0 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 34a_100000741967_200025704644 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 7a_100000741967_200025704644 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.966 CCC(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_100000210202 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.966 CCC(=O)c1ccc2[nH]cnc2c1 1458a_100000184039_100000210202 [0,0,0,0,0,0|2,0,2]=4 4 B14R2.966 CCC(=O)c1ccc2[nH]ncc2c1 1458a_100000030791_100000210202 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.966 CCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000210202 [0,0,0,0,0,0|2,0,0]=2 6 B14R2.966 CCC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210202 [0,0,0,0,0,0|3,0,0]=3 7 B14R2.966 CCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210202 [0,0,0,0,0,0|3,0,0]=3 8 B14R2.966 CCC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_100000210202 [0,0,0,0,0,0|1,0,2]=3 9 B14R2.966 CCC(=O)c1ccc2ccoc2c1 1458a_100000077109_100000210202 [0,0,0,0,0,0|2,0,2]=4 10 B14R2.966 CCC(=O)c1ccc2ccsc2c1 1458a_100000045399_100000210202 [0,0,0,0,0,0|2,0,2]=4 11 B14R2.966 CCC(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_100000210202 [0,0,0,0,0,0|2,0,1]=3 12 B14R2.966 CCC(=O)c1ccc2ncoc2c1 1458a_100000750374_100000210202 [0,0,0,0,0,0|3,0,1]=4 13 B14R2.966 CCC(=O)c1ccc2ncsc2c1 1458a_100000183663_100000210202 [0,0,0,0,0,0|3,0,1]=4 14 B14R2.966 CCC(=O)c1ccc2nonc2c1 1458a_100000031939_100000210202 [0,0,0,0,0,0|3,0,1]=4 15 B14R2.966 CCC(=O)c1ccc2nsnc2c1 1458a_100000041451_100000210202 [0,0,0,0,0,0|3,0,1]=4 16 B14R2.966 CCC(=O)c1ccc2occc2c1 1458a_100000039204_100000210202 [0,0,0,0,0,0|3,0,1]=4 17 B14R2.966 CCC(=O)c1ccc2ocnc2c1 1458a_100000238527_100000210202 [0,0,0,0,0,0|2,0,2]=4 18 B14R2.966 CCC(=O)c1ccc2sccc2c1 1458a_100000766740_100000210202 [0,0,0,0,0,0|3,0,1]=4 19 B14R2.966 CCC(=O)c1ccc2scnc2c1 1458a_100000068124_100000210202 [0,0,0,0,0,0|2,0,2]=4 20 B14R2.966 CCC(=O)c1ccc2snnc2c1 1458a_100000038608_100000210202 [0,0,0,0,0,0|3,0,1]=4 21 B14R2.966 CNC(=O)c1ccc2[nH]ccc2c1 11a_106832991635_100000752189 [0,0,0,0,0,0|3,0,1]=4 22 B14R2.966 CNC(=O)c1ccc2[nH]ccc2c1 527a_100102657272_100000752189 [0,0,0,0,0,0|3,0,1]=4 23 B14R2.966 CNC(=O)c1ccc2[nH]cnc2c1 240690a_100102657272_100000184039 [0,0,0,0,0,0|2,0,2]=4 24 B14R2.966 CNC(=O)c1ccc2[nH]cnc2c1 527a_100102657272_100000184039 [0,0,0,0,0,0|2,0,2]=4 25 B14R2.966 CNC(=O)c1ccc2[nH]ncc2c1 240690a_100102657272_100000030791 [0,0,0,0,0,0|4,0,0]=4 26 B14R2.966 CNC(=O)c1ccc2[nH]ncc2c1 527a_100102657272_100000030791 [0,0,0,0,0,0|4,0,0]=4 27 B14R2.966 CNC(=O)c1ccc2[nH]nnc2c1 240690a_100102657272_100000184783 [0,0,0,0,0,0|3,0,1]=4 28 B14R2.966 CNC(=O)c1ccc2[nH]nnc2c1 527a_100102657272_100000184783 [0,0,0,0,0,0|3,0,1]=4 29 B14R2.966 CNC(=O)c1ccc2c(c1)CCC2 11a_106832991635_100000195560 [0,0,0,0,0,0|2,0,0]=2 30 B14R2.966 CNC(=O)c1ccc2c(c1)CCC2 1626a_100102657272_100000195560 [0,0,0,0,0,0|2,0,0]=2 31 B14R2.966 CNC(=O)c1ccc2c(c1)CCC2 240690a_100102657272_100000195560 [0,0,0,0,0,0|2,0,0]=2 32 B14R2.966 CNC(=O)c1ccc2c(c1)CCC2 527a_100102657272_100000195560 [0,0,0,0,0,0|2,0,0]=2 33 B14R2.966 CNC(=O)c1ccc2c(c1)CCO2 11a_106832991635_100011207309 [0,0,0,0,0,0|3,0,0]=3 34 B14R2.966 CNC(=O)c1ccc2c(c1)CCO2 1626a_100102657272_100011207309 [0,0,0,0,0,0|3,0,0]=3 35 B14R2.966 CNC(=O)c1ccc2c(c1)CCO2 240690a_100102657272_100011207309 [0,0,0,0,0,0|3,0,0]=3 36 B14R2.966 CNC(=O)c1ccc2c(c1)CCO2 527a_100102657272_100011207309 [0,0,0,0,0,0|3,0,0]=3 37 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 11a_106832991635_100000210863 [0,0,0,0,0,0|3,0,0]=3 38 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 1626a_100102657272_100000210863 [0,0,0,0,0,0|3,0,0]=3 39 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 240690a_100102657272_100000210863 [0,0,0,0,0,0|3,0,0]=3 40 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 527a_100102657272_100000210863 [0,0,0,0,0,0|3,0,0]=3 41 B14R2.966 CNC(=O)c1ccc2cc[nH]c2c1 11a_106832991635_100000739399 [0,0,0,0,0,0|1,0,2]=3 42 B14R2.966 CNC(=O)c1ccc2cc[nH]c2c1 527a_100102657272_100000739399 [0,0,0,0,0,0|1,0,2]=3 43 B14R2.966 CNC(=O)c1ccc2ccoc2c1 11a_106832991635_100000077109 [0,0,0,0,0,0|2,0,2]=4 44 B14R2.966 CNC(=O)c1ccc2ccoc2c1 1626a_100102657272_100000077109 [0,0,0,0,0,0|2,0,2]=4 45 B14R2.966 CNC(=O)c1ccc2ccoc2c1 240690a_100102657272_100000077109 [0,0,0,0,0,0|2,0,2]=4 46 B14R2.966 CNC(=O)c1ccc2ccoc2c1 527a_100102657272_100000077109 [0,0,0,0,0,0|2,0,2]=4 47 B14R2.966 CNC(=O)c1ccc2ccsc2c1 11a_106832991635_100000045399 [0,0,0,0,0,0|2,0,2]=4 48 B14R2.966 CNC(=O)c1ccc2ccsc2c1 1626a_100102657272_100000045399 [0,0,0,0,0,0|2,0,2]=4 49 B14R2.966 CNC(=O)c1ccc2ccsc2c1 240690a_100102657272_100000045399 [0,0,0,0,0,0|2,0,2]=4 50 B14R2.966 CNC(=O)c1ccc2ccsc2c1 527a_100102657272_100000045399 [0,0,0,0,0,0|2,0,2]=4 51 B14R2.966 CNC(=O)c1ccc2cn[nH]c2c1 240690a_100102657272_102516607281 [0,0,0,0,0,0|2,0,1]=3 52 B14R2.966 CNC(=O)c1ccc2cn[nH]c2c1 527a_100102657272_102516607281 [0,0,0,0,0,0|2,0,1]=3 53 B14R2.966 CNC(=O)c1ccc2ncoc2c1 1626a_100102657272_100000750374 [0,0,0,0,0,0|3,0,1]=4 54 B14R2.966 CNC(=O)c1ccc2ncsc2c1 11a_106832991635_100000183663 [0,0,0,0,0,0|3,0,1]=4 55 B14R2.966 CNC(=O)c1ccc2ncsc2c1 1626a_100102657272_100000183663 [0,0,0,0,0,0|3,0,1]=4 56 B14R2.966 CNC(=O)c1ccc2ncsc2c1 240690a_100102657272_100000183663 [0,0,0,0,0,0|3,0,1]=4 57 B14R2.966 CNC(=O)c1ccc2ncsc2c1 527a_100102657272_100000183663 [0,0,0,0,0,0|3,0,1]=4 58 B14R2.966 CNC(=O)c1ccc2nonc2c1 11a_106832991635_100000031939 [0,0,0,0,0,0|3,0,1]=4 59 B14R2.966 CNC(=O)c1ccc2nonc2c1 240690a_100102657272_100000031939 [0,0,0,0,0,0|3,0,1]=4 60 B14R2.966 CNC(=O)c1ccc2nonc2c1 527a_100102657272_100000031939 [0,0,0,0,0,0|3,0,1]=4 61 B14R2.966 CNC(=O)c1ccc2nsnc2c1 11a_106832991635_100000041451 [0,0,0,0,0,0|3,0,1]=4 62 B14R2.966 CNC(=O)c1ccc2nsnc2c1 1626a_100102657272_100000041451 [0,0,0,0,0,0|3,0,1]=4 63 B14R2.966 CNC(=O)c1ccc2nsnc2c1 240690a_100102657272_100000041451 [0,0,0,0,0,0|3,0,1]=4 64 B14R2.966 CNC(=O)c1ccc2nsnc2c1 527a_100102657272_100000041451 [0,0,0,0,0,0|3,0,1]=4 65 B14R2.966 CNC(=O)c1ccc2occc2c1 11a_106832991635_100000039204 [0,0,0,0,0,0|3,0,1]=4 66 B14R2.966 CNC(=O)c1ccc2occc2c1 1626a_100102657272_100000039204 [0,0,0,0,0,0|3,0,1]=4 67 B14R2.966 CNC(=O)c1ccc2occc2c1 240690a_100102657272_100000039204 [0,0,0,0,0,0|3,0,1]=4 68 B14R2.966 CNC(=O)c1ccc2occc2c1 527a_100102657272_100000039204 [0,0,0,0,0,0|3,0,1]=4 69 B14R2.966 CNC(=O)c1ccc2ocnc2c1 11a_106832991635_100000238527 [0,0,0,0,0,0|2,0,2]=4 70 B14R2.966 CNC(=O)c1ccc2ocnc2c1 1626a_100102657272_100000238527 [0,0,0,0,0,0|2,0,2]=4 71 B14R2.966 CNC(=O)c1ccc2sccc2c1 11a_106832991635_100000766740 [0,0,0,0,0,0|3,0,1]=4 72 B14R2.966 CNC(=O)c1ccc2sccc2c1 1626a_100102657272_100000766740 [0,0,0,0,0,0|3,0,1]=4 73 B14R2.966 CNC(=O)c1ccc2sccc2c1 240690a_100102657272_100000766740 [0,0,0,0,0,0|3,0,1]=4 74 B14R2.966 CNC(=O)c1ccc2sccc2c1 527a_100102657272_100000766740 [0,0,0,0,0,0|3,0,1]=4 75 B14R2.966 CNC(=O)c1ccc2scnc2c1 11a_106832991635_100000068124 [0,0,0,0,0,0|2,0,2]=4 76 B14R2.966 CNC(=O)c1ccc2scnc2c1 1626a_100102657272_100000068124 [0,0,0,0,0,0|2,0,2]=4 77 B14R2.966 CNC(=O)c1ccc2scnc2c1 527a_100102657272_100000068124 [0,0,0,0,0,0|2,0,2]=4 78 B14R2.966 CNC(=O)c1ccc2snnc2c1 11a_106832991635_100000038608 [0,0,0,0,0,0|3,0,1]=4 79 B14R2.966 CNC(=O)c1ccc2snnc2c1 1626a_100102657272_100000038608 [0,0,0,0,0,0|3,0,1]=4 80 B14R2.966 CNC(=O)c1ccc2snnc2c1 240690a_100102657272_100000038608 [0,0,0,0,0,0|3,0,1]=4 81 B14R2.966 CNC(=O)c1ccc2snnc2c1 527a_100102657272_100000038608 [0,0,0,0,0,0|3,0,1]=4 82 B14R2.966 CNC(C)c1ccc2c(c1)CCC2 269862a_106832991636_100000203790 [0,0,0,0,0,0|3,0,1]=4 83 B14R2.966 CNC(C)c1ccc2c(c1)OCC2 269862a_106832991636_100000143635 [0,0,0,0,0,0|3,0,1]=4 84 B14R2.966 CN[C@@H](C)c1ccc2c(c1)CCC2 2230a_100000762724_200000210301 [0,0,0,0,0,0|3,0,1]=4 85 B14R2.966 CN[C@@H](C)c1ccc2c(c1)CCC2 34a_100000762724_200000210301 [0,0,0,0,0,0|3,0,1]=4 86 B14R2.966 COC(C)c1ccc2c(c1)OCO2 34a_100000741967_200000210301 [0,0,0,0,0,0|3,0,1]=4 87 B14R2.966 COC(C)c1ccc2c(c1)OCO2 7a_100000741967_200000210301 [0,0,0,0,0,0|3,0,1]=4 88 B14R2.966 C[C@H](N[13CH3])c1ccc2c(c1)CCC2 2230a_100000762724_200025704644 [0,0,0,0,0,0|3,0,1]=4 89 B14R2.966 C[C@H](N[13CH3])c1ccc2c(c1)CCC2 34a_100000762724_200025704644 [0,0,0,0,0,0|3,0,1]=4 90 B14R2.966 O=C(CF)c1ccc2c(c1)CCC2 1458a_100000195560_100015361967 [0,0,0,0,0,0|3,0,0]=3 91 B14R2.966 O=C(CF)c1ccc2c(c1)CCO2 1458a_100011207309_100015361967 [0,0,0,0,0,0|4,0,0]=4 92 B14R2.966 O=C(CF)c1ccc2c(c1)OCO2 1458a_100000210863_100015361967 [0,0,0,0,0,0|4,0,0]=4 93 B14R2.966 O=C(CF)c1ccc2cc[nH]c2c1 1458a_100000739399_100015361967 [0,0,0,0,0,0|2,0,2]=4 94 B14R2.966 O=C(CF)c1ccc2cn[nH]c2c1 1458a_102516607281_100015361967 [0,0,0,0,0,0|3,0,1]=4 95 B13R2.430 C=C(C)c1cc2c(cn1)CCN2 271570a_100000694244_100020639910 [1,0,0,0,0,0|2,0,0]=3 96 B13R2.430 C=C(C)c1ccc2c(c1)C=CC2 271570a_100000694244_100009814306 [1,0,0,0,0,0|2,0,1]=4 97 B13R2.430 C=C(C)c1ccc2c(c1)CCC2 271570a_100000694244_100000745594 [1,0,0,0,0,0|2,0,0]=3 98 B13R2.430 C=C(C)c1ccc2c(c1)CCN2 271570a_100000694244_100000026929 [1,0,0,0,0,0|3,0,0]=4 99 B13R2.430 C=C(C)c1ccc2c(c1)CCO2 271570a_100000694244_100000729065 [1,0,0,0,0,0|3,0,0]=4 100 B13R2.430 C=C(C)c1ccc2c(c1)CNC2 271570a_100000694244_100000702344 [1,0,0,0,0,0|3,0,0]=4 101 B13R2.430 C=C(C)c1ccc2c(c1)COC2 271570a_100000694244_100000698232 [1,0,0,0,0,0|3,0,0]=4 102 B13R2.430 C=C(C)c1ccc2c(c1)NCC2 271570a_100000694244_100000754641 [1,0,0,0,0,0|1,0,0]=2 103 B13R2.430 C=C(C)c1ccc2c(c1)OCC2 271570a_100000694244_100009818566 [1,0,0,0,0,0|2,0,0]=3 104 B13R2.430 C=C(C)c1ccc2c(c1)OCO2 271570a_100000694244_100000688060 [1,0,0,0,0,0|3,0,0]=4 105 B13R2.430 C=C(C)c1ccc2c(n1)CCC2 271570a_100000694244_100000046531 [1,0,0,0,0,0|3,0,0]=4 106 B13R2.430 C=C(C)c1ccc2cc[nH]c2c1 271570a_100000694244_100000743809 [1,0,0,0,0,0|1,0,2]=4 107 B13R2.430 C=C(C)c1ccc2cn[nH]c2c1 271570a_100000694244_100000049514 [1,0,0,0,0,0|2,0,1]=4 108 B13R2.430 C=C(C)c1ccc2nn[nH]c2c1 271570a_100000694244_100009817464 [1,0,0,0,0,0|3,0,0]=4 109 B13R2.430 C=C(C)c1cnc2c(c1)CCC2 271570a_100000694244_100000693888 [1,0,0,0,0,0|3,0,0]=4 110 B13R2.430 C=C(C)c1cnc2c(c1)NCC2 271570a_100000694244_100000698607 [1,0,0,0,0,0|2,0,0]=3 111 B13R2.430 CC(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_200000210301 [1,0,0,0,0,0|2,0,1]=4 112 B13R2.430 CC(=O)c1ccc2[nH]cnc2c1 1458a_100000184039_200000210301 [1,0,0,0,0,0|1,0,2]=4 113 B13R2.430 CC(=O)c1ccc2[nH]ncc2c1 1458a_100000030791_200000210301 [1,0,0,0,0,0|3,0,0]=4 114 B13R2.430 CC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_200000210301 [1,0,0,0,0,0|1,0,0]=2 115 B13R2.430 CC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_200000210301 [1,0,0,0,0,0|2,0,0]=3 116 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000210301 [1,0,0,0,0,0|2,0,0]=3 117 B13R2.430 CC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_200000210301 [1,0,0,0,0,0|0,0,2]=3 118 B13R2.430 CC(=O)c1ccc2ccoc2c1 1458a_100000077109_200000210301 [1,0,0,0,0,0|1,0,2]=4 119 B13R2.430 CC(=O)c1ccc2ccsc2c1 1458a_100000045399_200000210301 [1,0,0,0,0,0|1,0,2]=4 120 B13R2.430 CC(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_200000210301 [1,0,0,0,0,0|1,0,1]=3 121 B13R2.430 CC(=O)c1ccc2ncoc2c1 1458a_100000750374_200000210301 [1,0,0,0,0,0|2,0,1]=4 122 B13R2.430 CC(=O)c1ccc2ncsc2c1 1458a_100000183663_200000210301 [1,0,0,0,0,0|2,0,1]=4 123 B13R2.430 CC(=O)c1ccc2nonc2c1 1458a_100000031939_200000210301 [1,0,0,0,0,0|2,0,1]=4 124 B13R2.430 CC(=O)c1ccc2nsnc2c1 1458a_100000041451_200000210301 [1,0,0,0,0,0|2,0,1]=4 125 B13R2.430 CC(=O)c1ccc2occc2c1 1458a_100000039204_200000210301 [1,0,0,0,0,0|2,0,1]=4 126 B13R2.430 CC(=O)c1ccc2ocnc2c1 1458a_100000238527_200000210301 [1,0,0,0,0,0|1,0,2]=4 127 B13R2.430 CC(=O)c1ccc2sccc2c1 1458a_100000766740_200000210301 [1,0,0,0,0,0|2,0,1]=4 128 B13R2.430 CC(=O)c1ccc2scnc2c1 1458a_100000068124_200000210301 [1,0,0,0,0,0|1,0,2]=4 129 B13R2.430 CC(=O)c1ccc2snnc2c1 1458a_100000038608_200000210301 [1,0,0,0,0,0|2,0,1]=4 130 B13R2.430 [13CH3]C(=O)c1ccc2[nH]ccc2c1 1458a_100000752189_200025704644 [1,0,0,0,0,0|2,0,1]=4 131 B13R2.430 [13CH3]C(=O)c1ccc2[nH]cnc2c1 1458a_100000184039_200025704644 [1,0,0,0,0,0|1,0,2]=4 132 B13R2.430 [13CH3]C(=O)c1ccc2[nH]ncc2c1 1458a_100000030791_200025704644 [1,0,0,0,0,0|3,0,0]=4 133 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)CCC2 1458a_100000195560_200025704644 [1,0,0,0,0,0|1,0,0]=2 134 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_200025704644 [1,0,0,0,0,0|2,0,0]=3 135 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200025704644 [1,0,0,0,0,0|2,0,0]=3 136 B13R2.430 [13CH3]C(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_200025704644 [1,0,0,0,0,0|0,0,2]=3 137 B13R2.430 [13CH3]C(=O)c1ccc2ccoc2c1 1458a_100000077109_200025704644 [1,0,0,0,0,0|1,0,2]=4 138 B13R2.430 [13CH3]C(=O)c1ccc2ccsc2c1 1458a_100000045399_200025704644 [1,0,0,0,0,0|1,0,2]=4 139 B13R2.430 [13CH3]C(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_200025704644 [1,0,0,0,0,0|1,0,1]=3 140 B13R2.430 [13CH3]C(=O)c1ccc2ncoc2c1 1458a_100000750374_200025704644 [1,0,0,0,0,0|2,0,1]=4 141 B13R2.430 [13CH3]C(=O)c1ccc2ncsc2c1 1458a_100000183663_200025704644 [1,0,0,0,0,0|2,0,1]=4 142 B13R2.430 [13CH3]C(=O)c1ccc2nonc2c1 1458a_100000031939_200025704644 [1,0,0,0,0,0|2,0,1]=4 143 B13R2.430 [13CH3]C(=O)c1ccc2nsnc2c1 1458a_100000041451_200025704644 [1,0,0,0,0,0|2,0,1]=4 144 B13R2.430 [13CH3]C(=O)c1ccc2occc2c1 1458a_100000039204_200025704644 [1,0,0,0,0,0|2,0,1]=4 145 B13R2.430 [13CH3]C(=O)c1ccc2ocnc2c1 1458a_100000238527_200025704644 [1,0,0,0,0,0|1,0,2]=4 146 B13R2.430 [13CH3]C(=O)c1ccc2sccc2c1 1458a_100000766740_200025704644 [1,0,0,0,0,0|2,0,1]=4 147 B13R2.430 [13CH3]C(=O)c1ccc2scnc2c1 1458a_100000068124_200025704644 [1,0,0,0,0,0|1,0,2]=4 148 B13R2.430 [13CH3]C(=O)c1ccc2snnc2c1 1458a_100000038608_200025704644 [1,0,0,0,0,0|2,0,1]=4 149 B13R2.449 C=C=Cc1cc2c(cn1)CCN2 271570a_100015277604_100020639910 [1,0,0,0,0,0|2,0,1]=4 150 B13R2.449 C=C=Cc1ccc2c(c1)CCC2 271570a_100015277604_100000745594 [1,0,0,0,0,0|2,0,1]=4 151 B13R2.449 C=C=Cc1ccc2c(c1)NCC2 271570a_100015277604_100000754641 [1,0,0,0,0,0|1,0,1]=3 152 B13R2.449 C=C=Cc1ccc2c(c1)OCC2 271570a_100015277604_100009818566 [1,0,0,0,0,0|2,0,1]=4 153 B13R2.449 C=C=Cc1cnc2c(c1)NCC2 271570a_100015277604_100000698607 [1,0,0,0,0,0|2,0,1]=4 154 B13R2.449 CC=Cc1cc2c(cn1)CCN2 271570a_100016259895_100020639910 [1,0,0,0,0,0|2,0,0]=3 155 B13R2.449 CC=Cc1ccc2c(c1)C=CC2 271570a_100016259895_100009814306 [1,0,0,0,0,0|2,0,1]=4 156 B13R2.449 CC=Cc1ccc2c(c1)CCC2 271570a_100016259895_100000745594 [1,0,0,0,0,0|2,0,0]=3 157 B13R2.449 CC=Cc1ccc2c(c1)CCN2 271570a_100016259895_100000026929 [1,0,0,0,0,0|3,0,0]=4 158 B13R2.449 CC=Cc1ccc2c(c1)CCO2 271570a_100016259895_100000729065 [1,0,0,0,0,0|3,0,0]=4 159 B13R2.449 CC=Cc1ccc2c(c1)CNC2 271570a_100016259895_100000702344 [1,0,0,0,0,0|3,0,0]=4 160 B13R2.449 CC=Cc1ccc2c(c1)COC2 271570a_100016259895_100000698232 [1,0,0,0,0,0|3,0,0]=4 161 B13R2.449 CC=Cc1ccc2c(c1)NCC2 271570a_100016259895_100000754641 [1,0,0,0,0,0|1,0,0]=2 162 B13R2.449 CC=Cc1ccc2c(c1)OCC2 271570a_100016259895_100009818566 [1,0,0,0,0,0|2,0,0]=3 163 B13R2.449 CC=Cc1ccc2c(c1)OCO2 271570a_100016259895_100000688060 [1,0,0,0,0,0|3,0,0]=4 164 B13R2.449 CC=Cc1ccc2c(n1)CCC2 271570a_100016259895_100000046531 [1,0,0,0,0,0|3,0,0]=4 165 B13R2.449 CC=Cc1ccc2cc[nH]c2c1 271570a_100016259895_100000743809 [1,0,0,0,0,0|1,0,2]=4 166 B13R2.449 CC=Cc1ccc2cn[nH]c2c1 271570a_100016259895_100000049514 [1,0,0,0,0,0|2,0,1]=4 167 B13R2.449 CC=Cc1ccc2nn[nH]c2c1 271570a_100016259895_100009817464 [1,0,0,0,0,0|3,0,0]=4 168 B13R2.449 CC=Cc1cnc2c(c1)CCC2 271570a_100016259895_100000693888 [1,0,0,0,0,0|3,0,0]=4 169 B13R2.449 CC=Cc1cnc2c(c1)NCC2 271570a_100016259895_100000698607 [1,0,0,0,0,0|2,0,0]=3 170 B13R2.449 CCNc1ccc2c(c1)CCC2 2230a_100000211504_100000210202 [1,0,0,0,0,0|3,0,0]=4 171 B13R2.449 CCNc1ccc2c(c1)CCC2 34a_100000211504_100000210202 [1,0,0,0,0,0|3,0,0]=4 172 B13R2.449 CCOc1ccc2c(c1)CCC2 34a_100000209987_100000210202 [1,0,0,0,0,0|3,0,0]=4 173 B13R2.449 CCOc1ccc2c(c1)CCC2 7a_100000209987_100000210202 [1,0,0,0,0,0|3,0,0]=4 174 B13R2.449 CCOc1ccc2c(c1)NCC2 34a_100020636427_100000210202 [1,0,0,0,0,0|2,0,0]=3 175 B13R2.449 CCSc1cc2c(cn1)CCN2 62a_100000210202_100020639910 [1,0,0,0,0,0|3,0,0]=4 176 B13R2.449 CCSc1cc2c(cn1)CCN2 62a_100020639910_100000210202 [1,0,0,0,0,0|3,0,0]=4 177 B13R2.449 CCSc1ccc2c(c1)CCC2 62a_100000210202_100000745594 [1,0,0,0,0,0|3,0,0]=4 178 B13R2.449 CCSc1ccc2c(c1)CCC2 62a_100000745594_100000210202 [1,0,0,0,0,0|3,0,0]=4 179 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000210202_100000754641 [1,0,0,0,0,0|2,0,0]=3 180 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000754641_100000210202 [1,0,0,0,0,0|2,0,0]=3 181 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100000210202_100009818566 [1,0,0,0,0,0|3,0,0]=4 182 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210202 [1,0,0,0,0,0|3,0,0]=4 183 B13R2.449 CCSc1cnc2c(c1)NCC2 62a_100000210202_100000698607 [1,0,0,0,0,0|3,0,0]=4 184 B13R2.449 CCSc1cnc2c(c1)NCC2 62a_100000698607_100000210202 [1,0,0,0,0,0|3,0,0]=4 185 B13R2.449 CNCc1ccc2c(c1)CCC2 207a_100102657272_100000765347 [1,0,0,0,0,0|2,0,1]=4 186 B13R2.449 CNCc1ccc2c(c1)CCC2 26a_100102657272_100000209987 [1,0,0,0,0,0|2,0,1]=4 187 B13R2.449 CNCc1ccc2c(c1)CCC2 270004a_106832991635_100000765347 [1,0,0,0,0,0|2,0,1]=4 188 B13R2.449 COCc1ccc2c(c1)CCC2 34a_200000765175_200000210301 [1,0,0,0,0,0|1,0,1]=3 189 B13R2.449 COCc1ccc2c(c1)CCC2 7a_200000765175_200000210301 [1,0,0,0,0,0|1,0,1]=3 190 B13R2.449 COCc1ccc2c(c1)CCO2 34a_100011219353_200000210301 [1,0,0,0,0,0|2,0,1]=4 191 B13R2.449 COCc1ccc2c(c1)CCO2 7a_100011219353_200000210301 [1,0,0,0,0,0|2,0,1]=4 192 B13R2.449 COCc1ccc2c(c1)NCC2 34a_100000694088_200000210301 [1,0,0,0,0,0|0,0,1]=2 193 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100000210967_200000210301 [1,0,0,0,0,0|2,0,1]=4 194 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100138415774_100000189651 [1,0,0,0,0,0|2,0,1]=4 195 B13R2.449 COCc1ccc2cn[nH]c2c1 34a_100138415774_100020605281 [1,0,0,0,0,0|1,0,2]=4 196 B13R2.449 FCOc1ccc2c(c1)NCC2 34a_100020636427_100015361967 [1,0,0,0,0,0|3,0,0]=4 197 B13R2.449 FCSc1ccc2c(c1)NCC2 62a_100000754641_100015361967 [1,0,0,0,0,0|3,0,0]=4 198 B13R2.449 FCSc1ccc2c(c1)NCC2 62a_100015361967_100000754641 [1,0,0,0,0,0|3,0,0]=4 199 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 34a_200000765175_200025704644 [1,0,0,0,0,0|1,0,1]=3 200 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 7a_200000765175_200025704644 [1,0,0,0,0,0|1,0,1]=3 201 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 34a_100011219353_200025704644 [1,0,0,0,0,0|2,0,1]=4 202 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 7a_100011219353_200025704644 [1,0,0,0,0,0|2,0,1]=4 203 B13R2.449 [13CH3]OCc1ccc2c(c1)NCC2 34a_100000694088_200025704644 [1,0,0,0,0,0|0,0,1]=2 204 B13R2.449 [13CH3]OCc1ccc2c(c1)OCO2 34a_100000210967_200025704644 [1,0,0,0,0,0|2,0,1]=4 205 B15R2.902 CNS(=O)(=O)c1ccc2c(c1)CCC2 270084a_100102657272_100000212175 [0,1,0,0,0,0|3,0,0]=4 206 B15R2.902 CNS(=O)(=O)c1ccc2c(c1)CCC2 274078a_100102657272_100000212175 [0,1,0,0,0,0|3,0,0]=4 207 B15R2.1350 C#CCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000184674 [0,1,0,0,0,0|2,0,1]=4 208 B15R2.1350 C=CCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000210623 [0,1,0,0,0,0|2,0,1]=4 209 B15R2.1350 CCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000210303 [0,1,0,0,0,0|2,0,0]=3 210 B15R2.1350 CCCC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210303 [0,1,0,0,0,0|3,0,0]=4 211 B15R2.1350 CCCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210303 [0,1,0,0,0,0|3,0,0]=4 212 B15R2.1350 CCCC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_100000210303 [0,1,0,0,0,0|1,0,2]=4 213 B15R2.1350 CCCC(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_100000210303 [0,1,0,0,0,0|2,0,1]=4 214 B15R2.1350 CCNC(=O)c1ccc2c(c1)CCC2 11a_100015525214_100000195560 [0,1,0,0,0,0|2,0,0]=3 215 B15R2.1350 CCNC(=O)c1ccc2c(c1)CCC2 240690a_100015525214_100000195560 [0,1,0,0,0,0|2,0,0]=3 216 B15R2.1350 CCNC(=O)c1ccc2c(c1)CCC2 527a_100015525214_100000195560 [0,1,0,0,0,0|2,0,0]=3 217 B15R2.1350 CCNC(=O)c1ccc2c(c1)CCO2 11a_100015525214_100011207309 [0,1,0,0,0,0|3,0,0]=4 218 B15R2.1350 CCNC(=O)c1ccc2c(c1)CCO2 240690a_100015525214_100011207309 [0,1,0,0,0,0|3,0,0]=4 219 B15R2.1350 CCNC(=O)c1ccc2c(c1)CCO2 527a_100015525214_100011207309 [0,1,0,0,0,0|3,0,0]=4 220 B15R2.1350 CCNC(=O)c1ccc2c(c1)OCO2 11a_100015525214_100000210863 [0,1,0,0,0,0|3,0,0]=4 221 B15R2.1350 CCNC(=O)c1ccc2c(c1)OCO2 240690a_100015525214_100000210863 [0,1,0,0,0,0|3,0,0]=4 222 B15R2.1350 CCNC(=O)c1ccc2c(c1)OCO2 527a_100015525214_100000210863 [0,1,0,0,0,0|3,0,0]=4 223 B15R2.1350 CCNC(=O)c1ccc2cc[nH]c2c1 11a_100015525214_100000739399 [0,1,0,0,0,0|1,0,2]=4 224 B15R2.1350 CCNC(=O)c1ccc2cc[nH]c2c1 527a_100015525214_100000739399 [0,1,0,0,0,0|1,0,2]=4 225 B15R2.1350 CCNC(=O)c1ccc2cn[nH]c2c1 240690a_100015525214_102516607281 [0,1,0,0,0,0|2,0,1]=4 226 B15R2.1350 CCNC(=O)c1ccc2cn[nH]c2c1 527a_100015525214_102516607281 [0,1,0,0,0,0|2,0,1]=4 227 B15R2.1350 CNCC(=O)c1ccc2c(c1)CCO2 2230a_106832991635_100000241338 [0,1,0,0,0,0|3,0,0]=4 228 B15R2.1350 CNCC(=O)c1ccc2c(c1)CCO2 34a_100102657272_100000241338 [0,1,0,0,0,0|3,0,0]=4 229 B15R2.1350 CNCC(=O)c1ccc2c(c1)CCO2 7a_106832991635_100000241338 [0,1,0,0,0,0|3,0,0]=4 230 B15R2.1350 CNCC(=O)c1ccc2c(c1)OCO2 7a_106832991635_100000181162 [0,1,0,0,0,0|3,0,0]=4 231 B15R2.1350 CNNC(=O)c1ccc2c(c1)CCC2 22a_100016993582_100000195560 [0,1,0,0,0,0|2,0,0]=3 232 B15R2.1350 CNNC(=O)c1ccc2c(c1)CCO2 22a_100016993582_100011207309 [0,1,0,0,0,0|3,0,0]=4 233 B15R2.1350 CNNC(=O)c1ccc2c(c1)OCO2 22a_100016993582_100000210863 [0,1,0,0,0,0|3,0,0]=4 234 B15R2.1350 CNNC(=O)c1ccc2cc[nH]c2c1 22a_100016993582_100000739399 [0,1,0,0,0,0|1,0,2]=4 235 B15R2.1350 CNNC(=O)c1ccc2cn[nH]c2c1 22a_100016993582_102516607281 [0,1,0,0,0,0|2,0,1]=4 236 B15R2.1350 COCC(=O)c1ccc2c(c1)CCO2 34a_100138415774_100000241338 [0,1,0,0,0,0|2,0,0]=3 237 B15R2.1350 CSCC(=O)c1ccc2c(c1)CCO2 62a_100000241338_200000210301 [0,1,0,0,0,0|2,1,0]=4 238 B15R2.1350 CSCC(=O)c1ccc2c(c1)CCO2 62a_200000210301_100000241338 [0,1,0,0,0,0|2,1,0]=4 239 B15R2.1350 CSCC(=O)c1ccc2c(c1)OCO2 62a_100000181162_200000210301 [0,1,0,0,0,0|2,1,0]=4 240 B15R2.1350 N#CCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100011214920 [0,1,0,0,0,0|2,0,1]=4 241 B15R2.1350 O=C(CCF)c1ccc2c(c1)CCC2 1458a_100000195560_100011217306 [0,1,0,0,0,0|2,0,0]=3 242 B15R2.1350 O=C(CCF)c1ccc2c(c1)CCO2 1458a_100011207309_100011217306 [0,1,0,0,0,0|3,0,0]=4 243 B15R2.1350 O=C(CCF)c1ccc2c(c1)OCO2 1458a_100000210863_100011217306 [0,1,0,0,0,0|3,0,0]=4 244 B15R2.1350 O=C(CCF)c1ccc2cc[nH]c2c1 1458a_100000739399_100011217306 [0,1,0,0,0,0|1,0,2]=4 245 B15R2.1350 O=C(CCF)c1ccc2cn[nH]c2c1 1458a_102516607281_100011217306 [0,1,0,0,0,0|2,0,1]=4 246 B15R2.1350 O=C(CCO)c1ccc2c(c1)CCC2 1458a_100000195560_100000211926 [0,1,0,0,0,0|2,0,0]=3 247 B15R2.1350 O=C(CCO)c1ccc2c(c1)CCO2 1458a_100011207309_100000211926 [0,1,0,0,0,0|3,0,0]=4 248 B15R2.1350 O=C(CCO)c1ccc2c(c1)OCO2 1458a_100000210863_100000211926 [0,1,0,0,0,0|3,0,0]=4 249 B15R2.1350 O=C(CCO)c1ccc2cc[nH]c2c1 1458a_100000739399_100000211926 [0,1,0,0,0,0|1,0,2]=4 250 B15R2.1350 O=C(CCO)c1ccc2cn[nH]c2c1 1458a_102516607281_100000211926 [0,1,0,0,0,0|2,0,1]=4 251 B15R2.1350 [13CH3]SCC(=O)c1ccc2c(c1)CCO2 62a_100000241338_200025704644 [0,1,0,0,0,0|2,1,0]=4 252 B15R2.1350 [13CH3]SCC(=O)c1ccc2c(c1)CCO2 62a_200025704644_100000241338 [0,1,0,0,0,0|2,1,0]=4 253 B15R2.1350 [13CH3]SCC(=O)c1ccc2c(c1)OCO2 62a_100000181162_200025704644 [0,1,0,0,0,0|2,1,0]=4 254 B15R2.1586 CCC(=O)c1ccc2c(c1C)OCO2 1458a_100009908537_100000210202 [0,1,0,0,0,0|3,0,0]=4 255 B15R2.1586 CCC(=O)c1ccc2cc[nH]c2c1Br 1458a_100010717018_100000210202 [0,1,0,0,0,0|1,0,2]=4 256 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 11a_106832991635_100009908537 [0,1,0,0,0,0|3,0,0]=4 257 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 1626a_100102657272_100009908537 [0,1,0,0,0,0|3,0,0]=4 258 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 240690a_100102657272_100009908537 [0,1,0,0,0,0|3,0,0]=4 259 B15R2.1586 CNC(=O)c1ccc2c(c1C)OCO2 527a_100102657272_100009908537 [0,1,0,0,0,0|3,0,0]=4 260 B15R2.1586 CNC(=O)c1ccc2cc[nH]c2c1Br 11a_106832991635_100010717018 [0,1,0,0,0,0|1,0,2]=4 261 B15R2.1586 CNC(=O)c1ccc2cc[nH]c2c1Br 240690a_100102657272_100010717018 [0,1,0,0,0,0|1,0,2]=4 262 B15R2.1586 CNC(=O)c1ccc2cc[nH]c2c1Br 527a_100102657272_100010717018 [0,1,0,0,0,0|1,0,2]=4 263 B15R2.4239 CC(=C(C)c1cc2c(cn1)CCN2)C 271570a_200000049429_100020639910 [0,1,0,0,0,0|3,0,0]=4 264 B15R2.4239 CC(=C(C)c1ccc2c(c1)CCC2)C 271570a_200000049429_100000745594 [0,1,0,0,0,0|3,0,0]=4 265 B15R2.4239 CC(=C(C)c1ccc2c(c1)NCC2)C 271570a_200000049429_100000754641 [0,1,0,0,0,0|2,0,0]=3 266 B15R2.4239 CC(=C(C)c1ccc2c(c1)OCC2)C 271570a_200000049429_100009818566 [0,1,0,0,0,0|3,0,0]=4 267 B15R2.4239 CC(=C(C)c1cnc2c(c1)NCC2)C 271570a_200000049429_100000698607 [0,1,0,0,0,0|3,0,0]=4 268 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000210206 [0,1,0,0,0,0|2,0,0]=3 269 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210206 [0,1,0,0,0,0|3,0,0]=4 270 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210206 [0,1,0,0,0,0|3,0,0]=4 271 B15R2.4239 CC(C)C(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_100000210206 [0,1,0,0,0,0|1,0,2]=4 272 B15R2.4239 CC(C)C(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_100000210206 [0,1,0,0,0,0|2,0,1]=4 273 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCC2 11a_100102631434_100000195560 [0,1,0,0,0,0|2,0,0]=3 274 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCC2 1626a_100102631434_100000195560 [0,1,0,0,0,0|2,0,0]=3 275 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCC2 240690a_100102631434_100000195560 [0,1,0,0,0,0|2,0,0]=3 276 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCC2 527a_100102631434_100000195560 [0,1,0,0,0,0|2,0,0]=3 277 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCO2 11a_100102631434_100011207309 [0,1,0,0,0,0|3,0,0]=4 278 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCO2 1626a_100102631434_100011207309 [0,1,0,0,0,0|3,0,0]=4 279 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCO2 240690a_100102631434_100011207309 [0,1,0,0,0,0|3,0,0]=4 280 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)CCO2 527a_100102631434_100011207309 [0,1,0,0,0,0|3,0,0]=4 281 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 11a_100102631434_100000210863 [0,1,0,0,0,0|3,0,0]=4 282 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 1626a_100102631434_100000210863 [0,1,0,0,0,0|3,0,0]=4 283 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 240690a_100102631434_100000210863 [0,1,0,0,0,0|3,0,0]=4 284 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 527a_100102631434_100000210863 [0,1,0,0,0,0|3,0,0]=4 285 B15R2.4239 CN(C)C(=O)c1ccc2cc[nH]c2c1 11a_100102631434_100000739399 [0,1,0,0,0,0|1,0,2]=4 286 B15R2.4239 CN(C)C(=O)c1ccc2cc[nH]c2c1 527a_100102631434_100000739399 [0,1,0,0,0,0|1,0,2]=4 287 B15R2.4239 CN(C)C(=O)c1ccc2cn[nH]c2c1 240690a_100102631434_102516607281 [0,1,0,0,0,0|2,0,1]=4 288 B15R2.4239 CN(C)C(=O)c1ccc2cn[nH]c2c1 527a_100102631434_102516607281 [0,1,0,0,0,0|2,0,1]=4 289 B15R2.19053 CCC(=O)c1cc2[nH]ccc2cc1Cl 1458a_100009858578_100000210202 [0,1,0,0,0,0|1,0,2]=4 290 B15R2.19053 CCC(=O)c1cc2[nH]cnc2cc1F 1458a_200000729458_100000210202 [0,1,0,0,0,0|2,0,1]=4 291 B15R2.19053 CCC(=O)c1cc2[nH]ncc2cc1Br 1458a_100102525137_100000210202 [0,1,0,0,0,0|2,0,1]=4 292 B15R2.19053 CCC(=O)c1cc2[nH]ncc2cc1Cl 1458a_100009865559_100000210202 [0,1,0,0,0,0|2,0,1]=4 293 B15R2.19053 CCC(=O)c1cc2c(cc1Br)OCO2 1458a_100012339479_100000210202 [0,1,0,0,0,0|3,0,0]=4 294 B15R2.19053 CNC(=O)c1cc2[nH]ccc2cc1Cl 11a_106832991635_100009858578 [0,1,0,0,0,0|1,0,2]=4 295 B15R2.19053 CNC(=O)c1cc2[nH]ccc2cc1Cl 527a_100102657272_100009858578 [0,1,0,0,0,0|1,0,2]=4 296 B15R2.19053 CNC(=O)c1cc2[nH]cnc2cc1F 11a_106832991635_200000729458 [0,1,0,0,0,0|2,0,1]=4 297 B15R2.19053 CNC(=O)c1cc2[nH]cnc2cc1F 1626a_100102657272_200000729458 [0,1,0,0,0,0|2,0,1]=4 298 B15R2.19053 CNC(=O)c1cc2[nH]cnc2cc1F 240690a_100102657272_200000729458 [0,1,0,0,0,0|2,0,1]=4 299 B15R2.19053 CNC(=O)c1cc2[nH]cnc2cc1F 527a_100102657272_200000729458 [0,1,0,0,0,0|2,0,1]=4 300 B15R2.19053 CNC(=O)c1cc2[nH]ncc2cc1Br 240690a_100102657272_100102525137 [0,1,0,0,0,0|2,0,1]=4 301 B15R2.19053 CNC(=O)c1cc2[nH]ncc2cc1Br 527a_100102657272_100102525137 [0,1,0,0,0,0|2,0,1]=4 302 B15R2.19053 CNC(=O)c1cc2[nH]ncc2cc1Cl 240690a_100102657272_100009865559 [0,1,0,0,0,0|2,0,1]=4 303 B15R2.19053 CNC(=O)c1cc2[nH]ncc2cc1Cl 527a_100102657272_100009865559 [0,1,0,0,0,0|2,0,1]=4 304 B15R2.19053 CNC(=O)c1cc2c(cc1Br)OCO2 11a_106832991635_100012339479 [0,1,0,0,0,0|3,0,0]=4 305 B15R2.19053 CNC(=O)c1cc2c(cc1Br)OCO2 1626a_100102657272_100012339479 [0,1,0,0,0,0|3,0,0]=4 306 B15R2.19053 CNC(=O)c1cc2c(cc1Br)OCO2 240690a_100102657272_100012339479 [0,1,0,0,0,0|3,0,0]=4 307 B15R2.19053 CNC(=O)c1cc2c(cc1Br)OCO2 527a_100102657272_100012339479 [0,1,0,0,0,0|3,0,0]=4 308 B15R2.19053 COC(=O)c1cc2[nH]ccc2cc1O 271570a_203496583355_100010253482 [0,1,0,0,0,0|0,0,2]=3 309 B15R2.19053 COC(=O)c1cc2[nH]ncc2cc1O 271570a_203496583355_100010206789 [0,1,0,0,0,0|1,0,1]=3 310 B15R2.19053 COC(=O)c1cc2c(cc1O)OCO2 271570a_203496583355_100010164243 [0,1,0,0,0,0|2,0,0]=3 311 B15R2.19053 COC(=O)c1cc2cc[nH]c2cc1O 271570a_203496583355_100010253485 [0,1,0,0,0,0|2,0,1]=4 312 B15R2.19053 COC(=O)c1cc2cn[nH]c2cc1O 271570a_203496583355_100010725067 [0,1,0,0,0,0|3,0,0]=4 313 B15R2.19053 COC(=O)c1nc2[nH]ccc2cc1O 271570a_203496583355_100010295714 [0,1,0,0,0,0|1,0,2]=4 314 B15R2.19098 CCC(=O)c1ccc2ccn(c2c1)C 1458a_100011912540_100000210202 [0,1,0,0,0,0|1,0,2]=4 315 B15R2.19098 CCC(=O)c1ccc2cnn(c2c1)C 1458a_100000101029_100000210202 [0,1,0,0,0,0|2,0,1]=4 316 B15R2.19098 CCC(=O)c1ccc2ncn(c2c1)C 1458a_100012001983_100000210202 [0,1,0,0,0,0|2,0,1]=4 317 B15R2.19098 CNC(=O)c1ccc2ccn(c2c1)C 11a_106832991635_100011912540 [0,1,0,0,0,0|1,0,2]=4 318 B15R2.19098 CNC(=O)c1ccc2ccn(c2c1)C 1626a_100102657272_100011912540 [0,1,0,0,0,0|1,0,2]=4 319 B15R2.19098 CNC(=O)c1ccc2ccn(c2c1)C 240690a_100102657272_100011912540 [0,1,0,0,0,0|1,0,2]=4 320 B15R2.19098 CNC(=O)c1ccc2ccn(c2c1)C 527a_100102657272_100011912540 [0,1,0,0,0,0|1,0,2]=4 321 B15R2.19098 CNC(=O)c1ccc2cnn(c2c1)C 11a_106832991635_100000101029 [0,1,0,0,0,0|2,0,1]=4 322 B15R2.19098 CNC(=O)c1ccc2cnn(c2c1)C 1626a_100102657272_100000101029 [0,1,0,0,0,0|2,0,1]=4 323 B15R2.19098 CNC(=O)c1ccc2cnn(c2c1)C 240690a_100102657272_100000101029 [0,1,0,0,0,0|2,0,1]=4 324 B15R2.19098 CNC(=O)c1ccc2cnn(c2c1)C 527a_100102657272_100000101029 [0,1,0,0,0,0|2,0,1]=4 325 B15R2.19098 CNC(=O)c1ccc2ncn(c2c1)C 1626a_100102657272_100012001983 [0,1,0,0,0,0|2,0,1]=4 326 B15R2.19098 CNC(=O)c1ccc2ncn(c2c1)C 240690a_100102657272_100012001983 [0,1,0,0,0,0|2,0,1]=4 327 B15R2.19098 CNC(=O)c1ccc2ncn(c2c1)C 527a_100102657272_100012001983 [0,1,0,0,0,0|2,0,1]=4 328 B15R2.19098 COC(=O)c1ccc2[nH]cc(c2c1)O 271570a_203496583355_100010163954 [0,1,0,0,0,0|2,0,1]=4 329 B15R2.19098 COC(=O)c1ccc2[nH]nc(c2c1)O 271570a_203496583355_100010233916 [0,1,0,0,0,0|3,0,0]=4 330 B15R2.19280 CCC(=O)c1ccc2c(c1)CC(O2)C 1458a_100000189409_100000210202 [0,1,0,0,0,0|3,0,0]=4 331 B15R2.19280 CCC(=O)c1ccc2cc([nH]c2c1)C 1458a_100009852829_100000210202 [0,1,0,0,0,0|1,0,2]=4 332 B15R2.19280 CCC(=O)c1ccc2oc(=O)[nH]c2c1 1458a_100000724434_100000210202 [0,1,0,0,0,0|2,0,1]=4 333 B15R2.19280 CNC(=O)c1ccc2[nH]c(=O)[nH]c2c1 240690a_100102657272_100000238528 [0,1,0,0,0,0|2,0,1]=4 334 B15R2.19280 CNC(=O)c1ccc2[nH]c(=O)[nH]c2c1 527a_100102657272_100000238528 [0,1,0,0,0,0|2,0,1]=4 335 B15R2.19280 CNC(=O)c1ccc2c(c1)CC(O2)C 11a_106832991635_100000189409 [0,1,0,0,0,0|3,0,0]=4 336 B15R2.19280 CNC(=O)c1ccc2c(c1)CC(O2)C 1626a_100102657272_100000189409 [0,1,0,0,0,0|3,0,0]=4 337 B15R2.19280 CNC(=O)c1ccc2c(c1)CC(O2)C 240690a_100102657272_100000189409 [0,1,0,0,0,0|3,0,0]=4 338 B15R2.19280 CNC(=O)c1ccc2c(c1)CC(O2)C 527a_100102657272_100000189409 [0,1,0,0,0,0|3,0,0]=4 339 B15R2.19280 CNC(=O)c1ccc2c(c1)NC(=O)C2 527a_100102657272_100015205845 [0,1,0,0,0,0|1,0,1]=3 340 B15R2.19280 CNC(=O)c1ccc2cc([nH]c2c1)C 11a_106832991635_100009852829 [0,1,0,0,0,0|1,0,2]=4 341 B15R2.19280 CNC(=O)c1ccc2cc([nH]c2c1)C 240690a_100102657272_100009852829 [0,1,0,0,0,0|1,0,2]=4 342 B15R2.19280 CNC(=O)c1ccc2cc([nH]c2c1)C 527a_100102657272_100009852829 [0,1,0,0,0,0|1,0,2]=4 343 B15R2.19280 CNC(=O)c1ccc2oc(=O)[nH]c2c1 240690a_100102657272_100000724434 [0,1,0,0,0,0|2,0,1]=4 344 B15R2.19280 CNC(=O)c1ccc2oc(=O)[nH]c2c1 527a_100102657272_100000724434 [0,1,0,0,0,0|2,0,1]=4 345 B15R2.19280 COC(=O)c1ccc2c(c1)CN(C2)C 2230a_100000752899_200000210301 [0,1,0,0,0,0|2,0,0]=3 346 B15R2.19280 COC(=O)c1ccc2c(c1)CN(C2)C 269982a_100000752899_200000210301 [0,1,0,0,0,0|2,0,0]=3 347 B15R2.19280 COC(=O)c1ccc2c(c1)CN(C2)C 34a_100000752899_200000210301 [0,1,0,0,0,0|2,0,0]=3 348 B15R2.19280 COC(=O)c1ccc2c(c1)CN(C2)[13CH3] 2230a_100000752899_200025704644 [0,1,0,0,0,0|2,0,0]=3 349 B15R2.19280 COC(=O)c1ccc2c(c1)CN(C2)[13CH3] 269982a_100000752899_200025704644 [0,1,0,0,0,0|2,0,0]=3 350 B15R2.19280 COC(=O)c1ccc2c(c1)CN(C2)[13CH3] 34a_100000752899_200025704644 [0,1,0,0,0,0|2,0,0]=3 351 B15R2.19280 COC(=O)c1ccc2nc(sc2c1)O 271570a_203496583355_100010075092 [0,1,0,0,0,0|2,0,1]=4 352 B15R2.19363 CCC(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_100000210202 [0,1,0,0,0,0|3,0,0]=4 353 B15R2.19363 CCC(=O)c1cc(c2cc[nH]c2c1)Br 1458a_100102525212_100000210202 [0,1,0,0,0,0|1,0,2]=4 354 B15R2.19363 CCC(=O)c1cc(c2cc[nH]c2c1)C 1458a_200015282437_100000210202 [0,1,0,0,0,0|1,0,2]=4 355 B15R2.19363 CCC(=O)c1cc(c2cc[nH]c2c1)Cl 1458a_100000086644_100000210202 [0,1,0,0,0,0|1,0,2]=4 356 B15R2.19363 CCC(=O)c1cc(c2cc[nH]c2c1)F 1458a_100000086646_100000210202 [0,1,0,0,0,0|1,0,2]=4 357 B15R2.19363 CCC(=O)c1cc(c2cn[nH]c2c1)Br 1458a_100102524947_100000210202 [0,1,0,0,0,0|2,0,1]=4 358 B15R2.19363 CCC(=O)c1cc(c2cn[nH]c2c1)Cl 1458a_200000086664_100000210202 [0,1,0,0,0,0|2,0,1]=4 359 B15R2.19363 CCC(=O)c1cc(c2cn[nH]c2c1)F 1458a_100000086653_100000210202 [0,1,0,0,0,0|2,0,1]=4 360 B15R2.19363 CNC(=O)c1cc(c2c(c1)OCO2)Br 11a_106832991635_100000744664 [0,1,0,0,0,0|3,0,0]=4 361 B15R2.19363 CNC(=O)c1cc(c2c(c1)OCO2)Br 1626a_100102657272_100000744664 [0,1,0,0,0,0|3,0,0]=4 362 B15R2.19363 CNC(=O)c1cc(c2c(c1)OCO2)Br 240690a_100102657272_100000744664 [0,1,0,0,0,0|3,0,0]=4 363 B15R2.19363 CNC(=O)c1cc(c2c(c1)OCO2)Br 527a_100102657272_100000744664 [0,1,0,0,0,0|3,0,0]=4 364 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)Br 11a_106832991635_100102525212 [0,1,0,0,0,0|1,0,2]=4 365 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)Br 240690a_100102657272_100102525212 [0,1,0,0,0,0|1,0,2]=4 366 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)Br 527a_100102657272_100102525212 [0,1,0,0,0,0|1,0,2]=4 367 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)C 11a_106832991635_200015282437 [0,1,0,0,0,0|1,0,2]=4 368 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)C 240690a_100102657272_200015282437 [0,1,0,0,0,0|1,0,2]=4 369 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)C 527a_100102657272_200015282437 [0,1,0,0,0,0|1,0,2]=4 370 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)Cl 11a_106832991635_100000086644 [0,1,0,0,0,0|1,0,2]=4 371 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)Cl 240690a_100102657272_100000086644 [0,1,0,0,0,0|1,0,2]=4 372 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)Cl 527a_100102657272_100000086644 [0,1,0,0,0,0|1,0,2]=4 373 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)F 11a_106832991635_100000086646 [0,1,0,0,0,0|1,0,2]=4 374 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)F 240690a_100102657272_100000086646 [0,1,0,0,0,0|1,0,2]=4 375 B15R2.19363 CNC(=O)c1cc(c2cc[nH]c2c1)F 527a_100102657272_100000086646 [0,1,0,0,0,0|1,0,2]=4 376 B15R2.19363 CNC(=O)c1cc(c2cn[nH]c2c1)Br 240690a_100102657272_100102524947 [0,1,0,0,0,0|2,0,1]=4 377 B15R2.19363 CNC(=O)c1cc(c2cn[nH]c2c1)Br 527a_100102657272_100102524947 [0,1,0,0,0,0|2,0,1]=4 378 B15R2.19363 CNC(=O)c1cc(c2cn[nH]c2c1)Cl 240690a_100102657272_200000086664 [0,1,0,0,0,0|2,0,1]=4 379 B15R2.19363 CNC(=O)c1cc(c2cn[nH]c2c1)Cl 527a_100102657272_200000086664 [0,1,0,0,0,0|2,0,1]=4 380 B15R2.19363 CNC(=O)c1cc(c2cn[nH]c2c1)F 240690a_100102657272_100000086653 [0,1,0,0,0,0|2,0,1]=4 381 B15R2.19363 CNC(=O)c1cc(c2cn[nH]c2c1)F 527a_100102657272_100000086653 [0,1,0,0,0,0|2,0,1]=4 382 B15R2.19363 COC(=O)c1cc(c2[nH]ccc2c1)O 271570a_203496583355_100000708014 [0,1,0,0,0,0|2,0,1]=4 383 B15R2.19363 COC(=O)c1cc(c2[nH]cnc2c1)O 271570a_203496583355_200010271411 [0,1,0,0,0,0|1,0,2]=4 384 B15R2.19363 COC(=O)c1cc(c2[nH]ncc2c1)O 271570a_203496583355_100010687428 [0,1,0,0,0,0|3,0,0]=4 385 B15R2.19363 COC(=O)c1cc(c2[nH]nnc2c1)O 271570a_203496583355_100010271418 [0,1,0,0,0,0|2,0,1]=4 386 B15R2.19363 COC(=O)c1cc(c2c(c1)CCO2)O 271570a_203496583355_100021627132 [0,1,0,0,0,0|2,0,0]=3 387 B15R2.19363 COC(=O)c1cc(c2c(c1)NCC2)O 271570a_203496583355_103439830445 [0,1,0,0,0,0|0,0,0]=1 388 B15R2.19363 COC(=O)c1cc(c2cc[nH]c2c1)O 271570a_203496583355_100102524955 [0,1,0,0,0,0|0,0,2]=3 389 B15R2.19363 COC(=O)c1cc(c2cn[nH]c2c1)O 271570a_203496583355_100010177789 [0,1,0,0,0,0|1,0,1]=3 390 B15R2.79412 CCC(=O)c1ccc2c(c1)CCN2C 1458a_100000708782_100000210202 [0,1,0,0,0,0|3,0,0]=4 391 B15R2.79412 CCC(=O)c1ccc2c(c[nH]c2c1)Br 1458a_100010235667_100000210202 [0,1,0,0,0,0|1,0,2]=4 392 B15R2.79412 CCC(=O)c1ccc2c(n[nH]c2c1)Br 1458a_100012355686_100000210202 [0,1,0,0,0,0|2,0,1]=4 393 B15R2.79412 CCC(=O)c1ccc2c(n[nH]c2c1)I 1458a_100010238549_100000210202 [0,1,0,0,0,0|2,0,1]=4 394 B15R2.79412 CNC(=O)c1ccc2c(c1)CCN2C 11a_106832991635_100000708782 [0,1,0,0,0,0|3,0,0]=4 395 B15R2.79412 CNC(=O)c1ccc2c(c1)CCN2C 1626a_100102657272_100000708782 [0,1,0,0,0,0|3,0,0]=4 396 B15R2.79412 CNC(=O)c1ccc2c(c1)CCN2C 240690a_100102657272_100000708782 [0,1,0,0,0,0|3,0,0]=4 397 B15R2.79412 CNC(=O)c1ccc2c(c1)CCN2C 527a_100102657272_100000708782 [0,1,0,0,0,0|3,0,0]=4 398 B15R2.79412 CNC(=O)c1ccc2c(c[nH]c2c1)Br 11a_106832991635_100010235667 [0,1,0,0,0,0|1,0,2]=4 399 B15R2.79412 CNC(=O)c1ccc2c(c[nH]c2c1)Br 240690a_100102657272_100010235667 [0,1,0,0,0,0|1,0,2]=4 400 B15R2.79412 CNC(=O)c1ccc2c(c[nH]c2c1)Br 527a_100102657272_100010235667 [0,1,0,0,0,0|1,0,2]=4 401 B15R2.79412 CNC(=O)c1ccc2c(n[nH]c2c1)Br 240690a_100102657272_100012355686 [0,1,0,0,0,0|2,0,1]=4 402 B15R2.79412 CNC(=O)c1ccc2c(n[nH]c2c1)Br 527a_100102657272_100012355686 [0,1,0,0,0,0|2,0,1]=4 403 B15R2.79412 CNC(=O)c1ccc2c(n[nH]c2c1)I 240690a_100102657272_100010238549 [0,1,0,0,0,0|2,0,1]=4 404 B15R2.79412 CNC(=O)c1ccc2c(n[nH]c2c1)I 527a_100102657272_100010238549 [0,1,0,0,0,0|2,0,1]=4 405 B15R2.79412 COC(=O)c1ccc2c(c[nH]c2c1)O 271570a_203496583355_100010236148 [0,1,0,0,0,0|0,0,2]=3 406 B15R2.79412 COC(=O)c1ccc2c(c[nH]c2n1)O 271570a_203496583355_100010295719 [0,1,0,0,0,0|1,0,2]=4 407 B15R2.79412 COC(=O)c1ccc2c(n[nH]c2c1)O 271570a_203496583355_100010186053 [0,1,0,0,0,0|1,0,1]=3 408 B15R2.79412 COC(=O)c1cnc2c(c[nH]c2c1)O 271570a_203496583355_100010168563 [0,1,0,0,0,0|1,0,2]=4 409 B15R2.79412 COC(=O)c1cnc2c(n[nH]c2c1)O 271570a_203496583355_100010289626 [0,1,0,0,0,0|2,0,1]=4 410 B13R1.49 C#Cc1cc(ccc1C)C(=O)CC 1458a_200012278110_100000210202 [0,0,1,0,0,0|2,0,1]=4 411 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 11a_106832991635_200012278110 [0,0,1,0,0,0|2,0,1]=4 412 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 1626a_100102657272_200012278110 [0,0,1,0,0,0|2,0,1]=4 413 B13R1.49 C#Cc1cc(ccc1C)C(=O)NC 527a_100102657272_200012278110 [0,0,1,0,0,0|2,0,1]=4 414 B13R1.49 C=Cc1cc(ccc1Br)C(=O)OC 271570a_100011290941_100012349818 [0,0,1,0,0,0|2,0,1]=4 415 B13R1.49 C=Cc1cc(ccc1C)C(=O)OC 271570a_100011290941_100011218856 [0,0,1,0,0,0|1,0,1]=3 416 B13R1.49 C=Cc1cc(ccc1Cl)C(=O)OC 271570a_100011290941_100011294800 [0,0,1,0,0,0|2,0,1]=4 417 B13R1.49 C=Cc1cc(ccc1F)C(=O)OC 271570a_100011290941_100000722584 [0,0,1,0,0,0|2,0,1]=4 418 B13R1.49 C=Cc1cc(ccc1N)C(=O)OC 271570a_100011290941_100000187552 [0,0,1,0,0,0|2,0,1]=4 419 B13R1.49 C=Cc1cc(ccc1O)C(=O)OC 271570a_100011290941_100000216328 [0,0,1,0,0,0|2,0,1]=4 420 B13R1.49 C=Cc1cc(ncc1C)C(=O)OC 271570a_100011290941_100000065005 [0,0,1,0,0,0|2,0,1]=4 421 B13R1.49 C=Cc1nc(ccc1C)C(=O)OC 271570a_100011290941_100010143800 [0,0,1,0,0,0|2,0,1]=4 422 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Br 1458a_100010152358_100000210202 [0,0,1,0,0,0|3,0,0]=4 423 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Cl 1458a_100000102533_100000210202 [0,0,1,0,0,0|3,0,0]=4 424 B13R1.49 CCC(=O)c1ccc(c(c1)CC)F 1458a_100009883079_100000210202 [0,0,1,0,0,0|3,0,0]=4 425 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210202 [0,0,1,0,0,0|3,0,0]=4 426 B13R1.49 CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210202 [0,0,1,0,0,0|2,0,0]=3 427 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210202 [0,0,1,0,0,0|3,0,0]=4 428 B13R1.49 CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210202 [0,0,1,0,0,0|3,0,0]=4 429 B13R1.49 CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210202 [0,0,1,0,0,0|3,0,0]=4 430 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [0,0,1,0,0,0|3,0,0]=4 431 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_100011216493_200000210301 [0,0,1,0,0,0|3,0,0]=4 432 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100011216493 [0,0,1,0,0,0|3,0,0]=4 433 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_100011216493_200025704644 [0,0,1,0,0,0|3,0,0]=4 434 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011216493 [0,0,1,0,0,0|3,0,0]=4 435 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 11a_106832991635_100010152358 [0,0,1,0,0,0|3,0,0]=4 436 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 1626a_100102657272_100010152358 [0,0,1,0,0,0|3,0,0]=4 437 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 240690a_100102657272_100010152358 [0,0,1,0,0,0|3,0,0]=4 438 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 527a_100102657272_100010152358 [0,0,1,0,0,0|3,0,0]=4 439 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 11a_106832991635_100000102533 [0,0,1,0,0,0|3,0,0]=4 440 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 1626a_100102657272_100000102533 [0,0,1,0,0,0|3,0,0]=4 441 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 240690a_100102657272_100000102533 [0,0,1,0,0,0|3,0,0]=4 442 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 527a_100102657272_100000102533 [0,0,1,0,0,0|3,0,0]=4 443 B13R1.49 CCc1cc(ccc1F)C(=O)NC 11a_106832991635_100009883079 [0,0,1,0,0,0|3,0,0]=4 444 B13R1.49 CCc1cc(ccc1F)C(=O)NC 1626a_100102657272_100009883079 [0,0,1,0,0,0|3,0,0]=4 445 B13R1.49 CCc1cc(ccc1F)C(=O)NC 240690a_100102657272_100009883079 [0,0,1,0,0,0|3,0,0]=4 446 B13R1.49 CCc1cc(ccc1F)C(=O)NC 527a_100102657272_100009883079 [0,0,1,0,0,0|3,0,0]=4 447 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 2230a_100000737617_200000210301 [0,0,1,0,0,0|1,0,0]=2 448 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 34a_100000737617_200000210301 [0,0,1,0,0,0|1,0,0]=2 449 B13R1.49 CNC(=O)c1ccc(c(c1)NC)C 7a_100000737617_200000210301 [0,0,1,0,0,0|1,0,0]=2 450 B13R1.49 CNC(=O)c1ccc(c(c1)NC)Cl 34a_100000740709_200000210301 [0,0,1,0,0,0|2,0,0]=3 451 B13R1.49 CNC(=O)c1ccc(c(c1)NC)F 27a_100102657272_200012359898 [0,0,1,0,0,0|2,0,0]=3 452 B13R1.49 CNC(=O)c1ccc(c(c1)NC)F 34a_100011295210_200000210301 [0,0,1,0,0,0|2,0,0]=3 453 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 2230a_100000737617_200025704644 [0,0,1,0,0,0|1,0,0]=2 454 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 34a_100000737617_200025704644 [0,0,1,0,0,0|1,0,0]=2 455 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])C 7a_100000737617_200025704644 [0,0,1,0,0,0|1,0,0]=2 456 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])Cl 34a_100000740709_200025704644 [0,0,1,0,0,0|2,0,0]=3 457 B13R1.49 CNC(=O)c1ccc(c(c1)N[13CH3])F 34a_100011295210_200025704644 [0,0,1,0,0,0|2,0,0]=3 458 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 11a_106832991635_100011934951 [0,0,1,0,0,0|3,0,0]=4 459 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 1626a_100102657272_100011934951 [0,0,1,0,0,0|3,0,0]=4 460 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 240690a_100102657272_100011934951 [0,0,1,0,0,0|3,0,0]=4 461 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 527a_100102657272_100011934951 [0,0,1,0,0,0|3,0,0]=4 462 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 11a_106832991635_100000212341 [0,0,1,0,0,0|2,0,0]=3 463 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 1626a_100102657272_100000212341 [0,0,1,0,0,0|2,0,0]=3 464 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 240690a_100102657272_100000212341 [0,0,1,0,0,0|2,0,0]=3 465 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 527a_100102657272_100000212341 [0,0,1,0,0,0|2,0,0]=3 466 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 11a_106832991635_100000181799 [0,0,1,0,0,0|3,0,0]=4 467 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 1626a_100102657272_100000181799 [0,0,1,0,0,0|3,0,0]=4 468 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 240690a_100102657272_100000181799 [0,0,1,0,0,0|3,0,0]=4 469 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 527a_100102657272_100000181799 [0,0,1,0,0,0|3,0,0]=4 470 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 11a_106832991635_100000757635 [0,0,1,0,0,0|3,0,0]=4 471 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 1626a_100102657272_100000757635 [0,0,1,0,0,0|3,0,0]=4 472 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 240690a_100102657272_100000757635 [0,0,1,0,0,0|3,0,0]=4 473 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 527a_100102657272_100000757635 [0,0,1,0,0,0|3,0,0]=4 474 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 11a_106832991635_100012356290 [0,0,1,0,0,0|3,0,0]=4 475 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 1626a_100102657272_100012356290 [0,0,1,0,0,0|3,0,0]=4 476 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 240690a_100102657272_100012356290 [0,0,1,0,0,0|3,0,0]=4 477 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 527a_100102657272_100012356290 [0,0,1,0,0,0|3,0,0]=4 478 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [0,0,1,0,0,0|3,0,0]=4 479 B13R1.49 CNC(=O)c1ccc(c(c1)SC)F 62a_200000210301_200012359898 [0,0,1,0,0,0|3,0,0]=4 480 B13R1.49 CNC(=O)c1ccc(c(c1)SC)F 62a_200012359898_200000210301 [0,0,1,0,0,0|3,0,0]=4 481 B13R1.49 CNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200012359898_200025704644 [0,0,1,0,0,0|3,0,0]=4 482 B13R1.49 CNC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_200012359898 [0,0,1,0,0,0|3,0,0]=4 483 B13R1.49 CNc1cc(cnc1F)C(=O)OC 27a_100102657272_100000117919 [0,0,1,0,0,0|2,0,0]=3 484 B13R1.49 CNc1nc(cnc1C)C(=O)OC 27a_100102657272_200010778766 [0,0,1,0,0,0|2,0,0]=3 485 B13R1.49 CNc1nc(cnc1F)C(=O)OC 27a_100102657272_100010896985 [0,0,1,0,0,0|3,0,0]=4 486 B13R1.49 COC(=O)c1cc(c(cn1)C)SC 62a_100000065005_200000210301 [0,0,1,0,0,0|2,0,0]=3 487 B13R1.49 COC(=O)c1cc(c(cn1)C)SC 62a_200000210301_100000065005 [0,0,1,0,0,0|2,0,0]=3 488 B13R1.49 COC(=O)c1cc(c(cn1)C)S[13CH3] 62a_100000065005_200025704644 [0,0,1,0,0,0|2,0,0]=3 489 B13R1.49 COC(=O)c1cc(c(cn1)C)S[13CH3] 62a_200025704644_100000065005 [0,0,1,0,0,0|2,0,0]=3 490 B13R1.49 COC(=O)c1cc(c(cn1)O)OC 271570a_203496583355_100010136178 [0,0,1,0,0,0|3,0,0]=4 491 B13R1.49 COC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010150795 [0,0,1,0,0,0|3,0,0]=4 492 B13R1.49 COC(=O)c1ccc(c(c1)C=O)O 271570a_203496583355_100012274322 [0,0,1,0,0,0|3,0,0]=4 493 B13R1.49 COC(=O)c1ccc(c(c1)CO)O 271570a_203496583355_100010201863 [0,0,1,0,0,0|3,0,0]=4 494 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 34a_100011934688_200000210301 [0,0,1,0,0,0|2,0,0]=3 495 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 7a_100011934688_200000210301 [0,0,1,0,0,0|2,0,0]=3 496 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 34a_100000736511_200000210301 [0,0,1,0,0,0|1,0,0]=2 497 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 7a_100000736511_200000210301 [0,0,1,0,0,0|1,0,0]=2 498 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 34a_100000103815_200000210301 [0,0,1,0,0,0|2,0,0]=3 499 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 7a_100000103815_200000210301 [0,0,1,0,0,0|2,0,0]=3 500 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 34a_100000062259_200000210301 [0,0,1,0,0,0|2,0,0]=3 501 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 7a_100000062259_200000210301 [0,0,1,0,0,0|2,0,0]=3 502 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 34a_100012350776_200000210301 [0,0,1,0,0,0|2,0,0]=3 503 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 7a_100012350776_200000210301 [0,0,1,0,0,0|2,0,0]=3 504 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 34a_100000757247_200000210301 [0,0,1,0,0,0|2,0,0]=3 505 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 7a_100000757247_200000210301 [0,0,1,0,0,0|2,0,0]=3 506 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [0,0,1,0,0,0|2,0,0]=3 507 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 34a_100011934688_200025704644 [0,0,1,0,0,0|2,0,0]=3 508 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100011934688_200025704644 [0,0,1,0,0,0|2,0,0]=3 509 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000736511_200025704644 [0,0,1,0,0,0|1,0,0]=2 510 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000736511_200025704644 [0,0,1,0,0,0|1,0,0]=2 511 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 34a_100000103815_200025704644 [0,0,1,0,0,0|2,0,0]=3 512 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 7a_100000103815_200025704644 [0,0,1,0,0,0|2,0,0]=3 513 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000062259_200025704644 [0,0,1,0,0,0|2,0,0]=3 514 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000062259_200025704644 [0,0,1,0,0,0|2,0,0]=3 515 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 34a_100012350776_200025704644 [0,0,1,0,0,0|2,0,0]=3 516 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 7a_100012350776_200025704644 [0,0,1,0,0,0|2,0,0]=3 517 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 34a_100000757247_200025704644 [0,0,1,0,0,0|2,0,0]=3 518 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000757247_200025704644 [0,0,1,0,0,0|2,0,0]=3 519 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_100012349818_200000210301 [0,0,1,0,0,0|2,0,0]=3 520 B13R1.49 COC(=O)c1ccc(c(c1)SC)Br 62a_200000210301_100012349818 [0,0,1,0,0,0|2,0,0]=3 521 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_100000723194_200000210301 [0,0,1,0,0,0|1,0,0]=2 522 B13R1.49 COC(=O)c1ccc(c(c1)SC)C 62a_200000210301_100000723194 [0,0,1,0,0,0|1,0,0]=2 523 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_100011294800_200000210301 [0,0,1,0,0,0|2,0,0]=3 524 B13R1.49 COC(=O)c1ccc(c(c1)SC)Cl 62a_200000210301_100011294800 [0,0,1,0,0,0|2,0,0]=3 525 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_100000722584_200000210301 [0,0,1,0,0,0|2,0,0]=3 526 B13R1.49 COC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100000722584 [0,0,1,0,0,0|2,0,0]=3 527 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_100000187552_200000210301 [0,0,1,0,0,0|2,0,0]=3 528 B13R1.49 COC(=O)c1ccc(c(c1)SC)N 62a_200000210301_100000187552 [0,0,1,0,0,0|2,0,0]=3 529 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_100000216328_200000210301 [0,0,1,0,0,0|2,0,0]=3 530 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100000216328 [0,0,1,0,0,0|2,0,0]=3 531 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100012349818_200025704644 [0,0,1,0,0,0|2,0,0]=3 532 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012349818 [0,0,1,0,0,0|2,0,0]=3 533 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_100000723194_200025704644 [0,0,1,0,0,0|1,0,0]=2 534 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100000723194 [0,0,1,0,0,0|1,0,0]=2 535 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_100011294800_200025704644 [0,0,1,0,0,0|2,0,0]=3 536 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011294800 [0,0,1,0,0,0|2,0,0]=3 537 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000722584_200025704644 [0,0,1,0,0,0|2,0,0]=3 538 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000722584 [0,0,1,0,0,0|2,0,0]=3 539 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_100000187552_200025704644 [0,0,1,0,0,0|2,0,0]=3 540 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100000187552 [0,0,1,0,0,0|2,0,0]=3 541 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_100000216328_200025704644 [0,0,1,0,0,0|2,0,0]=3 542 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100000216328 [0,0,1,0,0,0|2,0,0]=3 543 B13R1.49 COC(=O)c1ccc(c(n1)OC)O 271570a_203496583355_100010189641 [0,0,1,0,0,0|3,0,0]=4 544 B13R1.49 COC(=O)c1ccc(c(n1)SC)C 62a_100010143800_200000210301 [0,0,1,0,0,0|2,0,0]=3 545 B13R1.49 COC(=O)c1ccc(c(n1)SC)C 62a_200000210301_100010143800 [0,0,1,0,0,0|2,0,0]=3 546 B13R1.49 COC(=O)c1ccc(c(n1)SC)F 62a_100010189626_200000210301 [0,0,1,0,0,0|3,0,0]=4 547 B13R1.49 COC(=O)c1ccc(c(n1)SC)F 62a_200000210301_100010189626 [0,0,1,0,0,0|3,0,0]=4 548 B13R1.49 COC(=O)c1ccc(c(n1)SC)O 62a_200000210301_200009815348 [0,0,1,0,0,0|3,0,0]=4 549 B13R1.49 COC(=O)c1ccc(c(n1)SC)O 62a_200009815348_200000210301 [0,0,1,0,0,0|3,0,0]=4 550 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])C 62a_100010143800_200025704644 [0,0,1,0,0,0|2,0,0]=3 551 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])C 62a_200025704644_100010143800 [0,0,1,0,0,0|2,0,0]=3 552 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])F 62a_100010189626_200025704644 [0,0,1,0,0,0|3,0,0]=4 553 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])F 62a_200025704644_100010189626 [0,0,1,0,0,0|3,0,0]=4 554 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])O 62a_200009815348_200025704644 [0,0,1,0,0,0|3,0,0]=4 555 B13R1.49 COC(=O)c1ccc(c(n1)S[13CH3])O 62a_200025704644_200009815348 [0,0,1,0,0,0|3,0,0]=4 556 B13R1.49 COC(=O)c1cnc(c(c1)OC)Cl 34a_100009840551_200000210301 [0,0,1,0,0,0|3,0,0]=4 557 B13R1.49 COC(=O)c1cnc(c(c1)OC)Cl 7a_100009840551_200000210301 [0,0,1,0,0,0|3,0,0]=4 558 B13R1.49 COC(=O)c1cnc(c(c1)OC)I 34a_100010999399_200000210301 [0,0,1,0,0,0|3,0,0]=4 559 B13R1.49 COC(=O)c1cnc(c(c1)OC)I 7a_100010999399_200000210301 [0,0,1,0,0,0|3,0,0]=4 560 B13R1.49 COC(=O)c1cnc(c(c1)OC)N 34a_100009857207_200000210301 [0,0,1,0,0,0|3,0,0]=4 561 B13R1.49 COC(=O)c1cnc(c(c1)OC)N 7a_100009857207_200000210301 [0,0,1,0,0,0|3,0,0]=4 562 B13R1.49 COC(=O)c1cnc(c(c1)OC)O 271570a_203496583355_100010074909 [0,0,1,0,0,0|3,0,0]=4 563 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])Cl 34a_100009840551_200025704644 [0,0,1,0,0,0|3,0,0]=4 564 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])Cl 7a_100009840551_200025704644 [0,0,1,0,0,0|3,0,0]=4 565 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])I 34a_100010999399_200025704644 [0,0,1,0,0,0|3,0,0]=4 566 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])I 7a_100010999399_200025704644 [0,0,1,0,0,0|3,0,0]=4 567 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])N 34a_100009857207_200025704644 [0,0,1,0,0,0|3,0,0]=4 568 B13R1.49 COC(=O)c1cnc(c(c1)O[13CH3])N 7a_100009857207_200025704644 [0,0,1,0,0,0|3,0,0]=4 569 B13R1.49 COC(=O)c1cnc(c(c1)SC)Cl 62a_100010188758_200000210301 [0,0,1,0,0,0|3,0,0]=4 570 B13R1.49 COC(=O)c1cnc(c(c1)SC)Cl 62a_200000210301_100010188758 [0,0,1,0,0,0|3,0,0]=4 571 B13R1.49 COC(=O)c1cnc(c(c1)SC)F 62a_100000117919_200000210301 [0,0,1,0,0,0|3,0,0]=4 572 B13R1.49 COC(=O)c1cnc(c(c1)SC)F 62a_200000210301_100000117919 [0,0,1,0,0,0|3,0,0]=4 573 B13R1.49 COC(=O)c1cnc(c(c1)SC)N 62a_100009816800_200000210301 [0,0,1,0,0,0|3,0,0]=4 574 B13R1.49 COC(=O)c1cnc(c(c1)SC)N 62a_200000210301_100009816800 [0,0,1,0,0,0|3,0,0]=4 575 B13R1.49 COC(=O)c1cnc(c(c1)SC)O 62a_100010109663_200000210301 [0,0,1,0,0,0|3,0,0]=4 576 B13R1.49 COC(=O)c1cnc(c(c1)SC)O 62a_200000210301_100010109663 [0,0,1,0,0,0|3,0,0]=4 577 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])Cl 62a_100010188758_200025704644 [0,0,1,0,0,0|3,0,0]=4 578 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])Cl 62a_200025704644_100010188758 [0,0,1,0,0,0|3,0,0]=4 579 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])F 62a_100000117919_200025704644 [0,0,1,0,0,0|3,0,0]=4 580 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])F 62a_200025704644_100000117919 [0,0,1,0,0,0|3,0,0]=4 581 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])N 62a_100009816800_200025704644 [0,0,1,0,0,0|3,0,0]=4 582 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])N 62a_200025704644_100009816800 [0,0,1,0,0,0|3,0,0]=4 583 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])O 62a_100010109663_200025704644 [0,0,1,0,0,0|3,0,0]=4 584 B13R1.49 COC(=O)c1cnc(c(c1)S[13CH3])O 62a_200025704644_100010109663 [0,0,1,0,0,0|3,0,0]=4 585 B13R1.49 COC(=O)c1cnc(c(n1)SC)C 62a_200000210301_200010778766 [0,0,1,0,0,0|3,0,0]=4 586 B13R1.49 COC(=O)c1cnc(c(n1)SC)C 62a_200010778766_200000210301 [0,0,1,0,0,0|3,0,0]=4 587 B13R1.49 COC(=O)c1cnc(c(n1)S[13CH3])C 62a_200010778766_200025704644 [0,0,1,0,0,0|3,0,0]=4 588 B13R1.49 COC(=O)c1cnc(c(n1)S[13CH3])C 62a_200025704644_200010778766 [0,0,1,0,0,0|3,0,0]=4 589 B13R1.49 COC(=O)c1coc(=O)c(c1)SC 62a_100009812866_200000210301 [0,0,1,0,0,0|3,0,0]=4 590 B13R1.49 COC(=O)c1coc(=O)c(c1)SC 62a_200000210301_100009812866 [0,0,1,0,0,0|3,0,0]=4 591 B13R1.49 COC(=O)c1coc(=O)c(c1)S[13CH3] 62a_100009812866_200025704644 [0,0,1,0,0,0|3,0,0]=4 592 B13R1.49 COC(=O)c1coc(=O)c(c1)S[13CH3] 62a_200025704644_100009812866 [0,0,1,0,0,0|3,0,0]=4 593 B13R1.49 COc1cc(ccc1C)C(=O)CF 1458a_100000212341_100015361967 [0,0,1,0,0,0|3,0,0]=4 594 B13R1.49 CSc1cc(ccc1C)C(=O)NN 62a_100000188075_200000210301 [0,0,1,0,0,0|3,0,0]=4 595 B13R1.49 CSc1cc(ccc1C)C(=O)NN 62a_200000210301_100000188075 [0,0,1,0,0,0|3,0,0]=4 596 B13R1.49 Cc1ccc(cc1S[13CH3])C(=O)NN 62a_100000188075_200025704644 [0,0,1,0,0,0|3,0,0]=4 597 B13R1.49 Cc1ccc(cc1S[13CH3])C(=O)NN 62a_200025704644_100000188075 [0,0,1,0,0,0|3,0,0]=4 598 B13R1.139 C=C=Cc1ccc(cc1)C(=O)OC 271570a_100015277604_100000150774 [0,0,1,0,0,0|1,0,2]=4 599 B13R1.139 CC=Cc1ccc(cc1)C(=O)OC 271570a_100016259895_100000150774 [0,0,1,0,0,0|1,0,2]=4 600 B13R1.139 CCC(=O)c1ccc(cc1)CC#N 1458a_100000693995_100000210202 [0,0,1,0,0,0|1,0,2]=4 601 B13R1.139 CCC(=O)c1ccc(cc1)CCO 1458a_100000078963_100000210202 [0,0,1,0,0,0|2,0,0]=3 602 B13R1.139 CCC(=O)c1ccc(cc1)CNC 26a_100102657272_100000212119 [0,0,1,0,0,0|3,0,0]=4 603 B13R1.139 CCC(=O)c1ccc(cc1)COC 1458a_100000189608_100000210202 [0,0,1,0,0,0|3,0,0]=4 604 B13R1.139 CCC(=O)c1ccc(cc1)CSC 1458a_100000175442_100000210202 [0,0,1,0,0,0|3,0,0]=4 605 B13R1.139 CCC(=O)c1ccc(cc1)OCF 34a_100000212119_100015361967 [0,0,1,0,0,0|3,0,0]=4 606 B13R1.139 CCC(=O)c1ccc(cc1)OCF 7a_100000212119_100015361967 [0,0,1,0,0,0|3,0,0]=4 607 B13R1.139 CCC(=O)c1ccc(cc1)SCF 62a_100000211647_100015361967 [0,0,1,0,0,0|3,0,0]=4 608 B13R1.139 CCC(=O)c1ccc(cc1)SCF 62a_100015361967_100000211647 [0,0,1,0,0,0|3,0,0]=4 609 B13R1.139 CCCc1ccc(cc1)C(=O)CC 1458a_100011207308_100000210202 [0,0,1,0,0,0|2,0,0]=3 610 B13R1.139 CCCc1ccc(cc1)C(=O)CF 1458a_100011207308_100015361967 [0,0,1,0,0,0|3,0,0]=4 611 B13R1.139 CCCc1ccc(cc1)C(=O)NC 11a_106832991635_100011207308 [0,0,1,0,0,0|2,0,0]=3 612 B13R1.139 CCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100011207308 [0,0,1,0,0,0|2,0,0]=3 613 B13R1.139 CCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100011207308 [0,0,1,0,0,0|2,0,0]=3 614 B13R1.139 CCCc1ccc(cc1)C(=O)NC 527a_100102657272_100011207308 [0,0,1,0,0,0|2,0,0]=3 615 B13R1.139 CCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210202 [0,0,1,0,0,0|3,0,0]=4 616 B13R1.139 CCNc1ccc(cc1)C(=O)NC 27a_100015525214_100000155074 [0,0,1,0,0,0|3,0,0]=4 617 B13R1.139 CCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210202 [0,0,1,0,0,0|3,0,0]=4 618 B13R1.139 CCNc1ccc(cn1)C(=O)OC 27a_100015525214_100000733799 [0,0,1,0,0,0|3,0,0]=4 619 B13R1.139 CCOc1ccc(cc1)C(=O)CC 1458a_100000181891_100000210202 [0,0,1,0,0,0|3,0,0]=4 620 B13R1.139 CCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210202 [0,0,1,0,0,0|3,0,0]=4 621 B13R1.139 CCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210202 [0,0,1,0,0,0|3,0,0]=4 622 B13R1.139 CCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000181891 [0,0,1,0,0,0|3,0,0]=4 623 B13R1.139 CCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000181891 [0,0,1,0,0,0|3,0,0]=4 624 B13R1.139 CCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000181891 [0,0,1,0,0,0|3,0,0]=4 625 B13R1.139 CCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210202 [0,0,1,0,0,0|3,0,0]=4 626 B13R1.139 CCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000181891 [0,0,1,0,0,0|3,0,0]=4 627 B13R1.139 CCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210202 [0,0,1,0,0,0|3,0,0]=4 628 B13R1.139 CCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210202 [0,0,1,0,0,0|2,0,0]=3 629 B13R1.139 CCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210202 [0,0,1,0,0,0|2,0,0]=3 630 B13R1.139 CCOc1ccc(nc1)C(=O)OC 34a_100011997255_100000210202 [0,0,1,0,0,0|3,0,0]=4 631 B13R1.139 CCOc1ccc(nc1)C(=O)OC 7a_100011997255_100000210202 [0,0,1,0,0,0|3,0,0]=4 632 B13R1.139 CCSc1ccc(cc1)C(=O)CC 1458a_100000244969_100000210202 [0,0,1,0,0,0|3,0,0]=4 633 B13R1.139 CCSc1ccc(cc1)C(=O)CC 62a_100000210202_100000211647 [0,0,1,0,0,0|3,0,0]=4 634 B13R1.139 CCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210202 [0,0,1,0,0,0|3,0,0]=4 635 B13R1.139 CCSc1ccc(cc1)C(=O)NC 11a_106832991635_100000244969 [0,0,1,0,0,0|3,0,0]=4 636 B13R1.139 CCSc1ccc(cc1)C(=O)NC 1626a_100102657272_100000244969 [0,0,1,0,0,0|3,0,0]=4 637 B13R1.139 CCSc1ccc(cc1)C(=O)NC 240690a_100102657272_100000244969 [0,0,1,0,0,0|3,0,0]=4 638 B13R1.139 CCSc1ccc(cc1)C(=O)NC 527a_100102657272_100000244969 [0,0,1,0,0,0|3,0,0]=4 639 B13R1.139 CCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210202 [0,0,1,0,0,0|3,0,0]=4 640 B13R1.139 CCSc1ccc(cc1)C(=O)NC 62a_100000210202_100000155074 [0,0,1,0,0,0|3,0,0]=4 641 B13R1.139 CCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210202 [0,0,1,0,0,0|2,0,0]=3 642 B13R1.139 CCSc1ccc(cc1)C(=O)OC 62a_100000210202_100000150774 [0,0,1,0,0,0|2,0,0]=3 643 B13R1.139 CCSc1ccc(cn1)C(=O)OC 62a_100000210202_100000733799 [0,0,1,0,0,0|3,0,0]=4 644 B13R1.139 CCSc1ccc(cn1)C(=O)OC 62a_100000733799_100000210202 [0,0,1,0,0,0|3,0,0]=4 645 B13R1.139 CCSc1ccc(nc1)C(=O)OC 62a_100000210202_100102712061 [0,0,1,0,0,0|3,0,0]=4 646 B13R1.139 CCSc1ccc(nc1)C(=O)OC 62a_100102712061_100000210202 [0,0,1,0,0,0|3,0,0]=4 647 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 11a_106832991635_100000693995 [0,0,1,0,0,0|1,0,2]=4 648 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 1626a_100102657272_100000693995 [0,0,1,0,0,0|1,0,2]=4 649 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 240690a_100102657272_100000693995 [0,0,1,0,0,0|1,0,2]=4 650 B13R1.139 CNC(=O)c1ccc(cc1)CC#N 527a_100102657272_100000693995 [0,0,1,0,0,0|1,0,2]=4 651 B13R1.139 CNC(=O)c1ccc(cc1)CCO 1626a_100102657272_100000078963 [0,0,1,0,0,0|2,0,0]=3 652 B13R1.139 CNC(=O)c1ccc(cc1)CCO 240690a_100102657272_100000078963 [0,0,1,0,0,0|2,0,0]=3 653 B13R1.139 CNC(=O)c1ccc(cc1)CN[13CH3] 2230a_100000743749_200025704644 [0,0,1,0,0,0|3,0,0]=4 654 B13R1.139 CNC(=O)c1ccc(cc1)CN[13CH3] 34a_100000743749_200025704644 [0,0,1,0,0,0|3,0,0]=4 655 B13R1.139 CNC(=O)c1ccc(cc1)COC 11a_106832991635_100000189608 [0,0,1,0,0,0|3,0,0]=4 656 B13R1.139 CNC(=O)c1ccc(cc1)COC 1626a_100102657272_100000189608 [0,0,1,0,0,0|3,0,0]=4 657 B13R1.139 CNC(=O)c1ccc(cc1)COC 240690a_100102657272_100000189608 [0,0,1,0,0,0|3,0,0]=4 658 B13R1.139 CNC(=O)c1ccc(cc1)COC 34a_100138415774_100000753832 [0,0,1,0,0,0|3,0,0]=4 659 B13R1.139 CNC(=O)c1ccc(cc1)COC 527a_100102657272_100000189608 [0,0,1,0,0,0|3,0,0]=4 660 B13R1.139 CNC(=O)c1ccc(cc1)CSC 11a_106832991635_100000175442 [0,0,1,0,0,0|3,0,0]=4 661 B13R1.139 CNC(=O)c1ccc(cc1)CSC 1626a_100102657272_100000175442 [0,0,1,0,0,0|3,0,0]=4 662 B13R1.139 CNC(=O)c1ccc(cc1)CSC 240690a_100102657272_100000175442 [0,0,1,0,0,0|3,0,0]=4 663 B13R1.139 CNC(=O)c1ccc(cc1)CSC 527a_100102657272_100000175442 [0,0,1,0,0,0|3,0,0]=4 664 B13R1.139 CNC(=O)c1ccc(cc1)CSC 62a_100000753832_200000210301 [0,0,1,0,0,0|3,0,0]=4 665 B13R1.139 CNC(=O)c1ccc(cc1)CSC 62a_200000210301_100000753832 [0,0,1,0,0,0|3,0,0]=4 666 B13R1.139 CNC(=O)c1ccc(cc1)CS[13CH3] 62a_100000753832_200025704644 [0,0,1,0,0,0|3,0,0]=4 667 B13R1.139 CNC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000753832 [0,0,1,0,0,0|3,0,0]=4 668 B13R1.139 CNC(=O)c1ccc(cc1)NCF 34a_100000184841_100015361967 [0,0,1,0,0,0|3,0,0]=4 669 B13R1.139 CNC(=O)c1ccc(cc1)OCF 34a_100000192141_100015361967 [0,0,1,0,0,0|3,0,0]=4 670 B13R1.139 CNC(=O)c1ccc(cc1)OCF 7a_100000192141_100015361967 [0,0,1,0,0,0|3,0,0]=4 671 B13R1.139 CNC(=O)c1ccc(cc1)SCF 62a_100000155074_100015361967 [0,0,1,0,0,0|3,0,0]=4 672 B13R1.139 CNC(=O)c1ccc(cc1)SCF 62a_100015361967_100000155074 [0,0,1,0,0,0|3,0,0]=4 673 B13R1.139 CNCc1ccc(cc1)C(=O)NC 207a_100102657272_100000043907 [0,0,1,0,0,0|3,0,0]=4 674 B13R1.139 CNCc1ccc(cc1)C(=O)NC 2230a_100000743749_200000210301 [0,0,1,0,0,0|3,0,0]=4 675 B13R1.139 CNCc1ccc(cc1)C(=O)NC 2230a_106832991635_100000753832 [0,0,1,0,0,0|3,0,0]=4 676 B13R1.139 CNCc1ccc(cc1)C(=O)NC 270004a_106832991635_100000043907 [0,0,1,0,0,0|3,0,0]=4 677 B13R1.139 CNCc1ccc(cc1)C(=O)NC 34a_100000743749_200000210301 [0,0,1,0,0,0|3,0,0]=4 678 B13R1.139 CNCc1ccc(cc1)C(=O)NC 34a_100102657272_100000753832 [0,0,1,0,0,0|3,0,0]=4 679 B13R1.139 CNCc1ccc(cc1)C(=O)NC 7a_106832991635_100000753832 [0,0,1,0,0,0|3,0,0]=4 680 B13R1.139 CNCc1ccc(cc1)C(=O)OC 2230a_106832991635_100000735637 [0,0,1,0,0,0|2,0,0]=3 681 B13R1.139 CNCc1ccc(cc1)C(=O)OC 26a_100102657272_100000150123 [0,0,1,0,0,0|2,0,0]=3 682 B13R1.139 CNCc1ccc(cc1)C(=O)OC 270004a_106832991635_100000148700 [0,0,1,0,0,0|2,0,0]=3 683 B13R1.139 CNCc1ccc(cc1)C(=O)OC 34a_100102657272_100000735637 [0,0,1,0,0,0|2,0,0]=3 684 B13R1.139 CNCc1ccc(cc1)C(=O)OC 7a_106832991635_100000735637 [0,0,1,0,0,0|2,0,0]=3 685 B13R1.139 CNCc1ccc(cn1)C(=O)OC 2230a_106832991635_100000063545 [0,0,1,0,0,0|3,0,0]=4 686 B13R1.139 CNCc1ccc(cn1)C(=O)OC 270004a_106832991635_100000762506 [0,0,1,0,0,0|3,0,0]=4 687 B13R1.139 CNCc1ccc(cn1)C(=O)OC 34a_100102657272_100010230174 [0,0,1,0,0,0|3,0,0]=4 688 B13R1.139 CNCc1ccc(cn1)C(=O)OC 7a_106832991635_100000063545 [0,0,1,0,0,0|3,0,0]=4 689 B13R1.139 CNCc1ccc(nc1)C(=O)OC 2230a_106832991635_100010177729 [0,0,1,0,0,0|3,0,0]=4 690 B13R1.139 CNCc1ccc(nc1)C(=O)OC 270004a_106832991635_102516457225 [0,0,1,0,0,0|3,0,0]=4 691 B13R1.139 CNCc1ccc(nc1)C(=O)OC 34a_100102657272_100010177729 [0,0,1,0,0,0|3,0,0]=4 692 B13R1.139 CNCc1ccc(nc1)C(=O)OC 7a_106832991635_100010177729 [0,0,1,0,0,0|3,0,0]=4 693 B13R1.139 COC(=O)c1ccc(cc1)CO[13CH3] 34a_100000151488_200025704644 [0,0,1,0,0,0|2,0,0]=3 694 B13R1.139 COC(=O)c1ccc(cc1)CO[13CH3] 7a_100000151488_200025704644 [0,0,1,0,0,0|2,0,0]=3 695 B13R1.139 COC(=O)c1ccc(cc1)CSC 62a_100000735637_200000210301 [0,0,1,0,0,0|2,0,0]=3 696 B13R1.139 COC(=O)c1ccc(cc1)CSC 62a_200000210301_100000187170 [0,0,1,0,0,0|2,0,0]=3 697 B13R1.139 COC(=O)c1ccc(cc1)CS[13CH3] 62a_100000735637_200025704644 [0,0,1,0,0,0|2,0,0]=3 698 B13R1.139 COC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000187170 [0,0,1,0,0,0|2,0,0]=3 699 B13R1.139 COC(=O)c1ccc(cc1)OCF 34a_100000150123_100015361967 [0,0,1,0,0,0|2,0,0]=3 700 B13R1.139 COC(=O)c1ccc(cc1)OCF 7a_100000150123_100015361967 [0,0,1,0,0,0|2,0,0]=3 701 B13R1.139 COC(=O)c1ccc(cc1)SCF 62a_100000150774_100015361967 [0,0,1,0,0,0|2,0,0]=3 702 B13R1.139 COC(=O)c1ccc(cc1)SCF 62a_100015361967_100000150774 [0,0,1,0,0,0|2,0,0]=3 703 B13R1.139 COC(=O)c1ccc(cn1)CO[13CH3] 34a_100009873365_200025704644 [0,0,1,0,0,0|3,0,0]=4 704 B13R1.139 COC(=O)c1ccc(cn1)CO[13CH3] 7a_100009873365_200025704644 [0,0,1,0,0,0|3,0,0]=4 705 B13R1.139 COC(=O)c1ccc(cn1)CSC 62a_100010177729_200000210301 [0,0,1,0,0,0|3,0,0]=4 706 B13R1.139 COC(=O)c1ccc(cn1)CSC 62a_200000210301_100010177729 [0,0,1,0,0,0|3,0,0]=4 707 B13R1.139 COC(=O)c1ccc(cn1)CS[13CH3] 62a_100010177729_200025704644 [0,0,1,0,0,0|3,0,0]=4 708 B13R1.139 COC(=O)c1ccc(cn1)CS[13CH3] 62a_200025704644_100010177729 [0,0,1,0,0,0|3,0,0]=4 709 B13R1.139 COC(=O)c1ccc(cn1)OCF 34a_100011997255_100015361967 [0,0,1,0,0,0|3,0,0]=4 710 B13R1.139 COC(=O)c1ccc(cn1)OCF 7a_100011997255_100015361967 [0,0,1,0,0,0|3,0,0]=4 711 B13R1.139 COC(=O)c1ccc(cn1)SCF 62a_100015361967_100102712061 [0,0,1,0,0,0|3,0,0]=4 712 B13R1.139 COC(=O)c1ccc(cn1)SCF 62a_100102712061_100015361967 [0,0,1,0,0,0|3,0,0]=4 713 B13R1.139 COC(=O)c1ccc(nc1)CO[13CH3] 34a_100000239634_200025704644 [0,0,1,0,0,0|3,0,0]=4 714 B13R1.139 COC(=O)c1ccc(nc1)CSC 62a_100010230174_200000210301 [0,0,1,0,0,0|3,0,0]=4 715 B13R1.139 COC(=O)c1ccc(nc1)CSC 62a_200000210301_100010230174 [0,0,1,0,0,0|3,0,0]=4 716 B13R1.139 COC(=O)c1ccc(nc1)CS[13CH3] 62a_100010230174_200025704644 [0,0,1,0,0,0|3,0,0]=4 717 B13R1.139 COC(=O)c1ccc(nc1)CS[13CH3] 62a_200025704644_100010230174 [0,0,1,0,0,0|3,0,0]=4 718 B13R1.139 COC(=O)c1ccc(nc1)SCF 62a_100000733799_100015361967 [0,0,1,0,0,0|3,0,0]=4 719 B13R1.139 COC(=O)c1ccc(nc1)SCF 62a_100015361967_100000733799 [0,0,1,0,0,0|3,0,0]=4 720 B13R1.139 COCc1ccc(cc1)C(=O)OC 34a_100000151488_200000210301 [0,0,1,0,0,0|2,0,0]=3 721 B13R1.139 COCc1ccc(cc1)C(=O)OC 34a_100138415774_100000735637 [0,0,1,0,0,0|2,0,0]=3 722 B13R1.139 COCc1ccc(cc1)C(=O)OC 7a_100000151488_200000210301 [0,0,1,0,0,0|2,0,0]=3 723 B13R1.139 COCc1ccc(cn1)C(=O)OC 34a_100000239634_200000210301 [0,0,1,0,0,0|3,0,0]=4 724 B13R1.139 COCc1ccc(cn1)C(=O)OC 34a_100138415774_100010230174 [0,0,1,0,0,0|3,0,0]=4 725 B13R1.139 COCc1ccc(nc1)C(=O)OC 34a_100009873365_200000210301 [0,0,1,0,0,0|3,0,0]=4 726 B13R1.139 COCc1ccc(nc1)C(=O)OC 34a_100138415774_100010177729 [0,0,1,0,0,0|3,0,0]=4 727 B13R1.139 COCc1ccc(nc1)C(=O)OC 7a_100009873365_200000210301 [0,0,1,0,0,0|3,0,0]=4 728 B13R1.139 O=C(CF)c1ccc(cc1)CCO 1458a_100000078963_100015361967 [0,0,1,0,0,0|3,0,0]=4 729 B13R1.374 C=C=Cc1cccc(c1)C(=O)OC 271570a_100015277604_100000148679 [0,0,1,0,0,0|1,0,2]=4 730 B13R1.374 CC=Cc1cc(ccn1)C(=O)OC 271570a_100016259895_100011934382 [0,0,1,0,0,0|2,0,1]=4 731 B13R1.374 CC=Cc1cccc(c1)C(=O)CC 271570a_100016259895_100000211677 [0,0,1,0,0,0|2,0,1]=4 732 B13R1.374 CC=Cc1cccc(c1)C(=O)NC 271570a_100016259895_100000155082 [0,0,1,0,0,0|2,0,1]=4 733 B13R1.374 CC=Cc1cccc(c1)C(=O)OC 271570a_100016259895_100000148679 [0,0,1,0,0,0|1,0,1]=3 734 B13R1.374 CC=Cc1cccc(n1)C(=O)OC 271570a_100016259895_100000708286 [0,0,1,0,0,0|2,0,1]=4 735 B13R1.374 CC=Cc1ccnc(c1)C(=O)OC 271570a_100016259895_100000693414 [0,0,1,0,0,0|2,0,1]=4 736 B13R1.374 CC=Cc1cncc(c1)C(=O)OC 271570a_100016259895_100000148912 [0,0,1,0,0,0|2,0,1]=4 737 B13R1.374 CCC(=O)c1cccc(c1)CCO 1458a_100009869812_100000210202 [0,0,1,0,0,0|3,0,0]=4 738 B13R1.374 CCC(=O)c1cccc(c1)CNC 26a_100102657272_100011996911 [0,0,1,0,0,0|3,0,0]=4 739 B13R1.374 CCC(=O)c1cccc(c1)COC 1458a_100000199024_100000210202 [0,0,1,0,0,0|3,0,0]=4 740 B13R1.374 CCC(=O)c1cccc(c1)OCF 34a_100011996911_100015361967 [0,0,1,0,0,0|3,0,0]=4 741 B13R1.374 CCC(=O)c1cccc(c1)OCF 7a_100011996911_100015361967 [0,0,1,0,0,0|3,0,0]=4 742 B13R1.374 CCC(=O)c1cccc(c1)SCF 62a_100000211677_100015361967 [0,0,1,0,0,0|3,0,0]=4 743 B13R1.374 CCC(=O)c1cccc(c1)SCF 62a_100015361967_100000211677 [0,0,1,0,0,0|3,0,0]=4 744 B13R1.374 CCNc1cc(cnn1)C(=O)OC 27a_100015525214_100009862058 [0,0,1,0,0,0|2,0,0]=3 745 B13R1.374 CCNc1cc(ncn1)C(=O)OC 27a_100015525214_100000051410 [0,0,1,0,0,0|2,0,0]=3 746 B13R1.374 CCNc1cccc(c1)C(=O)NC 34a_100000185133_100000210202 [0,0,1,0,0,0|1,0,0]=2 747 B13R1.374 CCNc1cccc(n1)C(=O)NC 27a_100015525214_100000755456 [0,0,1,0,0,0|2,0,0]=3 748 B13R1.374 CCNc1cccc(n1)C(=O)OC 27a_100015525214_100000708286 [0,0,1,0,0,0|1,0,0]=2 749 B13R1.374 CCNc1ccnc(c1)C(=O)NC 27a_100015525214_100000204654 [0,0,1,0,0,0|2,0,0]=3 750 B13R1.374 CCNc1cncc(c1)C(=O)NC 27a_100015525214_200000155086 [0,0,1,0,0,0|2,0,0]=3 751 B13R1.374 CCNc1cncc(n1)C(=O)OC 27a_100015525214_100000765340 [0,0,1,0,0,0|2,0,0]=3 752 B13R1.374 CCNc1nccc(n1)C(=O)OC 27a_100015525214_100000070389 [0,0,1,0,0,0|2,0,0]=3 753 B13R1.374 CCOc1cc(ccn1)C(=O)OC 34a_100138552365_100000210202 [0,0,1,0,0,0|2,0,0]=3 754 B13R1.374 CCOc1cccc(c1)C(=O)CBr 7a_100009813753_100000210202 [0,0,1,0,0,0|3,0,0]=4 755 B13R1.374 CCOc1cccc(c1)C(=O)CC 1458a_100000216331_100000210202 [0,0,1,0,0,0|2,0,0]=3 756 B13R1.374 CCOc1cccc(c1)C(=O)CC 34a_100011996911_100000210202 [0,0,1,0,0,0|2,0,0]=3 757 B13R1.374 CCOc1cccc(c1)C(=O)CC 7a_100011996911_100000210202 [0,0,1,0,0,0|2,0,0]=3 758 B13R1.374 CCOc1cccc(c1)C(=O)CF 1458a_100000216331_100015361967 [0,0,1,0,0,0|3,0,0]=4 759 B13R1.374 CCOc1cccc(c1)C(=O)NC 11a_106832991635_100000216331 [0,0,1,0,0,0|2,0,0]=3 760 B13R1.374 CCOc1cccc(c1)C(=O)NC 1626a_100102657272_100000216331 [0,0,1,0,0,0|2,0,0]=3 761 B13R1.374 CCOc1cccc(c1)C(=O)NC 240690a_100102657272_100000216331 [0,0,1,0,0,0|2,0,0]=3 762 B13R1.374 CCOc1cccc(c1)C(=O)NC 34a_100000159807_100000210202 [0,0,1,0,0,0|2,0,0]=3 763 B13R1.374 CCOc1cccc(c1)C(=O)NC 527a_100102657272_100000216331 [0,0,1,0,0,0|2,0,0]=3 764 B13R1.374 CCOc1cccc(c1)C(=O)NC 7a_100000159807_100000210202 [0,0,1,0,0,0|2,0,0]=3 765 B13R1.374 CCOc1cccc(c1)C(=O)NN 34a_100000184184_100000210202 [0,0,1,0,0,0|3,0,0]=4 766 B13R1.374 CCOc1cccc(c1)C(=O)OC 34a_100000150331_100000210202 [0,0,1,0,0,0|1,0,0]=2 767 B13R1.374 CCOc1cccc(c1)C(=O)OC 7a_100000150331_100000210202 [0,0,1,0,0,0|1,0,0]=2 768 B13R1.374 CCOc1ccnc(c1)C(=O)OC 34a_200020638413_100000210202 [0,0,1,0,0,0|2,0,0]=3 769 B13R1.374 CCOc1cncc(c1)C(=O)OC 34a_100000687108_100000210202 [0,0,1,0,0,0|2,0,0]=3 770 B13R1.374 CCOc1cncc(c1)C(=O)OC 7a_100000687108_100000210202 [0,0,1,0,0,0|2,0,0]=3 771 B13R1.374 CCSc1cc(ccn1)C(=O)NC 62a_100000210202_100011196506 [0,0,1,0,0,0|3,0,0]=4 772 B13R1.374 CCSc1cc(ccn1)C(=O)NC 62a_100011196506_100000210202 [0,0,1,0,0,0|3,0,0]=4 773 B13R1.374 CCSc1cc(ccn1)C(=O)OC 62a_100000210202_100011934382 [0,0,1,0,0,0|2,0,0]=3 774 B13R1.374 CCSc1cc(ccn1)C(=O)OC 62a_100011934382_100000210202 [0,0,1,0,0,0|2,0,0]=3 775 B13R1.374 CCSc1cc(cnn1)C(=O)OC 62a_100000210202_100009862058 [0,0,1,0,0,0|3,0,0]=4 776 B13R1.374 CCSc1cc(cnn1)C(=O)OC 62a_100009862058_100000210202 [0,0,1,0,0,0|3,0,0]=4 777 B13R1.374 CCSc1cc(ncn1)C(=O)OC 62a_100000051410_100000210202 [0,0,1,0,0,0|3,0,0]=4 778 B13R1.374 CCSc1cc(ncn1)C(=O)OC 62a_100000210202_100000051410 [0,0,1,0,0,0|3,0,0]=4 779 B13R1.374 CCSc1cccc(c1)C(=O)C#N 62a_100000210202_100010169886 [0,0,1,0,0,0|3,0,0]=4 780 B13R1.374 CCSc1cccc(c1)C(=O)C=O 62a_100000210202_100000726164 [0,0,1,0,0,0|3,0,0]=4 781 B13R1.374 CCSc1cccc(c1)C(=O)C=O 62a_100000726164_100000210202 [0,0,1,0,0,0|3,0,0]=4 782 B13R1.374 CCSc1cccc(c1)C(=O)CC 62a_100000210202_100000211677 [0,0,1,0,0,0|2,0,0]=3 783 B13R1.374 CCSc1cccc(c1)C(=O)CC 62a_100000211677_100000210202 [0,0,1,0,0,0|2,0,0]=3 784 B13R1.374 CCSc1cccc(c1)C(=O)CN 62a_100000210202_100020587001 [0,0,1,0,0,0|3,0,0]=4 785 B13R1.374 CCSc1cccc(c1)C(=O)CN 62a_100020587001_100000210202 [0,0,1,0,0,0|3,0,0]=4 786 B13R1.374 CCSc1cccc(c1)C(=O)NC 62a_100000155082_100000210202 [0,0,1,0,0,0|2,0,0]=3 787 B13R1.374 CCSc1cccc(c1)C(=O)NC 62a_100000210202_100000155082 [0,0,1,0,0,0|2,0,0]=3 788 B13R1.374 CCSc1cccc(c1)C(=O)NN 62a_100000189783_100000210202 [0,0,1,0,0,0|3,0,0]=4 789 B13R1.374 CCSc1cccc(c1)C(=O)NN 62a_100000210202_100000189783 [0,0,1,0,0,0|3,0,0]=4 790 B13R1.374 CCSc1cccc(c1)C(=O)OC 62a_100000148848_100000210202 [0,0,1,0,0,0|1,0,0]=2 791 B13R1.374 CCSc1cccc(c1)C(=O)OC 62a_100000210202_100000148848 [0,0,1,0,0,0|1,0,0]=2 792 B13R1.374 CCSc1cccc(n1)C(=O)CC 62a_100000210202_100011004013 [0,0,1,0,0,0|3,0,0]=4 793 B13R1.374 CCSc1cccc(n1)C(=O)CC 62a_100011004013_100000210202 [0,0,1,0,0,0|3,0,0]=4 794 B13R1.374 CCSc1cccc(n1)C(=O)NC 62a_100000210202_100000755456 [0,0,1,0,0,0|3,0,0]=4 795 B13R1.374 CCSc1cccc(n1)C(=O)NC 62a_100000755456_100000210202 [0,0,1,0,0,0|3,0,0]=4 796 B13R1.374 CCSc1cccc(n1)C(=O)OC 62a_100000210202_100000708286 [0,0,1,0,0,0|2,0,0]=3 797 B13R1.374 CCSc1cccc(n1)C(=O)OC 62a_100000708286_100000210202 [0,0,1,0,0,0|2,0,0]=3 798 B13R1.374 CCSc1ccnc(c1)C(=O)CC 62a_100000210202_200000094848 [0,0,1,0,0,0|3,0,0]=4 799 B13R1.374 CCSc1ccnc(c1)C(=O)CC 62a_200000094848_100000210202 [0,0,1,0,0,0|3,0,0]=4 800 B13R1.374 CCSc1ccnc(c1)C(=O)NC 62a_100000204654_100000210202 [0,0,1,0,0,0|3,0,0]=4 801 B13R1.374 CCSc1ccnc(c1)C(=O)NC 62a_100000210202_100000204654 [0,0,1,0,0,0|3,0,0]=4 802 B13R1.374 CCSc1ccnc(c1)C(=O)OC 62a_100000210202_100000693414 [0,0,1,0,0,0|2,0,0]=3 803 B13R1.374 CCSc1ccnc(c1)C(=O)OC 62a_100000693414_100000210202 [0,0,1,0,0,0|2,0,0]=3 804 B13R1.374 CCSc1cncc(c1)C(=O)NC 62a_100000210202_200000155086 [0,0,1,0,0,0|3,0,0]=4 805 B13R1.374 CCSc1cncc(c1)C(=O)NC 62a_200000155086_100000210202 [0,0,1,0,0,0|3,0,0]=4 806 B13R1.374 CCSc1cncc(c1)C(=O)OC 62a_100000148912_100000210202 [0,0,1,0,0,0|2,0,0]=3 807 B13R1.374 CCSc1cncc(c1)C(=O)OC 62a_100000210202_100000148912 [0,0,1,0,0,0|2,0,0]=3 808 B13R1.374 CCSc1cncc(n1)C(=O)OC 62a_100000210202_100000765340 [0,0,1,0,0,0|3,0,0]=4 809 B13R1.374 CCSc1cncc(n1)C(=O)OC 62a_100000765340_100000210202 [0,0,1,0,0,0|3,0,0]=4 810 B13R1.374 CCSc1nccc(n1)C(=O)OC 62a_100000070389_100000210202 [0,0,1,0,0,0|3,0,0]=4 811 B13R1.374 CCSc1nccc(n1)C(=O)OC 62a_100000210202_100000070389 [0,0,1,0,0,0|3,0,0]=4 812 B13R1.374 CNC(=O)c1cccc(c1)CCO 1626a_100102657272_100009869812 [0,0,1,0,0,0|3,0,0]=4 813 B13R1.374 CNC(=O)c1cccc(c1)CCO 240690a_100102657272_100009869812 [0,0,1,0,0,0|3,0,0]=4 814 B13R1.374 CNC(=O)c1cccc(c1)COC 11a_106832991635_100000199024 [0,0,1,0,0,0|3,0,0]=4 815 B13R1.374 CNC(=O)c1cccc(c1)COC 1626a_100102657272_100000199024 [0,0,1,0,0,0|3,0,0]=4 816 B13R1.374 CNC(=O)c1cccc(c1)COC 240690a_100102657272_100000199024 [0,0,1,0,0,0|3,0,0]=4 817 B13R1.374 CNC(=O)c1cccc(c1)COC 34a_100138415774_100000755619 [0,0,1,0,0,0|3,0,0]=4 818 B13R1.374 CNC(=O)c1cccc(c1)COC 527a_100102657272_100000199024 [0,0,1,0,0,0|3,0,0]=4 819 B13R1.374 CNC(=O)c1cccc(c1)CSC 62a_100000755619_200000210301 [0,0,1,0,0,0|3,0,0]=4 820 B13R1.374 CNC(=O)c1cccc(c1)CSC 62a_200000210301_100000755619 [0,0,1,0,0,0|3,0,0]=4 821 B13R1.374 CNC(=O)c1cccc(c1)CS[13CH3] 62a_100000755619_200025704644 [0,0,1,0,0,0|3,0,0]=4 822 B13R1.374 CNC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000755619 [0,0,1,0,0,0|3,0,0]=4 823 B13R1.374 CNC(=O)c1cccc(c1)NCF 34a_100000185133_100015361967 [0,0,1,0,0,0|2,0,0]=3 824 B13R1.374 CNC(=O)c1cccc(c1)OCF 34a_100000159807_100015361967 [0,0,1,0,0,0|3,0,0]=4 825 B13R1.374 CNC(=O)c1cccc(c1)OCF 7a_100000159807_100015361967 [0,0,1,0,0,0|3,0,0]=4 826 B13R1.374 CNC(=O)c1cccc(c1)SCF 62a_100000155082_100015361967 [0,0,1,0,0,0|3,0,0]=4 827 B13R1.374 CNC(=O)c1cccc(c1)SCF 62a_100015361967_100000155082 [0,0,1,0,0,0|3,0,0]=4 828 B13R1.374 CNCc1cc(ccn1)C(=O)OC 2230a_106832991635_100020667620 [0,0,1,0,0,0|3,0,0]=4 829 B13R1.374 CNCc1cc(ccn1)C(=O)OC 270004a_106832991635_100009884558 [0,0,1,0,0,0|3,0,0]=4 830 B13R1.374 CNCc1cc(ccn1)C(=O)OC 7a_106832991635_100020667620 [0,0,1,0,0,0|3,0,0]=4 831 B13R1.374 CNCc1cccc(c1)C(=O)NC 2230a_106832991635_100000755619 [0,0,1,0,0,0|3,0,0]=4 832 B13R1.374 CNCc1cccc(c1)C(=O)NC 34a_100102657272_100000755619 [0,0,1,0,0,0|3,0,0]=4 833 B13R1.374 CNCc1cccc(c1)C(=O)NC 7a_106832991635_100000755619 [0,0,1,0,0,0|3,0,0]=4 834 B13R1.374 CNCc1cccc(c1)C(=O)OC 2230a_106832991635_100000184886 [0,0,1,0,0,0|2,0,0]=3 835 B13R1.374 CNCc1cccc(c1)C(=O)OC 26a_100102657272_100000150331 [0,0,1,0,0,0|2,0,0]=3 836 B13R1.374 CNCc1cccc(c1)C(=O)OC 270004a_106832991635_100000687630 [0,0,1,0,0,0|2,0,0]=3 837 B13R1.374 CNCc1cccc(c1)C(=O)OC 34a_100102657272_100000184886 [0,0,1,0,0,0|2,0,0]=3 838 B13R1.374 CNCc1cccc(c1)C(=O)OC 7a_106832991635_100000184886 [0,0,1,0,0,0|2,0,0]=3 839 B13R1.374 CNCc1cccc(n1)C(=O)OC 2230a_106832991635_100000097194 [0,0,1,0,0,0|3,0,0]=4 840 B13R1.374 CNCc1cccc(n1)C(=O)OC 270004a_106832991635_100000085286 [0,0,1,0,0,0|3,0,0]=4 841 B13R1.374 CNCc1cccc(n1)C(=O)OC 34a_100102657272_100010006753 [0,0,1,0,0,0|3,0,0]=4 842 B13R1.374 CNCc1cccc(n1)C(=O)OC 7a_106832991635_100000097194 [0,0,1,0,0,0|3,0,0]=4 843 B13R1.374 CNCc1cncc(c1)C(=O)OC 2230a_106832991635_100020633827 [0,0,1,0,0,0|3,0,0]=4 844 B13R1.374 CNCc1cncc(c1)C(=O)OC 7a_106832991635_100020633827 [0,0,1,0,0,0|3,0,0]=4 845 B13R1.374 COC(=O)c1cc(ccn1)OCF 34a_200020638413_100015361967 [0,0,1,0,0,0|3,0,0]=4 846 B13R1.374 COC(=O)c1cc(ccn1)SCF 62a_100000693414_100015361967 [0,0,1,0,0,0|3,0,0]=4 847 B13R1.374 COC(=O)c1cc(ccn1)SCF 62a_100015361967_100000693414 [0,0,1,0,0,0|3,0,0]=4 848 B13R1.374 COC(=O)c1cccc(c1)CO[13CH3] 34a_100000750316_200025704644 [0,0,1,0,0,0|2,0,0]=3 849 B13R1.374 COC(=O)c1cccc(c1)CO[13CH3] 7a_100000750316_200025704644 [0,0,1,0,0,0|2,0,0]=3 850 B13R1.374 COC(=O)c1cccc(c1)CSC 62a_100000184886_200000210301 [0,0,1,0,0,0|2,0,0]=3 851 B13R1.374 COC(=O)c1cccc(c1)CSC 62a_200000210301_100000184886 [0,0,1,0,0,0|2,0,0]=3 852 B13R1.374 COC(=O)c1cccc(c1)CS[13CH3] 62a_100000184886_200025704644 [0,0,1,0,0,0|2,0,0]=3 853 B13R1.374 COC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000184886 [0,0,1,0,0,0|2,0,0]=3 854 B13R1.374 COC(=O)c1cccc(c1)OCF 34a_100000150331_100015361967 [0,0,1,0,0,0|2,0,0]=3 855 B13R1.374 COC(=O)c1cccc(c1)OCF 7a_100000150331_100015361967 [0,0,1,0,0,0|2,0,0]=3 856 B13R1.374 COC(=O)c1cccc(c1)SCF 62a_100000148848_100015361967 [0,0,1,0,0,0|2,0,0]=3 857 B13R1.374 COC(=O)c1cccc(c1)SCF 62a_100015361967_100000148848 [0,0,1,0,0,0|2,0,0]=3 858 B13R1.374 COC(=O)c1cccc(n1)CSC 62a_100000097194_200000210301 [0,0,1,0,0,0|3,0,0]=4 859 B13R1.374 COC(=O)c1cccc(n1)CSC 62a_200000210301_100010006753 [0,0,1,0,0,0|3,0,0]=4 860 B13R1.374 COC(=O)c1cccc(n1)CS[13CH3] 62a_100000097194_200025704644 [0,0,1,0,0,0|3,0,0]=4 861 B13R1.374 COC(=O)c1cccc(n1)CS[13CH3] 62a_200025704644_100010006753 [0,0,1,0,0,0|3,0,0]=4 862 B13R1.374 COC(=O)c1cccc(n1)SCF 62a_100000708286_100015361967 [0,0,1,0,0,0|3,0,0]=4 863 B13R1.374 COC(=O)c1cccc(n1)SCF 62a_100015361967_100000708286 [0,0,1,0,0,0|3,0,0]=4 864 B13R1.374 COC(=O)c1ccnc(c1)CSC 62a_100020667620_200000210301 [0,0,1,0,0,0|3,0,0]=4 865 B13R1.374 COC(=O)c1ccnc(c1)CSC 62a_200000210301_100020667620 [0,0,1,0,0,0|3,0,0]=4 866 B13R1.374 COC(=O)c1ccnc(c1)CS[13CH3] 62a_100020667620_200025704644 [0,0,1,0,0,0|3,0,0]=4 867 B13R1.374 COC(=O)c1ccnc(c1)CS[13CH3] 62a_200025704644_100020667620 [0,0,1,0,0,0|3,0,0]=4 868 B13R1.374 COC(=O)c1ccnc(c1)OCF 34a_100138552365_100015361967 [0,0,1,0,0,0|3,0,0]=4 869 B13R1.374 COC(=O)c1ccnc(c1)SCF 62a_100011934382_100015361967 [0,0,1,0,0,0|3,0,0]=4 870 B13R1.374 COC(=O)c1ccnc(c1)SCF 62a_100015361967_100011934382 [0,0,1,0,0,0|3,0,0]=4 871 B13R1.374 COC(=O)c1cncc(c1)CO[13CH3] 34a_100009869914_200025704644 [0,0,1,0,0,0|3,0,0]=4 872 B13R1.374 COC(=O)c1cncc(c1)CO[13CH3] 7a_100009869914_200025704644 [0,0,1,0,0,0|3,0,0]=4 873 B13R1.374 COC(=O)c1cncc(c1)CSC 62a_100020633827_200000210301 [0,0,1,0,0,0|3,0,0]=4 874 B13R1.374 COC(=O)c1cncc(c1)CSC 62a_200000210301_100020633827 [0,0,1,0,0,0|3,0,0]=4 875 B13R1.374 COC(=O)c1cncc(c1)CS[13CH3] 62a_100020633827_200025704644 [0,0,1,0,0,0|3,0,0]=4 876 B13R1.374 COC(=O)c1cncc(c1)CS[13CH3] 62a_200025704644_100020633827 [0,0,1,0,0,0|3,0,0]=4 877 B13R1.374 COC(=O)c1cncc(c1)OCF 34a_100000687108_100015361967 [0,0,1,0,0,0|3,0,0]=4 878 B13R1.374 COC(=O)c1cncc(c1)OCF 7a_100000687108_100015361967 [0,0,1,0,0,0|3,0,0]=4 879 B13R1.374 COC(=O)c1cncc(c1)SCF 62a_100000148912_100015361967 [0,0,1,0,0,0|3,0,0]=4 880 B13R1.374 COC(=O)c1cncc(c1)SCF 62a_100015361967_100000148912 [0,0,1,0,0,0|3,0,0]=4 881 B13R1.374 COCc1cccc(c1)C(=O)OC 34a_100000750316_200000210301 [0,0,1,0,0,0|2,0,0]=3 882 B13R1.374 COCc1cccc(c1)C(=O)OC 34a_100138415774_100000184886 [0,0,1,0,0,0|2,0,0]=3 883 B13R1.374 COCc1cccc(c1)C(=O)OC 7a_100000750316_200000210301 [0,0,1,0,0,0|2,0,0]=3 884 B13R1.374 COCc1cccc(n1)C(=O)OC 34a_100138415774_100010006753 [0,0,1,0,0,0|3,0,0]=4 885 B13R1.374 COCc1cncc(c1)C(=O)OC 34a_100009869914_200000210301 [0,0,1,0,0,0|3,0,0]=4 886 B13R1.374 COCc1cncc(c1)C(=O)OC 7a_100009869914_200000210301 [0,0,1,0,0,0|3,0,0]=4 887 B13R1.3088 C=Cc1ccc(cc1Br)C(=O)OC 271570a_100011290941_100011294788 [0,0,1,0,0,0|1,0,2]=4 888 B13R1.3088 C=Cc1ccc(cc1C)C(=O)OC 271570a_100011290941_100011215878 [0,0,1,0,0,0|1,0,2]=4 889 B13R1.3088 C=Cc1ccc(cc1Cl)C(=O)OC 271570a_100011290941_100012356344 [0,0,1,0,0,0|1,0,2]=4 890 B13R1.3088 C=Cc1ccc(cc1F)C(=O)OC 271570a_100011290941_100000703229 [0,0,1,0,0,0|1,0,2]=4 891 B13R1.3088 C=Cc1ccc(cc1N)C(=O)OC 271570a_100011290941_100011450966 [0,0,1,0,0,0|0,0,2]=3 892 B13R1.3088 C=Cc1ccc(cc1O)C(=O)OC 271570a_100011290941_100012350776 [0,0,1,0,0,0|1,0,2]=4 893 B13R1.3088 C=Cc1ccc(nc1N)C(=O)OC 271570a_100011290941_100010187631 [0,0,1,0,0,0|1,0,2]=4 894 B13R1.3088 C=Cc1cnc(cc1N)C(=O)OC 271570a_100011290941_100016001589 [0,0,1,0,0,0|1,0,2]=4 895 B13R1.3088 C=Cc1ncc(cc1N)C(=O)OC 271570a_100011290941_100000079130 [0,0,1,0,0,0|1,0,2]=4 896 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)CC 1458a_100012340589_100000210202 [0,0,1,0,0,0|2,0,0]=3 897 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)OC 1458a_100000187947_100000210202 [0,0,1,0,0,0|3,0,0]=4 898 B13R1.3088 CCC(=O)c1ccc(c(c1)C)OC 1458a_100011202886_100000210202 [0,0,1,0,0,0|3,0,0]=4 899 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200012349626 [0,0,1,0,0,0|3,0,0]=4 900 B13R1.3088 CCC(=O)c1ccc(c(c1)C)SC 62a_200012349626_200000210301 [0,0,1,0,0,0|3,0,0]=4 901 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200012349626_200025704644 [0,0,1,0,0,0|3,0,0]=4 902 B13R1.3088 CCC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200012349626 [0,0,1,0,0,0|3,0,0]=4 903 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 1458a_100000188346_100000210202 [0,0,1,0,0,0|3,0,0]=4 904 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 34a_100011218862_200000210301 [0,0,1,0,0,0|3,0,0]=4 905 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)OC 7a_100011218862_200000210301 [0,0,1,0,0,0|3,0,0]=4 906 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100011218862_200025704644 [0,0,1,0,0,0|3,0,0]=4 907 B13R1.3088 CCC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100011218862_200025704644 [0,0,1,0,0,0|3,0,0]=4 908 B13R1.3088 CCC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_100000210202 [0,0,1,0,0,0|3,0,0]=4 909 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC 1458a_100000186160_100000210202 [0,0,1,0,0,0|3,0,0]=4 910 B13R1.3088 CCC(=O)c1ccc(c(c1)I)OC 1458a_100000188716_100000210202 [0,0,1,0,0,0|3,0,0]=4 911 B13R1.3088 CCC(=O)c1ccc(c(c1)O)CC 1458a_100000089006_100000210202 [0,0,1,0,0,0|2,0,0]=3 912 B13R1.3088 CCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210202 [0,0,1,0,0,0|3,0,0]=4 913 B13R1.3088 CCc1ccc(cc1Br)C(=O)CF 1458a_100012340589_100015361967 [0,0,1,0,0,0|3,0,0]=4 914 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 11a_106832991635_100012340589 [0,0,1,0,0,0|2,0,0]=3 915 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 1626a_100102657272_100012340589 [0,0,1,0,0,0|2,0,0]=3 916 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 240690a_100102657272_100012340589 [0,0,1,0,0,0|2,0,0]=3 917 B13R1.3088 CCc1ccc(cc1Br)C(=O)NC 527a_100102657272_100012340589 [0,0,1,0,0,0|2,0,0]=3 918 B13R1.3088 CCc1ccc(cc1O)C(=O)CF 1458a_100000089006_100015361967 [0,0,1,0,0,0|3,0,0]=4 919 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 240690a_100102657272_100000089006 [0,0,1,0,0,0|2,0,0]=3 920 B13R1.3088 CCc1ccc(cc1O)C(=O)NC 527a_100102657272_100000089006 [0,0,1,0,0,0|2,0,0]=3 921 B13R1.3088 CCc1ccc(cc1O)C(=O)OC 271570a_203496583355_200012360130 [0,0,1,0,0,0|1,0,0]=2 922 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 11a_106832991635_100000187947 [0,0,1,0,0,0|3,0,0]=4 923 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 1626a_100102657272_100000187947 [0,0,1,0,0,0|3,0,0]=4 924 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 240690a_100102657272_100000187947 [0,0,1,0,0,0|3,0,0]=4 925 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC 527a_100102657272_100000187947 [0,0,1,0,0,0|3,0,0]=4 926 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 2230a_100000739472_200000210301 [0,0,1,0,0,0|3,0,0]=4 927 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 27a_100102657272_200013065384 [0,0,1,0,0,0|3,0,0]=4 928 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 34a_100000739472_200000210301 [0,0,1,0,0,0|3,0,0]=4 929 B13R1.3088 CNC(=O)c1ccc(c(c1)C)NC 7a_100000739472_200000210301 [0,0,1,0,0,0|3,0,0]=4 930 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 2230a_100000739472_200025704644 [0,0,1,0,0,0|3,0,0]=4 931 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 34a_100000739472_200025704644 [0,0,1,0,0,0|3,0,0]=4 932 B13R1.3088 CNC(=O)c1ccc(c(c1)C)N[13CH3] 7a_100000739472_200025704644 [0,0,1,0,0,0|3,0,0]=4 933 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 11a_106832991635_100011202886 [0,0,1,0,0,0|3,0,0]=4 934 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 1626a_100102657272_100011202886 [0,0,1,0,0,0|3,0,0]=4 935 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 240690a_100102657272_100011202886 [0,0,1,0,0,0|3,0,0]=4 936 B13R1.3088 CNC(=O)c1ccc(c(c1)C)OC 527a_100102657272_100011202886 [0,0,1,0,0,0|3,0,0]=4 937 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200000210301_200013065384 [0,0,1,0,0,0|3,0,0]=4 938 B13R1.3088 CNC(=O)c1ccc(c(c1)C)SC 62a_200013065384_200000210301 [0,0,1,0,0,0|3,0,0]=4 939 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200013065384_200025704644 [0,0,1,0,0,0|3,0,0]=4 940 B13R1.3088 CNC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_200013065384 [0,0,1,0,0,0|3,0,0]=4 941 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 11a_106832991635_100000188346 [0,0,1,0,0,0|3,0,0]=4 942 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 1626a_100102657272_100000188346 [0,0,1,0,0,0|3,0,0]=4 943 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 240690a_100102657272_100000188346 [0,0,1,0,0,0|3,0,0]=4 944 B13R1.3088 CNC(=O)c1ccc(c(c1)Cl)OC 527a_100102657272_100000188346 [0,0,1,0,0,0|3,0,0]=4 945 B13R1.3088 CNC(=O)c1ccc(c(c1)F)CO 1626a_100102657272_100000687192 [0,0,1,0,0,0|3,0,0]=4 946 B13R1.3088 CNC(=O)c1ccc(c(c1)F)CO 240690a_100102657272_100000687192 [0,0,1,0,0,0|3,0,0]=4 947 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 11a_106832991635_100000186160 [0,0,1,0,0,0|3,0,0]=4 948 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 1626a_100102657272_100000186160 [0,0,1,0,0,0|3,0,0]=4 949 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 240690a_100102657272_100000186160 [0,0,1,0,0,0|3,0,0]=4 950 B13R1.3088 CNC(=O)c1ccc(c(c1)F)OC 527a_100102657272_100000186160 [0,0,1,0,0,0|3,0,0]=4 951 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 11a_106832991635_100000188716 [0,0,1,0,0,0|3,0,0]=4 952 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 1626a_100102657272_100000188716 [0,0,1,0,0,0|3,0,0]=4 953 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 240690a_100102657272_100000188716 [0,0,1,0,0,0|3,0,0]=4 954 B13R1.3088 CNC(=O)c1ccc(c(c1)I)OC 527a_100102657272_100000188716 [0,0,1,0,0,0|3,0,0]=4 955 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 240690a_100102657272_100000766810 [0,0,1,0,0,0|3,0,0]=4 956 B13R1.3088 CNC(=O)c1ccc(c(c1)O)OC 527a_100102657272_100000766810 [0,0,1,0,0,0|3,0,0]=4 957 B13R1.3088 CNc1ccc(nc1F)C(=O)OC 27a_100102657272_100010189630 [0,0,1,0,0,0|3,0,0]=4 958 B13R1.3088 CNc1ncc(cc1Br)C(=O)OC 27a_100102657272_100010114297 [0,0,1,0,0,0|3,0,0]=4 959 B13R1.3088 CNc1ncc(cc1C)C(=O)OC 27a_100102657272_100009862495 [0,0,1,0,0,0|3,0,0]=4 960 B13R1.3088 CNc1ncc(cc1F)C(=O)OC 27a_100102657272_100009877320 [0,0,1,0,0,0|3,0,0]=4 961 B13R1.3088 CNc1ncc(cc1N)C(=O)OC 27a_100102657272_100000079130 [0,0,1,0,0,0|2,0,0]=3 962 B13R1.3088 COC(=O)c1cc(c(cn1)OC)O 271570a_203496583355_200010136175 [0,0,1,0,0,0|3,0,0]=4 963 B13R1.3088 COC(=O)c1cc(c(cn1)SC)C 62a_100010080863_200000210301 [0,0,1,0,0,0|3,0,0]=4 964 B13R1.3088 COC(=O)c1cc(c(cn1)SC)C 62a_200000210301_100010080863 [0,0,1,0,0,0|3,0,0]=4 965 B13R1.3088 COC(=O)c1cc(c(cn1)SC)N 62a_100016001589_200000210301 [0,0,1,0,0,0|2,0,0]=3 966 B13R1.3088 COC(=O)c1cc(c(cn1)SC)N 62a_200000210301_100016001589 [0,0,1,0,0,0|2,0,0]=3 967 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])C 62a_100010080863_200025704644 [0,0,1,0,0,0|3,0,0]=4 968 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])C 62a_200025704644_100010080863 [0,0,1,0,0,0|3,0,0]=4 969 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])N 62a_100016001589_200025704644 [0,0,1,0,0,0|2,0,0]=3 970 B13R1.3088 COC(=O)c1cc(c(cn1)S[13CH3])N 62a_200025704644_100016001589 [0,0,1,0,0,0|2,0,0]=3 971 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 34a_100000216328_200000210301 [0,0,1,0,0,0|2,0,0]=3 972 B13R1.3088 COC(=O)c1ccc(c(c1)Br)OC 7a_100000216328_200000210301 [0,0,1,0,0,0|2,0,0]=3 973 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100000216328_200025704644 [0,0,1,0,0,0|2,0,0]=3 974 B13R1.3088 COC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100000216328_200025704644 [0,0,1,0,0,0|2,0,0]=3 975 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_100011294788_200000210301 [0,0,1,0,0,0|2,0,0]=3 976 B13R1.3088 COC(=O)c1ccc(c(c1)Br)SC 62a_200000210301_100011294788 [0,0,1,0,0,0|2,0,0]=3 977 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100011294788_200025704644 [0,0,1,0,0,0|2,0,0]=3 978 B13R1.3088 COC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100011294788 [0,0,1,0,0,0|2,0,0]=3 979 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 34a_100011997373_200000210301 [0,0,1,0,0,0|2,0,0]=3 980 B13R1.3088 COC(=O)c1ccc(c(c1)C)OC 7a_100011997373_200000210301 [0,0,1,0,0,0|2,0,0]=3 981 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100011997373_200025704644 [0,0,1,0,0,0|2,0,0]=3 982 B13R1.3088 COC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100011997373_200025704644 [0,0,1,0,0,0|2,0,0]=3 983 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_100011215878_200000210301 [0,0,1,0,0,0|2,0,0]=3 984 B13R1.3088 COC(=O)c1ccc(c(c1)C)SC 62a_200000210301_100011215878 [0,0,1,0,0,0|2,0,0]=3 985 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100011215878_200025704644 [0,0,1,0,0,0|2,0,0]=3 986 B13R1.3088 COC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100011215878 [0,0,1,0,0,0|2,0,0]=3 987 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 34a_100000151454_200000210301 [0,0,1,0,0,0|2,0,0]=3 988 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)OC 7a_100000151454_200000210301 [0,0,1,0,0,0|2,0,0]=3 989 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000151454_200025704644 [0,0,1,0,0,0|2,0,0]=3 990 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000151454_200025704644 [0,0,1,0,0,0|2,0,0]=3 991 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_100012356344_200000210301 [0,0,1,0,0,0|2,0,0]=3 992 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)SC 62a_200000210301_100012356344 [0,0,1,0,0,0|2,0,0]=3 993 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_100012356344_200025704644 [0,0,1,0,0,0|2,0,0]=3 994 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_100012356344 [0,0,1,0,0,0|2,0,0]=3 995 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 34a_100000075456_200000210301 [0,0,1,0,0,0|2,0,0]=3 996 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC 7a_100000075456_200000210301 [0,0,1,0,0,0|2,0,0]=3 997 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000075456_200025704644 [0,0,1,0,0,0|2,0,0]=3 998 B13R1.3088 COC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000075456_200025704644 [0,0,1,0,0,0|2,0,0]=3 999 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_100000703229_200000210301 [0,0,1,0,0,0|2,0,0]=3 1000 B13R1.3088 COC(=O)c1ccc(c(c1)F)SC 62a_200000210301_100000703229 [0,0,1,0,0,0|2,0,0]=3 1001 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000703229_200025704644 [0,0,1,0,0,0|2,0,0]=3 1002 B13R1.3088 COC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000703229 [0,0,1,0,0,0|2,0,0]=3 1003 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 34a_100010162523_200000210301 [0,0,1,0,0,0|2,0,0]=3 1004 B13R1.3088 COC(=O)c1ccc(c(c1)I)OC 7a_100010162523_200000210301 [0,0,1,0,0,0|2,0,0]=3 1005 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 34a_100010162523_200025704644 [0,0,1,0,0,0|2,0,0]=3 1006 B13R1.3088 COC(=O)c1ccc(c(c1)I)O[13CH3] 7a_100010162523_200025704644 [0,0,1,0,0,0|2,0,0]=3 1007 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 34a_100000724433_200000210301 [0,0,1,0,0,0|1,0,0]=2 1008 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC 7a_100000724433_200000210301 [0,0,1,0,0,0|1,0,0]=2 1009 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000724433_200025704644 [0,0,1,0,0,0|1,0,0]=2 1010 B13R1.3088 COC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000724433_200025704644 [0,0,1,0,0,0|1,0,0]=2 1011 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_100011450966_200000210301 [0,0,1,0,0,0|1,0,0]=2 1012 B13R1.3088 COC(=O)c1ccc(c(c1)N)SC 62a_200000210301_100011450966 [0,0,1,0,0,0|1,0,0]=2 1013 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100011450966_200025704644 [0,0,1,0,0,0|1,0,0]=2 1014 B13R1.3088 COC(=O)c1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011450966 [0,0,1,0,0,0|1,0,0]=2 1015 B13R1.3088 COC(=O)c1ccc(c(c1)O)C#N 271570a_203496583355_100009861381 [0,0,1,0,0,0|2,0,1]=4 1016 B13R1.3088 COC(=O)c1ccc(c(c1)O)C=O 271570a_203496583355_100012179231 [0,0,1,0,0,0|2,0,1]=4 1017 B13R1.3088 COC(=O)c1ccc(c(c1)O)CO 271570a_203496583355_100012355398 [0,0,1,0,0,0|2,0,0]=3 1018 B13R1.3088 COC(=O)c1ccc(c(c1)O)OC 271570a_203496583355_100000189012 [0,0,1,0,0,0|2,0,0]=3 1019 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_100012350776_200000210301 [0,0,1,0,0,0|2,0,0]=3 1020 B13R1.3088 COC(=O)c1ccc(c(c1)O)SC 62a_200000210301_100012350776 [0,0,1,0,0,0|2,0,0]=3 1021 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_100012350776_200025704644 [0,0,1,0,0,0|2,0,0]=3 1022 B13R1.3088 COC(=O)c1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012350776 [0,0,1,0,0,0|2,0,0]=3 1023 B13R1.3088 COC(=O)c1ccc(c(n1)Br)OC 34a_200009815348_200000210301 [0,0,1,0,0,0|3,0,0]=4 1024 B13R1.3088 COC(=O)c1ccc(c(n1)Br)OC 7a_200009815348_200000210301 [0,0,1,0,0,0|3,0,0]=4 1025 B13R1.3088 COC(=O)c1ccc(c(n1)Br)O[13CH3] 34a_200009815348_200025704644 [0,0,1,0,0,0|3,0,0]=4 1026 B13R1.3088 COC(=O)c1ccc(c(n1)Br)O[13CH3] 7a_200009815348_200025704644 [0,0,1,0,0,0|3,0,0]=4 1027 B13R1.3088 COC(=O)c1ccc(c(n1)C)SC 62a_100010207261_200000210301 [0,0,1,0,0,0|3,0,0]=4 1028 B13R1.3088 COC(=O)c1ccc(c(n1)C)SC 62a_200000210301_100010207261 [0,0,1,0,0,0|3,0,0]=4 1029 B13R1.3088 COC(=O)c1ccc(c(n1)C)S[13CH3] 62a_100010207261_200025704644 [0,0,1,0,0,0|3,0,0]=4 1030 B13R1.3088 COC(=O)c1ccc(c(n1)C)S[13CH3] 62a_200025704644_100010207261 [0,0,1,0,0,0|3,0,0]=4 1031 B13R1.3088 COC(=O)c1ccc(c(n1)F)SC 62a_100010189630_200000210301 [0,0,1,0,0,0|3,0,0]=4 1032 B13R1.3088 COC(=O)c1ccc(c(n1)F)SC 62a_200000210301_100010189630 [0,0,1,0,0,0|3,0,0]=4 1033 B13R1.3088 COC(=O)c1ccc(c(n1)F)S[13CH3] 62a_100010189630_200025704644 [0,0,1,0,0,0|3,0,0]=4 1034 B13R1.3088 COC(=O)c1ccc(c(n1)F)S[13CH3] 62a_200025704644_100010189630 [0,0,1,0,0,0|3,0,0]=4 1035 B13R1.3088 COC(=O)c1ccc(c(n1)N)SC 62a_100010187631_200000210301 [0,0,1,0,0,0|2,0,0]=3 1036 B13R1.3088 COC(=O)c1ccc(c(n1)N)S[13CH3] 62a_100010187631_200025704644 [0,0,1,0,0,0|2,0,0]=3 1037 B13R1.3088 COC(=O)c1ccc(c(n1)O)OC 271570a_203496583355_100010205418 [0,0,1,0,0,0|3,0,0]=4 1038 B13R1.3088 COC(=O)c1ccc(c(n1)O)SC 62a_200000210301_100010189637 [0,0,1,0,0,0|3,0,0]=4 1039 B13R1.3088 COC(=O)c1ccc(c(n1)O)S[13CH3] 62a_200025704644_100010189637 [0,0,1,0,0,0|3,0,0]=4 1040 B13R1.3088 COC(=O)c1cnc(c(c1)Br)OC 34a_100015192546_200000210301 [0,0,1,0,0,0|3,0,0]=4 1041 B13R1.3088 COC(=O)c1cnc(c(c1)Br)O[13CH3] 34a_100015192546_200025704644 [0,0,1,0,0,0|3,0,0]=4 1042 B13R1.3088 COC(=O)c1cnc(c(c1)Br)SC 62a_100010114297_200000210301 [0,0,1,0,0,0|3,0,0]=4 1043 B13R1.3088 COC(=O)c1cnc(c(c1)Br)SC 62a_200000210301_100010114297 [0,0,1,0,0,0|3,0,0]=4 1044 B13R1.3088 COC(=O)c1cnc(c(c1)Br)S[13CH3] 62a_100010114297_200025704644 [0,0,1,0,0,0|3,0,0]=4 1045 B13R1.3088 COC(=O)c1cnc(c(c1)Br)S[13CH3] 62a_200025704644_100010114297 [0,0,1,0,0,0|3,0,0]=4 1046 B13R1.3088 COC(=O)c1cnc(c(c1)C)SC 62a_200000210301_100009862495 [0,0,1,0,0,0|3,0,0]=4 1047 B13R1.3088 COC(=O)c1cnc(c(c1)C)SC 62a_200010136688_200000210301 [0,0,1,0,0,0|3,0,0]=4 1048 B13R1.3088 COC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200010136688_200025704644 [0,0,1,0,0,0|3,0,0]=4 1049 B13R1.3088 COC(=O)c1cnc(c(c1)C)S[13CH3] 62a_200025704644_100009862495 [0,0,1,0,0,0|3,0,0]=4 1050 B13R1.3088 COC(=O)c1cnc(c(c1)F)SC 62a_100010189625_200000210301 [0,0,1,0,0,0|3,0,0]=4 1051 B13R1.3088 COC(=O)c1cnc(c(c1)F)SC 62a_200000210301_100010189625 [0,0,1,0,0,0|3,0,0]=4 1052 B13R1.3088 COC(=O)c1cnc(c(c1)F)S[13CH3] 62a_100010189625_200025704644 [0,0,1,0,0,0|3,0,0]=4 1053 B13R1.3088 COC(=O)c1cnc(c(c1)F)S[13CH3] 62a_200025704644_100010189625 [0,0,1,0,0,0|3,0,0]=4 1054 B13R1.3088 COC(=O)c1cnc(c(c1)N)SC 62a_200000210301_100000079130 [0,0,1,0,0,0|2,0,0]=3 1055 B13R1.3088 COC(=O)c1cnc(c(c1)N)S[13CH3] 62a_200025704644_100000079130 [0,0,1,0,0,0|2,0,0]=3 1056 B13R1.3088 COC(=O)c1cnc(c(c1)O)OC 271570a_203496583355_100010189640 [0,0,1,0,0,0|3,0,0]=4 1057 B13R1.3088 COC(=O)c1cnc(c(c1)O)SC 62a_100010999399_200000210301 [0,0,1,0,0,0|3,0,0]=4 1058 B13R1.3088 COC(=O)c1cnc(c(c1)O)SC 62a_200000210301_100010999399 [0,0,1,0,0,0|3,0,0]=4 1059 B13R1.3088 COC(=O)c1cnc(c(c1)O)S[13CH3] 62a_100010999399_200025704644 [0,0,1,0,0,0|3,0,0]=4 1060 B13R1.3088 COC(=O)c1cnc(c(c1)O)S[13CH3] 62a_200025704644_100010999399 [0,0,1,0,0,0|3,0,0]=4 1061 B13R1.3088 COc1ccc(cc1N)C(=O)NN 34a_200000039609_200000210301 [0,0,1,0,0,0|3,0,0]=4 1062 B13R1.3088 [13CH3]Oc1ccc(cc1N)C(=O)NN 34a_200000039609_200025704644 [0,0,1,0,0,0|3,0,0]=4 1063 B13R2.1139 CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210202 [0,0,0,0,1,0|1,0,0]=2 1064 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 11a_106832991635_100000137882 [0,0,0,0,1,0|1,0,0]=2 1065 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 1626a_100102657272_100000137882 [0,0,0,0,1,0|1,0,0]=2 1066 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 240690a_100102657272_100000137882 [0,0,0,0,1,0|1,0,0]=2 1067 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 527a_100102657272_100000137882 [0,0,0,0,1,0|1,0,0]=2 1068 B13R2.1139 O=C(CF)c1ccc2c(c1)CC2 1458a_100000137882_100015361967 [0,0,0,0,1,0|2,0,0]=3 1069 B15R2.1601 CCC(=O)c1ccc2c(c1)CCCC2 1458a_100000199106_100000210202 [0,0,0,0,0,1|2,0,0]=3 1070 B15R2.1601 CCC(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_100000210202 [0,0,0,0,0,1|2,0,0]=3 1071 B15R2.1601 CCC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210202 [0,0,0,0,0,1|2,0,0]=3 1072 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCC2 11a_106832991635_100000199106 [0,0,0,0,0,1|2,0,0]=3 1073 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCC2 1626a_100102657272_100000199106 [0,0,0,0,0,1|2,0,0]=3 1074 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCC2 240690a_100102657272_100000199106 [0,0,0,0,0,1|2,0,0]=3 1075 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCC2 527a_100102657272_100000199106 [0,0,0,0,0,1|2,0,0]=3 1076 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 11a_106832991635_100011398765 [0,0,0,0,0,1|2,0,0]=3 1077 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 1626a_100102657272_100011398765 [0,0,0,0,0,1|2,0,0]=3 1078 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 240690a_100102657272_100011398765 [0,0,0,0,0,1|2,0,0]=3 1079 B15R2.1601 CNC(=O)c1ccc2c(c1)CCCO2 527a_100102657272_100011398765 [0,0,0,0,0,1|2,0,0]=3 1080 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 11a_106832991635_100000182659 [0,0,0,0,0,1|2,0,0]=3 1081 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 1626a_100102657272_100000182659 [0,0,0,0,0,1|2,0,0]=3 1082 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 240690a_100102657272_100000182659 [0,0,0,0,0,1|2,0,0]=3 1083 B15R2.1601 CNC(=O)c1ccc2c(c1)OCCO2 527a_100102657272_100000182659 [0,0,0,0,0,1|2,0,0]=3 1084 B15R2.1601 O=C(CF)c1ccc2c(c1)CCCC2 1458a_100000199106_100015361967 [0,0,0,0,0,1|3,0,0]=4 1085 B15R2.1601 O=C(CF)c1ccc2c(c1)CCCO2 1458a_100011398765_100015361967 [0,0,0,0,0,1|3,0,0]=4 1086 B15R2.1601 O=C(CF)c1ccc2c(c1)OCCO2 1458a_100000182659_100015361967 [0,0,0,0,0,1|3,0,0]=4 1087 B15R2.4343 C=CC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000185746 [0,0,0,0,0,1|2,0,1]=4 1088 B15R2.4343 C=CC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000185746 [0,0,0,0,0,1|2,0,1]=4 1089 B15R2.4343 CCC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_100000210202 [0,0,0,0,0,1|3,0,0]=4 1090 B15R2.4343 CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210202 [0,0,0,0,0,1|3,0,0]=4 1091 B15R2.4343 CCC(=O)Cc1ccc2cc[nH]c2c1 1458a_100000094508_100000210202 [0,0,0,0,0,1|1,0,2]=4 1092 B15R2.4343 CCC(=O)Cc1ccc2cn[nH]c2c1 1458a_100000210414_100020605281 [0,0,0,0,0,1|2,0,1]=4 1093 B15R2.4343 CCC(=O)Cc1ccc2nc[nH]c2c1 1458a_100000055147_100000210202 [0,0,0,0,0,1|2,0,1]=4 1094 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000210414 [0,0,0,0,0,1|2,0,0]=3 1095 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000210414 [0,0,0,0,0,1|2,0,0]=3 1096 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000210414 [0,0,0,0,0,1|2,0,0]=3 1097 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000210414 [0,0,0,0,0,1|2,0,0]=3 1098 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100000210414 [0,0,0,0,0,1|3,0,0]=4 1099 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100000210414 [0,0,0,0,0,1|3,0,0]=4 1100 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000210414 [0,0,0,0,0,1|3,0,0]=4 1101 B15R2.4343 CCC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100000210414 [0,0,0,0,0,1|3,0,0]=4 1102 B15R2.4343 CCC(=O)Nc1ccc2c(c1)COC2 11a_100011728444_100000210414 [0,0,0,0,0,1|3,0,0]=4 1103 B15R2.4343 CCC(=O)Nc1ccc2c(c1)COC2 1626a_100011728444_100000210414 [0,0,0,0,0,1|3,0,0]=4 1104 B15R2.4343 CCC(=O)Nc1ccc2c(c1)COC2 22a_100011728444_100000210414 [0,0,0,0,0,1|3,0,0]=4 1105 B15R2.4343 CCC(=O)Nc1ccc2c(c1)COC2 527a_100011728444_100000210414 [0,0,0,0,0,1|3,0,0]=4 1106 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100000210414 [0,0,0,0,0,1|3,0,0]=4 1107 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000210414 [0,0,0,0,0,1|3,0,0]=4 1108 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000210414 [0,0,0,0,0,1|3,0,0]=4 1109 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100000210414 [0,0,0,0,0,1|3,0,0]=4 1110 B15R2.4343 CCC(=O)Nc1ccc2cc[nH]c2c1 11a_100000743810_100000210414 [0,0,0,0,0,1|1,0,2]=4 1111 B15R2.4343 CCC(=O)Nc1ccc2cc[nH]c2c1 1626a_100000743810_100000210414 [0,0,0,0,0,1|1,0,2]=4 1112 B15R2.4343 CCC(=O)Nc1ccc2cc[nH]c2c1 22a_100000743810_100000210414 [0,0,0,0,0,1|1,0,2]=4 1113 B15R2.4343 CCC(=O)Nc1ccc2cc[nH]c2c1 527a_100000743810_100000210414 [0,0,0,0,0,1|1,0,2]=4 1114 B15R2.4343 CCC(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100011215416 [0,0,0,0,0,1|2,0,1]=4 1115 B15R2.4343 CCC(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000758301 [0,0,0,0,0,1|2,0,1]=4 1116 B15R2.4343 CCC(C)Sc1ccc2c(c1)NCC2 62a_100000758301_100000754641 [0,0,0,0,0,1|2,0,1]=4 1117 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 11a_106832991635_100000242752 [0,0,0,0,0,1|3,0,0]=4 1118 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 1626a_100102657272_100000242752 [0,0,0,0,0,1|3,0,0]=4 1119 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 240690a_100102657272_100000242752 [0,0,0,0,0,1|3,0,0]=4 1120 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 527a_100102657272_100000242752 [0,0,0,0,0,1|3,0,0]=4 1121 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 11a_106832991635_100000743733 [0,0,0,0,0,1|3,0,0]=4 1122 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 240690a_100102657272_100000743733 [0,0,0,0,0,1|3,0,0]=4 1123 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 527a_100102657272_100000743733 [0,0,0,0,0,1|3,0,0]=4 1124 B15R2.4343 CNC(=O)Cc1ccc2cc[nH]c2c1 11a_106832991635_100000094508 [0,0,0,0,0,1|1,0,2]=4 1125 B15R2.4343 CNC(=O)Cc1ccc2cc[nH]c2c1 527a_100102657272_100000094508 [0,0,0,0,0,1|1,0,2]=4 1126 B15R2.4343 CNC(=O)Cc1ccc2nc[nH]c2c1 240690a_100102657272_100000055147 [0,0,0,0,0,1|2,0,1]=4 1127 B15R2.4343 CNC(=O)Cc1ccc2nc[nH]c2c1 527a_100102657272_100000055147 [0,0,0,0,0,1|2,0,1]=4 1128 B15R2.4343 CNC(=O)Nc1ccc2c(c1)CCC2 2430a_100000211504_100102657272 [0,0,0,0,0,1|2,0,0]=3 1129 B15R2.4343 CNC(=O)Nc1ccc2c(c1)CCO2 2430a_100000736984_100102657272 [0,0,0,0,0,1|3,0,0]=4 1130 B15R2.4343 CNC(=O)Nc1ccc2c(c1)CCO2 512a_100000736984_100102657272 [0,0,0,0,0,1|3,0,0]=4 1131 B15R2.4343 CNC(=O)Nc1ccc2c(c1)COC2 2430a_100011728444_100102657272 [0,0,0,0,0,1|3,0,0]=4 1132 B15R2.4343 CNC(=O)Nc1ccc2c(c1)COC2 512a_100011728444_100102657272 [0,0,0,0,0,1|3,0,0]=4 1133 B15R2.4343 CNC(=O)Nc1ccc2c(c1)OCO2 2430a_100000209953_100102657272 [0,0,0,0,0,1|3,0,0]=4 1134 B15R2.4343 CNC(=O)Nc1ccc2cc[nH]c2c1 2430a_100000743810_100102657272 [0,0,0,0,0,1|1,0,2]=4 1135 B15R2.4343 COC(C)Sc1cc2c(cn1)CCN2 62a_100009879195_100020639910 [0,0,0,0,0,1|2,0,1]=4 1136 B15R2.4343 COC(C)Sc1cc2c(cn1)CCN2 62a_100020639910_100009879195 [0,0,0,0,0,1|2,0,1]=4 1137 B15R2.4343 COC(C)Sc1ccc2c(c1)CCC2 62a_100000745594_100009879195 [0,0,0,0,0,1|2,0,1]=4 1138 B15R2.4343 COC(C)Sc1ccc2c(c1)CCC2 62a_100009879195_100000745594 [0,0,0,0,0,1|2,0,1]=4 1139 B15R2.4343 COC(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100009879195 [0,0,0,0,0,1|1,0,1]=3 1140 B15R2.4343 COC(C)Sc1ccc2c(c1)NCC2 62a_100009879195_100000754641 [0,0,0,0,0,1|1,0,1]=3 1141 B15R2.4343 COC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100009879195 [0,0,0,0,0,1|2,0,1]=4 1142 B15R2.4343 COC(C)Sc1ccc2c(c1)OCC2 62a_100009879195_100009818566 [0,0,0,0,0,1|2,0,1]=4 1143 B15R2.4343 COC(C)Sc1cnc2c(c1)NCC2 62a_100000698607_100009879195 [0,0,0,0,0,1|2,0,1]=4 1144 B15R2.4343 COC(C)Sc1cnc2c(c1)NCC2 62a_100009879195_100000698607 [0,0,0,0,0,1|2,0,1]=4 1145 B15R2.4343 O=C(CO)Nc1ccc2c(c1)CCC2 22a_100000211504_100000210174 [0,0,0,0,0,1|3,0,0]=4 1146 B15R2.4343 O=C(CO)Nc1ccc2c(c1)CCC2 527a_100000211504_100000210174 [0,0,0,0,0,1|3,0,0]=4 1147 B12R1.56 C#Cc1cc(ccc1C)C(=O)C 1458a_200012278110_200000210301 [1,0,1,0,0,0|1,0,1]=4 1148 B12R1.56 C#Cc1cc(ccc1C)C(=O)[13CH3] 1458a_200012278110_200025704644 [1,0,1,0,0,0|1,0,1]=4 1149 B12R1.56 C=C(C)c1ccc(c(c1)NC)C 271570a_100000694244_100020629602 [1,0,1,0,0,0|1,0,0]=3 1150 B12R1.56 C=C(C)c1ccc(c(c1)NC)F 271570a_100000694244_100011314990 [1,0,1,0,0,0|2,0,0]=4 1151 B12R1.56 C=C(C)c1ccc(c(c1)NC)N 271570a_100000694244_100000694363 [1,0,1,0,0,0|2,0,0]=4 1152 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [1,0,1,0,0,0|2,0,0]=4 1153 B12R1.56 C=Cc1cc(ccc1C)C(=O)C 271570a_100011290941_100011934287 [1,0,1,0,0,0|1,0,1]=4 1154 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [1,0,1,0,0,0|1,0,0]=3 1155 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [1,0,1,0,0,0|1,0,0]=3 1156 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [1,0,1,0,0,0|2,0,0]=4 1157 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [1,0,1,0,0,0|2,0,0]=4 1158 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100010146556_200025704644 [1,0,1,0,0,0|2,0,0]=4 1159 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100010146556 [1,0,1,0,0,0|2,0,0]=4 1160 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_100011934287_200025704644 [1,0,1,0,0,0|1,0,0]=3 1161 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100011934287 [1,0,1,0,0,0|1,0,0]=3 1162 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000239719_200025704644 [1,0,1,0,0,0|2,0,0]=4 1163 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000239719 [1,0,1,0,0,0|2,0,0]=4 1164 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])N 62a_100012029215_200025704644 [1,0,1,0,0,0|2,0,0]=4 1165 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [1,0,1,0,0,0|2,0,0]=4 1166 B12R1.56 CCc1cc(ccc1Br)C(=O)C 1458a_100010152358_200000210301 [1,0,1,0,0,0|2,0,0]=4 1167 B12R1.56 CCc1cc(ccc1Br)C(=O)[13CH3] 1458a_100010152358_200025704644 [1,0,1,0,0,0|2,0,0]=4 1168 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [1,0,1,0,0,0|2,0,0]=4 1169 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [1,0,1,0,0,0|2,0,0]=4 1170 B12R1.56 CCc1cc(ccc1F)C(=O)C 1458a_100009883079_200000210301 [1,0,1,0,0,0|2,0,0]=4 1171 B12R1.56 CCc1cc(ccc1F)C(=O)[13CH3] 1458a_100009883079_200025704644 [1,0,1,0,0,0|2,0,0]=4 1172 B12R1.56 CNc1cc(ccc1C)C(=O)N 34a_100000188646_200000210301 [1,0,1,0,0,0|1,0,0]=3 1173 B12R1.56 CNc1cc(ccc1C)C(=O)N 7a_100000188646_200000210301 [1,0,1,0,0,0|1,0,0]=3 1174 B12R1.56 CNc1cc(ccc1C)C(C)C 2230a_100011216979_200000210301 [1,0,1,0,0,0|1,0,1]=4 1175 B12R1.56 CNc1cc(ccc1C)C(C)C 34a_100011216979_200000210301 [1,0,1,0,0,0|1,0,1]=4 1176 B12R1.56 CNc1cc(ccc1C)C(C)C 7a_100011216979_200000210301 [1,0,1,0,0,0|1,0,1]=4 1177 B12R1.56 CNc1cc(ccc1C)N(C)C 34a_100015186894_200000210301 [1,0,1,0,0,0|2,0,0]=4 1178 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 34a_100000184112_200000210301 [1,0,1,0,0,0|1,0,1]=4 1179 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 7a_100000184112_200000210301 [1,0,1,0,0,0|1,0,1]=4 1180 B12R1.56 CNc1cc(ccc1Cl)C(=O)N 34a_100000736751_200000210301 [1,0,1,0,0,0|2,0,0]=4 1181 B12R1.56 CNc1cc(ccc1F)C(=O)N 34a_100000740466_200000210301 [1,0,1,0,0,0|2,0,0]=4 1182 B12R1.56 CNc1cc(cnc1F)C(=O)C 27a_100102657272_200010135287 [1,0,1,0,0,0|2,0,0]=4 1183 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [1,0,1,0,0,0|2,0,0]=4 1184 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [1,0,1,0,0,0|2,0,0]=4 1185 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [1,0,1,0,0,0|1,0,0]=3 1186 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [1,0,1,0,0,0|1,0,0]=3 1187 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [1,0,1,0,0,0|1,0,0]=3 1188 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [1,0,1,0,0,0|1,0,0]=3 1189 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [1,0,1,0,0,0|2,0,0]=4 1190 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [1,0,1,0,0,0|2,0,0]=4 1191 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [1,0,1,0,0,0|2,0,0]=4 1192 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [1,0,1,0,0,0|2,0,0]=4 1193 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [1,0,1,0,0,0|2,0,0]=4 1194 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [1,0,1,0,0,0|2,0,0]=4 1195 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [1,0,1,0,0,0|2,0,0]=4 1196 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [1,0,1,0,0,0|2,0,0]=4 1197 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [1,0,1,0,0,0|2,0,0]=4 1198 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [1,0,1,0,0,0|2,0,0]=4 1199 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [1,0,1,0,0,0|2,0,0]=4 1200 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_100010146556_200000210301 [1,0,1,0,0,0|2,0,0]=4 1201 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_200000210301_100010146556 [1,0,1,0,0,0|2,0,0]=4 1202 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_100011934287_200000210301 [1,0,1,0,0,0|1,0,0]=3 1203 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_200000210301_100011934287 [1,0,1,0,0,0|1,0,0]=3 1204 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_100000186401_200000210301 [1,0,1,0,0,0|2,0,0]=4 1205 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_200000210301_100000186401 [1,0,1,0,0,0|2,0,0]=4 1206 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_100000239719_200000210301 [1,0,1,0,0,0|2,0,0]=4 1207 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_200000210301_100000239719 [1,0,1,0,0,0|2,0,0]=4 1208 B12R1.56 CSc1cc(ccc1N)C(=O)C 62a_100012029215_200000210301 [1,0,1,0,0,0|2,0,0]=4 1209 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [1,0,1,0,0,0|2,0,0]=4 1210 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 34a_100000188646_200025704644 [1,0,1,0,0,0|1,0,0]=3 1211 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 7a_100000188646_200025704644 [1,0,1,0,0,0|1,0,0]=3 1212 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 2230a_100011216979_200025704644 [1,0,1,0,0,0|1,0,1]=4 1213 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 34a_100011216979_200025704644 [1,0,1,0,0,0|1,0,1]=4 1214 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 7a_100011216979_200025704644 [1,0,1,0,0,0|1,0,1]=4 1215 B12R1.56 Cc1ccc(cc1N[13CH3])N(C)C 34a_100015186894_200025704644 [1,0,1,0,0,0|2,0,0]=4 1216 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 34a_100000184112_200025704644 [1,0,1,0,0,0|1,0,1]=4 1217 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 7a_100000184112_200025704644 [1,0,1,0,0,0|1,0,1]=4 1218 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_100000186401_200025704644 [1,0,1,0,0,0|2,0,0]=4 1219 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_200025704644_100000186401 [1,0,1,0,0,0|2,0,0]=4 1220 B12R1.56 [13CH3]Nc1cc(ccc1Cl)C(=O)N 34a_100000736751_200025704644 [1,0,1,0,0,0|2,0,0]=4 1221 B12R1.56 [13CH3]Nc1cc(ccc1F)C(=O)N 34a_100000740466_200025704644 [1,0,1,0,0,0|2,0,0]=4 1222 B12R1.286 C=C=Cc1ccc(c(c1)NC)C 271570a_100015277604_100020629602 [1,0,1,0,0,0|1,0,1]=4 1223 B12R1.286 CC=Cc1ccc(c(c1)NC)C 271570a_100016259895_100020629602 [1,0,1,0,0,0|1,0,0]=3 1224 B12R1.286 CC=Cc1ccc(c(c1)NC)F 271570a_100016259895_100011314990 [1,0,1,0,0,0|2,0,0]=4 1225 B12R1.286 CC=Cc1ccc(c(c1)NC)N 271570a_100016259895_100000694363 [1,0,1,0,0,0|2,0,0]=4 1226 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [1,0,1,0,0,0|2,0,0]=4 1227 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100000210202_100020629602 [1,0,1,0,0,0|2,0,0]=4 1228 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100020629602_100000210202 [1,0,1,0,0,0|2,0,0]=4 1229 B12R1.286 CNc1cc(ccc1Br)COC 34a_200013033220_200000210301 [1,0,1,0,0,0|1,0,1]=4 1230 B12R1.286 COCc1ccc(c(c1)N[13CH3])Br 34a_200013033220_200025704644 [1,0,1,0,0,0|1,0,1]=4 1231 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [1,0,1,0,0,0|1,0,1]=4 1232 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [1,0,1,0,0,0|1,0,1]=4 1233 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200000210301_200015395492 [1,0,1,0,0,0|1,0,1]=4 1234 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200015395492_200000210301 [1,0,1,0,0,0|1,0,1]=4 1235 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200015395492_200025704644 [1,0,1,0,0,0|1,0,1]=4 1236 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200025704644_200015395492 [1,0,1,0,0,0|1,0,1]=4 1237 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [1,0,1,0,0,0|1,0,1]=4 1238 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [1,0,1,0,0,0|1,0,1]=4 1239 B12R1.367 CCC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_100000210202 [1,0,1,0,0,0|2,0,0]=4 1240 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [1,0,1,0,0,0|2,0,0]=4 1241 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [1,0,1,0,0,0|1,0,0]=3 1242 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [1,0,1,0,0,0|2,0,0]=4 1243 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [1,0,1,0,0,0|2,0,0]=4 1244 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [1,0,1,0,0,0|2,0,0]=4 1245 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [1,0,1,0,0,0|2,0,0]=4 1246 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [1,0,1,0,0,0|2,0,0]=4 1247 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_100000210202 [1,0,1,0,0,0|2,0,0]=4 1248 B12R1.367 CCC(=O)c1ccc(c(c1)F)C 1458a_100000212313_100000210202 [1,0,1,0,0,0|2,0,0]=4 1249 B12R1.367 CCC(=O)c1ccc(c(c1)I)C 1458a_100000751299_100000210202 [1,0,1,0,0,0|2,0,0]=4 1250 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [1,0,1,0,0,0|2,0,0]=4 1251 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 11a_106832991635_100000186397 [1,0,1,0,0,0|2,0,0]=4 1252 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 1626a_100102657272_100000186397 [1,0,1,0,0,0|2,0,0]=4 1253 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 240690a_100102657272_100000186397 [1,0,1,0,0,0|2,0,0]=4 1254 B12R1.367 CNC(=O)c1ccc(c(c1)Br)C 527a_100102657272_100000186397 [1,0,1,0,0,0|2,0,0]=4 1255 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 11a_106832991635_100000692631 [1,0,1,0,0,0|2,0,0]=4 1256 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 1626a_100102657272_100000692631 [1,0,1,0,0,0|2,0,0]=4 1257 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 240690a_100102657272_100000692631 [1,0,1,0,0,0|2,0,0]=4 1258 B12R1.367 CNC(=O)c1ccc(c(c1)C)Br 527a_100102657272_100000692631 [1,0,1,0,0,0|2,0,0]=4 1259 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 11a_106832991635_100000210898 [1,0,1,0,0,0|1,0,0]=3 1260 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 1626a_100102657272_100000210898 [1,0,1,0,0,0|1,0,0]=3 1261 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 240690a_100102657272_100000210898 [1,0,1,0,0,0|1,0,0]=3 1262 B12R1.367 CNC(=O)c1ccc(c(c1)C)C 527a_100102657272_100000210898 [1,0,1,0,0,0|1,0,0]=3 1263 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 11a_106832991635_100000686306 [1,0,1,0,0,0|2,0,0]=4 1264 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 1626a_100102657272_100000686306 [1,0,1,0,0,0|2,0,0]=4 1265 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 240690a_100102657272_100000686306 [1,0,1,0,0,0|2,0,0]=4 1266 B12R1.367 CNC(=O)c1ccc(c(c1)C)Cl 527a_100102657272_100000686306 [1,0,1,0,0,0|2,0,0]=4 1267 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 11a_106832991635_100000751819 [1,0,1,0,0,0|2,0,0]=4 1268 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 1626a_100102657272_100000751819 [1,0,1,0,0,0|2,0,0]=4 1269 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 240690a_100102657272_100000751819 [1,0,1,0,0,0|2,0,0]=4 1270 B12R1.367 CNC(=O)c1ccc(c(c1)C)F 527a_100102657272_100000751819 [1,0,1,0,0,0|2,0,0]=4 1271 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 11a_106832991635_100000751300 [1,0,1,0,0,0|2,0,0]=4 1272 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 1626a_100102657272_100000751300 [1,0,1,0,0,0|2,0,0]=4 1273 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 240690a_100102657272_100000751300 [1,0,1,0,0,0|2,0,0]=4 1274 B12R1.367 CNC(=O)c1ccc(c(c1)C)I 527a_100102657272_100000751300 [1,0,1,0,0,0|2,0,0]=4 1275 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [1,0,1,0,0,0|2,0,0]=4 1276 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [1,0,1,0,0,0|2,0,0]=4 1277 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 11a_106832991635_100000751740 [1,0,1,0,0,0|2,0,0]=4 1278 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 1626a_100102657272_100000751740 [1,0,1,0,0,0|2,0,0]=4 1279 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 240690a_100102657272_100000751740 [1,0,1,0,0,0|2,0,0]=4 1280 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)C 527a_100102657272_100000751740 [1,0,1,0,0,0|2,0,0]=4 1281 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 11a_106832991635_100000212313 [1,0,1,0,0,0|2,0,0]=4 1282 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 1626a_100102657272_100000212313 [1,0,1,0,0,0|2,0,0]=4 1283 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 240690a_100102657272_100000212313 [1,0,1,0,0,0|2,0,0]=4 1284 B12R1.367 CNC(=O)c1ccc(c(c1)F)C 527a_100102657272_100000212313 [1,0,1,0,0,0|2,0,0]=4 1285 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 11a_106832991635_100000751299 [1,0,1,0,0,0|2,0,0]=4 1286 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 1626a_100102657272_100000751299 [1,0,1,0,0,0|2,0,0]=4 1287 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 240690a_100102657272_100000751299 [1,0,1,0,0,0|2,0,0]=4 1288 B12R1.367 CNC(=O)c1ccc(c(c1)I)C 527a_100102657272_100000751299 [1,0,1,0,0,0|2,0,0]=4 1289 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [1,0,1,0,0,0|2,0,0]=4 1290 B12R1.367 COC(=O)c1cc(c(cn1)C)O 271570a_203496583355_100000065005 [1,0,1,0,0,0|2,0,0]=4 1291 B12R1.367 COC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100010080863 [1,0,1,0,0,0|2,0,0]=4 1292 B12R1.367 COC(=O)c1cc(c(cn1)O)N 271570a_203496583355_100016001589 [1,0,1,0,0,0|2,0,0]=4 1293 B12R1.367 COC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100011294788 [1,0,1,0,0,0|2,0,0]=4 1294 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [1,0,1,0,0,0|1,0,0]=3 1295 B12R1.367 COC(=O)c1ccc(c(c1)Cl)O 271570a_203496583355_100012356344 [1,0,1,0,0,0|2,0,0]=4 1296 B12R1.367 COC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000703229 [1,0,1,0,0,0|2,0,0]=4 1297 B12R1.367 COC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100011450966 [1,0,1,0,0,0|1,0,0]=3 1298 B12R1.367 COC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100012349818 [1,0,1,0,0,0|2,0,0]=4 1299 B12R1.367 COC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011218856 [1,0,1,0,0,0|1,0,0]=3 1300 B12R1.367 COC(=O)c1ccc(c(c1)O)Cl 271570a_203496583355_100011294800 [1,0,1,0,0,0|2,0,0]=4 1301 B12R1.367 COC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000722584 [1,0,1,0,0,0|2,0,0]=4 1302 B12R1.367 COC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100000187552 [1,0,1,0,0,0|2,0,0]=4 1303 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [1,0,1,0,0,0|2,0,0]=4 1304 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [1,0,1,0,0,0|2,0,0]=4 1305 B12R1.367 COC(=O)c1ccc(c(n1)C)O 271570a_203496583355_100010207261 [1,0,1,0,0,0|2,0,0]=4 1306 B12R1.367 COC(=O)c1ccc(c(n1)N)O 271570a_203496583355_100010187631 [1,0,1,0,0,0|2,0,0]=4 1307 B12R1.367 COC(=O)c1ccc(c(n1)O)C 271570a_203496583355_100010143800 [1,0,1,0,0,0|2,0,0]=4 1308 B12R1.367 COC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009862495 [1,0,1,0,0,0|2,0,0]=4 1309 B12R1.367 COC(=O)c1cnc(c(c1)N)O 271570a_203496583355_100000079130 [1,0,1,0,0,0|2,0,0]=4 1310 B12R1.367 Cc1ccc(cc1C)C(=O)CF 1458a_100000210898_100015361967 [1,0,1,0,0,0|2,0,0]=4 1311 B12R1.435 C=Cc1cccc(c1)C(=O)OC 271570a_100011290941_100000148679 [1,0,1,0,0,0|0,0,2]=4 1312 B12R1.435 CCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210202 [1,0,1,0,0,0|1,0,0]=3 1313 B12R1.435 CCC(=O)c1cccc(c1)CO 1458a_100000746274_100000210202 [1,0,1,0,0,0|2,0,0]=4 1314 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [1,0,1,0,0,0|2,0,0]=4 1315 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [1,0,1,0,0,0|2,0,0]=4 1316 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [1,0,1,0,0,0|2,0,0]=4 1317 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [1,0,1,0,0,0|2,0,0]=4 1318 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [1,0,1,0,0,0|2,0,0]=4 1319 B12R1.435 CCC(=O)c1cccc(c1)SC 1458a_100011217804_100000210202 [1,0,1,0,0,0|2,0,0]=4 1320 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_100000211677_200000210301 [1,0,1,0,0,0|2,0,0]=4 1321 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_200000210301_100000211677 [1,0,1,0,0,0|2,0,0]=4 1322 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_100000211677_200025704644 [1,0,1,0,0,0|2,0,0]=4 1323 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000211677 [1,0,1,0,0,0|2,0,0]=4 1324 B12R1.435 CCc1cccc(c1)C(=O)CF 1458a_100011933908_100015361967 [1,0,1,0,0,0|2,0,0]=4 1325 B12R1.435 CCc1cccc(c1)C(=O)NC 11a_106832991635_100011933908 [1,0,1,0,0,0|1,0,0]=3 1326 B12R1.435 CCc1cccc(c1)C(=O)NC 1626a_100102657272_100011933908 [1,0,1,0,0,0|1,0,0]=3 1327 B12R1.435 CCc1cccc(c1)C(=O)NC 240690a_100102657272_100011933908 [1,0,1,0,0,0|1,0,0]=3 1328 B12R1.435 CCc1cccc(c1)C(=O)NC 527a_100102657272_100011933908 [1,0,1,0,0,0|1,0,0]=3 1329 B12R1.435 CNC(=O)c1cc(ccn1)NC 27a_100102657272_100000204654 [1,0,1,0,0,0|2,0,0]=4 1330 B12R1.435 CNC(=O)c1cccc(c1)CO 240690a_100102657272_100000746274 [1,0,1,0,0,0|2,0,0]=4 1331 B12R1.435 CNC(=O)c1cccc(c1)NC 34a_100000185133_200000210301 [1,0,1,0,0,0|1,0,0]=3 1332 B12R1.435 CNC(=O)c1cccc(c1)N[13CH3] 34a_100000185133_200025704644 [1,0,1,0,0,0|1,0,0]=3 1333 B12R1.435 CNC(=O)c1cccc(c1)OC 11a_106832991635_100000188888 [1,0,1,0,0,0|2,0,0]=4 1334 B12R1.435 CNC(=O)c1cccc(c1)OC 1626a_100102657272_100000188888 [1,0,1,0,0,0|2,0,0]=4 1335 B12R1.435 CNC(=O)c1cccc(c1)OC 240690a_100102657272_100000188888 [1,0,1,0,0,0|2,0,0]=4 1336 B12R1.435 CNC(=O)c1cccc(c1)OC 34a_100000159807_200000210301 [1,0,1,0,0,0|2,0,0]=4 1337 B12R1.435 CNC(=O)c1cccc(c1)OC 527a_100102657272_100000188888 [1,0,1,0,0,0|2,0,0]=4 1338 B12R1.435 CNC(=O)c1cccc(c1)OC 7a_100000159807_200000210301 [1,0,1,0,0,0|2,0,0]=4 1339 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 34a_100000159807_200025704644 [1,0,1,0,0,0|2,0,0]=4 1340 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 7a_100000159807_200025704644 [1,0,1,0,0,0|2,0,0]=4 1341 B12R1.435 CNC(=O)c1cccc(c1)SC 11a_106832991635_100011217804 [1,0,1,0,0,0|2,0,0]=4 1342 B12R1.435 CNC(=O)c1cccc(c1)SC 1626a_100102657272_100011217804 [1,0,1,0,0,0|2,0,0]=4 1343 B12R1.435 CNC(=O)c1cccc(c1)SC 240690a_100102657272_100011217804 [1,0,1,0,0,0|2,0,0]=4 1344 B12R1.435 CNC(=O)c1cccc(c1)SC 527a_100102657272_100011217804 [1,0,1,0,0,0|2,0,0]=4 1345 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_100000155082_200000210301 [1,0,1,0,0,0|2,0,0]=4 1346 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_200000210301_100000155082 [1,0,1,0,0,0|2,0,0]=4 1347 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_100000155082_200025704644 [1,0,1,0,0,0|2,0,0]=4 1348 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000155082 [1,0,1,0,0,0|2,0,0]=4 1349 B12R1.435 CNC(=O)c1cccc(n1)NC 27a_100102657272_100000755456 [1,0,1,0,0,0|2,0,0]=4 1350 B12R1.435 CNC(=O)c1cncc(c1)NC 27a_100102657272_200000155086 [1,0,1,0,0,0|2,0,0]=4 1351 B12R1.435 CNc1cc(cnn1)C(=O)OC 27a_100102657272_100009862058 [1,0,1,0,0,0|2,0,0]=4 1352 B12R1.435 CNc1cc(ncn1)C(=O)OC 27a_100102657272_100000051410 [1,0,1,0,0,0|2,0,0]=4 1353 B12R1.435 CNc1cccc(n1)C(=O)OC 27a_100102657272_100000708286 [1,0,1,0,0,0|1,0,0]=3 1354 B12R1.435 CNc1cncc(n1)C(=O)OC 27a_100102657272_100000765340 [1,0,1,0,0,0|2,0,0]=4 1355 B12R1.435 CNc1nccc(n1)C(=O)OC 27a_100102657272_100000070389 [1,0,1,0,0,0|2,0,0]=4 1356 B12R1.435 COC(=O)c1cc(ccn1)OC 34a_200020638413_200000210301 [1,0,1,0,0,0|2,0,0]=4 1357 B12R1.435 COC(=O)c1cc(ccn1)O[13CH3] 34a_200020638413_200025704644 [1,0,1,0,0,0|2,0,0]=4 1358 B12R1.435 COC(=O)c1cc(ccn1)SC 62a_100000693414_200000210301 [1,0,1,0,0,0|2,0,0]=4 1359 B12R1.435 COC(=O)c1cc(ccn1)SC 62a_200000210301_100000693414 [1,0,1,0,0,0|2,0,0]=4 1360 B12R1.435 COC(=O)c1cc(ccn1)S[13CH3] 62a_100000693414_200025704644 [1,0,1,0,0,0|2,0,0]=4 1361 B12R1.435 COC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000693414 [1,0,1,0,0,0|2,0,0]=4 1362 B12R1.435 COC(=O)c1cccc(c1)OC 34a_100000150331_200000210301 [1,0,1,0,0,0|1,0,0]=3 1363 B12R1.435 COC(=O)c1cccc(c1)OC 7a_100000150331_200000210301 [1,0,1,0,0,0|1,0,0]=3 1364 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 34a_100000150331_200025704644 [1,0,1,0,0,0|1,0,0]=3 1365 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 7a_100000150331_200025704644 [1,0,1,0,0,0|1,0,0]=3 1366 B12R1.435 COC(=O)c1cccc(c1)SC 62a_100000148848_200000210301 [1,0,1,0,0,0|1,0,0]=3 1367 B12R1.435 COC(=O)c1cccc(c1)SC 62a_200000210301_100000148848 [1,0,1,0,0,0|1,0,0]=3 1368 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_100000148848_200025704644 [1,0,1,0,0,0|1,0,0]=3 1369 B12R1.435 COC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000148848 [1,0,1,0,0,0|1,0,0]=3 1370 B12R1.435 COC(=O)c1cccc(n1)SC 62a_100000708286_200000210301 [1,0,1,0,0,0|2,0,0]=4 1371 B12R1.435 COC(=O)c1cccc(n1)SC 62a_200000210301_100000708286 [1,0,1,0,0,0|2,0,0]=4 1372 B12R1.435 COC(=O)c1cccc(n1)S[13CH3] 62a_100000708286_200025704644 [1,0,1,0,0,0|2,0,0]=4 1373 B12R1.435 COC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100000708286 [1,0,1,0,0,0|2,0,0]=4 1374 B12R1.435 COC(=O)c1ccnc(c1)OC 34a_100138552365_200000210301 [1,0,1,0,0,0|2,0,0]=4 1375 B12R1.435 COC(=O)c1ccnc(c1)O[13CH3] 34a_100138552365_200025704644 [1,0,1,0,0,0|2,0,0]=4 1376 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_100011934382_200000210301 [1,0,1,0,0,0|2,0,0]=4 1377 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_200000210301_100011934382 [1,0,1,0,0,0|2,0,0]=4 1378 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_100011934382_200025704644 [1,0,1,0,0,0|2,0,0]=4 1379 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011934382 [1,0,1,0,0,0|2,0,0]=4 1380 B12R1.435 COC(=O)c1cncc(c1)OC 34a_100000687108_200000210301 [1,0,1,0,0,0|2,0,0]=4 1381 B12R1.435 COC(=O)c1cncc(c1)OC 7a_100000687108_200000210301 [1,0,1,0,0,0|2,0,0]=4 1382 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 34a_100000687108_200025704644 [1,0,1,0,0,0|2,0,0]=4 1383 B12R1.435 COC(=O)c1cncc(c1)O[13CH3] 7a_100000687108_200025704644 [1,0,1,0,0,0|2,0,0]=4 1384 B12R1.435 COC(=O)c1cncc(c1)SC 62a_100000148912_200000210301 [1,0,1,0,0,0|2,0,0]=4 1385 B12R1.435 COC(=O)c1cncc(c1)SC 62a_200000210301_100000148912 [1,0,1,0,0,0|2,0,0]=4 1386 B12R1.435 COC(=O)c1cncc(c1)S[13CH3] 62a_100000148912_200025704644 [1,0,1,0,0,0|2,0,0]=4 1387 B12R1.435 COC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100000148912 [1,0,1,0,0,0|2,0,0]=4 1388 B12R1.5 C=Cc1ccc(cc1)C(=O)OC 271570a_100011290941_100000150774 [1,0,1,0,0,0|0,0,2]=4 1389 B12R1.5 CC(O[13CH3])c1ccc(cc1)CN 34a_200000048501_200025704644 [1,0,1,0,0,0|1,0,1]=4 1390 B12R1.5 CCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210202 [1,0,1,0,0,0|1,0,0]=3 1391 B12R1.5 CCC(=O)c1ccc(cc1)CO 1458a_100000183892_100000210202 [1,0,1,0,0,0|2,0,0]=4 1392 B12R1.5 CCC(=O)c1ccc(cc1)OC 1458a_100000184203_100000210202 [1,0,1,0,0,0|2,0,0]=4 1393 B12R1.5 CCC(=O)c1ccc(cc1)OC 34a_100000212119_200000210301 [1,0,1,0,0,0|2,0,0]=4 1394 B12R1.5 CCC(=O)c1ccc(cc1)OC 7a_100000212119_200000210301 [1,0,1,0,0,0|2,0,0]=4 1395 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 34a_100000212119_200025704644 [1,0,1,0,0,0|2,0,0]=4 1396 B12R1.5 CCC(=O)c1ccc(cc1)O[13CH3] 7a_100000212119_200025704644 [1,0,1,0,0,0|2,0,0]=4 1397 B12R1.5 CCC(=O)c1ccc(cc1)SC 1458a_100000189692_100000210202 [1,0,1,0,0,0|2,0,0]=4 1398 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_100000211647_200000210301 [1,0,1,0,0,0|2,0,0]=4 1399 B12R1.5 CCC(=O)c1ccc(cc1)SC 62a_200000210301_100000211647 [1,0,1,0,0,0|2,0,0]=4 1400 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_100000211647_200025704644 [1,0,1,0,0,0|2,0,0]=4 1401 B12R1.5 CCC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000211647 [1,0,1,0,0,0|2,0,0]=4 1402 B12R1.5 CCc1ccc(cc1)C(=O)CF 1458a_100000211226_100015361967 [1,0,1,0,0,0|2,0,0]=4 1403 B12R1.5 CCc1ccc(cc1)C(=O)NC 11a_106832991635_100000211226 [1,0,1,0,0,0|1,0,0]=3 1404 B12R1.5 CCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000211226 [1,0,1,0,0,0|1,0,0]=3 1405 B12R1.5 CCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000211226 [1,0,1,0,0,0|1,0,0]=3 1406 B12R1.5 CCc1ccc(cc1)C(=O)NC 527a_100102657272_100000211226 [1,0,1,0,0,0|1,0,0]=3 1407 B12R1.5 CCc1ccc(cc1)C(C)OC 34a_100011232672_200000210301 [1,0,1,0,0,0|1,0,1]=4 1408 B12R1.5 CCc1ccc(cc1)C(C)OC 7a_100011232672_200000210301 [1,0,1,0,0,0|1,0,1]=4 1409 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 34a_100011232672_200025704644 [1,0,1,0,0,0|1,0,1]=4 1410 B12R1.5 CCc1ccc(cc1)C(C)O[13CH3] 7a_100011232672_200025704644 [1,0,1,0,0,0|1,0,1]=4 1411 B12R1.5 CNC(=O)c1ccc(cc1)CO 1626a_100102657272_100000183892 [1,0,1,0,0,0|2,0,0]=4 1412 B12R1.5 CNC(=O)c1ccc(cc1)CO 240690a_100102657272_100000183892 [1,0,1,0,0,0|2,0,0]=4 1413 B12R1.5 CNC(=O)c1ccc(cc1)NC 2230a_100000184841_200000210301 [1,0,1,0,0,0|2,0,0]=4 1414 B12R1.5 CNC(=O)c1ccc(cc1)NC 27a_100102657272_100000155074 [1,0,1,0,0,0|2,0,0]=4 1415 B12R1.5 CNC(=O)c1ccc(cc1)NC 34a_100000184841_200000210301 [1,0,1,0,0,0|2,0,0]=4 1416 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 2230a_100000184841_200025704644 [1,0,1,0,0,0|2,0,0]=4 1417 B12R1.5 CNC(=O)c1ccc(cc1)N[13CH3] 34a_100000184841_200025704644 [1,0,1,0,0,0|2,0,0]=4 1418 B12R1.5 CNC(=O)c1ccc(cc1)OC 11a_106832991635_100000184203 [1,0,1,0,0,0|2,0,0]=4 1419 B12R1.5 CNC(=O)c1ccc(cc1)OC 1626a_100102657272_100000184203 [1,0,1,0,0,0|2,0,0]=4 1420 B12R1.5 CNC(=O)c1ccc(cc1)OC 240690a_100102657272_100000184203 [1,0,1,0,0,0|2,0,0]=4 1421 B12R1.5 CNC(=O)c1ccc(cc1)OC 34a_100000192141_200000210301 [1,0,1,0,0,0|2,0,0]=4 1422 B12R1.5 CNC(=O)c1ccc(cc1)OC 527a_100102657272_100000184203 [1,0,1,0,0,0|2,0,0]=4 1423 B12R1.5 CNC(=O)c1ccc(cc1)OC 7a_100000192141_200000210301 [1,0,1,0,0,0|2,0,0]=4 1424 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 34a_100000192141_200025704644 [1,0,1,0,0,0|2,0,0]=4 1425 B12R1.5 CNC(=O)c1ccc(cc1)O[13CH3] 7a_100000192141_200025704644 [1,0,1,0,0,0|2,0,0]=4 1426 B12R1.5 CNC(=O)c1ccc(cc1)SC 11a_106832991635_100000189692 [1,0,1,0,0,0|2,0,0]=4 1427 B12R1.5 CNC(=O)c1ccc(cc1)SC 1626a_100102657272_100000189692 [1,0,1,0,0,0|2,0,0]=4 1428 B12R1.5 CNC(=O)c1ccc(cc1)SC 240690a_100102657272_100000189692 [1,0,1,0,0,0|2,0,0]=4 1429 B12R1.5 CNC(=O)c1ccc(cc1)SC 527a_100102657272_100000189692 [1,0,1,0,0,0|2,0,0]=4 1430 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_100000155074_200000210301 [1,0,1,0,0,0|2,0,0]=4 1431 B12R1.5 CNC(=O)c1ccc(cc1)SC 62a_200000210301_100000155074 [1,0,1,0,0,0|2,0,0]=4 1432 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_100000155074_200025704644 [1,0,1,0,0,0|2,0,0]=4 1433 B12R1.5 CNC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000155074 [1,0,1,0,0,0|2,0,0]=4 1434 B12R1.5 CNc1ccc(cn1)C(=O)OC 27a_100102657272_100000733799 [1,0,1,0,0,0|2,0,0]=4 1435 B12R1.5 COC(=O)c1ccc(cc1)OC 34a_100000150123_200000210301 [1,0,1,0,0,0|1,0,0]=3 1436 B12R1.5 COC(=O)c1ccc(cc1)OC 7a_100000150123_200000210301 [1,0,1,0,0,0|1,0,0]=3 1437 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 34a_100000150123_200025704644 [1,0,1,0,0,0|1,0,0]=3 1438 B12R1.5 COC(=O)c1ccc(cc1)O[13CH3] 7a_100000150123_200025704644 [1,0,1,0,0,0|1,0,0]=3 1439 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_100000150774_200000210301 [1,0,1,0,0,0|1,0,0]=3 1440 B12R1.5 COC(=O)c1ccc(cc1)SC 62a_200000210301_100000150774 [1,0,1,0,0,0|1,0,0]=3 1441 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_100000150774_200025704644 [1,0,1,0,0,0|1,0,0]=3 1442 B12R1.5 COC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000150774 [1,0,1,0,0,0|1,0,0]=3 1443 B12R1.5 COC(=O)c1ccc(cn1)OC 34a_100011997255_200000210301 [1,0,1,0,0,0|2,0,0]=4 1444 B12R1.5 COC(=O)c1ccc(cn1)OC 7a_100011997255_200000210301 [1,0,1,0,0,0|2,0,0]=4 1445 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 34a_100011997255_200025704644 [1,0,1,0,0,0|2,0,0]=4 1446 B12R1.5 COC(=O)c1ccc(cn1)O[13CH3] 7a_100011997255_200025704644 [1,0,1,0,0,0|2,0,0]=4 1447 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_100102712061_200000210301 [1,0,1,0,0,0|2,0,0]=4 1448 B12R1.5 COC(=O)c1ccc(cn1)SC 62a_200000210301_100102712061 [1,0,1,0,0,0|2,0,0]=4 1449 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_100102712061_200025704644 [1,0,1,0,0,0|2,0,0]=4 1450 B12R1.5 COC(=O)c1ccc(cn1)S[13CH3] 62a_200025704644_100102712061 [1,0,1,0,0,0|2,0,0]=4 1451 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_100000733799_200000210301 [1,0,1,0,0,0|2,0,0]=4 1452 B12R1.5 COC(=O)c1ccc(nc1)SC 62a_200000210301_100000733799 [1,0,1,0,0,0|2,0,0]=4 1453 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_100000733799_200025704644 [1,0,1,0,0,0|2,0,0]=4 1454 B12R1.5 COC(=O)c1ccc(nc1)S[13CH3] 62a_200025704644_100000733799 [1,0,1,0,0,0|2,0,0]=4 1455 B12R1.5 COC(C)c1ccc(cc1)CN 34a_200000048501_200000210301 [1,0,1,0,0,0|1,0,1]=4 1456 B12R1.113 C=C(C)c1ccc(cc1)CCC 271570a_100000694244_100000750032 [1,0,1,0,0,0|2,0,0]=4 1457 B12R1.113 C=C(C)c1ccc(cc1)CCN 271570a_100000694244_100000755846 [1,0,1,0,0,0|1,0,0]=3 1458 B12R1.113 C=C(C)c1ccc(cc1)CCO 271570a_100000694244_100000766406 [1,0,1,0,0,0|2,0,0]=4 1459 B12R1.113 C=C(C)c1ccc(cc1)CNN 271570a_100000694244_100016993955 [1,0,1,0,0,0|2,0,0]=4 1460 B12R1.113 CC(=O)c1ccc(cc1)CC#N 1458a_100000693995_200000210301 [1,0,1,0,0,0|0,0,2]=4 1461 B12R1.113 CC(=O)c1ccc(cc1)CCO 1458a_100000078963_200000210301 [1,0,1,0,0,0|1,0,0]=3 1462 B12R1.113 CC(=O)c1ccc(cc1)CO[13CH3] 7a_100000082505_200025704644 [1,0,1,0,0,0|2,0,0]=4 1463 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_100000756337_200025704644 [1,0,1,0,0,0|2,0,0]=4 1464 B12R1.113 CC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100000756337 [1,0,1,0,0,0|2,0,0]=4 1465 B12R1.113 CC(=O)c1ccc(cc1)OCF 34a_100000185113_100015361967 [1,0,1,0,0,0|2,0,0]=4 1466 B12R1.113 CC(=O)c1ccc(cc1)OCF 7a_100000185113_100015361967 [1,0,1,0,0,0|2,0,0]=4 1467 B12R1.113 CC(=O)c1ccc(cc1)SCF 62a_100000185465_100015361967 [1,0,1,0,0,0|2,0,0]=4 1468 B12R1.113 CC(=O)c1ccc(cc1)SCF 62a_100015361967_100000185465 [1,0,1,0,0,0|2,0,0]=4 1469 B12R1.113 CCCc1ccc(cc1)C(=O)C 1458a_100011207308_200000210301 [1,0,1,0,0,0|1,0,0]=3 1470 B12R1.113 CCCc1ccc(cc1)C(=O)[13CH3] 1458a_100011207308_200025704644 [1,0,1,0,0,0|1,0,0]=3 1471 B12R1.113 CCOc1ccc(cc1)C(=O)C 1458a_100000181891_200000210301 [1,0,1,0,0,0|2,0,0]=4 1472 B12R1.113 CCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210202 [1,0,1,0,0,0|2,0,0]=4 1473 B12R1.113 CCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210202 [1,0,1,0,0,0|2,0,0]=4 1474 B12R1.113 CCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000181891_200025704644 [1,0,1,0,0,0|2,0,0]=4 1475 B12R1.113 CCSc1ccc(cc1)C(=O)C 1458a_100000244969_200000210301 [1,0,1,0,0,0|2,0,0]=4 1476 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210202 [1,0,1,0,0,0|2,0,0]=4 1477 B12R1.113 CCSc1ccc(cc1)C(=O)C 62a_100000210202_100000185465 [1,0,1,0,0,0|2,0,0]=4 1478 B12R1.113 CCSc1ccc(cc1)C(=O)[13CH3] 1458a_100000244969_200025704644 [1,0,1,0,0,0|2,0,0]=4 1479 B12R1.113 CNCc1ccc(cc1)C(=O)C 2230a_106832991635_100000756337 [1,0,1,0,0,0|2,0,0]=4 1480 B12R1.113 CNCc1ccc(cc1)C(=O)C 26a_100102657272_100000185113 [1,0,1,0,0,0|2,0,0]=4 1481 B12R1.113 CNCc1ccc(cc1)C(=O)C 34a_100102657272_100000756337 [1,0,1,0,0,0|2,0,0]=4 1482 B12R1.113 CNCc1ccc(cc1)C(=O)C 7a_106832991635_100000756337 [1,0,1,0,0,0|2,0,0]=4 1483 B12R1.113 CNCc1ccc(cc1)C(=O)O 269956a_100000181780_200000210301 [1,0,1,0,0,0|2,0,0]=4 1484 B12R1.113 COCc1ccc(cc1)C(=O)C 1458a_100000189608_200000210301 [1,0,1,0,0,0|2,0,0]=4 1485 B12R1.113 COCc1ccc(cc1)C(=O)C 34a_100138415774_100000756337 [1,0,1,0,0,0|2,0,0]=4 1486 B12R1.113 COCc1ccc(cc1)C(=O)C 7a_100000082505_200000210301 [1,0,1,0,0,0|2,0,0]=4 1487 B12R1.113 COCc1ccc(cc1)C(=O)[13CH3] 1458a_100000189608_200025704644 [1,0,1,0,0,0|2,0,0]=4 1488 B12R1.113 CSCc1ccc(cc1)C(=O)C 1458a_100000175442_200000210301 [1,0,1,0,0,0|2,0,0]=4 1489 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_100000756337_200000210301 [1,0,1,0,0,0|2,0,0]=4 1490 B12R1.113 CSCc1ccc(cc1)C(=O)C 62a_200000210301_100000756337 [1,0,1,0,0,0|2,0,0]=4 1491 B12R1.113 CSCc1ccc(cc1)C(=O)[13CH3] 1458a_100000175442_200025704644 [1,0,1,0,0,0|2,0,0]=4 1492 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CC#N 1458a_100000693995_200025704644 [1,0,1,0,0,0|0,0,2]=4 1493 B12R1.113 [13CH3]C(=O)c1ccc(cc1)CCO 1458a_100000078963_200025704644 [1,0,1,0,0,0|1,0,0]=3 1494 B12R1.113 [13CH3]NCc1ccc(cc1)C(=O)O 269956a_100000181780_200025704644 [1,0,1,0,0,0|2,0,0]=4 1495 B12R1.116 C=C=Cc1ccc(cc1)CCN 271570a_100015277604_100000755846 [1,0,1,0,0,0|1,0,1]=4 1496 B12R1.116 CC=Cc1ccc(cc1)CCC 271570a_100016259895_100000750032 [1,0,1,0,0,0|2,0,0]=4 1497 B12R1.116 CC=Cc1ccc(cc1)CCN 271570a_100016259895_100000755846 [1,0,1,0,0,0|1,0,0]=3 1498 B12R1.116 CC=Cc1ccc(cc1)CCO 271570a_100016259895_100000766406 [1,0,1,0,0,0|2,0,0]=4 1499 B12R1.116 CC=Cc1ccc(cc1)CNN 271570a_100016259895_100016993955 [1,0,1,0,0,0|2,0,0]=4 1500 B12R1.116 CCCc1ccc(cc1)COC 34a_100138415774_100011982809 [1,0,1,0,0,0|1,0,1]=4 1501 B12R1.116 CCOc1ccc(cc1)CCN 34a_100000743037_100000210202 [1,0,1,0,0,0|2,0,0]=4 1502 B12R1.116 CCSc1ccc(cc1)CCN 62a_100000210202_100000755846 [1,0,1,0,0,0|2,0,0]=4 1503 B12R1.116 CCSc1ccc(cc1)CCN 62a_100000755846_100000210202 [1,0,1,0,0,0|2,0,0]=4 1504 B12R1.116 CNCc1ccc(cc1)CCN 26a_100102657272_100000743037 [1,0,1,0,0,0|1,0,1]=4 1505 B12R1.278 C=C=Cc1cccc(c1)NCC 271570a_100015277604_100000738899 [1,0,1,0,0,0|1,0,1]=4 1506 B12R1.278 CC=Cc1cccc(c1)CCC 271570a_100016259895_100000694964 [1,0,1,0,0,0|2,0,0]=4 1507 B12R1.278 CC=Cc1cccc(c1)NCC 271570a_100016259895_100000738899 [1,0,1,0,0,0|1,0,0]=3 1508 B12R1.278 CC=Cc1cccc(c1)OCC 271570a_100016259895_100000170002 [1,0,1,0,0,0|2,0,0]=4 1509 B12R1.278 CC=Cc1cccc(c1)SCC 271570a_100016259895_100000703699 [1,0,1,0,0,0|2,0,0]=4 1510 B12R1.278 CC=Cc1cccc(n1)NCC 271570a_100016259895_200020678610 [1,0,1,0,0,0|2,0,0]=4 1511 B12R1.278 CCNc1cccc(c1)COC 2230a_100000737370_100000210202 [1,0,1,0,0,0|0,0,1]=3 1512 B12R1.278 CCNc1cccc(c1)COC 34a_100000737370_100000210202 [1,0,1,0,0,0|0,0,1]=3 1513 B12R1.278 CCNc1cccc(c1)OCC 2230a_100000742568_100000210202 [1,0,1,0,0,0|2,0,0]=4 1514 B12R1.278 CCNc1cccc(c1)OCC 34a_100000717746_100000210202 [1,0,1,0,0,0|2,0,0]=4 1515 B12R1.278 CCNc1cccc(c1)OCC 34a_100000742568_100000210202 [1,0,1,0,0,0|2,0,0]=4 1516 B12R1.278 CCNc1cccc(c1)OCC 7a_100000717746_100000210202 [1,0,1,0,0,0|2,0,0]=4 1517 B12R1.278 CCNc1cccc(c1)SCC 62a_100000210202_100000738899 [1,0,1,0,0,0|2,0,0]=4 1518 B12R1.278 CCOc1cccc(c1)COC 34a_200011232711_200000210301 [1,0,1,0,0,0|1,0,1]=4 1519 B12R1.278 CCOc1cccc(c1)COC 7a_200011232711_200000210301 [1,0,1,0,0,0|1,0,1]=4 1520 B12R1.278 CCOc1cccc(c1)CO[13CH3] 34a_200011232711_200025704644 [1,0,1,0,0,0|1,0,1]=4 1521 B12R1.278 CCOc1cccc(c1)CO[13CH3] 7a_200011232711_200025704644 [1,0,1,0,0,0|1,0,1]=4 1522 B12R1.278 CCSc1cccc(c1)COC 62a_100000210202_100011493687 [1,0,1,0,0,0|1,0,1]=4 1523 B12R1.278 CCSc1cccc(c1)COC 62a_100011493687_100000210202 [1,0,1,0,0,0|1,0,1]=4 1524 B12R1.278 COCc1cccc(c1)NCF 34a_100000737370_100015361967 [1,0,1,0,0,0|1,0,1]=4 1525 B12R1.279 C=C(C)c1cccc(c1)CCC 271570a_100000694244_100000694964 [1,0,1,0,0,0|2,0,0]=4 1526 B12R1.279 C=C(C)c1cccc(c1)NCC 271570a_100000694244_100000738899 [1,0,1,0,0,0|1,0,0]=3 1527 B12R1.279 C=C(C)c1cccc(c1)OCC 271570a_100000694244_100000170002 [1,0,1,0,0,0|2,0,0]=4 1528 B12R1.279 C=C(C)c1cccc(c1)SCC 271570a_100000694244_100000703699 [1,0,1,0,0,0|2,0,0]=4 1529 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100000210202_100012123953 [1,0,1,0,0,0|2,0,0]=4 1530 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100012123953_100000210202 [1,0,1,0,0,0|2,0,0]=4 1531 B12R1.279 C=C(C)c1cccc(n1)NCC 271570a_100000694244_200020678610 [1,0,1,0,0,0|2,0,0]=4 1532 B12R1.279 CC(=O)c1cccc(c1)CCO 1458a_100009869812_200000210301 [1,0,1,0,0,0|2,0,0]=4 1533 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_100000084091_200025704644 [1,0,1,0,0,0|2,0,0]=4 1534 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000084091 [1,0,1,0,0,0|2,0,0]=4 1535 B12R1.279 CC(=O)c1cccc(c1)OCF 34a_100000211620_100015361967 [1,0,1,0,0,0|2,0,0]=4 1536 B12R1.279 CC(=O)c1cccc(c1)OCF 7a_100000211620_100015361967 [1,0,1,0,0,0|2,0,0]=4 1537 B12R1.279 CC(=O)c1cccc(c1)SCF 62a_100000210093_100015361967 [1,0,1,0,0,0|2,0,0]=4 1538 B12R1.279 CC(=O)c1cccc(c1)SCF 62a_100015361967_100000210093 [1,0,1,0,0,0|2,0,0]=4 1539 B12R1.279 CC=Cc1cccc(c1)C(=O)C 271570a_100016259895_100000210093 [1,0,1,0,0,0|1,0,1]=4 1540 B12R1.279 CCNc1cccc(c1)C(=O)N 34a_100000217337_100000210202 [1,0,1,0,0,0|1,0,0]=3 1541 B12R1.279 CCNc1cccc(c1)C(C)C 2230a_100000211879_100000210202 [1,0,1,0,0,0|1,0,1]=4 1542 B12R1.279 CCNc1cccc(c1)C(C)C 34a_100000211879_100000210202 [1,0,1,0,0,0|1,0,1]=4 1543 B12R1.279 CCNc1cccc(c1)C(C)C 7a_100000211879_100000210202 [1,0,1,0,0,0|1,0,1]=4 1544 B12R1.279 CCNc1cccc(c1)C(C)O 2230a_100011217120_100000210202 [1,0,1,0,0,0|0,0,2]=4 1545 B12R1.279 CCNc1cccc(c1)C(C)O 34a_100011217120_100000210202 [1,0,1,0,0,0|0,0,2]=4 1546 B12R1.279 CCNc1cccc(c1)N(C)C 34a_100000209982_100000210202 [1,0,1,0,0,0|2,0,0]=4 1547 B12R1.279 CCNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_100000210202 [1,0,1,0,0,0|1,0,1]=4 1548 B12R1.279 CCNc1cccc(n1)C(=O)C 27a_100015525214_100000085735 [1,0,1,0,0,0|1,0,0]=3 1549 B12R1.279 CCNc1cccc(n1)C(=O)N 27a_100015525214_100011834053 [1,0,1,0,0,0|2,0,0]=4 1550 B12R1.279 CCNc1ccnc(c1)C(=O)N 27a_100015525214_100000229564 [1,0,1,0,0,0|2,0,0]=4 1551 B12R1.279 CCNc1nccc(n1)C(=O)C 27a_100015525214_100010643186 [1,0,1,0,0,0|2,0,0]=4 1552 B12R1.279 CCOc1cccc(c1)C(=O)C 1458a_100000216331_200000210301 [1,0,1,0,0,0|1,0,0]=3 1553 B12R1.279 CCOc1cccc(c1)C(=O)C 34a_100000211620_100000210202 [1,0,1,0,0,0|1,0,0]=3 1554 B12R1.279 CCOc1cccc(c1)C(=O)C 7a_100000211620_100000210202 [1,0,1,0,0,0|1,0,0]=3 1555 B12R1.279 CCOc1cccc(c1)C(=O)N 34a_100000162170_100000210202 [1,0,1,0,0,0|2,0,0]=4 1556 B12R1.279 CCOc1cccc(c1)C(=O)N 7a_100000162170_100000210202 [1,0,1,0,0,0|2,0,0]=4 1557 B12R1.279 CCOc1cccc(c1)C(=O)[13CH3] 1458a_100000216331_200025704644 [1,0,1,0,0,0|1,0,0]=3 1558 B12R1.279 CCSc1cc(ccn1)C(=O)C 62a_100000210202_100000685609 [1,0,1,0,0,0|2,0,0]=4 1559 B12R1.279 CCSc1cc(ccn1)C(=O)C 62a_100000685609_100000210202 [1,0,1,0,0,0|2,0,0]=4 1560 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210093_100000210202 [1,0,1,0,0,0|1,0,0]=3 1561 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210202_100000210093 [1,0,1,0,0,0|1,0,0]=3 1562 B12R1.279 CCSc1cccc(c1)C(=O)N 62a_100000162208_100000210202 [1,0,1,0,0,0|2,0,0]=4 1563 B12R1.279 CCSc1cccc(c1)C(=O)N 62a_100000210202_100000162208 [1,0,1,0,0,0|2,0,0]=4 1564 B12R1.279 CCSc1cccc(c1)S(=O)C 62a_100000210202_100009816267 [1,0,1,0,0,0|2,0,0]=4 1565 B12R1.279 CCSc1cccc(c1)S(=O)C 62a_100009816267_100000210202 [1,0,1,0,0,0|2,0,0]=4 1566 B12R1.279 CCSc1cccc(n1)C(=O)C 62a_100000210202_100009816502 [1,0,1,0,0,0|2,0,0]=4 1567 B12R1.279 CCSc1cccc(n1)C(=O)C 62a_100009816502_100000210202 [1,0,1,0,0,0|2,0,0]=4 1568 B12R1.279 CCSc1ccnc(c1)C(=O)C 62a_100000210202_100000709912 [1,0,1,0,0,0|2,0,0]=4 1569 B12R1.279 CCSc1ccnc(c1)C(=O)C 62a_100000709912_100000210202 [1,0,1,0,0,0|2,0,0]=4 1570 B12R1.279 CCSc1cncc(c1)C(=O)C 62a_100000210202_100011216243 [1,0,1,0,0,0|2,0,0]=4 1571 B12R1.279 CCSc1cncc(c1)C(=O)C 62a_100011216243_100000210202 [1,0,1,0,0,0|2,0,0]=4 1572 B12R1.279 CNCc1cccc(c1)C(=O)C 2230a_106832991635_100000084091 [1,0,1,0,0,0|2,0,0]=4 1573 B12R1.279 CNCc1cccc(c1)C(=O)C 26a_100102657272_100000211620 [1,0,1,0,0,0|2,0,0]=4 1574 B12R1.279 CNCc1cccc(c1)C(=O)C 34a_100102657272_100000084091 [1,0,1,0,0,0|2,0,0]=4 1575 B12R1.279 CNCc1cccc(c1)C(=O)C 7a_106832991635_100000084091 [1,0,1,0,0,0|2,0,0]=4 1576 B12R1.279 CNCc1cccc(c1)C(=O)O 269956a_100000752609_200000210301 [1,0,1,0,0,0|2,0,0]=4 1577 B12R1.279 COCc1cccc(c1)C(=O)C 1458a_100000199024_200000210301 [1,0,1,0,0,0|2,0,0]=4 1578 B12R1.279 COCc1cccc(c1)C(=O)C 34a_100138415774_100000084091 [1,0,1,0,0,0|2,0,0]=4 1579 B12R1.279 COCc1cccc(c1)C(=O)[13CH3] 1458a_100000199024_200025704644 [1,0,1,0,0,0|2,0,0]=4 1580 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_100000084091_200000210301 [1,0,1,0,0,0|2,0,0]=4 1581 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_200000210301_100000084091 [1,0,1,0,0,0|2,0,0]=4 1582 B12R1.279 NC(=O)c1cccc(c1)NCF 34a_100000217337_100015361967 [1,0,1,0,0,0|2,0,0]=4 1583 B12R1.279 [13CH3]C(=O)c1cccc(c1)CCO 1458a_100009869812_200025704644 [1,0,1,0,0,0|2,0,0]=4 1584 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)O 269956a_100000752609_200025704644 [1,0,1,0,0,0|2,0,0]=4 1585 B12R1.48 C=C(C)c1ccc(c(c1)F)CC 271570a_100000694244_200010071577 [1,0,1,0,0,0|2,0,0]=4 1586 B12R1.48 C=C(C)c1ccc(c(c1)N)CC 271570a_100000694244_100012354963 [1,0,1,0,0,0|1,0,0]=3 1587 B12R1.48 C=C(C)c1ccc(c(c1)N)CO 271570a_100000694244_100000718831 [1,0,1,0,0,0|2,0,0]=4 1588 B12R1.48 C=C(C)c1ccc(c(c1)N)NC 271570a_100000694244_100000741790 [1,0,1,0,0,0|2,0,0]=4 1589 B12R1.48 C=C(C)c1ccc(c(c1)N)OC 271570a_100000694244_100000743470 [1,0,1,0,0,0|2,0,0]=4 1590 B12R1.48 C=Cc1ccc(cc1N)C(=O)C 271570a_100011290941_100009816534 [1,0,1,0,0,0|0,0,2]=4 1591 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 34a_100011772453_200025704644 [1,0,1,0,0,0|2,0,0]=4 1592 B12R1.48 CC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100011772453_200025704644 [1,0,1,0,0,0|2,0,0]=4 1593 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100010146554_200025704644 [1,0,1,0,0,0|2,0,0]=4 1594 B12R1.48 CC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100010146554 [1,0,1,0,0,0|2,0,0]=4 1595 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 34a_100000188726_200025704644 [1,0,1,0,0,0|2,0,0]=4 1596 B12R1.48 CC(=O)c1ccc(c(c1)C)O[13CH3] 7a_100000188726_200025704644 [1,0,1,0,0,0|2,0,0]=4 1597 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100000697869_200025704644 [1,0,1,0,0,0|2,0,0]=4 1598 B12R1.48 CC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000697869 [1,0,1,0,0,0|2,0,0]=4 1599 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 34a_100000188625_200025704644 [1,0,1,0,0,0|2,0,0]=4 1600 B12R1.48 CC(=O)c1ccc(c(c1)Cl)O[13CH3] 7a_100000188625_200025704644 [1,0,1,0,0,0|2,0,0]=4 1601 B12R1.48 CC(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200000210301 [1,0,1,0,0,0|2,0,0]=4 1602 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 34a_100000751691_200025704644 [1,0,1,0,0,0|2,0,0]=4 1603 B12R1.48 CC(=O)c1ccc(c(c1)F)O[13CH3] 7a_100000751691_200025704644 [1,0,1,0,0,0|2,0,0]=4 1604 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100000690002_200025704644 [1,0,1,0,0,0|2,0,0]=4 1605 B12R1.48 CC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100000690002 [1,0,1,0,0,0|2,0,0]=4 1606 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 34a_100000117292_200025704644 [1,0,1,0,0,0|1,0,0]=3 1607 B12R1.48 CC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100000117292_200025704644 [1,0,1,0,0,0|1,0,0]=3 1608 B12R1.48 CC(=O)c1ccc(c(c1)N)S[13CH3] 62a_100009816534_200025704644 [1,0,1,0,0,0|1,0,0]=3 1609 B12R1.48 CCc1ccc(cc1Br)C(=O)C 1458a_100012340589_200000210301 [1,0,1,0,0,0|1,0,0]=3 1610 B12R1.48 CCc1ccc(cc1Br)C(=O)[13CH3] 1458a_100012340589_200025704644 [1,0,1,0,0,0|1,0,0]=3 1611 B12R1.48 CCc1ccc(cc1O)C(=O)C 1458a_100000089006_200000210301 [1,0,1,0,0,0|1,0,0]=3 1612 B12R1.48 CCc1ccc(cc1O)C(=O)[13CH3] 1458a_100000089006_200025704644 [1,0,1,0,0,0|1,0,0]=3 1613 B12R1.48 COc1ccc(cc1Br)C(=O)C 1458a_100000187947_200000210301 [1,0,1,0,0,0|2,0,0]=4 1614 B12R1.48 COc1ccc(cc1Br)C(=O)C 34a_100011772453_200000210301 [1,0,1,0,0,0|2,0,0]=4 1615 B12R1.48 COc1ccc(cc1Br)C(=O)C 7a_100011772453_200000210301 [1,0,1,0,0,0|2,0,0]=4 1616 B12R1.48 COc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000187947_200025704644 [1,0,1,0,0,0|2,0,0]=4 1617 B12R1.48 COc1ccc(cc1C)C(=O)C 1458a_100011202886_200000210301 [1,0,1,0,0,0|2,0,0]=4 1618 B12R1.48 COc1ccc(cc1C)C(=O)C 34a_100000188726_200000210301 [1,0,1,0,0,0|2,0,0]=4 1619 B12R1.48 COc1ccc(cc1C)C(=O)C 7a_100000188726_200000210301 [1,0,1,0,0,0|2,0,0]=4 1620 B12R1.48 COc1ccc(cc1C)C(=O)[13CH3] 1458a_100011202886_200025704644 [1,0,1,0,0,0|2,0,0]=4 1621 B12R1.48 COc1ccc(cc1Cl)C(=O)C 1458a_100000188346_200000210301 [1,0,1,0,0,0|2,0,0]=4 1622 B12R1.48 COc1ccc(cc1Cl)C(=O)C 34a_100000188625_200000210301 [1,0,1,0,0,0|2,0,0]=4 1623 B12R1.48 COc1ccc(cc1Cl)C(=O)C 7a_100000188625_200000210301 [1,0,1,0,0,0|2,0,0]=4 1624 B12R1.48 COc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000188346_200025704644 [1,0,1,0,0,0|2,0,0]=4 1625 B12R1.48 COc1ccc(cc1F)C(=O)C 1458a_100000186160_200000210301 [1,0,1,0,0,0|2,0,0]=4 1626 B12R1.48 COc1ccc(cc1F)C(=O)C 34a_100000751691_200000210301 [1,0,1,0,0,0|2,0,0]=4 1627 B12R1.48 COc1ccc(cc1F)C(=O)C 7a_100000751691_200000210301 [1,0,1,0,0,0|2,0,0]=4 1628 B12R1.48 COc1ccc(cc1F)C(=O)[13CH3] 1458a_100000186160_200025704644 [1,0,1,0,0,0|2,0,0]=4 1629 B12R1.48 COc1ccc(cc1I)C(=O)C 1458a_100000188716_200000210301 [1,0,1,0,0,0|2,0,0]=4 1630 B12R1.48 COc1ccc(cc1I)C(=O)[13CH3] 1458a_100000188716_200025704644 [1,0,1,0,0,0|2,0,0]=4 1631 B12R1.48 COc1ccc(cc1N)C(=O)C 34a_100000117292_200000210301 [1,0,1,0,0,0|1,0,0]=3 1632 B12R1.48 COc1ccc(cc1N)C(=O)C 7a_100000117292_200000210301 [1,0,1,0,0,0|1,0,0]=3 1633 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [1,0,1,0,0,0|2,0,0]=4 1634 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [1,0,1,0,0,0|2,0,0]=4 1635 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [1,0,1,0,0,0|2,0,0]=4 1636 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_100010146554_200000210301 [1,0,1,0,0,0|2,0,0]=4 1637 B12R1.48 CSc1ccc(cc1Br)C(=O)C 62a_200000210301_100010146554 [1,0,1,0,0,0|2,0,0]=4 1638 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_100000697869_200000210301 [1,0,1,0,0,0|2,0,0]=4 1639 B12R1.48 CSc1ccc(cc1C)C(=O)C 62a_200000210301_100000697869 [1,0,1,0,0,0|2,0,0]=4 1640 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_100000690002_200000210301 [1,0,1,0,0,0|2,0,0]=4 1641 B12R1.48 CSc1ccc(cc1F)C(=O)C 62a_200000210301_100000690002 [1,0,1,0,0,0|2,0,0]=4 1642 B12R1.48 CSc1ccc(cc1N)C(=O)C 62a_100009816534_200000210301 [1,0,1,0,0,0|1,0,0]=3 1643 B12R1.48 [13CH3]C(=O)c1ccc(c(c1)F)CO 1458a_100000687192_200025704644 [1,0,1,0,0,0|2,0,0]=4 1644 B12R1.288 C=C=Cc1ccc(c(c1)N)CC 271570a_100015277604_100012354963 [1,0,1,0,0,0|1,0,1]=4 1645 B12R1.288 CC=Cc1ccc(c(c1)F)CC 271570a_100016259895_200010071577 [1,0,1,0,0,0|2,0,0]=4 1646 B12R1.288 CC=Cc1ccc(c(c1)N)CC 271570a_100016259895_100012354963 [1,0,1,0,0,0|1,0,0]=3 1647 B12R1.288 CC=Cc1ccc(c(c1)N)CO 271570a_100016259895_100000718831 [1,0,1,0,0,0|2,0,0]=4 1648 B12R1.288 CC=Cc1ccc(c(c1)N)NC 271570a_100016259895_100000741790 [1,0,1,0,0,0|2,0,0]=4 1649 B12R1.288 CC=Cc1ccc(c(c1)N)OC 271570a_100016259895_100000743470 [1,0,1,0,0,0|2,0,0]=4 1650 B12R1.288 CCSc1ccc(c(c1)N)CC 62a_100000210202_100012354963 [1,0,1,0,0,0|2,0,0]=4 1651 B12R1.288 CCSc1ccc(c(c1)N)CC 62a_100012354963_100000210202 [1,0,1,0,0,0|2,0,0]=4 1652 B12R1.288 COCc1ccc(c(c1)N)OC 34a_100011269841_200000210301 [1,0,1,0,0,0|1,0,1]=4 1653 B12R1.288 COCc1ccc(c(c1)N)SC 62a_200000210301_200013033220 [1,0,1,0,0,0|1,0,1]=4 1654 B12R1.288 COCc1ccc(c(c1)N)SC 62a_200013033220_200000210301 [1,0,1,0,0,0|1,0,1]=4 1655 B12R1.288 COCc1ccc(c(c1)N)S[13CH3] 62a_200013033220_200025704644 [1,0,1,0,0,0|1,0,1]=4 1656 B12R1.288 COCc1ccc(c(c1)N)S[13CH3] 62a_200025704644_200013033220 [1,0,1,0,0,0|1,0,1]=4 1657 B12R1.288 COc1ccc(cc1N)CO[13CH3] 34a_100011269841_200025704644 [1,0,1,0,0,0|1,0,1]=4 1658 B12R2.44 C=Cc1cc2c(cn1)CCN2 271570a_100011290941_100020639910 [2,0,0,0,0,0|1,0,1]=4 1659 B12R2.44 C=Cc1ccc2c(c1)CCC2 271570a_100011290941_100000745594 [2,0,0,0,0,0|1,0,1]=4 1660 B12R2.44 C=Cc1ccc2c(c1)NCC2 271570a_100011290941_100000754641 [2,0,0,0,0,0|0,0,1]=3 1661 B12R2.44 C=Cc1ccc2c(c1)OCC2 271570a_100011290941_100009818566 [2,0,0,0,0,0|1,0,1]=4 1662 B12R2.44 C=Cc1cnc2c(c1)NCC2 271570a_100011290941_100000698607 [2,0,0,0,0,0|1,0,1]=4 1663 B12R2.44 CNc1ccc2c(c1)CCC2 2230a_100000211504_200000210301 [2,0,0,0,0,0|2,0,0]=4 1664 B12R2.44 CNc1ccc2c(c1)CCC2 34a_100000211504_200000210301 [2,0,0,0,0,0|2,0,0]=4 1665 B12R2.44 COc1ccc2c(c1)CCC2 34a_100000209987_200000210301 [2,0,0,0,0,0|1,0,0]=3 1666 B12R2.44 COc1ccc2c(c1)CCC2 7a_100000209987_200000210301 [2,0,0,0,0,0|1,0,0]=3 1667 B12R2.44 COc1ccc2c(c1)CCN2 34a_100020636429_200000210301 [2,0,0,0,0,0|2,0,0]=4 1668 B12R2.44 COc1ccc2c(c1)CNC2 34a_100015195982_200000210301 [2,0,0,0,0,0|2,0,0]=4 1669 B12R2.44 COc1ccc2c(c1)NCC2 34a_100020636427_200000210301 [2,0,0,0,0,0|0,0,0]=2 1670 B12R2.44 COc1ccc2c(c1)OCO2 34a_100000210298_200000210301 [2,0,0,0,0,0|2,0,0]=4 1671 B12R2.44 COc1ccc2cc[nH]c2c1 34a_100000036713_200000210301 [2,0,0,0,0,0|0,0,2]=4 1672 B12R2.44 CSc1cc2c(cn1)CCN2 62a_100020639910_200000210301 [2,0,0,0,0,0|1,1,0]=4 1673 B12R2.44 CSc1cc2c(cn1)CCN2 62a_200000210301_100020639910 [2,0,0,0,0,0|1,1,0]=4 1674 B12R2.44 CSc1ccc2c(c1)CCC2 62a_100000745594_200000210301 [2,0,0,0,0,0|1,1,0]=4 1675 B12R2.44 CSc1ccc2c(c1)CCC2 62a_200000210301_100000745594 [2,0,0,0,0,0|1,1,0]=4 1676 B12R2.44 CSc1ccc2c(c1)NCC2 62a_100000754641_200000210301 [2,0,0,0,0,0|0,1,0]=3 1677 B12R2.44 CSc1ccc2c(c1)NCC2 62a_200000210301_100000754641 [2,0,0,0,0,0|0,1,0]=3 1678 B12R2.44 CSc1ccc2c(c1)OCC2 62a_100009818566_200000210301 [2,0,0,0,0,0|1,1,0]=4 1679 B12R2.44 CSc1ccc2c(c1)OCC2 62a_200000210301_100009818566 [2,0,0,0,0,0|1,1,0]=4 1680 B12R2.44 CSc1cnc2c(c1)NCC2 62a_100000698607_200000210301 [2,0,0,0,0,0|1,1,0]=4 1681 B12R2.44 CSc1cnc2c(c1)NCC2 62a_200000210301_100000698607 [2,0,0,0,0,0|1,1,0]=4 1682 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 2230a_100000211504_200025704644 [2,0,0,0,0,0|2,0,0]=4 1683 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 34a_100000211504_200025704644 [2,0,0,0,0,0|2,0,0]=4 1684 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 34a_100000209987_200025704644 [2,0,0,0,0,0|1,0,0]=3 1685 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 7a_100000209987_200025704644 [2,0,0,0,0,0|1,0,0]=3 1686 B12R2.44 [13CH3]Oc1ccc2c(c1)CCN2 34a_100020636429_200025704644 [2,0,0,0,0,0|2,0,0]=4 1687 B12R2.44 [13CH3]Oc1ccc2c(c1)CNC2 34a_100015195982_200025704644 [2,0,0,0,0,0|2,0,0]=4 1688 B12R2.44 [13CH3]Oc1ccc2c(c1)NCC2 34a_100020636427_200025704644 [2,0,0,0,0,0|0,0,0]=2 1689 B12R2.44 [13CH3]Oc1ccc2c(c1)OCO2 34a_100000210298_200025704644 [2,0,0,0,0,0|2,0,0]=4 1690 B12R2.44 [13CH3]Oc1ccc2cc[nH]c2c1 34a_100000036713_200025704644 [2,0,0,0,0,0|0,0,2]=4 1691 B12R2.44 [13CH3]Sc1cc2c(cn1)CCN2 62a_100020639910_200025704644 [2,0,0,0,0,0|1,1,0]=4 1692 B12R2.44 [13CH3]Sc1cc2c(cn1)CCN2 62a_200025704644_100020639910 [2,0,0,0,0,0|1,1,0]=4 1693 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_100000745594_200025704644 [2,0,0,0,0,0|1,1,0]=4 1694 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_200025704644_100000745594 [2,0,0,0,0,0|1,1,0]=4 1695 B12R2.44 [13CH3]Sc1ccc2c(c1)NCC2 62a_100000754641_200025704644 [2,0,0,0,0,0|0,1,0]=3 1696 B12R2.44 [13CH3]Sc1ccc2c(c1)NCC2 62a_200025704644_100000754641 [2,0,0,0,0,0|0,1,0]=3 1697 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_100009818566_200025704644 [2,0,0,0,0,0|1,1,0]=4 1698 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_200025704644_100009818566 [2,0,0,0,0,0|1,1,0]=4 1699 B12R2.44 [13CH3]Sc1cnc2c(c1)NCC2 62a_100000698607_200025704644 [2,0,0,0,0,0|1,1,0]=4 1700 B12R2.44 [13CH3]Sc1cnc2c(c1)NCC2 62a_200025704644_100000698607 [2,0,0,0,0,0|1,1,0]=4 1701 B14R1.41 CN(C)C(=O)c1ccc(c(c1)N[13CH3])F 34a_103624757406_200025704644 [0,1,1,0,0,0|2,0,0]=4 1702 B14R1.41 CN(C)C(=O)c1ccc(c(c1)N[13CH3])F 7a_103624757406_200025704644 [0,1,1,0,0,0|2,0,0]=4 1703 B14R1.41 CNc1cc(ccc1C)C(=C(C)C)C 271570a_200000049429_100020629602 [0,1,1,0,0,0|2,0,0]=4 1704 B14R1.41 CNc1cc(ccc1F)C(=O)N(C)C 34a_103624757406_200000210301 [0,1,1,0,0,0|2,0,0]=4 1705 B14R1.41 CNc1cc(ccc1F)C(=O)N(C)C 7a_103624757406_200000210301 [0,1,1,0,0,0|2,0,0]=4 1706 B14R1.41 COc1cc(ccc1C)C(=O)C(C)C 1458a_100000212341_100000210206 [0,1,1,0,0,0|2,0,0]=4 1707 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 11a_100102631434_100000212341 [0,1,1,0,0,0|2,0,0]=4 1708 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 1626a_100102631434_100000212341 [0,1,1,0,0,0|2,0,0]=4 1709 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 240690a_100102631434_100000212341 [0,1,1,0,0,0|2,0,0]=4 1710 B14R1.41 COc1cc(ccc1C)C(=O)N(C)C 527a_100102631434_100000212341 [0,1,1,0,0,0|2,0,0]=4 1711 B14R1.358 C=Cc1cc(cc(c1C)Cl)C(=O)OC 271570a_100011290941_100012360618 [0,1,1,0,0,0|1,0,1]=4 1712 B14R1.358 C=Cc1cc(cc(c1C)F)C(=O)OC 271570a_100011290941_100012920391 [0,1,1,0,0,0|1,0,1]=4 1713 B14R1.358 C=Cc1cc(cc(c1C)N)C(=O)OC 271570a_100011290941_100012353609 [0,1,1,0,0,0|1,0,1]=4 1714 B14R1.358 COC(=O)c1cc(c(c(c1)OC)C)F 34a_100000101006_200000210301 [0,1,1,0,0,0|1,0,0]=3 1715 B14R1.358 COC(=O)c1cc(c(c(c1)OC)C)F 7a_100000101006_200000210301 [0,1,1,0,0,0|1,0,0]=3 1716 B14R1.358 COC(=O)c1cc(c(c(c1)OC)Cl)Br 34a_200020639753_200000210301 [0,1,1,0,0,0|2,0,0]=4 1717 B14R1.358 COC(=O)c1cc(c(c(c1)OC)Cl)Br 7a_200020639753_200000210301 [0,1,1,0,0,0|2,0,0]=4 1718 B14R1.358 COC(=O)c1cc(c(c(c1)OC)N)O 271570a_203496583355_100010236038 [0,1,1,0,0,0|2,0,0]=4 1719 B14R1.358 COC(=O)c1cc(c(c(c1)OC)O)O 271570a_203496583355_200009811556 [0,1,1,0,0,0|2,0,0]=4 1720 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])C)F 34a_100000101006_200025704644 [0,1,1,0,0,0|1,0,0]=3 1721 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])C)F 7a_100000101006_200025704644 [0,1,1,0,0,0|1,0,0]=3 1722 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])Cl)Br 34a_200020639753_200025704644 [0,1,1,0,0,0|2,0,0]=4 1723 B14R1.358 COC(=O)c1cc(c(c(c1)O[13CH3])Cl)Br 7a_200020639753_200025704644 [0,1,1,0,0,0|2,0,0]=4 1724 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)Cl 62a_100012360618_200000210301 [0,1,1,0,0,0|1,0,0]=3 1725 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)Cl 62a_200000210301_100012360618 [0,1,1,0,0,0|1,0,0]=3 1726 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)F 62a_100012920391_200000210301 [0,1,1,0,0,0|1,0,0]=3 1727 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)F 62a_200000210301_100012920391 [0,1,1,0,0,0|1,0,0]=3 1728 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)N 62a_100012353609_200000210301 [0,1,1,0,0,0|1,0,0]=3 1729 B14R1.358 COC(=O)c1cc(c(c(c1)SC)C)N 62a_200000210301_100012353609 [0,1,1,0,0,0|1,0,0]=3 1730 B14R1.358 COC(=O)c1cc(c(c(c1)SC)F)F 62a_100010189562_200000210301 [0,1,1,0,0,0|2,0,0]=4 1731 B14R1.358 COC(=O)c1cc(c(c(c1)SC)F)F 62a_200000210301_100010189562 [0,1,1,0,0,0|2,0,0]=4 1732 B14R1.358 COC(=O)c1cc(c(c(c1)SC)F)N 62a_200000210301_200010713629 [0,1,1,0,0,0|2,0,0]=4 1733 B14R1.358 COC(=O)c1cc(c(c(c1)SC)F)N 62a_200010713629_200000210301 [0,1,1,0,0,0|2,0,0]=4 1734 B14R1.358 COC(=O)c1cc(c(c(c1)SC)N)C 62a_100010177015_200000210301 [0,1,1,0,0,0|2,0,0]=4 1735 B14R1.358 COC(=O)c1cc(c(c(c1)SC)N)C 62a_200000210301_100010177015 [0,1,1,0,0,0|2,0,0]=4 1736 B14R1.358 COC(=O)c1cc(c(c(c1)SC)N)F 62a_100010170820_200000210301 [0,1,1,0,0,0|2,0,0]=4 1737 B14R1.358 COC(=O)c1cc(c(c(c1)SC)N)F 62a_200000210301_100010170820 [0,1,1,0,0,0|2,0,0]=4 1738 B14R1.358 COC(=O)c1cc(c(c(c1)SC)N)N 62a_100010128412_200000210301 [0,1,1,0,0,0|2,0,0]=4 1739 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)Cl 62a_100135280131_200000210301 [0,1,1,0,0,0|2,0,0]=4 1740 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)Cl 62a_200000210301_100135280131 [0,1,1,0,0,0|2,0,0]=4 1741 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)N 62a_100010372079_200000210301 [0,1,1,0,0,0|2,0,0]=4 1742 B14R1.358 COC(=O)c1cc(c(c(c1)SC)O)N 62a_200000210301_100010372079 [0,1,1,0,0,0|2,0,0]=4 1743 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)Cl 62a_100012360618_200025704644 [0,1,1,0,0,0|1,0,0]=3 1744 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)Cl 62a_200025704644_100012360618 [0,1,1,0,0,0|1,0,0]=3 1745 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)F 62a_100012920391_200025704644 [0,1,1,0,0,0|1,0,0]=3 1746 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)F 62a_200025704644_100012920391 [0,1,1,0,0,0|1,0,0]=3 1747 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)N 62a_100012353609_200025704644 [0,1,1,0,0,0|1,0,0]=3 1748 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])C)N 62a_200025704644_100012353609 [0,1,1,0,0,0|1,0,0]=3 1749 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])F)F 62a_100010189562_200025704644 [0,1,1,0,0,0|2,0,0]=4 1750 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])F)F 62a_200025704644_100010189562 [0,1,1,0,0,0|2,0,0]=4 1751 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])F)N 62a_200010713629_200025704644 [0,1,1,0,0,0|2,0,0]=4 1752 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])F)N 62a_200025704644_200010713629 [0,1,1,0,0,0|2,0,0]=4 1753 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])N)C 62a_100010177015_200025704644 [0,1,1,0,0,0|2,0,0]=4 1754 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])N)C 62a_200025704644_100010177015 [0,1,1,0,0,0|2,0,0]=4 1755 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])N)F 62a_100010170820_200025704644 [0,1,1,0,0,0|2,0,0]=4 1756 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])N)F 62a_200025704644_100010170820 [0,1,1,0,0,0|2,0,0]=4 1757 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])N)N 62a_100010128412_200025704644 [0,1,1,0,0,0|2,0,0]=4 1758 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)Cl 62a_100135280131_200025704644 [0,1,1,0,0,0|2,0,0]=4 1759 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)Cl 62a_200025704644_100135280131 [0,1,1,0,0,0|2,0,0]=4 1760 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)N 62a_100010372079_200025704644 [0,1,1,0,0,0|2,0,0]=4 1761 B14R1.358 COC(=O)c1cc(c(c(c1)S[13CH3])O)N 62a_200025704644_100010372079 [0,1,1,0,0,0|2,0,0]=4 1762 B14R1.436 C=C=Cc1cc(ccc1C)C(=O)OC 271570a_100015277604_100011218856 [0,1,1,0,0,0|1,0,1]=4 1763 B14R1.436 CC=Cc1cc(ccc1Br)C(=O)OC 271570a_100016259895_100012349818 [0,1,1,0,0,0|2,0,0]=4 1764 B14R1.436 CC=Cc1cc(ccc1C)C(=O)OC 271570a_100016259895_100011218856 [0,1,1,0,0,0|1,0,0]=3 1765 B14R1.436 CC=Cc1cc(ccc1Cl)C(=O)OC 271570a_100016259895_100011294800 [0,1,1,0,0,0|2,0,0]=4 1766 B14R1.436 CC=Cc1cc(ccc1F)C(=O)OC 271570a_100016259895_100000722584 [0,1,1,0,0,0|2,0,0]=4 1767 B14R1.436 CC=Cc1cc(ccc1N)C(=O)OC 271570a_100016259895_100000187552 [0,1,1,0,0,0|2,0,0]=4 1768 B14R1.436 CC=Cc1cc(ccc1O)C(=O)OC 271570a_100016259895_100000216328 [0,1,1,0,0,0|2,0,0]=4 1769 B14R1.436 CC=Cc1cc(ncc1C)C(=O)OC 271570a_100016259895_100000065005 [0,1,1,0,0,0|2,0,0]=4 1770 B14R1.436 CC=Cc1nc(ccc1C)C(=O)OC 271570a_100016259895_100010143800 [0,1,1,0,0,0|2,0,0]=4 1771 B14R1.436 CCNc1cc(ccc1C)C(=O)NC 2230a_100000737617_100000210202 [0,1,1,0,0,0|1,0,0]=3 1772 B14R1.436 CCNc1cc(ccc1C)C(=O)NC 34a_100000737617_100000210202 [0,1,1,0,0,0|1,0,0]=3 1773 B14R1.436 CCNc1cc(ccc1C)C(=O)NC 7a_100000737617_100000210202 [0,1,1,0,0,0|1,0,0]=3 1774 B14R1.436 CCNc1cc(ccc1Cl)C(=O)NC 34a_100000740709_100000210202 [0,1,1,0,0,0|2,0,0]=4 1775 B14R1.436 CCNc1cc(ccc1F)C(=O)NC 27a_100015525214_200012359898 [0,1,1,0,0,0|2,0,0]=4 1776 B14R1.436 CCNc1cc(ccc1F)C(=O)NC 34a_100011295210_100000210202 [0,1,1,0,0,0|2,0,0]=4 1777 B14R1.436 CCNc1cc(cnc1F)C(=O)OC 27a_100015525214_100000117919 [0,1,1,0,0,0|2,0,0]=4 1778 B14R1.436 CCNc1nc(cnc1C)C(=O)OC 27a_100015525214_200010778766 [0,1,1,0,0,0|2,0,0]=4 1779 B14R1.436 CCOc1cc(ccc1Br)C(=O)OC 34a_100011934688_100000210202 [0,1,1,0,0,0|2,0,0]=4 1780 B14R1.436 CCOc1cc(ccc1Br)C(=O)OC 7a_100011934688_100000210202 [0,1,1,0,0,0|2,0,0]=4 1781 B14R1.436 CCOc1cc(ccc1C)C(=O)CC 1458a_100000238212_100000210202 [0,1,1,0,0,0|2,0,0]=4 1782 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 11a_106832991635_100000238212 [0,1,1,0,0,0|2,0,0]=4 1783 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 1626a_100102657272_100000238212 [0,1,1,0,0,0|2,0,0]=4 1784 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 240690a_100102657272_100000238212 [0,1,1,0,0,0|2,0,0]=4 1785 B14R1.436 CCOc1cc(ccc1C)C(=O)NC 527a_100102657272_100000238212 [0,1,1,0,0,0|2,0,0]=4 1786 B14R1.436 CCOc1cc(ccc1C)C(=O)OC 34a_100000736511_100000210202 [0,1,1,0,0,0|1,0,0]=3 1787 B14R1.436 CCOc1cc(ccc1C)C(=O)OC 7a_100000736511_100000210202 [0,1,1,0,0,0|1,0,0]=3 1788 B14R1.436 CCOc1cc(ccc1Cl)C(=O)OC 34a_100000103815_100000210202 [0,1,1,0,0,0|2,0,0]=4 1789 B14R1.436 CCOc1cc(ccc1Cl)C(=O)OC 7a_100000103815_100000210202 [0,1,1,0,0,0|2,0,0]=4 1790 B14R1.436 CCOc1cc(ccc1F)C(=O)OC 34a_100000062259_100000210202 [0,1,1,0,0,0|2,0,0]=4 1791 B14R1.436 CCOc1cc(ccc1F)C(=O)OC 7a_100000062259_100000210202 [0,1,1,0,0,0|2,0,0]=4 1792 B14R1.436 CCOc1cc(ccc1I)C(=O)OC 34a_100012350776_100000210202 [0,1,1,0,0,0|2,0,0]=4 1793 B14R1.436 CCOc1cc(ccc1I)C(=O)OC 7a_100012350776_100000210202 [0,1,1,0,0,0|2,0,0]=4 1794 B14R1.436 CCOc1cc(ccc1N)C(=O)OC 34a_100000757247_100000210202 [0,1,1,0,0,0|2,0,0]=4 1795 B14R1.436 CCOc1cc(ccc1N)C(=O)OC 7a_100000757247_100000210202 [0,1,1,0,0,0|2,0,0]=4 1796 B14R1.436 CCSc1cc(ccc1Br)C(=O)OC 62a_100000210202_100012349818 [0,1,1,0,0,0|2,0,0]=4 1797 B14R1.436 CCSc1cc(ccc1Br)C(=O)OC 62a_100012349818_100000210202 [0,1,1,0,0,0|2,0,0]=4 1798 B14R1.436 CCSc1cc(ccc1C)C(=O)OC 62a_100000210202_100000723194 [0,1,1,0,0,0|1,0,0]=3 1799 B14R1.436 CCSc1cc(ccc1C)C(=O)OC 62a_100000723194_100000210202 [0,1,1,0,0,0|1,0,0]=3 1800 B14R1.436 CCSc1cc(ccc1Cl)C(=O)OC 62a_100000210202_100011294800 [0,1,1,0,0,0|2,0,0]=4 1801 B14R1.436 CCSc1cc(ccc1Cl)C(=O)OC 62a_100011294800_100000210202 [0,1,1,0,0,0|2,0,0]=4 1802 B14R1.436 CCSc1cc(ccc1F)C(=O)OC 62a_100000210202_100000722584 [0,1,1,0,0,0|2,0,0]=4 1803 B14R1.436 CCSc1cc(ccc1F)C(=O)OC 62a_100000722584_100000210202 [0,1,1,0,0,0|2,0,0]=4 1804 B14R1.436 CCSc1cc(ccc1N)C(=O)OC 62a_100000187552_100000210202 [0,1,1,0,0,0|2,0,0]=4 1805 B14R1.436 CCSc1cc(ccc1N)C(=O)OC 62a_100000210202_100000187552 [0,1,1,0,0,0|2,0,0]=4 1806 B14R1.436 CCSc1cc(ccc1O)C(=O)OC 62a_100000210202_100000216328 [0,1,1,0,0,0|2,0,0]=4 1807 B14R1.436 CCSc1cc(ccc1O)C(=O)OC 62a_100000216328_100000210202 [0,1,1,0,0,0|2,0,0]=4 1808 B14R1.436 CCSc1cc(ncc1C)C(=O)OC 62a_100000065005_100000210202 [0,1,1,0,0,0|2,0,0]=4 1809 B14R1.436 CCSc1cc(ncc1C)C(=O)OC 62a_100000210202_100000065005 [0,1,1,0,0,0|2,0,0]=4 1810 B14R1.436 CCSc1nc(ccc1C)C(=O)OC 62a_100000210202_100010143800 [0,1,1,0,0,0|2,0,0]=4 1811 B14R1.436 CCSc1nc(ccc1C)C(=O)OC 62a_100010143800_100000210202 [0,1,1,0,0,0|2,0,0]=4 1812 B14R1.436 CNC(=O)c1ccc(c(c1)NCF)C 34a_100000737617_100015361967 [0,1,1,0,0,0|1,0,0]=3 1813 B14R1.436 CNC(=O)c1ccc(c(c1)NCF)C 7a_100000737617_100015361967 [0,1,1,0,0,0|1,0,0]=3 1814 B14R1.436 CNC(=O)c1ccc(c(c1)NCF)Cl 34a_100000740709_100015361967 [0,1,1,0,0,0|2,0,0]=4 1815 B14R1.436 CNC(=O)c1ccc(c(c1)NCF)F 34a_100011295210_100015361967 [0,1,1,0,0,0|2,0,0]=4 1816 B14R1.436 CNCc1cc(ccc1Br)C(=O)OC 2230a_106832991635_100012232407 [0,1,1,0,0,0|1,0,0]=3 1817 B14R1.436 CNCc1cc(ccc1Br)C(=O)OC 26a_100102657272_100011934688 [0,1,1,0,0,0|1,0,0]=3 1818 B14R1.436 CNCc1cc(ccc1Br)C(=O)OC 270004a_106832991635_100012274322 [0,1,1,0,0,0|1,0,0]=3 1819 B14R1.436 CNCc1cc(ccc1Br)C(=O)OC 34a_100102657272_100012232407 [0,1,1,0,0,0|1,0,0]=3 1820 B14R1.436 CNCc1cc(ccc1Br)C(=O)OC 7a_106832991635_100012232407 [0,1,1,0,0,0|1,0,0]=3 1821 B14R1.436 CNCc1cc(ccc1C)C(=O)OC 270004a_106832991635_100010624047 [0,1,1,0,0,0|0,0,0]=2 1822 B14R1.436 CNCc1cc(ccc1Cl)C(=O)OC 2230a_106832991635_100000698984 [0,1,1,0,0,0|1,0,0]=3 1823 B14R1.436 CNCc1cc(ccc1Cl)C(=O)OC 26a_100102657272_100000103815 [0,1,1,0,0,0|1,0,0]=3 1824 B14R1.436 CNCc1cc(ccc1Cl)C(=O)OC 270004a_106832991635_100000725138 [0,1,1,0,0,0|1,0,0]=3 1825 B14R1.436 CNCc1cc(ccc1Cl)C(=O)OC 7a_106832991635_100000698984 [0,1,1,0,0,0|1,0,0]=3 1826 B14R1.436 CNCc1cc(ccc1F)C(=O)OC 26a_100102657272_100000062259 [0,1,1,0,0,0|1,0,0]=3 1827 B14R1.436 COC(=O)c1cc(c(cn1)C)SCF 62a_100000065005_100015361967 [0,1,1,0,0,0|2,0,0]=4 1828 B14R1.436 COC(=O)c1cc(c(cn1)C)SCF 62a_100015361967_100000065005 [0,1,1,0,0,0|2,0,0]=4 1829 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])Br 34a_100010201863_200025704644 [0,1,1,0,0,0|2,0,0]=4 1830 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])Br 7a_100010201863_200025704644 [0,1,1,0,0,0|2,0,0]=4 1831 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])N 34a_200015838792_200025704644 [0,1,1,0,0,0|2,0,0]=4 1832 B14R1.436 COC(=O)c1ccc(c(c1)CO[13CH3])N 7a_200015838792_200025704644 [0,1,1,0,0,0|2,0,0]=4 1833 B14R1.436 COC(=O)c1ccc(c(c1)CSC)Br 62a_100012232407_200000210301 [0,1,1,0,0,0|2,0,0]=4 1834 B14R1.436 COC(=O)c1ccc(c(c1)CSC)Br 62a_200000210301_100012232407 [0,1,1,0,0,0|2,0,0]=4 1835 B14R1.436 COC(=O)c1ccc(c(c1)CSC)Cl 62a_100000698984_200000210301 [0,1,1,0,0,0|2,0,0]=4 1836 B14R1.436 COC(=O)c1ccc(c(c1)CSC)Cl 62a_200000210301_100000698984 [0,1,1,0,0,0|2,0,0]=4 1837 B14R1.436 COC(=O)c1ccc(c(c1)CS[13CH3])Br 62a_100012232407_200025704644 [0,1,1,0,0,0|2,0,0]=4 1838 B14R1.436 COC(=O)c1ccc(c(c1)CS[13CH3])Br 62a_200025704644_100012232407 [0,1,1,0,0,0|2,0,0]=4 1839 B14R1.436 COC(=O)c1ccc(c(c1)CS[13CH3])Cl 62a_100000698984_200025704644 [0,1,1,0,0,0|2,0,0]=4 1840 B14R1.436 COC(=O)c1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100000698984 [0,1,1,0,0,0|2,0,0]=4 1841 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Br 34a_100011934688_100015361967 [0,1,1,0,0,0|2,0,0]=4 1842 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Br 7a_100011934688_100015361967 [0,1,1,0,0,0|2,0,0]=4 1843 B14R1.436 COC(=O)c1ccc(c(c1)OCF)C 34a_100000736511_100015361967 [0,1,1,0,0,0|1,0,0]=3 1844 B14R1.436 COC(=O)c1ccc(c(c1)OCF)C 7a_100000736511_100015361967 [0,1,1,0,0,0|1,0,0]=3 1845 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Cl 34a_100000103815_100015361967 [0,1,1,0,0,0|2,0,0]=4 1846 B14R1.436 COC(=O)c1ccc(c(c1)OCF)Cl 7a_100000103815_100015361967 [0,1,1,0,0,0|2,0,0]=4 1847 B14R1.436 COC(=O)c1ccc(c(c1)OCF)F 34a_100000062259_100015361967 [0,1,1,0,0,0|2,0,0]=4 1848 B14R1.436 COC(=O)c1ccc(c(c1)OCF)F 7a_100000062259_100015361967 [0,1,1,0,0,0|2,0,0]=4 1849 B14R1.436 COC(=O)c1ccc(c(c1)OCF)I 34a_100012350776_100015361967 [0,1,1,0,0,0|2,0,0]=4 1850 B14R1.436 COC(=O)c1ccc(c(c1)OCF)I 7a_100012350776_100015361967 [0,1,1,0,0,0|2,0,0]=4 1851 B14R1.436 COC(=O)c1ccc(c(c1)OCF)N 34a_100000757247_100015361967 [0,1,1,0,0,0|2,0,0]=4 1852 B14R1.436 COC(=O)c1ccc(c(c1)OCF)N 7a_100000757247_100015361967 [0,1,1,0,0,0|2,0,0]=4 1853 B14R1.436 COC(=O)c1ccc(c(c1)SCF)Br 62a_100012349818_100015361967 [0,1,1,0,0,0|2,0,0]=4 1854 B14R1.436 COC(=O)c1ccc(c(c1)SCF)Br 62a_100015361967_100012349818 [0,1,1,0,0,0|2,0,0]=4 1855 B14R1.436 COC(=O)c1ccc(c(c1)SCF)C 62a_100000723194_100015361967 [0,1,1,0,0,0|1,0,0]=3 1856 B14R1.436 COC(=O)c1ccc(c(c1)SCF)C 62a_100015361967_100000723194 [0,1,1,0,0,0|1,0,0]=3 1857 B14R1.436 COC(=O)c1ccc(c(c1)SCF)Cl 62a_100011294800_100015361967 [0,1,1,0,0,0|2,0,0]=4 1858 B14R1.436 COC(=O)c1ccc(c(c1)SCF)Cl 62a_100015361967_100011294800 [0,1,1,0,0,0|2,0,0]=4 1859 B14R1.436 COC(=O)c1ccc(c(c1)SCF)F 62a_100000722584_100015361967 [0,1,1,0,0,0|2,0,0]=4 1860 B14R1.436 COC(=O)c1ccc(c(c1)SCF)F 62a_100015361967_100000722584 [0,1,1,0,0,0|2,0,0]=4 1861 B14R1.436 COC(=O)c1ccc(c(c1)SCF)N 62a_100000187552_100015361967 [0,1,1,0,0,0|2,0,0]=4 1862 B14R1.436 COC(=O)c1ccc(c(c1)SCF)N 62a_100015361967_100000187552 [0,1,1,0,0,0|2,0,0]=4 1863 B14R1.436 COC(=O)c1ccc(c(c1)SCF)O 62a_100000216328_100015361967 [0,1,1,0,0,0|2,0,0]=4 1864 B14R1.436 COC(=O)c1ccc(c(c1)SCF)O 62a_100015361967_100000216328 [0,1,1,0,0,0|2,0,0]=4 1865 B14R1.436 COC(=O)c1ccc(c(n1)SCF)C 62a_100010143800_100015361967 [0,1,1,0,0,0|2,0,0]=4 1866 B14R1.436 COC(=O)c1ccc(c(n1)SCF)C 62a_100015361967_100010143800 [0,1,1,0,0,0|2,0,0]=4 1867 B14R1.436 COCc1cc(ccc1Br)C(=O)OC 34a_100010201863_200000210301 [0,1,1,0,0,0|2,0,0]=4 1868 B14R1.436 COCc1cc(ccc1Br)C(=O)OC 34a_100138415774_100012232407 [0,1,1,0,0,0|2,0,0]=4 1869 B14R1.436 COCc1cc(ccc1Br)C(=O)OC 7a_100010201863_200000210301 [0,1,1,0,0,0|2,0,0]=4 1870 B14R1.436 COCc1cc(ccc1N)C(=O)OC 34a_200015838792_200000210301 [0,1,1,0,0,0|2,0,0]=4 1871 B14R1.436 COCc1cc(ccc1N)C(=O)OC 7a_200015838792_200000210301 [0,1,1,0,0,0|2,0,0]=4 1872 B14R1.436 COCc1cc(ccc1O)C(=O)OC 271570a_203496583355_200010890493 [0,1,1,0,0,0|2,0,0]=4 1873 B14R1.626 C=Cc1cc(ccc1C)C(=O)OCC 271570a_100011290941_100012359631 [0,1,1,0,0,0|1,0,1]=4 1874 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210303 [0,1,1,0,0,0|2,0,0]=4 1875 B14R1.626 CCNC(=O)c1ccc(c(c1)NC)C 34a_100000740560_200000210301 [0,1,1,0,0,0|1,0,0]=3 1876 B14R1.626 CCNC(=O)c1ccc(c(c1)NC)C 7a_100000740560_200000210301 [0,1,1,0,0,0|1,0,0]=3 1877 B14R1.626 CCNC(=O)c1ccc(c(c1)NC)F 27a_100102657272_200012359900 [0,1,1,0,0,0|2,0,0]=4 1878 B14R1.626 CCNC(=O)c1ccc(c(c1)N[13CH3])C 34a_100000740560_200025704644 [0,1,1,0,0,0|1,0,0]=3 1879 B14R1.626 CCNC(=O)c1ccc(c(c1)N[13CH3])C 7a_100000740560_200025704644 [0,1,1,0,0,0|1,0,0]=3 1880 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 11a_100015525214_100000212341 [0,1,1,0,0,0|2,0,0]=4 1881 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 240690a_100015525214_100000212341 [0,1,1,0,0,0|2,0,0]=4 1882 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 527a_100015525214_100000212341 [0,1,1,0,0,0|2,0,0]=4 1883 B14R1.626 CCOC(=O)c1cc(c(cn1)C)SC 62a_100009880029_200000210301 [0,1,1,0,0,0|2,0,0]=4 1884 B14R1.626 CCOC(=O)c1cc(c(cn1)C)SC 62a_200000210301_100009880029 [0,1,1,0,0,0|2,0,0]=4 1885 B14R1.626 CCOC(=O)c1cc(c(cn1)C)S[13CH3] 62a_100009880029_200025704644 [0,1,1,0,0,0|2,0,0]=4 1886 B14R1.626 CCOC(=O)c1cc(c(cn1)C)S[13CH3] 62a_200025704644_100009880029 [0,1,1,0,0,0|2,0,0]=4 1887 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)Br 7a_100012355281_200000210301 [0,1,1,0,0,0|2,0,0]=4 1888 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F 34a_200009842343_200000210301 [0,1,1,0,0,0|2,0,0]=4 1889 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F 7a_200009842343_200000210301 [0,1,1,0,0,0|2,0,0]=4 1890 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)N 7a_100000756704_200000210301 [0,1,1,0,0,0|2,0,0]=4 1891 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100010189661 [0,1,1,0,0,0|2,0,0]=4 1892 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100012355281_200025704644 [0,1,1,0,0,0|2,0,0]=4 1893 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])F 34a_200009842343_200025704644 [0,1,1,0,0,0|2,0,0]=4 1894 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])F 7a_200009842343_200025704644 [0,1,1,0,0,0|2,0,0]=4 1895 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000756704_200025704644 [0,1,1,0,0,0|2,0,0]=4 1896 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)C 62a_100012359631_200000210301 [0,1,1,0,0,0|1,0,0]=3 1897 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)C 62a_200000210301_100012359631 [0,1,1,0,0,0|1,0,0]=3 1898 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)F 62a_100011934563_200000210301 [0,1,1,0,0,0|2,0,0]=4 1899 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100011934563 [0,1,1,0,0,0|2,0,0]=4 1900 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)N 62a_100161115259_200000210301 [0,1,1,0,0,0|2,0,0]=4 1901 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)N 62a_200000210301_100161115259 [0,1,1,0,0,0|2,0,0]=4 1902 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100009812659 [0,1,1,0,0,0|2,0,0]=4 1903 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])C 62a_100012359631_200025704644 [0,1,1,0,0,0|1,0,0]=3 1904 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100012359631 [0,1,1,0,0,0|1,0,0]=3 1905 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])F 62a_100011934563_200025704644 [0,1,1,0,0,0|2,0,0]=4 1906 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011934563 [0,1,1,0,0,0|2,0,0]=4 1907 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])N 62a_100161115259_200025704644 [0,1,1,0,0,0|2,0,0]=4 1908 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100161115259 [0,1,1,0,0,0|2,0,0]=4 1909 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100009812659 [0,1,1,0,0,0|2,0,0]=4 1910 B14R1.626 CCOC(=O)c1ccc(c(n1)NC)C 27a_100102657272_200009853511 [0,1,1,0,0,0|1,0,0]=3 1911 B14R1.626 CCOC(=O)c1ccc(c(n1)SC)C 62a_200000210301_200009853511 [0,1,1,0,0,0|2,0,0]=4 1912 B14R1.626 CCOC(=O)c1ccc(c(n1)S[13CH3])C 62a_200025704644_200009853511 [0,1,1,0,0,0|2,0,0]=4 1913 B14R1.626 CCOC(=O)c1cnc(c(c1)NC)N 27a_100102657272_100009816805 [0,1,1,0,0,0|2,0,0]=4 1914 B14R1.626 CNNC(=O)c1ccc(c(c1)OC)C 22a_100016993582_100000212341 [0,1,1,0,0,0|2,0,0]=4 1915 B14R1.626 COCC(=O)c1ccc(c(c1)OC)Br 34a_100138415774_200010710740 [0,1,1,0,0,0|2,0,0]=4 1916 B14R1.626 COCC(=O)c1ccc(c(c1)OC)F 34a_100138415774_200012348595 [0,1,1,0,0,0|2,0,0]=4 1917 B14R1.626 COc1cc(ccc1C)C(=O)CCF 1458a_100000212341_100011217306 [0,1,1,0,0,0|2,0,0]=4 1918 B14R1.626 COc1cc(ccc1C)C(=O)CCO 1458a_100000212341_100000211926 [0,1,1,0,0,0|2,0,0]=4 1919 B14R1.748 C=C(C)c1cc(ccc1Br)C(=O)OC 271570a_100000694244_100012349818 [0,1,1,0,0,0|2,0,0]=4 1920 B14R1.748 C=C(C)c1cc(ccc1C)C(=O)OC 271570a_100000694244_100011218856 [0,1,1,0,0,0|1,0,0]=3 1921 B14R1.748 C=C(C)c1cc(ccc1Cl)C(=O)OC 271570a_100000694244_100011294800 [0,1,1,0,0,0|2,0,0]=4 1922 B14R1.748 C=C(C)c1cc(ccc1F)C(=O)OC 271570a_100000694244_100000722584 [0,1,1,0,0,0|2,0,0]=4 1923 B14R1.748 C=C(C)c1cc(ccc1N)C(=O)OC 271570a_100000694244_100000187552 [0,1,1,0,0,0|2,0,0]=4 1924 B14R1.748 C=C(C)c1cc(ccc1O)C(=O)OC 271570a_100000694244_100000216328 [0,1,1,0,0,0|2,0,0]=4 1925 B14R1.748 C=C(C)c1cc(ncc1C)C(=O)OC 271570a_100000694244_100000065005 [0,1,1,0,0,0|2,0,0]=4 1926 B14R1.748 C=C(C)c1nc(ccc1C)C(=O)OC 271570a_100000694244_100010143800 [0,1,1,0,0,0|2,0,0]=4 1927 B14R1.748 CNC(=O)c1ccc(c(c1)N(C)C)F 27a_100102631434_200012359898 [0,1,1,0,0,0|2,0,0]=4 1928 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)Br 1458a_100010710364_200000210301 [0,1,1,0,0,0|2,0,0]=4 1929 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)Cl 1458a_200000732520_200000210301 [0,1,1,0,0,0|2,0,0]=4 1930 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)C)O 271570a_203496583355_200016005208 [0,1,1,0,0,0|2,0,0]=4 1931 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)[13CH3])Br 1458a_100010710364_200025704644 [0,1,1,0,0,0|2,0,0]=4 1932 B14R1.748 COC(=O)c1ccc(c(c1)C(=O)[13CH3])Cl 1458a_200000732520_200025704644 [0,1,1,0,0,0|2,0,0]=4 1933 B14R1.748 COC(=O)c1ccc(c(c1)C(C)C)O 271570a_203496583355_200025703530 [0,1,1,0,0,0|2,0,0]=4 1934 B14R1.748 COC(=O)c1cnc(c(c1)N(C)C)F 27a_100102631434_100000117919 [0,1,1,0,0,0|2,0,0]=4 1935 B14R1.748 COC(=O)c1cnc(c(n1)N(C)C)C 27a_100102631434_200010778766 [0,1,1,0,0,0|2,0,0]=4 1936 B14R1.1864 C=Cc1cc(ccc1CC)C(=O)OC 271570a_100011290941_200012360130 [0,1,1,0,0,0|1,0,1]=4 1937 B14R1.1864 C=Cc1cc(ccc1CO)C(=O)OC 271570a_100011290941_100012355398 [0,1,1,0,0,0|1,0,1]=4 1938 B14R1.1864 C=Cc1cc(ccc1OC)C(=O)OC 271570a_100011290941_100000189012 [0,1,1,0,0,0|1,0,1]=4 1939 B14R1.1864 C=Cc1ccc(cc1OC)C(=O)OC 271570a_100011290941_100009816954 [0,1,1,0,0,0|1,0,1]=4 1940 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000210202 [0,1,1,0,0,0|2,0,0]=4 1941 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 34a_100000012293_200000210301 [0,1,1,0,0,0|2,0,0]=4 1942 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 7a_100000012293_200000210301 [0,1,1,0,0,0|2,0,0]=4 1943 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_100000012293_200025704644 [0,1,1,0,0,0|2,0,0]=4 1944 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000012293_200025704644 [0,1,1,0,0,0|2,0,0]=4 1945 B14R1.1864 CCc1ccc(cc1SC)C(=O)OC 62a_200000210301_200012360130 [0,1,1,0,0,0|1,0,0]=3 1946 B14R1.1864 CCc1ccc(cc1SC)C(=O)OC 62a_200012360130_200000210301 [0,1,1,0,0,0|1,0,0]=3 1947 B14R1.1864 CCc1ccc(cc1S[13CH3])C(=O)OC 62a_200012360130_200025704644 [0,1,1,0,0,0|1,0,0]=3 1948 B14R1.1864 CCc1ccc(cc1S[13CH3])C(=O)OC 62a_200025704644_200012360130 [0,1,1,0,0,0|1,0,0]=3 1949 B14R1.1864 CNC(=O)c1ccc(c(c1)NC)OC 2230a_100000740754_200000210301 [0,1,1,0,0,0|1,0,0]=3 1950 B14R1.1864 CNC(=O)c1ccc(c(c1)NC)OC 34a_100000740754_200000210301 [0,1,1,0,0,0|1,0,0]=3 1951 B14R1.1864 CNC(=O)c1ccc(c(c1)N[13CH3])OC 2230a_100000740754_200025704644 [0,1,1,0,0,0|1,0,0]=3 1952 B14R1.1864 CNC(=O)c1ccc(c(c1)N[13CH3])OC 34a_100000740754_200025704644 [0,1,1,0,0,0|1,0,0]=3 1953 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)NC 2230a_100011850465_200000210301 [0,1,1,0,0,0|2,0,0]=4 1954 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)NC 34a_100011850465_200000210301 [0,1,1,0,0,0|2,0,0]=4 1955 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)N[13CH3] 2230a_100011850465_200025704644 [0,1,1,0,0,0|2,0,0]=4 1956 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)N[13CH3] 34a_100011850465_200025704644 [0,1,1,0,0,0|2,0,0]=4 1957 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 11a_106832991635_100000211223 [0,1,1,0,0,0|2,0,0]=4 1958 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 1626a_100102657272_100000211223 [0,1,1,0,0,0|2,0,0]=4 1959 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 240690a_100102657272_100000211223 [0,1,1,0,0,0|2,0,0]=4 1960 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 527a_100102657272_100000211223 [0,1,1,0,0,0|2,0,0]=4 1961 B14R1.1864 CNc1ccc(cc1C#N)C(=O)OC 27a_100102657272_100010150795 [0,1,1,0,0,0|2,0,0]=4 1962 B14R1.1864 CNc1ncc(cc1OC)C(=O)OC 27a_100102657272_100010074909 [0,1,1,0,0,0|2,0,0]=4 1963 B14R1.1864 COC(=O)c1cc(c(cn1)OC)SC 62a_200000210301_200010136175 [0,1,1,0,0,0|2,0,0]=4 1964 B14R1.1864 COC(=O)c1cc(c(cn1)OC)SC 62a_200010136175_200000210301 [0,1,1,0,0,0|2,0,0]=4 1965 B14R1.1864 COC(=O)c1cc(c(cn1)OC)S[13CH3] 62a_200010136175_200025704644 [0,1,1,0,0,0|2,0,0]=4 1966 B14R1.1864 COC(=O)c1cc(c(cn1)OC)S[13CH3] 62a_200025704644_200010136175 [0,1,1,0,0,0|2,0,0]=4 1967 B14R1.1864 COC(=O)c1cc(c(cn1)SC)OC 62a_100010136178_200000210301 [0,1,1,0,0,0|2,0,0]=4 1968 B14R1.1864 COC(=O)c1cc(c(cn1)SC)OC 62a_200000210301_100010136178 [0,1,1,0,0,0|2,0,0]=4 1969 B14R1.1864 COC(=O)c1cc(c(cn1)S[13CH3])OC 62a_100010136178_200025704644 [0,1,1,0,0,0|2,0,0]=4 1970 B14R1.1864 COC(=O)c1cc(c(cn1)S[13CH3])OC 62a_200025704644_100010136178 [0,1,1,0,0,0|2,0,0]=4 1971 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)OC 34a_100009865136_200000210301 [0,1,1,0,0,0|2,0,0]=4 1972 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)OC 7a_100009865136_200000210301 [0,1,1,0,0,0|2,0,0]=4 1973 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)O[13CH3] 34a_100009865136_200025704644 [0,1,1,0,0,0|2,0,0]=4 1974 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)O[13CH3] 7a_100009865136_200025704644 [0,1,1,0,0,0|2,0,0]=4 1975 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)SC 62a_200000210301_100010150795 [0,1,1,0,0,0|2,0,0]=4 1976 B14R1.1864 COC(=O)c1ccc(c(c1)C#N)S[13CH3] 62a_200025704644_100010150795 [0,1,1,0,0,0|2,0,0]=4 1977 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)SC 62a_100012274322_200000210301 [0,1,1,0,0,0|2,0,0]=4 1978 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)SC 62a_200000210301_100012274322 [0,1,1,0,0,0|2,0,0]=4 1979 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)S[13CH3] 62a_100012274322_200025704644 [0,1,1,0,0,0|2,0,0]=4 1980 B14R1.1864 COC(=O)c1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100012274322 [0,1,1,0,0,0|2,0,0]=4 1981 B14R1.1864 COC(=O)c1ccc(c(c1)CO)SC 62a_100010201863_200000210301 [0,1,1,0,0,0|2,0,0]=4 1982 B14R1.1864 COC(=O)c1ccc(c(c1)CO)SC 62a_200000210301_100010201863 [0,1,1,0,0,0|2,0,0]=4 1983 B14R1.1864 COC(=O)c1ccc(c(c1)CO)S[13CH3] 62a_100010201863_200025704644 [0,1,1,0,0,0|2,0,0]=4 1984 B14R1.1864 COC(=O)c1ccc(c(c1)CO)S[13CH3] 62a_200025704644_100010201863 [0,1,1,0,0,0|2,0,0]=4 1985 B14R1.1864 COC(=O)c1ccc(c(c1)OC)C#N 34a_100000044657_200000210301 [0,1,1,0,0,0|1,0,1]=4 1986 B14R1.1864 COC(=O)c1ccc(c(c1)OC)C#N 7a_100000044657_200000210301 [0,1,1,0,0,0|1,0,1]=4 1987 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 34a_100000212147_200000210301 [0,1,1,0,0,0|1,0,0]=3 1988 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 34a_100011215032_200000210301 [0,1,1,0,0,0|1,0,0]=3 1989 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 7a_100000212147_200000210301 [0,1,1,0,0,0|1,0,0]=3 1990 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 7a_100011215032_200000210301 [0,1,1,0,0,0|1,0,0]=3 1991 B14R1.1864 COC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_100000212147_200025704644 [0,1,1,0,0,0|1,0,0]=3 1992 B14R1.1864 COC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000212147_200025704644 [0,1,1,0,0,0|1,0,0]=3 1993 B14R1.1864 COC(=O)c1ccc(c(c1)OC)SC 62a_100009816954_200000210301 [0,1,1,0,0,0|1,0,0]=3 1994 B14R1.1864 COC(=O)c1ccc(c(c1)OC)SC 62a_200000210301_100009816954 [0,1,1,0,0,0|1,0,0]=3 1995 B14R1.1864 COC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_100009816954_200025704644 [0,1,1,0,0,0|1,0,0]=3 1996 B14R1.1864 COC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100009816954 [0,1,1,0,0,0|1,0,0]=3 1997 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])C#N 34a_100000044657_200025704644 [0,1,1,0,0,0|1,0,1]=4 1998 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])C#N 7a_100000044657_200025704644 [0,1,1,0,0,0|1,0,1]=4 1999 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])OC 34a_100011215032_200025704644 [0,1,1,0,0,0|1,0,0]=3 2000 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])OC 7a_100011215032_200025704644 [0,1,1,0,0,0|1,0,0]=3 2001 B14R1.1864 COC(=O)c1ccc(c(c1)SC)C#N 62a_200000210301_100009861381 [0,1,1,0,0,0|1,0,1]=4 2002 B14R1.1864 COC(=O)c1ccc(c(c1)SC)C=O 62a_100012179231_200000210301 [0,1,1,0,0,0|1,0,1]=4 2003 B14R1.1864 COC(=O)c1ccc(c(c1)SC)C=O 62a_200000210301_100012179231 [0,1,1,0,0,0|1,0,1]=4 2004 B14R1.1864 COC(=O)c1ccc(c(c1)SC)CO 62a_100012355398_200000210301 [0,1,1,0,0,0|1,0,0]=3 2005 B14R1.1864 COC(=O)c1ccc(c(c1)SC)CO 62a_200000210301_100012355398 [0,1,1,0,0,0|1,0,0]=3 2006 B14R1.1864 COC(=O)c1ccc(c(c1)SC)OC 62a_100000189012_200000210301 [0,1,1,0,0,0|1,0,0]=3 2007 B14R1.1864 COC(=O)c1ccc(c(c1)SC)OC 62a_200000210301_100000189012 [0,1,1,0,0,0|1,0,0]=3 2008 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])C#N 62a_200025704644_100009861381 [0,1,1,0,0,0|1,0,1]=4 2009 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])C=O 62a_100012179231_200025704644 [0,1,1,0,0,0|1,0,1]=4 2010 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])C=O 62a_200025704644_100012179231 [0,1,1,0,0,0|1,0,1]=4 2011 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])CO 62a_100012355398_200025704644 [0,1,1,0,0,0|1,0,0]=3 2012 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])CO 62a_200025704644_100012355398 [0,1,1,0,0,0|1,0,0]=3 2013 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])OC 62a_100000189012_200025704644 [0,1,1,0,0,0|1,0,0]=3 2014 B14R1.1864 COC(=O)c1ccc(c(c1)S[13CH3])OC 62a_200025704644_100000189012 [0,1,1,0,0,0|1,0,0]=3 2015 B14R1.1864 COC(=O)c1ccc(c(n1)OC)SC 62a_100010189641_200000210301 [0,1,1,0,0,0|2,0,0]=4 2016 B14R1.1864 COC(=O)c1ccc(c(n1)OC)SC 62a_200000210301_100010189641 [0,1,1,0,0,0|2,0,0]=4 2017 B14R1.1864 COC(=O)c1ccc(c(n1)OC)S[13CH3] 62a_100010189641_200025704644 [0,1,1,0,0,0|2,0,0]=4 2018 B14R1.1864 COC(=O)c1ccc(c(n1)OC)S[13CH3] 62a_200025704644_100010189641 [0,1,1,0,0,0|2,0,0]=4 2019 B14R1.1864 COC(=O)c1ccc(c(n1)SC)OC 62a_100010205418_200000210301 [0,1,1,0,0,0|2,0,0]=4 2020 B14R1.1864 COC(=O)c1ccc(c(n1)SC)OC 62a_200000210301_100010205418 [0,1,1,0,0,0|2,0,0]=4 2021 B14R1.1864 COC(=O)c1ccc(c(n1)S[13CH3])OC 62a_100010205418_200025704644 [0,1,1,0,0,0|2,0,0]=4 2022 B14R1.1864 COC(=O)c1ccc(c(n1)S[13CH3])OC 62a_200025704644_100010205418 [0,1,1,0,0,0|2,0,0]=4 2023 B14R1.1864 COC(=O)c1cnc(c(c1)OC)OC 34a_100009867281_200000210301 [0,1,1,0,0,0|2,0,0]=4 2024 B14R1.1864 COC(=O)c1cnc(c(c1)OC)SC 62a_100010136190_200000210301 [0,1,1,0,0,0|2,0,0]=4 2025 B14R1.1864 COC(=O)c1cnc(c(c1)OC)SC 62a_200000210301_100010074909 [0,1,1,0,0,0|2,0,0]=4 2026 B14R1.1864 COC(=O)c1cnc(c(c1)OC)S[13CH3] 62a_100010136190_200025704644 [0,1,1,0,0,0|2,0,0]=4 2027 B14R1.1864 COC(=O)c1cnc(c(c1)OC)S[13CH3] 62a_200025704644_100010074909 [0,1,1,0,0,0|2,0,0]=4 2028 B14R1.1864 COC(=O)c1cnc(c(c1)O[13CH3])OC 34a_100009867281_200025704644 [0,1,1,0,0,0|2,0,0]=4 2029 B14R1.1864 COC(=O)c1cnc(c(c1)SC)OC 62a_100010189640_200000210301 [0,1,1,0,0,0|2,0,0]=4 2030 B14R1.1864 COC(=O)c1cnc(c(c1)SC)OC 62a_200000210301_100010189640 [0,1,1,0,0,0|2,0,0]=4 2031 B14R1.1864 COC(=O)c1cnc(c(c1)S[13CH3])OC 62a_100010189640_200025704644 [0,1,1,0,0,0|2,0,0]=4 2032 B14R1.1864 COC(=O)c1cnc(c(c1)S[13CH3])OC 62a_200025704644_100010189640 [0,1,1,0,0,0|2,0,0]=4 2033 B14R1.2283 C=Cc1cc(c(cc1C)C)C(=O)OC 271570a_100011290941_200012360129 [0,1,1,0,0,0|1,0,1]=4 2034 B14R1.2283 C=Cc1cc(c(cc1C)Cl)C(=O)OC 271570a_100011290941_100014124666 [0,1,1,0,0,0|1,0,1]=4 2035 B14R1.2283 C=Cc1cc(c(cc1C)F)C(=O)OC 271570a_100011290941_100012920548 [0,1,1,0,0,0|1,0,1]=4 2036 B14R1.2283 C=Cc1cc(c(cc1C)N)C(=O)OC 271570a_100011290941_100010892302 [0,1,1,0,0,0|1,0,1]=4 2037 B14R1.2283 C=Cc1cc(c(cc1C)O)C(=O)OC 271570a_100011290941_100010233952 [0,1,1,0,0,0|1,0,1]=4 2038 B14R1.2283 CCC(=O)c1cc(c(cc1Br)C)OC 1458a_100010289115_100000210202 [0,1,1,0,0,0|2,0,0]=4 2039 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 11a_106832991635_100010289115 [0,1,1,0,0,0|2,0,0]=4 2040 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 1626a_100102657272_100010289115 [0,1,1,0,0,0|2,0,0]=4 2041 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 240690a_100102657272_100010289115 [0,1,1,0,0,0|2,0,0]=4 2042 B14R1.2283 CNC(=O)c1cc(c(cc1Br)C)OC 527a_100102657272_100010289115 [0,1,1,0,0,0|2,0,0]=4 2043 B14R1.2283 COC(=O)c1cc(c(cc1C)C)SC 62a_200000210301_200012360129 [0,1,1,0,0,0|1,0,0]=3 2044 B14R1.2283 COC(=O)c1cc(c(cc1C)C)SC 62a_200012360129_200000210301 [0,1,1,0,0,0|1,0,0]=3 2045 B14R1.2283 COC(=O)c1cc(c(cc1C)C)S[13CH3] 62a_200012360129_200025704644 [0,1,1,0,0,0|1,0,0]=3 2046 B14R1.2283 COC(=O)c1cc(c(cc1C)C)S[13CH3] 62a_200025704644_200012360129 [0,1,1,0,0,0|1,0,0]=3 2047 B14R1.2283 COC(=O)c1cc(c(cc1C)F)SC 62a_100013328185_200000210301 [0,1,1,0,0,0|2,0,0]=4 2048 B14R1.2283 COC(=O)c1cc(c(cc1C)F)SC 62a_200000210301_100013328185 [0,1,1,0,0,0|2,0,0]=4 2049 B14R1.2283 COC(=O)c1cc(c(cc1C)F)S[13CH3] 62a_100013328185_200025704644 [0,1,1,0,0,0|2,0,0]=4 2050 B14R1.2283 COC(=O)c1cc(c(cc1C)F)S[13CH3] 62a_200025704644_100013328185 [0,1,1,0,0,0|2,0,0]=4 2051 B14R1.2283 COC(=O)c1cc(c(cc1C)N)SC 62a_100010236254_200000210301 [0,1,1,0,0,0|2,0,0]=4 2052 B14R1.2283 COC(=O)c1cc(c(cc1C)N)SC 62a_200000210301_100010236254 [0,1,1,0,0,0|2,0,0]=4 2053 B14R1.2283 COC(=O)c1cc(c(cc1C)N)S[13CH3] 62a_100010236254_200025704644 [0,1,1,0,0,0|2,0,0]=4 2054 B14R1.2283 COC(=O)c1cc(c(cc1C)N)S[13CH3] 62a_200025704644_100010236254 [0,1,1,0,0,0|2,0,0]=4 2055 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)SC 62a_100014124666_200000210301 [0,1,1,0,0,0|1,0,0]=3 2056 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)SC 62a_200000210301_100014124666 [0,1,1,0,0,0|1,0,0]=3 2057 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)S[13CH3] 62a_100014124666_200025704644 [0,1,1,0,0,0|1,0,0]=3 2058 B14R1.2283 COC(=O)c1cc(c(cc1Cl)C)S[13CH3] 62a_200025704644_100014124666 [0,1,1,0,0,0|1,0,0]=3 2059 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)OC 34a_100010071070_200000210301 [0,1,1,0,0,0|2,0,0]=4 2060 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)OC 7a_100010071070_200000210301 [0,1,1,0,0,0|2,0,0]=4 2061 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)O[13CH3] 34a_100010071070_200025704644 [0,1,1,0,0,0|2,0,0]=4 2062 B14R1.2283 COC(=O)c1cc(c(cc1Cl)F)O[13CH3] 7a_100010071070_200025704644 [0,1,1,0,0,0|2,0,0]=4 2063 B14R1.2283 COC(=O)c1cc(c(cc1Cl)N)SC 62a_100010204190_200000210301 [0,1,1,0,0,0|2,0,0]=4 2064 B14R1.2283 COC(=O)c1cc(c(cc1Cl)N)S[13CH3] 62a_100010204190_200025704644 [0,1,1,0,0,0|2,0,0]=4 2065 B14R1.2283 COC(=O)c1cc(c(cc1F)C)OC 34a_100009839768_200000210301 [0,1,1,0,0,0|1,0,0]=3 2066 B14R1.2283 COC(=O)c1cc(c(cc1F)C)OC 7a_100009839768_200000210301 [0,1,1,0,0,0|1,0,0]=3 2067 B14R1.2283 COC(=O)c1cc(c(cc1F)C)O[13CH3] 34a_100009839768_200025704644 [0,1,1,0,0,0|1,0,0]=3 2068 B14R1.2283 COC(=O)c1cc(c(cc1F)C)O[13CH3] 7a_100009839768_200025704644 [0,1,1,0,0,0|1,0,0]=3 2069 B14R1.2283 COC(=O)c1cc(c(cc1F)C)SC 62a_100012920548_200000210301 [0,1,1,0,0,0|1,0,0]=3 2070 B14R1.2283 COC(=O)c1cc(c(cc1F)C)SC 62a_200000210301_100012920548 [0,1,1,0,0,0|1,0,0]=3 2071 B14R1.2283 COC(=O)c1cc(c(cc1F)C)S[13CH3] 62a_100012920548_200025704644 [0,1,1,0,0,0|1,0,0]=3 2072 B14R1.2283 COC(=O)c1cc(c(cc1F)C)S[13CH3] 62a_200025704644_100012920548 [0,1,1,0,0,0|1,0,0]=3 2073 B14R1.2283 COC(=O)c1cc(c(cc1F)Cl)SC 62a_100012920370_200000210301 [0,1,1,0,0,0|2,0,0]=4 2074 B14R1.2283 COC(=O)c1cc(c(cc1F)Cl)SC 62a_200000210301_100012920370 [0,1,1,0,0,0|2,0,0]=4 2075 B14R1.2283 COC(=O)c1cc(c(cc1F)Cl)S[13CH3] 62a_100012920370_200025704644 [0,1,1,0,0,0|2,0,0]=4 2076 B14R1.2283 COC(=O)c1cc(c(cc1F)Cl)S[13CH3] 62a_200025704644_100012920370 [0,1,1,0,0,0|2,0,0]=4 2077 B14R1.2283 COC(=O)c1cc(c(cc1F)F)SC 62a_100000718433_200000210301 [0,1,1,0,0,0|2,0,0]=4 2078 B14R1.2283 COC(=O)c1cc(c(cc1F)F)SC 62a_200000210301_100000718433 [0,1,1,0,0,0|2,0,0]=4 2079 B14R1.2283 COC(=O)c1cc(c(cc1F)F)S[13CH3] 62a_100000718433_200025704644 [0,1,1,0,0,0|2,0,0]=4 2080 B14R1.2283 COC(=O)c1cc(c(cc1F)F)S[13CH3] 62a_200025704644_100000718433 [0,1,1,0,0,0|2,0,0]=4 2081 B14R1.2283 COC(=O)c1cc(c(cc1F)N)SC 62a_100010764354_200000210301 [0,1,1,0,0,0|2,0,0]=4 2082 B14R1.2283 COC(=O)c1cc(c(cc1F)N)S[13CH3] 62a_100010764354_200025704644 [0,1,1,0,0,0|2,0,0]=4 2083 B14R1.2283 COC(=O)c1cc(c(cc1N)C)SC 62a_100010892302_200000210301 [0,1,1,0,0,0|1,0,0]=3 2084 B14R1.2283 COC(=O)c1cc(c(cc1N)C)SC 62a_200000210301_100010892302 [0,1,1,0,0,0|1,0,0]=3 2085 B14R1.2283 COC(=O)c1cc(c(cc1N)C)S[13CH3] 62a_100010892302_200025704644 [0,1,1,0,0,0|1,0,0]=3 2086 B14R1.2283 COC(=O)c1cc(c(cc1N)C)S[13CH3] 62a_200025704644_100010892302 [0,1,1,0,0,0|1,0,0]=3 2087 B14R1.2283 COC(=O)c1cc(c(cc1N)Cl)SC 62a_100010253894_200000210301 [0,1,1,0,0,0|2,0,0]=4 2088 B14R1.2283 COC(=O)c1cc(c(cc1N)Cl)S[13CH3] 62a_100010253894_200025704644 [0,1,1,0,0,0|2,0,0]=4 2089 B14R1.2283 COC(=O)c1cc(c(cc1N)F)OC 34a_100011586606_200000210301 [0,1,1,0,0,0|2,0,0]=4 2090 B14R1.2283 COC(=O)c1cc(c(cc1N)F)OC 7a_100011586606_200000210301 [0,1,1,0,0,0|2,0,0]=4 2091 B14R1.2283 COC(=O)c1cc(c(cc1N)F)O[13CH3] 34a_100011586606_200025704644 [0,1,1,0,0,0|2,0,0]=4 2092 B14R1.2283 COC(=O)c1cc(c(cc1N)F)O[13CH3] 7a_100011586606_200025704644 [0,1,1,0,0,0|2,0,0]=4 2093 B14R1.2283 COC(=O)c1cc(c(cc1N)F)SC 62a_100000699149_200000210301 [0,1,1,0,0,0|2,0,0]=4 2094 B14R1.2283 COC(=O)c1cc(c(cc1N)F)S[13CH3] 62a_100000699149_200025704644 [0,1,1,0,0,0|2,0,0]=4 2095 B14R1.2283 COC(=O)c1cc(c(cc1N)O)OC 271570a_203496583355_100014686525 [0,1,1,0,0,0|2,0,0]=4 2096 B14R1.2283 COC(=O)c1cc(c(cc1O)C)SC 62a_100010233952_200000210301 [0,1,1,0,0,0|1,0,0]=3 2097 B14R1.2283 COC(=O)c1cc(c(cc1O)C)SC 62a_200000210301_100010233952 [0,1,1,0,0,0|1,0,0]=3 2098 B14R1.2283 COC(=O)c1cc(c(cc1O)C)S[13CH3] 62a_100010233952_200025704644 [0,1,1,0,0,0|1,0,0]=3 2099 B14R1.2283 COC(=O)c1cc(c(cc1O)C)S[13CH3] 62a_200025704644_100010233952 [0,1,1,0,0,0|1,0,0]=3 2100 B14R1.2283 COC(=O)c1cc(c(cc1O)F)OC 271570a_203496583355_100010269054 [0,1,1,0,0,0|2,0,0]=4 2101 B14R1.2283 COC(=O)c1cc(c(cc1O)F)SC 62a_100010371811_200000210301 [0,1,1,0,0,0|2,0,0]=4 2102 B14R1.2283 COC(=O)c1cc(c(cc1O)F)SC 62a_200000210301_100010371811 [0,1,1,0,0,0|2,0,0]=4 2103 B14R1.2283 COC(=O)c1cc(c(cc1O)F)S[13CH3] 62a_100010371811_200025704644 [0,1,1,0,0,0|2,0,0]=4 2104 B14R1.2283 COC(=O)c1cc(c(cc1O)F)S[13CH3] 62a_200025704644_100010371811 [0,1,1,0,0,0|2,0,0]=4 2105 B14R1.2283 COC(=O)c1cc(c(cc1O)N)SC 62a_100010075205_200000210301 [0,1,1,0,0,0|2,0,0]=4 2106 B14R1.2283 COC(=O)c1cc(c(cc1O)N)S[13CH3] 62a_100010075205_200025704644 [0,1,1,0,0,0|2,0,0]=4 2107 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)N[13CH3])C 34a_100000740302_200025704644 [0,1,1,0,0,0|2,0,0]=4 2108 B14R1.3413 CNS(=O)(=O)c1ccc(c(c1)N[13CH3])C 7a_100000740302_200025704644 [0,1,1,0,0,0|2,0,0]=4 2109 B14R1.3413 CNc1cc(ccc1C)S(=O)(=O)NC 34a_100000740302_200000210301 [0,1,1,0,0,0|2,0,0]=4 2110 B14R1.3413 CNc1cc(ccc1C)S(=O)(=O)NC 7a_100000740302_200000210301 [0,1,1,0,0,0|2,0,0]=4 2111 B14R1.4114 C=Cc1c(ccc(c1C)C(=O)OC)C 271570a_100011290941_200010734123 [0,1,1,0,0,0|1,0,1]=4 2112 B14R1.4114 COC(=O)c1ccc(c(c1C)OC)Br 34a_100010889012_200000210301 [0,1,1,0,0,0|2,0,0]=4 2113 B14R1.4114 COC(=O)c1ccc(c(c1C)OC)Br 7a_100010889012_200000210301 [0,1,1,0,0,0|2,0,0]=4 2114 B14R1.4114 COC(=O)c1ccc(c(c1C)O[13CH3])Br 34a_100010889012_200025704644 [0,1,1,0,0,0|2,0,0]=4 2115 B14R1.4114 COC(=O)c1ccc(c(c1C)O[13CH3])Br 7a_100010889012_200025704644 [0,1,1,0,0,0|2,0,0]=4 2116 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)C 62a_200000210301_200010734123 [0,1,1,0,0,0|1,0,0]=3 2117 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)C 62a_200010734123_200000210301 [0,1,1,0,0,0|1,0,0]=3 2118 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)N 62a_100010764323_200000210301 [0,1,1,0,0,0|2,0,0]=4 2119 B14R1.4114 COC(=O)c1ccc(c(c1C)SC)N 62a_200000210301_100010764323 [0,1,1,0,0,0|2,0,0]=4 2120 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])C 62a_200010734123_200025704644 [0,1,1,0,0,0|1,0,0]=3 2121 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])C 62a_200025704644_200010734123 [0,1,1,0,0,0|1,0,0]=3 2122 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])N 62a_100010764323_200025704644 [0,1,1,0,0,0|2,0,0]=4 2123 B14R1.4114 COC(=O)c1ccc(c(c1C)S[13CH3])N 62a_200025704644_100010764323 [0,1,1,0,0,0|2,0,0]=4 2124 B14R1.4114 COC(=O)c1ccc(c(c1Cl)SC)N 62a_200000210301_200016031531 [0,1,1,0,0,0|2,0,0]=4 2125 B14R1.4114 COC(=O)c1ccc(c(c1Cl)SC)N 62a_200016031531_200000210301 [0,1,1,0,0,0|2,0,0]=4 2126 B14R1.4114 COC(=O)c1ccc(c(c1Cl)S[13CH3])N 62a_200016031531_200025704644 [0,1,1,0,0,0|2,0,0]=4 2127 B14R1.4114 COC(=O)c1ccc(c(c1Cl)S[13CH3])N 62a_200025704644_200016031531 [0,1,1,0,0,0|2,0,0]=4 2128 B14R1.4114 COC(=O)c1ccc(c(c1F)OC)Br 34a_100011096176_200000210301 [0,1,1,0,0,0|2,0,0]=4 2129 B14R1.4114 COC(=O)c1ccc(c(c1F)OC)Br 7a_100011096176_200000210301 [0,1,1,0,0,0|2,0,0]=4 2130 B14R1.4114 COC(=O)c1ccc(c(c1F)O[13CH3])Br 34a_100011096176_200025704644 [0,1,1,0,0,0|2,0,0]=4 2131 B14R1.4114 COC(=O)c1ccc(c(c1F)O[13CH3])Br 7a_100011096176_200025704644 [0,1,1,0,0,0|2,0,0]=4 2132 B14R1.4114 COC(=O)c1ccc(c(c1F)SC)F 62a_100000697099_200000210301 [0,1,1,0,0,0|2,0,0]=4 2133 B14R1.4114 COC(=O)c1ccc(c(c1F)SC)F 62a_200000210301_100000697099 [0,1,1,0,0,0|2,0,0]=4 2134 B14R1.4114 COC(=O)c1ccc(c(c1F)S[13CH3])F 62a_100000697099_200025704644 [0,1,1,0,0,0|2,0,0]=4 2135 B14R1.4114 COC(=O)c1ccc(c(c1F)S[13CH3])F 62a_200025704644_100000697099 [0,1,1,0,0,0|2,0,0]=4 2136 B14R1.25 CCCC(=O)c1ccc(cc1)CCC 1458a_100011207308_100000210303 [0,1,1,0,0,0|2,0,0]=4 2137 B14R1.25 CCCC(=O)c1ccc(cc1)CCO 1458a_100000078963_100000210303 [0,1,1,0,0,0|2,0,0]=4 2138 B14R1.25 CCCc1ccc(cc1)C(=O)CCF 1458a_100011207308_100011217306 [0,1,1,0,0,0|2,0,0]=4 2139 B14R1.25 CCCc1ccc(cc1)C(=O)CCO 1458a_100011207308_100000211926 [0,1,1,0,0,0|2,0,0]=4 2140 B14R1.25 CCCc1ccc(cc1)C(=O)CNC 2230a_106832991635_100000183362 [0,1,1,0,0,0|2,0,0]=4 2141 B14R1.25 CCCc1ccc(cc1)C(=O)CNC 7a_106832991635_100000183362 [0,1,1,0,0,0|2,0,0]=4 2142 B14R1.25 CCCc1ccc(cc1)C(=O)CSC 62a_100000183362_200000210301 [0,1,1,0,0,0|1,1,0]=4 2143 B14R1.25 CCCc1ccc(cc1)C(=O)CSC 62a_200000210301_100000183362 [0,1,1,0,0,0|1,1,0]=4 2144 B14R1.25 CCCc1ccc(cc1)C(=O)CS[13CH3] 62a_100000183362_200025704644 [0,1,1,0,0,0|1,1,0]=4 2145 B14R1.25 CCCc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000183362 [0,1,1,0,0,0|1,1,0]=4 2146 B14R1.25 CCCc1ccc(cc1)C(=O)NCC 11a_100015525214_100011207308 [0,1,1,0,0,0|2,0,0]=4 2147 B14R1.25 CCCc1ccc(cc1)C(=O)NCC 240690a_100015525214_100011207308 [0,1,1,0,0,0|2,0,0]=4 2148 B14R1.25 CCCc1ccc(cc1)C(=O)NCC 527a_100015525214_100011207308 [0,1,1,0,0,0|2,0,0]=4 2149 B14R1.25 CCCc1ccc(cc1)C(=O)NNC 22a_100016993582_100011207308 [0,1,1,0,0,0|2,0,0]=4 2150 B14R1.25 CCNC(=O)c1ccc(cc1)CCO 240690a_100015525214_100000078963 [0,1,1,0,0,0|2,0,0]=4 2151 B14R1.25 CCOC(=O)c1ccc(cc1)CNC 2230a_106832991635_100009812261 [0,1,1,0,0,0|2,0,0]=4 2152 B14R1.25 CCOC(=O)c1ccc(cc1)CNC 270004a_106832991635_100000170165 [0,1,1,0,0,0|2,0,0]=4 2153 B14R1.25 CCOC(=O)c1ccc(cc1)CNC 34a_100102657272_100009812261 [0,1,1,0,0,0|2,0,0]=4 2154 B14R1.25 CCOC(=O)c1ccc(cc1)CNC 7a_106832991635_100009812261 [0,1,1,0,0,0|2,0,0]=4 2155 B14R1.25 CCOC(=O)c1ccc(cc1)COC 34a_100138415774_100009812261 [0,1,1,0,0,0|2,0,0]=4 2156 B14R1.25 CCOC(=O)c1ccc(cc1)CSC 62a_100009812261_200000210301 [0,1,1,0,0,0|2,0,0]=4 2157 B14R1.25 CCOC(=O)c1ccc(cc1)CSC 62a_200000210301_100009812261 [0,1,1,0,0,0|2,0,0]=4 2158 B14R1.25 CCOC(=O)c1ccc(cc1)CS[13CH3] 62a_100009812261_200025704644 [0,1,1,0,0,0|2,0,0]=4 2159 B14R1.25 CCOC(=O)c1ccc(cc1)CS[13CH3] 62a_200025704644_100009812261 [0,1,1,0,0,0|2,0,0]=4 2160 B14R1.25 CCOC(=O)c1ccc(cc1)OCC 34a_100000169885_100000210202 [0,1,1,0,0,0|2,0,0]=4 2161 B14R1.25 CCOC(=O)c1ccc(cc1)OCC 7a_100000169885_100000210202 [0,1,1,0,0,0|2,0,0]=4 2162 B14R1.25 CCOC(=O)c1ccc(cc1)OCF 34a_100000169885_100015361967 [0,1,1,0,0,0|2,0,0]=4 2163 B14R1.25 CCOC(=O)c1ccc(cc1)OCF 7a_100000169885_100015361967 [0,1,1,0,0,0|2,0,0]=4 2164 B14R1.25 CCOC(=O)c1ccc(cc1)SCC 62a_100000169895_100000210202 [0,1,1,0,0,0|2,0,0]=4 2165 B14R1.25 CCOC(=O)c1ccc(cc1)SCC 62a_100000210202_100000169919 [0,1,1,0,0,0|2,0,0]=4 2166 B14R1.25 CCOC(=O)c1ccc(cc1)SCF 62a_100000169895_100015361967 [0,1,1,0,0,0|2,0,0]=4 2167 B14R1.25 CCOC(=O)c1ccc(cc1)SCF 62a_100015361967_100000169919 [0,1,1,0,0,0|2,0,0]=4 2168 B14R1.25 CCOc1ccc(cc1)C(=O)COC 34a_200009861119_100000210202 [0,1,1,0,0,0|2,0,0]=4 2169 B14R1.25 CCOc1ccc(cc1)C(=O)COC 7a_200009861119_100000210202 [0,1,1,0,0,0|2,0,0]=4 2170 B14R1.25 CCSc1ccc(cc1)C(=O)COC 62a_200011343064_100000210202 [0,1,1,0,0,0|2,0,0]=4 2171 B14R1.25 CNNC(=O)c1ccc(cc1)CCO 22a_100016993582_100000078963 [0,1,1,0,0,0|2,0,0]=4 2172 B14R1.25 COCC(=O)c1ccc(cc1)OCF 34a_200009861119_100015361967 [0,1,1,0,0,0|2,0,0]=4 2173 B14R1.25 COCC(=O)c1ccc(cc1)OCF 7a_200009861119_100015361967 [0,1,1,0,0,0|2,0,0]=4 2174 B14R1.25 COCC(=O)c1ccc(cc1)SCF 62a_200011343064_100015361967 [0,1,1,0,0,0|2,0,0]=4 2175 B14R1.25 O=C(CCF)c1ccc(cc1)CCO 1458a_100000078963_100011217306 [0,1,1,0,0,0|2,0,0]=4 2176 B14R1.25 O=C(CCO)c1ccc(cc1)CCO 1458a_100000078963_100000211926 [0,1,1,0,0,0|2,0,0]=4 2177 B14R1.65 C#CCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000184674 [0,1,1,0,0,0|1,0,1]=4 2178 B14R1.65 C#CCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000038162 [0,1,1,0,0,0|1,0,1]=4 2179 B14R1.65 C#CCSc1ccc(cc1)C(=O)OC 62a_100000038162_100000150774 [0,1,1,0,0,0|1,0,1]=4 2180 B14R1.65 C=CCOc1ccc(cc1)C(=O)OC 34a_100000150123_100015514636 [0,1,1,0,0,0|1,0,1]=4 2181 B14R1.65 C=CCOc1ccc(cc1)C(=O)OC 7a_100000150123_100015514636 [0,1,1,0,0,0|1,0,1]=4 2182 B14R1.65 C=CCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210623 [0,1,1,0,0,0|1,0,1]=4 2183 B14R1.65 C=CCSc1ccc(cc1)C(=O)OC 62a_100000210623_100000150774 [0,1,1,0,0,0|1,0,1]=4 2184 B14R1.65 CCC(=O)c1ccc(cc1)OCCF 34a_100000212119_100011217306 [0,1,1,0,0,0|2,0,0]=4 2185 B14R1.65 CCC(=O)c1ccc(cc1)OCCF 7a_100000212119_100011217306 [0,1,1,0,0,0|2,0,0]=4 2186 B14R1.65 CCC(=O)c1ccc(cc1)OCCO 1458a_100000217286_100000210202 [0,1,1,0,0,0|2,0,0]=4 2187 B14R1.65 CCC(=O)c1ccc(cc1)OCCO 34a_100000212119_100000211926 [0,1,1,0,0,0|2,0,0]=4 2188 B14R1.65 CCC(=O)c1ccc(cc1)OCCO 7a_100000212119_100000211926 [0,1,1,0,0,0|2,0,0]=4 2189 B14R1.65 CCC(=O)c1ccc(cc1)SCCF 62a_100000211647_100011217306 [0,1,1,0,0,0|2,0,0]=4 2190 B14R1.65 CCC(=O)c1ccc(cc1)SCCF 62a_100011217306_100000211647 [0,1,1,0,0,0|2,0,0]=4 2191 B14R1.65 CCC(=O)c1ccc(cc1)SCCO 1458a_200000182347_100000210202 [0,1,1,0,0,0|2,0,0]=4 2192 B14R1.65 CCC(=O)c1ccc(cc1)SCCO 62a_100000211647_100000211926 [0,1,1,0,0,0|2,0,0]=4 2193 B14R1.65 CCC(=O)c1ccc(cc1)SCCO 62a_100000211926_100000211647 [0,1,1,0,0,0|2,0,0]=4 2194 B14R1.65 CCCCc1ccc(cc1)C(=O)CC 1458a_100000186158_100000210202 [0,1,1,0,0,0|2,0,0]=4 2195 B14R1.65 CCCCc1ccc(cc1)C(=O)CC 271570a_100020621405_100000211647 [0,1,1,0,0,0|2,0,0]=4 2196 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 11a_106832991635_100000186158 [0,1,1,0,0,0|2,0,0]=4 2197 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000186158 [0,1,1,0,0,0|2,0,0]=4 2198 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000186158 [0,1,1,0,0,0|2,0,0]=4 2199 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 271570a_100020621405_100000155074 [0,1,1,0,0,0|2,0,0]=4 2200 B14R1.65 CCCCc1ccc(cc1)C(=O)NC 527a_100102657272_100000186158 [0,1,1,0,0,0|2,0,0]=4 2201 B14R1.65 CCCCc1ccc(cc1)C(=O)OC 271570a_100020621405_100000150774 [0,1,1,0,0,0|1,0,0]=3 2202 B14R1.65 CCCCc1ccc(cn1)C(=O)OC 271570a_100020621405_100000733799 [0,1,1,0,0,0|2,0,0]=4 2203 B14R1.65 CCCCc1ccc(nc1)C(=O)OC 271570a_100020621405_100000690920 [0,1,1,0,0,0|2,0,0]=4 2204 B14R1.65 CCCNc1ccc(cc1)C(=O)NC 2230a_100000184841_100000210303 [0,1,1,0,0,0|2,0,0]=4 2205 B14R1.65 CCCNc1ccc(cc1)C(=O)NC 34a_100000184841_100000210303 [0,1,1,0,0,0|2,0,0]=4 2206 B14R1.65 CCCOc1ccc(cc1)C(=O)CC 1458a_100000182924_100000210202 [0,1,1,0,0,0|2,0,0]=4 2207 B14R1.65 CCCOc1ccc(cc1)C(=O)CC 34a_100000212119_100000210303 [0,1,1,0,0,0|2,0,0]=4 2208 B14R1.65 CCCOc1ccc(cc1)C(=O)CC 7a_100000212119_100000210303 [0,1,1,0,0,0|2,0,0]=4 2209 B14R1.65 CCCOc1ccc(cc1)C(=O)NC 11a_106832991635_100000182924 [0,1,1,0,0,0|2,0,0]=4 2210 B14R1.65 CCCOc1ccc(cc1)C(=O)NC 1626a_100102657272_100000182924 [0,1,1,0,0,0|2,0,0]=4 2211 B14R1.65 CCCOc1ccc(cc1)C(=O)NC 240690a_100102657272_100000182924 [0,1,1,0,0,0|2,0,0]=4 2212 B14R1.65 CCCOc1ccc(cc1)C(=O)NC 34a_100000192141_100000210303 [0,1,1,0,0,0|2,0,0]=4 2213 B14R1.65 CCCOc1ccc(cc1)C(=O)NC 527a_100102657272_100000182924 [0,1,1,0,0,0|2,0,0]=4 2214 B14R1.65 CCCOc1ccc(cc1)C(=O)NC 7a_100000192141_100000210303 [0,1,1,0,0,0|2,0,0]=4 2215 B14R1.65 CCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210303 [0,1,1,0,0,0|1,0,0]=3 2216 B14R1.65 CCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210303 [0,1,1,0,0,0|1,0,0]=3 2217 B14R1.65 CCCOc1ccc(nc1)C(=O)OC 34a_100011997255_100000210303 [0,1,1,0,0,0|2,0,0]=4 2218 B14R1.65 CCCOc1ccc(nc1)C(=O)OC 7a_100011997255_100000210303 [0,1,1,0,0,0|2,0,0]=4 2219 B14R1.65 CCCSc1ccc(cc1)C(=O)CC 62a_100000210303_100000211647 [0,1,1,0,0,0|2,0,0]=4 2220 B14R1.65 CCCSc1ccc(cc1)C(=O)CC 62a_100000211647_100000210303 [0,1,1,0,0,0|2,0,0]=4 2221 B14R1.65 CCCSc1ccc(cc1)C(=O)NC 62a_100000155074_100000210303 [0,1,1,0,0,0|2,0,0]=4 2222 B14R1.65 CCCSc1ccc(cc1)C(=O)NC 62a_100000210303_100000155074 [0,1,1,0,0,0|2,0,0]=4 2223 B14R1.65 CCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210303 [0,1,1,0,0,0|1,0,0]=3 2224 B14R1.65 CCCSc1ccc(cc1)C(=O)OC 62a_100000210303_100000150774 [0,1,1,0,0,0|1,0,0]=3 2225 B14R1.65 CCCSc1ccc(cn1)C(=O)OC 62a_100000210303_100000733799 [0,1,1,0,0,0|2,0,0]=4 2226 B14R1.65 CCCSc1ccc(cn1)C(=O)OC 62a_100000733799_100000210303 [0,1,1,0,0,0|2,0,0]=4 2227 B14R1.65 CCCSc1ccc(nc1)C(=O)OC 62a_100000210303_100102712061 [0,1,1,0,0,0|2,0,0]=4 2228 B14R1.65 CCCSc1ccc(nc1)C(=O)OC 62a_100102712061_100000210303 [0,1,1,0,0,0|2,0,0]=4 2229 B14R1.65 CCNCc1ccc(cc1)C(=O)NC 207a_100015525214_100000043907 [0,1,1,0,0,0|2,0,0]=4 2230 B14R1.65 CCNCc1ccc(cc1)C(=O)NC 2230a_100000743749_100000210202 [0,1,1,0,0,0|2,0,0]=4 2231 B14R1.65 CCNCc1ccc(cc1)C(=O)NC 2230a_100015525214_100000753832 [0,1,1,0,0,0|2,0,0]=4 2232 B14R1.65 CCNCc1ccc(cc1)C(=O)NC 270004a_100015525214_100000043907 [0,1,1,0,0,0|2,0,0]=4 2233 B14R1.65 CCNCc1ccc(cc1)C(=O)NC 34a_100000743749_100000210202 [0,1,1,0,0,0|2,0,0]=4 2234 B14R1.65 CCNCc1ccc(cc1)C(=O)OC 2230a_100015525214_100000735637 [0,1,1,0,0,0|1,0,0]=3 2235 B14R1.65 CCNCc1ccc(cc1)C(=O)OC 270004a_100015525214_100000148700 [0,1,1,0,0,0|1,0,0]=3 2236 B14R1.65 CCNCc1ccc(cn1)C(=O)OC 2230a_100015525214_100000063545 [0,1,1,0,0,0|2,0,0]=4 2237 B14R1.65 CCNCc1ccc(cn1)C(=O)OC 270004a_100015525214_100000762506 [0,1,1,0,0,0|2,0,0]=4 2238 B14R1.65 CCNCc1ccc(nc1)C(=O)OC 2230a_100015525214_100010177729 [0,1,1,0,0,0|2,0,0]=4 2239 B14R1.65 CCNCc1ccc(nc1)C(=O)OC 270004a_100015525214_102516457225 [0,1,1,0,0,0|2,0,0]=4 2240 B14R1.65 CCOCc1ccc(cc1)C(=O)NC 34a_100121572206_100000753832 [0,1,1,0,0,0|2,0,0]=4 2241 B14R1.65 CCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000210202 [0,1,1,0,0,0|1,0,0]=3 2242 B14R1.65 CCOCc1ccc(cc1)C(=O)OC 34a_100121572206_100000735637 [0,1,1,0,0,0|1,0,0]=3 2243 B14R1.65 CCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000210202 [0,1,1,0,0,0|1,0,0]=3 2244 B14R1.65 CCOCc1ccc(cn1)C(=O)OC 34a_100000239634_100000210202 [0,1,1,0,0,0|2,0,0]=4 2245 B14R1.65 CCOCc1ccc(cn1)C(=O)OC 34a_100121572206_100010230174 [0,1,1,0,0,0|2,0,0]=4 2246 B14R1.65 CCOCc1ccc(nc1)C(=O)OC 34a_100009873365_100000210202 [0,1,1,0,0,0|2,0,0]=4 2247 B14R1.65 CCOCc1ccc(nc1)C(=O)OC 34a_100121572206_100010177729 [0,1,1,0,0,0|2,0,0]=4 2248 B14R1.65 CCOCc1ccc(nc1)C(=O)OC 7a_100009873365_100000210202 [0,1,1,0,0,0|2,0,0]=4 2249 B14R1.65 CCSCc1ccc(cc1)C(=O)CC 1458a_100000193729_100000210202 [0,1,1,0,0,0|2,0,0]=4 2250 B14R1.65 CCSCc1ccc(cc1)C(=O)NC 11a_106832991635_100000193729 [0,1,1,0,0,0|2,0,0]=4 2251 B14R1.65 CCSCc1ccc(cc1)C(=O)NC 1626a_100102657272_100000193729 [0,1,1,0,0,0|2,0,0]=4 2252 B14R1.65 CCSCc1ccc(cc1)C(=O)NC 240690a_100102657272_100000193729 [0,1,1,0,0,0|2,0,0]=4 2253 B14R1.65 CCSCc1ccc(cc1)C(=O)NC 527a_100102657272_100000193729 [0,1,1,0,0,0|2,0,0]=4 2254 B14R1.65 CCSCc1ccc(cc1)C(=O)NC 62a_100000210202_100000753832 [0,1,1,0,0,0|2,0,0]=4 2255 B14R1.65 CCSCc1ccc(cc1)C(=O)NC 62a_100000753832_100000210202 [0,1,1,0,0,0|2,0,0]=4 2256 B14R1.65 CCSCc1ccc(cc1)C(=O)OC 62a_100000210202_100000187170 [0,1,1,0,0,0|1,0,0]=3 2257 B14R1.65 CCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210202 [0,1,1,0,0,0|1,0,0]=3 2258 B14R1.65 CCSCc1ccc(cn1)C(=O)OC 62a_100000210202_100010230174 [0,1,1,0,0,0|2,0,0]=4 2259 B14R1.65 CCSCc1ccc(cn1)C(=O)OC 62a_100010230174_100000210202 [0,1,1,0,0,0|2,0,0]=4 2260 B14R1.65 CCSCc1ccc(nc1)C(=O)OC 62a_100000210202_100010177729 [0,1,1,0,0,0|2,0,0]=4 2261 B14R1.65 CCSCc1ccc(nc1)C(=O)OC 62a_100010177729_100000210202 [0,1,1,0,0,0|2,0,0]=4 2262 B14R1.65 CNC(=O)c1ccc(cc1)CNCF 34a_100000743749_100015361967 [0,1,1,0,0,0|2,0,0]=4 2263 B14R1.65 CNC(=O)c1ccc(cc1)CSCF 62a_100000753832_100015361967 [0,1,1,0,0,0|2,0,0]=4 2264 B14R1.65 CNC(=O)c1ccc(cc1)CSCF 62a_100015361967_100000753832 [0,1,1,0,0,0|2,0,0]=4 2265 B14R1.65 CNC(=O)c1ccc(cc1)NCCF 2230a_100000184841_100011217306 [0,1,1,0,0,0|2,0,0]=4 2266 B14R1.65 CNC(=O)c1ccc(cc1)NCCF 34a_100000184841_100011217306 [0,1,1,0,0,0|2,0,0]=4 2267 B14R1.65 CNC(=O)c1ccc(cc1)NCCO 2230a_100000184841_100000211926 [0,1,1,0,0,0|2,0,0]=4 2268 B14R1.65 CNC(=O)c1ccc(cc1)NCCO 27a_100000210304_100000155074 [0,1,1,0,0,0|2,0,0]=4 2269 B14R1.65 CNC(=O)c1ccc(cc1)NCCO 34a_100000184841_100000211926 [0,1,1,0,0,0|2,0,0]=4 2270 B14R1.65 CNC(=O)c1ccc(cc1)OCCF 34a_100000192141_100011217306 [0,1,1,0,0,0|2,0,0]=4 2271 B14R1.65 CNC(=O)c1ccc(cc1)OCCF 7a_100000192141_100011217306 [0,1,1,0,0,0|2,0,0]=4 2272 B14R1.65 CNC(=O)c1ccc(cc1)OCCO 1626a_100102657272_100000217286 [0,1,1,0,0,0|2,0,0]=4 2273 B14R1.65 CNC(=O)c1ccc(cc1)OCCO 240690a_100102657272_100000217286 [0,1,1,0,0,0|2,0,0]=4 2274 B14R1.65 CNC(=O)c1ccc(cc1)OCCO 34a_100000192141_100000211926 [0,1,1,0,0,0|2,0,0]=4 2275 B14R1.65 CNC(=O)c1ccc(cc1)OCCO 7a_100000192141_100000211926 [0,1,1,0,0,0|2,0,0]=4 2276 B14R1.65 CNC(=O)c1ccc(cc1)SCCF 62a_100000155074_100011217306 [0,1,1,0,0,0|2,0,0]=4 2277 B14R1.65 CNC(=O)c1ccc(cc1)SCCF 62a_100011217306_100000155074 [0,1,1,0,0,0|2,0,0]=4 2278 B14R1.65 CNC(=O)c1ccc(cc1)SCCO 1626a_100102657272_200000182347 [0,1,1,0,0,0|2,0,0]=4 2279 B14R1.65 CNC(=O)c1ccc(cc1)SCCO 240690a_100102657272_200000182347 [0,1,1,0,0,0|2,0,0]=4 2280 B14R1.65 CNC(=O)c1ccc(cc1)SCCO 62a_100000155074_100000211926 [0,1,1,0,0,0|2,0,0]=4 2281 B14R1.65 CNC(=O)c1ccc(cc1)SCCO 62a_100000211926_100000155074 [0,1,1,0,0,0|2,0,0]=4 2282 B14R1.65 CNCCc1ccc(cc1)C(=O)OC 2230a_106832991635_100010192280 [0,1,1,0,0,0|0,0,0]=2 2283 B14R1.65 CNCCc1ccc(cc1)C(=O)OC 34a_100102657272_100010192280 [0,1,1,0,0,0|0,0,0]=2 2284 B14R1.65 CNCCc1ccc(cc1)C(=O)OC 7a_106832991635_100010192280 [0,1,1,0,0,0|0,0,0]=2 2285 B14R1.65 COC(=O)c1ccc(cc1)CCO[13CH3] 34a_100010779965_200025704644 [0,1,1,0,0,0|1,0,0]=3 2286 B14R1.65 COC(=O)c1ccc(cc1)CCO[13CH3] 7a_100010779965_200025704644 [0,1,1,0,0,0|1,0,0]=3 2287 B14R1.65 COC(=O)c1ccc(cc1)CCSC 62a_100010192280_200000210301 [0,1,1,0,0,0|1,0,0]=3 2288 B14R1.65 COC(=O)c1ccc(cc1)CCSC 62a_200000210301_100010192280 [0,1,1,0,0,0|1,0,0]=3 2289 B14R1.65 COC(=O)c1ccc(cc1)CCS[13CH3] 62a_100010192280_200025704644 [0,1,1,0,0,0|1,0,0]=3 2290 B14R1.65 COC(=O)c1ccc(cc1)CCS[13CH3] 62a_200025704644_100010192280 [0,1,1,0,0,0|1,0,0]=3 2291 B14R1.65 COC(=O)c1ccc(cc1)COCF 34a_100000151488_100015361967 [0,1,1,0,0,0|1,0,0]=3 2292 B14R1.65 COC(=O)c1ccc(cc1)COCF 7a_100000151488_100015361967 [0,1,1,0,0,0|1,0,0]=3 2293 B14R1.65 COC(=O)c1ccc(cc1)CSCF 62a_100000735637_100015361967 [0,1,1,0,0,0|1,0,0]=3 2294 B14R1.65 COC(=O)c1ccc(cc1)CSCF 62a_100015361967_100000187170 [0,1,1,0,0,0|1,0,0]=3 2295 B14R1.65 COC(=O)c1ccc(cc1)OCC#N 7a_100000150123_100011215382 [0,1,1,0,0,0|0,0,2]=4 2296 B14R1.65 COC(=O)c1ccc(cc1)OCC=O 34a_100000150123_200009817547 [0,1,1,0,0,0|1,0,1]=4 2297 B14R1.65 COC(=O)c1ccc(cc1)OCC=O 7a_100000150123_200015260668 [0,1,1,0,0,0|1,0,1]=4 2298 B14R1.65 COC(=O)c1ccc(cc1)OCCF 34a_100000150123_100011217306 [0,1,1,0,0,0|1,0,0]=3 2299 B14R1.65 COC(=O)c1ccc(cc1)OCCF 7a_100000150123_100011217306 [0,1,1,0,0,0|1,0,0]=3 2300 B14R1.65 COC(=O)c1ccc(cc1)OCCO 34a_100000150123_100000211926 [0,1,1,0,0,0|1,0,0]=3 2301 B14R1.65 COC(=O)c1ccc(cc1)OCCO 7a_100000150123_100000211926 [0,1,1,0,0,0|1,0,0]=3 2302 B14R1.65 COC(=O)c1ccc(cc1)OCSC 34a_100000150123_100011218213 [0,1,1,0,0,0|2,0,0]=4 2303 B14R1.65 COC(=O)c1ccc(cc1)SCC#N 62a_100000150774_100011215382 [0,1,1,0,0,0|0,0,2]=4 2304 B14R1.65 COC(=O)c1ccc(cc1)SCC#N 62a_100011215382_100000150774 [0,1,1,0,0,0|0,0,2]=4 2305 B14R1.65 COC(=O)c1ccc(cc1)SCC=O 62a_100000150774_200015260668 [0,1,1,0,0,0|1,0,1]=4 2306 B14R1.65 COC(=O)c1ccc(cc1)SCC=O 62a_200015260668_100000150774 [0,1,1,0,0,0|1,0,1]=4 2307 B14R1.65 COC(=O)c1ccc(cc1)SCCF 62a_100000150774_100011217306 [0,1,1,0,0,0|1,0,0]=3 2308 B14R1.65 COC(=O)c1ccc(cc1)SCCF 62a_100011217306_100000150774 [0,1,1,0,0,0|1,0,0]=3 2309 B14R1.65 COC(=O)c1ccc(cc1)SCCO 62a_100000150774_100000211926 [0,1,1,0,0,0|1,0,0]=3 2310 B14R1.65 COC(=O)c1ccc(cc1)SCCO 62a_100000211926_100000150774 [0,1,1,0,0,0|1,0,0]=3 2311 B14R1.65 COC(=O)c1ccc(cc1)SCSC 62a_100000150774_100011218213 [0,1,1,0,0,0|2,0,0]=4 2312 B14R1.65 COC(=O)c1ccc(cc1)SCSC 62a_100011218213_100000150774 [0,1,1,0,0,0|2,0,0]=4 2313 B14R1.65 COC(=O)c1ccc(cn1)COCF 34a_100009873365_100015361967 [0,1,1,0,0,0|2,0,0]=4 2314 B14R1.65 COC(=O)c1ccc(cn1)COCF 7a_100009873365_100015361967 [0,1,1,0,0,0|2,0,0]=4 2315 B14R1.65 COC(=O)c1ccc(cn1)CSCF 62a_100010177729_100015361967 [0,1,1,0,0,0|2,0,0]=4 2316 B14R1.65 COC(=O)c1ccc(cn1)CSCF 62a_100015361967_100010177729 [0,1,1,0,0,0|2,0,0]=4 2317 B14R1.65 COC(=O)c1ccc(cn1)OCCF 34a_100011997255_100011217306 [0,1,1,0,0,0|2,0,0]=4 2318 B14R1.65 COC(=O)c1ccc(cn1)OCCF 7a_100011997255_100011217306 [0,1,1,0,0,0|2,0,0]=4 2319 B14R1.65 COC(=O)c1ccc(cn1)OCCO 34a_100011997255_100000211926 [0,1,1,0,0,0|2,0,0]=4 2320 B14R1.65 COC(=O)c1ccc(cn1)OCCO 7a_100011997255_100000211926 [0,1,1,0,0,0|2,0,0]=4 2321 B14R1.65 COC(=O)c1ccc(cn1)SCCF 62a_100011217306_100102712061 [0,1,1,0,0,0|2,0,0]=4 2322 B14R1.65 COC(=O)c1ccc(cn1)SCCF 62a_100102712061_100011217306 [0,1,1,0,0,0|2,0,0]=4 2323 B14R1.65 COC(=O)c1ccc(cn1)SCCO 62a_100000211926_100102712061 [0,1,1,0,0,0|2,0,0]=4 2324 B14R1.65 COC(=O)c1ccc(cn1)SCCO 62a_100102712061_100000211926 [0,1,1,0,0,0|2,0,0]=4 2325 B14R1.65 COC(=O)c1ccc(nc1)COCF 34a_100000239634_100015361967 [0,1,1,0,0,0|2,0,0]=4 2326 B14R1.65 COC(=O)c1ccc(nc1)CSCF 62a_100010230174_100015361967 [0,1,1,0,0,0|2,0,0]=4 2327 B14R1.65 COC(=O)c1ccc(nc1)CSCF 62a_100015361967_100010230174 [0,1,1,0,0,0|2,0,0]=4 2328 B14R1.65 COC(=O)c1ccc(nc1)NCCO 27a_100000210304_100000733799 [0,1,1,0,0,0|2,0,0]=4 2329 B14R1.65 COC(=O)c1ccc(nc1)SCCF 62a_100000733799_100011217306 [0,1,1,0,0,0|2,0,0]=4 2330 B14R1.65 COC(=O)c1ccc(nc1)SCCF 62a_100011217306_100000733799 [0,1,1,0,0,0|2,0,0]=4 2331 B14R1.65 COC(=O)c1ccc(nc1)SCCO 62a_100000211926_100000733799 [0,1,1,0,0,0|2,0,0]=4 2332 B14R1.65 COC(=O)c1ccc(nc1)SCCO 62a_100000733799_100000211926 [0,1,1,0,0,0|2,0,0]=4 2333 B14R1.65 COCCc1ccc(cc1)C(=O)OC 34a_100010779965_200000210301 [0,1,1,0,0,0|1,0,0]=3 2334 B14R1.65 COCCc1ccc(cc1)C(=O)OC 34a_100138415774_100010192280 [0,1,1,0,0,0|1,0,0]=3 2335 B14R1.65 COCCc1ccc(cc1)C(=O)OC 7a_100010779965_200000210301 [0,1,1,0,0,0|1,0,0]=3 2336 B14R1.65 COCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000766300 [0,1,1,0,0,0|2,0,0]=4 2337 B14R1.65 COCSc1ccc(cc1)C(=O)OC 62a_100000766300_100000150774 [0,1,1,0,0,0|2,0,0]=4 2338 B14R1.141 CC(=C(C)c1ccc(cc1)CCN)C 271570a_200000049429_100000755846 [0,1,1,0,0,0|2,0,0]=4 2339 B14R1.141 CC(C)C(=O)c1ccc(cc1)CCO 1458a_100000078963_100000210206 [0,1,1,0,0,0|2,0,0]=4 2340 B14R1.141 CCCc1ccc(cc1)C(=O)C(C)C 1458a_100011207308_100000210206 [0,1,1,0,0,0|2,0,0]=4 2341 B14R1.141 CCCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100011207308 [0,1,1,0,0,0|2,0,0]=4 2342 B14R1.141 CCCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100011207308 [0,1,1,0,0,0|2,0,0]=4 2343 B14R1.141 CCCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100011207308 [0,1,1,0,0,0|2,0,0]=4 2344 B14R1.141 CCCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100011207308 [0,1,1,0,0,0|2,0,0]=4 2345 B14R1.141 CN(C)C(=O)c1ccc(cc1)CCO 1626a_100102631434_100000078963 [0,1,1,0,0,0|2,0,0]=4 2346 B14R1.141 CN(C)C(=O)c1ccc(cc1)CCO 240690a_100102631434_100000078963 [0,1,1,0,0,0|2,0,0]=4 2347 B14R1.487 CCOc1ccc(c(c1)Br)C(=O)OC 34a_100010150825_100000210202 [0,1,1,0,0,0|2,0,0]=4 2348 B14R1.487 CCOc1ccc(c(c1)Br)C(=O)OC 7a_100010150825_100000210202 [0,1,1,0,0,0|2,0,0]=4 2349 B14R1.487 CCOc1ccc(c(c1)C)C(=O)OC 34a_100012000157_100000210202 [0,1,1,0,0,0|2,0,0]=4 2350 B14R1.487 CCOc1ccc(c(c1)C)C(=O)OC 7a_100012000157_100000210202 [0,1,1,0,0,0|2,0,0]=4 2351 B14R1.487 CCOc1ccc(c(c1)Cl)C(=O)OC 34a_100000081488_100000210202 [0,1,1,0,0,0|2,0,0]=4 2352 B14R1.487 CCOc1ccc(c(c1)Cl)C(=O)OC 7a_100000081488_100000210202 [0,1,1,0,0,0|2,0,0]=4 2353 B14R1.487 CCOc1ccc(c(c1)F)C(=O)OC 34a_100011999631_100000210202 [0,1,1,0,0,0|2,0,0]=4 2354 B14R1.487 CCOc1ccc(c(c1)F)C(=O)OC 7a_100011999631_100000210202 [0,1,1,0,0,0|2,0,0]=4 2355 B14R1.487 CCOc1ccc(c(c1)N)C(=O)OC 34a_100000701581_100000210202 [0,1,1,0,0,0|2,0,0]=4 2356 B14R1.487 CCOc1ccc(c(c1)N)C(=O)OC 7a_100000701581_100000210202 [0,1,1,0,0,0|2,0,0]=4 2357 B14R1.487 CCSc1ccc(c(c1)Br)C(=O)OC 62a_100000210202_100010247156 [0,1,1,0,0,0|2,0,0]=4 2358 B14R1.487 CCSc1ccc(c(c1)Br)C(=O)OC 62a_100010247156_100000210202 [0,1,1,0,0,0|2,0,0]=4 2359 B14R1.487 CCSc1ccc(c(c1)C)C(=O)OC 62a_100000210202_100000747612 [0,1,1,0,0,0|2,0,0]=4 2360 B14R1.487 CCSc1ccc(c(c1)C)C(=O)OC 62a_100000747612_100000210202 [0,1,1,0,0,0|2,0,0]=4 2361 B14R1.487 CCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000060724_100000210202 [0,1,1,0,0,0|2,0,0]=4 2362 B14R1.487 CCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000210202_100000060724 [0,1,1,0,0,0|2,0,0]=4 2363 B14R1.487 CCSc1ccc(c(c1)F)C(=O)OC 62a_100000210202_100000216654 [0,1,1,0,0,0|2,0,0]=4 2364 B14R1.487 CCSc1ccc(c(c1)F)C(=O)OC 62a_100000216654_100000210202 [0,1,1,0,0,0|2,0,0]=4 2365 B14R1.487 CCSc1ccc(c(c1)N)C(=O)OC 62a_100011373473_100000210202 [0,1,1,0,0,0|2,0,0]=4 2366 B14R1.487 CCSc1ccc(c(c1)O)C(=O)OC 62a_100000210202_100000062286 [0,1,1,0,0,0|2,0,0]=4 2367 B14R1.487 CNCc1ccc(c(c1)Br)C(=O)OC 2230a_106832991635_100012340598 [0,1,1,0,0,0|2,0,0]=4 2368 B14R1.487 CNCc1ccc(c(c1)Br)C(=O)OC 26a_100102657272_100010150825 [0,1,1,0,0,0|2,0,0]=4 2369 B14R1.487 CNCc1ccc(c(c1)Br)C(=O)OC 34a_100102657272_100012340598 [0,1,1,0,0,0|2,0,0]=4 2370 B14R1.487 CNCc1ccc(c(c1)Br)C(=O)OC 7a_106832991635_100012340598 [0,1,1,0,0,0|2,0,0]=4 2371 B14R1.487 CNCc1ccc(c(c1)C)C(=O)OC 2230a_106832991635_100010991300 [0,1,1,0,0,0|2,0,0]=4 2372 B14R1.487 CNCc1ccc(c(c1)C)C(=O)OC 270004a_106832991635_100010370968 [0,1,1,0,0,0|2,0,0]=4 2373 B14R1.487 CNCc1ccc(c(c1)C)C(=O)OC 34a_100102657272_100010991300 [0,1,1,0,0,0|2,0,0]=4 2374 B14R1.487 CNCc1ccc(c(c1)C)C(=O)OC 7a_106832991635_100010991300 [0,1,1,0,0,0|2,0,0]=4 2375 B14R1.487 CNCc1ccc(c(c1)Cl)C(=O)OC 2230a_106832991635_100010128985 [0,1,1,0,0,0|2,0,0]=4 2376 B14R1.487 CNCc1ccc(c(c1)Cl)C(=O)OC 270004a_106832991635_100010630601 [0,1,1,0,0,0|2,0,0]=4 2377 B14R1.487 CNCc1ccc(c(c1)Cl)C(=O)OC 34a_100102657272_100010128985 [0,1,1,0,0,0|2,0,0]=4 2378 B14R1.487 CNCc1ccc(c(c1)Cl)C(=O)OC 7a_106832991635_100010128985 [0,1,1,0,0,0|2,0,0]=4 2379 B14R1.487 CNCc1ccc(c(c1)F)C(=O)OC 2230a_106832991635_100000686969 [0,1,1,0,0,0|2,0,0]=4 2380 B14R1.487 CNCc1ccc(c(c1)F)C(=O)OC 270004a_106832991635_100012457946 [0,1,1,0,0,0|2,0,0]=4 2381 B14R1.487 CNCc1ccc(c(c1)F)C(=O)OC 34a_100102657272_100000686969 [0,1,1,0,0,0|2,0,0]=4 2382 B14R1.487 CNCc1ccc(c(c1)F)C(=O)OC 7a_106832991635_100000686969 [0,1,1,0,0,0|2,0,0]=4 2383 B14R1.487 COC(=O)c1ccc(cc1Br)CSC 62a_100012340598_200000210301 [0,1,1,0,0,0|2,0,0]=4 2384 B14R1.487 COC(=O)c1ccc(cc1Br)CSC 62a_200000210301_100012340598 [0,1,1,0,0,0|2,0,0]=4 2385 B14R1.487 COC(=O)c1ccc(cc1Br)CS[13CH3] 62a_100012340598_200025704644 [0,1,1,0,0,0|2,0,0]=4 2386 B14R1.487 COC(=O)c1ccc(cc1Br)CS[13CH3] 62a_200025704644_100012340598 [0,1,1,0,0,0|2,0,0]=4 2387 B14R1.487 COC(=O)c1ccc(cc1Br)OCF 34a_100010150825_100015361967 [0,1,1,0,0,0|2,0,0]=4 2388 B14R1.487 COC(=O)c1ccc(cc1Br)OCF 7a_100010150825_100015361967 [0,1,1,0,0,0|2,0,0]=4 2389 B14R1.487 COC(=O)c1ccc(cc1Br)SCF 62a_100010247156_100015361967 [0,1,1,0,0,0|2,0,0]=4 2390 B14R1.487 COC(=O)c1ccc(cc1Br)SCF 62a_100015361967_100010247156 [0,1,1,0,0,0|2,0,0]=4 2391 B14R1.487 COC(=O)c1ccc(cc1C)CSC 62a_100010991300_200000210301 [0,1,1,0,0,0|2,0,0]=4 2392 B14R1.487 COC(=O)c1ccc(cc1C)CSC 62a_200000210301_100010991300 [0,1,1,0,0,0|2,0,0]=4 2393 B14R1.487 COC(=O)c1ccc(cc1C)CS[13CH3] 62a_100010991300_200025704644 [0,1,1,0,0,0|2,0,0]=4 2394 B14R1.487 COC(=O)c1ccc(cc1C)CS[13CH3] 62a_200025704644_100010991300 [0,1,1,0,0,0|2,0,0]=4 2395 B14R1.487 COC(=O)c1ccc(cc1C)OCF 34a_100012000157_100015361967 [0,1,1,0,0,0|2,0,0]=4 2396 B14R1.487 COC(=O)c1ccc(cc1C)OCF 7a_100012000157_100015361967 [0,1,1,0,0,0|2,0,0]=4 2397 B14R1.487 COC(=O)c1ccc(cc1C)SCF 62a_100000747612_100015361967 [0,1,1,0,0,0|2,0,0]=4 2398 B14R1.487 COC(=O)c1ccc(cc1C)SCF 62a_100015361967_100000747612 [0,1,1,0,0,0|2,0,0]=4 2399 B14R1.487 COC(=O)c1ccc(cc1Cl)CSC 62a_100010128985_200000210301 [0,1,1,0,0,0|2,0,0]=4 2400 B14R1.487 COC(=O)c1ccc(cc1Cl)CSC 62a_200000210301_100010128985 [0,1,1,0,0,0|2,0,0]=4 2401 B14R1.487 COC(=O)c1ccc(cc1Cl)CS[13CH3] 62a_100010128985_200025704644 [0,1,1,0,0,0|2,0,0]=4 2402 B14R1.487 COC(=O)c1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100010128985 [0,1,1,0,0,0|2,0,0]=4 2403 B14R1.487 COC(=O)c1ccc(cc1Cl)OCF 34a_100000081488_100015361967 [0,1,1,0,0,0|2,0,0]=4 2404 B14R1.487 COC(=O)c1ccc(cc1Cl)OCF 7a_100000081488_100015361967 [0,1,1,0,0,0|2,0,0]=4 2405 B14R1.487 COC(=O)c1ccc(cc1Cl)SCF 62a_100000060724_100015361967 [0,1,1,0,0,0|2,0,0]=4 2406 B14R1.487 COC(=O)c1ccc(cc1Cl)SCF 62a_100015361967_100000060724 [0,1,1,0,0,0|2,0,0]=4 2407 B14R1.487 COC(=O)c1ccc(cc1F)CO[13CH3] 34a_100012183857_200025704644 [0,1,1,0,0,0|2,0,0]=4 2408 B14R1.487 COC(=O)c1ccc(cc1F)CO[13CH3] 7a_100012183857_200025704644 [0,1,1,0,0,0|2,0,0]=4 2409 B14R1.487 COC(=O)c1ccc(cc1F)CSC 62a_100000686969_200000210301 [0,1,1,0,0,0|2,0,0]=4 2410 B14R1.487 COC(=O)c1ccc(cc1F)CSC 62a_200000210301_100000686969 [0,1,1,0,0,0|2,0,0]=4 2411 B14R1.487 COC(=O)c1ccc(cc1F)CS[13CH3] 62a_100000686969_200025704644 [0,1,1,0,0,0|2,0,0]=4 2412 B14R1.487 COC(=O)c1ccc(cc1F)CS[13CH3] 62a_200025704644_100000686969 [0,1,1,0,0,0|2,0,0]=4 2413 B14R1.487 COC(=O)c1ccc(cc1F)OCF 34a_100011999631_100015361967 [0,1,1,0,0,0|2,0,0]=4 2414 B14R1.487 COC(=O)c1ccc(cc1F)OCF 7a_100011999631_100015361967 [0,1,1,0,0,0|2,0,0]=4 2415 B14R1.487 COC(=O)c1ccc(cc1F)SCF 62a_100000216654_100015361967 [0,1,1,0,0,0|2,0,0]=4 2416 B14R1.487 COC(=O)c1ccc(cc1F)SCF 62a_100015361967_100000216654 [0,1,1,0,0,0|2,0,0]=4 2417 B14R1.487 COC(=O)c1ccc(cc1N)OCF 34a_100000701581_100015361967 [0,1,1,0,0,0|2,0,0]=4 2418 B14R1.487 COC(=O)c1ccc(cc1N)OCF 7a_100000701581_100015361967 [0,1,1,0,0,0|2,0,0]=4 2419 B14R1.487 COC(=O)c1ccc(cc1N)SCF 62a_100011373473_100015361967 [0,1,1,0,0,0|2,0,0]=4 2420 B14R1.487 COC(=O)c1ccc(cc1O)SCF 62a_100015361967_100000062286 [0,1,1,0,0,0|2,0,0]=4 2421 B14R1.487 COCc1ccc(c(c1)Br)C(=O)OC 34a_100138415774_100012340598 [0,1,1,0,0,0|2,0,0]=4 2422 B14R1.487 COCc1ccc(c(c1)C)C(=O)OC 34a_100138415774_100010991300 [0,1,1,0,0,0|2,0,0]=4 2423 B14R1.487 COCc1ccc(c(c1)Cl)C(=O)OC 34a_100138415774_100010128985 [0,1,1,0,0,0|2,0,0]=4 2424 B14R1.487 COCc1ccc(c(c1)F)C(=O)OC 34a_100012183857_200000210301 [0,1,1,0,0,0|2,0,0]=4 2425 B14R1.487 COCc1ccc(c(c1)F)C(=O)OC 34a_100138415774_100000686969 [0,1,1,0,0,0|2,0,0]=4 2426 B14R1.487 COCc1ccc(c(c1)F)C(=O)OC 7a_100012183857_200000210301 [0,1,1,0,0,0|2,0,0]=4 2427 B14R1.717 CCC(=O)c1ccc(cc1)CC(C)C 1458a_100000185289_100000210202 [0,1,1,0,0,0|2,0,0]=4 2428 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 11a_106832991635_100000185289 [0,1,1,0,0,0|2,0,0]=4 2429 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 1626a_100102657272_100000185289 [0,1,1,0,0,0|2,0,0]=4 2430 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 240690a_100102657272_100000185289 [0,1,1,0,0,0|2,0,0]=4 2431 B14R1.717 CNC(=O)c1ccc(cc1)CC(C)C 527a_100102657272_100000185289 [0,1,1,0,0,0|2,0,0]=4 2432 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100000070787_100000735637 [0,1,1,0,0,0|1,0,1]=4 2433 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)C 1458a_100012277402_200000210301 [0,1,1,0,0,0|1,0,1]=4 2434 B14R1.717 COC(=O)c1ccc(cc1)CC(=O)[13CH3] 1458a_100012277402_200025704644 [0,1,1,0,0,0|1,0,1]=4 2435 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 2230a_100000737656_200000210301 [0,1,1,0,0,0|2,0,0]=4 2436 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 2230a_100102631434_100000735637 [0,1,1,0,0,0|2,0,0]=4 2437 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 269982a_100000737656_200000210301 [0,1,1,0,0,0|2,0,0]=4 2438 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 269982a_100102631434_100000735637 [0,1,1,0,0,0|2,0,0]=4 2439 B14R1.717 COC(=O)c1ccc(cc1)CN(C)C 270004a_100102631434_100000148700 [0,1,1,0,0,0|2,0,0]=4 2440 B14R1.717 COC(=O)c1ccc(cc1)CN(C)[13CH3] 2230a_100000737656_200025704644 [0,1,1,0,0,0|2,0,0]=4 2441 B14R1.717 COC(=O)c1ccc(cc1)CN(C)[13CH3] 269982a_100000737656_200025704644 [0,1,1,0,0,0|2,0,0]=4 2442 B14R1.717 COC(=O)c1ccc(cc1)OC(C)C 34a_100000150123_100000210206 [0,1,1,0,0,0|2,0,0]=4 2443 B14R1.717 COC(=O)c1ccc(cc1)OC(C)C 7a_100000150123_100000210206 [0,1,1,0,0,0|2,0,0]=4 2444 B14R1.717 COC(=O)c1ccc(cc1)SC(C)C 62a_100000150774_100000210206 [0,1,1,0,0,0|2,0,0]=4 2445 B14R1.717 COC(=O)c1ccc(cc1)SC(C)C 62a_100000210206_100000150774 [0,1,1,0,0,0|2,0,0]=4 2446 B14R1.718 CCC(=O)c1ccc(cc1)C(=O)OC 1458a_100000211811_100000210202 [0,1,1,0,0,0|1,0,1]=4 2447 B14R1.718 CCN(C)c1ccc(cc1)C(=O)OC 2230a_100000220287_100000210202 [0,1,1,0,0,0|2,0,0]=4 2448 B14R1.718 CCN(C)c1ccc(cc1)C(=O)OC 269982a_100000220287_100000204670 [0,1,1,0,0,0|2,0,0]=4 2449 B14R1.718 CCN(C)c1ccc(cc1)C(=O)OC 34a_100000220287_100000210202 [0,1,1,0,0,0|2,0,0]=4 2450 B14R1.718 CNC(C)c1ccc(cc1)C(=O)OC 2230a_106832991635_100010159609 [0,1,1,0,0,0|2,0,0]=4 2451 B14R1.718 CNC(C)c1ccc(cc1)C(=O)OC 7a_106832991635_100010159609 [0,1,1,0,0,0|2,0,0]=4 2452 B14R1.718 COC(=O)c1ccc(cc1)C(=O)CF 1458a_100000211811_100015361967 [0,1,1,0,0,0|1,0,1]=4 2453 B14R1.718 COC(=O)c1ccc(cc1)C(C)OC 34a_100000036437_200000210301 [0,1,1,0,0,0|2,0,0]=4 2454 B14R1.718 COC(=O)c1ccc(cc1)C(C)OC 7a_100000036437_200000210301 [0,1,1,0,0,0|2,0,0]=4 2455 B14R1.718 COC(=O)c1ccc(cc1)C(C)O[13CH3] 34a_100000036437_200025704644 [0,1,1,0,0,0|2,0,0]=4 2456 B14R1.718 COC(=O)c1ccc(cc1)C(C)O[13CH3] 7a_100000036437_200025704644 [0,1,1,0,0,0|2,0,0]=4 2457 B14R1.718 COC(=O)c1ccc(cc1)C(C)SC 62a_100010159609_200000210301 [0,1,1,0,0,0|2,0,0]=4 2458 B14R1.718 COC(=O)c1ccc(cc1)C(C)SC 62a_200000210301_100010159609 [0,1,1,0,0,0|2,0,0]=4 2459 B14R1.718 COC(=O)c1ccc(cc1)C(C)S[13CH3] 62a_100010159609_200025704644 [0,1,1,0,0,0|2,0,0]=4 2460 B14R1.718 COC(=O)c1ccc(cc1)C(C)S[13CH3] 62a_200025704644_100010159609 [0,1,1,0,0,0|2,0,0]=4 2461 B14R1.718 COC(=O)c1ccc(cc1)N(C)CF 269982a_100000220287_100015361967 [0,1,1,0,0,0|2,0,0]=4 2462 B14R1.718 COC(=O)c1ccc(cc1)N(C)CF 34a_100000220287_100015361967 [0,1,1,0,0,0|2,0,0]=4 2463 B14R1.3125 CNS(=O)(=O)c1ccc(cc1)CCN 40a_100102657272_100000014313 [0,1,1,0,0,0|2,0,0]=4 2464 B14R1.6720 CCCc1ccc(cc1Br)C(=O)CC 1458a_200010235943_100000210202 [0,1,1,0,0,0|2,0,0]=4 2465 B14R1.6720 CCCc1ccc(cc1Br)C(=O)NC 11a_106832991635_200010235943 [0,1,1,0,0,0|2,0,0]=4 2466 B14R1.6720 CCCc1ccc(cc1Br)C(=O)NC 1626a_100102657272_200010235943 [0,1,1,0,0,0|2,0,0]=4 2467 B14R1.6720 CCCc1ccc(cc1Br)C(=O)NC 240690a_100102657272_200010235943 [0,1,1,0,0,0|2,0,0]=4 2468 B14R1.6720 CCCc1ccc(cc1Br)C(=O)NC 527a_100102657272_200010235943 [0,1,1,0,0,0|2,0,0]=4 2469 B14R1.6720 CCOc1ccc(cc1Br)C(=O)OC 34a_100000216328_100000210202 [0,1,1,0,0,0|2,0,0]=4 2470 B14R1.6720 CCOc1ccc(cc1Br)C(=O)OC 7a_100000216328_100000210202 [0,1,1,0,0,0|2,0,0]=4 2471 B14R1.6720 CCOc1ccc(cc1C)C(=O)OC 34a_100011997373_100000210202 [0,1,1,0,0,0|2,0,0]=4 2472 B14R1.6720 CCOc1ccc(cc1C)C(=O)OC 7a_100011997373_100000210202 [0,1,1,0,0,0|2,0,0]=4 2473 B14R1.6720 CCOc1ccc(cc1Cl)C(=O)OC 34a_100000151454_100000210202 [0,1,1,0,0,0|2,0,0]=4 2474 B14R1.6720 CCOc1ccc(cc1Cl)C(=O)OC 7a_100000151454_100000210202 [0,1,1,0,0,0|2,0,0]=4 2475 B14R1.6720 CCOc1ccc(cc1F)C(=O)OC 34a_100000075456_100000210202 [0,1,1,0,0,0|2,0,0]=4 2476 B14R1.6720 CCOc1ccc(cc1F)C(=O)OC 7a_100000075456_100000210202 [0,1,1,0,0,0|2,0,0]=4 2477 B14R1.6720 CCOc1ccc(cc1I)C(=O)OC 34a_100010162523_100000210202 [0,1,1,0,0,0|2,0,0]=4 2478 B14R1.6720 CCOc1ccc(cc1I)C(=O)OC 7a_100010162523_100000210202 [0,1,1,0,0,0|2,0,0]=4 2479 B14R1.6720 CCOc1ccc(cc1N)C(=O)OC 34a_100000724433_100000210202 [0,1,1,0,0,0|2,0,0]=4 2480 B14R1.6720 CCOc1ccc(cc1N)C(=O)OC 7a_100000724433_100000210202 [0,1,1,0,0,0|2,0,0]=4 2481 B14R1.6720 CCSc1ccc(cc1Br)C(=O)OC 62a_100000210202_100011294788 [0,1,1,0,0,0|2,0,0]=4 2482 B14R1.6720 CCSc1ccc(cc1Br)C(=O)OC 62a_100011294788_100000210202 [0,1,1,0,0,0|2,0,0]=4 2483 B14R1.6720 CCSc1ccc(cc1C)C(=O)OC 62a_100000210202_100011215878 [0,1,1,0,0,0|2,0,0]=4 2484 B14R1.6720 CCSc1ccc(cc1C)C(=O)OC 62a_100011215878_100000210202 [0,1,1,0,0,0|2,0,0]=4 2485 B14R1.6720 CCSc1ccc(cc1Cl)C(=O)OC 62a_100000210202_100012356344 [0,1,1,0,0,0|2,0,0]=4 2486 B14R1.6720 CCSc1ccc(cc1Cl)C(=O)OC 62a_100012356344_100000210202 [0,1,1,0,0,0|2,0,0]=4 2487 B14R1.6720 CCSc1ccc(cc1F)C(=O)OC 62a_100000210202_100000703229 [0,1,1,0,0,0|2,0,0]=4 2488 B14R1.6720 CCSc1ccc(cc1F)C(=O)OC 62a_100000703229_100000210202 [0,1,1,0,0,0|2,0,0]=4 2489 B14R1.6720 CCSc1ccc(cc1N)C(=O)OC 62a_100000210202_100011450966 [0,1,1,0,0,0|2,0,0]=4 2490 B14R1.6720 CCSc1ccc(cc1N)C(=O)OC 62a_100011450966_100000210202 [0,1,1,0,0,0|2,0,0]=4 2491 B14R1.6720 CCSc1ccc(cc1O)C(=O)OC 62a_100000210202_100012350776 [0,1,1,0,0,0|2,0,0]=4 2492 B14R1.6720 CCSc1ccc(cc1O)C(=O)OC 62a_100012350776_100000210202 [0,1,1,0,0,0|2,0,0]=4 2493 B14R1.6720 CNCc1ccc(cc1Br)C(=O)OC 2230a_106832991635_100010201862 [0,1,1,0,0,0|2,0,0]=4 2494 B14R1.6720 CNCc1ccc(cc1Br)C(=O)OC 26a_100102657272_100000216328 [0,1,1,0,0,0|2,0,0]=4 2495 B14R1.6720 CNCc1ccc(cc1Br)C(=O)OC 270004a_106832991635_100000727569 [0,1,1,0,0,0|2,0,0]=4 2496 B14R1.6720 CNCc1ccc(cc1Br)C(=O)OC 34a_100102657272_100010201862 [0,1,1,0,0,0|2,0,0]=4 2497 B14R1.6720 CNCc1ccc(cc1Br)C(=O)OC 7a_106832991635_100010201862 [0,1,1,0,0,0|2,0,0]=4 2498 B14R1.6720 CNCc1ccc(cc1C)C(=O)OC 270004a_106832991635_100010289884 [0,1,1,0,0,0|2,0,0]=4 2499 B14R1.6720 CNCc1ccc(cc1Cl)C(=O)OC 2230a_106832991635_100012194053 [0,1,1,0,0,0|2,0,0]=4 2500 B14R1.6720 CNCc1ccc(cc1Cl)C(=O)OC 26a_100102657272_100000151454 [0,1,1,0,0,0|2,0,0]=4 2501 B14R1.6720 CNCc1ccc(cc1Cl)C(=O)OC 270004a_106832991635_100012179231 [0,1,1,0,0,0|2,0,0]=4 2502 B14R1.6720 CNCc1ccc(cc1Cl)C(=O)OC 34a_100102657272_100012194053 [0,1,1,0,0,0|2,0,0]=4 2503 B14R1.6720 CNCc1ccc(cc1Cl)C(=O)OC 7a_106832991635_100012194053 [0,1,1,0,0,0|2,0,0]=4 2504 B14R1.6720 CNCc1ccc(cc1F)C(=O)OC 2230a_106832991635_100000694138 [0,1,1,0,0,0|2,0,0]=4 2505 B14R1.6720 CNCc1ccc(cc1F)C(=O)OC 26a_100102657272_100000075456 [0,1,1,0,0,0|2,0,0]=4 2506 B14R1.6720 CNCc1ccc(cc1F)C(=O)OC 270004a_106832991635_100012178685 [0,1,1,0,0,0|2,0,0]=4 2507 B14R1.6720 CNCc1ccc(cc1F)C(=O)OC 34a_100102657272_100000694138 [0,1,1,0,0,0|2,0,0]=4 2508 B14R1.6720 CNCc1ccc(cc1F)C(=O)OC 7a_106832991635_100000694138 [0,1,1,0,0,0|2,0,0]=4 2509 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CO[13CH3] 34a_100012355398_200025704644 [0,1,1,0,0,0|2,0,0]=4 2510 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CO[13CH3] 7a_100012355398_200025704644 [0,1,1,0,0,0|2,0,0]=4 2511 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CSC 62a_100010201862_200000210301 [0,1,1,0,0,0|2,0,0]=4 2512 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CSC 62a_200000210301_100010201862 [0,1,1,0,0,0|2,0,0]=4 2513 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CS[13CH3] 62a_100010201862_200025704644 [0,1,1,0,0,0|2,0,0]=4 2514 B14R1.6720 COC(=O)c1ccc(c(c1)Br)CS[13CH3] 62a_200025704644_100010201862 [0,1,1,0,0,0|2,0,0]=4 2515 B14R1.6720 COC(=O)c1ccc(c(c1)Br)OCF 34a_100000216328_100015361967 [0,1,1,0,0,0|2,0,0]=4 2516 B14R1.6720 COC(=O)c1ccc(c(c1)Br)OCF 7a_100000216328_100015361967 [0,1,1,0,0,0|2,0,0]=4 2517 B14R1.6720 COC(=O)c1ccc(c(c1)Br)SCF 62a_100011294788_100015361967 [0,1,1,0,0,0|2,0,0]=4 2518 B14R1.6720 COC(=O)c1ccc(c(c1)Br)SCF 62a_100015361967_100011294788 [0,1,1,0,0,0|2,0,0]=4 2519 B14R1.6720 COC(=O)c1ccc(c(c1)C)OCF 34a_100011997373_100015361967 [0,1,1,0,0,0|2,0,0]=4 2520 B14R1.6720 COC(=O)c1ccc(c(c1)C)OCF 7a_100011997373_100015361967 [0,1,1,0,0,0|2,0,0]=4 2521 B14R1.6720 COC(=O)c1ccc(c(c1)C)SCF 62a_100011215878_100015361967 [0,1,1,0,0,0|2,0,0]=4 2522 B14R1.6720 COC(=O)c1ccc(c(c1)C)SCF 62a_100015361967_100011215878 [0,1,1,0,0,0|2,0,0]=4 2523 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)CSC 62a_100012194053_200000210301 [0,1,1,0,0,0|2,0,0]=4 2524 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)CSC 62a_200000210301_100012194053 [0,1,1,0,0,0|2,0,0]=4 2525 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)CS[13CH3] 62a_100012194053_200025704644 [0,1,1,0,0,0|2,0,0]=4 2526 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)CS[13CH3] 62a_200025704644_100012194053 [0,1,1,0,0,0|2,0,0]=4 2527 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)OCF 34a_100000151454_100015361967 [0,1,1,0,0,0|2,0,0]=4 2528 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)OCF 7a_100000151454_100015361967 [0,1,1,0,0,0|2,0,0]=4 2529 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)SCF 62a_100012356344_100015361967 [0,1,1,0,0,0|2,0,0]=4 2530 B14R1.6720 COC(=O)c1ccc(c(c1)Cl)SCF 62a_100015361967_100012356344 [0,1,1,0,0,0|2,0,0]=4 2531 B14R1.6720 COC(=O)c1ccc(c(c1)F)CO[13CH3] 34a_100000094453_200025704644 [0,1,1,0,0,0|2,0,0]=4 2532 B14R1.6720 COC(=O)c1ccc(c(c1)F)CO[13CH3] 7a_100000094453_200025704644 [0,1,1,0,0,0|2,0,0]=4 2533 B14R1.6720 COC(=O)c1ccc(c(c1)F)CSC 62a_100000694138_200000210301 [0,1,1,0,0,0|2,0,0]=4 2534 B14R1.6720 COC(=O)c1ccc(c(c1)F)CSC 62a_200000210301_100000694138 [0,1,1,0,0,0|2,0,0]=4 2535 B14R1.6720 COC(=O)c1ccc(c(c1)F)CS[13CH3] 62a_100000694138_200025704644 [0,1,1,0,0,0|2,0,0]=4 2536 B14R1.6720 COC(=O)c1ccc(c(c1)F)CS[13CH3] 62a_200025704644_100000694138 [0,1,1,0,0,0|2,0,0]=4 2537 B14R1.6720 COC(=O)c1ccc(c(c1)F)OCF 34a_100000075456_100015361967 [0,1,1,0,0,0|2,0,0]=4 2538 B14R1.6720 COC(=O)c1ccc(c(c1)F)OCF 7a_100000075456_100015361967 [0,1,1,0,0,0|2,0,0]=4 2539 B14R1.6720 COC(=O)c1ccc(c(c1)F)SCF 62a_100000703229_100015361967 [0,1,1,0,0,0|2,0,0]=4 2540 B14R1.6720 COC(=O)c1ccc(c(c1)F)SCF 62a_100015361967_100000703229 [0,1,1,0,0,0|2,0,0]=4 2541 B14R1.6720 COC(=O)c1ccc(c(c1)I)OCF 34a_100010162523_100015361967 [0,1,1,0,0,0|2,0,0]=4 2542 B14R1.6720 COC(=O)c1ccc(c(c1)I)OCF 7a_100010162523_100015361967 [0,1,1,0,0,0|2,0,0]=4 2543 B14R1.6720 COC(=O)c1ccc(c(c1)N)OCF 34a_100000724433_100015361967 [0,1,1,0,0,0|2,0,0]=4 2544 B14R1.6720 COC(=O)c1ccc(c(c1)N)OCF 7a_100000724433_100015361967 [0,1,1,0,0,0|2,0,0]=4 2545 B14R1.6720 COC(=O)c1ccc(c(c1)N)SCF 62a_100011450966_100015361967 [0,1,1,0,0,0|2,0,0]=4 2546 B14R1.6720 COC(=O)c1ccc(c(c1)N)SCF 62a_100015361967_100011450966 [0,1,1,0,0,0|2,0,0]=4 2547 B14R1.6720 COC(=O)c1ccc(c(c1)O)SCF 62a_100012350776_100015361967 [0,1,1,0,0,0|2,0,0]=4 2548 B14R1.6720 COC(=O)c1ccc(c(c1)O)SCF 62a_100015361967_100012350776 [0,1,1,0,0,0|2,0,0]=4 2549 B14R1.6720 COCc1ccc(cc1Br)C(=O)OC 34a_100012355398_200000210301 [0,1,1,0,0,0|2,0,0]=4 2550 B14R1.6720 COCc1ccc(cc1Br)C(=O)OC 34a_100138415774_100010201862 [0,1,1,0,0,0|2,0,0]=4 2551 B14R1.6720 COCc1ccc(cc1Br)C(=O)OC 7a_100012355398_200000210301 [0,1,1,0,0,0|2,0,0]=4 2552 B14R1.6720 COCc1ccc(cc1Cl)C(=O)OC 34a_100138415774_100012194053 [0,1,1,0,0,0|2,0,0]=4 2553 B14R1.6720 COCc1ccc(cc1F)C(=O)OC 34a_100000094453_200000210301 [0,1,1,0,0,0|2,0,0]=4 2554 B14R1.6720 COCc1ccc(cc1F)C(=O)OC 34a_100138415774_100000694138 [0,1,1,0,0,0|2,0,0]=4 2555 B14R1.6720 COCc1ccc(cc1F)C(=O)OC 7a_100000094453_200000210301 [0,1,1,0,0,0|2,0,0]=4 2556 B14R1.471 CC=Cc1cccc(c1)C(=O)OCC 271570a_100016259895_100000170211 [0,1,1,0,0,0|1,0,1]=4 2557 B14R1.471 CCCC(=O)c1cccc(c1)OCC 1458a_100000216331_100000210303 [0,1,1,0,0,0|2,0,0]=4 2558 B14R1.471 CCNC(=O)c1cc(ccn1)NCC 27a_100015525214_100000194128 [0,1,1,0,0,0|2,0,0]=4 2559 B14R1.471 CCNC(=O)c1cccc(c1)NCC 34a_100000181407_100000210202 [0,1,1,0,0,0|1,0,0]=3 2560 B14R1.471 CCNC(=O)c1cccc(c1)NCC 7a_100000181407_100000210202 [0,1,1,0,0,0|1,0,0]=3 2561 B14R1.471 CCNC(=O)c1cccc(c1)NCF 34a_100000181407_100015361967 [0,1,1,0,0,0|2,0,0]=4 2562 B14R1.471 CCNC(=O)c1cccc(c1)NCF 7a_100000181407_100015361967 [0,1,1,0,0,0|2,0,0]=4 2563 B14R1.471 CCNC(=O)c1cccc(c1)OCC 11a_100015525214_100000216331 [0,1,1,0,0,0|2,0,0]=4 2564 B14R1.471 CCNC(=O)c1cccc(c1)OCC 240690a_100015525214_100000216331 [0,1,1,0,0,0|2,0,0]=4 2565 B14R1.471 CCNC(=O)c1cccc(c1)OCC 527a_100015525214_100000216331 [0,1,1,0,0,0|2,0,0]=4 2566 B14R1.471 CCNC(=O)c1cccc(c1)OCC 7a_100000160095_100000210202 [0,1,1,0,0,0|2,0,0]=4 2567 B14R1.471 CCNC(=O)c1cccc(c1)SCC 62a_100000155180_100000210202 [0,1,1,0,0,0|2,0,0]=4 2568 B14R1.471 CCNC(=O)c1cccc(c1)SCC 62a_100000210202_100000155180 [0,1,1,0,0,0|2,0,0]=4 2569 B14R1.471 CCNC(=O)c1ccnc(c1)NCC 27a_100015525214_100000229823 [0,1,1,0,0,0|2,0,0]=4 2570 B14R1.471 CCNC(=O)c1cncc(c1)NCC 27a_100015525214_200000155184 [0,1,1,0,0,0|2,0,0]=4 2571 B14R1.471 CCNc1cc(cnn1)C(=O)OCC 27a_100015525214_100009853686 [0,1,1,0,0,0|2,0,0]=4 2572 B14R1.471 CCNc1cc(ncn1)C(=O)OCC 27a_100015525214_100009878719 [0,1,1,0,0,0|2,0,0]=4 2573 B14R1.471 CCNc1cccc(n1)C(=O)OCC 27a_100015525214_100000695914 [0,1,1,0,0,0|1,0,0]=3 2574 B14R1.471 CCNc1cncc(n1)C(=O)OCC 27a_100015525214_100012185986 [0,1,1,0,0,0|2,0,0]=4 2575 B14R1.471 CCNc1nccc(n1)C(=O)OCC 27a_100015525214_100000087789 [0,1,1,0,0,0|2,0,0]=4 2576 B14R1.471 CCOC(=O)c1cc(ccn1)SCC 62a_100000210202_100010210110 [0,1,1,0,0,0|2,0,0]=4 2577 B14R1.471 CCOC(=O)c1cc(ccn1)SCC 62a_100010210110_100000210202 [0,1,1,0,0,0|2,0,0]=4 2578 B14R1.471 CCOC(=O)c1cccc(c1)CNC 2230a_106832991635_100011934420 [0,1,1,0,0,0|2,0,0]=4 2579 B14R1.471 CCOC(=O)c1cccc(c1)CNC 270004a_106832991635_200000047102 [0,1,1,0,0,0|2,0,0]=4 2580 B14R1.471 CCOC(=O)c1cccc(c1)CNC 7a_106832991635_100011934420 [0,1,1,0,0,0|2,0,0]=4 2581 B14R1.471 CCOC(=O)c1cccc(c1)CSC 62a_100011934420_200000210301 [0,1,1,0,0,0|2,0,0]=4 2582 B14R1.471 CCOC(=O)c1cccc(c1)CSC 62a_200000210301_100011934420 [0,1,1,0,0,0|2,0,0]=4 2583 B14R1.471 CCOC(=O)c1cccc(c1)CS[13CH3] 62a_100011934420_200025704644 [0,1,1,0,0,0|2,0,0]=4 2584 B14R1.471 CCOC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100011934420 [0,1,1,0,0,0|2,0,0]=4 2585 B14R1.471 CCOC(=O)c1cccc(c1)OCC 7a_100000169910_100000210202 [0,1,1,0,0,0|1,0,0]=3 2586 B14R1.471 CCOC(=O)c1cccc(c1)OCF 7a_100000169910_100015361967 [0,1,1,0,0,0|2,0,0]=4 2587 B14R1.471 CCOC(=O)c1cccc(c1)SCC 62a_100000170211_100000210202 [0,1,1,0,0,0|1,0,0]=3 2588 B14R1.471 CCOC(=O)c1cccc(c1)SCC 62a_100000210202_100000170211 [0,1,1,0,0,0|1,0,0]=3 2589 B14R1.471 CCOC(=O)c1cccc(c1)SCF 62a_100000170211_100015361967 [0,1,1,0,0,0|2,0,0]=4 2590 B14R1.471 CCOC(=O)c1cccc(c1)SCF 62a_100015361967_100000170211 [0,1,1,0,0,0|2,0,0]=4 2591 B14R1.471 CCOC(=O)c1cccc(n1)SCC 62a_100000210202_100000695914 [0,1,1,0,0,0|2,0,0]=4 2592 B14R1.471 CCOC(=O)c1cccc(n1)SCC 62a_100000695914_100000210202 [0,1,1,0,0,0|2,0,0]=4 2593 B14R1.471 CCOC(=O)c1ccnc(c1)SCC 62a_100000210202_100011213083 [0,1,1,0,0,0|2,0,0]=4 2594 B14R1.471 CCOC(=O)c1ccnc(c1)SCC 62a_100012350809_100000210202 [0,1,1,0,0,0|2,0,0]=4 2595 B14R1.471 CCOC(=O)c1cncc(c1)OCC 7a_100000185702_100000210202 [0,1,1,0,0,0|2,0,0]=4 2596 B14R1.471 CCOC(=O)c1cncc(c1)SCC 62a_100000170250_100000210202 [0,1,1,0,0,0|2,0,0]=4 2597 B14R1.471 CCOC(=O)c1cncc(c1)SCC 62a_100000210202_100000170250 [0,1,1,0,0,0|2,0,0]=4 2598 B14R1.471 CCOc1cccc(c1)C(=O)CCF 1458a_100000216331_100011217306 [0,1,1,0,0,0|2,0,0]=4 2599 B14R1.471 CCOc1cccc(c1)C(=O)CCO 1458a_100000216331_100000211926 [0,1,1,0,0,0|2,0,0]=4 2600 B14R1.471 CCOc1cccc(c1)C(=O)NNC 22a_100016993582_100000216331 [0,1,1,0,0,0|2,0,0]=4 2601 B14R1.473 CC=Cc1cccc(c1Br)C(=O)OC 271570a_100016259895_100010240208 [0,1,1,0,0,0|1,0,1]=4 2602 B14R1.473 CC=Cc1cccc(c1C)C(=O)OC 271570a_100016259895_100012298220 [0,1,1,0,0,0|1,0,1]=4 2603 B14R1.473 CC=Cc1cccc(c1F)C(=O)OC 271570a_100016259895_100012355674 [0,1,1,0,0,0|1,0,1]=4 2604 B14R1.473 CC=Cc1cccc(c1N)C(=O)OC 271570a_100016259895_100011356556 [0,1,1,0,0,0|1,0,1]=4 2605 B14R1.473 CC=Cc1cccc(c1O)C(=O)OC 271570a_100016259895_100009816214 [0,1,1,0,0,0|1,0,1]=4 2606 B14R1.473 CCNc1cccc(c1C)C(=O)NC 34a_100000739055_100000210202 [0,1,1,0,0,0|1,0,0]=3 2607 B14R1.473 CCOc1cccc(c1Br)C(=O)OC 34a_200010230364_100000210202 [0,1,1,0,0,0|1,0,0]=3 2608 B14R1.473 CCOc1cccc(c1Br)C(=O)OC 7a_200010230364_100000210202 [0,1,1,0,0,0|1,0,0]=3 2609 B14R1.473 CCOc1cccc(c1C)C(=O)OC 34a_100011999632_100000210202 [0,1,1,0,0,0|1,0,0]=3 2610 B14R1.473 CCOc1cccc(c1C)C(=O)OC 7a_100011999632_100000210202 [0,1,1,0,0,0|1,0,0]=3 2611 B14R1.473 CCOc1cccc(c1Cl)C(=O)OC 34a_100009866855_100000210202 [0,1,1,0,0,0|1,0,0]=3 2612 B14R1.473 CCOc1cccc(c1Cl)C(=O)OC 7a_100009866855_100000210202 [0,1,1,0,0,0|1,0,0]=3 2613 B14R1.473 CCOc1cccc(c1F)C(=O)CC 1458a_100000100213_100000210202 [0,1,1,0,0,0|2,0,0]=4 2614 B14R1.473 CCOc1cccc(c1F)C(=O)NC 11a_106832991635_100000100213 [0,1,1,0,0,0|2,0,0]=4 2615 B14R1.473 CCOc1cccc(c1F)C(=O)NC 1626a_100102657272_100000100213 [0,1,1,0,0,0|2,0,0]=4 2616 B14R1.473 CCOc1cccc(c1F)C(=O)NC 240690a_100102657272_100000100213 [0,1,1,0,0,0|2,0,0]=4 2617 B14R1.473 CCOc1cccc(c1F)C(=O)NC 527a_100102657272_100000100213 [0,1,1,0,0,0|2,0,0]=4 2618 B14R1.473 CCOc1cccc(c1F)C(=O)OC 34a_100009854753_100000210202 [0,1,1,0,0,0|1,0,0]=3 2619 B14R1.473 CCOc1cccc(c1F)C(=O)OC 7a_100009854753_100000210202 [0,1,1,0,0,0|1,0,0]=3 2620 B14R1.473 CCOc1cccc(c1N)C(=O)OC 34a_100015205654_100000210202 [0,1,1,0,0,0|1,0,0]=3 2621 B14R1.473 CCOc1cccc(c1N)C(=O)OC 7a_100015205654_100000210202 [0,1,1,0,0,0|1,0,0]=3 2622 B14R1.473 CCSc1c[nH]cc(c1=O)C(=O)OC 62a_100000210202_100010873956 [0,1,1,0,0,0|2,0,0]=4 2623 B14R1.473 CCSc1c[nH]cc(c1=O)C(=O)OC 62a_100010873956_100000210202 [0,1,1,0,0,0|2,0,0]=4 2624 B14R1.473 CCSc1cccc(c1Br)C(=O)OC 62a_100000210202_100010240208 [0,1,1,0,0,0|1,0,0]=3 2625 B14R1.473 CCSc1cccc(c1Br)C(=O)OC 62a_100010240208_100000210202 [0,1,1,0,0,0|1,0,0]=3 2626 B14R1.473 CCSc1cccc(c1C)C(=O)OC 62a_100000210202_100012298220 [0,1,1,0,0,0|1,0,0]=3 2627 B14R1.473 CCSc1cccc(c1C)C(=O)OC 62a_100012298220_100000210202 [0,1,1,0,0,0|1,0,0]=3 2628 B14R1.473 CCSc1cccc(c1F)C(=O)OC 62a_100000210202_100012355674 [0,1,1,0,0,0|1,0,0]=3 2629 B14R1.473 CCSc1cccc(c1F)C(=O)OC 62a_100012355674_100000210202 [0,1,1,0,0,0|1,0,0]=3 2630 B14R1.473 CCSc1cccc(c1N)C(=O)OC 62a_100011356556_100000210202 [0,1,1,0,0,0|1,0,0]=3 2631 B14R1.473 CCSc1cccc(c1O)C(=O)OC 62a_100009816214_100000210202 [0,1,1,0,0,0|1,0,0]=3 2632 B14R1.473 CCSc1ccnc(c1C)C(=O)OC 62a_100000094583_100000210202 [0,1,1,0,0,0|2,0,0]=4 2633 B14R1.473 CCSc1ccnc(c1C)C(=O)OC 62a_100000210202_100000094583 [0,1,1,0,0,0|2,0,0]=4 2634 B14R1.473 CCSc1ccnc(c1F)C(=O)OC 62a_100000210202_100000687924 [0,1,1,0,0,0|2,0,0]=4 2635 B14R1.473 CCSc1ccnc(c1F)C(=O)OC 62a_100000687924_100000210202 [0,1,1,0,0,0|2,0,0]=4 2636 B14R1.473 CCSc1cncc(c1C)C(=O)OC 62a_100000210202_100010713144 [0,1,1,0,0,0|2,0,0]=4 2637 B14R1.473 CCSc1cncc(c1C)C(=O)OC 62a_100010713144_100000210202 [0,1,1,0,0,0|2,0,0]=4 2638 B14R1.473 CCSc1nccc(c1C)C(=O)OC 62a_100000087782_100000210202 [0,1,1,0,0,0|2,0,0]=4 2639 B14R1.473 CCSc1nccc(c1C)C(=O)OC 62a_100000210202_100000087782 [0,1,1,0,0,0|2,0,0]=4 2640 B14R1.473 CCSc1nccc(c1F)C(=O)OC 62a_100000081818_100000210202 [0,1,1,0,0,0|2,0,0]=4 2641 B14R1.473 CCSc1nccc(c1F)C(=O)OC 62a_100000210202_100000081818 [0,1,1,0,0,0|2,0,0]=4 2642 B14R1.473 CCSc1nccc(c1N)C(=O)OC 62a_100000067308_100000210202 [0,1,1,0,0,0|2,0,0]=4 2643 B14R1.473 CCSc1nccc(c1N)C(=O)OC 62a_100000210202_100000067308 [0,1,1,0,0,0|2,0,0]=4 2644 B14R1.473 CNC(=O)c1cccc(c1C)NCF 34a_100000739055_100015361967 [0,1,1,0,0,0|2,0,0]=4 2645 B14R1.473 CNCc1cccc(c1Br)C(=O)OC 2230a_106832991635_100010235804 [0,1,1,0,0,0|2,0,0]=4 2646 B14R1.473 CNCc1cccc(c1Br)C(=O)OC 26a_100102657272_200010230364 [0,1,1,0,0,0|2,0,0]=4 2647 B14R1.473 CNCc1cccc(c1Br)C(=O)OC 34a_100102657272_100010235804 [0,1,1,0,0,0|2,0,0]=4 2648 B14R1.473 CNCc1cccc(c1Br)C(=O)OC 7a_106832991635_100010235804 [0,1,1,0,0,0|2,0,0]=4 2649 B14R1.473 CNCc1cccc(c1Cl)C(=O)OC 26a_100102657272_100009866855 [0,1,1,0,0,0|2,0,0]=4 2650 B14R1.473 CNCc1cccc(c1F)C(=O)OC 2230a_106832991635_200013328352 [0,1,1,0,0,0|2,0,0]=4 2651 B14R1.473 CNCc1cccc(c1F)C(=O)OC 270004a_106832991635_100012866473 [0,1,1,0,0,0|2,0,0]=4 2652 B14R1.473 CNCc1cccc(c1F)C(=O)OC 34a_100102657272_200013328352 [0,1,1,0,0,0|2,0,0]=4 2653 B14R1.473 CNCc1cccc(c1F)C(=O)OC 7a_106832991635_200013328352 [0,1,1,0,0,0|2,0,0]=4 2654 B14R1.473 COC(=O)c1cccc(c1Br)CSC 62a_100010235804_200000210301 [0,1,1,0,0,0|2,0,0]=4 2655 B14R1.473 COC(=O)c1cccc(c1Br)CSC 62a_200000210301_100010235804 [0,1,1,0,0,0|2,0,0]=4 2656 B14R1.473 COC(=O)c1cccc(c1Br)CS[13CH3] 62a_100010235804_200025704644 [0,1,1,0,0,0|2,0,0]=4 2657 B14R1.473 COC(=O)c1cccc(c1Br)CS[13CH3] 62a_200025704644_100010235804 [0,1,1,0,0,0|2,0,0]=4 2658 B14R1.473 COC(=O)c1cccc(c1Br)OCF 34a_200010230364_100015361967 [0,1,1,0,0,0|2,0,0]=4 2659 B14R1.473 COC(=O)c1cccc(c1Br)OCF 7a_200010230364_100015361967 [0,1,1,0,0,0|2,0,0]=4 2660 B14R1.473 COC(=O)c1cccc(c1Br)SCF 62a_100010240208_100015361967 [0,1,1,0,0,0|2,0,0]=4 2661 B14R1.473 COC(=O)c1cccc(c1Br)SCF 62a_100015361967_100010240208 [0,1,1,0,0,0|2,0,0]=4 2662 B14R1.473 COC(=O)c1cccc(c1C)OCF 34a_100011999632_100015361967 [0,1,1,0,0,0|2,0,0]=4 2663 B14R1.473 COC(=O)c1cccc(c1C)OCF 7a_100011999632_100015361967 [0,1,1,0,0,0|2,0,0]=4 2664 B14R1.473 COC(=O)c1cccc(c1C)SCF 62a_100012298220_100015361967 [0,1,1,0,0,0|2,0,0]=4 2665 B14R1.473 COC(=O)c1cccc(c1C)SCF 62a_100015361967_100012298220 [0,1,1,0,0,0|2,0,0]=4 2666 B14R1.473 COC(=O)c1cccc(c1Cl)OCF 34a_100009866855_100015361967 [0,1,1,0,0,0|2,0,0]=4 2667 B14R1.473 COC(=O)c1cccc(c1Cl)OCF 7a_100009866855_100015361967 [0,1,1,0,0,0|2,0,0]=4 2668 B14R1.473 COC(=O)c1cccc(c1F)CSC 62a_200000210301_200013328352 [0,1,1,0,0,0|2,0,0]=4 2669 B14R1.473 COC(=O)c1cccc(c1F)CSC 62a_200013328352_200000210301 [0,1,1,0,0,0|2,0,0]=4 2670 B14R1.473 COC(=O)c1cccc(c1F)CS[13CH3] 62a_200013328352_200025704644 [0,1,1,0,0,0|2,0,0]=4 2671 B14R1.473 COC(=O)c1cccc(c1F)CS[13CH3] 62a_200025704644_200013328352 [0,1,1,0,0,0|2,0,0]=4 2672 B14R1.473 COC(=O)c1cccc(c1F)OCF 34a_100009854753_100015361967 [0,1,1,0,0,0|2,0,0]=4 2673 B14R1.473 COC(=O)c1cccc(c1F)OCF 7a_100009854753_100015361967 [0,1,1,0,0,0|2,0,0]=4 2674 B14R1.473 COC(=O)c1cccc(c1F)SCF 62a_100012355674_100015361967 [0,1,1,0,0,0|2,0,0]=4 2675 B14R1.473 COC(=O)c1cccc(c1F)SCF 62a_100015361967_100012355674 [0,1,1,0,0,0|2,0,0]=4 2676 B14R1.473 COC(=O)c1cccc(c1N)OCF 34a_100015205654_100015361967 [0,1,1,0,0,0|2,0,0]=4 2677 B14R1.473 COC(=O)c1cccc(c1N)OCF 7a_100015205654_100015361967 [0,1,1,0,0,0|2,0,0]=4 2678 B14R1.473 COC(=O)c1cccc(c1N)SCF 62a_100011356556_100015361967 [0,1,1,0,0,0|2,0,0]=4 2679 B14R1.473 COC(=O)c1cccc(c1O)SCF 62a_100009816214_100015361967 [0,1,1,0,0,0|2,0,0]=4 2680 B14R1.473 COCc1cccc(c1Br)C(=O)OC 34a_100138415774_100010235804 [0,1,1,0,0,0|2,0,0]=4 2681 B14R1.473 COCc1cccc(c1F)C(=O)OC 34a_100138415774_200013328352 [0,1,1,0,0,0|2,0,0]=4 2682 B14R1.733 CCC(=O)c1cccc(c1)NC(=O)C 1458a_100000188798_100000210202 [0,1,1,0,0,0|1,0,1]=4 2683 B14R1.733 CCC(=O)c1cccc(c1)OC(C)C 1458a_100000186504_100000210202 [0,1,1,0,0,0|2,0,0]=4 2684 B14R1.733 CCC(=O)c1cccc(c1)OC(C)C 34a_100011996911_100000210206 [0,1,1,0,0,0|2,0,0]=4 2685 B14R1.733 CCC(=O)c1cccc(c1)OC(C)C 7a_100011996911_100000210206 [0,1,1,0,0,0|2,0,0]=4 2686 B14R1.733 CCC(=O)c1cccc(c1)SC(C)C 62a_100000210206_100000211677 [0,1,1,0,0,0|2,0,0]=4 2687 B14R1.733 CCC(=O)c1cccc(c1)SC(C)C 62a_100000211677_100000210206 [0,1,1,0,0,0|2,0,0]=4 2688 B14R1.733 CNC(=O)c1cc(ccn1)NC(C)C 27a_100138425928_100000204654 [0,1,1,0,0,0|2,0,0]=4 2689 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 11a_100000185133_100015343762 [0,1,1,0,0,0|1,0,1]=4 2690 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 11a_106832991635_100000188798 [0,1,1,0,0,0|1,0,1]=4 2691 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 1626a_100000185133_100015343762 [0,1,1,0,0,0|1,0,1]=4 2692 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 1626a_100102657272_100000188798 [0,1,1,0,0,0|1,0,1]=4 2693 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 22a_100000185133_100000070787 [0,1,1,0,0,0|1,0,1]=4 2694 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 240690a_100102657272_100000188798 [0,1,1,0,0,0|1,0,1]=4 2695 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 527a_100000185133_100103153847 [0,1,1,0,0,0|1,0,1]=4 2696 B14R1.733 CNC(=O)c1cccc(c1)NC(=O)C 527a_100102657272_100000188798 [0,1,1,0,0,0|1,0,1]=4 2697 B14R1.733 CNC(=O)c1cccc(c1)NC(C)C 34a_100000185133_100000210206 [0,1,1,0,0,0|1,0,0]=3 2698 B14R1.733 CNC(=O)c1cccc(c1)OC(C)C 11a_106832991635_100000186504 [0,1,1,0,0,0|2,0,0]=4 2699 B14R1.733 CNC(=O)c1cccc(c1)OC(C)C 1626a_100102657272_100000186504 [0,1,1,0,0,0|2,0,0]=4 2700 B14R1.733 CNC(=O)c1cccc(c1)OC(C)C 240690a_100102657272_100000186504 [0,1,1,0,0,0|2,0,0]=4 2701 B14R1.733 CNC(=O)c1cccc(c1)OC(C)C 34a_100000159807_100000210206 [0,1,1,0,0,0|2,0,0]=4 2702 B14R1.733 CNC(=O)c1cccc(c1)OC(C)C 527a_100102657272_100000186504 [0,1,1,0,0,0|2,0,0]=4 2703 B14R1.733 CNC(=O)c1cccc(c1)OC(C)C 7a_100000159807_100000210206 [0,1,1,0,0,0|2,0,0]=4 2704 B14R1.733 CNC(=O)c1cccc(c1)SC(C)C 62a_100000155082_100000210206 [0,1,1,0,0,0|2,0,0]=4 2705 B14R1.733 CNC(=O)c1cccc(c1)SC(C)C 62a_100000210206_100000155082 [0,1,1,0,0,0|2,0,0]=4 2706 B14R1.733 CNC(=O)c1cccc(n1)NC(C)C 27a_100138425928_100000755456 [0,1,1,0,0,0|2,0,0]=4 2707 B14R1.733 CNC(=O)c1cncc(c1)NC(C)C 27a_100138425928_200000155086 [0,1,1,0,0,0|2,0,0]=4 2708 B14R1.733 COC(=O)c1cc(ccn1)OC(C)C 34a_200020638413_100000210206 [0,1,1,0,0,0|2,0,0]=4 2709 B14R1.733 COC(=O)c1cc(ccn1)SC(C)C 62a_100000210206_100000693414 [0,1,1,0,0,0|2,0,0]=4 2710 B14R1.733 COC(=O)c1cc(ccn1)SC(C)C 62a_100000693414_100000210206 [0,1,1,0,0,0|2,0,0]=4 2711 B14R1.733 COC(=O)c1cc(ncn1)NC(C)C 27a_100138425928_100000051410 [0,1,1,0,0,0|2,0,0]=4 2712 B14R1.733 COC(=O)c1cccc(c1)C=C(C)C 271570a_100102525489_100000148679 [0,1,1,0,0,0|1,0,1]=4 2713 B14R1.733 COC(=O)c1cccc(c1)CC(=O)C 1458a_100000070787_100000184886 [0,1,1,0,0,0|1,0,1]=4 2714 B14R1.733 COC(=O)c1cccc(c1)CC(=O)C 1458a_100000111006_200000210301 [0,1,1,0,0,0|1,0,1]=4 2715 B14R1.733 COC(=O)c1cccc(c1)CC(=O)[13CH3] 1458a_100000111006_200025704644 [0,1,1,0,0,0|1,0,1]=4 2716 B14R1.733 COC(=O)c1cccc(c1)CN(C)C 2230a_100102631434_100000184886 [0,1,1,0,0,0|2,0,0]=4 2717 B14R1.733 COC(=O)c1cccc(c1)CN(C)C 269982a_100102631434_100000749464 [0,1,1,0,0,0|2,0,0]=4 2718 B14R1.733 COC(=O)c1cccc(c1)CN(C)C 270004a_100102631434_100000687630 [0,1,1,0,0,0|2,0,0]=4 2719 B14R1.733 COC(=O)c1cccc(c1)NC(=O)C 188690a_100020604953_100015343762 [0,1,1,0,0,0|0,0,1]=3 2720 B14R1.733 COC(=O)c1cccc(c1)OC(C)C 34a_100000150331_100000210206 [0,1,1,0,0,0|1,0,0]=3 2721 B14R1.733 COC(=O)c1cccc(c1)OC(C)C 7a_100000150331_100000210206 [0,1,1,0,0,0|1,0,0]=3 2722 B14R1.733 COC(=O)c1cccc(c1)SC(C)C 62a_100000148848_100000210206 [0,1,1,0,0,0|1,0,0]=3 2723 B14R1.733 COC(=O)c1cccc(c1)SC(C)C 62a_100000210206_100000148848 [0,1,1,0,0,0|1,0,0]=3 2724 B14R1.733 COC(=O)c1cccc(n1)NC(C)C 27a_100138425928_100000708286 [0,1,1,0,0,0|1,0,0]=3 2725 B14R1.733 COC(=O)c1cccc(n1)SC(C)C 62a_100000210206_100000708286 [0,1,1,0,0,0|2,0,0]=4 2726 B14R1.733 COC(=O)c1cccc(n1)SC(C)C 62a_100000708286_100000210206 [0,1,1,0,0,0|2,0,0]=4 2727 B14R1.733 COC(=O)c1ccnc(c1)OC(C)C 34a_100138552365_100000210206 [0,1,1,0,0,0|2,0,0]=4 2728 B14R1.733 COC(=O)c1ccnc(c1)SC(C)C 62a_100000210206_100011934382 [0,1,1,0,0,0|2,0,0]=4 2729 B14R1.733 COC(=O)c1ccnc(c1)SC(C)C 62a_100011934382_100000210206 [0,1,1,0,0,0|2,0,0]=4 2730 B14R1.733 COC(=O)c1ccnc(n1)NC(C)C 27a_100138425928_100000070389 [0,1,1,0,0,0|2,0,0]=4 2731 B14R1.733 COC(=O)c1cncc(c1)OC(C)C 34a_100000687108_100000210206 [0,1,1,0,0,0|2,0,0]=4 2732 B14R1.733 COC(=O)c1cncc(c1)OC(C)C 7a_100000687108_100000210206 [0,1,1,0,0,0|2,0,0]=4 2733 B14R1.733 COC(=O)c1cncc(c1)SC(C)C 62a_100000148912_100000210206 [0,1,1,0,0,0|2,0,0]=4 2734 B14R1.733 COC(=O)c1cncc(c1)SC(C)C 62a_100000210206_100000148912 [0,1,1,0,0,0|2,0,0]=4 2735 B14R1.733 COC(=O)c1cncc(n1)NC(C)C 27a_100138425928_100000765340 [0,1,1,0,0,0|2,0,0]=4 2736 B14R1.733 COC(=O)c1cnnc(c1)NC(C)C 27a_100138425928_100009862058 [0,1,1,0,0,0|2,0,0]=4 2737 B14R1.734 CCC(=O)c1cccc(c1)C(=O)OC 1458a_100000035267_100000210202 [0,1,1,0,0,0|1,0,0]=3 2738 B14R1.734 CNC(=O)c1cccc(c1)C(=O)OC 11a_106832991635_100000035267 [0,1,1,0,0,0|2,0,0]=4 2739 B14R1.734 CNC(=O)c1cccc(c1)C(=O)OC 1626a_100102657272_100000035267 [0,1,1,0,0,0|2,0,0]=4 2740 B14R1.734 CNC(=O)c1cccc(c1)C(=O)OC 240690a_100102657272_100000035267 [0,1,1,0,0,0|2,0,0]=4 2741 B14R1.734 CNC(=O)c1cccc(c1)C(=O)OC 527a_100102657272_100000035267 [0,1,1,0,0,0|2,0,0]=4 2742 B14R1.734 COC(=O)c1cccc(c1)C(=O)CF 1458a_100000035267_100015361967 [0,1,1,0,0,0|2,0,0]=4 2743 B14R1.780 C#CCNc1cccc(c1)C(=O)NC 34a_100000185133_100000184674 [0,1,1,0,0,0|1,0,1]=4 2744 B14R1.780 C#CCNc1cccc(n1)C(=O)OC 27a_100000212058_100000708286 [0,1,1,0,0,0|1,0,1]=4 2745 B14R1.780 C#CCOc1cccc(c1)C(=O)OC 34a_100000150331_100000184674 [0,1,1,0,0,0|1,0,1]=4 2746 B14R1.780 C#CCOc1cccc(c1)C(=O)OC 7a_100000150331_100000038162 [0,1,1,0,0,0|1,0,1]=4 2747 B14R1.780 C#CCSc1cccc(c1)C(=O)OC 62a_100000038162_100000148848 [0,1,1,0,0,0|1,0,1]=4 2748 B14R1.780 C=CCNc1cccc(c1)C(=O)NC 34a_100000185133_100015514636 [0,1,1,0,0,0|1,0,1]=4 2749 B14R1.780 C=CCNc1cccc(n1)C(=O)OC 27a_100020586998_100000708286 [0,1,1,0,0,0|1,0,1]=4 2750 B14R1.780 C=CCOc1cccc(c1)C(=O)OC 34a_100000150331_100015514636 [0,1,1,0,0,0|1,0,1]=4 2751 B14R1.780 C=CCOc1cccc(c1)C(=O)OC 7a_100000150331_100015514636 [0,1,1,0,0,0|1,0,1]=4 2752 B14R1.780 C=CCSc1cccc(c1)C(=O)OC 62a_100000148848_100000210623 [0,1,1,0,0,0|1,0,1]=4 2753 B14R1.780 C=CCSc1cccc(c1)C(=O)OC 62a_100000210623_100000148848 [0,1,1,0,0,0|1,0,1]=4 2754 B14R1.780 CCC(=O)c1cccc(c1)OCCF 34a_100011996911_100011217306 [0,1,1,0,0,0|2,0,0]=4 2755 B14R1.780 CCC(=O)c1cccc(c1)OCCF 7a_100011996911_100011217306 [0,1,1,0,0,0|2,0,0]=4 2756 B14R1.780 CCC(=O)c1cccc(c1)OCCO 1458a_100000217287_100000210202 [0,1,1,0,0,0|2,0,0]=4 2757 B14R1.780 CCC(=O)c1cccc(c1)OCCO 34a_100011996911_100000211926 [0,1,1,0,0,0|2,0,0]=4 2758 B14R1.780 CCC(=O)c1cccc(c1)OCCO 7a_100011996911_100000211926 [0,1,1,0,0,0|2,0,0]=4 2759 B14R1.780 CCC(=O)c1cccc(c1)OCSC 34a_100011996911_100011218213 [0,1,1,0,0,0|2,0,0]=4 2760 B14R1.780 CCC(=O)c1cccc(c1)SCCF 62a_100000211677_100011217306 [0,1,1,0,0,0|2,0,0]=4 2761 B14R1.780 CCC(=O)c1cccc(c1)SCCF 62a_100011217306_100000211677 [0,1,1,0,0,0|2,0,0]=4 2762 B14R1.780 CCC(=O)c1cccc(c1)SCCO 62a_100000211677_100000211926 [0,1,1,0,0,0|2,0,0]=4 2763 B14R1.780 CCC(=O)c1cccc(c1)SCCO 62a_100000211926_100000211677 [0,1,1,0,0,0|2,0,0]=4 2764 B14R1.780 CCC(=O)c1cccc(c1)SCOC 62a_100000211677_100000766300 [0,1,1,0,0,0|2,0,0]=4 2765 B14R1.780 CCC(=O)c1cccc(c1)SCOC 62a_100000766300_100000211677 [0,1,1,0,0,0|2,0,0]=4 2766 B14R1.780 CCC(=O)c1cccc(c1)SCSC 62a_100000211677_100011218213 [0,1,1,0,0,0|2,0,0]=4 2767 B14R1.780 CCC(=O)c1cccc(c1)SCSC 62a_100011218213_100000211677 [0,1,1,0,0,0|2,0,0]=4 2768 B14R1.780 CCCCc1cc(ccn1)C(=O)OC 271570a_100020621405_100011934382 [0,1,1,0,0,0|2,0,0]=4 2769 B14R1.780 CCCCc1cccc(c1)C(=O)CC 1458a_100012178757_100000210202 [0,1,1,0,0,0|2,0,0]=4 2770 B14R1.780 CCCCc1cccc(c1)C(=O)CC 271570a_100020621405_100000211677 [0,1,1,0,0,0|2,0,0]=4 2771 B14R1.780 CCCCc1cccc(c1)C(=O)NC 11a_106832991635_100012178757 [0,1,1,0,0,0|2,0,0]=4 2772 B14R1.780 CCCCc1cccc(c1)C(=O)NC 1626a_100102657272_100012178757 [0,1,1,0,0,0|2,0,0]=4 2773 B14R1.780 CCCCc1cccc(c1)C(=O)NC 240690a_100102657272_100012178757 [0,1,1,0,0,0|2,0,0]=4 2774 B14R1.780 CCCCc1cccc(c1)C(=O)NC 271570a_100020621405_100000155082 [0,1,1,0,0,0|2,0,0]=4 2775 B14R1.780 CCCCc1cccc(c1)C(=O)NC 527a_100102657272_100012178757 [0,1,1,0,0,0|2,0,0]=4 2776 B14R1.780 CCCCc1cccc(c1)C(=O)OC 271570a_100020621405_100000148679 [0,1,1,0,0,0|1,0,0]=3 2777 B14R1.780 CCCCc1cccc(n1)C(=O)OC 271570a_100020621405_100000708286 [0,1,1,0,0,0|2,0,0]=4 2778 B14R1.780 CCCCc1ccnc(c1)C(=O)OC 271570a_100020621405_100000693414 [0,1,1,0,0,0|2,0,0]=4 2779 B14R1.780 CCCCc1cncc(c1)C(=O)OC 271570a_100020621405_100000148912 [0,1,1,0,0,0|2,0,0]=4 2780 B14R1.780 CCCNc1cccc(c1)C(=O)NC 34a_100000185133_100000210303 [0,1,1,0,0,0|1,0,0]=3 2781 B14R1.780 CCCOc1cc(ccn1)C(=O)OC 34a_100138552365_100000210303 [0,1,1,0,0,0|2,0,0]=4 2782 B14R1.780 CCCOc1cccc(c1)C(=O)CC 1458a_100000216339_100000210202 [0,1,1,0,0,0|2,0,0]=4 2783 B14R1.780 CCCOc1cccc(c1)C(=O)CC 34a_100011996911_100000210303 [0,1,1,0,0,0|2,0,0]=4 2784 B14R1.780 CCCOc1cccc(c1)C(=O)CC 7a_100011996911_100000210303 [0,1,1,0,0,0|2,0,0]=4 2785 B14R1.780 CCCOc1cccc(c1)C(=O)NC 11a_106832991635_100000216339 [0,1,1,0,0,0|2,0,0]=4 2786 B14R1.780 CCCOc1cccc(c1)C(=O)NC 1626a_100102657272_100000216339 [0,1,1,0,0,0|2,0,0]=4 2787 B14R1.780 CCCOc1cccc(c1)C(=O)NC 240690a_100102657272_100000216339 [0,1,1,0,0,0|2,0,0]=4 2788 B14R1.780 CCCOc1cccc(c1)C(=O)NC 34a_100000159807_100000210303 [0,1,1,0,0,0|2,0,0]=4 2789 B14R1.780 CCCOc1cccc(c1)C(=O)NC 527a_100102657272_100000216339 [0,1,1,0,0,0|2,0,0]=4 2790 B14R1.780 CCCOc1cccc(c1)C(=O)NC 7a_100000159807_100000210303 [0,1,1,0,0,0|2,0,0]=4 2791 B14R1.780 CCCOc1cccc(c1)C(=O)OC 34a_100000150331_100000210303 [0,1,1,0,0,0|1,0,0]=3 2792 B14R1.780 CCCOc1cccc(c1)C(=O)OC 7a_100000150331_100000210303 [0,1,1,0,0,0|1,0,0]=3 2793 B14R1.780 CCCOc1ccnc(c1)C(=O)OC 34a_200020638413_100000210303 [0,1,1,0,0,0|2,0,0]=4 2794 B14R1.780 CCCOc1cncc(c1)C(=O)OC 34a_100000687108_100000210303 [0,1,1,0,0,0|2,0,0]=4 2795 B14R1.780 CCCOc1cncc(c1)C(=O)OC 7a_100000687108_100000210303 [0,1,1,0,0,0|2,0,0]=4 2796 B14R1.780 CCCSc1cc(ccn1)C(=O)OC 62a_100000210303_100011934382 [0,1,1,0,0,0|2,0,0]=4 2797 B14R1.780 CCCSc1cc(ccn1)C(=O)OC 62a_100011934382_100000210303 [0,1,1,0,0,0|2,0,0]=4 2798 B14R1.780 CCCSc1cccc(c1)C(=O)CC 62a_100000210303_100000211677 [0,1,1,0,0,0|2,0,0]=4 2799 B14R1.780 CCCSc1cccc(c1)C(=O)CC 62a_100000211677_100000210303 [0,1,1,0,0,0|2,0,0]=4 2800 B14R1.780 CCCSc1cccc(c1)C(=O)NC 62a_100000155082_100000210303 [0,1,1,0,0,0|2,0,0]=4 2801 B14R1.780 CCCSc1cccc(c1)C(=O)NC 62a_100000210303_100000155082 [0,1,1,0,0,0|2,0,0]=4 2802 B14R1.780 CCCSc1cccc(c1)C(=O)OC 62a_100000148848_100000210303 [0,1,1,0,0,0|1,0,0]=3 2803 B14R1.780 CCCSc1cccc(c1)C(=O)OC 62a_100000210303_100000148848 [0,1,1,0,0,0|1,0,0]=3 2804 B14R1.780 CCCSc1cccc(n1)C(=O)OC 62a_100000210303_100000708286 [0,1,1,0,0,0|2,0,0]=4 2805 B14R1.780 CCCSc1cccc(n1)C(=O)OC 62a_100000708286_100000210303 [0,1,1,0,0,0|2,0,0]=4 2806 B14R1.780 CCCSc1ccnc(c1)C(=O)OC 62a_100000210303_100000693414 [0,1,1,0,0,0|2,0,0]=4 2807 B14R1.780 CCCSc1ccnc(c1)C(=O)OC 62a_100000693414_100000210303 [0,1,1,0,0,0|2,0,0]=4 2808 B14R1.780 CCCSc1cncc(c1)C(=O)OC 62a_100000148912_100000210303 [0,1,1,0,0,0|2,0,0]=4 2809 B14R1.780 CCCSc1cncc(c1)C(=O)OC 62a_100000210303_100000148912 [0,1,1,0,0,0|2,0,0]=4 2810 B14R1.780 CCNCc1cc(ccn1)C(=O)OC 2230a_100015525214_100020667620 [0,1,1,0,0,0|1,0,0]=3 2811 B14R1.780 CCNCc1cc(ccn1)C(=O)OC 270004a_100015525214_100009884558 [0,1,1,0,0,0|1,0,0]=3 2812 B14R1.780 CCNCc1cccc(c1)C(=O)NC 2230a_100015525214_100000755619 [0,1,1,0,0,0|1,0,0]=3 2813 B14R1.780 CCNCc1cccc(c1)C(=O)OC 2230a_100015525214_100000184886 [0,1,1,0,0,0|0,0,0]=2 2814 B14R1.780 CCNCc1cccc(c1)C(=O)OC 270004a_100015525214_100000687630 [0,1,1,0,0,0|0,0,0]=2 2815 B14R1.780 CCNCc1cccc(n1)C(=O)OC 2230a_100015525214_100000097194 [0,1,1,0,0,0|1,0,0]=3 2816 B14R1.780 CCNCc1cccc(n1)C(=O)OC 270004a_100015525214_100000085286 [0,1,1,0,0,0|1,0,0]=3 2817 B14R1.780 CCNCc1cncc(c1)C(=O)OC 2230a_100015525214_100020633827 [0,1,1,0,0,0|1,0,0]=3 2818 B14R1.780 CCOCc1cccc(c1)C(=O)NC 34a_100121572206_100000755619 [0,1,1,0,0,0|2,0,0]=4 2819 B14R1.780 CCOCc1cccc(c1)C(=O)OC 34a_100000750316_100000210202 [0,1,1,0,0,0|1,0,0]=3 2820 B14R1.780 CCOCc1cccc(c1)C(=O)OC 34a_100121572206_100000184886 [0,1,1,0,0,0|1,0,0]=3 2821 B14R1.780 CCOCc1cccc(c1)C(=O)OC 7a_100000750316_100000210202 [0,1,1,0,0,0|1,0,0]=3 2822 B14R1.780 CCOCc1cccc(n1)C(=O)OC 34a_100121572206_100010006753 [0,1,1,0,0,0|2,0,0]=4 2823 B14R1.780 CCOCc1cncc(c1)C(=O)OC 34a_100009869914_100000210202 [0,1,1,0,0,0|2,0,0]=4 2824 B14R1.780 CCOCc1cncc(c1)C(=O)OC 7a_100009869914_100000210202 [0,1,1,0,0,0|2,0,0]=4 2825 B14R1.780 CCSCc1cc(ccn1)C(=O)OC 62a_100000210202_100020667620 [0,1,1,0,0,0|2,0,0]=4 2826 B14R1.780 CCSCc1cc(ccn1)C(=O)OC 62a_100020667620_100000210202 [0,1,1,0,0,0|2,0,0]=4 2827 B14R1.780 CCSCc1cccc(c1)C(=O)NC 62a_100000210202_100000755619 [0,1,1,0,0,0|2,0,0]=4 2828 B14R1.780 CCSCc1cccc(c1)C(=O)NC 62a_100000755619_100000210202 [0,1,1,0,0,0|2,0,0]=4 2829 B14R1.780 CCSCc1cccc(c1)C(=O)OC 62a_100000184886_100000210202 [0,1,1,0,0,0|1,0,0]=3 2830 B14R1.780 CCSCc1cccc(c1)C(=O)OC 62a_100000210202_100000184886 [0,1,1,0,0,0|1,0,0]=3 2831 B14R1.780 CCSCc1cccc(n1)C(=O)OC 62a_100000097194_100000210202 [0,1,1,0,0,0|2,0,0]=4 2832 B14R1.780 CCSCc1cccc(n1)C(=O)OC 62a_100000210202_100010006753 [0,1,1,0,0,0|2,0,0]=4 2833 B14R1.780 CCSCc1cncc(c1)C(=O)OC 62a_100000210202_100020633827 [0,1,1,0,0,0|2,0,0]=4 2834 B14R1.780 CCSCc1cncc(c1)C(=O)OC 62a_100020633827_100000210202 [0,1,1,0,0,0|2,0,0]=4 2835 B14R1.780 CNC(=O)c1cc(ccn1)NCCO 27a_100000210304_100000204654 [0,1,1,0,0,0|2,0,0]=4 2836 B14R1.780 CNC(=O)c1cccc(c1)NCC=O 34a_100000185133_200009817547 [0,1,1,0,0,0|1,0,1]=4 2837 B14R1.780 CNC(=O)c1cccc(c1)NCCF 34a_100000185133_100011217306 [0,1,1,0,0,0|1,0,0]=3 2838 B14R1.780 CNC(=O)c1cccc(c1)NCCO 34a_100000185133_100000211926 [0,1,1,0,0,0|1,0,0]=3 2839 B14R1.780 CNC(=O)c1cccc(c1)NCSC 34a_100000185133_100011218213 [0,1,1,0,0,0|1,0,0]=3 2840 B14R1.780 CNC(=O)c1cccc(c1)OCCF 34a_100000159807_100011217306 [0,1,1,0,0,0|2,0,0]=4 2841 B14R1.780 CNC(=O)c1cccc(c1)OCCF 7a_100000159807_100011217306 [0,1,1,0,0,0|2,0,0]=4 2842 B14R1.780 CNC(=O)c1cccc(c1)OCCO 1626a_100102657272_100000217287 [0,1,1,0,0,0|2,0,0]=4 2843 B14R1.780 CNC(=O)c1cccc(c1)OCCO 240690a_100102657272_100000217287 [0,1,1,0,0,0|2,0,0]=4 2844 B14R1.780 CNC(=O)c1cccc(c1)OCCO 34a_100000159807_100000211926 [0,1,1,0,0,0|2,0,0]=4 2845 B14R1.780 CNC(=O)c1cccc(c1)OCCO 7a_100000159807_100000211926 [0,1,1,0,0,0|2,0,0]=4 2846 B14R1.780 CNC(=O)c1cccc(c1)OCSC 34a_100000159807_100011218213 [0,1,1,0,0,0|2,0,0]=4 2847 B14R1.780 CNC(=O)c1cccc(c1)SCCF 62a_100000155082_100011217306 [0,1,1,0,0,0|2,0,0]=4 2848 B14R1.780 CNC(=O)c1cccc(c1)SCCF 62a_100011217306_100000155082 [0,1,1,0,0,0|2,0,0]=4 2849 B14R1.780 CNC(=O)c1cccc(c1)SCCO 62a_100000155082_100000211926 [0,1,1,0,0,0|2,0,0]=4 2850 B14R1.780 CNC(=O)c1cccc(c1)SCCO 62a_100000211926_100000155082 [0,1,1,0,0,0|2,0,0]=4 2851 B14R1.780 CNC(=O)c1cccc(c1)SCOC 62a_100000155082_100000766300 [0,1,1,0,0,0|2,0,0]=4 2852 B14R1.780 CNC(=O)c1cccc(c1)SCOC 62a_100000766300_100000155082 [0,1,1,0,0,0|2,0,0]=4 2853 B14R1.780 CNC(=O)c1cccc(c1)SCSC 62a_100000155082_100011218213 [0,1,1,0,0,0|2,0,0]=4 2854 B14R1.780 CNC(=O)c1cccc(c1)SCSC 62a_100011218213_100000155082 [0,1,1,0,0,0|2,0,0]=4 2855 B14R1.780 CNC(=O)c1cccc(n1)NCCO 27a_100000210304_100000755456 [0,1,1,0,0,0|2,0,0]=4 2856 B14R1.780 CNC(=O)c1cncc(c1)NCCO 27a_100000210304_200000155086 [0,1,1,0,0,0|2,0,0]=4 2857 B14R1.780 COC(=O)c1cc(ccn1)OCCF 34a_200020638413_100011217306 [0,1,1,0,0,0|2,0,0]=4 2858 B14R1.780 COC(=O)c1cc(ccn1)OCCO 34a_200020638413_100000211926 [0,1,1,0,0,0|2,0,0]=4 2859 B14R1.780 COC(=O)c1cc(ccn1)OCSC 34a_200020638413_100011218213 [0,1,1,0,0,0|2,0,0]=4 2860 B14R1.780 COC(=O)c1cc(ccn1)SCCF 62a_100000693414_100011217306 [0,1,1,0,0,0|2,0,0]=4 2861 B14R1.780 COC(=O)c1cc(ccn1)SCCF 62a_100011217306_100000693414 [0,1,1,0,0,0|2,0,0]=4 2862 B14R1.780 COC(=O)c1cc(ccn1)SCCO 62a_100000211926_100000693414 [0,1,1,0,0,0|2,0,0]=4 2863 B14R1.780 COC(=O)c1cc(ccn1)SCCO 62a_100000693414_100000211926 [0,1,1,0,0,0|2,0,0]=4 2864 B14R1.780 COC(=O)c1cc(ccn1)SCSC 62a_100000693414_100011218213 [0,1,1,0,0,0|2,0,0]=4 2865 B14R1.780 COC(=O)c1cc(ccn1)SCSC 62a_100011218213_100000693414 [0,1,1,0,0,0|2,0,0]=4 2866 B14R1.780 COC(=O)c1cc(ncn1)NCCO 27a_100000210304_100000051410 [0,1,1,0,0,0|2,0,0]=4 2867 B14R1.780 COC(=O)c1cccc(c1)COCF 34a_100000750316_100015361967 [0,1,1,0,0,0|2,0,0]=4 2868 B14R1.780 COC(=O)c1cccc(c1)COCF 7a_100000750316_100015361967 [0,1,1,0,0,0|2,0,0]=4 2869 B14R1.780 COC(=O)c1cccc(c1)CSCF 62a_100000184886_100015361967 [0,1,1,0,0,0|2,0,0]=4 2870 B14R1.780 COC(=O)c1cccc(c1)CSCF 62a_100015361967_100000184886 [0,1,1,0,0,0|2,0,0]=4 2871 B14R1.780 COC(=O)c1cccc(c1)OCC#N 7a_100000150331_100011215382 [0,1,1,0,0,0|1,0,1]=4 2872 B14R1.780 COC(=O)c1cccc(c1)OCC=O 34a_100000150331_200009817547 [0,1,1,0,0,0|1,0,1]=4 2873 B14R1.780 COC(=O)c1cccc(c1)OCC=O 7a_100000150331_200015260668 [0,1,1,0,0,0|1,0,1]=4 2874 B14R1.780 COC(=O)c1cccc(c1)OCCF 34a_100000150331_100011217306 [0,1,1,0,0,0|1,0,0]=3 2875 B14R1.780 COC(=O)c1cccc(c1)OCCF 7a_100000150331_100011217306 [0,1,1,0,0,0|1,0,0]=3 2876 B14R1.780 COC(=O)c1cccc(c1)OCCO 34a_100000150331_100000211926 [0,1,1,0,0,0|1,0,0]=3 2877 B14R1.780 COC(=O)c1cccc(c1)OCCO 7a_100000150331_100000211926 [0,1,1,0,0,0|1,0,0]=3 2878 B14R1.780 COC(=O)c1cccc(c1)OCSC 34a_100000150331_100011218213 [0,1,1,0,0,0|1,0,0]=3 2879 B14R1.780 COC(=O)c1cccc(c1)SCC#N 62a_100000148848_100011215382 [0,1,1,0,0,0|1,0,1]=4 2880 B14R1.780 COC(=O)c1cccc(c1)SCC#N 62a_100011215382_100000148848 [0,1,1,0,0,0|1,0,1]=4 2881 B14R1.780 COC(=O)c1cccc(c1)SCC=O 62a_100000148848_200015260668 [0,1,1,0,0,0|1,0,1]=4 2882 B14R1.780 COC(=O)c1cccc(c1)SCC=O 62a_200015260668_100000148848 [0,1,1,0,0,0|1,0,1]=4 2883 B14R1.780 COC(=O)c1cccc(c1)SCCF 62a_100000148848_100011217306 [0,1,1,0,0,0|1,0,0]=3 2884 B14R1.780 COC(=O)c1cccc(c1)SCCF 62a_100011217306_100000148848 [0,1,1,0,0,0|1,0,0]=3 2885 B14R1.780 COC(=O)c1cccc(c1)SCCO 62a_100000148848_100000211926 [0,1,1,0,0,0|1,0,0]=3 2886 B14R1.780 COC(=O)c1cccc(c1)SCCO 62a_100000211926_100000148848 [0,1,1,0,0,0|1,0,0]=3 2887 B14R1.780 COC(=O)c1cccc(c1)SCSC 62a_100000148848_100011218213 [0,1,1,0,0,0|1,0,0]=3 2888 B14R1.780 COC(=O)c1cccc(c1)SCSC 62a_100011218213_100000148848 [0,1,1,0,0,0|1,0,0]=3 2889 B14R1.780 COC(=O)c1cccc(n1)NCCO 27a_100000210304_100000708286 [0,1,1,0,0,0|1,0,0]=3 2890 B14R1.780 COC(=O)c1cccc(n1)SCCF 62a_100000708286_100011217306 [0,1,1,0,0,0|2,0,0]=4 2891 B14R1.780 COC(=O)c1cccc(n1)SCCF 62a_100011217306_100000708286 [0,1,1,0,0,0|2,0,0]=4 2892 B14R1.780 COC(=O)c1cccc(n1)SCCO 62a_100000211926_100000708286 [0,1,1,0,0,0|2,0,0]=4 2893 B14R1.780 COC(=O)c1cccc(n1)SCCO 62a_100000708286_100000211926 [0,1,1,0,0,0|2,0,0]=4 2894 B14R1.780 COC(=O)c1cccc(n1)SCSC 62a_100000708286_100011218213 [0,1,1,0,0,0|2,0,0]=4 2895 B14R1.780 COC(=O)c1cccc(n1)SCSC 62a_100011218213_100000708286 [0,1,1,0,0,0|2,0,0]=4 2896 B14R1.780 COC(=O)c1ccnc(c1)OCCF 34a_100138552365_100011217306 [0,1,1,0,0,0|2,0,0]=4 2897 B14R1.780 COC(=O)c1ccnc(c1)OCCO 34a_100138552365_100000211926 [0,1,1,0,0,0|2,0,0]=4 2898 B14R1.780 COC(=O)c1ccnc(c1)OCSC 34a_100138552365_100011218213 [0,1,1,0,0,0|2,0,0]=4 2899 B14R1.780 COC(=O)c1ccnc(c1)SCCF 62a_100011217306_100011934382 [0,1,1,0,0,0|2,0,0]=4 2900 B14R1.780 COC(=O)c1ccnc(c1)SCCF 62a_100011934382_100011217306 [0,1,1,0,0,0|2,0,0]=4 2901 B14R1.780 COC(=O)c1ccnc(c1)SCCO 62a_100000211926_100011934382 [0,1,1,0,0,0|2,0,0]=4 2902 B14R1.780 COC(=O)c1ccnc(c1)SCCO 62a_100011934382_100000211926 [0,1,1,0,0,0|2,0,0]=4 2903 B14R1.780 COC(=O)c1ccnc(c1)SCSC 62a_100011218213_100011934382 [0,1,1,0,0,0|2,0,0]=4 2904 B14R1.780 COC(=O)c1ccnc(c1)SCSC 62a_100011934382_100011218213 [0,1,1,0,0,0|2,0,0]=4 2905 B14R1.780 COC(=O)c1ccnc(n1)NCCO 27a_100000210304_100000070389 [0,1,1,0,0,0|2,0,0]=4 2906 B14R1.780 COC(=O)c1cncc(c1)OCCF 34a_100000687108_100011217306 [0,1,1,0,0,0|2,0,0]=4 2907 B14R1.780 COC(=O)c1cncc(c1)OCCF 7a_100000687108_100011217306 [0,1,1,0,0,0|2,0,0]=4 2908 B14R1.780 COC(=O)c1cncc(c1)OCCO 34a_100000687108_100000211926 [0,1,1,0,0,0|2,0,0]=4 2909 B14R1.780 COC(=O)c1cncc(c1)OCCO 7a_100000687108_100000211926 [0,1,1,0,0,0|2,0,0]=4 2910 B14R1.780 COC(=O)c1cncc(c1)OCSC 34a_100000687108_100011218213 [0,1,1,0,0,0|2,0,0]=4 2911 B14R1.780 COC(=O)c1cncc(c1)SCCF 62a_100000148912_100011217306 [0,1,1,0,0,0|2,0,0]=4 2912 B14R1.780 COC(=O)c1cncc(c1)SCCF 62a_100011217306_100000148912 [0,1,1,0,0,0|2,0,0]=4 2913 B14R1.780 COC(=O)c1cncc(c1)SCCO 62a_100000148912_100000211926 [0,1,1,0,0,0|2,0,0]=4 2914 B14R1.780 COC(=O)c1cncc(c1)SCCO 62a_100000211926_100000148912 [0,1,1,0,0,0|2,0,0]=4 2915 B14R1.780 COC(=O)c1cncc(c1)SCSC 62a_100000148912_100011218213 [0,1,1,0,0,0|2,0,0]=4 2916 B14R1.780 COC(=O)c1cncc(c1)SCSC 62a_100011218213_100000148912 [0,1,1,0,0,0|2,0,0]=4 2917 B14R1.780 COC(=O)c1cncc(n1)NCCO 27a_100000210304_100000765340 [0,1,1,0,0,0|2,0,0]=4 2918 B14R1.780 COC(=O)c1cnnc(c1)NCCO 27a_100000210304_100009862058 [0,1,1,0,0,0|2,0,0]=4 2919 B14R1.780 COCSc1cc(ccn1)C(=O)OC 62a_100000766300_100011934382 [0,1,1,0,0,0|2,0,0]=4 2920 B14R1.780 COCSc1cc(ccn1)C(=O)OC 62a_100011934382_100000766300 [0,1,1,0,0,0|2,0,0]=4 2921 B14R1.780 COCSc1cccc(c1)C(=O)OC 62a_100000148848_100000766300 [0,1,1,0,0,0|1,0,0]=3 2922 B14R1.780 COCSc1cccc(c1)C(=O)OC 62a_100000766300_100000148848 [0,1,1,0,0,0|1,0,0]=3 2923 B14R1.780 COCSc1cccc(n1)C(=O)OC 62a_100000708286_100000766300 [0,1,1,0,0,0|2,0,0]=4 2924 B14R1.780 COCSc1cccc(n1)C(=O)OC 62a_100000766300_100000708286 [0,1,1,0,0,0|2,0,0]=4 2925 B14R1.780 COCSc1ccnc(c1)C(=O)OC 62a_100000693414_100000766300 [0,1,1,0,0,0|2,0,0]=4 2926 B14R1.780 COCSc1ccnc(c1)C(=O)OC 62a_100000766300_100000693414 [0,1,1,0,0,0|2,0,0]=4 2927 B14R1.780 COCSc1cncc(c1)C(=O)OC 62a_100000148912_100000766300 [0,1,1,0,0,0|2,0,0]=4 2928 B14R1.780 COCSc1cncc(c1)C(=O)OC 62a_100000766300_100000148912 [0,1,1,0,0,0|2,0,0]=4 2929 B14R1.3213 CC=Cc1cc(cc(c1)C(=O)OC)Br 271570a_100016259895_100012339729 [0,1,1,0,0,0|1,0,1]=4 2930 B14R1.3213 CC=Cc1cc(cc(c1)C(=O)OC)C 271570a_100016259895_100012359405 [0,1,1,0,0,0|1,0,1]=4 2931 B14R1.3213 CC=Cc1cc(cc(c1)C(=O)OC)Cl 271570a_100016259895_100000695173 [0,1,1,0,0,0|1,0,1]=4 2932 B14R1.3213 CC=Cc1cc(cc(c1)C(=O)OC)F 271570a_100016259895_100000698578 [0,1,1,0,0,0|1,0,1]=4 2933 B14R1.3213 CC=Cc1cc(cc(c1)C(=O)OC)N 271570a_100016259895_100138415615 [0,1,1,0,0,0|1,0,1]=4 2934 B14R1.3213 CC=Cc1cc(cc(c1)C(=O)OC)O 271570a_100016259895_100000696291 [0,1,1,0,0,0|1,0,1]=4 2935 B14R1.3213 CCNc1nc(cc(n1)C(=O)OC)C 27a_100015525214_100000724386 [0,1,1,0,0,0|2,0,0]=4 2936 B14R1.3213 CCOc1cc(cc(c1)C(=O)CC)C 1458a_200010998560_100000210202 [0,1,1,0,0,0|2,0,0]=4 2937 B14R1.3213 CCOc1cc(cc(c1)C(=O)NC)C 11a_106832991635_200010998560 [0,1,1,0,0,0|2,0,0]=4 2938 B14R1.3213 CCOc1cc(cc(c1)C(=O)NC)C 1626a_100102657272_200010998560 [0,1,1,0,0,0|2,0,0]=4 2939 B14R1.3213 CCOc1cc(cc(c1)C(=O)NC)C 240690a_100102657272_200010998560 [0,1,1,0,0,0|2,0,0]=4 2940 B14R1.3213 CCOc1cc(cc(c1)C(=O)NC)C 527a_100102657272_200010998560 [0,1,1,0,0,0|2,0,0]=4 2941 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)Br 34a_100000696291_100000210202 [0,1,1,0,0,0|1,0,0]=3 2942 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)Br 7a_100000696291_100000210202 [0,1,1,0,0,0|1,0,0]=3 2943 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)Cl 34a_100009870047_100000210202 [0,1,1,0,0,0|1,0,0]=3 2944 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)Cl 7a_100009870047_100000210202 [0,1,1,0,0,0|1,0,0]=3 2945 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)F 34a_100000118610_100000210202 [0,1,1,0,0,0|1,0,0]=3 2946 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)F 7a_100000118610_100000210202 [0,1,1,0,0,0|1,0,0]=3 2947 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)N 34a_100000069914_100000210202 [0,1,1,0,0,0|1,0,0]=3 2948 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)N 7a_100000069914_100000210202 [0,1,1,0,0,0|1,0,0]=3 2949 B14R1.3213 CCOc1cc(cc(c1)C(=O)OC)O 271570a_203496583355_200010223199 [0,1,1,0,0,0|1,0,0]=3 2950 B14R1.3213 CCSc1cc(cc(c1)C(=O)NC)F 62a_100000210202_200011295653 [0,1,1,0,0,0|2,0,0]=4 2951 B14R1.3213 CCSc1cc(cc(c1)C(=O)NC)F 62a_200011295653_100000210202 [0,1,1,0,0,0|2,0,0]=4 2952 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)Br 62a_100000210202_100012339729 [0,1,1,0,0,0|1,0,0]=3 2953 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)Br 62a_100012339729_100000210202 [0,1,1,0,0,0|1,0,0]=3 2954 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)C 62a_100000210202_100012359405 [0,1,1,0,0,0|1,0,0]=3 2955 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)C 62a_100012359405_100000210202 [0,1,1,0,0,0|1,0,0]=3 2956 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)Cl 62a_100000210202_100000695173 [0,1,1,0,0,0|1,0,0]=3 2957 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)Cl 62a_100000695173_100000210202 [0,1,1,0,0,0|1,0,0]=3 2958 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)F 62a_100000210202_100000698578 [0,1,1,0,0,0|1,0,0]=3 2959 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)F 62a_100000698578_100000210202 [0,1,1,0,0,0|1,0,0]=3 2960 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)N 62a_100000210202_100138415615 [0,1,1,0,0,0|1,0,0]=3 2961 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)N 62a_100138415615_100000210202 [0,1,1,0,0,0|1,0,0]=3 2962 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)O 62a_100000210202_100000696291 [0,1,1,0,0,0|1,0,0]=3 2963 B14R1.3213 CCSc1cc(cc(c1)C(=O)OC)O 62a_100000696291_100000210202 [0,1,1,0,0,0|1,0,0]=3 2964 B14R1.3213 CCSc1cc(cc(n1)C(=O)OC)C 62a_100000210202_100009865194 [0,1,1,0,0,0|2,0,0]=4 2965 B14R1.3213 CCSc1cc(cc(n1)C(=O)OC)C 62a_100009865194_100000210202 [0,1,1,0,0,0|2,0,0]=4 2966 B14R1.3213 CCSc1cc(cc(n1)C)C(=O)OC 62a_100000210202_100000695393 [0,1,1,0,0,0|2,0,0]=4 2967 B14R1.3213 CCSc1cc(cc(n1)C)C(=O)OC 62a_100000695393_100000210202 [0,1,1,0,0,0|2,0,0]=4 2968 B14R1.3213 CCSc1cc(cc(n1)N)C(=O)OC 62a_100000062536_100000210202 [0,1,1,0,0,0|2,0,0]=4 2969 B14R1.3213 CCSc1cc(cc(n1)N)C(=O)OC 62a_100000210202_100000062536 [0,1,1,0,0,0|2,0,0]=4 2970 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Br 2230a_106832991635_100010233859 [0,1,1,0,0,0|2,0,0]=4 2971 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Br 26a_100102657272_100000696291 [0,1,1,0,0,0|2,0,0]=4 2972 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Br 270004a_106832991635_100010371122 [0,1,1,0,0,0|2,0,0]=4 2973 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Br 34a_100102657272_100010233859 [0,1,1,0,0,0|2,0,0]=4 2974 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Br 7a_106832991635_100010233859 [0,1,1,0,0,0|2,0,0]=4 2975 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Cl 26a_100102657272_100009870047 [0,1,1,0,0,0|2,0,0]=4 2976 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)Cl 270004a_106832991635_100013041588 [0,1,1,0,0,0|2,0,0]=4 2977 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)F 26a_100102657272_100000118610 [0,1,1,0,0,0|2,0,0]=4 2978 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)F 270004a_106832991635_100013120018 [0,1,1,0,0,0|2,0,0]=4 2979 B14R1.3213 CNCc1cc(cc(c1)C(=O)OC)I 270004a_106832991635_100010726508 [0,1,1,0,0,0|2,0,0]=4 2980 B14R1.3213 COC(=O)c1cc(cc(c1)CO[13CH3])Br 34a_100010232996_200025704644 [0,1,1,0,0,0|2,0,0]=4 2981 B14R1.3213 COC(=O)c1cc(cc(c1)CO[13CH3])Br 7a_100010232996_200025704644 [0,1,1,0,0,0|2,0,0]=4 2982 B14R1.3213 COC(=O)c1cc(cc(c1)CO[13CH3])Cl 34a_100010269335_200025704644 [0,1,1,0,0,0|2,0,0]=4 2983 B14R1.3213 COC(=O)c1cc(cc(c1)CO[13CH3])Cl 7a_100010269335_200025704644 [0,1,1,0,0,0|2,0,0]=4 2984 B14R1.3213 COC(=O)c1cc(cc(c1)CSC)Br 62a_100010233859_200000210301 [0,1,1,0,0,0|2,0,0]=4 2985 B14R1.3213 COC(=O)c1cc(cc(c1)CSC)Br 62a_200000210301_100010233859 [0,1,1,0,0,0|2,0,0]=4 2986 B14R1.3213 COC(=O)c1cc(cc(c1)CS[13CH3])Br 62a_100010233859_200025704644 [0,1,1,0,0,0|2,0,0]=4 2987 B14R1.3213 COC(=O)c1cc(cc(c1)CS[13CH3])Br 62a_200025704644_100010233859 [0,1,1,0,0,0|2,0,0]=4 2988 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)Br 34a_100000696291_100015361967 [0,1,1,0,0,0|2,0,0]=4 2989 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)Br 7a_100000696291_100015361967 [0,1,1,0,0,0|2,0,0]=4 2990 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)Cl 34a_100009870047_100015361967 [0,1,1,0,0,0|2,0,0]=4 2991 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)Cl 7a_100009870047_100015361967 [0,1,1,0,0,0|2,0,0]=4 2992 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)F 34a_100000118610_100015361967 [0,1,1,0,0,0|2,0,0]=4 2993 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)F 7a_100000118610_100015361967 [0,1,1,0,0,0|2,0,0]=4 2994 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)N 34a_100000069914_100015361967 [0,1,1,0,0,0|2,0,0]=4 2995 B14R1.3213 COC(=O)c1cc(cc(c1)OCF)N 7a_100000069914_100015361967 [0,1,1,0,0,0|2,0,0]=4 2996 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)Br 62a_100012339729_100015361967 [0,1,1,0,0,0|2,0,0]=4 2997 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)Br 62a_100015361967_100012339729 [0,1,1,0,0,0|2,0,0]=4 2998 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)C 62a_100012359405_100015361967 [0,1,1,0,0,0|2,0,0]=4 2999 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)C 62a_100015361967_100012359405 [0,1,1,0,0,0|2,0,0]=4 3000 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)Cl 62a_100000695173_100015361967 [0,1,1,0,0,0|2,0,0]=4 3001 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)Cl 62a_100015361967_100000695173 [0,1,1,0,0,0|2,0,0]=4 3002 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)F 62a_100000698578_100015361967 [0,1,1,0,0,0|2,0,0]=4 3003 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)F 62a_100015361967_100000698578 [0,1,1,0,0,0|2,0,0]=4 3004 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)N 62a_100015361967_100138415615 [0,1,1,0,0,0|2,0,0]=4 3005 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)N 62a_100138415615_100015361967 [0,1,1,0,0,0|2,0,0]=4 3006 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)O 62a_100000696291_100015361967 [0,1,1,0,0,0|2,0,0]=4 3007 B14R1.3213 COC(=O)c1cc(cc(c1)SCF)O 62a_100015361967_100000696291 [0,1,1,0,0,0|2,0,0]=4 3008 B14R1.3213 COCc1cc(cc(c1)C(=O)OC)Br 34a_100010232996_200000210301 [0,1,1,0,0,0|2,0,0]=4 3009 B14R1.3213 COCc1cc(cc(c1)C(=O)OC)Br 34a_100138415774_100010233859 [0,1,1,0,0,0|2,0,0]=4 3010 B14R1.3213 COCc1cc(cc(c1)C(=O)OC)Br 7a_100010232996_200000210301 [0,1,1,0,0,0|2,0,0]=4 3011 B14R1.3213 COCc1cc(cc(c1)C(=O)OC)Cl 34a_100010269335_200000210301 [0,1,1,0,0,0|2,0,0]=4 3012 B14R1.3213 COCc1cc(cc(c1)C(=O)OC)Cl 7a_100010269335_200000210301 [0,1,1,0,0,0|2,0,0]=4 3013 B14R1.3326 CCNc1cccc(c1)C(=C(C)C)C 271570a_200000049429_100000738899 [0,1,1,0,0,0|2,0,0]=4 3014 B14R1.3326 CCNc1cccc(c1)C(=O)C(C)C 27a_100015525214_100011350656 [0,1,1,0,0,0|1,0,0]=3 3015 B14R1.3326 CCNc1cccc(c1)C(=O)N(C)C 34a_100000246196_100000210202 [0,1,1,0,0,0|1,0,0]=3 3016 B14R1.3326 CCNc1cccc(c1)C(=O)N(C)C 7a_100000246196_100000210202 [0,1,1,0,0,0|1,0,0]=3 3017 B14R1.3326 CCNc1ccnc(c1)C(=O)N(C)C 27a_100015525214_200000198538 [0,1,1,0,0,0|2,0,0]=4 3018 B14R1.3326 CCOc1cccc(c1)C(=O)C(C)C 1458a_100000216331_100000210206 [0,1,1,0,0,0|2,0,0]=4 3019 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C 11a_100102631434_100000216331 [0,1,1,0,0,0|2,0,0]=4 3020 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100000216331 [0,1,1,0,0,0|2,0,0]=4 3021 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100000216331 [0,1,1,0,0,0|2,0,0]=4 3022 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C 34a_100000159535_100000210202 [0,1,1,0,0,0|2,0,0]=4 3023 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C 527a_100102631434_100000216331 [0,1,1,0,0,0|2,0,0]=4 3024 B14R1.3326 CCOc1cccc(c1)C(=O)N(C)C 7a_100000159535_100000210202 [0,1,1,0,0,0|2,0,0]=4 3025 B14R1.3326 CCSc1cccc(c1)C(=O)C(C)C 62a_100000210202_100011350656 [0,1,1,0,0,0|2,0,0]=4 3026 B14R1.3326 CCSc1cccc(c1)C(=O)C(C)C 62a_100011350656_100000210202 [0,1,1,0,0,0|2,0,0]=4 3027 B14R1.3326 CCSc1cccc(c1)C(=O)N(C)C 62a_100000159571_100000210202 [0,1,1,0,0,0|2,0,0]=4 3028 B14R1.3326 CCSc1cccc(c1)C(=O)N(C)C 62a_100000210202_100000159571 [0,1,1,0,0,0|2,0,0]=4 3029 B14R1.3326 CN(C)C(=O)c1cccc(c1)NCF 34a_100000246196_100015361967 [0,1,1,0,0,0|2,0,0]=4 3030 B14R1.3326 CN(C)C(=O)c1cccc(c1)NCF 7a_100000246196_100015361967 [0,1,1,0,0,0|2,0,0]=4 3031 B14R1.6661 CCNc1cccc(c1)S(=O)(=O)NC 34a_100000738320_100000210202 [0,1,1,0,0,0|2,0,0]=4 3032 B14R1.6661 CCNc1cccc(c1)S(=O)(=O)NC 7a_100000738320_100000210202 [0,1,1,0,0,0|2,0,0]=4 3033 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)Br 271570a_100016259895_100012340073 [0,1,1,0,0,0|1,0,1]=4 3034 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)C 271570a_100016259895_100012360116 [0,1,1,0,0,0|1,0,1]=4 3035 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)Cl 271570a_100016259895_100012353682 [0,1,1,0,0,0|1,0,1]=4 3036 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)F 271570a_100016259895_100000154357 [0,1,1,0,0,0|1,0,1]=4 3037 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)N 271570a_100016259895_100000212070 [0,1,1,0,0,0|1,0,1]=4 3038 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)O 271570a_100016259895_100000149868 [0,1,1,0,0,0|1,0,1]=4 3039 B14R1.6795 CCNc1ccc(c(c1)C(=O)NC)Cl 2230a_100000742274_100000210202 [0,1,1,0,0,0|1,0,0]=3 3040 B14R1.6795 CCNc1ccc(c(c1)C(=O)NC)Cl 34a_100000742274_100000210202 [0,1,1,0,0,0|1,0,0]=3 3041 B14R1.6795 CCNc1ccc(c(c1)C(=O)NC)F 2230a_100000747870_100000210202 [0,1,1,0,0,0|1,0,0]=3 3042 B14R1.6795 CCNc1ccc(c(c1)C(=O)NC)F 34a_100000747870_100000210202 [0,1,1,0,0,0|1,0,0]=3 3043 B14R1.6795 CCNc1ccc(c(c1)C(=O)NC)F 7a_100000747870_100000210202 [0,1,1,0,0,0|1,0,0]=3 3044 B14R1.6795 CCNc1cnc(c(n1)C(=O)OC)C 27a_100015525214_100010884432 [0,1,1,0,0,0|2,0,0]=4 3045 B14R1.6795 CCOc1ccc(c(c1)C(=O)CC)O 1458a_200011255221_100000210202 [0,1,1,0,0,0|2,0,0]=4 3046 B14R1.6795 CCOc1ccc(c(c1)C(=O)NC)O 240690a_100102657272_200011255221 [0,1,1,0,0,0|2,0,0]=4 3047 B14R1.6795 CCOc1ccc(c(c1)C(=O)NC)O 527a_100102657272_200011255221 [0,1,1,0,0,0|2,0,0]=4 3048 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Br 34a_100010230369_100000210202 [0,1,1,0,0,0|1,0,0]=3 3049 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Br 7a_100010230369_100000210202 [0,1,1,0,0,0|1,0,0]=3 3050 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)C 34a_100012002527_100000210202 [0,1,1,0,0,0|1,0,0]=3 3051 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)C 7a_100012002527_100000210202 [0,1,1,0,0,0|1,0,0]=3 3052 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Cl 34a_100012001761_100000210202 [0,1,1,0,0,0|1,0,0]=3 3053 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Cl 7a_100012001761_100000210202 [0,1,1,0,0,0|1,0,0]=3 3054 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)F 34a_100009856154_100000210202 [0,1,1,0,0,0|1,0,0]=3 3055 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)F 7a_100009856154_100000210202 [0,1,1,0,0,0|1,0,0]=3 3056 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)I 34a_200009888904_100000210202 [0,1,1,0,0,0|1,0,0]=3 3057 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)I 7a_200009888904_100000210202 [0,1,1,0,0,0|1,0,0]=3 3058 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)N 34a_100000694981_100000210202 [0,1,1,0,0,0|1,0,0]=3 3059 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)N 7a_100000694981_100000210202 [0,1,1,0,0,0|1,0,0]=3 3060 B14R1.6795 CCSc1c[nH]c(=O)c(c1)C(=O)OC 62a_100000210202_100009816710 [0,1,1,0,0,0|2,0,0]=4 3061 B14R1.6795 CCSc1c[nH]c(=O)c(c1)C(=O)OC 62a_100009816710_100000210202 [0,1,1,0,0,0|2,0,0]=4 3062 B14R1.6795 CCSc1cc(c(cn1)C)C(=O)OC 62a_100000210202_100009858526 [0,1,1,0,0,0|2,0,0]=4 3063 B14R1.6795 CCSc1cc(c(cn1)C)C(=O)OC 62a_100009858526_100000210202 [0,1,1,0,0,0|2,0,0]=4 3064 B14R1.6795 CCSc1cc(c(cn1)F)C(=O)OC 62a_100000210202_100010218257 [0,1,1,0,0,0|2,0,0]=4 3065 B14R1.6795 CCSc1cc(c(cn1)F)C(=O)OC 62a_100010218257_100000210202 [0,1,1,0,0,0|2,0,0]=4 3066 B14R1.6795 CCSc1cc(c(cn1)N)C(=O)OC 62a_100000210202_100012180746 [0,1,1,0,0,0|2,0,0]=4 3067 B14R1.6795 CCSc1cc(c(cn1)N)C(=O)OC 62a_100012180746_100000210202 [0,1,1,0,0,0|2,0,0]=4 3068 B14R1.6795 CCSc1cc(c(cn1)O)C(=O)OC 62a_100000210202_100010136202 [0,1,1,0,0,0|2,0,0]=4 3069 B14R1.6795 CCSc1cc(c(cn1)O)C(=O)OC 62a_100010136202_100000210202 [0,1,1,0,0,0|2,0,0]=4 3070 B14R1.6795 CCSc1ccc(c(c1)C(=O)NC)F 62a_100000155058_100000210202 [0,1,1,0,0,0|2,0,0]=4 3071 B14R1.6795 CCSc1ccc(c(c1)C(=O)NC)F 62a_100000210202_100000155058 [0,1,1,0,0,0|2,0,0]=4 3072 B14R1.6795 CCSc1ccc(c(c1)C(=O)NC)N 62a_100000690504_100000210202 [0,1,1,0,0,0|2,0,0]=4 3073 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Br 62a_100000210202_100012340073 [0,1,1,0,0,0|1,0,0]=3 3074 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Br 62a_100012340073_100000210202 [0,1,1,0,0,0|1,0,0]=3 3075 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)C 62a_100000210202_100012360116 [0,1,1,0,0,0|1,0,0]=3 3076 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)C 62a_100012360116_100000210202 [0,1,1,0,0,0|1,0,0]=3 3077 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Cl 62a_100000210202_100012353682 [0,1,1,0,0,0|1,0,0]=3 3078 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Cl 62a_100012353682_100000210202 [0,1,1,0,0,0|1,0,0]=3 3079 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)F 62a_100000210202_100000216675 [0,1,1,0,0,0|1,0,0]=3 3080 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)F 62a_100000216675_100000210202 [0,1,1,0,0,0|1,0,0]=3 3081 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)N 62a_100000212070_100000210202 [0,1,1,0,0,0|1,0,0]=3 3082 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)O 62a_100000210202_100000149868 [0,1,1,0,0,0|1,0,0]=3 3083 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)C 62a_100000117997_100000210202 [0,1,1,0,0,0|2,0,0]=4 3084 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)C 62a_100000210202_100000117997 [0,1,1,0,0,0|2,0,0]=4 3085 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)F 62a_100000210202_100000697719 [0,1,1,0,0,0|2,0,0]=4 3086 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)F 62a_100000697719_100000210202 [0,1,1,0,0,0|2,0,0]=4 3087 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)N 62a_100009860768_100000210202 [0,1,1,0,0,0|2,0,0]=4 3088 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)O 62a_100000210202_100000697862 [0,1,1,0,0,0|2,0,0]=4 3089 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)C 62a_100000210202_100010180201 [0,1,1,0,0,0|2,0,0]=4 3090 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)C 62a_100010180201_100000210202 [0,1,1,0,0,0|2,0,0]=4 3091 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)Cl 62a_100000210202_100010171060 [0,1,1,0,0,0|2,0,0]=4 3092 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)F 62a_100000210202_100010243567 [0,1,1,0,0,0|2,0,0]=4 3093 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)F 62a_100010243567_100000210202 [0,1,1,0,0,0|2,0,0]=4 3094 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)N 62a_100000210202_100009816750 [0,1,1,0,0,0|2,0,0]=4 3095 B14R1.6795 CCSc1cnc(c(c1)C(=O)OC)N 62a_100009816750_100000210202 [0,1,1,0,0,0|2,0,0]=4 3096 B14R1.6795 CNC(=O)c1cc(ccc1Cl)NCF 34a_100000742274_100015361967 [0,1,1,0,0,0|2,0,0]=4 3097 B14R1.6795 CNC(=O)c1cc(ccc1F)NCF 34a_100000747870_100015361967 [0,1,1,0,0,0|2,0,0]=4 3098 B14R1.6795 CNC(=O)c1cc(ccc1F)NCF 7a_100000747870_100015361967 [0,1,1,0,0,0|2,0,0]=4 3099 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 2230a_106832991635_200012349814 [0,1,1,0,0,0|2,0,0]=4 3100 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 26a_100102657272_100010230369 [0,1,1,0,0,0|2,0,0]=4 3101 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 270004a_106832991635_100013328361 [0,1,1,0,0,0|2,0,0]=4 3102 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 34a_100102657272_200012349814 [0,1,1,0,0,0|2,0,0]=4 3103 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 7a_106832991635_200012349814 [0,1,1,0,0,0|2,0,0]=4 3104 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)C 270004a_106832991635_100010280812 [0,1,1,0,0,0|2,0,0]=4 3105 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 2230a_106832991635_100010269346 [0,1,1,0,0,0|2,0,0]=4 3106 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 270004a_106832991635_200010632534 [0,1,1,0,0,0|2,0,0]=4 3107 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 34a_100102657272_100010269346 [0,1,1,0,0,0|2,0,0]=4 3108 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 7a_106832991635_100010269346 [0,1,1,0,0,0|2,0,0]=4 3109 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 2230a_106832991635_200013328350 [0,1,1,0,0,0|2,0,0]=4 3110 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 270004a_106832991635_100012056738 [0,1,1,0,0,0|2,0,0]=4 3111 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 34a_100102657272_200013328350 [0,1,1,0,0,0|2,0,0]=4 3112 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 7a_106832991635_200013328350 [0,1,1,0,0,0|2,0,0]=4 3113 B14R1.6795 COC(=O)c1cc(ccc1Br)CSC 62a_200000210301_200012349814 [0,1,1,0,0,0|2,0,0]=4 3114 B14R1.6795 COC(=O)c1cc(ccc1Br)CSC 62a_200012349814_200000210301 [0,1,1,0,0,0|2,0,0]=4 3115 B14R1.6795 COC(=O)c1cc(ccc1Br)CS[13CH3] 62a_200012349814_200025704644 [0,1,1,0,0,0|2,0,0]=4 3116 B14R1.6795 COC(=O)c1cc(ccc1Br)CS[13CH3] 62a_200025704644_200012349814 [0,1,1,0,0,0|2,0,0]=4 3117 B14R1.6795 COC(=O)c1cc(ccc1Br)OCF 34a_100010230369_100015361967 [0,1,1,0,0,0|2,0,0]=4 3118 B14R1.6795 COC(=O)c1cc(ccc1Br)OCF 7a_100010230369_100015361967 [0,1,1,0,0,0|2,0,0]=4 3119 B14R1.6795 COC(=O)c1cc(ccc1Br)SCF 62a_100012340073_100015361967 [0,1,1,0,0,0|2,0,0]=4 3120 B14R1.6795 COC(=O)c1cc(ccc1Br)SCF 62a_100015361967_100012340073 [0,1,1,0,0,0|2,0,0]=4 3121 B14R1.6795 COC(=O)c1cc(ccc1C)OCF 34a_100012002527_100015361967 [0,1,1,0,0,0|2,0,0]=4 3122 B14R1.6795 COC(=O)c1cc(ccc1C)OCF 7a_100012002527_100015361967 [0,1,1,0,0,0|2,0,0]=4 3123 B14R1.6795 COC(=O)c1cc(ccc1C)SCF 62a_100012360116_100015361967 [0,1,1,0,0,0|2,0,0]=4 3124 B14R1.6795 COC(=O)c1cc(ccc1C)SCF 62a_100015361967_100012360116 [0,1,1,0,0,0|2,0,0]=4 3125 B14R1.6795 COC(=O)c1cc(ccc1Cl)CSC 62a_100010269346_200000210301 [0,1,1,0,0,0|2,0,0]=4 3126 B14R1.6795 COC(=O)c1cc(ccc1Cl)CSC 62a_200000210301_100010269346 [0,1,1,0,0,0|2,0,0]=4 3127 B14R1.6795 COC(=O)c1cc(ccc1Cl)CS[13CH3] 62a_100010269346_200025704644 [0,1,1,0,0,0|2,0,0]=4 3128 B14R1.6795 COC(=O)c1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100010269346 [0,1,1,0,0,0|2,0,0]=4 3129 B14R1.6795 COC(=O)c1cc(ccc1Cl)OCF 34a_100012001761_100015361967 [0,1,1,0,0,0|2,0,0]=4 3130 B14R1.6795 COC(=O)c1cc(ccc1Cl)OCF 7a_100012001761_100015361967 [0,1,1,0,0,0|2,0,0]=4 3131 B14R1.6795 COC(=O)c1cc(ccc1Cl)SCF 62a_100012353682_100015361967 [0,1,1,0,0,0|2,0,0]=4 3132 B14R1.6795 COC(=O)c1cc(ccc1Cl)SCF 62a_100015361967_100012353682 [0,1,1,0,0,0|2,0,0]=4 3133 B14R1.6795 COC(=O)c1cc(ccc1F)CO[13CH3] 34a_100009832128_200025704644 [0,1,1,0,0,0|2,0,0]=4 3134 B14R1.6795 COC(=O)c1cc(ccc1F)CO[13CH3] 7a_100009832128_200025704644 [0,1,1,0,0,0|2,0,0]=4 3135 B14R1.6795 COC(=O)c1cc(ccc1F)CSC 62a_200000210301_200013328350 [0,1,1,0,0,0|2,0,0]=4 3136 B14R1.6795 COC(=O)c1cc(ccc1F)CSC 62a_200013328350_200000210301 [0,1,1,0,0,0|2,0,0]=4 3137 B14R1.6795 COC(=O)c1cc(ccc1F)CS[13CH3] 62a_200013328350_200025704644 [0,1,1,0,0,0|2,0,0]=4 3138 B14R1.6795 COC(=O)c1cc(ccc1F)CS[13CH3] 62a_200025704644_200013328350 [0,1,1,0,0,0|2,0,0]=4 3139 B14R1.6795 COC(=O)c1cc(ccc1F)OCF 34a_100009856154_100015361967 [0,1,1,0,0,0|2,0,0]=4 3140 B14R1.6795 COC(=O)c1cc(ccc1F)OCF 7a_100009856154_100015361967 [0,1,1,0,0,0|2,0,0]=4 3141 B14R1.6795 COC(=O)c1cc(ccc1F)SCF 62a_100000216675_100015361967 [0,1,1,0,0,0|2,0,0]=4 3142 B14R1.6795 COC(=O)c1cc(ccc1F)SCF 62a_100015361967_100000216675 [0,1,1,0,0,0|2,0,0]=4 3143 B14R1.6795 COC(=O)c1cc(ccc1I)OCF 34a_200009888904_100015361967 [0,1,1,0,0,0|2,0,0]=4 3144 B14R1.6795 COC(=O)c1cc(ccc1I)OCF 7a_200009888904_100015361967 [0,1,1,0,0,0|2,0,0]=4 3145 B14R1.6795 COC(=O)c1cc(ccc1N)OCF 34a_100000694981_100015361967 [0,1,1,0,0,0|2,0,0]=4 3146 B14R1.6795 COC(=O)c1cc(ccc1N)OCF 7a_100000694981_100015361967 [0,1,1,0,0,0|2,0,0]=4 3147 B14R1.6795 COC(=O)c1cc(ccc1N)SCF 62a_100000212070_100015361967 [0,1,1,0,0,0|2,0,0]=4 3148 B14R1.6795 COC(=O)c1cc(ccc1O)SCF 62a_100015361967_100000149868 [0,1,1,0,0,0|2,0,0]=4 3149 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)Br 34a_100138415774_200012349814 [0,1,1,0,0,0|2,0,0]=4 3150 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)Cl 34a_100138415774_100010269346 [0,1,1,0,0,0|2,0,0]=4 3151 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)F 34a_100009832128_200000210301 [0,1,1,0,0,0|2,0,0]=4 3152 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)F 34a_100138415774_200013328350 [0,1,1,0,0,0|2,0,0]=4 3153 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)F 7a_100009832128_200000210301 [0,1,1,0,0,0|2,0,0]=4 3154 B14R1.628 C=Cc1ccc(cc1N)C(=O)OCC 271570a_100011290941_200011450955 [0,1,1,0,0,0|0,0,2]=4 3155 B14R1.628 CCCC(=O)c1ccc(c(c1)Br)CC 1458a_100012340589_100000210303 [0,1,1,0,0,0|2,0,0]=4 3156 B14R1.628 CCCC(=O)c1ccc(c(c1)O)CC 1458a_100000089006_100000210303 [0,1,1,0,0,0|2,0,0]=4 3157 B14R1.628 CCNC(=O)c1ccc(c(c1)Br)CC 11a_100015525214_100012340589 [0,1,1,0,0,0|2,0,0]=4 3158 B14R1.628 CCNC(=O)c1ccc(c(c1)Br)CC 240690a_100015525214_100012340589 [0,1,1,0,0,0|2,0,0]=4 3159 B14R1.628 CCNC(=O)c1ccc(c(c1)Br)CC 527a_100015525214_100012340589 [0,1,1,0,0,0|2,0,0]=4 3160 B14R1.628 CCNC(=O)c1ccc(c(c1)O)CC 240690a_100015525214_100000089006 [0,1,1,0,0,0|2,0,0]=4 3161 B14R1.628 CCNC(=O)c1ccc(c(c1)O)CC 527a_100015525214_100000089006 [0,1,1,0,0,0|2,0,0]=4 3162 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)OC 7a_100009812659_200000210301 [0,1,1,0,0,0|2,0,0]=4 3163 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)O[13CH3] 7a_100009812659_200025704644 [0,1,1,0,0,0|2,0,0]=4 3164 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)SC 62a_100011294787_200000210301 [0,1,1,0,0,0|2,0,0]=4 3165 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)SC 62a_200000210301_100011294787 [0,1,1,0,0,0|2,0,0]=4 3166 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_100011294787_200025704644 [0,1,1,0,0,0|2,0,0]=4 3167 B14R1.628 CCOC(=O)c1ccc(c(c1)Br)S[13CH3] 62a_200025704644_100011294787 [0,1,1,0,0,0|2,0,0]=4 3168 B14R1.628 CCOC(=O)c1ccc(c(c1)C)SC 62a_100012229600_200000210301 [0,1,1,0,0,0|2,0,0]=4 3169 B14R1.628 CCOC(=O)c1ccc(c(c1)C)SC 62a_200000210301_100012229600 [0,1,1,0,0,0|2,0,0]=4 3170 B14R1.628 CCOC(=O)c1ccc(c(c1)C)S[13CH3] 62a_100012229600_200025704644 [0,1,1,0,0,0|2,0,0]=4 3171 B14R1.628 CCOC(=O)c1ccc(c(c1)C)S[13CH3] 62a_200025704644_100012229600 [0,1,1,0,0,0|2,0,0]=4 3172 B14R1.628 CCOC(=O)c1ccc(c(c1)Cl)SC 62a_200000210301_200012351148 [0,1,1,0,0,0|2,0,0]=4 3173 B14R1.628 CCOC(=O)c1ccc(c(c1)Cl)SC 62a_200012351148_200000210301 [0,1,1,0,0,0|2,0,0]=4 3174 B14R1.628 CCOC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_200012351148_200025704644 [0,1,1,0,0,0|2,0,0]=4 3175 B14R1.628 CCOC(=O)c1ccc(c(c1)Cl)S[13CH3] 62a_200025704644_200012351148 [0,1,1,0,0,0|2,0,0]=4 3176 B14R1.628 CCOC(=O)c1ccc(c(c1)F)OC 34a_200000082637_200000210301 [0,1,1,0,0,0|2,0,0]=4 3177 B14R1.628 CCOC(=O)c1ccc(c(c1)F)OC 7a_200000082637_200000210301 [0,1,1,0,0,0|2,0,0]=4 3178 B14R1.628 CCOC(=O)c1ccc(c(c1)F)O[13CH3] 34a_200000082637_200025704644 [0,1,1,0,0,0|2,0,0]=4 3179 B14R1.628 CCOC(=O)c1ccc(c(c1)F)O[13CH3] 7a_200000082637_200025704644 [0,1,1,0,0,0|2,0,0]=4 3180 B14R1.628 CCOC(=O)c1ccc(c(c1)F)SC 62a_100011533738_200000210301 [0,1,1,0,0,0|2,0,0]=4 3181 B14R1.628 CCOC(=O)c1ccc(c(c1)F)SC 62a_200000210301_100011533738 [0,1,1,0,0,0|2,0,0]=4 3182 B14R1.628 CCOC(=O)c1ccc(c(c1)F)S[13CH3] 62a_100011533738_200025704644 [0,1,1,0,0,0|2,0,0]=4 3183 B14R1.628 CCOC(=O)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011533738 [0,1,1,0,0,0|2,0,0]=4 3184 B14R1.628 CCOC(=O)c1ccc(c(c1)I)OC 7a_200010236255_200000210301 [0,1,1,0,0,0|2,0,0]=4 3185 B14R1.628 CCOC(=O)c1ccc(c(c1)I)O[13CH3] 7a_200010236255_200025704644 [0,1,1,0,0,0|2,0,0]=4 3186 B14R1.628 CCOC(=O)c1ccc(c(c1)N)OC 7a_100011450745_200000210301 [0,1,1,0,0,0|1,0,0]=3 3187 B14R1.628 CCOC(=O)c1ccc(c(c1)N)O[13CH3] 7a_100011450745_200025704644 [0,1,1,0,0,0|1,0,0]=3 3188 B14R1.628 CCOC(=O)c1ccc(c(c1)N)SC 62a_200000210301_200011450955 [0,1,1,0,0,0|1,0,0]=3 3189 B14R1.628 CCOC(=O)c1ccc(c(c1)N)SC 62a_200011450955_200000210301 [0,1,1,0,0,0|1,0,0]=3 3190 B14R1.628 CCOC(=O)c1ccc(c(c1)N)S[13CH3] 62a_200011450955_200025704644 [0,1,1,0,0,0|1,0,0]=3 3191 B14R1.628 CCOC(=O)c1ccc(c(c1)N)S[13CH3] 62a_200025704644_200011450955 [0,1,1,0,0,0|1,0,0]=3 3192 B14R1.628 CCOC(=O)c1ccc(c(c1)O)CC 271570a_203496583355_200012360145 [0,1,1,0,0,0|1,0,0]=3 3193 B14R1.628 CCOC(=O)c1ccc(c(c1)O)OC 271570a_203496583355_100012360133 [0,1,1,0,0,0|2,0,0]=4 3194 B14R1.628 CCOC(=O)c1ccc(c(c1)O)SC 62a_200000210301_100012355281 [0,1,1,0,0,0|2,0,0]=4 3195 B14R1.628 CCOC(=O)c1ccc(c(c1)O)S[13CH3] 62a_200025704644_100012355281 [0,1,1,0,0,0|2,0,0]=4 3196 B14R1.628 CCc1ccc(cc1Br)C(=O)CCF 1458a_100012340589_100011217306 [0,1,1,0,0,0|2,0,0]=4 3197 B14R1.628 CCc1ccc(cc1Br)C(=O)CCO 1458a_100012340589_100000211926 [0,1,1,0,0,0|2,0,0]=4 3198 B14R1.628 CCc1ccc(cc1Br)C(=O)NNC 22a_100016993582_100012340589 [0,1,1,0,0,0|2,0,0]=4 3199 B14R1.628 CCc1ccc(cc1O)C(=O)CCF 1458a_100000089006_100011217306 [0,1,1,0,0,0|2,0,0]=4 3200 B14R1.628 CCc1ccc(cc1O)C(=O)CCO 1458a_100000089006_100000211926 [0,1,1,0,0,0|2,0,0]=4 3201 B14R1.628 CCc1ccc(cc1O)C(=O)NNC 22a_100016993582_100000089006 [0,1,1,0,0,0|2,0,0]=4 3202 B14R1.628 COCC(=O)c1ccc(c(c1)Br)OC 34a_100138415774_100011262385 [0,1,1,0,0,0|2,0,0]=4 3203 B14R1.628 COCC(=O)c1ccc(c(c1)F)OC 34a_100138415774_100000195436 [0,1,1,0,0,0|2,0,0]=4 3204 B14R1.747 C=C(C)c1ccc(cc1Br)C(=O)OC 271570a_100000694244_100011294788 [0,1,1,0,0,0|1,0,1]=4 3205 B14R1.747 C=C(C)c1ccc(cc1C)C(=O)OC 271570a_100000694244_100011215878 [0,1,1,0,0,0|1,0,1]=4 3206 B14R1.747 C=C(C)c1ccc(cc1Cl)C(=O)OC 271570a_100000694244_100012356344 [0,1,1,0,0,0|1,0,1]=4 3207 B14R1.747 C=C(C)c1ccc(cc1F)C(=O)OC 271570a_100000694244_100000703229 [0,1,1,0,0,0|1,0,1]=4 3208 B14R1.747 C=C(C)c1ccc(cc1N)C(=O)OC 271570a_100000694244_100011450966 [0,1,1,0,0,0|0,0,1]=3 3209 B14R1.747 C=C(C)c1ccc(cc1O)C(=O)OC 271570a_100000694244_100012350776 [0,1,1,0,0,0|1,0,1]=4 3210 B14R1.747 C=C(C)c1ccc(nc1N)C(=O)OC 271570a_100000694244_100010187631 [0,1,1,0,0,0|1,0,1]=4 3211 B14R1.747 C=C(C)c1cnc(cc1N)C(=O)OC 271570a_100000694244_100016001589 [0,1,1,0,0,0|1,0,1]=4 3212 B14R1.747 C=C(C)c1ncc(cc1N)C(=O)OC 271570a_100000694244_100000079130 [0,1,1,0,0,0|1,0,1]=4 3213 B14R1.747 CCC(=O)c1ccc(c(c1)Br)C(C)C 1458a_100010235942_100000210202 [0,1,1,0,0,0|2,0,0]=4 3214 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 11a_106832991635_100010235942 [0,1,1,0,0,0|2,0,0]=4 3215 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 1626a_100102657272_100010235942 [0,1,1,0,0,0|2,0,0]=4 3216 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 240690a_100102657272_100010235942 [0,1,1,0,0,0|2,0,0]=4 3217 B14R1.747 CNC(=O)c1ccc(c(c1)Br)C(C)C 527a_100102657272_100010235942 [0,1,1,0,0,0|2,0,0]=4 3218 B14R1.747 COC(=O)c1ccc(c(c1)Br)C(=O)C 1458a_200010202026_200000210301 [0,1,1,0,0,0|1,0,1]=4 3219 B14R1.747 COC(=O)c1ccc(c(c1)Br)C(=O)[13CH3] 1458a_200010202026_200025704644 [0,1,1,0,0,0|1,0,1]=4 3220 B14R1.747 COC(=O)c1ccc(c(c1)Cl)C(=O)C 1458a_100010291778_200000210301 [0,1,1,0,0,0|1,0,1]=4 3221 B14R1.747 COC(=O)c1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100010291778_200025704644 [0,1,1,0,0,0|1,0,1]=4 3222 B14R1.747 COC(=O)c1ccc(c(c1)F)C(=O)C 1458a_100000703384_200000210301 [0,1,1,0,0,0|1,0,1]=4 3223 B14R1.747 COC(=O)c1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000703384_200025704644 [0,1,1,0,0,0|1,0,1]=4 3224 B14R1.747 COC(=O)c1ccc(c(c1)O)C(=O)C 1458a_100000101776_200000210301 [0,1,1,0,0,0|1,0,1]=4 3225 B14R1.747 COC(=O)c1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000101776_200025704644 [0,1,1,0,0,0|1,0,1]=4 3226 B14R1.747 COC(=O)c1ccc(c(c1)O)C(C)C 271570a_203496583355_200010236285 [0,1,1,0,0,0|1,0,0]=3 3227 B14R1.747 COC(=O)c1cnc(c(c1)N)N(C)C 27a_100102631434_100000079130 [0,1,1,0,0,0|2,0,0]=4 3228 B14R1.2294 C=Cc1cc(c(cc1N)C(=O)OC)F 271570a_100011290941_100000760059 [0,1,1,0,0,0|0,0,2]=4 3229 B14R1.2294 COC(=O)c1cc(c(cc1C)OC)O 271570a_203496583355_100010236281 [0,1,1,0,0,0|2,0,0]=4 3230 B14R1.2294 COC(=O)c1cc(c(cc1C)SC)F 62a_100010291504_200000210301 [0,1,1,0,0,0|2,0,0]=4 3231 B14R1.2294 COC(=O)c1cc(c(cc1C)SC)F 62a_200000210301_100010291504 [0,1,1,0,0,0|2,0,0]=4 3232 B14R1.2294 COC(=O)c1cc(c(cc1C)S[13CH3])F 62a_100010291504_200025704644 [0,1,1,0,0,0|2,0,0]=4 3233 B14R1.2294 COC(=O)c1cc(c(cc1C)S[13CH3])F 62a_200025704644_100010291504 [0,1,1,0,0,0|2,0,0]=4 3234 B14R1.2294 COC(=O)c1cc(c(cc1F)OC)Cl 34a_100010366841_200000210301 [0,1,1,0,0,0|2,0,0]=4 3235 B14R1.2294 COC(=O)c1cc(c(cc1F)OC)Cl 7a_100010366841_200000210301 [0,1,1,0,0,0|2,0,0]=4 3236 B14R1.2294 COC(=O)c1cc(c(cc1F)OC)O 271570a_203496583355_100015648668 [0,1,1,0,0,0|2,0,0]=4 3237 B14R1.2294 COC(=O)c1cc(c(cc1F)O[13CH3])Cl 34a_100010366841_200025704644 [0,1,1,0,0,0|2,0,0]=4 3238 B14R1.2294 COC(=O)c1cc(c(cc1F)O[13CH3])Cl 7a_100010366841_200025704644 [0,1,1,0,0,0|2,0,0]=4 3239 B14R1.2294 COC(=O)c1cc(c(cc1F)SC)F 62a_100010769226_200000210301 [0,1,1,0,0,0|2,0,0]=4 3240 B14R1.2294 COC(=O)c1cc(c(cc1F)SC)F 62a_200000210301_100010769226 [0,1,1,0,0,0|2,0,0]=4 3241 B14R1.2294 COC(=O)c1cc(c(cc1F)SC)N 62a_100000760059_200000210301 [0,1,1,0,0,0|1,0,0]=3 3242 B14R1.2294 COC(=O)c1cc(c(cc1F)S[13CH3])F 62a_100010769226_200025704644 [0,1,1,0,0,0|2,0,0]=4 3243 B14R1.2294 COC(=O)c1cc(c(cc1F)S[13CH3])F 62a_200025704644_100010769226 [0,1,1,0,0,0|2,0,0]=4 3244 B14R1.2294 COC(=O)c1cc(c(cc1F)S[13CH3])N 62a_100000760059_200025704644 [0,1,1,0,0,0|1,0,0]=3 3245 B14R1.2294 COC(=O)c1cc(c(cc1N)OC)O 271570a_203496583355_100000730826 [0,1,1,0,0,0|2,0,0]=4 3246 B14R1.2294 COC(=O)c1cc(c(cc1N)SC)F 62a_100000724440_200000210301 [0,1,1,0,0,0|2,0,0]=4 3247 B14R1.2294 COC(=O)c1cc(c(cc1N)S[13CH3])F 62a_100000724440_200025704644 [0,1,1,0,0,0|2,0,0]=4 3248 B14R1.2294 COC(=O)c1cc(c(cc1O)OC)O 271570a_203496583355_200010007936 [0,1,1,0,0,0|2,0,0]=4 3249 B14R1.2294 COC(=O)c1cc(c(cc1O)SC)F 62a_100010760826_200000210301 [0,1,1,0,0,0|2,0,0]=4 3250 B14R1.2294 COC(=O)c1cc(c(cc1O)SC)F 62a_200000210301_100010760826 [0,1,1,0,0,0|2,0,0]=4 3251 B14R1.2294 COC(=O)c1cc(c(cc1O)S[13CH3])F 62a_100010760826_200025704644 [0,1,1,0,0,0|2,0,0]=4 3252 B14R1.2294 COC(=O)c1cc(c(cc1O)S[13CH3])F 62a_200025704644_100010760826 [0,1,1,0,0,0|2,0,0]=4 3253 B14R1.2316 COC(=O)c1ccc(c(c1C)C)SC 62a_100010761469_200000210301 [0,1,1,0,0,0|2,0,0]=4 3254 B14R1.2316 COC(=O)c1ccc(c(c1C)C)SC 62a_200000210301_100010761469 [0,1,1,0,0,0|2,0,0]=4 3255 B14R1.2316 COC(=O)c1ccc(c(c1C)C)S[13CH3] 62a_100010761469_200025704644 [0,1,1,0,0,0|2,0,0]=4 3256 B14R1.2316 COC(=O)c1ccc(c(c1C)C)S[13CH3] 62a_200025704644_100010761469 [0,1,1,0,0,0|2,0,0]=4 3257 B14R1.2316 COC(=O)c1ccc(c(c1C)F)SC 62a_100010291505_200000210301 [0,1,1,0,0,0|2,0,0]=4 3258 B14R1.2316 COC(=O)c1ccc(c(c1C)F)SC 62a_200000210301_100010291505 [0,1,1,0,0,0|2,0,0]=4 3259 B14R1.2316 COC(=O)c1ccc(c(c1C)F)S[13CH3] 62a_100010291505_200025704644 [0,1,1,0,0,0|2,0,0]=4 3260 B14R1.2316 COC(=O)c1ccc(c(c1C)F)S[13CH3] 62a_200025704644_100010291505 [0,1,1,0,0,0|2,0,0]=4 3261 B14R1.2316 COC(=O)c1ccc(c(c1C)O)OC 271570a_203496583355_100010761468 [0,1,1,0,0,0|2,0,0]=4 3262 B14R1.2316 COC(=O)c1ccc(c(c1C)O)SC 62a_100010889012_200000210301 [0,1,1,0,0,0|2,0,0]=4 3263 B14R1.2316 COC(=O)c1ccc(c(c1C)O)SC 62a_200000210301_100010889012 [0,1,1,0,0,0|2,0,0]=4 3264 B14R1.2316 COC(=O)c1ccc(c(c1C)O)S[13CH3] 62a_100010889012_200025704644 [0,1,1,0,0,0|2,0,0]=4 3265 B14R1.2316 COC(=O)c1ccc(c(c1C)O)S[13CH3] 62a_200025704644_100010889012 [0,1,1,0,0,0|2,0,0]=4 3266 B14R1.2316 COC(=O)c1ccc(c(c1F)C)SC 62a_100010172522_200000210301 [0,1,1,0,0,0|2,0,0]=4 3267 B14R1.2316 COC(=O)c1ccc(c(c1F)C)SC 62a_200000210301_100010172522 [0,1,1,0,0,0|2,0,0]=4 3268 B14R1.2316 COC(=O)c1ccc(c(c1F)C)S[13CH3] 62a_100010172522_200025704644 [0,1,1,0,0,0|2,0,0]=4 3269 B14R1.2316 COC(=O)c1ccc(c(c1F)C)S[13CH3] 62a_200025704644_100010172522 [0,1,1,0,0,0|2,0,0]=4 3270 B14R1.2316 COC(=O)c1ccc(c(c1F)F)OC 34a_100000101000_200000210301 [0,1,1,0,0,0|2,0,0]=4 3271 B14R1.2316 COC(=O)c1ccc(c(c1F)F)OC 7a_100000101000_200000210301 [0,1,1,0,0,0|2,0,0]=4 3272 B14R1.2316 COC(=O)c1ccc(c(c1F)F)O[13CH3] 34a_100000101000_200025704644 [0,1,1,0,0,0|2,0,0]=4 3273 B14R1.2316 COC(=O)c1ccc(c(c1F)F)O[13CH3] 7a_100000101000_200025704644 [0,1,1,0,0,0|2,0,0]=4 3274 B14R1.2316 COC(=O)c1ccc(c(c1F)F)SC 62a_100010982024_200000210301 [0,1,1,0,0,0|2,0,0]=4 3275 B14R1.2316 COC(=O)c1ccc(c(c1F)F)SC 62a_200000210301_100010982024 [0,1,1,0,0,0|2,0,0]=4 3276 B14R1.2316 COC(=O)c1ccc(c(c1F)F)S[13CH3] 62a_100010982024_200025704644 [0,1,1,0,0,0|2,0,0]=4 3277 B14R1.2316 COC(=O)c1ccc(c(c1F)F)S[13CH3] 62a_200025704644_100010982024 [0,1,1,0,0,0|2,0,0]=4 3278 B14R1.2316 COC(=O)c1ccc(c(c1F)O)SC 62a_100011096176_200000210301 [0,1,1,0,0,0|2,0,0]=4 3279 B14R1.2316 COC(=O)c1ccc(c(c1F)O)SC 62a_200000210301_100011096176 [0,1,1,0,0,0|2,0,0]=4 3280 B14R1.2316 COC(=O)c1ccc(c(c1F)O)S[13CH3] 62a_100011096176_200025704644 [0,1,1,0,0,0|2,0,0]=4 3281 B14R1.2316 COC(=O)c1ccc(c(c1F)O)S[13CH3] 62a_200025704644_100011096176 [0,1,1,0,0,0|2,0,0]=4 3282 B14R1.2316 COC(=O)c1ccc(c(c1N)C)SC 62a_100000764893_200000210301 [0,1,1,0,0,0|2,0,0]=4 3283 B14R1.2316 COC(=O)c1ccc(c(c1N)C)S[13CH3] 62a_100000764893_200025704644 [0,1,1,0,0,0|2,0,0]=4 3284 B14R1.2316 COC(=O)c1ccc(c(c1N)F)SC 62a_100022009169_200000210301 [0,1,1,0,0,0|2,0,0]=4 3285 B14R1.2316 COC(=O)c1ccc(c(c1N)F)S[13CH3] 62a_100022009169_200025704644 [0,1,1,0,0,0|2,0,0]=4 3286 B14R1.3652 CCc1ccc(cc1Br)C(=O)C(C)C 1458a_100012340589_100000210206 [0,1,1,0,0,0|2,0,0]=4 3287 B14R1.3652 CCc1ccc(cc1Br)C(=O)N(C)C 11a_100102631434_100012340589 [0,1,1,0,0,0|2,0,0]=4 3288 B14R1.3652 CCc1ccc(cc1Br)C(=O)N(C)C 1626a_100102631434_100012340589 [0,1,1,0,0,0|2,0,0]=4 3289 B14R1.3652 CCc1ccc(cc1Br)C(=O)N(C)C 240690a_100102631434_100012340589 [0,1,1,0,0,0|2,0,0]=4 3290 B14R1.3652 CCc1ccc(cc1Br)C(=O)N(C)C 527a_100102631434_100012340589 [0,1,1,0,0,0|2,0,0]=4 3291 B14R1.3652 CCc1ccc(cc1N)C(=C(C)C)C 271570a_200000049429_100012354963 [0,1,1,0,0,0|2,0,0]=4 3292 B14R1.3652 CCc1ccc(cc1O)C(=O)C(C)C 1458a_100000089006_100000210206 [0,1,1,0,0,0|2,0,0]=4 3293 B14R1.3652 CCc1ccc(cc1O)C(=O)N(C)C 240690a_100102631434_100000089006 [0,1,1,0,0,0|2,0,0]=4 3294 B14R1.3652 CCc1ccc(cc1O)C(=O)N(C)C 527a_100102631434_100000089006 [0,1,1,0,0,0|2,0,0]=4 3295 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Br 34a_100009813172_200000210301 [0,1,1,0,0,0|2,0,0]=4 3296 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Br 7a_100009813172_200000210301 [0,1,1,0,0,0|2,0,0]=4 3297 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Cl 34a_100010873366_200000210301 [0,1,1,0,0,0|2,0,0]=4 3298 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)Cl 7a_100010873366_200000210301 [0,1,1,0,0,0|2,0,0]=4 3299 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)N 34a_100010372079_200000210301 [0,1,1,0,0,0|1,0,0]=3 3300 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)OC)N 7a_100010372079_200000210301 [0,1,1,0,0,0|1,0,0]=3 3301 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Br 34a_100009813172_200025704644 [0,1,1,0,0,0|2,0,0]=4 3302 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Br 7a_100009813172_200025704644 [0,1,1,0,0,0|2,0,0]=4 3303 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Cl 34a_100010873366_200025704644 [0,1,1,0,0,0|2,0,0]=4 3304 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])Cl 7a_100010873366_200025704644 [0,1,1,0,0,0|2,0,0]=4 3305 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])N 34a_100010372079_200025704644 [0,1,1,0,0,0|1,0,0]=3 3306 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)O[13CH3])N 7a_100010372079_200025704644 [0,1,1,0,0,0|1,0,0]=3 3307 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)SC)Cl 62a_100012361296_200000210301 [0,1,1,0,0,0|2,0,0]=4 3308 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)SC)Cl 62a_200000210301_100012361296 [0,1,1,0,0,0|2,0,0]=4 3309 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)S[13CH3])Cl 62a_100012361296_200025704644 [0,1,1,0,0,0|2,0,0]=4 3310 B14R1.12512 COC(=O)c1cc(c(c(c1)Br)S[13CH3])Cl 62a_200025704644_100012361296 [0,1,1,0,0,0|2,0,0]=4 3311 B14R1.12512 COC(=O)c1cc(c(c(c1)C)SC)C 62a_100010209423_200000210301 [0,1,1,0,0,0|2,0,0]=4 3312 B14R1.12512 COC(=O)c1cc(c(c(c1)C)SC)C 62a_200000210301_100010209423 [0,1,1,0,0,0|2,0,0]=4 3313 B14R1.12512 COC(=O)c1cc(c(c(c1)C)S[13CH3])C 62a_100010209423_200025704644 [0,1,1,0,0,0|2,0,0]=4 3314 B14R1.12512 COC(=O)c1cc(c(c(c1)C)S[13CH3])C 62a_200025704644_100010209423 [0,1,1,0,0,0|2,0,0]=4 3315 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)Cl 34a_100000148585_200000210301 [0,1,1,0,0,0|2,0,0]=4 3316 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)Cl 7a_100000148585_200000210301 [0,1,1,0,0,0|2,0,0]=4 3317 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)N 34a_100010571316_200000210301 [0,1,1,0,0,0|1,0,0]=3 3318 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)OC)N 7a_100010571316_200000210301 [0,1,1,0,0,0|1,0,0]=3 3319 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])Cl 34a_100000148585_200025704644 [0,1,1,0,0,0|2,0,0]=4 3320 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])Cl 7a_100000148585_200025704644 [0,1,1,0,0,0|2,0,0]=4 3321 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])N 34a_100010571316_200025704644 [0,1,1,0,0,0|1,0,0]=3 3322 B14R1.12512 COC(=O)c1cc(c(c(c1)Cl)O[13CH3])N 7a_100010571316_200025704644 [0,1,1,0,0,0|1,0,0]=3 3323 B14R1.12512 COC(=O)c1cc(c(c(c1)F)OC)F 34a_100009871777_200000210301 [0,1,1,0,0,0|2,0,0]=4 3324 B14R1.12512 COC(=O)c1cc(c(c(c1)F)OC)F 7a_100009871777_200000210301 [0,1,1,0,0,0|2,0,0]=4 3325 B14R1.12512 COC(=O)c1cc(c(c(c1)F)O[13CH3])F 34a_100009871777_200025704644 [0,1,1,0,0,0|2,0,0]=4 3326 B14R1.12512 COC(=O)c1cc(c(c(c1)F)O[13CH3])F 7a_100009871777_200025704644 [0,1,1,0,0,0|2,0,0]=4 3327 B14R1.12512 COC(=O)c1cc(c(c(c1)F)SC)F 62a_200000210301_200010155432 [0,1,1,0,0,0|2,0,0]=4 3328 B14R1.12512 COC(=O)c1cc(c(c(c1)F)SC)F 62a_200010155432_200000210301 [0,1,1,0,0,0|2,0,0]=4 3329 B14R1.12512 COC(=O)c1cc(c(c(c1)F)S[13CH3])F 62a_200010155432_200025704644 [0,1,1,0,0,0|2,0,0]=4 3330 B14R1.12512 COC(=O)c1cc(c(c(c1)F)S[13CH3])F 62a_200025704644_200010155432 [0,1,1,0,0,0|2,0,0]=4 3331 B14R1.12512 COC(=O)c1cc(c(c(c1)I)OC)Cl 34a_100135280131_200000210301 [0,1,1,0,0,0|2,0,0]=4 3332 B14R1.12512 COC(=O)c1cc(c(c(c1)I)OC)Cl 7a_100135280131_200000210301 [0,1,1,0,0,0|2,0,0]=4 3333 B14R1.12512 COC(=O)c1cc(c(c(c1)I)OC)I 7a_100010007818_200000210301 [0,1,1,0,0,0|2,0,0]=4 3334 B14R1.12512 COC(=O)c1cc(c(c(c1)I)O[13CH3])Cl 34a_100135280131_200025704644 [0,1,1,0,0,0|2,0,0]=4 3335 B14R1.12512 COC(=O)c1cc(c(c(c1)I)O[13CH3])Cl 7a_100135280131_200025704644 [0,1,1,0,0,0|2,0,0]=4 3336 B14R1.12512 COC(=O)c1cc(c(c(c1)I)O[13CH3])I 7a_100010007818_200025704644 [0,1,1,0,0,0|2,0,0]=4 3337 B14R1.12512 COC(=O)c1cc(c(c(c1)O)SC)O 62a_200000210301_100010192586 [0,1,1,0,0,0|2,0,0]=4 3338 B14R1.12512 COC(=O)c1cc(c(c(c1)O)S[13CH3])O 62a_200025704644_100010192586 [0,1,1,0,0,0|2,0,0]=4 3339 B14R2.601 C=C(C)c1ccc2c(c1)CC(C2)N 271570a_100000694244_100015193702 [1,1,0,0,0,0|2,0,0]=4 3340 B14R2.601 C=C(C)c1ccc2c(c1)CC(C2)O 271570a_100000694244_100010161096 [1,1,0,0,0,0|2,0,0]=4 3341 B14R2.601 C=C(C)c1ccc2c(c1)NC(=O)C2 271570a_100000694244_100000760487 [1,1,0,0,0,0|1,0,1]=4 3342 B14R2.601 CC(=O)c1ccc2c(c1)CC(O2)C 1458a_100000189409_200000210301 [1,1,0,0,0,0|2,0,0]=4 3343 B14R2.601 CC(=O)c1ccc2cc([nH]c2c1)C 1458a_100009852829_200000210301 [1,1,0,0,0,0|0,0,2]=4 3344 B14R2.601 CC(=O)c1ccc2oc(=O)[nH]c2c1 1458a_100000724434_200000210301 [1,1,0,0,0,0|1,0,1]=4 3345 B14R2.601 CC1Cc2cc(ccc2O1)C(=O)[13CH3] 1458a_100000189409_200025704644 [1,1,0,0,0,0|2,0,0]=4 3346 B14R2.601 Cc1cc2ccc(cc2[nH]1)C(=O)[13CH3] 1458a_100009852829_200025704644 [1,1,0,0,0,0|0,0,2]=4 3347 B14R2.601 [13CH3]C(=O)c1ccc2oc(=O)[nH]c2c1 1458a_100000724434_200025704644 [1,1,0,0,0,0|1,0,1]=4 3348 B14R2.624 C=C(C)c1cc2c(cc1O)CCC2 271570a_100000694244_200010659162 [1,1,0,0,0,0|2,0,0]=4 3349 B14R2.624 CC(=O)c1cc2[nH]ccc2cc1Cl 1458a_100009858578_200000210301 [1,1,0,0,0,0|0,0,2]=4 3350 B14R2.624 CC(=O)c1cc2[nH]cnc2cc1F 1458a_200000729458_200000210301 [1,1,0,0,0,0|1,0,1]=4 3351 B14R2.624 CC(=O)c1cc2[nH]ncc2cc1Br 1458a_100102525137_200000210301 [1,1,0,0,0,0|1,0,1]=4 3352 B14R2.624 CC(=O)c1cc2[nH]ncc2cc1Cl 1458a_100009865559_200000210301 [1,1,0,0,0,0|1,0,1]=4 3353 B14R2.624 CC(=O)c1cc2c(cc1Br)OCO2 1458a_100012339479_200000210301 [1,1,0,0,0,0|2,0,0]=4 3354 B14R2.624 [13CH3]C(=O)c1cc2[nH]ccc2cc1Cl 1458a_100009858578_200025704644 [1,1,0,0,0,0|0,0,2]=4 3355 B14R2.624 [13CH3]C(=O)c1cc2[nH]cnc2cc1F 1458a_200000729458_200025704644 [1,1,0,0,0,0|1,0,1]=4 3356 B14R2.624 [13CH3]C(=O)c1cc2[nH]ncc2cc1Br 1458a_100102525137_200025704644 [1,1,0,0,0,0|1,0,1]=4 3357 B14R2.624 [13CH3]C(=O)c1cc2[nH]ncc2cc1Cl 1458a_100009865559_200025704644 [1,1,0,0,0,0|1,0,1]=4 3358 B14R2.624 [13CH3]C(=O)c1cc2c(cc1Br)OCO2 1458a_100012339479_200025704644 [1,1,0,0,0,0|2,0,0]=4 3359 B14R2.5719 C=C(C)c1ccc2c(c1)CCC2N 271570a_100000694244_100000744021 [1,1,0,0,0,0|2,0,0]=4 3360 B14R2.5719 C=C(C)c1ccc2c(c1)CCC2O 271570a_100000694244_100000747877 [1,1,0,0,0,0|2,0,0]=4 3361 B14R2.5719 C=C(C)c1ccc2c(c1)OCC2N 271570a_100000694244_100020628175 [1,1,0,0,0,0|2,0,0]=4 3362 B14R2.5719 CC(=O)c1ccc2c(c1)CCN2C 1458a_100000708782_200000210301 [1,1,0,0,0,0|2,0,0]=4 3363 B14R2.5719 CC(=O)c1ccc2c(c[nH]c2c1)Br 1458a_100010235667_200000210301 [1,1,0,0,0,0|0,0,2]=4 3364 B14R2.5719 CC(=O)c1ccc2c(n[nH]c2c1)Br 1458a_100012355686_200000210301 [1,1,0,0,0,0|1,0,1]=4 3365 B14R2.5719 CC(=O)c1ccc2c(n[nH]c2c1)I 1458a_100010238549_200000210301 [1,1,0,0,0,0|1,0,1]=4 3366 B14R2.5719 CN1CCc2c1ccc(c2)C(=O)[13CH3] 1458a_100000708782_200025704644 [1,1,0,0,0,0|2,0,0]=4 3367 B14R2.5719 [13CH3]C(=O)c1ccc2c(c[nH]c2c1)Br 1458a_100010235667_200025704644 [1,1,0,0,0,0|0,0,2]=4 3368 B14R2.5719 [13CH3]C(=O)c1ccc2c(n[nH]c2c1)Br 1458a_100012355686_200025704644 [1,1,0,0,0,0|1,0,1]=4 3369 B14R2.5719 [13CH3]C(=O)c1ccc2c(n[nH]c2c1)I 1458a_100010238549_200025704644 [1,1,0,0,0,0|1,0,1]=4 3370 B14R2.5998 C=C(C)c1ccc2c(c1N)CCC2 271570a_100000694244_202495424074 [1,1,0,0,0,0|2,0,0]=4 3371 B14R2.5998 C=C(C)c1ccc2c(c1O)CCC2 271570a_100000694244_100010662108 [1,1,0,0,0,0|2,0,0]=4 3372 B14R2.5998 CC(=O)c1ccc2c(c1C)OCO2 1458a_100009908537_200000210301 [1,1,0,0,0,0|2,0,0]=4 3373 B14R2.5998 CC(=O)c1ccc2cc[nH]c2c1Br 1458a_100010717018_200000210301 [1,1,0,0,0,0|0,0,2]=4 3374 B14R2.5998 Cc1c(ccc2c1OCO2)C(=O)[13CH3] 1458a_100009908537_200025704644 [1,1,0,0,0,0|2,0,0]=4 3375 B14R2.5998 [13CH3]C(=O)c1ccc2cc[nH]c2c1Br 1458a_100010717018_200025704644 [1,1,0,0,0,0|0,0,2]=4 3376 B14R2.8824 CC(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_200000210301 [1,1,0,0,0,0|2,0,0]=4 3377 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)Br 1458a_100102525212_200000210301 [1,1,0,0,0,0|0,0,2]=4 3378 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)C 1458a_200015282437_200000210301 [1,1,0,0,0,0|0,0,2]=4 3379 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)Cl 1458a_100000086644_200000210301 [1,1,0,0,0,0|0,0,2]=4 3380 B14R2.8824 CC(=O)c1cc(c2cc[nH]c2c1)F 1458a_100000086646_200000210301 [1,1,0,0,0,0|0,0,2]=4 3381 B14R2.8824 CC(=O)c1cc(c2cn[nH]c2c1)Br 1458a_100102524947_200000210301 [1,1,0,0,0,0|1,0,1]=4 3382 B14R2.8824 CC(=O)c1cc(c2cn[nH]c2c1)Cl 1458a_200000086664_200000210301 [1,1,0,0,0,0|1,0,1]=4 3383 B14R2.8824 CC(=O)c1cc(c2cn[nH]c2c1)F 1458a_100000086653_200000210301 [1,1,0,0,0,0|1,0,1]=4 3384 B14R2.8824 Cc1cc(cc2c1cc[nH]2)C(=O)[13CH3] 1458a_200015282437_200025704644 [1,1,0,0,0,0|0,0,2]=4 3385 B14R2.8824 [13CH3]C(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_200025704644 [1,1,0,0,0,0|2,0,0]=4 3386 B14R2.8824 [13CH3]C(=O)c1cc(c2cc[nH]c2c1)Br 1458a_100102525212_200025704644 [1,1,0,0,0,0|0,0,2]=4 3387 B14R2.8824 [13CH3]C(=O)c1cc(c2cc[nH]c2c1)Cl 1458a_100000086644_200025704644 [1,1,0,0,0,0|0,0,2]=4 3388 B14R2.8824 [13CH3]C(=O)c1cc(c2cc[nH]c2c1)F 1458a_100000086646_200025704644 [1,1,0,0,0,0|0,0,2]=4 3389 B14R2.8824 [13CH3]C(=O)c1cc(c2cn[nH]c2c1)Br 1458a_100102524947_200025704644 [1,1,0,0,0,0|1,0,1]=4 3390 B14R2.8824 [13CH3]C(=O)c1cc(c2cn[nH]c2c1)Cl 1458a_200000086664_200025704644 [1,1,0,0,0,0|1,0,1]=4 3391 B14R2.8824 [13CH3]C(=O)c1cc(c2cn[nH]c2c1)F 1458a_100000086653_200025704644 [1,1,0,0,0,0|1,0,1]=4 3392 B14R2.24358 C=C(C)c1ccc2c(c1)C(=O)CC2 271570a_100000694244_100000759401 [1,1,0,0,0,0|2,0,0]=4 3393 B14R2.24358 C=C(C)c1ccc2c(c1)C(CC2)N 271570a_100000694244_100011435097 [1,1,0,0,0,0|2,0,0]=4 3394 B14R2.24358 C=C(C)c1ccc2c(c1)C(CC2)O 271570a_100000694244_100011836024 [1,1,0,0,0,0|2,0,0]=4 3395 B14R2.24358 CC(=O)c1ccc2ccn(c2c1)C 1458a_100011912540_200000210301 [1,1,0,0,0,0|0,0,2]=4 3396 B14R2.24358 CC(=O)c1ccc2cnn(c2c1)C 1458a_100000101029_200000210301 [1,1,0,0,0,0|1,0,1]=4 3397 B14R2.24358 CC(=O)c1ccc2ncn(c2c1)C 1458a_100012001983_200000210301 [1,1,0,0,0,0|1,0,1]=4 3398 B14R2.24358 Cn1ccc2c1cc(cc2)C(=O)[13CH3] 1458a_100011912540_200025704644 [1,1,0,0,0,0|0,0,2]=4 3399 B14R2.24358 Cn1cnc2c1cc(cc2)C(=O)[13CH3] 1458a_100012001983_200025704644 [1,1,0,0,0,0|1,0,1]=4 3400 B14R2.24358 Cn1ncc2c1cc(cc2)C(=O)[13CH3] 1458a_100000101029_200025704644 [1,1,0,0,0,0|1,0,1]=4 3401 B14R2.475 CC=Cc1ccc2c(c1)C(=O)CC2 271570a_100016259895_100000759401 [1,1,0,0,0,0|2,0,0]=4 3402 B14R2.475 CC=Cc1ccc2c(c1)C(CC2)N 271570a_100016259895_100011435097 [1,1,0,0,0,0|2,0,0]=4 3403 B14R2.475 CC=Cc1ccc2c(c1)C(CC2)O 271570a_100016259895_100011836024 [1,1,0,0,0,0|2,0,0]=4 3404 B14R2.583 CC=Cc1cc2c(cc1O)CCC2 271570a_100016259895_200010659162 [1,1,0,0,0,0|2,0,0]=4 3405 B14R2.808 CC=Cc1ccc2c(c1N)CCC2 271570a_100016259895_202495424074 [1,1,0,0,0,0|2,0,0]=4 3406 B14R2.808 CC=Cc1ccc2c(c1O)CCC2 271570a_100016259895_100010662108 [1,1,0,0,0,0|2,0,0]=4 3407 B14R2.991 CCCCc1ccc2c(c1)NCC2 271570a_100020621405_100000754641 [1,1,0,0,0,0|1,0,1]=4 3408 B14R2.991 CCCOc1ccc2c(c1)NCC2 34a_100020636427_100000210303 [1,1,0,0,0,0|1,0,1]=4 3409 B14R2.991 CCCSc1ccc2c(c1)NCC2 62a_100000210303_100000754641 [1,1,0,0,0,0|1,0,1]=4 3410 B14R2.991 CCCSc1ccc2c(c1)NCC2 62a_100000754641_100000210303 [1,1,0,0,0,0|1,0,1]=4 3411 B14R2.991 CCOCc1ccc2c(c1)CCC2 34a_200000765175_100000210202 [1,1,0,0,0,0|1,0,1]=4 3412 B14R2.991 CCOCc1ccc2c(c1)CCC2 7a_200000765175_100000210202 [1,1,0,0,0,0|1,0,1]=4 3413 B14R2.991 CCOCc1ccc2c(c1)NCC2 34a_100000694088_100000210202 [1,1,0,0,0,0|0,0,1]=3 3414 B14R2.991 COCNc1ccc2c(c1)CCC2 2230a_100000211504_100000766300 [1,1,0,0,0,0|1,0,1]=4 3415 B14R2.991 COCSc1cc2c(cn1)CCN2 62a_100000766300_100020639910 [1,1,0,0,0,0|1,0,1]=4 3416 B14R2.991 COCSc1cc2c(cn1)CCN2 62a_100020639910_100000766300 [1,1,0,0,0,0|1,0,1]=4 3417 B14R2.991 COCSc1ccc2c(c1)CCC2 62a_100000745594_100000766300 [1,1,0,0,0,0|1,0,1]=4 3418 B14R2.991 COCSc1ccc2c(c1)CCC2 62a_100000766300_100000745594 [1,1,0,0,0,0|1,0,1]=4 3419 B14R2.991 COCSc1ccc2c(c1)NCC2 62a_100000754641_100000766300 [1,1,0,0,0,0|0,0,1]=3 3420 B14R2.991 COCSc1ccc2c(c1)NCC2 62a_100000766300_100000754641 [1,1,0,0,0,0|0,0,1]=3 3421 B14R2.991 COCSc1ccc2c(c1)OCC2 62a_100000766300_100009818566 [1,1,0,0,0,0|1,0,1]=4 3422 B14R2.991 COCSc1ccc2c(c1)OCC2 62a_100009818566_100000766300 [1,1,0,0,0,0|1,0,1]=4 3423 B14R2.991 COCSc1cnc2c(c1)NCC2 62a_100000698607_100000766300 [1,1,0,0,0,0|1,0,1]=4 3424 B14R2.991 COCSc1cnc2c(c1)NCC2 62a_100000766300_100000698607 [1,1,0,0,0,0|1,0,1]=4 3425 B14R2.991 CSCOc1ccc2c(c1)NCC2 34a_100020636427_100011218213 [1,1,0,0,0,0|0,1,1]=4 3426 B14R2.991 CSCSc1ccc2c(c1)NCC2 62a_100000754641_100011218213 [1,1,0,0,0,0|0,1,1]=4 3427 B14R2.991 CSCSc1ccc2c(c1)NCC2 62a_100011218213_100000754641 [1,1,0,0,0,0|0,1,1]=4 3428 B14R2.991 FCCOc1ccc2c(c1)NCC2 34a_100020636427_100011217306 [1,1,0,0,0,0|2,0,0]=4 3429 B14R2.991 FCCSc1ccc2c(c1)NCC2 62a_100000754641_100011217306 [1,1,0,0,0,0|2,0,0]=4 3430 B14R2.991 FCCSc1ccc2c(c1)NCC2 62a_100011217306_100000754641 [1,1,0,0,0,0|2,0,0]=4 3431 B14R2.991 FCOCc1ccc2c(c1)CCC2 34a_200000765175_100015361967 [1,1,0,0,0,0|1,0,1]=4 3432 B14R2.991 FCOCc1ccc2c(c1)CCC2 7a_200000765175_100015361967 [1,1,0,0,0,0|1,0,1]=4 3433 B14R2.991 FCOCc1ccc2c(c1)NCC2 34a_100000694088_100015361967 [1,1,0,0,0,0|0,0,1]=3 3434 B14R2.991 OCCOc1ccc2c(c1)NCC2 34a_100020636427_100000211926 [1,1,0,0,0,0|2,0,0]=4 3435 B14R2.991 OCCSc1ccc2c(c1)NCC2 62a_100000211926_100000754641 [1,1,0,0,0,0|2,0,0]=4 3436 B14R2.991 OCCSc1ccc2c(c1)NCC2 62a_100000754641_100000211926 [1,1,0,0,0,0|2,0,0]=4 3437 B14R2.1008 CC(=Cc1cc2c(cn1)CCN2)C 271570a_100102525489_100020639910 [1,1,0,0,0,0|2,0,0]=4 3438 B14R2.1008 CC(=Cc1ccc2c(c1)CCC2)C 271570a_100102525489_100000745594 [1,1,0,0,0,0|2,0,0]=4 3439 B14R2.1008 CC(=Cc1ccc2c(c1)NCC2)C 271570a_100102525489_100000754641 [1,1,0,0,0,0|1,0,0]=3 3440 B14R2.1008 CC(=Cc1ccc2c(c1)OCC2)C 271570a_100102525489_100009818566 [1,1,0,0,0,0|2,0,0]=4 3441 B14R2.1008 CC(=Cc1cnc2c(c1)NCC2)C 271570a_100102525489_100000698607 [1,1,0,0,0,0|2,0,0]=4 3442 B14R2.1008 CC(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100000210206 [1,1,0,0,0,0|2,0,0]=4 3443 B14R2.1008 CC(C)Sc1ccc2c(c1)NCC2 62a_100000210206_100000754641 [1,1,0,0,0,0|2,0,0]=4 3444 B14R2.1008 CC(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000210206 [1,1,0,0,0,0|2,0,0]=4 3445 B14R2.6400 CC=Cc1ccc2c(c1)CC(C2)N 271570a_100016259895_100015193702 [1,1,0,0,0,0|2,0,0]=4 3446 B14R2.6400 CC=Cc1ccc2c(c1)CC(C2)O 271570a_100016259895_100010161096 [1,1,0,0,0,0|2,0,0]=4 3447 B14R2.6400 CC=Cc1ccc2c(c1)NC(=O)C2 271570a_100016259895_100000760487 [1,1,0,0,0,0|1,0,1]=4 3448 B14R2.6412 CC=Cc1ccc2c(c1)CCC2N 271570a_100016259895_100000744021 [1,1,0,0,0,0|2,0,0]=4 3449 B14R2.6412 CC=Cc1ccc2c(c1)CCC2O 271570a_100016259895_100000747877 [1,1,0,0,0,0|2,0,0]=4 3450 B14R2.6412 CC=Cc1ccc2c(c1)OCC2N 271570a_100016259895_100020628175 [1,1,0,0,0,0|2,0,0]=4 3451 B14R2.9949 C#CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000184674 [0,1,0,0,1,0|1,0,1]=4 3452 B14R2.9949 C=CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210623 [0,1,0,0,1,0|1,0,1]=4 3453 B14R2.9949 CCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210303 [0,1,0,0,1,0|1,0,0]=3 3454 B14R2.9949 CCNC(=O)c1ccc2c(c1)CC2 11a_100015525214_100000137882 [0,1,0,0,1,0|1,0,0]=3 3455 B14R2.9949 CCNC(=O)c1ccc2c(c1)CC2 240690a_100015525214_100000137882 [0,1,0,0,1,0|1,0,0]=3 3456 B14R2.9949 CCNC(=O)c1ccc2c(c1)CC2 527a_100015525214_100000137882 [0,1,0,0,1,0|1,0,0]=3 3457 B14R2.9949 CNNC(=O)c1ccc2c(c1)CC2 22a_100016993582_100000137882 [0,1,0,0,1,0|1,0,0]=3 3458 B14R2.9949 N#CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100011214920 [0,1,0,0,1,0|1,0,1]=4 3459 B14R2.9949 O=C(CCF)c1ccc2c(c1)CC2 1458a_100000137882_100011217306 [0,1,0,0,1,0|1,0,0]=3 3460 B14R2.9949 O=C(CCO)c1ccc2c(c1)CC2 1458a_100000137882_100000211926 [0,1,0,0,1,0|1,0,0]=3 3461 B14R2.15123 CC(=C(C)c1ccc2c(c1)CC2)C 271570a_200000049429_100009818592 [0,1,0,0,1,0|2,0,0]=4 3462 B14R2.15123 CC(C)C(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210206 [0,1,0,0,1,0|1,0,0]=3 3463 B14R2.15123 CN(C)C(=O)c1ccc2c(c1)CC2 11a_100102631434_100000137882 [0,1,0,0,1,0|1,0,0]=3 3464 B14R2.15123 CN(C)C(=O)c1ccc2c(c1)CC2 1626a_100102631434_100000137882 [0,1,0,0,1,0|1,0,0]=3 3465 B14R2.15123 CN(C)C(=O)c1ccc2c(c1)CC2 240690a_100102631434_100000137882 [0,1,0,0,1,0|1,0,0]=3 3466 B14R2.15123 CN(C)C(=O)c1ccc2c(c1)CC2 527a_100102631434_100000137882 [0,1,0,0,1,0|1,0,0]=3 3467 B16R2.767 CCCC(=O)c1ccc2c(c1)CCCC2 1458a_100000199106_100000210303 [0,1,0,0,0,1|2,0,0]=4 3468 B16R2.767 CCCC(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_100000210303 [0,1,0,0,0,1|2,0,0]=4 3469 B16R2.767 CCCC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210303 [0,1,0,0,0,1|2,0,0]=4 3470 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCC2 11a_100015525214_100000199106 [0,1,0,0,0,1|2,0,0]=4 3471 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCC2 240690a_100015525214_100000199106 [0,1,0,0,0,1|2,0,0]=4 3472 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCC2 527a_100015525214_100000199106 [0,1,0,0,0,1|2,0,0]=4 3473 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCO2 11a_100015525214_100011398765 [0,1,0,0,0,1|2,0,0]=4 3474 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCO2 240690a_100015525214_100011398765 [0,1,0,0,0,1|2,0,0]=4 3475 B16R2.767 CCNC(=O)c1ccc2c(c1)CCCO2 527a_100015525214_100011398765 [0,1,0,0,0,1|2,0,0]=4 3476 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 11a_100015525214_100000182659 [0,1,0,0,0,1|2,0,0]=4 3477 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 240690a_100015525214_100000182659 [0,1,0,0,0,1|2,0,0]=4 3478 B16R2.767 CCNC(=O)c1ccc2c(c1)OCCO2 527a_100015525214_100000182659 [0,1,0,0,0,1|2,0,0]=4 3479 B16R2.767 CNCC(=O)c1ccc2c(c1)CCCC2 2230a_106832991635_100011262348 [0,1,0,0,0,1|2,0,0]=4 3480 B16R2.767 CNCC(=O)c1ccc2c(c1)CCCC2 34a_100102657272_100011262348 [0,1,0,0,0,1|2,0,0]=4 3481 B16R2.767 CNCC(=O)c1ccc2c(c1)CCCC2 7a_106832991635_100011262348 [0,1,0,0,0,1|2,0,0]=4 3482 B16R2.767 CNCC(=O)c1ccc2c(c1)OCCO2 2230a_106832991635_100000185173 [0,1,0,0,0,1|2,0,0]=4 3483 B16R2.767 CNCC(=O)c1ccc2c(c1)OCCO2 34a_100102657272_100000185173 [0,1,0,0,0,1|2,0,0]=4 3484 B16R2.767 CNCC(=O)c1ccc2c(c1)OCCO2 7a_106832991635_100000185173 [0,1,0,0,0,1|2,0,0]=4 3485 B16R2.767 CNNC(=O)c1ccc2c(c1)CCCC2 22a_100016993582_100000199106 [0,1,0,0,0,1|2,0,0]=4 3486 B16R2.767 CNNC(=O)c1ccc2c(c1)CCCO2 22a_100016993582_100011398765 [0,1,0,0,0,1|2,0,0]=4 3487 B16R2.767 CNNC(=O)c1ccc2c(c1)OCCO2 22a_100016993582_100000182659 [0,1,0,0,0,1|2,0,0]=4 3488 B16R2.767 COCC(=O)c1ccc2c(c1)CCCC2 34a_100138415774_100011262348 [0,1,0,0,0,1|1,0,0]=3 3489 B16R2.767 COCC(=O)c1ccc2c(c1)OCCO2 34a_100138415774_100000185173 [0,1,0,0,0,1|1,0,0]=3 3490 B16R2.767 CSCC(=O)c1ccc2c(c1)CCCC2 62a_100011262348_200000210301 [0,1,0,0,0,1|1,1,0]=4 3491 B16R2.767 CSCC(=O)c1ccc2c(c1)CCCC2 62a_200000210301_100011262348 [0,1,0,0,0,1|1,1,0]=4 3492 B16R2.767 CSCC(=O)c1ccc2c(c1)OCCO2 62a_100000185173_200000210301 [0,1,0,0,0,1|1,1,0]=4 3493 B16R2.767 CSCC(=O)c1ccc2c(c1)OCCO2 62a_200000210301_100000185173 [0,1,0,0,0,1|1,1,0]=4 3494 B16R2.767 O=C(CCF)c1ccc2c(c1)CCCC2 1458a_100000199106_100011217306 [0,1,0,0,0,1|2,0,0]=4 3495 B16R2.767 O=C(CCF)c1ccc2c(c1)CCCO2 1458a_100011398765_100011217306 [0,1,0,0,0,1|2,0,0]=4 3496 B16R2.767 O=C(CCF)c1ccc2c(c1)OCCO2 1458a_100000182659_100011217306 [0,1,0,0,0,1|2,0,0]=4 3497 B16R2.767 O=C(CCO)c1ccc2c(c1)CCCC2 1458a_100000199106_100000211926 [0,1,0,0,0,1|2,0,0]=4 3498 B16R2.767 O=C(CCO)c1ccc2c(c1)CCCO2 1458a_100011398765_100000211926 [0,1,0,0,0,1|2,0,0]=4 3499 B16R2.767 O=C(CCO)c1ccc2c(c1)OCCO2 1458a_100000182659_100000211926 [0,1,0,0,0,1|2,0,0]=4 3500 B16R2.767 [13CH3]SCC(=O)c1ccc2c(c1)CCCC2 62a_100011262348_200025704644 [0,1,0,0,0,1|1,1,0]=4 3501 B16R2.767 [13CH3]SCC(=O)c1ccc2c(c1)CCCC2 62a_200025704644_100011262348 [0,1,0,0,0,1|1,1,0]=4 3502 B16R2.767 [13CH3]SCC(=O)c1ccc2c(c1)OCCO2 62a_100000185173_200025704644 [0,1,0,0,0,1|1,1,0]=4 3503 B16R2.767 [13CH3]SCC(=O)c1ccc2c(c1)OCCO2 62a_200025704644_100000185173 [0,1,0,0,0,1|1,1,0]=4 3504 B16R2.1205 CCC(=O)c1ccc2c(c1)NC(=O)CO2 1458a_100000187493_100000210202 [0,1,0,0,0,1|1,0,1]=4 3505 B16R2.1205 CCC(=O)c1ccc2c(c1)NC(=O)CS2 1458a_100000010532_100000210202 [0,1,0,0,0,1|1,0,1]=4 3506 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 11a_106832991635_100000187493 [0,1,0,0,0,1|1,0,1]=4 3507 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 1626a_100102657272_100000187493 [0,1,0,0,0,1|1,0,1]=4 3508 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 240690a_100102657272_100000187493 [0,1,0,0,0,1|1,0,1]=4 3509 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CO2 527a_100102657272_100000187493 [0,1,0,0,0,1|1,0,1]=4 3510 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CS2 11a_106832991635_100000010532 [0,1,0,0,0,1|1,0,1]=4 3511 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CS2 1626a_100102657272_100000010532 [0,1,0,0,0,1|1,0,1]=4 3512 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CS2 240690a_100102657272_100000010532 [0,1,0,0,0,1|1,0,1]=4 3513 B16R2.1205 CNC(=O)c1ccc2c(c1)NC(=O)CS2 527a_100102657272_100000010532 [0,1,0,0,0,1|1,0,1]=4 3514 B16R2.1205 COC(=O)c1ccc2c(c1)CN(CC2)C 2230a_100000696298_200000210301 [0,1,0,0,0,1|0,0,0]=2 3515 B16R2.1205 COC(=O)c1ccc2c(c1)CN(CC2)C 269982a_100000696298_200000210301 [0,1,0,0,0,1|0,0,0]=2 3516 B16R2.1205 COC(=O)c1ccc2c(c1)CN(CC2)C 34a_100000696298_200000210301 [0,1,0,0,0,1|0,0,0]=2 3517 B16R2.1205 COC(=O)c1ccc2c(c1)CN(CC2)[13CH3] 2230a_100000696298_200025704644 [0,1,0,0,0,1|0,0,0]=2 3518 B16R2.1205 COC(=O)c1ccc2c(c1)CN(CC2)[13CH3] 269982a_100000696298_200025704644 [0,1,0,0,0,1|0,0,0]=2 3519 B16R2.1205 COC(=O)c1ccc2c(c1)CN(CC2)[13CH3] 34a_100000696298_200025704644 [0,1,0,0,0,1|0,0,0]=2 3520 B16R2.1212 CCC(=O)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_100000210202 [0,1,0,0,0,1|1,0,0]=3 3521 B16R2.1212 CNC(=O)c1ccc2c(c1)C(=O)NCC2 11a_106832991635_100000724257 [0,1,0,0,0,1|1,0,0]=3 3522 B16R2.1212 CNC(=O)c1ccc2c(c1)C(=O)NCC2 1626a_100102657272_100000724257 [0,1,0,0,0,1|1,0,0]=3 3523 B16R2.1212 CNC(=O)c1ccc2c(c1)C(=O)NCC2 240690a_100102657272_100000724257 [0,1,0,0,0,1|1,0,0]=3 3524 B16R2.1212 CNC(=O)c1ccc2c(c1)C(=O)NCC2 527a_100102657272_100000724257 [0,1,0,0,0,1|1,0,0]=3 3525 B16R2.1212 O=C(CF)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_100015361967 [0,1,0,0,0,1|2,0,0]=4 3526 B16R2.6284 CC(=C(C)c1ccc2c(c1)CNCC2)C 271570a_200000049429_100015189961 [0,1,0,0,0,1|2,0,0]=4 3527 B16R2.6284 CC(=C(C)c1ccc2c(c1)NCCC2)C 271570a_200000049429_100010196366 [0,1,0,0,0,1|2,0,0]=4 3528 B16R2.6284 CC(=C(C)c1ccc2c(c1)NCCO2)C 271570a_200000049429_100000708519 [0,1,0,0,0,1|2,0,0]=4 3529 B16R2.6284 CC(=C(C)c1ccc2c(c1)NCCS2)C 271570a_200000049429_100013243616 [0,1,0,0,0,1|2,0,0]=4 3530 B16R2.6284 CC(C)C(=O)c1ccc2c(c1)CCCC2 1458a_100000199106_100000210206 [0,1,0,0,0,1|2,0,0]=4 3531 B16R2.6284 CC(C)C(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_100000210206 [0,1,0,0,0,1|2,0,0]=4 3532 B16R2.6284 CC(C)C(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210206 [0,1,0,0,0,1|2,0,0]=4 3533 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCC2 11a_100102631434_100000199106 [0,1,0,0,0,1|2,0,0]=4 3534 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCC2 1626a_100102631434_100000199106 [0,1,0,0,0,1|2,0,0]=4 3535 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCC2 240690a_100102631434_100000199106 [0,1,0,0,0,1|2,0,0]=4 3536 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCC2 527a_100102631434_100000199106 [0,1,0,0,0,1|2,0,0]=4 3537 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCO2 11a_100102631434_100011398765 [0,1,0,0,0,1|2,0,0]=4 3538 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCO2 1626a_100102631434_100011398765 [0,1,0,0,0,1|2,0,0]=4 3539 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCO2 240690a_100102631434_100011398765 [0,1,0,0,0,1|2,0,0]=4 3540 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)CCCO2 527a_100102631434_100011398765 [0,1,0,0,0,1|2,0,0]=4 3541 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 11a_100102631434_100000182659 [0,1,0,0,0,1|2,0,0]=4 3542 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 1626a_100102631434_100000182659 [0,1,0,0,0,1|2,0,0]=4 3543 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 240690a_100102631434_100000182659 [0,1,0,0,0,1|2,0,0]=4 3544 B16R2.6284 CN(C)C(=O)c1ccc2c(c1)OCCO2 527a_100102631434_100000182659 [0,1,0,0,0,1|2,0,0]=4 3545 B16R2.33799 COC(=O)c1ccc2c(c1)CCN(C2)C 2230a_100020628067_200000210301 [0,1,0,0,0,1|1,0,0]=3 3546 B16R2.33799 COC(=O)c1ccc2c(c1)CCN(C2)C 269982a_100020628067_200000210301 [0,1,0,0,0,1|1,0,0]=3 3547 B16R2.33799 COC(=O)c1ccc2c(c1)CCN(C2)C 34a_100020628067_200000210301 [0,1,0,0,0,1|1,0,0]=3 3548 B16R2.33799 COC(=O)c1ccc2c(c1)CCN(C2)[13CH3] 2230a_100020628067_200025704644 [0,1,0,0,0,1|1,0,0]=3 3549 B16R2.33799 COC(=O)c1ccc2c(c1)CCN(C2)[13CH3] 269982a_100020628067_200025704644 [0,1,0,0,0,1|1,0,0]=3 3550 B16R2.33799 COC(=O)c1ccc2c(c1)CCN(C2)[13CH3] 34a_100020628067_200025704644 [0,1,0,0,0,1|1,0,0]=3 3551 B16R2.33941 CCC(=O)c1cc2c(cc1Br)OCCO2 1458a_200011264633_100000210202 [0,1,0,0,0,1|2,0,0]=4 3552 B16R2.33941 CCC(=O)c1cc2c(cc1C)OCCO2 1458a_100000089694_100000210202 [0,1,0,0,0,1|2,0,0]=4 3553 B16R2.33941 CCC(=O)c1cc2c(cc1O)OCCO2 1458a_100000107476_100000210202 [0,1,0,0,0,1|2,0,0]=4 3554 B16R2.33941 CNC(=O)c1cc2c(cc1Br)OCCO2 11a_106832991635_200011264633 [0,1,0,0,0,1|2,0,0]=4 3555 B16R2.33941 CNC(=O)c1cc2c(cc1Br)OCCO2 1626a_100102657272_200011264633 [0,1,0,0,0,1|2,0,0]=4 3556 B16R2.33941 CNC(=O)c1cc2c(cc1Br)OCCO2 240690a_100102657272_200011264633 [0,1,0,0,0,1|2,0,0]=4 3557 B16R2.33941 CNC(=O)c1cc2c(cc1Br)OCCO2 527a_100102657272_200011264633 [0,1,0,0,0,1|2,0,0]=4 3558 B16R2.33941 CNC(=O)c1cc2c(cc1C)OCCO2 11a_106832991635_100000089694 [0,1,0,0,0,1|2,0,0]=4 3559 B16R2.33941 CNC(=O)c1cc2c(cc1C)OCCO2 1626a_100102657272_100000089694 [0,1,0,0,0,1|2,0,0]=4 3560 B16R2.33941 CNC(=O)c1cc2c(cc1C)OCCO2 240690a_100102657272_100000089694 [0,1,0,0,0,1|2,0,0]=4 3561 B16R2.33941 CNC(=O)c1cc2c(cc1C)OCCO2 527a_100102657272_100000089694 [0,1,0,0,0,1|2,0,0]=4 3562 B16R2.33941 CNC(=O)c1cc2c(cc1O)OCCO2 240690a_100102657272_100000107476 [0,1,0,0,0,1|2,0,0]=4 3563 B16R2.173132 CCC(=O)c1ccc2c(c1)OCCN2C 1458a_100000067097_100000210202 [0,1,0,0,0,1|2,0,0]=4 3564 B16R2.173132 CNC(=O)c1ccc2c(c1)OCCN2C 11a_106832991635_100000067097 [0,1,0,0,0,1|2,0,0]=4 3565 B16R2.173132 CNC(=O)c1ccc2c(c1)OCCN2C 1626a_100102657272_100000067097 [0,1,0,0,0,1|2,0,0]=4 3566 B16R2.173132 CNC(=O)c1ccc2c(c1)OCCN2C 240690a_100102657272_100000067097 [0,1,0,0,0,1|2,0,0]=4 3567 B16R2.173132 CNC(=O)c1ccc2c(c1)OCCN2C 527a_100102657272_100000067097 [0,1,0,0,0,1|2,0,0]=4 3568 B16R2.2151 CC#CC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000763181 [0,1,0,0,0,1|2,0,0]=4 3569 B16R2.2151 CC=CC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000210699 [0,1,0,0,0,1|2,0,0]=4 3570 B16R2.2151 CC=CC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000210699 [0,1,0,0,0,1|2,0,0]=4 3571 B16R2.2151 CC=CC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000210699 [0,1,0,0,0,1|2,0,0]=4 3572 B16R2.2151 CCCC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000211992 [0,1,0,0,0,1|2,0,0]=4 3573 B16R2.2151 CCCC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000211992 [0,1,0,0,0,1|2,0,0]=4 3574 B16R2.2151 CCCC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000211992 [0,1,0,0,0,1|2,0,0]=4 3575 B16R2.2151 CCCC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000211992 [0,1,0,0,0,1|2,0,0]=4 3576 B16R2.2151 CCNC(=O)Nc1ccc2c(c1)CCC2 2430a_100000211504_100015525214 [0,1,0,0,0,1|2,0,0]=4 3577 B16R2.2151 COCC(=O)Cc1ccc2cn[nH]c2c1 1458a_100000210968_100020605281 [0,1,0,0,0,1|1,0,1]=4 3578 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000210968 [0,1,0,0,0,1|1,0,0]=3 3579 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000210968 [0,1,0,0,0,1|1,0,0]=3 3580 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000210968 [0,1,0,0,0,1|1,0,0]=3 3581 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000210968 [0,1,0,0,0,1|1,0,0]=3 3582 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100000210968 [0,1,0,0,0,1|2,0,0]=4 3583 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100000210968 [0,1,0,0,0,1|2,0,0]=4 3584 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000210968 [0,1,0,0,0,1|2,0,0]=4 3585 B16R2.2151 COCC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100000210968 [0,1,0,0,0,1|2,0,0]=4 3586 B16R2.2151 COCC(=O)Nc1ccc2c(c1)COC2 11a_100011728444_100000210968 [0,1,0,0,0,1|2,0,0]=4 3587 B16R2.2151 COCC(=O)Nc1ccc2c(c1)COC2 1626a_100011728444_100000210968 [0,1,0,0,0,1|2,0,0]=4 3588 B16R2.2151 COCC(=O)Nc1ccc2c(c1)COC2 22a_100011728444_100000210968 [0,1,0,0,0,1|2,0,0]=4 3589 B16R2.2151 COCC(=O)Nc1ccc2c(c1)COC2 527a_100011728444_100000210968 [0,1,0,0,0,1|2,0,0]=4 3590 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100000210968 [0,1,0,0,0,1|2,0,0]=4 3591 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000210968 [0,1,0,0,0,1|2,0,0]=4 3592 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000210968 [0,1,0,0,0,1|2,0,0]=4 3593 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 34a_100138415774_100000182918 [0,1,0,0,0,1|2,0,0]=4 3594 B16R2.2151 COCC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100000210968 [0,1,0,0,0,1|2,0,0]=4 3595 B16R2.2151 COCC(=O)Nc1ccc2cc[nH]c2c1 11a_100000743810_100000210968 [0,1,0,0,0,1|0,0,2]=4 3596 B16R2.2151 COCC(=O)Nc1ccc2cc[nH]c2c1 1626a_100000743810_100000210968 [0,1,0,0,0,1|0,0,2]=4 3597 B16R2.2151 COCC(=O)Nc1ccc2cc[nH]c2c1 22a_100000743810_100000210968 [0,1,0,0,0,1|0,0,2]=4 3598 B16R2.2151 COCC(=O)Nc1ccc2cc[nH]c2c1 527a_100000743810_100000210968 [0,1,0,0,0,1|0,0,2]=4 3599 B16R2.2151 COCC(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100000765312 [0,1,0,0,0,1|1,0,1]=4 3600 B16R2.2151 COCC(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000765312 [0,1,0,0,0,1|1,0,1]=4 3601 B16R2.2151 COCC(C)Sc1ccc2c(c1)NCC2 62a_100000765312_100000754641 [0,1,0,0,0,1|1,0,1]=4 3602 B16R2.2151 CSCC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000184570 [0,1,0,0,0,1|1,1,0]=4 3603 B16R2.2151 CSCC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000184570 [0,1,0,0,0,1|1,1,0]=4 3604 B16R2.2151 CSCC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000184570 [0,1,0,0,0,1|1,1,0]=4 3605 B16R2.2151 CSCC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000184570 [0,1,0,0,0,1|1,1,0]=4 3606 B16R2.2151 O=C(CCO)Nc1ccc2c(c1)CCC2 22a_100000211504_100011216618 [0,1,0,0,0,1|2,0,0]=4 3607 B16R2.6257 C=C(C)C(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000185857 [0,1,0,0,0,1|2,0,0]=4 3608 B16R2.6257 C=C(C)C(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000185857 [0,1,0,0,0,1|2,0,0]=4 3609 B16R2.6257 C=C(C)C(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000185857 [0,1,0,0,0,1|2,0,0]=4 3610 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000210198 [0,1,0,0,0,1|2,0,0]=4 3611 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000210198 [0,1,0,0,0,1|2,0,0]=4 3612 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000210198 [0,1,0,0,0,1|2,0,0]=4 3613 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000210198 [0,1,0,0,0,1|2,0,0]=4 3614 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000062450 [0,1,0,0,0,1|2,0,0]=4 3615 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000062450 [0,1,0,0,0,1|2,0,0]=4 3616 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000062450 [0,1,0,0,0,1|2,0,0]=4 3617 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000062450 [0,1,0,0,0,1|2,0,0]=4 3618 B16R2.6257 CN(C)C(=O)Nc1ccc2c(c1)CCC2 2430a_100000211504_100102631434 [0,1,0,0,0,1|2,0,0]=4 3619 B16R2.6257 C[C@@H](O)C(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000717761 [0,1,0,0,0,1|2,0,0]=4 3620 B16R2.6257 C[C@H](O)C(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_217856618621 [0,1,0,0,0,1|2,0,0]=4 3621 B16R2.6257 C[C@H](O)C(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_217856618621 [0,1,0,0,0,1|2,0,0]=4 3622 B16R2.176344 CCC(=O)Nc1ccc2c(c1)NC(=O)C2 22a_100000721629_100000210414 [0,1,0,0,0,1|1,0,1]=4 3623 B16R2.176344 CCC(=O)Nc1ccc2c(c1)NC(=O)C2 527a_100000721629_100000210414 [0,1,0,0,0,1|1,0,1]=4 3624 B16R2.176344 CNC(=O)Nc1ccc2c(c1)NC(=O)C2 2430a_100000721629_100102657272 [0,1,0,0,0,1|1,0,1]=4 3625 B16R2.2122 C#CCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000753159 [0,2,0,0,0,0|2,0,0]=4 3626 B16R2.2122 C#CCNC(=O)c1ccc2c(c1)CCC2 11a_100000212058_100000195560 [0,2,0,0,0,0|2,0,0]=4 3627 B16R2.2122 C#CCNC(=O)c1ccc2c(c1)CCC2 1626a_100000212058_100000195560 [0,2,0,0,0,0|2,0,0]=4 3628 B16R2.2122 C#CCNC(=O)c1ccc2c(c1)CCC2 240690a_100000212058_100000195560 [0,2,0,0,0,0|2,0,0]=4 3629 B16R2.2122 C#CCNC(=O)c1ccc2c(c1)CCC2 527a_100000212058_100000195560 [0,2,0,0,0,0|2,0,0]=4 3630 B16R2.2122 C/C=C/CC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100102629194 [0,2,0,0,0,0|2,0,0]=4 3631 B16R2.2122 C=CCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000754431 [0,2,0,0,0,0|2,0,0]=4 3632 B16R2.2122 C=CCNC(=O)c1ccc2c(c1)CCC2 1626a_100020586998_100000195560 [0,2,0,0,0,0|2,0,0]=4 3633 B16R2.2122 C=CCNC(=O)c1ccc2c(c1)CCC2 240690a_100020586998_100000195560 [0,2,0,0,0,0|2,0,0]=4 3634 B16R2.2122 C=CCNC(=O)c1ccc2c(c1)CCC2 527a_100020586998_100000195560 [0,2,0,0,0,0|2,0,0]=4 3635 B16R2.2122 CC#CCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000748600 [0,2,0,0,0,0|2,0,0]=4 3636 B16R2.2122 CC=CCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000070051 [0,2,0,0,0,0|2,0,0]=4 3637 B16R2.2122 CC=NNC(=O)c1ccc2c(c1)CCC2 4a_100000189872_200000210099 [0,2,0,0,0,0|2,0,0]=4 3638 B16R2.2122 CCCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000210211 [0,2,0,0,0,0|2,0,0]=4 3639 B16R2.2122 CCCNC(=O)c1ccc2c(c1)CCC2 11a_100020643023_100000195560 [0,2,0,0,0,0|2,0,0]=4 3640 B16R2.2122 CCCNC(=O)c1ccc2c(c1)CCC2 1626a_100020643023_100000195560 [0,2,0,0,0,0|2,0,0]=4 3641 B16R2.2122 CCCNC(=O)c1ccc2c(c1)CCC2 240690a_100020643023_100000195560 [0,2,0,0,0,0|2,0,0]=4 3642 B16R2.2122 CCCNC(=O)c1ccc2c(c1)CCC2 527a_100020643023_100000195560 [0,2,0,0,0,0|2,0,0]=4 3643 B16R2.2122 CCNNC(=O)c1ccc2c(c1)CCC2 22a_100000756455_100000195560 [0,2,0,0,0,0|2,0,0]=4 3644 B16R2.2122 CCOCC(=O)c1ccc2c(c1)CCO2 34a_100121572206_100000241338 [0,2,0,0,0,0|2,0,0]=4 3645 B16R2.2122 COCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000233755 [0,2,0,0,0,0|1,0,0]=3 3646 B16R2.2122 COCCC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000233755 [0,2,0,0,0,0|2,0,0]=4 3647 B16R2.2122 COCCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000233755 [0,2,0,0,0,0|2,0,0]=4 3648 B16R2.2122 COCCC(=O)c1ccc2cc[nH]c2c1 1458a_100000739399_100000233755 [0,2,0,0,0,0|0,0,2]=4 3649 B16R2.2122 COCCC(=O)c1ccc2cn[nH]c2c1 1458a_102516607281_100000233755 [0,2,0,0,0,0|1,0,1]=4 3650 B16R2.2122 CSCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000751147 [0,2,0,0,0,0|1,1,0]=4 3651 B16R2.2122 N#CCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100011215226 [0,2,0,0,0,0|2,0,0]=4 3652 B16R2.2122 N#CCNC(=O)c1ccc2c(c1)CCC2 1626a_100000734998_100000195560 [0,2,0,0,0,0|2,0,0]=4 3653 B16R2.2122 N#CCNC(=O)c1ccc2c(c1)CCC2 527a_100000734998_100000195560 [0,2,0,0,0,0|2,0,0]=4 3654 B16R2.2122 O=C(CCCF)c1ccc2c(c1)CCC2 1458a_100000195560_100011934791 [0,2,0,0,0,0|2,0,0]=4 3655 B16R2.2122 O=C(CCCO)c1ccc2c(c1)CCC2 1458a_100000195560_100011215043 [0,2,0,0,0,0|2,0,0]=4 3656 B16R2.2122 O=C(NCCF)c1ccc2c(c1)CCC2 11a_100000724931_100000195560 [0,2,0,0,0,0|2,0,0]=4 3657 B16R2.2122 O=C(NCCF)c1ccc2c(c1)CCC2 1626a_100000724931_100000195560 [0,2,0,0,0,0|2,0,0]=4 3658 B16R2.2122 O=C(NCCF)c1ccc2c(c1)CCC2 240690a_100000724931_100000195560 [0,2,0,0,0,0|2,0,0]=4 3659 B16R2.2122 O=C(NCCF)c1ccc2c(c1)CCC2 527a_100000724931_100000195560 [0,2,0,0,0,0|2,0,0]=4 3660 B16R2.2122 O=C(NCCO)c1ccc2c(c1)CCC2 240690a_100000210304_100000195560 [0,2,0,0,0,0|2,0,0]=4 3661 B16R2.2122 O=C(NCCO)c1ccc2c(c1)CCC2 527a_100000210304_100000195560 [0,2,0,0,0,0|2,0,0]=4 3662 B16R2.11587 C=C(C)CC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000748629 [0,2,0,0,0,0|2,0,0]=4 3663 B16R2.11587 CC(C)CC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000210624 [0,2,0,0,0,0|2,0,0]=4 3664 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)CCC2 11a_100138425928_100000195560 [0,2,0,0,0,0|2,0,0]=4 3665 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)CCC2 1626a_100138425928_100000195560 [0,2,0,0,0,0|2,0,0]=4 3666 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)CCC2 240690a_100138425928_100000195560 [0,2,0,0,0,0|2,0,0]=4 3667 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)CCC2 527a_100138425928_100000195560 [0,2,0,0,0,0|2,0,0]=4 3668 B16R2.11587 CC(O)CC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100011218427 [0,2,0,0,0,0|2,0,0]=4 3669 B16R2.11587 O=C(CC(F)F)c1ccc2c(c1)CCC2 1458a_100000195560_100011934356 [0,2,0,0,0,0|2,0,0]=4 3670 B16R2.29707 CCNC(=O)c1ccc2c(c1)NC(=O)C2 527a_100015525214_100015205845 [0,2,0,0,0,0|1,0,1]=4 3671 B16R2.29707 CNNC(=O)c1ccc2c(c1)NC(=O)C2 22a_100016993582_100015205845 [0,2,0,0,0,0|1,0,1]=4 3672 B16R2.3891 CN(C)C(=O)c1ccc2c(c1)NC(=O)C2 527a_100102631434_100015205845 [0,2,0,0,0,0|1,0,1]=4 3673 B16R2.1581 C=Cc1cc2c(cc1C(=O)OC)OCO2 271570a_100011290941_100010164243 [0,2,0,0,0,0|2,0,0]=4 3674 B16R2.1581 C=Cc1cc2cc[nH]c2cc1C(=O)OC 271570a_100011290941_100010253482 [0,2,0,0,0,0|0,0,2]=4 3675 B16R2.1581 C=Cc1cc2cn[nH]c2cc1C(=O)OC 271570a_100011290941_100010206789 [0,2,0,0,0,0|1,0,1]=4 3676 B16R2.1581 COC(=O)c1cc2[nH]ccc2cc1SC 62a_200000210301_100010253482 [0,2,0,0,0,0|0,0,2]=4 3677 B16R2.1581 COC(=O)c1cc2[nH]ccc2cc1S[13CH3] 62a_200025704644_100010253482 [0,2,0,0,0,0|0,0,2]=4 3678 B16R2.1581 COC(=O)c1cc2[nH]ncc2cc1SC 62a_200000210301_100010206789 [0,2,0,0,0,0|1,0,1]=4 3679 B16R2.1581 COC(=O)c1cc2[nH]ncc2cc1S[13CH3] 62a_200025704644_100010206789 [0,2,0,0,0,0|1,0,1]=4 3680 B16R2.1581 COC(=O)c1cc2c(cc1SC)OCO2 62a_100010164243_200000210301 [0,2,0,0,0,0|2,0,0]=4 3681 B16R2.1581 COC(=O)c1cc2c(cc1S[13CH3])OCO2 62a_100010164243_200025704644 [0,2,0,0,0,0|2,0,0]=4 3682 B16R2.33805 CNC(=O)c1ccc2c(c1)N(C(=O)C2)C 11a_106832991635_200000722870 [0,2,0,0,0,0|1,0,1]=4 3683 B16R2.33805 CNC(=O)c1ccc2c(c1)N(C(=O)C2)C 1626a_100102657272_200000722870 [0,2,0,0,0,0|1,0,1]=4 3684 B16R2.33805 CNC(=O)c1ccc2c(c1)N(C(=O)C2)C 240690a_100102657272_200000722870 [0,2,0,0,0,0|1,0,1]=4 3685 B16R2.33805 CNC(=O)c1ccc2c(c1)N(C(=O)C2)C 527a_100102657272_200000722870 [0,2,0,0,0,0|1,0,1]=4 3686 B16R2.173139 COC(=O)c1ccc2c(cn(c2c1)C)O 271570a_203496583355_100010163953 [0,2,0,0,0,0|0,0,2]=4 3687 B16R2.173139 COC(=O)c1ccc2c(nn(c2c1)C)O 271570a_203496583355_100010192591 [0,2,0,0,0,0|1,0,1]=4 3688 B16R2.496463 COC(=O)c1cc(c2c(c1)C(=O)CC2)O 271570a_203496583355_100020639223 [0,2,0,0,0,0|1,0,0]=3 3689 B16R2.496463 COC(=O)c1cc(c2cnn(c2c1)C)O 271570a_203496583355_100021624818 [0,2,0,0,0,0|1,0,1]=4 3690 B16R2.1469 CCN1Cc2ccc(cc2C1)C(=O)OC 2230a_100000752899_100000210202 [0,2,0,0,0,0|2,0,0]=4 3691 B16R2.1469 CCN1Cc2ccc(cc2C1)C(=O)OC 269982a_100000752899_100000204670 [0,2,0,0,0,0|2,0,0]=4 3692 B16R2.1469 CCN1Cc2ccc(cc2C1)C(=O)OC 34a_100000752899_100000210202 [0,2,0,0,0,0|2,0,0]=4 3693 B16R2.1469 COC(=O)c1ccc2c(c1)CN(C2)CF 269982a_100000752899_100015361967 [0,2,0,0,0,0|2,0,0]=4 3694 B16R2.1469 COC(=O)c1ccc2c(c1)CN(C2)CF 34a_100000752899_100015361967 [0,2,0,0,0,0|2,0,0]=4 3695 B16R2.173485 COC(=O)c1cc(c2[nH]c(=O)[nH]c2c1)O 271570a_203496583355_200010721747 [0,2,0,0,0,0|1,0,1]=4 3696 B16R2.40075 C=Cc1cc(cc2c1CCN2)C(=O)OC 271570a_100011290941_103439830445 [0,2,0,0,0,0|0,0,0]=2 3697 B16R2.40075 C=Cc1cc(cc2c1OCC2)C(=O)OC 271570a_100011290941_100021627132 [0,2,0,0,0,0|2,0,0]=4 3698 B16R2.40075 C=Cc1cc(cc2c1cc[nH]2)C(=O)OC 271570a_100011290941_100102524955 [0,2,0,0,0,0|0,0,2]=4 3699 B16R2.40075 C=Cc1cc(cc2c1cn[nH]2)C(=O)OC 271570a_100011290941_100010177789 [0,2,0,0,0,0|1,0,1]=4 3700 B16R2.40075 COC(=O)c1cc(c2cc[nH]c2c1)OC 34a_200000059727_200000210301 [0,2,0,0,0,0|0,0,2]=4 3701 B16R2.40075 COC(=O)c1cc(c2cc[nH]c2c1)OC 7a_200000059727_200000210301 [0,2,0,0,0,0|0,0,2]=4 3702 B16R2.40075 COC(=O)c1cc(c2cc[nH]c2c1)O[13CH3] 34a_200000059727_200025704644 [0,2,0,0,0,0|0,0,2]=4 3703 B16R2.40075 COC(=O)c1cc(c2cc[nH]c2c1)O[13CH3] 7a_200000059727_200025704644 [0,2,0,0,0,0|0,0,2]=4 3704 B16R2.40075 COC(=O)c1cc(c2cc[nH]c2c1)SC 62a_200000210301_100102524955 [0,2,0,0,0,0|0,0,2]=4 3705 B16R2.40075 COC(=O)c1cc(c2cc[nH]c2c1)S[13CH3] 62a_200025704644_100102524955 [0,2,0,0,0,0|0,0,2]=4 3706 B16R2.40075 COC(=O)c1cc(c2cn[nH]c2c1)SC 62a_200000210301_100010177789 [0,2,0,0,0,0|1,0,1]=4 3707 B16R2.40075 COC(=O)c1cc(c2cn[nH]c2c1)S[13CH3] 62a_200025704644_100010177789 [0,2,0,0,0,0|1,0,1]=4 3708 B16R2.40075 COC(=O)c1cc2c(c(c1)SC)CCN2 62a_103439830445_200000210301 [0,2,0,0,0,0|0,0,0]=2 3709 B16R2.40075 COC(=O)c1cc2c(c(c1)SC)CCN2 62a_200000210301_103439830445 [0,2,0,0,0,0|0,0,0]=2 3710 B16R2.40075 COC(=O)c1cc2c(c(c1)SC)OCC2 62a_100021627132_200000210301 [0,2,0,0,0,0|2,0,0]=4 3711 B16R2.40075 COC(=O)c1cc2c(c(c1)SC)OCC2 62a_200000210301_100021627132 [0,2,0,0,0,0|2,0,0]=4 3712 B16R2.40075 COC(=O)c1cc2c(c(c1)S[13CH3])CCN2 62a_103439830445_200025704644 [0,2,0,0,0,0|0,0,0]=2 3713 B16R2.40075 COC(=O)c1cc2c(c(c1)S[13CH3])CCN2 62a_200025704644_103439830445 [0,2,0,0,0,0|0,0,0]=2 3714 B16R2.40075 COC(=O)c1cc2c(c(c1)S[13CH3])OCC2 62a_100021627132_200025704644 [0,2,0,0,0,0|2,0,0]=4 3715 B16R2.40075 COC(=O)c1cc2c(c(c1)S[13CH3])OCC2 62a_200025704644_100021627132 [0,2,0,0,0,0|2,0,0]=4 3716 B16R2.447612 COC(=O)c1cc(c2c(n[nH]c2c1)O)F 271570a_203496583355_100010188400 [0,2,0,0,0,0|1,0,1]=4 3717 B16R2.42255 C=Cc1c[nH]c2c1ccc(c2)C(=O)OC 271570a_100011290941_100010236148 [0,2,0,0,0,0|0,0,2]=4 3718 B16R2.42255 C=Cc1n[nH]c2c1ccc(c2)C(=O)OC 271570a_100011290941_100010186053 [0,2,0,0,0,0|1,0,1]=4 3719 B16R2.42255 COC(=O)c1ccc2c(c[nH]c2c1)SC 62a_200000210301_100010236148 [0,2,0,0,0,0|0,0,2]=4 3720 B16R2.42255 COC(=O)c1ccc2c(c[nH]c2c1)S[13CH3] 62a_200025704644_100010236148 [0,2,0,0,0,0|0,0,2]=4 3721 B16R2.42255 COC(=O)c1ccc2c(n[nH]c2c1)SC 62a_200000210301_100010186053 [0,2,0,0,0,0|1,0,1]=4 3722 B16R2.42255 COC(=O)c1ccc2c(n[nH]c2c1)S[13CH3] 62a_200025704644_100010186053 [0,2,0,0,0,0|1,0,1]=4 3723 B12R0.248 C=CCCCNC/C=C/C(=O)OC 2230a_100000700776_100000742655 [0,0,2,0,0,0|0,0,2]=4 3724 B12R0.248 C=CCCCNC/C=C/C(=O)OC 34a_100000700776_100000742655 [0,0,2,0,0,0|0,0,2]=4 3725 B14R2.2167 COc1cc2c(cc1C)COC2=O 7a_200010662192_200000210301 [0,0,1,1,0,0|1,0,0]=3 3726 B14R2.2167 CSc1cc2c(cc1C)CCC2=O 62a_100010133461_200000210301 [0,0,1,1,0,0|2,0,0]=4 3727 B14R2.2167 CSc1cc2c(cc1C)CCC2=O 62a_200000210301_100010133461 [0,0,1,1,0,0|2,0,0]=4 3728 B14R2.2167 Cc1cc2c(cc1O[13CH3])C(=O)OC2 7a_200010662192_200025704644 [0,0,1,1,0,0|1,0,0]=3 3729 B14R2.2167 Cc1cc2c(cc1S[13CH3])C(=O)CC2 62a_100010133461_200025704644 [0,0,1,1,0,0|2,0,0]=4 3730 B14R2.2167 Cc1cc2c(cc1S[13CH3])C(=O)CC2 62a_200025704644_100010133461 [0,0,1,1,0,0|2,0,0]=4 3731 B14R2.3818 COc1c(ccc2c1CCC2=O)C 34a_100009867297_200000210301 [0,0,1,1,0,0|2,0,0]=4 3732 B14R2.3818 COc1c(ccc2c1CCC2=O)C 7a_100009867297_200000210301 [0,0,1,1,0,0|2,0,0]=4 3733 B14R2.3818 CSc1c(ccc2c1CCC2=O)C 62a_100010133459_200000210301 [0,0,1,1,0,0|2,0,0]=4 3734 B14R2.3818 CSc1c(ccc2c1CCC2=O)C 62a_200000210301_100010133459 [0,0,1,1,0,0|2,0,0]=4 3735 B14R2.3818 Cc1ccc2c(c1O[13CH3])CCC2=O 34a_100009867297_200025704644 [0,0,1,1,0,0|2,0,0]=4 3736 B14R2.3818 Cc1ccc2c(c1O[13CH3])CCC2=O 7a_100009867297_200025704644 [0,0,1,1,0,0|2,0,0]=4 3737 B14R2.3818 Cc1ccc2c(c1S[13CH3])CCC2=O 62a_100010133459_200025704644 [0,0,1,1,0,0|2,0,0]=4 3738 B14R2.3818 Cc1ccc2c(c1S[13CH3])CCC2=O 62a_200025704644_100010133459 [0,0,1,1,0,0|2,0,0]=4 3739 B14R2.964 CCC(=O)c1ccc(cc1)C2CC2 1458a_100011688853_100000210202 [0,0,1,1,0,0|2,0,0]=4 3740 B14R2.964 CCC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000211647 [0,0,1,1,0,0|2,0,0]=4 3741 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 11a_106832991635_100011688853 [0,0,1,1,0,0|2,0,0]=4 3742 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 1626a_100102657272_100011688853 [0,0,1,1,0,0|2,0,0]=4 3743 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 240690a_100102657272_100011688853 [0,0,1,1,0,0|2,0,0]=4 3744 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000155074 [0,0,1,1,0,0|2,0,0]=4 3745 B14R2.964 CNC(=O)c1ccc(cc1)C2CC2 527a_100102657272_100011688853 [0,0,1,1,0,0|2,0,0]=4 3746 B14R2.964 COC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000150774 [0,0,1,1,0,0|1,0,0]=3 3747 B14R2.964 COC(=O)c1ccc(cn1)C2CC2 271570a_100011220607_100000690920 [0,0,1,1,0,0|2,0,0]=4 3748 B14R2.964 COC(=O)c1ccc(nc1)C2CC2 271570a_100011220607_100000733799 [0,0,1,1,0,0|2,0,0]=4 3749 B14R2.527 CC=Cc1cccc2c1COC2=O 271570a_100016259895_100010167076 [0,0,1,1,0,0|1,0,1]=4 3750 B14R2.527 CCNc1cccc2c1CNC2=O 2230a_100000087543_100000210202 [0,0,1,1,0,0|1,0,0]=3 3751 B14R2.527 CCOc1cccc2c1CCC2=O 34a_100000240044_100000210202 [0,0,1,1,0,0|2,0,0]=4 3752 B14R2.527 CCOc1cccc2c1CCC2=O 7a_100000240044_100000210202 [0,0,1,1,0,0|2,0,0]=4 3753 B14R2.527 CCOc1cccc2c1CNC2=O 34a_100000098541_100000210202 [0,0,1,1,0,0|2,0,0]=4 3754 B14R2.527 CCSc1cccc2c1CCC2=O 62a_100000049675_100000210202 [0,0,1,1,0,0|2,0,0]=4 3755 B14R2.527 CCSc1cccc2c1CCC2=O 62a_100000210202_100000049675 [0,0,1,1,0,0|2,0,0]=4 3756 B14R2.527 CCSc1cccc2c1CNC2=O 62a_100000688282_100000210202 [0,0,1,1,0,0|2,0,0]=4 3757 B14R2.527 CCSc1cccc2c1COC2=O 62a_100010167076_100000210202 [0,0,1,1,0,0|1,0,0]=3 3758 B14R2.527 O=C1OCc2c1cccc2SCF 62a_100010167076_100015361967 [0,0,1,1,0,0|2,0,0]=4 3759 B14R2.965 CCC(=O)c1cccc(c1)C2CC2 1458a_100011260452_100000210202 [0,0,1,1,0,0|2,0,0]=4 3760 B14R2.965 CCC(=O)c1cccc(c1)C2CC2 271570a_100011220607_100000211677 [0,0,1,1,0,0|2,0,0]=4 3761 B14R2.965 CNC(=O)c1cccc(c1)C2CC2 11a_106832991635_100011260452 [0,0,1,1,0,0|2,0,0]=4 3762 B14R2.965 CNC(=O)c1cccc(c1)C2CC2 1626a_100102657272_100011260452 [0,0,1,1,0,0|2,0,0]=4 3763 B14R2.965 CNC(=O)c1cccc(c1)C2CC2 240690a_100102657272_100011260452 [0,0,1,1,0,0|2,0,0]=4 3764 B14R2.965 CNC(=O)c1cccc(c1)C2CC2 271570a_100011220607_100000155082 [0,0,1,1,0,0|2,0,0]=4 3765 B14R2.965 CNC(=O)c1cccc(c1)C2CC2 527a_100102657272_100011260452 [0,0,1,1,0,0|2,0,0]=4 3766 B14R2.965 COC(=O)c1cc(ccn1)C2CC2 271570a_100011220607_100000693414 [0,0,1,1,0,0|2,0,0]=4 3767 B14R2.965 COC(=O)c1cccc(c1)C2CC2 271570a_100011220607_100000148679 [0,0,1,1,0,0|1,0,0]=3 3768 B14R2.965 COC(=O)c1cccc(n1)C2CC2 271570a_100011220607_100000708286 [0,0,1,1,0,0|2,0,0]=4 3769 B14R2.965 COC(=O)c1ccnc(c1)C2CC2 271570a_100011220607_100011934382 [0,0,1,1,0,0|2,0,0]=4 3770 B14R2.965 COC(=O)c1cncc(c1)C2CC2 271570a_100011220607_100000148912 [0,0,1,1,0,0|2,0,0]=4 3771 B14R2.10782 CCC(=O)c1cccc2c1CCC2 1458a_100000051556_100000210202 [0,0,1,1,0,0|2,0,0]=4 3772 B14R2.10782 CNC(=O)c1cccc2c1CCC2 11a_106832991635_100000051556 [0,0,1,1,0,0|2,0,0]=4 3773 B14R2.10782 CNC(=O)c1cccc2c1CCC2 1626a_100102657272_100000051556 [0,0,1,1,0,0|2,0,0]=4 3774 B14R2.10782 CNC(=O)c1cccc2c1CCC2 240690a_100102657272_100000051556 [0,0,1,1,0,0|2,0,0]=4 3775 B14R2.10782 CNC(=O)c1cccc2c1CCC2 527a_100102657272_100000051556 [0,0,1,1,0,0|2,0,0]=4 3776 B14R2.1802 COc1ccc2c(c1C)COC2=O 7a_100010675704_200000210301 [0,0,1,1,0,0|2,0,0]=4 3777 B14R2.1802 CSc1ccc2c(c1C)COC2=O 62a_100010986288_200000210301 [0,0,1,1,0,0|2,0,0]=4 3778 B14R2.1802 Cc1c(ccc2c1COC2=O)O[13CH3] 7a_100010675704_200025704644 [0,0,1,1,0,0|2,0,0]=4 3779 B14R2.1802 Cc1c(ccc2c1COC2=O)S[13CH3] 62a_100010986288_200025704644 [0,0,1,1,0,0|2,0,0]=4 3780 B14R3.3015 c1cc2c(cc1C3CC3)NCC2 271570a_100011220607_100000754641 [1,0,0,1,0,0|1,0,1]=4 3781 B16R3.1779 C1=C(CCC1)c2ccc3c(c2)NCC3 271570a_100000089523_100000754641 [0,1,0,1,0,0|2,0,0]=4 3782 B16R3.1779 C1=C(CCO1)c2cc3c(cn2)CCN3 271570a_100000118173_100020639910 [0,1,0,1,0,0|2,0,0]=4 3783 B16R3.1779 C1=C(CCO1)c2ccc3c(c2)CCC3 271570a_100000118173_100000745594 [0,1,0,1,0,0|2,0,0]=4 3784 B16R3.1779 C1=C(CCO1)c2ccc3c(c2)NCC3 271570a_100000118173_100000754641 [0,1,0,1,0,0|1,0,0]=3 3785 B16R3.1779 C1=C(CCO1)c2ccc3c(c2)OCC3 271570a_100000118173_100009818566 [0,1,0,1,0,0|2,0,0]=4 3786 B16R3.1779 C1=C(CCO1)c2cnc3c(c2)NCC3 271570a_100000118173_100000698607 [0,1,0,1,0,0|2,0,0]=4 3787 B16R3.1779 C1=C(COC1)c2cc3c(cn2)CCN3 271570a_100009872500_100020639910 [0,1,0,1,0,0|2,0,0]=4 3788 B16R3.1779 C1=C(COC1)c2ccc3c(c2)CCC3 271570a_100009872500_100000745594 [0,1,0,1,0,0|2,0,0]=4 3789 B16R3.1779 C1=C(COC1)c2ccc3c(c2)NCC3 271570a_100009872500_100000754641 [0,1,0,1,0,0|1,0,0]=3 3790 B16R3.1779 C1=C(COC1)c2ccc3c(c2)OCC3 271570a_100009872500_100009818566 [0,1,0,1,0,0|2,0,0]=4 3791 B16R3.1779 C1=C(COC1)c2cnc3c(c2)NCC3 271570a_100009872500_100000698607 [0,1,0,1,0,0|2,0,0]=4 3792 B16R3.1779 c1cc(co1)c2ccc3c(c2)NCC3 271570a_100011218838_100000754641 [0,1,0,1,0,0|1,0,1]=4 3793 B16R3.1779 c1coc(c1)c2ccc3c(c2)NCC3 271570a_100000750936_100000754641 [0,1,0,1,0,0|1,0,1]=4 3794 B16R3.10656 C=C(c1ccc2c(c1)NCC2)C3CC3 271570a_100010895485_100000754641 [0,1,0,1,0,0|2,0,0]=4 3795 B12R1.63 COC(=O)c1cc(c([nH]1)C)SC 62a_200000210301_100010501536 [0,0,1,0,1,0|2,0,0]=4 3796 B12R1.63 COC(=O)c1cc(c([nH]1)C)S[13CH3] 62a_200025704644_100010501536 [0,0,1,0,1,0|2,0,0]=4 3797 B12R1.63 COC(=O)c1cc(c(s1)SC)C 62a_100011219469_200000210301 [0,0,1,0,1,0|2,0,0]=4 3798 B12R1.63 COC(=O)c1cc(c(s1)SC)C 62a_200000210301_100011219469 [0,0,1,0,1,0|2,0,0]=4 3799 B12R1.63 COC(=O)c1cc(c(s1)S[13CH3])C 62a_100011219469_200025704644 [0,0,1,0,1,0|2,0,0]=4 3800 B12R1.63 COC(=O)c1cc(c(s1)S[13CH3])C 62a_200025704644_100011219469 [0,0,1,0,1,0|2,0,0]=4 3801 B12R1.743 COC(=O)c1scc(c1SC)C 62a_200000210301_100000716566 [0,0,1,0,1,0|2,0,0]=4 3802 B12R1.743 COC(=O)c1scc(c1S[13CH3])C 62a_200025704644_100000716566 [0,0,1,0,1,0|2,0,0]=4 3803 B12R1.291 CCOc1cc[nH]c1C(=O)OC 34a_100000131702_100000210202 [0,0,1,0,1,0|2,0,0]=4 3804 B12R1.291 CCOc1ccsc1C(=O)OC 7a_100000043449_100000210202 [0,0,1,0,1,0|2,0,0]=4 3805 B12R1.291 CCSc1cc[nH]c1C(=O)OC 62a_100000210202_100102525103 [0,0,1,0,1,0|2,0,0]=4 3806 B12R1.291 CCSc1ccoc1C(=O)OC 62a_100000210202_100012676306 [0,0,1,0,1,0|2,0,0]=4 3807 B12R1.291 CCSc1ccsc1C(=O)OC 62a_100000210202_100000730364 [0,0,1,0,1,0|2,0,0]=4 3808 B12R1.291 CCSc1cscc1C(=O)OC 62a_100000210202_100012351140 [0,0,1,0,1,0|2,0,0]=4 3809 B12R1.291 CCSc1cscc1C(=O)OC 62a_100012351140_100000210202 [0,0,1,0,1,0|2,0,0]=4 3810 B12R1.291 CCSc1occc1C(=O)OC 62a_100000210202_100011935261 [0,0,1,0,1,0|2,0,0]=4 3811 B12R1.291 CCSc1sccc1C(=O)OC 62a_100000210202_100009822520 [0,0,1,0,1,0|2,0,0]=4 3812 B12R1.291 CCSc1sccc1C(=O)OC 62a_100009822520_100000210202 [0,0,1,0,1,0|2,0,0]=4 3813 B12R2.1384 C=C(C)c1ccc2c(c1)CC2 271570a_100000694244_100009818592 [1,0,0,0,1,0|1,0,0]=3 3814 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_200000210301 [1,0,0,0,1,0|0,0,0]=2 3815 B12R2.1384 [13CH3]C(=O)c1ccc2c(c1)CC2 1458a_100000137882_200025704644 [1,0,0,0,1,0|0,0,0]=2 3816 B12R2.143 C=C=Cc1ccc2c(c1)CC2 271570a_100015277604_100009818592 [1,0,0,0,1,0|1,0,1]=4 3817 B12R2.143 CC=Cc1ccc2c(c1)CC2 271570a_100016259895_100009818592 [1,0,0,0,1,0|1,0,0]=3 3818 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100000210202_100009818592 [1,0,0,0,1,0|2,0,0]=4 3819 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100009818592_100000210202 [1,0,0,0,1,0|2,0,0]=4 3820 B12R2.143 CNCc1ccc2c(c1)CC2 207a_100102657272_100010273998 [1,0,0,0,1,0|1,0,1]=4 3821 B12R2.143 CNCc1ccc2c(c1)CC2 270004a_106832991635_100010273998 [1,0,0,0,1,0|1,0,1]=4 3822 B12R2.143 COCc1ccc2c(c1)CC2 34a_100010733339_200000210301 [1,0,0,0,1,0|0,0,1]=3 3823 B12R2.143 COCc1ccc2c(c1)CC2 7a_100010733339_200000210301 [1,0,0,0,1,0|0,0,1]=3 3824 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 34a_100010733339_200025704644 [1,0,0,0,1,0|0,0,1]=3 3825 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 7a_100010733339_200025704644 [1,0,0,0,1,0|0,0,1]=3 3826 B14R1.3405 CCC(=O)Nc1ccc(c(c1)NC)C 34a_100000740061_200000210301 [0,0,1,0,0,1|1,0,0]=3 3827 B14R1.3405 CCC(=O)Nc1ccc(c(c1)NC)C 7a_100000740061_200000210301 [0,0,1,0,0,1|1,0,0]=3 3828 B14R1.3405 CCC(=O)Nc1ccc(c(c1)NC)F 34a_100011193610_200000210301 [0,0,1,0,0,1|2,0,0]=4 3829 B14R1.3405 CCC(=O)Nc1ccc(c(c1)N[13CH3])C 34a_100000740061_200025704644 [0,0,1,0,0,1|1,0,0]=3 3830 B14R1.3405 CCC(=O)Nc1ccc(c(c1)N[13CH3])C 7a_100000740061_200025704644 [0,0,1,0,0,1|1,0,0]=3 3831 B14R1.3405 CCC(=O)Nc1ccc(c(c1)N[13CH3])F 34a_100011193610_200025704644 [0,0,1,0,0,1|2,0,0]=4 3832 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 11a_100011279678_100000210414 [0,0,1,0,0,1|2,0,0]=4 3833 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 1626a_100011279678_100000210414 [0,0,1,0,0,1|2,0,0]=4 3834 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 22a_100011279678_100000210414 [0,0,1,0,0,1|2,0,0]=4 3835 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 527a_100011279678_100000210414 [0,0,1,0,0,1|2,0,0]=4 3836 B14R1.3405 CNC(=O)Nc1ccc(c(c1)OC)C 2430a_100011279678_100102657272 [0,0,1,0,0,1|2,0,0]=4 3837 B14R1.3405 CNC(=O)Nc1ccc(c(c1)OC)C 512a_100011279678_100102657272 [0,0,1,0,0,1|2,0,0]=4 3838 B14R1.3405 CNc1cc(ccc1C)SC(C)OC 62a_100009879195_100020629602 [0,0,1,0,0,1|1,0,1]=4 3839 B14R1.3405 CNc1cc(ccc1C)SC(C)OC 62a_100020629602_100009879195 [0,0,1,0,0,1|1,0,1]=4 3840 B14R1.3405 COC(=O)Cc1cc(c(cn1)C)SC 62a_100015669916_200000210301 [0,0,1,0,0,1|2,0,0]=4 3841 B14R1.3405 COC(=O)Cc1cc(c(cn1)C)SC 62a_200000210301_100015669916 [0,0,1,0,0,1|2,0,0]=4 3842 B14R1.3405 COC(=O)Cc1cc(c(cn1)C)S[13CH3] 62a_100015669916_200025704644 [0,0,1,0,0,1|2,0,0]=4 3843 B14R1.3405 COC(=O)Cc1cc(c(cn1)C)S[13CH3] 62a_200025704644_100015669916 [0,0,1,0,0,1|2,0,0]=4 3844 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)N 34a_200009957001_200000210301 [0,0,1,0,0,1|2,0,0]=4 3845 B14R1.3405 COC(=O)Cc1ccc(c(c1)O[13CH3])N 34a_200009957001_200025704644 [0,0,1,0,0,1|2,0,0]=4 3846 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)F 62a_100011435807_200000210301 [0,0,1,0,0,1|2,0,0]=4 3847 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)F 62a_200000210301_100011435807 [0,0,1,0,0,1|2,0,0]=4 3848 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)O 62a_100010222482_200000210301 [0,0,1,0,0,1|2,0,0]=4 3849 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)O 62a_200000210301_100010222482 [0,0,1,0,0,1|2,0,0]=4 3850 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])F 62a_100011435807_200025704644 [0,0,1,0,0,1|2,0,0]=4 3851 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])F 62a_200025704644_100011435807 [0,0,1,0,0,1|2,0,0]=4 3852 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010222482_200025704644 [0,0,1,0,0,1|2,0,0]=4 3853 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010222482 [0,0,1,0,0,1|2,0,0]=4 3854 B14R1.24 CCC(=O)Nc1ccc(cc1)CCO 22a_100011204434_100000210414 [0,0,1,0,0,1|2,0,0]=4 3855 B14R1.24 CCC(=O)Nc1ccc(cc1)CCO 527a_100011204434_100000210414 [0,0,1,0,0,1|2,0,0]=4 3856 B14R1.24 CCCc1ccc(cc1)CC(=O)CC 1458a_100000186164_100000210202 [0,0,1,0,0,1|2,0,0]=4 3857 B14R1.24 CCCc1ccc(cc1)CC(=O)CC 1458a_100000210414_100011982809 [0,0,1,0,0,1|2,0,0]=4 3858 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 11a_106832991635_100000186164 [0,0,1,0,0,1|2,0,0]=4 3859 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 1626a_100102657272_100000186164 [0,0,1,0,0,1|2,0,0]=4 3860 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 240690a_100102657272_100000186164 [0,0,1,0,0,1|2,0,0]=4 3861 B14R1.24 CCCc1ccc(cc1)CC(=O)NC 527a_100102657272_100000186164 [0,0,1,0,0,1|2,0,0]=4 3862 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 11a_100000211780_100000210414 [0,0,1,0,0,1|2,0,0]=4 3863 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 1626a_100000211780_100000210414 [0,0,1,0,0,1|2,0,0]=4 3864 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 22a_100000211780_100000210414 [0,0,1,0,0,1|2,0,0]=4 3865 B14R1.24 CCCc1ccc(cc1)NC(=O)CC 527a_100000211780_100000210414 [0,0,1,0,0,1|2,0,0]=4 3866 B14R1.24 CCCc1ccc(cc1)NC(=O)NC 2430a_100000211780_100102657272 [0,0,1,0,0,1|2,0,0]=4 3867 B14R1.24 CCOc1ccc(cc1)CC(=O)OC 34a_100000211648_100000210202 [0,0,1,0,0,1|2,0,0]=4 3868 B14R1.24 CCOc1ccc(cc1)NC(=O)OC 34a_100011235918_100000210202 [0,0,1,0,0,1|2,0,0]=4 3869 B14R1.24 CCSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000210202 [0,0,1,0,0,1|2,0,0]=4 3870 B14R1.24 CCSc1ccc(cc1)CC(=O)OC 62a_100000210202_100000149743 [0,0,1,0,0,1|2,0,0]=4 3871 B14R1.24 CCSc1ccc(cc1)NC(=O)OC 62a_100000210202_100000181880 [0,0,1,0,0,1|2,0,0]=4 3872 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 2230a_106832991635_100009816886 [0,0,1,0,0,1|2,0,0]=4 3873 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 270004a_106832991635_100009886798 [0,0,1,0,0,1|2,0,0]=4 3874 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 34a_100102657272_100009816886 [0,0,1,0,0,1|2,0,0]=4 3875 B14R1.24 CNCc1ccc(cc1)CC(=O)OC 7a_106832991635_100009816886 [0,0,1,0,0,1|2,0,0]=4 3876 B14R1.24 COC(=O)Cc1ccc(cc1)CO[13CH3] 34a_100000087118_200025704644 [0,0,1,0,0,1|2,0,0]=4 3877 B14R1.24 COC(=O)Cc1ccc(cc1)CSC 62a_100009816886_200000210301 [0,0,1,0,0,1|2,0,0]=4 3878 B14R1.24 COC(=O)Cc1ccc(cc1)CSC 62a_200000210301_100009816886 [0,0,1,0,0,1|2,0,0]=4 3879 B14R1.24 COC(=O)Cc1ccc(cc1)CS[13CH3] 62a_100009816886_200025704644 [0,0,1,0,0,1|2,0,0]=4 3880 B14R1.24 COC(=O)Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100009816886 [0,0,1,0,0,1|2,0,0]=4 3881 B14R1.24 COC(=O)Cc1ccc(cc1)OCF 34a_100000211648_100015361967 [0,0,1,0,0,1|2,0,0]=4 3882 B14R1.24 COC(=O)Cc1ccc(cc1)SCF 62a_100000149743_100015361967 [0,0,1,0,0,1|2,0,0]=4 3883 B14R1.24 COC(=O)Cc1ccc(cc1)SCF 62a_100015361967_100000149743 [0,0,1,0,0,1|2,0,0]=4 3884 B14R1.24 COC(=O)Nc1ccc(cc1)OCF 34a_100011235918_100015361967 [0,0,1,0,0,1|2,0,0]=4 3885 B14R1.24 COC(=O)Nc1ccc(cc1)SCF 62a_100015361967_100000181880 [0,0,1,0,0,1|2,0,0]=4 3886 B14R1.24 COC(C)Sc1ccc(cc1)CCN 62a_100000755846_100009879195 [0,0,1,0,0,1|1,0,1]=4 3887 B14R1.24 COC(C)Sc1ccc(cc1)CCN 62a_100009879195_100000755846 [0,0,1,0,0,1|1,0,1]=4 3888 B14R1.24 COCc1ccc(cc1)CC(=O)OC 34a_100000087118_200000210301 [0,0,1,0,0,1|2,0,0]=4 3889 B14R1.24 COCc1ccc(cc1)CC(=O)OC 34a_100138415774_100009816886 [0,0,1,0,0,1|2,0,0]=4 3890 B14R1.470 C=CC(=O)Nc1cccc(c1)NCC 34a_100012282147_100000210202 [0,0,1,0,0,1|1,0,1]=4 3891 B14R1.470 CC=Cc1cccc(c1)CC(=O)OC 271570a_100016259895_100000699549 [0,0,1,0,0,1|1,0,1]=4 3892 B14R1.470 CCC(=O)Nc1cccc(c1)NCF 34a_100000186510_100015361967 [0,0,1,0,0,1|2,0,0]=4 3893 B14R1.470 CCNc1cc(ncn1)CC(=O)OC 27a_100015525214_100000104187 [0,0,1,0,0,1|2,0,0]=4 3894 B14R1.470 CCNc1cccc(c1)CC(=O)NC 2230a_100011690097_100000210202 [0,0,1,0,0,1|1,0,0]=3 3895 B14R1.470 CCNc1cccc(c1)CC(=O)NC 34a_100011690097_100000210202 [0,0,1,0,0,1|1,0,0]=3 3896 B14R1.470 CCNc1cccc(c1)NC(=O)CC 34a_100000186510_100000210202 [0,0,1,0,0,1|1,0,0]=3 3897 B14R1.470 CCNc1cccc(c1)SC(C)OC 62a_100009879195_100000738899 [0,0,1,0,0,1|1,0,1]=4 3898 B14R1.470 CCOc1cccc(c1)CC(=O)CC 1458a_100000690747_100000210202 [0,0,1,0,0,1|2,0,0]=4 3899 B14R1.470 CCOc1cccc(c1)CC(=O)NC 11a_106832991635_100000690747 [0,0,1,0,0,1|2,0,0]=4 3900 B14R1.470 CCOc1cccc(c1)CC(=O)NC 1626a_100102657272_100000690747 [0,0,1,0,0,1|2,0,0]=4 3901 B14R1.470 CCOc1cccc(c1)CC(=O)NC 240690a_100102657272_100000690747 [0,0,1,0,0,1|2,0,0]=4 3902 B14R1.470 CCOc1cccc(c1)CC(=O)NC 527a_100102657272_100000690747 [0,0,1,0,0,1|2,0,0]=4 3903 B14R1.470 CCOc1cccc(c1)NC(=O)CC 11a_100000742568_100000210414 [0,0,1,0,0,1|2,0,0]=4 3904 B14R1.470 CCOc1cccc(c1)NC(=O)CC 1626a_100000742568_100000210414 [0,0,1,0,0,1|2,0,0]=4 3905 B14R1.470 CCOc1cccc(c1)NC(=O)CC 22a_100000742568_100000210414 [0,0,1,0,0,1|2,0,0]=4 3906 B14R1.470 CCOc1cccc(c1)NC(=O)CC 34a_100000158609_100000210202 [0,0,1,0,0,1|2,0,0]=4 3907 B14R1.470 CCOc1cccc(c1)NC(=O)CC 527a_100000742568_100000210414 [0,0,1,0,0,1|2,0,0]=4 3908 B14R1.470 CCOc1cccc(c1)NC(=O)CC 7a_100000158609_100000210202 [0,0,1,0,0,1|2,0,0]=4 3909 B14R1.470 CCOc1cccc(c1)NC(=O)NC 2430a_100000742568_100102657272 [0,0,1,0,0,1|2,0,0]=4 3910 B14R1.470 CCOc1cccc(c1)NC(=O)OC 34a_100000741004_100000210202 [0,0,1,0,0,1|1,0,0]=3 3911 B14R1.470 CCOc1cccc(c1)NC(=O)OC 7a_100000741004_100000210202 [0,0,1,0,0,1|1,0,0]=3 3912 B14R1.470 CCSc1cc(ccn1)CC(=O)OC 62a_100000210202_100010135589 [0,0,1,0,0,1|2,0,0]=4 3913 B14R1.470 CCSc1cc(ccn1)CC(=O)OC 62a_100010135589_100000210202 [0,0,1,0,0,1|2,0,0]=4 3914 B14R1.470 CCSc1cccc(c1)CC(=O)OC 62a_100000210202_100000699549 [0,0,1,0,0,1|1,0,0]=3 3915 B14R1.470 CCSc1cccc(c1)CC(=O)OC 62a_100000699549_100000210202 [0,0,1,0,0,1|1,0,0]=3 3916 B14R1.470 CCSc1cccc(n1)CC(=O)OC 62a_100000094215_100000210202 [0,0,1,0,0,1|2,0,0]=4 3917 B14R1.470 CCSc1cccc(n1)CC(=O)OC 62a_100000210202_100000094215 [0,0,1,0,0,1|2,0,0]=4 3918 B14R1.470 CCSc1ccnc(c1)CC(=O)OC 62a_100000210202_100010275543 [0,0,1,0,0,1|2,0,0]=4 3919 B14R1.470 CCSc1ccnc(c1)CC(=O)OC 62a_100010275543_100000210202 [0,0,1,0,0,1|2,0,0]=4 3920 B14R1.470 CNC(=O)Cc1cccc(c1)NCF 34a_100011690097_100015361967 [0,0,1,0,0,1|2,0,0]=4 3921 B14R1.470 COC(=O)Cc1cccc(c1)SCF 62a_100000699549_100015361967 [0,0,1,0,0,1|2,0,0]=4 3922 B14R1.470 COC(=O)Cc1cccc(c1)SCF 62a_100015361967_100000699549 [0,0,1,0,0,1|2,0,0]=4 3923 B14R1.470 COC(=O)Nc1cccc(c1)OCF 34a_100000741004_100015361967 [0,0,1,0,0,1|2,0,0]=4 3924 B14R1.470 COC(=O)Nc1cccc(c1)OCF 7a_100000741004_100015361967 [0,0,1,0,0,1|2,0,0]=4 3925 B14R1.588 COC(=O)CC(=O)C=CC1=CCCC1 1458a_100016262312_100000747449 [0,0,1,0,0,1|2,0,0]=4 3926 B14R1.3276 C=Cc1ccc(cc1N)NC(=O)OC 271570a_100011290941_100012639261 [0,0,1,0,0,1|0,0,2]=4 3927 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 11a_100000766362_100000210414 [0,0,1,0,0,1|2,0,0]=4 3928 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 1626a_100000766362_100000210414 [0,0,1,0,0,1|2,0,0]=4 3929 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 22a_100000766362_100000210414 [0,0,1,0,0,1|2,0,0]=4 3930 B14R1.3276 CCC(=O)Nc1ccc(c(c1)Cl)CC 527a_100000766362_100000210414 [0,0,1,0,0,1|2,0,0]=4 3931 B14R1.3276 CCc1ccc(cc1Cl)NC(=O)NC 2430a_100000766362_100102657272 [0,0,1,0,0,1|2,0,0]=4 3932 B14R1.3276 CCc1ccc(cc1N)SC(C)OC 62a_100009879195_100012354963 [0,0,1,0,0,1|1,0,1]=4 3933 B14R1.3276 CCc1ccc(cc1N)SC(C)OC 62a_100012354963_100009879195 [0,0,1,0,0,1|1,0,1]=4 3934 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)OC 34a_100010222482_200000210301 [0,0,1,0,0,1|2,0,0]=4 3935 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)OC 7a_100010222482_200000210301 [0,0,1,0,0,1|2,0,0]=4 3936 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010222482_200025704644 [0,0,1,0,0,1|2,0,0]=4 3937 B14R1.3276 COC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010222482_200025704644 [0,0,1,0,0,1|2,0,0]=4 3938 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)OC 34a_100000087474_200000210301 [0,0,1,0,0,1|2,0,0]=4 3939 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)OC 7a_100000087474_200000210301 [0,0,1,0,0,1|2,0,0]=4 3940 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_100000087474_200025704644 [0,0,1,0,0,1|2,0,0]=4 3941 B14R1.3276 COC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_100000087474_200025704644 [0,0,1,0,0,1|2,0,0]=4 3942 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)OC 34a_100009994800_200000210301 [0,0,1,0,0,1|2,0,0]=4 3943 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)OC 7a_100009994800_200000210301 [0,0,1,0,0,1|2,0,0]=4 3944 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_100009994800_200025704644 [0,0,1,0,0,1|2,0,0]=4 3945 B14R1.3276 COC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_100009994800_200025704644 [0,0,1,0,0,1|2,0,0]=4 3946 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)OC 34a_100000699185_200000210301 [0,0,1,0,0,1|2,0,0]=4 3947 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)OC 7a_100000699185_200000210301 [0,0,1,0,0,1|2,0,0]=4 3948 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)O[13CH3] 34a_100000699185_200025704644 [0,0,1,0,0,1|2,0,0]=4 3949 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)O[13CH3] 7a_100000699185_200025704644 [0,0,1,0,0,1|2,0,0]=4 3950 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)SC 62a_100010371902_200000210301 [0,0,1,0,0,1|2,0,0]=4 3951 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)SC 62a_200000210301_100010371902 [0,0,1,0,0,1|2,0,0]=4 3952 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)S[13CH3] 62a_100010371902_200025704644 [0,0,1,0,0,1|2,0,0]=4 3953 B14R1.3276 COC(=O)Cc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100010371902 [0,0,1,0,0,1|2,0,0]=4 3954 B14R1.3276 COC(=O)Cc1ccc(c(c1)N)OC 34a_100000067991_200000210301 [0,0,1,0,0,1|1,0,0]=3 3955 B14R1.3276 COC(=O)Cc1ccc(c(c1)N)O[13CH3] 34a_100000067991_200025704644 [0,0,1,0,0,1|1,0,0]=3 3956 B14R1.3276 COC(=O)Cc1ccc(c(c1)O)OC 271570a_203496583355_200012357789 [0,0,1,0,0,1|2,0,0]=4 3957 B14R1.3276 COC(=O)Nc1ccc(c(c1)N)SC 62a_200000210301_100012639261 [0,0,1,0,0,1|1,0,0]=3 3958 B14R1.3276 COC(=O)Nc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100012639261 [0,0,1,0,0,1|1,0,0]=3 3959 B14R2.781 C=C(C)c1ccc2c(c1)CCCC2 271570a_100000694244_100011221367 [1,0,0,0,0,1|2,0,0]=4 3960 B14R2.781 C=C(C)c1ccc2c(c1)CCCN2 271570a_100000694244_100016994925 [1,0,0,0,0,1|2,0,0]=4 3961 B14R2.781 C=C(C)c1ccc2c(c1)CCCO2 271570a_100000694244_100011393166 [1,0,0,0,0,1|2,0,0]=4 3962 B14R2.781 C=C(C)c1ccc2c(c1)CCNC2 271570a_100000694244_100000686056 [1,0,0,0,0,1|2,0,0]=4 3963 B14R2.781 C=C(C)c1ccc2c(c1)CNCC2 271570a_100000694244_100015189961 [1,0,0,0,0,1|1,0,0]=3 3964 B14R2.781 C=C(C)c1ccc2c(c1)COCC2 271570a_100000694244_100010128096 [1,0,0,0,0,1|2,0,0]=4 3965 B14R2.781 C=C(C)c1ccc2c(c1)NCCC2 271570a_100000694244_100010196366 [1,0,0,0,0,1|1,0,0]=3 3966 B14R2.781 C=C(C)c1ccc2c(c1)NCCO2 271570a_100000694244_100000708519 [1,0,0,0,0,1|1,0,0]=3 3967 B14R2.781 C=C(C)c1ccc2c(c1)NCCS2 271570a_100000694244_100013243616 [1,0,0,0,0,1|1,0,0]=3 3968 B14R2.781 C=C(C)c1ccc2c(c1)OCCC2 271570a_100000694244_100010700467 [1,0,0,0,0,1|2,0,0]=4 3969 B14R2.781 C=C(C)c1ccc2c(c1)OCCN2 271570a_100000694244_100012355470 [1,0,0,0,0,1|2,0,0]=4 3970 B14R2.781 C=C(C)c1ccc2c(c1)OCCO2 271570a_100000694244_100000184379 [1,0,0,0,0,1|2,0,0]=4 3971 B14R2.781 C=C(C)c1ccc2c(n1)NCCC2 271570a_100000694244_100009952728 [1,0,0,0,0,1|2,0,0]=4 3972 B14R2.781 C=C(C)c1ccc2c(n1)NCCO2 271570a_100000694244_100010209492 [1,0,0,0,0,1|2,0,0]=4 3973 B14R2.781 C=C(C)c1cnc2c(c1)NCCO2 271570a_100000694244_100000700286 [1,0,0,0,0,1|2,0,0]=4 3974 B14R2.781 CC(=O)c1ccc2c(c1)CCCC2 1458a_100000199106_200000210301 [1,0,0,0,0,1|1,0,0]=3 3975 B14R2.781 CC(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_200000210301 [1,0,0,0,0,1|1,0,0]=3 3976 B14R2.781 CC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_200000210301 [1,0,0,0,0,1|1,0,0]=3 3977 B14R2.781 [13CH3]C(=O)c1ccc2c(c1)CCCC2 1458a_100000199106_200025704644 [1,0,0,0,0,1|1,0,0]=3 3978 B14R2.781 [13CH3]C(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_200025704644 [1,0,0,0,0,1|1,0,0]=3 3979 B14R2.781 [13CH3]C(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_200025704644 [1,0,0,0,0,1|1,0,0]=3 3980 B14R2.112 C=C=Cc1ccc2c(c1)CNCC2 271570a_100015277604_100015189961 [1,0,0,0,0,1|1,0,1]=4 3981 B14R2.112 C=C=Cc1ccc2c(c1)NCCC2 271570a_100015277604_100010196366 [1,0,0,0,0,1|1,0,1]=4 3982 B14R2.112 C=C=Cc1ccc2c(c1)NCCO2 271570a_100015277604_100000708519 [1,0,0,0,0,1|1,0,1]=4 3983 B14R2.112 C=C=Cc1ccc2c(c1)NCCS2 271570a_100015277604_100013243616 [1,0,0,0,0,1|1,0,1]=4 3984 B14R2.112 CC=Cc1ccc2c(c1)CCCC2 271570a_100016259895_100011221367 [1,0,0,0,0,1|2,0,0]=4 3985 B14R2.112 CC=Cc1ccc2c(c1)CCCN2 271570a_100016259895_100016994925 [1,0,0,0,0,1|2,0,0]=4 3986 B14R2.112 CC=Cc1ccc2c(c1)CCCO2 271570a_100016259895_100011393166 [1,0,0,0,0,1|2,0,0]=4 3987 B14R2.112 CC=Cc1ccc2c(c1)CCNC2 271570a_100016259895_100000686056 [1,0,0,0,0,1|2,0,0]=4 3988 B14R2.112 CC=Cc1ccc2c(c1)CNCC2 271570a_100016259895_100015189961 [1,0,0,0,0,1|1,0,0]=3 3989 B14R2.112 CC=Cc1ccc2c(c1)COCC2 271570a_100016259895_100010128096 [1,0,0,0,0,1|2,0,0]=4 3990 B14R2.112 CC=Cc1ccc2c(c1)NCCC2 271570a_100016259895_100010196366 [1,0,0,0,0,1|1,0,0]=3 3991 B14R2.112 CC=Cc1ccc2c(c1)NCCO2 271570a_100016259895_100000708519 [1,0,0,0,0,1|1,0,0]=3 3992 B14R2.112 CC=Cc1ccc2c(c1)NCCS2 271570a_100016259895_100013243616 [1,0,0,0,0,1|1,0,0]=3 3993 B14R2.112 CC=Cc1ccc2c(c1)OCCC2 271570a_100016259895_100010700467 [1,0,0,0,0,1|2,0,0]=4 3994 B14R2.112 CC=Cc1ccc2c(c1)OCCN2 271570a_100016259895_100012355470 [1,0,0,0,0,1|2,0,0]=4 3995 B14R2.112 CC=Cc1ccc2c(c1)OCCO2 271570a_100016259895_100000184379 [1,0,0,0,0,1|2,0,0]=4 3996 B14R2.112 CC=Cc1ccc2c(n1)NCCC2 271570a_100016259895_100009952728 [1,0,0,0,0,1|2,0,0]=4 3997 B14R2.112 CC=Cc1ccc2c(n1)NCCO2 271570a_100016259895_100010209492 [1,0,0,0,0,1|2,0,0]=4 3998 B14R2.112 CC=Cc1cnc2c(c1)NCCO2 271570a_100016259895_100000700286 [1,0,0,0,0,1|2,0,0]=4 3999 B14R2.112 CCOc1ccc2c(c1)CNCC2 34a_100015185785_100000210202 [1,0,0,0,0,1|2,0,0]=4 4000 B14R2.112 CCOc1ccc2c(c1)NCCC2 34a_106638131596_100000210202 [1,0,0,0,0,1|2,0,0]=4 4001 B14R2.112 CCOc1ccc2c(c1)NCCO2 34a_100020636358_100000210202 [1,0,0,0,0,1|2,0,0]=4 4002 B14R2.112 CCSc1ccc2c(c1)CNCC2 62a_100000210202_100015189961 [1,0,0,0,0,1|2,0,0]=4 4003 B14R2.112 CCSc1ccc2c(c1)CNCC2 62a_100015189961_100000210202 [1,0,0,0,0,1|2,0,0]=4 4004 B14R2.112 CCSc1ccc2c(c1)NCCC2 62a_100000210202_100010196366 [1,0,0,0,0,1|2,0,0]=4 4005 B14R2.112 CCSc1ccc2c(c1)NCCC2 62a_100010196366_100000210202 [1,0,0,0,0,1|2,0,0]=4 4006 B14R2.112 CCSc1ccc2c(c1)NCCO2 62a_100000210202_100000708519 [1,0,0,0,0,1|2,0,0]=4 4007 B14R2.112 CCSc1ccc2c(c1)NCCS2 62a_100000210202_100013243616 [1,0,0,0,0,1|2,0,0]=4 4008 B14R2.112 COCc1ccc2c(c1)CNCC2 34a_100138411858_200000210301 [1,0,0,0,0,1|0,0,1]=3 4009 B14R2.112 COCc1ccc2c(c1)OCCO2 34a_100000745213_200000210301 [1,0,0,0,0,1|1,0,1]=4 4010 B14R2.112 [13CH3]OCc1ccc2c(c1)CNCC2 34a_100138411858_200025704644 [1,0,0,0,0,1|0,0,1]=3 4011 B14R2.112 [13CH3]OCc1ccc2c(c1)OCCO2 34a_100000745213_200025704644 [1,0,0,0,0,1|1,0,1]=4 4012 B14R2.10892 COC(C)Sc1ccc2c(c1)CC2 62a_100009818592_100009879195 [0,0,0,0,1,1|1,0,1]=4 4013 B14R2.10892 COC(C)Sc1ccc2c(c1)CC2 62a_100009879195_100009818592 [0,0,0,0,1,1|1,0,1]=4 4014 B16R2.5347 CCC(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_100000210202 [0,0,0,0,0,2|2,0,0]=4 4015 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCC2 11a_100011205400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4016 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCC2 1626a_100011205400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4017 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCC2 22a_100011205400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4018 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCC2 527a_100011205400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4019 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCO2 11a_100138412508_100000210414 [0,0,0,0,0,2|2,0,0]=4 4020 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCO2 1626a_100138412508_100000210414 [0,0,0,0,0,2|2,0,0]=4 4021 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCO2 22a_100138412508_100000210414 [0,0,0,0,0,2|2,0,0]=4 4022 B16R2.5347 CCC(=O)Nc1ccc2c(c1)CCCO2 527a_100138412508_100000210414 [0,0,0,0,0,2|2,0,0]=4 4023 B16R2.5347 CCC(=O)Nc1ccc2c(c1)OCCO2 11a_100020630400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4024 B16R2.5347 CCC(=O)Nc1ccc2c(c1)OCCO2 1626a_100020630400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4025 B16R2.5347 CCC(=O)Nc1ccc2c(c1)OCCO2 22a_100020630400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4026 B16R2.5347 CCC(=O)Nc1ccc2c(c1)OCCO2 527a_100020630400_100000210414 [0,0,0,0,0,2|2,0,0]=4 4027 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 11a_106832991635_100000184005 [0,0,0,0,0,2|2,0,0]=4 4028 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 1626a_100102657272_100000184005 [0,0,0,0,0,2|2,0,0]=4 4029 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 240690a_100102657272_100000184005 [0,0,0,0,0,2|2,0,0]=4 4030 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 527a_100102657272_100000184005 [0,0,0,0,0,2|2,0,0]=4 4031 B16R2.5347 CNC(=O)Nc1ccc2c(c1)CCCC2 2430a_100011205400_100102657272 [0,0,0,0,0,2|2,0,0]=4 4032 B16R2.5347 CNC(=O)Nc1ccc2c(c1)CCCO2 2430a_100138412508_100102657272 [0,0,0,0,0,2|2,0,0]=4 4033 B16R2.5347 CNC(=O)Nc1ccc2c(c1)CCCO2 512a_100138412508_100102657272 [0,0,0,0,0,2|2,0,0]=4 4034 B16R2.5347 CNC(=O)Nc1ccc2c(c1)OCCO2 2430a_100020630400_100102657272 [0,0,0,0,0,2|2,0,0]=4 4035 B16R2.5347 CNC(=O)Nc1ccc2c(c1)OCCO2 512a_100020630400_100102657272 [0,0,0,0,0,2|2,0,0]=4 4036 B16R2.5347 COC(C)Sc1ccc2c(c1)CNCC2 62a_100009879195_100015189961 [0,0,0,0,0,2|1,0,1]=4 4037 B16R2.5347 COC(C)Sc1ccc2c(c1)CNCC2 62a_100015189961_100009879195 [0,0,0,0,0,2|1,0,1]=4 4038 B16R2.5347 COC(C)Sc1ccc2c(c1)NCCC2 62a_100009879195_100010196366 [0,0,0,0,0,2|1,0,1]=4 4039 B16R2.5347 COC(C)Sc1ccc2c(c1)NCCC2 62a_100010196366_100009879195 [0,0,0,0,0,2|1,0,1]=4 4040 B16R2.5347 COC(C)Sc1ccc2c(c1)NCCO2 62a_100009879195_100000708519 [0,0,0,0,0,2|1,0,1]=4 4041 B16R2.5347 COC(C)Sc1ccc2c(c1)NCCS2 62a_100009879195_100013243616 [0,0,0,0,0,2|1,0,1]=4 4042 B16R2.171832 CCC(=O)c1ccc2c(c1)OCCCO2 1458a_100000198587_100000210202 [0,0,0,0,0,2|2,0,0]=4 4043 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 11a_106832991635_100000198587 [0,0,0,0,0,2|2,0,0]=4 4044 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 1626a_100102657272_100000198587 [0,0,0,0,0,2|2,0,0]=4 4045 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 240690a_100102657272_100000198587 [0,0,0,0,0,2|2,0,0]=4 4046 B16R2.171832 CNC(=O)c1ccc2c(c1)OCCCO2 527a_100102657272_100000198587 [0,0,0,0,0,2|2,0,0]=4 4047 B16R2.1357 CCC(=O)COc1ccc2c(c1)CCC2 1458a_100000183705_100000210202 [0,0,0,0,0,2|2,0,0]=4 4048 B16R2.1357 CCC(=O)COc1ccc2c(c1)CCC2 7a_100000209987_100000747405 [0,0,0,0,0,2|2,0,0]=4 4049 B16R2.1357 CCC(=O)CSc1cc2c(cn1)CCN2 62a_100000747405_100020639910 [0,0,0,0,0,2|2,0,0]=4 4050 B16R2.1357 CCC(=O)CSc1cc2c(cn1)CCN2 62a_100020639910_100000747405 [0,0,0,0,0,2|2,0,0]=4 4051 B16R2.1357 CCC(=O)CSc1ccc2c(c1)CCC2 62a_100000745594_100000747405 [0,0,0,0,0,2|2,0,0]=4 4052 B16R2.1357 CCC(=O)CSc1ccc2c(c1)CCC2 62a_100000747405_100000745594 [0,0,0,0,0,2|2,0,0]=4 4053 B16R2.1357 CCC(=O)CSc1ccc2c(c1)NCC2 62a_100000747405_100000754641 [0,0,0,0,0,2|1,0,0]=3 4054 B16R2.1357 CCC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000747405 [0,0,0,0,0,2|1,0,0]=3 4055 B16R2.1357 CCC(=O)CSc1ccc2c(c1)OCC2 62a_100000747405_100009818566 [0,0,0,0,0,2|2,0,0]=4 4056 B16R2.1357 CCC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747405 [0,0,0,0,0,2|2,0,0]=4 4057 B16R2.1357 CCC(=O)CSc1cnc2c(c1)NCC2 62a_100000698607_100000747405 [0,0,0,0,0,2|2,0,0]=4 4058 B16R2.1357 CCC(=O)CSc1cnc2c(c1)NCC2 62a_100000747405_100000698607 [0,0,0,0,0,2|2,0,0]=4 4059 B16R2.1357 CCC(=O)NNc1ccc2c(c1)CCC2 22a_100015187744_100000210414 [0,0,0,0,0,2|2,0,0]=4 4060 B16R2.1357 CNC(=O)CNc1ccc2c(c1)CCC2 2230a_100000211504_100000183359 [0,0,0,0,0,2|2,0,0]=4 4061 B16R2.1357 CNC(=O)CNc1ccc2c(c1)CCC2 34a_100000211504_100000183359 [0,0,0,0,0,2|2,0,0]=4 4062 B16R2.1357 CNC(=O)COc1ccc2c(c1)CCC2 11a_106832991635_100000183705 [0,0,0,0,0,2|2,0,0]=4 4063 B16R2.1357 CNC(=O)COc1ccc2c(c1)CCC2 1626a_100102657272_100000183705 [0,0,0,0,0,2|2,0,0]=4 4064 B16R2.1357 CNC(=O)COc1ccc2c(c1)CCC2 240690a_100102657272_100000183705 [0,0,0,0,0,2|2,0,0]=4 4065 B16R2.1357 CNC(=O)COc1ccc2c(c1)CCC2 34a_100000209987_100000183359 [0,0,0,0,0,2|2,0,0]=4 4066 B16R2.1357 CNC(=O)COc1ccc2c(c1)CCC2 527a_100102657272_100000183705 [0,0,0,0,0,2|2,0,0]=4 4067 B16R2.1357 CNC(=O)COc1ccc2c(c1)CCC2 7a_100000209987_100000183359 [0,0,0,0,0,2|2,0,0]=4 4068 B16R2.1357 CNC(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000183359 [0,0,0,0,0,2|1,0,0]=3 4069 B16R2.1357 CNC(=O)CSc1cc2c(cn1)CCN2 62a_100000183359_100020639910 [0,0,0,0,0,2|2,0,0]=4 4070 B16R2.1357 CNC(=O)CSc1cc2c(cn1)CCN2 62a_100020639910_100000183359 [0,0,0,0,0,2|2,0,0]=4 4071 B16R2.1357 CNC(=O)CSc1ccc2c(c1)CCC2 62a_100000183359_100000745594 [0,0,0,0,0,2|2,0,0]=4 4072 B16R2.1357 CNC(=O)CSc1ccc2c(c1)CCC2 62a_100000745594_100000183359 [0,0,0,0,0,2|2,0,0]=4 4073 B16R2.1357 CNC(=O)CSc1ccc2c(c1)NCC2 62a_100000183359_100000754641 [0,0,0,0,0,2|1,0,0]=3 4074 B16R2.1357 CNC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000183359 [0,0,0,0,0,2|1,0,0]=3 4075 B16R2.1357 CNC(=O)CSc1ccc2c(c1)OCC2 62a_100000183359_100009818566 [0,0,0,0,0,2|2,0,0]=4 4076 B16R2.1357 CNC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000183359 [0,0,0,0,0,2|2,0,0]=4 4077 B16R2.1357 CNC(=O)CSc1cnc2c(c1)NCC2 62a_100000183359_100000698607 [0,0,0,0,0,2|2,0,0]=4 4078 B16R2.1357 CNC(=O)CSc1cnc2c(c1)NCC2 62a_100000698607_100000183359 [0,0,0,0,0,2|2,0,0]=4 4079 B16R2.1357 CNC(=O)NNc1ccc2c(c1)CCC2 273464a_100102657272_100015187744 [0,0,0,0,0,2|2,0,0]=4 4080 B16R2.1357 CNC(=O)NNc1ccc2c(c1)CCC2 512a_106832991638_100015187744 [0,0,0,0,0,2|2,0,0]=4 4081 B16R2.1357 COC(=O)CNc1ccc2c(c1)CCC2 2230a_100000211504_100000747449 [0,0,0,0,0,2|1,0,0]=3 4082 B16R2.1357 COC(=O)CNc1ccc2c(c1)CCC2 34a_100000211504_100000747449 [0,0,0,0,0,2|1,0,0]=3 4083 B16R2.1357 COC(=O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000747449 [0,0,0,0,0,2|2,0,0]=4 4084 B16R2.1357 COC(=O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000747449 [0,0,0,0,0,2|2,0,0]=4 4085 B16R2.1357 COC(=O)CNc1ccc2c(c1)COC2 2230a_100011728444_100000747449 [0,0,0,0,0,2|2,0,0]=4 4086 B16R2.1357 COC(=O)CNc1ccc2c(c1)COC2 34a_100011728444_100000747449 [0,0,0,0,0,2|2,0,0]=4 4087 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747449 [0,0,0,0,0,2|2,0,0]=4 4088 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000747449 [0,0,0,0,0,2|2,0,0]=4 4089 B16R2.1357 COC(=O)COc1ccc2c(c1)CCC2 34a_100000209987_100000747449 [0,0,0,0,0,2|1,0,0]=3 4090 B16R2.1357 COC(=O)COc1ccc2c(c1)CCC2 7a_100000209987_100000747449 [0,0,0,0,0,2|1,0,0]=3 4091 B16R2.1357 COC(=O)COc1ccc2c(c1)CCN2 34a_100020636429_100000747449 [0,0,0,0,0,2|2,0,0]=4 4092 B16R2.1357 COC(=O)COc1ccc2c(c1)CNC2 34a_100015195982_100000747449 [0,0,0,0,0,2|2,0,0]=4 4093 B16R2.1357 COC(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000747449 [0,0,0,0,0,2|0,0,0]=2 4094 B16R2.1357 COC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000747449 [0,0,0,0,0,2|2,0,0]=4 4095 B16R2.1357 COC(=O)COc1ccc2cc[nH]c2c1 34a_100000036713_100000747449 [0,0,0,0,0,2|0,0,2]=4 4096 B16R2.1357 COC(=O)CSc1cc2c(cn1)CCN2 62a_100000747449_100020639910 [0,0,0,0,0,2|1,0,0]=3 4097 B16R2.1357 COC(=O)CSc1cc2c(cn1)CCN2 62a_100020639910_100000747449 [0,0,0,0,0,2|1,0,0]=3 4098 B16R2.1357 COC(=O)CSc1ccc2c(c1)C=CC2 62a_100000747449_100009814306 [0,0,0,0,0,2|1,0,1]=4 4099 B16R2.1357 COC(=O)CSc1ccc2c(c1)C=CC2 62a_100009814306_100000747449 [0,0,0,0,0,2|1,0,1]=4 4100 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCC2 62a_100000745594_100000747449 [0,0,0,0,0,2|1,0,0]=3 4101 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCC2 62a_100000747449_100000745594 [0,0,0,0,0,2|1,0,0]=3 4102 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCN2 62a_100000691068_100000747449 [0,0,0,0,0,2|2,0,0]=4 4103 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCN2 62a_100000747449_100000691068 [0,0,0,0,0,2|2,0,0]=4 4104 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000747449 [0,0,0,0,0,2|2,0,0]=4 4105 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCO2 62a_100000747449_100000729065 [0,0,0,0,0,2|2,0,0]=4 4106 B16R2.1357 COC(=O)CSc1ccc2c(c1)CNC2 62a_100000702344_100000747449 [0,0,0,0,0,2|2,0,0]=4 4107 B16R2.1357 COC(=O)CSc1ccc2c(c1)CNC2 62a_100000747449_100000702344 [0,0,0,0,0,2|2,0,0]=4 4108 B16R2.1357 COC(=O)CSc1ccc2c(c1)COC2 62a_100000698232_100000747449 [0,0,0,0,0,2|2,0,0]=4 4109 B16R2.1357 COC(=O)CSc1ccc2c(c1)COC2 62a_100000747449_100000698232 [0,0,0,0,0,2|2,0,0]=4 4110 B16R2.1357 COC(=O)CSc1ccc2c(c1)NCC2 62a_100000747449_100000754641 [0,0,0,0,0,2|0,0,0]=2 4111 B16R2.1357 COC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000747449 [0,0,0,0,0,2|0,0,0]=2 4112 B16R2.1357 COC(=O)CSc1ccc2c(c1)OCC2 62a_100000747449_100009818566 [0,0,0,0,0,2|1,0,0]=3 4113 B16R2.1357 COC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747449 [0,0,0,0,0,2|1,0,0]=3 4114 B16R2.1357 COC(=O)CSc1ccc2c(n1)CCC2 62a_100000046531_100000747449 [0,0,0,0,0,2|2,0,0]=4 4115 B16R2.1357 COC(=O)CSc1ccc2c(n1)CCC2 62a_100000747449_100000046531 [0,0,0,0,0,2|2,0,0]=4 4116 B16R2.1357 COC(=O)CSc1ccc2cc[nH]c2c1 62a_100000747449_100000743809 [0,0,0,0,0,2|0,0,2]=4 4117 B16R2.1357 COC(=O)CSc1ccc2cn[nH]c2c1 62a_100000747449_100000049514 [0,0,0,0,0,2|1,0,1]=4 4118 B16R2.1357 COC(=O)CSc1ccc2nn[nH]c2c1 62a_100000747449_100009817464 [0,0,0,0,0,2|2,0,0]=4 4119 B16R2.1357 COC(=O)CSc1cnc2c(c1)CCC2 62a_100000693888_100000747449 [0,0,0,0,0,2|2,0,0]=4 4120 B16R2.1357 COC(=O)CSc1cnc2c(c1)CCC2 62a_100000747449_100000693888 [0,0,0,0,0,2|2,0,0]=4 4121 B16R2.1357 COC(=O)CSc1cnc2c(c1)NCC2 62a_100000698607_100000747449 [0,0,0,0,0,2|1,0,0]=3 4122 B16R2.1357 COC(=O)CSc1cnc2c(c1)NCC2 62a_100000747449_100000698607 [0,0,0,0,0,2|1,0,0]=3 4123 B11R0.40 C=CCCNC/C=C/C(=O)OC 2230a_100015191253_100000742655 [1,0,2,0,0,0|0,0,1]=4 4124 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [2,0,1,0,0,0|1,0,0]=4 4125 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [2,0,1,0,0,0|1,0,0]=4 4126 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [2,0,1,0,0,0|1,0,0]=4 4127 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [2,0,1,0,0,0|1,0,0]=4 4128 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [2,0,1,0,0,0|0,0,0]=3 4129 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [2,0,1,0,0,0|1,0,0]=4 4130 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [2,0,1,0,0,0|1,0,0]=4 4131 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [2,0,1,0,0,0|1,0,0]=4 4132 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [2,0,1,0,0,0|1,0,0]=4 4133 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [2,0,1,0,0,0|1,0,0]=4 4134 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [2,0,1,0,0,0|1,0,0]=4 4135 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [2,0,1,0,0,0|1,0,0]=4 4136 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [2,0,1,0,0,0|1,0,0]=4 4137 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [2,0,1,0,0,0|1,0,0]=4 4138 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [2,0,1,0,0,0|1,0,0]=4 4139 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [2,0,1,0,0,0|1,0,0]=4 4140 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [2,0,1,0,0,0|1,0,0]=4 4141 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [2,0,1,0,0,0|1,0,0]=4 4142 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [2,0,1,0,0,0|1,0,0]=4 4143 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [2,0,1,0,0,0|1,0,0]=4 4144 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [2,0,1,0,0,0|1,0,0]=4 4145 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [2,0,1,0,0,0|1,0,0]=4 4146 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [2,0,1,0,0,0|0,0,0]=3 4147 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [2,0,1,0,0,0|1,0,0]=4 4148 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [2,0,1,0,0,0|1,0,0]=4 4149 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [2,0,1,0,0,0|1,0,0]=4 4150 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [2,0,1,0,0,0|1,0,0]=4 4151 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [2,0,1,0,0,0|1,0,0]=4 4152 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [2,0,1,0,0,0|1,0,0]=4 4153 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [2,0,1,0,0,0|1,0,0]=4 4154 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [2,0,1,0,0,0|1,0,0]=4 4155 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [2,0,1,0,0,0|1,0,0]=4 4156 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [2,0,1,0,0,0|1,0,0]=4 4157 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [2,0,1,0,0,0|1,0,0]=4 4158 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [2,0,1,0,0,0|0,0,0]=3 4159 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [2,0,1,0,0,0|0,0,0]=3 4160 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [2,0,1,0,0,0|1,0,0]=4 4161 B11R1.266 CNc1cccc(n1)C(=O)C 27a_100102657272_100000085735 [2,0,1,0,0,0|1,0,0]=4 4162 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [2,0,1,0,0,0|1,0,0]=4 4163 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [2,0,1,0,0,0|1,0,0]=4 4164 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [2,0,1,0,0,0|1,0,0]=4 4165 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [2,0,1,0,0,0|1,0,0]=4 4166 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [2,0,1,0,0,0|1,0,0]=4 4167 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [2,0,1,0,0,0|1,0,0]=4 4168 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [2,0,1,0,0,0|1,0,0]=4 4169 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [2,0,1,0,0,0|1,0,0]=4 4170 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [2,0,1,0,0,0|1,0,0]=4 4171 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [2,0,1,0,0,0|1,0,0]=4 4172 B11R1.280 C=Cc1ccc(c(c1)NC)C 271570a_100011290941_100020629602 [2,0,1,0,0,0|0,0,1]=4 4173 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [2,0,1,0,0,0|0,0,1]=4 4174 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [2,0,1,0,0,0|0,0,1]=4 4175 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [2,0,1,0,0,0|0,0,1]=4 4176 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [2,0,1,0,0,0|0,0,1]=4 4177 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [2,0,1,0,0,0|0,0,1]=4 4178 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [2,0,1,0,0,0|0,0,1]=4 4179 B11R1.280 CNc1cc(ccc1Br)OC 34a_100000748603_200000210301 [2,0,1,0,0,0|1,0,0]=4 4180 B11R1.280 CNc1cc(ccc1C)CO 2230a_100000758420_200000210301 [2,0,1,0,0,0|0,0,1]=4 4181 B11R1.280 CNc1cc(ccc1C)CO 34a_100000758420_200000210301 [2,0,1,0,0,0|0,0,1]=4 4182 B11R1.280 CNc1cc(ccc1C)OC 2230a_100000760359_200000210301 [2,0,1,0,0,0|0,0,0]=3 4183 B11R1.280 CNc1cc(ccc1C)OC 34a_100000760359_200000210301 [2,0,1,0,0,0|0,0,0]=3 4184 B11R1.280 CNc1cc(ccc1C)SC 62a_100020629602_200000210301 [2,0,1,0,0,0|0,1,0]=4 4185 B11R1.280 CNc1cc(ccc1C)SC 62a_200000210301_100020629602 [2,0,1,0,0,0|0,1,0]=4 4186 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_100020629602_200025704644 [2,0,1,0,0,0|0,1,0]=4 4187 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_200025704644_100020629602 [2,0,1,0,0,0|0,1,0]=4 4188 B11R1.280 CNc1cc(ccc1Cl)OC 34a_100000745576_200000210301 [2,0,1,0,0,0|1,0,0]=4 4189 B11R1.280 CNc1cc(ccc1F)OC 34a_100000764331_200000210301 [2,0,1,0,0,0|1,0,0]=4 4190 B11R1.280 CNc1cc(ccc1I)OC 34a_100000748021_200000210301 [2,0,1,0,0,0|1,0,0]=4 4191 B11R1.280 CNc1cc(ccc1O)OC 34a_100000188146_200000210301 [2,0,1,0,0,0|1,0,0]=4 4192 B11R1.280 COc1cc(ccc1C)O[13CH3] 34a_100009865632_200025704644 [2,0,1,0,0,0|1,0,0]=4 4193 B11R1.280 COc1cc(ccc1C)O[13CH3] 7a_100009865632_200025704644 [2,0,1,0,0,0|1,0,0]=4 4194 B11R1.280 COc1ccc(c(c1)N[13CH3])Br 34a_100000748603_200025704644 [2,0,1,0,0,0|1,0,0]=4 4195 B11R1.280 COc1ccc(c(c1)N[13CH3])C 2230a_100000760359_200025704644 [2,0,1,0,0,0|0,0,0]=3 4196 B11R1.280 COc1ccc(c(c1)N[13CH3])C 34a_100000760359_200025704644 [2,0,1,0,0,0|0,0,0]=3 4197 B11R1.280 COc1ccc(c(c1)N[13CH3])Cl 34a_100000745576_200025704644 [2,0,1,0,0,0|1,0,0]=4 4198 B11R1.280 COc1ccc(c(c1)N[13CH3])F 34a_100000764331_200025704644 [2,0,1,0,0,0|1,0,0]=4 4199 B11R1.280 COc1ccc(c(c1)N[13CH3])I 34a_100000748021_200025704644 [2,0,1,0,0,0|1,0,0]=4 4200 B11R1.280 COc1ccc(c(c1)N[13CH3])O 34a_100000188146_200025704644 [2,0,1,0,0,0|1,0,0]=4 4201 B11R1.280 COc1ccc(c(c1)OC)C 34a_100009865632_200000210301 [2,0,1,0,0,0|1,0,0]=4 4202 B11R1.280 COc1ccc(c(c1)OC)C 34a_100012179981_200000210301 [2,0,1,0,0,0|1,0,0]=4 4203 B11R1.280 COc1ccc(c(c1)OC)C 7a_100009865632_200000210301 [2,0,1,0,0,0|1,0,0]=4 4204 B11R1.280 COc1ccc(c(c1)OC)C 7a_100012179981_200000210301 [2,0,1,0,0,0|1,0,0]=4 4205 B11R1.280 COc1ccc(c(c1)O[13CH3])C 34a_100012179981_200025704644 [2,0,1,0,0,0|1,0,0]=4 4206 B11R1.280 COc1ccc(c(c1)O[13CH3])C 7a_100012179981_200025704644 [2,0,1,0,0,0|1,0,0]=4 4207 B11R1.280 COc1ccc(c(c1)SC)C 62a_100012349166_200000210301 [2,0,1,0,0,0|1,0,0]=4 4208 B11R1.280 COc1ccc(c(c1)SC)C 62a_200000210301_100012349166 [2,0,1,0,0,0|1,0,0]=4 4209 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_100012349166_200025704644 [2,0,1,0,0,0|1,0,0]=4 4210 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_200025704644_100012349166 [2,0,1,0,0,0|1,0,0]=4 4211 B11R1.280 CSc1cc(ccc1C)C=O 62a_100000695567_200000210301 [2,0,1,0,0,0|1,0,0]=4 4212 B11R1.280 CSc1cc(ccc1C)C=O 62a_200000210301_100000695567 [2,0,1,0,0,0|1,0,0]=4 4213 B11R1.280 Cc1ccc(cc1N[13CH3])CO 2230a_100000758420_200025704644 [2,0,1,0,0,0|0,0,1]=4 4214 B11R1.280 Cc1ccc(cc1N[13CH3])CO 34a_100000758420_200025704644 [2,0,1,0,0,0|0,0,1]=4 4215 B11R1.280 Cc1ccc(cc1S[13CH3])C=O 62a_100000695567_200025704644 [2,0,1,0,0,0|1,0,0]=4 4216 B11R1.280 Cc1ccc(cc1S[13CH3])C=O 62a_200025704644_100000695567 [2,0,1,0,0,0|1,0,0]=4 4217 B11R1.189 C=Cc1cccc(c1)NCC 271570a_100011290941_100000738899 [2,0,1,0,0,0|0,0,1]=4 4218 B11R1.189 C=Cc1cccc(c1)NCC 34a_100011827668_100000210202 [2,0,1,0,0,0|0,0,1]=4 4219 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [2,0,1,0,0,0|1,0,0]=4 4220 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [2,0,1,0,0,0|1,0,0]=4 4221 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [2,0,1,0,0,0|1,0,0]=4 4222 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [2,0,1,0,0,0|1,0,0]=4 4223 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [2,0,1,0,0,0|1,0,0]=4 4224 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [2,0,1,0,0,0|1,0,0]=4 4225 B11R1.189 CCNc1cccc(c1)CC 2230a_100000211250_100000210202 [2,0,1,0,0,0|0,0,1]=4 4226 B11R1.189 CCNc1cccc(c1)CC 34a_100000211250_100000210202 [2,0,1,0,0,0|0,0,1]=4 4227 B11R1.189 CCNc1cccc(c1)CC 7a_100000211250_100000210202 [2,0,1,0,0,0|0,0,1]=4 4228 B11R1.189 CCNc1cccc(c1)CO 2230a_100000211919_100000210202 [2,0,1,0,0,0|0,0,1]=4 4229 B11R1.189 CCNc1cccc(c1)CO 34a_100000211919_100000210202 [2,0,1,0,0,0|0,0,1]=4 4230 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [2,0,1,0,0,0|0,0,0]=3 4231 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [2,0,1,0,0,0|0,0,0]=3 4232 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [2,0,1,0,0,0|0,0,0]=3 4233 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [2,0,1,0,0,0|0,0,0]=3 4234 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [2,0,1,0,0,0|0,0,0]=3 4235 B11R1.189 CCNc1cccc(c1)SC 2230a_100000210049_100000210202 [2,0,1,0,0,0|0,1,0]=4 4236 B11R1.189 CCNc1cccc(c1)SC 34a_100000210049_100000210202 [2,0,1,0,0,0|0,1,0]=4 4237 B11R1.189 CCNc1cccc(c1)SC 62a_200000210301_100000738899 [2,0,1,0,0,0|0,1,0]=4 4238 B11R1.189 CCNc1cccc(c1)S[13CH3] 62a_200025704644_100000738899 [2,0,1,0,0,0|0,1,0]=4 4239 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [2,0,1,0,0,0|1,0,0]=4 4240 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [2,0,1,0,0,0|1,0,0]=4 4241 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [2,0,1,0,0,0|1,0,0]=4 4242 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [2,0,1,0,0,0|1,0,0]=4 4243 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [2,0,1,0,0,0|1,0,0]=4 4244 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [2,0,1,0,0,0|1,0,0]=4 4245 B11R1.189 CCSc1cccc(c1)C=O 62a_100000014684_100000210202 [2,0,1,0,0,0|1,0,0]=4 4246 B11R1.189 CCSc1cccc(c1)C=O 62a_100000210202_100000014684 [2,0,1,0,0,0|1,0,0]=4 4247 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [2,0,1,0,0,0|1,0,0]=4 4248 B11R1.189 CNc1cccc(c1)COC 2230a_100000737370_200000210301 [2,0,1,0,0,0|0,0,1]=4 4249 B11R1.189 CNc1cccc(c1)COC 34a_100000737370_200000210301 [2,0,1,0,0,0|0,0,1]=4 4250 B11R1.189 COCc1cccc(c1)N[13CH3] 2230a_100000737370_200025704644 [2,0,1,0,0,0|0,0,1]=4 4251 B11R1.189 COCc1cccc(c1)N[13CH3] 34a_100000737370_200025704644 [2,0,1,0,0,0|0,0,1]=4 4252 B11R1.189 COc1cccc(c1)NCF 34a_100000210024_100015361967 [2,0,1,0,0,0|1,0,0]=4 4253 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [2,0,1,0,0,0|1,0,0]=4 4254 B11R1.192 CC=Cc1ccc(c(c1)N)C 271570a_100016259895_100000761890 [2,0,1,0,0,0|1,0,0]=4 4255 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [2,0,1,0,0,0|0,0,1]=4 4256 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [2,0,1,0,0,0|0,0,1]=4 4257 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [2,0,1,0,0,0|0,0,1]=4 4258 B11R1.192 COCc1ccc(c(c1)N)C 34a_100000758420_200000210301 [2,0,1,0,0,0|0,0,1]=4 4259 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [2,0,1,0,0,0|0,0,1]=4 4260 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [2,0,1,0,0,0|0,0,1]=4 4261 B11R1.192 Cc1ccc(cc1N)CO[13CH3] 34a_100000758420_200025704644 [2,0,1,0,0,0|0,0,1]=4 4262 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [2,0,1,0,0,0|1,0,0]=4 4263 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [2,0,1,0,0,0|1,0,0]=4 4264 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [2,0,1,0,0,0|1,0,0]=4 4265 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [2,0,1,0,0,0|1,0,0]=4 4266 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [2,0,1,0,0,0|1,0,0]=4 4267 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [2,0,1,0,0,0|1,0,0]=4 4268 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [2,0,1,0,0,0|1,0,0]=4 4269 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [2,0,1,0,0,0|1,0,0]=4 4270 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [2,0,1,0,0,0|1,0,0]=4 4271 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [2,0,1,0,0,0|1,0,0]=4 4272 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [2,0,1,0,0,0|1,0,0]=4 4273 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [2,0,1,0,0,0|1,0,0]=4 4274 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [2,0,1,0,0,0|1,0,0]=4 4275 B11R1.3 C=C(C)c1ccc(cc1)CN 271570a_100000694244_100016989417 [2,0,1,0,0,0|1,0,0]=4 4276 B11R1.3 CC(=O)c1ccc(cc1)CO 1458a_100000183892_200000210301 [2,0,1,0,0,0|1,0,0]=4 4277 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 34a_100000185113_200025704644 [2,0,1,0,0,0|1,0,0]=4 4278 B11R1.3 CC(=O)c1ccc(cc1)O[13CH3] 7a_100000185113_200025704644 [2,0,1,0,0,0|1,0,0]=4 4279 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_100000185465_200025704644 [2,0,1,0,0,0|1,0,0]=4 4280 B11R1.3 CC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000185465 [2,0,1,0,0,0|1,0,0]=4 4281 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [2,0,1,0,0,0|0,0,0]=3 4282 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [2,0,1,0,0,0|0,0,0]=3 4283 B11R1.3 COc1ccc(cc1)C(=O)C 1458a_100000184203_200000210301 [2,0,1,0,0,0|1,0,0]=4 4284 B11R1.3 COc1ccc(cc1)C(=O)C 34a_100000185113_200000210301 [2,0,1,0,0,0|1,0,0]=4 4285 B11R1.3 COc1ccc(cc1)C(=O)C 7a_100000185113_200000210301 [2,0,1,0,0,0|1,0,0]=4 4286 B11R1.3 COc1ccc(cc1)C(=O)[13CH3] 1458a_100000184203_200025704644 [2,0,1,0,0,0|1,0,0]=4 4287 B11R1.3 CSc1ccc(cc1)C(=O)C 1458a_100000189692_200000210301 [2,0,1,0,0,0|1,0,0]=4 4288 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_100000185465_200000210301 [2,0,1,0,0,0|1,0,0]=4 4289 B11R1.3 CSc1ccc(cc1)C(=O)C 62a_200000210301_100000185465 [2,0,1,0,0,0|1,0,0]=4 4290 B11R1.3 CSc1ccc(cc1)C(=O)[13CH3] 1458a_100000189692_200025704644 [2,0,1,0,0,0|1,0,0]=4 4291 B11R1.3 [13CH3]C(=O)c1ccc(cc1)CO 1458a_100000183892_200025704644 [2,0,1,0,0,0|1,0,0]=4 4292 B11R1.83 C=Cc1ccc(cc1)CCN 271570a_100011290941_100000755846 [2,0,1,0,0,0|0,0,1]=4 4293 B11R1.83 CC=Cc1ccc(cc1)CC 271570a_100016259895_100011215824 [2,0,1,0,0,0|1,0,0]=4 4294 B11R1.83 CC=Cc1ccc(cc1)CN 271570a_100016259895_100016989417 [2,0,1,0,0,0|1,0,0]=4 4295 B11R1.83 CCCc1ccc(cc1)OC 34a_100000749406_200000210301 [2,0,1,0,0,0|1,0,0]=4 4296 B11R1.83 CCCc1ccc(cc1)OC 7a_100000749406_200000210301 [2,0,1,0,0,0|1,0,0]=4 4297 B11R1.83 CCCc1ccc(cc1)O[13CH3] 34a_100000749406_200025704644 [2,0,1,0,0,0|1,0,0]=4 4298 B11R1.83 CCCc1ccc(cc1)O[13CH3] 7a_100000749406_200025704644 [2,0,1,0,0,0|1,0,0]=4 4299 B11R1.83 CCc1ccc(cc1)COC 34a_100000702245_200000210301 [2,0,1,0,0,0|0,0,1]=4 4300 B11R1.83 CCc1ccc(cc1)COC 34a_100138415774_100000747183 [2,0,1,0,0,0|0,0,1]=4 4301 B11R1.83 CCc1ccc(cc1)COC 7a_100000702245_200000210301 [2,0,1,0,0,0|0,0,1]=4 4302 B11R1.83 CCc1ccc(cc1)CO[13CH3] 34a_100000702245_200025704644 [2,0,1,0,0,0|0,0,1]=4 4303 B11R1.83 CCc1ccc(cc1)CO[13CH3] 7a_100000702245_200025704644 [2,0,1,0,0,0|0,0,1]=4 4304 B11R1.83 COCc1ccc(cc1)CN 34a_100015189231_200000210301 [2,0,1,0,0,0|0,0,1]=4 4305 B11R1.83 COc1ccc(cc1)CCBr 34a_100009816426_200000210301 [2,0,1,0,0,0|1,0,0]=4 4306 B11R1.83 COc1ccc(cc1)CCBr 7a_100009816426_200000210301 [2,0,1,0,0,0|1,0,0]=4 4307 B11R1.83 COc1ccc(cc1)CCN 34a_100000743037_200000210301 [2,0,1,0,0,0|0,0,0]=3 4308 B11R1.83 COc1ccc(cc1)CCO 34a_100011215338_200000210301 [2,0,1,0,0,0|1,0,0]=4 4309 B11R1.83 COc1ccc(cc1)CCO 7a_100011215338_200000210301 [2,0,1,0,0,0|1,0,0]=4 4310 B11R1.83 CSc1ccc(cc1)CCN 62a_100000755846_200000210301 [2,0,1,0,0,0|0,1,0]=4 4311 B11R1.83 CSc1ccc(cc1)CCN 62a_200000210301_100000755846 [2,0,1,0,0,0|0,1,0]=4 4312 B11R1.83 [13CH3]OCc1ccc(cc1)CN 34a_100015189231_200025704644 [2,0,1,0,0,0|0,0,1]=4 4313 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 34a_100009816426_200025704644 [2,0,1,0,0,0|1,0,0]=4 4314 B11R1.83 [13CH3]Oc1ccc(cc1)CCBr 7a_100009816426_200025704644 [2,0,1,0,0,0|1,0,0]=4 4315 B11R1.83 [13CH3]Oc1ccc(cc1)CCN 34a_100000743037_200025704644 [2,0,1,0,0,0|0,0,0]=3 4316 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 34a_100011215338_200025704644 [2,0,1,0,0,0|1,0,0]=4 4317 B11R1.83 [13CH3]Oc1ccc(cc1)CCO 7a_100011215338_200025704644 [2,0,1,0,0,0|1,0,0]=4 4318 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_100000755846_200025704644 [2,0,1,0,0,0|0,1,0]=4 4319 B11R1.83 [13CH3]Sc1ccc(cc1)CCN 62a_200025704644_100000755846 [2,0,1,0,0,0|0,1,0]=4 4320 B11R1.279 C=Cc1ccc(c(c1)N)CC 271570a_100011290941_100012354963 [2,0,1,0,0,0|0,0,1]=4 4321 B11R1.279 CCc1ccc(cc1Cl)OC 34a_100009886192_200000210301 [2,0,1,0,0,0|1,0,0]=4 4322 B11R1.279 CCc1ccc(cc1Cl)OC 7a_100009886192_200000210301 [2,0,1,0,0,0|1,0,0]=4 4323 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 34a_100009886192_200025704644 [2,0,1,0,0,0|1,0,0]=4 4324 B11R1.279 CCc1ccc(cc1Cl)O[13CH3] 7a_100009886192_200025704644 [2,0,1,0,0,0|1,0,0]=4 4325 B11R1.279 CCc1ccc(cc1N)SC 62a_100012354963_200000210301 [2,0,1,0,0,0|0,1,0]=4 4326 B11R1.279 CCc1ccc(cc1N)SC 62a_200000210301_100012354963 [2,0,1,0,0,0|0,1,0]=4 4327 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_100012354963_200025704644 [2,0,1,0,0,0|0,1,0]=4 4328 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_200025704644_100012354963 [2,0,1,0,0,0|0,1,0]=4 4329 B11R1.279 COc1ccc(c(c1)N)OC 34a_100000188146_200000210301 [2,0,1,0,0,0|1,0,0]=4 4330 B11R1.279 COc1ccc(c(c1)N)O[13CH3] 34a_100000188146_200025704644 [2,0,1,0,0,0|1,0,0]=4 4331 B11R1.279 COc1ccc(c(c1)N)SC 62a_100000748021_200000210301 [2,0,1,0,0,0|1,0,0]=4 4332 B11R1.279 COc1ccc(c(c1)N)SC 62a_200000210301_100000748021 [2,0,1,0,0,0|1,0,0]=4 4333 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_100000748021_200025704644 [2,0,1,0,0,0|1,0,0]=4 4334 B11R1.279 COc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100000748021 [2,0,1,0,0,0|1,0,0]=4 4335 B11R2.36 Oc1cc2c(cn1)CCN2 271570a_203496583355_100020639910 [3,0,0,0,0,0|1,0,0]=4 4336 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [3,0,0,0,0,0|1,0,0]=4 4337 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [3,0,0,0,0,0|0,0,0]=3 4338 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [3,0,0,0,0,0|1,0,0]=4 4339 B11R2.36 Oc1cnc2c(c1)NCC2 271570a_203496583355_100000698607 [3,0,0,0,0,0|1,0,0]=4 4340 B13R0.1170 C=CCCCNC(=O)C=CC(=O)OC 1626a_100000700776_100016283253 [0,1,2,0,0,0|0,0,1]=4 4341 B13R1.13 C=C(C)c1cc(ccc1C)C(=O)C 271570a_100000694244_100011934287 [1,1,1,0,0,0|1,0,0]=4 4342 B13R1.50 CNc1cc(ccc1C)S(=O)(=O)C 34a_100000230108_200000210301 [1,1,1,0,0,0|1,0,0]=4 4343 B13R1.50 CNc1cc(ccc1C)S(=O)(=O)C 7a_100000230108_200000210301 [1,1,1,0,0,0|1,0,0]=4 4344 B13R1.50 Cc1ccc(cc1N[13CH3])S(=O)(=O)C 34a_100000230108_200025704644 [1,1,1,0,0,0|1,0,0]=4 4345 B13R1.50 Cc1ccc(cc1N[13CH3])S(=O)(=O)C 7a_100000230108_200025704644 [1,1,1,0,0,0|1,0,0]=4 4346 B13R1.354 C=C(C)c1ccc(c(c1)CNC)C 271570a_100000694244_106744473289 [1,1,1,0,0,0|1,0,0]=4 4347 B13R1.354 CC(=O)c1ccc(c(c1)OCF)C 34a_100000084092_100015361967 [1,1,1,0,0,0|1,0,0]=4 4348 B13R1.354 CC(=O)c1ccc(c(c1)OCF)C 7a_100000084092_100015361967 [1,1,1,0,0,0|1,0,0]=4 4349 B13R1.354 CC(=O)c1ccc(c(c1)SCF)C 62a_100011934287_100015361967 [1,1,1,0,0,0|1,0,0]=4 4350 B13R1.354 CC(=O)c1ccc(c(c1)SCF)C 62a_100015361967_100011934287 [1,1,1,0,0,0|1,0,0]=4 4351 B13R1.354 CC=Cc1cc(ccc1C)C(=O)C 271570a_100016259895_100011934287 [1,1,1,0,0,0|1,0,0]=4 4352 B13R1.354 CCNc1cc(ccc1C)C(=O)N 34a_100000188646_100000210202 [1,1,1,0,0,0|1,0,0]=4 4353 B13R1.354 CCNc1cc(ccc1C)C(=O)N 7a_100000188646_100000210202 [1,1,1,0,0,0|1,0,0]=4 4354 B13R1.354 CCOc1cc(ccc1C)C(=O)C 1458a_100000238212_200000210301 [1,1,1,0,0,0|1,0,0]=4 4355 B13R1.354 CCOc1cc(ccc1C)C(=O)C 34a_100000084092_100000210202 [1,1,1,0,0,0|1,0,0]=4 4356 B13R1.354 CCOc1cc(ccc1C)C(=O)C 7a_100000084092_100000210202 [1,1,1,0,0,0|1,0,0]=4 4357 B13R1.354 CCOc1cc(ccc1C)C(=O)[13CH3] 1458a_100000238212_200025704644 [1,1,1,0,0,0|1,0,0]=4 4358 B13R1.354 CCSc1cc(ccc1C)C(=O)C 62a_100000210202_100011934287 [1,1,1,0,0,0|1,0,0]=4 4359 B13R1.354 CCSc1cc(ccc1C)C(=O)C 62a_100011934287_100000210202 [1,1,1,0,0,0|1,0,0]=4 4360 B13R1.354 CNCc1cc(ccc1F)C(=O)C 26a_100102657272_100000117923 [1,1,1,0,0,0|1,0,0]=4 4361 B13R1.354 CNCc1cc(ccc1O)C(=O)C 34a_100102657272_100000010293 [1,1,1,0,0,0|1,0,0]=4 4362 B13R1.354 Cc1ccc(cc1NCF)C(=O)N 34a_100000188646_100015361967 [1,1,1,0,0,0|1,0,0]=4 4363 B13R1.354 Cc1ccc(cc1NCF)C(=O)N 7a_100000188646_100015361967 [1,1,1,0,0,0|1,0,0]=4 4364 B13R1.651 CC(=O)c1cc(c(cc1O)C)S[13CH3] 62a_200010233951_200025704644 [1,1,1,0,0,0|1,0,0]=4 4365 B13R1.651 COc1cc(c(cc1C)Br)C(=O)C 1458a_100010289115_200000210301 [1,1,1,0,0,0|1,0,0]=4 4366 B13R1.651 COc1cc(c(cc1C)Br)C(=O)[13CH3] 1458a_100010289115_200025704644 [1,1,1,0,0,0|1,0,0]=4 4367 B13R1.651 CSc1cc(c(cc1C)O)C(=O)C 62a_200010233951_200000210301 [1,1,1,0,0,0|1,0,0]=4 4368 B13R1.3091 CNc1cc(ccc1OC)C(=O)N 34a_100000740584_200000210301 [1,1,1,0,0,0|1,0,0]=4 4369 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 34a_100000186468_200025704644 [1,1,1,0,0,0|1,0,0]=4 4370 B13R1.3091 COc1cc(ccc1O[13CH3])C(=O)C 7a_100000186468_200025704644 [1,1,1,0,0,0|1,0,0]=4 4371 B13R1.3091 COc1cc(ccc1SC)C(=O)C 62a_100010110075_200000210301 [1,1,1,0,0,0|1,0,0]=4 4372 B13R1.3091 COc1cc(ccc1S[13CH3])C(=O)C 62a_100010110075_200025704644 [1,1,1,0,0,0|1,0,0]=4 4373 B13R1.3091 COc1ccc(cc1N[13CH3])C(=O)N 34a_100000740584_200025704644 [1,1,1,0,0,0|1,0,0]=4 4374 B13R1.3091 COc1ccc(cc1OC)C(=O)C 1458a_100000211223_200000210301 [1,1,1,0,0,0|1,0,0]=4 4375 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000186468_200000210301 [1,1,1,0,0,0|1,0,0]=4 4376 B13R1.3091 COc1ccc(cc1OC)C(=O)C 34a_100000732934_200000210301 [1,1,1,0,0,0|1,0,0]=4 4377 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000186468_200000210301 [1,1,1,0,0,0|1,0,0]=4 4378 B13R1.3091 COc1ccc(cc1OC)C(=O)C 7a_100000732934_200000210301 [1,1,1,0,0,0|1,0,0]=4 4379 B13R1.3091 COc1ccc(cc1OC)C(=O)[13CH3] 1458a_100000211223_200025704644 [1,1,1,0,0,0|1,0,0]=4 4380 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 34a_100000732934_200025704644 [1,1,1,0,0,0|1,0,0]=4 4381 B13R1.3091 COc1ccc(cc1O[13CH3])C(=O)C 7a_100000732934_200025704644 [1,1,1,0,0,0|1,0,0]=4 4382 B13R1.3091 COc1ccc(cc1SC)C(=O)C 62a_100000185153_200000210301 [1,1,1,0,0,0|1,0,0]=4 4383 B13R1.3091 COc1ccc(cc1SC)C(=O)C 62a_200000210301_100000039561 [1,1,1,0,0,0|1,0,0]=4 4384 B13R1.3091 COc1ccc(cc1S[13CH3])C(=O)C 62a_100000185153_200025704644 [1,1,1,0,0,0|1,0,0]=4 4385 B13R1.3091 COc1ccc(cc1S[13CH3])C(=O)C 62a_200025704644_100000039561 [1,1,1,0,0,0|1,0,0]=4 4386 B13R1.52 CNc1cc(ccc1C)C=C(C)C 271570a_100102525489_100020629602 [1,1,1,0,0,0|1,0,0]=4 4387 B13R1.384 CC=Cc1ccc(c(c1)CNC)C 271570a_100016259895_106744473289 [1,1,1,0,0,0|1,0,0]=4 4388 B13R1.575 CNc1cc(ccc1C)SCOC 62a_100000766300_100020629602 [1,1,1,0,0,0|0,0,1]=4 4389 B13R1.575 CNc1cc(ccc1C)SCOC 62a_100020629602_100000766300 [1,1,1,0,0,0|0,0,1]=4 4390 B13R1.466 CCCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210303 [1,1,1,0,0,0|1,0,0]=4 4391 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 11a_100015525214_100000210898 [1,1,1,0,0,0|1,0,0]=4 4392 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 240690a_100015525214_100000210898 [1,1,1,0,0,0|1,0,0]=4 4393 B13R1.466 CCNC(=O)c1ccc(c(c1)C)C 527a_100015525214_100000210898 [1,1,1,0,0,0|1,0,0]=4 4394 B13R1.466 CCOC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100012229600 [1,1,1,0,0,0|1,0,0]=4 4395 B13R1.466 CCOC(=O)c1ccc(c(c1)N)O 271570a_203496583355_200011450955 [1,1,1,0,0,0|1,0,0]=4 4396 B13R1.466 CCOC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100012359631 [1,1,1,0,0,0|1,0,0]=4 4397 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 2230a_106832991635_100000183365 [1,1,1,0,0,0|1,0,0]=4 4398 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 7a_106832991635_100000183365 [1,1,1,0,0,0|1,0,0]=4 4399 B13R1.466 CNNC(=O)c1ccc(c(c1)C)C 22a_100016993582_100000210898 [1,1,1,0,0,0|1,0,0]=4 4400 B13R1.466 COCC(=O)c1ccc(c(c1)Br)C 34a_100138415774_100012346676 [1,1,1,0,0,0|1,0,0]=4 4401 B13R1.466 COCC(=O)c1ccc(c(c1)F)C 34a_100138415774_100011219196 [1,1,1,0,0,0|1,0,0]=4 4402 B13R1.466 CSCC(=O)c1ccc(c(c1)C)C 62a_100000183365_200000210301 [1,1,1,0,0,0|0,1,0]=4 4403 B13R1.466 CSCC(=O)c1ccc(c(c1)C)C 62a_200000210301_100000183365 [1,1,1,0,0,0|0,1,0]=4 4404 B13R1.466 Cc1ccc(cc1C)C(=O)CCF 1458a_100000210898_100011217306 [1,1,1,0,0,0|1,0,0]=4 4405 B13R1.466 Cc1ccc(cc1C)C(=O)CCO 1458a_100000210898_100000211926 [1,1,1,0,0,0|1,0,0]=4 4406 B13R1.466 Cc1ccc(cc1C)C(=O)CS[13CH3] 62a_100000183365_200025704644 [1,1,1,0,0,0|0,1,0]=4 4407 B13R1.466 Cc1ccc(cc1C)C(=O)CS[13CH3] 62a_200025704644_100000183365 [1,1,1,0,0,0|0,1,0]=4 4408 B13R1.510 Cc1ccc(cc1C)C(=O)C(C)C 1458a_100000210898_100000210206 [1,1,1,0,0,0|1,0,0]=4 4409 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 11a_100102631434_100000210898 [1,1,1,0,0,0|1,0,0]=4 4410 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 1626a_100102631434_100000210898 [1,1,1,0,0,0|1,0,0]=4 4411 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 240690a_100102631434_100000210898 [1,1,1,0,0,0|1,0,0]=4 4412 B13R1.510 Cc1ccc(cc1C)C(=O)N(C)C 527a_100102631434_100000210898 [1,1,1,0,0,0|1,0,0]=4 4413 B13R1.1807 CCC(=O)c1cc(c(cc1C)C)C 1458a_100011216168_100000210202 [1,1,1,0,0,0|1,0,0]=4 4414 B13R1.1807 CCC(=O)c1cc(c(cc1I)C)C 1458a_100010184404_100000210202 [1,1,1,0,0,0|1,0,0]=4 4415 B13R1.1807 CCC(=O)c1cc(c(cc1O)C)C 1458a_100009831561_100000210202 [1,1,1,0,0,0|1,0,0]=4 4416 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 11a_106832991635_100011216168 [1,1,1,0,0,0|1,0,0]=4 4417 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 1626a_100102657272_100011216168 [1,1,1,0,0,0|1,0,0]=4 4418 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 240690a_100102657272_100011216168 [1,1,1,0,0,0|1,0,0]=4 4419 B13R1.1807 CNC(=O)c1cc(c(cc1C)C)C 527a_100102657272_100011216168 [1,1,1,0,0,0|1,0,0]=4 4420 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 11a_106832991635_100010184404 [1,1,1,0,0,0|1,0,0]=4 4421 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 1626a_100102657272_100010184404 [1,1,1,0,0,0|1,0,0]=4 4422 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 240690a_100102657272_100010184404 [1,1,1,0,0,0|1,0,0]=4 4423 B13R1.1807 CNC(=O)c1cc(c(cc1I)C)C 527a_100102657272_100010184404 [1,1,1,0,0,0|1,0,0]=4 4424 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 240690a_100102657272_100009831561 [1,1,1,0,0,0|1,0,0]=4 4425 B13R1.1807 CNC(=O)c1cc(c(cc1O)C)C 527a_100102657272_100009831561 [1,1,1,0,0,0|1,0,0]=4 4426 B13R1.1807 COC(=O)c1cc(c(cc1C)C)O 271570a_203496583355_200012360129 [1,1,1,0,0,0|1,0,0]=4 4427 B13R1.1807 COC(=O)c1cc(c(cc1Cl)C)O 271570a_203496583355_100014124666 [1,1,1,0,0,0|1,0,0]=4 4428 B13R1.1807 COC(=O)c1cc(c(cc1F)C)O 271570a_203496583355_100012920548 [1,1,1,0,0,0|1,0,0]=4 4429 B13R1.1807 COC(=O)c1cc(c(cc1F)O)N 271570a_203496583355_100000760059 [1,1,1,0,0,0|1,0,0]=4 4430 B13R1.1807 COC(=O)c1cc(c(cc1N)C)O 271570a_203496583355_100010892302 [1,1,1,0,0,0|1,0,0]=4 4431 B13R1.1807 COC(=O)c1cc(c(cc1O)C)F 271570a_203496583355_100015763395 [1,1,1,0,0,0|1,0,0]=4 4432 B13R1.1807 COC(=O)c1cc(c(cc1O)C)N 271570a_203496583355_100000730709 [1,1,1,0,0,0|0,0,0]=3 4433 B13R1.1807 COC(=O)c1cc(c(cc1O)C)O 271570a_203496583355_100010233952 [1,1,1,0,0,0|1,0,0]=4 4434 B13R1.1807 COC(=O)c1cc(c(cc1O)F)C 271570a_203496583355_100015451887 [1,1,1,0,0,0|1,0,0]=4 4435 B13R1.1808 CCC(=O)c1ccc(c(c1F)C)C 1458a_100010768504_100000210202 [1,1,1,0,0,0|1,0,0]=4 4436 B13R1.1808 CCC(=O)c1ccc(c(c1I)C)C 1458a_100010188221_100000210202 [1,1,1,0,0,0|1,0,0]=4 4437 B13R1.1808 CCC(=O)c1ccc(c(c1O)C)C 1458a_100000742916_100000210202 [1,1,1,0,0,0|1,0,0]=4 4438 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 11a_106832991635_100010768504 [1,1,1,0,0,0|1,0,0]=4 4439 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 1626a_100102657272_100010768504 [1,1,1,0,0,0|1,0,0]=4 4440 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 240690a_100102657272_100010768504 [1,1,1,0,0,0|1,0,0]=4 4441 B13R1.1808 CNC(=O)c1ccc(c(c1F)C)C 527a_100102657272_100010768504 [1,1,1,0,0,0|1,0,0]=4 4442 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 11a_106832991635_100010188221 [1,1,1,0,0,0|1,0,0]=4 4443 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 1626a_100102657272_100010188221 [1,1,1,0,0,0|1,0,0]=4 4444 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 240690a_100102657272_100010188221 [1,1,1,0,0,0|1,0,0]=4 4445 B13R1.1808 CNC(=O)c1ccc(c(c1I)C)C 527a_100102657272_100010188221 [1,1,1,0,0,0|1,0,0]=4 4446 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 240690a_100102657272_100000742916 [1,1,1,0,0,0|1,0,0]=4 4447 B13R1.1808 CNC(=O)c1ccc(c(c1O)C)C 527a_100102657272_100000742916 [1,1,1,0,0,0|1,0,0]=4 4448 B13R1.1808 COC(=O)c1ccc(c(c1C)C)O 271570a_203496583355_100010761469 [1,1,1,0,0,0|1,0,0]=4 4449 B13R1.1808 COC(=O)c1ccc(c(c1C)O)C 271570a_203496583355_200010734123 [1,1,1,0,0,0|1,0,0]=4 4450 B13R1.1808 COC(=O)c1ccc(c(c1F)C)O 271570a_203496583355_100010172522 [1,1,1,0,0,0|1,0,0]=4 4451 B13R1.1808 COC(=O)c1ccc(c(c1N)C)O 271570a_203496583355_100000764893 [1,1,1,0,0,0|1,0,0]=4 4452 B13R1.2678 CCC(=O)c1cc(c(c(c1)C)C)C 1458a_100000075298_100000210202 [1,1,1,0,0,0|1,0,0]=4 4453 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 11a_106832991635_100000075298 [1,1,1,0,0,0|1,0,0]=4 4454 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 1626a_100102657272_100000075298 [1,1,1,0,0,0|1,0,0]=4 4455 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 240690a_100102657272_100000075298 [1,1,1,0,0,0|1,0,0]=4 4456 B13R1.2678 CNC(=O)c1cc(c(c(c1)C)C)C 527a_100102657272_100000075298 [1,1,1,0,0,0|1,0,0]=4 4457 B13R1.2678 COC(=O)c1cc(c(c(c1)C)O)C 271570a_203496583355_100010209423 [1,1,1,0,0,0|1,0,0]=4 4458 B13R1.2678 COC(=O)c1cc(c(c(c1)Cl)C)O 271570a_203496583355_100012360618 [1,1,1,0,0,0|1,0,0]=4 4459 B13R1.2678 COC(=O)c1cc(c(c(c1)F)C)O 271570a_203496583355_100012920391 [1,1,1,0,0,0|1,0,0]=4 4460 B13R1.2678 COC(=O)c1cc(c(c(c1)O)C)N 271570a_203496583355_100012353609 [1,1,1,0,0,0|0,0,0]=3 4461 B13R1.2678 COC(=O)c1cc(c(c(c1)O)F)N 271570a_203496583355_200010713629 [1,1,1,0,0,0|1,0,0]=4 4462 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)C 271570a_203496583355_100010177015 [1,1,1,0,0,0|1,0,0]=4 4463 B13R1.2678 COC(=O)c1cc(c(c(c1)O)N)N 271570a_203496583355_100010128412 [1,1,1,0,0,0|1,0,0]=4 4464 B13R1.2678 COC(=O)c1cc(c(c(c1)O)O)N 271570a_203496583355_100010372079 [1,1,1,0,0,0|1,0,0]=4 4465 B13R1.82 CCc1cccc(c1O)C(=O)OC 271570a_203496583355_200009992460 [1,1,1,0,0,0|0,0,0]=3 4466 B13R1.82 CNC(=O)c1cccc(c1C)NC 34a_100000739055_200000210301 [1,1,1,0,0,0|1,0,0]=4 4467 B13R1.82 CNC(=O)c1cccc(c1C)N[13CH3] 34a_100000739055_200025704644 [1,1,1,0,0,0|1,0,0]=4 4468 B13R1.82 COC(=O)c1cccc(c1Br)OC 34a_200010230364_200000210301 [1,1,1,0,0,0|1,0,0]=4 4469 B13R1.82 COC(=O)c1cccc(c1Br)OC 7a_200010230364_200000210301 [1,1,1,0,0,0|1,0,0]=4 4470 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 34a_200010230364_200025704644 [1,1,1,0,0,0|1,0,0]=4 4471 B13R1.82 COC(=O)c1cccc(c1Br)O[13CH3] 7a_200010230364_200025704644 [1,1,1,0,0,0|1,0,0]=4 4472 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_100010240208_200000210301 [1,1,1,0,0,0|1,0,0]=4 4473 B13R1.82 COC(=O)c1cccc(c1Br)SC 62a_200000210301_100010240208 [1,1,1,0,0,0|1,0,0]=4 4474 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_100010240208_200025704644 [1,1,1,0,0,0|1,0,0]=4 4475 B13R1.82 COC(=O)c1cccc(c1Br)S[13CH3] 62a_200025704644_100010240208 [1,1,1,0,0,0|1,0,0]=4 4476 B13R1.82 COC(=O)c1cccc(c1C)OC 34a_100011999632_200000210301 [1,1,1,0,0,0|1,0,0]=4 4477 B13R1.82 COC(=O)c1cccc(c1C)OC 7a_100011999632_200000210301 [1,1,1,0,0,0|1,0,0]=4 4478 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 34a_100011999632_200025704644 [1,1,1,0,0,0|1,0,0]=4 4479 B13R1.82 COC(=O)c1cccc(c1C)O[13CH3] 7a_100011999632_200025704644 [1,1,1,0,0,0|1,0,0]=4 4480 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_100012298220_200000210301 [1,1,1,0,0,0|1,0,0]=4 4481 B13R1.82 COC(=O)c1cccc(c1C)SC 62a_200000210301_100012298220 [1,1,1,0,0,0|1,0,0]=4 4482 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_100012298220_200025704644 [1,1,1,0,0,0|1,0,0]=4 4483 B13R1.82 COC(=O)c1cccc(c1C)S[13CH3] 62a_200025704644_100012298220 [1,1,1,0,0,0|1,0,0]=4 4484 B13R1.82 COC(=O)c1cccc(c1Cl)OC 34a_100009866855_200000210301 [1,1,1,0,0,0|1,0,0]=4 4485 B13R1.82 COC(=O)c1cccc(c1Cl)OC 7a_100009866855_200000210301 [1,1,1,0,0,0|1,0,0]=4 4486 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 34a_100009866855_200025704644 [1,1,1,0,0,0|1,0,0]=4 4487 B13R1.82 COC(=O)c1cccc(c1Cl)O[13CH3] 7a_100009866855_200025704644 [1,1,1,0,0,0|1,0,0]=4 4488 B13R1.82 COC(=O)c1cccc(c1F)OC 34a_100009854753_200000210301 [1,1,1,0,0,0|1,0,0]=4 4489 B13R1.82 COC(=O)c1cccc(c1F)OC 7a_100009854753_200000210301 [1,1,1,0,0,0|1,0,0]=4 4490 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 34a_100009854753_200025704644 [1,1,1,0,0,0|1,0,0]=4 4491 B13R1.82 COC(=O)c1cccc(c1F)O[13CH3] 7a_100009854753_200025704644 [1,1,1,0,0,0|1,0,0]=4 4492 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_100012355674_200000210301 [1,1,1,0,0,0|1,0,0]=4 4493 B13R1.82 COC(=O)c1cccc(c1F)SC 62a_200000210301_100012355674 [1,1,1,0,0,0|1,0,0]=4 4494 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_100012355674_200025704644 [1,1,1,0,0,0|1,0,0]=4 4495 B13R1.82 COC(=O)c1cccc(c1F)S[13CH3] 62a_200025704644_100012355674 [1,1,1,0,0,0|1,0,0]=4 4496 B13R1.82 COC(=O)c1cccc(c1N)OC 34a_100015205654_200000210301 [1,1,1,0,0,0|1,0,0]=4 4497 B13R1.82 COC(=O)c1cccc(c1N)OC 7a_100015205654_200000210301 [1,1,1,0,0,0|1,0,0]=4 4498 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 34a_100015205654_200025704644 [1,1,1,0,0,0|1,0,0]=4 4499 B13R1.82 COC(=O)c1cccc(c1N)O[13CH3] 7a_100015205654_200025704644 [1,1,1,0,0,0|1,0,0]=4 4500 B13R1.82 COC(=O)c1cccc(c1N)SC 62a_100011356556_200000210301 [1,1,1,0,0,0|1,0,0]=4 4501 B13R1.82 COC(=O)c1cccc(c1N)S[13CH3] 62a_100011356556_200025704644 [1,1,1,0,0,0|1,0,0]=4 4502 B13R1.82 COC(=O)c1cccc(c1O)OC 271570a_203496583355_100010189551 [1,1,1,0,0,0|1,0,0]=4 4503 B13R1.82 COC(=O)c1cccc(c1O)SC 62a_100009816214_200000210301 [1,1,1,0,0,0|1,0,0]=4 4504 B13R1.82 COC(=O)c1cccc(c1O)S[13CH3] 62a_100009816214_200025704644 [1,1,1,0,0,0|1,0,0]=4 4505 B13R1.314 COC(=O)c1cc(cc(c1)CN)O 271570a_203496583355_100134615983 [1,1,1,0,0,0|1,0,0]=4 4506 B13R1.314 COC(=O)c1cc(cc(c1)CO)O 271570a_203496583355_100010232996 [1,1,1,0,0,0|1,0,0]=4 4507 B13R1.314 COC(=O)c1cc(cc(c1)OC)Br 34a_100000696291_200000210301 [1,1,1,0,0,0|1,0,0]=4 4508 B13R1.314 COC(=O)c1cc(cc(c1)OC)Br 7a_100000696291_200000210301 [1,1,1,0,0,0|1,0,0]=4 4509 B13R1.314 COC(=O)c1cc(cc(c1)OC)Cl 34a_100009870047_200000210301 [1,1,1,0,0,0|1,0,0]=4 4510 B13R1.314 COC(=O)c1cc(cc(c1)OC)Cl 7a_100009870047_200000210301 [1,1,1,0,0,0|1,0,0]=4 4511 B13R1.314 COC(=O)c1cc(cc(c1)OC)F 34a_100000118610_200000210301 [1,1,1,0,0,0|1,0,0]=4 4512 B13R1.314 COC(=O)c1cc(cc(c1)OC)F 7a_100000118610_200000210301 [1,1,1,0,0,0|1,0,0]=4 4513 B13R1.314 COC(=O)c1cc(cc(c1)OC)N 34a_100000069914_200000210301 [1,1,1,0,0,0|1,0,0]=4 4514 B13R1.314 COC(=O)c1cc(cc(c1)OC)N 7a_100000069914_200000210301 [1,1,1,0,0,0|1,0,0]=4 4515 B13R1.314 COC(=O)c1cc(cc(c1)OC)O 271570a_203496583355_200010233337 [1,1,1,0,0,0|1,0,0]=4 4516 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Br 34a_100000696291_200025704644 [1,1,1,0,0,0|1,0,0]=4 4517 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Br 7a_100000696291_200025704644 [1,1,1,0,0,0|1,0,0]=4 4518 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Cl 34a_100009870047_200025704644 [1,1,1,0,0,0|1,0,0]=4 4519 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])Cl 7a_100009870047_200025704644 [1,1,1,0,0,0|1,0,0]=4 4520 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])F 34a_100000118610_200025704644 [1,1,1,0,0,0|1,0,0]=4 4521 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])F 7a_100000118610_200025704644 [1,1,1,0,0,0|1,0,0]=4 4522 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])N 34a_100000069914_200025704644 [1,1,1,0,0,0|1,0,0]=4 4523 B13R1.314 COC(=O)c1cc(cc(c1)O[13CH3])N 7a_100000069914_200025704644 [1,1,1,0,0,0|1,0,0]=4 4524 B13R1.314 COC(=O)c1cc(cc(c1)SC)Br 62a_100012339729_200000210301 [1,1,1,0,0,0|1,0,0]=4 4525 B13R1.314 COC(=O)c1cc(cc(c1)SC)Br 62a_200000210301_100012339729 [1,1,1,0,0,0|1,0,0]=4 4526 B13R1.314 COC(=O)c1cc(cc(c1)SC)C 62a_100012359405_200000210301 [1,1,1,0,0,0|1,0,0]=4 4527 B13R1.314 COC(=O)c1cc(cc(c1)SC)C 62a_200000210301_100012359405 [1,1,1,0,0,0|1,0,0]=4 4528 B13R1.314 COC(=O)c1cc(cc(c1)SC)Cl 62a_100000695173_200000210301 [1,1,1,0,0,0|1,0,0]=4 4529 B13R1.314 COC(=O)c1cc(cc(c1)SC)Cl 62a_200000210301_100000695173 [1,1,1,0,0,0|1,0,0]=4 4530 B13R1.314 COC(=O)c1cc(cc(c1)SC)F 62a_100000698578_200000210301 [1,1,1,0,0,0|1,0,0]=4 4531 B13R1.314 COC(=O)c1cc(cc(c1)SC)F 62a_200000210301_100000698578 [1,1,1,0,0,0|1,0,0]=4 4532 B13R1.314 COC(=O)c1cc(cc(c1)SC)N 62a_100138415615_200000210301 [1,1,1,0,0,0|1,0,0]=4 4533 B13R1.314 COC(=O)c1cc(cc(c1)SC)N 62a_200000210301_100138415615 [1,1,1,0,0,0|1,0,0]=4 4534 B13R1.314 COC(=O)c1cc(cc(c1)SC)O 62a_100000696291_200000210301 [1,1,1,0,0,0|1,0,0]=4 4535 B13R1.314 COC(=O)c1cc(cc(c1)SC)O 62a_200000210301_100000696291 [1,1,1,0,0,0|1,0,0]=4 4536 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Br 62a_100012339729_200025704644 [1,1,1,0,0,0|1,0,0]=4 4537 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Br 62a_200025704644_100012339729 [1,1,1,0,0,0|1,0,0]=4 4538 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])C 62a_100012359405_200025704644 [1,1,1,0,0,0|1,0,0]=4 4539 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])C 62a_200025704644_100012359405 [1,1,1,0,0,0|1,0,0]=4 4540 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Cl 62a_100000695173_200025704644 [1,1,1,0,0,0|1,0,0]=4 4541 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])Cl 62a_200025704644_100000695173 [1,1,1,0,0,0|1,0,0]=4 4542 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])F 62a_100000698578_200025704644 [1,1,1,0,0,0|1,0,0]=4 4543 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])F 62a_200025704644_100000698578 [1,1,1,0,0,0|1,0,0]=4 4544 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])N 62a_100138415615_200025704644 [1,1,1,0,0,0|1,0,0]=4 4545 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])N 62a_200025704644_100138415615 [1,1,1,0,0,0|1,0,0]=4 4546 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])O 62a_100000696291_200025704644 [1,1,1,0,0,0|1,0,0]=4 4547 B13R1.314 COC(=O)c1cc(cc(c1)S[13CH3])O 62a_200025704644_100000696291 [1,1,1,0,0,0|1,0,0]=4 4548 B13R1.460 CCCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210303 [1,1,1,0,0,0|1,0,0]=4 4549 B13R1.460 CCNC(=O)c1cccc(c1)CC 11a_100015525214_100011933908 [1,1,1,0,0,0|1,0,0]=4 4550 B13R1.460 CCNC(=O)c1cccc(c1)CC 240690a_100015525214_100011933908 [1,1,1,0,0,0|1,0,0]=4 4551 B13R1.460 CCNC(=O)c1cccc(c1)CC 527a_100015525214_100011933908 [1,1,1,0,0,0|1,0,0]=4 4552 B13R1.460 CCNC(=O)c1cccc(c1)NC 34a_100000181407_200000210301 [1,1,1,0,0,0|1,0,0]=4 4553 B13R1.460 CCNC(=O)c1cccc(c1)NC 7a_100000181407_200000210301 [1,1,1,0,0,0|1,0,0]=4 4554 B13R1.460 CCNC(=O)c1cccc(c1)N[13CH3] 34a_100000181407_200025704644 [1,1,1,0,0,0|1,0,0]=4 4555 B13R1.460 CCNC(=O)c1cccc(c1)N[13CH3] 7a_100000181407_200025704644 [1,1,1,0,0,0|1,0,0]=4 4556 B13R1.460 CCOC(=O)c1cccc(c1)OC 7a_100000169910_200000210301 [1,1,1,0,0,0|1,0,0]=4 4557 B13R1.460 CCOC(=O)c1cccc(c1)O[13CH3] 7a_100000169910_200025704644 [1,1,1,0,0,0|1,0,0]=4 4558 B13R1.460 CCOC(=O)c1cccc(c1)SC 62a_100000170211_200000210301 [1,1,1,0,0,0|1,0,0]=4 4559 B13R1.460 CCOC(=O)c1cccc(c1)SC 62a_200000210301_100000170211 [1,1,1,0,0,0|1,0,0]=4 4560 B13R1.460 CCOC(=O)c1cccc(c1)S[13CH3] 62a_100000170211_200025704644 [1,1,1,0,0,0|1,0,0]=4 4561 B13R1.460 CCOC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000170211 [1,1,1,0,0,0|1,0,0]=4 4562 B13R1.460 CCOC(=O)c1cccc(n1)NC 27a_100102657272_100000695914 [1,1,1,0,0,0|1,0,0]=4 4563 B13R1.460 CCc1cccc(c1)C(=O)CCF 1458a_100011933908_100011217306 [1,1,1,0,0,0|1,0,0]=4 4564 B13R1.460 CCc1cccc(c1)C(=O)CCO 1458a_100011933908_100000211926 [1,1,1,0,0,0|1,0,0]=4 4565 B13R1.460 CCc1cccc(c1)C(=O)NNC 22a_100016993582_100011933908 [1,1,1,0,0,0|1,0,0]=4 4566 B13R1.460 COCC(=O)c1cccc(c1)OC 34a_100138415774_100000211451 [1,1,1,0,0,0|1,0,0]=4 4567 B13R1.543 C=C(C)c1cccc(c1)C(=O)OC 271570a_100000694244_100000148679 [1,1,1,0,0,0|0,0,1]=4 4568 B13R1.543 CCC(=O)c1cccc(c1)C(C)C 1458a_100011934808_100000210202 [1,1,1,0,0,0|1,0,0]=4 4569 B13R1.543 CCC(=O)c1cccc(c1)C(C)O 1458a_100000090953_100000210202 [1,1,1,0,0,0|1,0,0]=4 4570 B13R1.543 CCC(=O)c1cccc(c1)N(C)C 1458a_100000210872_100000210202 [1,1,1,0,0,0|1,0,0]=4 4571 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 11a_106832991635_100011934808 [1,1,1,0,0,0|1,0,0]=4 4572 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 1626a_100102657272_100011934808 [1,1,1,0,0,0|1,0,0]=4 4573 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 240690a_100102657272_100011934808 [1,1,1,0,0,0|1,0,0]=4 4574 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 527a_100102657272_100011934808 [1,1,1,0,0,0|1,0,0]=4 4575 B13R1.543 CNC(=O)c1cccc(c1)C(C)O 240690a_100102657272_100000090953 [1,1,1,0,0,0|1,0,0]=4 4576 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 11a_106832991635_100000210872 [1,1,1,0,0,0|1,0,0]=4 4577 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 1626a_100102657272_100000210872 [1,1,1,0,0,0|1,0,0]=4 4578 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 240690a_100102657272_100000210872 [1,1,1,0,0,0|1,0,0]=4 4579 B13R1.543 CNC(=O)c1cccc(c1)N(C)C 527a_100102657272_100000210872 [1,1,1,0,0,0|1,0,0]=4 4580 B13R1.543 COC(=O)c1cccc(c1)C(=O)C 1458a_100000035267_200000210301 [1,1,1,0,0,0|0,0,1]=4 4581 B13R1.543 COC(=O)c1cccc(c1)C(=O)[13CH3] 1458a_100000035267_200025704644 [1,1,1,0,0,0|0,0,1]=4 4582 B13R1.543 COC(=O)c1cccc(n1)N(C)C 27a_100102631434_100000708286 [1,1,1,0,0,0|1,0,0]=4 4583 B13R1.642 CCc1cccc(c1)C(=O)C(C)C 1458a_100011933908_100000210206 [1,1,1,0,0,0|1,0,0]=4 4584 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 11a_100102631434_100011933908 [1,1,1,0,0,0|1,0,0]=4 4585 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 1626a_100102631434_100011933908 [1,1,1,0,0,0|1,0,0]=4 4586 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 240690a_100102631434_100011933908 [1,1,1,0,0,0|1,0,0]=4 4587 B13R1.642 CCc1cccc(c1)C(=O)N(C)C 527a_100102631434_100011933908 [1,1,1,0,0,0|1,0,0]=4 4588 B13R1.642 CN(C)C(=O)c1cccc(c1)N[13CH3] 34a_100000246196_200025704644 [1,1,1,0,0,0|1,0,0]=4 4589 B13R1.642 CN(C)C(=O)c1cccc(c1)N[13CH3] 7a_100000246196_200025704644 [1,1,1,0,0,0|1,0,0]=4 4590 B13R1.642 CNc1cccc(c1)C(=O)C(C)C 27a_100102657272_100011350656 [1,1,1,0,0,0|1,0,0]=4 4591 B13R1.642 CNc1cccc(c1)C(=O)N(C)C 34a_100000246196_200000210301 [1,1,1,0,0,0|1,0,0]=4 4592 B13R1.642 CNc1cccc(c1)C(=O)N(C)C 7a_100000246196_200000210301 [1,1,1,0,0,0|1,0,0]=4 4593 B13R1.2431 CCC(=O)c1cc(ccc1O)CC 1458a_200000748397_100000210202 [1,1,1,0,0,0|1,0,0]=4 4594 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 240690a_100102657272_200000748397 [1,1,1,0,0,0|1,0,0]=4 4595 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 527a_100102657272_200000748397 [1,1,1,0,0,0|1,0,0]=4 4596 B13R1.2431 CNC(=O)c1cc(ccc1Cl)NC 2230a_100000742274_200000210301 [1,1,1,0,0,0|1,0,0]=4 4597 B13R1.2431 CNC(=O)c1cc(ccc1Cl)NC 34a_100000742274_200000210301 [1,1,1,0,0,0|1,0,0]=4 4598 B13R1.2431 CNC(=O)c1cc(ccc1Cl)N[13CH3] 2230a_100000742274_200025704644 [1,1,1,0,0,0|1,0,0]=4 4599 B13R1.2431 CNC(=O)c1cc(ccc1Cl)N[13CH3] 34a_100000742274_200025704644 [1,1,1,0,0,0|1,0,0]=4 4600 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 2230a_100000747870_200000210301 [1,1,1,0,0,0|1,0,0]=4 4601 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 34a_100000747870_200000210301 [1,1,1,0,0,0|1,0,0]=4 4602 B13R1.2431 CNC(=O)c1cc(ccc1F)NC 7a_100000747870_200000210301 [1,1,1,0,0,0|1,0,0]=4 4603 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 2230a_100000747870_200025704644 [1,1,1,0,0,0|1,0,0]=4 4604 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 34a_100000747870_200025704644 [1,1,1,0,0,0|1,0,0]=4 4605 B13R1.2431 CNC(=O)c1cc(ccc1F)N[13CH3] 7a_100000747870_200025704644 [1,1,1,0,0,0|1,0,0]=4 4606 B13R1.2431 COC(=O)c1cc(ccc1Br)OC 34a_100010230369_200000210301 [1,1,1,0,0,0|1,0,0]=4 4607 B13R1.2431 COC(=O)c1cc(ccc1Br)OC 7a_100010230369_200000210301 [1,1,1,0,0,0|1,0,0]=4 4608 B13R1.2431 COC(=O)c1cc(ccc1Br)O[13CH3] 34a_100010230369_200025704644 [1,1,1,0,0,0|1,0,0]=4 4609 B13R1.2431 COC(=O)c1cc(ccc1Br)O[13CH3] 7a_100010230369_200025704644 [1,1,1,0,0,0|1,0,0]=4 4610 B13R1.2431 COC(=O)c1cc(ccc1Br)SC 62a_100012340073_200000210301 [1,1,1,0,0,0|1,0,0]=4 4611 B13R1.2431 COC(=O)c1cc(ccc1Br)SC 62a_200000210301_100012340073 [1,1,1,0,0,0|1,0,0]=4 4612 B13R1.2431 COC(=O)c1cc(ccc1Br)S[13CH3] 62a_100012340073_200025704644 [1,1,1,0,0,0|1,0,0]=4 4613 B13R1.2431 COC(=O)c1cc(ccc1Br)S[13CH3] 62a_200025704644_100012340073 [1,1,1,0,0,0|1,0,0]=4 4614 B13R1.2431 COC(=O)c1cc(ccc1C)OC 34a_100012002527_200000210301 [1,1,1,0,0,0|1,0,0]=4 4615 B13R1.2431 COC(=O)c1cc(ccc1C)OC 7a_100012002527_200000210301 [1,1,1,0,0,0|1,0,0]=4 4616 B13R1.2431 COC(=O)c1cc(ccc1C)O[13CH3] 34a_100012002527_200025704644 [1,1,1,0,0,0|1,0,0]=4 4617 B13R1.2431 COC(=O)c1cc(ccc1C)O[13CH3] 7a_100012002527_200025704644 [1,1,1,0,0,0|1,0,0]=4 4618 B13R1.2431 COC(=O)c1cc(ccc1C)SC 62a_100012360116_200000210301 [1,1,1,0,0,0|1,0,0]=4 4619 B13R1.2431 COC(=O)c1cc(ccc1C)SC 62a_200000210301_100012360116 [1,1,1,0,0,0|1,0,0]=4 4620 B13R1.2431 COC(=O)c1cc(ccc1C)S[13CH3] 62a_100012360116_200025704644 [1,1,1,0,0,0|1,0,0]=4 4621 B13R1.2431 COC(=O)c1cc(ccc1C)S[13CH3] 62a_200025704644_100012360116 [1,1,1,0,0,0|1,0,0]=4 4622 B13R1.2431 COC(=O)c1cc(ccc1Cl)OC 34a_100012001761_200000210301 [1,1,1,0,0,0|1,0,0]=4 4623 B13R1.2431 COC(=O)c1cc(ccc1Cl)OC 7a_100012001761_200000210301 [1,1,1,0,0,0|1,0,0]=4 4624 B13R1.2431 COC(=O)c1cc(ccc1Cl)O[13CH3] 34a_100012001761_200025704644 [1,1,1,0,0,0|1,0,0]=4 4625 B13R1.2431 COC(=O)c1cc(ccc1Cl)O[13CH3] 7a_100012001761_200025704644 [1,1,1,0,0,0|1,0,0]=4 4626 B13R1.2431 COC(=O)c1cc(ccc1Cl)SC 62a_100012353682_200000210301 [1,1,1,0,0,0|1,0,0]=4 4627 B13R1.2431 COC(=O)c1cc(ccc1Cl)SC 62a_200000210301_100012353682 [1,1,1,0,0,0|1,0,0]=4 4628 B13R1.2431 COC(=O)c1cc(ccc1Cl)S[13CH3] 62a_100012353682_200025704644 [1,1,1,0,0,0|1,0,0]=4 4629 B13R1.2431 COC(=O)c1cc(ccc1Cl)S[13CH3] 62a_200025704644_100012353682 [1,1,1,0,0,0|1,0,0]=4 4630 B13R1.2431 COC(=O)c1cc(ccc1F)OC 34a_100009856154_200000210301 [1,1,1,0,0,0|1,0,0]=4 4631 B13R1.2431 COC(=O)c1cc(ccc1F)OC 7a_100009856154_200000210301 [1,1,1,0,0,0|1,0,0]=4 4632 B13R1.2431 COC(=O)c1cc(ccc1F)O[13CH3] 34a_100009856154_200025704644 [1,1,1,0,0,0|1,0,0]=4 4633 B13R1.2431 COC(=O)c1cc(ccc1F)O[13CH3] 7a_100009856154_200025704644 [1,1,1,0,0,0|1,0,0]=4 4634 B13R1.2431 COC(=O)c1cc(ccc1F)SC 62a_100000216675_200000210301 [1,1,1,0,0,0|1,0,0]=4 4635 B13R1.2431 COC(=O)c1cc(ccc1F)SC 62a_200000210301_100000216675 [1,1,1,0,0,0|1,0,0]=4 4636 B13R1.2431 COC(=O)c1cc(ccc1F)S[13CH3] 62a_100000216675_200025704644 [1,1,1,0,0,0|1,0,0]=4 4637 B13R1.2431 COC(=O)c1cc(ccc1F)S[13CH3] 62a_200025704644_100000216675 [1,1,1,0,0,0|1,0,0]=4 4638 B13R1.2431 COC(=O)c1cc(ccc1I)OC 34a_200009888904_200000210301 [1,1,1,0,0,0|1,0,0]=4 4639 B13R1.2431 COC(=O)c1cc(ccc1I)OC 7a_200009888904_200000210301 [1,1,1,0,0,0|1,0,0]=4 4640 B13R1.2431 COC(=O)c1cc(ccc1I)O[13CH3] 34a_200009888904_200025704644 [1,1,1,0,0,0|1,0,0]=4 4641 B13R1.2431 COC(=O)c1cc(ccc1I)O[13CH3] 7a_200009888904_200025704644 [1,1,1,0,0,0|1,0,0]=4 4642 B13R1.2431 COC(=O)c1cc(ccc1N)OC 34a_100000694981_200000210301 [1,1,1,0,0,0|1,0,0]=4 4643 B13R1.2431 COC(=O)c1cc(ccc1N)OC 7a_100000694981_200000210301 [1,1,1,0,0,0|1,0,0]=4 4644 B13R1.2431 COC(=O)c1cc(ccc1N)O[13CH3] 34a_100000694981_200025704644 [1,1,1,0,0,0|1,0,0]=4 4645 B13R1.2431 COC(=O)c1cc(ccc1N)O[13CH3] 7a_100000694981_200025704644 [1,1,1,0,0,0|1,0,0]=4 4646 B13R1.2431 COC(=O)c1cc(ccc1N)SC 62a_100000212070_200000210301 [1,1,1,0,0,0|1,0,0]=4 4647 B13R1.2431 COC(=O)c1cc(ccc1N)S[13CH3] 62a_100000212070_200025704644 [1,1,1,0,0,0|1,0,0]=4 4648 B13R1.2431 COC(=O)c1cc(ccc1O)CN 271570a_203496583355_100016988414 [1,1,1,0,0,0|1,0,0]=4 4649 B13R1.2431 COC(=O)c1cc(ccc1O)OC 271570a_203496583355_100000151459 [1,1,1,0,0,0|1,0,0]=4 4650 B13R1.2431 COC(=O)c1cc(ccc1O)SC 62a_200000210301_100000149868 [1,1,1,0,0,0|1,0,0]=4 4651 B13R1.2431 COC(=O)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000149868 [1,1,1,0,0,0|1,0,0]=4 4652 B13R1.36 CCc1ccc(cc1)C(=O)C(C)C 1458a_100000211226_100000210206 [1,1,1,0,0,0|1,0,0]=4 4653 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 11a_100102631434_100000211226 [1,1,1,0,0,0|1,0,0]=4 4654 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 1626a_100102631434_100000211226 [1,1,1,0,0,0|1,0,0]=4 4655 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 240690a_100102631434_100000211226 [1,1,1,0,0,0|1,0,0]=4 4656 B13R1.36 CCc1ccc(cc1)C(=O)N(C)C 527a_100102631434_100000211226 [1,1,1,0,0,0|1,0,0]=4 4657 B13R1.95 CCC(=O)c1ccc(cc1F)CC 1458a_200009867912_100000210202 [1,1,1,0,0,0|1,0,0]=4 4658 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 11a_106832991635_200009867912 [1,1,1,0,0,0|1,0,0]=4 4659 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 1626a_100102657272_200009867912 [1,1,1,0,0,0|1,0,0]=4 4660 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 240690a_100102657272_200009867912 [1,1,1,0,0,0|1,0,0]=4 4661 B13R1.95 CCc1ccc(c(c1)F)C(=O)NC 527a_100102657272_200009867912 [1,1,1,0,0,0|1,0,0]=4 4662 B13R1.95 COC(=O)c1ccc(cc1Br)OC 34a_100010150825_200000210301 [1,1,1,0,0,0|1,0,0]=4 4663 B13R1.95 COC(=O)c1ccc(cc1Br)OC 7a_100010150825_200000210301 [1,1,1,0,0,0|1,0,0]=4 4664 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 34a_100010150825_200025704644 [1,1,1,0,0,0|1,0,0]=4 4665 B13R1.95 COC(=O)c1ccc(cc1Br)O[13CH3] 7a_100010150825_200025704644 [1,1,1,0,0,0|1,0,0]=4 4666 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_100010247156_200000210301 [1,1,1,0,0,0|1,0,0]=4 4667 B13R1.95 COC(=O)c1ccc(cc1Br)SC 62a_200000210301_100010247156 [1,1,1,0,0,0|1,0,0]=4 4668 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_100010247156_200025704644 [1,1,1,0,0,0|1,0,0]=4 4669 B13R1.95 COC(=O)c1ccc(cc1Br)S[13CH3] 62a_200025704644_100010247156 [1,1,1,0,0,0|1,0,0]=4 4670 B13R1.95 COC(=O)c1ccc(cc1C)OC 34a_100012000157_200000210301 [1,1,1,0,0,0|1,0,0]=4 4671 B13R1.95 COC(=O)c1ccc(cc1C)OC 7a_100012000157_200000210301 [1,1,1,0,0,0|1,0,0]=4 4672 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 34a_100012000157_200025704644 [1,1,1,0,0,0|1,0,0]=4 4673 B13R1.95 COC(=O)c1ccc(cc1C)O[13CH3] 7a_100012000157_200025704644 [1,1,1,0,0,0|1,0,0]=4 4674 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_100000747612_200000210301 [1,1,1,0,0,0|1,0,0]=4 4675 B13R1.95 COC(=O)c1ccc(cc1C)SC 62a_200000210301_100000747612 [1,1,1,0,0,0|1,0,0]=4 4676 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_100000747612_200025704644 [1,1,1,0,0,0|1,0,0]=4 4677 B13R1.95 COC(=O)c1ccc(cc1C)S[13CH3] 62a_200025704644_100000747612 [1,1,1,0,0,0|1,0,0]=4 4678 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 34a_100000081488_200000210301 [1,1,1,0,0,0|1,0,0]=4 4679 B13R1.95 COC(=O)c1ccc(cc1Cl)OC 7a_100000081488_200000210301 [1,1,1,0,0,0|1,0,0]=4 4680 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 34a_100000081488_200025704644 [1,1,1,0,0,0|1,0,0]=4 4681 B13R1.95 COC(=O)c1ccc(cc1Cl)O[13CH3] 7a_100000081488_200025704644 [1,1,1,0,0,0|1,0,0]=4 4682 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_100000060724_200000210301 [1,1,1,0,0,0|1,0,0]=4 4683 B13R1.95 COC(=O)c1ccc(cc1Cl)SC 62a_200000210301_100000060724 [1,1,1,0,0,0|1,0,0]=4 4684 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_100000060724_200025704644 [1,1,1,0,0,0|1,0,0]=4 4685 B13R1.95 COC(=O)c1ccc(cc1Cl)S[13CH3] 62a_200025704644_100000060724 [1,1,1,0,0,0|1,0,0]=4 4686 B13R1.95 COC(=O)c1ccc(cc1F)OC 34a_100011999631_200000210301 [1,1,1,0,0,0|1,0,0]=4 4687 B13R1.95 COC(=O)c1ccc(cc1F)OC 7a_100011999631_200000210301 [1,1,1,0,0,0|1,0,0]=4 4688 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 34a_100011999631_200025704644 [1,1,1,0,0,0|1,0,0]=4 4689 B13R1.95 COC(=O)c1ccc(cc1F)O[13CH3] 7a_100011999631_200025704644 [1,1,1,0,0,0|1,0,0]=4 4690 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_100000216654_200000210301 [1,1,1,0,0,0|1,0,0]=4 4691 B13R1.95 COC(=O)c1ccc(cc1F)SC 62a_200000210301_100000216654 [1,1,1,0,0,0|1,0,0]=4 4692 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_100000216654_200025704644 [1,1,1,0,0,0|1,0,0]=4 4693 B13R1.95 COC(=O)c1ccc(cc1F)S[13CH3] 62a_200025704644_100000216654 [1,1,1,0,0,0|1,0,0]=4 4694 B13R1.95 COC(=O)c1ccc(cc1N)OC 34a_100000701581_200000210301 [1,1,1,0,0,0|1,0,0]=4 4695 B13R1.95 COC(=O)c1ccc(cc1N)OC 7a_100000701581_200000210301 [1,1,1,0,0,0|1,0,0]=4 4696 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 34a_100000701581_200025704644 [1,1,1,0,0,0|1,0,0]=4 4697 B13R1.95 COC(=O)c1ccc(cc1N)O[13CH3] 7a_100000701581_200025704644 [1,1,1,0,0,0|1,0,0]=4 4698 B13R1.95 COC(=O)c1ccc(cc1N)SC 62a_100011373473_200000210301 [1,1,1,0,0,0|1,0,0]=4 4699 B13R1.95 COC(=O)c1ccc(cc1N)S[13CH3] 62a_100011373473_200025704644 [1,1,1,0,0,0|1,0,0]=4 4700 B13R1.95 COC(=O)c1ccc(cc1O)OC 271570a_203496583355_100009815674 [1,1,1,0,0,0|1,0,0]=4 4701 B13R1.95 COC(=O)c1ccc(cc1O)SC 62a_200000210301_100000062286 [1,1,1,0,0,0|1,0,0]=4 4702 B13R1.95 COC(=O)c1ccc(cc1O)S[13CH3] 62a_200025704644_100000062286 [1,1,1,0,0,0|1,0,0]=4 4703 B13R1.452 CCCC(=O)c1ccc(cc1)CC 1458a_100000211226_100000210303 [1,1,1,0,0,0|1,0,0]=4 4704 B13R1.452 CCNC(=O)c1ccc(cc1)CC 11a_100015525214_100000211226 [1,1,1,0,0,0|1,0,0]=4 4705 B13R1.452 CCNC(=O)c1ccc(cc1)CC 240690a_100015525214_100000211226 [1,1,1,0,0,0|1,0,0]=4 4706 B13R1.452 CCNC(=O)c1ccc(cc1)CC 527a_100015525214_100000211226 [1,1,1,0,0,0|1,0,0]=4 4707 B13R1.452 CCOC(=O)c1ccc(cc1)OC 34a_100000169885_200000210301 [1,1,1,0,0,0|1,0,0]=4 4708 B13R1.452 CCOC(=O)c1ccc(cc1)OC 7a_100000169885_200000210301 [1,1,1,0,0,0|1,0,0]=4 4709 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 34a_100000169885_200025704644 [1,1,1,0,0,0|1,0,0]=4 4710 B13R1.452 CCOC(=O)c1ccc(cc1)O[13CH3] 7a_100000169885_200025704644 [1,1,1,0,0,0|1,0,0]=4 4711 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_100000169895_200000210301 [1,1,1,0,0,0|1,0,0]=4 4712 B13R1.452 CCOC(=O)c1ccc(cc1)SC 62a_200000210301_100000169919 [1,1,1,0,0,0|1,0,0]=4 4713 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_100000169895_200025704644 [1,1,1,0,0,0|1,0,0]=4 4714 B13R1.452 CCOC(=O)c1ccc(cc1)S[13CH3] 62a_200025704644_100000169919 [1,1,1,0,0,0|1,0,0]=4 4715 B13R1.452 CCc1ccc(cc1)C(=O)CCF 1458a_100000211226_100011217306 [1,1,1,0,0,0|1,0,0]=4 4716 B13R1.452 CCc1ccc(cc1)C(=O)CCO 1458a_100000211226_100000211926 [1,1,1,0,0,0|1,0,0]=4 4717 B13R1.452 CCc1ccc(cc1)C(=O)CNC 2230a_106832991635_100000689809 [1,1,1,0,0,0|1,0,0]=4 4718 B13R1.452 CCc1ccc(cc1)C(=O)CNC 7a_106832991635_100000183122 [1,1,1,0,0,0|1,0,0]=4 4719 B13R1.452 CCc1ccc(cc1)C(=O)CSC 62a_100000689809_200000210301 [1,1,1,0,0,0|0,1,0]=4 4720 B13R1.452 CCc1ccc(cc1)C(=O)CSC 62a_200000210301_100000689809 [1,1,1,0,0,0|0,1,0]=4 4721 B13R1.452 CCc1ccc(cc1)C(=O)CS[13CH3] 62a_100000689809_200025704644 [1,1,1,0,0,0|0,1,0]=4 4722 B13R1.452 CCc1ccc(cc1)C(=O)CS[13CH3] 62a_200025704644_100000689809 [1,1,1,0,0,0|0,1,0]=4 4723 B13R1.452 CCc1ccc(cc1)C(=O)NNC 22a_100016993582_100000211226 [1,1,1,0,0,0|1,0,0]=4 4724 B13R1.452 COCC(=O)c1ccc(cc1)OC 34a_200009861119_200000210301 [1,1,1,0,0,0|1,0,0]=4 4725 B13R1.452 COCC(=O)c1ccc(cc1)OC 7a_200009861119_200000210301 [1,1,1,0,0,0|1,0,0]=4 4726 B13R1.452 COCC(=O)c1ccc(cc1)O[13CH3] 34a_200009861119_200025704644 [1,1,1,0,0,0|1,0,0]=4 4727 B13R1.452 COCC(=O)c1ccc(cc1)O[13CH3] 7a_200009861119_200025704644 [1,1,1,0,0,0|1,0,0]=4 4728 B13R1.452 COCC(=O)c1ccc(cc1)SC 34a_100138415774_100011216809 [1,1,1,0,0,0|1,0,0]=4 4729 B13R1.452 COCC(=O)c1ccc(cc1)SC 62a_200011343064_200000210301 [1,1,1,0,0,0|1,0,0]=4 4730 B13R1.452 COCC(=O)c1ccc(cc1)S[13CH3] 62a_200011343064_200025704644 [1,1,1,0,0,0|1,0,0]=4 4731 B13R1.537 C=C(C)c1ccc(cc1)C(=O)OC 271570a_100000694244_100000150774 [1,1,1,0,0,0|0,0,1]=4 4732 B13R1.537 CCC(=O)c1ccc(cc1)C(C)C 1458a_100000210772_100000210202 [1,1,1,0,0,0|1,0,0]=4 4733 B13R1.537 CCC(=O)c1ccc(cc1)C(C)O 1458a_100000076921_100000210202 [1,1,1,0,0,0|1,0,0]=4 4734 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 11a_106832991635_100000210772 [1,1,1,0,0,0|1,0,0]=4 4735 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 1626a_100102657272_100000210772 [1,1,1,0,0,0|1,0,0]=4 4736 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 240690a_100102657272_100000210772 [1,1,1,0,0,0|1,0,0]=4 4737 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C 527a_100102657272_100000210772 [1,1,1,0,0,0|1,0,0]=4 4738 B13R1.537 CNC(=O)c1ccc(cc1)C(C)O 240690a_100102657272_100000076921 [1,1,1,0,0,0|1,0,0]=4 4739 B13R1.537 COC(=O)c1ccc(cc1)C(=O)C 1458a_100000211811_200000210301 [1,1,1,0,0,0|0,0,1]=4 4740 B13R1.537 COC(=O)c1ccc(cc1)C(=O)[13CH3] 1458a_100000211811_200025704644 [1,1,1,0,0,0|0,0,1]=4 4741 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 2230a_100000220287_200000210301 [1,1,1,0,0,0|1,0,0]=4 4742 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 269982a_100000220287_200000210301 [1,1,1,0,0,0|1,0,0]=4 4743 B13R1.537 COC(=O)c1ccc(cc1)N(C)C 34a_100000220287_200000210301 [1,1,1,0,0,0|1,0,0]=4 4744 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 2230a_100000220287_200025704644 [1,1,1,0,0,0|1,0,0]=4 4745 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 269982a_100000220287_200025704644 [1,1,1,0,0,0|1,0,0]=4 4746 B13R1.537 COC(=O)c1ccc(cc1)N(C)[13CH3] 34a_100000220287_200025704644 [1,1,1,0,0,0|1,0,0]=4 4747 B13R1.74 C=C(C)c1ccc(cc1)CCCN 271570a_100000694244_100011297623 [1,1,1,0,0,0|1,0,0]=4 4748 B13R1.74 C=C(C)c1ccc(cc1)CCNC 271570a_100000694244_100000752880 [1,1,1,0,0,0|1,0,0]=4 4749 B13R1.74 C=C(C)c1ccc(cc1)OCCN 271570a_100000694244_100000746992 [1,1,1,0,0,0|1,0,0]=4 4750 B13R1.74 C=C(C)c1ccc(cc1)SCCN 271570a_100000694244_100000184645 [1,1,1,0,0,0|1,0,0]=4 4751 B13R1.74 CC(=O)c1ccc(cc1)CCS[13CH3] 62a_200000038727_200025704644 [1,1,1,0,0,0|1,0,0]=4 4752 B13R1.74 CC(=O)c1ccc(cc1)CCS[13CH3] 62a_200025704644_200000038727 [1,1,1,0,0,0|1,0,0]=4 4753 B13R1.74 CC(=O)c1ccc(cc1)COCF 7a_100000082505_100015361967 [1,1,1,0,0,0|1,0,0]=4 4754 B13R1.74 CC(=O)c1ccc(cc1)CSCF 62a_100000756337_100015361967 [1,1,1,0,0,0|1,0,0]=4 4755 B13R1.74 CC(=O)c1ccc(cc1)CSCF 62a_100015361967_100000756337 [1,1,1,0,0,0|1,0,0]=4 4756 B13R1.74 CC(=O)c1ccc(cc1)OCCF 34a_100000185113_100011217306 [1,1,1,0,0,0|1,0,0]=4 4757 B13R1.74 CC(=O)c1ccc(cc1)OCCF 7a_100000185113_100011217306 [1,1,1,0,0,0|1,0,0]=4 4758 B13R1.74 CC(=O)c1ccc(cc1)OCCO 1458a_100000217286_200000210301 [1,1,1,0,0,0|1,0,0]=4 4759 B13R1.74 CC(=O)c1ccc(cc1)OCCO 34a_100000185113_100000211926 [1,1,1,0,0,0|1,0,0]=4 4760 B13R1.74 CC(=O)c1ccc(cc1)OCCO 7a_100000185113_100000211926 [1,1,1,0,0,0|1,0,0]=4 4761 B13R1.74 CC(=O)c1ccc(cc1)SCCF 62a_100000185465_100011217306 [1,1,1,0,0,0|1,0,0]=4 4762 B13R1.74 CC(=O)c1ccc(cc1)SCCF 62a_100011217306_100000185465 [1,1,1,0,0,0|1,0,0]=4 4763 B13R1.74 CC(=O)c1ccc(cc1)SCCO 1458a_200000182347_200000210301 [1,1,1,0,0,0|1,0,0]=4 4764 B13R1.74 CC(=O)c1ccc(cc1)SCCO 62a_100000185465_100000211926 [1,1,1,0,0,0|1,0,0]=4 4765 B13R1.74 CC(=O)c1ccc(cc1)SCCO 62a_100000211926_100000185465 [1,1,1,0,0,0|1,0,0]=4 4766 B13R1.74 CCCCc1ccc(cc1)C(=O)C 1458a_100000186158_200000210301 [1,1,1,0,0,0|1,0,0]=4 4767 B13R1.74 CCCCc1ccc(cc1)C(=O)C 271570a_100020621405_100000185465 [1,1,1,0,0,0|1,0,0]=4 4768 B13R1.74 CCCCc1ccc(cc1)C(=O)[13CH3] 1458a_100000186158_200025704644 [1,1,1,0,0,0|1,0,0]=4 4769 B13R1.74 CCCOc1ccc(cc1)C(=O)C 1458a_100000182924_200000210301 [1,1,1,0,0,0|1,0,0]=4 4770 B13R1.74 CCCOc1ccc(cc1)C(=O)C 34a_100000185113_100000210303 [1,1,1,0,0,0|1,0,0]=4 4771 B13R1.74 CCCOc1ccc(cc1)C(=O)C 7a_100000185113_100000210303 [1,1,1,0,0,0|1,0,0]=4 4772 B13R1.74 CCCOc1ccc(cc1)C(=O)[13CH3] 1458a_100000182924_200025704644 [1,1,1,0,0,0|1,0,0]=4 4773 B13R1.74 CCCSc1ccc(cc1)C(=O)C 62a_100000185465_100000210303 [1,1,1,0,0,0|1,0,0]=4 4774 B13R1.74 CCCSc1ccc(cc1)C(=O)C 62a_100000210303_100000185465 [1,1,1,0,0,0|1,0,0]=4 4775 B13R1.74 CCNCc1ccc(cc1)C(=O)C 2230a_100015525214_100000756337 [1,1,1,0,0,0|1,0,0]=4 4776 B13R1.74 CCNCc1ccc(cc1)C(=O)O 269956a_100000181780_100000210202 [1,1,1,0,0,0|1,0,0]=4 4777 B13R1.74 CCOCc1ccc(cc1)C(=O)C 34a_100121572206_100000756337 [1,1,1,0,0,0|1,0,0]=4 4778 B13R1.74 CCOCc1ccc(cc1)C(=O)C 7a_100000082505_100000210202 [1,1,1,0,0,0|1,0,0]=4 4779 B13R1.74 CCSCc1ccc(cc1)C(=O)C 1458a_100000193729_200000210301 [1,1,1,0,0,0|1,0,0]=4 4780 B13R1.74 CCSCc1ccc(cc1)C(=O)C 62a_100000210202_100000756337 [1,1,1,0,0,0|1,0,0]=4 4781 B13R1.74 CCSCc1ccc(cc1)C(=O)C 62a_100000756337_100000210202 [1,1,1,0,0,0|1,0,0]=4 4782 B13R1.74 CCSCc1ccc(cc1)C(=O)[13CH3] 1458a_100000193729_200025704644 [1,1,1,0,0,0|1,0,0]=4 4783 B13R1.74 CNCCc1ccc(cc1)C(=O)C 2230a_106832991635_200000038727 [1,1,1,0,0,0|0,0,0]=3 4784 B13R1.74 CNCCc1ccc(cc1)C(=O)C 34a_100102657272_200000038727 [1,1,1,0,0,0|0,0,0]=3 4785 B13R1.74 CNCCc1ccc(cc1)C(=O)C 7a_106832991635_200000038727 [1,1,1,0,0,0|0,0,0]=3 4786 B13R1.74 CNCCc1ccc(cc1)C(=O)O 269956a_100000704756_200000210301 [1,1,1,0,0,0|0,0,0]=3 4787 B13R1.74 COCCc1ccc(cc1)C(=O)C 34a_100138415774_200000038727 [1,1,1,0,0,0|1,0,0]=4 4788 B13R1.74 CSCCc1ccc(cc1)C(=O)C 62a_200000038727_200000210301 [1,1,1,0,0,0|1,0,0]=4 4789 B13R1.74 CSCCc1ccc(cc1)C(=O)C 62a_200000210301_200000038727 [1,1,1,0,0,0|1,0,0]=4 4790 B13R1.74 O=C(O)c1ccc(cc1)CNCF 269956a_100000181780_100015361967 [1,1,1,0,0,0|1,0,0]=4 4791 B13R1.74 [13CH3]C(=O)c1ccc(cc1)OCCO 1458a_100000217286_200025704644 [1,1,1,0,0,0|1,0,0]=4 4792 B13R1.74 [13CH3]C(=O)c1ccc(cc1)SCCO 1458a_200000182347_200025704644 [1,1,1,0,0,0|1,0,0]=4 4793 B13R1.74 [13CH3]NCCc1ccc(cc1)C(=O)O 269956a_100000704756_200025704644 [1,1,1,0,0,0|0,0,0]=3 4794 B13R1.144 CCCc1ccc(cc1Br)C(=O)C 1458a_200010235943_200000210301 [1,1,1,0,0,0|1,0,0]=4 4795 B13R1.144 CCCc1ccc(cc1Br)C(=O)[13CH3] 1458a_200010235943_200025704644 [1,1,1,0,0,0|1,0,0]=4 4796 B13R1.585 CC(=O)c1ccc(cc1)CC(C)C 1458a_100000185289_200000210301 [1,1,1,0,0,0|1,0,0]=4 4797 B13R1.585 CC(C)Cc1ccc(cc1)C(=O)[13CH3] 1458a_100000185289_200025704644 [1,1,1,0,0,0|1,0,0]=4 4798 B13R1.77 CC=Cc1ccc(cc1)CCCN 271570a_100016259895_100011297623 [1,1,1,0,0,0|1,0,0]=4 4799 B13R1.77 CC=Cc1ccc(cc1)CCNC 271570a_100016259895_100000752880 [1,1,1,0,0,0|1,0,0]=4 4800 B13R1.77 CC=Cc1ccc(cc1)OCCN 271570a_100016259895_100000746992 [1,1,1,0,0,0|1,0,0]=4 4801 B13R1.77 CC=Cc1ccc(cc1)SCCN 271570a_100016259895_100000184645 [1,1,1,0,0,0|1,0,0]=4 4802 B13R1.77 COCSc1ccc(cc1)CCN 62a_100000755846_100000766300 [1,1,1,0,0,0|0,0,1]=4 4803 B13R1.77 COCSc1ccc(cc1)CCN 62a_100000766300_100000755846 [1,1,1,0,0,0|0,0,1]=4 4804 B13R1.142 CC(=Cc1ccc(cc1)CCN)C 271570a_100102525489_100000755846 [1,1,1,0,0,0|1,0,0]=4 4805 B13R1.373 CC=Cc1cccc(c1)NC(C)C 271570a_100016259895_100000219649 [1,1,1,0,0,0|1,0,0]=4 4806 B13R1.373 CCNc1cccc(c1)C=C(C)C 271570a_100102525489_100000738899 [1,1,1,0,0,0|1,0,0]=4 4807 B13R1.373 COCc1cccc(c1)NC(C)C 2230a_100000737370_100000210206 [1,1,1,0,0,0|0,0,1]=4 4808 B13R1.373 COCc1cccc(c1)NC(C)C 34a_100000737370_100000210206 [1,1,1,0,0,0|0,0,1]=4 4809 B13R1.567 CC=Cc1cccc(c1)CNCC 271570a_100016259895_100000187426 [1,1,1,0,0,0|1,0,0]=4 4810 B13R1.567 CCCNc1cccc(c1)COC 2230a_100000737370_100000210303 [1,1,1,0,0,0|0,0,1]=4 4811 B13R1.567 CCCNc1cccc(c1)COC 34a_100000737370_100000210303 [1,1,1,0,0,0|0,0,1]=4 4812 B13R1.567 CCNc1cccc(c1)OCOC 34a_100012265470_100000210202 [1,1,1,0,0,0|0,0,1]=4 4813 B13R1.567 CCNc1cccc(c1)SCOC 62a_100000766300_100000738899 [1,1,1,0,0,0|0,0,1]=4 4814 B13R1.567 COCNc1cccc(c1)COC 2230a_100000737370_100000766300 [1,1,1,0,0,0|0,0,1]=4 4815 B13R1.567 COCc1cccc(c1)NCCF 2230a_100000737370_100011217306 [1,1,1,0,0,0|0,0,1]=4 4816 B13R1.567 COCc1cccc(c1)NCCF 34a_100000737370_100011217306 [1,1,1,0,0,0|0,0,1]=4 4817 B13R1.567 COCc1cccc(c1)NCCO 2230a_100000737370_100000211926 [1,1,1,0,0,0|0,0,1]=4 4818 B13R1.567 COCc1cccc(c1)NCCO 34a_100000737370_100000211926 [1,1,1,0,0,0|0,0,1]=4 4819 B13R1.567 COCc1cccc(c1)NCSC 2230a_100000737370_100011218213 [1,1,1,0,0,0|0,0,1]=4 4820 B13R1.567 COCc1cccc(c1)NCSC 34a_100000737370_100011218213 [1,1,1,0,0,0|0,0,1]=4 4821 B13R1.31 CCNc1cc(cc(c1)C(=O)N)F 34a_200011998915_100000210202 [1,1,1,0,0,0|1,0,0]=4 4822 B13R1.31 CCNc1cc(cc(c1)C(=O)N)F 7a_200011998915_100000210202 [1,1,1,0,0,0|1,0,0]=4 4823 B13R1.31 CCOc1cc(cc(c1)C(=O)C)C 1458a_200010998560_200000210301 [1,1,1,0,0,0|1,0,0]=4 4824 B13R1.31 CCOc1cc(cc(c1)C(=O)C)C 34a_100009855872_100000210202 [1,1,1,0,0,0|1,0,0]=4 4825 B13R1.31 CCOc1cc(cc(c1)C(=O)C)C 7a_100009855872_100000210202 [1,1,1,0,0,0|1,0,0]=4 4826 B13R1.31 CCOc1cc(cc(c1)C(=O)[13CH3])C 1458a_200010998560_200025704644 [1,1,1,0,0,0|1,0,0]=4 4827 B13R1.31 CCSc1cc(cc(c1)C(=O)C)Br 62a_100000210202_100010005435 [1,1,1,0,0,0|1,0,0]=4 4828 B13R1.31 CCSc1cc(cc(c1)C(=O)C)Br 62a_100010005435_100000210202 [1,1,1,0,0,0|1,0,0]=4 4829 B13R1.31 CCSc1cc(cc(c1)C(=O)C)C 62a_100000210202_100000694479 [1,1,1,0,0,0|1,0,0]=4 4830 B13R1.31 CCSc1cc(cc(c1)C(=O)C)C 62a_100000694479_100000210202 [1,1,1,0,0,0|1,0,0]=4 4831 B13R1.31 CCSc1cc(cc(c1)C(=O)C)F 62a_100000210202_100012361402 [1,1,1,0,0,0|1,0,0]=4 4832 B13R1.31 CCSc1cc(cc(c1)C(=O)C)F 62a_100012361402_100000210202 [1,1,1,0,0,0|1,0,0]=4 4833 B13R1.375 CCNc1cccc(c1)S(=O)(=O)C 34a_100000209861_100000210202 [1,1,1,0,0,0|1,0,0]=4 4834 B13R1.375 CCNc1cccc(c1)S(=O)(=O)C 7a_100000209861_100000210202 [1,1,1,0,0,0|1,0,0]=4 4835 B13R1.377 CCNc1cccc(c1C)C(=O)N 34a_100000738810_100000210202 [1,1,1,0,0,0|1,0,0]=4 4836 B13R1.377 CCNc1cccc(c1C)C(=O)N 7a_100000738810_100000210202 [1,1,1,0,0,0|1,0,0]=4 4837 B13R1.377 CCNc1cccc(c1F)C(=O)N 34a_100014075672_100000210202 [1,1,1,0,0,0|1,0,0]=4 4838 B13R1.377 CCOc1cccc(c1C)C(=O)C 34a_200009877264_100000210202 [1,1,1,0,0,0|1,0,0]=4 4839 B13R1.377 CCOc1cccc(c1C)C(=O)C 7a_200009877264_100000210202 [1,1,1,0,0,0|1,0,0]=4 4840 B13R1.377 CCOc1cccc(c1F)C(=O)C 1458a_100000100213_200000210301 [1,1,1,0,0,0|1,0,0]=4 4841 B13R1.377 CCOc1cccc(c1F)C(=O)C 34a_100009856408_100000210202 [1,1,1,0,0,0|1,0,0]=4 4842 B13R1.377 CCOc1cccc(c1F)C(=O)C 7a_100009856408_100000210202 [1,1,1,0,0,0|1,0,0]=4 4843 B13R1.377 CCOc1cccc(c1F)C(=O)[13CH3] 1458a_100000100213_200025704644 [1,1,1,0,0,0|1,0,0]=4 4844 B13R1.377 CCOc1cccc(c1N)C(=O)C 7a_100000036053_100000210202 [1,1,1,0,0,0|1,0,0]=4 4845 B13R1.377 CCSc1cccc(c1C)C(=O)C 62a_100000210202_100012706834 [1,1,1,0,0,0|1,0,0]=4 4846 B13R1.377 CCSc1cccc(c1C)C(=O)C 62a_100012706834_100000210202 [1,1,1,0,0,0|1,0,0]=4 4847 B13R1.377 CCSc1cccc(c1F)C(=O)C 62a_100000210202_100012355707 [1,1,1,0,0,0|1,0,0]=4 4848 B13R1.377 CCSc1cccc(c1F)C(=O)C 62a_100012355707_100000210202 [1,1,1,0,0,0|1,0,0]=4 4849 B13R1.568 C=C(C)c1cccc(c1)CNCC 271570a_100000694244_100000187426 [1,1,1,0,0,0|1,0,0]=4 4850 B13R1.568 CC(=O)c1cccc(c1)OCCF 34a_100000211620_100011217306 [1,1,1,0,0,0|1,0,0]=4 4851 B13R1.568 CC(=O)c1cccc(c1)OCCF 7a_100000211620_100011217306 [1,1,1,0,0,0|1,0,0]=4 4852 B13R1.568 CC(=O)c1cccc(c1)OCCO 1458a_100000217287_200000210301 [1,1,1,0,0,0|1,0,0]=4 4853 B13R1.568 CC(=O)c1cccc(c1)OCCO 34a_100000211620_100000211926 [1,1,1,0,0,0|1,0,0]=4 4854 B13R1.568 CC(=O)c1cccc(c1)OCCO 7a_100000211620_100000211926 [1,1,1,0,0,0|1,0,0]=4 4855 B13R1.568 CC(=O)c1cccc(c1)SCCF 62a_100000210093_100011217306 [1,1,1,0,0,0|1,0,0]=4 4856 B13R1.568 CC(=O)c1cccc(c1)SCCF 62a_100011217306_100000210093 [1,1,1,0,0,0|1,0,0]=4 4857 B13R1.568 CC(=O)c1cccc(c1)SCCO 62a_100000210093_100000211926 [1,1,1,0,0,0|1,0,0]=4 4858 B13R1.568 CC(=O)c1cccc(c1)SCCO 62a_100000211926_100000210093 [1,1,1,0,0,0|1,0,0]=4 4859 B13R1.568 CC(=O)c1cccc(n1)NCCO 27a_100000210304_100000085735 [1,1,1,0,0,0|1,0,0]=4 4860 B13R1.568 CCCCc1cccc(c1)C(=O)C 1458a_100012178757_200000210301 [1,1,1,0,0,0|1,0,0]=4 4861 B13R1.568 CCCCc1cccc(c1)C(=O)C 271570a_100020621405_100000210093 [1,1,1,0,0,0|1,0,0]=4 4862 B13R1.568 CCCCc1cccc(c1)C(=O)[13CH3] 1458a_100012178757_200025704644 [1,1,1,0,0,0|1,0,0]=4 4863 B13R1.568 CCCNc1cccc(c1)C(=O)N 34a_100000217337_100000210303 [1,1,1,0,0,0|1,0,0]=4 4864 B13R1.568 CCCOc1cccc(c1)C(=O)C 1458a_100000216339_200000210301 [1,1,1,0,0,0|1,0,0]=4 4865 B13R1.568 CCCOc1cccc(c1)C(=O)C 34a_100000211620_100000210303 [1,1,1,0,0,0|1,0,0]=4 4866 B13R1.568 CCCOc1cccc(c1)C(=O)C 7a_100000211620_100000210303 [1,1,1,0,0,0|1,0,0]=4 4867 B13R1.568 CCCOc1cccc(c1)C(=O)[13CH3] 1458a_100000216339_200025704644 [1,1,1,0,0,0|1,0,0]=4 4868 B13R1.568 CCCSc1cccc(c1)C(=O)C 62a_100000210093_100000210303 [1,1,1,0,0,0|1,0,0]=4 4869 B13R1.568 CCCSc1cccc(c1)C(=O)C 62a_100000210303_100000210093 [1,1,1,0,0,0|1,0,0]=4 4870 B13R1.568 CCNCc1cccc(c1)C(=O)C 2230a_100015525214_100000084091 [1,1,1,0,0,0|0,0,0]=3 4871 B13R1.568 CCNCc1cccc(c1)C(=O)N 207a_100015525214_100000059704 [1,1,1,0,0,0|1,0,0]=4 4872 B13R1.568 CCNCc1cccc(c1)C(=O)N 2230a_100000746036_100000210202 [1,1,1,0,0,0|1,0,0]=4 4873 B13R1.568 CCNCc1cccc(c1)C(=O)N 2230a_100015525214_100000738444 [1,1,1,0,0,0|1,0,0]=4 4874 B13R1.568 CCNCc1cccc(c1)C(=O)N 270004a_100015525214_100000059704 [1,1,1,0,0,0|1,0,0]=4 4875 B13R1.568 CCNCc1cccc(c1)C(=O)O 269956a_100000752609_100000210202 [1,1,1,0,0,0|0,0,0]=3 4876 B13R1.568 CCOCc1cccc(c1)C(=O)C 34a_100121572206_100000084091 [1,1,1,0,0,0|1,0,0]=4 4877 B13R1.568 CCSCc1cccc(c1)C(=O)C 62a_100000084091_100000210202 [1,1,1,0,0,0|1,0,0]=4 4878 B13R1.568 CCSCc1cccc(c1)C(=O)C 62a_100000210202_100000084091 [1,1,1,0,0,0|1,0,0]=4 4879 B13R1.568 COCSc1cccc(c1)C(=O)C 62a_100000210093_100000766300 [1,1,1,0,0,0|1,0,0]=4 4880 B13R1.568 COCSc1cccc(c1)C(=O)C 62a_100000766300_100000210093 [1,1,1,0,0,0|1,0,0]=4 4881 B13R1.568 CSCNc1cccc(c1)C(=O)N 34a_100000217337_100011218213 [1,1,1,0,0,0|1,0,0]=4 4882 B13R1.568 CSCOc1cccc(c1)C(=O)C 34a_100000211620_100011218213 [1,1,1,0,0,0|1,0,0]=4 4883 B13R1.568 CSCSc1cccc(c1)C(=O)C 62a_100000210093_100011218213 [1,1,1,0,0,0|1,0,0]=4 4884 B13R1.568 CSCSc1cccc(c1)C(=O)C 62a_100011218213_100000210093 [1,1,1,0,0,0|1,0,0]=4 4885 B13R1.568 NC(=O)c1cccc(c1)NCCF 34a_100000217337_100011217306 [1,1,1,0,0,0|1,0,0]=4 4886 B13R1.568 NC(=O)c1cccc(c1)NCCO 34a_100000217337_100000211926 [1,1,1,0,0,0|1,0,0]=4 4887 B13R1.568 O=C(O)c1cccc(c1)CNCF 269956a_100000752609_100015361967 [1,1,1,0,0,0|1,0,0]=4 4888 B13R1.568 [13CH3]C(=O)c1cccc(c1)OCCO 1458a_100000217287_200025704644 [1,1,1,0,0,0|1,0,0]=4 4889 B13R1.587 C=C(C)c1cccc(c1)NC(C)C 271570a_100000694244_100000219649 [1,1,1,0,0,0|1,0,0]=4 4890 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)C 1458a_100000188798_200000210301 [1,1,1,0,0,0|0,0,1]=4 4891 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)[13CH3] 1458a_100000188798_200025704644 [1,1,1,0,0,0|0,0,1]=4 4892 B13R1.587 CC(=O)c1cccc(c1)OC(C)C 1458a_100000186504_200000210301 [1,1,1,0,0,0|1,0,0]=4 4893 B13R1.587 CC(=O)c1cccc(c1)OC(C)C 34a_100000211620_100000210206 [1,1,1,0,0,0|1,0,0]=4 4894 B13R1.587 CC(=O)c1cccc(c1)OC(C)C 7a_100000211620_100000210206 [1,1,1,0,0,0|1,0,0]=4 4895 B13R1.587 CC(=O)c1cccc(c1)SC(C)C 62a_100000210093_100000210206 [1,1,1,0,0,0|1,0,0]=4 4896 B13R1.587 CC(=O)c1cccc(c1)SC(C)C 62a_100000210206_100000210093 [1,1,1,0,0,0|1,0,0]=4 4897 B13R1.587 CC(=O)c1cccc(n1)NC(C)C 27a_100138425928_100000085735 [1,1,1,0,0,0|1,0,0]=4 4898 B13R1.587 CC(C)Nc1cccc(c1)C(=O)N 34a_100000217337_100000210206 [1,1,1,0,0,0|1,0,0]=4 4899 B13R1.587 CC(C)Oc1cccc(c1)C(=O)[13CH3] 1458a_100000186504_200025704644 [1,1,1,0,0,0|1,0,0]=4 4900 B13R1.120 C=C(C)c1ccc(cc1N)C(=O)C 271570a_100000694244_100009816534 [1,1,1,0,0,0|0,0,1]=4 4901 B13R1.120 CC(=O)c1ccc(c(c1)Br)C(C)C 1458a_100010235942_200000210301 [1,1,1,0,0,0|1,0,0]=4 4902 B13R1.120 CC(C)c1ccc(cc1Br)C(=O)[13CH3] 1458a_100010235942_200025704644 [1,1,1,0,0,0|1,0,0]=4 4903 B13R1.35 CCc1ccc(cc1N)C=C(C)C 271570a_100102525489_100012354963 [1,1,1,0,0,0|1,0,0]=4 4904 B13R1.577 CCc1ccc(cc1N)SCOC 62a_100000766300_100012354963 [1,1,1,0,0,0|0,0,1]=4 4905 B13R1.577 CCc1ccc(cc1N)SCOC 62a_100012354963_100000766300 [1,1,1,0,0,0|0,0,1]=4 4906 B13R1.581 CCNCc1ccoc1C(=O)OC 2230a_100015525214_100000734845 [0,1,1,0,1,0|1,0,0]=4 4907 B13R1.581 CCNCc1occc1C(=O)OC 2230a_100015525214_100009813464 [0,1,1,0,1,0|1,0,0]=4 4908 B13R2.599 COc1cc2c(cc1Br)CCC2 34a_200010659162_200000210301 [2,1,0,0,0,0|1,0,0]=4 4909 B13R2.599 COc1cc2c(cc1Br)CCC2 7a_200010659162_200000210301 [2,1,0,0,0,0|1,0,0]=4 4910 B13R2.599 COc1cc2c(cc1F)CCC2 34a_200000146645_200000210301 [2,1,0,0,0,0|1,0,0]=4 4911 B13R2.599 COc1cc2c(cc1F)CCC2 7a_200000146645_200000210301 [2,1,0,0,0,0|1,0,0]=4 4912 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 34a_200010659162_200025704644 [2,1,0,0,0,0|1,0,0]=4 4913 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 7a_200010659162_200025704644 [2,1,0,0,0,0|1,0,0]=4 4914 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 34a_200000146645_200025704644 [2,1,0,0,0,0|1,0,0]=4 4915 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 7a_200000146645_200025704644 [2,1,0,0,0,0|1,0,0]=4 4916 B13R2.669 COc1ccc2c(c1)C(=O)CC2 34a_100009827925_200000210301 [2,1,0,0,0,0|1,0,0]=4 4917 B13R2.669 COc1ccc2c(c1)C(=O)CC2 7a_100009827925_200000210301 [2,1,0,0,0,0|1,0,0]=4 4918 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 34a_100009827925_200025704644 [2,1,0,0,0,0|1,0,0]=4 4919 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 7a_100009827925_200025704644 [2,1,0,0,0,0|1,0,0]=4 4920 B13R2.467 CCOCc1ccc2c(c1)CC2 34a_100010733339_100000210202 [1,1,0,0,1,0|0,0,1]=4 4921 B13R2.467 CCOCc1ccc2c(c1)CC2 7a_100010733339_100000210202 [1,1,0,0,1,0|0,0,1]=4 4922 B13R2.467 COCSc1ccc2c(c1)CC2 62a_100000766300_100009818592 [1,1,0,0,1,0|0,0,1]=4 4923 B13R2.467 COCSc1ccc2c(c1)CC2 62a_100009818592_100000766300 [1,1,0,0,1,0|0,0,1]=4 4924 B13R2.467 FCOCc1ccc2c(c1)CC2 34a_100010733339_100015361967 [1,1,0,0,1,0|0,0,1]=4 4925 B13R2.467 FCOCc1ccc2c(c1)CC2 7a_100010733339_100015361967 [1,1,0,0,1,0|0,0,1]=4 4926 B13R2.1279 CC(=Cc1ccc2c(c1)CC2)C 271570a_100102525489_100009818592 [1,1,0,0,1,0|1,0,0]=4 4927 B15R1.1277 CCCC(=O)Nc1ccc(c(c1)NC)C 34a_200011203080_200000210301 [0,1,1,0,0,1|1,0,0]=4 4928 B15R1.1277 CCCC(=O)Nc1ccc(c(c1)NC)C 7a_200011203080_200000210301 [0,1,1,0,0,1|1,0,0]=4 4929 B15R1.1277 CCCC(=O)Nc1ccc(c(c1)N[13CH3])C 34a_200011203080_200025704644 [0,1,1,0,0,1|1,0,0]=4 4930 B15R1.1277 CCCC(=O)Nc1ccc(c(c1)N[13CH3])C 7a_200011203080_200025704644 [0,1,1,0,0,1|1,0,0]=4 4931 B15R1.1277 CCOC(=O)Cc1ccc(c(c1)SC)C 62a_200000210301_200010149176 [0,1,1,0,0,1|1,0,0]=4 4932 B15R1.1277 CCOC(=O)Cc1ccc(c(c1)SC)C 62a_200010149176_200000210301 [0,1,1,0,0,1|1,0,0]=4 4933 B15R1.1277 CCOC(=O)Cc1ccc(c(c1)S[13CH3])C 62a_200010149176_200025704644 [0,1,1,0,0,1|1,0,0]=4 4934 B15R1.1277 CCOC(=O)Cc1ccc(c(c1)S[13CH3])C 62a_200025704644_200010149176 [0,1,1,0,0,1|1,0,0]=4 4935 B15R1.1277 CNc1cc(ccc1C)NC(=O)COC 34a_200011203084_200000210301 [0,1,1,0,0,1|0,0,0]=3 4936 B15R1.1277 CNc1cc(ccc1C)NC(=O)COC 7a_200011203084_200000210301 [0,1,1,0,0,1|0,0,0]=3 4937 B15R1.1277 CNc1cc(ccc1Cl)NC(=O)COC 34a_100011193636_200000210301 [0,1,1,0,0,1|1,0,0]=4 4938 B15R1.1277 COCC(=O)Nc1ccc(c(c1)N[13CH3])C 34a_200011203084_200025704644 [0,1,1,0,0,1|0,0,0]=3 4939 B15R1.1277 COCC(=O)Nc1ccc(c(c1)N[13CH3])C 7a_200011203084_200025704644 [0,1,1,0,0,1|0,0,0]=3 4940 B15R1.1277 COCC(=O)Nc1ccc(c(c1)N[13CH3])Cl 34a_100011193636_200025704644 [0,1,1,0,0,1|1,0,0]=4 4941 B15R1.1277 COCC(=O)Nc1ccc(c(c1)OC)C 11a_100011279678_100000210968 [0,1,1,0,0,1|1,0,0]=4 4942 B15R1.1277 COCC(=O)Nc1ccc(c(c1)OC)C 1626a_100011279678_100000210968 [0,1,1,0,0,1|1,0,0]=4 4943 B15R1.1277 COCC(=O)Nc1ccc(c(c1)OC)C 22a_100011279678_100000210968 [0,1,1,0,0,1|1,0,0]=4 4944 B15R1.1277 COCC(=O)Nc1ccc(c(c1)OC)C 527a_100011279678_100000210968 [0,1,1,0,0,1|1,0,0]=4 4945 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC 34a_100000074908_200000210301 [0,1,1,0,0,1|1,0,0]=4 4946 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)OC 34a_100009869222_200000210301 [0,1,1,0,0,1|1,0,0]=4 4947 B15R1.3769 COC(=O)Cc1ccc(c(c1)OC)O[13CH3] 34a_100000074908_200025704644 [0,1,1,0,0,1|1,0,0]=4 4948 B15R1.3769 COC(=O)Cc1ccc(c(c1)O[13CH3])OC 34a_100009869222_200025704644 [0,1,1,0,0,1|1,0,0]=4 4949 B15R1.3769 COC(=O)Cc1ccc(c(c1)SC)OC 62a_200000210301_200012357789 [0,1,1,0,0,1|1,0,0]=4 4950 B15R1.3769 COC(=O)Cc1ccc(c(c1)SC)OC 62a_200012357789_200000210301 [0,1,1,0,0,1|1,0,0]=4 4951 B15R1.3769 COC(=O)Cc1ccc(c(c1)S[13CH3])OC 62a_200012357789_200025704644 [0,1,1,0,0,1|1,0,0]=4 4952 B15R1.3769 COC(=O)Cc1ccc(c(c1)S[13CH3])OC 62a_200025704644_200012357789 [0,1,1,0,0,1|1,0,0]=4 4953 B15R1.3849 CCC(=O)Nc1ccc(c(c1)N(C)C)C 11a_100011708272_100000210414 [0,1,1,0,0,1|1,0,0]=4 4954 B15R1.3849 CCC(=O)Nc1ccc(c(c1)N(C)C)C 1626a_100011708272_100000210414 [0,1,1,0,0,1|1,0,0]=4 4955 B15R1.3849 CCC(=O)Nc1ccc(c(c1)N(C)C)C 22a_100011708272_100000210414 [0,1,1,0,0,1|1,0,0]=4 4956 B15R1.3849 CCC(=O)Nc1ccc(c(c1)N(C)C)C 527a_100011708272_100000210414 [0,1,1,0,0,1|1,0,0]=4 4957 B15R1.3849 CNC(=O)Nc1ccc(c(c1)N(C)C)C 2430a_100011708272_100102657272 [0,1,1,0,0,1|1,0,0]=4 4958 B15R1.4038 CNc1cc(ccc1C)NC(=O)C(C)C 34a_100000739767_200000210301 [0,1,1,0,0,1|1,0,0]=4 4959 B15R1.4038 CNc1cc(ccc1C)NC(=O)C(C)C 7a_100000739767_200000210301 [0,1,1,0,0,1|1,0,0]=4 4960 B15R1.4038 Cc1ccc(cc1N[13CH3])NC(=O)C(C)C 34a_100000739767_200025704644 [0,1,1,0,0,1|1,0,0]=4 4961 B15R1.4038 Cc1ccc(cc1N[13CH3])NC(=O)C(C)C 7a_100000739767_200025704644 [0,1,1,0,0,1|1,0,0]=4 4962 B15R1.9222 CCC(=O)Nc1ccc(c(c1)NCF)C 34a_100000740061_100015361967 [0,1,1,0,0,1|1,0,0]=4 4963 B15R1.9222 CCC(=O)Nc1ccc(c(c1)NCF)C 7a_100000740061_100015361967 [0,1,1,0,0,1|1,0,0]=4 4964 B15R1.9222 CCNc1cc(ccc1C)NC(=O)CC 34a_100000740061_100000210202 [0,1,1,0,0,1|1,0,0]=4 4965 B15R1.9222 CCNc1cc(ccc1C)NC(=O)CC 7a_100000740061_100000210202 [0,1,1,0,0,1|1,0,0]=4 4966 B15R1.104 CCCCc1ccc(cc1)CC(=O)OC 271570a_100020621405_100000149743 [0,1,1,0,0,1|1,0,0]=4 4967 B15R1.104 CCCCc1ccc(cc1)NC(=O)OC 271570a_100020621405_100000181880 [0,1,1,0,0,1|1,0,0]=4 4968 B15R1.104 CCCOc1ccc(cc1)CC(=O)OC 34a_100000211648_100000210303 [0,1,1,0,0,1|1,0,0]=4 4969 B15R1.104 CCCOc1ccc(cc1)NC(=O)OC 34a_100011235918_100000210303 [0,1,1,0,0,1|1,0,0]=4 4970 B15R1.104 CCCSc1ccc(cc1)CC(=O)OC 62a_100000149743_100000210303 [0,1,1,0,0,1|1,0,0]=4 4971 B15R1.104 CCCSc1ccc(cc1)CC(=O)OC 62a_100000210303_100000149743 [0,1,1,0,0,1|1,0,0]=4 4972 B15R1.104 CCCSc1ccc(cc1)NC(=O)OC 62a_100000210303_100000181880 [0,1,1,0,0,1|1,0,0]=4 4973 B15R1.104 CCNCc1ccc(cc1)CC(=O)OC 2230a_100015525214_100009816886 [0,1,1,0,0,1|1,0,0]=4 4974 B15R1.104 CCNCc1ccc(cc1)CC(=O)OC 270004a_100015525214_100009886798 [0,1,1,0,0,1|1,0,0]=4 4975 B15R1.104 CCOCc1ccc(cc1)CC(=O)OC 34a_100000087118_100000210202 [0,1,1,0,0,1|1,0,0]=4 4976 B15R1.104 CCOCc1ccc(cc1)CC(=O)OC 34a_100121572206_100009816886 [0,1,1,0,0,1|1,0,0]=4 4977 B15R1.104 CCSCc1ccc(cc1)CC(=O)OC 62a_100000210202_100009816886 [0,1,1,0,0,1|1,0,0]=4 4978 B15R1.104 CCSCc1ccc(cc1)CC(=O)OC 62a_100009816886_100000210202 [0,1,1,0,0,1|1,0,0]=4 4979 B15R1.104 COC(=O)Cc1ccc(cc1)COCF 34a_100000087118_100015361967 [0,1,1,0,0,1|1,0,0]=4 4980 B15R1.104 COC(=O)Cc1ccc(cc1)CSCF 62a_100009816886_100015361967 [0,1,1,0,0,1|1,0,0]=4 4981 B15R1.104 COC(=O)Cc1ccc(cc1)CSCF 62a_100015361967_100009816886 [0,1,1,0,0,1|1,0,0]=4 4982 B15R1.104 COC(=O)Cc1ccc(cc1)OCCF 34a_100000211648_100011217306 [0,1,1,0,0,1|1,0,0]=4 4983 B15R1.104 COC(=O)Cc1ccc(cc1)OCCO 34a_100000211648_100000211926 [0,1,1,0,0,1|1,0,0]=4 4984 B15R1.104 COC(=O)Cc1ccc(cc1)SCCF 62a_100000149743_100011217306 [0,1,1,0,0,1|1,0,0]=4 4985 B15R1.104 COC(=O)Cc1ccc(cc1)SCCF 62a_100011217306_100000149743 [0,1,1,0,0,1|1,0,0]=4 4986 B15R1.104 COC(=O)Cc1ccc(cc1)SCCO 62a_100000149743_100000211926 [0,1,1,0,0,1|1,0,0]=4 4987 B15R1.104 COC(=O)Cc1ccc(cc1)SCCO 62a_100000211926_100000149743 [0,1,1,0,0,1|1,0,0]=4 4988 B15R1.104 COC(=O)Nc1ccc(cc1)OCCF 34a_100011235918_100011217306 [0,1,1,0,0,1|1,0,0]=4 4989 B15R1.104 COC(=O)Nc1ccc(cc1)OCCO 34a_100011235918_100000211926 [0,1,1,0,0,1|1,0,0]=4 4990 B15R1.104 COC(=O)Nc1ccc(cc1)SCCF 62a_100011217306_100000181880 [0,1,1,0,0,1|1,0,0]=4 4991 B15R1.104 COC(=O)Nc1ccc(cc1)SCCO 62a_100000211926_100000181880 [0,1,1,0,0,1|1,0,0]=4 4992 B15R1.5643 CCCc1ccc(cc1)CC(=O)COC 1458a_100000210968_100011982809 [0,1,1,0,0,1|1,0,0]=4 4993 B15R1.5643 CCCc1ccc(cc1)NC(=O)COC 11a_100000211780_100000210968 [0,1,1,0,0,1|1,0,0]=4 4994 B15R1.5643 CCCc1ccc(cc1)NC(=O)COC 1626a_100000211780_100000210968 [0,1,1,0,0,1|1,0,0]=4 4995 B15R1.5643 CCCc1ccc(cc1)NC(=O)COC 22a_100000211780_100000210968 [0,1,1,0,0,1|1,0,0]=4 4996 B15R1.5643 CCCc1ccc(cc1)NC(=O)COC 34a_100138415774_100000239566 [0,1,1,0,0,1|1,0,0]=4 4997 B15R1.5643 CCCc1ccc(cc1)NC(=O)COC 527a_100000211780_100000210968 [0,1,1,0,0,1|1,0,0]=4 4998 B15R1.5643 COCC(=O)Nc1ccc(cc1)CCO 22a_100011204434_100000210968 [0,1,1,0,0,1|1,0,0]=4 4999 B15R1.5643 COCC(=O)Nc1ccc(cc1)CCO 527a_100011204434_100000210968 [0,1,1,0,0,1|1,0,0]=4 5000 B15R1.567 CCNc1cccc(c1)CC(=O)N(C)C 2230a_100011690103_100000210202 [0,1,1,0,0,1|1,0,0]=4 5001 B15R1.567 CCNc1cccc(c1)CC(=O)N(C)C 34a_100011690103_100000210202 [0,1,1,0,0,1|1,0,0]=4 5002 B15R1.567 CCNc1cccc(c1)NC(=O)C(C)C 34a_100000186425_100000210202 [0,1,1,0,0,1|1,0,0]=4 5003 B15R1.571 CCSc1cccc(c1)C(=O)C(=O)OC 62a_100000210202_100000699548 [0,1,1,0,0,1|1,0,0]=4 5004 B15R1.571 CCSc1cccc(c1)C(=O)C(=O)OC 62a_100000699548_100000210202 [0,1,1,0,0,1|1,0,0]=4 5005 B15R1.571 CCSc1cccc(c1)C(C)C(=O)OC 62a_100000210202_100010077029 [0,1,1,0,0,1|1,0,0]=4 5006 B15R1.571 CCSc1cccc(c1)C(C)C(=O)OC 62a_100010077029_100000210202 [0,1,1,0,0,1|1,0,0]=4 5007 B15R1.571 CCSc1cccc(c1)C(N)C(=O)OC 62a_100000210202_100015207118 [0,1,1,0,0,1|1,0,0]=4 5008 B15R1.571 CCSc1cccc(c1)C(N)C(=O)OC 62a_100015207118_100000210202 [0,1,1,0,0,1|1,0,0]=4 5009 B15R1.575 CCSc1cccc(c1F)CC(=O)OC 62a_100000210202_100010741560 [0,1,1,0,0,1|1,0,0]=4 5010 B15R1.575 CCSc1cccc(c1F)CC(=O)OC 62a_100010741560_100000210202 [0,1,1,0,0,1|1,0,0]=4 5011 B15R1.575 CCSc1cccc(c1O)CC(=O)OC 62a_100010150830_100000210202 [0,1,1,0,0,1|1,0,0]=4 5012 B15R1.1038 CCC(=O)Nc1cccc(c1)NCCF 34a_100000186510_100011217306 [0,1,1,0,0,1|1,0,0]=4 5013 B15R1.1038 CCC(=O)Nc1cccc(c1)NCCO 34a_100000186510_100000211926 [0,1,1,0,0,1|1,0,0]=4 5014 B15R1.1038 CCC(=O)Nc1cccc(c1)NCSC 34a_100000186510_100011218213 [0,1,1,0,0,1|1,0,0]=4 5015 B15R1.1038 CCCCc1cccc(c1)CC(=O)OC 271570a_100020621405_100000699549 [0,1,1,0,0,1|1,0,0]=4 5016 B15R1.1038 CCCNc1cccc(c1)CC(=O)NC 2230a_100011690097_100000210303 [0,1,1,0,0,1|1,0,0]=4 5017 B15R1.1038 CCCNc1cccc(c1)CC(=O)NC 34a_100011690097_100000210303 [0,1,1,0,0,1|1,0,0]=4 5018 B15R1.1038 CCCNc1cccc(c1)NC(=O)CC 34a_100000186510_100000210303 [0,1,1,0,0,1|1,0,0]=4 5019 B15R1.1038 CCCOc1cccc(c1)NC(=O)OC 34a_100000741004_100000210303 [0,1,1,0,0,1|1,0,0]=4 5020 B15R1.1038 CCCOc1cccc(c1)NC(=O)OC 7a_100000741004_100000210303 [0,1,1,0,0,1|1,0,0]=4 5021 B15R1.1038 CCCSc1cccc(c1)CC(=O)OC 62a_100000210303_100000699549 [0,1,1,0,0,1|1,0,0]=4 5022 B15R1.1038 CCCSc1cccc(c1)CC(=O)OC 62a_100000699549_100000210303 [0,1,1,0,0,1|1,0,0]=4 5023 B15R1.1038 CCNCc1cccc(c1)NC(=O)CC 2230a_100000740940_100000210202 [0,1,1,0,0,1|1,0,0]=4 5024 B15R1.1038 CCNCc1cccc(c1)NC(=O)CC 34a_100000740940_100000210202 [0,1,1,0,0,1|1,0,0]=4 5025 B15R1.1038 CNC(=O)Cc1cccc(c1)NCCF 2230a_100011690097_100011217306 [0,1,1,0,0,1|1,0,0]=4 5026 B15R1.1038 CNC(=O)Cc1cccc(c1)NCCF 34a_100011690097_100011217306 [0,1,1,0,0,1|1,0,0]=4 5027 B15R1.1038 CNC(=O)Cc1cccc(c1)NCCO 2230a_100011690097_100000211926 [0,1,1,0,0,1|1,0,0]=4 5028 B15R1.1038 CNC(=O)Cc1cccc(c1)NCCO 34a_100011690097_100000211926 [0,1,1,0,0,1|1,0,0]=4 5029 B15R1.1038 CNC(=O)Cc1cccc(c1)NCOC 2230a_100011690097_100000766300 [0,1,1,0,0,1|1,0,0]=4 5030 B15R1.1038 CNC(=O)Cc1cccc(c1)NCSC 2230a_100011690097_100011218213 [0,1,1,0,0,1|1,0,0]=4 5031 B15R1.1038 CNC(=O)Cc1cccc(c1)NCSC 34a_100011690097_100011218213 [0,1,1,0,0,1|1,0,0]=4 5032 B15R1.1038 COC(=O)Cc1cccc(c1)SCCF 62a_100000699549_100011217306 [0,1,1,0,0,1|1,0,0]=4 5033 B15R1.1038 COC(=O)Cc1cccc(c1)SCCF 62a_100011217306_100000699549 [0,1,1,0,0,1|1,0,0]=4 5034 B15R1.1038 COC(=O)Cc1cccc(c1)SCCO 62a_100000211926_100000699549 [0,1,1,0,0,1|1,0,0]=4 5035 B15R1.1038 COC(=O)Cc1cccc(c1)SCCO 62a_100000699549_100000211926 [0,1,1,0,0,1|1,0,0]=4 5036 B15R1.1038 COC(=O)Cc1cccc(c1)SCSC 62a_100000699549_100011218213 [0,1,1,0,0,1|1,0,0]=4 5037 B15R1.1038 COC(=O)Cc1cccc(c1)SCSC 62a_100011218213_100000699549 [0,1,1,0,0,1|1,0,0]=4 5038 B15R1.1038 COC(=O)Nc1cccc(c1)OCCF 34a_100000741004_100011217306 [0,1,1,0,0,1|1,0,0]=4 5039 B15R1.1038 COC(=O)Nc1cccc(c1)OCCF 7a_100000741004_100011217306 [0,1,1,0,0,1|1,0,0]=4 5040 B15R1.1038 COC(=O)Nc1cccc(c1)OCCO 34a_100000741004_100000211926 [0,1,1,0,0,1|1,0,0]=4 5041 B15R1.1038 COC(=O)Nc1cccc(c1)OCCO 7a_100000741004_100000211926 [0,1,1,0,0,1|1,0,0]=4 5042 B15R1.1038 COC(=O)Nc1cccc(c1)OCSC 34a_100000741004_100011218213 [0,1,1,0,0,1|1,0,0]=4 5043 B15R1.1038 COCSc1cccc(c1)CC(=O)OC 62a_100000699549_100000766300 [0,1,1,0,0,1|1,0,0]=4 5044 B15R1.1038 COCSc1cccc(c1)CC(=O)OC 62a_100000766300_100000699549 [0,1,1,0,0,1|1,0,0]=4 5045 B15R1.3839 CCC(=O)Nc1cccc(c1)NC(C)C 34a_100000186510_100000210206 [0,1,1,0,0,1|1,0,0]=4 5046 B15R1.3839 CNC(=O)Cc1cccc(c1)NC(C)C 2230a_100011690097_100000210206 [0,1,1,0,0,1|1,0,0]=4 5047 B15R1.3839 CNC(=O)Cc1cccc(c1)NC(C)C 34a_100011690097_100000210206 [0,1,1,0,0,1|1,0,0]=4 5048 B15R1.3839 COC(=O)Cc1cccc(c1)NC(=O)C 188690a_100000758884_100015343762 [0,1,1,0,0,1|0,0,1]=4 5049 B15R1.3839 COC(=O)Cc1cccc(c1)SC(C)C 62a_100000210206_100000699549 [0,1,1,0,0,1|1,0,0]=4 5050 B15R1.3839 COC(=O)Cc1cccc(c1)SC(C)C 62a_100000699549_100000210206 [0,1,1,0,0,1|1,0,0]=4 5051 B15R1.3839 COC(=O)Nc1cccc(c1)OC(C)C 34a_100000741004_100000210206 [0,1,1,0,0,1|1,0,0]=4 5052 B15R1.3839 COC(=O)Nc1cccc(c1)OC(C)C 7a_100000741004_100000210206 [0,1,1,0,0,1|1,0,0]=4 5053 B15R1.3840 CCC(=O)c1cccc(c1)CC(=O)OC 1458a_100000708854_100000210202 [0,1,1,0,0,1|1,0,0]=4 5054 B15R1.3840 CCC(=O)c1cccc(c1)NC(=O)OC 1458a_100000751489_100000210202 [0,1,1,0,0,1|1,0,0]=4 5055 B15R1.9253 CCSc1cc(cc(c1)CC(=O)OC)F 62a_100000210202_100012569085 [0,1,1,0,0,1|1,0,0]=4 5056 B15R1.9253 CCSc1cc(cc(c1)CC(=O)OC)F 62a_100012569085_100000210202 [0,1,1,0,0,1|1,0,0]=4 5057 B15R1.9453 CCCC(=O)Nc1cccc(c1)NCC 34a_100000741889_100000210202 [0,1,1,0,0,1|1,0,0]=4 5058 B15R1.9453 CCCC(=O)Nc1cccc(c1)NCC 7a_100000741889_100000210202 [0,1,1,0,0,1|1,0,0]=4 5059 B15R1.9453 CCNc1cccc(c1)NC(=O)COC 34a_100159271271_100000210202 [0,1,1,0,0,1|0,0,0]=3 5060 B15R1.9453 CCOC(=O)Cc1cccc(c1)OCC 7a_100011472689_100000210202 [0,1,1,0,0,1|1,0,0]=4 5061 B15R1.9453 CCOC(=O)Cc1cccc(c1)SCC 62a_100000210202_100011586817 [0,1,1,0,0,1|1,0,0]=4 5062 B15R1.9453 CCOC(=O)Cc1cccc(c1)SCC 62a_100011586817_100000210202 [0,1,1,0,0,1|1,0,0]=4 5063 B15R1.9453 CCOC(=O)Nc1cccc(c1)OCC 34a_100000158603_100000210202 [0,1,1,0,0,1|1,0,0]=4 5064 B15R1.9453 CCOC(=O)Nc1cccc(c1)OCC 7a_100000158603_100000210202 [0,1,1,0,0,1|1,0,0]=4 5065 B15R1.9453 CCOc1cccc(c1)NC(=O)COC 11a_100000742568_100000210968 [0,1,1,0,0,1|1,0,0]=4 5066 B15R1.9453 CCOc1cccc(c1)NC(=O)COC 1626a_100000742568_100000210968 [0,1,1,0,0,1|1,0,0]=4 5067 B15R1.9453 CCOc1cccc(c1)NC(=O)COC 22a_100000742568_100000210968 [0,1,1,0,0,1|1,0,0]=4 5068 B15R1.9453 CCOc1cccc(c1)NC(=O)COC 527a_100000742568_100000210968 [0,1,1,0,0,1|1,0,0]=4 5069 B15R1.9453 CCSc1cccc(c1)NC(=O)COC 62a_100000210202_100000158352 [0,1,1,0,0,1|1,0,0]=4 5070 B15R1.9453 COCC(=O)Nc1cccc(c1)NCF 34a_100159271271_100015361967 [0,1,1,0,0,1|1,0,0]=4 5071 B15R1.9657 CCNc1ccc(c(c1)NC(=O)CC)C 34a_200011193571_100000210202 [0,1,1,0,0,1|1,0,0]=4 5072 B15R1.9657 CCNc1ccc(c(c1)NC(=O)CC)C 7a_200011193571_100000210202 [0,1,1,0,0,1|1,0,0]=4 5073 B15R1.9657 CCSc1ccc(c(c1)CC(=O)OC)O 62a_100000210202_100010185610 [0,1,1,0,0,1|1,0,0]=4 5074 B15R1.9657 CCSc1ccc(c(c1)CC(=O)OC)O 62a_100010185610_100000210202 [0,1,1,0,0,1|1,0,0]=4 5075 B15R1.1279 CCc1ccc(cc1Cl)NC(=O)COC 11a_100000766362_100000210968 [0,1,1,0,0,1|1,0,0]=4 5076 B15R1.1279 CCc1ccc(cc1Cl)NC(=O)COC 1626a_100000766362_100000210968 [0,1,1,0,0,1|1,0,0]=4 5077 B15R1.1279 CCc1ccc(cc1Cl)NC(=O)COC 22a_100000766362_100000210968 [0,1,1,0,0,1|1,0,0]=4 5078 B15R1.1279 CCc1ccc(cc1Cl)NC(=O)COC 527a_100000766362_100000210968 [0,1,1,0,0,1|1,0,0]=4 5079 B15R1.3848 C=C(C)c1ccc(cc1N)NC(=O)OC 271570a_100000694244_100012639261 [0,1,1,0,0,1|0,0,1]=4 5080 B15R1.12853 CNc1cc(ccc1OC)C(=O)N(C)C 2230a_100000742845_200000210301 [0,2,1,0,0,0|1,0,0]=4 5081 B15R1.12853 CNc1cc(ccc1OC)C(=O)N(C)C 34a_100000742845_200000210301 [0,2,1,0,0,0|1,0,0]=4 5082 B15R1.12853 CNc1cc(ccc1OC)C(=O)N(C)C 7a_100000742845_200000210301 [0,2,1,0,0,0|1,0,0]=4 5083 B15R1.12853 COc1ccc(cc1N[13CH3])C(=O)N(C)C 2230a_100000742845_200025704644 [0,2,1,0,0,0|1,0,0]=4 5084 B15R1.12853 COc1ccc(cc1N[13CH3])C(=O)N(C)C 34a_100000742845_200025704644 [0,2,1,0,0,0|1,0,0]=4 5085 B15R1.12853 COc1ccc(cc1N[13CH3])C(=O)N(C)C 7a_100000742845_200025704644 [0,2,1,0,0,0|1,0,0]=4 5086 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)Br 34a_200009811556_200000210301 [0,2,1,0,0,0|1,0,0]=4 5087 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)Br 7a_200009811556_200000210301 [0,2,1,0,0,0|1,0,0]=4 5088 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)F 34a_200010080224_200000210301 [0,2,1,0,0,0|1,0,0]=4 5089 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)F 7a_200010080224_200000210301 [0,2,1,0,0,0|1,0,0]=4 5090 B15R1.374 COC(=O)c1cc(c(c(c1)OC)OC)O 271570a_203496583355_100000727075 [0,2,1,0,0,0|1,0,0]=4 5091 B15R1.374 COC(=O)c1cc(c(c(c1)OC)O[13CH3])Br 34a_200009811556_200025704644 [0,2,1,0,0,0|1,0,0]=4 5092 B15R1.374 COC(=O)c1cc(c(c(c1)OC)O[13CH3])Br 7a_200009811556_200025704644 [0,2,1,0,0,0|1,0,0]=4 5093 B15R1.374 COC(=O)c1cc(c(c(c1)O[13CH3])OC)F 34a_200010080224_200025704644 [0,2,1,0,0,0|1,0,0]=4 5094 B15R1.374 COC(=O)c1cc(c(c(c1)O[13CH3])OC)F 7a_200010080224_200025704644 [0,2,1,0,0,0|1,0,0]=4 5095 B15R1.3628 CC=Cc1cc(cc(c1C)Cl)C(=O)OC 271570a_100016259895_100012360618 [0,2,1,0,0,0|1,0,0]=4 5096 B15R1.3628 CC=Cc1cc(cc(c1C)F)C(=O)OC 271570a_100016259895_100012920391 [0,2,1,0,0,0|1,0,0]=4 5097 B15R1.3628 CC=Cc1cc(cc(c1C)N)C(=O)OC 271570a_100016259895_100012353609 [0,2,1,0,0,0|1,0,0]=4 5098 B15R1.3628 CCOc1cc(cc(c1C)F)C(=O)OC 34a_100000101006_100000210202 [0,2,1,0,0,0|1,0,0]=4 5099 B15R1.3628 CCOc1cc(cc(c1C)F)C(=O)OC 7a_100000101006_100000210202 [0,2,1,0,0,0|1,0,0]=4 5100 B15R1.3628 CCSc1cc(cc(c1C)Cl)C(=O)OC 62a_100000210202_100012360618 [0,2,1,0,0,0|1,0,0]=4 5101 B15R1.3628 CCSc1cc(cc(c1C)Cl)C(=O)OC 62a_100012360618_100000210202 [0,2,1,0,0,0|1,0,0]=4 5102 B15R1.3628 CCSc1cc(cc(c1C)F)C(=O)OC 62a_100000210202_100012920391 [0,2,1,0,0,0|1,0,0]=4 5103 B15R1.3628 CCSc1cc(cc(c1C)F)C(=O)OC 62a_100012920391_100000210202 [0,2,1,0,0,0|1,0,0]=4 5104 B15R1.3628 CCSc1cc(cc(c1C)N)C(=O)OC 62a_100000210202_100012353609 [0,2,1,0,0,0|1,0,0]=4 5105 B15R1.3628 CCSc1cc(cc(c1C)N)C(=O)OC 62a_100012353609_100000210202 [0,2,1,0,0,0|1,0,0]=4 5106 B15R1.3628 CNCc1cc(cc(c1Cl)Br)C(=O)OC 26a_100102657272_200020639753 [0,2,1,0,0,0|1,0,0]=4 5107 B15R1.3628 COC(=O)c1cc(c(c(c1)OCF)C)F 34a_100000101006_100015361967 [0,2,1,0,0,0|1,0,0]=4 5108 B15R1.3628 COC(=O)c1cc(c(c(c1)OCF)C)F 7a_100000101006_100015361967 [0,2,1,0,0,0|1,0,0]=4 5109 B15R1.3628 COC(=O)c1cc(c(c(c1)SCF)C)Cl 62a_100012360618_100015361967 [0,2,1,0,0,0|1,0,0]=4 5110 B15R1.3628 COC(=O)c1cc(c(c(c1)SCF)C)Cl 62a_100015361967_100012360618 [0,2,1,0,0,0|1,0,0]=4 5111 B15R1.3628 COC(=O)c1cc(c(c(c1)SCF)C)F 62a_100012920391_100015361967 [0,2,1,0,0,0|1,0,0]=4 5112 B15R1.3628 COC(=O)c1cc(c(c(c1)SCF)C)F 62a_100015361967_100012920391 [0,2,1,0,0,0|1,0,0]=4 5113 B15R1.3628 COC(=O)c1cc(c(c(c1)SCF)C)N 62a_100012353609_100015361967 [0,2,1,0,0,0|1,0,0]=4 5114 B15R1.3628 COC(=O)c1cc(c(c(c1)SCF)C)N 62a_100015361967_100012353609 [0,2,1,0,0,0|1,0,0]=4 5115 B15R1.13367 C=C(C)c1cc(cc(c1C)Cl)C(=O)OC 271570a_100000694244_100012360618 [0,2,1,0,0,0|1,0,0]=4 5116 B15R1.13367 C=C(C)c1cc(cc(c1C)F)C(=O)OC 271570a_100000694244_100012920391 [0,2,1,0,0,0|1,0,0]=4 5117 B15R1.13367 C=C(C)c1cc(cc(c1C)N)C(=O)OC 271570a_100000694244_100012353609 [0,2,1,0,0,0|1,0,0]=4 5118 B15R1.991 CCC(=O)c1ccc(c(c1)NC(=O)C)C 1458a_100000194935_100000210202 [0,2,1,0,0,0|1,0,0]=4 5119 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 11a_100000737617_100015343762 [0,2,1,0,0,0|1,0,0]=4 5120 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 11a_106832991635_100000194935 [0,2,1,0,0,0|1,0,0]=4 5121 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 1626a_100000737617_100015343762 [0,2,1,0,0,0|1,0,0]=4 5122 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 1626a_100102657272_100000194935 [0,2,1,0,0,0|1,0,0]=4 5123 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 22a_100000737617_100000070787 [0,2,1,0,0,0|1,0,0]=4 5124 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 240690a_100102657272_100000194935 [0,2,1,0,0,0|1,0,0]=4 5125 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 527a_100000737617_100103153847 [0,2,1,0,0,0|1,0,0]=4 5126 B15R1.991 CNC(=O)c1ccc(c(c1)NC(=O)C)C 527a_100102657272_100000194935 [0,2,1,0,0,0|1,0,0]=4 5127 B15R1.991 CNC(=O)c1ccc(c(c1)NC(C)C)C 2230a_100000737617_100000210206 [0,2,1,0,0,0|1,0,0]=4 5128 B15R1.991 CNC(=O)c1ccc(c(c1)NC(C)C)C 34a_100000737617_100000210206 [0,2,1,0,0,0|1,0,0]=4 5129 B15R1.991 CNC(=O)c1ccc(c(c1)NC(C)C)C 7a_100000737617_100000210206 [0,2,1,0,0,0|1,0,0]=4 5130 B15R1.991 COC(=O)c1ccc(c(c1)C=C(C)C)C 271570a_100102525489_100011218856 [0,2,1,0,0,0|1,0,0]=4 5131 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)Br 2230a_100102631434_100012232407 [0,2,1,0,0,0|1,0,0]=4 5132 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)Br 269982a_100102631434_100012232407 [0,2,1,0,0,0|1,0,0]=4 5133 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)Br 270004a_100102631434_100012274322 [0,2,1,0,0,0|1,0,0]=4 5134 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)C 270004a_100102631434_100010624047 [0,2,1,0,0,0|0,0,0]=3 5135 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)Cl 2230a_100102631434_100000698984 [0,2,1,0,0,0|1,0,0]=4 5136 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)Cl 269982a_100102631434_100000698984 [0,2,1,0,0,0|1,0,0]=4 5137 B15R1.991 COC(=O)c1ccc(c(c1)CN(C)C)Cl 270004a_100102631434_100000725138 [0,2,1,0,0,0|1,0,0]=4 5138 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)Br 188690a_100011450966_100015343762 [0,2,1,0,0,0|1,0,0]=4 5139 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)C 188690a_100000742527_100015343762 [0,2,1,0,0,0|0,0,0]=3 5140 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)F 188690a_100000735820_100015343762 [0,2,1,0,0,0|1,0,0]=4 5141 B15R1.991 COC(=O)c1ccc(c(c1)NC(=O)C)O 188690a_100000724433_100015343762 [0,2,1,0,0,0|1,0,0]=4 5142 B15R1.991 COC(=O)c1ccc(c(c1)OC(C)C)C 34a_100000736511_100000210206 [0,2,1,0,0,0|1,0,0]=4 5143 B15R1.991 COC(=O)c1ccc(c(c1)OC(C)C)C 7a_100000736511_100000210206 [0,2,1,0,0,0|1,0,0]=4 5144 B15R1.991 COC(=O)c1ccc(c(c1)SC(C)C)C 62a_100000210206_100000723194 [0,2,1,0,0,0|1,0,0]=4 5145 B15R1.991 COC(=O)c1ccc(c(c1)SC(C)C)C 62a_100000723194_100000210206 [0,2,1,0,0,0|1,0,0]=4 5146 B15R1.1003 C#CCNc1cc(ccc1C)C(=O)NC 2230a_100000737617_100000038162 [0,2,1,0,0,0|1,0,0]=4 5147 B15R1.1003 C#CCNc1cc(ccc1C)C(=O)NC 34a_100000737617_100000184674 [0,2,1,0,0,0|1,0,0]=4 5148 B15R1.1003 C#CCNc1cc(ccc1C)C(=O)NC 7a_100000737617_100000038162 [0,2,1,0,0,0|1,0,0]=4 5149 B15R1.1003 C#CCOc1cc(ccc1C)C(=O)OC 34a_100000736511_100000184674 [0,2,1,0,0,0|1,0,0]=4 5150 B15R1.1003 C#CCOc1cc(ccc1C)C(=O)OC 7a_100000736511_100000038162 [0,2,1,0,0,0|1,0,0]=4 5151 B15R1.1003 C#CCSc1cc(ccc1C)C(=O)OC 62a_100000038162_100000723194 [0,2,1,0,0,0|1,0,0]=4 5152 B15R1.1003 C=CCNc1cc(ccc1C)C(=O)NC 2230a_100000737617_100000210623 [0,2,1,0,0,0|1,0,0]=4 5153 B15R1.1003 C=CCNc1cc(ccc1C)C(=O)NC 34a_100000737617_100015514636 [0,2,1,0,0,0|1,0,0]=4 5154 B15R1.1003 C=CCNc1cc(ccc1C)C(=O)NC 7a_100000737617_100015514636 [0,2,1,0,0,0|1,0,0]=4 5155 B15R1.1003 C=CCOc1cc(ccc1C)C(=O)OC 34a_100000736511_100015514636 [0,2,1,0,0,0|1,0,0]=4 5156 B15R1.1003 C=CCOc1cc(ccc1C)C(=O)OC 7a_100000736511_100015514636 [0,2,1,0,0,0|1,0,0]=4 5157 B15R1.1003 C=CCSc1cc(ccc1C)C(=O)OC 62a_100000210623_100000723194 [0,2,1,0,0,0|1,0,0]=4 5158 B15R1.1003 C=CCSc1cc(ccc1C)C(=O)OC 62a_100000723194_100000210623 [0,2,1,0,0,0|1,0,0]=4 5159 B15R1.1003 CCCCc1cc(ccc1C)C(=O)OC 271570a_100020621405_100011218856 [0,2,1,0,0,0|1,0,0]=4 5160 B15R1.1003 CCCNc1cc(ccc1C)C(=O)NC 2230a_100000737617_100000210303 [0,2,1,0,0,0|1,0,0]=4 5161 B15R1.1003 CCCNc1cc(ccc1C)C(=O)NC 34a_100000737617_100000210303 [0,2,1,0,0,0|1,0,0]=4 5162 B15R1.1003 CCCNc1cc(ccc1C)C(=O)NC 7a_100000737617_100000210303 [0,2,1,0,0,0|1,0,0]=4 5163 B15R1.1003 CCCOc1cc(ccc1C)C(=O)OC 34a_100000736511_100000210303 [0,2,1,0,0,0|1,0,0]=4 5164 B15R1.1003 CCCOc1cc(ccc1C)C(=O)OC 7a_100000736511_100000210303 [0,2,1,0,0,0|1,0,0]=4 5165 B15R1.1003 CCCSc1cc(ccc1C)C(=O)OC 62a_100000210303_100000723194 [0,2,1,0,0,0|1,0,0]=4 5166 B15R1.1003 CCCSc1cc(ccc1C)C(=O)OC 62a_100000723194_100000210303 [0,2,1,0,0,0|1,0,0]=4 5167 B15R1.1003 CCNCc1cc(ccc1Br)C(=O)OC 2230a_100015525214_100012232407 [0,2,1,0,0,0|1,0,0]=4 5168 B15R1.1003 CCNCc1cc(ccc1Br)C(=O)OC 270004a_100015525214_100012274322 [0,2,1,0,0,0|1,0,0]=4 5169 B15R1.1003 CCNCc1cc(ccc1C)C(=O)OC 270004a_100015525214_100010624047 [0,2,1,0,0,0|0,0,0]=3 5170 B15R1.1003 CCNCc1cc(ccc1Cl)C(=O)OC 2230a_100015525214_100000698984 [0,2,1,0,0,0|1,0,0]=4 5171 B15R1.1003 CCNCc1cc(ccc1Cl)C(=O)OC 270004a_100015525214_100000725138 [0,2,1,0,0,0|1,0,0]=4 5172 B15R1.1003 CNC(=O)c1ccc(c(c1)NCC#N)C 2230a_100000737617_100011215382 [0,2,1,0,0,0|1,0,0]=4 5173 B15R1.1003 CNC(=O)c1ccc(c(c1)NCC#N)C 7a_100000737617_100011215382 [0,2,1,0,0,0|1,0,0]=4 5174 B15R1.1003 CNC(=O)c1ccc(c(c1)NCC=O)C 2230a_100000737617_200015260668 [0,2,1,0,0,0|1,0,0]=4 5175 B15R1.1003 CNC(=O)c1ccc(c(c1)NCC=O)C 34a_100000737617_200009817547 [0,2,1,0,0,0|1,0,0]=4 5176 B15R1.1003 CNC(=O)c1ccc(c(c1)NCC=O)C 7a_100000737617_200015260668 [0,2,1,0,0,0|1,0,0]=4 5177 B15R1.1003 CNC(=O)c1ccc(c(c1)NCCF)C 2230a_100000737617_100011217306 [0,2,1,0,0,0|1,0,0]=4 5178 B15R1.1003 CNC(=O)c1ccc(c(c1)NCCF)C 34a_100000737617_100011217306 [0,2,1,0,0,0|1,0,0]=4 5179 B15R1.1003 CNC(=O)c1ccc(c(c1)NCCF)C 7a_100000737617_100011217306 [0,2,1,0,0,0|1,0,0]=4 5180 B15R1.1003 CNC(=O)c1ccc(c(c1)NCCO)C 2230a_100000737617_100000211926 [0,2,1,0,0,0|1,0,0]=4 5181 B15R1.1003 CNC(=O)c1ccc(c(c1)NCCO)C 34a_100000737617_100000211926 [0,2,1,0,0,0|1,0,0]=4 5182 B15R1.1003 CNC(=O)c1ccc(c(c1)NCCO)C 7a_100000737617_100000211926 [0,2,1,0,0,0|1,0,0]=4 5183 B15R1.1003 CNC(=O)c1ccc(c(c1)NCOC)C 2230a_100000737617_100000766300 [0,2,1,0,0,0|1,0,0]=4 5184 B15R1.1003 CNC(=O)c1ccc(c(c1)NCSC)C 2230a_100000737617_100011218213 [0,2,1,0,0,0|1,0,0]=4 5185 B15R1.1003 CNC(=O)c1ccc(c(c1)NCSC)C 34a_100000737617_100011218213 [0,2,1,0,0,0|1,0,0]=4 5186 B15R1.1003 COC(=O)c1ccc(c(c1)OCC#N)C 7a_100000736511_100011215382 [0,2,1,0,0,0|1,0,0]=4 5187 B15R1.1003 COC(=O)c1ccc(c(c1)OCC=O)C 34a_100000736511_200009817547 [0,2,1,0,0,0|1,0,0]=4 5188 B15R1.1003 COC(=O)c1ccc(c(c1)OCC=O)C 7a_100000736511_200015260668 [0,2,1,0,0,0|1,0,0]=4 5189 B15R1.1003 COC(=O)c1ccc(c(c1)OCCF)C 34a_100000736511_100011217306 [0,2,1,0,0,0|1,0,0]=4 5190 B15R1.1003 COC(=O)c1ccc(c(c1)OCCF)C 7a_100000736511_100011217306 [0,2,1,0,0,0|1,0,0]=4 5191 B15R1.1003 COC(=O)c1ccc(c(c1)OCCO)C 34a_100000736511_100000211926 [0,2,1,0,0,0|1,0,0]=4 5192 B15R1.1003 COC(=O)c1ccc(c(c1)OCCO)C 7a_100000736511_100000211926 [0,2,1,0,0,0|1,0,0]=4 5193 B15R1.1003 COC(=O)c1ccc(c(c1)OCSC)C 34a_100000736511_100011218213 [0,2,1,0,0,0|1,0,0]=4 5194 B15R1.1003 COC(=O)c1ccc(c(c1)SCC#N)C 62a_100000723194_100011215382 [0,2,1,0,0,0|1,0,0]=4 5195 B15R1.1003 COC(=O)c1ccc(c(c1)SCC#N)C 62a_100011215382_100000723194 [0,2,1,0,0,0|1,0,0]=4 5196 B15R1.1003 COC(=O)c1ccc(c(c1)SCC=O)C 62a_100000723194_200015260668 [0,2,1,0,0,0|1,0,0]=4 5197 B15R1.1003 COC(=O)c1ccc(c(c1)SCC=O)C 62a_200015260668_100000723194 [0,2,1,0,0,0|1,0,0]=4 5198 B15R1.1003 COC(=O)c1ccc(c(c1)SCCF)C 62a_100000723194_100011217306 [0,2,1,0,0,0|1,0,0]=4 5199 B15R1.1003 COC(=O)c1ccc(c(c1)SCCF)C 62a_100011217306_100000723194 [0,2,1,0,0,0|1,0,0]=4 5200 B15R1.1003 COC(=O)c1ccc(c(c1)SCCO)C 62a_100000211926_100000723194 [0,2,1,0,0,0|1,0,0]=4 5201 B15R1.1003 COC(=O)c1ccc(c(c1)SCCO)C 62a_100000723194_100000211926 [0,2,1,0,0,0|1,0,0]=4 5202 B15R1.1003 COC(=O)c1ccc(c(c1)SCSC)C 62a_100000723194_100011218213 [0,2,1,0,0,0|1,0,0]=4 5203 B15R1.1003 COC(=O)c1ccc(c(c1)SCSC)C 62a_100011218213_100000723194 [0,2,1,0,0,0|1,0,0]=4 5204 B15R1.1003 COCSc1cc(ccc1C)C(=O)OC 62a_100000723194_100000766300 [0,2,1,0,0,0|1,0,0]=4 5205 B15R1.1003 COCSc1cc(ccc1C)C(=O)OC 62a_100000766300_100000723194 [0,2,1,0,0,0|1,0,0]=4 5206 B15R1.7680 CC=Cc1cc(ccc1CC)C(=O)OC 271570a_100016259895_200012360130 [0,2,1,0,0,0|1,0,0]=4 5207 B15R1.7680 CC=Cc1cc(ccc1CO)C(=O)OC 271570a_100016259895_100012355398 [0,2,1,0,0,0|1,0,0]=4 5208 B15R1.7680 CC=Cc1cc(ccc1OC)C(=O)OC 271570a_100016259895_100000189012 [0,2,1,0,0,0|1,0,0]=4 5209 B15R1.7680 CCNc1cc(ccc1OC)C(=O)NC 2230a_100000740754_100000210202 [0,2,1,0,0,0|1,0,0]=4 5210 B15R1.7680 CCNc1cc(ccc1OC)C(=O)NC 34a_100000740754_100000210202 [0,2,1,0,0,0|1,0,0]=4 5211 B15R1.7680 CCOc1cc(ccc1OC)C(=O)OC 34a_100011215032_100000210202 [0,2,1,0,0,0|1,0,0]=4 5212 B15R1.7680 CCOc1cc(ccc1OC)C(=O)OC 7a_100011215032_100000210202 [0,2,1,0,0,0|1,0,0]=4 5213 B15R1.7680 CCSc1cc(ccc1CC)C(=O)OC 62a_100000210202_200012360130 [0,2,1,0,0,0|1,0,0]=4 5214 B15R1.7680 CCSc1cc(ccc1CC)C(=O)OC 62a_200012360130_100000210202 [0,2,1,0,0,0|1,0,0]=4 5215 B15R1.7680 CCSc1cc(ccc1CO)C(=O)OC 62a_100000210202_100012355398 [0,2,1,0,0,0|1,0,0]=4 5216 B15R1.7680 CCSc1cc(ccc1CO)C(=O)OC 62a_100012355398_100000210202 [0,2,1,0,0,0|1,0,0]=4 5217 B15R1.7680 CCSc1cc(ccc1OC)C(=O)OC 62a_100000189012_100000210202 [0,2,1,0,0,0|1,0,0]=4 5218 B15R1.7680 CCSc1cc(ccc1OC)C(=O)OC 62a_100000210202_100000189012 [0,2,1,0,0,0|1,0,0]=4 5219 B15R1.7680 CCc1ccc(cc1SCF)C(=O)OC 62a_100015361967_200012360130 [0,2,1,0,0,0|1,0,0]=4 5220 B15R1.7680 CCc1ccc(cc1SCF)C(=O)OC 62a_200012360130_100015361967 [0,2,1,0,0,0|1,0,0]=4 5221 B15R1.7680 CNC(=O)c1ccc(c(c1)NCF)OC 34a_100000740754_100015361967 [0,2,1,0,0,0|1,0,0]=4 5222 B15R1.7680 CNCc1cc(ccc1C#N)C(=O)OC 2230a_106832991635_200010210189 [0,2,1,0,0,0|0,0,1]=4 5223 B15R1.7680 CNCc1cc(ccc1C#N)C(=O)OC 7a_106832991635_200010210189 [0,2,1,0,0,0|0,0,1]=4 5224 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 2230a_106832991635_200010762020 [0,2,1,0,0,0|0,0,0]=3 5225 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 26a_100102657272_100011215032 [0,2,1,0,0,0|0,0,0]=3 5226 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 270004a_106832991635_100000059354 [0,2,1,0,0,0|0,0,0]=3 5227 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 34a_100102657272_200010762020 [0,2,1,0,0,0|0,0,0]=3 5228 B15R1.7680 CNCc1cc(ccc1OC)C(=O)OC 7a_106832991635_200010762020 [0,2,1,0,0,0|0,0,0]=3 5229 B15R1.7680 COC(=O)c1ccc(c(c1)CSC)OC 62a_200000210301_200010762020 [0,2,1,0,0,0|1,0,0]=4 5230 B15R1.7680 COC(=O)c1ccc(c(c1)CSC)OC 62a_200010762020_200000210301 [0,2,1,0,0,0|1,0,0]=4 5231 B15R1.7680 COC(=O)c1ccc(c(c1)CS[13CH3])OC 62a_200010762020_200025704644 [0,2,1,0,0,0|1,0,0]=4 5232 B15R1.7680 COC(=O)c1ccc(c(c1)CS[13CH3])OC 62a_200025704644_200010762020 [0,2,1,0,0,0|1,0,0]=4 5233 B15R1.7680 COC(=O)c1ccc(c(c1)OCF)OC 34a_100011215032_100015361967 [0,2,1,0,0,0|1,0,0]=4 5234 B15R1.7680 COC(=O)c1ccc(c(c1)OCF)OC 7a_100011215032_100015361967 [0,2,1,0,0,0|1,0,0]=4 5235 B15R1.7680 COC(=O)c1ccc(c(c1)SCF)CO 62a_100012355398_100015361967 [0,2,1,0,0,0|1,0,0]=4 5236 B15R1.7680 COC(=O)c1ccc(c(c1)SCF)CO 62a_100015361967_100012355398 [0,2,1,0,0,0|1,0,0]=4 5237 B15R1.7680 COC(=O)c1ccc(c(c1)SCF)OC 62a_100000189012_100015361967 [0,2,1,0,0,0|1,0,0]=4 5238 B15R1.7680 COC(=O)c1ccc(c(c1)SCF)OC 62a_100015361967_100000189012 [0,2,1,0,0,0|1,0,0]=4 5239 B15R1.7680 COCc1cc(ccc1OC)C(=O)OC 34a_100138415774_200010762020 [0,2,1,0,0,0|1,0,0]=4 5240 B15R1.7680 COCc1cc(ccc1SC)C(=O)OC 62a_200000210301_200010890493 [0,2,1,0,0,0|1,0,0]=4 5241 B15R1.7680 COCc1cc(ccc1SC)C(=O)OC 62a_200010890493_200000210301 [0,2,1,0,0,0|1,0,0]=4 5242 B15R1.7680 COCc1cc(ccc1S[13CH3])C(=O)OC 62a_200010890493_200025704644 [0,2,1,0,0,0|1,0,0]=4 5243 B15R1.7680 COCc1cc(ccc1S[13CH3])C(=O)OC 62a_200025704644_200010890493 [0,2,1,0,0,0|1,0,0]=4 5244 B15R1.9230 CC=Cc1cc(ccc1C)C(=O)OCC 271570a_100016259895_100012359631 [0,2,1,0,0,0|1,0,0]=4 5245 B15R1.9230 CCNC(=O)c1ccc(c(c1)NCC)C 34a_100000740560_100000210202 [0,2,1,0,0,0|1,0,0]=4 5246 B15R1.9230 CCNC(=O)c1ccc(c(c1)NCC)C 7a_100000740560_100000210202 [0,2,1,0,0,0|1,0,0]=4 5247 B15R1.9230 CCNC(=O)c1ccc(c(c1)NCF)C 34a_100000740560_100015361967 [0,2,1,0,0,0|1,0,0]=4 5248 B15R1.9230 CCNC(=O)c1ccc(c(c1)NCF)C 7a_100000740560_100015361967 [0,2,1,0,0,0|1,0,0]=4 5249 B15R1.9230 CCNc1nc(ccc1C)C(=O)OCC 27a_100015525214_200009853511 [0,2,1,0,0,0|1,0,0]=4 5250 B15R1.9230 CCOC(=O)c1ccc(c(c1)CNC)Br 2230a_106832991635_200010218069 [0,2,1,0,0,0|1,0,0]=4 5251 B15R1.9230 CCOC(=O)c1ccc(c(c1)CNC)Br 26a_100102657272_100012355281 [0,2,1,0,0,0|1,0,0]=4 5252 B15R1.9230 CCOC(=O)c1ccc(c(c1)CNC)Br 34a_100102657272_200010218069 [0,2,1,0,0,0|1,0,0]=4 5253 B15R1.9230 CCOC(=O)c1ccc(c(c1)CNC)Br 7a_106832991635_200010218069 [0,2,1,0,0,0|1,0,0]=4 5254 B15R1.9230 CCOC(=O)c1ccc(c(c1)SCC)C 62a_100000210202_100012359631 [0,2,1,0,0,0|1,0,0]=4 5255 B15R1.9230 CCOC(=O)c1ccc(c(c1)SCC)C 62a_100012359631_100000210202 [0,2,1,0,0,0|1,0,0]=4 5256 B15R1.9230 CCOC(=O)c1ccc(c(c1)SCF)C 62a_100012359631_100015361967 [0,2,1,0,0,0|1,0,0]=4 5257 B15R1.9230 CCOC(=O)c1ccc(c(c1)SCF)C 62a_100015361967_100012359631 [0,2,1,0,0,0|1,0,0]=4 5258 B15R1.11778 CNC(=O)c1cc(ccc1Br)C(=O)OC 11a_106832991635_100010710364 [0,2,1,0,0,0|1,0,0]=4 5259 B15R1.11778 CNC(=O)c1cc(ccc1Br)C(=O)OC 1626a_100102657272_100010710364 [0,2,1,0,0,0|1,0,0]=4 5260 B15R1.11778 CNC(=O)c1cc(ccc1Br)C(=O)OC 240690a_100102657272_100010710364 [0,2,1,0,0,0|1,0,0]=4 5261 B15R1.11778 CNC(=O)c1cc(ccc1Br)C(=O)OC 527a_100102657272_100010710364 [0,2,1,0,0,0|1,0,0]=4 5262 B15R1.11778 CNC(=O)c1cc(ccc1Cl)C(=O)OC 11a_106832991635_200000732520 [0,2,1,0,0,0|1,0,0]=4 5263 B15R1.11778 CNC(=O)c1cc(ccc1Cl)C(=O)OC 1626a_100102657272_200000732520 [0,2,1,0,0,0|1,0,0]=4 5264 B15R1.11778 CNC(=O)c1cc(ccc1Cl)C(=O)OC 240690a_100102657272_200000732520 [0,2,1,0,0,0|1,0,0]=4 5265 B15R1.11778 CNC(=O)c1cc(ccc1Cl)C(=O)OC 527a_100102657272_200000732520 [0,2,1,0,0,0|1,0,0]=4 5266 B15R1.27278 CC=Cc1c(ccc(c1C)C(=O)OC)C 271570a_100016259895_200010734123 [0,2,1,0,0,0|1,0,0]=4 5267 B15R1.27278 CCSc1c(ccc(c1C)C(=O)OC)C 62a_100000210202_200010734123 [0,2,1,0,0,0|1,0,0]=4 5268 B15R1.27278 CCSc1c(ccc(c1C)C(=O)OC)C 62a_200010734123_100000210202 [0,2,1,0,0,0|1,0,0]=4 5269 B15R1.27278 CNCc1c(ccc(c1F)C(=O)OC)Br 26a_100102657272_100011096176 [0,2,1,0,0,0|1,0,0]=4 5270 B15R1.27278 COC(=O)c1ccc(c(c1C)SCF)C 62a_100015361967_200010734123 [0,2,1,0,0,0|1,0,0]=4 5271 B15R1.27278 COC(=O)c1ccc(c(c1C)SCF)C 62a_200010734123_100015361967 [0,2,1,0,0,0|1,0,0]=4 5272 B15R1.27362 CC=Cc1cc(c(cc1C)C)C(=O)OC 271570a_100016259895_200012360129 [0,2,1,0,0,0|1,0,0]=4 5273 B15R1.27362 CC=Cc1cc(c(cc1C)Cl)C(=O)OC 271570a_100016259895_100014124666 [0,2,1,0,0,0|1,0,0]=4 5274 B15R1.27362 CC=Cc1cc(c(cc1C)F)C(=O)OC 271570a_100016259895_100012920548 [0,2,1,0,0,0|1,0,0]=4 5275 B15R1.27362 CC=Cc1cc(c(cc1C)N)C(=O)OC 271570a_100016259895_100010892302 [0,2,1,0,0,0|1,0,0]=4 5276 B15R1.27362 CC=Cc1cc(c(cc1C)O)C(=O)OC 271570a_100016259895_100010233952 [0,2,1,0,0,0|1,0,0]=4 5277 B15R1.27362 CCOc1cc(c(cc1C)F)C(=O)OC 34a_100009839768_100000210202 [0,2,1,0,0,0|1,0,0]=4 5278 B15R1.27362 CCOc1cc(c(cc1C)F)C(=O)OC 7a_100009839768_100000210202 [0,2,1,0,0,0|1,0,0]=4 5279 B15R1.27362 CCSc1cc(c(cc1C)C)C(=O)OC 62a_100000210202_200012360129 [0,2,1,0,0,0|1,0,0]=4 5280 B15R1.27362 CCSc1cc(c(cc1C)C)C(=O)OC 62a_200012360129_100000210202 [0,2,1,0,0,0|1,0,0]=4 5281 B15R1.27362 CCSc1cc(c(cc1C)Cl)C(=O)OC 62a_100000210202_100014124666 [0,2,1,0,0,0|1,0,0]=4 5282 B15R1.27362 CCSc1cc(c(cc1C)Cl)C(=O)OC 62a_100014124666_100000210202 [0,2,1,0,0,0|1,0,0]=4 5283 B15R1.27362 CCSc1cc(c(cc1C)F)C(=O)OC 62a_100000210202_100012920548 [0,2,1,0,0,0|1,0,0]=4 5284 B15R1.27362 CCSc1cc(c(cc1C)F)C(=O)OC 62a_100012920548_100000210202 [0,2,1,0,0,0|1,0,0]=4 5285 B15R1.27362 CCSc1cc(c(cc1C)N)C(=O)OC 62a_100000210202_100010892302 [0,2,1,0,0,0|1,0,0]=4 5286 B15R1.27362 CCSc1cc(c(cc1C)N)C(=O)OC 62a_100010892302_100000210202 [0,2,1,0,0,0|1,0,0]=4 5287 B15R1.27362 CCSc1cc(c(cc1C)O)C(=O)OC 62a_100000210202_100010233952 [0,2,1,0,0,0|1,0,0]=4 5288 B15R1.27362 CCSc1cc(c(cc1C)O)C(=O)OC 62a_100010233952_100000210202 [0,2,1,0,0,0|1,0,0]=4 5289 B15R1.27362 COC(=O)c1cc(c(cc1C)C)SCF 62a_100015361967_200012360129 [0,2,1,0,0,0|1,0,0]=4 5290 B15R1.27362 COC(=O)c1cc(c(cc1C)C)SCF 62a_200012360129_100015361967 [0,2,1,0,0,0|1,0,0]=4 5291 B15R1.27362 COC(=O)c1cc(c(cc1Cl)C)SCF 62a_100014124666_100015361967 [0,2,1,0,0,0|1,0,0]=4 5292 B15R1.27362 COC(=O)c1cc(c(cc1Cl)C)SCF 62a_100015361967_100014124666 [0,2,1,0,0,0|1,0,0]=4 5293 B15R1.27362 COC(=O)c1cc(c(cc1F)C)OCF 34a_100009839768_100015361967 [0,2,1,0,0,0|1,0,0]=4 5294 B15R1.27362 COC(=O)c1cc(c(cc1F)C)OCF 7a_100009839768_100015361967 [0,2,1,0,0,0|1,0,0]=4 5295 B15R1.27362 COC(=O)c1cc(c(cc1F)C)SCF 62a_100012920548_100015361967 [0,2,1,0,0,0|1,0,0]=4 5296 B15R1.27362 COC(=O)c1cc(c(cc1F)C)SCF 62a_100015361967_100012920548 [0,2,1,0,0,0|1,0,0]=4 5297 B15R1.27362 COC(=O)c1cc(c(cc1N)C)SCF 62a_100010892302_100015361967 [0,2,1,0,0,0|1,0,0]=4 5298 B15R1.27362 COC(=O)c1cc(c(cc1N)C)SCF 62a_100015361967_100010892302 [0,2,1,0,0,0|1,0,0]=4 5299 B15R1.27362 COC(=O)c1cc(c(cc1O)C)SCF 62a_100010233952_100015361967 [0,2,1,0,0,0|1,0,0]=4 5300 B15R1.27362 COC(=O)c1cc(c(cc1O)C)SCF 62a_100015361967_100010233952 [0,2,1,0,0,0|1,0,0]=4 5301 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)OC 7a_100000038551_200000210301 [0,2,1,0,0,0|1,0,0]=4 5302 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000038551_200025704644 [0,2,1,0,0,0|1,0,0]=4 5303 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)SC 62a_100010189661_200000210301 [0,2,1,0,0,0|1,0,0]=4 5304 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)SC 62a_200000210301_100010189661 [0,2,1,0,0,0|1,0,0]=4 5305 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_100010189661_200025704644 [0,2,1,0,0,0|1,0,0]=4 5306 B15R1.815 CCOC(=O)c1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100010189661 [0,2,1,0,0,0|1,0,0]=4 5307 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)CC 62a_200000210301_200012360145 [0,2,1,0,0,0|1,0,0]=4 5308 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)CC 62a_200012360145_200000210301 [0,2,1,0,0,0|1,0,0]=4 5309 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)OC 62a_100012360133_200000210301 [0,2,1,0,0,0|1,0,0]=4 5310 B15R1.815 CCOC(=O)c1ccc(c(c1)SC)OC 62a_200000210301_100012360133 [0,2,1,0,0,0|1,0,0]=4 5311 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])CC 62a_200012360145_200025704644 [0,2,1,0,0,0|1,0,0]=4 5312 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])CC 62a_200025704644_200012360145 [0,2,1,0,0,0|1,0,0]=4 5313 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])OC 62a_100012360133_200025704644 [0,2,1,0,0,0|1,0,0]=4 5314 B15R1.815 CCOC(=O)c1ccc(c(c1)S[13CH3])OC 62a_200025704644_100012360133 [0,2,1,0,0,0|1,0,0]=4 5315 B15R1.816 C=C(C)c1cc(ccc1C)C(=O)OCC 271570a_100000694244_100012359631 [0,2,1,0,0,0|1,0,0]=4 5316 B15R1.816 CCOC(=O)c1ccc(c(n1)N(C)C)C 27a_100102631434_200009853511 [0,2,1,0,0,0|1,0,0]=4 5317 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)C 2230a_200015187719_200000210301 [0,2,1,0,0,0|1,0,0]=4 5318 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)C 34a_200015187719_200000210301 [0,2,1,0,0,0|1,0,0]=4 5319 B15R1.1243 CCCNC(=O)c1ccc(c(c1)NC)C 7a_200015187719_200000210301 [0,2,1,0,0,0|1,0,0]=4 5320 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])C 2230a_200015187719_200025704644 [0,2,1,0,0,0|1,0,0]=4 5321 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])C 34a_200015187719_200025704644 [0,2,1,0,0,0|1,0,0]=4 5322 B15R1.1243 CCCNC(=O)c1ccc(c(c1)N[13CH3])C 7a_200015187719_200025704644 [0,2,1,0,0,0|1,0,0]=4 5323 B15R1.1243 COCCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000233755 [0,2,1,0,0,0|1,0,0]=4 5324 B15R1.4037 CNc1cc(ccc1C)C(=O)NC(C)C 34a_200011193736_200000210301 [0,2,1,0,0,0|1,0,0]=4 5325 B15R1.4037 CNc1cc(ccc1C)C(=O)NC(C)C 7a_200011193736_200000210301 [0,2,1,0,0,0|1,0,0]=4 5326 B15R1.4037 Cc1ccc(cc1N[13CH3])C(=O)NC(C)C 34a_200011193736_200025704644 [0,2,1,0,0,0|1,0,0]=4 5327 B15R1.4037 Cc1ccc(cc1N[13CH3])C(=O)NC(C)C 7a_200011193736_200025704644 [0,2,1,0,0,0|1,0,0]=4 5328 B15R1.10612 CCOC(=O)c1cc(c(cc1C)C)SC 62a_100012360142_200000210301 [0,2,1,0,0,0|1,0,0]=4 5329 B15R1.10612 CCOC(=O)c1cc(c(cc1C)C)SC 62a_200000210301_100012360142 [0,2,1,0,0,0|1,0,0]=4 5330 B15R1.10612 CCOC(=O)c1cc(c(cc1C)C)S[13CH3] 62a_100012360142_200025704644 [0,2,1,0,0,0|1,0,0]=4 5331 B15R1.10612 CCOC(=O)c1cc(c(cc1C)C)S[13CH3] 62a_200025704644_100012360142 [0,2,1,0,0,0|1,0,0]=4 5332 B15R1.3760 C=C(C)c1cc(ccc1CC)C(=O)OC 271570a_100000694244_200012360130 [0,2,1,0,0,0|1,0,0]=4 5333 B15R1.3760 C=C(C)c1cc(ccc1CO)C(=O)OC 271570a_100000694244_100012355398 [0,2,1,0,0,0|1,0,0]=4 5334 B15R1.3760 C=C(C)c1cc(ccc1OC)C(=O)OC 271570a_100000694244_100000189012 [0,2,1,0,0,0|1,0,0]=4 5335 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)OC 7a_100000030976_200000210301 [0,2,1,0,0,0|1,0,0]=4 5336 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)O[13CH3] 7a_100000030976_200025704644 [0,2,1,0,0,0|1,0,0]=4 5337 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)SC 62a_200016005208_200000210301 [0,2,1,0,0,0|1,0,0]=4 5338 B15R1.3760 COC(=O)c1ccc(c(c1)C(=O)C)S[13CH3] 62a_200016005208_200025704644 [0,2,1,0,0,0|1,0,0]=4 5339 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)SC 62a_200000210301_200025703530 [0,2,1,0,0,0|1,0,0]=4 5340 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)SC 62a_200025703530_200000210301 [0,2,1,0,0,0|1,0,0]=4 5341 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)S[13CH3] 62a_200025703530_200025704644 [0,2,1,0,0,0|1,0,0]=4 5342 B15R1.3760 COC(=O)c1ccc(c(c1)C(C)C)S[13CH3] 62a_200025704644_200025703530 [0,2,1,0,0,0|1,0,0]=4 5343 B15R1.11684 C=C(C)c1c(ccc(c1C)C(=O)OC)C 271570a_100000694244_200010734123 [0,2,1,0,0,0|1,0,0]=4 5344 B15R1.11738 C=C(C)c1cc(c(cc1C)C)C(=O)OC 271570a_100000694244_200012360129 [0,2,1,0,0,0|1,0,0]=4 5345 B15R1.11738 C=C(C)c1cc(c(cc1C)Cl)C(=O)OC 271570a_100000694244_100014124666 [0,2,1,0,0,0|1,0,0]=4 5346 B15R1.11738 C=C(C)c1cc(c(cc1C)F)C(=O)OC 271570a_100000694244_100012920548 [0,2,1,0,0,0|1,0,0]=4 5347 B15R1.11738 C=C(C)c1cc(c(cc1C)N)C(=O)OC 271570a_100000694244_100010892302 [0,2,1,0,0,0|1,0,0]=4 5348 B15R1.11738 C=C(C)c1cc(c(cc1C)O)C(=O)OC 271570a_100000694244_100010233952 [0,2,1,0,0,0|1,0,0]=4 5349 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)SC 62a_100010236281_200000210301 [0,2,1,0,0,0|1,0,0]=4 5350 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)SC 62a_200000210301_100010236281 [0,2,1,0,0,0|1,0,0]=4 5351 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)S[13CH3] 62a_100010236281_200025704644 [0,2,1,0,0,0|1,0,0]=4 5352 B15R1.1827 COC(=O)c1cc(c(cc1C)OC)S[13CH3] 62a_200025704644_100010236281 [0,2,1,0,0,0|1,0,0]=4 5353 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)SC 62a_100015648668_200000210301 [0,2,1,0,0,0|1,0,0]=4 5354 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)SC 62a_200000210301_100015648668 [0,2,1,0,0,0|1,0,0]=4 5355 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)S[13CH3] 62a_100015648668_200025704644 [0,2,1,0,0,0|1,0,0]=4 5356 B15R1.1827 COC(=O)c1cc(c(cc1F)OC)S[13CH3] 62a_200025704644_100015648668 [0,2,1,0,0,0|1,0,0]=4 5357 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)OC 34a_100009867527_200000210301 [0,2,1,0,0,0|1,0,0]=4 5358 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)OC 7a_100009867527_200000210301 [0,2,1,0,0,0|1,0,0]=4 5359 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)O[13CH3] 34a_100009867527_200025704644 [0,2,1,0,0,0|1,0,0]=4 5360 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)O[13CH3] 7a_100009867527_200025704644 [0,2,1,0,0,0|1,0,0]=4 5361 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)SC 62a_100000730826_200000210301 [0,2,1,0,0,0|1,0,0]=4 5362 B15R1.1827 COC(=O)c1cc(c(cc1N)OC)S[13CH3] 62a_100000730826_200025704644 [0,2,1,0,0,0|1,0,0]=4 5363 B15R1.1827 COC(=O)c1cc(c(cc1N)SC)OC 62a_100014686525_200000210301 [0,2,1,0,0,0|1,0,0]=4 5364 B15R1.1827 COC(=O)c1cc(c(cc1N)S[13CH3])OC 62a_100014686525_200025704644 [0,2,1,0,0,0|1,0,0]=4 5365 B15R1.1827 COC(=O)c1cc(c(cc1O)OC)OC 271570a_203496583355_100000058957 [0,2,1,0,0,0|1,0,0]=4 5366 B15R1.1849 COC(=O)c1ccc(c(c1C)SC)OC 62a_100010761468_200000210301 [0,2,1,0,0,0|1,0,0]=4 5367 B15R1.1849 COC(=O)c1ccc(c(c1C)SC)OC 62a_200000210301_100010761468 [0,2,1,0,0,0|1,0,0]=4 5368 B15R1.1849 COC(=O)c1ccc(c(c1C)S[13CH3])OC 62a_100010761468_200025704644 [0,2,1,0,0,0|1,0,0]=4 5369 B15R1.1849 COC(=O)c1ccc(c(c1C)S[13CH3])OC 62a_200025704644_100010761468 [0,2,1,0,0,0|1,0,0]=4 5370 B15R1.4045 C=C(C)c1ccc(cc1OC)C(=O)OC 271570a_100000694244_100009816954 [0,2,1,0,0,0|1,0,0]=4 5371 B15R1.4045 COC(=O)c1ccc(c(c1)SC)C(C)C 62a_200000210301_200010236285 [0,2,1,0,0,0|1,0,0]=4 5372 B15R1.4045 COC(=O)c1ccc(c(c1)SC)C(C)C 62a_200010236285_200000210301 [0,2,1,0,0,0|1,0,0]=4 5373 B15R1.4045 COC(=O)c1ccc(c(c1)S[13CH3])C(C)C 62a_200010236285_200025704644 [0,2,1,0,0,0|1,0,0]=4 5374 B15R1.4045 COC(=O)c1ccc(c(c1)S[13CH3])C(C)C 62a_200025704644_200010236285 [0,2,1,0,0,0|1,0,0]=4 5375 B15R1.7061 CC=Cc1ccc(cc1OC)C(=O)OC 271570a_100016259895_100009816954 [0,2,1,0,0,0|1,0,0]=4 5376 B15R1.7061 CCOc1ccc(cc1OC)C(=O)OC 34a_100000212147_100000210202 [0,2,1,0,0,0|1,0,0]=4 5377 B15R1.7061 CCOc1ccc(cc1OC)C(=O)OC 7a_100000212147_100000210202 [0,2,1,0,0,0|1,0,0]=4 5378 B15R1.7061 CCSc1ccc(cc1OC)C(=O)OC 62a_100000210202_100009816954 [0,2,1,0,0,0|1,0,0]=4 5379 B15R1.7061 CCSc1ccc(cc1OC)C(=O)OC 62a_100009816954_100000210202 [0,2,1,0,0,0|1,0,0]=4 5380 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 2230a_106832991635_100000765176 [0,2,1,0,0,0|1,0,0]=4 5381 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 26a_100102657272_100000212147 [0,2,1,0,0,0|1,0,0]=4 5382 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 270004a_106832991635_100009848378 [0,2,1,0,0,0|1,0,0]=4 5383 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 34a_100102657272_100000765176 [0,2,1,0,0,0|1,0,0]=4 5384 B15R1.7061 CNCc1ccc(cc1OC)C(=O)OC 7a_106832991635_100000765176 [0,2,1,0,0,0|1,0,0]=4 5385 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CO[13CH3] 34a_100010744631_200025704644 [0,2,1,0,0,0|1,0,0]=4 5386 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CO[13CH3] 7a_100010744631_200025704644 [0,2,1,0,0,0|1,0,0]=4 5387 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CSC 62a_100000765176_200000210301 [0,2,1,0,0,0|1,0,0]=4 5388 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CSC 62a_200000210301_100000765176 [0,2,1,0,0,0|1,0,0]=4 5389 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CS[13CH3] 62a_100000765176_200025704644 [0,2,1,0,0,0|1,0,0]=4 5390 B15R1.7061 COC(=O)c1ccc(c(c1)OC)CS[13CH3] 62a_200025704644_100000765176 [0,2,1,0,0,0|1,0,0]=4 5391 B15R1.7061 COC(=O)c1ccc(c(c1)OC)OCF 34a_100000212147_100015361967 [0,2,1,0,0,0|1,0,0]=4 5392 B15R1.7061 COC(=O)c1ccc(c(c1)OC)OCF 7a_100000212147_100015361967 [0,2,1,0,0,0|1,0,0]=4 5393 B15R1.7061 COC(=O)c1ccc(c(c1)OC)SCF 62a_100009816954_100015361967 [0,2,1,0,0,0|1,0,0]=4 5394 B15R1.7061 COC(=O)c1ccc(c(c1)OC)SCF 62a_100015361967_100009816954 [0,2,1,0,0,0|1,0,0]=4 5395 B15R1.7061 COCc1ccc(cc1OC)C(=O)OC 34a_100010744631_200000210301 [0,2,1,0,0,0|1,0,0]=4 5396 B15R1.7061 COCc1ccc(cc1OC)C(=O)OC 34a_100138415774_100000765176 [0,2,1,0,0,0|1,0,0]=4 5397 B15R1.7061 COCc1ccc(cc1OC)C(=O)OC 7a_100010744631_200000210301 [0,2,1,0,0,0|1,0,0]=4 5398 B15R1.1791 COC(=O)c1cc(c(cc1OC)C)SC 62a_100010233953_200000210301 [0,2,1,0,0,0|1,0,0]=4 5399 B15R1.1791 COC(=O)c1cc(c(cc1OC)C)SC 62a_200000210301_100010200788 [0,2,1,0,0,0|1,0,0]=4 5400 B15R1.1791 COC(=O)c1cc(c(cc1OC)C)S[13CH3] 62a_100010233953_200025704644 [0,2,1,0,0,0|1,0,0]=4 5401 B15R1.1791 COC(=O)c1cc(c(cc1OC)C)S[13CH3] 62a_200025704644_100010200788 [0,2,1,0,0,0|1,0,0]=4 5402 B15R1.105 CCCCc1ccc(cc1)C(=O)COC 271570a_100020621405_200011343064 [0,2,1,0,0,0|1,0,0]=4 5403 B15R1.105 CCCCc1ccc(cc1)C(=O)OCC 271570a_100020621405_100000170077 [0,2,1,0,0,0|1,0,0]=4 5404 B15R1.105 CCCOc1ccc(cc1)C(=O)COC 34a_200009861119_100000210303 [0,2,1,0,0,0|1,0,0]=4 5405 B15R1.105 CCCOc1ccc(cc1)C(=O)COC 7a_200009861119_100000210303 [0,2,1,0,0,0|1,0,0]=4 5406 B15R1.105 CCCOc1ccc(cc1)C(=O)OCC 34a_100000169885_100000210303 [0,2,1,0,0,0|1,0,0]=4 5407 B15R1.105 CCCOc1ccc(cc1)C(=O)OCC 7a_100000169885_100000210303 [0,2,1,0,0,0|1,0,0]=4 5408 B15R1.105 CCCSc1ccc(cc1)C(=O)COC 62a_200011343064_100000210303 [0,2,1,0,0,0|1,0,0]=4 5409 B15R1.105 CCCSc1ccc(cc1)C(=O)OCC 62a_100000169895_100000210303 [0,2,1,0,0,0|1,0,0]=4 5410 B15R1.105 CCCSc1ccc(cc1)C(=O)OCC 62a_100000210303_100000169919 [0,2,1,0,0,0|1,0,0]=4 5411 B15R1.105 CCNCc1ccc(cc1)C(=O)OCC 2230a_100015525214_100009812261 [0,2,1,0,0,0|1,0,0]=4 5412 B15R1.105 CCNCc1ccc(cc1)C(=O)OCC 270004a_100015525214_100000170165 [0,2,1,0,0,0|1,0,0]=4 5413 B15R1.105 CCOC(=O)c1ccc(cc1)CSCC 62a_100000210202_100009812261 [0,2,1,0,0,0|1,0,0]=4 5414 B15R1.105 CCOC(=O)c1ccc(cc1)CSCC 62a_100009812261_100000210202 [0,2,1,0,0,0|1,0,0]=4 5415 B15R1.105 CCOC(=O)c1ccc(cc1)CSCF 62a_100009812261_100015361967 [0,2,1,0,0,0|1,0,0]=4 5416 B15R1.105 CCOC(=O)c1ccc(cc1)CSCF 62a_100015361967_100009812261 [0,2,1,0,0,0|1,0,0]=4 5417 B15R1.105 CCOC(=O)c1ccc(cc1)OCCF 34a_100000169885_100011217306 [0,2,1,0,0,0|1,0,0]=4 5418 B15R1.105 CCOC(=O)c1ccc(cc1)OCCF 7a_100000169885_100011217306 [0,2,1,0,0,0|1,0,0]=4 5419 B15R1.105 CCOC(=O)c1ccc(cc1)OCCO 34a_100000169885_100000211926 [0,2,1,0,0,0|1,0,0]=4 5420 B15R1.105 CCOC(=O)c1ccc(cc1)OCCO 7a_100000169885_100000211926 [0,2,1,0,0,0|1,0,0]=4 5421 B15R1.105 CCOC(=O)c1ccc(cc1)SCCF 62a_100000169895_100011217306 [0,2,1,0,0,0|1,0,0]=4 5422 B15R1.105 CCOC(=O)c1ccc(cc1)SCCF 62a_100011217306_100000169919 [0,2,1,0,0,0|1,0,0]=4 5423 B15R1.105 CCOC(=O)c1ccc(cc1)SCCO 62a_100000169895_100000211926 [0,2,1,0,0,0|1,0,0]=4 5424 B15R1.105 CCOC(=O)c1ccc(cc1)SCCO 62a_100000211926_100000169919 [0,2,1,0,0,0|1,0,0]=4 5425 B15R1.105 CCOCc1ccc(cc1)C(=O)OCC 34a_100121572206_100009812261 [0,2,1,0,0,0|1,0,0]=4 5426 B15R1.105 COCC(=O)c1ccc(cc1)OCCF 34a_200009861119_100011217306 [0,2,1,0,0,0|1,0,0]=4 5427 B15R1.105 COCC(=O)c1ccc(cc1)OCCF 7a_200009861119_100011217306 [0,2,1,0,0,0|1,0,0]=4 5428 B15R1.105 COCC(=O)c1ccc(cc1)OCCO 34a_200009861119_100000211926 [0,2,1,0,0,0|1,0,0]=4 5429 B15R1.105 COCC(=O)c1ccc(cc1)OCCO 7a_200009861119_100000211926 [0,2,1,0,0,0|1,0,0]=4 5430 B15R1.105 COCC(=O)c1ccc(cc1)SCCF 62a_200011343064_100011217306 [0,2,1,0,0,0|1,0,0]=4 5431 B15R1.105 COCC(=O)c1ccc(cc1)SCCO 62a_200011343064_100000211926 [0,2,1,0,0,0|1,0,0]=4 5432 B15R1.779 COCC(=O)c1ccc(cc1)CC(C)C 34a_100138415774_100000741693 [0,2,1,0,0,0|1,0,0]=4 5433 B15R1.780 CCCC(=O)c1ccc(cc1)C(=O)OC 1458a_100000211811_100000210303 [0,2,1,0,0,0|1,0,0]=4 5434 B15R1.780 CCCN(C)c1ccc(cc1)C(=O)OC 2230a_100000220287_100000210303 [0,2,1,0,0,0|1,0,0]=4 5435 B15R1.780 CCCN(C)c1ccc(cc1)C(=O)OC 269982a_100000220287_100000210303 [0,2,1,0,0,0|1,0,0]=4 5436 B15R1.780 CCCN(C)c1ccc(cc1)C(=O)OC 34a_100000220287_100000210303 [0,2,1,0,0,0|1,0,0]=4 5437 B15R1.780 CCNC(C)c1ccc(cc1)C(=O)OC 2230a_100015525214_100010159609 [0,2,1,0,0,0|1,0,0]=4 5438 B15R1.780 CCOC(C)c1ccc(cc1)C(=O)OC 34a_100000036437_100000210202 [0,2,1,0,0,0|1,0,0]=4 5439 B15R1.780 CCOC(C)c1ccc(cc1)C(=O)OC 7a_100000036437_100000210202 [0,2,1,0,0,0|1,0,0]=4 5440 B15R1.780 CCSC(C)c1ccc(cc1)C(=O)OC 62a_100000210202_100010159609 [0,2,1,0,0,0|1,0,0]=4 5441 B15R1.780 CCSC(C)c1ccc(cc1)C(=O)OC 62a_100010159609_100000210202 [0,2,1,0,0,0|1,0,0]=4 5442 B15R1.780 CNCC(=O)c1ccc(cc1)C(=O)OC 2230a_106832991635_100000233775 [0,2,1,0,0,0|0,0,1]=4 5443 B15R1.780 CNCC(=O)c1ccc(cc1)C(=O)OC 7a_106832991635_100000233775 [0,2,1,0,0,0|0,0,1]=4 5444 B15R1.780 COC(=O)c1ccc(cc1)C(=O)CCF 1458a_100000211811_100011217306 [0,2,1,0,0,0|1,0,0]=4 5445 B15R1.780 COC(=O)c1ccc(cc1)C(=O)CCO 1458a_100000211811_100000211926 [0,2,1,0,0,0|1,0,0]=4 5446 B15R1.780 COC(=O)c1ccc(cc1)C(C)OCF 34a_100000036437_100015361967 [0,2,1,0,0,0|1,0,0]=4 5447 B15R1.780 COC(=O)c1ccc(cc1)C(C)OCF 7a_100000036437_100015361967 [0,2,1,0,0,0|1,0,0]=4 5448 B15R1.780 COC(=O)c1ccc(cc1)C(C)SCF 62a_100010159609_100015361967 [0,2,1,0,0,0|1,0,0]=4 5449 B15R1.780 COC(=O)c1ccc(cc1)C(C)SCF 62a_100015361967_100010159609 [0,2,1,0,0,0|1,0,0]=4 5450 B15R1.780 COC(=O)c1ccc(cc1)N(C)CCF 2230a_100000220287_100011217306 [0,2,1,0,0,0|1,0,0]=4 5451 B15R1.780 COC(=O)c1ccc(cc1)N(C)CCF 269982a_100000220287_100011217306 [0,2,1,0,0,0|1,0,0]=4 5452 B15R1.780 COC(=O)c1ccc(cc1)N(C)CCF 34a_100000220287_100011217306 [0,2,1,0,0,0|1,0,0]=4 5453 B15R1.780 COC(=O)c1ccc(cc1)N(C)CCO 2230a_100000220287_100000211926 [0,2,1,0,0,0|1,0,0]=4 5454 B15R1.780 COC(=O)c1ccc(cc1)N(C)CCO 269982a_100000220287_100000211926 [0,2,1,0,0,0|1,0,0]=4 5455 B15R1.780 COC(=O)c1ccc(cc1)N(C)CCO 34a_100000220287_100000211926 [0,2,1,0,0,0|1,0,0]=4 5456 B15R1.1221 CCCc1ccc(cc1)C(=O)CCOC 1458a_100011207308_100000233755 [0,2,1,0,0,0|1,0,0]=4 5457 B15R1.1221 COCCC(=O)c1ccc(cc1)CCO 1458a_100000078963_100000233755 [0,2,1,0,0,0|1,0,0]=4 5458 B15R1.557 C#CCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000688953 [0,2,1,0,0,0|1,0,0]=4 5459 B15R1.557 C#CCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000688953 [0,2,1,0,0,0|1,0,0]=4 5460 B15R1.557 C#CCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000688953 [0,2,1,0,0,0|1,0,0]=4 5461 B15R1.557 C#CCCSc1ccc(cc1)C(=O)OC 62a_100000688953_100000150774 [0,2,1,0,0,0|1,0,0]=4 5462 B15R1.557 C#CCNCc1ccc(cc1)C(=O)OC 34a_100000212058_100000735637 [0,2,1,0,0,0|1,0,0]=4 5463 B15R1.557 C#CCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000184674 [0,2,1,0,0,0|1,0,0]=4 5464 B15R1.557 C#CCOCc1ccc(cc1)C(=O)OC 34a_100000210247_100000735637 [0,2,1,0,0,0|1,0,0]=4 5465 B15R1.557 C#CCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000038162 [0,2,1,0,0,0|1,0,0]=4 5466 B15R1.557 C#CCSCc1ccc(cc1)C(=O)OC 62a_100000038162_100000187170 [0,2,1,0,0,0|1,0,0]=4 5467 B15R1.557 C=CCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000754431 [0,2,1,0,0,0|1,0,0]=4 5468 B15R1.557 C=CCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000754431 [0,2,1,0,0,0|1,0,0]=4 5469 B15R1.557 C=CCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000754431 [0,2,1,0,0,0|1,0,0]=4 5470 B15R1.557 C=CCCSc1ccc(cc1)C(=O)OC 62a_100000754431_100000150774 [0,2,1,0,0,0|1,0,0]=4 5471 B15R1.557 C=CCNCc1ccc(cc1)C(=O)OC 2230a_100020586998_100000735637 [0,2,1,0,0,0|1,0,0]=4 5472 B15R1.557 C=CCNCc1ccc(cc1)C(=O)OC 270004a_100020586998_100000148700 [0,2,1,0,0,0|1,0,0]=4 5473 B15R1.557 C=CCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100015514636 [0,2,1,0,0,0|1,0,0]=4 5474 B15R1.557 C=CCOCc1ccc(cc1)C(=O)OC 34a_200000210373_100000735637 [0,2,1,0,0,0|1,0,0]=4 5475 B15R1.557 C=CCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100015514636 [0,2,1,0,0,0|1,0,0]=4 5476 B15R1.557 C=CCSCc1ccc(cc1)C(=O)OC 62a_100000210623_100000187170 [0,2,1,0,0,0|1,0,0]=4 5477 B15R1.557 C=CCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210623 [0,2,1,0,0,0|1,0,0]=4 5478 B15R1.557 CCCC=Cc1ccc(cc1)C(=O)OC 271570a_100016258520_100000150774 [0,2,1,0,0,0|1,0,0]=4 5479 B15R1.557 CCCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100000210210 [0,2,1,0,0,0|1,0,0]=4 5480 B15R1.557 CCCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000210211 [0,2,1,0,0,0|1,0,0]=4 5481 B15R1.557 CCCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000210210 [0,2,1,0,0,0|1,0,0]=4 5482 B15R1.557 CCCCSc1ccc(cc1)C(=O)OC 62a_100000210211_100000150774 [0,2,1,0,0,0|1,0,0]=4 5483 B15R1.557 CCCNCc1ccc(cc1)C(=O)OC 270004a_100020643023_100000148700 [0,2,1,0,0,0|1,0,0]=4 5484 B15R1.557 CCCOCc1ccc(cc1)C(=O)OC 34a_100000151488_100000210303 [0,2,1,0,0,0|1,0,0]=4 5485 B15R1.557 CCCOCc1ccc(cc1)C(=O)OC 34a_100000210258_100000735637 [0,2,1,0,0,0|1,0,0]=4 5486 B15R1.557 CCCOCc1ccc(cc1)C(=O)OC 7a_100000151488_100000210303 [0,2,1,0,0,0|1,0,0]=4 5487 B15R1.557 CCCSCc1ccc(cc1)C(=O)OC 62a_100000210303_100000187170 [0,2,1,0,0,0|1,0,0]=4 5488 B15R1.557 CCCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000210303 [0,2,1,0,0,0|1,0,0]=4 5489 B15R1.557 CCNCCc1ccc(cc1)C(=O)OC 2230a_100015525214_100010192280 [0,2,1,0,0,0|0,0,0]=3 5490 B15R1.557 CCOCCc1ccc(cc1)C(=O)OC 34a_100010779965_100000210202 [0,2,1,0,0,0|1,0,0]=4 5491 B15R1.557 CCOCCc1ccc(cc1)C(=O)OC 34a_100121572206_100010192280 [0,2,1,0,0,0|1,0,0]=4 5492 B15R1.557 CCOCCc1ccc(cc1)C(=O)OC 7a_100010779965_100000210202 [0,2,1,0,0,0|1,0,0]=4 5493 B15R1.557 CCOCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000739092 [0,2,1,0,0,0|1,0,0]=4 5494 B15R1.557 CCOCSc1ccc(cc1)C(=O)OC 62a_100000739092_100000150774 [0,2,1,0,0,0|1,0,0]=4 5495 B15R1.557 CCSCCc1ccc(cc1)C(=O)OC 62a_100000210202_100010192280 [0,2,1,0,0,0|1,0,0]=4 5496 B15R1.557 CCSCCc1ccc(cc1)C(=O)OC 62a_100010192280_100000210202 [0,2,1,0,0,0|1,0,0]=4 5497 B15R1.557 CNC(=O)c1ccc(cc1)COCCN 34a_100000210304_100000753832 [0,2,1,0,0,0|1,0,0]=4 5498 B15R1.557 CNCCCc1ccc(cc1)C(=O)OC 2230a_106832991635_100010192279 [0,2,1,0,0,0|0,0,0]=3 5499 B15R1.557 CNCCCc1ccc(cc1)C(=O)OC 34a_100102657272_100010192279 [0,2,1,0,0,0|0,0,0]=3 5500 B15R1.557 CNCCCc1ccc(cc1)C(=O)OC 7a_106832991635_100010192279 [0,2,1,0,0,0|0,0,0]=3 5501 B15R1.557 CNCCOc1ccc(cc1)C(=O)OC 2230a_106832991635_100000742590 [0,2,1,0,0,0|0,0,0]=3 5502 B15R1.557 CNCCOc1ccc(cc1)C(=O)OC 34a_100102657272_100000742590 [0,2,1,0,0,0|0,0,0]=3 5503 B15R1.557 CNCCOc1ccc(cc1)C(=O)OC 7a_106832991635_100000742590 [0,2,1,0,0,0|0,0,0]=3 5504 B15R1.557 COC(=O)c1ccc(cc1)CCCSC 62a_100010192279_200000210301 [0,2,1,0,0,0|1,0,0]=4 5505 B15R1.557 COC(=O)c1ccc(cc1)CCCSC 62a_200000210301_100010192279 [0,2,1,0,0,0|1,0,0]=4 5506 B15R1.557 COC(=O)c1ccc(cc1)CCCS[13CH3] 62a_100010192279_200025704644 [0,2,1,0,0,0|1,0,0]=4 5507 B15R1.557 COC(=O)c1ccc(cc1)CCCS[13CH3] 62a_200025704644_100010192279 [0,2,1,0,0,0|1,0,0]=4 5508 B15R1.557 COC(=O)c1ccc(cc1)CCOCF 34a_100010779965_100015361967 [0,2,1,0,0,0|1,0,0]=4 5509 B15R1.557 COC(=O)c1ccc(cc1)CCOCF 7a_100010779965_100015361967 [0,2,1,0,0,0|1,0,0]=4 5510 B15R1.557 COC(=O)c1ccc(cc1)CCSCF 62a_100010192280_100015361967 [0,2,1,0,0,0|1,0,0]=4 5511 B15R1.557 COC(=O)c1ccc(cc1)CCSCF 62a_100015361967_100010192280 [0,2,1,0,0,0|1,0,0]=4 5512 B15R1.557 COC(=O)c1ccc(cc1)CNCCF 34a_100000724931_100000735637 [0,2,1,0,0,0|1,0,0]=4 5513 B15R1.557 COC(=O)c1ccc(cc1)CNCCO 2230a_100016997473_100000735637 [0,2,1,0,0,0|1,0,0]=4 5514 B15R1.557 COC(=O)c1ccc(cc1)CNCCO 270004a_100000210304_100000148700 [0,2,1,0,0,0|1,0,0]=4 5515 B15R1.557 COC(=O)c1ccc(cc1)CNCCO 34a_100016990907_100000735637 [0,2,1,0,0,0|1,0,0]=4 5516 B15R1.557 COC(=O)c1ccc(cc1)COCC#N 7a_100000151488_100011215382 [0,2,1,0,0,0|0,0,1]=4 5517 B15R1.557 COC(=O)c1ccc(cc1)COCC=O 34a_100000151488_200009817547 [0,2,1,0,0,0|1,0,0]=4 5518 B15R1.557 COC(=O)c1ccc(cc1)COCC=O 7a_100000151488_200015260668 [0,2,1,0,0,0|1,0,0]=4 5519 B15R1.557 COC(=O)c1ccc(cc1)COCCBr 34a_100000211926_100000735637 [0,2,1,0,0,0|1,0,0]=4 5520 B15R1.557 COC(=O)c1ccc(cc1)COCCF 34a_100000151488_100011217306 [0,2,1,0,0,0|1,0,0]=4 5521 B15R1.557 COC(=O)c1ccc(cc1)COCCF 7a_100000151488_100011217306 [0,2,1,0,0,0|1,0,0]=4 5522 B15R1.557 COC(=O)c1ccc(cc1)COCCN 34a_100000210304_100000735637 [0,2,1,0,0,0|0,0,0]=3 5523 B15R1.557 COC(=O)c1ccc(cc1)COCCO 34a_100000151488_100000211926 [0,2,1,0,0,0|1,0,0]=4 5524 B15R1.557 COC(=O)c1ccc(cc1)COCCO 7a_100000151488_100000211926 [0,2,1,0,0,0|1,0,0]=4 5525 B15R1.557 COC(=O)c1ccc(cc1)COCSC 34a_100000151488_100011218213 [0,2,1,0,0,0|1,0,0]=4 5526 B15R1.557 COC(=O)c1ccc(cc1)CSCC#N 62a_100000735637_100011215382 [0,2,1,0,0,0|0,0,1]=4 5527 B15R1.557 COC(=O)c1ccc(cc1)CSCC#N 62a_100011215382_100000187170 [0,2,1,0,0,0|0,0,1]=4 5528 B15R1.557 COC(=O)c1ccc(cc1)CSCC=O 62a_100000735637_200015260668 [0,2,1,0,0,0|1,0,0]=4 5529 B15R1.557 COC(=O)c1ccc(cc1)CSCC=O 62a_200015260668_100000187170 [0,2,1,0,0,0|1,0,0]=4 5530 B15R1.557 COC(=O)c1ccc(cc1)CSCCF 62a_100000735637_100011217306 [0,2,1,0,0,0|1,0,0]=4 5531 B15R1.557 COC(=O)c1ccc(cc1)CSCCF 62a_100011217306_100000187170 [0,2,1,0,0,0|1,0,0]=4 5532 B15R1.557 COC(=O)c1ccc(cc1)CSCCO 62a_100000211926_100000187170 [0,2,1,0,0,0|1,0,0]=4 5533 B15R1.557 COC(=O)c1ccc(cc1)CSCCO 62a_100000735637_100000211926 [0,2,1,0,0,0|1,0,0]=4 5534 B15R1.557 COC(=O)c1ccc(cc1)CSCSC 62a_100000735637_100011218213 [0,2,1,0,0,0|1,0,0]=4 5535 B15R1.557 COC(=O)c1ccc(cc1)CSCSC 62a_100011218213_100000187170 [0,2,1,0,0,0|1,0,0]=4 5536 B15R1.557 COC(=O)c1ccc(cc1)OCCC#N 7a_100000150123_100000184422 [0,2,1,0,0,0|0,0,1]=4 5537 B15R1.557 COC(=O)c1ccc(cc1)OCCCF 34a_100000150123_100011934791 [0,2,1,0,0,0|1,0,0]=4 5538 B15R1.557 COC(=O)c1ccc(cc1)OCCCF 7a_100000150123_100011934791 [0,2,1,0,0,0|1,0,0]=4 5539 B15R1.557 COC(=O)c1ccc(cc1)OCCCO 34a_100000150123_100000230001 [0,2,1,0,0,0|1,0,0]=4 5540 B15R1.557 COC(=O)c1ccc(cc1)OCCCO 7a_100000150123_100011215043 [0,2,1,0,0,0|1,0,0]=4 5541 B15R1.557 COC(=O)c1ccc(cc1)OCCO[13CH3] 34a_100011216607_200025704644 [0,2,1,0,0,0|1,0,0]=4 5542 B15R1.557 COC(=O)c1ccc(cc1)OCCO[13CH3] 7a_100011216607_200025704644 [0,2,1,0,0,0|1,0,0]=4 5543 B15R1.557 COC(=O)c1ccc(cc1)OCCSC 34a_100000150123_100000212216 [0,2,1,0,0,0|1,0,0]=4 5544 B15R1.557 COC(=O)c1ccc(cc1)OCCSC 62a_100000742590_200000210301 [0,2,1,0,0,0|1,0,0]=4 5545 B15R1.557 COC(=O)c1ccc(cc1)OCCSC 62a_200000210301_100000742590 [0,2,1,0,0,0|1,0,0]=4 5546 B15R1.557 COC(=O)c1ccc(cc1)OCCSC 7a_100000150123_100000212216 [0,2,1,0,0,0|1,0,0]=4 5547 B15R1.557 COC(=O)c1ccc(cc1)OCCS[13CH3] 62a_100000742590_200025704644 [0,2,1,0,0,0|1,0,0]=4 5548 B15R1.557 COC(=O)c1ccc(cc1)OCCS[13CH3] 62a_200025704644_100000742590 [0,2,1,0,0,0|1,0,0]=4 5549 B15R1.557 COC(=O)c1ccc(cc1)SCCC#N 62a_100000150774_100011215226 [0,2,1,0,0,0|0,0,1]=4 5550 B15R1.557 COC(=O)c1ccc(cc1)SCCC#N 62a_100011215226_100000150774 [0,2,1,0,0,0|0,0,1]=4 5551 B15R1.557 COC(=O)c1ccc(cc1)SCCCF 62a_100000150774_100011934791 [0,2,1,0,0,0|1,0,0]=4 5552 B15R1.557 COC(=O)c1ccc(cc1)SCCCF 62a_100011934791_100000150774 [0,2,1,0,0,0|1,0,0]=4 5553 B15R1.557 COC(=O)c1ccc(cc1)SCCCO 62a_100000150774_100011215043 [0,2,1,0,0,0|1,0,0]=4 5554 B15R1.557 COC(=O)c1ccc(cc1)SCCCO 62a_100011215043_100000150774 [0,2,1,0,0,0|1,0,0]=4 5555 B15R1.557 COC(=O)c1ccc(cc1)SCCSC 62a_100000150774_100000751147 [0,2,1,0,0,0|1,0,0]=4 5556 B15R1.557 COC(=O)c1ccc(cc1)SCCSC 62a_100000212216_100000150774 [0,2,1,0,0,0|1,0,0]=4 5557 B15R1.557 COC(=O)c1ccc(cn1)COCCN 34a_100000210304_100010177729 [0,2,1,0,0,0|1,0,0]=4 5558 B15R1.557 COC(=O)c1ccc(nc1)COCCN 34a_100000210304_100010230174 [0,2,1,0,0,0|1,0,0]=4 5559 B15R1.557 COCCCc1ccc(cc1)C(=O)OC 34a_100138415774_100010192279 [0,2,1,0,0,0|1,0,0]=4 5560 B15R1.557 COCCOc1ccc(cc1)C(=O)OC 34a_100000150123_100011201679 [0,2,1,0,0,0|1,0,0]=4 5561 B15R1.557 COCCOc1ccc(cc1)C(=O)OC 34a_100011216607_200000210301 [0,2,1,0,0,0|1,0,0]=4 5562 B15R1.557 COCCOc1ccc(cc1)C(=O)OC 34a_100138415774_100000742590 [0,2,1,0,0,0|1,0,0]=4 5563 B15R1.557 COCCOc1ccc(cc1)C(=O)OC 7a_100000150123_100000233755 [0,2,1,0,0,0|1,0,0]=4 5564 B15R1.557 COCCOc1ccc(cc1)C(=O)OC 7a_100011216607_200000210301 [0,2,1,0,0,0|1,0,0]=4 5565 B15R1.557 COCCSc1ccc(cc1)C(=O)OC 62a_100000150774_100000233755 [0,2,1,0,0,0|1,0,0]=4 5566 B15R1.557 COCCSc1ccc(cc1)C(=O)OC 62a_100000233755_100000150774 [0,2,1,0,0,0|1,0,0]=4 5567 B15R1.557 COCSCc1ccc(cc1)C(=O)OC 62a_100000735637_100000766300 [0,2,1,0,0,0|1,0,0]=4 5568 B15R1.557 COCSCc1ccc(cc1)C(=O)OC 62a_100000766300_100000187170 [0,2,1,0,0,0|1,0,0]=4 5569 B15R1.944 COC(=O)c1ccc(cc1)CCC(=O)C 1458a_100000070787_100010192280 [0,2,1,0,0,0|1,0,0]=4 5570 B15R1.944 COC(=O)c1ccc(cc1)CCC(=O)C 1458a_100000070832_200000210301 [0,2,1,0,0,0|1,0,0]=4 5571 B15R1.944 COC(=O)c1ccc(cc1)CCC(=O)[13CH3] 1458a_100000070832_200025704644 [0,2,1,0,0,0|1,0,0]=4 5572 B15R1.944 COC(=O)c1ccc(cc1)CCN(C)C 2230a_100102631434_100010192280 [0,2,1,0,0,0|0,0,0]=3 5573 B15R1.944 COC(=O)c1ccc(cc1)CCN(C)C 269982a_100102631434_100010192280 [0,2,1,0,0,0|0,0,0]=3 5574 B15R1.944 COC(=O)c1ccc(cc1)CNC(C)C 2230a_100138425928_100000735637 [0,2,1,0,0,0|1,0,0]=4 5575 B15R1.944 COC(=O)c1ccc(cc1)CNC(C)C 34a_100138425928_100000735637 [0,2,1,0,0,0|1,0,0]=4 5576 B15R1.944 COC(=O)c1ccc(cc1)COC(C)C 34a_100000151488_100000210206 [0,2,1,0,0,0|1,0,0]=4 5577 B15R1.944 COC(=O)c1ccc(cc1)COC(C)C 34a_100000212225_100000735637 [0,2,1,0,0,0|1,0,0]=4 5578 B15R1.944 COC(=O)c1ccc(cc1)COC(C)C 7a_100000151488_100000210206 [0,2,1,0,0,0|1,0,0]=4 5579 B15R1.944 COC(=O)c1ccc(cc1)CSC(C)C 62a_100000210206_100000187170 [0,2,1,0,0,0|1,0,0]=4 5580 B15R1.944 COC(=O)c1ccc(cc1)CSC(C)C 62a_100000735637_100000210206 [0,2,1,0,0,0|1,0,0]=4 5581 B15R1.944 COC(=O)c1ccc(cc1)OCC(=O)N 34a_100000150123_100000187820 [0,2,1,0,0,0|0,0,1]=4 5582 B15R1.944 COC(=O)c1ccc(cc1)OCC(=O)N 7a_100000150123_100000187820 [0,2,1,0,0,0|0,0,1]=4 5583 B15R1.944 COC(=O)c1ccc(cc1)OCC(C)C 34a_100000150123_100000210624 [0,2,1,0,0,0|1,0,0]=4 5584 B15R1.944 COC(=O)c1ccc(cc1)OCC(C)C 7a_100000150123_100000210760 [0,2,1,0,0,0|1,0,0]=4 5585 B15R1.944 COC(=O)c1ccc(cc1)OCC(C)O 34a_100000150123_100011218427 [0,2,1,0,0,0|1,0,0]=4 5586 B15R1.944 COC(=O)c1ccc(cc1)OCC(C)O 7a_100000150123_100011218427 [0,2,1,0,0,0|1,0,0]=4 5587 B15R1.944 COC(=O)c1ccc(cc1)OCC(F)F 34a_100000150123_100011934356 [0,2,1,0,0,0|1,0,0]=4 5588 B15R1.944 COC(=O)c1ccc(cc1)OCC(F)F 7a_100000150123_100011934356 [0,2,1,0,0,0|1,0,0]=4 5589 B15R1.944 COC(=O)c1ccc(cc1)OC[C@@H](C)O 34a_100000150123_100009817552 [0,2,1,0,0,0|1,0,0]=4 5590 B15R1.944 COC(=O)c1ccc(cc1)OC[C@@H](C)O 7a_100000150123_100009817552 [0,2,1,0,0,0|1,0,0]=4 5591 B15R1.944 COC(=O)c1ccc(cc1)SCC(=O)N 62a_100000150774_100000747473 [0,2,1,0,0,0|0,0,1]=4 5592 B15R1.944 COC(=O)c1ccc(cc1)SCC(=O)N 62a_100000747473_100000150774 [0,2,1,0,0,0|0,0,1]=4 5593 B15R1.944 COC(=O)c1ccc(cc1)SCC(C)C 62a_100000150774_100000210760 [0,2,1,0,0,0|1,0,0]=4 5594 B15R1.944 COC(=O)c1ccc(cc1)SCC(C)C 62a_100000210624_100000150774 [0,2,1,0,0,0|1,0,0]=4 5595 B15R1.944 COC(=O)c1ccc(cc1)SCC(C)O 62a_100000150774_100011218427 [0,2,1,0,0,0|1,0,0]=4 5596 B15R1.944 COC(=O)c1ccc(cc1)SCC(C)O 62a_100011218427_100000150774 [0,2,1,0,0,0|1,0,0]=4 5597 B15R1.944 COC(=O)c1ccc(cc1)SCC(F)F 62a_100000150774_100011934356 [0,2,1,0,0,0|1,0,0]=4 5598 B15R1.944 COC(=O)c1ccc(cc1)SCC(F)F 62a_100011934356_100000150774 [0,2,1,0,0,0|1,0,0]=4 5599 B15R1.944 COC(=O)c1ccc(cc1)SC[C@@H](C)O 62a_100000150774_100009817552 [0,2,1,0,0,0|1,0,0]=4 5600 B15R1.944 COC(=O)c1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000150774 [0,2,1,0,0,0|1,0,0]=4 5601 B15R1.1056 CCCCc1ccc(c(c1)Br)C(=O)OC 271570a_100020621405_100010247156 [0,2,1,0,0,0|1,0,0]=4 5602 B15R1.1056 CCCCc1ccc(c(c1)C)C(=O)OC 271570a_100020621405_100000747612 [0,2,1,0,0,0|1,0,0]=4 5603 B15R1.1056 CCCCc1ccc(c(c1)Cl)C(=O)OC 271570a_100020621405_100000060724 [0,2,1,0,0,0|1,0,0]=4 5604 B15R1.1056 CCCCc1ccc(c(c1)F)C(=O)OC 271570a_100020621405_100000216654 [0,2,1,0,0,0|1,0,0]=4 5605 B15R1.1056 CCCCc1ccc(c(c1)N)C(=O)OC 271570a_100020621405_100011373473 [0,2,1,0,0,0|1,0,0]=4 5606 B15R1.1056 CCCCc1ccc(c(c1)O)C(=O)OC 271570a_100020621405_100000062286 [0,2,1,0,0,0|1,0,0]=4 5607 B15R1.1056 CCCOc1ccc(c(c1)Br)C(=O)OC 34a_100010150825_100000210303 [0,2,1,0,0,0|1,0,0]=4 5608 B15R1.1056 CCCOc1ccc(c(c1)Br)C(=O)OC 7a_100010150825_100000210303 [0,2,1,0,0,0|1,0,0]=4 5609 B15R1.1056 CCCOc1ccc(c(c1)C)C(=O)OC 34a_100012000157_100000210303 [0,2,1,0,0,0|1,0,0]=4 5610 B15R1.1056 CCCOc1ccc(c(c1)C)C(=O)OC 7a_100012000157_100000210303 [0,2,1,0,0,0|1,0,0]=4 5611 B15R1.1056 CCCOc1ccc(c(c1)Cl)C(=O)OC 34a_100000081488_100000210303 [0,2,1,0,0,0|1,0,0]=4 5612 B15R1.1056 CCCOc1ccc(c(c1)Cl)C(=O)OC 7a_100000081488_100000210303 [0,2,1,0,0,0|1,0,0]=4 5613 B15R1.1056 CCCOc1ccc(c(c1)F)C(=O)OC 34a_100011999631_100000210303 [0,2,1,0,0,0|1,0,0]=4 5614 B15R1.1056 CCCOc1ccc(c(c1)F)C(=O)OC 7a_100011999631_100000210303 [0,2,1,0,0,0|1,0,0]=4 5615 B15R1.1056 CCCOc1ccc(c(c1)N)C(=O)OC 34a_100000701581_100000210303 [0,2,1,0,0,0|1,0,0]=4 5616 B15R1.1056 CCCOc1ccc(c(c1)N)C(=O)OC 7a_100000701581_100000210303 [0,2,1,0,0,0|1,0,0]=4 5617 B15R1.1056 CCCSc1ccc(c(c1)Br)C(=O)OC 62a_100000210303_100010247156 [0,2,1,0,0,0|1,0,0]=4 5618 B15R1.1056 CCCSc1ccc(c(c1)Br)C(=O)OC 62a_100010247156_100000210303 [0,2,1,0,0,0|1,0,0]=4 5619 B15R1.1056 CCCSc1ccc(c(c1)C)C(=O)OC 62a_100000210303_100000747612 [0,2,1,0,0,0|1,0,0]=4 5620 B15R1.1056 CCCSc1ccc(c(c1)C)C(=O)OC 62a_100000747612_100000210303 [0,2,1,0,0,0|1,0,0]=4 5621 B15R1.1056 CCCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000060724_100000210303 [0,2,1,0,0,0|1,0,0]=4 5622 B15R1.1056 CCCSc1ccc(c(c1)Cl)C(=O)OC 62a_100000210303_100000060724 [0,2,1,0,0,0|1,0,0]=4 5623 B15R1.1056 CCCSc1ccc(c(c1)F)C(=O)OC 62a_100000210303_100000216654 [0,2,1,0,0,0|1,0,0]=4 5624 B15R1.1056 CCCSc1ccc(c(c1)F)C(=O)OC 62a_100000216654_100000210303 [0,2,1,0,0,0|1,0,0]=4 5625 B15R1.1056 CCCSc1ccc(c(c1)N)C(=O)OC 62a_100011373473_100000210303 [0,2,1,0,0,0|1,0,0]=4 5626 B15R1.1056 CCCSc1ccc(c(c1)O)C(=O)OC 62a_100000210303_100000062286 [0,2,1,0,0,0|1,0,0]=4 5627 B15R1.1056 CCNCc1ccc(c(c1)Br)C(=O)OC 2230a_100015525214_100012340598 [0,2,1,0,0,0|1,0,0]=4 5628 B15R1.1056 CCNCc1ccc(c(c1)C)C(=O)OC 2230a_100015525214_100010991300 [0,2,1,0,0,0|1,0,0]=4 5629 B15R1.1056 CCNCc1ccc(c(c1)C)C(=O)OC 270004a_100015525214_100010370968 [0,2,1,0,0,0|1,0,0]=4 5630 B15R1.1056 CCNCc1ccc(c(c1)Cl)C(=O)OC 2230a_100015525214_100010128985 [0,2,1,0,0,0|1,0,0]=4 5631 B15R1.1056 CCNCc1ccc(c(c1)Cl)C(=O)OC 270004a_100015525214_100010630601 [0,2,1,0,0,0|1,0,0]=4 5632 B15R1.1056 CCNCc1ccc(c(c1)F)C(=O)OC 2230a_100015525214_100000686969 [0,2,1,0,0,0|1,0,0]=4 5633 B15R1.1056 CCNCc1ccc(c(c1)F)C(=O)OC 270004a_100015525214_100012457946 [0,2,1,0,0,0|1,0,0]=4 5634 B15R1.1056 CCOCc1ccc(c(c1)Br)C(=O)OC 34a_100121572206_100012340598 [0,2,1,0,0,0|1,0,0]=4 5635 B15R1.1056 CCOCc1ccc(c(c1)C)C(=O)OC 34a_100121572206_100010991300 [0,2,1,0,0,0|1,0,0]=4 5636 B15R1.1056 CCOCc1ccc(c(c1)Cl)C(=O)OC 34a_100121572206_100010128985 [0,2,1,0,0,0|1,0,0]=4 5637 B15R1.1056 CCOCc1ccc(c(c1)F)C(=O)OC 34a_100012183857_100000210202 [0,2,1,0,0,0|1,0,0]=4 5638 B15R1.1056 CCOCc1ccc(c(c1)F)C(=O)OC 34a_100121572206_100000686969 [0,2,1,0,0,0|1,0,0]=4 5639 B15R1.1056 CCOCc1ccc(c(c1)F)C(=O)OC 7a_100012183857_100000210202 [0,2,1,0,0,0|1,0,0]=4 5640 B15R1.1056 CCSCc1ccc(c(c1)Br)C(=O)OC 62a_100000210202_100012340598 [0,2,1,0,0,0|1,0,0]=4 5641 B15R1.1056 CCSCc1ccc(c(c1)Br)C(=O)OC 62a_100012340598_100000210202 [0,2,1,0,0,0|1,0,0]=4 5642 B15R1.1056 CCSCc1ccc(c(c1)C)C(=O)OC 62a_100000210202_100010991300 [0,2,1,0,0,0|1,0,0]=4 5643 B15R1.1056 CCSCc1ccc(c(c1)C)C(=O)OC 62a_100010991300_100000210202 [0,2,1,0,0,0|1,0,0]=4 5644 B15R1.1056 CCSCc1ccc(c(c1)Cl)C(=O)OC 62a_100000210202_100010128985 [0,2,1,0,0,0|1,0,0]=4 5645 B15R1.1056 CCSCc1ccc(c(c1)Cl)C(=O)OC 62a_100010128985_100000210202 [0,2,1,0,0,0|1,0,0]=4 5646 B15R1.1056 CCSCc1ccc(c(c1)F)C(=O)OC 62a_100000210202_100000686969 [0,2,1,0,0,0|1,0,0]=4 5647 B15R1.1056 CCSCc1ccc(c(c1)F)C(=O)OC 62a_100000686969_100000210202 [0,2,1,0,0,0|1,0,0]=4 5648 B15R1.1056 COC(=O)c1ccc(cc1Br)CSCF 62a_100012340598_100015361967 [0,2,1,0,0,0|1,0,0]=4 5649 B15R1.1056 COC(=O)c1ccc(cc1Br)CSCF 62a_100015361967_100012340598 [0,2,1,0,0,0|1,0,0]=4 5650 B15R1.1056 COC(=O)c1ccc(cc1Br)OCCF 34a_100010150825_100011217306 [0,2,1,0,0,0|1,0,0]=4 5651 B15R1.1056 COC(=O)c1ccc(cc1Br)OCCF 7a_100010150825_100011217306 [0,2,1,0,0,0|1,0,0]=4 5652 B15R1.1056 COC(=O)c1ccc(cc1Br)OCCO 34a_100010150825_100000211926 [0,2,1,0,0,0|1,0,0]=4 5653 B15R1.1056 COC(=O)c1ccc(cc1Br)OCCO 7a_100010150825_100000211926 [0,2,1,0,0,0|1,0,0]=4 5654 B15R1.1056 COC(=O)c1ccc(cc1Br)SCCF 62a_100010247156_100011217306 [0,2,1,0,0,0|1,0,0]=4 5655 B15R1.1056 COC(=O)c1ccc(cc1Br)SCCF 62a_100011217306_100010247156 [0,2,1,0,0,0|1,0,0]=4 5656 B15R1.1056 COC(=O)c1ccc(cc1Br)SCCO 62a_100000211926_100010247156 [0,2,1,0,0,0|1,0,0]=4 5657 B15R1.1056 COC(=O)c1ccc(cc1Br)SCCO 62a_100010247156_100000211926 [0,2,1,0,0,0|1,0,0]=4 5658 B15R1.1056 COC(=O)c1ccc(cc1C)CSCF 62a_100010991300_100015361967 [0,2,1,0,0,0|1,0,0]=4 5659 B15R1.1056 COC(=O)c1ccc(cc1C)CSCF 62a_100015361967_100010991300 [0,2,1,0,0,0|1,0,0]=4 5660 B15R1.1056 COC(=O)c1ccc(cc1C)OCCF 34a_100012000157_100011217306 [0,2,1,0,0,0|1,0,0]=4 5661 B15R1.1056 COC(=O)c1ccc(cc1C)OCCF 7a_100012000157_100011217306 [0,2,1,0,0,0|1,0,0]=4 5662 B15R1.1056 COC(=O)c1ccc(cc1C)OCCO 34a_100012000157_100000211926 [0,2,1,0,0,0|1,0,0]=4 5663 B15R1.1056 COC(=O)c1ccc(cc1C)OCCO 7a_100012000157_100000211926 [0,2,1,0,0,0|1,0,0]=4 5664 B15R1.1056 COC(=O)c1ccc(cc1C)SCCF 62a_100000747612_100011217306 [0,2,1,0,0,0|1,0,0]=4 5665 B15R1.1056 COC(=O)c1ccc(cc1C)SCCF 62a_100011217306_100000747612 [0,2,1,0,0,0|1,0,0]=4 5666 B15R1.1056 COC(=O)c1ccc(cc1C)SCCO 62a_100000211926_100000747612 [0,2,1,0,0,0|1,0,0]=4 5667 B15R1.1056 COC(=O)c1ccc(cc1C)SCCO 62a_100000747612_100000211926 [0,2,1,0,0,0|1,0,0]=4 5668 B15R1.1056 COC(=O)c1ccc(cc1Cl)CSCF 62a_100010128985_100015361967 [0,2,1,0,0,0|1,0,0]=4 5669 B15R1.1056 COC(=O)c1ccc(cc1Cl)CSCF 62a_100015361967_100010128985 [0,2,1,0,0,0|1,0,0]=4 5670 B15R1.1056 COC(=O)c1ccc(cc1Cl)OCCF 34a_100000081488_100011217306 [0,2,1,0,0,0|1,0,0]=4 5671 B15R1.1056 COC(=O)c1ccc(cc1Cl)OCCF 7a_100000081488_100011217306 [0,2,1,0,0,0|1,0,0]=4 5672 B15R1.1056 COC(=O)c1ccc(cc1Cl)OCCO 34a_100000081488_100000211926 [0,2,1,0,0,0|1,0,0]=4 5673 B15R1.1056 COC(=O)c1ccc(cc1Cl)OCCO 7a_100000081488_100000211926 [0,2,1,0,0,0|1,0,0]=4 5674 B15R1.1056 COC(=O)c1ccc(cc1Cl)SCCF 62a_100000060724_100011217306 [0,2,1,0,0,0|1,0,0]=4 5675 B15R1.1056 COC(=O)c1ccc(cc1Cl)SCCF 62a_100011217306_100000060724 [0,2,1,0,0,0|1,0,0]=4 5676 B15R1.1056 COC(=O)c1ccc(cc1Cl)SCCO 62a_100000060724_100000211926 [0,2,1,0,0,0|1,0,0]=4 5677 B15R1.1056 COC(=O)c1ccc(cc1Cl)SCCO 62a_100000211926_100000060724 [0,2,1,0,0,0|1,0,0]=4 5678 B15R1.1056 COC(=O)c1ccc(cc1F)COCF 34a_100012183857_100015361967 [0,2,1,0,0,0|1,0,0]=4 5679 B15R1.1056 COC(=O)c1ccc(cc1F)COCF 7a_100012183857_100015361967 [0,2,1,0,0,0|1,0,0]=4 5680 B15R1.1056 COC(=O)c1ccc(cc1F)CSCF 62a_100000686969_100015361967 [0,2,1,0,0,0|1,0,0]=4 5681 B15R1.1056 COC(=O)c1ccc(cc1F)CSCF 62a_100015361967_100000686969 [0,2,1,0,0,0|1,0,0]=4 5682 B15R1.1056 COC(=O)c1ccc(cc1F)OCCF 34a_100011999631_100011217306 [0,2,1,0,0,0|1,0,0]=4 5683 B15R1.1056 COC(=O)c1ccc(cc1F)OCCF 7a_100011999631_100011217306 [0,2,1,0,0,0|1,0,0]=4 5684 B15R1.1056 COC(=O)c1ccc(cc1F)OCCO 34a_100011999631_100000211926 [0,2,1,0,0,0|1,0,0]=4 5685 B15R1.1056 COC(=O)c1ccc(cc1F)OCCO 7a_100011999631_100000211926 [0,2,1,0,0,0|1,0,0]=4 5686 B15R1.1056 COC(=O)c1ccc(cc1F)SCCF 62a_100000216654_100011217306 [0,2,1,0,0,0|1,0,0]=4 5687 B15R1.1056 COC(=O)c1ccc(cc1F)SCCF 62a_100011217306_100000216654 [0,2,1,0,0,0|1,0,0]=4 5688 B15R1.1056 COC(=O)c1ccc(cc1F)SCCO 62a_100000211926_100000216654 [0,2,1,0,0,0|1,0,0]=4 5689 B15R1.1056 COC(=O)c1ccc(cc1F)SCCO 62a_100000216654_100000211926 [0,2,1,0,0,0|1,0,0]=4 5690 B15R1.1056 COC(=O)c1ccc(cc1N)OCCF 34a_100000701581_100011217306 [0,2,1,0,0,0|1,0,0]=4 5691 B15R1.1056 COC(=O)c1ccc(cc1N)OCCF 7a_100000701581_100011217306 [0,2,1,0,0,0|1,0,0]=4 5692 B15R1.1056 COC(=O)c1ccc(cc1N)OCCO 34a_100000701581_100000211926 [0,2,1,0,0,0|1,0,0]=4 5693 B15R1.1056 COC(=O)c1ccc(cc1N)OCCO 7a_100000701581_100000211926 [0,2,1,0,0,0|1,0,0]=4 5694 B15R1.1056 COC(=O)c1ccc(cc1N)SCCF 62a_100011373473_100011217306 [0,2,1,0,0,0|1,0,0]=4 5695 B15R1.1056 COC(=O)c1ccc(cc1N)SCCO 62a_100011373473_100000211926 [0,2,1,0,0,0|1,0,0]=4 5696 B15R1.1056 COC(=O)c1ccc(cc1O)SCCF 62a_100011217306_100000062286 [0,2,1,0,0,0|1,0,0]=4 5697 B15R1.1056 COC(=O)c1ccc(cc1O)SCCO 62a_100000211926_100000062286 [0,2,1,0,0,0|1,0,0]=4 5698 B15R1.12061 CCCCc1ccc(cc1Br)C(=O)OC 271570a_100020621405_100011294788 [0,2,1,0,0,0|1,0,0]=4 5699 B15R1.12061 CCCCc1ccc(cc1C)C(=O)OC 271570a_100020621405_100011215878 [0,2,1,0,0,0|1,0,0]=4 5700 B15R1.12061 CCCCc1ccc(cc1Cl)C(=O)OC 271570a_100020621405_100012356344 [0,2,1,0,0,0|1,0,0]=4 5701 B15R1.12061 CCCCc1ccc(cc1F)C(=O)OC 271570a_100020621405_100000703229 [0,2,1,0,0,0|1,0,0]=4 5702 B15R1.12061 CCCCc1ccc(cc1N)C(=O)OC 271570a_100020621405_100011450966 [0,2,1,0,0,0|1,0,0]=4 5703 B15R1.12061 CCCCc1ccc(cc1O)C(=O)OC 271570a_100020621405_100012350776 [0,2,1,0,0,0|1,0,0]=4 5704 B15R1.12061 CCCOc1ccc(cc1Br)C(=O)OC 34a_100000216328_100000210303 [0,2,1,0,0,0|1,0,0]=4 5705 B15R1.12061 CCCOc1ccc(cc1Br)C(=O)OC 7a_100000216328_100000210303 [0,2,1,0,0,0|1,0,0]=4 5706 B15R1.12061 CCCOc1ccc(cc1C)C(=O)OC 34a_100011997373_100000210303 [0,2,1,0,0,0|1,0,0]=4 5707 B15R1.12061 CCCOc1ccc(cc1C)C(=O)OC 7a_100011997373_100000210303 [0,2,1,0,0,0|1,0,0]=4 5708 B15R1.12061 CCCOc1ccc(cc1Cl)C(=O)OC 34a_100000151454_100000210303 [0,2,1,0,0,0|1,0,0]=4 5709 B15R1.12061 CCCOc1ccc(cc1Cl)C(=O)OC 7a_100000151454_100000210303 [0,2,1,0,0,0|1,0,0]=4 5710 B15R1.12061 CCCOc1ccc(cc1F)C(=O)OC 34a_100000075456_100000210303 [0,2,1,0,0,0|1,0,0]=4 5711 B15R1.12061 CCCOc1ccc(cc1F)C(=O)OC 7a_100000075456_100000210303 [0,2,1,0,0,0|1,0,0]=4 5712 B15R1.12061 CCCOc1ccc(cc1I)C(=O)OC 34a_100010162523_100000210303 [0,2,1,0,0,0|1,0,0]=4 5713 B15R1.12061 CCCOc1ccc(cc1I)C(=O)OC 7a_100010162523_100000210303 [0,2,1,0,0,0|1,0,0]=4 5714 B15R1.12061 CCCOc1ccc(cc1N)C(=O)OC 34a_100000724433_100000210303 [0,2,1,0,0,0|1,0,0]=4 5715 B15R1.12061 CCCOc1ccc(cc1N)C(=O)OC 7a_100000724433_100000210303 [0,2,1,0,0,0|1,0,0]=4 5716 B15R1.12061 CCCSc1ccc(cc1Br)C(=O)OC 62a_100000210303_100011294788 [0,2,1,0,0,0|1,0,0]=4 5717 B15R1.12061 CCCSc1ccc(cc1Br)C(=O)OC 62a_100011294788_100000210303 [0,2,1,0,0,0|1,0,0]=4 5718 B15R1.12061 CCCSc1ccc(cc1C)C(=O)OC 62a_100000210303_100011215878 [0,2,1,0,0,0|1,0,0]=4 5719 B15R1.12061 CCCSc1ccc(cc1C)C(=O)OC 62a_100011215878_100000210303 [0,2,1,0,0,0|1,0,0]=4 5720 B15R1.12061 CCCSc1ccc(cc1Cl)C(=O)OC 62a_100000210303_100012356344 [0,2,1,0,0,0|1,0,0]=4 5721 B15R1.12061 CCCSc1ccc(cc1Cl)C(=O)OC 62a_100012356344_100000210303 [0,2,1,0,0,0|1,0,0]=4 5722 B15R1.12061 CCCSc1ccc(cc1F)C(=O)OC 62a_100000210303_100000703229 [0,2,1,0,0,0|1,0,0]=4 5723 B15R1.12061 CCCSc1ccc(cc1F)C(=O)OC 62a_100000703229_100000210303 [0,2,1,0,0,0|1,0,0]=4 5724 B15R1.12061 CCCSc1ccc(cc1N)C(=O)OC 62a_100000210303_100011450966 [0,2,1,0,0,0|1,0,0]=4 5725 B15R1.12061 CCCSc1ccc(cc1N)C(=O)OC 62a_100011450966_100000210303 [0,2,1,0,0,0|1,0,0]=4 5726 B15R1.12061 CCCSc1ccc(cc1O)C(=O)OC 62a_100000210303_100012350776 [0,2,1,0,0,0|1,0,0]=4 5727 B15R1.12061 CCCSc1ccc(cc1O)C(=O)OC 62a_100012350776_100000210303 [0,2,1,0,0,0|1,0,0]=4 5728 B15R1.12061 CCNCc1ccc(cc1Br)C(=O)OC 2230a_100015525214_100010201862 [0,2,1,0,0,0|1,0,0]=4 5729 B15R1.12061 CCNCc1ccc(cc1Br)C(=O)OC 270004a_100015525214_100000727569 [0,2,1,0,0,0|1,0,0]=4 5730 B15R1.12061 CCNCc1ccc(cc1C)C(=O)OC 270004a_100015525214_100010289884 [0,2,1,0,0,0|1,0,0]=4 5731 B15R1.12061 CCNCc1ccc(cc1Cl)C(=O)OC 2230a_100015525214_100012194053 [0,2,1,0,0,0|1,0,0]=4 5732 B15R1.12061 CCNCc1ccc(cc1Cl)C(=O)OC 270004a_100015525214_100012179231 [0,2,1,0,0,0|1,0,0]=4 5733 B15R1.12061 CCNCc1ccc(cc1F)C(=O)OC 2230a_100015525214_100000694138 [0,2,1,0,0,0|1,0,0]=4 5734 B15R1.12061 CCNCc1ccc(cc1F)C(=O)OC 270004a_100015525214_100012178685 [0,2,1,0,0,0|1,0,0]=4 5735 B15R1.12061 CCOCc1ccc(cc1Br)C(=O)OC 34a_100012355398_100000210202 [0,2,1,0,0,0|1,0,0]=4 5736 B15R1.12061 CCOCc1ccc(cc1Br)C(=O)OC 34a_100121572206_100010201862 [0,2,1,0,0,0|1,0,0]=4 5737 B15R1.12061 CCOCc1ccc(cc1Br)C(=O)OC 7a_100012355398_100000210202 [0,2,1,0,0,0|1,0,0]=4 5738 B15R1.12061 CCOCc1ccc(cc1Cl)C(=O)OC 34a_100121572206_100012194053 [0,2,1,0,0,0|1,0,0]=4 5739 B15R1.12061 CCOCc1ccc(cc1F)C(=O)OC 34a_100000094453_100000210202 [0,2,1,0,0,0|1,0,0]=4 5740 B15R1.12061 CCOCc1ccc(cc1F)C(=O)OC 34a_100121572206_100000694138 [0,2,1,0,0,0|1,0,0]=4 5741 B15R1.12061 CCOCc1ccc(cc1F)C(=O)OC 7a_100000094453_100000210202 [0,2,1,0,0,0|1,0,0]=4 5742 B15R1.12061 CCSCc1ccc(cc1Br)C(=O)OC 62a_100000210202_100010201862 [0,2,1,0,0,0|1,0,0]=4 5743 B15R1.12061 CCSCc1ccc(cc1Br)C(=O)OC 62a_100010201862_100000210202 [0,2,1,0,0,0|1,0,0]=4 5744 B15R1.12061 CCSCc1ccc(cc1Cl)C(=O)OC 62a_100000210202_100012194053 [0,2,1,0,0,0|1,0,0]=4 5745 B15R1.12061 CCSCc1ccc(cc1Cl)C(=O)OC 62a_100012194053_100000210202 [0,2,1,0,0,0|1,0,0]=4 5746 B15R1.12061 CCSCc1ccc(cc1F)C(=O)OC 62a_100000210202_100000694138 [0,2,1,0,0,0|1,0,0]=4 5747 B15R1.12061 CCSCc1ccc(cc1F)C(=O)OC 62a_100000694138_100000210202 [0,2,1,0,0,0|1,0,0]=4 5748 B15R1.12061 COC(=O)c1ccc(c(c1)Br)COCF 34a_100012355398_100015361967 [0,2,1,0,0,0|1,0,0]=4 5749 B15R1.12061 COC(=O)c1ccc(c(c1)Br)COCF 7a_100012355398_100015361967 [0,2,1,0,0,0|1,0,0]=4 5750 B15R1.12061 COC(=O)c1ccc(c(c1)Br)CSCF 62a_100010201862_100015361967 [0,2,1,0,0,0|1,0,0]=4 5751 B15R1.12061 COC(=O)c1ccc(c(c1)Br)CSCF 62a_100015361967_100010201862 [0,2,1,0,0,0|1,0,0]=4 5752 B15R1.12061 COC(=O)c1ccc(c(c1)Br)OCCF 34a_100000216328_100011217306 [0,2,1,0,0,0|1,0,0]=4 5753 B15R1.12061 COC(=O)c1ccc(c(c1)Br)OCCF 7a_100000216328_100011217306 [0,2,1,0,0,0|1,0,0]=4 5754 B15R1.12061 COC(=O)c1ccc(c(c1)Br)OCCO 34a_100000216328_100000211926 [0,2,1,0,0,0|1,0,0]=4 5755 B15R1.12061 COC(=O)c1ccc(c(c1)Br)OCCO 7a_100000216328_100000211926 [0,2,1,0,0,0|1,0,0]=4 5756 B15R1.12061 COC(=O)c1ccc(c(c1)Br)SCCF 62a_100011217306_100011294788 [0,2,1,0,0,0|1,0,0]=4 5757 B15R1.12061 COC(=O)c1ccc(c(c1)Br)SCCF 62a_100011294788_100011217306 [0,2,1,0,0,0|1,0,0]=4 5758 B15R1.12061 COC(=O)c1ccc(c(c1)Br)SCCO 62a_100000211926_100011294788 [0,2,1,0,0,0|1,0,0]=4 5759 B15R1.12061 COC(=O)c1ccc(c(c1)Br)SCCO 62a_100011294788_100000211926 [0,2,1,0,0,0|1,0,0]=4 5760 B15R1.12061 COC(=O)c1ccc(c(c1)C)OCCF 34a_100011997373_100011217306 [0,2,1,0,0,0|1,0,0]=4 5761 B15R1.12061 COC(=O)c1ccc(c(c1)C)OCCF 7a_100011997373_100011217306 [0,2,1,0,0,0|1,0,0]=4 5762 B15R1.12061 COC(=O)c1ccc(c(c1)C)OCCO 34a_100011997373_100000211926 [0,2,1,0,0,0|1,0,0]=4 5763 B15R1.12061 COC(=O)c1ccc(c(c1)C)OCCO 7a_100011997373_100000211926 [0,2,1,0,0,0|1,0,0]=4 5764 B15R1.12061 COC(=O)c1ccc(c(c1)C)SCCF 62a_100011215878_100011217306 [0,2,1,0,0,0|1,0,0]=4 5765 B15R1.12061 COC(=O)c1ccc(c(c1)C)SCCF 62a_100011217306_100011215878 [0,2,1,0,0,0|1,0,0]=4 5766 B15R1.12061 COC(=O)c1ccc(c(c1)C)SCCO 62a_100000211926_100011215878 [0,2,1,0,0,0|1,0,0]=4 5767 B15R1.12061 COC(=O)c1ccc(c(c1)C)SCCO 62a_100011215878_100000211926 [0,2,1,0,0,0|1,0,0]=4 5768 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)CSCF 62a_100012194053_100015361967 [0,2,1,0,0,0|1,0,0]=4 5769 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)CSCF 62a_100015361967_100012194053 [0,2,1,0,0,0|1,0,0]=4 5770 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)OCCF 34a_100000151454_100011217306 [0,2,1,0,0,0|1,0,0]=4 5771 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)OCCF 7a_100000151454_100011217306 [0,2,1,0,0,0|1,0,0]=4 5772 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)OCCO 34a_100000151454_100000211926 [0,2,1,0,0,0|1,0,0]=4 5773 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)OCCO 7a_100000151454_100000211926 [0,2,1,0,0,0|1,0,0]=4 5774 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)SCCF 62a_100011217306_100012356344 [0,2,1,0,0,0|1,0,0]=4 5775 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)SCCF 62a_100012356344_100011217306 [0,2,1,0,0,0|1,0,0]=4 5776 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)SCCO 62a_100000211926_100012356344 [0,2,1,0,0,0|1,0,0]=4 5777 B15R1.12061 COC(=O)c1ccc(c(c1)Cl)SCCO 62a_100012356344_100000211926 [0,2,1,0,0,0|1,0,0]=4 5778 B15R1.12061 COC(=O)c1ccc(c(c1)F)COCF 34a_100000094453_100015361967 [0,2,1,0,0,0|1,0,0]=4 5779 B15R1.12061 COC(=O)c1ccc(c(c1)F)COCF 7a_100000094453_100015361967 [0,2,1,0,0,0|1,0,0]=4 5780 B15R1.12061 COC(=O)c1ccc(c(c1)F)CSCF 62a_100000694138_100015361967 [0,2,1,0,0,0|1,0,0]=4 5781 B15R1.12061 COC(=O)c1ccc(c(c1)F)CSCF 62a_100015361967_100000694138 [0,2,1,0,0,0|1,0,0]=4 5782 B15R1.12061 COC(=O)c1ccc(c(c1)F)OCCF 34a_100000075456_100011217306 [0,2,1,0,0,0|1,0,0]=4 5783 B15R1.12061 COC(=O)c1ccc(c(c1)F)OCCF 7a_100000075456_100011217306 [0,2,1,0,0,0|1,0,0]=4 5784 B15R1.12061 COC(=O)c1ccc(c(c1)F)OCCO 34a_100000075456_100000211926 [0,2,1,0,0,0|1,0,0]=4 5785 B15R1.12061 COC(=O)c1ccc(c(c1)F)OCCO 7a_100000075456_100000211926 [0,2,1,0,0,0|1,0,0]=4 5786 B15R1.12061 COC(=O)c1ccc(c(c1)F)SCCF 62a_100000703229_100011217306 [0,2,1,0,0,0|1,0,0]=4 5787 B15R1.12061 COC(=O)c1ccc(c(c1)F)SCCF 62a_100011217306_100000703229 [0,2,1,0,0,0|1,0,0]=4 5788 B15R1.12061 COC(=O)c1ccc(c(c1)F)SCCO 62a_100000211926_100000703229 [0,2,1,0,0,0|1,0,0]=4 5789 B15R1.12061 COC(=O)c1ccc(c(c1)F)SCCO 62a_100000703229_100000211926 [0,2,1,0,0,0|1,0,0]=4 5790 B15R1.12061 COC(=O)c1ccc(c(c1)I)OCCF 34a_100010162523_100011217306 [0,2,1,0,0,0|1,0,0]=4 5791 B15R1.12061 COC(=O)c1ccc(c(c1)I)OCCF 7a_100010162523_100011217306 [0,2,1,0,0,0|1,0,0]=4 5792 B15R1.12061 COC(=O)c1ccc(c(c1)I)OCCO 34a_100010162523_100000211926 [0,2,1,0,0,0|1,0,0]=4 5793 B15R1.12061 COC(=O)c1ccc(c(c1)I)OCCO 7a_100010162523_100000211926 [0,2,1,0,0,0|1,0,0]=4 5794 B15R1.12061 COC(=O)c1ccc(c(c1)N)OCCF 34a_100000724433_100011217306 [0,2,1,0,0,0|1,0,0]=4 5795 B15R1.12061 COC(=O)c1ccc(c(c1)N)OCCF 7a_100000724433_100011217306 [0,2,1,0,0,0|1,0,0]=4 5796 B15R1.12061 COC(=O)c1ccc(c(c1)N)OCCO 34a_100000724433_100000211926 [0,2,1,0,0,0|1,0,0]=4 5797 B15R1.12061 COC(=O)c1ccc(c(c1)N)OCCO 7a_100000724433_100000211926 [0,2,1,0,0,0|1,0,0]=4 5798 B15R1.12061 COC(=O)c1ccc(c(c1)N)SCCF 62a_100011217306_100011450966 [0,2,1,0,0,0|1,0,0]=4 5799 B15R1.12061 COC(=O)c1ccc(c(c1)N)SCCF 62a_100011450966_100011217306 [0,2,1,0,0,0|1,0,0]=4 5800 B15R1.12061 COC(=O)c1ccc(c(c1)N)SCCO 62a_100000211926_100011450966 [0,2,1,0,0,0|1,0,0]=4 5801 B15R1.12061 COC(=O)c1ccc(c(c1)N)SCCO 62a_100011450966_100000211926 [0,2,1,0,0,0|1,0,0]=4 5802 B15R1.12061 COC(=O)c1ccc(c(c1)O)SCCF 62a_100011217306_100012350776 [0,2,1,0,0,0|1,0,0]=4 5803 B15R1.12061 COC(=O)c1ccc(c(c1)O)SCCF 62a_100012350776_100011217306 [0,2,1,0,0,0|1,0,0]=4 5804 B15R1.12061 COC(=O)c1ccc(c(c1)O)SCCO 62a_100000211926_100012350776 [0,2,1,0,0,0|1,0,0]=4 5805 B15R1.12061 COC(=O)c1ccc(c(c1)O)SCCO 62a_100012350776_100000211926 [0,2,1,0,0,0|1,0,0]=4 5806 B15R1.566 CCNc1cccc(c1)C(=O)NC(C)C 27a_100015525214_200000152632 [0,2,1,0,0,0|1,0,0]=4 5807 B15R1.566 CCNc1cccc(c1)C(=O)NC(C)C 34a_100000738563_100000210202 [0,2,1,0,0,0|1,0,0]=4 5808 B15R1.566 CCNc1cccc(c1)C(=O)NC(C)C 7a_100000738563_100000210202 [0,2,1,0,0,0|1,0,0]=4 5809 B15R1.576 CCNC(=O)c1cccc(c1C)NCC 34a_200011193780_100000210202 [0,2,1,0,0,0|1,0,0]=4 5810 B15R1.576 CCNC(=O)c1cccc(c1C)NCC 7a_200011193780_100000210202 [0,2,1,0,0,0|1,0,0]=4 5811 B15R1.576 CCOC(=O)c1cccc(c1C)OCC 7a_100012185227_100000210202 [0,2,1,0,0,0|1,0,0]=4 5812 B15R1.576 CCOC(=O)c1cccc(c1C)SCC 62a_100000210202_100012298221 [0,2,1,0,0,0|1,0,0]=4 5813 B15R1.576 CCOC(=O)c1cccc(c1C)SCC 62a_100012298221_100000210202 [0,2,1,0,0,0|1,0,0]=4 5814 B15R1.576 CCOC(=O)c1cccc(c1F)SCC 62a_100000210202_100012350793 [0,2,1,0,0,0|1,0,0]=4 5815 B15R1.576 CCOC(=O)c1cccc(c1F)SCC 62a_100012350793_100000210202 [0,2,1,0,0,0|1,0,0]=4 5816 B15R1.576 CCOC(=O)c1cccc(c1N)OCC 7a_100012001980_100000210202 [0,2,1,0,0,0|1,0,0]=4 5817 B15R1.576 CCOC(=O)c1cccc(c1N)SCC 62a_200011356557_100000210202 [0,2,1,0,0,0|1,0,0]=4 5818 B15R1.798 CCNC(=O)c1cccc(c1)NC(C)C 34a_100000181407_100000210206 [0,2,1,0,0,0|1,0,0]=4 5819 B15R1.798 CCNC(=O)c1cccc(c1)NC(C)C 7a_100000181407_100000210206 [0,2,1,0,0,0|1,0,0]=4 5820 B15R1.798 CCOC(=O)c1cccc(c1)NC(=O)C 188690a_100000204664_100015343762 [0,2,1,0,0,0|0,0,1]=4 5821 B15R1.798 CCOC(=O)c1cccc(c1)OC(C)C 7a_100000169910_100000210206 [0,2,1,0,0,0|1,0,0]=4 5822 B15R1.798 CCOC(=O)c1cccc(c1)SC(C)C 62a_100000170211_100000210206 [0,2,1,0,0,0|1,0,0]=4 5823 B15R1.798 CCOC(=O)c1cccc(c1)SC(C)C 62a_100000210206_100000170211 [0,2,1,0,0,0|1,0,0]=4 5824 B15R1.798 CCOC(=O)c1cccc(n1)NC(C)C 27a_100138425928_100000695914 [0,2,1,0,0,0|1,0,0]=4 5825 B15R1.799 CCCC(=O)c1cccc(c1)C(=O)OC 1458a_100000035267_100000210303 [0,2,1,0,0,0|1,0,0]=4 5826 B15R1.799 CCCN(C)c1cccc(n1)C(=O)OC 27a_100000747261_100000708286 [0,2,1,0,0,0|1,0,0]=4 5827 B15R1.799 CCNC(=O)c1cccc(c1)C(=O)OC 11a_100015525214_100000035267 [0,2,1,0,0,0|0,0,0]=3 5828 B15R1.799 CCNC(=O)c1cccc(c1)C(=O)OC 240690a_100015525214_100000035267 [0,2,1,0,0,0|0,0,0]=3 5829 B15R1.799 CCNC(=O)c1cccc(c1)C(=O)OC 527a_100015525214_100000035267 [0,2,1,0,0,0|0,0,0]=3 5830 B15R1.799 CNCC(=O)c1cccc(c1)C(=O)OC 2230a_106832991635_100009888909 [0,2,1,0,0,0|1,0,0]=4 5831 B15R1.799 CNCC(=O)c1cccc(c1)C(=O)OC 7a_106832991635_100009888909 [0,2,1,0,0,0|1,0,0]=4 5832 B15R1.799 CNNC(=O)c1cccc(c1)C(=O)OC 22a_100016993582_100000035267 [0,2,1,0,0,0|1,0,0]=4 5833 B15R1.799 COC(=O)c1cccc(c1)C(=O)CCF 1458a_100000035267_100011217306 [0,2,1,0,0,0|1,0,0]=4 5834 B15R1.799 COC(=O)c1cccc(c1)C(=O)CCO 1458a_100000035267_100000211926 [0,2,1,0,0,0|1,0,0]=4 5835 B15R1.799 COC(=O)c1cccc(c1)C(=O)CSC 62a_100009888909_200000210301 [0,2,1,0,0,0|1,0,0]=4 5836 B15R1.799 COC(=O)c1cccc(c1)C(=O)CSC 62a_200000210301_100009888909 [0,2,1,0,0,0|1,0,0]=4 5837 B15R1.799 COC(=O)c1cccc(c1)C(=O)CS[13CH3] 62a_100009888909_200025704644 [0,2,1,0,0,0|1,0,0]=4 5838 B15R1.799 COC(=O)c1cccc(c1)C(=O)CS[13CH3] 62a_200025704644_100009888909 [0,2,1,0,0,0|1,0,0]=4 5839 B15R1.799 COC(=O)c1cccc(n1)N(C)CCO 27a_100000210263_100000708286 [0,2,1,0,0,0|1,0,0]=4 5840 B15R1.1039 CCCCc1cccc(c1)C(=O)OCC 271570a_100020621405_100000170211 [0,2,1,0,0,0|1,0,0]=4 5841 B15R1.1039 CCCNc1cccc(c1)C(=O)NCC 34a_100000181407_100000210303 [0,2,1,0,0,0|1,0,0]=4 5842 B15R1.1039 CCCNc1cccc(c1)C(=O)NCC 7a_100000181407_100000210303 [0,2,1,0,0,0|1,0,0]=4 5843 B15R1.1039 CCCOc1cccc(c1)C(=O)OCC 7a_100000169910_100000210303 [0,2,1,0,0,0|1,0,0]=4 5844 B15R1.1039 CCCSc1cccc(c1)C(=O)OCC 62a_100000170211_100000210303 [0,2,1,0,0,0|1,0,0]=4 5845 B15R1.1039 CCCSc1cccc(c1)C(=O)OCC 62a_100000210303_100000170211 [0,2,1,0,0,0|1,0,0]=4 5846 B15R1.1039 CCNC(=O)c1cccc(c1)NCCF 34a_100000181407_100011217306 [0,2,1,0,0,0|1,0,0]=4 5847 B15R1.1039 CCNC(=O)c1cccc(c1)NCCF 7a_100000181407_100011217306 [0,2,1,0,0,0|1,0,0]=4 5848 B15R1.1039 CCNC(=O)c1cccc(c1)NCCO 34a_100000181407_100000211926 [0,2,1,0,0,0|1,0,0]=4 5849 B15R1.1039 CCNC(=O)c1cccc(c1)NCCO 7a_100000181407_100000211926 [0,2,1,0,0,0|1,0,0]=4 5850 B15R1.1039 CCNC(=O)c1cccc(c1)NCSC 34a_100000181407_100011218213 [0,2,1,0,0,0|1,0,0]=4 5851 B15R1.1039 CCNCc1cc(ccn1)C(=O)OCC 270004a_100015525214_100009858167 [0,2,1,0,0,0|1,0,0]=4 5852 B15R1.1039 CCNCc1cccc(c1)C(=O)NCC 2230a_100015525214_100011266491 [0,2,1,0,0,0|1,0,0]=4 5853 B15R1.1039 CCNCc1cccc(c1)C(=O)OCC 2230a_100015525214_100011934420 [0,2,1,0,0,0|0,0,0]=3 5854 B15R1.1039 CCNCc1cccc(c1)C(=O)OCC 270004a_100015525214_200000047102 [0,2,1,0,0,0|0,0,0]=3 5855 B15R1.1039 CCNCc1cccc(n1)C(=O)OCC 2230a_100015525214_200000094938 [0,2,1,0,0,0|1,0,0]=4 5856 B15R1.1039 CCOC(=O)c1cccc(c1)CSCC 62a_100000210202_100011934420 [0,2,1,0,0,0|1,0,0]=4 5857 B15R1.1039 CCOC(=O)c1cccc(c1)CSCC 62a_100011934420_100000210202 [0,2,1,0,0,0|1,0,0]=4 5858 B15R1.1039 CCOC(=O)c1cccc(c1)OCCF 7a_100000169910_100011217306 [0,2,1,0,0,0|1,0,0]=4 5859 B15R1.1039 CCOC(=O)c1cccc(c1)OCCO 7a_100000169910_100000211926 [0,2,1,0,0,0|1,0,0]=4 5860 B15R1.1039 CCOC(=O)c1cccc(c1)SCCF 62a_100000170211_100011217306 [0,2,1,0,0,0|1,0,0]=4 5861 B15R1.1039 CCOC(=O)c1cccc(c1)SCCF 62a_100011217306_100000170211 [0,2,1,0,0,0|1,0,0]=4 5862 B15R1.1039 CCOC(=O)c1cccc(c1)SCCO 62a_100000170211_100000211926 [0,2,1,0,0,0|1,0,0]=4 5863 B15R1.1039 CCOC(=O)c1cccc(c1)SCCO 62a_100000211926_100000170211 [0,2,1,0,0,0|1,0,0]=4 5864 B15R1.1039 CCOC(=O)c1cccc(c1)SCOC 62a_100000170211_100000766300 [0,2,1,0,0,0|1,0,0]=4 5865 B15R1.1039 CCOC(=O)c1cccc(c1)SCOC 62a_100000766300_100000170211 [0,2,1,0,0,0|1,0,0]=4 5866 B15R1.1039 CCOC(=O)c1cccc(c1)SCSC 62a_100000170211_100011218213 [0,2,1,0,0,0|1,0,0]=4 5867 B15R1.1039 CCOC(=O)c1cccc(c1)SCSC 62a_100011218213_100000170211 [0,2,1,0,0,0|1,0,0]=4 5868 B15R1.1039 CCOC(=O)c1cccc(n1)NCCO 27a_100000210304_100000695914 [0,2,1,0,0,0|1,0,0]=4 5869 B15R1.1231 CCOc1cccc(c1)C(=O)CCOC 1458a_100000216331_100000233755 [0,2,1,0,0,0|1,0,0]=4 5870 B15R1.3624 CCNc1cc(cc(n1)C(=O)OCC)C 27a_100015525214_200000094552 [0,2,1,0,0,0|1,0,0]=4 5871 B15R1.3624 CCOC(=O)c1cc(cc(c1)SCC)Br 62a_100000210202_200012351389 [0,2,1,0,0,0|1,0,0]=4 5872 B15R1.3624 CCOC(=O)c1cc(cc(c1)SCC)Br 62a_200012351389_100000210202 [0,2,1,0,0,0|1,0,0]=4 5873 B15R1.3624 CCOC(=O)c1cc(cc(c1)SCC)F 62a_100000210202_200011295119 [0,2,1,0,0,0|1,0,0]=4 5874 B15R1.3624 CCOC(=O)c1cc(cc(c1)SCC)F 62a_200011295119_100000210202 [0,2,1,0,0,0|1,0,0]=4 5875 B15R1.9646 CCNC(=O)c1cc(ccc1Cl)NCC 2230a_200015187120_100000210202 [0,2,1,0,0,0|1,0,0]=4 5876 B15R1.9646 CCNC(=O)c1cc(ccc1Cl)NCC 34a_200015187120_100000210202 [0,2,1,0,0,0|1,0,0]=4 5877 B15R1.9646 CCNC(=O)c1cc(ccc1Cl)NCC 7a_200015187120_100000210202 [0,2,1,0,0,0|1,0,0]=4 5878 B15R1.9646 CCNC(=O)c1cc(ccc1F)NCC 27a_100015525214_100000155167 [0,2,1,0,0,0|1,0,0]=4 5879 B15R1.9646 CCNc1ccc(c(n1)C(=O)OCC)F 27a_100015525214_100010189790 [0,2,1,0,0,0|1,0,0]=4 5880 B15R1.9646 CCOC(=O)c1cc(ccc1Br)SCC 62a_100000210202_200012360513 [0,2,1,0,0,0|1,0,0]=4 5881 B15R1.9646 CCOC(=O)c1cc(ccc1Br)SCC 62a_200012360513_100000210202 [0,2,1,0,0,0|1,0,0]=4 5882 B15R1.9646 CCOC(=O)c1cc(ccc1C)SCC 62a_100000210202_100012360117 [0,2,1,0,0,0|1,0,0]=4 5883 B15R1.9646 CCOC(=O)c1cc(ccc1C)SCC 62a_100012360117_100000210202 [0,2,1,0,0,0|1,0,0]=4 5884 B15R1.9646 CCOC(=O)c1cc(ccc1Cl)SCC 62a_100000210202_200012339456 [0,2,1,0,0,0|1,0,0]=4 5885 B15R1.9646 CCOC(=O)c1cc(ccc1Cl)SCC 62a_200012339456_100000210202 [0,2,1,0,0,0|1,0,0]=4 5886 B15R1.9646 CCOC(=O)c1cc(ccc1F)OCC 34a_200009857887_100000210202 [0,2,1,0,0,0|1,0,0]=4 5887 B15R1.9646 CCOC(=O)c1cc(ccc1F)OCC 7a_200009857887_100000210202 [0,2,1,0,0,0|1,0,0]=4 5888 B15R1.9646 CCOC(=O)c1cc(ccc1F)SCC 62a_100000210202_100011206329 [0,2,1,0,0,0|1,0,0]=4 5889 B15R1.9646 CCOC(=O)c1cc(ccc1F)SCC 62a_100000716760_100000210202 [0,2,1,0,0,0|1,0,0]=4 5890 B15R1.9646 CCOC(=O)c1cc(ccc1N)SCC 62a_100000747833_100000210202 [0,2,1,0,0,0|1,0,0]=4 5891 B15R1.9646 CCOC(=O)c1cc(ccc1O)SCC 62a_100000210202_200000173011 [0,2,1,0,0,0|1,0,0]=4 5892 B15R1.969 CNC(=O)c1cccc(c1C)NC(C)C 34a_100000739055_100000210206 [0,2,1,0,0,0|1,0,0]=4 5893 B15R1.969 COC(=O)c1cccc(c1Br)OC(C)C 34a_200010230364_100000210206 [0,2,1,0,0,0|1,0,0]=4 5894 B15R1.969 COC(=O)c1cccc(c1Br)OC(C)C 7a_200010230364_100000210206 [0,2,1,0,0,0|1,0,0]=4 5895 B15R1.969 COC(=O)c1cccc(c1Br)SC(C)C 62a_100000210206_100010240208 [0,2,1,0,0,0|1,0,0]=4 5896 B15R1.969 COC(=O)c1cccc(c1Br)SC(C)C 62a_100010240208_100000210206 [0,2,1,0,0,0|1,0,0]=4 5897 B15R1.969 COC(=O)c1cccc(c1C)NC(=O)C 188690a_100000736742_100015343762 [0,2,1,0,0,0|0,0,1]=4 5898 B15R1.969 COC(=O)c1cccc(c1C)OC(C)C 34a_100011999632_100000210206 [0,2,1,0,0,0|1,0,0]=4 5899 B15R1.969 COC(=O)c1cccc(c1C)OC(C)C 7a_100011999632_100000210206 [0,2,1,0,0,0|1,0,0]=4 5900 B15R1.969 COC(=O)c1cccc(c1C)SC(C)C 62a_100000210206_100012298220 [0,2,1,0,0,0|1,0,0]=4 5901 B15R1.969 COC(=O)c1cccc(c1C)SC(C)C 62a_100012298220_100000210206 [0,2,1,0,0,0|1,0,0]=4 5902 B15R1.969 COC(=O)c1cccc(c1Cl)OC(C)C 34a_100009866855_100000210206 [0,2,1,0,0,0|1,0,0]=4 5903 B15R1.969 COC(=O)c1cccc(c1Cl)OC(C)C 7a_100009866855_100000210206 [0,2,1,0,0,0|1,0,0]=4 5904 B15R1.969 COC(=O)c1cccc(c1F)NC(=O)C 188690a_100012186181_100015343762 [0,2,1,0,0,0|0,0,1]=4 5905 B15R1.969 COC(=O)c1cccc(c1F)OC(C)C 34a_100009854753_100000210206 [0,2,1,0,0,0|1,0,0]=4 5906 B15R1.969 COC(=O)c1cccc(c1F)OC(C)C 7a_100009854753_100000210206 [0,2,1,0,0,0|1,0,0]=4 5907 B15R1.969 COC(=O)c1cccc(c1F)SC(C)C 62a_100000210206_100012355674 [0,2,1,0,0,0|1,0,0]=4 5908 B15R1.969 COC(=O)c1cccc(c1F)SC(C)C 62a_100012355674_100000210206 [0,2,1,0,0,0|1,0,0]=4 5909 B15R1.969 COC(=O)c1cccc(c1N)OC(C)C 34a_100015205654_100000210206 [0,2,1,0,0,0|1,0,0]=4 5910 B15R1.969 COC(=O)c1cccc(c1N)OC(C)C 7a_100015205654_100000210206 [0,2,1,0,0,0|1,0,0]=4 5911 B15R1.969 COC(=O)c1cccc(c1N)SC(C)C 62a_100011356556_100000210206 [0,2,1,0,0,0|1,0,0]=4 5912 B15R1.969 COC(=O)c1cccc(c1O)SC(C)C 62a_100009816214_100000210206 [0,2,1,0,0,0|1,0,0]=4 5913 B15R1.1042 CCCCc1cccc(c1Br)C(=O)OC 271570a_100020621405_100010240208 [0,2,1,0,0,0|1,0,0]=4 5914 B15R1.1042 CCCCc1cccc(c1C)C(=O)OC 271570a_100020621405_100012298220 [0,2,1,0,0,0|1,0,0]=4 5915 B15R1.1042 CCCCc1cccc(c1F)C(=O)OC 271570a_100020621405_100012355674 [0,2,1,0,0,0|1,0,0]=4 5916 B15R1.1042 CCCCc1cccc(c1N)C(=O)OC 271570a_100020621405_100011356556 [0,2,1,0,0,0|1,0,0]=4 5917 B15R1.1042 CCCCc1cccc(c1O)C(=O)OC 271570a_100020621405_100009816214 [0,2,1,0,0,0|1,0,0]=4 5918 B15R1.1042 CCCNc1cccc(c1C)C(=O)NC 34a_100000739055_100000210303 [0,2,1,0,0,0|1,0,0]=4 5919 B15R1.1042 CCCOc1cccc(c1Br)C(=O)OC 34a_200010230364_100000210303 [0,2,1,0,0,0|1,0,0]=4 5920 B15R1.1042 CCCOc1cccc(c1Br)C(=O)OC 7a_200010230364_100000210303 [0,2,1,0,0,0|1,0,0]=4 5921 B15R1.1042 CCCOc1cccc(c1C)C(=O)OC 34a_100011999632_100000210303 [0,2,1,0,0,0|1,0,0]=4 5922 B15R1.1042 CCCOc1cccc(c1C)C(=O)OC 7a_100011999632_100000210303 [0,2,1,0,0,0|1,0,0]=4 5923 B15R1.1042 CCCOc1cccc(c1Cl)C(=O)OC 34a_100009866855_100000210303 [0,2,1,0,0,0|1,0,0]=4 5924 B15R1.1042 CCCOc1cccc(c1Cl)C(=O)OC 7a_100009866855_100000210303 [0,2,1,0,0,0|1,0,0]=4 5925 B15R1.1042 CCCOc1cccc(c1F)C(=O)OC 34a_100009854753_100000210303 [0,2,1,0,0,0|1,0,0]=4 5926 B15R1.1042 CCCOc1cccc(c1F)C(=O)OC 7a_100009854753_100000210303 [0,2,1,0,0,0|1,0,0]=4 5927 B15R1.1042 CCCOc1cccc(c1N)C(=O)OC 34a_100015205654_100000210303 [0,2,1,0,0,0|1,0,0]=4 5928 B15R1.1042 CCCOc1cccc(c1N)C(=O)OC 7a_100015205654_100000210303 [0,2,1,0,0,0|1,0,0]=4 5929 B15R1.1042 CCCSc1cccc(c1Br)C(=O)OC 62a_100000210303_100010240208 [0,2,1,0,0,0|1,0,0]=4 5930 B15R1.1042 CCCSc1cccc(c1Br)C(=O)OC 62a_100010240208_100000210303 [0,2,1,0,0,0|1,0,0]=4 5931 B15R1.1042 CCCSc1cccc(c1C)C(=O)OC 62a_100000210303_100012298220 [0,2,1,0,0,0|1,0,0]=4 5932 B15R1.1042 CCCSc1cccc(c1C)C(=O)OC 62a_100012298220_100000210303 [0,2,1,0,0,0|1,0,0]=4 5933 B15R1.1042 CCCSc1cccc(c1F)C(=O)OC 62a_100000210303_100012355674 [0,2,1,0,0,0|1,0,0]=4 5934 B15R1.1042 CCCSc1cccc(c1F)C(=O)OC 62a_100012355674_100000210303 [0,2,1,0,0,0|1,0,0]=4 5935 B15R1.1042 CCCSc1cccc(c1N)C(=O)OC 62a_100011356556_100000210303 [0,2,1,0,0,0|1,0,0]=4 5936 B15R1.1042 CCCSc1cccc(c1O)C(=O)OC 62a_100009816214_100000210303 [0,2,1,0,0,0|1,0,0]=4 5937 B15R1.1042 CCNCc1cccc(c1Br)C(=O)OC 2230a_100015525214_100010235804 [0,2,1,0,0,0|0,0,0]=3 5938 B15R1.1042 CCNCc1cccc(c1F)C(=O)OC 2230a_100015525214_200013328352 [0,2,1,0,0,0|0,0,0]=3 5939 B15R1.1042 CCNCc1cccc(c1F)C(=O)OC 270004a_100015525214_100012866473 [0,2,1,0,0,0|0,0,0]=3 5940 B15R1.1042 CCOCc1cccc(c1Br)C(=O)OC 34a_100121572206_100010235804 [0,2,1,0,0,0|1,0,0]=4 5941 B15R1.1042 CCOCc1cccc(c1F)C(=O)OC 34a_100121572206_200013328352 [0,2,1,0,0,0|1,0,0]=4 5942 B15R1.1042 CCSCc1cccc(c1Br)C(=O)OC 62a_100000210202_100010235804 [0,2,1,0,0,0|1,0,0]=4 5943 B15R1.1042 CCSCc1cccc(c1Br)C(=O)OC 62a_100010235804_100000210202 [0,2,1,0,0,0|1,0,0]=4 5944 B15R1.1042 CCSCc1cccc(c1F)C(=O)OC 62a_100000210202_200013328352 [0,2,1,0,0,0|1,0,0]=4 5945 B15R1.1042 CCSCc1cccc(c1F)C(=O)OC 62a_200013328352_100000210202 [0,2,1,0,0,0|1,0,0]=4 5946 B15R1.1042 CNC(=O)c1cccc(c1C)NCCF 34a_100000739055_100011217306 [0,2,1,0,0,0|1,0,0]=4 5947 B15R1.1042 CNC(=O)c1cccc(c1C)NCCO 34a_100000739055_100000211926 [0,2,1,0,0,0|1,0,0]=4 5948 B15R1.1042 CNC(=O)c1cccc(c1C)NCSC 34a_100000739055_100011218213 [0,2,1,0,0,0|1,0,0]=4 5949 B15R1.1042 COC(=O)c1cccc(c1Br)OCCF 34a_200010230364_100011217306 [0,2,1,0,0,0|1,0,0]=4 5950 B15R1.1042 COC(=O)c1cccc(c1Br)OCCF 7a_200010230364_100011217306 [0,2,1,0,0,0|1,0,0]=4 5951 B15R1.1042 COC(=O)c1cccc(c1Br)OCCO 34a_200010230364_100000211926 [0,2,1,0,0,0|1,0,0]=4 5952 B15R1.1042 COC(=O)c1cccc(c1Br)OCCO 7a_200010230364_100000211926 [0,2,1,0,0,0|1,0,0]=4 5953 B15R1.1042 COC(=O)c1cccc(c1Br)OCSC 34a_200010230364_100011218213 [0,2,1,0,0,0|1,0,0]=4 5954 B15R1.1042 COC(=O)c1cccc(c1Br)SCCF 62a_100010240208_100011217306 [0,2,1,0,0,0|1,0,0]=4 5955 B15R1.1042 COC(=O)c1cccc(c1Br)SCCF 62a_100011217306_100010240208 [0,2,1,0,0,0|1,0,0]=4 5956 B15R1.1042 COC(=O)c1cccc(c1Br)SCCO 62a_100000211926_100010240208 [0,2,1,0,0,0|1,0,0]=4 5957 B15R1.1042 COC(=O)c1cccc(c1Br)SCCO 62a_100010240208_100000211926 [0,2,1,0,0,0|1,0,0]=4 5958 B15R1.1042 COC(=O)c1cccc(c1Br)SCSC 62a_100010240208_100011218213 [0,2,1,0,0,0|1,0,0]=4 5959 B15R1.1042 COC(=O)c1cccc(c1Br)SCSC 62a_100011218213_100010240208 [0,2,1,0,0,0|1,0,0]=4 5960 B15R1.1042 COC(=O)c1cccc(c1C)OCCF 34a_100011999632_100011217306 [0,2,1,0,0,0|1,0,0]=4 5961 B15R1.1042 COC(=O)c1cccc(c1C)OCCF 7a_100011999632_100011217306 [0,2,1,0,0,0|1,0,0]=4 5962 B15R1.1042 COC(=O)c1cccc(c1C)OCCO 34a_100011999632_100000211926 [0,2,1,0,0,0|1,0,0]=4 5963 B15R1.1042 COC(=O)c1cccc(c1C)OCCO 7a_100011999632_100000211926 [0,2,1,0,0,0|1,0,0]=4 5964 B15R1.1042 COC(=O)c1cccc(c1C)OCSC 34a_100011999632_100011218213 [0,2,1,0,0,0|1,0,0]=4 5965 B15R1.1042 COC(=O)c1cccc(c1C)SCCF 62a_100011217306_100012298220 [0,2,1,0,0,0|1,0,0]=4 5966 B15R1.1042 COC(=O)c1cccc(c1C)SCCF 62a_100012298220_100011217306 [0,2,1,0,0,0|1,0,0]=4 5967 B15R1.1042 COC(=O)c1cccc(c1C)SCCO 62a_100000211926_100012298220 [0,2,1,0,0,0|1,0,0]=4 5968 B15R1.1042 COC(=O)c1cccc(c1C)SCCO 62a_100012298220_100000211926 [0,2,1,0,0,0|1,0,0]=4 5969 B15R1.1042 COC(=O)c1cccc(c1C)SCSC 62a_100011218213_100012298220 [0,2,1,0,0,0|1,0,0]=4 5970 B15R1.1042 COC(=O)c1cccc(c1C)SCSC 62a_100012298220_100011218213 [0,2,1,0,0,0|1,0,0]=4 5971 B15R1.1042 COC(=O)c1cccc(c1Cl)OCCF 34a_100009866855_100011217306 [0,2,1,0,0,0|1,0,0]=4 5972 B15R1.1042 COC(=O)c1cccc(c1Cl)OCCF 7a_100009866855_100011217306 [0,2,1,0,0,0|1,0,0]=4 5973 B15R1.1042 COC(=O)c1cccc(c1Cl)OCCO 34a_100009866855_100000211926 [0,2,1,0,0,0|1,0,0]=4 5974 B15R1.1042 COC(=O)c1cccc(c1Cl)OCCO 7a_100009866855_100000211926 [0,2,1,0,0,0|1,0,0]=4 5975 B15R1.1042 COC(=O)c1cccc(c1Cl)OCSC 34a_100009866855_100011218213 [0,2,1,0,0,0|1,0,0]=4 5976 B15R1.1042 COC(=O)c1cccc(c1F)OCCF 34a_100009854753_100011217306 [0,2,1,0,0,0|1,0,0]=4 5977 B15R1.1042 COC(=O)c1cccc(c1F)OCCF 7a_100009854753_100011217306 [0,2,1,0,0,0|1,0,0]=4 5978 B15R1.1042 COC(=O)c1cccc(c1F)OCCO 34a_100009854753_100000211926 [0,2,1,0,0,0|1,0,0]=4 5979 B15R1.1042 COC(=O)c1cccc(c1F)OCCO 7a_100009854753_100000211926 [0,2,1,0,0,0|1,0,0]=4 5980 B15R1.1042 COC(=O)c1cccc(c1F)OCSC 34a_100009854753_100011218213 [0,2,1,0,0,0|1,0,0]=4 5981 B15R1.1042 COC(=O)c1cccc(c1F)SCCF 62a_100011217306_100012355674 [0,2,1,0,0,0|1,0,0]=4 5982 B15R1.1042 COC(=O)c1cccc(c1F)SCCF 62a_100012355674_100011217306 [0,2,1,0,0,0|1,0,0]=4 5983 B15R1.1042 COC(=O)c1cccc(c1F)SCCO 62a_100000211926_100012355674 [0,2,1,0,0,0|1,0,0]=4 5984 B15R1.1042 COC(=O)c1cccc(c1F)SCCO 62a_100012355674_100000211926 [0,2,1,0,0,0|1,0,0]=4 5985 B15R1.1042 COC(=O)c1cccc(c1F)SCSC 62a_100011218213_100012355674 [0,2,1,0,0,0|1,0,0]=4 5986 B15R1.1042 COC(=O)c1cccc(c1F)SCSC 62a_100012355674_100011218213 [0,2,1,0,0,0|1,0,0]=4 5987 B15R1.1042 COC(=O)c1cccc(c1N)OCCF 34a_100015205654_100011217306 [0,2,1,0,0,0|1,0,0]=4 5988 B15R1.1042 COC(=O)c1cccc(c1N)OCCF 7a_100015205654_100011217306 [0,2,1,0,0,0|1,0,0]=4 5989 B15R1.1042 COC(=O)c1cccc(c1N)OCCO 34a_100015205654_100000211926 [0,2,1,0,0,0|1,0,0]=4 5990 B15R1.1042 COC(=O)c1cccc(c1N)OCCO 7a_100015205654_100000211926 [0,2,1,0,0,0|1,0,0]=4 5991 B15R1.1042 COC(=O)c1cccc(c1N)OCSC 34a_100015205654_100011218213 [0,2,1,0,0,0|1,0,0]=4 5992 B15R1.1042 COC(=O)c1cccc(c1N)SCCF 62a_100011356556_100011217306 [0,2,1,0,0,0|1,0,0]=4 5993 B15R1.1042 COC(=O)c1cccc(c1N)SCCO 62a_100011356556_100000211926 [0,2,1,0,0,0|1,0,0]=4 5994 B15R1.1042 COC(=O)c1cccc(c1N)SCSC 62a_100011356556_100011218213 [0,2,1,0,0,0|1,0,0]=4 5995 B15R1.1042 COC(=O)c1cccc(c1O)SCCF 62a_100009816214_100011217306 [0,2,1,0,0,0|1,0,0]=4 5996 B15R1.1042 COC(=O)c1cccc(c1O)SCCO 62a_100009816214_100000211926 [0,2,1,0,0,0|1,0,0]=4 5997 B15R1.1042 COC(=O)c1cccc(c1O)SCSC 62a_100009816214_100011218213 [0,2,1,0,0,0|1,0,0]=4 5998 B15R1.1042 COCSc1cccc(c1Br)C(=O)OC 62a_100000766300_100010240208 [0,2,1,0,0,0|1,0,0]=4 5999 B15R1.1042 COCSc1cccc(c1Br)C(=O)OC 62a_100010240208_100000766300 [0,2,1,0,0,0|1,0,0]=4 6000 B15R1.1042 COCSc1cccc(c1C)C(=O)OC 62a_100000766300_100012298220 [0,2,1,0,0,0|1,0,0]=4 6001 B15R1.1042 COCSc1cccc(c1C)C(=O)OC 62a_100012298220_100000766300 [0,2,1,0,0,0|1,0,0]=4 6002 B15R1.1042 COCSc1cccc(c1F)C(=O)OC 62a_100000766300_100012355674 [0,2,1,0,0,0|1,0,0]=4 6003 B15R1.1042 COCSc1cccc(c1F)C(=O)OC 62a_100012355674_100000766300 [0,2,1,0,0,0|1,0,0]=4 6004 B15R1.1042 COCSc1cccc(c1N)C(=O)OC 62a_100011356556_100000766300 [0,2,1,0,0,0|1,0,0]=4 6005 B15R1.1042 COCSc1cccc(c1O)C(=O)OC 62a_100009816214_100000766300 [0,2,1,0,0,0|1,0,0]=4 6006 B15R1.3653 CCOc1cc(cc(c1C)C(=O)OC)Br 34a_200011012443_100000210202 [0,2,1,0,0,0|1,0,0]=4 6007 B15R1.3653 CCOc1cc(cc(c1C)C(=O)OC)Br 7a_200011012443_100000210202 [0,2,1,0,0,0|1,0,0]=4 6008 B15R1.3653 CCSc1cc(cc(c1C)C(=O)OC)F 62a_100000210202_100012347598 [0,2,1,0,0,0|1,0,0]=4 6009 B15R1.3653 CCSc1cc(cc(c1C)C(=O)OC)F 62a_100012347598_100000210202 [0,2,1,0,0,0|1,0,0]=4 6010 B15R1.3653 CCSc1cc(cc(c1N)C(=O)OC)Br 62a_100010726126_100000210202 [0,2,1,0,0,0|1,0,0]=4 6011 B15R1.3653 CCSc1cc(cc(c1N)C(=O)OC)C 62a_100000210202_100000216481 [0,2,1,0,0,0|1,0,0]=4 6012 B15R1.3653 CCSc1cc(cc(c1N)C(=O)OC)C 62a_100000216481_100000210202 [0,2,1,0,0,0|1,0,0]=4 6013 B15R1.3653 CCSc1cc(cc(c1N)C(=O)OC)Cl 62a_100000043629_100000210202 [0,2,1,0,0,0|1,0,0]=4 6014 B15R1.3653 CCSc1cc(cc(c1O)C(=O)OC)Br 62a_100009996593_100000210202 [0,2,1,0,0,0|1,0,0]=4 6015 B15R1.6832 CCNc1cccc(c1C)C(=O)N(C)C 34a_100015185817_100000210202 [0,2,1,0,0,0|1,0,0]=4 6016 B15R1.6832 CCNc1cccc(c1C)C(=O)N(C)C 7a_100015185817_100000210202 [0,2,1,0,0,0|1,0,0]=4 6017 B15R1.6832 CCNc1cccc(c1O)C(=O)N(C)C 34a_100012182727_100000210202 [0,2,1,0,0,0|1,0,0]=4 6018 B15R1.7636 CCOc1cccc(c1CC)C(=O)OC 34a_200010668476_100000210202 [0,2,1,0,0,0|1,0,0]=4 6019 B15R1.7636 CCOc1cccc(c1CC)C(=O)OC 7a_200010668476_100000210202 [0,2,1,0,0,0|1,0,0]=4 6020 B15R1.7636 CCSc1cccc(c1C#N)C(=O)OC 62a_100000210202_100000766541 [0,2,1,0,0,0|1,0,0]=4 6021 B15R1.7636 CCSc1cccc(c1OC)C(=O)OC 62a_100010233336_100000210202 [0,2,1,0,0,0|1,0,0]=4 6022 B15R1.33248 CCOc1ccc(c(c1C)C(=O)OC)Br 34a_100010074912_100000210202 [0,2,1,0,0,0|1,0,0]=4 6023 B15R1.33248 CCOc1ccc(c(c1C)C(=O)OC)Br 7a_100010074912_100000210202 [0,2,1,0,0,0|1,0,0]=4 6024 B15R1.33248 CCSc1ccc(c(c1C)C(=O)OC)C 62a_100000210202_100016100700 [0,2,1,0,0,0|1,0,0]=4 6025 B15R1.33248 CCSc1ccc(c(c1C)C(=O)OC)C 62a_100016100700_100000210202 [0,2,1,0,0,0|1,0,0]=4 6026 B15R1.33248 CCSc1ccc(c(c1C)C(=O)OC)N 62a_100010203172_100000210202 [0,2,1,0,0,0|1,0,0]=4 6027 B15R1.33248 CCSc1ccc(c(c1F)C(=O)OC)F 62a_100000210202_100000721510 [0,2,1,0,0,0|1,0,0]=4 6028 B15R1.33248 CCSc1ccc(c(c1F)C(=O)OC)F 62a_100000721510_100000210202 [0,2,1,0,0,0|1,0,0]=4 6029 B15R1.926 CNC(=O)c1cc(ccc1Cl)NC(C)C 2230a_100000742274_100000210206 [0,2,1,0,0,0|1,0,0]=4 6030 B15R1.926 CNC(=O)c1cc(ccc1Cl)NC(C)C 34a_100000742274_100000210206 [0,2,1,0,0,0|1,0,0]=4 6031 B15R1.926 CNC(=O)c1cc(ccc1F)NC(C)C 2230a_100000747870_100000210206 [0,2,1,0,0,0|1,0,0]=4 6032 B15R1.926 CNC(=O)c1cc(ccc1F)NC(C)C 34a_100000747870_100000210206 [0,2,1,0,0,0|1,0,0]=4 6033 B15R1.926 CNC(=O)c1cc(ccc1F)NC(C)C 7a_100000747870_100000210206 [0,2,1,0,0,0|1,0,0]=4 6034 B15R1.926 COC(=O)c1cc(ccc1Br)NC(=O)C 188690a_100000696289_100015343762 [0,2,1,0,0,0|0,0,1]=4 6035 B15R1.926 COC(=O)c1cc(ccc1Br)OC(C)C 34a_100010230369_100000210206 [0,2,1,0,0,0|1,0,0]=4 6036 B15R1.926 COC(=O)c1cc(ccc1Br)OC(C)C 7a_100010230369_100000210206 [0,2,1,0,0,0|1,0,0]=4 6037 B15R1.926 COC(=O)c1cc(ccc1Br)SC(C)C 62a_100000210206_100012340073 [0,2,1,0,0,0|1,0,0]=4 6038 B15R1.926 COC(=O)c1cc(ccc1Br)SC(C)C 62a_100012340073_100000210206 [0,2,1,0,0,0|1,0,0]=4 6039 B15R1.926 COC(=O)c1cc(ccc1C)NC(=O)C 188690a_100000766237_100015343762 [0,2,1,0,0,0|0,0,1]=4 6040 B15R1.926 COC(=O)c1cc(ccc1C)OC(C)C 34a_100012002527_100000210206 [0,2,1,0,0,0|1,0,0]=4 6041 B15R1.926 COC(=O)c1cc(ccc1C)OC(C)C 7a_100012002527_100000210206 [0,2,1,0,0,0|1,0,0]=4 6042 B15R1.926 COC(=O)c1cc(ccc1C)SC(C)C 62a_100000210206_100012360116 [0,2,1,0,0,0|1,0,0]=4 6043 B15R1.926 COC(=O)c1cc(ccc1C)SC(C)C 62a_100012360116_100000210206 [0,2,1,0,0,0|1,0,0]=4 6044 B15R1.926 COC(=O)c1cc(ccc1Cl)NC(=O)C 188690a_100015183649_100015343762 [0,2,1,0,0,0|0,0,1]=4 6045 B15R1.926 COC(=O)c1cc(ccc1Cl)OC(C)C 34a_100012001761_100000210206 [0,2,1,0,0,0|1,0,0]=4 6046 B15R1.926 COC(=O)c1cc(ccc1Cl)OC(C)C 7a_100012001761_100000210206 [0,2,1,0,0,0|1,0,0]=4 6047 B15R1.926 COC(=O)c1cc(ccc1Cl)SC(C)C 62a_100000210206_100012353682 [0,2,1,0,0,0|1,0,0]=4 6048 B15R1.926 COC(=O)c1cc(ccc1Cl)SC(C)C 62a_100012353682_100000210206 [0,2,1,0,0,0|1,0,0]=4 6049 B15R1.926 COC(=O)c1cc(ccc1F)NC(=O)C 188690a_100000735807_100015343762 [0,2,1,0,0,0|0,0,1]=4 6050 B15R1.926 COC(=O)c1cc(ccc1F)OC(C)C 34a_100009856154_100000210206 [0,2,1,0,0,0|1,0,0]=4 6051 B15R1.926 COC(=O)c1cc(ccc1F)OC(C)C 7a_100009856154_100000210206 [0,2,1,0,0,0|1,0,0]=4 6052 B15R1.926 COC(=O)c1cc(ccc1F)SC(C)C 62a_100000210206_100000216675 [0,2,1,0,0,0|1,0,0]=4 6053 B15R1.926 COC(=O)c1cc(ccc1F)SC(C)C 62a_100000216675_100000210206 [0,2,1,0,0,0|1,0,0]=4 6054 B15R1.926 COC(=O)c1cc(ccc1I)NC(=O)C 188690a_100011794239_100015343762 [0,2,1,0,0,0|0,0,1]=4 6055 B15R1.926 COC(=O)c1cc(ccc1I)OC(C)C 34a_200009888904_100000210206 [0,2,1,0,0,0|1,0,0]=4 6056 B15R1.926 COC(=O)c1cc(ccc1I)OC(C)C 7a_200009888904_100000210206 [0,2,1,0,0,0|1,0,0]=4 6057 B15R1.926 COC(=O)c1cc(ccc1N)OC(C)C 34a_100000694981_100000210206 [0,2,1,0,0,0|1,0,0]=4 6058 B15R1.926 COC(=O)c1cc(ccc1N)OC(C)C 7a_100000694981_100000210206 [0,2,1,0,0,0|1,0,0]=4 6059 B15R1.926 COC(=O)c1cc(ccc1N)SC(C)C 62a_100000212070_100000210206 [0,2,1,0,0,0|1,0,0]=4 6060 B15R1.926 COC(=O)c1cc(ccc1O)NC(=O)C 188690a_100011246163_100015343762 [0,2,1,0,0,0|0,0,1]=4 6061 B15R1.926 COC(=O)c1cc(ccc1O)SC(C)C 62a_100000210206_100000149868 [0,2,1,0,0,0|1,0,0]=4 6062 B15R1.934 COC(=O)c1cc(cc(c1)NC(=O)C)Br 188690a_100138415615_100015343762 [0,2,1,0,0,0|0,0,1]=4 6063 B15R1.934 COC(=O)c1cc(cc(c1)NC(=O)C)C 188690a_100025797325_100015343762 [0,2,1,0,0,0|0,0,1]=4 6064 B15R1.934 COC(=O)c1cc(cc(c1)NC(=O)C)Cl 188690a_100000756140_100015343762 [0,2,1,0,0,0|0,0,1]=4 6065 B15R1.934 COC(=O)c1cc(cc(c1)NC(=O)C)F 188690a_100011794249_100015343762 [0,2,1,0,0,0|0,0,1]=4 6066 B15R1.934 COC(=O)c1cc(cc(c1)NC(=O)C)I 188690a_200000693439_100015343762 [0,2,1,0,0,0|0,0,1]=4 6067 B15R1.934 COC(=O)c1cc(cc(c1)NC(=O)C)O 188690a_100000069914_100015343762 [0,2,1,0,0,0|0,0,1]=4 6068 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)Br 34a_100000696291_100000210206 [0,2,1,0,0,0|1,0,0]=4 6069 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)Br 7a_100000696291_100000210206 [0,2,1,0,0,0|1,0,0]=4 6070 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)Cl 34a_100009870047_100000210206 [0,2,1,0,0,0|1,0,0]=4 6071 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)Cl 7a_100009870047_100000210206 [0,2,1,0,0,0|1,0,0]=4 6072 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)F 34a_100000118610_100000210206 [0,2,1,0,0,0|1,0,0]=4 6073 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)F 7a_100000118610_100000210206 [0,2,1,0,0,0|1,0,0]=4 6074 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)N 34a_100000069914_100000210206 [0,2,1,0,0,0|1,0,0]=4 6075 B15R1.934 COC(=O)c1cc(cc(c1)OC(C)C)N 7a_100000069914_100000210206 [0,2,1,0,0,0|1,0,0]=4 6076 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)Br 62a_100000210206_100012339729 [0,2,1,0,0,0|1,0,0]=4 6077 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)Br 62a_100012339729_100000210206 [0,2,1,0,0,0|1,0,0]=4 6078 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)C 62a_100000210206_100012359405 [0,2,1,0,0,0|1,0,0]=4 6079 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)C 62a_100012359405_100000210206 [0,2,1,0,0,0|1,0,0]=4 6080 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)Cl 62a_100000210206_100000695173 [0,2,1,0,0,0|1,0,0]=4 6081 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)Cl 62a_100000695173_100000210206 [0,2,1,0,0,0|1,0,0]=4 6082 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)F 62a_100000210206_100000698578 [0,2,1,0,0,0|1,0,0]=4 6083 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)F 62a_100000698578_100000210206 [0,2,1,0,0,0|1,0,0]=4 6084 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)N 62a_100000210206_100138415615 [0,2,1,0,0,0|1,0,0]=4 6085 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)N 62a_100138415615_100000210206 [0,2,1,0,0,0|1,0,0]=4 6086 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)O 62a_100000210206_100000696291 [0,2,1,0,0,0|1,0,0]=4 6087 B15R1.934 COC(=O)c1cc(cc(c1)SC(C)C)O 62a_100000696291_100000210206 [0,2,1,0,0,0|1,0,0]=4 6088 B15R1.968 CNC(=O)c1cccc(c1)NC(C)(C)C 34a_100000185133_100000210625 [0,2,1,0,0,0|1,0,0]=4 6089 B15R1.968 COC(=O)c1cccc(c1)OC(C)(C)C 34a_100000150331_100000210625 [0,2,1,0,0,0|1,0,0]=4 6090 B15R1.968 COC(=O)c1cccc(c1)SC(C)(C)C 62a_100000148848_100000211941 [0,2,1,0,0,0|1,0,0]=4 6091 B15R1.968 COC(=O)c1cccc(c1)SC(C)(C)C 62a_100000211941_100000148848 [0,2,1,0,0,0|1,0,0]=4 6092 B15R1.11732 COC(=O)c1cccc(c1)C(=O)C(C)C 1458a_100000035267_100000210206 [0,2,1,0,0,0|1,0,0]=4 6093 B15R1.11732 COC(=O)c1cccc(n1)N(C)C(C)C 27a_200000211004_100000708286 [0,2,1,0,0,0|1,0,0]=4 6094 B15R1.12261 CC(C)Nc1cccc(c1)C(=O)C(C)C 27a_100138425928_100011350656 [0,2,1,0,0,0|1,0,0]=4 6095 B15R1.12261 CC(C)Nc1cccc(c1)C(=O)N(C)C 34a_100000246196_100000210206 [0,2,1,0,0,0|1,0,0]=4 6096 B15R1.12261 CC(C)Nc1cccc(c1)C(=O)N(C)C 7a_100000246196_100000210206 [0,2,1,0,0,0|1,0,0]=4 6097 B15R1.11499 CCC(=O)c1cc(cc(c1)C(=O)OC)Br 1458a_100000689276_100000210202 [0,2,1,0,0,0|1,0,0]=4 6098 B15R1.11499 CCC(=O)c1cc(cc(c1)C(=O)OC)C 1458a_100000068708_100000210202 [0,2,1,0,0,0|1,0,0]=4 6099 B15R1.11499 CCC(=O)c1cc(cc(c1)C(=O)OC)F 1458a_100000088977_100000210202 [0,2,1,0,0,0|1,0,0]=4 6100 B15R1.11499 CCC(=O)c1cc(cc(c1)C(=O)OC)I 1458a_200000072760_100000210202 [0,2,1,0,0,0|1,0,0]=4 6101 B15R1.11734 CCN(CC)c1cccc(n1)C(=O)OC 27a_100000724800_100000708286 [0,2,1,0,0,0|1,0,0]=4 6102 B15R1.967 C=C(C)CNc1cccc(c1)C(=O)NC 34a_100000185133_100000748629 [0,2,1,0,0,0|1,0,0]=4 6103 B15R1.967 C=C(C)CNc1cccc(n1)C(=O)OC 27a_100000765925_100000708286 [0,2,1,0,0,0|1,0,0]=4 6104 B15R1.967 C=C(C)COc1cccc(c1)C(=O)OC 34a_100000150331_100000748629 [0,2,1,0,0,0|1,0,0]=4 6105 B15R1.967 C=C(C)COc1cccc(c1)C(=O)OC 7a_100000150331_100000748629 [0,2,1,0,0,0|1,0,0]=4 6106 B15R1.967 C=C(C)CSc1cccc(c1)C(=O)OC 62a_100000148848_100000211660 [0,2,1,0,0,0|1,0,0]=4 6107 B15R1.967 C=C(C)CSc1cccc(c1)C(=O)OC 62a_100000748629_100000148848 [0,2,1,0,0,0|1,0,0]=4 6108 B15R1.967 CNC(=O)c1cccc(c1)CNC(C)C 2230a_100138425928_100000755619 [0,2,1,0,0,0|1,0,0]=4 6109 B15R1.967 CNC(=O)c1cccc(c1)CNC(C)C 34a_100138425928_100000755619 [0,2,1,0,0,0|1,0,0]=4 6110 B15R1.967 CNC(=O)c1cccc(c1)NCC(C)C 34a_100000185133_100000210624 [0,2,1,0,0,0|1,0,0]=4 6111 B15R1.967 CNC(=O)c1cccc(c1)NCC(C)O 34a_100000185133_100011218427 [0,2,1,0,0,0|1,0,0]=4 6112 B15R1.967 CNC(=O)c1cccc(c1)NCC(F)F 34a_100000185133_100011934356 [0,2,1,0,0,0|1,0,0]=4 6113 B15R1.967 CNC(=O)c1cccc(c1)NC[C@@H](C)O 34a_100000185133_100009817552 [0,2,1,0,0,0|1,0,0]=4 6114 B15R1.967 COC(=O)c1cccc(c1)C=CC(C)C 271570a_100016257149_100000148679 [0,2,1,0,0,0|1,0,0]=4 6115 B15R1.967 COC(=O)c1cccc(c1)C=CC(C)O 271570a_200011019289_100000148679 [0,2,1,0,0,0|1,0,0]=4 6116 B15R1.967 COC(=O)c1cccc(c1)CNC(=O)C 188690a_100000742309_100015343762 [0,2,1,0,0,0|0,0,1]=4 6117 B15R1.967 COC(=O)c1cccc(c1)CNC(C)C 2230a_100138425928_100000184886 [0,2,1,0,0,0|0,0,0]=3 6118 B15R1.967 COC(=O)c1cccc(c1)CNC(C)C 34a_100138425928_100000184886 [0,2,1,0,0,0|0,0,0]=3 6119 B15R1.967 COC(=O)c1cccc(c1)COC(C)C 34a_100000212225_100000184886 [0,2,1,0,0,0|1,0,0]=4 6120 B15R1.967 COC(=O)c1cccc(c1)COC(C)C 34a_100000750316_100000210206 [0,2,1,0,0,0|1,0,0]=4 6121 B15R1.967 COC(=O)c1cccc(c1)COC(C)C 7a_100000750316_100000210206 [0,2,1,0,0,0|1,0,0]=4 6122 B15R1.967 COC(=O)c1cccc(c1)CSC(C)C 62a_100000184886_100000210206 [0,2,1,0,0,0|1,0,0]=4 6123 B15R1.967 COC(=O)c1cccc(c1)CSC(C)C 62a_100000210206_100000184886 [0,2,1,0,0,0|1,0,0]=4 6124 B15R1.967 COC(=O)c1cccc(c1)OCC(C)C 34a_100000150331_100000210624 [0,2,1,0,0,0|1,0,0]=4 6125 B15R1.967 COC(=O)c1cccc(c1)OCC(C)C 7a_100000150331_100000210760 [0,2,1,0,0,0|1,0,0]=4 6126 B15R1.967 COC(=O)c1cccc(c1)OCC(C)O 34a_100000150331_100011218427 [0,2,1,0,0,0|1,0,0]=4 6127 B15R1.967 COC(=O)c1cccc(c1)OCC(C)O 7a_100000150331_100011218427 [0,2,1,0,0,0|1,0,0]=4 6128 B15R1.967 COC(=O)c1cccc(c1)OCC(F)F 34a_100000150331_100011934356 [0,2,1,0,0,0|1,0,0]=4 6129 B15R1.967 COC(=O)c1cccc(c1)OCC(F)F 7a_100000150331_100011934356 [0,2,1,0,0,0|1,0,0]=4 6130 B15R1.967 COC(=O)c1cccc(c1)OC[C@@H](C)O 34a_100000150331_100009817552 [0,2,1,0,0,0|1,0,0]=4 6131 B15R1.967 COC(=O)c1cccc(c1)OC[C@@H](C)O 7a_100000150331_100009817552 [0,2,1,0,0,0|1,0,0]=4 6132 B15R1.967 COC(=O)c1cccc(c1)SCC(C)C 62a_100000148848_100000210760 [0,2,1,0,0,0|1,0,0]=4 6133 B15R1.967 COC(=O)c1cccc(c1)SCC(C)C 62a_100000210624_100000148848 [0,2,1,0,0,0|1,0,0]=4 6134 B15R1.967 COC(=O)c1cccc(c1)SCC(C)O 62a_100000148848_100011218427 [0,2,1,0,0,0|1,0,0]=4 6135 B15R1.967 COC(=O)c1cccc(c1)SCC(C)O 62a_100011218427_100000148848 [0,2,1,0,0,0|1,0,0]=4 6136 B15R1.967 COC(=O)c1cccc(c1)SCC(F)F 62a_100000148848_100011934356 [0,2,1,0,0,0|1,0,0]=4 6137 B15R1.967 COC(=O)c1cccc(c1)SCC(F)F 62a_100011934356_100000148848 [0,2,1,0,0,0|1,0,0]=4 6138 B15R1.967 COC(=O)c1cccc(c1)SC[C@@H](C)O 62a_100000148848_100009817552 [0,2,1,0,0,0|1,0,0]=4 6139 B15R1.967 COC(=O)c1cccc(c1)SC[C@@H](C)O 62a_100009817552_100000148848 [0,2,1,0,0,0|1,0,0]=4 6140 B15R1.967 COC(=O)c1cccc(n1)CNC(C)C 2230a_100138425928_100000097194 [0,2,1,0,0,0|1,0,0]=4 6141 B15R1.967 COC(=O)c1cccc(n1)CNC(C)C 34a_100138425928_100010006753 [0,2,1,0,0,0|1,0,0]=4 6142 B15R1.967 COC(=O)c1cccc(n1)NCC(C)C 27a_100000210953_100000708286 [0,2,1,0,0,0|1,0,0]=4 6143 B15R1.967 COC(=O)c1cccc(n1)NCC(C)O 27a_100000210904_100000708286 [0,2,1,0,0,0|1,0,0]=4 6144 B15R1.967 COC(=O)c1cccc(n1)NCC(F)F 27a_100000765723_100000708286 [0,2,1,0,0,0|1,0,0]=4 6145 B15R1.967 COC(=O)c1ccnc(c1)CNC(C)C 2230a_100138425928_100020667620 [0,2,1,0,0,0|1,0,0]=4 6146 B15R1.967 COC(=O)c1cncc(c1)CNC(C)C 2230a_100138425928_100020633827 [0,2,1,0,0,0|1,0,0]=4 6147 B15R1.1182 C#CCCNc1cccc(c1)C(=O)NC 34a_100000185133_100000688953 [0,2,1,0,0,0|1,0,0]=4 6148 B15R1.1182 C#CCCNc1cccc(n1)C(=O)OC 27a_100000755551_100000708286 [0,2,1,0,0,0|1,0,0]=4 6149 B15R1.1182 C#CCCOc1cccc(c1)C(=O)OC 34a_100000150331_100000688953 [0,2,1,0,0,0|1,0,0]=4 6150 B15R1.1182 C#CCCOc1cccc(c1)C(=O)OC 7a_100000150331_100000688953 [0,2,1,0,0,0|1,0,0]=4 6151 B15R1.1182 C#CCCSc1cccc(c1)C(=O)OC 62a_100000148848_100000688953 [0,2,1,0,0,0|1,0,0]=4 6152 B15R1.1182 C#CCCSc1cccc(c1)C(=O)OC 62a_100000688953_100000148848 [0,2,1,0,0,0|1,0,0]=4 6153 B15R1.1182 C#CCNCc1cccc(c1)C(=O)OC 34a_100000212058_100000184886 [0,2,1,0,0,0|0,0,1]=4 6154 B15R1.1182 C/C=C/CNc1cccc(c1)C(=O)NC 34a_100000185133_100102629194 [0,2,1,0,0,0|1,0,0]=4 6155 B15R1.1182 C/C=C/COc1cccc(c1)C(=O)OC 34a_100000150331_100102629194 [0,2,1,0,0,0|1,0,0]=4 6156 B15R1.1182 C/C=C/COc1cccc(c1)C(=O)OC 7a_100000150331_100102629194 [0,2,1,0,0,0|1,0,0]=4 6157 B15R1.1182 C/C=C/CSc1cccc(c1)C(=O)OC 62a_100000148848_100102629194 [0,2,1,0,0,0|1,0,0]=4 6158 B15R1.1182 C/C=C/CSc1cccc(c1)C(=O)OC 62a_100102629194_100000148848 [0,2,1,0,0,0|1,0,0]=4 6159 B15R1.1182 C=CCCNc1cccc(c1)C(=O)NC 34a_100000185133_100000754431 [0,2,1,0,0,0|1,0,0]=4 6160 B15R1.1182 C=CCCNc1cccc(n1)C(=O)OC 27a_100015191253_100000708286 [0,2,1,0,0,0|1,0,0]=4 6161 B15R1.1182 C=CCCOc1cccc(c1)C(=O)OC 34a_100000150331_100000754431 [0,2,1,0,0,0|1,0,0]=4 6162 B15R1.1182 C=CCCOc1cccc(c1)C(=O)OC 7a_100000150331_100000754431 [0,2,1,0,0,0|1,0,0]=4 6163 B15R1.1182 C=CCCSc1cccc(c1)C(=O)OC 62a_100000148848_100000754431 [0,2,1,0,0,0|1,0,0]=4 6164 B15R1.1182 C=CCCSc1cccc(c1)C(=O)OC 62a_100000754431_100000148848 [0,2,1,0,0,0|1,0,0]=4 6165 B15R1.1182 C=CCNCc1cccc(c1)C(=O)OC 2230a_100020586998_100000184886 [0,2,1,0,0,0|0,0,1]=4 6166 B15R1.1182 C=CCNCc1cccc(c1)C(=O)OC 270004a_100020586998_100000687630 [0,2,1,0,0,0|0,0,1]=4 6167 B15R1.1182 CC#CCNc1cccc(c1)C(=O)NC 34a_100000185133_100000748600 [0,2,1,0,0,0|1,0,0]=4 6168 B15R1.1182 CC#CCNc1cccc(n1)C(=O)OC 27a_100000685387_100000708286 [0,2,1,0,0,0|1,0,0]=4 6169 B15R1.1182 CC#CCOc1cccc(c1)C(=O)OC 34a_100000150331_100000748600 [0,2,1,0,0,0|1,0,0]=4 6170 B15R1.1182 CC#CCOc1cccc(c1)C(=O)OC 7a_100000150331_100000748600 [0,2,1,0,0,0|1,0,0]=4 6171 B15R1.1182 CC#CCSc1cccc(c1)C(=O)OC 62a_100000148848_100000748600 [0,2,1,0,0,0|1,0,0]=4 6172 B15R1.1182 CC#CCSc1cccc(c1)C(=O)OC 62a_100000748600_100000148848 [0,2,1,0,0,0|1,0,0]=4 6173 B15R1.1182 CC=CCNc1cccc(c1)C(=O)NC 34a_100000185133_100000070051 [0,2,1,0,0,0|1,0,0]=4 6174 B15R1.1182 CC=CCOc1cccc(c1)C(=O)OC 34a_100000150331_100000070051 [0,2,1,0,0,0|1,0,0]=4 6175 B15R1.1182 CC=CCOc1cccc(c1)C(=O)OC 7a_100000150331_100000070051 [0,2,1,0,0,0|1,0,0]=4 6176 B15R1.1182 CC=CCSc1cccc(c1)C(=O)OC 62a_100000070051_100000148848 [0,2,1,0,0,0|1,0,0]=4 6177 B15R1.1182 CC=CCSc1cccc(c1)C(=O)OC 62a_100000148848_100000070051 [0,2,1,0,0,0|1,0,0]=4 6178 B15R1.1182 CCCC=Cc1cccc(c1)C(=O)OC 271570a_100016258520_100000148679 [0,2,1,0,0,0|1,0,0]=4 6179 B15R1.1182 CCCCNc1cccc(c1)C(=O)NC 34a_100000185133_100000210210 [0,2,1,0,0,0|1,0,0]=4 6180 B15R1.1182 CCCCNc1cccc(n1)C(=O)OC 27a_100000102301_100000708286 [0,2,1,0,0,0|1,0,0]=4 6181 B15R1.1182 CCCCOc1cccc(c1)C(=O)OC 34a_100000150331_100000210210 [0,2,1,0,0,0|1,0,0]=4 6182 B15R1.1182 CCCCOc1cccc(c1)C(=O)OC 7a_100000150331_100000210211 [0,2,1,0,0,0|1,0,0]=4 6183 B15R1.1182 CCCCSc1cccc(c1)C(=O)OC 62a_100000148848_100000210210 [0,2,1,0,0,0|1,0,0]=4 6184 B15R1.1182 CCCCSc1cccc(c1)C(=O)OC 62a_100000210211_100000148848 [0,2,1,0,0,0|1,0,0]=4 6185 B15R1.1182 CCCNCc1cc(ccn1)C(=O)OC 270004a_100020643023_100009884558 [0,2,1,0,0,0|1,0,0]=4 6186 B15R1.1182 CCCNCc1cccc(c1)C(=O)OC 270004a_100020643023_100000687630 [0,2,1,0,0,0|0,0,0]=3 6187 B15R1.1182 CCCNCc1cccc(n1)C(=O)OC 270004a_100020643023_100000085286 [0,2,1,0,0,0|1,0,0]=4 6188 B15R1.1182 CCCOCc1cccc(c1)C(=O)OC 34a_100000210258_100000184886 [0,2,1,0,0,0|1,0,0]=4 6189 B15R1.1182 CCCOCc1cccc(c1)C(=O)OC 34a_100000750316_100000210303 [0,2,1,0,0,0|1,0,0]=4 6190 B15R1.1182 CCCOCc1cccc(c1)C(=O)OC 7a_100000750316_100000210303 [0,2,1,0,0,0|1,0,0]=4 6191 B15R1.1182 CCCSCc1cccc(c1)C(=O)OC 62a_100000184886_100000210303 [0,2,1,0,0,0|1,0,0]=4 6192 B15R1.1182 CCCSCc1cccc(c1)C(=O)OC 62a_100000210303_100000184886 [0,2,1,0,0,0|1,0,0]=4 6193 B15R1.1182 CCNN=Cc1cc(ccn1)C(=O)OC 4a_100000756455_100009884558 [0,2,1,0,0,0|1,0,0]=4 6194 B15R1.1182 CCNN=Cc1cccc(c1)C(=O)OC 4a_100000756455_100000687630 [0,2,1,0,0,0|0,0,0]=3 6195 B15R1.1182 CCNN=Cc1cccc(n1)C(=O)OC 4a_100000756455_100000085286 [0,2,1,0,0,0|1,0,0]=4 6196 B15R1.1182 CCOC=Cc1cccc(c1)C(=O)OC 271570a_100016256518_100000148679 [0,2,1,0,0,0|1,0,0]=4 6197 B15R1.1182 CCOCSc1cccc(c1)C(=O)OC 62a_100000148848_100000739092 [0,2,1,0,0,0|1,0,0]=4 6198 B15R1.1182 CCOCSc1cccc(c1)C(=O)OC 62a_100000739092_100000148848 [0,2,1,0,0,0|1,0,0]=4 6199 B15R1.1182 CNC(=O)c1cccc(c1)CNCCF 34a_100000724931_100000755619 [0,2,1,0,0,0|1,0,0]=4 6200 B15R1.1182 CNC(=O)c1cccc(c1)CNCCO 2230a_100016997473_100000755619 [0,2,1,0,0,0|1,0,0]=4 6201 B15R1.1182 CNC(=O)c1cccc(c1)CNCCO 34a_100016990907_100000755619 [0,2,1,0,0,0|1,0,0]=4 6202 B15R1.1182 CNC(=O)c1cccc(c1)NCCCF 34a_100000185133_100011934791 [0,2,1,0,0,0|1,0,0]=4 6203 B15R1.1182 CNC(=O)c1cccc(c1)NCCCO 34a_100000185133_100000230001 [0,2,1,0,0,0|1,0,0]=4 6204 B15R1.1182 CNC(=O)c1cccc(c1)NCCOC 34a_100000185133_100011201679 [0,2,1,0,0,0|1,0,0]=4 6205 B15R1.1182 CNC(=O)c1cccc(c1)NCCSC 34a_100000185133_100000212216 [0,2,1,0,0,0|1,0,0]=4 6206 B15R1.1182 CNCCOc1cccc(c1)C(=O)OC 2230a_106832991635_100000745353 [0,2,1,0,0,0|1,0,0]=4 6207 B15R1.1182 CNCCOc1cccc(c1)C(=O)OC 34a_100102657272_100000745353 [0,2,1,0,0,0|1,0,0]=4 6208 B15R1.1182 CNCCOc1cccc(c1)C(=O)OC 7a_106832991635_100000745353 [0,2,1,0,0,0|1,0,0]=4 6209 B15R1.1182 COC(=O)c1cccc(c1)C#CCO[13CH3] 34a_100000040267_200025704644 [0,2,1,0,0,0|1,0,0]=4 6210 B15R1.1182 COC(=O)c1cccc(c1)C#CCO[13CH3] 7a_100000040267_200025704644 [0,2,1,0,0,0|1,0,0]=4 6211 B15R1.1182 COC(=O)c1cccc(c1)CNCCF 34a_100000724931_100000184886 [0,2,1,0,0,0|0,0,0]=3 6212 B15R1.1182 COC(=O)c1cccc(c1)CNCCO 2230a_100016997473_100000184886 [0,2,1,0,0,0|0,0,0]=3 6213 B15R1.1182 COC(=O)c1cccc(c1)CNCCO 270004a_100000210304_100000687630 [0,2,1,0,0,0|0,0,0]=3 6214 B15R1.1182 COC(=O)c1cccc(c1)CNCCO 34a_100016990907_100000184886 [0,2,1,0,0,0|0,0,0]=3 6215 B15R1.1182 COC(=O)c1cccc(c1)COCCBr 34a_100000211926_100000184886 [0,2,1,0,0,0|1,0,0]=4 6216 B15R1.1182 COC(=O)c1cccc(c1)COCCF 34a_100000750316_100011217306 [0,2,1,0,0,0|1,0,0]=4 6217 B15R1.1182 COC(=O)c1cccc(c1)COCCF 7a_100000750316_100011217306 [0,2,1,0,0,0|1,0,0]=4 6218 B15R1.1182 COC(=O)c1cccc(c1)COCCN 34a_100000210304_100000184886 [0,2,1,0,0,0|1,0,0]=4 6219 B15R1.1182 COC(=O)c1cccc(c1)COCCO 34a_100000750316_100000211926 [0,2,1,0,0,0|1,0,0]=4 6220 B15R1.1182 COC(=O)c1cccc(c1)COCCO 7a_100000750316_100000211926 [0,2,1,0,0,0|1,0,0]=4 6221 B15R1.1182 COC(=O)c1cccc(c1)COCSC 34a_100000750316_100011218213 [0,2,1,0,0,0|1,0,0]=4 6222 B15R1.1182 COC(=O)c1cccc(c1)CSCCF 62a_100000184886_100011217306 [0,2,1,0,0,0|1,0,0]=4 6223 B15R1.1182 COC(=O)c1cccc(c1)CSCCF 62a_100011217306_100000184886 [0,2,1,0,0,0|1,0,0]=4 6224 B15R1.1182 COC(=O)c1cccc(c1)CSCCO 62a_100000184886_100000211926 [0,2,1,0,0,0|1,0,0]=4 6225 B15R1.1182 COC(=O)c1cccc(c1)CSCCO 62a_100000211926_100000184886 [0,2,1,0,0,0|1,0,0]=4 6226 B15R1.1182 COC(=O)c1cccc(c1)CSCSC 62a_100000184886_100011218213 [0,2,1,0,0,0|1,0,0]=4 6227 B15R1.1182 COC(=O)c1cccc(c1)CSCSC 62a_100011218213_100000184886 [0,2,1,0,0,0|1,0,0]=4 6228 B15R1.1182 COC(=O)c1cccc(c1)OCCC#N 7a_100000150331_100000184422 [0,2,1,0,0,0|1,0,0]=4 6229 B15R1.1182 COC(=O)c1cccc(c1)OCCCF 34a_100000150331_100011934791 [0,2,1,0,0,0|1,0,0]=4 6230 B15R1.1182 COC(=O)c1cccc(c1)OCCCF 7a_100000150331_100011934791 [0,2,1,0,0,0|1,0,0]=4 6231 B15R1.1182 COC(=O)c1cccc(c1)OCCCO 34a_100000150331_100000230001 [0,2,1,0,0,0|1,0,0]=4 6232 B15R1.1182 COC(=O)c1cccc(c1)OCCCO 7a_100000150331_100011215043 [0,2,1,0,0,0|1,0,0]=4 6233 B15R1.1182 COC(=O)c1cccc(c1)OCCSC 34a_100000150331_100000212216 [0,2,1,0,0,0|1,0,0]=4 6234 B15R1.1182 COC(=O)c1cccc(c1)OCCSC 62a_100000745353_200000210301 [0,2,1,0,0,0|1,0,0]=4 6235 B15R1.1182 COC(=O)c1cccc(c1)OCCSC 62a_200000210301_100000745353 [0,2,1,0,0,0|1,0,0]=4 6236 B15R1.1182 COC(=O)c1cccc(c1)OCCSC 7a_100000150331_100000212216 [0,2,1,0,0,0|1,0,0]=4 6237 B15R1.1182 COC(=O)c1cccc(c1)OCCS[13CH3] 62a_100000745353_200025704644 [0,2,1,0,0,0|1,0,0]=4 6238 B15R1.1182 COC(=O)c1cccc(c1)OCCS[13CH3] 62a_200025704644_100000745353 [0,2,1,0,0,0|1,0,0]=4 6239 B15R1.1182 COC(=O)c1cccc(c1)SCCC#N 62a_100000148848_100011215226 [0,2,1,0,0,0|1,0,0]=4 6240 B15R1.1182 COC(=O)c1cccc(c1)SCCC#N 62a_100011215226_100000148848 [0,2,1,0,0,0|1,0,0]=4 6241 B15R1.1182 COC(=O)c1cccc(c1)SCCCF 62a_100000148848_100011934791 [0,2,1,0,0,0|1,0,0]=4 6242 B15R1.1182 COC(=O)c1cccc(c1)SCCCF 62a_100011934791_100000148848 [0,2,1,0,0,0|1,0,0]=4 6243 B15R1.1182 COC(=O)c1cccc(c1)SCCCO 62a_100000148848_100011215043 [0,2,1,0,0,0|1,0,0]=4 6244 B15R1.1182 COC(=O)c1cccc(c1)SCCCO 62a_100011215043_100000148848 [0,2,1,0,0,0|1,0,0]=4 6245 B15R1.1182 COC(=O)c1cccc(c1)SCCSC 62a_100000148848_100000751147 [0,2,1,0,0,0|1,0,0]=4 6246 B15R1.1182 COC(=O)c1cccc(c1)SCCSC 62a_100000212216_100000148848 [0,2,1,0,0,0|1,0,0]=4 6247 B15R1.1182 COC(=O)c1cccc(n1)CNCCF 34a_100000724931_100010006753 [0,2,1,0,0,0|1,0,0]=4 6248 B15R1.1182 COC(=O)c1cccc(n1)CNCCO 2230a_100016997473_100000097194 [0,2,1,0,0,0|1,0,0]=4 6249 B15R1.1182 COC(=O)c1cccc(n1)CNCCO 270004a_100000210304_100000085286 [0,2,1,0,0,0|1,0,0]=4 6250 B15R1.1182 COC(=O)c1cccc(n1)CNCCO 34a_100016990907_100010006753 [0,2,1,0,0,0|1,0,0]=4 6251 B15R1.1182 COC(=O)c1cccc(n1)NCCC#N 27a_100000720768_100000708286 [0,2,1,0,0,0|1,0,0]=4 6252 B15R1.1182 COC(=O)c1cccc(n1)NCCCF 27a_100015189416_100000708286 [0,2,1,0,0,0|1,0,0]=4 6253 B15R1.1182 COC(=O)c1cccc(n1)NCCCO 27a_100000182051_100000708286 [0,2,1,0,0,0|1,0,0]=4 6254 B15R1.1182 COC(=O)c1cccc(n1)NCCSC 27a_100020590264_100000708286 [0,2,1,0,0,0|1,0,0]=4 6255 B15R1.1182 COC(=O)c1ccnc(c1)CNCCO 2230a_100016997473_100020667620 [0,2,1,0,0,0|1,0,0]=4 6256 B15R1.1182 COC(=O)c1ccnc(c1)CNCCO 270004a_100000210304_100009884558 [0,2,1,0,0,0|1,0,0]=4 6257 B15R1.1182 COC(=O)c1cncc(c1)CNCCO 2230a_100016997473_100020633827 [0,2,1,0,0,0|1,0,0]=4 6258 B15R1.1182 COCC#Cc1cccc(c1)C(=O)OC 34a_100000040267_200000210301 [0,2,1,0,0,0|1,0,0]=4 6259 B15R1.1182 COCC#Cc1cccc(c1)C(=O)OC 7a_100000040267_200000210301 [0,2,1,0,0,0|1,0,0]=4 6260 B15R1.1182 COCC=Cc1cccc(c1)C(=O)OC 271570a_100016286323_100000148679 [0,2,1,0,0,0|1,0,0]=4 6261 B15R1.1182 COCCNc1cccc(n1)C(=O)OC 27a_100000209980_100000708286 [0,2,1,0,0,0|1,0,0]=4 6262 B15R1.1182 COCCOc1cccc(c1)C(=O)OC 34a_100000150331_100011201679 [0,2,1,0,0,0|1,0,0]=4 6263 B15R1.1182 COCCOc1cccc(c1)C(=O)OC 34a_100138415774_100000745353 [0,2,1,0,0,0|1,0,0]=4 6264 B15R1.1182 COCCOc1cccc(c1)C(=O)OC 7a_100000150331_100000233755 [0,2,1,0,0,0|1,0,0]=4 6265 B15R1.1182 COCCSc1cccc(c1)C(=O)OC 62a_100000148848_100000233755 [0,2,1,0,0,0|1,0,0]=4 6266 B15R1.1182 COCCSc1cccc(c1)C(=O)OC 62a_100000233755_100000148848 [0,2,1,0,0,0|1,0,0]=4 6267 B15R1.1182 COCSCc1cccc(c1)C(=O)OC 62a_100000184886_100000766300 [0,2,1,0,0,0|1,0,0]=4 6268 B15R1.1182 COCSCc1cccc(c1)C(=O)OC 62a_100000766300_100000184886 [0,2,1,0,0,0|1,0,0]=4 6269 B15R1.5445 CCCCc1cc(cc(c1)C(=O)OC)Br 271570a_100020621405_100012339729 [0,2,1,0,0,0|1,0,0]=4 6270 B15R1.5445 CCCCc1cc(cc(c1)C(=O)OC)C 271570a_100020621405_100012359405 [0,2,1,0,0,0|1,0,0]=4 6271 B15R1.5445 CCCCc1cc(cc(c1)C(=O)OC)Cl 271570a_100020621405_100000695173 [0,2,1,0,0,0|1,0,0]=4 6272 B15R1.5445 CCCCc1cc(cc(c1)C(=O)OC)F 271570a_100020621405_100000698578 [0,2,1,0,0,0|1,0,0]=4 6273 B15R1.5445 CCCCc1cc(cc(c1)C(=O)OC)N 271570a_100020621405_100138415615 [0,2,1,0,0,0|1,0,0]=4 6274 B15R1.5445 CCCCc1cc(cc(c1)C(=O)OC)O 271570a_100020621405_100000696291 [0,2,1,0,0,0|1,0,0]=4 6275 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)Br 34a_100000696291_100000210303 [0,2,1,0,0,0|1,0,0]=4 6276 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)Br 7a_100000696291_100000210303 [0,2,1,0,0,0|1,0,0]=4 6277 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)Cl 34a_100009870047_100000210303 [0,2,1,0,0,0|1,0,0]=4 6278 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)Cl 7a_100009870047_100000210303 [0,2,1,0,0,0|1,0,0]=4 6279 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)F 34a_100000118610_100000210303 [0,2,1,0,0,0|1,0,0]=4 6280 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)F 7a_100000118610_100000210303 [0,2,1,0,0,0|1,0,0]=4 6281 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)N 34a_100000069914_100000210303 [0,2,1,0,0,0|1,0,0]=4 6282 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)N 7a_100000069914_100000210303 [0,2,1,0,0,0|1,0,0]=4 6283 B15R1.5445 CCCOc1cc(cc(c1)C(=O)OC)O 271570a_203496583355_200010138849 [0,2,1,0,0,0|1,0,0]=4 6284 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)Br 62a_100000210303_100012339729 [0,2,1,0,0,0|1,0,0]=4 6285 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)Br 62a_100012339729_100000210303 [0,2,1,0,0,0|1,0,0]=4 6286 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)C 62a_100000210303_100012359405 [0,2,1,0,0,0|1,0,0]=4 6287 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)C 62a_100012359405_100000210303 [0,2,1,0,0,0|1,0,0]=4 6288 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)Cl 62a_100000210303_100000695173 [0,2,1,0,0,0|1,0,0]=4 6289 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)Cl 62a_100000695173_100000210303 [0,2,1,0,0,0|1,0,0]=4 6290 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)F 62a_100000210303_100000698578 [0,2,1,0,0,0|1,0,0]=4 6291 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)F 62a_100000698578_100000210303 [0,2,1,0,0,0|1,0,0]=4 6292 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)N 62a_100000210303_100138415615 [0,2,1,0,0,0|1,0,0]=4 6293 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)N 62a_100138415615_100000210303 [0,2,1,0,0,0|1,0,0]=4 6294 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)O 62a_100000210303_100000696291 [0,2,1,0,0,0|1,0,0]=4 6295 B15R1.5445 CCCSc1cc(cc(c1)C(=O)OC)O 62a_100000696291_100000210303 [0,2,1,0,0,0|1,0,0]=4 6296 B15R1.5445 CCNCc1cc(cc(c1)C(=O)OC)Br 2230a_100015525214_100010233859 [0,2,1,0,0,0|0,0,0]=3 6297 B15R1.5445 CCNCc1cc(cc(c1)C(=O)OC)Br 270004a_100015525214_100010371122 [0,2,1,0,0,0|0,0,0]=3 6298 B15R1.5445 CCNCc1cc(cc(c1)C(=O)OC)Cl 270004a_100015525214_100013041588 [0,2,1,0,0,0|0,0,0]=3 6299 B15R1.5445 CCNCc1cc(cc(c1)C(=O)OC)F 270004a_100015525214_100013120018 [0,2,1,0,0,0|0,0,0]=3 6300 B15R1.5445 CCNCc1cc(cc(c1)C(=O)OC)I 270004a_100015525214_100010726508 [0,2,1,0,0,0|0,0,0]=3 6301 B15R1.5445 CCOCc1cc(cc(c1)C(=O)OC)Br 34a_100010232996_100000210202 [0,2,1,0,0,0|1,0,0]=4 6302 B15R1.5445 CCOCc1cc(cc(c1)C(=O)OC)Br 34a_100121572206_100010233859 [0,2,1,0,0,0|1,0,0]=4 6303 B15R1.5445 CCOCc1cc(cc(c1)C(=O)OC)Br 7a_100010232996_100000210202 [0,2,1,0,0,0|1,0,0]=4 6304 B15R1.5445 CCOCc1cc(cc(c1)C(=O)OC)Cl 34a_100010269335_100000210202 [0,2,1,0,0,0|1,0,0]=4 6305 B15R1.5445 CCOCc1cc(cc(c1)C(=O)OC)Cl 7a_100010269335_100000210202 [0,2,1,0,0,0|1,0,0]=4 6306 B15R1.5445 CCSCc1cc(cc(c1)C(=O)OC)Br 62a_100000210202_100010233859 [0,2,1,0,0,0|1,0,0]=4 6307 B15R1.5445 CCSCc1cc(cc(c1)C(=O)OC)Br 62a_100010233859_100000210202 [0,2,1,0,0,0|1,0,0]=4 6308 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)Br 34a_100000696291_100011217306 [0,2,1,0,0,0|1,0,0]=4 6309 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)Br 7a_100000696291_100011217306 [0,2,1,0,0,0|1,0,0]=4 6310 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)Cl 34a_100009870047_100011217306 [0,2,1,0,0,0|1,0,0]=4 6311 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)Cl 7a_100009870047_100011217306 [0,2,1,0,0,0|1,0,0]=4 6312 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)F 34a_100000118610_100011217306 [0,2,1,0,0,0|1,0,0]=4 6313 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)F 7a_100000118610_100011217306 [0,2,1,0,0,0|1,0,0]=4 6314 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)N 34a_100000069914_100011217306 [0,2,1,0,0,0|1,0,0]=4 6315 B15R1.5445 COC(=O)c1cc(cc(c1)OCCF)N 7a_100000069914_100011217306 [0,2,1,0,0,0|1,0,0]=4 6316 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)Br 34a_100000696291_100000211926 [0,2,1,0,0,0|1,0,0]=4 6317 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)Br 7a_100000696291_100000211926 [0,2,1,0,0,0|1,0,0]=4 6318 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)Cl 34a_100009870047_100000211926 [0,2,1,0,0,0|1,0,0]=4 6319 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)Cl 7a_100009870047_100000211926 [0,2,1,0,0,0|1,0,0]=4 6320 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)F 34a_100000118610_100000211926 [0,2,1,0,0,0|1,0,0]=4 6321 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)F 7a_100000118610_100000211926 [0,2,1,0,0,0|1,0,0]=4 6322 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)N 34a_100000069914_100000211926 [0,2,1,0,0,0|1,0,0]=4 6323 B15R1.5445 COC(=O)c1cc(cc(c1)OCCO)N 7a_100000069914_100000211926 [0,2,1,0,0,0|1,0,0]=4 6324 B15R1.5445 COC(=O)c1cc(cc(c1)OCSC)Br 34a_100000696291_100011218213 [0,2,1,0,0,0|1,0,0]=4 6325 B15R1.5445 COC(=O)c1cc(cc(c1)OCSC)Cl 34a_100009870047_100011218213 [0,2,1,0,0,0|1,0,0]=4 6326 B15R1.5445 COC(=O)c1cc(cc(c1)OCSC)F 34a_100000118610_100011218213 [0,2,1,0,0,0|1,0,0]=4 6327 B15R1.5445 COC(=O)c1cc(cc(c1)OCSC)N 34a_100000069914_100011218213 [0,2,1,0,0,0|1,0,0]=4 6328 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)Br 62a_100011217306_100012339729 [0,2,1,0,0,0|1,0,0]=4 6329 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)Br 62a_100012339729_100011217306 [0,2,1,0,0,0|1,0,0]=4 6330 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)C 62a_100011217306_100012359405 [0,2,1,0,0,0|1,0,0]=4 6331 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)C 62a_100012359405_100011217306 [0,2,1,0,0,0|1,0,0]=4 6332 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)Cl 62a_100000695173_100011217306 [0,2,1,0,0,0|1,0,0]=4 6333 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)Cl 62a_100011217306_100000695173 [0,2,1,0,0,0|1,0,0]=4 6334 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)F 62a_100000698578_100011217306 [0,2,1,0,0,0|1,0,0]=4 6335 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)F 62a_100011217306_100000698578 [0,2,1,0,0,0|1,0,0]=4 6336 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)N 62a_100011217306_100138415615 [0,2,1,0,0,0|1,0,0]=4 6337 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)N 62a_100138415615_100011217306 [0,2,1,0,0,0|1,0,0]=4 6338 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)O 62a_100000696291_100011217306 [0,2,1,0,0,0|1,0,0]=4 6339 B15R1.5445 COC(=O)c1cc(cc(c1)SCCF)O 62a_100011217306_100000696291 [0,2,1,0,0,0|1,0,0]=4 6340 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)Br 62a_100000211926_100012339729 [0,2,1,0,0,0|1,0,0]=4 6341 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)Br 62a_100012339729_100000211926 [0,2,1,0,0,0|1,0,0]=4 6342 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)C 62a_100000211926_100012359405 [0,2,1,0,0,0|1,0,0]=4 6343 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)C 62a_100012359405_100000211926 [0,2,1,0,0,0|1,0,0]=4 6344 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)Cl 62a_100000211926_100000695173 [0,2,1,0,0,0|1,0,0]=4 6345 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)Cl 62a_100000695173_100000211926 [0,2,1,0,0,0|1,0,0]=4 6346 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)F 62a_100000211926_100000698578 [0,2,1,0,0,0|1,0,0]=4 6347 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)F 62a_100000698578_100000211926 [0,2,1,0,0,0|1,0,0]=4 6348 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)N 62a_100000211926_100138415615 [0,2,1,0,0,0|1,0,0]=4 6349 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)N 62a_100138415615_100000211926 [0,2,1,0,0,0|1,0,0]=4 6350 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)O 62a_100000211926_100000696291 [0,2,1,0,0,0|1,0,0]=4 6351 B15R1.5445 COC(=O)c1cc(cc(c1)SCCO)O 62a_100000696291_100000211926 [0,2,1,0,0,0|1,0,0]=4 6352 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)Br 62a_100011218213_100012339729 [0,2,1,0,0,0|1,0,0]=4 6353 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)Br 62a_100012339729_100011218213 [0,2,1,0,0,0|1,0,0]=4 6354 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)C 62a_100011218213_100012359405 [0,2,1,0,0,0|1,0,0]=4 6355 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)C 62a_100012359405_100011218213 [0,2,1,0,0,0|1,0,0]=4 6356 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)Cl 62a_100000695173_100011218213 [0,2,1,0,0,0|1,0,0]=4 6357 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)Cl 62a_100011218213_100000695173 [0,2,1,0,0,0|1,0,0]=4 6358 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)F 62a_100000698578_100011218213 [0,2,1,0,0,0|1,0,0]=4 6359 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)F 62a_100011218213_100000698578 [0,2,1,0,0,0|1,0,0]=4 6360 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)N 62a_100011218213_100138415615 [0,2,1,0,0,0|1,0,0]=4 6361 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)N 62a_100138415615_100011218213 [0,2,1,0,0,0|1,0,0]=4 6362 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)O 62a_100000696291_100011218213 [0,2,1,0,0,0|1,0,0]=4 6363 B15R1.5445 COC(=O)c1cc(cc(c1)SCSC)O 62a_100011218213_100000696291 [0,2,1,0,0,0|1,0,0]=4 6364 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)Br 62a_100000766300_100012339729 [0,2,1,0,0,0|1,0,0]=4 6365 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)Br 62a_100012339729_100000766300 [0,2,1,0,0,0|1,0,0]=4 6366 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)C 62a_100000766300_100012359405 [0,2,1,0,0,0|1,0,0]=4 6367 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)C 62a_100012359405_100000766300 [0,2,1,0,0,0|1,0,0]=4 6368 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)Cl 62a_100000695173_100000766300 [0,2,1,0,0,0|1,0,0]=4 6369 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)Cl 62a_100000766300_100000695173 [0,2,1,0,0,0|1,0,0]=4 6370 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)F 62a_100000698578_100000766300 [0,2,1,0,0,0|1,0,0]=4 6371 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)F 62a_100000766300_100000698578 [0,2,1,0,0,0|1,0,0]=4 6372 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)N 62a_100000766300_100138415615 [0,2,1,0,0,0|1,0,0]=4 6373 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)N 62a_100138415615_100000766300 [0,2,1,0,0,0|1,0,0]=4 6374 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)O 62a_100000696291_100000766300 [0,2,1,0,0,0|1,0,0]=4 6375 B15R1.5445 COCSc1cc(cc(c1)C(=O)OC)O 62a_100000766300_100000696291 [0,2,1,0,0,0|1,0,0]=4 6376 B15R1.5772 CC(C)C(=O)c1cccc(c1)NCCO 27a_100000210304_100011350656 [0,2,1,0,0,0|1,0,0]=4 6377 B15R1.5772 CCCNc1cccc(c1)C(=O)N(C)C 34a_100000246196_100000210303 [0,2,1,0,0,0|1,0,0]=4 6378 B15R1.5772 CCCNc1cccc(c1)C(=O)N(C)C 7a_100000246196_100000210303 [0,2,1,0,0,0|1,0,0]=4 6379 B15R1.5772 CCNCc1cccc(c1)C(=O)N(C)C 2230a_100000737882_100000210202 [0,2,1,0,0,0|1,0,0]=4 6380 B15R1.5772 CCNCc1cccc(c1)C(=O)N(C)C 2230a_100015525214_100000743481 [0,2,1,0,0,0|1,0,0]=4 6381 B15R1.5772 CCNCc1cccc(c1)C(=O)N(C)C 34a_100000737882_100000210202 [0,2,1,0,0,0|1,0,0]=4 6382 B15R1.5772 CN(C)C(=O)c1cccc(c1)NCCF 34a_100000246196_100011217306 [0,2,1,0,0,0|1,0,0]=4 6383 B15R1.5772 CN(C)C(=O)c1cccc(c1)NCCF 7a_100000246196_100011217306 [0,2,1,0,0,0|1,0,0]=4 6384 B15R1.5772 CN(C)C(=O)c1cccc(c1)NCCO 34a_100000246196_100000211926 [0,2,1,0,0,0|1,0,0]=4 6385 B15R1.5772 CN(C)C(=O)c1cccc(c1)NCCO 7a_100000246196_100000211926 [0,2,1,0,0,0|1,0,0]=4 6386 B15R1.5772 CSCNc1cccc(c1)C(=O)N(C)C 34a_100000246196_100011218213 [0,2,1,0,0,0|1,0,0]=4 6387 B15R1.12147 CCCCc1ccc(c(c1)C(=O)OC)Br 271570a_100020621405_100012340073 [0,2,1,0,0,0|1,0,0]=4 6388 B15R1.12147 CCCCc1ccc(c(c1)C(=O)OC)C 271570a_100020621405_100012360116 [0,2,1,0,0,0|1,0,0]=4 6389 B15R1.12147 CCCCc1ccc(c(c1)C(=O)OC)Cl 271570a_100020621405_100012353682 [0,2,1,0,0,0|1,0,0]=4 6390 B15R1.12147 CCCCc1ccc(c(c1)C(=O)OC)F 271570a_100020621405_100000154357 [0,2,1,0,0,0|1,0,0]=4 6391 B15R1.12147 CCCCc1ccc(c(c1)C(=O)OC)N 271570a_100020621405_100000212070 [0,2,1,0,0,0|1,0,0]=4 6392 B15R1.12147 CCCCc1ccc(c(c1)C(=O)OC)O 271570a_100020621405_100000149868 [0,2,1,0,0,0|1,0,0]=4 6393 B15R1.12147 CCCNc1ccc(c(c1)C(=O)NC)Cl 2230a_100000742274_100000210303 [0,2,1,0,0,0|1,0,0]=4 6394 B15R1.12147 CCCNc1ccc(c(c1)C(=O)NC)Cl 34a_100000742274_100000210303 [0,2,1,0,0,0|1,0,0]=4 6395 B15R1.12147 CCCNc1ccc(c(c1)C(=O)NC)F 2230a_100000747870_100000210303 [0,2,1,0,0,0|1,0,0]=4 6396 B15R1.12147 CCCNc1ccc(c(c1)C(=O)NC)F 34a_100000747870_100000210303 [0,2,1,0,0,0|1,0,0]=4 6397 B15R1.12147 CCCNc1ccc(c(c1)C(=O)NC)F 7a_100000747870_100000210303 [0,2,1,0,0,0|1,0,0]=4 6398 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)Br 34a_100010230369_100000210303 [0,2,1,0,0,0|1,0,0]=4 6399 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)Br 7a_100010230369_100000210303 [0,2,1,0,0,0|1,0,0]=4 6400 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)C 34a_100012002527_100000210303 [0,2,1,0,0,0|1,0,0]=4 6401 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)C 7a_100012002527_100000210303 [0,2,1,0,0,0|1,0,0]=4 6402 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)Cl 34a_100012001761_100000210303 [0,2,1,0,0,0|1,0,0]=4 6403 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)Cl 7a_100012001761_100000210303 [0,2,1,0,0,0|1,0,0]=4 6404 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)F 34a_100009856154_100000210303 [0,2,1,0,0,0|1,0,0]=4 6405 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)F 7a_100009856154_100000210303 [0,2,1,0,0,0|1,0,0]=4 6406 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)I 34a_200009888904_100000210303 [0,2,1,0,0,0|1,0,0]=4 6407 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)I 7a_200009888904_100000210303 [0,2,1,0,0,0|1,0,0]=4 6408 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)N 34a_100000694981_100000210303 [0,2,1,0,0,0|1,0,0]=4 6409 B15R1.12147 CCCOc1ccc(c(c1)C(=O)OC)N 7a_100000694981_100000210303 [0,2,1,0,0,0|1,0,0]=4 6410 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)Br 62a_100000210303_100012340073 [0,2,1,0,0,0|1,0,0]=4 6411 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)Br 62a_100012340073_100000210303 [0,2,1,0,0,0|1,0,0]=4 6412 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)C 62a_100000210303_100012360116 [0,2,1,0,0,0|1,0,0]=4 6413 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)C 62a_100012360116_100000210303 [0,2,1,0,0,0|1,0,0]=4 6414 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)Cl 62a_100000210303_100012353682 [0,2,1,0,0,0|1,0,0]=4 6415 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)Cl 62a_100012353682_100000210303 [0,2,1,0,0,0|1,0,0]=4 6416 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)F 62a_100000210303_100000216675 [0,2,1,0,0,0|1,0,0]=4 6417 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)F 62a_100000216675_100000210303 [0,2,1,0,0,0|1,0,0]=4 6418 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)N 62a_100000212070_100000210303 [0,2,1,0,0,0|1,0,0]=4 6419 B15R1.12147 CCCSc1ccc(c(c1)C(=O)OC)O 62a_100000210303_100000149868 [0,2,1,0,0,0|1,0,0]=4 6420 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)Br 2230a_100015525214_200012349814 [0,2,1,0,0,0|0,0,0]=3 6421 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)Br 270004a_100015525214_100013328361 [0,2,1,0,0,0|0,0,0]=3 6422 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)C 270004a_100015525214_100010280812 [0,2,1,0,0,0|0,0,0]=3 6423 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)Cl 2230a_100015525214_100010269346 [0,2,1,0,0,0|0,0,0]=3 6424 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)Cl 270004a_100015525214_200010632534 [0,2,1,0,0,0|0,0,0]=3 6425 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)F 2230a_100015525214_200013328350 [0,2,1,0,0,0|0,0,0]=3 6426 B15R1.12147 CCNCc1ccc(c(c1)C(=O)OC)F 270004a_100015525214_100012056738 [0,2,1,0,0,0|0,0,0]=3 6427 B15R1.12147 CCOCc1ccc(c(c1)C(=O)OC)Br 34a_100121572206_200012349814 [0,2,1,0,0,0|1,0,0]=4 6428 B15R1.12147 CCOCc1ccc(c(c1)C(=O)OC)Cl 34a_100121572206_100010269346 [0,2,1,0,0,0|1,0,0]=4 6429 B15R1.12147 CCOCc1ccc(c(c1)C(=O)OC)F 34a_100009832128_100000210202 [0,2,1,0,0,0|1,0,0]=4 6430 B15R1.12147 CCOCc1ccc(c(c1)C(=O)OC)F 34a_100121572206_200013328350 [0,2,1,0,0,0|1,0,0]=4 6431 B15R1.12147 CCOCc1ccc(c(c1)C(=O)OC)F 7a_100009832128_100000210202 [0,2,1,0,0,0|1,0,0]=4 6432 B15R1.12147 CCSCc1ccc(c(c1)C(=O)OC)Br 62a_100000210202_200012349814 [0,2,1,0,0,0|1,0,0]=4 6433 B15R1.12147 CCSCc1ccc(c(c1)C(=O)OC)Br 62a_200012349814_100000210202 [0,2,1,0,0,0|1,0,0]=4 6434 B15R1.12147 CCSCc1ccc(c(c1)C(=O)OC)Cl 62a_100000210202_100010269346 [0,2,1,0,0,0|1,0,0]=4 6435 B15R1.12147 CCSCc1ccc(c(c1)C(=O)OC)Cl 62a_100010269346_100000210202 [0,2,1,0,0,0|1,0,0]=4 6436 B15R1.12147 CCSCc1ccc(c(c1)C(=O)OC)F 62a_100000210202_200013328350 [0,2,1,0,0,0|1,0,0]=4 6437 B15R1.12147 CCSCc1ccc(c(c1)C(=O)OC)F 62a_200013328350_100000210202 [0,2,1,0,0,0|1,0,0]=4 6438 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCCF 2230a_100000742274_100011217306 [0,2,1,0,0,0|1,0,0]=4 6439 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCCF 34a_100000742274_100011217306 [0,2,1,0,0,0|1,0,0]=4 6440 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCCO 2230a_100000742274_100000211926 [0,2,1,0,0,0|1,0,0]=4 6441 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCCO 34a_100000742274_100000211926 [0,2,1,0,0,0|1,0,0]=4 6442 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCOC 2230a_100000742274_100000766300 [0,2,1,0,0,0|1,0,0]=4 6443 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCSC 2230a_100000742274_100011218213 [0,2,1,0,0,0|1,0,0]=4 6444 B15R1.12147 CNC(=O)c1cc(ccc1Cl)NCSC 34a_100000742274_100011218213 [0,2,1,0,0,0|1,0,0]=4 6445 B15R1.12147 CNC(=O)c1cc(ccc1F)NCCF 2230a_100000747870_100011217306 [0,2,1,0,0,0|1,0,0]=4 6446 B15R1.12147 CNC(=O)c1cc(ccc1F)NCCF 34a_100000747870_100011217306 [0,2,1,0,0,0|1,0,0]=4 6447 B15R1.12147 CNC(=O)c1cc(ccc1F)NCCF 7a_100000747870_100011217306 [0,2,1,0,0,0|1,0,0]=4 6448 B15R1.12147 CNC(=O)c1cc(ccc1F)NCCO 2230a_100000747870_100000211926 [0,2,1,0,0,0|1,0,0]=4 6449 B15R1.12147 CNC(=O)c1cc(ccc1F)NCCO 34a_100000747870_100000211926 [0,2,1,0,0,0|1,0,0]=4 6450 B15R1.12147 CNC(=O)c1cc(ccc1F)NCCO 7a_100000747870_100000211926 [0,2,1,0,0,0|1,0,0]=4 6451 B15R1.12147 CNC(=O)c1cc(ccc1F)NCOC 2230a_100000747870_100000766300 [0,2,1,0,0,0|1,0,0]=4 6452 B15R1.12147 CNC(=O)c1cc(ccc1F)NCSC 2230a_100000747870_100011218213 [0,2,1,0,0,0|1,0,0]=4 6453 B15R1.12147 CNC(=O)c1cc(ccc1F)NCSC 34a_100000747870_100011218213 [0,2,1,0,0,0|1,0,0]=4 6454 B15R1.12147 COC(=O)c1cc(ccc1Br)OCCF 34a_100010230369_100011217306 [0,2,1,0,0,0|1,0,0]=4 6455 B15R1.12147 COC(=O)c1cc(ccc1Br)OCCF 7a_100010230369_100011217306 [0,2,1,0,0,0|1,0,0]=4 6456 B15R1.12147 COC(=O)c1cc(ccc1Br)OCCO 34a_100010230369_100000211926 [0,2,1,0,0,0|1,0,0]=4 6457 B15R1.12147 COC(=O)c1cc(ccc1Br)OCCO 7a_100010230369_100000211926 [0,2,1,0,0,0|1,0,0]=4 6458 B15R1.12147 COC(=O)c1cc(ccc1Br)OCSC 34a_100010230369_100011218213 [0,2,1,0,0,0|1,0,0]=4 6459 B15R1.12147 COC(=O)c1cc(ccc1Br)SCCF 62a_100011217306_100012340073 [0,2,1,0,0,0|1,0,0]=4 6460 B15R1.12147 COC(=O)c1cc(ccc1Br)SCCF 62a_100012340073_100011217306 [0,2,1,0,0,0|1,0,0]=4 6461 B15R1.12147 COC(=O)c1cc(ccc1Br)SCCO 62a_100000211926_100012340073 [0,2,1,0,0,0|1,0,0]=4 6462 B15R1.12147 COC(=O)c1cc(ccc1Br)SCCO 62a_100012340073_100000211926 [0,2,1,0,0,0|1,0,0]=4 6463 B15R1.12147 COC(=O)c1cc(ccc1Br)SCSC 62a_100011218213_100012340073 [0,2,1,0,0,0|1,0,0]=4 6464 B15R1.12147 COC(=O)c1cc(ccc1Br)SCSC 62a_100012340073_100011218213 [0,2,1,0,0,0|1,0,0]=4 6465 B15R1.12147 COC(=O)c1cc(ccc1C)OCCF 34a_100012002527_100011217306 [0,2,1,0,0,0|1,0,0]=4 6466 B15R1.12147 COC(=O)c1cc(ccc1C)OCCF 7a_100012002527_100011217306 [0,2,1,0,0,0|1,0,0]=4 6467 B15R1.12147 COC(=O)c1cc(ccc1C)OCCO 34a_100012002527_100000211926 [0,2,1,0,0,0|1,0,0]=4 6468 B15R1.12147 COC(=O)c1cc(ccc1C)OCCO 7a_100012002527_100000211926 [0,2,1,0,0,0|1,0,0]=4 6469 B15R1.12147 COC(=O)c1cc(ccc1C)OCSC 34a_100012002527_100011218213 [0,2,1,0,0,0|1,0,0]=4 6470 B15R1.12147 COC(=O)c1cc(ccc1C)SCCF 62a_100011217306_100012360116 [0,2,1,0,0,0|1,0,0]=4 6471 B15R1.12147 COC(=O)c1cc(ccc1C)SCCF 62a_100012360116_100011217306 [0,2,1,0,0,0|1,0,0]=4 6472 B15R1.12147 COC(=O)c1cc(ccc1C)SCCO 62a_100000211926_100012360116 [0,2,1,0,0,0|1,0,0]=4 6473 B15R1.12147 COC(=O)c1cc(ccc1C)SCCO 62a_100012360116_100000211926 [0,2,1,0,0,0|1,0,0]=4 6474 B15R1.12147 COC(=O)c1cc(ccc1C)SCSC 62a_100011218213_100012360116 [0,2,1,0,0,0|1,0,0]=4 6475 B15R1.12147 COC(=O)c1cc(ccc1C)SCSC 62a_100012360116_100011218213 [0,2,1,0,0,0|1,0,0]=4 6476 B15R1.12147 COC(=O)c1cc(ccc1Cl)OCCF 34a_100012001761_100011217306 [0,2,1,0,0,0|1,0,0]=4 6477 B15R1.12147 COC(=O)c1cc(ccc1Cl)OCCF 7a_100012001761_100011217306 [0,2,1,0,0,0|1,0,0]=4 6478 B15R1.12147 COC(=O)c1cc(ccc1Cl)OCCO 34a_100012001761_100000211926 [0,2,1,0,0,0|1,0,0]=4 6479 B15R1.12147 COC(=O)c1cc(ccc1Cl)OCCO 7a_100012001761_100000211926 [0,2,1,0,0,0|1,0,0]=4 6480 B15R1.12147 COC(=O)c1cc(ccc1Cl)OCSC 34a_100012001761_100011218213 [0,2,1,0,0,0|1,0,0]=4 6481 B15R1.12147 COC(=O)c1cc(ccc1Cl)SCCF 62a_100011217306_100012353682 [0,2,1,0,0,0|1,0,0]=4 6482 B15R1.12147 COC(=O)c1cc(ccc1Cl)SCCF 62a_100012353682_100011217306 [0,2,1,0,0,0|1,0,0]=4 6483 B15R1.12147 COC(=O)c1cc(ccc1Cl)SCCO 62a_100000211926_100012353682 [0,2,1,0,0,0|1,0,0]=4 6484 B15R1.12147 COC(=O)c1cc(ccc1Cl)SCCO 62a_100012353682_100000211926 [0,2,1,0,0,0|1,0,0]=4 6485 B15R1.12147 COC(=O)c1cc(ccc1Cl)SCSC 62a_100011218213_100012353682 [0,2,1,0,0,0|1,0,0]=4 6486 B15R1.12147 COC(=O)c1cc(ccc1Cl)SCSC 62a_100012353682_100011218213 [0,2,1,0,0,0|1,0,0]=4 6487 B15R1.12147 COC(=O)c1cc(ccc1F)OCCF 34a_100009856154_100011217306 [0,2,1,0,0,0|1,0,0]=4 6488 B15R1.12147 COC(=O)c1cc(ccc1F)OCCF 7a_100009856154_100011217306 [0,2,1,0,0,0|1,0,0]=4 6489 B15R1.12147 COC(=O)c1cc(ccc1F)OCCO 34a_100009856154_100000211926 [0,2,1,0,0,0|1,0,0]=4 6490 B15R1.12147 COC(=O)c1cc(ccc1F)OCCO 7a_100009856154_100000211926 [0,2,1,0,0,0|1,0,0]=4 6491 B15R1.12147 COC(=O)c1cc(ccc1F)OCSC 34a_100009856154_100011218213 [0,2,1,0,0,0|1,0,0]=4 6492 B15R1.12147 COC(=O)c1cc(ccc1F)SCCF 62a_100000216675_100011217306 [0,2,1,0,0,0|1,0,0]=4 6493 B15R1.12147 COC(=O)c1cc(ccc1F)SCCF 62a_100011217306_100000216675 [0,2,1,0,0,0|1,0,0]=4 6494 B15R1.12147 COC(=O)c1cc(ccc1F)SCCO 62a_100000211926_100000216675 [0,2,1,0,0,0|1,0,0]=4 6495 B15R1.12147 COC(=O)c1cc(ccc1F)SCCO 62a_100000216675_100000211926 [0,2,1,0,0,0|1,0,0]=4 6496 B15R1.12147 COC(=O)c1cc(ccc1F)SCSC 62a_100000216675_100011218213 [0,2,1,0,0,0|1,0,0]=4 6497 B15R1.12147 COC(=O)c1cc(ccc1F)SCSC 62a_100011218213_100000216675 [0,2,1,0,0,0|1,0,0]=4 6498 B15R1.12147 COC(=O)c1cc(ccc1I)OCCF 34a_200009888904_100011217306 [0,2,1,0,0,0|1,0,0]=4 6499 B15R1.12147 COC(=O)c1cc(ccc1I)OCCF 7a_200009888904_100011217306 [0,2,1,0,0,0|1,0,0]=4 6500 B15R1.12147 COC(=O)c1cc(ccc1I)OCCO 34a_200009888904_100000211926 [0,2,1,0,0,0|1,0,0]=4 6501 B15R1.12147 COC(=O)c1cc(ccc1I)OCCO 7a_200009888904_100000211926 [0,2,1,0,0,0|1,0,0]=4 6502 B15R1.12147 COC(=O)c1cc(ccc1I)OCSC 34a_200009888904_100011218213 [0,2,1,0,0,0|1,0,0]=4 6503 B15R1.12147 COC(=O)c1cc(ccc1N)OCCF 34a_100000694981_100011217306 [0,2,1,0,0,0|1,0,0]=4 6504 B15R1.12147 COC(=O)c1cc(ccc1N)OCCF 7a_100000694981_100011217306 [0,2,1,0,0,0|1,0,0]=4 6505 B15R1.12147 COC(=O)c1cc(ccc1N)OCCO 34a_100000694981_100000211926 [0,2,1,0,0,0|1,0,0]=4 6506 B15R1.12147 COC(=O)c1cc(ccc1N)OCCO 7a_100000694981_100000211926 [0,2,1,0,0,0|1,0,0]=4 6507 B15R1.12147 COC(=O)c1cc(ccc1N)OCSC 34a_100000694981_100011218213 [0,2,1,0,0,0|1,0,0]=4 6508 B15R1.12147 COC(=O)c1cc(ccc1N)SCCF 62a_100000212070_100011217306 [0,2,1,0,0,0|1,0,0]=4 6509 B15R1.12147 COC(=O)c1cc(ccc1N)SCCO 62a_100000212070_100000211926 [0,2,1,0,0,0|1,0,0]=4 6510 B15R1.12147 COC(=O)c1cc(ccc1N)SCSC 62a_100000212070_100011218213 [0,2,1,0,0,0|1,0,0]=4 6511 B15R1.12147 COC(=O)c1cc(ccc1O)SCCF 62a_100011217306_100000149868 [0,2,1,0,0,0|1,0,0]=4 6512 B15R1.12147 COC(=O)c1cc(ccc1O)SCCO 62a_100000211926_100000149868 [0,2,1,0,0,0|1,0,0]=4 6513 B15R1.12147 COC(=O)c1cc(ccc1O)SCSC 62a_100011218213_100000149868 [0,2,1,0,0,0|1,0,0]=4 6514 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)Br 62a_100000766300_100012340073 [0,2,1,0,0,0|1,0,0]=4 6515 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)Br 62a_100012340073_100000766300 [0,2,1,0,0,0|1,0,0]=4 6516 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)C 62a_100000766300_100012360116 [0,2,1,0,0,0|1,0,0]=4 6517 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)C 62a_100012360116_100000766300 [0,2,1,0,0,0|1,0,0]=4 6518 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)Cl 62a_100000766300_100012353682 [0,2,1,0,0,0|1,0,0]=4 6519 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)Cl 62a_100012353682_100000766300 [0,2,1,0,0,0|1,0,0]=4 6520 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)F 62a_100000216675_100000766300 [0,2,1,0,0,0|1,0,0]=4 6521 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)F 62a_100000766300_100000216675 [0,2,1,0,0,0|1,0,0]=4 6522 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)N 62a_100000212070_100000766300 [0,2,1,0,0,0|1,0,0]=4 6523 B15R1.12147 COCSc1ccc(c(c1)C(=O)OC)O 62a_100000766300_100000149868 [0,2,1,0,0,0|1,0,0]=4 6524 B15R1.3625 C=Cc1cc(cc(c1)C(=O)OC)OCC 271570a_100011290941_200010223199 [0,2,1,0,0,0|1,0,0]=4 6525 B15R1.3625 CCNc1cc(nc(c1)C(=O)OC)OC 27a_100015525214_100010136341 [0,2,1,0,0,0|1,0,0]=4 6526 B15R1.3625 CCOc1cc(cc(c1)C(=O)OC)OC 34a_100000076322_100000210202 [0,2,1,0,0,0|1,0,0]=4 6527 B15R1.3625 CCOc1cc(cc(c1)C(=O)OC)OC 7a_100000076322_100000210202 [0,2,1,0,0,0|1,0,0]=4 6528 B15R1.3625 CCOc1cc(cc(c1)C(=O)OC)SC 62a_200000210301_200010223199 [0,2,1,0,0,0|1,0,0]=4 6529 B15R1.3625 CCOc1cc(cc(c1)C(=O)OC)SC 62a_200010223199_200000210301 [0,2,1,0,0,0|1,0,0]=4 6530 B15R1.3625 CCOc1cc(cc(c1)C(=O)OC)S[13CH3] 62a_200010223199_200025704644 [0,2,1,0,0,0|1,0,0]=4 6531 B15R1.3625 CCOc1cc(cc(c1)C(=O)OC)S[13CH3] 62a_200025704644_200010223199 [0,2,1,0,0,0|1,0,0]=4 6532 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)C#N 62a_100000210202_200010072370 [0,2,1,0,0,0|1,0,0]=4 6533 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)C=O 62a_100000210202_100010371122 [0,2,1,0,0,0|1,0,0]=4 6534 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)C=O 62a_100010371122_100000210202 [0,2,1,0,0,0|1,0,0]=4 6535 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)CN 62a_100000210202_100134615983 [0,2,1,0,0,0|1,0,0]=4 6536 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)CN 62a_100134615983_100000210202 [0,2,1,0,0,0|1,0,0]=4 6537 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)CO 62a_100000210202_100010232996 [0,2,1,0,0,0|1,0,0]=4 6538 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)CO 62a_100010232996_100000210202 [0,2,1,0,0,0|1,0,0]=4 6539 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)OC 62a_100000210202_200010233337 [0,2,1,0,0,0|1,0,0]=4 6540 B15R1.3625 CCSc1cc(cc(c1)C(=O)OC)OC 62a_200010233337_100000210202 [0,2,1,0,0,0|1,0,0]=4 6541 B15R1.3652 CCNc1cc(cc(c1)C(=O)C(C)C)F 27a_100015525214_100012353570 [0,2,1,0,0,0|1,0,0]=4 6542 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)Br 62a_100000210202_100012569200 [0,2,1,0,0,0|1,0,0]=4 6543 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)Br 62a_100012569200_100000210202 [0,2,1,0,0,0|1,0,0]=4 6544 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)F 62a_100000210202_100015527428 [0,2,1,0,0,0|1,0,0]=4 6545 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)F 62a_100015527428_100000210202 [0,2,1,0,0,0|1,0,0]=4 6546 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)N 62a_100000210202_100012257200 [0,2,1,0,0,0|1,0,0]=4 6547 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)N 62a_100012257200_100000210202 [0,2,1,0,0,0|1,0,0]=4 6548 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)O 62a_100000210202_200011012443 [0,2,1,0,0,0|1,0,0]=4 6549 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)C)O 62a_200011012443_100000210202 [0,2,1,0,0,0|1,0,0]=4 6550 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)F)C 62a_100000210202_200012928940 [0,2,1,0,0,0|1,0,0]=4 6551 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)F)C 62a_200012928940_100000210202 [0,2,1,0,0,0|1,0,0]=4 6552 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)F)F 62a_100000210202_100012362532 [0,2,1,0,0,0|1,0,0]=4 6553 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)F)F 62a_100012362532_100000210202 [0,2,1,0,0,0|1,0,0]=4 6554 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)F)N 62a_100000210202_100011794250 [0,2,1,0,0,0|1,0,0]=4 6555 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)F)N 62a_100011794250_100000210202 [0,2,1,0,0,0|1,0,0]=4 6556 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)N)C 62a_100000210202_100011356660 [0,2,1,0,0,0|1,0,0]=4 6557 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)N)C 62a_100011356660_100000210202 [0,2,1,0,0,0|1,0,0]=4 6558 B15R1.3689 CCSc1cc(c(c(c1)C(=O)OC)N)N 62a_100010127340_100000210202 [0,2,1,0,0,0|1,0,0]=4 6559 B15R1.9655 CCNc1ccc(c(c1)C(=O)N(C)C)Cl 34a_100000738984_100000210202 [0,2,1,0,0,0|1,0,0]=4 6560 B15R1.9655 CCNc1ccc(c(c1)C(=O)N(C)C)Cl 7a_100000738984_100000210202 [0,2,1,0,0,0|1,0,0]=4 6561 B15R1.9655 CCNc1ccc(c(c1)C(=O)N(C)C)O 34a_200000118641_100000210202 [0,2,1,0,0,0|1,0,0]=4 6562 B15R1.9647 CCOc1ccc(c(c1)C(=O)OC)OC 34a_200009863118_200000210301 [0,2,1,0,0,0|1,0,0]=4 6563 B15R1.9647 CCOc1ccc(c(c1)C(=O)OC)OC 7a_200009863118_200000210301 [0,2,1,0,0,0|1,0,0]=4 6564 B15R1.9647 CCOc1ccc(c(c1)C(=O)OC)O[13CH3] 34a_200009863118_200025704644 [0,2,1,0,0,0|1,0,0]=4 6565 B15R1.9647 CCOc1ccc(c(c1)C(=O)OC)O[13CH3] 7a_200009863118_200025704644 [0,2,1,0,0,0|1,0,0]=4 6566 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)C#N 62a_100000210202_100010201442 [0,2,1,0,0,0|1,0,0]=4 6567 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)C=O 62a_100012355575_100000210202 [0,2,1,0,0,0|1,0,0]=4 6568 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)CC 62a_100000210202_100012360140 [0,2,1,0,0,0|1,0,0]=4 6569 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)CC 62a_100012360140_100000210202 [0,2,1,0,0,0|1,0,0]=4 6570 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)CN 62a_100000210202_100016992124 [0,2,1,0,0,0|1,0,0]=4 6571 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)CN 62a_100016992124_100000210202 [0,2,1,0,0,0|1,0,0]=4 6572 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)NC 62a_200000216482_100000210202 [0,2,1,0,0,0|1,0,0]=4 6573 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)OC 62a_100000210202_100012047238 [0,2,1,0,0,0|1,0,0]=4 6574 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)OC 62a_100012047238_100000210202 [0,2,1,0,0,0|1,0,0]=4 6575 B15R1.9647 CCSc1ccc(c(c1)C(=O)OC)SC 62a_200010204078_100000210202 [0,2,1,0,0,0|1,0,0]=4 6576 B15R1.814 C=C(C)c1ccc(cc1N)C(=O)OCC 271570a_100000694244_200011450955 [0,2,1,0,0,0|0,0,1]=4 6577 B15R1.1245 CCc1ccc(cc1Br)C(=O)CCOC 1458a_100012340589_100000233755 [0,2,1,0,0,0|1,0,0]=4 6578 B15R1.1245 CCc1ccc(cc1O)C(=O)CCOC 1458a_100000089006_100000233755 [0,2,1,0,0,0|1,0,0]=4 6579 B15R1.11739 C=C(C)c1cc(c(cc1N)C(=O)OC)F 271570a_100000694244_100000760059 [0,2,1,0,0,0|0,0,1]=4 6580 B15R1.11739 COC(=O)c1cc(c(cc1N)C(C)C)O 271570a_203496583355_200010211380 [0,2,1,0,0,0|1,0,0]=4 6581 B15R1.10149 COC(=O)c1c(cc(c(c1F)N)SC)F 62a_100012702389_200000210301 [0,2,1,0,0,0|1,0,0]=4 6582 B15R1.10149 COC(=O)c1c(cc(c(c1F)N)SC)F 62a_200000210301_100012702389 [0,2,1,0,0,0|1,0,0]=4 6583 B15R1.10149 COC(=O)c1c(cc(c(c1F)N)S[13CH3])F 62a_100012702389_200025704644 [0,2,1,0,0,0|1,0,0]=4 6584 B15R1.10149 COC(=O)c1c(cc(c(c1F)N)S[13CH3])F 62a_200025704644_100012702389 [0,2,1,0,0,0|1,0,0]=4 6585 B15R2.627 C=C(C)c1ccc2c(c1C)NCCO2 271570a_100000694244_100010271709 [1,1,0,0,0,1|1,0,0]=4 6586 B15R2.984 C=C(C)c1cc2c(cc1F)OCCN2 271570a_100000694244_100012568745 [1,1,0,0,0,1|1,0,0]=4 6587 B15R2.984 CC(=O)c1cc2c(cc1Br)OCCO2 1458a_200011264633_200000210301 [1,1,0,0,0,1|1,0,0]=4 6588 B15R2.984 CC(=O)c1cc2c(cc1C)OCCO2 1458a_100000089694_200000210301 [1,1,0,0,0,1|1,0,0]=4 6589 B15R2.984 CC(=O)c1cc2c(cc1O)OCCO2 1458a_100000107476_200000210301 [1,1,0,0,0,1|1,0,0]=4 6590 B15R2.984 CC(=O)c1cc2c(cc1O)OCCO2 271570a_203496583355_100011218560 [1,1,0,0,0,1|1,0,0]=4 6591 B15R2.984 Cc1cc2c(cc1C(=O)[13CH3])OCCO2 1458a_100000089694_200025704644 [1,1,0,0,0,1|1,0,0]=4 6592 B15R2.984 [13CH3]C(=O)c1cc2c(cc1Br)OCCO2 1458a_200011264633_200025704644 [1,1,0,0,0,1|1,0,0]=4 6593 B15R2.984 [13CH3]C(=O)c1cc2c(cc1O)OCCO2 1458a_100000107476_200025704644 [1,1,0,0,0,1|1,0,0]=4 6594 B15R2.7174 C=C(C)c1ccc2c(c1)CN(CC2)C 271570a_100000694244_100010157284 [1,1,0,0,0,1|1,0,0]=4 6595 B15R2.7174 C=C(C)c1ccc2c(c1)NC(=O)CC2 271570a_100000694244_100000763451 [1,1,0,0,0,1|1,0,0]=4 6596 B15R2.7174 CC(=O)c1ccc2c(c1)NC(=O)CO2 1458a_100000187493_200000210301 [1,1,0,0,0,1|0,0,1]=4 6597 B15R2.7174 CC(=O)c1ccc2c(c1)NC(=O)CS2 1458a_100000010532_200000210301 [1,1,0,0,0,1|0,0,1]=4 6598 B15R2.7174 [13CH3]C(=O)c1ccc2c(c1)NC(=O)CO2 1458a_100000187493_200025704644 [1,1,0,0,0,1|0,0,1]=4 6599 B15R2.7174 [13CH3]C(=O)c1ccc2c(c1)NC(=O)CS2 1458a_100000010532_200025704644 [1,1,0,0,0,1|0,0,1]=4 6600 B15R2.7180 C=C(C)c1ccc2c(c1)CNC(C2)C 271570a_100000694244_200000706634 [1,1,0,0,0,1|1,0,0]=4 6601 B15R2.13598 C=C(C)c1ccc2c(c1)NCCC2=O 271570a_100000694244_100010157303 [1,1,0,0,0,1|1,0,0]=4 6602 B15R2.13598 C=C(C)c1ccc2c(c1)NCCN2C 271570a_100000694244_100011551014 [1,1,0,0,0,1|1,0,0]=4 6603 B15R2.13598 CC(=O)c1ccc2c(c1)OCCN2C 1458a_100000067097_200000210301 [1,1,0,0,0,1|1,0,0]=4 6604 B15R2.13598 CN1CCOc2c1ccc(c2)C(=O)[13CH3] 1458a_100000067097_200025704644 [1,1,0,0,0,1|1,0,0]=4 6605 B15R2.14951 C=C(C)c1cc(c2c(c1)CNCC2)C 271570a_100000694244_100016068755 [1,1,0,0,0,1|1,0,0]=4 6606 B15R2.61353 C=C(C)c1ccc2c(c1)C(=O)NCC2 271570a_100000694244_100000688804 [1,1,0,0,0,1|1,0,0]=4 6607 B15R2.61353 CC(=O)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_200000210301 [1,1,0,0,0,1|0,0,0]=3 6608 B15R2.61353 [13CH3]C(=O)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_200025704644 [1,1,0,0,0,1|0,0,0]=3 6609 B15R2.352 CCOCc1ccc2c(c1)CNCC2 34a_100138411858_100000210202 [1,1,0,0,0,1|0,0,1]=4 6610 B15R2.352 COCSc1ccc2c(c1)CNCC2 62a_100000766300_100015189961 [1,1,0,0,0,1|0,0,1]=4 6611 B15R2.352 COCSc1ccc2c(c1)CNCC2 62a_100015189961_100000766300 [1,1,0,0,0,1|0,0,1]=4 6612 B15R2.352 COCSc1ccc2c(c1)NCCC2 62a_100000766300_100010196366 [1,1,0,0,0,1|0,0,1]=4 6613 B15R2.352 COCSc1ccc2c(c1)NCCC2 62a_100010196366_100000766300 [1,1,0,0,0,1|0,0,1]=4 6614 B15R2.352 COCSc1ccc2c(c1)NCCO2 62a_100000766300_100000708519 [1,1,0,0,0,1|0,0,1]=4 6615 B15R2.352 COCSc1ccc2c(c1)NCCS2 62a_100000766300_100013243616 [1,1,0,0,0,1|0,0,1]=4 6616 B15R2.352 FCOCc1ccc2c(c1)CNCC2 34a_100138411858_100015361967 [1,1,0,0,0,1|0,0,1]=4 6617 B15R2.886 CC=Cc1cc(c2c(c1)CNCC2)C 271570a_100016259895_100016068755 [1,1,0,0,0,1|1,0,0]=4 6618 B15R2.888 CC=Cc1cc2c(cc1F)OCCN2 271570a_100016259895_100012568745 [1,1,0,0,0,1|1,0,0]=4 6619 B15R2.1282 CC=Cc1ccc2c(c1)CN(CC2)C 271570a_100016259895_100010157284 [1,1,0,0,0,1|1,0,0]=4 6620 B15R2.1282 CC=Cc1ccc2c(c1)NC(=O)CC2 271570a_100016259895_100000763451 [1,1,0,0,0,1|1,0,0]=4 6621 B15R2.1290 CC=Cc1ccc2c(c1)C(=O)NCC2 271570a_100016259895_100000688804 [1,1,0,0,0,1|1,0,0]=4 6622 B15R2.1668 CC(=Cc1ccc2c(c1)CNCC2)C 271570a_100102525489_100015189961 [1,1,0,0,0,1|1,0,0]=4 6623 B15R2.1668 CC(=Cc1ccc2c(c1)NCCC2)C 271570a_100102525489_100010196366 [1,1,0,0,0,1|1,0,0]=4 6624 B15R2.1668 CC(=Cc1ccc2c(c1)NCCO2)C 271570a_100102525489_100000708519 [1,1,0,0,0,1|1,0,0]=4 6625 B15R2.1668 CC(=Cc1ccc2c(c1)NCCS2)C 271570a_100102525489_100013243616 [1,1,0,0,0,1|1,0,0]=4 6626 B15R2.2220 CC=Cc1ccc2c(c1C)NCCO2 271570a_100016259895_100010271709 [1,1,0,0,0,1|1,0,0]=4 6627 B15R2.10252 CC=Cc1ccc2c(c1)CNC(C2)C 271570a_100016259895_200000706634 [1,1,0,0,0,1|1,0,0]=4 6628 B15R2.54379 CC=Cc1ccc2c(c1)NCCC2=O 271570a_100016259895_100010157303 [1,1,0,0,0,1|1,0,0]=4 6629 B15R2.54379 CC=Cc1ccc2c(c1)NCCN2C 271570a_100016259895_100011551014 [1,1,0,0,0,1|1,0,0]=4 6630 B15R2.6706 CC(=O)c1ccc2c(c1O[13CH3])CCC2 34a_100010635854_200025704644 [1,2,0,0,0,0|1,0,0]=4 6631 B15R2.6706 CC(=O)c1ccc2c(c1O[13CH3])CCC2 7a_100010635854_200025704644 [1,2,0,0,0,0|1,0,0]=4 6632 B15R2.6706 COc1c(ccc2c1CCC2)C(=O)C 34a_100010635854_200000210301 [1,2,0,0,0,0|1,0,0]=4 6633 B15R2.6706 COc1c(ccc2c1CCC2)C(=O)C 7a_100010635854_200000210301 [1,2,0,0,0,0|1,0,0]=4 6634 B15R2.2123 C#CCOCc1ccc2c(c1)NCC2 34a_100000694088_100000184674 [1,2,0,0,0,0|0,0,1]=4 6635 B15R2.2123 C/C=C/COc1ccc2c(c1)NCC2 34a_100020636427_100102629194 [1,2,0,0,0,0|1,0,0]=4 6636 B15R2.2123 C/C=C/CSc1ccc2c(c1)NCC2 62a_100000754641_100102629194 [1,2,0,0,0,0|1,0,0]=4 6637 B15R2.2123 C/C=C/CSc1ccc2c(c1)NCC2 62a_100102629194_100000754641 [1,2,0,0,0,0|1,0,0]=4 6638 B15R2.2123 C=CCOCc1ccc2c(c1)NCC2 34a_100000694088_100015514636 [1,2,0,0,0,0|0,0,1]=4 6639 B15R2.2123 CC=CCOc1ccc2c(c1)NCC2 34a_100020636427_100000070051 [1,2,0,0,0,0|1,0,0]=4 6640 B15R2.2123 CC=CCSc1ccc2c(c1)NCC2 62a_100000070051_100000754641 [1,2,0,0,0,0|1,0,0]=4 6641 B15R2.2123 CC=CCSc1ccc2c(c1)NCC2 62a_100000754641_100000070051 [1,2,0,0,0,0|1,0,0]=4 6642 B15R2.2123 CCCC=Cc1ccc2c(c1)NCC2 271570a_100016258520_100000754641 [1,2,0,0,0,0|1,0,0]=4 6643 B15R2.2123 CCCOCc1ccc2c(c1)NCC2 34a_100000694088_100000210303 [1,2,0,0,0,0|0,0,1]=4 6644 B15R2.2123 CCOC=Cc1cc2c(cn1)CCN2 271570a_100016256518_100020639910 [1,2,0,0,0,0|1,0,0]=4 6645 B15R2.2123 CCOC=Cc1ccc2c(c1)CCC2 271570a_100016256518_100000745594 [1,2,0,0,0,0|1,0,0]=4 6646 B15R2.2123 CCOC=Cc1ccc2c(c1)NCC2 271570a_100016256518_100000754641 [1,2,0,0,0,0|0,0,0]=3 6647 B15R2.2123 CCOC=Cc1ccc2c(c1)OCC2 271570a_100016256518_100009818566 [1,2,0,0,0,0|1,0,0]=4 6648 B15R2.2123 CCOC=Cc1cnc2c(c1)NCC2 271570a_100016256518_100000698607 [1,2,0,0,0,0|1,0,0]=4 6649 B15R2.2123 CCOCSc1ccc2c(c1)NCC2 62a_100000739092_100000754641 [1,2,0,0,0,0|0,0,1]=4 6650 B15R2.2123 CCOCSc1ccc2c(c1)NCC2 62a_100000754641_100000739092 [1,2,0,0,0,0|0,0,1]=4 6651 B15R2.2123 COCC=Cc1cc2c(cn1)CCN2 271570a_100016286323_100020639910 [1,2,0,0,0,0|1,0,0]=4 6652 B15R2.2123 COCC=Cc1ccc2c(c1)CCC2 271570a_100016286323_100000745594 [1,2,0,0,0,0|1,0,0]=4 6653 B15R2.2123 COCC=Cc1ccc2c(c1)NCC2 271570a_100016286323_100000754641 [1,2,0,0,0,0|0,0,0]=3 6654 B15R2.2123 COCC=Cc1ccc2c(c1)OCC2 271570a_100016286323_100009818566 [1,2,0,0,0,0|1,0,0]=4 6655 B15R2.2123 COCC=Cc1cnc2c(c1)NCC2 271570a_100016286323_100000698607 [1,2,0,0,0,0|1,0,0]=4 6656 B15R2.2123 COCCOc1ccc2c(c1)NCC2 34a_100020636427_100011201679 [1,2,0,0,0,0|0,0,1]=4 6657 B15R2.2123 COCCSc1ccc2c(c1)NCC2 62a_100000233755_100000754641 [1,2,0,0,0,0|0,0,1]=4 6658 B15R2.2123 COCCSc1ccc2c(c1)NCC2 62a_100000754641_100000233755 [1,2,0,0,0,0|0,0,1]=4 6659 B15R2.2123 CSCOCc1ccc2c(c1)NCC2 34a_100000694088_100011218213 [1,2,0,0,0,0|0,0,1]=4 6660 B15R2.2123 FCCOCc1ccc2c(c1)NCC2 34a_100000694088_100011217306 [1,2,0,0,0,0|0,0,1]=4 6661 B15R2.2123 O=CCOCc1ccc2c(c1)NCC2 34a_100000694088_200009817547 [1,2,0,0,0,0|0,0,1]=4 6662 B15R2.2123 OCCOCc1ccc2c(c1)NCC2 34a_100000694088_100000211926 [1,2,0,0,0,0|0,0,1]=4 6663 B15R2.7688 CC(C)C=Cc1ccc2c(c1)NCC2 271570a_100016257149_100000754641 [1,2,0,0,0,0|1,0,0]=4 6664 B15R2.7688 CC(C)OCc1ccc2c(c1)NCC2 34a_100000694088_100000210206 [1,2,0,0,0,0|0,0,1]=4 6665 B15R2.7688 CC(O)C=Cc1ccc2c(c1)NCC2 271570a_200011019289_100000754641 [1,2,0,0,0,0|1,0,0]=4 6666 B15R2.3423 C#CCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000753159 [0,2,0,0,1,0|1,0,0]=4 6667 B15R2.3423 C#CCNC(=O)c1ccc2c(c1)CC2 11a_100000212058_100000137882 [0,2,0,0,1,0|1,0,0]=4 6668 B15R2.3423 C#CCNC(=O)c1ccc2c(c1)CC2 1626a_100000212058_100000137882 [0,2,0,0,1,0|1,0,0]=4 6669 B15R2.3423 C#CCNC(=O)c1ccc2c(c1)CC2 240690a_100000212058_100000137882 [0,2,0,0,1,0|1,0,0]=4 6670 B15R2.3423 C#CCNC(=O)c1ccc2c(c1)CC2 527a_100000212058_100000137882 [0,2,0,0,1,0|1,0,0]=4 6671 B15R2.3423 C/C=C/CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100102629194 [0,2,0,0,1,0|1,0,0]=4 6672 B15R2.3423 C=CCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000754431 [0,2,0,0,1,0|1,0,0]=4 6673 B15R2.3423 C=CCNC(=O)c1ccc2c(c1)CC2 1626a_100020586998_100000137882 [0,2,0,0,1,0|1,0,0]=4 6674 B15R2.3423 C=CCNC(=O)c1ccc2c(c1)CC2 240690a_100020586998_100000137882 [0,2,0,0,1,0|1,0,0]=4 6675 B15R2.3423 C=CCNC(=O)c1ccc2c(c1)CC2 527a_100020586998_100000137882 [0,2,0,0,1,0|1,0,0]=4 6676 B15R2.3423 CC#CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000748600 [0,2,0,0,1,0|1,0,0]=4 6677 B15R2.3423 CC=CCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000070051 [0,2,0,0,1,0|1,0,0]=4 6678 B15R2.3423 CCCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210211 [0,2,0,0,1,0|1,0,0]=4 6679 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 11a_100020643023_100000137882 [0,2,0,0,1,0|1,0,0]=4 6680 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 1626a_100020643023_100000137882 [0,2,0,0,1,0|1,0,0]=4 6681 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 240690a_100020643023_100000137882 [0,2,0,0,1,0|1,0,0]=4 6682 B15R2.3423 CCCNC(=O)c1ccc2c(c1)CC2 527a_100020643023_100000137882 [0,2,0,0,1,0|1,0,0]=4 6683 B15R2.3423 CCNNC(=O)c1ccc2c(c1)CC2 22a_100000756455_100000137882 [0,2,0,0,1,0|1,0,0]=4 6684 B15R2.3423 COCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000233755 [0,2,0,0,1,0|0,0,0]=3 6685 B15R2.3423 CSCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000751147 [0,2,0,0,1,0|0,1,0]=4 6686 B15R2.3423 N#CCCC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100011215226 [0,2,0,0,1,0|1,0,0]=4 6687 B15R2.3423 N#CCNC(=O)c1ccc2c(c1)CC2 1626a_100000734998_100000137882 [0,2,0,0,1,0|1,0,0]=4 6688 B15R2.3423 N#CCNC(=O)c1ccc2c(c1)CC2 527a_100000734998_100000137882 [0,2,0,0,1,0|1,0,0]=4 6689 B15R2.3423 O=C(CCCF)c1ccc2c(c1)CC2 1458a_100000137882_100011934791 [0,2,0,0,1,0|1,0,0]=4 6690 B15R2.3423 O=C(CCCO)c1ccc2c(c1)CC2 1458a_100000137882_100011215043 [0,2,0,0,1,0|1,0,0]=4 6691 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 11a_100000724931_100000137882 [0,2,0,0,1,0|1,0,0]=4 6692 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 1626a_100000724931_100000137882 [0,2,0,0,1,0|1,0,0]=4 6693 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 240690a_100000724931_100000137882 [0,2,0,0,1,0|1,0,0]=4 6694 B15R2.3423 O=C(NCCF)c1ccc2c(c1)CC2 527a_100000724931_100000137882 [0,2,0,0,1,0|1,0,0]=4 6695 B15R2.3423 O=C(NCCO)c1ccc2c(c1)CC2 240690a_100000210304_100000137882 [0,2,0,0,1,0|1,0,0]=4 6696 B15R2.3423 O=C(NCCO)c1ccc2c(c1)CC2 527a_100000210304_100000137882 [0,2,0,0,1,0|1,0,0]=4 6697 B15R2.41412 C=C(C)CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000748629 [0,2,0,0,1,0|1,0,0]=4 6698 B15R2.41412 CC(C)CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100000210624 [0,2,0,0,1,0|1,0,0]=4 6699 B15R2.41412 CC(C)NC(=O)c1ccc2c(c1)CC2 11a_100138425928_100000137882 [0,2,0,0,1,0|1,0,0]=4 6700 B15R2.41412 CC(C)NC(=O)c1ccc2c(c1)CC2 1626a_100138425928_100000137882 [0,2,0,0,1,0|1,0,0]=4 6701 B15R2.41412 CC(C)NC(=O)c1ccc2c(c1)CC2 240690a_100138425928_100000137882 [0,2,0,0,1,0|1,0,0]=4 6702 B15R2.41412 CC(C)NC(=O)c1ccc2c(c1)CC2 527a_100138425928_100000137882 [0,2,0,0,1,0|1,0,0]=4 6703 B15R2.41412 CC(O)CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_100011218427 [0,2,0,0,1,0|1,0,0]=4 6704 B15R2.41412 O=C(CC(F)F)c1ccc2c(c1)CC2 1458a_100000137882_100011934356 [0,2,0,0,1,0|1,0,0]=4 6705 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCC2 11a_100011205400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6706 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCC2 1626a_100011205400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6707 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCC2 22a_100011205400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6708 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCC2 527a_100011205400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6709 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCO2 11a_100138412508_100000210968 [0,1,0,0,0,2|1,0,0]=4 6710 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCO2 1626a_100138412508_100000210968 [0,1,0,0,0,2|1,0,0]=4 6711 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCO2 22a_100138412508_100000210968 [0,1,0,0,0,2|1,0,0]=4 6712 B17R2.2159 COCC(=O)Nc1ccc2c(c1)CCCO2 527a_100138412508_100000210968 [0,1,0,0,0,2|1,0,0]=4 6713 B17R2.2159 COCC(=O)Nc1ccc2c(c1)OCCO2 11a_100020630400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6714 B17R2.2159 COCC(=O)Nc1ccc2c(c1)OCCO2 1626a_100020630400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6715 B17R2.2159 COCC(=O)Nc1ccc2c(c1)OCCO2 22a_100020630400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6716 B17R2.2159 COCC(=O)Nc1ccc2c(c1)OCCO2 34a_100138415774_100000183334 [0,1,0,0,0,2|1,0,0]=4 6717 B17R2.2159 COCC(=O)Nc1ccc2c(c1)OCCO2 527a_100020630400_100000210968 [0,1,0,0,0,2|1,0,0]=4 6718 B17R2.9611 CCC(=O)Nc1ccc2c(c1)CN(CC2)C 11a_100012157641_100000210414 [0,1,0,0,0,2|1,0,0]=4 6719 B17R2.9611 CCC(=O)Nc1ccc2c(c1)CN(CC2)C 1626a_100012157641_100000210414 [0,1,0,0,0,2|1,0,0]=4 6720 B17R2.9611 CCC(=O)Nc1ccc2c(c1)CN(CC2)C 22a_100012157641_100000210414 [0,1,0,0,0,2|1,0,0]=4 6721 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 11a_100000055022_100000210414 [0,1,0,0,0,2|1,0,0]=4 6722 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 1626a_100000055022_100000210414 [0,1,0,0,0,2|1,0,0]=4 6723 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 22a_100000055022_100000210414 [0,1,0,0,0,2|1,0,0]=4 6724 B17R2.9611 CCC(=O)Nc1ccc2c(c1)NC(=O)CC2 527a_100000055022_100000210414 [0,1,0,0,0,2|1,0,0]=4 6725 B17R2.9611 CNC(=O)Nc1ccc2c(c1)CN(CC2)C 512a_100012157641_100102657272 [0,1,0,0,0,2|1,0,0]=4 6726 B17R2.9611 CNC(=O)Nc1ccc2c(c1)NC(=O)CC2 2430a_100000055022_100102657272 [0,1,0,0,0,2|1,0,0]=4 6727 B17R2.9618 CCC(=O)Nc1ccc2c(c1)C(=O)NCC2 11a_100000694132_100000210414 [0,1,0,0,0,2|1,0,0]=4 6728 B17R2.9618 CCC(=O)Nc1ccc2c(c1)C(=O)NCC2 1626a_100000694132_100000210414 [0,1,0,0,0,2|1,0,0]=4 6729 B17R2.9618 CCC(=O)Nc1ccc2c(c1)C(=O)NCC2 22a_100000694132_100000210414 [0,1,0,0,0,2|1,0,0]=4 6730 B17R2.9618 CCC(=O)Nc1ccc2c(c1)C(=O)NCC2 527a_100000694132_100000210414 [0,1,0,0,0,2|1,0,0]=4 6731 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCC2)C 11a_100011636485_100000210414 [0,1,0,0,0,2|1,0,0]=4 6732 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCC2)C 1626a_100011636485_100000210414 [0,1,0,0,0,2|1,0,0]=4 6733 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCC2)C 22a_100011636485_100000210414 [0,1,0,0,0,2|1,0,0]=4 6734 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCC2)C 527a_100011636485_100000210414 [0,1,0,0,0,2|1,0,0]=4 6735 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCO2)C 11a_100000105042_100000210414 [0,1,0,0,0,2|1,0,0]=4 6736 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCO2)C 1626a_100000105042_100000210414 [0,1,0,0,0,2|1,0,0]=4 6737 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCO2)C 22a_100000105042_100000210414 [0,1,0,0,0,2|1,0,0]=4 6738 B17R2.9618 CCC(=O)Nc1ccc2c(c1)N(CCO2)C 527a_100000105042_100000210414 [0,1,0,0,0,2|1,0,0]=4 6739 B17R2.9618 CNC(=O)Nc1ccc2c(c1)C(=O)NCC2 2430a_100000694132_100102657272 [0,1,0,0,0,2|1,0,0]=4 6740 B17R2.9618 CNC(=O)Nc1ccc2c(c1)N(CCC2)C 2430a_100011636485_100102657272 [0,1,0,0,0,2|1,0,0]=4 6741 B17R2.9618 CNC(=O)Nc1ccc2c(c1)N(CCC2)C 512a_100011636485_100102657272 [0,1,0,0,0,2|1,0,0]=4 6742 B17R2.9618 CNC(=O)Nc1ccc2c(c1)N(CCO2)C 2430a_100000105042_100102657272 [0,1,0,0,0,2|1,0,0]=4 6743 B17R2.323902 COCC(=O)c1ccc2c(c1)OCCCO2 34a_100138415774_100000205144 [0,1,0,0,0,2|1,0,0]=4 6744 B17R2.898 COC(=O)CSc1ccc2c(c1N)CCC2 62a_100000747449_202495424074 [0,1,0,0,0,2|1,0,0]=4 6745 B17R2.898 COC(=O)CSc1ccc2c(c1N)CCC2 62a_202495424074_100000747449 [0,1,0,0,0,2|1,0,0]=4 6746 B17R2.898 COC(=O)CSc1ccc2c(c1O)CCC2 62a_100000747449_100010662108 [0,1,0,0,0,2|1,0,0]=4 6747 B17R2.898 COC(=O)CSc1ccc2c(c1O)CCC2 62a_100010662108_100000747449 [0,1,0,0,0,2|1,0,0]=4 6748 B17R2.6122 COC(=O)CC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000747449 [0,1,0,0,0,2|1,0,0]=4 6749 B17R2.9648 C=COC(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000036128 [0,1,0,0,0,2|0,0,1]=4 6750 B17R2.9648 C=COC(=O)CSc1ccc2c(c1)NCC2 62a_100000036128_100000754641 [0,1,0,0,0,2|0,0,1]=4 6751 B17R2.9648 C=COC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000036128 [0,1,0,0,0,2|0,0,1]=4 6752 B17R2.9648 CCCC(=O)CSc1ccc2c(c1)NCC2 62a_100000747444_100000754641 [0,1,0,0,0,2|1,0,0]=4 6753 B17R2.9648 CCCC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000747444 [0,1,0,0,0,2|1,0,0]=4 6754 B17R2.9648 CCNC(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000183381 [0,1,0,0,0,2|1,0,0]=4 6755 B17R2.9648 CCNC(=O)CSc1ccc2c(c1)NCC2 62a_100000183381_100000754641 [0,1,0,0,0,2|1,0,0]=4 6756 B17R2.9648 CCNC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000183381 [0,1,0,0,0,2|1,0,0]=4 6757 B17R2.9648 CCOC(=O)C=Cc1cc2c(cn1)CCN2 271570a_100010199719_100020639910 [0,1,0,0,0,2|1,0,0]=4 6758 B17R2.9648 CCOC(=O)C=Cc1ccc2c(c1)CCC2 271570a_100010199719_100000745594 [0,1,0,0,0,2|1,0,0]=4 6759 B17R2.9648 CCOC(=O)C=Cc1ccc2c(c1)NCC2 271570a_100010199719_100000754641 [0,1,0,0,0,2|0,0,0]=3 6760 B17R2.9648 CCOC(=O)C=Cc1ccc2c(c1)OCC2 271570a_100010199719_100009818566 [0,1,0,0,0,2|1,0,0]=4 6761 B17R2.9648 CCOC(=O)C=Cc1cnc2c(c1)NCC2 271570a_100010199719_100000698607 [0,1,0,0,0,2|1,0,0]=4 6762 B17R2.9648 CCOC(=O)CNc1ccc2c(c1)CCC2 2230a_100000211504_100000188475 [0,1,0,0,0,2|1,0,0]=4 6763 B17R2.9648 CCOC(=O)CNc1ccc2c(c1)CCC2 34a_100000211504_100000188475 [0,1,0,0,0,2|1,0,0]=4 6764 B17R2.9648 CCOC(=O)COc1ccc2c(c1)CCC2 34a_100000209987_100000188475 [0,1,0,0,0,2|1,0,0]=4 6765 B17R2.9648 CCOC(=O)COc1ccc2c(c1)CCC2 7a_100000209987_100000188475 [0,1,0,0,0,2|1,0,0]=4 6766 B17R2.9648 CCOC(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000188475 [0,1,0,0,0,2|0,0,0]=3 6767 B17R2.9648 CCOC(=O)CSc1cc2c(cn1)CCN2 62a_100000188475_100020639910 [0,1,0,0,0,2|1,0,0]=4 6768 B17R2.9648 CCOC(=O)CSc1cc2c(cn1)CCN2 62a_100020639910_100000188475 [0,1,0,0,0,2|1,0,0]=4 6769 B17R2.9648 CCOC(=O)CSc1ccc2c(c1)CCC2 62a_100000188475_100000745594 [0,1,0,0,0,2|1,0,0]=4 6770 B17R2.9648 CCOC(=O)CSc1ccc2c(c1)CCC2 62a_100000745594_100000188475 [0,1,0,0,0,2|1,0,0]=4 6771 B17R2.9648 CCOC(=O)CSc1ccc2c(c1)NCC2 62a_100000188475_100000754641 [0,1,0,0,0,2|0,0,0]=3 6772 B17R2.9648 CCOC(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000188475 [0,1,0,0,0,2|0,0,0]=3 6773 B17R2.9648 CCOC(=O)CSc1ccc2c(c1)OCC2 62a_100000188475_100009818566 [0,1,0,0,0,2|1,0,0]=4 6774 B17R2.9648 CCOC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000188475 [0,1,0,0,0,2|1,0,0]=4 6775 B17R2.9648 CCOC(=O)CSc1cnc2c(c1)NCC2 62a_100000188475_100000698607 [0,1,0,0,0,2|1,0,0]=4 6776 B17R2.9648 CCOC(=O)CSc1cnc2c(c1)NCC2 62a_100000698607_100000188475 [0,1,0,0,0,2|1,0,0]=4 6777 B17R2.9648 COCC(=O)NNc1ccc2c(c1)CCC2 22a_100015187744_100000210968 [0,1,0,0,0,2|1,0,0]=4 6778 B17R2.9648 O=C(COc1ccc2c(c1)NCC2)NCO 34a_100020636427_100000185155 [0,1,0,0,0,2|1,0,0]=4 6779 B17R2.9648 O=C(CSc1ccc2c(c1)NCC2)NCO 62a_100000185155_100000754641 [0,1,0,0,0,2|1,0,0]=4 6780 B17R2.9648 O=C(CSc1ccc2c(c1)NCC2)NCO 62a_100000754641_100000185155 [0,1,0,0,0,2|1,0,0]=4 6781 B17R2.18982 CCC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000742827_100000754641 [0,1,0,0,0,2|1,0,0]=4 6782 B17R2.18982 CCC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000742827 [0,1,0,0,0,2|1,0,0]=4 6783 B17R2.18982 CNC(=O)C(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100000731044 [0,1,0,0,0,2|1,0,0]=4 6784 B17R2.18982 CNC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000209862_100000754641 [0,1,0,0,0,2|1,0,0]=4 6785 B17R2.18982 CNC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000731044 [0,1,0,0,0,2|1,0,0]=4 6786 B17R2.18982 CNC(=O)C(F)Oc1ccc2c(c1)NCC2 34a_100020636427_100009813575 [0,1,0,0,0,2|1,0,0]=4 6787 B17R2.18982 CNC(=O)C(F)Sc1ccc2c(c1)NCC2 62a_100000754641_100009813575 [0,1,0,0,0,2|1,0,0]=4 6788 B17R2.18982 CNC(=O)C(F)Sc1ccc2c(c1)NCC2 62a_100009813575_100000754641 [0,1,0,0,0,2|1,0,0]=4 6789 B17R2.18982 COC(=O)C(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000024059 [0,1,0,0,0,2|1,0,0]=4 6790 B17R2.18982 COC(=O)C(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000024059 [0,1,0,0,0,2|1,0,0]=4 6791 B17R2.18982 COC(=O)C(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000024059 [0,1,0,0,0,2|1,0,0]=4 6792 B17R2.18982 COC(=O)C(C)Nc1ccc2c(c1)CCC2 2230a_100000211504_100000211248 [0,1,0,0,0,2|1,0,0]=4 6793 B17R2.18982 COC(=O)C(C)Nc1ccc2c(c1)CCC2 34a_100000211504_100000211248 [0,1,0,0,0,2|1,0,0]=4 6794 B17R2.18982 COC(=O)C(C)Oc1ccc2c(c1)CCC2 34a_100000209987_100000211248 [0,1,0,0,0,2|1,0,0]=4 6795 B17R2.18982 COC(=O)C(C)Oc1ccc2c(c1)CCC2 7a_100000209987_100000211248 [0,1,0,0,0,2|1,0,0]=4 6796 B17R2.18982 COC(=O)C(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100000211248 [0,1,0,0,0,2|0,0,0]=3 6797 B17R2.18982 COC(=O)C(C)Sc1cc2c(cn1)CCN2 62a_100000211248_100020639910 [0,1,0,0,0,2|1,0,0]=4 6798 B17R2.18982 COC(=O)C(C)Sc1cc2c(cn1)CCN2 62a_100020639910_100000211248 [0,1,0,0,0,2|1,0,0]=4 6799 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)CCC2 62a_100000211248_100000745594 [0,1,0,0,0,2|1,0,0]=4 6800 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)CCC2 62a_100000745594_100000211248 [0,1,0,0,0,2|1,0,0]=4 6801 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000211248_100000754641 [0,1,0,0,0,2|0,0,0]=3 6802 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000211248 [0,1,0,0,0,2|0,0,0]=3 6803 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)OCC2 62a_100000211248_100009818566 [0,1,0,0,0,2|1,0,0]=4 6804 B17R2.18982 COC(=O)C(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000211248 [0,1,0,0,0,2|1,0,0]=4 6805 B17R2.18982 COC(=O)C(C)Sc1cnc2c(c1)NCC2 62a_100000211248_100000698607 [0,1,0,0,0,2|1,0,0]=4 6806 B17R2.18982 COC(=O)C(C)Sc1cnc2c(c1)NCC2 62a_100000698607_100000211248 [0,1,0,0,0,2|1,0,0]=4 6807 B17R2.45524 CC(=O)C(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100011261029 [0,1,0,0,0,2|1,0,0]=4 6808 B17R2.45524 CC(=O)C(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100011261029 [0,1,0,0,0,2|1,0,0]=4 6809 B17R2.45524 CC(=O)C(=O)CSc1ccc2c(c1)NCC2 62a_100011261029_100000754641 [0,1,0,0,0,2|1,0,0]=4 6810 B17R2.45524 CC(C)C(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000753385 [0,1,0,0,0,2|1,0,0]=4 6811 B17R2.45524 CC(C)C(=O)CSc1ccc2c(c1)NCC2 62a_100000753385_100000754641 [0,1,0,0,0,2|1,0,0]=4 6812 B17R2.45524 CC(C)C(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000753385 [0,1,0,0,0,2|1,0,0]=4 6813 B17R2.45524 CN(C)C(=O)CCc1ccc2c(c1)NCC2 271570a_200010232142_100000754641 [0,1,0,0,0,2|1,0,0]=4 6814 B17R2.45524 CN(C)C(=O)COc1ccc2c(c1)NCC2 34a_100020636427_100000692301 [0,1,0,0,0,2|1,0,0]=4 6815 B17R2.45524 CN(C)C(=O)CSc1ccc2c(c1)NCC2 62a_100000692301_100000754641 [0,1,0,0,0,2|1,0,0]=4 6816 B17R2.45524 CN(C)C(=O)CSc1ccc2c(c1)NCC2 62a_100000754641_100000692301 [0,1,0,0,0,2|1,0,0]=4 6817 B17R2.57548 COC(=O)COc1cc2c(cc1Br)CCC2 34a_200010659162_100000747449 [0,1,0,0,0,2|1,0,0]=4 6818 B17R2.57548 COC(=O)COc1cc2c(cc1Br)CCC2 7a_200010659162_100000747449 [0,1,0,0,0,2|1,0,0]=4 6819 B17R2.57548 COC(=O)COc1cc2c(cc1F)CCC2 34a_200000146645_100000747449 [0,1,0,0,0,2|1,0,0]=4 6820 B17R2.57548 COC(=O)COc1cc2c(cc1F)CCC2 7a_200000146645_100000747449 [0,1,0,0,0,2|1,0,0]=4 6821 B17R2.57548 COC(=O)CSc1cc2c(cc1O)CCC2 62a_100000747449_200010659162 [0,1,0,0,0,2|1,0,0]=4 6822 B17R2.57548 COC(=O)CSc1cc2c(cc1O)CCC2 62a_200010659162_100000747449 [0,1,0,0,0,2|1,0,0]=4 6823 B17R2.57593 COC(=O)COc1ccc2c(c1)C(=O)CC2 34a_100009827925_100000747449 [0,1,0,0,0,2|1,0,0]=4 6824 B17R2.57593 COC(=O)COc1ccc2c(c1)C(=O)CC2 7a_100009827925_100000747449 [0,1,0,0,0,2|1,0,0]=4 6825 B17R2.57593 COC(=O)CSc1ccc2c(c1)C(=O)CC2 62a_100000747449_100000759401 [0,1,0,0,0,2|1,0,0]=4 6826 B17R2.57593 COC(=O)CSc1ccc2c(c1)C(=O)CC2 62a_100000759401_100000747449 [0,1,0,0,0,2|1,0,0]=4 6827 B17R2.57593 COC(=O)CSc1ccc2c(c1)C(CC2)N 62a_100000747449_100011435097 [0,1,0,0,0,2|1,0,0]=4 6828 B17R2.57593 COC(=O)CSc1ccc2c(c1)C(CC2)N 62a_100011435097_100000747449 [0,1,0,0,0,2|1,0,0]=4 6829 B17R2.57593 COC(=O)CSc1ccc2c(c1)C(CC2)O 62a_100000747449_100011836024 [0,1,0,0,0,2|1,0,0]=4 6830 B17R2.57593 COC(=O)CSc1ccc2c(c1)C(CC2)O 62a_100011836024_100000747449 [0,1,0,0,0,2|1,0,0]=4 6831 B17R2.60983 COC(=O)CSc1ccc2c(c1)CC(C2)N 62a_100000747449_100015193702 [0,1,0,0,0,2|1,0,0]=4 6832 B17R2.60983 COC(=O)CSc1ccc2c(c1)CC(C2)N 62a_100015193702_100000747449 [0,1,0,0,0,2|1,0,0]=4 6833 B17R2.60983 COC(=O)CSc1ccc2c(c1)CC(C2)O 62a_100000747449_100010161096 [0,1,0,0,0,2|1,0,0]=4 6834 B17R2.60983 COC(=O)CSc1ccc2c(c1)CC(C2)O 62a_100010161096_100000747449 [0,1,0,0,0,2|1,0,0]=4 6835 B17R2.60983 COC(=O)CSc1ccc2c(c1)NC(=O)C2 62a_100000747449_100000760487 [0,1,0,0,0,2|0,0,1]=4 6836 B17R2.376002 COC(=O)CSc1ccc2c(c1)CCC2N 62a_100000744021_100000747449 [0,1,0,0,0,2|1,0,0]=4 6837 B17R2.376002 COC(=O)CSc1ccc2c(c1)CCC2N 62a_100000747449_100000744021 [0,1,0,0,0,2|1,0,0]=4 6838 B17R2.376002 COC(=O)CSc1ccc2c(c1)CCC2O 62a_100000747449_100000747877 [0,1,0,0,0,2|1,0,0]=4 6839 B17R2.376002 COC(=O)CSc1ccc2c(c1)CCC2O 62a_100000747877_100000747449 [0,1,0,0,0,2|1,0,0]=4 6840 B17R2.376002 COC(=O)CSc1ccc2c(c1)OCC2N 62a_100000747449_100020628175 [0,1,0,0,0,2|1,0,0]=4 6841 B17R2.376002 COC(=O)CSc1ccc2c(c1)OCC2N 62a_100020628175_100000747449 [0,1,0,0,0,2|1,0,0]=4 6842 B17R2.2104 CCOCC(=O)c1ccc2c(c1)CCCC2 34a_100121572206_100011262348 [0,2,0,0,0,1|1,0,0]=4 6843 B17R2.2104 CCOCC(=O)c1ccc2c(c1)OCCO2 34a_100121572206_100000185173 [0,2,0,0,0,1|1,0,0]=4 6844 B17R2.2104 COCCC(=O)c1ccc2c(c1)CCCC2 1458a_100000199106_100000233755 [0,2,0,0,0,1|1,0,0]=4 6845 B17R2.2104 COCCC(=O)c1ccc2c(c1)CCCO2 1458a_100011398765_100000233755 [0,2,0,0,0,1|1,0,0]=4 6846 B17R2.2104 COCCC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000233755 [0,2,0,0,0,1|1,0,0]=4 6847 B17R2.6202 CCCC(=O)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_100000210303 [0,2,0,0,0,1|1,0,0]=4 6848 B17R2.6202 CCNC(=O)c1ccc2c(c1)C(=O)NCC2 11a_100015525214_100000724257 [0,2,0,0,0,1|1,0,0]=4 6849 B17R2.6202 CCNC(=O)c1ccc2c(c1)C(=O)NCC2 240690a_100015525214_100000724257 [0,2,0,0,0,1|1,0,0]=4 6850 B17R2.6202 CCNC(=O)c1ccc2c(c1)C(=O)NCC2 527a_100015525214_100000724257 [0,2,0,0,0,1|1,0,0]=4 6851 B17R2.6202 CNNC(=O)c1ccc2c(c1)C(=O)NCC2 22a_100016993582_100000724257 [0,2,0,0,0,1|1,0,0]=4 6852 B17R2.6202 O=C(CCF)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_100011217306 [0,2,0,0,0,1|1,0,0]=4 6853 B17R2.6202 O=C(CCO)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_100000211926 [0,2,0,0,0,1|1,0,0]=4 6854 B17R2.11709 CCN1CCc2ccc(cc2C1)C(=O)OC 2230a_100000696298_100000210202 [0,2,0,0,0,1|0,0,0]=3 6855 B17R2.11709 CCN1CCc2ccc(cc2C1)C(=O)OC 269982a_100000696298_100000204670 [0,2,0,0,0,1|0,0,0]=3 6856 B17R2.11709 CCN1CCc2ccc(cc2C1)C(=O)OC 34a_100000696298_100000210202 [0,2,0,0,0,1|0,0,0]=3 6857 B17R2.11709 COC(=O)c1ccc2c(c1)CN(CC2)CF 269982a_100000696298_100015361967 [0,2,0,0,0,1|0,0,0]=3 6858 B17R2.11709 COC(=O)c1ccc2c(c1)CN(CC2)CF 34a_100000696298_100015361967 [0,2,0,0,0,1|0,0,0]=3 6859 B17R2.252071 CC(C)C(=O)c1ccc2c(c1)C(=O)NCC2 1458a_100000724257_100000210206 [0,2,0,0,0,1|1,0,0]=4 6860 B17R2.252071 CN(C)C(=O)c1ccc2c(c1)C(=O)NCC2 11a_100102631434_100000724257 [0,2,0,0,0,1|1,0,0]=4 6861 B17R2.252071 CN(C)C(=O)c1ccc2c(c1)C(=O)NCC2 1626a_100102631434_100000724257 [0,2,0,0,0,1|1,0,0]=4 6862 B17R2.252071 CN(C)C(=O)c1ccc2c(c1)C(=O)NCC2 240690a_100102631434_100000724257 [0,2,0,0,0,1|1,0,0]=4 6863 B17R2.252071 CN(C)C(=O)c1ccc2c(c1)C(=O)NCC2 527a_100102631434_100000724257 [0,2,0,0,0,1|1,0,0]=4 6864 B17R2.356959 COC(=O)c1cc(c2c(c1O)CCCC2)O 271570a_203496583355_100010113800 [0,2,0,0,0,1|1,0,0]=4 6865 B17R2.11734 CCN1CCc2cc(ccc2C1)C(=O)OC 2230a_100020628067_100000210202 [0,2,0,0,0,1|1,0,0]=4 6866 B17R2.11734 CCN1CCc2cc(ccc2C1)C(=O)OC 269982a_100020628067_100000204670 [0,2,0,0,0,1|1,0,0]=4 6867 B17R2.11734 CCN1CCc2cc(ccc2C1)C(=O)OC 34a_100020628067_100000210202 [0,2,0,0,0,1|1,0,0]=4 6868 B17R2.11734 COC(=O)c1ccc2c(c1)CCN(C2)CF 269982a_100020628067_100015361967 [0,2,0,0,0,1|1,0,0]=4 6869 B17R2.11734 COC(=O)c1ccc2c(c1)CCN(C2)CF 34a_100020628067_100015361967 [0,2,0,0,0,1|1,0,0]=4 6870 B17R2.10085 CCOCC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000211967 [0,2,0,0,0,1|1,0,0]=4 6871 B17R2.10085 CCOCC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000211967 [0,2,0,0,0,1|1,0,0]=4 6872 B17R2.10085 CCOCC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000211967 [0,2,0,0,0,1|1,0,0]=4 6873 B17R2.10085 CCOCC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000211967 [0,2,0,0,0,1|1,0,0]=4 6874 B17R2.10085 COC=CC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100016268678 [0,2,0,0,0,1|1,0,0]=4 6875 B17R2.10085 COC=CC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100016268678 [0,2,0,0,0,1|1,0,0]=4 6876 B17R2.10085 COCCC(=O)Nc1ccc2c(c1)CCC2 11a_100000211504_100000749529 [0,2,0,0,0,1|1,0,0]=4 6877 B17R2.10085 COCCC(=O)Nc1ccc2c(c1)CCC2 1626a_100000211504_100000749529 [0,2,0,0,0,1|1,0,0]=4 6878 B17R2.10085 COCCC(=O)Nc1ccc2c(c1)CCC2 22a_100000211504_100000749529 [0,2,0,0,0,1|1,0,0]=4 6879 B17R2.10085 COCCC(=O)Nc1ccc2c(c1)CCC2 34a_100138415774_100000242074 [0,2,0,0,0,1|1,0,0]=4 6880 B17R2.10085 COCCC(=O)Nc1ccc2c(c1)CCC2 527a_100000211504_100000749529 [0,2,0,0,0,1|1,0,0]=4 6881 B17R2.75079 COCC(=O)Nc1ccc2c(c1)NC(=O)C2 22a_100000721629_100000210968 [0,2,0,0,0,1|0,0,1]=4 6882 B17R2.75079 COCC(=O)Nc1ccc2c(c1)NC(=O)C2 527a_100000721629_100000210968 [0,2,0,0,0,1|0,0,1]=4 6883 B17R2.2316 CCOCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100011215890 [0,3,0,0,0,0|1,0,0]=4 6884 B17R2.2316 COCCCC(=O)c1ccc2c(c1)CCC2 1458a_100000195560_100000740836 [0,3,0,0,0,0|1,0,0]=4 6885 B17R2.2316 COCCNC(=O)c1ccc2c(c1)CCC2 1626a_100000209980_100000195560 [0,3,0,0,0,0|1,0,0]=4 6886 B17R2.2316 COCCNC(=O)c1ccc2c(c1)CCC2 240690a_100000209980_100000195560 [0,3,0,0,0,0|1,0,0]=4 6887 B17R2.2316 COCCNC(=O)c1ccc2c(c1)CCC2 527a_100000209980_100000195560 [0,3,0,0,0,0|1,0,0]=4 6888 B17R2.68696 C=Cc1cc(cc2c1CCC2=O)C(=O)OC 271570a_100011290941_100020639223 [0,3,0,0,0,0|1,0,0]=4 6889 B17R2.68696 COC(=O)c1cc(c2c(c1)C(=O)CC2)SC 62a_100020639223_200000210301 [0,3,0,0,0,0|1,0,0]=4 6890 B17R2.68696 COC(=O)c1cc(c2c(c1)C(=O)CC2)SC 62a_200000210301_100020639223 [0,3,0,0,0,0|1,0,0]=4 6891 B17R2.68696 COC(=O)c1cc(c2c(c1)C(=O)CC2)S[13CH3] 62a_100020639223_200025704644 [0,3,0,0,0,0|1,0,0]=4 6892 B17R2.68696 COC(=O)c1cc(c2c(c1)C(=O)CC2)S[13CH3] 62a_200025704644_100020639223 [0,3,0,0,0,0|1,0,0]=4 6893 B17R2.58261 C=C(C)c1cc(cc2c1CCN2)C(=O)OC 271570a_100000694244_103439830445 [0,3,0,0,0,0|0,0,0]=3 6894 B17R2.89813 C=C=Cc1cc(cc2c1CCN2)C(=O)OC 271570a_100015277604_103439830445 [0,3,0,0,0,0|0,0,0]=3 6895 B17R2.89813 CC=Cc1cc(cc2c1CCN2)C(=O)OC 271570a_100016259895_103439830445 [0,3,0,0,0,0|0,0,0]=3 6896 B17R2.89813 CCSc1cc(cc2c1CCN2)C(=O)OC 62a_100000210202_103439830445 [0,3,0,0,0,0|0,0,0]=3 6897 B17R2.89813 CCSc1cc(cc2c1CCN2)C(=O)OC 62a_103439830445_100000210202 [0,3,0,0,0,0|0,0,0]=3 6898 B17R2.89813 COC(=O)c1cc2c(c(c1)SCF)CCN2 62a_100015361967_103439830445 [0,3,0,0,0,0|0,0,0]=3 6899 B17R2.89813 COC(=O)c1cc2c(c(c1)SCF)CCN2 62a_103439830445_100015361967 [0,3,0,0,0,0|0,0,0]=3 6900 B13R2.5180 Cc1c(ccc2c1COC2=O)O 271570a_203496583355_100010986288 [1,0,1,1,0,0|1,0,0]=4 6901 B13R2.573 CNc1cccc2c1CNC2=O 2230a_100000087543_200000210301 [1,0,1,1,0,0|1,0,0]=4 6902 B13R2.573 CSc1cccc2c1COC2=O 62a_100010167076_200000210301 [1,0,1,1,0,0|1,0,0]=4 6903 B13R2.573 [13CH3]Nc1cccc2c1CNC2=O 2230a_100000087543_200025704644 [1,0,1,1,0,0|1,0,0]=4 6904 B13R2.573 [13CH3]Sc1cccc2c1COC2=O 62a_100010167076_200025704644 [1,0,1,1,0,0|1,0,0]=4 6905 B13R2.428 CC(=O)c1ccc(cc1)C2CC2 1458a_100011688853_200000210301 [1,0,1,1,0,0|1,0,0]=4 6906 B13R2.428 CC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000185465 [1,0,1,1,0,0|1,0,0]=4 6907 B13R2.428 [13CH3]C(=O)c1ccc(cc1)C2CC2 1458a_100011688853_200025704644 [1,0,1,1,0,0|1,0,0]=4 6908 B13R2.292 CC=Cc1cccc2c1CCN2 271570a_100016259895_100009817896 [1,0,1,1,0,0|1,0,0]=4 6909 B13R2.292 CCNc1cccc2c1COC2 2230a_100000125316_100000210202 [1,0,1,1,0,0|0,0,1]=4 6910 B13R2.292 CCNc1cccc2c1COC2 34a_100000125316_100000210202 [1,0,1,1,0,0|0,0,1]=4 6911 B13R2.429 CC(=O)c1cccc(c1)C2CC2 1458a_100011260452_200000210301 [1,0,1,1,0,0|1,0,0]=4 6912 B13R2.429 CC(=O)c1cccc(c1)C2CC2 271570a_100011220607_100000210093 [1,0,1,1,0,0|1,0,0]=4 6913 B13R2.429 [13CH3]C(=O)c1cccc(c1)C2CC2 1458a_100011260452_200025704644 [1,0,1,1,0,0|1,0,0]=4 6914 B13R2.5569 C=C(C)c1cccc2c1CCN2 271570a_100000694244_100009817896 [1,0,1,1,0,0|1,0,0]=4 6915 B13R2.5569 CC(=O)c1cccc2c1CCC2 1458a_100000051556_200000210301 [1,0,1,1,0,0|1,0,0]=4 6916 B13R2.5569 [13CH3]C(=O)c1cccc2c1CCC2 1458a_100000051556_200025704644 [1,0,1,1,0,0|1,0,0]=4 6917 B15R2.4341 COC(=O)Cc1ccc(cc1)C2CC2 271570a_100011220607_100000149743 [0,0,1,1,0,1|1,0,0]=4 6918 B15R2.4341 COC(=O)Nc1ccc(cc1)C2CC2 271570a_100011220607_100000181880 [0,0,1,1,0,1|1,0,0]=4 6919 B15R2.4342 COC(=O)Cc1cccc(c1)C2CC2 271570a_100011220607_100000699549 [0,0,1,1,0,1|1,0,0]=4 6920 B15R2.101 COC(=O)c1c[nH]c(c1)C2=CCCC2 271570a_100000089523_100009840242 [0,0,1,1,0,1|1,0,0]=4 6921 B15R2.101 COC(=O)c1c[nH]c(c1)C2=COCC2 271570a_100000118173_100009840242 [0,0,1,1,0,1|1,0,0]=4 6922 B15R2.101 COC(=O)c1cc(co1)C2=CCCC2 271570a_100000089523_100009992624 [0,0,1,1,0,1|1,0,0]=4 6923 B15R2.101 COC(=O)c1cc(co1)C2=COCC2 271570a_100000118173_100009992624 [0,0,1,1,0,1|1,0,0]=4 6924 B15R2.101 COC(=O)c1cc(cs1)C2=CCCC2 271570a_100000089523_100009815473 [0,0,1,1,0,1|1,0,0]=4 6925 B15R2.101 COC(=O)c1cc(cs1)C2=COCC2 271570a_100000118173_100009815473 [0,0,1,1,0,1|1,0,0]=4 6926 B15R2.101 COC(=O)c1csc(c1)C2=CCCC2 271570a_100000089523_100000692058 [0,0,1,1,0,1|1,0,0]=4 6927 B15R2.101 COC(=O)c1csc(c1)C2=COCC2 271570a_100000118173_100000692058 [0,0,1,1,0,1|1,0,0]=4 6928 B15R2.19459 COC(=O)c1ccc(c(c1)C2CC2)C 271570a_100011220607_100011218856 [0,1,1,1,0,0|1,0,0]=4 6929 B15R2.7 NCCc1ccc(cc1)C2=CCOC2 271570a_100009872500_100000755846 [0,1,1,1,0,0|1,0,0]=4 6930 B15R2.7 NCCc1ccc(cc1)C2=COCC2 271570a_100000118173_100000755846 [0,1,1,1,0,0|1,0,0]=4 6931 B15R2.1348 CCOC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_100000170077 [0,1,1,1,0,0|1,0,0]=4 6932 B15R2.1348 COCC(=O)c1ccc(cc1)C2CC2 271570a_100011220607_200011343064 [0,1,1,1,0,0|1,0,0]=4 6933 B15R2.19225 COC(=O)c1ccc(cc1)OC2CC2 34a_100000150123_100000211595 [0,1,1,1,0,0|1,0,0]=4 6934 B15R2.19225 COC(=O)c1ccc(cc1)SC2CC2 62a_100000150774_100000211595 [0,1,1,1,0,0|1,0,0]=4 6935 B15R2.79619 COC(=O)c1ccc(cc1Br)C2CC2 271570a_100011220607_100010247156 [0,1,1,1,0,0|1,0,0]=4 6936 B15R2.79619 COC(=O)c1ccc(cc1C)C2CC2 271570a_100011220607_100000747612 [0,1,1,1,0,0|1,0,0]=4 6937 B15R2.79619 COC(=O)c1ccc(cc1Cl)C2CC2 271570a_100011220607_100000060724 [0,1,1,1,0,0|1,0,0]=4 6938 B15R2.79619 COC(=O)c1ccc(cc1F)C2CC2 271570a_100011220607_100000216654 [0,1,1,1,0,0|1,0,0]=4 6939 B15R2.79619 COC(=O)c1ccc(cc1N)C2CC2 271570a_100011220607_100011373473 [0,1,1,1,0,0|1,0,0]=4 6940 B15R2.79619 COC(=O)c1ccc(cc1O)C2CC2 271570a_100011220607_100000062286 [0,1,1,1,0,0|1,0,0]=4 6941 B15R2.19460 COC(=O)c1ccc(c(c1)Br)C2CC2 271570a_100011220607_100011294788 [0,1,1,1,0,0|1,0,0]=4 6942 B15R2.19460 COC(=O)c1ccc(c(c1)C)C2CC2 271570a_100011220607_100011215878 [0,1,1,1,0,0|1,0,0]=4 6943 B15R2.19460 COC(=O)c1ccc(c(c1)Cl)C2CC2 271570a_100011220607_100012356344 [0,1,1,1,0,0|1,0,0]=4 6944 B15R2.19460 COC(=O)c1ccc(c(c1)F)C2CC2 271570a_100011220607_100000703229 [0,1,1,1,0,0|1,0,0]=4 6945 B15R2.19460 COC(=O)c1ccc(c(c1)N)C2CC2 271570a_100011220607_100011450966 [0,1,1,1,0,0|1,0,0]=4 6946 B15R2.19460 COC(=O)c1ccc(c(c1)O)C2CC2 271570a_100011220607_100012350776 [0,1,1,1,0,0|1,0,0]=4 6947 B15R2.68 CCNc1cccc(c1)C2=CCOC2 271570a_100009872500_100000738899 [0,1,1,1,0,0|1,0,0]=4 6948 B15R2.68 CCNc1cccc(c1)C2=COCC2 271570a_100000118173_100000738899 [0,1,1,1,0,0|1,0,0]=4 6949 B15R2.1349 CCOC(=O)c1cccc(c1)C2CC2 271570a_100011220607_100000170211 [0,1,1,1,0,0|1,0,0]=4 6950 B15R2.1584 COC(=O)c1cccc(c1Br)C2CC2 271570a_100011220607_100010240208 [0,1,1,1,0,0|1,0,0]=4 6951 B15R2.1584 COC(=O)c1cccc(c1C)C2CC2 271570a_100011220607_100012298220 [0,1,1,1,0,0|1,0,0]=4 6952 B15R2.1584 COC(=O)c1cccc(c1F)C2CC2 271570a_100011220607_100012355674 [0,1,1,1,0,0|1,0,0]=4 6953 B15R2.1584 COC(=O)c1cccc(c1N)C2CC2 271570a_100011220607_100011356556 [0,1,1,1,0,0|1,0,0]=4 6954 B15R2.1584 COC(=O)c1cccc(c1O)C2CC2 271570a_100011220607_100009816214 [0,1,1,1,0,0|1,0,0]=4 6955 B15R2.8 CC(C)Nc1cccc2c1CNC2=O 2230a_100000087543_100000210206 [0,1,1,1,0,0|1,0,0]=4 6956 B15R2.8 CC(C)Sc1cccc2c1COC2=O 62a_100010167076_100000210206 [0,1,1,1,0,0|1,0,0]=4 6957 B15R2.19246 CNC(=O)c1cccc(c1)NC2CC2 34a_100000185133_100000211595 [0,1,1,1,0,0|1,0,0]=4 6958 B15R2.19246 COC(=O)c1cccc(c1)OC2CC2 34a_100000150331_100000211595 [0,1,1,1,0,0|1,0,0]=4 6959 B15R2.19246 COC(=O)c1cccc(c1)SC2CC2 62a_100000148848_100000211595 [0,1,1,1,0,0|1,0,0]=4 6960 B15R2.19246 COC(=O)c1cccc(n1)NC2CC2 27a_100000212008_100000708286 [0,1,1,1,0,0|1,0,0]=4 6961 B15R2.19247 COC(=O)c1cccc(n1)N2CCC2 27a_100000754969_100000708286 [0,1,1,1,0,0|1,0,0]=4 6962 B15R2.1445 CCCCc1cccc2c1COC2=O 271570a_100020621405_100010167076 [0,1,1,1,0,0|1,0,0]=4 6963 B15R2.1445 CCCNc1cccc2c1CNC2=O 2230a_100000087543_100000210303 [0,1,1,1,0,0|1,0,0]=4 6964 B15R2.1445 CCCSc1cccc2c1COC2=O 62a_100010167076_100000210303 [0,1,1,1,0,0|1,0,0]=4 6965 B15R2.1445 COCNc1cccc2c1CNC2=O 2230a_100000087543_100000766300 [0,1,1,1,0,0|1,0,0]=4 6966 B15R2.1445 COCSc1cccc2c1COC2=O 62a_100010167076_100000766300 [0,1,1,1,0,0|1,0,0]=4 6967 B15R2.1445 CSCNc1cccc2c1CNC2=O 2230a_100000087543_100011218213 [0,1,1,1,0,0|1,0,0]=4 6968 B15R2.1445 CSCSc1cccc2c1COC2=O 62a_100010167076_100011218213 [0,1,1,1,0,0|1,0,0]=4 6969 B15R2.1445 O=C1NCc2c1cccc2NCCF 2230a_100000087543_100011217306 [0,1,1,1,0,0|1,0,0]=4 6970 B15R2.1445 O=C1NCc2c1cccc2NCCO 2230a_100000087543_100000211926 [0,1,1,1,0,0|1,0,0]=4 6971 B15R2.1445 O=C1OCc2c1cccc2SCCF 62a_100010167076_100011217306 [0,1,1,1,0,0|1,0,0]=4 6972 B15R2.1445 O=C1OCc2c1cccc2SCCO 62a_100010167076_100000211926 [0,1,1,1,0,0|1,0,0]=4 6973 B15R2.19217 COC(=O)c1cc(cc(c1)C2CC2)Br 271570a_100011220607_100012339729 [0,1,1,1,0,0|1,0,0]=4 6974 B15R2.19217 COC(=O)c1cc(cc(c1)C2CC2)C 271570a_100011220607_100012359405 [0,1,1,1,0,0|1,0,0]=4 6975 B15R2.19217 COC(=O)c1cc(cc(c1)C2CC2)Cl 271570a_100011220607_100000695173 [0,1,1,1,0,0|1,0,0]=4 6976 B15R2.19217 COC(=O)c1cc(cc(c1)C2CC2)F 271570a_100011220607_100000698578 [0,1,1,1,0,0|1,0,0]=4 6977 B15R2.19217 COC(=O)c1cc(cc(c1)C2CC2)N 271570a_100011220607_100138415615 [0,1,1,1,0,0|1,0,0]=4 6978 B15R2.19217 COC(=O)c1cc(cc(c1)C2CC2)O 271570a_100011220607_100000696291 [0,1,1,1,0,0|1,0,0]=4 6979 B15R2.19185 COC(=O)c1cc(ccc1Br)C2CC2 271570a_100011220607_100012340073 [0,1,1,1,0,0|1,0,0]=4 6980 B15R2.19185 COC(=O)c1cc(ccc1C)C2CC2 271570a_100011220607_100012360116 [0,1,1,1,0,0|1,0,0]=4 6981 B15R2.19185 COC(=O)c1cc(ccc1Cl)C2CC2 271570a_100011220607_100012353682 [0,1,1,1,0,0|1,0,0]=4 6982 B15R2.19185 COC(=O)c1cc(ccc1F)C2CC2 271570a_100011220607_100000154357 [0,1,1,1,0,0|1,0,0]=4 6983 B15R2.19185 COC(=O)c1cc(ccc1N)C2CC2 271570a_100011220607_100000212070 [0,1,1,1,0,0|1,0,0]=4 6984 B15R2.19185 COC(=O)c1cc(ccc1O)C2CC2 271570a_100011220607_100000149868 [0,1,1,1,0,0|1,0,0]=4 6985 B15R2.1560 COC(=O)c1[nH]ccc1C2=CCCC2 271570a_100000089523_100102525103 [0,1,1,1,0,0|1,0,0]=4 6986 B15R2.1560 COC(=O)c1ccoc1C2=CCCC2 271570a_100000089523_100011935261 [0,1,1,1,0,0|1,0,0]=4 6987 B15R2.1560 COC(=O)c1ccsc1C2=CCCC2 271570a_100000089523_100009822520 [0,1,1,1,0,0|1,0,0]=4 6988 B15R2.1560 COC(=O)c1cscc1C2=CCCC2 271570a_100000089523_100012351140 [0,1,1,1,0,0|1,0,0]=4 6989 B15R2.1560 COC(=O)c1occc1C2=CCCC2 271570a_100000089523_100012676306 [0,1,1,1,0,0|1,0,0]=4 6990 B15R2.1560 COC(=O)c1sccc1C2=CCCC2 271570a_100000089523_100000730364 [0,1,1,1,0,0|1,0,0]=4 6991 B15R3.10397 O=C1OCc2c1ccc(c2)C3CC3 271570a_100011220607_100009816608 [0,0,1,2,0,0|1,0,0]=4 6992 B15R3.2 O=C1OCc2c1cccc2C3CC3 271570a_100011220607_100010167076 [0,0,1,2,0,0|1,0,0]=4 6993 B15R3.60995 O=C1OCc2c1cc(cc2)C3CC3 271570a_100011220607_100000693025 [0,0,1,2,0,0|1,0,0]=4 6994 B17R3.2399 O=C1C=C(CC1)c2ccc3c(c2)NCC3 271570a_100010737933_100000754641 [0,0,0,1,0,2|1,0,0]=4 6995 B17R3.3114 O=C1CCC1Oc2ccc3c(c2)NCC3 34a_100020636427_100009892977 [0,0,0,1,0,2|1,0,0]=4 6996 B17R3.3114 O=C1CCC1Sc2ccc3c(c2)NCC3 62a_100000754641_100009892977 [0,0,0,1,0,2|1,0,0]=4 6997 B17R3.3114 O=C1CCC1Sc2ccc3c(c2)NCC3 62a_100009892977_100000754641 [0,0,0,1,0,2|1,0,0]=4 6998 B17R3.1917 C1=C(CCO1)c2ccc3c(c2)CNCC3 271570a_100000118173_100015189961 [0,1,0,1,0,1|1,0,0]=4 6999 B17R3.1917 C1=C(CCO1)c2ccc3c(c2)NCCC3 271570a_100000118173_100010196366 [0,1,0,1,0,1|1,0,0]=4 7000 B17R3.1917 C1=C(CCO1)c2ccc3c(c2)NCCO3 271570a_100000118173_100000708519 [0,1,0,1,0,1|1,0,0]=4 7001 B17R3.1917 C1=C(CCO1)c2ccc3c(c2)NCCS3 271570a_100000118173_100013243616 [0,1,0,1,0,1|1,0,0]=4 7002 B17R3.1917 C1=C(COC1)c2ccc3c(c2)CNCC3 271570a_100009872500_100015189961 [0,1,0,1,0,1|1,0,0]=4 7003 B17R3.1917 C1=C(COC1)c2ccc3c(c2)NCCC3 271570a_100009872500_100010196366 [0,1,0,1,0,1|1,0,0]=4 7004 B17R3.1917 C1=C(COC1)c2ccc3c(c2)NCCO3 271570a_100009872500_100000708519 [0,1,0,1,0,1|1,0,0]=4 7005 B17R3.1917 C1=C(COC1)c2ccc3c(c2)NCCS3 271570a_100009872500_100013243616 [0,1,0,1,0,1|1,0,0]=4 7006 B17R3.67269 O=C(Nc1ccc2c(c1)CCC2)C3CO3 11a_100000211504_100000701028 [0,1,0,1,0,1|1,0,0]=4 7007 B17R3.67269 O=C(Nc1ccc2c(c1)CCC2)C3CO3 1626a_100000211504_100000701028 [0,1,0,1,0,1|1,0,0]=4 7008 B17R3.67269 O=C(Nc1ccc2c(c1)CCC2)C3CO3 22a_100000211504_100000701028 [0,1,0,1,0,1|1,0,0]=4 7009 B17R3.67269 O=C(Nc1ccc2c(c1)CCC2)C3CO3 527a_100000211504_100000701028 [0,1,0,1,0,1|1,0,0]=4 7010 B17R3.1941 C1=C(CCCO1)c2ccc3c(c2)NCC3 271570a_100010175576_100000754641 [0,2,0,1,0,0|1,0,0]=4 7011 B17R3.1941 C1=C(CCOC1)c2ccc3c(c2)NCC3 271570a_100000070234_100000754641 [0,2,0,1,0,0|1,0,0]=4 7012 B17R3.1941 C1=C(OCCC1)c2ccc3c(c2)NCC3 271570a_100010177797_100000754641 [0,2,0,1,0,0|1,0,0]=4 7013 B17R3.128626 O=C(CC1CO1)c2ccc3c(c2)CCC3 1458a_100000195560_100011216344 [0,2,0,1,0,0|1,0,0]=4 7014 B17R3.128626 O=C(C[C@@H]1CO1)c2ccc3c(c2)CCC3 1458a_100000195560_100000745022 [0,2,0,1,0,0|1,0,0]=4 7015 B11R2.190 C=Cc1ccc2c(c1)CC2 271570a_100011290941_100009818592 [2,0,0,0,1,0|0,0,1]=4 7016 B11R2.190 CSc1ccc2c(c1)CC2 62a_100009818592_200000210301 [2,0,0,0,1,0|0,1,0]=4 7017 B11R2.190 CSc1ccc2c(c1)CC2 62a_200000210301_100009818592 [2,0,0,0,1,0|0,1,0]=4 7018 B11R2.190 [13CH3]Sc1ccc2c(c1)CC2 62a_100009818592_200025704644 [2,0,0,0,1,0|0,1,0]=4 7019 B11R2.190 [13CH3]Sc1ccc2c(c1)CC2 62a_200025704644_100009818592 [2,0,0,0,1,0|0,1,0]=4 7020 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_100000210414_100000747183 [1,0,1,0,0,1|1,0,0]=4 7021 B13R1.5 CCC(=O)Cc1ccc(cc1)CC 1458a_200000759805_100000210202 [1,0,1,0,0,1|1,0,0]=4 7022 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 11a_100000211069_100000210414 [1,0,1,0,0,1|1,0,0]=4 7023 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 1626a_100000211069_100000210414 [1,0,1,0,0,1|1,0,0]=4 7024 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 22a_100000211069_100000210414 [1,0,1,0,0,1|1,0,0]=4 7025 B13R1.5 CCC(=O)Nc1ccc(cc1)CC 527a_100000211069_100000210414 [1,0,1,0,0,1|1,0,0]=4 7026 B13R1.5 CCc1ccc(cc1)CC(=O)NC 11a_106832991635_200000759805 [1,0,1,0,0,1|1,0,0]=4 7027 B13R1.5 CCc1ccc(cc1)CC(=O)NC 1626a_100102657272_200000759805 [1,0,1,0,0,1|1,0,0]=4 7028 B13R1.5 CCc1ccc(cc1)CC(=O)NC 240690a_100102657272_200000759805 [1,0,1,0,0,1|1,0,0]=4 7029 B13R1.5 CCc1ccc(cc1)CC(=O)NC 527a_100102657272_200000759805 [1,0,1,0,0,1|1,0,0]=4 7030 B13R1.5 CCc1ccc(cc1)NC(=O)NC 2430a_100000211069_100102657272 [1,0,1,0,0,1|1,0,0]=4 7031 B13R1.5 COC(=O)Cc1ccc(cc1)OC 34a_100000211648_200000210301 [1,0,1,0,0,1|1,0,0]=4 7032 B13R1.5 COC(=O)Cc1ccc(cc1)O[13CH3] 34a_100000211648_200025704644 [1,0,1,0,0,1|1,0,0]=4 7033 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_100000149743_200000210301 [1,0,1,0,0,1|1,0,0]=4 7034 B13R1.5 COC(=O)Cc1ccc(cc1)SC 62a_200000210301_100000149743 [1,0,1,0,0,1|1,0,0]=4 7035 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_100000149743_200025704644 [1,0,1,0,0,1|1,0,0]=4 7036 B13R1.5 COC(=O)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100000149743 [1,0,1,0,0,1|1,0,0]=4 7037 B13R1.5 COC(=O)Nc1ccc(cc1)OC 34a_100011235918_200000210301 [1,0,1,0,0,1|1,0,0]=4 7038 B13R1.5 COC(=O)Nc1ccc(cc1)O[13CH3] 34a_100011235918_200025704644 [1,0,1,0,0,1|1,0,0]=4 7039 B13R1.5 COC(=O)Nc1ccc(cc1)SC 62a_200000210301_100000181880 [1,0,1,0,0,1|1,0,0]=4 7040 B13R1.5 COC(=O)Nc1ccc(cc1)S[13CH3] 62a_200025704644_100000181880 [1,0,1,0,0,1|1,0,0]=4 7041 B13R1.2065 CCC(=O)c1ccc(cc1NC)C 27a_100102657272_200012349623 [0,0,1,0,1,1|1,0,0]=4 7042 B13R1.2065 CNc1cc(ccc1C(=O)OC)O 271570a_203496583355_200160487225 [0,0,1,0,1,1|1,0,0]=4 7043 B13R1.2065 CNc1cc(ncc1C(=O)OC)C 27a_100102657272_100011998247 [0,0,1,0,1,1|1,0,0]=4 7044 B13R1.2065 CNc1nc(cnc1C(=O)OC)C 27a_100102657272_100000099855 [0,0,1,0,1,1|1,0,0]=4 7045 B13R1.2065 COC(=O)c1ccc(cc1OC)C 34a_100000148187_200000210301 [0,0,1,0,1,1|1,0,0]=4 7046 B13R1.2065 COC(=O)c1ccc(cc1OC)C 7a_100000148187_200000210301 [0,0,1,0,1,1|1,0,0]=4 7047 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])C 34a_100000148187_200025704644 [0,0,1,0,1,1|1,0,0]=4 7048 B13R1.2065 COC(=O)c1ccc(cc1O[13CH3])C 7a_100000148187_200025704644 [0,0,1,0,1,1|1,0,0]=4 7049 B13R1.2065 COC(=O)c1ccc(cc1SC)C 62a_100012340597_200000210301 [0,0,1,0,1,1|1,0,0]=4 7050 B13R1.2065 COC(=O)c1ccc(cc1SC)C 62a_200000210301_100012340597 [0,0,1,0,1,1|1,0,0]=4 7051 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])C 62a_100012340597_200025704644 [0,0,1,0,1,1|1,0,0]=4 7052 B13R1.2065 COC(=O)c1ccc(cc1S[13CH3])C 62a_200025704644_100012340597 [0,0,1,0,1,1|1,0,0]=4 7053 B13R1.2065 COC(=O)c1ccc(nc1SC)C 62a_100000054099_200000210301 [0,0,1,0,1,1|1,0,0]=4 7054 B13R1.2065 COC(=O)c1ccc(nc1SC)C 62a_200000210301_100000054099 [0,0,1,0,1,1|1,0,0]=4 7055 B13R1.2065 COC(=O)c1ccc(nc1S[13CH3])C 62a_100000054099_200025704644 [0,0,1,0,1,1|1,0,0]=4 7056 B13R1.2065 COC(=O)c1ccc(nc1S[13CH3])C 62a_200025704644_100000054099 [0,0,1,0,1,1|1,0,0]=4 7057 B13R2.57 C=Cc1ccc2c(c1)CNCC2 271570a_100011290941_100015189961 [2,0,0,0,0,1|0,0,1]=4 7058 B13R2.57 C=Cc1ccc2c(c1)NCCC2 271570a_100011290941_100010196366 [2,0,0,0,0,1|0,0,1]=4 7059 B13R2.57 C=Cc1ccc2c(c1)NCCO2 271570a_100011290941_100000708519 [2,0,0,0,0,1|0,0,1]=4 7060 B13R2.57 C=Cc1ccc2c(c1)NCCS2 271570a_100011290941_100013243616 [2,0,0,0,0,1|0,0,1]=4 7061 B13R2.57 COc1ccc2c(c1)CCCC2 34a_100000186212_200000210301 [2,0,0,0,0,1|1,0,0]=4 7062 B13R2.57 COc1ccc2c(c1)CCCC2 7a_100000186212_200000210301 [2,0,0,0,0,1|1,0,0]=4 7063 B13R2.57 COc1ccc2c(c1)CCCN2 34a_100000070867_200000210301 [2,0,0,0,0,1|1,0,0]=4 7064 B13R2.57 COc1ccc2c(c1)CCNC2 34a_100000077532_200000210301 [2,0,0,0,0,1|1,0,0]=4 7065 B13R2.57 COc1ccc2c(c1)CCOC2 34a_100009841951_200000210301 [2,0,0,0,0,1|1,0,0]=4 7066 B13R2.57 COc1ccc2c(c1)CCOC2 7a_100009841951_200000210301 [2,0,0,0,0,1|1,0,0]=4 7067 B13R2.57 COc1ccc2c(c1)CNCC2 34a_100015185785_200000210301 [2,0,0,0,0,1|0,0,0]=3 7068 B13R2.57 COc1ccc2c(c1)NCCC2 34a_106638131596_200000210301 [2,0,0,0,0,1|0,0,0]=3 7069 B13R2.57 COc1ccc2c(c1)NCCO2 34a_100020636358_200000210301 [2,0,0,0,0,1|0,0,0]=3 7070 B13R2.57 COc1ccc2c(c1)OCCO2 34a_100000234341_200000210301 [2,0,0,0,0,1|1,0,0]=4 7071 B13R2.57 CSc1ccc2c(c1)CNCC2 62a_100015189961_200000210301 [2,0,0,0,0,1|0,1,0]=4 7072 B13R2.57 CSc1ccc2c(c1)CNCC2 62a_200000210301_100015189961 [2,0,0,0,0,1|0,1,0]=4 7073 B13R2.57 CSc1ccc2c(c1)NCCC2 62a_100010196366_200000210301 [2,0,0,0,0,1|0,1,0]=4 7074 B13R2.57 CSc1ccc2c(c1)NCCC2 62a_200000210301_100010196366 [2,0,0,0,0,1|0,1,0]=4 7075 B13R2.57 CSc1ccc2c(c1)NCCO2 62a_200000210301_100000708519 [2,0,0,0,0,1|0,1,0]=4 7076 B13R2.57 CSc1ccc2c(c1)NCCS2 62a_200000210301_100013243616 [2,0,0,0,0,1|0,1,0]=4 7077 B13R2.57 [13CH3]Oc1ccc2c(c1)CCCC2 34a_100000186212_200025704644 [2,0,0,0,0,1|1,0,0]=4 7078 B13R2.57 [13CH3]Oc1ccc2c(c1)CCCC2 7a_100000186212_200025704644 [2,0,0,0,0,1|1,0,0]=4 7079 B13R2.57 [13CH3]Oc1ccc2c(c1)CCCN2 34a_100000070867_200025704644 [2,0,0,0,0,1|1,0,0]=4 7080 B13R2.57 [13CH3]Oc1ccc2c(c1)CCNC2 34a_100000077532_200025704644 [2,0,0,0,0,1|1,0,0]=4 7081 B13R2.57 [13CH3]Oc1ccc2c(c1)CCOC2 34a_100009841951_200025704644 [2,0,0,0,0,1|1,0,0]=4 7082 B13R2.57 [13CH3]Oc1ccc2c(c1)CCOC2 7a_100009841951_200025704644 [2,0,0,0,0,1|1,0,0]=4 7083 B13R2.57 [13CH3]Oc1ccc2c(c1)CNCC2 34a_100015185785_200025704644 [2,0,0,0,0,1|0,0,0]=3 7084 B13R2.57 [13CH3]Oc1ccc2c(c1)NCCC2 34a_106638131596_200025704644 [2,0,0,0,0,1|0,0,0]=3 7085 B13R2.57 [13CH3]Oc1ccc2c(c1)NCCO2 34a_100020636358_200025704644 [2,0,0,0,0,1|0,0,0]=3 7086 B13R2.57 [13CH3]Oc1ccc2c(c1)OCCO2 34a_100000234341_200025704644 [2,0,0,0,0,1|1,0,0]=4 7087 B13R2.57 [13CH3]Sc1ccc2c(c1)CNCC2 62a_100015189961_200025704644 [2,0,0,0,0,1|0,1,0]=4 7088 B13R2.57 [13CH3]Sc1ccc2c(c1)CNCC2 62a_200025704644_100015189961 [2,0,0,0,0,1|0,1,0]=4 7089 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCC2 62a_100010196366_200025704644 [2,0,0,0,0,1|0,1,0]=4 7090 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCC2 62a_200025704644_100010196366 [2,0,0,0,0,1|0,1,0]=4 7091 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCO2 62a_200025704644_100000708519 [2,0,0,0,0,1|0,1,0]=4 7092 B13R2.57 [13CH3]Sc1ccc2c(c1)NCCS2 62a_200025704644_100013243616 [2,0,0,0,0,1|0,1,0]=4 7093 B15R1.18 CCC(=O)CSc1ccc(cc1)CCN 62a_100000747405_100000755846 [0,0,1,0,0,2|1,0,0]=4 7094 B15R1.18 CCC(=O)CSc1ccc(cc1)CCN 62a_100000755846_100000747405 [0,0,1,0,0,2|1,0,0]=4 7095 B15R1.18 CCCc1ccc(cc1)NCC(=O)OC 2230a_100000211780_100000747449 [0,0,1,0,0,2|1,0,0]=4 7096 B15R1.18 CCCc1ccc(cc1)NCC(=O)OC 34a_100000211780_100000747449 [0,0,1,0,0,2|1,0,0]=4 7097 B15R1.18 CCCc1ccc(cc1)OCC(=O)OC 34a_100000749406_100000747449 [0,0,1,0,0,2|1,0,0]=4 7098 B15R1.18 CCCc1ccc(cc1)OCC(=O)OC 7a_100000749406_100000747449 [0,0,1,0,0,2|1,0,0]=4 7099 B15R1.18 CCCc1ccc(cc1)SCC(=O)OC 62a_100000747449_100000750032 [0,0,1,0,0,2|1,0,0]=4 7100 B15R1.18 CCCc1ccc(cc1)SCC(=O)OC 62a_100000750032_100000747449 [0,0,1,0,0,2|1,0,0]=4 7101 B15R1.18 CNC(=O)COc1ccc(cc1)CCN 34a_100000743037_100000183359 [0,0,1,0,0,2|1,0,0]=4 7102 B15R1.18 CNC(=O)CSc1ccc(cc1)CCN 62a_100000183359_100000755846 [0,0,1,0,0,2|1,0,0]=4 7103 B15R1.18 CNC(=O)CSc1ccc(cc1)CCN 62a_100000755846_100000183359 [0,0,1,0,0,2|1,0,0]=4 7104 B15R1.18 COC(=O)CNc1ccc(cc1)CCO 2230a_100011204434_100000747449 [0,0,1,0,0,2|1,0,0]=4 7105 B15R1.18 COC(=O)CNc1ccc(cc1)CCO 34a_100011204434_100000747449 [0,0,1,0,0,2|1,0,0]=4 7106 B15R1.18 COC(=O)COc1ccc(cc1)CCBr 34a_100009816426_100000747449 [0,0,1,0,0,2|1,0,0]=4 7107 B15R1.18 COC(=O)COc1ccc(cc1)CCBr 7a_100009816426_100000747449 [0,0,1,0,0,2|1,0,0]=4 7108 B15R1.18 COC(=O)COc1ccc(cc1)CCN 34a_100000743037_100000747449 [0,0,1,0,0,2|0,0,0]=3 7109 B15R1.18 COC(=O)COc1ccc(cc1)CCO 34a_100011215338_100000747449 [0,0,1,0,0,2|1,0,0]=4 7110 B15R1.18 COC(=O)COc1ccc(cc1)CCO 7a_100011215338_100000747449 [0,0,1,0,0,2|1,0,0]=4 7111 B15R1.18 COC(=O)CSc1ccc(cc1)CCN 62a_100000747449_100000755846 [0,0,1,0,0,2|0,0,0]=3 7112 B15R1.18 COC(=O)CSc1ccc(cc1)CCN 62a_100000755846_100000747449 [0,0,1,0,0,2|0,0,0]=3 7113 B15R1.18 COC(=O)CSc1ccc(cc1)CCO 62a_100000747449_100000766406 [0,0,1,0,0,2|1,0,0]=4 7114 B15R1.18 COC(=O)CSc1ccc(cc1)CCO 62a_100000766406_100000747449 [0,0,1,0,0,2|1,0,0]=4 7115 B15R1.18 COC(=O)CSc1ccc(cc1)CNN 62a_100000747449_100016993955 [0,0,1,0,0,2|1,0,0]=4 7116 B15R1.18 COC(=O)CSc1ccc(cc1)CNN 62a_100016993955_100000747449 [0,0,1,0,0,2|1,0,0]=4 7117 B15R1.3779 CCC(=O)CSc1ccc(c(c1)N)CC 62a_100000747405_100012354963 [0,0,1,0,0,2|1,0,0]=4 7118 B15R1.3779 CCC(=O)CSc1ccc(c(c1)N)CC 62a_100012354963_100000747405 [0,0,1,0,0,2|1,0,0]=4 7119 B15R1.3779 CCc1ccc(cc1Cl)NCC(=O)OC 2230a_100000766362_100000747449 [0,0,1,0,0,2|1,0,0]=4 7120 B15R1.3779 CCc1ccc(cc1Cl)NCC(=O)OC 34a_100000766362_100000747449 [0,0,1,0,0,2|1,0,0]=4 7121 B15R1.3779 CCc1ccc(cc1Cl)NCC(=O)OC 7a_100000766362_100000747449 [0,0,1,0,0,2|1,0,0]=4 7122 B15R1.3779 CCc1ccc(cc1Cl)OCC(=O)OC 34a_100009886192_100000747449 [0,0,1,0,0,2|1,0,0]=4 7123 B15R1.3779 CCc1ccc(cc1Cl)OCC(=O)OC 7a_100009886192_100000747449 [0,0,1,0,0,2|1,0,0]=4 7124 B15R1.3779 CCc1ccc(cc1F)SCC(=O)OC 62a_100000747449_200010071577 [0,0,1,0,0,2|1,0,0]=4 7125 B15R1.3779 CCc1ccc(cc1F)SCC(=O)OC 62a_200010071577_100000747449 [0,0,1,0,0,2|1,0,0]=4 7126 B15R1.3779 CCc1ccc(cc1N)SCC(=O)NC 62a_100000183359_100012354963 [0,0,1,0,0,2|1,0,0]=4 7127 B15R1.3779 CCc1ccc(cc1N)SCC(=O)NC 62a_100012354963_100000183359 [0,0,1,0,0,2|1,0,0]=4 7128 B15R1.3779 CCc1ccc(cc1N)SCC(=O)OC 62a_100000747449_100012354963 [0,0,1,0,0,2|0,0,0]=3 7129 B15R1.3779 CCc1ccc(cc1N)SCC(=O)OC 62a_100012354963_100000747449 [0,0,1,0,0,2|0,0,0]=3 7130 B15R1.3779 CNc1ccc(cc1N)SCC(=O)OC 62a_100000741790_100000747449 [0,0,1,0,0,2|1,0,0]=4 7131 B15R1.3779 COC(=O)COc1ccc(c(c1)N)SC 62a_200000210301_200010369463 [0,0,1,0,0,2|1,0,0]=4 7132 B15R1.3779 COC(=O)COc1ccc(c(c1)N)SC 62a_200010369463_200000210301 [0,0,1,0,0,2|1,0,0]=4 7133 B15R1.3779 COC(=O)COc1ccc(c(c1)N)S[13CH3] 62a_200010369463_200025704644 [0,0,1,0,0,2|1,0,0]=4 7134 B15R1.3779 COC(=O)COc1ccc(c(c1)N)S[13CH3] 62a_200025704644_200010369463 [0,0,1,0,0,2|1,0,0]=4 7135 B15R1.3779 COC(=O)CSc1ccc(c(c1)N)CO 62a_100000718831_100000747449 [0,0,1,0,0,2|1,0,0]=4 7136 B15R1.3779 COC(=O)CSc1ccc(c(c1)N)CO 62a_100000747449_100000718831 [0,0,1,0,0,2|1,0,0]=4 7137 B15R1.3779 COC(=O)CSc1ccc(c(c1)N)OC 62a_100000747449_100011249504 [0,0,1,0,0,2|1,0,0]=4 7138 B15R1.3779 COC(=O)CSc1ccc(c(c1)N)OC 62a_100011249504_100000747449 [0,0,1,0,0,2|1,0,0]=4 7139 B15R2.68695 C=C(C)c1ccc2c(c1)NCCCC2 271570a_100000694244_100010199521 [1,0,0,0,0,2|1,0,0]=4 7140 B15R2.68695 CC(=O)c1ccc2c(c1)OCCCO2 1458a_100000198587_200000210301 [1,0,0,0,0,2|1,0,0]=4 7141 B15R2.68695 [13CH3]C(=O)c1ccc2c(c1)OCCCO2 1458a_100000198587_200025704644 [1,0,0,0,0,2|1,0,0]=4 7142 B15R2.10338 CC=Cc1ccc2c(c1)NCCCC2 271570a_100016259895_100010199521 [1,0,0,0,0,2|1,0,0]=4 7143 B17R2.556 CCC(=O)CSc1ccc2c(c1)CNCC2 62a_100000747405_100015189961 [0,0,0,0,0,3|1,0,0]=4 7144 B17R2.556 CCC(=O)CSc1ccc2c(c1)CNCC2 62a_100015189961_100000747405 [0,0,0,0,0,3|1,0,0]=4 7145 B17R2.556 CCC(=O)CSc1ccc2c(c1)NCCC2 62a_100000747405_100010196366 [0,0,0,0,0,3|1,0,0]=4 7146 B17R2.556 CCC(=O)CSc1ccc2c(c1)NCCC2 62a_100010196366_100000747405 [0,0,0,0,0,3|1,0,0]=4 7147 B17R2.556 CCC(=O)CSc1ccc2c(c1)NCCO2 62a_100000747405_100000708519 [0,0,0,0,0,3|1,0,0]=4 7148 B17R2.556 CCC(=O)CSc1ccc2c(c1)NCCS2 62a_100000747405_100013243616 [0,0,0,0,0,3|1,0,0]=4 7149 B17R2.556 CNC(=O)COc1ccc2c(c1)CNCC2 34a_100015185785_100000183359 [0,0,0,0,0,3|1,0,0]=4 7150 B17R2.556 CNC(=O)COc1ccc2c(c1)NCCC2 34a_106638131596_100000183359 [0,0,0,0,0,3|1,0,0]=4 7151 B17R2.556 CNC(=O)COc1ccc2c(c1)NCCO2 34a_100020636358_100000183359 [0,0,0,0,0,3|1,0,0]=4 7152 B17R2.556 CNC(=O)CSc1ccc2c(c1)CNCC2 62a_100000183359_100015189961 [0,0,0,0,0,3|1,0,0]=4 7153 B17R2.556 CNC(=O)CSc1ccc2c(c1)CNCC2 62a_100015189961_100000183359 [0,0,0,0,0,3|1,0,0]=4 7154 B17R2.556 CNC(=O)CSc1ccc2c(c1)NCCC2 62a_100000183359_100010196366 [0,0,0,0,0,3|1,0,0]=4 7155 B17R2.556 CNC(=O)CSc1ccc2c(c1)NCCC2 62a_100010196366_100000183359 [0,0,0,0,0,3|1,0,0]=4 7156 B17R2.556 CNC(=O)CSc1ccc2c(c1)NCCO2 62a_100000183359_100000708519 [0,0,0,0,0,3|1,0,0]=4 7157 B17R2.556 CNC(=O)CSc1ccc2c(c1)NCCS2 62a_100000183359_100013243616 [0,0,0,0,0,3|1,0,0]=4 7158 B17R2.556 COC(=O)CNc1ccc2c(c1)CCCC2 2230a_100011205400_100000747449 [0,0,0,0,0,3|1,0,0]=4 7159 B17R2.556 COC(=O)CNc1ccc2c(c1)CCCC2 34a_100011205400_100000747449 [0,0,0,0,0,3|1,0,0]=4 7160 B17R2.556 COC(=O)CNc1ccc2c(c1)CCCO2 2230a_100138412508_100000747449 [0,0,0,0,0,3|1,0,0]=4 7161 B17R2.556 COC(=O)CNc1ccc2c(c1)CCCO2 34a_100138412508_100000747449 [0,0,0,0,0,3|1,0,0]=4 7162 B17R2.556 COC(=O)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000747449 [0,0,0,0,0,3|1,0,0]=4 7163 B17R2.556 COC(=O)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000747449 [0,0,0,0,0,3|1,0,0]=4 7164 B17R2.556 COC(=O)COc1ccc2c(c1)CCCC2 34a_100000186212_100000747449 [0,0,0,0,0,3|1,0,0]=4 7165 B17R2.556 COC(=O)COc1ccc2c(c1)CCCC2 7a_100000186212_100000747449 [0,0,0,0,0,3|1,0,0]=4 7166 B17R2.556 COC(=O)COc1ccc2c(c1)CCCN2 34a_100000070867_100000747449 [0,0,0,0,0,3|1,0,0]=4 7167 B17R2.556 COC(=O)COc1ccc2c(c1)CCNC2 34a_100000077532_100000747449 [0,0,0,0,0,3|1,0,0]=4 7168 B17R2.556 COC(=O)COc1ccc2c(c1)CCOC2 34a_100009841951_100000747449 [0,0,0,0,0,3|1,0,0]=4 7169 B17R2.556 COC(=O)COc1ccc2c(c1)CCOC2 7a_100009841951_100000747449 [0,0,0,0,0,3|1,0,0]=4 7170 B17R2.556 COC(=O)COc1ccc2c(c1)CNCC2 34a_100015185785_100000747449 [0,0,0,0,0,3|0,0,0]=3 7171 B17R2.556 COC(=O)COc1ccc2c(c1)NCCC2 34a_106638131596_100000747449 [0,0,0,0,0,3|0,0,0]=3 7172 B17R2.556 COC(=O)COc1ccc2c(c1)NCCO2 34a_100020636358_100000747449 [0,0,0,0,0,3|0,0,0]=3 7173 B17R2.556 COC(=O)COc1ccc2c(c1)OCCO2 34a_100000234341_100000747449 [0,0,0,0,0,3|1,0,0]=4 7174 B17R2.556 COC(=O)CSc1ccc2c(c1)CCCC2 62a_100000747449_100011221367 [0,0,0,0,0,3|1,0,0]=4 7175 B17R2.556 COC(=O)CSc1ccc2c(c1)CCCC2 62a_100011221367_100000747449 [0,0,0,0,0,3|1,0,0]=4 7176 B17R2.556 COC(=O)CSc1ccc2c(c1)CCCN2 62a_100000747449_100016994925 [0,0,0,0,0,3|1,0,0]=4 7177 B17R2.556 COC(=O)CSc1ccc2c(c1)CCCN2 62a_100016994925_100000747449 [0,0,0,0,0,3|1,0,0]=4 7178 B17R2.556 COC(=O)CSc1ccc2c(c1)CCCO2 62a_100000747449_100011393166 [0,0,0,0,0,3|1,0,0]=4 7179 B17R2.556 COC(=O)CSc1ccc2c(c1)CCCO2 62a_100011393166_100000747449 [0,0,0,0,0,3|1,0,0]=4 7180 B17R2.556 COC(=O)CSc1ccc2c(c1)CCNC2 62a_100000686056_100000747449 [0,0,0,0,0,3|1,0,0]=4 7181 B17R2.556 COC(=O)CSc1ccc2c(c1)CCNC2 62a_100000747449_100000686056 [0,0,0,0,0,3|1,0,0]=4 7182 B17R2.556 COC(=O)CSc1ccc2c(c1)CNCC2 62a_100000747449_100015189961 [0,0,0,0,0,3|0,0,0]=3 7183 B17R2.556 COC(=O)CSc1ccc2c(c1)CNCC2 62a_100015189961_100000747449 [0,0,0,0,0,3|0,0,0]=3 7184 B17R2.556 COC(=O)CSc1ccc2c(c1)COCC2 62a_100000747449_100010128096 [0,0,0,0,0,3|1,0,0]=4 7185 B17R2.556 COC(=O)CSc1ccc2c(c1)COCC2 62a_100010128096_100000747449 [0,0,0,0,0,3|1,0,0]=4 7186 B17R2.556 COC(=O)CSc1ccc2c(c1)NCCC2 62a_100000747449_100010196366 [0,0,0,0,0,3|0,0,0]=3 7187 B17R2.556 COC(=O)CSc1ccc2c(c1)NCCC2 62a_100010196366_100000747449 [0,0,0,0,0,3|0,0,0]=3 7188 B17R2.556 COC(=O)CSc1ccc2c(c1)NCCO2 62a_100000747449_100000708519 [0,0,0,0,0,3|0,0,0]=3 7189 B17R2.556 COC(=O)CSc1ccc2c(c1)NCCS2 62a_100000747449_100013243616 [0,0,0,0,0,3|0,0,0]=3 7190 B17R2.556 COC(=O)CSc1ccc2c(c1)OCCC2 62a_100000747449_100010700467 [0,0,0,0,0,3|1,0,0]=4 7191 B17R2.556 COC(=O)CSc1ccc2c(c1)OCCC2 62a_100010700467_100000747449 [0,0,0,0,0,3|1,0,0]=4 7192 B17R2.556 COC(=O)CSc1ccc2c(c1)OCCN2 62a_100000747449_100012355470 [0,0,0,0,0,3|1,0,0]=4 7193 B17R2.556 COC(=O)CSc1ccc2c(c1)OCCO2 62a_100000747449_100011216881 [0,0,0,0,0,3|1,0,0]=4 7194 B17R2.556 COC(=O)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000747449 [0,0,0,0,0,3|1,0,0]=4 7195 B17R2.556 COC(=O)CSc1ccc2c(n1)NCCC2 62a_100000747449_100009952728 [0,0,0,0,0,3|1,0,0]=4 7196 B17R2.556 COC(=O)CSc1ccc2c(n1)NCCC2 62a_100009952728_100000747449 [0,0,0,0,0,3|1,0,0]=4 7197 B17R2.556 COC(=O)CSc1ccc2c(n1)NCCO2 62a_100000747449_100010209492 [0,0,0,0,0,3|1,0,0]=4 7198 B17R2.556 COC(=O)CSc1ccc2c(n1)NCCO2 62a_100010209492_100000747449 [0,0,0,0,0,3|1,0,0]=4 7199 B17R2.556 COC(=O)CSc1cnc2c(c1)NCCO2 62a_100000747449_100000700286 [0,0,0,0,0,3|1,0,0]=4 7200 B17R2.7777 CNC(=O)CCOc1ccc2c(c1)NCC2 34a_100020636427_100012179268 [0,0,0,0,0,3|1,0,0]=4 7201 B17R2.7777 CNC(=O)CCSc1ccc2c(c1)NCC2 62a_100000737683_100000754641 [0,0,0,0,0,3|1,0,0]=4 7202 B17R2.7777 CNC(=O)CCSc1ccc2c(c1)NCC2 62a_100000754641_100000737683 [0,0,0,0,0,3|1,0,0]=4 7203 B17R2.7777 CNC(=O)COCc1ccc2c(c1)NCC2 34a_100000694088_100000183359 [0,0,0,0,0,3|1,0,0]=4 7204 B17R2.7777 COC(=O)C=NNc1ccc2c(c1)CCC2 4a_100015187744_200011823558 [0,0,0,0,0,3|1,0,0]=4 7205 B17R2.7777 COC(=O)CCNc1ccc2c(c1)CCC2 2230a_100000211504_100000204255 [0,0,0,0,0,3|1,0,0]=4 7206 B17R2.7777 COC(=O)CCNc1ccc2c(c1)CCC2 34a_100000211504_100000742370 [0,0,0,0,0,3|1,0,0]=4 7207 B17R2.7777 COC(=O)CCOc1ccc2c(c1)CCC2 34a_100000209987_100000742370 [0,0,0,0,0,3|1,0,0]=4 7208 B17R2.7777 COC(=O)CCOc1ccc2c(c1)CCC2 7a_100000209987_100000204255 [0,0,0,0,0,3|1,0,0]=4 7209 B17R2.7777 COC(=O)CCOc1ccc2c(c1)NCC2 34a_100020636427_100000742370 [0,0,0,0,0,3|0,0,0]=3 7210 B17R2.7777 COC(=O)CCSc1cc2c(cn1)CCN2 62a_100000204255_100020639910 [0,0,0,0,0,3|1,0,0]=4 7211 B17R2.7777 COC(=O)CCSc1cc2c(cn1)CCN2 62a_100020639910_100000204255 [0,0,0,0,0,3|1,0,0]=4 7212 B17R2.7777 COC(=O)CCSc1ccc2c(c1)CCC2 62a_100000204255_100000745594 [0,0,0,0,0,3|1,0,0]=4 7213 B17R2.7777 COC(=O)CCSc1ccc2c(c1)CCC2 62a_100000745594_100000204255 [0,0,0,0,0,3|1,0,0]=4 7214 B17R2.7777 COC(=O)CCSc1ccc2c(c1)NCC2 62a_100000204255_100000754641 [0,0,0,0,0,3|0,0,0]=3 7215 B17R2.7777 COC(=O)CCSc1ccc2c(c1)NCC2 62a_100000754641_100000204255 [0,0,0,0,0,3|0,0,0]=3 7216 B17R2.7777 COC(=O)CCSc1ccc2c(c1)OCC2 62a_100000204255_100009818566 [0,0,0,0,0,3|1,0,0]=4 7217 B17R2.7777 COC(=O)CCSc1ccc2c(c1)OCC2 62a_100009818566_100000204255 [0,0,0,0,0,3|1,0,0]=4 7218 B17R2.7777 COC(=O)CCSc1cnc2c(c1)NCC2 62a_100000204255_100000698607 [0,0,0,0,0,3|1,0,0]=4 7219 B17R2.7777 COC(=O)CCSc1cnc2c(c1)NCC2 62a_100000698607_100000204255 [0,0,0,0,0,3|1,0,0]=4 7220 B17R2.7777 COC(=O)COCc1ccc2c(c1)CCC2 34a_200000765175_100000747449 [0,0,0,0,0,3|1,0,0]=4 7221 B17R2.7777 COC(=O)COCc1ccc2c(c1)CCC2 7a_200000765175_100000747449 [0,0,0,0,0,3|1,0,0]=4 7222 B17R2.7777 COC(=O)COCc1ccc2c(c1)NCC2 34a_100000694088_100000747449 [0,0,0,0,0,3|0,0,0]=3 7223 B17R2.7777 COC(=O)OCSc1cc2c(cn1)CCN2 62a_100020639910_100000139417 [0,0,0,0,0,3|1,0,0]=4 7224 B17R2.7777 COC(=O)OCSc1ccc2c(c1)CCC2 62a_100000745594_100000139417 [0,0,0,0,0,3|1,0,0]=4 7225 B17R2.7777 COC(=O)OCSc1ccc2c(c1)NCC2 62a_100000754641_100000139417 [0,0,0,0,0,3|0,0,0]=3 7226 B17R2.7777 COC(=O)OCSc1ccc2c(c1)OCC2 62a_100009818566_100000139417 [0,0,0,0,0,3|1,0,0]=4 7227 B17R2.7777 COC(=O)OCSc1cnc2c(c1)NCC2 62a_100000698607_100000139417 [0,0,0,0,0,3|1,0,0]=4