0 B11R1.40 CC(CN)Oc1ccccc1 H50720 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.40 CCC(=O)Nc1ccccc1 H31832 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.40 CCN(C)Cc1ccccc1 L08520 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.40 COC(=O)Cc1ccccc1 A15537 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.40 COC(=O)Oc1ccccc1 B25232 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.40 C\C(=C/c1ccccc1)\C=O A10429 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.40 c1ccc(cc1)CC(CO)N H63562 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.40 c1ccc(cc1)C[C@@H](CO)N A11586 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.40 c1ccc(cc1)C[C@H](CO)N L09697 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.40 c1ccc(cc1)C\C(=N\O)\N H58835 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.40 c1ccc(cc1)NC(=O)NN B25578 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.40 c1ccc(cc1)NC(=S)NN A15349 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.17 C#CCCc1ccccc1 L12946 [1,0,0,0,0,0|1,0,1]=3 13 B10R1.17 C#CCOc1ccccc1 43923 [1,0,0,0,0,0|2,0,1]=4 14 B10R1.17 C#CCOc1ccccc1 A18272 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.17 C=CCNc1ccccc1 H55821 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.17 C=CCOc1ccccc1 L03359 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.17 C=CCSc1ccccc1 L04771 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.17 CCC#Cc1ccccc1 A11332 [1,0,0,0,0,0|1,0,2]=4 19 B10R1.17 CCCC[n+]1ccccc1 19740 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.17 CCCC[n+]1ccccc1 H26995 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.17 CCCCc1ccccc1 A10910 [1,0,0,0,0,0|1,0,0]=2 22 B10R1.17 CCNCc1ccccc1 L05651 [1,0,0,0,0,0|2,0,0]=3 23 B10R1.17 CCNCc1cccnc1 H51120 [1,0,0,0,0,0|3,0,0]=4 24 B10R1.17 CCNCc1ccncc1 L13714 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.17 CNCCc1ccccn1 H50190 [1,0,0,0,0,0|1,0,0]=2 26 B10R1.17 c1ccc(cc1)CCC#N L06483 [1,0,0,0,0,0|2,0,0]=3 27 B10R1.17 c1ccc(cc1)CCC=O A10367 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.17 c1ccc(cc1)CCCBr A14050 [1,0,0,0,0,0|2,0,0]=3 29 B10R1.17 c1ccc(cc1)CCCCl B20445 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.17 c1ccc(cc1)CCCI H53420 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.17 c1ccc(cc1)CCCN L03023 [1,0,0,0,0,0|2,0,0]=3 32 B10R1.17 c1ccc(cc1)CCCO A13022 [1,0,0,0,0,0|2,0,0]=3 33 B10R1.17 c1ccc(cc1)CCC[Zn+] H58569 [1,0,0,0,0,0|2,0,0]=3 34 B10R1.17 c1ccc(cc1)CN=C=O L02633 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.17 c1ccc(cc1)CN=C=S A15008 [1,0,0,0,0,0|3,0,0]=4 36 B10R1.17 c1ccc(cc1)CN=[N+]=[N-] 32635 [1,0,0,0,0,0|2,0,1]=4 37 B10R1.17 c1ccc(cc1)CNC=O B23722 [1,0,0,0,0,0|3,0,0]=4 38 B10R1.17 c1ccc(cc1)COC=O L13405 [1,0,0,0,0,0|3,0,0]=4 39 B10R1.17 c1ccc(cc1)COCCl H60207 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.17 c1ccc(cc1)CSC#N B23902 [1,0,0,0,0,0|3,0,0]=4 41 B10R1.17 c1ccc(cc1)NCCN L03786 [1,0,0,0,0,0|3,0,0]=4 42 B10R1.17 c1ccc(cc1)NCCO B22131 [1,0,0,0,0,0|3,0,0]=4 43 B10R1.17 c1ccc(cc1)OCC#N A11981 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.17 c1ccc(cc1)OCCBr B21087 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.17 c1ccc(cc1)OCCCl L11345 [1,0,0,0,0,0|3,0,0]=4 46 B10R1.17 c1ccc(cc1)OCCN A12225 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 c1ccc(cc1)OCCO A10786 [1,0,0,0,0,0|3,0,0]=4 48 B10R1.17 c1ccc(cc1)SCC#N A12869 [1,0,0,0,0,0|3,0,0]=4 49 B10R1.17 c1ccc(cc1)SCCBr L11005 [1,0,0,0,0,0|3,0,0]=4 50 B10R1.17 c1ccc(cc1)SCCCl B23265 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.17 c1ccc(cc1)SCCO A10861 [1,0,0,0,0,0|3,0,0]=4 52 B10R1.18 CC(=C)Cc1ccccc1 B20370 [1,0,0,0,0,0|0,0,2]=3 53 B10R1.18 CC(=O)C[n+]1ccccc1 A16015 [1,0,0,0,0,0|2,0,1]=4 54 B10R1.18 CC(=O)C[n+]1ccccc1 B24490 [1,0,0,0,0,0|2,0,1]=4 55 B10R1.18 CC(=O)Cc1ccncc1 L18667 [1,0,0,0,0,0|2,0,1]=4 56 B10R1.18 CC(=O)Nc1ccccc1 A14361 [1,0,0,0,0,0|2,0,1]=4 57 B10R1.18 CC(=O)Oc1ccccc1 B22561 [1,0,0,0,0,0|2,0,1]=4 58 B10R1.18 CC(=O)Oc1ccccc1 L19598 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.18 CC(=O)Sc1ccccc1 H55175 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.18 CC(C)Cc1ccccn1 B22349 [1,0,0,0,0,0|1,0,0]=2 61 B10R1.18 CC(C)Cc1cccnc1 B22080 [1,0,0,0,0,0|1,0,0]=2 62 B10R1.18 CC(C)Cc1cnccn1 A10245 [1,0,0,0,0,0|2,0,0]=3 63 B10R1.18 CC(C)Nc1ccccc1 L10646 [1,0,0,0,0,0|1,0,0]=2 64 B10R1.18 CC(C)Sc1ccccc1 A17124 [1,0,0,0,0,0|1,0,0]=2 65 B10R1.18 CN(C)Cc1ccccc1 A12191 [1,0,0,0,0,0|1,0,0]=2 66 B10R1.18 C[SiH](C)Cc1ccccc1 L05334 [1,0,0,0,0,0|0,1,0]=2 67 B10R1.18 c1cc(cnc1)CC(=O)N B25692 [1,0,0,0,0,0|2,0,1]=4 68 B10R1.18 c1cc(cnc1)CC(=S)N H58040 [1,0,0,0,0,0|2,0,1]=4 69 B10R1.18 c1ccc(cc1)CC(=O)Cl B24987 [1,0,0,0,0,0|2,0,1]=4 70 B10R1.18 c1ccc(cc1)CC(=O)N H60626 [1,0,0,0,0,0|1,0,1]=3 71 B10R1.18 c1ccc(cc1)CC(=O)O A14881 [1,0,0,0,0,0|2,0,1]=4 72 B10R1.18 c1ccc(cc1)CC(=S)N H26514 [1,0,0,0,0,0|1,0,1]=3 73 B10R1.18 c1ccc(cc1)NC(=O)N L01306 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.18 c1ccc(cc1)NC(=S)N L06690 [1,0,0,0,0,0|2,0,1]=4 75 B10R1.18 c1ccc(cc1)OC(=O)N L00944 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.18 c1ccnc(c1)CC(=O)N B24939 [1,0,0,0,0,0|2,0,1]=4 77 B10R1.18 c1ccnc(c1)CC(=S)N H58993 [1,0,0,0,0,0|2,0,1]=4 78 B10R1.18 c1cnccc1CC(=O)N B24734 [1,0,0,0,0,0|2,0,1]=4 79 B12R1.32 CCOC(=O)Cc1ccccc1 A19356 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.34 CN(C(=O)c1ccccc1)OC H54253 [0,1,0,0,0,0|2,0,1]=4 81 B12R1.34 COC(=O)C(c1ccccc1)Br L09043 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.34 COC(=O)C(c1ccccc1)O L12706 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.34 COC(=O)[C@@H](c1ccccc1)N L18735 [0,1,0,0,0,0|2,0,1]=4 84 B12R1.34 COC(=O)[C@@H](c1ccccc1)O L14065 [0,1,0,0,0,0|2,0,1]=4 85 B12R1.34 COC(=O)[C@H](c1ccccc1)N H62874 [0,1,0,0,0,0|2,0,1]=4 86 B12R1.34 COC(=O)[C@H](c1ccccc1)O L14070 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.34 c1ccc(cc1)C(C(=O)NN)O L11653 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.34 c1ccc(cc1)[C@@H]([C@H](CO)N)O 42183 [0,1,0,0,0,0|3,0,0]=4 89 B12R1.43 CC(C(=O)Cl)Oc1ccccc1 L04943 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.43 CC(C)C(=O)Cc1ccccc1 L07176 [0,1,0,0,0,0|2,0,1]=4 91 B12R1.43 c1ccc(cc1)CC(C(=O)O)N A10132 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.43 c1ccc(cc1)CC(C(=O)O)O L09854 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)N)N H62030 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)N)N H65506 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N A13238 [0,1,0,0,0,0|3,0,0]=4 96 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)O A18203 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.43 c1ccc(cc1)C[C@H](C(=O)N)N H65853 [0,1,0,0,0,0|3,0,0]=4 98 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N A10572 [0,1,0,0,0,0|3,0,0]=4 99 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)O H35096 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.49 COC(=O)Cc1ccc(cc1)F H32236 [0,1,0,0,0,0|2,0,1]=4 101 B12R1.49 COC(=O)Cc1ccc(cc1)O B22533 [0,1,0,0,0,0|2,0,1]=4 102 B12R1.118 COC(Cc1ccccc1)OC A18730 [0,1,0,0,0,0|1,0,0]=2 103 B12R1.194 CO[Si](C)(C)Cc1ccccc1 H28574 [0,1,0,0,0,0|1,1,0]=3 104 B12R1.371 Cc1ccccc1CC(=O)OC L09877 [0,1,0,0,0,0|2,0,1]=4 105 B12R2.18 Cc1c([nH]c2c1cccc2)C A18504 [0,0,0,1,0,0|2,0,1]=4 106 B12R2.18 Cn1c2ccccc2nc1Br H60075 [0,0,0,1,0,0|2,0,1]=4 107 B12R2.18 Cn1c2ccccc2nc1Cl H63559 [0,0,0,1,0,0|2,0,1]=4 108 B12R2.18 c1ccc2c(c1)CC(C2=O)Br L12453 [0,0,0,1,0,0|3,0,0]=4 109 B12R2.18 c1ccc2c(c1)CC(C2O)Br A13511 [0,0,0,1,0,0|3,0,0]=4 110 B12R2.18 c1ccc2c(c1)C[C@H]([C@H]2N)O H32066 [0,0,0,1,0,0|3,0,0]=4 111 B12R2.24 CC1CNc2ccccc2O1 H61002 [0,0,0,1,0,0|3,0,0]=4 112 B12R2.24 CC1CNc2ccccc2S1 H61005 [0,0,0,1,0,0|3,0,0]=4 113 B12R2.24 c1ccc2c(c1)CCC(=O)C2 L01053 [0,0,0,1,0,0|2,0,1]=4 114 B12R2.24 c1ccc2c(c1)CCC(C2)N H66652 [0,0,0,1,0,0|2,0,0]=3 115 B12R2.24 c1ccc2c(c1)CNC(=O)N2 L07763 [0,0,0,1,0,0|2,0,1]=4 116 B12R2.32 CCC1=Cc2ccccc2C1 B23104 [0,0,0,1,0,0|1,0,2]=4 117 B12R2.32 c1ccc2c(c1)CC(C2)CN H66610 [0,0,0,1,0,0|2,0,0]=3 118 B12R2.32 c1ccc2c(c1)C[C@H](N2)CO H27711 [0,0,0,1,0,0|3,0,0]=4 119 B10R1.15 C#CC(c1ccccc1)O L09549 [0,0,0,0,1,0|2,0,1]=4 120 B10R1.15 CC(C#N)c1ccccc1 A13636 [0,0,0,0,1,0|2,0,0]=3 121 B10R1.15 CC(C=O)c1ccccc1 B22436 [0,0,0,0,1,0|2,0,0]=3 122 B10R1.15 CC(CBr)c1ccccc1 L16267 [0,0,0,0,1,0|2,0,0]=3 123 B10R1.15 CC(CN)c1ccccc1 H36338 [0,0,0,0,1,0|2,0,0]=3 124 B10R1.15 CC(CO)c1ccccc1 B23473 [0,0,0,0,1,0|2,0,0]=3 125 B10R1.15 CCC(=O)c1ccccc1 A15140 [0,0,0,0,1,0|2,0,1]=4 126 B10R1.15 CCC(C)c1ccccc1 B22962 [0,0,0,0,1,0|1,0,0]=2 127 B10R1.15 CCC(c1ccccc1)O A10830 [0,0,0,0,1,0|2,0,0]=3 128 B10R1.15 CC[C@@H](c1ccccc1)N L16320 [0,0,0,0,1,0|2,0,0]=3 129 B10R1.15 CC[C@@H](c1ccccc1)O L06608 [0,0,0,0,1,0|2,0,0]=3 130 B10R1.15 CC[C@H](c1ccccc1)N L16319 [0,0,0,0,1,0|2,0,0]=3 131 B10R1.15 CC[C@H](c1ccccc1)O L05681 [0,0,0,0,1,0|2,0,0]=3 132 B10R1.15 CN(C=O)c1ccccc1 A11829 [0,0,0,0,1,0|3,0,0]=4 133 B10R1.15 CNC(=O)c1ccccc1 A18057 [0,0,0,0,1,0|1,0,1]=3 134 B10R1.15 COC(=O)c1ccccc1 44368 [0,0,0,0,1,0|2,0,1]=4 135 B10R1.15 COC(=O)c1ccccc1 A12404 [0,0,0,0,1,0|2,0,1]=4 136 B10R1.15 C[C@@H](CO)c1ccccc1 L13999 [0,0,0,0,1,0|2,0,0]=3 137 B10R1.15 C[C@H](CO)c1ccccc1 L13988 [0,0,0,0,1,0|2,0,0]=3 138 B10R1.15 C\C(=N/O)\c1ccccc1 A11804 [0,0,0,0,1,0|1,0,2]=4 139 B10R1.15 c1ccc(cc1)C(=O)NN A12268 [0,0,0,0,1,0|2,0,1]=4 140 B10R1.15 c1ccc(cc1)C(=O)NO A10509 [0,0,0,0,1,0|2,0,1]=4 141 B10R1.15 c1ccc(cc1)C(C#N)O L08698 [0,0,0,0,1,0|3,0,0]=4 142 B10R1.15 c1ccc(cc1)C(CBr)Br B24990 [0,0,0,0,1,0|3,0,0]=4 143 B10R1.15 c1ccc(cc1)C(CCl)O L14538 [0,0,0,0,1,0|3,0,0]=4 144 B10R1.15 c1ccc(cc1)C(CN)O H63932 [0,0,0,0,1,0|3,0,0]=4 145 B10R1.15 c1ccc(cc1)C(CO)O L04551 [0,0,0,0,1,0|3,0,0]=4 146 B10R1.15 c1ccc(cc1)[C@@H](C#N)N L06355 [0,0,0,0,1,0|3,0,0]=4 147 B10R1.15 c1ccc(cc1)[C@@H](CN)O L19404 [0,0,0,0,1,0|3,0,0]=4 148 B10R1.15 c1ccc(cc1)[C@@H](CO)N L13265 [0,0,0,0,1,0|3,0,0]=4 149 B10R1.15 c1ccc(cc1)[C@@H](CO)O L09836 [0,0,0,0,1,0|3,0,0]=4 150 B10R1.15 c1ccc(cc1)[C@H](C#N)O H56658 [0,0,0,0,1,0|3,0,0]=4 151 B10R1.15 c1ccc(cc1)[C@H](CN)O L19403 [0,0,0,0,1,0|3,0,0]=4 152 B10R1.15 c1ccc(cc1)[C@H](CO)N A19030 [0,0,0,0,1,0|3,0,0]=4 153 B10R1.15 c1ccc(cc1)[C@H](CO)O L10494 [0,0,0,0,1,0|3,0,0]=4 154 B12R1.27 CCC(=O)OCc1ccccc1 B23186 [0,0,0,0,0,1|2,0,1]=4 155 B12R1.27 CCC(C#Cc1ccccc1)O H53416 [0,0,0,0,0,1|2,0,1]=4 156 B12R1.27 COC(=O)CCc1ccccc1 L05310 [0,0,0,0,0,1|2,0,1]=4 157 B12R1.27 COC(=O)CSc1ccccc1 L12649 [0,0,0,0,0,1|2,0,1]=4 158 B12R1.27 c1ccc(cc1)CNC(=S)NN L10920 [0,0,0,0,0,1|2,0,1]=4 159 B12R1.27 c1ccc(cc1)COC(=O)NN A13005 [0,0,0,0,0,1|2,0,1]=4 160 B12R1.27 c1ccc(cc1)COC(=O)NO L13175 [0,0,0,0,0,1|2,0,1]=4 161 B12R1.27 c1ccc(cc1)OCC(CN)O H50245 [0,0,0,0,0,1|3,0,0]=4 162 B12R1.27 c1ccc(cc1)OCC(CO)O B25701 [0,0,0,0,0,1|3,0,0]=4 163 B9R1.8 C#CCc1ccccc1 H53500 [2,0,0,0,0,0|0,0,2]=4 164 B9R1.8 C=CCc1ccccc1 A12965 [2,0,0,0,0,0|0,0,2]=4 165 B9R1.8 CC#Cc1ccccc1 A14272 [2,0,0,0,0,0|0,0,2]=4 166 B9R1.8 CCCc1ccccc1 B21468 [2,0,0,0,0,0|0,0,0]=2 167 B9R1.8 CCNc1ccccc1 A15060 [2,0,0,0,0,0|1,0,0]=3 168 B9R1.8 CCOc1ccccc1 A15501 [2,0,0,0,0,0|1,0,0]=3 169 B9R1.8 CCOc1ccccn1 L05649 [2,0,0,0,0,0|2,0,0]=4 170 B9R1.8 CCSc1ccccc1 A13987 [2,0,0,0,0,0|1,0,0]=3 171 B9R1.8 CNCc1ccccc1 A13746 [2,0,0,0,0,0|0,0,0]=2 172 B9R1.8 CNCc1cccnc1 H50262 [2,0,0,0,0,0|1,0,0]=3 173 B9R1.8 COCc1ccccc1 B23490 [2,0,0,0,0,0|1,0,0]=3 174 B9R1.8 C\N=C\c1ccccc1 B25161 [2,0,0,0,0,0|0,0,2]=4 175 B9R1.8 c1cc(cnc1)CCN L16311 [2,0,0,0,0,0|1,0,0]=3 176 B9R1.8 c1ccc(cc1)CC#N A10694 [2,0,0,0,0,0|0,0,2]=4 177 B9R1.8 c1ccc(cc1)CC=O A14263 [2,0,0,0,0,0|1,0,1]=4 178 B9R1.8 c1ccc(cc1)CCBr A12528 [2,0,0,0,0,0|1,0,0]=3 179 B9R1.8 c1ccc(cc1)CCCl L04891 [2,0,0,0,0,0|1,0,0]=3 180 B9R1.8 c1ccc(cc1)CCN A13402 [2,0,0,0,0,0|0,0,0]=2 181 B9R1.8 c1ccc(cc1)CCO A15241 [2,0,0,0,0,0|1,0,0]=3 182 B9R1.8 c1ccc(cc1)CC[Zn+] H58154 [2,0,0,0,0,0|1,0,0]=3 183 B9R1.8 c1ccc(cc1)CNN H54916 [2,0,0,0,0,0|1,0,0]=3 184 B9R1.8 c1ccc(cc1)CON A17393 [2,0,0,0,0,0|1,0,0]=3 185 B9R1.8 c1ccc(cc1)CON L13601 [2,0,0,0,0,0|1,0,0]=3 186 B9R1.8 c1ccnc(c1)CCN L05627 [2,0,0,0,0,0|1,0,0]=3 187 B9R1.8 c1ccnc(c1)CCO B23579 [2,0,0,0,0,0|2,0,0]=4 188 B9R1.8 c1cnccc1CCN H27545 [2,0,0,0,0,0|1,0,0]=3 189 B9R1.8 c1cnccc1CCO L13780 [2,0,0,0,0,0|2,0,0]=4 190 B11R1.1 CCCC[n+]1ccc(cc1)C H27100 [1,1,0,0,0,0|2,0,0]=4 191 B11R1.1 CCCC[n+]1ccc(cc1)C H27355 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.1 CCCCc1ccc(cc1)Br B23979 [1,1,0,0,0,0|1,0,0]=3 193 B11R1.1 CCCCc1ccc(cc1)Cl B24138 [1,1,0,0,0,0|1,0,0]=3 194 B11R1.1 CCCCc1ccc(cc1)I A14421 [1,1,0,0,0,0|1,0,0]=3 195 B11R1.1 CCCCc1ccc(cc1)N B25234 [1,1,0,0,0,0|1,0,0]=3 196 B11R1.1 CCCCc1ccc(cc1)O A12812 [1,1,0,0,0,0|1,0,0]=3 197 B11R1.1 CCCOc1ccc(cc1)Br A11462 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.1 CCCOc1ccc(cc1)N H55096 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.1 CCCOc1ccc(cc1)O B22266 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.1 CCNCc1ccc(cc1)F H56689 [1,1,0,0,0,0|2,0,0]=4 201 B11R1.1 COCCc1ccc(cc1)O B23548 [1,1,0,0,0,0|1,0,0]=3 202 B11R1.1 c1cc(ccc1CCC#N)O L07934 [1,1,0,0,0,0|2,0,0]=4 203 B11R1.1 c1cc(ccc1CCCO)Br H61118 [1,1,0,0,0,0|2,0,0]=4 204 B11R1.16 C=CCC(c1ccccc1)O H53466 [1,1,0,0,0,0|1,0,1]=4 205 B11R1.16 CCCC(=O)c1ccccc1 A11345 [1,1,0,0,0,0|1,0,1]=4 206 B11R1.16 CCCC(C)c1ccccc1 B20114 [1,1,0,0,0,0|1,0,0]=3 207 B11R1.16 CCC[C@@H](c1ccccc1)N H27048 [1,1,0,0,0,0|1,0,0]=3 208 B11R1.16 CCC[C@H](c1ccccc1)N H27156 [1,1,0,0,0,0|1,0,0]=3 209 B11R1.16 CNCC(c1ccccc1)O L08111 [1,1,0,0,0,0|0,0,0]=2 210 B11R1.16 c1ccc(cc1)[C@@H](CCCl)O H55567 [1,1,0,0,0,0|2,0,0]=4 211 B11R1.16 c1ccc(cc1)[C@H](CCCl)O H54847 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.17 CCNCc1ccccc1F H56127 [1,1,0,0,0,0|2,0,0]=4 213 B11R1.17 c1ccc(c(c1)CCCO)Br H63884 [1,1,0,0,0,0|2,0,0]=4 214 B11R1.24 CCCC[n+]1cccc(c1)C H26983 [1,1,0,0,0,0|2,0,0]=4 215 B11R1.24 CCCC[n+]1cccc(c1)C H27496 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.24 CCNCc1cccc(c1)F H56434 [1,1,0,0,0,0|2,0,0]=4 217 B11R1.28 C#CCCCc1ccccc1 L11608 [1,1,0,0,0,0|1,0,1]=4 218 B11R1.28 C#CCOCc1ccccc1 H53481 [1,1,0,0,0,0|1,0,1]=4 219 B11R1.28 CCCC#Cc1ccccc1 B20857 [1,1,0,0,0,0|1,0,1]=4 220 B11R1.28 CCCCCc1ccccc1 A15734 [1,1,0,0,0,0|1,0,0]=3 221 B11R1.28 CCCCCc1ccccn1 B22125 [1,1,0,0,0,0|2,0,0]=4 222 B11R1.28 CCCCNc1ccccc1 B24180 [1,1,0,0,0,0|1,0,0]=3 223 B11R1.28 CCCCOc1ccccc1 L04703 [1,1,0,0,0,0|1,0,0]=3 224 B11R1.28 CCCCOc1ccccn1 B21651 [1,1,0,0,0,0|2,0,0]=4 225 B11R1.28 CNCCOc1ccccc1 H50258 [1,1,0,0,0,0|0,0,0]=2 226 B11R1.28 COCCSc1ccccc1 L10464 [1,1,0,0,0,0|1,0,0]=3 227 B11R1.28 c1ccc(cc1)CCCC#N L01638 [1,1,0,0,0,0|1,0,1]=4 228 B11R1.28 c1ccc(cc1)CCCCBr B25237 [1,1,0,0,0,0|1,0,0]=3 229 B11R1.28 c1ccc(cc1)CCCCCl A11753 [1,1,0,0,0,0|1,0,0]=3 230 B11R1.28 c1ccc(cc1)CCCCN L02982 [1,1,0,0,0,0|1,0,0]=3 231 B11R1.28 c1ccc(cc1)CCCCO A13433 [1,1,0,0,0,0|1,0,0]=3 232 B11R1.28 c1ccc(cc1)CCN=C=S A15123 [1,1,0,0,0,0|0,0,2]=4 233 B11R1.28 c1ccc(cc1)CNCC#N L18566 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.28 c1ccc(cc1)CNCCN A13262 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.28 c1ccc(cc1)CNCCO A16866 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.28 c1ccc(cc1)COCCBr H56872 [1,1,0,0,0,0|2,0,0]=4 237 B11R1.28 c1ccc(cc1)COCCI H35095 [1,1,0,0,0,0|2,0,0]=4 238 B11R1.28 c1ccc(cc1)CSCCO L12274 [1,1,0,0,0,0|2,0,0]=4 239 B11R1.28 c1ccc(cc1)OCCCBr L12494 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.28 c1ccc(cc1)OCCCN H52398 [1,1,0,0,0,0|2,0,0]=4 241 B11R1.28 c1ccc(cc1)SCCCCl B21345 [1,1,0,0,0,0|2,0,0]=4 242 B11R1.91 B(CCc1ccccc1)(O)O H52502 [1,1,0,0,0,0|2,0,0]=4 243 B11R1.91 CC(=C)COc1ccccc1 B22369 [1,1,0,0,0,0|2,0,0]=4 244 B11R1.91 CC(=N)SCc1ccccc1 H51844 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.91 CC(=O)CCc1ccccc1 B22777 [1,1,0,0,0,0|1,0,0]=3 246 B11R1.91 CC(=O)OCc1ccccc1 B23472 [1,1,0,0,0,0|2,0,0]=4 247 B11R1.91 CC(C)NCc1ccccc1 B23243 [1,1,0,0,0,0|2,0,0]=4 248 B11R1.91 CC(CCc1ccccc1)N A18804 [1,1,0,0,0,0|1,0,0]=3 249 B11R1.91 CC(CCc1ccccc1)O L05970 [1,1,0,0,0,0|1,0,0]=3 250 B11R1.91 CC(COc1ccccc1)O L04596 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.91 C[C@@H](CCc1ccccc1)O L18886 [1,1,0,0,0,0|1,0,0]=3 252 B11R1.91 C[C@H](CCc1ccccc1)O L18885 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.91 c1ccc(cc1)CCC(=O)Cl A10860 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.91 c1ccc(cc1)CCC(=O)O A14908 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.20 CC(=O)Cc1ccc(cc1)Br A19028 [1,1,0,0,0,0|1,0,1]=4 256 B11R1.20 CC(=O)Cc1ccc(cc1)F L11720 [1,1,0,0,0,0|1,0,1]=4 257 B11R1.20 CC(=O)Cc1ccc(cc1)O A18936 [1,1,0,0,0,0|1,0,1]=4 258 B11R1.20 CC(C)Cc1ccc(cc1)[Mg+] H54201 [1,1,0,0,0,0|0,0,0]=2 259 B11R1.20 CC(C)Oc1ccc(cn1)Br H32564 [1,1,0,0,0,0|2,0,0]=4 260 B11R1.20 CC(C)Oc1ccc(cn1)I H50140 [1,1,0,0,0,0|2,0,0]=4 261 B11R1.20 CC(Cc1ccc(cc1)F)N H51016 [1,1,0,0,0,0|0,0,0]=2 262 B11R1.20 Cc1ccc(cc1)CC(=O)C B24728 [1,1,0,0,0,0|1,0,1]=4 263 B11R1.20 Cc1ccc(cc1)CC(=S)N H26278 [1,1,0,0,0,0|1,0,1]=4 264 B11R1.20 c1cc(ccc1CC(=O)N)O A15266 [1,1,0,0,0,0|1,0,1]=4 265 B11R1.20 c1cc(ccc1CC(=S)N)Cl H26864 [1,1,0,0,0,0|1,0,1]=4 266 B11R1.36 CC(=C)C(c1ccccc1)O B20936 [1,1,0,0,0,0|0,0,2]=4 267 B11R1.36 CC(C(=O)c1ccccc1)Br A10661 [1,1,0,0,0,0|1,0,1]=4 268 B11R1.36 CC(C)C(=O)c1ccccc1 B24628 [1,1,0,0,0,0|0,0,1]=3 269 B11R1.36 CC(C)C(c1ccccc1)O B20729 [1,1,0,0,0,0|0,0,0]=2 270 B11R1.36 CC(c1ccccc1)N(C)C A17989 [1,1,0,0,0,0|1,0,0]=3 271 B11R1.36 CN(C)C(=O)c1ccccc1 A18766 [1,1,0,0,0,0|1,0,1]=4 272 B11R1.36 c1ccc(cc1)C(C(=O)N)O L04679 [1,1,0,0,0,0|1,0,1]=4 273 B11R1.36 c1ccc(cc1)[C@@H](C(=O)N)N H65751 [1,1,0,0,0,0|1,0,1]=4 274 B11R1.86 CC(=O)Cc1ccccc1Cl L09846 [1,1,0,0,0,0|1,0,1]=4 275 B11R1.86 CC(=O)Cc1ccccc1F H61535 [1,1,0,0,0,0|1,0,1]=4 276 B11R1.86 CC(C)Oc1c(cccn1)Br H52360 [1,1,0,0,0,0|2,0,0]=4 277 B11R1.86 CC(C)Oc1c(cccn1)I H50083 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.86 CC(C)Oc1ccccc1Br B25688 [1,1,0,0,0,0|1,0,0]=3 279 B11R1.86 CC(C)Oc1ccccc1O L07360 [1,1,0,0,0,0|1,0,0]=3 280 B11R1.86 CC(Cc1ccccc1F)N H50999 [1,1,0,0,0,0|0,0,0]=2 281 B11R1.86 Cc1ccccc1CC(=S)N H33111 [1,1,0,0,0,0|1,0,1]=4 282 B11R1.86 c1ccc(c(c1)CC(=S)N)Cl H26685 [1,1,0,0,0,0|1,0,1]=4 283 B11R1.157 CC(=O)Cc1cccc(c1)F B22061 [1,1,0,0,0,0|1,0,1]=4 284 B11R1.157 CC(C)Oc1cccc(c1)Br L13802 [1,1,0,0,0,0|1,0,0]=3 285 B11R1.157 Cc1cccc(c1)CC(=S)N H33031 [1,1,0,0,0,0|1,0,1]=4 286 B11R1.157 c1cc(cc(c1)Cl)CC(=S)N H32426 [1,1,0,0,0,0|1,0,1]=4 287 B11R1.509 CC(C)(C)Cc1ccccc1 A12941 [1,1,0,0,0,0|0,0,0]=2 288 B11R1.509 CC(C)(C)Oc1ccccc1 H27689 [1,1,0,0,0,0|1,0,0]=3 289 B11R1.509 CC(C)(Cc1ccccc1)O L03679 [1,1,0,0,0,0|0,0,0]=2 290 B11R1.509 CS(=O)(=O)Cc1ccccc1 L04233 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.509 C[N+](C)(C)Cc1ccccc1 41717 [1,1,0,0,0,0|1,0,0]=3 292 B11R1.509 C[N+](C)(C)Cc1ccccc1 43474 [1,1,0,0,0,0|1,0,0]=3 293 B11R1.509 C[N+](C)(C)Cc1ccccc1 47189 [1,1,0,0,0,0|1,0,0]=3 294 B11R1.509 C[N+](C)(C)Cc1ccccc1 A14927 [1,1,0,0,0,0|1,0,0]=3 295 B11R1.509 C[N+](C)(C)Cc1ccccc1 A16759 [1,1,0,0,0,0|1,0,0]=3 296 B11R1.509 C[N+](C)(C)Cc1ccccc1 A16840 [1,1,0,0,0,0|1,0,0]=3 297 B11R1.509 C[N+](C)(C)Cc1ccccc1 B20812 [1,1,0,0,0,0|1,0,0]=3 298 B11R1.509 C[N+](C)(C)Cc1ccccc1 B22892 [1,1,0,0,0,0|1,0,0]=3 299 B11R1.509 C[N+](C)(C)Cc1ccccc1 B23520 [1,1,0,0,0,0|1,0,0]=3 300 B11R1.509 C[N+](C)(C)Cc1ccccc1 B24470 [1,1,0,0,0,0|1,0,0]=3 301 B11R1.509 C[Si](C)(C)Cc1ccccc1 A13191 [1,1,0,0,0,0|0,1,0]=3 302 B11R1.509 C[Si](C)(C)Sc1ccccc1 L06319 [1,1,0,0,0,0|1,1,0]=4 303 B11R1.509 c1ccc(cc1)CS(=O)(=O)N A16740 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.7 CC(C#C)(c1ccccc1)O B25515 [0,1,0,0,1,0|1,0,1]=4 305 B11R1.7 CCC(C)(C)c1ccccc1 L03731 [0,1,0,0,1,0|1,0,0]=3 306 B11R1.7 CNS(=O)(=O)c1ccccc1 H55666 [0,1,0,0,1,0|2,0,0]=4 307 B11R1.7 COP(=O)(C)c1ccccc1 A18760 [0,1,0,0,1,0|2,0,0]=4 308 B11R1.7 CO[Si](C)(C)c1ccccc1 H27165 [0,1,0,0,1,0|1,1,0]=4 309 B11R1.12 CCC(C#N)c1ccccc1 A17093 [0,1,0,0,1,0|1,0,1]=4 310 B11R1.12 CCN(CC)c1ccccc1 A10560 [0,1,0,0,1,0|2,0,0]=4 311 B11R1.12 CCP(CC)c1ccccc1 10180 [0,1,0,0,1,0|2,0,0]=4 312 B11R1.12 COC(c1ccccc1)OC A11009 [0,1,0,0,1,0|1,0,0]=3 313 B11R1.12 COP(c1ccccc1)OC A14006 [0,1,0,0,1,0|2,0,0]=4 314 B11R1.12 CO[C@@H](CO)c1ccccc1 L14044 [0,1,0,0,1,0|1,0,0]=3 315 B11R1.12 c1ccc(cc1)C(CO)CO H56761 [0,1,0,0,1,0|2,0,0]=4 316 B11R1.22 CNC(=O)c1ccc(cc1)Br H57940 [0,1,0,0,1,0|1,0,1]=4 317 B11R1.22 CNC(=O)c1ccc(cc1)F H57798 [0,1,0,0,1,0|1,0,1]=4 318 B11R1.22 Cc1ccc(cc1)C(=O)NC H56446 [0,1,0,0,1,0|1,0,1]=4 319 B11R1.23 CCC(c1cccc(c1)F)O H32342 [0,1,0,0,1,0|2,0,0]=4 320 B11R1.23 CNC(=O)c1cccc(c1)Cl H56565 [0,1,0,0,1,0|1,0,1]=4 321 B11R1.23 Cc1cccc(c1)C(=O)NC H56299 [0,1,0,0,1,0|1,0,1]=4 322 B11R1.222 CCC(C)c1ccccc1O A18461 [0,1,0,0,1,0|1,0,0]=3 323 B11R1.222 CCC(c1ccccc1F)O H31929 [0,1,0,0,1,0|2,0,0]=4 324 B11R1.222 CNC(=O)c1ccccc1Br H50583 [0,1,0,0,1,0|1,0,1]=4 325 B11R1.222 CNC(=O)c1ccccc1Cl H56910 [0,1,0,0,1,0|1,0,1]=4 326 B11R1.222 CNC(=O)c1ccccc1F H56104 [0,1,0,0,1,0|1,0,1]=4 327 B13R1.254 CC(C)(CO)OCc1ccccc1 H26006 [0,1,0,0,0,1|2,0,0]=4 328 B13R1.351 C[C@H](C(=O)O)OCc1ccccc1 L17205 [0,1,0,0,0,1|2,0,0]=4 329 B13R1.417 CC[C@H](CO)NCc1ccccc1 H50328 [0,1,0,0,0,1|1,0,0]=3 330 B13R1.47 CCCC(C)C(c1ccccc1)O B20596 [0,2,0,0,0,0|1,0,0]=3 331 B13R1.152 C[C@@H]([C@@H](c1ccccc1)O)N(C)C 41570 [0,2,0,0,0,0|0,0,0]=2 332 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O H65675 [0,2,0,0,0,0|0,0,1]=3 333 B13R1.1073 CC(Cc1ccccc1)(C(=O)O)N B25155 [0,2,0,0,0,0|2,0,0]=4 334 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)N H35430 [0,2,0,0,0,0|2,0,0]=4 335 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)N L14580 [0,2,0,0,0,0|2,0,0]=4 336 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)N L14589 [0,2,0,0,0,0|2,0,0]=4 337 B11R2.1 Cn1c2ccccc2nn1 L00297 [1,0,0,1,0,0|2,0,0]=4 338 B11R2.1 Cn1ccc2c1cccc2 A12605 [1,0,0,1,0,0|0,0,2]=4 339 B11R2.1 Cn1cnc2c1cccc2 B25472 [1,0,0,1,0,0|1,0,1]=4 340 B11R2.1 c1ccc2c(c1)CCC2=O A11056 [1,0,0,1,0,0|2,0,0]=4 341 B11R2.1 c1ccc2c(c1)CCC2N A16585 [1,0,0,1,0,0|2,0,0]=4 342 B11R2.1 c1ccc2c(c1)CCC2O B24536 [1,0,0,1,0,0|2,0,0]=4 343 B11R2.1 c1ccc2c(c1)CC[C@@H]2N L19303 [1,0,0,1,0,0|2,0,0]=4 344 B11R2.1 c1ccc2c(c1)CC[C@H]2N L19302 [1,0,0,1,0,0|2,0,0]=4 345 B11R2.20 c1ccc2c(c1)CCC=C2 L11430 [1,0,0,1,0,0|1,0,1]=4 346 B11R2.20 c1ccc2c(c1)CCCC2 A14962 [1,0,0,1,0,0|1,0,0]=3 347 B11R2.20 c1ccc2c(c1)CCCN2 B22750 [1,0,0,1,0,0|2,0,0]=4 348 B11R2.20 c1ccc2c(c1)CCNC2 L08143 [1,0,0,1,0,0|0,0,0]=2 349 B11R2.20 c1ccc2c(c1)CCOC2 A12566 [1,0,0,1,0,0|1,0,0]=3 350 B11R2.238 c1ccc(cc1)SC2CC2 L12321 [1,0,0,1,0,0|2,0,0]=4 351 B11R2.10 CC1=Cc2ccccc2C1 H26875 [1,0,0,1,0,0|0,0,2]=4 352 B11R2.10 Cc1[nH]c2ccccc2n1 A17290 [1,0,0,1,0,0|1,0,1]=4 353 B11R2.10 Cc1cc2ccccc2[nH]1 A10764 [1,0,0,1,0,0|0,0,2]=4 354 B11R2.10 c1ccc2c(c1)CC(=O)C2 A12574 [1,0,0,1,0,0|1,0,1]=4 355 B11R2.10 c1ccc2c(c1)CC(=O)N2 A18764 [1,0,0,1,0,0|1,0,1]=4 356 B11R2.10 c1ccc2c(c1)CC(C2)N H31023 [1,0,0,1,0,0|0,0,0]=2 357 B11R2.10 c1ccc2c(c1)CC(C2)N L14083 [1,0,0,1,0,0|0,0,0]=2 358 B11R2.10 c1ccc2c(c1)CC(C2)O L01766 [1,0,0,1,0,0|1,0,0]=3 359 B13R2.32 CC1CCc2ccccc2C1=O H31865 [0,0,0,1,0,1|2,0,0]=4 360 B13R2.32 CN1c2ccccc2OCC1=O H27196 [0,0,0,1,0,1|1,0,1]=4 361 B13R2.57 c1ccc2c(c1)CC(NC2)CO H65933 [0,0,0,1,0,1|2,0,0]=4 362 B13R2.57 c1ccc2c(c1)C[C@@H](NC2)CO H65401 [0,0,0,1,0,1|2,0,0]=4 363 B13R2.31 c1ccc(cc1)CN2CC(C2)O H57498 [0,1,0,1,0,0|2,0,0]=4 364 B13R2.64 c1ccc(cc1)CC2=NCCN2 B21764 [0,1,0,1,0,0|0,0,1]=3 365 B13R2.8137 c1ccc(cc1)C(=O)C2CCC2 B25146 [0,1,0,1,0,0|1,0,1]=4 366 B9R1.12 CCCCC1=CC=CC1 H27576 [1,0,0,0,1,0|1,0,1]=4 367 B9R1.12 CCCCC1=CCC=C1 A16719 [1,0,0,0,1,0|1,0,1]=4 368 B9R1.12 CCCCc1ccco1 A13376 [1,0,0,0,1,0|2,0,0]=4 369 B9R1.12 CCCCc1cccs1 A12740 [1,0,0,0,1,0|2,0,0]=4 370 B9R1.12 CCCCc1ccsc1 H55795 [1,0,0,0,1,0|2,0,0]=4 371 B9R1.6 CC(=C)c1ccccc1 L03609 [1,0,0,0,1,0|0,0,2]=4 372 B9R1.6 CC(=O)c1ccccc1 A12727 [1,0,0,0,1,0|1,0,1]=4 373 B9R1.6 CC(C)c1ccccc1 A11864 [1,0,0,0,1,0|0,0,0]=2 374 B9R1.6 CC(C)c1cnccn1 A13891 [1,0,0,0,1,0|2,0,0]=4 375 B9R1.6 CC(c1ccccc1)Br A16839 [1,0,0,0,1,0|1,0,0]=3 376 B9R1.6 CC(c1ccccc1)N A15711 [1,0,0,0,1,0|0,0,0]=2 377 B9R1.6 CC(c1ccccc1)O A13837 [1,0,0,0,1,0|1,0,0]=3 378 B9R1.6 CC(c1ccccc1)S H26345 [1,0,0,0,1,0|1,0,0]=3 379 B9R1.6 CC(c1ccccc1)[Zn+] H58185 [1,0,0,0,1,0|1,0,0]=3 380 B9R1.6 CC(c1ccccn1)N H26046 [1,0,0,0,1,0|1,0,0]=3 381 B9R1.6 CC(c1cccnc1)N H26047 [1,0,0,0,1,0|1,0,0]=3 382 B9R1.6 CC(c1ccncc1)N H50303 [1,0,0,0,1,0|1,0,0]=3 383 B9R1.6 CC(c1ccncc1)O H58711 [1,0,0,0,1,0|2,0,0]=4 384 B9R1.6 CN(C)c1cc[nH+]cc1 H55010 [1,0,0,0,1,0|2,0,0]=4 385 B9R1.6 CN(C)c1ccccc1 A11916 [1,0,0,0,1,0|1,0,0]=3 386 B9R1.6 CN(C)c1ccccn1 L02513 [1,0,0,0,1,0|2,0,0]=4 387 B9R1.6 CN(C)c1ccncc1 A13016 [1,0,0,0,1,0|2,0,0]=4 388 B9R1.6 CN(C)c1ccncc1 H51715 [1,0,0,0,1,0|2,0,0]=4 389 B9R1.6 CN(c1ccccc1)N B22440 [1,0,0,0,1,0|1,0,0]=3 390 B9R1.6 CP(C)c1ccccc1 A17975 [1,0,0,0,1,0|1,0,0]=3 391 B9R1.6 CS(=O)c1ccccc1 A15009 [1,0,0,0,1,0|2,0,0]=4 392 B9R1.6 C[C@@H](c1ccccc1)N A12632 [1,0,0,0,1,0|0,0,0]=2 393 B9R1.6 C[C@@H](c1ccccc1)N L19118 [1,0,0,0,1,0|0,0,0]=2 394 B9R1.6 C[C@@H](c1ccccc1)O B21188 [1,0,0,0,1,0|1,0,0]=3 395 B9R1.6 C[C@H](c1ccccc1)N A10967 [1,0,0,0,1,0|0,0,0]=2 396 B9R1.6 C[C@H](c1ccccc1)N L19117 [1,0,0,0,1,0|0,0,0]=2 397 B9R1.6 C[C@H](c1ccccc1)O L19296 [1,0,0,0,1,0|1,0,0]=3 398 B9R1.6 C[C@H](c1ccncc1)O H51033 [1,0,0,0,1,0|2,0,0]=4 399 B9R1.6 C[SiH](C)c1ccccc1 L04558 [1,0,0,0,1,0|0,1,0]=3 400 B9R1.6 c1ccc(cc1)C(=N)N A16002 [1,0,0,0,1,0|1,0,1]=4 401 B9R1.6 c1ccc(cc1)C(=O)N A10501 [1,0,0,0,1,0|1,0,1]=4 402 B9R1.6 c1ccc(cc1)C(=S)N A12973 [1,0,0,0,1,0|1,0,1]=4 403 B9R1.13 CC(C)Cc1nccs1 A13759 [1,0,0,0,1,0|2,0,0]=4 404 B9R1.13 CN(C)CC1=CC=CC1 L07915 [1,0,0,0,1,0|1,0,1]=4 405 B9R1.11 CC(c1cccs1)NC H51109 [0,0,0,0,2,0|1,0,0]=3