0 B11R1.15 CC(c1ccc(o1)C)N=C=O 1P01ALEB [0,0,0,0,0,0|1,0,1]=2 1 B11R1.15 CC(c1ccc(s1)C)N=C=O 1P01A1DX [0,0,0,0,0,0|1,1,1]=3 2 B11R1.15 COCC(c1ccc(o1)C)N 1P019TYA [0,0,0,0,0,0|3,0,0]=3 3 B11R1.15 Cc1ccc(o1)C(=O)CC#N 1P01BF28 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.15 Cc1ccc(o1)[C@@H](CCO)N 1P01XCAX [0,0,0,0,0,0|1,0,2]=3 5 B10R1.11 C=CCC(c1ccco1)O 1P00EE7O [1,0,0,0,0,0|2,0,0]=3 6 B10R1.11 CCCC(c1ccco1)N 1P01ATAY [1,0,0,0,0,0|2,0,1]=4 7 B10R1.11 COCC(c1ccco1)N 1P019TYB [1,0,0,0,0,0|3,0,0]=4 8 B10R1.11 N#CCC(c1ccco1)O 1P01BNU5 [1,0,0,0,0,0|2,0,1]=4 9 B10R1.11 OCCC(c1ccco1)N 1P019ZEL [1,0,0,0,0,0|1,0,2]=4 10 B10R1.14 CC(c1ccc(o1)C)C#N 1P01EK54 [1,0,0,0,0,0|1,0,1]=3 11 B10R1.14 CC(c1nc(cs1)C)CN 1P008VMB [1,0,0,0,0,0|3,0,0]=4 12 B10R1.14 CC(c1ncc(s1)C)CN 1P01A7JW [1,0,0,0,0,0|2,1,0]=4 13 B10R1.14 CC(n1ccc(n1)C)CN 1P00HEDB [1,0,0,0,0,0|3,0,0]=4 14 B10R1.14 CCC(=O)c1ccc(o1)C 1P0038SV [1,0,0,0,0,0|1,0,2]=4 15 B10R1.14 CCC(c1ccc(o1)C)N 1P00231Y [1,0,0,0,0,0|1,0,1]=3 16 B10R1.14 CCC(c1csc(n1)C)C 1P028F5I [1,0,0,0,0,0|2,0,1]=4 17 B10R1.14 CC[C@@H](c1ccc(o1)C)N 1P00232F [1,0,0,0,0,0|1,0,1]=3 18 B10R1.14 CC[C@@H](c1ccc(o1)C)N 1P00DG8E [1,0,0,0,0,0|1,0,1]=3 19 B10R1.14 CC[C@H](c1ccc(o1)C)N 1P00G42G [1,0,0,0,0,0|1,0,1]=3 20 B10R1.14 CNC(c1ccc(s1)C)C 1P00HEUN [1,0,0,0,0,0|1,1,1]=4 21 B10R1.14 Cc1ccc(o1)C(=O)CBr 1P001UJS [1,0,0,0,0,0|2,0,1]=4 22 B10R1.14 Cc1ccc(o1)C(CN)N 1P01A3GH [1,0,0,0,0,0|2,0,0]=3 23 B10R1.14 Cc1ccc(o1)C(CN)O 1P01AKYQ [1,0,0,0,0,0|2,0,0]=3 24 B10R1.14 Cc1ccc(s1)C(CO)N 1P019TFN [1,0,0,0,0,0|1,1,1]=4 25 B10R1.16 CCNCc1ccc(o1)C 1P00J2EX [1,0,0,0,0,0|2,0,1]=4 26 B10R1.16 CONCc1ccc(o1)C 1P01C0UN [1,0,0,0,0,0|3,0,0]=4 27 B10R1.16 Cc1ccc(o1)CCC=O 1P007D0Q [1,0,0,0,0,0|0,0,0]=1 28 B10R1.16 Cc1ccc(o1)\C=C\C=O 1P00DIF2 [1,0,0,0,0,0|0,0,2]=3 29 B10R1.16 Cc1ccc(s1)CCC#N 1P0288HP [1,0,0,0,0,0|1,1,1]=4 30 B10R1.16 Cc1ccc(s1)CCCN 1P00016G [1,0,0,0,0,0|1,1,1]=4 31 B10R1.16 O=CCCc1cnn(c1)C 1P01C2I0 [1,0,0,0,0,0|3,0,0]=4 32 B10R1.16 [N-]=[N+]=NCc1ccc(o1)C 1P01A2XZ [1,0,0,0,0,0|3,0,0]=4 33 B12R1.29 COCCC(c1ccc(o1)C)N 1P01A5KT [0,1,0,0,0,0|1,0,2]=4 34 B12R1.103 CC(=O)OC(c1nnc(o1)C)C 1P01A6C7 [0,1,0,0,0,0|3,0,0]=4 35 B12R1.103 CC(n1ccc(n1)C)CC(=O)O 1P01C4X8 [0,1,0,0,0,0|2,0,0]=3 36 B12R1.103 Cc1cc(sc1)C(CC(=O)O)O 1P028724 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.103 Cc1ccc(o1)C(CC(=O)O)N 1P00DDMX [0,1,0,0,0,0|1,0,0]=2 38 B12R1.103 Cc1ccc(o1)C(CC(=O)O)N 1P027OEC [0,1,0,0,0,0|1,0,0]=2 39 B12R1.103 Cc1ccc(o1)[C@H](CC(=O)O)N 1P01AH77 [0,1,0,0,0,0|1,0,0]=2 40 B12R1.103 Cc1ccc(o1)[C@H](CC(=O)O)N 1P01AIGB [0,1,0,0,0,0|1,0,0]=2 41 B12R1.103 NC(c1ccc(s1)Cl)CC(=O)O 1P01B4PB [0,1,0,0,0,0|2,1,0]=4 42 B12R1.103 N[C@@H](c1ccc(s1)Cl)CC(=O)O 1P019ZCT [0,1,0,0,0,0|2,1,0]=4 43 B12R1.103 OC(=O)CC(c1cnn(c1)C)C 1P01C3LV [0,1,0,0,0,0|3,0,0]=4 44 B12R1.312 COCC(c1ccc(o1)CC)N 1P01ALCH [0,1,0,0,0,0|3,0,0]=4 45 B10R0.3 O=CCC(CCC=C(C)C)C 1P0084IZ [0,0,1,0,0,0|1,0,2]=4 46 B10R0.3 O=CC[C@@H](CCC=C(C)C)C 1P003BT9 [0,0,1,0,0,0|1,0,2]=4 47 B10R0.3 O=CC[C@H](CCC=C(C)C)C 1P003BS2 [0,0,1,0,0,0|1,0,2]=4 48 B12R2.73 Cc1ccc(o1)[C@@H]2C[C@H]2CN 1P028TQ4 [0,0,0,1,0,0|1,0,1]=3 49 B12R2.76 O=C1CC(C1)c2ccc(s2)Cl 1P028L10 [0,0,0,1,0,0|1,1,0]=3 50 B12R2.76 O=C1CC(C1)c2csc(n2)N 1P028P3D [0,0,0,1,0,0|3,0,0]=4 51 B12R2.76 O=C1CC(C1)c2csc(n2)N 1P028Q2L [0,0,0,1,0,0|3,0,0]=4 52 B12R2.76 O=C1CC(C1)c2onc(n2)C 1P01DXQR [0,0,0,1,0,0|3,0,0]=4 53 B12R1.16 O=CNC(c1ccc(cc1)Cl)C 1P01DZNB [0,0,0,0,0,1|3,0,0]=4 54 B9R1.11 CCC(c1ccco1)N 1P01ASY7 [2,0,0,0,0,0|1,0,1]=4 55 B9R1.11 CNC(c1ccco1)C 1P019MEE [2,0,0,0,0,0|1,0,1]=4 56 B9R1.11 N#CC(c1ccco1)C 1P01B6OK [2,0,0,0,0,0|1,0,1]=4 57 B9R1.11 NCC(c1ccco1)O 1P00C1QL [2,0,0,0,0,0|2,0,0]=4 58 B9R1.11 NCC(c1cccs1)C 1P01AKCV [2,0,0,0,0,0|1,1,0]=4 59 B9R1.11 O=CC(=O)c1ccco1 1P007UQS [2,0,0,0,0,0|1,0,1]=4 60 B9R1.11 OCC(c1ccco1)N 1P00BJSX [2,0,0,0,0,0|1,0,1]=4 61 B9R1.11 OC[C@H](c1ccco1)N 1P024G1T [2,0,0,0,0,0|1,0,1]=4 62 B9R1.11 OC[C@H](c1ccco1)O 1P001DDJ [2,0,0,0,0,0|1,0,1]=4 63 B9R1.12 C#CCCc1ccco1 1P01XIDT [2,0,0,0,0,0|1,0,1]=4 64 B9R1.12 CCCCc1ccco1 1P003HAJ [2,0,0,0,0,0|1,0,1]=4 65 B9R1.12 N#CCCc1ccco1 1P019UDZ [2,0,0,0,0,0|1,0,1]=4 66 B9R1.12 NCCCc1ccco1 1P00DD6T [2,0,0,0,0,0|1,0,1]=4 67 B9R1.12 O=C=NCc1ccco1 1P00FBVQ [2,0,0,0,0,0|1,0,1]=4 68 B9R1.12 O=CC=Cc1ccco1 1P00IBGZ [2,0,0,0,0,0|0,0,2]=4 69 B9R1.12 O=CCCc1ccco1 1P024Z0F [2,0,0,0,0,0|0,0,0]=2 70 B9R1.12 O=CCCc1cccs1 1P002TCP [2,0,0,0,0,0|0,1,0]=3 71 B9R1.12 O=CCCc1cscc1 1P01J8CC [2,0,0,0,0,0|2,0,0]=4 72 B9R1.12 O=CCCn1cccn1 1P003ZHT [2,0,0,0,0,0|2,0,0]=4 73 B9R1.12 O=CNCc1ccco1 1P005G3V [2,0,0,0,0,0|1,0,0]=3 74 B9R1.12 O=CSCc1ccco1 1P003R65 [2,0,0,0,0,0|1,0,0]=3 75 B9R1.12 O=C\C=C\c1ccco1 1P003CH6 [2,0,0,0,0,0|0,0,2]=4 76 B9R1.12 OCCCc1ccco1 1P01A4WN [2,0,0,0,0,0|0,0,2]=4 77 B9R1.7 CNCc1ccc(o1)C 1P001EP7 [2,0,0,0,0,0|1,0,1]=4 78 B9R1.7 Cc1ccc(o1)CCN 1P0031S1 [2,0,0,0,0,0|1,0,0]=3 79 B9R1.7 Cc1ccc(o1)CCO 1P00CNQA [2,0,0,0,0,0|0,0,1]=3 80 B9R1.7 Cc1ccc(o1)N=C=O 1P021EPZ [2,0,0,0,0,0|1,0,1]=4 81 B9R1.7 Cc1ccc(s1)CC=O 1P01DVRI [2,0,0,0,0,0|0,1,0]=3 82 B9R1.7 Cc1ccc(s1)CCBr 1P028V6A [2,0,0,0,0,0|1,1,0]=4 83 B9R1.7 Cc1ccc(s1)CCN 1P0015S3 [2,0,0,0,0,0|1,1,0]=4 84 B9R1.7 Cc1ccc(s1)CCN 1P0030KN [2,0,0,0,0,0|1,1,0]=4 85 B9R1.7 Cc1ccc(s1)CCO 1P01BBAZ [2,0,0,0,0,0|0,1,1]=4 86 B9R1.7 NCCc1ccc(o1)Br 1P01A1LP [2,0,0,0,0,0|2,0,0]=4 87 B9R1.7 NCCc1ccc(o1)Br 1P01AES0 [2,0,0,0,0,0|2,0,0]=4 88 B9R1.7 NCCc1cnc(o1)C 1P01FJW6 [2,0,0,0,0,0|2,0,0]=4 89 B9R1.7 NCCc1ncc(o1)C 1P028TLR [2,0,0,0,0,0|2,0,0]=4 90 B9R1.7 [C-]#[N+]Cc1ccc(o1)C 1P01NLZE [2,0,0,0,0,0|1,0,1]=4 91 B9R1.35 CC(=O)c1ccc(o1)Br 1P00C003 [2,0,0,0,0,0|1,0,1]=4 92 B9R1.35 CC(c1ccc(o1)Br)N 1P01JV5M [2,0,0,0,0,0|2,0,0]=4 93 B9R1.35 CC(c1cnc(o1)Br)C 1P01DW7O [2,0,0,0,0,0|2,0,0]=4 94 B9R1.35 CC(c1cnc(o1)Cl)C 1P01DTG4 [2,0,0,0,0,0|2,0,0]=4 95 B9R1.35 CC(c1ncc([nH]1)C)C 1P00CLEL [2,0,0,0,0,0|2,0,0]=4 96 B9R1.35 CC(c1ncc(o1)Br)C 1P01DWGL [2,0,0,0,0,0|2,0,0]=4 97 B9R1.35 C[C@@H](c1ccc(o1)Br)N 1P01JV5J [2,0,0,0,0,0|2,0,0]=4 98 B9R1.35 C[C@H](c1ccc(o1)Br)N 1P01JV5K [2,0,0,0,0,0|2,0,0]=4 99 B9R1.35 Cc1ccc(o1)C(=O)C 1P000J0G [2,0,0,0,0,0|0,0,1]=3 100 B9R1.35 Cc1ccc(o1)C(=O)Cl 1P001CFN [2,0,0,0,0,0|1,0,1]=4 101 B9R1.35 Cc1ccc(o1)C(=O)N 1P003WAO [2,0,0,0,0,0|1,0,1]=4 102 B9R1.35 Cc1ccc(o1)C(=O)O 1P002FW0 [2,0,0,0,0,0|1,0,1]=4 103 B9R1.35 Cc1ccc(o1)C(N)C 1P00EECV [2,0,0,0,0,0|1,0,0]=3 104 B9R1.35 Cc1ccc(o1)[C@@H](O)C 1P019RPC [2,0,0,0,0,0|0,0,1]=3 105 B9R1.35 Cc1ccc(o1)[C@H](N)C 1P01KA8N [2,0,0,0,0,0|1,0,0]=3 106 B9R1.35 Cc1ccc(s1)C(=O)C 1P0012U7 [2,0,0,0,0,0|0,1,1]=4 107 B9R1.35 Cc1ccc(s1)C(N)C 1P019XL6 [2,0,0,0,0,0|1,1,0]=4 108 B9R1.35 Cc1ccc(s1)C(O)C 1P01DWTR [2,0,0,0,0,0|0,1,1]=4 109 B9R1.35 Cc1ccc(s1)C(S)C 1P01AH7L [2,0,0,0,0,0|0,2,0]=4 110 B9R1.35 Cc1ccn(n1)C(C)C 1P00AUGZ [2,0,0,0,0,0|2,0,0]=4 111 B9R1.35 Cc1cnc(o1)C(N)C 1P01A5ST [2,0,0,0,0,0|2,0,0]=4 112 B9R1.35 Cc1csc(n1)C(C)C 1P001PGO [2,0,0,0,0,0|2,0,0]=4 113 B9R1.35 Cc1scc(n1)C(C)C 1P00CZGP [2,0,0,0,0,0|2,0,0]=4 114 B9R1.35 Cn1ccc(n1)C(C)C 1P01AJ6M [2,0,0,0,0,0|2,0,0]=4 115 B9R1.35 Cn1ccc(n1)C(C)C 1P01EIRN [2,0,0,0,0,0|2,0,0]=4 116 B11R1.77 CC(=O)CC(=O)c1ccco1 1P003DB4 [1,1,0,0,0,0|1,0,1]=4 117 B11R1.77 CC(n1cccc1)CC(=O)O 1P01AB5Q [1,1,0,0,0,0|2,0,0]=4 118 B11R1.77 N[C@H](c1cnco1)CC(=O)O 1P027WNM [1,1,0,0,0,0|2,0,0]=4 119 B11R1.77 OC(=O)C=C(c1ccco1)C 1P028G89 [1,1,0,0,0,0|0,0,2]=4 120 B11R1.77 OC(=O)CC(c1ccco1)C 1P01BVGY [1,1,0,0,0,0|0,0,0]=2 121 B11R1.77 OC(=O)CC(c1ccco1)N 1P005OLI [1,1,0,0,0,0|1,0,0]=3 122 B11R1.77 OC(=O)CC(c1ccco1)N 1P01DUOC [1,1,0,0,0,0|1,0,0]=3 123 B11R1.77 OC(=O)CC(c1cccs1)N 1P00341K [1,1,0,0,0,0|1,1,0]=4 124 B11R1.77 OC(=O)CC(n1cccn1)C 1P00895E [1,1,0,0,0,0|2,0,0]=4 125 B11R1.77 OC(=O)C[C@@H](c1ccco1)N 1P00109G [1,1,0,0,0,0|1,0,0]=3 126 B11R1.77 OC(=O)C[C@@H](c1ccco1)N 1P01XDFK [1,1,0,0,0,0|1,0,0]=3 127 B11R1.77 OC(=O)C[C@@H](c1cccs1)N 1P01KLBF [1,1,0,0,0,0|1,1,0]=4 128 B11R1.77 OC(=O)C[C@H](c1ccco1)N 1P01KL5O [1,1,0,0,0,0|1,0,0]=3 129 B11R1.6 CC(c1ccc(o1)C)(CN)O 1P01AL3C [1,1,0,0,0,0|1,0,0]=3 130 B11R1.314 CC(c1ccc(o1)C)C(=O)O 1P01AKWU [1,1,0,0,0,0|0,0,0]=2 131 B11R1.314 CC(c1ccc(s1)Br)C(=O)O 1P019TAC [1,1,0,0,0,0|1,1,0]=4 132 B11R1.314 CC(c1ccc(s1)C)C(=O)O 1P019U6K [1,1,0,0,0,0|0,1,0]=3 133 B11R1.314 CC(c1ccc(s1)Cl)C(=O)O 1P019YUY [1,1,0,0,0,0|1,1,0]=4 134 B11R1.314 CC(c1ccn(n1)C)C(=O)O 1P028O3S [1,1,0,0,0,0|2,0,0]=4 135 B11R1.314 CC(c1ccn(n1)C)C(=O)O 1P028QXS [1,1,0,0,0,0|2,0,0]=4 136 B11R1.314 CC(n1ccc(n1)C)C(=O)O 1P009AIR [1,1,0,0,0,0|2,0,0]=4 137 B11R1.314 Cc1ccc(s1)C(C(=O)O)N 1P0087NT [1,1,0,0,0,0|1,1,0]=4 138 B11R1.314 OC(=O)C(c1ccn(c1)C)C 1P0293S6 [1,1,0,0,0,0|2,0,0]=4 139 B11R1.314 [O-]C(=O)C(c1ccc(s1)C)O 1P019SW7 [1,1,0,0,0,0|1,1,0]=4 140 B11R1.314 [O-]C(=O)C(c1nc(cs1)C)C 1P01BALL [1,1,0,0,0,0|2,0,0]=4 141 B11R1.27 Cc1ccc(o1)CNCCO 1P00BE2C [1,1,0,0,0,0|0,0,2]=4 142 B11R1.27 Cc1ccc(s1)CNCC=C 1P00J4KN [1,1,0,0,0,0|1,1,0]=4 143 B11R1.39 CC(=Cc1ccc(o1)C)C=O 1P0291AB [1,1,0,0,0,0|0,0,2]=4 144 B11R1.75 CC(=O)CCc1ccc(s1)Cl 1P01A1CT [1,1,0,0,0,0|1,1,0]=4 145 B11R1.75 CC(=O)OCc1ncc(o1)C 1P01A2JM [1,1,0,0,0,0|2,0,0]=4 146 B11R1.75 CC(CCc1ccc(o1)C)N 1P019SHK [1,1,0,0,0,0|1,0,1]=4 147 B11R1.75 Cc1c[nH]c(n1)CCC(=O)O 1P01FKMP [1,1,0,0,0,0|2,0,0]=4 148 B11R1.75 Cc1cc(sc1)CCC(=O)O 1P00IAU7 [1,1,0,0,0,0|2,0,0]=4 149 B11R1.75 Cc1ccc(o1)C=CC(=O)O 1P001FO6 [1,1,0,0,0,0|0,0,2]=4 150 B11R1.75 Cc1ccc(o1)CCC(=O)O 1P019TZL [1,1,0,0,0,0|0,0,0]=2 151 B11R1.75 Cc1ccc(o1)\C=C\C(=O)Cl 1P00HCLC [1,1,0,0,0,0|0,0,2]=4 152 B11R1.75 Cc1ccc(o1)\C=C\C(=O)O 1P019IGP [1,1,0,0,0,0|0,0,2]=4 153 B11R1.75 Cc1ccc(s1)CCC(=O)O 1P00HY1T [1,1,0,0,0,0|0,1,0]=3 154 B11R1.75 Cc1ccn(n1)CCC(=O)O 1P006AA4 [1,1,0,0,0,0|2,0,0]=4 155 B11R1.75 Cc1csc(n1)CCC(=O)O 1P01BF7G [1,1,0,0,0,0|2,0,0]=4 156 B11R1.75 Cc1nc(cs1)CCC(=O)O 1P00LTQP [1,1,0,0,0,0|2,0,0]=4 157 B11R1.75 Cc1ncc(o1)CCC(=O)O 1P028EE6 [1,1,0,0,0,0|1,0,0]=3 158 B11R1.75 Cc1ncc(s1)CCC(=O)O 1P01E08B [1,1,0,0,0,0|1,1,0]=4 159 B11R1.75 Cn1ccc(n1)CCC(=O)O 1P00JFF3 [1,1,0,0,0,0|2,0,0]=4 160 B11R1.75 OC(=O)CCc1ccc(s1)Br 1P00H4YK [1,1,0,0,0,0|1,1,0]=4 161 B11R1.75 OC(=O)CCc1ccc(s1)Cl 1P019VMS [1,1,0,0,0,0|1,1,0]=4 162 B11R1.75 OC(=O)CCc1ccn(c1)C 1P01C3V7 [1,1,0,0,0,0|2,0,0]=4 163 B11R1.75 [O-]C(=O)CCc1nnc(o1)C 1P01B6SH [1,1,0,0,0,0|2,0,0]=4 164 B13R1.132 CC(c1ccc(cc1)Br)CC(=O)O 1P01A1DW [0,1,0,0,0,1|2,0,0]=4 165 B13R1.132 CC(c1ccc(cc1)C)CC(=O)O 1P00772E [0,1,0,0,0,1|1,0,0]=3 166 B13R1.132 CC(c1ccc(cc1)F)CC(=O)O 1P001RMW [0,1,0,0,0,1|2,0,0]=4 167 B13R1.132 CC(c1ccc(cc1)N)CC(=O)O 1P01A6P7 [0,1,0,0,0,1|2,0,0]=4 168 B13R1.132 C[C@@H](c1ccc(cc1)F)CC(=O)O 1P002KTB [0,1,0,0,0,1|2,0,0]=4 169 B13R1.132 C[C@H](c1ccc(cc1)F)CC(=O)O 1P00C402 [0,1,0,0,0,1|2,0,0]=4 170 B13R1.132 NC(=O)CC(c1ccc(cc1)N)C 1P01BJV4 [0,1,0,0,0,1|2,0,0]=4 171 B13R1.132 NC(c1ccc(cc1)C)CC(=O)O 1P003JBJ [0,1,0,0,0,1|2,0,0]=4 172 B13R1.132 N[C@@H](c1ccc(cc1)C)CC(=O)O 1P00I96V [0,1,0,0,0,1|2,0,0]=4 173 B13R1.132 N[C@@H](c1ccc(cc1)C)CC(=O)O 1P028NFE [0,1,0,0,0,1|2,0,0]=4 174 B13R1.132 N[C@H](c1ccc(cc1)C)CC(=O)O 1P00I970 [0,1,0,0,0,1|2,0,0]=4 175 B13R1.132 N[C@H](c1ccc(cc1)C)CC(=O)O 1P028NQ5 [0,1,0,0,0,1|2,0,0]=4 176 B13R1.132 OC(=O)CC(c1ccc(nc1)N)C 1P027UN3 [0,1,0,0,0,1|2,0,0]=4 177 B13R1.147 OC(=O)CC(c1cccc(c1)Br)C 1P028IXT [0,1,0,0,0,1|2,0,0]=4 178 B13R1.147 OC(=O)CC(c1cccc(c1)C)C 1P01DWKY [0,1,0,0,0,1|1,0,0]=3 179 B13R1.147 OC(=O)CC(c1cccc(c1)F)C 1P01AJGA [0,1,0,0,0,1|2,0,0]=4 180 B13R1.147 OC(=O)C[C@@H](c1cccc(c1)C)N 1P00ICHM [0,1,0,0,0,1|2,0,0]=4 181 B13R1.147 OC(=O)C[C@H](c1cccc(c1)C)N 1P00ID0T [0,1,0,0,0,1|2,0,0]=4 182 B13R1.712 NCC(c1ccc(s1)Br)CC(=O)O 1P01ELYJ [0,2,0,0,0,0|1,1,0]=4 183 B13R1.23 CCCCNC(c1ccc(o1)C)C 1P019MB7 [0,2,0,0,0,0|1,0,1]=4 184 B13R1.3428 OC(=O)CC(c1csc(n1)C)(N)C 1P01BDFL [0,2,0,0,0,0|2,0,0]=4 185 B13R1.3465 CC(n1nc(cc1C)C)CC(=O)O 1P00GTBC [0,2,0,0,0,0|2,0,0]=4 186 B11R1.16 O=CCC(c1ccccc1)C 1P001TO2 [0,0,1,1,0,0|1,0,1]=4 187 B11R2.2 C1NCC(C1)c2ccco2 1P00VTYD [1,0,0,1,0,0|1,0,1]=4 188 B11R2.2 C1NCC(C1)c2ccco2 1P018LNX [1,0,0,1,0,0|1,0,1]=4 189 B11R2.11 O=C1CC(C1)c2ncc[nH]2 1P01FJOR [1,0,0,1,0,0|2,0,0]=4 190 B11R2.11 O=C1CC(C1)n2cccn2 1P01B9CR [1,0,0,1,0,0|2,0,0]=4 191 B11R2.32 O=C[C@@H]1C[C@H]1c2ccco2 1P028RSW [1,0,0,1,0,0|0,0,0]=2 192 B11R2.32 O=C[C@@H]1C[C@H]1c2cccs2 1P028DJS [1,0,0,1,0,0|0,1,0]=3 193 B11R2.32 O=C[C@@H]1C[C@H]1c2cscc2 1P028E6G [1,0,0,1,0,0|2,0,0]=4 194 B11R2.32 OC[C@@H]1C[C@H]1c2ccco2 1P0285Y9 [1,0,0,1,0,0|0,0,2]=4 195 B13R2.42 O=CC1CC1c2ccc(cc2)F 1P01B6NN [0,0,0,1,0,1|2,0,0]=4 196 B13R2.42 O=C[C@@H]1C[C@H]1c2ccc(cc2)F 1P00CSN9 [0,0,0,1,0,1|2,0,0]=4 197 B13R2.147 O=C1CC(C1)c2ccc(cc2)Br 1P0033X4 [0,0,0,1,0,1|2,0,0]=4 198 B13R2.147 O=C1CC(C1)c2ccc(cc2)C 1P019VK8 [0,0,0,1,0,1|1,0,0]=3 199 B13R2.147 O=C1CC(C1)c2ccc(cc2)Cl 1P019VK9 [0,0,0,1,0,1|2,0,0]=4 200 B13R2.147 O=C1CC(C1)c2ccc(cc2)F 1P007KE2 [0,0,0,1,0,1|2,0,0]=4 201 B13R2.147 O=C1CC(C1)c2ccc(cn2)Br 1P028R61 [0,0,0,1,0,1|2,0,0]=4 202 B13R2.5187 Brc1ccc2c(c1)C(=O)CC2C 1P023OEZ [0,0,0,1,0,1|2,0,0]=4 203 B13R2.151 O=C1CC(C1)c2cccc(c2)Br 1P008A6X [0,0,0,1,0,1|2,0,0]=4 204 B13R2.151 O=C1CC(C1)c2cccc(c2)C 1P019VKA [0,0,0,1,0,1|1,0,0]=3 205 B13R2.151 O=C1CC(C1)c2cccc(c2)Cl 1P00AXNC [0,0,0,1,0,1|2,0,0]=4 206 B13R2.151 O=C1CC(C1)c2cccc(c2)F 1P019VKB [0,0,0,1,0,1|2,0,0]=4 207 B13R2.151 O=C1CC(C1)c2ccnc(c2)Cl 1P0281XP [0,0,0,1,0,1|2,0,0]=4 208 B13R2.151 O=C1CC(C1)c2nccc(c2)Br 1P0282ZY [0,0,0,1,0,1|2,0,0]=4 209 B13R2.10 Cc1ccc(o1)C2CCCCN2 1P00IKD7 [0,1,0,1,0,0|1,0,1]=4 210 B13R2.10 Cc1ccc(o1)C2CNCCO2 1P01A32P [0,1,0,1,0,0|1,0,1]=4 211 B13R2.10 Cc1ccc(o1)C2COCCN2 1P01AJDJ [0,1,0,1,0,0|0,0,2]=4 212 B13R2.10 Cc1ccc(o1)C2CSCCN2 1P019T0T [0,1,0,1,0,0|0,1,1]=4 213 B13R2.11 O=C1NCC(C1)c2ccc(o2)C 1P027RAR [0,1,0,1,0,0|0,0,0]=2 214 B13R2.11 O=C1NCC(C1)c2ccc(s2)Br 1P01BKV1 [0,1,0,1,0,0|1,1,0]=4 215 B13R2.11 O=C1NCC(C1)c2ccn(n2)C 1P0274EO [0,1,0,1,0,0|2,0,0]=4 216 B13R2.2978 Cc1ccc(o1)[C@@H]2C[C@H]2C(=O)O 1P028T09 [0,1,0,1,0,0|0,0,0]=2 217 B13R2.2978 OC(=O)[C@@H]1C[C@H]1c2ccc(o2)Br 1P02801C [0,1,0,1,0,0|1,0,0]=3 218 B13R2.2978 OC(=O)[C@@H]1C[C@H]1c2ccc(s2)Br 1P0023LC [0,1,0,1,0,0|1,1,0]=4 219 B13R2.2978 OC(=O)[C@@H]1C[C@H]1c2ccc(s2)Cl 1P01BG3V [0,1,0,1,0,0|1,1,0]=4 220 B11R1.30 C=CCN(Cc1ccco1)C 1P01C7TL [1,0,0,0,0,1|2,0,0]=4 221 B11R1.22 NCC(c1ccc(cc1)C)C 1P01AK9Z [1,0,0,0,0,1|2,0,0]=4 222 B11R1.22 O=CC(c1ccc(cc1)Br)C 1P01C728 [1,0,0,0,0,1|2,0,0]=4 223 B11R1.22 O=CC(c1ccc(cc1)C)C 1P01BY6R [1,0,0,0,0,1|1,0,0]=3 224 B11R1.22 O=CC(c1ccc(cc1)F)C 1P01A39H [1,0,0,0,0,1|2,0,0]=4 225 B11R1.22 O=CC(c1ccc(cc1)I)C 1P01DDJW [1,0,0,0,0,1|2,0,0]=4 226 B11R1.22 O=CN(c1ccc(cc1)C)C 1P003SWO [1,0,0,0,0,1|2,0,0]=4 227 B11R1.1 O=CCCc1ccc(cc1)Br 1P0051VF [1,0,0,0,0,1|2,0,0]=4 228 B11R1.1 O=CCCc1ccc(cc1)Cl 1P008Q2P [1,0,0,0,0,1|2,0,0]=4 229 B11R1.1 O=CCCc1ccc(cc1)F 1P00EG6O [1,0,0,0,0,1|2,0,0]=4 230 B11R1.1 O=CCCc1ccc(cc1)I 1P01BUL9 [1,0,0,0,0,1|2,0,0]=4 231 B11R1.1 O=CCCc1ccc(cc1)O 1P0028NJ [1,0,0,0,0,1|2,0,0]=4 232 B11R1.1 O=CCCc1ccc(nc1)C 1P01ADJ6 [1,0,0,0,0,1|1,0,0]=3 233 B11R1.24 O=CCCc1cccc(c1)Br 1P002L1M [1,0,0,0,0,1|2,0,0]=4 234 B11R1.24 O=CCCc1cccc(c1)Cl 1P0012BU [1,0,0,0,0,1|2,0,0]=4 235 B11R1.24 O=CCCc1cccc(c1)F 1P002OU3 [1,0,0,0,0,1|2,0,0]=4 236 B11R1.24 O=CCCc1cncc(c1)C 1P01AD9R [1,0,0,0,0,1|1,0,0]=3 237 B11R1.24 O=CCCc1cncc(c1)F 1P01ADOR [1,0,0,0,0,1|2,0,0]=4