0 B10R1.18 CC(=O)Oc1ccccc1 QY9 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 CC(C)Cc1ccccc1 I4B [0,0,0,0,0,0|1,0,0]=1 2 B10R1.18 C[C@@H](Cc1ccccc1)N 1WE [0,0,0,0,0,0|0,0,0]=0 3 B10R1.18 C[C@H](Cc1ccccc1)N FRD [0,0,0,0,0,0|0,0,0]=0 4 B10R1.18 N=C(\N)/Nc1ccccc1 PL0 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.18 c1ccc(cc1)CC(=O)O PAC [0,0,0,0,0,0|2,0,1]=3 6 B10R1.18 c1ccc(cc1)NC(=O)N PHU [0,0,0,0,0,0|2,0,1]=3 7 B10R1.18 c1ccc(cc1)NC(=S)N URS [0,0,0,0,0,0|2,0,1]=3 8 B10R1.18 c1cnccc1NC(=S)N YS6 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.8 CCCc1ccccc1 3H0 [1,0,0,0,0,0|0,0,0]=1 10 B9R1.8 CCOc1ccccc1 16Q [1,0,0,0,0,0|1,0,0]=2 11 B9R1.8 CCSc1ccccc1 16M [1,0,0,0,0,0|1,0,0]=2 12 B9R1.8 CNCc1ccccc1 271 [1,0,0,0,0,0|1,0,0]=2 13 B9R1.8 CSCc1ccccc1 PTF [1,0,0,0,0,0|1,0,0]=2 14 B9R1.8 c1cc(cnc1)CCN 45X [1,0,0,0,0,0|1,0,0]=2 15 B9R1.8 c1ccc(cc1)CC=O HY1 [1,0,0,0,0,0|1,0,1]=3 16 B9R1.8 c1ccc(cc1)CCCl CEE [1,0,0,0,0,0|1,0,0]=2 17 B9R1.8 c1ccc(cc1)CCO PEL [1,0,0,0,0,0|1,0,0]=2 18 B9R1.8 c1ccc(cc1)CC[NH3+] PEA [1,0,0,0,0,0|0,0,1]=2 19 B9R1.8 c1ccc(cc1)CNN BZZ [1,0,0,0,0,0|1,0,0]=2 20 B9R1.8 c1ccc(cc1)CON OBZ [1,0,0,0,0,0|1,0,0]=2 21 B9R1.8 c1ccc(cc1)N=C=S FTE [1,0,0,0,0,0|2,0,1]=4 22 B9R1.8 c1ccc(cc1)NC=O FAN [1,0,0,0,0,0|2,0,1]=4 23 B9R1.8 c1ccc(cc1)NC=S 0FI [1,0,0,0,0,0|2,0,1]=4 24 B11R1.20 CC(=O)Nc1ccc(cc1)O NNS [0,1,0,0,0,0|2,0,1]=4 25 B11R1.20 CC(=O)Nc1ccc(cc1)O TYL [0,1,0,0,0,0|2,0,1]=4 26 B11R1.20 C[C@H](Cc1ccc(cc1)O)N AEG [0,1,0,0,0,0|0,0,0]=1 27 B11R1.20 c1cc(ccc1CC(=O)O)O 4HP [0,1,0,0,0,0|2,0,1]=4 28 B11R1.36 C[C@H]([C@@H](c1ccccc1)O)N NPU [0,1,0,0,0,0|0,0,0]=1 29 B11R1.36 C[C@H](c1ccccc1)C(=O)O GRO [0,1,0,0,0,0|2,0,1]=4 30 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N 004 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)O SMN [0,1,0,0,0,0|2,0,1]=4 32 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)N PG9 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)N PGY [0,1,0,0,0,0|2,0,1]=4 34 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)O RMN [0,1,0,0,0,0|2,0,1]=4 35 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)S RTD [0,1,0,0,0,0|2,0,1]=4 36 B11R1.40 CC[C@H](Cc1ccccc1)N PO0 [0,1,0,0,0,0|0,0,0]=1 37 B11R1.40 C[C@@H](Cc1ccccc1)NC B40 [0,1,0,0,0,0|0,0,0]=1 38 B11R1.40 c1ccc(cc1)C[C@@H](C=O)N PHA [0,1,0,0,0,0|0,0,1]=2 39 B11R1.40 c1ccc(cc1)C[C@@H](CO)N PHL [0,1,0,0,0,0|0,0,0]=1 40 B11R1.40 c1ccc(cc1)C[C@@H](CO)O PPP [0,1,0,0,0,0|1,0,0]=2 41 B11R1.40 c1ccc(cc1)C[C@@H]([C-]=O)[NH-] PHE_LL [0,1,0,0,0,0|0,0,2]=3 42 B11R1.40 c1ccc(cc1)C[C@@H]([C-]=O)[NH3+] PHE_LSN3 [0,1,0,0,0,0|0,0,2]=3 43 B11R1.40 c1ccc(cc1)C[C@H](CO)N PDH [0,1,0,0,0,0|0,0,0]=1 44 B11R1.40 c1ccc(cc1)NC(=O)ON PHJ [0,1,0,0,0,0|2,0,1]=4 45 B11R1.86 Cc1ccccc1NC(=S)N 5Q5 [0,1,0,0,0,0|2,0,1]=4 46 B11R1.86 c1ccc(c(c1)CC(=O)O)O OHP [0,1,0,0,0,0|2,0,1]=4 47 B11R1.157 CC(=O)Nc1cccc(c1)N N3M [0,1,0,0,0,0|2,0,1]=4 48 B11R1.157 c1cc(cc(c1)O)CC(=O)O 3HP [0,1,0,0,0,0|2,0,1]=4 49 B11R1.509 c1ccc(cc1)CP(=O)(O)O B85 [0,1,0,0,0,0|3,0,0]=4 50 B11R1.509 c1ccc(cc1)CS(=O)(=O)O IOX [0,1,0,0,0,0|3,0,0]=4 51 B11R1.509 c1ccc(cc1)CS(=O)(=O)O PMS [0,1,0,0,0,0|3,0,0]=4 52 B11R2.4 c1ccc(cc1)[C@@H]2C[C@H]2N GJZ [0,0,0,1,0,0|0,0,0]=1 53 B11R2.4 c1ccc(cc1)[C@H]2C[C@@H]2[NH3+] TPA [0,0,0,1,0,0|0,0,1]=2 54 B11R2.10 C1=CC2=NC(N=C2C=C1)N 270 [0,0,0,1,0,0|2,0,0]=3 55 B11R2.10 Cc1cc2ccccc2[nH]1 2MI [0,0,0,1,0,0|0,0,2]=3 56 B11R2.10 c1ccc2c(c1)CC(C2)N XM0 [0,0,0,1,0,0|0,0,0]=1 57 B11R2.10 c1ccc2c(c1)[nH]c(n2)N AX7 [0,0,0,1,0,0|2,0,1]=4 58 B11R2.10 c1ccc2c(c1)nc(s2)N ABV [0,0,0,1,0,0|2,0,1]=4 59 B9R1.6 B(c1ccccc1)(O)O PBC [0,0,0,0,1,0|3,0,0]=4 60 B9R1.6 CC(=O)c1ccccc1 AC0 [0,0,0,0,1,0|1,0,1]=3 61 B9R1.6 C[C@@H](c1ccccc1)N 98B [0,0,0,0,1,0|0,0,0]=1 62 B9R1.6 C[C@@H](c1ccccc1)O SS1 [0,0,0,0,1,0|1,0,0]=2 63 B9R1.6 C[C@H](c1ccccc1)N QSC [0,0,0,0,1,0|0,0,0]=1 64 B9R1.6 C[C@H](c1ccccc1)O SS2 [0,0,0,0,1,0|1,0,0]=2 65 B9R1.6 N=C(/c1ccccc1)\N BEN [0,0,0,0,1,0|1,0,1]=3 66 B9R1.6 c1cc(cnc1)C(=O)N NCA [0,0,0,0,1,0|2,0,1]=4 67 B9R1.6 c1ccc(cc1)C(=N)N BDN [0,0,0,0,1,0|1,0,1]=3 68 B9R1.6 c1ccc(cc1)C(=O)N UNU [0,0,0,0,1,0|1,0,1]=3 69 B9R1.6 c1ccc(cc1)C(=O)O BEZ [0,0,0,0,1,0|2,0,1]=4 70 B9R1.6 c1ccc(cc1)C(=O)O BOX [0,0,0,0,1,0|2,0,1]=4 71 B9R1.6 c1ccc(cc1)C(=[NH2+])N BAM [0,0,0,0,1,0|1,0,1]=3 72 B9R1.6 c1ccc(cc1)[N+](=O)[O-] NBZ [0,0,0,0,1,0|3,0,0]=4 73 B9R1.6 c1ccnc(c1)C(=O)N WM1 [0,0,0,0,1,0|2,0,1]=4 74 B9R1.6 c1cnccc1C(=N)N NTN [0,0,0,0,1,0|2,0,1]=4 75 B11R1.91 B(CCc1ccccc1)(O)O PBA [0,0,0,0,0,1|3,0,0]=4 76 B11R1.91 CC(=O)OCc1ccccc1 J0Z [0,0,0,0,0,1|1,0,1]=3 77 B11R1.91 C[C@H](CCc1ccccc1)N 4DD [0,0,0,0,0,1|0,0,0]=1 78 B11R1.91 c1ccc(cc1)CCC(=O)O HCI [0,0,0,0,0,1|2,0,1]=4 79 B11R1.91 c1ccc(cc1)CNC(=O)O PMQ [0,0,0,0,0,1|2,0,1]=4 80 B11R1.91 c1ccc(cc1)COC(=O)Cl PHQ [0,0,0,0,0,1|2,0,1]=4 81 B11R1.91 c1ccc(cc1)COC(=O)O BGG [0,0,0,0,0,1|2,0,1]=4 82 B11R1.91 c1ccc(cc1)OCC(=O)N PO6 [0,0,0,0,0,1|1,0,1]=3 83 B11R1.91 c1ccc(cc1)OCC(=O)O 06Y [0,0,0,0,0,1|2,0,1]=4 84 B11R1.91 c1ccc(cc1)\C=C\C(=O)N DH6 [0,0,0,0,0,1|1,0,2]=4 85 B8R1.2 B1(C=CC=CN1)CC 6OQ [2,0,0,0,0,0|2,0,0]=4 86 B8R1.2 B1C=CC=CN1CC B24 [2,0,0,0,0,0|2,0,0]=4 87 B8R1.2 C=Cc1ccccc1 SYN [2,0,0,0,0,0|0,0,2]=4 88 B8R1.2 CCc1ccccc1 N2B [2,0,0,0,0,0|0,0,0]=2 89 B8R1.2 CCc1ccccc1 PYJ [2,0,0,0,0,0|0,0,0]=2 90 B8R1.2 CNc1ccccc1 1MR [2,0,0,0,0,0|1,0,0]=3 91 B8R1.2 COc1cccnc1 282 [2,0,0,0,0,0|2,0,0]=4 92 B8R1.2 CSc1ccccc1 16R [2,0,0,0,0,0|1,0,0]=3 93 B8R1.2 c1cc(cnc1)CN 0YC [2,0,0,0,0,0|1,0,0]=3 94 B8R1.2 c1cc(cnc1)CO PYF [2,0,0,0,0,0|2,0,0]=4 95 B8R1.2 c1cc(cnc1)CS PY2 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.2 c1ccc(cc1)C=O HBX [2,0,0,0,0,0|1,0,1]=4 97 B8R1.2 c1ccc(cc1)CCl 9CL [2,0,0,0,0,0|1,0,0]=3 98 B8R1.2 c1ccc(cc1)CN ABN [2,0,0,0,0,0|0,0,0]=2 99 B8R1.2 c1ccc(cc1)CO 010 [2,0,0,0,0,0|1,0,0]=3 100 B8R1.2 c1ccc(cc1)N=O NBE [2,0,0,0,0,0|2,0,0]=4 101 B8R1.2 c1ccc(cc1)NN PHZ [2,0,0,0,0,0|1,0,0]=3 102 B8R1.2 c1ccc(cc1)[As]=O PA0 [2,0,0,0,0,0|2,0,0]=4 103 B8R1.2 c1ccnc(c1)CN APY [2,0,0,0,0,0|1,0,0]=3 104 B8R1.2 c1cnccc1CN NNW [2,0,0,0,0,0|1,0,0]=3 105 B8R1.2 c1cnccc1CO PY7 [2,0,0,0,0,0|2,0,0]=4 106 B10R0.97 CC(C)C/C=C/C=C\C(=O)O FA7 [0,1,1,0,0,0|2,0,0]=4 107 B10R1.1 c1cc(ccc1CC#N)O 3AQ [1,1,0,0,0,0|0,0,2]=4 108 B10R1.1 c1cc(ccc1CCN)O AEF [1,1,0,0,0,0|0,0,0]=2 109 B10R1.1 c1cc(ccc1CCO)F 4FA [1,1,0,0,0,0|1,0,0]=3 110 B10R1.1 c1cc(ccc1CCO)O YRL [1,1,0,0,0,0|1,0,0]=3 111 B10R1.4 C1=CC=[N](C(=C1)N)CCO 1LN [1,1,0,0,0,0|2,0,0]=4 112 B10R1.4 C=CCc1ccccc1O 2LP [1,1,0,0,0,0|0,0,2]=4 113 B10R1.4 CCCc1ccccc1N PRY [1,1,0,0,0,0|0,0,0]=2 114 B10R1.4 CCCc1ccccc1O JZ4 [1,1,0,0,0,0|0,0,0]=2 115 B10R1.4 CCOc1ccccc1O 261 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.4 c1ccc(c(c1)CCN)F BSX [1,1,0,0,0,0|0,0,0]=2 117 B10R1.15 C#C[C@H](c1ccccc1)O 1DJ [1,1,0,0,0,0|0,0,2]=4 118 B10R1.15 CCC(=O)c1ccccc1 I1E [1,1,0,0,0,0|0,0,1]=3 119 B10R1.15 CC[C@@H](C)c1ccccc1 3GY [1,1,0,0,0,0|0,0,0]=2 120 B10R1.15 C[C@H](C=O)c1ccccc1 1LP [1,1,0,0,0,0|1,0,1]=4 121 B10R1.15 c1ccc(cc1)C(=O)CO HXT [1,1,0,0,0,0|1,0,1]=4 122 B10R1.15 c1ccc(cc1)C(=O)NN WM4 [1,1,0,0,0,0|1,0,1]=4 123 B10R1.15 c1ccc(cc1)[C@@H](C#N)O MNN [1,1,0,0,0,0|0,0,2]=4 124 B10R1.15 c1ccc(cc1)[C@H](C#N)O MXN [1,1,0,0,0,0|0,0,2]=4 125 B10R1.15 c1ccc(cc1)[C@H](CO)O FEH [1,1,0,0,0,0|1,0,0]=3 126 B10R1.17 C=CCNc1ccccc1 NYL [1,1,0,0,0,0|0,0,2]=4 127 B10R1.17 CCCCc1ccccc1 N4B [1,1,0,0,0,0|0,0,0]=2 128 B10R1.17 c1ccc(cc1)CCC=O 3PL [1,1,0,0,0,0|0,0,1]=3 129 B10R1.17 c1ccc(cc1)CCCCl LT1 [1,1,0,0,0,0|0,0,0]=2 130 B10R1.17 c1ccc(cc1)CCC[NH3+] PRA [1,1,0,0,0,0|0,0,0]=2 131 B10R1.17 c1ccc(cc1)CNC=O BNF [1,1,0,0,0,0|1,0,1]=4 132 B10R1.17 c1ccc(cc1)CNC=S 9BE [1,1,0,0,0,0|1,0,1]=4 133 B10R1.17 c1ccc(cc1)COC=O BZO [1,1,0,0,0,0|1,0,1]=4 134 B10R1.17 c1ccc(cc1)COC=O CBZ [1,1,0,0,0,0|1,0,1]=4 135 B10R1.17 c1ccc(cc1)NCC#N 264 [1,1,0,0,0,0|0,0,2]=4 136 B10R1.17 c1ccc(cc1)OCCCl 258 [1,1,0,0,0,0|1,0,0]=3 137 B10R1.17 c1ccc(cc1)OCCO 268 [1,1,0,0,0,0|1,0,0]=3 138 B10R1.17 c1cnccc1NCCN 01R [1,1,0,0,0,0|1,0,0]=3 139 B10R1.13 CC(=O)c1ccc(cc1)Br PBP [0,1,0,0,1,0|1,0,1]=4 140 B10R1.13 CC(=O)c1ccc(cc1)O AC6 [0,1,0,0,1,0|1,0,1]=4 141 B10R1.13 CC(C)c1ccc(cc1)N ISO [0,1,0,0,1,0|1,0,0]=3 142 B10R1.13 Cc1ccc(cc1)C(C)C MML [0,1,0,0,1,0|1,0,0]=3 143 B10R1.13 c1cc(ccc1C(=O)N)O HBD [0,1,0,0,1,0|1,0,1]=4 144 B10R1.13 c1cc(ccc1C(=[NH2+])N)N PBZ [0,1,0,0,1,0|1,0,1]=4 145 B10R1.28 CS(=O)(=O)c1ccccc1 SML [0,1,0,0,1,0|2,0,0]=4 146 B10R1.28 c1ccc(cc1)S(=O)(=O)N FB2 [0,1,0,0,1,0|2,0,0]=4 147 B10R1.61 CC(=O)c1ccccc1N VNJ [0,1,0,0,1,0|1,0,1]=4 148 B10R1.61 CC(C)c1ccccc1O IP0 [0,1,0,0,1,0|1,0,0]=3 149 B10R1.61 c1ccc(c(c1)C(=O)N)N 2AE [0,1,0,0,1,0|1,0,1]=4 150 B10R1.61 c1ccc(c(c1)C(=O)N)O OHB [0,1,0,0,1,0|1,0,1]=4 151 B10R1.113 CC(=O)c1cccc(c1)N 3AO [0,1,0,0,1,0|1,0,1]=4 152 B10R1.113 CC(=O)c1cccc(c1)O 53C [0,1,0,0,1,0|1,0,1]=4 153 B10R1.113 c1cc(cc(c1)Cl)C(=O)N WCE [0,1,0,0,1,0|1,0,1]=4 154 B10R1.113 c1cc(cc(c1)N)C(=O)N 3AB [0,1,0,0,1,0|1,0,1]=4 155 B10R1.27 c1c([nH+]c[nH]1)C[C@@H](CO)N HSO [0,1,0,0,1,0|2,0,0]=4 156 B12R1.21 N=C(/N)\SCc1ccc(cc1)Cl F90 [0,1,0,0,0,1|1,0,1]=4 157 B12R1.21 c1cc(ccc1CCC(=O)N)Br TCF [0,1,0,0,0,1|1,0,1]=4 158 B12R1.21 c1cc(ccc1CCC(=O)N)O SGI [0,1,0,0,0,1|1,0,1]=4 159 B12R1.43 CC(=O)[C@H](Cc1ccccc1)N HPC [0,1,0,0,0,1|1,0,1]=4 160 B12R1.43 C[C@@H]([C@H](Cc1ccccc1)N)O PS0 [0,1,0,0,0,1|1,0,0]=3 161 B12R1.43 C[C@H]([C@H](Cc1ccccc1)N)O HPB [0,1,0,0,0,1|1,0,0]=3 162 B12R1.43 C[C@H]([C@H](Cc1ccccc1)N)O PR0 [0,1,0,0,0,1|1,0,0]=3 163 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)N)N NFA [0,1,0,0,0,1|1,0,1]=4 164 B12R1.43 c1ccc(cc1)C[C@@H](C(O)O)N HPH [0,1,0,0,0,1|2,0,0]=4 165 B12R1.43 c1ccc(cc1)C[C@@H](C(O)O)N TPH [0,1,0,0,0,1|2,0,0]=4 166 B12R1.125 N=C(/N)\SCc1ccccc1Cl F06 [0,1,0,0,0,1|1,0,1]=4 167 B12R1.4 COc1ccc(cc1)CC(=O)N ZHZ [0,2,0,0,0,0|1,0,1]=4 168 B12R1.49 C[C@@H](Cc1ccc(cc1)O)NC 1WF [0,2,0,0,0,0|0,0,0]=2 169 B12R1.49 c1cc(ccc1CC(=O)NN)F 45Y [0,2,0,0,0,0|1,0,1]=4 170 B12R1.49 c1cc(ccc1C[C@@H](C=O)N)O TYB [0,2,0,0,0,0|0,0,1]=3 171 B12R1.49 c1cc(ccc1C[C@@H](CO)N)O TYE [0,2,0,0,0,0|0,0,0]=2 172 B12R1.49 c1cc(ccc1C[C@@H]([C-]=O)[NH-])O TYR_LL [0,2,0,0,0,0|0,0,2]=4 173 B12R1.49 c1cc(ccc1C[C@@H]([C-]=O)[NH-])[O-] TYR_LL_DHH [0,2,0,0,0,0|0,0,2]=4 174 B12R1.49 c1cc(ccc1C[C@@H]([C-]=O)[NH3+])O TYR_LSN3 [0,2,0,0,0,0|0,0,2]=4 175 B12R1.49 c1cc(ccc1C[C@@H]([C-]=O)[NH3+])[O-] TYR_LSN3_DHH [0,2,0,0,0,0|0,0,2]=4 176 B12R1.34 C[C@@H](c1ccccc1)N(C)C=O PHC [0,2,0,0,0,0|2,0,0]=4 177 B12R1.34 c1ccc(cc1)[C@@H]([C@H](CO)O)N TA2 [0,2,0,0,0,0|1,0,0]=3 178 B12R1.225 C[C@@H](c1cccc(c1)O)N(C)C SAF [0,2,0,0,0,0|2,0,0]=4 179 B12R1.32 CCSC(=Nc1ccccc1)N PTU [0,2,0,0,0,0|1,0,1]=4 180 B10R2.6 c1ccc(cc1)[C@@H]2CO2 RSO [1,0,0,1,0,0|1,0,0]=3 181 B10R2.7 c1ccc2c(c1)CC=C2 DEN [1,0,0,1,0,0|0,0,2]=4 182 B10R2.7 c1ccc2c(c1)CCC2 16N [1,0,0,1,0,0|0,0,0]=2 183 B10R2.7 c1ccc2c(c1)CCN2 IDM [1,0,0,1,0,0|0,0,0]=2 184 B10R2.7 c1ccc2c(c1)[nH]cn2 BZI [1,0,0,1,0,0|1,0,1]=4 185 B10R2.7 c1ccc2c(c1)[nH]nn2 0CT [1,0,0,1,0,0|2,0,0]=4 186 B10R2.7 c1ccc2c(c1)cc[nH]2 IND [1,0,0,1,0,0|0,0,2]=4 187 B10R2.7 c1ccc2c(c1)cn[nH]2 LZ1 [1,0,0,1,0,0|1,0,1]=4 188 B12R2.24 c1ccc2c(c1)N=C(CS2)N 4JT [0,0,0,1,0,1|1,0,1]=4 189 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 1P8 [0,1,0,1,0,0|1,0,1]=4 190 B12R2.606 c1cc2c(cc1Cl)NC(=O)C2 ES2 [0,1,0,1,0,0|1,0,1]=4 191 B12R2.18 CN1Cc2ccccc2C1=O 5WV [0,1,0,1,0,0|2,0,0]=4 192 B12R2.18 Cn1c2ccccc2nc1N ES7 [0,1,0,1,0,0|1,0,1]=4 193 B12R2.18 c1ccc2c(c1)C[C@H]([C@@H]2O)O 5V4 [0,1,0,1,0,0|1,0,0]=3 194 B12R2.18 c1ccc2c(c1)C[C@H]([C@H]2N)O 00X [0,1,0,1,0,0|1,0,0]=3 195 B12R2.32 CNc1[nH]c2ccccc2n1 1M2 [0,1,0,1,0,0|1,0,1]=4 196 B12R2.32 c1ccc2c(c1)[nH]c(n2)CO XIY [0,1,0,1,0,0|1,0,1]=4 197 B12R2.32 c1ccc2c(c1)[nH]c(n2)CS 2XO [0,1,0,1,0,0|1,0,1]=4 198 B8R1.8 c1c(nc[nH]1)CCN HSM [1,0,0,0,1,0|2,0,0]=4 199 B8R1.8 c1cc(oc1)CCN 56T [1,0,0,0,1,0|1,0,0]=3 200 B12R1.252 CC(=O)NCCc1ccccc1 54W [0,0,0,0,0,2|1,0,1]=4