 [0,0,1,0,0,1|1,0,0]=3 158 B15R2.79765 O=C(CCl)N1CCSC2=C1C=CC=C2 Z89267042 [0,0,1,0,0,1|1,0,0]=3 159 B15R2.79765 O=C(CCl)N1CCSC2=C1C=CC=N2 Z1562154227 [0,0,1,0,0,1|2,0,0]=4 160 B15R2.79765 O=C(CO)N1CCCC2=C1C=CC=C2 Z228585450 [0,0,1,0,0,1|1,0,0]=3 161 B15R3.1969 C1=CC2=C3C(=C1)CCCC3CNC2 Z3216186279 [1,0,0,0,0,1|1,0,1]=4