0 B14R2.2974 NCC1(CCCC1)C2=CC=CC=C2 Z199451530 [0,0,0,0,0,0|0,0,0]=0 1 B14R2.2974 NCC1(CCCC1)C2=CC=NC=C2 Z1552027318 [0,0,0,0,0,0|1,0,0]=1 2 B14R2.2974 NCC1(CCOC1)C2=CC=CC=C2 Z3314475143 [0,0,0,0,0,0|1,0,0]=1 3 B14R2.2974 O=CC1(CCOC1)C2=CC=CC=C2 Z1511803589 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.2974 OCC1(CCCC1)C2=CC=CC=C2 Z1198147620 [0,0,0,0,0,0|1,0,0]=1 5 B14R2.2974 OCC1(CCCN1)C2=CC=CC=C2 Z1262607421 [0,0,0,0,0,0|2,0,0]=2 6 B14R2.2974 OCC1(CCNC1)C2=CC=CC=C2 Z1262586759 [0,0,0,0,0,0|2,0,0]=2 7 B13R2.223 CC1(CCNC1)C2=CC=CC=C2 Z979421388 [1,0,0,0,0,0|1,0,0]=2 8 B13R2.223 FC1(CCNC1)C2=CC=CC=C2 Z2009833144 [1,0,0,0,0,0|2,0,0]=3 9 B13R2.223 NC1(CCCC1)C2=CC=CC=C2 Z381654396 [1,0,0,0,0,0|0,0,0]=1 10 B13R2.223 NC1(CCNC1)C2=CC=CC=C2 Z2967366647 [1,0,0,0,0,0|1,0,0]=2 11 B13R2.223 NC1(CCOC1)C2=CC=CC=C2 Z3323267062 [1,0,0,0,0,0|1,0,0]=2 12 B13R2.223 NC1(CCOC1)C2=NC=CC=N2 Z3179195179 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.223 OC1(CCCC1)C2=CC=CC=C2 Z449370860 [1,0,0,0,0,0|1,0,0]=2 14 B13R2.223 OC1(CCNC1)C2=CC=CC=C2 Z3864242940 [1,0,0,0,0,0|2,0,0]=3 15 B15R2.4125 N#CC1(CCCC1)C2=NC=C(C=C2)Br Z2065825018 [0,1,0,0,0,0|1,0,2]=4 16 B15R2.4125 NCC1(CCCC1)C2=CC=C(C=C2)Br Z361883814 [0,1,0,0,0,0|0,0,0]=1 17 B15R2.4125 NCC1(CCCC1)C2=CC=C(C=C2)Cl Z361883826 [0,1,0,0,0,0|0,0,0]=1 18 B15R2.4125 NCC1(CCCC1)C2=CC=C(C=C2)F Z361884276 [0,1,0,0,0,0|0,0,0]=1 19 B15R2.4125 O=CC1(CCOC1)C2=CC=C(C=C2)Br Z3073573944 [0,1,0,0,0,0|2,0,1]=4 20 B15R2.4134 CC1=CC(=CC=C1)C2(CCCC2)C=O Z1251361345 [0,1,0,0,0,0|1,0,1]=3 21 B15R2.4134 CC1=CC(=CC=C1)C2(CCCC2)CN Z390130836 [0,1,0,0,0,0|0,0,0]=1 22 B15R2.4134 NCC1(CCCC1)C2=CC(=CC=C2)Br Z390130886 [0,1,0,0,0,0|0,0,0]=1 23 B15R2.4134 NCC1(CCCC1)C2=CC(=CC=C2)Cl Z361883778 [0,1,0,0,0,0|0,0,0]=1 24 B15R2.5167 NCC1(CCC(=O)N1)C2=CC=CC=C2 Z1837330830 [0,1,0,0,0,0|1,0,1]=3 25 B15R2.5167 O=C1CC(CN1)(CO)C2=CC=CC=C2 Z2235386865 [0,1,0,0,0,0|2,0,1]=4 26 B15R2.6812 NCCC1(CCCC1)C2=CC=CC=C2 Z4957235024 [0,1,0,0,0,0|0,0,0]=1 27 B15R2.16122 CC(=O)C1(CCCC1)C2=CC=CC=C2 Z1082545842 [0,1,0,0,0,0|1,0,1]=3 28 B15R2.16122 CC(N)C1(CCCC1)C2=CC=CC=C2 Z1742055064 [0,1,0,0,0,0|0,0,0]=1 29 B15R2.16122 CC(O)C1(CCCC1)C2=CC=CC=C2 Z1082546486 [0,1,0,0,0,0|1,0,0]=2 30 B15R2.16122 NC(=O)C1(CCNC1)C2=CC=CC=C2 Z2301583532 [0,1,0,0,0,0|1,0,1]=3 31 B15R2.16122 O=C(O)C1(CCCC1)C2=CC=CC=C2 Z104484856 [0,1,0,0,0,0|1,0,1]=3 32 B15R2.16122 O=C(O)C1(CCCC1)C2=CN=CC=C2 Z2111525185 [0,1,0,0,0,0|2,0,1]=4 33 B15R2.16122 O=C(O)C1(CCCN1)C2=CC=CC=C2 Z3024698206 [0,1,0,0,0,0|2,0,1]=4 34 B15R2.16122 O=C(O)C1(CCNC1)C2=CC=CC=C2 Z1618102110 [0,1,0,0,0,0|2,0,1]=4 35 B15R2.26648 N#CC1(CCCC1)C2=C(C=CC=C2)F Z825741154 [0,1,0,0,0,0|0,0,2]=3 36 B13R1.26 CCC(OCCO)C1=CC=CC=C1 Z1896226330 [0,0,1,0,0,0|3,0,0]=4 37 B13R1.26 CCCCN(N=O)C1=CC=CC=C1 Z4882196363 [0,0,1,0,0,0|3,0,0]=4 38 B13R1.26 CCCNC(CC)C1=CC=CC=C1 Z316257194 [0,0,1,0,0,0|2,0,0]=3 39 B13R1.26 CCNCC(CC)C1=CC=CC=C1 Z163644928 [0,0,1,0,0,0|2,0,0]=3 40 B13R1.402 COCC(N)(CO)C1=CC=CC=C1 Z3214799413 [0,0,1,0,0,0|3,0,0]=4 41 B13R1.412 CCC(CC)(CN)C1=CC=CC=C1 Z725146502 [0,0,1,0,0,0|0,0,0]=1 42 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CC2 Z979421326 [0,0,0,1,0,0|2,0,0]=3 43 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CN2 Z2143576554 [0,0,0,1,0,0|1,0,0]=2 44 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)OC2 Z1079104234 [0,0,0,1,0,0|3,0,0]=4 45 B13R2.2370 NCC1(CCCC1)C2=CC=CS2 Z336081050 [0,0,0,0,1,0|1,0,0]=2 46 B13R2.2539 CNC1(CCC1)C2=CC=CC=C2 Z5336514980 [0,0,0,0,1,0|2,0,0]=3 47 B13R2.2539 COC1(CNC1)C2=CC=CC=C2 Z1992316405 [0,0,0,0,1,0|3,0,0]=4 48 B13R2.2539 N#CC1(CCC1)C2=CC=CC=C2 Z361882924 [0,0,0,0,1,0|0,0,2]=3 49 B13R2.2539 N#CC1(CCC1)C2=NC=CC=C2 Z1255444832 [0,0,0,0,1,0|1,0,2]=4 50 B13R2.2539 NCC1(CCC1)C2=CC=CC=C2 Z212171864 [0,0,0,0,1,0|0,0,0]=1 51 B13R2.2539 O=CC1(CCC1)C2=CC=CC=C2 Z1216846429 [0,0,0,0,1,0|1,0,1]=3 52 B13R2.2539 OCC1(CNC1)C2=CC=CC=C2 Z2301684355 [0,0,0,0,1,0|2,0,0]=3 53 B15R2.4135 CCC1(CCCN1)CC2=CC=CC=C2 Z2509379140 [0,0,0,0,0,1|2,0,0]=3 54 B15R2.4135 NCC1(CCCC1)SC2=CC=CC=C2 Z1162905472 [0,0,0,0,0,1|0,0,0]=1 55 B15R2.4135 O=CC1(CCOC1)CC2=CC=CC=C2 Z2301250737 [0,0,0,0,0,1|2,0,1]=4 56 B15R2.4980 CCC1(CNCCO1)C2=CC=CC=C2 Z5262256070 [0,0,0,0,0,1|2,0,0]=3 57 B15R2.4980 CNC1(CCNCC1)C2=CC=CC=C2 Z2050688372 [0,0,0,0,0,1|2,0,0]=3 58 B15R2.4980 CNC1(CCOCC1)C2=CC=CC=C2 Z5344106458 [0,0,0,0,0,1|2,0,0]=3 59 B15R2.4980 N#CC1(CCCNC1)C2=NC=CC=C2 Z2379964906 [0,0,0,0,0,1|1,0,2]=4 60 B15R2.4980 N#CC1(CCNCC1)C2=CC=CC=C2 Z1954805193 [0,0,0,0,0,1|0,0,2]=3 61 B15R2.4980 N#CC1(CCNCC1)C2=NC=CC=C2 Z1255426527 [0,0,0,0,0,1|1,0,2]=4 62 B15R2.4980 N#CC1(CCOCC1)C2=CC=CC=C2 Z361882916 [0,0,0,0,0,1|0,0,2]=3 63 B15R2.4980 N#CC1(CCOCC1)C2=NC=CC=C2 Z1255452224 [0,0,0,0,0,1|1,0,2]=4 64 B15R2.4980 NCC1(CCCCC1)C2=CC=CC=C2 Z332384248 [0,0,0,0,0,1|0,0,0]=1 65 B15R2.4980 NCC1(CCOCC1)C2=CC=CC=C2 Z361883808 [0,0,0,0,0,1|0,0,0]=1 66 B15R2.4980 NCC1(CCOCC1)C2=NC=CC=C2 Z3337471631 [0,0,0,0,0,1|1,0,0]=2 67 B15R2.4980 NCC1(COCCO1)C2=CC=CC=C2 Z3059114029 [0,0,0,0,0,1|1,0,0]=2 68 B15R2.4980 OCC1(CCCNC1)C2=CC=CC=C2 Z2696738945 [0,0,0,0,0,1|1,0,0]=2 69 B15R2.4980 OCC1(CCNCC1)C2=CC=CC=C2 Z1262562693 [0,0,0,0,0,1|1,0,0]=2 70 B15R2.4980 OCC1(CCOCC1)C2=CC=CC=C2 Z1251413950 [0,0,0,0,0,1|1,0,0]=2 71 B12R1.3 CCCC(C=O)C1=CC=CC=C1 Z1251357295 [1,0,1,0,0,0|1,0,1]=4 72 B12R1.3 CCNC(CC)C1=CC=CC=C1 Z316386730 [1,0,1,0,0,0|2,0,0]=4 73 B12R1.3 NCC(CCO)C1=CC=CC=C1 Z1198177199 [1,0,1,0,0,0|1,0,0]=3 74 B12R1.30 C=CCCC(N)C1=CC=CC=C1 Z1219748388 [1,0,1,0,0,0|0,0,2]=4 75 B12R1.30 CCCCC(O)C1=CC=CC=C1 Z445987132 [1,0,1,0,0,0|1,0,0]=3 76 B12R1.30 CCCC[C@@H](N)C1=CC=CC=C1 Z1642061107 [1,0,1,0,0,0|0,0,0]=2 77 B12R1.30 CCCC[C@@H](O)C1=CC=CC=C1 Z1127664488 [1,0,1,0,0,0|1,0,0]=3 78 B12R1.30 CCCC[C@H](N)C1=CC=CC=C1 Z1649893428 [1,0,1,0,0,0|0,0,0]=2 79 B12R1.30 CCCC[C@H](O)C1=CC=CC=C1 Z1127664374 [1,0,1,0,0,0|1,0,0]=3 80 B12R1.30 CCCNC(C)C1=CC=CC=C1 Z57397067 [1,0,1,0,0,0|1,0,0]=3 81 B12R1.30 CCNCC(N)C1=CC=CC=C1 Z756920572 [1,0,1,0,0,0|1,0,0]=3 82 B12R1.30 CN(CCCO)C1=CC=CC=C1 Z104585644 [1,0,1,0,0,0|2,0,0]=4 83 B12R1.30 CNCCN(C)C1=CC=CC=C1 Z335286914 [1,0,1,0,0,0|2,0,0]=4 84 B12R1.30 COCCC(N)C1=CN=CC=C1 Z2768512544 [1,0,1,0,0,0|2,0,0]=4 85 B12R1.30 COCCC(O)C1=CC=CC=C1 Z818738046 [1,0,1,0,0,0|2,0,0]=4 86 B12R1.30 C[C@H](NCCO)C1=CC=CC=C1 Z1079131628 [1,0,1,0,0,0|2,0,0]=4 87 B12R1.30 N#CCCC(N)C1=CC=CC=C1 Z1492796961 [1,0,1,0,0,0|1,0,1]=4 88 B12R1.30 NC(CCCO)C1=CC=CC=C1 Z1245735325 [1,0,1,0,0,0|1,0,0]=3 89 B12R1.39 CC(C)(CCN)C1=CC=CC=C1 Z336081086 [1,0,1,0,0,0|1,0,0]=3 90 B12R1.39 CC(C)(CCO)C1=CC=CC=C1 Z1255440195 [1,0,1,0,0,0|1,0,0]=3 91 B12R1.39 CC(O)(CCN)C1=CC=CC=C1 Z1182310345 [1,0,1,0,0,0|2,0,0]=4 92 B12R1.39 CCNC(C)(C)C1=CC=CC=C1 Z991114618 [1,0,1,0,0,0|1,0,0]=3 93 B12R1.39 COCC(C)(N)C1=CC=CC=C1 Z992444342 [1,0,1,0,0,0|1,0,0]=3 94 B12R1.39 COCC(C)(O)C1=CC=CC=C1 Z992444182 [1,0,1,0,0,0|2,0,0]=4 95 B12R1.475 CC(CN)(CO)C1=CC=CC=C1 Z4522214749 [1,0,1,0,0,0|1,0,0]=3 96 B12R2.2 C1=CC(=CC=N1)C2CCCN2 Z238920298 [2,0,0,0,0,0|2,0,0]=4 97 B12R2.2 C1=CC(=CC=N1)C2CCNC2 Z2492414323 [2,0,0,0,0,0|2,0,0]=4 98 B12R2.2 C1=CC(=CN=C1)C2CCCN2 Z164706372 [2,0,0,0,0,0|2,0,0]=4 99 B12R2.2 C1=CC=C(C=C1)C2=NCCC2 Z235344923 [2,0,0,0,0,0|1,0,1]=4 100 B12R2.2 C1=CC=C(C=C1)C2CCCN2 Z223138744 [2,0,0,0,0,0|1,0,0]=3 101 B12R2.2 C1=CC=C(C=C1)C2CCNC2 Z926900322 [2,0,0,0,0,0|1,0,0]=3 102 B12R2.2 C1=CN=C(C=C1)C2CCNC2 Z940902744 [2,0,0,0,0,0|2,0,0]=4 103 B12R2.2 C1=CN=C(C=C1)N2CCCC2 Z31197339 [2,0,0,0,0,0|2,0,0]=4 104 B14R1.121 CCCCNC(CC)C1=CC=CC=C1 Z334909176 [0,1,1,0,0,0|1,0,0]=3 105 B14R1.540 CCC(NCC(C)C)C1=CC=CC=C1 Z1171716845 [0,1,1,0,0,0|2,0,0]=4 106 B14R1.537 CCC(CC)(CN)C1=CC=C(C=C1)Cl Z725146514 [0,1,1,0,0,0|0,0,0]=2 107 B14R1.6939 CCC(CC)(C(=O)O)C1=CC=CC=C1 Z336127810 [0,1,1,0,0,0|1,0,1]=4 108 B14R2.317 CC1(CCNC1=O)C2=CC=CC=C2 Z1509156364 [1,1,0,0,0,0|1,0,1]=4 109 B14R2.2950 CC1(CNC(=O)C1)C2=CC=CC=C2 Z1263715001 [1,1,0,0,0,0|1,0,1]=4 110 B14R2.4398 CC1(CCNC1)C2=CC=C(C=C2)Cl Z3302946329 [1,1,0,0,0,0|1,0,0]=3 111 B14R2.4398 CC1=CC=C(C=C1)C2(CCNC2)C Z979421390 [1,1,0,0,0,0|1,0,0]=3 112 B14R2.4398 CC1=CC=C(C=C1)C2(CCNC2)O Z1696844436 [1,1,0,0,0,0|2,0,0]=4 113 B14R2.4398 NC1(CCCC1)C2=CC=C(C=C2)Br Z449369212 [1,1,0,0,0,0|0,0,0]=2 114 B14R2.4398 NC1(CCCC1)C2=CC=C(C=C2)Cl Z992717200 [1,1,0,0,0,0|0,0,0]=2 115 B14R2.4398 NC1(CCCC1)C2=CC=C(C=C2)F Z1259341018 [1,1,0,0,0,0|0,0,0]=2 116 B14R2.4398 OC1(CCNC1)C2=CC=C(C=C2)Br Z2313546921 [1,1,0,0,0,0|2,0,0]=4 117 B14R2.4471 CC1(CCCN1)C2=CC(=CC=C2)F Z2733369712 [1,1,0,0,0,0|1,0,0]=3 118 B14R2.4471 CC1=CC(=CC=C1)C2(CCCC2)N Z390131054 [1,1,0,0,0,0|0,0,0]=2 119 B14R2.4471 FC1(CCNC1)C2=CC(=CC=C2)Cl Z2009833087 [1,1,0,0,0,0|2,0,0]=4 120 B14R2.4471 NC1(CCCC1)C2=CC(=CC=C2)Cl Z381654320 [1,1,0,0,0,0|0,0,0]=2 121 B14R2.4471 NC1(CCCC1)C2=NC(=O)C=CN2 Z1270443608 [1,1,0,0,0,0|2,0,0]=4 122 B14R2.4471 OC1(CCCC1)C2=CC(=CC=C2)Cl Z872052596 [1,1,0,0,0,0|1,0,0]=3 123 B14R2.5439 NC1(CCCC1)C2=C(C=CC=C2)F Z2768212901 [1,1,0,0,0,0|0,0,0]=2 124 B14R2.5439 OC1(CCNC1)C2=C(C=CC=C2)Br Z4167749709 [1,1,0,0,0,0|2,0,0]=4 125 B14R2.5439 OC1(CCNC1)C2=C(C=CC=C2)F Z3247780784 [1,1,0,0,0,0|2,0,0]=4 126 B14R2.157 NCC1(CCC1)C2=CC=C(C=C2)Br Z361883816 [0,1,0,0,1,0|0,0,0]=2 127 B14R2.157 NCC1(CCC1)C2=CC=C(C=C2)Cl Z361883828 [0,1,0,0,1,0|0,0,0]=2 128 B14R2.157 NCC1(CCC1)C2=CC=C(C=C2)F Z361884278 [0,1,0,0,1,0|0,0,0]=2 129 B14R2.2971 COC1(CCC1)C2=CC(=CC=C2)N Z2732542319 [0,1,0,0,1,0|2,0,0]=4 130 B14R2.2971 NCC1(CCC1)C2=CC(=CC=C2)Br Z390130892 [0,1,0,0,1,0|0,0,0]=2 131 B14R2.2971 NCC1(CCC1)C2=CC(=NC=C2)O Z5890398145 [0,1,0,0,1,0|1,0,0]=3 132 B14R2.2971 NCC1(CCC1)C2=CC(=O)C=CN2 Z5567333069 [0,1,0,0,1,0|1,0,0]=3 133 B14R2.2971 NCC1(CCC1)C2=NC(=CC=C2)O Z4775372665 [0,1,0,0,1,0|1,0,0]=3 134 B14R2.3449 NCC1(CC(=O)C1)C2=CC=CC=C2 Z1696861483 [0,1,0,0,1,0|0,0,1]=3 135 B14R2.3449 O=C[C@@]1(C[C@H](C1)F)C2=CC=CC=C2 Z2943579800 [0,1,0,0,1,0|1,0,1]=4 136 B14R2.9538 CC(C)C1(CNC1)C2=CC=CC=C2 Z2327225916 [0,1,0,0,1,0|2,0,0]=4 137 B14R2.9538 CC(N)C1(CCC1)C2=CC=CC=C2 Z3006441493 [0,1,0,0,1,0|0,0,0]=2 138 B14R2.9538 O=C(O)C1(CCC1)C2=CC=CC=C2 Z111414052 [0,1,0,0,1,0|1,0,1]=4 139 B14R2.9726 COCC1(CNC1)C2=CC=CC=C2 Z2299684703 [0,1,0,0,1,0|2,0,0]=4 140 B14R2.14357 NCC1(CCC1)C2=C(C=CC=C2)Br Z2197092678 [0,1,0,0,1,0|0,0,0]=2 141 B14R2.14357 NCC1(CCC1)C2=C(C=CC=C2)Cl Z858031308 [0,1,0,0,1,0|0,0,0]=2 142 B16R2.6077 CC1=CC=C(C=C1)SC2(CCCC2)CN Z1270211298 [0,1,0,0,0,1|0,0,0]=2 143 B16R2.27140 NC(=O)C1(CCCC1)SC2=CC=CC=C2 Z1220054897 [0,1,0,0,0,1|0,0,1]=3 144 B16R2.27140 O=C(O)C1(CCCC1)SC2=CC=CC=C2 Z803531388 [0,1,0,0,0,1|1,0,1]=4 145 B16R2.6076 CC1=CC=C(C=C1)C2(CCOCC2)C#N Z390130284 [0,1,0,0,0,1|0,0,2]=4 146 B16R2.6076 CC1=CC=C(C=C1)C2(CCOCC2)CN Z1266854945 [0,1,0,0,0,1|0,0,0]=2 147 B16R2.6076 CCC1(CCNCC1)C2=CC=C(C=C2)Cl Z1945984068 [0,1,0,0,0,1|1,0,0]=3 148 B16R2.6076 N#CC1(CCCCC1)C2=CC=C(C=C2)Br Z361882980 [0,1,0,0,0,1|0,0,2]=4 149 B16R2.6076 N#CC1(CCCCC1)C2=CC=C(C=C2)F Z361884256 [0,1,0,0,0,1|0,0,2]=4 150 B16R2.6076 N#CC1(CCOCC1)C2=CC=C(C=C2)Br Z361882976 [0,1,0,0,0,1|0,0,2]=4 151 B16R2.6076 NCC1(CCCCC1)C2=CC=C(C=C2)Br Z361883824 [0,1,0,0,0,1|0,0,0]=2 152 B16R2.6076 NCC1(CCCCC1)C2=CC=C(C=C2)Cl Z361883836 [0,1,0,0,0,1|0,0,0]=2 153 B16R2.6076 NCC1(CCCCC1)C2=CC=C(C=C2)F Z361884286 [0,1,0,0,0,1|0,0,0]=2 154 B16R2.6076 NCC1(CCOCC1)C2=CC=C(C=C2)Br Z361883820 [0,1,0,0,0,1|0,0,0]=2 155 B16R2.6076 NCC1(CCOCC1)C2=CC=C(C=C2)Cl Z815264082 [0,1,0,0,0,1|0,0,0]=2 156 B16R2.6076 NCC1(CCOCC1)C2=CC=C(C=C2)F Z361884282 [0,1,0,0,0,1|0,0,0]=2 157 B16R2.7941 CC1=CC(=CC=C1)C2(CCCCC2)CN Z390130858 [0,1,0,0,0,1|0,0,0]=2 158 B16R2.7941 N#CC1(CCCCC1)C2=CC=CC(=C2)Cl Z361882956 [0,1,0,0,0,1|0,0,2]=4 159 B16R2.7941 N#CC1(CCOCC1)C2=CC=CC(=C2)Br Z390130314 [0,1,0,0,0,1|0,0,2]=4 160 B16R2.7941 NCC1(CCCCC1)C2=CC(=CC=C2)Br Z390130908 [0,1,0,0,0,1|0,0,0]=2 161 B16R2.7941 NCC1(CCCCC1)C2=CC(=CC=C2)Cl Z2235790651 [0,1,0,0,0,1|0,0,0]=2 162 B16R2.7941 NCC1(CCCCC1)C2=CC(=CC=C2)F Z361883920 [0,1,0,0,0,1|0,0,0]=2 163 B16R2.7941 NCC1(CCOCC1)C2=CC(=CC=C2)Br Z600428464 [0,1,0,0,0,1|0,0,0]=2 164 B16R2.7941 NCC1(CCOCC1)C2=CC(=CC=C2)Cl Z361883784 [0,1,0,0,0,1|0,0,0]=2 165 B16R2.27540 CC(O)C1(CCCCC1)C2=CC=CC=C2 Z1082546850 [0,1,0,0,0,1|1,0,0]=3 166 B16R2.27540 N=C(N)C1(CCOCC1)C2=CC=CC=C2 Z2940572261 [0,1,0,0,0,1|0,0,1]=3 167 B16R2.27540 O=C(O)C1(CCNCC1)C2=CC=CC=C2 Z248485684 [0,1,0,0,0,1|1,0,1]=4 168 B16R2.27540 O=C(O)C1(CCOCC1)C2=CC=CC=C2 Z361883550 [0,1,0,0,0,1|1,0,1]=4 169 B16R2.46345 N#CC1(CCC(=O)CC1)C2=CC=CC=C2 Z104486458 [0,1,0,0,0,1|0,0,2]=4 170 B16R2.46345 O=C1CCC(CN1)(CO)C2=CC=CC=C2 Z2235814827 [0,1,0,0,0,1|1,0,1]=4 171 B16R2.47566 NCC1(CCCC(=O)N1)C2=CC=CC=C2 Z4765092648 [0,1,0,0,0,1|0,0,1]=3 172 B16R2.59469 CC1=C(C=CC=C1)C2(CCCCC2)CN Z361883776 [0,1,0,0,0,1|0,0,0]=2 173 B16R2.59469 CC1=C(C=CC=C1)C2(CCOCC2)CN Z361883772 [0,1,0,0,0,1|0,0,0]=2 174 B16R2.59469 N#CC1(CCCCC1)C2=C(C=CC=C2)Cl Z858030346 [0,1,0,0,0,1|0,0,2]=4 175 B16R2.59469 NCC1(CCCCC1)C2=C(C=CC=C2)Br Z2235681462 [0,1,0,0,0,1|0,0,0]=2 176 B16R2.59469 NCC1(CCOCC1)C2=C(C=CC=C2)Cl Z1263820353 [0,1,0,0,0,1|0,0,0]=2 177 B16R2.47517 CC1=CC(=C(C=C1)C2(CCCC2)CN)C Z1509427796 [0,2,0,0,0,0|0,0,0]=2 178 B16R2.47517 N#CC1(CCCC1)C2=C(C=C(C=C2)F)F Z1238481034 [0,2,0,0,0,0|0,0,2]=4 179 B16R2.167673 NC(=O)C1(CCCC1)C2=CC=C(C=C2)Br Z287485122 [0,2,0,0,0,0|0,0,1]=3 180 B16R2.167673 NC(=O)C1(CCCC1)C2=CC=C(C=C2)Cl Z68590269 [0,2,0,0,0,0|0,0,1]=3 181 B16R2.167673 NC(=O)C1(CCCC1)C2=CC=C(C=C2)F Z287483888 [0,2,0,0,0,0|0,0,1]=3 182 B16R2.167673 O=C(O)C1(CCCC1)C2=CC=C(C=C2)Br Z223659226 [0,2,0,0,0,0|1,0,1]=4 183 B16R2.167673 O=C(O)C1(CCCC1)C2=CC=C(C=C2)Cl Z104479236 [0,2,0,0,0,0|1,0,1]=4 184 B16R2.167673 O=C(O)C1(CCCC1)C2=CC=C(C=C2)F Z104503834 [0,2,0,0,0,0|1,0,1]=4 185 B16R2.47520 N#CC1(CCCC1)C2=C(C=CC(=C2)Cl)Cl Z1509606541 [0,2,0,0,0,0|0,0,2]=4 186 B16R2.47530 N#CC1(CCCC1)C2=CC=CC(=C2F)F Z1509728423 [0,2,0,0,0,0|0,0,2]=4 187 B16R2.47530 NCC1(CCCC1)C2=C(C(=CC=C2)Cl)F Z1837073490 [0,2,0,0,0,0|0,0,0]=2 188 B16R2.47530 NCC1(CCCC1)C2=C(C(=CC=C2)F)F Z1860991832 [0,2,0,0,0,0|0,0,0]=2 189 B16R2.56582 COC1=CC(=CC=C1)C2(CCCC2)CN Z801752004 [0,2,0,0,0,0|0,0,0]=2 190 B16R2.80695 CC1=CC(=CC=C1)C2(CCCC2)C(=O)N Z1030080890 [0,2,0,0,0,0|0,0,1]=3 191 B16R2.80695 CC1=CC(=CC=C1)C2(CCCC2)C(=O)O Z364000160 [0,2,0,0,0,0|1,0,1]=4 192 B16R2.80695 NC(=O)C1(CCCC1)C2=CC(=CC=C2)Br Z319647972 [0,2,0,0,0,0|0,0,1]=3 193 B16R2.80695 NC(=O)C1(CCCC1)C2=CC(=CC=C2)F Z68591829 [0,2,0,0,0,0|0,0,1]=3 194 B16R2.80695 O=C(O)C1(CCCC1)C2=CC(=CC=C2)Cl Z361883520 [0,2,0,0,0,0|1,0,1]=4 195 B16R2.80695 O=C(O)C1(CCCC1)C2=CC(=CC=C2)F Z104505412 [0,2,0,0,0,0|1,0,1]=4 196 B16R2.27689 CC(=O)NC1(CCCC1)C2=CC=CC=C2 Z1198550369 [0,2,0,0,0,0|1,0,1]=4 197 B16R2.27689 O=C(O)CC1(CCCC1)C2=CC=CC=C2 Z1508923605 [0,2,0,0,0,0|1,0,0]=3 198 B16R2.27689 O=C(O)CC1(CCCO1)C2=CC=CC=C2 Z4454271902 [0,2,0,0,0,0|2,0,0]=4 199 B16R2.52085 FC(F)(F)C1(CCCN1)C2=CC=CC=C2 Z1171220821 [0,2,0,0,0,0|2,0,0]=4 200 B16R2.52085 FC(F)(F)C1(CCNC1)C2=CC=CC=C2 Z4427906554 [0,2,0,0,0,0|2,0,0]=4 201 B16R2.84013 CC1=C(C=CC=C1)C2(CCCC2)C(=O)O Z361883508 [0,2,0,0,0,0|1,0,1]=4 202 B16R2.84013 NC(=O)C1(CCCC1)C2=C(C=CC=C2)F Z68591869 [0,2,0,0,0,0|0,0,1]=3 203 B16R2.84013 O=C(O)C1(CCCC1)C2=C(C=CC=C2)F Z104495528 [0,2,0,0,0,0|1,0,1]=4 204 B16R2.59282 COC1=C(C=CC=C1)C2(CCCC2)CN Z361883898 [0,2,0,0,0,0|0,0,0]=2 205 B16R2.233585 N#CC1(CCCC1)C2=C(C=CC=C2F)F Z1509553584 [0,2,0,0,0,0|0,0,2]=4 206 B14R2.3 CCCNC1CCC2=C1C=CC=C2 Z316257262 [0,0,1,1,0,0|2,0,0]=4 207 B14R2.8 NCC1CCC(C1)C2=CC=CC=C2 Z2216314446 [0,0,1,1,0,0|2,0,0]=4 208 B14R2.8 OC[C@@H]1CC[C@H](C1)C2=CC=CC=C2 Z2262019790 [0,0,1,1,0,0|2,0,0]=4 209 B14R2.24 CC1CCNCC1C2=CC=CC=C2 Z2803578072 [0,0,1,1,0,0|2,0,0]=4 210 B14R2.24 CC1CNCCC1C2=CC=CC=C2 Z1259303197 [0,0,1,1,0,0|2,0,0]=4 211 B14R2.24 C[C@@H]1CCNC[C@@H]1C2=CC=CC=C2 Z2831446470 [0,0,1,1,0,0|2,0,0]=4 212 B14R2.24 F[C@@H]1CNCC[C@H]1C2=CC=CC=C2 Z5551895336 [0,0,1,1,0,0|2,0,0]=4 213 B14R2.24 NC1CCNCC1C2=CC=CC=C2 Z4510822484 [0,0,1,1,0,0|1,0,0]=3 214 B14R2.24 N[C@@H]1COCC[C@@H]1C2=CC=CC=C2 Z4463176366 [0,0,1,1,0,0|1,0,0]=3 215 B14R2.24 O=C1CCCCC1C2=CC=CC=C2 Z104507604 [0,0,1,1,0,0|1,0,1]=4 216 B14R2.24 O[C@@H]1CCCC[C@H]1C2=CN=CC=C2 Z1898596794 [0,0,1,1,0,0|2,0,0]=4 217 B14R2.24 O[C@@H]1CNCC[C@@H]1C2=CC=CC=C2 Z5178963486 [0,0,1,1,0,0|2,0,0]=4 218 B14R2.24 O[C@@H]1CNCC[C@H]1C2=CC=CC=C2 Z2568756561 [0,0,1,1,0,0|2,0,0]=4 219 B14R2.24 O[C@H]1CCCC[C@H]1C2=CN=CC=C2 Z1945984021 [0,0,1,1,0,0|2,0,0]=4 220 B14R2.68 BrC1CCC(CC1)C2=CC=CC=C2 Z381393018 [0,0,1,1,0,0|2,0,0]=4 221 B14R2.68 CC1CCC(CC1)C2=CC=CC=C2 Z1416193181 [0,0,1,1,0,0|1,0,0]=3 222 B14R2.68 CC1CCC(NC1)C2=CC=CC=C2 Z1230089920 [0,0,1,1,0,0|2,0,0]=4 223 B14R2.68 CC1CNC(CO1)C2=CC=CC=C2 Z1097086347 [0,0,1,1,0,0|2,0,0]=4 224 B14R2.68 C[C@@H]1CO[C@H](CN1)C2=CC=CC=C2 Z3190001661 [0,0,1,1,0,0|1,0,0]=3 225 B14R2.68 NC1CCC(CC1)C2=CC=CC=C2 Z239626662 [0,0,1,1,0,0|2,0,0]=4 226 B14R2.68 OC1CCC(CC1)C2=CC=CC=C2 Z335244834 [0,0,1,1,0,0|2,0,0]=4 227 B14R2.1131 CN1CCC(C2=C1C=CC=C2)CN Z440640608 [0,0,1,1,0,0|1,0,0]=3 228 B14R2.1253 C1=CC=C(C=C1)C2CCCCCN2 Z1258578207 [0,0,1,1,0,0|2,0,0]=4 229 B14R2.1253 C1=CC=C(C=C1)C2CCCCNC2 Z2310707785 [0,0,1,1,0,0|0,0,0]=2 230 B14R2.1253 C1=CC=C(C=C1)C2CCCNCC2 Z425362306 [0,0,1,1,0,0|2,0,0]=4 231 B14R2.1253 C1=CC=C(C=C1)C2CNCCCO2 Z425722882 [0,0,1,1,0,0|1,0,0]=3 232 B14R2.2014 NCC1CCCCC2=C1C=CC=C2 Z5341486855 [0,0,1,1,0,0|0,0,0]=2 233 B14R2.2014 O=CC1CCCCC2=C1C=CC=C2 Z1268606307 [0,0,1,1,0,0|1,0,1]=4 234 B14R2.2850 NCC(C1=CC=CC=C1)C2CCC2 Z4868599254 [0,0,1,1,0,0|0,0,0]=2 235 B14R2.2850 O=CC(C1=CC=CC=C1)C2CCC2 Z1255403723 [0,0,1,1,0,0|1,0,1]=4 236 B14R2.3459 CC1(CCCC2=C1C=CC=C2)C=O Z1511786768 [0,0,1,1,0,0|1,0,1]=4 237 B14R2.3459 CC1(CCOC2=C1C=CC=C2)CN Z4927160563 [0,0,1,1,0,0|1,0,0]=3 238 B14R2.5540 CC1(CCCNC1)C2=CC=CC=C2 Z1190324159 [0,0,1,1,0,0|0,0,0]=2 239 B14R2.5540 CC1(CCNCC1)C2=CC=CC=C2 Z1095369049 [0,0,1,1,0,0|2,0,0]=4 240 B14R2.5540 CC1(CNCCO1)C2=CC=CC=C2 Z979724158 [0,0,1,1,0,0|1,0,0]=3 241 B14R2.5540 NC1(CCCOC1)C2=CC=CC=C2 Z4009961546 [0,0,1,1,0,0|2,0,0]=4 242 B14R2.5540 OC1(CCCNC1)C2=CC=CC=C2 Z2679906833 [0,0,1,1,0,0|1,0,0]=3 243 B14R2.16831 CCC1(CNC2=C1C=CC=C2)CC Z1210585575 [0,0,1,1,0,0|0,0,0]=2 244 B14R2.16831 CNC1(CCC2=C1C=CC=C2)CO Z734147158 [0,0,1,1,0,0|2,0,0]=4 245 B14R3.2935 C1=CC=C(C=C1)C23CC(C2)CN3 Z2587666026 [1,0,0,1,0,0|1,0,0]=3 246 B14R3.2936 C1=CC=C(C=C1)C23CNCC2C3 Z2803719278 [1,0,0,1,0,0|1,0,0]=3 247 B14R3.2936 C1=CC=C(C=C1)[C@]23CNC[C@H]2C3 Z2568758552 [1,0,0,1,0,0|1,0,0]=3 248 B14R3.2936 C1=CN=C(C=C1)[C@]23CNC[C@H]2C3 Z4322364112 [1,0,0,1,0,0|2,0,0]=4 249 B14R3.3059 C1=CC2=C(C=C1)C3(CCC3)CN2 Z1836338847 [0,0,0,1,1,0|0,0,0]=2 250 B14R3.3059 C1=CC2=C(C=N1)NCC23CCC3 Z4189741981 [0,0,0,1,1,0|1,0,0]=3 251 B14R3.3059 C1=CC2=C(N=C1)C3(CCC3)CN2 Z3669508838 [0,0,0,1,1,0|1,0,0]=3 252 B16R3.39 NC1C2=C(C=CC=C2)CC13CCCC3 Z4202573934 [0,0,0,1,0,1|0,0,0]=2 253 B16R3.5981 C1=CC=C(C=C1)C2NCC23CCCC3 Z1999526334 [0,0,0,1,0,1|0,0,0]=2 254 B16R3.748214 C1=CC2=C(C=C1)OC3(CCNC3)CC2 Z2146654429 [0,0,0,1,0,1|2,0,0]=4 255 B16R3.5983 C1=CC=C(C=C1)C23CCCCC2CN3 Z1407619616 [0,0,0,1,0,1|2,0,0]=4 256 B16R3.6449 C1=CC2=C(C=C1)C3(C=C2)CCNCC3 Z3225744136 [0,0,0,1,0,1|1,0,1]=4 257 B16R3.6449 C1=CC2=C(C=C1)C3(CC2)CNCCO3 Z1251362656 [0,0,0,1,0,1|2,0,0]=4 258 B16R3.6449 C1=CC2=C(C=C1)C3(CCCNC3)CO2 Z3687354785 [0,0,0,1,0,1|1,0,0]=3 259 B16R3.6449 C1=CC2=C(C=C1)C3(CCCNC3)OC2 Z1255386062 [0,0,0,1,0,1|2,0,0]=4 260 B16R3.6449 C1=CC2=C(C=C1)C3(CCNCC3)CC2 Z3217337471 [0,0,0,1,0,1|1,0,0]=3 261 B16R3.6449 C1=CC2=C(C=C1)C3(CCNCC3)CO2 Z3241270622 [0,0,0,1,0,1|1,0,0]=3 262 B16R3.6449 C1=CC2=C(C=C1)C3(CCOCC3)CN2 Z1255404894 [0,0,0,1,0,1|0,0,0]=2 263 B16R3.6449 C1=CC2=C(C=N1)OCC23CCNCC3 Z5100568906 [0,0,0,1,0,1|2,0,0]=4 264 B16R3.6449 C1=CC2=C(N=C1)OCC23CCNCC3 Z3484145884 [0,0,0,1,0,1|2,0,0]=4 265 B16R3.2119 BrC1=CC2=C(C=C1)C3(CCNC3)CC2 Z4714472157 [0,1,0,1,0,0|2,0,0]=4 266 B16R3.3347 ClC1=C2NCC3(C2=CC=C1)CCCC3 Z1416190754 [0,1,0,1,0,0|0,0,0]=2 267 B16R3.3347 FC1=C2NCC3(C2=CC=C1)CCCC3 Z1416190753 [0,1,0,1,0,0|0,0,0]=2 268 B16R3.444508 BrC1=CC2=C(C=C1)CCC23CCNC3 Z4618271364 [0,1,0,1,0,0|2,0,0]=4 269 B16R3.444508 BrC1=CC2=C(C=C1)NCC23CCCC3 Z1415893831 [0,1,0,1,0,0|0,0,0]=2 270 B16R3.1811 C1=CC2=C(C=C1)C3(CCC2)CCNC3 Z3241266755 [0,1,0,1,0,0|2,0,0]=4 271 B16R3.1811 C1=CC2=C(C=C1)C3(CCCC3)CNC2 Z2188171678 [0,1,0,1,0,0|0,0,0]=2 272 B16R3.180227 NC1CC2(CCCC2)C3=C1C=CC=C3 Z5039774711 [0,1,0,1,0,0|0,0,0]=2 273 B16R3.59 O=C1NC2=C(C13CCCC3)C=CC=C2 Z1210584849 [0,1,0,1,0,0|0,0,1]=3 274 B16R3.59 O=C1NC2=C(C13CCNC3)C=CC=C2 Z1742055048 [0,1,0,1,0,0|1,0,1]=4 275 B16R3.603219 FC1=C2C(=CC=C1)NCC23CCCC3 Z970077630 [0,1,0,1,0,0|0,0,0]=2 276 B12R2.116 CC1(CNC1)C2=CC=CC=C2 Z2143576561 [1,0,0,0,1,0|1,0,0]=3 277 B12R2.116 NC1(CCC1)C2=CC=NC=C2 Z1198261773 [1,0,0,0,1,0|1,0,0]=3 278 B12R2.116 NC1(CCC1)C2=CN=CC=C2 Z3655397645 [1,0,0,0,1,0|1,0,0]=3 279 B12R2.116 OC1(CCC1)C2=CC=CC=C2 Z1198315122 [1,0,0,0,1,0|1,0,0]=3 280 B12R2.121 NC1(CCCC1)C2=NC=CO2 Z5371210321 [1,0,0,0,1,0|2,0,0]=4 281 B12R2.121 NC1(CCCC1)C2=NC=CS2 Z1695797873 [1,0,0,0,1,0|2,0,0]=4 282 B12R2.2050 NCC1(CCC1)C2=NOC=C2 Z5872370586 [0,0,0,0,2,0|2,0,0]=4 283 B12R2.48 CNC1(CC1)C2=CC=CC=C2 Z3841531244 [0,0,0,0,2,0|2,0,0]=4 284 B12R2.48 NCC1(CC1)C2=CC=CC=C2 Z217306544 [0,0,0,0,2,0|0,0,0]=2 285 B12R2.48 NCC1(CC1)C2=NC=CC=C2 Z1655103509 [0,0,0,0,2,0|1,0,0]=3 286 B12R2.48 O=CC1(CC1)C2=CC=CC=C2 Z1079097808 [0,0,0,0,2,0|1,0,1]=4 287 B12R2.48 OCC1(CC1)C2=CC=CC=C2 Z1033255944 [0,0,0,0,2,0|1,0,0]=3 288 B14R1.6936 CCC(CO)(CO)CC1=CC=CC=C1 Z1322543883 [0,0,1,0,0,1|2,0,0]=4 289 B14R1.6936 CC[N+](CC)(CC)CC1=CC=CC=C1 Z56871881 [0,0,1,0,0,1|2,0,0]=4 290 B14R2.411 CC1(CCCN1)CC2=CC=CC=C2 Z1704732682 [1,0,0,0,0,1|1,0,0]=3 291 B14R2.411 NC1(CCCC1)CC2=CC=CC=C2 Z1655103589 [1,0,0,0,0,1|0,0,0]=2 292 B14R2.411 OC1(CCCC1)CC2=CC=CC=C2 Z449370862 [1,0,0,0,0,1|1,0,0]=3 293 B14R2.411 OC1(CCNC1)CC2=CC=CC=C2 Z3006329777 [1,0,0,0,0,1|2,0,0]=4 294 B14R2.3371 NCC1(CCCCC1)C2=CC=CS2 Z336080994 [0,0,0,0,1,1|1,0,0]=3 295 B14R2.3371 NCC1(CCOCC1)N2C=CC=N2 Z4885923173 [0,0,0,0,1,1|2,0,0]=4 296 B14R2.2972 NCC1(CCC1)CC2=CC=CC=C2 Z1407672948 [0,0,0,0,1,1|0,0,0]=2 297 B16R2.7942 CCC1(CCNCC1)CC2=CC=CC=C2 Z1946235609 [0,0,0,0,0,2|1,0,0]=3 298 B16R2.7942 N#CC1(CCCCC1)NC2=CC=CC=C2 Z204018286 [0,0,0,0,0,2|0,0,2]=4 299 B16R2.7942 N#CC1(CCOCC1)SC2=CC=CC=C2 Z1258790608 [0,0,0,0,0,2|0,0,2]=4 300 B16R2.7942 NCC1(CCCCC1)CC2=CC=CC=C2 Z223690280 [0,0,0,0,0,2|0,0,0]=2 301 B16R2.7942 NCC1(CCCCC1)NC2=CC=CC=C2 Z235342005 [0,0,0,0,0,2|0,0,0]=2 302 B16R2.7942 OCC1(CCCCC1)NC2=CC=CC=C2 Z5062615595 [0,0,0,0,0,2|1,0,0]=3 303 B16R2.7942 OCC1(CCNCC1)CC2=CC=CC=C2 Z1881598569 [0,0,0,0,0,2|1,0,0]=3 304 B16R2.7942 OCC1(CCNCC1)NC2=CC=CC=C2 Z778384034 [0,0,0,0,0,2|1,0,0]=3 305 B16R2.8136 NCC1(CCCCCC1)C2=CC=CC=C2 Z361883810 [0,0,0,0,0,2|0,0,0]=2