0 B12R1.21 CC(=O)COc1ccc(cc1)Cl CSC000150450 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.21 CC(=O)CSc1ccc(cc1)C CSC000172844 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.21 CC(=O)CSc1ccc(cc1)Cl CSC000150472 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.21 CC(=O)CSc1ccc(cc1)F CSC000148136 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.21 CC(=O)NCc1ccc(cc1)C CSC000154265 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.21 CC(=O)NCc1ccc(cc1)Cl CSC000152849 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.21 CC(=O)NCc1ccc(cc1)F CSC000152308 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.21 CC(=O)NNc1ccc(cc1)Br CSC009815283 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.21 CC(=O)NNc1ccc(cc1)C CSC000002330 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.21 CC(O)CSc1ccc(cc1)Cl CSC011366763 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.21 Cc1ccc(cc1)CNC(=O)N CSC000238954 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.21 Cc1ccc(cc1)SCC(=O)N CSC000149676 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.21 NC(=O)CCc1ccc(cc1)Cl CSC000022186 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.21 NC(=O)COc1ccc(cc1)Br CSC000150415 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.21 NC(=O)COc1ccc(cc1)Cl CSC000150449 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.21 NC(=O)COc1ccc(cc1)F CSC000150549 [0,0,0,0,0,0|3,0,0]=3 16 B12R1.21 NC(=O)CSc1ccc(cc1)Cl CSC000150469 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.21 NC(=O)NCc1ccc(cc1)F CSC000238953 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.21 OC(=O)COc1ccc(cc1)Br CSC000182358 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.1 Brc1ccc(cc1)OCC=C CSC000172055 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.1 Brc1ccc(cc1)SCC=C CSC009811901 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.1 Cc1ccc(cc1)NCCO CSC011233175 [1,0,0,0,0,0|2,0,1]=4 22 B11R1.1 Cc1ccc(cc1)OCC=C CSC000172063 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.1 Cc1ccc(cc1)OCCO CSC011219107 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.1 Cc1ccc(cc1)SCC=C CSC000006760 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.1 Cc1ccc(cc1)SCCO CSC000230582 [1,0,0,0,0,0|2,0,1]=4 26 B11R1.1 Clc1ccc(cc1)SCC=C CSC000006393 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.1 Fc1ccc(cc1)SCC=C CSC000006478 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.1 OCCNc1ccc(cc1)Cl CSC011233097 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.1 OCCNc1ccc(cc1)F CSC011233115 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.1 OCCOc1ccc(cc1)Br CSC000686261 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.1 OCCOc1ccc(cc1)Cl CSC000237962 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.1 OCCOc1ccc(cc1)F CSC011305846 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.1 OCCOc1ccc(cc1)I CSC000230681 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.1 OCCSc1ccc(cc1)Cl CSC000230527 [1,0,0,0,0,0|2,0,1]=4 35 B11R1.1 OCCSc1ccc(cc1)F CSC000230679 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [1,0,0,0,0,0|3,0,0]=4 38 B11R1.91 CC(=O)NCc1cccnc1 CSC000154915 [1,0,0,0,0,0|3,0,0]=4 39 B11R1.91 CC(=O)NCc1ccncc1 CSC000154903 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.91 CC(=O)NNc1ccccc1 CSC000153448 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.91 CC(=O)OCc1ccccc1 CSC000000625 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.91 CC(O)CNc1ccccc1 CSC011364939 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.91 NC(=O)C#Cc1ccccc1 CSC000041776 [1,0,0,0,0,0|1,0,2]=4 44 B11R1.91 NC(=O)COc1ccccc1 CSC000150575 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.91 NC(=O)CSc1ccccn1 CSC000149794 [1,0,0,0,0,0|3,0,0]=4 46 B11R1.91 OC(=O)CSc1ccccn1 CSC000156281 [1,0,0,0,0,0|2,0,0]=3 47 B13R1.3 CC(=C)COc1ccc(cc1)CO CSC000173090 [0,1,0,0,0,0|3,0,0]=4 48 B13R1.3 CC(=O)COc1ccc(cc1)C#N CSC000150630 [0,1,0,0,0,0|3,0,0]=4 49 B13R1.3 CCc1ccc(cc1)OCC(=O)N CSC000149771 [0,1,0,0,0,0|3,0,0]=4 50 B13R1.3 COc1ccc(cc1)CCC(=O)C CSC000170882 [0,1,0,0,0,0|1,0,0]=2 51 B13R1.3 COc1ccc(cc1)CNC(=O)C CSC000155742 [0,1,0,0,0,0|2,0,0]=3 52 B13R1.3 COc1ccc(cc1)CNC(=O)N CSC000238945 [0,1,0,0,0,0|2,0,0]=3 53 B13R1.3 NC(=O)COc1ccc(cc1)CO CSC000148266 [0,1,0,0,0,0|2,0,0]=3 54 B13R1.14 CCC(=O)NCc1ccc(cc1)C CSC000154269 [0,1,0,0,0,0|3,0,0]=4 55 B13R1.14 CCC(=O)NCc1ccc(cc1)Cl CSC000152853 [0,1,0,0,0,0|3,0,0]=4 56 B13R1.14 CCC(=O)NCc1ccc(cc1)F CSC000152312 [0,1,0,0,0,0|3,0,0]=4 57 B13R1.14 CNC(=O)CCc1ccc(cc1)Cl CSC000022063 [0,1,0,0,0,0|2,0,0]=3 58 B13R1.14 CNC(=O)CCc1ccc(cc1)F CSC000198136 [0,1,0,0,0,0|2,0,0]=3 59 B13R1.14 CNC(=O)COc1ccc(cc1)C CSC000150494 [0,1,0,0,0,0|3,0,0]=4 60 B13R1.14 CNC(=O)COc1ccc(cc1)Cl CSC000150441 [0,1,0,0,0,0|3,0,0]=4 61 B13R1.14 CNC(=O)COc1ccc(cc1)F CSC000150542 [0,1,0,0,0,0|3,0,0]=4 62 B13R1.14 CNC(=O)CSc1ccc(cc1)Cl CSC000150459 [0,1,0,0,0,0|3,0,0]=4 63 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl CSC000235214 [0,1,0,0,0,0|3,0,0]=4 64 B13R1.14 CNC(=O)NCc1ccc(cc1)F CSC000235249 [0,1,0,0,0,0|3,0,0]=4 65 B13R1.14 COC(=O)CCc1ccc(cc1)Br CSC012357364 [0,1,0,0,0,0|1,0,0]=2 66 B13R1.14 COC(=O)CCc1ccc(cc1)Cl CSC000240969 [0,1,0,0,0,0|1,0,0]=2 67 B13R1.14 COC(=O)CCc1ccc(cc1)F CSC000198246 [0,1,0,0,0,0|1,0,0]=2 68 B13R1.14 COC(=O)CNc1ccc(cc1)Br CSC000219630 [0,1,0,0,0,0|2,0,0]=3 69 B13R1.14 COC(=O)CNc1ccc(cc1)C CSC000219983 [0,1,0,0,0,0|2,0,0]=3 70 B13R1.14 COC(=O)CNc1ccc(cc1)Cl CSC000220163 [0,1,0,0,0,0|2,0,0]=3 71 B13R1.14 COC(=O)CNc1ccc(cc1)F CSC000219835 [0,1,0,0,0,0|2,0,0]=3 72 B13R1.14 COC(=O)COc1ccc(cc1)C CSC000151163 [0,1,0,0,0,0|2,0,0]=3 73 B13R1.14 COC(=O)COc1ccc(cc1)Cl CSC000148943 [0,1,0,0,0,0|2,0,0]=3 74 B13R1.14 COC(=O)COc1ccc(cc1)I CSC000151492 [0,1,0,0,0,0|2,0,0]=3 75 B13R1.14 COC(=O)CSc1ccc(cc1)C CSC000148271 [0,1,0,0,0,0|2,0,0]=3 76 B13R1.14 COC(=O)CSc1ccc(cc1)Cl CSC000150947 [0,1,0,0,0,0|2,0,0]=3 77 B13R1.14 COC(=O)NCc1ccc(cc1)Br CSC011472957 [0,1,0,0,0,0|2,0,0]=3 78 B13R1.14 COC(=O)NCc1ccc(cc1)Cl CSC000235972 [0,1,0,0,0,0|2,0,0]=3 79 B13R1.14 Cc1ccc(cc1)CNC(=O)CN CSC000168522 [0,1,0,0,0,0|3,0,0]=4 80 B13R1.14 Cc1ccc(cc1)OCC(=O)NN CSC000183956 [0,1,0,0,0,0|3,0,0]=4 81 B13R1.14 NCC(=O)NCc1ccc(cc1)F CSC000168487 [0,1,0,0,0,0|3,0,0]=4 82 B13R1.14 NNC(=O)COc1ccc(cc1)I CSC000189952 [0,1,0,0,0,0|3,0,0]=4 83 B13R1.132 CC(NC(=O)C)c1ccc(cc1)Br CSC000153805 [0,1,0,0,0,0|3,0,0]=4 84 B13R1.132 CC(NC(=O)C)c1ccc(cc1)C CSC011237556 [0,1,0,0,0,0|3,0,0]=4 85 B13R1.132 CC(NC(=O)C)c1ccc(cc1)Cl CSC000153794 [0,1,0,0,0,0|3,0,0]=4 86 B13R1.132 CC(NC(=O)N)c1ccc(cc1)Br CSC000238882 [0,1,0,0,0,0|3,0,0]=4 87 B13R1.132 CN(CC(=O)O)c1ccc(cn1)I CSC056773533 [0,1,0,0,0,0|3,0,0]=4 88 B13R1.133 CC(Nc1ccc(cn1)Br)C(=O)O CSC051419754 [0,1,0,0,0,0|3,0,0]=4 89 B13R1.133 CC(Nc1ccc(cn1)Cl)C(=O)O CSC056939720 [0,1,0,0,0,0|3,0,0]=4 90 B13R1.133 CC(Nc1ccc(cn1)I)C(=O)O CSC056890600 [0,1,0,0,0,0|3,0,0]=4 91 B13R1.133 CC(Oc1ccc(cc1)Br)C(=O)N CSC000150412 [0,1,0,0,0,0|3,0,0]=4 92 B13R1.133 CC(Oc1ccc(cc1)C)C(=O)N CSC000150499 [0,1,0,0,0,0|3,0,0]=4 93 B13R1.133 CC(Oc1ccc(cc1)F)C(=O)N CSC000150547 [0,1,0,0,0,0|3,0,0]=4 94 B13R1.133 CC(Sc1ccc(cc1)C)C(=O)N CSC000149675 [0,1,0,0,0,0|3,0,0]=4 95 B13R1.133 CC(Sc1ccc(cc1)Cl)C(=O)N CSC000150465 [0,1,0,0,0,0|3,0,0]=4 96 B13R1.133 CN(Cc1ccc(cc1)C)C(=O)C CSC000155497 [0,1,0,0,0,0|3,0,0]=4 97 B13R1.133 CN(Cc1ccc(cc1)C)C(=O)N CSC000238865 [0,1,0,0,0,0|3,0,0]=4 98 B13R1.133 C[C@@H](Nc1ccc(cn1)Br)C(=O)O CSC015263983 [0,1,0,0,0,0|3,0,0]=4 99 B13R1.133 C[C@@H](Nc1ccc(cn1)Cl)C(=O)O CSC015919780 [0,1,0,0,0,0|3,0,0]=4 100 B13R1.133 C[C@@H](Nc1ccc(cn1)I)C(=O)O CSC057439611 [0,1,0,0,0,0|3,0,0]=4 101 B13R1.133 C[C@H](Nc1ccc(cn1)Br)C(=O)O CSC015389935 [0,1,0,0,0,0|3,0,0]=4 102 B13R1.133 C[C@H](Nc1ccc(cn1)Cl)C(=O)O CSC015228121 [0,1,0,0,0,0|3,0,0]=4 103 B13R1.133 C[C@H](Nc1ccc(cn1)I)C(=O)O CSC057111767 [0,1,0,0,0,0|3,0,0]=4 104 B13R1.164 CC(=O)COc1ccc(cc1Cl)Cl CSC000150674 [0,1,0,0,0,0|3,0,0]=4 105 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl CSC000001290 [0,1,0,0,0,0|3,0,0]=4 106 B13R1.164 Cc1cc(ccc1OCC(=O)N)Br CSC000187326 [0,1,0,0,0,0|3,0,0]=4 107 B13R1.164 Cc1cc(ccc1OCC(=O)N)Cl CSC000149614 [0,1,0,0,0,0|3,0,0]=4 108 B13R1.164 Cc1cc(cnc1NCC(=O)O)Br CSC016130210 [0,1,0,0,0,0|3,0,0]=4 109 B13R1.164 Cc1ccc(c(c1)Br)OCC(=O)N CSC000148664 [0,1,0,0,0,0|3,0,0]=4 110 B13R1.164 Cc1ccc(c(c1)C)OCC(=O)N CSC000148438 [0,1,0,0,0,0|3,0,0]=4 111 B13R1.164 Cc1ccc(c(c1)Cl)OCC(=O)N CSC011725959 [0,1,0,0,0,0|3,0,0]=4 112 B13R1.164 NC(=O)CCc1ccc(cc1Cl)Cl CSC011226212 [0,1,0,0,0,0|2,0,0]=3 113 B13R1.164 NC(=O)COc1ccc(cc1F)Cl CSC000175330 [0,1,0,0,0,0|3,0,0]=4 114 B13R1.164 OC(=O)COc1ccc(cc1Br)F CSC000184067 [0,1,0,0,0,0|2,0,0]=3 115 B13R1.164 OC(=O)COc1ccc(cc1Cl)Br CSC000185252 [0,1,0,0,0,0|2,0,0]=3 116 B13R1.164 OC(=O)COc1ccc(cc1Cl)Cl CSC000180860 [0,1,0,0,0,0|2,0,0]=3 117 B13R1.164 OC(=O)COc1ccc(cc1Cl)F CSC000191239 [0,1,0,0,0,0|2,0,0]=3 118 B13R1.511 CC(=O)OCc1cc(=O)c(co1)O CSC009830044 [0,1,0,0,0,0|3,0,0]=4 119 B13R1.511 Cc1cc(ccc1Br)OCC(=O)N CSC000186616 [0,1,0,0,0,0|3,0,0]=4 120 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)N CSC000149623 [0,1,0,0,0,0|3,0,0]=4 121 B13R1.511 Cc1cc(ncc1Br)NCC(=O)O CSC015408348 [0,1,0,0,0,0|3,0,0]=4 122 B13R1.511 Cc1ccc(cc1C)OCC(=O)N CSC000149134 [0,1,0,0,0,0|3,0,0]=4 123 B13R1.511 Cc1ccc(cc1Cl)OCC(=O)O CSC009999609 [0,1,0,0,0,0|2,0,0]=3 124 B13R1.511 Cc1nc(ccc1Br)NCC(=O)O CSC016053532 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.20 CC(=O)Nc1ccc(cc1)Br CSC000153570 [0,0,0,0,1,0|3,0,0]=4 126 B11R1.20 CC(=O)Nc1ccc(cc1)Cl CSC000154020 [0,0,0,0,1,0|3,0,0]=4 127 B11R1.20 CC(=O)Oc1ccc(cc1)Br CSC009811594 [0,0,0,0,1,0|3,0,0]=4 128 B11R1.20 CC(=O)Oc1ccc(cc1)C CSC000001885 [0,0,0,0,1,0|3,0,0]=4 129 B11R1.20 CC(=O)Oc1ccc(cc1)Cl CSC000001863 [0,0,0,0,1,0|3,0,0]=4 130 B11R1.20 CC(=O)Oc1ccc(cc1)F CSC000001924 [0,0,0,0,1,0|3,0,0]=4 131 B11R1.20 Cc1ccc(cc1)CC(=O)N CSC000206417 [0,0,0,0,1,0|2,0,0]=3 132 B11R1.20 NC(=O)Cc1ccc(cc1)Br CSC000162331 [0,0,0,0,1,0|2,0,0]=3 133 B11R1.20 NC(=O)Cc1ccc(cc1)F CSC000162278 [0,0,0,0,1,0|2,0,0]=3 134 B11R1.20 NC(=O)Cc1ccc(cc1)O CSC000020825 [0,0,0,0,1,0|1,0,0]=2 135 B11R1.20 NC(=O)Nc1ccc(cc1)Br CSC000198584 [0,0,0,0,1,0|3,0,0]=4 136 B11R1.20 NC(=O)Nc1ccc(cc1)F CSC000222807 [0,0,0,0,1,0|3,0,0]=4 137 B13R1.513 CC(=C)CNCc1ccc(cc1)Br CSC011645308 [0,0,0,0,0,1|3,0,0]=4 138 B13R1.513 CC(=O)CCSc1ccc(cc1)F CSC000208766 [0,0,0,0,0,1|2,0,0]=3 139 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl CSC000151911 [0,0,0,0,0,1|2,0,0]=3 140 B13R1.513 CC(=O)NCCc1ccc(cc1)F CSC000152297 [0,0,0,0,0,1|2,0,0]=3 141 B13R1.513 CC(=O)NCCc1ccc(cc1)O CSC011395907 [0,0,0,0,0,1|1,0,0]=2 142 B13R1.513 CC(=O)OCCc1ccc(cc1)C CSC009829655 [0,0,0,0,0,1|2,0,0]=3 143 B13R1.513 CC(=O)OCCc1ccc(cc1)Cl CSC009851009 [0,0,0,0,0,1|2,0,0]=3 144 B13R1.513 CC(=O)OCCc1ccc(cc1)F CSC000071711 [0,0,0,0,0,1|2,0,0]=3 145 B13R1.513 CC(O)CNCc1ccc(cc1)Br CSC000187449 [0,0,0,0,0,1|2,0,1]=4 146 B13R1.513 CC(O)CNCc1ccc(cc1)Br CSC000187449 [0,0,0,0,0,1|2,0,1]=4 147 B13R1.513 CC(O)CNCc1ccc(cc1)C CSC000188770 [0,0,0,0,0,1|2,0,1]=4 148 B13R1.513 CC(O)CNCc1ccc(cc1)Cl CSC000186849 [0,0,0,0,0,1|2,0,1]=4 149 B13R1.513 CC(O)CNCc1ccc(cc1)F CSC000186854 [0,0,0,0,0,1|2,0,1]=4 150 B13R1.513 Cc1ccc(cc1)SCCC(=O)N CSC000162367 [0,0,0,0,0,1|2,0,0]=3 151 B13R1.513 NC(=O)CSCc1ccc(cc1)F CSC000162057 [0,0,0,0,0,1|2,0,0]=3 152 B13R1.513 NC(=O)NCCc1ccc(cc1)Cl CSC000238947 [0,0,0,0,0,1|2,0,0]=3 153 B13R1.513 OC(=O)CCNc1ccc(cn1)Br CSC057255885 [0,0,0,0,0,1|2,0,0]=3 154 B13R1.513 OC(=O)CCNc1ccc(cn1)Cl CSC025755724 [0,0,0,0,0,1|2,0,0]=3 155 B13R1.513 OC(=O)CCNc1ccc(cn1)Cl CSC025755724 [0,0,0,0,0,1|2,0,0]=3 156 B13R1.513 OC(=O)CCNc1ccc(cn1)I CSC056847524 [0,0,0,0,0,1|2,0,0]=3 157 B13R1.513 OC(=O)CCNc1ncc(cn1)Br CSC015946636 [0,0,0,0,0,1|3,0,0]=4 158 B13R1.513 OC(=O)CCNc1ncc(cn1)Cl CSC015284654 [0,0,0,0,0,1|3,0,0]=4 159 B10R1.17 C=CCSc1ccccc1 CSC000006400 [2,0,0,0,0,0|2,0,0]=4 160 B10R1.17 OCCSc1ccccc1 CSC000230494 [2,0,0,0,0,0|1,0,1]=4 161 B12R1.1 Cc1ccc(cc1)CSCCO CSC011212911 [1,1,0,0,0,0|1,0,1]=4 162 B12R1.1 Cc1ccc(cc1)SCCCO CSC000213565 [1,1,0,0,0,0|1,0,1]=4 163 B12R1.1 OCCCSc1ccc(cc1)Br CSC000213788 [1,1,0,0,0,0|1,0,1]=4 164 B12R1.1 OCCCSc1ccc(cc1)Cl CSC000212878 [1,1,0,0,0,0|1,0,1]=4 165 B12R1.1 OCCNCc1ccc(cc1)Br CSC000186819 [1,1,0,0,0,0|1,0,1]=4 166 B12R1.1 OCCNCc1ccc(cc1)Br CSC000186819 [1,1,0,0,0,0|1,0,1]=4 167 B12R1.1 OCCNCc1ccc(cc1)Cl CSC000180886 [1,1,0,0,0,0|1,0,1]=4 168 B12R1.1 OCCNCc1ccc(cc1)F CSC000180845 [1,1,0,0,0,0|1,0,1]=4 169 B12R1.1 OCCSCc1ccc(cc1)Br CSC011212529 [1,1,0,0,0,0|1,0,1]=4 170 B12R1.1 OCCSCc1ccc(cc1)Cl CSC000186141 [1,1,0,0,0,0|1,0,1]=4 171 B12R1.1 OCCSCc1ccc(cc1)F CSC011212906 [1,1,0,0,0,0|1,0,1]=4 172 B12R1.1 OCCSCc1ccc(cc1)I CSC000238427 [1,1,0,0,0,0|1,0,1]=4 173 B12R1.71 COc1ccc(cc1)OCCO CSC011305860 [1,1,0,0,0,0|1,0,1]=4 174 B12R1.71 COc1ccc(cc1)SCCO CSC000230841 [1,1,0,0,0,0|1,0,1]=4 175 B12R1.71 OCCOc1ccc(cc1)CO CSC011232690 [1,1,0,0,0,0|1,0,1]=4 176 B12R1.27 CCC(=O)NCc1ccccc1 CSC000153145 [1,1,0,0,0,0|2,0,0]=4 177 B12R1.27 CCC(=O)OCc1ccccc1 CSC000000848 [1,1,0,0,0,0|2,0,0]=4 178 B12R1.27 CNC(=O)CCc1ccccc1 CSC000159837 [1,1,0,0,0,0|1,0,0]=3 179 B12R1.27 CNC(=O)COc1ccccc1 CSC000150564 [1,1,0,0,0,0|2,0,0]=4 180 B12R1.27 CNC(=O)CSc1ccccc1 CSC000150703 [1,1,0,0,0,0|2,0,0]=4 181 B12R1.27 CNC(=O)NCc1ccccc1 CSC000222791 [1,1,0,0,0,0|2,0,0]=4 182 B12R1.27 COC(=O)C#Cc1ccccc1 CSC011216089 [1,1,0,0,0,0|0,0,2]=4 183 B12R1.27 COC(=O)COc1ccccc1 CSC000148705 [1,1,0,0,0,0|1,0,0]=3 184 B12R1.27 COC(=O)CSc1ccccc1 CSC000151200 [1,1,0,0,0,0|1,0,0]=3 185 B12R1.27 COC(=O)CSc1ccccn1 CSC000156013 [1,1,0,0,0,0|2,0,0]=4 186 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [1,1,0,0,0,0|1,0,0]=3 187 B12R1.27 NNC(=O)CCc1ccccc1 CSC000189782 [1,1,0,0,0,0|1,0,0]=3 188 B12R1.27 NNC(=O)COc1ccccc1 CSC000186219 [1,1,0,0,0,0|2,0,0]=4 189 B12R1.27 NNC(=O)CSc1ccccc1 CSC000189974 [1,1,0,0,0,0|2,0,0]=4 190 B12R1.27 OCC(=O)NCc1ccccc1 CSC000246335 [1,1,0,0,0,0|1,0,0]=3 191 B12R1.43 CN(Cc1ccccc1)C(=O)C CSC000152884 [1,1,0,0,0,0|2,0,0]=4 192 B12R1.43 CN(Cc1ccccc1)C(=O)N CSC000238888 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)N CSC011423145 [1,1,0,0,0,0|1,0,0]=3 194 B12R1.107 CC(NC(=O)C)c1ccccc1 CSC000158019 [1,1,0,0,0,0|2,0,0]=4 195 B12R1.107 CC(OC(=O)C)c1ccccc1 CSC000000578 [1,1,0,0,0,0|2,0,0]=4 196 B12R1.107 CN(CC(=O)O)c1ccccn1 CSC015360306 [1,1,0,0,0,0|2,0,0]=4 197 B12R1.107 C[C@@H](NC(=O)C)c1ccccc1 CSC011908465 [1,1,0,0,0,0|2,0,0]=4 198 B12R1.107 C[C@H](NC(=O)C)c1ccccc1 CSC011908453 [1,1,0,0,0,0|2,0,0]=4 199 B12R1.107 NC(=O)CS(=O)c1ccccc1 CSC000064346 [1,1,0,0,0,0|2,0,0]=4 200 B12R1.125 CC(=O)NCc1ccccc1Br CSC011237613 [1,1,0,0,0,0|2,0,0]=4 201 B12R1.125 CC(=O)NCc1ccccc1C CSC000175807 [1,1,0,0,0,0|2,0,0]=4 202 B12R1.125 CC(=O)NCc1ccccc1Cl CSC000155626 [1,1,0,0,0,0|2,0,0]=4 203 B12R1.125 CC(=O)OCc1ccccc1C CSC000000619 [1,1,0,0,0,0|2,0,0]=4 204 B12R1.125 Cc1ccccc1OCC(=O)N CSC000150533 [1,1,0,0,0,0|2,0,0]=4 205 B12R1.125 NC(=O)CCc1ccccc1Cl CSC000162028 [1,1,0,0,0,0|1,0,0]=3 206 B12R1.125 NC(=O)CCc1ccccc1F CSC000016472 [1,1,0,0,0,0|1,0,0]=3 207 B12R1.125 NC(=O)COc1ccccc1Cl CSC000150432 [1,1,0,0,0,0|2,0,0]=4 208 B12R1.125 NC(=O)COc1ccccc1F CSC000150391 [1,1,0,0,0,0|2,0,0]=4 209 B12R1.125 NC(=O)COc1ccccc1O CSC000162348 [1,1,0,0,0,0|2,0,0]=4 210 B12R1.125 OC(=O)COc1ccccc1F CSC000182486 [1,1,0,0,0,0|1,0,0]=3 211 B12R1.226 CC(=O)NCc1cccc(c1)C CSC011222369 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.226 NC(=O)COc1cccc(c1)Cl CSC000150646 [1,1,0,0,0,0|2,0,0]=4 213 B12R1.226 NC(=O)NCc1cccc(c1)Cl CSC000238944 [1,1,0,0,0,0|2,0,0]=4 214 B12R1.4 CCc1ccc(cc1)CC(=O)N CSC009837247 [0,1,0,0,1,0|2,0,0]=4 215 B12R1.4 COc1ccc(cc1)CC(=O)N CSC000162232 [0,1,0,0,1,0|1,0,0]=3 216 B12R1.4 COc1ccc(cc1)OC(=O)C CSC000002274 [0,1,0,0,1,0|2,0,0]=4 217 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O CSC012186693 [0,1,0,0,1,0|2,0,0]=4 218 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O CSC011215158 [0,1,0,0,1,0|2,0,0]=4 219 B12R1.19 Cc1ccc(cc1C)CC(=O)N CSC000162019 [0,1,0,0,1,0|2,0,0]=4 220 B12R1.20 CN(C(=O)C)c1ccc(cc1)O CSC000743460 [0,1,0,0,1,0|2,0,0]=4 221 B12R1.20 NC(=O)C(O)c1ccc(cc1)Cl CSC011626263 [0,1,0,0,1,0|2,0,0]=4 222 B12R1.233 NC(=O)Cc1ccc(cc1Br)F CSC010883721 [0,1,0,0,1,0|2,0,0]=4 223 B12R1.233 NC(=O)Cc1ccc(cc1Cl)Cl CSC000162283 [0,1,0,0,1,0|2,0,0]=4 224 B12R1.233 NC(=O)Cc1ccc(cc1Cl)F CSC000034102 [0,1,0,0,1,0|2,0,0]=4 225 B14R1.4 COc1ccc(cc1)CCNC(=O)N CSC000238940 [0,1,0,0,0,1|1,0,0]=3 226 B14R1.4 COc1ccc(cc1)CCOC(=O)C CSC000000615 [0,1,0,0,0,1|1,0,0]=3 227 B14R1.4 COc1ccc(cc1)CNCC(C)O CSC000196623 [0,1,0,0,0,1|1,0,1]=4 228 B14R1.13 CCC(=O)NCCc1ccc(cc1)Br CSC012059244 [0,1,0,0,0,1|2,0,0]=4 229 B14R1.13 CNC(=O)CCSc1ccc(cc1)C CSC000159961 [0,1,0,0,0,1|2,0,0]=4 230 B14R1.13 CNC(=O)CCSc1ccc(cc1)Cl CSC000155106 [0,1,0,0,0,1|2,0,0]=4 231 B14R1.13 CNC(=O)CSCc1ccc(cc1)Br CSC000150865 [0,1,0,0,0,1|2,0,0]=4 232 B14R1.13 CNC(=O)CSCc1ccc(cc1)C CSC000155064 [0,1,0,0,0,1|2,0,0]=4 233 B14R1.13 CNC(=O)CSCc1ccc(cc1)Cl CSC000148962 [0,1,0,0,0,1|2,0,0]=4 234 B14R1.13 CNC(=O)CSCc1ccc(cc1)F CSC000159739 [0,1,0,0,0,1|2,0,0]=4 235 B14R1.13 CNC(=O)NCCc1ccc(cc1)Cl CSC000235234 [0,1,0,0,0,1|2,0,0]=4 236 B14R1.13 CNC(=O)NCCc1ccc(cc1)F CSC000235248 [0,1,0,0,0,1|2,0,0]=4 237 B14R1.13 CNC(=O)NCCc1ccc(cc1)O CSC011462650 [0,1,0,0,0,1|1,0,0]=3 238 B14R1.13 COC(=O)CCSc1ccc(cc1)C CSC000149873 [0,1,0,0,0,1|1,0,0]=3 239 B14R1.13 COC(=O)CCSc1ccc(cc1)Cl CSC000149920 [0,1,0,0,0,1|1,0,0]=3 240 B14R1.13 COC(=O)CSCc1ccc(cc1)Br CSC000150933 [0,1,0,0,0,1|1,0,0]=3 241 B14R1.13 COC(=O)CSCc1ccc(cc1)C CSC000148414 [0,1,0,0,0,1|1,0,0]=3 242 B14R1.13 COC(=O)CSCc1ccc(cc1)Cl CSC000148415 [0,1,0,0,0,1|1,0,0]=3 243 B14R1.13 COC(=O)CSCc1ccc(cc1)F CSC000148349 [0,1,0,0,0,1|1,0,0]=3 244 B14R1.13 COC(=O)NCCc1ccc(cc1)Cl CSC000188991 [0,1,0,0,0,1|1,0,0]=3 245 B14R1.13 NCC(=O)NCCc1ccc(cc1)Br CSC012346923 [0,1,0,0,0,1|2,0,0]=4 246 B14R1.13 NCC(=O)NCCc1ccc(cc1)Cl CSC000168504 [0,1,0,0,0,1|2,0,0]=4 247 B14R1.13 NNC(=O)CSCc1ccc(cc1)Cl CSC000189996 [0,1,0,0,0,1|2,0,0]=4 248 B14R1.13 NNC(=O)CSCc1ccc(cc1)F CSC000189992 [0,1,0,0,0,1|2,0,0]=4 249 B14R1.678 CC(=O)NCC(O)c1ccc(cc1)Cl CSC000044975 [0,1,0,0,0,1|2,0,0]=4 250 B14R1.678 CN(CCC(=O)O)c1ccc(cn1)Cl CSC010974849 [0,1,0,0,0,1|2,0,0]=4 251 B14R1.678 CN(CCC(=O)O)c1ccc(cn1)I CSC057384165 [0,1,0,0,0,1|2,0,0]=4 252 B14R1.679 CC(NCc1ccc(cc1)Br)C(=O)O CSC011300776 [0,1,0,0,0,1|1,0,0]=3 253 B14R1.679 CC(NCc1ccc(cc1)Br)C(=O)O CSC011300776 [0,1,0,0,0,1|1,0,0]=3 254 B14R1.679 CC(NCc1ccc(cc1)Cl)C(=O)O CSC011300714 [0,1,0,0,0,1|1,0,0]=3 255 B14R1.679 CC(NCc1ccc(cc1)Cl)C(=O)O CSC011300714 [0,1,0,0,0,1|1,0,0]=3 256 B14R1.679 OC(=O)C(=O)NCc1ccc(cc1)Cl CSC011297121 [0,1,0,0,0,1|1,0,1]=4 257 B14R1.687 CC(=O)OCCc1ccc(c(c1)F)F CSC010168939 [0,1,0,0,0,1|2,0,0]=4 258 B14R1.687 Cc1cc(ncc1Br)NCCC(=O)O CSC016095595 [0,1,0,0,0,1|2,0,0]=4 259 B14R1.687 Cc1nc(ccc1Br)NCCC(=O)O CSC015565129 [0,1,0,0,0,1|2,0,0]=4 260 B14R1.687 NC(=O)CSCc1ccc(c(c1)Cl)Cl CSC046104796 [0,1,0,0,0,1|2,0,0]=4 261 B14R1.698 CN(CC(=O)N)Cc1ccc(cc1)Br CSC000175066 [0,1,0,0,0,1|2,0,0]=4 262 B14R1.698 CN(CC(=O)N)Cc1ccc(cc1)Cl CSC000175072 [0,1,0,0,0,1|2,0,0]=4 263 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Br CSC011192223 [0,1,0,0,0,1|1,0,0]=3 264 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Br CSC011192223 [0,1,0,0,0,1|1,0,0]=3 265 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Cl CSC011192224 [0,1,0,0,0,1|1,0,0]=3 266 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)Cl CSC011192224 [0,1,0,0,0,1|1,0,0]=3 267 B14R1.698 CN(CC(=O)O)Cc1ccc(cc1)I CSC012291065 [0,1,0,0,0,1|1,0,0]=3 268 B14R1.4464 Cc1cc(cnc1NCCC(=O)O)Br CSC015402289 [0,1,0,0,0,1|2,0,0]=4 269 B14R1.4464 OC(=O)CCNc1ncc(cc1Br)Cl CSC015313829 [0,1,0,0,0,1|2,0,0]=4 270 B14R1.4464 OC(=O)CCNc1ncc(cc1Cl)Br CSC015419775 [0,1,0,0,0,1|2,0,0]=4 271 B14R1.4464 OC(=O)CCNc1ncc(cc1Cl)Cl CSC021660086 [0,1,0,0,0,1|2,0,0]=4 272 B14R1.4464 OC(=O)CCNc1ncc(cc1F)Cl CSC016132655 [0,1,0,0,0,1|2,0,0]=4 273 B14R1.2 COc1ccc(cc1)C(C)CC(=O)N CSC009885428 [0,2,0,0,0,0|1,0,0]=3 274 B14R1.2 COc1ccc(cc1)C(C)NC(=O)C CSC011237584 [0,2,0,0,0,0|2,0,0]=4 275 B14R1.3 COc1ccc(cc1)OC(C)C(=O)N CSC000150799 [0,2,0,0,0,0|2,0,0]=4 276 B14R1.5 CCC(=O)NCc1ccc(cc1)OC CSC000155745 [0,2,0,0,0,0|2,0,0]=4 277 B14R1.5 CNC(=O)NCc1ccc(cc1)OC CSC000235231 [0,2,0,0,0,0|2,0,0]=4 278 B14R1.5 COC(=O)CCc1ccc(cc1)OC CSC000151455 [0,2,0,0,0,0|0,0,0]=2 279 B14R1.5 COC(=O)COc1ccc(cc1)CO CSC000173185 [0,2,0,0,0,0|1,0,0]=3 280 B14R1.5 COC(=O)COc1ccc(cc1)OC CSC000149906 [0,2,0,0,0,0|1,0,0]=3 281 B14R1.5 COC(=O)CSc1ccc(cc1)OC CSC000198245 [0,2,0,0,0,0|1,0,0]=3 282 B14R1.5 COc1ccc(cc1)CCC(=O)NN CSC000189948 [0,2,0,0,0,0|1,0,0]=3 283 B14R1.142 CCOc1ccc(cc1)CNC(=O)C CSC000044878 [0,2,0,0,0,0|2,0,0]=4 284 B14R1.419 OC(=O)CNc1ccc(cc1)[N+](=O)[O-] CSC000204769 [0,2,0,0,0,0|1,0,1]=4 285 B14R1.134 COC(=O)C(C)Cc1ccc(cc1)C CSC010733193 [0,2,0,0,0,0|1,0,0]=3 286 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)Br CSC011392333 [0,2,0,0,0,0|2,0,0]=4 287 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)C CSC011392111 [0,2,0,0,0,0|2,0,0]=4 288 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)Br CSC000148289 [0,2,0,0,0,0|2,0,0]=4 289 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)C CSC000151460 [0,2,0,0,0,0|2,0,0]=4 290 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)Cl CSC000150899 [0,2,0,0,0,0|2,0,0]=4 291 B14R1.502 CCNC(=O)CCc1ccc(cc1)Cl CSC000022064 [0,2,0,0,0,0|2,0,0]=4 292 B14R1.502 CCNC(=O)CCc1ccc(cc1)F CSC000198146 [0,2,0,0,0,0|2,0,0]=4 293 B14R1.502 CCOC(=O)CCc1ccc(cc1)Br CSC012353604 [0,2,0,0,0,0|1,0,0]=3 294 B14R1.502 CCOC(=O)CCc1ccc(cc1)F CSC011212770 [0,2,0,0,0,0|1,0,0]=3 295 B14R1.502 CCOC(=O)CCc1ccc(cc1)O CSC000042238 [0,2,0,0,0,0|0,0,0]=2 296 B14R1.502 CCOC(=O)CNc1ccc(cc1)Br CSC000219622 [0,2,0,0,0,0|2,0,0]=4 297 B14R1.502 CCOC(=O)CNc1ccc(cc1)Cl CSC000220156 [0,2,0,0,0,0|2,0,0]=4 298 B14R1.502 CCOC(=O)COc1ccc(cc1)Br CSC000170664 [0,2,0,0,0,0|2,0,0]=4 299 B14R1.502 CCOC(=O)COc1ccc(cc1)C CSC000170982 [0,2,0,0,0,0|2,0,0]=4 300 B14R1.502 CCOC(=O)COc1ccc(cc1)Cl CSC000170970 [0,2,0,0,0,0|2,0,0]=4 301 B14R1.502 CCOC(=O)COc1ccc(cc1)F CSC000170983 [0,2,0,0,0,0|2,0,0]=4 302 B14R1.502 CCOC(=O)COc1ccc(cc1)I CSC000171710 [0,2,0,0,0,0|2,0,0]=4 303 B14R1.502 CCOC(=O)CSc1ccc(cc1)C CSC000172570 [0,2,0,0,0,0|2,0,0]=4 304 B14R1.502 CCOC(=O)CSc1ccc(cc1)Cl CSC000170981 [0,2,0,0,0,0|2,0,0]=4 305 B14R1.502 CCOC(=O)CSc1ccc(cc1)O CSC011400692 [0,2,0,0,0,0|1,0,0]=3 306 B14R1.502 COCC(=O)NCc1ccc(cc1)F CSC000161512 [0,2,0,0,0,0|2,0,0]=4 307 B14R1.727 CNC(=O)CCc1ccc(cc1Cl)Cl CSC011223620 [0,2,0,0,0,0|2,0,0]=4 308 B14R1.727 COC(=O)COc1ccc(cc1Br)Br CSC000150960 [0,2,0,0,0,0|2,0,0]=4 309 B14R1.727 COC(=O)COc1ccc(cc1C)Cl CSC000149228 [0,2,0,0,0,0|2,0,0]=4 310 B14R1.727 COC(=O)COc1ccc(cc1Cl)Br CSC000149651 [0,2,0,0,0,0|2,0,0]=4 311 B14R1.727 COC(=O)COc1ccc(cc1Cl)Cl CSC000150116 [0,2,0,0,0,0|2,0,0]=4 312 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl CSC049028319 [0,2,0,0,0,0|2,0,0]=4 313 B14R1.833 COC(=O)CNc1ccc(c(c1)C)C CSC000219816 [0,2,0,0,0,0|2,0,0]=4 314 B14R1.833 COC(=O)COc1ccc(c(c1)C)Cl CSC000149931 [0,2,0,0,0,0|2,0,0]=4 315 B14R1.685 CN(CC(=O)O)c1ccc(c(c1)Cl)C CSC010100097 [0,2,0,0,0,0|2,0,0]=4 316 B14R2.5816 CC(=O)N1CCc2c1cc(cc2)Br CSC009817278 [0,0,0,1,0,1|2,0,0]=4 317 B14R2.5816 CC(=O)N1CCc2c1cc(cc2)Cl CSC000057073 [0,0,0,1,0,1|2,0,0]=4 318 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 CSC012187205 [0,1,0,1,0,0|1,0,0]=3 319 B10R1.18 CS(=O)Cc1ccccc1 CSC000064350 [1,0,0,0,1,0|2,0,0]=4 320 B10R1.13 CS(=O)c1ccc(cc1)O CSC000064373 [0,0,0,0,2,0|2,0,0]=4 321 B10R1.13 NC(=O)c1ccc(cc1)Cl CSC000162172 [0,0,0,0,2,0|2,0,0]=4 322 B10R1.13 NC(=O)c1ccc(cc1)I CSC000162191 [0,0,0,0,2,0|2,0,0]=4 323 B12R1.252 CC(=C)CNCc1ccccc1 CSC000224140 [1,0,0,0,0,1|2,0,0]=4 324 B12R1.252 CC(=O)CCSc1ccccc1 CSC000208507 [1,0,0,0,0,1|1,0,0]=3 325 B12R1.252 CC(=O)CCSc1ccccn1 CSC000208669 [1,0,0,0,0,1|2,0,0]=4 326 B12R1.252 CC(=O)CSCc1ccccc1 CSC000172147 [1,0,0,0,0,1|1,0,0]=3 327 B12R1.252 CC(=O)NCCc1ccccc1 CSC000153396 [1,0,0,0,0,1|1,0,0]=3 328 B12R1.252 CC(=O)OCCc1ccccc1 CSC000024547 [1,0,0,0,0,1|1,0,0]=3 329 B12R1.252 NC(=O)CCCc1ccccc1 CSC011273634 [1,0,0,0,0,1|1,0,0]=3 330 B12R1.252 NC(=O)CSCc1ccccc1 CSC000149389 [1,0,0,0,0,1|1,0,0]=3 331 B12R1.252 NC(=O)NCCc1ccccc1 CSC000238938 [1,0,0,0,0,1|1,0,0]=3 332 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br CSC009814669 [0,0,0,0,0,2|2,0,0]=4 333 B14R1.677 CC(=O)NCCOc1ccc(cc1)C CSC000002334 [0,0,0,0,0,2|2,0,0]=4 334 B14R1.677 CC(=O)NCCOc1ccc(cc1)F CSC000008501 [0,0,0,0,0,2|2,0,0]=4 335 B14R1.677 CC(=O)NCCSc1ccc(cc1)Cl CSC048458814 [0,0,0,0,0,2|2,0,0]=4 336 B14R1.677 CC(=O)OCCOc1ccc(cc1)Br CSC009811543 [0,0,0,0,0,2|2,0,0]=4 337 B14R1.677 Cc1ccc(cc1)OCCCC(=O)N CSC000162218 [0,0,0,0,0,2|2,0,0]=4 338 B14R1.677 Cc1ccc(cc1)OCCNC(=O)N CSC000022875 [0,0,0,0,0,2|2,0,0]=4 339 B14R1.677 NC(=O)CCCOc1ccc(cc1)Cl CSC000027696 [0,0,0,0,0,2|2,0,0]=4 340 B14R1.677 NC(=O)CCCSc1ccc(cc1)Cl CSC000162164 [0,0,0,0,0,2|2,0,0]=4 341 B14R1.677 NC(=O)CCSCc1ccc(cc1)I CSC018001412 [0,0,0,0,0,2|2,0,0]=4 342 B14R1.677 OC(=O)CCCNc1ccc(cn1)Br CSC052096381 [0,0,0,0,0,2|2,0,0]=4 343 B14R1.677 OC(=O)CCCNc1ccc(cn1)Cl CSC057478892 [0,0,0,0,0,2|2,0,0]=4 344 B14R1.677 OC(=O)CCCNc1ccc(cn1)I CSC057656491 [0,0,0,0,0,2|2,0,0]=4 345 B14R1.677 OC(=O)CCNCc1ccc(cc1)Br CSC011244181 [0,0,0,0,0,2|1,0,0]=3 346 B14R1.677 OC(=O)CCNCc1ccc(cc1)Br CSC011244181 [0,0,0,0,0,2|1,0,0]=3