0 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [0,0,0,0,0,0|0,0,0]=0 1 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [0,0,0,0,0,0|0,0,0]=0 2 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [0,0,0,0,0,0|0,0,0]=0 3 B10R2.6 C1=CC(=CC=N1)C2CC2 Z3042074264 [1,0,0,0,0,0|1,0,0]=2 4 B10R2.6 C1=CC(=CC=N1)C2CO2 Z1187818726 [1,0,0,0,0,0|2,0,0]=3 5 B10R2.6 C1=CC(=CN=C1)C2CO2 Z1187818722 [1,0,0,0,0,0|2,0,0]=3 6 B10R2.6 C1=CC=C(C=C1)C2CO2 Z104486008 [1,0,0,0,0,0|1,0,0]=2 7 B10R2.6 C1=CC=C(C=C1)[C@@H]2CO2 Z1255356265 [1,0,0,0,0,0|1,0,0]=2 8 B10R2.6 C1=CC=C(C=C1)[C@H]2CO2 Z1255390768 [1,0,0,0,0,0|1,0,0]=2 9 B10R2.6 C1=CN=C(C=C1)C2CO2 Z1187818707 [1,0,0,0,0,0|2,0,0]=3 10 B12R2.27 CNC1CC1C2=CC=CC=C2 Z1443588579 [0,1,0,0,0,0|0,0,0]=1 11 B12R2.27 CN[C@@H]1C[C@H]1C2=CC=CC=C2 Z3024312938 [0,1,0,0,0,0|0,0,0]=1 12 B12R2.27 N#C[C@@H]1C[C@H]1C2=CC=CC=C2 Z1198147613 [0,1,0,0,0,0|0,0,1]=2 13 B12R2.27 NCC1CC1C2=CC=CC=C2 Z1276751392 [0,1,0,0,0,0|0,0,0]=1 14 B12R2.27 O=C[C@@H]1C[C@H]1C2=CC=CC=C2 Z2298064271 [0,1,0,0,0,0|1,0,0]=2 15 B12R2.27 OCC1OC1C2=CC=CC=C2 Z1509054538 [0,1,0,0,0,0|2,0,0]=3 16 B12R2.37 CC1C(C1C2=CC=CC=C2)N Z3596843396 [0,1,0,0,0,0|0,0,0]=1 17 B12R2.79 CC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2380468351 [0,1,0,0,0,0|0,0,0]=1 18 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)Cl Z3074487523 [0,1,0,0,0,0|2,0,0]=3 19 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)F Z2527567177 [0,1,0,0,0,0|2,0,0]=3 20 B12R2.79 NC1CC1C2=CC=C(C=C2)F Z1266823169 [0,1,0,0,0,0|0,0,0]=1 21 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Br Z2298098036 [0,1,0,0,0,0|0,0,0]=1 22 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2298098012 [0,1,0,0,0,0|0,0,0]=1 23 B12R2.80 C[C@@H]1O[C@H]1C2=CC(=CC=C2)Cl Z2525216417 [0,1,0,0,0,0|2,0,0]=3 24 B12R2.80 NC1CC1C2=CC(=CC=C2)Br Z1266823142 [0,1,0,0,0,0|0,0,0]=1 25 B12R2.80 N[C@@H]1C[C@H]1C2=CC(=CC=C2)Cl Z2298098009 [0,1,0,0,0,0|0,0,0]=1 26 B12R2.92 CC1(OC1C2=CC=CC=C2)C Z1486033030 [0,1,0,0,0,0|2,0,0]=3 27 B12R2.115 CC1=C(C=CC=C1)[C@@H]2C[C@H]2N Z2286637165 [0,1,0,0,0,0|0,0,0]=1 28 B12R2.115 NC1CC1C2=C(C=CC=C2)Br Z1269638533 [0,1,0,0,0,0|0,0,0]=1 29 B12R2.115 N[C@@H]1C[C@H]1C2=C(C=CC=C2)Cl Z2298098040 [0,1,0,0,0,0|0,0,0]=1 30 B12R2.235 CC1(CC1N)C2=CC=CC=C2 Z1259335890 [0,1,0,0,0,0|0,0,0]=1 31 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [0,0,1,0,0,0|0,0,2]=3 32 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [0,0,1,0,0,0|2,0,1]=4 33 B10R1.15 CC(C#N)C1=CC=NC=C1 Z415654740 [0,0,1,0,0,0|1,0,2]=4 34 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [0,0,1,0,0,0|1,0,1]=3 35 B10R1.15 CC(CBr)C1=CC=CC=C1 Z756118300 [0,0,1,0,0,0|1,0,0]=2 36 B10R1.15 CC(CN)C1=CC=NC=C1 Z415654978 [0,0,1,0,0,0|1,0,0]=2 37 B10R1.15 CCC(=O)C1=CC=CC=C1 Z104473068 [0,0,1,0,0,0|2,0,1]=4 38 B10R1.15 CCC(N)C1=CC=CC=C1 Z1262252904 [0,0,1,0,0,0|2,0,0]=3 39 B10R1.15 CCC(N)C1=CC=NC=C1 Z228583312 [0,0,1,0,0,0|3,0,0]=4 40 B10R1.15 CCC(O)C1=CC=CC=C1 Z335245178 [0,0,1,0,0,0|2,0,0]=3 41 B10R1.15 CCC(O)C1=CC=NC=C1 Z513749638 [0,0,1,0,0,0|3,0,0]=4 42 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [0,0,1,0,0,0|3,0,0]=4 43 B10R1.15 CNC(C)C1=CC=CC=C1 Z85917524 [0,0,1,0,0,0|2,0,0]=3 44 B10R1.15 CNC(C)C1=CN=CC=C1 Z451350188 [0,0,1,0,0,0|3,0,0]=4 45 B10R1.15 CNC(C)C1=NC=CC=C1 Z451350194 [0,0,1,0,0,0|3,0,0]=4 46 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [0,0,1,0,0,0|0,0,0]=1 47 B10R1.15 N#CC(Br)C1=CC=CC=C1 Z1198157485 [0,0,1,0,0,0|1,0,2]=4 48 B10R1.15 NC(CO)C1=CC=CC=C1 Z381674942 [0,0,1,0,0,0|2,0,0]=3 49 B10R1.15 NC(CO)C1=CN=CC=C1 Z2350903961 [0,0,1,0,0,0|3,0,0]=4 50 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [0,0,1,0,0,0|1,0,1]=3 51 B10R1.15 NCC(=O)C1=CC=NC=C1 Z2677521709 [0,0,1,0,0,0|2,0,1]=4 52 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [0,0,1,0,0,0|1,0,0]=2 53 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [0,0,1,0,0,0|1,0,0]=2 54 B10R1.15 NCC(O)C1=CN=CC=C1 Z336086578 [0,0,1,0,0,0|2,0,0]=3 55 B10R1.15 NCC(O)C1=NC=CC=C1 Z802671456 [0,0,1,0,0,0|2,0,0]=3 56 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [0,0,1,0,0,0|2,0,1]=4 57 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 Z1201618614 [0,0,1,0,0,0|2,0,0]=3 58 B10R1.15 N[C@H](CO)C1=CC=CC=C1 Z1101444224 [0,0,1,0,0,0|2,0,0]=3 59 B10R1.15 O=C(CCl)C1=CC=CC=C1 Z57834468 [0,0,1,0,0,0|2,0,1]=4 60 B10R1.15 O=C(CO)C1=CC=CC=C1 Z906206792 [0,0,1,0,0,0|2,0,1]=4 61 B10R1.15 OCC(O)C1=CC=NC=C1 Z2736474279 [0,0,1,0,0,0|3,0,0]=4 62 B10R1.15 OCC(O)C1=NC=CC=C1 Z4985119178 [0,0,1,0,0,0|3,0,0]=4 63 B10R1.17 BrCCOC1=CC=CC=C1 Z56950513 [0,0,1,0,0,0|2,0,0]=3 64 B10R1.17 CCCCC1=CC=CC=C1 Z104492496 [0,0,1,0,0,0|1,0,0]=2 65 B10R1.17 CCCNC1=CN=CC=C1 Z334882412 [0,0,1,0,0,0|3,0,0]=4 66 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [0,0,1,0,0,0|2,0,0]=3 67 B10R1.17 CCNCC1=CC=NC=C1 Z57327181 [0,0,1,0,0,0|3,0,0]=4 68 B10R1.17 CCNCC1=NC=CC=C1 Z90513146 [0,0,1,0,0,0|3,0,0]=4 69 B10R1.17 CCSCC1=NC=CC=C1 Z1607601848 [0,0,1,0,0,0|3,0,0]=4 70 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [0,0,1,0,0,0|2,0,0]=3 71 B10R1.17 CNCCC1=CC=NC=C1 Z235580560 [0,0,1,0,0,0|3,0,0]=4 72 B10R1.17 CNCCC1=CN=CC=C1 Z2418466818 [0,0,1,0,0,0|3,0,0]=4 73 B10R1.17 CNCCC1=NC=CC=C1 Z2238930991 [0,0,1,0,0,0|3,0,0]=4 74 B10R1.17 COCCC1=CC=CC=C1 Z104494216 [0,0,1,0,0,0|2,0,0]=3 75 B10R1.17 N#CCCC1=CC=CC=C1 Z104507980 [0,0,1,0,0,0|0,0,2]=3 76 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [0,0,1,0,0,0|1,0,2]=4 77 B10R1.17 N#CCOC1=CC=CC=C1 Z53792061 [0,0,1,0,0,0|1,0,2]=4 78 B10R1.17 N#CCSC1=CC=CC=C1 Z19751391 [0,0,1,0,0,0|1,0,2]=4 79 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [0,0,1,0,0,0|0,0,2]=3 80 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [0,0,1,0,0,0|1,0,2]=4 81 B10R1.17 NCC#CC1=CC=CC=C1 Z227964210 [0,0,1,0,0,0|0,0,2]=3 82 B10R1.17 NCC#CC1=NC=CC=C1 Z1456201642 [0,0,1,0,0,0|1,0,2]=4 83 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [0,0,1,0,0,0|0,0,0]=1 84 B10R1.17 NCCCC1=CN=CC=C1 Z3058301115 [0,0,1,0,0,0|1,0,0]=2 85 B10R1.17 NCCCC1=CN=NC=C1 Z3270187722 [0,0,1,0,0,0|2,0,0]=3 86 B10R1.17 NCCCC1=NC=CC=C1 Z600381818 [0,0,1,0,0,0|1,0,0]=2 87 B10R1.17 NCCCC1=NC=CN=C1 Z1474025943 [0,0,1,0,0,0|2,0,0]=3 88 B10R1.17 NCCNC1=CC=NC=C1 Z317257862 [0,0,1,0,0,0|2,0,0]=3 89 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [0,0,1,0,0,0|2,0,0]=3 90 B10R1.17 NCCNC1=NC=CC=N1 Z381428982 [0,0,1,0,0,0|3,0,0]=4 91 B10R1.17 NCCNC1=NN=CC=C1 Z991530796 [0,0,1,0,0,0|3,0,0]=4 92 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [0,0,1,0,0,0|1,0,0]=2 93 B10R1.17 NCCOC1=CC=NC=C1 Z3243651499 [0,0,1,0,0,0|2,0,0]=3 94 B10R1.17 NCCOC1=CN=CC=C1 Z429662874 [0,0,1,0,0,0|2,0,0]=3 95 B10R1.17 NCCOC1=NC=CC=N1 Z4381809298 [0,0,1,0,0,0|3,0,0]=4 96 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [0,0,1,0,0,0|1,0,0]=2 97 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [0,0,1,0,0,0|1,0,0]=2 98 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [0,0,1,0,0,0|1,0,1]=3 99 B10R1.17 O=CCCC1=CC=NC=C1 Z1070006438 [0,0,1,0,0,0|2,0,1]=4 100 B10R1.17 O=CCCC1=CN=CC=C1 Z1198276578 [0,0,1,0,0,0|2,0,1]=4 101 B10R1.17 O=CCCC1=NC=CC=C1 Z1079158816 [0,0,1,0,0,0|2,0,1]=4 102 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [0,0,1,0,0,0|2,0,1]=4 103 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [0,0,1,0,0,0|2,0,1]=4 104 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [0,0,1,0,0,0|1,0,2]=4 105 B10R1.17 OCCCC1=CC=CC=C1 Z104476660 [0,0,1,0,0,0|1,0,0]=2 106 B10R1.17 OCCCC1=CC=NC=C1 Z104475752 [0,0,1,0,0,0|2,0,0]=3 107 B10R1.17 OCCCC1=CN=CC=C1 Z104479004 [0,0,1,0,0,0|2,0,0]=3 108 B10R1.17 OCCCC1=NC=NC=C1 Z2044799287 [0,0,1,0,0,0|3,0,0]=4 109 B10R1.17 OCCNC1=CC=NC=C1 Z359301874 [0,0,1,0,0,0|3,0,0]=4 110 B10R1.17 OCCNC1=NC=CC=C1 Z31212159 [0,0,1,0,0,0|3,0,0]=4 111 B10R1.17 OCCOC1=CC=CC=C1 Z104473570 [0,0,1,0,0,0|2,0,0]=3 112 B10R1.17 OCCOC1=CN=CC=C1 Z1180078238 [0,0,1,0,0,0|3,0,0]=4 113 B10R1.17 OCCSC1=CC=CC=C1 Z149157348 [0,0,1,0,0,0|2,0,0]=3 114 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [0,0,1,0,0,0|2,0,1]=4 115 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [0,0,1,0,0,0|2,0,1]=4 116 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [0,0,1,0,0,0|2,0,1]=4 117 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [0,0,1,0,0,0|1,0,0]=2 118 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [0,0,1,0,0,0|2,0,0]=3 119 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [0,0,1,0,0,0|2,0,0]=3 120 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [0,0,1,0,0,0|3,0,0]=4 121 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,0,1,0,0,0|2,0,0]=3 122 B10R1.18 CC(C)OC1=CC=NC=C1 Z1140308716 [0,0,1,0,0,0|3,0,0]=4 123 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [0,0,1,0,0,0|1,0,0]=2 124 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [0,0,1,0,0,0|1,0,0]=2 125 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [0,0,1,0,0,0|2,0,0]=3 126 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [0,0,1,0,0,0|2,0,0]=3 127 B10R1.18 CN(C)CC1=CN=CC=C1 Z140563088 [0,0,1,0,0,0|3,0,0]=4 128 B10R1.18 CN(C)CC1=NC=CC=C1 Z4614651190 [0,0,1,0,0,0|3,0,0]=4 129 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [0,0,1,0,0,0|1,0,1]=3 130 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [0,0,1,0,0,0|2,0,1]=4 131 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [0,0,1,0,0,0|2,0,1]=4 132 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [0,0,1,0,0,0|1,0,1]=3 133 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [0,0,1,0,0,0|2,0,1]=4 134 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [0,0,1,0,0,0|2,0,1]=4 135 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [0,0,1,0,0,0|1,0,1]=3 136 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [0,0,1,0,0,0|2,0,1]=4 137 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [0,0,1,0,0,0|3,0,0]=4 138 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [0,0,1,0,0,0|3,0,0]=4 139 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [0,0,1,0,0,0|3,0,0]=4 140 B12R3.12 C1=CC2=C(C=C1)C3OC3C2 Z278165226 [0,0,0,1,0,0|2,0,0]=3 141 B10R2.5 N[C@@H]1C[C@H]1C2=CNC=N2 Z2798782647 [0,0,0,0,1,0|2,0,0]=3 142 B10R2.5 N[C@@H]1C[C@H]1C2=CSC=C2 Z2683264163 [0,0,0,0,1,0|1,0,0]=2 143 B12R2.11 N[C@@H]1C[C@H]1SC2=CC=CC=C2 Z4598403773 [0,0,0,0,0,1|0,0,0]=1 144 B12R2.22 NC1CN(C1)C2=NC=CC=C2 Z3217364935 [0,0,0,0,0,1|2,0,0]=3 145 B12R2.22 NC1CN(C1)C2=NC=CN=C2 Z3244717829 [0,0,0,0,0,1|3,0,0]=4 146 B12R2.22 NC1CN(C1)C2=NC=NC=C2 Z1695922983 [0,0,0,0,0,1|3,0,0]=4 147 B12R2.22 NC1CN(C1)C2=NN=CC=C2 Z3244717830 [0,0,0,0,0,1|3,0,0]=4 148 B12R2.22 N[C@H]1C[C@@H](C1)C2=CC=CC=C2 Z2301685436 [0,0,0,0,0,1|0,0,0]=1 149 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 Z336080338 [0,0,0,0,0,1|1,0,1]=3 150 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 Z367677412 [0,0,0,0,0,1|1,0,1]=3 151 B12R2.22 OC1CC(C1)C2=CC=CC=C2 Z501748204 [0,0,0,0,0,1|1,0,0]=2 152 B12R2.22 OC1CN(C1)C2=NC=CC=C2 Z2935741201 [0,0,0,0,0,1|3,0,0]=4 153 B12R2.22 O[C@H]1C[C@H](C1)C2=CC=CC=C2 Z1504675336 [0,0,0,0,0,1|1,0,0]=2 154 B12R2.23 CC1CNC1C2=CC=CC=C2 Z1268458216 [0,0,0,0,0,1|1,0,0]=2 155 B12R2.23 NC1CCC1C2=CC=CC=C2 Z1203589614 [0,0,0,0,0,1|0,0,0]=1 156 B12R2.23 N[C@@H]1CC[C@@H]1C2=CC=CC=C2 Z2489138864 [0,0,0,0,0,1|0,0,0]=1 157 B12R2.23 O=C1CCN1C2=CC=CC=C2 Z1198221109 [0,0,0,0,0,1|2,0,1]=4 158 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [1,0,1,0,0,0|1,0,1]=4 159 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [1,0,1,0,0,0|1,0,0]=3 160 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [1,0,1,0,0,0|0,0,0]=2 161 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [1,0,1,0,0,0|1,0,0]=3 162 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [1,0,1,0,0,0|1,0,0]=3 163 B9R1.6 CC(N)C1=NC=CC=N1 Z2945456281 [1,0,1,0,0,0|2,0,0]=4 164 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [1,0,1,0,0,0|1,0,0]=3 165 B9R1.6 CC(O)C1=CC=NC=C1 Z335245082 [1,0,1,0,0,0|2,0,0]=4 166 B9R1.6 CC(O)C1=CN=CC=C1 Z335245084 [1,0,1,0,0,0|2,0,0]=4 167 B9R1.6 CC(O)C1=NC=CC=C1 Z335244914 [1,0,1,0,0,0|2,0,0]=4 168 B9R1.6 CN(C)C1=CC=NC=C1 Z104478964 [1,0,1,0,0,0|2,0,0]=4 169 B9R1.6 CN(C)C1=CN=CC=C1 Z1201619922 [1,0,1,0,0,0|2,0,0]=4 170 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [1,0,1,0,0,0|1,0,0]=3 171 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [1,0,1,0,0,0|0,0,0]=2 172 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [1,0,1,0,0,0|1,0,0]=3 173 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [1,0,1,0,0,0|1,0,0]=3 174 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [1,0,1,0,0,0|0,0,0]=2 175 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [1,0,1,0,0,0|1,0,0]=3 176 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [1,0,1,0,0,0|1,0,0]=3 177 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [1,0,1,0,0,0|1,0,1]=4 178 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [1,0,1,0,0,0|1,0,1]=4 179 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,1,0,0,0|0,0,0]=2 180 B9R1.8 CCCC1=NC=CC=C1 Z1255434741 [1,0,1,0,0,0|1,0,0]=3 181 B9R1.8 CCCC1=NN=CC=C1 Z1486025396 [1,0,1,0,0,0|2,0,0]=4 182 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,1,0,0,0|1,0,0]=3 183 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [1,0,1,0,0,0|2,0,0]=4 184 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [1,0,1,0,0,0|2,0,0]=4 185 B9R1.8 CCSC1=CC=NC=C1 Z1376454759 [1,0,1,0,0,0|2,0,0]=4 186 B9R1.8 CNCC1=CC=NC=C1 Z57390007 [1,0,1,0,0,0|2,0,0]=4 187 B9R1.8 CNCC1=CN=CC=C1 Z56963341 [1,0,1,0,0,0|2,0,0]=4 188 B9R1.8 CSCC1=CN=CC=C1 Z599631354 [1,0,1,0,0,0|2,0,0]=4 189 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [1,0,1,0,0,0|1,0,0]=3 190 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [1,0,1,0,0,0|1,0,0]=3 191 B9R1.8 NCCC1=CN=NC=C1 Z3070743015 [1,0,1,0,0,0|2,0,0]=4 192 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [1,0,1,0,0,0|1,0,0]=3 193 B9R1.8 NCCC1=NC=CN=C1 Z1925930460 [1,0,1,0,0,0|2,0,0]=4 194 B9R1.8 NCCC1=NC=NC=C1 Z2935002210 [1,0,1,0,0,0|2,0,0]=4 195 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,1,0,0,0|1,0,0]=3 196 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [1,0,1,0,0,0|2,0,0]=4 197 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,1,0,0,0|1,0,0]=3 198 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,1,0,0,0|1,0,1]=4 199 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,1,0,0,0|1,0,0]=3 200 B9R1.8 OCCC1=CN=CC=C1 Z992949518 [1,0,1,0,0,0|2,0,0]=4 201 B9R1.8 OCCC1=NC=CC=C1 Z104473592 [1,0,1,0,0,0|2,0,0]=4 202 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 Z339435272 [0,1,1,0,0,0|0,0,2]=4 203 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 Z1079442604 [0,1,1,0,0,0|1,0,1]=4 204 B11R1.7 CC(C)(CN)C1=CC=CC=C1 Z291234238 [0,1,1,0,0,0|0,0,0]=2 205 B11R1.7 CC(C)(CN)C1=CN=CC=C1 Z1255424681 [0,1,1,0,0,0|1,0,0]=3 206 B11R1.7 CC(C)(CO)C1=CC=CC=C1 Z397587218 [0,1,1,0,0,0|1,0,0]=3 207 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Z1216821531 [0,1,1,0,0,0|2,0,0]=4 208 B11R1.7 CC(F)(C#N)C1=CC=CC=C1 Z1695669743 [0,1,1,0,0,0|0,0,2]=4 209 B11R1.7 CC(F)(CN)C1=CC=CC=C1 Z2768234774 [0,1,1,0,0,0|0,0,0]=2 210 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Z734150992 [0,1,1,0,0,0|1,0,0]=3 211 B11R1.7 CC(O)(CN)C1=CC=CC=C1 Z979721628 [0,1,1,0,0,0|0,0,0]=2 212 B11R1.7 CCC(C)(N)C1=CC=CC=C1 Z449373366 [0,1,1,0,0,0|1,0,0]=3 213 B11R1.7 CCC(C)(O)C1=CC=CC=C1 Z449373348 [0,1,1,0,0,0|1,0,0]=3 214 B11R1.7 CNC(C)(C)C1=CC=CC=C1 Z991114970 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.7 NCC(F)(F)C1=CC=CC=C1 Z2168499583 [0,1,1,0,0,0|1,0,0]=3 216 B11R1.7 NCC(F)(F)C1=NC=CC=C1 Z1198184449 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [0,1,1,0,0,0|1,0,1]=4 218 B11R1.12 CCC(CC)C1=CC=NC=C1 Z104493650 [0,1,1,0,0,0|2,0,0]=4 219 B11R1.12 CCC(CN)C1=CC=CC=C1 Z85956799 [0,1,1,0,0,0|0,0,0]=2 220 B11R1.12 CCC(CO)C1=CC=CC=C1 Z397587442 [0,1,1,0,0,0|1,0,0]=3 221 B11R1.12 CCC(NC)C1=CC=NC=C1 Z513800486 [0,1,1,0,0,0|2,0,0]=4 222 B11R1.12 CCN(CC)C1=CC=CC=C1 Z57770738 [0,1,1,0,0,0|2,0,0]=4 223 B11R1.12 CNC(CO)C1=CC=CC=C1 Z734147276 [0,1,1,0,0,0|1,0,0]=3 224 B11R1.12 COC(CN)C1=CC=CC=C1 Z285139084 [0,1,1,0,0,0|0,0,0]=2 225 B11R1.12 NCC(CO)C1=CC=CC=C1 Z1198168251 [0,1,1,0,0,0|0,0,0]=2 226 B11R1.12 OCC(CO)C1=CC=CC=C1 Z1255395467 [0,1,1,0,0,0|1,0,0]=3 227 B11R1.16 C#CCC(O)C1=CC=CC=C1 Z932373338 [0,1,1,0,0,0|2,0,0]=4 228 B11R1.16 C#CCN(C)C1=CC=CC=C1 Z103708484 [0,1,1,0,0,0|2,0,0]=4 229 B11R1.16 CC(CC#N)C1=CC=CC=C1 Z1251357056 [0,1,1,0,0,0|0,0,1]=3 230 B11R1.16 CC(CC=O)C1=CC=CC=C1 Z57921394 [0,1,1,0,0,0|1,0,0]=3 231 B11R1.16 CC(N=C=S)C1=CC=CC=C1 Z57358351 [0,1,1,0,0,0|1,0,1]=4 232 B11R1.16 CCCC(O)C1=CC=CC=C1 Z335244704 [0,1,1,0,0,0|2,0,0]=4 233 B11R1.16 CCNC(C)C1=CC=NC=C1 Z1695709422 [0,1,1,0,0,0|2,0,0]=4 234 B11R1.16 CCNC(C)C1=CN=CC=C1 Z163548568 [0,1,1,0,0,0|2,0,0]=4 235 B11R1.16 CN(CCN)C1=CC=CC=C1 Z154669318 [0,1,1,0,0,0|1,0,0]=3 236 B11R1.16 CN(CCN)C1=NC=CC=C1 Z3026268353 [0,1,1,0,0,0|2,0,0]=4 237 B11R1.16 CN(CCO)C1=CC=CC=C1 Z138702688 [0,1,1,0,0,0|2,0,0]=4 238 B11R1.16 CNCC(C)C1=CC=CC=C1 Z57797325 [0,1,1,0,0,0|0,0,0]=2 239 B11R1.16 COCC(N)C1=CC=CC=C1 Z271013088 [0,1,1,0,0,0|2,0,0]=4 240 B11R1.16 CSCC(N)C1=CC=CC=C1 Z995116260 [0,1,1,0,0,0|2,0,0]=4 241 B11R1.16 N#CCC(N)C1=CC=CC=C1 Z1415893991 [0,1,1,0,0,0|1,0,1]=4 242 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [0,1,1,0,0,0|2,0,0]=4 243 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [0,1,1,0,0,0|1,0,0]=3 244 B11R1.16 NCCS(=O)C1=CC=CC=C1 Z1266854955 [0,1,1,0,0,0|2,0,0]=4 245 B11R1.16 O[C@@H](CCCl)C1=CC=CC=C1 Z1255427232 [0,1,1,0,0,0|2,0,0]=4 246 B11R1.16 O[C@H](CCCl)C1=CC=CC=C1 Z1255356297 [0,1,1,0,0,0|2,0,0]=4 247 B11R1.22 CC(C#N)C1=CC=C(C=C1)Br Z1269233209 [0,1,1,0,0,0|0,0,2]=4 248 B11R1.22 CC(C#N)C1=CC=C(C=C1)Cl Z1198147665 [0,1,1,0,0,0|0,0,2]=4 249 B11R1.22 CC(C=O)C1=CC=C(C=C1)Br Z1269114153 [0,1,1,0,0,0|1,0,1]=4 250 B11R1.22 CC(C=O)C1=CC=C(C=C1)Cl Z1198334992 [0,1,1,0,0,0|1,0,1]=4 251 B11R1.22 CC(C=O)C1=CC=C(C=C1)F Z1255400140 [0,1,1,0,0,0|1,0,1]=4 252 B11R1.22 CC(CN)C1=CC=C(C=C1)Br Z2906280360 [0,1,1,0,0,0|0,0,0]=2 253 B11R1.22 CC(CN)C1=CC=C(C=C1)F Z415654954 [0,1,1,0,0,0|0,0,0]=2 254 B11R1.22 CC(CO)C1=CC=C(C=C1)F Z1255440783 [0,1,1,0,0,0|1,0,0]=3 255 B11R1.22 CC1=CC=C(C=C1)C(=O)CN Z275368898 [0,1,1,0,0,0|1,0,1]=4 256 B11R1.22 CC1=CC=C(C=C1)C(C)C#N Z415654732 [0,1,1,0,0,0|0,0,2]=4 257 B11R1.22 CC1=CC=C(C=C1)C(C)C=O Z1198150045 [0,1,1,0,0,0|1,0,1]=4 258 B11R1.22 CC1=CC=C(C=C1)C(C)CN Z415654970 [0,1,1,0,0,0|0,0,0]=2 259 B11R1.22 CC1=CC=C(C=C1)C(N)CF Z2474474695 [0,1,1,0,0,0|2,0,0]=4 260 B11R1.22 CC1=CC=C(C=C1)C(N)CO Z5087131901 [0,1,1,0,0,0|2,0,0]=4 261 B11R1.22 CC1=CC=C(C=C1)C(O)CN Z336086536 [0,1,1,0,0,0|1,0,0]=3 262 B11R1.22 CC1=CC=C(C=C1)[C@@H](O)CN Z1895741843 [0,1,1,0,0,0|1,0,0]=3 263 B11R1.22 CCC(C)C1=CC=C(C=C1)O Z104484172 [0,1,1,0,0,0|1,0,0]=3 264 B11R1.22 CCC(N)C1=CC=C(C=C1)Br Z90662172 [0,1,1,0,0,0|2,0,0]=4 265 B11R1.22 CCC(N)C1=CC=C(C=C1)C Z90662186 [0,1,1,0,0,0|2,0,0]=4 266 B11R1.22 CCC(N)C1=CC=C(C=C1)Cl Z221421644 [0,1,1,0,0,0|2,0,0]=4 267 B11R1.22 CCC(O)C1=CC=C(C=C1)C Z228586316 [0,1,1,0,0,0|2,0,0]=4 268 B11R1.22 CCC(O)C1=CC=C(C=C1)Cl Z228586168 [0,1,1,0,0,0|2,0,0]=4 269 B11R1.22 CCC(O)C1=CC=C(C=C1)F Z228586174 [0,1,1,0,0,0|2,0,0]=4 270 B11R1.22 CCC(O)C1=CC=C(C=C1)O Z228586170 [0,1,1,0,0,0|2,0,0]=4 271 B11R1.22 CC[C@@H](N)C1=CC=C(C=C1)F Z1626921240 [0,1,1,0,0,0|2,0,0]=4 272 B11R1.22 CC[C@H](N)C1=CC=C(C=C1)F Z1625822291 [0,1,1,0,0,0|2,0,0]=4 273 B11R1.22 CNC(C)C1=CC=C(C=C1)C Z239628686 [0,1,1,0,0,0|2,0,0]=4 274 B11R1.22 CNC(C)C1=CC=C(C=C1)Cl Z159528172 [0,1,1,0,0,0|2,0,0]=4 275 B11R1.22 CNC(C)C1=CC=C(C=C1)F Z166605480 [0,1,1,0,0,0|2,0,0]=4 276 B11R1.22 CNC(C)C1=CC=C(C=C1)O Z316170374 [0,1,1,0,0,0|2,0,0]=4 277 B11R1.22 NC(CF)C1=CC=C(C=C1)Cl Z1510155807 [0,1,1,0,0,0|2,0,0]=4 278 B11R1.22 NC(CO)C1=CC=C(C=C1)Br Z2188171600 [0,1,1,0,0,0|2,0,0]=4 279 B11R1.22 NC(CO)C1=CC=C(C=C1)F Z1268152327 [0,1,1,0,0,0|2,0,0]=4 280 B11R1.22 NCC(=O)C1=CC=C(C=C1)Br Z1741980207 [0,1,1,0,0,0|1,0,1]=4 281 B11R1.22 NCC(=O)C1=CC=C(C=C1)Cl Z56928681 [0,1,1,0,0,0|1,0,1]=4 282 B11R1.22 NCC(=O)C1=CC=C(C=C1)F Z275365838 [0,1,1,0,0,0|1,0,1]=4 283 B11R1.22 NCC(=O)C1=CC=C(C=C1)O Z1198177329 [0,1,1,0,0,0|1,0,1]=4 284 B11R1.22 NCC(O)C1=CC=C(C=C1)Cl Z295878600 [0,1,1,0,0,0|1,0,0]=3 285 B11R1.23 CC(C#N)C1=CC(=CC=C1)F Z415654674 [0,1,1,0,0,0|0,0,2]=4 286 B11R1.23 CC(C=O)C1=CC(=CC=C1)Br Z1269224544 [0,1,1,0,0,0|1,0,1]=4 287 B11R1.23 CC(C=O)C1=CC(=CC=C1)Cl Z1222424632 [0,1,1,0,0,0|1,0,1]=4 288 B11R1.23 CC(C=O)C1=CC(=CC=C1)F Z1222424642 [0,1,1,0,0,0|1,0,1]=4 289 B11R1.23 CC(CN)C1=CC(=CC=C1)Br Z5094147873 [0,1,1,0,0,0|0,0,0]=2 290 B11R1.23 CC(CN)C1=CC(=CC=C1)F Z415654914 [0,1,1,0,0,0|0,0,0]=2 291 B11R1.23 CC(CN)C1=CC=CC(=O)N1 Z4656721256 [0,1,1,0,0,0|1,0,0]=3 292 B11R1.23 CC(CO)C1=CC(=CC=C1)Br Z1269177166 [0,1,1,0,0,0|1,0,0]=3 293 B11R1.23 CC(CO)C1=CC(=CC=C1)Cl Z1222424631 [0,1,1,0,0,0|1,0,0]=3 294 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [0,1,1,0,0,0|1,0,1]=4 295 B11R1.23 CC1=CC(=CC=C1)C(O)CN Z336086464 [0,1,1,0,0,0|1,0,0]=3 296 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [0,1,1,0,0,0|1,0,1]=4 297 B11R1.23 CCC(N)C1=CC(=CC=C1)Cl Z239627026 [0,1,1,0,0,0|2,0,0]=4 298 B11R1.23 CCC(N)C1=CC(=CC=C1)O Z4164634595 [0,1,1,0,0,0|2,0,0]=4 299 B11R1.23 CCC(O)C1=CC(=CC=C1)Br Z228586280 [0,1,1,0,0,0|2,0,0]=4 300 B11R1.23 CCC(O)C1=CC(=CC=C1)Cl Z335245132 [0,1,1,0,0,0|2,0,0]=4 301 B11R1.23 CCC(O)C1=CC(=CC=C1)N Z1262626036 [0,1,1,0,0,0|2,0,0]=4 302 B11R1.23 CNC(C)C1=CC(=CC=C1)Cl Z159528162 [0,1,1,0,0,0|2,0,0]=4 303 B11R1.23 CNC(C)C1=CC(=CC=C1)O Z1266854844 [0,1,1,0,0,0|2,0,0]=4 304 B11R1.23 COC(C)C1=CC(=CC=C1)N Z801781454 [0,1,1,0,0,0|2,0,0]=4 305 B11R1.23 CSC(C)C1=CC(=CC=C1)N Z801781922 [0,1,1,0,0,0|2,0,0]=4 306 B11R1.23 NC(CF)C1=CC(=CC=C1)Br Z3210128314 [0,1,1,0,0,0|2,0,0]=4 307 B11R1.23 NC(CF)C1=CC(=CC=C1)Cl Z3445798142 [0,1,1,0,0,0|2,0,0]=4 308 B11R1.23 NC(CF)C1=CC(=CC=C1)F Z3681214901 [0,1,1,0,0,0|2,0,0]=4 309 B11R1.23 NC(CO)C1=CC(=CC=C1)Br Z1438483917 [0,1,1,0,0,0|2,0,0]=4 310 B11R1.23 NC(CO)C1=CC(=CC=C1)Cl Z1695784092 [0,1,1,0,0,0|2,0,0]=4 311 B11R1.23 NC(CO)C1=CC(=CC=C1)F Z1268152384 [0,1,1,0,0,0|2,0,0]=4 312 B11R1.23 NC(CO)C1=CC(=CC=C1)I Z3605387233 [0,1,1,0,0,0|2,0,0]=4 313 B11R1.23 NC(CO)C1=CC(=CC=C1)O Z3247611804 [0,1,1,0,0,0|2,0,0]=4 314 B11R1.23 NC1=CC(=CC=C1)C(O)CO Z970072128 [0,1,1,0,0,0|2,0,0]=4 315 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [0,1,1,0,0,0|1,0,1]=4 316 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [0,1,1,0,0,0|1,0,1]=4 317 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [0,1,1,0,0,0|1,0,1]=4 318 B11R1.23 NCC(O)C1=CC(=CC=C1)Cl Z330910384 [0,1,1,0,0,0|1,0,0]=3 319 B11R1.23 NCC(O)C1=CC(=CC=C1)O Z3041501762 [0,1,1,0,0,0|1,0,0]=3 320 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,1,1,0,0,0|1,0,1]=4 321 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,1,1,0,0,0|0,0,1]=3 322 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [0,1,1,0,0,0|0,0,0]=2 323 B11R1.36 CC(N)C(O)C1=CC=NC=C1 Z1263602353 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.36 CC(O)C(N)C1=CC=CC=C1 Z2588063686 [0,1,1,0,0,0|2,0,0]=4 325 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,1,1,0,0,0|1,0,1]=4 326 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,1,1,0,0,0|1,0,1]=4 327 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,1,1,0,0,0|1,0,1]=4 328 B11R1.36 NC(C1=CC=CC=C1)C(F)F Z2211231766 [0,1,1,0,0,0|2,0,0]=4 329 B11R1.222 CC(C=O)C1=C(C=CC=C1)Br Z1269159201 [0,1,1,0,0,0|1,0,1]=4 330 B11R1.222 CC(C=O)C1=C(C=CC=C1)Cl Z1222424635 [0,1,1,0,0,0|1,0,1]=4 331 B11R1.222 CC(C=O)C1=C(C=CC=C1)F Z1222424647 [0,1,1,0,0,0|1,0,1]=4 332 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [0,1,1,0,0,0|1,0,1]=4 333 B11R1.222 CC1=C(C=CC=C1)C(C)C#N Z415654748 [0,1,1,0,0,0|0,0,2]=4 334 B11R1.222 CC1=C(C=CC=C1)C(C)C=O Z1222424657 [0,1,1,0,0,0|1,0,1]=4 335 B11R1.222 CC1=C(C=CC=C1)C(N)CF Z3092528504 [0,1,1,0,0,0|2,0,0]=4 336 B11R1.222 CC1=C(C=CC=C1)C(N)CO Z385458414 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.222 CC1=C(C=CC=C1)C(O)CN Z336086534 [0,1,1,0,0,0|1,0,0]=3 338 B11R1.222 CCC(N)C1=C(C=CC=C1)Br Z851790482 [0,1,1,0,0,0|2,0,0]=4 339 B11R1.222 CCC(N)C1=C(C=CC=C1)O Z1266854970 [0,1,1,0,0,0|2,0,0]=4 340 B11R1.222 CCN(C)C1=C(C=CC=C1)N Z409023630 [0,1,1,0,0,0|2,0,0]=4 341 B11R1.222 CNC(C)C1=C(C=CC=C1)Br Z1497158706 [0,1,1,0,0,0|2,0,0]=4 342 B11R1.222 CNC(C)C1=C(C=CC=C1)C Z159528196 [0,1,1,0,0,0|2,0,0]=4 343 B11R1.222 CNC(C)C1=C(C=CC=C1)Cl Z138106016 [0,1,1,0,0,0|2,0,0]=4 344 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [0,1,1,0,0,0|2,0,0]=4 345 B11R1.222 NC(CF)C1=C(C=CC=C1)Br Z4444282330 [0,1,1,0,0,0|2,0,0]=4 346 B11R1.222 NC(CO)C1=C(C=CC=C1)F Z1268152413 [0,1,1,0,0,0|2,0,0]=4 347 B11R1.222 NC(CO)C1=C(C=CC=C1)I Z2941400807 [0,1,1,0,0,0|2,0,0]=4 348 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [0,1,1,0,0,0|1,0,1]=4 349 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [0,1,1,0,0,0|1,0,1]=4 350 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [0,1,1,0,0,0|1,0,1]=4 351 B11R1.222 NCC(O)C1=C(C=CC=C1)Cl Z1255523275 [0,1,1,0,0,0|1,0,0]=3 352 B11R1.1 BrCCOC1=CC=C(C=C1)Br Z56887702 [0,1,1,0,0,0|2,0,0]=4 353 B11R1.1 CC1=CC=C(C=C1)CCCN Z4639316723 [0,1,1,0,0,0|0,0,0]=2 354 B11R1.1 CC1=CC=C(C=C1)OCCBr Z56886357 [0,1,1,0,0,0|2,0,0]=4 355 B11R1.1 CC1=CC=C(C=C1)OCCN Z54747869 [0,1,1,0,0,0|1,0,0]=3 356 B11R1.1 CC1=CC=C(C=C1)SCCCl Z90122598 [0,1,1,0,0,0|2,0,0]=4 357 B11R1.1 CC1=CC=C(C=C1)SCCO Z149178580 [0,1,1,0,0,0|2,0,0]=4 358 B11R1.1 CC1=CN=C(C=C1)NCCN Z1695797833 [0,1,1,0,0,0|2,0,0]=4 359 B11R1.1 CCCCC1=CC=C(C=C1)N Z104475500 [0,1,1,0,0,0|1,0,0]=3 360 B11R1.1 CCCNC1=CC=C(C=C1)Cl Z1266933829 [0,1,1,0,0,0|2,0,0]=4 361 B11R1.1 CCCOC1=CC=C(C=C1)N Z239604724 [0,1,1,0,0,0|2,0,0]=4 362 B11R1.1 CCNCC1=CC=C(C=C1)F Z3244655509 [0,1,1,0,0,0|2,0,0]=4 363 B11R1.1 CCOCC1=CC=C(C=C1)Br Z823854370 [0,1,1,0,0,0|2,0,0]=4 364 B11R1.1 CCOCC1=CC=C(C=C1)N Z240084570 [0,1,1,0,0,0|2,0,0]=4 365 B11R1.1 CCSCC1=CC=C(C=C1)N Z332378208 [0,1,1,0,0,0|2,0,0]=4 366 B11R1.1 CNCCC1=CC=C(C=C1)Br Z385447024 [0,1,1,0,0,0|2,0,0]=4 367 B11R1.1 CNCCC1=CC=C(C=C1)C Z5115849578 [0,1,1,0,0,0|2,0,0]=4 368 B11R1.1 CNCCC1=CC=C(C=C1)Cl Z1623872266 [0,1,1,0,0,0|2,0,0]=4 369 B11R1.1 CNCCC1=CC=C(C=C1)F Z138454998 [0,1,1,0,0,0|2,0,0]=4 370 B11R1.1 COCCC1=CC=C(C=C1)Br Z299596190 [0,1,1,0,0,0|2,0,0]=4 371 B11R1.1 COCCC1=CC=C(C=C1)Cl Z1470894103 [0,1,1,0,0,0|2,0,0]=4 372 B11R1.1 COCCC1=CC=C(C=C1)O Z104485614 [0,1,1,0,0,0|2,0,0]=4 373 B11R1.1 CSCCC1=CC=C(C=C1)N Z732207426 [0,1,1,0,0,0|2,0,0]=4 374 B11R1.1 ClC1=CC=C(C=C1)OCCBr Z56926557 [0,1,1,0,0,0|2,0,0]=4 375 B11R1.1 ClCCSC1=CC=C(C=C1)Cl Z55993025 [0,1,1,0,0,0|2,0,0]=4 376 B11R1.1 FCCOC1=CC=C(C=C1)Br Z1269166672 [0,1,1,0,0,0|2,0,0]=4 377 B11R1.1 N#CCCC1=CC=C(C=C1)N Z4750298565 [0,1,1,0,0,0|0,0,2]=4 378 B11R1.1 NC/C=C/C1=CC=C(C=C1)Br Z2235681463 [0,1,1,0,0,0|0,0,2]=4 379 B11R1.1 NC1=CC=C(C=C1)OCCF Z1262631146 [0,1,1,0,0,0|2,0,0]=4 380 B11R1.1 NC1=CC=C(C=C1)OCCO Z332379386 [0,1,1,0,0,0|2,0,0]=4 381 B11R1.1 NCC#CC1=CC=C(C=C1)I Z4775597113 [0,1,1,0,0,0|0,0,2]=4 382 B11R1.1 NCCCC1=CC=C(C=C1)Br Z3980240042 [0,1,1,0,0,0|0,0,0]=2 383 B11R1.1 NCCCC1=CC=C(C=C1)Cl Z992716848 [0,1,1,0,0,0|0,0,0]=2 384 B11R1.1 NCCCC1=CC=C(C=C1)F Z3244753845 [0,1,1,0,0,0|0,0,0]=2 385 B11R1.1 NCCCC1=CC=C(C=C1)N Z5453008768 [0,1,1,0,0,0|0,0,0]=2 386 B11R1.1 NCCCC1=CC=C(C=C1)O Z1270210797 [0,1,1,0,0,0|0,0,0]=2 387 B11R1.1 NCCNC1=CC=C(C=C1)O Z3386315806 [0,1,1,0,0,0|1,0,0]=3 388 B11R1.1 NCCOC1=CC=C(C=C1)Br Z1262237188 [0,1,1,0,0,0|1,0,0]=3 389 B11R1.1 NCCOC1=CC=C(C=C1)Cl Z85957193 [0,1,1,0,0,0|1,0,0]=3 390 B11R1.1 NCCOC1=CC=C(C=C1)F Z87000937 [0,1,1,0,0,0|1,0,0]=3 391 B11R1.1 NCCOC1=CC=C(C=C1)I Z381428104 [0,1,1,0,0,0|1,0,0]=3 392 B11R1.1 NCCOC1=NC=C(C=C1)Cl Z1421528823 [0,1,1,0,0,0|2,0,0]=4 393 B11R1.1 NCCSC1=CC=C(C=C1)Br Z262221984 [0,1,1,0,0,0|1,0,0]=3 394 B11R1.1 NCCSC1=CC=C(C=C1)Cl Z54751093 [0,1,1,0,0,0|1,0,0]=3 395 B11R1.1 NCCSC1=CC=C(C=C1)F Z1267773811 [0,1,1,0,0,0|1,0,0]=3 396 B11R1.1 O=CCCC1=CC=C(C=C1)Br Z993017756 [0,1,1,0,0,0|1,0,1]=4 397 B11R1.1 O=CCCC1=CC=C(C=C1)Cl Z993017742 [0,1,1,0,0,0|1,0,1]=4 398 B11R1.1 O=CCCC1=CC=C(C=C1)F Z993017748 [0,1,1,0,0,0|1,0,1]=4 399 B11R1.1 OCCCC1=CC=C(C=C1)F Z992949550 [0,1,1,0,0,0|1,0,0]=3 400 B11R1.1 OCCNC1=CC=C(C=C1)Br Z335275406 [0,1,1,0,0,0|2,0,0]=4 401 B11R1.1 OCCOC1=CC=C(C=C1)Br Z335092354 [0,1,1,0,0,0|2,0,0]=4 402 B11R1.1 OCCOC1=CC=C(C=C1)O Z381414946 [0,1,1,0,0,0|2,0,0]=4 403 B11R1.1 OCCSC1=CC=C(C=C1)Br Z149190682 [0,1,1,0,0,0|2,0,0]=4 404 B11R1.1 OCCSC1=CC=C(C=C1)Cl Z149162370 [0,1,1,0,0,0|2,0,0]=4 405 B11R1.17 CC1=C(C=CC=C1)CCCN Z424782962 [0,1,1,0,0,0|0,0,0]=2 406 B11R1.17 CC1=C(C=CC=C1)CCCO Z979436644 [0,1,1,0,0,0|1,0,0]=3 407 B11R1.17 CC1=C(C=CC=C1)OCCN Z223656356 [0,1,1,0,0,0|1,0,0]=3 408 B11R1.17 CC1=C(N=CC=C1)CCCN Z1198262715 [0,1,1,0,0,0|1,0,0]=3 409 B11R1.17 CCCNC1=C(C=CC=C1)F Z334942896 [0,1,1,0,0,0|2,0,0]=4 410 B11R1.17 CCCNC1=C(C=CC=C1)N Z94601320 [0,1,1,0,0,0|2,0,0]=4 411 B11R1.17 CCCOC1=C(C=CC=C1)Br Z54722000 [0,1,1,0,0,0|2,0,0]=4 412 B11R1.17 CCCOC1=C(C=CC=C1)N Z56968930 [0,1,1,0,0,0|2,0,0]=4 413 B11R1.17 CCCOC1=C(C=CC=C1)O Z55993120 [0,1,1,0,0,0|2,0,0]=4 414 B11R1.17 CCNCC1=C(C=CC=C1)Br Z1982494002 [0,1,1,0,0,0|2,0,0]=4 415 B11R1.17 CCNCC1=C(C=CC=C1)C Z90513218 [0,1,1,0,0,0|2,0,0]=4 416 B11R1.17 CCNCC1=C(C=CC=C1)Cl Z90513164 [0,1,1,0,0,0|2,0,0]=4 417 B11R1.17 CCNCC1=C(C=CC=C1)F Z286282968 [0,1,1,0,0,0|2,0,0]=4 418 B11R1.17 CCNCC1=C(C=CC=C1)N Z2351947311 [0,1,1,0,0,0|2,0,0]=4 419 B11R1.17 CCOCC1=C(C=CC=C1)N Z285163822 [0,1,1,0,0,0|2,0,0]=4 420 B11R1.17 CNCCC1=C(C=CC=C1)C Z2234185664 [0,1,1,0,0,0|2,0,0]=4 421 B11R1.17 CNCCC1=C(C=CC=C1)Cl Z4935566656 [0,1,1,0,0,0|2,0,0]=4 422 B11R1.17 CNCCC1=C(C=CC=C1)F Z163192604 [0,1,1,0,0,0|2,0,0]=4 423 B11R1.17 CNCCC1=C(C=CC=C1)O Z1665033474 [0,1,1,0,0,0|2,0,0]=4 424 B11R1.17 COCCC1=C(C=CC=C1)N Z992259832 [0,1,1,0,0,0|2,0,0]=4 425 B11R1.17 ClC1=C(C=CC=C1)OCCBr Z56886267 [0,1,1,0,0,0|2,0,0]=4 426 B11R1.17 N#CCCC1=C(C=CC=C1)Br Z815260584 [0,1,1,0,0,0|0,0,2]=4 427 B11R1.17 NC1=C(C=CC=C1)CCCO Z1198265858 [0,1,1,0,0,0|1,0,0]=3 428 B11R1.17 NC1=C(C=CC=C1)NCCO Z55928991 [0,1,1,0,0,0|2,0,0]=4 429 B11R1.17 NC1=C(C=CC=C1)OCCO Z3445703033 [0,1,1,0,0,0|2,0,0]=4 430 B11R1.17 NCCCC1=C(C=CC=C1)Cl Z1695729033 [0,1,1,0,0,0|0,0,0]=2 431 B11R1.17 NCCCC1=C(C=CC=C1)F Z424783030 [0,1,1,0,0,0|0,0,0]=2 432 B11R1.17 NCCCN1C=CC=CC1=O Z271005712 [0,1,1,0,0,0|1,0,0]=3 433 B11R1.17 NCCCN1C=CC=NC1=O Z1956828657 [0,1,1,0,0,0|2,0,0]=4 434 B11R1.17 NCCNC1=C(C=CC=C1)N Z991530054 [0,1,1,0,0,0|1,0,0]=3 435 B11R1.17 NCCNC1=C(C=CC=N1)Br Z808603224 [0,1,1,0,0,0|2,0,0]=4 436 B11R1.17 NCCOC1=C(C=CC=C1)Br Z803145324 [0,1,1,0,0,0|1,0,0]=3 437 B11R1.17 NCCOC1=C(C=CC=C1)Cl Z54747867 [0,1,1,0,0,0|1,0,0]=3 438 B11R1.17 NCCOC1=C(C=CC=C1)F Z1272739857 [0,1,1,0,0,0|1,0,0]=3 439 B11R1.17 NCCOC1=C(C=CC=C1)O Z3217405430 [0,1,1,0,0,0|1,0,0]=3 440 B11R1.17 NCCOC1=C(C=CC=N1)Cl Z1421528240 [0,1,1,0,0,0|2,0,0]=4 441 B11R1.17 NCCSC1=C(C=CC=C1)F Z57971449 [0,1,1,0,0,0|1,0,0]=3 442 B11R1.17 NNCCC1=C(C=CC=C1)F Z285144176 [0,1,1,0,0,0|1,0,0]=3 443 B11R1.17 O=C1C=CC=CN1CCCO Z425794816 [0,1,1,0,0,0|2,0,0]=4 444 B11R1.17 O=CCCC1=C(C=CC=C1)F Z993017602 [0,1,1,0,0,0|1,0,1]=4 445 B11R1.17 OCCCC1=C(C=CC=C1)Br Z992949552 [0,1,1,0,0,0|1,0,0]=3 446 B11R1.17 OCCOC1=C(C=CC=C1)Br Z149303034 [0,1,1,0,0,0|2,0,0]=4 447 B11R1.17 OCCOC1=C(C=CC=C1)F Z425795714 [0,1,1,0,0,0|2,0,0]=4 448 B11R1.17 OCCOC1=C(C=CC=C1)O Z56755902 [0,1,1,0,0,0|2,0,0]=4 449 B11R1.17 OCCSC1=C(C=CC=C1)Br Z149386602 [0,1,1,0,0,0|2,0,0]=4 450 B11R1.17 OCCSC1=C(C=CC=C1)Cl Z149174540 [0,1,1,0,0,0|2,0,0]=4 451 B11R1.24 BrCCOC1=CC(=CC=C1)Br Z56886268 [0,1,1,0,0,0|2,0,0]=4 452 B11R1.24 C=CCCC1=CC=CC(=C1)Br Z1269162615 [0,1,1,0,0,0|1,0,1]=4 453 B11R1.24 CC1=CC(=CC=C1)CCCN Z4993130622 [0,1,1,0,0,0|0,0,0]=2 454 B11R1.24 CC1=CC(=CC=C1)CCCO Z979436642 [0,1,1,0,0,0|1,0,0]=3 455 B11R1.24 CC1=CC(=CC=C1)OCCBr Z56886266 [0,1,1,0,0,0|2,0,0]=4 456 B11R1.24 CC1=CC(=CC=C1)OCCN Z85926240 [0,1,1,0,0,0|1,0,0]=3 457 B11R1.24 CC1=CC(=CN=C1)CCCO Z1216820424 [0,1,1,0,0,0|2,0,0]=4 458 B11R1.24 CC1=NC(=CC=C1)CCCO Z104479712 [0,1,1,0,0,0|2,0,0]=4 459 B11R1.24 CC1=NC(=CC=C1)NCCN Z1267773738 [0,1,1,0,0,0|2,0,0]=4 460 B11R1.24 CCCOC1=CC(=CC=C1)Br Z54848718 [0,1,1,0,0,0|2,0,0]=4 461 B11R1.24 CCCOC1=CC(=CC=C1)N Z239604770 [0,1,1,0,0,0|2,0,0]=4 462 B11R1.24 CCCOC1=CC(=CC=C1)O Z381415572 [0,1,1,0,0,0|2,0,0]=4 463 B11R1.24 CCNCC1=CC(=CC=C1)Br Z1138763375 [0,1,1,0,0,0|2,0,0]=4 464 B11R1.24 CCNCC1=CC(=CC=C1)C Z90513252 [0,1,1,0,0,0|2,0,0]=4 465 B11R1.24 CCNCC1=CC(=CC=C1)Cl Z90513201 [0,1,1,0,0,0|2,0,0]=4 466 B11R1.24 CCNCC1=CC(=CC=C1)F Z85935746 [0,1,1,0,0,0|2,0,0]=4 467 B11R1.24 CCOCC1=CC(=CC=C1)N Z285163820 [0,1,1,0,0,0|2,0,0]=4 468 B11R1.24 CCSCC1=CC(=CC=C1)N Z332378038 [0,1,1,0,0,0|2,0,0]=4 469 B11R1.24 CNCCC1=CC(=CC=C1)Br Z2168282744 [0,1,1,0,0,0|2,0,0]=4 470 B11R1.24 CNCCC1=CC(=CC=C1)O Z4924737523 [0,1,1,0,0,0|2,0,0]=4 471 B11R1.24 COCCC1=CC(=CC=C1)O Z1513911027 [0,1,1,0,0,0|2,0,0]=4 472 B11R1.24 NC1=CC(=CC=C1)CCCO Z1198265859 [0,1,1,0,0,0|1,0,0]=3 473 B11R1.24 NC1=CC(=CC=C1)OCCF Z1262657442 [0,1,1,0,0,0|2,0,0]=4 474 B11R1.24 NCC#CC1=CC(=CC=C1)F Z2004547701 [0,1,1,0,0,0|0,0,2]=4 475 B11R1.24 NCCCC1=CC(=CC=C1)Br Z1266823414 [0,1,1,0,0,0|0,0,0]=2 476 B11R1.24 NCCCC1=CC(=CC=C1)Cl Z1262246154 [0,1,1,0,0,0|0,0,0]=2 477 B11R1.24 NCCCC1=CC(=CC=C1)F Z424782946 [0,1,1,0,0,0|0,0,0]=2 478 B11R1.24 NCCCC1=CC(=CC=C1)O Z1895582955 [0,1,1,0,0,0|0,0,0]=2 479 B11R1.24 NCCCC1=CC(=CN=C1)F Z4446765955 [0,1,1,0,0,0|1,0,0]=3 480 B11R1.24 NCCOC1=CC(=CC=C1)Br Z744843646 [0,1,1,0,0,0|1,0,0]=3 481 B11R1.24 NCCOC1=CC(=CC=C1)Cl Z425484860 [0,1,1,0,0,0|1,0,0]=3 482 B11R1.24 NCCOC1=CC(=CC=C1)F Z381785786 [0,1,1,0,0,0|1,0,0]=3 483 B11R1.24 O=CCCC1=CC=CC(=C1)Cl Z993017744 [0,1,1,0,0,0|1,0,1]=4 484 B11R1.24 O=CCCC1=CC=CC(=C1)F Z993017622 [0,1,1,0,0,0|1,0,1]=4 485 B11R1.24 OCCNC1=CC(=CC=C1)F Z335274246 [0,1,1,0,0,0|2,0,0]=4 486 B11R1.24 OCCOC1=CC(=CC=C1)Br Z335092356 [0,1,1,0,0,0|2,0,0]=4 487 B11R1.24 OCCOC1=CC(=CC=C1)Cl Z149166432 [0,1,1,0,0,0|2,0,0]=4 488 B11R1.28 BrCCCOC1=CC=CC=C1 Z90122132 [0,1,1,0,0,0|1,0,0]=3 489 B11R1.28 C#CCCOC1=CC=CC=C1 Z1143222703 [0,1,1,0,0,0|1,0,1]=4 490 B11R1.28 C#CCNCC1=CC=CC=C1 Z2082999436 [0,1,1,0,0,0|1,0,1]=4 491 B11R1.28 C=CCNCC1=CC=CC=C1 Z86135577 [0,1,1,0,0,0|1,0,1]=4 492 B11R1.28 CCCCCC1=CC=CC=C1 Z199507042 [0,1,1,0,0,0|1,0,0]=3 493 B11R1.28 CCCCNC1=CC=NC=C1 Z359299136 [0,1,1,0,0,0|2,0,0]=4 494 B11R1.28 CCCNCC1=CC=CC=C1 Z56946091 [0,1,1,0,0,0|1,0,0]=3 495 B11R1.28 CCCNCC1=CC=NC=C1 Z3247723488 [0,1,1,0,0,0|2,0,0]=4 496 B11R1.28 CCCNCC1=CN=CC=C1 Z3247723489 [0,1,1,0,0,0|2,0,0]=4 497 B11R1.28 CCCNCC1=NC=CC=C1 Z4401052052 [0,1,1,0,0,0|2,0,0]=4 498 B11R1.28 CCNCCC1=CC=CC=C1 Z444350074 [0,1,1,0,0,0|1,0,0]=3 499 B11R1.28 CCNCCC1=NC=CC=C1 Z138534138 [0,1,1,0,0,0|2,0,0]=4 500 B11R1.28 CCOCCC1=CC=CC=C1 Z1198150519 [0,1,1,0,0,0|1,0,0]=3 501 B11R1.28 CNCCCC1=CC=CC=C1 Z102767020 [0,1,1,0,0,0|0,0,0]=2 502 B11R1.28 CNCCNC1=NC=CC=C1 Z3033960688 [0,1,1,0,0,0|2,0,0]=4 503 B11R1.28 CNCCOC1=CC=CC=C1 Z56945505 [0,1,1,0,0,0|1,0,0]=3 504 B11R1.28 COCCNC1=CC=CC=C1 Z266463556 [0,1,1,0,0,0|2,0,0]=4 505 B11R1.28 ClCCCOC1=CC=CC=C1 Z275020186 [0,1,1,0,0,0|1,0,0]=3 506 B11R1.28 ClCCNCC1=CC=CC=C1 Z57158447 [0,1,1,0,0,0|1,0,0]=3 507 B11R1.28 N#CCCNC1=CC=CC=C1 Z56915949 [0,1,1,0,0,0|0,0,2]=4 508 B11R1.28 N#CCCOC1=CC=CC=C1 Z54337114 [0,1,1,0,0,0|0,0,2]=4 509 B11R1.28 N#CCNCC1=CC=CC=C1 Z266079624 [0,1,1,0,0,0|0,0,2]=4 510 B11R1.28 N#CCOCC1=CC=CC=C1 Z295205356 [0,1,1,0,0,0|0,0,2]=4 511 B11R1.28 N#CCSCC1=CC=CC=C1 Z54337756 [0,1,1,0,0,0|0,0,2]=4 512 B11R1.28 NCCCCC1=CC=CC=C1 Z2574929438 [0,1,1,0,0,0|0,0,0]=2 513 B11R1.28 NCCCCC1=CC=NC=C1 Z3234944907 [0,1,1,0,0,0|1,0,0]=3 514 B11R1.28 NCCCNC1=CC=CC=C1 Z756919512 [0,1,1,0,0,0|0,0,0]=2 515 B11R1.28 NCCCNC1=CC=NC=C1 Z317257864 [0,1,1,0,0,0|1,0,0]=3 516 B11R1.28 NCCCNC1=NC=CC=C1 Z234895141 [0,1,1,0,0,0|1,0,0]=3 517 B11R1.28 NCCCNC1=NC=CC=N1 Z444311056 [0,1,1,0,0,0|2,0,0]=4 518 B11R1.28 NCCCOC1=CC=CC=C1 Z234895129 [0,1,1,0,0,0|0,0,0]=2 519 B11R1.28 NCCCOC1=CC=NC=C1 Z976694292 [0,1,1,0,0,0|1,0,0]=3 520 B11R1.28 NCCCOC1=NC=CC=N1 Z2467687631 [0,1,1,0,0,0|2,0,0]=4 521 B11R1.28 NCCCSC1=CC=CC=C1 Z262222134 [0,1,1,0,0,0|0,0,0]=2 522 B11R1.28 NCCCSC1=NC=CC=C1 Z2028214397 [0,1,1,0,0,0|1,0,0]=3 523 B11R1.28 NCCNCC1=NC=CC=C1 Z600492946 [0,1,1,0,0,0|1,0,0]=3 524 B11R1.28 NCCOCC1=CC=CC=C1 Z271005946 [0,1,1,0,0,0|0,0,0]=2 525 B11R1.28 O=CCCCC1=CC=CC=C1 Z993017616 [0,1,1,0,0,0|1,0,0]=3 526 B11R1.28 O=CCOCC1=CC=CC=C1 Z906195396 [0,1,1,0,0,0|1,0,1]=4 527 B11R1.28 O=CCSCC1=CC=CC=C1 Z854102762 [0,1,1,0,0,0|1,0,1]=4 528 B11R1.28 OCCCNC1=CC=CC=C1 Z104584292 [0,1,1,0,0,0|1,0,0]=3 529 B11R1.28 OCCCNC1=CC=NC=C1 Z359301948 [0,1,1,0,0,0|2,0,0]=4 530 B11R1.28 OCCCNC1=NC=CC=C1 Z31220937 [0,1,1,0,0,0|2,0,0]=4 531 B11R1.28 OCCCSC1=CC=CC=C1 Z104650330 [0,1,1,0,0,0|1,0,0]=3 532 B11R1.28 OCCNCC1=CN=CC=C1 Z90504502 [0,1,1,0,0,0|2,0,0]=4 533 B11R1.28 OCCOCC1=CC=CC=C1 Z854223062 [0,1,1,0,0,0|1,0,0]=3 534 B11R1.28 S=C=NCCC1=CC=CC=C1 Z56924472 [0,1,1,0,0,0|1,0,1]=4 535 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [0,1,1,0,0,0|1,0,1]=4 536 B11R1.40 CC(C=O)CC1=CC=CC=C1 Z1198150055 [0,1,1,0,0,0|1,0,1]=4 537 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [0,1,1,0,0,0|1,0,0]=3 538 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [0,1,1,0,0,0|1,0,0]=3 539 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [0,1,1,0,0,0|1,0,0]=3 540 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [0,1,1,0,0,0|1,0,0]=3 541 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [0,1,1,0,0,0|1,0,0]=3 542 B11R1.40 CCC(O)CC1=CC=CC=C1 Z513749284 [0,1,1,0,0,0|1,0,0]=3 543 B11R1.40 CCC(O)CC1=CC=NC=C1 Z992409862 [0,1,1,0,0,0|2,0,0]=4 544 B11R1.40 CC[C@@H](O)CC1=CC=CC=C1 Z1262397064 [0,1,1,0,0,0|1,0,0]=3 545 B11R1.40 CC[C@H](O)CC1=CC=CC=C1 Z1262397065 [0,1,1,0,0,0|1,0,0]=3 546 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [0,1,1,0,0,0|1,0,0]=3 547 B11R1.40 NC(CO)CC1=CC=NC=C1 Z1824511267 [0,1,1,0,0,0|2,0,0]=4 548 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [0,1,1,0,0,0|0,0,1]=3 549 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [0,1,1,0,0,0|1,0,1]=4 550 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [0,1,1,0,0,0|0,0,0]=2 551 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [0,1,1,0,0,0|0,0,0]=2 552 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [0,1,1,0,0,0|0,0,0]=2 553 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [0,1,1,0,0,0|1,0,1]=4 554 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [0,1,1,0,0,0|1,0,0]=3 555 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [0,1,1,0,0,0|1,0,0]=3 556 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [0,1,1,0,0,0|1,0,1]=4 557 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [0,1,1,0,0,0|2,0,0]=4 558 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [0,1,1,0,0,0|0,0,0]=2 559 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [0,1,1,0,0,0|1,0,0]=3 560 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [0,1,1,0,0,0|2,0,0]=4 561 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [0,1,1,0,0,0|2,0,0]=4 562 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [0,1,1,0,0,0|0,0,0]=2 563 B11R1.91 FC(F)SCC1=CC=CC=C1 Z55626056 [0,1,1,0,0,0|2,0,0]=4 564 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [0,1,1,0,0,0|0,0,1]=3 565 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [0,1,1,0,0,0|1,0,1]=4 566 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [0,1,1,0,0,0|1,0,1]=4 567 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [0,1,1,0,0,0|1,0,1]=4 568 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [0,1,1,0,0,0|0,0,1]=3 569 B11R1.91 NC(=O)CCC1=CC=NC=C1 Z1095213378 [0,1,1,0,0,0|1,0,1]=4 570 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [0,1,1,0,0,0|1,0,1]=4 571 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [0,1,1,0,0,0|1,0,1]=4 572 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [0,1,1,0,0,0|1,0,1]=4 573 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [0,1,1,0,0,0|1,0,1]=4 574 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [0,1,1,0,0,0|1,0,1]=4 575 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [0,1,1,0,0,0|0,0,1]=3 576 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [0,1,1,0,0,0|1,0,1]=4 577 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [0,1,1,0,0,0|1,0,1]=4 578 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [0,1,1,0,0,0|1,0,1]=4 579 B11R1.91 O=[N+]([O-])CCC1=CC=CC=C1 Z995234780 [0,1,1,0,0,0|2,0,0]=4 580 B11R1.91 OB(O)CCC1=CC=CC=C1 Z1147227790 [0,1,1,0,0,0|2,0,0]=4 581 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,1,1,0,0,0|1,0,1]=4 582 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [0,1,1,0,0,0|1,0,0]=3 583 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [0,1,1,0,0,0|2,0,0]=4 584 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [0,1,1,0,0,0|2,0,0]=4 585 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [0,1,1,0,0,0|2,0,0]=4 586 B11R1.20 CC(C)OC1=CC=C(C=C1)Br Z53834735 [0,1,1,0,0,0|2,0,0]=4 587 B11R1.20 CC(C)OC1=CC=C(C=C1)I Z54181200 [0,1,1,0,0,0|2,0,0]=4 588 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,1,1,0,0,0|0,0,0]=2 589 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [0,1,1,0,0,0|1,0,1]=4 590 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [0,1,1,0,0,0|2,0,0]=4 591 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [0,1,1,0,0,0|2,0,0]=4 592 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [0,1,1,0,0,0|2,0,0]=4 593 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [0,1,1,0,0,0|1,0,1]=4 594 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [0,1,1,0,0,0|1,0,1]=4 595 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,1,1,0,0,0|1,0,1]=4 596 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,1,1,0,0,0|1,0,1]=4 597 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,1,1,0,0,0|1,0,1]=4 598 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,1,1,0,0,0|1,0,1]=4 599 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [0,1,1,0,0,0|1,0,1]=4 600 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [0,1,1,0,0,0|1,0,1]=4 601 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [0,1,1,0,0,0|1,0,1]=4 602 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [0,1,1,0,0,0|1,0,1]=4 603 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [0,1,1,0,0,0|1,0,1]=4 604 B11R1.86 CC(C)CC1=C(C=CC=C1)N Z1171158156 [0,1,1,0,0,0|1,0,0]=3 605 B11R1.86 CC(C)NC1=C(C=CC=C1)Br Z334939134 [0,1,1,0,0,0|2,0,0]=4 606 B11R1.86 CC(C)NC1=C(C=CC=C1)I Z362774390 [0,1,1,0,0,0|2,0,0]=4 607 B11R1.86 CC(C)OC1=C(C=CC=C1)Br Z54690481 [0,1,1,0,0,0|2,0,0]=4 608 B11R1.86 CC(C)OC1=C(C=CC=C1)Cl Z53833775 [0,1,1,0,0,0|2,0,0]=4 609 B11R1.86 CC(C)OC1=C(C=CC=C1)N Z239604736 [0,1,1,0,0,0|2,0,0]=4 610 B11R1.86 CC(C)SC1=C(C=CC=C1)N Z316174692 [0,1,1,0,0,0|2,0,0]=4 611 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [0,1,1,0,0,0|0,0,0]=2 612 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [0,1,1,0,0,0|0,0,0]=2 613 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [0,1,1,0,0,0|1,0,1]=4 614 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [0,1,1,0,0,0|1,0,1]=4 615 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [0,1,1,0,0,0|0,0,0]=2 616 B11R1.86 CC1=C(C=CC=C1)NC(C)C Z267168760 [0,1,1,0,0,0|2,0,0]=4 617 B11R1.86 CC1=C(C=CN=C1)CC(C)N Z4926043046 [0,1,1,0,0,0|1,0,0]=3 618 B11R1.86 CN(C)CC1=C(C=CC=C1)Cl Z54750062 [0,1,1,0,0,0|2,0,0]=4 619 B11R1.86 CN(C)CC1=C(C=CC=C1)N Z285162890 [0,1,1,0,0,0|2,0,0]=4 620 B11R1.86 CS(=O)CC1=C(C=CC=C1)N Z802580910 [0,1,1,0,0,0|2,0,0]=4 621 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [0,1,1,0,0,0|1,0,1]=4 622 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [0,1,1,0,0,0|1,0,1]=4 623 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [0,1,1,0,0,0|1,0,1]=4 624 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [0,1,1,0,0,0|1,0,1]=4 625 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [0,1,1,0,0,0|1,0,1]=4 626 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [0,1,1,0,0,0|1,0,1]=4 627 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [0,1,1,0,0,0|1,0,1]=4 628 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [0,1,1,0,0,0|1,0,1]=4 629 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [0,1,1,0,0,0|1,0,1]=4 630 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [0,1,1,0,0,0|1,0,0]=3 631 B11R1.157 CC(C)CC1=CC(=NC=C1)N Z1197889925 [0,1,1,0,0,0|2,0,0]=4 632 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [0,1,1,0,0,0|2,0,0]=4 633 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [0,1,1,0,0,0|2,0,0]=4 634 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [0,1,1,0,0,0|2,0,0]=4 635 B11R1.157 CC(C)OC1=CC(=CC=C1)Br Z53833977 [0,1,1,0,0,0|2,0,0]=4 636 B11R1.157 CC(C)OC1=CC(=CC=C1)N Z239604760 [0,1,1,0,0,0|2,0,0]=4 637 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [0,1,1,0,0,0|2,0,0]=4 638 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [0,1,1,0,0,0|0,0,0]=2 639 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [0,1,1,0,0,0|0,0,0]=2 640 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [0,1,1,0,0,0|0,0,0]=2 641 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [0,1,1,0,0,0|1,0,0]=3 642 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [0,1,1,0,0,0|2,0,0]=4 643 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [0,1,1,0,0,0|2,0,0]=4 644 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [0,1,1,0,0,0|1,0,1]=4 645 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [0,1,1,0,0,0|1,0,1]=4 646 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [0,1,1,0,0,0|1,0,1]=4 647 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [0,1,1,0,0,0|1,0,1]=4 648 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [0,1,1,0,0,0|1,0,1]=4 649 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [0,1,1,0,0,0|2,0,0]=4 650 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [0,1,1,0,0,0|2,0,0]=4 651 B11R2.34 BrC1=CC=C(C=C1)C2CO2 Z278165164 [1,1,0,0,0,0|1,0,0]=3 652 B11R2.34 BrC1=CC=C(C=C1)[C@@H]2CO2 Z1198177141 [1,1,0,0,0,0|1,0,0]=3 653 B11R2.34 BrC1=CC=C(C=C1)[C@H]2CO2 Z1198177142 [1,1,0,0,0,0|1,0,0]=3 654 B11R2.34 BrC1=CN=C(C=C1)C2CC2 Z2943484009 [1,1,0,0,0,0|1,0,0]=3 655 B11R2.34 BrC1=NC=C(C=N1)C2CC2 Z1255375372 [1,1,0,0,0,0|2,0,0]=4 656 B11R2.34 BrC1=NC=C(N=C1)C2CC2 Z1198319306 [1,1,0,0,0,0|2,0,0]=4 657 B11R2.34 CC1=CC=C(C=C1)C2CO2 Z278165170 [1,1,0,0,0,0|1,0,0]=3 658 B11R2.34 CC1=NC=C(C=C1)C2CO2 Z1504684436 [1,1,0,0,0,0|2,0,0]=4 659 B11R2.34 ClC1=CC=C(C=C1)C2CO2 Z274971352 [1,1,0,0,0,0|1,0,0]=3 660 B11R2.34 ClC1=CC=C(C=C1)[C@@H]2CO2 Z1255450845 [1,1,0,0,0,0|1,0,0]=3 661 B11R2.34 ClC1=CC=C(C=C1)[C@H]2CO2 Z1198173162 [1,1,0,0,0,0|1,0,0]=3 662 B11R2.34 ClC1=NC=C(C=N1)C2CC2 Z1255437429 [1,1,0,0,0,0|2,0,0]=4 663 B11R2.34 ClC1=NN=C(C=C1)C2CC2 Z1013743432 [1,1,0,0,0,0|2,0,0]=4 664 B11R2.34 FC1=CC=C(C=C1)C2CO2 Z238878272 [1,1,0,0,0,0|1,0,0]=3 665 B11R2.34 FC1=CC=C(C=C1)[C@@H]2CO2 Z1255365381 [1,1,0,0,0,0|1,0,0]=3 666 B11R2.34 FC1=CC=C(C=C1)[C@H]2CO2 Z1255356921 [1,1,0,0,0,0|1,0,0]=3 667 B11R2.34 FC1=CN=C(C=C1)C2CO2 Z1575327880 [1,1,0,0,0,0|2,0,0]=4 668 B11R2.34 NC1=CN=C(N=C1)C2CC2 Z381402574 [1,1,0,0,0,0|2,0,0]=4 669 B11R2.34 NC1=NC=C(C=N1)C2CC2 Z1255436540 [1,1,0,0,0,0|2,0,0]=4 670 B11R2.34 NC1=NN=C(C=C1)C2CC2 Z1013744036 [1,1,0,0,0,0|2,0,0]=4 671 B11R2.34 O=C1C=CC(=NN1)C2CC2 Z1013742704 [1,1,0,0,0,0|2,0,0]=4 672 B11R2.34 OC1=CN=C(N=C1)C2CC2 Z1255433581 [1,1,0,0,0,0|2,0,0]=4 673 B11R2.35 BrC1=CC(=CC=C1)C2CO2 Z278165168 [1,1,0,0,0,0|1,0,0]=3 674 B11R2.35 BrC1=CC(=CC=C1)[C@@H]2CO2 Z1575341746 [1,1,0,0,0,0|1,0,0]=3 675 B11R2.35 BrC1=CC(=CC=C1)[C@H]2CO2 Z1575341859 [1,1,0,0,0,0|1,0,0]=3 676 B11R2.35 BrC1=NC=NC(=C1)C2CC2 Z1198319302 [1,1,0,0,0,0|2,0,0]=4 677 B11R2.35 CC1=CC(=CC=C1)C2CO2 Z802853588 [1,1,0,0,0,0|1,0,0]=3 678 B11R2.35 ClC1=CC(=CC=C1)C2CO2 Z278165232 [1,1,0,0,0,0|1,0,0]=3 679 B11R2.35 ClC1=CC(=CC=C1)[C@@H]2CO2 Z1255457905 [1,1,0,0,0,0|1,0,0]=3 680 B11R2.35 ClC1=CC(=NC=C1)C2CC2 Z4714470389 [1,1,0,0,0,0|1,0,0]=3 681 B11R2.35 ClC1=NC(=CC=C1)C2CO2 Z3271515213 [1,1,0,0,0,0|2,0,0]=4 682 B11R2.35 ClC1=NC(=CC=N1)C2CC2 Z1198234901 [1,1,0,0,0,0|2,0,0]=4 683 B11R2.35 ClC1=NC(=NC=C1)C2CC2 Z445153110 [1,1,0,0,0,0|2,0,0]=4 684 B11R2.35 ClC1=NC=NC(=C1)C2CC2 Z1124752380 [1,1,0,0,0,0|2,0,0]=4 685 B11R2.35 FC1=CC(=CC=C1)C2CO2 Z283685748 [1,1,0,0,0,0|1,0,0]=3 686 B11R2.35 NC1=CC(=CC=C1)C2CC2 Z992239700 [1,1,0,0,0,0|0,0,0]=2 687 B11R2.35 NC1=CC(=CN=C1)C2CC2 Z4513216590 [1,1,0,0,0,0|1,0,0]=3 688 B11R2.35 NC1=NC(=CC=N1)C2CC2 Z991536704 [1,1,0,0,0,0|2,0,0]=4 689 B11R2.35 NC1=NC(=NC=C1)C2CC2 Z856211350 [1,1,0,0,0,0|2,0,0]=4 690 B11R2.35 NC1=NC=CC(=C1)C2CC2 Z1255428514 [1,1,0,0,0,0|1,0,0]=3 691 B11R2.35 O=C1C=COC(=C1)C2CC2 Z4461966095 [1,1,0,0,0,0|1,0,0]=3 692 B11R2.35 O=C1N=C(C=CN1)C2CC2 Z1203747698 [1,1,0,0,0,0|2,0,0]=4 693 B11R2.35 OC1=CC(=CC=C1)C2CC2 Z1198170922 [1,1,0,0,0,0|0,0,0]=2 694 B11R2.35 OC1=CC(=NC=C1)C2CC2 Z1255493056 [1,1,0,0,0,0|1,0,0]=3 695 B11R2.35 OC1=NC(=NC=C1)C2CC2 Z1259335801 [1,1,0,0,0,0|2,0,0]=4 696 B11R2.40 CC1(CO1)C2=CC=CC=C2 Z813010616 [1,1,0,0,0,0|1,0,0]=3 697 B11R2.40 NC1(CC1)C2=CC=CC=C2 Z1262398449 [1,1,0,0,0,0|0,0,0]=2 698 B11R2.40 NC1(CC1)C2=CC=NC=C2 Z3244521572 [1,1,0,0,0,0|1,0,0]=3 699 B11R2.40 NC1(CC1)C2=CN=CC=C2 Z3241265434 [1,1,0,0,0,0|1,0,0]=3 700 B11R2.40 NC1(CC1)C2=NC=CC=C2 Z995042286 [1,1,0,0,0,0|1,0,0]=3 701 B11R2.40 NC1(CC1)C2=NC=CC=N2 Z3243412657 [1,1,0,0,0,0|2,0,0]=4 702 B11R2.55 BrC1=C(C=CC=C1)C2CO2 Z278165218 [1,1,0,0,0,0|1,0,0]=3 703 B11R2.55 CC1=C(C=CC=C1)C2CO2 Z278165272 [1,1,0,0,0,0|1,0,0]=3 704 B11R2.55 ClC1=C(C=CC=C1)C2CO2 Z278165192 [1,1,0,0,0,0|1,0,0]=3 705 B11R2.55 ClC1=C(C=CC=C1)[C@@H]2CO2 Z1575341712 [1,1,0,0,0,0|1,0,0]=3 706 B11R2.55 ClC1=C(C=CC=C1)[C@H]2CO2 Z1575341825 [1,1,0,0,0,0|1,0,0]=3 707 B11R2.55 FC1=C(C=CC=C1)C2CO2 Z278165212 [1,1,0,0,0,0|1,0,0]=3 708 B11R2.55 FC1=C(C=CC=C1)[C@@H]2CO2 Z1575341650 [1,1,0,0,0,0|1,0,0]=3 709 B11R2.55 NC1=C(C=CC=C1)C2CC2 Z336079888 [1,1,0,0,0,0|0,0,0]=2 710 B11R2.55 NC1=C(C=CC=N1)C2CC2 Z4496948738 [1,1,0,0,0,0|1,0,0]=3 711 B11R2.55 NC1=C(C=CN=C1)C2CC2 Z3681316846 [1,1,0,0,0,0|1,0,0]=3 712 B11R2.55 NC1=C(C=NC=C1)C2CC2 Z4521980438 [1,1,0,0,0,0|1,0,0]=3 713 B11R2.55 NC1=C(N=CC=C1)C2CC2 Z1521319401 [1,1,0,0,0,0|1,0,0]=3 714 B11R2.55 NC1=C(N=CC=N1)C2CC2 Z1203653375 [1,1,0,0,0,0|2,0,0]=4 715 B11R2.32 O=C[C@@H]1C[C@H]1C2=CC=CO2 Z3581743888 [0,1,0,0,1,0|2,0,0]=4 716 B11R2.32 O=C[C@@H]1C[C@H]1C2=CC=CS2 Z3581757674 [0,1,0,0,1,0|2,0,0]=4 717 B11R2.32 O=C[C@@H]1C[C@H]1C2=CSC=C2 Z3581743841 [0,1,0,0,1,0|2,0,0]=4 718 B11R2.33 CN1C=CC(=N1)[C@@H]2C[C@H]2N Z3172965524 [0,1,0,0,1,0|2,0,0]=4 719 B11R2.50 CC1CC1(N)C2=CC=CS2 Z5630149745 [0,1,0,0,1,0|2,0,0]=4 720 B11R2.51 CN1C=NC=C1[C@@H]2C[C@H]2N Z2239018648 [0,1,0,0,1,0|2,0,0]=4 721 B11R2.51 CN1N=CC=C1[C@@H]2C[C@H]2N Z3483425410 [0,1,0,0,1,0|2,0,0]=4 722 B13R2.50 NC[C@@H]1C[C@H]1CC2=CC=CC=C2 Z3013803470 [0,1,0,0,0,1|0,0,0]=2 723 B13R2.197 C[C@@H]1C[C@@]1(N)CC2=CC=CC=C2 Z3487486148 [0,1,0,0,0,1|1,0,0]=3 724 B13R2.382 CC1CC1C(N)C2=CC=CC=C2 Z1695797918 [0,1,0,0,0,1|1,0,0]=3 725 B13R2.52 CNC1CC(C1)C2=CC=CC=C2 Z444333842 [0,1,0,0,0,1|0,0,0]=2 726 B13R2.147 CC1=CC=C(C=C1)C2CC(=O)N2 Z1238837490 [0,1,0,0,0,1|1,0,1]=4 727 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)Br Z1696091784 [0,1,0,0,0,1|0,0,0]=2 728 B13R2.147 NC1CC(C1)C2=CC=C(C=C2)F Z1266854912 [0,1,0,0,0,1|0,0,0]=2 729 B13R2.147 N[C@H]1C[C@@H](C1)C2=CC=C(C=C2)Cl Z1947189743 [0,1,0,0,0,1|0,0,0]=2 730 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)Br Z385459408 [0,1,0,0,0,1|1,0,1]=4 731 B13R2.147 O=C1CC(C1)C2=CC=C(C=C2)F Z444338412 [0,1,0,0,0,1|1,0,1]=4 732 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)Br Z1238837631 [0,1,0,0,0,1|1,0,1]=4 733 B13R2.147 O=C1CC(N1)C2=CC=C(C=C2)Cl Z1198168152 [0,1,0,0,0,1|1,0,1]=4 734 B13R2.147 OC1CC(C1)C2=CC=C(C=C2)Br Z501748690 [0,1,0,0,0,1|1,0,0]=3 735 B13R2.151 CC1=CC(=CC=C1)C2CC(=O)C2 Z444344078 [0,1,0,0,0,1|1,0,1]=4 736 B13R2.151 CC1=CC(=CC=C1)[C@H]2C[C@@H](C2)N Z1954242338 [0,1,0,0,0,1|0,0,0]=2 737 B13R2.151 NC1CC(C1)C2=CC(=CC=C2)Cl Z1262327397 [0,1,0,0,0,1|0,0,0]=2 738 B13R2.151 N[C@H]1C[C@@H](C1)C2=CC(=CC=C2)Br Z3088779932 [0,1,0,0,0,1|0,0,0]=2 739 B13R2.151 O=C1CC(N1)C2=CC=CC(=C2)Br Z1238837585 [0,1,0,0,0,1|1,0,1]=4 740 B13R2.151 O=C1CC(N1)C2=CC=CC(=C2)O Z3227055565 [0,1,0,0,0,1|1,0,1]=4 741 B13R2.216 CC1=C(C=CC=C1)C2CC(=O)C2 Z444348616 [0,1,0,0,0,1|1,0,1]=4 742 B13R2.216 NC1CC(C1)C2=C(C=CC=C2)Br Z1696091632 [0,1,0,0,0,1|0,0,0]=2 743 B13R2.216 NC1CC(C1)C2=C(C=CC=C2)Cl Z1255523422 [0,1,0,0,0,1|0,0,0]=2 744 B13R2.216 NC1CC(C1)C2=C(C=CC=C2)F Z1259339076 [0,1,0,0,0,1|0,0,0]=2 745 B13R2.216 O=C1CC(C1)C2=C(C=CC=C2)Cl Z444350246 [0,1,0,0,0,1|1,0,1]=4 746 B13R2.216 O=C1CC(C1)C2=C(C=CC=C2)F Z444349348 [0,1,0,0,0,1|1,0,1]=4 747 B13R2.216 O=C1CC(N1)C2=C(C=CC=C2)Cl Z1198168153 [0,1,0,0,0,1|1,0,1]=4 748 B13R2.216 O[C@H]1C[C@H](C1)C2=C(C=CC=C2)F Z2111077766 [0,1,0,0,0,1|1,0,0]=3 749 B13R2.238 CC1(CC(=O)C1)C2=CC=CC=C2 Z1123697907 [0,1,0,0,0,1|1,0,1]=4 750 B13R2.238 CC1(CC(C1)N)C2=CC=CC=C2 Z1126749018 [0,1,0,0,0,1|0,0,0]=2 751 B13R2.238 CC1CC(C1)(N)C2=CC=CC=C2 Z4631703126 [0,1,0,0,0,1|1,0,0]=3 752 B13R2.238 N[C@@]1(C[C@@H](C1)O)C2=CC=CC=C2 Z2791095871 [0,1,0,0,0,1|1,0,0]=3 753 B13R2.238 N[C@H]1C[C@](C1)(O)C2=CC=NC=C2 Z5229156075 [0,1,0,0,0,1|1,0,0]=3 754 B13R2.238 N[C@H]1C[C@](C1)(O)C2=CN=CC=C2 Z5219131819 [0,1,0,0,0,1|1,0,0]=3 755 B13R2.373 CC1C(=O)CC1C2=CC=CC=C2 Z1436543792 [0,1,0,0,0,1|1,0,1]=4 756 B13R2.373 CC1C(=O)NC1C2=CC=CC=C2 Z1267861070 [0,1,0,0,0,1|1,0,1]=4 757 B13R2.373 CC1C(CC1C2=CC=CC=C2)N Z1430540182 [0,1,0,0,0,1|0,0,0]=2 758 B13R2.373 NC1CN(C1=O)C2=CC=CC=C2 Z1891776032 [0,1,0,0,0,1|1,0,0]=3 759 B13R2.56 NCC1CCC1C2=CC=CC=C2 Z4003034803 [0,1,0,0,0,1|0,0,0]=2 760 B13R2.56 O=CC1CCC1C2=CC=CC=C2 Z1509045454 [0,1,0,0,0,1|1,0,0]=3 761 B13R2.56 OC[C@@H]1NC[C@H]1C2=CC=CC=C2 Z3691037314 [0,1,0,0,0,1|1,0,0]=3 762 B13R2.146 CC1CCN1C2=CC=C(C=C2)Br Z1464058881 [0,1,0,0,0,1|2,0,0]=4 763 B13R2.215 NC1CCC1C2=C(C=CC=C2)Cl Z1695906760 [0,1,0,0,0,1|0,0,0]=2 764 B13R2.219 CC1(CNC1C2=CN=CC=C2)C Z2158468705 [0,1,0,0,0,1|2,0,0]=4 765 B13R2.413 CC1(CCC1N)C2=CC=CC=C2 Z1813195198 [0,1,0,0,0,1|0,0,0]=2 766 B13R2.25 O=C=NC1CC1C2=CC=CC=C2 Z1094720198 [0,2,0,0,0,0|0,0,1]=3 767 B13R2.25 O=CC[C@@H]1C[C@H]1C2=CC=CC=C2 Z2582231304 [0,2,0,0,0,0|1,0,0]=3 768 B13R2.42 NC[C@@H]1C[C@H]1C2=CC=C(C=C2)F Z2286737527 [0,2,0,0,0,0|0,0,0]=2 769 B13R2.42 O=CC1CC1C2=CC=C(C=C2)F Z1255463273 [0,2,0,0,0,0|1,0,0]=3 770 B13R2.42 O=C[C@@H]1C[C@H]1C2=CC=C(C=C2)F Z2307166680 [0,2,0,0,0,0|1,0,0]=3 771 B13R2.98 C[C@@]1(C[C@@H]1C2=CC=CC=C2)C=O Z2289709429 [0,2,0,0,0,0|1,0,0]=3 772 B13R2.98 C[C@]1(C[C@H]1C2=CC=CC=C2)CN Z2216303059 [0,2,0,0,0,0|0,0,0]=2 773 B13R2.98 C[C@]1(C[C@H]1C2=CC=CC=C2)CO Z2467454648 [0,2,0,0,0,0|1,0,0]=3 774 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 Z1198162290 [0,2,0,0,0,0|1,0,0]=3 775 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 Z2235584851 [0,2,0,0,0,0|1,0,0]=3 776 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=NC=C2 Z2379204261 [0,2,0,0,0,0|2,0,0]=4 777 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CN=CC=C2 Z2242045438 [0,2,0,0,0,0|2,0,0]=4 778 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=NC=CC=C2 Z3070727223 [0,2,0,0,0,0|2,0,0]=4 779 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 Z1235967724 [0,2,0,0,0,0|1,0,0]=3 780 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 Z1262510970 [0,2,0,0,0,0|1,0,0]=3 781 B13R2.423 O=C([O-])C1OC1C2=CC=CC=C2 Z57931417 [0,2,0,0,0,0|2,0,0]=4 782 B13R2.16 COC1=CC=C(C=C1)C2OC2C Z278165290 [0,2,0,0,0,0|2,0,0]=4 783 B13R2.16 COC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2298098001 [0,2,0,0,0,0|0,0,0]=2 784 B13R2.16 COC1=CC=C(C=C1)[C@@H]2O[C@H]2C Z2527564242 [0,2,0,0,0,0|2,0,0]=4 785 B13R2.522 CC1=C(C=C(C=C1)C2CC2N)C Z234897043 [0,2,0,0,0,0|0,0,0]=2 786 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)Cl Z2298098026 [0,2,0,0,0,0|0,0,0]=2 787 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)F Z2298098037 [0,2,0,0,0,0|0,0,0]=2 788 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)F)F Z2298098006 [0,2,0,0,0,0|0,0,0]=2 789 B13R2.2987 CC1(CC1N)C2=CC=C(C=C2)F Z1695926070 [0,2,0,0,0,0|0,0,0]=2 790 B13R2.2988 NC1=CC=C(C=C1)C2CC2(F)F Z3401936800 [0,2,0,0,0,0|1,0,0]=3 791 B13R2.2988 OC1=CC=C(C=C1)C2CC2(F)F Z1513871465 [0,2,0,0,0,0|1,0,0]=3 792 B13R2.5399 CC1=CC(=C(C=C1)[C@@H]2C[C@H]2N)Br Z4670281105 [0,2,0,0,0,0|0,0,0]=2 793 B13R2.5399 N[C@@H]1C[C@H]1C2=C(C=C(C=C2)Cl)Cl Z2298098028 [0,2,0,0,0,0|0,0,0]=2 794 B13R2.5399 N[C@@H]1C[C@H]1C2=C(C=C(C=C2)F)F Z2298098010 [0,2,0,0,0,0|0,0,0]=2 795 B13R2.81 COC1=CC(=CC=C1)[C@@H]2C[C@H]2N Z2236704792 [0,2,0,0,0,0|0,0,0]=2 796 B13R2.154 N[C@@H]1C[C@H]1C2=C(C(=CC=C2)Cl)Cl Z2298098020 [0,2,0,0,0,0|0,0,0]=2 797 B13R2.154 N[C@@H]1C[C@H]1C2=C(C(=CC=C2)F)F Z2298098033 [0,2,0,0,0,0|0,0,0]=2 798 B13R2.2964 N[C@@H]1C[C@H]1C2=CC(=CC(=C2)Br)Br Z4750771031 [0,2,0,0,0,0|0,0,0]=2 799 B13R2.2964 N[C@@H]1C[C@H]1C2=CC(=CC(=C2)Cl)Cl Z3317292635 [0,2,0,0,0,0|0,0,0]=2 800 B13R2.3019 CC1(CC1N)C2=CC(=CC=C2)F Z1695926124 [0,2,0,0,0,0|0,0,0]=2 801 B13R2.3020 NC1=CC(=CC=C1)C2CC2(F)F Z3205555898 [0,2,0,0,0,0|1,0,0]=3 802 B13R2.3127 N[C@@H]1C[C@H]1C2=C(C=CC(=C2)F)F Z2298098032 [0,2,0,0,0,0|0,0,0]=2 803 B13R2.3201 NC1(CC1(F)F)C2=CC=CC=C2 Z1509454599 [0,2,0,0,0,0|1,0,0]=3 804 B13R2.3571 NC1=C(C=CC=C1)C2CC2(F)F Z2732502421 [0,2,0,0,0,0|1,0,0]=3 805 B13R2.92 COC1=C(C=CC=C1)C2CC2N Z1263820289 [0,2,0,0,0,0|0,0,0]=2 806 B13R2.3570 CC1(CC1N)C2=C(C=CC=C2)Cl Z1250132353 [0,2,0,0,0,0|0,0,0]=2 807 B13R2.3570 CC1(CC1N)C2=C(C=CC=C2)F Z1259162122 [0,2,0,0,0,0|0,0,0]=2 808 B13R2.3570 CC1=C(C=CC=C1)C2(CC2N)C Z1259162043 [0,2,0,0,0,0|0,0,0]=2 809 B13R2.5332 N[C@@H]1C[C@H]1C2=C(C=CC=C2Cl)Cl Z2286637159 [0,2,0,0,0,0|0,0,0]=2 810 B13R2.5332 N[C@@H]1C[C@H]1C2=C(C=CC=C2F)Br Z3352684529 [0,2,0,0,0,0|0,0,0]=2 811 B13R2.5332 N[C@@H]1C[C@H]1C2=C(C=CC=C2F)Cl Z2286637161 [0,2,0,0,0,0|0,0,0]=2 812 B11R2.1 CC1=CNC2=C1C=CC=C2 Z415653134 [0,0,1,1,0,0|0,0,2]=4 813 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [0,0,1,1,0,0|0,0,0]=2 814 B11R2.1 CC1CNC2=C1C=CN=C2 Z3400245703 [0,0,1,1,0,0|1,0,0]=3 815 B11R2.1 CC1CNC2=C1N=CC=C2 Z3464420345 [0,0,1,1,0,0|1,0,0]=3 816 B11R2.1 CC1NCC2=C1C=CC=C2 Z1203731964 [0,0,1,1,0,0|2,0,0]=4 817 B11R2.1 NC1CCC2=C1C=CC=C2 Z168884748 [0,0,1,1,0,0|2,0,0]=4 818 B11R2.1 NC1CSC2=C1C=CC=C2 Z431544668 [0,0,1,1,0,0|2,0,0]=4 819 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 Z1741972748 [0,0,1,1,0,0|2,0,0]=4 820 B11R2.1 OC1COC2=C1C=CC=C2 Z1267884639 [0,0,1,1,0,0|2,0,0]=4 821 B11R2.1 O[C@@H]1CSC2=C1C=CC=C2 Z1438326029 [0,0,1,1,0,0|2,0,0]=4 822 B11R2.239 C1=CC(=NC=N1)C2CNC2 Z3244818217 [0,0,1,1,0,0|2,0,0]=4 823 B11R2.239 C1=CC=C(C=C1)C2CCN2 Z359510120 [0,0,1,1,0,0|2,0,0]=4 824 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [0,0,1,1,0,0|0,0,0]=2 825 B11R2.20 C1=CC2=C(C=C1)CCC=C2 Z237493310 [0,0,1,1,0,0|1,0,1]=4 826 B11R2.20 C1=CC2=C(C=C1)CNCC2 Z57834231 [0,0,1,1,0,0|2,0,0]=4 827 B11R2.20 C1=CC2=C(C=C1)COCC2 Z756090080 [0,0,1,1,0,0|2,0,0]=4 828 B11R2.20 C1=CC2=C(C=C1)OCCC2 Z728136016 [0,0,1,1,0,0|1,0,0]=3 829 B11R2.20 C1=CC2=C(C=C1)OCCN2 Z228584850 [0,0,1,1,0,0|1,0,0]=3 830 B11R2.20 C1=CC2=C(C=C1)SCCN2 Z56943460 [0,0,1,1,0,0|1,0,0]=3 831 B11R2.20 C1=CC2=C(C=N1)CCCC2 Z104492180 [0,0,1,1,0,0|2,0,0]=4 832 B11R2.20 C1=CC2=C(C=N1)NCCC2 Z3243651200 [0,0,1,1,0,0|1,0,0]=3 833 B11R2.20 C1=CC2=C(C=N1)NCCN2 Z1203732990 [0,0,1,1,0,0|2,0,0]=4 834 B11R2.20 C1=CC2=C(C=N1)NCCO2 Z2217033032 [0,0,1,1,0,0|2,0,0]=4 835 B11R2.20 C1=CC2=C(CCCC2)N=C1 Z1201617100 [0,0,1,1,0,0|2,0,0]=4 836 B11R2.20 C1=CC2=C(CCCN2)N=C1 Z212053854 [0,0,1,1,0,0|1,0,0]=3 837 B11R2.20 C1=CC2=C(N=C1)NCCC2 Z1198176448 [0,0,1,1,0,0|1,0,0]=3 838 B11R2.20 C1=CC2=C(N=C1)NCCN2 Z1198175971 [0,0,1,1,0,0|2,0,0]=4 839 B11R2.20 C1=CC2=C(N=C1)OCCN2 Z1201624799 [0,0,1,1,0,0|2,0,0]=4 840 B11R2.238 C1=CC=C(C=C1)CC2CO2 Z1020680006 [0,0,1,1,0,0|1,0,0]=3 841 B11R2.238 C1=CC=C(C=C1)C[C@@H]2CO2 Z1617991494 [0,0,1,1,0,0|1,0,0]=3 842 B11R2.238 C1=CC=C(C=C1)C[C@H]2CO2 Z2216712384 [0,0,1,1,0,0|1,0,0]=3 843 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [0,0,1,1,0,0|2,0,0]=4 844 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [0,0,1,1,0,0|1,0,1]=4 845 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,0,1,1,0,0|0,0,0]=2 846 B11R2.10 CC1CC2=C(N1)C=CN=C2 Z1203822742 [0,0,1,1,0,0|1,0,0]=3 847 B11R2.10 CC1CC2=C(O1)C=CC=C2 Z104378304 [0,0,1,1,0,0|1,0,0]=3 848 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [0,0,1,1,0,0|1,0,1]=4 849 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,0,1,1,0,0|0,0,0]=2 850 B11R2.10 NC1CC2=C(C1)C=NC=C2 Z2238944796 [0,0,1,1,0,0|1,0,0]=3 851 B11R2.10 NC1CC2=C(C1)N=CC=C2 Z3069017080 [0,0,1,1,0,0|1,0,0]=3 852 B11R2.10 NC1CC2=C(C1)N=CC=N2 Z4953585301 [0,0,1,1,0,0|2,0,0]=4 853 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [0,0,1,1,0,0|1,0,1]=4 854 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [0,0,1,1,0,0|1,0,1]=4 855 B13R3.3800 N[C@@H]1[C@@H]2[C@H]1C3=C(C2)C=CC=C3 Z2888819437 [0,0,0,1,0,1|0,0,0]=2 856 B13R3.28 C1=CC2=C(C=C1)[C@@H]3O[C@@H]3CC2 Z3177279256 [0,1,0,1,0,0|2,0,0]=4 857 B13R3.213 ClC1=CC2=C(C=C1)CC3C2O3 Z1198182425 [0,1,0,1,0,0|2,0,0]=4 858 B9R1.11 CC(CN)C1=CC=CS1 Z803101386 [0,0,1,0,1,0|1,0,0]=3 859 B9R1.11 CC(CN)C1=CN=CN1 Z2865711302 [0,0,1,0,1,0|2,0,0]=4 860 B9R1.11 CC(CN)C1=NC=CN1 Z3205686355 [0,0,1,0,1,0|2,0,0]=4 861 B9R1.11 CC(CN)C1=NC=CS1 Z994266314 [0,0,1,0,1,0|2,0,0]=4 862 B9R1.11 NCC(O)C1=COC=C1 Z1198261509 [0,0,1,0,1,0|2,0,0]=4 863 B9R1.11 NCC(O)C1=CSC=C1 Z330910460 [0,0,1,0,1,0|2,0,0]=4 864 B9R1.12 NCCCC1=CC=NN1 Z2895332060 [0,0,1,0,1,0|2,0,0]=4 865 B9R1.12 NCCCC1=CNC=N1 Z2574933947 [0,0,1,0,1,0|2,0,0]=4 866 B9R1.12 NCCCC1=CNN=C1 Z2106603664 [0,0,1,0,1,0|2,0,0]=4 867 B9R1.12 NCCCC1=CON=C1 Z3022047352 [0,0,1,0,1,0|2,0,0]=4 868 B9R1.12 NCCCC1=NC=CN1 Z3244743443 [0,0,1,0,1,0|2,0,0]=4 869 B9R1.12 NCCCC1=NC=CO1 Z4966451613 [0,0,1,0,1,0|2,0,0]=4 870 B9R1.12 NCCCC1=NC=CS1 Z1263529635 [0,0,1,0,1,0|2,0,0]=4 871 B9R1.12 NCCCN1C=CC=C1 Z600497510 [0,0,1,0,1,0|1,0,0]=3 872 B9R1.12 NCCCN1C=CC=N1 Z271005716 [0,0,1,0,1,0|2,0,0]=4 873 B9R1.12 OCCCC1=COC=C1 Z1198265634 [0,0,1,0,1,0|2,0,0]=4 874 B9R1.12 OCCCC1=CSC=C1 Z993012564 [0,0,1,0,1,0|2,0,0]=4 875 B9R1.13 CC(N)CC1=CC=CO1 Z285143986 [0,0,1,0,1,0|1,0,0]=3 876 B9R1.13 CC(N)CC1=CC=CS1 Z1160899518 [0,0,1,0,1,0|1,0,0]=3 877 B9R1.13 CC(N)CC1=CNN=C1 Z5233405251 [0,0,1,0,1,0|2,0,0]=4 878 B9R1.13 CC(N)CC1=COC=C1 Z1098234443 [0,0,1,0,1,0|1,0,0]=3 879 B9R1.13 CC(N)CN1C=CC=N1 Z271011614 [0,0,1,0,1,0|2,0,0]=4 880 B9R1.13 CC(N)CN1C=CN=C1 Z271011862 [0,0,1,0,1,0|2,0,0]=4 881 B9R2.2 C1=CC(=CS1)C2CO2 Z954550900 [1,0,0,0,1,0|2,0,0]=4 882 B9R2.2 C1=CC(=NN1)C2CC2 Z336080424 [1,0,0,0,1,0|2,0,0]=4 883 B11R2.11 NC1CC(C1)N2C=CC=N2 Z3481962608 [0,0,0,0,1,1|2,0,0]=4 884 B11R2.11 NC1CC(C1)N2C=CN=C2 Z3485357187 [0,0,0,0,1,1|2,0,0]=4 885 B11R2.11 N[C@H]1C[C@@H](C1)C2=NC=CN2 Z4004062876 [0,0,0,0,1,1|2,0,0]=4 886 B11R2.11 N[C@H]1C[C@@H](C1)C2=NOC=C2 Z4438672599 [0,0,0,0,1,1|2,0,0]=4 887 B11R2.11 N[C@H]1C[C@@H](C1)N2C=CC=N2 Z3481345929 [0,0,0,0,1,1|2,0,0]=4 888 B11R2.11 N[C@H]1C[C@H](C1)N2C=CC=N2 Z4130645042 [0,0,0,0,1,1|2,0,0]=4 889 B13R2.31 NC1CC(C1)NC2=CC=CC=C2 Z2753743538 [0,0,0,0,0,2|0,0,0]=2 890 B13R2.31 N[C@H]1C[C@@H](C1)CC2=CC=CC=C2 Z5336692620 [0,0,0,0,0,2|0,0,0]=2 891 B13R2.31 O=C1CC(N1)CC2=CC=CC=C2 Z1198168168 [0,0,0,0,0,2|1,0,1]=4 892 B13R2.31 OC1CC(C1)CC2=CC=CC=C2 Z1551917814 [0,0,0,0,0,2|1,0,0]=3 893 B13R2.31 O[C@H]1C[C@H](C1)SC2=CC=CC=C2 Z2690875271 [0,0,0,0,0,2|1,0,0]=3 894 B13R2.10 CC1CC(CN1)C2=CC=CC=C2 Z1203620755 [0,0,0,0,0,2|1,0,0]=3 895 B13R2.10 FC1CNC(C1)C2=CC=CC=C2 Z2732815726 [0,0,0,0,0,2|1,0,0]=3 896 B13R2.10 NC1=NC(CO1)C2=CC=CC=C2 Z1262629910 [0,0,0,0,0,2|0,0,1]=3 897 B13R2.10 NC1=NCC(N1)C2=CC=CC=C2 Z4461628926 [0,0,0,0,0,2|0,0,1]=3 898 B13R2.10 NC1=NN(CC1)C2=CC=CC=C2 Z57473788 [0,0,0,0,0,2|1,0,1]=4 899 B13R2.10 NC1CCC(C1)C2=CC=CC=C2 Z1947438117 [0,0,0,0,0,2|0,0,0]=2 900 B13R2.10 NC1CCN(C1)C2=CC=CC=C2 Z415647888 [0,0,0,0,0,2|1,0,0]=3 901 B13R2.10 NC1CCN(C1)C2=NC=CC=C2 Z934137772 [0,0,0,0,0,2|2,0,0]=4 902 B13R2.10 NC1COC(C1)C2=CC=CC=C2 Z4657508784 [0,0,0,0,0,2|0,0,0]=2 903 B13R2.10 O=C1CC(CN1)C2=CC=CC=C2 Z954601980 [0,0,0,0,0,2|1,0,1]=4 904 B13R2.10 O=C1CC(CO1)C2=CC=CC=C2 Z1551943626 [0,0,0,0,0,2|1,0,1]=4 905 B13R2.10 O=C1NC(CO1)C2=CC=CC=C2 Z57199626 [0,0,0,0,0,2|1,0,1]=4 906 B13R2.10 O=C1NCC(N1)C2=CC=CC=C2 Z1255433877 [0,0,0,0,0,2|1,0,1]=4 907 B13R2.10 OC1CCN(C1)C2=CC=CC=C2 Z1198184574 [0,0,0,0,0,2|2,0,0]=4 908 B13R2.10 OC1CNC(C1)C2=CC=CC=C2 Z2298064173 [0,0,0,0,0,2|1,0,0]=3 909 B13R2.15 CC1NCCC1C2=CC=CC=C2 Z979418782 [0,0,0,0,0,2|1,0,0]=3 910 B13R2.15 F[C@@H]1CNC[C@@H]1C2=CC=CC=C2 Z3222118152 [0,0,0,0,0,2|1,0,0]=3 911 B13R2.15 N=C1NCCC1C2=CC=CC=C2 Z5485653209 [0,0,0,0,0,2|0,0,2]=4 912 B13R2.15 NC1=NCCN1C2=CC=CC=C2 Z56767233 [0,0,0,0,0,2|1,0,1]=4 913 B13R2.15 NC1CCCC1C2=CC=CC=C2 Z993058900 [0,0,0,0,0,2|0,0,0]=2 914 B13R2.15 N[C@@H]1CCO[C@H]1C2=CC=CC=C2 Z2690083974 [0,0,0,0,0,2|0,0,0]=2 915 B13R2.15 N[C@@H]1CCO[C@H]1C2=CN=CC=C2 Z2327884249 [0,0,0,0,0,2|1,0,0]=3 916 B13R2.15 O=C1CCCC1C2=CC=CC=C2 Z993018320 [0,0,0,0,0,2|1,0,1]=4 917 B13R2.15 O=C1NCCC1C2=CC=CC=C2 Z1198157720 [0,0,0,0,0,2|1,0,1]=4 918 B13R2.15 O=C1OCCC1C2=CC=CC=C2 Z1198158252 [0,0,0,0,0,2|1,0,1]=4 919 B13R2.15 OC1CCCC1C2=CN=CC=C2 Z992949374 [0,0,0,0,0,2|2,0,0]=4 920 B13R2.15 O[C@@H]1CCC[C@H]1C2=CC=CC=C2 Z2306832376 [0,0,0,0,0,2|1,0,0]=3 921 B13R2.15 O[C@@H]1CCN[C@@H]1C2=CC=CC=C2 Z4203073787 [0,0,0,0,0,2|1,0,0]=3