0 B10R1.15 C[C@H](CN)c1ccccc1 WX600102 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.15 N=C(\c1ccccc1)/OC WXC04573 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.15 c1ccc(cc1)C(=O)CF WXFC0145 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.15 c1ccc(cc1)C(=S)NN WXC00705 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.15 c1ccc(cc1)[C@@H](CF)N WXFC0133 [0,0,0,0,0,0|2,0,0]=2 5 B10R1.15 c1ccc(cc1)[C@H](CF)N WXFC0134 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.15 c1ccc(cc1)\C(=N\O)\N WX690132 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.15 c1ccnc(c1)C(=O)CBr WX631026 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.15 c1cnccc1C(=O)CBr WX631022 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.6 B(c1cccnc1)(O)O WX654050 [1,0,0,0,0,0|3,0,0]=4 10 B9R1.6 B(c1ccncc1)(O)O WX654049 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.6 CC(c1ccccn1)N WX609027 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.6 CC(c1ccccn1)O WX642039 [1,0,0,0,0,0|1,0,0]=2 13 B9R1.6 CC(c1cccnc1)N WX609031 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.6 CC(c1cccnc1)O WX642141 [1,0,0,0,0,0|1,0,0]=2 15 B9R1.6 CC(c1ccncc1)N WX609038 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.6 CC(c1ccncc1)O WX642142 [1,0,0,0,0,0|1,0,0]=2 17 B9R1.6 CC(c1ncccn1)N WX609073 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.6 CC(c1ncccn1)O WX642042 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.8 CNCc1ccccn1 WX600188 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.8 CNCc1cccnc1 WX609032 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.8 CNCc1ccncc1 WX603083 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.8 c1cc(cnc1)CC#N WX683086 [1,0,0,0,0,0|2,0,1]=4 23 B9R1.8 c1cc(cnc1)CNN WX684003 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.8 c1ccnc(c1)CCN WX600199 [1,0,0,0,0,0|2,0,0]=3 25 B11R1.7 c1ccc(cc1)S(=O)(=O)CF WX690290 [0,1,0,0,0,0|3,0,0]=4 26 B11R1.16 c1ccc(cc1)C(=O)CC#N WX683081 [0,1,0,0,0,0|2,0,1]=4 27 B11R1.22 Cc1ccc(cc1)\C(=N/O)\N WX690131 [0,1,0,0,0,0|2,0,1]=4 28 B11R1.22 c1cc(ccc1C(CN)O)Br WX600145 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.22 c1cc(ccc1C(CO)N)F WX600173 [0,1,0,0,0,0|1,0,0]=2 30 B11R1.22 c1cc(ccc1\C(=N\O)\N)O WX690142 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.23 c1cc(cc(c1)Br)C(=O)CN WX602205 [0,1,0,0,0,0|2,0,1]=4 32 B11R1.23 c1cc(cc(c1)Br)C(CN)O WX600167 [0,1,0,0,0,0|2,0,0]=3 33 B11R1.23 c1cc(cc(c1)Br)\C(=N\O)\N WX690148 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.36 CC(C)C(=C)c1ccccc1 WXC02189 [0,1,0,0,0,0|1,0,2]=4 35 B11R1.36 CC(c1ccccc1)C(=N)N WX619918 [0,1,0,0,0,0|1,0,1]=3 36 B11R1.36 c1ccc(cc1)C(=O)C(F)F WXFC0144 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.222 CCC(=O)c1ccccc1Br WX626030 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.222 CCC(=O)c1ccccc1Cl WXC00823 [0,1,0,0,0,0|2,0,1]=4 39 B11R1.222 c1ccc(c(c1)C(=NO)N)Br WX690159 [0,1,0,0,0,0|2,0,1]=4 40 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl WX631003 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.222 c1ccc(c(c1)C(=O)CCl)N WX631029 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.222 c1ccc(c(c1)C(CN)O)Br WX603077 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.222 c1ccc(c(c1)\C(=N/O)\N)Cl WX690161 [0,1,0,0,0,0|2,0,1]=4 44 B11R2.1 Cn1c2ccccc2cn1 WX690064 [0,0,0,1,0,0|3,0,0]=4 45 B11R2.1 c1ccc2c(c1)CCC2O WX649087 [0,0,0,1,0,0|2,0,0]=3 46 B11R2.1 c1ccc2c(c1)c(co2)Br WX637107 [0,0,0,1,0,0|1,0,2]=4 47 B9R1.11 c1cc(oc1)C(CN)O WX600098 [0,0,0,0,1,0|3,0,0]=4 48 B11R1.40 c1ccc(cc1)C\C(=N/O)\N WX690150 [0,0,0,0,0,1|2,0,1]=4 49 B8R1.2 CNc1cccnc1 WX609454 [2,0,0,0,0,0|2,0,0]=4 50 B8R1.2 c1cc(cnc1)CO WX640285 [2,0,0,0,0,0|1,0,0]=3 51 B8R1.2 c1ccnc(c1)CO WX640282 [2,0,0,0,0,0|1,0,0]=3 52 B8R1.2 c1cnc(cn1)CO WX640335 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.2 c1cnc(nc1)CO WX640112 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.2 c1cnc(nc1)CO WXC04758 [2,0,0,0,0,0|2,0,0]=4 55 B8R1.2 c1cnccc1CO WX640289 [2,0,0,0,0,0|1,0,0]=3 56 B8R1.2 c1cncnc1CO WX640254 [2,0,0,0,0,0|2,0,0]=4 57 B10R1.13 B(c1ccc(cc1)N)(O)O WX650024 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.13 CC(c1ncc(cn1)O)O WX649075 [1,1,0,0,0,0|2,0,0]=4 59 B10R1.13 CN(C)c1ccc(cn1)Br WX637239 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.13 CN(C)c1ccc(cn1)N WX606099 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.13 C[C@@H](c1ncc(cn1)O)O WX649103 [1,1,0,0,0,0|2,0,0]=4 62 B10R1.28 CC(C)(c1ccccc1)N WX600125 [1,1,0,0,0,0|0,0,0]=2 63 B10R1.28 CC(C)(c1cccnc1)N WX600235 [1,1,0,0,0,0|1,0,0]=3 64 B10R1.61 B(c1ccccc1N)(O)O WX650019 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.61 B(c1ccccc1O)(O)O WX650052 [1,1,0,0,0,0|2,0,0]=4 66 B10R1.61 CC(C)c1c(cccn1)O WX645029 [1,1,0,0,0,0|1,0,0]=3 67 B10R1.61 CC(c1ccncc1F)Cl WX630339 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.61 c1ccc(c(c1)C(F)F)N WXFC0033 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.113 CC(=O)c1cccc(c1)Br WX633007 [1,1,0,0,0,0|0,0,2]=4 70 B10R1.113 CC(C)c1nccc(n1)Cl WXC04099 [1,1,0,0,0,0|2,0,0]=4 71 B10R1.113 CC(C)c1nccc(n1)O WXC04102 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.113 Cc1cccc(c1)[C@@H](C)O WXC01314 [1,1,0,0,0,0|0,0,0]=2 73 B10R1.113 Cc1cccc(c1)[C@H](C)O WXC01313 [1,1,0,0,0,0|0,0,0]=2 74 B10R1.113 c1cc(cc(c1)I)C(F)F WXFC0039 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.113 c1cc(cc(c1)N)C(F)F WX602046 [1,1,0,0,0,0|2,0,0]=4 76 B10R1.113 c1cc(cc(c1)O)C(F)F WXFC0040 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.1 c1c(cnc(n1)CCO)O WX649071 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.1 c1cc(ccc1CC#N)I WX634021 [1,1,0,0,0,0|1,0,1]=4 79 B10R1.1 c1cc(ccc1CNN)Cl WXC03194 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.1 c1cc(ccc1\C=N\O)Cl WX632026 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.4 c1ccc(c(c1)CNN)Cl WXC03184 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.4 c1ccc(c(c1)\C=N\O)Br WX633099 [1,1,0,0,0,0|1,0,1]=4 83 B10R1.10 CNCc1cccc(c1)O WX600071 [1,1,0,0,0,0|2,0,0]=4 84 B10R1.10 CSCc1cccc(c1)Br WX633087 [1,1,0,0,0,0|2,0,0]=4 85 B10R1.17 C1C=CCC(=C1)CCCO WX640164 [1,1,0,0,0,0|0,0,2]=4 86 B10R1.18 c1ccc(cc1)CC(=S)N WX619929 [1,1,0,0,0,0|0,1,1]=4 87 B12R1.17 CN(CCBr)c1cccc(c1)F WX630242 [0,2,0,0,0,0|2,0,0]=4 88 B12R1.20 c1cc(ccc1[C@@H](C(=O)O)N)F WX665059 [0,2,0,0,0,0|1,0,1]=4 89 B12R1.24 CCC(c1cccc(c1C)F)O WXC00114 [0,2,0,0,0,0|2,0,0]=4 90 B12R1.564 CC(C)([C@@H](c1ccccc1)N)O WXC04676 [0,2,0,0,0,0|1,0,0]=3 91 B10R2.7 c1ccc2c(c1)CNC2 WX604071 [1,0,0,1,0,0|2,0,0]=4 92 B12R2.24 CC1CNc2ccccc2O1 WX602053 [0,0,0,1,0,1|1,0,0]=3 93 B12R2.24 CC1CNc2ccccc2S1 WX604425 [0,0,0,1,0,1|1,0,0]=3 94 B12R2.24 CC1COc2ccccc2N1 WX604081 [0,0,0,1,0,1|0,0,0]=2 95 B12R2.24 CC1CSc2ccccc2N1 WX604182 [0,0,0,1,0,1|0,1,0]=3 96 B12R2.24 c1ccc2c(c1)CC(CN2)N WX604740 [0,0,0,1,0,1|2,0,0]=4 97 B12R2.32 c1ccc2c(c1)[nH]c(n2)CO WX640277 [0,0,0,1,0,1|1,0,1]=4 98 B12R2.32 c1ccc2c(c1)cc(o2)CO WX640356 [0,0,0,1,0,1|0,0,2]=4 99 B12R2.32 c1ccc2c(c1)cc(s2)CO WX640279 [0,0,0,1,0,1|0,0,2]=4 100 B12R2.2058 c1ccc(cc1)NC2CCC2 WXC03097 [0,0,0,1,0,1|1,0,0]=3 101 B12R2.48 c1ccc(cc1)C2(CC2)C#N WXC00522 [0,1,0,1,0,0|1,0,1]=4 102 B12R2.48 c1ccc(cc1)C2(CC2)CO WX640310 [0,1,0,1,0,0|0,0,0]=2 103 B12R2.2403 CC1(CCc2c1cccc2)O WX644012 [0,1,0,1,0,0|1,0,0]=3 104 B12R2.2403 CC1(CNc2c1cccn2)C WXC02325 [0,1,0,1,0,0|2,0,0]=4 105 B12R2.1 c1ccc/2c(c1)CC\C2=N/O WX690241 [0,1,0,1,0,0|1,0,1]=4 106 B12R2.1 c1ccc2c(c1)c(c[nH]2)CO WX640278 [0,1,0,1,0,0|0,0,2]=4 107 B12R2.1 c1ccc2c(c1)c(no2)CBr WX630337 [0,1,0,1,0,0|1,0,1]=4 108 B12R2.2 c1ccc(cc1)C2CCNC2 WX604689 [0,1,0,1,0,0|1,0,0]=3 109 B12R2.1081 CC1CNCc2c1cccc2 WX604177 [0,1,0,1,0,0|1,0,0]=3 110 B12R2.1081 CC1CNCc2c1cccc2 WX604759 [0,1,0,1,0,0|1,0,0]=3 111 B12R2.1081 CC1c2ccccc2CCN1 WX604078 [0,1,0,1,0,0|1,0,0]=3 112 B12R2.1081 CC1c2ccccc2CCN1 WX604757 [0,1,0,1,0,0|1,0,0]=3 113 B12R2.1081 C[C@@H]1CNCc2c1cccc2 WX604648 [0,1,0,1,0,0|1,0,0]=3 114 B12R2.1081 C[C@H]1CNCc2c1cccc2 WX604647 [0,1,0,1,0,0|1,0,0]=3 115 B12R2.1081 c1ccc2c(c1)[C@@H](CCO2)N WX604247 [0,1,0,1,0,0|1,0,0]=3 116 B12R2.1081 c1ccc2c(c1)[C@H](CCO2)N WX604750 [0,1,0,1,0,0|1,0,0]=3 117 B12R2.1081 c1ccc2c(c1)[C@H](CCO2)N WXC00813 [0,1,0,1,0,0|1,0,0]=3 118 B12R2.2028 C[C@@H]1c2ccccc2C(=O)N1 WX619181 [0,1,0,1,0,0|0,0,2]=4 119 B12R2.612 Cc1ccc2c(c1)CCC2O WX642032 [0,1,0,1,0,0|2,0,0]=4 120 B12R2.612 c1cc2c(cc1Br)CCC2O WX633165 [0,1,0,1,0,0|2,0,0]=4 121 B12R2.612 c1cc2c(cc1Br)CC[C@H]2O WX633147 [0,1,0,1,0,0|2,0,0]=4 122 B12R2.132 Cc1ccc2c(c1)C(CC2)O WX642123 [0,1,0,1,0,0|2,0,0]=4 123 B12R2.132 Cc1ccc2c(c1)[C@H](CC2)N WXC03237 [0,1,0,1,0,0|2,0,0]=4 124 B12R2.132 c1cc2c(cc1Br)C(CC2)N WX604358 [0,1,0,1,0,0|2,0,0]=4 125 B12R2.196 Cc1cccc2c1CCC2O WX642033 [0,1,0,1,0,0|2,0,0]=4 126 B12R2.203 Cc1cccc2c1C(CC2)O WX642122 [0,1,0,1,0,0|2,0,0]=4 127 B8R1.7 CC(c1c[nH]cn1)O WX642070 [1,0,0,0,1,0|2,0,0]=4 128 B8R1.7 CC(c1cccs1)N WX609033 [1,0,0,0,1,0|2,0,0]=4 129 B8R1.7 CC(c1cccs1)O WX642064 [1,0,0,0,1,0|1,0,0]=3 130 B8R1.8 c1cc(oc1)CCO WX640320 [1,0,0,0,1,0|1,0,0]=3 131 B8R1.8 c1cc(sc1)CCN WX600201 [1,0,0,0,1,0|2,0,0]=4