0 B12R1.43 C/C(=C\c1ccccc1)/C(=O)[13CH3] 1458a_100016990649_200025704644 [0,0,0,0,0,0|0,0,0]=0 1 B12R1.43 C/C(=C\c1ccccn1)/C(=O)[13CH3] 1458a_100025712827_200025704644 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 11a_100000106764_100009813364 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 1626a_100000106764_100009813364 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.43 C=C(C)C(=O)Cc1ccccc1 1458a_100000185857_100015291786 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.43 C=C(C)C(=O)Cc1ccccn1 1458a_100000185857_100000721315 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.43 C=C(C)C(=O)Cc1cccnc1 1458a_100000185857_100000733263 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.43 C=C(C)C(=O)Cc1ccncc1 1458a_100000185857_100000705612 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.43 C=C(C)C(=O)Nc1ccccc1 11a_100000106764_100000185857 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.43 C=C(C)C(=O)Nc1ccccc1 1626a_100000106764_100000185857 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.43 C=C(C)C(=O)Nc1ccccc1 22a_100000106764_100000185857 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 11a_100000106764_100000039160 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 1626a_100000106764_100000039160 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 22a_100000106764_100000039160 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.43 C=C(F)C(=O)Nc1ccccc1 11a_100000106764_100000036797 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.43 C=C(F)C(=O)Nc1ccccc1 1626a_100000106764_100000036797 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.43 C=C(F)C(=O)Nc1ccccc1 22a_100000106764_100000036797 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.43 CC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_200000210301 [0,0,0,0,0,0|0,0,0]=0 18 B12R1.43 CC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200000210301 [0,0,0,0,0,0|1,0,0]=1 19 B12R1.43 CC(=O)/C(=C/c1ccccn1)/C 1458a_100025712827_200000210301 [0,0,0,0,0,0|1,0,0]=1 20 B12R1.43 CC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200000210301 [0,0,0,0,0,0|1,0,0]=1 21 B12R1.43 CC(=O)C(=Cc1cccnc1)F 1458a_100000731744_200000210301 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.43 CC(=O)C(=O)Nc1ccccc1 1458a_100000738435_200000210301 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000070787_200011218536 [0,0,0,0,0,0|0,0,2]=2 24 B12R1.43 CC(=O)C(C)Cc1ccccc1 1458a_100000754839_200000210301 [0,0,0,0,0,0|0,0,2]=2 25 B12R1.43 CC(=O)C(C)Cc1ccccn1 1458a_100012000792_200000210301 [0,0,0,0,0,0|1,0,2]=3 26 B12R1.43 CC(=O)C(C)Oc1ccccc1 1458a_100000188414_200000210301 [0,0,0,0,0,0|1,0,1]=2 27 B12R1.43 CC(=O)C(C)Oc1ccccc1 7a_100000210340_100000179758 [0,0,0,0,0,0|1,0,1]=2 28 B12R1.43 CC(=O)C(C)Oc1cccnc1 7a_100000210849_100000179758 [0,0,0,0,0,0|2,0,1]=3 29 B12R1.43 CC(=O)C(C)Oc1cncnc1 7a_100000754086_100000179758 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.43 CC(=O)C(C)Sc1ccccc1 1458a_100000199063_200000210301 [0,0,0,0,0,0|1,0,1]=2 31 B12R1.43 CC(=O)C(C)Sc1ccccc1 62a_100000719477_100009814033 [0,0,0,0,0,0|1,0,1]=2 32 B12R1.43 CC(=O)C(C)Sc1ccccc1 62a_100009814033_100000041952 [0,0,0,0,0,0|1,0,1]=2 33 B12R1.43 CC(=O)C(C)Sc1ccccn1 1458a_100000156770_200000210301 [0,0,0,0,0,0|2,0,1]=3 34 B12R1.43 CC(=O)C(C)Sc1ccccn1 62a_100009814033_100011216584 [0,0,0,0,0,0|2,0,1]=3 35 B12R1.43 CC(=O)C(C)Sc1ccccn1 62a_100011216584_100009814033 [0,0,0,0,0,0|2,0,1]=3 36 B12R1.43 CC(=O)C(C)Sc1cccnc1 62a_100000210063_100009814033 [0,0,0,0,0,0|2,0,1]=3 37 B12R1.43 CC(=O)C(C)Sc1cccnc1 62a_100009814033_100000210063 [0,0,0,0,0,0|2,0,1]=3 38 B12R1.43 CC(=O)C(C)Sc1cccnn1 62a_100009814033_100016991348 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.43 CC(=O)C(C)Sc1cccnn1 62a_100016991348_100009814033 [0,0,0,0,0,0|3,0,1]=4 40 B12R1.43 CC(=O)C(C)Sc1ccncc1 62a_100000728582_100009814033 [0,0,0,0,0,0|2,0,1]=3 41 B12R1.43 CC(=O)C(C)Sc1ccncc1 62a_100009814033_100000728582 [0,0,0,0,0,0|2,0,1]=3 42 B12R1.43 CC(=O)C(C)Sc1ccncn1 62a_100000703185_100009814033 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.43 CC(=O)C(C)Sc1ccncn1 62a_100009814033_100000703185 [0,0,0,0,0,0|3,0,1]=4 44 B12R1.43 CC(=O)C(C)Sc1ccnnc1 62a_100000732662_100009814033 [0,0,0,0,0,0|3,0,1]=4 45 B12R1.43 CC(=O)C(C)Sc1ccnnc1 62a_100009814033_100000732662 [0,0,0,0,0,0|3,0,1]=4 46 B12R1.43 CC(=O)C(C)Sc1cnccn1 62a_100000211759_100009814033 [0,0,0,0,0,0|3,0,1]=4 47 B12R1.43 CC(=O)C(C)Sc1cnccn1 62a_100009814033_100000211759 [0,0,0,0,0,0|3,0,1]=4 48 B12R1.43 CC(=O)C(C)Sc1cncnc1 62a_100009814033_100011206942 [0,0,0,0,0,0|3,0,1]=4 49 B12R1.43 CC(=O)C(C)Sc1cncnc1 62a_100011206942_100009814033 [0,0,0,0,0,0|3,0,1]=4 50 B12R1.43 CC(=O)C(C)Sc1ncccn1 62a_100000211032_100009814033 [0,0,0,0,0,0|3,0,1]=4 51 B12R1.43 CC(=O)C(C)Sc1ncccn1 62a_100009814033_100000211032 [0,0,0,0,0,0|3,0,1]=4 52 B12R1.43 CC(=O)N(C)Cc1ccccc1 11a_100000186898_100015343762 [0,0,0,0,0,0|1,0,1]=2 53 B12R1.43 CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100015343762 [0,0,0,0,0,0|1,0,1]=2 54 B12R1.43 CC(=O)N(C)Cc1ccccc1 240690a_100000186898_100015343762 [0,0,0,0,0,0|1,0,1]=2 55 B12R1.43 CC(=O)N(C)Cc1ccccc1 527a_100000186898_100103153847 [0,0,0,0,0,0|1,0,1]=2 56 B12R1.43 CC(=O)N(C)Cc1ccccn1 11a_100000207498_100015343762 [0,0,0,0,0,0|2,0,1]=3 57 B12R1.43 CC(=O)N(C)Cc1ccccn1 240690a_100000207498_100015343762 [0,0,0,0,0,0|2,0,1]=3 58 B12R1.43 CC(=O)N(C)Cc1ccccn1 527a_100000207498_100103153847 [0,0,0,0,0,0|2,0,1]=3 59 B12R1.43 CC(=O)N(C)Cc1cccnc1 11a_100000184577_100015343762 [0,0,0,0,0,0|2,0,1]=3 60 B12R1.43 CC(=O)N(C)Cc1cccnc1 240690a_100000184577_100015343762 [0,0,0,0,0,0|2,0,1]=3 61 B12R1.43 CC(=O)N(C)Cc1cccnc1 527a_100000184577_100103153847 [0,0,0,0,0,0|2,0,1]=3 62 B12R1.43 CC(=O)N(C)Cc1ccncc1 11a_100000187231_100015343762 [0,0,0,0,0,0|2,0,1]=3 63 B12R1.43 CC(=O)N(C)Cc1ccncc1 240690a_100000187231_100015343762 [0,0,0,0,0,0|2,0,1]=3 64 B12R1.43 CC(=O)N(C)Cc1ccncc1 527a_100000187231_100103153847 [0,0,0,0,0,0|2,0,1]=3 65 B12R1.43 CC(=O)N(C)Cc1cnccn1 11a_100011269079_100015343762 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.43 CC(=O)N(C)Cc1cnccn1 240690a_100011269079_100015343762 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.43 CC(=O)N(C)Cc1cnccn1 527a_100011269079_100103153847 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.43 CC(=O)N(C)Cc1ncccn1 11a_100025716638_100015343762 [0,0,0,0,0,0|3,0,1]=4 69 B12R1.43 CC(=O)N(C)Cc1ncccn1 240690a_100025716638_100015343762 [0,0,0,0,0,0|3,0,1]=4 70 B12R1.43 CC(=O)N(C)Cc1ncccn1 527a_100025716638_100103153847 [0,0,0,0,0,0|3,0,1]=4 71 B12R1.43 CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200000210301 [0,0,0,0,0,0|1,0,2]=3 72 B12R1.43 CC(C)C(=O)Cc1ccccc1 1458a_100000210198_100015291786 [0,0,0,0,0,0|2,0,2]=4 73 B12R1.43 CC(C)C(=O)Nc1ccccc1 11a_100000106764_100000210198 [0,0,0,0,0,0|3,0,1]=4 74 B12R1.43 CC(C)C(=O)Nc1ccccc1 1626a_100000106764_100000210198 [0,0,0,0,0,0|3,0,1]=4 75 B12R1.43 CC(C)C(=O)Nc1ccccc1 22a_100000106764_100000210198 [0,0,0,0,0,0|3,0,1]=4 76 B12R1.43 CC(C)C(=O)Nc1ccccc1 527a_100000106764_100000210198 [0,0,0,0,0,0|3,0,1]=4 77 B12R1.43 CC(C)N(C)Cc1ccccc1 2230a_100000068392_200000210301 [0,0,0,0,0,0|2,0,2]=4 78 B12R1.43 CC(C)N(C)Cc1ccccc1 2230a_100000186898_100000210206 [0,0,0,0,0,0|2,0,2]=4 79 B12R1.43 CC(C)N(C)Cc1ccccc1 269982a_100000068392_200000210301 [0,0,0,0,0,0|2,0,2]=4 80 B12R1.43 CC(C)N(C)Cc1ccccc1 269982a_100000186898_100000210206 [0,0,0,0,0,0|2,0,2]=4 81 B12R1.43 CC(C)N(C)Cc1ccccc1 269982a_200000211004_100000211182 [0,0,0,0,0,0|2,0,2]=4 82 B12R1.43 CC(C)N(C)Cc1ccccc1 270004a_200000211004_100015611070 [0,0,0,0,0,0|2,0,2]=4 83 B12R1.43 CC(C)N([13CH3])Cc1ccccc1 2230a_100000068392_200025704644 [0,0,0,0,0,0|2,0,2]=4 84 B12R1.43 CC(C)N([13CH3])Cc1ccccc1 269982a_100000068392_200025704644 [0,0,0,0,0,0|2,0,2]=4 85 B12R1.43 CC(Cc1ccccc1)C(=O)[13CH3] 1458a_100000754839_200025704644 [0,0,0,0,0,0|0,0,2]=2 86 B12R1.43 CC(Cc1ccccc1)N(C)C 269982a_100102631434_200011218536 [0,0,0,0,0,0|2,0,2]=4 87 B12R1.43 CC(Cc1ccccn1)C(=O)[13CH3] 1458a_100012000792_200025704644 [0,0,0,0,0,0|1,0,2]=3 88 B12R1.43 CC(F)C(=O)Cc1ccccc1 1458a_100000062450_100015291786 [0,0,0,0,0,0|2,0,2]=4 89 B12R1.43 CC(F)C(=O)Nc1ccccc1 11a_100000106764_100000062450 [0,0,0,0,0,0|3,0,1]=4 90 B12R1.43 CC(F)C(=O)Nc1ccccc1 1626a_100000106764_100000062450 [0,0,0,0,0,0|3,0,1]=4 91 B12R1.43 CC(F)C(=O)Nc1ccccc1 22a_100000106764_100000062450 [0,0,0,0,0,0|3,0,1]=4 92 B12R1.43 CC(F)C(=O)Nc1ccccc1 527a_100000106764_100000062450 [0,0,0,0,0,0|3,0,1]=4 93 B12R1.43 CC(Nc1ccccc1)C(=O)N 34a_100000106764_100000702099 [0,0,0,0,0,0|2,0,1]=3 94 B12R1.43 CC(Oc1ccccc1)C(=O)N 34a_100000210340_100000702099 [0,0,0,0,0,0|2,0,1]=3 95 B12R1.43 CC(Oc1ccccc1)C(=O)N 7a_100000210340_100000702099 [0,0,0,0,0,0|2,0,1]=3 96 B12R1.43 CC(Oc1ccccc1)C(=O)[13CH3] 1458a_100000188414_200025704644 [0,0,0,0,0,0|1,0,1]=2 97 B12R1.43 CC(Oc1cccnc1)C(=O)N 34a_100000210849_100000702099 [0,0,0,0,0,0|3,0,1]=4 98 B12R1.43 CC(Oc1cccnc1)C(=O)N 7a_100000210849_100000702099 [0,0,0,0,0,0|3,0,1]=4 99 B12R1.43 CC(Oc1ccncc1)C(=O)N 34a_100000212176_100000702099 [0,0,0,0,0,0|3,0,1]=4 100 B12R1.43 CC(Sc1ccccc1)C(=O)N 62a_100000702099_100000041952 [0,0,0,0,0,0|2,0,1]=3 101 B12R1.43 CC(Sc1ccccc1)C(=O)N 62a_100000719477_100000702099 [0,0,0,0,0,0|2,0,1]=3 102 B12R1.43 CC(Sc1ccccc1)C(=O)[13CH3] 1458a_100000199063_200025704644 [0,0,0,0,0,0|1,0,1]=2 103 B12R1.43 CC(Sc1ccccn1)C(=O)N 62a_100000702099_100011216584 [0,0,0,0,0,0|3,0,1]=4 104 B12R1.43 CC(Sc1ccccn1)C(=O)N 62a_100011216584_100000702099 [0,0,0,0,0,0|3,0,1]=4 105 B12R1.43 CC(Sc1ccccn1)C(=O)[13CH3] 1458a_100000156770_200025704644 [0,0,0,0,0,0|2,0,1]=3 106 B12R1.43 CC(Sc1cccnc1)C(=O)N 62a_100000210063_100000702099 [0,0,0,0,0,0|3,0,1]=4 107 B12R1.43 CC(Sc1cccnc1)C(=O)N 62a_100000702099_100000210063 [0,0,0,0,0,0|3,0,1]=4 108 B12R1.43 CC(Sc1ccncc1)C(=O)N 62a_100000702099_100000728582 [0,0,0,0,0,0|3,0,1]=4 109 B12R1.43 CC(Sc1ccncc1)C(=O)N 62a_100000728582_100000702099 [0,0,0,0,0,0|3,0,1]=4 110 B12R1.43 CN(C)C(=O)Nc1ccccc1 2430a_100000106764_100102631434 [0,0,0,0,0,0|4,0,0]=4 111 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 1458a_100000717761_100015291786 [0,0,0,0,0,0|1,0,3]=4 112 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 22a_100000106764_100000717761 [0,0,0,0,0,0|2,0,2]=4 113 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 1458a_217856618621_100015291786 [0,0,0,0,0,0|1,0,3]=4 114 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 1626a_100000106764_217856618621 [0,0,0,0,0,0|2,0,2]=4 115 B12R1.43 C[C@H](O)C(=O)Nc1ccccc1 22a_100000106764_217856618621 [0,0,0,0,0,0|2,0,2]=4 116 B12R1.43 NC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011215815 [0,0,0,0,0,0|3,0,0]=3 117 B12R1.43 NC(=O)C(F)Nc1ccccc1 34a_100000106764_100009813875 [0,0,0,0,0,0|3,0,1]=4 118 B12R1.43 NC(=O)C(F)Oc1ccccc1 34a_100000210340_100009813875 [0,0,0,0,0,0|3,0,1]=4 119 B12R1.43 NC(=O)C(F)Oc1ccccc1 7a_100000210340_100009813875 [0,0,0,0,0,0|3,0,1]=4 120 B12R1.43 NC(=O)C(F)Sc1ccccc1 62a_100000719477_100009813875 [0,0,0,0,0,0|3,0,1]=4 121 B12R1.43 NC(=O)C(F)Sc1ccccc1 62a_100009813875_100000041952 [0,0,0,0,0,0|3,0,1]=4 122 B12R1.43 O=C([O-])C(F)Nc1ccccc1 34a_100000106764_100020610796 [0,0,0,0,0,0|3,0,1]=4 123 B12R1.43 O=C([O-])C(F)Oc1ccccc1 34a_100000210340_100020610796 [0,0,0,0,0,0|3,0,1]=4 124 B12R1.43 O=C([O-])C(F)Sc1ccccc1 62a_100000719477_100020610796 [0,0,0,0,0,0|3,0,1]=4 125 B12R1.43 O=C([O-])C(F)Sc1ccccc1 62a_100020610796_100000041952 [0,0,0,0,0,0|3,0,1]=4 126 B12R1.43 [13CH3]C(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_200025704644 [0,0,0,0,0,0|1,0,0]=1 127 B12R1.43 [13CH3]C(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_200025704644 [0,0,0,0,0,0|1,0,0]=1 128 B12R1.43 [13CH3]C(=O)C(=Cc1cccnc1)F 1458a_100000731744_200025704644 [0,0,0,0,0,0|2,0,0]=2 129 B12R1.43 [13CH3]C(=O)C(=O)Nc1ccccc1 1458a_100000738435_200025704644 [0,0,0,0,0,0|2,0,0]=2 130 B12R1.43 [13CH3]C(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_200025704644 [0,0,0,0,0,0|1,0,2]=3 131 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [1,0,0,0,0,0|1,0,2]=4 132 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [1,0,0,0,0,0|2,0,1]=4 133 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [1,0,0,0,0,0|2,0,1]=4 134 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [1,0,0,0,0,0|1,0,2]=4 135 B11R1.40 CC(Cc1ccccc1)O[13CH3] 34a_100000748627_200025704644 [1,0,0,0,0,0|1,0,2]=4 136 B11R1.40 CC(Cc1ccccc1)O[13CH3] 7a_100000748627_200025704644 [1,0,0,0,0,0|1,0,2]=4 137 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200011218536_200025704644 [1,0,0,0,0,0|1,0,2]=4 138 B11R1.40 CC(Cc1ccccc1)S[13CH3] 62a_200025704644_200011218536 [1,0,0,0,0,0|1,0,2]=4 139 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [1,0,0,0,0,0|1,0,2]=4 140 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [1,0,0,0,0,0|2,0,1]=4 141 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [1,0,0,0,0,0|2,0,1]=4 142 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [1,0,0,0,0,0|2,0,1]=4 143 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [1,0,0,0,0,0|2,0,1]=4 144 B11R1.40 CCC(C)Nc1ccccc1 34a_100000106764_100011215416 [1,0,0,0,0,0|1,0,2]=4 145 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [1,0,0,0,0,0|1,0,2]=4 146 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [1,0,0,0,0,0|1,0,2]=4 147 B11R1.40 CCC(C)Sc1ccccc1 62a_100000719477_100000758301 [1,0,0,0,0,0|1,0,2]=4 148 B11R1.40 CCC(C)Sc1ccccc1 62a_100000758301_100000041952 [1,0,0,0,0,0|1,0,2]=4 149 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186898_100000210202 [1,0,0,0,0,0|1,0,2]=4 150 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000186914_200000210301 [1,0,0,0,0,0|1,0,2]=4 151 B11R1.40 CCN(C)Cc1ccccc1 2230a_100000225621_100015291786 [1,0,0,0,0,0|1,0,2]=4 152 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186898_100000204670 [1,0,0,0,0,0|1,0,2]=4 153 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000186914_200000210301 [1,0,0,0,0,0|1,0,2]=4 154 B11R1.40 CCN(C)Cc1ccccc1 269982a_100000225621_100000211182 [1,0,0,0,0,0|1,0,2]=4 155 B11R1.40 CCN([13CH3])Cc1ccccc1 2230a_100000186914_200025704644 [1,0,0,0,0,0|1,0,2]=4 156 B11R1.40 CCN([13CH3])Cc1ccccc1 269982a_100000186914_200025704644 [1,0,0,0,0,0|1,0,2]=4 157 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [1,0,0,0,0,0|3,0,0]=4 158 B11R1.40 CNC(C)Cc1ccccc1 34a_100102657272_200011218536 [1,0,0,0,0,0|1,0,2]=4 159 B11R1.40 CNC(C)Cc1ccccc1 7a_106832991635_200011218536 [1,0,0,0,0,0|1,0,2]=4 160 B11R1.40 COC(C)Cc1ccccc1 34a_100000748627_200000210301 [1,0,0,0,0,0|1,0,2]=4 161 B11R1.40 COC(C)Cc1ccccc1 34a_100138415774_200011218536 [1,0,0,0,0,0|1,0,2]=4 162 B11R1.40 COC(C)Cc1ccccc1 7a_100000748627_200000210301 [1,0,0,0,0,0|1,0,2]=4 163 B11R1.40 COC(C)Sc1ccccc1 62a_100000719477_100009879195 [1,0,0,0,0,0|2,0,1]=4 164 B11R1.40 COC(C)Sc1ccccc1 62a_100009879195_100000041952 [1,0,0,0,0,0|2,0,1]=4 165 B11R1.40 CSC(C)Cc1ccccc1 62a_200000210301_200011218536 [1,0,0,0,0,0|1,0,2]=4 166 B11R1.40 CSC(C)Cc1ccccc1 62a_200011218536_200000210301 [1,0,0,0,0,0|1,0,2]=4 167 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [1,0,0,0,0,0|2,0,1]=4 168 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [1,0,0,0,0,0|2,0,1]=4 169 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [1,0,0,0,0,0|2,0,1]=4 170 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [1,0,0,0,0,0|2,0,1]=4 171 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [1,0,0,0,0,0|2,0,1]=4 172 B11R1.91 CC(=O)C#Cc1ccccc1 1458a_100000736102_200000210301 [1,0,0,0,0,0|0,0,2]=3 173 B11R1.91 CC(=O)C#Cc1ccccn1 1458a_102125277312_200000210301 [1,0,0,0,0,0|1,0,2]=4 174 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [1,0,0,0,0,0|0,0,0]=1 175 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [1,0,0,0,0,0|1,0,0]=2 176 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [1,0,0,0,0,0|1,0,0]=2 177 B11R1.91 CC(=O)C=Cc1ccncc1 1458a_100000682801_200000210301 [1,0,0,0,0,0|1,0,0]=2 178 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [1,0,0,0,0,0|0,0,2]=3 179 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [1,0,0,0,0,0|0,0,2]=3 180 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [1,0,0,0,0,0|1,0,2]=4 181 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [1,0,0,0,0,0|1,0,2]=4 182 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000070787_200011713674 [1,0,0,0,0,0|1,0,2]=4 183 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000198484_200000210301 [1,0,0,0,0,0|1,0,2]=4 184 B11R1.91 CC(=O)CCc1ccncc1 1458a_100000070787_100000723409 [1,0,0,0,0,0|1,0,2]=4 185 B11R1.91 CC(=O)CCc1ccncc1 1458a_100011225043_200000210301 [1,0,0,0,0,0|1,0,2]=4 186 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [1,0,0,0,0,0|1,0,1]=3 187 B11R1.91 CC(=O)COc1ccccn1 1458a_100102699861_200000210301 [1,0,0,0,0,0|2,0,1]=4 188 B11R1.91 CC(=O)COc1cccnc1 1458a_100015207166_200000210301 [1,0,0,0,0,0|2,0,1]=4 189 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [1,0,0,0,0,0|1,0,1]=3 190 B11R1.91 CC(=O)CSc1ccccn1 1458a_100000156281_200000210301 [1,0,0,0,0,0|2,0,1]=4 191 B11R1.91 CC(=O)CSc1ccncc1 1458a_100000211328_200000210301 [1,0,0,0,0,0|2,0,1]=4 192 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [1,0,0,0,0,0|1,0,1]=3 193 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [1,0,0,0,0,0|1,0,1]=3 194 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [1,0,0,0,0,0|1,0,1]=3 195 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [1,0,0,0,0,0|1,0,1]=3 196 B11R1.91 CC(=O)NCc1ccccn1 11a_100000210449_100015343762 [1,0,0,0,0,0|2,0,1]=4 197 B11R1.91 CC(=O)NCc1ccccn1 1626a_100000210449_100015343762 [1,0,0,0,0,0|2,0,1]=4 198 B11R1.91 CC(=O)NCc1ccccn1 240690a_100000210449_100015343762 [1,0,0,0,0,0|2,0,1]=4 199 B11R1.91 CC(=O)NCc1ccccn1 527a_100000210449_100103153847 [1,0,0,0,0,0|2,0,1]=4 200 B11R1.91 CC(=O)NCc1cccnc1 11a_100000210453_100015343762 [1,0,0,0,0,0|2,0,1]=4 201 B11R1.91 CC(=O)NCc1cccnc1 240690a_100000210453_100015343762 [1,0,0,0,0,0|2,0,1]=4 202 B11R1.91 CC(=O)NCc1cccnc1 527a_100000210453_100103153847 [1,0,0,0,0,0|2,0,1]=4 203 B11R1.91 CC(=O)NCc1ccncc1 11a_100000210450_100015343762 [1,0,0,0,0,0|2,0,1]=4 204 B11R1.91 CC(=O)NCc1ccncc1 1626a_100000210450_100015343762 [1,0,0,0,0,0|2,0,1]=4 205 B11R1.91 CC(=O)NCc1ccncc1 240690a_100000210450_100015343762 [1,0,0,0,0,0|2,0,1]=4 206 B11R1.91 CC(=O)NCc1ccncc1 527a_100000210450_100103153847 [1,0,0,0,0,0|2,0,1]=4 207 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [1,0,0,0,0,0|2,0,0]=3 208 B11R1.91 CC(=O)NNc1ccccn1 22a_100000183288_100000070787 [1,0,0,0,0,0|3,0,0]=4 209 B11R1.91 CC(=O)NNc1cccnc1 22a_100000728903_100000070787 [1,0,0,0,0,0|3,0,0]=4 210 B11R1.91 CC(=O)NNc1ccncc1 22a_100000698918_100000070787 [1,0,0,0,0,0|3,0,0]=4 211 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [1,0,0,0,0,0|1,0,1]=3 212 B11R1.91 CC(C)C=Cc1ccccn1 271570a_100016257149_100011216584 [1,0,0,0,0,0|2,0,1]=4 213 B11R1.91 CC(C)C=Cc1cccnc1 271570a_100016257149_100000752921 [1,0,0,0,0,0|2,0,1]=4 214 B11R1.91 CC(C)C=Cc1ccncc1 271570a_100016257149_100000035832 [1,0,0,0,0,0|2,0,1]=4 215 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [1,0,0,0,0,0|0,0,2]=3 216 B11R1.91 CC(O)C=Cc1ccccn1 271570a_200011019289_100011216584 [1,0,0,0,0,0|1,0,2]=4 217 B11R1.91 CC(O)C=Cc1cccnc1 271570a_200011019289_100000752921 [1,0,0,0,0,0|1,0,2]=4 218 B11R1.91 CC(O)C=Cc1ccncc1 271570a_200011019289_100000035832 [1,0,0,0,0,0|1,0,2]=4 219 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [1,0,0,0,0,0|2,0,1]=4 220 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [1,0,0,0,0,0|2,0,1]=4 221 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [1,0,0,0,0,0|2,0,1]=4 222 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [1,0,0,0,0,0|2,0,1]=4 223 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [1,0,0,0,0,0|2,0,1]=4 224 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [1,0,0,0,0,0|2,0,1]=4 225 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [1,0,0,0,0,0|2,0,1]=4 226 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [1,0,0,0,0,0|2,0,1]=4 227 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [1,0,0,0,0,0|2,0,1]=4 228 B11R1.91 [13CH3]C(=O)C#Cc1ccccc1 1458a_100000736102_200025704644 [1,0,0,0,0,0|0,0,2]=3 229 B11R1.91 [13CH3]C(=O)C#Cc1ccccn1 1458a_102125277312_200025704644 [1,0,0,0,0,0|1,0,2]=4 230 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [1,0,0,0,0,0|0,0,0]=1 231 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [1,0,0,0,0,0|1,0,0]=2 232 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [1,0,0,0,0,0|1,0,0]=2 233 B11R1.91 [13CH3]C(=O)C=Cc1ccncc1 1458a_100000682801_200025704644 [1,0,0,0,0,0|1,0,0]=2 234 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [1,0,0,0,0,0|0,0,2]=3 235 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [1,0,0,0,0,0|1,0,2]=4 236 B11R1.91 [13CH3]C(=O)CCc1cccnc1 1458a_100000198484_200025704644 [1,0,0,0,0,0|1,0,2]=4 237 B11R1.91 [13CH3]C(=O)CCc1ccncc1 1458a_100011225043_200025704644 [1,0,0,0,0,0|1,0,2]=4 238 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [1,0,0,0,0,0|1,0,1]=3 239 B11R1.91 [13CH3]C(=O)COc1ccccn1 1458a_100102699861_200025704644 [1,0,0,0,0,0|2,0,1]=4 240 B11R1.91 [13CH3]C(=O)COc1cccnc1 1458a_100015207166_200025704644 [1,0,0,0,0,0|2,0,1]=4 241 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [1,0,0,0,0,0|1,0,1]=3 242 B11R1.91 [13CH3]C(=O)CSc1ccccn1 1458a_100000156281_200025704644 [1,0,0,0,0,0|2,0,1]=4 243 B11R1.91 [13CH3]C(=O)CSc1ccncc1 1458a_100000211328_200025704644 [1,0,0,0,0,0|2,0,1]=4 244 B13R1.133 C/C(=C\c1ccc(cc1)F)/C(=O)[13CH3] 1458a_100053117043_200025704644 [0,1,0,0,0,0|0,0,0]=1 245 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Br 1458a_100000185857_100000189115 [0,1,0,0,0,0|2,0,1]=4 246 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)C 1458a_100000185857_100000210814 [0,1,0,0,0,0|2,0,1]=4 247 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)Cl 1458a_100000185857_100000694040 [0,1,0,0,0,0|2,0,1]=4 248 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)F 1458a_100000185857_100000198546 [0,1,0,0,0,0|2,0,1]=4 249 B13R1.133 C=C(C)C(=O)Cc1ccc(cc1)I 1458a_100000185857_100000189116 [0,1,0,0,0,0|2,0,1]=4 250 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000185857 [0,1,0,0,0,0|3,0,0]=4 251 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185857 [0,1,0,0,0,0|3,0,0]=4 252 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185857 [0,1,0,0,0,0|3,0,0]=4 253 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000185857 [0,1,0,0,0,0|3,0,0]=4 254 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185857 [0,1,0,0,0,0|3,0,0]=4 255 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)C 22a_100000124888_100000185857 [0,1,0,0,0,0|3,0,0]=4 256 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000185857 [0,1,0,0,0,0|3,0,0]=4 257 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185857 [0,1,0,0,0,0|3,0,0]=4 258 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185857 [0,1,0,0,0,0|3,0,0]=4 259 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000185857 [0,1,0,0,0,0|3,0,0]=4 260 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185857 [0,1,0,0,0,0|3,0,0]=4 261 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)F 22a_100000185862_100000185857 [0,1,0,0,0,0|3,0,0]=4 262 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000185857 [0,1,0,0,0,0|3,0,0]=4 263 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185857 [0,1,0,0,0,0|3,0,0]=4 264 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)I 22a_100000185761_100000185857 [0,1,0,0,0,0|3,0,0]=4 265 B13R1.133 C=C(C)C(=O)Nc1ccc(cc1)O 22a_100000185829_100000185857 [0,1,0,0,0,0|3,0,0]=4 266 B13R1.133 CC(=O)/C(=C/c1ccc(cc1)F)/C 1458a_100053117043_200000210301 [0,1,0,0,0,0|0,0,0]=1 267 B13R1.133 CC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_200000210301 [0,1,0,0,0,0|2,0,0]=3 268 B13R1.133 CC(=O)C(=O)Nc1ccc(cn1)Cl 1458a_100011297360_200000210301 [0,1,0,0,0,0|3,0,0]=4 269 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)Br 1458a_100000695199_200000210301 [0,1,0,0,0,0|0,0,2]=3 270 B13R1.133 CC(=O)C(C)Cc1ccc(cc1)F 1458a_100000746122_200000210301 [0,1,0,0,0,0|0,0,2]=3 271 B13R1.133 CC(=O)C(C)Nc1ccc(cc1)Br 2230a_100000210018_100009814033 [0,1,0,0,0,0|1,0,1]=3 272 B13R1.133 CC(=O)C(C)Nc1ccc(cc1)Cl 2230a_100000210052_100009814033 [0,1,0,0,0,0|1,0,1]=3 273 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Br 1458a_100000181392_200000210301 [0,1,0,0,0,0|1,0,1]=3 274 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000179758 [0,1,0,0,0,0|1,0,1]=3 275 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)C 1458a_100000183867_200000210301 [0,1,0,0,0,0|1,0,1]=3 276 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000179758 [0,1,0,0,0,0|1,0,1]=3 277 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Cl 1458a_100000184027_200000210301 [0,1,0,0,0,0|1,0,1]=3 278 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000179758 [0,1,0,0,0,0|1,0,1]=3 279 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)F 1458a_100000203723_200000210301 [0,1,0,0,0,0|1,0,1]=3 280 B13R1.133 CC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000179758 [0,1,0,0,0,0|1,0,1]=3 281 B13R1.133 CC(=O)C(C)Oc1ccc(nc1)Br 7a_100000685995_100000179758 [0,1,0,0,0,0|2,0,1]=4 282 B13R1.133 CC(=O)C(C)Oc1ccc(nc1)C 7a_100000745506_100000179758 [0,1,0,0,0,0|2,0,1]=4 283 B13R1.133 CC(=O)C(C)Oc1ccc(nc1)Cl 7a_100000744096_100000179758 [0,1,0,0,0,0|2,0,1]=4 284 B13R1.133 CC(=O)C(C)Oc1ccc(nc1)F 7a_100000688820_100000179758 [0,1,0,0,0,0|2,0,1]=4 285 B13R1.133 CC(=O)C(C)Oc1ccc(nc1)I 7a_100000687607_100000179758 [0,1,0,0,0,0|2,0,1]=4 286 B13R1.133 CC(=O)C(C)Oc1ccc(nc1)N 7a_100015188713_100000179758 [0,1,0,0,0,0|2,0,1]=4 287 B13R1.133 CC(=O)C(C)Sc1cc[n+](cc1)[O-] 62a_100009814033_100000039755 [0,1,0,0,0,0|2,0,1]=4 288 B13R1.133 CC(=O)C(C)Sc1ccc(=O)[nH]c1 62a_100000212171_100009814033 [0,1,0,0,0,0|2,0,1]=4 289 B13R1.133 CC(=O)C(C)Sc1ccc(=O)[nH]c1 62a_100009814033_100000212171 [0,1,0,0,0,0|2,0,1]=4 290 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Br 62a_100000752885_100009814033 [0,1,0,0,0,0|1,0,1]=3 291 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Br 62a_100009814033_100000752885 [0,1,0,0,0,0|1,0,1]=3 292 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)C 1458a_100000181072_200000210301 [0,1,0,0,0,0|1,0,1]=3 293 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)C 62a_100000186775_100009814033 [0,1,0,0,0,0|1,0,1]=3 294 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)C 62a_100009814033_100000186775 [0,1,0,0,0,0|1,0,1]=3 295 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Cl 1458a_100000178403_200000210301 [0,1,0,0,0,0|1,0,1]=3 296 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000755918_100009814033 [0,1,0,0,0,0|1,0,1]=3 297 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)Cl 62a_100009814033_100000755918 [0,1,0,0,0,0|1,0,1]=3 298 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)F 1458a_100000181075_200000210301 [0,1,0,0,0,0|1,0,1]=3 299 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)F 62a_100000211213_100009814033 [0,1,0,0,0,0|1,0,1]=3 300 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)F 62a_100009814033_100000211213 [0,1,0,0,0,0|1,0,1]=3 301 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)N 62a_100000185761_100009814033 [0,1,0,0,0,0|1,0,1]=3 302 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)N 62a_100009814033_100000185761 [0,1,0,0,0,0|1,0,1]=3 303 B13R1.133 CC(=O)C(C)Sc1ccc(cc1)O 62a_100009814033_100000185759 [0,1,0,0,0,0|1,0,1]=3 304 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)Br 62a_100000686858_100009814033 [0,1,0,0,0,0|2,0,1]=4 305 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)Br 62a_100009814033_100000686858 [0,1,0,0,0,0|2,0,1]=4 306 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)C 62a_100009814033_100000754016 [0,1,0,0,0,0|2,0,1]=4 307 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)C 62a_100011192072_100009814033 [0,1,0,0,0,0|2,0,1]=4 308 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)Cl 62a_100009814033_100011356976 [0,1,0,0,0,0|2,0,1]=4 309 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)Cl 62a_100011356976_100009814033 [0,1,0,0,0,0|2,0,1]=4 310 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)F 62a_100000744514_100009814033 [0,1,0,0,0,0|2,0,1]=4 311 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)F 62a_100009814033_100000744514 [0,1,0,0,0,0|2,0,1]=4 312 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)N 62a_100000737798_100009814033 [0,1,0,0,0,0|2,0,1]=4 313 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)N 62a_100009814033_100000737798 [0,1,0,0,0,0|2,0,1]=4 314 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)O 62a_100000685995_100009814033 [0,1,0,0,0,0|2,0,1]=4 315 B13R1.133 CC(=O)C(C)Sc1ccc(cn1)O 62a_100009814033_100000744096 [0,1,0,0,0,0|2,0,1]=4 316 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)Br 62a_100009814033_100009814638 [0,1,0,0,0,0|2,0,1]=4 317 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)Br 62a_100009814638_100009814033 [0,1,0,0,0,0|2,0,1]=4 318 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)C 62a_100000751577_100009814033 [0,1,0,0,0,0|2,0,1]=4 319 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)C 62a_100009814033_100000751577 [0,1,0,0,0,0|2,0,1]=4 320 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)Cl 62a_100000034144_100009814033 [0,1,0,0,0,0|2,0,1]=4 321 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)Cl 62a_100009814033_100000034144 [0,1,0,0,0,0|2,0,1]=4 322 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)F 62a_100000042367_100009814033 [0,1,0,0,0,0|2,0,1]=4 323 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)F 62a_100009814033_100000042367 [0,1,0,0,0,0|2,0,1]=4 324 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)N 62a_100000187370_100009814033 [0,1,0,0,0,0|2,0,1]=4 325 B13R1.133 CC(=O)C(C)Sc1ccc(nc1)N 62a_100009814033_100000187370 [0,1,0,0,0,0|2,0,1]=4 326 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200000210301 [0,1,0,0,0,0|1,0,2]=4 327 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200000210301 [0,1,0,0,0,0|1,0,2]=4 328 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [0,1,0,0,0,0|1,0,2]=4 329 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 11a_100000180866_100015343762 [0,1,0,0,0,0|1,0,1]=3 330 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 1626a_100000180866_100015343762 [0,1,0,0,0,0|1,0,1]=3 331 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 240690a_100000180866_100015343762 [0,1,0,0,0,0|1,0,1]=3 332 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Br 527a_100000180866_100103153847 [0,1,0,0,0,0|1,0,1]=3 333 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 11a_100000744650_100015343762 [0,1,0,0,0,0|1,0,1]=3 334 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 1626a_100000744650_100015343762 [0,1,0,0,0,0|1,0,1]=3 335 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 240690a_100000744650_100015343762 [0,1,0,0,0,0|1,0,1]=3 336 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)C 527a_100000744650_100103153847 [0,1,0,0,0,0|1,0,1]=3 337 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 11a_100000184517_100015343762 [0,1,0,0,0,0|1,0,1]=3 338 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 1626a_100000184517_100015343762 [0,1,0,0,0,0|1,0,1]=3 339 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 240690a_100000184517_100015343762 [0,1,0,0,0,0|1,0,1]=3 340 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)Cl 527a_100000184517_100103153847 [0,1,0,0,0,0|1,0,1]=3 341 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 11a_100000184576_100015343762 [0,1,0,0,0,0|1,0,1]=3 342 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 1626a_100000184576_100015343762 [0,1,0,0,0,0|1,0,1]=3 343 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 240690a_100000184576_100015343762 [0,1,0,0,0,0|1,0,1]=3 344 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)F 527a_100000184576_100103153847 [0,1,0,0,0,0|1,0,1]=3 345 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100015343762 [0,1,0,0,0,0|1,0,1]=3 346 B13R1.133 CC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100103153847 [0,1,0,0,0,0|1,0,1]=3 347 B13R1.133 CC(=O)N(C)Cc1ccc(cn1)C 11a_200000717808_100015343762 [0,1,0,0,0,0|2,0,1]=4 348 B13R1.133 CC(=O)N(C)Cc1ccc(cn1)C 1626a_200000717808_100015343762 [0,1,0,0,0,0|2,0,1]=4 349 B13R1.133 CC(=O)N(C)Cc1ccc(cn1)C 240690a_200000717808_100015343762 [0,1,0,0,0,0|2,0,1]=4 350 B13R1.133 CC(=O)N(C)Cc1ccc(cn1)C 527a_200000717808_100103153847 [0,1,0,0,0,0|2,0,1]=4 351 B13R1.133 CC(=O)N(C)Cc1ccc(nc1)C 11a_106623407658_100015343762 [0,1,0,0,0,0|2,0,1]=4 352 B13R1.133 CC(=O)N(C)Cc1ccc(nc1)C 240690a_106623407658_100015343762 [0,1,0,0,0,0|2,0,1]=4 353 B13R1.133 CC(=O)N(C)Cc1ccc(nc1)C 527a_106623407658_100103153847 [0,1,0,0,0,0|2,0,1]=4 354 B13R1.133 CC(=O)N(C)Cc1ccc(nc1)Cl 11a_100000026953_100015343762 [0,1,0,0,0,0|2,0,1]=4 355 B13R1.133 CC(=O)N(C)Cc1ccc(nc1)Cl 240690a_100000026953_100015343762 [0,1,0,0,0,0|2,0,1]=4 356 B13R1.133 CC(=O)N(C)Cc1ccc(nc1)Cl 527a_100000026953_100103153847 [0,1,0,0,0,0|2,0,1]=4 357 B13R1.133 CC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_200000210301 [0,1,0,0,0,0|1,0,1]=3 358 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200000210301 [0,1,0,0,0,0|1,0,2]=4 359 B13R1.133 CC(Cc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100000695199_200025704644 [0,1,0,0,0,0|0,0,2]=3 360 B13R1.133 CC(Cc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000746122_200025704644 [0,1,0,0,0,0|0,0,2]=3 361 B13R1.133 CC(Nc1ccc(cc1)Br)C(=O)N 2230a_100000210018_100000702099 [0,1,0,0,0,0|2,0,1]=4 362 B13R1.133 CC(Nc1ccc(cc1)Br)C(=O)N 34a_100000210018_100000702099 [0,1,0,0,0,0|2,0,1]=4 363 B13R1.133 CC(Nc1ccc(cc1)Cl)C(=O)N 2230a_100000210052_100000702099 [0,1,0,0,0,0|2,0,1]=4 364 B13R1.133 CC(Nc1ccc(cc1)Cl)C(=O)N 34a_100000210052_100000702099 [0,1,0,0,0,0|2,0,1]=4 365 B13R1.133 CC(Nc1ccc(cc1)F)C(=O)N 34a_100000185862_100000702099 [0,1,0,0,0,0|2,0,1]=4 366 B13R1.133 CC(Nc1ccc(cc1)I)C(=O)N 34a_100000185761_100000702099 [0,1,0,0,0,0|2,0,1]=4 367 B13R1.133 CC(Nc1ccc(cc1)O)C(=O)N 34a_100000185829_100000702099 [0,1,0,0,0,0|2,0,1]=4 368 B13R1.133 CC(Oc1ccc(cc1)Br)C(=O)N 34a_100000185759_100000702099 [0,1,0,0,0,0|2,0,1]=4 369 B13R1.133 CC(Oc1ccc(cc1)Br)C(=O)N 7a_100000185759_100000702099 [0,1,0,0,0,0|2,0,1]=4 370 B13R1.133 CC(Oc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100000181392_200025704644 [0,1,0,0,0,0|1,0,1]=3 371 B13R1.133 CC(Oc1ccc(cc1)Cl)C(=O)N 34a_100000210216_100000702099 [0,1,0,0,0,0|2,0,1]=4 372 B13R1.133 CC(Oc1ccc(cc1)Cl)C(=O)N 7a_100000210216_100000702099 [0,1,0,0,0,0|2,0,1]=4 373 B13R1.133 CC(Oc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_100000184027_200025704644 [0,1,0,0,0,0|1,0,1]=3 374 B13R1.133 CC(Oc1ccc(cc1)F)C(=O)N 34a_100000210339_100000702099 [0,1,0,0,0,0|2,0,1]=4 375 B13R1.133 CC(Oc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000203723_200025704644 [0,1,0,0,0,0|1,0,1]=3 376 B13R1.133 CC(Oc1ccc(cc1)I)C(=O)N 34a_100000212066_100000702099 [0,1,0,0,0,0|2,0,1]=4 377 B13R1.133 CC(Oc1ccc(cc1)I)C(=O)N 7a_100000212066_100000702099 [0,1,0,0,0,0|2,0,1]=4 378 B13R1.133 CC(Oc1ccc(cc1)N)C(=O)N 34a_100000185829_100000702099 [0,1,0,0,0,0|2,0,1]=4 379 B13R1.133 CC(Oc1ccc(cc1)O)C(=O)N 271570a_203496583355_100000150412 [0,1,0,0,0,0|2,0,1]=4 380 B13R1.133 CC(Sc1ccc(cc1)Br)C(=O)N 62a_100000702099_100000752885 [0,1,0,0,0,0|2,0,1]=4 381 B13R1.133 CC(Sc1ccc(cc1)Br)C(=O)N 62a_100000752885_100000702099 [0,1,0,0,0,0|2,0,1]=4 382 B13R1.133 CC(Sc1ccc(cc1)Cl)C(=O)N 62a_100000702099_100000755918 [0,1,0,0,0,0|2,0,1]=4 383 B13R1.133 CC(Sc1ccc(cc1)Cl)C(=O)N 62a_100000755918_100000702099 [0,1,0,0,0,0|2,0,1]=4 384 B13R1.133 CC(Sc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_100000178403_200025704644 [0,1,0,0,0,0|1,0,1]=3 385 B13R1.133 CC(Sc1ccc(cc1)F)C(=O)N 62a_100000211213_100000702099 [0,1,0,0,0,0|2,0,1]=4 386 B13R1.133 CC(Sc1ccc(cc1)F)C(=O)N 62a_100000702099_100000211213 [0,1,0,0,0,0|2,0,1]=4 387 B13R1.133 CC(Sc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000181075_200025704644 [0,1,0,0,0,0|1,0,1]=3 388 B13R1.133 CC(Sc1ccc(cc1)N)C(=O)N 62a_100000185761_100000702099 [0,1,0,0,0,0|2,0,1]=4 389 B13R1.133 CC(Sc1ccc(cc1)N)C(=O)N 62a_100000702099_100000185761 [0,1,0,0,0,0|2,0,1]=4 390 B13R1.133 CC(Sc1ccc(cc1)O)C(=O)N 62a_100000702099_100000185759 [0,1,0,0,0,0|2,0,1]=4 391 B13R1.133 C[C@@H](Oc1ccc(cc1)O)C(=O)[13CH3] 1458a_100000005562_200025704644 [0,1,0,0,0,0|1,0,1]=3 392 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)N 22a_100000124888_100011215815 [0,1,0,0,0,0|3,0,0]=4 393 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)[13CH3] 1458a_100000189662_200025704644 [0,1,0,0,0,0|2,0,0]=3 394 B13R1.133 Cc1ccc(cc1)NC(C)C(=O)N 34a_100000124888_100000702099 [0,1,0,0,0,0|2,0,1]=4 395 B13R1.133 Cc1ccc(cc1)OC(C)C(=O)N 34a_100000210336_100000702099 [0,1,0,0,0,0|2,0,1]=4 396 B13R1.133 Cc1ccc(cc1)OC(C)C(=O)N 7a_100000210336_100000702099 [0,1,0,0,0,0|2,0,1]=4 397 B13R1.133 Cc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_100000183867_200025704644 [0,1,0,0,0,0|1,0,1]=3 398 B13R1.133 Cc1ccc(cc1)SC(C)C(=O)N 62a_100000186775_100000702099 [0,1,0,0,0,0|2,0,1]=4 399 B13R1.133 Cc1ccc(cc1)SC(C)C(=O)N 62a_100000702099_100000186775 [0,1,0,0,0,0|2,0,1]=4 400 B13R1.133 Cc1ccc(cc1)SC(C)C(=O)[13CH3] 1458a_100000181072_200025704644 [0,1,0,0,0,0|1,0,1]=3 401 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100011215815 [0,1,0,0,0,0|3,0,0]=4 402 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011215815 [0,1,0,0,0,0|3,0,0]=4 403 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100011215815 [0,1,0,0,0,0|3,0,0]=4 404 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100011215815 [0,1,0,0,0,0|3,0,0]=4 405 B13R1.133 NC(=O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100011215815 [0,1,0,0,0,0|3,0,0]=4 406 B13R1.133 [13CH3]C(=O)C(=O)Nc1ccc(cn1)Cl 1458a_100011297360_200025704644 [0,1,0,0,0,0|3,0,0]=4 407 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)Cl 1458a_100012362158_200025704644 [0,1,0,0,0,0|1,0,2]=4 408 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)F 1458a_100012179405_200025704644 [0,1,0,0,0,0|1,0,2]=4 409 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [0,1,0,0,0,0|1,0,2]=4 410 B13R1.133 [13CH3]C(=O)[C@@H](O)Cc1ccc(cc1)Br 1458a_200015644258_200025704644 [0,1,0,0,0,0|1,0,2]=4 411 B13R1.135 C#CC(=O)C(C)Cc1ccccc1 1458a_100000211873_200011218536 [0,1,0,0,0,0|0,0,3]=4 412 B13R1.135 C/C(=C\c1ccccc1)/C(=O)CF 1458a_100016990649_100015361967 [0,1,0,0,0,0|0,0,0]=1 413 B13R1.135 C/C(=C\c1ccccn1)/C(=O)CF 1458a_100025712827_100015361967 [0,1,0,0,0,0|1,0,0]=2 414 B13R1.135 C/C=C(\C)/C(=O)Cc1ccccc1 1458a_100020587367_100015291786 [0,1,0,0,0,0|2,0,1]=4 415 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 11a_100000106764_100020587367 [0,1,0,0,0,0|3,0,0]=4 416 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 1626a_100000106764_100020587367 [0,1,0,0,0,0|3,0,0]=4 417 B13R1.135 C/C=C(\C)/C(=O)Nc1ccccc1 22a_100000106764_100020587367 [0,1,0,0,0,0|3,0,0]=4 418 B13R1.135 C=C(CO)C(=O)Nc1ccccc1 22a_100000106764_200000705526 [0,1,0,0,0,0|3,0,0]=4 419 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 11a_106832991635_100000066491 [0,1,0,0,0,0|0,0,2]=3 420 B13R1.135 C=C(Cc1ccccc1)C(=O)NC 1626a_100102657272_100000066491 [0,1,0,0,0,0|0,0,2]=3 421 B13R1.135 C=CC(=O)C(C)Cc1ccccc1 1458a_100000185746_200011218536 [0,1,0,0,0,0|0,0,3]=4 422 B13R1.135 C=CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000185746 [0,1,0,0,0,0|1,0,2]=4 423 B13R1.135 C=CC(=O)N(C)Cc1ccccc1 240690a_100000186898_200121576911 [0,1,0,0,0,0|1,0,2]=4 424 B13R1.135 CC(Cc1ccccc1)C(=O)CF 1458a_100000754839_100015361967 [0,1,0,0,0,0|0,0,2]=3 425 B13R1.135 CC(Cc1ccccc1)C(=O)CO 1458a_100000210174_200011218536 [0,1,0,0,0,0|0,0,2]=3 426 B13R1.135 CC(Cc1ccccn1)C(=O)CF 1458a_100012000792_100015361967 [0,1,0,0,0,0|1,0,2]=4 427 B13R1.135 CC(Oc1ccccc1)C(=O)CF 1458a_100000188414_100015361967 [0,1,0,0,0,0|1,0,1]=3 428 B13R1.135 CC(Sc1ccccc1)C(=O)CF 1458a_100000199063_100015361967 [0,1,0,0,0,0|1,0,1]=3 429 B13R1.135 CC(Sc1ccccn1)C(=O)CF 1458a_100000156770_100015361967 [0,1,0,0,0,0|2,0,1]=4 430 B13R1.135 CCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210202 [0,1,0,0,0,0|0,0,0]=1 431 B13R1.135 CCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210202 [0,1,0,0,0,0|1,0,0]=2 432 B13R1.135 CCC(=O)/C(=C/c1ccccn1)/C 1458a_100025712827_100000210202 [0,1,0,0,0,0|1,0,0]=2 433 B13R1.135 CCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210202 [0,1,0,0,0,0|1,0,0]=2 434 B13R1.135 CCC(=O)C(=Cc1cccnc1)F 1458a_100000731744_100000210202 [0,1,0,0,0,0|2,0,0]=3 435 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210202 [0,1,0,0,0,0|2,0,0]=3 436 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000210414_200011218536 [0,1,0,0,0,0|0,0,2]=3 437 B13R1.135 CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210202 [0,1,0,0,0,0|0,0,2]=3 438 B13R1.135 CCC(=O)C(C)Cc1ccccn1 1458a_100012000792_100000210202 [0,1,0,0,0,0|1,0,2]=4 439 B13R1.135 CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210202 [0,1,0,0,0,0|1,0,1]=3 440 B13R1.135 CCC(=O)C(C)Oc1ccccc1 7a_100000210340_100000742827 [0,1,0,0,0,0|1,0,1]=3 441 B13R1.135 CCC(=O)C(C)Oc1cccnc1 7a_100000210849_100000742827 [0,1,0,0,0,0|2,0,1]=4 442 B13R1.135 CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210202 [0,1,0,0,0,0|1,0,1]=3 443 B13R1.135 CCC(=O)C(C)Sc1ccccc1 62a_100000719477_100000742827 [0,1,0,0,0,0|1,0,1]=3 444 B13R1.135 CCC(=O)C(C)Sc1ccccc1 62a_100000742827_100000041952 [0,1,0,0,0,0|1,0,1]=3 445 B13R1.135 CCC(=O)C(C)Sc1ccccn1 1458a_100000156770_100000210202 [0,1,0,0,0,0|2,0,1]=4 446 B13R1.135 CCC(=O)C(C)Sc1ccccn1 62a_100000742827_100011216584 [0,1,0,0,0,0|2,0,1]=4 447 B13R1.135 CCC(=O)C(C)Sc1ccccn1 62a_100011216584_100000742827 [0,1,0,0,0,0|2,0,1]=4 448 B13R1.135 CCC(=O)C(C)Sc1cccnc1 62a_100000210063_100000742827 [0,1,0,0,0,0|2,0,1]=4 449 B13R1.135 CCC(=O)C(C)Sc1cccnc1 62a_100000742827_100000210063 [0,1,0,0,0,0|2,0,1]=4 450 B13R1.135 CCC(=O)C(C)Sc1ccncc1 62a_100000728582_100000742827 [0,1,0,0,0,0|2,0,1]=4 451 B13R1.135 CCC(=O)C(C)Sc1ccncc1 62a_100000742827_100000728582 [0,1,0,0,0,0|2,0,1]=4 452 B13R1.135 CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210414 [0,1,0,0,0,0|1,0,1]=3 453 B13R1.135 CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210414 [0,1,0,0,0,0|1,0,1]=3 454 B13R1.135 CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210414 [0,1,0,0,0,0|1,0,1]=3 455 B13R1.135 CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210414 [0,1,0,0,0,0|1,0,1]=3 456 B13R1.135 CCC(=O)N(C)Cc1ccccn1 11a_100000207498_100000210414 [0,1,0,0,0,0|2,0,1]=4 457 B13R1.135 CCC(=O)N(C)Cc1ccccn1 240690a_100000207498_100000210414 [0,1,0,0,0,0|2,0,1]=4 458 B13R1.135 CCC(=O)N(C)Cc1ccccn1 527a_100000207498_100000210414 [0,1,0,0,0,0|2,0,1]=4 459 B13R1.135 CCC(=O)N(C)Cc1cccnc1 11a_100000184577_100000210414 [0,1,0,0,0,0|2,0,1]=4 460 B13R1.135 CCC(=O)N(C)Cc1cccnc1 240690a_100000184577_100000210414 [0,1,0,0,0,0|2,0,1]=4 461 B13R1.135 CCC(=O)N(C)Cc1cccnc1 527a_100000184577_100000210414 [0,1,0,0,0,0|2,0,1]=4 462 B13R1.135 CCC(=O)N(C)Cc1ccncc1 11a_100000187231_100000210414 [0,1,0,0,0,0|2,0,1]=4 463 B13R1.135 CCC(=O)N(C)Cc1ccncc1 240690a_100000187231_100000210414 [0,1,0,0,0,0|2,0,1]=4 464 B13R1.135 CCC(=O)N(C)Cc1ccncc1 527a_100000187231_100000210414 [0,1,0,0,0,0|2,0,1]=4 465 B13R1.135 CCC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000210202 [0,1,0,0,0,0|1,0,2]=4 466 B13R1.135 CN(Cc1ccccc1)C(=O)CO 240690a_100000186898_100000210174 [0,1,0,0,0,0|1,0,1]=3 467 B13R1.135 CN(Cc1ccccc1)C(=O)CO 527a_100000186898_100000210174 [0,1,0,0,0,0|1,0,1]=3 468 B13R1.135 CN(Cc1ccccn1)C(=O)CO 240690a_100000207498_100000210174 [0,1,0,0,0,0|2,0,1]=4 469 B13R1.135 CN(Cc1ccccn1)C(=O)CO 527a_100000207498_100000210174 [0,1,0,0,0,0|2,0,1]=4 470 B13R1.135 CN(Cc1cccnc1)C(=O)CO 240690a_100000184577_100000210174 [0,1,0,0,0,0|2,0,1]=4 471 B13R1.135 CN(Cc1cccnc1)C(=O)CO 527a_100000184577_100000210174 [0,1,0,0,0,0|2,0,1]=4 472 B13R1.135 CN(Cc1ccncc1)C(=O)CO 240690a_100000187231_100000210174 [0,1,0,0,0,0|2,0,1]=4 473 B13R1.135 CN(Cc1ccncc1)C(=O)CO 527a_100000187231_100000210174 [0,1,0,0,0,0|2,0,1]=4 474 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/C 11a_106832991635_100016990649 [0,1,0,0,0,0|0,0,0]=1 475 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/C 1626a_100102657272_100016990649 [0,1,0,0,0,0|0,0,0]=1 476 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/C 527a_100102657272_100016990649 [0,1,0,0,0,0|0,0,0]=1 477 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 11a_106832991635_200020598536 [0,1,0,0,0,0|1,0,0]=2 478 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 1626a_100102657272_200020598536 [0,1,0,0,0,0|1,0,0]=2 479 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 240690a_100102657272_200020598536 [0,1,0,0,0,0|1,0,0]=2 480 B13R1.135 CNC(=O)/C(=C/c1ccccc1)/Cl 527a_100102657272_200020598536 [0,1,0,0,0,0|1,0,0]=2 481 B13R1.135 CNC(=O)/C(=C/c1ccccn1)/C 11a_106832991635_100025712827 [0,1,0,0,0,0|1,0,0]=2 482 B13R1.135 CNC(=O)/C(=C/c1ccccn1)/C 1626a_100102657272_100025712827 [0,1,0,0,0,0|1,0,0]=2 483 B13R1.135 CNC(=O)/C(=C/c1ccccn1)/C 527a_100102657272_100025712827 [0,1,0,0,0,0|1,0,0]=2 484 B13R1.135 CNC(=O)/C(=C\c1ccccc1)/F 11a_106832991635_100020889036 [0,1,0,0,0,0|1,0,0]=2 485 B13R1.135 CNC(=O)/C(=C\c1ccccc1)/F 527a_100102657272_100020889036 [0,1,0,0,0,0|1,0,0]=2 486 B13R1.135 CNC(=O)C(=Cc1cccnc1)F 11a_106832991635_100000731744 [0,1,0,0,0,0|2,0,0]=3 487 B13R1.135 CNC(=O)C(=Cc1cccnc1)F 240690a_100102657272_100000731744 [0,1,0,0,0,0|2,0,0]=3 488 B13R1.135 CNC(=O)C(=Cc1cccnc1)F 527a_100102657272_100000731744 [0,1,0,0,0,0|2,0,0]=3 489 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 1458a_100011218921_100015291786 [0,1,0,0,0,0|1,0,1]=3 490 B13R1.135 CNC(=O)C(=O)Cc1ccccn1 1458a_100011218921_100000721315 [0,1,0,0,0,0|2,0,1]=4 491 B13R1.135 CNC(=O)C(=O)Cc1cccnc1 1458a_100011218921_100000733263 [0,1,0,0,0,0|2,0,1]=4 492 B13R1.135 CNC(=O)C(=O)Cc1ccncc1 1458a_100011218921_100000705612 [0,1,0,0,0,0|2,0,1]=4 493 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100011218921 [0,1,0,0,0,0|2,0,0]=3 494 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 22a_100000106764_100011218921 [0,1,0,0,0,0|2,0,0]=3 495 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 240690a_100102657272_100000738435 [0,1,0,0,0,0|2,0,0]=3 496 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 527a_100000106764_100011218921 [0,1,0,0,0,0|2,0,0]=3 497 B13R1.135 CNC(=O)C(C)Cc1ccccc1 11a_106832991635_100000754839 [0,1,0,0,0,0|0,0,2]=3 498 B13R1.135 CNC(=O)C(C)Cc1ccccc1 1626a_100102657272_100000754839 [0,1,0,0,0,0|0,0,2]=3 499 B13R1.135 CNC(=O)C(C)Cc1ccccc1 240690a_100102657272_100000754839 [0,1,0,0,0,0|0,0,2]=3 500 B13R1.135 CNC(=O)C(C)Cc1ccccc1 527a_100102657272_100000754839 [0,1,0,0,0,0|0,0,2]=3 501 B13R1.135 CNC(=O)C(C)Cc1ccccn1 1626a_100102657272_100012000792 [0,1,0,0,0,0|1,0,2]=4 502 B13R1.135 CNC(=O)C(C)Cc1ccccn1 240690a_100102657272_100012000792 [0,1,0,0,0,0|1,0,2]=4 503 B13R1.135 CNC(=O)C(C)Cc1ccccn1 527a_100102657272_100012000792 [0,1,0,0,0,0|1,0,2]=4 504 B13R1.135 CNC(=O)C(C)Nc1ccccc1 34a_100000106764_100000731044 [0,1,0,0,0,0|1,0,1]=3 505 B13R1.135 CNC(=O)C(C)Oc1ccccc1 11a_106832991635_100000188414 [0,1,0,0,0,0|1,0,1]=3 506 B13R1.135 CNC(=O)C(C)Oc1ccccc1 1626a_100102657272_100000188414 [0,1,0,0,0,0|1,0,1]=3 507 B13R1.135 CNC(=O)C(C)Oc1ccccc1 240690a_100102657272_100000188414 [0,1,0,0,0,0|1,0,1]=3 508 B13R1.135 CNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000731044 [0,1,0,0,0,0|1,0,1]=3 509 B13R1.135 CNC(=O)C(C)Oc1ccccc1 527a_100102657272_100000188414 [0,1,0,0,0,0|1,0,1]=3 510 B13R1.135 CNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000209862 [0,1,0,0,0,0|1,0,1]=3 511 B13R1.135 CNC(=O)C(C)Oc1cccnc1 34a_100000210849_100000731044 [0,1,0,0,0,0|2,0,1]=4 512 B13R1.135 CNC(=O)C(C)Oc1cccnc1 7a_100000210849_100000209862 [0,1,0,0,0,0|2,0,1]=4 513 B13R1.135 CNC(=O)C(C)Oc1ccncc1 34a_100000212176_100000731044 [0,1,0,0,0,0|2,0,1]=4 514 B13R1.135 CNC(=O)C(C)Sc1ccccc1 11a_106832991635_100000199063 [0,1,0,0,0,0|1,0,1]=3 515 B13R1.135 CNC(=O)C(C)Sc1ccccc1 1626a_100102657272_100000199063 [0,1,0,0,0,0|1,0,1]=3 516 B13R1.135 CNC(=O)C(C)Sc1ccccc1 240690a_100102657272_100000199063 [0,1,0,0,0,0|1,0,1]=3 517 B13R1.135 CNC(=O)C(C)Sc1ccccc1 527a_100102657272_100000199063 [0,1,0,0,0,0|1,0,1]=3 518 B13R1.135 CNC(=O)C(C)Sc1ccccc1 62a_100000209862_100000041952 [0,1,0,0,0,0|1,0,1]=3 519 B13R1.135 CNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000731044 [0,1,0,0,0,0|1,0,1]=3 520 B13R1.135 CNC(=O)C(C)Sc1ccccn1 11a_106832991635_100000156770 [0,1,0,0,0,0|2,0,1]=4 521 B13R1.135 CNC(=O)C(C)Sc1ccccn1 1626a_100102657272_100000156770 [0,1,0,0,0,0|2,0,1]=4 522 B13R1.135 CNC(=O)C(C)Sc1ccccn1 240690a_100102657272_100000156770 [0,1,0,0,0,0|2,0,1]=4 523 B13R1.135 CNC(=O)C(C)Sc1ccccn1 527a_100102657272_100000156770 [0,1,0,0,0,0|2,0,1]=4 524 B13R1.135 CNC(=O)C(C)Sc1ccccn1 62a_100000209862_100011216584 [0,1,0,0,0,0|2,0,1]=4 525 B13R1.135 CNC(=O)C(C)Sc1ccccn1 62a_100011216584_100000731044 [0,1,0,0,0,0|2,0,1]=4 526 B13R1.135 CNC(=O)C(C)Sc1cccnc1 62a_100000209862_100000210063 [0,1,0,0,0,0|2,0,1]=4 527 B13R1.135 CNC(=O)C(C)Sc1cccnc1 62a_100000210063_100000731044 [0,1,0,0,0,0|2,0,1]=4 528 B13R1.135 CNC(=O)C(C)Sc1ccncc1 62a_100000209862_100000728582 [0,1,0,0,0,0|2,0,1]=4 529 B13R1.135 CNC(=O)C(C)Sc1ccncc1 62a_100000728582_100000731044 [0,1,0,0,0,0|2,0,1]=4 530 B13R1.135 CNC(=O)C(F)Nc1ccccc1 34a_100000106764_100009813575 [0,1,0,0,0,0|2,0,1]=4 531 B13R1.135 CNC(=O)C(F)Oc1ccccc1 34a_100000210340_100009813575 [0,1,0,0,0,0|2,0,1]=4 532 B13R1.135 CNC(=O)C(F)Oc1ccccc1 7a_100000210340_100009813575 [0,1,0,0,0,0|2,0,1]=4 533 B13R1.135 CNC(=O)C(F)Sc1ccccc1 62a_100000719477_100009813575 [0,1,0,0,0,0|2,0,1]=4 534 B13R1.135 CNC(=O)C(F)Sc1ccccc1 62a_100009813575_100000041952 [0,1,0,0,0,0|2,0,1]=4 535 B13R1.135 CNC(=O)N(C)Cc1ccccc1 2708a_100102657272_100000186898 [0,1,0,0,0,0|1,0,1]=3 536 B13R1.135 CNC(=O)N(C)Cc1ccccc1 273464a_100102657272_100000186898 [0,1,0,0,0,0|1,0,1]=3 537 B13R1.135 CNC(=O)N(C)Cc1ccccn1 2708a_100102657272_100000207498 [0,1,0,0,0,0|2,0,1]=4 538 B13R1.135 CNC(=O)N(C)Cc1ccccn1 273464a_100102657272_100000207498 [0,1,0,0,0,0|2,0,1]=4 539 B13R1.135 CNC(=O)N(C)Cc1cccnc1 2708a_100102657272_100000184577 [0,1,0,0,0,0|2,0,1]=4 540 B13R1.135 CNC(=O)N(C)Cc1cccnc1 273464a_100102657272_100000184577 [0,1,0,0,0,0|2,0,1]=4 541 B13R1.135 CNC(=O)N(C)Cc1ccncc1 2708a_100102657272_100000187231 [0,1,0,0,0,0|2,0,1]=4 542 B13R1.135 CNC(=O)N(C)Cc1ccncc1 273464a_100102657272_100000187231 [0,1,0,0,0,0|2,0,1]=4 543 B13R1.135 CNC(=O)[C@H](O)Cc1ccccc1 240690a_100102657272_100009816399 [0,1,0,0,0,0|1,0,2]=4 544 B13R1.135 COC(=O)C(=O)Nc1ccccc1 11a_100000106764_100000024059 [0,1,0,0,0,0|2,0,0]=3 545 B13R1.135 COC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100000024059 [0,1,0,0,0,0|2,0,0]=3 546 B13R1.135 COC(=O)C(=O)Nc1ccccc1 527a_100000106764_100000024059 [0,1,0,0,0,0|2,0,0]=3 547 B13R1.135 COC(=O)C(C)Nc1ccccc1 34a_100000106764_100000211248 [0,1,0,0,0,0|1,0,1]=3 548 B13R1.135 COC(=O)C(C)Oc1ccccc1 34a_100000210340_100000211248 [0,1,0,0,0,0|1,0,1]=3 549 B13R1.135 COC(=O)C(C)Oc1ccccc1 7a_100000210340_100000211248 [0,1,0,0,0,0|1,0,1]=3 550 B13R1.135 COC(=O)C(C)Oc1cccnc1 34a_100000210849_100000211248 [0,1,0,0,0,0|2,0,1]=4 551 B13R1.135 COC(=O)C(C)Oc1cccnc1 7a_100000210849_100000211248 [0,1,0,0,0,0|2,0,1]=4 552 B13R1.135 COC(=O)C(C)Oc1ccncc1 34a_100000212176_100000211248 [0,1,0,0,0,0|2,0,1]=4 553 B13R1.135 COC(=O)C(C)Sc1ccccc1 62a_100000211248_100000041952 [0,1,0,0,0,0|1,0,1]=3 554 B13R1.135 COC(=O)C(C)Sc1ccccc1 62a_100000719477_100000211248 [0,1,0,0,0,0|1,0,1]=3 555 B13R1.135 COC(=O)C(C)Sc1ccccn1 62a_100000211248_100011216584 [0,1,0,0,0,0|2,0,1]=4 556 B13R1.135 COC(=O)C(C)Sc1ccccn1 62a_100011216584_100000211248 [0,1,0,0,0,0|2,0,1]=4 557 B13R1.135 COC(=O)C(C)Sc1cccnc1 62a_100000210063_100000211248 [0,1,0,0,0,0|2,0,1]=4 558 B13R1.135 COC(=O)C(C)Sc1cccnc1 62a_100000211248_100000210063 [0,1,0,0,0,0|2,0,1]=4 559 B13R1.135 COC(=O)C(C)Sc1ccncc1 62a_100000211248_100000728582 [0,1,0,0,0,0|2,0,1]=4 560 B13R1.135 COC(=O)C(C)Sc1ccncc1 62a_100000728582_100000211248 [0,1,0,0,0,0|2,0,1]=4 561 B13R1.135 O=C(CF)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100015361967 [0,1,0,0,0,0|1,0,0]=2 562 B13R1.135 O=C(CF)/C(=C\c1ccccc1)/F 1458a_100020889036_100015361967 [0,1,0,0,0,0|1,0,0]=2 563 B13R1.135 O=C(CF)C(=Cc1cccnc1)F 1458a_100000731744_100015361967 [0,1,0,0,0,0|2,0,0]=3 564 B13R1.135 O=C(CF)C(=O)Nc1ccccc1 1458a_100000738435_100015361967 [0,1,0,0,0,0|2,0,0]=3 565 B13R1.135 O=C(CF)[C@H](O)Cc1ccccc1 1458a_100009816399_100015361967 [0,1,0,0,0,0|1,0,2]=4 566 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Br 1458a_100000185857_100000211773 [0,1,0,0,0,0|2,0,1]=4 567 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)C 1458a_100000185857_100000211840 [0,1,0,0,0,0|2,0,1]=4 568 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)Cl 1458a_100000185857_100000181238 [0,1,0,0,0,0|2,0,1]=4 569 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)F 1458a_100000185857_100000230114 [0,1,0,0,0,0|2,0,1]=4 570 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)I 1458a_100000185857_100011218688 [0,1,0,0,0,0|2,0,1]=4 571 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)O 1458a_100000185857_100011660834 [0,1,0,0,0,0|2,0,1]=4 572 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000185857 [0,1,0,0,0,0|3,0,0]=4 573 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185857 [0,1,0,0,0,0|3,0,0]=4 574 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Br 22a_100000210019_100000185857 [0,1,0,0,0,0|3,0,0]=4 575 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 11a_100000188690_100000185857 [0,1,0,0,0,0|3,0,0]=4 576 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 1626a_100000188690_100000185857 [0,1,0,0,0,0|3,0,0]=4 577 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)C 22a_100000188690_100000185857 [0,1,0,0,0,0|3,0,0]=4 578 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000185857 [0,1,0,0,0,0|3,0,0]=4 579 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185857 [0,1,0,0,0,0|3,0,0]=4 580 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185857 [0,1,0,0,0,0|3,0,0]=4 581 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 11a_100000210047_100000185857 [0,1,0,0,0,0|3,0,0]=4 582 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000185857 [0,1,0,0,0,0|3,0,0]=4 583 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)F 22a_100000210047_100000185857 [0,1,0,0,0,0|3,0,0]=4 584 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 11a_100000211102_100000185857 [0,1,0,0,0,0|3,0,0]=4 585 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000185857 [0,1,0,0,0,0|3,0,0]=4 586 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)I 22a_100000211102_100000185857 [0,1,0,0,0,0|3,0,0]=4 587 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000185857 [0,1,0,0,0,0|3,0,0]=4 588 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000185857 [0,1,0,0,0,0|3,0,0]=4 589 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200000210301 [0,1,0,0,0,0|2,0,0]=3 590 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200000210301 [0,1,0,0,0,0|2,0,0]=3 591 B13R1.148 CC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100009814033 [0,1,0,0,0,0|1,0,1]=3 592 B13R1.148 CC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000179758 [0,1,0,0,0,0|2,0,1]=4 593 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Br 1458a_100000246016_200000210301 [0,1,0,0,0,0|1,0,1]=3 594 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000179758 [0,1,0,0,0,0|1,0,1]=3 595 B13R1.148 CC(=O)C(C)Oc1cccc(c1)C 1458a_100000183885_200000210301 [0,1,0,0,0,0|1,0,1]=3 596 B13R1.148 CC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000179758 [0,1,0,0,0,0|1,0,1]=3 597 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Cl 1458a_100000185161_200000210301 [0,1,0,0,0,0|1,0,1]=3 598 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000179758 [0,1,0,0,0,0|1,0,1]=3 599 B13R1.148 CC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000179758 [0,1,0,0,0,0|1,0,1]=3 600 B13R1.148 CC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000179758 [0,1,0,0,0,0|1,0,1]=3 601 B13R1.148 CC(=O)C(C)Oc1cncc(c1)Br 7a_100000754920_100000179758 [0,1,0,0,0,0|2,0,1]=4 602 B13R1.148 CC(=O)C(C)Oc1cncc(c1)C 7a_100011830280_100000179758 [0,1,0,0,0,0|2,0,1]=4 603 B13R1.148 CC(=O)C(C)Oc1cncc(c1)Cl 7a_100000032511_100000179758 [0,1,0,0,0,0|2,0,1]=4 604 B13R1.148 CC(=O)C(C)Oc1cncc(c1)F 7a_100011830296_100000179758 [0,1,0,0,0,0|2,0,1]=4 605 B13R1.148 CC(=O)C(C)Sc1cc(=O)cc[nH]1 62a_100009817434_100009814033 [0,1,0,0,0,0|2,0,1]=4 606 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)C 62a_100000750283_100009814033 [0,1,0,0,0,0|2,0,1]=4 607 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)C 62a_100009814033_100000750283 [0,1,0,0,0,0|2,0,1]=4 608 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)Cl 62a_100009814033_100010167805 [0,1,0,0,0,0|2,0,1]=4 609 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)Cl 62a_100010167805_100009814033 [0,1,0,0,0,0|2,0,1]=4 610 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)F 62a_100000764206_100009814033 [0,1,0,0,0,0|2,0,1]=4 611 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)F 62a_100009814033_100000764206 [0,1,0,0,0,0|2,0,1]=4 612 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)N 62a_100009814033_100009814236 [0,1,0,0,0,0|2,0,1]=4 613 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)N 62a_100009814236_100009814033 [0,1,0,0,0,0|2,0,1]=4 614 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)O 62a_100009814033_100000762945 [0,1,0,0,0,0|2,0,1]=4 615 B13R1.148 CC(=O)C(C)Sc1cc[nH]c(=O)c1 62a_100009814033_100009816521 [0,1,0,0,0,0|2,0,1]=4 616 B13R1.148 CC(=O)C(C)Sc1cc[nH]c(=O)c1 62a_100009816521_100009814033 [0,1,0,0,0,0|2,0,1]=4 617 B13R1.148 CC(=O)C(C)Sc1ccc[n+](c1)C 62a_100009814033_100009996589 [0,1,0,0,0,0|2,0,1]=4 618 B13R1.148 CC(=O)C(C)Sc1ccc[n+](c1)C 62a_100009996589_100009814033 [0,1,0,0,0,0|2,0,1]=4 619 B13R1.148 CC(=O)C(C)Sc1ccc[n+](c1)[O-] 62a_100009814033_100009815978 [0,1,0,0,0,0|2,0,1]=4 620 B13R1.148 CC(=O)C(C)Sc1cccc(=O)[nH]1 62a_100009814033_100000752884 [0,1,0,0,0,0|2,0,1]=4 621 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100009814033 [0,1,0,0,0,0|1,0,1]=3 622 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Br 62a_100009814033_100000691529 [0,1,0,0,0,0|1,0,1]=3 623 B13R1.148 CC(=O)C(C)Sc1cccc(c1)C 62a_100009814033_100011215228 [0,1,0,0,0,0|1,0,1]=3 624 B13R1.148 CC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100009814033 [0,1,0,0,0,0|1,0,1]=3 625 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100009814033 [0,1,0,0,0,0|1,0,1]=3 626 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Cl 62a_100009814033_100000699651 [0,1,0,0,0,0|1,0,1]=3 627 B13R1.148 CC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100009814033 [0,1,0,0,0,0|1,0,1]=3 628 B13R1.148 CC(=O)C(C)Sc1cccc(c1)F 62a_100009814033_100000685547 [0,1,0,0,0,0|1,0,1]=3 629 B13R1.148 CC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100009814033 [0,1,0,0,0,0|1,0,1]=3 630 B13R1.148 CC(=O)C(C)Sc1cccc(c1)N 62a_100009814033_100000210019 [0,1,0,0,0,0|1,0,1]=3 631 B13R1.148 CC(=O)C(C)Sc1cccc(c1)O 62a_100009814033_100000211634 [0,1,0,0,0,0|1,0,1]=3 632 B13R1.148 CC(=O)C(C)Sc1cccc(c1)[S] 62a_100009814033_114929384022 [0,1,0,0,0,0|1,0,1]=3 633 B13R1.148 CC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100009814033 [0,1,0,0,0,0|1,0,1]=3 634 B13R1.148 CC(=O)C(C)Sc1cccc(n1)Br 62a_100000684672_100009814033 [0,1,0,0,0,0|2,0,1]=4 635 B13R1.148 CC(=O)C(C)Sc1cccc(n1)Br 62a_100009814033_100000684672 [0,1,0,0,0,0|2,0,1]=4 636 B13R1.148 CC(=O)C(C)Sc1cccc(n1)C 62a_100000742759_100009814033 [0,1,0,0,0,0|2,0,1]=4 637 B13R1.148 CC(=O)C(C)Sc1cccc(n1)C 62a_100009814033_100000742759 [0,1,0,0,0,0|2,0,1]=4 638 B13R1.148 CC(=O)C(C)Sc1cccc(n1)Cl 62a_100000051397_100009814033 [0,1,0,0,0,0|2,0,1]=4 639 B13R1.148 CC(=O)C(C)Sc1cccc(n1)Cl 62a_100009814033_100000051397 [0,1,0,0,0,0|2,0,1]=4 640 B13R1.148 CC(=O)C(C)Sc1cccc(n1)F 62a_100009814033_100009815982 [0,1,0,0,0,0|2,0,1]=4 641 B13R1.148 CC(=O)C(C)Sc1cccc(n1)F 62a_100009815982_100009814033 [0,1,0,0,0,0|2,0,1]=4 642 B13R1.148 CC(=O)C(C)Sc1cccc(n1)N 62a_100000740741_100009814033 [0,1,0,0,0,0|2,0,1]=4 643 B13R1.148 CC(=O)C(C)Sc1cccc(n1)N 62a_100009814033_100000740741 [0,1,0,0,0,0|2,0,1]=4 644 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)Br 62a_100009814033_100009814637 [0,1,0,0,0,0|2,0,1]=4 645 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)Br 62a_100009814637_100009814033 [0,1,0,0,0,0|2,0,1]=4 646 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)C 62a_100000758586_100009814033 [0,1,0,0,0,0|2,0,1]=4 647 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)C 62a_100009814033_100000758586 [0,1,0,0,0,0|2,0,1]=4 648 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)Cl 62a_100000035001_100009814033 [0,1,0,0,0,0|2,0,1]=4 649 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)Cl 62a_100009814033_100000035001 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)F 62a_100009814033_100009816116 [0,1,0,0,0,0|2,0,1]=4 651 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)F 62a_100009816116_100009814033 [0,1,0,0,0,0|2,0,1]=4 652 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)N 62a_100000049665_100009814033 [0,1,0,0,0,0|2,0,1]=4 653 B13R1.148 CC(=O)C(C)Sc1ccnc(c1)N 62a_100009814033_100000049665 [0,1,0,0,0,0|2,0,1]=4 654 B13R1.148 CC(=O)C(C)Sc1cncc(c1)Br 62a_100000728054_100009814033 [0,1,0,0,0,0|2,0,1]=4 655 B13R1.148 CC(=O)C(C)Sc1cncc(c1)Br 62a_100009814033_100000728054 [0,1,0,0,0,0|2,0,1]=4 656 B13R1.148 CC(=O)C(C)Sc1cncc(c1)C 62a_100000760492_100009814033 [0,1,0,0,0,0|2,0,1]=4 657 B13R1.148 CC(=O)C(C)Sc1cncc(c1)C 62a_100009814033_100000760492 [0,1,0,0,0,0|2,0,1]=4 658 B13R1.148 CC(=O)C(C)Sc1cncc(c1)Cl 62a_100000049639_100009814033 [0,1,0,0,0,0|2,0,1]=4 659 B13R1.148 CC(=O)C(C)Sc1cncc(c1)Cl 62a_100009814033_100000049639 [0,1,0,0,0,0|2,0,1]=4 660 B13R1.148 CC(=O)C(C)Sc1cncc(c1)F 62a_100000744099_100009814033 [0,1,0,0,0,0|2,0,1]=4 661 B13R1.148 CC(=O)C(C)Sc1cncc(c1)F 62a_100009814033_100000744099 [0,1,0,0,0,0|2,0,1]=4 662 B13R1.148 CC(=O)C(C)Sc1cncc(c1)N 62a_100000687067_100009814033 [0,1,0,0,0,0|2,0,1]=4 663 B13R1.148 CC(=O)C(C)Sc1cncc(c1)N 62a_100009814033_100000687067 [0,1,0,0,0,0|2,0,1]=4 664 B13R1.148 CC(=O)C(C)Sc1cncc(c1)O 62a_100000754920_100009814033 [0,1,0,0,0,0|2,0,1]=4 665 B13R1.148 CC(=O)C(C)Sc1cncc(c1)O 62a_100009814033_100000754920 [0,1,0,0,0,0|2,0,1]=4 666 B13R1.148 CC(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200000210301 [0,1,0,0,0,0|1,0,2]=4 667 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)C 11a_106354213154_100015343762 [0,1,0,0,0,0|2,0,1]=4 668 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)C 240690a_106354213154_100015343762 [0,1,0,0,0,0|2,0,1]=4 669 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)C 527a_106354213154_100103153847 [0,1,0,0,0,0|2,0,1]=4 670 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)Cl 11a_100102954512_100015343762 [0,1,0,0,0,0|2,0,1]=4 671 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)Cl 1626a_100102954512_100015343762 [0,1,0,0,0,0|2,0,1]=4 672 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)Cl 240690a_100102954512_100015343762 [0,1,0,0,0,0|2,0,1]=4 673 B13R1.148 CC(=O)N(C)Cc1cc(ccn1)Cl 527a_100102954512_100103153847 [0,1,0,0,0,0|2,0,1]=4 674 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100015343762 [0,1,0,0,0,0|1,0,1]=3 675 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100015343762 [0,1,0,0,0,0|1,0,1]=3 676 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100015343762 [0,1,0,0,0,0|1,0,1]=3 677 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100103153847 [0,1,0,0,0,0|1,0,1]=3 678 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100015343762 [0,1,0,0,0,0|1,0,1]=3 679 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100015343762 [0,1,0,0,0,0|1,0,1]=3 680 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100015343762 [0,1,0,0,0,0|1,0,1]=3 681 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100103153847 [0,1,0,0,0,0|1,0,1]=3 682 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100015343762 [0,1,0,0,0,0|1,0,1]=3 683 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100015343762 [0,1,0,0,0,0|1,0,1]=3 684 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100015343762 [0,1,0,0,0,0|1,0,1]=3 685 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100103153847 [0,1,0,0,0,0|1,0,1]=3 686 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100015343762 [0,1,0,0,0,0|1,0,1]=3 687 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100015343762 [0,1,0,0,0,0|1,0,1]=3 688 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100015343762 [0,1,0,0,0,0|1,0,1]=3 689 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100103153847 [0,1,0,0,0,0|1,0,1]=3 690 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100015343762 [0,1,0,0,0,0|1,0,1]=3 691 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100103153847 [0,1,0,0,0,0|1,0,1]=3 692 B13R1.148 CC(=O)N(C)Cc1cccc(n1)Br 11a_106354212997_100015343762 [0,1,0,0,0,0|2,0,1]=4 693 B13R1.148 CC(=O)N(C)Cc1cccc(n1)Br 1626a_106354212997_100015343762 [0,1,0,0,0,0|2,0,1]=4 694 B13R1.148 CC(=O)N(C)Cc1cccc(n1)Br 240690a_106354212997_100015343762 [0,1,0,0,0,0|2,0,1]=4 695 B13R1.148 CC(=O)N(C)Cc1cccc(n1)Br 527a_106354212997_100103153847 [0,1,0,0,0,0|2,0,1]=4 696 B13R1.148 CC(=O)N(C)Cc1cccc(n1)C 11a_100000687132_100015343762 [0,1,0,0,0,0|2,0,1]=4 697 B13R1.148 CC(=O)N(C)Cc1cccc(n1)C 1626a_100000687132_100015343762 [0,1,0,0,0,0|2,0,1]=4 698 B13R1.148 CC(=O)N(C)Cc1cccc(n1)C 240690a_100000687132_100015343762 [0,1,0,0,0,0|2,0,1]=4 699 B13R1.148 CC(=O)N(C)Cc1cccc(n1)C 527a_100000687132_100103153847 [0,1,0,0,0,0|2,0,1]=4 700 B13R1.148 CC(=O)N(C)Cc1cncc(c1)Br 11a_103549770560_100015343762 [0,1,0,0,0,0|2,0,1]=4 701 B13R1.148 CC(=O)N(C)Cc1cncc(c1)Br 240690a_103549770560_100015343762 [0,1,0,0,0,0|2,0,1]=4 702 B13R1.148 CC(=O)N(C)Cc1cncc(c1)Br 527a_103549770560_100103153847 [0,1,0,0,0,0|2,0,1]=4 703 B13R1.148 CC(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200000210301 [0,1,0,0,0,0|1,0,2]=4 704 B13R1.148 CC(Nc1cccc(c1)Br)C(=O)N 34a_100000210019_100000702099 [0,1,0,0,0,0|2,0,1]=4 705 B13R1.148 CC(Nc1cccc(c1)Cl)C(=O)N 34a_100000185859_100000702099 [0,1,0,0,0,0|2,0,1]=4 706 B13R1.148 CC(Nc1cccc(c1)F)C(=O)N 34a_100000210047_100000702099 [0,1,0,0,0,0|2,0,1]=4 707 B13R1.148 CC(Nc1cccc(c1)I)C(=O)N 34a_100000211102_100000702099 [0,1,0,0,0,0|2,0,1]=4 708 B13R1.148 CC(Nc1cccc(c1)O)C(=O)N 34a_100000210217_100000702099 [0,1,0,0,0,0|2,0,1]=4 709 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)N 34a_100000210342_100000702099 [0,1,0,0,0,0|2,0,1]=4 710 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)N 7a_100000210342_100000702099 [0,1,0,0,0,0|2,0,1]=4 711 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)[13CH3] 1458a_100000246016_200025704644 [0,1,0,0,0,0|1,0,1]=3 712 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)N 34a_100000210295_100000702099 [0,1,0,0,0,0|2,0,1]=4 713 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)N 7a_100000210295_100000702099 [0,1,0,0,0,0|2,0,1]=4 714 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)[13CH3] 1458a_100000185161_200025704644 [0,1,0,0,0,0|1,0,1]=3 715 B13R1.148 CC(Oc1cccc(c1)F)C(=O)N 34a_100000210426_100000702099 [0,1,0,0,0,0|2,0,1]=4 716 B13R1.148 CC(Oc1cccc(c1)F)C(=O)N 7a_100000210426_100000702099 [0,1,0,0,0,0|2,0,1]=4 717 B13R1.148 CC(Oc1cccc(c1)I)C(=O)N 34a_100000211634_100000702099 [0,1,0,0,0,0|2,0,1]=4 718 B13R1.148 CC(Oc1cccc(c1)I)C(=O)N 7a_100000211634_100000702099 [0,1,0,0,0,0|2,0,1]=4 719 B13R1.148 CC(Oc1cccc(c1)N)C(=O)N 34a_100000210217_100000702099 [0,1,0,0,0,0|2,0,1]=4 720 B13R1.148 CC(Oc1cccc(c1)O)C(=O)N 271570a_203496583355_200000150601 [0,1,0,0,0,0|2,0,1]=4 721 B13R1.148 CC(Sc1cccc(c1)Br)C(=O)N 62a_100000691529_100000702099 [0,1,0,0,0,0|2,0,1]=4 722 B13R1.148 CC(Sc1cccc(c1)Br)C(=O)N 62a_100000702099_100000691529 [0,1,0,0,0,0|2,0,1]=4 723 B13R1.148 CC(Sc1cccc(c1)Cl)C(=O)N 62a_100000699651_100000702099 [0,1,0,0,0,0|2,0,1]=4 724 B13R1.148 CC(Sc1cccc(c1)Cl)C(=O)N 62a_100000702099_100000699651 [0,1,0,0,0,0|2,0,1]=4 725 B13R1.148 CC(Sc1cccc(c1)F)C(=O)N 62a_100000685547_100000702099 [0,1,0,0,0,0|2,0,1]=4 726 B13R1.148 CC(Sc1cccc(c1)F)C(=O)N 62a_100000702099_100000685547 [0,1,0,0,0,0|2,0,1]=4 727 B13R1.148 CC(Sc1cccc(c1)N)C(=O)N 62a_100000210019_100000702099 [0,1,0,0,0,0|2,0,1]=4 728 B13R1.148 CC(Sc1cccc(c1)N)C(=O)N 62a_100000702099_100000210019 [0,1,0,0,0,0|2,0,1]=4 729 B13R1.148 CC(Sc1cccc(c1)O)C(=O)N 62a_100000702099_100000211634 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.148 CC(Sc1cccc(c1)[S])C(=O)N 62a_100000702099_114929384022 [0,1,0,0,0,0|2,0,1]=4 731 B13R1.148 CC(Sc1cccc(c1)[S])C(=O)N 62a_114929384022_100000702099 [0,1,0,0,0,0|2,0,1]=4 732 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)N 22a_100000188690_100011215815 [0,1,0,0,0,0|3,0,0]=4 733 B13R1.148 Cc1cccc(c1)NC(C)C(=O)N 2230a_100000188690_100000702099 [0,1,0,0,0,0|2,0,1]=4 734 B13R1.148 Cc1cccc(c1)NC(C)C(=O)N 34a_100000188690_100000702099 [0,1,0,0,0,0|2,0,1]=4 735 B13R1.148 Cc1cccc(c1)OC(C)C(=O)N 34a_100000210337_100000702099 [0,1,0,0,0,0|2,0,1]=4 736 B13R1.148 Cc1cccc(c1)OC(C)C(=O)N 7a_100000210337_100000702099 [0,1,0,0,0,0|2,0,1]=4 737 B13R1.148 Cc1cccc(c1)OC(C)C(=O)[13CH3] 1458a_100000183885_200025704644 [0,1,0,0,0,0|1,0,1]=3 738 B13R1.148 Cc1cccc(c1)SC(C)C(=O)N 62a_100000702099_100011215228 [0,1,0,0,0,0|2,0,1]=4 739 B13R1.148 Cc1cccc(c1)SC(C)C(=O)N 62a_100011215228_100000702099 [0,1,0,0,0,0|2,0,1]=4 740 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)Br 22a_100000210019_100011215815 [0,1,0,0,0,0|3,0,0]=4 741 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100011215815 [0,1,0,0,0,0|3,0,0]=4 742 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)F 22a_100000210047_100011215815 [0,1,0,0,0,0|3,0,0]=4 743 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)I 22a_100000211102_100011215815 [0,1,0,0,0,0|3,0,0]=4 744 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)O 22a_100000210217_100011215815 [0,1,0,0,0,0|3,0,0]=4 745 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200025704644 [0,1,0,0,0,0|2,0,0]=3 746 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200025704644 [0,1,0,0,0,0|2,0,0]=3 747 B13R1.148 [13CH3]C(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200025704644 [0,1,0,0,0,0|1,0,2]=4 748 B13R1.148 [13CH3]C(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200025704644 [0,1,0,0,0,0|1,0,2]=4 749 B13R1.152 C=C(C(=O)C(C)C)c1ccccc1 1458a_100000065200_100000210206 [0,1,0,0,0,0|2,0,1]=4 750 B13R1.152 C=C(C(=O)N(C)C)c1ccccc1 1626a_100102631434_100000065200 [0,1,0,0,0,0|3,0,0]=4 751 B13R1.152 C=C(C)C(=O)C(C)c1ccccc1 1458a_100000185857_100000230085 [0,1,0,0,0,0|2,0,1]=4 752 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 11a_100000210012_100000185857 [0,1,0,0,0,0|3,0,0]=4 753 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 1626a_100000210012_100000185857 [0,1,0,0,0,0|3,0,0]=4 754 B13R1.152 C=C(C)C(=O)N(C)c1ccccc1 22a_100000210012_100000185857 [0,1,0,0,0,0|3,0,0]=4 755 B13R1.152 CC(=O)C(=O)N(C)c1ccccc1 1458a_100011297159_200000210301 [0,1,0,0,0,0|2,0,0]=3 756 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 1458a_100000070787_100000239700 [0,1,0,0,0,0|0,0,1]=2 757 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000179758 [0,1,0,0,0,0|0,0,1]=2 758 B13R1.152 CC(=O)C(C)N(C)c1ccccc1 2230a_100000210012_100009814033 [0,1,0,0,0,0|1,0,1]=3 759 B13R1.152 CC(=O)C(C)N(C)c1ccccc1 269982a_100000210012_100009814033 [0,1,0,0,0,0|1,0,1]=3 760 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 11a_100000195388_100015343762 [0,1,0,0,0,0|1,0,1]=3 761 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 1626a_100000195388_100015343762 [0,1,0,0,0,0|1,0,1]=3 762 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 240690a_100000195388_100015343762 [0,1,0,0,0,0|1,0,1]=3 763 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 527a_100000195388_100103153847 [0,1,0,0,0,0|1,0,1]=3 764 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 11a_100000231138_100015343762 [0,1,0,0,0,0|2,0,1]=4 765 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 1626a_100000231138_100015343762 [0,1,0,0,0,0|2,0,1]=4 766 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 240690a_100000231138_100015343762 [0,1,0,0,0,0|2,0,1]=4 767 B13R1.152 CC(=O)N(C)C(C)c1ccccn1 527a_100000231138_100103153847 [0,1,0,0,0,0|2,0,1]=4 768 B13R1.152 CC(=O)N(C)C(C)c1cccnc1 11a_100000232774_100015343762 [0,1,0,0,0,0|2,0,1]=4 769 B13R1.152 CC(=O)N(C)C(C)c1cccnc1 240690a_100000232774_100015343762 [0,1,0,0,0,0|2,0,1]=4 770 B13R1.152 CC(=O)N(C)C(C)c1cccnc1 527a_100000232774_100103153847 [0,1,0,0,0,0|2,0,1]=4 771 B13R1.152 CC(=O)N(C)C(C)c1ccncc1 11a_100000231139_100015343762 [0,1,0,0,0,0|2,0,1]=4 772 B13R1.152 CC(=O)N(C)C(C)c1ccncc1 240690a_100000231139_100015343762 [0,1,0,0,0,0|2,0,1]=4 773 B13R1.152 CC(=O)N(C)C(C)c1ccncc1 527a_100000231139_100103153847 [0,1,0,0,0,0|2,0,1]=4 774 B13R1.152 CC(C(=O)N)C(=O)c1ccccc1 1458a_100000185807_100000702099 [0,1,0,0,0,0|1,0,1]=3 775 B13R1.152 CC(C(=O)N)N(C)c1ccccc1 2230a_100000210012_100000702099 [0,1,0,0,0,0|2,0,1]=4 776 B13R1.152 CC(C(=O)N)N(C)c1ccccc1 269982a_100000210012_100000184083 [0,1,0,0,0,0|2,0,1]=4 777 B13R1.152 CC(C(=O)N)N(C)c1ccccc1 34a_100000210012_100000702099 [0,1,0,0,0,0|2,0,1]=4 778 B13R1.152 CC(C(=O)O)N(C)c1ccccc1 269956a_100000189636_200000210301 [0,1,0,0,0,0|2,0,1]=4 779 B13R1.152 CC(C(=O)O)N([13CH3])c1ccccc1 269956a_100000189636_200025704644 [0,1,0,0,0,0|2,0,1]=4 780 B13R1.152 CC(C(=O)c1ccccc1)N(C)C 2230a_100102631434_100000239700 [0,1,0,0,0,0|2,0,1]=4 781 B13R1.152 CC(C(=O)c1ccccc1)N(C)C 269982a_100102631434_100000239700 [0,1,0,0,0,0|2,0,1]=4 782 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 11a_200000211004_100000185807 [0,1,0,0,0,0|2,0,1]=4 783 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 1626a_200000211004_100000185807 [0,1,0,0,0,0|2,0,1]=4 784 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 240690a_200000211004_100000185807 [0,1,0,0,0,0|2,0,1]=4 785 B13R1.152 CC(C)N(C)C(=O)c1ccccc1 527a_200000211004_100000185807 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.152 CN(C(=O)C(=O)N)c1ccccc1 22a_100000210012_100011215815 [0,1,0,0,0,0|3,0,0]=4 787 B13R1.152 CN(C(=O)C(=O)[13CH3])c1ccccc1 1458a_100011297159_200025704644 [0,1,0,0,0,0|2,0,0]=3 788 B13R1.152 NC(=O)C(F)C(=O)c1ccccc1 1458a_100000185807_100009813875 [0,1,0,0,0,0|2,0,1]=4 789 B13R1.152 O=C([O-])C(F)C(=O)c1ccccc1 1458a_100000185807_100020610796 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.202 C=C(C)C(=O)Cc1ccccc1Br 1458a_100000185857_100000184730 [0,1,0,0,0,0|2,0,1]=4 791 B13R1.202 C=C(C)C(=O)Cc1ccccc1C 1458a_100000185857_100000211839 [0,1,0,0,0,0|2,0,1]=4 792 B13R1.202 C=C(C)C(=O)Cc1ccccc1Cl 1458a_100000185857_100000187162 [0,1,0,0,0,0|2,0,1]=4 793 B13R1.202 C=C(C)C(=O)Cc1ccccc1F 1458a_100000185857_100000187165 [0,1,0,0,0,0|2,0,1]=4 794 B13R1.202 C=C(C)C(=O)Cc1ccccc1I 1458a_100000185857_100011216222 [0,1,0,0,0,0|2,0,1]=4 795 B13R1.202 C=C(C)C(=O)Nc1ccccc1Br 11a_100000210017_100000185857 [0,1,0,0,0,0|3,0,0]=4 796 B13R1.202 C=C(C)C(=O)Nc1ccccc1Br 1626a_100000210017_100000185857 [0,1,0,0,0,0|3,0,0]=4 797 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 11a_100015192222_100000185857 [0,1,0,0,0,0|3,0,0]=4 798 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 1626a_100015192222_100000185857 [0,1,0,0,0,0|3,0,0]=4 799 B13R1.202 C=C(C)C(=O)Nc1ccccc1C 22a_100015192222_100000185857 [0,1,0,0,0,0|3,0,0]=4 800 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 11a_100000185783_100000185857 [0,1,0,0,0,0|3,0,0]=4 801 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000185857 [0,1,0,0,0,0|3,0,0]=4 802 B13R1.202 C=C(C)C(=O)Nc1ccccc1Cl 22a_100000185783_100000185857 [0,1,0,0,0,0|3,0,0]=4 803 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 11a_100000210422_100000185857 [0,1,0,0,0,0|3,0,0]=4 804 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 1626a_100000210422_100000185857 [0,1,0,0,0,0|3,0,0]=4 805 B13R1.202 C=C(C)C(=O)Nc1ccccc1F 22a_100000210422_100000185857 [0,1,0,0,0,0|3,0,0]=4 806 B13R1.202 C=C(C)C(=O)Nc1ccccc1I 11a_100000210053_100000185857 [0,1,0,0,0,0|3,0,0]=4 807 B13R1.202 C=C(C)C(=O)Nc1ccccc1I 1626a_100000210053_100000185857 [0,1,0,0,0,0|3,0,0]=4 808 B13R1.202 C=C(C)C(=O)Nc1ccccc1O 22a_100000185747_100000185857 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.202 CC(=Cc1ccccc1Cl)C(=O)[13CH3] 1458a_100000693296_200025704644 [0,1,0,0,0,0|0,0,0]=1 810 B13R1.202 CC(=O)C(=Cc1ccccc1Cl)C 1458a_100000693296_200000210301 [0,1,0,0,0,0|0,0,0]=1 811 B13R1.202 CC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_200000210301 [0,1,0,0,0,0|2,0,0]=3 812 B13R1.202 CC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_200000210301 [0,1,0,0,0,0|2,0,0]=3 813 B13R1.202 CC(=O)C(C)Oc1cccc[n+]1[O-] 7a_100000211761_100000179758 [0,1,0,0,0,0|2,0,1]=4 814 B13R1.202 CC(=O)C(C)Oc1ccccc1Br 1458a_100000246065_200000210301 [0,1,0,0,0,0|1,0,1]=3 815 B13R1.202 CC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000179758 [0,1,0,0,0,0|1,0,1]=3 816 B13R1.202 CC(=O)C(C)Oc1ccccc1C 1458a_100000189243_200000210301 [0,1,0,0,0,0|1,0,1]=3 817 B13R1.202 CC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000179758 [0,1,0,0,0,0|1,0,1]=3 818 B13R1.202 CC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_200000210301 [0,1,0,0,0,0|1,0,1]=3 819 B13R1.202 CC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000179758 [0,1,0,0,0,0|1,0,1]=3 820 B13R1.202 CC(=O)C(C)Oc1ccccc1F 1458a_100000191191_200000210301 [0,1,0,0,0,0|1,0,1]=3 821 B13R1.202 CC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000179758 [0,1,0,0,0,0|1,0,1]=3 822 B13R1.202 CC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000179758 [0,1,0,0,0,0|1,0,1]=3 823 B13R1.202 CC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000179758 [0,1,0,0,0,0|1,0,1]=3 824 B13R1.202 CC(=O)C(C)Oc1cccnc1Br 7a_100000744436_100000179758 [0,1,0,0,0,0|2,0,1]=4 825 B13R1.202 CC(=O)C(C)Oc1cccnc1C 7a_100000745507_100000179758 [0,1,0,0,0,0|2,0,1]=4 826 B13R1.202 CC(=O)C(C)Oc1cccnc1Cl 7a_100000757616_100000179758 [0,1,0,0,0,0|2,0,1]=4 827 B13R1.202 CC(=O)C(C)Oc1cccnc1F 7a_100000061740_100000179758 [0,1,0,0,0,0|2,0,1]=4 828 B13R1.202 CC(=O)C(C)Oc1cccnc1I 7a_100000034122_100000179758 [0,1,0,0,0,0|2,0,1]=4 829 B13R1.202 CC(=O)C(C)Oc1cccnc1N 7a_100000211975_100000179758 [0,1,0,0,0,0|2,0,1]=4 830 B13R1.202 CC(=O)C(C)Oc1cccoc1=O 7a_100000077404_100000179758 [0,1,0,0,0,0|2,0,1]=4 831 B13R1.202 CC(=O)C(C)Oc1cnccc1C 7a_100011997053_100000179758 [0,1,0,0,0,0|2,0,1]=4 832 B13R1.202 CC(=O)C(C)Sc1c[nH]ccc1=O 62a_100009814033_100009998708 [0,1,0,0,0,0|2,0,1]=4 833 B13R1.202 CC(=O)C(C)Sc1c[nH]ccc1=O 62a_100009998708_100009814033 [0,1,0,0,0,0|2,0,1]=4 834 B13R1.202 CC(=O)C(C)Sc1c[nH]ccc1=S 62a_100009814033_200012280681 [0,1,0,0,0,0|2,0,1]=4 835 B13R1.202 CC(=O)C(C)Sc1c[nH]ccc1=S 62a_200012280681_100009814033 [0,1,0,0,0,0|2,0,1]=4 836 B13R1.202 CC(=O)C(C)Sc1cccc[n+]1C 62a_100009814033_100000212160 [0,1,0,0,0,0|2,0,1]=4 837 B13R1.202 CC(=O)C(C)Sc1cccc[n+]1[O-] 62a_100009814033_200000042595 [0,1,0,0,0,0|2,0,1]=4 838 B13R1.202 CC(=O)C(C)Sc1ccccc1Br 62a_100000695589_100009814033 [0,1,0,0,0,0|1,0,1]=3 839 B13R1.202 CC(=O)C(C)Sc1ccccc1Br 62a_100009814033_100000695589 [0,1,0,0,0,0|1,0,1]=3 840 B13R1.202 CC(=O)C(C)Sc1ccccc1C 62a_100000210755_100009814033 [0,1,0,0,0,0|1,0,1]=3 841 B13R1.202 CC(=O)C(C)Sc1ccccc1C 62a_100009814033_100000210755 [0,1,0,0,0,0|1,0,1]=3 842 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_200000210301 [0,1,0,0,0,0|1,0,1]=3 843 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100009814033 [0,1,0,0,0,0|1,0,1]=3 844 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl 62a_100009814033_100000764095 [0,1,0,0,0,0|1,0,1]=3 845 B13R1.202 CC(=O)C(C)Sc1ccccc1F 62a_100009814033_100011215700 [0,1,0,0,0,0|1,0,1]=3 846 B13R1.202 CC(=O)C(C)Sc1ccccc1F 62a_100011215700_100009814033 [0,1,0,0,0,0|1,0,1]=3 847 B13R1.202 CC(=O)C(C)Sc1ccccc1N 62a_100000210017_100009814033 [0,1,0,0,0,0|1,0,1]=3 848 B13R1.202 CC(=O)C(C)Sc1ccccc1N 62a_100009814033_100000210017 [0,1,0,0,0,0|1,0,1]=3 849 B13R1.202 CC(=O)C(C)Sc1ccccc1O 62a_100000739446_100009814033 [0,1,0,0,0,0|1,0,1]=3 850 B13R1.202 CC(=O)C(C)Sc1ccccc1O 62a_100009814033_100000739446 [0,1,0,0,0,0|1,0,1]=3 851 B13R1.202 CC(=O)C(C)Sc1cccnc1Br 62a_100009814033_100010202626 [0,1,0,0,0,0|2,0,1]=4 852 B13R1.202 CC(=O)C(C)Sc1cccnc1Br 62a_100010202626_100009814033 [0,1,0,0,0,0|2,0,1]=4 853 B13R1.202 CC(=O)C(C)Sc1cccnc1C 62a_100000751574_100009814033 [0,1,0,0,0,0|2,0,1]=4 854 B13R1.202 CC(=O)C(C)Sc1cccnc1C 62a_100009814033_100000751574 [0,1,0,0,0,0|2,0,1]=4 855 B13R1.202 CC(=O)C(C)Sc1cccnc1Cl 62a_100000036424_100009814033 [0,1,0,0,0,0|2,0,1]=4 856 B13R1.202 CC(=O)C(C)Sc1cccnc1Cl 62a_100009814033_100000036424 [0,1,0,0,0,0|2,0,1]=4 857 B13R1.202 CC(=O)C(C)Sc1cccnc1F 62a_100009814033_100009816115 [0,1,0,0,0,0|2,0,1]=4 858 B13R1.202 CC(=O)C(C)Sc1cccnc1F 62a_100009816115_100009814033 [0,1,0,0,0,0|2,0,1]=4 859 B13R1.202 CC(=O)C(C)Sc1cccnc1N 62a_100000045569_100009814033 [0,1,0,0,0,0|2,0,1]=4 860 B13R1.202 CC(=O)C(C)Sc1cccnc1N 62a_100009814033_100000045569 [0,1,0,0,0,0|2,0,1]=4 861 B13R1.202 CC(=O)C(C)Sc1cccnc1O 62a_100000760158_100009814033 [0,1,0,0,0,0|2,0,1]=4 862 B13R1.202 CC(=O)C(C)Sc1cccnc1O 62a_100009814033_100000760158 [0,1,0,0,0,0|2,0,1]=4 863 B13R1.202 CC(=O)C(C)Sc1ccncc1Br 62a_100000726257_100009814033 [0,1,0,0,0,0|2,0,1]=4 864 B13R1.202 CC(=O)C(C)Sc1ccncc1Br 62a_100009814033_100000726257 [0,1,0,0,0,0|2,0,1]=4 865 B13R1.202 CC(=O)C(C)Sc1ccncc1C 62a_100000765111_100009814033 [0,1,0,0,0,0|2,0,1]=4 866 B13R1.202 CC(=O)C(C)Sc1ccncc1C 62a_100009814033_100000765111 [0,1,0,0,0,0|2,0,1]=4 867 B13R1.202 CC(=O)C(C)Sc1ccncc1Cl 62a_100000708259_100009814033 [0,1,0,0,0,0|2,0,1]=4 868 B13R1.202 CC(=O)C(C)Sc1ccncc1Cl 62a_100009814033_100000708259 [0,1,0,0,0,0|2,0,1]=4 869 B13R1.202 CC(=O)C(C)Sc1ccncc1F 62a_100000047030_100009814033 [0,1,0,0,0,0|2,0,1]=4 870 B13R1.202 CC(=O)C(C)Sc1ccncc1F 62a_100009814033_100000047030 [0,1,0,0,0,0|2,0,1]=4 871 B13R1.202 CC(=O)C(C)Sc1ccncc1N 62a_100000756074_100009814033 [0,1,0,0,0,0|2,0,1]=4 872 B13R1.202 CC(=O)C(C)Sc1ccncc1N 62a_100009814033_100000756074 [0,1,0,0,0,0|2,0,1]=4 873 B13R1.202 CC(=O)C(C)Sc1ccncc1O 62a_100009814033_100009817591 [0,1,0,0,0,0|2,0,1]=4 874 B13R1.202 CC(=O)C(C)Sc1ccncc1O 62a_100009817591_100009814033 [0,1,0,0,0,0|2,0,1]=4 875 B13R1.202 CC(=O)C(C)Sc1cnccc1Br 62a_100009814033_100010138639 [0,1,0,0,0,0|2,0,1]=4 876 B13R1.202 CC(=O)C(C)Sc1cnccc1Br 62a_100010138639_100009814033 [0,1,0,0,0,0|2,0,1]=4 877 B13R1.202 CC(=O)C(C)Sc1cnccc1C 62a_100000761580_100009814033 [0,1,0,0,0,0|2,0,1]=4 878 B13R1.202 CC(=O)C(C)Sc1cnccc1C 62a_100009814033_100000761580 [0,1,0,0,0,0|2,0,1]=4 879 B13R1.202 CC(=O)C(C)Sc1cnccc1Cl 62a_100009814033_100009995489 [0,1,0,0,0,0|2,0,1]=4 880 B13R1.202 CC(=O)C(C)Sc1cnccc1Cl 62a_100009995489_100009814033 [0,1,0,0,0,0|2,0,1]=4 881 B13R1.202 CC(=O)C(C)Sc1cnccc1F 62a_100009814033_100009820683 [0,1,0,0,0,0|2,0,1]=4 882 B13R1.202 CC(=O)C(C)Sc1cnccc1F 62a_100009820683_100009814033 [0,1,0,0,0,0|2,0,1]=4 883 B13R1.202 CC(=O)C(C)Sc1cnccc1N 62a_100000047001_100009814033 [0,1,0,0,0,0|2,0,1]=4 884 B13R1.202 CC(=O)C(C)Sc1cnccc1N 62a_100009814033_100000047001 [0,1,0,0,0,0|2,0,1]=4 885 B13R1.202 CC(=O)C(C)Sc1ncccc1Br 62a_100000696092_100009814033 [0,1,0,0,0,0|2,0,1]=4 886 B13R1.202 CC(=O)C(C)Sc1ncccc1Br 62a_100009814033_100000696092 [0,1,0,0,0,0|2,0,1]=4 887 B13R1.202 CC(=O)C(C)Sc1ncccc1C 62a_100000751373_100009814033 [0,1,0,0,0,0|2,0,1]=4 888 B13R1.202 CC(=O)C(C)Sc1ncccc1C 62a_100009814033_100000751373 [0,1,0,0,0,0|2,0,1]=4 889 B13R1.202 CC(=O)C(C)Sc1ncccc1Cl 62a_100009814033_100011356963 [0,1,0,0,0,0|2,0,1]=4 890 B13R1.202 CC(=O)C(C)Sc1ncccc1Cl 62a_100011356963_100009814033 [0,1,0,0,0,0|2,0,1]=4 891 B13R1.202 CC(=O)C(C)Sc1ncccc1F 62a_100000685392_100009814033 [0,1,0,0,0,0|2,0,1]=4 892 B13R1.202 CC(=O)C(C)Sc1ncccc1F 62a_100009814033_100000685392 [0,1,0,0,0,0|2,0,1]=4 893 B13R1.202 CC(=O)C(C)Sc1ncccc1N 62a_100000688686_100009814033 [0,1,0,0,0,0|2,0,1]=4 894 B13R1.202 CC(=O)C(C)Sc1ncccc1N 62a_100009814033_100000688686 [0,1,0,0,0,0|2,0,1]=4 895 B13R1.202 CC(=O)C(C)Sc1ncccc1O 62a_100000034122_100009814033 [0,1,0,0,0,0|2,0,1]=4 896 B13R1.202 CC(=O)C(C)Sc1ncccc1O 62a_100009814033_100000034122 [0,1,0,0,0,0|2,0,1]=4 897 B13R1.202 CC(=O)C(O)Cc1ccccc1Br 1458a_100012382637_200000210301 [0,1,0,0,0,0|1,0,2]=4 898 B13R1.202 CC(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_200000210301 [0,1,0,0,0,0|1,0,2]=4 899 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 11a_100000184654_100015343762 [0,1,0,0,0,0|1,0,1]=3 900 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 1626a_100000184654_100015343762 [0,1,0,0,0,0|1,0,1]=3 901 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 240690a_100000184654_100015343762 [0,1,0,0,0,0|1,0,1]=3 902 B13R1.202 CC(=O)N(C)Cc1ccccc1Br 527a_100000184654_100103153847 [0,1,0,0,0,0|1,0,1]=3 903 B13R1.202 CC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100015343762 [0,1,0,0,0,0|1,0,1]=3 904 B13R1.202 CC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100015343762 [0,1,0,0,0,0|1,0,1]=3 905 B13R1.202 CC(=O)N(C)Cc1ccccc1C 527a_100000184421_100103153847 [0,1,0,0,0,0|1,0,1]=3 906 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 11a_100000184507_100015343762 [0,1,0,0,0,0|1,0,1]=3 907 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 1626a_100000184507_100015343762 [0,1,0,0,0,0|1,0,1]=3 908 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 240690a_100000184507_100015343762 [0,1,0,0,0,0|1,0,1]=3 909 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl 527a_100000184507_100103153847 [0,1,0,0,0,0|1,0,1]=3 910 B13R1.202 CC(=O)N(C)Cc1ccccc1F 11a_100000742528_100015343762 [0,1,0,0,0,0|1,0,1]=3 911 B13R1.202 CC(=O)N(C)Cc1ccccc1F 1626a_100000742528_100015343762 [0,1,0,0,0,0|1,0,1]=3 912 B13R1.202 CC(=O)N(C)Cc1ccccc1F 240690a_100000742528_100015343762 [0,1,0,0,0,0|1,0,1]=3 913 B13R1.202 CC(=O)N(C)Cc1ccccc1F 527a_100000742528_100103153847 [0,1,0,0,0,0|1,0,1]=3 914 B13R1.202 CC(=O)N(C)Cc1ccccc1O 240690a_100015189988_100015343762 [0,1,0,0,0,0|1,0,1]=3 915 B13R1.202 CC(=O)N(C)Cc1ccccc1O 527a_100015189988_100103153847 [0,1,0,0,0,0|1,0,1]=3 916 B13R1.202 CC(=O)N(C)Cc1cccnc1C 11a_200011875998_100015343762 [0,1,0,0,0,0|2,0,1]=4 917 B13R1.202 CC(=O)N(C)Cc1cccnc1C 240690a_200011875998_100015343762 [0,1,0,0,0,0|2,0,1]=4 918 B13R1.202 CC(=O)N(C)Cc1cccnc1C 527a_200011875998_100103153847 [0,1,0,0,0,0|2,0,1]=4 919 B13R1.202 CC(=O)N(C)Cc1cccnc1Cl 11a_103496529121_100015343762 [0,1,0,0,0,0|2,0,1]=4 920 B13R1.202 CC(=O)N(C)Cc1cccnc1Cl 240690a_103496529121_100015343762 [0,1,0,0,0,0|2,0,1]=4 921 B13R1.202 CC(=O)N(C)Cc1cccnc1Cl 527a_103496529121_100103153847 [0,1,0,0,0,0|2,0,1]=4 922 B13R1.202 CC(=O)N(C)Cc1ccncc1C 240690a_100015187836_100015343762 [0,1,0,0,0,0|2,0,1]=4 923 B13R1.202 CC(=O)N(C)Cc1ccncc1C 527a_100015187836_100103153847 [0,1,0,0,0,0|2,0,1]=4 924 B13R1.202 CC(Nc1ccccc1Br)C(=O)N 34a_100000210017_100000702099 [0,1,0,0,0,0|2,0,1]=4 925 B13R1.202 CC(Nc1ccccc1Cl)C(=O)N 34a_100000185783_100000702099 [0,1,0,0,0,0|2,0,1]=4 926 B13R1.202 CC(Nc1ccccc1F)C(=O)N 34a_100000210422_100000702099 [0,1,0,0,0,0|2,0,1]=4 927 B13R1.202 CC(Nc1ccccc1I)C(=O)N 34a_100000210053_100000702099 [0,1,0,0,0,0|2,0,1]=4 928 B13R1.202 CC(Nc1ccccc1O)C(=O)N 34a_100000185747_100000702099 [0,1,0,0,0,0|2,0,1]=4 929 B13R1.202 CC(Oc1ccccc1Br)C(=O)N 34a_100000181306_100000702099 [0,1,0,0,0,0|2,0,1]=4 930 B13R1.202 CC(Oc1ccccc1Br)C(=O)N 7a_100000181306_100000702099 [0,1,0,0,0,0|2,0,1]=4 931 B13R1.202 CC(Oc1ccccc1Br)C(=O)[13CH3] 1458a_100000246065_200025704644 [0,1,0,0,0,0|1,0,1]=3 932 B13R1.202 CC(Oc1ccccc1Cl)C(=O)N 34a_100000210172_100000702099 [0,1,0,0,0,0|2,0,1]=4 933 B13R1.202 CC(Oc1ccccc1Cl)C(=O)N 7a_100000210172_100000702099 [0,1,0,0,0,0|2,0,1]=4 934 B13R1.202 CC(Oc1ccccc1Cl)C(=O)[13CH3] 1458a_100000191201_200025704644 [0,1,0,0,0,0|1,0,1]=3 935 B13R1.202 CC(Oc1ccccc1F)C(=O)N 34a_100000210171_100000702099 [0,1,0,0,0,0|2,0,1]=4 936 B13R1.202 CC(Oc1ccccc1F)C(=O)N 7a_100000210171_100000702099 [0,1,0,0,0,0|2,0,1]=4 937 B13R1.202 CC(Oc1ccccc1F)C(=O)[13CH3] 1458a_100000191191_200025704644 [0,1,0,0,0,0|1,0,1]=3 938 B13R1.202 CC(Oc1ccccc1I)C(=O)N 34a_100000739446_100000702099 [0,1,0,0,0,0|2,0,1]=4 939 B13R1.202 CC(Oc1ccccc1I)C(=O)N 7a_100000739446_100000702099 [0,1,0,0,0,0|2,0,1]=4 940 B13R1.202 CC(Oc1ccccc1N)C(=O)N 34a_100000185747_100000702099 [0,1,0,0,0,0|2,0,1]=4 941 B13R1.202 CC(Oc1ccccc1N)C(=O)N 7a_100000185747_100000702099 [0,1,0,0,0,0|2,0,1]=4 942 B13R1.202 CC(Oc1ccccc1O)C(=O)N 271570a_203496583355_100000148488 [0,1,0,0,0,0|2,0,1]=4 943 B13R1.202 CC(Sc1ccccc1Br)C(=O)N 62a_100000695589_100000702099 [0,1,0,0,0,0|2,0,1]=4 944 B13R1.202 CC(Sc1ccccc1Br)C(=O)N 62a_100000702099_100000695589 [0,1,0,0,0,0|2,0,1]=4 945 B13R1.202 CC(Sc1ccccc1Cl)C(=O)N 62a_100000702099_100000764095 [0,1,0,0,0,0|2,0,1]=4 946 B13R1.202 CC(Sc1ccccc1Cl)C(=O)N 62a_100000764095_100000702099 [0,1,0,0,0,0|2,0,1]=4 947 B13R1.202 CC(Sc1ccccc1Cl)C(=O)[13CH3] 1458a_100000181065_200025704644 [0,1,0,0,0,0|1,0,1]=3 948 B13R1.202 CC(Sc1ccccc1F)C(=O)N 62a_100000702099_100011215700 [0,1,0,0,0,0|2,0,1]=4 949 B13R1.202 CC(Sc1ccccc1F)C(=O)N 62a_100011215700_100000702099 [0,1,0,0,0,0|2,0,1]=4 950 B13R1.202 CC(Sc1ccccc1N)C(=O)N 62a_100000210017_100000702099 [0,1,0,0,0,0|2,0,1]=4 951 B13R1.202 CC(Sc1ccccc1N)C(=O)N 62a_100000702099_100000210017 [0,1,0,0,0,0|2,0,1]=4 952 B13R1.202 CC(Sc1ccccc1O)C(=O)N 62a_100000702099_100000739446 [0,1,0,0,0,0|2,0,1]=4 953 B13R1.202 CC(Sc1ccccc1O)C(=O)N 62a_100000739446_100000702099 [0,1,0,0,0,0|2,0,1]=4 954 B13R1.202 Cc1ccccc1NC(=O)C(=O)N 22a_100015192222_100011215815 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.202 Cc1ccccc1NC(=O)C(=O)[13CH3] 1458a_200011297352_200025704644 [0,1,0,0,0,0|2,0,0]=3 956 B13R1.202 Cc1ccccc1NC(C)C(=O)N 34a_100015192222_100000702099 [0,1,0,0,0,0|2,0,1]=4 957 B13R1.202 Cc1ccccc1OC(C)C(=O)N 34a_100000210338_100000702099 [0,1,0,0,0,0|2,0,1]=4 958 B13R1.202 Cc1ccccc1OC(C)C(=O)N 7a_100000210338_100000702099 [0,1,0,0,0,0|2,0,1]=4 959 B13R1.202 Cc1ccccc1OC(C)C(=O)[13CH3] 1458a_100000189243_200025704644 [0,1,0,0,0,0|1,0,1]=3 960 B13R1.202 Cc1ccccc1SC(C)C(=O)N 62a_100000210755_100000702099 [0,1,0,0,0,0|2,0,1]=4 961 B13R1.202 Cc1ccccc1SC(C)C(=O)N 62a_100000702099_100000210755 [0,1,0,0,0,0|2,0,1]=4 962 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl 22a_100000185783_100011215815 [0,1,0,0,0,0|3,0,0]=4 963 B13R1.202 NC(=O)C(=O)Nc1ccccc1F 22a_100000210422_100011215815 [0,1,0,0,0,0|3,0,0]=4 964 B13R1.202 NC(=O)C(=O)Nc1ccccc1O 22a_100000185747_100011215815 [0,1,0,0,0,0|3,0,0]=4 965 B13R1.202 [13CH3]C(=O)C(=O)Nc1ccccc1F 1458a_200011297310_200025704644 [0,1,0,0,0,0|2,0,0]=3 966 B13R1.202 [13CH3]C(=O)C(O)Cc1ccccc1Br 1458a_100012382637_200025704644 [0,1,0,0,0,0|1,0,2]=4 967 B13R1.202 [13CH3]C(=O)C(O)Cc1ccccc1Cl 1458a_100000703902_200025704644 [0,1,0,0,0,0|1,0,2]=4 968 B13R1.353 CN(Cc1ccccc1)S(=O)(=O)C 40a_100000186898_100000738038 [0,1,0,0,0,0|2,0,1]=4 969 B13R1.418 CC(=O)C(=Cc1ccccc1)C#N 1458a_100000162679_200000210301 [0,1,0,0,0,0|0,0,1]=2 970 B13R1.418 CC(=O)C(C#N)Cc1ccccc1 1458a_100000070787_100000183401 [0,1,0,0,0,0|0,0,3]=4 971 B13R1.418 CC(=O)C(C#N)Cc1ccccc1 1458a_100000075392_200000210301 [0,1,0,0,0,0|0,0,3]=4 972 B13R1.418 CCC(Nc1ccccc1)C(=O)N 34a_100000106764_100000750255 [0,1,0,0,0,0|2,0,1]=4 973 B13R1.418 CCC(Oc1ccccc1)C(=O)C 1458a_100000211556_200000210301 [0,1,0,0,0,0|1,0,1]=3 974 B13R1.418 CCC(Oc1ccccc1)C(=O)N 34a_100000210340_100000750255 [0,1,0,0,0,0|2,0,1]=4 975 B13R1.418 CCC(Oc1ccccc1)C(=O)N 7a_100000210340_100000750255 [0,1,0,0,0,0|2,0,1]=4 976 B13R1.418 CCC(Oc1ccccc1)C(=O)[13CH3] 1458a_100000211556_200025704644 [0,1,0,0,0,0|1,0,1]=3 977 B13R1.418 CCC(Sc1ccccc1)C(=O)C 1458a_100000230495_200000210301 [0,1,0,0,0,0|1,0,1]=3 978 B13R1.418 CCC(Sc1ccccc1)C(=O)N 62a_100000719477_100000750255 [0,1,0,0,0,0|2,0,1]=4 979 B13R1.418 CCC(Sc1ccccc1)C(=O)N 62a_100000750255_100000041952 [0,1,0,0,0,0|2,0,1]=4 980 B13R1.418 CCC(Sc1ccccc1)C(=O)[13CH3] 1458a_100000230495_200025704644 [0,1,0,0,0,0|1,0,1]=3 981 B13R1.418 CCN(Cc1ccccc1)C(=O)C 11a_100000186914_100015343762 [0,1,0,0,0,0|1,0,1]=3 982 B13R1.418 CCN(Cc1ccccc1)C(=O)C 1626a_100000186914_100015343762 [0,1,0,0,0,0|1,0,1]=3 983 B13R1.418 CCN(Cc1ccccc1)C(=O)C 240690a_100000186914_100015343762 [0,1,0,0,0,0|1,0,1]=3 984 B13R1.418 CCN(Cc1ccccc1)C(=O)C 527a_100000186914_100103153847 [0,1,0,0,0,0|1,0,1]=3 985 B13R1.418 CCN(Cc1ccccn1)C(=O)C 11a_100000201164_100015343762 [0,1,0,0,0,0|2,0,1]=4 986 B13R1.418 CCN(Cc1ccccn1)C(=O)C 1626a_100000201164_100015343762 [0,1,0,0,0,0|2,0,1]=4 987 B13R1.418 CCN(Cc1ccccn1)C(=O)C 240690a_100000201164_100015343762 [0,1,0,0,0,0|2,0,1]=4 988 B13R1.418 CCN(Cc1ccccn1)C(=O)C 527a_100000201164_100103153847 [0,1,0,0,0,0|2,0,1]=4 989 B13R1.418 CCN(Cc1cccnc1)C(=O)C 11a_100000186920_100015343762 [0,1,0,0,0,0|2,0,1]=4 990 B13R1.418 CCN(Cc1cccnc1)C(=O)C 1626a_100000186920_100015343762 [0,1,0,0,0,0|2,0,1]=4 991 B13R1.418 CCN(Cc1cccnc1)C(=O)C 240690a_100000186920_100015343762 [0,1,0,0,0,0|2,0,1]=4 992 B13R1.418 CCN(Cc1cccnc1)C(=O)C 527a_100000186920_100103153847 [0,1,0,0,0,0|2,0,1]=4 993 B13R1.418 CCN(Cc1ccncc1)C(=O)C 11a_100000186919_100015343762 [0,1,0,0,0,0|2,0,1]=4 994 B13R1.418 CCN(Cc1ccncc1)C(=O)C 1626a_100000186919_100015343762 [0,1,0,0,0,0|2,0,1]=4 995 B13R1.418 CCN(Cc1ccncc1)C(=O)C 240690a_100000186919_100015343762 [0,1,0,0,0,0|2,0,1]=4 996 B13R1.418 CNC(Cc1ccccc1)C(=O)N 2230a_100000745710_200000210301 [0,1,0,0,0,0|1,0,2]=4 997 B13R1.418 CNC(Cc1ccccc1)C(=O)N 34a_100000745710_200000210301 [0,1,0,0,0,0|1,0,2]=4 998 B13R1.418 [13CH3]C(=O)C(=Cc1ccccc1)C#N 1458a_100000162679_200025704644 [0,1,0,0,0,0|0,0,1]=2 999 B13R1.418 [13CH3]C(=O)C(C#N)Cc1ccccc1 1458a_100000075392_200025704644 [0,1,0,0,0,0|0,0,3]=4 1000 B13R1.418 [13CH3]NC(Cc1ccccc1)C(=O)N 2230a_100000745710_200025704644 [0,1,0,0,0,0|1,0,2]=4 1001 B13R1.418 [13CH3]NC(Cc1ccccc1)C(=O)N 34a_100000745710_200025704644 [0,1,0,0,0,0|1,0,2]=4 1002 B13R1.1073 CC(=O)C(C)(C)Cc1ccccc1 1458a_100000757416_200000210301 [0,1,0,0,0,0|0,0,2]=3 1003 B13R1.1073 CC(=O)C(C)(C)Oc1ccccc1 1458a_100000743201_200000210301 [0,1,0,0,0,0|1,0,1]=3 1004 B13R1.1073 CC(=O)C(C)(C)Oc1ccccc1 7a_100000210340_100000075568 [0,1,0,0,0,0|1,0,1]=3 1005 B13R1.1073 CC(=O)C(C)(C)Oc1cccnc1 7a_100000210849_100000075568 [0,1,0,0,0,0|2,0,1]=4 1006 B13R1.1073 CC(=O)C(C)(C)Sc1ccccc1 62a_100000075568_100000041952 [0,1,0,0,0,0|1,0,1]=3 1007 B13R1.1073 CC(=O)C(C)(C)Sc1ccccc1 62a_100000719477_100000075568 [0,1,0,0,0,0|1,0,1]=3 1008 B13R1.1073 CC(=O)C(C)(C)Sc1ccccn1 62a_100000075568_100011216584 [0,1,0,0,0,0|2,0,1]=4 1009 B13R1.1073 CC(=O)C(C)(C)Sc1ccccn1 62a_100011216584_100000075568 [0,1,0,0,0,0|2,0,1]=4 1010 B13R1.1073 CC(=O)C(C)(C)Sc1cccnc1 62a_100000075568_100000210063 [0,1,0,0,0,0|2,0,1]=4 1011 B13R1.1073 CC(=O)C(C)(C)Sc1cccnc1 62a_100000210063_100000075568 [0,1,0,0,0,0|2,0,1]=4 1012 B13R1.1073 CC(=O)C(C)(C)Sc1ccncc1 62a_100000075568_100000728582 [0,1,0,0,0,0|2,0,1]=4 1013 B13R1.1073 CC(=O)C(C)(C)Sc1ccncc1 62a_100000728582_100000075568 [0,1,0,0,0,0|2,0,1]=4 1014 B13R1.1073 CC(=O)C(F)(F)Oc1ccccc1 1458a_100000070787_200000057402 [0,1,0,0,0,0|2,0,1]=4 1015 B13R1.1073 CC(C)(Cc1ccccc1)C(=O)[13CH3] 1458a_100000757416_200025704644 [0,1,0,0,0,0|0,0,2]=3 1016 B13R1.1073 CC(C)(Nc1ccccc1)C(=O)N 34a_100000106764_100000702505 [0,1,0,0,0,0|2,0,1]=4 1017 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)N 34a_100000210340_100000702505 [0,1,0,0,0,0|2,0,1]=4 1018 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)N 7a_100000210340_100000702505 [0,1,0,0,0,0|2,0,1]=4 1019 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)[13CH3] 1458a_100000743201_200025704644 [0,1,0,0,0,0|1,0,1]=3 1020 B13R1.1073 CC(C)(Sc1ccccc1)C(=O)N 62a_100000702505_100000041952 [0,1,0,0,0,0|2,0,1]=4 1021 B13R1.1073 CC(C)(Sc1ccccc1)C(=O)N 62a_100000719477_100000702505 [0,1,0,0,0,0|2,0,1]=4 1022 B11R0.163 C=CC=CC(=O)CC(=O)C(=O)C 1458a_100016291481_100011261029 [0,0,1,0,0,0|2,0,1]=4 1023 B13R2.27 O=C1CCC1Nc2ccccc2 34a_100000106764_100009892977 [0,0,0,1,0,0|1,0,1]=3 1024 B13R2.27 O=C1CCC1Oc2ccccc2 34a_100000210340_100009892977 [0,0,0,1,0,0|1,0,1]=3 1025 B13R2.27 O=C1CCC1Oc2ccccc2 7a_100000210340_100009892977 [0,0,0,1,0,0|1,0,1]=3 1026 B13R2.27 O=C1CCC1Oc2cccnc2 34a_100000210849_100009892977 [0,0,0,1,0,0|2,0,1]=4 1027 B13R2.27 O=C1CCC1Oc2cccnc2 7a_100000210849_100009892977 [0,0,0,1,0,0|2,0,1]=4 1028 B13R2.27 O=C1CCC1Oc2ccncc2 34a_100000212176_100009892977 [0,0,0,1,0,0|2,0,1]=4 1029 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100000719477_100009892977 [0,0,0,1,0,0|1,0,1]=3 1030 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100009892977_100000041952 [0,0,0,1,0,0|1,0,1]=3 1031 B13R2.27 O=C1CCC1Sc2ccccn2 62a_100009892977_100011216584 [0,0,0,1,0,0|2,0,1]=4 1032 B13R2.27 O=C1CCC1Sc2ccccn2 62a_100011216584_100009892977 [0,0,0,1,0,0|2,0,1]=4 1033 B13R2.27 O=C1CCC1Sc2cccnc2 62a_100000210063_100009892977 [0,0,0,1,0,0|2,0,1]=4 1034 B13R2.27 O=C1CCC1Sc2cccnc2 62a_100009892977_100000210063 [0,0,0,1,0,0|2,0,1]=4 1035 B13R2.27 O=C1CCC1Sc2ccncc2 62a_100000728582_100009892977 [0,0,0,1,0,0|2,0,1]=4 1036 B13R2.27 O=C1CCC1Sc2ccncc2 62a_100009892977_100000728582 [0,0,0,1,0,0|2,0,1]=4 1037 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [0,0,0,1,0,0|1,0,1]=3 1038 B13R2.369 Cc1cc2cccnc2nc1O 271570a_203496583355_100009877248 [0,0,0,1,0,0|2,0,1]=4 1039 B13R2.369 Cc1cc2ncccc2cc1O 271570a_203496583355_100010137429 [0,0,0,1,0,0|1,0,2]=4 1040 B13R2.369 Cc1nc2ccccc2nc1O 271570a_203496583355_100000185947 [0,0,0,1,0,0|2,0,1]=4 1041 B13R2.369 Nc1cc2ccccc2cc1O 271570a_203496583355_100009991566 [0,0,0,1,0,0|1,0,2]=4 1042 B13R2.369 Nc1nc2ccccc2cc1O 271570a_203496583355_100010135404 [0,0,0,1,0,0|3,0,0]=4 1043 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [0,0,0,1,0,0|2,0,0]=3 1044 B13R2.369 Oc1cc2ccccc2cc1Br 271570a_203496583355_200010169544 [0,0,0,1,0,0|1,0,2]=4 1045 B13R2.369 Oc1cc2ccccc2cc1Cl 271570a_203496583355_100010152806 [0,0,0,1,0,0|1,0,2]=4 1046 B13R2.369 Oc1cc2ccccc2cc1O 271570a_203496583355_100009817189 [0,0,0,1,0,0|1,0,2]=4 1047 B13R2.369 Oc1cc2ccccc2nc1Cl 271570a_203496583355_100010220712 [0,0,0,1,0,0|3,0,0]=4 1048 B13R2.369 Oc1cc2ccccc2nc1F 271570a_203496583355_100011158909 [0,0,0,1,0,0|3,0,0]=4 1049 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200000100762 [0,0,0,1,0,0|2,0,1]=4 1050 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200009820883 [0,0,0,1,0,0|2,0,1]=4 1051 B13R2.369 Oc1nc2ccccc2cc1Br 271570a_203496583355_100010072790 [0,0,0,1,0,0|2,0,1]=4 1052 B13R2.423 CC(=O)C1CC1c2cccnc2 1458a_100000746292_200000210301 [0,0,0,1,0,0|1,0,2]=4 1053 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200000210301 [0,0,0,1,0,0|0,0,2]=3 1054 B13R2.423 [13CH3]C(=O)C1CC1c2cccnc2 1458a_100000746292_200025704644 [0,0,0,1,0,0|1,0,2]=4 1055 B13R2.423 [13CH3]C(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200025704644 [0,0,0,1,0,0|0,0,2]=3 1056 B13R2.435 C=C(C)c1cc2ccccc2[nH]1 271570a_100000694244_100010232065 [0,0,0,1,0,0|2,0,0]=3 1057 B13R2.435 C=C(C)c1cc2ccccc2o1 271570a_100000694244_100010159458 [0,0,0,1,0,0|2,0,0]=3 1058 B13R2.435 C=C(C)c1cc2ccccc2s1 271570a_100000694244_100009816949 [0,0,0,1,0,0|2,0,0]=3 1059 B13R2.435 C=C(C)c1cc2cccnc2[nH]1 271570a_100000694244_100010079843 [0,0,0,1,0,0|3,0,0]=4 1060 B13R2.435 C=C(C)c1cn2ccccc2n1 271570a_100000694244_100009819586 [0,0,0,1,0,0|3,0,0]=4 1061 B13R2.435 C=C(C)c1nc2ccccc2[nH]1 271570a_100000694244_100009814255 [0,0,0,1,0,0|3,0,0]=4 1062 B13R2.435 C=C(C)c1nc2ccccc2s1 271570a_100000694244_100000751744 [0,0,0,1,0,0|3,0,0]=4 1063 B13R2.435 CC(=O)C1=Cc2ccccc2C1 1458a_100009862756_200000210301 [0,0,0,1,0,0|0,0,0]=1 1064 B13R2.435 CC(=O)C1Cc2ccccc2C1 1458a_100000070787_100000753484 [0,0,0,1,0,0|0,0,2]=3 1065 B13R2.435 CC(=O)C1Cc2ccccc2C1 1458a_100000685393_200000210301 [0,0,0,1,0,0|0,0,2]=3 1066 B13R2.435 CC(=O)C1Cc2ccccc2O1 1458a_100000209886_200000210301 [0,0,0,1,0,0|1,0,1]=3 1067 B13R2.435 CC(=O)C1Cc2ccccc2S1 1458a_100000024912_200000210301 [0,0,0,1,0,0|1,0,1]=3 1068 B13R2.435 CC(=O)N1Cc2ccccc2C1 11a_100000752595_100015343762 [0,0,0,1,0,0|1,0,1]=3 1069 B13R2.435 CC(=O)N1Cc2ccccc2C1 1626a_100000752595_100015343762 [0,0,0,1,0,0|1,0,1]=3 1070 B13R2.435 CC(=O)N1Cc2ccccc2C1 240690a_100000752595_100015343762 [0,0,0,1,0,0|1,0,1]=3 1071 B13R2.435 CC(=O)N1Cc2ccccc2C1 527a_100000752595_100103153847 [0,0,0,1,0,0|1,0,1]=3 1072 B13R2.435 CC(=O)N1Cc2cccnc2C1 11a_100000726175_100015343762 [0,0,0,1,0,0|2,0,1]=4 1073 B13R2.435 CC(=O)N1Cc2cccnc2C1 1626a_100000726175_100015343762 [0,0,0,1,0,0|2,0,1]=4 1074 B13R2.435 CC(=O)N1Cc2cccnc2C1 240690a_100000726175_100015343762 [0,0,0,1,0,0|2,0,1]=4 1075 B13R2.435 CC(=O)N1Cc2cccnc2C1 527a_100000726175_100103153847 [0,0,0,1,0,0|2,0,1]=4 1076 B13R2.435 CC(=O)N1Cc2ccncc2C1 11a_100000730608_100015343762 [0,0,0,1,0,0|2,0,1]=4 1077 B13R2.435 CC(=O)N1Cc2ccncc2C1 1626a_100000730608_100015343762 [0,0,0,1,0,0|2,0,1]=4 1078 B13R2.435 CC(=O)N1Cc2ccncc2C1 240690a_100000730608_100015343762 [0,0,0,1,0,0|2,0,1]=4 1079 B13R2.435 CC(=O)N1Cc2ccncc2C1 527a_100000730608_100103153847 [0,0,0,1,0,0|2,0,1]=4 1080 B13R2.435 [13CH3]C(=O)C1=Cc2ccccc2C1 1458a_100009862756_200025704644 [0,0,0,1,0,0|0,0,0]=1 1081 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2C1 1458a_100000685393_200025704644 [0,0,0,1,0,0|0,0,2]=3 1082 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2O1 1458a_100000209886_200025704644 [0,0,0,1,0,0|1,0,1]=3 1083 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2S1 1458a_100000024912_200025704644 [0,0,0,1,0,0|1,0,1]=3 1084 B11R1.35 CC(=Cc1ccco1)C(=O)[13CH3] 1458a_100011995979_200025704644 [0,0,0,0,1,0|1,0,0]=2 1085 B11R1.35 CC(=O)C(=Cc1ccco1)C 1458a_100011995979_200000210301 [0,0,0,0,1,0|1,0,0]=2 1086 B11R1.35 CC(=O)C(C)Oc1ccsc1 7a_100000106738_100000179758 [0,0,0,0,1,0|2,0,1]=4 1087 B11R1.35 CC(=O)C(C)Sc1ccco1 62a_100009814033_100009814098 [0,0,0,0,1,0|2,0,1]=4 1088 B11R1.35 CC(=O)C(C)Sc1ccco1 62a_100009814098_100009814033 [0,0,0,0,1,0|2,0,1]=4 1089 B11R1.35 CC(=O)C(C)Sc1cccs1 62a_100009814033_100011215356 [0,0,0,0,1,0|2,0,1]=4 1090 B11R1.35 CC(=O)C(C)Sc1cccs1 62a_100011215356_100009814033 [0,0,0,0,1,0|2,0,1]=4 1091 B11R1.35 CC(=O)C(C)Sc1ccoc1 62a_100009814033_100011215275 [0,0,0,0,1,0|2,0,1]=4 1092 B11R1.35 CC(=O)C(C)Sc1ccoc1 62a_100011215275_100009814033 [0,0,0,0,1,0|2,0,1]=4 1093 B11R1.35 CC(=O)C(C)Sc1ccsc1 62a_100000738268_100009814033 [0,0,0,0,1,0|2,0,1]=4 1094 B11R1.35 CC(=O)C(C)Sc1ccsc1 62a_100009814033_100000738268 [0,0,0,0,1,0|2,0,1]=4 1095 B11R1.35 CC(=O)N(C)Cc1ccco1 11a_100000185268_100015343762 [0,0,0,0,1,0|2,0,1]=4 1096 B11R1.35 CC(=O)N(C)Cc1ccco1 240690a_100000185268_100015343762 [0,0,0,0,1,0|2,0,1]=4 1097 B11R1.35 CC(=O)N(C)Cc1ccco1 527a_100000185268_100103153847 [0,0,0,0,1,0|2,0,1]=4 1098 B11R1.35 CC(=O)N(C)Cc1cccs1 11a_100000184426_100015343762 [0,0,0,0,1,0|2,0,1]=4 1099 B11R1.35 CC(=O)N(C)Cc1cccs1 240690a_100000184426_100015343762 [0,0,0,0,1,0|2,0,1]=4 1100 B11R1.35 CC(=O)N(C)Cc1cccs1 527a_100000184426_100103153847 [0,0,0,0,1,0|2,0,1]=4 1101 B11R1.35 CC(=O)N(C)Cc1ccsc1 11a_100020654213_100015343762 [0,0,0,0,1,0|2,0,1]=4 1102 B11R1.35 CC(=O)N(C)Cc1ccsc1 240690a_100020654213_100015343762 [0,0,0,0,1,0|2,0,1]=4 1103 B11R1.35 CC(=O)N(C)Cc1ccsc1 527a_100020654213_100103153847 [0,0,0,0,1,0|2,0,1]=4 1104 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [0,0,0,0,1,0|0,0,1]=2 1105 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [0,0,0,0,1,0|0,0,1]=2 1106 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [0,0,0,0,1,0|1,0,0]=2 1107 B11R1.36 CC(=C(C)c1ccccn1)C 271570a_200000049429_100011216584 [0,0,0,0,1,0|2,0,0]=3 1108 B11R1.36 CC(=C(C)c1cccnc1)C 271570a_200000049429_100000752921 [0,0,0,0,1,0|2,0,0]=3 1109 B11R1.36 CC(=C(C)c1cccnn1)C 271570a_200000049429_100016991348 [0,0,0,0,1,0|3,0,0]=4 1110 B11R1.36 CC(=C(C)c1ccncc1)C 271570a_200000049429_100000035832 [0,0,0,0,1,0|2,0,0]=3 1111 B11R1.36 CC(=C(C)c1ccncn1)C 271570a_200000049429_100000703185 [0,0,0,0,1,0|3,0,0]=4 1112 B11R1.36 CC(=C(C)c1ccnnc1)C 271570a_200000049429_100000732662 [0,0,0,0,1,0|3,0,0]=4 1113 B11R1.36 CC(=C(C)c1cnccn1)C 271570a_200000049429_100000758340 [0,0,0,0,1,0|3,0,0]=4 1114 B11R1.36 CC(=C(C)c1cncnc1)C 271570a_200000049429_100011206942 [0,0,0,0,1,0|3,0,0]=4 1115 B11R1.36 CC(=C(C)c1ncccn1)C 271570a_200000049429_100000211032 [0,0,0,0,1,0|3,0,0]=4 1116 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [0,0,0,0,1,0|0,0,1]=2 1117 B11R1.36 CC(=O)C(C)c1ccccn1 1458a_100000722050_200000210301 [0,0,0,0,1,0|1,0,1]=3 1118 B11R1.36 CC(=O)C(C)c1cnccn1 1458a_100000070787_200000703233 [0,0,0,0,1,0|2,0,1]=4 1119 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [0,0,0,0,1,0|1,0,1]=3 1120 B11R1.36 CC(=O)N(C)c1ccccc1 11a_100000210012_100015343762 [0,0,0,0,1,0|1,0,0]=2 1121 B11R1.36 CC(=O)N(C)c1ccccc1 1626a_100000210012_100015343762 [0,0,0,0,1,0|1,0,0]=2 1122 B11R1.36 CC(=O)N(C)c1ccccc1 22a_100000210012_100000070787 [0,0,0,0,1,0|1,0,0]=2 1123 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [0,0,0,0,1,0|0,0,1]=2 1124 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [0,0,0,0,1,0|1,0,1]=3 1125 B11R1.36 CC(C(=O)[13CH3])c1ccccn1 1458a_100000722050_200025704644 [0,0,0,0,1,0|1,0,1]=3 1126 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [0,0,0,0,1,0|2,0,1]=4 1127 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210012_100000210206 [0,0,0,0,1,0|2,0,1]=4 1128 B11R1.36 CC(C)N(C)c1ccccc1 2230a_100000210572_200000210301 [0,0,0,0,1,0|2,0,1]=4 1129 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210012_100000210206 [0,0,0,0,1,0|2,0,1]=4 1130 B11R1.36 CC(C)N(C)c1ccccc1 269982a_100000210572_200000210301 [0,0,0,0,1,0|2,0,1]=4 1131 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210012_100000210206 [0,0,0,0,1,0|2,0,1]=4 1132 B11R1.36 CC(C)N(C)c1ccccc1 34a_100000210572_200000210301 [0,0,0,0,1,0|2,0,1]=4 1133 B11R1.36 CC(C)N(C)c1ccccc1 7a_100000210572_200000210301 [0,0,0,0,1,0|2,0,1]=4 1134 B11R1.36 CC(C)N([13CH3])c1ccccc1 2230a_100000210572_200025704644 [0,0,0,0,1,0|2,0,1]=4 1135 B11R1.36 CC(C)N([13CH3])c1ccccc1 269982a_100000210572_200025704644 [0,0,0,0,1,0|2,0,1]=4 1136 B11R1.36 CC(C)N([13CH3])c1ccccc1 34a_100000210572_200025704644 [0,0,0,0,1,0|2,0,1]=4 1137 B11R1.36 CC(C)N([13CH3])c1ccccc1 7a_100000210572_200025704644 [0,0,0,0,1,0|2,0,1]=4 1138 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100000195388_200000210301 [0,0,0,0,1,0|2,0,1]=4 1139 B11R1.36 CC(c1ccccc1)N(C)C 2230a_100102631434_100000230085 [0,0,0,0,1,0|2,0,1]=4 1140 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100000195388_200000210301 [0,0,0,0,1,0|2,0,1]=4 1141 B11R1.36 CC(c1ccccc1)N(C)C 269982a_100102631434_100000230085 [0,0,0,0,1,0|2,0,1]=4 1142 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 2230a_100000195388_200025704644 [0,0,0,0,1,0|2,0,1]=4 1143 B11R1.36 CC(c1ccccc1)N(C)[13CH3] 269982a_100000195388_200025704644 [0,0,0,0,1,0|2,0,1]=4 1144 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [0,0,0,0,1,0|3,0,0]=4 1145 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [0,0,0,0,1,0|3,0,0]=4 1146 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [0,0,0,0,1,0|3,0,0]=4 1147 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [0,0,0,0,1,0|3,0,0]=4 1148 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [0,0,0,0,1,0|0,0,1]=2 1149 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [0,0,0,0,1,0|1,0,1]=3 1150 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [0,0,0,0,1,0|1,0,1]=3 1151 B13R1.348 C=C(C)CN(C)Cc1ccccc1 2230a_100000186898_100000748629 [0,0,0,0,0,1|2,0,1]=4 1152 B13R1.348 C=C(C)CN(C)Cc1ccccc1 2230a_100000225649_100015291786 [0,0,0,0,0,1|2,0,1]=4 1153 B13R1.348 C=C(C)CN(C)Cc1ccccc1 2230a_100015184565_200000210301 [0,0,0,0,0,1|2,0,1]=4 1154 B13R1.348 C=C(C)CN(C)Cc1ccccc1 269982a_100000186898_100000748629 [0,0,0,0,0,1|2,0,1]=4 1155 B13R1.348 C=C(C)CN(C)Cc1ccccc1 269982a_100000225649_100000211182 [0,0,0,0,0,1|2,0,1]=4 1156 B13R1.348 C=C(C)CN(C)Cc1ccccc1 269982a_100015184565_200000210301 [0,0,0,0,0,1|2,0,1]=4 1157 B13R1.348 C=C(C)CN(C)Cc1ccccc1 270004a_100000225649_100015611070 [0,0,0,0,0,1|2,0,1]=4 1158 B13R1.348 C=C(C)CN([13CH3])Cc1ccccc1 2230a_100015184565_200025704644 [0,0,0,0,0,1|2,0,1]=4 1159 B13R1.348 C=C(C)CN([13CH3])Cc1ccccc1 269982a_100015184565_200025704644 [0,0,0,0,0,1|2,0,1]=4 1160 B13R1.348 CC(=CC(=O)Cc1ccccc1)C 1458a_100000211388_100015291786 [0,0,0,0,0,1|2,0,1]=4 1161 B13R1.348 CC(=CC(=O)Cc1ccccc1)Cl 1458a_200042562850_100015291786 [0,0,0,0,0,1|2,0,1]=4 1162 B13R1.348 CC(=CC(=O)Cc1ccccc1)I 1458a_100025716642_100015291786 [0,0,0,0,0,1|2,0,1]=4 1163 B13R1.348 CC(=CC(=O)Nc1ccccc1)C 11a_100000106764_100000211388 [0,0,0,0,0,1|3,0,0]=4 1164 B13R1.348 CC(=CC(=O)Nc1ccccc1)C 1626a_100000106764_100000211388 [0,0,0,0,0,1|3,0,0]=4 1165 B13R1.348 CC(=CC(=O)Nc1ccccc1)C 22a_100000106764_100000211388 [0,0,0,0,0,1|3,0,0]=4 1166 B13R1.348 CC(=CC(=O)Nc1ccccc1)Cl 11a_100000106764_200042562850 [0,0,0,0,0,1|3,0,0]=4 1167 B13R1.348 CC(=CC(=O)Nc1ccccc1)Cl 1626a_100000106764_200042562850 [0,0,0,0,0,1|3,0,0]=4 1168 B13R1.348 CC(=CC(=O)Nc1ccccc1)Cl 22a_100000106764_200042562850 [0,0,0,0,0,1|3,0,0]=4 1169 B13R1.348 CC(=CC(=O)Nc1ccccc1)I 11a_100000106764_100025716642 [0,0,0,0,0,1|3,0,0]=4 1170 B13R1.348 CC(=CC(=O)Nc1ccccc1)I 1626a_100000106764_100025716642 [0,0,0,0,0,1|3,0,0]=4 1171 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 1458a_100000070787_100000233483 [0,0,0,0,0,1|1,0,1]=3 1172 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 1458a_100000070787_100000182850 [0,0,0,0,0,1|2,0,0]=3 1173 B13R1.348 CC(=O)CC(=O)Nc1ccccn1 1458a_100000070787_100020662008 [0,0,0,0,0,1|3,0,0]=4 1174 B13R1.348 CC(=O)CC(=O)Nc1ccncc1 1458a_100000070787_100000754145 [0,0,0,0,0,1|3,0,0]=4 1175 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 1458a_100000070787_100009813826 [0,0,0,0,0,1|2,0,0]=3 1176 B13R1.348 CC(=O)CN(C)Cc1ccccc1 1458a_100000745601_200000210301 [0,0,0,0,0,1|1,0,1]=3 1177 B13R1.348 CC(=O)CN(C)Cc1ccccn1 1458a_100015184508_200000210301 [0,0,0,0,0,1|2,0,1]=4 1178 B13R1.348 CC(=O)NC(C)Cc1ccccn1 11a_100000238496_100015343762 [0,0,0,0,0,1|1,0,2]=4 1179 B13R1.348 CC(=O)NC(C)Cc1ccccn1 1626a_100000238496_100015343762 [0,0,0,0,0,1|1,0,2]=4 1180 B13R1.348 CC(=O)NC(C)Cc1ccccn1 240690a_100000238496_100015343762 [0,0,0,0,0,1|1,0,2]=4 1181 B13R1.348 CC(=O)NC(C)Cc1ccccn1 527a_100000238496_100103153847 [0,0,0,0,0,1|1,0,2]=4 1182 B13R1.348 CC(=O)NC(C)Cc1cccnc1 11a_100011207255_100015343762 [0,0,0,0,0,1|1,0,2]=4 1183 B13R1.348 CC(=O)NC(C)Cc1cccnc1 1626a_100011207255_100015343762 [0,0,0,0,0,1|1,0,2]=4 1184 B13R1.348 CC(=O)NC(C)Cc1cccnc1 240690a_100011207255_100015343762 [0,0,0,0,0,1|1,0,2]=4 1185 B13R1.348 CC(=O)NC(C)Cc1cccnc1 527a_100011207255_100103153847 [0,0,0,0,0,1|1,0,2]=4 1186 B13R1.348 CC(=O)OC(C)Sc1ccccc1 62a_100000719477_100009818208 [0,0,0,0,0,1|1,0,1]=3 1187 B13R1.348 CC(=O)OC(C)Sc1ccccc1 62a_100009818208_100000041952 [0,0,0,0,0,1|1,0,1]=3 1188 B13R1.348 CC(=O)OC(C)Sc1ccccn1 62a_100009818208_100011216584 [0,0,0,0,0,1|2,0,1]=4 1189 B13R1.348 CC(=O)OC(C)Sc1ccccn1 62a_100011216584_100009818208 [0,0,0,0,0,1|2,0,1]=4 1190 B13R1.348 CC(=O)OC(C)Sc1cccnc1 62a_100000210063_100009818208 [0,0,0,0,0,1|2,0,1]=4 1191 B13R1.348 CC(=O)OC(C)Sc1cccnc1 62a_100009818208_100000210063 [0,0,0,0,0,1|2,0,1]=4 1192 B13R1.348 CC(=O)OC(C)Sc1ccncc1 62a_100000728582_100009818208 [0,0,0,0,0,1|2,0,1]=4 1193 B13R1.348 CC(=O)OC(C)Sc1ccncc1 62a_100009818208_100000728582 [0,0,0,0,0,1|2,0,1]=4 1194 B13R1.348 CN(CC(=O)N)Cc1ccccc1 2230a_100000186898_100000747473 [0,0,0,0,0,1|2,0,1]=4 1195 B13R1.348 CN(CC(=O)N)Cc1ccccc1 2230a_100000739694_100015291786 [0,0,0,0,0,1|2,0,1]=4 1196 B13R1.348 CN(CC(=O)N)Cc1ccccc1 269982a_100000186898_100000187820 [0,0,0,0,0,1|2,0,1]=4 1197 B13R1.348 CN(CC(=O)N)Cc1ccccc1 270004a_100000739694_100015611070 [0,0,0,0,0,1|2,0,1]=4 1198 B13R1.348 CN(CC(=O)O)Cc1ccccc1 269956a_100000745947_200000210301 [0,0,0,0,0,1|2,0,1]=4 1199 B13R1.348 CN(CC(=O)O)Cc1ccccc1 269956a_100000746989_100015291786 [0,0,0,0,0,1|2,0,1]=4 1200 B13R1.348 CN(CC(=O)[13CH3])Cc1ccccc1 1458a_100000745601_200025704644 [0,0,0,0,0,1|1,0,1]=3 1201 B13R1.348 CN(CC(=O)[13CH3])Cc1ccccn1 1458a_100015184508_200025704644 [0,0,0,0,0,1|2,0,1]=4 1202 B13R1.348 CN(CC(=O)[O-])Cc1ccccc1 269982a_100000186898_100020667443 [0,0,0,0,0,1|2,0,1]=4 1203 B13R1.348 NC(=O)CC(=O)Cc1ccccc1 1458a_100134613110_100015291786 [0,0,0,0,0,1|2,0,1]=4 1204 B13R1.348 NC(=O)CC(=O)Nc1ccccc1 22a_100000106764_100134613110 [0,0,0,0,0,1|3,0,0]=4 1205 B13R1.348 NC(=O)CC(=O)Nc1ccccc1 527a_100000106764_100134613110 [0,0,0,0,0,1|3,0,0]=4 1206 B13R1.348 [13CH3]N(CC(=O)O)Cc1ccccc1 269956a_100000745947_200025704644 [0,0,0,0,0,1|2,0,1]=4 1207 B13R1.351 C=C(C)C(=NNc1ccccc1)C 4a_100015195140_100011216138 [0,0,0,0,0,1|2,0,0]=3 1208 B13R1.351 C=C(C)C(=NNc1ccccn1)C 4a_100000183288_100011216138 [0,0,0,0,0,1|3,0,0]=4 1209 B13R1.351 C=C(C)C(=NNc1cccnc1)C 4a_100000728903_100011216138 [0,0,0,0,0,1|3,0,0]=4 1210 B13R1.351 C=C(C)C(=NNc1ccncc1)C 4a_100000698918_100011216138 [0,0,0,0,0,1|3,0,0]=4 1211 B13R1.351 C=C(C)C(=O)CCc1ccccc1 1458a_100000185857_100000765856 [0,0,0,0,0,1|2,0,1]=4 1212 B13R1.351 C=C(C)C(=O)NCc1ccccc1 11a_100015324214_100000185857 [0,0,0,0,0,1|2,0,1]=4 1213 B13R1.351 C=C(C)C(=O)NCc1ccccc1 1626a_100015324214_100000185857 [0,0,0,0,0,1|2,0,1]=4 1214 B13R1.351 C=C(C)C(=O)NNc1ccccc1 22a_100015195140_100000185857 [0,0,0,0,0,1|3,0,0]=4 1215 B13R1.351 C=C(C)C(C)NCc1ccccc1 269862a_100015324214_100011216138 [0,0,0,0,0,1|1,0,2]=4 1216 B13R1.351 CC(=NNc1ccccc1)C(C)C 4a_100015195140_100000211110 [0,0,0,0,0,1|2,0,1]=4 1217 B13R1.351 CC(=NNc1ccccc1)C(C)O 4a_100015195140_100000212229 [0,0,0,0,0,1|1,0,2]=4 1218 B13R1.351 CC(=O)C(=O)CNc1ccccc1 34a_100000106764_100011261029 [0,0,0,0,0,1|1,0,1]=3 1219 B13R1.351 CC(=O)C(=O)COc1ccccc1 34a_100000210340_100011261029 [0,0,0,0,0,1|1,0,1]=3 1220 B13R1.351 CC(=O)C(=O)COc1cccnc1 34a_100000210849_100011261029 [0,0,0,0,0,1|2,0,1]=4 1221 B13R1.351 CC(=O)C(=O)COc1ccncc1 34a_100000212176_100011261029 [0,0,0,0,0,1|2,0,1]=4 1222 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100000719477_100011261029 [0,0,0,0,0,1|1,0,1]=3 1223 B13R1.351 CC(=O)C(=O)CSc1ccccc1 62a_100011261029_100000041952 [0,0,0,0,0,1|1,0,1]=3 1224 B13R1.351 CC(=O)C(=O)CSc1ccccn1 62a_100011216584_100011261029 [0,0,0,0,0,1|2,0,1]=4 1225 B13R1.351 CC(=O)C(=O)CSc1ccccn1 62a_100011261029_100011216584 [0,0,0,0,0,1|2,0,1]=4 1226 B13R1.351 CC(=O)C(=O)CSc1cccnc1 62a_100000210063_100011261029 [0,0,0,0,0,1|2,0,1]=4 1227 B13R1.351 CC(=O)C(=O)CSc1cccnc1 62a_100011261029_100000210063 [0,0,0,0,0,1|2,0,1]=4 1228 B13R1.351 CC(=O)C(=O)CSc1ccncc1 62a_100000728582_100011261029 [0,0,0,0,0,1|2,0,1]=4 1229 B13R1.351 CC(=O)C(=O)CSc1ccncc1 62a_100011261029_100000728582 [0,0,0,0,0,1|2,0,1]=4 1230 B13R1.351 CC(=O)C(C)CCc1ccccc1 1458a_100011435293_200000210301 [0,0,0,0,0,1|0,0,2]=3 1231 B13R1.351 CC(=O)C(C)NCc1ccccc1 2230a_100015324214_100009814033 [0,0,0,0,0,1|0,0,2]=3 1232 B13R1.351 CC(=O)C(C)OCc1ccccc1 34a_100000212229_100015291786 [0,0,0,0,0,1|0,0,2]=3 1233 B13R1.351 CC(=O)C(C)OCc1ccccc1 7a_100000210790_100000179758 [0,0,0,0,0,1|0,0,2]=3 1234 B13R1.351 CC(=O)C(C)OCc1ccccn1 34a_100000212229_100000721315 [0,0,0,0,0,1|1,0,2]=4 1235 B13R1.351 CC(=O)C(C)OCc1cccnc1 34a_100000212229_100000733263 [0,0,0,0,0,1|1,0,2]=4 1236 B13R1.351 CC(=O)C(C)SCc1ccccc1 1458a_100000149570_200000210301 [0,0,0,0,0,1|0,0,2]=3 1237 B13R1.351 CC(=O)C(C)SCc1ccccc1 62a_100000211182_100009814033 [0,0,0,0,0,1|0,0,2]=3 1238 B13R1.351 CC(=O)C(C)SCc1ccccc1 62a_100009814033_100015291786 [0,0,0,0,0,1|0,0,2]=3 1239 B13R1.351 CC(=O)C(C)SCc1ccccn1 62a_100000721315_100009814033 [0,0,0,0,0,1|1,0,2]=4 1240 B13R1.351 CC(=O)C(C)SCc1ccccn1 62a_100009814033_100000721315 [0,0,0,0,0,1|1,0,2]=4 1241 B13R1.351 CC(=O)C(C)SCc1cccnc1 62a_100000741622_100009814033 [0,0,0,0,0,1|1,0,2]=4 1242 B13R1.351 CC(=O)C(C)SCc1cccnc1 62a_100009814033_100000741622 [0,0,0,0,0,1|1,0,2]=4 1243 B13R1.351 CC(=O)C(C)SCc1ccncc1 62a_100009814033_100015193705 [0,0,0,0,0,1|1,0,2]=4 1244 B13R1.351 CC(=O)C(C)SCc1ccncc1 62a_100015193705_100009814033 [0,0,0,0,0,1|1,0,2]=4 1245 B13R1.351 CC(=O)C(O)CCc1ccccc1 1458a_100000242596_200000210301 [0,0,0,0,0,1|1,0,2]=4 1246 B13R1.351 CC(=O)N(C)CCc1ccccc1 11a_100000207497_100015343762 [0,0,0,0,0,1|1,0,1]=3 1247 B13R1.351 CC(=O)N(C)CCc1ccccc1 1626a_100000207497_100015343762 [0,0,0,0,0,1|1,0,1]=3 1248 B13R1.351 CC(=O)N(C)CCc1ccccc1 240690a_100000207497_100015343762 [0,0,0,0,0,1|1,0,1]=3 1249 B13R1.351 CC(=O)N(C)CCc1ccccc1 527a_100000207497_100103153847 [0,0,0,0,0,1|1,0,1]=3 1250 B13R1.351 CC(=O)N(C)CCc1ccccn1 11a_100000737206_100015343762 [0,0,0,0,0,1|2,0,1]=4 1251 B13R1.351 CC(=O)N(C)CCc1ccccn1 1626a_100000737206_100015343762 [0,0,0,0,0,1|2,0,1]=4 1252 B13R1.351 CC(=O)N(C)CCc1ccccn1 240690a_100000737206_100015343762 [0,0,0,0,0,1|2,0,1]=4 1253 B13R1.351 CC(=O)N(C)CCc1ccccn1 527a_100000737206_100103153847 [0,0,0,0,0,1|2,0,1]=4 1254 B13R1.351 CC(=O)N(C)CCc1cccnc1 11a_100000763209_100015343762 [0,0,0,0,0,1|2,0,1]=4 1255 B13R1.351 CC(=O)N(C)CCc1cccnc1 1626a_100000763209_100015343762 [0,0,0,0,0,1|2,0,1]=4 1256 B13R1.351 CC(=O)N(C)CCc1cccnc1 240690a_100000763209_100015343762 [0,0,0,0,0,1|2,0,1]=4 1257 B13R1.351 CC(=O)N(C)CCc1cccnc1 527a_100000763209_100103153847 [0,0,0,0,0,1|2,0,1]=4 1258 B13R1.351 CC(=O)N(C)CCc1ccncc1 11a_100000742850_100015343762 [0,0,0,0,0,1|2,0,1]=4 1259 B13R1.351 CC(=O)N(C)CCc1ccncc1 240690a_100000742850_100015343762 [0,0,0,0,0,1|2,0,1]=4 1260 B13R1.351 CC(=O)N(C)CCc1ccncc1 527a_100000742850_100103153847 [0,0,0,0,0,1|2,0,1]=4 1261 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 1458a_100000703211_200000210301 [0,0,0,0,0,1|0,0,2]=3 1262 B13R1.351 CC(C)C(=O)C=Cc1ccccc1 1458a_100000210462_100000210206 [0,0,0,0,0,1|2,0,1]=4 1263 B13R1.351 CC(CCc1ccccc1)C(=O)[13CH3] 1458a_100011435293_200025704644 [0,0,0,0,0,1|0,0,2]=3 1264 B13R1.351 CC(NCc1ccccc1)C(=O)N 2230a_100015324214_100000702099 [0,0,0,0,0,1|1,0,2]=4 1265 B13R1.351 CC(NCc1ccccc1)C(=O)N 34a_100015324214_100000702099 [0,0,0,0,0,1|1,0,2]=4 1266 B13R1.351 CC(OCc1ccccc1)C(=O)N 34a_100000210790_100000702099 [0,0,0,0,0,1|1,0,2]=4 1267 B13R1.351 CC(OCc1ccccc1)C(=O)N 7a_100000210790_100000702099 [0,0,0,0,0,1|1,0,2]=4 1268 B13R1.351 CC(SCc1ccccc1)C(=O)N 62a_100000211182_100000702099 [0,0,0,0,0,1|1,0,2]=4 1269 B13R1.351 CC(SCc1ccccc1)C(=O)N 62a_100000702099_100015291786 [0,0,0,0,0,1|1,0,2]=4 1270 B13R1.351 CC(SCc1ccccc1)C(=O)[13CH3] 1458a_100000149570_200025704644 [0,0,0,0,0,1|0,0,2]=3 1271 B13R1.351 CN(C)C(=O)C=Cc1ccccc1 11a_100102631434_100000210462 [0,0,0,0,0,1|3,0,0]=4 1272 B13R1.351 CN(C)C(=O)C=Cc1ccccc1 1626a_100102631434_100000210462 [0,0,0,0,0,1|3,0,0]=4 1273 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)N 2230a_100000119354_100015291786 [0,0,0,0,0,1|1,0,2]=4 1274 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)N 270004a_100000119354_100015611070 [0,0,0,0,0,1|1,0,2]=4 1275 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)N 34a_100000119354_100015291786 [0,0,0,0,0,1|1,0,2]=4 1276 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)N 34a_100000731257_100015291786 [0,0,0,0,0,1|1,0,2]=4 1277 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)N 7a_100000731257_100000211182 [0,0,0,0,0,1|1,0,2]=4 1278 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O 269956a_100000743915_100015291786 [0,0,0,0,0,1|1,0,2]=4 1279 B13R1.351 C[C@H](OCc1ccccc1)C(=O)[13CH3] 1458a_100000703211_200025704644 [0,0,0,0,0,1|0,0,2]=3 1280 B13R1.351 C[C@H](OCc1ccccc1)C(=O)[O-] 7a_217856618621_100000211182 [0,0,0,0,0,1|1,0,2]=4 1281 B13R1.351 NC(=O)C(=O)NCc1ccccc1 240690a_100015324214_100011215815 [0,0,0,0,0,1|2,0,1]=4 1282 B13R1.351 NC(=O)C(=O)NNc1ccccc1 22a_100015195140_100011215815 [0,0,0,0,0,1|3,0,0]=4 1283 B13R1.351 [13CH3]C(=O)C(O)CCc1ccccc1 1458a_100000242596_200025704644 [0,0,0,0,0,1|1,0,2]=4 1284 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [2,0,0,0,0,0|2,0,0]=4 1285 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [2,0,0,0,0,0|1,0,1]=4 1286 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [2,0,0,0,0,0|1,0,1]=4 1287 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [2,0,0,0,0,0|1,0,1]=4 1288 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [2,0,0,0,0,0|1,0,1]=4 1289 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [2,0,0,0,0,0|1,0,1]=4 1290 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [2,0,0,0,0,0|0,0,0]=2 1291 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [2,0,0,0,0,0|1,0,0]=3 1292 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [2,0,0,0,0,0|1,0,0]=3 1293 B10R1.18 CC(=Cc1cccnn1)C 271570a_100102525489_100016991348 [2,0,0,0,0,0|2,0,0]=4 1294 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [2,0,0,0,0,0|1,0,0]=3 1295 B10R1.18 CC(=Cc1ccncn1)C 271570a_100102525489_100000703185 [2,0,0,0,0,0|2,0,0]=4 1296 B10R1.18 CC(=Cc1ccnnc1)C 271570a_100102525489_100000732662 [2,0,0,0,0,0|2,0,0]=4 1297 B10R1.18 CC(=Cc1cnccn1)C 271570a_100102525489_100000758340 [2,0,0,0,0,0|2,0,0]=4 1298 B10R1.18 CC(=Cc1cncnc1)C 271570a_100102525489_100011206942 [2,0,0,0,0,0|2,0,0]=4 1299 B10R1.18 CC(=Cc1ncccn1)C 271570a_100102525489_100000211032 [2,0,0,0,0,0|2,0,0]=4 1300 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [2,0,0,0,0,0|1,0,1]=4 1301 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [2,0,0,0,0,0|0,0,1]=3 1302 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [2,0,0,0,0,0|1,0,1]=4 1303 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [2,0,0,0,0,0|1,0,1]=4 1304 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [2,0,0,0,0,0|1,0,1]=4 1305 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [2,0,0,0,0,0|1,0,1]=4 1306 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [2,0,0,0,0,0|1,0,1]=4 1307 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [2,0,0,0,0,0|1,0,0]=3 1308 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [2,0,0,0,0,0|1,0,0]=3 1309 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [2,0,0,0,0,0|1,0,0]=3 1310 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [2,0,0,0,0,0|1,0,0]=3 1311 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [2,0,0,0,0,0|1,0,1]=4 1312 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [2,0,0,0,0,0|1,0,1]=4 1313 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [2,0,0,0,0,0|1,0,1]=4 1314 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [2,0,0,0,0,0|1,0,1]=4 1315 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [2,0,0,0,0,0|1,0,1]=4 1316 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [2,0,0,0,0,0|1,0,1]=4 1317 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [2,0,0,0,0,0|1,0,1]=4 1318 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [2,0,0,0,0,0|1,0,1]=4 1319 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [2,0,0,0,0,0|1,0,1]=4 1320 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [2,0,0,0,0,0|1,0,1]=4 1321 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [2,0,0,0,0,0|1,0,1]=4 1322 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [2,0,0,0,0,0|1,0,1]=4 1323 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [2,0,0,0,0,0|1,0,1]=4 1324 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [2,0,0,0,0,0|1,0,1]=4 1325 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [2,0,0,0,0,0|1,0,1]=4 1326 B12R1.32 C/C(=C\c1ccccc1)/CO[13CH3] 34a_200025717232_200025704644 [1,1,0,0,0,0|0,0,1]=3 1327 B12R1.32 C/C(=C\c1ccccc1)/CO[13CH3] 7a_200025717232_200025704644 [1,1,0,0,0,0|0,0,1]=3 1328 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [1,1,0,0,0,0|1,0,1]=4 1329 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [1,1,0,0,0,0|2,0,0]=4 1330 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [1,1,0,0,0,0|2,0,0]=4 1331 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [1,1,0,0,0,0|2,0,0]=4 1332 B12R1.32 CN(CC=O)Cc1ccccc1 2230a_100000186898_200015260668 [1,1,0,0,0,0|1,0,1]=4 1333 B12R1.32 CN(CC=O)Cc1ccccc1 269982a_100000186898_200015260668 [1,1,0,0,0,0|1,0,1]=4 1334 B12R1.32 COC/C(=C/c1ccccc1)/C 34a_200025717232_200000210301 [1,1,0,0,0,0|0,0,1]=3 1335 B12R1.32 COC/C(=C/c1ccccc1)/C 7a_200025717232_200000210301 [1,1,0,0,0,0|0,0,1]=3 1336 B12R1.34 C=C(C(=O)CC)c1ccccc1 1458a_100000065200_100000210202 [1,1,0,0,0,0|1,0,1]=4 1337 B12R1.34 C=C(C(=O)NC)c1ccccc1 1626a_100102657272_100000065200 [1,1,0,0,0,0|2,0,0]=4 1338 B12R1.34 CC(S[13CH3])C(=O)c1ccccc1 62a_100000239700_200025704644 [1,1,0,0,0,0|1,0,1]=4 1339 B12R1.34 CC(S[13CH3])C(=O)c1ccccc1 62a_200025704644_100000239700 [1,1,0,0,0,0|1,0,1]=4 1340 B12R1.34 CCC(C)C(=O)c1ccccc1 1458a_100000185807_100000758301 [1,1,0,0,0,0|0,0,2]=4 1341 B12R1.34 CCN(C)C(=O)c1ccccc1 11a_100000225621_100000185807 [1,1,0,0,0,0|1,0,1]=4 1342 B12R1.34 CCN(C)C(=O)c1ccccc1 1626a_100000225621_100000185807 [1,1,0,0,0,0|1,0,1]=4 1343 B12R1.34 CCN(C)C(=O)c1ccccc1 240690a_100000225621_100000185807 [1,1,0,0,0,0|1,0,1]=4 1344 B12R1.34 CCN(C)C(=O)c1ccccc1 527a_100000225621_100000185807 [1,1,0,0,0,0|1,0,1]=4 1345 B12R1.34 CNC(C)C(=O)c1ccccc1 2230a_106832991635_100000239700 [1,1,0,0,0,0|1,0,1]=4 1346 B12R1.34 CNC(C)C(=O)c1ccccc1 7a_106832991635_100000239700 [1,1,0,0,0,0|1,0,1]=4 1347 B12R1.34 CSC(C)C(=O)c1ccccc1 62a_100000239700_200000210301 [1,1,0,0,0,0|1,0,1]=4 1348 B12R1.34 CSC(C)C(=O)c1ccccc1 62a_200000210301_100000239700 [1,1,0,0,0,0|1,0,1]=4 1349 B12R1.49 CC(=Cc1ccc(cc1)Br)C#N 6a_100000186029_200000212204 [1,1,0,0,0,0|1,0,1]=4 1350 B12R1.49 CC(=Cc1ccc(cc1)F)C#N 6a_100000210084_200000212204 [1,1,0,0,0,0|1,0,1]=4 1351 B12R1.49 CC(=Cc1ccc(cc1)I)C#N 6a_100000188517_200000212204 [1,1,0,0,0,0|1,0,1]=4 1352 B12R1.50 CC(=Cc1cccc(c1)Br)C#N 6a_100000210085_200000212204 [1,1,0,0,0,0|1,0,1]=4 1353 B12R1.50 CC(=Cc1cccc(c1)F)C#N 6a_100000210812_200000212204 [1,1,0,0,0,0|1,0,1]=4 1354 B12R1.50 CC(=Cc1cccc(c1)I)C#N 6a_100000014684_200000212204 [1,1,0,0,0,0|1,0,1]=4 1355 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [1,1,0,0,0,0|0,0,0]=2 1356 B12R1.21 CC(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200000210301 [1,1,0,0,0,0|0,0,2]=4 1357 B12R1.21 CC(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200000210301 [1,1,0,0,0,0|0,0,2]=4 1358 B12R1.21 CC(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200000210301 [1,1,0,0,0,0|0,0,2]=4 1359 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [1,1,0,0,0,0|0,0,0]=2 1360 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [1,1,0,0,0,0|0,0,0]=2 1361 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [1,1,0,0,0,0|0,0,0]=2 1362 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [1,1,0,0,0,0|0,0,0]=2 1363 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [1,1,0,0,0,0|0,0,0]=2 1364 B12R1.21 CC(=O)C=Cc1ccc(cn1)F 1458a_100020630499_200000210301 [1,1,0,0,0,0|1,0,0]=3 1365 B12R1.21 CC(=O)C=Cc1ccc(nc1)Br 1458a_100020588214_200000210301 [1,1,0,0,0,0|1,0,0]=3 1366 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [1,1,0,0,0,0|0,0,2]=4 1367 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [1,1,0,0,0,0|0,0,2]=4 1368 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [1,1,0,0,0,0|0,0,2]=4 1369 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [1,1,0,0,0,0|0,0,2]=4 1370 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [1,1,0,0,0,0|0,0,2]=4 1371 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [1,1,0,0,0,0|0,0,2]=4 1372 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [1,1,0,0,0,0|0,0,2]=4 1373 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [1,1,0,0,0,0|0,0,2]=4 1374 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [1,1,0,0,0,0|0,0,2]=4 1375 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [1,1,0,0,0,0|0,0,2]=4 1376 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [1,1,0,0,0,0|0,0,2]=4 1377 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [1,1,0,0,0,0|0,0,2]=4 1378 B12R1.21 CC(=O)COc1ccc(cc1)Br 1458a_100000182358_200000210301 [1,1,0,0,0,0|1,0,1]=4 1379 B12R1.21 CC(=O)COc1ccc(cc1)C 1458a_100000182360_200000210301 [1,1,0,0,0,0|1,0,1]=4 1380 B12R1.21 CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_200000210301 [1,1,0,0,0,0|1,0,1]=4 1381 B12R1.21 CC(=O)COc1ccc(cc1)F 1458a_100000184765_200000210301 [1,1,0,0,0,0|1,0,1]=4 1382 B12R1.21 CC(=O)COc1ccc(cc1)I 1458a_100000184369_200000210301 [1,1,0,0,0,0|1,0,1]=4 1383 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [1,1,0,0,0,0|1,0,1]=4 1384 B12R1.21 CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_200000210301 [1,1,0,0,0,0|1,0,1]=4 1385 B12R1.21 CC(=O)CSc1ccc(cc1)C 1458a_100000179497_200000210301 [1,1,0,0,0,0|1,0,1]=4 1386 B12R1.21 CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200000210301 [1,1,0,0,0,0|1,0,1]=4 1387 B12R1.21 CC(=O)CSc1ccc(cc1)F 1458a_100000691584_200000210301 [1,1,0,0,0,0|1,0,1]=4 1388 B12R1.21 CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100015343762 [1,1,0,0,0,0|1,0,1]=4 1389 B12R1.21 CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100015343762 [1,1,0,0,0,0|1,0,1]=4 1390 B12R1.21 CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100015343762 [1,1,0,0,0,0|1,0,1]=4 1391 B12R1.21 CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100103153847 [1,1,0,0,0,0|1,0,1]=4 1392 B12R1.21 CC(=O)NCc1ccc(cc1)C 11a_100000174908_100015343762 [1,1,0,0,0,0|1,0,1]=4 1393 B12R1.21 CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100015343762 [1,1,0,0,0,0|1,0,1]=4 1394 B12R1.21 CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100015343762 [1,1,0,0,0,0|1,0,1]=4 1395 B12R1.21 CC(=O)NCc1ccc(cc1)C 527a_100000174908_100103153847 [1,1,0,0,0,0|1,0,1]=4 1396 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100015343762 [1,1,0,0,0,0|1,0,1]=4 1397 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100015343762 [1,1,0,0,0,0|1,0,1]=4 1398 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100015343762 [1,1,0,0,0,0|1,0,1]=4 1399 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100103153847 [1,1,0,0,0,0|1,0,1]=4 1400 B12R1.21 CC(=O)NCc1ccc(cc1)F 11a_100000174882_100015343762 [1,1,0,0,0,0|1,0,1]=4 1401 B12R1.21 CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100015343762 [1,1,0,0,0,0|1,0,1]=4 1402 B12R1.21 CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100015343762 [1,1,0,0,0,0|1,0,1]=4 1403 B12R1.21 CC(=O)NCc1ccc(cc1)F 527a_100000174882_100103153847 [1,1,0,0,0,0|1,0,1]=4 1404 B12R1.21 CC(=O)NCc1ccc(cc1)I 11a_100016989417_100015343762 [1,1,0,0,0,0|1,0,1]=4 1405 B12R1.21 CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100015343762 [1,1,0,0,0,0|1,0,1]=4 1406 B12R1.21 CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100015343762 [1,1,0,0,0,0|1,0,1]=4 1407 B12R1.21 CC(=O)NCc1ccc(cc1)I 527a_100016989417_100103153847 [1,1,0,0,0,0|1,0,1]=4 1408 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [1,1,0,0,0,0|1,0,1]=4 1409 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [1,1,0,0,0,0|1,0,1]=4 1410 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [1,1,0,0,0,0|1,0,1]=4 1411 B12R1.21 CC(=O)NNc1ccc(cc1)Br 22a_100000735608_100000070787 [1,1,0,0,0,0|2,0,0]=4 1412 B12R1.21 CC(=O)NNc1ccc(cc1)C 22a_100000683527_100000070787 [1,1,0,0,0,0|2,0,0]=4 1413 B12R1.21 CC(=O)NNc1ccc(cc1)Cl 22a_100000683521_100000070787 [1,1,0,0,0,0|2,0,0]=4 1414 B12R1.21 CC(=O)NNc1ccc(cc1)F 22a_100000728448_100000070787 [1,1,0,0,0,0|2,0,0]=4 1415 B12R1.21 CC(=O)NNc1ccc(cc1)I 22a_100016988836_100000070787 [1,1,0,0,0,0|2,0,0]=4 1416 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [1,1,0,0,0,0|2,0,0]=4 1417 B12R1.21 CC(C)C=Cc1ccc(cc1)Br 271570a_100016257149_100000752885 [1,1,0,0,0,0|1,0,1]=4 1418 B12R1.21 CC(C)C=Cc1ccc(cc1)Cl 271570a_100016257149_100000755918 [1,1,0,0,0,0|1,0,1]=4 1419 B12R1.21 CC(C)C=Cc1ccc(cc1)F 271570a_100016257149_100000211213 [1,1,0,0,0,0|1,0,1]=4 1420 B12R1.21 CC(C)C=Cc1ccc(cc1)N 271570a_100016257149_100000185761 [1,1,0,0,0,0|1,0,1]=4 1421 B12R1.21 CC(C)C=Cc1ccc(cc1)O 271570a_100016257149_100000185759 [1,1,0,0,0,0|1,0,1]=4 1422 B12R1.21 CC(O)C=Cc1ccc(cc1)Br 271570a_200011019289_100000752885 [1,1,0,0,0,0|0,0,2]=4 1423 B12R1.21 CC(O)C=Cc1ccc(cc1)Cl 271570a_200011019289_100000755918 [1,1,0,0,0,0|0,0,2]=4 1424 B12R1.21 CC(O)C=Cc1ccc(cc1)F 271570a_200011019289_100000211213 [1,1,0,0,0,0|0,0,2]=4 1425 B12R1.21 CC(O)C=Cc1ccc(cc1)N 271570a_200011019289_100000185761 [1,1,0,0,0,0|0,0,2]=4 1426 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [1,1,0,0,0,0|0,0,2]=4 1427 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [1,1,0,0,0,0|0,0,0]=2 1428 B12R1.21 Cc1ccc(cc1)C=CC(C)C 271570a_100016257149_100000186775 [1,1,0,0,0,0|1,0,1]=4 1429 B12R1.21 Cc1ccc(cc1)C=CC(C)O 271570a_200011019289_100000186775 [1,1,0,0,0,0|0,0,2]=4 1430 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [1,1,0,0,0,0|0,0,2]=4 1431 B12R1.21 Cc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182360_200025704644 [1,1,0,0,0,0|1,0,1]=4 1432 B12R1.21 Cc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000179497_200025704644 [1,1,0,0,0,0|1,0,1]=4 1433 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Br 1458a_100012100275_200025704644 [1,1,0,0,0,0|0,0,2]=4 1434 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)Cl 1458a_100011892723_200025704644 [1,1,0,0,0,0|0,0,2]=4 1435 B12R1.21 [13CH3]C(=O)C#Cc1ccc(cc1)F 1458a_100000238512_200025704644 [1,1,0,0,0,0|0,0,2]=4 1436 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [1,1,0,0,0,0|0,0,0]=2 1437 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [1,1,0,0,0,0|0,0,0]=2 1438 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [1,1,0,0,0,0|0,0,0]=2 1439 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [1,1,0,0,0,0|0,0,0]=2 1440 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cn1)F 1458a_100020630499_200025704644 [1,1,0,0,0,0|1,0,0]=3 1441 B12R1.21 [13CH3]C(=O)C=Cc1ccc(nc1)Br 1458a_100020588214_200025704644 [1,1,0,0,0,0|1,0,0]=3 1442 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [1,1,0,0,0,0|0,0,2]=4 1443 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [1,1,0,0,0,0|0,0,2]=4 1444 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [1,1,0,0,0,0|0,0,2]=4 1445 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [1,1,0,0,0,0|0,0,2]=4 1446 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [1,1,0,0,0,0|0,0,2]=4 1447 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Br 1458a_100000182358_200025704644 [1,1,0,0,0,0|1,0,1]=4 1448 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Cl 1458a_100016990877_200025704644 [1,1,0,0,0,0|1,0,1]=4 1449 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)F 1458a_100000184765_200025704644 [1,1,0,0,0,0|1,0,1]=4 1450 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)I 1458a_100000184369_200025704644 [1,1,0,0,0,0|1,0,1]=4 1451 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [1,1,0,0,0,0|1,0,1]=4 1452 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Br 1458a_100000179496_200025704644 [1,1,0,0,0,0|1,0,1]=4 1453 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200025704644 [1,1,0,0,0,0|1,0,1]=4 1454 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)F 1458a_100000691584_200025704644 [1,1,0,0,0,0|1,0,1]=4 1455 B12R1.27 CCC(=O)C#Cc1ccccc1 1458a_100000736102_100000210202 [1,1,0,0,0,0|0,0,2]=4 1456 B12R1.27 CCC(=O)C=Cc1ccccc1 1458a_100000210462_100000210202 [1,1,0,0,0,0|0,0,0]=2 1457 B12R1.27 CCC(=O)C=Cc1ccccn1 1458a_100000740811_100000210202 [1,1,0,0,0,0|1,0,0]=3 1458 B12R1.27 CCC(=O)C=Cc1cccnc1 1458a_100000735890_100000210202 [1,1,0,0,0,0|1,0,0]=3 1459 B12R1.27 CCC(=O)C=Cc1ccncc1 1458a_100000682801_100000210202 [1,1,0,0,0,0|1,0,0]=3 1460 B12R1.27 CCC(=O)C=Cc1cncnc1 6a_100000749868_100000211110 [1,1,0,0,0,0|2,0,0]=4 1461 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000185753_100000210202 [1,1,0,0,0,0|0,0,2]=4 1462 B12R1.27 CCC(=O)CCc1ccccc1 1458a_100000210414_100000765856 [1,1,0,0,0,0|0,0,2]=4 1463 B12R1.27 CCC(=O)COc1ccccc1 1458a_100000186222_100000210202 [1,1,0,0,0,0|1,0,1]=4 1464 B12R1.27 CCC(=O)COc1ccccc1 7a_100000210340_100000747405 [1,1,0,0,0,0|1,0,1]=4 1465 B12R1.27 CCC(=O)CSc1ccccc1 1458a_100000211596_100000210202 [1,1,0,0,0,0|1,0,1]=4 1466 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000719477_100000747405 [1,1,0,0,0,0|1,0,1]=4 1467 B12R1.27 CCC(=O)CSc1ccccc1 62a_100000747405_100000041952 [1,1,0,0,0,0|1,0,1]=4 1468 B12R1.27 CCC(=O)NCc1ccccc1 11a_100015324214_100000210414 [1,1,0,0,0,0|1,0,1]=4 1469 B12R1.27 CCC(=O)NCc1ccccc1 1626a_100015324214_100000210414 [1,1,0,0,0,0|1,0,1]=4 1470 B12R1.27 CCC(=O)NCc1ccccc1 240690a_100015324214_100000210414 [1,1,0,0,0,0|1,0,1]=4 1471 B12R1.27 CCC(=O)NCc1ccccc1 527a_100015324214_100000210414 [1,1,0,0,0,0|1,0,1]=4 1472 B12R1.27 CCC(=O)NNc1ccccc1 22a_100015195140_100000210414 [1,1,0,0,0,0|2,0,0]=4 1473 B12R1.27 CNC(=O)C#Cc1ccccc1 240690a_100102657272_100000736102 [1,1,0,0,0,0|0,0,2]=4 1474 B12R1.27 CNC(=O)C=Cc1ccccc1 11a_106832991635_100000210462 [1,1,0,0,0,0|0,0,0]=2 1475 B12R1.27 CNC(=O)C=Cc1ccccc1 1626a_100102657272_100000210462 [1,1,0,0,0,0|0,0,0]=2 1476 B12R1.27 CNC(=O)C=Cc1ccccn1 11a_106832991635_100000740811 [1,1,0,0,0,0|1,0,0]=3 1477 B12R1.27 CNC(=O)C=Cc1ccccn1 240690a_100102657272_100000740811 [1,1,0,0,0,0|1,0,0]=3 1478 B12R1.27 CNC(=O)C=Cc1cccnc1 11a_106832991635_100000735890 [1,1,0,0,0,0|1,0,0]=3 1479 B12R1.27 CNC(=O)C=Cc1cccnc1 240690a_100102657272_100000735890 [1,1,0,0,0,0|1,0,0]=3 1480 B12R1.27 CNC(=O)C=Cc1ccncc1 240690a_100102657272_100000682801 [1,1,0,0,0,0|1,0,0]=3 1481 B12R1.27 CNC(=O)CCc1ccccc1 11a_106832991635_100000185753 [1,1,0,0,0,0|0,0,2]=4 1482 B12R1.27 CNC(=O)CCc1ccccc1 1626a_100102657272_100000185753 [1,1,0,0,0,0|0,0,2]=4 1483 B12R1.27 CNC(=O)CCc1ccccc1 240690a_100102657272_100000185753 [1,1,0,0,0,0|0,0,2]=4 1484 B12R1.27 CNC(=O)CCc1ccccc1 527a_100102657272_100000185753 [1,1,0,0,0,0|0,0,2]=4 1485 B12R1.27 CNC(=O)CNc1ccccc1 34a_100000106764_100000183359 [1,1,0,0,0,0|1,0,1]=4 1486 B12R1.27 CNC(=O)COc1ccccc1 11a_106832991635_100000186222 [1,1,0,0,0,0|1,0,1]=4 1487 B12R1.27 CNC(=O)COc1ccccc1 1626a_100102657272_100000186222 [1,1,0,0,0,0|1,0,1]=4 1488 B12R1.27 CNC(=O)COc1ccccc1 240690a_100102657272_100000186222 [1,1,0,0,0,0|1,0,1]=4 1489 B12R1.27 CNC(=O)COc1ccccc1 34a_100000210340_100000183359 [1,1,0,0,0,0|1,0,1]=4 1490 B12R1.27 CNC(=O)COc1ccccc1 527a_100102657272_100000186222 [1,1,0,0,0,0|1,0,1]=4 1491 B12R1.27 CNC(=O)COc1ccccc1 7a_100000210340_100000183359 [1,1,0,0,0,0|1,0,1]=4 1492 B12R1.27 CNC(=O)CSc1ccccc1 11a_106832991635_100000211596 [1,1,0,0,0,0|1,0,1]=4 1493 B12R1.27 CNC(=O)CSc1ccccc1 1626a_100102657272_100000211596 [1,1,0,0,0,0|1,0,1]=4 1494 B12R1.27 CNC(=O)CSc1ccccc1 240690a_100102657272_100000211596 [1,1,0,0,0,0|1,0,1]=4 1495 B12R1.27 CNC(=O)CSc1ccccc1 527a_100102657272_100000211596 [1,1,0,0,0,0|1,0,1]=4 1496 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000183359_100000041952 [1,1,0,0,0,0|1,0,1]=4 1497 B12R1.27 CNC(=O)CSc1ccccc1 62a_100000719477_100000183359 [1,1,0,0,0,0|1,0,1]=4 1498 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100015324214_106832991635 [1,1,0,0,0,0|1,0,1]=4 1499 B12R1.27 CNC(=O)NCc1ccccc1 2708a_100102657272_100015324214 [1,1,0,0,0,0|1,0,1]=4 1500 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100015324214_100102657272 [1,1,0,0,0,0|1,0,1]=4 1501 B12R1.27 CNC(=O)NCc1ccccc1 273464a_100102657272_100015324214 [1,1,0,0,0,0|1,0,1]=4 1502 B12R1.27 CNC(=O)NCc1ccccc1 512a_100015324214_100102657272 [1,1,0,0,0,0|1,0,1]=4 1503 B12R1.27 CNC(=O)NCc1ccccc1 512a_106832991638_100015324214 [1,1,0,0,0,0|1,0,1]=4 1504 B12R1.27 CNC(=O)NNc1ccccc1 273464a_100102657272_100015195140 [1,1,0,0,0,0|2,0,0]=4 1505 B12R1.27 CNC(=O)NNc1ccccc1 512a_106832991638_100015195140 [1,1,0,0,0,0|2,0,0]=4 1506 B12R1.27 COC(=O)CNc1ccccc1 34a_100000106764_100000747449 [1,1,0,0,0,0|1,0,1]=4 1507 B12R1.27 COC(=O)COc1ccccc1 34a_100000210340_100000747449 [1,1,0,0,0,0|1,0,1]=4 1508 B12R1.27 COC(=O)COc1ccccc1 7a_100000210340_100000747449 [1,1,0,0,0,0|1,0,1]=4 1509 B12R1.27 COC(=O)CSc1ccccc1 62a_100000719477_100000747449 [1,1,0,0,0,0|1,0,1]=4 1510 B12R1.27 COC(=O)CSc1ccccc1 62a_100000747449_100000041952 [1,1,0,0,0,0|1,0,1]=4 1511 B12R1.27 O=C(C#Cc1ccccc1)CF 1458a_100000736102_100015361967 [1,1,0,0,0,0|0,0,2]=4 1512 B12R1.27 O=C(C=Cc1ccccc1)CF 1458a_100000210462_100015361967 [1,1,0,0,0,0|0,0,0]=2 1513 B12R1.27 O=C(C=Cc1ccccn1)CF 1458a_100000740811_100015361967 [1,1,0,0,0,0|1,0,0]=3 1514 B12R1.27 O=C(C=Cc1cccnc1)CF 1458a_100000735890_100015361967 [1,1,0,0,0,0|1,0,0]=3 1515 B12R1.27 O=C(C=Cc1ccncc1)CF 1458a_100000682801_100015361967 [1,1,0,0,0,0|1,0,0]=3 1516 B12R1.27 O=C(C=Cc1cncnc1)CBr 6a_100000749868_100009888967 [1,1,0,0,0,0|2,0,0]=4 1517 B12R1.27 O=C(C=Cc1cncnc1)CCl 6a_100000749868_100000086384 [1,1,0,0,0,0|2,0,0]=4 1518 B12R1.27 O=C(C=Cc1cncnc1)CF 6a_100000749868_100000764096 [1,1,0,0,0,0|2,0,0]=4 1519 B12R1.27 O=C(CF)CCc1ccccc1 1458a_100000185753_100015361967 [1,1,0,0,0,0|0,0,2]=4 1520 B12R1.27 O=C(CF)COc1ccccc1 1458a_100000186222_100015361967 [1,1,0,0,0,0|1,0,1]=4 1521 B12R1.27 O=C(CF)CSc1ccccc1 1458a_100000211596_100015361967 [1,1,0,0,0,0|1,0,1]=4 1522 B12R1.27 O=C(CO)CCc1ccccc1 1458a_100000210174_100000765856 [1,1,0,0,0,0|0,0,2]=4 1523 B12R1.27 O=C(CO)NCc1ccccc1 240690a_100015324214_100000210174 [1,1,0,0,0,0|1,0,1]=4 1524 B12R1.27 O=C(CO)NCc1ccccc1 527a_100015324214_100000210174 [1,1,0,0,0,0|1,0,1]=4 1525 B12R1.27 O=C(CO)NNc1ccccc1 22a_100015195140_100000210174 [1,1,0,0,0,0|2,0,0]=4 1526 B12R1.107 C=C(C)CC(=O)c1ccccc1 1458a_100000185807_100000748629 [1,1,0,0,0,0|1,0,1]=4 1527 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [1,1,0,0,0,0|0,0,0]=2 1528 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [1,1,0,0,0,0|0,0,0]=2 1529 B12R1.107 CC(=O)CC(=O)c1ccccc1 1458a_100000070787_100000211460 [1,1,0,0,0,0|0,0,1]=3 1530 B12R1.107 CC(=O)CC(=O)c1ccccn1 1458a_100000070787_100000027445 [1,1,0,0,0,0|1,0,1]=4 1531 B12R1.107 CC(=O)CC(=O)c1cccnc1 1458a_100000070787_100015188593 [1,1,0,0,0,0|1,0,1]=4 1532 B12R1.107 CC(=O)CC(=O)c1ccncc1 1458a_100000070787_100000027454 [1,1,0,0,0,0|1,0,1]=4 1533 B12R1.107 CC(=O)CC(C)c1ccccc1 1458a_100000070787_100000756946 [1,1,0,0,0,0|0,0,2]=4 1534 B12R1.107 CC(=O)CC(C)c1ccccc1 1458a_100000183687_200000210301 [1,1,0,0,0,0|0,0,2]=4 1535 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000070787_100000185958 [1,1,0,0,0,0|0,0,2]=4 1536 B12R1.107 CC(=O)CC(O)c1ccccc1 1458a_100000690199_200000210301 [1,1,0,0,0,0|0,0,2]=4 1537 B12R1.107 CC(=O)CN(C)c1ccccc1 1458a_100000745425_200000210301 [1,1,0,0,0,0|1,0,1]=4 1538 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 1458a_100000070787_100011933945 [1,1,0,0,0,0|0,0,2]=4 1539 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 11a_100000751104_100015343762 [1,1,0,0,0,0|1,0,1]=4 1540 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 1626a_100000751104_100015343762 [1,1,0,0,0,0|1,0,1]=4 1541 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 240690a_100000751104_100015343762 [1,1,0,0,0,0|1,0,1]=4 1542 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 527a_100000751104_100103153847 [1,1,0,0,0,0|1,0,1]=4 1543 B12R1.107 CC(CC(=O)[13CH3])c1ccccc1 1458a_100000183687_200025704644 [1,1,0,0,0,0|0,0,2]=4 1544 B12R1.107 CN(CC(=O)[13CH3])c1ccccc1 1458a_100000745425_200025704644 [1,1,0,0,0,0|1,0,1]=4 1545 B12R1.107 NC(=O)CC(=O)c1ccccc1 1458a_100000185807_100000187820 [1,1,0,0,0,0|1,0,1]=4 1546 B12R1.107 O=C([O-])CC(=O)c1ccccc1 1458a_100000185807_100020667443 [1,1,0,0,0,0|1,0,1]=4 1547 B12R1.107 [13CH3]C(=O)CC(O)c1ccccc1 1458a_100000690199_200025704644 [1,1,0,0,0,0|0,0,2]=4 1548 B12R1.125 CC(=O)C#Cc1ccccc1F 1458a_100011892747_200000210301 [1,1,0,0,0,0|0,0,2]=4 1549 B12R1.125 CC(=O)C=Cc1ccccc1Br 1458a_100000719032_200000210301 [1,1,0,0,0,0|0,0,0]=2 1550 B12R1.125 CC(=O)C=Cc1ccccc1Cl 1458a_100000720304_200000210301 [1,1,0,0,0,0|0,0,0]=2 1551 B12R1.125 CC(=O)C=Cc1ccccc1F 1458a_100016256065_200000210301 [1,1,0,0,0,0|0,0,0]=2 1552 B12R1.125 CC(=O)C=Cc1ccccc1O 1458a_100016263591_200000210301 [1,1,0,0,0,0|0,0,0]=2 1553 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000070787_100012161201 [1,1,0,0,0,0|0,0,2]=4 1554 B12R1.125 CC(=O)CCc1ccccc1Br 1458a_100000740810_200000210301 [1,1,0,0,0,0|0,0,2]=4 1555 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000070787_100011713688 [1,1,0,0,0,0|0,0,2]=4 1556 B12R1.125 CC(=O)CCc1ccccc1C 1458a_100000748742_200000210301 [1,1,0,0,0,0|0,0,2]=4 1557 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000070787_100011713703 [1,1,0,0,0,0|0,0,2]=4 1558 B12R1.125 CC(=O)CCc1ccccc1Cl 1458a_100000184300_200000210301 [1,1,0,0,0,0|0,0,2]=4 1559 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000070787_100000720011 [1,1,0,0,0,0|0,0,2]=4 1560 B12R1.125 CC(=O)CCc1ccccc1F 1458a_100000189703_200000210301 [1,1,0,0,0,0|0,0,2]=4 1561 B12R1.125 CC(=O)CCc1ccccc1I 1458a_100000037306_200000210301 [1,1,0,0,0,0|0,0,2]=4 1562 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000070787_100000722297 [1,1,0,0,0,0|0,0,2]=4 1563 B12R1.125 CC(=O)CCc1ccccc1O 1458a_100000181328_200000210301 [1,1,0,0,0,0|0,0,2]=4 1564 B12R1.125 CC(=O)COc1ccccc1Br 1458a_100000216496_200000210301 [1,1,0,0,0,0|1,0,1]=4 1565 B12R1.125 CC(=O)COc1ccccc1C 1458a_100000182418_200000210301 [1,1,0,0,0,0|1,0,1]=4 1566 B12R1.125 CC(=O)COc1ccccc1Cl 1458a_100000185159_200000210301 [1,1,0,0,0,0|1,0,1]=4 1567 B12R1.125 CC(=O)COc1ccccc1F 1458a_100000182486_200000210301 [1,1,0,0,0,0|1,0,1]=4 1568 B12R1.125 CC(=O)COc1ccccc1O 1458a_100000183020_200000210301 [1,1,0,0,0,0|1,0,1]=4 1569 B12R1.125 CC(=O)CSc1ccccc1C 1458a_100000183026_200000210301 [1,1,0,0,0,0|1,0,1]=4 1570 B12R1.125 CC(=O)CSc1ccccc1F 1458a_100000179528_200000210301 [1,1,0,0,0,0|1,0,1]=4 1571 B12R1.125 CC(=O)CSc1ccccc1O 1458a_100000695322_200000210301 [1,1,0,0,0,0|1,0,1]=4 1572 B12R1.125 CC(=O)NCc1ccccc1Br 11a_100000689332_100015343762 [1,1,0,0,0,0|1,0,1]=4 1573 B12R1.125 CC(=O)NCc1ccccc1Br 1626a_100000689332_100015343762 [1,1,0,0,0,0|1,0,1]=4 1574 B12R1.125 CC(=O)NCc1ccccc1Br 240690a_100000689332_100015343762 [1,1,0,0,0,0|1,0,1]=4 1575 B12R1.125 CC(=O)NCc1ccccc1Br 527a_100000689332_100103153847 [1,1,0,0,0,0|1,0,1]=4 1576 B12R1.125 CC(=O)NCc1ccccc1C 11a_100000174972_100015343762 [1,1,0,0,0,0|1,0,1]=4 1577 B12R1.125 CC(=O)NCc1ccccc1C 1626a_100000174972_100015343762 [1,1,0,0,0,0|1,0,1]=4 1578 B12R1.125 CC(=O)NCc1ccccc1C 240690a_100000174972_100015343762 [1,1,0,0,0,0|1,0,1]=4 1579 B12R1.125 CC(=O)NCc1ccccc1C 527a_100000174972_100103153847 [1,1,0,0,0,0|1,0,1]=4 1580 B12R1.125 CC(=O)NCc1ccccc1Cl 11a_100000174879_100015343762 [1,1,0,0,0,0|1,0,1]=4 1581 B12R1.125 CC(=O)NCc1ccccc1Cl 1626a_100000174879_100015343762 [1,1,0,0,0,0|1,0,1]=4 1582 B12R1.125 CC(=O)NCc1ccccc1Cl 240690a_100000174879_100015343762 [1,1,0,0,0,0|1,0,1]=4 1583 B12R1.125 CC(=O)NCc1ccccc1Cl 527a_100000174879_100103153847 [1,1,0,0,0,0|1,0,1]=4 1584 B12R1.125 CC(=O)NCc1ccccc1F 11a_100000174869_100015343762 [1,1,0,0,0,0|1,0,1]=4 1585 B12R1.125 CC(=O)NCc1ccccc1F 1626a_100000174869_100015343762 [1,1,0,0,0,0|1,0,1]=4 1586 B12R1.125 CC(=O)NCc1ccccc1F 240690a_100000174869_100015343762 [1,1,0,0,0,0|1,0,1]=4 1587 B12R1.125 CC(=O)NCc1ccccc1F 527a_100000174869_100103153847 [1,1,0,0,0,0|1,0,1]=4 1588 B12R1.125 CC(=O)NCc1ccccc1I 11a_100015347259_100015343762 [1,1,0,0,0,0|1,0,1]=4 1589 B12R1.125 CC(=O)NCc1ccccc1I 1626a_100015347259_100015343762 [1,1,0,0,0,0|1,0,1]=4 1590 B12R1.125 CC(=O)NCc1ccccc1I 240690a_100015347259_100015343762 [1,1,0,0,0,0|1,0,1]=4 1591 B12R1.125 CC(=O)NCc1ccccc1I 527a_100015347259_100103153847 [1,1,0,0,0,0|1,0,1]=4 1592 B12R1.125 CC(=O)NCc1ccccc1O 240690a_100000185550_100015343762 [1,1,0,0,0,0|1,0,1]=4 1593 B12R1.125 CC(=O)NCc1ccccc1O 271570a_203496583355_100011237613 [1,1,0,0,0,0|1,0,1]=4 1594 B12R1.125 CC(=O)NCc1ccccc1O 527a_100000185550_100103153847 [1,1,0,0,0,0|1,0,1]=4 1595 B12R1.125 CC(=O)NNc1ccccc1Br 22a_100000241748_100000070787 [1,1,0,0,0,0|2,0,0]=4 1596 B12R1.125 CC(=O)NNc1ccccc1C 22a_100000184220_100000070787 [1,1,0,0,0,0|2,0,0]=4 1597 B12R1.125 CC(=O)NNc1ccccc1Cl 22a_100000683529_100000070787 [1,1,0,0,0,0|2,0,0]=4 1598 B12R1.125 CC(=O)NNc1ccccc1F 22a_100000239246_100000070787 [1,1,0,0,0,0|2,0,0]=4 1599 B12R1.125 CC(=O)NNc1ccccc1I 22a_100011218156_100000070787 [1,1,0,0,0,0|2,0,0]=4 1600 B12R1.125 CC(C)C=Cc1ccccc1Br 271570a_100016257149_100000695589 [1,1,0,0,0,0|1,0,1]=4 1601 B12R1.125 CC(C)C=Cc1ccccc1Cl 271570a_100016257149_100000764095 [1,1,0,0,0,0|1,0,1]=4 1602 B12R1.125 CC(C)C=Cc1ccccc1F 271570a_100016257149_100011215700 [1,1,0,0,0,0|1,0,1]=4 1603 B12R1.125 CC(C)C=Cc1ccccc1N 271570a_100016257149_100000210017 [1,1,0,0,0,0|1,0,1]=4 1604 B12R1.125 CC(C)C=Cc1ccccc1O 271570a_100016257149_100000739446 [1,1,0,0,0,0|1,0,1]=4 1605 B12R1.125 CC(O)C=Cc1ccccc1Br 271570a_200011019289_100000695589 [1,1,0,0,0,0|0,0,2]=4 1606 B12R1.125 CC(O)C=Cc1ccccc1Cl 271570a_200011019289_100000764095 [1,1,0,0,0,0|0,0,2]=4 1607 B12R1.125 CC(O)C=Cc1ccccc1F 271570a_200011019289_100011215700 [1,1,0,0,0,0|0,0,2]=4 1608 B12R1.125 CC(O)C=Cc1ccccc1N 271570a_200011019289_100000210017 [1,1,0,0,0,0|0,0,2]=4 1609 B12R1.125 CC(O)C=Cc1ccccc1O 271570a_200011019289_100000739446 [1,1,0,0,0,0|0,0,2]=4 1610 B12R1.125 Cc1ccccc1C=CC(C)C 271570a_100016257149_100000210755 [1,1,0,0,0,0|1,0,1]=4 1611 B12R1.125 Cc1ccccc1C=CC(C)O 271570a_200011019289_100000210755 [1,1,0,0,0,0|0,0,2]=4 1612 B12R1.125 Cc1ccccc1CCC(=O)[13CH3] 1458a_100000748742_200025704644 [1,1,0,0,0,0|0,0,2]=4 1613 B12R1.125 Cc1ccccc1OCC(=O)[13CH3] 1458a_100000182418_200025704644 [1,1,0,0,0,0|1,0,1]=4 1614 B12R1.125 Cc1ccccc1SCC(=O)[13CH3] 1458a_100000183026_200025704644 [1,1,0,0,0,0|1,0,1]=4 1615 B12R1.125 [13CH3]C(=O)C#Cc1ccccc1F 1458a_100011892747_200025704644 [1,1,0,0,0,0|0,0,2]=4 1616 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Br 1458a_100000719032_200025704644 [1,1,0,0,0,0|0,0,0]=2 1617 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1Cl 1458a_100000720304_200025704644 [1,1,0,0,0,0|0,0,0]=2 1618 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1F 1458a_100016256065_200025704644 [1,1,0,0,0,0|0,0,0]=2 1619 B12R1.125 [13CH3]C(=O)C=Cc1ccccc1O 1458a_100016263591_200025704644 [1,1,0,0,0,0|0,0,0]=2 1620 B12R1.125 [13CH3]C(=O)CCc1ccccc1Br 1458a_100000740810_200025704644 [1,1,0,0,0,0|0,0,2]=4 1621 B12R1.125 [13CH3]C(=O)CCc1ccccc1Cl 1458a_100000184300_200025704644 [1,1,0,0,0,0|0,0,2]=4 1622 B12R1.125 [13CH3]C(=O)CCc1ccccc1F 1458a_100000189703_200025704644 [1,1,0,0,0,0|0,0,2]=4 1623 B12R1.125 [13CH3]C(=O)CCc1ccccc1I 1458a_100000037306_200025704644 [1,1,0,0,0,0|0,0,2]=4 1624 B12R1.125 [13CH3]C(=O)CCc1ccccc1O 1458a_100000181328_200025704644 [1,1,0,0,0,0|0,0,2]=4 1625 B12R1.125 [13CH3]C(=O)COc1ccccc1Br 1458a_100000216496_200025704644 [1,1,0,0,0,0|1,0,1]=4 1626 B12R1.125 [13CH3]C(=O)COc1ccccc1Cl 1458a_100000185159_200025704644 [1,1,0,0,0,0|1,0,1]=4 1627 B12R1.125 [13CH3]C(=O)COc1ccccc1F 1458a_100000182486_200025704644 [1,1,0,0,0,0|1,0,1]=4 1628 B12R1.125 [13CH3]C(=O)COc1ccccc1O 1458a_100000183020_200025704644 [1,1,0,0,0,0|1,0,1]=4 1629 B12R1.125 [13CH3]C(=O)CSc1ccccc1F 1458a_100000179528_200025704644 [1,1,0,0,0,0|1,0,1]=4 1630 B12R1.125 [13CH3]C(=O)CSc1ccccc1O 1458a_100000695322_200025704644 [1,1,0,0,0,0|1,0,1]=4 1631 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [1,1,0,0,0,0|0,0,0]=2 1632 B12R1.226 CC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200000210301 [1,1,0,0,0,0|0,0,2]=4 1633 B12R1.226 CC(=O)C#Cc1cccc(c1)C 1458a_100011892726_200000210301 [1,1,0,0,0,0|0,0,2]=4 1634 B12R1.226 CC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200000210301 [1,1,0,0,0,0|0,0,2]=4 1635 B12R1.226 CC(=O)C#Cc1cccc(c1)F 1458a_100011892744_200000210301 [1,1,0,0,0,0|0,0,2]=4 1636 B12R1.226 CC(=O)C#Cc1cccc(c1)O 1458a_200009909484_200000210301 [1,1,0,0,0,0|0,0,2]=4 1637 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [1,1,0,0,0,0|0,0,0]=2 1638 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [1,1,0,0,0,0|0,0,0]=2 1639 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [1,1,0,0,0,0|0,0,0]=2 1640 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [1,1,0,0,0,0|0,0,0]=2 1641 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [1,1,0,0,0,0|0,0,0]=2 1642 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [1,1,0,0,0,0|0,0,2]=4 1643 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [1,1,0,0,0,0|0,0,2]=4 1644 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [1,1,0,0,0,0|0,0,2]=4 1645 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [1,1,0,0,0,0|0,0,2]=4 1646 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [1,1,0,0,0,0|0,0,2]=4 1647 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [1,1,0,0,0,0|0,0,2]=4 1648 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [1,1,0,0,0,0|0,0,2]=4 1649 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [1,1,0,0,0,0|0,0,2]=4 1650 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [1,1,0,0,0,0|0,0,2]=4 1651 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [1,1,0,0,0,0|0,0,2]=4 1652 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [1,1,0,0,0,0|0,0,2]=4 1653 B12R1.226 CC(=O)COc1cccc(c1)Br 1458a_100000182359_200000210301 [1,1,0,0,0,0|1,0,1]=4 1654 B12R1.226 CC(=O)COc1cccc(c1)C 1458a_100000183606_200000210301 [1,1,0,0,0,0|1,0,1]=4 1655 B12R1.226 CC(=O)COc1cccc(c1)Cl 1458a_100000184978_200000210301 [1,1,0,0,0,0|1,0,1]=4 1656 B12R1.226 CC(=O)COc1cccc(c1)F 1458a_100000182781_200000210301 [1,1,0,0,0,0|1,0,1]=4 1657 B12R1.226 CC(=O)CSc1cccc(c1)Br 1458a_100000760868_200000210301 [1,1,0,0,0,0|1,0,1]=4 1658 B12R1.226 CC(=O)NCc1cccc(c1)Br 11a_100000174977_100015343762 [1,1,0,0,0,0|1,0,1]=4 1659 B12R1.226 CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100015343762 [1,1,0,0,0,0|1,0,1]=4 1660 B12R1.226 CC(=O)NCc1cccc(c1)Br 240690a_100000174977_100015343762 [1,1,0,0,0,0|1,0,1]=4 1661 B12R1.226 CC(=O)NCc1cccc(c1)Br 527a_100000174977_100103153847 [1,1,0,0,0,0|1,0,1]=4 1662 B12R1.226 CC(=O)NCc1cccc(c1)C 11a_100000185548_100015343762 [1,1,0,0,0,0|1,0,1]=4 1663 B12R1.226 CC(=O)NCc1cccc(c1)C 1626a_100000185548_100015343762 [1,1,0,0,0,0|1,0,1]=4 1664 B12R1.226 CC(=O)NCc1cccc(c1)C 240690a_100000185548_100015343762 [1,1,0,0,0,0|1,0,1]=4 1665 B12R1.226 CC(=O)NCc1cccc(c1)C 527a_100000185548_100103153847 [1,1,0,0,0,0|1,0,1]=4 1666 B12R1.226 CC(=O)NCc1cccc(c1)Cl 11a_100000174878_100015343762 [1,1,0,0,0,0|1,0,1]=4 1667 B12R1.226 CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100015343762 [1,1,0,0,0,0|1,0,1]=4 1668 B12R1.226 CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100015343762 [1,1,0,0,0,0|1,0,1]=4 1669 B12R1.226 CC(=O)NCc1cccc(c1)Cl 527a_100000174878_100103153847 [1,1,0,0,0,0|1,0,1]=4 1670 B12R1.226 CC(=O)NCc1cccc(c1)F 11a_100000174948_100015343762 [1,1,0,0,0,0|1,0,1]=4 1671 B12R1.226 CC(=O)NCc1cccc(c1)F 1626a_100000174948_100015343762 [1,1,0,0,0,0|1,0,1]=4 1672 B12R1.226 CC(=O)NCc1cccc(c1)F 240690a_100000174948_100015343762 [1,1,0,0,0,0|1,0,1]=4 1673 B12R1.226 CC(=O)NCc1cccc(c1)F 527a_100000174948_100103153847 [1,1,0,0,0,0|1,0,1]=4 1674 B12R1.226 CC(=O)NCc1cccc(c1)I 11a_100000106179_100015343762 [1,1,0,0,0,0|1,0,1]=4 1675 B12R1.226 CC(=O)NCc1cccc(c1)I 1626a_100000106179_100015343762 [1,1,0,0,0,0|1,0,1]=4 1676 B12R1.226 CC(=O)NCc1cccc(c1)I 240690a_100000106179_100015343762 [1,1,0,0,0,0|1,0,1]=4 1677 B12R1.226 CC(=O)NCc1cccc(c1)I 527a_100000106179_100103153847 [1,1,0,0,0,0|1,0,1]=4 1678 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [1,1,0,0,0,0|1,0,1]=4 1679 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [1,1,0,0,0,0|1,0,1]=4 1680 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [1,1,0,0,0,0|1,0,1]=4 1681 B12R1.226 CC(=O)NNc1cccc(c1)Br 22a_100000217339_100000070787 [1,1,0,0,0,0|2,0,0]=4 1682 B12R1.226 CC(=O)NNc1cccc(c1)C 22a_100000681630_100000070787 [1,1,0,0,0,0|2,0,0]=4 1683 B12R1.226 CC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000070787 [1,1,0,0,0,0|2,0,0]=4 1684 B12R1.226 CC(=O)NNc1cccc(c1)F 22a_100000745080_100000070787 [1,1,0,0,0,0|2,0,0]=4 1685 B12R1.226 CC(=O)NNc1cccc(c1)I 22a_100020605690_100000070787 [1,1,0,0,0,0|2,0,0]=4 1686 B12R1.226 CC(C)C=Cc1cccc(c1)Br 271570a_100016257149_100000691529 [1,1,0,0,0,0|1,0,1]=4 1687 B12R1.226 CC(C)C=Cc1cccc(c1)Cl 271570a_100016257149_100000699651 [1,1,0,0,0,0|1,0,1]=4 1688 B12R1.226 CC(C)C=Cc1cccc(c1)F 271570a_100016257149_100000685547 [1,1,0,0,0,0|1,0,1]=4 1689 B12R1.226 CC(C)C=Cc1cccc(c1)N 271570a_100016257149_100000210019 [1,1,0,0,0,0|1,0,1]=4 1690 B12R1.226 CC(C)C=Cc1cccc(c1)O 271570a_100016257149_100000211634 [1,1,0,0,0,0|1,0,1]=4 1691 B12R1.226 CC(C)C=Cc1cccc(c1)[S] 271570a_100016257149_114929384022 [1,1,0,0,0,0|1,0,1]=4 1692 B12R1.226 CC(O)C=Cc1cccc(c1)Br 271570a_200011019289_100000691529 [1,1,0,0,0,0|0,0,2]=4 1693 B12R1.226 CC(O)C=Cc1cccc(c1)Cl 271570a_200011019289_100000699651 [1,1,0,0,0,0|0,0,2]=4 1694 B12R1.226 CC(O)C=Cc1cccc(c1)F 271570a_200011019289_100000685547 [1,1,0,0,0,0|0,0,2]=4 1695 B12R1.226 CC(O)C=Cc1cccc(c1)N 271570a_200011019289_100000210019 [1,1,0,0,0,0|0,0,2]=4 1696 B12R1.226 CC(O)C=Cc1cccc(c1)O 271570a_200011019289_100000211634 [1,1,0,0,0,0|0,0,2]=4 1697 B12R1.226 CC(O)C=Cc1cccc(c1)[S] 271570a_200011019289_114929384022 [1,1,0,0,0,0|0,0,2]=4 1698 B12R1.226 Cc1cccc(c1)C#CC(=O)[13CH3] 1458a_100011892726_200025704644 [1,1,0,0,0,0|0,0,2]=4 1699 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [1,1,0,0,0,0|0,0,0]=2 1700 B12R1.226 Cc1cccc(c1)C=CC(C)C 271570a_100016257149_100011215228 [1,1,0,0,0,0|1,0,1]=4 1701 B12R1.226 Cc1cccc(c1)C=CC(C)O 271570a_200011019289_100011215228 [1,1,0,0,0,0|0,0,2]=4 1702 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [1,1,0,0,0,0|0,0,2]=4 1703 B12R1.226 Cc1cccc(c1)OCC(=O)[13CH3] 1458a_100000183606_200025704644 [1,1,0,0,0,0|1,0,1]=4 1704 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200025704644 [1,1,0,0,0,0|0,0,2]=4 1705 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200025704644 [1,1,0,0,0,0|0,0,2]=4 1706 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)F 1458a_100011892744_200025704644 [1,1,0,0,0,0|0,0,2]=4 1707 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)O 1458a_200009909484_200025704644 [1,1,0,0,0,0|0,0,2]=4 1708 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [1,1,0,0,0,0|0,0,0]=2 1709 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [1,1,0,0,0,0|0,0,0]=2 1710 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [1,1,0,0,0,0|0,0,0]=2 1711 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [1,1,0,0,0,0|0,0,0]=2 1712 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [1,1,0,0,0,0|0,0,2]=4 1713 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [1,1,0,0,0,0|0,0,2]=4 1714 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [1,1,0,0,0,0|0,0,2]=4 1715 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [1,1,0,0,0,0|0,0,2]=4 1716 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [1,1,0,0,0,0|0,0,2]=4 1717 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Br 1458a_100000182359_200025704644 [1,1,0,0,0,0|1,0,1]=4 1718 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Cl 1458a_100000184978_200025704644 [1,1,0,0,0,0|1,0,1]=4 1719 B12R1.226 [13CH3]C(=O)COc1cccc(c1)F 1458a_100000182781_200025704644 [1,1,0,0,0,0|1,0,1]=4 1720 B12R1.226 [13CH3]C(=O)CSc1cccc(c1)Br 1458a_100000760868_200025704644 [1,1,0,0,0,0|1,0,1]=4 1721 B12R1.891 CC(C)(C)C=Cc1ccccc1 271570a_100102527731_100000210277 [1,1,0,0,0,0|1,0,1]=4 1722 B12R1.891 CC(C)(O)C=Cc1ccccc1 271570a_200016258132_100000210277 [1,1,0,0,0,0|0,0,2]=4 1723 B12R1.108 CC(=Cc1ccco1)C(=O)CF 1458a_100011995979_100015361967 [0,1,0,0,1,0|1,0,0]=3 1724 B12R1.108 CCC(=O)C(=Cc1ccco1)C 1458a_100011995979_100000210202 [0,1,0,0,1,0|1,0,0]=3 1725 B12R1.108 CNC(=O)C(=Cc1ccco1)C 11a_106832991635_100011995979 [0,1,0,0,1,0|1,0,0]=3 1726 B12R1.108 CNC(=O)C(=Cc1ccco1)C 1626a_100102657272_100011995979 [0,1,0,0,1,0|1,0,0]=3 1727 B12R1.108 CNC(=O)C(=Cc1ccco1)C 527a_100102657272_100011995979 [0,1,0,0,1,0|1,0,0]=3 1728 B12R1.120 CC(=O)C(C)C(=O)c1cccs1 1458a_100000070787_100011262360 [0,1,0,0,1,0|1,0,1]=4 1729 B12R1.298 CC(=O)/C(=C/c1ccoc1)/C#N 1458a_100021253019_200000210301 [0,1,0,0,1,0|1,0,1]=4 1730 B12R1.298 CC(=O)/C(=C/c1ccsc1)/C#N 1458a_100138434748_200000210301 [0,1,0,0,1,0|1,0,1]=4 1731 B12R1.298 [13CH3]C(=O)/C(=C/c1ccoc1)/C#N 1458a_100021253019_200025704644 [0,1,0,0,1,0|1,0,1]=4 1732 B12R1.298 [13CH3]C(=O)/C(=C/c1ccsc1)/C#N 1458a_100138434748_200025704644 [0,1,0,0,1,0|1,0,1]=4 1733 B12R1.20 CC(=C(C)c1cc[n+](cc1)[O-])C 271570a_200000049429_100000039755 [0,1,0,0,1,0|2,0,0]=4 1734 B12R1.20 CC(=C(C)c1ccc(=O)[nH]c1)C 271570a_200000049429_100000212171 [0,1,0,0,1,0|2,0,0]=4 1735 B12R1.20 CC(=C(C)c1ccc(cc1)Br)C 271570a_200000049429_100000752885 [0,1,0,0,1,0|1,0,0]=3 1736 B12R1.20 CC(=C(C)c1ccc(cc1)C)C 271570a_200000049429_100000186775 [0,1,0,0,1,0|1,0,0]=3 1737 B12R1.20 CC(=C(C)c1ccc(cc1)Cl)C 271570a_200000049429_100000755918 [0,1,0,0,1,0|1,0,0]=3 1738 B12R1.20 CC(=C(C)c1ccc(cc1)F)C 271570a_200000049429_100000211213 [0,1,0,0,1,0|1,0,0]=3 1739 B12R1.20 CC(=C(C)c1ccc(cc1)N)C 271570a_200000049429_100000185761 [0,1,0,0,1,0|1,0,0]=3 1740 B12R1.20 CC(=C(C)c1ccc(cc1)O)C 271570a_200000049429_100000185759 [0,1,0,0,1,0|1,0,0]=3 1741 B12R1.20 CC(=C(C)c1ccc(cn1)Br)C 271570a_200000049429_100000686858 [0,1,0,0,1,0|2,0,0]=4 1742 B12R1.20 CC(=C(C)c1ccc(cn1)C)C 271570a_200000049429_100000754016 [0,1,0,0,1,0|2,0,0]=4 1743 B12R1.20 CC(=C(C)c1ccc(cn1)Cl)C 271570a_200000049429_100011356976 [0,1,0,0,1,0|2,0,0]=4 1744 B12R1.20 CC(=C(C)c1ccc(cn1)F)C 271570a_200000049429_100000744514 [0,1,0,0,1,0|2,0,0]=4 1745 B12R1.20 CC(=C(C)c1ccc(cn1)N)C 271570a_200000049429_100000744251 [0,1,0,0,1,0|2,0,0]=4 1746 B12R1.20 CC(=C(C)c1ccc(cn1)O)C 271570a_200000049429_100000685995 [0,1,0,0,1,0|2,0,0]=4 1747 B12R1.20 CC(=C(C)c1ccc(nc1)Br)C 271570a_200000049429_100009814638 [0,1,0,0,1,0|2,0,0]=4 1748 B12R1.20 CC(=C(C)c1ccc(nc1)C)C 271570a_200000049429_100000751577 [0,1,0,0,1,0|2,0,0]=4 1749 B12R1.20 CC(=C(C)c1ccc(nc1)Cl)C 271570a_200000049429_100000034144 [0,1,0,0,1,0|2,0,0]=4 1750 B12R1.20 CC(=C(C)c1ccc(nc1)F)C 271570a_200000049429_100000748661 [0,1,0,0,1,0|2,0,0]=4 1751 B12R1.20 CC(=C(C)c1ccc(nc1)N)C 271570a_200000049429_100000187370 [0,1,0,0,1,0|2,0,0]=4 1752 B12R1.20 CC(=O)C(C)c1ccc(cc1)Br 1458a_100000070787_100000755118 [0,1,0,0,1,0|0,0,1]=3 1753 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000070787_100011261388 [0,1,0,0,1,0|0,0,1]=3 1754 B12R1.20 CC(=O)C(C)c1ccc(cc1)C 1458a_100000751627_200000210301 [0,1,0,0,1,0|0,0,1]=3 1755 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100000070787_100000684792 [0,1,0,0,1,0|0,0,1]=3 1756 B12R1.20 CC(=O)C(C)c1ccc(cc1)Cl 1458a_100011216001_200000210301 [0,1,0,0,1,0|0,0,1]=3 1757 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100000070787_100000743420 [0,1,0,0,1,0|0,0,1]=3 1758 B12R1.20 CC(=O)C(C)c1ccc(cc1)F 1458a_100011435297_200000210301 [0,1,0,0,1,0|0,0,1]=3 1759 B12R1.20 CC(=O)C(C)c1ccc(cc1)O 1458a_100000031422_200000210301 [0,1,0,0,1,0|0,0,1]=3 1760 B12R1.20 CC(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200000210301 [0,1,0,0,1,0|1,0,1]=4 1761 B12R1.20 CC(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200000210301 [0,1,0,0,1,0|1,0,1]=4 1762 B12R1.20 CC(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200000210301 [0,1,0,0,1,0|1,0,1]=4 1763 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,1,0,0,1,0|1,0,1]=4 1764 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 11a_100000219623_100015343762 [0,1,0,0,1,0|1,0,0]=3 1765 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 1626a_100000219623_100015343762 [0,1,0,0,1,0|1,0,0]=3 1766 B12R1.20 CC(=O)N(C)c1ccc(cc1)Br 22a_100000219623_100000070787 [0,1,0,0,1,0|1,0,0]=3 1767 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 11a_100000219977_100015343762 [0,1,0,0,1,0|1,0,0]=3 1768 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 1626a_100000219977_100015343762 [0,1,0,0,1,0|1,0,0]=3 1769 B12R1.20 CC(=O)N(C)c1ccc(cc1)C 22a_100000219977_100000070787 [0,1,0,0,1,0|1,0,0]=3 1770 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 11a_100020629279_100015343762 [0,1,0,0,1,0|1,0,0]=3 1771 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 1626a_100020629279_100015343762 [0,1,0,0,1,0|1,0,0]=3 1772 B12R1.20 CC(=O)N(C)c1ccc(cc1)Cl 22a_100020629279_100000070787 [0,1,0,0,1,0|1,0,0]=3 1773 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 11a_100000219829_100015343762 [0,1,0,0,1,0|1,0,0]=3 1774 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 1626a_100000219829_100015343762 [0,1,0,0,1,0|1,0,0]=3 1775 B12R1.20 CC(=O)N(C)c1ccc(cc1)F 22a_100000219829_100000070787 [0,1,0,0,1,0|1,0,0]=3 1776 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 11a_100000743151_100015343762 [0,1,0,0,1,0|1,0,0]=3 1777 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 1626a_100000743151_100015343762 [0,1,0,0,1,0|1,0,0]=3 1778 B12R1.20 CC(=O)N(C)c1ccc(cc1)I 22a_100000743151_100000070787 [0,1,0,0,1,0|1,0,0]=3 1779 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 22a_100000182112_100000070787 [0,1,0,0,1,0|1,0,0]=3 1780 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 271570a_203496583355_200009816415 [0,1,0,0,1,0|1,0,0]=3 1781 B12R1.20 CC(=O)N(C)c1ccc(cc1)O 527a_100000182112_100103153847 [0,1,0,0,1,0|1,0,0]=3 1782 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)C 1458a_100009815954_200000210301 [0,1,0,0,1,0|1,0,1]=4 1783 B12R1.20 CC(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200000210301 [0,1,0,0,1,0|1,0,1]=4 1784 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)Cl 1458a_100011216001_200025704644 [0,1,0,0,1,0|0,0,1]=3 1785 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)F 1458a_100011435297_200025704644 [0,1,0,0,1,0|0,0,1]=3 1786 B12R1.20 CC(C(=O)[13CH3])c1ccc(cc1)O 1458a_100000031422_200025704644 [0,1,0,0,1,0|0,0,1]=3 1787 B12R1.20 Cc1ccc(cc1)C(C)C(=O)[13CH3] 1458a_100000751627_200025704644 [0,1,0,0,1,0|0,0,1]=3 1788 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(=O)[13CH3] 1458a_100009815954_200025704644 [0,1,0,0,1,0|1,0,1]=4 1789 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,1,0,0,1,0|2,0,0]=4 1790 B12R1.20 [13CH3]C(=O)C(F)c1ccc(cc1)Cl 1458a_100012277543_200025704644 [0,1,0,0,1,0|1,0,1]=4 1791 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)Br 1458a_100000756554_200025704644 [0,1,0,0,1,0|1,0,1]=4 1792 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)F 1458a_100000209909_200025704644 [0,1,0,0,1,0|1,0,1]=4 1793 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,1,0,0,1,0|1,0,1]=4 1794 B12R1.20 [13CH3]C(=O)[C@H](O)c1ccc(cc1)Cl 1458a_100009817493_200025704644 [0,1,0,0,1,0|1,0,1]=4 1795 B12R1.124 CC(=C(C)c1c[nH]ccc1=O)C 271570a_200000049429_100009998708 [0,1,0,0,1,0|2,0,0]=4 1796 B12R1.124 CC(=C(C)c1c[nH]ccc1=S)C 271570a_200000049429_200012280681 [0,1,0,0,1,0|2,0,0]=4 1797 B12R1.124 CC(=C(C)c1ccc[nH]c1=O)C 271570a_200000049429_100000050042 [0,1,0,0,1,0|2,0,0]=4 1798 B12R1.124 CC(=C(C)c1cccc[n+]1C)C 271570a_200000049429_100000212160 [0,1,0,0,1,0|2,0,0]=4 1799 B12R1.124 CC(=C(C)c1cccc[n+]1[O-])C 271570a_200000049429_200000042595 [0,1,0,0,1,0|2,0,0]=4 1800 B12R1.124 CC(=C(C)c1ccccc1Br)C 271570a_200000049429_100000695589 [0,1,0,0,1,0|1,0,0]=3 1801 B12R1.124 CC(=C(C)c1ccccc1C)C 271570a_200000049429_100000210755 [0,1,0,0,1,0|1,0,0]=3 1802 B12R1.124 CC(=C(C)c1ccccc1Cl)C 271570a_200000049429_100000764095 [0,1,0,0,1,0|1,0,0]=3 1803 B12R1.124 CC(=C(C)c1ccccc1F)C 271570a_200000049429_100011215700 [0,1,0,0,1,0|1,0,0]=3 1804 B12R1.124 CC(=C(C)c1ccccc1N)C 271570a_200000049429_100000210017 [0,1,0,0,1,0|1,0,0]=3 1805 B12R1.124 CC(=C(C)c1ccccc1O)C 271570a_200000049429_100000739446 [0,1,0,0,1,0|1,0,0]=3 1806 B12R1.124 CC(=C(C)c1cccnc1Br)C 271570a_200000049429_100010202626 [0,1,0,0,1,0|2,0,0]=4 1807 B12R1.124 CC(=C(C)c1cccnc1C)C 271570a_200000049429_100000751574 [0,1,0,0,1,0|2,0,0]=4 1808 B12R1.124 CC(=C(C)c1cccnc1Cl)C 271570a_200000049429_100000036424 [0,1,0,0,1,0|2,0,0]=4 1809 B12R1.124 CC(=C(C)c1cccnc1F)C 271570a_200000049429_100009816115 [0,1,0,0,1,0|2,0,0]=4 1810 B12R1.124 CC(=C(C)c1cccnc1N)C 271570a_200000049429_100000045569 [0,1,0,0,1,0|2,0,0]=4 1811 B12R1.124 CC(=C(C)c1ccncc1Br)C 271570a_200000049429_100000726257 [0,1,0,0,1,0|2,0,0]=4 1812 B12R1.124 CC(=C(C)c1ccncc1C)C 271570a_200000049429_100015191297 [0,1,0,0,1,0|2,0,0]=4 1813 B12R1.124 CC(=C(C)c1ccncc1Cl)C 271570a_200000049429_100000708259 [0,1,0,0,1,0|2,0,0]=4 1814 B12R1.124 CC(=C(C)c1ccncc1F)C 271570a_200000049429_100000047030 [0,1,0,0,1,0|2,0,0]=4 1815 B12R1.124 CC(=C(C)c1ccncc1N)C 271570a_200000049429_100009815883 [0,1,0,0,1,0|2,0,0]=4 1816 B12R1.124 CC(=C(C)c1ccncc1O)C 271570a_200000049429_100009817591 [0,1,0,0,1,0|2,0,0]=4 1817 B12R1.124 CC(=C(C)c1cnccc1Br)C 271570a_200000049429_100010138639 [0,1,0,0,1,0|2,0,0]=4 1818 B12R1.124 CC(=C(C)c1cnccc1C)C 271570a_200000049429_100000761580 [0,1,0,0,1,0|2,0,0]=4 1819 B12R1.124 CC(=C(C)c1cnccc1Cl)C 271570a_200000049429_100009995489 [0,1,0,0,1,0|2,0,0]=4 1820 B12R1.124 CC(=C(C)c1cnccc1F)C 271570a_200000049429_100009820683 [0,1,0,0,1,0|2,0,0]=4 1821 B12R1.124 CC(=C(C)c1cnccc1N)C 271570a_200000049429_100000047001 [0,1,0,0,1,0|2,0,0]=4 1822 B12R1.124 CC(=C(C)c1ncccc1Br)C 271570a_200000049429_100000696092 [0,1,0,0,1,0|2,0,0]=4 1823 B12R1.124 CC(=C(C)c1ncccc1C)C 271570a_200000049429_100000751373 [0,1,0,0,1,0|2,0,0]=4 1824 B12R1.124 CC(=C(C)c1ncccc1Cl)C 271570a_200000049429_100011356963 [0,1,0,0,1,0|2,0,0]=4 1825 B12R1.124 CC(=C(C)c1ncccc1F)C 271570a_200000049429_100000685392 [0,1,0,0,1,0|2,0,0]=4 1826 B12R1.124 CC(=C(C)c1ncccc1N)C 271570a_200000049429_100000688686 [0,1,0,0,1,0|2,0,0]=4 1827 B12R1.124 CC(=C(C)c1ncccc1O)C 271570a_200000049429_100000034122 [0,1,0,0,1,0|2,0,0]=4 1828 B12R1.124 CC(=O)C(C)c1ccccc1Br 1458a_100012359601_200000210301 [0,1,0,0,1,0|0,0,1]=3 1829 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100000070787_100000181259 [0,1,0,0,1,0|0,0,1]=3 1830 B12R1.124 CC(=O)C(C)c1ccccc1Cl 1458a_100011667492_200000210301 [0,1,0,0,1,0|0,0,1]=3 1831 B12R1.124 CC(=O)C(C)c1ccccc1F 1458a_100000070787_200000741388 [0,1,0,0,1,0|0,0,1]=3 1832 B12R1.124 CC(=O)C(O)c1ccccc1Br 1458a_200011356456_200000210301 [0,1,0,0,1,0|1,0,1]=4 1833 B12R1.124 CC(=O)C(O)c1ccccc1Cl 1458a_100011217820_200000210301 [0,1,0,0,1,0|1,0,1]=4 1834 B12R1.124 CC(=O)C(O)c1ccccc1F 1458a_100011219519_200000210301 [0,1,0,0,1,0|1,0,1]=4 1835 B12R1.124 CC(=O)N(C)c1ccccc1Br 11a_100020606079_100015343762 [0,1,0,0,1,0|1,0,0]=3 1836 B12R1.124 CC(=O)N(C)c1ccccc1Br 1626a_100020606079_100015343762 [0,1,0,0,1,0|1,0,0]=3 1837 B12R1.124 CC(=O)N(C)c1ccccc1C 11a_100000219699_100015343762 [0,1,0,0,1,0|1,0,0]=3 1838 B12R1.124 CC(=O)N(C)c1ccccc1C 1626a_100000219699_100015343762 [0,1,0,0,1,0|1,0,0]=3 1839 B12R1.124 CC(=O)N(C)c1ccccc1C 22a_100000219699_100000070787 [0,1,0,0,1,0|1,0,0]=3 1840 B12R1.124 CC(=O)N(C)c1ccccc1Cl 11a_100000219374_100015343762 [0,1,0,0,1,0|1,0,0]=3 1841 B12R1.124 CC(=O)N(C)c1ccccc1Cl 1626a_100000219374_100015343762 [0,1,0,0,1,0|1,0,0]=3 1842 B12R1.124 CC(=O)N(C)c1ccccc1F 11a_100000220357_100015343762 [0,1,0,0,1,0|1,0,0]=3 1843 B12R1.124 CC(=O)N(C)c1ccccc1F 1626a_100000220357_100015343762 [0,1,0,0,1,0|1,0,0]=3 1844 B12R1.124 CC(=O)N(C)c1ccccc1F 22a_100000220357_100000070787 [0,1,0,0,1,0|1,0,0]=3 1845 B12R1.124 CC(=O)N(C)c1ccccc1O 22a_100000033821_100000070787 [0,1,0,0,1,0|1,0,0]=3 1846 B12R1.124 CC(=O)N(C)c1ccccc1O 527a_100000033821_100103153847 [0,1,0,0,1,0|1,0,0]=3 1847 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Br 1458a_100012359601_200025704644 [0,1,0,0,1,0|0,0,1]=3 1848 B12R1.124 CC(C(=O)[13CH3])c1ccccc1Cl 1458a_100011667492_200025704644 [0,1,0,0,1,0|0,0,1]=3 1849 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Br 1458a_200011356456_200025704644 [0,1,0,0,1,0|1,0,1]=4 1850 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1Cl 1458a_100011217820_200025704644 [0,1,0,0,1,0|1,0,1]=4 1851 B12R1.124 [13CH3]C(=O)C(O)c1ccccc1F 1458a_100011219519_200025704644 [0,1,0,0,1,0|1,0,1]=4 1852 B12R1.225 CC(=C(C)c1cc(ccn1)C)C 271570a_200000049429_100000750283 [0,1,0,0,1,0|2,0,0]=4 1853 B12R1.225 CC(=C(C)c1cc(ccn1)Cl)C 271570a_200000049429_100010167805 [0,1,0,0,1,0|2,0,0]=4 1854 B12R1.225 CC(=C(C)c1cc(ccn1)F)C 271570a_200000049429_100009817058 [0,1,0,0,1,0|2,0,0]=4 1855 B12R1.225 CC(=C(C)c1cc(ccn1)N)C 271570a_200000049429_100009814236 [0,1,0,0,1,0|2,0,0]=4 1856 B12R1.225 CC(=C(C)c1cc(ccn1)O)C 271570a_200000049429_100000762945 [0,1,0,0,1,0|2,0,0]=4 1857 B12R1.225 CC(=C(C)c1cc[nH]c(=O)c1)C 271570a_200000049429_100009816521 [0,1,0,0,1,0|2,0,0]=4 1858 B12R1.225 CC(=C(C)c1ccc[n+](c1)C)C 271570a_200000049429_100009996589 [0,1,0,0,1,0|2,0,0]=4 1859 B12R1.225 CC(=C(C)c1ccc[n+](c1)[O-])C 271570a_200000049429_100009815978 [0,1,0,0,1,0|2,0,0]=4 1860 B12R1.225 CC(=C(C)c1cccc(=O)[nH]1)C 271570a_200000049429_100000761760 [0,1,0,0,1,0|2,0,0]=4 1861 B12R1.225 CC(=C(C)c1cccc(c1)Br)C 271570a_200000049429_100000691529 [0,1,0,0,1,0|1,0,0]=3 1862 B12R1.225 CC(=C(C)c1cccc(c1)C)C 271570a_200000049429_100011215228 [0,1,0,0,1,0|1,0,0]=3 1863 B12R1.225 CC(=C(C)c1cccc(c1)Cl)C 271570a_200000049429_100000699651 [0,1,0,0,1,0|1,0,0]=3 1864 B12R1.225 CC(=C(C)c1cccc(c1)F)C 271570a_200000049429_100000685547 [0,1,0,0,1,0|1,0,0]=3 1865 B12R1.225 CC(=C(C)c1cccc(c1)N)C 271570a_200000049429_100000210019 [0,1,0,0,1,0|1,0,0]=3 1866 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,1,0,0,1,0|1,0,0]=3 1867 B12R1.225 CC(=C(C)c1cccc(c1)[S])C 271570a_200000049429_114929384022 [0,1,0,0,1,0|1,0,0]=3 1868 B12R1.225 CC(=C(C)c1cccc(n1)Br)C 271570a_200000049429_100000684672 [0,1,0,0,1,0|2,0,0]=4 1869 B12R1.225 CC(=C(C)c1cccc(n1)C)C 271570a_200000049429_100000742759 [0,1,0,0,1,0|2,0,0]=4 1870 B12R1.225 CC(=C(C)c1cccc(n1)F)C 271570a_200000049429_100009815982 [0,1,0,0,1,0|2,0,0]=4 1871 B12R1.225 CC(=C(C)c1cccc(n1)N)C 271570a_200000049429_100000740741 [0,1,0,0,1,0|2,0,0]=4 1872 B12R1.225 CC(=C(C)c1ccnc(c1)Br)C 271570a_200000049429_100009814637 [0,1,0,0,1,0|2,0,0]=4 1873 B12R1.225 CC(=C(C)c1ccnc(c1)C)C 271570a_200000049429_100000758586 [0,1,0,0,1,0|2,0,0]=4 1874 B12R1.225 CC(=C(C)c1ccnc(c1)Cl)C 271570a_200000049429_100000035001 [0,1,0,0,1,0|2,0,0]=4 1875 B12R1.225 CC(=C(C)c1ccnc(c1)F)C 271570a_200000049429_100009816116 [0,1,0,0,1,0|2,0,0]=4 1876 B12R1.225 CC(=C(C)c1ccnc(c1)N)C 271570a_200000049429_100000744379 [0,1,0,0,1,0|2,0,0]=4 1877 B12R1.225 CC(=C(C)c1cncc(c1)Br)C 271570a_200000049429_100000728054 [0,1,0,0,1,0|2,0,0]=4 1878 B12R1.225 CC(=C(C)c1cncc(c1)C)C 271570a_200000049429_100000760492 [0,1,0,0,1,0|2,0,0]=4 1879 B12R1.225 CC(=C(C)c1cncc(c1)Cl)C 271570a_200000049429_100000049639 [0,1,0,0,1,0|2,0,0]=4 1880 B12R1.225 CC(=C(C)c1cncc(c1)F)C 271570a_200000049429_100000744099 [0,1,0,0,1,0|2,0,0]=4 1881 B12R1.225 CC(=C(C)c1cncc(c1)N)C 271570a_200000049429_100000687067 [0,1,0,0,1,0|2,0,0]=4 1882 B12R1.225 CC(=C(C)c1cncc(c1)O)C 271570a_200000049429_100000754920 [0,1,0,0,1,0|2,0,0]=4 1883 B12R1.225 CC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_200000210301 [0,1,0,0,1,0|0,0,1]=3 1884 B12R1.225 CC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_200000210301 [0,1,0,0,1,0|0,0,1]=3 1885 B12R1.225 CC(=O)C(C)c1cccc(c1)F 1458a_100000762896_200000210301 [0,1,0,0,1,0|0,0,1]=3 1886 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,1,0,0,1,0|1,0,1]=4 1887 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [0,1,0,0,1,0|1,0,1]=4 1888 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [0,1,0,0,1,0|1,0,1]=4 1889 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100015343762 [0,1,0,0,1,0|1,0,0]=3 1890 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100015343762 [0,1,0,0,1,0|1,0,0]=3 1891 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000070787 [0,1,0,0,1,0|1,0,0]=3 1892 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100103153847 [0,1,0,0,1,0|1,0,0]=3 1893 B12R1.225 CC(=O)N(C)c1cccc(c1)C 11a_100000219674_100015343762 [0,1,0,0,1,0|1,0,0]=3 1894 B12R1.225 CC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100015343762 [0,1,0,0,1,0|1,0,0]=3 1895 B12R1.225 CC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000070787 [0,1,0,0,1,0|1,0,0]=3 1896 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100015343762 [0,1,0,0,1,0|1,0,0]=3 1897 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100015343762 [0,1,0,0,1,0|1,0,0]=3 1898 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000070787 [0,1,0,0,1,0|1,0,0]=3 1899 B12R1.225 CC(=O)N(C)c1cccc(c1)F 11a_100020633736_100015343762 [0,1,0,0,1,0|1,0,0]=3 1900 B12R1.225 CC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100015343762 [0,1,0,0,1,0|1,0,0]=3 1901 B12R1.225 CC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000070787 [0,1,0,0,1,0|1,0,0]=3 1902 B12R1.225 CC(=O)N(C)c1cccc(c1)I 11a_100000221217_100015343762 [0,1,0,0,1,0|1,0,0]=3 1903 B12R1.225 CC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100015343762 [0,1,0,0,1,0|1,0,0]=3 1904 B12R1.225 CC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000070787 [0,1,0,0,1,0|1,0,0]=3 1905 B12R1.225 CC(=O)N(C)c1cccc(c1)O 527a_100000756613_100103153847 [0,1,0,0,1,0|1,0,0]=3 1906 B12R1.225 CC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_200000210301 [0,1,0,0,1,0|0,0,1]=3 1907 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000722698_200025704644 [0,1,0,0,1,0|0,0,1]=3 1908 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000762818_200025704644 [0,1,0,0,1,0|0,0,1]=3 1909 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)F 1458a_100000762896_200025704644 [0,1,0,0,1,0|0,0,1]=3 1910 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,1,0,0,1,0|1,0,1]=4 1911 B12R1.225 Cc1cccc(c1)[C@@H](C)C(=O)[13CH3] 1458a_200009911544_200025704644 [0,1,0,0,1,0|0,0,1]=3 1912 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [0,1,0,0,1,0|1,0,1]=4 1913 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [0,1,0,0,1,0|1,0,1]=4 1914 B12R1.253 CC(=O)C(C)(C)c1ccccc1 1458a_100000070787_100000034625 [0,1,0,0,1,0|0,0,1]=3 1915 B12R1.253 CC(=O)C(C)(C)c1ccccc1 1458a_100000211857_200000210301 [0,1,0,0,1,0|0,0,1]=3 1916 B12R1.253 CC(=O)C(F)(F)c1ccccc1 1458a_100000070787_100000036403 [0,1,0,0,1,0|1,0,1]=4 1917 B12R1.253 CC(=O)[C@](C)(O)c1ccccc1 1458a_100000753667_200000210301 [0,1,0,0,1,0|0,0,1]=3 1918 B12R1.253 CC(C)(C(=O)[13CH3])c1ccccc1 1458a_100000211857_200025704644 [0,1,0,0,1,0|0,0,1]=3 1919 B12R1.253 C[C@](O)(C(=O)[13CH3])c1ccccc1 1458a_100000753667_200025704644 [0,1,0,0,1,0|0,0,1]=3 1920 B12R1.478 C=C(C)C(OC)c1ccccc1 34a_200011216824_200000210301 [0,1,0,0,1,0|1,0,1]=4 1921 B12R1.478 C=C(C)C(OC)c1ccccc1 7a_200011216824_200000210301 [0,1,0,0,1,0|1,0,1]=4 1922 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 34a_200011216824_200025704644 [0,1,0,0,1,0|1,0,1]=4 1923 B12R1.478 C=C(C)C(O[13CH3])c1ccccc1 7a_200011216824_200025704644 [0,1,0,0,1,0|1,0,1]=4 1924 B12R1.478 CC(=O)C(CO)c1ccccc1 1458a_100011218805_200000210301 [0,1,0,0,1,0|0,0,1]=3 1925 B12R1.478 CC(=O)C(S[13CH3])c1ccccc1 62a_100009888967_200025704644 [0,1,0,0,1,0|0,0,1]=3 1926 B12R1.478 CC(=O)C(S[13CH3])c1ccccc1 62a_200025704644_100009888967 [0,1,0,0,1,0|0,0,1]=3 1927 B12R1.478 CCC(C(=O)C)c1ccccc1 1458a_100000211302_200000210301 [0,1,0,0,1,0|0,0,1]=3 1928 B12R1.478 CCC(C(=O)[13CH3])c1ccccc1 1458a_100000211302_200025704644 [0,1,0,0,1,0|0,0,1]=3 1929 B12R1.478 CCN(C(=O)C)c1ccccc1 11a_100000210013_100015343762 [0,1,0,0,1,0|1,0,0]=3 1930 B12R1.478 CCN(C(=O)C)c1ccccc1 1626a_100000210013_100015343762 [0,1,0,0,1,0|1,0,0]=3 1931 B12R1.478 CCN(C(=O)C)c1ccccc1 22a_100000210013_100000070787 [0,1,0,0,1,0|1,0,0]=3 1932 B12R1.478 CNC(C(=O)C)c1ccccc1 2230a_106832991635_100009888967 [0,1,0,0,1,0|0,0,1]=3 1933 B12R1.478 CNC(C(=O)C)c1ccccc1 7a_106832991635_100009888967 [0,1,0,0,1,0|0,0,1]=3 1934 B12R1.478 CNC(C(=O)N)c1ccccc1 2230a_106832991635_100000188848 [0,1,0,0,1,0|1,0,1]=4 1935 B12R1.478 CNC(C(=O)N)c1ccccc1 7a_106832991635_100000188848 [0,1,0,0,1,0|1,0,1]=4 1936 B12R1.478 CNC(C(=O)O)c1ccccc1 269956a_100000230147_200000210301 [0,1,0,0,1,0|1,0,1]=4 1937 B12R1.478 CN[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_200000210301 [0,1,0,0,1,0|1,0,1]=4 1938 B12R1.478 COC(C(=O)N)c1ccccc1 34a_100011200849_200000210301 [0,1,0,0,1,0|1,0,1]=4 1939 B12R1.478 COC(C(=O)N)c1ccccc1 7a_100011200849_200000210301 [0,1,0,0,1,0|1,0,1]=4 1940 B12R1.478 CO[C@@H](C(=O)C)c1ccccc1 1458a_100000698336_200000210301 [0,1,0,0,1,0|0,0,1]=3 1941 B12R1.478 CO[C@@H](C(=O)[13CH3])c1ccccc1 1458a_100000698336_200025704644 [0,1,0,0,1,0|0,0,1]=3 1942 B12R1.478 CSC(C(=O)C)c1ccccc1 62a_100009888967_200000210301 [0,1,0,0,1,0|0,0,1]=3 1943 B12R1.478 CSC(C(=O)C)c1ccccc1 62a_200000210301_100009888967 [0,1,0,0,1,0|0,0,1]=3 1944 B12R1.478 CSC(C(=O)N)c1ccccc1 62a_100000188848_200000210301 [0,1,0,0,1,0|1,0,1]=4 1945 B12R1.478 CSC(C(=O)N)c1ccccc1 62a_200000210301_100000188848 [0,1,0,0,1,0|1,0,1]=4 1946 B12R1.478 [13CH3]C(=O)C(CO)c1ccccc1 1458a_100011218805_200025704644 [0,1,0,0,1,0|0,0,1]=3 1947 B12R1.478 [13CH3]NC(C(=O)O)c1ccccc1 269956a_100000230147_200025704644 [0,1,0,0,1,0|1,0,1]=4 1948 B12R1.478 [13CH3]N[C@@H](C(=O)N)c1ccccc1 2230a_100011423151_200025704644 [0,1,0,0,1,0|1,0,1]=4 1949 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 34a_100011200849_200025704644 [0,1,0,0,1,0|1,0,1]=4 1950 B12R1.478 [13CH3]OC(C(=O)N)c1ccccc1 7a_100011200849_200025704644 [0,1,0,0,1,0|1,0,1]=4 1951 B12R1.478 [13CH3]SC(C(=O)N)c1ccccc1 62a_100000188848_200025704644 [0,1,0,0,1,0|1,0,1]=4 1952 B12R1.478 [13CH3]SC(C(=O)N)c1ccccc1 62a_200025704644_100000188848 [0,1,0,0,1,0|1,0,1]=4 1953 B14R1.337 CC(=O)CC(=O)Cc1ccccc1Br 1458a_100000070787_100000700504 [0,1,0,0,0,1|1,0,1]=4 1954 B14R1.337 CC(=O)CC(=O)Cc1ccccc1C 1458a_100000070787_100011223134 [0,1,0,0,0,1|1,0,1]=4 1955 B14R1.337 CC(=O)CC(=O)Nc1ccccc1Br 1458a_100000070787_100000182372 [0,1,0,0,0,1|2,0,0]=4 1956 B14R1.337 CC(=O)CC(=O)Nc1ccccc1C 1458a_100000070787_100000183529 [0,1,0,0,0,1|2,0,0]=4 1957 B14R1.337 CC(=O)CC(=O)Nc1ccccc1Cl 1458a_100000070787_100000182448 [0,1,0,0,0,1|2,0,0]=4 1958 B14R1.337 CC(=O)CC(=O)Nc1ccccc1F 1458a_100000070787_100000182988 [0,1,0,0,0,1|2,0,0]=4 1959 B14R1.337 CC(=O)CC(=O)Nc1ccccc1I 1458a_100000070787_100000180142 [0,1,0,0,0,1|2,0,0]=4 1960 B14R1.337 CC(=O)CC(=O)Nc1ccccc1O 1458a_100000070787_100000014494 [0,1,0,0,0,1|2,0,0]=4 1961 B14R1.337 CC(=O)CC(=O)Nc1ccccc1O 271570a_203496583355_200000187717 [0,1,0,0,0,1|2,0,0]=4 1962 B14R1.337 CC(=O)CN(C)Cc1ccccc1F 1458a_100015184060_200000210301 [0,1,0,0,0,1|1,0,1]=4 1963 B14R1.337 CC(=O)OC(C)Sc1ccccc1Br 62a_100000695589_100009818208 [0,1,0,0,0,1|1,0,1]=4 1964 B14R1.337 CC(=O)OC(C)Sc1ccccc1Br 62a_100009818208_100000695589 [0,1,0,0,0,1|1,0,1]=4 1965 B14R1.337 CC(=O)OC(C)Sc1ccccc1C 62a_100000210755_100009818208 [0,1,0,0,0,1|1,0,1]=4 1966 B14R1.337 CC(=O)OC(C)Sc1ccccc1C 62a_100009818208_100000210755 [0,1,0,0,0,1|1,0,1]=4 1967 B14R1.337 CC(=O)OC(C)Sc1ccccc1Cl 62a_100000764095_100009818208 [0,1,0,0,0,1|1,0,1]=4 1968 B14R1.337 CC(=O)OC(C)Sc1ccccc1Cl 62a_100009818208_100000764095 [0,1,0,0,0,1|1,0,1]=4 1969 B14R1.337 CC(=O)OC(C)Sc1ccccc1F 62a_100009818208_100011215700 [0,1,0,0,0,1|1,0,1]=4 1970 B14R1.337 CC(=O)OC(C)Sc1ccccc1F 62a_100011215700_100009818208 [0,1,0,0,0,1|1,0,1]=4 1971 B14R1.337 CC(=O)OC(C)Sc1ccccc1N 62a_100000210017_100009818208 [0,1,0,0,0,1|1,0,1]=4 1972 B14R1.337 CC(=O)OC(C)Sc1ccccc1N 62a_100009818208_100000210017 [0,1,0,0,0,1|1,0,1]=4 1973 B14R1.337 CC(=O)OC(C)Sc1ccccc1O 62a_100000739446_100009818208 [0,1,0,0,0,1|1,0,1]=4 1974 B14R1.337 CC(=O)OC(C)Sc1ccccc1O 62a_100009818208_100000739446 [0,1,0,0,0,1|1,0,1]=4 1975 B14R1.337 CN(CC(=O)[13CH3])Cc1ccccc1F 1458a_100015184060_200025704644 [0,1,0,0,0,1|1,0,1]=4 1976 B14R1.417 C=C(C(=O)CC(=O)N)c1ccccc1 1458a_100000065200_100000187820 [0,1,0,0,0,1|2,0,0]=4 1977 B14R1.417 C=C(C(=O)CC(=O)[O-])c1ccccc1 1458a_100000065200_100020667443 [0,1,0,0,0,1|2,0,0]=4 1978 B14R1.417 C=C(C)CC(=O)C(=C)c1ccccc1 1458a_100000065200_100000748629 [0,1,0,0,0,1|2,0,0]=4 1979 B14R1.417 C=C(C)CN(C)C(=O)c1ccccc1 11a_100000225649_100000185807 [0,1,0,0,0,1|2,0,0]=4 1980 B14R1.417 C=C(C)CN(C)C(=O)c1ccccc1 1626a_100000225649_100000185807 [0,1,0,0,0,1|2,0,0]=4 1981 B14R1.417 C=C(C)CN(C)C(=O)c1ccccc1 527a_100000225649_100000185807 [0,1,0,0,0,1|2,0,0]=4 1982 B14R1.417 CC(=O)CC(=O)N(C)c1ccccc1 1458a_100000070787_100000183487 [0,1,0,0,0,1|2,0,0]=4 1983 B14R1.417 CC(=O)CN(C)C(=O)c1ccccc1 1458a_100000194983_200000210301 [0,1,0,0,0,1|1,0,0]=3 1984 B14R1.417 CC(=O)OC(C)C(=O)c1ccccc1 1458a_100000185807_100009818208 [0,1,0,0,0,1|0,0,1]=3 1985 B14R1.417 CC(=O)OC(C)N(C)c1ccccc1 269982a_100000210012_100009818208 [0,1,0,0,0,1|1,0,1]=4 1986 B14R1.417 CN(CC(=O)N)C(=O)c1ccccc1 11a_100000739694_100000185807 [0,1,0,0,0,1|2,0,0]=4 1987 B14R1.417 CN(CC(=O)N)C(=O)c1ccccc1 527a_100000739694_100000185807 [0,1,0,0,0,1|2,0,0]=4 1988 B14R1.417 CN(CC(=O)[13CH3])C(=O)c1ccccc1 1458a_100000194983_200025704644 [0,1,0,0,0,1|1,0,0]=3 1989 B14R1.425 C/C(=C\c1ccccc1)/C(=O)C(C)C 1458a_100016990649_100000210206 [0,1,0,0,0,1|1,0,1]=4 1990 B14R1.425 C/C(=C\c1ccccc1)/C(=O)N(C)C 11a_100102631434_100016990649 [0,1,0,0,0,1|2,0,0]=4 1991 B14R1.425 C/C(=C\c1ccccc1)/C(=O)N(C)C 1626a_100102631434_100016990649 [0,1,0,0,0,1|2,0,0]=4 1992 B14R1.425 C/C(=C\c1ccccc1)/C(=O)N(C)C 527a_100102631434_100016990649 [0,1,0,0,0,1|2,0,0]=4 1993 B14R1.425 CC(=O)C(C)C(=O)Nc1ccccc1 1458a_100000070787_100000183986 [0,1,0,0,0,1|2,0,0]=4 1994 B14R1.425 CC(=O)C(C)C(=O)Nc1ccccc1 1458a_100012277477_200000210301 [0,1,0,0,0,1|2,0,0]=4 1995 B14R1.425 CC(=O)C(C)N(C)Cc1ccccc1 1458a_100000757622_200000210301 [0,1,0,0,0,1|1,0,1]=4 1996 B14R1.425 CC(=O)C(C)N(C)Cc1ccccc1 2230a_100000186898_100009814033 [0,1,0,0,0,1|1,0,1]=4 1997 B14R1.425 CC(=O)C(C)N(C)Cc1ccccc1 269982a_100000186898_100009814033 [0,1,0,0,0,1|1,0,1]=4 1998 B14R1.425 CC(C(=O)[13CH3])C(=O)Nc1ccccc1 1458a_100012277477_200025704644 [0,1,0,0,0,1|2,0,0]=4 1999 B14R1.425 CC(C(=O)[13CH3])N(C)Cc1ccccc1 1458a_100000757622_200025704644 [0,1,0,0,0,1|1,0,1]=4 2000 B14R1.549 CC(=O)NC(CO)Cc1ccccc1 240690a_100000739027_100015343762 [0,1,0,0,0,1|0,0,2]=4 2001 B14R1.549 CC(=O)NC(CO)Cc1ccccc1 527a_100000739027_100103153847 [0,1,0,0,0,1|0,0,2]=4 2002 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Br 1458a_100000070787_100000183692 [0,1,0,0,0,1|2,0,0]=4 2003 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Br 1458a_100011623802_200000210301 [0,1,0,0,0,1|2,0,0]=4 2004 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)C 1458a_100000070787_100000182914 [0,1,0,0,0,1|2,0,0]=4 2005 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)Cl 1458a_100000070787_100000182960 [0,1,0,0,0,1|2,0,0]=4 2006 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)F 1458a_100000070787_100000181725 [0,1,0,0,0,1|2,0,0]=4 2007 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)F 1458a_200000189458_200000210301 [0,1,0,0,0,1|2,0,0]=4 2008 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)I 1458a_100000070787_100000183000 [0,1,0,0,0,1|2,0,0]=4 2009 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)O 1458a_100000070787_100000233757 [0,1,0,0,0,1|2,0,0]=4 2010 B14R1.698 CC(=O)CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000182854 [0,1,0,0,0,1|2,0,0]=4 2011 B14R1.698 CC(=O)CC(=O)Oc1ccc(cc1)Br 1458a_100000070787_200010760497 [0,1,0,0,0,1|2,0,0]=4 2012 B14R1.698 CC(=O)CC(C)Oc1ccc(cc1)F 1458a_100000070787_100010228477 [0,1,0,0,0,1|1,0,1]=4 2013 B14R1.698 CC(=O)CC(C)Sc1ccc(cc1)Cl 1458a_100011219718_200000210301 [0,1,0,0,0,1|1,0,1]=4 2014 B14R1.698 CC(=O)CN(C)Cc1ccc(cc1)C 1458a_100015185648_200000210301 [0,1,0,0,0,1|1,0,1]=4 2015 B14R1.698 CC(=O)NC(C)Cc1ccc(cc1)O 240690a_100102634573_100015343762 [0,1,0,0,0,1|0,0,2]=4 2016 B14R1.698 CC(=O)NC(C)Cc1ccc(cc1)O 527a_100102634573_100103153847 [0,1,0,0,0,1|0,0,2]=4 2017 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)Br 62a_100000752885_100009818208 [0,1,0,0,0,1|1,0,1]=4 2018 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)Br 62a_100009818208_100000752885 [0,1,0,0,0,1|1,0,1]=4 2019 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)C 62a_100000186775_100009818208 [0,1,0,0,0,1|1,0,1]=4 2020 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)C 62a_100009818208_100000186775 [0,1,0,0,0,1|1,0,1]=4 2021 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)Cl 62a_100000755918_100009818208 [0,1,0,0,0,1|1,0,1]=4 2022 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)Cl 62a_100009818208_100000755918 [0,1,0,0,0,1|1,0,1]=4 2023 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)F 62a_100000211213_100009818208 [0,1,0,0,0,1|1,0,1]=4 2024 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)F 62a_100009818208_100000211213 [0,1,0,0,0,1|1,0,1]=4 2025 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)N 62a_100000185761_100009818208 [0,1,0,0,0,1|1,0,1]=4 2026 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)N 62a_100009818208_100000185761 [0,1,0,0,0,1|1,0,1]=4 2027 B14R1.698 CC(=O)OC(C)Sc1ccc(cc1)O 62a_100009818208_100000185759 [0,1,0,0,0,1|1,0,1]=4 2028 B14R1.698 CC(CC(=O)[13CH3])Sc1ccc(cc1)Cl 1458a_100011219718_200025704644 [0,1,0,0,0,1|1,0,1]=4 2029 B14R1.698 Cc1ccc(cc1)CN(C)CC(=O)[13CH3] 1458a_100015185648_200025704644 [0,1,0,0,0,1|1,0,1]=4 2030 B14R1.698 [13CH3]C(=O)CC(=O)Nc1ccc(cc1)Br 1458a_100011623802_200025704644 [0,1,0,0,0,1|2,0,0]=4 2031 B14R1.698 [13CH3]C(=O)CC(=O)Nc1ccc(cc1)F 1458a_200000189458_200025704644 [0,1,0,0,0,1|2,0,0]=4 2032 B14R1.743 CCC(=O)CC(=O)Cc1ccccc1 1458a_100000210414_100000233483 [0,1,0,0,0,1|1,0,1]=4 2033 B14R1.743 CCC(=O)CC(=O)Nc1ccccc1 1458a_100000210414_100000182850 [0,1,0,0,0,1|2,0,0]=4 2034 B14R1.743 CCC(=O)CC(=O)Oc1ccccc1 1458a_100000210414_100009813826 [0,1,0,0,0,1|2,0,0]=4 2035 B14R1.743 CCC(=O)CN(C)Cc1ccccc1 1458a_100000745601_100000210202 [0,1,0,0,0,1|1,0,1]=4 2036 B14R1.743 CCC(=O)CN(C)Cc1ccccc1 269982a_100000186898_100000747405 [0,1,0,0,0,1|1,0,1]=4 2037 B14R1.743 CN(CC(=O)CF)Cc1ccccc1 1458a_100000745601_100015361967 [0,1,0,0,0,1|1,0,1]=4 2038 B14R1.743 CNC(=O)CC(=O)Oc1ccccc1 240690a_100102657272_200000075362 [0,1,0,0,0,1|2,0,0]=4 2039 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 11a_106832991635_100000745601 [0,1,0,0,0,1|1,0,1]=4 2040 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 2230a_100000186898_100000183359 [0,1,0,0,0,1|1,0,1]=4 2041 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 2230a_100000189611_100015291786 [0,1,0,0,0,1|1,0,1]=4 2042 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 240690a_100102657272_100000745601 [0,1,0,0,0,1|1,0,1]=4 2043 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 269982a_100000186898_100000183359 [0,1,0,0,0,1|1,0,1]=4 2044 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 270004a_100000189611_100015611070 [0,1,0,0,0,1|1,0,1]=4 2045 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 527a_100102657272_100000745601 [0,1,0,0,0,1|1,0,1]=4 2046 B14R1.743 COC(=O)CC(=O)Cc1ccccc1 1458a_100000211351_100015291786 [0,1,0,0,0,1|1,0,1]=4 2047 B14R1.743 COC(=O)CC(=O)Nc1ccccc1 22a_100000106764_100000211351 [0,1,0,0,0,1|2,0,0]=4 2048 B14R1.743 COC(=O)CC(C)Nc1ccccc1 34a_100000106764_100009817358 [0,1,0,0,0,1|1,0,1]=4 2049 B14R1.743 COC(=O)CC(C)Oc1ccccc1 34a_100000210340_100009817358 [0,1,0,0,0,1|1,0,1]=4 2050 B14R1.743 COC(=O)CC(C)Oc1ccccc1 7a_100000210340_100009817358 [0,1,0,0,0,1|1,0,1]=4 2051 B14R1.743 COC(=O)CC(C)Sc1ccccc1 62a_100000719477_100009817358 [0,1,0,0,0,1|1,0,1]=4 2052 B14R1.743 COC(=O)CC(C)Sc1ccccc1 62a_100009817358_100000041952 [0,1,0,0,0,1|1,0,1]=4 2053 B14R1.743 COC(=O)CN(C)Cc1ccccc1 2230a_100000186898_100000747449 [0,1,0,0,0,1|1,0,1]=4 2054 B14R1.743 COC(=O)CN(C)Cc1ccccc1 2230a_100000198492_100015291786 [0,1,0,0,0,1|1,0,1]=4 2055 B14R1.743 COC(=O)CN(C)Cc1ccccc1 2230a_100000219879_200000210301 [0,1,0,0,0,1|1,0,1]=4 2056 B14R1.743 COC(=O)CN(C)Cc1ccccc1 269982a_100000186898_100000747449 [0,1,0,0,0,1|1,0,1]=4 2057 B14R1.743 COC(=O)CN(C)Cc1ccccc1 269982a_100000219879_200000210301 [0,1,0,0,0,1|1,0,1]=4 2058 B14R1.743 COC(=O)CN(C)Cc1ccccc1 270004a_100000198492_100015611070 [0,1,0,0,0,1|1,0,1]=4 2059 B14R1.743 COC(=O)CN([13CH3])Cc1ccccc1 2230a_100000219879_200025704644 [0,1,0,0,0,1|1,0,1]=4 2060 B14R1.743 COC(=O)CN([13CH3])Cc1ccccc1 269982a_100000219879_200025704644 [0,1,0,0,0,1|1,0,1]=4 2061 B14R1.743 O=C(CO)CC(=O)Cc1ccccc1 1458a_100000210174_100000233483 [0,1,0,0,0,1|1,0,1]=4 2062 B14R1.743 O=C(CO)CC(=O)Nc1ccccc1 1458a_100000210174_100000182850 [0,1,0,0,0,1|2,0,0]=4 2063 B14R1.743 O=C(CO)CC(=O)Oc1ccccc1 1458a_100000210174_100009813826 [0,1,0,0,0,1|2,0,0]=4 2064 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)Br 1458a_100000070787_100000183509 [0,1,0,0,0,1|2,0,0]=4 2065 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)C 1458a_100000070787_100000182861 [0,1,0,0,0,1|2,0,0]=4 2066 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)C 1458a_200011623804_200000210301 [0,1,0,0,0,1|2,0,0]=4 2067 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)Cl 1458a_100000070787_100000182995 [0,1,0,0,0,1|2,0,0]=4 2068 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)F 1458a_100000070787_100000183335 [0,1,0,0,0,1|2,0,0]=4 2069 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)O 1458a_100000070787_100011236192 [0,1,0,0,0,1|2,0,0]=4 2070 B14R1.5978 CC(=O)CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000187718 [0,1,0,0,0,1|2,0,0]=4 2071 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)Br 62a_100000691529_100009818208 [0,1,0,0,0,1|1,0,1]=4 2072 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)Br 62a_100009818208_100000691529 [0,1,0,0,0,1|1,0,1]=4 2073 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)C 62a_100009818208_100011215228 [0,1,0,0,0,1|1,0,1]=4 2074 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)C 62a_100011215228_100009818208 [0,1,0,0,0,1|1,0,1]=4 2075 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)Cl 62a_100000699651_100009818208 [0,1,0,0,0,1|1,0,1]=4 2076 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)Cl 62a_100009818208_100000699651 [0,1,0,0,0,1|1,0,1]=4 2077 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)F 62a_100000685547_100009818208 [0,1,0,0,0,1|1,0,1]=4 2078 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)F 62a_100009818208_100000685547 [0,1,0,0,0,1|1,0,1]=4 2079 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)N 62a_100000210019_100009818208 [0,1,0,0,0,1|1,0,1]=4 2080 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)N 62a_100009818208_100000210019 [0,1,0,0,0,1|1,0,1]=4 2081 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)O 62a_100009818208_100000211634 [0,1,0,0,0,1|1,0,1]=4 2082 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)[S] 62a_100009818208_114929384022 [0,1,0,0,0,1|1,0,1]=4 2083 B14R1.5978 CC(=O)OC(C)Sc1cccc(c1)[S] 62a_114929384022_100009818208 [0,1,0,0,0,1|1,0,1]=4 2084 B14R1.5978 Cc1cccc(c1)NC(=O)CC(=O)[13CH3] 1458a_200011623804_200025704644 [0,1,0,0,0,1|2,0,0]=4 2085 B14R1.161 C=C(C)C(=NNc1ccccc1Br)C 4a_100000241748_100011216138 [0,1,0,0,0,1|2,0,0]=4 2086 B14R1.161 C=C(C)C(=NNc1ccccc1C)C 4a_100000184220_100011216138 [0,1,0,0,0,1|2,0,0]=4 2087 B14R1.161 C=C(C)C(=NNc1ccccc1Cl)C 4a_100000683529_100011216138 [0,1,0,0,0,1|2,0,0]=4 2088 B14R1.161 C=C(C)C(=NNc1ccccc1F)C 4a_100000239246_100011216138 [0,1,0,0,0,1|2,0,0]=4 2089 B14R1.161 C=C(C)C(=NNc1ccccc1I)C 4a_100011218156_100011216138 [0,1,0,0,0,1|2,0,0]=4 2090 B14R1.161 CC(=O)C(=O)CNc1ccccc1Br 34a_100000210017_100011261029 [0,1,0,0,0,1|1,0,1]=4 2091 B14R1.161 CC(=O)C(=O)CNc1ccccc1C 34a_100015192222_100011261029 [0,1,0,0,0,1|1,0,1]=4 2092 B14R1.161 CC(=O)C(=O)CNc1ccccc1Cl 34a_100000185783_100011261029 [0,1,0,0,0,1|1,0,1]=4 2093 B14R1.161 CC(=O)C(=O)CNc1ccccc1F 34a_100000210422_100011261029 [0,1,0,0,0,1|1,0,1]=4 2094 B14R1.161 CC(=O)C(=O)CNc1ccccc1I 34a_100000210053_100011261029 [0,1,0,0,0,1|1,0,1]=4 2095 B14R1.161 CC(=O)C(=O)CNc1ccccc1O 34a_100000185747_100011261029 [0,1,0,0,0,1|1,0,1]=4 2096 B14R1.161 CC(=O)C(=O)COc1ccccc1Br 34a_100000181306_100011261029 [0,1,0,0,0,1|1,0,1]=4 2097 B14R1.161 CC(=O)C(=O)COc1ccccc1C 34a_100000210338_100011261029 [0,1,0,0,0,1|1,0,1]=4 2098 B14R1.161 CC(=O)C(=O)COc1ccccc1Cl 34a_100000210172_100011261029 [0,1,0,0,0,1|1,0,1]=4 2099 B14R1.161 CC(=O)C(=O)COc1ccccc1F 34a_100000210171_100011261029 [0,1,0,0,0,1|1,0,1]=4 2100 B14R1.161 CC(=O)C(=O)COc1ccccc1I 34a_100000739446_100011261029 [0,1,0,0,0,1|1,0,1]=4 2101 B14R1.161 CC(=O)C(=O)COc1ccccc1N 34a_100000185747_100011261029 [0,1,0,0,0,1|1,0,1]=4 2102 B14R1.161 CC(=O)C(=O)CSc1ccccc1Br 62a_100000695589_100011261029 [0,1,0,0,0,1|1,0,1]=4 2103 B14R1.161 CC(=O)C(=O)CSc1ccccc1Br 62a_100011261029_100000695589 [0,1,0,0,0,1|1,0,1]=4 2104 B14R1.161 CC(=O)C(=O)CSc1ccccc1C 62a_100000210755_100011261029 [0,1,0,0,0,1|1,0,1]=4 2105 B14R1.161 CC(=O)C(=O)CSc1ccccc1C 62a_100011261029_100000210755 [0,1,0,0,0,1|1,0,1]=4 2106 B14R1.161 CC(=O)C(=O)CSc1ccccc1Cl 62a_100000764095_100011261029 [0,1,0,0,0,1|1,0,1]=4 2107 B14R1.161 CC(=O)C(=O)CSc1ccccc1Cl 62a_100011261029_100000764095 [0,1,0,0,0,1|1,0,1]=4 2108 B14R1.161 CC(=O)C(=O)CSc1ccccc1F 62a_100011215700_100011261029 [0,1,0,0,0,1|1,0,1]=4 2109 B14R1.161 CC(=O)C(=O)CSc1ccccc1F 62a_100011261029_100011215700 [0,1,0,0,0,1|1,0,1]=4 2110 B14R1.161 CC(=O)C(=O)CSc1ccccc1N 62a_100000210017_100011261029 [0,1,0,0,0,1|1,0,1]=4 2111 B14R1.161 CC(=O)C(=O)CSc1ccccc1N 62a_100011261029_100000210017 [0,1,0,0,0,1|1,0,1]=4 2112 B14R1.161 CC(=O)C(=O)CSc1ccccc1O 62a_100000739446_100011261029 [0,1,0,0,0,1|1,0,1]=4 2113 B14R1.161 CC(=O)C(=O)CSc1ccccc1O 62a_100011261029_100000739446 [0,1,0,0,0,1|1,0,1]=4 2114 B14R1.161 CC(=O)C(C)NCc1ccccc1Br 2230a_100000689332_100009814033 [0,1,0,0,0,1|0,0,2]=4 2115 B14R1.161 CC(=O)C(C)NCc1ccccc1Cl 2230a_100000174879_100009814033 [0,1,0,0,0,1|0,0,2]=4 2116 B14R1.161 CC(=O)C(C)OCc1ccccc1Br 34a_100000212229_100000184730 [0,1,0,0,0,1|0,0,2]=4 2117 B14R1.161 CC(=O)C(C)OCc1ccccc1Br 7a_100000756307_100000179758 [0,1,0,0,0,1|0,0,2]=4 2118 B14R1.161 CC(=O)C(C)OCc1ccccc1C 34a_100000212229_100000211839 [0,1,0,0,0,1|0,0,2]=4 2119 B14R1.161 CC(=O)C(C)OCc1ccccc1C 7a_100000698903_100000179758 [0,1,0,0,0,1|0,0,2]=4 2120 B14R1.161 CC(=O)C(C)OCc1ccccc1Cl 34a_100000212229_100000187162 [0,1,0,0,0,1|0,0,2]=4 2121 B14R1.161 CC(=O)C(C)OCc1ccccc1Cl 7a_100000210847_100000179758 [0,1,0,0,0,1|0,0,2]=4 2122 B14R1.161 CC(=O)C(C)OCc1ccccc1F 34a_100000212229_100000211605 [0,1,0,0,0,1|0,0,2]=4 2123 B14R1.161 CC(=O)C(C)OCc1ccccc1F 7a_100000211962_100000179758 [0,1,0,0,0,1|0,0,2]=4 2124 B14R1.161 CC(=O)C(C)OCc1ccccc1I 34a_100000212229_100011215278 [0,1,0,0,0,1|0,0,2]=4 2125 B14R1.161 CC(=O)C(C)OCc1ccccc1I 7a_100000187465_100000179758 [0,1,0,0,0,1|0,0,2]=4 2126 B14R1.161 CC(=O)C(C)SCc1ccccc1Br 62a_100000184730_100009814033 [0,1,0,0,0,1|0,0,2]=4 2127 B14R1.161 CC(=O)C(C)SCc1ccccc1Br 62a_100009814033_100000184730 [0,1,0,0,0,1|0,0,2]=4 2128 B14R1.161 CC(=O)C(C)SCc1ccccc1C 62a_100000211839_100009814033 [0,1,0,0,0,1|0,0,2]=4 2129 B14R1.161 CC(=O)C(C)SCc1ccccc1C 62a_100009814033_100000211839 [0,1,0,0,0,1|0,0,2]=4 2130 B14R1.161 CC(=O)C(C)SCc1ccccc1Cl 62a_100000187162_100009814033 [0,1,0,0,0,1|0,0,2]=4 2131 B14R1.161 CC(=O)C(C)SCc1ccccc1Cl 62a_100009814033_100000187162 [0,1,0,0,0,1|0,0,2]=4 2132 B14R1.161 CC(=O)C(C)SCc1ccccc1F 62a_100000211605_100009814033 [0,1,0,0,0,1|0,0,2]=4 2133 B14R1.161 CC(=O)C(C)SCc1ccccc1F 62a_100009814033_100000211605 [0,1,0,0,0,1|0,0,2]=4 2134 B14R1.161 CC(=O)C(C)SCc1ccccc1I 62a_100009814033_100011216222 [0,1,0,0,0,1|0,0,2]=4 2135 B14R1.161 CC(=O)C(C)SCc1ccccc1I 62a_100011216222_100009814033 [0,1,0,0,0,1|0,0,2]=4 2136 B14R1.161 CC(=O)N(C)CCc1ccccc1F 11a_100000232559_100015343762 [0,1,0,0,0,1|1,0,1]=4 2137 B14R1.161 CC(=O)N(C)CCc1ccccc1F 1626a_100000232559_100015343762 [0,1,0,0,0,1|1,0,1]=4 2138 B14R1.161 CC(=O)N(C)CCc1ccccc1F 240690a_100000232559_100015343762 [0,1,0,0,0,1|1,0,1]=4 2139 B14R1.161 CC(=O)N(C)CCc1ccccc1F 527a_100000232559_100103153847 [0,1,0,0,0,1|1,0,1]=4 2140 B14R1.415 C=C(C)C(=O)CC(=O)c1ccccc1 1458a_100000185857_100000211460 [0,1,0,0,0,1|2,0,0]=4 2141 B14R1.415 CC(=O)C(=O)CC(=O)c1ccccc1 1458a_100000185807_100011261029 [0,1,0,0,0,1|1,0,0]=3 2142 B14R1.415 CC(=O)C(=O)CN(C)c1ccccc1 269982a_100000210012_100011261029 [0,1,0,0,0,1|1,0,1]=4 2143 B14R1.415 CC(=O)C(=O)CN(C)c1ccccc1 34a_100000210012_100011261029 [0,1,0,0,0,1|1,0,1]=4 2144 B14R1.415 CC(=O)C(C)N[C@H](C)c1ccccc1 2230a_100000751104_100009814033 [0,1,0,0,0,1|0,0,2]=4 2145 B14R1.415 CC(=O)C(C)OC(C)c1ccccc1 34a_100000212229_100000211855 [0,1,0,0,0,1|0,0,2]=4 2146 B14R1.415 CC(=O)C(C)O[C@H](C)c1ccccc1 7a_100000761318_100000179758 [0,1,0,0,0,1|0,0,2]=4 2147 B14R1.415 CC(=O)C(C)SC(C)c1ccccc1 62a_100000230085_100009814033 [0,1,0,0,0,1|0,0,2]=4 2148 B14R1.415 CC(=O)C(C)SC(C)c1ccccc1 62a_100009814033_100000230085 [0,1,0,0,0,1|0,0,2]=4 2149 B14R1.415 CC(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200000210301 [0,1,0,0,0,1|1,0,1]=4 2150 B14R1.415 CC(=O)N(C)CC(O)c1ccccc1 240690a_100000227976_100015343762 [0,1,0,0,0,1|1,0,1]=4 2151 B14R1.415 CC(=O)N(C)CC(O)c1ccccc1 527a_100000227976_100103153847 [0,1,0,0,0,1|1,0,1]=4 2152 B14R1.415 CC(=O)[C@@H](C)NC(=O)c1ccccc1 1458a_100011504567_200000210301 [0,1,0,0,0,1|0,0,1]=3 2153 B14R1.415 CC(=O)[C@@H](C)OC(=O)c1ccccc1 1458a_200035542198_200000210301 [0,1,0,0,0,1|0,0,1]=3 2154 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)N 11a_100000119354_100000185807 [0,1,0,0,0,1|1,0,1]=4 2155 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)N 240690a_100000119354_100000185807 [0,1,0,0,0,1|1,0,1]=4 2156 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)N 527a_100000119354_100000185807 [0,1,0,0,0,1|1,0,1]=4 2157 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)[13CH3] 1458a_100011504567_200025704644 [0,1,0,0,0,1|0,0,1]=3 2158 B14R1.415 C[C@@H](OC(=O)c1ccccc1)C(=O)[13CH3] 1458a_200035542198_200025704644 [0,1,0,0,0,1|0,0,1]=3 2159 B14R1.415 [13CH3]C(=O)C(O)NC(=O)c1ccccc1 1458a_100000067094_200025704644 [0,1,0,0,0,1|1,0,1]=4 2160 B14R1.679 C=C(C)C(=NNc1ccc(cc1)Br)C 4a_100000735608_100011216138 [0,1,0,0,0,1|2,0,0]=4 2161 B14R1.679 C=C(C)C(=NNc1ccc(cc1)C)C 4a_100000683527_100011216138 [0,1,0,0,0,1|2,0,0]=4 2162 B14R1.679 C=C(C)C(=NNc1ccc(cc1)Cl)C 4a_100000683521_100011216138 [0,1,0,0,0,1|2,0,0]=4 2163 B14R1.679 C=C(C)C(=NNc1ccc(cc1)F)C 4a_100000728448_100011216138 [0,1,0,0,0,1|2,0,0]=4 2164 B14R1.679 C=C(C)C(=NNc1ccc(cc1)I)C 4a_100016988836_100011216138 [0,1,0,0,0,1|2,0,0]=4 2165 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)Br 34a_100000210018_100011261029 [0,1,0,0,0,1|1,0,1]=4 2166 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)C 34a_100000124888_100011261029 [0,1,0,0,0,1|1,0,1]=4 2167 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)Cl 34a_100000210052_100011261029 [0,1,0,0,0,1|1,0,1]=4 2168 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)F 34a_100000185862_100011261029 [0,1,0,0,0,1|1,0,1]=4 2169 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)I 34a_100000185761_100011261029 [0,1,0,0,0,1|1,0,1]=4 2170 B14R1.679 CC(=O)C(=O)CNc1ccc(cc1)O 34a_100000185829_100011261029 [0,1,0,0,0,1|1,0,1]=4 2171 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)Br 34a_100000185759_100011261029 [0,1,0,0,0,1|1,0,1]=4 2172 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)C 34a_100000210336_100011261029 [0,1,0,0,0,1|1,0,1]=4 2173 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)Cl 34a_100000210216_100011261029 [0,1,0,0,0,1|1,0,1]=4 2174 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)F 34a_100000210339_100011261029 [0,1,0,0,0,1|1,0,1]=4 2175 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)I 34a_100000212066_100011261029 [0,1,0,0,0,1|1,0,1]=4 2176 B14R1.679 CC(=O)C(=O)COc1ccc(cc1)N 34a_100000185829_100011261029 [0,1,0,0,0,1|1,0,1]=4 2177 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Br 62a_100000752885_100011261029 [0,1,0,0,0,1|1,0,1]=4 2178 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Br 62a_100011261029_100000752885 [0,1,0,0,0,1|1,0,1]=4 2179 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)C 62a_100000186775_100011261029 [0,1,0,0,0,1|1,0,1]=4 2180 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)C 62a_100011261029_100000186775 [0,1,0,0,0,1|1,0,1]=4 2181 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Cl 62a_100000755918_100011261029 [0,1,0,0,0,1|1,0,1]=4 2182 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)Cl 62a_100011261029_100000755918 [0,1,0,0,0,1|1,0,1]=4 2183 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)F 62a_100000211213_100011261029 [0,1,0,0,0,1|1,0,1]=4 2184 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)F 62a_100011261029_100000211213 [0,1,0,0,0,1|1,0,1]=4 2185 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)N 62a_100000185761_100011261029 [0,1,0,0,0,1|1,0,1]=4 2186 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)N 62a_100011261029_100000185761 [0,1,0,0,0,1|1,0,1]=4 2187 B14R1.679 CC(=O)C(=O)CSc1ccc(cc1)O 62a_100011261029_100000185759 [0,1,0,0,0,1|1,0,1]=4 2188 B14R1.679 CC(=O)C(C)NCc1ccc(cc1)Br 2230a_100000174875_100009814033 [0,1,0,0,0,1|0,0,2]=4 2189 B14R1.679 CC(=O)C(C)NCc1ccc(cc1)C 2230a_100000174908_100009814033 [0,1,0,0,0,1|0,0,2]=4 2190 B14R1.679 CC(=O)C(C)NCc1ccc(cc1)Cl 2230a_100000174871_100009814033 [0,1,0,0,0,1|0,0,2]=4 2191 B14R1.679 CC(=O)C(C)NCc1ccc(cc1)F 2230a_100000174882_100009814033 [0,1,0,0,0,1|0,0,2]=4 2192 B14R1.679 CC(=O)C(C)NCc1ccc(cc1)I 2230a_100016989417_100009814033 [0,1,0,0,0,1|0,0,2]=4 2193 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)Br 34a_100000212229_100000189115 [0,1,0,0,0,1|0,0,2]=4 2194 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)C 34a_100000212229_100000210814 [0,1,0,0,0,1|0,0,2]=4 2195 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)C 7a_100011215236_100000179758 [0,1,0,0,0,1|0,0,2]=4 2196 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)Cl 34a_100000212229_100000694040 [0,1,0,0,0,1|0,0,2]=4 2197 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)Cl 7a_100000211118_100000179758 [0,1,0,0,0,1|0,0,2]=4 2198 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)F 34a_100000212229_100000198546 [0,1,0,0,0,1|0,0,2]=4 2199 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)F 7a_100000210977_100000179758 [0,1,0,0,0,1|0,0,2]=4 2200 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)I 34a_100000212229_100000189116 [0,1,0,0,0,1|0,0,2]=4 2201 B14R1.679 CC(=O)C(C)OCc1ccc(cc1)I 7a_100000690907_100000179758 [0,1,0,0,0,1|0,0,2]=4 2202 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)Br 62a_100000189115_100009814033 [0,1,0,0,0,1|0,0,2]=4 2203 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)Br 62a_100009814033_100000189115 [0,1,0,0,0,1|0,0,2]=4 2204 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)C 62a_100000210814_100009814033 [0,1,0,0,0,1|0,0,2]=4 2205 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)C 62a_100009814033_100000210814 [0,1,0,0,0,1|0,0,2]=4 2206 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)Cl 1458a_200000149568_200000210301 [0,1,0,0,0,1|0,0,2]=4 2207 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)Cl 62a_100000187161_100009814033 [0,1,0,0,0,1|0,0,2]=4 2208 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)Cl 62a_100009814033_100000187161 [0,1,0,0,0,1|0,0,2]=4 2209 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)F 62a_100000198546_100009814033 [0,1,0,0,0,1|0,0,2]=4 2210 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)F 62a_100009814033_100000187164 [0,1,0,0,0,1|0,0,2]=4 2211 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)I 62a_100000189116_100009814033 [0,1,0,0,0,1|0,0,2]=4 2212 B14R1.679 CC(=O)C(C)SCc1ccc(cc1)I 62a_100009814033_100000189116 [0,1,0,0,0,1|0,0,2]=4 2213 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Br 11a_100000752880_100015343762 [0,1,0,0,0,1|1,0,1]=4 2214 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Br 1626a_100000752880_100015343762 [0,1,0,0,0,1|1,0,1]=4 2215 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Br 240690a_100000752880_100015343762 [0,1,0,0,0,1|1,0,1]=4 2216 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Br 527a_100000752880_100103153847 [0,1,0,0,0,1|1,0,1]=4 2217 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Cl 11a_100000698262_100015343762 [0,1,0,0,0,1|1,0,1]=4 2218 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Cl 1626a_100000698262_100015343762 [0,1,0,0,0,1|1,0,1]=4 2219 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Cl 240690a_100000698262_100015343762 [0,1,0,0,0,1|1,0,1]=4 2220 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)Cl 527a_100000698262_100103153847 [0,1,0,0,0,1|1,0,1]=4 2221 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)F 11a_100102946585_100015343762 [0,1,0,0,0,1|1,0,1]=4 2222 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)F 1626a_100102946585_100015343762 [0,1,0,0,0,1|1,0,1]=4 2223 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)F 240690a_100102946585_100015343762 [0,1,0,0,0,1|1,0,1]=4 2224 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)F 527a_100102946585_100103153847 [0,1,0,0,0,1|1,0,1]=4 2225 B14R1.679 CC(=O)N(C)CCc1ccc(cc1)O 240690a_100016989440_100015343762 [0,1,0,0,0,1|1,0,1]=4 2226 B14R1.679 CC(SCc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_200000149568_200025704644 [0,1,0,0,0,1|0,0,2]=4 2227 B14R1.756 C/C=C(\C)/C(=NNc1ccccc1)C 4a_100015195140_100020675665 [0,1,0,0,0,1|2,0,0]=4 2228 B14R1.756 C=C(CNc1ccccc1)C(=O)OC 34a_100000106764_100009813391 [0,1,0,0,0,1|0,0,2]=4 2229 B14R1.756 C=C(COc1ccccc1)C(=O)OC 34a_100000210340_100009813391 [0,1,0,0,0,1|0,0,2]=4 2230 B14R1.756 C=C(CSc1ccccc1)C(=O)OC 62a_100000719477_100009813391 [0,1,0,0,0,1|0,0,2]=4 2231 B14R1.756 C=C(CSc1ccccc1)C(=O)OC 62a_100009813391_100000041952 [0,1,0,0,0,1|0,0,2]=4 2232 B14R1.756 CC(=NO)C(=NNc1ccccc1)C 4a_100015195140_100000066335 [0,1,0,0,0,1|1,0,1]=4 2233 B14R1.756 CC(CCc1ccccc1)C(=O)CF 1458a_100011435293_100015361967 [0,1,0,0,0,1|0,0,2]=4 2234 B14R1.756 CC(SCc1ccccc1)C(=O)CF 1458a_100000149570_100015361967 [0,1,0,0,0,1|0,0,2]=4 2235 B14R1.756 CCC(=O)C(C)CCc1ccccc1 1458a_100011435293_100000210202 [0,1,0,0,0,1|0,0,2]=4 2236 B14R1.756 CCC(=O)C(C)NCc1ccccc1 2230a_100015324214_100000742827 [0,1,0,0,0,1|0,0,2]=4 2237 B14R1.756 CCC(=O)C(C)OCc1ccccc1 7a_100000210790_100000742827 [0,1,0,0,0,1|0,0,2]=4 2238 B14R1.756 CCC(=O)C(C)SCc1ccccc1 1458a_100000149570_100000210202 [0,1,0,0,0,1|0,0,2]=4 2239 B14R1.756 CCC(=O)C(C)SCc1ccccc1 62a_100000211182_100000742827 [0,1,0,0,0,1|0,0,2]=4 2240 B14R1.756 CCC(=O)C(C)SCc1ccccc1 62a_100000742827_100015291786 [0,1,0,0,0,1|0,0,2]=4 2241 B14R1.756 CCC(=O)N(C)CCc1ccccc1 11a_100000207497_100000210414 [0,1,0,0,0,1|1,0,1]=4 2242 B14R1.756 CCC(=O)N(C)CCc1ccccc1 1626a_100000207497_100000210414 [0,1,0,0,0,1|1,0,1]=4 2243 B14R1.756 CCC(=O)N(C)CCc1ccccc1 240690a_100000207497_100000210414 [0,1,0,0,0,1|1,0,1]=4 2244 B14R1.756 CCC(=O)N(C)CCc1ccccc1 527a_100000207497_100000210414 [0,1,0,0,0,1|1,0,1]=4 2245 B14R1.756 CCC(=O)[C@H](C)OCc1ccccc1 1458a_100000703211_100000210202 [0,1,0,0,0,1|0,0,2]=4 2246 B14R1.756 CN(CCc1ccccc1)C(=O)CO 240690a_100000207497_100000210174 [0,1,0,0,0,1|1,0,1]=4 2247 B14R1.756 CN(CCc1ccccc1)C(=O)CO 527a_100000207497_100000210174 [0,1,0,0,0,1|1,0,1]=4 2248 B14R1.756 CNC(=O)C(=O)CCc1ccccc1 1458a_100011218921_100000765856 [0,1,0,0,0,1|1,0,1]=4 2249 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 1626a_100015324214_100011218921 [0,1,0,0,0,1|1,0,1]=4 2250 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 240690a_100015324214_100011218921 [0,1,0,0,0,1|1,0,1]=4 2251 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 527a_100015324214_100011218921 [0,1,0,0,0,1|1,0,1]=4 2252 B14R1.756 CNC(=O)C(=O)NNc1ccccc1 22a_100015195140_100011218921 [0,1,0,0,0,1|2,0,0]=4 2253 B14R1.756 CNC(=O)C(C)CCc1ccccc1 11a_106832991635_100011435293 [0,1,0,0,0,1|0,0,2]=4 2254 B14R1.756 CNC(=O)C(C)CCc1ccccc1 1626a_100102657272_100011435293 [0,1,0,0,0,1|0,0,2]=4 2255 B14R1.756 CNC(=O)C(C)CCc1ccccc1 240690a_100102657272_100011435293 [0,1,0,0,0,1|0,0,2]=4 2256 B14R1.756 CNC(=O)C(C)CCc1ccccc1 527a_100102657272_100011435293 [0,1,0,0,0,1|0,0,2]=4 2257 B14R1.756 CNC(=O)C(C)NCc1ccccc1 2230a_100015324214_100000731044 [0,1,0,0,0,1|0,0,2]=4 2258 B14R1.756 CNC(=O)C(C)NCc1ccccc1 34a_100015324214_100000731044 [0,1,0,0,0,1|0,0,2]=4 2259 B14R1.756 CNC(=O)C(C)OCc1ccccc1 34a_100000210790_100000731044 [0,1,0,0,0,1|0,0,2]=4 2260 B14R1.756 CNC(=O)C(C)OCc1ccccc1 7a_100000210790_100000209862 [0,1,0,0,0,1|0,0,2]=4 2261 B14R1.756 CNC(=O)C(C)SCc1ccccc1 11a_106832991635_100000149570 [0,1,0,0,0,1|0,0,2]=4 2262 B14R1.756 CNC(=O)C(C)SCc1ccccc1 1626a_100102657272_100000149570 [0,1,0,0,0,1|0,0,2]=4 2263 B14R1.756 CNC(=O)C(C)SCc1ccccc1 240690a_100102657272_100000149570 [0,1,0,0,0,1|0,0,2]=4 2264 B14R1.756 CNC(=O)C(C)SCc1ccccc1 527a_100102657272_100000149570 [0,1,0,0,0,1|0,0,2]=4 2265 B14R1.756 CNC(=O)C(C)SCc1ccccc1 62a_100000209862_100015291786 [0,1,0,0,0,1|0,0,2]=4 2266 B14R1.756 CNC(=O)C(C)SCc1ccccc1 62a_100000211182_100000731044 [0,1,0,0,0,1|0,0,2]=4 2267 B14R1.756 CNC(=O)N(C)CCc1ccccc1 2708a_100102657272_100000207497 [0,1,0,0,0,1|1,0,1]=4 2268 B14R1.756 CNC(=O)N(C)CCc1ccccc1 273464a_100102657272_100000207497 [0,1,0,0,0,1|1,0,1]=4 2269 B14R1.756 CNC(=O)[C@@H](C)NCc1ccccc1 2230a_100000684985_100015291786 [0,1,0,0,0,1|0,0,2]=4 2270 B14R1.756 CNC(=O)[C@@H](C)NCc1ccccc1 34a_100000684985_100015291786 [0,1,0,0,0,1|0,0,2]=4 2271 B14R1.756 CNC(=O)[C@H](C)OCc1ccccc1 11a_106832991635_100000703211 [0,1,0,0,0,1|0,0,2]=4 2272 B14R1.756 CNC(=O)[C@H](C)OCc1ccccc1 1626a_100102657272_100000703211 [0,1,0,0,0,1|0,0,2]=4 2273 B14R1.756 CNC(=O)[C@H](C)OCc1ccccc1 240690a_100102657272_100000703211 [0,1,0,0,0,1|0,0,2]=4 2274 B14R1.756 CNC(=O)[C@H](C)OCc1ccccc1 527a_100102657272_100000703211 [0,1,0,0,0,1|0,0,2]=4 2275 B14R1.756 COC(=O)C(=NNc1ccccc1)C 4a_100015195140_100000211753 [0,1,0,0,0,1|1,0,0]=3 2276 B14R1.756 COC(=O)C(=NNc1ccccn1)C 4a_100000183288_100000211753 [0,1,0,0,0,1|2,0,0]=4 2277 B14R1.756 COC(=O)C(=NNc1cccnc1)C 4a_100000728903_100000211753 [0,1,0,0,0,1|2,0,0]=4 2278 B14R1.756 COC(=O)C(=NNc1ccncc1)C 4a_100000698918_100000211753 [0,1,0,0,0,1|2,0,0]=4 2279 B14R1.756 COC(=O)C(=O)CNc1ccccc1 34a_100000106764_100011610305 [0,1,0,0,0,1|1,0,1]=4 2280 B14R1.756 COC(=O)C(=O)COc1ccccc1 34a_100000210340_100011610305 [0,1,0,0,0,1|1,0,1]=4 2281 B14R1.756 COC(=O)C(=O)CSc1ccccc1 62a_100000719477_100011610305 [0,1,0,0,0,1|1,0,1]=4 2282 B14R1.756 COC(=O)C(=O)CSc1ccccc1 62a_100011610305_100000041952 [0,1,0,0,0,1|1,0,1]=4 2283 B14R1.756 COC(=O)C(=O)NCc1ccccc1 11a_100015324214_100000024059 [0,1,0,0,0,1|1,0,1]=4 2284 B14R1.756 COC(=O)C(=O)NCc1ccccc1 1626a_100015324214_100000024059 [0,1,0,0,0,1|1,0,1]=4 2285 B14R1.756 COC(=O)C(=O)NCc1ccccc1 240690a_100015324214_100000024059 [0,1,0,0,0,1|1,0,1]=4 2286 B14R1.756 COC(=O)C(=O)NCc1ccccc1 527a_100015324214_100000024059 [0,1,0,0,0,1|1,0,1]=4 2287 B14R1.756 COC(=O)C(C)CNc1ccccc1 34a_100000106764_100000698445 [0,1,0,0,0,1|0,0,2]=4 2288 B14R1.756 COC(=O)C(C)COc1ccccc1 34a_100000210340_100000698445 [0,1,0,0,0,1|0,0,2]=4 2289 B14R1.756 COC(=O)C(C)CSc1ccccc1 62a_100000698445_100000041952 [0,1,0,0,0,1|0,0,2]=4 2290 B14R1.756 COC(=O)C(C)CSc1ccccc1 62a_100000719477_100000698445 [0,1,0,0,0,1|0,0,2]=4 2291 B14R1.756 COC(=O)C(C)NCc1ccccc1 2230a_100015324214_100000211248 [0,1,0,0,0,1|0,0,2]=4 2292 B14R1.756 COC(=O)C(C)NCc1ccccc1 34a_100015324214_100000211248 [0,1,0,0,0,1|0,0,2]=4 2293 B14R1.756 COC(=O)C(C)OCc1ccccc1 34a_100000210790_100000211248 [0,1,0,0,0,1|0,0,2]=4 2294 B14R1.756 COC(=O)C(C)OCc1ccccc1 34a_100011215400_100015291786 [0,1,0,0,0,1|0,0,2]=4 2295 B14R1.756 COC(=O)C(C)OCc1ccccc1 7a_100000210790_100000211248 [0,1,0,0,0,1|0,0,2]=4 2296 B14R1.756 COC(=O)C(C)SCc1ccccc1 62a_100000211182_100000211248 [0,1,0,0,0,1|0,0,2]=4 2297 B14R1.756 COC(=O)C(C)SCc1ccccc1 62a_100000211248_100015291786 [0,1,0,0,0,1|0,0,2]=4 2298 B14R1.756 C[C@H](OCc1ccccc1)C(=O)CF 1458a_100000703211_100015361967 [0,1,0,0,0,1|0,0,2]=4 2299 B14R1.4194 CCN(CCc1ccccc1)C(=O)C 11a_100000741020_100015343762 [0,1,0,0,0,1|1,0,1]=4 2300 B14R1.4194 CCN(CCc1ccccc1)C(=O)C 1626a_100000741020_100015343762 [0,1,0,0,0,1|1,0,1]=4 2301 B14R1.4194 CCN(CCc1ccccc1)C(=O)C 240690a_100000741020_100015343762 [0,1,0,0,0,1|1,0,1]=4 2302 B14R1.4194 CCN(CCc1ccccc1)C(=O)C 527a_100000741020_100103153847 [0,1,0,0,0,1|1,0,1]=4 2303 B14R1.5956 C=C(C)C(=NNc1cccc(c1)Br)C 4a_100000217339_100011216138 [0,1,0,0,0,1|2,0,0]=4 2304 B14R1.5956 C=C(C)C(=NNc1cccc(c1)C)C 4a_100000681630_100011216138 [0,1,0,0,0,1|2,0,0]=4 2305 B14R1.5956 C=C(C)C(=NNc1cccc(c1)Cl)C 4a_100000184277_100011216138 [0,1,0,0,0,1|2,0,0]=4 2306 B14R1.5956 C=C(C)C(=NNc1cccc(c1)F)C 4a_100000745080_100011216138 [0,1,0,0,0,1|2,0,0]=4 2307 B14R1.5956 C=C(C)C(=NNc1cccc(c1)I)C 4a_100020605690_100011216138 [0,1,0,0,0,1|2,0,0]=4 2308 B14R1.5956 CC(=O)C(=O)CNc1cccc(c1)Br 34a_100000210019_100011261029 [0,1,0,0,0,1|1,0,1]=4 2309 B14R1.5956 CC(=O)C(=O)CNc1cccc(c1)C 34a_100000188690_100011261029 [0,1,0,0,0,1|1,0,1]=4 2310 B14R1.5956 CC(=O)C(=O)CNc1cccc(c1)Cl 34a_100000185859_100011261029 [0,1,0,0,0,1|1,0,1]=4 2311 B14R1.5956 CC(=O)C(=O)CNc1cccc(c1)F 34a_100000210047_100011261029 [0,1,0,0,0,1|1,0,1]=4 2312 B14R1.5956 CC(=O)C(=O)CNc1cccc(c1)I 34a_100000211102_100011261029 [0,1,0,0,0,1|1,0,1]=4 2313 B14R1.5956 CC(=O)C(=O)CNc1cccc(c1)O 34a_100000210217_100011261029 [0,1,0,0,0,1|1,0,1]=4 2314 B14R1.5956 CC(=O)C(=O)COc1cccc(c1)Br 34a_100000210342_100011261029 [0,1,0,0,0,1|1,0,1]=4 2315 B14R1.5956 CC(=O)C(=O)COc1cccc(c1)C 34a_100000210337_100011261029 [0,1,0,0,0,1|1,0,1]=4 2316 B14R1.5956 CC(=O)C(=O)COc1cccc(c1)Cl 34a_100000210295_100011261029 [0,1,0,0,0,1|1,0,1]=4 2317 B14R1.5956 CC(=O)C(=O)COc1cccc(c1)F 34a_100000210426_100011261029 [0,1,0,0,0,1|1,0,1]=4 2318 B14R1.5956 CC(=O)C(=O)COc1cccc(c1)I 34a_100000211634_100011261029 [0,1,0,0,0,1|1,0,1]=4 2319 B14R1.5956 CC(=O)C(=O)COc1cccc(c1)N 34a_100000210217_100011261029 [0,1,0,0,0,1|1,0,1]=4 2320 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)Br 62a_100000691529_100011261029 [0,1,0,0,0,1|1,0,1]=4 2321 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)Br 62a_100011261029_100000691529 [0,1,0,0,0,1|1,0,1]=4 2322 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)C 62a_100011215228_100011261029 [0,1,0,0,0,1|1,0,1]=4 2323 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)C 62a_100011261029_100011215228 [0,1,0,0,0,1|1,0,1]=4 2324 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)Cl 62a_100000699651_100011261029 [0,1,0,0,0,1|1,0,1]=4 2325 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)Cl 62a_100011261029_100000699651 [0,1,0,0,0,1|1,0,1]=4 2326 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)F 62a_100000685547_100011261029 [0,1,0,0,0,1|1,0,1]=4 2327 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)F 62a_100011261029_100000685547 [0,1,0,0,0,1|1,0,1]=4 2328 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)N 62a_100000210019_100011261029 [0,1,0,0,0,1|1,0,1]=4 2329 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)N 62a_100011261029_100000210019 [0,1,0,0,0,1|1,0,1]=4 2330 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)O 62a_100011261029_100000211634 [0,1,0,0,0,1|1,0,1]=4 2331 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)[S] 62a_100011261029_114929384022 [0,1,0,0,0,1|1,0,1]=4 2332 B14R1.5956 CC(=O)C(=O)CSc1cccc(c1)[S] 62a_114929384022_100011261029 [0,1,0,0,0,1|1,0,1]=4 2333 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)Br 2230a_100000174977_100009814033 [0,1,0,0,0,1|0,0,2]=4 2334 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)C 2230a_100000185548_100009814033 [0,1,0,0,0,1|0,0,2]=4 2335 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)Cl 2230a_100000174878_100009814033 [0,1,0,0,0,1|0,0,2]=4 2336 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)F 2230a_100000174948_100009814033 [0,1,0,0,0,1|0,0,2]=4 2337 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)I 2230a_100000106179_100009814033 [0,1,0,0,0,1|0,0,2]=4 2338 B14R1.5956 CC(=O)C(C)NCc1cccc(c1)O 2230a_100000743036_100009814033 [0,1,0,0,0,1|0,0,2]=4 2339 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)Br 34a_100000212229_100000698116 [0,1,0,0,0,1|0,0,2]=4 2340 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)Br 7a_100000687537_100000179758 [0,1,0,0,0,1|0,0,2]=4 2341 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)C 34a_100000212229_100000211840 [0,1,0,0,0,1|0,0,2]=4 2342 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)C 7a_100011217746_100000179758 [0,1,0,0,0,1|0,0,2]=4 2343 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)Cl 34a_100000212229_100000187163 [0,1,0,0,0,1|0,0,2]=4 2344 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)Cl 7a_100000241301_100000179758 [0,1,0,0,0,1|0,0,2]=4 2345 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)F 34a_100000212229_100000187166 [0,1,0,0,0,1|0,0,2]=4 2346 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)F 7a_100000210976_100000179758 [0,1,0,0,0,1|0,0,2]=4 2347 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)I 34a_100000212229_100011218688 [0,1,0,0,0,1|0,0,2]=4 2348 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)I 7a_100011215336_100000179758 [0,1,0,0,0,1|0,0,2]=4 2349 B14R1.5956 CC(=O)C(C)OCc1cccc(c1)O 34a_100000212229_100011660834 [0,1,0,0,0,1|0,0,2]=4 2350 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)Br 62a_100000211773_100009814033 [0,1,0,0,0,1|0,0,2]=4 2351 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)Br 62a_100009814033_100000211773 [0,1,0,0,0,1|0,0,2]=4 2352 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)C 62a_100000211840_100009814033 [0,1,0,0,0,1|0,0,2]=4 2353 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)C 62a_100009814033_100000211840 [0,1,0,0,0,1|0,0,2]=4 2354 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)Cl 62a_100000187163_100009814033 [0,1,0,0,0,1|0,0,2]=4 2355 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)Cl 62a_100009814033_100000187163 [0,1,0,0,0,1|0,0,2]=4 2356 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)F 62a_100000230114_100009814033 [0,1,0,0,0,1|0,0,2]=4 2357 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)F 62a_100009814033_100000230114 [0,1,0,0,0,1|0,0,2]=4 2358 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)I 62a_100009814033_100011218688 [0,1,0,0,0,1|0,0,2]=4 2359 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)I 62a_100011218688_100009814033 [0,1,0,0,0,1|0,0,2]=4 2360 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)O 62a_100009814033_100011660834 [0,1,0,0,0,1|0,0,2]=4 2361 B14R1.5956 CC(=O)C(C)SCc1cccc(c1)O 62a_100011660834_100009814033 [0,1,0,0,0,1|0,0,2]=4 2362 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)C 11a_114849113767_100015343762 [0,1,0,0,0,1|1,0,1]=4 2363 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)C 1626a_114849113767_100015343762 [0,1,0,0,0,1|1,0,1]=4 2364 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)C 240690a_114849113767_100015343762 [0,1,0,0,0,1|1,0,1]=4 2365 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)C 527a_114849113767_100103153847 [0,1,0,0,0,1|1,0,1]=4 2366 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)Cl 11a_106726388433_100015343762 [0,1,0,0,0,1|1,0,1]=4 2367 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)Cl 1626a_106726388433_100015343762 [0,1,0,0,0,1|1,0,1]=4 2368 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)Cl 240690a_106726388433_100015343762 [0,1,0,0,0,1|1,0,1]=4 2369 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)Cl 527a_106726388433_100103153847 [0,1,0,0,0,1|1,0,1]=4 2370 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)F 11a_106726388868_100015343762 [0,1,0,0,0,1|1,0,1]=4 2371 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)F 1626a_106726388868_100015343762 [0,1,0,0,0,1|1,0,1]=4 2372 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)F 240690a_106726388868_100015343762 [0,1,0,0,0,1|1,0,1]=4 2373 B14R1.5956 CC(=O)N(C)CCc1cccc(c1)F 527a_106726388868_100103153847 [0,1,0,0,0,1|1,0,1]=4 2374 B14R1.6395 CC(=O)C(C)(C)OCc1ccccc1 34a_100000747739_100015291786 [0,1,0,0,0,1|0,0,2]=4 2375 B14R1.6395 CC(=O)C(C)(C)OCc1ccccc1 7a_100000210790_100000075568 [0,1,0,0,0,1|0,0,2]=4 2376 B14R1.6395 CC(=O)C(C)(C)OCc1ccccc1 7a_100000747739_100000211182 [0,1,0,0,0,1|0,0,2]=4 2377 B14R1.6395 CC(=O)C(C)(C)SCc1ccccc1 1458a_100011459008_200000210301 [0,1,0,0,0,1|0,0,2]=4 2378 B14R1.6395 CC(=O)C(C)(C)SCc1ccccc1 62a_100000075568_100015291786 [0,1,0,0,0,1|0,0,2]=4 2379 B14R1.6395 CC(=O)C(C)(C)SCc1ccccc1 62a_100000211182_100000075568 [0,1,0,0,0,1|0,0,2]=4 2380 B14R1.6395 CC(C)(SCc1ccccc1)C(=O)[13CH3] 1458a_100011459008_200025704644 [0,1,0,0,0,1|0,0,2]=4 2381 B14R1.328 CC(=O)C(C)Oc1cccccc1=O 7a_100000036025_100000179758 [0,1,0,0,0,1|1,0,1]=4 2382 B14R1.3 C/C(=C\c1ccc(cc1)O[13CH3])/[N+](=O)[O-] 34a_200020671538_200025704644 [0,2,0,0,0,0|2,0,0]=4 2383 B14R1.3 C/C(=C\c1ccc(cc1)O[13CH3])/[N+](=O)[O-] 7a_200020671538_200025704644 [0,2,0,0,0,0|2,0,0]=4 2384 B14R1.3 C=Cc1ccc(cc1)OC(C)C(=O)C 7a_100000189437_100000179758 [0,2,0,0,0,0|1,0,1]=4 2385 B14R1.3 C=Cc1ccc(cc1)SC(C)C(=O)C 62a_100000748128_100009814033 [0,2,0,0,0,0|1,0,1]=4 2386 B14R1.3 C=Cc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000748128 [0,2,0,0,0,0|1,0,1]=4 2387 B14R1.3 CC(=O)C(C)Cc1ccc(cc1)C#N 1458a_200000109623_200000210301 [0,2,0,0,0,0|0,0,2]=4 2388 B14R1.3 CC(=O)C(C)Nc1ccc(cc1)CO 2230a_100011215238_100009814033 [0,2,0,0,0,0|1,0,1]=4 2389 B14R1.3 CC(=O)C(C)Oc1ccc(cc1)C#N 1458a_100000191206_200000210301 [0,2,0,0,0,0|1,0,1]=4 2390 B14R1.3 CC(=O)C(C)Oc1ccc(cc1)C#N 7a_100000210344_100000179758 [0,2,0,0,0,0|1,0,1]=4 2391 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)C#N 62a_100009814033_100000184291 [0,2,0,0,0,0|1,0,1]=4 2392 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)C=O 62a_100000188517_100009814033 [0,2,0,0,0,0|1,0,1]=4 2393 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)C=O 62a_100009814033_100000188517 [0,2,0,0,0,0|1,0,1]=4 2394 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CF 62a_100009814033_100010268989 [0,2,0,0,0,0|1,0,1]=4 2395 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CF 62a_100010268989_100009814033 [0,2,0,0,0,0|1,0,1]=4 2396 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CN 62a_100009814033_100016989417 [0,2,0,0,0,0|1,0,1]=4 2397 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CN 62a_100016989417_100009814033 [0,2,0,0,0,0|1,0,1]=4 2398 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CO 62a_100000690907_100009814033 [0,2,0,0,0,0|1,0,1]=4 2399 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)CO 62a_100009814033_100000690907 [0,2,0,0,0,0|1,0,1]=4 2400 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)NN 62a_100009814033_100016988836 [0,2,0,0,0,0|1,0,1]=4 2401 B14R1.3 CC(=O)C(C)Sc1ccc(cc1)NN 62a_100016988836_100009814033 [0,2,0,0,0,0|1,0,1]=4 2402 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 11a_100000217971_100015343762 [0,2,0,0,0,0|1,0,1]=4 2403 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 1626a_100000217971_100015343762 [0,2,0,0,0,0|1,0,1]=4 2404 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 240690a_100000217971_100015343762 [0,2,0,0,0,0|1,0,1]=4 2405 B14R1.3 CC(=O)N(C)Cc1ccc(cc1)C#N 527a_100000217971_100103153847 [0,2,0,0,0,0|1,0,1]=4 2406 B14R1.3 CC(Cc1ccc(cc1)C#N)C(=O)[13CH3] 1458a_200000109623_200025704644 [0,2,0,0,0,0|0,0,2]=4 2407 B14R1.3 CC(Oc1ccc(cc1)C#N)C(=O)[13CH3] 1458a_100000191206_200025704644 [0,2,0,0,0,0|1,0,1]=4 2408 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 11a_100000683253_100015343762 [0,2,0,0,0,0|1,0,1]=4 2409 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 1626a_100000683253_100015343762 [0,2,0,0,0,0|1,0,1]=4 2410 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 240690a_100000683253_100015343762 [0,2,0,0,0,0|1,0,1]=4 2411 B14R1.3 CCc1ccc(cc1)CN(C)C(=O)C 527a_100000683253_100103153847 [0,2,0,0,0,0|1,0,1]=4 2412 B14R1.3 CCc1ccc(cc1)NC(C)C(=O)C 2230a_100000211069_100009814033 [0,2,0,0,0,0|1,0,1]=4 2413 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)C 1458a_200000216327_200000210301 [0,2,0,0,0,0|1,0,1]=4 2414 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)C 7a_100000211359_100000179758 [0,2,0,0,0,0|1,0,1]=4 2415 B14R1.3 CCc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_200000216327_200025704644 [0,2,0,0,0,0|1,0,1]=4 2416 B14R1.3 CCc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100011215824 [0,2,0,0,0,0|1,0,1]=4 2417 B14R1.3 CCc1ccc(cc1)SC(C)C(=O)C 62a_100011215824_100009814033 [0,2,0,0,0,0|1,0,1]=4 2418 B14R1.3 CNc1ccc(cc1)SC(C)C(=O)C 62a_100000743151_100009814033 [0,2,0,0,0,0|1,0,1]=4 2419 B14R1.3 CNc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000743151 [0,2,0,0,0,0|1,0,1]=4 2420 B14R1.3 COc1ccc(cc1)/C=C(\C)/[N+](=O)[O-] 34a_200020671538_200000210301 [0,2,0,0,0,0|2,0,0]=4 2421 B14R1.3 COc1ccc(cc1)/C=C(\C)/[N+](=O)[O-] 7a_200020671538_200000210301 [0,2,0,0,0,0|2,0,0]=4 2422 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 11a_100000184145_100015343762 [0,2,0,0,0,0|1,0,1]=4 2423 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 1626a_100000184145_100015343762 [0,2,0,0,0,0|1,0,1]=4 2424 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 240690a_100000184145_100015343762 [0,2,0,0,0,0|1,0,1]=4 2425 B14R1.3 COc1ccc(cc1)CN(C)C(=O)C 527a_100000184145_100103153847 [0,2,0,0,0,0|1,0,1]=4 2426 B14R1.3 COc1ccc(cc1)OC(C)C(=O)C 1458a_100000188420_200000210301 [0,2,0,0,0,0|1,0,1]=4 2427 B14R1.3 COc1ccc(cc1)OC(C)C(=O)[13CH3] 1458a_100000188420_200025704644 [0,2,0,0,0,0|1,0,1]=4 2428 B14R1.3 COc1ccc(cc1)SC(C)C(=O)C 1458a_100000230843_200000210301 [0,2,0,0,0,0|1,0,1]=4 2429 B14R1.3 COc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100000171711 [0,2,0,0,0,0|1,0,1]=4 2430 B14R1.3 COc1ccc(cc1)SC(C)C(=O)[13CH3] 1458a_100000230843_200025704644 [0,2,0,0,0,0|1,0,1]=4 2431 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 11a_102495365258_100015343762 [0,2,0,0,0,0|1,0,1]=4 2432 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 1626a_102495365258_100015343762 [0,2,0,0,0,0|1,0,1]=4 2433 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 240690a_102495365258_100015343762 [0,2,0,0,0,0|1,0,1]=4 2434 B14R1.3 CSc1ccc(cc1)CN(C)C(=O)C 527a_102495365258_100103153847 [0,2,0,0,0,0|1,0,1]=4 2435 B14R1.3 CSc1ccc(cc1)SC(C)C(=O)C 62a_100009814033_100011263217 [0,2,0,0,0,0|1,0,1]=4 2436 B14R1.3 CSc1ccc(cc1)SC(C)C(=O)C 62a_100011263217_100009814033 [0,2,0,0,0,0|1,0,1]=4 2437 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)Br 1458a_100000070787_100000184162 [0,2,0,0,0,0|0,0,1]=3 2438 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000179758 [0,2,0,0,0,0|0,0,1]=3 2439 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)C 1458a_100000070787_100000183984 [0,2,0,0,0,0|0,0,1]=3 2440 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)C 1458a_100000188618_100000179758 [0,2,0,0,0,0|0,0,1]=3 2441 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)Cl 1458a_100000070787_100000183210 [0,2,0,0,0,0|0,0,1]=3 2442 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000179758 [0,2,0,0,0,0|0,0,1]=3 2443 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)F 1458a_100000070787_100000229918 [0,2,0,0,0,0|0,0,1]=3 2444 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)F 1458a_100000187176_100000179758 [0,2,0,0,0,0|0,0,1]=3 2445 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)I 1458a_100000187904_100000179758 [0,2,0,0,0,0|0,0,1]=3 2446 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)O 1458a_100000070787_200010205864 [0,2,0,0,0,0|0,0,1]=3 2447 B14R1.132 CC(=O)C(C)C(=O)c1ccc(cc1)O 1458a_100000212099_100000179758 [0,2,0,0,0,0|0,0,1]=3 2448 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)Br 2230a_100000219623_100009814033 [0,2,0,0,0,0|1,0,1]=4 2449 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)Br 269982a_100000219623_100009814033 [0,2,0,0,0,0|1,0,1]=4 2450 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)C 2230a_100000219977_100009814033 [0,2,0,0,0,0|1,0,1]=4 2451 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)C 269982a_100000219977_100009814033 [0,2,0,0,0,0|1,0,1]=4 2452 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)Cl 2230a_100020629279_100009814033 [0,2,0,0,0,0|1,0,1]=4 2453 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)Cl 269982a_100020629279_100009814033 [0,2,0,0,0,0|1,0,1]=4 2454 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)F 2230a_100000219829_100009814033 [0,2,0,0,0,0|1,0,1]=4 2455 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)F 269982a_100000219829_100009814033 [0,2,0,0,0,0|1,0,1]=4 2456 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)I 2230a_100000743151_100009814033 [0,2,0,0,0,0|1,0,1]=4 2457 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)I 269982a_100000743151_100009814033 [0,2,0,0,0,0|1,0,1]=4 2458 B14R1.132 CC(=O)C(C)N(C)c1ccc(cc1)O 269982a_100000182112_100009814033 [0,2,0,0,0,0|1,0,1]=4 2459 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Br 11a_100000231103_100015343762 [0,2,0,0,0,0|1,0,1]=4 2460 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Br 240690a_100000231103_100015343762 [0,2,0,0,0,0|1,0,1]=4 2461 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Br 527a_100000231103_100103153847 [0,2,0,0,0,0|1,0,1]=4 2462 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Cl 11a_100000231102_100015343762 [0,2,0,0,0,0|1,0,1]=4 2463 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Cl 1626a_100000231102_100015343762 [0,2,0,0,0,0|1,0,1]=4 2464 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Cl 240690a_100000231102_100015343762 [0,2,0,0,0,0|1,0,1]=4 2465 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)Cl 527a_100000231102_100103153847 [0,2,0,0,0,0|1,0,1]=4 2466 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)F 11a_100000222788_100015343762 [0,2,0,0,0,0|1,0,1]=4 2467 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)F 1626a_100000222788_100015343762 [0,2,0,0,0,0|1,0,1]=4 2468 B14R1.132 CC(=O)N(C)C(C)c1ccc(cc1)F 240690a_100000222788_100015343762 [0,2,0,0,0,0|1,0,1]=4 2469 B14R1.132 CC(C(=O)N)C(=O)c1ccc(cc1)Br 1458a_100000185839_100000702099 [0,2,0,0,0,0|1,0,1]=4 2470 B14R1.132 CC(C(=O)N)C(=O)c1ccc(cc1)Cl 1458a_100000210187_100000702099 [0,2,0,0,0,0|1,0,1]=4 2471 B14R1.132 CC(C(=O)N)C(=O)c1ccc(cc1)F 1458a_100000187176_100000702099 [0,2,0,0,0,0|1,0,1]=4 2472 B14R1.132 CC(C(=O)N)C(=O)c1ccc(cc1)I 1458a_100000187904_100000702099 [0,2,0,0,0,0|1,0,1]=4 2473 B14R1.132 CC(C(=O)N)C(=O)c1ccc(cc1)O 1458a_100000212099_100000702099 [0,2,0,0,0,0|1,0,1]=4 2474 B14R1.132 Cc1ccc(cc1)C(=O)C(C)C(=O)N 1458a_100000188618_100000702099 [0,2,0,0,0,0|1,0,1]=4 2475 B14R1.134 C/C(=C\c1ccc(cc1)F)/C(=O)CF 1458a_100053117043_100015361967 [0,2,0,0,0,0|0,0,0]=2 2476 B14R1.134 CC(Cc1ccc(cc1)Br)C(=O)CF 1458a_100000695199_100015361967 [0,2,0,0,0,0|0,0,2]=4 2477 B14R1.134 CC(Cc1ccc(cc1)F)C(=O)CF 1458a_100000746122_100015361967 [0,2,0,0,0,0|0,0,2]=4 2478 B14R1.134 CC(Oc1ccc(cc1)Br)C(=O)CF 1458a_100000181392_100015361967 [0,2,0,0,0,0|1,0,1]=4 2479 B14R1.134 CC(Oc1ccc(cc1)Cl)C(=O)CF 1458a_100000184027_100015361967 [0,2,0,0,0,0|1,0,1]=4 2480 B14R1.134 CC(Oc1ccc(cc1)F)C(=O)CF 1458a_100000203723_100015361967 [0,2,0,0,0,0|1,0,1]=4 2481 B14R1.134 CC(Sc1ccc(cc1)Cl)C(=O)CF 1458a_100000178403_100015361967 [0,2,0,0,0,0|1,0,1]=4 2482 B14R1.134 CC(Sc1ccc(cc1)F)C(=O)CF 1458a_100000181075_100015361967 [0,2,0,0,0,0|1,0,1]=4 2483 B14R1.134 CCC(=O)/C(=C/c1ccc(cc1)F)/C 1458a_100053117043_100000210202 [0,2,0,0,0,0|0,0,0]=2 2484 B14R1.134 CCC(=O)C(=O)Nc1ccc(cc1)C 1458a_100000189662_100000210202 [0,2,0,0,0,0|2,0,0]=4 2485 B14R1.134 CCC(=O)C(C)Cc1ccc(cc1)Br 1458a_100000695199_100000210202 [0,2,0,0,0,0|0,0,2]=4 2486 B14R1.134 CCC(=O)C(C)Cc1ccc(cc1)F 1458a_100000746122_100000210202 [0,2,0,0,0,0|0,0,2]=4 2487 B14R1.134 CCC(=O)C(C)Nc1ccc(cc1)Br 2230a_100000210018_100000742827 [0,2,0,0,0,0|1,0,1]=4 2488 B14R1.134 CCC(=O)C(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000742827 [0,2,0,0,0,0|1,0,1]=4 2489 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)Br 1458a_100000181392_100000210202 [0,2,0,0,0,0|1,0,1]=4 2490 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000742827 [0,2,0,0,0,0|1,0,1]=4 2491 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)C 1458a_100000183867_100000210202 [0,2,0,0,0,0|1,0,1]=4 2492 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000742827 [0,2,0,0,0,0|1,0,1]=4 2493 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)Cl 1458a_100000184027_100000210202 [0,2,0,0,0,0|1,0,1]=4 2494 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000742827 [0,2,0,0,0,0|1,0,1]=4 2495 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)F 1458a_100000203723_100000210202 [0,2,0,0,0,0|1,0,1]=4 2496 B14R1.134 CCC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000742827 [0,2,0,0,0,0|1,0,1]=4 2497 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)Br 62a_100000742827_100000752885 [0,2,0,0,0,0|1,0,1]=4 2498 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)Br 62a_100000752885_100000742827 [0,2,0,0,0,0|1,0,1]=4 2499 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)C 1458a_100000181072_100000210202 [0,2,0,0,0,0|1,0,1]=4 2500 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)C 62a_100000186775_100000742827 [0,2,0,0,0,0|1,0,1]=4 2501 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)C 62a_100000742827_100000186775 [0,2,0,0,0,0|1,0,1]=4 2502 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)Cl 1458a_100000178403_100000210202 [0,2,0,0,0,0|1,0,1]=4 2503 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000742827_100000755918 [0,2,0,0,0,0|1,0,1]=4 2504 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000755918_100000742827 [0,2,0,0,0,0|1,0,1]=4 2505 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)F 1458a_100000181075_100000210202 [0,2,0,0,0,0|1,0,1]=4 2506 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)F 62a_100000211213_100000742827 [0,2,0,0,0,0|1,0,1]=4 2507 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)F 62a_100000742827_100000211213 [0,2,0,0,0,0|1,0,1]=4 2508 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)N 62a_100000185761_100000742827 [0,2,0,0,0,0|1,0,1]=4 2509 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)N 62a_100000742827_100000185761 [0,2,0,0,0,0|1,0,1]=4 2510 B14R1.134 CCC(=O)C(C)Sc1ccc(cc1)O 62a_100000742827_100000185759 [0,2,0,0,0,0|1,0,1]=4 2511 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Br 11a_100000180866_100000210414 [0,2,0,0,0,0|1,0,1]=4 2512 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Br 1626a_100000180866_100000210414 [0,2,0,0,0,0|1,0,1]=4 2513 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Br 240690a_100000180866_100000210414 [0,2,0,0,0,0|1,0,1]=4 2514 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Br 527a_100000180866_100000210414 [0,2,0,0,0,0|1,0,1]=4 2515 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)C 11a_100000744650_100000210414 [0,2,0,0,0,0|1,0,1]=4 2516 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)C 1626a_100000744650_100000210414 [0,2,0,0,0,0|1,0,1]=4 2517 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)C 240690a_100000744650_100000210414 [0,2,0,0,0,0|1,0,1]=4 2518 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)C 527a_100000744650_100000210414 [0,2,0,0,0,0|1,0,1]=4 2519 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Cl 11a_100000184517_100000210414 [0,2,0,0,0,0|1,0,1]=4 2520 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Cl 1626a_100000184517_100000210414 [0,2,0,0,0,0|1,0,1]=4 2521 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Cl 240690a_100000184517_100000210414 [0,2,0,0,0,0|1,0,1]=4 2522 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)Cl 527a_100000184517_100000210414 [0,2,0,0,0,0|1,0,1]=4 2523 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)F 11a_100000184576_100000210414 [0,2,0,0,0,0|1,0,1]=4 2524 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)F 1626a_100000184576_100000210414 [0,2,0,0,0,0|1,0,1]=4 2525 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)F 240690a_100000184576_100000210414 [0,2,0,0,0,0|1,0,1]=4 2526 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)F 527a_100000184576_100000210414 [0,2,0,0,0,0|1,0,1]=4 2527 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)O 240690a_100000207500_100000210414 [0,2,0,0,0,0|1,0,1]=4 2528 B14R1.134 CCC(=O)N(C)Cc1ccc(cc1)O 527a_100000207500_100000210414 [0,2,0,0,0,0|1,0,1]=4 2529 B14R1.134 CCC(=O)[C@@H](C)Oc1ccc(cc1)O 1458a_100000005562_100000210202 [0,2,0,0,0,0|1,0,1]=4 2530 B14R1.134 CN(Cc1ccc(cc1)Br)C(=O)CO 240690a_100000180866_100000210174 [0,2,0,0,0,0|1,0,1]=4 2531 B14R1.134 CN(Cc1ccc(cc1)Br)C(=O)CO 527a_100000180866_100000210174 [0,2,0,0,0,0|1,0,1]=4 2532 B14R1.134 CN(Cc1ccc(cc1)Cl)C(=O)CO 240690a_100000184517_100000210174 [0,2,0,0,0,0|1,0,1]=4 2533 B14R1.134 CN(Cc1ccc(cc1)Cl)C(=O)CO 527a_100000184517_100000210174 [0,2,0,0,0,0|1,0,1]=4 2534 B14R1.134 CN(Cc1ccc(cc1)F)C(=O)CO 240690a_100000184576_100000210174 [0,2,0,0,0,0|1,0,1]=4 2535 B14R1.134 CN(Cc1ccc(cc1)F)C(=O)CO 527a_100000184576_100000210174 [0,2,0,0,0,0|1,0,1]=4 2536 B14R1.134 CN(Cc1ccc(cc1)O)C(=O)CO 240690a_100000207500_100000210174 [0,2,0,0,0,0|1,0,1]=4 2537 B14R1.134 CN(Cc1ccc(cc1)O)C(=O)CO 527a_100000207500_100000210174 [0,2,0,0,0,0|1,0,1]=4 2538 B14R1.134 CNC(=O)/C(=C/c1ccc(cc1)F)/C 11a_106832991635_100053117043 [0,2,0,0,0,0|0,0,0]=2 2539 B14R1.134 CNC(=O)/C(=C/c1ccc(cc1)F)/C 1626a_100102657272_100053117043 [0,2,0,0,0,0|0,0,0]=2 2540 B14R1.134 CNC(=O)/C(=C/c1ccc(cc1)F)/C 240690a_100102657272_100053117043 [0,2,0,0,0,0|0,0,0]=2 2541 B14R1.134 CNC(=O)/C(=C/c1ccc(cc1)F)/C 527a_100102657272_100053117043 [0,2,0,0,0,0|0,0,0]=2 2542 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)Br 1458a_100011218921_100000189115 [0,2,0,0,0,0|1,0,1]=4 2543 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)C 1458a_100011218921_100000210814 [0,2,0,0,0,0|1,0,1]=4 2544 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)Cl 1458a_100011218921_100000694040 [0,2,0,0,0,0|1,0,1]=4 2545 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)F 1458a_100011218921_100000198546 [0,2,0,0,0,0|1,0,1]=4 2546 B14R1.134 CNC(=O)C(=O)Cc1ccc(cc1)I 1458a_100011218921_100000189116 [0,2,0,0,0,0|1,0,1]=4 2547 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100011218921 [0,2,0,0,0,0|2,0,0]=4 2548 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Br 22a_100000210018_100011218921 [0,2,0,0,0,0|2,0,0]=4 2549 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100011218921 [0,2,0,0,0,0|2,0,0]=4 2550 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100011218921 [0,2,0,0,0,0|2,0,0]=4 2551 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 1626a_100102657272_100000189662 [0,2,0,0,0,0|2,0,0]=4 2552 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 22a_100000124888_100011218921 [0,2,0,0,0,0|2,0,0]=4 2553 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 240690a_100102657272_100000189662 [0,2,0,0,0,0|2,0,0]=4 2554 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C 527a_100000124888_100011218921 [0,2,0,0,0,0|2,0,0]=4 2555 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100011218921 [0,2,0,0,0,0|2,0,0]=4 2556 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100102657272_100000199041 [0,2,0,0,0,0|2,0,0]=4 2557 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 22a_100000210052_100011218921 [0,2,0,0,0,0|2,0,0]=4 2558 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 240690a_100102657272_100000199041 [0,2,0,0,0,0|2,0,0]=4 2559 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100011218921 [0,2,0,0,0,0|2,0,0]=4 2560 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100011218921 [0,2,0,0,0,0|2,0,0]=4 2561 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 1626a_100102657272_100011297306 [0,2,0,0,0,0|2,0,0]=4 2562 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 22a_100000185862_100011218921 [0,2,0,0,0,0|2,0,0]=4 2563 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 240690a_100102657272_100011297306 [0,2,0,0,0,0|2,0,0]=4 2564 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F 527a_100000185862_100011218921 [0,2,0,0,0,0|2,0,0]=4 2565 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100011218921 [0,2,0,0,0,0|2,0,0]=4 2566 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)I 22a_100000185761_100011218921 [0,2,0,0,0,0|2,0,0]=4 2567 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)I 527a_100000185761_100011218921 [0,2,0,0,0,0|2,0,0]=4 2568 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)O 22a_100000185829_100011218921 [0,2,0,0,0,0|2,0,0]=4 2569 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 11a_106832991635_100009913200 [0,2,0,0,0,0|2,0,0]=4 2570 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 1626a_100102657272_100009913200 [0,2,0,0,0,0|2,0,0]=4 2571 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 240690a_100102657272_100009913200 [0,2,0,0,0,0|2,0,0]=4 2572 B14R1.134 CNC(=O)C(=O)Sc1ccc(cc1)C 527a_100102657272_100009913200 [0,2,0,0,0,0|2,0,0]=4 2573 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)Br 11a_106832991635_100000695199 [0,2,0,0,0,0|0,0,2]=4 2574 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)Br 1626a_100102657272_100000695199 [0,2,0,0,0,0|0,0,2]=4 2575 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)Br 240690a_100102657272_100000695199 [0,2,0,0,0,0|0,0,2]=4 2576 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)Br 527a_100102657272_100000695199 [0,2,0,0,0,0|0,0,2]=4 2577 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)F 11a_106832991635_100000746122 [0,2,0,0,0,0|0,0,2]=4 2578 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)F 1626a_100102657272_100000746122 [0,2,0,0,0,0|0,0,2]=4 2579 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)F 240690a_100102657272_100000746122 [0,2,0,0,0,0|0,0,2]=4 2580 B14R1.134 CNC(=O)C(C)Cc1ccc(cc1)F 527a_100102657272_100000746122 [0,2,0,0,0,0|0,0,2]=4 2581 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)Br 2230a_100000210018_100000731044 [0,2,0,0,0,0|1,0,1]=4 2582 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)Br 34a_100000210018_100000731044 [0,2,0,0,0,0|1,0,1]=4 2583 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)C 34a_100000124888_100000731044 [0,2,0,0,0,0|1,0,1]=4 2584 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000731044 [0,2,0,0,0,0|1,0,1]=4 2585 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)Cl 34a_100000210052_100000731044 [0,2,0,0,0,0|1,0,1]=4 2586 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)F 34a_100000185862_100000731044 [0,2,0,0,0,0|1,0,1]=4 2587 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)I 34a_100000185761_100000731044 [0,2,0,0,0,0|1,0,1]=4 2588 B14R1.134 CNC(=O)C(C)Nc1ccc(cc1)O 34a_100000185829_100000731044 [0,2,0,0,0,0|1,0,1]=4 2589 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Br 11a_106832991635_100000181392 [0,2,0,0,0,0|1,0,1]=4 2590 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Br 1626a_100102657272_100000181392 [0,2,0,0,0,0|1,0,1]=4 2591 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Br 240690a_100102657272_100000181392 [0,2,0,0,0,0|1,0,1]=4 2592 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Br 34a_100000185759_100000731044 [0,2,0,0,0,0|1,0,1]=4 2593 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Br 527a_100102657272_100000181392 [0,2,0,0,0,0|1,0,1]=4 2594 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000209862 [0,2,0,0,0,0|1,0,1]=4 2595 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)C 11a_106832991635_100000183867 [0,2,0,0,0,0|1,0,1]=4 2596 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)C 1626a_100102657272_100000183867 [0,2,0,0,0,0|1,0,1]=4 2597 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)C 240690a_100102657272_100000183867 [0,2,0,0,0,0|1,0,1]=4 2598 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)C 34a_100000210336_100000731044 [0,2,0,0,0,0|1,0,1]=4 2599 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)C 527a_100102657272_100000183867 [0,2,0,0,0,0|1,0,1]=4 2600 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000209862 [0,2,0,0,0,0|1,0,1]=4 2601 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Cl 11a_106832991635_100000184027 [0,2,0,0,0,0|1,0,1]=4 2602 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Cl 1626a_100102657272_100000184027 [0,2,0,0,0,0|1,0,1]=4 2603 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Cl 240690a_100102657272_100000184027 [0,2,0,0,0,0|1,0,1]=4 2604 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Cl 34a_100000210216_100000731044 [0,2,0,0,0,0|1,0,1]=4 2605 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Cl 527a_100102657272_100000184027 [0,2,0,0,0,0|1,0,1]=4 2606 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000209862 [0,2,0,0,0,0|1,0,1]=4 2607 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)F 11a_106832991635_100000203723 [0,2,0,0,0,0|1,0,1]=4 2608 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)F 1626a_100102657272_100000203723 [0,2,0,0,0,0|1,0,1]=4 2609 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)F 240690a_100102657272_100000203723 [0,2,0,0,0,0|1,0,1]=4 2610 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)F 34a_100000210339_100000731044 [0,2,0,0,0,0|1,0,1]=4 2611 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)F 527a_100102657272_100000203723 [0,2,0,0,0,0|1,0,1]=4 2612 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)I 34a_100000212066_100000731044 [0,2,0,0,0,0|1,0,1]=4 2613 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000209862 [0,2,0,0,0,0|1,0,1]=4 2614 B14R1.134 CNC(=O)C(C)Oc1ccc(cc1)N 34a_100000185829_100000731044 [0,2,0,0,0,0|1,0,1]=4 2615 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Br 62a_100000209862_100000752885 [0,2,0,0,0,0|1,0,1]=4 2616 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Br 62a_100000752885_100000731044 [0,2,0,0,0,0|1,0,1]=4 2617 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)C 11a_106832991635_100000181072 [0,2,0,0,0,0|1,0,1]=4 2618 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)C 1626a_100102657272_100000181072 [0,2,0,0,0,0|1,0,1]=4 2619 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)C 240690a_100102657272_100000181072 [0,2,0,0,0,0|1,0,1]=4 2620 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)C 527a_100102657272_100000181072 [0,2,0,0,0,0|1,0,1]=4 2621 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)C 62a_100000186775_100000731044 [0,2,0,0,0,0|1,0,1]=4 2622 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)C 62a_100000209862_100000186775 [0,2,0,0,0,0|1,0,1]=4 2623 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Cl 11a_106832991635_100000178403 [0,2,0,0,0,0|1,0,1]=4 2624 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Cl 1626a_100102657272_100000178403 [0,2,0,0,0,0|1,0,1]=4 2625 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Cl 240690a_100102657272_100000178403 [0,2,0,0,0,0|1,0,1]=4 2626 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Cl 527a_100102657272_100000178403 [0,2,0,0,0,0|1,0,1]=4 2627 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000209862_100000755918 [0,2,0,0,0,0|1,0,1]=4 2628 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000755918_100000731044 [0,2,0,0,0,0|1,0,1]=4 2629 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)F 11a_106832991635_100000181075 [0,2,0,0,0,0|1,0,1]=4 2630 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)F 1626a_100102657272_100000181075 [0,2,0,0,0,0|1,0,1]=4 2631 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)F 240690a_100102657272_100000181075 [0,2,0,0,0,0|1,0,1]=4 2632 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)F 527a_100102657272_100000181075 [0,2,0,0,0,0|1,0,1]=4 2633 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)F 62a_100000209862_100000211213 [0,2,0,0,0,0|1,0,1]=4 2634 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)F 62a_100000211213_100000731044 [0,2,0,0,0,0|1,0,1]=4 2635 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)N 62a_100000185761_100000731044 [0,2,0,0,0,0|1,0,1]=4 2636 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)N 62a_100000209862_100000185761 [0,2,0,0,0,0|1,0,1]=4 2637 B14R1.134 CNC(=O)C(C)Sc1ccc(cc1)O 62a_100000209862_100000185759 [0,2,0,0,0,0|1,0,1]=4 2638 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)Br 2708a_100102657272_100000180866 [0,2,0,0,0,0|1,0,1]=4 2639 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)Br 273464a_100102657272_100000180866 [0,2,0,0,0,0|1,0,1]=4 2640 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)C 2708a_100102657272_100000744650 [0,2,0,0,0,0|1,0,1]=4 2641 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)C 273464a_100102657272_100000744650 [0,2,0,0,0,0|1,0,1]=4 2642 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)Cl 2708a_100102657272_100000184517 [0,2,0,0,0,0|1,0,1]=4 2643 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)Cl 273464a_100102657272_100000184517 [0,2,0,0,0,0|1,0,1]=4 2644 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)F 2708a_100102657272_100000184576 [0,2,0,0,0,0|1,0,1]=4 2645 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)F 273464a_100102657272_100000184576 [0,2,0,0,0,0|1,0,1]=4 2646 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)O 2708a_100102657272_100000207500 [0,2,0,0,0,0|1,0,1]=4 2647 B14R1.134 CNC(=O)N(C)Cc1ccc(cc1)O 273464a_100102657272_100000207500 [0,2,0,0,0,0|1,0,1]=4 2648 B14R1.134 CNC(=O)[C@@H](C)Oc1ccc(cc1)O 240690a_100102657272_100000005562 [0,2,0,0,0,0|1,0,1]=4 2649 B14R1.134 CNC(=O)[C@@H](C)Oc1ccc(cc1)O 527a_100102657272_100000005562 [0,2,0,0,0,0|1,0,1]=4 2650 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Br 11a_100000210018_100000024059 [0,2,0,0,0,0|2,0,0]=4 2651 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000024059 [0,2,0,0,0,0|2,0,0]=4 2652 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Br 527a_100000210018_100000024059 [0,2,0,0,0,0|2,0,0]=4 2653 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)C 11a_100000124888_100000024059 [0,2,0,0,0,0|2,0,0]=4 2654 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)C 1626a_100000124888_100000024059 [0,2,0,0,0,0|2,0,0]=4 2655 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)C 527a_100000124888_100000024059 [0,2,0,0,0,0|2,0,0]=4 2656 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Cl 11a_100000210052_100000024059 [0,2,0,0,0,0|2,0,0]=4 2657 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000024059 [0,2,0,0,0,0|2,0,0]=4 2658 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)Cl 527a_100000210052_100000024059 [0,2,0,0,0,0|2,0,0]=4 2659 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)F 11a_100000185862_100000024059 [0,2,0,0,0,0|2,0,0]=4 2660 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)F 1626a_100000185862_100000024059 [0,2,0,0,0,0|2,0,0]=4 2661 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)F 527a_100000185862_100000024059 [0,2,0,0,0,0|2,0,0]=4 2662 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)I 11a_100000185761_100000024059 [0,2,0,0,0,0|2,0,0]=4 2663 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)I 1626a_100000185761_100000024059 [0,2,0,0,0,0|2,0,0]=4 2664 B14R1.134 COC(=O)C(=O)Nc1ccc(cc1)I 527a_100000185761_100000024059 [0,2,0,0,0,0|2,0,0]=4 2665 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)Br 2230a_100000210018_100000211248 [0,2,0,0,0,0|1,0,1]=4 2666 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)Br 34a_100000210018_100000211248 [0,2,0,0,0,0|1,0,1]=4 2667 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)C 34a_100000124888_100000211248 [0,2,0,0,0,0|1,0,1]=4 2668 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)Cl 2230a_100000210052_100000211248 [0,2,0,0,0,0|1,0,1]=4 2669 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)Cl 34a_100000210052_100000211248 [0,2,0,0,0,0|1,0,1]=4 2670 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)F 34a_100000185862_100000211248 [0,2,0,0,0,0|1,0,1]=4 2671 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)I 34a_100000185761_100000211248 [0,2,0,0,0,0|1,0,1]=4 2672 B14R1.134 COC(=O)C(C)Nc1ccc(cc1)O 34a_100000185829_100000211248 [0,2,0,0,0,0|1,0,1]=4 2673 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)Br 34a_100000185759_100000211248 [0,2,0,0,0,0|1,0,1]=4 2674 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)Br 7a_100000185759_100000211248 [0,2,0,0,0,0|1,0,1]=4 2675 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)C 34a_100000210336_100000211248 [0,2,0,0,0,0|1,0,1]=4 2676 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)C 7a_100000210336_100000211248 [0,2,0,0,0,0|1,0,1]=4 2677 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)Cl 34a_100000210216_100000211248 [0,2,0,0,0,0|1,0,1]=4 2678 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)Cl 7a_100000210216_100000211248 [0,2,0,0,0,0|1,0,1]=4 2679 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)F 34a_100000210339_100000211248 [0,2,0,0,0,0|1,0,1]=4 2680 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)I 34a_100000212066_100000211248 [0,2,0,0,0,0|1,0,1]=4 2681 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)I 7a_100000212066_100000211248 [0,2,0,0,0,0|1,0,1]=4 2682 B14R1.134 COC(=O)C(C)Oc1ccc(cc1)N 34a_100000185829_100000211248 [0,2,0,0,0,0|1,0,1]=4 2683 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)Br 62a_100000211248_100000752885 [0,2,0,0,0,0|1,0,1]=4 2684 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)Br 62a_100000752885_100000211248 [0,2,0,0,0,0|1,0,1]=4 2685 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)C 62a_100000186775_100000211248 [0,2,0,0,0,0|1,0,1]=4 2686 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)C 62a_100000211248_100000186775 [0,2,0,0,0,0|1,0,1]=4 2687 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000211248_100000755918 [0,2,0,0,0,0|1,0,1]=4 2688 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)Cl 62a_100000755918_100000211248 [0,2,0,0,0,0|1,0,1]=4 2689 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)F 62a_100000211213_100000211248 [0,2,0,0,0,0|1,0,1]=4 2690 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)F 62a_100000211248_100000211213 [0,2,0,0,0,0|1,0,1]=4 2691 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)N 62a_100000185761_100000211248 [0,2,0,0,0,0|1,0,1]=4 2692 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)N 62a_100000211248_100000185761 [0,2,0,0,0,0|1,0,1]=4 2693 B14R1.134 COC(=O)C(C)Sc1ccc(cc1)O 62a_100000211248_100000185759 [0,2,0,0,0,0|1,0,1]=4 2694 B14R1.134 C[C@@H](Oc1ccc(cc1)O)C(=O)CF 1458a_100000005562_100015361967 [0,2,0,0,0,0|1,0,1]=4 2695 B14R1.134 Cc1ccc(cc1)CN(C)C(=O)CO 240690a_100000744650_100000210174 [0,2,0,0,0,0|1,0,1]=4 2696 B14R1.134 Cc1ccc(cc1)CN(C)C(=O)CO 527a_100000744650_100000210174 [0,2,0,0,0,0|1,0,1]=4 2697 B14R1.134 Cc1ccc(cc1)NC(=O)C(=O)CF 1458a_100000189662_100015361967 [0,2,0,0,0,0|2,0,0]=4 2698 B14R1.134 Cc1ccc(cc1)OC(C)C(=O)CF 1458a_100000183867_100015361967 [0,2,0,0,0,0|1,0,1]=4 2699 B14R1.134 Cc1ccc(cc1)SC(C)C(=O)CF 1458a_100000181072_100015361967 [0,2,0,0,0,0|1,0,1]=4 2700 B14R1.536 CC(=O)/C(=C/c1ccc(cc1)Cl)/C#N 1458a_100016996005_200000210301 [0,2,0,0,0,0|0,0,1]=3 2701 B14R1.536 CC(=O)C(=Cc1ccc(cc1)F)C#N 1458a_100000162691_200000210301 [0,2,0,0,0,0|0,0,1]=3 2702 B14R1.536 CC(=O)C(=Cc1ccc(cc1)O)C#N 1458a_100000162680_200000210301 [0,2,0,0,0,0|0,0,1]=3 2703 B14R1.536 CC(=O)C(Cc1ccc(cc1)Cl)S[13CH3] 62a_200009990494_200025704644 [0,2,0,0,0,0|0,0,2]=4 2704 B14R1.536 CC(=O)C(Cc1ccc(cc1)Cl)S[13CH3] 62a_200025704644_200009990494 [0,2,0,0,0,0|0,0,2]=4 2705 B14R1.536 CCC(Oc1ccc(cc1)C)C(=O)C 1458a_100000216147_200000210301 [0,2,0,0,0,0|1,0,1]=4 2706 B14R1.536 CCC(Oc1ccc(cc1)C)C(=O)[13CH3] 1458a_100000216147_200025704644 [0,2,0,0,0,0|1,0,1]=4 2707 B14R1.536 CCC(Oc1ccc(cc1)Cl)C(=O)C 1458a_200000205294_200000210301 [0,2,0,0,0,0|1,0,1]=4 2708 B14R1.536 CCC(Oc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_200000205294_200025704644 [0,2,0,0,0,0|1,0,1]=4 2709 B14R1.536 CCC(Oc1ccc(cc1)F)C(=O)C 1458a_100011202367_200000210301 [0,2,0,0,0,0|1,0,1]=4 2710 B14R1.536 CCC(Oc1ccc(cc1)F)C(=O)[13CH3] 1458a_100011202367_200025704644 [0,2,0,0,0,0|1,0,1]=4 2711 B14R1.536 CCN(Cc1ccc(cc1)Br)C(=O)C 11a_100000187385_100015343762 [0,2,0,0,0,0|1,0,1]=4 2712 B14R1.536 CCN(Cc1ccc(cc1)Br)C(=O)C 1626a_100000187385_100015343762 [0,2,0,0,0,0|1,0,1]=4 2713 B14R1.536 CCN(Cc1ccc(cc1)Br)C(=O)C 240690a_100000187385_100015343762 [0,2,0,0,0,0|1,0,1]=4 2714 B14R1.536 CCN(Cc1ccc(cc1)Br)C(=O)C 527a_100000187385_100103153847 [0,2,0,0,0,0|1,0,1]=4 2715 B14R1.536 CCN(Cc1ccc(cc1)C)C(=O)C 11a_100000180869_100015343762 [0,2,0,0,0,0|1,0,1]=4 2716 B14R1.536 CCN(Cc1ccc(cc1)C)C(=O)C 1626a_100000180869_100015343762 [0,2,0,0,0,0|1,0,1]=4 2717 B14R1.536 CCN(Cc1ccc(cc1)C)C(=O)C 240690a_100000180869_100015343762 [0,2,0,0,0,0|1,0,1]=4 2718 B14R1.536 CCN(Cc1ccc(cc1)C)C(=O)C 527a_100000180869_100103153847 [0,2,0,0,0,0|1,0,1]=4 2719 B14R1.536 CCN(Cc1ccc(cc1)Cl)C(=O)C 11a_100000180830_100015343762 [0,2,0,0,0,0|1,0,1]=4 2720 B14R1.536 CCN(Cc1ccc(cc1)Cl)C(=O)C 1626a_100000180830_100015343762 [0,2,0,0,0,0|1,0,1]=4 2721 B14R1.536 CCN(Cc1ccc(cc1)Cl)C(=O)C 240690a_100000180830_100015343762 [0,2,0,0,0,0|1,0,1]=4 2722 B14R1.536 CCN(Cc1ccc(cc1)Cl)C(=O)C 527a_100000180830_100103153847 [0,2,0,0,0,0|1,0,1]=4 2723 B14R1.536 CCN(Cc1ccc(cc1)F)C(=O)C 11a_100015183324_100015343762 [0,2,0,0,0,0|1,0,1]=4 2724 B14R1.536 CCN(Cc1ccc(cc1)F)C(=O)C 1626a_100015183324_100015343762 [0,2,0,0,0,0|1,0,1]=4 2725 B14R1.536 CCN(Cc1ccc(cc1)F)C(=O)C 240690a_100015183324_100015343762 [0,2,0,0,0,0|1,0,1]=4 2726 B14R1.536 CCN(Cc1ccc(cc1)F)C(=O)C 527a_100015183324_100103153847 [0,2,0,0,0,0|1,0,1]=4 2727 B14R1.536 CCN(Cc1ccc(cc1)O)C(=O)C 240690a_100000748449_100015343762 [0,2,0,0,0,0|1,0,1]=4 2728 B14R1.536 CNC(Cc1ccc(cc1)Cl)C(=O)C 34a_100102657272_200009990494 [0,2,0,0,0,0|0,0,2]=4 2729 B14R1.536 CNC(Cc1ccc(cc1)Cl)C(=O)C 7a_106832991635_200009990494 [0,2,0,0,0,0|0,0,2]=4 2730 B14R1.536 COC(Cc1ccc(cc1)Cl)C(=O)C 34a_100138415774_200009990494 [0,2,0,0,0,0|0,0,2]=4 2731 B14R1.536 CSC(Cc1ccc(cc1)Cl)C(=O)C 62a_200000210301_200009990494 [0,2,0,0,0,0|0,0,2]=4 2732 B14R1.536 CSC(Cc1ccc(cc1)Cl)C(=O)C 62a_200009990494_200000210301 [0,2,0,0,0,0|0,0,2]=4 2733 B14R1.536 [13CH3]C(=O)/C(=C/c1ccc(cc1)Cl)/C#N 1458a_100016996005_200025704644 [0,2,0,0,0,0|0,0,1]=3 2734 B14R1.536 [13CH3]C(=O)C(=Cc1ccc(cc1)F)C#N 1458a_100000162691_200025704644 [0,2,0,0,0,0|0,0,1]=3 2735 B14R1.536 [13CH3]C(=O)C(=Cc1ccc(cc1)O)C#N 1458a_100000162680_200025704644 [0,2,0,0,0,0|0,0,1]=3 2736 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)C)C 1458a_100000189585_200000210301 [0,2,0,0,0,0|2,0,0]=4 2737 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)Br 2230a_100011306057_100009814033 [0,2,0,0,0,0|1,0,1]=4 2738 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)Br 7a_100011306057_100000179758 [0,2,0,0,0,0|1,0,1]=4 2739 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)C 2230a_100000736455_100009814033 [0,2,0,0,0,0|1,0,1]=4 2740 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)C 7a_100000736455_100000179758 [0,2,0,0,0,0|1,0,1]=4 2741 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)Cl 2230a_100000686031_100009814033 [0,2,0,0,0,0|1,0,1]=4 2742 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)F 2230a_100000760356_100009814033 [0,2,0,0,0,0|1,0,1]=4 2743 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Br)F 7a_100000760356_100000179758 [0,2,0,0,0,0|1,0,1]=4 2744 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Br 2230a_100000210723_100009814033 [0,2,0,0,0,0|1,0,1]=4 2745 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Br 7a_100000210723_100000179758 [0,2,0,0,0,0|1,0,1]=4 2746 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)C 2230a_100000724040_100009814033 [0,2,0,0,0,0|1,0,1]=4 2747 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)C 7a_100000724040_100000179758 [0,2,0,0,0,0|1,0,1]=4 2748 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Cl 2230a_100000187808_100009814033 [0,2,0,0,0,0|1,0,1]=4 2749 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Cl 7a_100000187808_100000179758 [0,2,0,0,0,0|1,0,1]=4 2750 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)F 2230a_100000750164_100009814033 [0,2,0,0,0,0|1,0,1]=4 2751 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)F 7a_100000750164_100000179758 [0,2,0,0,0,0|1,0,1]=4 2752 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)I 7a_100000198070_100000179758 [0,2,0,0,0,0|1,0,1]=4 2753 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000179758 [0,2,0,0,0,0|1,0,1]=4 2754 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)Br 2230a_100000687081_100009814033 [0,2,0,0,0,0|1,0,1]=4 2755 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)Br 7a_100000687081_100000179758 [0,2,0,0,0,0|1,0,1]=4 2756 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)C 2230a_100000188892_100009814033 [0,2,0,0,0,0|1,0,1]=4 2757 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)C 7a_100000188892_100000179758 [0,2,0,0,0,0|1,0,1]=4 2758 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_100009814033 [0,2,0,0,0,0|1,0,1]=4 2759 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)F 2230a_100000211060_100009814033 [0,2,0,0,0,0|1,0,1]=4 2760 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)Cl)F 7a_100000211060_100000179758 [0,2,0,0,0,0|1,0,1]=4 2761 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)Br 2230a_100000759894_100009814033 [0,2,0,0,0,0|1,0,1]=4 2762 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)Br 7a_100000759894_100000179758 [0,2,0,0,0,0|1,0,1]=4 2763 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)C 2230a_100000210958_100009814033 [0,2,0,0,0,0|1,0,1]=4 2764 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)C 7a_100000210958_100000179758 [0,2,0,0,0,0|1,0,1]=4 2765 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)Cl 2230a_100000739366_100009814033 [0,2,0,0,0,0|1,0,1]=4 2766 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)Cl 7a_100000739366_100000179758 [0,2,0,0,0,0|1,0,1]=4 2767 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)F 2230a_100000210724_100009814033 [0,2,0,0,0,0|1,0,1]=4 2768 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)F 7a_100000210724_100000179758 [0,2,0,0,0,0|1,0,1]=4 2769 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)I 7a_100011356925_100000179758 [0,2,0,0,0,0|1,0,1]=4 2770 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000179758 [0,2,0,0,0,0|1,0,1]=4 2771 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)I)C 7a_100000184131_100000179758 [0,2,0,0,0,0|1,0,1]=4 2772 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)I)F 7a_114828291077_100000179758 [0,2,0,0,0,0|1,0,1]=4 2773 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000179758 [0,2,0,0,0,0|1,0,1]=4 2774 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000179758 [0,2,0,0,0,0|1,0,1]=4 2775 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Br)C 7a_100011380479_100000179758 [0,2,0,0,0,0|1,0,1]=4 2776 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Br)Cl 7a_100011933957_100000179758 [0,2,0,0,0,0|1,0,1]=4 2777 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Br)F 7a_100000693481_100000179758 [0,2,0,0,0,0|1,0,1]=4 2778 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Br)I 7a_100000701344_100000179758 [0,2,0,0,0,0|1,0,1]=4 2779 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Br)N 7a_100012001276_100000179758 [0,2,0,0,0,0|1,0,1]=4 2780 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)Br 7a_100000690111_100000179758 [0,2,0,0,0,0|1,0,1]=4 2781 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)C 7a_100000210932_100000179758 [0,2,0,0,0,0|1,0,1]=4 2782 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)Cl 1458a_100000230597_200000210301 [0,2,0,0,0,0|1,0,1]=4 2783 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)Cl 7a_100000211092_100000179758 [0,2,0,0,0,0|1,0,1]=4 2784 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)F 7a_100000751312_100000179758 [0,2,0,0,0,0|1,0,1]=4 2785 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)I 7a_100000729255_100000179758 [0,2,0,0,0,0|1,0,1]=4 2786 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)N 7a_100000756630_100000179758 [0,2,0,0,0,0|1,0,1]=4 2787 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Cl)Br 7a_100011215161_100000179758 [0,2,0,0,0,0|1,0,1]=4 2788 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Cl)C 7a_100011265682_100000179758 [0,2,0,0,0,0|1,0,1]=4 2789 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Cl)Cl 7a_100000211054_100000179758 [0,2,0,0,0,0|1,0,1]=4 2790 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Cl)F 7a_100000211030_100000179758 [0,2,0,0,0,0|1,0,1]=4 2791 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Cl)I 7a_100000047559_100000179758 [0,2,0,0,0,0|1,0,1]=4 2792 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)Cl)N 7a_100011215599_100000179758 [0,2,0,0,0,0|1,0,1]=4 2793 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)F)Br 7a_100000755031_100000179758 [0,2,0,0,0,0|1,0,1]=4 2794 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)F)C 7a_100000722560_100000179758 [0,2,0,0,0,0|1,0,1]=4 2795 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)F)Cl 7a_100000691581_100000179758 [0,2,0,0,0,0|1,0,1]=4 2796 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)F)F 7a_100000181275_100000179758 [0,2,0,0,0,0|1,0,1]=4 2797 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)F)I 7a_100009990212_100000179758 [0,2,0,0,0,0|1,0,1]=4 2798 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)F)N 7a_100000759473_100000179758 [0,2,0,0,0,0|1,0,1]=4 2799 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)I)Br 7a_100012339312_100000179758 [0,2,0,0,0,0|1,0,1]=4 2800 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)I)Cl 7a_100000049588_100000179758 [0,2,0,0,0,0|1,0,1]=4 2801 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)I)N 7a_100010084370_100000179758 [0,2,0,0,0,0|1,0,1]=4 2802 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)N)Br 7a_100011999798_100000179758 [0,2,0,0,0,0|1,0,1]=4 2803 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)N)C 7a_100011216113_100000179758 [0,2,0,0,0,0|1,0,1]=4 2804 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)N)F 7a_100012017239_100000179758 [0,2,0,0,0,0|1,0,1]=4 2805 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)Br 62a_100009814033_100012356285 [0,2,0,0,0,0|1,0,1]=4 2806 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)Br 62a_100012356285_100009814033 [0,2,0,0,0,0|1,0,1]=4 2807 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)C 62a_100009814033_100011847877 [0,2,0,0,0,0|1,0,1]=4 2808 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)C 62a_100011847877_100009814033 [0,2,0,0,0,0|1,0,1]=4 2809 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)Cl 62a_100009814033_100012353702 [0,2,0,0,0,0|1,0,1]=4 2810 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)Cl 62a_100012353702_100009814033 [0,2,0,0,0,0|1,0,1]=4 2811 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)F 62a_100009814033_100012047266 [0,2,0,0,0,0|1,0,1]=4 2812 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)F 62a_100012047266_100009814033 [0,2,0,0,0,0|1,0,1]=4 2813 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)N 62a_100000750455_100009814033 [0,2,0,0,0,0|1,0,1]=4 2814 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)N 62a_100009814033_100000750455 [0,2,0,0,0,0|1,0,1]=4 2815 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100009814033_100012361655 [0,2,0,0,0,0|1,0,1]=4 2816 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100009814033 [0,2,0,0,0,0|1,0,1]=4 2817 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Br 62a_100009813585_100009814033 [0,2,0,0,0,0|1,0,1]=4 2818 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Br 62a_100009814033_100009813585 [0,2,0,0,0,0|1,0,1]=4 2819 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)C 62a_100009814033_100011215607 [0,2,0,0,0,0|1,0,1]=4 2820 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)C 62a_100011215607_100009814033 [0,2,0,0,0,0|1,0,1]=4 2821 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Cl 62a_100000049509_100009814033 [0,2,0,0,0,0|1,0,1]=4 2822 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Cl 62a_100009814033_100000049509 [0,2,0,0,0,0|1,0,1]=4 2823 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)F 62a_100009814033_100011218330 [0,2,0,0,0,0|1,0,1]=4 2824 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)F 62a_100011218330_100009814033 [0,2,0,0,0,0|1,0,1]=4 2825 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)N 62a_100000211769_100009814033 [0,2,0,0,0,0|1,0,1]=4 2826 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)N 62a_100009814033_100000211769 [0,2,0,0,0,0|1,0,1]=4 2827 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)O 62a_100009814033_100000186361 [0,2,0,0,0,0|1,0,1]=4 2828 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)Br 62a_100009814033_100012047281 [0,2,0,0,0,0|1,0,1]=4 2829 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)Br 62a_100012047281_100009814033 [0,2,0,0,0,0|1,0,1]=4 2830 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)C 62a_100009814033_100011216363 [0,2,0,0,0,0|1,0,1]=4 2831 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)C 62a_100011216363_100009814033 [0,2,0,0,0,0|1,0,1]=4 2832 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)Cl 62a_100009814033_100011214914 [0,2,0,0,0,0|1,0,1]=4 2833 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)Cl 62a_100011214914_100009814033 [0,2,0,0,0,0|1,0,1]=4 2834 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)F 62a_100009814033_100011215976 [0,2,0,0,0,0|1,0,1]=4 2835 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)F 62a_100011215976_100009814033 [0,2,0,0,0,0|1,0,1]=4 2836 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)N 62a_100009814033_100011218065 [0,2,0,0,0,0|1,0,1]=4 2837 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)N 62a_100011218065_100009814033 [0,2,0,0,0,0|1,0,1]=4 2838 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100009814033_100012360047 [0,2,0,0,0,0|1,0,1]=4 2839 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009814033 [0,2,0,0,0,0|1,0,1]=4 2840 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)Br 62a_100000685389_100009814033 [0,2,0,0,0,0|1,0,1]=4 2841 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)Br 62a_100009814033_100000685389 [0,2,0,0,0,0|1,0,1]=4 2842 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)C 62a_100000720648_100009814033 [0,2,0,0,0,0|1,0,1]=4 2843 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)C 62a_100009814033_100000720648 [0,2,0,0,0,0|1,0,1]=4 2844 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)Cl 62a_100009814033_100011216805 [0,2,0,0,0,0|1,0,1]=4 2845 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)Cl 62a_100011216805_100009814033 [0,2,0,0,0,0|1,0,1]=4 2846 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)F 62a_100000703953_100009814033 [0,2,0,0,0,0|1,0,1]=4 2847 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)F 62a_100009814033_100000703953 [0,2,0,0,0,0|1,0,1]=4 2848 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)N 62a_100009814033_100011215594 [0,2,0,0,0,0|1,0,1]=4 2849 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)N 62a_100011215594_100009814033 [0,2,0,0,0,0|1,0,1]=4 2850 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100000185481_100009814033 [0,2,0,0,0,0|1,0,1]=4 2851 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100009814033_100000185481 [0,2,0,0,0,0|1,0,1]=4 2852 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)Br 62a_100000750456_100009814033 [0,2,0,0,0,0|1,0,1]=4 2853 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)Br 62a_100009814033_100000750456 [0,2,0,0,0,0|1,0,1]=4 2854 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)C 62a_100000761890_100009814033 [0,2,0,0,0,0|1,0,1]=4 2855 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)C 62a_100009814033_100000761890 [0,2,0,0,0,0|1,0,1]=4 2856 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)Cl 62a_100009814033_200000761891 [0,2,0,0,0,0|1,0,1]=4 2857 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)Cl 62a_200000761891_100009814033 [0,2,0,0,0,0|1,0,1]=4 2858 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)F 62a_100000740924_100009814033 [0,2,0,0,0,0|1,0,1]=4 2859 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)F 62a_100009814033_100000740924 [0,2,0,0,0,0|1,0,1]=4 2860 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)N 62a_100000741789_100009814033 [0,2,0,0,0,0|1,0,1]=4 2861 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)N 62a_100009814033_100011534411 [0,2,0,0,0,0|1,0,1]=4 2862 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100000752626_100009814033 [0,2,0,0,0,0|1,0,1]=4 2863 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100009814033_100000752626 [0,2,0,0,0,0|1,0,1]=4 2864 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100009814033_100012356990 [0,2,0,0,0,0|1,0,1]=4 2865 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100009814033 [0,2,0,0,0,0|1,0,1]=4 2866 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100000685420_100009814033 [0,2,0,0,0,0|1,0,1]=4 2867 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100009814033_100000685420 [0,2,0,0,0,0|1,0,1]=4 2868 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100009814033_100011356854 [0,2,0,0,0,0|1,0,1]=4 2869 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100009814033 [0,2,0,0,0,0|1,0,1]=4 2870 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100000686035_100009814033 [0,2,0,0,0,0|1,0,1]=4 2871 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100009814033_100000686035 [0,2,0,0,0,0|1,0,1]=4 2872 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100000739049_100009814033 [0,2,0,0,0,0|1,0,1]=4 2873 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100009814033_100000739049 [0,2,0,0,0,0|1,0,1]=4 2874 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [0,2,0,0,0,0|1,0,1]=4 2875 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 11a_100015204808_100015343762 [0,2,0,0,0,0|1,0,1]=4 2876 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 1626a_100015204808_100015343762 [0,2,0,0,0,0|1,0,1]=4 2877 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 240690a_100015204808_100015343762 [0,2,0,0,0,0|1,0,1]=4 2878 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 527a_100015204808_100103153847 [0,2,0,0,0,0|1,0,1]=4 2879 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 11a_100000184578_100015343762 [0,2,0,0,0,0|1,0,1]=4 2880 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 1626a_100000184578_100015343762 [0,2,0,0,0,0|1,0,1]=4 2881 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 240690a_100000184578_100015343762 [0,2,0,0,0,0|1,0,1]=4 2882 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)Cl)Cl 527a_100000184578_100103153847 [0,2,0,0,0,0|1,0,1]=4 2883 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [0,2,0,0,0,0|1,0,1]=4 2884 B14R1.686 Cc1cc(ccc1Cl)OC(C)C(=O)[13CH3] 1458a_100000230597_200025704644 [0,2,0,0,0,0|1,0,1]=4 2885 B14R1.686 Cc1ccc(cc1C)NC(=O)C(=O)[13CH3] 1458a_100000189585_200025704644 [0,2,0,0,0,0|2,0,0]=4 2886 B14R1.6049 CC(=O)C(=O)Nc1ccc(cc1C)C 1458a_200011297145_200000210301 [0,2,0,0,0,0|2,0,0]=4 2887 B14R1.6049 CC(=O)C(C)Nc1ccc(cc1C)Br 7a_100000211769_100000179758 [0,2,0,0,0,0|1,0,1]=4 2888 B14R1.6049 CC(=O)C(C)Nc1ccc(cc1C)C 7a_100000736561_100000179758 [0,2,0,0,0,0|1,0,1]=4 2889 B14R1.6049 CC(=O)C(C)Nc1ccc(cc1C)Cl 7a_100000210418_100000179758 [0,2,0,0,0,0|1,0,1]=4 2890 B14R1.6049 CC(=O)C(C)Nc1ccc(cc1C)F 7a_100000211637_100000179758 [0,2,0,0,0,0|1,0,1]=4 2891 B14R1.6049 CC(=O)C(C)Nc1ccc(cc1C)I 7a_100000184554_100000179758 [0,2,0,0,0,0|1,0,1]=4 2892 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)Br 1458a_100000191205_200000210301 [0,2,0,0,0,0|1,0,1]=4 2893 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)Br 7a_100000188717_100000179758 [0,2,0,0,0,0|1,0,1]=4 2894 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)C 7a_100000210800_100000179758 [0,2,0,0,0,0|1,0,1]=4 2895 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)Cl 7a_100000211998_100000179758 [0,2,0,0,0,0|1,0,1]=4 2896 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)F 1458a_100000191313_200000210301 [0,2,0,0,0,0|1,0,1]=4 2897 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)F 7a_100000211999_100000179758 [0,2,0,0,0,0|1,0,1]=4 2898 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)I 7a_100012361655_100000179758 [0,2,0,0,0,0|1,0,1]=4 2899 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Br)N 7a_100011534360_100000179758 [0,2,0,0,0,0|1,0,1]=4 2900 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)Br 7a_100000186361_100000179758 [0,2,0,0,0,0|1,0,1]=4 2901 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)C 1458a_100000246062_200000210301 [0,2,0,0,0,0|1,0,1]=4 2902 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)C 7a_100000211776_100000179758 [0,2,0,0,0,0|1,0,1]=4 2903 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)Cl 1458a_100000212078_200000210301 [0,2,0,0,0,0|1,0,1]=4 2904 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)Cl 7a_100000211091_100000179758 [0,2,0,0,0,0|1,0,1]=4 2905 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)F 7a_100000764316_100000179758 [0,2,0,0,0,0|1,0,1]=4 2906 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)I 7a_100011218673_100000179758 [0,2,0,0,0,0|1,0,1]=4 2907 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1C)N 7a_100011218179_100000179758 [0,2,0,0,0,0|1,0,1]=4 2908 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)Br 7a_100000186472_100000179758 [0,2,0,0,0,0|1,0,1]=4 2909 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)C 7a_100000749699_100000179758 [0,2,0,0,0,0|1,0,1]=4 2910 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)Cl 1458a_100000186221_200000210301 [0,2,0,0,0,0|1,0,1]=4 2911 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)Cl 7a_100015191787_100000179758 [0,2,0,0,0,0|1,0,1]=4 2912 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)F 1458a_100000191240_200000210301 [0,2,0,0,0,0|1,0,1]=4 2913 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)F 7a_100000212004_100000179758 [0,2,0,0,0,0|1,0,1]=4 2914 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)I 7a_100012360047_100000179758 [0,2,0,0,0,0|1,0,1]=4 2915 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1Cl)N 7a_100000744943_100000179758 [0,2,0,0,0,0|1,0,1]=4 2916 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1F)Br 7a_100000185481_100000179758 [0,2,0,0,0,0|1,0,1]=4 2917 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1F)C 7a_100011216688_100000179758 [0,2,0,0,0,0|1,0,1]=4 2918 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1F)Cl 7a_100000230166_100000179758 [0,2,0,0,0,0|1,0,1]=4 2919 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1F)F 7a_100000230127_100000179758 [0,2,0,0,0,0|1,0,1]=4 2920 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1F)I 7a_100011356965_100000179758 [0,2,0,0,0,0|1,0,1]=4 2921 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1F)N 7a_100011220035_100000179758 [0,2,0,0,0,0|1,0,1]=4 2922 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1I)Br 7a_100012355227_100000179758 [0,2,0,0,0,0|1,0,1]=4 2923 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1I)C 7a_100000765521_100000179758 [0,2,0,0,0,0|1,0,1]=4 2924 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1I)Cl 7a_100011356953_100000179758 [0,2,0,0,0,0|1,0,1]=4 2925 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1I)F 7a_100012355409_100000179758 [0,2,0,0,0,0|1,0,1]=4 2926 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1I)I 7a_100010001573_100000179758 [0,2,0,0,0,0|1,0,1]=4 2927 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1N)Br 7a_100000752626_100000179758 [0,2,0,0,0,0|1,0,1]=4 2928 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1N)C 7a_100011215204_100000179758 [0,2,0,0,0,0|1,0,1]=4 2929 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1N)Cl 7a_100000210500_100000179758 [0,2,0,0,0,0|1,0,1]=4 2930 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1N)F 7a_100000759472_100000179758 [0,2,0,0,0,0|1,0,1]=4 2931 B14R1.6049 CC(=O)C(C)Oc1ccc(cc1N)I 7a_100000753495_100000179758 [0,2,0,0,0,0|1,0,1]=4 2932 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)Br 62a_100009814033_100011484698 [0,2,0,0,0,0|1,0,1]=4 2933 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)Br 62a_100011484698_100009814033 [0,2,0,0,0,0|1,0,1]=4 2934 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)C 62a_100009813563_100009814033 [0,2,0,0,0,0|1,0,1]=4 2935 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)C 62a_100009814033_100009813563 [0,2,0,0,0,0|1,0,1]=4 2936 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)Cl 62a_100009814033_100011219703 [0,2,0,0,0,0|1,0,1]=4 2937 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)Cl 62a_100011219703_100009814033 [0,2,0,0,0,0|1,0,1]=4 2938 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)F 62a_100009814033_100011217111 [0,2,0,0,0,0|1,0,1]=4 2939 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)F 62a_100011217111_100009814033 [0,2,0,0,0,0|1,0,1]=4 2940 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)N 62a_100000750458_100009814033 [0,2,0,0,0,0|1,0,1]=4 2941 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)N 62a_100009814033_100000750458 [0,2,0,0,0,0|1,0,1]=4 2942 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)O 62a_100000701344_100009814033 [0,2,0,0,0,0|1,0,1]=4 2943 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Br)O 62a_100009814033_100000701344 [0,2,0,0,0,0|1,0,1]=4 2944 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)Br 62a_100000701812_100009814033 [0,2,0,0,0,0|1,0,1]=4 2945 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)Br 62a_100009814033_100000701812 [0,2,0,0,0,0|1,0,1]=4 2946 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)C 62a_100009814033_100011217332 [0,2,0,0,0,0|1,0,1]=4 2947 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)C 62a_100011217332_100009814033 [0,2,0,0,0,0|1,0,1]=4 2948 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)Cl 62a_100009814033_100011219607 [0,2,0,0,0,0|1,0,1]=4 2949 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)Cl 62a_100011219607_100009814033 [0,2,0,0,0,0|1,0,1]=4 2950 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)F 62a_100009814033_100011205405 [0,2,0,0,0,0|1,0,1]=4 2951 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)F 62a_100011205405_100009814033 [0,2,0,0,0,0|1,0,1]=4 2952 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)N 62a_100000210723_100009814033 [0,2,0,0,0,0|1,0,1]=4 2953 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)N 62a_100009814033_100000210723 [0,2,0,0,0,0|1,0,1]=4 2954 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1C)O 62a_100009814033_100000690111 [0,2,0,0,0,0|1,0,1]=4 2955 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)Br 62a_100009814033_100011216062 [0,2,0,0,0,0|1,0,1]=4 2956 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)Br 62a_100011216062_100009814033 [0,2,0,0,0,0|1,0,1]=4 2957 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)C 62a_100009814033_100011263221 [0,2,0,0,0,0|1,0,1]=4 2958 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)C 62a_100011263221_100009814033 [0,2,0,0,0,0|1,0,1]=4 2959 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)Cl 62a_100000699841_100009814033 [0,2,0,0,0,0|1,0,1]=4 2960 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)Cl 62a_100009814033_100000699841 [0,2,0,0,0,0|1,0,1]=4 2961 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)F 62a_100000733362_100009814033 [0,2,0,0,0,0|1,0,1]=4 2962 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)F 62a_100009814033_100000733362 [0,2,0,0,0,0|1,0,1]=4 2963 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)N 62a_100000761885_100009814033 [0,2,0,0,0,0|1,0,1]=4 2964 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)N 62a_100009814033_100000761885 [0,2,0,0,0,0|1,0,1]=4 2965 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)O 62a_100000047559_100009814033 [0,2,0,0,0,0|1,0,1]=4 2966 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1Cl)O 62a_100009814033_100000047559 [0,2,0,0,0,0|1,0,1]=4 2967 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)Br 62a_100009814013_100009814033 [0,2,0,0,0,0|1,0,1]=4 2968 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)Br 62a_100009814033_100009814013 [0,2,0,0,0,0|1,0,1]=4 2969 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)C 62a_100009814033_100011216119 [0,2,0,0,0,0|1,0,1]=4 2970 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)C 62a_100011216119_100009814033 [0,2,0,0,0,0|1,0,1]=4 2971 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)Cl 62a_100009814033_100011216042 [0,2,0,0,0,0|1,0,1]=4 2972 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)Cl 62a_100011216042_100009814033 [0,2,0,0,0,0|1,0,1]=4 2973 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)F 62a_100000750030_100009814033 [0,2,0,0,0,0|1,0,1]=4 2974 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)F 62a_100009814033_100000750030 [0,2,0,0,0,0|1,0,1]=4 2975 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)N 62a_100009814033_100011356925 [0,2,0,0,0,0|1,0,1]=4 2976 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)N 62a_100011356925_100009814033 [0,2,0,0,0,0|1,0,1]=4 2977 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)O 62a_100000755031_100009814033 [0,2,0,0,0,0|1,0,1]=4 2978 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1F)O 62a_100009814033_100000755031 [0,2,0,0,0,0|1,0,1]=4 2979 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)Br 62a_100000743836_100009814033 [0,2,0,0,0,0|1,0,1]=4 2980 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)Br 62a_100009814033_100000743836 [0,2,0,0,0,0|1,0,1]=4 2981 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)C 62a_100009814033_100011216686 [0,2,0,0,0,0|1,0,1]=4 2982 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)C 62a_100011216686_100009814033 [0,2,0,0,0,0|1,0,1]=4 2983 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)Cl 62a_100000761886_100009814033 [0,2,0,0,0,0|1,0,1]=4 2984 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)Cl 62a_100009814033_100000761886 [0,2,0,0,0,0|1,0,1]=4 2985 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)F 62a_100000687223_100009814033 [0,2,0,0,0,0|1,0,1]=4 2986 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)F 62a_100009814033_100000687223 [0,2,0,0,0,0|1,0,1]=4 2987 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)N 62a_100009814033_200012175722 [0,2,0,0,0,0|1,0,1]=4 2988 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)N 62a_200012175722_100009814033 [0,2,0,0,0,0|1,0,1]=4 2989 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)O 62a_100009814033_100011999798 [0,2,0,0,0,0|1,0,1]=4 2990 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1N)O 62a_100011999798_100009814033 [0,2,0,0,0,0|1,0,1]=4 2991 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)Br 62a_100009814033_100012344904 [0,2,0,0,0,0|1,0,1]=4 2992 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)Br 62a_100012344904_100009814033 [0,2,0,0,0,0|1,0,1]=4 2993 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)C 62a_100009814033_100012002257 [0,2,0,0,0,0|1,0,1]=4 2994 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)C 62a_100012002257_100009814033 [0,2,0,0,0,0|1,0,1]=4 2995 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)Cl 62a_100000050036_100009814033 [0,2,0,0,0,0|1,0,1]=4 2996 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)Cl 62a_100009814033_100000050036 [0,2,0,0,0,0|1,0,1]=4 2997 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)F 62a_100000690578_100009814033 [0,2,0,0,0,0|1,0,1]=4 2998 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)F 62a_100009814033_100000690578 [0,2,0,0,0,0|1,0,1]=4 2999 B14R1.6049 CC(=O)C(C)Sc1ccc(cc1O)O 62a_100009814033_100009813921 [0,2,0,0,0,0|1,0,1]=4 3000 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Br)F 11a_200011192132_100015343762 [0,2,0,0,0,0|1,0,1]=4 3001 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Br)F 1626a_200011192132_100015343762 [0,2,0,0,0,0|1,0,1]=4 3002 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Br)F 240690a_200011192132_100015343762 [0,2,0,0,0,0|1,0,1]=4 3003 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Br)F 527a_200011192132_100103153847 [0,2,0,0,0,0|1,0,1]=4 3004 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1C)C 11a_100025771030_100015343762 [0,2,0,0,0,0|1,0,1]=4 3005 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1C)C 1626a_100025771030_100015343762 [0,2,0,0,0,0|1,0,1]=4 3006 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1C)C 240690a_100025771030_100015343762 [0,2,0,0,0,0|1,0,1]=4 3007 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1C)C 527a_100025771030_100103153847 [0,2,0,0,0,0|1,0,1]=4 3008 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Cl)Cl 11a_100015189987_100015343762 [0,2,0,0,0,0|1,0,1]=4 3009 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Cl)Cl 1626a_100015189987_100015343762 [0,2,0,0,0,0|1,0,1]=4 3010 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Cl)Cl 240690a_100015189987_100015343762 [0,2,0,0,0,0|1,0,1]=4 3011 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1Cl)Cl 527a_100015189987_100103153847 [0,2,0,0,0,0|1,0,1]=4 3012 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1F)F 11a_100000207661_100015343762 [0,2,0,0,0,0|1,0,1]=4 3013 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1F)F 1626a_100000207661_100015343762 [0,2,0,0,0,0|1,0,1]=4 3014 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1F)F 240690a_100000207661_100015343762 [0,2,0,0,0,0|1,0,1]=4 3015 B14R1.6049 CC(=O)N(C)Cc1ccc(cc1F)F 527a_100000207661_100103153847 [0,2,0,0,0,0|1,0,1]=4 3016 B14R1.6049 CC(Oc1ccc(cc1Br)Br)C(=O)[13CH3] 1458a_100000191205_200025704644 [0,2,0,0,0,0|1,0,1]=4 3017 B14R1.6049 CC(Oc1ccc(cc1Br)F)C(=O)[13CH3] 1458a_100000191313_200025704644 [0,2,0,0,0,0|1,0,1]=4 3018 B14R1.6049 CC(Oc1ccc(cc1Cl)Cl)C(=O)[13CH3] 1458a_100000186221_200025704644 [0,2,0,0,0,0|1,0,1]=4 3019 B14R1.6049 CC(Oc1ccc(cc1Cl)F)C(=O)[13CH3] 1458a_100000191240_200025704644 [0,2,0,0,0,0|1,0,1]=4 3020 B14R1.6049 Cc1cc(ccc1OC(C)C(=O)[13CH3])Cl 1458a_100000212078_200025704644 [0,2,0,0,0,0|1,0,1]=4 3021 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(=O)[13CH3] 1458a_200011297145_200025704644 [0,2,0,0,0,0|2,0,0]=4 3022 B14R1.6049 Cc1ccc(c(c1)C)OC(C)C(=O)[13CH3] 1458a_100000246062_200025704644 [0,2,0,0,0,0|1,0,1]=4 3023 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)Br 1458a_100015185431_200000210301 [0,2,0,0,0,0|1,0,1]=4 3024 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)Br 7a_100000185759_100000075568 [0,2,0,0,0,0|1,0,1]=4 3025 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)C 7a_100000210336_100000075568 [0,2,0,0,0,0|1,0,1]=4 3026 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)Cl 1458a_100000188143_200000210301 [0,2,0,0,0,0|1,0,1]=4 3027 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)Cl 7a_100000210216_100000075568 [0,2,0,0,0,0|1,0,1]=4 3028 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)F 1458a_100000691700_200000210301 [0,2,0,0,0,0|1,0,1]=4 3029 B14R1.7626 CC(=O)C(C)(C)Oc1ccc(cc1)I 7a_100000212066_100000075568 [0,2,0,0,0,0|1,0,1]=4 3030 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)Br 62a_100000075568_100000752885 [0,2,0,0,0,0|1,0,1]=4 3031 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)Br 62a_100000752885_100000075568 [0,2,0,0,0,0|1,0,1]=4 3032 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)C 62a_100000075568_100000186775 [0,2,0,0,0,0|1,0,1]=4 3033 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)C 62a_100000186775_100000075568 [0,2,0,0,0,0|1,0,1]=4 3034 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)Cl 62a_100000075568_100000755918 [0,2,0,0,0,0|1,0,1]=4 3035 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)Cl 62a_100000755918_100000075568 [0,2,0,0,0,0|1,0,1]=4 3036 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)F 62a_100000075568_100000211213 [0,2,0,0,0,0|1,0,1]=4 3037 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)F 62a_100000211213_100000075568 [0,2,0,0,0,0|1,0,1]=4 3038 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)N 62a_100000075568_100000185761 [0,2,0,0,0,0|1,0,1]=4 3039 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)N 62a_100000185761_100000075568 [0,2,0,0,0,0|1,0,1]=4 3040 B14R1.7626 CC(=O)C(C)(C)Sc1ccc(cc1)O 62a_100000075568_100000185759 [0,2,0,0,0,0|1,0,1]=4 3041 B14R1.7626 CC(C)(Oc1ccc(cc1)Br)C(=O)[13CH3] 1458a_100015185431_200025704644 [0,2,0,0,0,0|1,0,1]=4 3042 B14R1.7626 CC(C)(Oc1ccc(cc1)Cl)C(=O)[13CH3] 1458a_100000188143_200025704644 [0,2,0,0,0,0|1,0,1]=4 3043 B14R1.7626 CC(C)(Oc1ccc(cc1)F)C(=O)[13CH3] 1458a_100000691700_200025704644 [0,2,0,0,0,0|1,0,1]=4 3044 B14R1.60 C#CCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000184674 [0,2,0,0,0,0|0,0,0]=2 3045 B14R1.60 C#CCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000184674 [0,2,0,0,0,0|1,0,0]=3 3046 B14R1.60 C#CCC(=O)/C(=C/c1ccccn1)/C 1458a_100025712827_100000184674 [0,2,0,0,0,0|1,0,0]=3 3047 B14R1.60 C#CCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000184674 [0,2,0,0,0,0|1,0,0]=3 3048 B14R1.60 C#CCC(=O)C(=Cc1cccnc1)F 1458a_100000731744_100000184674 [0,2,0,0,0,0|2,0,0]=4 3049 B14R1.60 C#CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000184674 [0,2,0,0,0,0|2,0,0]=4 3050 B14R1.60 C#CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000184674 [0,2,0,0,0,0|0,0,2]=4 3051 B14R1.60 C#CCC(=O)C(C)Cc1ccccc1 1458a_100011220946_200011218536 [0,2,0,0,0,0|0,0,2]=4 3052 B14R1.60 C#CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000184674 [0,2,0,0,0,0|1,0,1]=4 3053 B14R1.60 C#CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000184674 [0,2,0,0,0,0|1,0,1]=4 3054 B14R1.60 C#CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100011220946 [0,2,0,0,0,0|1,0,1]=4 3055 B14R1.60 C#CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100011220946 [0,2,0,0,0,0|1,0,1]=4 3056 B14R1.60 C/C(=C\c1ccccc1)/C(=O)CC#N 1458a_100016990649_100011214920 [0,2,0,0,0,0|0,0,0]=2 3057 B14R1.60 C/C(=C\c1ccccc1)/C(=O)CCF 1458a_100016990649_100011217306 [0,2,0,0,0,0|0,0,0]=2 3058 B14R1.60 C/C(=C\c1ccccc1)/C(=O)CCO 1458a_100016990649_100000211926 [0,2,0,0,0,0|0,0,0]=2 3059 B14R1.60 C/C(=C\c1ccccn1)/C(=O)CC#N 1458a_100025712827_100011214920 [0,2,0,0,0,0|1,0,0]=3 3060 B14R1.60 C/C(=C\c1ccccn1)/C(=O)CCF 1458a_100025712827_100011217306 [0,2,0,0,0,0|1,0,0]=3 3061 B14R1.60 C/C(=C\c1ccccn1)/C(=O)CCO 1458a_100025712827_100000211926 [0,2,0,0,0,0|1,0,0]=3 3062 B14R1.60 C=C(Cc1ccccc1)C(=O)NCC 11a_100015525214_100000066491 [0,2,0,0,0,0|0,0,2]=4 3063 B14R1.60 C=C(Cc1ccccc1)C(=O)NNC 22a_100016993582_100000066491 [0,2,0,0,0,0|0,0,2]=4 3064 B14R1.60 C=CCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210623 [0,2,0,0,0,0|0,0,0]=2 3065 B14R1.60 C=CCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210623 [0,2,0,0,0,0|1,0,0]=3 3066 B14R1.60 C=CCC(=O)/C(=C/c1ccccn1)/C 1458a_100025712827_100000210623 [0,2,0,0,0,0|1,0,0]=3 3067 B14R1.60 C=CCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210623 [0,2,0,0,0,0|1,0,0]=3 3068 B14R1.60 C=CCC(=O)C(=Cc1cccnc1)F 1458a_100000731744_100000210623 [0,2,0,0,0,0|2,0,0]=4 3069 B14R1.60 C=CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210623 [0,2,0,0,0,0|2,0,0]=4 3070 B14R1.60 C=CCC(=O)C(C)Cc1ccccc1 1458a_100000210193_200011218536 [0,2,0,0,0,0|0,0,2]=4 3071 B14R1.60 C=CCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210623 [0,2,0,0,0,0|0,0,2]=4 3072 B14R1.60 C=CCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210623 [0,2,0,0,0,0|1,0,1]=4 3073 B14R1.60 C=CCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210623 [0,2,0,0,0,0|1,0,1]=4 3074 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210193 [0,2,0,0,0,0|1,0,1]=4 3075 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210193 [0,2,0,0,0,0|1,0,1]=4 3076 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210193 [0,2,0,0,0,0|1,0,1]=4 3077 B14R1.60 C=CCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210193 [0,2,0,0,0,0|1,0,1]=4 3078 B14R1.60 CC#CC(=O)C(C)Cc1ccccc1 1458a_100000763181_200011218536 [0,2,0,0,0,0|0,0,2]=4 3079 B14R1.60 CC(Cc1ccccc1)C(=O)CC#N 1458a_100000754839_100011214920 [0,2,0,0,0,0|0,0,2]=4 3080 B14R1.60 CC(Cc1ccccc1)C(=O)CC#N 1458a_100051588842_200011218536 [0,2,0,0,0,0|0,0,2]=4 3081 B14R1.60 CC(Cc1ccccc1)C(=O)CCF 1458a_100000754839_100011217306 [0,2,0,0,0,0|0,0,2]=4 3082 B14R1.60 CC(Cc1ccccc1)C(=O)CCO 1458a_100000754839_100000211926 [0,2,0,0,0,0|0,0,2]=4 3083 B14R1.60 CC(Cc1ccccc1)C(=O)CCO 1458a_100011216618_200011218536 [0,2,0,0,0,0|0,0,2]=4 3084 B14R1.60 CC(Oc1ccccc1)C(=O)CC#N 1458a_100000188414_100011214920 [0,2,0,0,0,0|1,0,1]=4 3085 B14R1.60 CC(Oc1ccccc1)C(=O)CCF 1458a_100000188414_100011217306 [0,2,0,0,0,0|1,0,1]=4 3086 B14R1.60 CC(Oc1ccccc1)C(=O)CCO 1458a_100000188414_100000211926 [0,2,0,0,0,0|1,0,1]=4 3087 B14R1.60 CC(Sc1ccccc1)C(=O)CC#N 1458a_100000199063_100011214920 [0,2,0,0,0,0|1,0,1]=4 3088 B14R1.60 CC(Sc1ccccc1)C(=O)CCF 1458a_100000199063_100011217306 [0,2,0,0,0,0|1,0,1]=4 3089 B14R1.60 CC(Sc1ccccc1)C(=O)CCO 1458a_100000199063_100000211926 [0,2,0,0,0,0|1,0,1]=4 3090 B14R1.60 CC=CC(=O)C(C)Cc1ccccc1 1458a_100000210699_200011218536 [0,2,0,0,0,0|0,0,2]=4 3091 B14R1.60 CC=CC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210699 [0,2,0,0,0,0|1,0,1]=4 3092 B14R1.60 CC=CC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210699 [0,2,0,0,0,0|1,0,1]=4 3093 B14R1.60 CC=CC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210699 [0,2,0,0,0,0|1,0,1]=4 3094 B14R1.60 CCCC(=O)/C(=C/c1ccccc1)/C 1458a_100016990649_100000210303 [0,2,0,0,0,0|0,0,0]=2 3095 B14R1.60 CCCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000210303 [0,2,0,0,0,0|1,0,0]=3 3096 B14R1.60 CCCC(=O)/C(=C/c1ccccn1)/C 1458a_100025712827_100000210303 [0,2,0,0,0,0|1,0,0]=3 3097 B14R1.60 CCCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100000210303 [0,2,0,0,0,0|1,0,0]=3 3098 B14R1.60 CCCC(=O)C(=Cc1cccnc1)F 1458a_100000731744_100000210303 [0,2,0,0,0,0|2,0,0]=4 3099 B14R1.60 CCCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100000210303 [0,2,0,0,0,0|2,0,0]=4 3100 B14R1.60 CCCC(=O)C(C)Cc1ccccc1 1458a_100000211992_200011218536 [0,2,0,0,0,0|0,0,2]=4 3101 B14R1.60 CCCC(=O)C(C)Cc1ccccc1 1458a_100000754839_100000210303 [0,2,0,0,0,0|0,0,2]=4 3102 B14R1.60 CCCC(=O)C(C)Oc1ccccc1 1458a_100000188414_100000210303 [0,2,0,0,0,0|1,0,1]=4 3103 B14R1.60 CCCC(=O)C(C)Sc1ccccc1 1458a_100000199063_100000210303 [0,2,0,0,0,0|1,0,1]=4 3104 B14R1.60 CCCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000211992 [0,2,0,0,0,0|1,0,1]=4 3105 B14R1.60 CCCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000211992 [0,2,0,0,0,0|1,0,1]=4 3106 B14R1.60 CCCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000211992 [0,2,0,0,0,0|1,0,1]=4 3107 B14R1.60 CCCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000211992 [0,2,0,0,0,0|1,0,1]=4 3108 B14R1.60 CCNC(=O)/C(=C/c1ccccc1)/C 11a_100015525214_100016990649 [0,2,0,0,0,0|0,0,0]=2 3109 B14R1.60 CCNC(=O)/C(=C/c1ccccc1)/C 527a_100015525214_100016990649 [0,2,0,0,0,0|0,0,0]=2 3110 B14R1.60 CCNC(=O)/C(=C/c1ccccc1)/Cl 11a_100015525214_200020598536 [0,2,0,0,0,0|1,0,0]=3 3111 B14R1.60 CCNC(=O)/C(=C/c1ccccc1)/Cl 240690a_100015525214_200020598536 [0,2,0,0,0,0|1,0,0]=3 3112 B14R1.60 CCNC(=O)/C(=C/c1ccccc1)/Cl 527a_100015525214_200020598536 [0,2,0,0,0,0|1,0,0]=3 3113 B14R1.60 CCNC(=O)/C(=C/c1ccccn1)/C 11a_100015525214_100025712827 [0,2,0,0,0,0|1,0,0]=3 3114 B14R1.60 CCNC(=O)/C(=C/c1ccccn1)/C 527a_100015525214_100025712827 [0,2,0,0,0,0|1,0,0]=3 3115 B14R1.60 CCNC(=O)/C(=C\c1ccccc1)/F 11a_100015525214_100020889036 [0,2,0,0,0,0|1,0,0]=3 3116 B14R1.60 CCNC(=O)/C(=C\c1ccccc1)/F 527a_100015525214_100020889036 [0,2,0,0,0,0|1,0,0]=3 3117 B14R1.60 CCNC(=O)C(=Cc1cccnc1)F 11a_100015525214_100000731744 [0,2,0,0,0,0|2,0,0]=4 3118 B14R1.60 CCNC(=O)C(=Cc1cccnc1)F 240690a_100015525214_100000731744 [0,2,0,0,0,0|2,0,0]=4 3119 B14R1.60 CCNC(=O)C(=Cc1cccnc1)F 527a_100015525214_100000731744 [0,2,0,0,0,0|2,0,0]=4 3120 B14R1.60 CCNC(=O)C(=O)Cc1ccccc1 1458a_200011297158_100015291786 [0,2,0,0,0,0|1,0,1]=4 3121 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 1626a_100000106764_200011297158 [0,2,0,0,0,0|2,0,0]=4 3122 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 22a_100000106764_200011297158 [0,2,0,0,0,0|2,0,0]=4 3123 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 240690a_100015525214_100000738435 [0,2,0,0,0,0|2,0,0]=4 3124 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 527a_100000106764_200011297158 [0,2,0,0,0,0|2,0,0]=4 3125 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 11a_100015525214_100000754839 [0,2,0,0,0,0|0,0,2]=4 3126 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 240690a_100015525214_100000754839 [0,2,0,0,0,0|0,0,2]=4 3127 B14R1.60 CCNC(=O)C(C)Cc1ccccc1 527a_100015525214_100000754839 [0,2,0,0,0,0|0,0,2]=4 3128 B14R1.60 CCNC(=O)C(C)Nc1ccccc1 34a_100000106764_100000230173 [0,2,0,0,0,0|1,0,1]=4 3129 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 11a_100015525214_100000188414 [0,2,0,0,0,0|1,0,1]=4 3130 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 240690a_100015525214_100000188414 [0,2,0,0,0,0|1,0,1]=4 3131 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 34a_100000210340_100000230173 [0,2,0,0,0,0|1,0,1]=4 3132 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 527a_100015525214_100000188414 [0,2,0,0,0,0|1,0,1]=4 3133 B14R1.60 CCNC(=O)C(C)Oc1ccccc1 7a_100000210340_100000230173 [0,2,0,0,0,0|1,0,1]=4 3134 B14R1.60 CCNC(=O)C(C)Sc1ccccc1 11a_100015525214_100000199063 [0,2,0,0,0,0|1,0,1]=4 3135 B14R1.60 CCNC(=O)C(C)Sc1ccccc1 240690a_100015525214_100000199063 [0,2,0,0,0,0|1,0,1]=4 3136 B14R1.60 CCNC(=O)C(C)Sc1ccccc1 527a_100015525214_100000199063 [0,2,0,0,0,0|1,0,1]=4 3137 B14R1.60 CCNC(=O)C(C)Sc1ccccc1 62a_100000230173_100000041952 [0,2,0,0,0,0|1,0,1]=4 3138 B14R1.60 CCNC(=O)C(C)Sc1ccccc1 62a_100000719477_100000230173 [0,2,0,0,0,0|1,0,1]=4 3139 B14R1.60 CCNC(=O)N(C)Cc1ccccc1 2708a_100015525214_100000186898 [0,2,0,0,0,0|1,0,1]=4 3140 B14R1.60 CCNC(=O)N(C)Cc1ccccc1 273464a_100015525214_100000186898 [0,2,0,0,0,0|1,0,1]=4 3141 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 11a_100000106764_100014798877 [0,2,0,0,0,0|2,0,0]=4 3142 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 1626a_100000106764_100014798877 [0,2,0,0,0,0|2,0,0]=4 3143 B14R1.60 CCOC(=O)C(C)Nc1ccccc1 34a_100000106764_100011216346 [0,2,0,0,0,0|1,0,1]=4 3144 B14R1.60 CCOC(=O)C(C)Oc1ccccc1 34a_100000210340_100011216346 [0,2,0,0,0,0|1,0,1]=4 3145 B14R1.60 CCOC(=O)C(C)Oc1ccccc1 7a_100000210340_100011216346 [0,2,0,0,0,0|1,0,1]=4 3146 B14R1.60 CCOC(=O)C(C)Sc1ccccc1 62a_100000719477_100011216346 [0,2,0,0,0,0|1,0,1]=4 3147 B14R1.60 CCOC(=O)C(C)Sc1ccccc1 62a_100011216346_100000041952 [0,2,0,0,0,0|1,0,1]=4 3148 B14R1.60 CN(Cc1ccccc1)C(=O)CC#N 1626a_100000186898_100051588842 [0,2,0,0,0,0|1,0,1]=4 3149 B14R1.60 CN(Cc1ccccc1)C(=O)CC#N 240690a_100000186898_100051588842 [0,2,0,0,0,0|1,0,1]=4 3150 B14R1.60 CN(Cc1ccccc1)C(=O)CCO 240690a_100000186898_100011216618 [0,2,0,0,0,0|1,0,1]=4 3151 B14R1.60 CN(Cc1ccccc1)C(=O)CS[13CH3] 62a_100000182870_200025704644 [0,2,0,0,0,0|1,0,1]=4 3152 B14R1.60 CN(Cc1ccccc1)C(=O)CS[13CH3] 62a_200025704644_100000182870 [0,2,0,0,0,0|1,0,1]=4 3153 B14R1.60 CNCC(=O)N(C)Cc1ccccc1 2230a_106832991635_100000182870 [0,2,0,0,0,0|1,0,1]=4 3154 B14R1.60 CNCC(=O)N(C)Cc1ccccc1 34a_100102657272_100000182870 [0,2,0,0,0,0|1,0,1]=4 3155 B14R1.60 CNCC(=O)N(C)Cc1ccccc1 7a_106832991635_100000182870 [0,2,0,0,0,0|1,0,1]=4 3156 B14R1.60 CNNC(=O)/C(=C/c1ccccc1)/C 22a_100016993582_100016990649 [0,2,0,0,0,0|0,0,0]=2 3157 B14R1.60 CNNC(=O)/C(=C/c1ccccc1)/Cl 22a_100016993582_200020598536 [0,2,0,0,0,0|1,0,0]=3 3158 B14R1.60 CNNC(=O)/C(=C/c1ccccn1)/C 22a_100016993582_100025712827 [0,2,0,0,0,0|1,0,0]=3 3159 B14R1.60 CNNC(=O)/C(=C\c1ccccc1)/F 22a_100016993582_100020889036 [0,2,0,0,0,0|1,0,0]=3 3160 B14R1.60 CNNC(=O)C(=Cc1cccnc1)F 22a_100016993582_100000731744 [0,2,0,0,0,0|2,0,0]=4 3161 B14R1.60 CNNC(=O)C(=O)Nc1ccccc1 22a_100016993582_100000738435 [0,2,0,0,0,0|2,0,0]=4 3162 B14R1.60 CNNC(=O)C(C)Cc1ccccc1 22a_100016993582_100000754839 [0,2,0,0,0,0|0,0,2]=4 3163 B14R1.60 CNNC(=O)C(C)Oc1ccccc1 22a_100016993582_100000188414 [0,2,0,0,0,0|1,0,1]=4 3164 B14R1.60 CNNC(=O)C(C)Sc1ccccc1 22a_100016993582_100000199063 [0,2,0,0,0,0|1,0,1]=4 3165 B14R1.60 COCC(=O)C(C)Cc1ccccc1 1458a_100000210968_200011218536 [0,2,0,0,0,0|0,0,2]=4 3166 B14R1.60 COCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000210968 [0,2,0,0,0,0|1,0,1]=4 3167 B14R1.60 COCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000210968 [0,2,0,0,0,0|1,0,1]=4 3168 B14R1.60 COCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000210968 [0,2,0,0,0,0|1,0,1]=4 3169 B14R1.60 COCC(=O)N(C)Cc1ccccc1 34a_100138415774_100000182870 [0,2,0,0,0,0|1,0,1]=4 3170 B14R1.60 COCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000210968 [0,2,0,0,0,0|1,0,1]=4 3171 B14R1.60 CSCC(=O)C(C)Cc1ccccc1 1458a_100000184570_200011218536 [0,2,0,0,0,0|0,0,2]=4 3172 B14R1.60 CSCC(=O)N(C)Cc1ccccc1 11a_100000186898_100000184570 [0,2,0,0,0,0|1,0,1]=4 3173 B14R1.60 CSCC(=O)N(C)Cc1ccccc1 1626a_100000186898_100000184570 [0,2,0,0,0,0|1,0,1]=4 3174 B14R1.60 CSCC(=O)N(C)Cc1ccccc1 240690a_100000186898_100000184570 [0,2,0,0,0,0|1,0,1]=4 3175 B14R1.60 CSCC(=O)N(C)Cc1ccccc1 527a_100000186898_100000184570 [0,2,0,0,0,0|1,0,1]=4 3176 B14R1.60 CSCC(=O)N(C)Cc1ccccc1 62a_100000182870_200000210301 [0,2,0,0,0,0|1,0,1]=4 3177 B14R1.60 CSCC(=O)N(C)Cc1ccccc1 62a_200000210301_100000182870 [0,2,0,0,0,0|1,0,1]=4 3178 B14R1.60 N#CCC(=O)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100011214920 [0,2,0,0,0,0|1,0,0]=3 3179 B14R1.60 N#CCC(=O)/C(=C\c1ccccc1)/F 1458a_100020889036_100011214920 [0,2,0,0,0,0|1,0,0]=3 3180 B14R1.60 N#CCC(=O)C(=Cc1cccnc1)F 1458a_100000731744_100011214920 [0,2,0,0,0,0|2,0,0]=4 3181 B14R1.60 N#CCC(=O)C(=O)Nc1ccccc1 1458a_100000738435_100011214920 [0,2,0,0,0,0|2,0,0]=4 3182 B14R1.60 O=C(CCF)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100011217306 [0,2,0,0,0,0|1,0,0]=3 3183 B14R1.60 O=C(CCF)/C(=C\c1ccccc1)/F 1458a_100020889036_100011217306 [0,2,0,0,0,0|1,0,0]=3 3184 B14R1.60 O=C(CCF)C(=Cc1cccnc1)F 1458a_100000731744_100011217306 [0,2,0,0,0,0|2,0,0]=4 3185 B14R1.60 O=C(CCF)C(=O)Nc1ccccc1 1458a_100000738435_100011217306 [0,2,0,0,0,0|2,0,0]=4 3186 B14R1.60 O=C(CCO)/C(=C/c1ccccc1)/Cl 1458a_200020598536_100000211926 [0,2,0,0,0,0|1,0,0]=3 3187 B14R1.60 O=C(CCO)/C(=C\c1ccccc1)/F 1458a_100020889036_100000211926 [0,2,0,0,0,0|1,0,0]=3 3188 B14R1.60 O=C(CCO)C(=Cc1cccnc1)F 1458a_100000731744_100000211926 [0,2,0,0,0,0|2,0,0]=4 3189 B14R1.60 O=C(CCO)C(=O)Nc1ccccc1 1458a_100000738435_100000211926 [0,2,0,0,0,0|2,0,0]=4 3190 B14R1.85 C#CC(=O)C(C)C(=O)c1ccccc1 1458a_100000211873_100000239700 [0,2,0,0,0,0|0,0,2]=4 3191 B14R1.85 C=CC(=O)C(C)C(=O)c1ccccc1 1458a_100000185746_100000239700 [0,2,0,0,0,0|0,0,2]=4 3192 B14R1.85 CC(C(=O)CO)C(=O)c1ccccc1 1458a_100000210174_100000239700 [0,2,0,0,0,0|0,0,1]=3 3193 B14R1.85 CC(c1ccccc1)N(C)C(=O)CO 240690a_100000195388_100000210174 [0,2,0,0,0,0|1,0,1]=4 3194 B14R1.85 CC(c1ccccc1)N(C)C(=O)CO 527a_100000195388_100000210174 [0,2,0,0,0,0|1,0,1]=4 3195 B14R1.85 CCC(=O)C(=O)N(C)c1ccccc1 1458a_100011297159_100000210202 [0,2,0,0,0,0|2,0,0]=4 3196 B14R1.85 CCC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000742827 [0,2,0,0,0,0|0,0,1]=3 3197 B14R1.85 CCC(=O)C(C)C(=O)c1ccccc1 1458a_100000210414_100000239700 [0,2,0,0,0,0|0,0,1]=3 3198 B14R1.85 CCC(=O)C(C)N(C)c1ccccc1 2230a_100000210012_100000742827 [0,2,0,0,0,0|1,0,1]=4 3199 B14R1.85 CCC(=O)C(C)N(C)c1ccccc1 269982a_100000210012_100000742827 [0,2,0,0,0,0|1,0,1]=4 3200 B14R1.85 CCC(=O)N(C)C(C)c1ccccc1 11a_100000195388_100000210414 [0,2,0,0,0,0|1,0,1]=4 3201 B14R1.85 CCC(=O)N(C)C(C)c1ccccc1 1626a_100000195388_100000210414 [0,2,0,0,0,0|1,0,1]=4 3202 B14R1.85 CCC(=O)N(C)C(C)c1ccccc1 240690a_100000195388_100000210414 [0,2,0,0,0,0|1,0,1]=4 3203 B14R1.85 CCC(=O)N(C)C(C)c1ccccc1 527a_100000195388_100000210414 [0,2,0,0,0,0|1,0,1]=4 3204 B14R1.85 CN(C(=O)C(=O)CF)c1ccccc1 1458a_100011297159_100015361967 [0,2,0,0,0,0|2,0,0]=4 3205 B14R1.85 CNC(=O)C(=O)C(C)c1ccccc1 1458a_100011218921_100000230085 [0,2,0,0,0,0|1,0,1]=4 3206 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 1626a_100000210012_100011218921 [0,2,0,0,0,0|2,0,0]=4 3207 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 1626a_100102657272_100011297159 [0,2,0,0,0,0|2,0,0]=4 3208 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 22a_100000210012_100011218921 [0,2,0,0,0,0|2,0,0]=4 3209 B14R1.85 CNC(=O)C(=O)N(C)c1ccccc1 240690a_100102657272_100011297159 [0,2,0,0,0,0|2,0,0]=4 3210 B14R1.85 CNC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000209862 [0,2,0,0,0,0|0,0,1]=3 3211 B14R1.85 CNC(=O)C(C)N(C)c1ccccc1 2230a_100000210012_100000731044 [0,2,0,0,0,0|1,0,1]=4 3212 B14R1.85 CNC(=O)C(C)N(C)c1ccccc1 269982a_100000210012_100000209862 [0,2,0,0,0,0|1,0,1]=4 3213 B14R1.85 CNC(=O)C(C)N(C)c1ccccc1 34a_100000210012_100000731044 [0,2,0,0,0,0|1,0,1]=4 3214 B14R1.85 CNC(=O)C(F)C(=O)c1ccccc1 1458a_100000185807_100009813575 [0,2,0,0,0,0|1,0,1]=4 3215 B14R1.85 CNC(=O)N(C)C(C)c1ccccc1 2708a_100102657272_100000195388 [0,2,0,0,0,0|1,0,1]=4 3216 B14R1.85 CNC(=O)N(C)C(C)c1ccccc1 273464a_100102657272_100000195388 [0,2,0,0,0,0|1,0,1]=4 3217 B14R1.85 COC(=O)C(=O)N(C)c1ccccc1 11a_100000210012_100000024059 [0,2,0,0,0,0|2,0,0]=4 3218 B14R1.85 COC(=O)C(=O)N(C)c1ccccc1 1626a_100000210012_100000024059 [0,2,0,0,0,0|2,0,0]=4 3219 B14R1.85 COC(=O)C(C)C(=O)c1ccccc1 1458a_100000185807_100000211248 [0,2,0,0,0,0|0,0,1]=3 3220 B14R1.85 COC(=O)C(C)N(C)c1ccccc1 2230a_100000210012_100000211248 [0,2,0,0,0,0|1,0,1]=4 3221 B14R1.85 COC(=O)C(C)N(C)c1ccccc1 269982a_100000210012_100000211248 [0,2,0,0,0,0|1,0,1]=4 3222 B14R1.85 COC(=O)C(C)N(C)c1ccccc1 34a_100000210012_100000211248 [0,2,0,0,0,0|1,0,1]=4 3223 B14R1.135 CC(Oc1cccc(c1)Br)C(=O)CF 1458a_100000246016_100015361967 [0,2,0,0,0,0|1,0,1]=4 3224 B14R1.135 CC(Oc1cccc(c1)Cl)C(=O)CF 1458a_100000185161_100015361967 [0,2,0,0,0,0|1,0,1]=4 3225 B14R1.135 CCC(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_100000210202 [0,2,0,0,0,0|2,0,0]=4 3226 B14R1.135 CCC(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_100000210202 [0,2,0,0,0,0|2,0,0]=4 3227 B14R1.135 CCC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100000742827 [0,2,0,0,0,0|1,0,1]=4 3228 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)Br 1458a_100000246016_100000210202 [0,2,0,0,0,0|1,0,1]=4 3229 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000742827 [0,2,0,0,0,0|1,0,1]=4 3230 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)C 1458a_100000183885_100000210202 [0,2,0,0,0,0|1,0,1]=4 3231 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000742827 [0,2,0,0,0,0|1,0,1]=4 3232 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)Cl 1458a_100000185161_100000210202 [0,2,0,0,0,0|1,0,1]=4 3233 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000742827 [0,2,0,0,0,0|1,0,1]=4 3234 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000742827 [0,2,0,0,0,0|1,0,1]=4 3235 B14R1.135 CCC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000742827 [0,2,0,0,0,0|1,0,1]=4 3236 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100000742827 [0,2,0,0,0,0|1,0,1]=4 3237 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)Br 62a_100000742827_100000691529 [0,2,0,0,0,0|1,0,1]=4 3238 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)C 62a_100000742827_100011215228 [0,2,0,0,0,0|1,0,1]=4 3239 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100000742827 [0,2,0,0,0,0|1,0,1]=4 3240 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100000742827 [0,2,0,0,0,0|1,0,1]=4 3241 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)Cl 62a_100000742827_100000699651 [0,2,0,0,0,0|1,0,1]=4 3242 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100000742827 [0,2,0,0,0,0|1,0,1]=4 3243 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)F 62a_100000742827_100000685547 [0,2,0,0,0,0|1,0,1]=4 3244 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100000742827 [0,2,0,0,0,0|1,0,1]=4 3245 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)N 62a_100000742827_100000210019 [0,2,0,0,0,0|1,0,1]=4 3246 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)O 62a_100000742827_100000211634 [0,2,0,0,0,0|1,0,1]=4 3247 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)[S] 62a_100000742827_114929384022 [0,2,0,0,0,0|1,0,1]=4 3248 B14R1.135 CCC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100000742827 [0,2,0,0,0,0|1,0,1]=4 3249 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100000210414 [0,2,0,0,0,0|1,0,1]=4 3250 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100000210414 [0,2,0,0,0,0|1,0,1]=4 3251 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100000210414 [0,2,0,0,0,0|1,0,1]=4 3252 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100000210414 [0,2,0,0,0,0|1,0,1]=4 3253 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100000210414 [0,2,0,0,0,0|1,0,1]=4 3254 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100000210414 [0,2,0,0,0,0|1,0,1]=4 3255 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100000210414 [0,2,0,0,0,0|1,0,1]=4 3256 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100000210414 [0,2,0,0,0,0|1,0,1]=4 3257 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100000210414 [0,2,0,0,0,0|1,0,1]=4 3258 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100000210414 [0,2,0,0,0,0|1,0,1]=4 3259 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100000210414 [0,2,0,0,0,0|1,0,1]=4 3260 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100000210414 [0,2,0,0,0,0|1,0,1]=4 3261 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100000210414 [0,2,0,0,0,0|1,0,1]=4 3262 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100000210414 [0,2,0,0,0,0|1,0,1]=4 3263 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100000210414 [0,2,0,0,0,0|1,0,1]=4 3264 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100000210414 [0,2,0,0,0,0|1,0,1]=4 3265 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100000210414 [0,2,0,0,0,0|1,0,1]=4 3266 B14R1.135 CCC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100000210414 [0,2,0,0,0,0|1,0,1]=4 3267 B14R1.135 CN(Cc1cccc(c1)Br)C(=O)CO 240690a_100000187585_100000210174 [0,2,0,0,0,0|1,0,1]=4 3268 B14R1.135 CN(Cc1cccc(c1)Br)C(=O)CO 527a_100000187585_100000210174 [0,2,0,0,0,0|1,0,1]=4 3269 B14R1.135 CN(Cc1cccc(c1)Cl)C(=O)CO 240690a_100020629429_100000210174 [0,2,0,0,0,0|1,0,1]=4 3270 B14R1.135 CN(Cc1cccc(c1)Cl)C(=O)CO 527a_100020629429_100000210174 [0,2,0,0,0,0|1,0,1]=4 3271 B14R1.135 CN(Cc1cccc(c1)F)C(=O)CO 240690a_100000184398_100000210174 [0,2,0,0,0,0|1,0,1]=4 3272 B14R1.135 CN(Cc1cccc(c1)F)C(=O)CO 527a_100000184398_100000210174 [0,2,0,0,0,0|1,0,1]=4 3273 B14R1.135 CN(Cc1cccc(c1)O)C(=O)CO 240690a_100000207540_100000210174 [0,2,0,0,0,0|1,0,1]=4 3274 B14R1.135 CN(Cc1cccc(c1)O)C(=O)CO 527a_100000207540_100000210174 [0,2,0,0,0,0|1,0,1]=4 3275 B14R1.135 CNC(=O)C(=O)Cc1cccc(c1)Br 1458a_100011218921_100000211773 [0,2,0,0,0,0|1,0,1]=4 3276 B14R1.135 CNC(=O)C(=O)Cc1cccc(c1)C 1458a_100011218921_100000211840 [0,2,0,0,0,0|1,0,1]=4 3277 B14R1.135 CNC(=O)C(=O)Cc1cccc(c1)Cl 1458a_100011218921_100000181238 [0,2,0,0,0,0|1,0,1]=4 3278 B14R1.135 CNC(=O)C(=O)Cc1cccc(c1)F 1458a_100011218921_100000230114 [0,2,0,0,0,0|1,0,1]=4 3279 B14R1.135 CNC(=O)C(=O)Cc1cccc(c1)I 1458a_100011218921_100011218688 [0,2,0,0,0,0|1,0,1]=4 3280 B14R1.135 CNC(=O)C(=O)Cc1cccc(c1)O 1458a_100011218921_100011660834 [0,2,0,0,0,0|1,0,1]=4 3281 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100011218921 [0,2,0,0,0,0|2,0,0]=4 3282 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Br 22a_100000210019_100011218921 [0,2,0,0,0,0|2,0,0]=4 3283 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Br 527a_100000210019_100011218921 [0,2,0,0,0,0|2,0,0]=4 3284 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)C 1626a_100000188690_100011218921 [0,2,0,0,0,0|2,0,0]=4 3285 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)C 22a_100000188690_100011218921 [0,2,0,0,0,0|2,0,0]=4 3286 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)C 527a_100000188690_100011218921 [0,2,0,0,0,0|2,0,0]=4 3287 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100011218921 [0,2,0,0,0,0|2,0,0]=4 3288 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Cl 22a_100000185859_100011218921 [0,2,0,0,0,0|2,0,0]=4 3289 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Cl 240690a_100102657272_200011297299 [0,2,0,0,0,0|2,0,0]=4 3290 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)F 1626a_100000210047_100011218921 [0,2,0,0,0,0|2,0,0]=4 3291 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)F 22a_100000210047_100011218921 [0,2,0,0,0,0|2,0,0]=4 3292 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)F 240690a_100102657272_200011297300 [0,2,0,0,0,0|2,0,0]=4 3293 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)F 527a_100000210047_100011218921 [0,2,0,0,0,0|2,0,0]=4 3294 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)I 1626a_100000211102_100011218921 [0,2,0,0,0,0|2,0,0]=4 3295 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)I 22a_100000211102_100011218921 [0,2,0,0,0,0|2,0,0]=4 3296 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)I 527a_100000211102_100011218921 [0,2,0,0,0,0|2,0,0]=4 3297 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)O 1626a_100000210217_100011218921 [0,2,0,0,0,0|2,0,0]=4 3298 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)O 22a_100000210217_100011218921 [0,2,0,0,0,0|2,0,0]=4 3299 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)O 527a_100000210217_100011218921 [0,2,0,0,0,0|2,0,0]=4 3300 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)Br 34a_100000210019_100000731044 [0,2,0,0,0,0|1,0,1]=4 3301 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100000731044 [0,2,0,0,0,0|1,0,1]=4 3302 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)C 34a_100000188690_100000731044 [0,2,0,0,0,0|1,0,1]=4 3303 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)Cl 34a_100000185859_100000731044 [0,2,0,0,0,0|1,0,1]=4 3304 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)F 34a_100000210047_100000731044 [0,2,0,0,0,0|1,0,1]=4 3305 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)I 34a_100000211102_100000731044 [0,2,0,0,0,0|1,0,1]=4 3306 B14R1.135 CNC(=O)C(C)Nc1cccc(c1)O 34a_100000210217_100000731044 [0,2,0,0,0,0|1,0,1]=4 3307 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Br 11a_106832991635_100000246016 [0,2,0,0,0,0|1,0,1]=4 3308 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Br 1626a_100102657272_100000246016 [0,2,0,0,0,0|1,0,1]=4 3309 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Br 240690a_100102657272_100000246016 [0,2,0,0,0,0|1,0,1]=4 3310 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Br 34a_100000210342_100000731044 [0,2,0,0,0,0|1,0,1]=4 3311 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Br 527a_100102657272_100000246016 [0,2,0,0,0,0|1,0,1]=4 3312 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000209862 [0,2,0,0,0,0|1,0,1]=4 3313 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)C 11a_106832991635_100000183885 [0,2,0,0,0,0|1,0,1]=4 3314 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)C 1626a_100102657272_100000183885 [0,2,0,0,0,0|1,0,1]=4 3315 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)C 240690a_100102657272_100000183885 [0,2,0,0,0,0|1,0,1]=4 3316 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)C 34a_100000210337_100000731044 [0,2,0,0,0,0|1,0,1]=4 3317 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)C 527a_100102657272_100000183885 [0,2,0,0,0,0|1,0,1]=4 3318 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000209862 [0,2,0,0,0,0|1,0,1]=4 3319 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Cl 11a_106832991635_100000185161 [0,2,0,0,0,0|1,0,1]=4 3320 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Cl 1626a_100102657272_100000185161 [0,2,0,0,0,0|1,0,1]=4 3321 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Cl 240690a_100102657272_100000185161 [0,2,0,0,0,0|1,0,1]=4 3322 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Cl 34a_100000210295_100000731044 [0,2,0,0,0,0|1,0,1]=4 3323 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Cl 527a_100102657272_100000185161 [0,2,0,0,0,0|1,0,1]=4 3324 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000209862 [0,2,0,0,0,0|1,0,1]=4 3325 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)F 34a_100000210426_100000731044 [0,2,0,0,0,0|1,0,1]=4 3326 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000209862 [0,2,0,0,0,0|1,0,1]=4 3327 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)I 34a_100000211634_100000731044 [0,2,0,0,0,0|1,0,1]=4 3328 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000209862 [0,2,0,0,0,0|1,0,1]=4 3329 B14R1.135 CNC(=O)C(C)Oc1cccc(c1)N 34a_100000210217_100000731044 [0,2,0,0,0,0|1,0,1]=4 3330 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)Br 62a_100000209862_100000691529 [0,2,0,0,0,0|1,0,1]=4 3331 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100000731044 [0,2,0,0,0,0|1,0,1]=4 3332 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)C 62a_100000209862_100011215228 [0,2,0,0,0,0|1,0,1]=4 3333 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100000731044 [0,2,0,0,0,0|1,0,1]=4 3334 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)Cl 62a_100000209862_100000699651 [0,2,0,0,0,0|1,0,1]=4 3335 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100000731044 [0,2,0,0,0,0|1,0,1]=4 3336 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)F 62a_100000209862_100000685547 [0,2,0,0,0,0|1,0,1]=4 3337 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100000731044 [0,2,0,0,0,0|1,0,1]=4 3338 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)N 62a_100000209862_100000210019 [0,2,0,0,0,0|1,0,1]=4 3339 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100000731044 [0,2,0,0,0,0|1,0,1]=4 3340 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)O 62a_100000209862_100000211634 [0,2,0,0,0,0|1,0,1]=4 3341 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)[S] 62a_100000209862_114929384022 [0,2,0,0,0,0|1,0,1]=4 3342 B14R1.135 CNC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100000731044 [0,2,0,0,0,0|1,0,1]=4 3343 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Br 2708a_100102657272_100000187585 [0,2,0,0,0,0|1,0,1]=4 3344 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Br 273464a_100102657272_100000187585 [0,2,0,0,0,0|1,0,1]=4 3345 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)C 2708a_100102657272_102495364743 [0,2,0,0,0,0|1,0,1]=4 3346 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)C 273464a_100102657272_102495364743 [0,2,0,0,0,0|1,0,1]=4 3347 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Cl 2708a_100102657272_100020629429 [0,2,0,0,0,0|1,0,1]=4 3348 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)Cl 273464a_100102657272_100020629429 [0,2,0,0,0,0|1,0,1]=4 3349 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)F 2708a_100102657272_100000184398 [0,2,0,0,0,0|1,0,1]=4 3350 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)F 273464a_100102657272_100000184398 [0,2,0,0,0,0|1,0,1]=4 3351 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)O 2708a_100102657272_100000207540 [0,2,0,0,0,0|1,0,1]=4 3352 B14R1.135 CNC(=O)N(C)Cc1cccc(c1)O 273464a_100102657272_100000207540 [0,2,0,0,0,0|1,0,1]=4 3353 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)Br 11a_100000210019_100000024059 [0,2,0,0,0,0|2,0,0]=4 3354 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)Br 1626a_100000210019_100000024059 [0,2,0,0,0,0|2,0,0]=4 3355 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)Br 527a_100000210019_100000024059 [0,2,0,0,0,0|2,0,0]=4 3356 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)C 11a_100000188690_100000024059 [0,2,0,0,0,0|2,0,0]=4 3357 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)C 1626a_100000188690_100000024059 [0,2,0,0,0,0|2,0,0]=4 3358 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)C 527a_100000188690_100000024059 [0,2,0,0,0,0|2,0,0]=4 3359 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)Cl 11a_100000185859_100000024059 [0,2,0,0,0,0|2,0,0]=4 3360 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000024059 [0,2,0,0,0,0|2,0,0]=4 3361 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)F 11a_100000210047_100000024059 [0,2,0,0,0,0|2,0,0]=4 3362 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)F 1626a_100000210047_100000024059 [0,2,0,0,0,0|2,0,0]=4 3363 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)F 527a_100000210047_100000024059 [0,2,0,0,0,0|2,0,0]=4 3364 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)I 11a_100000211102_100000024059 [0,2,0,0,0,0|2,0,0]=4 3365 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)I 1626a_100000211102_100000024059 [0,2,0,0,0,0|2,0,0]=4 3366 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)I 527a_100000211102_100000024059 [0,2,0,0,0,0|2,0,0]=4 3367 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000024059 [0,2,0,0,0,0|2,0,0]=4 3368 B14R1.135 COC(=O)C(=O)Nc1cccc(c1)O 527a_100000210217_100000024059 [0,2,0,0,0,0|2,0,0]=4 3369 B14R1.135 COC(=O)C(C)Nc1cccc(c1)Br 34a_100000210019_100000211248 [0,2,0,0,0,0|1,0,1]=4 3370 B14R1.135 COC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100000211248 [0,2,0,0,0,0|1,0,1]=4 3371 B14R1.135 COC(=O)C(C)Nc1cccc(c1)C 34a_100000188690_100000211248 [0,2,0,0,0,0|1,0,1]=4 3372 B14R1.135 COC(=O)C(C)Nc1cccc(c1)Cl 34a_100000185859_100000211248 [0,2,0,0,0,0|1,0,1]=4 3373 B14R1.135 COC(=O)C(C)Nc1cccc(c1)F 34a_100000210047_100000211248 [0,2,0,0,0,0|1,0,1]=4 3374 B14R1.135 COC(=O)C(C)Nc1cccc(c1)I 34a_100000211102_100000211248 [0,2,0,0,0,0|1,0,1]=4 3375 B14R1.135 COC(=O)C(C)Nc1cccc(c1)O 34a_100000210217_100000211248 [0,2,0,0,0,0|1,0,1]=4 3376 B14R1.135 COC(=O)C(C)Oc1cccc(c1)Br 34a_100000210342_100000211248 [0,2,0,0,0,0|1,0,1]=4 3377 B14R1.135 COC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000211248 [0,2,0,0,0,0|1,0,1]=4 3378 B14R1.135 COC(=O)C(C)Oc1cccc(c1)C 34a_100000210337_100000211248 [0,2,0,0,0,0|1,0,1]=4 3379 B14R1.135 COC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000211248 [0,2,0,0,0,0|1,0,1]=4 3380 B14R1.135 COC(=O)C(C)Oc1cccc(c1)Cl 34a_100000210295_100000211248 [0,2,0,0,0,0|1,0,1]=4 3381 B14R1.135 COC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000211248 [0,2,0,0,0,0|1,0,1]=4 3382 B14R1.135 COC(=O)C(C)Oc1cccc(c1)F 34a_100000210426_100000211248 [0,2,0,0,0,0|1,0,1]=4 3383 B14R1.135 COC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000211248 [0,2,0,0,0,0|1,0,1]=4 3384 B14R1.135 COC(=O)C(C)Oc1cccc(c1)I 34a_100000211634_100000211248 [0,2,0,0,0,0|1,0,1]=4 3385 B14R1.135 COC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000211248 [0,2,0,0,0,0|1,0,1]=4 3386 B14R1.135 COC(=O)C(C)Oc1cccc(c1)N 34a_100000210217_100000211248 [0,2,0,0,0,0|1,0,1]=4 3387 B14R1.135 COC(=O)C(C)Sc1cccc(c1)Br 62a_100000211248_100000691529 [0,2,0,0,0,0|1,0,1]=4 3388 B14R1.135 COC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100000211248 [0,2,0,0,0,0|1,0,1]=4 3389 B14R1.135 COC(=O)C(C)Sc1cccc(c1)C 62a_100000211248_100011215228 [0,2,0,0,0,0|1,0,1]=4 3390 B14R1.135 COC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100000211248 [0,2,0,0,0,0|1,0,1]=4 3391 B14R1.135 COC(=O)C(C)Sc1cccc(c1)Cl 62a_100000211248_100000699651 [0,2,0,0,0,0|1,0,1]=4 3392 B14R1.135 COC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100000211248 [0,2,0,0,0,0|1,0,1]=4 3393 B14R1.135 COC(=O)C(C)Sc1cccc(c1)F 62a_100000211248_100000685547 [0,2,0,0,0,0|1,0,1]=4 3394 B14R1.135 COC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100000211248 [0,2,0,0,0,0|1,0,1]=4 3395 B14R1.135 COC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100000211248 [0,2,0,0,0,0|1,0,1]=4 3396 B14R1.135 COC(=O)C(C)Sc1cccc(c1)N 62a_100000211248_100000210019 [0,2,0,0,0,0|1,0,1]=4 3397 B14R1.135 COC(=O)C(C)Sc1cccc(c1)O 62a_100000211248_100000211634 [0,2,0,0,0,0|1,0,1]=4 3398 B14R1.135 COC(=O)C(C)Sc1cccc(c1)[S] 62a_100000211248_114929384022 [0,2,0,0,0,0|1,0,1]=4 3399 B14R1.135 COC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100000211248 [0,2,0,0,0,0|1,0,1]=4 3400 B14R1.135 Cc1cccc(c1)CN(C)C(=O)CO 240690a_102495364743_100000210174 [0,2,0,0,0,0|1,0,1]=4 3401 B14R1.135 Cc1cccc(c1)CN(C)C(=O)CO 527a_102495364743_100000210174 [0,2,0,0,0,0|1,0,1]=4 3402 B14R1.135 Cc1cccc(c1)OC(C)C(=O)CF 1458a_100000183885_100015361967 [0,2,0,0,0,0|1,0,1]=4 3403 B14R1.135 O=C(CF)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_100015361967 [0,2,0,0,0,0|2,0,0]=4 3404 B14R1.135 O=C(CF)C(=O)Nc1cccc(c1)F 1458a_200011297300_100015361967 [0,2,0,0,0,0|2,0,0]=4 3405 B14R1.1007 CC(=Cc1ccccc1Cl)C(=O)CF 1458a_100000693296_100015361967 [0,2,0,0,0,0|0,0,0]=2 3406 B14R1.1007 CC(Oc1ccccc1Br)C(=O)CF 1458a_100000246065_100015361967 [0,2,0,0,0,0|1,0,1]=4 3407 B14R1.1007 CC(Oc1ccccc1Cl)C(=O)CF 1458a_100000191201_100015361967 [0,2,0,0,0,0|1,0,1]=4 3408 B14R1.1007 CC(Oc1ccccc1F)C(=O)CF 1458a_100000191191_100015361967 [0,2,0,0,0,0|1,0,1]=4 3409 B14R1.1007 CC(Sc1ccccc1Cl)C(=O)CF 1458a_100000181065_100015361967 [0,2,0,0,0,0|1,0,1]=4 3410 B14R1.1007 CCC(=O)C(=Cc1ccccc1Cl)C 1458a_100000693296_100000210202 [0,2,0,0,0,0|0,0,0]=2 3411 B14R1.1007 CCC(=O)C(=O)Nc1ccccc1C 1458a_200011297352_100000210202 [0,2,0,0,0,0|2,0,0]=4 3412 B14R1.1007 CCC(=O)C(=O)Nc1ccccc1F 1458a_200011297310_100000210202 [0,2,0,0,0,0|2,0,0]=4 3413 B14R1.1007 CCC(=O)C(C)Oc1ccccc1Br 1458a_100000246065_100000210202 [0,2,0,0,0,0|1,0,1]=4 3414 B14R1.1007 CCC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000742827 [0,2,0,0,0,0|1,0,1]=4 3415 B14R1.1007 CCC(=O)C(C)Oc1ccccc1C 1458a_100000189243_100000210202 [0,2,0,0,0,0|1,0,1]=4 3416 B14R1.1007 CCC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000742827 [0,2,0,0,0,0|1,0,1]=4 3417 B14R1.1007 CCC(=O)C(C)Oc1ccccc1Cl 1458a_100000191201_100000210202 [0,2,0,0,0,0|1,0,1]=4 3418 B14R1.1007 CCC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000742827 [0,2,0,0,0,0|1,0,1]=4 3419 B14R1.1007 CCC(=O)C(C)Oc1ccccc1F 1458a_100000191191_100000210202 [0,2,0,0,0,0|1,0,1]=4 3420 B14R1.1007 CCC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000742827 [0,2,0,0,0,0|1,0,1]=4 3421 B14R1.1007 CCC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000742827 [0,2,0,0,0,0|1,0,1]=4 3422 B14R1.1007 CCC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000742827 [0,2,0,0,0,0|1,0,1]=4 3423 B14R1.1007 CCC(=O)C(C)Sc1ccccc1Br 62a_100000695589_100000742827 [0,2,0,0,0,0|1,0,1]=4 3424 B14R1.1007 CCC(=O)C(C)Sc1ccccc1Br 62a_100000742827_100000695589 [0,2,0,0,0,0|1,0,1]=4 3425 B14R1.1007 CCC(=O)C(C)Sc1ccccc1C 62a_100000210755_100000742827 [0,2,0,0,0,0|1,0,1]=4 3426 B14R1.1007 CCC(=O)C(C)Sc1ccccc1C 62a_100000742827_100000210755 [0,2,0,0,0,0|1,0,1]=4 3427 B14R1.1007 CCC(=O)C(C)Sc1ccccc1Cl 1458a_100000181065_100000210202 [0,2,0,0,0,0|1,0,1]=4 3428 B14R1.1007 CCC(=O)C(C)Sc1ccccc1Cl 62a_100000742827_100000764095 [0,2,0,0,0,0|1,0,1]=4 3429 B14R1.1007 CCC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100000742827 [0,2,0,0,0,0|1,0,1]=4 3430 B14R1.1007 CCC(=O)C(C)Sc1ccccc1F 62a_100000742827_100011215700 [0,2,0,0,0,0|1,0,1]=4 3431 B14R1.1007 CCC(=O)C(C)Sc1ccccc1F 62a_100011215700_100000742827 [0,2,0,0,0,0|1,0,1]=4 3432 B14R1.1007 CCC(=O)C(C)Sc1ccccc1N 62a_100000210017_100000742827 [0,2,0,0,0,0|1,0,1]=4 3433 B14R1.1007 CCC(=O)C(C)Sc1ccccc1N 62a_100000742827_100000210017 [0,2,0,0,0,0|1,0,1]=4 3434 B14R1.1007 CCC(=O)C(C)Sc1ccccc1O 62a_100000739446_100000742827 [0,2,0,0,0,0|1,0,1]=4 3435 B14R1.1007 CCC(=O)C(C)Sc1ccccc1O 62a_100000742827_100000739446 [0,2,0,0,0,0|1,0,1]=4 3436 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Br 11a_100000184654_100000210414 [0,2,0,0,0,0|1,0,1]=4 3437 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Br 1626a_100000184654_100000210414 [0,2,0,0,0,0|1,0,1]=4 3438 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Br 240690a_100000184654_100000210414 [0,2,0,0,0,0|1,0,1]=4 3439 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Br 527a_100000184654_100000210414 [0,2,0,0,0,0|1,0,1]=4 3440 B14R1.1007 CCC(=O)N(C)Cc1ccccc1C 1626a_100000184421_100000210414 [0,2,0,0,0,0|1,0,1]=4 3441 B14R1.1007 CCC(=O)N(C)Cc1ccccc1C 240690a_100000184421_100000210414 [0,2,0,0,0,0|1,0,1]=4 3442 B14R1.1007 CCC(=O)N(C)Cc1ccccc1C 527a_100000184421_100000210414 [0,2,0,0,0,0|1,0,1]=4 3443 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Cl 11a_100000184507_100000210414 [0,2,0,0,0,0|1,0,1]=4 3444 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Cl 1626a_100000184507_100000210414 [0,2,0,0,0,0|1,0,1]=4 3445 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Cl 240690a_100000184507_100000210414 [0,2,0,0,0,0|1,0,1]=4 3446 B14R1.1007 CCC(=O)N(C)Cc1ccccc1Cl 527a_100000184507_100000210414 [0,2,0,0,0,0|1,0,1]=4 3447 B14R1.1007 CCC(=O)N(C)Cc1ccccc1F 11a_100000742528_100000210414 [0,2,0,0,0,0|1,0,1]=4 3448 B14R1.1007 CCC(=O)N(C)Cc1ccccc1F 1626a_100000742528_100000210414 [0,2,0,0,0,0|1,0,1]=4 3449 B14R1.1007 CCC(=O)N(C)Cc1ccccc1F 240690a_100000742528_100000210414 [0,2,0,0,0,0|1,0,1]=4 3450 B14R1.1007 CCC(=O)N(C)Cc1ccccc1F 527a_100000742528_100000210414 [0,2,0,0,0,0|1,0,1]=4 3451 B14R1.1007 CCC(=O)N(C)Cc1ccccc1O 240690a_100015189988_100000210414 [0,2,0,0,0,0|1,0,1]=4 3452 B14R1.1007 CCC(=O)N(C)Cc1ccccc1O 527a_100015189988_100000210414 [0,2,0,0,0,0|1,0,1]=4 3453 B14R1.1007 CN(Cc1ccccc1Br)C(=O)CO 240690a_100000184654_100000210174 [0,2,0,0,0,0|1,0,1]=4 3454 B14R1.1007 CN(Cc1ccccc1Br)C(=O)CO 527a_100000184654_100000210174 [0,2,0,0,0,0|1,0,1]=4 3455 B14R1.1007 CN(Cc1ccccc1Cl)C(=O)CO 240690a_100000184507_100000210174 [0,2,0,0,0,0|1,0,1]=4 3456 B14R1.1007 CN(Cc1ccccc1Cl)C(=O)CO 527a_100000184507_100000210174 [0,2,0,0,0,0|1,0,1]=4 3457 B14R1.1007 CN(Cc1ccccc1F)C(=O)CO 240690a_100000742528_100000210174 [0,2,0,0,0,0|1,0,1]=4 3458 B14R1.1007 CN(Cc1ccccc1F)C(=O)CO 527a_100000742528_100000210174 [0,2,0,0,0,0|1,0,1]=4 3459 B14R1.1007 CN(Cc1ccccc1O)C(=O)CO 240690a_100015189988_100000210174 [0,2,0,0,0,0|1,0,1]=4 3460 B14R1.1007 CN(Cc1ccccc1O)C(=O)CO 527a_100015189988_100000210174 [0,2,0,0,0,0|1,0,1]=4 3461 B14R1.1007 CNC(=O)C(=Cc1ccccc1Cl)C 11a_106832991635_100000693296 [0,2,0,0,0,0|0,0,0]=2 3462 B14R1.1007 CNC(=O)C(=Cc1ccccc1Cl)C 1626a_100102657272_100000693296 [0,2,0,0,0,0|0,0,0]=2 3463 B14R1.1007 CNC(=O)C(=Cc1ccccc1Cl)C 240690a_100102657272_100000693296 [0,2,0,0,0,0|0,0,0]=2 3464 B14R1.1007 CNC(=O)C(=Cc1ccccc1Cl)C 527a_100102657272_100000693296 [0,2,0,0,0,0|0,0,0]=2 3465 B14R1.1007 CNC(=O)C(=O)Cc1ccccc1Br 1458a_100011218921_100000184730 [0,2,0,0,0,0|1,0,1]=4 3466 B14R1.1007 CNC(=O)C(=O)Cc1ccccc1C 1458a_100011218921_100000211839 [0,2,0,0,0,0|1,0,1]=4 3467 B14R1.1007 CNC(=O)C(=O)Cc1ccccc1Cl 1458a_100011218921_100000187162 [0,2,0,0,0,0|1,0,1]=4 3468 B14R1.1007 CNC(=O)C(=O)Cc1ccccc1F 1458a_100011218921_100000187165 [0,2,0,0,0,0|1,0,1]=4 3469 B14R1.1007 CNC(=O)C(=O)Cc1ccccc1I 1458a_100011218921_100011216222 [0,2,0,0,0,0|1,0,1]=4 3470 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1Br 1626a_100000210017_100011218921 [0,2,0,0,0,0|2,0,0]=4 3471 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1C 1626a_100015192222_100011218921 [0,2,0,0,0,0|2,0,0]=4 3472 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1C 22a_100015192222_100011218921 [0,2,0,0,0,0|2,0,0]=4 3473 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1C 240690a_100102657272_200011297352 [0,2,0,0,0,0|2,0,0]=4 3474 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1C 527a_100015192222_100011218921 [0,2,0,0,0,0|2,0,0]=4 3475 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1Cl 1626a_100000185783_100011218921 [0,2,0,0,0,0|2,0,0]=4 3476 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1Cl 22a_100000185783_100011218921 [0,2,0,0,0,0|2,0,0]=4 3477 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1Cl 240690a_100102657272_200011297307 [0,2,0,0,0,0|2,0,0]=4 3478 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1Cl 527a_100000185783_100011218921 [0,2,0,0,0,0|2,0,0]=4 3479 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1F 1626a_100000210422_100011218921 [0,2,0,0,0,0|2,0,0]=4 3480 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1F 22a_100000210422_100011218921 [0,2,0,0,0,0|2,0,0]=4 3481 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1F 240690a_100102657272_200011297310 [0,2,0,0,0,0|2,0,0]=4 3482 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1F 527a_100000210422_100011218921 [0,2,0,0,0,0|2,0,0]=4 3483 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1I 1626a_100000210053_100011218921 [0,2,0,0,0,0|2,0,0]=4 3484 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1O 22a_100000185747_100011218921 [0,2,0,0,0,0|2,0,0]=4 3485 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1O 527a_100000185747_100011218921 [0,2,0,0,0,0|2,0,0]=4 3486 B14R1.1007 CNC(=O)C(C)Nc1ccccc1Br 34a_100000210017_100000731044 [0,2,0,0,0,0|1,0,1]=4 3487 B14R1.1007 CNC(=O)C(C)Nc1ccccc1C 34a_100015192222_100000731044 [0,2,0,0,0,0|1,0,1]=4 3488 B14R1.1007 CNC(=O)C(C)Nc1ccccc1Cl 34a_100000185783_100000731044 [0,2,0,0,0,0|1,0,1]=4 3489 B14R1.1007 CNC(=O)C(C)Nc1ccccc1F 34a_100000210422_100000731044 [0,2,0,0,0,0|1,0,1]=4 3490 B14R1.1007 CNC(=O)C(C)Nc1ccccc1I 34a_100000210053_100000731044 [0,2,0,0,0,0|1,0,1]=4 3491 B14R1.1007 CNC(=O)C(C)Nc1ccccc1O 34a_100000185747_100000731044 [0,2,0,0,0,0|1,0,1]=4 3492 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Br 11a_106832991635_100000246065 [0,2,0,0,0,0|1,0,1]=4 3493 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Br 1626a_100102657272_100000246065 [0,2,0,0,0,0|1,0,1]=4 3494 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Br 240690a_100102657272_100000246065 [0,2,0,0,0,0|1,0,1]=4 3495 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Br 34a_100000181306_100000731044 [0,2,0,0,0,0|1,0,1]=4 3496 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Br 527a_100102657272_100000246065 [0,2,0,0,0,0|1,0,1]=4 3497 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000209862 [0,2,0,0,0,0|1,0,1]=4 3498 B14R1.1007 CNC(=O)C(C)Oc1ccccc1C 11a_106832991635_100000189243 [0,2,0,0,0,0|1,0,1]=4 3499 B14R1.1007 CNC(=O)C(C)Oc1ccccc1C 1626a_100102657272_100000189243 [0,2,0,0,0,0|1,0,1]=4 3500 B14R1.1007 CNC(=O)C(C)Oc1ccccc1C 240690a_100102657272_100000189243 [0,2,0,0,0,0|1,0,1]=4 3501 B14R1.1007 CNC(=O)C(C)Oc1ccccc1C 34a_100000210338_100000731044 [0,2,0,0,0,0|1,0,1]=4 3502 B14R1.1007 CNC(=O)C(C)Oc1ccccc1C 527a_100102657272_100000189243 [0,2,0,0,0,0|1,0,1]=4 3503 B14R1.1007 CNC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000209862 [0,2,0,0,0,0|1,0,1]=4 3504 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Cl 11a_106832991635_100000191201 [0,2,0,0,0,0|1,0,1]=4 3505 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Cl 1626a_100102657272_100000191201 [0,2,0,0,0,0|1,0,1]=4 3506 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Cl 240690a_100102657272_100000191201 [0,2,0,0,0,0|1,0,1]=4 3507 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Cl 34a_100000210172_100000731044 [0,2,0,0,0,0|1,0,1]=4 3508 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Cl 527a_100102657272_100000191201 [0,2,0,0,0,0|1,0,1]=4 3509 B14R1.1007 CNC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000209862 [0,2,0,0,0,0|1,0,1]=4 3510 B14R1.1007 CNC(=O)C(C)Oc1ccccc1F 11a_106832991635_100000191191 [0,2,0,0,0,0|1,0,1]=4 3511 B14R1.1007 CNC(=O)C(C)Oc1ccccc1F 1626a_100102657272_100000191191 [0,2,0,0,0,0|1,0,1]=4 3512 B14R1.1007 CNC(=O)C(C)Oc1ccccc1F 240690a_100102657272_100000191191 [0,2,0,0,0,0|1,0,1]=4 3513 B14R1.1007 CNC(=O)C(C)Oc1ccccc1F 34a_100000210171_100000731044 [0,2,0,0,0,0|1,0,1]=4 3514 B14R1.1007 CNC(=O)C(C)Oc1ccccc1F 527a_100102657272_100000191191 [0,2,0,0,0,0|1,0,1]=4 3515 B14R1.1007 CNC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000209862 [0,2,0,0,0,0|1,0,1]=4 3516 B14R1.1007 CNC(=O)C(C)Oc1ccccc1I 34a_100000739446_100000731044 [0,2,0,0,0,0|1,0,1]=4 3517 B14R1.1007 CNC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000209862 [0,2,0,0,0,0|1,0,1]=4 3518 B14R1.1007 CNC(=O)C(C)Oc1ccccc1N 34a_100000185747_100000731044 [0,2,0,0,0,0|1,0,1]=4 3519 B14R1.1007 CNC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000209862 [0,2,0,0,0,0|1,0,1]=4 3520 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Br 62a_100000209862_100000695589 [0,2,0,0,0,0|1,0,1]=4 3521 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Br 62a_100000695589_100000731044 [0,2,0,0,0,0|1,0,1]=4 3522 B14R1.1007 CNC(=O)C(C)Sc1ccccc1C 62a_100000209862_100000210755 [0,2,0,0,0,0|1,0,1]=4 3523 B14R1.1007 CNC(=O)C(C)Sc1ccccc1C 62a_100000210755_100000731044 [0,2,0,0,0,0|1,0,1]=4 3524 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Cl 11a_106832991635_100000181065 [0,2,0,0,0,0|1,0,1]=4 3525 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Cl 1626a_100102657272_100000181065 [0,2,0,0,0,0|1,0,1]=4 3526 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Cl 240690a_100102657272_100000181065 [0,2,0,0,0,0|1,0,1]=4 3527 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Cl 527a_100102657272_100000181065 [0,2,0,0,0,0|1,0,1]=4 3528 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Cl 62a_100000209862_100000764095 [0,2,0,0,0,0|1,0,1]=4 3529 B14R1.1007 CNC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100000731044 [0,2,0,0,0,0|1,0,1]=4 3530 B14R1.1007 CNC(=O)C(C)Sc1ccccc1F 62a_100000209862_100011215700 [0,2,0,0,0,0|1,0,1]=4 3531 B14R1.1007 CNC(=O)C(C)Sc1ccccc1F 62a_100011215700_100000731044 [0,2,0,0,0,0|1,0,1]=4 3532 B14R1.1007 CNC(=O)C(C)Sc1ccccc1N 62a_100000209862_100000210017 [0,2,0,0,0,0|1,0,1]=4 3533 B14R1.1007 CNC(=O)C(C)Sc1ccccc1N 62a_100000210017_100000731044 [0,2,0,0,0,0|1,0,1]=4 3534 B14R1.1007 CNC(=O)C(C)Sc1ccccc1O 62a_100000209862_100000739446 [0,2,0,0,0,0|1,0,1]=4 3535 B14R1.1007 CNC(=O)C(C)Sc1ccccc1O 62a_100000739446_100000731044 [0,2,0,0,0,0|1,0,1]=4 3536 B14R1.1007 CNC(=O)N(C)Cc1ccccc1Br 2708a_100102657272_100000184654 [0,2,0,0,0,0|1,0,1]=4 3537 B14R1.1007 CNC(=O)N(C)Cc1ccccc1Br 273464a_100102657272_100000184654 [0,2,0,0,0,0|1,0,1]=4 3538 B14R1.1007 CNC(=O)N(C)Cc1ccccc1C 2708a_100102657272_100000184421 [0,2,0,0,0,0|1,0,1]=4 3539 B14R1.1007 CNC(=O)N(C)Cc1ccccc1C 273464a_100102657272_100000184421 [0,2,0,0,0,0|1,0,1]=4 3540 B14R1.1007 CNC(=O)N(C)Cc1ccccc1Cl 2708a_100102657272_100000184507 [0,2,0,0,0,0|1,0,1]=4 3541 B14R1.1007 CNC(=O)N(C)Cc1ccccc1Cl 273464a_100102657272_100000184507 [0,2,0,0,0,0|1,0,1]=4 3542 B14R1.1007 CNC(=O)N(C)Cc1ccccc1F 2708a_100102657272_100000742528 [0,2,0,0,0,0|1,0,1]=4 3543 B14R1.1007 CNC(=O)N(C)Cc1ccccc1F 273464a_100102657272_100000742528 [0,2,0,0,0,0|1,0,1]=4 3544 B14R1.1007 CNC(=O)N(C)Cc1ccccc1O 2708a_100102657272_100015189988 [0,2,0,0,0,0|1,0,1]=4 3545 B14R1.1007 CNC(=O)N(C)Cc1ccccc1O 273464a_100102657272_100015189988 [0,2,0,0,0,0|1,0,1]=4 3546 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Br 11a_100000210017_100000024059 [0,2,0,0,0,0|2,0,0]=4 3547 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Br 1626a_100000210017_100000024059 [0,2,0,0,0,0|2,0,0]=4 3548 B14R1.1007 COC(=O)C(=O)Nc1ccccc1C 11a_100015192222_100000024059 [0,2,0,0,0,0|2,0,0]=4 3549 B14R1.1007 COC(=O)C(=O)Nc1ccccc1C 1626a_100015192222_100000024059 [0,2,0,0,0,0|2,0,0]=4 3550 B14R1.1007 COC(=O)C(=O)Nc1ccccc1C 527a_100015192222_100000024059 [0,2,0,0,0,0|2,0,0]=4 3551 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Cl 11a_100000185783_100000024059 [0,2,0,0,0,0|2,0,0]=4 3552 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Cl 1626a_100000185783_100000024059 [0,2,0,0,0,0|2,0,0]=4 3553 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Cl 527a_100000185783_100000024059 [0,2,0,0,0,0|2,0,0]=4 3554 B14R1.1007 COC(=O)C(=O)Nc1ccccc1F 11a_100000210422_100000024059 [0,2,0,0,0,0|2,0,0]=4 3555 B14R1.1007 COC(=O)C(=O)Nc1ccccc1F 1626a_100000210422_100000024059 [0,2,0,0,0,0|2,0,0]=4 3556 B14R1.1007 COC(=O)C(=O)Nc1ccccc1F 527a_100000210422_100000024059 [0,2,0,0,0,0|2,0,0]=4 3557 B14R1.1007 COC(=O)C(=O)Nc1ccccc1I 11a_100000210053_100000024059 [0,2,0,0,0,0|2,0,0]=4 3558 B14R1.1007 COC(=O)C(=O)Nc1ccccc1I 1626a_100000210053_100000024059 [0,2,0,0,0,0|2,0,0]=4 3559 B14R1.1007 COC(=O)C(=O)Nc1ccccc1O 527a_100000185747_100000024059 [0,2,0,0,0,0|2,0,0]=4 3560 B14R1.1007 COC(=O)C(C)Nc1ccccc1Br 34a_100000210017_100000211248 [0,2,0,0,0,0|1,0,1]=4 3561 B14R1.1007 COC(=O)C(C)Nc1ccccc1C 34a_100015192222_100000211248 [0,2,0,0,0,0|1,0,1]=4 3562 B14R1.1007 COC(=O)C(C)Nc1ccccc1Cl 34a_100000185783_100000211248 [0,2,0,0,0,0|1,0,1]=4 3563 B14R1.1007 COC(=O)C(C)Nc1ccccc1F 34a_100000210422_100000211248 [0,2,0,0,0,0|1,0,1]=4 3564 B14R1.1007 COC(=O)C(C)Nc1ccccc1I 34a_100000210053_100000211248 [0,2,0,0,0,0|1,0,1]=4 3565 B14R1.1007 COC(=O)C(C)Nc1ccccc1O 34a_100000185747_100000211248 [0,2,0,0,0,0|1,0,1]=4 3566 B14R1.1007 COC(=O)C(C)Oc1ccccc1Br 34a_100000181306_100000211248 [0,2,0,0,0,0|1,0,1]=4 3567 B14R1.1007 COC(=O)C(C)Oc1ccccc1Br 7a_100000181306_100000211248 [0,2,0,0,0,0|1,0,1]=4 3568 B14R1.1007 COC(=O)C(C)Oc1ccccc1C 34a_100000210338_100000211248 [0,2,0,0,0,0|1,0,1]=4 3569 B14R1.1007 COC(=O)C(C)Oc1ccccc1C 7a_100000210338_100000211248 [0,2,0,0,0,0|1,0,1]=4 3570 B14R1.1007 COC(=O)C(C)Oc1ccccc1Cl 34a_100000210172_100000211248 [0,2,0,0,0,0|1,0,1]=4 3571 B14R1.1007 COC(=O)C(C)Oc1ccccc1Cl 7a_100000210172_100000211248 [0,2,0,0,0,0|1,0,1]=4 3572 B14R1.1007 COC(=O)C(C)Oc1ccccc1F 34a_100000210171_100000211248 [0,2,0,0,0,0|1,0,1]=4 3573 B14R1.1007 COC(=O)C(C)Oc1ccccc1F 7a_100000210171_100000211248 [0,2,0,0,0,0|1,0,1]=4 3574 B14R1.1007 COC(=O)C(C)Oc1ccccc1I 34a_100000739446_100000211248 [0,2,0,0,0,0|1,0,1]=4 3575 B14R1.1007 COC(=O)C(C)Oc1ccccc1I 7a_100000739446_100000211248 [0,2,0,0,0,0|1,0,1]=4 3576 B14R1.1007 COC(=O)C(C)Oc1ccccc1N 34a_100000185747_100000211248 [0,2,0,0,0,0|1,0,1]=4 3577 B14R1.1007 COC(=O)C(C)Oc1ccccc1N 7a_100000185747_100000211248 [0,2,0,0,0,0|1,0,1]=4 3578 B14R1.1007 COC(=O)C(C)Sc1ccccc1Br 62a_100000211248_100000695589 [0,2,0,0,0,0|1,0,1]=4 3579 B14R1.1007 COC(=O)C(C)Sc1ccccc1Br 62a_100000695589_100000211248 [0,2,0,0,0,0|1,0,1]=4 3580 B14R1.1007 COC(=O)C(C)Sc1ccccc1C 62a_100000210755_100000211248 [0,2,0,0,0,0|1,0,1]=4 3581 B14R1.1007 COC(=O)C(C)Sc1ccccc1C 62a_100000211248_100000210755 [0,2,0,0,0,0|1,0,1]=4 3582 B14R1.1007 COC(=O)C(C)Sc1ccccc1Cl 62a_100000211248_100000764095 [0,2,0,0,0,0|1,0,1]=4 3583 B14R1.1007 COC(=O)C(C)Sc1ccccc1Cl 62a_100000764095_100000211248 [0,2,0,0,0,0|1,0,1]=4 3584 B14R1.1007 COC(=O)C(C)Sc1ccccc1F 62a_100000211248_100011215700 [0,2,0,0,0,0|1,0,1]=4 3585 B14R1.1007 COC(=O)C(C)Sc1ccccc1F 62a_100011215700_100000211248 [0,2,0,0,0,0|1,0,1]=4 3586 B14R1.1007 COC(=O)C(C)Sc1ccccc1N 62a_100000210017_100000211248 [0,2,0,0,0,0|1,0,1]=4 3587 B14R1.1007 COC(=O)C(C)Sc1ccccc1N 62a_100000211248_100000210017 [0,2,0,0,0,0|1,0,1]=4 3588 B14R1.1007 COC(=O)C(C)Sc1ccccc1O 62a_100000211248_100000739446 [0,2,0,0,0,0|1,0,1]=4 3589 B14R1.1007 COC(=O)C(C)Sc1ccccc1O 62a_100000739446_100000211248 [0,2,0,0,0,0|1,0,1]=4 3590 B14R1.1007 Cc1ccccc1CN(C)C(=O)CO 240690a_100000184421_100000210174 [0,2,0,0,0,0|1,0,1]=4 3591 B14R1.1007 Cc1ccccc1CN(C)C(=O)CO 527a_100000184421_100000210174 [0,2,0,0,0,0|1,0,1]=4 3592 B14R1.1007 Cc1ccccc1NC(=O)C(=O)CF 1458a_200011297352_100015361967 [0,2,0,0,0,0|2,0,0]=4 3593 B14R1.1007 Cc1ccccc1OC(C)C(=O)CF 1458a_100000189243_100015361967 [0,2,0,0,0,0|1,0,1]=4 3594 B14R1.1007 O=C(CF)C(=O)Nc1ccccc1F 1458a_200011297310_100015361967 [0,2,0,0,0,0|2,0,0]=4 3595 B14R1.1031 CCC(=O)C(=Cc1ccccc1)C#N 1458a_100000162679_100000210202 [0,2,0,0,0,0|0,0,1]=3 3596 B14R1.1031 CCC(=O)C(CC)Oc1ccccc1 1458a_100000211556_100000210202 [0,2,0,0,0,0|1,0,1]=4 3597 B14R1.1031 CCC(=O)C(CC)Sc1ccccc1 1458a_100000230495_100000210202 [0,2,0,0,0,0|1,0,1]=4 3598 B14R1.1031 CCC(=O)N(CC)Cc1ccccc1 11a_100000186914_100000210414 [0,2,0,0,0,0|1,0,1]=4 3599 B14R1.1031 CCC(=O)N(CC)Cc1ccccc1 1626a_100000186914_100000210414 [0,2,0,0,0,0|1,0,1]=4 3600 B14R1.1031 CCC(=O)N(CC)Cc1ccccc1 240690a_100000186914_100000210414 [0,2,0,0,0,0|1,0,1]=4 3601 B14R1.1031 CCC(=O)N(CC)Cc1ccccc1 527a_100000186914_100000210414 [0,2,0,0,0,0|1,0,1]=4 3602 B14R1.1031 CCC(Nc1ccccc1)C(=O)OC 34a_100000106764_100000235869 [0,2,0,0,0,0|1,0,1]=4 3603 B14R1.1031 CCC(Oc1ccccc1)C(=O)CF 1458a_100000211556_100015361967 [0,2,0,0,0,0|1,0,1]=4 3604 B14R1.1031 CCC(Oc1ccccc1)C(=O)NC 11a_106832991635_100000211556 [0,2,0,0,0,0|1,0,1]=4 3605 B14R1.1031 CCC(Oc1ccccc1)C(=O)NC 1626a_100102657272_100000211556 [0,2,0,0,0,0|1,0,1]=4 3606 B14R1.1031 CCC(Oc1ccccc1)C(=O)NC 240690a_100102657272_100000211556 [0,2,0,0,0,0|1,0,1]=4 3607 B14R1.1031 CCC(Oc1ccccc1)C(=O)NC 527a_100102657272_100000211556 [0,2,0,0,0,0|1,0,1]=4 3608 B14R1.1031 CCC(Oc1ccccc1)C(=O)OC 34a_100000210340_100000235869 [0,2,0,0,0,0|1,0,1]=4 3609 B14R1.1031 CCC(Oc1ccccc1)C(=O)OC 7a_100000210340_100000742303 [0,2,0,0,0,0|1,0,1]=4 3610 B14R1.1031 CCC(Sc1ccccc1)C(=O)CF 1458a_100000230495_100015361967 [0,2,0,0,0,0|1,0,1]=4 3611 B14R1.1031 CCC(Sc1ccccc1)C(=O)NC 11a_106832991635_100000230495 [0,2,0,0,0,0|1,0,1]=4 3612 B14R1.1031 CCC(Sc1ccccc1)C(=O)NC 1626a_100102657272_100000230495 [0,2,0,0,0,0|1,0,1]=4 3613 B14R1.1031 CCC(Sc1ccccc1)C(=O)NC 240690a_100102657272_100000230495 [0,2,0,0,0,0|1,0,1]=4 3614 B14R1.1031 CCC(Sc1ccccc1)C(=O)NC 527a_100102657272_100000230495 [0,2,0,0,0,0|1,0,1]=4 3615 B14R1.1031 CCC(Sc1ccccc1)C(=O)OC 62a_100000235869_100000041952 [0,2,0,0,0,0|1,0,1]=4 3616 B14R1.1031 CCC(Sc1ccccc1)C(=O)OC 62a_100000719477_100000235869 [0,2,0,0,0,0|1,0,1]=4 3617 B14R1.1031 CCN(Cc1ccccc1)C(=O)CO 240690a_100000186914_100000210174 [0,2,0,0,0,0|1,0,1]=4 3618 B14R1.1031 CCN(Cc1ccccc1)C(=O)CO 527a_100000186914_100000210174 [0,2,0,0,0,0|1,0,1]=4 3619 B14R1.1031 CCN(Cc1ccccc1)C(=O)NC 2708a_100102657272_100000186914 [0,2,0,0,0,0|1,0,1]=4 3620 B14R1.1031 CCN(Cc1ccccc1)C(=O)NC 273464a_100102657272_100000186914 [0,2,0,0,0,0|1,0,1]=4 3621 B14R1.1031 CNC(=O)C(=Cc1ccccc1)C#N 527a_100102657272_100000162679 [0,2,0,0,0,0|0,0,1]=3 3622 B14R1.1031 CNC(=O)C(Cc1ccccc1)NC 2230a_100000719550_200000210301 [0,2,0,0,0,0|0,0,2]=4 3623 B14R1.1031 CNC(=O)C(Cc1ccccc1)NC 34a_100000719550_200000210301 [0,2,0,0,0,0|0,0,2]=4 3624 B14R1.1031 CNC(=O)C(Cc1ccccc1)N[13CH3] 2230a_100000719550_200025704644 [0,2,0,0,0,0|0,0,2]=4 3625 B14R1.1031 CNC(=O)C(Cc1ccccc1)N[13CH3] 34a_100000719550_200025704644 [0,2,0,0,0,0|0,0,2]=4 3626 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC 34a_100102657272_100000764117 [0,2,0,0,0,0|0,0,2]=4 3627 B14R1.1031 COC(=O)C(CO)Nc1ccccc1 34a_100000106764_100012276630 [0,2,0,0,0,0|1,0,1]=4 3628 B14R1.1031 COC(=O)C(CO)Oc1ccccc1 34a_100000210340_100012276630 [0,2,0,0,0,0|1,0,1]=4 3629 B14R1.1031 COC(=O)C(CO)Sc1ccccc1 62a_100000719477_100012276630 [0,2,0,0,0,0|1,0,1]=4 3630 B14R1.1031 COC(=O)C(CO)Sc1ccccc1 62a_100012276630_100000041952 [0,2,0,0,0,0|1,0,1]=4 3631 B14R1.1031 COC(=O)C(Cc1ccccc1)OC 34a_100138415774_100000764117 [0,2,0,0,0,0|0,0,2]=4 3632 B14R1.1031 COC(=O)C(Cc1ccccc1)SC 62a_100000764117_200000210301 [0,2,0,0,0,0|0,0,2]=4 3633 B14R1.1031 COC(=O)C(Cc1ccccc1)SC 62a_200000210301_100000764117 [0,2,0,0,0,0|0,0,2]=4 3634 B14R1.1031 COC(=O)C(Cc1ccccc1)S[13CH3] 62a_100000764117_200025704644 [0,2,0,0,0,0|0,0,2]=4 3635 B14R1.1031 COC(=O)C(Cc1ccccc1)S[13CH3] 62a_200025704644_100000764117 [0,2,0,0,0,0|0,0,2]=4 3636 B14R1.1031 COC(=O)C(Nc1ccccc1)OC 34a_100000106764_100000101307 [0,2,0,0,0,0|1,0,1]=4 3637 B14R1.1031 COC(=O)C(OC)Oc1ccccc1 34a_100000210340_100000101307 [0,2,0,0,0,0|1,0,1]=4 3638 B14R1.1031 COC(=O)C(OC)Sc1ccccc1 62a_100000101307_100000041952 [0,2,0,0,0,0|1,0,1]=4 3639 B14R1.1031 COC(=O)C(OC)Sc1ccccc1 62a_100000719477_100000101307 [0,2,0,0,0,0|1,0,1]=4 3640 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)OC 34a_100009819611_200000210301 [0,2,0,0,0,0|0,0,2]=4 3641 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)OC 7a_100009819611_200000210301 [0,2,0,0,0,0|0,0,2]=4 3642 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)O[13CH3] 34a_100009819611_200025704644 [0,2,0,0,0,0|0,0,2]=4 3643 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)O[13CH3] 7a_100009819611_200025704644 [0,2,0,0,0,0|0,0,2]=4 3644 B14R1.1031 N#CC(=Cc1ccccc1)C(=O)CF 1458a_100000162679_100015361967 [0,2,0,0,0,0|0,0,1]=3 3645 B14R1.1107 CC(C)(Cc1ccccc1)C(=O)CF 1458a_100000757416_100015361967 [0,2,0,0,0,0|0,0,2]=4 3646 B14R1.1107 CC(C)(Oc1ccccc1)C(=O)CF 1458a_100000743201_100015361967 [0,2,0,0,0,0|1,0,1]=4 3647 B14R1.1107 CCC(=O)C(C)(C)Cc1ccccc1 1458a_100000757416_100000210202 [0,2,0,0,0,0|0,0,2]=4 3648 B14R1.1107 CCC(=O)C(C)(C)Oc1ccccc1 1458a_100000743201_100000210202 [0,2,0,0,0,0|1,0,1]=4 3649 B14R1.1107 CNC(=O)C(C)(C)Cc1ccccc1 11a_106832991635_100000757416 [0,2,0,0,0,0|0,0,2]=4 3650 B14R1.1107 CNC(=O)C(C)(C)Cc1ccccc1 1626a_100102657272_100000757416 [0,2,0,0,0,0|0,0,2]=4 3651 B14R1.1107 CNC(=O)C(C)(C)Cc1ccccc1 240690a_100102657272_100000757416 [0,2,0,0,0,0|0,0,2]=4 3652 B14R1.1107 CNC(=O)C(C)(C)Cc1ccccc1 527a_100102657272_100000757416 [0,2,0,0,0,0|0,0,2]=4 3653 B14R1.1107 CNC(=O)C(C)(C)Nc1ccccc1 34a_100000106764_100000732697 [0,2,0,0,0,0|1,0,1]=4 3654 B14R1.1107 CNC(=O)C(C)(C)Oc1ccccc1 11a_106832991635_100000743201 [0,2,0,0,0,0|1,0,1]=4 3655 B14R1.1107 CNC(=O)C(C)(C)Oc1ccccc1 1626a_100102657272_100000743201 [0,2,0,0,0,0|1,0,1]=4 3656 B14R1.1107 CNC(=O)C(C)(C)Oc1ccccc1 240690a_100102657272_100000743201 [0,2,0,0,0,0|1,0,1]=4 3657 B14R1.1107 CNC(=O)C(C)(C)Oc1ccccc1 34a_100000210340_100000732697 [0,2,0,0,0,0|1,0,1]=4 3658 B14R1.1107 CNC(=O)C(C)(C)Oc1ccccc1 527a_100102657272_100000743201 [0,2,0,0,0,0|1,0,1]=4 3659 B14R1.1107 CNC(=O)C(C)(C)Sc1ccccc1 62a_100000719477_100000732697 [0,2,0,0,0,0|1,0,1]=4 3660 B14R1.1107 CNC(=O)C(C)(C)Sc1ccccc1 62a_100000732697_100000041952 [0,2,0,0,0,0|1,0,1]=4 3661 B14R1.1107 COC(=O)C(C)(C)Sc1ccccc1 62a_100000689032_100000041952 [0,2,0,0,0,0|1,0,1]=4 3662 B14R1.1107 COC(=O)C(C)(C)Sc1ccccc1 62a_100000719477_100000689032 [0,2,0,0,0,0|1,0,1]=4 3663 B14R1.1107 COC(=O)C(C)(F)Nc1ccccc1 34a_100000106764_200009867631 [0,2,0,0,0,0|1,0,1]=4 3664 B14R1.1107 COC(=O)C(C)(F)Oc1ccccc1 34a_100000210340_200009867631 [0,2,0,0,0,0|1,0,1]=4 3665 B14R1.1107 COC(=O)C(C)(F)Sc1ccccc1 62a_100000719477_200009867631 [0,2,0,0,0,0|1,0,1]=4 3666 B14R1.1107 COC(=O)C(C)(F)Sc1ccccc1 62a_200009867631_100000041952 [0,2,0,0,0,0|1,0,1]=4 3667 B14R1.75 C#Cc1cccc(c1)NC(C)C(=O)C 2230a_100000735509_100009814033 [0,2,0,0,0,0|1,0,1]=4 3668 B14R1.75 C#Cc1cccc(c1)OC(C)C(=O)C 7a_100011216014_100000179758 [0,2,0,0,0,0|1,0,1]=4 3669 B14R1.75 C=Cc1cccc(c1)OC(C)C(=O)C 7a_100011309434_100000179758 [0,2,0,0,0,0|1,0,1]=4 3670 B14R1.75 C=Cc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100011215241 [0,2,0,0,0,0|1,0,1]=4 3671 B14R1.75 C=Cc1cccc(c1)SC(C)C(=O)C 62a_100011215241_100009814033 [0,2,0,0,0,0|1,0,1]=4 3672 B14R1.75 CC(=O)C(C)Nc1cccc(c1)C#N 7a_100000210922_100000179758 [0,2,0,0,0,0|1,0,1]=4 3673 B14R1.75 CC(=O)C(C)Nc1cccc(c1)CF 2230a_100000126320_100009814033 [0,2,0,0,0,0|1,0,1]=4 3674 B14R1.75 CC(=O)C(C)Nc1cccc(c1)CF 7a_100000126320_100000179758 [0,2,0,0,0,0|1,0,1]=4 3675 B14R1.75 CC(=O)C(C)Nc1cccc(c1)CO 2230a_100000211919_100009814033 [0,2,0,0,0,0|1,0,1]=4 3676 B14R1.75 CC(=O)C(C)Oc1cccc(c1)C#N 1458a_100000230699_200000210301 [0,2,0,0,0,0|1,0,1]=4 3677 B14R1.75 CC(=O)C(C)Oc1cccc(c1)C#N 7a_100000184713_100000179758 [0,2,0,0,0,0|1,0,1]=4 3678 B14R1.75 CC(=O)C(C)Oc1cccc(c1)CBr 7a_100011660834_100000179758 [0,2,0,0,0,0|1,0,1]=4 3679 B14R1.75 CC(=O)C(C)Oc1cccc(c1)CCl 7a_100000084143_100000179758 [0,2,0,0,0,0|1,0,1]=4 3680 B14R1.75 CC(=O)C(C)Oc1cccc(c1)CO 7a_100011214949_100000179758 [0,2,0,0,0,0|1,0,1]=4 3681 B14R1.75 CC(=O)C(C)Sc1cccc(c1)C#N 62a_100009814033_100000189340 [0,2,0,0,0,0|1,0,1]=4 3682 B14R1.75 CC(=O)C(C)Sc1cccc(c1)C=O 62a_100000014684_100009814033 [0,2,0,0,0,0|1,0,1]=4 3683 B14R1.75 CC(=O)C(C)Sc1cccc(c1)C=O 62a_100009814033_100000014684 [0,2,0,0,0,0|1,0,1]=4 3684 B14R1.75 CC(=O)C(C)Sc1cccc(c1)CF 62a_100009814033_100010878472 [0,2,0,0,0,0|1,0,1]=4 3685 B14R1.75 CC(=O)C(C)Sc1cccc(c1)CF 62a_100010878472_100009814033 [0,2,0,0,0,0|1,0,1]=4 3686 B14R1.75 CC(=O)C(C)Sc1cccc(c1)CN 62a_100000106179_100009814033 [0,2,0,0,0,0|1,0,1]=4 3687 B14R1.75 CC(=O)C(C)Sc1cccc(c1)CN 62a_100009814033_100000106179 [0,2,0,0,0,0|1,0,1]=4 3688 B14R1.75 CC(=O)C(C)Sc1cccc(c1)CO 62a_100000687537_100009814033 [0,2,0,0,0,0|1,0,1]=4 3689 B14R1.75 CC(=O)C(C)Sc1cccc(c1)CO 62a_100009814033_100000687537 [0,2,0,0,0,0|1,0,1]=4 3690 B14R1.75 CC(=O)C(C)Sc1cccc(c1)NN 62a_100000217339_100009814033 [0,2,0,0,0,0|1,0,1]=4 3691 B14R1.75 CC(=O)C(C)Sc1cccc(c1)NN 62a_100009814033_100000217339 [0,2,0,0,0,0|1,0,1]=4 3692 B14R1.75 CC(=O)N(C)Cc1cccc(c1)C#N 11a_100000168042_100015343762 [0,2,0,0,0,0|1,0,1]=4 3693 B14R1.75 CC(=O)N(C)Cc1cccc(c1)C#N 1626a_100000168042_100015343762 [0,2,0,0,0,0|1,0,1]=4 3694 B14R1.75 CC(=O)N(C)Cc1cccc(c1)C#N 240690a_100000168042_100015343762 [0,2,0,0,0,0|1,0,1]=4 3695 B14R1.75 CC(=O)N(C)Cc1cccc(c1)C#N 527a_100000168042_100103153847 [0,2,0,0,0,0|1,0,1]=4 3696 B14R1.75 CC(Oc1cccc(c1)C#N)C(=O)[13CH3] 1458a_100000230699_200025704644 [0,2,0,0,0,0|1,0,1]=4 3697 B14R1.75 CCc1cccc(c1)NC(C)C(=O)C 2230a_100000211250_100009814033 [0,2,0,0,0,0|1,0,1]=4 3698 B14R1.75 CCc1cccc(c1)NC(C)C(=O)C 7a_100000211250_100000179758 [0,2,0,0,0,0|1,0,1]=4 3699 B14R1.75 CCc1cccc(c1)OC(C)C(=O)C 7a_100000211550_100000179758 [0,2,0,0,0,0|1,0,1]=4 3700 B14R1.75 CCc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100011263222 [0,2,0,0,0,0|1,0,1]=4 3701 B14R1.75 CCc1cccc(c1)SC(C)C(=O)C 62a_100011263222_100009814033 [0,2,0,0,0,0|1,0,1]=4 3702 B14R1.75 CNc1cccc(c1)OC(C)C(=O)C 7a_100000756613_100000179758 [0,2,0,0,0,0|1,0,1]=4 3703 B14R1.75 CNc1cccc(c1)SC(C)C(=O)C 62a_100000219648_100009814033 [0,2,0,0,0,0|1,0,1]=4 3704 B14R1.75 CNc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100000219648 [0,2,0,0,0,0|1,0,1]=4 3705 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 11a_100000184262_100015343762 [0,2,0,0,0,0|1,0,1]=4 3706 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 1626a_100000184262_100015343762 [0,2,0,0,0,0|1,0,1]=4 3707 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 240690a_100000184262_100015343762 [0,2,0,0,0,0|1,0,1]=4 3708 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 527a_100000184262_100103153847 [0,2,0,0,0,0|1,0,1]=4 3709 B14R1.75 COc1cccc(c1)OC(C)C(=O)C 1458a_100000216024_200000210301 [0,2,0,0,0,0|1,0,1]=4 3710 B14R1.75 COc1cccc(c1)OC(C)C(=O)C 7a_100000211255_100000179758 [0,2,0,0,0,0|1,0,1]=4 3711 B14R1.75 COc1cccc(c1)OC(C)C(=O)[13CH3] 1458a_100000216024_200025704644 [0,2,0,0,0,0|1,0,1]=4 3712 B14R1.75 COc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100000170001 [0,2,0,0,0,0|1,0,1]=4 3713 B14R1.75 CSc1cccc(c1)CN(C)C(=O)C 11a_100011934695_100015343762 [0,2,0,0,0,0|1,0,1]=4 3714 B14R1.75 CSc1cccc(c1)CN(C)C(=O)C 240690a_100011934695_100015343762 [0,2,0,0,0,0|1,0,1]=4 3715 B14R1.75 CSc1cccc(c1)CN(C)C(=O)C 527a_100011934695_100103153847 [0,2,0,0,0,0|1,0,1]=4 3716 B14R1.75 CSc1cccc(c1)NC(C)C(=O)C 2230a_100000210049_100009814033 [0,2,0,0,0,0|1,0,1]=4 3717 B14R1.75 CSc1cccc(c1)OC(C)C(=O)C 7a_100011265683_100000179758 [0,2,0,0,0,0|1,0,1]=4 3718 B14R1.75 CSc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100011215954 [0,2,0,0,0,0|1,0,1]=4 3719 B14R1.75 CSc1cccc(c1)SC(C)C(=O)C 62a_100011215954_100009814033 [0,2,0,0,0,0|1,0,1]=4 3720 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)Br 1458a_100000070787_100012349134 [0,2,0,0,0,0|0,0,1]=3 3721 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)Br 1458a_100000210664_100000179758 [0,2,0,0,0,0|0,0,1]=3 3722 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)C 1458a_100000189346_100000179758 [0,2,0,0,0,0|0,0,1]=3 3723 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)Cl 1458a_100000070787_100000184413 [0,2,0,0,0,0|0,0,1]=3 3724 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)Cl 1458a_100000210390_100000179758 [0,2,0,0,0,0|0,0,1]=3 3725 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)F 1458a_100000070787_100012356231 [0,2,0,0,0,0|0,0,1]=3 3726 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)F 1458a_100000210950_100000179758 [0,2,0,0,0,0|0,0,1]=3 3727 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)I 1458a_100000184098_100000179758 [0,2,0,0,0,0|0,0,1]=3 3728 B14R1.150 CC(=O)C(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000179758 [0,2,0,0,0,0|0,0,1]=3 3729 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)Br 2230a_100000219648_100009814033 [0,2,0,0,0,0|1,0,1]=4 3730 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)Br 269982a_100000219648_100009814033 [0,2,0,0,0,0|1,0,1]=4 3731 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)C 2230a_100000219674_100009814033 [0,2,0,0,0,0|1,0,1]=4 3732 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)C 269982a_100000219674_100009814033 [0,2,0,0,0,0|1,0,1]=4 3733 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)Cl 2230a_100000220044_100009814033 [0,2,0,0,0,0|1,0,1]=4 3734 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)Cl 269982a_100000220044_100009814033 [0,2,0,0,0,0|1,0,1]=4 3735 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)F 2230a_100020633736_100009814033 [0,2,0,0,0,0|1,0,1]=4 3736 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)F 269982a_100020633736_100009814033 [0,2,0,0,0,0|1,0,1]=4 3737 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)I 2230a_100000221217_100009814033 [0,2,0,0,0,0|1,0,1]=4 3738 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)I 269982a_100000221217_100009814033 [0,2,0,0,0,0|1,0,1]=4 3739 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)O 2230a_100000756613_100009814033 [0,2,0,0,0,0|1,0,1]=4 3740 B14R1.150 CC(=O)C(C)N(C)c1cccc(c1)O 269982a_100000756613_100009814033 [0,2,0,0,0,0|1,0,1]=4 3741 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 11a_100025717457_100015343762 [0,2,0,0,0,0|1,0,1]=4 3742 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 1626a_100025717457_100015343762 [0,2,0,0,0,0|1,0,1]=4 3743 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 240690a_100025717457_100015343762 [0,2,0,0,0,0|1,0,1]=4 3744 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)Br 527a_100025717457_100103153847 [0,2,0,0,0,0|1,0,1]=4 3745 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 11a_100000231114_100015343762 [0,2,0,0,0,0|1,0,1]=4 3746 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 1626a_100000231114_100015343762 [0,2,0,0,0,0|1,0,1]=4 3747 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 240690a_100000231114_100015343762 [0,2,0,0,0,0|1,0,1]=4 3748 B14R1.150 CC(=O)N(C)C(C)c1cccc(c1)F 527a_100000231114_100103153847 [0,2,0,0,0,0|1,0,1]=4 3749 B14R1.150 CC(C(=O)N)C(=O)c1cccc(c1)Br 1458a_100000210664_100000702099 [0,2,0,0,0,0|1,0,1]=4 3750 B14R1.150 CC(C(=O)N)C(=O)c1cccc(c1)Cl 1458a_100000210390_100000702099 [0,2,0,0,0,0|1,0,1]=4 3751 B14R1.150 CC(C(=O)N)C(=O)c1cccc(c1)F 1458a_100000210950_100000702099 [0,2,0,0,0,0|1,0,1]=4 3752 B14R1.150 CC(C(=O)N)C(=O)c1cccc(c1)I 1458a_100000184098_100000702099 [0,2,0,0,0,0|1,0,1]=4 3753 B14R1.150 CC(C(=O)N)C(=O)c1cccc(c1)O 1458a_100000183914_100000702099 [0,2,0,0,0,0|1,0,1]=4 3754 B14R1.150 Cc1cccc(c1)C(=O)C(C)C(=O)N 1458a_100000189346_100000702099 [0,2,0,0,0,0|1,0,1]=4 3755 B14R1.153 CC(=O)C(=O)Nc1cccc(c1C)C 1458a_200011297339_200000210301 [0,2,0,0,0,0|2,0,0]=4 3756 B14R1.153 CC(=O)C(C)Nc1cccc(c1Br)O 7a_100012183704_100000179758 [0,2,0,0,0,0|1,0,1]=4 3757 B14R1.153 CC(=O)C(C)Nc1cccc(c1C)C 2230a_100000210026_100009814033 [0,2,0,0,0,0|1,0,1]=4 3758 B14R1.153 CC(=O)C(C)Nc1cccc(c1C)C 7a_100000210026_100000179758 [0,2,0,0,0,0|1,0,1]=4 3759 B14R1.153 CC(=O)C(C)Nc1cccc(c1C)Cl 2230a_100000210441_100009814033 [0,2,0,0,0,0|1,0,1]=4 3760 B14R1.153 CC(=O)C(C)Nc1cccc(c1C)Cl 7a_100000210441_100000179758 [0,2,0,0,0,0|1,0,1]=4 3761 B14R1.153 CC(=O)C(C)Nc1cccc(c1C)F 7a_100000745574_100000179758 [0,2,0,0,0,0|1,0,1]=4 3762 B14R1.153 CC(=O)C(C)Nc1cccc(c1C)O 7a_100011216573_100000179758 [0,2,0,0,0,0|1,0,1]=4 3763 B14R1.153 CC(=O)C(C)Nc1cccc(c1Cl)C 7a_100000765562_100000179758 [0,2,0,0,0,0|1,0,1]=4 3764 B14R1.153 CC(=O)C(C)Nc1cccc(c1Cl)O 7a_100012002038_100000179758 [0,2,0,0,0,0|1,0,1]=4 3765 B14R1.153 CC(=O)C(C)Nc1cccc(c1F)Br 2230a_100011935091_100009814033 [0,2,0,0,0,0|1,0,1]=4 3766 B14R1.153 CC(=O)C(C)Nc1cccc(c1F)C 2230a_100000697159_100009814033 [0,2,0,0,0,0|1,0,1]=4 3767 B14R1.153 CC(=O)C(C)Nc1cccc(c1F)C 7a_100000697159_100000179758 [0,2,0,0,0,0|1,0,1]=4 3768 B14R1.153 CC(=O)C(C)Nc1cccc(c1F)Cl 2230a_100000199060_100009814033 [0,2,0,0,0,0|1,0,1]=4 3769 B14R1.153 CC(=O)C(C)Oc1cccc(c1Br)Br 7a_100010187966_100000179758 [0,2,0,0,0,0|1,0,1]=4 3770 B14R1.153 CC(=O)C(C)Oc1cccc(c1Br)C 7a_100000686692_100000179758 [0,2,0,0,0,0|1,0,1]=4 3771 B14R1.153 CC(=O)C(C)Oc1cccc(c1Br)Cl 7a_100012348804_100000179758 [0,2,0,0,0,0|1,0,1]=4 3772 B14R1.153 CC(=O)C(C)Oc1cccc(c1Br)F 7a_100009820682_100000179758 [0,2,0,0,0,0|1,0,1]=4 3773 B14R1.153 CC(=O)C(C)Oc1cccc(c1Br)I 7a_100010187914_100000179758 [0,2,0,0,0,0|1,0,1]=4 3774 B14R1.153 CC(=O)C(C)Oc1cccc(c1Br)N 7a_100012183704_100000179758 [0,2,0,0,0,0|1,0,1]=4 3775 B14R1.153 CC(=O)C(C)Oc1cccc(c1C)Br 7a_100012002258_100000179758 [0,2,0,0,0,0|1,0,1]=4 3776 B14R1.153 CC(=O)C(C)Oc1cccc(c1C)C 1458a_100000246044_200000210301 [0,2,0,0,0,0|1,0,1]=4 3777 B14R1.153 CC(=O)C(C)Oc1cccc(c1C)C 7a_100000185855_100000179758 [0,2,0,0,0,0|1,0,1]=4 3778 B14R1.153 CC(=O)C(C)Oc1cccc(c1C)Cl 7a_100011265684_100000179758 [0,2,0,0,0,0|1,0,1]=4 3779 B14R1.153 CC(=O)C(C)Oc1cccc(c1C)F 7a_100011217231_100000179758 [0,2,0,0,0,0|1,0,1]=4 3780 B14R1.153 CC(=O)C(C)Oc1cccc(c1C)N 7a_100011216573_100000179758 [0,2,0,0,0,0|1,0,1]=4 3781 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)Br 7a_100010187913_100000179758 [0,2,0,0,0,0|1,0,1]=4 3782 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)C 7a_100000695629_100000179758 [0,2,0,0,0,0|1,0,1]=4 3783 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)Cl 1458a_100000191260_200000210301 [0,2,0,0,0,0|1,0,1]=4 3784 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)Cl 7a_100000211076_100000179758 [0,2,0,0,0,0|1,0,1]=4 3785 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)F 7a_100000087408_100000179758 [0,2,0,0,0,0|1,0,1]=4 3786 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)I 7a_100000049636_100000179758 [0,2,0,0,0,0|1,0,1]=4 3787 B14R1.153 CC(=O)C(C)Oc1cccc(c1Cl)N 7a_100012002038_100000179758 [0,2,0,0,0,0|1,0,1]=4 3788 B14R1.153 CC(=O)C(C)Oc1cccc(c1F)Br 7a_100009817021_100000179758 [0,2,0,0,0,0|1,0,1]=4 3789 B14R1.153 CC(=O)C(C)Oc1cccc(c1F)C 7a_100000751311_100000179758 [0,2,0,0,0,0|1,0,1]=4 3790 B14R1.153 CC(=O)C(C)Oc1cccc(c1F)Cl 7a_100000687438_100000179758 [0,2,0,0,0,0|1,0,1]=4 3791 B14R1.153 CC(=O)C(C)Oc1cccc(c1F)F 7a_100000751161_100000179758 [0,2,0,0,0,0|1,0,1]=4 3792 B14R1.153 CC(=O)C(C)Oc1cccc(c1I)Br 7a_100010187912_100000179758 [0,2,0,0,0,0|1,0,1]=4 3793 B14R1.153 CC(=O)C(C)Oc1cccc(c1I)C 7a_100010083724_100000179758 [0,2,0,0,0,0|1,0,1]=4 3794 B14R1.153 CC(=O)C(C)Oc1cccc(c1I)Cl 7a_100000050174_100000179758 [0,2,0,0,0,0|1,0,1]=4 3795 B14R1.153 CC(=O)C(C)Oc1cccc(c1I)F 7a_100000690913_100000179758 [0,2,0,0,0,0|1,0,1]=4 3796 B14R1.153 CC(=O)C(C)Oc1cccc(c1N)Br 7a_100011934926_100000179758 [0,2,0,0,0,0|1,0,1]=4 3797 B14R1.153 CC(=O)C(C)Oc1cccc(c1N)C 7a_100000743429_100000179758 [0,2,0,0,0,0|1,0,1]=4 3798 B14R1.153 CC(=O)C(C)Oc1cccc(c1N)Cl 7a_100012022510_100000179758 [0,2,0,0,0,0|1,0,1]=4 3799 B14R1.153 CC(=O)C(C)Oc1cccc(c1N)F 7a_100020591140_100000179758 [0,2,0,0,0,0|1,0,1]=4 3800 B14R1.153 CC(=O)C(C)Oc1cccc(c1N)I 7a_200000049512_100000179758 [0,2,0,0,0,0|1,0,1]=4 3801 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)Br 62a_100009814033_100010175083 [0,2,0,0,0,0|1,0,1]=4 3802 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)Br 62a_100010175083_100009814033 [0,2,0,0,0,0|1,0,1]=4 3803 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)C 62a_100009814033_100012362457 [0,2,0,0,0,0|1,0,1]=4 3804 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)C 62a_100012362457_100009814033 [0,2,0,0,0,0|1,0,1]=4 3805 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)Cl 62a_100009814033_100014021842 [0,2,0,0,0,0|1,0,1]=4 3806 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)Cl 62a_100014021842_100009814033 [0,2,0,0,0,0|1,0,1]=4 3807 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)F 62a_100009814033_100010202630 [0,2,0,0,0,0|1,0,1]=4 3808 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)F 62a_100010202630_100009814033 [0,2,0,0,0,0|1,0,1]=4 3809 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)O 62a_100009814033_100010187914 [0,2,0,0,0,0|1,0,1]=4 3810 B14R1.153 CC(=O)C(C)Sc1cccc(c1Br)O 62a_100010187914_100009814033 [0,2,0,0,0,0|1,0,1]=4 3811 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)Br 62a_100009814033_100012353703 [0,2,0,0,0,0|1,0,1]=4 3812 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)Br 62a_100012353703_100009814033 [0,2,0,0,0,0|1,0,1]=4 3813 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)C 62a_100009814033_100011214922 [0,2,0,0,0,0|1,0,1]=4 3814 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)C 62a_100011214922_100009814033 [0,2,0,0,0,0|1,0,1]=4 3815 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)Cl 62a_100000726075_100009814033 [0,2,0,0,0,0|1,0,1]=4 3816 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)Cl 62a_100009814033_100000726075 [0,2,0,0,0,0|1,0,1]=4 3817 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)F 62a_100009814033_100011216893 [0,2,0,0,0,0|1,0,1]=4 3818 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)F 62a_100011216893_100009814033 [0,2,0,0,0,0|1,0,1]=4 3819 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)N 62a_100000761887_100009814033 [0,2,0,0,0,0|1,0,1]=4 3820 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)N 62a_100009814033_100000761887 [0,2,0,0,0,0|1,0,1]=4 3821 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)O 62a_100009814033_100012002258 [0,2,0,0,0,0|1,0,1]=4 3822 B14R1.153 CC(=O)C(C)Sc1cccc(c1C)O 62a_100012002258_100009814033 [0,2,0,0,0,0|1,0,1]=4 3823 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)Br 62a_100009814033_100010142854 [0,2,0,0,0,0|1,0,1]=4 3824 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)Br 62a_100010142854_100009814033 [0,2,0,0,0,0|1,0,1]=4 3825 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)C 62a_100009814033_200012352035 [0,2,0,0,0,0|1,0,1]=4 3826 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)C 62a_200012352035_100009814033 [0,2,0,0,0,0|1,0,1]=4 3827 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)Cl 62a_100009814033_100011215384 [0,2,0,0,0,0|1,0,1]=4 3828 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)Cl 62a_100011215384_100009814033 [0,2,0,0,0,0|1,0,1]=4 3829 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)F 62a_100009814033_200010234923 [0,2,0,0,0,0|1,0,1]=4 3830 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)F 62a_200010234923_100009814033 [0,2,0,0,0,0|1,0,1]=4 3831 B14R1.153 CC(=O)C(C)Sc1cccc(c1Cl)O 62a_100009814033_100000049636 [0,2,0,0,0,0|1,0,1]=4 3832 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)Br 62a_100000702267_100009814033 [0,2,0,0,0,0|1,0,1]=4 3833 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)Br 62a_100009814033_100000702267 [0,2,0,0,0,0|1,0,1]=4 3834 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)C 62a_100000717567_100009814033 [0,2,0,0,0,0|1,0,1]=4 3835 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)C 62a_100009814033_100000717567 [0,2,0,0,0,0|1,0,1]=4 3836 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)Cl 62a_100009814033_100011217346 [0,2,0,0,0,0|1,0,1]=4 3837 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)Cl 62a_100011217346_100009814033 [0,2,0,0,0,0|1,0,1]=4 3838 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)F 62a_100000694657_100009814033 [0,2,0,0,0,0|1,0,1]=4 3839 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)F 62a_100009814033_100000694657 [0,2,0,0,0,0|1,0,1]=4 3840 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)N 62a_100009814033_100011935091 [0,2,0,0,0,0|1,0,1]=4 3841 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)N 62a_100011935091_100009814033 [0,2,0,0,0,0|1,0,1]=4 3842 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)O 62a_100009814033_100009817021 [0,2,0,0,0,0|1,0,1]=4 3843 B14R1.153 CC(=O)C(C)Sc1cccc(c1F)O 62a_100009817021_100009814033 [0,2,0,0,0,0|1,0,1]=4 3844 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)Br 62a_100009814033_100010146558 [0,2,0,0,0,0|1,0,1]=4 3845 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)Br 62a_100010146558_100009814033 [0,2,0,0,0,0|1,0,1]=4 3846 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)C 62a_100009814033_100011834072 [0,2,0,0,0,0|1,0,1]=4 3847 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)C 62a_100011834072_100009814033 [0,2,0,0,0,0|1,0,1]=4 3848 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)Cl 62a_100009814033_100010190421 [0,2,0,0,0,0|1,0,1]=4 3849 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)Cl 62a_100010190421_100009814033 [0,2,0,0,0,0|1,0,1]=4 3850 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)F 62a_100000042321_100009814033 [0,2,0,0,0,0|1,0,1]=4 3851 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)F 62a_100009814033_100000042321 [0,2,0,0,0,0|1,0,1]=4 3852 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)N 62a_100015191791_100009814033 [0,2,0,0,0,0|1,0,1]=4 3853 B14R1.153 CC(=O)C(C)Sc1cccc(c1N)O 62a_100009814033_100011934926 [0,2,0,0,0,0|1,0,1]=4 3854 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)Br 62a_100009814033_100010084509 [0,2,0,0,0,0|1,0,1]=4 3855 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)Br 62a_100010084509_100009814033 [0,2,0,0,0,0|1,0,1]=4 3856 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)C 62a_100009814033_100009817157 [0,2,0,0,0,0|1,0,1]=4 3857 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)C 62a_100009817157_100009814033 [0,2,0,0,0,0|1,0,1]=4 3858 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)Cl 62a_100009814033_100010202889 [0,2,0,0,0,0|1,0,1]=4 3859 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)Cl 62a_100010202889_100009814033 [0,2,0,0,0,0|1,0,1]=4 3860 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)F 62a_100009813666_100009814033 [0,2,0,0,0,0|1,0,1]=4 3861 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)F 62a_100009814033_100009813666 [0,2,0,0,0,0|1,0,1]=4 3862 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)N 62a_100009814033_100010084371 [0,2,0,0,0,0|1,0,1]=4 3863 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)N 62a_100011934915_100009814033 [0,2,0,0,0,0|1,0,1]=4 3864 B14R1.153 CC(=O)C(C)Sc1cccc(c1O)O 62a_100009814033_100009815950 [0,2,0,0,0,0|1,0,1]=4 3865 B14R1.153 CC(=O)N(C)Cc1cccc(c1C)C 1626a_100000207598_100015343762 [0,2,0,0,0,0|1,0,1]=4 3866 B14R1.153 CC(=O)N(C)Cc1cccc(c1C)C 240690a_100000207598_100015343762 [0,2,0,0,0,0|1,0,1]=4 3867 B14R1.153 CC(=O)N(C)Cc1cccc(c1C)C 527a_100000207598_100103153847 [0,2,0,0,0,0|1,0,1]=4 3868 B14R1.153 CC(=O)N(C)Cc1cccc(c1Cl)Cl 11a_100000690605_100015343762 [0,2,0,0,0,0|1,0,1]=4 3869 B14R1.153 CC(=O)N(C)Cc1cccc(c1Cl)Cl 1626a_100000690605_100015343762 [0,2,0,0,0,0|1,0,1]=4 3870 B14R1.153 CC(=O)N(C)Cc1cccc(c1Cl)Cl 240690a_100000690605_100015343762 [0,2,0,0,0,0|1,0,1]=4 3871 B14R1.153 CC(=O)N(C)Cc1cccc(c1Cl)Cl 527a_100000690605_100103153847 [0,2,0,0,0,0|1,0,1]=4 3872 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)Br 11a_114873767014_100015343762 [0,2,0,0,0,0|1,0,1]=4 3873 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)Br 1626a_114873767014_100015343762 [0,2,0,0,0,0|1,0,1]=4 3874 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)Br 240690a_114873767014_100015343762 [0,2,0,0,0,0|1,0,1]=4 3875 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)Br 527a_114873767014_100103153847 [0,2,0,0,0,0|1,0,1]=4 3876 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)F 11a_102515433064_100015343762 [0,2,0,0,0,0|1,0,1]=4 3877 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)F 1626a_102515433064_100015343762 [0,2,0,0,0,0|1,0,1]=4 3878 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)F 240690a_102515433064_100015343762 [0,2,0,0,0,0|1,0,1]=4 3879 B14R1.153 CC(=O)N(C)Cc1cccc(c1F)F 527a_102515433064_100103153847 [0,2,0,0,0,0|1,0,1]=4 3880 B14R1.153 CC(Oc1cccc(c1Cl)Cl)C(=O)[13CH3] 1458a_100000191260_200025704644 [0,2,0,0,0,0|1,0,1]=4 3881 B14R1.153 Cc1cccc(c1C)NC(=O)C(=O)[13CH3] 1458a_200011297339_200025704644 [0,2,0,0,0,0|2,0,0]=4 3882 B14R1.153 Cc1cccc(c1C)OC(C)C(=O)[13CH3] 1458a_100000246044_200025704644 [0,2,0,0,0,0|1,0,1]=4 3883 B14R1.542 CC(=O)/C(=C/c1cccc(c1)O)/C#N 1458a_200020587497_200000210301 [0,2,0,0,0,0|0,0,1]=3 3884 B14R1.542 CC(=O)C(Cc1cccc(c1)Cl)S[13CH3] 62a_200009990483_200025704644 [0,2,0,0,0,0|0,0,2]=4 3885 B14R1.542 CC(=O)C(Cc1cccc(c1)Cl)S[13CH3] 62a_200025704644_200009990483 [0,2,0,0,0,0|0,0,2]=4 3886 B14R1.542 CCN(Cc1cccc(c1)Br)C(=O)C 11a_100000187426_100015343762 [0,2,0,0,0,0|1,0,1]=4 3887 B14R1.542 CCN(Cc1cccc(c1)Br)C(=O)C 1626a_100000187426_100015343762 [0,2,0,0,0,0|1,0,1]=4 3888 B14R1.542 CCN(Cc1cccc(c1)Br)C(=O)C 240690a_100000187426_100015343762 [0,2,0,0,0,0|1,0,1]=4 3889 B14R1.542 CCN(Cc1cccc(c1)Br)C(=O)C 527a_100000187426_100103153847 [0,2,0,0,0,0|1,0,1]=4 3890 B14R1.542 CCN(Cc1cccc(c1)C)C(=O)C 11a_102516607250_100015343762 [0,2,0,0,0,0|1,0,1]=4 3891 B14R1.542 CCN(Cc1cccc(c1)C)C(=O)C 1626a_102516607250_100015343762 [0,2,0,0,0,0|1,0,1]=4 3892 B14R1.542 CCN(Cc1cccc(c1)C)C(=O)C 240690a_102516607250_100015343762 [0,2,0,0,0,0|1,0,1]=4 3893 B14R1.542 CCN(Cc1cccc(c1)C)C(=O)C 527a_102516607250_100103153847 [0,2,0,0,0,0|1,0,1]=4 3894 B14R1.542 CCN(Cc1cccc(c1)Cl)C(=O)C 11a_100000201194_100015343762 [0,2,0,0,0,0|1,0,1]=4 3895 B14R1.542 CCN(Cc1cccc(c1)Cl)C(=O)C 1626a_100000201194_100015343762 [0,2,0,0,0,0|1,0,1]=4 3896 B14R1.542 CCN(Cc1cccc(c1)Cl)C(=O)C 240690a_100000201194_100015343762 [0,2,0,0,0,0|1,0,1]=4 3897 B14R1.542 CCN(Cc1cccc(c1)Cl)C(=O)C 527a_100000201194_100103153847 [0,2,0,0,0,0|1,0,1]=4 3898 B14R1.542 CCN(Cc1cccc(c1)F)C(=O)C 11a_100000195558_100015343762 [0,2,0,0,0,0|1,0,1]=4 3899 B14R1.542 CCN(Cc1cccc(c1)F)C(=O)C 1626a_100000195558_100015343762 [0,2,0,0,0,0|1,0,1]=4 3900 B14R1.542 CCN(Cc1cccc(c1)F)C(=O)C 240690a_100000195558_100015343762 [0,2,0,0,0,0|1,0,1]=4 3901 B14R1.542 CCN(Cc1cccc(c1)F)C(=O)C 527a_100000195558_100103153847 [0,2,0,0,0,0|1,0,1]=4 3902 B14R1.542 CCN(Cc1cccc(c1)O)C(=O)C 1626a_100000201218_100015343762 [0,2,0,0,0,0|1,0,1]=4 3903 B14R1.542 CCN(Cc1cccc(c1)O)C(=O)C 240690a_100000201218_100015343762 [0,2,0,0,0,0|1,0,1]=4 3904 B14R1.542 CCN(Cc1cccc(c1)O)C(=O)C 527a_100000201218_100103153847 [0,2,0,0,0,0|1,0,1]=4 3905 B14R1.542 CNC(Cc1cccc(c1)Cl)C(=O)C 34a_100102657272_200009990483 [0,2,0,0,0,0|0,0,2]=4 3906 B14R1.542 CNC(Cc1cccc(c1)Cl)C(=O)C 7a_106832991635_200009990483 [0,2,0,0,0,0|0,0,2]=4 3907 B14R1.542 COC(Cc1cccc(c1)Cl)C(=O)C 34a_100138415774_200009990483 [0,2,0,0,0,0|0,0,2]=4 3908 B14R1.542 CSC(Cc1cccc(c1)Cl)C(=O)C 62a_200000210301_200009990483 [0,2,0,0,0,0|0,0,2]=4 3909 B14R1.542 CSC(Cc1cccc(c1)Cl)C(=O)C 62a_200009990483_200000210301 [0,2,0,0,0,0|0,0,2]=4 3910 B14R1.542 [13CH3]C(=O)/C(=C/c1cccc(c1)O)/C#N 1458a_200020587497_200025704644 [0,2,0,0,0,0|0,0,1]=3 3911 B14R1.4257 CC(=O)C(=O)Nc1cc(cc(c1)C)C 1458a_200011297318_200000210301 [0,2,0,0,0,0|2,0,0]=4 3912 B14R1.4257 CC(=O)C(=O)Nc1cc(cc(c1)F)F 1458a_200011297330_200000210301 [0,2,0,0,0,0|2,0,0]=4 3913 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Br)Br 7a_100012047176_100000179758 [0,2,0,0,0,0|1,0,1]=4 3914 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Br)C 7a_100000695972_100000179758 [0,2,0,0,0,0|1,0,1]=4 3915 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Br)Cl 7a_100011934539_100000179758 [0,2,0,0,0,0|1,0,1]=4 3916 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Br)F 7a_100000705686_100000179758 [0,2,0,0,0,0|1,0,1]=4 3917 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)C)C 2230a_100000210930_100009814033 [0,2,0,0,0,0|1,0,1]=4 3918 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)C)C 7a_100000210930_100000179758 [0,2,0,0,0,0|1,0,1]=4 3919 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Cl)C 2230a_100012022512_100009814033 [0,2,0,0,0,0|1,0,1]=4 3920 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Cl)C 7a_100012022512_100000179758 [0,2,0,0,0,0|1,0,1]=4 3921 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Cl)Cl 7a_100000210456_100000179758 [0,2,0,0,0,0|1,0,1]=4 3922 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Cl)F 7a_100000686136_100000179758 [0,2,0,0,0,0|1,0,1]=4 3923 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)Cl)O 7a_100000123917_100000179758 [0,2,0,0,0,0|1,0,1]=4 3924 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)F)C 2230a_100000742734_100009814033 [0,2,0,0,0,0|1,0,1]=4 3925 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)F)C 7a_100000742734_100000179758 [0,2,0,0,0,0|1,0,1]=4 3926 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)F)F 7a_100000233717_100000179758 [0,2,0,0,0,0|1,0,1]=4 3927 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)I)Br 7a_100009814763_100000179758 [0,2,0,0,0,0|1,0,1]=4 3928 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)I)Cl 7a_100010147676_100000179758 [0,2,0,0,0,0|1,0,1]=4 3929 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)I)F 7a_100011356972_100000179758 [0,2,0,0,0,0|1,0,1]=4 3930 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)I)I 7a_200000696836_100000179758 [0,2,0,0,0,0|1,0,1]=4 3931 B14R1.4257 CC(=O)C(C)Nc1cc(cc(c1)O)C 7a_100011995906_100000179758 [0,2,0,0,0,0|1,0,1]=4 3932 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Br)Br 7a_100010167048_100000179758 [0,2,0,0,0,0|1,0,1]=4 3933 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Br)C 7a_100011999630_100000179758 [0,2,0,0,0,0|1,0,1]=4 3934 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Br)Cl 7a_100010185897_100000179758 [0,2,0,0,0,0|1,0,1]=4 3935 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Br)F 7a_100000688818_100000179758 [0,2,0,0,0,0|1,0,1]=4 3936 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)C)C 7a_100000210933_100000179758 [0,2,0,0,0,0|1,0,1]=4 3937 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Cl)C 7a_100000087485_100000179758 [0,2,0,0,0,0|1,0,1]=4 3938 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Cl)Cl 1458a_100000750361_200000210301 [0,2,0,0,0,0|1,0,1]=4 3939 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Cl)Cl 7a_100000181315_100000179758 [0,2,0,0,0,0|1,0,1]=4 3940 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Cl)F 7a_100011219751_100000179758 [0,2,0,0,0,0|1,0,1]=4 3941 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)Cl)N 7a_100000123917_100000179758 [0,2,0,0,0,0|1,0,1]=4 3942 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)F)C 7a_100011830401_100000179758 [0,2,0,0,0,0|1,0,1]=4 3943 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)F)F 1458a_100011749273_200000210301 [0,2,0,0,0,0|1,0,1]=4 3944 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)F)F 7a_100000747503_100000179758 [0,2,0,0,0,0|1,0,1]=4 3945 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)I)Br 7a_100010068917_100000179758 [0,2,0,0,0,0|1,0,1]=4 3946 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)I)Cl 7a_100010068924_100000179758 [0,2,0,0,0,0|1,0,1]=4 3947 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)I)F 7a_100000717995_100000179758 [0,2,0,0,0,0|1,0,1]=4 3948 B14R1.4257 CC(=O)C(C)Oc1cc(cc(c1)N)C 7a_100011995906_100000179758 [0,2,0,0,0,0|1,0,1]=4 3949 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)Br 62a_100009814033_100009814770 [0,2,0,0,0,0|1,0,1]=4 3950 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)Br 62a_100009814770_100009814033 [0,2,0,0,0,0|1,0,1]=4 3951 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)Cl 62a_100009814033_100009814755 [0,2,0,0,0,0|1,0,1]=4 3952 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)Cl 62a_100009814755_100009814033 [0,2,0,0,0,0|1,0,1]=4 3953 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)F 62a_100009814033_100009814764 [0,2,0,0,0,0|1,0,1]=4 3954 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)F 62a_100009814764_100009814033 [0,2,0,0,0,0|1,0,1]=4 3955 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)N 62a_100009814033_100009814763 [0,2,0,0,0,0|1,0,1]=4 3956 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)N 62a_100009814763_100009814033 [0,2,0,0,0,0|1,0,1]=4 3957 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)O 62a_100009814033_100010068917 [0,2,0,0,0,0|1,0,1]=4 3958 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Br)O 62a_100010068917_100009814033 [0,2,0,0,0,0|1,0,1]=4 3959 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)C)C 62a_100009814033_100011215608 [0,2,0,0,0,0|1,0,1]=4 3960 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)C)C 62a_100011215608_100009814033 [0,2,0,0,0,0|1,0,1]=4 3961 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)C 62a_100009814033_100010172791 [0,2,0,0,0,0|1,0,1]=4 3962 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)C 62a_100010172791_100009814033 [0,2,0,0,0,0|1,0,1]=4 3963 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)Cl 62a_100000747138_100009814033 [0,2,0,0,0,0|1,0,1]=4 3964 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)Cl 62a_100009814033_100000747138 [0,2,0,0,0,0|1,0,1]=4 3965 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)F 62a_100009814033_100013859453 [0,2,0,0,0,0|1,0,1]=4 3966 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)F 62a_100013859453_100009814033 [0,2,0,0,0,0|1,0,1]=4 3967 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)N 62a_100009814033_100010147676 [0,2,0,0,0,0|1,0,1]=4 3968 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)N 62a_100010147676_100009814033 [0,2,0,0,0,0|1,0,1]=4 3969 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)O 62a_100009814033_100010068924 [0,2,0,0,0,0|1,0,1]=4 3970 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)Cl)O 62a_100010068924_100009814033 [0,2,0,0,0,0|1,0,1]=4 3971 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)C 62a_100009814033_100011356977 [0,2,0,0,0,0|1,0,1]=4 3972 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)C 62a_100011356977_100009814033 [0,2,0,0,0,0|1,0,1]=4 3973 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)F 62a_100000233788_100009814033 [0,2,0,0,0,0|1,0,1]=4 3974 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)F 62a_100009814033_100000233788 [0,2,0,0,0,0|1,0,1]=4 3975 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)N 62a_100009814033_100011356972 [0,2,0,0,0,0|1,0,1]=4 3976 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)N 62a_100011356972_100009814033 [0,2,0,0,0,0|1,0,1]=4 3977 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)O 62a_100000688818_100009814033 [0,2,0,0,0,0|1,0,1]=4 3978 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)F)O 62a_100009814033_100000688818 [0,2,0,0,0,0|1,0,1]=4 3979 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)N)C 62a_100000695972_100009814033 [0,2,0,0,0,0|1,0,1]=4 3980 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)N)C 62a_100009814033_100000695972 [0,2,0,0,0,0|1,0,1]=4 3981 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)N)N 62a_100009814033_100011999608 [0,2,0,0,0,0|1,0,1]=4 3982 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)N)N 62a_100011999608_100009814033 [0,2,0,0,0,0|1,0,1]=4 3983 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)O)C 62a_100009814033_100011999630 [0,2,0,0,0,0|1,0,1]=4 3984 B14R1.4257 CC(=O)C(C)Sc1cc(cc(c1)O)O 62a_100009814033_100009868816 [0,2,0,0,0,0|1,0,1]=4 3985 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 11a_100016988021_100015343762 [0,2,0,0,0,0|1,0,1]=4 3986 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 1626a_100016988021_100015343762 [0,2,0,0,0,0|1,0,1]=4 3987 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 240690a_100016988021_100015343762 [0,2,0,0,0,0|1,0,1]=4 3988 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)Cl)Cl 527a_100016988021_100103153847 [0,2,0,0,0,0|1,0,1]=4 3989 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)F)F 11a_100000720221_100015343762 [0,2,0,0,0,0|1,0,1]=4 3990 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)F)F 1626a_100000720221_100015343762 [0,2,0,0,0,0|1,0,1]=4 3991 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)F)F 240690a_100000720221_100015343762 [0,2,0,0,0,0|1,0,1]=4 3992 B14R1.4257 CC(=O)N(C)Cc1cc(cc(c1)F)F 527a_100000720221_100103153847 [0,2,0,0,0,0|1,0,1]=4 3993 B14R1.4257 CC(Oc1cc(cc(c1)Cl)Cl)C(=O)[13CH3] 1458a_100000750361_200025704644 [0,2,0,0,0,0|1,0,1]=4 3994 B14R1.4257 CC(Oc1cc(cc(c1)F)F)C(=O)[13CH3] 1458a_100011749273_200025704644 [0,2,0,0,0,0|1,0,1]=4 3995 B14R1.4257 Cc1cc(cc(c1)NC(=O)C(=O)[13CH3])C 1458a_200011297318_200025704644 [0,2,0,0,0,0|2,0,0]=4 3996 B14R1.4257 [13CH3]C(=O)C(=O)Nc1cc(cc(c1)F)F 1458a_200011297330_200025704644 [0,2,0,0,0,0|2,0,0]=4 3997 B14R1.4404 CC(=O)C(C)(C)Cc1cccc(c1)Br 1458a_200011736070_200000210301 [0,2,0,0,0,0|0,0,2]=4 3998 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)Br 7a_100000210342_100000075568 [0,2,0,0,0,0|1,0,1]=4 3999 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)C 1458a_200015186090_200000210301 [0,2,0,0,0,0|1,0,1]=4 4000 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)C 7a_100000210337_100000075568 [0,2,0,0,0,0|1,0,1]=4 4001 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)Cl 1458a_100000755146_200000210301 [0,2,0,0,0,0|1,0,1]=4 4002 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)Cl 7a_100000210295_100000075568 [0,2,0,0,0,0|1,0,1]=4 4003 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)F 7a_100000210426_100000075568 [0,2,0,0,0,0|1,0,1]=4 4004 B14R1.4404 CC(=O)C(C)(C)Oc1cccc(c1)I 7a_100000211634_100000075568 [0,2,0,0,0,0|1,0,1]=4 4005 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)Br 62a_100000075568_100000691529 [0,2,0,0,0,0|1,0,1]=4 4006 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)Br 62a_100000691529_100000075568 [0,2,0,0,0,0|1,0,1]=4 4007 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)C 62a_100000075568_100011215228 [0,2,0,0,0,0|1,0,1]=4 4008 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)C 62a_100011215228_100000075568 [0,2,0,0,0,0|1,0,1]=4 4009 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)Cl 62a_100000075568_100000699651 [0,2,0,0,0,0|1,0,1]=4 4010 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)Cl 62a_100000699651_100000075568 [0,2,0,0,0,0|1,0,1]=4 4011 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)F 62a_100000075568_100000685547 [0,2,0,0,0,0|1,0,1]=4 4012 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)F 62a_100000685547_100000075568 [0,2,0,0,0,0|1,0,1]=4 4013 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)N 62a_100000075568_100000210019 [0,2,0,0,0,0|1,0,1]=4 4014 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)N 62a_100000210019_100000075568 [0,2,0,0,0,0|1,0,1]=4 4015 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)O 62a_100000075568_100000211634 [0,2,0,0,0,0|1,0,1]=4 4016 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)[S] 62a_100000075568_114929384022 [0,2,0,0,0,0|1,0,1]=4 4017 B14R1.4404 CC(=O)C(C)(C)Sc1cccc(c1)[S] 62a_114929384022_100000075568 [0,2,0,0,0,0|1,0,1]=4 4018 B14R1.4404 CC(C)(Cc1cccc(c1)Br)C(=O)[13CH3] 1458a_200011736070_200025704644 [0,2,0,0,0,0|0,0,2]=4 4019 B14R1.4404 CC(C)(Oc1cccc(c1)Cl)C(=O)[13CH3] 1458a_100000755146_200025704644 [0,2,0,0,0,0|1,0,1]=4 4020 B14R1.4404 Cc1cccc(c1)OC(C)(C)C(=O)[13CH3] 1458a_200015186090_200025704644 [0,2,0,0,0,0|1,0,1]=4 4021 B14R1.4474 CC(=O)C(C)Nc1cc(ccc1C)Br 7a_100000741167_100000179758 [0,2,0,0,0,0|1,0,1]=4 4022 B14R1.4474 CC(=O)C(C)Nc1cc(ccc1C)C 2230a_100000185781_100009814033 [0,2,0,0,0,0|1,0,1]=4 4023 B14R1.4474 CC(=O)C(C)Nc1cc(ccc1C)C 7a_100000185781_100000179758 [0,2,0,0,0,0|1,0,1]=4 4024 B14R1.4474 CC(=O)C(C)Nc1cc(ccc1C)Cl 7a_100000211374_100000179758 [0,2,0,0,0,0|1,0,1]=4 4025 B14R1.4474 CC(=O)C(C)Nc1cc(ccc1C)F 7a_100000211107_100000179758 [0,2,0,0,0,0|1,0,1]=4 4026 B14R1.4474 CC(=O)C(C)Nc1cc(ccc1C)I 7a_100000761890_100000179758 [0,2,0,0,0,0|1,0,1]=4 4027 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Br)Br 7a_100011220040_100000179758 [0,2,0,0,0,0|1,0,1]=4 4028 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Br)C 7a_100012002257_100000179758 [0,2,0,0,0,0|1,0,1]=4 4029 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Br)Cl 7a_100012339455_100000179758 [0,2,0,0,0,0|1,0,1]=4 4030 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Br)F 7a_100000690578_100000179758 [0,2,0,0,0,0|1,0,1]=4 4031 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Br)I 7a_100012356990_100000179758 [0,2,0,0,0,0|1,0,1]=4 4032 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1C)Br 7a_100000685420_100000179758 [0,2,0,0,0,0|1,0,1]=4 4033 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1C)C 7a_100000210931_100000179758 [0,2,0,0,0,0|1,0,1]=4 4034 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1C)Cl 7a_100000756515_100000179758 [0,2,0,0,0,0|1,0,1]=4 4035 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1C)F 7a_100000690566_100000179758 [0,2,0,0,0,0|1,0,1]=4 4036 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1C)I 7a_100000766334_100000179758 [0,2,0,0,0,0|1,0,1]=4 4037 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1C)N 7a_100000759471_100000179758 [0,2,0,0,0,0|1,0,1]=4 4038 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)Br 7a_100000738945_100000179758 [0,2,0,0,0,0|1,0,1]=4 4039 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)C 1458a_100000246039_200000210301 [0,2,0,0,0,0|1,0,1]=4 4040 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)C 7a_100000211493_100000179758 [0,2,0,0,0,0|1,0,1]=4 4041 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)Cl 1458a_200000191291_200000210301 [0,2,0,0,0,0|1,0,1]=4 4042 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)Cl 7a_100000211422_100000179758 [0,2,0,0,0,0|1,0,1]=4 4043 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)F 7a_100000692107_100000179758 [0,2,0,0,0,0|1,0,1]=4 4044 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1Cl)I 7a_100011356854_100000179758 [0,2,0,0,0,0|1,0,1]=4 4045 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1F)Br 7a_100000686035_100000179758 [0,2,0,0,0,0|1,0,1]=4 4046 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1F)C 7a_100000759540_100000179758 [0,2,0,0,0,0|1,0,1]=4 4047 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1F)Cl 7a_100000757397_100000179758 [0,2,0,0,0,0|1,0,1]=4 4048 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1F)F 7a_100000752141_100000179758 [0,2,0,0,0,0|1,0,1]=4 4049 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1F)I 7a_100009958187_100000179758 [0,2,0,0,0,0|1,0,1]=4 4050 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1F)N 7a_100012017398_100000179758 [0,2,0,0,0,0|1,0,1]=4 4051 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1I)Br 7a_100012344904_100000179758 [0,2,0,0,0,0|1,0,1]=4 4052 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1I)Cl 7a_100000050036_100000179758 [0,2,0,0,0,0|1,0,1]=4 4053 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1I)F 7a_100010084537_100000179758 [0,2,0,0,0,0|1,0,1]=4 4054 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1N)Br 7a_100000739049_100000179758 [0,2,0,0,0,0|1,0,1]=4 4055 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1N)C 7a_100000211527_100000179758 [0,2,0,0,0,0|1,0,1]=4 4056 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1N)Cl 7a_100000185728_100000179758 [0,2,0,0,0,0|1,0,1]=4 4057 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1N)F 7a_100000753323_100000179758 [0,2,0,0,0,0|1,0,1]=4 4058 B14R1.4474 CC(=O)C(C)Oc1cc(ccc1N)I 7a_100000057187_100000179758 [0,2,0,0,0,0|1,0,1]=4 4059 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)Br 62a_100009814033_100011483371 [0,2,0,0,0,0|1,0,1]=4 4060 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)Br 62a_100011483371_100009814033 [0,2,0,0,0,0|1,0,1]=4 4061 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)C 62a_100009814033_100012353751 [0,2,0,0,0,0|1,0,1]=4 4062 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)C 62a_100012353751_100009814033 [0,2,0,0,0,0|1,0,1]=4 4063 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)Cl 62a_100009814033_100012339723 [0,2,0,0,0,0|1,0,1]=4 4064 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)Cl 62a_100012339723_100009814033 [0,2,0,0,0,0|1,0,1]=4 4065 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)F 62a_100009814033_100011217576 [0,2,0,0,0,0|1,0,1]=4 4066 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)F 62a_100011217576_100009814033 [0,2,0,0,0,0|1,0,1]=4 4067 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)N 62a_100000750459_100009814033 [0,2,0,0,0,0|1,0,1]=4 4068 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)N 62a_100009814033_100000750459 [0,2,0,0,0,0|1,0,1]=4 4069 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)O 62a_100009814033_100012339312 [0,2,0,0,0,0|1,0,1]=4 4070 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Br)O 62a_100012339312_100009814033 [0,2,0,0,0,0|1,0,1]=4 4071 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)Br 62a_100009814033_100011344865 [0,2,0,0,0,0|1,0,1]=4 4072 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)Br 62a_100011344865_100009814033 [0,2,0,0,0,0|1,0,1]=4 4073 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)C 62a_100000210833_100009814033 [0,2,0,0,0,0|1,0,1]=4 4074 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)C 62a_100009814033_100000210833 [0,2,0,0,0,0|1,0,1]=4 4075 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)Cl 62a_100009814033_100011263213 [0,2,0,0,0,0|1,0,1]=4 4076 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)Cl 62a_100011263213_100009814033 [0,2,0,0,0,0|1,0,1]=4 4077 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)F 62a_100009814033_100011218078 [0,2,0,0,0,0|1,0,1]=4 4078 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)F 62a_100011218078_100009814033 [0,2,0,0,0,0|1,0,1]=4 4079 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)N 62a_100000736455_100009814033 [0,2,0,0,0,0|1,0,1]=4 4080 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)N 62a_100009814033_100000736455 [0,2,0,0,0,0|1,0,1]=4 4081 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)O 62a_100009814033_100011380479 [0,2,0,0,0,0|1,0,1]=4 4082 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1C)O 62a_100011380479_100009814033 [0,2,0,0,0,0|1,0,1]=4 4083 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)Br 62a_100009814033_100011772130 [0,2,0,0,0,0|1,0,1]=4 4084 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)Br 62a_100011772130_100009814033 [0,2,0,0,0,0|1,0,1]=4 4085 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)C 62a_100009814033_100012356289 [0,2,0,0,0,0|1,0,1]=4 4086 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)C 62a_100012356289_100009814033 [0,2,0,0,0,0|1,0,1]=4 4087 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)Cl 62a_100000707729_100009814033 [0,2,0,0,0,0|1,0,1]=4 4088 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)Cl 62a_100009814033_100000707729 [0,2,0,0,0,0|1,0,1]=4 4089 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)F 62a_100009814033_100011217299 [0,2,0,0,0,0|1,0,1]=4 4090 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)F 62a_100011217299_100009814033 [0,2,0,0,0,0|1,0,1]=4 4091 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)N 62a_100009814033_100012360549 [0,2,0,0,0,0|1,0,1]=4 4092 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)N 62a_100012360549_100009814033 [0,2,0,0,0,0|1,0,1]=4 4093 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)O 62a_100000049588_100009814033 [0,2,0,0,0,0|1,0,1]=4 4094 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1Cl)O 62a_100009814033_100000049588 [0,2,0,0,0,0|1,0,1]=4 4095 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)Br 62a_100009814033_100011217312 [0,2,0,0,0,0|1,0,1]=4 4096 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)Br 62a_100011217312_100009814033 [0,2,0,0,0,0|1,0,1]=4 4097 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)C 62a_100000736223_100009814033 [0,2,0,0,0,0|1,0,1]=4 4098 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)C 62a_100009814033_100000736223 [0,2,0,0,0,0|1,0,1]=4 4099 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)Cl 62a_100009814033_100011218116 [0,2,0,0,0,0|1,0,1]=4 4100 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)Cl 62a_100011218116_100009814033 [0,2,0,0,0,0|1,0,1]=4 4101 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)F 62a_100009814033_100011219198 [0,2,0,0,0,0|1,0,1]=4 4102 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)F 62a_100011219198_100009814033 [0,2,0,0,0,0|1,0,1]=4 4103 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)N 62a_100000760356_100009814033 [0,2,0,0,0,0|1,0,1]=4 4104 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)N 62a_100009814033_100000760356 [0,2,0,0,0,0|1,0,1]=4 4105 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)O 62a_100000693481_100009814033 [0,2,0,0,0,0|1,0,1]=4 4106 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1F)O 62a_100009814033_100000693481 [0,2,0,0,0,0|1,0,1]=4 4107 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)Br 62a_100000187925_100009814033 [0,2,0,0,0,0|1,0,1]=4 4108 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)Br 62a_100009814033_100000187925 [0,2,0,0,0,0|1,0,1]=4 4109 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)C 62a_100009814033_100011356834 [0,2,0,0,0,0|1,0,1]=4 4110 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)C 62a_100011356834_100009814033 [0,2,0,0,0,0|1,0,1]=4 4111 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)Cl 62a_100000761889_100009814033 [0,2,0,0,0,0|1,0,1]=4 4112 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)Cl 62a_100009814033_100000761889 [0,2,0,0,0,0|1,0,1]=4 4113 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)F 62a_100000760547_100009814033 [0,2,0,0,0,0|1,0,1]=4 4114 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)F 62a_100009814033_100000760547 [0,2,0,0,0,0|1,0,1]=4 4115 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)N 62a_100009814033_100011534242 [0,2,0,0,0,0|1,0,1]=4 4116 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)N 62a_100011534242_100009814033 [0,2,0,0,0,0|1,0,1]=4 4117 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)O 62a_100009814033_100012001276 [0,2,0,0,0,0|1,0,1]=4 4118 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1N)O 62a_100012001276_100009814033 [0,2,0,0,0,0|1,0,1]=4 4119 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)Br 62a_100009814033_100012355227 [0,2,0,0,0,0|1,0,1]=4 4120 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)Br 62a_100012355227_100009814033 [0,2,0,0,0,0|1,0,1]=4 4121 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)C 62a_100000765521_100009814033 [0,2,0,0,0,0|1,0,1]=4 4122 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)C 62a_100009814033_100000765521 [0,2,0,0,0,0|1,0,1]=4 4123 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)Cl 62a_100009814033_100011356953 [0,2,0,0,0,0|1,0,1]=4 4124 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)Cl 62a_100011356953_100009814033 [0,2,0,0,0,0|1,0,1]=4 4125 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)F 62a_100000211999_100009814033 [0,2,0,0,0,0|1,0,1]=4 4126 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)F 62a_100009814033_100000211999 [0,2,0,0,0,0|1,0,1]=4 4127 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)N 62a_100009814033_100011534360 [0,2,0,0,0,0|1,0,1]=4 4128 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)N 62a_100011534360_100009814033 [0,2,0,0,0,0|1,0,1]=4 4129 B14R1.4474 CC(=O)C(C)Sc1cc(ccc1O)O 62a_100009814033_100009813629 [0,2,0,0,0,0|1,0,1]=4 4130 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Br)Cl 11a_100000711432_100015343762 [0,2,0,0,0,0|1,0,1]=4 4131 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Br)Cl 1626a_100000711432_100015343762 [0,2,0,0,0,0|1,0,1]=4 4132 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Br)Cl 240690a_100000711432_100015343762 [0,2,0,0,0,0|1,0,1]=4 4133 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Br)Cl 527a_100000711432_100103153847 [0,2,0,0,0,0|1,0,1]=4 4134 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1C)Br 11a_106744473289_100015343762 [0,2,0,0,0,0|1,0,1]=4 4135 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1C)Br 1626a_106744473289_100015343762 [0,2,0,0,0,0|1,0,1]=4 4136 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1C)Br 240690a_106744473289_100015343762 [0,2,0,0,0,0|1,0,1]=4 4137 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1C)Br 527a_106744473289_100103153847 [0,2,0,0,0,0|1,0,1]=4 4138 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Cl)Cl 11a_106354212996_100015343762 [0,2,0,0,0,0|1,0,1]=4 4139 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Cl)Cl 1626a_106354212996_100015343762 [0,2,0,0,0,0|1,0,1]=4 4140 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Cl)Cl 240690a_106354212996_100015343762 [0,2,0,0,0,0|1,0,1]=4 4141 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1Cl)Cl 527a_106354212996_100103153847 [0,2,0,0,0,0|1,0,1]=4 4142 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)Br 11a_100000748472_100015343762 [0,2,0,0,0,0|1,0,1]=4 4143 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)Br 1626a_100000748472_100015343762 [0,2,0,0,0,0|1,0,1]=4 4144 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)Br 240690a_100000748472_100015343762 [0,2,0,0,0,0|1,0,1]=4 4145 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)Br 527a_100000748472_100103153847 [0,2,0,0,0,0|1,0,1]=4 4146 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)C 11a_102515433075_100015343762 [0,2,0,0,0,0|1,0,1]=4 4147 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)C 1626a_102515433075_100015343762 [0,2,0,0,0,0|1,0,1]=4 4148 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)C 240690a_102515433075_100015343762 [0,2,0,0,0,0|1,0,1]=4 4149 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)C 527a_102515433075_100103153847 [0,2,0,0,0,0|1,0,1]=4 4150 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)F 11a_100000724026_100015343762 [0,2,0,0,0,0|1,0,1]=4 4151 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)F 1626a_100000724026_100015343762 [0,2,0,0,0,0|1,0,1]=4 4152 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)F 240690a_100000724026_100015343762 [0,2,0,0,0,0|1,0,1]=4 4153 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1F)F 527a_100000724026_100103153847 [0,2,0,0,0,0|1,0,1]=4 4154 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1O)Br 240690a_100011602694_100015343762 [0,2,0,0,0,0|1,0,1]=4 4155 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1O)Br 527a_100011602694_100103153847 [0,2,0,0,0,0|1,0,1]=4 4156 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1O)Cl 240690a_100000712467_100015343762 [0,2,0,0,0,0|1,0,1]=4 4157 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1O)Cl 527a_100000712467_100103153847 [0,2,0,0,0,0|1,0,1]=4 4158 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1O)F 240690a_114855342409_100015343762 [0,2,0,0,0,0|1,0,1]=4 4159 B14R1.4474 CC(=O)N(C)Cc1cc(ccc1O)F 527a_114855342409_100103153847 [0,2,0,0,0,0|1,0,1]=4 4160 B14R1.4474 CC(Oc1cc(ccc1Cl)Cl)C(=O)[13CH3] 1458a_200000191291_200025704644 [0,2,0,0,0,0|1,0,1]=4 4161 B14R1.4474 Cc1ccc(c(c1)OC(C)C(=O)[13CH3])Cl 1458a_100000246039_200025704644 [0,2,0,0,0,0|1,0,1]=4 4162 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1Br 1458a_100000188424_100000179758 [0,2,0,0,0,0|0,0,1]=3 4163 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1C 1458a_100000212026_100000179758 [0,2,0,0,0,0|0,0,1]=3 4164 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1Cl 1458a_100000070787_100010255250 [0,2,0,0,0,0|0,0,1]=3 4165 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1Cl 1458a_100000185844_100000179758 [0,2,0,0,0,0|0,0,1]=3 4166 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1F 1458a_100000188656_100000179758 [0,2,0,0,0,0|0,0,1]=3 4167 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1I 1458a_100000187884_100000179758 [0,2,0,0,0,0|0,0,1]=3 4168 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1O 1458a_100015234032_100000179758 [0,2,0,0,0,0|0,0,1]=3 4169 B14R1.243 CC(=O)C(C)C(=O)c1ccccc1[O-] 1458a_100009911694_100000179758 [0,2,0,0,0,0|0,0,1]=3 4170 B14R1.243 CC(=O)C(C)N(C)c1ccccc1Br 2230a_100020606079_100009814033 [0,2,0,0,0,0|1,0,1]=4 4171 B14R1.243 CC(=O)C(C)N(C)c1ccccc1Br 269982a_100020606079_100009814033 [0,2,0,0,0,0|1,0,1]=4 4172 B14R1.243 CC(=O)C(C)N(C)c1ccccc1C 2230a_100000219699_100009814033 [0,2,0,0,0,0|1,0,1]=4 4173 B14R1.243 CC(=O)C(C)N(C)c1ccccc1C 269982a_100000219699_100009814033 [0,2,0,0,0,0|1,0,1]=4 4174 B14R1.243 CC(=O)C(C)N(C)c1ccccc1Cl 2230a_100000219374_100009814033 [0,2,0,0,0,0|1,0,1]=4 4175 B14R1.243 CC(=O)C(C)N(C)c1ccccc1Cl 269982a_100000219374_100009814033 [0,2,0,0,0,0|1,0,1]=4 4176 B14R1.243 CC(=O)C(C)N(C)c1ccccc1F 2230a_100000220357_100009814033 [0,2,0,0,0,0|1,0,1]=4 4177 B14R1.243 CC(=O)C(C)N(C)c1ccccc1F 269982a_100000220357_100009814033 [0,2,0,0,0,0|1,0,1]=4 4178 B14R1.243 CC(=O)C(C)N(C)c1ccccc1O 269982a_100000033821_100009814033 [0,2,0,0,0,0|1,0,1]=4 4179 B14R1.243 CC(=O)N(C)C(C)c1ccccc1Br 11a_100000692418_100015343762 [0,2,0,0,0,0|1,0,1]=4 4180 B14R1.243 CC(=O)N(C)C(C)c1ccccc1Br 1626a_100000692418_100015343762 [0,2,0,0,0,0|1,0,1]=4 4181 B14R1.243 CC(=O)N(C)C(C)c1ccccc1Br 240690a_100000692418_100015343762 [0,2,0,0,0,0|1,0,1]=4 4182 B14R1.243 CC(=O)N(C)C(C)c1ccccc1Br 527a_100000692418_100103153847 [0,2,0,0,0,0|1,0,1]=4 4183 B14R1.243 CC(=O)N(C)C(C)c1ccccc1F 11a_100000231110_100015343762 [0,2,0,0,0,0|1,0,1]=4 4184 B14R1.243 CC(=O)N(C)C(C)c1ccccc1F 1626a_100000231110_100015343762 [0,2,0,0,0,0|1,0,1]=4 4185 B14R1.243 CC(=O)N(C)C(C)c1ccccc1F 240690a_100000231110_100015343762 [0,2,0,0,0,0|1,0,1]=4 4186 B14R1.243 CC(=O)N(C)C(C)c1ccccc1F 527a_100000231110_100103153847 [0,2,0,0,0,0|1,0,1]=4 4187 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1Br 1458a_100000188424_100000702099 [0,2,0,0,0,0|1,0,1]=4 4188 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1Cl 1458a_100000185844_100000702099 [0,2,0,0,0,0|1,0,1]=4 4189 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1F 1458a_100000188656_100000702099 [0,2,0,0,0,0|1,0,1]=4 4190 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1I 1458a_100000187884_100000702099 [0,2,0,0,0,0|1,0,1]=4 4191 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1O 1458a_100015234032_100000702099 [0,2,0,0,0,0|1,0,1]=4 4192 B14R1.243 CC(C(=O)N)C(=O)c1ccccc1[O-] 1458a_100009911694_100000702099 [0,2,0,0,0,0|1,0,1]=4 4193 B14R1.243 Cc1ccccc1C(=O)C(C)C(=O)N 1458a_100000212026_100000702099 [0,2,0,0,0,0|1,0,1]=4 4194 B14R1.1017 CCC(C(=O)N)C(=O)c1ccccc1 1458a_100000185807_100000750255 [0,2,0,0,0,0|1,0,1]=4 4195 B14R1.1027 CCC(c1ccccc1)N(C)C(=O)C 11a_100000737544_100015343762 [0,2,0,0,0,0|1,0,1]=4 4196 B14R1.1027 CCC(c1ccccc1)N(C)C(=O)C 1626a_100000737544_100015343762 [0,2,0,0,0,0|1,0,1]=4 4197 B14R1.1027 CCC(c1ccccc1)N(C)C(=O)C 240690a_100000737544_100015343762 [0,2,0,0,0,0|1,0,1]=4 4198 B14R1.1027 CCC(c1ccccc1)N(C)C(=O)C 527a_100000737544_100103153847 [0,2,0,0,0,0|1,0,1]=4 4199 B14R1.1027 CCN(c1ccccc1)C(C)C(=O)C 2230a_100000210013_100009814033 [0,2,0,0,0,0|1,0,1]=4 4200 B14R1.1027 CCN(c1ccccc1)C(C)C(=O)C 269982a_100000210013_100009814033 [0,2,0,0,0,0|1,0,1]=4 4201 B14R1.6391 CC(=O)C(C)(C)C(=O)c1ccccc1 1458a_100000070787_200009813919 [0,2,0,0,0,0|0,0,1]=3 4202 B14R1.6391 CC(=O)C(C)(C)N(C)c1ccccc1 269982a_100000210012_100000075568 [0,2,0,0,0,0|1,0,1]=4 4203 B14R1.550 CCC(Oc1ccccc1Cl)C(=O)C 1458a_100000205292_200000210301 [0,2,0,0,0,0|1,0,1]=4 4204 B14R1.550 CCC(Oc1ccccc1Cl)C(=O)[13CH3] 1458a_100000205292_200025704644 [0,2,0,0,0,0|1,0,1]=4 4205 B14R1.550 CCN(Cc1ccccc1C)C(=O)C 11a_100000201206_100015343762 [0,2,0,0,0,0|1,0,1]=4 4206 B14R1.550 CCN(Cc1ccccc1C)C(=O)C 1626a_100000201206_100015343762 [0,2,0,0,0,0|1,0,1]=4 4207 B14R1.550 CCN(Cc1ccccc1C)C(=O)C 240690a_100000201206_100015343762 [0,2,0,0,0,0|1,0,1]=4 4208 B14R1.550 CCN(Cc1ccccc1C)C(=O)C 527a_100000201206_100103153847 [0,2,0,0,0,0|1,0,1]=4 4209 B14R1.550 CCN(Cc1ccccc1Cl)C(=O)C 11a_100000201176_100015343762 [0,2,0,0,0,0|1,0,1]=4 4210 B14R1.550 CCN(Cc1ccccc1Cl)C(=O)C 1626a_100000201176_100015343762 [0,2,0,0,0,0|1,0,1]=4 4211 B14R1.550 CCN(Cc1ccccc1Cl)C(=O)C 240690a_100000201176_100015343762 [0,2,0,0,0,0|1,0,1]=4 4212 B14R1.550 CCN(Cc1ccccc1Cl)C(=O)C 527a_100000201176_100103153847 [0,2,0,0,0,0|1,0,1]=4 4213 B14R1.550 CCN(Cc1ccccc1F)C(=O)C 11a_100015186831_100015343762 [0,2,0,0,0,0|1,0,1]=4 4214 B14R1.550 CCN(Cc1ccccc1F)C(=O)C 1626a_100015186831_100015343762 [0,2,0,0,0,0|1,0,1]=4 4215 B14R1.550 CCN(Cc1ccccc1F)C(=O)C 240690a_100015186831_100015343762 [0,2,0,0,0,0|1,0,1]=4 4216 B14R1.550 CCN(Cc1ccccc1F)C(=O)C 527a_100015186831_100103153847 [0,2,0,0,0,0|1,0,1]=4 4217 B14R1.550 CCN(Cc1ccccc1O)C(=O)C 240690a_100011223546_100015343762 [0,2,0,0,0,0|1,0,1]=4 4218 B14R1.550 CCN(Cc1ccccc1O)C(=O)C 527a_100011223546_100103153847 [0,2,0,0,0,0|1,0,1]=4 4219 B14R1.3135 C#Cc1ccccc1OC(C)C(=O)C 7a_200011470546_100000179758 [0,2,0,0,0,0|1,0,1]=4 4220 B14R1.3135 C/C(=C\c1ccccc1O[13CH3])/[N+](=O)[O-] 34a_200039083493_200025704644 [0,2,0,0,0,0|2,0,0]=4 4221 B14R1.3135 C/C(=C\c1ccccc1O[13CH3])/[N+](=O)[O-] 7a_200039083493_200025704644 [0,2,0,0,0,0|2,0,0]=4 4222 B14R1.3135 C=Cc1ccccc1SC(C)C(=O)C 62a_100009814033_100011218376 [0,2,0,0,0,0|1,0,1]=4 4223 B14R1.3135 C=Cc1ccccc1SC(C)C(=O)C 62a_100011218376_100009814033 [0,2,0,0,0,0|1,0,1]=4 4224 B14R1.3135 CC(=O)C(C)Oc1ccccc1C#N 7a_100000211048_100000179758 [0,2,0,0,0,0|1,0,1]=4 4225 B14R1.3135 CC(=O)C(C)Sc1ccccc1C#N 62a_100009814033_100000188569 [0,2,0,0,0,0|1,0,1]=4 4226 B14R1.3135 CC(=O)C(C)Sc1ccccc1C=O 62a_100000210073_100009814033 [0,2,0,0,0,0|1,0,1]=4 4227 B14R1.3135 CC(=O)C(C)Sc1ccccc1C=O 62a_100009814033_100000210073 [0,2,0,0,0,0|1,0,1]=4 4228 B14R1.3135 CC(=O)C(C)Sc1ccccc1CN 62a_100000689332_100009814033 [0,2,0,0,0,0|1,0,1]=4 4229 B14R1.3135 CC(=O)C(C)Sc1ccccc1CN 62a_100009814033_100000689332 [0,2,0,0,0,0|1,0,1]=4 4230 B14R1.3135 CC(=O)C(C)Sc1ccccc1CO 62a_100000187465_100009814033 [0,2,0,0,0,0|1,0,1]=4 4231 B14R1.3135 CC(=O)C(C)Sc1ccccc1CO 62a_100009814033_100000187465 [0,2,0,0,0,0|1,0,1]=4 4232 B14R1.3135 CC(=O)C(C)Sc1ccccc1NN 62a_100000241748_100009814033 [0,2,0,0,0,0|1,0,1]=4 4233 B14R1.3135 CC(=O)C(C)Sc1ccccc1NN 62a_100009814033_100000241748 [0,2,0,0,0,0|1,0,1]=4 4234 B14R1.3135 CC(=O)N(C)Cc1ccccc1C#N 1626a_100000225633_100015343762 [0,2,0,0,0,0|1,0,1]=4 4235 B14R1.3135 CC(=O)N(C)Cc1ccccc1C#N 240690a_100000225633_100015343762 [0,2,0,0,0,0|1,0,1]=4 4236 B14R1.3135 CC(=O)N(C)Cc1ccccc1CO 240690a_100000044721_100015343762 [0,2,0,0,0,0|1,0,1]=4 4237 B14R1.3135 CC(=O)N(C)Cc1ccccc1CO 527a_100000044721_100103153847 [0,2,0,0,0,0|1,0,1]=4 4238 B14R1.3135 CCc1ccccc1NC(=O)C(=O)C 1458a_200011297324_200000210301 [0,2,0,0,0,0|2,0,0]=4 4239 B14R1.3135 CCc1ccccc1NC(=O)C(=O)[13CH3] 1458a_200011297324_200025704644 [0,2,0,0,0,0|2,0,0]=4 4240 B14R1.3135 CCc1ccccc1NC(C)C(=O)C 2230a_100000212081_100009814033 [0,2,0,0,0,0|1,0,1]=4 4241 B14R1.3135 CCc1ccccc1NC(C)C(=O)C 7a_100000212081_100000179758 [0,2,0,0,0,0|1,0,1]=4 4242 B14R1.3135 CCc1ccccc1OC(C)C(=O)C 7a_100000210936_100000179758 [0,2,0,0,0,0|1,0,1]=4 4243 B14R1.3135 CCc1ccccc1SC(C)C(=O)C 62a_100009814033_100011215823 [0,2,0,0,0,0|1,0,1]=4 4244 B14R1.3135 CCc1ccccc1SC(C)C(=O)C 62a_100011215823_100009814033 [0,2,0,0,0,0|1,0,1]=4 4245 B14R1.3135 CNc1ccccc1SC(C)C(=O)C 62a_100009814033_100020606079 [0,2,0,0,0,0|1,0,1]=4 4246 B14R1.3135 CNc1ccccc1SC(C)C(=O)C 62a_100020606079_100009814033 [0,2,0,0,0,0|1,0,1]=4 4247 B14R1.3135 COc1ccccc1/C=C(\C)/[N+](=O)[O-] 34a_200039083493_200000210301 [0,2,0,0,0,0|2,0,0]=4 4248 B14R1.3135 COc1ccccc1/C=C(\C)/[N+](=O)[O-] 7a_200039083493_200000210301 [0,2,0,0,0,0|2,0,0]=4 4249 B14R1.3135 COc1ccccc1CN(C)C(=O)C 11a_100000184376_100015343762 [0,2,0,0,0,0|1,0,1]=4 4250 B14R1.3135 COc1ccccc1CN(C)C(=O)C 1626a_100000184376_100015343762 [0,2,0,0,0,0|1,0,1]=4 4251 B14R1.3135 COc1ccccc1CN(C)C(=O)C 240690a_100000184376_100015343762 [0,2,0,0,0,0|1,0,1]=4 4252 B14R1.3135 COc1ccccc1CN(C)C(=O)C 527a_100000184376_100103153847 [0,2,0,0,0,0|1,0,1]=4 4253 B14R1.3135 COc1ccccc1NC(=O)C(=O)C 1458a_200011297187_200000210301 [0,2,0,0,0,0|2,0,0]=4 4254 B14R1.3135 COc1ccccc1NC(=O)C(=O)[13CH3] 1458a_200011297187_200025704644 [0,2,0,0,0,0|2,0,0]=4 4255 B14R1.3135 COc1ccccc1OC(C)C(=O)C 1458a_100000188836_200000210301 [0,2,0,0,0,0|1,0,1]=4 4256 B14R1.3135 COc1ccccc1OC(C)C(=O)[13CH3] 1458a_100000188836_200025704644 [0,2,0,0,0,0|1,0,1]=4 4257 B14R1.3135 COc1ccccc1SC(C)C(=O)C 62a_100000210334_100009814033 [0,2,0,0,0,0|1,0,1]=4 4258 B14R1.3135 COc1ccccc1SC(C)C(=O)C 62a_100009814033_100000210334 [0,2,0,0,0,0|1,0,1]=4 4259 B14R1.3135 CSc1ccccc1SC(C)C(=O)C 62a_100009814033_100011217816 [0,2,0,0,0,0|1,0,1]=4 4260 B14R1.3135 CSc1ccccc1SC(C)C(=O)C 62a_100011217816_100009814033 [0,2,0,0,0,0|1,0,1]=4 4261 B14R1.5882 CC(=O)C(C)(C)Cc1ccccc1F 1458a_200011736048_200000210301 [0,2,0,0,0,0|0,0,2]=4 4262 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1Br 7a_100000181306_100000075568 [0,2,0,0,0,0|1,0,1]=4 4263 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1C 1458a_200015182929_200000210301 [0,2,0,0,0,0|1,0,1]=4 4264 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1C 7a_100000210338_100000075568 [0,2,0,0,0,0|1,0,1]=4 4265 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1Cl 1458a_100015197561_200000210301 [0,2,0,0,0,0|1,0,1]=4 4266 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1Cl 7a_100000210172_100000075568 [0,2,0,0,0,0|1,0,1]=4 4267 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1F 7a_100000210171_100000075568 [0,2,0,0,0,0|1,0,1]=4 4268 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1I 7a_100000739446_100000075568 [0,2,0,0,0,0|1,0,1]=4 4269 B14R1.5882 CC(=O)C(C)(C)Oc1ccccc1N 7a_100000185747_100000075568 [0,2,0,0,0,0|1,0,1]=4 4270 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1Br 62a_100000075568_100000695589 [0,2,0,0,0,0|1,0,1]=4 4271 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1Br 62a_100000695589_100000075568 [0,2,0,0,0,0|1,0,1]=4 4272 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1C 62a_100000075568_100000210755 [0,2,0,0,0,0|1,0,1]=4 4273 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1C 62a_100000210755_100000075568 [0,2,0,0,0,0|1,0,1]=4 4274 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1Cl 62a_100000075568_100000764095 [0,2,0,0,0,0|1,0,1]=4 4275 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1Cl 62a_100000764095_100000075568 [0,2,0,0,0,0|1,0,1]=4 4276 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1F 62a_100000075568_100011215700 [0,2,0,0,0,0|1,0,1]=4 4277 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1F 62a_100011215700_100000075568 [0,2,0,0,0,0|1,0,1]=4 4278 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1N 62a_100000075568_100000210017 [0,2,0,0,0,0|1,0,1]=4 4279 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1N 62a_100000210017_100000075568 [0,2,0,0,0,0|1,0,1]=4 4280 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1O 62a_100000075568_100000739446 [0,2,0,0,0,0|1,0,1]=4 4281 B14R1.5882 CC(=O)C(C)(C)Sc1ccccc1O 62a_100000739446_100000075568 [0,2,0,0,0,0|1,0,1]=4 4282 B14R1.5882 CC(C)(Cc1ccccc1F)C(=O)[13CH3] 1458a_200011736048_200025704644 [0,2,0,0,0,0|0,0,2]=4 4283 B14R1.5882 CC(C)(Oc1ccccc1Cl)C(=O)[13CH3] 1458a_100015197561_200025704644 [0,2,0,0,0,0|1,0,1]=4 4284 B14R1.5882 Cc1ccccc1OC(C)(C)C(=O)[13CH3] 1458a_200015182929_200025704644 [0,2,0,0,0,0|1,0,1]=4 4285 B14R1.5971 CC(=O)C(=O)Nc1c(cccc1C)C 1458a_100000689146_200000210301 [0,2,0,0,0,0|2,0,0]=4 4286 B14R1.5971 CC(=O)C(C)Nc1c(cccc1F)F 2230a_100000210704_100009814033 [0,2,0,0,0,0|1,0,1]=4 4287 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Br)Br 7a_100000736428_100000179758 [0,2,0,0,0,0|1,0,1]=4 4288 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Br)C 7a_100009817157_100000179758 [0,2,0,0,0,0|1,0,1]=4 4289 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Br)Cl 7a_100010214474_100000179758 [0,2,0,0,0,0|1,0,1]=4 4290 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Br)F 7a_100009813666_100000179758 [0,2,0,0,0,0|1,0,1]=4 4291 B14R1.5971 CC(=O)C(C)Oc1c(cccc1C)C 7a_100000210341_100000179758 [0,2,0,0,0,0|1,0,1]=4 4292 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Cl)C 7a_100000033731_100000179758 [0,2,0,0,0,0|1,0,1]=4 4293 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Cl)Cl 7a_100000211709_100000179758 [0,2,0,0,0,0|1,0,1]=4 4294 B14R1.5971 CC(=O)C(C)Oc1c(cccc1Cl)F 7a_100000694953_100000179758 [0,2,0,0,0,0|1,0,1]=4 4295 B14R1.5971 CC(=O)C(C)Oc1c(cccc1F)C 7a_100011659162_100000179758 [0,2,0,0,0,0|1,0,1]=4 4296 B14R1.5971 CC(=O)C(C)Oc1c(cccc1F)F 7a_100000230165_100000179758 [0,2,0,0,0,0|1,0,1]=4 4297 B14R1.5971 CC(=O)C(C)Oc1c(cccc1I)Br 7a_100010084509_100000179758 [0,2,0,0,0,0|1,0,1]=4 4298 B14R1.5971 CC(=O)C(C)Oc1c(cccc1I)Cl 7a_100010202889_100000179758 [0,2,0,0,0,0|1,0,1]=4 4299 B14R1.5971 CC(=O)C(C)Oc1c(cccc1I)F 7a_100010186298_100000179758 [0,2,0,0,0,0|1,0,1]=4 4300 B14R1.5971 CC(=O)C(C)Oc1c(cccc1N)C 7a_100000756359_100000179758 [0,2,0,0,0,0|1,0,1]=4 4301 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)Br 62a_100009814033_100009994525 [0,2,0,0,0,0|1,0,1]=4 4302 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)Br 62a_100009994525_100009814033 [0,2,0,0,0,0|1,0,1]=4 4303 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)C 62a_100009814033_100010141302 [0,2,0,0,0,0|1,0,1]=4 4304 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)C 62a_100010141302_100009814033 [0,2,0,0,0,0|1,0,1]=4 4305 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)Cl 62a_100009814033_100010214488 [0,2,0,0,0,0|1,0,1]=4 4306 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)Cl 62a_100010214488_100009814033 [0,2,0,0,0,0|1,0,1]=4 4307 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)F 62a_100009814033_100011219512 [0,2,0,0,0,0|1,0,1]=4 4308 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)F 62a_100011219512_100009814033 [0,2,0,0,0,0|1,0,1]=4 4309 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)N 62a_100009814033_100020590159 [0,2,0,0,0,0|1,0,1]=4 4310 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)N 62a_100020590159_100009814033 [0,2,0,0,0,0|1,0,1]=4 4311 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)O 62a_100009814033_100010187912 [0,2,0,0,0,0|1,0,1]=4 4312 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Br)O 62a_100010187912_100009814033 [0,2,0,0,0,0|1,0,1]=4 4313 B14R1.5971 CC(=O)C(C)Sc1c(cccc1C)C 62a_100000033847_100009814033 [0,2,0,0,0,0|1,0,1]=4 4314 B14R1.5971 CC(=O)C(C)Sc1c(cccc1C)C 62a_100009814033_100000033847 [0,2,0,0,0,0|1,0,1]=4 4315 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)C 62a_100000043165_100009814033 [0,2,0,0,0,0|1,0,1]=4 4316 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)C 62a_100009814033_100000043165 [0,2,0,0,0,0|1,0,1]=4 4317 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)Cl 62a_100000034237_100009814033 [0,2,0,0,0,0|1,0,1]=4 4318 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)Cl 62a_100009814033_100000034237 [0,2,0,0,0,0|1,0,1]=4 4319 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)F 62a_100000050007_100009814033 [0,2,0,0,0,0|1,0,1]=4 4320 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)F 62a_100009814033_100000050007 [0,2,0,0,0,0|1,0,1]=4 4321 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)N 62a_100000049713_100009814033 [0,2,0,0,0,0|1,0,1]=4 4322 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)N 62a_100009814033_100000049713 [0,2,0,0,0,0|1,0,1]=4 4323 B14R1.5971 CC(=O)C(C)Sc1c(cccc1Cl)O 62a_100009814033_100000050174 [0,2,0,0,0,0|1,0,1]=4 4324 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)C 62a_100009814033_100011218421 [0,2,0,0,0,0|1,0,1]=4 4325 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)C 62a_100011218421_100009814033 [0,2,0,0,0,0|1,0,1]=4 4326 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)F 62a_100000693133_100009814033 [0,2,0,0,0,0|1,0,1]=4 4327 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)F 62a_100009814033_100000693133 [0,2,0,0,0,0|1,0,1]=4 4328 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)N 62a_100000690935_100009814033 [0,2,0,0,0,0|1,0,1]=4 4329 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)N 62a_100009814033_100000690935 [0,2,0,0,0,0|1,0,1]=4 4330 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)O 62a_100009814033_100009820682 [0,2,0,0,0,0|1,0,1]=4 4331 B14R1.5971 CC(=O)C(C)Sc1c(cccc1F)O 62a_100009820682_100009814033 [0,2,0,0,0,0|1,0,1]=4 4332 B14R1.5971 CC(=O)C(C)Sc1c(cccc1N)C 62a_100000684715_100009814033 [0,2,0,0,0,0|1,0,1]=4 4333 B14R1.5971 CC(=O)C(C)Sc1c(cccc1N)C 62a_100009814033_100000684715 [0,2,0,0,0,0|1,0,1]=4 4334 B14R1.5971 CC(=O)C(C)Sc1c(cccc1O)C 62a_100000686692_100009814033 [0,2,0,0,0,0|1,0,1]=4 4335 B14R1.5971 CC(=O)C(C)Sc1c(cccc1O)C 62a_100009814033_100000686692 [0,2,0,0,0,0|1,0,1]=4 4336 B14R1.5971 CC(=O)C(C)Sc1c(cccc1O)N 62a_100009814033_100012183704 [0,2,0,0,0,0|1,0,1]=4 4337 B14R1.5971 CC(=O)C(C)Sc1c(cccc1O)N 62a_100012183704_100009814033 [0,2,0,0,0,0|1,0,1]=4 4338 B14R1.5971 CC(=O)C(C)Sc1c(cccc1O)O 62a_100009814033_100010205330 [0,2,0,0,0,0|1,0,1]=4 4339 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Br)F 11a_106744473292_100015343762 [0,2,0,0,0,0|1,0,1]=4 4340 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Br)F 1626a_106744473292_100015343762 [0,2,0,0,0,0|1,0,1]=4 4341 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Br)F 240690a_106744473292_100015343762 [0,2,0,0,0,0|1,0,1]=4 4342 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Br)F 527a_106744473292_100103153847 [0,2,0,0,0,0|1,0,1]=4 4343 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)Cl 11a_100000186903_100015343762 [0,2,0,0,0,0|1,0,1]=4 4344 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)Cl 1626a_100000186903_100015343762 [0,2,0,0,0,0|1,0,1]=4 4345 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)Cl 240690a_100000186903_100015343762 [0,2,0,0,0,0|1,0,1]=4 4346 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)Cl 527a_100000186903_100103153847 [0,2,0,0,0,0|1,0,1]=4 4347 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)F 11a_100000184537_100015343762 [0,2,0,0,0,0|1,0,1]=4 4348 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)F 1626a_100000184537_100015343762 [0,2,0,0,0,0|1,0,1]=4 4349 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)F 240690a_100000184537_100015343762 [0,2,0,0,0,0|1,0,1]=4 4350 B14R1.5971 CC(=O)N(C)Cc1c(cccc1Cl)F 527a_100000184537_100103153847 [0,2,0,0,0,0|1,0,1]=4 4351 B14R1.5971 Cc1cccc(c1NC(=O)C(=O)[13CH3])C 1458a_100000689146_200025704644 [0,2,0,0,0,0|2,0,0]=4 4352 B14R1.980 C#CCN(Cc1ccccc1)C(=O)C 11a_100000730907_100015343762 [0,2,0,0,0,0|1,0,1]=4 4353 B14R1.980 C#CCN(Cc1ccccc1)C(=O)C 1626a_100000730907_100015343762 [0,2,0,0,0,0|1,0,1]=4 4354 B14R1.980 C#CCN(Cc1ccccc1)C(=O)C 240690a_100000730907_100015343762 [0,2,0,0,0,0|1,0,1]=4 4355 B14R1.980 C#CCN(Cc1ccccc1)C(=O)C 527a_100000730907_100103153847 [0,2,0,0,0,0|1,0,1]=4 4356 B14R1.980 C=CCN(Cc1ccccc1)C(=O)C 11a_100000196212_100015343762 [0,2,0,0,0,0|1,0,1]=4 4357 B14R1.980 C=CCN(Cc1ccccc1)C(=O)C 1626a_100000196212_100015343762 [0,2,0,0,0,0|1,0,1]=4 4358 B14R1.980 C=CCN(Cc1ccccc1)C(=O)C 240690a_100000196212_100015343762 [0,2,0,0,0,0|1,0,1]=4 4359 B14R1.980 C=CCN(Cc1ccccc1)C(=O)C 527a_100000196212_100103153847 [0,2,0,0,0,0|1,0,1]=4 4360 B14R1.980 CC(=O)N(CC#N)Cc1ccccc1 11a_100000743013_100015343762 [0,2,0,0,0,0|1,0,1]=4 4361 B14R1.980 CC(=O)N(CC#N)Cc1ccccc1 1626a_100000743013_100015343762 [0,2,0,0,0,0|1,0,1]=4 4362 B14R1.980 CC(=O)N(CC#N)Cc1ccccc1 240690a_100000743013_100015343762 [0,2,0,0,0,0|1,0,1]=4 4363 B14R1.980 CC(=O)N(CCO)Cc1ccccc1 240690a_100000180844_100015343762 [0,2,0,0,0,0|1,0,1]=4 4364 B14R1.980 CC(=O)N(CCO)Cc1ccccc1 527a_100000180844_100103153847 [0,2,0,0,0,0|1,0,1]=4 4365 B14R1.980 CCCN(Cc1ccccc1)C(=O)C 11a_100000184400_100015343762 [0,2,0,0,0,0|1,0,1]=4 4366 B14R1.980 CCCN(Cc1ccccc1)C(=O)C 1626a_100000184400_100015343762 [0,2,0,0,0,0|1,0,1]=4 4367 B14R1.980 CCCN(Cc1ccccc1)C(=O)C 240690a_100000184400_100015343762 [0,2,0,0,0,0|1,0,1]=4 4368 B14R1.980 CCCN(Cc1ccccc1)C(=O)C 527a_100000184400_100103153847 [0,2,0,0,0,0|1,0,1]=4 4369 B14R1.4513 CC(=O)C(Sc1ccccc1)C(=O)C 62a_100000210371_100000041952 [0,2,0,0,0,0|1,0,1]=4 4370 B14R1.4513 CC(=O)C(Sc1ccccc1)C(=O)C 62a_100000719477_100000210371 [0,2,0,0,0,0|1,0,1]=4 4371 B14R1.4513 CC(=O)C(Sc1ccccc1)C(C)C 1458a_100000750438_200000210301 [0,2,0,0,0,0|1,0,1]=4 4372 B14R1.4513 CC(=O)N(Cc1ccccc1)C(C)C 11a_100000068392_100015343762 [0,2,0,0,0,0|1,0,1]=4 4373 B14R1.4513 CC(=O)N(Cc1ccccc1)C(C)C 1626a_100000068392_100015343762 [0,2,0,0,0,0|1,0,1]=4 4374 B14R1.4513 CC(=O)N(Cc1ccccc1)C(C)C 240690a_100000068392_100015343762 [0,2,0,0,0,0|1,0,1]=4 4375 B14R1.4513 CC(=O)[C@H](Cc1ccccc1)N(C)C 1458a_102495365803_200000210301 [0,2,0,0,0,0|0,0,2]=4 4376 B14R1.4513 CC(C)C(Sc1ccccc1)C(=O)[13CH3] 1458a_100000750438_200025704644 [0,2,0,0,0,0|1,0,1]=4 4377 B14R1.4513 CN(C)[C@@H](Cc1ccccc1)C(=O)[13CH3] 1458a_102495365803_200025704644 [0,2,0,0,0,0|0,0,2]=4 4378 B12R1.11 C=Cc1cc(cc(c1)C(=O)C)Br 271570a_100011290941_100010005435 [0,0,1,1,0,0|1,0,1]=4 4379 B12R1.11 C=Cc1cc(cc(c1)C(=O)C)C 271570a_100011290941_100000694479 [0,0,1,1,0,0|0,0,2]=4 4380 B12R1.11 C=Cc1cc(cc(c1)C(=O)C)F 271570a_100011290941_100012361402 [0,0,1,1,0,0|1,0,1]=4 4381 B12R1.279 C=C=Cc1cccc(c1)C(=O)C 271570a_100015277604_100000210093 [0,0,1,1,0,0|0,0,2]=4 4382 B12R1.279 C=C=Cc1ccnc(c1)C(=O)C 271570a_100015277604_100000709912 [0,0,1,1,0,0|1,0,1]=4 4383 B12R1.279 CC=Cc1cccc(c1)C(=O)C 271570a_100016259895_100000210093 [0,0,1,1,0,0|0,0,2]=4 4384 B12R1.279 CC=Cc1ccnc(c1)C(=O)C 271570a_100016259895_100000709912 [0,0,1,1,0,0|1,0,1]=4 4385 B12R1.448 C=Cc1cc(c(cc1C=O)C)C 271570a_100011290941_100010184403 [0,0,1,1,0,0|2,0,0]=4 4386 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [1,0,0,1,0,0|2,0,0]=4 4387 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [1,0,0,1,0,0|1,0,1]=4 4388 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [1,0,0,1,0,0|1,0,1]=4 4389 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [1,0,0,1,0,0|1,0,1]=4 4390 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [1,0,0,1,0,0|2,0,0]=4 4391 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [1,0,0,1,0,0|1,0,1]=4 4392 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [1,0,0,1,0,0|1,0,1]=4 4393 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [1,0,0,1,0,0|1,0,1]=4 4394 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [1,0,0,1,0,0|2,0,0]=4 4395 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [1,0,0,1,0,0|2,0,0]=4 4396 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [1,0,0,1,0,0|2,0,0]=4 4397 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [1,0,0,1,0,0|2,0,0]=4 4398 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [1,0,0,1,0,0|2,0,0]=4 4399 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [1,0,0,1,0,0|2,0,0]=4 4400 B12R2.2057 C(=CC1CC1)c2ccccc2 271570a_100102526188_100000210277 [1,0,0,1,0,0|1,0,1]=4 4401 B12R2.3190 CC(=O)C1Cc2c1cccc2 1458a_200000238571_200000210301 [1,0,0,1,0,0|0,0,2]=4 4402 B12R2.3190 [13CH3]C(=O)C1Cc2c1cccc2 1458a_200000238571_200025704644 [1,0,0,1,0,0|0,0,2]=4 4403 B14R2.598 Cc1cc(c(s1)C)c2ccccc2 271570a_100010068963_100000210277 [0,0,0,1,0,1|1,0,0]=3 4404 B14R2.598 Cc1cc(c(s1)C)c2ccccc2 271570a_100011218836_100000688054 [0,0,0,1,0,1|1,0,0]=3 4405 B14R2.598 Cc1cc(c(s1)C)c2ccccn2 271570a_100010068963_100011216584 [0,0,0,1,0,1|2,0,0]=4 4406 B14R2.598 Cc1cc(c(s1)C)c2ccccn2 271570a_100011264011_100000688054 [0,0,0,1,0,1|2,0,0]=4 4407 B14R2.598 Cc1cc(c(s1)C)c2cccnc2 271570a_100000757648_100000688054 [0,0,0,1,0,1|2,0,0]=4 4408 B14R2.598 Cc1cc(c(s1)C)c2cccnc2 271570a_100010068963_100000752921 [0,0,0,1,0,1|2,0,0]=4 4409 B14R2.598 Cc1cc(c(s1)C)c2ccncc2 271570a_100000752145_100000688054 [0,0,0,1,0,1|2,0,0]=4 4410 B14R2.598 Cc1cc(c(s1)C)c2ccncc2 271570a_100010068963_100000035832 [0,0,0,1,0,1|2,0,0]=4 4411 B14R2.598 Cc1cc(c(s1)c2ccccc2)C 271570a_100011218836_100000689295 [0,0,0,1,0,1|0,1,0]=3 4412 B14R2.598 Cc1cc(c(s1)c2ccccn2)C 271570a_100011264011_100000689295 [0,0,0,1,0,1|1,1,0]=4 4413 B14R2.598 Cc1cc(c(s1)c2cccnc2)C 271570a_100000757648_100000689295 [0,0,0,1,0,1|1,1,0]=4 4414 B14R2.598 Cc1cc(c(s1)c2ccncc2)C 271570a_100000752145_100000689295 [0,0,0,1,0,1|1,1,0]=4 4415 B14R2.598 Cc1cc(n(n1)C)c2ccccc2 271570a_100010162543_100000210277 [0,0,0,1,0,1|2,0,0]=4 4416 B14R2.598 Cc1cc(n(n1)C)c2ccccc2 271570a_100011218836_100009818511 [0,0,0,1,0,1|2,0,0]=4 4417 B14R2.598 Cc1cn(c(n1)c2ccccc2)C 271570a_100011218836_100009816808 [0,0,0,1,0,1|2,0,0]=4 4418 B14R2.598 Cc1cn(nc1c2ccccc2)C 271570a_100011218836_100012644376 [0,0,0,1,0,1|2,0,0]=4 4419 B14R2.598 Cc1nc(c(s1)C)c2ccccc2 271570a_100011218836_100010270876 [0,0,0,1,0,1|1,0,0]=3 4420 B14R2.598 Cc1nc(c(s1)C)c2ccccn2 271570a_100011264011_100010270876 [0,0,0,1,0,1|2,0,0]=4 4421 B14R2.598 Cc1nc(c(s1)C)c2cccnc2 271570a_100000757648_100010270876 [0,0,0,1,0,1|2,0,0]=4 4422 B14R2.598 Cc1nc(c(s1)C)c2ccncc2 271570a_100000752145_100010270876 [0,0,0,1,0,1|2,0,0]=4 4423 B14R2.598 Cc1nc(c(s1)O)c2ccccc2 271570a_203496583355_200009828155 [0,0,0,1,0,1|2,0,0]=4 4424 B14R2.598 Cc1nc(c(s1)c2ccccc2)C 271570a_100000068875_100000210277 [0,0,0,1,0,1|0,1,0]=3 4425 B14R2.598 Cc1nc(c(s1)c2ccccc2)C 271570a_100011218836_100009814099 [0,0,0,1,0,1|0,1,0]=3 4426 B14R2.598 Cc1nc(c(s1)c2ccccn2)C 271570a_100000068875_100011216584 [0,0,0,1,0,1|1,1,0]=4 4427 B14R2.598 Cc1nc(c(s1)c2ccccn2)C 271570a_100011264011_100009814099 [0,0,0,1,0,1|1,1,0]=4 4428 B14R2.598 Cc1nc(c(s1)c2cccnc2)C 271570a_100000068875_100000752921 [0,0,0,1,0,1|1,1,0]=4 4429 B14R2.598 Cc1nc(c(s1)c2cccnc2)C 271570a_100000757648_100009814099 [0,0,0,1,0,1|1,1,0]=4 4430 B14R2.598 Cc1nc(c(s1)c2ccncc2)C 271570a_100000068875_100000035832 [0,0,0,1,0,1|1,1,0]=4 4431 B14R2.598 Cc1nc(c(s1)c2ccncc2)C 271570a_100000752145_100009814099 [0,0,0,1,0,1|1,1,0]=4 4432 B14R2.598 Cc1nn(cc1c2ccccc2)C 271570a_100011218836_100011996311 [0,0,0,1,0,1|2,0,0]=4 4433 B14R2.598 Cc1nn(cc1c2ccccc2)C 271570a_100011935086_100000210277 [0,0,0,1,0,1|2,0,0]=4 4434 B14R2.598 Cc1nn(nc1c2ccccc2)C 271570a_100011218836_200009884731 [0,0,0,1,0,1|2,0,0]=4 4435 B14R2.598 Cc1sc(nc1c2ccccc2)N 271570a_100011218836_100009817509 [0,0,0,1,0,1|2,0,0]=4 4436 B14R2.598 Cc1sc(nc1c2ccccc2)O 271570a_203496583355_100011830251 [0,0,0,1,0,1|1,0,1]=4 4437 B14R2.642 C=C(C)c1c(oc2c1cccc2)C 271570a_100000694244_200010236113 [0,0,0,1,0,1|2,0,0]=4 4438 B14R2.642 C=C(C)c1c(sc2c1cccc2)C 271570a_100000694244_100010002616 [0,0,0,1,0,1|2,0,0]=4 4439 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 11a_100016998360_100015343762 [0,0,0,1,0,1|0,0,2]=4 4440 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 1626a_100016998360_100015343762 [0,0,0,1,0,1|0,0,2]=4 4441 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 240690a_100016998360_100015343762 [0,0,0,1,0,1|0,0,2]=4 4442 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 527a_100016998360_100103153847 [0,0,0,1,0,1|0,0,2]=4 4443 B14R2.768 CC(=Cc1cc2ccccc2[nH]1)C 271570a_100102525489_100010232065 [0,0,0,1,0,1|2,0,0]=4 4444 B14R2.768 CC(=Cc1cc2ccccc2o1)C 271570a_100102525489_100010159458 [0,0,0,1,0,1|2,0,0]=4 4445 B14R2.768 CC(=Cc1cc2ccccc2s1)C 271570a_100102525489_100009816949 [0,0,0,1,0,1|2,0,0]=4 4446 B14R2.768 CC(=O)CC1Cc2ccccc2C1 1458a_100011217126_200000210301 [0,0,0,1,0,1|0,0,2]=4 4447 B14R2.768 CC(=O)CN1Cc2ccccc2C1 1458a_100015185064_200000210301 [0,0,0,1,0,1|1,0,1]=4 4448 B14R2.768 CC(=O)Cc1cc2ccccc2o1 1458a_100000735538_200000210301 [0,0,0,1,0,1|1,0,0]=3 4449 B14R2.768 CC(=O)Cc1cc2ccccc2s1 1458a_100012001211_200000210301 [0,0,0,1,0,1|1,0,0]=3 4450 B14R2.768 CC(=O)Cc1cn2ccccc2n1 1458a_100000070787_100000689847 [0,0,0,1,0,1|2,0,0]=4 4451 B14R2.768 CC(=O)Cc1nc2ccccc2[nH]1 1458a_100000070787_100000737899 [0,0,0,1,0,1|2,0,0]=4 4452 B14R2.768 CC(=O)Cc1nc2ccccc2o1 1458a_100000070787_100000195508 [0,0,0,1,0,1|2,0,0]=4 4453 B14R2.768 CC(=O)Cc1nc2ccccc2o1 1458a_100015185861_200000210301 [0,0,0,1,0,1|2,0,0]=4 4454 B14R2.768 CC(=O)Cc1nc2ccccc2s1 1458a_100000070787_100011217541 [0,0,0,1,0,1|2,0,0]=4 4455 B14R2.768 CC(=O)Cn1cc2ccccc2n1 1458a_100000060251_200000210301 [0,0,0,1,0,1|2,0,0]=4 4456 B14R2.768 CC(=O)NC1Cc2ccccc2C1 11a_100000753258_100015343762 [0,0,0,1,0,1|0,0,2]=4 4457 B14R2.768 CC(=O)NC1Cc2ccccc2C1 1626a_100000753258_100015343762 [0,0,0,1,0,1|0,0,2]=4 4458 B14R2.768 CC(=O)NC1Cc2ccccc2C1 240690a_100000753258_100015343762 [0,0,0,1,0,1|0,0,2]=4 4459 B14R2.768 CC(=O)NC1Cc2ccccc2C1 527a_100000753258_100103153847 [0,0,0,1,0,1|0,0,2]=4 4460 B14R2.768 [13CH3]C(=O)CC1Cc2ccccc2C1 1458a_100011217126_200025704644 [0,0,0,1,0,1|0,0,2]=4 4461 B14R2.768 [13CH3]C(=O)CN1Cc2ccccc2C1 1458a_100015185064_200025704644 [0,0,0,1,0,1|1,0,1]=4 4462 B14R2.768 [13CH3]C(=O)Cc1cc2ccccc2o1 1458a_100000735538_200025704644 [0,0,0,1,0,1|1,0,0]=3 4463 B14R2.768 [13CH3]C(=O)Cc1cc2ccccc2s1 1458a_100012001211_200025704644 [0,0,0,1,0,1|1,0,0]=3 4464 B14R2.768 [13CH3]C(=O)Cc1nc2ccccc2o1 1458a_100015185861_200025704644 [0,0,0,1,0,1|2,0,0]=4 4465 B14R2.768 [13CH3]C(=O)Cn1cc2ccccc2n1 1458a_100000060251_200025704644 [0,0,0,1,0,1|2,0,0]=4 4466 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 11a_100020588832_100015343762 [0,0,0,1,0,1|0,0,2]=4 4467 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 1626a_100020588832_100015343762 [0,0,0,1,0,1|0,0,2]=4 4468 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 240690a_100020588832_100015343762 [0,0,0,1,0,1|0,0,2]=4 4469 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 527a_100020588832_100103153847 [0,0,0,1,0,1|0,0,2]=4 4470 B14R2.31 O=C1CCC1NCc2ccccc2 34a_100015324214_100009892977 [0,0,0,1,0,1|0,0,2]=4 4471 B14R2.31 O=C1CCC1OCc2ccccc2 34a_100000210790_100009892977 [0,0,0,1,0,1|0,0,2]=4 4472 B14R2.31 O=C1CCC1OCc2ccccc2 7a_100000210790_100009892977 [0,0,0,1,0,1|0,0,2]=4 4473 B14R2.31 O=C1CCC1SCc2ccccc2 62a_100000211182_100009892977 [0,0,0,1,0,1|0,0,2]=4 4474 B14R2.31 O=C1CCC1SCc2ccccc2 62a_100009892977_100015291786 [0,0,0,1,0,1|0,0,2]=4 4475 B14R2.260 Cc1cc(nn1C)c2ccccc2 271570a_100011218836_100012001299 [0,0,0,1,0,1|2,0,0]=4 4476 B14R2.260 Cc1cc(sc1C)c2ccccc2 271570a_100011218836_100009850898 [0,0,0,1,0,1|0,1,0]=3 4477 B14R2.260 Cc1cc(sc1C)c2ccccn2 271570a_100011264011_100009850898 [0,0,0,1,0,1|1,1,0]=4 4478 B14R2.260 Cc1cc(sc1C)c2cccnc2 271570a_100000757648_100009850898 [0,0,0,1,0,1|1,1,0]=4 4479 B14R2.260 Cc1cc(sc1C)c2ccncc2 271570a_100000752145_100009850898 [0,0,0,1,0,1|1,1,0]=4 4480 B14R2.260 Cc1cc(sc1Cl)c2ccccc2 271570a_202125692827_100000210277 [0,0,0,1,0,1|1,1,0]=4 4481 B14R2.260 Cc1nc(cn1C)c2ccccc2 271570a_100011218836_100000684932 [0,0,0,1,0,1|2,0,0]=4 4482 B14R2.260 Cc1nc(sc1C)c2ccccc2 271570a_100011218836_100000765934 [0,0,0,1,0,1|0,1,0]=3 4483 B14R2.260 Cc1nc(sc1C)c2ccccn2 271570a_100011264011_100000765934 [0,0,0,1,0,1|1,1,0]=4 4484 B14R2.260 Cc1nc(sc1C)c2cccnc2 271570a_100000757648_100000765934 [0,0,0,1,0,1|1,1,0]=4 4485 B14R2.260 Cc1nc(sc1C)c2ccncc2 271570a_100000752145_100000765934 [0,0,0,1,0,1|1,1,0]=4 4486 B14R2.260 Cc1nc(sc1O)c2ccccc2 271570a_203496583355_100009828503 [0,0,0,1,0,1|1,0,1]=4 4487 B14R2.260 Cc1nn(cc1O)c2ccccc2 271570a_203496583355_107254826870 [0,0,0,1,0,1|2,0,0]=4 4488 B14R2.779 CC(=O)C1CC(C1)c2ccccc2 1458a_100000746226_200000210301 [0,0,0,1,0,1|0,0,2]=4 4489 B14R2.779 [13CH3]C(=O)C1CC(C1)c2ccccc2 1458a_100000746226_200025704644 [0,0,0,1,0,1|0,0,2]=4 4490 B14R2.781 C=C(C)c1cc2ccccc2cn1 271570a_100000694244_100000047361 [0,0,0,1,0,1|1,0,1]=4 4491 B14R2.781 C=C(C)c1ccc2ccccc2c1 271570a_100000694244_100000233703 [0,0,0,1,0,1|1,0,1]=4 4492 B14R2.781 C=C(C)c1ccc2ccccc2n1 271570a_100000694244_100011291633 [0,0,0,1,0,1|2,0,0]=4 4493 B14R2.781 C=C(C)c1cnc2ccccc2c1 271570a_100000694244_100000737414 [0,0,0,1,0,1|1,0,1]=4 4494 B14R2.781 C=C(C)c1cnc2ccccc2n1 271570a_100000694244_100000756483 [0,0,0,1,0,1|2,0,0]=4 4495 B14R2.781 C=C(C)c1ncc2ccccc2n1 271570a_100000694244_100000097389 [0,0,0,1,0,1|2,0,0]=4 4496 B14R2.781 CC(=O)C1=Cc2ccccc2OC1 1458a_100000018039_200000210301 [0,0,0,1,0,1|0,0,2]=4 4497 B14R2.781 CC(=O)C1CCc2ccccc2C1 1458a_100011217706_200000210301 [0,0,0,1,0,1|0,0,2]=4 4498 B14R2.781 CC(=O)C1COc2ccccc2C1 1458a_100000203760_200000210301 [0,0,0,1,0,1|0,0,2]=4 4499 B14R2.781 CC(=O)C1Cc2ccccc2CO1 1458a_100009880028_200000210301 [0,0,0,1,0,1|0,0,2]=4 4500 B14R2.781 CC(=O)N1CCc2ccccc2C1 11a_100000188457_100015343762 [0,0,0,1,0,1|1,0,1]=4 4501 B14R2.781 CC(=O)N1CCc2ccccc2C1 1626a_100000188457_100015343762 [0,0,0,1,0,1|1,0,1]=4 4502 B14R2.781 CC(=O)N1CCc2ccccc2C1 240690a_100000188457_100015343762 [0,0,0,1,0,1|1,0,1]=4 4503 B14R2.781 CC(=O)N1CCc2ccccc2C1 527a_100000188457_100103153847 [0,0,0,1,0,1|1,0,1]=4 4504 B14R2.781 CC(=O)c1ccc2ccccc2c1 1458a_100000210637_200000210301 [0,0,0,1,0,1|0,0,1]=3 4505 B14R2.781 CC(=O)c1ccc2cccnc2c1 1458a_100011933907_200000210301 [0,0,0,1,0,1|1,0,1]=4 4506 B14R2.781 CC(=O)c1ccc2ccncc2c1 1458a_100000070124_200000210301 [0,0,0,1,0,1|1,0,1]=4 4507 B14R2.781 CC(=O)c1ccc2cnccc2c1 1458a_100011935275_200000210301 [0,0,0,1,0,1|1,0,1]=4 4508 B14R2.781 CC(=O)c1ccc2ncccc2c1 1458a_100011216044_200000210301 [0,0,0,1,0,1|1,0,1]=4 4509 B14R2.781 [13CH3]C(=O)C1=Cc2ccccc2OC1 1458a_100000018039_200025704644 [0,0,0,1,0,1|0,0,2]=4 4510 B14R2.781 [13CH3]C(=O)C1CCc2ccccc2C1 1458a_100011217706_200025704644 [0,0,0,1,0,1|0,0,2]=4 4511 B14R2.781 [13CH3]C(=O)C1COc2ccccc2C1 1458a_100000203760_200025704644 [0,0,0,1,0,1|0,0,2]=4 4512 B14R2.781 [13CH3]C(=O)C1Cc2ccccc2CO1 1458a_100009880028_200025704644 [0,0,0,1,0,1|0,0,2]=4 4513 B14R2.781 [13CH3]C(=O)c1ccc2ccccc2c1 1458a_100000210637_200025704644 [0,0,0,1,0,1|0,0,1]=3 4514 B14R2.781 [13CH3]C(=O)c1ccc2cccnc2c1 1458a_100011933907_200025704644 [0,0,0,1,0,1|1,0,1]=4 4515 B14R2.781 [13CH3]C(=O)c1ccc2ccncc2c1 1458a_100000070124_200025704644 [0,0,0,1,0,1|1,0,1]=4 4516 B14R2.781 [13CH3]C(=O)c1ccc2cnccc2c1 1458a_100011935275_200025704644 [0,0,0,1,0,1|1,0,1]=4 4517 B14R2.781 [13CH3]C(=O)c1ccc2ncccc2c1 1458a_100011216044_200025704644 [0,0,0,1,0,1|1,0,1]=4 4518 B14R2.946 Cc1ccc(cc1)NC2CCC2=O 34a_100000124888_100009892977 [0,1,0,1,0,0|1,0,1]=4 4519 B14R2.946 Cc1ccc(cc1)OC2CCC2=O 34a_100000210336_100009892977 [0,1,0,1,0,0|1,0,1]=4 4520 B14R2.946 Cc1ccc(cc1)OC2CCC2=O 7a_100000210336_100009892977 [0,1,0,1,0,0|1,0,1]=4 4521 B14R2.946 Cc1ccc(cc1)SC2CCC2=O 62a_100000186775_100009892977 [0,1,0,1,0,0|1,0,1]=4 4522 B14R2.946 Cc1ccc(cc1)SC2CCC2=O 62a_100009892977_100000186775 [0,1,0,1,0,0|1,0,1]=4 4523 B14R2.946 Nc1ccc(cc1)OC2CCC2=O 34a_100000185829_100009892977 [0,1,0,1,0,0|1,0,1]=4 4524 B14R2.946 Nc1ccc(cc1)SC2CCC2=O 62a_100000185761_100009892977 [0,1,0,1,0,0|1,0,1]=4 4525 B14R2.946 Nc1ccc(cc1)SC2CCC2=O 62a_100009892977_100000185761 [0,1,0,1,0,0|1,0,1]=4 4526 B14R2.946 O=C1CCC1Nc2ccc(cc2)Br 34a_100000210018_100009892977 [0,1,0,1,0,0|1,0,1]=4 4527 B14R2.946 O=C1CCC1Nc2ccc(cc2)Cl 34a_100000210052_100009892977 [0,1,0,1,0,0|1,0,1]=4 4528 B14R2.946 O=C1CCC1Nc2ccc(cc2)F 34a_100000185862_100009892977 [0,1,0,1,0,0|1,0,1]=4 4529 B14R2.946 O=C1CCC1Nc2ccc(cc2)I 34a_100000185761_100009892977 [0,1,0,1,0,0|1,0,1]=4 4530 B14R2.946 O=C1CCC1Nc2ccc(cc2)O 34a_100000185829_100009892977 [0,1,0,1,0,0|1,0,1]=4 4531 B14R2.946 O=C1CCC1Oc2ccc(cc2)Br 34a_100000185759_100009892977 [0,1,0,1,0,0|1,0,1]=4 4532 B14R2.946 O=C1CCC1Oc2ccc(cc2)Br 7a_100000185759_100009892977 [0,1,0,1,0,0|1,0,1]=4 4533 B14R2.946 O=C1CCC1Oc2ccc(cc2)Cl 34a_100000210216_100009892977 [0,1,0,1,0,0|1,0,1]=4 4534 B14R2.946 O=C1CCC1Oc2ccc(cc2)Cl 7a_100000210216_100009892977 [0,1,0,1,0,0|1,0,1]=4 4535 B14R2.946 O=C1CCC1Oc2ccc(cc2)F 34a_100000210339_100009892977 [0,1,0,1,0,0|1,0,1]=4 4536 B14R2.946 O=C1CCC1Oc2ccc(cc2)I 34a_100000212066_100009892977 [0,1,0,1,0,0|1,0,1]=4 4537 B14R2.946 O=C1CCC1Oc2ccc(cc2)I 7a_100000212066_100009892977 [0,1,0,1,0,0|1,0,1]=4 4538 B14R2.946 O=C1CCC1Sc2ccc(cc2)Br 62a_100000752885_100009892977 [0,1,0,1,0,0|1,0,1]=4 4539 B14R2.946 O=C1CCC1Sc2ccc(cc2)Br 62a_100009892977_100000752885 [0,1,0,1,0,0|1,0,1]=4 4540 B14R2.946 O=C1CCC1Sc2ccc(cc2)Cl 62a_100000755918_100009892977 [0,1,0,1,0,0|1,0,1]=4 4541 B14R2.946 O=C1CCC1Sc2ccc(cc2)Cl 62a_100009892977_100000755918 [0,1,0,1,0,0|1,0,1]=4 4542 B14R2.946 O=C1CCC1Sc2ccc(cc2)F 62a_100000211213_100009892977 [0,1,0,1,0,0|1,0,1]=4 4543 B14R2.946 O=C1CCC1Sc2ccc(cc2)F 62a_100009892977_100000211213 [0,1,0,1,0,0|1,0,1]=4 4544 B14R2.946 O=C1CCC1Sc2ccc(cc2)O 62a_100009892977_100000185759 [0,1,0,1,0,0|1,0,1]=4 4545 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)Cl 1458a_100000235803_200000210301 [0,1,0,1,0,0|0,0,2]=4 4546 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)F 1458a_200015190327_200000210301 [0,1,0,1,0,0|0,0,2]=4 4547 B14R2.4402 CC(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br 1458a_100010113649_200000210301 [0,1,0,1,0,0|0,0,2]=4 4548 B14R2.4402 [13CH3]C(=O)C1CC1c2ccc(cc2)Cl 1458a_100000235803_200025704644 [0,1,0,1,0,0|0,0,2]=4 4549 B14R2.4402 [13CH3]C(=O)C1CC1c2ccc(cc2)F 1458a_200015190327_200025704644 [0,1,0,1,0,0|0,0,2]=4 4550 B14R2.4402 [13CH3]C(=O)[C@@H]1C[C@H]1c2ccc(cc2)Br 1458a_100010113649_200025704644 [0,1,0,1,0,0|0,0,2]=4 4551 B14R2.4529 C=C(C)c1cc2cc(ccc2[nH]1)Br 271570a_100000694244_100011012855 [0,1,0,1,0,0|2,0,0]=4 4552 B14R2.4529 C=C(C)c1cc2cc(ccc2s1)Br 271570a_100000694244_200010198765 [0,1,0,1,0,0|2,0,0]=4 4553 B14R2.4529 CC(=O)C1Cc2cc(ccc2O1)O 1458a_200009830173_200000210301 [0,1,0,1,0,0|1,0,1]=4 4554 B14R2.4529 CC(=O)C1Cc2ccc(cc2O1)C 1458a_100009922052_200000210301 [0,1,0,1,0,0|1,0,1]=4 4555 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Br 11a_100000702344_100015343762 [0,1,0,1,0,0|1,0,1]=4 4556 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Br 1626a_100000702344_100015343762 [0,1,0,1,0,0|1,0,1]=4 4557 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Br 240690a_100000702344_100015343762 [0,1,0,1,0,0|1,0,1]=4 4558 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Br 527a_100000702344_100103153847 [0,1,0,1,0,0|1,0,1]=4 4559 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Cl 11a_100015205306_100015343762 [0,1,0,1,0,0|1,0,1]=4 4560 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Cl 1626a_100015205306_100015343762 [0,1,0,1,0,0|1,0,1]=4 4561 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Cl 240690a_100015205306_100015343762 [0,1,0,1,0,0|1,0,1]=4 4562 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)Cl 527a_100015205306_100103153847 [0,1,0,1,0,0|1,0,1]=4 4563 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)F 11a_100000766377_100015343762 [0,1,0,1,0,0|1,0,1]=4 4564 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)F 1626a_100000766377_100015343762 [0,1,0,1,0,0|1,0,1]=4 4565 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)F 240690a_100000766377_100015343762 [0,1,0,1,0,0|1,0,1]=4 4566 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)F 527a_100000766377_100103153847 [0,1,0,1,0,0|1,0,1]=4 4567 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)O 240690a_100015195982_100015343762 [0,1,0,1,0,0|1,0,1]=4 4568 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)O 271570a_203496583355_200015237658 [0,1,0,1,0,0|1,0,1]=4 4569 B14R2.4529 CC(=O)N1Cc2ccc(cc2C1)O 527a_100015195982_100103153847 [0,1,0,1,0,0|1,0,1]=4 4570 B14R2.4529 CC(=O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000181247 [0,1,0,1,0,0|1,0,0]=3 4571 B14R2.4529 CC(=O)c1nc2ccc(cc2[nH]1)O 271570a_203496583355_200011795181 [0,1,0,1,0,0|2,0,0]=4 4572 B14R2.4529 CC(=O)n1cc2cc(ccc2n1)O 271570a_203496583355_100010240164 [0,1,0,1,0,0|2,0,0]=4 4573 B14R2.4529 CC(=O)n1cc2ccc(cc2n1)O 271570a_203496583355_100010184422 [0,1,0,1,0,0|2,0,0]=4 4574 B14R2.4529 Cc1ccc2c(c1)OC(C2)C(=O)[13CH3] 1458a_100009922052_200025704644 [0,1,0,1,0,0|1,0,1]=4 4575 B14R2.4529 NC(=O)c1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009814496 [0,1,0,1,0,0|2,0,0]=4 4576 B14R2.4529 NC(=O)c1cc2cc(ccc2o1)O 271570a_203496583355_100000185017 [0,1,0,1,0,0|2,0,0]=4 4577 B14R2.4529 NC(=O)c1cc2ccc(cc2[nH]1)O 271570a_203496583355_100009814495 [0,1,0,1,0,0|2,0,0]=4 4578 B14R2.4529 [13CH3]C(=O)C1Cc2cc(ccc2O1)O 1458a_200009830173_200025704644 [0,1,0,1,0,0|1,0,1]=4 4579 B14R2.8239 Cc1cc2cc(ccc2nc1N)O 271570a_203496583355_100011830096 [0,1,0,1,0,0|2,0,0]=4 4580 B14R2.30 O=C1CCCC1Nc2ccccc2 34a_100000106764_100000709159 [0,1,0,1,0,0|1,0,1]=4 4581 B14R2.30 O=C1CCCC1Oc2ccccc2 34a_100000210340_100000709159 [0,1,0,1,0,0|1,0,1]=4 4582 B14R2.30 O=C1CCCC1Oc2ccccc2 7a_100000210340_100000211823 [0,1,0,1,0,0|1,0,1]=4 4583 B14R2.30 O=C1CCCC1Sc2ccccc2 62a_100000211823_100000041952 [0,1,0,1,0,0|1,0,1]=4 4584 B14R2.30 O=C1CCCC1Sc2ccccc2 62a_100000719477_100000211823 [0,1,0,1,0,0|1,0,1]=4 4585 B14R2.30 O=C1OCCC1Nc2ccccc2 34a_100000106764_100000211211 [0,1,0,1,0,0|1,0,1]=4 4586 B14R2.30 O=C1OCCC1Oc2ccccc2 34a_100000210340_100000211211 [0,1,0,1,0,0|1,0,1]=4 4587 B14R2.30 O=C1OCCC1Oc2ccccc2 7a_100000210340_100000211211 [0,1,0,1,0,0|1,0,1]=4 4588 B14R2.30 O=C1OCCC1Sc2ccccc2 62a_100000211211_100000041952 [0,1,0,1,0,0|1,0,1]=4 4589 B14R2.30 O=C1OCCC1Sc2ccccc2 62a_100000719477_100000211211 [0,1,0,1,0,0|1,0,1]=4 4590 B14R2.958 CCC(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_100000210202 [0,1,0,1,0,0|0,0,2]=4 4591 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 11a_106832991635_100009815801 [0,1,0,1,0,0|0,0,2]=4 4592 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 240690a_100102657272_100009815801 [0,1,0,1,0,0|0,0,2]=4 4593 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 527a_100102657272_100009815801 [0,1,0,1,0,0|0,0,2]=4 4594 B14R2.958 O=C(CF)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_100015361967 [0,1,0,1,0,0|0,0,2]=4 4595 B14R2.972 CCC(=O)C1=Cc2ccccc2C1 1458a_100009862756_100000210202 [0,1,0,1,0,0|0,0,0]=2 4596 B14R2.972 CCC(=O)C1Cc2ccccc2C1 1458a_100000210414_100000753484 [0,1,0,1,0,0|0,0,2]=4 4597 B14R2.972 CCC(=O)C1Cc2ccccc2C1 1458a_100000685393_100000210202 [0,1,0,1,0,0|0,0,2]=4 4598 B14R2.972 CCC(=O)C1Cc2ccccc2O1 1458a_100000209886_100000210202 [0,1,0,1,0,0|1,0,1]=4 4599 B14R2.972 CCC(=O)C1Cc2ccccc2S1 1458a_100000024912_100000210202 [0,1,0,1,0,0|1,0,1]=4 4600 B14R2.972 CCC(=O)N1Cc2ccccc2C1 11a_100000752595_100000210414 [0,1,0,1,0,0|1,0,1]=4 4601 B14R2.972 CCC(=O)N1Cc2ccccc2C1 1626a_100000752595_100000210414 [0,1,0,1,0,0|1,0,1]=4 4602 B14R2.972 CCC(=O)N1Cc2ccccc2C1 240690a_100000752595_100000210414 [0,1,0,1,0,0|1,0,1]=4 4603 B14R2.972 CCC(=O)N1Cc2ccccc2C1 527a_100000752595_100000210414 [0,1,0,1,0,0|1,0,1]=4 4604 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 11a_106832991635_100009862756 [0,1,0,1,0,0|0,0,0]=2 4605 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 1626a_100102657272_100009862756 [0,1,0,1,0,0|0,0,0]=2 4606 B14R2.972 CNC(=O)C1=Cc2ccccc2C1 240690a_100102657272_100009862756 [0,1,0,1,0,0|0,0,0]=2 4607 B14R2.972 CNC(=O)C1Cc2ccccc2C1 11a_106832991635_100000685393 [0,1,0,1,0,0|0,0,2]=4 4608 B14R2.972 CNC(=O)C1Cc2ccccc2C1 1626a_100102657272_100000685393 [0,1,0,1,0,0|0,0,2]=4 4609 B14R2.972 CNC(=O)C1Cc2ccccc2C1 240690a_100102657272_100000685393 [0,1,0,1,0,0|0,0,2]=4 4610 B14R2.972 CNC(=O)C1Cc2ccccc2C1 527a_100102657272_100000685393 [0,1,0,1,0,0|0,0,2]=4 4611 B14R2.972 CNC(=O)C1Cc2ccccc2O1 11a_106832991635_100000209886 [0,1,0,1,0,0|1,0,1]=4 4612 B14R2.972 CNC(=O)C1Cc2ccccc2O1 1626a_100102657272_100000209886 [0,1,0,1,0,0|1,0,1]=4 4613 B14R2.972 CNC(=O)C1Cc2ccccc2O1 240690a_100102657272_100000209886 [0,1,0,1,0,0|1,0,1]=4 4614 B14R2.972 CNC(=O)C1Cc2ccccc2O1 527a_100102657272_100000209886 [0,1,0,1,0,0|1,0,1]=4 4615 B14R2.972 CNC(=O)C1Cc2ccccc2S1 11a_106832991635_100000024912 [0,1,0,1,0,0|1,0,1]=4 4616 B14R2.972 CNC(=O)C1Cc2ccccc2S1 1626a_100102657272_100000024912 [0,1,0,1,0,0|1,0,1]=4 4617 B14R2.972 CNC(=O)C1Cc2ccccc2S1 240690a_100102657272_100000024912 [0,1,0,1,0,0|1,0,1]=4 4618 B14R2.972 CNC(=O)C1Cc2ccccc2S1 527a_100102657272_100000024912 [0,1,0,1,0,0|1,0,1]=4 4619 B14R2.972 CNC(=O)N1Cc2ccccc2C1 2708a_100102657272_100000752595 [0,1,0,1,0,0|1,0,1]=4 4620 B14R2.972 CNC(=O)N1Cc2ccccc2C1 273464a_100102657272_100000752595 [0,1,0,1,0,0|1,0,1]=4 4621 B14R2.972 O=C(CF)C1=Cc2ccccc2C1 1458a_100009862756_100015361967 [0,1,0,1,0,0|0,0,0]=2 4622 B14R2.972 O=C(CF)C1Cc2ccccc2C1 1458a_100000685393_100015361967 [0,1,0,1,0,0|0,0,2]=4 4623 B14R2.972 O=C(CF)C1Cc2ccccc2O1 1458a_100000209886_100015361967 [0,1,0,1,0,0|1,0,1]=4 4624 B14R2.972 O=C(CF)C1Cc2ccccc2S1 1458a_100000024912_100015361967 [0,1,0,1,0,0|1,0,1]=4 4625 B14R2.972 O=C(CO)C1Cc2ccccc2C1 1458a_100000210174_100000753484 [0,1,0,1,0,0|0,0,2]=4 4626 B14R2.972 O=C(CO)N1Cc2ccccc2C1 240690a_100000752595_100000210174 [0,1,0,1,0,0|1,0,1]=4 4627 B14R2.972 O=C(CO)N1Cc2ccccc2C1 527a_100000752595_100000210174 [0,1,0,1,0,0|1,0,1]=4 4628 B14R2.1128 C=Cc1cc2ccccc2oc1=O 271570a_100011290941_200000187772 [0,1,0,1,0,0|1,0,1]=4 4629 B14R2.1128 C=Cc1nc2ccccc2cc1C 271570a_100011290941_100000751756 [0,1,0,1,0,0|1,0,1]=4 4630 B14R2.1128 CCc1cc2ccccc2nc1O 271570a_203496583355_100011829826 [0,1,0,1,0,0|1,0,1]=4 4631 B14R2.1128 CNc1cc2ccccc2cc1Br 34a_100009991566_200000210301 [0,1,0,1,0,0|1,0,1]=4 4632 B14R2.1128 CNc1cc2ccccc2cc1Br 7a_100009991566_200000210301 [0,1,0,1,0,0|1,0,1]=4 4633 B14R2.1128 CNc1nc2ccccc2cc1C 27a_100102657272_100000751756 [0,1,0,1,0,0|1,0,0]=3 4634 B14R2.1128 CNc1nc2ccccc2nc1C 27a_100102657272_100000185947 [0,1,0,1,0,0|2,0,0]=4 4635 B14R2.1128 CNc1nc2ncccc2cc1C 27a_100102657272_100009877248 [0,1,0,1,0,0|2,0,0]=4 4636 B14R2.1128 COc1cc2ccccc2cc1Br 34a_100009817189_200000210301 [0,1,0,1,0,0|1,0,1]=4 4637 B14R2.1128 COc1cc2ccccc2cc1Br 7a_100009817189_200000210301 [0,1,0,1,0,0|1,0,1]=4 4638 B14R2.1128 COc1cc2ccccc2cc1C 34a_100000091601_200000210301 [0,1,0,1,0,0|1,0,0]=3 4639 B14R2.1128 COc1cc2ccccc2cc1C 7a_100000091601_200000210301 [0,1,0,1,0,0|1,0,0]=3 4640 B14R2.1128 COc1cc2ccccc2cc1N 34a_106744474703_200000210301 [0,1,0,1,0,0|1,0,1]=4 4641 B14R2.1128 COc1cc2ccccc2cc1N 7a_106744474703_200000210301 [0,1,0,1,0,0|1,0,1]=4 4642 B14R2.1128 COc1cc2ccccc2cc1O 271570a_203496583355_100009817100 [0,1,0,1,0,0|0,0,2]=4 4643 B14R2.1128 COc1cc2ccccc2nc1C 34a_200000079175_200000210301 [0,1,0,1,0,0|1,0,0]=3 4644 B14R2.1128 COc1cc2ccccc2nc1C 7a_200000079175_200000210301 [0,1,0,1,0,0|1,0,0]=3 4645 B14R2.1128 COc1cc2ccccc2nc1Cl 34a_200000100762_200000210301 [0,1,0,1,0,0|2,0,0]=4 4646 B14R2.1128 COc1cc2ccccc2nc1Cl 7a_200000100762_200000210301 [0,1,0,1,0,0|2,0,0]=4 4647 B14R2.1128 COc1cc2ccccc2oc1=O 7a_100000061252_200000210301 [0,1,0,1,0,0|1,0,0]=3 4648 B14R2.1128 COc1nc2ccccc2cc1O 271570a_203496583355_100009820890 [0,1,0,1,0,0|2,0,0]=4 4649 B14R2.1128 CSc1cc2ccccc2cc1Br 62a_200000210301_200010169544 [0,1,0,1,0,0|1,0,1]=4 4650 B14R2.1128 CSc1cc2ccccc2cc1Br 62a_200010169544_200000210301 [0,1,0,1,0,0|1,0,1]=4 4651 B14R2.1128 CSc1cc2ccccc2cc1Cl 62a_100010152806_200000210301 [0,1,0,1,0,0|1,0,1]=4 4652 B14R2.1128 CSc1cc2ccccc2cc1Cl 62a_200000210301_100010152806 [0,1,0,1,0,0|1,0,1]=4 4653 B14R2.1128 CSc1cc2ccccc2cc1N 62a_100009991566_200000210301 [0,1,0,1,0,0|1,0,1]=4 4654 B14R2.1128 CSc1cc2ccccc2cc1N 62a_200000210301_100009991566 [0,1,0,1,0,0|1,0,1]=4 4655 B14R2.1128 CSc1cc2ccccc2cc1O 62a_200000210301_100009817189 [0,1,0,1,0,0|0,0,2]=4 4656 B14R2.1128 CSc1cc2ccccc2nc1Cl 62a_200000210301_100010220712 [0,1,0,1,0,0|2,0,0]=4 4657 B14R2.1128 CSc1cc2ccccc2nc1F 62a_100011158909_200000210301 [0,1,0,1,0,0|2,0,0]=4 4658 B14R2.1128 CSc1cc2ccccc2nc1F 62a_200000210301_100011158909 [0,1,0,1,0,0|2,0,0]=4 4659 B14R2.1128 CSc1cc2ccccc2nc1N 62a_100010135404_200000210301 [0,1,0,1,0,0|2,0,0]=4 4660 B14R2.1128 CSc1cc2ccccc2nc1O 62a_200000210301_200009820883 [0,1,0,1,0,0|1,0,1]=4 4661 B14R2.1128 CSc1cc2ccccc2oc1=O 62a_200000210301_200000187772 [0,1,0,1,0,0|1,0,0]=3 4662 B14R2.1128 CSc1cc2cccnc2cc1C 62a_100010137429_200000210301 [0,1,0,1,0,0|2,0,0]=4 4663 B14R2.1128 CSc1cc2cccnc2cc1C 62a_200000210301_100010137429 [0,1,0,1,0,0|2,0,0]=4 4664 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_100010072790_200000210301 [0,1,0,1,0,0|2,0,0]=4 4665 B14R2.1128 CSc1nc2ccccc2cc1Br 62a_200000210301_100010072790 [0,1,0,1,0,0|2,0,0]=4 4666 B14R2.1128 CSc1nc2ccccc2cc1C 62a_200000210301_100000751756 [0,1,0,1,0,0|1,0,0]=3 4667 B14R2.1128 CSc1nc2ccccc2cc1O 62a_200000210301_200000100762 [0,1,0,1,0,0|2,0,0]=4 4668 B14R2.1128 CSc1nc2ccccc2nc1C 62a_100000757254_200000210301 [0,1,0,1,0,0|2,0,0]=4 4669 B14R2.1128 CSc1nc2ccccc2nc1C 62a_200000210301_100000185947 [0,1,0,1,0,0|2,0,0]=4 4670 B14R2.1128 CSc1nc2ncccc2cc1C 62a_200000210301_100009877248 [0,1,0,1,0,0|2,0,0]=4 4671 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 34a_100000091601_200025704644 [0,1,0,1,0,0|1,0,0]=3 4672 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 7a_100000091601_200025704644 [0,1,0,1,0,0|1,0,0]=3 4673 B14R2.1128 Cc1cc2ccccc2nc1S[13CH3] 62a_200025704644_100000751756 [0,1,0,1,0,0|1,0,0]=3 4674 B14R2.1128 Cc1cc2cccnc2nc1S[13CH3] 62a_200025704644_100009877248 [0,1,0,1,0,0|2,0,0]=4 4675 B14R2.1128 Cc1cc2ncccc2cc1S[13CH3] 62a_100010137429_200025704644 [0,1,0,1,0,0|2,0,0]=4 4676 B14R2.1128 Cc1cc2ncccc2cc1S[13CH3] 62a_200025704644_100010137429 [0,1,0,1,0,0|2,0,0]=4 4677 B14R2.1128 Cc1nc2ccccc2cc1O[13CH3] 34a_200000079175_200025704644 [0,1,0,1,0,0|1,0,0]=3 4678 B14R2.1128 Cc1nc2ccccc2cc1O[13CH3] 7a_200000079175_200025704644 [0,1,0,1,0,0|1,0,0]=3 4679 B14R2.1128 Cc1nc2ccccc2nc1S[13CH3] 62a_100000757254_200025704644 [0,1,0,1,0,0|2,0,0]=4 4680 B14R2.1128 Cc1nc2ccccc2nc1S[13CH3] 62a_200025704644_100000185947 [0,1,0,1,0,0|2,0,0]=4 4681 B14R2.1128 OCc1cc2ccccc2nc1O 271570a_203496583355_100000754719 [0,1,0,1,0,0|1,0,1]=4 4682 B14R2.1128 [13CH3]Nc1cc2ccccc2cc1Br 34a_100009991566_200025704644 [0,1,0,1,0,0|1,0,1]=4 4683 B14R2.1128 [13CH3]Nc1cc2ccccc2cc1Br 7a_100009991566_200025704644 [0,1,0,1,0,0|1,0,1]=4 4684 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 34a_100009817189_200025704644 [0,1,0,1,0,0|1,0,1]=4 4685 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 7a_100009817189_200025704644 [0,1,0,1,0,0|1,0,1]=4 4686 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 34a_106744474703_200025704644 [0,1,0,1,0,0|1,0,1]=4 4687 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 7a_106744474703_200025704644 [0,1,0,1,0,0|1,0,1]=4 4688 B14R2.1128 [13CH3]Oc1cc2ccccc2nc1Cl 34a_200000100762_200025704644 [0,1,0,1,0,0|2,0,0]=4 4689 B14R2.1128 [13CH3]Oc1cc2ccccc2nc1Cl 7a_200000100762_200025704644 [0,1,0,1,0,0|2,0,0]=4 4690 B14R2.1128 [13CH3]Oc1cc2ccccc2oc1=O 7a_100000061252_200025704644 [0,1,0,1,0,0|1,0,0]=3 4691 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Br 62a_200010169544_200025704644 [0,1,0,1,0,0|1,0,1]=4 4692 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Br 62a_200025704644_200010169544 [0,1,0,1,0,0|1,0,1]=4 4693 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Cl 62a_100010152806_200025704644 [0,1,0,1,0,0|1,0,1]=4 4694 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1Cl 62a_200025704644_100010152806 [0,1,0,1,0,0|1,0,1]=4 4695 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1N 62a_100009991566_200025704644 [0,1,0,1,0,0|1,0,1]=4 4696 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1N 62a_200025704644_100009991566 [0,1,0,1,0,0|1,0,1]=4 4697 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1O 62a_200025704644_100009817189 [0,1,0,1,0,0|0,0,2]=4 4698 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1Cl 62a_200025704644_100010220712 [0,1,0,1,0,0|2,0,0]=4 4699 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1F 62a_100011158909_200025704644 [0,1,0,1,0,0|2,0,0]=4 4700 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1F 62a_200025704644_100011158909 [0,1,0,1,0,0|2,0,0]=4 4701 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1N 62a_100010135404_200025704644 [0,1,0,1,0,0|2,0,0]=4 4702 B14R2.1128 [13CH3]Sc1cc2ccccc2nc1O 62a_200025704644_200009820883 [0,1,0,1,0,0|1,0,1]=4 4703 B14R2.1128 [13CH3]Sc1cc2ccccc2oc1=O 62a_200025704644_200000187772 [0,1,0,1,0,0|1,0,0]=3 4704 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_100010072790_200025704644 [0,1,0,1,0,0|2,0,0]=4 4705 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1Br 62a_200025704644_100010072790 [0,1,0,1,0,0|2,0,0]=4 4706 B14R2.1128 [13CH3]Sc1nc2ccccc2cc1O 62a_200025704644_200000100762 [0,1,0,1,0,0|2,0,0]=4 4707 B14R2.4514 Cc1[nH]nc(c1C)c2ccccc2 271570a_100011218836_100015309786 [0,1,0,1,0,0|1,0,0]=3 4708 B14R2.4514 Cc1[nH]nc(c1C)c2ccccn2 271570a_100011264011_100015309786 [0,1,0,1,0,0|2,0,0]=4 4709 B14R2.4514 Cc1[nH]nc(c1C)c2cccnc2 271570a_100000757648_100015309786 [0,1,0,1,0,0|2,0,0]=4 4710 B14R2.4514 Cc1[nH]nc(c1C)c2ccncc2 271570a_100000752145_100015309786 [0,1,0,1,0,0|2,0,0]=4 4711 B14R2.4514 Cc1c(cnn1C)c2ccccc2 271570a_100011218836_100000722751 [0,1,0,1,0,0|2,0,0]=4 4712 B14R2.4514 Cc1c(cnn1C)c2ccccc2 271570a_100011935085_100000210277 [0,1,0,1,0,0|2,0,0]=4 4713 B14R2.4514 Cc1cnc(n1C)c2ccccc2 271570a_100011218836_100009816807 [0,1,0,1,0,0|2,0,0]=4 4714 B14R2.4514 Cc1n[nH]c(c1O)c2ccccc2 271570a_203496583355_200009816416 [0,1,0,1,0,0|2,0,0]=4 4715 B14R2.4514 Cc1ncc(n1C)c2ccccc2 271570a_100011218836_100000762843 [0,1,0,1,0,0|2,0,0]=4 4716 B14R2.4514 Cc1onc(c1O)c2ccccc2 271570a_203496583355_100000041977 [0,1,0,1,0,0|1,0,1]=4 4717 B14R2.4514 Cc1scc(c1C)c2ccccc2 271570a_100011218836_100009820295 [0,1,0,1,0,0|0,1,0]=3 4718 B14R2.4514 Cc1scc(c1C)c2ccccn2 271570a_100011264011_100009820295 [0,1,0,1,0,0|1,1,0]=4 4719 B14R2.4514 Cc1scc(c1C)c2cccnc2 271570a_100000757648_100009820295 [0,1,0,1,0,0|1,1,0]=4 4720 B14R2.4514 Cc1scc(c1C)c2ccncc2 271570a_100000752145_100009820295 [0,1,0,1,0,0|1,1,0]=4 4721 B14R2.270 Cc1cccc(c1)NC2CCC2=O 34a_100000188690_100009892977 [0,1,0,1,0,0|1,0,1]=4 4722 B14R2.270 Cc1cccc(c1)OC2CCC2=O 34a_100000210337_100009892977 [0,1,0,1,0,0|1,0,1]=4 4723 B14R2.270 Cc1cccc(c1)OC2CCC2=O 7a_100000210337_100009892977 [0,1,0,1,0,0|1,0,1]=4 4724 B14R2.270 Cc1cccc(c1)SC2CCC2=O 62a_100009892977_100011215228 [0,1,0,1,0,0|1,0,1]=4 4725 B14R2.270 Cc1cccc(c1)SC2CCC2=O 62a_100011215228_100009892977 [0,1,0,1,0,0|1,0,1]=4 4726 B14R2.270 Nc1cccc(c1)OC2CCC2=O 34a_100000210217_100009892977 [0,1,0,1,0,0|1,0,1]=4 4727 B14R2.270 Nc1cccc(c1)SC2CCC2=O 62a_100000210019_100009892977 [0,1,0,1,0,0|1,0,1]=4 4728 B14R2.270 Nc1cccc(c1)SC2CCC2=O 62a_100009892977_100000210019 [0,1,0,1,0,0|1,0,1]=4 4729 B14R2.270 O=C1CCC1Nc2cccc(c2)Br 34a_100000210019_100009892977 [0,1,0,1,0,0|1,0,1]=4 4730 B14R2.270 O=C1CCC1Nc2cccc(c2)Cl 34a_100000185859_100009892977 [0,1,0,1,0,0|1,0,1]=4 4731 B14R2.270 O=C1CCC1Nc2cccc(c2)F 34a_100000210047_100009892977 [0,1,0,1,0,0|1,0,1]=4 4732 B14R2.270 O=C1CCC1Nc2cccc(c2)I 34a_100000211102_100009892977 [0,1,0,1,0,0|1,0,1]=4 4733 B14R2.270 O=C1CCC1Nc2cccc(c2)O 34a_100000210217_100009892977 [0,1,0,1,0,0|1,0,1]=4 4734 B14R2.270 O=C1CCC1Oc2cccc(c2)Br 34a_100000210342_100009892977 [0,1,0,1,0,0|1,0,1]=4 4735 B14R2.270 O=C1CCC1Oc2cccc(c2)Br 7a_100000210342_100009892977 [0,1,0,1,0,0|1,0,1]=4 4736 B14R2.270 O=C1CCC1Oc2cccc(c2)Cl 34a_100000210295_100009892977 [0,1,0,1,0,0|1,0,1]=4 4737 B14R2.270 O=C1CCC1Oc2cccc(c2)Cl 7a_100000210295_100009892977 [0,1,0,1,0,0|1,0,1]=4 4738 B14R2.270 O=C1CCC1Oc2cccc(c2)F 34a_100000210426_100009892977 [0,1,0,1,0,0|1,0,1]=4 4739 B14R2.270 O=C1CCC1Oc2cccc(c2)F 7a_100000210426_100009892977 [0,1,0,1,0,0|1,0,1]=4 4740 B14R2.270 O=C1CCC1Oc2cccc(c2)I 34a_100000211634_100009892977 [0,1,0,1,0,0|1,0,1]=4 4741 B14R2.270 O=C1CCC1Oc2cccc(c2)I 7a_100000211634_100009892977 [0,1,0,1,0,0|1,0,1]=4 4742 B14R2.270 O=C1CCC1Sc2cccc(c2)Br 62a_100000691529_100009892977 [0,1,0,1,0,0|1,0,1]=4 4743 B14R2.270 O=C1CCC1Sc2cccc(c2)Br 62a_100009892977_100000691529 [0,1,0,1,0,0|1,0,1]=4 4744 B14R2.270 O=C1CCC1Sc2cccc(c2)Cl 62a_100000699651_100009892977 [0,1,0,1,0,0|1,0,1]=4 4745 B14R2.270 O=C1CCC1Sc2cccc(c2)Cl 62a_100009892977_100000699651 [0,1,0,1,0,0|1,0,1]=4 4746 B14R2.270 O=C1CCC1Sc2cccc(c2)F 62a_100000685547_100009892977 [0,1,0,1,0,0|1,0,1]=4 4747 B14R2.270 O=C1CCC1Sc2cccc(c2)F 62a_100009892977_100000685547 [0,1,0,1,0,0|1,0,1]=4 4748 B14R2.270 O=C1CCC1Sc2cccc(c2)O 62a_100009892977_100000211634 [0,1,0,1,0,0|1,0,1]=4 4749 B14R2.270 O=C1CCC1Sc2cccc(c2)[S] 62a_100009892977_114929384022 [0,1,0,1,0,0|1,0,1]=4 4750 B14R2.270 O=C1CCC1Sc2cccc(c2)[S] 62a_114929384022_100009892977 [0,1,0,1,0,0|1,0,1]=4 4751 B14R2.4476 CC(=O)C1CC1c2cccc(c2)Br 1458a_100000747823_200000210301 [0,1,0,1,0,0|0,0,2]=4 4752 B14R2.4476 [13CH3]C(=O)C1CC1c2cccc(c2)Br 1458a_100000747823_200025704644 [0,1,0,1,0,0|0,0,2]=4 4753 B14R2.7969 C=C(C)c1cc2cccc(c2[nH]1)Br 271570a_100000694244_100135389745 [0,1,0,1,0,0|2,0,0]=4 4754 B14R2.7969 CC(=O)C1Cc2cccc(c2C1)Br 1458a_100010332549_200000210301 [0,1,0,1,0,0|0,0,2]=4 4755 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Br 11a_100000703859_100015343762 [0,1,0,1,0,0|1,0,1]=4 4756 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Br 1626a_100000703859_100015343762 [0,1,0,1,0,0|1,0,1]=4 4757 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Br 240690a_100000703859_100015343762 [0,1,0,1,0,0|1,0,1]=4 4758 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Br 527a_100000703859_100103153847 [0,1,0,1,0,0|1,0,1]=4 4759 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)C 11a_100020635169_100015343762 [0,1,0,1,0,0|1,0,1]=4 4760 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)C 1626a_100020635169_100015343762 [0,1,0,1,0,0|1,0,1]=4 4761 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)C 240690a_100020635169_100015343762 [0,1,0,1,0,0|1,0,1]=4 4762 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)C 527a_100020635169_100103153847 [0,1,0,1,0,0|1,0,1]=4 4763 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Cl 11a_100000731892_100015343762 [0,1,0,1,0,0|1,0,1]=4 4764 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Cl 1626a_100000731892_100015343762 [0,1,0,1,0,0|1,0,1]=4 4765 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Cl 240690a_100000731892_100015343762 [0,1,0,1,0,0|1,0,1]=4 4766 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)Cl 527a_100000731892_100103153847 [0,1,0,1,0,0|1,0,1]=4 4767 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)F 11a_100000051403_100015343762 [0,1,0,1,0,0|1,0,1]=4 4768 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)F 1626a_100000051403_100015343762 [0,1,0,1,0,0|1,0,1]=4 4769 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)F 240690a_100000051403_100015343762 [0,1,0,1,0,0|1,0,1]=4 4770 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)F 527a_100000051403_100103153847 [0,1,0,1,0,0|1,0,1]=4 4771 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)O 240690a_100015191671_100015343762 [0,1,0,1,0,0|1,0,1]=4 4772 B14R2.7969 CC(=O)N1Cc2cccc(c2C1)O 527a_100015191671_100103153847 [0,1,0,1,0,0|1,0,1]=4 4773 B14R2.7969 CC(=O)c1cc2cccc(c2o1)O 271570a_203496583355_100011280056 [0,1,0,1,0,0|1,0,0]=3 4774 B14R2.7969 NC(=O)c1cc2cccc(c2s1)O 271570a_203496583355_100020879177 [0,1,0,1,0,0|2,0,0]=4 4775 B14R2.7969 [13CH3]C(=O)C1Cc2cccc(c2C1)Br 1458a_100010332549_200025704644 [0,1,0,1,0,0|0,0,2]=4 4776 B14R2.335 CN(c1ccccc1)C2CCC2=O 269982a_100000210012_100009892977 [0,1,0,1,0,0|1,0,1]=4 4777 B14R2.335 CN(c1ccccc1)C2CCC2=O 34a_100000210012_100009892977 [0,1,0,1,0,0|1,0,1]=4 4778 B14R2.335 O=C1CCC1C(=O)c2ccccc2 1458a_100000185807_100009892977 [0,1,0,1,0,0|0,0,1]=3 4779 B14R2.450 C=C(C)c1nc2ccccc2n1C 271570a_100000694244_200000239431 [0,1,0,1,0,0|2,0,0]=4 4780 B14R2.450 C=C(C)c1sc2ccccc2c1C 271570a_100000694244_200010198769 [0,1,0,1,0,0|2,0,0]=4 4781 B14R2.450 CC(=O)C1=C(c2ccccc2C1)C 1458a_200000242466_200000210301 [0,1,0,1,0,0|0,0,0]=2 4782 B14R2.450 CC(=O)C1Cc2ccccc2C1=O 1458a_100000070787_100011218503 [0,1,0,1,0,0|0,0,1]=3 4783 B14R2.450 CC1=C(Cc2c1cccc2)C(=O)[13CH3] 1458a_200000242466_200025704644 [0,1,0,1,0,0|0,0,0]=2 4784 B14R2.780 CC(=O)N1CCC1c2ccccc2 11a_100000739605_100015343762 [0,1,0,1,0,0|1,0,1]=4 4785 B14R2.780 CC(=O)N1CCC1c2ccccc2 1626a_100000739605_100015343762 [0,1,0,1,0,0|1,0,1]=4 4786 B14R2.780 CC(=O)N1CCC1c2ccccc2 240690a_100000739605_100015343762 [0,1,0,1,0,0|1,0,1]=4 4787 B14R2.780 CC(=O)N1CCC1c2ccccc2 527a_100000739605_100103153847 [0,1,0,1,0,0|1,0,1]=4 4788 B14R2.662 Cc1ccccc1NC2CCC2=O 34a_100015192222_100009892977 [0,1,0,1,0,0|1,0,1]=4 4789 B14R2.662 Cc1ccccc1OC2CCC2=O 34a_100000210338_100009892977 [0,1,0,1,0,0|1,0,1]=4 4790 B14R2.662 Cc1ccccc1OC2CCC2=O 7a_100000210338_100009892977 [0,1,0,1,0,0|1,0,1]=4 4791 B14R2.662 Cc1ccccc1SC2CCC2=O 62a_100000210755_100009892977 [0,1,0,1,0,0|1,0,1]=4 4792 B14R2.662 Cc1ccccc1SC2CCC2=O 62a_100009892977_100000210755 [0,1,0,1,0,0|1,0,1]=4 4793 B14R2.662 Nc1ccccc1OC2CCC2=O 34a_100000185747_100009892977 [0,1,0,1,0,0|1,0,1]=4 4794 B14R2.662 Nc1ccccc1OC2CCC2=O 7a_100000185747_100009892977 [0,1,0,1,0,0|1,0,1]=4 4795 B14R2.662 Nc1ccccc1SC2CCC2=O 62a_100000210017_100009892977 [0,1,0,1,0,0|1,0,1]=4 4796 B14R2.662 Nc1ccccc1SC2CCC2=O 62a_100009892977_100000210017 [0,1,0,1,0,0|1,0,1]=4 4797 B14R2.662 O=C1CCC1Nc2ccccc2Br 34a_100000210017_100009892977 [0,1,0,1,0,0|1,0,1]=4 4798 B14R2.662 O=C1CCC1Nc2ccccc2Cl 34a_100000185783_100009892977 [0,1,0,1,0,0|1,0,1]=4 4799 B14R2.662 O=C1CCC1Nc2ccccc2F 34a_100000210422_100009892977 [0,1,0,1,0,0|1,0,1]=4 4800 B14R2.662 O=C1CCC1Nc2ccccc2I 34a_100000210053_100009892977 [0,1,0,1,0,0|1,0,1]=4 4801 B14R2.662 O=C1CCC1Nc2ccccc2O 34a_100000185747_100009892977 [0,1,0,1,0,0|1,0,1]=4 4802 B14R2.662 O=C1CCC1Oc2ccccc2Br 34a_100000181306_100009892977 [0,1,0,1,0,0|1,0,1]=4 4803 B14R2.662 O=C1CCC1Oc2ccccc2Br 7a_100000181306_100009892977 [0,1,0,1,0,0|1,0,1]=4 4804 B14R2.662 O=C1CCC1Oc2ccccc2Cl 34a_100000210172_100009892977 [0,1,0,1,0,0|1,0,1]=4 4805 B14R2.662 O=C1CCC1Oc2ccccc2Cl 7a_100000210172_100009892977 [0,1,0,1,0,0|1,0,1]=4 4806 B14R2.662 O=C1CCC1Oc2ccccc2F 34a_100000210171_100009892977 [0,1,0,1,0,0|1,0,1]=4 4807 B14R2.662 O=C1CCC1Oc2ccccc2F 7a_100000210171_100009892977 [0,1,0,1,0,0|1,0,1]=4 4808 B14R2.662 O=C1CCC1Oc2ccccc2I 34a_100000739446_100009892977 [0,1,0,1,0,0|1,0,1]=4 4809 B14R2.662 O=C1CCC1Oc2ccccc2I 7a_100000739446_100009892977 [0,1,0,1,0,0|1,0,1]=4 4810 B14R2.662 O=C1CCC1Sc2ccccc2Br 62a_100000695589_100009892977 [0,1,0,1,0,0|1,0,1]=4 4811 B14R2.662 O=C1CCC1Sc2ccccc2Br 62a_100009892977_100000695589 [0,1,0,1,0,0|1,0,1]=4 4812 B14R2.662 O=C1CCC1Sc2ccccc2Cl 62a_100000764095_100009892977 [0,1,0,1,0,0|1,0,1]=4 4813 B14R2.662 O=C1CCC1Sc2ccccc2Cl 62a_100009892977_100000764095 [0,1,0,1,0,0|1,0,1]=4 4814 B14R2.662 O=C1CCC1Sc2ccccc2F 62a_100009892977_100011215700 [0,1,0,1,0,0|1,0,1]=4 4815 B14R2.662 O=C1CCC1Sc2ccccc2F 62a_100011215700_100009892977 [0,1,0,1,0,0|1,0,1]=4 4816 B14R2.662 O=C1CCC1Sc2ccccc2O 62a_100000739446_100009892977 [0,1,0,1,0,0|1,0,1]=4 4817 B14R2.662 O=C1CCC1Sc2ccccc2O 62a_100009892977_100000739446 [0,1,0,1,0,0|1,0,1]=4 4818 B14R2.5443 CC(=O)C1CC1c2ccccc2Br 1458a_100000748278_200000210301 [0,1,0,1,0,0|0,0,2]=4 4819 B14R2.5443 CC(=O)C1CC1c2ccccc2Cl 1458a_100016119764_200000210301 [0,1,0,1,0,0|0,0,2]=4 4820 B14R2.5443 [13CH3]C(=O)C1CC1c2ccccc2Br 1458a_100000748278_200025704644 [0,1,0,1,0,0|0,0,2]=4 4821 B14R2.5443 [13CH3]C(=O)C1CC1c2ccccc2Cl 1458a_100016119764_200025704644 [0,1,0,1,0,0|0,0,2]=4 4822 B14R2.788 CC(=O)C1(CC1)Sc2ccccc2 62a_100000086384_100000041952 [0,1,0,1,0,0|1,0,1]=4 4823 B14R2.788 CC(=O)C1(CC1)Sc2ccccc2 62a_100000719477_100000086384 [0,1,0,1,0,0|1,0,1]=4 4824 B10R0.81 C=CC=CC(=O)C(C)C(=O)C 1458a_100016291481_100000179758 [0,0,1,0,1,0|1,0,1]=4 4825 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [1,0,0,0,1,0|1,0,1]=4 4826 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [1,0,0,0,1,0|1,0,1]=4 4827 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [1,0,0,0,1,0|1,0,1]=4 4828 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [1,0,0,0,1,0|1,0,1]=4 4829 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [1,0,0,0,1,0|1,0,1]=4 4830 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [1,0,0,0,1,0|1,0,1]=4 4831 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [1,0,0,0,1,0|1,0,1]=4 4832 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [1,0,0,0,1,0|1,0,1]=4 4833 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [1,0,0,0,1,0|1,0,1]=4 4834 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [1,0,0,0,1,0|1,0,1]=4 4835 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [1,0,0,0,1,0|1,0,1]=4 4836 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [1,0,0,0,1,0|1,0,1]=4 4837 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [1,0,0,0,1,0|2,0,0]=4 4838 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [1,0,0,0,1,0|2,0,0]=4 4839 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [1,0,0,0,1,0|2,0,0]=4 4840 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [1,0,0,0,1,0|2,0,0]=4 4841 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [1,0,0,0,1,0|1,0,1]=4 4842 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [1,0,0,0,1,0|1,0,1]=4 4843 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [1,0,0,0,1,0|1,0,1]=4 4844 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [1,0,0,0,1,0|1,0,1]=4 4845 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [1,0,0,0,1,0|1,0,1]=4 4846 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [1,0,0,0,1,0|1,0,1]=4 4847 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [1,0,0,0,1,0|1,0,1]=4 4848 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [1,0,0,0,1,0|1,0,1]=4 4849 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [1,0,0,0,1,0|1,0,1]=4 4850 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [1,0,0,0,1,0|1,0,1]=4 4851 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [1,0,0,0,1,0|1,0,1]=4 4852 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [1,0,0,0,1,0|1,0,1]=4 4853 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [1,0,0,0,1,0|1,0,1]=4 4854 B10R1.66 CC(=O)C=Cc1c[nH]cn1 1458a_100102678534_200000210301 [1,0,0,0,1,0|2,0,0]=4 4855 B10R1.66 CC(=O)C=Cc1cccs1 1458a_100000182767_200000210301 [1,0,0,0,1,0|1,0,0]=3 4856 B10R1.66 CC(=O)C=Cc1ccoc1 1458a_100000238621_200000210301 [1,0,0,0,1,0|1,0,0]=3 4857 B10R1.66 CC(=O)C=Cc1ccsc1 1458a_100000698588_200000210301 [1,0,0,0,1,0|1,0,0]=3 4858 B10R1.66 CC(=O)C=Cc1cscn1 1458a_200000747928_200000210301 [1,0,0,0,1,0|2,0,0]=4 4859 B10R1.66 CC(=O)C=Cc1nccs1 1458a_100102558208_200000210301 [1,0,0,0,1,0|2,0,0]=4 4860 B10R1.66 [13CH3]C(=O)C=Cc1c[nH]cn1 1458a_100102678534_200025704644 [1,0,0,0,1,0|2,0,0]=4 4861 B10R1.66 [13CH3]C(=O)C=Cc1cccs1 1458a_100000182767_200025704644 [1,0,0,0,1,0|1,0,0]=3 4862 B10R1.66 [13CH3]C(=O)C=Cc1ccoc1 1458a_100000238621_200025704644 [1,0,0,0,1,0|1,0,0]=3 4863 B10R1.66 [13CH3]C(=O)C=Cc1ccsc1 1458a_100000698588_200025704644 [1,0,0,0,1,0|1,0,0]=3 4864 B10R1.66 [13CH3]C(=O)C=Cc1cscn1 1458a_200000747928_200025704644 [1,0,0,0,1,0|2,0,0]=4 4865 B10R1.66 [13CH3]C(=O)C=Cc1nccs1 1458a_100102558208_200025704644 [1,0,0,0,1,0|2,0,0]=4 4866 B10R1.23 CC(=C(C)c1ccco1)C 271570a_200000049429_100009814098 [0,0,0,0,2,0|2,0,0]=4 4867 B10R1.23 CC(=C(C)c1cccs1)C 271570a_200000049429_100011215356 [0,0,0,0,2,0|2,0,0]=4 4868 B10R1.23 CC(=C(C)c1ccoc1)C 271570a_200000049429_100011215275 [0,0,0,0,2,0|2,0,0]=4 4869 B10R1.23 CC(=C(C)c1ccsc1)C 271570a_200000049429_100000738268 [0,0,0,0,2,0|2,0,0]=4 4870 B10R1.23 CC(=O)C(C)n1cccc1 1458a_100000243804_200000210301 [0,0,0,0,2,0|1,0,1]=4 4871 B10R1.23 CC(C(=O)[13CH3])n1cccc1 1458a_100000243804_200025704644 [0,0,0,0,2,0|1,0,1]=4 4872 B12R1.252 C=C(C)C=NNc1ccccc1 4a_100015195140_100000210575 [1,0,0,0,0,1|2,0,0]=4 4873 B12R1.252 CC(=CCNc1ccccc1)C 34a_100000106764_100000761012 [1,0,0,0,0,1|1,0,1]=4 4874 B12R1.252 CC(=CCOc1ccccc1)C 34a_100000210340_100000761012 [1,0,0,0,0,1|1,0,1]=4 4875 B12R1.252 CC(=CCOc1ccccc1)C 7a_100000210340_100000761012 [1,0,0,0,0,1|1,0,1]=4 4876 B12R1.252 CC(=CCSc1ccccc1)C 62a_100000719477_100000761012 [1,0,0,0,0,1|1,0,1]=4 4877 B12R1.252 CC(=CCSc1ccccc1)C 62a_100000761012_100000041952 [1,0,0,0,0,1|1,0,1]=4 4878 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [1,0,0,0,0,1|0,0,0]=2 4879 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [1,0,0,0,0,1|0,0,0]=2 4880 B12R1.252 CC(=O)C=CSc1ccccc1 1458a_100016262050_200000210301 [1,0,0,0,0,1|0,0,0]=2 4881 B12R1.252 CC(=O)CC#Cc1ccccc1 1458a_100000070787_100011352542 [1,0,0,0,0,1|0,0,2]=4 4882 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100000070787_100000211621 [1,0,0,0,0,1|0,0,2]=4 4883 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100011207963_200000210301 [1,0,0,0,0,1|0,0,2]=4 4884 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000070787_100000184471 [1,0,0,0,0,1|0,0,2]=4 4885 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000182761_200000210301 [1,0,0,0,0,1|0,0,2]=4 4886 B12R1.252 CC(=O)CCOc1ccccc1 7a_100000210340_100000053229 [1,0,0,0,0,1|0,0,2]=4 4887 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000070787_100000246102 [1,0,0,0,0,1|0,0,2]=4 4888 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000182436_200000210301 [1,0,0,0,0,1|0,0,2]=4 4889 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000053229_100000041952 [1,0,0,0,0,1|0,0,2]=4 4890 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000719477_100000053229 [1,0,0,0,0,1|0,0,2]=4 4891 B12R1.252 CC(=O)COCc1ccccc1 1458a_100000230186_200000210301 [1,0,0,0,0,1|0,0,2]=4 4892 B12R1.252 CC(=O)COCc1ccccc1 34a_100000211253_100015291786 [1,0,0,0,0,1|0,0,2]=4 4893 B12R1.252 CC(=O)CSCc1ccccc1 1458a_100000070787_200011217039 [1,0,0,0,0,1|0,0,2]=4 4894 B12R1.252 CC(=O)CSCc1ccccc1 1458a_100000150264_200000210301 [1,0,0,0,0,1|0,0,2]=4 4895 B12R1.252 CC(=O)NCCc1ccccc1 11a_100000106460_100015343762 [1,0,0,0,0,1|0,0,2]=4 4896 B12R1.252 CC(=O)NCCc1ccccc1 1626a_100000106460_100015343762 [1,0,0,0,0,1|0,0,2]=4 4897 B12R1.252 CC(=O)NCCc1ccccc1 240690a_100000106460_100015343762 [1,0,0,0,0,1|0,0,2]=4 4898 B12R1.252 CC(=O)NCCc1ccccc1 527a_100000106460_100103153847 [1,0,0,0,0,1|0,0,2]=4 4899 B12R1.252 CC(=O)NN=Cc1ccccc1 4a_100000189765_100015611070 [1,0,0,0,0,1|1,0,0]=3 4900 B12R1.252 CC(=O)NN=Cc1ccccn1 4a_100000189765_100000209966 [1,0,0,0,0,1|2,0,0]=4 4901 B12R1.252 CC(=O)NN=Cc1cccnc1 4a_100000189765_100000209961 [1,0,0,0,0,1|2,0,0]=4 4902 B12R1.252 CC(=O)NN=Cc1ccncc1 4a_100000189765_100000186114 [1,0,0,0,0,1|2,0,0]=4 4903 B12R1.252 CC(=O)NNCc1ccccc1 22a_100000007032_100000070787 [1,0,0,0,0,1|1,0,1]=4 4904 B12R1.252 CC(=O)OCNc1ccccc1 34a_100000106764_100009813279 [1,0,0,0,0,1|1,0,1]=4 4905 B12R1.252 CC(=O)OCOc1ccccc1 34a_100000210340_100009813279 [1,0,0,0,0,1|1,0,1]=4 4906 B12R1.252 CC(=O)OCSc1ccccc1 62a_100000076356_100000041952 [1,0,0,0,0,1|1,0,1]=4 4907 B12R1.252 CC(=O)OCSc1ccccc1 62a_100000719477_100000076356 [1,0,0,0,0,1|1,0,1]=4 4908 B12R1.252 CC(C)CC=Cc1ccccc1 271570a_100016259101_100000210277 [1,0,0,0,0,1|1,0,1]=4 4909 B12R1.252 CN(C)C/C=C/c1ccccc1 2230a_100102631434_100016265936 [1,0,0,0,0,1|2,0,0]=4 4910 B12R1.252 CN(C)C/C=C/c1ccccc1 269982a_100102631434_100016265936 [1,0,0,0,0,1|2,0,0]=4 4911 B12R1.252 CN(C)CC=Cc1ccccc1 270004a_100102631434_100000210105 [1,0,0,0,0,1|2,0,0]=4 4912 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [1,0,0,0,0,1|0,0,0]=2 4913 B12R1.252 [13CH3]C(=O)C=CSc1ccccc1 1458a_100016262050_200025704644 [1,0,0,0,0,1|0,0,0]=2 4914 B12R1.252 [13CH3]C(=O)CCCc1ccccc1 1458a_100011207963_200025704644 [1,0,0,0,0,1|0,0,2]=4 4915 B12R1.252 [13CH3]C(=O)CCOc1ccccc1 1458a_100000182761_200025704644 [1,0,0,0,0,1|0,0,2]=4 4916 B12R1.252 [13CH3]C(=O)CCSc1ccccc1 1458a_100000182436_200025704644 [1,0,0,0,0,1|0,0,2]=4 4917 B12R1.252 [13CH3]C(=O)COCc1ccccc1 1458a_100000230186_200025704644 [1,0,0,0,0,1|0,0,2]=4 4918 B12R1.252 [13CH3]C(=O)CSCc1ccccc1 1458a_100000150264_200025704644 [1,0,0,0,0,1|0,0,2]=4 4919 B14R1.423 C/C(=C\c1ccccc1)/COC(C)C 34a_200025717232_100000210206 [0,0,0,0,0,2|1,0,1]=4 4920 B14R1.423 C/C(=C\c1ccccc1)/COC(C)C 7a_200025717232_100000210206 [0,0,0,0,0,2|1,0,1]=4 4921 B14R1.423 CC(=O)C=CC(=O)Nc1ccccc1 1458a_200016255450_200000210301 [0,0,0,0,0,2|2,0,0]=4 4922 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000070787_100000242058 [0,0,0,0,0,2|2,0,0]=4 4923 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200000210301 [0,0,0,0,0,2|2,0,0]=4 4924 B14R1.423 CC(=O)CCC(=O)Oc1ccccc1 1458a_100000070787_200000035796 [0,0,0,0,0,2|2,0,0]=4 4925 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 1458a_100000070787_100015196923 [0,0,0,0,0,2|1,0,1]=4 4926 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 1458a_100000177486_200000210301 [0,0,0,0,0,2|1,0,1]=4 4927 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 269982a_100000186898_100000053229 [0,0,0,0,0,2|1,0,1]=4 4928 B14R1.423 CC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200000210301 [0,0,0,0,0,2|1,0,1]=4 4929 B14R1.423 CC(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_200000210301 [0,0,0,0,0,2|2,0,0]=4 4930 B14R1.423 CC(=O)COC(C)Cc1ccccc1 34a_100000211253_200011218536 [0,0,0,0,0,2|0,0,2]=4 4931 B14R1.423 CC(=O)NCC(=O)Cc1ccccc1 1458a_100000194580_100015291786 [0,0,0,0,0,2|1,0,1]=4 4932 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 11a_100000106764_100000194580 [0,0,0,0,0,2|2,0,0]=4 4933 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 11a_100000742222_100015343762 [0,0,0,0,0,2|2,0,0]=4 4934 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 1626a_100000106764_100000194580 [0,0,0,0,0,2|2,0,0]=4 4935 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 1626a_100000742222_100015343762 [0,0,0,0,0,2|2,0,0]=4 4936 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 22a_100000106764_100000194580 [0,0,0,0,0,2|2,0,0]=4 4937 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 240690a_100000742222_100015343762 [0,0,0,0,0,2|2,0,0]=4 4938 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 527a_100000106764_100000194580 [0,0,0,0,0,2|2,0,0]=4 4939 B14R1.423 CC(=O)NCC(=O)Nc1ccccc1 527a_100000742222_100103153847 [0,0,0,0,0,2|2,0,0]=4 4940 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 11a_100000755676_100015343762 [0,0,0,0,0,2|1,0,1]=4 4941 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 1626a_100000755676_100015343762 [0,0,0,0,0,2|1,0,1]=4 4942 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 240690a_100000755676_100015343762 [0,0,0,0,0,2|1,0,1]=4 4943 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 527a_100000755676_100103153847 [0,0,0,0,0,2|1,0,1]=4 4944 B14R1.423 CC(=O)NN=C(C)C[n+]1ccccc1 4a_100000189765_100000034229 [0,0,0,0,0,2|1,0,1]=4 4945 B14R1.423 CC(=O)NNC(=O)Cc1ccccc1 22a_100000182964_100000070787 [0,0,0,0,0,2|1,0,1]=4 4946 B14R1.423 CC(=O)OCC(=O)Cc1ccccc1 1458a_100000183556_100015291786 [0,0,0,0,0,2|1,0,1]=4 4947 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 1626a_100000106764_100000183556 [0,0,0,0,0,2|2,0,0]=4 4948 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 22a_100000106764_100000183556 [0,0,0,0,0,2|2,0,0]=4 4949 B14R1.423 CC(=O)OCC(=O)Nc1ccccc1 527a_100000106764_100000183556 [0,0,0,0,0,2|2,0,0]=4 4950 B14R1.423 CC(=O)OCN(C)Cc1ccccc1 269982a_100000186898_100000076356 [0,0,0,0,0,2|1,0,1]=4 4951 B14R1.423 CC(=O)SCC(=O)Cc1ccccc1 1458a_100000049016_100015291786 [0,0,0,0,0,2|1,0,1]=4 4952 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 11a_100000106764_100000049016 [0,0,0,0,0,2|2,0,0]=4 4953 B14R1.423 CC(=O)SCC(=O)Nc1ccccc1 1626a_100000106764_100000049016 [0,0,0,0,0,2|2,0,0]=4 4954 B14R1.423 CN(CCC(=O)[13CH3])Cc1ccccc1 1458a_100000177486_200025704644 [0,0,0,0,0,2|1,0,1]=4 4955 B14R1.423 [13CH3]C(=O)C=CC(=O)Nc1ccccc1 1458a_200016255450_200025704644 [0,0,0,0,0,2|2,0,0]=4 4956 B14R1.423 [13CH3]C(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200025704644 [0,0,0,0,0,2|2,0,0]=4 4957 B14R1.423 [13CH3]C(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200025704644 [0,0,0,0,0,2|1,0,1]=4 4958 B14R1.423 [13CH3]C(=O)CNC(=O)Nc1ccccc1 1458a_100000181911_200025704644 [0,0,0,0,0,2|2,0,0]=4 4959 B14R1.818 C=C(C)CC(=O)C=Cc1ccccc1 1458a_100000210462_100000748629 [0,0,0,0,0,2|2,0,0]=4 4960 B14R1.818 CC(=O)CC(=O)CCc1ccccc1 1458a_100000070787_100012361361 [0,0,0,0,0,2|1,0,1]=4 4961 B14R1.818 CC(=O)CC(=O)NCc1ccccc1 1458a_100000070787_100000183539 [0,0,0,0,0,2|1,0,1]=4 4962 B14R1.818 CC(=O)CC(=O)OCc1ccccc1 1458a_100000037839_200000210301 [0,0,0,0,0,2|1,0,1]=4 4963 B14R1.818 CC(=O)CC(=O)OCc1ccccc1 1458a_100000070787_100000753625 [0,0,0,0,0,2|1,0,1]=4 4964 B14R1.818 CC(=O)NC(=O)COc1ccccc1 7a_100000210340_100000183797 [0,0,0,0,0,2|1,0,1]=4 4965 B14R1.818 CC(=O)NC(=O)CSc1ccccc1 62a_100000719477_100000183797 [0,0,0,0,0,2|1,0,1]=4 4966 B14R1.818 CC(=O)NC(C)CCc1ccccc1 11a_100000210798_100015343762 [0,0,0,0,0,2|0,0,2]=4 4967 B14R1.818 CC(=O)NC(C)CCc1ccccc1 1626a_100000210798_100015343762 [0,0,0,0,0,2|0,0,2]=4 4968 B14R1.818 CC(=O)NC(C)CCc1ccccc1 240690a_100000210798_100015343762 [0,0,0,0,0,2|0,0,2]=4 4969 B14R1.818 CC(=O)NC(C)CCc1ccccc1 527a_100000210798_100103153847 [0,0,0,0,0,2|0,0,2]=4 4970 B14R1.818 CC(=O)NC(C)COc1ccccc1 11a_100000746794_100015343762 [0,0,0,0,0,2|0,0,2]=4 4971 B14R1.818 CC(=O)NC(C)COc1ccccc1 1626a_100000746794_100015343762 [0,0,0,0,0,2|0,0,2]=4 4972 B14R1.818 CC(=O)NC(C)COc1ccccc1 240690a_100000746794_100015343762 [0,0,0,0,0,2|0,0,2]=4 4973 B14R1.818 CC(=O)NC(C)COc1ccccc1 527a_100000746794_100103153847 [0,0,0,0,0,2|0,0,2]=4 4974 B14R1.818 CC(=O)OC(C)SCc1ccccc1 62a_100000211182_100009818208 [0,0,0,0,0,2|0,0,2]=4 4975 B14R1.818 CC(=O)OC(C)SCc1ccccc1 62a_100009818208_100015291786 [0,0,0,0,0,2|0,0,2]=4 4976 B14R1.818 NC(=O)CC(=O)C=Cc1ccccc1 1458a_100000210462_100000187820 [0,0,0,0,0,2|2,0,0]=4 4977 B14R1.818 O=C([O-])CC(=O)C=Cc1ccccc1 1458a_100000210462_100020667443 [0,0,0,0,0,2|2,0,0]=4 4978 B14R1.818 [13CH3]C(=O)CC(=O)OCc1ccccc1 1458a_100000037839_200025704644 [0,0,0,0,0,2|1,0,1]=4 4979 B14R1.6449 C=C(C)C(=NNCc1ccccc1)C 4a_100000007032_100011216138 [0,0,0,0,0,2|1,0,1]=4 4980 B14R1.6449 C=C(C)C(=O)C/C=C/c1ccccc1 1458a_100000185857_100016265936 [0,0,0,0,0,2|2,0,0]=4 4981 B14R1.6449 CC(=O)C(=O)CNCc1ccccc1 34a_100015324214_100011261029 [0,0,0,0,0,2|1,0,1]=4 4982 B14R1.6449 CC(=O)C(=O)COCc1ccccc1 34a_100000210790_100011261029 [0,0,0,0,0,2|1,0,1]=4 4983 B14R1.6449 CC(=O)C(=O)CSCc1ccccc1 62a_100000211182_100011261029 [0,0,0,0,0,2|1,0,1]=4 4984 B14R1.6449 CC(=O)C(=O)CSCc1ccccc1 62a_100011261029_100015291786 [0,0,0,0,0,2|1,0,1]=4 4985 B14R1.6449 CC(=O)C(C)CCCc1ccccc1 1458a_100000070787_200010759516 [0,0,0,0,0,2|0,0,2]=4 4986 B14R1.6449 CC(=O)C(C)COCc1ccccc1 34a_100000032740_100015291786 [0,0,0,0,0,2|0,0,2]=4 4987 B14R1.6449 CC(=O)C(C)COCc1ccccc1 7a_100000032740_100000211182 [0,0,0,0,0,2|0,0,2]=4 4988 B14R1.6449 CC(=O)C(C)NCCc1ccccc1 2230a_100000106460_100009814033 [0,0,0,0,0,2|0,0,2]=4 4989 B14R1.6449 CC(=O)C(C)OCCc1ccccc1 34a_100000212229_100000765856 [0,0,0,0,0,2|0,0,2]=4 4990 B14R1.6449 CC(=O)C(C)OCCc1ccccc1 7a_100000210268_100000179758 [0,0,0,0,0,2|0,0,2]=4 4991 B14R1.6449 CC(=O)C(C)SCCc1ccccc1 62a_100000765856_100009814033 [0,0,0,0,0,2|0,0,2]=4 4992 B14R1.6449 CC(=O)C(C)SCCc1ccccc1 62a_100009814033_100011218657 [0,0,0,0,0,2|0,0,2]=4 4993 B14R1.6449 CC(=O)C(C)SCSc1ccccc1 62a_100009814033_100011218342 [0,0,0,0,0,2|0,0,2]=4 4994 B14R1.6449 CC(=O)C(C)SCSc1ccccc1 62a_100011218342_100009814033 [0,0,0,0,0,2|0,0,2]=4 4995 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 11a_100000693637_100015343762 [0,0,0,0,0,2|1,0,1]=4 4996 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 1626a_100000693637_100015343762 [0,0,0,0,0,2|1,0,1]=4 4997 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 240690a_100000693637_100015343762 [0,0,0,0,0,2|1,0,1]=4 4998 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 527a_100000693637_100103153847 [0,0,0,0,0,2|1,0,1]=4 4999 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 11a_100000184383_100015343762 [0,0,0,0,0,2|1,0,1]=4 5000 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 1626a_100000184383_100015343762 [0,0,0,0,0,2|1,0,1]=4 5001 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 240690a_100000184383_100015343762 [0,0,0,0,0,2|1,0,1]=4 5002 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 527a_100000184383_100103153847 [0,0,0,0,0,2|1,0,1]=4 5003 B14R1.6449 NC(=O)C(=O)NN=Cc1ccccc1 4a_100000211141_100015611070 [0,0,0,0,0,2|2,0,0]=4