0 B15R2.4343 C#CC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_200000035995 [0,0,0,0,0,0|3,0,1]=4 1 B15R2.4343 C#CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_200000035995 [0,0,0,0,0,0|2,0,1]=3 2 B15R2.4343 C#CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_200000035995 [0,0,0,0,0,0|2,0,1]=3 3 B15R2.4343 C#CC(C)Sc1ccc2c(c1)CCO2 62a_200000035995_100000729065 [0,0,0,0,0,0|3,0,1]=4 4 B15R2.4343 C#CC(C)Sc1ccc2c(c1)OCC2 62a_200000035995_100009818566 [0,0,0,0,0,0|3,0,1]=4 5 B15R2.4343 C=CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000185746 [0,0,0,0,0,0|3,0,1]=4 6 B15R2.4343 C=CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000185746 [0,0,0,0,0,0|3,0,1]=4 7 B15R2.4343 C=CC(C)Sc1cc2c(cn1)OCC2 62a_100011215867_102495363667 [0,0,0,0,0,0|4,0,0]=4 8 B15R2.4343 C=CC(C)Sc1ccc2c(c1)CCC2 62a_100011215867_100000745594 [0,0,0,0,0,0|4,0,0]=4 9 B15R2.4343 C=CC(C)Sc1ccc2c(c1)CCN2 62a_100011215867_100000691068 [0,0,0,0,0,0|4,0,0]=4 10 B15R2.4343 C=CC(C)Sc1ccc2c(c1)CCO2 62a_100011215867_100000729065 [0,0,0,0,0,0|3,0,0]=3 11 B15R2.4343 C=CC(C)Sc1ccc2c(c1)NCC2 62a_100011215867_100000754641 [0,0,0,0,0,0|4,0,0]=4 12 B15R2.4343 C=CC(C)Sc1ccc2c(c1)OCC2 62a_100011215867_100009818566 [0,0,0,0,0,0|3,0,0]=3 13 B15R2.4343 C=CC(C)Sc1ccc2ccoc2c1 62a_100011215867_100000759542 [0,0,0,0,0,0|3,0,1]=4 14 B15R2.4343 C=CC(C)Sc1ccc2cnoc2c1 62a_100011215867_100009817722 [0,0,0,0,0,0|4,0,0]=4 15 B15R2.4343 C=CC(C)Sc1ccc2ncoc2c1 62a_100011215867_100009817590 [0,0,0,0,0,0|3,0,1]=4 16 B15R2.4343 C=CC(C)Sc1ccc2occc2c1 62a_100011215867_100000691453 [0,0,0,0,0,0|3,0,1]=4 17 B15R2.4343 C=CC(C)Sc1ccc2ocnc2c1 62a_100011215867_100009816175 [0,0,0,0,0,0|3,0,1]=4 18 B15R2.4343 C=CC(C)Sc1ccc2oncc2c1 62a_100011215867_100009817723 [0,0,0,0,0,0|4,0,0]=4 19 B15R2.4343 CC(C#N)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000184139 [0,0,0,0,0,0|3,0,1]=4 20 B15R2.4343 CC(C#N)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000184139 [0,0,0,0,0,0|2,0,1]=3 21 B15R2.4343 CC(C#N)Sc1ccc2c(c1)CCO2 62a_100000703298_100000729065 [0,0,0,0,0,0|3,0,1]=4 22 B15R2.4343 CC(C#N)Sc1ccc2c(c1)CCO2 62a_100000729065_100000703298 [0,0,0,0,0,0|3,0,1]=4 23 B15R2.4343 CC(C#N)Sc1ccc2c(c1)OCC2 62a_100000703298_100009818566 [0,0,0,0,0,0|3,0,1]=4 24 B15R2.4343 CC(C#N)Sc1ccc2c(c1)OCC2 62a_100009818566_100000703298 [0,0,0,0,0,0|3,0,1]=4 25 B15R2.4343 CC(CO)Nc1ccc2c(c1)CCO2 2230a_100000736984_100012180447 [0,0,0,0,0,0|2,0,2]=4 26 B15R2.4343 CC(CO)Nc1ccc2c(c1)CCO2 34a_100000736984_100012180447 [0,0,0,0,0,0|2,0,2]=4 27 B15R2.4343 CC(CO)Nc1ccc2c(c1)OCO2 2230a_100000209953_100012180447 [0,0,0,0,0,0|1,0,2]=3 28 B15R2.4343 CC(CO)Nc1ccc2c(c1)OCO2 34a_100000209953_100012180447 [0,0,0,0,0,0|1,0,2]=3 29 B15R2.4343 CC(CO)Oc1ccc2c(c1)OCO2 34a_100000210298_100012180447 [0,0,0,0,0,0|1,0,2]=3 30 B15R2.4343 CC(CO)Sc1ccc2c(c1)CCO2 62a_100012180447_100000729065 [0,0,0,0,0,0|2,0,2]=4 31 B15R2.4343 CC(CO)Sc1ccc2c(c1)OCC2 62a_100012180447_100009818566 [0,0,0,0,0,0|2,0,2]=4 32 B15R2.4343 CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210202 [0,0,0,0,0,0|2,0,2]=4 33 B15R2.4343 CCC(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000758301 [0,0,0,0,0,0|3,0,1]=4 34 B15R2.4343 CCC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100011215416 [0,0,0,0,0,0|3,0,1]=4 35 B15R2.4343 CCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000758301 [0,0,0,0,0,0|2,0,1]=3 36 B15R2.4343 CCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100011215416 [0,0,0,0,0,0|2,0,1]=3 37 B15R2.4343 CCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100011215416 [0,0,0,0,0,0|2,0,1]=3 38 B15R2.4343 CCC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000758301 [0,0,0,0,0,0|3,0,1]=4 39 B15R2.4343 CCC(C)Sc1ccc2c(c1)CCO2 62a_100000758301_100000729065 [0,0,0,0,0,0|3,0,1]=4 40 B15R2.4343 CCC(C)Sc1ccc2c(c1)OCC2 62a_100000758301_100009818566 [0,0,0,0,0,0|3,0,1]=4 41 B15R2.4343 CCC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000758301 [0,0,0,0,0,0|3,0,1]=4 42 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210202 [0,0,0,0,0,0|2,0,1]=3 43 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000204670 [0,0,0,0,0,0|2,0,1]=3 44 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000225621_100000189651 [0,0,0,0,0,0|2,0,1]=3 45 B15R2.4343 CN(CF)Cc1ccc2c(c1)OCO2 269982a_100000186720_100015361967 [0,0,0,0,0,0|2,0,1]=3 46 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 11a_106832991635_100000743733 [0,0,0,0,0,0|3,0,1]=4 47 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 240690a_100102657272_100000743733 [0,0,0,0,0,0|3,0,1]=4 48 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 527a_100102657272_100000743733 [0,0,0,0,0,0|3,0,1]=4 49 B15R2.4343 COC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100009879195 [0,0,0,0,0,0|4,0,0]=4 50 B15R2.4343 COC(C)Sc1ccc2c(c1)CCO2 62a_100009879195_100000729065 [0,0,0,0,0,0|4,0,0]=4 51 B15R2.4343 COC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100009879195 [0,0,0,0,0,0|4,0,0]=4 52 B15R2.4343 COC(C)Sc1ccc2c(c1)OCC2 62a_100009879195_100009818566 [0,0,0,0,0,0|4,0,0]=4 53 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)CCO2 62a_100000729065_100016084084 [0,0,0,0,0,0|2,0,2]=4 54 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)CCO2 62a_100016084084_100000729065 [0,0,0,0,0,0|2,0,2]=4 55 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)OCC2 62a_100009818566_100016084084 [0,0,0,0,0,0|2,0,2]=4 56 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)OCC2 62a_100016084084_100009818566 [0,0,0,0,0,0|2,0,2]=4 57 B15R2.4343 O=C(CF)Cc1ccc2c(c1)OCO2 1458a_100000743733_100015361967 [0,0,0,0,0,0|2,0,2]=4 58 B14R2.991 C#CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000038162 [1,0,0,0,0,0|2,0,1]=4 59 B14R2.991 C#CCNc1ccc2c(c1)OCO2 34a_100000209953_100000184674 [1,0,0,0,0,0|2,0,1]=4 60 B14R2.991 C#CCOc1ccc2c(c1)OCO2 34a_100000210298_100000184674 [1,0,0,0,0,0|2,0,1]=4 61 B14R2.991 C=CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210623 [1,0,0,0,0,0|3,0,0]=4 62 B14R2.991 C=CCNc1ccc2c(c1)CCO2 34a_100000736984_100015514636 [1,0,0,0,0,0|3,0,0]=4 63 B14R2.991 C=CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210623 [1,0,0,0,0,0|2,0,0]=3 64 B14R2.991 C=CCNc1ccc2c(c1)OCO2 34a_100000209953_100015514636 [1,0,0,0,0,0|2,0,0]=3 65 B14R2.991 C=CCOc1ccc2c(c1)OCO2 34a_100000210298_100015514636 [1,0,0,0,0,0|2,0,0]=3 66 B14R2.991 C=CCSc1ccc2c(c1)CCO2 62a_100000210623_100000729065 [1,0,0,0,0,0|3,0,0]=4 67 B14R2.991 C=CCSc1ccc2c(c1)CCO2 62a_100000729065_100000210623 [1,0,0,0,0,0|3,0,0]=4 68 B14R2.991 C=CCSc1ccc2c(c1)OCC2 62a_100000210623_100009818566 [1,0,0,0,0,0|3,0,0]=4 69 B14R2.991 C=CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210623 [1,0,0,0,0,0|3,0,0]=4 70 B14R2.991 CCCCc1ccc2c(c1)CCO2 271570a_100020621405_100000729065 [1,0,0,0,0,0|2,0,1]=4 71 B14R2.991 CCCCc1ccc2c(c1)OCC2 271570a_100020621405_100009818566 [1,0,0,0,0,0|2,0,1]=4 72 B14R2.991 CCCCc1ccc2c(c1)OCO2 271570a_100020621405_100000688060 [1,0,0,0,0,0|1,0,1]=3 73 B14R2.991 CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210303 [1,0,0,0,0,0|2,0,1]=4 74 B14R2.991 CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000210303 [1,0,0,0,0,0|2,0,1]=4 75 B14R2.991 CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000210303 [1,0,0,0,0,0|2,0,1]=4 76 B14R2.991 CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210202 [1,0,0,0,0,0|2,0,1]=4 77 B14R2.991 CCNCc1ccc2c(c1)OCO2 34a_100000210006_100000210202 [1,0,0,0,0,0|2,0,1]=4 78 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100000210967_100000210202 [1,0,0,0,0,0|2,0,1]=4 79 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100121572206_100000189651 [1,0,0,0,0,0|2,0,1]=4 80 B14R2.991 CNCCc1ccc2c(c1)CCO2 2230a_106832991635_100000763274 [1,0,0,0,0,0|3,0,0]=4 81 B14R2.991 CNCCc1ccc2c(c1)CCO2 34a_100102657272_100000763274 [1,0,0,0,0,0|3,0,0]=4 82 B14R2.991 CNCCc1ccc2c(c1)CCO2 7a_106832991635_100000763274 [1,0,0,0,0,0|3,0,0]=4 83 B14R2.991 CNCCc1ccc2c(c1)OCO2 2230a_100000204656_200000210301 [1,0,0,0,0,0|2,0,0]=3 84 B14R2.991 CNCCc1ccc2c(c1)OCO2 34a_100000204656_200000210301 [1,0,0,0,0,0|2,0,0]=3 85 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100012161074_200000210301 [1,0,0,0,0,0|3,0,0]=4 86 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100138415774_100000763274 [1,0,0,0,0,0|3,0,0]=4 87 B14R2.991 COCCc1ccc2c(c1)CCO2 7a_100012161074_200000210301 [1,0,0,0,0,0|3,0,0]=4 88 B14R2.991 COCCc1ccc2c(c1)OCO2 34a_100011934097_200000210301 [1,0,0,0,0,0|2,0,0]=3 89 B14R2.991 COCNc1ccc2c(c1)OCO2 2230a_100000209953_100000766300 [1,0,0,0,0,0|3,0,0]=4 90 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_100000763274_200000210301 [1,0,0,0,0,0|3,0,0]=4 91 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_200000210301_100000763274 [1,0,0,0,0,0|3,0,0]=4 92 B14R2.991 CSCNc1ccc2c(c1)OCO2 2230a_100000209953_100011218213 [1,0,0,0,0,0|3,0,0]=4 93 B14R2.991 CSCNc1ccc2c(c1)OCO2 34a_100000209953_100011218213 [1,0,0,0,0,0|3,0,0]=4 94 B14R2.991 CSCOc1ccc2c(c1)OCO2 34a_100000210298_100011218213 [1,0,0,0,0,0|3,0,0]=4 95 B14R2.991 FCCNc1ccc2c(c1)OCO2 2230a_100000209953_100011217306 [1,0,0,0,0,0|2,0,1]=4 96 B14R2.991 FCCNc1ccc2c(c1)OCO2 34a_100000209953_100011217306 [1,0,0,0,0,0|2,0,1]=4 97 B14R2.991 FCCOc1ccc2c(c1)OCO2 34a_100000210298_100011217306 [1,0,0,0,0,0|2,0,1]=4 98 B14R2.991 FCNCc1ccc2c(c1)OCO2 34a_100000210006_100015361967 [1,0,0,0,0,0|2,0,1]=4 99 B14R2.991 FCOCc1ccc2c(c1)OCO2 34a_100000210967_100015361967 [1,0,0,0,0,0|2,0,1]=4 100 B14R2.991 N#CCNc1ccc2c(c1)OCO2 2230a_100000209953_100011215382 [1,0,0,0,0,0|2,0,1]=4 101 B14R2.991 O=CCNc1ccc2c(c1)CCC2 2230a_100000211504_200015260668 [1,0,0,0,0,0|3,0,0]=4 102 B14R2.991 O=CCNc1ccc2c(c1)CCC2 34a_100000211504_200009817547 [1,0,0,0,0,0|3,0,0]=4 103 B14R2.991 O=CCNc1ccc2c(c1)CCO2 2230a_100000736984_200015260668 [1,0,0,0,0,0|2,0,0]=3 104 B14R2.991 O=CCNc1ccc2c(c1)CCO2 34a_100000736984_200009817547 [1,0,0,0,0,0|2,0,0]=3 105 B14R2.991 O=CCNc1ccc2c(c1)OCO2 2230a_100000209953_200015260668 [1,0,0,0,0,0|1,0,0]=2 106 B14R2.991 O=CCNc1ccc2c(c1)OCO2 34a_100000209953_200009817547 [1,0,0,0,0,0|1,0,0]=2 107 B14R2.991 O=CCNc1ccc2ccoc2c1 34a_100000102395_200009817547 [1,0,0,0,0,0|2,0,1]=4 108 B14R2.991 O=CCNc1ccc2cnoc2c1 34a_100000084182_200009817547 [1,0,0,0,0,0|3,0,0]=4 109 B14R2.991 O=CCNc1ccc2ncoc2c1 34a_100011248239_200009817547 [1,0,0,0,0,0|2,0,1]=4 110 B14R2.991 O=CCNc1ccc2occc2c1 34a_106430523501_200009817547 [1,0,0,0,0,0|2,0,1]=4 111 B14R2.991 O=CCNc1ccc2ocnc2c1 34a_100011219863_200009817547 [1,0,0,0,0,0|2,0,1]=4 112 B14R2.991 O=CCNc1ccc2oncc2c1 34a_100000037595_200009817547 [1,0,0,0,0,0|3,0,0]=4 113 B14R2.991 O=CCOc1ccc2c(c1)CCC2 34a_100000209987_200009817547 [1,0,0,0,0,0|3,0,0]=4 114 B14R2.991 O=CCOc1ccc2c(c1)CCC2 7a_100000209987_200015260668 [1,0,0,0,0,0|3,0,0]=4 115 B14R2.991 O=CCOc1ccc2c(c1)CCN2 34a_100020636429_200009817547 [1,0,0,0,0,0|3,0,0]=4 116 B14R2.991 O=CCOc1ccc2c(c1)NCC2 34a_100020636427_200009817547 [1,0,0,0,0,0|3,0,0]=4 117 B14R2.991 O=CCOc1ccc2c(c1)OCO2 34a_100000210298_200009817547 [1,0,0,0,0,0|1,0,0]=2 118 B14R2.991 O=CCOc1ccc2ccoc2c1 34a_100000089557_200009817547 [1,0,0,0,0,0|2,0,1]=4 119 B14R2.991 O=CCOc1ccc2ccoc2c1 7a_100000089557_200015260668 [1,0,0,0,0,0|2,0,1]=4 120 B14R2.991 O=CCOc1ccc2cnoc2c1 34a_100000098417_200009817547 [1,0,0,0,0,0|3,0,0]=4 121 B14R2.991 O=CCOc1ccc2cnoc2c1 7a_100000098417_200015260668 [1,0,0,0,0,0|3,0,0]=4 122 B14R2.991 O=CCOc1ccc2occc2c1 34a_100000070125_200009817547 [1,0,0,0,0,0|2,0,1]=4 123 B14R2.991 O=CCOc1ccc2occc2c1 7a_100000070125_200015260668 [1,0,0,0,0,0|2,0,1]=4 124 B14R2.991 O=CCSc1cc2c(cn1)OCC2 62a_102495363667_200015260668 [1,0,0,0,0,0|3,0,0]=4 125 B14R2.991 O=CCSc1cc2c(cn1)OCC2 62a_200015260668_102495363667 [1,0,0,0,0,0|3,0,0]=4 126 B14R2.991 O=CCSc1ccc2c(c1)CCC2 62a_100000745594_200015260668 [1,0,0,0,0,0|3,0,0]=4 127 B14R2.991 O=CCSc1ccc2c(c1)CCC2 62a_200015260668_100000745594 [1,0,0,0,0,0|3,0,0]=4 128 B14R2.991 O=CCSc1ccc2c(c1)CCN2 62a_100000691068_200015260668 [1,0,0,0,0,0|3,0,0]=4 129 B14R2.991 O=CCSc1ccc2c(c1)CCN2 62a_200015260668_100000691068 [1,0,0,0,0,0|3,0,0]=4 130 B14R2.991 O=CCSc1ccc2c(c1)CCO2 62a_100000729065_200015260668 [1,0,0,0,0,0|2,0,0]=3 131 B14R2.991 O=CCSc1ccc2c(c1)CCO2 62a_200015260668_100000729065 [1,0,0,0,0,0|2,0,0]=3 132 B14R2.991 O=CCSc1ccc2c(c1)NCC2 62a_100000754641_200015260668 [1,0,0,0,0,0|3,0,0]=4 133 B14R2.991 O=CCSc1ccc2c(c1)NCC2 62a_200015260668_100000754641 [1,0,0,0,0,0|3,0,0]=4 134 B14R2.991 O=CCSc1ccc2c(c1)OCC2 62a_100009818566_200015260668 [1,0,0,0,0,0|2,0,0]=3 135 B14R2.991 O=CCSc1ccc2c(c1)OCC2 62a_200015260668_100009818566 [1,0,0,0,0,0|2,0,0]=3 136 B14R2.991 O=CCSc1ccc2ccoc2c1 62a_200015260668_100000759542 [1,0,0,0,0,0|2,0,1]=4 137 B14R2.991 O=CCSc1ccc2cnoc2c1 62a_200015260668_100009817722 [1,0,0,0,0,0|3,0,0]=4 138 B14R2.991 O=CCSc1ccc2ncoc2c1 62a_200015260668_100009817590 [1,0,0,0,0,0|2,0,1]=4 139 B14R2.991 O=CCSc1ccc2occc2c1 62a_200015260668_100000691453 [1,0,0,0,0,0|2,0,1]=4 140 B14R2.991 O=CCSc1ccc2ocnc2c1 62a_200015260668_100009816175 [1,0,0,0,0,0|2,0,1]=4 141 B14R2.991 O=CCSc1ccc2oncc2c1 62a_200015260668_100009817723 [1,0,0,0,0,0|3,0,0]=4 142 B14R2.991 OCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000211926 [1,0,0,0,0,0|1,0,2]=4 143 B14R2.991 OCCNc1ccc2c(c1)OCO2 34a_100000209953_100000211926 [1,0,0,0,0,0|1,0,2]=4 144 B14R2.991 OCCOc1ccc2c(c1)OCO2 34a_100000210298_100000211926 [1,0,0,0,0,0|1,0,2]=4 145 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 2230a_100000204656_200025704644 [1,0,0,0,0,0|2,0,0]=3 146 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 34a_100000204656_200025704644 [1,0,0,0,0,0|2,0,0]=3 147 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 34a_100012161074_200025704644 [1,0,0,0,0,0|3,0,0]=4 148 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 7a_100012161074_200025704644 [1,0,0,0,0,0|3,0,0]=4 149 B14R2.991 [13CH3]OCCc1ccc2c(c1)OCO2 34a_100011934097_200025704644 [1,0,0,0,0,0|2,0,0]=3 150 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_100000763274_200025704644 [1,0,0,0,0,0|3,0,0]=4 151 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_200025704644_100000763274 [1,0,0,0,0,0|3,0,0]=4 152 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [1,0,0,0,0,0|0,0,3]=4 153 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [1,0,0,0,0,0|1,0,1]=3 154 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [1,0,0,0,0,0|0,0,1]=2 155 B14R2.1008 CC(=O)Cc1ccc2ncoc2c1 1458a_100000070787_106359897996 [1,0,0,0,0,0|1,0,2]=4 156 B14R2.1008 CC(=O)Cc1ccc2occc2c1 1458a_100000096804_200000210301 [1,0,0,0,0,0|1,0,2]=4 157 B14R2.1008 CC(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200000210301 [1,0,0,0,0,0|1,0,2]=4 158 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100015343762 [1,0,0,0,0,0|2,0,1]=4 159 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100015343762 [1,0,0,0,0,0|2,0,1]=4 160 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000070787 [1,0,0,0,0,0|2,0,1]=4 161 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100103153847 [1,0,0,0,0,0|2,0,1]=4 162 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [1,0,0,0,0,0|1,0,1]=3 163 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [1,0,0,0,0,0|1,0,1]=3 164 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [1,0,0,0,0,0|1,0,1]=3 165 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [1,0,0,0,0,0|1,0,1]=3 166 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000210206 [1,0,0,0,0,0|2,0,1]=4 167 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100000210206 [1,0,0,0,0,0|2,0,1]=4 168 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000210206 [1,0,0,0,0,0|1,0,1]=3 169 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210206 [1,0,0,0,0,0|1,0,1]=3 170 B14R2.1008 CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210206 [1,0,0,0,0,0|1,0,1]=3 171 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000210206_100000729065 [1,0,0,0,0,0|2,0,1]=4 172 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000210206 [1,0,0,0,0,0|2,0,1]=4 173 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100000210206_100009818566 [1,0,0,0,0,0|2,0,1]=4 174 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000210206 [1,0,0,0,0,0|2,0,1]=4 175 B14R2.1008 CN(C)Cc1ccc2c(c1)CCO2 270004a_100102631434_100011218456 [1,0,0,0,0,0|2,0,1]=4 176 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [1,0,0,0,0,0|1,0,1]=3 177 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [1,0,0,0,0,0|1,0,1]=3 178 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [1,0,0,0,0,0|1,0,1]=3 179 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [1,0,0,0,0,0|1,0,1]=3 180 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [1,0,0,0,0,0|1,0,1]=3 181 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [1,0,0,0,0,0|1,0,1]=3 182 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [1,0,0,0,0,0|0,0,1]=2 183 B14R2.1008 [13CH3]C(=O)Cc1ccc2occc2c1 1458a_100000096804_200025704644 [1,0,0,0,0,0|1,0,2]=4 184 B14R2.1008 [13CH3]C(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200025704644 [1,0,0,0,0,0|1,0,2]=4 185 B16R2.2151 C#CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000038162 [0,1,0,0,0,0|2,0,1]=4 186 B16R2.2151 C#CCN(C)Cc1ccc2c(c1)OCO2 34a_100000225692_100000189651 [0,1,0,0,0,0|2,0,1]=4 187 B16R2.2151 C=CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210623 [0,1,0,0,0,0|2,0,1]=4 188 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)CCO2 270004a_100000225617_100011218456 [0,1,0,0,0,0|3,0,0]=4 189 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210623 [0,1,0,0,0,0|2,0,0]=3 190 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000210623 [0,1,0,0,0,0|2,0,0]=3 191 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000225617_100000189651 [0,1,0,0,0,0|2,0,0]=3 192 B16R2.2151 CC(CC#N)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009813641 [0,1,0,0,0,0|2,0,1]=4 193 B16R2.2151 CC(CCO)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009893172 [0,1,0,0,0,0|1,0,2]=4 194 B16R2.2151 CC(CCO)Nc1ccc2c(c1)OCO2 34a_100000209953_100009893172 [0,1,0,0,0,0|1,0,2]=4 195 B16R2.2151 CC(CCO)Oc1ccc2c(c1)OCO2 34a_100000210298_100009893172 [0,1,0,0,0,0|1,0,2]=4 196 B16R2.2151 CCCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000766640 [0,1,0,0,0,0|2,0,1]=4 197 B16R2.2151 CCCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000766640 [0,1,0,0,0,0|2,0,1]=4 198 B16R2.2151 CCCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000766640 [0,1,0,0,0,0|2,0,1]=4 199 B16R2.2151 CCCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210303 [0,1,0,0,0,0|2,0,1]=4 200 B16R2.2151 CCCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000210303 [0,1,0,0,0,0|2,0,1]=4 201 B16R2.2151 CCCN(C)Cc1ccc2c(c1)OCO2 269982a_100000747261_100000189651 [0,1,0,0,0,0|2,0,1]=4 202 B16R2.2151 CN(CC#N)Cc1ccc2c(c1)OCO2 2230a_100000186720_100011215382 [0,1,0,0,0,0|2,0,1]=4 203 B16R2.2151 CN(CC#N)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011214920 [0,1,0,0,0,0|2,0,1]=4 204 B16R2.2151 CN(CC=O)Cc1ccc2c(c1)OCO2 2230a_100000186720_200015260668 [0,1,0,0,0,0|1,0,0]=2 205 B16R2.2151 CN(CC=O)Cc1ccc2c(c1)OCO2 269982a_100000186720_200015260668 [0,1,0,0,0,0|1,0,0]=2 206 B16R2.2151 CN(CCF)Cc1ccc2c(c1)OCO2 2230a_100000186720_100011217306 [0,1,0,0,0,0|2,0,1]=4 207 B16R2.2151 CN(CCF)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011217306 [0,1,0,0,0,0|2,0,1]=4 208 B16R2.2151 CN(CCO)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000211926 [0,1,0,0,0,0|1,0,2]=4 209 B16R2.2151 CN(CCO)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000211926 [0,1,0,0,0,0|1,0,2]=4 210 B16R2.2151 CN(CCO)Cc1ccc2c(c1)OCO2 269982a_100000210263_100000189651 [0,1,0,0,0,0|1,0,2]=4 211 B16R2.2151 CNCC(C)Cc1ccc2c(c1)OCO2 270004a_106832991635_100000017537 [0,1,0,0,0,0|1,0,1]=3 212 B16R2.2151 COCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000765312 [0,1,0,0,0,0|1,0,2]=4 213 B16R2.2151 COCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000765312 [0,1,0,0,0,0|1,0,2]=4 214 B16R2.2151 COCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000765312 [0,1,0,0,0,0|1,0,2]=4 215 B16R2.2151 COCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000766300 [0,1,0,0,0,0|1,0,2]=4 216 B16R2.2151 COCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000766300 [0,1,0,0,0,0|1,0,2]=4 217 B16R2.2151 CSCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100011218213 [0,1,0,0,0,0|1,1,1]=4 218 B16R2.2151 CSCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011218213 [0,1,0,0,0,0|1,1,1]=4 219 B16R2.2183 C#CC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000035995 [0,1,0,0,0,0|1,0,2]=4 220 B16R2.2183 CC(C#N)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000703298 [0,1,0,0,0,0|1,0,2]=4 221 B16R2.2183 CCC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000758301 [0,1,0,0,0,0|1,0,2]=4 222 B16R2.6257 CC(=O)C(C)Cc1ccc2c(c1)OCO2 1458a_100000062412_200000210301 [0,1,0,0,0,0|0,0,0]=1 223 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)CCC2 2230a_100000211504_100009814033 [0,1,0,0,0,0|3,0,0]=4 224 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100009814033 [0,1,0,0,0,0|2,0,0]=3 225 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009814033 [0,1,0,0,0,0|1,0,0]=2 226 B16R2.6257 CC(=O)C(C)Oc1ccc2c(c1)CCC2 1458a_100000246040_200000210301 [0,1,0,0,0,0|3,0,0]=4 227 B16R2.6257 CC(=O)C(C)Oc1ccc2c(c1)CCC2 7a_100000209987_100000179758 [0,1,0,0,0,0|3,0,0]=4 228 B16R2.6257 CC(=O)C(C)Oc1ccc2c(c1)OCO2 1458a_100000246018_200000210301 [0,1,0,0,0,0|1,0,0]=2 229 B16R2.6257 CC(=O)C(C)Oc1ccc2ccoc2c1 7a_100000089557_100000179758 [0,1,0,0,0,0|2,0,1]=4 230 B16R2.6257 CC(=O)C(C)Oc1ccc2cnoc2c1 7a_100000098417_100000179758 [0,1,0,0,0,0|3,0,0]=4 231 B16R2.6257 CC(=O)C(C)Oc1ccc2occc2c1 7a_100000070125_100000179758 [0,1,0,0,0,0|2,0,1]=4 232 B16R2.6257 CC(=O)C(C)Sc1cc2c(cn1)OCC2 62a_100009814033_102495363667 [0,1,0,0,0,0|3,0,0]=4 233 B16R2.6257 CC(=O)C(C)Sc1cc2c(cn1)OCC2 62a_102495363667_100009814033 [0,1,0,0,0,0|3,0,0]=4 234 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCC2 62a_100000745594_100009814033 [0,1,0,0,0,0|3,0,0]=4 235 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCC2 62a_100009814033_100000745594 [0,1,0,0,0,0|3,0,0]=4 236 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCN2 62a_100000691068_100009814033 [0,1,0,0,0,0|3,0,0]=4 237 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCN2 62a_100009814033_100000691068 [0,1,0,0,0,0|3,0,0]=4 238 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100009814033 [0,1,0,0,0,0|2,0,0]=3 239 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCO2 62a_100009814033_100000729065 [0,1,0,0,0,0|2,0,0]=3 240 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100009814033 [0,1,0,0,0,0|3,0,0]=4 241 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100009814033_100000754641 [0,1,0,0,0,0|3,0,0]=4 242 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)OCC2 62a_100009814033_100009818566 [0,1,0,0,0,0|2,0,0]=3 243 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100009814033 [0,1,0,0,0,0|2,0,0]=3 244 B16R2.6257 CC(=O)C(C)Sc1ccc2ccoc2c1 62a_100009814033_100000759542 [0,1,0,0,0,0|2,0,1]=4 245 B16R2.6257 CC(=O)C(C)Sc1ccc2cnoc2c1 62a_100009814033_100009817722 [0,1,0,0,0,0|3,0,0]=4 246 B16R2.6257 CC(=O)C(C)Sc1ccc2ncoc2c1 62a_100009814033_100009817590 [0,1,0,0,0,0|2,0,1]=4 247 B16R2.6257 CC(=O)C(C)Sc1ccc2occc2c1 62a_100009814033_100000691453 [0,1,0,0,0,0|2,0,1]=4 248 B16R2.6257 CC(=O)C(C)Sc1ccc2ocnc2c1 62a_100009814033_100009816175 [0,1,0,0,0,0|2,0,1]=4 249 B16R2.6257 CC(=O)C(C)Sc1ccc2oncc2c1 62a_100009814033_100009817723 [0,1,0,0,0,0|3,0,0]=4 250 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 11a_100000186720_100015343762 [0,1,0,0,0,0|1,0,0]=2 251 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 240690a_100000186720_100015343762 [0,1,0,0,0,0|1,0,0]=2 252 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 527a_100000186720_100103153847 [0,1,0,0,0,0|1,0,0]=2 253 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210206 [0,1,0,0,0,0|2,0,1]=4 254 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 2230a_100015183898_200000210301 [0,1,0,0,0,0|2,0,1]=4 255 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000210206 [0,1,0,0,0,0|2,0,1]=4 256 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100015183898_200000210301 [0,1,0,0,0,0|2,0,1]=4 257 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_200000211004_100000189651 [0,1,0,0,0,0|2,0,1]=4 258 B16R2.6257 CC(C)N([13CH3])Cc1ccc2c(c1)OCO2 2230a_100015183898_200025704644 [0,1,0,0,0,0|2,0,1]=4 259 B16R2.6257 CC(C)N([13CH3])Cc1ccc2c(c1)OCO2 269982a_100015183898_200025704644 [0,1,0,0,0,0|2,0,1]=4 260 B16R2.6257 CC(Cc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000062412_200025704644 [0,1,0,0,0,0|0,0,0]=1 261 B16R2.6257 CC(Nc1ccc2c(c1)CCC2)C(=O)N 2230a_100000211504_100000702099 [0,1,0,0,0,0|3,0,0]=4 262 B16R2.6257 CC(Nc1ccc2c(c1)CCC2)C(=O)N 34a_100000211504_100000702099 [0,1,0,0,0,0|3,0,0]=4 263 B16R2.6257 CC(Nc1ccc2c(c1)CCO2)C(=O)N 2230a_100000736984_100000702099 [0,1,0,0,0,0|2,0,0]=3 264 B16R2.6257 CC(Nc1ccc2c(c1)CCO2)C(=O)N 34a_100000736984_100000702099 [0,1,0,0,0,0|2,0,0]=3 265 B16R2.6257 CC(Nc1ccc2c(c1)OCO2)C(=O)N 2230a_100000209953_100000702099 [0,1,0,0,0,0|1,0,0]=2 266 B16R2.6257 CC(Nc1ccc2c(c1)OCO2)C(=O)N 34a_100000209953_100000702099 [0,1,0,0,0,0|1,0,0]=2 267 B16R2.6257 CC(Nc1ccc2ccoc2c1)C(=O)N 34a_100000102395_100000702099 [0,1,0,0,0,0|2,0,1]=4 268 B16R2.6257 CC(Nc1ccc2cnoc2c1)C(=O)N 34a_100000084182_100000702099 [0,1,0,0,0,0|3,0,0]=4 269 B16R2.6257 CC(Nc1ccc2ncoc2c1)C(=O)N 34a_100011248239_100000702099 [0,1,0,0,0,0|2,0,1]=4 270 B16R2.6257 CC(Nc1ccc2occc2c1)C(=O)N 34a_106430523501_100000702099 [0,1,0,0,0,0|2,0,1]=4 271 B16R2.6257 CC(Nc1ccc2ocnc2c1)C(=O)N 34a_100011219863_100000702099 [0,1,0,0,0,0|2,0,1]=4 272 B16R2.6257 CC(Nc1ccc2oncc2c1)C(=O)N 34a_100000037595_100000702099 [0,1,0,0,0,0|3,0,0]=4 273 B16R2.6257 CC(Oc1ccc2c(c1)CCC2)C(=O)N 34a_100000209987_100000702099 [0,1,0,0,0,0|3,0,0]=4 274 B16R2.6257 CC(Oc1ccc2c(c1)CCC2)C(=O)N 7a_100000209987_100000702099 [0,1,0,0,0,0|3,0,0]=4 275 B16R2.6257 CC(Oc1ccc2c(c1)CCC2)C(=O)[13CH3] 1458a_100000246040_200025704644 [0,1,0,0,0,0|3,0,0]=4 276 B16R2.6257 CC(Oc1ccc2c(c1)CCN2)C(=O)N 34a_100020636429_100000702099 [0,1,0,0,0,0|3,0,0]=4 277 B16R2.6257 CC(Oc1ccc2c(c1)NCC2)C(=O)N 34a_100020636427_100000702099 [0,1,0,0,0,0|3,0,0]=4 278 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)N 34a_100000210298_100000702099 [0,1,0,0,0,0|1,0,0]=2 279 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000246018_200025704644 [0,1,0,0,0,0|1,0,0]=2 280 B16R2.6257 CC(Oc1ccc2ccoc2c1)C(=O)N 34a_100000089557_100000702099 [0,1,0,0,0,0|2,0,1]=4 281 B16R2.6257 CC(Oc1ccc2ccoc2c1)C(=O)N 7a_100000089557_100000702099 [0,1,0,0,0,0|2,0,1]=4 282 B16R2.6257 CC(Oc1ccc2cnoc2c1)C(=O)N 34a_100000098417_100000702099 [0,1,0,0,0,0|3,0,0]=4 283 B16R2.6257 CC(Oc1ccc2cnoc2c1)C(=O)N 7a_100000098417_100000702099 [0,1,0,0,0,0|3,0,0]=4 284 B16R2.6257 CC(Oc1ccc2occc2c1)C(=O)N 34a_100000070125_100000702099 [0,1,0,0,0,0|2,0,1]=4 285 B16R2.6257 CC(Oc1ccc2occc2c1)C(=O)N 7a_100000070125_100000702099 [0,1,0,0,0,0|2,0,1]=4 286 B16R2.6257 CC(Sc1cc2c(cn1)OCC2)C(=O)N 62a_100000702099_102495363667 [0,1,0,0,0,0|3,0,0]=4 287 B16R2.6257 CC(Sc1cc2c(cn1)OCC2)C(=O)N 62a_102495363667_100000702099 [0,1,0,0,0,0|3,0,0]=4 288 B16R2.6257 CC(Sc1ccc2c(c1)CCC2)C(=O)N 62a_100000702099_100000745594 [0,1,0,0,0,0|3,0,0]=4 289 B16R2.6257 CC(Sc1ccc2c(c1)CCC2)C(=O)N 62a_100000745594_100000702099 [0,1,0,0,0,0|3,0,0]=4 290 B16R2.6257 CC(Sc1ccc2c(c1)CCN2)C(=O)N 62a_100000691068_100000702099 [0,1,0,0,0,0|3,0,0]=4 291 B16R2.6257 CC(Sc1ccc2c(c1)CCN2)C(=O)N 62a_100000702099_100000691068 [0,1,0,0,0,0|3,0,0]=4 292 B16R2.6257 CC(Sc1ccc2c(c1)CCO2)C(=O)N 62a_100000702099_100000729065 [0,1,0,0,0,0|2,0,0]=3 293 B16R2.6257 CC(Sc1ccc2c(c1)CCO2)C(=O)N 62a_100000729065_100000702099 [0,1,0,0,0,0|2,0,0]=3 294 B16R2.6257 CC(Sc1ccc2c(c1)NCC2)C(=O)N 62a_100000702099_100000754641 [0,1,0,0,0,0|3,0,0]=4 295 B16R2.6257 CC(Sc1ccc2c(c1)NCC2)C(=O)N 62a_100000754641_100000702099 [0,1,0,0,0,0|3,0,0]=4 296 B16R2.6257 CC(Sc1ccc2c(c1)OCC2)C(=O)N 62a_100000702099_100009818566 [0,1,0,0,0,0|2,0,0]=3 297 B16R2.6257 CC(Sc1ccc2c(c1)OCC2)C(=O)N 62a_100009818566_100000702099 [0,1,0,0,0,0|2,0,0]=3 298 B16R2.6257 CC(Sc1ccc2ccoc2c1)C(=O)N 62a_100000702099_100000759542 [0,1,0,0,0,0|2,0,1]=4 299 B16R2.6257 CC(Sc1ccc2cnoc2c1)C(=O)N 62a_100000702099_100009817722 [0,1,0,0,0,0|3,0,0]=4 300 B16R2.6257 CC(Sc1ccc2ncoc2c1)C(=O)N 62a_100000702099_100009817590 [0,1,0,0,0,0|2,0,1]=4 301 B16R2.6257 CC(Sc1ccc2occc2c1)C(=O)N 62a_100000702099_100000691453 [0,1,0,0,0,0|2,0,1]=4 302 B16R2.6257 CC(Sc1ccc2ocnc2c1)C(=O)N 62a_100000702099_100009816175 [0,1,0,0,0,0|2,0,1]=4 303 B16R2.6257 CC(Sc1ccc2oncc2c1)C(=O)N 62a_100000702099_100009817723 [0,1,0,0,0,0|3,0,0]=4 304 B16R2.6257 NC(=O)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100011215815 [0,1,0,0,0,0|2,0,1]=4 305 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)CCO2 2230a_100000736984_100009813875 [0,1,0,0,0,0|3,0,0]=4 306 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)CCO2 34a_100000736984_100009813875 [0,1,0,0,0,0|3,0,0]=4 307 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009813875 [0,1,0,0,0,0|2,0,0]=3 308 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)OCO2 34a_100000209953_100009813875 [0,1,0,0,0,0|2,0,0]=3 309 B16R2.6257 NC(=O)C(F)Oc1ccc2c(c1)OCO2 34a_100000210298_100009813875 [0,1,0,0,0,0|2,0,0]=3 310 B16R2.6257 NC(=O)C(F)Sc1ccc2c(c1)CCO2 62a_100000729065_100009813875 [0,1,0,0,0,0|3,0,0]=4 311 B16R2.6257 NC(=O)C(F)Sc1ccc2c(c1)CCO2 62a_100009813875_100000729065 [0,1,0,0,0,0|3,0,0]=4 312 B16R2.6257 NC(=O)C(F)Sc1ccc2c(c1)OCC2 62a_100009813875_100009818566 [0,1,0,0,0,0|3,0,0]=4 313 B16R2.6257 NC(=O)C(F)Sc1ccc2c(c1)OCC2 62a_100009818566_100009813875 [0,1,0,0,0,0|3,0,0]=4 314 B16R2.6257 O=C([O-])C(F)Nc1ccc2c(c1)CCO2 34a_100000736984_100020610796 [0,1,0,0,0,0|3,0,0]=4 315 B16R2.6257 O=C([O-])C(F)Nc1ccc2c(c1)OCO2 34a_100000209953_100020610796 [0,1,0,0,0,0|2,0,0]=3 316 B16R2.6257 O=C([O-])C(F)Oc1ccc2c(c1)OCO2 34a_100000210298_100020610796 [0,1,0,0,0,0|2,0,0]=3 317 B16R2.6257 O=C([O-])C(F)Sc1ccc2c(c1)CCO2 62a_100000729065_100020610796 [0,1,0,0,0,0|3,0,0]=4 318 B16R2.6257 O=C([O-])C(F)Sc1ccc2c(c1)CCO2 62a_100020610796_100000729065 [0,1,0,0,0,0|3,0,0]=4 319 B16R2.6257 O=C([O-])C(F)Sc1ccc2c(c1)OCC2 62a_100009818566_100020610796 [0,1,0,0,0,0|3,0,0]=4 320 B16R2.6257 O=C([O-])C(F)Sc1ccc2c(c1)OCC2 62a_100020610796_100009818566 [0,1,0,0,0,0|3,0,0]=4 321 B16R2.6479 CC(C#N)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000703298 [0,1,0,0,0,0|2,0,1]=4 322 B16R2.6479 CCC(C)Sc1ccc2c(c1C)OCO2 62a_100010335860_100000758301 [0,1,0,0,0,0|2,0,1]=4 323 B16R2.6479 CCC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000758301 [0,1,0,0,0,0|2,0,1]=4 324 B16R2.6479 COC(C)Sc1ccc2c(c1C)OCO2 62a_100010335860_100009879195 [0,1,0,0,0,0|3,0,0]=4 325 B16R2.6479 COC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100009879195 [0,1,0,0,0,0|3,0,0]=4 326 B16R2.6479 C[C@H](CO)Sc1ccc2c(c1F)OCO2 62a_100010223184_100016084084 [0,1,0,0,0,0|1,0,2]=4 327 B16R2.6479 Cc1c(ccc2c1OCO2)SC(C)C#N 62a_100010335860_100000703298 [0,1,0,0,0,0|2,0,1]=4 328 B16R2.6479 Cc1c(ccc2c1OCO2)S[C@H](C)CO 62a_100010335860_100016084084 [0,1,0,0,0,0|1,0,2]=4 329 B16R2.11850 CCN(CC)Cc1ccc2c(c1)OCO2 269956a_100000042499_100000189651 [0,1,0,0,0,0|2,0,1]=4 330 B16R2.11850 CCN(CC)Cc1ccc2c(c1)OCO2 269982a_100000724800_100000189651 [0,1,0,0,0,0|2,0,1]=4 331 B16R2.11850 O=CC(C=O)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000736813 [0,1,0,0,0,0|2,0,1]=4 332 B16R2.11850 O=CC(C=O)Nc1ccc2c(c1)CCO2 34a_100000736984_100000736813 [0,1,0,0,0,0|2,0,1]=4 333 B16R2.11850 O=CC(C=O)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000736813 [0,1,0,0,0,0|1,0,1]=3 334 B16R2.11850 O=CC(C=O)Nc1ccc2c(c1)OCO2 34a_100000209953_100000736813 [0,1,0,0,0,0|1,0,1]=3 335 B16R2.11850 O=CC(C=O)Oc1ccc2c(c1)OCO2 34a_100000210298_100000736813 [0,1,0,0,0,0|1,0,1]=3 336 B16R2.11850 O=CC(C=O)Sc1ccc2c(c1)CCO2 62a_100000729065_100000736813 [0,1,0,0,0,0|2,0,1]=4 337 B16R2.11850 O=CC(C=O)Sc1ccc2c(c1)CCO2 62a_100000736813_100000729065 [0,1,0,0,0,0|2,0,1]=4 338 B16R2.11850 O=CC(C=O)Sc1ccc2c(c1)OCC2 62a_100000736813_100009818566 [0,1,0,0,0,0|2,0,1]=4 339 B16R2.11850 O=CC(C=O)Sc1ccc2c(c1)OCC2 62a_100009818566_100000736813 [0,1,0,0,0,0|2,0,1]=4 340 B16R2.21744 C#CC(C)(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000038118 [0,1,0,0,0,0|2,0,1]=4 341 B16R2.21744 C#CC(C)(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000038118 [0,1,0,0,0,0|2,0,1]=4 342 B16R2.21744 CC(C)(C#N)Nc1ccc2c(c1)OCO2 34a_100000209953_100011162410 [0,1,0,0,0,0|2,0,1]=4 343 B16R2.21744 CC(C)(C#N)Oc1ccc2c(c1)OCO2 34a_100000210298_100011162410 [0,1,0,0,0,0|2,0,1]=4 344 B16R2.34310 C#CC(C)Nc1cc2c(cc1C)OCO2 34a_100000066439_200000035995 [0,1,0,0,0,0|2,0,1]=4 345 B16R2.34310 C#CC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_200000035995 [0,1,0,0,0,0|2,0,1]=4 346 B16R2.34310 C#CC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_200000035995 [0,1,0,0,0,0|2,0,1]=4 347 B16R2.34310 C#CC(C)Oc1cc2c(cc1C)OCO2 34a_100000145572_200000035995 [0,1,0,0,0,0|2,0,1]=4 348 B16R2.34310 C=CC(=O)Cc1cc2c(cc1Br)OCO2 1458a_100000185746_100009995336 [0,1,0,0,0,0|2,0,1]=4 349 B16R2.34310 C=CC(=O)Cc1cc2c(cc1Cl)OCO2 1458a_100000185746_100000043460 [0,1,0,0,0,0|2,0,1]=4 350 B16R2.34310 CC(C#N)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000703298 [0,1,0,0,0,0|2,0,1]=4 351 B16R2.34310 CC(C#N)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000703298 [0,1,0,0,0,0|2,0,1]=4 352 B16R2.34310 CC(CO)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100012180447 [0,1,0,0,0,0|1,0,2]=4 353 B16R2.34310 CC(CO)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100012180447 [0,1,0,0,0,0|1,0,2]=4 354 B16R2.34310 CC(CO)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100012180447 [0,1,0,0,0,0|1,0,2]=4 355 B16R2.34310 CCC(C)Nc1cc2c(cc1C)OCO2 2230a_100000066439_100000758301 [0,1,0,0,0,0|2,0,1]=4 356 B16R2.34310 CCC(C)Nc1cc2c(cc1C)OCO2 34a_100000066439_100011215416 [0,1,0,0,0,0|2,0,1]=4 357 B16R2.34310 CCC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100011215416 [0,1,0,0,0,0|2,0,1]=4 358 B16R2.34310 CCC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100011215416 [0,1,0,0,0,0|2,0,1]=4 359 B16R2.34310 CCC(C)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000758301 [0,1,0,0,0,0|2,0,1]=4 360 B16R2.34310 CCC(C)Oc1cc2c(cc1C)OCO2 34a_100000145572_100011215416 [0,1,0,0,0,0|2,0,1]=4 361 B16R2.34310 CCC(C)Oc1cc2c(cc1C)OCO2 7a_100000145572_100000758301 [0,1,0,0,0,0|2,0,1]=4 362 B16R2.34310 CCC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000758301 [0,1,0,0,0,0|2,0,1]=4 363 B16R2.34310 CCN(C)Cc1cc2c(cc1Br)OCO2 2230a_100000225621_100009995336 [0,1,0,0,0,0|2,0,1]=4 364 B16R2.34310 CCN(C)Cc1cc2c(cc1Br)OCO2 269982a_100000225621_100009995336 [0,1,0,0,0,0|2,0,1]=4 365 B16R2.34310 CCN(C)Cc1cc2c(cc1Br)OCO2 26a_100000225621_100010290809 [0,1,0,0,0,0|2,0,1]=4 366 B16R2.34310 CCN(C)Cc1cc2c(cc1C)OCO2 269982a_100000225621_200000112958 [0,1,0,0,0,0|2,0,1]=4 367 B16R2.34310 CCN(C)Cc1cc2c(cc1Cl)OCO2 269982a_100000225621_100000043460 [0,1,0,0,0,0|2,0,1]=4 368 B16R2.34310 COC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100009879195 [0,1,0,0,0,0|3,0,0]=4 369 B16R2.34310 C[C@H](CO)Sc1cc2c(cc1N)OCO2 62a_100012557033_100016084084 [0,1,0,0,0,0|1,0,2]=4 370 B16R2.34310 Cc1cc2c(cc1NC(C)C#N)OCO2 2230a_100000066439_100000184139 [0,1,0,0,0,0|2,0,1]=4 371 B16R2.34310 Cc1cc2c(cc1NC(C)CO)OCO2 2230a_100000066439_100012180447 [0,1,0,0,0,0|1,0,2]=4 372 B16R2.34310 Cc1cc2c(cc1NC(C)CO)OCO2 34a_100000066439_100012180447 [0,1,0,0,0,0|1,0,2]=4 373 B16R2.34310 Cc1cc2c(cc1OC(C)C#N)OCO2 7a_100000145572_100000703298 [0,1,0,0,0,0|2,0,1]=4 374 B16R2.34310 Cc1cc2c(cc1OC(C)CO)OCO2 34a_100000145572_100012180447 [0,1,0,0,0,0|1,0,2]=4 375 B16R2.34310 Cc1cc2c(cc1OC(C)CO)OCO2 7a_100000145572_100012180447 [0,1,0,0,0,0|1,0,2]=4 376 B16R2.34363 C=CC(C)Sc1ccc2c(c1)C(=O)CO2 62a_100011215867_100000752586 [0,1,0,0,0,0|3,0,0]=4 377 B16R2.176353 C=CC(C)Sc1ccc2c(c1)OCC2=O 62a_100011215867_100000686717 [0,1,0,0,0,0|3,0,0]=4 378 B16R2.176353 C=CC(C)Sc1ccc2c(c1)OCC2N 62a_100011215867_100020628175 [0,1,0,0,0,0|3,0,0]=4 379 B14R1.24 C=CC(C)Sc1ccc(cc1)CCO 62a_100011215867_100000766406 [0,0,1,0,0,0|3,0,0]=4 380 B14R1.24 C=CC(C)Sc1ccc(cc1)OCC 62a_100011215867_100000171712 [0,0,1,0,0,0|3,0,0]=4 381 B14R1.24 CCOc1ccc(cc1)CC(C)NC 270004a_106832991635_200011996056 [0,0,1,0,0,0|3,0,0]=4 382 B14R1.470 C=CC(C)Sc1cccc(c1)CCO 62a_100011215867_100011217444 [0,0,1,0,0,0|3,0,0]=4 383 B14R1.470 C=CC(C)Sc1cccc(c1)OCC 62a_100011215867_100000170002 [0,0,1,0,0,0|3,0,0]=4 384 B14R1.470 CCOc1cccc(c1)CC(C)NC 270004a_106832991635_200000077187 [0,0,1,0,0,0|3,0,0]=4 385 B14R1.3276 C#CC(C)Nc1ccc(c(c1)O)OC 34a_100000211920_200000035995 [0,0,1,0,0,0|2,0,1]=4 386 B14R1.3276 C#CC(C)Sc1ccc(c(c1)O)OC 62a_200000035995_100009816560 [0,0,1,0,0,0|2,0,1]=4 387 B14R1.3276 C=CC(C)Sc1cc(c(cn1)OC)O 62a_100011215867_100010264082 [0,0,1,0,0,0|3,0,0]=4 388 B14R1.3276 C=CC(C)Sc1ccc(c(c1)Br)OC 62a_100011215867_100011249507 [0,0,1,0,0,0|3,0,0]=4 389 B14R1.3276 C=CC(C)Sc1ccc(c(c1)C)OC 62a_100011215867_100011219705 [0,0,1,0,0,0|3,0,0]=4 390 B14R1.3276 C=CC(C)Sc1ccc(c(c1)Cl)OC 62a_100011215867_100012355395 [0,0,1,0,0,0|3,0,0]=4 391 B14R1.3276 C=CC(C)Sc1ccc(c(c1)F)OC 62a_100011215867_100000171752 [0,0,1,0,0,0|3,0,0]=4 392 B14R1.3276 C=CC(C)Sc1ccc(c(c1)N)OC 62a_100011215867_100011249504 [0,0,1,0,0,0|3,0,0]=4 393 B14R1.3276 C=CC(C)Sc1ccc(c(c1)O)OC 62a_100011215867_100009816560 [0,0,1,0,0,0|2,0,0]=3 394 B14R1.3276 C=CC(C)Sc1cnc(c(c1)O)OC 62a_100011215867_100010135713 [0,0,1,0,0,0|3,0,0]=4 395 B14R1.3276 CCC(C)Nc1ccc(c(c1)O)OC 34a_100000211920_100011215416 [0,0,1,0,0,0|2,0,1]=4 396 B14R1.3276 CCC(C)Sc1ccc(c(c1)O)OC 62a_100000758301_100009816560 [0,0,1,0,0,0|2,0,1]=4 397 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 2230a_100000188468_100000210202 [0,0,1,0,0,0|2,0,1]=4 398 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 269982a_100000188468_100000204670 [0,0,1,0,0,0|2,0,1]=4 399 B14R1.3276 CNC(C)Cc1ccc(c(c1)Br)OC 270004a_106832991635_100011493462 [0,0,1,0,0,0|3,0,0]=4 400 B14R1.3276 CNC(C)Cc1ccc(c(c1)Cl)OC 270004a_106832991635_200000078656 [0,0,1,0,0,0|3,0,0]=4 401 B14R1.3276 COc1ccc(cc1O)CN(C)CF 269982a_100000188468_100015361967 [0,0,1,0,0,0|2,0,1]=4 402 B14R1.3276 COc1ccc(cc1O)NC(C)CO 34a_100000211920_100012180447 [0,0,1,0,0,0|1,0,2]=4 403 B14R1.3276 COc1ccc(cc1O)SC(C)C#N 62a_100000703298_100009816560 [0,0,1,0,0,0|2,0,1]=4 404 B14R1.3276 COc1ccc(cc1O)SC(C)CO 62a_100012180447_100009816560 [0,0,1,0,0,0|1,0,2]=4 405 B14R1.3276 COc1ccc(cc1O)SC(C)OC 62a_100009879195_100009816560 [0,0,1,0,0,0|3,0,0]=4 406 B14R1.3276 COc1ccc(cc1O)S[C@H](C)CO 62a_100016084084_100009816560 [0,0,1,0,0,0|1,0,2]=4 407 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_200000035995 [0,0,1,0,0,0|2,0,1]=4 408 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)O 62a_200000035995_100000694246 [0,0,1,0,0,0|2,0,1]=4 409 B14R1.3405 C=CC(C)Sc1ccc(c(c1)CC)O 62a_100011215867_100012338938 [0,0,1,0,0,0|3,0,0]=4 410 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)Br 62a_100011215867_100012353699 [0,0,1,0,0,0|3,0,0]=4 411 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)C 62a_100011215867_100011830276 [0,0,1,0,0,0|3,0,0]=4 412 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)Cl 62a_100011215867_100011356853 [0,0,1,0,0,0|3,0,0]=4 413 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)F 62a_100011215867_100011934186 [0,0,1,0,0,0|3,0,0]=4 414 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)N 62a_100011215867_100015196925 [0,0,1,0,0,0|3,0,0]=4 415 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)O 62a_100011215867_100000694246 [0,0,1,0,0,0|2,0,0]=3 416 B14R1.3405 C=CC(C)Sc1ccc(c(n1)OC)O 62a_100011215867_100010893133 [0,0,1,0,0,0|3,0,0]=4 417 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100011215416 [0,0,1,0,0,0|2,0,1]=4 418 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)O 62a_100000758301_100000694246 [0,0,1,0,0,0|2,0,1]=4 419 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)C 270004a_106832991635_200000081148 [0,0,1,0,0,0|3,0,0]=4 420 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)F 270004a_106832991635_200000078651 [0,0,1,0,0,0|3,0,0]=4 421 B14R1.3405 COc1cc(ccc1O)NC(C)CO 34a_100000726020_100012180447 [0,0,1,0,0,0|1,0,2]=4 422 B14R1.3405 COc1cc(ccc1O)SC(C)C#N 62a_100000703298_100000694246 [0,0,1,0,0,0|2,0,1]=4 423 B14R1.3405 COc1cc(ccc1O)SC(C)CO 62a_100012180447_100000694246 [0,0,1,0,0,0|1,0,2]=4 424 B14R1.3405 COc1cc(ccc1O)SC(C)OC 62a_100009879195_100000694246 [0,0,1,0,0,0|3,0,0]=4 425 B14R1.3405 COc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100000694246 [0,0,1,0,0,0|1,0,2]=4 426 B16R3.5012 c1cc2c(cc1CN3CCC3)OCO2 269982a_100000754969_100000189651 [0,0,0,1,0,0|2,0,1]=4 427 B16R3.5012 c1cc2c(cc1NC3CCC3)OCO2 34a_100000209953_100000749161 [0,0,0,1,0,0|2,0,1]=4 428 B16R3.5012 c1cc2c(cc1NC3COC3)OCO2 34a_100000209953_100009818527 [0,0,0,1,0,0|1,0,2]=4 429 B16R3.5012 c1cc2c(cc1OC3CCC3)OCO2 34a_100000210298_100000749161 [0,0,0,1,0,0|2,0,1]=4 430 B16R3.5012 c1cc2c(cc1OC3COC3)OCO2 34a_100000210298_100009818527 [0,0,0,1,0,0|1,0,2]=4 431 B14R2.966 CC(N[13CH3])c1ccc2c(c1)CCO2 2230a_100159266031_200025704644 [0,0,0,0,1,0|3,0,0]=4 432 B14R2.966 CC(N[13CH3])c1ccc2c(c1)CCO2 34a_100159266031_200025704644 [0,0,0,0,1,0|3,0,0]=4 433 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 34a_100000741967_200025704644 [0,0,0,0,1,0|2,0,0]=3 434 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 7a_100000741967_200025704644 [0,0,0,0,1,0|2,0,0]=3 435 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 2230a_200000219546_200000210301 [0,0,0,0,1,0|2,0,1]=4 436 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 269982a_200000219546_200000210301 [0,0,0,0,1,0|2,0,1]=4 437 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 34a_200000219546_200000210301 [0,0,0,0,1,0|2,0,1]=4 438 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 2230a_200000219546_200025704644 [0,0,0,0,1,0|2,0,1]=4 439 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 269982a_200000219546_200025704644 [0,0,0,0,1,0|2,0,1]=4 440 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 34a_200000219546_200025704644 [0,0,0,0,1,0|2,0,1]=4 441 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 2230a_100159266031_200000210301 [0,0,0,0,1,0|3,0,0]=4 442 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 269862a_106832991636_100000241315 [0,0,0,0,1,0|3,0,0]=4 443 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 34a_100159266031_200000210301 [0,0,0,0,1,0|3,0,0]=4 444 B14R2.966 CNC(C)c1ccc2c(c1)OCC2 269862a_106832991636_100000143635 [0,0,0,0,1,0|3,0,0]=4 445 B14R2.966 CNC(C)c1ccc2c(c1)OCO2 269862a_106832991636_100000211065 [0,0,0,0,1,0|2,0,0]=3 446 B14R2.966 CN[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_200000210301 [0,0,0,0,1,0|2,0,0]=3 447 B14R2.966 COC(C)c1ccc2c(c1)OCO2 34a_100000741967_200000210301 [0,0,0,0,1,0|2,0,0]=3 448 B14R2.966 COC(C)c1ccc2c(c1)OCO2 7a_100000741967_200000210301 [0,0,0,0,1,0|2,0,0]=3 449 B14R2.966 C[C@@H](N[13CH3])c1ccc2c(c1)OCO2 2230a_100000744171_200025704644 [0,0,0,0,1,0|2,0,0]=3 450 B14R2.10892 C=CC(C)Sc1ccc2c(c1)CC2 62a_100011215867_100009818592 [0,0,0,0,1,0|3,0,0]=4 451 B16R2.1357 C#CC(C)NCc1ccc2c(c1)CCO2 270004a_100000707721_100011218456 [0,0,0,0,0,1|2,0,1]=4 452 B16R2.1357 C#CC(C)NCc1ccc2c(c1)CCO2 34a_100011219410_200000035995 [0,0,0,0,0,1|2,0,1]=4 453 B16R2.1357 C#CC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_200000035995 [0,0,0,0,0,1|1,0,1]=3 454 B16R2.1357 C#CC(C)NCc1ccc2c(c1)OCO2 34a_100000707721_100000189651 [0,0,0,0,0,1|1,0,1]=3 455 B16R2.1357 C#CC(C)OCc1ccc2c(c1)CCO2 34a_100011219353_200000035995 [0,0,0,0,0,1|2,0,1]=4 456 B16R2.1357 C#CC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_200000035995 [0,0,0,0,0,1|1,0,1]=3 457 B16R2.1357 C#C[C@@H](C)OCc1ccc2c(c1)OCO2 34a_100009815206_100000189651 [0,0,0,0,0,1|1,0,1]=3 458 B16R2.1357 C#C[C@@H](C)OCc1ccc2c(c1)OCO2 7a_100009815206_100000189651 [0,0,0,0,0,1|1,0,1]=3 459 B16R2.1357 C=CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100000185746 [0,0,0,0,0,1|2,0,1]=4 460 B16R2.1357 C=CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_200121576911 [0,0,0,0,0,1|2,0,1]=4 461 B16R2.1357 C=CC(C)OCc1ccc2c(c1)OCO2 34a_100000695699_100000189651 [0,0,0,0,0,1|1,0,0]=2 462 B16R2.1357 C=CC(C)OCc1ccc2ncoc2c1 34a_100000695699_106359897996 [0,0,0,0,0,1|2,0,1]=4 463 B16R2.1357 C=CC(C)OCc1ccc2ocnc2c1 34a_100000695699_200010203175 [0,0,0,0,0,1|2,0,1]=4 464 B16R2.1357 C=CC(C)SCc1ccc2ncoc2c1 62a_100011215867_106359897996 [0,0,0,0,0,1|2,0,1]=4 465 B16R2.1357 C=CC(C)SCc1ccc2ocnc2c1 62a_100011215867_200010203175 [0,0,0,0,0,1|2,0,1]=4 466 B16R2.1357 C=CC(O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000730141 [0,0,0,0,0,1|3,0,0]=4 467 B16R2.1357 C=CC(O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000730141 [0,0,0,0,0,1|3,0,0]=4 468 B16R2.1357 C=CC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000730141 [0,0,0,0,0,1|2,0,0]=3 469 B16R2.1357 C=CC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000730141 [0,0,0,0,0,1|2,0,0]=3 470 B16R2.1357 C=CC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100000730141 [0,0,0,0,0,1|2,0,0]=3 471 B16R2.1357 C=CC(O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000730141 [0,0,0,0,0,1|3,0,0]=4 472 B16R2.1357 C=CC(O)CSc1ccc2c(c1)CCO2 62a_100000730141_100000729065 [0,0,0,0,0,1|3,0,0]=4 473 B16R2.1357 C=CC(O)CSc1ccc2c(c1)OCC2 62a_100000730141_100009818566 [0,0,0,0,0,1|3,0,0]=4 474 B16R2.1357 C=CC(O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000730141 [0,0,0,0,0,1|3,0,0]=4 475 B16R2.1357 CC(C#N)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000184139 [0,0,0,0,0,1|2,0,1]=4 476 B16R2.1357 CC(C#N)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000184139 [0,0,0,0,0,1|1,0,1]=3 477 B16R2.1357 CC(C#N)OCc1ccc2c(c1)CCO2 7a_100011219353_100000703298 [0,0,0,0,0,1|2,0,1]=4 478 B16R2.1357 CC(C#N)OCc1ccc2c(c1)OCO2 34a_100011218135_100000189651 [0,0,0,0,0,1|1,0,1]=3 479 B16R2.1357 CC(CCc1ccc2c(c1)OCO2)O[13CH3] 34a_100000744918_200025704644 [0,0,0,0,0,1|2,0,0]=3 480 B16R2.1357 CC(CCc1ccc2c(c1)OCO2)O[13CH3] 7a_100000744918_200025704644 [0,0,0,0,0,1|2,0,0]=3 481 B16R2.1357 CC(CF)OCc1ccc2c(c1)OCO2 34a_100016041109_100000189651 [0,0,0,0,0,1|1,0,1]=3 482 B16R2.1357 CC(CF)OCc1ccc2c(c1)OCO2 7a_100016041109_100000189651 [0,0,0,0,0,1|1,0,1]=3 483 B16R2.1357 CC(CN)OCc1ccc2c(c1)OCO2 34a_100000210904_100000189651 [0,0,0,0,0,1|1,0,1]=3 484 B16R2.1357 CC(CO)NCc1ccc2c(c1)CCO2 2230a_100011219410_100012180447 [0,0,0,0,0,1|1,0,2]=4 485 B16R2.1357 CC(CO)NCc1ccc2c(c1)CCO2 34a_100011219410_100012180447 [0,0,0,0,0,1|1,0,2]=4 486 B16R2.1357 CC(CO)NCc1ccc2c(c1)OCO2 2230a_100000210006_100012180447 [0,0,0,0,0,1|0,0,2]=3 487 B16R2.1357 CC(CO)NCc1ccc2c(c1)OCO2 34a_100000210006_100012180447 [0,0,0,0,0,1|0,0,2]=3 488 B16R2.1357 CC(CO)OCc1ccc2c(c1)CCO2 34a_100011219353_100012180447 [0,0,0,0,0,1|1,0,2]=4 489 B16R2.1357 CC(CO)OCc1ccc2c(c1)CCO2 7a_100011219353_100012180447 [0,0,0,0,0,1|1,0,2]=4 490 B16R2.1357 CC(CO)OCc1ccc2c(c1)OCO2 34a_100000210967_100012180447 [0,0,0,0,0,1|0,0,2]=3 491 B16R2.1357 CCC(C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000748023 [0,0,0,0,0,1|2,0,1]=4 492 B16R2.1357 CCC(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100000748023 [0,0,0,0,0,1|2,0,1]=4 493 B16R2.1357 CCC(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748023 [0,0,0,0,0,1|1,0,1]=3 494 B16R2.1357 CCC(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748023 [0,0,0,0,0,1|1,0,1]=3 495 B16R2.1357 CCC(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748023 [0,0,0,0,0,1|1,0,1]=3 496 B16R2.1357 CCC(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100000748023 [0,0,0,0,0,1|2,0,1]=4 497 B16R2.1357 CCC(C)CSc1ccc2c(c1)CCO2 62a_100000748023_100000729065 [0,0,0,0,0,1|2,0,1]=4 498 B16R2.1357 CCC(C)CSc1ccc2c(c1)OCC2 62a_100000748023_100009818566 [0,0,0,0,0,1|2,0,1]=4 499 B16R2.1357 CCC(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100000748023 [0,0,0,0,0,1|2,0,1]=4 500 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 207a_100000209981_100011218456 [0,0,0,0,0,1|2,0,1]=4 501 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000758301 [0,0,0,0,0,1|2,0,1]=4 502 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 270004a_100000209981_100011218456 [0,0,0,0,0,1|2,0,1]=4 503 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 34a_100011219410_100011215416 [0,0,0,0,0,1|2,0,1]=4 504 B16R2.1357 CCC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000758301 [0,0,0,0,0,1|1,0,1]=3 505 B16R2.1357 CCC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100011215416 [0,0,0,0,0,1|1,0,1]=3 506 B16R2.1357 CCC(C)OCc1ccc2c(c1)CCO2 34a_100011219353_100011215416 [0,0,0,0,0,1|2,0,1]=4 507 B16R2.1357 CCC(C)OCc1ccc2c(c1)CCO2 7a_100011219353_100000758301 [0,0,0,0,0,1|2,0,1]=4 508 B16R2.1357 CCC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100011215416 [0,0,0,0,0,1|1,0,1]=3 509 B16R2.1357 CCC(C)OCc1ccc2c(c1)OCO2 7a_100000210228_100000189651 [0,0,0,0,0,1|1,0,1]=3 510 B16R2.1357 CCC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011218378 [0,0,0,0,0,1|2,0,1]=4 511 B16R2.1357 CCC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011218378 [0,0,0,0,0,1|2,0,1]=4 512 B16R2.1357 CCC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011218378 [0,0,0,0,0,1|2,0,1]=4 513 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100009816398 [0,0,0,0,0,1|2,0,1]=4 514 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)CCO2 34a_100000736984_100009816398 [0,0,0,0,0,1|2,0,1]=4 515 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009816398 [0,0,0,0,0,1|1,0,1]=3 516 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)OCO2 34a_100000209953_100009816398 [0,0,0,0,0,1|1,0,1]=3 517 B16R2.1357 CC[C@H](C)COc1ccc2c(c1)OCO2 34a_100000210298_100009816398 [0,0,0,0,0,1|1,0,1]=3 518 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)CCO2 62a_100000729065_100009816398 [0,0,0,0,0,1|2,0,1]=4 519 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)CCO2 62a_100009816398_100000729065 [0,0,0,0,0,1|2,0,1]=4 520 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)OCC2 62a_100009816398_100009818566 [0,0,0,0,0,1|2,0,1]=4 521 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)OCC2 62a_100009818566_100009816398 [0,0,0,0,0,1|2,0,1]=4 522 B16R2.1357 CNC(C)CCc1ccc2c(c1)OCO2 270004a_106832991635_100000182259 [0,0,0,0,0,1|2,0,0]=3 523 B16R2.1357 COC(C)CCc1ccc2c(c1)OCO2 34a_100000744918_200000210301 [0,0,0,0,0,1|2,0,0]=3 524 B16R2.1357 COC(C)CCc1ccc2c(c1)OCO2 7a_100000744918_200000210301 [0,0,0,0,0,1|2,0,0]=3 525 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000059175 [0,0,0,0,0,1|1,0,2]=4 526 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)CCO2 34a_100000736984_100000059175 [0,0,0,0,0,1|1,0,2]=4 527 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000059175 [0,0,0,0,0,1|0,0,2]=3 528 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)OCO2 34a_100000209953_100000059175 [0,0,0,0,0,1|0,0,2]=3 529 B16R2.1357 C[C@@H](CO)COc1ccc2c(c1)OCO2 34a_100000210298_100000059175 [0,0,0,0,0,1|0,0,2]=3 530 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)CCO2 62a_100000059175_100000729065 [0,0,0,0,0,1|1,0,2]=4 531 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)CCO2 62a_100000729065_100000059175 [0,0,0,0,0,1|1,0,2]=4 532 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)OCC2 62a_100000059175_100009818566 [0,0,0,0,0,1|1,0,2]=4 533 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)OCC2 62a_100009818566_100000059175 [0,0,0,0,0,1|1,0,2]=4 534 B16R2.1357 C[C@H](CF)NCc1ccc2c(c1)CCO2 207a_100102880703_100011218456 [0,0,0,0,0,1|2,0,1]=4 535 B16R2.1357 C[C@H](CF)NCc1ccc2c(c1)CCO2 270004a_100102880703_100011218456 [0,0,0,0,0,1|2,0,1]=4 536 B16R2.1357 C[C@H](CO)NCc1ccc2c(c1)CCO2 207a_100000737577_100011218456 [0,0,0,0,0,1|1,0,2]=4 537 B16R2.1357 C[C@H](CO)NCc1ccc2c(c1)CCO2 270004a_100000737577_100011218456 [0,0,0,0,0,1|1,0,2]=4 538 B16R2.1357 OCC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011219619 [0,0,0,0,0,1|1,0,2]=4 539 B16R2.1357 OCC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011219619 [0,0,0,0,0,1|1,0,2]=4 540 B16R2.1357 OCC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011219619 [0,0,0,0,0,1|1,0,2]=4 541 B16R2.1357 OC[C@H](O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009815848 [0,0,0,0,0,1|1,0,2]=4 542 B16R2.1357 OC[C@H](O)CNc1ccc2c(c1)OCO2 34a_100000209953_100009815848 [0,0,0,0,0,1|1,0,2]=4 543 B16R2.1357 OC[C@H](O)COc1ccc2c(c1)OCO2 34a_100000210298_100009815848 [0,0,0,0,0,1|1,0,2]=4 544 B16R2.1357 O[C@@H](CF)CNc1ccc2c(c1)OCO2 2230a_100000209953_100015614560 [0,0,0,0,0,1|2,0,1]=4 545 B16R2.1357 O[C@@H](CF)CNc1ccc2c(c1)OCO2 34a_100000209953_100015614560 [0,0,0,0,0,1|2,0,1]=4 546 B16R2.1357 O[C@@H](CF)COc1ccc2c(c1)OCO2 34a_100000210298_100015614560 [0,0,0,0,0,1|2,0,1]=4 547 B16R2.5347 C#CC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_200000035995 [0,0,0,0,0,1|2,0,1]=4 548 B16R2.5347 C#CC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_200000035995 [0,0,0,0,0,1|2,0,1]=4 549 B16R2.5347 C#CC(C)Sc1ccc2c(c1)OCCO2 62a_200000035995_100011216881 [0,0,0,0,0,1|2,0,1]=4 550 B16R2.5347 C=CC(C)Sc1ccc2c(c1)CCCO2 62a_100011215867_100011393166 [0,0,0,0,0,1|3,0,0]=4 551 B16R2.5347 C=CC(C)Sc1ccc2c(c1)COCC2 62a_100011215867_100010128096 [0,0,0,0,0,1|3,0,0]=4 552 B16R2.5347 C=CC(C)Sc1ccc2c(c1)NCCO2 62a_100011215867_100000708519 [0,0,0,0,0,1|3,0,0]=4 553 B16R2.5347 C=CC(C)Sc1ccc2c(c1)OCCC2 62a_100011215867_100010700467 [0,0,0,0,0,1|3,0,0]=4 554 B16R2.5347 C=CC(C)Sc1ccc2c(c1)OCCN2 62a_100011215867_100012355470 [0,0,0,0,0,1|3,0,0]=4 555 B16R2.5347 C=CC(C)Sc1ccc2c(c1)OCCO2 62a_100011215867_100011216881 [0,0,0,0,0,1|2,0,0]=3 556 B16R2.5347 CC(C#N)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000184139 [0,0,0,0,0,1|2,0,1]=4 557 B16R2.5347 CC(C#N)Sc1ccc2c(c1)OCCO2 62a_100000703298_100011216881 [0,0,0,0,0,1|2,0,1]=4 558 B16R2.5347 CC(C#N)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000703298 [0,0,0,0,0,1|2,0,1]=4 559 B16R2.5347 CC(CO)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100012180447 [0,0,0,0,0,1|1,0,2]=4 560 B16R2.5347 CC(CO)Nc1ccc2c(c1)OCCO2 34a_100020630400_100012180447 [0,0,0,0,0,1|1,0,2]=4 561 B16R2.5347 CC(CO)Oc1ccc2c(c1)OCCO2 34a_100000234341_100012180447 [0,0,0,0,0,1|1,0,2]=4 562 B16R2.5347 CC(CO)Sc1ccc2c(c1)OCCO2 62a_100012180447_100011216881 [0,0,0,0,0,1|1,0,2]=4 563 B16R2.5347 CCC(C)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000758301 [0,0,0,0,0,1|2,0,1]=4 564 B16R2.5347 CCC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_100011215416 [0,0,0,0,0,1|2,0,1]=4 565 B16R2.5347 CCC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_100011215416 [0,0,0,0,0,1|2,0,1]=4 566 B16R2.5347 CCC(C)Sc1ccc2c(c1)OCCO2 62a_100000758301_100011216881 [0,0,0,0,0,1|2,0,1]=4 567 B16R2.5347 CCC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000758301 [0,0,0,0,0,1|2,0,1]=4 568 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684720_100000210202 [0,0,0,0,0,1|2,0,1]=4 569 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684725_200000210301 [0,0,0,0,0,1|2,0,1]=4 570 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684720_100000204670 [0,0,0,0,0,1|2,0,1]=4 571 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684725_200000210301 [0,0,0,0,0,1|2,0,1]=4 572 B16R2.5347 CCN([13CH3])Cc1ccc2c(c1)OCCO2 2230a_100000684725_200025704644 [0,0,0,0,0,1|2,0,1]=4 573 B16R2.5347 CCN([13CH3])Cc1ccc2c(c1)OCCO2 269982a_100000684725_200025704644 [0,0,0,0,0,1|2,0,1]=4 574 B16R2.5347 CN(CF)Cc1ccc2c(c1)OCCO2 269982a_100000684720_100015361967 [0,0,0,0,0,1|2,0,1]=4 575 B16R2.5347 CNC(C)Cc1ccc2c(c1)OCCO2 270004a_106832991635_200000075428 [0,0,0,0,0,1|2,0,0]=3 576 B16R2.5347 COC(C)Sc1ccc2c(c1)OCCO2 62a_100009879195_100011216881 [0,0,0,0,0,1|3,0,0]=4 577 B16R2.5347 COC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100009879195 [0,0,0,0,0,1|3,0,0]=4 578 B16R2.5347 C[C@H](CO)Sc1ccc2c(c1)OCCO2 62a_100011216881_100016084084 [0,0,0,0,0,1|1,0,2]=4 579 B16R2.5347 C[C@H](CO)Sc1ccc2c(c1)OCCO2 62a_100016084084_100011216881 [0,0,0,0,0,1|1,0,2]=4 580 B13R1.5 C=CC(C)Sc1ccc(cc1)CO 62a_100011215867_100000690907 [1,0,1,0,0,0|2,0,0]=4 581 B13R1.5 C=CC(C)Sc1ccc(cc1)OC 62a_100011215867_100000171711 [1,0,1,0,0,0|2,0,0]=4 582 B13R1.5 CNC(C)Cc1ccc(cc1)OC 270004a_106832991635_100000211147 [1,0,1,0,0,0|2,0,0]=4 583 B13R1.77 CCOc1ccc(cc1)NCC=O 2230a_100000739623_200015260668 [1,0,1,0,0,0|2,0,0]=4 584 B13R1.77 CCOc1ccc(cc1)NCC=O 34a_100000739623_200009817547 [1,0,1,0,0,0|2,0,0]=4 585 B13R1.77 CCOc1ccc(cc1)OCC=O 34a_100000185467_200009817547 [1,0,1,0,0,0|2,0,0]=4 586 B13R1.77 CCOc1ccc(cc1)SCC=O 62a_200015260668_100000171712 [1,0,1,0,0,0|2,0,0]=4 587 B13R1.77 CCSc1ccc(cc1)CCC=O 62a_100000210202_100011361538 [1,0,1,0,0,0|1,1,0]=4 588 B13R1.77 CCSc1ccc(cc1)CCC=O 62a_100011361538_100000210202 [1,0,1,0,0,0|1,1,0]=4 589 B13R1.77 O=CCCc1ccc(cc1)SCF 62a_100011361538_100015361967 [1,0,1,0,0,0|1,1,0]=4 590 B13R1.77 O=CCCc1ccc(cc1)SCF 62a_100015361967_100011361538 [1,0,1,0,0,0|1,1,0]=4 591 B13R1.77 O=CCNc1ccc(cc1)CCO 2230a_100011204434_200015260668 [1,0,1,0,0,0|2,0,0]=4 592 B13R1.77 O=CCNc1ccc(cc1)CCO 34a_100011204434_200009817547 [1,0,1,0,0,0|2,0,0]=4 593 B13R1.77 O=CCOc1ccc(cc1)CCO 34a_100011215338_200009817547 [1,0,1,0,0,0|2,0,0]=4 594 B13R1.77 O=CCOc1ccc(cc1)CCO 7a_100011215338_200015260668 [1,0,1,0,0,0|2,0,0]=4 595 B13R1.77 O=CCSc1ccc(cc1)CCO 62a_100000766406_200015260668 [1,0,1,0,0,0|2,0,0]=4 596 B13R1.77 O=CCSc1ccc(cc1)CCO 62a_200015260668_100000766406 [1,0,1,0,0,0|2,0,0]=4 597 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 34a_100011218180_100015361967 [1,0,1,0,0,0|1,0,1]=4 598 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 7a_100011218180_100015361967 [1,0,1,0,0,0|1,0,1]=4 599 B13R1.142 CC(N)Cc1ccc(cc1)OCF 34a_100102634573_100015361967 [1,0,1,0,0,0|2,0,0]=4 600 B13R1.142 CCOc1ccc(cc1)CC(=O)C 1458a_100000183096_200000210301 [1,0,1,0,0,0|1,0,1]=4 601 B13R1.142 CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210202 [1,0,1,0,0,0|1,0,1]=4 602 B13R1.142 CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210202 [1,0,1,0,0,0|1,0,1]=4 603 B13R1.142 CCOc1ccc(cc1)CC(=O)[13CH3] 1458a_100000183096_200025704644 [1,0,1,0,0,0|1,0,1]=4 604 B13R1.142 CCOc1ccc(cc1)CC(C)N 34a_100102634573_100000210202 [1,0,1,0,0,0|2,0,0]=4 605 B13R1.81 C=CC(C)Sc1cccc(c1)CO 62a_100011215867_100000687537 [1,0,1,0,0,0|2,0,0]=4 606 B13R1.81 C=CC(C)Sc1cccc(c1)OC 62a_100011215867_100000170001 [1,0,1,0,0,0|2,0,0]=4 607 B13R1.81 CNC(C)Cc1cccc(c1)OC 270004a_106832991635_100011218204 [1,0,1,0,0,0|2,0,0]=4 608 B13R1.373 CCOc1cccc(c1)CC(=O)C 1458a_100000690747_200000210301 [1,0,1,0,0,0|1,0,1]=4 609 B13R1.373 CCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690747_200025704644 [1,0,1,0,0,0|1,0,1]=4 610 B13R1.567 CCOc1cccc(c1)NCC=O 2230a_100000742568_200015260668 [1,0,1,0,0,0|2,0,0]=4 611 B13R1.567 CCOc1cccc(c1)NCC=O 34a_100000742568_200009817547 [1,0,1,0,0,0|2,0,0]=4 612 B13R1.567 CCOc1cccc(c1)OCC=O 34a_100011215941_200009817547 [1,0,1,0,0,0|2,0,0]=4 613 B13R1.567 CCOc1cccc(c1)OCC=O 7a_100011215941_200015260668 [1,0,1,0,0,0|2,0,0]=4 614 B13R1.567 CCOc1cccc(c1)SCC=O 62a_200015260668_100000170002 [1,0,1,0,0,0|2,0,0]=4 615 B13R1.567 O=CCNc1cccc(c1)CCO 2230a_100011996697_200015260668 [1,0,1,0,0,0|2,0,0]=4 616 B13R1.567 O=CCNc1cccc(c1)CCO 34a_100011996697_200009817547 [1,0,1,0,0,0|2,0,0]=4 617 B13R1.567 O=CCOc1cccc(c1)CCO 34a_100011215281_200009817547 [1,0,1,0,0,0|2,0,0]=4 618 B13R1.567 O=CCOc1cccc(c1)CCO 7a_100011215281_200015260668 [1,0,1,0,0,0|2,0,0]=4 619 B13R1.567 O=CCSc1cccc(c1)CCO 62a_100011217444_200015260668 [1,0,1,0,0,0|2,0,0]=4 620 B13R1.567 O=CCSc1cccc(c1)CCO 62a_200015260668_100011217444 [1,0,1,0,0,0|2,0,0]=4 621 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010141077_200025704644 [1,0,1,0,0,0|1,0,1]=4 622 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010141077_200025704644 [1,0,1,0,0,0|1,0,1]=4 623 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_200000080089_200025704644 [1,0,1,0,0,0|1,0,1]=4 624 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_200000080089_200025704644 [1,0,1,0,0,0|1,0,1]=4 625 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_200000080078_200025704644 [1,0,1,0,0,0|1,0,1]=4 626 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_200000080078_200025704644 [1,0,1,0,0,0|1,0,1]=4 627 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100000070787_200011397701 [1,0,1,0,0,0|1,0,1]=4 628 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100011202338_200000210301 [1,0,1,0,0,0|1,0,1]=4 629 B13R1.35 COc1ccc(cc1Br)CC(=O)C 34a_100010141077_200000210301 [1,0,1,0,0,0|1,0,1]=4 630 B13R1.35 COc1ccc(cc1Br)CC(=O)C 7a_100010141077_200000210301 [1,0,1,0,0,0|1,0,1]=4 631 B13R1.35 COc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100011202338_200025704644 [1,0,1,0,0,0|1,0,1]=4 632 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100000070787_200011290836 [1,0,1,0,0,0|1,0,1]=4 633 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100011356478_200000210301 [1,0,1,0,0,0|1,0,1]=4 634 B13R1.35 COc1ccc(cc1C)CC(=O)C 34a_200000080089_200000210301 [1,0,1,0,0,0|1,0,1]=4 635 B13R1.35 COc1ccc(cc1C)CC(=O)C 7a_200000080089_200000210301 [1,0,1,0,0,0|1,0,1]=4 636 B13R1.35 COc1ccc(cc1C)CC(=O)[13CH3] 1458a_100011356478_200025704644 [1,0,1,0,0,0|1,0,1]=4 637 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100000070787_100000693707 [1,0,1,0,0,0|1,0,1]=4 638 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100012026953_200000210301 [1,0,1,0,0,0|1,0,1]=4 639 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_200000210301 [1,0,1,0,0,0|1,0,1]=4 640 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_200000210301 [1,0,1,0,0,0|1,0,1]=4 641 B13R1.35 COc1ccc(cc1Cl)CC(=O)[13CH3] 1458a_100012026953_200025704644 [1,0,1,0,0,0|1,0,1]=4 642 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000070787_100000189595 [1,0,1,0,0,0|1,0,1]=4 643 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000204603_200000210301 [1,0,1,0,0,0|1,0,1]=4 644 B13R1.35 COc1ccc(cc1F)CC(=O)[13CH3] 1458a_100000204603_200025704644 [1,0,1,0,0,0|1,0,1]=4 645 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [1,0,1,0,0,0|0,0,1]=3 646 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [1,0,1,0,0,0|0,0,1]=3 647 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [1,0,1,0,0,0|0,0,1]=3 648 B13R1.35 COc1ccc(cc1O)CN(C)C 2230a_100000188468_200000210301 [1,0,1,0,0,0|1,0,1]=4 649 B13R1.35 COc1ccc(cc1O)CN(C)C 269982a_100000188468_200000210301 [1,0,1,0,0,0|1,0,1]=4 650 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 2230a_100000188468_200025704644 [1,0,1,0,0,0|1,0,1]=4 651 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 269982a_100000188468_200025704644 [1,0,1,0,0,0|1,0,1]=4 652 B13R1.35 COc1ccc(cc1O)NC(=O)C 22a_100000211920_100000070787 [1,0,1,0,0,0|1,0,1]=4 653 B13R1.35 COc1ccc(cc1O)NC(=O)C 527a_100000211920_100103153847 [1,0,1,0,0,0|1,0,1]=4 654 B13R1.35 COc1ccc(cc1O)NC(C)C 34a_100000211920_100000210206 [1,0,1,0,0,0|1,0,1]=4 655 B13R1.35 COc1ccc(cc1O)SC(C)C 62a_100000210206_100009816560 [1,0,1,0,0,0|1,0,1]=4 656 B13R1.577 C=CCNc1ccc(c(c1)O)OC 34a_100000211920_100015514636 [1,0,1,0,0,0|2,0,0]=4 657 B13R1.577 C=CCSc1ccc(c(c1)O)OC 62a_100000210623_100009816560 [1,0,1,0,0,0|2,0,0]=4 658 B13R1.577 CCCCc1ccc(c(c1)O)OC 271570a_100020621405_100009816560 [1,0,1,0,0,0|1,0,1]=4 659 B13R1.577 CNCCc1ccc(c(c1)O)OC 2230a_100011207234_200000210301 [1,0,1,0,0,0|2,0,0]=4 660 B13R1.577 CNCCc1ccc(c(c1)O)OC 34a_100011207234_200000210301 [1,0,1,0,0,0|2,0,0]=4 661 B13R1.577 COc1ccc(cc1Br)NCC=O 34a_100000187427_200009817547 [1,0,1,0,0,0|2,0,0]=4 662 B13R1.577 COc1ccc(cc1Br)OCC=O 34a_100010234764_200009817547 [1,0,1,0,0,0|2,0,0]=4 663 B13R1.577 COc1ccc(cc1Br)OCC=O 7a_100010234764_200015260668 [1,0,1,0,0,0|2,0,0]=4 664 B13R1.577 COc1ccc(cc1Br)SCC=O 62a_100011249507_200015260668 [1,0,1,0,0,0|2,0,0]=4 665 B13R1.577 COc1ccc(cc1Br)SCC=O 62a_200015260668_100011249507 [1,0,1,0,0,0|2,0,0]=4 666 B13R1.577 COc1ccc(cc1C)NCC=O 2230a_100000743268_200015260668 [1,0,1,0,0,0|2,0,0]=4 667 B13R1.577 COc1ccc(cc1C)NCC=O 34a_100000743268_200009817547 [1,0,1,0,0,0|2,0,0]=4 668 B13R1.577 COc1ccc(cc1C)NCC=O 7a_100000743268_200015260668 [1,0,1,0,0,0|2,0,0]=4 669 B13R1.577 COc1ccc(cc1C)OCC=O 34a_100000759738_200009817547 [1,0,1,0,0,0|2,0,0]=4 670 B13R1.577 COc1ccc(cc1C)OCC=O 7a_100000759738_200015260668 [1,0,1,0,0,0|2,0,0]=4 671 B13R1.577 COc1ccc(cc1C)SCC=O 62a_100011219705_200015260668 [1,0,1,0,0,0|2,0,0]=4 672 B13R1.577 COc1ccc(cc1C)SCC=O 62a_200015260668_100011219705 [1,0,1,0,0,0|2,0,0]=4 673 B13R1.577 COc1ccc(cc1Cl)NCC=O 2230a_100000211044_200015260668 [1,0,1,0,0,0|2,0,0]=4 674 B13R1.577 COc1ccc(cc1Cl)NCC=O 34a_100000211044_200009817547 [1,0,1,0,0,0|2,0,0]=4 675 B13R1.577 COc1ccc(cc1Cl)OCC=O 34a_200009861682_200009817547 [1,0,1,0,0,0|2,0,0]=4 676 B13R1.577 COc1ccc(cc1Cl)OCC=O 7a_200009861682_200015260668 [1,0,1,0,0,0|2,0,0]=4 677 B13R1.577 COc1ccc(cc1Cl)SCC=O 62a_100012355395_200015260668 [1,0,1,0,0,0|2,0,0]=4 678 B13R1.577 COc1ccc(cc1Cl)SCC=O 62a_200015260668_100012355395 [1,0,1,0,0,0|2,0,0]=4 679 B13R1.577 COc1ccc(cc1F)NCC=O 2230a_100000740183_200015260668 [1,0,1,0,0,0|2,0,0]=4 680 B13R1.577 COc1ccc(cc1F)NCC=O 34a_100000740183_200009817547 [1,0,1,0,0,0|2,0,0]=4 681 B13R1.577 COc1ccc(cc1F)OCC=O 34a_100000746305_200009817547 [1,0,1,0,0,0|2,0,0]=4 682 B13R1.577 COc1ccc(cc1F)OCC=O 7a_100000746305_200015260668 [1,0,1,0,0,0|2,0,0]=4 683 B13R1.577 COc1ccc(cc1F)SCC=O 62a_100000171752_200015260668 [1,0,1,0,0,0|2,0,0]=4 684 B13R1.577 COc1ccc(cc1F)SCC=O 62a_200015260668_100000171752 [1,0,1,0,0,0|2,0,0]=4 685 B13R1.577 COc1ccc(cc1I)NCC=O 34a_100011356947_200009817547 [1,0,1,0,0,0|2,0,0]=4 686 B13R1.577 COc1ccc(cc1I)OCC=O 34a_100010084122_200009817547 [1,0,1,0,0,0|2,0,0]=4 687 B13R1.577 COc1ccc(cc1I)OCC=O 7a_100010084122_200015260668 [1,0,1,0,0,0|2,0,0]=4 688 B13R1.577 COc1ccc(cc1N)SCC=O 62a_100011249504_200015260668 [1,0,1,0,0,0|2,0,0]=4 689 B13R1.577 COc1ccc(cc1N)SCC=O 62a_200015260668_100011249504 [1,0,1,0,0,0|2,0,0]=4 690 B13R1.577 COc1ccc(cc1O)CCN[13CH3] 2230a_100011207234_200025704644 [1,0,1,0,0,0|2,0,0]=4 691 B13R1.577 COc1ccc(cc1O)CCN[13CH3] 34a_100011207234_200025704644 [1,0,1,0,0,0|2,0,0]=4 692 B13R1.577 COc1ccc(cc1O)NCC=O 34a_100000211920_200009817547 [1,0,1,0,0,0|1,0,0]=3 693 B13R1.577 COc1ccc(cc1O)SCC=O 62a_200015260668_100009816560 [1,0,1,0,0,0|1,0,0]=3 694 B13R1.577 COc1cnc(cc1O)SCC=O 62a_200015260668_100010264082 [1,0,1,0,0,0|2,0,0]=4 695 B13R1.577 COc1ncc(cc1O)SCC=O 62a_200015260668_100010135713 [1,0,1,0,0,0|2,0,0]=4 696 B13R1.2879 C=CC(C)Sc1ccc(c(c1)C)O 62a_100011215867_100000186361 [1,0,1,0,0,0|2,0,0]=4 697 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)C 62a_100011215867_100000685420 [1,0,1,0,0,0|2,0,0]=4 698 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)O 62a_100011215867_100009813601 [1,0,1,0,0,0|2,0,0]=4 699 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [1,0,1,0,0,0|0,1,1]=4 700 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [1,0,1,0,0,0|0,1,1]=4 701 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [1,0,1,0,0,0|1,0,1]=4 702 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [1,0,1,0,0,0|1,0,1]=4 703 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [1,0,1,0,0,0|1,0,1]=4 704 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [1,0,1,0,0,0|1,0,1]=4 705 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [1,0,1,0,0,0|1,0,1]=4 706 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [1,0,1,0,0,0|1,0,1]=4 707 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [1,0,1,0,0,0|1,0,1]=4 708 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [1,0,1,0,0,0|0,0,1]=3 709 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [1,0,1,0,0,0|0,0,1]=3 710 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [1,0,1,0,0,0|1,0,1]=4 711 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [1,0,1,0,0,0|1,0,1]=4 712 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [1,0,1,0,0,0|1,0,1]=4 713 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [1,0,1,0,0,0|1,0,1]=4 714 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [1,0,1,0,0,0|0,1,1]=4 715 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [1,0,1,0,0,0|0,1,1]=4 716 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [1,0,1,0,0,0|2,0,0]=4 717 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [1,0,1,0,0,0|2,0,0]=4 718 B13R1.575 CCCCc1ccc(c(c1)OC)O 271570a_100020621405_100000694246 [1,0,1,0,0,0|1,0,1]=4 719 B13R1.575 CCc1cc(ccc1O)SCC=O 62a_200015260668_100012338938 [1,0,1,0,0,0|2,0,0]=4 720 B13R1.575 CNCCc1ccc(c(c1)OC)O 2230a_106832991635_100010741665 [1,0,1,0,0,0|2,0,0]=4 721 B13R1.575 CNCCc1ccc(c(c1)OC)O 34a_100000756042_200000210301 [1,0,1,0,0,0|2,0,0]=4 722 B13R1.575 CNCCc1ccc(c(c1)OC)O 7a_106832991635_100010741665 [1,0,1,0,0,0|2,0,0]=4 723 B13R1.575 COc1cc(ccc1Br)NCC=O 2230a_100000765947_200015260668 [1,0,1,0,0,0|2,0,0]=4 724 B13R1.575 COc1cc(ccc1Br)NCC=O 34a_100000765947_200009817547 [1,0,1,0,0,0|2,0,0]=4 725 B13R1.575 COc1cc(ccc1Br)OCC=O 34a_100011827694_200009817547 [1,0,1,0,0,0|2,0,0]=4 726 B13R1.575 COc1cc(ccc1Br)OCC=O 7a_100011827694_200015260668 [1,0,1,0,0,0|2,0,0]=4 727 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_100012353699_200015260668 [1,0,1,0,0,0|2,0,0]=4 728 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_200015260668_100012353699 [1,0,1,0,0,0|2,0,0]=4 729 B13R1.575 COc1cc(ccc1C)NCC=O 2230a_100011279678_200015260668 [1,0,1,0,0,0|2,0,0]=4 730 B13R1.575 COc1cc(ccc1C)NCC=O 34a_100011279678_200009817547 [1,0,1,0,0,0|2,0,0]=4 731 B13R1.575 COc1cc(ccc1C)OCC=O 34a_100009865632_200009817547 [1,0,1,0,0,0|2,0,0]=4 732 B13R1.575 COc1cc(ccc1C)OCC=O 7a_100009865632_200015260668 [1,0,1,0,0,0|2,0,0]=4 733 B13R1.575 COc1cc(ccc1C)SCC=O 62a_100011830276_200015260668 [1,0,1,0,0,0|2,0,0]=4 734 B13R1.575 COc1cc(ccc1C)SCC=O 62a_200015260668_100011830276 [1,0,1,0,0,0|2,0,0]=4 735 B13R1.575 COc1cc(ccc1Cl)NCC=O 2230a_100000742311_200015260668 [1,0,1,0,0,0|2,0,0]=4 736 B13R1.575 COc1cc(ccc1Cl)NCC=O 34a_100000742311_200009817547 [1,0,1,0,0,0|2,0,0]=4 737 B13R1.575 COc1cc(ccc1Cl)OCC=O 34a_100012186310_200009817547 [1,0,1,0,0,0|2,0,0]=4 738 B13R1.575 COc1cc(ccc1Cl)OCC=O 7a_100012186310_200015260668 [1,0,1,0,0,0|2,0,0]=4 739 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_100011356853_200015260668 [1,0,1,0,0,0|2,0,0]=4 740 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_200015260668_100011356853 [1,0,1,0,0,0|2,0,0]=4 741 B13R1.575 COc1cc(ccc1F)NCC=O 2230a_100000701188_200015260668 [1,0,1,0,0,0|2,0,0]=4 742 B13R1.575 COc1cc(ccc1F)NCC=O 34a_100000701188_200009817547 [1,0,1,0,0,0|2,0,0]=4 743 B13R1.575 COc1cc(ccc1F)OCC=O 34a_100012001760_200009817547 [1,0,1,0,0,0|2,0,0]=4 744 B13R1.575 COc1cc(ccc1F)OCC=O 7a_100012001760_200015260668 [1,0,1,0,0,0|2,0,0]=4 745 B13R1.575 COc1cc(ccc1F)SCC=O 62a_100011934186_200015260668 [1,0,1,0,0,0|2,0,0]=4 746 B13R1.575 COc1cc(ccc1F)SCC=O 62a_200015260668_100011934186 [1,0,1,0,0,0|2,0,0]=4 747 B13R1.575 COc1cc(ccc1I)NCC=O 34a_100000746945_200009817547 [1,0,1,0,0,0|2,0,0]=4 748 B13R1.575 COc1cc(ccc1N)OCC=O 34a_100015326901_200009817547 [1,0,1,0,0,0|2,0,0]=4 749 B13R1.575 COc1cc(ccc1N)OCC=O 7a_100015326901_200015260668 [1,0,1,0,0,0|2,0,0]=4 750 B13R1.575 COc1cc(ccc1N)SCC=O 62a_100011279103_200015260668 [1,0,1,0,0,0|2,0,0]=4 751 B13R1.575 COc1cc(ccc1N)SCC=O 62a_200015260668_100015196925 [1,0,1,0,0,0|2,0,0]=4 752 B13R1.575 COc1cc(ccc1O)CCN[13CH3] 34a_100000756042_200025704644 [1,0,1,0,0,0|2,0,0]=4 753 B13R1.575 COc1cc(ccc1O)CCSC 62a_200000210301_100010741665 [1,0,1,0,0,0|2,0,0]=4 754 B13R1.575 COc1cc(ccc1O)CCS[13CH3] 62a_200025704644_100010741665 [1,0,1,0,0,0|2,0,0]=4 755 B13R1.575 COc1cc(ccc1O)NCC=O 34a_100000726020_200009817547 [1,0,1,0,0,0|1,0,0]=3 756 B13R1.575 COc1cc(ccc1O)SCC=O 62a_200015260668_100000694246 [1,0,1,0,0,0|1,0,0]=3 757 B13R1.575 COc1nc(ccc1O)SCC=O 62a_200015260668_100010893133 [1,0,1,0,0,0|2,0,0]=4 758 B13R2.449 C=C=Cc1ccc2c(c1)OCO2 271570a_100015277604_100000688060 [2,0,0,0,0,0|0,0,2]=4 759 B13R2.449 CC=Cc1ccc2c(c1)OCO2 271570a_100016259895_100000688060 [2,0,0,0,0,0|0,0,2]=4 760 B13R2.449 CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210202 [2,0,0,0,0,0|2,0,0]=4 761 B13R2.449 CCNc1ccc2c(c1)CCO2 34a_100000736984_100000210202 [2,0,0,0,0,0|2,0,0]=4 762 B13R2.449 CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210202 [2,0,0,0,0,0|1,0,0]=3 763 B13R2.449 CCNc1ccc2c(c1)OCO2 34a_100000209953_100000210202 [2,0,0,0,0,0|1,0,0]=3 764 B13R2.449 CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210202 [2,0,0,0,0,0|1,0,0]=3 765 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000210202_100000729065 [2,0,0,0,0,0|2,0,0]=4 766 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000729065_100000210202 [2,0,0,0,0,0|2,0,0]=4 767 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100000210202_100009818566 [2,0,0,0,0,0|2,0,0]=4 768 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210202 [2,0,0,0,0,0|2,0,0]=4 769 B13R2.449 CNCc1ccc2c(c1)CCO2 207a_100102657272_100011218456 [2,0,0,0,0,0|2,0,0]=4 770 B13R2.449 CNCc1ccc2c(c1)CCO2 2230a_100011219410_200000210301 [2,0,0,0,0,0|2,0,0]=4 771 B13R2.449 CNCc1ccc2c(c1)CCO2 270004a_106832991635_100011218456 [2,0,0,0,0,0|2,0,0]=4 772 B13R2.449 CNCc1ccc2c(c1)CCO2 34a_100011219410_200000210301 [2,0,0,0,0,0|2,0,0]=4 773 B13R2.449 CNCc1ccc2c(c1)OCO2 2230a_100000210006_200000210301 [2,0,0,0,0,0|1,0,0]=3 774 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100000210006_200000210301 [2,0,0,0,0,0|1,0,0]=3 775 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100102657272_100000189651 [2,0,0,0,0,0|1,0,0]=3 776 B13R2.449 CNCc1ccc2c(c1)OCO2 7a_106832991635_100000189651 [2,0,0,0,0,0|1,0,0]=3 777 B13R2.449 COCc1ccc2c(c1)CCO2 34a_100011219353_200000210301 [2,0,0,0,0,0|2,0,0]=4 778 B13R2.449 COCc1ccc2c(c1)CCO2 7a_100011219353_200000210301 [2,0,0,0,0,0|2,0,0]=4 779 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100000210967_200000210301 [2,0,0,0,0,0|1,0,0]=3 780 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100138415774_100000189651 [2,0,0,0,0,0|1,0,0]=3 781 B13R2.449 FCNc1ccc2c(c1)OCO2 34a_100000209953_100015361967 [2,0,0,0,0,0|2,0,0]=4 782 B13R2.449 FCOc1ccc2c(c1)OCO2 34a_100000210298_100015361967 [2,0,0,0,0,0|2,0,0]=4 783 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 2230a_100011219410_200025704644 [2,0,0,0,0,0|2,0,0]=4 784 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 34a_100011219410_200025704644 [2,0,0,0,0,0|2,0,0]=4 785 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 2230a_100000210006_200025704644 [2,0,0,0,0,0|1,0,0]=3 786 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 34a_100000210006_200025704644 [2,0,0,0,0,0|1,0,0]=3 787 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 34a_100011219353_200025704644 [2,0,0,0,0,0|2,0,0]=4 788 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 7a_100011219353_200025704644 [2,0,0,0,0,0|2,0,0]=4 789 B13R2.449 [13CH3]OCc1ccc2c(c1)OCO2 34a_100000210967_200025704644 [2,0,0,0,0,0|1,0,0]=3 790 B15R1.16 CC(=O)C(C)Nc1ccc(cc1)CCO 2230a_100011204434_100009814033 [0,1,1,0,0,0|2,0,0]=4 791 B15R1.16 CC(=O)C(C)Oc1ccc(cc1)CCO 7a_100011215338_100000179758 [0,1,1,0,0,0|2,0,0]=4 792 B15R1.16 CC(=O)C(C)Sc1ccc(cc1)CCO 62a_100000766406_100009814033 [0,1,1,0,0,0|2,0,0]=4 793 B15R1.16 CC(=O)C(C)Sc1ccc(cc1)CCO 62a_100009814033_100000766406 [0,1,1,0,0,0|2,0,0]=4 794 B15R1.16 CC(Nc1ccc(cc1)CCO)C(=O)N 2230a_100011204434_100000702099 [0,1,1,0,0,0|2,0,0]=4 795 B15R1.16 CC(Nc1ccc(cc1)CCO)C(=O)N 34a_100011204434_100000702099 [0,1,1,0,0,0|2,0,0]=4 796 B15R1.16 CC(Oc1ccc(cc1)CCO)C(=O)N 34a_100011215338_100000702099 [0,1,1,0,0,0|2,0,0]=4 797 B15R1.16 CC(Oc1ccc(cc1)CCO)C(=O)N 7a_100011215338_100000702099 [0,1,1,0,0,0|2,0,0]=4 798 B15R1.16 CC(Oc1ccc(cc1)OCF)C(=O)[O-] 34a_203549785325_100015361967 [0,1,1,0,0,0|2,0,0]=4 799 B15R1.16 CC(Sc1ccc(cc1)CCO)C(=O)N 62a_100000702099_100000766406 [0,1,1,0,0,0|2,0,0]=4 800 B15R1.16 CC(Sc1ccc(cc1)CCO)C(=O)N 62a_100000766406_100000702099 [0,1,1,0,0,0|2,0,0]=4 801 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 11a_100000180828_100015343762 [0,1,1,0,0,0|2,0,0]=4 802 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 1626a_100000180828_100015343762 [0,1,1,0,0,0|2,0,0]=4 803 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 240690a_100000180828_100015343762 [0,1,1,0,0,0|2,0,0]=4 804 B15R1.16 CCOc1ccc(cc1)CN(C)C(=O)C 527a_100000180828_100103153847 [0,1,1,0,0,0|2,0,0]=4 805 B15R1.16 CCOc1ccc(cc1)C[C@H](N)C(=O)N 34a_100011423149_100000210202 [0,1,1,0,0,0|2,0,0]=4 806 B15R1.16 CCOc1ccc(cc1)NC(C)C(=O)C 2230a_100000739623_100009814033 [0,1,1,0,0,0|2,0,0]=4 807 B15R1.16 CCOc1ccc(cc1)NC(C)C(=O)N 2230a_100000739623_100000702099 [0,1,1,0,0,0|2,0,0]=4 808 B15R1.16 CCOc1ccc(cc1)NC(C)C(=O)N 34a_100000739623_100000702099 [0,1,1,0,0,0|2,0,0]=4 809 B15R1.16 CCOc1ccc(cc1)OC(C)C(=O)C 1458a_100000246031_200000210301 [0,1,1,0,0,0|2,0,0]=4 810 B15R1.16 CCOc1ccc(cc1)OC(C)C(=O)N 34a_100000185467_100000702099 [0,1,1,0,0,0|2,0,0]=4 811 B15R1.16 CCOc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_100000246031_200025704644 [0,1,1,0,0,0|2,0,0]=4 812 B15R1.16 CCOc1ccc(cc1)OC(C)C(=O)[O-] 34a_203549785325_100000210202 [0,1,1,0,0,0|2,0,0]=4 813 B15R1.16 CCOc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000171712 [0,1,1,0,0,0|2,0,0]=4 814 B15R1.16 CCOc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000171712 [0,1,1,0,0,0|2,0,0]=4 815 B15R1.16 NC(=O)[C@@H](N)Cc1ccc(cc1)OCF 34a_100011423149_100015361967 [0,1,1,0,0,0|2,0,0]=4 816 B15R1.104 C=CC(C)Sc1ccc(cc1)OCCO 62a_100011215867_100000686261 [0,1,1,0,0,0|2,0,0]=4 817 B15R1.104 C=CC(C)Sc1ccc(cc1)OCOC 62a_100011215867_100012265687 [0,1,1,0,0,0|2,0,0]=4 818 B15R1.5643 CCOc1ccc(cc1)CN(C)CC=O 2230a_100000180828_200015260668 [0,1,1,0,0,0|2,0,0]=4 819 B15R1.5643 CCOc1ccc(cc1)CN(C)CC=O 269982a_100000180828_200015260668 [0,1,1,0,0,0|2,0,0]=4 820 B15R1.567 CC(=O)C(C)Nc1cccc(c1)CCO 2230a_100011996697_100009814033 [0,1,1,0,0,0|2,0,0]=4 821 B15R1.567 CC(=O)C(C)Oc1cccc(c1)CCO 7a_100011215281_100000179758 [0,1,1,0,0,0|2,0,0]=4 822 B15R1.567 CC(=O)C(C)Sc1cccc(c1)CCO 62a_100009814033_100011217444 [0,1,1,0,0,0|2,0,0]=4 823 B15R1.567 CC(=O)C(C)Sc1cccc(c1)CCO 62a_100011217444_100009814033 [0,1,1,0,0,0|2,0,0]=4 824 B15R1.567 CC(Nc1cccc(c1)CCO)C(=O)N 2230a_100011996697_100000702099 [0,1,1,0,0,0|2,0,0]=4 825 B15R1.567 CC(Nc1cccc(c1)CCO)C(=O)N 34a_100011996697_100000702099 [0,1,1,0,0,0|2,0,0]=4 826 B15R1.567 CC(Oc1cccc(c1)CCO)C(=O)N 34a_100011215281_100000702099 [0,1,1,0,0,0|2,0,0]=4 827 B15R1.567 CC(Oc1cccc(c1)CCO)C(=O)N 7a_100011215281_100000702099 [0,1,1,0,0,0|2,0,0]=4 828 B15R1.567 CC(Sc1cccc(c1)CCO)C(=O)N 62a_100000702099_100011217444 [0,1,1,0,0,0|2,0,0]=4 829 B15R1.567 CC(Sc1cccc(c1)CCO)C(=O)N 62a_100011217444_100000702099 [0,1,1,0,0,0|2,0,0]=4 830 B15R1.567 CCOc1cccc(c1)NC(C)C(=O)C 2230a_100000742568_100009814033 [0,1,1,0,0,0|2,0,0]=4 831 B15R1.567 CCOc1cccc(c1)NC(C)C(=O)N 2230a_100000742568_100000702099 [0,1,1,0,0,0|2,0,0]=4 832 B15R1.567 CCOc1cccc(c1)NC(C)C(=O)N 34a_100000742568_100000702099 [0,1,1,0,0,0|2,0,0]=4 833 B15R1.567 CCOc1cccc(c1)OC(C)C(=O)C 7a_100011215941_100000179758 [0,1,1,0,0,0|2,0,0]=4 834 B15R1.567 CCOc1cccc(c1)OC(C)C(=O)N 34a_100011215941_100000702099 [0,1,1,0,0,0|2,0,0]=4 835 B15R1.567 CCOc1cccc(c1)OC(C)C(=O)N 7a_100011215941_100000702099 [0,1,1,0,0,0|2,0,0]=4 836 B15R1.567 CCOc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100000170002 [0,1,1,0,0,0|2,0,0]=4 837 B15R1.567 CCOc1cccc(c1)SC(C)C(=O)N 62a_100000702099_100000170002 [0,1,1,0,0,0|2,0,0]=4 838 B15R1.1038 C=CC(C)Sc1cccc(c1)OCCO 62a_100011215867_100000757546 [0,1,1,0,0,0|2,0,0]=4 839 B15R1.1038 C=CC(C)Sc1cccc(c1)OCOC 62a_100011215867_100012265688 [0,1,1,0,0,0|2,0,0]=4 840 B15R1.1279 C=CCN(C)Cc1ccc(c(c1)O)OC 2230a_100000188468_100000210623 [0,1,1,0,0,0|2,0,0]=4 841 B15R1.1279 C=CCN(C)Cc1ccc(c(c1)O)OC 269982a_100000188468_100000210623 [0,1,1,0,0,0|2,0,0]=4 842 B15R1.1279 COc1ccc(cc1C)CN(C)CC=O 2230a_100000241087_200015260668 [0,1,1,0,0,0|2,0,0]=4 843 B15R1.1279 COc1ccc(cc1C)CN(C)CC=O 269982a_100000241087_200015260668 [0,1,1,0,0,0|2,0,0]=4 844 B15R1.1279 COc1ccc(cc1C)CN(C)CC=O 34a_100000241087_200009817547 [0,1,1,0,0,0|2,0,0]=4 845 B15R1.1279 COc1ccc(cc1O)CN(C)CC=O 2230a_100000188468_200015260668 [0,1,1,0,0,0|1,0,0]=3 846 B15R1.1279 COc1ccc(cc1O)CN(C)CC=O 269982a_100000188468_200015260668 [0,1,1,0,0,0|1,0,0]=3 847 B15R1.3769 C=CC(C)Sc1ccc(c(c1)CO)OC 62a_100011215867_100000204679 [0,1,1,0,0,0|2,0,0]=4 848 B15R1.3769 C=CC(C)Sc1ccc(c(c1)OC)OC 62a_100011215867_100011356967 [0,1,1,0,0,0|2,0,0]=4 849 B15R1.3769 CNC(C)Cc1ccc(c(c1)OC)OC 270004a_106832991635_100000211454 [0,1,1,0,0,0|2,0,0]=4 850 B15R1.3769 COc1ccc(cc1OC)CC(C)OC 34a_100011303635_200000210301 [0,1,1,0,0,0|2,0,0]=4 851 B15R1.3769 COc1ccc(cc1OC)CC(C)OC 7a_100011303635_200000210301 [0,1,1,0,0,0|2,0,0]=4 852 B15R1.3769 COc1ccc(cc1OC)CC(C)O[13CH3] 34a_100011303635_200025704644 [0,1,1,0,0,0|2,0,0]=4 853 B15R1.3769 COc1ccc(cc1OC)CC(C)O[13CH3] 7a_100011303635_200025704644 [0,1,1,0,0,0|2,0,0]=4 854 B15R1.3777 COc1ccc(cc1Br)NC(C)C(=O)N 34a_100000187427_100000702099 [0,1,1,0,0,0|2,0,0]=4 855 B15R1.3777 COc1ccc(cc1Br)OC(C)C(=O)C 7a_100010234764_100000179758 [0,1,1,0,0,0|2,0,0]=4 856 B15R1.3777 COc1ccc(cc1Br)OC(C)C(=O)N 34a_100010234764_100000702099 [0,1,1,0,0,0|2,0,0]=4 857 B15R1.3777 COc1ccc(cc1Br)OC(C)C(=O)N 7a_100010234764_100000702099 [0,1,1,0,0,0|2,0,0]=4 858 B15R1.3777 COc1ccc(cc1Br)SC(C)C(=O)C 62a_100009814033_100011249507 [0,1,1,0,0,0|2,0,0]=4 859 B15R1.3777 COc1ccc(cc1Br)SC(C)C(=O)C 62a_100011249507_100009814033 [0,1,1,0,0,0|2,0,0]=4 860 B15R1.3777 COc1ccc(cc1Br)SC(C)C(=O)N 62a_100000702099_100011249507 [0,1,1,0,0,0|2,0,0]=4 861 B15R1.3777 COc1ccc(cc1Br)SC(C)C(=O)N 62a_100011249507_100000702099 [0,1,1,0,0,0|2,0,0]=4 862 B15R1.3777 COc1ccc(cc1C)CN(C)C(=O)C 11a_100000241087_100015343762 [0,1,1,0,0,0|2,0,0]=4 863 B15R1.3777 COc1ccc(cc1C)CN(C)C(=O)C 1626a_100000241087_100015343762 [0,1,1,0,0,0|2,0,0]=4 864 B15R1.3777 COc1ccc(cc1C)CN(C)C(=O)C 240690a_100000241087_100015343762 [0,1,1,0,0,0|2,0,0]=4 865 B15R1.3777 COc1ccc(cc1C)CN(C)C(=O)C 527a_100000241087_100103153847 [0,1,1,0,0,0|2,0,0]=4 866 B15R1.3777 COc1ccc(cc1C)NC(C)C(=O)C 2230a_100000743268_100009814033 [0,1,1,0,0,0|2,0,0]=4 867 B15R1.3777 COc1ccc(cc1C)NC(C)C(=O)C 7a_100000743268_100000179758 [0,1,1,0,0,0|2,0,0]=4 868 B15R1.3777 COc1ccc(cc1C)NC(C)C(=O)N 2230a_100000743268_100000702099 [0,1,1,0,0,0|2,0,0]=4 869 B15R1.3777 COc1ccc(cc1C)NC(C)C(=O)N 34a_100000743268_100000702099 [0,1,1,0,0,0|2,0,0]=4 870 B15R1.3777 COc1ccc(cc1C)NC(C)C(=O)N 7a_100000743268_100000702099 [0,1,1,0,0,0|2,0,0]=4 871 B15R1.3777 COc1ccc(cc1C)OC(C)C(=O)C 7a_100000759738_100000179758 [0,1,1,0,0,0|2,0,0]=4 872 B15R1.3777 COc1ccc(cc1C)OC(C)C(=O)N 34a_100000759738_100000702099 [0,1,1,0,0,0|2,0,0]=4 873 B15R1.3777 COc1ccc(cc1C)OC(C)C(=O)N 7a_100000759738_100000702099 [0,1,1,0,0,0|2,0,0]=4 874 B15R1.3777 COc1ccc(cc1C)SC(C)C(=O)C 62a_100009814033_100011219705 [0,1,1,0,0,0|2,0,0]=4 875 B15R1.3777 COc1ccc(cc1C)SC(C)C(=O)C 62a_100011219705_100009814033 [0,1,1,0,0,0|2,0,0]=4 876 B15R1.3777 COc1ccc(cc1C)SC(C)C(=O)N 62a_100000702099_100011219705 [0,1,1,0,0,0|2,0,0]=4 877 B15R1.3777 COc1ccc(cc1C)SC(C)C(=O)N 62a_100011219705_100000702099 [0,1,1,0,0,0|2,0,0]=4 878 B15R1.3777 COc1ccc(cc1Cl)NC(C)C(=O)C 2230a_100000211044_100009814033 [0,1,1,0,0,0|2,0,0]=4 879 B15R1.3777 COc1ccc(cc1Cl)NC(C)C(=O)N 2230a_100000211044_100000702099 [0,1,1,0,0,0|2,0,0]=4 880 B15R1.3777 COc1ccc(cc1Cl)NC(C)C(=O)N 34a_100000211044_100000702099 [0,1,1,0,0,0|2,0,0]=4 881 B15R1.3777 COc1ccc(cc1Cl)OC(C)C(=O)C 7a_200009861682_100000179758 [0,1,1,0,0,0|2,0,0]=4 882 B15R1.3777 COc1ccc(cc1Cl)OC(C)C(=O)N 34a_200009861682_100000702099 [0,1,1,0,0,0|2,0,0]=4 883 B15R1.3777 COc1ccc(cc1Cl)OC(C)C(=O)N 7a_200009861682_100000702099 [0,1,1,0,0,0|2,0,0]=4 884 B15R1.3777 COc1ccc(cc1Cl)SC(C)C(=O)C 62a_100009814033_100012355395 [0,1,1,0,0,0|2,0,0]=4 885 B15R1.3777 COc1ccc(cc1Cl)SC(C)C(=O)C 62a_100012355395_100009814033 [0,1,1,0,0,0|2,0,0]=4 886 B15R1.3777 COc1ccc(cc1Cl)SC(C)C(=O)N 62a_100000702099_100012355395 [0,1,1,0,0,0|2,0,0]=4 887 B15R1.3777 COc1ccc(cc1Cl)SC(C)C(=O)N 62a_100012355395_100000702099 [0,1,1,0,0,0|2,0,0]=4 888 B15R1.3777 COc1ccc(cc1F)NC(C)C(=O)C 2230a_100000740183_100009814033 [0,1,1,0,0,0|2,0,0]=4 889 B15R1.3777 COc1ccc(cc1F)NC(C)C(=O)N 2230a_100000740183_100000702099 [0,1,1,0,0,0|2,0,0]=4 890 B15R1.3777 COc1ccc(cc1F)NC(C)C(=O)N 34a_100000740183_100000702099 [0,1,1,0,0,0|2,0,0]=4 891 B15R1.3777 COc1ccc(cc1F)OC(C)C(=O)C 7a_100000746305_100000179758 [0,1,1,0,0,0|2,0,0]=4 892 B15R1.3777 COc1ccc(cc1F)OC(C)C(=O)N 34a_100000746305_100000702099 [0,1,1,0,0,0|2,0,0]=4 893 B15R1.3777 COc1ccc(cc1F)OC(C)C(=O)N 7a_100000746305_100000702099 [0,1,1,0,0,0|2,0,0]=4 894 B15R1.3777 COc1ccc(cc1F)SC(C)C(=O)C 62a_100000171752_100009814033 [0,1,1,0,0,0|2,0,0]=4 895 B15R1.3777 COc1ccc(cc1F)SC(C)C(=O)C 62a_100009814033_100000171752 [0,1,1,0,0,0|2,0,0]=4 896 B15R1.3777 COc1ccc(cc1F)SC(C)C(=O)N 62a_100000171752_100000702099 [0,1,1,0,0,0|2,0,0]=4 897 B15R1.3777 COc1ccc(cc1F)SC(C)C(=O)N 62a_100000702099_100000171752 [0,1,1,0,0,0|2,0,0]=4 898 B15R1.3777 COc1ccc(cc1I)NC(C)C(=O)N 34a_100011356947_100000702099 [0,1,1,0,0,0|2,0,0]=4 899 B15R1.3777 COc1ccc(cc1I)OC(C)C(=O)C 7a_100010084122_100000179758 [0,1,1,0,0,0|2,0,0]=4 900 B15R1.3777 COc1ccc(cc1I)OC(C)C(=O)N 34a_100010084122_100000702099 [0,1,1,0,0,0|2,0,0]=4 901 B15R1.3777 COc1ccc(cc1I)OC(C)C(=O)N 7a_100010084122_100000702099 [0,1,1,0,0,0|2,0,0]=4 902 B15R1.3777 COc1ccc(cc1N)SC(C)C(=O)C 62a_100009814033_100011249504 [0,1,1,0,0,0|2,0,0]=4 903 B15R1.3777 COc1ccc(cc1N)SC(C)C(=O)C 62a_100011249504_100009814033 [0,1,1,0,0,0|2,0,0]=4 904 B15R1.3777 COc1ccc(cc1N)SC(C)C(=O)N 62a_100000702099_100011249504 [0,1,1,0,0,0|2,0,0]=4 905 B15R1.3777 COc1ccc(cc1N)SC(C)C(=O)N 62a_100011249504_100000702099 [0,1,1,0,0,0|2,0,0]=4 906 B15R1.3777 COc1ccc(cc1O)CN(C)C(=O)C 240690a_100000188468_100015343762 [0,1,1,0,0,0|1,0,0]=3 907 B15R1.3777 COc1ccc(cc1O)CN(C)C(=O)C 527a_100000188468_100103153847 [0,1,1,0,0,0|1,0,0]=3 908 B15R1.3777 COc1ccc(cc1O)NC(C)C(=O)N 34a_100000211920_100000702099 [0,1,1,0,0,0|1,0,0]=3 909 B15R1.3777 COc1ccc(cc1O)NC(F)C(=O)N 34a_100000211920_100009813875 [0,1,1,0,0,0|2,0,0]=4 910 B15R1.3777 COc1ccc(cc1O)NC(F)C(=O)[O-] 34a_100000211920_100020610796 [0,1,1,0,0,0|2,0,0]=4 911 B15R1.3777 COc1ccc(cc1O)SC(C)C(=O)C 62a_100009814033_100009816560 [0,1,1,0,0,0|1,0,0]=3 912 B15R1.3777 COc1ccc(cc1O)SC(C)C(=O)N 62a_100000702099_100009816560 [0,1,1,0,0,0|1,0,0]=3 913 B15R1.3777 COc1ccc(cc1O)SC(F)C(=O)N 62a_100009813875_100009816560 [0,1,1,0,0,0|2,0,0]=4 914 B15R1.3777 COc1ccc(cc1O)SC(F)C(=O)[O-] 62a_100020610796_100009816560 [0,1,1,0,0,0|2,0,0]=4 915 B15R1.3777 COc1cnc(cc1O)SC(C)C(=O)C 62a_100009814033_100010264082 [0,1,1,0,0,0|2,0,0]=4 916 B15R1.3777 COc1cnc(cc1O)SC(C)C(=O)N 62a_100000702099_100010264082 [0,1,1,0,0,0|2,0,0]=4 917 B15R1.3777 COc1ncc(cc1O)SC(C)C(=O)C 62a_100009814033_100010135713 [0,1,1,0,0,0|2,0,0]=4 918 B15R1.3777 COc1ncc(cc1O)SC(C)C(=O)N 62a_100000702099_100010135713 [0,1,1,0,0,0|2,0,0]=4 919 B15R1.3780 COc1ccc(cc1O)NC(C=O)C=O 34a_100000211920_100000736813 [0,1,1,0,0,0|1,0,1]=4 920 B15R1.3780 COc1ccc(cc1O)SC(C=O)C=O 62a_100000736813_100009816560 [0,1,1,0,0,0|1,0,1]=4 921 B15R1.371 C=CC(C)Sc1cc(c(c(c1)OC)O)O 62a_100011215867_200159242197 [0,1,1,0,0,0|2,0,0]=4 922 B15R1.1794 C=CC(C)Sc1cc(c(cc1F)O)OC 62a_100011215867_100010189133 [0,1,1,0,0,0|2,0,0]=4 923 B15R1.4038 CCc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100012338938 [0,1,1,0,0,0|2,0,0]=4 924 B15R1.4038 CCc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100012338938 [0,1,1,0,0,0|2,0,0]=4 925 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)C 2230a_100000765947_100009814033 [0,1,1,0,0,0|2,0,0]=4 926 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)N 2230a_100000765947_100000702099 [0,1,1,0,0,0|2,0,0]=4 927 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)N 34a_100000765947_100000702099 [0,1,1,0,0,0|2,0,0]=4 928 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)C 7a_100011827694_100000179758 [0,1,1,0,0,0|2,0,0]=4 929 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)N 34a_100011827694_100000702099 [0,1,1,0,0,0|2,0,0]=4 930 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)N 7a_100011827694_100000702099 [0,1,1,0,0,0|2,0,0]=4 931 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)C 62a_100009814033_100012353699 [0,1,1,0,0,0|2,0,0]=4 932 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)C 62a_100012353699_100009814033 [0,1,1,0,0,0|2,0,0]=4 933 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)N 62a_100000702099_100012353699 [0,1,1,0,0,0|2,0,0]=4 934 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)N 62a_100012353699_100000702099 [0,1,1,0,0,0|2,0,0]=4 935 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)C 2230a_100011279678_100009814033 [0,1,1,0,0,0|2,0,0]=4 936 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)N 2230a_100011279678_100000702099 [0,1,1,0,0,0|2,0,0]=4 937 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)N 34a_100011279678_100000702099 [0,1,1,0,0,0|2,0,0]=4 938 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)C 7a_100009865632_100000179758 [0,1,1,0,0,0|2,0,0]=4 939 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)N 34a_100009865632_100000702099 [0,1,1,0,0,0|2,0,0]=4 940 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)N 7a_100009865632_100000702099 [0,1,1,0,0,0|2,0,0]=4 941 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)C 62a_100009814033_100011830276 [0,1,1,0,0,0|2,0,0]=4 942 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)C 62a_100011830276_100009814033 [0,1,1,0,0,0|2,0,0]=4 943 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)N 62a_100000702099_100011830276 [0,1,1,0,0,0|2,0,0]=4 944 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)N 62a_100011830276_100000702099 [0,1,1,0,0,0|2,0,0]=4 945 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)C 2230a_100000742311_100009814033 [0,1,1,0,0,0|2,0,0]=4 946 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)N 2230a_100000742311_100000702099 [0,1,1,0,0,0|2,0,0]=4 947 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)N 34a_100000742311_100000702099 [0,1,1,0,0,0|2,0,0]=4 948 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)C 7a_100012186310_100000179758 [0,1,1,0,0,0|2,0,0]=4 949 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)N 34a_100012186310_100000702099 [0,1,1,0,0,0|2,0,0]=4 950 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)N 7a_100012186310_100000702099 [0,1,1,0,0,0|2,0,0]=4 951 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)C 62a_100009814033_100011356853 [0,1,1,0,0,0|2,0,0]=4 952 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)C 62a_100011356853_100009814033 [0,1,1,0,0,0|2,0,0]=4 953 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)N 62a_100000702099_100011356853 [0,1,1,0,0,0|2,0,0]=4 954 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)N 62a_100011356853_100000702099 [0,1,1,0,0,0|2,0,0]=4 955 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)C 2230a_100000701188_100009814033 [0,1,1,0,0,0|2,0,0]=4 956 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)N 2230a_100000701188_100000702099 [0,1,1,0,0,0|2,0,0]=4 957 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)N 34a_100000701188_100000702099 [0,1,1,0,0,0|2,0,0]=4 958 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)C 7a_100012001760_100000179758 [0,1,1,0,0,0|2,0,0]=4 959 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)N 34a_100012001760_100000702099 [0,1,1,0,0,0|2,0,0]=4 960 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)N 7a_100012001760_100000702099 [0,1,1,0,0,0|2,0,0]=4 961 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100011934186 [0,1,1,0,0,0|2,0,0]=4 962 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)C 62a_100011934186_100009814033 [0,1,1,0,0,0|2,0,0]=4 963 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)N 62a_100000702099_100011934186 [0,1,1,0,0,0|2,0,0]=4 964 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)N 62a_100011934186_100000702099 [0,1,1,0,0,0|2,0,0]=4 965 B15R1.4038 COc1cc(ccc1I)NC(C)C(=O)N 34a_100000746945_100000702099 [0,1,1,0,0,0|2,0,0]=4 966 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)C 7a_100015326901_100000179758 [0,1,1,0,0,0|2,0,0]=4 967 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)N 34a_100015326901_100000702099 [0,1,1,0,0,0|2,0,0]=4 968 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)N 7a_100015326901_100000702099 [0,1,1,0,0,0|2,0,0]=4 969 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)C 62a_100009814033_100015196925 [0,1,1,0,0,0|2,0,0]=4 970 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)C 62a_100011279103_100009814033 [0,1,1,0,0,0|2,0,0]=4 971 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)N 62a_100000702099_100015196925 [0,1,1,0,0,0|2,0,0]=4 972 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)N 62a_100011279103_100000702099 [0,1,1,0,0,0|2,0,0]=4 973 B15R1.4038 COc1cc(ccc1O)NC(C)C(=O)N 34a_100000726020_100000702099 [0,1,1,0,0,0|1,0,0]=3 974 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)N 34a_100000726020_100009813875 [0,1,1,0,0,0|2,0,0]=4 975 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)[O-] 34a_100000726020_100020610796 [0,1,1,0,0,0|2,0,0]=4 976 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100000694246 [0,1,1,0,0,0|1,0,0]=3 977 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000694246 [0,1,1,0,0,0|1,0,0]=3 978 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000694246 [0,1,1,0,0,0|2,0,0]=4 979 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000694246 [0,1,1,0,0,0|2,0,0]=4 980 B15R1.4038 COc1nc(ccc1O)SC(C)C(=O)C 62a_100009814033_100010893133 [0,1,1,0,0,0|2,0,0]=4 981 B15R1.4038 COc1nc(ccc1O)SC(C)C(=O)N 62a_100000702099_100010893133 [0,1,1,0,0,0|2,0,0]=4 982 B15R1.4040 COc1cc(ccc1O)NC(C=O)C=O 34a_100000726020_100000736813 [0,1,1,0,0,0|1,0,1]=4 983 B15R1.4040 COc1cc(ccc1O)SC(C=O)C=O 62a_100000736813_100000694246 [0,1,1,0,0,0|1,0,1]=4 984 B15R2.1350 C=CCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210623 [1,1,0,0,0,0|1,0,1]=4 985 B15R2.1393 O=CCSc1ccc2c(c1)C(=O)CO2 62a_200015260668_100000752586 [1,1,0,0,0,0|2,0,0]=4 986 B15R2.1503 C=CCNc1cc2c(cc1C)OCO2 2230a_100000066439_100000210623 [1,1,0,0,0,0|2,0,0]=4 987 B15R2.1503 C=CCNc1cc2c(cc1C)OCO2 34a_100000066439_100015514636 [1,1,0,0,0,0|2,0,0]=4 988 B15R2.1503 C=CCNc1cc2c(cc1Cl)OCO2 34a_100000234339_100015514636 [1,1,0,0,0,0|2,0,0]=4 989 B15R2.1503 C=CCOc1cc2c(cc1Br)OCO2 34a_100010290809_100015514636 [1,1,0,0,0,0|2,0,0]=4 990 B15R2.1503 C=CCOc1cc2c(cc1Br)OCO2 7a_100010290809_100015514636 [1,1,0,0,0,0|2,0,0]=4 991 B15R2.1503 C=CCOc1cc2c(cc1C)OCO2 34a_100000145572_100015514636 [1,1,0,0,0,0|2,0,0]=4 992 B15R2.1503 C=CCOc1cc2c(cc1C)OCO2 7a_100000145572_100015514636 [1,1,0,0,0,0|2,0,0]=4 993 B15R2.1503 C=CCSc1cc2c(cc1N)OCO2 62a_100012557033_100000210623 [1,1,0,0,0,0|2,0,0]=4 994 B15R2.1503 CCCCc1cc2c(cc1N)OCO2 271570a_100020621405_100012557033 [1,1,0,0,0,0|1,0,1]=4 995 B15R2.1503 CCCCc1cc2c(cc1O)OCO2 271570a_100020621405_100010290809 [1,1,0,0,0,0|1,0,1]=4 996 B15R2.1503 Cc1cc2c(cc1NCC=O)OCO2 2230a_100000066439_200015260668 [1,1,0,0,0,0|1,0,0]=3 997 B15R2.1503 Cc1cc2c(cc1NCC=O)OCO2 34a_100000066439_200009817547 [1,1,0,0,0,0|1,0,0]=3 998 B15R2.1503 Cc1cc2c(cc1OCC=O)OCO2 34a_100000145572_200009817547 [1,1,0,0,0,0|1,0,0]=3 999 B15R2.1503 Cc1cc2c(cc1OCC=O)OCO2 7a_100000145572_200015260668 [1,1,0,0,0,0|1,0,0]=3 1000 B15R2.1503 Nc1cc2c(cc1SCC=O)OCO2 62a_100012557033_200015260668 [1,1,0,0,0,0|1,0,0]=3 1001 B15R2.1503 O=CCNc1cc2c(cc1Cl)OCO2 34a_100000234339_200009817547 [1,1,0,0,0,0|1,0,0]=3 1002 B15R2.1503 O=CCOc1cc2c(cc1Br)OCO2 34a_100010290809_200009817547 [1,1,0,0,0,0|1,0,0]=3 1003 B15R2.1503 O=CCOc1cc2c(cc1Br)OCO2 7a_100010290809_200015260668 [1,1,0,0,0,0|1,0,0]=3 1004 B15R2.1636 C=CCSc1ccc2c(c1C)OCO2 62a_100010335860_100000210623 [1,1,0,0,0,0|2,0,0]=4 1005 B15R2.1636 C=CCSc1ccc2c(c1F)OCO2 62a_100010223184_100000210623 [1,1,0,0,0,0|2,0,0]=4 1006 B15R2.1636 CCCCc1ccc2c(c1C)OCO2 271570a_100020621405_100010335860 [1,1,0,0,0,0|1,0,1]=4 1007 B15R2.1636 CCCCc1ccc2c(c1F)OCO2 271570a_100020621405_100010223184 [1,1,0,0,0,0|1,0,1]=4 1008 B15R2.1636 Cc1c(ccc2c1OCO2)SCC=O 62a_100010335860_200015260668 [1,1,0,0,0,0|1,0,0]=3 1009 B15R2.1636 O=CCSc1ccc2c(c1F)OCO2 62a_100010223184_200015260668 [1,1,0,0,0,0|1,0,0]=3 1010 B15R2.2123 BrCCOCc1ccc2c(c1)OCO2 34a_100000211926_100000189651 [1,1,0,0,0,0|1,0,1]=4 1011 B15R2.2123 C#CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000688953 [1,1,0,0,0,0|1,0,1]=4 1012 B15R2.2123 C#CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000688953 [1,1,0,0,0,0|1,0,1]=4 1013 B15R2.2123 C#CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000688953 [1,1,0,0,0,0|1,0,1]=4 1014 B15R2.2123 C#CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000038162 [1,1,0,0,0,0|1,0,1]=4 1015 B15R2.2123 C#CCNCc1ccc2c(c1)OCO2 34a_100000210006_100000184674 [1,1,0,0,0,0|1,0,1]=4 1016 B15R2.2123 C#CCNCc1ccc2c(c1)OCO2 34a_100000212058_100000189651 [1,1,0,0,0,0|1,0,1]=4 1017 B15R2.2123 C#CCOCc1ccc2c(c1)OCO2 34a_100000210247_100000189651 [1,1,0,0,0,0|1,0,1]=4 1018 B15R2.2123 C#CCOCc1ccc2c(c1)OCO2 34a_100000210967_100000184674 [1,1,0,0,0,0|1,0,1]=4 1019 B15R2.2123 C/C=C/CNc1ccc2c(c1)OCO2 34a_100000209953_100102629194 [1,1,0,0,0,0|1,0,1]=4 1020 B15R2.2123 C/C=C/COc1ccc2c(c1)OCO2 34a_100000210298_100102629194 [1,1,0,0,0,0|1,0,1]=4 1021 B15R2.2123 C=CCCNc1ccc2c(c1)CCO2 2230a_100000736984_100000754431 [1,1,0,0,0,0|2,0,0]=4 1022 B15R2.2123 C=CCCNc1ccc2c(c1)CCO2 34a_100000736984_100000754431 [1,1,0,0,0,0|2,0,0]=4 1023 B15R2.2123 C=CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000754431 [1,1,0,0,0,0|1,0,0]=3 1024 B15R2.2123 C=CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000754431 [1,1,0,0,0,0|1,0,0]=3 1025 B15R2.2123 C=CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000754431 [1,1,0,0,0,0|1,0,0]=3 1026 B15R2.2123 C=CCCSc1ccc2c(c1)CCO2 62a_100000729065_100000754431 [1,1,0,0,0,0|2,0,0]=4 1027 B15R2.2123 C=CCCSc1ccc2c(c1)CCO2 62a_100000754431_100000729065 [1,1,0,0,0,0|2,0,0]=4 1028 B15R2.2123 C=CCCSc1ccc2c(c1)OCC2 62a_100000754431_100009818566 [1,1,0,0,0,0|2,0,0]=4 1029 B15R2.2123 C=CCCSc1ccc2c(c1)OCC2 62a_100009818566_100000754431 [1,1,0,0,0,0|2,0,0]=4 1030 B15R2.2123 C=CCNCc1ccc2c(c1)CCO2 2230a_100011219410_100000210623 [1,1,0,0,0,0|2,0,0]=4 1031 B15R2.2123 C=CCNCc1ccc2c(c1)CCO2 270004a_100020586998_100011218456 [1,1,0,0,0,0|2,0,0]=4 1032 B15R2.2123 C=CCNCc1ccc2c(c1)CCO2 34a_100011219410_100015514636 [1,1,0,0,0,0|2,0,0]=4 1033 B15R2.2123 C=CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210623 [1,1,0,0,0,0|1,0,0]=3 1034 B15R2.2123 C=CCNCc1ccc2c(c1)OCO2 34a_100000210006_100015514636 [1,1,0,0,0,0|1,0,0]=3 1035 B15R2.2123 C=CCOCc1ccc2c(c1)CCO2 34a_100011219353_100015514636 [1,1,0,0,0,0|2,0,0]=4 1036 B15R2.2123 C=CCOCc1ccc2c(c1)CCO2 7a_100011219353_100015514636 [1,1,0,0,0,0|2,0,0]=4 1037 B15R2.2123 C=CCOCc1ccc2c(c1)OCO2 34a_100000210967_100015514636 [1,1,0,0,0,0|1,0,0]=3 1038 B15R2.2123 C=CCOCc1ccc2c(c1)OCO2 34a_200000210373_100000189651 [1,1,0,0,0,0|1,0,0]=3 1039 B15R2.2123 CC=CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000070051 [1,1,0,0,0,0|1,0,1]=4 1040 B15R2.2123 CC=CCNc1ccc2c(c1)OCO2 34a_100000209953_100000070051 [1,1,0,0,0,0|1,0,1]=4 1041 B15R2.2123 CC=CCOc1ccc2c(c1)OCO2 34a_100000210298_100000070051 [1,1,0,0,0,0|1,0,1]=4 1042 B15R2.2123 CCCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210211 [1,1,0,0,0,0|1,0,1]=4 1043 B15R2.2123 CCCCNc1ccc2c(c1)OCO2 34a_100000209953_100000210210 [1,1,0,0,0,0|1,0,1]=4 1044 B15R2.2123 CCCCOc1ccc2c(c1)OCO2 34a_100000210298_100000210210 [1,1,0,0,0,0|1,0,1]=4 1045 B15R2.2123 CCCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210303 [1,1,0,0,0,0|1,0,1]=4 1046 B15R2.2123 CCCNCc1ccc2c(c1)OCO2 34a_100000210006_100000210303 [1,1,0,0,0,0|1,0,1]=4 1047 B15R2.2123 CCCOCc1ccc2c(c1)OCO2 34a_100000210258_100000189651 [1,1,0,0,0,0|1,0,1]=4 1048 B15R2.2123 CCCOCc1ccc2c(c1)OCO2 34a_100000210967_100000210303 [1,1,0,0,0,0|1,0,1]=4 1049 B15R2.2123 CCNCCc1ccc2c(c1)OCO2 2230a_100000204656_100000210202 [1,1,0,0,0,0|1,0,1]=4 1050 B15R2.2123 CCNCCc1ccc2c(c1)OCO2 34a_100000204656_100000210202 [1,1,0,0,0,0|1,0,1]=4 1051 B15R2.2123 CCOCCc1ccc2c(c1)OCO2 34a_100011934097_100000210202 [1,1,0,0,0,0|1,0,1]=4 1052 B15R2.2123 COCCNc1ccc2c(c1)OCO2 2230a_100000209953_100011201679 [1,1,0,0,0,0|2,0,0]=4 1053 B15R2.2123 COCCNc1ccc2c(c1)OCO2 34a_100000209953_100011201679 [1,1,0,0,0,0|2,0,0]=4 1054 B15R2.2123 COCCNc1ccc2c(c1)OCO2 34a_200016989596_200000210301 [1,1,0,0,0,0|2,0,0]=4 1055 B15R2.2123 COCCOc1ccc2c(c1)OCO2 34a_100000210298_100011201679 [1,1,0,0,0,0|2,0,0]=4 1056 B15R2.2123 COCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000766300 [1,1,0,0,0,0|2,0,0]=4 1057 B15R2.2123 CSCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000751147 [1,1,0,0,0,0|2,0,0]=4 1058 B15R2.2123 CSCCNc1ccc2c(c1)OCO2 34a_100000209953_100000212216 [1,1,0,0,0,0|2,0,0]=4 1059 B15R2.2123 CSCCOc1ccc2c(c1)OCO2 34a_100000210298_100000212216 [1,1,0,0,0,0|2,0,0]=4 1060 B15R2.2123 CSCNCc1ccc2c(c1)OCO2 2230a_100000210006_100011218213 [1,1,0,0,0,0|2,0,0]=4 1061 B15R2.2123 CSCNCc1ccc2c(c1)OCO2 34a_100000210006_100011218213 [1,1,0,0,0,0|2,0,0]=4 1062 B15R2.2123 CSCOCc1ccc2c(c1)OCO2 34a_100000210967_100011218213 [1,1,0,0,0,0|2,0,0]=4 1063 B15R2.2123 FCCCNc1ccc2c(c1)OCO2 2230a_100000209953_100011934791 [1,1,0,0,0,0|1,0,1]=4 1064 B15R2.2123 FCCCNc1ccc2c(c1)OCO2 34a_100000209953_100011934791 [1,1,0,0,0,0|1,0,1]=4 1065 B15R2.2123 FCCCOc1ccc2c(c1)OCO2 34a_100000210298_100011934791 [1,1,0,0,0,0|1,0,1]=4 1066 B15R2.2123 FCCNCc1ccc2c(c1)OCO2 2230a_100000210006_100011217306 [1,1,0,0,0,0|1,0,1]=4 1067 B15R2.2123 FCCNCc1ccc2c(c1)OCO2 34a_100000210006_100011217306 [1,1,0,0,0,0|1,0,1]=4 1068 B15R2.2123 FCCNCc1ccc2c(c1)OCO2 34a_100000724931_100000189651 [1,1,0,0,0,0|1,0,1]=4 1069 B15R2.2123 FCCOCc1ccc2c(c1)OCO2 34a_100000210967_100011217306 [1,1,0,0,0,0|1,0,1]=4 1070 B15R2.2123 FCNCCc1ccc2c(c1)OCO2 34a_100000204656_100015361967 [1,1,0,0,0,0|1,0,1]=4 1071 B15R2.2123 FCOCCc1ccc2c(c1)OCO2 34a_100011934097_100015361967 [1,1,0,0,0,0|1,0,1]=4 1072 B15R2.2123 N#CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100011215226 [1,1,0,0,0,0|1,0,1]=4 1073 B15R2.2123 N#CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100011215382 [1,1,0,0,0,0|1,0,1]=4 1074 B15R2.2123 NCCOCc1ccc2c(c1)OCO2 34a_100000210304_100000189651 [1,1,0,0,0,0|1,0,1]=4 1075 B15R2.2123 O=CCNCc1ccc2c(c1)CCO2 2230a_100011219410_200015260668 [1,1,0,0,0,0|1,0,0]=3 1076 B15R2.2123 O=CCNCc1ccc2c(c1)CCO2 34a_100011219410_200009817547 [1,1,0,0,0,0|1,0,0]=3 1077 B15R2.2123 O=CCNCc1ccc2c(c1)OCO2 2230a_100000210006_200015260668 [1,1,0,0,0,0|0,0,0]=2 1078 B15R2.2123 O=CCNCc1ccc2c(c1)OCO2 34a_100000210006_200009817547 [1,1,0,0,0,0|0,0,0]=2 1079 B15R2.2123 O=CCNCc1ccc2occc2c1 2230a_100020591328_200015260668 [1,1,0,0,0,0|1,0,1]=4 1080 B15R2.2123 O=CCNCc1ccc2occc2c1 34a_100020591328_200009817547 [1,1,0,0,0,0|1,0,1]=4 1081 B15R2.2123 O=CCOCc1ccc2c(c1)CCC2 34a_200000765175_200009817547 [1,1,0,0,0,0|2,0,0]=4 1082 B15R2.2123 O=CCOCc1ccc2c(c1)CCC2 7a_200000765175_200015260668 [1,1,0,0,0,0|2,0,0]=4 1083 B15R2.2123 O=CCOCc1ccc2c(c1)CCO2 34a_100011219353_200009817547 [1,1,0,0,0,0|1,0,0]=3 1084 B15R2.2123 O=CCOCc1ccc2c(c1)CCO2 7a_100011219353_200015260668 [1,1,0,0,0,0|1,0,0]=3 1085 B15R2.2123 O=CCOCc1ccc2c(c1)NCC2 34a_100000694088_200009817547 [1,1,0,0,0,0|2,0,0]=4 1086 B15R2.2123 O=CCOCc1ccc2c(c1)OCO2 34a_100000210967_200009817547 [1,1,0,0,0,0|0,0,0]=2 1087 B15R2.2123 O=CCOCc1ccc2ccoc2c1 34a_200009859634_200009817547 [1,1,0,0,0,0|1,0,1]=4 1088 B15R2.2123 O=CCOCc1ccc2ccoc2c1 7a_200009859634_200015260668 [1,1,0,0,0,0|1,0,1]=4 1089 B15R2.2123 O=CCOCc1ccc2occc2c1 34a_100000067418_200009817547 [1,1,0,0,0,0|1,0,1]=4 1090 B15R2.2123 O=CCOCc1ccc2occc2c1 7a_100000067418_200015260668 [1,1,0,0,0,0|1,0,1]=4 1091 B15R2.2123 O=CCSCc1ccc2ncoc2c1 62a_106359897996_200015260668 [1,1,0,0,0,0|1,0,1]=4 1092 B15R2.2123 O=CCSCc1ccc2ncoc2c1 62a_200015260668_106359897996 [1,1,0,0,0,0|1,0,1]=4 1093 B15R2.2123 O=CCSCc1ccc2ocnc2c1 62a_200015260668_200010203175 [1,1,0,0,0,0|1,0,1]=4 1094 B15R2.2123 OCCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000230001 [1,1,0,0,0,0|0,0,2]=4 1095 B15R2.2123 OCCCNc1ccc2c(c1)OCO2 34a_100000209953_100000230001 [1,1,0,0,0,0|0,0,2]=4 1096 B15R2.2123 OCCCOc1ccc2c(c1)OCO2 34a_100000210298_100000230001 [1,1,0,0,0,0|0,0,2]=4 1097 B15R2.2123 OCCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000211926 [1,1,0,0,0,0|0,0,2]=4 1098 B15R2.2123 OCCNCc1ccc2c(c1)OCO2 34a_100000210006_100000211926 [1,1,0,0,0,0|0,0,2]=4 1099 B15R2.2123 OCCNCc1ccc2c(c1)OCO2 34a_100016990907_100000189651 [1,1,0,0,0,0|0,0,2]=4 1100 B15R2.2123 OCCOCc1ccc2c(c1)OCO2 34a_100000210967_100000211926 [1,1,0,0,0,0|0,0,2]=4 1101 B15R2.2123 [13CH3]OCCNc1ccc2c(c1)OCO2 34a_200016989596_200025704644 [1,1,0,0,0,0|2,0,0]=4 1102 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748629 [1,1,0,0,0,0|2,0,0]=4 1103 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748629 [1,1,0,0,0,0|2,0,0]=4 1104 B15R2.7688 C=C(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748629 [1,1,0,0,0,0|2,0,0]=4 1105 B15R2.7688 C=C(F)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009893438 [1,1,0,0,0,0|2,0,0]=4 1106 B15R2.7688 C=C(F)CNc1ccc2c(c1)OCO2 34a_100000209953_100009893438 [1,1,0,0,0,0|2,0,0]=4 1107 B15R2.7688 C=C(F)COc1ccc2c(c1)OCO2 34a_100000210298_100009893438 [1,1,0,0,0,0|2,0,0]=4 1108 B15R2.7688 CC(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200000210301 [1,1,0,0,0,0|0,0,2]=4 1109 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000070787_100000763274 [1,1,0,0,0,0|1,0,0]=3 1110 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200000210301 [1,1,0,0,0,0|1,0,0]=3 1111 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200000210301 [1,1,0,0,0,0|0,0,0]=2 1112 B15R2.7688 CC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200000210301 [1,1,0,0,0,0|1,0,0]=3 1113 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 11a_100011219410_100015343762 [1,1,0,0,0,0|2,0,0]=4 1114 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 1626a_100011219410_100015343762 [1,1,0,0,0,0|2,0,0]=4 1115 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 240690a_100011219410_100015343762 [1,1,0,0,0,0|2,0,0]=4 1116 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 527a_100011219410_100103153847 [1,1,0,0,0,0|2,0,0]=4 1117 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100015343762 [1,1,0,0,0,0|1,0,0]=3 1118 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100015343762 [1,1,0,0,0,0|1,0,0]=3 1119 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100015343762 [1,1,0,0,0,0|1,0,0]=3 1120 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100103153847 [1,1,0,0,0,0|1,0,0]=3 1121 B15R2.7688 NC(=O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000747473 [1,1,0,0,0,0|2,0,0]=4 1122 B15R2.7688 NC(=O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000187820 [1,1,0,0,0,0|2,0,0]=4 1123 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747473 [1,1,0,0,0,0|1,0,0]=3 1124 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000187820 [1,1,0,0,0,0|1,0,0]=3 1125 B15R2.7688 NC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000187820 [1,1,0,0,0,0|1,0,0]=3 1126 B15R2.7688 NC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000747473 [1,1,0,0,0,0|2,0,0]=4 1127 B15R2.7688 NC(=O)CSc1ccc2c(c1)CCO2 62a_100000747473_100000729065 [1,1,0,0,0,0|2,0,0]=4 1128 B15R2.7688 NC(=O)CSc1ccc2c(c1)OCC2 62a_100000747473_100009818566 [1,1,0,0,0,0|2,0,0]=4 1129 B15R2.7688 NC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747473 [1,1,0,0,0,0|2,0,0]=4 1130 B15R2.7688 O=C([O-])CNc1ccc2c(c1)CCO2 34a_100000736984_100020667443 [1,1,0,0,0,0|2,0,0]=4 1131 B15R2.7688 O=C([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100020667443 [1,1,0,0,0,0|1,0,0]=3 1132 B15R2.7688 O=C([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100020667443 [1,1,0,0,0,0|1,0,0]=3 1133 B15R2.7688 O=C([O-])CSc1ccc2c(c1)CCO2 62a_100000729065_100020667443 [1,1,0,0,0,0|2,0,0]=4 1134 B15R2.7688 O=C([O-])CSc1ccc2c(c1)CCO2 62a_100020667443_100000729065 [1,1,0,0,0,0|2,0,0]=4 1135 B15R2.7688 O=C([O-])CSc1ccc2c(c1)OCC2 62a_100009818566_100020667443 [1,1,0,0,0,0|2,0,0]=4 1136 B15R2.7688 O=C([O-])CSc1ccc2c(c1)OCC2 62a_100020667443_100009818566 [1,1,0,0,0,0|2,0,0]=4 1137 B15R2.7688 O=[N+]([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100000761209 [1,1,0,0,0,0|2,0,0]=4 1138 B15R2.7688 O=[N+]([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100000761209 [1,1,0,0,0,0|2,0,0]=4 1139 B15R2.7688 [13CH3]C(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200025704644 [1,1,0,0,0,0|0,0,2]=4 1140 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200025704644 [1,1,0,0,0,0|1,0,0]=3 1141 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200025704644 [1,1,0,0,0,0|0,0,0]=2 1142 B15R2.7688 [13CH3]C(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200025704644 [1,1,0,0,0,0|1,0,0]=3 1143 B15R2.17700 CC1Cc2cc(ccc2O1)NCC=O 2230a_100102713350_200015260668 [1,1,0,0,0,0|2,0,0]=4 1144 B15R2.17700 CC1Cc2cc(ccc2O1)NCC=O 34a_100102713350_200009817547 [1,1,0,0,0,0|2,0,0]=4 1145 B15R2.17712 NC1COc2c1ccc(c2)SCC=O 62a_100020628175_200015260668 [1,1,0,0,0,0|2,0,0]=4 1146 B15R2.17712 NC1COc2c1ccc(c2)SCC=O 62a_200015260668_100020628175 [1,1,0,0,0,0|2,0,0]=4 1147 B15R2.17712 O=CCSc1ccc2c(c1)OCC2=O 62a_200015260668_100000686717 [1,1,0,0,0,0|2,0,0]=4 1148 B15R2.964 CC(=O)Cc1cc2c(cc1Br)OCO2 1458a_100000070787_100009995336 [1,1,0,0,0,0|0,0,1]=3 1149 B15R2.964 CC(=O)Cc1cc2c(cc1Cl)OCO2 1458a_100000070787_100000043460 [1,1,0,0,0,0|0,0,1]=3 1150 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 11a_100000066439_100015343762 [1,1,0,0,0,0|1,0,1]=4 1151 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 1626a_100000066439_100015343762 [1,1,0,0,0,0|1,0,1]=4 1152 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 22a_100000066439_100000070787 [1,1,0,0,0,0|1,0,1]=4 1153 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 527a_100000066439_100103153847 [1,1,0,0,0,0|1,0,1]=4 1154 B15R2.964 CC(=O)Nc1cc2c(cc1Cl)OCO2 11a_100000234339_100015343762 [1,1,0,0,0,0|1,0,1]=4 1155 B15R2.964 CC(=O)Nc1cc2c(cc1Cl)OCO2 1626a_100000234339_100015343762 [1,1,0,0,0,0|1,0,1]=4 1156 B15R2.964 CC(=O)Nc1cc2c(cc1Cl)OCO2 22a_100000234339_100000070787 [1,1,0,0,0,0|1,0,1]=4 1157 B15R2.964 CC(=O)Nc1cc2c(cc1I)OCO2 11a_100012557033_100015343762 [1,1,0,0,0,0|1,0,1]=4 1158 B15R2.964 CC(=O)Nc1cc2c(cc1I)OCO2 1626a_100012557033_100015343762 [1,1,0,0,0,0|1,0,1]=4 1159 B15R2.964 CC(=O)Nc1cc2c(cc1I)OCO2 22a_100012557033_100000070787 [1,1,0,0,0,0|1,0,1]=4 1160 B15R2.964 CC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210206 [1,1,0,0,0,0|1,0,1]=4 1161 B15R2.964 CC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100000210206 [1,1,0,0,0,0|1,0,1]=4 1162 B15R2.964 CC(C)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000210206 [1,1,0,0,0,0|1,0,1]=4 1163 B15R2.964 CC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000210206 [1,1,0,0,0,0|1,0,1]=4 1164 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 2230a_100102631434_100009995336 [1,1,0,0,0,0|1,0,1]=4 1165 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 269982a_100102631434_100009995336 [1,1,0,0,0,0|1,0,1]=4 1166 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 270004a_100102631434_100000186749 [1,1,0,0,0,0|1,0,1]=4 1167 B15R2.964 CN(C)Cc1cc2c(cc1Cl)OCO2 269982a_100102631434_100000043460 [1,1,0,0,0,0|1,0,1]=4 1168 B15R2.964 CN(C)Cc1cc2c(cc1Cl)OCO2 270004a_100102631434_100000015535 [1,1,0,0,0,0|1,0,1]=4 1169 B15R2.964 Cc1cc2c(cc1CN(C)C)OCO2 269982a_100102631434_200000112958 [1,1,0,0,0,0|1,0,1]=4 1170 B15R2.964 Cc1cc2c(cc1NC(C)C)OCO2 2230a_100000066439_100000210206 [1,1,0,0,0,0|1,0,1]=4 1171 B15R2.964 Cc1cc2c(cc1NC(C)C)OCO2 34a_100000066439_100000210206 [1,1,0,0,0,0|1,0,1]=4 1172 B15R2.964 Cc1cc2c(cc1OC(C)C)OCO2 34a_100000145572_100000210206 [1,1,0,0,0,0|1,0,1]=4 1173 B15R2.964 Cc1cc2c(cc1OC(C)C)OCO2 7a_100000145572_100000210206 [1,1,0,0,0,0|1,0,1]=4 1174 B15R2.4239 CC(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200000210301 [1,1,0,0,0,0|0,0,1]=3 1175 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210206 [1,1,0,0,0,0|0,0,2]=4 1176 B15R2.4239 [13CH3]C(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200025704644 [1,1,0,0,0,0|0,0,1]=3 1177 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Br 270004a_100102631434_100000682445 [1,1,0,0,0,0|1,0,1]=4 1178 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Cl 270004a_100102631434_100000016197 [1,1,0,0,0,0|1,0,1]=4 1179 B15R2.42998 CC(C)(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210625 [1,1,0,0,0,0|1,0,1]=4 1180 B15R2.42998 CC(C)(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210625 [1,1,0,0,0,0|1,0,1]=4 1181 B15R2.42998 CS(=O)(=O)Nc1ccc2c(c1)OCO2 40a_100000209953_100000738038 [1,1,0,0,0,0|2,0,0]=4 1182 B15R2.43323 CC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000210206 [1,1,0,0,0,0|1,0,1]=4 1183 B15R2.43323 Cc1c(ccc2c1OCO2)SC(C)C 62a_100010335860_100000210206 [1,1,0,0,0,0|1,0,1]=4 1184 B15R2.1198 CCC(NC)c1ccc2c(c1)OCO2 269862a_106832991636_200011217896 [0,1,0,0,1,0|1,0,1]=4 1185 B15R2.27852 CC(=O)C(C)Sc1ccc2c(c1)CC2 62a_100009814033_100009818592 [0,1,0,0,1,0|2,0,0]=4 1186 B15R2.27852 CC(=O)C(C)Sc1ccc2c(c1)CC2 62a_100009818592_100009814033 [0,1,0,0,1,0|2,0,0]=4 1187 B15R2.27852 CC(Sc1ccc2c(c1)CC2)C(=O)N 62a_100000702099_100009818592 [0,1,0,0,1,0|2,0,0]=4 1188 B15R2.27852 CC(Sc1ccc2c(c1)CC2)C(=O)N 62a_100009818592_100000702099 [0,1,0,0,1,0|2,0,0]=4 1189 B17R2.898 C=CC(O)CSc1ccc2c(c1C)OCO2 62a_100010335860_100000730141 [0,1,0,0,0,1|2,0,0]=4 1190 B17R2.898 C=CC(O)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000730141 [0,1,0,0,0,1|2,0,0]=4 1191 B17R2.898 CCC(C)CSc1ccc2c(c1C)OCO2 62a_100010335860_100000748023 [0,1,0,0,0,1|1,0,1]=4 1192 B17R2.898 CCC(C)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000748023 [0,1,0,0,0,1|1,0,1]=4 1193 B17R2.898 CC[C@H](C)CSc1ccc2c(c1C)OCO2 62a_100010335860_100009816398 [0,1,0,0,0,1|1,0,1]=4 1194 B17R2.898 CC[C@H](C)CSc1ccc2c(c1F)OCO2 62a_100010223184_100009816398 [0,1,0,0,0,1|1,0,1]=4 1195 B17R2.898 C[C@@H](CO)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000059175 [0,1,0,0,0,1|0,0,2]=4 1196 B17R2.898 Cc1c(ccc2c1OCO2)SC[C@@H](C)CO 62a_100010335860_100000059175 [0,1,0,0,0,1|0,0,2]=4 1197 B17R2.6122 C#CC(C)OC(C)c1ccc2c(c1)OCO2 34a_100000741967_200000035995 [0,1,0,0,0,1|1,0,1]=4 1198 B17R2.6122 CC(C#N)N[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_100000184139 [0,1,0,0,0,1|1,0,1]=4 1199 B17R2.6122 CC(C#N)OC(C)c1ccc2c(c1)OCO2 7a_100000741967_100000703298 [0,1,0,0,0,1|1,0,1]=4 1200 B17R2.6122 CC(CO)N[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_100012180447 [0,1,0,0,0,1|0,0,2]=4 1201 B17R2.6122 CC(CO)OC(C)c1ccc2c(c1)OCO2 34a_100000741967_100012180447 [0,1,0,0,0,1|0,0,2]=4 1202 B17R2.6122 CC(CO)OC(C)c1ccc2c(c1)OCO2 7a_100000741967_100012180447 [0,1,0,0,0,1|0,0,2]=4 1203 B17R2.6122 CC(N[C@H](C)CF)c1ccc2c(c1)OCO2 269862a_100102880703_100000211065 [0,1,0,0,0,1|1,0,1]=4 1204 B17R2.6122 CC(N[C@H](C)CO)c1ccc2c(c1)OCO2 269862a_100000737577_100000211065 [0,1,0,0,0,1|0,0,2]=4 1205 B17R2.6122 CCC(C)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000748023 [0,1,0,0,0,1|1,0,1]=4 1206 B17R2.6122 CCC(C)NC(C)c1ccc2c(c1)OCO2 269862a_100000209981_100000211065 [0,1,0,0,0,1|1,0,1]=4 1207 B17R2.6122 CCC(C)N[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_100000758301 [0,1,0,0,0,1|1,0,1]=4 1208 B17R2.6122 CCC(C)OC(C)c1ccc2c(c1)OCO2 34a_100000741967_100011215416 [0,1,0,0,0,1|1,0,1]=4 1209 B17R2.6122 CCC(C)OC(C)c1ccc2c(c1)OCO2 7a_100000741967_100000758301 [0,1,0,0,0,1|1,0,1]=4 1210 B17R2.6122 CC[C@H](C)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100009816398 [0,1,0,0,0,1|1,0,1]=4 1211 B17R2.6122 C[C@@H](CO)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000059175 [0,1,0,0,0,1|0,0,2]=4 1212 B17R2.9648 C#CCC(C)OCc1ccc2c(c1)OCO2 34a_100000685586_100000189651 [0,1,0,0,0,1|1,0,1]=4 1213 B17R2.9648 C#CCC(C)OCc1ccc2c(c1)OCO2 7a_100000685586_100000189651 [0,1,0,0,0,1|1,0,1]=4 1214 B17R2.9648 C/C=C/C(C)OCc1ccc2c(c1)OCO2 34a_200102604097_100000189651 [0,1,0,0,0,1|1,0,0]=3 1215 B17R2.9648 C=CC[C@@H](C)OCc1ccc2c(c1)OCO2 34a_100000731007_100000189651 [0,1,0,0,0,1|1,0,0]=3 1216 B17R2.9648 C=CC[C@@H](C)OCc1ccc2c(c1)OCO2 7a_100000731007_100000189651 [0,1,0,0,0,1|1,0,0]=3 1217 B17R2.9648 CC#CC(C)OCc1ccc2c(c1)OCO2 34a_100011216543_100000189651 [0,1,0,0,0,1|1,0,1]=4 1218 B17R2.9648 CC(CC#N)NCc1ccc2c(c1)OCO2 2230a_100000210006_100009813641 [0,1,0,0,0,1|1,0,1]=4 1219 B17R2.9648 CC(CCBr)OCc1ccc2c(c1)OCO2 34a_100012276601_100000189651 [0,1,0,0,0,1|1,0,1]=4 1220 B17R2.9648 CC(CCO)NCc1ccc2c(c1)OCO2 2230a_100000210006_100009893172 [0,1,0,0,0,1|0,0,2]=4 1221 B17R2.9648 CC(CCO)NCc1ccc2c(c1)OCO2 34a_100000210006_100009893172 [0,1,0,0,0,1|0,0,2]=4 1222 B17R2.9648 CC(CCO)OCc1ccc2c(c1)OCO2 34a_100000210967_100009893172 [0,1,0,0,0,1|0,0,2]=4 1223 B17R2.9648 CC(CCc1ccc2c(c1)OCO2)OCF 34a_100000744918_100015361967 [0,1,0,0,0,1|1,0,1]=4 1224 B17R2.9648 CC(CCc1ccc2c(c1)OCO2)OCF 7a_100000744918_100015361967 [0,1,0,0,0,1|1,0,1]=4 1225 B17R2.9648 CCCC(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011216630 [0,1,0,0,0,1|1,0,1]=4 1226 B17R2.9648 CCCC(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100011216630 [0,1,0,0,0,1|1,0,1]=4 1227 B17R2.9648 CCCC(C)COc1ccc2c(c1)OCO2 34a_100000210298_100011216630 [0,1,0,0,0,1|1,0,1]=4 1228 B17R2.9648 CCCC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000766640 [0,1,0,0,0,1|1,0,1]=4 1229 B17R2.9648 CCCC(C)NCc1ccc2c(c1)OCO2 270004a_100000210006_100000211909 [0,1,0,0,0,1|1,0,1]=4 1230 B17R2.9648 CCCC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000766640 [0,1,0,0,0,1|1,0,1]=4 1231 B17R2.9648 CCCC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000766640 [0,1,0,0,0,1|1,0,1]=4 1232 B17R2.9648 CCCC(C)OCc1ccc2c(c1)OCO2 34a_100000764384_100000189651 [0,1,0,0,0,1|1,0,1]=4 1233 B17R2.9648 CCCC(C)OCc1ccc2c(c1)OCO2 7a_100000764384_100000189651 [0,1,0,0,0,1|1,0,1]=4 1234 B17R2.9648 CCNC(C)CCc1ccc2c(c1)OCO2 270004a_100015525214_100000182259 [0,1,0,0,0,1|1,0,1]=4 1235 B17R2.9648 CCOC(C)CCc1ccc2c(c1)OCO2 34a_100000744918_100000210202 [0,1,0,0,0,1|1,0,1]=4 1236 B17R2.9648 CCOC(C)CCc1ccc2c(c1)OCO2 7a_100000744918_100000210202 [0,1,0,0,0,1|1,0,1]=4 1237 B17R2.9648 COCC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000765312 [0,1,0,0,0,1|0,0,2]=4 1238 B17R2.9648 COCC(C)NCc1ccc2c(c1)OCO2 270004a_100000210006_100000749346 [0,1,0,0,0,1|0,0,2]=4 1239 B17R2.9648 COCC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000765312 [0,1,0,0,0,1|0,0,2]=4 1240 B17R2.9648 COCC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000765312 [0,1,0,0,0,1|0,0,2]=4 1241 B17R2.9648 COC[C@@H](C)OCc1ccc2c(c1)OCO2 34a_100011934205_100000189651 [0,1,0,0,0,1|0,0,2]=4 1242 B17R2.9648 CSCC(C)NCc1ccc2c(c1)OCO2 270004a_100000210006_100011216314 [0,1,0,0,0,1|0,1,1]=4 1243 B17R2.9648 C[C@H](CCO)NCc1ccc2c(c1)OCO2 34a_100000706166_100000189651 [0,1,0,0,0,1|0,0,2]=4 1244 B17R2.18982 C#CC(C)C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000035995 [0,1,0,0,0,1|1,0,1]=4 1245 B17R2.18982 C=CC(C)C(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100011216780 [0,1,0,0,0,1|1,0,1]=4 1246 B17R2.18982 C=CC(C)C(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100011216780 [0,1,0,0,0,1|1,0,1]=4 1247 B17R2.18982 C=CC(C)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100011216780 [0,1,0,0,0,1|1,0,1]=4 1248 B17R2.18982 C=CC(C)C(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100011216780 [0,1,0,0,0,1|1,0,1]=4 1249 B17R2.18982 C=CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011215867 [0,1,0,0,0,1|1,0,0]=3 1250 B17R2.18982 CC(C#N)C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000703298 [0,1,0,0,0,1|1,0,1]=4 1251 B17R2.18982 CC(C#N)N(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000184139 [0,1,0,0,0,1|1,0,1]=4 1252 B17R2.18982 CC(C#N)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000703298 [0,1,0,0,0,1|1,0,1]=4 1253 B17R2.18982 CC(CO)N(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100012180447 [0,1,0,0,0,1|0,0,2]=4 1254 B17R2.18982 CC(CO)N(C)Cc1ccc2c(c1)OCO2 269982a_100000693034_100000189651 [0,1,0,0,0,1|0,0,2]=4 1255 B17R2.18982 CCC(C)C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000758301 [0,1,0,0,0,1|1,0,1]=4 1256 B17R2.18982 CCC(C)N(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000758301 [0,1,0,0,0,1|1,0,1]=4 1257 B17R2.18982 CCC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000758301 [0,1,0,0,0,1|1,0,1]=4 1258 B17R2.18982 CCC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100000741768_100000189651 [0,1,0,0,0,1|1,0,1]=4 1259 B17R2.18982 COC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100009879195 [0,1,0,0,0,1|2,0,0]=4 1260 B17R2.18982 C[C@H](CO)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100016084084 [0,1,0,0,0,1|0,0,2]=4 1261 B17R2.35839 C#CC(C)(C)NCc1ccc2c(c1)OCO2 34a_100000054563_100000189651 [0,1,0,0,0,1|1,0,1]=4 1262 B17R2.35839 C#CC(C)(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000038118 [0,1,0,0,0,1|1,0,1]=4 1263 B17R2.35839 C#CC(C)(C)OCc1ccc2c(c1)OCO2 34a_100000189450_100000189651 [0,1,0,0,0,1|1,0,1]=4 1264 B17R2.35839 C#CC(C)(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000038118 [0,1,0,0,0,1|1,0,1]=4 1265 B17R2.35839 C#CC(C)(C)OCc1ccc2c(c1)OCO2 7a_100000189450_100000189651 [0,1,0,0,0,1|1,0,1]=4 1266 B17R2.35839 C=CC(C)(C)OCc1ccc2c(c1)OCO2 34a_100011215311_100000189651 [0,1,0,0,0,1|1,0,0]=3 1267 B17R2.35839 C=CC(C)(C)OCc1ccc2c(c1)OCO2 7a_100011215311_100000189651 [0,1,0,0,0,1|1,0,0]=3 1268 B17R2.35839 C=C[Si](C)(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000038793 [0,1,0,0,0,1|1,1,0]=4 1269 B17R2.35839 CC(C)(C#N)NCc1ccc2c(c1)OCO2 34a_100000210006_100011162410 [0,1,0,0,0,1|1,0,1]=4 1270 B17R2.35839 CC(C)(C#N)OCc1ccc2c(c1)OCO2 34a_100000210967_100011162410 [0,1,0,0,0,1|1,0,1]=4 1271 B17R2.35839 CC(C)(C#N)OCc1ccc2c(c1)OCO2 34a_200015195151_100000189651 [0,1,0,0,0,1|1,0,1]=4 1272 B17R2.35839 CC(C)(CCl)OCc1ccc2c(c1)OCO2 7a_100000764493_100000189651 [0,1,0,0,0,1|1,0,1]=4 1273 B17R2.35839 CC(C)(CO)CNc1ccc2c(c1)OCO2 34a_100000209953_100009813988 [0,1,0,0,0,1|0,0,2]=4 1274 B17R2.35839 CC(C)(CO)COc1ccc2c(c1)OCO2 34a_100000210298_100009813988 [0,1,0,0,0,1|0,0,2]=4 1275 B17R2.35839 CCC(C)(C)OCc1ccc2c(c1)OCO2 7a_100000210230_100000189651 [0,1,0,0,0,1|1,0,1]=4 1276 B17R2.35839 COC(C)(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000701081 [0,1,0,0,0,1|2,0,0]=4 1277 B17R2.35839 COC(C)(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000701081 [0,1,0,0,0,1|2,0,0]=4 1278 B17R2.45524 C=C(C)C(C)NCc1ccc2c(c1)CCO2 269862a_100011219410_100011216138 [0,1,0,0,0,1|2,0,0]=4 1279 B17R2.45524 C=C(C)C(C)NCc1ccc2c(c1)OCO2 269862a_100000210006_100011216138 [0,1,0,0,0,1|1,0,0]=3 1280 B17R2.45524 CC(=O)C(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011261029 [0,1,0,0,0,1|1,0,1]=4 1281 B17R2.45524 CC(=O)C(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100011261029 [0,1,0,0,0,1|1,0,1]=4 1282 B17R2.45524 CC(=O)C(C)NCc1ccc2c(c1)CCO2 2230a_100011219410_100009814033 [0,1,0,0,0,1|1,0,0]=3 1283 B17R2.45524 CC(=O)C(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100009814033 [0,1,0,0,0,1|0,0,0]=2 1284 B17R2.45524 CC(=O)C(C)NCc1ccc2occc2c1 2230a_100020591328_100009814033 [0,1,0,0,0,1|1,0,1]=4 1285 B17R2.45524 CC(=O)C(C)OCc1ccc2c(c1)CCC2 7a_200000765175_100000179758 [0,1,0,0,0,1|2,0,0]=4 1286 B17R2.45524 CC(=O)C(C)OCc1ccc2c(c1)CCO2 7a_100011219353_100000179758 [0,1,0,0,0,1|1,0,0]=3 1287 B17R2.45524 CC(=O)C(C)OCc1ccc2c(c1)OCO2 34a_100000212229_100000189651 [0,1,0,0,0,1|0,0,0]=2 1288 B17R2.45524 CC(=O)C(C)OCc1ccc2ccoc2c1 7a_200009859634_100000179758 [0,1,0,0,0,1|1,0,1]=4 1289 B17R2.45524 CC(=O)C(C)OCc1ccc2ncoc2c1 34a_100000212229_106359897996 [0,1,0,0,0,1|1,0,1]=4 1290 B17R2.45524 CC(=O)C(C)OCc1ccc2occc2c1 7a_100000067418_100000179758 [0,1,0,0,0,1|1,0,1]=4 1291 B17R2.45524 CC(=O)C(C)OCc1ccc2ocnc2c1 34a_100000212229_200010203175 [0,1,0,0,0,1|1,0,1]=4 1292 B17R2.45524 CC(=O)C(C)SCc1ccc2ncoc2c1 62a_100009814033_106359897996 [0,1,0,0,0,1|1,0,1]=4 1293 B17R2.45524 CC(=O)C(C)SCc1ccc2ncoc2c1 62a_106359897996_100009814033 [0,1,0,0,0,1|1,0,1]=4 1294 B17R2.45524 CC(=O)C(C)SCc1ccc2ocnc2c1 62a_100009814033_200010203175 [0,1,0,0,0,1|1,0,1]=4 1295 B17R2.45524 CC(C)C(C)OCc1ccc2c(c1)OCO2 7a_100000748068_100000189651 [0,1,0,0,0,1|1,0,1]=4 1296 B17R2.45524 CC(CCc1ccc2c(c1)OCO2)N(C)C 270004a_100102631434_100000182259 [0,1,0,0,0,1|2,0,0]=4 1297 B17R2.45524 CC(NCc1ccc2c(c1)CCO2)C(=O)N 2230a_100011219410_100000702099 [0,1,0,0,0,1|1,0,0]=3 1298 B17R2.45524 CC(NCc1ccc2c(c1)CCO2)C(=O)N 34a_100011219410_100000702099 [0,1,0,0,0,1|1,0,0]=3 1299 B17R2.45524 CC(NCc1ccc2c(c1)OCO2)C(=O)N 2230a_100000210006_100000702099 [0,1,0,0,0,1|0,0,0]=2 1300 B17R2.45524 CC(NCc1ccc2c(c1)OCO2)C(=O)N 34a_100000210006_100000702099 [0,1,0,0,0,1|0,0,0]=2 1301 B17R2.45524 CC(NCc1ccc2occc2c1)C(=O)N 2230a_100020591328_100000702099 [0,1,0,0,0,1|1,0,1]=4 1302 B17R2.45524 CC(NCc1ccc2occc2c1)C(=O)N 34a_100020591328_100000702099 [0,1,0,0,0,1|1,0,1]=4 1303 B17R2.45524 CC(OCc1ccc2c(c1)CCC2)C(=O)N 34a_200000765175_100000702099 [0,1,0,0,0,1|2,0,0]=4 1304 B17R2.45524 CC(OCc1ccc2c(c1)CCC2)C(=O)N 7a_200000765175_100000702099 [0,1,0,0,0,1|2,0,0]=4 1305 B17R2.45524 CC(OCc1ccc2c(c1)CCO2)C(=O)N 34a_100011219353_100000702099 [0,1,0,0,0,1|1,0,0]=3 1306 B17R2.45524 CC(OCc1ccc2c(c1)CCO2)C(=O)N 7a_100011219353_100000702099 [0,1,0,0,0,1|1,0,0]=3 1307 B17R2.45524 CC(OCc1ccc2c(c1)NCC2)C(=O)N 34a_100000694088_100000702099 [0,1,0,0,0,1|2,0,0]=4 1308 B17R2.45524 CC(OCc1ccc2c(c1)OCO2)C(=O)N 34a_100000210967_100000702099 [0,1,0,0,0,1|0,0,0]=2 1309 B17R2.45524 CC(OCc1ccc2ccoc2c1)C(=O)N 34a_200009859634_100000702099 [0,1,0,0,0,1|1,0,1]=4 1310 B17R2.45524 CC(OCc1ccc2ccoc2c1)C(=O)N 7a_200009859634_100000702099 [0,1,0,0,0,1|1,0,1]=4 1311 B17R2.45524 CC(OCc1ccc2occc2c1)C(=O)N 34a_100000067418_100000702099 [0,1,0,0,0,1|1,0,1]=4 1312 B17R2.45524 CC(OCc1ccc2occc2c1)C(=O)N 7a_100000067418_100000702099 [0,1,0,0,0,1|1,0,1]=4 1313 B17R2.45524 CC(SCc1ccc2ncoc2c1)C(=O)N 62a_100000702099_106359897996 [0,1,0,0,0,1|1,0,1]=4 1314 B17R2.45524 CC(SCc1ccc2ncoc2c1)C(=O)N 62a_106359897996_100000702099 [0,1,0,0,0,1|1,0,1]=4 1315 B17R2.45524 CC(SCc1ccc2ocnc2c1)C(=O)N 62a_100000702099_200010203175 [0,1,0,0,0,1|1,0,1]=4 1316 B17R2.45524 C[C@@H](NCc1ccc2c(c1)CCC2)C(=O)N 270004a_100000119354_100000765347 [0,1,0,0,0,1|2,0,0]=4 1317 B17R2.45524 C[C@@H](NCc1ccc2c(c1)CCO2)C(=O)N 270004a_100000119354_100011218456 [0,1,0,0,0,1|1,0,0]=3 1318 B17R2.45524 C[C@@H](NCc1ccc2c(c1)OCO2)C(=O)N 34a_100000119354_100000189651 [0,1,0,0,0,1|0,0,0]=2 1319 B17R2.45524 C[C@@H](NCc1ccc2ncoc2c1)C(=O)N 2230a_100000119354_106359897996 [0,1,0,0,0,1|1,0,1]=4 1320 B17R2.45524 C[C@@H](NCc1ccc2ncoc2c1)C(=O)N 270004a_100000119354_100000059852 [0,1,0,0,0,1|1,0,1]=4 1321 B17R2.45524 C[C@@H](NCc1ccc2ncoc2c1)C(=O)N 34a_100000119354_106359897996 [0,1,0,0,0,1|1,0,1]=4 1322 B17R2.45524 C[C@@H](NCc1ccc2occc2c1)C(=O)N 270004a_100000119354_100000040644 [0,1,0,0,0,1|1,0,1]=4 1323 B17R2.45524 C[C@@H](NCc1ccc2ocnc2c1)C(=O)N 2230a_100000119354_200010203175 [0,1,0,0,0,1|1,0,1]=4 1324 B17R2.45524 C[C@@H](NCc1ccc2ocnc2c1)C(=O)N 270004a_100000119354_100010271902 [0,1,0,0,0,1|1,0,1]=4 1325 B17R2.45524 C[C@@H](NCc1ccc2ocnc2c1)C(=O)N 34a_100000119354_200010203175 [0,1,0,0,0,1|1,0,1]=4 1326 B17R2.45524 C[C@@H](OCc1ccc2c(c1)OCO2)C(=O)N 34a_100000731257_100000189651 [0,1,0,0,0,1|0,0,0]=2 1327 B17R2.45524 C[C@@H](OCc1ccc2c(c1)OCO2)C(=O)N 7a_100000731257_100000189651 [0,1,0,0,0,1|0,0,0]=2 1328 B17R2.45524 C[C@@H](OCc1ccc2ncoc2c1)C(=O)N 34a_100000731257_106359897996 [0,1,0,0,0,1|1,0,1]=4 1329 B17R2.45524 C[C@@H](OCc1ccc2ncoc2c1)C(=O)N 7a_100000731257_106359897996 [0,1,0,0,0,1|1,0,1]=4 1330 B17R2.45524 C[C@@H](OCc1ccc2ocnc2c1)C(=O)N 34a_100000731257_200010203175 [0,1,0,0,0,1|1,0,1]=4 1331 B17R2.45524 C[C@@H](OCc1ccc2ocnc2c1)C(=O)N 7a_100000731257_200010203175 [0,1,0,0,0,1|1,0,1]=4 1332 B17R2.45524 C[C@H](NCc1ccc2c(c1)OCO2)C(=O)O 269956a_100000743915_100000189651 [0,1,0,0,0,1|0,0,0]=2 1333 B17R2.45524 C[C@H](NCc1ccc2ncoc2c1)C(=O)O 269956a_100000743915_106359897996 [0,1,0,0,0,1|1,0,1]=4 1334 B17R2.45524 C[C@H](NCc1ccc2ocnc2c1)C(=O)O 269956a_100000743915_200010203175 [0,1,0,0,0,1|1,0,1]=4 1335 B17R2.45524 C[C@H](OCc1ccc2c(c1)OCO2)C(=O)[O-] 7a_217856618621_100000189651 [0,1,0,0,0,1|0,0,0]=2 1336 B17R2.45524 C[C@H](OCc1ccc2ncoc2c1)C(=O)[O-] 7a_217856618621_106359897996 [0,1,0,0,0,1|1,0,1]=4 1337 B17R2.45524 C[C@H](OCc1ccc2ocnc2c1)C(=O)[O-] 7a_217856618621_200010203175 [0,1,0,0,0,1|1,0,1]=4 1338 B17R2.45524 NC(=O)C(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100011215815 [0,1,0,0,0,1|1,0,1]=4 1339 B17R2.45524 NC(=O)C(F)NCc1ccc2c(c1)CCO2 2230a_100011219410_100009813875 [0,1,0,0,0,1|2,0,0]=4 1340 B17R2.45524 NC(=O)C(F)NCc1ccc2c(c1)CCO2 34a_100011219410_100009813875 [0,1,0,0,0,1|2,0,0]=4 1341 B17R2.45524 NC(=O)C(F)NCc1ccc2c(c1)OCO2 2230a_100000210006_100009813875 [0,1,0,0,0,1|1,0,0]=3 1342 B17R2.45524 NC(=O)C(F)NCc1ccc2c(c1)OCO2 34a_100000210006_100009813875 [0,1,0,0,0,1|1,0,0]=3 1343 B17R2.45524 NC(=O)C(F)OCc1ccc2c(c1)CCO2 34a_100011219353_100009813875 [0,1,0,0,0,1|2,0,0]=4 1344 B17R2.45524 NC(=O)C(F)OCc1ccc2c(c1)CCO2 7a_100011219353_100009813875 [0,1,0,0,0,1|2,0,0]=4 1345 B17R2.45524 NC(=O)C(F)OCc1ccc2c(c1)OCO2 34a_100000210967_100009813875 [0,1,0,0,0,1|1,0,0]=3 1346 B17R2.45524 O=C([O-])C(F)NCc1ccc2c(c1)CCO2 34a_100011219410_100020610796 [0,1,0,0,0,1|2,0,0]=4 1347 B17R2.45524 O=C([O-])C(F)NCc1ccc2c(c1)OCO2 34a_100000210006_100020610796 [0,1,0,0,0,1|1,0,0]=3 1348 B17R2.45524 O=C([O-])C(F)OCc1ccc2c(c1)CCO2 34a_100011219353_100020610796 [0,1,0,0,0,1|2,0,0]=4 1349 B17R2.45524 O=C([O-])C(F)OCc1ccc2c(c1)OCO2 34a_100000210967_100020610796 [0,1,0,0,0,1|1,0,0]=3 1350 B17R2.48534 C#CC(CC)OCc1ccc2c(c1)OCO2 34a_100000758843_100000189651 [0,1,0,0,0,1|1,0,1]=4 1351 B17R2.48534 C#CC(CC)OCc1ccc2c(c1)OCO2 7a_100000758843_100000189651 [0,1,0,0,0,1|1,0,1]=4 1352 B17R2.48534 C=CC(C=C)OCc1ccc2c(c1)OCO2 34a_100000033096_100000189651 [0,1,0,0,0,1|1,0,1]=4 1353 B17R2.48534 C=CC(CC)OCc1ccc2c(c1)OCO2 34a_100000766422_100000189651 [0,1,0,0,0,1|1,0,0]=3 1354 B17R2.48534 C=CC(CC)OCc1ccc2c(c1)OCO2 7a_100000766422_100000189651 [0,1,0,0,0,1|1,0,0]=3 1355 B17R2.48534 C=C[C@@H](CO)NCc1ccc2c(c1)CCO2 270004a_100016989147_100011218456 [0,1,0,0,0,1|2,0,0]=4 1356 B17R2.48534 C=C[C@@H](CO)NCc1ccc2c(c1)OCO2 34a_100016989147_100000189651 [0,1,0,0,0,1|1,0,0]=3 1357 B17R2.48534 CCC(CC)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011215472 [0,1,0,0,0,1|1,0,1]=4 1358 B17R2.48534 CCC(CC)CNc1ccc2c(c1)OCO2 34a_100000209953_100011215472 [0,1,0,0,0,1|1,0,1]=4 1359 B17R2.48534 CCC(CC)COc1ccc2c(c1)OCO2 34a_100000210298_100011215472 [0,1,0,0,0,1|1,0,1]=4 1360 B17R2.48534 CCC(CC)NCc1ccc2c(c1)OCO2 270004a_100000210006_100000210860 [0,1,0,0,0,1|1,0,1]=4 1361 B17R2.48534 CCC(CC)OCc1ccc2c(c1)OCO2 7a_100000688536_100000189651 [0,1,0,0,0,1|1,0,1]=4 1362 B17R2.48534 COC(CN)COc1ccc2c(c1)OCO2 34a_100000238326_200000210301 [0,1,0,0,0,1|1,0,1]=4 1363 B17R2.48534 COC(CNc1ccc2c(c1)OCO2)OC 2230a_100000209953_100000751394 [0,1,0,0,0,1|2,0,0]=4 1364 B17R2.48534 COC(CNc1ccc2c(c1)OCO2)OC 34a_100000209953_100000211822 [0,1,0,0,0,1|2,0,0]=4 1365 B17R2.48534 COC(COc1ccc2c(c1)OCO2)OC 34a_100000210298_100000211822 [0,1,0,0,0,1|2,0,0]=4 1366 B17R2.48534 ClCC(CCl)OCc1ccc2c(c1)OCO2 7a_100000737055_100000189651 [0,1,0,0,0,1|1,0,1]=4 1367 B17R2.48534 FCC(CF)OCc1ccc2c(c1)OCO2 34a_100000032261_100000189651 [0,1,0,0,0,1|1,0,1]=4 1368 B17R2.48534 FCC(CF)OCc1ccc2c(c1)OCO2 7a_100000032261_100000189651 [0,1,0,0,0,1|1,0,1]=4 1369 B17R2.48534 FC[C@@H](CCl)OCc1ccc2c(c1)OCO2 34a_100015614560_100000189651 [0,1,0,0,0,1|1,0,1]=4 1370 B17R2.48534 FC[C@@H](CCl)OCc1ccc2c(c1)OCO2 7a_100015614560_100000189651 [0,1,0,0,0,1|1,0,1]=4 1371 B17R2.48534 NCC(CN)OCc1ccc2c(c1)OCO2 34a_100000031598_100000189651 [0,1,0,0,0,1|1,0,1]=4 1372 B17R2.48534 O=CC(C=O)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000736813 [0,1,0,0,0,1|1,0,1]=4 1373 B17R2.48534 O=CC(C=O)NCc1ccc2c(c1)CCO2 34a_100011219410_100000736813 [0,1,0,0,0,1|1,0,1]=4 1374 B17R2.48534 O=CC(C=O)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000736813 [0,1,0,0,0,1|0,0,1]=3 1375 B17R2.48534 O=CC(C=O)NCc1ccc2c(c1)OCO2 34a_100000210006_100000736813 [0,1,0,0,0,1|0,0,1]=3 1376 B17R2.48534 O=CC(C=O)OCc1ccc2c(c1)CCO2 34a_100011219353_100000736813 [0,1,0,0,0,1|1,0,1]=4 1377 B17R2.48534 O=CC(C=O)OCc1ccc2c(c1)OCO2 34a_100000210967_100000736813 [0,1,0,0,0,1|0,0,1]=3 1378 B17R2.48534 [13CH3]OC(CN)COc1ccc2c(c1)OCO2 34a_100000238326_200025704644 [0,1,0,0,0,1|1,0,1]=4 1379 B17R2.57548 C#CC(C)NCc1cc2c(cc1Br)OCO2 2230a_100000707721_100009995336 [0,1,0,0,0,1|1,0,1]=4 1380 B17R2.57548 C#CC(C)NCc1cc2c(cc1Br)OCO2 270004a_100000707721_100000186749 [0,1,0,0,0,1|1,0,1]=4 1381 B17R2.57548 C#CC(C)NCc1cc2c(cc1Br)OCO2 34a_100000707721_100009995336 [0,1,0,0,0,1|1,0,1]=4 1382 B17R2.57548 C#CC(C)NCc1cc2c(cc1Cl)OCO2 270004a_100000707721_100000015535 [0,1,0,0,0,1|1,0,1]=4 1383 B17R2.57548 C#CC(C)OCc1cc2c(cc1Br)OCO2 34a_100000187691_200000035995 [0,1,0,0,0,1|1,0,1]=4 1384 B17R2.57548 C#CC(C)OCc1cc2c(cc1Cl)OCO2 34a_200000238738_200000035995 [0,1,0,0,0,1|1,0,1]=4 1385 B17R2.57548 C#C[C@@H](C)OCc1cc2c(cc1Br)OCO2 34a_100009815206_100009995336 [0,1,0,0,0,1|1,0,1]=4 1386 B17R2.57548 C#C[C@@H](C)OCc1cc2c(cc1Br)OCO2 7a_100009815206_100009995336 [0,1,0,0,0,1|1,0,1]=4 1387 B17R2.57548 C#C[C@@H](C)OCc1cc2c(cc1C)OCO2 7a_100009815206_200000112958 [0,1,0,0,0,1|1,0,1]=4 1388 B17R2.57548 C#C[C@@H](C)OCc1cc2c(cc1Cl)OCO2 7a_100009815206_100000043460 [0,1,0,0,0,1|1,0,1]=4 1389 B17R2.57548 C=CC(C)OCc1cc2c(cc1Br)OCO2 34a_100000695699_100009995336 [0,1,0,0,0,1|1,0,0]=3 1390 B17R2.57548 C=CC(O)CNc1cc2c(cc1C)OCO2 2230a_100000066439_100000730141 [0,1,0,0,0,1|2,0,0]=4 1391 B17R2.57548 C=CC(O)CNc1cc2c(cc1C)OCO2 34a_100000066439_100000730141 [0,1,0,0,0,1|2,0,0]=4 1392 B17R2.57548 C=CC(O)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000730141 [0,1,0,0,0,1|2,0,0]=4 1393 B17R2.57548 C=CC(O)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000730141 [0,1,0,0,0,1|2,0,0]=4 1394 B17R2.57548 C=CC(O)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000730141 [0,1,0,0,0,1|2,0,0]=4 1395 B17R2.57548 C=CC(O)COc1cc2c(cc1C)OCO2 34a_100000145572_100000730141 [0,1,0,0,0,1|2,0,0]=4 1396 B17R2.57548 C=CC(O)COc1cc2c(cc1C)OCO2 7a_100000145572_100000730141 [0,1,0,0,0,1|2,0,0]=4 1397 B17R2.57548 C=CC(O)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000730141 [0,1,0,0,0,1|2,0,0]=4 1398 B17R2.57548 CC(C#N)NCc1cc2c(cc1Br)OCO2 2230a_100000737613_100009995336 [0,1,0,0,0,1|1,0,1]=4 1399 B17R2.57548 CC(C#N)NCc1cc2c(cc1Br)OCO2 2230a_200011199097_100000184139 [0,1,0,0,0,1|1,0,1]=4 1400 B17R2.57548 CC(C#N)OCc1cc2c(cc1Br)OCO2 34a_100011218135_100009995336 [0,1,0,0,0,1|1,0,1]=4 1401 B17R2.57548 CC(C#N)OCc1cc2c(cc1Br)OCO2 7a_100000187691_100000703298 [0,1,0,0,0,1|1,0,1]=4 1402 B17R2.57548 CC(C#N)OCc1cc2c(cc1Cl)OCO2 7a_200000238738_100000703298 [0,1,0,0,0,1|1,0,1]=4 1403 B17R2.57548 CC(C#N)SCc1cc2c(cc1Br)OCO2 62a_100009995336_100000703298 [0,1,0,0,0,1|1,0,1]=4 1404 B17R2.57548 CC(C#N)SCc1cc2c(cc1Cl)OCO2 62a_100000043460_100000703298 [0,1,0,0,0,1|1,0,1]=4 1405 B17R2.57548 CC(CF)OCc1cc2c(cc1Br)OCO2 34a_100016041109_100009995336 [0,1,0,0,0,1|1,0,1]=4 1406 B17R2.57548 CC(CF)OCc1cc2c(cc1Br)OCO2 7a_100016041109_100009995336 [0,1,0,0,0,1|1,0,1]=4 1407 B17R2.57548 CC(CF)OCc1cc2c(cc1Cl)OCO2 7a_100016041109_100000043460 [0,1,0,0,0,1|1,0,1]=4 1408 B17R2.57548 CC(CN)OCc1cc2c(cc1Br)OCO2 34a_100000210904_100009995336 [0,1,0,0,0,1|1,0,1]=4 1409 B17R2.57548 CC(CO)NCc1cc2c(cc1Br)OCO2 2230a_200011199097_100012180447 [0,1,0,0,0,1|0,0,2]=4 1410 B17R2.57548 CC(CO)OCc1cc2c(cc1Br)OCO2 34a_100000187691_100012180447 [0,1,0,0,0,1|0,0,2]=4 1411 B17R2.57548 CC(CO)OCc1cc2c(cc1Br)OCO2 7a_100000187691_100012180447 [0,1,0,0,0,1|0,0,2]=4 1412 B17R2.57548 CC(CO)OCc1cc2c(cc1Cl)OCO2 34a_200000238738_100012180447 [0,1,0,0,0,1|0,0,2]=4 1413 B17R2.57548 CC(CO)OCc1cc2c(cc1Cl)OCO2 7a_200000238738_100012180447 [0,1,0,0,0,1|0,0,2]=4 1414 B17R2.57548 CCC(C)CNc1cc2c(cc1C)OCO2 2230a_100000066439_100000748023 [0,1,0,0,0,1|1,0,1]=4 1415 B17R2.57548 CCC(C)CNc1cc2c(cc1C)OCO2 34a_100000066439_100000748023 [0,1,0,0,0,1|1,0,1]=4 1416 B17R2.57548 CCC(C)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000748023 [0,1,0,0,0,1|1,0,1]=4 1417 B17R2.57548 CCC(C)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000748023 [0,1,0,0,0,1|1,0,1]=4 1418 B17R2.57548 CCC(C)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000748023 [0,1,0,0,0,1|1,0,1]=4 1419 B17R2.57548 CCC(C)COc1cc2c(cc1C)OCO2 34a_100000145572_100000748023 [0,1,0,0,0,1|1,0,1]=4 1420 B17R2.57548 CCC(C)COc1cc2c(cc1C)OCO2 7a_100000145572_100000748023 [0,1,0,0,0,1|1,0,1]=4 1421 B17R2.57548 CCC(C)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000748023 [0,1,0,0,0,1|1,0,1]=4 1422 B17R2.57548 CCC(C)NCc1cc2c(cc1Br)OCO2 2230a_100000209981_100009995336 [0,1,0,0,0,1|1,0,1]=4 1423 B17R2.57548 CCC(C)NCc1cc2c(cc1Br)OCO2 2230a_200011199097_100000758301 [0,1,0,0,0,1|1,0,1]=4 1424 B17R2.57548 CCC(C)NCc1cc2c(cc1Br)OCO2 270004a_100000209981_100000186749 [0,1,0,0,0,1|1,0,1]=4 1425 B17R2.57548 CCC(C)NCc1cc2c(cc1Cl)OCO2 207a_100000209981_100000015535 [0,1,0,0,0,1|1,0,1]=4 1426 B17R2.57548 CCC(C)NCc1cc2c(cc1Cl)OCO2 270004a_100000209981_100000015535 [0,1,0,0,0,1|1,0,1]=4 1427 B17R2.57548 CCC(C)OCc1cc2c(cc1Br)OCO2 34a_100000187691_100011215416 [0,1,0,0,0,1|1,0,1]=4 1428 B17R2.57548 CCC(C)OCc1cc2c(cc1Br)OCO2 7a_100000187691_100000758301 [0,1,0,0,0,1|1,0,1]=4 1429 B17R2.57548 CCC(C)OCc1cc2c(cc1Br)OCO2 7a_100000210228_100009995336 [0,1,0,0,0,1|1,0,1]=4 1430 B17R2.57548 CCC(C)OCc1cc2c(cc1C)OCO2 7a_100000210228_200000112958 [0,1,0,0,0,1|1,0,1]=4 1431 B17R2.57548 CCC(C)OCc1cc2c(cc1Cl)OCO2 34a_200000238738_100011215416 [0,1,0,0,0,1|1,0,1]=4 1432 B17R2.57548 CCC(C)OCc1cc2c(cc1Cl)OCO2 7a_100000210228_100000043460 [0,1,0,0,0,1|1,0,1]=4 1433 B17R2.57548 CCC(C)OCc1cc2c(cc1Cl)OCO2 7a_200000238738_100000758301 [0,1,0,0,0,1|1,0,1]=4 1434 B17R2.57548 CCC(C)SCc1cc2c(cc1Br)OCO2 62a_100009995336_100000758301 [0,1,0,0,0,1|1,0,1]=4 1435 B17R2.57548 CCC(C)SCc1cc2c(cc1Cl)OCO2 62a_100000043460_100000758301 [0,1,0,0,0,1|1,0,1]=4 1436 B17R2.57548 CC[C@H](C)CNc1cc2c(cc1C)OCO2 2230a_100000066439_100009816398 [0,1,0,0,0,1|1,0,1]=4 1437 B17R2.57548 CC[C@H](C)CNc1cc2c(cc1C)OCO2 34a_100000066439_100009816398 [0,1,0,0,0,1|1,0,1]=4 1438 B17R2.57548 CC[C@H](C)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100009816398 [0,1,0,0,0,1|1,0,1]=4 1439 B17R2.57548 CC[C@H](C)COc1cc2c(cc1Br)OCO2 34a_100010290809_100009816398 [0,1,0,0,0,1|1,0,1]=4 1440 B17R2.57548 CC[C@H](C)COc1cc2c(cc1Br)OCO2 7a_100010290809_100009816398 [0,1,0,0,0,1|1,0,1]=4 1441 B17R2.57548 CC[C@H](C)COc1cc2c(cc1C)OCO2 34a_100000145572_100009816398 [0,1,0,0,0,1|1,0,1]=4 1442 B17R2.57548 CC[C@H](C)COc1cc2c(cc1C)OCO2 7a_100000145572_100009816398 [0,1,0,0,0,1|1,0,1]=4 1443 B17R2.57548 CC[C@H](C)CSc1cc2c(cc1N)OCO2 62a_100012557033_100009816398 [0,1,0,0,0,1|1,0,1]=4 1444 B17R2.57548 COC(C)SCc1cc2c(cc1Br)OCO2 62a_100009995336_100009879195 [0,1,0,0,0,1|2,0,0]=4 1445 B17R2.57548 COC(C)SCc1cc2c(cc1Cl)OCO2 62a_100000043460_100009879195 [0,1,0,0,0,1|2,0,0]=4 1446 B17R2.57548 C[C@@H](CO)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000059175 [0,1,0,0,0,1|0,0,2]=4 1447 B17R2.57548 C[C@@H](CO)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000059175 [0,1,0,0,0,1|0,0,2]=4 1448 B17R2.57548 C[C@@H](CO)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000059175 [0,1,0,0,0,1|0,0,2]=4 1449 B17R2.57548 C[C@@H](CO)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000059175 [0,1,0,0,0,1|0,0,2]=4 1450 B17R2.57548 C[C@H](CF)NCc1cc2c(cc1Br)OCO2 270004a_100102880703_100000186749 [0,1,0,0,0,1|1,0,1]=4 1451 B17R2.57548 C[C@H](CF)NCc1cc2c(cc1Cl)OCO2 207a_100102880703_100000015535 [0,1,0,0,0,1|1,0,1]=4 1452 B17R2.57548 C[C@H](CF)NCc1cc2c(cc1Cl)OCO2 270004a_100102880703_100000015535 [0,1,0,0,0,1|1,0,1]=4 1453 B17R2.57548 C[C@H](CO)NCc1cc2c(cc1Br)OCO2 2230a_100000737577_100009995336 [0,1,0,0,0,1|0,0,2]=4 1454 B17R2.57548 C[C@H](CO)NCc1cc2c(cc1Br)OCO2 270004a_100000737577_100000186749 [0,1,0,0,0,1|0,0,2]=4 1455 B17R2.57548 C[C@H](CO)NCc1cc2c(cc1Cl)OCO2 207a_100000737577_100000015535 [0,1,0,0,0,1|0,0,2]=4 1456 B17R2.57548 C[C@H](CO)NCc1cc2c(cc1Cl)OCO2 270004a_100000737577_100000015535 [0,1,0,0,0,1|0,0,2]=4 1457 B17R2.57548 C[C@H](CO)SCc1cc2c(cc1Br)OCO2 62a_100009995336_100016084084 [0,1,0,0,0,1|0,0,2]=4 1458 B17R2.57548 C[C@H](CO)SCc1cc2c(cc1Cl)OCO2 62a_100000043460_100016084084 [0,1,0,0,0,1|0,0,2]=4 1459 B17R2.57548 Cc1cc2c(cc1COC(C)CF)OCO2 7a_100016041109_200000112958 [0,1,0,0,0,1|1,0,1]=4 1460 B17R2.57548 Cc1cc2c(cc1NC[C@@H](C)CO)OCO2 2230a_100000066439_100000059175 [0,1,0,0,0,1|0,0,2]=4 1461 B17R2.57548 Cc1cc2c(cc1NC[C@@H](C)CO)OCO2 34a_100000066439_100000059175 [0,1,0,0,0,1|0,0,2]=4 1462 B17R2.57548 Cc1cc2c(cc1OC[C@@H](C)CO)OCO2 34a_100000145572_100000059175 [0,1,0,0,0,1|0,0,2]=4 1463 B17R2.57548 Cc1cc2c(cc1OC[C@@H](C)CO)OCO2 7a_100000145572_100000059175 [0,1,0,0,0,1|0,0,2]=4 1464 B17R2.57711 C#CC(C)NCc1cc(c2c(c1)OCO2)Br 270004a_100000707721_100000682445 [0,1,0,0,0,1|1,0,1]=4 1465 B17R2.57711 C#CC(C)NCc1cc(c2c(c1)OCO2)Cl 270004a_100000707721_100000016197 [0,1,0,0,0,1|1,0,1]=4 1466 B17R2.57711 C#CC(C)OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200000035995 [0,1,0,0,0,1|1,0,1]=4 1467 B17R2.57711 CC(C#N)OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_100000703298 [0,1,0,0,0,1|1,0,1]=4 1468 B17R2.57711 CC(CO)OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_100012180447 [0,1,0,0,0,1|0,0,2]=4 1469 B17R2.57711 CC(CO)OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_100012180447 [0,1,0,0,0,1|0,0,2]=4 1470 B17R2.57711 CCC(C)NCc1cc(c2c(c1)OCO2)Br 207a_100000209981_100000682445 [0,1,0,0,0,1|1,0,1]=4 1471 B17R2.57711 CCC(C)NCc1cc(c2c(c1)OCO2)Br 270004a_100000209981_100000682445 [0,1,0,0,0,1|1,0,1]=4 1472 B17R2.57711 CCC(C)NCc1cc(c2c(c1)OCO2)Cl 207a_100000209981_100000016197 [0,1,0,0,0,1|1,0,1]=4 1473 B17R2.57711 CCC(C)NCc1cc(c2c(c1)OCO2)Cl 270004a_100000209981_100000016197 [0,1,0,0,0,1|1,0,1]=4 1474 B17R2.57711 CCC(C)OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_100011215416 [0,1,0,0,0,1|1,0,1]=4 1475 B17R2.57711 CCC(C)OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_100000758301 [0,1,0,0,0,1|1,0,1]=4 1476 B17R2.57711 C[C@H](CF)NCc1cc(c2c(c1)OCO2)Br 207a_100102880703_100000682445 [0,1,0,0,0,1|1,0,1]=4 1477 B17R2.57711 C[C@H](CF)NCc1cc(c2c(c1)OCO2)Br 270004a_100102880703_100000682445 [0,1,0,0,0,1|1,0,1]=4 1478 B17R2.57711 C[C@H](CF)NCc1cc(c2c(c1)OCO2)Cl 207a_100102880703_100000016197 [0,1,0,0,0,1|1,0,1]=4 1479 B17R2.57711 C[C@H](CF)NCc1cc(c2c(c1)OCO2)Cl 270004a_100102880703_100000016197 [0,1,0,0,0,1|1,0,1]=4 1480 B17R2.57711 C[C@H](CO)NCc1cc(c2c(c1)OCO2)Br 207a_100000737577_100000682445 [0,1,0,0,0,1|0,0,2]=4 1481 B17R2.57711 C[C@H](CO)NCc1cc(c2c(c1)OCO2)Br 270004a_100000737577_100000682445 [0,1,0,0,0,1|0,0,2]=4 1482 B17R2.57711 C[C@H](CO)NCc1cc(c2c(c1)OCO2)Cl 207a_100000737577_100000016197 [0,1,0,0,0,1|0,0,2]=4 1483 B17R2.57711 C[C@H](CO)NCc1cc(c2c(c1)OCO2)Cl 270004a_100000737577_100000016197 [0,1,0,0,0,1|0,0,2]=4 1484 B17R2.2159 C=CCN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684720_100000210623 [0,1,0,0,0,1|2,0,0]=4 1485 B17R2.2159 C=CCN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684720_100000210623 [0,1,0,0,0,1|2,0,0]=4 1486 B17R2.2159 C=CCN(C)Cc1ccc2c(c1)OCCO2 270004a_100000225617_100000184955 [0,1,0,0,0,1|2,0,0]=4 1487 B17R2.2159 CCNC(C)Cc1ccc2c(c1)OCCO2 270004a_100015525214_200000075428 [0,1,0,0,0,1|1,0,1]=4 1488 B17R2.2159 CN(CC=O)Cc1ccc2c(c1)OCCO2 2230a_100000684720_200015260668 [0,1,0,0,0,1|1,0,0]=3 1489 B17R2.2159 CN(CC=O)Cc1ccc2c(c1)OCCO2 269982a_100000684720_200015260668 [0,1,0,0,0,1|1,0,0]=3 1490 B17R2.7413 C=CC(C)Sc1ccc2c(c1C)OCCO2 62a_100011215867_100010072848 [0,1,0,0,0,1|2,0,0]=4 1491 B17R2.9167 CC(=O)C(C)Nc1ccc2c(c1)CCCO2 2230a_100138412508_100009814033 [0,1,0,0,0,1|2,0,0]=4 1492 B17R2.9167 CC(=O)C(C)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100009814033 [0,1,0,0,0,1|1,0,0]=3 1493 B17R2.9167 CC(=O)C(C)Oc1ccc2c(c1)CCOC2 7a_100009841951_100000179758 [0,1,0,0,0,1|2,0,0]=4 1494 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)CCCO2 62a_100009814033_100011393166 [0,1,0,0,0,1|2,0,0]=4 1495 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)CCCO2 62a_100011393166_100009814033 [0,1,0,0,0,1|2,0,0]=4 1496 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)COCC2 62a_100009814033_100010128096 [0,1,0,0,0,1|2,0,0]=4 1497 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)COCC2 62a_100010128096_100009814033 [0,1,0,0,0,1|2,0,0]=4 1498 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)NCCO2 62a_100009814033_100000708519 [0,1,0,0,0,1|2,0,0]=4 1499 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)OCCC2 62a_100009814033_100010700467 [0,1,0,0,0,1|2,0,0]=4 1500 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)OCCC2 62a_100010700467_100009814033 [0,1,0,0,0,1|2,0,0]=4 1501 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)OCCN2 62a_100009814033_100012355470 [0,1,0,0,0,1|2,0,0]=4 1502 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)OCCO2 62a_100009814033_100011216881 [0,1,0,0,0,1|1,0,0]=3 1503 B17R2.9167 CC(=O)C(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100009814033 [0,1,0,0,0,1|1,0,0]=3 1504 B17R2.9167 CC(=O)N(C)Cc1ccc2c(c1)OCCO2 11a_100000684720_100015343762 [0,1,0,0,0,1|1,0,0]=3 1505 B17R2.9167 CC(=O)N(C)Cc1ccc2c(c1)OCCO2 240690a_100000684720_100015343762 [0,1,0,0,0,1|1,0,0]=3 1506 B17R2.9167 CC(=O)N(C)Cc1ccc2c(c1)OCCO2 527a_100000684720_100103153847 [0,1,0,0,0,1|1,0,0]=3 1507 B17R2.9167 CC(Cc1ccc2c(c1)OCCO2)N(C)C 270004a_100102631434_200000075428 [0,1,0,0,0,1|2,0,0]=4 1508 B17R2.9167 CC(Nc1ccc2c(c1)CCCO2)C(=O)N 2230a_100138412508_100000702099 [0,1,0,0,0,1|2,0,0]=4 1509 B17R2.9167 CC(Nc1ccc2c(c1)CCCO2)C(=O)N 34a_100138412508_100000702099 [0,1,0,0,0,1|2,0,0]=4 1510 B17R2.9167 CC(Nc1ccc2c(c1)OCCO2)C(=O)N 2230a_100020630400_100000702099 [0,1,0,0,0,1|1,0,0]=3 1511 B17R2.9167 CC(Nc1ccc2c(c1)OCCO2)C(=O)N 34a_100020630400_100000702099 [0,1,0,0,0,1|1,0,0]=3 1512 B17R2.9167 CC(Oc1ccc2c(c1)CCOC2)C(=O)N 34a_100009841951_100000702099 [0,1,0,0,0,1|2,0,0]=4 1513 B17R2.9167 CC(Oc1ccc2c(c1)CCOC2)C(=O)N 7a_100009841951_100000702099 [0,1,0,0,0,1|2,0,0]=4 1514 B17R2.9167 CC(Oc1ccc2c(c1)NCCO2)C(=O)N 34a_100020636358_100000702099 [0,1,0,0,0,1|2,0,0]=4 1515 B17R2.9167 CC(Oc1ccc2c(c1)OCCO2)C(=O)N 34a_100000234341_100000702099 [0,1,0,0,0,1|1,0,0]=3 1516 B17R2.9167 CC(Sc1ccc2c(c1)CCCO2)C(=O)N 62a_100000702099_100011393166 [0,1,0,0,0,1|2,0,0]=4 1517 B17R2.9167 CC(Sc1ccc2c(c1)CCCO2)C(=O)N 62a_100011393166_100000702099 [0,1,0,0,0,1|2,0,0]=4 1518 B17R2.9167 CC(Sc1ccc2c(c1)COCC2)C(=O)N 62a_100000702099_100010128096 [0,1,0,0,0,1|2,0,0]=4 1519 B17R2.9167 CC(Sc1ccc2c(c1)COCC2)C(=O)N 62a_100010128096_100000702099 [0,1,0,0,0,1|2,0,0]=4 1520 B17R2.9167 CC(Sc1ccc2c(c1)NCCO2)C(=O)N 62a_100000702099_100000708519 [0,1,0,0,0,1|2,0,0]=4 1521 B17R2.9167 CC(Sc1ccc2c(c1)OCCC2)C(=O)N 62a_100000702099_100010700467 [0,1,0,0,0,1|2,0,0]=4 1522 B17R2.9167 CC(Sc1ccc2c(c1)OCCC2)C(=O)N 62a_100010700467_100000702099 [0,1,0,0,0,1|2,0,0]=4 1523 B17R2.9167 CC(Sc1ccc2c(c1)OCCN2)C(=O)N 62a_100000702099_100012355470 [0,1,0,0,0,1|2,0,0]=4 1524 B17R2.9167 CC(Sc1ccc2c(c1)OCCO2)C(=O)N 62a_100000702099_100011216881 [0,1,0,0,0,1|1,0,0]=3 1525 B17R2.9167 CC(Sc1ccc2c(c1)OCCO2)C(=O)N 62a_100011216881_100000702099 [0,1,0,0,0,1|1,0,0]=3 1526 B17R2.9167 NC(=O)C(F)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100009813875 [0,1,0,0,0,1|2,0,0]=4 1527 B17R2.9167 NC(=O)C(F)Nc1ccc2c(c1)OCCO2 34a_100020630400_100009813875 [0,1,0,0,0,1|2,0,0]=4 1528 B17R2.9167 NC(=O)C(F)Oc1ccc2c(c1)OCCO2 34a_100000234341_100009813875 [0,1,0,0,0,1|2,0,0]=4 1529 B17R2.9167 NC(=O)C(F)Sc1ccc2c(c1)OCCO2 62a_100009813875_100011216881 [0,1,0,0,0,1|2,0,0]=4 1530 B17R2.9167 NC(=O)C(F)Sc1ccc2c(c1)OCCO2 62a_100011216881_100009813875 [0,1,0,0,0,1|2,0,0]=4 1531 B17R2.9167 O=C([O-])C(F)Nc1ccc2c(c1)OCCO2 34a_100020630400_100020610796 [0,1,0,0,0,1|2,0,0]=4 1532 B17R2.9167 O=C([O-])C(F)Oc1ccc2c(c1)OCCO2 34a_100000234341_100020610796 [0,1,0,0,0,1|2,0,0]=4 1533 B17R2.9167 O=C([O-])C(F)Sc1ccc2c(c1)OCCO2 62a_100011216881_100020610796 [0,1,0,0,0,1|2,0,0]=4 1534 B17R2.9167 O=C([O-])C(F)Sc1ccc2c(c1)OCCO2 62a_100020610796_100011216881 [0,1,0,0,0,1|2,0,0]=4 1535 B17R2.48339 O=CC(C=O)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000736813 [0,1,0,0,0,1|1,0,1]=4 1536 B17R2.48339 O=CC(C=O)Nc1ccc2c(c1)OCCO2 34a_100020630400_100000736813 [0,1,0,0,0,1|1,0,1]=4 1537 B17R2.48339 O=CC(C=O)Oc1ccc2c(c1)OCCO2 34a_100000234341_100000736813 [0,1,0,0,0,1|1,0,1]=4 1538 B17R2.48339 O=CC(C=O)Sc1ccc2c(c1)OCCO2 62a_100000736813_100011216881 [0,1,0,0,0,1|1,0,1]=4 1539 B17R2.48339 O=CC(C=O)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000736813 [0,1,0,0,0,1|1,0,1]=4 1540 B17R2.10085 C/C=C/CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100102629194 [0,2,0,0,0,0|2,0,0]=4 1541 B17R2.10085 C=CCCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000754431 [0,2,0,0,0,0|2,0,0]=4 1542 B17R2.10085 C=CCCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000754431 [0,2,0,0,0,0|2,0,0]=4 1543 B17R2.10085 C=CCCN(C)Cc1ccc2c(c1)OCO2 269982a_100020639649_100000189651 [0,2,0,0,0,0|2,0,0]=4 1544 B17R2.10085 CC=CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000070051 [0,2,0,0,0,0|2,0,0]=4 1545 B17R2.10085 CCNCC(C)Cc1ccc2c(c1)OCO2 270004a_100015525214_100000017537 [0,2,0,0,0,0|1,0,1]=4 1546 B17R2.45097 C=C(C)CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000748629 [0,2,0,0,0,0|2,0,0]=4 1547 B17R2.45097 C=C(C)CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000748629 [0,2,0,0,0,0|2,0,0]=4 1548 B17R2.45097 C=C(C)CN(C)Cc1ccc2c(c1)OCO2 269982a_100000225649_100000189651 [0,2,0,0,0,0|2,0,0]=4 1549 B17R2.45097 C=C(F)CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100009893438 [0,2,0,0,0,0|2,0,0]=4 1550 B17R2.45097 C=C(F)CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100009893438 [0,2,0,0,0,0|2,0,0]=4 1551 B17R2.45097 CC(=O)OC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100009818208 [0,2,0,0,0,0|2,0,0]=4 1552 B17R2.45097 CC(=O)OC(C)Sc1ccc2c(c1)CCO2 62a_100009818208_100000729065 [0,2,0,0,0,0|2,0,0]=4 1553 B17R2.45097 CC(=O)OC(C)Sc1ccc2c(c1)OCC2 62a_100009818208_100009818566 [0,2,0,0,0,0|2,0,0]=4 1554 B17R2.45097 CC(=O)OC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100009818208 [0,2,0,0,0,0|2,0,0]=4 1555 B17R2.45097 CC(Cc1ccc2c(c1)OCO2)CN(C)C 270004a_100102631434_100000017537 [0,2,0,0,0,0|1,0,1]=4 1556 B17R2.45097 CN(CC(=O)N)Cc1ccc2c(c1)CCO2 270004a_100000739694_100011218456 [0,2,0,0,0,0|2,0,0]=4 1557 B17R2.45097 CN(CC(=O)N)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000747473 [0,2,0,0,0,0|1,0,0]=3 1558 B17R2.45097 CN(CC(=O)N)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000187820 [0,2,0,0,0,0|1,0,0]=3 1559 B17R2.45097 CN(CC(=O)O)Cc1ccc2c(c1)OCO2 269956a_100000746989_100000189651 [0,2,0,0,0,0|1,0,0]=3 1560 B17R2.45097 CN(CC(=O)[O-])Cc1ccc2c(c1)OCO2 269982a_100000186720_100020667443 [0,2,0,0,0,0|1,0,0]=3 1561 B17R2.45097 CN(Cc1ccc2c(c1)OCO2)C[N+](=O)[O-] 269982a_100000186720_100000761209 [0,2,0,0,0,0|1,0,1]=4 1562 B17R2.45097 NC(=O)CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000187820 [0,2,0,0,0,0|1,0,1]=4 1563 B17R2.45097 O=C([O-])CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100020667443 [0,2,0,0,0,0|1,0,1]=4 1564 B17R2.49559 C=CCN(C)Cc1cc(c2c(c1)OCO2)Br 270004a_100000225617_100000682445 [0,2,0,0,0,0|2,0,0]=4 1565 B17R2.49559 C=CCN(C)Cc1cc(c2c(c1)OCO2)Cl 270004a_100000225617_100000016197 [0,2,0,0,0,0|2,0,0]=4 1566 B17R2.50473 C=CCN(C)Cc1cc2c(cc1Br)OCO2 2230a_100000225617_100009995336 [0,2,0,0,0,0|2,0,0]=4 1567 B17R2.50473 C=CCN(C)Cc1cc2c(cc1Br)OCO2 269982a_100000225617_100009995336 [0,2,0,0,0,0|2,0,0]=4 1568 B17R2.50473 C=CCN(C)Cc1cc2c(cc1Br)OCO2 26a_100000225617_100010290809 [0,2,0,0,0,0|2,0,0]=4 1569 B17R2.50473 C=CCN(C)Cc1cc2c(cc1Br)OCO2 270004a_100000225617_100000186749 [0,2,0,0,0,0|2,0,0]=4 1570 B17R2.50473 C=CCN(C)Cc1cc2c(cc1C)OCO2 269982a_100000225617_200000112958 [0,2,0,0,0,0|2,0,0]=4 1571 B17R2.50473 C=CCN(C)Cc1cc2c(cc1Cl)OCO2 269982a_100000225617_100000043460 [0,2,0,0,0,0|2,0,0]=4 1572 B17R2.50473 C=CCN(C)Cc1cc2c(cc1Cl)OCO2 270004a_100000225617_100000015535 [0,2,0,0,0,0|2,0,0]=4 1573 B17R2.20012 CC(=O)C(C)C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000179758 [0,2,0,0,0,0|1,0,1]=4 1574 B17R2.20012 CC(=O)C(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000179758 [0,2,0,0,0,0|0,0,1]=3 1575 B17R2.20012 CC(C(=O)N)C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000702099 [0,2,0,0,0,0|1,0,1]=4 1576 B17R2.20012 CC(C(=O)N)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000702099 [0,2,0,0,0,0|0,0,1]=3 1577 B17R2.20012 NC(=O)C(F)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100009813875 [0,2,0,0,0,0|1,0,1]=4 1578 B17R2.20012 O=C([O-])C(F)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100020610796 [0,2,0,0,0,0|1,0,1]=4 1579 B17R2.57724 C=CC(C)N(CC)c1ccc2c(c1)OCO2 269982a_200000219546_100011215867 [0,2,0,0,0,0|2,0,0]=4 1580 B17R2.4858 CC(=O)C(C)Nc1ccc2c(c1)CC(O2)C 2230a_100102713350_100009814033 [0,2,0,0,0,0|2,0,0]=4 1581 B17R2.4858 CC1Cc2cc(ccc2O1)NC(C)C(=O)N 2230a_100102713350_100000702099 [0,2,0,0,0,0|2,0,0]=4 1582 B17R2.4858 CC1Cc2cc(ccc2O1)NC(C)C(=O)N 34a_100102713350_100000702099 [0,2,0,0,0,0|2,0,0]=4 1583 B17R2.22726 CC(=O)C(C)Nc1cc2c(cc1C)OCO2 2230a_100000066439_100009814033 [0,2,0,0,0,0|1,0,0]=3 1584 B17R2.22726 CC(=O)C(C)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000179758 [0,2,0,0,0,0|1,0,0]=3 1585 B17R2.22726 CC(=O)C(C)Oc1cc2c(cc1C)OCO2 7a_100000145572_100000179758 [0,2,0,0,0,0|1,0,0]=3 1586 B17R2.22726 CC(=O)C(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100009814033 [0,2,0,0,0,0|1,0,0]=3 1587 B17R2.22726 CC(Nc1cc2c(cc1Cl)OCO2)C(=O)N 34a_100000234339_100000702099 [0,2,0,0,0,0|1,0,0]=3 1588 B17R2.22726 CC(Oc1cc2c(cc1Br)OCO2)C(=O)N 34a_100010290809_100000702099 [0,2,0,0,0,0|1,0,0]=3 1589 B17R2.22726 CC(Oc1cc2c(cc1Br)OCO2)C(=O)N 7a_100010290809_100000702099 [0,2,0,0,0,0|1,0,0]=3 1590 B17R2.22726 CC(Sc1cc2c(cc1N)OCO2)C(=O)N 62a_100012557033_100000702099 [0,2,0,0,0,0|1,0,0]=3 1591 B17R2.22726 Cc1cc2c(cc1NC(C)C(=O)N)OCO2 2230a_100000066439_100000702099 [0,2,0,0,0,0|1,0,0]=3 1592 B17R2.22726 Cc1cc2c(cc1NC(C)C(=O)N)OCO2 34a_100000066439_100000702099 [0,2,0,0,0,0|1,0,0]=3 1593 B17R2.22726 Cc1cc2c(cc1NC(F)C(=O)N)OCO2 2230a_100000066439_100009813875 [0,2,0,0,0,0|2,0,0]=4 1594 B17R2.22726 Cc1cc2c(cc1NC(F)C(=O)N)OCO2 34a_100000066439_100009813875 [0,2,0,0,0,0|2,0,0]=4 1595 B17R2.22726 Cc1cc2c(cc1NC(F)C(=O)[O-])OCO2 34a_100000066439_100020610796 [0,2,0,0,0,0|2,0,0]=4 1596 B17R2.22726 Cc1cc2c(cc1OC(C)C(=O)N)OCO2 34a_100000145572_100000702099 [0,2,0,0,0,0|1,0,0]=3 1597 B17R2.22726 Cc1cc2c(cc1OC(C)C(=O)N)OCO2 7a_100000145572_100000702099 [0,2,0,0,0,0|1,0,0]=3 1598 B17R2.22726 Cc1cc2c(cc1OC(F)C(=O)N)OCO2 34a_100000145572_100009813875 [0,2,0,0,0,0|2,0,0]=4 1599 B17R2.22726 Cc1cc2c(cc1OC(F)C(=O)N)OCO2 7a_100000145572_100009813875 [0,2,0,0,0,0|2,0,0]=4 1600 B17R2.22726 Cc1cc2c(cc1OC(F)C(=O)[O-])OCO2 34a_100000145572_100020610796 [0,2,0,0,0,0|2,0,0]=4 1601 B17R2.22726 NC(=O)C(F)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100009813875 [0,2,0,0,0,0|2,0,0]=4 1602 B17R2.22726 NC(=O)C(F)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100009813875 [0,2,0,0,0,0|2,0,0]=4 1603 B17R2.22726 NC(=O)C(F)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100009813875 [0,2,0,0,0,0|2,0,0]=4 1604 B17R2.22726 NC(=O)C(F)Sc1cc2c(cc1N)OCO2 62a_100012557033_100009813875 [0,2,0,0,0,0|2,0,0]=4 1605 B17R2.22726 Nc1cc2c(cc1SC(F)C(=O)[O-])OCO2 62a_100012557033_100020610796 [0,2,0,0,0,0|2,0,0]=4 1606 B17R2.22726 O=C([O-])C(F)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100020610796 [0,2,0,0,0,0|2,0,0]=4 1607 B17R2.22726 O=C([O-])C(F)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100020610796 [0,2,0,0,0,0|2,0,0]=4 1608 B17R2.25203 CC(=O)C(C)Sc1ccc2c(c1)OCC2=O 62a_100009814033_100000686717 [0,2,0,0,0,0|2,0,0]=4 1609 B17R2.25203 CC(=O)C(C)Sc1ccc2c(c1)OCC2N 62a_100009814033_100020628175 [0,2,0,0,0,0|2,0,0]=4 1610 B17R2.25203 CC(=O)C(C)Sc1ccc2c(c1)OCC2N 62a_100020628175_100009814033 [0,2,0,0,0,0|2,0,0]=4 1611 B17R2.25203 CC(Sc1ccc2c(c1)OCC2=O)C(=O)N 62a_100000702099_100000686717 [0,2,0,0,0,0|2,0,0]=4 1612 B17R2.25203 CC(Sc1ccc2c(c1)OCC2N)C(=O)N 62a_100000702099_100020628175 [0,2,0,0,0,0|2,0,0]=4 1613 B17R2.25203 CC(Sc1ccc2c(c1)OCC2N)C(=O)N 62a_100020628175_100000702099 [0,2,0,0,0,0|2,0,0]=4 1614 B17R2.45616 CN(Cc1ccc2c(c1)OCO2)S(=O)(=O)C 40a_100000186720_100000738038 [0,2,0,0,0,0|2,0,0]=4 1615 B17R2.48517 CCC(Nc1ccc2c(c1)CCO2)C(=O)N 2230a_100000736984_100000750255 [0,2,0,0,0,0|2,0,0]=4 1616 B17R2.48517 CCC(Nc1ccc2c(c1)CCO2)C(=O)N 34a_100000736984_100000750255 [0,2,0,0,0,0|2,0,0]=4 1617 B17R2.48517 CCC(Nc1ccc2c(c1)OCO2)C(=O)N 2230a_100000209953_100000750255 [0,2,0,0,0,0|1,0,0]=3 1618 B17R2.48517 CCC(Nc1ccc2c(c1)OCO2)C(=O)N 34a_100000209953_100000750255 [0,2,0,0,0,0|1,0,0]=3 1619 B17R2.48517 CCC(Oc1ccc2c(c1)OCO2)C(=O)N 34a_100000210298_100000750255 [0,2,0,0,0,0|1,0,0]=3 1620 B17R2.48517 CCC(Sc1ccc2c(c1)CCO2)C(=O)N 62a_100000729065_100000750255 [0,2,0,0,0,0|2,0,0]=4 1621 B17R2.48517 CCC(Sc1ccc2c(c1)CCO2)C(=O)N 62a_100000750255_100000729065 [0,2,0,0,0,0|2,0,0]=4 1622 B17R2.48517 CCC(Sc1ccc2c(c1)OCC2)C(=O)N 62a_100000750255_100009818566 [0,2,0,0,0,0|2,0,0]=4 1623 B17R2.48517 CCC(Sc1ccc2c(c1)OCC2)C(=O)N 62a_100009818566_100000750255 [0,2,0,0,0,0|2,0,0]=4 1624 B17R2.155584 CC(=O)C(C)Sc1ccc2c(c1C)OCO2 62a_100010335860_100009814033 [0,2,0,0,0,0|1,0,0]=3 1625 B17R2.155584 CC(=O)C(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100009814033 [0,2,0,0,0,0|1,0,0]=3 1626 B17R2.155584 CC(Sc1ccc2c(c1F)OCO2)C(=O)N 62a_100010223184_100000702099 [0,2,0,0,0,0|1,0,0]=3 1627 B17R2.155584 Cc1c(ccc2c1OCO2)SC(C)C(=O)N 62a_100010335860_100000702099 [0,2,0,0,0,0|1,0,0]=3 1628 B17R2.155584 Cc1c(ccc2c1OCO2)SC(F)C(=O)N 62a_100010335860_100009813875 [0,2,0,0,0,0|2,0,0]=4 1629 B17R2.155584 Cc1c(ccc2c1OCO2)SC(F)C(=O)[O-] 62a_100010335860_100020610796 [0,2,0,0,0,0|2,0,0]=4 1630 B17R2.155584 NC(=O)C(F)Sc1ccc2c(c1F)OCO2 62a_100010223184_100009813875 [0,2,0,0,0,0|2,0,0]=4 1631 B17R2.155584 O=C([O-])C(F)Sc1ccc2c(c1F)OCO2 62a_100010223184_100020610796 [0,2,0,0,0,0|2,0,0]=4 1632 B17R2.186986 CC(=O)C(C)Sc1ccc2c(c1)C(=O)CO2 62a_100009814033_100000752586 [0,2,0,0,0,0|2,0,0]=4 1633 B17R2.186986 CC(Sc1ccc2c(c1)C(=O)CO2)C(=O)N 62a_100000702099_100000752586 [0,2,0,0,0,0|2,0,0]=4 1634 B17R2.291802 CC(=O)C(C)(C)Sc1ccc2c(c1)CCO2 62a_100000075568_100000729065 [0,2,0,0,0,0|2,0,0]=4 1635 B17R2.291802 CC(=O)C(C)(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000075568 [0,2,0,0,0,0|2,0,0]=4 1636 B17R2.291802 CC(=O)C(C)(C)Sc1ccc2c(c1)OCC2 62a_100000075568_100009818566 [0,2,0,0,0,0|2,0,0]=4 1637 B17R2.291802 CC(=O)C(C)(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000075568 [0,2,0,0,0,0|2,0,0]=4 1638 B17R2.291802 CC(C)(Nc1ccc2c(c1)CCO2)C(=O)N 2230a_100000736984_100000702505 [0,2,0,0,0,0|2,0,0]=4 1639 B17R2.291802 CC(C)(Nc1ccc2c(c1)CCO2)C(=O)N 34a_100000736984_100000702505 [0,2,0,0,0,0|2,0,0]=4 1640 B17R2.291802 CC(C)(Nc1ccc2c(c1)OCO2)C(=O)N 2230a_100000209953_100000702505 [0,2,0,0,0,0|1,0,0]=3 1641 B17R2.291802 CC(C)(Nc1ccc2c(c1)OCO2)C(=O)N 34a_100000209953_100000702505 [0,2,0,0,0,0|1,0,0]=3 1642 B17R2.291802 CC(C)(Oc1ccc2c(c1)OCO2)C(=O)N 34a_100000210298_100000702505 [0,2,0,0,0,0|1,0,0]=3 1643 B17R2.291802 CC(C)(Sc1ccc2c(c1)CCO2)C(=O)N 62a_100000702505_100000729065 [0,2,0,0,0,0|2,0,0]=4 1644 B17R2.291802 CC(C)(Sc1ccc2c(c1)CCO2)C(=O)N 62a_100000729065_100000702505 [0,2,0,0,0,0|2,0,0]=4 1645 B17R2.291802 CC(C)(Sc1ccc2c(c1)OCC2)C(=O)N 62a_100000702505_100009818566 [0,2,0,0,0,0|2,0,0]=4 1646 B17R2.291802 CC(C)(Sc1ccc2c(c1)OCC2)C(=O)N 62a_100009818566_100000702505 [0,2,0,0,0,0|2,0,0]=4 1647 B17R2.291802 O=C([O-])C(F)(F)Nc1ccc2c(c1)OCO2 34a_100000209953_100020612412 [0,2,0,0,0,0|2,0,0]=4 1648 B17R2.291802 O=C([O-])C(F)(F)Oc1ccc2c(c1)OCO2 34a_100000210298_100020612412 [0,2,0,0,0,0|2,0,0]=4 1649 B17R2.19485 Cc1c(ccc2c1OCO2)SC(C=O)C=O 62a_100010335860_100000736813 [0,2,0,0,0,0|1,0,1]=4 1650 B17R2.19485 O=CC(C=O)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000736813 [0,2,0,0,0,0|1,0,1]=4 1651 B17R2.44430 Cc1cc2c(cc1NC(C=O)C=O)OCO2 2230a_100000066439_100000736813 [0,2,0,0,0,0|1,0,1]=4 1652 B17R2.44430 Cc1cc2c(cc1NC(C=O)C=O)OCO2 34a_100000066439_100000736813 [0,2,0,0,0,0|1,0,1]=4 1653 B17R2.44430 Cc1cc2c(cc1OC(C=O)C=O)OCO2 34a_100000145572_100000736813 [0,2,0,0,0,0|1,0,1]=4 1654 B17R2.44430 Nc1cc2c(cc1SC(C=O)C=O)OCO2 62a_100012557033_100000736813 [0,2,0,0,0,0|1,0,1]=4 1655 B17R2.44430 O=CC(C=O)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100000736813 [0,2,0,0,0,0|1,0,1]=4 1656 B17R2.44430 O=CC(C=O)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100000736813 [0,2,0,0,0,0|1,0,1]=4 1657 B17R2.87673 C=CC(C)Sc1ccc2c(c1)OC(O2)(C)C 62a_100011215867_100010187540 [0,2,0,0,0,0|2,0,0]=4 1658 B17R2.87673 C=CC(C)Sc1ccc2c(c1)OC(O2)(F)F 62a_100011215867_100009813929 [0,2,0,0,0,0|2,0,0]=4 1659 B15R2.16644 CC1Cc2ccc(cc2C1=O)SCF 62a_100000694082_100015361967 [0,0,1,1,0,0|1,1,0]=4 1660 B15R2.16644 CC1Cc2ccc(cc2C1=O)SCF 62a_100015361967_100000694082 [0,0,1,1,0,0|1,1,0]=4 1661 B15R2.16644 CCOc1ccc2c(c1)C(=O)N(C2)C 34a_100010264224_100000210202 [0,0,1,1,0,0|2,0,0]=4 1662 B15R2.16644 CCOc1ccc2c(c1)C(=O)N(C2)C 7a_100010264224_100000210202 [0,0,1,1,0,0|2,0,0]=4 1663 B15R2.16644 CCSc1ccc2c(c1)C(=O)C(C2)C 62a_100000210202_100000694082 [0,0,1,1,0,0|1,1,0]=4 1664 B15R2.16644 CCSc1ccc2c(c1)C(=O)C(C2)C 62a_100000694082_100000210202 [0,0,1,1,0,0|1,1,0]=4 1665 B15R2.16644 CN1Cc2ccc(cc2C1=O)OCF 34a_100010264224_100015361967 [0,0,1,1,0,0|2,0,0]=4 1666 B15R2.16644 CN1Cc2ccc(cc2C1=O)OCF 7a_100010264224_100015361967 [0,0,1,1,0,0|2,0,0]=4 1667 B15R2.54452 CC1Cc2cc(ccc2C1=O)SCF 62a_100010169280_100015361967 [0,0,1,1,0,0|1,1,0]=4 1668 B15R2.54452 CC1Cc2cc(ccc2C1=O)SCF 62a_100015361967_100010169280 [0,0,1,1,0,0|1,1,0]=4 1669 B15R2.54452 CCNc1ccc2c(c1)CC(C2=O)C 27a_100015525214_100010169280 [0,0,1,1,0,0|2,0,0]=4 1670 B15R2.54452 CCSc1ccc2c(c1)CC(C2=O)C 62a_100000210202_100010169280 [0,0,1,1,0,0|1,1,0]=4 1671 B15R2.54452 CCSc1ccc2c(c1)CC(C2=O)C 62a_100010169280_100000210202 [0,0,1,1,0,0|1,1,0]=4 1672 B17R3.3114 CC1CCN1Cc2ccc3c(c2)OCO3 269982a_100000755817_100000189651 [0,0,0,1,0,1|1,0,1]=4 1673 B17R3.3114 CC1CCN1Cc2ccc3c(c2)OCO3 34a_100000755817_100000189651 [0,0,0,1,0,1|1,0,1]=4 1674 B17R3.4900 F[C@@H]1C[C@H]1NCc2ccc3c(c2)OCO3 34a_100025746932_100000189651 [0,0,0,1,0,1|1,0,1]=4 1675 B17R3.7372 c1cc2c(cc1CNC3CCC3)OCO2 270004a_100000210006_100000241760 [0,0,0,1,0,1|1,0,1]=4 1676 B17R3.7372 c1cc2c(cc1CNC3CCC3)OCO2 34a_100000210006_100000749161 [0,0,0,1,0,1|1,0,1]=4 1677 B17R3.7372 c1cc2c(cc1CNC3CCC3)OCO2 34a_100000749019_100000189651 [0,0,0,1,0,1|1,0,1]=4 1678 B17R3.7372 c1cc2c(cc1CNC3COC3)OCO2 34a_100000210006_100009818527 [0,0,0,1,0,1|0,0,2]=4 1679 B17R3.7372 c1cc2c(cc1COC3CCC3)OCO2 34a_100000210967_100000749161 [0,0,0,1,0,1|1,0,1]=4 1680 B17R3.7372 c1cc2c(cc1COC3CCC3)OCO2 34a_100000748187_100000189651 [0,0,0,1,0,1|1,0,1]=4 1681 B17R3.7372 c1cc2c(cc1COC3COC3)OCO2 34a_100000210967_100009818527 [0,0,0,1,0,1|0,0,2]=4 1682 B17R3.7372 c1cc2c(cc1COC3CSC3)OCO2 7a_100000072292_100000189651 [0,0,0,1,0,1|0,1,1]=4 1683 B17R3.7372 c1cc2c(cc1NCC3CCC3)OCO2 2230a_100000209953_100000763275 [0,0,0,1,0,1|1,0,1]=4 1684 B17R3.7372 c1cc2c(cc1NCC3CCC3)OCO2 34a_100000209953_100000763275 [0,0,0,1,0,1|1,0,1]=4 1685 B17R3.7372 c1cc2c(cc1NCC3CCO3)OCO2 2230a_100000209953_100000103362 [0,0,0,1,0,1|2,0,0]=4 1686 B17R3.7372 c1cc2c(cc1NCC3CCO3)OCO2 34a_100000209953_100000103362 [0,0,0,1,0,1|2,0,0]=4 1687 B17R3.7372 c1cc2c(cc1NCC3COC3)OCO2 2230a_100000209953_100010264016 [0,0,0,1,0,1|0,0,2]=4 1688 B17R3.7372 c1cc2c(cc1NCC3COC3)OCO2 34a_100000209953_100010264016 [0,0,0,1,0,1|0,0,2]=4 1689 B17R3.7372 c1cc2c(cc1OCC3CCC3)OCO2 34a_100000210298_100000763275 [0,0,0,1,0,1|1,0,1]=4 1690 B17R3.7372 c1cc2c(cc1OCC3CCO3)OCO2 34a_100000210298_100000103362 [0,0,0,1,0,1|2,0,0]=4 1691 B17R3.7372 c1cc2c(cc1OCC3COC3)OCO2 34a_100000210298_100010264016 [0,0,0,1,0,1|0,0,2]=4 1692 B17R3.220775 CC1(CC1)OCc2ccc3c(c2)OCO3 7a_100011725673_100000189651 [0,0,0,1,0,1|1,0,1]=4 1693 B17R3.220775 CC1(CO1)CNc2ccc3c(c2)OCO3 34a_100000209953_100000760498 [0,0,0,1,0,1|0,0,2]=4 1694 B17R3.220775 CC1(CO1)COc2ccc3c(c2)OCO3 34a_100000210298_100000760498 [0,0,0,1,0,1|0,0,2]=4 1695 B17R3.21035 C1=CCN(C1)Cc2ccc3c(c2)OCO3 269982a_100015195280_100000189651 [0,1,0,1,0,0|2,0,0]=4 1696 B17R3.32479 O=C1CC(C1)Sc2ccc3c(c2)CCO3 62a_100009894365_100000729065 [0,1,0,1,0,0|2,0,0]=4 1697 B17R3.32479 O=C1CC(C1)Sc2ccc3c(c2)OCC3 62a_100009894365_100009818566 [0,1,0,1,0,0|2,0,0]=4 1698 B17R3.102678 CC1Cc2c(cc3c(c2O)CCC3)C1=O 271570a_203496583355_100010174996 [0,1,0,1,0,0|2,0,0]=4 1699 B13R1.3088 CNC(C)c1ccc(c(c1)O)OC 269862a_106832991636_100000732934 [0,0,1,0,1,0|2,0,0]=4 1700 B13R2.467 O=CCSc1ccc2c(c1)CC2 62a_100009818592_200015260668 [1,0,0,0,1,0|2,0,0]=4 1701 B13R2.467 O=CCSc1ccc2c(c1)CC2 62a_200015260668_100009818592 [1,0,0,0,1,0|2,0,0]=4 1702 B13R2.430 C=C(C)c1ccc2c(c1)CCO2 271570a_100000694244_100000729065 [1,0,0,0,1,0|1,0,1]=4 1703 B13R2.430 C=C(C)c1ccc2c(c1)OCC2 271570a_100000694244_100009818566 [1,0,0,0,1,0|1,0,1]=4 1704 B13R2.430 C=C(C)c1ccc2c(c1)OCO2 271570a_100000694244_100000688060 [1,0,0,0,1,0|0,0,1]=3 1705 B13R2.430 CC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_200000210301 [1,0,0,0,1,0|1,0,1]=4 1706 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000210301 [1,0,0,0,1,0|0,0,1]=3 1707 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_200025704644 [1,0,0,0,1,0|1,0,1]=4 1708 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200025704644 [1,0,0,0,1,0|0,0,1]=3 1709 B15R1.3779 C#CC(C)NCc1ccc(c(c1)O)OC 34a_100000740000_200000035995 [0,0,1,0,0,1|1,0,1]=4 1710 B15R1.3779 C=CC(C)OCc1ccc(c(c1)Br)OC 34a_100000695699_200011397701 [0,0,1,0,0,1|2,0,0]=4 1711 B15R1.3779 C=CC(C)OCc1ccc(c(c1)C)OC 34a_100000695699_200011290836 [0,0,1,0,0,1|2,0,0]=4 1712 B15R1.3779 C=CC(C)OCc1ccc(c(c1)Cl)OC 34a_100000695699_100000693707 [0,0,1,0,0,1|2,0,0]=4 1713 B15R1.3779 C=CC(C)OCc1ccc(c(c1)F)OC 34a_100000695699_100000189595 [0,0,1,0,0,1|2,0,0]=4 1714 B15R1.3779 C=CC(C)SCc1ccc(c(c1)Br)OC 62a_100011215867_200011397701 [0,0,1,0,0,1|2,0,0]=4 1715 B15R1.3779 C=CC(C)SCc1ccc(c(c1)C)OC 62a_100011215867_200011290836 [0,0,1,0,0,1|2,0,0]=4 1716 B15R1.3779 C=CC(C)SCc1ccc(c(c1)Cl)OC 62a_100011215867_100000693707 [0,0,1,0,0,1|2,0,0]=4 1717 B15R1.3779 C=CC(C)SCc1ccc(c(c1)F)OC 62a_100011215867_100000189595 [0,0,1,0,0,1|2,0,0]=4 1718 B15R1.3779 C=CC(O)CNc1ccc(c(c1)O)OC 34a_100000211920_100000730141 [0,0,1,0,0,1|2,0,0]=4 1719 B15R1.3779 C=CC(O)CSc1ccc(c(c1)O)OC 62a_100000730141_100009816560 [0,0,1,0,0,1|2,0,0]=4 1720 B15R1.3779 CCC(C)CNc1ccc(c(c1)O)OC 34a_100000211920_100000748023 [0,0,1,0,0,1|1,0,1]=4 1721 B15R1.3779 CCC(C)CSc1ccc(c(c1)O)OC 62a_100000748023_100009816560 [0,0,1,0,0,1|1,0,1]=4 1722 B15R1.3779 CCC(C)NCc1ccc(c(c1)O)OC 34a_100000740000_100011215416 [0,0,1,0,0,1|1,0,1]=4 1723 B15R1.3779 CC[C@H](C)CNc1ccc(c(c1)O)OC 34a_100000211920_100009816398 [0,0,1,0,0,1|1,0,1]=4 1724 B15R1.3779 CC[C@H](C)CSc1ccc(c(c1)O)OC 62a_100009816398_100009816560 [0,0,1,0,0,1|1,0,1]=4 1725 B15R1.3779 COc1ccc(cc1O)CNC(C)CO 34a_100000740000_100012180447 [0,0,1,0,0,1|0,0,2]=4 1726 B15R1.3779 COc1ccc(cc1O)NC[C@@H](C)CO 34a_100000211920_100000059175 [0,0,1,0,0,1|0,0,2]=4 1727 B15R1.3779 COc1ccc(cc1O)SC[C@@H](C)CO 62a_100000059175_100009816560 [0,0,1,0,0,1|0,0,2]=4 1728 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)O 34a_100000185554_200000035995 [0,0,1,0,0,1|1,0,1]=4 1729 B15R1.4039 C=CC(C)OCc1ccc(c(c1)OC)Br 34a_100000695699_100010110085 [0,0,1,0,0,1|2,0,0]=4 1730 B15R1.4039 C=CC(C)OCc1ccc(c(c1)OC)Cl 34a_100000695699_200010214485 [0,0,1,0,0,1|2,0,0]=4 1731 B15R1.4039 C=CC(C)OCc1ccc(c(c1)OC)F 34a_100000695699_100012349856 [0,0,1,0,0,1|2,0,0]=4 1732 B15R1.4039 C=CC(C)SCc1ccc(c(c1)OC)Br 62a_100011215867_100010110085 [0,0,1,0,0,1|2,0,0]=4 1733 B15R1.4039 C=CC(C)SCc1ccc(c(c1)OC)Cl 62a_100011215867_200010214485 [0,0,1,0,0,1|2,0,0]=4 1734 B15R1.4039 C=CC(C)SCc1ccc(c(c1)OC)F 62a_100011215867_100012349856 [0,0,1,0,0,1|2,0,0]=4 1735 B15R1.4039 C=CC(O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000730141 [0,0,1,0,0,1|2,0,0]=4 1736 B15R1.4039 C=CC(O)CSc1ccc(c(c1)OC)O 62a_100000730141_100000694246 [0,0,1,0,0,1|2,0,0]=4 1737 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748023 [0,0,1,0,0,1|1,0,1]=4 1738 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)O 62a_100000748023_100000694246 [0,0,1,0,0,1|1,0,1]=4 1739 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)O 34a_100000185554_100011215416 [0,0,1,0,0,1|1,0,1]=4 1740 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)O 34a_100000726020_100009816398 [0,0,1,0,0,1|1,0,1]=4 1741 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)O 62a_100009816398_100000694246 [0,0,1,0,0,1|1,0,1]=4 1742 B15R1.4039 COc1cc(ccc1O)CNC(C)CO 34a_100000185554_100012180447 [0,0,1,0,0,1|0,0,2]=4 1743 B15R1.4039 COc1cc(ccc1O)NC[C@@H](C)CO 34a_100000726020_100000059175 [0,0,1,0,0,1|0,0,2]=4 1744 B15R1.4039 COc1cc(ccc1O)SC[C@@H](C)CO 62a_100000059175_100000694246 [0,0,1,0,0,1|0,0,2]=4 1745 B15R2.352 C=CCNc1ccc2c(c1)OCCO2 2230a_100020630400_100000210623 [1,0,0,0,0,1|2,0,0]=4 1746 B15R2.352 C=CCNc1ccc2c(c1)OCCO2 34a_100020630400_100015514636 [1,0,0,0,0,1|2,0,0]=4 1747 B15R2.352 C=CCOc1ccc2c(c1)OCCO2 34a_100000234341_100015514636 [1,0,0,0,0,1|2,0,0]=4 1748 B15R2.352 C=CCSc1ccc2c(c1)OCCO2 62a_100000210623_100011216881 [1,0,0,0,0,1|2,0,0]=4 1749 B15R2.352 C=CCSc1ccc2c(c1)OCCO2 62a_100011216881_100000210623 [1,0,0,0,0,1|2,0,0]=4 1750 B15R2.352 CCCCc1ccc2c(c1)OCCO2 271570a_100020621405_100000184379 [1,0,0,0,0,1|1,0,1]=4 1751 B15R2.352 O=CCNc1ccc2c(c1)CCCO2 2230a_100138412508_200015260668 [1,0,0,0,0,1|2,0,0]=4 1752 B15R2.352 O=CCNc1ccc2c(c1)CCCO2 34a_100138412508_200009817547 [1,0,0,0,0,1|2,0,0]=4 1753 B15R2.352 O=CCNc1ccc2c(c1)OCCO2 2230a_100020630400_200015260668 [1,0,0,0,0,1|1,0,0]=3 1754 B15R2.352 O=CCNc1ccc2c(c1)OCCO2 34a_100020630400_200009817547 [1,0,0,0,0,1|1,0,0]=3 1755 B15R2.352 O=CCOc1ccc2c(c1)CCOC2 34a_100009841951_200009817547 [1,0,0,0,0,1|2,0,0]=4 1756 B15R2.352 O=CCOc1ccc2c(c1)CCOC2 7a_100009841951_200015260668 [1,0,0,0,0,1|2,0,0]=4 1757 B15R2.352 O=CCOc1ccc2c(c1)NCCO2 34a_100020636358_200009817547 [1,0,0,0,0,1|2,0,0]=4 1758 B15R2.352 O=CCOc1ccc2c(c1)OCCO2 34a_100000234341_200009817547 [1,0,0,0,0,1|1,0,0]=3 1759 B15R2.352 O=CCSc1ccc2c(c1)CCCO2 62a_100011393166_200015260668 [1,0,0,0,0,1|2,0,0]=4 1760 B15R2.352 O=CCSc1ccc2c(c1)CCCO2 62a_200015260668_100011393166 [1,0,0,0,0,1|2,0,0]=4 1761 B15R2.352 O=CCSc1ccc2c(c1)COCC2 62a_100010128096_200015260668 [1,0,0,0,0,1|2,0,0]=4 1762 B15R2.352 O=CCSc1ccc2c(c1)COCC2 62a_200015260668_100010128096 [1,0,0,0,0,1|2,0,0]=4 1763 B15R2.352 O=CCSc1ccc2c(c1)NCCO2 62a_200015260668_100000708519 [1,0,0,0,0,1|2,0,0]=4 1764 B15R2.352 O=CCSc1ccc2c(c1)OCCC2 62a_100010700467_200015260668 [1,0,0,0,0,1|2,0,0]=4 1765 B15R2.352 O=CCSc1ccc2c(c1)OCCC2 62a_200015260668_100010700467 [1,0,0,0,0,1|2,0,0]=4 1766 B15R2.352 O=CCSc1ccc2c(c1)OCCN2 62a_200015260668_100012355470 [1,0,0,0,0,1|2,0,0]=4 1767 B15R2.352 O=CCSc1ccc2c(c1)OCCO2 62a_100011216881_200015260668 [1,0,0,0,0,1|1,0,0]=3 1768 B15R2.352 O=CCSc1ccc2c(c1)OCCO2 62a_200015260668_100011216881 [1,0,0,0,0,1|1,0,0]=3 1769 B15R2.1668 CC(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_200000210301 [1,0,0,0,0,1|0,0,1]=3 1770 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 11a_100020630400_100015343762 [1,0,0,0,0,1|1,0,1]=4 1771 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 1626a_100020630400_100015343762 [1,0,0,0,0,1|1,0,1]=4 1772 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 22a_100020630400_100000070787 [1,0,0,0,0,1|1,0,1]=4 1773 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 527a_100020630400_100103153847 [1,0,0,0,0,1|1,0,1]=4 1774 B15R2.1668 CC(C)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000210206 [1,0,0,0,0,1|1,0,1]=4 1775 B15R2.1668 CC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_100000210206 [1,0,0,0,0,1|1,0,1]=4 1776 B15R2.1668 CC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_100000210206 [1,0,0,0,0,1|1,0,1]=4 1777 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCO2 62a_100000210206_100011216881 [1,0,0,0,0,1|1,0,1]=4 1778 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000210206 [1,0,0,0,0,1|1,0,1]=4 1779 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684720_200000210301 [1,0,0,0,0,1|1,0,1]=4 1780 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684720_200000210301 [1,0,0,0,0,1|1,0,1]=4 1781 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 270004a_100102631434_100000184955 [1,0,0,0,0,1|1,0,1]=4 1782 B15R2.1668 CN([13CH3])Cc1ccc2c(c1)OCCO2 2230a_100000684720_200025704644 [1,0,0,0,0,1|1,0,1]=4 1783 B15R2.1668 CN([13CH3])Cc1ccc2c(c1)OCCO2 269982a_100000684720_200025704644 [1,0,0,0,0,1|1,0,1]=4 1784 B15R2.1668 [13CH3]C(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_200025704644 [1,0,0,0,0,1|0,0,1]=3 1785 B15R2.1601 CC(N[13CH3])c1ccc2c(c1)OCCO2 2230a_100000738497_200025704644 [0,0,0,0,1,1|2,0,0]=4 1786 B15R2.1601 CC(N[13CH3])c1ccc2c(c1)OCCO2 34a_100000738497_200025704644 [0,0,0,0,1,1|2,0,0]=4 1787 B15R2.1601 CNC(C)c1ccc2c(c1)OCCO2 2230a_100000738497_200000210301 [0,0,0,0,1,1|2,0,0]=4 1788 B15R2.1601 CNC(C)c1ccc2c(c1)OCCO2 269862a_106832991636_100000182760 [0,0,0,0,1,1|2,0,0]=4 1789 B15R2.1601 CNC(C)c1ccc2c(c1)OCCO2 34a_100000738497_200000210301 [0,0,0,0,1,1|2,0,0]=4 1790 B17R2.556 C#CC(C)NCc1ccc2c(c1)OCCO2 270004a_100000707721_100000184955 [0,0,0,0,0,2|1,0,1]=4 1791 B17R2.556 C#CC(C)NCc1ccc2c(c1)OCCO2 34a_100000684186_200000035995 [0,0,0,0,0,2|1,0,1]=4 1792 B17R2.556 C#CC(C)OCc1ccc2c(c1)OCCO2 34a_100000745213_200000035995 [0,0,0,0,0,2|1,0,1]=4 1793 B17R2.556 C=CC(O)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000730141 [0,0,0,0,0,2|2,0,0]=4 1794 B17R2.556 C=CC(O)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000730141 [0,0,0,0,0,2|2,0,0]=4 1795 B17R2.556 C=CC(O)COc1ccc2c(c1)OCCO2 34a_100000234341_100000730141 [0,0,0,0,0,2|2,0,0]=4 1796 B17R2.556 C=CC(O)CSc1ccc2c(c1)OCCO2 62a_100000730141_100011216881 [0,0,0,0,0,2|2,0,0]=4 1797 B17R2.556 C=CC(O)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000730141 [0,0,0,0,0,2|2,0,0]=4 1798 B17R2.556 CC(C#N)NCc1ccc2c(c1)OCCO2 2230a_100000684186_100000184139 [0,0,0,0,0,2|1,0,1]=4 1799 B17R2.556 CC(CO)NCc1ccc2c(c1)OCCO2 2230a_100000684186_100012180447 [0,0,0,0,0,2|0,0,2]=4 1800 B17R2.556 CC(CO)NCc1ccc2c(c1)OCCO2 34a_100000684186_100012180447 [0,0,0,0,0,2|0,0,2]=4 1801 B17R2.556 CC(CO)OCc1ccc2c(c1)OCCO2 34a_100000745213_100012180447 [0,0,0,0,0,2|0,0,2]=4 1802 B17R2.556 CCC(C)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000748023 [0,0,0,0,0,2|1,0,1]=4 1803 B17R2.556 CCC(C)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000748023 [0,0,0,0,0,2|1,0,1]=4 1804 B17R2.556 CCC(C)COc1ccc2c(c1)OCCO2 34a_100000234341_100000748023 [0,0,0,0,0,2|1,0,1]=4 1805 B17R2.556 CCC(C)CSc1ccc2c(c1)OCCO2 62a_100000748023_100011216881 [0,0,0,0,0,2|1,0,1]=4 1806 B17R2.556 CCC(C)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000748023 [0,0,0,0,0,2|1,0,1]=4 1807 B17R2.556 CCC(C)NCc1ccc2c(c1)OCCO2 207a_100000209981_100000184955 [0,0,0,0,0,2|1,0,1]=4 1808 B17R2.556 CCC(C)NCc1ccc2c(c1)OCCO2 2230a_100000684186_100000758301 [0,0,0,0,0,2|1,0,1]=4 1809 B17R2.556 CCC(C)NCc1ccc2c(c1)OCCO2 270004a_100000209981_100000184955 [0,0,0,0,0,2|1,0,1]=4 1810 B17R2.556 CCC(C)NCc1ccc2c(c1)OCCO2 34a_100000684186_100011215416 [0,0,0,0,0,2|1,0,1]=4 1811 B17R2.556 CCC(C)OCc1ccc2c(c1)OCCO2 34a_100000745213_100011215416 [0,0,0,0,0,2|1,0,1]=4 1812 B17R2.556 CC[C@H](C)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100009816398 [0,0,0,0,0,2|1,0,1]=4 1813 B17R2.556 CC[C@H](C)CNc1ccc2c(c1)OCCO2 34a_100020630400_100009816398 [0,0,0,0,0,2|1,0,1]=4 1814 B17R2.556 CC[C@H](C)COc1ccc2c(c1)OCCO2 34a_100000234341_100009816398 [0,0,0,0,0,2|1,0,1]=4 1815 B17R2.556 CC[C@H](C)CSc1ccc2c(c1)OCCO2 62a_100009816398_100011216881 [0,0,0,0,0,2|1,0,1]=4 1816 B17R2.556 CC[C@H](C)CSc1ccc2c(c1)OCCO2 62a_100011216881_100009816398 [0,0,0,0,0,2|1,0,1]=4 1817 B17R2.556 C[C@@H](CO)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000059175 [0,0,0,0,0,2|0,0,2]=4 1818 B17R2.556 C[C@@H](CO)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000059175 [0,0,0,0,0,2|0,0,2]=4 1819 B17R2.556 C[C@@H](CO)COc1ccc2c(c1)OCCO2 34a_100000234341_100000059175 [0,0,0,0,0,2|0,0,2]=4 1820 B17R2.556 C[C@@H](CO)CSc1ccc2c(c1)OCCO2 62a_100000059175_100011216881 [0,0,0,0,0,2|0,0,2]=4 1821 B17R2.556 C[C@@H](CO)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000059175 [0,0,0,0,0,2|0,0,2]=4 1822 B17R2.556 C[C@H](CF)NCc1ccc2c(c1)OCCO2 207a_100102880703_100000184955 [0,0,0,0,0,2|1,0,1]=4 1823 B17R2.556 C[C@H](CF)NCc1ccc2c(c1)OCCO2 270004a_100102880703_100000184955 [0,0,0,0,0,2|1,0,1]=4 1824 B17R2.556 C[C@H](CO)NCc1ccc2c(c1)OCCO2 207a_100000737577_100000184955 [0,0,0,0,0,2|0,0,2]=4 1825 B17R2.556 C[C@H](CO)NCc1ccc2c(c1)OCCO2 270004a_100000737577_100000184955 [0,0,0,0,0,2|0,0,2]=4 1826 B17R2.7777 C#CC(C)NCCc1ccc2c(c1)OCO2 34a_100000204656_200000035995 [0,0,0,0,0,2|1,0,1]=4 1827 B17R2.7777 C#CC(C)OCCc1ccc2c(c1)OCO2 34a_100011934097_200000035995 [0,0,0,0,0,2|1,0,1]=4 1828 B17R2.7777 C=CC(C)COCc1ccc2c(c1)OCO2 34a_100011215527_100000189651 [0,0,0,0,0,2|1,0,0]=3 1829 B17R2.7777 C=CC(C)COCc1ccc2c(c1)OCO2 7a_100011215527_100000189651 [0,0,0,0,0,2|1,0,0]=3 1830 B17R2.7777 C=CC(C)OCCc1ccc2c(c1)CCO2 34a_100000695699_100000763274 [0,0,0,0,0,2|2,0,0]=4 1831 B17R2.7777 C=CC(C)SCCc1ccc2c(c1)CCO2 62a_100011215867_100000763274 [0,0,0,0,0,2|2,0,0]=4 1832 B17R2.7777 C=CC(O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000730141 [0,0,0,0,0,2|2,0,0]=4 1833 B17R2.7777 C=CC(O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000730141 [0,0,0,0,0,2|2,0,0]=4 1834 B17R2.7777 C=CC(O)COCc1ccc2c(c1)OCO2 34a_100000210967_100000730141 [0,0,0,0,0,2|2,0,0]=4 1835 B17R2.7777 C=C[C@H](N)COCc1ccc2c(c1)OCO2 34a_100016989147_100000189651 [0,0,0,0,0,2|2,0,0]=4 1836 B17R2.7777 CC(C#N)NCCc1ccc2c(c1)OCO2 2230a_100000204656_100000184139 [0,0,0,0,0,2|1,0,1]=4 1837 B17R2.7777 CC(CN)COCc1ccc2c(c1)OCO2 34a_100000744482_100000189651 [0,0,0,0,0,2|1,0,1]=4 1838 B17R2.7777 CC(CO)CNCc1ccc2c(c1)OCO2 34a_100000744482_100000189651 [0,0,0,0,0,2|0,0,2]=4 1839 B17R2.7777 CC(CO)NCCc1ccc2c(c1)OCO2 2230a_100000204656_100012180447 [0,0,0,0,0,2|0,0,2]=4 1840 B17R2.7777 CC(CO)NCCc1ccc2c(c1)OCO2 34a_100000204656_100012180447 [0,0,0,0,0,2|0,0,2]=4 1841 B17R2.7777 CC(CO)OCCc1ccc2c(c1)OCO2 34a_100011934097_100012180447 [0,0,0,0,0,2|0,0,2]=4 1842 B17R2.7777 CCC(C)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000748023 [0,0,0,0,0,2|1,0,1]=4 1843 B17R2.7777 CCC(C)CNCc1ccc2c(c1)OCO2 270004a_100000210006_100000243153 [0,0,0,0,0,2|1,0,1]=4 1844 B17R2.7777 CCC(C)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000748023 [0,0,0,0,0,2|1,0,1]=4 1845 B17R2.7777 CCC(C)COCc1ccc2c(c1)OCO2 34a_100000210967_100000748023 [0,0,0,0,0,2|1,0,1]=4 1846 B17R2.7777 CCC(C)NCCc1ccc2c(c1)OCO2 2230a_100000204656_100000758301 [0,0,0,0,0,2|1,0,1]=4 1847 B17R2.7777 CCC(C)NCCc1ccc2c(c1)OCO2 34a_100000204656_100011215416 [0,0,0,0,0,2|1,0,1]=4 1848 B17R2.7777 CCC(C)OCCc1ccc2c(c1)OCO2 34a_100011934097_100011215416 [0,0,0,0,0,2|1,0,1]=4 1849 B17R2.7777 CC[C@H](C)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100009816398 [0,0,0,0,0,2|1,0,1]=4 1850 B17R2.7777 CC[C@H](C)CNCc1ccc2c(c1)OCO2 34a_100000210006_100009816398 [0,0,0,0,0,2|1,0,1]=4 1851 B17R2.7777 CC[C@H](C)COCc1ccc2c(c1)OCO2 34a_100000210967_100009816398 [0,0,0,0,0,2|1,0,1]=4 1852 B17R2.7777 CC[C@H](C)COCc1ccc2c(c1)OCO2 7a_100009816381_100000189651 [0,0,0,0,0,2|1,0,1]=4 1853 B17R2.7777 COC(C)COCc1ccc2c(c1)OCO2 34a_100000690652_100000189651 [0,0,0,0,0,2|2,0,0]=4 1854 B17R2.7777 C[C@@H](CO)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000059175 [0,0,0,0,0,2|0,0,2]=4 1855 B17R2.7777 C[C@@H](CO)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000059175 [0,0,0,0,0,2|0,0,2]=4 1856 B17R2.7777 C[C@@H](CO)COCc1ccc2c(c1)OCO2 34a_100000210967_100000059175 [0,0,0,0,0,2|0,0,2]=4 1857 B17R2.364503 C=CC(C)Sc1ccc2c(c1)OCCCO2 62a_100011215867_100000739260 [0,0,0,0,0,2|2,0,0]=4