0 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000748629 [0,0,0,0,0,0|3,0,1]=4 1 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000748629 [0,0,0,0,0,0|3,0,1]=4 2 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000748629 [0,0,0,0,0,0|3,0,1]=4 3 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 34a_100011279678_100000748629 [0,0,0,0,0,0|3,0,1]=4 4 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000748629 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000748629 [0,0,0,0,0,0|3,0,1]=4 6 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000748629 [0,0,0,0,0,0|3,0,1]=4 7 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 34a_100000701188_100000748629 [0,0,0,0,0,0|3,0,1]=4 8 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)I 34a_100000746945_100000748629 [0,0,0,0,0,0|3,0,1]=4 9 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748629 [0,0,0,0,0,0|2,0,1]=3 10 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 34a_100011827694_100000748629 [0,0,0,0,0,0|3,0,1]=4 11 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 7a_100011827694_100000748629 [0,0,0,0,0,0|3,0,1]=4 12 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 34a_100009865632_100000748629 [0,0,0,0,0,0|3,0,1]=4 13 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 7a_100009865632_100000748629 [0,0,0,0,0,0|3,0,1]=4 14 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000748629 [0,0,0,0,0,0|3,0,1]=4 15 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000748629 [0,0,0,0,0,0|3,0,1]=4 16 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 34a_100012001760_100000748629 [0,0,0,0,0,0|3,0,1]=4 17 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 7a_100012001760_100000748629 [0,0,0,0,0,0|3,0,1]=4 18 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 34a_100015326901_100000748629 [0,0,0,0,0,0|3,0,1]=4 19 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 7a_100015326901_100000748629 [0,0,0,0,0,0|3,0,1]=4 20 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)O 62a_100000748629_100012338938 [0,0,0,0,0,0|3,0,1]=4 21 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100000748629_100012353699 [0,0,0,0,0,0|3,0,1]=4 22 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000211660 [0,0,0,0,0,0|3,0,1]=4 23 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100000748629_100011830276 [0,0,0,0,0,0|3,0,1]=4 24 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100011830276_100000211660 [0,0,0,0,0,0|3,0,1]=4 25 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100000748629_100011356853 [0,0,0,0,0,0|3,0,1]=4 26 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000211660 [0,0,0,0,0,0|3,0,1]=4 27 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100000748629_100011934186 [0,0,0,0,0,0|3,0,1]=4 28 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100011934186_100000211660 [0,0,0,0,0,0|3,0,1]=4 29 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100000748629_100015196925 [0,0,0,0,0,0|3,0,1]=4 30 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100011279103_100000211660 [0,0,0,0,0,0|3,0,1]=4 31 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)O 62a_100000748629_100000694246 [0,0,0,0,0,0|2,0,1]=3 32 B14R1.42 C=C(C)CSc1ccc(c(n1)OC)O 62a_100000748629_100010893133 [0,0,0,0,0,0|3,0,1]=4 33 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)O 34a_100000726020_100009893438 [0,0,0,0,0,0|2,0,2]=4 34 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)O 62a_100000042424_100000694246 [0,0,0,0,0,0|2,0,2]=4 35 B14R1.42 CC(C)C=Cc1ccc(c(c1)C#N)O 271570a_100016257149_100000687585 [0,0,0,0,0,0|3,0,1]=4 36 B14R1.42 CC(C)C=Cc1ccc(c(c1)C=O)O 271570a_100016257149_100000186750 [0,0,0,0,0,0|3,0,1]=4 37 B14R1.42 CC(C)C=Cc1ccc(c(c1)CN)O 271570a_100016257149_100000730032 [0,0,0,0,0,0|3,0,1]=4 38 B14R1.42 CC(C)C=Cc1ccc(c(c1)CO)O 271570a_100016257149_100000184703 [0,0,0,0,0,0|3,0,1]=4 39 B14R1.42 CC(O)C=Cc1ccc(c(c1)C#N)O 271570a_200011019289_100000687585 [0,0,0,0,0,0|2,0,2]=4 40 B14R1.42 CC(O)C=Cc1ccc(c(c1)C=O)O 271570a_200011019289_100000186750 [0,0,0,0,0,0|2,0,2]=4 41 B14R1.42 CC(O)C=Cc1ccc(c(c1)CN)O 271570a_200011019289_100000730032 [0,0,0,0,0,0|2,0,2]=4 42 B14R1.42 CC(O)C=Cc1ccc(c(c1)CO)O 271570a_200011019289_100000184703 [0,0,0,0,0,0|2,0,2]=4 43 B14R1.42 CCc1cc(ccc1Br)C=CC(C)C 271570a_100016257149_100010244631 [0,0,0,0,0,0|3,0,1]=4 44 B14R1.42 CCc1cc(ccc1Br)C=CC(C)O 271570a_200011019289_100010244631 [0,0,0,0,0,0|2,0,2]=4 45 B14R1.42 CCc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100010244625 [0,0,0,0,0,0|3,0,1]=4 46 B14R1.42 CCc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100010244625 [0,0,0,0,0,0|2,0,2]=4 47 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 11a_114873767189_100015343762 [0,0,0,0,0,0|3,0,1]=4 48 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 1626a_114873767189_100015343762 [0,0,0,0,0,0|3,0,1]=4 49 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 240690a_114873767189_100015343762 [0,0,0,0,0,0|3,0,1]=4 50 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 527a_114873767189_100103153847 [0,0,0,0,0,0|3,0,1]=4 51 B14R1.42 CCc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100000686106 [0,0,0,0,0,0|3,0,1]=4 52 B14R1.42 CCc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100000686106 [0,0,0,0,0,0|2,0,2]=4 53 B14R1.42 CCc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100012338938 [0,0,0,0,0,0|2,0,1]=3 54 B14R1.42 CCc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100012338938 [0,0,0,0,0,0|1,0,2]=3 55 B14R1.42 CCc1cc(ccc1O)SCC(=O)N 62a_100000747473_100012338938 [0,0,0,0,0,0|3,0,1]=4 56 B14R1.42 CCc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100012338938 [0,0,0,0,0,0|3,0,1]=4 57 B14R1.42 CNc1cc(ccc1C)C=CC(C)C 271570a_100016257149_100020629602 [0,0,0,0,0,0|3,0,1]=4 58 B14R1.42 CNc1cc(ccc1C)C=CC(C)O 271570a_200011019289_100020629602 [0,0,0,0,0,0|2,0,2]=4 59 B14R1.42 CNc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100011314990 [0,0,0,0,0,0|3,0,1]=4 60 B14R1.42 CNc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100011314990 [0,0,0,0,0,0|2,0,2]=4 61 B14R1.42 CNc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100000694363 [0,0,0,0,0,0|3,0,1]=4 62 B14R1.42 CNc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100000694363 [0,0,0,0,0,0|2,0,2]=4 63 B14R1.42 COc1cc(c[nH]c1=O)C=CC(C)C 271570a_100016257149_100010125397 [0,0,0,0,0,0|2,0,2]=4 64 B14R1.42 COc1cc(c[nH]c1=O)C=CC(C)O 271570a_200011019289_100010125397 [0,0,0,0,0,0|1,0,3]=4 65 B14R1.42 COc1cc(ccc1Br)C=CC(=O)C 1458a_100016267305_200000210301 [0,0,0,0,0,0|1,0,0]=1 66 B14R1.42 COc1cc(ccc1Br)C=CC(=O)[13CH3] 1458a_100016267305_200025704644 [0,0,0,0,0,0|1,0,0]=1 67 B14R1.42 COc1cc(ccc1Br)C=CC(C)C 271570a_100016257149_100012353699 [0,0,0,0,0,0|2,0,1]=3 68 B14R1.42 COc1cc(ccc1Br)C=CC(C)O 271570a_200011019289_100012353699 [0,0,0,0,0,0|1,0,2]=3 69 B14R1.42 COc1cc(ccc1Br)NCC(=O)N 2230a_100000765947_100000747473 [0,0,0,0,0,0|3,0,1]=4 70 B14R1.42 COc1cc(ccc1Br)NCC(=O)N 34a_100000765947_100000187820 [0,0,0,0,0,0|3,0,1]=4 71 B14R1.42 COc1cc(ccc1Br)NCC(=O)[O-] 34a_100000765947_100020667443 [0,0,0,0,0,0|3,0,1]=4 72 B14R1.42 COc1cc(ccc1Br)OCC(=O)N 34a_100011827694_100000187820 [0,0,0,0,0,0|3,0,1]=4 73 B14R1.42 COc1cc(ccc1Br)OCC(=O)N 7a_100011827694_100000187820 [0,0,0,0,0,0|3,0,1]=4 74 B14R1.42 COc1cc(ccc1Br)OCC(=O)[O-] 34a_100011827694_100020667443 [0,0,0,0,0,0|3,0,1]=4 75 B14R1.42 COc1cc(ccc1Br)SCC(=O)N 62a_100000747473_100012353699 [0,0,0,0,0,0|3,0,1]=4 76 B14R1.42 COc1cc(ccc1Br)SCC(=O)N 62a_100012353699_100000747473 [0,0,0,0,0,0|3,0,1]=4 77 B14R1.42 COc1cc(ccc1Br)SCC(=O)[O-] 62a_100012353699_100020667443 [0,0,0,0,0,0|3,0,1]=4 78 B14R1.42 COc1cc(ccc1Br)SCC(=O)[O-] 62a_100020667443_100012353699 [0,0,0,0,0,0|3,0,1]=4 79 B14R1.42 COc1cc(ccc1C)C=CC(C)C 271570a_100016257149_100011830276 [0,0,0,0,0,0|2,0,1]=3 80 B14R1.42 COc1cc(ccc1C)C=CC(C)O 271570a_200011019289_100011830276 [0,0,0,0,0,0|1,0,2]=3 81 B14R1.42 COc1cc(ccc1C)CCC(=O)C 1458a_200000066385_200000210301 [0,0,0,0,0,0|1,0,2]=3 82 B14R1.42 COc1cc(ccc1C)CCC(=O)[13CH3] 1458a_200000066385_200025704644 [0,0,0,0,0,0|1,0,2]=3 83 B14R1.42 COc1cc(ccc1C)NCC(=O)N 2230a_100011279678_100000747473 [0,0,0,0,0,0|3,0,1]=4 84 B14R1.42 COc1cc(ccc1C)NCC(=O)N 34a_100011279678_100000187820 [0,0,0,0,0,0|3,0,1]=4 85 B14R1.42 COc1cc(ccc1C)NCC(=O)[O-] 34a_100011279678_100020667443 [0,0,0,0,0,0|3,0,1]=4 86 B14R1.42 COc1cc(ccc1C)OCC(=O)N 34a_100009865632_100000187820 [0,0,0,0,0,0|3,0,1]=4 87 B14R1.42 COc1cc(ccc1C)OCC(=O)N 7a_100009865632_100000187820 [0,0,0,0,0,0|3,0,1]=4 88 B14R1.42 COc1cc(ccc1C)OCC(=O)[O-] 34a_100009865632_100020667443 [0,0,0,0,0,0|3,0,1]=4 89 B14R1.42 COc1cc(ccc1C)SCC(=O)N 62a_100000747473_100011830276 [0,0,0,0,0,0|3,0,1]=4 90 B14R1.42 COc1cc(ccc1C)SCC(=O)N 62a_100011830276_100000747473 [0,0,0,0,0,0|3,0,1]=4 91 B14R1.42 COc1cc(ccc1C)SCC(=O)[O-] 62a_100011830276_100020667443 [0,0,0,0,0,0|3,0,1]=4 92 B14R1.42 COc1cc(ccc1C)SCC(=O)[O-] 62a_100020667443_100011830276 [0,0,0,0,0,0|3,0,1]=4 93 B14R1.42 COc1cc(ccc1Cl)C=CC(C)C 271570a_100016257149_100011356853 [0,0,0,0,0,0|2,0,1]=3 94 B14R1.42 COc1cc(ccc1Cl)C=CC(C)O 271570a_200011019289_100011356853 [0,0,0,0,0,0|1,0,2]=3 95 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 11a_100015204853_100015343762 [0,0,0,0,0,0|2,0,1]=3 96 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 1626a_100015204853_100015343762 [0,0,0,0,0,0|2,0,1]=3 97 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 240690a_100015204853_100015343762 [0,0,0,0,0,0|2,0,1]=3 98 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 527a_100015204853_100103153847 [0,0,0,0,0,0|2,0,1]=3 99 B14R1.42 COc1cc(ccc1Cl)NCC(=O)N 2230a_100000742311_100000747473 [0,0,0,0,0,0|3,0,1]=4 100 B14R1.42 COc1cc(ccc1Cl)NCC(=O)N 34a_100000742311_100000187820 [0,0,0,0,0,0|3,0,1]=4 101 B14R1.42 COc1cc(ccc1Cl)NCC(=O)[O-] 34a_100000742311_100020667443 [0,0,0,0,0,0|3,0,1]=4 102 B14R1.42 COc1cc(ccc1Cl)OCC(=O)N 34a_100012186310_100000187820 [0,0,0,0,0,0|3,0,1]=4 103 B14R1.42 COc1cc(ccc1Cl)OCC(=O)N 7a_100012186310_100000187820 [0,0,0,0,0,0|3,0,1]=4 104 B14R1.42 COc1cc(ccc1Cl)OCC(=O)[O-] 34a_100012186310_100020667443 [0,0,0,0,0,0|3,0,1]=4 105 B14R1.42 COc1cc(ccc1Cl)SCC(=O)N 62a_100000747473_100011356853 [0,0,0,0,0,0|3,0,1]=4 106 B14R1.42 COc1cc(ccc1Cl)SCC(=O)N 62a_100011356853_100000747473 [0,0,0,0,0,0|3,0,1]=4 107 B14R1.42 COc1cc(ccc1Cl)SCC(=O)[O-] 62a_100011356853_100020667443 [0,0,0,0,0,0|3,0,1]=4 108 B14R1.42 COc1cc(ccc1Cl)SCC(=O)[O-] 62a_100020667443_100011356853 [0,0,0,0,0,0|3,0,1]=4 109 B14R1.42 COc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100011934186 [0,0,0,0,0,0|2,0,1]=3 110 B14R1.42 COc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100011934186 [0,0,0,0,0,0|1,0,2]=3 111 B14R1.42 COc1cc(ccc1F)CCC(=O)C 1458a_100009849056_200000210301 [0,0,0,0,0,0|1,0,2]=3 112 B14R1.42 COc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100009849056_200025704644 [0,0,0,0,0,0|1,0,2]=3 113 B14R1.42 COc1cc(ccc1F)CNC(=O)C 11a_100020626639_100015343762 [0,0,0,0,0,0|2,0,1]=3 114 B14R1.42 COc1cc(ccc1F)CNC(=O)C 1626a_100020626639_100015343762 [0,0,0,0,0,0|2,0,1]=3 115 B14R1.42 COc1cc(ccc1F)CNC(=O)C 240690a_100020626639_100015343762 [0,0,0,0,0,0|2,0,1]=3 116 B14R1.42 COc1cc(ccc1F)CNC(=O)C 527a_100020626639_100103153847 [0,0,0,0,0,0|2,0,1]=3 117 B14R1.42 COc1cc(ccc1F)NCC(=O)N 2230a_100000701188_100000747473 [0,0,0,0,0,0|3,0,1]=4 118 B14R1.42 COc1cc(ccc1F)NCC(=O)N 34a_100000701188_100000187820 [0,0,0,0,0,0|3,0,1]=4 119 B14R1.42 COc1cc(ccc1F)NCC(=O)[O-] 34a_100000701188_100020667443 [0,0,0,0,0,0|3,0,1]=4 120 B14R1.42 COc1cc(ccc1F)NNC(=O)C 22a_102515433066_100000070787 [0,0,0,0,0,0|3,0,0]=3 121 B14R1.42 COc1cc(ccc1F)OCC(=O)N 34a_100012001760_100000187820 [0,0,0,0,0,0|3,0,1]=4 122 B14R1.42 COc1cc(ccc1F)OCC(=O)N 7a_100012001760_100000187820 [0,0,0,0,0,0|3,0,1]=4 123 B14R1.42 COc1cc(ccc1F)OCC(=O)[O-] 34a_100012001760_100020667443 [0,0,0,0,0,0|3,0,1]=4 124 B14R1.42 COc1cc(ccc1F)SCC(=O)N 62a_100000747473_100011934186 [0,0,0,0,0,0|3,0,1]=4 125 B14R1.42 COc1cc(ccc1F)SCC(=O)N 62a_100011934186_100000747473 [0,0,0,0,0,0|3,0,1]=4 126 B14R1.42 COc1cc(ccc1F)SCC(=O)[O-] 62a_100011934186_100020667443 [0,0,0,0,0,0|3,0,1]=4 127 B14R1.42 COc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100011934186 [0,0,0,0,0,0|3,0,1]=4 128 B14R1.42 COc1cc(ccc1I)NCC(=O)N 34a_100000746945_100000187820 [0,0,0,0,0,0|3,0,1]=4 129 B14R1.42 COc1cc(ccc1I)NCC(=O)[O-] 34a_100000746945_100020667443 [0,0,0,0,0,0|3,0,1]=4 130 B14R1.42 COc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100011279103 [0,0,0,0,0,0|2,0,1]=3 131 B14R1.42 COc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100011279103 [0,0,0,0,0,0|1,0,2]=3 132 B14R1.42 COc1cc(ccc1N)OCC(=O)N 34a_100015326901_100000187820 [0,0,0,0,0,0|3,0,1]=4 133 B14R1.42 COc1cc(ccc1N)OCC(=O)N 7a_100015326901_100000187820 [0,0,0,0,0,0|3,0,1]=4 134 B14R1.42 COc1cc(ccc1N)OCC(=O)[O-] 34a_100015326901_100020667443 [0,0,0,0,0,0|3,0,1]=4 135 B14R1.42 COc1cc(ccc1N)SCC(=O)N 62a_100000747473_100015196925 [0,0,0,0,0,0|3,0,1]=4 136 B14R1.42 COc1cc(ccc1N)SCC(=O)N 62a_100011279103_100000747473 [0,0,0,0,0,0|3,0,1]=4 137 B14R1.42 COc1cc(ccc1N)SCC(=O)[O-] 62a_100011279103_100020667443 [0,0,0,0,0,0|3,0,1]=4 138 B14R1.42 COc1cc(ccc1N)SCC(=O)[O-] 62a_100020667443_100015196925 [0,0,0,0,0,0|3,0,1]=4 139 B14R1.42 COc1cc(ccc1O)C=CC(=O)C 1458a_100000182119_200000210301 [0,0,0,0,0,0|0,0,0]=0 140 B14R1.42 COc1cc(ccc1O)C=CC(=O)[13CH3] 1458a_100000182119_200025704644 [0,0,0,0,0,0|0,0,0]=0 141 B14R1.42 COc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000694246 [0,0,0,0,0,0|1,0,1]=2 142 B14R1.42 COc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000694246 [0,0,0,0,0,0|0,0,2]=2 143 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [0,0,0,0,0,0|0,0,2]=2 144 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [0,0,0,0,0,0|0,0,2]=2 145 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [0,0,0,0,0,0|0,0,2]=2 146 B14R1.42 COc1cc(ccc1O)CCN(C)C 2230a_100102631434_100010741665 [0,0,0,0,0,0|2,0,2]=4 147 B14R1.42 COc1cc(ccc1O)CCN(C)C 269982a_100102631434_100010741665 [0,0,0,0,0,0|2,0,2]=4 148 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [0,0,0,0,0,0|1,0,1]=2 149 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [0,0,0,0,0,0|1,0,1]=2 150 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [0,0,0,0,0,0|1,0,1]=2 151 B14R1.42 COc1cc(ccc1O)CNC(C)C 34a_100000185554_100000210206 [0,0,0,0,0,0|2,0,2]=4 152 B14R1.42 COc1cc(ccc1O)NCC(=O)N 34a_100000726020_100000187820 [0,0,0,0,0,0|2,0,1]=3 153 B14R1.42 COc1cc(ccc1O)NCC(=O)[O-] 34a_100000726020_100020667443 [0,0,0,0,0,0|2,0,1]=3 154 B14R1.42 COc1cc(ccc1O)NCC(C)C 34a_100000726020_100000210624 [0,0,0,0,0,0|2,0,2]=4 155 B14R1.42 COc1cc(ccc1O)NCC(C)O 34a_100000726020_100011218427 [0,0,0,0,0,0|1,0,3]=4 156 B14R1.42 COc1cc(ccc1O)NC[C@@H](C)O 34a_100000726020_100009817552 [0,0,0,0,0,0|1,0,3]=4 157 B14R1.42 COc1cc(ccc1O)NC[N+](=O)[O-] 34a_100000726020_100000761209 [0,0,0,0,0,0|3,0,1]=4 158 B14R1.42 COc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000694246 [0,0,0,0,0,0|2,0,1]=3 159 B14R1.42 COc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000694246 [0,0,0,0,0,0|2,0,1]=3 160 B14R1.42 COc1cc(ccc1O)SCC(C)C 62a_100000210624_100000694246 [0,0,0,0,0,0|2,0,2]=4 161 B14R1.42 COc1cc(ccc1O)SCC(C)O 62a_100011218427_100000694246 [0,0,0,0,0,0|1,0,3]=4 162 B14R1.42 COc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000694246 [0,0,0,0,0,0|1,0,3]=4 163 B14R1.42 COc1cc(cnc1C)C=CC(C)C 271570a_100016257149_100010254219 [0,0,0,0,0,0|3,0,1]=4 164 B14R1.42 COc1cc(cnc1C)C=CC(C)O 271570a_200011019289_100010254219 [0,0,0,0,0,0|2,0,2]=4 165 B14R1.42 COc1cc(cnc1F)C=CC(C)C 271570a_100016257149_100010214931 [0,0,0,0,0,0|3,0,1]=4 166 B14R1.42 COc1cc(cnc1F)C=CC(C)O 271570a_200011019289_100010214931 [0,0,0,0,0,0|2,0,2]=4 167 B14R1.42 COc1cc(cnc1N)C=CC(C)C 271570a_100016257149_106354213024 [0,0,0,0,0,0|3,0,1]=4 168 B14R1.42 COc1cc(cnc1N)C=CC(C)O 271570a_200011019289_106354213024 [0,0,0,0,0,0|2,0,2]=4 169 B14R1.42 COc1cc(ncc1C)C=CC(C)C 271570a_100016257149_100010067687 [0,0,0,0,0,0|3,0,1]=4 170 B14R1.42 COc1cc(ncc1C)C=CC(C)O 271570a_200011019289_100010067687 [0,0,0,0,0,0|2,0,2]=4 171 B14R1.42 COc1cc(ncc1F)C=CC(C)C 271570a_100016257149_200010136270 [0,0,0,0,0,0|3,0,1]=4 172 B14R1.42 COc1cc(ncc1F)C=CC(C)O 271570a_200011019289_200010136270 [0,0,0,0,0,0|2,0,2]=4 173 B14R1.42 COc1cc(ncc1N)C=CC(C)C 271570a_100016257149_100009887741 [0,0,0,0,0,0|3,0,1]=4 174 B14R1.42 COc1cc(ncc1N)C=CC(C)O 271570a_200011019289_100009887741 [0,0,0,0,0,0|2,0,2]=4 175 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 11a_200015507175_100015343762 [0,0,0,0,0,0|3,0,1]=4 176 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 1626a_200015507175_100015343762 [0,0,0,0,0,0|3,0,1]=4 177 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 240690a_200015507175_100015343762 [0,0,0,0,0,0|3,0,1]=4 178 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 527a_200015507175_100103153847 [0,0,0,0,0,0|3,0,1]=4 179 B14R1.42 COc1nc(ccc1N)C=CC(C)C 271570a_100016257149_100000687816 [0,0,0,0,0,0|3,0,1]=4 180 B14R1.42 COc1nc(ccc1N)C=CC(C)O 271570a_200011019289_100000687816 [0,0,0,0,0,0|2,0,2]=4 181 B14R1.42 COc1nc(ccc1O)C=CC(C)C 271570a_100016257149_100010893133 [0,0,0,0,0,0|2,0,1]=3 182 B14R1.42 COc1nc(ccc1O)C=CC(C)O 271570a_200011019289_100010893133 [0,0,0,0,0,0|1,0,2]=3 183 B14R1.42 COc1nc(ccc1O)SCC(=O)N 62a_100000747473_100010893133 [0,0,0,0,0,0|3,0,1]=4 184 B14R1.42 COc1nc(ccc1O)SCC(=O)[O-] 62a_100020667443_100010893133 [0,0,0,0,0,0|3,0,1]=4 185 B14R1.42 COc1nc(cnc1O)C=CC(C)C 271570a_100016257149_200010365344 [0,0,0,0,0,0|3,0,1]=4 186 B14R1.42 COc1nc(cnc1O)C=CC(C)O 271570a_200011019289_200010365344 [0,0,0,0,0,0|2,0,2]=4 187 B14R1.42 CSc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100010341305 [0,0,0,0,0,0|2,1,1]=4 188 B14R1.42 CSc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100010341305 [0,0,0,0,0,0|1,1,2]=4 189 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 34a_100011218179_100000748629 [1,0,0,0,0,0|2,0,1]=4 190 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 7a_100011218179_100000748629 [1,0,0,0,0,0|2,0,1]=4 191 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [1,0,0,0,0,0|2,0,1]=4 192 B13R1.511 C=C(C)CSc1ccc(c(c1)C)O 62a_100000748629_100000186361 [1,0,0,0,0,0|2,0,1]=4 193 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [1,0,0,0,0,0|2,0,1]=4 194 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)Cl 1458a_100102889548_200000210301 [1,0,0,0,0,0|2,0,0]=3 195 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)F 1458a_100011195070_200000210301 [1,0,0,0,0,0|2,0,0]=3 196 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200000210301 [1,0,0,0,0,0|1,0,0]=2 197 B13R1.511 CC(=O)C=Cc1ccc(c(c1)C)C 1458a_100011338269_200000210301 [1,0,0,0,0,0|1,0,0]=2 198 B13R1.511 CC(=O)C=Cc1ccc(c(c1)C)F 1458a_100016261966_200000210301 [1,0,0,0,0,0|1,0,0]=2 199 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)Cl 1458a_100000716972_200000210301 [1,0,0,0,0,0|2,0,0]=3 200 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)F 1458a_100102525453_200000210301 [1,0,0,0,0,0|2,0,0]=3 201 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200000210301 [1,0,0,0,0,0|1,0,0]=2 202 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)Br 1458a_100102601611_200000210301 [1,0,0,0,0,0|2,0,0]=3 203 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)C 1458a_100102526211_200000210301 [1,0,0,0,0,0|2,0,0]=3 204 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)Cl 1458a_100020610926_200000210301 [1,0,0,0,0,0|2,0,0]=3 205 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)F 1458a_100011195075_200000210301 [1,0,0,0,0,0|2,0,0]=3 206 B13R1.511 CC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_200000210301 [1,0,0,0,0,0|1,0,2]=4 207 B13R1.511 CC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_200000210301 [1,0,0,0,0,0|1,0,2]=4 208 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [1,0,0,0,0,0|0,0,2]=3 209 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [1,0,0,0,0,0|0,0,2]=3 210 B13R1.511 CC(=O)COc1ccc(c(c1)C)C 1458a_100000182425_200000210301 [1,0,0,0,0,0|2,0,1]=4 211 B13R1.511 CC(=O)COc1ccc(c(c1)C)Cl 1458a_100000182483_200000210301 [1,0,0,0,0,0|2,0,1]=4 212 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 11a_100015205234_100015343762 [1,0,0,0,0,0|2,0,1]=4 213 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 1626a_100015205234_100015343762 [1,0,0,0,0,0|2,0,1]=4 214 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 240690a_100015205234_100015343762 [1,0,0,0,0,0|2,0,1]=4 215 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 527a_100015205234_100103153847 [1,0,0,0,0,0|2,0,1]=4 216 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 11a_100025706692_100015343762 [1,0,0,0,0,0|2,0,1]=4 217 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 1626a_100025706692_100015343762 [1,0,0,0,0,0|2,0,1]=4 218 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 240690a_100025706692_100015343762 [1,0,0,0,0,0|2,0,1]=4 219 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 527a_100025706692_100103153847 [1,0,0,0,0,0|2,0,1]=4 220 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 11a_100000239911_100015343762 [1,0,0,0,0,0|2,0,1]=4 221 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 1626a_100000239911_100015343762 [1,0,0,0,0,0|2,0,1]=4 222 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 240690a_100000239911_100015343762 [1,0,0,0,0,0|2,0,1]=4 223 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 527a_100000239911_100103153847 [1,0,0,0,0,0|2,0,1]=4 224 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [1,0,0,0,0,0|2,0,1]=4 225 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [1,0,0,0,0,0|2,0,1]=4 226 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100015343762 [1,0,0,0,0,0|2,0,1]=4 227 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100103153847 [1,0,0,0,0,0|2,0,1]=4 228 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100015343762 [1,0,0,0,0,0|2,0,1]=4 229 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100103153847 [1,0,0,0,0,0|2,0,1]=4 230 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [1,0,0,0,0,0|1,0,1]=3 231 B13R1.511 CC(=O)NNc1ccc(c(c1)C)Br 22a_100000745493_100000070787 [1,0,0,0,0,0|3,0,0]=4 232 B13R1.511 CC(=O)NNc1ccc(c(c1)C)Cl 22a_100015233126_100000070787 [1,0,0,0,0,0|3,0,0]=4 233 B13R1.511 CC(C)C=Cc1ccc(c(c1)Br)O 271570a_100016257149_100012361655 [1,0,0,0,0,0|2,0,1]=4 234 B13R1.511 CC(C)C=Cc1ccc(c(c1)Cl)O 271570a_100016257149_100012360047 [1,0,0,0,0,0|2,0,1]=4 235 B13R1.511 CC(C)C=Cc1ccc(c(c1)F)O 271570a_100016257149_100000185481 [1,0,0,0,0,0|2,0,1]=4 236 B13R1.511 CC(C)C=Cc1ccc(c(c1)N)O 271570a_100016257149_100000752626 [1,0,0,0,0,0|2,0,1]=4 237 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)Br 271570a_100016257149_100012356990 [1,0,0,0,0,0|2,0,1]=4 238 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)Cl 271570a_100016257149_100011356854 [1,0,0,0,0,0|2,0,1]=4 239 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)F 271570a_100016257149_100000686035 [1,0,0,0,0,0|2,0,1]=4 240 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)N 271570a_100016257149_100000739049 [1,0,0,0,0,0|2,0,1]=4 241 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)O 271570a_100016257149_100009813601 [1,0,0,0,0,0|1,0,1]=3 242 B13R1.511 CC(O)C=Cc1ccc(c(c1)Br)O 271570a_200011019289_100012361655 [1,0,0,0,0,0|1,0,2]=4 243 B13R1.511 CC(O)C=Cc1ccc(c(c1)Cl)O 271570a_200011019289_100012360047 [1,0,0,0,0,0|1,0,2]=4 244 B13R1.511 CC(O)C=Cc1ccc(c(c1)F)O 271570a_200011019289_100000185481 [1,0,0,0,0,0|1,0,2]=4 245 B13R1.511 CC(O)C=Cc1ccc(c(c1)N)O 271570a_200011019289_100000752626 [1,0,0,0,0,0|1,0,2]=4 246 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)Br 271570a_200011019289_100012356990 [1,0,0,0,0,0|1,0,2]=4 247 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)Cl 271570a_200011019289_100011356854 [1,0,0,0,0,0|1,0,2]=4 248 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)F 271570a_200011019289_100000686035 [1,0,0,0,0,0|1,0,2]=4 249 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)N 271570a_200011019289_100000739049 [1,0,0,0,0,0|1,0,2]=4 250 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)O 271570a_200011019289_100009813601 [1,0,0,0,0,0|0,0,2]=3 251 B13R1.511 Cc1cc(ccc1Br)C=CC(C)C 271570a_100016257149_100009813585 [1,0,0,0,0,0|2,0,1]=4 252 B13R1.511 Cc1cc(ccc1Br)C=CC(C)O 271570a_200011019289_100009813585 [1,0,0,0,0,0|1,0,2]=4 253 B13R1.511 Cc1cc(ccc1Cl)C=CC(C)C 271570a_100016257149_100000049509 [1,0,0,0,0,0|2,0,1]=4 254 B13R1.511 Cc1cc(ccc1Cl)C=CC(C)O 271570a_200011019289_100000049509 [1,0,0,0,0,0|1,0,2]=4 255 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)[13CH3] 1458a_100000182483_200025704644 [1,0,0,0,0,0|2,0,1]=4 256 B13R1.511 Cc1cc(ccc1F)C=CC(=O)[13CH3] 1458a_100016261966_200025704644 [1,0,0,0,0,0|1,0,0]=2 257 B13R1.511 Cc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100011218330 [1,0,0,0,0,0|2,0,1]=4 258 B13R1.511 Cc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100011218330 [1,0,0,0,0,0|1,0,2]=4 259 B13R1.511 Cc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100011615030_200025704644 [1,0,0,0,0,0|1,0,2]=4 260 B13R1.511 Cc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100000211769 [1,0,0,0,0,0|2,0,1]=4 261 B13R1.511 Cc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100000211769 [1,0,0,0,0,0|1,0,2]=4 262 B13R1.511 Cc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000186361 [1,0,0,0,0,0|1,0,1]=3 263 B13R1.511 Cc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000186361 [1,0,0,0,0,0|0,0,2]=3 264 B13R1.511 Cc1cc(ccc1O)NCC(=O)N 34a_100011218179_100000187820 [1,0,0,0,0,0|2,0,1]=4 265 B13R1.511 Cc1cc(ccc1O)NCC(=O)N 7a_100011218179_100000187820 [1,0,0,0,0,0|2,0,1]=4 266 B13R1.511 Cc1cc(ccc1O)NCC(=O)[O-] 34a_100011218179_100020667443 [1,0,0,0,0,0|2,0,1]=4 267 B13R1.511 Cc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000186361 [1,0,0,0,0,0|2,0,1]=4 268 B13R1.511 Cc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000186361 [1,0,0,0,0,0|2,0,1]=4 269 B13R1.511 Cc1cc(cnc1O)C=CC(C)C 271570a_100016257149_100000685391 [1,0,0,0,0,0|2,0,1]=4 270 B13R1.511 Cc1cc(cnc1O)C=CC(C)O 271570a_200011019289_100000685391 [1,0,0,0,0,0|1,0,2]=4 271 B13R1.511 Cc1cc(ncc1O)C=CC(C)C 271570a_100016257149_100000692680 [1,0,0,0,0,0|2,0,1]=4 272 B13R1.511 Cc1cc(ncc1O)C=CC(C)O 271570a_200011019289_100000692680 [1,0,0,0,0,0|1,0,2]=4 273 B13R1.511 Cc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100011338269_200025704644 [1,0,0,0,0,0|1,0,0]=2 274 B13R1.511 Cc1ccc(cc1C)C=CC(C)C 271570a_100016257149_100011215607 [1,0,0,0,0,0|2,0,1]=4 275 B13R1.511 Cc1ccc(cc1C)C=CC(C)O 271570a_200011019289_100011215607 [1,0,0,0,0,0|1,0,2]=4 276 B13R1.511 Cc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011338283_200025704644 [1,0,0,0,0,0|1,0,2]=4 277 B13R1.511 Cc1ccc(cc1C)OCC(=O)[13CH3] 1458a_100000182425_200025704644 [1,0,0,0,0,0|2,0,1]=4 278 B13R1.511 Cc1ccc(cc1F)C=CC(=O)[13CH3] 1458a_100102526211_200025704644 [1,0,0,0,0,0|2,0,0]=3 279 B13R1.511 Cc1ccc(cc1O)C=CC(C)C 271570a_100016257149_100000766334 [1,0,0,0,0,0|2,0,1]=4 280 B13R1.511 Cc1ccc(cc1O)C=CC(C)O 271570a_200011019289_100000766334 [1,0,0,0,0,0|1,0,2]=4 281 B13R1.511 Cc1nc(ccc1O)C=CC(C)C 271570a_100016257149_100010233687 [1,0,0,0,0,0|2,0,1]=4 282 B13R1.511 Cc1nc(ccc1O)C=CC(C)O 271570a_200011019289_100010233687 [1,0,0,0,0,0|1,0,2]=4 283 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [1,0,0,0,0,0|2,0,1]=4 284 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [1,0,0,0,0,0|2,0,1]=4 285 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100020667443 [1,0,0,0,0,0|2,0,1]=4 286 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)O 62a_100020667443_100009813601 [1,0,0,0,0,0|2,0,1]=4 287 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)Cl 1458a_100102889548_200025704644 [1,0,0,0,0,0|2,0,0]=3 288 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)F 1458a_100011195070_200025704644 [1,0,0,0,0,0|2,0,0]=3 289 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200025704644 [1,0,0,0,0,0|1,0,0]=2 290 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)Cl 1458a_100000716972_200025704644 [1,0,0,0,0,0|2,0,0]=3 291 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)F 1458a_100102525453_200025704644 [1,0,0,0,0,0|2,0,0]=3 292 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200025704644 [1,0,0,0,0,0|1,0,0]=2 293 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)F)Br 1458a_100102601611_200025704644 [1,0,0,0,0,0|2,0,0]=3 294 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)F)Cl 1458a_100020610926_200025704644 [1,0,0,0,0,0|2,0,0]=3 295 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)F)F 1458a_100011195075_200025704644 [1,0,0,0,0,0|2,0,0]=3 296 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [1,0,0,0,0,0|0,0,2]=3 297 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [1,0,0,0,0,0|1,0,2]=4 298 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [1,0,0,0,0,0|1,0,2]=4 299 B13R1.575 CC=NNc1ccc(c(c1)OC)F 4a_102515433066_200000210099 [1,0,0,0,0,0|3,0,0]=4 300 B13R1.575 CCCCc1ccc(c(c1)OC)O 271570a_100020621405_100000694246 [1,0,0,0,0,0|0,0,3]=4 301 B13R1.575 CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210303 [1,0,0,0,0,0|1,0,2]=4 302 B13R1.575 CCCSc1ccc(c(c1)OC)O 62a_100000210303_100000694246 [1,0,0,0,0,0|1,0,2]=4 303 B13R1.575 CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210202 [1,0,0,0,0,0|1,0,2]=4 304 B13R1.575 CCc1cc(ccc1O)SCC=O 62a_200015260668_100012338938 [1,0,0,0,0,0|2,0,1]=4 305 B13R1.575 CNCCc1ccc(c(c1)OC)O 2230a_106832991635_100010741665 [1,0,0,0,0,0|1,0,2]=4 306 B13R1.575 CNCCc1ccc(c(c1)OC)O 34a_100000756042_200000210301 [1,0,0,0,0,0|1,0,2]=4 307 B13R1.575 CNCCc1ccc(c(c1)OC)O 7a_106832991635_100010741665 [1,0,0,0,0,0|1,0,2]=4 308 B13R1.575 COCSc1ccc(c(c1)OC)O 62a_100000766300_100000694246 [1,0,0,0,0,0|2,0,1]=4 309 B13R1.575 COc1cc(ccc1Br)NCC=O 2230a_100000765947_200015260668 [1,0,0,0,0,0|2,0,1]=4 310 B13R1.575 COc1cc(ccc1Br)NCC=O 34a_100000765947_200009817547 [1,0,0,0,0,0|2,0,1]=4 311 B13R1.575 COc1cc(ccc1Br)OCC=O 34a_100011827694_200009817547 [1,0,0,0,0,0|2,0,1]=4 312 B13R1.575 COc1cc(ccc1Br)OCC=O 7a_100011827694_200015260668 [1,0,0,0,0,0|2,0,1]=4 313 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_100012353699_200015260668 [1,0,0,0,0,0|2,0,1]=4 314 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_200015260668_100012353699 [1,0,0,0,0,0|2,0,1]=4 315 B13R1.575 COc1cc(ccc1C)NCC=O 2230a_100011279678_200015260668 [1,0,0,0,0,0|2,0,1]=4 316 B13R1.575 COc1cc(ccc1C)NCC=O 34a_100011279678_200009817547 [1,0,0,0,0,0|2,0,1]=4 317 B13R1.575 COc1cc(ccc1C)OCC=O 34a_100009865632_200009817547 [1,0,0,0,0,0|2,0,1]=4 318 B13R1.575 COc1cc(ccc1C)OCC=O 7a_100009865632_200015260668 [1,0,0,0,0,0|2,0,1]=4 319 B13R1.575 COc1cc(ccc1C)SCC=O 62a_100011830276_200015260668 [1,0,0,0,0,0|2,0,1]=4 320 B13R1.575 COc1cc(ccc1C)SCC=O 62a_200015260668_100011830276 [1,0,0,0,0,0|2,0,1]=4 321 B13R1.575 COc1cc(ccc1Cl)NCC=O 2230a_100000742311_200015260668 [1,0,0,0,0,0|2,0,1]=4 322 B13R1.575 COc1cc(ccc1Cl)NCC=O 34a_100000742311_200009817547 [1,0,0,0,0,0|2,0,1]=4 323 B13R1.575 COc1cc(ccc1Cl)OCC=O 34a_100012186310_200009817547 [1,0,0,0,0,0|2,0,1]=4 324 B13R1.575 COc1cc(ccc1Cl)OCC=O 7a_100012186310_200015260668 [1,0,0,0,0,0|2,0,1]=4 325 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_100011356853_200015260668 [1,0,0,0,0,0|2,0,1]=4 326 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_200015260668_100011356853 [1,0,0,0,0,0|2,0,1]=4 327 B13R1.575 COc1cc(ccc1F)NCC=O 2230a_100000701188_200015260668 [1,0,0,0,0,0|2,0,1]=4 328 B13R1.575 COc1cc(ccc1F)NCC=O 34a_100000701188_200009817547 [1,0,0,0,0,0|2,0,1]=4 329 B13R1.575 COc1cc(ccc1F)OCC=O 34a_100012001760_200009817547 [1,0,0,0,0,0|2,0,1]=4 330 B13R1.575 COc1cc(ccc1F)OCC=O 7a_100012001760_200015260668 [1,0,0,0,0,0|2,0,1]=4 331 B13R1.575 COc1cc(ccc1F)SCC=O 62a_100011934186_200015260668 [1,0,0,0,0,0|2,0,1]=4 332 B13R1.575 COc1cc(ccc1F)SCC=O 62a_200015260668_100011934186 [1,0,0,0,0,0|2,0,1]=4 333 B13R1.575 COc1cc(ccc1I)NCC=O 34a_100000746945_200009817547 [1,0,0,0,0,0|2,0,1]=4 334 B13R1.575 COc1cc(ccc1N)OCC=O 34a_100015326901_200009817547 [1,0,0,0,0,0|2,0,1]=4 335 B13R1.575 COc1cc(ccc1N)OCC=O 7a_100015326901_200015260668 [1,0,0,0,0,0|2,0,1]=4 336 B13R1.575 COc1cc(ccc1N)SCC=O 62a_100011279103_200015260668 [1,0,0,0,0,0|2,0,1]=4 337 B13R1.575 COc1cc(ccc1N)SCC=O 62a_200015260668_100015196925 [1,0,0,0,0,0|2,0,1]=4 338 B13R1.575 COc1cc(ccc1O)CCN[13CH3] 34a_100000756042_200025704644 [1,0,0,0,0,0|1,0,2]=4 339 B13R1.575 COc1cc(ccc1O)CCSC 62a_200000210301_100010741665 [1,0,0,0,0,0|1,0,2]=4 340 B13R1.575 COc1cc(ccc1O)CCS[13CH3] 62a_200025704644_100010741665 [1,0,0,0,0,0|1,0,2]=4 341 B13R1.575 COc1cc(ccc1O)NCC=O 34a_100000726020_200009817547 [1,0,0,0,0,0|1,0,1]=3 342 B13R1.575 COc1cc(ccc1O)NCSC 34a_100000726020_100011218213 [1,0,0,0,0,0|2,0,1]=4 343 B13R1.575 COc1cc(ccc1O)SCC=O 62a_200015260668_100000694246 [1,0,0,0,0,0|1,0,1]=3 344 B13R1.575 COc1cc(ccc1O)SCSC 62a_100011218213_100000694246 [1,0,0,0,0,0|2,0,1]=4 345 B13R1.575 COc1nc(ccc1O)SCC=O 62a_200015260668_100010893133 [1,0,0,0,0,0|2,0,1]=4 346 B13R1.643 C=C(C)CNc1cccc(c1)OC 34a_100000210024_100000748629 [1,0,0,0,0,0|2,0,1]=4 347 B13R1.643 C=C(C)COc1cccc(c1)OC 34a_100000211255_100000748629 [1,0,0,0,0,0|2,0,1]=4 348 B13R1.643 C=C(C)COc1cccc(c1)OC 7a_100000211255_100000748629 [1,0,0,0,0,0|2,0,1]=4 349 B13R1.643 C=C(C)CSc1cccc(c1)OC 62a_100000748629_100000170001 [1,0,0,0,0,0|2,0,1]=4 350 B13R1.643 C=Cc1cccc(c1)/C=C/C(=O)C 271570a_100011290941_200016266566 [1,0,0,0,0,0|1,0,1]=3 351 B13R1.643 CC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200016266566_200025704644 [1,0,0,0,0,0|0,1,0]=2 352 B13R1.643 CC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200025704644_200016266566 [1,0,0,0,0,0|0,1,0]=2 353 B13R1.643 CC(=O)C=Cc1cccc(c1)C#N 1458a_100000738773_200000210301 [1,0,0,0,0,0|2,0,0]=3 354 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_100011279149_200025704644 [1,0,0,0,0,0|0,1,2]=4 355 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_200025704644_100011279149 [1,0,0,0,0,0|0,1,2]=4 356 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_100000766983_200025704644 [1,0,0,0,0,0|1,1,1]=4 357 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_200025704644_100000766983 [1,0,0,0,0,0|1,1,1]=4 358 B13R1.643 CCc1cccc(c1)C=CC(C)C 271570a_100016257149_100000684523 [1,0,0,0,0,0|2,0,1]=4 359 B13R1.643 CCc1cccc(c1)C=CC(C)O 271570a_200011019289_100000684523 [1,0,0,0,0,0|1,0,2]=4 360 B13R1.643 CNc1cccc(c1)C=CC(C)C 271570a_100016257149_100000219648 [1,0,0,0,0,0|2,0,1]=4 361 B13R1.643 CNc1cccc(c1)C=CC(C)O 271570a_200011019289_100000219648 [1,0,0,0,0,0|1,0,2]=4 362 B13R1.643 COc1cc(ccn1)C=CC(C)C 271570a_100016257149_100000117307 [1,0,0,0,0,0|2,0,1]=4 363 B13R1.643 COc1cc(ccn1)C=CC(C)O 271570a_200011019289_100000117307 [1,0,0,0,0,0|1,0,2]=4 364 B13R1.643 COc1cc(ccn1)CNC(=O)C 11a_100102525109_100015343762 [1,0,0,0,0,0|2,0,1]=4 365 B13R1.643 COc1cc(ccn1)CNC(=O)C 1626a_100102525109_100015343762 [1,0,0,0,0,0|2,0,1]=4 366 B13R1.643 COc1cc(ccn1)CNC(=O)C 240690a_100102525109_100015343762 [1,0,0,0,0,0|2,0,1]=4 367 B13R1.643 COc1cc(ccn1)CNC(=O)C 527a_100102525109_100103153847 [1,0,0,0,0,0|2,0,1]=4 368 B13R1.643 COc1cccc(c1)C=CC(C)C 271570a_100016257149_100000170001 [1,0,0,0,0,0|1,0,1]=3 369 B13R1.643 COc1cccc(c1)C=CC(C)O 271570a_200011019289_100000170001 [1,0,0,0,0,0|0,0,2]=3 370 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000070787_100011713679 [1,0,0,0,0,0|0,0,2]=3 371 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000234931_200000210301 [1,0,0,0,0,0|0,0,2]=3 372 B13R1.643 COc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234931_200025704644 [1,0,0,0,0,0|0,0,2]=3 373 B13R1.643 COc1cccc(c1)CNC(=O)C 11a_100000174954_100015343762 [1,0,0,0,0,0|1,0,1]=3 374 B13R1.643 COc1cccc(c1)CNC(=O)C 1626a_100000174954_100015343762 [1,0,0,0,0,0|1,0,1]=3 375 B13R1.643 COc1cccc(c1)CNC(=O)C 240690a_100000174954_100015343762 [1,0,0,0,0,0|1,0,1]=3 376 B13R1.643 COc1cccc(c1)CNC(=O)C 527a_100000174954_100103153847 [1,0,0,0,0,0|1,0,1]=3 377 B13R1.643 COc1cccc(c1)NCC(=O)N 34a_100000210024_100000187820 [1,0,0,0,0,0|2,0,1]=4 378 B13R1.643 COc1cccc(c1)NCC(=O)[O-] 34a_100000210024_100020667443 [1,0,0,0,0,0|2,0,1]=4 379 B13R1.643 COc1cccc(c1)NNC(=O)C 22a_100000722927_100000070787 [1,0,0,0,0,0|2,0,0]=3 380 B13R1.643 COc1cccc(c1)OCC(=O)C 1458a_100000182123_200000210301 [1,0,0,0,0,0|1,0,1]=3 381 B13R1.643 COc1cccc(c1)OCC(=O)N 34a_100000211255_100000187820 [1,0,0,0,0,0|2,0,1]=4 382 B13R1.643 COc1cccc(c1)OCC(=O)N 7a_100000211255_100000187820 [1,0,0,0,0,0|2,0,1]=4 383 B13R1.643 COc1cccc(c1)OCC(=O)[13CH3] 1458a_100000182123_200025704644 [1,0,0,0,0,0|1,0,1]=3 384 B13R1.643 COc1cccc(c1)OCC(=O)[O-] 34a_100000211255_100020667443 [1,0,0,0,0,0|2,0,1]=4 385 B13R1.643 COc1cccc(c1)SCC(=O)C 1458a_100000741315_200000210301 [1,0,0,0,0,0|1,0,1]=3 386 B13R1.643 COc1cccc(c1)SCC(=O)N 62a_100000747473_100000170001 [1,0,0,0,0,0|2,0,1]=4 387 B13R1.643 COc1cccc(c1)SCC(=O)[13CH3] 1458a_100000741315_200025704644 [1,0,0,0,0,0|1,0,1]=3 388 B13R1.643 COc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000170001 [1,0,0,0,0,0|2,0,1]=4 389 B13R1.643 COc1cccc(n1)C=CC(C)C 271570a_100016257149_100000760917 [1,0,0,0,0,0|2,0,1]=4 390 B13R1.643 COc1cccc(n1)C=CC(C)O 271570a_200011019289_100000760917 [1,0,0,0,0,0|1,0,2]=4 391 B13R1.643 COc1cccc(n1)CNC(=O)C 11a_100000746380_100015343762 [1,0,0,0,0,0|2,0,1]=4 392 B13R1.643 COc1cccc(n1)CNC(=O)C 1626a_100000746380_100015343762 [1,0,0,0,0,0|2,0,1]=4 393 B13R1.643 COc1cccc(n1)CNC(=O)C 240690a_100000746380_100015343762 [1,0,0,0,0,0|2,0,1]=4 394 B13R1.643 COc1cccc(n1)CNC(=O)C 527a_100000746380_100103153847 [1,0,0,0,0,0|2,0,1]=4 395 B13R1.643 COc1cccc(n1)NNC(=O)C 22a_100000698482_100000070787 [1,0,0,0,0,0|3,0,0]=4 396 B13R1.643 COc1ccnc(c1)C=CC(C)C 271570a_100016257149_100011216251 [1,0,0,0,0,0|2,0,1]=4 397 B13R1.643 COc1ccnc(c1)C=CC(C)O 271570a_200011019289_100011216251 [1,0,0,0,0,0|1,0,2]=4 398 B13R1.643 COc1ccnc(c1)CNC(=O)C 11a_100000706253_100015343762 [1,0,0,0,0,0|2,0,1]=4 399 B13R1.643 COc1ccnc(c1)CNC(=O)C 1626a_100000706253_100015343762 [1,0,0,0,0,0|2,0,1]=4 400 B13R1.643 COc1ccnc(c1)CNC(=O)C 240690a_100000706253_100015343762 [1,0,0,0,0,0|2,0,1]=4 401 B13R1.643 COc1ccnc(c1)CNC(=O)C 527a_100000706253_100103153847 [1,0,0,0,0,0|2,0,1]=4 402 B13R1.643 COc1cncc(c1)C=CC(C)C 271570a_100016257149_100000684773 [1,0,0,0,0,0|2,0,1]=4 403 B13R1.643 COc1cncc(c1)C=CC(C)O 271570a_200011019289_100000684773 [1,0,0,0,0,0|1,0,2]=4 404 B13R1.643 COc1cncc(c1)CNC(=O)C 11a_100020589029_100015343762 [1,0,0,0,0,0|2,0,1]=4 405 B13R1.643 COc1cncc(c1)CNC(=O)C 240690a_100020589029_100015343762 [1,0,0,0,0,0|2,0,1]=4 406 B13R1.643 COc1cncc(c1)CNC(=O)C 527a_100020589029_100103153847 [1,0,0,0,0,0|2,0,1]=4 407 B13R1.643 CSc1cccc(c1)/C=C/C(=O)C 62a_200000210301_200016266566 [1,0,0,0,0,0|0,1,0]=2 408 B13R1.643 CSc1cccc(c1)/C=C/C(=O)C 62a_200016266566_200000210301 [1,0,0,0,0,0|0,1,0]=2 409 B13R1.643 CSc1cccc(c1)C=CC(C)C 271570a_100016257149_100011215954 [1,0,0,0,0,0|1,1,1]=4 410 B13R1.643 CSc1cccc(c1)C=CC(C)O 271570a_200011019289_100011215954 [1,0,0,0,0,0|0,1,2]=4 411 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_100011279149_200000210301 [1,0,0,0,0,0|0,1,2]=4 412 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_200000210301_100011279149 [1,0,0,0,0,0|0,1,2]=4 413 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_100000766983_200000210301 [1,0,0,0,0,0|1,1,1]=4 414 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_200000210301_100000766983 [1,0,0,0,0,0|1,1,1]=4 415 B13R1.643 [13CH3]C(=O)C=Cc1cccc(c1)C#N 1458a_100000738773_200025704644 [1,0,0,0,0,0|2,0,0]=3 416 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)O)O 62a_100000748629_200159242197 [0,1,0,0,0,0|2,0,1]=4 417 B15R1.392 CCc1cc(cc(c1O)C)C=CC(C)C 271570a_100016257149_100010659108 [0,1,0,0,0,0|2,0,1]=4 418 B15R1.392 CCc1cc(cc(c1O)C)C=CC(C)O 271570a_200011019289_100010659108 [0,1,0,0,0,0|1,0,2]=4 419 B15R1.392 COc1cc(cc(c1F)C)C=CC(C)C 271570a_100016257149_100010271686 [0,1,0,0,0,0|2,0,1]=4 420 B15R1.392 COc1cc(cc(c1F)C)C=CC(C)O 271570a_200011019289_100010271686 [0,1,0,0,0,0|1,0,2]=4 421 B15R1.392 COc1cc(cc(c1F)F)C=CC(C)C 271570a_100016257149_100011218012 [0,1,0,0,0,0|2,0,1]=4 422 B15R1.392 COc1cc(cc(c1F)F)C=CC(C)O 271570a_200011019289_100011218012 [0,1,0,0,0,0|1,0,2]=4 423 B15R1.392 COc1cc(cc(c1F)O)C=CC(C)C 271570a_100016257149_200015524394 [0,1,0,0,0,0|2,0,1]=4 424 B15R1.392 COc1cc(cc(c1F)O)C=CC(C)O 271570a_200011019289_200015524394 [0,1,0,0,0,0|1,0,2]=4 425 B15R1.392 COc1cc(cc(c1N)C)C=CC(C)C 271570a_100016257149_100000741850 [0,1,0,0,0,0|2,0,1]=4 426 B15R1.392 COc1cc(cc(c1N)C)C=CC(C)O 271570a_200011019289_100000741850 [0,1,0,0,0,0|1,0,2]=4 427 B15R1.392 COc1cc(cc(c1O)Br)C=CC(=O)C 1458a_100015195021_200000210301 [0,1,0,0,0,0|0,0,0]=1 428 B15R1.392 COc1cc(cc(c1O)Br)C=CC(=O)[13CH3] 1458a_100015195021_200025704644 [0,1,0,0,0,0|0,0,0]=1 429 B15R1.392 COc1cc(cc(c1O)I)C=CC(=O)C 1458a_200021160827_200000210301 [0,1,0,0,0,0|0,0,0]=1 430 B15R1.392 COc1cc(cc(c1O)I)C=CC(=O)[13CH3] 1458a_200021160827_200025704644 [0,1,0,0,0,0|0,0,0]=1 431 B15R1.392 COc1cc(cc(c1O)O)SCC(=O)N 62a_100000747473_200159242197 [0,1,0,0,0,0|2,0,1]=4 432 B15R1.392 COc1cc(cc(c1O)O)SCC(=O)[O-] 62a_100020667443_200159242197 [0,1,0,0,0,0|2,0,1]=4 433 B15R1.531 CCOc1cc(ccc1C)C=CC(C)C 271570a_100016257149_100012361169 [0,1,0,0,0,0|2,0,1]=4 434 B15R1.531 CCOc1cc(ccc1C)C=CC(C)O 271570a_200011019289_100012361169 [0,1,0,0,0,0|1,0,2]=4 435 B15R1.531 CCOc1cc(ccc1F)C=CC(C)C 271570a_100016257149_200012344967 [0,1,0,0,0,0|2,0,1]=4 436 B15R1.531 CCOc1cc(ccc1F)C=CC(C)O 271570a_200011019289_200012344967 [0,1,0,0,0,0|1,0,2]=4 437 B15R1.531 CCOc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100000688918 [0,1,0,0,0,0|2,0,1]=4 438 B15R1.531 CCOc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100000688918 [0,1,0,0,0,0|1,0,2]=4 439 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 11a_200000751567_100015343762 [0,1,0,0,0,0|1,0,1]=3 440 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 240690a_200000751567_100015343762 [0,1,0,0,0,0|1,0,1]=3 441 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 527a_200000751567_100103153847 [0,1,0,0,0,0|1,0,1]=3 442 B15R1.531 CNCc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100011602694 [0,1,0,0,0,0|2,0,1]=4 443 B15R1.531 CNCc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100011602694 [0,1,0,0,0,0|1,0,2]=4 444 B15R1.531 COCc1cc(ccc1Br)C=CC(C)C 271570a_100016257149_202125822959 [0,1,0,0,0,0|2,0,1]=4 445 B15R1.531 COCc1cc(ccc1Br)C=CC(C)O 271570a_200011019289_202125822959 [0,1,0,0,0,0|1,0,2]=4 446 B15R1.531 COCc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100010140362 [0,1,0,0,0,0|2,0,1]=4 447 B15R1.531 COCc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100010140362 [0,1,0,0,0,0|1,0,2]=4 448 B15R1.873 CC(=O)C=Cc1ccc(c(c1)[N+](=O)[O-])Cl 1458a_100016263400_200000210301 [0,1,0,0,0,0|3,0,0]=4 449 B15R1.873 CC(=O)C=Cc1ccc(c(c1)[N+](=O)[O-])F 1458a_200132309682_200000210301 [0,1,0,0,0,0|3,0,0]=4 450 B15R1.873 CC(=O)c1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000212127 [0,1,0,0,0,0|2,0,1]=4 451 B15R1.873 CC(=O)c1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000212127 [0,1,0,0,0,0|1,0,2]=4 452 B15R1.873 CC(C)C=Cc1ccc(c(c1)C(C)C)O 271570a_100016257149_100000691460 [0,1,0,0,0,0|2,0,1]=4 453 B15R1.873 CC(O)C=Cc1ccc(c(c1)C(C)C)O 271570a_200011019289_100000691460 [0,1,0,0,0,0|1,0,2]=4 454 B15R1.873 [13CH3]C(=O)C=Cc1ccc(c(c1)[N+](=O)[O-])Cl 1458a_100016263400_200025704644 [0,1,0,0,0,0|3,0,0]=4 455 B15R1.873 [13CH3]C(=O)C=Cc1ccc(c(c1)[N+](=O)[O-])F 1458a_200132309682_200025704644 [0,1,0,0,0,0|3,0,0]=4 456 B15R1.1803 C=C(C)CSc1cc(c(cc1F)O)OC 62a_100000748629_100010189133 [0,1,0,0,0,0|2,0,1]=4 457 B15R1.1803 COc1cc(c(cc1Br)Br)C=CC(C)C 271570a_100016257149_200014006352 [0,1,0,0,0,0|2,0,1]=4 458 B15R1.1803 COc1cc(c(cc1Br)Br)C=CC(C)O 271570a_200011019289_200014006352 [0,1,0,0,0,0|1,0,2]=4 459 B15R1.1803 COc1cc(c(cc1C)N)C=CC(C)C 271570a_100016257149_200010584344 [0,1,0,0,0,0|2,0,1]=4 460 B15R1.1803 COc1cc(c(cc1C)N)C=CC(C)O 271570a_200011019289_200010584344 [0,1,0,0,0,0|1,0,2]=4 461 B15R1.1803 COc1cc(c(cc1Cl)F)C=CC(C)C 271570a_100016257149_100010739614 [0,1,0,0,0,0|2,0,1]=4 462 B15R1.1803 COc1cc(c(cc1Cl)F)C=CC(C)O 271570a_200011019289_100010739614 [0,1,0,0,0,0|1,0,2]=4 463 B15R1.1803 COc1cc(c(cc1F)C)C=CC(C)C 271570a_100016257149_100011009880 [0,1,0,0,0,0|2,0,1]=4 464 B15R1.1803 COc1cc(c(cc1F)C)C=CC(C)O 271570a_200011019289_100011009880 [0,1,0,0,0,0|1,0,2]=4 465 B15R1.1803 COc1cc(c(cc1F)F)C=CC(C)C 271570a_100016257149_200015541288 [0,1,0,0,0,0|2,0,1]=4 466 B15R1.1803 COc1cc(c(cc1F)F)C=CC(C)O 271570a_200011019289_200015541288 [0,1,0,0,0,0|1,0,2]=4 467 B15R1.1803 COc1cc(c(cc1F)N)C=CC(C)C 271570a_100016257149_100010365326 [0,1,0,0,0,0|2,0,1]=4 468 B15R1.1803 COc1cc(c(cc1F)N)C=CC(C)O 271570a_200011019289_100010365326 [0,1,0,0,0,0|1,0,2]=4 469 B15R1.1803 COc1cc(c(cc1N)C)C=CC(C)C 271570a_100016257149_100010141321 [0,1,0,0,0,0|2,0,1]=4 470 B15R1.1803 COc1cc(c(cc1N)C)C=CC(C)O 271570a_200011019289_100010141321 [0,1,0,0,0,0|1,0,2]=4 471 B15R1.1803 COc1cc(c(cc1N)F)C=CC(C)C 271570a_100016257149_100012766639 [0,1,0,0,0,0|2,0,1]=4 472 B15R1.1803 COc1cc(c(cc1N)F)C=CC(C)O 271570a_200011019289_100012766639 [0,1,0,0,0,0|1,0,2]=4 473 B15R1.1803 COc1cc(c(cc1O)F)C=CC(C)C 271570a_100016257149_100010189133 [0,1,0,0,0,0|1,0,1]=3 474 B15R1.1803 COc1cc(c(cc1O)F)C=CC(C)O 271570a_200011019289_100010189133 [0,1,0,0,0,0|0,0,2]=3 475 B15R1.1803 COc1cc(c(cc1O)F)SCC(=O)N 62a_100000747473_100010189133 [0,1,0,0,0,0|2,0,1]=4 476 B15R1.1803 COc1cc(c(cc1O)F)SCC(=O)[O-] 62a_100020667443_100010189133 [0,1,0,0,0,0|2,0,1]=4 477 B15R1.4027 CCc1cc(ccc1O)C=CC(C)(C)C 271570a_100102527731_100012338938 [0,1,0,0,0,0|2,0,1]=4 478 B15R1.4027 CCc1cc(ccc1O)C=CC(C)(C)O 271570a_200016258132_100012338938 [0,1,0,0,0,0|1,0,2]=4 479 B15R1.4027 COc1cc(ccc1Br)C=CC(C)(C)C 271570a_100102527731_100012353699 [0,1,0,0,0,0|2,0,1]=4 480 B15R1.4027 COc1cc(ccc1Br)C=CC(C)(C)O 271570a_200016258132_100012353699 [0,1,0,0,0,0|1,0,2]=4 481 B15R1.4027 COc1cc(ccc1C)C=CC(C)(C)C 271570a_100102527731_100011830276 [0,1,0,0,0,0|2,0,1]=4 482 B15R1.4027 COc1cc(ccc1C)C=CC(C)(C)O 271570a_200016258132_100011830276 [0,1,0,0,0,0|1,0,2]=4 483 B15R1.4027 COc1cc(ccc1Cl)C=CC(C)(C)C 271570a_100102527731_100011356853 [0,1,0,0,0,0|2,0,1]=4 484 B15R1.4027 COc1cc(ccc1Cl)C=CC(C)(C)O 271570a_200016258132_100011356853 [0,1,0,0,0,0|1,0,2]=4 485 B15R1.4027 COc1cc(ccc1F)C=CC(C)(C)C 271570a_100102527731_100011934186 [0,1,0,0,0,0|2,0,1]=4 486 B15R1.4027 COc1cc(ccc1F)C=CC(C)(C)O 271570a_200016258132_100011934186 [0,1,0,0,0,0|1,0,2]=4 487 B15R1.4027 COc1cc(ccc1N)C=CC(C)(C)C 271570a_100102527731_100011279103 [0,1,0,0,0,0|2,0,1]=4 488 B15R1.4027 COc1cc(ccc1N)C=CC(C)(C)O 271570a_200016258132_100011279103 [0,1,0,0,0,0|1,0,2]=4 489 B15R1.4027 COc1cc(ccc1O)C=CC(C)(C)C 271570a_100102527731_100000694246 [0,1,0,0,0,0|1,0,1]=3 490 B15R1.4027 COc1cc(ccc1O)C=CC(C)(C)O 271570a_200016258132_100000694246 [0,1,0,0,0,0|0,0,2]=3 491 B15R1.4027 COc1cc(ccc1O)CNS(=O)(=O)C 40a_100000185554_100000738038 [0,1,0,0,0,0|2,0,1]=4 492 B15R1.4027 COc1nc(ccc1O)C=CC(C)(C)C 271570a_100102527731_100010893133 [0,1,0,0,0,0|2,0,1]=4 493 B15R1.4027 COc1nc(ccc1O)C=CC(C)(C)O 271570a_200016258132_100010893133 [0,1,0,0,0,0|1,0,2]=4 494 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000748629 [0,1,0,0,0,0|2,0,1]=4 495 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000748629 [0,1,0,0,0,0|2,0,1]=4 496 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000748629 [0,1,0,0,0,0|2,0,1]=4 497 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000748629 [0,1,0,0,0,0|2,0,1]=4 498 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000748629 [0,1,0,0,0,0|2,0,1]=4 499 B15R1.4037 C=C(C)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000748629 [0,1,0,0,0,0|1,0,1]=3 500 B15R1.4037 C=C(F)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100009893438 [0,1,0,0,0,0|1,0,2]=4 501 B15R1.4037 CC(=O)CC(=O)c1ccc(c(c1)CO)O 1458a_100000070787_100010262812 [0,1,0,0,0,0|2,0,1]=4 502 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(=O)C 1458a_100000070787_200010710740 [0,1,0,0,0,0|1,0,1]=3 503 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(=O)N 1458a_100011934951_100000187820 [0,1,0,0,0,0|2,0,1]=4 504 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(=O)[O-] 1458a_100011934951_100020667443 [0,1,0,0,0,0|2,0,1]=4 505 B15R1.4037 COc1cc(ccc1C)C(=O)CC(=O)N 1458a_100000212341_100000187820 [0,1,0,0,0,0|2,0,1]=4 506 B15R1.4037 COc1cc(ccc1C)C(=O)CC(=O)[O-] 1458a_100000212341_100020667443 [0,1,0,0,0,0|2,0,1]=4 507 B15R1.4037 COc1cc(ccc1Cl)C(=O)CC(=O)N 1458a_100000181799_100000187820 [0,1,0,0,0,0|2,0,1]=4 508 B15R1.4037 COc1cc(ccc1Cl)C(=O)CC(=O)[O-] 1458a_100000181799_100020667443 [0,1,0,0,0,0|2,0,1]=4 509 B15R1.4037 COc1cc(ccc1F)C(=O)CC(=O)C 1458a_100000070787_200012348595 [0,1,0,0,0,0|1,0,1]=3 510 B15R1.4037 COc1cc(ccc1F)C(=O)CC(=O)N 1458a_100000757635_100000187820 [0,1,0,0,0,0|2,0,1]=4 511 B15R1.4037 COc1cc(ccc1F)C(=O)CC(=O)[O-] 1458a_100000757635_100020667443 [0,1,0,0,0,0|2,0,1]=4 512 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 11a_100025717271_100015343762 [0,1,0,0,0,0|2,0,1]=4 513 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 1626a_100025717271_100015343762 [0,1,0,0,0,0|2,0,1]=4 514 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 240690a_100025717271_100015343762 [0,1,0,0,0,0|2,0,1]=4 515 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 527a_100025717271_100103153847 [0,1,0,0,0,0|2,0,1]=4 516 B15R1.4037 COc1cc(ccc1I)C(=O)CC(=O)N 1458a_100012356290_100000187820 [0,1,0,0,0,0|2,0,1]=4 517 B15R1.4037 COc1cc(ccc1I)C(=O)CC(=O)[O-] 1458a_100012356290_100020667443 [0,1,0,0,0,0|2,0,1]=4 518 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)C 1458a_100000070787_100010206313 [0,1,0,0,0,0|0,0,1]=2 519 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)N 1458a_100000687070_100000187820 [0,1,0,0,0,0|1,0,1]=3 520 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)[O-] 1458a_100000687070_100020667443 [0,1,0,0,0,0|1,0,1]=3 521 B15R1.4037 COc1cc(ccc1O)C(=O)CC(C)C 1458a_100000687070_100000210624 [0,1,0,0,0,0|1,0,2]=4 522 B15R1.4037 COc1cc(ccc1O)C(=O)CC(C)O 1458a_100000687070_100011218427 [0,1,0,0,0,0|0,0,3]=4 523 B15R1.4037 COc1cc(ccc1O)C(=O)CN(C)C 269982a_100102631434_100010206313 [0,1,0,0,0,0|2,0,1]=4 524 B15R1.4037 COc1cc(ccc1O)C(=O)C[N+](=O)[O-] 1458a_100000687070_100000761209 [0,1,0,0,0,0|2,0,1]=4 525 B15R1.4037 COc1cc(ccc1O)C(=O)NC(C)C 240690a_100138425928_100000687070 [0,1,0,0,0,0|2,0,1]=4 526 B15R1.4037 COc1cc(ccc1O)C(=O)NC(C)C 271570a_203496583355_200010239583 [0,1,0,0,0,0|2,0,1]=4 527 B15R1.4038 C=C(C)C(=O)Cc1ccc(c(c1)OC)Br 1458a_100000185857_100010110085 [0,1,0,0,0,0|2,0,1]=4 528 B15R1.4038 C=C(C)C(=O)Cc1ccc(c(c1)OC)Cl 1458a_100000185857_200010214485 [0,1,0,0,0,0|2,0,1]=4 529 B15R1.4038 C=C(C)C(=O)Cc1ccc(c(c1)OC)F 1458a_100000185857_100012349856 [0,1,0,0,0,0|2,0,1]=4 530 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)Br 11a_100000765947_100000185857 [0,1,0,0,0,0|3,0,0]=4 531 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)Br 1626a_100000765947_100000185857 [0,1,0,0,0,0|3,0,0]=4 532 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)Br 22a_100000765947_100000185857 [0,1,0,0,0,0|3,0,0]=4 533 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)C 11a_100011279678_100000185857 [0,1,0,0,0,0|3,0,0]=4 534 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)C 1626a_100011279678_100000185857 [0,1,0,0,0,0|3,0,0]=4 535 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)C 22a_100011279678_100000185857 [0,1,0,0,0,0|3,0,0]=4 536 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)Cl 11a_100000742311_100000185857 [0,1,0,0,0,0|3,0,0]=4 537 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)Cl 1626a_100000742311_100000185857 [0,1,0,0,0,0|3,0,0]=4 538 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)Cl 22a_100000742311_100000185857 [0,1,0,0,0,0|3,0,0]=4 539 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)F 11a_100000701188_100000185857 [0,1,0,0,0,0|3,0,0]=4 540 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)F 1626a_100000701188_100000185857 [0,1,0,0,0,0|3,0,0]=4 541 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)F 22a_100000701188_100000185857 [0,1,0,0,0,0|3,0,0]=4 542 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)I 11a_100000746945_100000185857 [0,1,0,0,0,0|3,0,0]=4 543 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)I 1626a_100000746945_100000185857 [0,1,0,0,0,0|3,0,0]=4 544 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)I 22a_100000746945_100000185857 [0,1,0,0,0,0|3,0,0]=4 545 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000185857 [0,1,0,0,0,0|2,0,0]=3 546 B15R1.4038 C=C(Cl)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000039160 [0,1,0,0,0,0|2,0,1]=4 547 B15R1.4038 C=C(F)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000036797 [0,1,0,0,0,0|2,0,1]=4 548 B15R1.4038 CCc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100012338938 [0,1,0,0,0,0|2,0,1]=4 549 B15R1.4038 COc1cc(ccc1Br)NC(=O)C(=O)N 22a_100000765947_100011215815 [0,1,0,0,0,0|3,0,0]=4 550 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)C 2230a_100000765947_100009814033 [0,1,0,0,0,0|2,0,1]=4 551 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)C 7a_100011827694_100000179758 [0,1,0,0,0,0|2,0,1]=4 552 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)C 62a_100009814033_100012353699 [0,1,0,0,0,0|2,0,1]=4 553 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)C 62a_100012353699_100009814033 [0,1,0,0,0,0|2,0,1]=4 554 B15R1.4038 COc1cc(ccc1C)NC(=O)C(=O)N 22a_100011279678_100011215815 [0,1,0,0,0,0|3,0,0]=4 555 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)C 2230a_100011279678_100009814033 [0,1,0,0,0,0|2,0,1]=4 556 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)C 7a_100009865632_100000179758 [0,1,0,0,0,0|2,0,1]=4 557 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)C 62a_100009814033_100011830276 [0,1,0,0,0,0|2,0,1]=4 558 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)C 62a_100011830276_100009814033 [0,1,0,0,0,0|2,0,1]=4 559 B15R1.4038 COc1cc(ccc1Cl)NC(=O)C(=O)N 22a_100000742311_100011215815 [0,1,0,0,0,0|3,0,0]=4 560 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)C 2230a_100000742311_100009814033 [0,1,0,0,0,0|2,0,1]=4 561 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)C 7a_100012186310_100000179758 [0,1,0,0,0,0|2,0,1]=4 562 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)C 62a_100009814033_100011356853 [0,1,0,0,0,0|2,0,1]=4 563 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)C 62a_100011356853_100009814033 [0,1,0,0,0,0|2,0,1]=4 564 B15R1.4038 COc1cc(ccc1F)NC(=O)C(=O)N 22a_100000701188_100011215815 [0,1,0,0,0,0|3,0,0]=4 565 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)C 2230a_100000701188_100009814033 [0,1,0,0,0,0|2,0,1]=4 566 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)C 7a_100012001760_100000179758 [0,1,0,0,0,0|2,0,1]=4 567 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100011934186 [0,1,0,0,0,0|2,0,1]=4 568 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)C 62a_100011934186_100009814033 [0,1,0,0,0,0|2,0,1]=4 569 B15R1.4038 COc1cc(ccc1I)NC(=O)C(=O)N 22a_100000746945_100011215815 [0,1,0,0,0,0|3,0,0]=4 570 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)C 7a_100015326901_100000179758 [0,1,0,0,0,0|2,0,1]=4 571 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)C 62a_100009814033_100015196925 [0,1,0,0,0,0|2,0,1]=4 572 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)C 62a_100011279103_100009814033 [0,1,0,0,0,0|2,0,1]=4 573 B15R1.4038 COc1cc(ccc1O)CC(=O)C(C)C 1458a_100000032101_100000210206 [0,1,0,0,0,0|1,0,2]=4 574 B15R1.4038 COc1cc(ccc1O)CC(=O)N(C)C 240690a_100102631434_100000032101 [0,1,0,0,0,0|2,0,1]=4 575 B15R1.4038 COc1cc(ccc1O)CC(=O)N(C)C 527a_100102631434_100000032101 [0,1,0,0,0,0|2,0,1]=4 576 B15R1.4038 COc1cc(ccc1O)NC(=O)C(=O)N 22a_100000726020_100011215815 [0,1,0,0,0,0|2,0,0]=3 577 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)C 22a_100000726020_100000210198 [0,1,0,0,0,0|2,0,1]=4 578 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)C 527a_100000726020_100000210198 [0,1,0,0,0,0|2,0,1]=4 579 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)F 22a_100000726020_100000062450 [0,1,0,0,0,0|2,0,1]=4 580 B15R1.4038 COc1cc(ccc1O)NC(=O)C(C)F 527a_100000726020_100000062450 [0,1,0,0,0,0|2,0,1]=4 581 B15R1.4038 COc1cc(ccc1O)NC(=O)N(C)C 2430a_100000726020_100102631434 [0,1,0,0,0,0|3,0,0]=4 582 B15R1.4038 COc1cc(ccc1O)NC(=O)[C@@H](C)O 22a_100000726020_100000717761 [0,1,0,0,0,0|1,0,2]=4 583 B15R1.4038 COc1cc(ccc1O)NC(=O)[C@H](C)O 22a_100000726020_217856618621 [0,1,0,0,0,0|1,0,2]=4 584 B15R1.4038 COc1cc(ccc1O)NC(C)C(=O)N 34a_100000726020_100000702099 [0,1,0,0,0,0|2,0,1]=4 585 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)N 34a_100000726020_100009813875 [0,1,0,0,0,0|2,0,1]=4 586 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)[O-] 34a_100000726020_100020610796 [0,1,0,0,0,0|2,0,1]=4 587 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100000694246 [0,1,0,0,0,0|1,0,1]=3 588 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000694246 [0,1,0,0,0,0|2,0,1]=4 589 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000694246 [0,1,0,0,0,0|2,0,1]=4 590 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000694246 [0,1,0,0,0,0|2,0,1]=4 591 B15R1.4038 COc1nc(ccc1O)SC(C)C(=O)C 62a_100009814033_100010893133 [0,1,0,0,0,0|2,0,1]=4 592 B15R1.4039 C#CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000211873_100010741665 [0,1,0,0,0,0|0,0,3]=4 593 B15R1.4039 C=CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000185746_100010741665 [0,1,0,0,0,0|0,0,3]=4 594 B15R1.4039 C=CC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_200121576911 [0,1,0,0,0,0|1,0,2]=4 595 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)C#N)Br 6a_100010128726_100000211110 [0,1,0,0,0,0|3,0,0]=4 596 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)C#N)C 6a_100012017333_100000211110 [0,1,0,0,0,0|3,0,0]=4 597 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)C#N)Cl 6a_100009841870_100000211110 [0,1,0,0,0,0|3,0,0]=4 598 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)C#N)F 6a_100000690697_100000211110 [0,1,0,0,0,0|3,0,0]=4 599 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)Br 1458a_100016267305_100000210202 [0,1,0,0,0,0|1,0,0]=2 600 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)C 6a_100000719150_100000211110 [0,1,0,0,0,0|1,0,0]=2 601 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)Cl 6a_100011998524_100000211110 [0,1,0,0,0,0|1,0,0]=2 602 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)F 6a_100000692873_100000211110 [0,1,0,0,0,0|1,0,0]=2 603 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000210202 [0,1,0,0,0,0|0,0,0]=1 604 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)C 1458a_200000066385_100000210202 [0,1,0,0,0,0|1,0,2]=4 605 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)F 1458a_100009849056_100000210202 [0,1,0,0,0,0|1,0,2]=4 606 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210414_100010741665 [0,1,0,0,0,0|0,0,2]=3 607 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210202 [0,1,0,0,0,0|0,0,2]=3 608 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000747405 [0,1,0,0,0,0|2,0,1]=4 609 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000747405 [0,1,0,0,0,0|2,0,1]=4 610 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000747405 [0,1,0,0,0,0|2,0,1]=4 611 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000747405 [0,1,0,0,0,0|2,0,1]=4 612 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000747405 [0,1,0,0,0,0|2,0,1]=4 613 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)O 62a_100000747405_100012338938 [0,1,0,0,0,0|2,0,1]=4 614 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Br 62a_100000747405_100012353699 [0,1,0,0,0,0|2,0,1]=4 615 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000747405 [0,1,0,0,0,0|2,0,1]=4 616 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)C 62a_100000747405_100011830276 [0,1,0,0,0,0|2,0,1]=4 617 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000747405 [0,1,0,0,0,0|2,0,1]=4 618 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000747405_100011356853 [0,1,0,0,0,0|2,0,1]=4 619 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000747405 [0,1,0,0,0,0|2,0,1]=4 620 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)F 62a_100000747405_100011934186 [0,1,0,0,0,0|2,0,1]=4 621 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000747405 [0,1,0,0,0,0|2,0,1]=4 622 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)N 62a_100000747405_100015196925 [0,1,0,0,0,0|2,0,1]=4 623 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000747405 [0,1,0,0,0,0|2,0,1]=4 624 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)O 62a_100000747405_100000694246 [0,1,0,0,0,0|1,0,1]=3 625 B15R1.4039 CCC(=O)CSc1ccc(c(n1)OC)O 62a_100000747405_100010893133 [0,1,0,0,0,0|2,0,1]=4 626 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 11a_100015204853_100000210414 [0,1,0,0,0,0|2,0,1]=4 627 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000210414 [0,1,0,0,0,0|2,0,1]=4 628 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_100000210414 [0,1,0,0,0,0|2,0,1]=4 629 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 527a_100015204853_100000210414 [0,1,0,0,0,0|2,0,1]=4 630 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 11a_100020626639_100000210414 [0,1,0,0,0,0|2,0,1]=4 631 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000210414 [0,1,0,0,0,0|2,0,1]=4 632 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_100000210414 [0,1,0,0,0,0|2,0,1]=4 633 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 527a_100020626639_100000210414 [0,1,0,0,0,0|2,0,1]=4 634 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210414 [0,1,0,0,0,0|1,0,1]=3 635 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210414 [0,1,0,0,0,0|1,0,1]=3 636 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210414 [0,1,0,0,0,0|1,0,1]=3 637 B15R1.4039 CCC(=O)NNc1ccc(c(c1)OC)F 22a_102515433066_100000210414 [0,1,0,0,0,0|3,0,0]=4 638 B15R1.4039 CCc1cc(ccc1O)SCC(=O)NC 62a_100000183359_100012338938 [0,1,0,0,0,0|2,0,1]=4 639 B15R1.4039 CCc1cc(ccc1O)SCC(=O)OC 62a_100000747449_100012338938 [0,1,0,0,0,0|2,0,1]=4 640 B15R1.4039 CNC(=O)C=Cc1ccc(c(c1)OC)Br 11a_106832991635_100016267305 [0,1,0,0,0,0|1,0,0]=2 641 B15R1.4039 CNC(=O)C=Cc1ccc(c(c1)OC)Br 1626a_100102657272_100016267305 [0,1,0,0,0,0|1,0,0]=2 642 B15R1.4039 CNC(=O)C=Cc1ccc(c(c1)OC)Br 240690a_100102657272_100016267305 [0,1,0,0,0,0|1,0,0]=2 643 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 11a_106832991635_200000066385 [0,1,0,0,0,0|1,0,2]=4 644 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 1626a_100102657272_200000066385 [0,1,0,0,0,0|1,0,2]=4 645 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 240690a_100102657272_200000066385 [0,1,0,0,0,0|1,0,2]=4 646 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 527a_100102657272_200000066385 [0,1,0,0,0,0|1,0,2]=4 647 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 11a_106832991635_100009849056 [0,1,0,0,0,0|1,0,2]=4 648 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 1626a_100102657272_100009849056 [0,1,0,0,0,0|1,0,2]=4 649 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 240690a_100102657272_100009849056 [0,1,0,0,0,0|1,0,2]=4 650 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 527a_100102657272_100009849056 [0,1,0,0,0,0|1,0,2]=4 651 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)O 240690a_100102657272_100011216321 [0,1,0,0,0,0|0,0,2]=3 652 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000183359 [0,1,0,0,0,0|2,0,1]=4 653 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000183359 [0,1,0,0,0,0|2,0,1]=4 654 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000183359 [0,1,0,0,0,0|2,0,1]=4 655 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)C 34a_100011279678_100000183359 [0,1,0,0,0,0|2,0,1]=4 656 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000183359 [0,1,0,0,0,0|2,0,1]=4 657 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000183359 [0,1,0,0,0,0|2,0,1]=4 658 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000183359 [0,1,0,0,0,0|2,0,1]=4 659 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)F 34a_100000701188_100000183359 [0,1,0,0,0,0|2,0,1]=4 660 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)I 34a_100000746945_100000183359 [0,1,0,0,0,0|2,0,1]=4 661 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000183359 [0,1,0,0,0,0|1,0,1]=3 662 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Br 34a_100011827694_100000183359 [0,1,0,0,0,0|2,0,1]=4 663 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000183359 [0,1,0,0,0,0|2,0,1]=4 664 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)C 34a_100009865632_100000183359 [0,1,0,0,0,0|2,0,1]=4 665 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000183359 [0,1,0,0,0,0|2,0,1]=4 666 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000183359 [0,1,0,0,0,0|2,0,1]=4 667 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000183359 [0,1,0,0,0,0|2,0,1]=4 668 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)F 34a_100012001760_100000183359 [0,1,0,0,0,0|2,0,1]=4 669 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000183359 [0,1,0,0,0,0|2,0,1]=4 670 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)N 34a_100015326901_100000183359 [0,1,0,0,0,0|2,0,1]=4 671 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000183359 [0,1,0,0,0,0|2,0,1]=4 672 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Br 62a_100000183359_100012353699 [0,1,0,0,0,0|2,0,1]=4 673 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000183359 [0,1,0,0,0,0|2,0,1]=4 674 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)C 62a_100000183359_100011830276 [0,1,0,0,0,0|2,0,1]=4 675 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000183359 [0,1,0,0,0,0|2,0,1]=4 676 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000183359_100011356853 [0,1,0,0,0,0|2,0,1]=4 677 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000183359 [0,1,0,0,0,0|2,0,1]=4 678 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)F 62a_100000183359_100011934186 [0,1,0,0,0,0|2,0,1]=4 679 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000183359 [0,1,0,0,0,0|2,0,1]=4 680 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)N 62a_100000183359_100015196925 [0,1,0,0,0,0|2,0,1]=4 681 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000183359 [0,1,0,0,0,0|2,0,1]=4 682 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)O 62a_100000183359_100000694246 [0,1,0,0,0,0|1,0,1]=3 683 B15R1.4039 CNC(=O)CSc1ccc(c(n1)OC)O 62a_100000183359_100010893133 [0,1,0,0,0,0|2,0,1]=4 684 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 2708a_100015204853_106832991635 [0,1,0,0,0,0|2,0,1]=4 685 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 2708a_100102657272_100015204853 [0,1,0,0,0,0|2,0,1]=4 686 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100015204853_100102657272 [0,1,0,0,0,0|2,0,1]=4 687 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100102657272_100015204853 [0,1,0,0,0,0|2,0,1]=4 688 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 512a_100015204853_100102657272 [0,1,0,0,0,0|2,0,1]=4 689 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 512a_106832991638_100015204853 [0,1,0,0,0,0|2,0,1]=4 690 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 2708a_100020626639_106832991635 [0,1,0,0,0,0|2,0,1]=4 691 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 2708a_100102657272_100020626639 [0,1,0,0,0,0|2,0,1]=4 692 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 273464a_100020626639_100102657272 [0,1,0,0,0,0|2,0,1]=4 693 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 273464a_100102657272_100020626639 [0,1,0,0,0,0|2,0,1]=4 694 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 512a_100020626639_100102657272 [0,1,0,0,0,0|2,0,1]=4 695 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 512a_106832991638_100020626639 [0,1,0,0,0,0|2,0,1]=4 696 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 2708a_100000185554_106832991635 [0,1,0,0,0,0|1,0,1]=3 697 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 2708a_100102657272_100000185554 [0,1,0,0,0,0|1,0,1]=3 698 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100102657272 [0,1,0,0,0,0|1,0,1]=3 699 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 273464a_100102657272_100000185554 [0,1,0,0,0,0|1,0,1]=3 700 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 512a_106832991638_100000185554 [0,1,0,0,0,0|1,0,1]=3 701 B15R1.4039 CNC(=O)NNc1ccc(c(c1)OC)F 273464a_100102657272_102515433066 [0,1,0,0,0,0|3,0,0]=4 702 B15R1.4039 CNC(=O)NNc1ccc(c(c1)OC)F 512a_102515433066_100102657272 [0,1,0,0,0,0|3,0,0]=4 703 B15R1.4039 CNC(=O)NNc1ccc(c(c1)OC)F 512a_106832991638_102515433066 [0,1,0,0,0,0|3,0,0]=4 704 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000747449 [0,1,0,0,0,0|2,0,1]=4 705 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000747449 [0,1,0,0,0,0|2,0,1]=4 706 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000747449 [0,1,0,0,0,0|2,0,1]=4 707 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)C 34a_100011279678_100000747449 [0,1,0,0,0,0|2,0,1]=4 708 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000747449 [0,1,0,0,0,0|2,0,1]=4 709 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000747449 [0,1,0,0,0,0|2,0,1]=4 710 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000747449 [0,1,0,0,0,0|2,0,1]=4 711 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)F 34a_100000701188_100000747449 [0,1,0,0,0,0|2,0,1]=4 712 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)I 34a_100000746945_100000747449 [0,1,0,0,0,0|2,0,1]=4 713 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000747449 [0,1,0,0,0,0|1,0,1]=3 714 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Br 34a_100011827694_100000747449 [0,1,0,0,0,0|2,0,1]=4 715 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000747449 [0,1,0,0,0,0|2,0,1]=4 716 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)C 34a_100009865632_100000747449 [0,1,0,0,0,0|2,0,1]=4 717 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000747449 [0,1,0,0,0,0|2,0,1]=4 718 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000747449 [0,1,0,0,0,0|2,0,1]=4 719 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000747449 [0,1,0,0,0,0|2,0,1]=4 720 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)F 34a_100012001760_100000747449 [0,1,0,0,0,0|2,0,1]=4 721 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000747449 [0,1,0,0,0,0|2,0,1]=4 722 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)N 34a_100015326901_100000747449 [0,1,0,0,0,0|2,0,1]=4 723 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000747449 [0,1,0,0,0,0|2,0,1]=4 724 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Br 62a_100000747449_100012353699 [0,1,0,0,0,0|2,0,1]=4 725 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000747449 [0,1,0,0,0,0|2,0,1]=4 726 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)C 62a_100000747449_100011830276 [0,1,0,0,0,0|2,0,1]=4 727 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000747449 [0,1,0,0,0,0|2,0,1]=4 728 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000747449_100011356853 [0,1,0,0,0,0|2,0,1]=4 729 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000747449 [0,1,0,0,0,0|2,0,1]=4 730 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)F 62a_100000747449_100011934186 [0,1,0,0,0,0|2,0,1]=4 731 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000747449 [0,1,0,0,0,0|2,0,1]=4 732 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)N 62a_100000747449_100015196925 [0,1,0,0,0,0|2,0,1]=4 733 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000747449 [0,1,0,0,0,0|2,0,1]=4 734 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)O 62a_100000747449_100000694246 [0,1,0,0,0,0|1,0,1]=3 735 B15R1.4039 COC(=O)CSc1ccc(c(n1)OC)O 62a_100000747449_100010893133 [0,1,0,0,0,0|2,0,1]=4 736 B15R1.4039 COc1cc(ccc1Br)C=CC(=O)CF 1458a_100016267305_100015361967 [0,1,0,0,0,0|1,0,0]=2 737 B15R1.4039 COc1cc(ccc1C)C=CC(=O)CBr 6a_100000719150_100009888967 [0,1,0,0,0,0|1,0,0]=2 738 B15R1.4039 COc1cc(ccc1C)C=CC(=O)CCl 6a_100000719150_100000086384 [0,1,0,0,0,0|1,0,0]=2 739 B15R1.4039 COc1cc(ccc1C)C=CC(=O)CF 6a_100000719150_100000764096 [0,1,0,0,0,0|1,0,0]=2 740 B15R1.4039 COc1cc(ccc1C)CCC(=O)CF 1458a_200000066385_100015361967 [0,1,0,0,0,0|1,0,2]=4 741 B15R1.4039 COc1cc(ccc1Cl)C=CC(=O)CBr 6a_100011998524_100009888967 [0,1,0,0,0,0|1,0,0]=2 742 B15R1.4039 COc1cc(ccc1Cl)C=CC(=O)CCl 6a_100011998524_100000086384 [0,1,0,0,0,0|1,0,0]=2 743 B15R1.4039 COc1cc(ccc1Cl)C=CC(=O)CF 6a_100011998524_100000764096 [0,1,0,0,0,0|1,0,0]=2 744 B15R1.4039 COc1cc(ccc1Cl)CNC(=O)CO 240690a_100015204853_100000210174 [0,1,0,0,0,0|2,0,1]=4 745 B15R1.4039 COc1cc(ccc1Cl)CNC(=O)CO 527a_100015204853_100000210174 [0,1,0,0,0,0|2,0,1]=4 746 B15R1.4039 COc1cc(ccc1F)C=CC(=O)CBr 6a_100000692873_100009888967 [0,1,0,0,0,0|1,0,0]=2 747 B15R1.4039 COc1cc(ccc1F)C=CC(=O)CCl 6a_100000692873_100000086384 [0,1,0,0,0,0|1,0,0]=2 748 B15R1.4039 COc1cc(ccc1F)C=CC(=O)CF 6a_100000692873_100000764096 [0,1,0,0,0,0|1,0,0]=2 749 B15R1.4039 COc1cc(ccc1F)CCC(=O)CF 1458a_100009849056_100015361967 [0,1,0,0,0,0|1,0,2]=4 750 B15R1.4039 COc1cc(ccc1F)CNC(=O)CO 240690a_100020626639_100000210174 [0,1,0,0,0,0|2,0,1]=4 751 B15R1.4039 COc1cc(ccc1F)CNC(=O)CO 527a_100020626639_100000210174 [0,1,0,0,0,0|2,0,1]=4 752 B15R1.4039 COc1cc(ccc1F)NNC(=O)CO 22a_102515433066_100000210174 [0,1,0,0,0,0|3,0,0]=4 753 B15R1.4039 COc1cc(ccc1O)C=CC(=O)CF 1458a_100000182119_100015361967 [0,1,0,0,0,0|0,0,0]=1 754 B15R1.4039 COc1cc(ccc1O)CCC(=O)CF 1458a_100011216321_100015361967 [0,1,0,0,0,0|0,0,2]=3 755 B15R1.4039 COc1cc(ccc1O)CCC(=O)CO 1458a_100000210174_100010741665 [0,1,0,0,0,0|0,0,2]=3 756 B15R1.4039 COc1cc(ccc1O)CNC(=O)CO 240690a_100000185554_100000210174 [0,1,0,0,0,0|1,0,1]=3 757 B15R1.4039 COc1cc(ccc1O)CNC(=O)CO 527a_100000185554_100000210174 [0,1,0,0,0,0|1,0,1]=3 758 B15R1.4039 Cc1ccc(cc1C#N)C=CC(=O)CBr 6a_100012017333_100009888967 [0,1,0,0,0,0|3,0,0]=4 759 B15R1.4039 Cc1ccc(cc1C#N)C=CC(=O)CCl 6a_100012017333_100000086384 [0,1,0,0,0,0|3,0,0]=4 760 B15R1.4039 Cc1ccc(cc1C#N)C=CC(=O)CF 6a_100012017333_100000764096 [0,1,0,0,0,0|3,0,0]=4 761 B15R1.4039 N#Cc1cc(ccc1Br)C=CC(=O)CBr 6a_100010128726_100009888967 [0,1,0,0,0,0|3,0,0]=4 762 B15R1.4039 N#Cc1cc(ccc1Br)C=CC(=O)CCl 6a_100010128726_100000086384 [0,1,0,0,0,0|3,0,0]=4 763 B15R1.4039 N#Cc1cc(ccc1Br)C=CC(=O)CF 6a_100010128726_100000764096 [0,1,0,0,0,0|3,0,0]=4 764 B15R1.4039 N#Cc1cc(ccc1Cl)C=CC(=O)CBr 6a_100009841870_100009888967 [0,1,0,0,0,0|3,0,0]=4 765 B15R1.4039 N#Cc1cc(ccc1Cl)C=CC(=O)CCl 6a_100009841870_100000086384 [0,1,0,0,0,0|3,0,0]=4 766 B15R1.4039 N#Cc1cc(ccc1Cl)C=CC(=O)CF 6a_100009841870_100000764096 [0,1,0,0,0,0|3,0,0]=4 767 B15R1.4039 N#Cc1cc(ccc1F)C=CC(=O)CBr 6a_100000690697_100009888967 [0,1,0,0,0,0|3,0,0]=4 768 B15R1.4039 N#Cc1cc(ccc1F)C=CC(=O)CCl 6a_100000690697_100000086384 [0,1,0,0,0,0|3,0,0]=4 769 B15R1.4039 N#Cc1cc(ccc1F)C=CC(=O)CF 6a_100000690697_100000764096 [0,1,0,0,0,0|3,0,0]=4 770 B15R1.5194 COc1c(ccc(c1F)C=CC(=O)C)Cl 1458a_100020621803_200000210301 [0,1,0,0,0,0|1,0,0]=2 771 B15R1.5194 COc1c(ccc(c1F)C=CC(=O)[13CH3])Cl 1458a_100020621803_200025704644 [0,1,0,0,0,0|1,0,0]=2 772 B15R1.5194 COc1c(ccc(c1F)C=CC(C)C)Cl 271570a_100016257149_200135222481 [0,1,0,0,0,0|2,0,1]=4 773 B15R1.5194 COc1c(ccc(c1F)C=CC(C)C)N 271570a_100016257149_100010734149 [0,1,0,0,0,0|2,0,1]=4 774 B15R1.5194 COc1c(ccc(c1F)C=CC(C)O)Cl 271570a_200011019289_200135222481 [0,1,0,0,0,0|1,0,2]=4 775 B15R1.5194 COc1c(ccc(c1F)C=CC(C)O)N 271570a_200011019289_100010734149 [0,1,0,0,0,0|1,0,2]=4 776 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 11a_200009889119_100015343762 [0,1,0,0,0,0|2,0,1]=4 777 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 1626a_200009889119_100015343762 [0,1,0,0,0,0|2,0,1]=4 778 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 240690a_200009889119_100015343762 [0,1,0,0,0,0|2,0,1]=4 779 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 527a_200009889119_100103153847 [0,1,0,0,0,0|2,0,1]=4 780 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 11a_115082355467_100015343762 [0,1,0,0,0,0|2,0,1]=4 781 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 1626a_115082355467_100015343762 [0,1,0,0,0,0|2,0,1]=4 782 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 240690a_115082355467_100015343762 [0,1,0,0,0,0|2,0,1]=4 783 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 527a_115082355467_100103153847 [0,1,0,0,0,0|2,0,1]=4 784 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000748629 [0,1,0,0,0,0|2,0,1]=4 785 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000748629 [0,1,0,0,0,0|2,0,1]=4 786 B15R1.12854 C=C(C)COc1ccc(c(c1)OC)CO 34a_200000116926_100000748629 [0,1,0,0,0,0|2,0,1]=4 787 B15R1.12854 C=C(C)COc1ccc(c(c1)OC)OC 34a_100000039706_100000748629 [0,1,0,0,0,0|2,0,1]=4 788 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CO 62a_100000748629_100011277633 [0,1,0,0,0,0|2,0,1]=4 789 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000211660 [0,1,0,0,0,0|2,0,1]=4 790 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)OC 62a_100000748629_100011356967 [0,1,0,0,0,0|2,0,1]=4 791 B15R1.12854 C=Cc1cc(ccc1OC)/C=C/C(=O)C 271570a_100011290941_200016254069 [0,1,0,0,0,0|1,0,1]=3 792 B15R1.12854 CCc1cc(ccc1OC)C=CC(C)C 271570a_100016257149_200010179862 [0,1,0,0,0,0|2,0,1]=4 793 B15R1.12854 CCc1cc(ccc1OC)C=CC(C)O 271570a_200011019289_200010179862 [0,1,0,0,0,0|1,0,2]=4 794 B15R1.12854 CCc1ccc(cc1OC)C=CC(C)C 271570a_100016257149_200010710398 [0,1,0,0,0,0|2,0,1]=4 795 B15R1.12854 CCc1ccc(cc1OC)C=CC(C)O 271570a_200011019289_200010710398 [0,1,0,0,0,0|1,0,2]=4 796 B15R1.12854 COc1cc(ccc1C#N)C=CC(C)C 271570a_100016257149_100000694671 [0,1,0,0,0,0|2,0,1]=4 797 B15R1.12854 COc1cc(ccc1C#N)C=CC(C)O 271570a_200011019289_100000694671 [0,1,0,0,0,0|1,0,2]=4 798 B15R1.12854 COc1cc(ccc1C=O)C=CC(C)C 271570a_100016257149_100000697075 [0,1,0,0,0,0|1,0,2]=4 799 B15R1.12854 COc1cc(ccc1C=O)C=CC(C)O 271570a_200011019289_100000697075 [0,1,0,0,0,0|0,0,3]=4 800 B15R1.12854 COc1cc(ccc1CO)C=CC(C)C 271570a_100016257149_100011277633 [0,1,0,0,0,0|1,0,1]=3 801 B15R1.12854 COc1cc(ccc1CO)C=CC(C)O 271570a_200011019289_100011277633 [0,1,0,0,0,0|0,0,2]=3 802 B15R1.12854 COc1cc(ccc1CO)NCC(=O)N 34a_100012183141_100000187820 [0,1,0,0,0,0|2,0,1]=4 803 B15R1.12854 COc1cc(ccc1CO)NCC(=O)[O-] 34a_100012183141_100020667443 [0,1,0,0,0,0|2,0,1]=4 804 B15R1.12854 COc1cc(ccc1CO)OCC(=O)C 1458a_200000048963_200000210301 [0,1,0,0,0,0|1,0,1]=3 805 B15R1.12854 COc1cc(ccc1CO)OCC(=O)N 34a_200000116926_100000187820 [0,1,0,0,0,0|2,0,1]=4 806 B15R1.12854 COc1cc(ccc1CO)OCC(=O)[13CH3] 1458a_200000048963_200025704644 [0,1,0,0,0,0|1,0,1]=3 807 B15R1.12854 COc1cc(ccc1CO)OCC(=O)[O-] 34a_200000116926_100020667443 [0,1,0,0,0,0|2,0,1]=4 808 B15R1.12854 COc1cc(ccc1CO)SCC(=O)N 62a_100000747473_100011277633 [0,1,0,0,0,0|2,0,1]=4 809 B15R1.12854 COc1cc(ccc1CO)SCC(=O)N 62a_100011277633_100000747473 [0,1,0,0,0,0|2,0,1]=4 810 B15R1.12854 COc1cc(ccc1CO)SCC(=O)[O-] 62a_100011277633_100020667443 [0,1,0,0,0,0|2,0,1]=4 811 B15R1.12854 COc1cc(ccc1CO)SCC(=O)[O-] 62a_100020667443_100011277633 [0,1,0,0,0,0|2,0,1]=4 812 B15R1.12854 COc1cc(ccc1O[13CH3])/C=C/C(=O)C 34a_100102526088_200025704644 [0,1,0,0,0,0|0,0,0]=1 813 B15R1.12854 COc1cc(ccc1O[13CH3])C=C[N+](=O)[O-] 34a_200103042931_200025704644 [0,1,0,0,0,0|2,0,0]=3 814 B15R1.12854 COc1cc(ccc1O[13CH3])CCC(=O)C 34a_100011290831_200025704644 [0,1,0,0,0,0|0,0,2]=3 815 B15R1.12854 COc1cc(ccc1O[13CH3])CCC(=O)C 7a_100011290831_200025704644 [0,1,0,0,0,0|0,0,2]=3 816 B15R1.12854 COc1cc(ccc1O[13CH3])CNC(=O)C 34a_100000046322_200025704644 [0,1,0,0,0,0|1,0,1]=3 817 B15R1.12854 COc1cc(ccc1O[13CH3])CNC(=O)C 7a_100000046322_200025704644 [0,1,0,0,0,0|1,0,1]=3 818 B15R1.12854 COc1cc(ccc1SC)C=CC(C)C 271570a_100016257149_200011001119 [0,1,0,0,0,0|1,1,1]=4 819 B15R1.12854 COc1cc(ccc1SC)C=CC(C)O 271570a_200011019289_200011001119 [0,1,0,0,0,0|0,1,2]=4 820 B15R1.12854 COc1cc(cnc1CO)C=CC(C)C 271570a_100016257149_200010246159 [0,1,0,0,0,0|2,0,1]=4 821 B15R1.12854 COc1cc(cnc1CO)C=CC(C)O 271570a_200011019289_200010246159 [0,1,0,0,0,0|1,0,2]=4 822 B15R1.12854 COc1cc(cnc1OC)C=CC(C)C 271570a_100016257149_100010234541 [0,1,0,0,0,0|2,0,1]=4 823 B15R1.12854 COc1cc(cnc1OC)C=CC(C)O 271570a_200011019289_100010234541 [0,1,0,0,0,0|1,0,2]=4 824 B15R1.12854 COc1cc(ncc1CO)C=CC(C)C 271570a_100016257149_100010714672 [0,1,0,0,0,0|2,0,1]=4 825 B15R1.12854 COc1cc(ncc1CO)C=CC(C)O 271570a_200011019289_100010714672 [0,1,0,0,0,0|1,0,2]=4 826 B15R1.12854 COc1ccc(cc1OC)/C=C/C(=O)C 34a_100102526088_200000210301 [0,1,0,0,0,0|0,0,0]=1 827 B15R1.12854 COc1ccc(cc1OC)/C=C/[N+](=O)[O-] 34a_100016278493_200000210301 [0,1,0,0,0,0|2,0,0]=3 828 B15R1.12854 COc1ccc(cc1OC)C=CC(=O)C 1458a_100015194992_200000210301 [0,1,0,0,0,0|0,0,0]=1 829 B15R1.12854 COc1ccc(cc1OC)C=CC(=O)[13CH3] 1458a_100015194992_200025704644 [0,1,0,0,0,0|0,0,0]=1 830 B15R1.12854 COc1ccc(cc1OC)C=CC(C)C 271570a_100016257149_100000187503 [0,1,0,0,0,0|1,0,1]=3 831 B15R1.12854 COc1ccc(cc1OC)C=CC(C)O 271570a_200011019289_100000187503 [0,1,0,0,0,0|0,0,2]=3 832 B15R1.12854 COc1ccc(cc1OC)C=C[N+](=O)[O-] 34a_200103042931_200000210301 [0,1,0,0,0,0|2,0,0]=3 833 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 1458a_100000070787_100011740610 [0,1,0,0,0,0|0,0,2]=3 834 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 1458a_100000187252_200000210301 [0,1,0,0,0,0|0,0,2]=3 835 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 34a_100011290831_200000210301 [0,1,0,0,0,0|0,0,2]=3 836 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 7a_100011290831_200000210301 [0,1,0,0,0,0|0,0,2]=3 837 B15R1.12854 COc1ccc(cc1OC)CCC(=O)[13CH3] 1458a_100000187252_200025704644 [0,1,0,0,0,0|0,0,2]=3 838 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 11a_100000185555_100015343762 [0,1,0,0,0,0|1,0,1]=3 839 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 1626a_100000185555_100015343762 [0,1,0,0,0,0|1,0,1]=3 840 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 240690a_100000185555_100015343762 [0,1,0,0,0,0|1,0,1]=3 841 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 34a_100000046322_200000210301 [0,1,0,0,0,0|1,0,1]=3 842 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 527a_100000185555_100103153847 [0,1,0,0,0,0|1,0,1]=3 843 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 7a_100000046322_200000210301 [0,1,0,0,0,0|1,0,1]=3 844 B15R1.12854 COc1ccc(cc1OC)NCC(=O)N 34a_100000187404_100000187820 [0,1,0,0,0,0|2,0,1]=4 845 B15R1.12854 COc1ccc(cc1OC)NCC(=O)[O-] 34a_100000187404_100020667443 [0,1,0,0,0,0|2,0,1]=4 846 B15R1.12854 COc1ccc(cc1OC)OCC(=O)N 34a_100000039706_100000187820 [0,1,0,0,0,0|2,0,1]=4 847 B15R1.12854 COc1ccc(cc1OC)OCC(=O)[O-] 34a_100000039706_100020667443 [0,1,0,0,0,0|2,0,1]=4 848 B15R1.12854 COc1ccc(cc1OC)SCC(=O)N 62a_100000747473_100011356967 [0,1,0,0,0,0|2,0,1]=4 849 B15R1.12854 COc1ccc(cc1OC)SCC(=O)[O-] 62a_100020667443_100011356967 [0,1,0,0,0,0|2,0,1]=4 850 B15R1.12854 COc1ccc(cc1O[13CH3])/C=C/[N+](=O)[O-] 34a_100016278493_200025704644 [0,1,0,0,0,0|2,0,0]=3 851 B15R1.12854 COc1ccc(cc1SC)/C=C/C(=O)C 62a_200000210301_200016254069 [0,1,0,0,0,0|0,1,0]=2 852 B15R1.12854 COc1ccc(cc1SC)/C=C/C(=O)C 62a_200016254069_200000210301 [0,1,0,0,0,0|0,1,0]=2 853 B15R1.12854 COc1ccc(cc1SC)C=CC(C)C 271570a_100016257149_200009892704 [0,1,0,0,0,0|1,1,1]=4 854 B15R1.12854 COc1ccc(cc1SC)C=CC(C)O 271570a_200011019289_200009892704 [0,1,0,0,0,0|0,1,2]=4 855 B15R1.12854 COc1ccc(cc1S[13CH3])/C=C/C(=O)C 62a_200016254069_200025704644 [0,1,0,0,0,0|0,1,0]=2 856 B15R1.12854 COc1ccc(cc1S[13CH3])/C=C/C(=O)C 62a_200025704644_200016254069 [0,1,0,0,0,0|0,1,0]=2 857 B15R1.12854 COc1ccc(nc1OC)C=CC(C)C 271570a_100016257149_100010214848 [0,1,0,0,0,0|2,0,1]=4 858 B15R1.12854 COc1ccc(nc1OC)C=CC(C)O 271570a_200011019289_100010214848 [0,1,0,0,0,0|1,0,2]=4 859 B15R1.12854 COc1nc(ccc1CO)C=CC(C)C 271570a_100016257149_100010988397 [0,1,0,0,0,0|2,0,1]=4 860 B15R1.12854 COc1nc(ccc1CO)C=CC(C)O 271570a_200011019289_100010988397 [0,1,0,0,0,0|1,0,2]=4 861 B15R2.1754 CSc1cc2ccc(cc2cc1O)O 62a_200000210301_100010179872 [0,0,0,1,0,0|0,1,2]=4 862 B15R2.1754 [13CH3]Sc1cc2ccc(cc2cc1O)O 62a_200025704644_100010179872 [0,0,0,1,0,0|0,1,2]=4 863 B15R2.4522 CCc1cc(ccc1O)C=CC2CC2 271570a_100102526188_100012338938 [0,0,0,1,0,0|2,0,1]=4 864 B15R2.4522 COc1cc(ccc1Br)C=CC2CC2 271570a_100102526188_100012353699 [0,0,0,1,0,0|2,0,1]=4 865 B15R2.4522 COc1cc(ccc1C)C=CC2CC2 271570a_100102526188_100011830276 [0,0,0,1,0,0|2,0,1]=4 866 B15R2.4522 COc1cc(ccc1Cl)C=CC2CC2 271570a_100102526188_100011356853 [0,0,0,1,0,0|2,0,1]=4 867 B15R2.4522 COc1cc(ccc1F)C=CC2CC2 271570a_100102526188_100011934186 [0,0,0,1,0,0|2,0,1]=4 868 B15R2.4522 COc1cc(ccc1N)C=CC2CC2 271570a_100102526188_100011279103 [0,0,0,1,0,0|2,0,1]=4 869 B15R2.4522 COc1cc(ccc1O)C=CC2CC2 271570a_100102526188_100000694246 [0,0,0,1,0,0|1,0,1]=3 870 B15R2.4522 COc1nc(ccc1O)C=CC2CC2 271570a_100102526188_100010893133 [0,0,0,1,0,0|2,0,1]=4 871 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748629 [0,0,0,1,0,0|2,0,1]=4 872 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748629 [0,0,0,1,0,0|2,0,1]=4 873 B15R2.7688 C=C(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748629 [0,0,0,1,0,0|2,0,1]=4 874 B15R2.7688 CC(=O)C=Cc1ccc2c(c1)CCO2 1458a_100000241297_200000210301 [0,0,0,1,0,0|1,0,0]=2 875 B15R2.7688 CC(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200000210301 [0,0,0,1,0,0|0,0,0]=1 876 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000070787_100000763274 [0,0,0,1,0,0|1,0,2]=4 877 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200000210301 [0,0,0,1,0,0|1,0,2]=4 878 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200000210301 [0,0,0,1,0,0|0,0,2]=3 879 B15R2.7688 CC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200000210301 [0,0,0,1,0,0|1,0,1]=3 880 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 11a_100011219410_100015343762 [0,0,0,1,0,0|2,0,1]=4 881 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 1626a_100011219410_100015343762 [0,0,0,1,0,0|2,0,1]=4 882 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 240690a_100011219410_100015343762 [0,0,0,1,0,0|2,0,1]=4 883 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 527a_100011219410_100103153847 [0,0,0,1,0,0|2,0,1]=4 884 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100015343762 [0,0,0,1,0,0|1,0,1]=3 885 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100015343762 [0,0,0,1,0,0|1,0,1]=3 886 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100015343762 [0,0,0,1,0,0|1,0,1]=3 887 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100103153847 [0,0,0,1,0,0|1,0,1]=3 888 B15R2.7688 CC(C)C=Cc1ccc2c(c1)CCO2 271570a_100016257149_100000729065 [0,0,0,1,0,0|2,0,1]=4 889 B15R2.7688 CC(C)C=Cc1ccc2c(c1)OCC2 271570a_100016257149_100009818566 [0,0,0,1,0,0|2,0,1]=4 890 B15R2.7688 CC(C)C=Cc1ccc2c(c1)OCO2 271570a_100016257149_100000688060 [0,0,0,1,0,0|1,0,1]=3 891 B15R2.7688 CC(O)C=Cc1ccc2c(c1)CCO2 271570a_200011019289_100000729065 [0,0,0,1,0,0|1,0,2]=4 892 B15R2.7688 CC(O)C=Cc1ccc2c(c1)OCC2 271570a_200011019289_100009818566 [0,0,0,1,0,0|1,0,2]=4 893 B15R2.7688 CC(O)C=Cc1ccc2c(c1)OCO2 271570a_200011019289_100000688060 [0,0,0,1,0,0|0,0,2]=3 894 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747473 [0,0,0,1,0,0|2,0,1]=4 895 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000187820 [0,0,0,1,0,0|2,0,1]=4 896 B15R2.7688 NC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000187820 [0,0,0,1,0,0|2,0,1]=4 897 B15R2.7688 O=C([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100020667443 [0,0,0,1,0,0|2,0,1]=4 898 B15R2.7688 O=C([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100020667443 [0,0,0,1,0,0|2,0,1]=4 899 B15R2.7688 [13CH3]C(=O)C=Cc1ccc2c(c1)CCO2 1458a_100000241297_200025704644 [0,0,0,1,0,0|1,0,0]=2 900 B15R2.7688 [13CH3]C(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200025704644 [0,0,0,1,0,0|0,0,0]=1 901 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200025704644 [0,0,0,1,0,0|1,0,2]=4 902 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200025704644 [0,0,0,1,0,0|0,0,2]=3 903 B15R2.7688 [13CH3]C(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200025704644 [0,0,0,1,0,0|1,0,1]=3 904 B13R1.52 C=Cc1cc(ccc1O)CC(=O)C 271570a_100011290941_100010141077 [0,0,0,0,1,0|1,0,2]=4 905 B13R1.52 CC(=Cc1ccc(c(c1)C#N)O)C 271570a_100102525489_100000687585 [0,0,0,0,1,0|3,0,0]=4 906 B13R1.52 CC(=Cc1ccc(c(c1)C=O)O)C 271570a_100102525489_100000186750 [0,0,0,0,1,0|3,0,0]=4 907 B13R1.52 CC(=Cc1ccc(c(c1)CN)O)C 271570a_100102525489_100000730032 [0,0,0,0,1,0|3,0,0]=4 908 B13R1.52 CC(=Cc1ccc(c(c1)CO)O)C 271570a_100102525489_100000184703 [0,0,0,0,1,0|3,0,0]=4 909 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,0,0,0,1,0|0,1,1]=3 910 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,0,0,0,1,0|0,1,1]=3 911 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)O 22a_100011249283_100000070787 [0,0,0,0,1,0|3,0,0]=4 912 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)O 527a_100011249283_100103153847 [0,0,0,0,1,0|3,0,0]=4 913 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])C 34a_100000739390_200025704644 [0,0,0,0,1,0|3,0,0]=4 914 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])C 7a_100000739390_200025704644 [0,0,0,0,1,0|3,0,0]=4 915 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])Cl 34a_100000742996_200025704644 [0,0,0,0,1,0|3,0,0]=4 916 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])F 34a_106454645589_200025704644 [0,0,0,0,1,0|3,0,0]=4 917 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 34a_100011935283_200025704644 [0,0,0,0,1,0|2,0,0]=3 918 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 7a_100011935283_200025704644 [0,0,0,0,1,0|2,0,0]=3 919 B13R1.52 CC(=O)Nc1ccc(c(c1)S[13CH3])C 62a_200025704644_100011221169 [0,0,0,0,1,0|2,1,0]=4 920 B13R1.52 CC(=O)Nc1ccc(c(c1)S[13CH3])F 62a_200025704644_100012348134 [0,0,0,0,1,0|2,1,0]=4 921 B13R1.52 CC(=O)Oc1ccc(c(c1)C=O)O 271570a_203496583355_100009816906 [0,0,0,0,1,0|3,0,0]=4 922 B13R1.52 CC(=O)Oc1ccc(c(c1)S[13CH3])C 62a_200025704644_200025702335 [0,0,0,0,1,0|2,1,0]=4 923 B13R1.52 CCc1cc(ccc1Br)C=C(C)C 271570a_100102525489_100010244631 [0,0,0,0,1,0|3,0,0]=4 924 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 11a_100010109747_100015343762 [0,0,0,0,1,0|3,0,0]=4 925 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 1626a_100010109747_100015343762 [0,0,0,0,1,0|3,0,0]=4 926 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 22a_100010109747_100000070787 [0,0,0,0,1,0|3,0,0]=4 927 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 527a_100010109747_100103153847 [0,0,0,0,1,0|3,0,0]=4 928 B13R1.52 CCc1cc(ccc1F)C=C(C)C 271570a_100102525489_100010244625 [0,0,0,0,1,0|3,0,0]=4 929 B13R1.52 CCc1cc(ccc1N)C=C(C)C 271570a_100102525489_100000686106 [0,0,0,0,1,0|3,0,0]=4 930 B13R1.52 CCc1cc(ccc1O)C=C(C)C 271570a_100102525489_100012338938 [0,0,0,0,1,0|2,0,0]=3 931 B13R1.52 CNc1cc(ccc1C)C=C(C)C 271570a_100102525489_100020629602 [0,0,0,0,1,0|3,0,0]=4 932 B13R1.52 CNc1cc(ccc1C)NC(=O)C 34a_100000739390_200000210301 [0,0,0,0,1,0|3,0,0]=4 933 B13R1.52 CNc1cc(ccc1C)NC(=O)C 7a_100000739390_200000210301 [0,0,0,0,1,0|3,0,0]=4 934 B13R1.52 CNc1cc(ccc1Cl)NC(=O)C 34a_100000742996_200000210301 [0,0,0,0,1,0|3,0,0]=4 935 B13R1.52 CNc1cc(ccc1F)C=C(C)C 271570a_100102525489_100011314990 [0,0,0,0,1,0|3,0,0]=4 936 B13R1.52 CNc1cc(ccc1F)NC(=O)C 34a_106454645589_200000210301 [0,0,0,0,1,0|3,0,0]=4 937 B13R1.52 CNc1cc(ccc1N)C=C(C)C 271570a_100102525489_100000694363 [0,0,0,0,1,0|3,0,0]=4 938 B13R1.52 COc1cc(c[nH]c1=O)C=C(C)C 271570a_100102525489_100010125397 [0,0,0,0,1,0|2,0,1]=4 939 B13R1.52 COc1cc(ccc1Br)C=C(C)C 271570a_100102525489_100012353699 [0,0,0,0,1,0|2,0,0]=3 940 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,0,0,0,1,0|1,0,1]=3 941 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,0,0,0,1,0|1,0,1]=3 942 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,0,0,0,1,0|1,0,1]=3 943 B13R1.52 COc1cc(ccc1Br)NC(=O)C 11a_100000765947_100015343762 [0,0,0,0,1,0|2,0,0]=3 944 B13R1.52 COc1cc(ccc1Br)NC(=O)C 1626a_100000765947_100015343762 [0,0,0,0,1,0|2,0,0]=3 945 B13R1.52 COc1cc(ccc1Br)NC(=O)C 22a_100000765947_100000070787 [0,0,0,0,1,0|2,0,0]=3 946 B13R1.52 COc1cc(ccc1Br)NC(=O)C 527a_100000765947_100103153847 [0,0,0,0,1,0|2,0,0]=3 947 B13R1.52 COc1cc(ccc1C)C=C(C)C 271570a_100102525489_100011830276 [0,0,0,0,1,0|2,0,0]=3 948 B13R1.52 COc1cc(ccc1C)NC(=O)C 11a_100011279678_100015343762 [0,0,0,0,1,0|2,0,0]=3 949 B13R1.52 COc1cc(ccc1C)NC(=O)C 1626a_100011279678_100015343762 [0,0,0,0,1,0|2,0,0]=3 950 B13R1.52 COc1cc(ccc1C)NC(=O)C 22a_100011279678_100000070787 [0,0,0,0,1,0|2,0,0]=3 951 B13R1.52 COc1cc(ccc1C)NC(=O)C 527a_100011279678_100103153847 [0,0,0,0,1,0|2,0,0]=3 952 B13R1.52 COc1cc(ccc1Cl)C=C(C)C 271570a_100102525489_100011356853 [0,0,0,0,1,0|2,0,0]=3 953 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,0,0,0,1,0|1,0,1]=3 954 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 11a_100000742311_100015343762 [0,0,0,0,1,0|2,0,0]=3 955 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 1626a_100000742311_100015343762 [0,0,0,0,1,0|2,0,0]=3 956 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 22a_100000742311_100000070787 [0,0,0,0,1,0|2,0,0]=3 957 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 34a_100011935283_200000210301 [0,0,0,0,1,0|2,0,0]=3 958 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 527a_100000742311_100103153847 [0,0,0,0,1,0|2,0,0]=3 959 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 7a_100011935283_200000210301 [0,0,0,0,1,0|2,0,0]=3 960 B13R1.52 COc1cc(ccc1F)C=C(C)C 271570a_100102525489_100011934186 [0,0,0,0,1,0|2,0,0]=3 961 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,0,0,0,1,0|1,0,1]=3 962 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,0,0,0,1,0|1,0,1]=3 963 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,0,0,0,1,0|1,0,1]=3 964 B13R1.52 COc1cc(ccc1F)NC(=O)C 11a_100000701188_100015343762 [0,0,0,0,1,0|2,0,0]=3 965 B13R1.52 COc1cc(ccc1F)NC(=O)C 1626a_100000701188_100015343762 [0,0,0,0,1,0|2,0,0]=3 966 B13R1.52 COc1cc(ccc1F)NC(=O)C 22a_100000701188_100000070787 [0,0,0,0,1,0|2,0,0]=3 967 B13R1.52 COc1cc(ccc1F)NC(=O)C 527a_100000701188_100103153847 [0,0,0,0,1,0|2,0,0]=3 968 B13R1.52 COc1cc(ccc1I)NC(=O)C 11a_100000746945_100015343762 [0,0,0,0,1,0|2,0,0]=3 969 B13R1.52 COc1cc(ccc1I)NC(=O)C 1626a_100000746945_100015343762 [0,0,0,0,1,0|2,0,0]=3 970 B13R1.52 COc1cc(ccc1I)NC(=O)C 22a_100000746945_100000070787 [0,0,0,0,1,0|2,0,0]=3 971 B13R1.52 COc1cc(ccc1I)NC(=O)C 527a_100000746945_100103153847 [0,0,0,0,1,0|2,0,0]=3 972 B13R1.52 COc1cc(ccc1N)C=C(C)C 271570a_100102525489_100011279103 [0,0,0,0,1,0|2,0,0]=3 973 B13R1.52 COc1cc(ccc1O)C=C(C)C 271570a_100102525489_100000694246 [0,0,0,0,1,0|1,0,0]=2 974 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,0,0,0,1,0|0,0,1]=2 975 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,0,0,0,1,0|0,0,1]=2 976 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [0,0,0,0,1,0|1,0,0]=2 977 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [0,0,0,0,1,0|1,0,0]=2 978 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [0,0,0,0,1,0|2,0,1]=4 979 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [0,0,0,0,1,0|2,0,1]=4 980 B13R1.52 COc1cc(cnc1C)C=C(C)C 271570a_100102525489_100010254219 [0,0,0,0,1,0|3,0,0]=4 981 B13R1.52 COc1cc(cnc1F)C=C(C)C 271570a_100102525489_100010214931 [0,0,0,0,1,0|3,0,0]=4 982 B13R1.52 COc1cc(cnc1N)C=C(C)C 271570a_100102525489_106354213024 [0,0,0,0,1,0|3,0,0]=4 983 B13R1.52 COc1cc(ncc1C)C=C(C)C 271570a_100102525489_100010067687 [0,0,0,0,1,0|3,0,0]=4 984 B13R1.52 COc1cc(ncc1F)C=C(C)C 271570a_100102525489_200010136270 [0,0,0,0,1,0|3,0,0]=4 985 B13R1.52 COc1cc(ncc1N)C=C(C)C 271570a_100102525489_100009887741 [0,0,0,0,1,0|3,0,0]=4 986 B13R1.52 COc1nc(ccc1Br)CC(=O)C 1458a_100000070787_200010066506 [0,0,0,0,1,0|2,0,1]=4 987 B13R1.52 COc1nc(ccc1N)C=C(C)C 271570a_100102525489_100000687816 [0,0,0,0,1,0|3,0,0]=4 988 B13R1.52 COc1nc(ccc1O)C=C(C)C 271570a_100102525489_100010893133 [0,0,0,0,1,0|2,0,0]=3 989 B13R1.52 COc1nc(cnc1O)C=C(C)C 271570a_100102525489_200010365344 [0,0,0,0,1,0|3,0,0]=4 990 B13R1.52 CSc1cc(ccc1C)NC(=O)C 62a_200000210301_100011221169 [0,0,0,0,1,0|2,1,0]=4 991 B13R1.52 CSc1cc(ccc1C)OC(=O)C 62a_200000210301_200025702335 [0,0,0,0,1,0|2,1,0]=4 992 B13R1.52 CSc1cc(ccc1F)C=C(C)C 271570a_100102525489_100010341305 [0,0,0,0,1,0|2,1,0]=4 993 B13R1.52 CSc1cc(ccc1F)NC(=O)C 62a_200000210301_100012348134 [0,0,0,0,1,0|2,1,0]=4 994 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,0,0,0,1,0|0,1,1]=3 995 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,0,0,0,1,0|0,1,1]=3 996 B15R1.4030 C=C(C)C=NNc1ccc(c(c1)OC)F 4a_102515433066_100000210575 [0,0,0,0,0,1|3,0,0]=4 997 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)O 34a_100000726020_100000730704 [0,0,0,0,0,1|1,0,2]=4 998 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)O 62a_100000730704_100000694246 [0,0,0,0,0,1|1,0,2]=4 999 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000748629 [0,0,0,0,0,1|1,0,2]=4 1000 B15R1.4030 CC(=O)NN=Cc1ccc(c(c1)C#N)O 4a_100000189765_100011970263 [0,0,0,0,0,1|3,0,0]=4 1001 B15R1.4030 CCc1cc(ccc1F)C=NNC(=O)C 4a_100000189765_100009840867 [0,0,0,0,0,1|3,0,0]=4 1002 B15R1.4030 CCc1cc(ccc1O)C=CCC(C)C 271570a_100016259101_100012338938 [0,0,0,0,0,1|2,0,1]=4 1003 B15R1.4030 CCc1cc(ccc1O)SCC=C(C)C 62a_100000761012_100012338938 [0,0,0,0,0,1|2,0,1]=4 1004 B15R1.4030 CCc1cc(ccc1O)SCCC(=O)C 62a_100000053229_100012338938 [0,0,0,0,0,1|1,0,2]=4 1005 B15R1.4030 CCc1cc(ccc1O)SCOC(=O)C 62a_100000076356_100012338938 [0,0,0,0,0,1|2,0,1]=4 1006 B15R1.4030 COc1cc(ccc1Br)C=CCC(C)C 271570a_100016259101_100012353699 [0,0,0,0,0,1|2,0,1]=4 1007 B15R1.4030 COc1cc(ccc1Br)C=NNC(=O)C 4a_100000189765_100010244714 [0,0,0,0,0,1|2,0,0]=3 1008 B15R1.4030 COc1cc(ccc1Br)COCC(=O)C 34a_100000211253_100010110085 [0,0,0,0,0,1|1,0,2]=4 1009 B15R1.4030 COc1cc(ccc1Br)NCC=C(C)C 2230a_100000765947_100000761012 [0,0,0,0,0,1|2,0,1]=4 1010 B15R1.4030 COc1cc(ccc1Br)NCC=C(C)C 34a_100000765947_100000761012 [0,0,0,0,0,1|2,0,1]=4 1011 B15R1.4030 COc1cc(ccc1Br)NCOC(=O)C 34a_100000765947_100009813279 [0,0,0,0,0,1|2,0,1]=4 1012 B15R1.4030 COc1cc(ccc1Br)OCC=C(C)C 34a_100011827694_100000761012 [0,0,0,0,0,1|2,0,1]=4 1013 B15R1.4030 COc1cc(ccc1Br)OCC=C(C)C 7a_100011827694_100000761012 [0,0,0,0,0,1|2,0,1]=4 1014 B15R1.4030 COc1cc(ccc1Br)OCCC(=O)C 7a_100011827694_100000053229 [0,0,0,0,0,1|1,0,2]=4 1015 B15R1.4030 COc1cc(ccc1Br)OCOC(=O)C 34a_100011827694_100009813279 [0,0,0,0,0,1|2,0,1]=4 1016 B15R1.4030 COc1cc(ccc1Br)SCC=C(C)C 62a_100000761012_100012353699 [0,0,0,0,0,1|2,0,1]=4 1017 B15R1.4030 COc1cc(ccc1Br)SCC=C(C)C 62a_100012353699_100000761012 [0,0,0,0,0,1|2,0,1]=4 1018 B15R1.4030 COc1cc(ccc1Br)SCCC(=O)C 62a_100000053229_100012353699 [0,0,0,0,0,1|1,0,2]=4 1019 B15R1.4030 COc1cc(ccc1Br)SCCC(=O)C 62a_100012353699_100000053229 [0,0,0,0,0,1|1,0,2]=4 1020 B15R1.4030 COc1cc(ccc1Br)SCOC(=O)C 62a_100000076356_100012353699 [0,0,0,0,0,1|2,0,1]=4 1021 B15R1.4030 COc1cc(ccc1Br)SCOC(=O)C 62a_100012353699_100000076356 [0,0,0,0,0,1|2,0,1]=4 1022 B15R1.4030 COc1cc(ccc1C)C=CCC(C)C 271570a_100016259101_100011830276 [0,0,0,0,0,1|2,0,1]=4 1023 B15R1.4030 COc1cc(ccc1C)C=NNC(=O)C 4a_100000189765_100000719150 [0,0,0,0,0,1|2,0,0]=3 1024 B15R1.4030 COc1cc(ccc1C)NCC=C(C)C 2230a_100011279678_100000761012 [0,0,0,0,0,1|2,0,1]=4 1025 B15R1.4030 COc1cc(ccc1C)NCC=C(C)C 34a_100011279678_100000761012 [0,0,0,0,0,1|2,0,1]=4 1026 B15R1.4030 COc1cc(ccc1C)NCOC(=O)C 34a_100011279678_100009813279 [0,0,0,0,0,1|2,0,1]=4 1027 B15R1.4030 COc1cc(ccc1C)OCC=C(C)C 34a_100009865632_100000761012 [0,0,0,0,0,1|2,0,1]=4 1028 B15R1.4030 COc1cc(ccc1C)OCC=C(C)C 7a_100009865632_100000761012 [0,0,0,0,0,1|2,0,1]=4 1029 B15R1.4030 COc1cc(ccc1C)OCCC(=O)C 7a_100009865632_100000053229 [0,0,0,0,0,1|1,0,2]=4 1030 B15R1.4030 COc1cc(ccc1C)OCOC(=O)C 34a_100009865632_100009813279 [0,0,0,0,0,1|2,0,1]=4 1031 B15R1.4030 COc1cc(ccc1C)SCC=C(C)C 62a_100000761012_100011830276 [0,0,0,0,0,1|2,0,1]=4 1032 B15R1.4030 COc1cc(ccc1C)SCC=C(C)C 62a_100011830276_100000761012 [0,0,0,0,0,1|2,0,1]=4 1033 B15R1.4030 COc1cc(ccc1C)SCCC(=O)C 62a_100000053229_100011830276 [0,0,0,0,0,1|1,0,2]=4 1034 B15R1.4030 COc1cc(ccc1C)SCCC(=O)C 62a_100011830276_100000053229 [0,0,0,0,0,1|1,0,2]=4 1035 B15R1.4030 COc1cc(ccc1C)SCOC(=O)C 62a_100000076356_100011830276 [0,0,0,0,0,1|2,0,1]=4 1036 B15R1.4030 COc1cc(ccc1C)SCOC(=O)C 62a_100011830276_100000076356 [0,0,0,0,0,1|2,0,1]=4 1037 B15R1.4030 COc1cc(ccc1Cl)C=CCC(C)C 271570a_100016259101_100011356853 [0,0,0,0,0,1|2,0,1]=4 1038 B15R1.4030 COc1cc(ccc1Cl)C=NNC(=O)C 4a_100000189765_100011998524 [0,0,0,0,0,1|2,0,0]=3 1039 B15R1.4030 COc1cc(ccc1Cl)COCC(=O)C 34a_100000211253_200010214485 [0,0,0,0,0,1|1,0,2]=4 1040 B15R1.4030 COc1cc(ccc1Cl)NCC=C(C)C 2230a_100000742311_100000761012 [0,0,0,0,0,1|2,0,1]=4 1041 B15R1.4030 COc1cc(ccc1Cl)NCC=C(C)C 34a_100000742311_100000761012 [0,0,0,0,0,1|2,0,1]=4 1042 B15R1.4030 COc1cc(ccc1Cl)NCOC(=O)C 34a_100000742311_100009813279 [0,0,0,0,0,1|2,0,1]=4 1043 B15R1.4030 COc1cc(ccc1Cl)OCC=C(C)C 34a_100012186310_100000761012 [0,0,0,0,0,1|2,0,1]=4 1044 B15R1.4030 COc1cc(ccc1Cl)OCC=C(C)C 7a_100012186310_100000761012 [0,0,0,0,0,1|2,0,1]=4 1045 B15R1.4030 COc1cc(ccc1Cl)OCCC(=O)C 7a_100012186310_100000053229 [0,0,0,0,0,1|1,0,2]=4 1046 B15R1.4030 COc1cc(ccc1Cl)OCOC(=O)C 34a_100012186310_100009813279 [0,0,0,0,0,1|2,0,1]=4 1047 B15R1.4030 COc1cc(ccc1Cl)SCC=C(C)C 62a_100000761012_100011356853 [0,0,0,0,0,1|2,0,1]=4 1048 B15R1.4030 COc1cc(ccc1Cl)SCC=C(C)C 62a_100011356853_100000761012 [0,0,0,0,0,1|2,0,1]=4 1049 B15R1.4030 COc1cc(ccc1Cl)SCCC(=O)C 62a_100000053229_100011356853 [0,0,0,0,0,1|1,0,2]=4 1050 B15R1.4030 COc1cc(ccc1Cl)SCCC(=O)C 62a_100011356853_100000053229 [0,0,0,0,0,1|1,0,2]=4 1051 B15R1.4030 COc1cc(ccc1Cl)SCOC(=O)C 62a_100000076356_100011356853 [0,0,0,0,0,1|2,0,1]=4 1052 B15R1.4030 COc1cc(ccc1Cl)SCOC(=O)C 62a_100011356853_100000076356 [0,0,0,0,0,1|2,0,1]=4 1053 B15R1.4030 COc1cc(ccc1F)C=CCC(C)C 271570a_100016259101_100011934186 [0,0,0,0,0,1|2,0,1]=4 1054 B15R1.4030 COc1cc(ccc1F)C=NNC(=O)C 4a_100000189765_100000692873 [0,0,0,0,0,1|2,0,0]=3 1055 B15R1.4030 COc1cc(ccc1F)COCC(=O)C 34a_100000211253_100012349856 [0,0,0,0,0,1|1,0,2]=4 1056 B15R1.4030 COc1cc(ccc1F)NCC=C(C)C 2230a_100000701188_100000761012 [0,0,0,0,0,1|2,0,1]=4 1057 B15R1.4030 COc1cc(ccc1F)NCC=C(C)C 34a_100000701188_100000761012 [0,0,0,0,0,1|2,0,1]=4 1058 B15R1.4030 COc1cc(ccc1F)NCOC(=O)C 34a_100000701188_100009813279 [0,0,0,0,0,1|2,0,1]=4 1059 B15R1.4030 COc1cc(ccc1F)OCC=C(C)C 34a_100012001760_100000761012 [0,0,0,0,0,1|2,0,1]=4 1060 B15R1.4030 COc1cc(ccc1F)OCC=C(C)C 7a_100012001760_100000761012 [0,0,0,0,0,1|2,0,1]=4 1061 B15R1.4030 COc1cc(ccc1F)OCCC(=O)C 7a_100012001760_100000053229 [0,0,0,0,0,1|1,0,2]=4 1062 B15R1.4030 COc1cc(ccc1F)OCOC(=O)C 34a_100012001760_100009813279 [0,0,0,0,0,1|2,0,1]=4 1063 B15R1.4030 COc1cc(ccc1F)SCC=C(C)C 62a_100000761012_100011934186 [0,0,0,0,0,1|2,0,1]=4 1064 B15R1.4030 COc1cc(ccc1F)SCC=C(C)C 62a_100011934186_100000761012 [0,0,0,0,0,1|2,0,1]=4 1065 B15R1.4030 COc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100011934186 [0,0,0,0,0,1|1,0,2]=4 1066 B15R1.4030 COc1cc(ccc1F)SCCC(=O)C 62a_100011934186_100000053229 [0,0,0,0,0,1|1,0,2]=4 1067 B15R1.4030 COc1cc(ccc1F)SCOC(=O)C 62a_100000076356_100011934186 [0,0,0,0,0,1|2,0,1]=4 1068 B15R1.4030 COc1cc(ccc1F)SCOC(=O)C 62a_100011934186_100000076356 [0,0,0,0,0,1|2,0,1]=4 1069 B15R1.4030 COc1cc(ccc1I)NCC=C(C)C 34a_100000746945_100000761012 [0,0,0,0,0,1|2,0,1]=4 1070 B15R1.4030 COc1cc(ccc1I)NCOC(=O)C 34a_100000746945_100009813279 [0,0,0,0,0,1|2,0,1]=4 1071 B15R1.4030 COc1cc(ccc1N)C=CCC(C)C 271570a_100016259101_100011279103 [0,0,0,0,0,1|2,0,1]=4 1072 B15R1.4030 COc1cc(ccc1N)OCC=C(C)C 34a_100015326901_100000761012 [0,0,0,0,0,1|2,0,1]=4 1073 B15R1.4030 COc1cc(ccc1N)OCC=C(C)C 7a_100015326901_100000761012 [0,0,0,0,0,1|2,0,1]=4 1074 B15R1.4030 COc1cc(ccc1N)OCCC(=O)C 7a_100015326901_100000053229 [0,0,0,0,0,1|1,0,2]=4 1075 B15R1.4030 COc1cc(ccc1N)OCOC(=O)C 34a_100015326901_100009813279 [0,0,0,0,0,1|2,0,1]=4 1076 B15R1.4030 COc1cc(ccc1N)SCC=C(C)C 62a_100000761012_100015196925 [0,0,0,0,0,1|2,0,1]=4 1077 B15R1.4030 COc1cc(ccc1N)SCC=C(C)C 62a_100011279103_100000761012 [0,0,0,0,0,1|2,0,1]=4 1078 B15R1.4030 COc1cc(ccc1N)SCCC(=O)C 62a_100000053229_100015196925 [0,0,0,0,0,1|1,0,2]=4 1079 B15R1.4030 COc1cc(ccc1N)SCCC(=O)C 62a_100011279103_100000053229 [0,0,0,0,0,1|1,0,2]=4 1080 B15R1.4030 COc1cc(ccc1N)SCOC(=O)C 62a_100000076356_100015196925 [0,0,0,0,0,1|2,0,1]=4 1081 B15R1.4030 COc1cc(ccc1N)SCOC(=O)C 62a_100011279103_100000076356 [0,0,0,0,0,1|2,0,1]=4 1082 B15R1.4030 COc1cc(ccc1O)C=CCC(C)C 271570a_100016259101_100000694246 [0,0,0,0,0,1|1,0,1]=3 1083 B15R1.4030 COc1cc(ccc1O)C=NNC(=O)C 4a_100000189765_100000188322 [0,0,0,0,0,1|1,0,0]=2 1084 B15R1.4030 COc1cc(ccc1O)C=NNC(C)C 4a_100000741168_100000188322 [0,0,0,0,0,1|2,0,1]=4 1085 B15R1.4030 COc1cc(ccc1O)CCNC(=O)C 240690a_100000756042_100015343762 [0,0,0,0,0,1|0,0,2]=3 1086 B15R1.4030 COc1cc(ccc1O)CCNC(=O)C 527a_100000756042_100103153847 [0,0,0,0,0,1|0,0,2]=3 1087 B15R1.4030 COc1cc(ccc1O)CNCC(=O)N 34a_100000185554_100000187820 [0,0,0,0,0,1|1,0,2]=4 1088 B15R1.4030 COc1cc(ccc1O)CNCC(=O)[O-] 34a_100000185554_100020667443 [0,0,0,0,0,1|1,0,2]=4 1089 B15R1.4030 COc1cc(ccc1O)NCC=C(C)C 34a_100000726020_100000761012 [0,0,0,0,0,1|1,0,1]=3 1090 B15R1.4030 COc1cc(ccc1O)NCCC(=O)N 34a_100000726020_100000731001 [0,0,0,0,0,1|1,0,2]=4 1091 B15R1.4030 COc1cc(ccc1O)NCOC(=O)C 34a_100000726020_100009813279 [0,0,0,0,0,1|1,0,1]=3 1092 B15R1.4030 COc1cc(ccc1O)SCC=C(C)C 62a_100000761012_100000694246 [0,0,0,0,0,1|1,0,1]=3 1093 B15R1.4030 COc1cc(ccc1O)SCCC(=O)C 62a_100000053229_100000694246 [0,0,0,0,0,1|0,0,2]=3 1094 B15R1.4030 COc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000694246 [0,0,0,0,0,1|1,0,2]=4 1095 B15R1.4030 COc1cc(ccc1O)SCOC(=O)C 62a_100000076356_100000694246 [0,0,0,0,0,1|1,0,1]=3 1096 B15R1.4030 COc1nc(ccc1O)C=CCC(C)C 271570a_100016259101_100010893133 [0,0,0,0,0,1|2,0,1]=4 1097 B15R1.4030 COc1nc(ccc1O)SCC=C(C)C 62a_100000761012_100010893133 [0,0,0,0,0,1|2,0,1]=4 1098 B15R1.4030 COc1nc(ccc1O)SCCC(=O)C 62a_100000053229_100010893133 [0,0,0,0,0,1|1,0,2]=4 1099 B15R1.4030 COc1nc(ccc1O)SCOC(=O)C 62a_100000076356_100010893133 [0,0,0,0,0,1|2,0,1]=4 1100 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [2,0,0,0,0,0|0,0,0]=2 1101 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [2,0,0,0,0,0|1,0,0]=3 1102 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [2,0,0,0,0,0|1,0,0]=3 1103 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [2,0,0,0,0,0|1,0,0]=3 1104 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [2,0,0,0,0,0|1,0,0]=3 1105 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [2,0,0,0,0,0|1,0,0]=3 1106 B12R1.21 CC(=O)C=Cc1ccc(cn1)F 1458a_100020630499_200000210301 [2,0,0,0,0,0|2,0,0]=4 1107 B12R1.21 CC(=O)C=Cc1ccc(nc1)Br 1458a_100020588214_200000210301 [2,0,0,0,0,0|2,0,0]=4 1108 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [2,0,0,0,0,0|0,0,2]=4 1109 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [2,0,0,0,0,0|0,0,2]=4 1110 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [2,0,0,0,0,0|0,0,2]=4 1111 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [2,0,0,0,0,0|1,0,1]=4 1112 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [2,0,0,0,0,0|1,0,1]=4 1113 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [2,0,0,0,0,0|1,0,1]=4 1114 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [2,0,0,0,0,0|1,0,1]=4 1115 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [2,0,0,0,0,0|2,0,0]=4 1116 B12R1.21 CC(C)C=Cc1ccc(cc1)O 271570a_100016257149_100000185759 [2,0,0,0,0,0|1,0,1]=4 1117 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [2,0,0,0,0,0|0,0,2]=4 1118 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [2,0,0,0,0,0|1,0,0]=3 1119 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [2,0,0,0,0,0|1,0,0]=3 1120 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [2,0,0,0,0,0|1,0,0]=3 1121 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [2,0,0,0,0,0|1,0,0]=3 1122 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [2,0,0,0,0,0|1,0,0]=3 1123 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cn1)F 1458a_100020630499_200025704644 [2,0,0,0,0,0|2,0,0]=4 1124 B12R1.21 [13CH3]C(=O)C=Cc1ccc(nc1)Br 1458a_100020588214_200025704644 [2,0,0,0,0,0|2,0,0]=4 1125 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [2,0,0,0,0,0|0,0,2]=4 1126 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [2,0,0,0,0,0|1,0,1]=4 1127 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [2,0,0,0,0,0|0,0,0]=2 1128 B12R1.226 CC(=O)C#Cc1cccc(c1)C 1458a_100011892726_200000210301 [2,0,0,0,0,0|0,0,2]=4 1129 B12R1.226 CC(=O)C#Cc1cccc(c1)O 1458a_200009909484_200000210301 [2,0,0,0,0,0|0,0,2]=4 1130 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [2,0,0,0,0,0|1,0,0]=3 1131 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [2,0,0,0,0,0|0,0,0]=2 1132 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [2,0,0,0,0,0|1,0,0]=3 1133 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [2,0,0,0,0,0|1,0,0]=3 1134 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [2,0,0,0,0,0|1,0,0]=3 1135 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [2,0,0,0,0,0|0,0,2]=4 1136 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [2,0,0,0,0,0|0,0,2]=4 1137 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [2,0,0,0,0,0|0,0,2]=4 1138 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [2,0,0,0,0,0|0,0,2]=4 1139 B12R1.226 CC(=O)COc1cccc(c1)C 1458a_100000183606_200000210301 [2,0,0,0,0,0|1,0,1]=4 1140 B12R1.226 CC(=O)NCc1cccc(c1)C 11a_100000185548_100015343762 [2,0,0,0,0,0|1,0,1]=4 1141 B12R1.226 CC(=O)NCc1cccc(c1)C 1626a_100000185548_100015343762 [2,0,0,0,0,0|1,0,1]=4 1142 B12R1.226 CC(=O)NCc1cccc(c1)C 240690a_100000185548_100015343762 [2,0,0,0,0,0|1,0,1]=4 1143 B12R1.226 CC(=O)NCc1cccc(c1)C 527a_100000185548_100103153847 [2,0,0,0,0,0|1,0,1]=4 1144 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [2,0,0,0,0,0|1,0,1]=4 1145 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [2,0,0,0,0,0|1,0,1]=4 1146 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [2,0,0,0,0,0|1,0,1]=4 1147 B12R1.226 CC(=O)NNc1cccc(c1)C 22a_100000681630_100000070787 [2,0,0,0,0,0|2,0,0]=4 1148 B12R1.226 CC(C)C=Cc1cccc(c1)O 271570a_100016257149_100000211634 [2,0,0,0,0,0|1,0,1]=4 1149 B12R1.226 CC(O)C=Cc1cccc(c1)O 271570a_200011019289_100000211634 [2,0,0,0,0,0|0,0,2]=4 1150 B12R1.226 Cc1cccc(c1)C#CC(=O)[13CH3] 1458a_100011892726_200025704644 [2,0,0,0,0,0|0,0,2]=4 1151 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [2,0,0,0,0,0|0,0,0]=2 1152 B12R1.226 Cc1cccc(c1)C=CC(C)C 271570a_100016257149_100011215228 [2,0,0,0,0,0|1,0,1]=4 1153 B12R1.226 Cc1cccc(c1)C=CC(C)O 271570a_200011019289_100011215228 [2,0,0,0,0,0|0,0,2]=4 1154 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [2,0,0,0,0,0|0,0,2]=4 1155 B12R1.226 Cc1cccc(c1)OCC(=O)[13CH3] 1458a_100000183606_200025704644 [2,0,0,0,0,0|1,0,1]=4 1156 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)O 1458a_200009909484_200025704644 [2,0,0,0,0,0|0,0,2]=4 1157 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [2,0,0,0,0,0|1,0,0]=3 1158 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [2,0,0,0,0,0|1,0,0]=3 1159 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [2,0,0,0,0,0|1,0,0]=3 1160 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [2,0,0,0,0,0|1,0,0]=3 1161 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [2,0,0,0,0,0|0,0,2]=4 1162 B12R1.385 Cc1cc(ccc1O)NCC=O 34a_100011218179_200009817547 [2,0,0,0,0,0|1,0,1]=4 1163 B12R1.385 Cc1cc(ccc1O)NCC=O 7a_100011218179_200015260668 [2,0,0,0,0,0|1,0,1]=4 1164 B12R1.385 Cc1cc(ccc1O)SCC=O 62a_200015260668_100000186361 [2,0,0,0,0,0|1,0,1]=4 1165 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [2,0,0,0,0,0|1,0,1]=4 1166 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [2,0,0,0,0,0|1,0,1]=4 1167 B12R1.286 C=C=Cc1ccc(c(c1)CC)O 271570a_100015277604_100012338938 [2,0,0,0,0,0|1,0,1]=4 1168 B12R1.286 C=C=Cc1ccc(c(c1)OC)Br 271570a_100015277604_100012353699 [2,0,0,0,0,0|1,0,1]=4 1169 B12R1.286 C=C=Cc1ccc(c(c1)OC)C 271570a_100015277604_100011830276 [2,0,0,0,0,0|1,0,1]=4 1170 B12R1.286 C=C=Cc1ccc(c(c1)OC)Cl 271570a_100015277604_100011356853 [2,0,0,0,0,0|1,0,1]=4 1171 B12R1.286 C=C=Cc1ccc(c(c1)OC)F 271570a_100015277604_100011934186 [2,0,0,0,0,0|1,0,1]=4 1172 B12R1.286 C=C=Cc1ccc(c(c1)OC)N 271570a_100015277604_100011279103 [2,0,0,0,0,0|1,0,1]=4 1173 B12R1.286 C=C=Cc1ccc(c(c1)OC)O 271570a_100015277604_100000694246 [2,0,0,0,0,0|0,0,1]=3 1174 B12R1.286 C=C=Cc1ccc(c(n1)OC)O 271570a_100015277604_100010893133 [2,0,0,0,0,0|1,0,1]=4 1175 B12R1.286 CC=Cc1c[nH]c(=O)c(c1)OC 271570a_100016259895_100010125397 [2,0,0,0,0,0|1,0,1]=4 1176 B12R1.286 CC=Cc1cc(c(cn1)C)OC 271570a_100016259895_100010067687 [2,0,0,0,0,0|2,0,0]=4 1177 B12R1.286 CC=Cc1cc(c(cn1)F)OC 271570a_100016259895_200010136270 [2,0,0,0,0,0|2,0,0]=4 1178 B12R1.286 CC=Cc1cc(c(cn1)N)OC 271570a_100016259895_100009887741 [2,0,0,0,0,0|2,0,0]=4 1179 B12R1.286 CC=Cc1ccc(c(c1)C#N)O 271570a_100016259895_100000687585 [2,0,0,0,0,0|2,0,0]=4 1180 B12R1.286 CC=Cc1ccc(c(c1)C=O)O 271570a_100016259895_100000186750 [2,0,0,0,0,0|2,0,0]=4 1181 B12R1.286 CC=Cc1ccc(c(c1)CC)Br 271570a_100016259895_100010244631 [2,0,0,0,0,0|2,0,0]=4 1182 B12R1.286 CC=Cc1ccc(c(c1)CC)F 271570a_100016259895_100010244625 [2,0,0,0,0,0|2,0,0]=4 1183 B12R1.286 CC=Cc1ccc(c(c1)CC)N 271570a_100016259895_100000686106 [2,0,0,0,0,0|2,0,0]=4 1184 B12R1.286 CC=Cc1ccc(c(c1)CC)O 271570a_100016259895_100012338938 [2,0,0,0,0,0|1,0,0]=3 1185 B12R1.286 CC=Cc1ccc(c(c1)CN)O 271570a_100016259895_100000730032 [2,0,0,0,0,0|2,0,0]=4 1186 B12R1.286 CC=Cc1ccc(c(c1)CO)O 271570a_100016259895_100000184703 [2,0,0,0,0,0|2,0,0]=4 1187 B12R1.286 CC=Cc1ccc(c(c1)NC)C 271570a_100016259895_100020629602 [2,0,0,0,0,0|2,0,0]=4 1188 B12R1.286 CC=Cc1ccc(c(c1)NC)F 271570a_100016259895_100011314990 [2,0,0,0,0,0|2,0,0]=4 1189 B12R1.286 CC=Cc1ccc(c(c1)NC)N 271570a_100016259895_100000694363 [2,0,0,0,0,0|2,0,0]=4 1190 B12R1.286 CC=Cc1ccc(c(c1)OC)Br 271570a_100016259895_100012353699 [2,0,0,0,0,0|1,0,0]=3 1191 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [2,0,0,0,0,0|1,0,0]=3 1192 B12R1.286 CC=Cc1ccc(c(c1)OC)Cl 271570a_100016259895_100011356853 [2,0,0,0,0,0|1,0,0]=3 1193 B12R1.286 CC=Cc1ccc(c(c1)OC)F 271570a_100016259895_100011934186 [2,0,0,0,0,0|1,0,0]=3 1194 B12R1.286 CC=Cc1ccc(c(c1)OC)N 271570a_100016259895_100011279103 [2,0,0,0,0,0|1,0,0]=3 1195 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [2,0,0,0,0,0|0,0,0]=2 1196 B12R1.286 CC=Cc1ccc(c(c1)SC)F 271570a_100016259895_100010341305 [2,0,0,0,0,0|1,1,0]=4 1197 B12R1.286 CC=Cc1ccc(c(n1)OC)N 271570a_100016259895_100000687816 [2,0,0,0,0,0|2,0,0]=4 1198 B12R1.286 CC=Cc1ccc(c(n1)OC)O 271570a_100016259895_100010893133 [2,0,0,0,0,0|1,0,0]=3 1199 B12R1.286 CC=Cc1cnc(c(c1)OC)C 271570a_100016259895_100010254219 [2,0,0,0,0,0|2,0,0]=4 1200 B12R1.286 CC=Cc1cnc(c(c1)OC)F 271570a_100016259895_100010214931 [2,0,0,0,0,0|2,0,0]=4 1201 B12R1.286 CC=Cc1cnc(c(c1)OC)N 271570a_100016259895_106354213024 [2,0,0,0,0,0|2,0,0]=4 1202 B12R1.286 CC=Cc1cnc(c(n1)OC)O 271570a_100016259895_200010365344 [2,0,0,0,0,0|2,0,0]=4 1203 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [2,0,0,0,0,0|1,0,1]=4 1204 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [2,0,0,0,0,0|1,0,1]=4 1205 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [2,0,0,0,0,0|1,0,1]=4 1206 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [2,0,0,0,0,0|1,0,1]=4 1207 B12R1.382 CC=NNc1cccc(c1)OC 4a_100000722927_200000210099 [2,0,0,0,0,0|2,0,0]=4 1208 B12R1.382 COc1cccc(c1)NCC=O 34a_100000210024_200009817547 [2,0,0,0,0,0|1,0,1]=4 1209 B12R1.382 COc1cccc(c1)OCC=O 34a_100000211255_200009817547 [2,0,0,0,0,0|1,0,1]=4 1210 B12R1.382 COc1cccc(c1)OCC=O 7a_100000211255_200015260668 [2,0,0,0,0,0|1,0,1]=4 1211 B12R1.382 COc1cccc(c1)SCC=O 62a_200015260668_100000170001 [2,0,0,0,0,0|1,0,1]=4 1212 B14R1.684 CC(C)(C)C=Cc1ccc(c(c1)O)O 271570a_100102527731_100009813601 [1,1,0,0,0,0|1,0,1]=4 1213 B14R1.684 CC(C)(O)C=Cc1ccc(c(c1)O)O 271570a_200016258132_100009813601 [1,1,0,0,0,0|0,0,2]=4 1214 B14R1.684 Cc1cc(ccc1O)C=CC(C)(C)C 271570a_100102527731_100000186361 [1,1,0,0,0,0|1,0,1]=4 1215 B14R1.684 Cc1cc(ccc1O)C=CC(C)(C)O 271570a_200016258132_100000186361 [1,1,0,0,0,0|0,0,2]=4 1216 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000748629 [1,1,0,0,0,0|1,0,1]=4 1217 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000748629 [1,1,0,0,0,0|1,0,1]=4 1218 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)C)C 1458a_100000070787_100000183365 [1,1,0,0,0,0|1,0,1]=4 1219 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)C)Cl 1458a_100000070787_200011216723 [1,1,0,0,0,0|1,0,1]=4 1220 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)Cl)O 1458a_100000070787_200010170092 [1,1,0,0,0,0|1,0,1]=4 1221 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000070787_100000183813 [1,1,0,0,0,0|0,0,1]=3 1222 B14R1.685 Cc1cc(ccc1O)C(=O)CC(=O)N 1458a_100000685612_100000187820 [1,1,0,0,0,0|1,0,1]=4 1223 B14R1.685 Cc1cc(ccc1O)C(=O)CC(=O)[O-] 1458a_100000685612_100020667443 [1,1,0,0,0,0|1,0,1]=4 1224 B14R1.685 NC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000187820 [1,1,0,0,0,0|1,0,1]=4 1225 B14R1.685 O=C([O-])CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100020667443 [1,1,0,0,0,0|1,0,1]=4 1226 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000185857 [1,1,0,0,0,0|2,0,0]=4 1227 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000185857 [1,1,0,0,0,0|2,0,0]=4 1228 B14R1.686 C=C(C)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000185857 [1,1,0,0,0,0|2,0,0]=4 1229 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)C)C 1458a_100000189585_200000210301 [1,1,0,0,0,0|2,0,0]=4 1230 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000179758 [1,1,0,0,0,0|1,0,1]=4 1231 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)O 62a_100009814033_100000186361 [1,1,0,0,0,0|1,0,1]=4 1232 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [1,1,0,0,0,0|1,0,1]=4 1233 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [1,1,0,0,0,0|0,0,2]=4 1234 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [1,1,0,0,0,0|1,0,1]=4 1235 B14R1.686 Cc1cc(ccc1O)NC(=O)C(=O)N 22a_100011218179_100011215815 [1,1,0,0,0,0|2,0,0]=4 1236 B14R1.686 Cc1ccc(cc1C)NC(=O)C(=O)[13CH3] 1458a_100000189585_200025704644 [1,1,0,0,0,0|2,0,0]=4 1237 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100011215815 [1,1,0,0,0,0|2,0,0]=4 1238 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [1,1,0,0,0,0|0,0,2]=4 1239 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Br)Cl 1458a_100102889548_100000210202 [1,1,0,0,0,0|2,0,0]=4 1240 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Br)Cl 6a_100000693810_100000211110 [1,1,0,0,0,0|2,0,0]=4 1241 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Br)F 1458a_100011195070_100000210202 [1,1,0,0,0,0|2,0,0]=4 1242 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Br)F 6a_100000211747_100000211110 [1,1,0,0,0,0|2,0,0]=4 1243 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_100000210202 [1,1,0,0,0,0|1,0,0]=3 1244 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)C)C 1458a_100011338269_100000210202 [1,1,0,0,0,0|1,0,0]=3 1245 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)C)C 6a_100000229942_100000211110 [1,1,0,0,0,0|1,0,0]=3 1246 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)C)Cl 6a_100000698814_100000211110 [1,1,0,0,0,0|1,0,0]=3 1247 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)C)F 1458a_100016261966_100000210202 [1,1,0,0,0,0|1,0,0]=3 1248 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)C)F 6a_100000748208_100000211110 [1,1,0,0,0,0|1,0,0]=3 1249 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)C 6a_100000760539_100000211110 [1,1,0,0,0,0|2,0,0]=4 1250 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)Cl 1458a_100000716972_100000210202 [1,1,0,0,0,0|2,0,0]=4 1251 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)Cl 6a_100000188533_100000211110 [1,1,0,0,0,0|2,0,0]=4 1252 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)F 1458a_100102525453_100000210202 [1,1,0,0,0,0|2,0,0]=4 1253 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)F 6a_100000742290_100000211110 [1,1,0,0,0,0|2,0,0]=4 1254 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_100000210202 [1,1,0,0,0,0|1,0,0]=3 1255 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)Cl)O 6a_100000186751_100000211110 [1,1,0,0,0,0|1,0,0]=3 1256 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)Br 1458a_100102601611_100000210202 [1,1,0,0,0,0|2,0,0]=4 1257 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)Br 6a_100000686674_100000211110 [1,1,0,0,0,0|2,0,0]=4 1258 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)C 1458a_100102526211_100000210202 [1,1,0,0,0,0|2,0,0]=4 1259 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)C 6a_100000753222_100000211110 [1,1,0,0,0,0|2,0,0]=4 1260 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)Cl 1458a_100020610926_100000210202 [1,1,0,0,0,0|2,0,0]=4 1261 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)Cl 6a_100000745630_100000211110 [1,1,0,0,0,0|2,0,0]=4 1262 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)F 1458a_100011195075_100000210202 [1,1,0,0,0,0|2,0,0]=4 1263 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)F 6a_100000211062_100000211110 [1,1,0,0,0,0|2,0,0]=4 1264 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)I 6a_100000050832_100000211110 [1,1,0,0,0,0|2,0,0]=4 1265 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)F)O 6a_100000742332_100000211110 [1,1,0,0,0,0|1,0,0]=3 1266 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)I)Br 6a_100010146563_100000211110 [1,1,0,0,0,0|2,0,0]=4 1267 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)I)C 6a_100010197721_100000211110 [1,1,0,0,0,0|2,0,0]=4 1268 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)I)Cl 6a_100010209939_100000211110 [1,1,0,0,0,0|2,0,0]=4 1269 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)I)F 6a_100010188209_100000211110 [1,1,0,0,0,0|2,0,0]=4 1270 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)I)O 6a_100000186752_100000211110 [1,1,0,0,0,0|1,0,0]=3 1271 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)O)Cl 6a_100009876013_100000211110 [1,1,0,0,0,0|1,0,0]=3 1272 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)O)F 6a_100000102368_100000211110 [1,1,0,0,0,0|1,0,0]=3 1273 B14R1.833 CCC(=O)C=Cc1ccc(c(c1)O)I 6a_100000041418_100000211110 [1,1,0,0,0,0|1,0,0]=3 1274 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_100000210202 [1,1,0,0,0,0|0,0,2]=4 1275 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000210414_200010393615 [1,1,0,0,0,0|0,0,2]=4 1276 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000747405 [1,1,0,0,0,0|1,0,1]=4 1277 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)O 62a_100000747405_100000186361 [1,1,0,0,0,0|1,0,1]=4 1278 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)O 62a_100000747405_100009813601 [1,1,0,0,0,0|1,0,1]=4 1279 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210414 [1,1,0,0,0,0|1,0,1]=4 1280 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)Cl 11a_106832991635_100102889548 [1,1,0,0,0,0|2,0,0]=4 1281 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)Cl 1626a_100102657272_100102889548 [1,1,0,0,0,0|2,0,0]=4 1282 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)Cl 240690a_100102657272_100102889548 [1,1,0,0,0,0|2,0,0]=4 1283 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)F 11a_106832991635_100011195070 [1,1,0,0,0,0|2,0,0]=4 1284 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)F 1626a_100102657272_100011195070 [1,1,0,0,0,0|2,0,0]=4 1285 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)F 240690a_100102657272_100011195070 [1,1,0,0,0,0|2,0,0]=4 1286 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Br)O 240690a_100102657272_200103079279 [1,1,0,0,0,0|1,0,0]=3 1287 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)C)C 11a_106832991635_100011338269 [1,1,0,0,0,0|1,0,0]=3 1288 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)C)C 1626a_100102657272_100011338269 [1,1,0,0,0,0|1,0,0]=3 1289 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)C)C 240690a_100102657272_100011338269 [1,1,0,0,0,0|1,0,0]=3 1290 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)C)F 11a_106832991635_100016261966 [1,1,0,0,0,0|1,0,0]=3 1291 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)C)F 1626a_100102657272_100016261966 [1,1,0,0,0,0|1,0,0]=3 1292 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)C)F 240690a_100102657272_100016261966 [1,1,0,0,0,0|1,0,0]=3 1293 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)Cl 11a_106832991635_100000716972 [1,1,0,0,0,0|2,0,0]=4 1294 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)Cl 1626a_100102657272_100000716972 [1,1,0,0,0,0|2,0,0]=4 1295 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000716972 [1,1,0,0,0,0|2,0,0]=4 1296 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)F 11a_106832991635_100102525453 [1,1,0,0,0,0|2,0,0]=4 1297 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)F 1626a_100102657272_100102525453 [1,1,0,0,0,0|2,0,0]=4 1298 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)F 240690a_100102657272_100102525453 [1,1,0,0,0,0|2,0,0]=4 1299 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)Cl)O 240690a_100102657272_200103117615 [1,1,0,0,0,0|1,0,0]=3 1300 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)Br 11a_106832991635_100102601611 [1,1,0,0,0,0|2,0,0]=4 1301 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)Br 1626a_100102657272_100102601611 [1,1,0,0,0,0|2,0,0]=4 1302 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)Br 240690a_100102657272_100102601611 [1,1,0,0,0,0|2,0,0]=4 1303 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)C 11a_106832991635_100102526211 [1,1,0,0,0,0|2,0,0]=4 1304 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)C 1626a_100102657272_100102526211 [1,1,0,0,0,0|2,0,0]=4 1305 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)C 240690a_100102657272_100102526211 [1,1,0,0,0,0|2,0,0]=4 1306 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)Cl 11a_106832991635_100020610926 [1,1,0,0,0,0|2,0,0]=4 1307 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)Cl 1626a_100102657272_100020610926 [1,1,0,0,0,0|2,0,0]=4 1308 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)Cl 240690a_100102657272_100020610926 [1,1,0,0,0,0|2,0,0]=4 1309 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)F 11a_106832991635_100011195075 [1,1,0,0,0,0|2,0,0]=4 1310 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)F 1626a_100102657272_100011195075 [1,1,0,0,0,0|2,0,0]=4 1311 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)F)F 240690a_100102657272_100011195075 [1,1,0,0,0,0|2,0,0]=4 1312 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)O)O 240690a_100102657272_100011195073 [1,1,0,0,0,0|0,0,0]=2 1313 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000183359 [1,1,0,0,0,0|1,0,1]=4 1314 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000183359 [1,1,0,0,0,0|1,0,1]=4 1315 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000183359 [1,1,0,0,0,0|1,0,1]=4 1316 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)O 62a_100000183359_100000186361 [1,1,0,0,0,0|1,0,1]=4 1317 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)O 62a_100000183359_100009813601 [1,1,0,0,0,0|1,0,1]=4 1318 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 2708a_100000010075_106832991635 [1,1,0,0,0,0|1,0,1]=4 1319 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100000010075_100102657272 [1,1,0,0,0,0|1,0,1]=4 1320 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100102657272_100000010075 [1,1,0,0,0,0|1,0,1]=4 1321 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 512a_106832991638_100000010075 [1,1,0,0,0,0|1,0,1]=4 1322 B14R1.833 COC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000747449 [1,1,0,0,0,0|1,0,1]=4 1323 B14R1.833 COC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000747449 [1,1,0,0,0,0|1,0,1]=4 1324 B14R1.833 COC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000747449 [1,1,0,0,0,0|1,0,1]=4 1325 B14R1.833 COC(=O)CSc1ccc(c(c1)C)O 62a_100000747449_100000186361 [1,1,0,0,0,0|1,0,1]=4 1326 B14R1.833 COC(=O)CSc1ccc(c(c1)O)O 62a_100000747449_100009813601 [1,1,0,0,0,0|1,0,1]=4 1327 B14R1.833 Cc1cc(ccc1Cl)C=CC(=O)CBr 6a_100000698814_100009888967 [1,1,0,0,0,0|1,0,0]=3 1328 B14R1.833 Cc1cc(ccc1Cl)C=CC(=O)CCl 6a_100000698814_100000086384 [1,1,0,0,0,0|1,0,0]=3 1329 B14R1.833 Cc1cc(ccc1Cl)C=CC(=O)CF 6a_100000698814_100000764096 [1,1,0,0,0,0|1,0,0]=3 1330 B14R1.833 Cc1cc(ccc1F)C=CC(=O)CBr 6a_100000748208_100009888967 [1,1,0,0,0,0|1,0,0]=3 1331 B14R1.833 Cc1cc(ccc1F)C=CC(=O)CCl 6a_100000748208_100000086384 [1,1,0,0,0,0|1,0,0]=3 1332 B14R1.833 Cc1cc(ccc1F)C=CC(=O)CF 1458a_100016261966_100015361967 [1,1,0,0,0,0|1,0,0]=3 1333 B14R1.833 Cc1cc(ccc1F)C=CC(=O)CF 6a_100000748208_100000764096 [1,1,0,0,0,0|1,0,0]=3 1334 B14R1.833 Cc1ccc(cc1C)C=CC(=O)CBr 6a_100000229942_100009888967 [1,1,0,0,0,0|1,0,0]=3 1335 B14R1.833 Cc1ccc(cc1C)C=CC(=O)CCl 6a_100000229942_100000086384 [1,1,0,0,0,0|1,0,0]=3 1336 B14R1.833 Cc1ccc(cc1C)C=CC(=O)CF 1458a_100011338269_100015361967 [1,1,0,0,0,0|1,0,0]=3 1337 B14R1.833 Cc1ccc(cc1C)C=CC(=O)CF 6a_100000229942_100000764096 [1,1,0,0,0,0|1,0,0]=3 1338 B14R1.833 Cc1ccc(cc1Cl)C=CC(=O)CBr 6a_100000760539_100009888967 [1,1,0,0,0,0|2,0,0]=4 1339 B14R1.833 Cc1ccc(cc1Cl)C=CC(=O)CCl 6a_100000760539_100000086384 [1,1,0,0,0,0|2,0,0]=4 1340 B14R1.833 Cc1ccc(cc1Cl)C=CC(=O)CF 6a_100000760539_100000764096 [1,1,0,0,0,0|2,0,0]=4 1341 B14R1.833 Cc1ccc(cc1F)C=CC(=O)CBr 6a_100000753222_100009888967 [1,1,0,0,0,0|2,0,0]=4 1342 B14R1.833 Cc1ccc(cc1F)C=CC(=O)CCl 6a_100000753222_100000086384 [1,1,0,0,0,0|2,0,0]=4 1343 B14R1.833 Cc1ccc(cc1F)C=CC(=O)CF 1458a_100102526211_100015361967 [1,1,0,0,0,0|2,0,0]=4 1344 B14R1.833 Cc1ccc(cc1F)C=CC(=O)CF 6a_100000753222_100000764096 [1,1,0,0,0,0|2,0,0]=4 1345 B14R1.833 Cc1ccc(cc1I)C=CC(=O)CBr 6a_100010197721_100009888967 [1,1,0,0,0,0|2,0,0]=4 1346 B14R1.833 Cc1ccc(cc1I)C=CC(=O)CCl 6a_100010197721_100000086384 [1,1,0,0,0,0|2,0,0]=4 1347 B14R1.833 Cc1ccc(cc1I)C=CC(=O)CF 6a_100010197721_100000764096 [1,1,0,0,0,0|2,0,0]=4 1348 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)Cl)CBr 6a_100000693810_100009888967 [1,1,0,0,0,0|2,0,0]=4 1349 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)Cl)CCl 6a_100000693810_100000086384 [1,1,0,0,0,0|2,0,0]=4 1350 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)Cl)CF 1458a_100102889548_100015361967 [1,1,0,0,0,0|2,0,0]=4 1351 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)Cl)CF 6a_100000693810_100000764096 [1,1,0,0,0,0|2,0,0]=4 1352 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)F)CBr 6a_100000211747_100009888967 [1,1,0,0,0,0|2,0,0]=4 1353 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)F)CCl 6a_100000211747_100000086384 [1,1,0,0,0,0|2,0,0]=4 1354 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)F)CF 1458a_100011195070_100015361967 [1,1,0,0,0,0|2,0,0]=4 1355 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)F)CF 6a_100000211747_100000764096 [1,1,0,0,0,0|2,0,0]=4 1356 B14R1.833 O=C(C=Cc1ccc(c(c1)Br)O)CF 1458a_200103079279_100015361967 [1,1,0,0,0,0|1,0,0]=3 1357 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)Cl)CBr 6a_100000188533_100009888967 [1,1,0,0,0,0|2,0,0]=4 1358 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)Cl)CCl 6a_100000188533_100000086384 [1,1,0,0,0,0|2,0,0]=4 1359 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)Cl)CF 1458a_100000716972_100015361967 [1,1,0,0,0,0|2,0,0]=4 1360 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)Cl)CF 6a_100000188533_100000764096 [1,1,0,0,0,0|2,0,0]=4 1361 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)F)CBr 6a_100000742290_100009888967 [1,1,0,0,0,0|2,0,0]=4 1362 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)F)CCl 6a_100000742290_100000086384 [1,1,0,0,0,0|2,0,0]=4 1363 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)F)CF 1458a_100102525453_100015361967 [1,1,0,0,0,0|2,0,0]=4 1364 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)F)CF 6a_100000742290_100000764096 [1,1,0,0,0,0|2,0,0]=4 1365 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)O)CBr 6a_100000186751_100009888967 [1,1,0,0,0,0|1,0,0]=3 1366 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)O)CCl 6a_100000186751_100000086384 [1,1,0,0,0,0|1,0,0]=3 1367 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)O)CF 1458a_200103117615_100015361967 [1,1,0,0,0,0|1,0,0]=3 1368 B14R1.833 O=C(C=Cc1ccc(c(c1)Cl)O)CF 6a_100000186751_100000764096 [1,1,0,0,0,0|1,0,0]=3 1369 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Br)CBr 6a_100000686674_100009888967 [1,1,0,0,0,0|2,0,0]=4 1370 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Br)CCl 6a_100000686674_100000086384 [1,1,0,0,0,0|2,0,0]=4 1371 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Br)CF 1458a_100102601611_100015361967 [1,1,0,0,0,0|2,0,0]=4 1372 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Br)CF 6a_100000686674_100000764096 [1,1,0,0,0,0|2,0,0]=4 1373 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Cl)CBr 6a_100000745630_100009888967 [1,1,0,0,0,0|2,0,0]=4 1374 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Cl)CCl 6a_100000745630_100000086384 [1,1,0,0,0,0|2,0,0]=4 1375 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Cl)CF 1458a_100020610926_100015361967 [1,1,0,0,0,0|2,0,0]=4 1376 B14R1.833 O=C(C=Cc1ccc(c(c1)F)Cl)CF 6a_100000745630_100000764096 [1,1,0,0,0,0|2,0,0]=4 1377 B14R1.833 O=C(C=Cc1ccc(c(c1)F)F)CBr 6a_100000211062_100009888967 [1,1,0,0,0,0|2,0,0]=4 1378 B14R1.833 O=C(C=Cc1ccc(c(c1)F)F)CCl 6a_100000211062_100000086384 [1,1,0,0,0,0|2,0,0]=4 1379 B14R1.833 O=C(C=Cc1ccc(c(c1)F)F)CF 1458a_100011195075_100015361967 [1,1,0,0,0,0|2,0,0]=4 1380 B14R1.833 O=C(C=Cc1ccc(c(c1)F)F)CF 6a_100000211062_100000764096 [1,1,0,0,0,0|2,0,0]=4 1381 B14R1.833 O=C(C=Cc1ccc(c(c1)F)I)CBr 6a_100000050832_100009888967 [1,1,0,0,0,0|2,0,0]=4 1382 B14R1.833 O=C(C=Cc1ccc(c(c1)F)I)CCl 6a_100000050832_100000086384 [1,1,0,0,0,0|2,0,0]=4 1383 B14R1.833 O=C(C=Cc1ccc(c(c1)F)I)CF 6a_100000050832_100000764096 [1,1,0,0,0,0|2,0,0]=4 1384 B14R1.833 O=C(C=Cc1ccc(c(c1)F)O)CBr 6a_100000742332_100009888967 [1,1,0,0,0,0|1,0,0]=3 1385 B14R1.833 O=C(C=Cc1ccc(c(c1)F)O)CCl 6a_100000742332_100000086384 [1,1,0,0,0,0|1,0,0]=3 1386 B14R1.833 O=C(C=Cc1ccc(c(c1)F)O)CF 6a_100000742332_100000764096 [1,1,0,0,0,0|1,0,0]=3 1387 B14R1.833 O=C(C=Cc1ccc(c(c1)I)Br)CBr 6a_100010146563_100009888967 [1,1,0,0,0,0|2,0,0]=4 1388 B14R1.833 O=C(C=Cc1ccc(c(c1)I)Br)CCl 6a_100010146563_100000086384 [1,1,0,0,0,0|2,0,0]=4 1389 B14R1.833 O=C(C=Cc1ccc(c(c1)I)Br)CF 6a_100010146563_100000764096 [1,1,0,0,0,0|2,0,0]=4 1390 B14R1.833 O=C(C=Cc1ccc(c(c1)I)Cl)CBr 6a_100010209939_100009888967 [1,1,0,0,0,0|2,0,0]=4 1391 B14R1.833 O=C(C=Cc1ccc(c(c1)I)Cl)CCl 6a_100010209939_100000086384 [1,1,0,0,0,0|2,0,0]=4 1392 B14R1.833 O=C(C=Cc1ccc(c(c1)I)Cl)CF 6a_100010209939_100000764096 [1,1,0,0,0,0|2,0,0]=4 1393 B14R1.833 O=C(C=Cc1ccc(c(c1)I)F)CBr 6a_100010188209_100009888967 [1,1,0,0,0,0|2,0,0]=4 1394 B14R1.833 O=C(C=Cc1ccc(c(c1)I)F)CCl 6a_100010188209_100000086384 [1,1,0,0,0,0|2,0,0]=4 1395 B14R1.833 O=C(C=Cc1ccc(c(c1)I)F)CF 6a_100010188209_100000764096 [1,1,0,0,0,0|2,0,0]=4 1396 B14R1.833 O=C(C=Cc1ccc(c(c1)I)O)CBr 6a_100000186752_100009888967 [1,1,0,0,0,0|1,0,0]=3 1397 B14R1.833 O=C(C=Cc1ccc(c(c1)I)O)CCl 6a_100000186752_100000086384 [1,1,0,0,0,0|1,0,0]=3 1398 B14R1.833 O=C(C=Cc1ccc(c(c1)I)O)CF 6a_100000186752_100000764096 [1,1,0,0,0,0|1,0,0]=3 1399 B14R1.833 O=C(C=Cc1ccc(c(c1)O)Cl)CBr 6a_100009876013_100009888967 [1,1,0,0,0,0|1,0,0]=3 1400 B14R1.833 O=C(C=Cc1ccc(c(c1)O)Cl)CCl 6a_100009876013_100000086384 [1,1,0,0,0,0|1,0,0]=3 1401 B14R1.833 O=C(C=Cc1ccc(c(c1)O)Cl)CF 6a_100009876013_100000764096 [1,1,0,0,0,0|1,0,0]=3 1402 B14R1.833 O=C(C=Cc1ccc(c(c1)O)F)CBr 6a_100000102368_100009888967 [1,1,0,0,0,0|1,0,0]=3 1403 B14R1.833 O=C(C=Cc1ccc(c(c1)O)F)CCl 6a_100000102368_100000086384 [1,1,0,0,0,0|1,0,0]=3 1404 B14R1.833 O=C(C=Cc1ccc(c(c1)O)F)CF 6a_100000102368_100000764096 [1,1,0,0,0,0|1,0,0]=3 1405 B14R1.833 O=C(C=Cc1ccc(c(c1)O)I)CBr 6a_100000041418_100009888967 [1,1,0,0,0,0|1,0,0]=3 1406 B14R1.833 O=C(C=Cc1ccc(c(c1)O)I)CCl 6a_100000041418_100000086384 [1,1,0,0,0,0|1,0,0]=3 1407 B14R1.833 O=C(C=Cc1ccc(c(c1)O)I)CF 6a_100000041418_100000764096 [1,1,0,0,0,0|1,0,0]=3 1408 B14R1.833 O=C(CF)CCc1ccc(c(c1)O)O 1458a_100000042615_100015361967 [1,1,0,0,0,0|0,0,2]=4 1409 B14R1.833 O=C(CO)CCc1ccc(c(c1)O)O 1458a_100000210174_200010393615 [1,1,0,0,0,0|0,0,2]=4 1410 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210174 [1,1,0,0,0,0|1,0,1]=4 1411 B14R1.3653 CC(C)C=Cc1ccc(c(c1)O)CO 271570a_100016257149_100000071718 [1,1,0,0,0,0|1,0,1]=4 1412 B14R1.3653 CC(O)C=Cc1ccc(c(c1)O)CO 271570a_200011019289_100000071718 [1,1,0,0,0,0|0,0,2]=4 1413 B14R1.3653 COc1ccc(cc1Br)C=CC(=O)C 1458a_200000186738_200000210301 [1,1,0,0,0,0|1,0,0]=3 1414 B14R1.3653 COc1ccc(cc1Br)C=CC(=O)[13CH3] 1458a_200000186738_200025704644 [1,1,0,0,0,0|1,0,0]=3 1415 B14R1.3653 COc1ccc(cc1C)C=CC(=O)C 1458a_100116352456_200000210301 [1,1,0,0,0,0|0,0,0]=2 1416 B14R1.3653 COc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100116352456_200025704644 [1,1,0,0,0,0|0,0,0]=2 1417 B14R1.3653 COc1ccc(cc1C)C=CC(C)C 271570a_100016257149_100011219705 [1,1,0,0,0,0|1,0,1]=4 1418 B14R1.3653 COc1ccc(cc1C)C=CC(C)O 271570a_200011019289_100011219705 [1,1,0,0,0,0|0,0,2]=4 1419 B14R1.3653 COc1ccc(cc1C)CCC(=O)C 1458a_100011616661_200000210301 [1,1,0,0,0,0|0,0,2]=4 1420 B14R1.3653 COc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011616661_200025704644 [1,1,0,0,0,0|0,0,2]=4 1421 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 11a_100102679029_100015343762 [1,1,0,0,0,0|1,0,1]=4 1422 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 1626a_100102679029_100015343762 [1,1,0,0,0,0|1,0,1]=4 1423 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 240690a_100102679029_100015343762 [1,1,0,0,0,0|1,0,1]=4 1424 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 527a_100102679029_100103153847 [1,1,0,0,0,0|1,0,1]=4 1425 B14R1.3653 COc1ccc(cc1Cl)C=CC(=O)C 1458a_100000735007_200000210301 [1,1,0,0,0,0|1,0,0]=3 1426 B14R1.3653 COc1ccc(cc1Cl)C=CC(=O)[13CH3] 1458a_100000735007_200025704644 [1,1,0,0,0,0|1,0,0]=3 1427 B14R1.3653 COc1ccc(cc1F)C=CC(=O)C 1458a_100102526129_200000210301 [1,1,0,0,0,0|1,0,0]=3 1428 B14R1.3653 COc1ccc(cc1F)C=CC(=O)[13CH3] 1458a_100102526129_200025704644 [1,1,0,0,0,0|1,0,0]=3 1429 B14R1.3653 COc1ccc(cc1O)/C=C/C(=O)C 271570a_203496583355_200016254069 [1,1,0,0,0,0|0,0,0]=2 1430 B14R1.3653 COc1ccc(cc1O)C=CC(=O)C 1458a_100000184920_200000210301 [1,1,0,0,0,0|0,0,0]=2 1431 B14R1.3653 COc1ccc(cc1O)C=CC(=O)[13CH3] 1458a_100000184920_200025704644 [1,1,0,0,0,0|0,0,0]=2 1432 B14R1.3653 COc1ccc(cc1O)C=CC(C)C 271570a_100016257149_100009816560 [1,1,0,0,0,0|1,0,1]=4 1433 B14R1.3653 COc1ccc(cc1O)C=CC(C)O 271570a_200011019289_100009816560 [1,1,0,0,0,0|0,0,2]=4 1434 B14R1.3653 COc1ccc(cc1O)CCC(=O)C 1458a_100000746301_200000210301 [1,1,0,0,0,0|0,0,2]=4 1435 B14R1.3653 COc1ccc(cc1O)CCC(=O)[13CH3] 1458a_100000746301_200025704644 [1,1,0,0,0,0|0,0,2]=4 1436 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 240690a_100000740000_100015343762 [1,1,0,0,0,0|1,0,1]=4 1437 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 527a_100000740000_100103153847 [1,1,0,0,0,0|1,0,1]=4 1438 B14R1.3653 Cc1cc(ccc1CO)C=CC(C)C 271570a_100016257149_100000748258 [1,1,0,0,0,0|1,0,1]=4 1439 B14R1.3653 Cc1cc(ccc1CO)C=CC(C)O 271570a_200011019289_100000748258 [1,1,0,0,0,0|0,0,2]=4 1440 B14R1.6036 CC(=O)C=Cc1cc(c(cc1C)C)C 1458a_100000739386_200000210301 [1,1,0,0,0,0|1,0,0]=3 1441 B14R1.6036 CC(=O)C=Cc1cc(c(cc1F)F)F 1458a_100102526214_200000210301 [1,1,0,0,0,0|2,0,0]=4 1442 B14R1.6036 Cc1cc(c(cc1C)C=CC(=O)[13CH3])C 1458a_100000739386_200025704644 [1,1,0,0,0,0|1,0,0]=3 1443 B14R1.6036 Cc1cc(c(cc1O)C)C=CC(C)C 271570a_100016257149_100000698207 [1,1,0,0,0,0|1,0,1]=4 1444 B14R1.6036 Cc1cc(c(cc1O)C)C=CC(C)O 271570a_200011019289_100000698207 [1,1,0,0,0,0|0,0,2]=4 1445 B14R1.6036 [13CH3]C(=O)C=Cc1cc(c(cc1F)F)F 1458a_100102526214_200025704644 [1,1,0,0,0,0|2,0,0]=4 1446 B14R1.6059 CC(=O)C=Cc1ccc(c(c1F)F)F 1458a_100016275240_200000210301 [1,1,0,0,0,0|2,0,0]=4 1447 B14R1.6059 Cc1c(ccc(c1C)C=CC(C)C)O 271570a_100016257149_100012353674 [1,1,0,0,0,0|1,0,1]=4 1448 B14R1.6059 Cc1c(ccc(c1C)C=CC(C)O)O 271570a_200011019289_100012353674 [1,1,0,0,0,0|0,0,2]=4 1449 B14R1.6059 Cc1c(ccc(c1F)C=CC(C)C)O 271570a_100016257149_100010390934 [1,1,0,0,0,0|1,0,1]=4 1450 B14R1.6059 Cc1c(ccc(c1F)C=CC(C)O)O 271570a_200011019289_100010390934 [1,1,0,0,0,0|0,0,2]=4 1451 B14R1.6059 [13CH3]C(=O)C=Cc1ccc(c(c1F)F)F 1458a_100016275240_200025704644 [1,1,0,0,0,0|2,0,0]=4 1452 B14R1.15552 CC(=O)C=Cc1cc(c(c(c1)F)F)F 1458a_100016255326_200000210301 [1,1,0,0,0,0|2,0,0]=4 1453 B14R1.15552 Cc1cc(cc(c1O)Br)C=CC(C)C 271570a_100016257149_100010982682 [1,1,0,0,0,0|1,0,1]=4 1454 B14R1.15552 Cc1cc(cc(c1O)Br)C=CC(C)O 271570a_200011019289_100010982682 [1,1,0,0,0,0|0,0,2]=4 1455 B14R1.15552 Cc1cc(cc(c1O)C)C=CC(C)C 271570a_100016257149_100000187306 [1,1,0,0,0,0|1,0,1]=4 1456 B14R1.15552 Cc1cc(cc(c1O)C)C=CC(C)O 271570a_200011019289_100000187306 [1,1,0,0,0,0|0,0,2]=4 1457 B14R1.15552 Cc1cc(cc(c1O)Cl)C=CC(C)C 271570a_100016257149_200015900153 [1,1,0,0,0,0|1,0,1]=4 1458 B14R1.15552 Cc1cc(cc(c1O)Cl)C=CC(C)O 271570a_200011019289_200015900153 [1,1,0,0,0,0|0,0,2]=4 1459 B14R1.15552 Cc1cc(cc(c1O)N)C=CC(C)C 271570a_100016257149_100011825904 [1,1,0,0,0,0|1,0,1]=4 1460 B14R1.15552 Cc1cc(cc(c1O)N)C=CC(C)O 271570a_200011019289_100011825904 [1,1,0,0,0,0|0,0,2]=4 1461 B14R1.15552 [13CH3]C(=O)C=Cc1cc(c(c(c1)F)F)F 1458a_100016255326_200025704644 [1,1,0,0,0,0|2,0,0]=4 1462 B14R1.626 C=CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210623 [1,1,0,0,0,0|0,0,2]=4 1463 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210303 [1,1,0,0,0,0|0,0,2]=4 1464 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)O 240690a_100015525214_100000687070 [1,1,0,0,0,0|1,0,1]=4 1465 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100010189661 [1,1,0,0,0,0|1,0,1]=4 1466 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)O 7a_106832991635_100010206313 [1,1,0,0,0,0|1,0,1]=4 1467 B14R1.626 CNNC(=O)c1ccc(c(c1)OC)O 22a_100016993582_100000687070 [1,1,0,0,0,0|2,0,0]=4 1468 B14R1.626 COc1cc(ccc1O)C(=O)CSC 62a_100010206313_200000210301 [1,1,0,0,0,0|1,0,1]=4 1469 B14R1.626 COc1cc(ccc1O)C(=O)CS[13CH3] 62a_100010206313_200025704644 [1,1,0,0,0,0|1,0,1]=4 1470 B14R1.793 CC=NNc1ccc(c(c1)OC)OC 4a_100000071703_200000210099 [1,1,0,0,0,0|2,0,0]=4 1471 B14R1.793 COc1cc(ccc1CO)NCC=O 34a_100012183141_200009817547 [1,1,0,0,0,0|1,0,1]=4 1472 B14R1.793 COc1cc(ccc1CO)OCC=O 34a_200000116926_200009817547 [1,1,0,0,0,0|1,0,1]=4 1473 B14R1.793 COc1cc(ccc1CO)SCC=O 62a_100011277633_200015260668 [1,1,0,0,0,0|1,0,1]=4 1474 B14R1.793 COc1cc(ccc1CO)SCC=O 62a_200015260668_100011277633 [1,1,0,0,0,0|1,0,1]=4 1475 B14R1.793 COc1cc(ccc1O[13CH3])/C=C\CO 34a_100016294963_200025704644 [1,1,0,0,0,0|0,0,2]=4 1476 B14R1.793 COc1ccc(cc1OC)/C=C/CO 34a_100102524974_200000210301 [1,1,0,0,0,0|0,0,2]=4 1477 B14R1.793 COc1ccc(cc1OC)/C=C\CO 34a_100016294963_200000210301 [1,1,0,0,0,0|0,0,2]=4 1478 B14R1.793 COc1ccc(cc1OC)NCC=O 34a_100000187404_200009817547 [1,1,0,0,0,0|1,0,1]=4 1479 B14R1.793 COc1ccc(cc1OC)OCC=O 34a_100000039706_200009817547 [1,1,0,0,0,0|1,0,1]=4 1480 B14R1.793 COc1ccc(cc1OC)SCC=O 62a_200015260668_100011356967 [1,1,0,0,0,0|1,0,1]=4 1481 B14R1.793 COc1ccc(cc1O[13CH3])/C=C/CO 34a_100102524974_200025704644 [1,1,0,0,0,0|0,0,2]=4 1482 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)Br 34a_100000765947_100102629194 [1,1,0,0,0,0|1,0,1]=4 1483 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)C 34a_100011279678_100102629194 [1,1,0,0,0,0|1,0,1]=4 1484 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)Cl 34a_100000742311_100102629194 [1,1,0,0,0,0|1,0,1]=4 1485 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)F 34a_100000701188_100102629194 [1,1,0,0,0,0|1,0,1]=4 1486 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)I 34a_100000746945_100102629194 [1,1,0,0,0,0|1,0,1]=4 1487 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)O 34a_100000726020_100102629194 [1,1,0,0,0,0|0,0,1]=3 1488 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Br 34a_100011827694_100102629194 [1,1,0,0,0,0|1,0,1]=4 1489 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Br 7a_100011827694_100102629194 [1,1,0,0,0,0|1,0,1]=4 1490 B14R1.907 C/C=C/COc1ccc(c(c1)OC)C 34a_100009865632_100102629194 [1,1,0,0,0,0|1,0,1]=4 1491 B14R1.907 C/C=C/COc1ccc(c(c1)OC)C 7a_100009865632_100102629194 [1,1,0,0,0,0|1,0,1]=4 1492 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Cl 34a_100012186310_100102629194 [1,1,0,0,0,0|1,0,1]=4 1493 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Cl 7a_100012186310_100102629194 [1,1,0,0,0,0|1,0,1]=4 1494 B14R1.907 C/C=C/COc1ccc(c(c1)OC)F 34a_100012001760_100102629194 [1,1,0,0,0,0|1,0,1]=4 1495 B14R1.907 C/C=C/COc1ccc(c(c1)OC)F 7a_100012001760_100102629194 [1,1,0,0,0,0|1,0,1]=4 1496 B14R1.907 C/C=C/COc1ccc(c(c1)OC)N 34a_100015326901_100102629194 [1,1,0,0,0,0|1,0,1]=4 1497 B14R1.907 C/C=C/COc1ccc(c(c1)OC)N 7a_100015326901_100102629194 [1,1,0,0,0,0|1,0,1]=4 1498 B14R1.907 C/C=C/CSc1ccc(c(c1)CC)O 62a_100102629194_100012338938 [1,1,0,0,0,0|1,0,1]=4 1499 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Br 62a_100012353699_100102629194 [1,1,0,0,0,0|1,0,1]=4 1500 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Br 62a_100102629194_100012353699 [1,1,0,0,0,0|1,0,1]=4 1501 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)C 62a_100011830276_100102629194 [1,1,0,0,0,0|1,0,1]=4 1502 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)C 62a_100102629194_100011830276 [1,1,0,0,0,0|1,0,1]=4 1503 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Cl 62a_100011356853_100102629194 [1,1,0,0,0,0|1,0,1]=4 1504 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Cl 62a_100102629194_100011356853 [1,1,0,0,0,0|1,0,1]=4 1505 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)F 62a_100011934186_100102629194 [1,1,0,0,0,0|1,0,1]=4 1506 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)F 62a_100102629194_100011934186 [1,1,0,0,0,0|1,0,1]=4 1507 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)N 62a_100011279103_100102629194 [1,1,0,0,0,0|1,0,1]=4 1508 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)N 62a_100102629194_100015196925 [1,1,0,0,0,0|1,0,1]=4 1509 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)O 62a_100102629194_100000694246 [1,1,0,0,0,0|0,0,1]=3 1510 B14R1.907 C/C=C/CSc1ccc(c(n1)OC)O 62a_100102629194_100010893133 [1,1,0,0,0,0|1,0,1]=4 1511 B14R1.907 CC=CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000070051 [1,1,0,0,0,0|1,0,1]=4 1512 B14R1.907 CC=CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000070051 [1,1,0,0,0,0|1,0,1]=4 1513 B14R1.907 CC=CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000070051 [1,1,0,0,0,0|1,0,1]=4 1514 B14R1.907 CC=CCNc1ccc(c(c1)OC)C 34a_100011279678_100000070051 [1,1,0,0,0,0|1,0,1]=4 1515 B14R1.907 CC=CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000070051 [1,1,0,0,0,0|1,0,1]=4 1516 B14R1.907 CC=CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000070051 [1,1,0,0,0,0|1,0,1]=4 1517 B14R1.907 CC=CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000070051 [1,1,0,0,0,0|1,0,1]=4 1518 B14R1.907 CC=CCNc1ccc(c(c1)OC)F 34a_100000701188_100000070051 [1,1,0,0,0,0|1,0,1]=4 1519 B14R1.907 CC=CCNc1ccc(c(c1)OC)I 34a_100000746945_100000070051 [1,1,0,0,0,0|1,0,1]=4 1520 B14R1.907 CC=CCNc1ccc(c(c1)OC)O 34a_100000726020_100000070051 [1,1,0,0,0,0|0,0,1]=3 1521 B14R1.907 CC=CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000070051 [1,1,0,0,0,0|1,0,1]=4 1522 B14R1.907 CC=CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000070051 [1,1,0,0,0,0|1,0,1]=4 1523 B14R1.907 CC=CCOc1ccc(c(c1)OC)C 34a_100009865632_100000070051 [1,1,0,0,0,0|1,0,1]=4 1524 B14R1.907 CC=CCOc1ccc(c(c1)OC)C 7a_100009865632_100000070051 [1,1,0,0,0,0|1,0,1]=4 1525 B14R1.907 CC=CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000070051 [1,1,0,0,0,0|1,0,1]=4 1526 B14R1.907 CC=CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000070051 [1,1,0,0,0,0|1,0,1]=4 1527 B14R1.907 CC=CCOc1ccc(c(c1)OC)F 34a_100012001760_100000070051 [1,1,0,0,0,0|1,0,1]=4 1528 B14R1.907 CC=CCOc1ccc(c(c1)OC)F 7a_100012001760_100000070051 [1,1,0,0,0,0|1,0,1]=4 1529 B14R1.907 CC=CCOc1ccc(c(c1)OC)N 34a_100015326901_100000070051 [1,1,0,0,0,0|1,0,1]=4 1530 B14R1.907 CC=CCOc1ccc(c(c1)OC)N 7a_100015326901_100000070051 [1,1,0,0,0,0|1,0,1]=4 1531 B14R1.907 CC=CCSc1ccc(c(c1)CC)O 62a_100000070051_100012338938 [1,1,0,0,0,0|1,0,1]=4 1532 B14R1.907 CC=CCSc1ccc(c(c1)OC)Br 62a_100000070051_100012353699 [1,1,0,0,0,0|1,0,1]=4 1533 B14R1.907 CC=CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000070051 [1,1,0,0,0,0|1,0,1]=4 1534 B14R1.907 CC=CCSc1ccc(c(c1)OC)C 62a_100000070051_100011830276 [1,1,0,0,0,0|1,0,1]=4 1535 B14R1.907 CC=CCSc1ccc(c(c1)OC)C 62a_100011830276_100000070051 [1,1,0,0,0,0|1,0,1]=4 1536 B14R1.907 CC=CCSc1ccc(c(c1)OC)Cl 62a_100000070051_100011356853 [1,1,0,0,0,0|1,0,1]=4 1537 B14R1.907 CC=CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000070051 [1,1,0,0,0,0|1,0,1]=4 1538 B14R1.907 CC=CCSc1ccc(c(c1)OC)F 62a_100000070051_100011934186 [1,1,0,0,0,0|1,0,1]=4 1539 B14R1.907 CC=CCSc1ccc(c(c1)OC)F 62a_100011934186_100000070051 [1,1,0,0,0,0|1,0,1]=4 1540 B14R1.907 CC=CCSc1ccc(c(c1)OC)N 62a_100000070051_100015196925 [1,1,0,0,0,0|1,0,1]=4 1541 B14R1.907 CC=CCSc1ccc(c(c1)OC)N 62a_100011279103_100000070051 [1,1,0,0,0,0|1,0,1]=4 1542 B14R1.907 CC=CCSc1ccc(c(c1)OC)O 62a_100000070051_100000694246 [1,1,0,0,0,0|0,0,1]=3 1543 B14R1.907 CC=CCSc1ccc(c(n1)OC)O 62a_100000070051_100010893133 [1,1,0,0,0,0|1,0,1]=4 1544 B14R1.907 CCCC=Cc1ccc(c(c1)CC)O 271570a_100016258520_100012338938 [1,1,0,0,0,0|1,0,1]=4 1545 B14R1.907 CCCC=Cc1ccc(c(c1)OC)Br 271570a_100016258520_100012353699 [1,1,0,0,0,0|1,0,1]=4 1546 B14R1.907 CCCC=Cc1ccc(c(c1)OC)C 271570a_100016258520_100011830276 [1,1,0,0,0,0|1,0,1]=4 1547 B14R1.907 CCCC=Cc1ccc(c(c1)OC)Cl 271570a_100016258520_100011356853 [1,1,0,0,0,0|1,0,1]=4 1548 B14R1.907 CCCC=Cc1ccc(c(c1)OC)F 271570a_100016258520_100011934186 [1,1,0,0,0,0|1,0,1]=4 1549 B14R1.907 CCCC=Cc1ccc(c(c1)OC)N 271570a_100016258520_100011279103 [1,1,0,0,0,0|1,0,1]=4 1550 B14R1.907 CCCC=Cc1ccc(c(c1)OC)O 271570a_100016258520_100000694246 [1,1,0,0,0,0|0,0,1]=3 1551 B14R1.907 CCCC=Cc1ccc(c(n1)OC)O 271570a_100016258520_100010893133 [1,1,0,0,0,0|1,0,1]=4 1552 B14R1.907 CCNN=Cc1ccc(c(c1)OC)O 4a_100000756455_100000188322 [1,1,0,0,0,0|1,0,1]=4 1553 B14R1.907 CCOC=Cc1ccc(c(c1)CC)O 271570a_100016256518_100012338938 [1,1,0,0,0,0|1,0,1]=4 1554 B14R1.907 CCOC=Cc1ccc(c(c1)OC)Br 271570a_100016256518_100012353699 [1,1,0,0,0,0|1,0,1]=4 1555 B14R1.907 CCOC=Cc1ccc(c(c1)OC)C 271570a_100016256518_100011830276 [1,1,0,0,0,0|1,0,1]=4 1556 B14R1.907 CCOC=Cc1ccc(c(c1)OC)Cl 271570a_100016256518_100011356853 [1,1,0,0,0,0|1,0,1]=4 1557 B14R1.907 CCOC=Cc1ccc(c(c1)OC)F 271570a_100016256518_100011934186 [1,1,0,0,0,0|1,0,1]=4 1558 B14R1.907 CCOC=Cc1ccc(c(c1)OC)N 271570a_100016256518_100011279103 [1,1,0,0,0,0|1,0,1]=4 1559 B14R1.907 CCOC=Cc1ccc(c(c1)OC)O 271570a_100016256518_100000694246 [1,1,0,0,0,0|0,0,1]=3 1560 B14R1.907 CCOC=Cc1ccc(c(n1)OC)O 271570a_100016256518_100010893133 [1,1,0,0,0,0|1,0,1]=4 1561 B14R1.907 CCc1cc(ccc1O)C=CCOC 271570a_100016286323_100012338938 [1,1,0,0,0,0|1,0,1]=4 1562 B14R1.907 COCC=Cc1ccc(c(c1)OC)Br 271570a_100016286323_100012353699 [1,1,0,0,0,0|1,0,1]=4 1563 B14R1.907 COCC=Cc1ccc(c(c1)OC)C 271570a_100016286323_100011830276 [1,1,0,0,0,0|1,0,1]=4 1564 B14R1.907 COCC=Cc1ccc(c(c1)OC)Cl 271570a_100016286323_100011356853 [1,1,0,0,0,0|1,0,1]=4 1565 B14R1.907 COCC=Cc1ccc(c(c1)OC)F 271570a_100016286323_100011934186 [1,1,0,0,0,0|1,0,1]=4 1566 B14R1.907 COCC=Cc1ccc(c(c1)OC)N 271570a_100016286323_100011279103 [1,1,0,0,0,0|1,0,1]=4 1567 B14R1.907 COCC=Cc1ccc(c(c1)OC)O 271570a_100016286323_100000694246 [1,1,0,0,0,0|0,0,1]=3 1568 B14R1.907 COCC=Cc1ccc(c(n1)OC)O 271570a_100016286323_100010893133 [1,1,0,0,0,0|1,0,1]=4 1569 B14R1.907 COc1cc(ccc1O)CNCC=O 34a_100000185554_200009817547 [1,1,0,0,0,0|0,0,2]=4 1570 B14R1.3405 C=CC(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000185746 [1,1,0,0,0,0|1,0,1]=4 1571 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210202 [1,1,0,0,0,0|0,0,2]=4 1572 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000210414 [1,1,0,0,0,0|1,0,1]=4 1573 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100000210414 [1,1,0,0,0,0|1,0,1]=4 1574 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 240690a_100102657272_100000032101 [1,1,0,0,0,0|1,0,1]=4 1575 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 527a_100102657272_100000032101 [1,1,0,0,0,0|1,0,1]=4 1576 B14R1.3405 CNC(=O)Nc1ccc(c(c1)OC)O 2430a_100000726020_100102657272 [1,1,0,0,0,0|2,0,0]=4 1577 B14R1.4435 COc1cc(c(cc1O)F)SCC=O 62a_200015260668_100010189133 [1,1,0,0,0,0|1,0,1]=4 1578 B14R1.7499 COc1cc(cc(c1O)O)SCC=O 62a_200015260668_200159242197 [1,1,0,0,0,0|1,0,1]=4 1579 B14R1.74 C=C(C)CC(=O)c1cccc(c1)OC 1458a_100000188888_100000748629 [1,1,0,0,0,0|1,0,1]=4 1580 B14R1.74 COc1cccc(c1)C(=O)CC(=O)C 1458a_100000070787_100000211451 [1,1,0,0,0,0|0,0,1]=3 1581 B14R1.74 COc1cccc(c1)C(=O)CC(=O)N 1458a_100000188888_100000187820 [1,1,0,0,0,0|1,0,1]=4 1582 B14R1.74 COc1cccc(c1)C(=O)CC(=O)[O-] 1458a_100000188888_100020667443 [1,1,0,0,0,0|1,0,1]=4 1583 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 11a_100000737859_100015343762 [1,1,0,0,0,0|1,0,1]=4 1584 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 1626a_100000737859_100015343762 [1,1,0,0,0,0|1,0,1]=4 1585 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 240690a_100000737859_100015343762 [1,1,0,0,0,0|1,0,1]=4 1586 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 527a_100000737859_100103153847 [1,1,0,0,0,0|1,0,1]=4 1587 B14R1.75 C=C(C)C(=O)Cc1cccc(c1)OC 1458a_100000185857_100000211672 [1,1,0,0,0,0|1,0,1]=4 1588 B14R1.75 C=C(C)C(=O)Nc1cccc(c1)OC 11a_100000210024_100000185857 [1,1,0,0,0,0|2,0,0]=4 1589 B14R1.75 C=C(C)C(=O)Nc1cccc(c1)OC 1626a_100000210024_100000185857 [1,1,0,0,0,0|2,0,0]=4 1590 B14R1.75 C=C(C)C(=O)Nc1cccc(c1)OC 22a_100000210024_100000185857 [1,1,0,0,0,0|2,0,0]=4 1591 B14R1.75 COc1cccc(c1)CC(O)C(=O)C 1458a_100000693103_200000210301 [1,1,0,0,0,0|0,0,2]=4 1592 B14R1.75 COc1cccc(c1)CC(O)C(=O)[13CH3] 1458a_100000693103_200025704644 [1,1,0,0,0,0|0,0,2]=4 1593 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 11a_100000184262_100015343762 [1,1,0,0,0,0|1,0,1]=4 1594 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 1626a_100000184262_100015343762 [1,1,0,0,0,0|1,0,1]=4 1595 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 240690a_100000184262_100015343762 [1,1,0,0,0,0|1,0,1]=4 1596 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 527a_100000184262_100103153847 [1,1,0,0,0,0|1,0,1]=4 1597 B14R1.75 COc1cccc(c1)NC(=O)C(=O)N 22a_100000210024_100011215815 [1,1,0,0,0,0|2,0,0]=4 1598 B14R1.75 COc1cccc(c1)OC(C)C(=O)C 1458a_100000216024_200000210301 [1,1,0,0,0,0|1,0,1]=4 1599 B14R1.75 COc1cccc(c1)OC(C)C(=O)C 7a_100000211255_100000179758 [1,1,0,0,0,0|1,0,1]=4 1600 B14R1.75 COc1cccc(c1)OC(C)C(=O)[13CH3] 1458a_100000216024_200025704644 [1,1,0,0,0,0|1,0,1]=4 1601 B14R1.75 COc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100000170001 [1,1,0,0,0,0|1,0,1]=4 1602 B14R1.77 C=Cc1cccc(c1)/C=C/C(=O)OC 271570a_100011290941_100000149372 [1,1,0,0,0,0|1,0,1]=4 1603 B14R1.77 CCC(=O)C=Cc1cccc(c1)C#N 1458a_100000738773_100000210202 [1,1,0,0,0,0|2,0,0]=4 1604 B14R1.77 CCC(=O)CCc1cccc(c1)OC 1458a_100000210414_100011713679 [1,1,0,0,0,0|0,0,2]=4 1605 B14R1.77 CCC(=O)CCc1cccc(c1)OC 1458a_100000234931_100000210202 [1,1,0,0,0,0|0,0,2]=4 1606 B14R1.77 CCC(=O)COc1cccc(c1)OC 1458a_100000182123_100000210202 [1,1,0,0,0,0|1,0,1]=4 1607 B14R1.77 CCC(=O)COc1cccc(c1)OC 7a_100000211255_100000747405 [1,1,0,0,0,0|1,0,1]=4 1608 B14R1.77 CCC(=O)CSc1cccc(c1)OC 1458a_100000741315_100000210202 [1,1,0,0,0,0|1,0,1]=4 1609 B14R1.77 CCC(=O)CSc1cccc(c1)OC 62a_100000747405_100000170001 [1,1,0,0,0,0|1,0,1]=4 1610 B14R1.77 CCC(=O)NCc1cccc(c1)OC 11a_100000174954_100000210414 [1,1,0,0,0,0|1,0,1]=4 1611 B14R1.77 CCC(=O)NCc1cccc(c1)OC 1626a_100000174954_100000210414 [1,1,0,0,0,0|1,0,1]=4 1612 B14R1.77 CCC(=O)NCc1cccc(c1)OC 240690a_100000174954_100000210414 [1,1,0,0,0,0|1,0,1]=4 1613 B14R1.77 CCC(=O)NCc1cccc(c1)OC 527a_100000174954_100000210414 [1,1,0,0,0,0|1,0,1]=4 1614 B14R1.77 CCC(=O)NNc1cccc(c1)OC 22a_100000722927_100000210414 [1,1,0,0,0,0|2,0,0]=4 1615 B14R1.77 CNC(=O)C=Cc1cccc(c1)C#N 11a_106832991635_100000738773 [1,1,0,0,0,0|2,0,0]=4 1616 B14R1.77 CNC(=O)C=Cc1cccc(c1)C#N 1626a_100102657272_100000738773 [1,1,0,0,0,0|2,0,0]=4 1617 B14R1.77 CNC(=O)C=Cc1cccc(c1)C#N 240690a_100102657272_100000738773 [1,1,0,0,0,0|2,0,0]=4 1618 B14R1.77 CNC(=O)CCc1cccc(c1)OC 11a_106832991635_100000234931 [1,1,0,0,0,0|0,0,2]=4 1619 B14R1.77 CNC(=O)CCc1cccc(c1)OC 1626a_100102657272_100000234931 [1,1,0,0,0,0|0,0,2]=4 1620 B14R1.77 CNC(=O)CCc1cccc(c1)OC 240690a_100102657272_100000234931 [1,1,0,0,0,0|0,0,2]=4 1621 B14R1.77 CNC(=O)CCc1cccc(c1)OC 527a_100102657272_100000234931 [1,1,0,0,0,0|0,0,2]=4 1622 B14R1.77 CNC(=O)CNc1cccc(c1)OC 34a_100000210024_100000183359 [1,1,0,0,0,0|1,0,1]=4 1623 B14R1.77 CNC(=O)COc1cccc(c1)OC 11a_106832991635_100000182123 [1,1,0,0,0,0|1,0,1]=4 1624 B14R1.77 CNC(=O)COc1cccc(c1)OC 1626a_100102657272_100000182123 [1,1,0,0,0,0|1,0,1]=4 1625 B14R1.77 CNC(=O)COc1cccc(c1)OC 240690a_100102657272_100000182123 [1,1,0,0,0,0|1,0,1]=4 1626 B14R1.77 CNC(=O)COc1cccc(c1)OC 34a_100000211255_100000183359 [1,1,0,0,0,0|1,0,1]=4 1627 B14R1.77 CNC(=O)COc1cccc(c1)OC 527a_100102657272_100000182123 [1,1,0,0,0,0|1,0,1]=4 1628 B14R1.77 CNC(=O)COc1cccc(c1)OC 7a_100000211255_100000183359 [1,1,0,0,0,0|1,0,1]=4 1629 B14R1.77 CNC(=O)CSc1cccc(c1)OC 11a_106832991635_100000741315 [1,1,0,0,0,0|1,0,1]=4 1630 B14R1.77 CNC(=O)CSc1cccc(c1)OC 1626a_100102657272_100000741315 [1,1,0,0,0,0|1,0,1]=4 1631 B14R1.77 CNC(=O)CSc1cccc(c1)OC 240690a_100102657272_100000741315 [1,1,0,0,0,0|1,0,1]=4 1632 B14R1.77 CNC(=O)CSc1cccc(c1)OC 527a_100102657272_100000741315 [1,1,0,0,0,0|1,0,1]=4 1633 B14R1.77 CNC(=O)CSc1cccc(c1)OC 62a_100000183359_100000170001 [1,1,0,0,0,0|1,0,1]=4 1634 B14R1.77 CNC(=O)NCc1cccc(c1)OC 2708a_100000174954_106832991635 [1,1,0,0,0,0|1,0,1]=4 1635 B14R1.77 CNC(=O)NCc1cccc(c1)OC 2708a_100102657272_100000174954 [1,1,0,0,0,0|1,0,1]=4 1636 B14R1.77 CNC(=O)NCc1cccc(c1)OC 273464a_100000174954_100102657272 [1,1,0,0,0,0|1,0,1]=4 1637 B14R1.77 CNC(=O)NCc1cccc(c1)OC 273464a_100102657272_100000174954 [1,1,0,0,0,0|1,0,1]=4 1638 B14R1.77 CNC(=O)NCc1cccc(c1)OC 512a_100000174954_100102657272 [1,1,0,0,0,0|1,0,1]=4 1639 B14R1.77 CNC(=O)NCc1cccc(c1)OC 512a_106832991638_100000174954 [1,1,0,0,0,0|1,0,1]=4 1640 B14R1.77 CNC(=O)NNc1cccc(c1)OC 273464a_100102657272_100000722927 [1,1,0,0,0,0|2,0,0]=4 1641 B14R1.77 CNC(=O)NNc1cccc(c1)OC 512a_100000722927_100102657272 [1,1,0,0,0,0|2,0,0]=4 1642 B14R1.77 CNC(=O)NNc1cccc(c1)OC 512a_106832991638_100000722927 [1,1,0,0,0,0|2,0,0]=4 1643 B14R1.77 COC(=O)/C=C/c1cccc(c1)OC 34a_200102525237_200000210301 [1,1,0,0,0,0|0,0,0]=2 1644 B14R1.77 COC(=O)/C=C/c1cccc(c1)OC 7a_200102525237_200000210301 [1,1,0,0,0,0|0,0,0]=2 1645 B14R1.77 COC(=O)/C=C/c1cccc(c1)O[13CH3] 34a_200102525237_200025704644 [1,1,0,0,0,0|0,0,0]=2 1646 B14R1.77 COC(=O)/C=C/c1cccc(c1)O[13CH3] 7a_200102525237_200025704644 [1,1,0,0,0,0|0,0,0]=2 1647 B14R1.77 COC(=O)/C=C/c1cccc(c1)SC 62a_100000149372_200000210301 [1,1,0,0,0,0|0,1,0]=3 1648 B14R1.77 COC(=O)/C=C/c1cccc(c1)SC 62a_200000210301_100000149372 [1,1,0,0,0,0|0,1,0]=3 1649 B14R1.77 COC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_100000149372_200025704644 [1,1,0,0,0,0|0,1,0]=3 1650 B14R1.77 COC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200025704644_100000149372 [1,1,0,0,0,0|0,1,0]=3 1651 B14R1.77 COC(=O)CCc1cccc(c1)OC 34a_100000067588_200000210301 [1,1,0,0,0,0|0,0,2]=4 1652 B14R1.77 COC(=O)CCc1cccc(c1)OC 7a_100000067588_200000210301 [1,1,0,0,0,0|0,0,2]=4 1653 B14R1.77 COC(=O)CCc1cccc(c1)O[13CH3] 34a_100000067588_200025704644 [1,1,0,0,0,0|0,0,2]=4 1654 B14R1.77 COC(=O)CCc1cccc(c1)O[13CH3] 7a_100000067588_200025704644 [1,1,0,0,0,0|0,0,2]=4 1655 B14R1.77 COC(=O)CNc1cccc(c1)OC 34a_100000210024_100000747449 [1,1,0,0,0,0|1,0,1]=4 1656 B14R1.77 COC(=O)COc1cccc(c1)OC 34a_100000211255_100000747449 [1,1,0,0,0,0|1,0,1]=4 1657 B14R1.77 COC(=O)COc1cccc(c1)OC 7a_100000211255_100000747449 [1,1,0,0,0,0|1,0,1]=4 1658 B14R1.77 COC(=O)CSc1cccc(c1)OC 62a_100000747449_100000170001 [1,1,0,0,0,0|1,0,1]=4 1659 B14R1.77 COc1cccc(c1)CCC(=O)CF 1458a_100000234931_100015361967 [1,1,0,0,0,0|0,0,2]=4 1660 B14R1.77 COc1cccc(c1)CCC(=O)CO 1458a_100000210174_100011713679 [1,1,0,0,0,0|0,0,2]=4 1661 B14R1.77 COc1cccc(c1)CNC(=O)CO 240690a_100000174954_100000210174 [1,1,0,0,0,0|1,0,1]=4 1662 B14R1.77 COc1cccc(c1)CNC(=O)CO 527a_100000174954_100000210174 [1,1,0,0,0,0|1,0,1]=4 1663 B14R1.77 COc1cccc(c1)NNC(=O)CO 22a_100000722927_100000210174 [1,1,0,0,0,0|2,0,0]=4 1664 B14R1.77 COc1cccc(c1)OCC(=O)CF 1458a_100000182123_100015361967 [1,1,0,0,0,0|1,0,1]=4 1665 B14R1.77 COc1cccc(c1)SCC(=O)CF 1458a_100000741315_100015361967 [1,1,0,0,0,0|1,0,1]=4 1666 B14R1.77 N#Cc1cccc(c1)C=CC(=O)CF 1458a_100000738773_100015361967 [1,1,0,0,0,0|2,0,0]=4 1667 B14R1.81 COc1cccc(c1C)C=CC(C)C 271570a_100016257149_100010002647 [1,1,0,0,0,0|1,0,1]=4 1668 B14R1.81 COc1cccc(c1C)C=CC(C)O 271570a_200011019289_100010002647 [1,1,0,0,0,0|0,0,2]=4 1669 B14R1.81 COc1cccc(c1Cl)C=CC(C)C 271570a_100016257149_100010147677 [1,1,0,0,0,0|1,0,1]=4 1670 B14R1.81 COc1cccc(c1Cl)C=CC(C)O 271570a_200011019289_100010147677 [1,1,0,0,0,0|0,0,2]=4 1671 B14R1.81 COc1cccc(c1Cl)CCC(=O)C 1458a_200000068528_200000210301 [1,1,0,0,0,0|0,0,2]=4 1672 B14R1.81 COc1cccc(c1Cl)CCC(=O)[13CH3] 1458a_200000068528_200025704644 [1,1,0,0,0,0|0,0,2]=4 1673 B14R1.81 COc1cccc(c1F)C=CC(C)C 271570a_100016257149_100010185846 [1,1,0,0,0,0|1,0,1]=4 1674 B14R1.81 COc1cccc(c1F)C=CC(C)O 271570a_200011019289_100010185846 [1,1,0,0,0,0|0,0,2]=4 1675 B14R1.81 COc1cccc(c1F)CNC(=O)C 11a_100137345169_100015343762 [1,1,0,0,0,0|1,0,1]=4 1676 B14R1.81 COc1cccc(c1F)CNC(=O)C 1626a_100137345169_100015343762 [1,1,0,0,0,0|1,0,1]=4 1677 B14R1.81 COc1cccc(c1F)CNC(=O)C 240690a_100137345169_100015343762 [1,1,0,0,0,0|1,0,1]=4 1678 B14R1.81 COc1cccc(c1F)CNC(=O)C 527a_100137345169_100103153847 [1,1,0,0,0,0|1,0,1]=4 1679 B14R1.81 COc1cccc(c1N)C=CC(C)C 271570a_100016257149_100000708083 [1,1,0,0,0,0|1,0,1]=4 1680 B14R1.81 COc1cccc(c1N)C=CC(C)O 271570a_200011019289_100000708083 [1,1,0,0,0,0|0,0,2]=4 1681 B14R1.81 COc1cccc(c1O)C=CC(C)C 271570a_100016257149_100000686866 [1,1,0,0,0,0|1,0,1]=4 1682 B14R1.81 COc1cccc(c1O)C=CC(C)O 271570a_200011019289_100000686866 [1,1,0,0,0,0|0,0,2]=4 1683 B14R1.376 COc1cc(cc(c1)C=CC(C)C)Br 271570a_100016257149_100010141301 [1,1,0,0,0,0|1,0,1]=4 1684 B14R1.376 COc1cc(cc(c1)C=CC(C)C)C 271570a_100016257149_100010187550 [1,1,0,0,0,0|1,0,1]=4 1685 B14R1.376 COc1cc(cc(c1)C=CC(C)C)Cl 271570a_100016257149_100010147680 [1,1,0,0,0,0|1,0,1]=4 1686 B14R1.376 COc1cc(cc(c1)C=CC(C)C)F 271570a_100016257149_100011934182 [1,1,0,0,0,0|1,0,1]=4 1687 B14R1.376 COc1cc(cc(c1)C=CC(C)C)N 271570a_100016257149_100000750983 [1,1,0,0,0,0|1,0,1]=4 1688 B14R1.376 COc1cc(cc(c1)C=CC(C)C)O 271570a_100016257149_100010068927 [1,1,0,0,0,0|1,0,1]=4 1689 B14R1.376 COc1cc(cc(c1)C=CC(C)O)Br 271570a_200011019289_100010141301 [1,1,0,0,0,0|0,0,2]=4 1690 B14R1.376 COc1cc(cc(c1)C=CC(C)O)C 271570a_200011019289_100010187550 [1,1,0,0,0,0|0,0,2]=4 1691 B14R1.376 COc1cc(cc(c1)C=CC(C)O)Cl 271570a_200011019289_100010147680 [1,1,0,0,0,0|0,0,2]=4 1692 B14R1.376 COc1cc(cc(c1)C=CC(C)O)F 271570a_200011019289_100011934182 [1,1,0,0,0,0|0,0,2]=4 1693 B14R1.376 COc1cc(cc(c1)C=CC(C)O)N 271570a_200011019289_100000750983 [1,1,0,0,0,0|0,0,2]=4 1694 B14R1.376 COc1cc(cc(c1)C=CC(C)O)O 271570a_200011019289_100010068927 [1,1,0,0,0,0|0,0,2]=4 1695 B14R1.376 COc1cc(cc(c1)CCC(=O)C)Br 1458a_200010146835_200000210301 [1,1,0,0,0,0|0,0,2]=4 1696 B14R1.376 COc1cc(cc(c1)CCC(=O)[13CH3])Br 1458a_200010146835_200025704644 [1,1,0,0,0,0|0,0,2]=4 1697 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 11a_106744500063_100015343762 [1,1,0,0,0,0|1,0,1]=4 1698 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 1626a_106744500063_100015343762 [1,1,0,0,0,0|1,0,1]=4 1699 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 240690a_106744500063_100015343762 [1,1,0,0,0,0|1,0,1]=4 1700 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 527a_106744500063_100103153847 [1,1,0,0,0,0|1,0,1]=4 1701 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 11a_100000696013_100015343762 [1,1,0,0,0,0|1,0,1]=4 1702 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 1626a_100000696013_100015343762 [1,1,0,0,0,0|1,0,1]=4 1703 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 240690a_100000696013_100015343762 [1,1,0,0,0,0|1,0,1]=4 1704 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 527a_100000696013_100103153847 [1,1,0,0,0,0|1,0,1]=4 1705 B14R1.468 C=C=Cc1cccc(c1)/C=C/C(=O)C 271570a_100015277604_200016266566 [1,1,0,0,0,0|1,0,1]=4 1706 B14R1.468 CC(=O)/C=C/c1cccc(c1)SCF 62a_100015361967_200016266566 [1,1,0,0,0,0|0,1,0]=3 1707 B14R1.468 CC(=O)/C=C/c1cccc(c1)SCF 62a_200016266566_100015361967 [1,1,0,0,0,0|0,1,0]=3 1708 B14R1.468 CC=Cc1cccc(c1)/C=C/C(=O)C 271570a_100016259895_200016266566 [1,1,0,0,0,0|1,0,0]=3 1709 B14R1.468 CCOc1cccc(c1)C=CC(=O)C 1458a_100011214976_200000210301 [1,1,0,0,0,0|0,0,0]=2 1710 B14R1.468 CCOc1cccc(c1)C=CC(=O)[13CH3] 1458a_100011214976_200025704644 [1,1,0,0,0,0|0,0,0]=2 1711 B14R1.468 CCOc1cccc(c1)C=CC(C)C 271570a_100016257149_100000170002 [1,1,0,0,0,0|1,0,1]=4 1712 B14R1.468 CCOc1cccc(c1)C=CC(C)O 271570a_200011019289_100000170002 [1,1,0,0,0,0|0,0,2]=4 1713 B14R1.468 CCOc1cccc(c1)CCC(=O)C 1458a_100011363991_200000210301 [1,1,0,0,0,0|0,0,2]=4 1714 B14R1.468 CCOc1cccc(c1)CCC(=O)[13CH3] 1458a_100011363991_200025704644 [1,1,0,0,0,0|0,0,2]=4 1715 B14R1.468 CCOc1cccc(c1)CNC(=O)C 11a_106359896916_100015343762 [1,1,0,0,0,0|1,0,1]=4 1716 B14R1.468 CCOc1cccc(c1)CNC(=O)C 1626a_106359896916_100015343762 [1,1,0,0,0,0|1,0,1]=4 1717 B14R1.468 CCOc1cccc(c1)CNC(=O)C 240690a_106359896916_100015343762 [1,1,0,0,0,0|1,0,1]=4 1718 B14R1.468 CCOc1cccc(c1)CNC(=O)C 527a_106359896916_100103153847 [1,1,0,0,0,0|1,0,1]=4 1719 B14R1.468 CCSc1cccc(c1)/C=C/C(=O)C 62a_100000210202_200016266566 [1,1,0,0,0,0|0,1,0]=3 1720 B14R1.468 CCSc1cccc(c1)/C=C/C(=O)C 62a_200016266566_100000210202 [1,1,0,0,0,0|0,1,0]=3 1721 B14R1.468 COCc1cccc(c1)C=CC(C)C 271570a_100016257149_100011493687 [1,1,0,0,0,0|1,0,1]=4 1722 B14R1.468 COCc1cccc(c1)C=CC(C)O 271570a_200011019289_100011493687 [1,1,0,0,0,0|0,0,2]=4 1723 B14R1.2162 COc1cccc(c1)C=CC(C)(C)C 271570a_100102527731_100000170001 [1,1,0,0,0,0|1,0,1]=4 1724 B14R1.2162 COc1cccc(c1)C=CC(C)(C)O 271570a_200016258132_100000170001 [1,1,0,0,0,0|0,0,2]=4 1725 B14R1.2335 COc1ccc(c(c1)C=CC(C)C)Br 271570a_100016257149_100009992028 [1,1,0,0,0,0|1,0,1]=4 1726 B14R1.2335 COc1ccc(c(c1)C=CC(C)C)C 271570a_100016257149_100012349166 [1,1,0,0,0,0|1,0,1]=4 1727 B14R1.2335 COc1ccc(c(c1)C=CC(C)C)Cl 271570a_100016257149_100011356938 [1,1,0,0,0,0|1,0,1]=4 1728 B14R1.2335 COc1ccc(c(c1)C=CC(C)C)F 271570a_100016257149_100000699733 [1,1,0,0,0,0|1,0,1]=4 1729 B14R1.2335 COc1ccc(c(c1)C=CC(C)C)N 271570a_100016257149_100015195136 [1,1,0,0,0,0|1,0,1]=4 1730 B14R1.2335 COc1ccc(c(c1)C=CC(C)C)O 271570a_100016257149_100000685887 [1,1,0,0,0,0|1,0,1]=4 1731 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)Br 271570a_200011019289_100009992028 [1,1,0,0,0,0|0,0,2]=4 1732 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)C 271570a_200011019289_100012349166 [1,1,0,0,0,0|0,0,2]=4 1733 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)Cl 271570a_200011019289_100011356938 [1,1,0,0,0,0|0,0,2]=4 1734 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)F 271570a_200011019289_100000699733 [1,1,0,0,0,0|0,0,2]=4 1735 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)N 271570a_200011019289_100015195136 [1,1,0,0,0,0|0,0,2]=4 1736 B14R1.2335 COc1ccc(c(c1)C=CC(C)O)O 271570a_200011019289_100000685887 [1,1,0,0,0,0|0,0,2]=4 1737 B14R1.2335 COc1ccc(c(c1)CCC(=O)C)Br 1458a_200012259420_200000210301 [1,1,0,0,0,0|0,0,2]=4 1738 B14R1.2335 COc1ccc(c(c1)CCC(=O)[13CH3])Br 1458a_200012259420_200025704644 [1,1,0,0,0,0|0,0,2]=4 1739 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 11a_100000741592_100015343762 [1,1,0,0,0,0|1,0,1]=4 1740 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 1626a_100000741592_100015343762 [1,1,0,0,0,0|1,0,1]=4 1741 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 240690a_100000741592_100015343762 [1,1,0,0,0,0|1,0,1]=4 1742 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 527a_100000741592_100103153847 [1,1,0,0,0,0|1,0,1]=4 1743 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 11a_100012180165_100015343762 [1,1,0,0,0,0|1,0,1]=4 1744 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 1626a_100012180165_100015343762 [1,1,0,0,0,0|1,0,1]=4 1745 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 240690a_100012180165_100015343762 [1,1,0,0,0,0|1,0,1]=4 1746 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 527a_100012180165_100103153847 [1,1,0,0,0,0|1,0,1]=4 1747 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 11a_100016995475_100015343762 [1,1,0,0,0,0|1,0,1]=4 1748 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 1626a_100016995475_100015343762 [1,1,0,0,0,0|1,0,1]=4 1749 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 240690a_100016995475_100015343762 [1,1,0,0,0,0|1,0,1]=4 1750 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 527a_100016995475_100103153847 [1,1,0,0,0,0|1,0,1]=4 1751 B14R1.2335 COc1ccc(c(c1)NNC(=O)C)Cl 22a_200000763216_100000070787 [1,1,0,0,0,0|2,0,0]=4 1752 B14R1.6355 C=C(C)c1cccc(c1)/C=C/C(=O)C 271570a_100000694244_200016266566 [1,1,0,0,0,0|1,0,0]=3 1753 B14R1.6355 CC(=O)C=Cc1cccc(c1)[N+](=O)[O-] 1458a_100000186624_200000210301 [1,1,0,0,0,0|2,0,0]=4 1754 B14R1.6355 [13CH3]C(=O)C=Cc1cccc(c1)[N+](=O)[O-] 1458a_100000186624_200025704644 [1,1,0,0,0,0|2,0,0]=4 1755 B14R1.41 CCc1cc(ccc1O)C(=C(C)C)C 271570a_200000049429_100012338938 [0,1,0,0,1,0|2,0,0]=4 1756 B14R1.41 COc1cc(ccc1Br)C(=C(C)C)C 271570a_200000049429_100012353699 [0,1,0,0,1,0|2,0,0]=4 1757 B14R1.41 COc1cc(ccc1C)C(=C(C)C)C 271570a_200000049429_100011830276 [0,1,0,0,1,0|2,0,0]=4 1758 B14R1.41 COc1cc(ccc1Cl)C(=C(C)C)C 271570a_200000049429_100011356853 [0,1,0,0,1,0|2,0,0]=4 1759 B14R1.41 COc1cc(ccc1F)C(=C(C)C)C 271570a_200000049429_100011934186 [0,1,0,0,1,0|2,0,0]=4 1760 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 11a_200012002703_100015343762 [0,1,0,0,1,0|2,0,0]=4 1761 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 1626a_200012002703_100015343762 [0,1,0,0,1,0|2,0,0]=4 1762 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 22a_200012002703_100000070787 [0,1,0,0,1,0|2,0,0]=4 1763 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 527a_200012002703_100103153847 [0,1,0,0,1,0|2,0,0]=4 1764 B14R1.41 COc1cc(ccc1N)C(=C(C)C)C 271570a_200000049429_100011279103 [0,1,0,0,1,0|2,0,0]=4 1765 B14R1.41 COc1cc(ccc1O)C(=C(C)C)C 271570a_200000049429_100000694246 [0,1,0,0,1,0|1,0,0]=3 1766 B14R1.41 COc1cc(ccc1O)C(=O)C(C)C 1458a_100000687070_100000210206 [0,1,0,0,1,0|1,0,1]=4 1767 B14R1.41 COc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100000687070 [0,1,0,0,1,0|2,0,0]=4 1768 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,1,0,0,1,0|0,0,1]=3 1769 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,1,0,0,1,0|0,0,1]=3 1770 B14R1.41 COc1nc(ccc1O)C(=C(C)C)C 271570a_200000049429_100010893133 [0,1,0,0,1,0|2,0,0]=4 1771 B14R1.343 CCc1cc(cc(c1O)C)C=C(C)C 271570a_100102525489_100010659108 [0,1,0,0,1,0|2,0,0]=4 1772 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 11a_100010131419_100015343762 [0,1,0,0,1,0|2,0,0]=4 1773 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 1626a_100010131419_100015343762 [0,1,0,0,1,0|2,0,0]=4 1774 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 22a_100010131419_100000070787 [0,1,0,0,1,0|2,0,0]=4 1775 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 527a_100010131419_100103153847 [0,1,0,0,1,0|2,0,0]=4 1776 B14R1.343 COc1cc(cc(c1F)C)C=C(C)C 271570a_100102525489_100010271686 [0,1,0,0,1,0|2,0,0]=4 1777 B14R1.343 COc1cc(cc(c1F)F)C=C(C)C 271570a_100102525489_100011218012 [0,1,0,0,1,0|2,0,0]=4 1778 B14R1.343 COc1cc(cc(c1F)O)C=C(C)C 271570a_100102525489_200015524394 [0,1,0,0,1,0|2,0,0]=4 1779 B14R1.343 COc1cc(cc(c1N)C)C=C(C)C 271570a_100102525489_100000741850 [0,1,0,0,1,0|2,0,0]=4 1780 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)C 1458a_100009814412_200000210301 [0,1,0,0,1,0|0,0,1]=3 1781 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)[13CH3] 1458a_100009814412_200025704644 [0,1,0,0,1,0|0,0,1]=3 1782 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100010141077_100015361967 [0,1,0,0,1,0|0,1,1]=4 1783 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100015361967_100010141077 [0,1,0,0,1,0|0,1,1]=4 1784 B14R1.439 CC(=O)Nc1ccc(c(c1)OCF)Cl 34a_100011935283_100015361967 [0,1,0,0,1,0|2,0,0]=4 1785 B14R1.439 CC(=O)Nc1ccc(c(c1)OCF)Cl 7a_100011935283_100015361967 [0,1,0,0,1,0|2,0,0]=4 1786 B14R1.439 CC=Cc1cc(ccc1O)CC(=O)C 271570a_100016259895_100010141077 [0,1,0,0,1,0|1,0,1]=4 1787 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 11a_200016990551_100015343762 [0,1,0,0,1,0|2,0,0]=4 1788 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 1626a_200016990551_100015343762 [0,1,0,0,1,0|2,0,0]=4 1789 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 22a_200016990551_100000070787 [0,1,0,0,1,0|2,0,0]=4 1790 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 527a_200016990551_100103153847 [0,1,0,0,1,0|2,0,0]=4 1791 B14R1.439 CCOc1cc(ccc1C)C=C(C)C 271570a_100102525489_100012361169 [0,1,0,0,1,0|2,0,0]=4 1792 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 11a_100011964961_100015343762 [0,1,0,0,1,0|2,0,0]=4 1793 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 1626a_100011964961_100015343762 [0,1,0,0,1,0|2,0,0]=4 1794 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 22a_100011964961_100000070787 [0,1,0,0,1,0|2,0,0]=4 1795 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 34a_100011935283_100000210202 [0,1,0,0,1,0|2,0,0]=4 1796 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 527a_100011964961_100103153847 [0,1,0,0,1,0|2,0,0]=4 1797 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 7a_100011935283_100000210202 [0,1,0,0,1,0|2,0,0]=4 1798 B14R1.439 CCOc1cc(ccc1F)C=C(C)C 271570a_100102525489_200012344967 [0,1,0,0,1,0|2,0,0]=4 1799 B14R1.439 CCOc1cc(ccc1N)C=C(C)C 271570a_100102525489_100000688918 [0,1,0,0,1,0|2,0,0]=4 1800 B14R1.439 CCOc1cc(ccc1O)CC(=O)C 1458a_200000048972_200000210301 [0,1,0,0,1,0|0,0,1]=3 1801 B14R1.439 CCOc1cc(ccc1O)CC(=O)[13CH3] 1458a_200000048972_200025704644 [0,1,0,0,1,0|0,0,1]=3 1802 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100000210202_100010141077 [0,1,0,0,1,0|0,1,1]=4 1803 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100010141077_100000210202 [0,1,0,0,1,0|0,1,1]=4 1804 B14R1.439 CNCc1cc(ccc1O)C=C(C)C 271570a_100102525489_100011602694 [0,1,0,0,1,0|2,0,0]=4 1805 B14R1.439 COCc1cc(ccc1Br)C=C(C)C 271570a_100102525489_202125822959 [0,1,0,0,1,0|2,0,0]=4 1806 B14R1.439 COCc1cc(ccc1F)C=C(C)C 271570a_100102525489_100010140362 [0,1,0,0,1,0|2,0,0]=4 1807 B14R1.705 C=C(C)c1cc(ccc1O)CC(=O)C 271570a_100000694244_100010141077 [0,1,0,0,1,0|1,0,1]=4 1808 B14R1.705 CC(=Cc1ccc(c(c1)C(C)C)O)C 271570a_100102525489_100000691460 [0,1,0,0,1,0|2,0,0]=4 1809 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)C)O 1458a_100000743812_200000210301 [0,1,0,0,1,0|2,0,0]=4 1810 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000743812_200025704644 [0,1,0,0,1,0|2,0,0]=4 1811 B14R1.705 CC(=O)c1cc(ccc1O)C=C(C)C 271570a_100102525489_100000212127 [0,1,0,0,1,0|2,0,0]=4 1812 B14R1.881 CC(=O)Nc1cc(c(cc1Cl)Cl)O[13CH3] 34a_200000039401_200025704644 [0,1,0,0,1,0|2,0,0]=4 1813 B14R1.881 CC(=O)Nc1cc(c(cc1Cl)Cl)O[13CH3] 7a_200000039401_200025704644 [0,1,0,0,1,0|2,0,0]=4 1814 B14R1.881 COc1cc(c(cc1Br)Br)C=C(C)C 271570a_100102525489_200014006352 [0,1,0,0,1,0|2,0,0]=4 1815 B14R1.881 COc1cc(c(cc1Br)Br)NC(=O)C 11a_100000718616_100015343762 [0,1,0,0,1,0|2,0,0]=4 1816 B14R1.881 COc1cc(c(cc1Br)Br)NC(=O)C 1626a_100000718616_100015343762 [0,1,0,0,1,0|2,0,0]=4 1817 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 11a_100010232211_100015343762 [0,1,0,0,1,0|2,0,0]=4 1818 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 1626a_100010232211_100015343762 [0,1,0,0,1,0|2,0,0]=4 1819 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 22a_100010232211_100000070787 [0,1,0,0,1,0|2,0,0]=4 1820 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 527a_100010232211_100103153847 [0,1,0,0,1,0|2,0,0]=4 1821 B14R1.881 COc1cc(c(cc1Br)Cl)NC(=O)C 11a_100012361290_100015343762 [0,1,0,0,1,0|2,0,0]=4 1822 B14R1.881 COc1cc(c(cc1Br)Cl)NC(=O)C 1626a_100012361290_100015343762 [0,1,0,0,1,0|2,0,0]=4 1823 B14R1.881 COc1cc(c(cc1C)Br)NC(=O)C 11a_100010244135_100015343762 [0,1,0,0,1,0|2,0,0]=4 1824 B14R1.881 COc1cc(c(cc1C)Br)NC(=O)C 1626a_100010244135_100015343762 [0,1,0,0,1,0|2,0,0]=4 1825 B14R1.881 COc1cc(c(cc1C)N)C=C(C)C 271570a_100102525489_200010584344 [0,1,0,0,1,0|2,0,0]=4 1826 B14R1.881 COc1cc(c(cc1Cl)Br)NC(=O)C 11a_100013022580_100015343762 [0,1,0,0,1,0|2,0,0]=4 1827 B14R1.881 COc1cc(c(cc1Cl)Br)NC(=O)C 1626a_100013022580_100015343762 [0,1,0,0,1,0|2,0,0]=4 1828 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 11a_100009858536_100015343762 [0,1,0,0,1,0|2,0,0]=4 1829 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 1626a_100009858536_100015343762 [0,1,0,0,1,0|2,0,0]=4 1830 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 22a_100009858536_100000070787 [0,1,0,0,1,0|2,0,0]=4 1831 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 527a_100009858536_100103153847 [0,1,0,0,1,0|2,0,0]=4 1832 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 11a_100011830341_100015343762 [0,1,0,0,1,0|2,0,0]=4 1833 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 1626a_100011830341_100015343762 [0,1,0,0,1,0|2,0,0]=4 1834 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 22a_100011830341_100000070787 [0,1,0,0,1,0|2,0,0]=4 1835 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 34a_200000039401_200000210301 [0,1,0,0,1,0|2,0,0]=4 1836 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 7a_200000039401_200000210301 [0,1,0,0,1,0|2,0,0]=4 1837 B14R1.881 COc1cc(c(cc1Cl)F)C=C(C)C 271570a_100102525489_100010739614 [0,1,0,0,1,0|2,0,0]=4 1838 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 11a_100009872666_100015343762 [0,1,0,0,1,0|2,0,0]=4 1839 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 1626a_100009872666_100015343762 [0,1,0,0,1,0|2,0,0]=4 1840 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 22a_100009872666_100000070787 [0,1,0,0,1,0|2,0,0]=4 1841 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C 11a_100010208193_100015343762 [0,1,0,0,1,0|2,0,0]=4 1842 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C 1626a_100010208193_100015343762 [0,1,0,0,1,0|2,0,0]=4 1843 B14R1.881 COc1cc(c(cc1F)C)C=C(C)C 271570a_100102525489_100011009880 [0,1,0,0,1,0|2,0,0]=4 1844 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 11a_100009958774_100015343762 [0,1,0,0,1,0|2,0,0]=4 1845 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 1626a_100009958774_100015343762 [0,1,0,0,1,0|2,0,0]=4 1846 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 22a_100009958774_100000070787 [0,1,0,0,1,0|2,0,0]=4 1847 B14R1.881 COc1cc(c(cc1F)F)C=C(C)C 271570a_100102525489_200015541288 [0,1,0,0,1,0|2,0,0]=4 1848 B14R1.881 COc1cc(c(cc1F)N)C=C(C)C 271570a_100102525489_100010365326 [0,1,0,0,1,0|2,0,0]=4 1849 B14R1.881 COc1cc(c(cc1N)C)C=C(C)C 271570a_100102525489_100010141321 [0,1,0,0,1,0|2,0,0]=4 1850 B14R1.881 COc1cc(c(cc1N)F)C=C(C)C 271570a_100102525489_100012766639 [0,1,0,0,1,0|2,0,0]=4 1851 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)C 1458a_100009814189_200000210301 [0,1,0,0,1,0|0,0,1]=3 1852 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)[13CH3] 1458a_100009814189_200025704644 [0,1,0,0,1,0|0,0,1]=3 1853 B14R1.881 COc1cc(c(cc1O)F)C=C(C)C 271570a_100102525489_100010189133 [0,1,0,0,1,0|1,0,0]=3 1854 B14R1.3412 COc1cc(ccc1O)NS(=O)(=O)C 40a_100000726020_100000738038 [0,1,0,0,1,0|2,0,0]=4 1855 B14R1.3651 CCc1cc(ccc1OC)C=C(C)C 271570a_100102525489_200010179862 [0,1,0,0,1,0|2,0,0]=4 1856 B14R1.3651 CCc1ccc(cc1OC)C=C(C)C 271570a_100102525489_200010710398 [0,1,0,0,1,0|2,0,0]=4 1857 B14R1.3651 CNc1cc(ccc1OC)NC(=O)C 34a_100000211725_200000210301 [0,1,0,0,1,0|2,0,0]=4 1858 B14R1.3651 COc1cc(ccc1C#N)C=C(C)C 271570a_100102525489_100000694671 [0,1,0,0,1,0|2,0,0]=4 1859 B14R1.3651 COc1cc(ccc1C#N)NC(=O)C 11a_100011999456_100015343762 [0,1,0,0,1,0|2,0,0]=4 1860 B14R1.3651 COc1cc(ccc1C#N)NC(=O)C 1626a_100011999456_100015343762 [0,1,0,0,1,0|2,0,0]=4 1861 B14R1.3651 COc1cc(ccc1C#N)NC(=O)C 527a_100011999456_100103153847 [0,1,0,0,1,0|2,0,0]=4 1862 B14R1.3651 COc1cc(ccc1C=O)C=C(C)C 271570a_100102525489_100000697075 [0,1,0,0,1,0|1,0,1]=4 1863 B14R1.3651 COc1cc(ccc1CO)C=C(C)C 271570a_100102525489_100011277633 [0,1,0,0,1,0|1,0,0]=3 1864 B14R1.3651 COc1cc(ccc1CO)NC(=O)C 22a_100012183141_100000070787 [0,1,0,0,1,0|1,0,0]=3 1865 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [0,1,0,0,1,0|0,0,1]=3 1866 B14R1.3651 COc1cc(ccc1SC)C=C(C)C 271570a_100102525489_200011001119 [0,1,0,0,1,0|1,1,0]=4 1867 B14R1.3651 COc1cc(cnc1CO)C=C(C)C 271570a_100102525489_200010246159 [0,1,0,0,1,0|2,0,0]=4 1868 B14R1.3651 COc1cc(cnc1OC)C=C(C)C 271570a_100102525489_100010234541 [0,1,0,0,1,0|2,0,0]=4 1869 B14R1.3651 COc1cc(ncc1CO)C=C(C)C 271570a_100102525489_100010714672 [0,1,0,0,1,0|2,0,0]=4 1870 B14R1.3651 COc1ccc(cc1N[13CH3])NC(=O)C 34a_100000211725_200025704644 [0,1,0,0,1,0|2,0,0]=4 1871 B14R1.3651 COc1ccc(cc1OC)C=C(C)C 271570a_100102525489_100000187503 [0,1,0,0,1,0|1,0,0]=3 1872 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [0,1,0,0,1,0|0,0,1]=3 1873 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [0,1,0,0,1,0|0,0,1]=3 1874 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [0,1,0,0,1,0|0,0,1]=3 1875 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 11a_100000187404_100015343762 [0,1,0,0,1,0|1,0,0]=3 1876 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 1626a_100000187404_100015343762 [0,1,0,0,1,0|1,0,0]=3 1877 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 22a_100000187404_100000070787 [0,1,0,0,1,0|1,0,0]=3 1878 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 527a_100000187404_100103153847 [0,1,0,0,1,0|1,0,0]=3 1879 B14R1.3651 COc1ccc(cc1SC)C=C(C)C 271570a_100102525489_200009892704 [0,1,0,0,1,0|1,1,0]=4 1880 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_100011493462_200000210301 [0,1,0,0,1,0|0,1,1]=4 1881 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_200000210301_100011493462 [0,1,0,0,1,0|0,1,1]=4 1882 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_100011493462_200025704644 [0,1,0,0,1,0|0,1,1]=4 1883 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_200025704644_100011493462 [0,1,0,0,1,0|0,1,1]=4 1884 B14R1.3651 COc1ccc(nc1OC)C=C(C)C 271570a_100102525489_100010214848 [0,1,0,0,1,0|2,0,0]=4 1885 B14R1.3651 COc1nc(ccc1CO)C=C(C)C 271570a_100102525489_100010988397 [0,1,0,0,1,0|2,0,0]=4 1886 B14R1.4106 COc1c(ccc(c1F)C=C(C)C)Cl 271570a_100102525489_200135222481 [0,1,0,0,1,0|2,0,0]=4 1887 B14R1.4106 COc1c(ccc(c1F)C=C(C)C)N 271570a_100102525489_100010734149 [0,1,0,0,1,0|2,0,0]=4 1888 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)Cl 1458a_100000070787_100010116237 [0,1,0,0,1,0|1,0,1]=4 1889 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)F 1458a_100000070787_100009814548 [0,1,0,0,1,0|1,0,1]=4 1890 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 11a_100137314619_100015343762 [0,1,0,0,1,0|2,0,0]=4 1891 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 1626a_100137314619_100015343762 [0,1,0,0,1,0|2,0,0]=4 1892 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 22a_100137314619_100000070787 [0,1,0,0,1,0|2,0,0]=4 1893 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 527a_100137314619_100103153847 [0,1,0,0,1,0|2,0,0]=4 1894 B16R1.406 COc1cc(cc(c1F)F)C=NNC(=O)C 4a_100000189765_100000050682 [0,1,0,0,0,1|2,0,0]=4 1895 B16R1.406 COc1cc(cc(c1O)Br)C=NNC(=O)C 4a_100000189765_100000186746 [0,1,0,0,0,1|1,0,0]=3 1896 B16R1.406 COc1cc(cc(c1O)C)C=NNC(=O)C 4a_100000189765_100000050991 [0,1,0,0,0,1|1,0,0]=3 1897 B16R1.406 COc1cc(cc(c1O)Cl)C=NNC(=O)C 4a_100000189765_100000010622 [0,1,0,0,0,1|1,0,0]=3 1898 B16R1.406 COc1cc(cc(c1O)F)C=NNC(=O)C 4a_100000189765_100000039941 [0,1,0,0,0,1|1,0,0]=3 1899 B16R1.406 COc1cc(cc(c1O)I)C=NNC(=O)C 4a_100000189765_100000184534 [0,1,0,0,0,1|1,0,0]=3 1900 B16R1.406 COc1cc(cc(c1O)O)C=NNC(=O)C 4a_100000189765_100000010769 [0,1,0,0,0,1|1,0,0]=3 1901 B16R1.406 COc1cc(cc(c1O)O)SCC=C(C)C 62a_100000761012_200159242197 [0,1,0,0,0,1|1,0,1]=4 1902 B16R1.406 COc1cc(cc(c1O)O)SCCC(=O)C 62a_100000053229_200159242197 [0,1,0,0,0,1|0,0,2]=4 1903 B16R1.406 COc1cc(cc(c1O)O)SCOC(=O)C 62a_100000076356_200159242197 [0,1,0,0,0,1|1,0,1]=4 1904 B16R1.4275 C=C(C)C=NNc1ccc(c(c1)OC)OC 4a_100000071703_100000210575 [0,1,0,0,0,1|2,0,0]=4 1905 B16R1.4275 COc1cc(ccc1C#N)C=NNC(=O)C 4a_100000189765_100000726430 [0,1,0,0,0,1|2,0,0]=4 1906 B16R1.4275 COc1cc(ccc1CO)C=CCC(C)C 271570a_100016259101_100011277633 [0,1,0,0,0,1|1,0,1]=4 1907 B16R1.4275 COc1cc(ccc1CO)NCC=C(C)C 34a_100012183141_100000761012 [0,1,0,0,0,1|1,0,1]=4 1908 B16R1.4275 COc1cc(ccc1CO)NCOC(=O)C 34a_100012183141_100009813279 [0,1,0,0,0,1|1,0,1]=4 1909 B16R1.4275 COc1cc(ccc1CO)OCC=C(C)C 34a_200000116926_100000761012 [0,1,0,0,0,1|1,0,1]=4 1910 B16R1.4275 COc1cc(ccc1CO)OCOC(=O)C 34a_200000116926_100009813279 [0,1,0,0,0,1|1,0,1]=4 1911 B16R1.4275 COc1cc(ccc1CO)SCC=C(C)C 62a_100000761012_100011277633 [0,1,0,0,0,1|1,0,1]=4 1912 B16R1.4275 COc1cc(ccc1CO)SCC=C(C)C 62a_100011277633_100000761012 [0,1,0,0,0,1|1,0,1]=4 1913 B16R1.4275 COc1cc(ccc1CO)SCCC(=O)C 62a_100000053229_100011277633 [0,1,0,0,0,1|0,0,2]=4 1914 B16R1.4275 COc1cc(ccc1CO)SCCC(=O)C 62a_100011277633_100000053229 [0,1,0,0,0,1|0,0,2]=4 1915 B16R1.4275 COc1cc(ccc1CO)SCOC(=O)C 62a_100000076356_100011277633 [0,1,0,0,0,1|1,0,1]=4 1916 B16R1.4275 COc1cc(ccc1CO)SCOC(=O)C 62a_100011277633_100000076356 [0,1,0,0,0,1|1,0,1]=4 1917 B16R1.4275 COc1cc(ccc1SC)C=NNC(=O)C 4a_100000189765_100000050949 [0,1,0,0,0,1|1,1,0]=4 1918 B16R1.4275 COc1cc(cnc1OC)C=NNC(=O)C 4a_100000189765_100000117638 [0,1,0,0,0,1|2,0,0]=4 1919 B16R1.4275 COc1ccc(cc1OC)C=CCC(C)C 271570a_100016259101_100000187503 [0,1,0,0,0,1|1,0,1]=4 1920 B16R1.4275 COc1ccc(cc1OC)C=NNC(=O)C 4a_100000189765_100000170513 [0,1,0,0,0,1|1,0,0]=3 1921 B16R1.4275 COc1ccc(cc1OC)CCCC(=O)C 1458a_100000070787_200012094798 [0,1,0,0,0,1|0,0,2]=4 1922 B16R1.4275 COc1ccc(cc1OC)CCCC(=O)C 1458a_100011217081_200000210301 [0,1,0,0,0,1|0,0,2]=4 1923 B16R1.4275 COc1ccc(cc1OC)CCCC(=O)[13CH3] 1458a_100011217081_200025704644 [0,1,0,0,0,1|0,0,2]=4 1924 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 11a_100000210947_100015343762 [0,1,0,0,0,1|0,0,2]=4 1925 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 1626a_100000210947_100015343762 [0,1,0,0,0,1|0,0,2]=4 1926 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 240690a_100000210947_100015343762 [0,1,0,0,0,1|0,0,2]=4 1927 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 527a_100000210947_100103153847 [0,1,0,0,0,1|0,0,2]=4 1928 B16R1.4275 COc1ccc(cc1OC)NCC=C(C)C 34a_100000187404_100000761012 [0,1,0,0,0,1|1,0,1]=4 1929 B16R1.4275 COc1ccc(cc1OC)NCOC(=O)C 34a_100000187404_100009813279 [0,1,0,0,0,1|1,0,1]=4 1930 B16R1.4275 COc1ccc(cc1OC)OCC=C(C)C 34a_100000039706_100000761012 [0,1,0,0,0,1|1,0,1]=4 1931 B16R1.4275 COc1ccc(cc1OC)OCOC(=O)C 34a_100000039706_100009813279 [0,1,0,0,0,1|1,0,1]=4 1932 B16R1.4275 COc1ccc(cc1OC)SCC=C(C)C 62a_100000761012_100011356967 [0,1,0,0,0,1|1,0,1]=4 1933 B16R1.4275 COc1ccc(cc1OC)SCCC(=O)C 62a_100000053229_100011356967 [0,1,0,0,0,1|0,0,2]=4 1934 B16R1.4275 COc1ccc(cc1OC)SCOC(=O)C 62a_100000076356_100011356967 [0,1,0,0,0,1|1,0,1]=4 1935 B16R1.4708 CCC(=O)NCCc1ccc(c(c1)OC)O 240690a_100000756042_100000210414 [0,1,0,0,0,1|0,0,2]=4 1936 B16R1.4708 CCC(=O)NCCc1ccc(c(c1)OC)O 527a_100000756042_100000210414 [0,1,0,0,0,1|0,0,2]=4 1937 B16R1.4708 CCC(=O)NN=Cc1ccc(c(c1)OC)Br 4a_100000183195_100010244714 [0,1,0,0,0,1|2,0,0]=4 1938 B16R1.4708 CCC(=O)NN=Cc1ccc(c(c1)OC)C 4a_100000183195_100000719150 [0,1,0,0,0,1|2,0,0]=4 1939 B16R1.4708 CCC(=O)NN=Cc1ccc(c(c1)OC)Cl 4a_100000183195_100011998524 [0,1,0,0,0,1|2,0,0]=4 1940 B16R1.4708 CCC(=O)NN=Cc1ccc(c(c1)OC)F 4a_100000183195_100000692873 [0,1,0,0,0,1|2,0,0]=4 1941 B16R1.4708 CCC(=O)NN=Cc1ccc(c(c1)OC)O 4a_100000183195_100000188322 [0,1,0,0,0,1|1,0,0]=3 1942 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)O 34a_100000726020_100012179268 [0,1,0,0,0,1|0,0,2]=4 1943 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)O 62a_100000737683_100000694246 [0,1,0,0,0,1|0,0,2]=4 1944 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000183359 [0,1,0,0,0,1|0,0,2]=4 1945 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 2708a_100000756042_106832991635 [0,1,0,0,0,1|0,0,2]=4 1946 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 2708a_100102657272_100000756042 [0,1,0,0,0,1|0,0,2]=4 1947 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 273464a_100000756042_100102657272 [0,1,0,0,0,1|0,0,2]=4 1948 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 273464a_100102657272_100000756042 [0,1,0,0,0,1|0,0,2]=4 1949 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 512a_100000756042_100102657272 [0,1,0,0,0,1|0,0,2]=4 1950 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 512a_106832991638_100000756042 [0,1,0,0,0,1|0,0,2]=4 1951 B16R1.4708 COC(=O)C=NNc1ccc(c(c1)OC)F 4a_102515433066_200011823558 [0,1,0,0,0,1|2,0,0]=4 1952 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)O 34a_100000726020_100000742370 [0,1,0,0,0,1|0,0,2]=4 1953 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)O 62a_100000204255_100000694246 [0,1,0,0,0,1|0,0,2]=4 1954 B16R1.4708 COC(=O)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000747449 [0,1,0,0,0,1|0,0,2]=4 1955 B16R1.4708 COc1cc(ccc1O)CCNC(=O)CO 240690a_100000756042_100000210174 [0,1,0,0,0,1|0,0,2]=4 1956 B16R1.4708 COc1cc(ccc1O)CCNC(=O)CO 527a_100000756042_100000210174 [0,1,0,0,0,1|0,0,2]=4 1957 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000730704 [0,1,0,0,0,1|1,0,1]=4 1958 B16R1.4709 C=C(C)CNC(=O)c1ccc(c(c1)OC)O 240690a_100000765925_100000687070 [0,1,0,0,0,1|1,0,1]=4 1959 B16R1.4709 COc1cc(ccc1Br)C(=NNC(=O)C)C 4a_100000189765_100010110075 [0,1,0,0,0,1|2,0,0]=4 1960 B16R1.4709 COc1cc(ccc1Br)C(=O)CC=C(C)C 1458a_100011934951_100000761012 [0,1,0,0,0,1|2,0,0]=4 1961 B16R1.4709 COc1cc(ccc1Br)C(=O)NNC(=O)C 22a_100000189765_100011934951 [0,1,0,0,0,1|2,0,0]=4 1962 B16R1.4709 COc1cc(ccc1C)C(=NNC(=O)C)C 4a_100000189765_100012706825 [0,1,0,0,0,1|2,0,0]=4 1963 B16R1.4709 COc1cc(ccc1C)C(=O)CC=C(C)C 1458a_100000212341_100000761012 [0,1,0,0,0,1|2,0,0]=4 1964 B16R1.4709 COc1cc(ccc1C)C(=O)NNC(=O)C 22a_100000189765_100000212341 [0,1,0,0,0,1|2,0,0]=4 1965 B16R1.4709 COc1cc(ccc1Cl)C(=NNC(=O)C)C 4a_100000189765_100012002813 [0,1,0,0,0,1|2,0,0]=4 1966 B16R1.4709 COc1cc(ccc1Cl)C(=O)CC=C(C)C 1458a_100000181799_100000761012 [0,1,0,0,0,1|2,0,0]=4 1967 B16R1.4709 COc1cc(ccc1Cl)C(=O)NNC(=O)C 22a_100000189765_100000181799 [0,1,0,0,0,1|2,0,0]=4 1968 B16R1.4709 COc1cc(ccc1F)C(=NNC(=O)C)C 4a_100000189765_100000694624 [0,1,0,0,0,1|2,0,0]=4 1969 B16R1.4709 COc1cc(ccc1F)C(=O)CC=C(C)C 1458a_100000757635_100000761012 [0,1,0,0,0,1|2,0,0]=4 1970 B16R1.4709 COc1cc(ccc1F)C(=O)NNC(=O)C 22a_100000189765_100000757635 [0,1,0,0,0,1|2,0,0]=4 1971 B16R1.4709 COc1cc(ccc1I)C(=O)CC=C(C)C 1458a_100012356290_100000761012 [0,1,0,0,0,1|2,0,0]=4 1972 B16R1.4709 COc1cc(ccc1I)C(=O)NNC(=O)C 22a_100000189765_100012356290 [0,1,0,0,0,1|2,0,0]=4 1973 B16R1.4709 COc1cc(ccc1O)C(=NNC(=O)C)C 4a_100000189765_100000186468 [0,1,0,0,0,1|1,0,0]=3 1974 B16R1.4709 COc1cc(ccc1O)C(=O)CC=C(C)C 1458a_100000687070_100000761012 [0,1,0,0,0,1|1,0,0]=3 1975 B16R1.4709 COc1cc(ccc1O)C(=O)NCC(=O)N 240690a_100000711301_100000687070 [0,1,0,0,0,1|1,0,1]=4 1976 B16R1.4709 COc1cc(ccc1O)C(=O)NNC(=O)C 22a_100000189765_100000687070 [0,1,0,0,0,1|1,0,0]=3 1977 B16R1.4710 C=C(C)C(=O)CCc1ccc(c(c1)OC)O 1458a_100000185857_100010741665 [0,1,0,0,0,1|1,0,1]=4 1978 B16R1.4710 C=C(C)C(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000185857 [0,1,0,0,0,1|1,0,1]=4 1979 B16R1.4710 CCc1cc(ccc1O)SCC(=O)C(=O)C 62a_100011261029_100012338938 [0,1,0,0,0,1|1,0,1]=4 1980 B16R1.4710 COc1cc(ccc1Br)NCC(=O)C(=O)C 34a_100000765947_100011261029 [0,1,0,0,0,1|1,0,1]=4 1981 B16R1.4710 COc1cc(ccc1Br)OCC(=O)C(=O)C 34a_100011827694_100011261029 [0,1,0,0,0,1|1,0,1]=4 1982 B16R1.4710 COc1cc(ccc1Br)SCC(=O)C(=O)C 62a_100011261029_100012353699 [0,1,0,0,0,1|1,0,1]=4 1983 B16R1.4710 COc1cc(ccc1Br)SCC(=O)C(=O)C 62a_100012353699_100011261029 [0,1,0,0,0,1|1,0,1]=4 1984 B16R1.4710 COc1cc(ccc1C)NCC(=O)C(=O)C 34a_100011279678_100011261029 [0,1,0,0,0,1|1,0,1]=4 1985 B16R1.4710 COc1cc(ccc1C)OCC(=O)C(=O)C 34a_100009865632_100011261029 [0,1,0,0,0,1|1,0,1]=4 1986 B16R1.4710 COc1cc(ccc1C)SCC(=O)C(=O)C 62a_100011261029_100011830276 [0,1,0,0,0,1|1,0,1]=4 1987 B16R1.4710 COc1cc(ccc1C)SCC(=O)C(=O)C 62a_100011830276_100011261029 [0,1,0,0,0,1|1,0,1]=4 1988 B16R1.4710 COc1cc(ccc1Cl)NCC(=O)C(=O)C 34a_100000742311_100011261029 [0,1,0,0,0,1|1,0,1]=4 1989 B16R1.4710 COc1cc(ccc1Cl)OCC(=O)C(=O)C 34a_100012186310_100011261029 [0,1,0,0,0,1|1,0,1]=4 1990 B16R1.4710 COc1cc(ccc1Cl)SCC(=O)C(=O)C 62a_100011261029_100011356853 [0,1,0,0,0,1|1,0,1]=4 1991 B16R1.4710 COc1cc(ccc1Cl)SCC(=O)C(=O)C 62a_100011356853_100011261029 [0,1,0,0,0,1|1,0,1]=4 1992 B16R1.4710 COc1cc(ccc1F)NCC(=O)C(=O)C 34a_100000701188_100011261029 [0,1,0,0,0,1|1,0,1]=4 1993 B16R1.4710 COc1cc(ccc1F)OCC(=O)C(=O)C 34a_100012001760_100011261029 [0,1,0,0,0,1|1,0,1]=4 1994 B16R1.4710 COc1cc(ccc1F)SCC(=O)C(=O)C 62a_100011261029_100011934186 [0,1,0,0,0,1|1,0,1]=4 1995 B16R1.4710 COc1cc(ccc1F)SCC(=O)C(=O)C 62a_100011934186_100011261029 [0,1,0,0,0,1|1,0,1]=4 1996 B16R1.4710 COc1cc(ccc1I)NCC(=O)C(=O)C 34a_100000746945_100011261029 [0,1,0,0,0,1|1,0,1]=4 1997 B16R1.4710 COc1cc(ccc1N)OCC(=O)C(=O)C 34a_100015326901_100011261029 [0,1,0,0,0,1|1,0,1]=4 1998 B16R1.4710 COc1cc(ccc1N)SCC(=O)C(=O)C 62a_100011261029_100015196925 [0,1,0,0,0,1|1,0,1]=4 1999 B16R1.4710 COc1cc(ccc1N)SCC(=O)C(=O)C 62a_100011279103_100011261029 [0,1,0,0,0,1|1,0,1]=4 2000 B16R1.4710 COc1cc(ccc1O)C=CC(=O)C(C)C 1458a_100000182119_100000210206 [0,1,0,0,0,1|1,0,1]=4 2001 B16R1.4710 COc1cc(ccc1O)CNC(=O)C(=O)N 240690a_100000185554_100011215815 [0,1,0,0,0,1|1,0,1]=4 2002 B16R1.4710 COc1cc(ccc1O)NCC(=O)C(=O)C 34a_100000726020_100011261029 [0,1,0,0,0,1|0,0,1]=3 2003 B16R1.4710 COc1cc(ccc1O)SCC(=O)C(=O)C 62a_100011261029_100000694246 [0,1,0,0,0,1|0,0,1]=3 2004 B16R1.4710 COc1nc(ccc1O)SCC(=O)C(=O)C 62a_100011261029_100010893133 [0,1,0,0,0,1|1,0,1]=4 2005 B16R1.4728 COc1cc(ccc1O)C/C=C/[Si](C)(C)C 271570a_100160482004_100000694246 [0,1,0,0,0,1|1,1,0]=4 2006 B16R1.4761 C=C(C)CC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000748629 [0,1,0,0,0,1|1,0,1]=4 2007 B16R1.4761 COc1cc(ccc1Br)CC(=O)C=C(C)C 1458a_100000211388_100010110085 [0,1,0,0,0,1|2,0,0]=4 2008 B16R1.4761 COc1cc(ccc1Br)CC(=O)C=C(C)Cl 1458a_200042562850_100010110085 [0,1,0,0,0,1|2,0,0]=4 2009 B16R1.4761 COc1cc(ccc1Br)CC(=O)C=C(C)I 1458a_100025716642_100010110085 [0,1,0,0,0,1|2,0,0]=4 2010 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)C 11a_100000765947_100000211388 [0,1,0,0,0,1|2,0,0]=4 2011 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)C 1626a_100000765947_100000211388 [0,1,0,0,0,1|2,0,0]=4 2012 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)C 22a_100000765947_100000211388 [0,1,0,0,0,1|2,0,0]=4 2013 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)Cl 11a_100000765947_200042562850 [0,1,0,0,0,1|2,0,0]=4 2014 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)Cl 1626a_100000765947_200042562850 [0,1,0,0,0,1|2,0,0]=4 2015 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)Cl 22a_100000765947_200042562850 [0,1,0,0,0,1|2,0,0]=4 2016 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)I 11a_100000765947_100025716642 [0,1,0,0,0,1|2,0,0]=4 2017 B16R1.4761 COc1cc(ccc1Br)NC(=O)C=C(C)I 1626a_100000765947_100025716642 [0,1,0,0,0,1|2,0,0]=4 2018 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)C 11a_100011279678_100000211388 [0,1,0,0,0,1|2,0,0]=4 2019 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)C 1626a_100011279678_100000211388 [0,1,0,0,0,1|2,0,0]=4 2020 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)C 22a_100011279678_100000211388 [0,1,0,0,0,1|2,0,0]=4 2021 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)Cl 11a_100011279678_200042562850 [0,1,0,0,0,1|2,0,0]=4 2022 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)Cl 1626a_100011279678_200042562850 [0,1,0,0,0,1|2,0,0]=4 2023 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)Cl 22a_100011279678_200042562850 [0,1,0,0,0,1|2,0,0]=4 2024 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)I 11a_100011279678_100025716642 [0,1,0,0,0,1|2,0,0]=4 2025 B16R1.4761 COc1cc(ccc1C)NC(=O)C=C(C)I 1626a_100011279678_100025716642 [0,1,0,0,0,1|2,0,0]=4 2026 B16R1.4761 COc1cc(ccc1Cl)CC(=O)C=C(C)C 1458a_100000211388_200010214485 [0,1,0,0,0,1|2,0,0]=4 2027 B16R1.4761 COc1cc(ccc1Cl)CC(=O)C=C(C)Cl 1458a_200042562850_200010214485 [0,1,0,0,0,1|2,0,0]=4 2028 B16R1.4761 COc1cc(ccc1Cl)CC(=O)C=C(C)I 1458a_100025716642_200010214485 [0,1,0,0,0,1|2,0,0]=4 2029 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)C 11a_100000742311_100000211388 [0,1,0,0,0,1|2,0,0]=4 2030 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)C 1626a_100000742311_100000211388 [0,1,0,0,0,1|2,0,0]=4 2031 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)C 22a_100000742311_100000211388 [0,1,0,0,0,1|2,0,0]=4 2032 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)Cl 11a_100000742311_200042562850 [0,1,0,0,0,1|2,0,0]=4 2033 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)Cl 1626a_100000742311_200042562850 [0,1,0,0,0,1|2,0,0]=4 2034 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)Cl 22a_100000742311_200042562850 [0,1,0,0,0,1|2,0,0]=4 2035 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)I 11a_100000742311_100025716642 [0,1,0,0,0,1|2,0,0]=4 2036 B16R1.4761 COc1cc(ccc1Cl)NC(=O)C=C(C)I 1626a_100000742311_100025716642 [0,1,0,0,0,1|2,0,0]=4 2037 B16R1.4761 COc1cc(ccc1Cl)NC(=O)CC(=O)C 1458a_100000070787_100011203113 [0,1,0,0,0,1|1,0,1]=4 2038 B16R1.4761 COc1cc(ccc1F)CC(=O)C=C(C)C 1458a_100000211388_100012349856 [0,1,0,0,0,1|2,0,0]=4 2039 B16R1.4761 COc1cc(ccc1F)CC(=O)C=C(C)Cl 1458a_200042562850_100012349856 [0,1,0,0,0,1|2,0,0]=4 2040 B16R1.4761 COc1cc(ccc1F)CC(=O)C=C(C)I 1458a_100025716642_100012349856 [0,1,0,0,0,1|2,0,0]=4 2041 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)C 11a_100000701188_100000211388 [0,1,0,0,0,1|2,0,0]=4 2042 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)C 1626a_100000701188_100000211388 [0,1,0,0,0,1|2,0,0]=4 2043 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)C 22a_100000701188_100000211388 [0,1,0,0,0,1|2,0,0]=4 2044 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)Cl 11a_100000701188_200042562850 [0,1,0,0,0,1|2,0,0]=4 2045 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)Cl 1626a_100000701188_200042562850 [0,1,0,0,0,1|2,0,0]=4 2046 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)Cl 22a_100000701188_200042562850 [0,1,0,0,0,1|2,0,0]=4 2047 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)I 11a_100000701188_100025716642 [0,1,0,0,0,1|2,0,0]=4 2048 B16R1.4761 COc1cc(ccc1F)NC(=O)C=C(C)I 1626a_100000701188_100025716642 [0,1,0,0,0,1|2,0,0]=4 2049 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)C 11a_100000746945_100000211388 [0,1,0,0,0,1|2,0,0]=4 2050 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)C 1626a_100000746945_100000211388 [0,1,0,0,0,1|2,0,0]=4 2051 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)C 22a_100000746945_100000211388 [0,1,0,0,0,1|2,0,0]=4 2052 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)Cl 11a_100000746945_200042562850 [0,1,0,0,0,1|2,0,0]=4 2053 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)Cl 1626a_100000746945_200042562850 [0,1,0,0,0,1|2,0,0]=4 2054 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)Cl 22a_100000746945_200042562850 [0,1,0,0,0,1|2,0,0]=4 2055 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)I 11a_100000746945_100025716642 [0,1,0,0,0,1|2,0,0]=4 2056 B16R1.4761 COc1cc(ccc1I)NC(=O)C=C(C)I 1626a_100000746945_100025716642 [0,1,0,0,0,1|2,0,0]=4 2057 B16R1.4761 COc1cc(ccc1O)CC(=O)CC(=O)N 1458a_100000032101_100000187820 [0,1,0,0,0,1|1,0,1]=4 2058 B16R1.4761 COc1cc(ccc1O)CC(=O)CC(=O)[O-] 1458a_100000032101_100020667443 [0,1,0,0,0,1|1,0,1]=4 2059 B16R1.4761 COc1cc(ccc1O)NC(=O)C=C(C)C 22a_100000726020_100000211388 [0,1,0,0,0,1|1,0,0]=3 2060 B16R1.4761 COc1cc(ccc1O)NC(=O)C=C(C)Cl 22a_100000726020_200042562850 [0,1,0,0,0,1|1,0,0]=3 2061 B16R1.4761 COc1cc(ccc1O)NC(=O)CC(=O)N 22a_100000726020_100134613110 [0,1,0,0,0,1|1,0,1]=4 2062 B16R1.4761 COc1cc(ccc1O)NC(=O)CC(=O)N 527a_100000726020_100134613110 [0,1,0,0,0,1|1,0,1]=4 2063 B16R1.4761 COc1cc(ccc1O)SC(C)OC(=O)C 62a_100009818208_100000694246 [0,1,0,0,0,1|1,0,1]=4 2064 B16R1.12733 CCOc1cc(ccc1Br)C=NNC(=O)C 4a_100000189765_200010381951 [0,1,0,0,0,1|2,0,0]=4 2065 B16R1.12733 CCOc1cc(ccc1F)C=NNC(=O)C 4a_100000189765_200000106648 [0,1,0,0,0,1|2,0,0]=4 2066 B16R1.12733 CCOc1cc(ccc1O)C=NNC(=O)C 4a_100000189765_100000188318 [0,1,0,0,0,1|1,0,0]=3 2067 B16R1.20029 CCc1cc(c(cc1O)O)C=NNC(=O)C 4a_100000189765_100010295668 [0,1,0,0,0,1|2,0,0]=4 2068 B16R1.20029 COc1cc(c(cc1Br)Br)C=NNC(=O)C 4a_100000189765_100010996155 [0,1,0,0,0,1|2,0,0]=4 2069 B16R1.20029 COc1cc(c(cc1Br)F)C=NNC(=O)C 4a_100000189765_100000695681 [0,1,0,0,0,1|2,0,0]=4 2070 B16R1.20029 COc1cc(c(cc1Br)O)C=NNC(=O)C 4a_100000189765_100010762608 [0,1,0,0,0,1|2,0,0]=4 2071 B16R1.20029 COc1cc(c(cc1Cl)F)C=NNC(=O)C 4a_100000189765_100000050388 [0,1,0,0,0,1|2,0,0]=4 2072 B16R1.20029 COc1cc(c(cc1F)Br)C=NNC(=O)C 4a_100000189765_100010366953 [0,1,0,0,0,1|2,0,0]=4 2073 B16R1.20029 COc1cc(c(cc1F)F)C=NNC(=O)C 4a_100000189765_100010630602 [0,1,0,0,0,1|2,0,0]=4 2074 B16R1.20029 COc1cc(c(cc1O)Br)C=NNC(=O)C 4a_100000189765_100000741691 [0,1,0,0,0,1|1,0,0]=3 2075 B16R1.20029 COc1cc(c(cc1O)F)C=CCC(C)C 271570a_100016259101_100010189133 [0,1,0,0,0,1|1,0,1]=4 2076 B16R1.20029 COc1cc(c(cc1O)F)SCC=C(C)C 62a_100000761012_100010189133 [0,1,0,0,0,1|1,0,1]=4 2077 B16R1.20029 COc1cc(c(cc1O)F)SCCC(=O)C 62a_100000053229_100010189133 [0,1,0,0,0,1|0,0,2]=4 2078 B16R1.20029 COc1cc(c(cc1O)F)SCOC(=O)C 62a_100000076356_100010189133 [0,1,0,0,0,1|1,0,1]=4 2079 B16R1.33579 COc1c(ccc(c1F)C=NNC(=O)C)Br 4a_100000189765_200010981996 [0,1,0,0,0,1|2,0,0]=4 2080 B16R1.33579 COc1c(ccc(c1F)C=NNC(=O)C)Cl 4a_100000189765_100009889114 [0,1,0,0,0,1|2,0,0]=4 2081 B16R1.33579 COc1c(ccc(c1F)C=NNC(=O)C)F 4a_100000189765_100000050928 [0,1,0,0,0,1|2,0,0]=4 2082 B16R1.33579 COc1c(ccc(c1O)C=NNC(=O)C)O 4a_100000189765_100009834984 [0,1,0,0,0,1|1,0,0]=3 2083 B16R1.404 C=C(C)CC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000748629 [0,2,0,0,0,0|1,0,1]=4 2084 B16R1.404 C=C(C)CC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000748629 [0,2,0,0,0,0|1,0,1]=4 2085 B16R1.404 COc1cc(cc(c1O)Cl)C(=O)CC(=O)N 1458a_100000209947_100000187820 [0,2,0,0,0,0|1,0,1]=4 2086 B16R1.404 COc1cc(cc(c1O)Cl)C(=O)CC(=O)[O-] 1458a_100000209947_100020667443 [0,2,0,0,0,0|1,0,1]=4 2087 B16R1.404 COc1cc(cc(c1O)O)C(=O)CC(=O)N 1458a_100000061230_100000187820 [0,2,0,0,0,0|1,0,1]=4 2088 B16R1.404 COc1cc(cc(c1O)O)C(=O)CC(=O)[O-] 1458a_100000061230_100020667443 [0,2,0,0,0,0|1,0,1]=4 2089 B16R1.405 COc1cc(cc(c1O)O)SC(C)C(=O)C 62a_100009814033_200159242197 [0,2,0,0,0,0|1,0,1]=4 2090 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)F)F 6a_100000050682_100000211110 [0,2,0,0,0,0|1,0,0]=3 2091 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)Br 1458a_100015195021_100000210202 [0,2,0,0,0,0|0,0,0]=2 2092 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)Br 6a_100000186746_100000211110 [0,2,0,0,0,0|0,0,0]=2 2093 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)C 6a_100000050991_100000211110 [0,2,0,0,0,0|0,0,0]=2 2094 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)Cl 6a_100000010622_100000211110 [0,2,0,0,0,0|0,0,0]=2 2095 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)F 6a_100000039941_100000211110 [0,2,0,0,0,0|0,0,0]=2 2096 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)I 1458a_200021160827_100000210202 [0,2,0,0,0,0|0,0,0]=2 2097 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)I 6a_100000184534_100000211110 [0,2,0,0,0,0|0,0,0]=2 2098 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)O)O 62a_100000747405_200159242197 [0,2,0,0,0,0|1,0,1]=4 2099 B16R1.407 CNC(=O)C=Cc1cc(c(c(c1)OC)O)Br 240690a_100102657272_100015195021 [0,2,0,0,0,0|0,0,0]=2 2100 B16R1.407 CNC(=O)C=Cc1cc(c(c(c1)OC)O)I 240690a_100102657272_200021160827 [0,2,0,0,0,0|0,0,0]=2 2101 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)O)O 62a_100000183359_200159242197 [0,2,0,0,0,0|1,0,1]=4 2102 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)O)O 62a_100000747449_200159242197 [0,2,0,0,0,0|1,0,1]=4 2103 B16R1.407 COc1cc(cc(c1F)F)C=CC(=O)CBr 6a_100000050682_100009888967 [0,2,0,0,0,0|1,0,0]=3 2104 B16R1.407 COc1cc(cc(c1F)F)C=CC(=O)CCl 6a_100000050682_100000086384 [0,2,0,0,0,0|1,0,0]=3 2105 B16R1.407 COc1cc(cc(c1F)F)C=CC(=O)CF 6a_100000050682_100000764096 [0,2,0,0,0,0|1,0,0]=3 2106 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CBr 6a_100000186746_100009888967 [0,2,0,0,0,0|0,0,0]=2 2107 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CCl 6a_100000186746_100000086384 [0,2,0,0,0,0|0,0,0]=2 2108 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CF 1458a_100015195021_100015361967 [0,2,0,0,0,0|0,0,0]=2 2109 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CF 6a_100000186746_100000764096 [0,2,0,0,0,0|0,0,0]=2 2110 B16R1.407 COc1cc(cc(c1O)C)C=CC(=O)CBr 6a_100000050991_100009888967 [0,2,0,0,0,0|0,0,0]=2 2111 B16R1.407 COc1cc(cc(c1O)C)C=CC(=O)CCl 6a_100000050991_100000086384 [0,2,0,0,0,0|0,0,0]=2 2112 B16R1.407 COc1cc(cc(c1O)C)C=CC(=O)CF 6a_100000050991_100000764096 [0,2,0,0,0,0|0,0,0]=2 2113 B16R1.407 COc1cc(cc(c1O)Cl)C=CC(=O)CBr 6a_100000010622_100009888967 [0,2,0,0,0,0|0,0,0]=2 2114 B16R1.407 COc1cc(cc(c1O)Cl)C=CC(=O)CCl 6a_100000010622_100000086384 [0,2,0,0,0,0|0,0,0]=2 2115 B16R1.407 COc1cc(cc(c1O)Cl)C=CC(=O)CF 6a_100000010622_100000764096 [0,2,0,0,0,0|0,0,0]=2 2116 B16R1.407 COc1cc(cc(c1O)F)C=CC(=O)CBr 6a_100000039941_100009888967 [0,2,0,0,0,0|0,0,0]=2 2117 B16R1.407 COc1cc(cc(c1O)F)C=CC(=O)CCl 6a_100000039941_100000086384 [0,2,0,0,0,0|0,0,0]=2 2118 B16R1.407 COc1cc(cc(c1O)F)C=CC(=O)CF 6a_100000039941_100000764096 [0,2,0,0,0,0|0,0,0]=2 2119 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CBr 6a_100000184534_100009888967 [0,2,0,0,0,0|0,0,0]=2 2120 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CCl 6a_100000184534_100000086384 [0,2,0,0,0,0|0,0,0]=2 2121 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CF 1458a_200021160827_100015361967 [0,2,0,0,0,0|0,0,0]=2 2122 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CF 6a_100000184534_100000764096 [0,2,0,0,0,0|0,0,0]=2 2123 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 11a_100000748475_100015343762 [0,2,0,0,0,0|1,0,1]=4 2124 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 1626a_100000748475_100015343762 [0,2,0,0,0,0|1,0,1]=4 2125 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 240690a_100000748475_100015343762 [0,2,0,0,0,0|1,0,1]=4 2126 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 527a_100000748475_100103153847 [0,2,0,0,0,0|1,0,1]=4 2127 B16R1.414 COc1cc(cc(c1OC)Cl)C=CC(=O)C 1458a_100000184590_200000210301 [0,2,0,0,0,0|0,0,0]=2 2128 B16R1.414 COc1cc(cc(c1OC)Cl)C=CC(=O)[13CH3] 1458a_100000184590_200025704644 [0,2,0,0,0,0|0,0,0]=2 2129 B16R1.423 COc1cc(cc(c1O)CO)C=CC(C)C 271570a_100016257149_100000185604 [0,2,0,0,0,0|1,0,1]=4 2130 B16R1.423 COc1cc(cc(c1O)CO)C=CC(C)O 271570a_200011019289_100000185604 [0,2,0,0,0,0|0,0,2]=4 2131 B16R1.423 COc1cc(cc(c1O)OC)C=CC(=O)C 1458a_100000764192_200000210301 [0,2,0,0,0,0|0,0,0]=2 2132 B16R1.423 COc1cc(cc(c1O)OC)C=CC(=O)[13CH3] 1458a_100000764192_200025704644 [0,2,0,0,0,0|0,0,0]=2 2133 B16R1.423 COc1cc(cc(c1O)OC)C=CC(C)C 271570a_100016257149_100000691893 [0,2,0,0,0,0|1,0,1]=4 2134 B16R1.423 COc1cc(cc(c1O)OC)C=CC(C)O 271570a_200011019289_100000691893 [0,2,0,0,0,0|0,0,2]=4 2135 B16R1.423 COc1cc(cc(c1O)OC)CCC(=O)C 1458a_100000024749_200000210301 [0,2,0,0,0,0|0,0,2]=4 2136 B16R1.423 COc1cc(cc(c1O)OC)CCC(=O)[13CH3] 1458a_100000024749_200025704644 [0,2,0,0,0,0|0,0,2]=4 2137 B16R1.4035 CCOc1cc(cc(c1O)Cl)C=CC(=O)C 1458a_100015194376_200000210301 [0,2,0,0,0,0|0,0,0]=2 2138 B16R1.4035 CCOc1cc(cc(c1O)Cl)C=CC(=O)[13CH3] 1458a_100015194376_200025704644 [0,2,0,0,0,0|0,0,0]=2 2139 B16R1.1097 COC(=O)c1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000149868 [0,2,0,0,0,0|1,0,1]=4 2140 B16R1.1097 COC(=O)c1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000149868 [0,2,0,0,0,0|0,0,2]=4 2141 B16R1.1097 COC(=O)c1cc(ccc1O)CNC(=O)C 188690a_100000068129_100015343762 [0,2,0,0,0,0|1,0,1]=4 2142 B16R1.10273 C=C=Cc1cc(ccc1OC)/C=C/C(=O)C 271570a_100015277604_200016254069 [0,2,0,0,0,0|1,0,1]=4 2143 B16R1.10273 CC=Cc1cc(ccc1OC)/C=C/C(=O)C 271570a_100016259895_200016254069 [0,2,0,0,0,0|1,0,0]=3 2144 B16R1.10273 CCOc1cc(ccc1OC)/C=C/[N+](=O)[O-] 34a_100016278493_100000210202 [0,2,0,0,0,0|2,0,0]=4 2145 B16R1.10273 CCOc1cc(ccc1OC)C=CC(=O)C 1458a_100000184759_200000210301 [0,2,0,0,0,0|0,0,0]=2 2146 B16R1.10273 CCOc1cc(ccc1OC)C=CC(=O)[13CH3] 1458a_100000184759_200025704644 [0,2,0,0,0,0|0,0,0]=2 2147 B16R1.10273 CCOc1cc(ccc1OC)C=CC(C)C 271570a_100016257149_200010219349 [0,2,0,0,0,0|1,0,1]=4 2148 B16R1.10273 CCOc1cc(ccc1OC)C=CC(C)O 271570a_200011019289_200010219349 [0,2,0,0,0,0|0,0,2]=4 2149 B16R1.10273 CCOc1cc(ccc1OC)C=C[N+](=O)[O-] 34a_200011407368_200000210301 [0,2,0,0,0,0|2,0,0]=4 2150 B16R1.10273 CCOc1cc(ccc1OC)CCC(=O)C 1458a_200011356518_200000210301 [0,2,0,0,0,0|0,0,2]=4 2151 B16R1.10273 CCOc1cc(ccc1OC)CCC(=O)[13CH3] 1458a_200011356518_200025704644 [0,2,0,0,0,0|0,0,2]=4 2152 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 11a_100000755831_100015343762 [0,2,0,0,0,0|1,0,1]=4 2153 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 1626a_100000755831_100015343762 [0,2,0,0,0,0|1,0,1]=4 2154 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 240690a_100000755831_100015343762 [0,2,0,0,0,0|1,0,1]=4 2155 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 527a_100000755831_100103153847 [0,2,0,0,0,0|1,0,1]=4 2156 B16R1.10273 CCOc1cc(ccc1O[13CH3])C=C[N+](=O)[O-] 34a_200011407368_200025704644 [0,2,0,0,0,0|2,0,0]=4 2157 B16R1.10273 CCSc1cc(ccc1OC)/C=C/C(=O)C 62a_100000210202_200016254069 [0,2,0,0,0,0|0,1,0]=3 2158 B16R1.10273 CCSc1cc(ccc1OC)/C=C/C(=O)C 62a_200016254069_100000210202 [0,2,0,0,0,0|0,1,0]=3 2159 B16R1.10273 COCc1cc(ccc1OC)C=CC(C)C 271570a_100016257149_200011493686 [0,2,0,0,0,0|1,0,1]=4 2160 B16R1.10273 COCc1cc(ccc1OC)C=CC(C)O 271570a_200011019289_200011493686 [0,2,0,0,0,0|0,0,2]=4 2161 B16R1.10273 COc1ccc(cc1OCF)/C=C/[N+](=O)[O-] 34a_100016278493_100015361967 [0,2,0,0,0,0|2,0,0]=4 2162 B16R1.10273 COc1ccc(cc1SCF)/C=C/C(=O)C 62a_100015361967_200016254069 [0,2,0,0,0,0|0,1,0]=3 2163 B16R1.10273 COc1ccc(cc1SCF)/C=C/C(=O)C 62a_200016254069_100015361967 [0,2,0,0,0,0|0,1,0]=3 2164 B16R1.12748 C=C(C)CC(=O)c1ccc(c(c1)OCC)O 1458a_100011260950_100000748629 [0,2,0,0,0,0|1,0,1]=4 2165 B16R1.12748 CCOc1cc(ccc1O)C(=O)CC(=O)N 1458a_100011260950_100000187820 [0,2,0,0,0,0|1,0,1]=4 2166 B16R1.12748 CCOc1cc(ccc1O)C(=O)CC(=O)[O-] 1458a_100011260950_100020667443 [0,2,0,0,0,0|1,0,1]=4 2167 B16R1.12750 CCOc1cc(ccc1F)C=CC(=O)CBr 6a_200000106648_100009888967 [0,2,0,0,0,0|1,0,0]=3 2168 B16R1.12750 CCOc1cc(ccc1F)C=CC(=O)CC 6a_200000106648_100000211110 [0,2,0,0,0,0|1,0,0]=3 2169 B16R1.12750 CCOc1cc(ccc1F)C=CC(=O)CCl 6a_200000106648_100000086384 [0,2,0,0,0,0|1,0,0]=3 2170 B16R1.12750 CCOc1cc(ccc1F)C=CC(=O)CF 6a_200000106648_100000764096 [0,2,0,0,0,0|1,0,0]=3 2171 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CC 11a_200000751567_100000210414 [0,2,0,0,0,0|1,0,1]=4 2172 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CC 240690a_200000751567_100000210414 [0,2,0,0,0,0|1,0,1]=4 2173 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CC 527a_200000751567_100000210414 [0,2,0,0,0,0|1,0,1]=4 2174 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CO 240690a_200000751567_100000210174 [0,2,0,0,0,0|1,0,1]=4 2175 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CO 527a_200000751567_100000210174 [0,2,0,0,0,0|1,0,1]=4 2176 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 2708a_100102657272_200000751567 [0,2,0,0,0,0|1,0,1]=4 2177 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 2708a_200000751567_106832991635 [0,2,0,0,0,0|1,0,1]=4 2178 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 273464a_100102657272_200000751567 [0,2,0,0,0,0|1,0,1]=4 2179 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 273464a_200000751567_100102657272 [0,2,0,0,0,0|1,0,1]=4 2180 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 512a_106832991638_200000751567 [0,2,0,0,0,0|1,0,1]=4 2181 B16R1.22892 CCOc1c(ccc(c1F)C=CC(=O)C)Cl 1458a_200010116263_200000210301 [0,2,0,0,0,0|1,0,0]=3 2182 B16R1.22892 CCOc1c(ccc(c1F)C=CC(=O)C)F 1458a_100000061557_200000210301 [0,2,0,0,0,0|1,0,0]=3 2183 B16R1.22892 CCOc1c(ccc(c1F)C=CC(=O)[13CH3])Cl 1458a_200010116263_200025704644 [0,2,0,0,0,0|1,0,0]=3 2184 B16R1.22892 CCOc1c(ccc(c1F)C=CC(=O)[13CH3])F 1458a_100000061557_200025704644 [0,2,0,0,0,0|1,0,0]=3 2185 B16R1.4265 C=C(C)c1cc(ccc1OC)/C=C/C(=O)C 271570a_100000694244_200016254069 [0,2,0,0,0,0|1,0,0]=3 2186 B16R1.20027 COc1cc(c(cc1O)F)C(=O)CC(=O)C 1458a_100000070787_100010235139 [0,2,0,0,0,0|0,0,1]=3 2187 B16R1.20028 COc1cc(c(cc1O)F)SC(C)C(=O)C 62a_100009814033_100010189133 [0,2,0,0,0,0|1,0,1]=4 2188 B16R1.20030 CCC(=O)C=Cc1cc(c(cc1Br)F)OC 6a_100010366953_100000211110 [0,2,0,0,0,0|1,0,0]=3 2189 B16R1.20030 CCC(=O)C=Cc1cc(c(cc1F)Br)OC 6a_100000695681_100000211110 [0,2,0,0,0,0|1,0,0]=3 2190 B16R1.20030 CCC(=O)C=Cc1cc(c(cc1F)Cl)OC 6a_100000050388_100000211110 [0,2,0,0,0,0|1,0,0]=3 2191 B16R1.20030 CCC(=O)C=Cc1cc(c(cc1F)F)OC 6a_100010630602_100000211110 [0,2,0,0,0,0|1,0,0]=3 2192 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)O)OC 62a_100000747405_100010189133 [0,2,0,0,0,0|1,0,1]=4 2193 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)O)OC 62a_100000183359_100010189133 [0,2,0,0,0,0|1,0,1]=4 2194 B16R1.20030 COC(=O)CSc1cc(c(cc1F)O)OC 62a_100000747449_100010189133 [0,2,0,0,0,0|1,0,1]=4 2195 B16R1.20030 COc1cc(c(cc1Br)F)C=CC(=O)CBr 6a_100000695681_100009888967 [0,2,0,0,0,0|1,0,0]=3 2196 B16R1.20030 COc1cc(c(cc1Br)F)C=CC(=O)CCl 6a_100000695681_100000086384 [0,2,0,0,0,0|1,0,0]=3 2197 B16R1.20030 COc1cc(c(cc1Br)F)C=CC(=O)CF 6a_100000695681_100000764096 [0,2,0,0,0,0|1,0,0]=3 2198 B16R1.20030 COc1cc(c(cc1Cl)F)C=CC(=O)CBr 6a_100000050388_100009888967 [0,2,0,0,0,0|1,0,0]=3 2199 B16R1.20030 COc1cc(c(cc1Cl)F)C=CC(=O)CCl 6a_100000050388_100000086384 [0,2,0,0,0,0|1,0,0]=3 2200 B16R1.20030 COc1cc(c(cc1Cl)F)C=CC(=O)CF 6a_100000050388_100000764096 [0,2,0,0,0,0|1,0,0]=3 2201 B16R1.20030 COc1cc(c(cc1F)Br)C=CC(=O)CBr 6a_100010366953_100009888967 [0,2,0,0,0,0|1,0,0]=3 2202 B16R1.20030 COc1cc(c(cc1F)Br)C=CC(=O)CCl 6a_100010366953_100000086384 [0,2,0,0,0,0|1,0,0]=3 2203 B16R1.20030 COc1cc(c(cc1F)Br)C=CC(=O)CF 6a_100010366953_100000764096 [0,2,0,0,0,0|1,0,0]=3 2204 B16R1.20030 COc1cc(c(cc1F)F)C=CC(=O)CBr 6a_100010630602_100009888967 [0,2,0,0,0,0|1,0,0]=3 2205 B16R1.20030 COc1cc(c(cc1F)F)C=CC(=O)CCl 6a_100010630602_100000086384 [0,2,0,0,0,0|1,0,0]=3 2206 B16R1.20030 COc1cc(c(cc1F)F)C=CC(=O)CF 6a_100010630602_100000764096 [0,2,0,0,0,0|1,0,0]=3 2207 B16R1.20040 COc1cc(c(cc1OC)C=CC(=O)C)Br 1458a_200000186731_200000210301 [0,2,0,0,0,0|0,0,0]=2 2208 B16R1.20040 COc1cc(c(cc1OC)C=CC(=O)[13CH3])Br 1458a_200000186731_200025704644 [0,2,0,0,0,0|0,0,0]=2 2209 B16R1.20040 COc1cc(c(cc1OC)C=CC(C)C)F 271570a_100016257149_200011765842 [0,2,0,0,0,0|1,0,1]=4 2210 B16R1.20040 COc1cc(c(cc1OC)C=CC(C)O)F 271570a_200011019289_200011765842 [0,2,0,0,0,0|0,0,2]=4 2211 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 11a_100132302102_100015343762 [0,2,0,0,0,0|1,0,1]=4 2212 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 1626a_100132302102_100015343762 [0,2,0,0,0,0|1,0,1]=4 2213 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 240690a_100132302102_100015343762 [0,2,0,0,0,0|1,0,1]=4 2214 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 527a_100132302102_100103153847 [0,2,0,0,0,0|1,0,1]=4 2215 B16R1.20060 COc1cc(c(cc1O)C=O)C=CC(C)C 271570a_100016257149_100000183646 [0,2,0,0,0,0|1,0,1]=4 2216 B16R1.20060 COc1cc(c(cc1O)C=O)C=CC(C)O 271570a_200011019289_100000183646 [0,2,0,0,0,0|0,0,2]=4 2217 B16R1.20060 COc1cc(c(cc1O)OC)C=CC(C)C 271570a_100016257149_100009816818 [0,2,0,0,0,0|1,0,1]=4 2218 B16R1.20060 COc1cc(c(cc1O)OC)C=CC(C)O 271570a_200011019289_100009816818 [0,2,0,0,0,0|0,0,2]=4 2219 B16R1.20063 COc1cc(c(cc1O)F)C=CC(C)(C)C 271570a_100102527731_100010189133 [0,2,0,0,0,0|1,0,1]=4 2220 B16R1.20063 COc1cc(c(cc1O)F)C=CC(C)(C)O 271570a_200016258132_100010189133 [0,2,0,0,0,0|0,0,2]=4 2221 B16R1.4726 COc1cc(ccc1O)C(=O)NS(=O)(=O)C 2740a_100000171171_100000687070 [0,2,0,0,0,0|2,0,0]=4 2222 B16R1.84799 COc1cc(ccc1CO)C=CC(C)(C)C 271570a_100102527731_100011277633 [0,2,0,0,0,0|1,0,1]=4 2223 B16R1.84799 COc1cc(ccc1CO)C=CC(C)(C)O 271570a_200016258132_100011277633 [0,2,0,0,0,0|0,0,2]=4 2224 B16R1.84799 COc1ccc(cc1OC)C=CC(C)(C)C 271570a_100102527731_100000187503 [0,2,0,0,0,0|1,0,1]=4 2225 B16R1.84799 COc1ccc(cc1OC)C=CC(C)(C)O 271570a_200016258132_100000187503 [0,2,0,0,0,0|0,0,2]=4 2226 B16R1.4273 C=C(C)CC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000748629 [0,2,0,0,0,0|1,0,1]=4 2227 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)C 1458a_100000070787_100000184214 [0,2,0,0,0,0|0,0,1]=3 2228 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)N 1458a_100000211223_100000187820 [0,2,0,0,0,0|1,0,1]=4 2229 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)[O-] 1458a_100000211223_100020667443 [0,2,0,0,0,0|1,0,1]=4 2230 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 11a_100025717294_100015343762 [0,2,0,0,0,0|1,0,1]=4 2231 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 1626a_100025717294_100015343762 [0,2,0,0,0,0|1,0,1]=4 2232 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 240690a_100025717294_100015343762 [0,2,0,0,0,0|1,0,1]=4 2233 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 527a_100025717294_100103153847 [0,2,0,0,0,0|1,0,1]=4 2234 B16R1.4727 C#CC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000211873_100010206313 [0,2,0,0,0,0|0,0,2]=4 2235 B16R1.4727 C=CC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000185746_100010206313 [0,2,0,0,0,0|0,0,2]=4 2236 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100000210414_200010710740 [0,2,0,0,0,0|1,0,1]=4 2237 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000747405 [0,2,0,0,0,0|1,0,1]=4 2238 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000747405 [0,2,0,0,0,0|1,0,1]=4 2239 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000747405 [0,2,0,0,0,0|1,0,1]=4 2240 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000210414_200012348595 [0,2,0,0,0,0|1,0,1]=4 2241 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000747405 [0,2,0,0,0,0|1,0,1]=4 2242 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000747405 [0,2,0,0,0,0|1,0,1]=4 2243 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000210414_100010206313 [0,2,0,0,0,0|0,0,1]=3 2244 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000747405 [0,2,0,0,0,0|0,0,1]=3 2245 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000183359 [0,2,0,0,0,0|1,0,1]=4 2246 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000183359 [0,2,0,0,0,0|1,0,1]=4 2247 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000183359 [0,2,0,0,0,0|1,0,1]=4 2248 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000183359 [0,2,0,0,0,0|1,0,1]=4 2249 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000183359 [0,2,0,0,0,0|1,0,1]=4 2250 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000183359 [0,2,0,0,0,0|0,0,1]=3 2251 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000747449 [0,2,0,0,0,0|1,0,1]=4 2252 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000747449 [0,2,0,0,0,0|1,0,1]=4 2253 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000747449 [0,2,0,0,0,0|1,0,1]=4 2254 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000747449 [0,2,0,0,0,0|1,0,1]=4 2255 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000747449 [0,2,0,0,0,0|1,0,1]=4 2256 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000747449 [0,2,0,0,0,0|0,0,1]=3 2257 B16R1.4727 COc1cc(ccc1Br)C(=O)CC(=O)CO 1458a_100000210174_200010710740 [0,2,0,0,0,0|1,0,1]=4 2258 B16R1.4727 COc1cc(ccc1F)C(=O)CC(=O)CO 1458a_100000210174_200012348595 [0,2,0,0,0,0|1,0,1]=4 2259 B16R1.4727 COc1cc(ccc1O)C(=O)CC(=O)CO 1458a_100000210174_100010206313 [0,2,0,0,0,0|0,0,1]=3 2260 B16R1.4731 COc1cc(ccc1Br)C(=O)C(C)C(=O)C 1458a_100011934951_100000179758 [0,2,0,0,0,0|1,0,1]=4 2261 B16R1.4731 COc1cc(ccc1C)C(=O)C(C)C(=O)C 1458a_100000212341_100000179758 [0,2,0,0,0,0|1,0,1]=4 2262 B16R1.4731 COc1cc(ccc1Cl)C(=O)C(C)C(=O)C 1458a_100000181799_100000179758 [0,2,0,0,0,0|1,0,1]=4 2263 B16R1.4731 COc1cc(ccc1F)C(=O)C(C)C(=O)C 1458a_100000757635_100000179758 [0,2,0,0,0,0|1,0,1]=4 2264 B16R1.4731 COc1cc(ccc1I)C(=O)C(C)C(=O)C 1458a_100012356290_100000179758 [0,2,0,0,0,0|1,0,1]=4 2265 B16R1.4731 COc1cc(ccc1O)C(=O)C(C)C(=O)C 1458a_100000687070_100000179758 [0,2,0,0,0,0|0,0,1]=3 2266 B16R1.4731 COc1cc(ccc1O)C(=O)C(C)C(=O)N 1458a_100000687070_100000702099 [0,2,0,0,0,0|1,0,1]=4 2267 B16R1.4731 COc1cc(ccc1O)C(=O)C(F)C(=O)N 1458a_100000687070_100009813875 [0,2,0,0,0,0|1,0,1]=4 2268 B16R1.4731 COc1cc(ccc1O)C(=O)C(F)C(=O)[O-] 1458a_100000687070_100020610796 [0,2,0,0,0,0|1,0,1]=4 2269 B16R1.4274 C=C(C)C(=O)Nc1ccc(c(c1)OC)CO 22a_100012183141_100000185857 [0,2,0,0,0,0|2,0,0]=4 2270 B16R1.4274 C=C(C)C(=O)Nc1ccc(c(c1)OC)OC 11a_100000187404_100000185857 [0,2,0,0,0,0|2,0,0]=4 2271 B16R1.4274 C=C(C)C(=O)Nc1ccc(c(c1)OC)OC 1626a_100000187404_100000185857 [0,2,0,0,0,0|2,0,0]=4 2272 B16R1.4274 C=C(C)C(=O)Nc1ccc(c(c1)OC)OC 22a_100000187404_100000185857 [0,2,0,0,0,0|2,0,0]=4 2273 B16R1.4274 COc1cc(ccc1CO)NC(=O)C(=O)N 22a_100012183141_100011215815 [0,2,0,0,0,0|2,0,0]=4 2274 B16R1.4274 COc1cc(ccc1CO)SC(C)C(=O)C 62a_100009814033_100011277633 [0,2,0,0,0,0|1,0,1]=4 2275 B16R1.4274 COc1cc(ccc1CO)SC(C)C(=O)C 62a_100011277633_100009814033 [0,2,0,0,0,0|1,0,1]=4 2276 B16R1.4274 COc1cc(ccc1O[13CH3])C=C(C)[N+](=O)[O-] 34a_200116372986_200025704644 [0,2,0,0,0,0|2,0,0]=4 2277 B16R1.4274 COc1ccc(cc1OC)C=C(C)[N+](=O)[O-] 34a_200116372986_200000210301 [0,2,0,0,0,0|2,0,0]=4 2278 B16R1.4274 COc1ccc(cc1OC)CN(C)C(=O)C 1626a_100000180827_100015343762 [0,2,0,0,0,0|1,0,1]=4 2279 B16R1.4274 COc1ccc(cc1OC)CN(C)C(=O)C 240690a_100000180827_100015343762 [0,2,0,0,0,0|1,0,1]=4 2280 B16R1.4274 COc1ccc(cc1OC)CN(C)C(=O)C 527a_100000180827_100103153847 [0,2,0,0,0,0|1,0,1]=4 2281 B16R1.4274 COc1ccc(cc1OC)NC(=O)C(=O)N 22a_100000187404_100011215815 [0,2,0,0,0,0|2,0,0]=4 2282 B16R1.4274 COc1ccc(cc1OC)SC(C)C(=O)C 62a_100009814033_100011356967 [0,2,0,0,0,0|1,0,1]=4 2283 B16R1.4730 C/C=C(\C)/C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100020587367 [0,2,0,0,0,0|2,0,0]=4 2284 B16R1.4730 C=C(CO)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_200000705526 [0,2,0,0,0,0|2,0,0]=4 2285 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000742827_100000694246 [0,2,0,0,0,0|1,0,1]=4 2286 B16R1.4730 CNC(=O)C(=O)Cc1ccc(c(c1)OC)Br 1458a_100011218921_100010110085 [0,2,0,0,0,0|1,0,1]=4 2287 B16R1.4730 CNC(=O)C(=O)Cc1ccc(c(c1)OC)Cl 1458a_100011218921_200010214485 [0,2,0,0,0,0|1,0,1]=4 2288 B16R1.4730 CNC(=O)C(=O)Cc1ccc(c(c1)OC)F 1458a_100011218921_100012349856 [0,2,0,0,0,0|1,0,1]=4 2289 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)Br 1626a_100000765947_100011218921 [0,2,0,0,0,0|2,0,0]=4 2290 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)Br 22a_100000765947_100011218921 [0,2,0,0,0,0|2,0,0]=4 2291 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)Br 527a_100000765947_100011218921 [0,2,0,0,0,0|2,0,0]=4 2292 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)C 1626a_100011279678_100011218921 [0,2,0,0,0,0|2,0,0]=4 2293 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)C 22a_100011279678_100011218921 [0,2,0,0,0,0|2,0,0]=4 2294 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)C 527a_100011279678_100011218921 [0,2,0,0,0,0|2,0,0]=4 2295 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)Cl 1626a_100000742311_100011218921 [0,2,0,0,0,0|2,0,0]=4 2296 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)Cl 22a_100000742311_100011218921 [0,2,0,0,0,0|2,0,0]=4 2297 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)Cl 527a_100000742311_100011218921 [0,2,0,0,0,0|2,0,0]=4 2298 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)F 1626a_100000701188_100011218921 [0,2,0,0,0,0|2,0,0]=4 2299 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)F 22a_100000701188_100011218921 [0,2,0,0,0,0|2,0,0]=4 2300 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)F 527a_100000701188_100011218921 [0,2,0,0,0,0|2,0,0]=4 2301 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)I 1626a_100000746945_100011218921 [0,2,0,0,0,0|2,0,0]=4 2302 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)I 22a_100000746945_100011218921 [0,2,0,0,0,0|2,0,0]=4 2303 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)I 527a_100000746945_100011218921 [0,2,0,0,0,0|2,0,0]=4 2304 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100011218921 [0,2,0,0,0,0|1,0,0]=3 2305 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100011218921 [0,2,0,0,0,0|1,0,0]=3 2306 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000731044 [0,2,0,0,0,0|1,0,1]=4 2307 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000209862_100000694246 [0,2,0,0,0,0|1,0,1]=4 2308 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)O 34a_100000726020_100009813575 [0,2,0,0,0,0|1,0,1]=4 2309 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)O 62a_100009813575_100000694246 [0,2,0,0,0,0|1,0,1]=4 2310 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)Br 11a_100000765947_100000024059 [0,2,0,0,0,0|2,0,0]=4 2311 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)Br 1626a_100000765947_100000024059 [0,2,0,0,0,0|2,0,0]=4 2312 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)Br 527a_100000765947_100000024059 [0,2,0,0,0,0|2,0,0]=4 2313 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)C 11a_100011279678_100000024059 [0,2,0,0,0,0|2,0,0]=4 2314 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)C 1626a_100011279678_100000024059 [0,2,0,0,0,0|2,0,0]=4 2315 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)C 527a_100011279678_100000024059 [0,2,0,0,0,0|2,0,0]=4 2316 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)Cl 11a_100000742311_100000024059 [0,2,0,0,0,0|2,0,0]=4 2317 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)Cl 1626a_100000742311_100000024059 [0,2,0,0,0,0|2,0,0]=4 2318 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)Cl 527a_100000742311_100000024059 [0,2,0,0,0,0|2,0,0]=4 2319 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)F 11a_100000701188_100000024059 [0,2,0,0,0,0|2,0,0]=4 2320 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)F 1626a_100000701188_100000024059 [0,2,0,0,0,0|2,0,0]=4 2321 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)F 527a_100000701188_100000024059 [0,2,0,0,0,0|2,0,0]=4 2322 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)I 11a_100000746945_100000024059 [0,2,0,0,0,0|2,0,0]=4 2323 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)I 1626a_100000746945_100000024059 [0,2,0,0,0,0|2,0,0]=4 2324 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)I 527a_100000746945_100000024059 [0,2,0,0,0,0|2,0,0]=4 2325 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100000024059 [0,2,0,0,0,0|1,0,0]=3 2326 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000211248 [0,2,0,0,0,0|1,0,1]=4 2327 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000211248_100000694246 [0,2,0,0,0,0|1,0,1]=4 2328 B16R1.4763 COc1cc(ccc1O)C=C(C#N)C(=O)C 1458a_100000162688_200000210301 [0,2,0,0,0,0|0,0,0]=2 2329 B16R1.4763 COc1cc(ccc1O)C=C(C#N)C(=O)[13CH3] 1458a_100000162688_200025704644 [0,2,0,0,0,0|0,0,0]=2 2330 B16R1.27683 COc1cc(ccc1O)SC(C)(C)C(=O)C 62a_100000075568_100000694246 [0,2,0,0,0,0|1,0,1]=4 2331 B16R1.4276 CCC(=O)C=Cc1ccc(c(c1)OC)OC 1458a_100015194992_100000210202 [0,2,0,0,0,0|0,0,0]=2 2332 B16R1.4276 CCC(=O)CCc1ccc(c(c1)OC)OC 1458a_100000187252_100000210202 [0,2,0,0,0,0|0,0,2]=4 2333 B16R1.4276 CCC(=O)CCc1ccc(c(c1)OC)OC 1458a_100000210414_100011740610 [0,2,0,0,0,0|0,0,2]=4 2334 B16R1.4276 CCC(=O)COc1ccc(c(c1)OC)CO 1458a_200000048963_100000210202 [0,2,0,0,0,0|1,0,1]=4 2335 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)CO 62a_100000747405_100011277633 [0,2,0,0,0,0|1,0,1]=4 2336 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000747405 [0,2,0,0,0,0|1,0,1]=4 2337 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)OC 62a_100000747405_100011356967 [0,2,0,0,0,0|1,0,1]=4 2338 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 11a_100000185555_100000210414 [0,2,0,0,0,0|1,0,1]=4 2339 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 1626a_100000185555_100000210414 [0,2,0,0,0,0|1,0,1]=4 2340 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 240690a_100000185555_100000210414 [0,2,0,0,0,0|1,0,1]=4 2341 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 527a_100000185555_100000210414 [0,2,0,0,0,0|1,0,1]=4 2342 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 11a_106832991635_100015194992 [0,2,0,0,0,0|0,0,0]=2 2343 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 1626a_100102657272_100015194992 [0,2,0,0,0,0|0,0,0]=2 2344 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 240690a_100102657272_100015194992 [0,2,0,0,0,0|0,0,0]=2 2345 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 527a_100102657272_100015194992 [0,2,0,0,0,0|0,0,0]=2 2346 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 11a_106832991635_100000187252 [0,2,0,0,0,0|0,0,2]=4 2347 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 1626a_100102657272_100000187252 [0,2,0,0,0,0|0,0,2]=4 2348 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 240690a_100102657272_100000187252 [0,2,0,0,0,0|0,0,2]=4 2349 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 527a_100102657272_100000187252 [0,2,0,0,0,0|0,0,2]=4 2350 B16R1.4276 CNC(=O)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000183359 [0,2,0,0,0,0|1,0,1]=4 2351 B16R1.4276 CNC(=O)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000183359 [0,2,0,0,0,0|1,0,1]=4 2352 B16R1.4276 CNC(=O)COc1ccc(c(c1)OC)CO 240690a_100102657272_200000048963 [0,2,0,0,0,0|1,0,1]=4 2353 B16R1.4276 CNC(=O)COc1ccc(c(c1)OC)CO 34a_200000116926_100000183359 [0,2,0,0,0,0|1,0,1]=4 2354 B16R1.4276 CNC(=O)COc1ccc(c(c1)OC)OC 34a_100000039706_100000183359 [0,2,0,0,0,0|1,0,1]=4 2355 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)CO 62a_100000183359_100011277633 [0,2,0,0,0,0|1,0,1]=4 2356 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000183359 [0,2,0,0,0,0|1,0,1]=4 2357 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)OC 62a_100000183359_100011356967 [0,2,0,0,0,0|1,0,1]=4 2358 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 2708a_100000185555_106832991635 [0,2,0,0,0,0|1,0,1]=4 2359 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 2708a_100102657272_100000185555 [0,2,0,0,0,0|1,0,1]=4 2360 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 273464a_100000185555_100102657272 [0,2,0,0,0,0|1,0,1]=4 2361 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 273464a_100102657272_100000185555 [0,2,0,0,0,0|1,0,1]=4 2362 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 512a_100000185555_100102657272 [0,2,0,0,0,0|1,0,1]=4 2363 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 512a_106832991638_100000185555 [0,2,0,0,0,0|1,0,1]=4 2364 B16R1.4276 CNC(=O)NNc1ccc(c(c1)OC)OC 273464a_100102657272_100000071703 [0,2,0,0,0,0|2,0,0]=4 2365 B16R1.4276 CNC(=O)NNc1ccc(c(c1)OC)OC 512a_106832991638_100000071703 [0,2,0,0,0,0|2,0,0]=4 2366 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)OC 34a_100000149373_200000210301 [0,2,0,0,0,0|0,0,0]=2 2367 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)OC 34a_100000724557_200000210301 [0,2,0,0,0,0|0,0,0]=2 2368 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)O[13CH3] 34a_100000149373_200025704644 [0,2,0,0,0,0|0,0,0]=2 2369 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)O[13CH3])OC 34a_100000724557_200025704644 [0,2,0,0,0,0|0,0,0]=2 2370 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 34a_100000056475_200000210301 [0,2,0,0,0,0|0,0,2]=4 2371 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 34a_100000070228_200000210301 [0,2,0,0,0,0|0,0,2]=4 2372 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 7a_100000056475_200000210301 [0,2,0,0,0,0|0,0,2]=4 2373 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 7a_100000070228_200000210301 [0,2,0,0,0,0|0,0,2]=4 2374 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)O[13CH3] 34a_100000070228_200025704644 [0,2,0,0,0,0|0,0,2]=4 2375 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)O[13CH3] 7a_100000070228_200025704644 [0,2,0,0,0,0|0,0,2]=4 2376 B16R1.4276 COC(=O)CCc1ccc(c(c1)O[13CH3])OC 34a_100000056475_200025704644 [0,2,0,0,0,0|0,0,2]=4 2377 B16R1.4276 COC(=O)CCc1ccc(c(c1)O[13CH3])OC 7a_100000056475_200025704644 [0,2,0,0,0,0|0,0,2]=4 2378 B16R1.4276 COC(=O)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000747449 [0,2,0,0,0,0|1,0,1]=4 2379 B16R1.4276 COC(=O)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000747449 [0,2,0,0,0,0|1,0,1]=4 2380 B16R1.4276 COC(=O)COc1ccc(c(c1)OC)CO 34a_200000116926_100000747449 [0,2,0,0,0,0|1,0,1]=4 2381 B16R1.4276 COC(=O)COc1ccc(c(c1)OC)OC 34a_100000039706_100000747449 [0,2,0,0,0,0|1,0,1]=4 2382 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)CO 62a_100000747449_100011277633 [0,2,0,0,0,0|1,0,1]=4 2383 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000747449 [0,2,0,0,0,0|1,0,1]=4 2384 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)OC 62a_100000747449_100011356967 [0,2,0,0,0,0|1,0,1]=4 2385 B16R1.4276 COc1cc(ccc1CO)OCC(=O)CF 1458a_200000048963_100015361967 [0,2,0,0,0,0|1,0,1]=4 2386 B16R1.4276 COc1ccc(cc1OC)C=CC(=O)CF 1458a_100015194992_100015361967 [0,2,0,0,0,0|0,0,0]=2 2387 B16R1.4276 COc1ccc(cc1OC)CCC(=O)CF 1458a_100000187252_100015361967 [0,2,0,0,0,0|0,0,2]=4 2388 B16R1.4276 COc1ccc(cc1OC)CCC(=O)CO 1458a_100000210174_100011740610 [0,2,0,0,0,0|0,0,2]=4 2389 B16R1.4276 COc1ccc(cc1OC)CNC(=O)CO 240690a_100000185555_100000210174 [0,2,0,0,0,0|1,0,1]=4 2390 B16R1.4276 COc1ccc(cc1OC)CNC(=O)CO 527a_100000185555_100000210174 [0,2,0,0,0,0|1,0,1]=4 2391 B16R1.15083 C#CCC(=O)C=Cc1ccc(c(c1)OC)Br 1458a_100016267305_100000184674 [0,2,0,0,0,0|1,0,0]=3 2392 B16R1.15083 C#CCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000184674 [0,2,0,0,0,0|0,0,0]=2 2393 B16R1.15083 C#CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000184674 [0,2,0,0,0,0|0,0,2]=4 2394 B16R1.15083 C#CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011220946_100010741665 [0,2,0,0,0,0|0,0,2]=4 2395 B16R1.15083 C#CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100011220946 [0,2,0,0,0,0|1,0,1]=4 2396 B16R1.15083 C=CCC(=O)C=Cc1ccc(c(c1)OC)Br 1458a_100016267305_100000210623 [0,2,0,0,0,0|1,0,0]=3 2397 B16R1.15083 C=CCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000210623 [0,2,0,0,0,0|0,0,0]=2 2398 B16R1.15083 C=CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210193_100010741665 [0,2,0,0,0,0|0,0,2]=4 2399 B16R1.15083 C=CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210623 [0,2,0,0,0,0|0,0,2]=4 2400 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210193 [0,2,0,0,0,0|1,0,1]=4 2401 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210193 [0,2,0,0,0,0|1,0,1]=4 2402 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210193 [0,2,0,0,0,0|1,0,1]=4 2403 B16R1.15083 CC#CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000763181_100010741665 [0,2,0,0,0,0|0,0,2]=4 2404 B16R1.15083 CC=CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210699_100010741665 [0,2,0,0,0,0|0,0,2]=4 2405 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210699 [0,2,0,0,0,0|1,0,1]=4 2406 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210699 [0,2,0,0,0,0|1,0,1]=4 2407 B16R1.15083 CCCC(=O)C=Cc1ccc(c(c1)OC)Br 1458a_100016267305_100000210303 [0,2,0,0,0,0|1,0,0]=3 2408 B16R1.15083 CCCC(=O)C=Cc1ccc(c(c1)OC)C 6a_100000719150_100011215381 [0,2,0,0,0,0|1,0,0]=3 2409 B16R1.15083 CCCC(=O)C=Cc1ccc(c(c1)OC)Cl 6a_100011998524_100011215381 [0,2,0,0,0,0|1,0,0]=3 2410 B16R1.15083 CCCC(=O)C=Cc1ccc(c(c1)OC)F 6a_100000692873_100011215381 [0,2,0,0,0,0|1,0,0]=3 2411 B16R1.15083 CCCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000210303 [0,2,0,0,0,0|0,0,0]=2 2412 B16R1.15083 CCCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000211992_100010741665 [0,2,0,0,0,0|0,0,2]=4 2413 B16R1.15083 CCCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210303 [0,2,0,0,0,0|0,0,2]=4 2414 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)O 62a_100000747444_100000694246 [0,2,0,0,0,0|1,0,1]=4 2415 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000211992 [0,2,0,0,0,0|1,0,1]=4 2416 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000211992 [0,2,0,0,0,0|1,0,1]=4 2417 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000211992 [0,2,0,0,0,0|1,0,1]=4 2418 B16R1.15083 CCNC(=O)C=Cc1ccc(c(c1)OC)Br 11a_100015525214_100016267305 [0,2,0,0,0,0|1,0,0]=3 2419 B16R1.15083 CCNC(=O)C=Cc1ccc(c(c1)OC)Br 240690a_100015525214_100016267305 [0,2,0,0,0,0|1,0,0]=3 2420 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)O 240690a_100015525214_100011216321 [0,2,0,0,0,0|0,0,2]=4 2421 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000183381 [0,2,0,0,0,0|1,0,1]=4 2422 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)O 62a_100000183381_100000694246 [0,2,0,0,0,0|1,0,1]=4 2423 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 2708a_100000185554_100015525214 [0,2,0,0,0,0|1,0,1]=4 2424 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 2708a_100015525214_100000185554 [0,2,0,0,0,0|1,0,1]=4 2425 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100015525214 [0,2,0,0,0,0|1,0,1]=4 2426 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 273464a_100015525214_100000185554 [0,2,0,0,0,0|1,0,1]=4 2427 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 512a_100015525214_100000185554 [0,2,0,0,0,0|1,0,1]=4 2428 B16R1.15083 CCOC(=O)C=Cc1c[nH]c(=O)c(c1)OC 271570a_100010199719_100010125397 [0,2,0,0,0,0|1,0,1]=4 2429 B16R1.15083 CCOC(=O)C=Cc1cc(c(cn1)C)OC 271570a_100010199719_100010067687 [0,2,0,0,0,0|2,0,0]=4 2430 B16R1.15083 CCOC(=O)C=Cc1cc(c(cn1)F)OC 271570a_100010199719_200010136270 [0,2,0,0,0,0|2,0,0]=4 2431 B16R1.15083 CCOC(=O)C=Cc1cc(c(cn1)N)OC 271570a_100010199719_100009887741 [0,2,0,0,0,0|2,0,0]=4 2432 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)C#N)O 271570a_100010199719_100000687585 [0,2,0,0,0,0|2,0,0]=4 2433 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)C=O)O 271570a_100010199719_100000186750 [0,2,0,0,0,0|2,0,0]=4 2434 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)CC)Br 271570a_100010199719_100010244631 [0,2,0,0,0,0|2,0,0]=4 2435 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)CC)F 271570a_100010199719_100010244625 [0,2,0,0,0,0|2,0,0]=4 2436 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)CC)N 271570a_100010199719_100000686106 [0,2,0,0,0,0|2,0,0]=4 2437 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)CC)O 271570a_100010199719_100012338938 [0,2,0,0,0,0|1,0,0]=3 2438 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)CN)O 271570a_100010199719_100000730032 [0,2,0,0,0,0|2,0,0]=4 2439 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)CO)O 271570a_100010199719_100000184703 [0,2,0,0,0,0|2,0,0]=4 2440 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)NC)C 271570a_100010199719_100020629602 [0,2,0,0,0,0|2,0,0]=4 2441 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)NC)F 271570a_100010199719_100011314990 [0,2,0,0,0,0|2,0,0]=4 2442 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)NC)N 271570a_100010199719_100000694363 [0,2,0,0,0,0|2,0,0]=4 2443 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)Br 271570a_100010199719_100012353699 [0,2,0,0,0,0|1,0,0]=3 2444 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)C 271570a_100010199719_100011830276 [0,2,0,0,0,0|1,0,0]=3 2445 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)Cl 271570a_100010199719_100011356853 [0,2,0,0,0,0|1,0,0]=3 2446 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)F 271570a_100010199719_100011934186 [0,2,0,0,0,0|1,0,0]=3 2447 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)N 271570a_100010199719_100011279103 [0,2,0,0,0,0|1,0,0]=3 2448 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)O 271570a_100010199719_100000694246 [0,2,0,0,0,0|0,0,0]=2 2449 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)SC)F 271570a_100010199719_100010341305 [0,2,0,0,0,0|1,1,0]=4 2450 B16R1.15083 CCOC(=O)C=Cc1ccc(c(n1)OC)N 271570a_100010199719_100000687816 [0,2,0,0,0,0|2,0,0]=4 2451 B16R1.15083 CCOC(=O)C=Cc1ccc(c(n1)OC)O 271570a_100010199719_100010893133 [0,2,0,0,0,0|1,0,0]=3 2452 B16R1.15083 CCOC(=O)C=Cc1cnc(c(c1)OC)C 271570a_100010199719_100010254219 [0,2,0,0,0,0|2,0,0]=4 2453 B16R1.15083 CCOC(=O)C=Cc1cnc(c(c1)OC)F 271570a_100010199719_100010214931 [0,2,0,0,0,0|2,0,0]=4 2454 B16R1.15083 CCOC(=O)C=Cc1cnc(c(c1)OC)N 271570a_100010199719_106354213024 [0,2,0,0,0,0|2,0,0]=4 2455 B16R1.15083 CCOC(=O)C=Cc1cnc(c(n1)OC)O 271570a_100010199719_200010365344 [0,2,0,0,0,0|2,0,0]=4 2456 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000188475 [0,2,0,0,0,0|1,0,1]=4 2457 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)O 62a_100000188475_100000694246 [0,2,0,0,0,0|1,0,1]=4 2458 B16R1.15083 CNNC(=O)C=Cc1ccc(c(c1)OC)Br 22a_100016993582_100016267305 [0,2,0,0,0,0|1,0,0]=3 2459 B16R1.15083 CNNC(=O)CCc1ccc(c(c1)OC)O 22a_100016993582_100011216321 [0,2,0,0,0,0|0,0,2]=4 2460 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100016993582 [0,2,0,0,0,0|1,0,1]=4 2461 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)O 512a_100016993582_100000185554 [0,2,0,0,0,0|1,0,1]=4 2462 B16R1.15083 COCC(=O)C=Cc1ccc(c(c1)OC)C 6a_100000719150_100000211753 [0,2,0,0,0,0|1,0,0]=3 2463 B16R1.15083 COCC(=O)C=Cc1ccc(c(c1)OC)Cl 6a_100011998524_100000211753 [0,2,0,0,0,0|1,0,0]=3 2464 B16R1.15083 COCC(=O)C=Cc1ccc(c(c1)OC)F 6a_100000692873_100000211753 [0,2,0,0,0,0|1,0,0]=3 2465 B16R1.15083 COCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210968_100010741665 [0,2,0,0,0,0|0,0,2]=4 2466 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210968 [0,2,0,0,0,0|1,0,1]=4 2467 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210968 [0,2,0,0,0,0|1,0,1]=4 2468 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210968 [0,2,0,0,0,0|1,0,1]=4 2469 B16R1.15083 COc1cc(ccc1Br)C=CC(=O)CC#N 1458a_100016267305_100011214920 [0,2,0,0,0,0|1,0,0]=3 2470 B16R1.15083 COc1cc(ccc1Br)C=CC(=O)CCF 1458a_100016267305_100011217306 [0,2,0,0,0,0|1,0,0]=3 2471 B16R1.15083 COc1cc(ccc1Br)C=CC(=O)CCO 1458a_100016267305_100000211926 [0,2,0,0,0,0|1,0,0]=3 2472 B16R1.15083 COc1cc(ccc1C)C=CC(=O)CC#N 6a_100000719150_100000184835 [0,2,0,0,0,0|1,0,0]=3 2473 B16R1.15083 COc1cc(ccc1C)C=CC(=O)CCBr 6a_100000719150_100011261029 [0,2,0,0,0,0|1,0,0]=3 2474 B16R1.15083 COc1cc(ccc1C)C=CC(=O)CCCl 6a_100000719150_100000053229 [0,2,0,0,0,0|1,0,0]=3 2475 B16R1.15083 COc1cc(ccc1C)C=CC(=O)CSC 6a_100000719150_100011216314 [0,2,0,0,0,0|1,0,0]=3 2476 B16R1.15083 COc1cc(ccc1Cl)C=CC(=O)CC#N 6a_100011998524_100000184835 [0,2,0,0,0,0|1,0,0]=3 2477 B16R1.15083 COc1cc(ccc1Cl)C=CC(=O)CCBr 6a_100011998524_100011261029 [0,2,0,0,0,0|1,0,0]=3 2478 B16R1.15083 COc1cc(ccc1Cl)C=CC(=O)CCCl 6a_100011998524_100000053229 [0,2,0,0,0,0|1,0,0]=3 2479 B16R1.15083 COc1cc(ccc1Cl)C=CC(=O)CSC 6a_100011998524_100011216314 [0,2,0,0,0,0|1,0,0]=3 2480 B16R1.15083 COc1cc(ccc1F)C=CC(=O)CC#N 6a_100000692873_100000184835 [0,2,0,0,0,0|1,0,0]=3 2481 B16R1.15083 COc1cc(ccc1F)C=CC(=O)CCBr 6a_100000692873_100011261029 [0,2,0,0,0,0|1,0,0]=3 2482 B16R1.15083 COc1cc(ccc1F)C=CC(=O)CCCl 6a_100000692873_100000053229 [0,2,0,0,0,0|1,0,0]=3 2483 B16R1.15083 COc1cc(ccc1F)C=CC(=O)CSC 6a_100000692873_100011216314 [0,2,0,0,0,0|1,0,0]=3 2484 B16R1.15083 COc1cc(ccc1O)C=CC(=O)CC#N 1458a_100000182119_100011214920 [0,2,0,0,0,0|0,0,0]=2 2485 B16R1.15083 COc1cc(ccc1O)C=CC(=O)CCF 1458a_100000182119_100011217306 [0,2,0,0,0,0|0,0,0]=2 2486 B16R1.15083 COc1cc(ccc1O)C=CC(=O)CCO 1458a_100000182119_100000211926 [0,2,0,0,0,0|0,0,0]=2 2487 B16R1.15083 COc1cc(ccc1O)CCC(=O)CC#N 1458a_100011216321_100011214920 [0,2,0,0,0,0|0,0,2]=4 2488 B16R1.15083 COc1cc(ccc1O)CCC(=O)CC#N 1458a_100051588842_100010741665 [0,2,0,0,0,0|0,0,2]=4 2489 B16R1.15083 COc1cc(ccc1O)CCC(=O)CCF 1458a_100011216321_100011217306 [0,2,0,0,0,0|0,0,2]=4 2490 B16R1.15083 COc1cc(ccc1O)CCC(=O)CCO 1458a_100011216321_100000211926 [0,2,0,0,0,0|0,0,2]=4 2491 B16R1.15083 COc1cc(ccc1O)CCC(=O)CCO 1458a_100011216618_100010741665 [0,2,0,0,0,0|0,0,2]=4 2492 B16R1.15083 COc1cc(ccc1O)CCC(=O)CSC 1458a_100000184570_100010741665 [0,2,0,0,0,0|0,0,2]=4 2493 B16R1.15083 COc1cc(ccc1O)CNC(=O)CC#N 240690a_100000185554_100051588842 [0,2,0,0,0,0|1,0,1]=4 2494 B16R1.15083 COc1cc(ccc1O)CNC(=O)CCO 240690a_100000185554_100011216618 [0,2,0,0,0,0|1,0,1]=4 2495 B16R1.15083 COc1cc(ccc1O)CNC(=O)CSC 11a_100000185554_100000184570 [0,2,0,0,0,0|1,0,1]=4 2496 B16R1.15083 COc1cc(ccc1O)CNC(=O)CSC 240690a_100000185554_100000184570 [0,2,0,0,0,0|1,0,1]=4 2497 B16R1.15083 COc1cc(ccc1O)CNC(=O)CSC 527a_100000185554_100000184570 [0,2,0,0,0,0|1,0,1]=4 2498 B16R1.15083 COc1cc(ccc1O)NCC(=O)NCO 34a_100000726020_100000185155 [0,2,0,0,0,0|1,0,1]=4 2499 B16R1.15083 COc1cc(ccc1O)SCC(=O)NCO 62a_100000185155_100000694246 [0,2,0,0,0,0|1,0,1]=4 2500 B16R1.35447 CCC(=O)C=Cc1ccc(c(c1F)OC)Cl 1458a_100020621803_100000210202 [0,2,0,0,0,0|1,0,0]=3 2501 B16R1.35447 CCC(=O)C=Cc1ccc(c(c1F)OC)Cl 6a_100009889114_100000211110 [0,2,0,0,0,0|1,0,0]=3 2502 B16R1.35447 CCC(=O)C=Cc1ccc(c(c1F)OC)F 6a_100000050928_100000211110 [0,2,0,0,0,0|1,0,0]=3 2503 B16R1.35447 CNC(=O)C=Cc1ccc(c(c1F)OC)Cl 11a_106832991635_100020621803 [0,2,0,0,0,0|1,0,0]=3 2504 B16R1.35447 CNC(=O)C=Cc1ccc(c(c1F)OC)Cl 1626a_100102657272_100020621803 [0,2,0,0,0,0|1,0,0]=3 2505 B16R1.35447 CNC(=O)C=Cc1ccc(c(c1F)OC)Cl 240690a_100102657272_100020621803 [0,2,0,0,0,0|1,0,0]=3 2506 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CBr)Cl 6a_100009889114_100009888967 [0,2,0,0,0,0|1,0,0]=3 2507 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CBr)F 6a_100000050928_100009888967 [0,2,0,0,0,0|1,0,0]=3 2508 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CCl)Cl 6a_100009889114_100000086384 [0,2,0,0,0,0|1,0,0]=3 2509 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CCl)F 6a_100000050928_100000086384 [0,2,0,0,0,0|1,0,0]=3 2510 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CF)Cl 1458a_100020621803_100015361967 [0,2,0,0,0,0|1,0,0]=3 2511 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CF)Cl 6a_100009889114_100000764096 [0,2,0,0,0,0|1,0,0]=3 2512 B16R1.35447 COc1c(ccc(c1F)C=CC(=O)CF)F 6a_100000050928_100000764096 [0,2,0,0,0,0|1,0,0]=3 2513 B16R1.20127 COc1ccc(c(c1OC)C)C=CC(C)C 271570a_100016257149_100010000156 [0,2,0,0,0,0|1,0,1]=4 2514 B16R1.20127 COc1ccc(c(c1OC)C)C=CC(C)O 271570a_200011019289_100010000156 [0,2,0,0,0,0|0,0,2]=4 2515 B16R1.20127 COc1ccc(c(c1OC)C)CCC(=O)C 1458a_200010008019_200000210301 [0,2,0,0,0,0|0,0,2]=4 2516 B16R1.20127 COc1ccc(c(c1OC)C)CCC(=O)[13CH3] 1458a_200010008019_200025704644 [0,2,0,0,0,0|0,0,2]=4 2517 B16R1.20127 COc1ccc(c(c1OC)Cl)C=CC(=O)C 1458a_200020587463_200000210301 [0,2,0,0,0,0|0,0,0]=2 2518 B16R1.20127 COc1ccc(c(c1OC)Cl)C=CC(=O)[13CH3] 1458a_200020587463_200025704644 [0,2,0,0,0,0|0,0,0]=2 2519 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 11a_102515433231_100015343762 [0,2,0,0,0,0|1,0,1]=4 2520 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 1626a_102515433231_100015343762 [0,2,0,0,0,0|1,0,1]=4 2521 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 240690a_102515433231_100015343762 [0,2,0,0,0,0|1,0,1]=4 2522 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 527a_102515433231_100103153847 [0,2,0,0,0,0|1,0,1]=4 2523 B16R1.4746 COc1cc(ccc1B(O)O)C=CC(C)C 271570a_100016257149_100010245881 [0,2,0,0,0,0|1,0,1]=4 2524 B16R1.4746 COc1cc(ccc1B(O)O)C=CC(C)O 271570a_200011019289_100010245881 [0,2,0,0,0,0|0,0,2]=4 2525 B16R1.9381 CCOc1ccc(cc1OC)/C=C/C(=O)C 34a_100102526088_100000210202 [0,2,0,0,0,0|0,0,0]=2 2526 B16R1.9381 CCOc1ccc(cc1OC)C=CC(=O)C 1458a_100000179813_200000210301 [0,2,0,0,0,0|0,0,0]=2 2527 B16R1.9381 CCOc1ccc(cc1OC)C=CC(=O)[13CH3] 1458a_100000179813_200025704644 [0,2,0,0,0,0|0,0,0]=2 2528 B16R1.9381 CCOc1ccc(cc1OC)C=CC(C)C 271570a_100016257149_200012344064 [0,2,0,0,0,0|1,0,1]=4 2529 B16R1.9381 CCOc1ccc(cc1OC)C=CC(C)O 271570a_200011019289_200012344064 [0,2,0,0,0,0|0,0,2]=4 2530 B16R1.9381 CCOc1ccc(cc1OC)C=C[N+](=O)[O-] 34a_200103042931_100000210202 [0,2,0,0,0,0|2,0,0]=4 2531 B16R1.9381 CCOc1ccc(cc1OC)CCC(=O)C 34a_100011290831_100000210202 [0,2,0,0,0,0|0,0,2]=4 2532 B16R1.9381 CCOc1ccc(cc1OC)CCC(=O)C 7a_100011290831_100000210202 [0,2,0,0,0,0|0,0,2]=4 2533 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 11a_200000739100_100015343762 [0,2,0,0,0,0|1,0,1]=4 2534 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 1626a_200000739100_100015343762 [0,2,0,0,0,0|1,0,1]=4 2535 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 240690a_200000739100_100015343762 [0,2,0,0,0,0|1,0,1]=4 2536 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 34a_100000046322_100000210202 [0,2,0,0,0,0|1,0,1]=4 2537 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 527a_200000739100_100103153847 [0,2,0,0,0,0|1,0,1]=4 2538 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 7a_100000046322_100000210202 [0,2,0,0,0,0|1,0,1]=4 2539 B16R1.9381 CNCc1ccc(cc1OC)/C=C/C(=O)C 26a_100102657272_100102526088 [0,2,0,0,0,0|1,0,0]=3 2540 B16R1.9381 CNCc1ccc(cc1OC)C=CC(=O)[O-] 26a_100102657272_100000055555 [0,2,0,0,0,0|2,0,0]=4 2541 B16R1.9381 COc1cc(ccc1OCF)/C=C/C(=O)C 34a_100102526088_100015361967 [0,2,0,0,0,0|0,0,0]=2 2542 B16R1.9381 COc1cc(ccc1OCF)C=C[N+](=O)[O-] 34a_200103042931_100015361967 [0,2,0,0,0,0|2,0,0]=4 2543 B16R1.9381 COc1cc(ccc1OCF)CCC(=O)C 34a_100011290831_100015361967 [0,2,0,0,0,0|0,0,2]=4 2544 B16R1.9381 COc1cc(ccc1OCF)CCC(=O)C 7a_100011290831_100015361967 [0,2,0,0,0,0|0,0,2]=4 2545 B16R1.9381 COc1cc(ccc1OCF)CNC(=O)C 34a_100000046322_100015361967 [0,2,0,0,0,0|1,0,1]=4 2546 B16R1.9381 COc1cc(ccc1OCF)CNC(=O)C 7a_100000046322_100015361967 [0,2,0,0,0,0|1,0,1]=4 2547 B14R1.142 CC=Cc1ccc(cc1)/C=C/C(=O)C 271570a_100016259895_200016259395 [0,0,1,1,0,0|2,0,0]=4 2548 B14R1.563 C=C(C)c1cc(cc(c1O)OC)C=O 271570a_100000694244_100000184534 [0,0,1,1,0,0|2,0,0]=4 2549 B14R2.8239 Oc1ccc2cc(c(cc2c1)O)O 271570a_203496583355_100010179872 [1,0,0,1,0,0|0,0,2]=4 2550 B14R2.10591 Cc1cc(ccc1O)C=CC2CC2 271570a_100102526188_100000186361 [1,0,0,1,0,0|1,0,1]=4 2551 B14R2.10591 Oc1ccc(cc1O)C=CC2CC2 271570a_100102526188_100009813601 [1,0,0,1,0,0|1,0,1]=4 2552 B14R2.203 CNc1c(ccc2c1cccc2)O 34a_100000007056_200000210301 [1,0,0,1,0,0|1,0,1]=4 2553 B14R2.203 COc1c(ccc2c1cccc2)Br 34a_100009996032_200000210301 [1,0,0,1,0,0|1,0,1]=4 2554 B14R2.203 COc1c(ccc2c1cccc2)Br 7a_100009996032_200000210301 [1,0,0,1,0,0|1,0,1]=4 2555 B14R2.203 COc1c(ccc2c1cccc2)C 34a_100000039261_200000210301 [1,0,0,1,0,0|1,0,1]=4 2556 B14R2.203 COc1c(ccc2c1cccc2)C 7a_100000039261_200000210301 [1,0,0,1,0,0|1,0,1]=4 2557 B14R2.203 COc1c(ccc2c1cccc2)N 34a_100000007060_200000210301 [1,0,0,1,0,0|1,0,1]=4 2558 B14R2.203 COc1c(ccc2c1cccc2)O 271570a_203496583355_100010089960 [1,0,0,1,0,0|0,0,1]=3 2559 B14R2.203 COc1c(ccc2c1nccc2)Br 34a_100009816563_200000210301 [1,0,0,1,0,0|2,0,0]=4 2560 B14R2.203 COc1c(ccc2c1nccc2)Cl 34a_100000700379_200000210301 [1,0,0,1,0,0|2,0,0]=4 2561 B14R2.203 COc1c(ccc2c1nccc2)Cl 7a_100000700379_200000210301 [1,0,0,1,0,0|2,0,0]=4 2562 B14R2.203 COc1c(ccc2c1nccc2)O 271570a_203496583355_100010256708 [1,0,0,1,0,0|1,0,0]=3 2563 B14R2.203 CSc1c(ccc2c1cccc2)O 62a_200000210301_100000183829 [1,0,0,1,0,0|0,1,1]=4 2564 B14R2.203 CSc1c(ccc2c1nccc2)O 62a_200000210301_100010173343 [1,0,0,1,0,0|1,1,0]=4 2565 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 34a_100000039261_200025704644 [1,0,0,1,0,0|1,0,1]=4 2566 B14R2.203 Cc1ccc2ccccc2c1O[13CH3] 7a_100000039261_200025704644 [1,0,0,1,0,0|1,0,1]=4 2567 B14R2.203 [13CH3]Nc1c(ccc2c1cccc2)O 34a_100000007056_200025704644 [1,0,0,1,0,0|1,0,1]=4 2568 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 34a_100009996032_200025704644 [1,0,0,1,0,0|1,0,1]=4 2569 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)Br 7a_100009996032_200025704644 [1,0,0,1,0,0|1,0,1]=4 2570 B14R2.203 [13CH3]Oc1c(ccc2c1cccc2)N 34a_100000007060_200025704644 [1,0,0,1,0,0|1,0,1]=4 2571 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Br 34a_100009816563_200025704644 [1,0,0,1,0,0|2,0,0]=4 2572 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 34a_100000700379_200025704644 [1,0,0,1,0,0|2,0,0]=4 2573 B14R2.203 [13CH3]Oc1c(ccc2c1nccc2)Cl 7a_100000700379_200025704644 [1,0,0,1,0,0|2,0,0]=4 2574 B14R2.203 [13CH3]Sc1c(ccc2c1cccc2)O 62a_200025704644_100000183829 [1,0,0,1,0,0|0,1,1]=4 2575 B14R2.203 [13CH3]Sc1c(ccc2c1nccc2)O 62a_200025704644_100010173343 [1,0,0,1,0,0|1,1,0]=4 2576 B14R2.991 O=CCNc1ccc2c(c1)OCO2 2230a_100000209953_200015260668 [1,0,0,1,0,0|1,0,1]=4 2577 B14R2.991 O=CCNc1ccc2c(c1)OCO2 34a_100000209953_200009817547 [1,0,0,1,0,0|1,0,1]=4 2578 B14R2.991 O=CCOc1ccc2c(c1)OCO2 34a_100000210298_200009817547 [1,0,0,1,0,0|1,0,1]=4 2579 B14R2.1128 COc1cc2ccccc2cc1Br 34a_100009817189_200000210301 [1,0,0,1,0,0|1,0,1]=4 2580 B14R2.1128 COc1cc2ccccc2cc1Br 7a_100009817189_200000210301 [1,0,0,1,0,0|1,0,1]=4 2581 B14R2.1128 COc1cc2ccccc2cc1C 34a_100000091601_200000210301 [1,0,0,1,0,0|1,0,1]=4 2582 B14R2.1128 COc1cc2ccccc2cc1C 7a_100000091601_200000210301 [1,0,0,1,0,0|1,0,1]=4 2583 B14R2.1128 COc1cc2ccccc2cc1N 34a_106744474703_200000210301 [1,0,0,1,0,0|1,0,1]=4 2584 B14R2.1128 COc1cc2ccccc2cc1N 7a_106744474703_200000210301 [1,0,0,1,0,0|1,0,1]=4 2585 B14R2.1128 COc1cc2ccccc2cc1O 271570a_203496583355_100009817100 [1,0,0,1,0,0|0,0,1]=3 2586 B14R2.1128 COc1cc2cccnc2cc1Br 34a_200010153759_200000210301 [1,0,0,1,0,0|2,0,0]=4 2587 B14R2.1128 COc1cc2cccnc2cc1Br 7a_200010153759_200000210301 [1,0,0,1,0,0|2,0,0]=4 2588 B14R2.1128 COc1cc2cccnc2cc1O 271570a_203496583355_100011093944 [1,0,0,1,0,0|1,0,0]=3 2589 B14R2.1128 COc1cc2ccncc2cc1O 271570a_203496583355_100010990640 [1,0,0,1,0,0|1,0,1]=4 2590 B14R2.1128 COc1cc2ncccc2cc1O 271570a_203496583355_100020706834 [1,0,0,1,0,0|1,0,1]=4 2591 B14R2.1128 COc1nc2ccccc2cc1O 271570a_203496583355_100009820890 [1,0,0,1,0,0|1,0,1]=4 2592 B14R2.1128 CSc1cc2ccccc2cc1O 62a_200000210301_100009817189 [1,0,0,1,0,0|0,1,1]=4 2593 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 34a_100000091601_200025704644 [1,0,0,1,0,0|1,0,1]=4 2594 B14R2.1128 Cc1cc2ccccc2cc1O[13CH3] 7a_100000091601_200025704644 [1,0,0,1,0,0|1,0,1]=4 2595 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 34a_100009817189_200025704644 [1,0,0,1,0,0|1,0,1]=4 2596 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1Br 7a_100009817189_200025704644 [1,0,0,1,0,0|1,0,1]=4 2597 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 34a_106744474703_200025704644 [1,0,0,1,0,0|1,0,1]=4 2598 B14R2.1128 [13CH3]Oc1cc2ccccc2cc1N 7a_106744474703_200025704644 [1,0,0,1,0,0|1,0,1]=4 2599 B14R2.1128 [13CH3]Oc1cc2cccnc2cc1Br 34a_200010153759_200025704644 [1,0,0,1,0,0|2,0,0]=4 2600 B14R2.1128 [13CH3]Oc1cc2cccnc2cc1Br 7a_200010153759_200025704644 [1,0,0,1,0,0|2,0,0]=4 2601 B14R2.1128 [13CH3]Sc1cc2ccccc2cc1O 62a_200025704644_100009817189 [1,0,0,1,0,0|0,1,1]=4 2602 B14R2.1416 COc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_200010010916 [1,0,0,1,0,0|0,0,2]=4 2603 B14R2.1416 COc1cc2cnn(c2cc1O)C 271570a_203496583355_200021298667 [1,0,0,1,0,0|2,0,0]=4 2604 B14R2.2185 COc1cccc(c1)C=CC2CC2 271570a_100102526188_100000170001 [1,0,0,1,0,0|1,0,1]=4 2605 B14R2.2332 CNc1ccc2nc(ccc2c1)C 34a_100011216442_200000210301 [1,0,0,1,0,0|2,0,0]=4 2606 B14R2.2332 CNc1ccc2oc(=O)ccc2c1 7a_100000008519_200000210301 [1,0,0,1,0,0|2,0,0]=4 2607 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200000210301 [1,0,0,1,0,0|0,0,2]=4 2608 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200000210301 [1,0,0,1,0,0|0,0,2]=4 2609 B14R2.2332 COc1ccc2cc(ccc2c1)Br 34a_100000185455_200000210301 [1,0,0,1,0,0|1,0,1]=4 2610 B14R2.2332 COc1ccc2cc(ccc2c1)Br 7a_100000185455_200000210301 [1,0,0,1,0,0|1,0,1]=4 2611 B14R2.2332 COc1ccc2cc(ccc2c1)C 34a_100000074090_200000210301 [1,0,0,1,0,0|1,0,0]=3 2612 B14R2.2332 COc1ccc2cc(ccc2c1)C 7a_100000074090_200000210301 [1,0,0,1,0,0|1,0,0]=3 2613 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 34a_100000074905_200000210301 [1,0,0,1,0,0|1,0,1]=4 2614 B14R2.2332 COc1ccc2cc(ccc2c1)Cl 7a_100000074905_200000210301 [1,0,0,1,0,0|1,0,1]=4 2615 B14R2.2332 COc1ccc2cc(ccc2c1)F 34a_100009847029_200000210301 [1,0,0,1,0,0|1,0,1]=4 2616 B14R2.2332 COc1ccc2cc(ccc2c1)F 7a_100009847029_200000210301 [1,0,0,1,0,0|1,0,1]=4 2617 B14R2.2332 COc1ccc2cc(ccc2c1)O 271570a_203496583355_100000170439 [1,0,0,1,0,0|0,0,2]=4 2618 B14R2.2332 COc1ccc2nc(ccc2c1)C 34a_100000037634_200000210301 [1,0,0,1,0,0|1,0,0]=3 2619 B14R2.2332 COc1ccc2nc(ccc2c1)C 7a_100000037634_200000210301 [1,0,0,1,0,0|1,0,0]=3 2620 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 34a_100009849208_200000210301 [1,0,0,1,0,0|2,0,0]=4 2621 B14R2.2332 COc1ccc2nc(ccc2c1)Cl 7a_100009849208_200000210301 [1,0,0,1,0,0|2,0,0]=4 2622 B14R2.2332 COc1ccc2nc(ccc2c1)O 271570a_203496583355_100000743015 [1,0,0,1,0,0|1,0,1]=4 2623 B14R2.2332 COc1ccc2oc(=O)ccc2c1 34a_100000066265_200000210301 [1,0,0,1,0,0|1,0,0]=3 2624 B14R2.2332 COc1ccc2oc(=O)ccc2c1 7a_100000066265_200000210301 [1,0,0,1,0,0|1,0,0]=3 2625 B14R2.2332 CSc1ccc2[nH]c(=O)ccc2c1 62a_200000210301_100011934725 [1,0,0,1,0,0|1,1,0]=4 2626 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_100000686635_200000210301 [1,0,0,1,0,0|1,1,0]=4 2627 B14R2.2332 CSc1ccc2nc(ccc2c1)C 62a_200000210301_100000686635 [1,0,0,1,0,0|1,1,0]=4 2628 B14R2.2332 CSc1ccc2oc(=O)ccc2c1 62a_200000210301_100009999946 [1,0,0,1,0,0|1,1,0]=4 2629 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 34a_100000074090_200025704644 [1,0,0,1,0,0|1,0,0]=3 2630 B14R2.2332 Cc1ccc2cc(ccc2c1)O[13CH3] 7a_100000074090_200025704644 [1,0,0,1,0,0|1,0,0]=3 2631 B14R2.2332 Cc1ccc2cc(ccc2n1)N[13CH3] 34a_100011216442_200025704644 [1,0,0,1,0,0|2,0,0]=4 2632 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 34a_100000037634_200025704644 [1,0,0,1,0,0|1,0,0]=3 2633 B14R2.2332 Cc1ccc2cc(ccc2n1)O[13CH3] 7a_100000037634_200025704644 [1,0,0,1,0,0|1,0,0]=3 2634 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_100000686635_200025704644 [1,0,0,1,0,0|1,1,0]=4 2635 B14R2.2332 Cc1ccc2cc(ccc2n1)S[13CH3] 62a_200025704644_100000686635 [1,0,0,1,0,0|1,1,0]=4 2636 B14R2.2332 [13CH3]Nc1ccc2oc(=O)ccc2c1 7a_100000008519_200025704644 [1,0,0,1,0,0|2,0,0]=4 2637 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200025704644 [1,0,0,1,0,0|0,0,2]=4 2638 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200025704644 [1,0,0,1,0,0|0,0,2]=4 2639 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 34a_100000185455_200025704644 [1,0,0,1,0,0|1,0,1]=4 2640 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Br 7a_100000185455_200025704644 [1,0,0,1,0,0|1,0,1]=4 2641 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 34a_100000074905_200025704644 [1,0,0,1,0,0|1,0,1]=4 2642 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)Cl 7a_100000074905_200025704644 [1,0,0,1,0,0|1,0,1]=4 2643 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 34a_100009847029_200025704644 [1,0,0,1,0,0|1,0,1]=4 2644 B14R2.2332 [13CH3]Oc1ccc2cc(ccc2c1)F 7a_100009847029_200025704644 [1,0,0,1,0,0|1,0,1]=4 2645 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 34a_100009849208_200025704644 [1,0,0,1,0,0|2,0,0]=4 2646 B14R2.2332 [13CH3]Oc1ccc2nc(ccc2c1)Cl 7a_100009849208_200025704644 [1,0,0,1,0,0|2,0,0]=4 2647 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 34a_100000066265_200025704644 [1,0,0,1,0,0|1,0,0]=3 2648 B14R2.2332 [13CH3]Oc1ccc2oc(=O)ccc2c1 7a_100000066265_200025704644 [1,0,0,1,0,0|1,0,0]=3 2649 B14R2.2332 [13CH3]Sc1ccc2[nH]c(=O)ccc2c1 62a_200025704644_100011934725 [1,0,0,1,0,0|1,1,0]=4 2650 B14R2.2332 [13CH3]Sc1ccc2oc(=O)ccc2c1 62a_200025704644_100009999946 [1,0,0,1,0,0|1,1,0]=4 2651 B14R2.11684 CNc1cccc2c1nc(cc2)C 34a_100000019871_200000210301 [1,0,0,1,0,0|2,0,0]=4 2652 B14R2.11684 COc1cccc2c1cc(cc2)Br 34a_100010089991_200000210301 [1,0,0,1,0,0|1,0,1]=4 2653 B14R2.11684 COc1cccc2c1cc(cc2)Br 7a_100010089991_200000210301 [1,0,0,1,0,0|1,0,1]=4 2654 B14R2.11684 COc1cccc2c1cc(cc2)C 34a_100000040781_200000210301 [1,0,0,1,0,0|1,0,0]=3 2655 B14R2.11684 COc1cccc2c1cc(cc2)C 7a_100000040781_200000210301 [1,0,0,1,0,0|1,0,0]=3 2656 B14R2.11684 COc1cccc2c1cc(cc2)Cl 34a_100009840344_200000210301 [1,0,0,1,0,0|1,0,1]=4 2657 B14R2.11684 COc1cccc2c1cc(cc2)Cl 7a_100009840344_200000210301 [1,0,0,1,0,0|1,0,1]=4 2658 B14R2.11684 COc1cccc2c1cc(cc2)F 34a_100009881884_200000210301 [1,0,0,1,0,0|1,0,1]=4 2659 B14R2.11684 COc1cccc2c1cc(cc2)F 7a_100009881884_200000210301 [1,0,0,1,0,0|1,0,1]=4 2660 B14R2.11684 COc1cccc2c1cc(cc2)N 34a_100132313934_200000210301 [1,0,0,1,0,0|1,0,1]=4 2661 B14R2.11684 COc1cccc2c1cc(cc2)N 7a_100132313934_200000210301 [1,0,0,1,0,0|1,0,1]=4 2662 B14R2.11684 COc1cccc2c1nc(cc2)Br 34a_100010153751_200000210301 [1,0,0,1,0,0|2,0,0]=4 2663 B14R2.11684 COc1cccc2c1nc(cc2)Br 7a_100010153751_200000210301 [1,0,0,1,0,0|2,0,0]=4 2664 B14R2.11684 COc1cccc2c1nc(cc2)C 34a_100000184714_200000210301 [1,0,0,1,0,0|1,0,0]=3 2665 B14R2.11684 COc1cccc2c1nc(cc2)C 7a_100000184714_200000210301 [1,0,0,1,0,0|1,0,0]=3 2666 B14R2.11684 COc1cccc2c1nc(cc2)Cl 34a_100000013812_200000210301 [1,0,0,1,0,0|2,0,0]=4 2667 B14R2.11684 COc1cccc2c1nc(cc2)Cl 7a_100000013812_200000210301 [1,0,0,1,0,0|2,0,0]=4 2668 B14R2.11684 COc1cccc2c1nc(cc2)N 34a_100000032106_200000210301 [1,0,0,1,0,0|2,0,0]=4 2669 B14R2.11684 COc1cccc2c1nc(cc2)N 7a_100000032106_200000210301 [1,0,0,1,0,0|2,0,0]=4 2670 B14R2.11684 COc1cccc2c1nc(cc2)O 271570a_203496583355_200011787714 [1,0,0,1,0,0|1,0,1]=4 2671 B14R2.11684 COc1ccnc2c1cc(cc2)C 34a_200011310529_200000210301 [1,0,0,1,0,0|2,0,0]=4 2672 B14R2.11684 CSc1cccc2c1[nH]c(=O)cc2 62a_200000210301_100000688906 [1,0,0,1,0,0|1,1,0]=4 2673 B14R2.11684 CSc1cccc2c1nc(cc2)C 62a_200000210301_100011934484 [1,0,0,1,0,0|1,1,0]=4 2674 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 34a_100000040781_200025704644 [1,0,0,1,0,0|1,0,0]=3 2675 B14R2.11684 Cc1ccc2cccc(c2c1)O[13CH3] 7a_100000040781_200025704644 [1,0,0,1,0,0|1,0,0]=3 2676 B14R2.11684 Cc1ccc2cccc(c2n1)N[13CH3] 34a_100000019871_200025704644 [1,0,0,1,0,0|2,0,0]=4 2677 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 34a_100000184714_200025704644 [1,0,0,1,0,0|1,0,0]=3 2678 B14R2.11684 Cc1ccc2cccc(c2n1)O[13CH3] 7a_100000184714_200025704644 [1,0,0,1,0,0|1,0,0]=3 2679 B14R2.11684 Cc1ccc2cccc(c2n1)S[13CH3] 62a_200025704644_100011934484 [1,0,0,1,0,0|1,1,0]=4 2680 B14R2.11684 Cc1ccc2nccc(c2c1)O[13CH3] 34a_200011310529_200025704644 [1,0,0,1,0,0|2,0,0]=4 2681 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 34a_100010089991_200025704644 [1,0,0,1,0,0|1,0,1]=4 2682 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Br 7a_100010089991_200025704644 [1,0,0,1,0,0|1,0,1]=4 2683 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 34a_100009840344_200025704644 [1,0,0,1,0,0|1,0,1]=4 2684 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)Cl 7a_100009840344_200025704644 [1,0,0,1,0,0|1,0,1]=4 2685 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 34a_100009881884_200025704644 [1,0,0,1,0,0|1,0,1]=4 2686 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)F 7a_100009881884_200025704644 [1,0,0,1,0,0|1,0,1]=4 2687 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 34a_100132313934_200025704644 [1,0,0,1,0,0|1,0,1]=4 2688 B14R2.11684 [13CH3]Oc1cccc2c1cc(cc2)N 7a_100132313934_200025704644 [1,0,0,1,0,0|1,0,1]=4 2689 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 34a_100010153751_200025704644 [1,0,0,1,0,0|2,0,0]=4 2690 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Br 7a_100010153751_200025704644 [1,0,0,1,0,0|2,0,0]=4 2691 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 34a_100000013812_200025704644 [1,0,0,1,0,0|2,0,0]=4 2692 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)Cl 7a_100000013812_200025704644 [1,0,0,1,0,0|2,0,0]=4 2693 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 34a_100000032106_200025704644 [1,0,0,1,0,0|2,0,0]=4 2694 B14R2.11684 [13CH3]Oc1cccc2c1nc(cc2)N 7a_100000032106_200025704644 [1,0,0,1,0,0|2,0,0]=4 2695 B14R2.11684 [13CH3]Sc1cccc2c1[nH]c(=O)cc2 62a_200025704644_100000688906 [1,0,0,1,0,0|1,1,0]=4 2696 B14R2.1008 CC(=Cc1ccc2c(c1)CCO2)C 271570a_100102525489_100000729065 [0,0,0,1,1,0|2,0,0]=4 2697 B14R2.1008 CC(=Cc1ccc2c(c1)OCC2)C 271570a_100102525489_100009818566 [0,0,0,1,1,0|2,0,0]=4 2698 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [0,0,0,1,1,0|1,0,0]=3 2699 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [0,0,0,1,1,0|1,0,1]=4 2700 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [0,0,0,1,1,0|0,0,1]=3 2701 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100015343762 [0,0,0,1,1,0|2,0,0]=4 2702 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100015343762 [0,0,0,1,1,0|2,0,0]=4 2703 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000070787 [0,0,0,1,1,0|2,0,0]=4 2704 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100103153847 [0,0,0,1,1,0|2,0,0]=4 2705 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [0,0,0,1,1,0|1,0,0]=3 2706 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [0,0,0,1,1,0|1,0,0]=3 2707 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [0,0,0,1,1,0|1,0,0]=3 2708 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [0,0,0,1,1,0|1,0,0]=3 2709 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [0,0,0,1,1,0|1,0,1]=4 2710 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [0,0,0,1,1,0|0,0,1]=3 2711 B16R2.2324 CCc1cc(ccc1O)c2cc(cs2)C 271570a_100000038307_100012338938 [0,0,0,1,0,1|2,0,0]=4 2712 B16R2.2324 CCc1cc(ccc1O)c2ccc(o2)C 271570a_100000061910_100012338938 [0,0,0,1,0,1|1,0,1]=4 2713 B16R2.2324 CCc1cc(ccc1O)c2ccc(s2)C 271570a_100011934456_100012338938 [0,0,0,1,0,1|1,1,0]=4 2714 B16R2.2324 CCc1cc(ccc1O)c2cnc(s2)C 271570a_100000696845_100012338938 [0,0,0,1,0,1|1,1,0]=4 2715 B16R2.2324 CCc1cc(ccc1O)c2csc(c2)C 271570a_100000699828_100012338938 [0,0,0,1,0,1|2,0,0]=4 2716 B16R2.2324 COc1cc(ccc1Br)c2cc(cs2)C 271570a_100000038307_100012353699 [0,0,0,1,0,1|2,0,0]=4 2717 B16R2.2324 COc1cc(ccc1Br)c2ccc(o2)C 271570a_100000061910_100012353699 [0,0,0,1,0,1|1,0,1]=4 2718 B16R2.2324 COc1cc(ccc1Br)c2ccc(s2)C 271570a_100011934456_100012353699 [0,0,0,1,0,1|1,1,0]=4 2719 B16R2.2324 COc1cc(ccc1Br)c2cnc(s2)C 271570a_100000696845_100012353699 [0,0,0,1,0,1|1,1,0]=4 2720 B16R2.2324 COc1cc(ccc1Br)c2csc(c2)C 271570a_100000699828_100012353699 [0,0,0,1,0,1|2,0,0]=4 2721 B16R2.2324 COc1cc(ccc1C)c2c[nH]c(n2)C 271570a_100010045235_100009814057 [0,0,0,1,0,1|2,0,0]=4 2722 B16R2.2324 COc1cc(ccc1C)c2cc(cs2)C 271570a_100000038307_100011830276 [0,0,0,1,0,1|2,0,0]=4 2723 B16R2.2324 COc1cc(ccc1C)c2cc(cs2)C 271570a_100010045235_100009876951 [0,0,0,1,0,1|2,0,0]=4 2724 B16R2.2324 COc1cc(ccc1C)c2ccc(o2)C 271570a_100000061910_100011830276 [0,0,0,1,0,1|1,0,1]=4 2725 B16R2.2324 COc1cc(ccc1C)c2ccc(s2)C 271570a_100010045235_100000761539 [0,0,0,1,0,1|1,1,0]=4 2726 B16R2.2324 COc1cc(ccc1C)c2ccc(s2)C 271570a_100011934456_100011830276 [0,0,0,1,0,1|1,1,0]=4 2727 B16R2.2324 COc1cc(ccc1C)c2cnc(s2)C 271570a_100000696845_100011830276 [0,0,0,1,0,1|1,1,0]=4 2728 B16R2.2324 COc1cc(ccc1C)c2cnc(s2)C 271570a_100010045235_100000764884 [0,0,0,1,0,1|1,1,0]=4 2729 B16R2.2324 COc1cc(ccc1C)c2csc(c2)C 271570a_100000699828_100011830276 [0,0,0,1,0,1|2,0,0]=4 2730 B16R2.2324 COc1cc(ccc1C)c2csc(c2)C 271570a_100010045235_100000759034 [0,0,0,1,0,1|2,0,0]=4 2731 B16R2.2324 COc1cc(ccc1C)c2csc(n2)C 271570a_100010045235_100011934587 [0,0,0,1,0,1|2,0,0]=4 2732 B16R2.2324 COc1cc(ccc1C)c2nc(c[nH]2)C 271570a_100010045235_100161115468 [0,0,0,1,0,1|2,0,0]=4 2733 B16R2.2324 COc1cc(ccc1C)c2nc(cs2)C 271570a_100010045235_100011291629 [0,0,0,1,0,1|2,0,0]=4 2734 B16R2.2324 COc1cc(ccc1C)c2ncc(s2)C 271570a_100010045235_100000690809 [0,0,0,1,0,1|1,1,0]=4 2735 B16R2.2324 COc1cc(ccc1Cl)c2c[nH]c(n2)C 271570a_100000739040_100009814057 [0,0,0,1,0,1|2,0,0]=4 2736 B16R2.2324 COc1cc(ccc1Cl)c2cc(cs2)C 271570a_100000038307_100011356853 [0,0,0,1,0,1|2,0,0]=4 2737 B16R2.2324 COc1cc(ccc1Cl)c2cc(cs2)C 271570a_100000739040_100009876951 [0,0,0,1,0,1|2,0,0]=4 2738 B16R2.2324 COc1cc(ccc1Cl)c2ccc(o2)C 271570a_100000061910_100011356853 [0,0,0,1,0,1|1,0,1]=4 2739 B16R2.2324 COc1cc(ccc1Cl)c2ccc(s2)C 271570a_100000739040_100000761539 [0,0,0,1,0,1|1,1,0]=4 2740 B16R2.2324 COc1cc(ccc1Cl)c2ccc(s2)C 271570a_100011934456_100011356853 [0,0,0,1,0,1|1,1,0]=4 2741 B16R2.2324 COc1cc(ccc1Cl)c2cnc(s2)C 271570a_100000696845_100011356853 [0,0,0,1,0,1|1,1,0]=4 2742 B16R2.2324 COc1cc(ccc1Cl)c2cnc(s2)C 271570a_100000739040_100000764884 [0,0,0,1,0,1|1,1,0]=4 2743 B16R2.2324 COc1cc(ccc1Cl)c2csc(c2)C 271570a_100000699828_100011356853 [0,0,0,1,0,1|2,0,0]=4 2744 B16R2.2324 COc1cc(ccc1Cl)c2csc(c2)C 271570a_100000739040_100000759034 [0,0,0,1,0,1|2,0,0]=4 2745 B16R2.2324 COc1cc(ccc1Cl)c2csc(n2)C 271570a_100000739040_100011934587 [0,0,0,1,0,1|2,0,0]=4 2746 B16R2.2324 COc1cc(ccc1Cl)c2nc(c[nH]2)C 271570a_100000739040_100161115468 [0,0,0,1,0,1|2,0,0]=4 2747 B16R2.2324 COc1cc(ccc1Cl)c2nc(cs2)C 271570a_100000739040_100011291629 [0,0,0,1,0,1|2,0,0]=4 2748 B16R2.2324 COc1cc(ccc1Cl)c2ncc(s2)C 271570a_100000739040_100000690809 [0,0,0,1,0,1|1,1,0]=4 2749 B16R2.2324 COc1cc(ccc1F)c2c[nH]c(n2)C 271570a_100011356763_100009814057 [0,0,0,1,0,1|2,0,0]=4 2750 B16R2.2324 COc1cc(ccc1F)c2cc(cs2)C 271570a_100000038307_100011934186 [0,0,0,1,0,1|2,0,0]=4 2751 B16R2.2324 COc1cc(ccc1F)c2cc(cs2)C 271570a_100011356763_100009876951 [0,0,0,1,0,1|2,0,0]=4 2752 B16R2.2324 COc1cc(ccc1F)c2ccc(o2)C 271570a_100000061910_100011934186 [0,0,0,1,0,1|1,0,1]=4 2753 B16R2.2324 COc1cc(ccc1F)c2ccc(s2)C 271570a_100011356763_100000761539 [0,0,0,1,0,1|1,1,0]=4 2754 B16R2.2324 COc1cc(ccc1F)c2ccc(s2)C 271570a_100011934456_100011934186 [0,0,0,1,0,1|1,1,0]=4 2755 B16R2.2324 COc1cc(ccc1F)c2cnc(s2)C 271570a_100000696845_100011934186 [0,0,0,1,0,1|1,1,0]=4 2756 B16R2.2324 COc1cc(ccc1F)c2cnc(s2)C 271570a_100011356763_100000764884 [0,0,0,1,0,1|1,1,0]=4 2757 B16R2.2324 COc1cc(ccc1F)c2csc(c2)C 271570a_100000699828_100011934186 [0,0,0,1,0,1|2,0,0]=4 2758 B16R2.2324 COc1cc(ccc1F)c2csc(c2)C 271570a_100011356763_100000759034 [0,0,0,1,0,1|2,0,0]=4 2759 B16R2.2324 COc1cc(ccc1F)c2csc(n2)C 271570a_100011356763_100011934587 [0,0,0,1,0,1|2,0,0]=4 2760 B16R2.2324 COc1cc(ccc1F)c2nc(c[nH]2)C 271570a_100011356763_100161115468 [0,0,0,1,0,1|2,0,0]=4 2761 B16R2.2324 COc1cc(ccc1F)c2nc(cs2)C 271570a_100011356763_100011291629 [0,0,0,1,0,1|2,0,0]=4 2762 B16R2.2324 COc1cc(ccc1F)c2ncc(s2)C 271570a_100011356763_100000690809 [0,0,0,1,0,1|1,1,0]=4 2763 B16R2.2324 COc1cc(ccc1N)c2c[nH]c(n2)C 271570a_100000068085_100009814057 [0,0,0,1,0,1|2,0,0]=4 2764 B16R2.2324 COc1cc(ccc1N)c2cc(cs2)C 271570a_100000038307_100011279103 [0,0,0,1,0,1|2,0,0]=4 2765 B16R2.2324 COc1cc(ccc1N)c2cc(cs2)C 271570a_100000068085_100009876951 [0,0,0,1,0,1|2,0,0]=4 2766 B16R2.2324 COc1cc(ccc1N)c2ccc(o2)C 271570a_100000061910_100011279103 [0,0,0,1,0,1|1,0,1]=4 2767 B16R2.2324 COc1cc(ccc1N)c2ccc(s2)C 271570a_100000068085_100000761539 [0,0,0,1,0,1|1,1,0]=4 2768 B16R2.2324 COc1cc(ccc1N)c2ccc(s2)C 271570a_100011934456_100011279103 [0,0,0,1,0,1|1,1,0]=4 2769 B16R2.2324 COc1cc(ccc1N)c2cnc(s2)C 271570a_100000068085_100000764884 [0,0,0,1,0,1|1,1,0]=4 2770 B16R2.2324 COc1cc(ccc1N)c2cnc(s2)C 271570a_100000696845_100011279103 [0,0,0,1,0,1|1,1,0]=4 2771 B16R2.2324 COc1cc(ccc1N)c2csc(c2)C 271570a_100000068085_100000759034 [0,0,0,1,0,1|2,0,0]=4 2772 B16R2.2324 COc1cc(ccc1N)c2csc(c2)C 271570a_100000699828_100011279103 [0,0,0,1,0,1|2,0,0]=4 2773 B16R2.2324 COc1cc(ccc1N)c2csc(n2)C 271570a_100000068085_100011934587 [0,0,0,1,0,1|2,0,0]=4 2774 B16R2.2324 COc1cc(ccc1N)c2nc(c[nH]2)C 271570a_100000068085_100161115468 [0,0,0,1,0,1|2,0,0]=4 2775 B16R2.2324 COc1cc(ccc1N)c2nc(cs2)C 271570a_100000068085_100011291629 [0,0,0,1,0,1|2,0,0]=4 2776 B16R2.2324 COc1cc(ccc1N)c2ncc(s2)C 271570a_100000068085_100000690809 [0,0,0,1,0,1|1,1,0]=4 2777 B16R2.2324 COc1cc(ccc1O)C2=CC(=O)CC2 271570a_100010737933_100000694246 [0,0,0,1,0,1|0,0,2]=4 2778 B16R2.2324 COc1cc(ccc1O)c2c[nH]c(n2)C 271570a_100000040328_100009814057 [0,0,0,1,0,1|1,0,0]=3 2779 B16R2.2324 COc1cc(ccc1O)c2cc([nH]n2)C 271570a_100000040328_100015199547 [0,0,0,1,0,1|2,0,0]=4 2780 B16R2.2324 COc1cc(ccc1O)c2cc([nH]n2)C 271570a_100009872134_100000694246 [0,0,0,1,0,1|2,0,0]=4 2781 B16R2.2324 COc1cc(ccc1O)c2cc(cs2)C 271570a_100000038307_100000694246 [0,0,0,1,0,1|1,0,0]=3 2782 B16R2.2324 COc1cc(ccc1O)c2cc(cs2)C 271570a_100000040328_100009876951 [0,0,0,1,0,1|1,0,0]=3 2783 B16R2.2324 COc1cc(ccc1O)c2cc(ns2)C 271570a_100000040328_100009815735 [0,0,0,1,0,1|2,0,0]=4 2784 B16R2.2324 COc1cc(ccc1O)c2ccc(o2)C 271570a_100000061910_100000694246 [0,0,0,1,0,1|0,0,1]=3 2785 B16R2.2324 COc1cc(ccc1O)c2ccc(s2)Br 271570a_100000040328_100010197418 [0,0,0,1,0,1|1,1,0]=4 2786 B16R2.2324 COc1cc(ccc1O)c2ccc(s2)C 271570a_100000040328_100000761539 [0,0,0,1,0,1|0,1,0]=3 2787 B16R2.2324 COc1cc(ccc1O)c2ccc(s2)C 271570a_100011934456_100000694246 [0,0,0,1,0,1|0,1,0]=3 2788 B16R2.2324 COc1cc(ccc1O)c2ccc(s2)Cl 271570a_100000708867_100000694246 [0,0,0,1,0,1|1,1,0]=4 2789 B16R2.2324 COc1cc(ccc1O)c2ccn(c2)C 271570a_100010172022_100000694246 [0,0,0,1,0,1|2,0,0]=4 2790 B16R2.2324 COc1cc(ccc1O)c2ccn(n2)C 271570a_100000040328_100000752436 [0,0,0,1,0,1|2,0,0]=4 2791 B16R2.2324 COc1cc(ccc1O)c2ccn(n2)C 271570a_100012348833_100000694246 [0,0,0,1,0,1|2,0,0]=4 2792 B16R2.2324 COc1cc(ccc1O)c2cn(cn2)C 271570a_100000040328_100000040308 [0,0,0,1,0,1|2,0,0]=4 2793 B16R2.2324 COc1cc(ccc1O)c2cnc(s2)C 271570a_100000040328_100000764884 [0,0,0,1,0,1|0,1,0]=3 2794 B16R2.2324 COc1cc(ccc1O)c2cnc(s2)C 271570a_100000696845_100000694246 [0,0,0,1,0,1|0,1,0]=3 2795 B16R2.2324 COc1cc(ccc1O)c2cnn(c2)C 271570a_100000040328_100000748075 [0,0,0,1,0,1|2,0,0]=4 2796 B16R2.2324 COc1cc(ccc1O)c2cnn(c2)C 271570a_100000685319_100000694246 [0,0,0,1,0,1|2,0,0]=4 2797 B16R2.2324 COc1cc(ccc1O)c2cnn(n2)C 271570a_100000040328_100000733932 [0,0,0,1,0,1|2,0,0]=4 2798 B16R2.2324 COc1cc(ccc1O)c2csc(c2)C 271570a_100000040328_100000759034 [0,0,0,1,0,1|1,0,0]=3 2799 B16R2.2324 COc1cc(ccc1O)c2csc(c2)C 271570a_100000699828_100000694246 [0,0,0,1,0,1|1,0,0]=3 2800 B16R2.2324 COc1cc(ccc1O)c2csc(n2)C 271570a_100000040328_100011934587 [0,0,0,1,0,1|1,0,0]=3 2801 B16R2.2324 COc1cc(ccc1O)c2csc(n2)N 271570a_100000040328_100011998049 [0,0,0,1,0,1|2,0,0]=4 2802 B16R2.2324 COc1cc(ccc1O)c2n[nH]c(n2)C 271570a_100000040328_100000732540 [0,0,0,1,0,1|2,0,0]=4 2803 B16R2.2324 COc1cc(ccc1O)c2nc(c[nH]2)C 271570a_100000040328_100161115468 [0,0,0,1,0,1|1,0,0]=3 2804 B16R2.2324 COc1cc(ccc1O)c2nc(cs2)Br 271570a_100000040328_200016082925 [0,0,0,1,0,1|2,0,0]=4 2805 B16R2.2324 COc1cc(ccc1O)c2nc(cs2)C 271570a_100000040328_100011291629 [0,0,0,1,0,1|1,0,0]=3 2806 B16R2.2324 COc1cc(ccc1O)c2nc(cs2)N 271570a_100000040328_200015188442 [0,0,0,1,0,1|2,0,0]=4 2807 B16R2.2324 COc1cc(ccc1O)c2nc(ns2)C 271570a_100000040328_100000709739 [0,0,0,1,0,1|2,0,0]=4 2808 B16R2.2324 COc1cc(ccc1O)c2ncc(s2)C 271570a_100000040328_100000690809 [0,0,0,1,0,1|0,1,0]=3 2809 B16R2.2324 COc1cc(ccc1O)c2ncn(n2)C 271570a_100000040328_100009819955 [0,0,0,1,0,1|2,0,0]=4 2810 B16R2.2324 COc1cc(ccc1O)c2nnc(o2)C 271570a_100000040328_100000708914 [0,0,0,1,0,1|1,0,1]=4 2811 B16R2.2324 COc1cc(ccc1O)c2nnc(s2)C 271570a_100000040328_100000686958 [0,0,0,1,0,1|1,1,0]=4 2812 B16R2.2324 COc1cc(ccc1O)c2noc(n2)C 270196a_100000184589_100000070787 [0,0,0,1,0,1|2,0,0]=4 2813 B16R2.2324 COc1cc(ccc1O)c2noc(n2)C 271570a_100000040328_100012003639 [0,0,0,1,0,1|2,0,0]=4 2814 B16R2.2324 COc1nc(ccc1O)c2cc(cs2)C 271570a_100000038307_100010893133 [0,0,0,1,0,1|2,0,0]=4 2815 B16R2.2324 COc1nc(ccc1O)c2ccc(o2)C 271570a_100000061910_100010893133 [0,0,0,1,0,1|1,0,1]=4 2816 B16R2.2324 COc1nc(ccc1O)c2ccc(s2)C 271570a_100011934456_100010893133 [0,0,0,1,0,1|1,1,0]=4 2817 B16R2.2324 COc1nc(ccc1O)c2cnc(s2)C 271570a_100000696845_100010893133 [0,0,0,1,0,1|1,1,0]=4 2818 B16R2.2324 COc1nc(ccc1O)c2csc(c2)C 271570a_100000699828_100010893133 [0,0,0,1,0,1|2,0,0]=4 2819 B16R2.6908 COc1cc(ccc1O)SC2CC(=O)C2 62a_100009894365_100000694246 [0,0,0,1,0,1|0,0,2]=4 2820 B16R2.27160 CC(=CCNc1ccc2c(c1)OCO2)C 2230a_100000209953_100000761012 [0,0,0,1,0,1|1,0,1]=4 2821 B16R2.27160 CC(=CCNc1ccc2c(c1)OCO2)C 34a_100000209953_100000761012 [0,0,0,1,0,1|1,0,1]=4 2822 B16R2.27160 CC(=CCOc1ccc2c(c1)OCO2)C 34a_100000210298_100000761012 [0,0,0,1,0,1|1,0,1]=4 2823 B16R2.27160 CC(=O)COCc1ccc2c(c1)OCO2 34a_100000211253_100000189651 [0,0,0,1,0,1|0,0,2]=4 2824 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 11a_100000204656_100015343762 [0,0,0,1,0,1|0,0,2]=4 2825 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 1626a_100000204656_100015343762 [0,0,0,1,0,1|0,0,2]=4 2826 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 240690a_100000204656_100015343762 [0,0,0,1,0,1|0,0,2]=4 2827 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 527a_100000204656_100103153847 [0,0,0,1,0,1|0,0,2]=4 2828 B16R2.27160 CC(=O)NN=Cc1ccc2c(c1)CCO2 4a_100000189765_100011218456 [0,0,0,1,0,1|2,0,0]=4 2829 B16R2.27160 CC(=O)OCNc1ccc2c(c1)OCO2 34a_100000209953_100009813279 [0,0,0,1,0,1|1,0,1]=4 2830 B16R2.27160 CC(=O)OCOc1ccc2c(c1)OCO2 34a_100000210298_100009813279 [0,0,0,1,0,1|1,0,1]=4 2831 B16R2.27160 CC(C)CC=Cc1ccc2c(c1)OCO2 271570a_100016259101_100000688060 [0,0,0,1,0,1|1,0,1]=4 2832 B16R2.477 CC(=O)C=Cc1ccc2c(c1)OCCO2 1458a_100000179788_200000210301 [0,1,0,1,0,0|0,0,0]=2 2833 B16R2.477 CC(=O)CSc1ccc2c(c1)OCCO2 1458a_100000179515_200000210301 [0,1,0,1,0,0|1,0,1]=4 2834 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 11a_100000684186_100015343762 [0,1,0,1,0,0|1,0,1]=4 2835 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 1626a_100000684186_100015343762 [0,1,0,1,0,0|1,0,1]=4 2836 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 240690a_100000684186_100015343762 [0,1,0,1,0,0|1,0,1]=4 2837 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 527a_100000684186_100103153847 [0,1,0,1,0,0|1,0,1]=4 2838 B16R2.477 CC(C)C=Cc1ccc2c(c1)OCCO2 271570a_100016257149_100000184379 [0,1,0,1,0,0|1,0,1]=4 2839 B16R2.477 CC(O)C=Cc1ccc2c(c1)OCCO2 271570a_200011019289_100000184379 [0,1,0,1,0,0|0,0,2]=4 2840 B16R2.477 [13CH3]C(=O)C=Cc1ccc2c(c1)OCCO2 1458a_100000179788_200025704644 [0,1,0,1,0,0|0,0,0]=2 2841 B16R2.477 [13CH3]C(=O)CSc1ccc2c(c1)OCCO2 1458a_100000179515_200025704644 [0,1,0,1,0,0|1,0,1]=4 2842 B16R2.3954 CC(=O)C=Cc1cc2c(cc1Br)OCO2 1458a_100016995997_200000210301 [0,1,0,1,0,0|0,0,0]=2 2843 B16R2.3954 CC(=O)CCc1cc2c(cc1Br)OCO2 1458a_200009827803_200000210301 [0,1,0,1,0,0|0,0,2]=4 2844 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 11a_200011199097_100015343762 [0,1,0,1,0,0|1,0,1]=4 2845 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 1626a_200011199097_100015343762 [0,1,0,1,0,0|1,0,1]=4 2846 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 240690a_200011199097_100015343762 [0,1,0,1,0,0|1,0,1]=4 2847 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 527a_200011199097_100103153847 [0,1,0,1,0,0|1,0,1]=4 2848 B16R2.3954 CC(C)C=Cc1cc2c(cc1N)OCO2 271570a_100016257149_100012557033 [0,1,0,1,0,0|1,0,1]=4 2849 B16R2.3954 CC(C)C=Cc1cc2c(cc1O)OCO2 271570a_100016257149_100010290809 [0,1,0,1,0,0|1,0,1]=4 2850 B16R2.3954 CC(O)C=Cc1cc2c(cc1N)OCO2 271570a_200011019289_100012557033 [0,1,0,1,0,0|0,0,2]=4 2851 B16R2.3954 CC(O)C=Cc1cc2c(cc1O)OCO2 271570a_200011019289_100010290809 [0,1,0,1,0,0|0,0,2]=4 2852 B16R2.3954 [13CH3]C(=O)C=Cc1cc2c(cc1Br)OCO2 1458a_100016995997_200025704644 [0,1,0,1,0,0|0,0,0]=2 2853 B16R2.3954 [13CH3]C(=O)CCc1cc2c(cc1Br)OCO2 1458a_200009827803_200025704644 [0,1,0,1,0,0|0,0,2]=4 2854 B16R2.70221 COc1c(cc(c2c1nc(cc2)C)C)C 34a_200000065913_200000210301 [0,1,0,1,0,0|2,0,0]=4 2855 B16R2.70221 COc1c(cc(c2c1nc(cc2)C)C)C 7a_200000065913_200000210301 [0,1,0,1,0,0|2,0,0]=4 2856 B16R2.70221 COc1c(cc(c2c1nc(cc2)C)Cl)Cl 34a_100000210574_200000210301 [0,1,0,1,0,0|2,0,0]=4 2857 B16R2.70221 COc1c(cc(c2c1nc(cc2)C)Cl)Cl 7a_100000210574_200000210301 [0,1,0,1,0,0|2,0,0]=4 2858 B16R2.70221 Cc1ccc2c(cc(c(c2n1)O[13CH3])C)C 34a_200000065913_200025704644 [0,1,0,1,0,0|2,0,0]=4 2859 B16R2.70221 Cc1ccc2c(cc(c(c2n1)O[13CH3])C)C 7a_200000065913_200025704644 [0,1,0,1,0,0|2,0,0]=4 2860 B16R2.70221 Cc1ccc2c(cc(c(c2n1)O[13CH3])Cl)Cl 34a_100000210574_200025704644 [0,1,0,1,0,0|2,0,0]=4 2861 B16R2.70221 Cc1ccc2c(cc(c(c2n1)O[13CH3])Cl)Cl 7a_100000210574_200025704644 [0,1,0,1,0,0|2,0,0]=4 2862 B16R2.202652 COc1cc(c(cc1O)F)C=CC2CC2 271570a_100102526188_100010189133 [0,1,0,1,0,0|1,0,1]=4 2863 B16R2.82843 CC(C)(C)C=Cc1ccc2c(c1)OCO2 271570a_100102527731_100000688060 [0,1,0,1,0,0|1,0,1]=4 2864 B16R2.82843 CC(C)(O)C=Cc1ccc2c(c1)OCO2 271570a_200016258132_100000688060 [0,1,0,1,0,0|0,0,2]=4 2865 B16R2.11587 C=C(C)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000748629 [0,1,0,1,0,0|1,0,1]=4 2866 B16R2.11587 CC(=O)CC(=O)c1ccc2c(c1)CCO2 1458a_100000070787_100000241338 [0,1,0,1,0,0|1,0,1]=4 2867 B16R2.11587 CC(=O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000070787_100000181162 [0,1,0,1,0,0|0,0,1]=3 2868 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 11a_100000744171_100015343762 [0,1,0,1,0,0|1,0,1]=4 2869 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 1626a_100000744171_100015343762 [0,1,0,1,0,0|1,0,1]=4 2870 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 240690a_100000744171_100015343762 [0,1,0,1,0,0|1,0,1]=4 2871 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 527a_100000744171_100103153847 [0,1,0,1,0,0|1,0,1]=4 2872 B16R2.11587 NC(=O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000187820 [0,1,0,1,0,0|1,0,1]=4 2873 B16R2.11587 O=C([O-])CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100020667443 [0,1,0,1,0,0|1,0,1]=4 2874 B16R2.6257 C=C(C)C(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100000185857 [0,1,0,1,0,0|2,0,0]=4 2875 B16R2.6257 C=C(C)C(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000185857 [0,1,0,1,0,0|2,0,0]=4 2876 B16R2.6257 C=C(C)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000185857 [0,1,0,1,0,0|2,0,0]=4 2877 B16R2.6257 CC(=O)C(C)Cc1ccc2c(c1)OCO2 1458a_100000062412_200000210301 [0,1,0,1,0,0|0,0,2]=4 2878 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009814033 [0,1,0,1,0,0|1,0,1]=4 2879 B16R2.6257 CC(=O)C(C)Oc1ccc2c(c1)OCO2 1458a_100000246018_200000210301 [0,1,0,1,0,0|1,0,1]=4 2880 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 11a_100000186720_100015343762 [0,1,0,1,0,0|1,0,1]=4 2881 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 240690a_100000186720_100015343762 [0,1,0,1,0,0|1,0,1]=4 2882 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 527a_100000186720_100103153847 [0,1,0,1,0,0|1,0,1]=4 2883 B16R2.6257 CC(Cc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000062412_200025704644 [0,1,0,1,0,0|0,0,2]=4 2884 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000246018_200025704644 [0,1,0,1,0,0|1,0,1]=4 2885 B16R2.6257 NC(=O)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100011215815 [0,1,0,1,0,0|2,0,0]=4 2886 B16R2.6906 COc1cc(ccc1O)NC2CCC2=O 34a_100000726020_100009892977 [0,1,0,1,0,0|1,0,1]=4 2887 B16R2.6906 COc1cc(ccc1O)SC2CCC2=O 62a_100009892977_100000694246 [0,1,0,1,0,0|1,0,1]=4 2888 B16R2.1357 CCC(=O)C=Cc1ccc2c(c1)CCO2 1458a_100000241297_100000210202 [0,1,0,1,0,0|1,0,0]=3 2889 B16R2.1357 CCC(=O)C=Cc1ccc2c(c1)CCO2 6a_100011218456_100000211110 [0,1,0,1,0,0|1,0,0]=3 2890 B16R2.1357 CCC(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_100000210202 [0,1,0,1,0,0|0,0,0]=2 2891 B16R2.1357 CCC(=O)C=Cc1ccc2occc2c1 6a_100000040644_100000211110 [0,1,0,1,0,0|1,0,1]=4 2892 B16R2.1357 CCC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_100000210202 [0,1,0,1,0,0|0,0,2]=4 2893 B16R2.1357 CCC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_100000210202 [0,1,0,1,0,0|1,0,1]=4 2894 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100000210414 [0,1,0,1,0,0|1,0,1]=4 2895 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100000210414 [0,1,0,1,0,0|1,0,1]=4 2896 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100000210414 [0,1,0,1,0,0|1,0,1]=4 2897 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100000210414 [0,1,0,1,0,0|1,0,1]=4 2898 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)CCO2 11a_106832991635_100000241297 [0,1,0,1,0,0|1,0,0]=3 2899 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)CCO2 1626a_100102657272_100000241297 [0,1,0,1,0,0|1,0,0]=3 2900 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)CCO2 240690a_100102657272_100000241297 [0,1,0,1,0,0|1,0,0]=3 2901 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)OCO2 11a_106832991635_100000182195 [0,1,0,1,0,0|0,0,0]=2 2902 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)OCO2 1626a_100102657272_100000182195 [0,1,0,1,0,0|0,0,0]=2 2903 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 11a_106832991635_100000235677 [0,1,0,1,0,0|0,0,2]=4 2904 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 1626a_100102657272_100000235677 [0,1,0,1,0,0|0,0,2]=4 2905 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 240690a_100102657272_100000235677 [0,1,0,1,0,0|0,0,2]=4 2906 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 527a_100102657272_100000235677 [0,1,0,1,0,0|0,0,2]=4 2907 B16R2.1357 CNC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000183359 [0,1,0,1,0,0|1,0,1]=4 2908 B16R2.1357 CNC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000183359 [0,1,0,1,0,0|1,0,1]=4 2909 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 11a_106832991635_100000246017 [0,1,0,1,0,0|1,0,1]=4 2910 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 1626a_100102657272_100000246017 [0,1,0,1,0,0|1,0,1]=4 2911 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 240690a_100102657272_100000246017 [0,1,0,1,0,0|1,0,1]=4 2912 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000183359 [0,1,0,1,0,0|1,0,1]=4 2913 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 527a_100102657272_100000246017 [0,1,0,1,0,0|1,0,1]=4 2914 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 2708a_100000210006_106832991635 [0,1,0,1,0,0|1,0,1]=4 2915 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 2708a_100102657272_100000210006 [0,1,0,1,0,0|1,0,1]=4 2916 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 273464a_100000210006_100102657272 [0,1,0,1,0,0|1,0,1]=4 2917 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 273464a_100102657272_100000210006 [0,1,0,1,0,0|1,0,1]=4 2918 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 512a_106832991638_100000210006 [0,1,0,1,0,0|1,0,1]=4 2919 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747449 [0,1,0,1,0,0|1,0,1]=4 2920 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000747449 [0,1,0,1,0,0|1,0,1]=4 2921 B16R2.1357 COC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000747449 [0,1,0,1,0,0|1,0,1]=4 2922 B16R2.1357 O=C(C=Cc1ccc2c(c1)CCO2)CBr 6a_100011218456_100009888967 [0,1,0,1,0,0|1,0,0]=3 2923 B16R2.1357 O=C(C=Cc1ccc2c(c1)CCO2)CCl 6a_100011218456_100000086384 [0,1,0,1,0,0|1,0,0]=3 2924 B16R2.1357 O=C(C=Cc1ccc2c(c1)CCO2)CF 1458a_100000241297_100015361967 [0,1,0,1,0,0|1,0,0]=3 2925 B16R2.1357 O=C(C=Cc1ccc2c(c1)CCO2)CF 6a_100011218456_100000764096 [0,1,0,1,0,0|1,0,0]=3 2926 B16R2.1357 O=C(C=Cc1ccc2c(c1)OCO2)CF 1458a_100000182195_100015361967 [0,1,0,1,0,0|0,0,0]=2 2927 B16R2.1357 O=C(C=Cc1ccc2occc2c1)CBr 6a_100000040644_100009888967 [0,1,0,1,0,0|1,0,1]=4 2928 B16R2.1357 O=C(C=Cc1ccc2occc2c1)CCl 6a_100000040644_100000086384 [0,1,0,1,0,0|1,0,1]=4 2929 B16R2.1357 O=C(C=Cc1ccc2occc2c1)CF 6a_100000040644_100000764096 [0,1,0,1,0,0|1,0,1]=4 2930 B16R2.1357 O=C(CF)CCc1ccc2c(c1)OCO2 1458a_100000235677_100015361967 [0,1,0,1,0,0|0,0,2]=4 2931 B16R2.1357 O=C(CF)COc1ccc2c(c1)OCO2 1458a_100000246017_100015361967 [0,1,0,1,0,0|1,0,1]=4 2932 B16R2.1357 O=C(CO)NCc1ccc2c(c1)OCO2 240690a_100000210006_100000210174 [0,1,0,1,0,0|1,0,1]=4 2933 B16R2.1357 O=C(CO)NCc1ccc2c(c1)OCO2 527a_100000210006_100000210174 [0,1,0,1,0,0|1,0,1]=4 2934 B16R2.83537 CC(C)C=Cc1ccc2c(c1F)OCO2 271570a_100016257149_100010223184 [0,1,0,1,0,0|1,0,1]=4 2935 B16R2.83537 CC(O)C=Cc1ccc2c(c1F)OCO2 271570a_200011019289_100010223184 [0,1,0,1,0,0|0,0,2]=4 2936 B16R2.83537 Cc1c(ccc2c1OCO2)C=CC(C)C 271570a_100016257149_100010335860 [0,1,0,1,0,0|1,0,1]=4 2937 B16R2.83537 Cc1c(ccc2c1OCO2)C=CC(C)O 271570a_200011019289_100010335860 [0,1,0,1,0,0|0,0,2]=4 2938 B16R2.1461 COc1cc2ccc(=O)oc2cc1OC 7a_100000032626_200000210301 [0,1,0,1,0,0|1,0,0]=3 2939 B16R2.1461 COc1cc2ccc(=O)oc2cc1O[13CH3] 7a_100000032626_200025704644 [0,1,0,1,0,0|1,0,0]=3 2940 B16R2.7475 COc1ccc2ccc(cc2c1SC)C 62a_200000210301_203437268721 [0,1,0,1,0,0|1,1,0]=4 2941 B16R2.7475 COc1ccc2ccc(cc2c1S[13CH3])C 62a_200025704644_203437268721 [0,1,0,1,0,0|1,1,0]=4 2942 B16R2.196403 COc1cc(ccc1CO)C=CC2CC2 271570a_100102526188_100011277633 [0,1,0,1,0,0|1,0,1]=4 2943 B16R2.196403 COc1ccc(cc1OC)C=CC2CC2 271570a_100102526188_100000187503 [0,1,0,1,0,0|1,0,1]=4 2944 B16R3.6439 C(=CC1CC1)c2ccc3c(c2)OCO3 271570a_100102526188_100000688060 [0,0,0,2,0,0|1,0,1]=4 2945 B12R1.19 CC(=Cc1cc(c(cn1)O)C)C 271570a_100102525489_100000692680 [1,0,0,0,1,0|2,0,0]=4 2946 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [1,0,0,0,1,0|2,0,0]=4 2947 B12R1.19 CC(=Cc1ccc(c(c1)C)Br)C 271570a_100102525489_100009813585 [1,0,0,0,1,0|2,0,0]=4 2948 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [1,0,0,0,1,0|2,0,0]=4 2949 B12R1.19 CC(=Cc1ccc(c(c1)C)Cl)C 271570a_100102525489_100000049509 [1,0,0,0,1,0|2,0,0]=4 2950 B12R1.19 CC(=Cc1ccc(c(c1)C)F)C 271570a_100102525489_100011218330 [1,0,0,0,1,0|2,0,0]=4 2951 B12R1.19 CC(=Cc1ccc(c(c1)C)N)C 271570a_100102525489_100000211769 [1,0,0,0,1,0|2,0,0]=4 2952 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [1,0,0,0,1,0|1,0,0]=3 2953 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [1,0,0,0,1,0|2,0,0]=4 2954 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [1,0,0,0,1,0|2,0,0]=4 2955 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [1,0,0,0,1,0|2,0,0]=4 2956 B12R1.19 CC(=Cc1ccc(c(c1)O)Br)C 271570a_100102525489_100012356990 [1,0,0,0,1,0|2,0,0]=4 2957 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [1,0,0,0,1,0|2,0,0]=4 2958 B12R1.19 CC(=Cc1ccc(c(c1)O)Cl)C 271570a_100102525489_100011356854 [1,0,0,0,1,0|2,0,0]=4 2959 B12R1.19 CC(=Cc1ccc(c(c1)O)F)C 271570a_100102525489_100000686035 [1,0,0,0,1,0|2,0,0]=4 2960 B12R1.19 CC(=Cc1ccc(c(c1)O)N)C 271570a_100102525489_100000739049 [1,0,0,0,1,0|2,0,0]=4 2961 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,0,0,0,1,0|1,0,0]=3 2962 B12R1.19 CC(=Cc1ccc(c(n1)C)O)C 271570a_100102525489_100010233687 [1,0,0,0,1,0|2,0,0]=4 2963 B12R1.19 CC(=Cc1cnc(c(c1)C)O)C 271570a_100102525489_100000685391 [1,0,0,0,1,0|2,0,0]=4 2964 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,0,0,0,1,0|1,0,1]=4 2965 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [1,0,0,0,1,0|1,0,1]=4 2966 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [1,0,0,0,1,0|1,0,1]=4 2967 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [1,0,0,0,1,0|1,0,1]=4 2968 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [1,0,0,0,1,0|1,0,1]=4 2969 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [1,0,0,0,1,0|1,0,1]=4 2970 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [1,0,0,0,1,0|1,0,1]=4 2971 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [1,0,0,0,1,0|1,0,1]=4 2972 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,0,0,0,1,0|0,0,1]=3 2973 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,0,0,0,1,0|1,0,1]=4 2974 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,0,0,0,1,0|1,0,1]=4 2975 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,0,0,0,1,0|1,0,1]=4 2976 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,0,0,0,1,0|0,0,1]=3 2977 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,0,0,0,1,0|0,0,1]=3 2978 B12R1.19 CC(=O)Nc1cc(c(cn1)O)C 271570a_203496583355_100011934553 [1,0,0,0,1,0|2,0,0]=4 2979 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [1,0,0,0,1,0|2,0,0]=4 2980 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [1,0,0,0,1,0|2,0,0]=4 2981 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [1,0,0,0,1,0|2,0,0]=4 2982 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [1,0,0,0,1,0|2,0,0]=4 2983 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [1,0,0,0,1,0|2,0,0]=4 2984 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [1,0,0,0,1,0|2,0,0]=4 2985 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [1,0,0,0,1,0|2,0,0]=4 2986 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [1,0,0,0,1,0|2,0,0]=4 2987 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [1,0,0,0,1,0|2,0,0]=4 2988 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [1,0,0,0,1,0|2,0,0]=4 2989 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [1,0,0,0,1,0|2,0,0]=4 2990 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [1,0,0,0,1,0|2,0,0]=4 2991 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [1,0,0,0,1,0|2,0,0]=4 2992 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [1,0,0,0,1,0|2,0,0]=4 2993 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [1,0,0,0,1,0|2,0,0]=4 2994 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [1,0,0,0,1,0|2,0,0]=4 2995 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [1,0,0,0,1,0|2,0,0]=4 2996 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [1,0,0,0,1,0|2,0,0]=4 2997 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [1,0,0,0,1,0|2,0,0]=4 2998 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [1,0,0,0,1,0|2,0,0]=4 2999 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [1,0,0,0,1,0|2,0,0]=4 3000 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [1,0,0,0,1,0|2,0,0]=4 3001 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [1,0,0,0,1,0|1,0,0]=3 3002 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [1,0,0,0,1,0|1,0,0]=3 3003 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [1,0,0,0,1,0|1,0,0]=3 3004 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [1,0,0,0,1,0|1,0,0]=3 3005 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [1,0,0,0,1,0|2,0,0]=4 3006 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [1,0,0,0,1,0|2,0,0]=4 3007 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [1,0,0,0,1,0|2,0,0]=4 3008 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [1,0,0,0,1,0|2,0,0]=4 3009 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [1,0,0,0,1,0|2,0,0]=4 3010 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [1,0,0,0,1,0|2,0,0]=4 3011 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [1,0,0,0,1,0|2,0,0]=4 3012 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [1,0,0,0,1,0|2,0,0]=4 3013 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [1,0,0,0,1,0|2,0,0]=4 3014 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [1,0,0,0,1,0|2,0,0]=4 3015 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [1,0,0,0,1,0|2,0,0]=4 3016 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [1,0,0,0,1,0|2,0,0]=4 3017 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,0,0,0,1,0|1,0,0]=3 3018 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,0,0,0,1,0|1,0,0]=3 3019 B12R1.19 CC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187074 [1,0,0,0,1,0|2,0,0]=4 3020 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [1,0,0,0,1,0|2,0,0]=4 3021 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [1,0,0,0,1,0|1,0,1]=4 3022 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [1,0,0,0,1,0|1,0,1]=4 3023 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,0,0,0,1,0|0,0,1]=3 3024 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [1,0,0,0,1,0|2,0,0]=4 3025 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [1,0,0,0,1,0|1,0,1]=4 3026 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,0,0,0,1,0|1,0,1]=4 3027 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,0,0,0,1,0|1,0,1]=4 3028 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,0,0,0,1,0|1,0,1]=4 3029 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,0,0,0,1,0|1,0,1]=4 3030 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,0,0,0,1,0|0,0,1]=3 3031 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [1,0,0,0,1,0|0,1,1]=4 3032 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [1,0,0,0,1,0|0,1,1]=4 3033 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [1,0,0,0,1,0|2,0,0]=4 3034 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [1,0,0,0,1,0|1,0,0]=3 3035 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [1,0,0,0,1,0|1,0,0]=3 3036 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [1,0,0,0,1,0|1,1,0]=4 3037 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [1,0,0,0,1,0|1,0,0]=3 3038 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [1,0,0,0,1,0|1,1,0]=4 3039 B12R1.438 CCc1cccc(c1)C=C(C)C 271570a_100102525489_100000684523 [1,0,0,0,1,0|2,0,0]=4 3040 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [1,0,0,0,1,0|2,0,0]=4 3041 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [1,0,0,0,1,0|2,0,0]=4 3042 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [1,0,0,0,1,0|2,0,0]=4 3043 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [1,0,0,0,1,0|2,0,0]=4 3044 B12R1.438 CNc1cccc(c1)C=C(C)C 271570a_100102525489_100000219648 [1,0,0,0,1,0|2,0,0]=4 3045 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [1,0,0,0,1,0|2,0,0]=4 3046 B12R1.438 COc1cc(ccn1)C=C(C)C 271570a_100102525489_100000117307 [1,0,0,0,1,0|2,0,0]=4 3047 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [1,0,0,0,1,0|1,0,1]=4 3048 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [1,0,0,0,1,0|1,0,1]=4 3049 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [1,0,0,0,1,0|1,0,1]=4 3050 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [1,0,0,0,1,0|1,0,0]=3 3051 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [1,0,0,0,1,0|0,0,1]=3 3052 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [1,0,0,0,1,0|0,0,1]=3 3053 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [1,0,0,0,1,0|1,0,1]=4 3054 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [1,0,0,0,1,0|1,0,1]=4 3055 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [1,0,0,0,1,0|0,0,1]=3 3056 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [1,0,0,0,1,0|1,0,0]=3 3057 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [1,0,0,0,1,0|1,0,0]=3 3058 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [1,0,0,0,1,0|1,0,0]=3 3059 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [1,0,0,0,1,0|1,0,0]=3 3060 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [1,0,0,0,1,0|1,0,0]=3 3061 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [1,0,0,0,1,0|1,0,0]=3 3062 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [1,0,0,0,1,0|2,0,0]=4 3063 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [1,0,0,0,1,0|2,0,0]=4 3064 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [1,0,0,0,1,0|1,0,0]=3 3065 B12R1.438 COc1cccc(n1)C=C(C)C 271570a_100102525489_100000760917 [1,0,0,0,1,0|2,0,0]=4 3066 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [1,0,0,0,1,0|1,0,1]=4 3067 B12R1.438 COc1ccnc(c1)C=C(C)C 271570a_100102525489_100011216251 [1,0,0,0,1,0|2,0,0]=4 3068 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [1,0,0,0,1,0|1,0,1]=4 3069 B12R1.438 COc1cncc(c1)C=C(C)C 271570a_100102525489_100000684773 [1,0,0,0,1,0|2,0,0]=4 3070 B12R1.438 CSc1cccc(c1)C=C(C)C 271570a_100102525489_100011215954 [1,0,0,0,1,0|1,1,0]=4 3071 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [1,0,0,0,1,0|0,1,1]=4 3072 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [1,0,0,0,1,0|0,1,1]=4 3073 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [1,0,0,0,1,0|0,1,1]=4 3074 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [1,0,0,0,1,0|0,1,1]=4 3075 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [1,0,0,0,1,0|1,1,0]=4 3076 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [1,0,0,0,1,0|1,1,0]=4 3077 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [1,0,0,0,1,0|1,1,0]=4 3078 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [1,0,0,0,1,0|1,1,0]=4 3079 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [1,0,0,0,1,0|1,1,0]=4 3080 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [1,0,0,0,1,0|1,1,0]=4 3081 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [1,0,0,0,1,0|1,0,1]=4 3082 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [1,0,0,0,1,0|1,0,1]=4 3083 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [1,0,0,0,1,0|2,0,0]=4 3084 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [1,0,0,0,1,0|2,0,0]=4 3085 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,0,0,0,2,0|2,0,0]=4 3086 B12R1.56 C=C(C)c1ccc(c(c1)OC)Br 271570a_100000694244_100012353699 [0,0,0,0,2,0|2,0,0]=4 3087 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [0,0,0,0,2,0|2,0,0]=4 3088 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [0,0,0,0,2,0|2,0,0]=4 3089 B12R1.56 C=C(C)c1ccc(c(c1)OC)F 271570a_100000694244_100011934186 [0,0,0,0,2,0|2,0,0]=4 3090 B12R1.56 C=C(C)c1ccc(c(c1)OC)N 271570a_100000694244_100011279103 [0,0,0,0,2,0|2,0,0]=4 3091 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,0,0,0,2,0|1,0,0]=3 3092 B12R1.56 C=C(C)c1ccc(c(n1)OC)O 271570a_100000694244_100010893133 [0,0,0,0,2,0|2,0,0]=4 3093 B12R1.56 C=Cc1cc(ccc1O)C(=O)C 271570a_100011290941_100011772453 [0,0,0,0,2,0|1,0,1]=4 3094 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200000210301 [0,0,0,0,2,0|2,0,0]=4 3095 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010125495 [0,0,0,0,2,0|2,0,0]=4 3096 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [0,0,0,0,2,0|1,0,0]=3 3097 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [0,0,0,0,2,0|1,0,0]=3 3098 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [0,0,0,0,2,0|1,0,0]=3 3099 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [0,0,0,0,2,0|1,0,0]=3 3100 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100010146556_200025704644 [0,0,0,0,2,0|1,1,0]=4 3101 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100010146556 [0,0,0,0,2,0|1,1,0]=4 3102 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_100011934287_200025704644 [0,0,0,0,2,0|1,1,0]=4 3103 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100011934287 [0,0,0,0,2,0|1,1,0]=4 3104 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000239719_200025704644 [0,0,0,0,2,0|1,1,0]=4 3105 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000239719 [0,0,0,0,2,0|1,1,0]=4 3106 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])N 62a_100012029215_200025704644 [0,0,0,0,2,0|1,1,0]=4 3107 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [0,0,0,0,2,0|0,1,0]=3 3108 B12R1.56 CCc1cc(ccc1Br)C(=O)C 1458a_100010152358_200000210301 [0,0,0,0,2,0|2,0,0]=4 3109 B12R1.56 CCc1cc(ccc1Br)C(=O)[13CH3] 1458a_100010152358_200025704644 [0,0,0,0,2,0|2,0,0]=4 3110 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [0,0,0,0,2,0|2,0,0]=4 3111 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [0,0,0,0,2,0|2,0,0]=4 3112 B12R1.56 CCc1cc(ccc1F)C(=O)C 1458a_100009883079_200000210301 [0,0,0,0,2,0|2,0,0]=4 3113 B12R1.56 CCc1cc(ccc1F)C(=O)[13CH3] 1458a_100009883079_200025704644 [0,0,0,0,2,0|2,0,0]=4 3114 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [0,0,0,0,2,0|1,0,0]=3 3115 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [0,0,0,0,2,0|2,0,0]=4 3116 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [0,0,0,0,2,0|2,0,0]=4 3117 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [0,0,0,0,2,0|1,0,0]=3 3118 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [0,0,0,0,2,0|1,0,0]=3 3119 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [0,0,0,0,2,0|1,0,0]=3 3120 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [0,0,0,0,2,0|1,0,0]=3 3121 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [0,0,0,0,2,0|1,0,0]=3 3122 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [0,0,0,0,2,0|1,0,0]=3 3123 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [0,0,0,0,2,0|1,0,0]=3 3124 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [0,0,0,0,2,0|1,0,0]=3 3125 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [0,0,0,0,2,0|1,0,0]=3 3126 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [0,0,0,0,2,0|1,0,0]=3 3127 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [0,0,0,0,2,0|1,0,0]=3 3128 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [0,0,0,0,2,0|1,0,0]=3 3129 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [0,0,0,0,2,0|1,0,0]=3 3130 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [0,0,0,0,2,0|2,0,0]=4 3131 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [0,0,0,0,2,0|2,0,0]=4 3132 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,0,0,0,2,0|0,0,0]=2 3133 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,0,0,0,2,0|0,0,0]=2 3134 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,0,0,0,2,0|1,0,0]=3 3135 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,0,0,0,2,0|0,0,0]=2 3136 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [0,0,0,0,2,0|1,0,1]=4 3137 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_100010146556_200000210301 [0,0,0,0,2,0|1,1,0]=4 3138 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_200000210301_100010146556 [0,0,0,0,2,0|1,1,0]=4 3139 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_100011934287_200000210301 [0,0,0,0,2,0|1,1,0]=4 3140 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_200000210301_100011934287 [0,0,0,0,2,0|1,1,0]=4 3141 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_100000239719_200000210301 [0,0,0,0,2,0|1,1,0]=4 3142 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_200000210301_100000239719 [0,0,0,0,2,0|1,1,0]=4 3143 B12R1.56 CSc1cc(ccc1N)C(=O)C 62a_100012029215_200000210301 [0,0,0,0,2,0|1,1,0]=4 3144 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [0,0,0,0,2,0|0,1,0]=3 3145 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200025704644 [0,0,0,0,2,0|2,0,0]=4 3146 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [0,0,0,0,2,0|2,0,0]=4 3147 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [0,0,0,0,2,0|2,0,0]=4 3148 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [0,0,0,0,2,0|2,0,0]=4 3149 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [0,0,0,0,2,0|2,0,0]=4 3150 B14R1.76 C=C(C)C=NNc1cccc(c1)OC 4a_100000722927_100000210575 [1,0,0,0,0,1|2,0,0]=4 3151 B14R1.76 CCc1cccc(c1)C=NNC(=O)C 4a_100000189765_100011999841 [1,0,0,0,0,1|2,0,0]=4 3152 B14R1.76 COc1cc(ccn1)C=NNC(=O)C 4a_100000189765_100000050969 [1,0,0,0,0,1|2,0,0]=4 3153 B14R1.76 COc1cccc(c1)C=CCC(C)C 271570a_100016259101_100000170001 [1,0,0,0,0,1|1,0,1]=4 3154 B14R1.76 COc1cccc(c1)C=CCN(C)C 270004a_100102631434_100102525843 [1,0,0,0,0,1|2,0,0]=4 3155 B14R1.76 COc1cccc(c1)C=NNC(=O)C 4a_100000189765_100000170238 [1,0,0,0,0,1|1,0,0]=3 3156 B14R1.76 COc1cccc(c1)CCNC(=O)C 11a_100000740386_100015343762 [1,0,0,0,0,1|0,0,2]=4 3157 B14R1.76 COc1cccc(c1)CCNC(=O)C 1626a_100000740386_100015343762 [1,0,0,0,0,1|0,0,2]=4 3158 B14R1.76 COc1cccc(c1)CCNC(=O)C 240690a_100000740386_100015343762 [1,0,0,0,0,1|0,0,2]=4 3159 B14R1.76 COc1cccc(c1)CCNC(=O)C 527a_100000740386_100103153847 [1,0,0,0,0,1|0,0,2]=4 3160 B14R1.76 COc1cccc(c1)CNNC(=O)C 22a_100015185960_100000070787 [1,0,0,0,0,1|1,0,1]=4 3161 B14R1.76 COc1cccc(c1)COCC(=O)C 34a_100000211253_100000688526 [1,0,0,0,0,1|0,0,2]=4 3162 B14R1.76 COc1cccc(c1)NCC=C(C)C 34a_100000210024_100000761012 [1,0,0,0,0,1|1,0,1]=4 3163 B14R1.76 COc1cccc(c1)NCOC(=O)C 34a_100000210024_100009813279 [1,0,0,0,0,1|1,0,1]=4 3164 B14R1.76 COc1cccc(c1)OCC=C(C)C 34a_100000211255_100000761012 [1,0,0,0,0,1|1,0,1]=4 3165 B14R1.76 COc1cccc(c1)OCC=C(C)C 7a_100000211255_100000761012 [1,0,0,0,0,1|1,0,1]=4 3166 B14R1.76 COc1cccc(c1)OCCC(=O)C 1458a_100000070787_100000691273 [1,0,0,0,0,1|0,0,2]=4 3167 B14R1.76 COc1cccc(c1)OCCC(=O)C 1458a_100000188295_200000210301 [1,0,0,0,0,1|0,0,2]=4 3168 B14R1.76 COc1cccc(c1)OCCC(=O)C 7a_100000211255_100000053229 [1,0,0,0,0,1|0,0,2]=4 3169 B14R1.76 COc1cccc(c1)OCCC(=O)[13CH3] 1458a_100000188295_200025704644 [1,0,0,0,0,1|0,0,2]=4 3170 B14R1.76 COc1cccc(c1)OCOC(=O)C 34a_100000211255_100009813279 [1,0,0,0,0,1|1,0,1]=4 3171 B14R1.76 COc1cccc(c1)SCC=C(C)C 62a_100000761012_100000170001 [1,0,0,0,0,1|1,0,1]=4 3172 B14R1.76 COc1cccc(c1)SCCC(=O)C 62a_100000053229_100000170001 [1,0,0,0,0,1|0,0,2]=4 3173 B14R1.76 COc1cccc(c1)SCOC(=O)C 62a_100000076356_100000170001 [1,0,0,0,0,1|1,0,1]=4 3174 B14R1.76 COc1cccc(n1)C=NNC(=O)C 4a_100000189765_100000694346 [1,0,0,0,0,1|2,0,0]=4 3175 B14R1.76 COc1ccnc(c1)C=NNC(=O)C 4a_100000189765_100000087537 [1,0,0,0,0,1|2,0,0]=4 3176 B14R1.76 COc1cncc(c1)C=NNC(=O)C 4a_100000189765_100011361638 [1,0,0,0,0,1|2,0,0]=4 3177 B14R1.76 CSc1cccc(c1)C=NNC(=O)C 4a_100000189765_100011935093 [1,0,0,0,0,1|1,1,0]=4 3178 B14R1.118 COc1c(cccc1C=CC(=O)C)F 1458a_100102526134_200000210301 [0,0,0,0,1,1|1,0,0]=3 3179 B14R1.118 COc1c(cccc1C=CC(=O)[13CH3])F 1458a_100102526134_200025704644 [0,0,0,0,1,1|1,0,0]=3 3180 B14R1.118 COc1c(cccc1C=CC(C)C)O 271570a_100016257149_100010234590 [0,0,0,0,1,1|1,0,1]=4 3181 B14R1.118 COc1c(cccc1C=CC(C)O)O 271570a_200011019289_100010234590 [0,0,0,0,1,1|0,0,2]=4 3182 B14R1.118 COc1c(ccnc1C=CC(C)C)O 271570a_100016257149_100000104430 [0,0,0,0,1,1|1,0,1]=4 3183 B14R1.118 COc1c(ccnc1C=CC(C)O)O 271570a_200011019289_100000104430 [0,0,0,0,1,1|0,0,2]=4 3184 B14R1.1600 COc1cc(ccc1C=CC(C)C)O 271570a_100016257149_100011827694 [0,0,0,0,1,1|1,0,1]=4 3185 B14R1.1600 COc1cc(ccc1C=CC(C)O)O 271570a_200011019289_100011827694 [0,0,0,0,1,1|0,0,2]=4 3186 B16R1.4707 CC(=O)OCC=Cc1ccc(c(c1)C#N)O 271570a_200000047263_100000687585 [0,0,0,0,0,2|2,0,0]=4 3187 B16R1.4707 CC(=O)OCC=Cc1ccc(c(c1)C=O)O 271570a_200000047263_100000186750 [0,0,0,0,0,2|2,0,0]=4 3188 B16R1.4707 CC(=O)OCC=Cc1ccc(c(c1)CN)O 271570a_200000047263_100000730032 [0,0,0,0,0,2|2,0,0]=4 3189 B16R1.4707 CC(=O)OCC=Cc1ccc(c(c1)CO)O 271570a_200000047263_100000184703 [0,0,0,0,0,2|2,0,0]=4 3190 B16R1.4707 CCc1cc(ccc1Br)C=CCOC(=O)C 271570a_200000047263_100010244631 [0,0,0,0,0,2|2,0,0]=4 3191 B16R1.4707 CCc1cc(ccc1F)C=CCOC(=O)C 271570a_200000047263_100010244625 [0,0,0,0,0,2|2,0,0]=4 3192 B16R1.4707 CCc1cc(ccc1N)C=CCOC(=O)C 271570a_200000047263_100000686106 [0,0,0,0,0,2|2,0,0]=4 3193 B16R1.4707 CCc1cc(ccc1O)C=CCOC(=O)C 271570a_200000047263_100012338938 [0,0,0,0,0,2|1,0,0]=3 3194 B16R1.4707 CNc1cc(ccc1C)C=CCOC(=O)C 271570a_200000047263_100020629602 [0,0,0,0,0,2|2,0,0]=4 3195 B16R1.4707 CNc1cc(ccc1F)C=CCOC(=O)C 271570a_200000047263_100011314990 [0,0,0,0,0,2|2,0,0]=4 3196 B16R1.4707 CNc1cc(ccc1N)C=CCOC(=O)C 271570a_200000047263_100000694363 [0,0,0,0,0,2|2,0,0]=4 3197 B16R1.4707 COc1cc(c[nH]c1=O)C=CCOC(=O)C 271570a_200000047263_100010125397 [0,0,0,0,0,2|1,0,1]=4 3198 B16R1.4707 COc1cc(ccc1Br)C=CCOC(=O)C 271570a_200000047263_100012353699 [0,0,0,0,0,2|1,0,0]=3 3199 B16R1.4707 COc1cc(ccc1C)C=CCOC(=O)C 271570a_200000047263_100011830276 [0,0,0,0,0,2|1,0,0]=3 3200 B16R1.4707 COc1cc(ccc1Cl)C=CCOC(=O)C 271570a_200000047263_100011356853 [0,0,0,0,0,2|1,0,0]=3 3201 B16R1.4707 COc1cc(ccc1F)C=CCOC(=O)C 271570a_200000047263_100011934186 [0,0,0,0,0,2|1,0,0]=3 3202 B16R1.4707 COc1cc(ccc1F)NN=CC=C(C)C 4a_102515433066_100011215525 [0,0,0,0,0,2|2,0,0]=4 3203 B16R1.4707 COc1cc(ccc1N)C=CCOC(=O)C 271570a_200000047263_100011279103 [0,0,0,0,0,2|1,0,0]=3 3204 B16R1.4707 COc1cc(ccc1O)C=CCOC(=O)C 271570a_200000047263_100000694246 [0,0,0,0,0,2|0,0,0]=2 3205 B16R1.4707 COc1cc(ccc1O)CNCC=C(C)C 34a_100000185554_100000761012 [0,0,0,0,0,2|1,0,1]=4 3206 B16R1.4707 COc1cc(ccc1O)CNCOC(=O)C 34a_100000185554_100009813279 [0,0,0,0,0,2|0,0,2]=4 3207 B16R1.4707 COc1cc(ccc1O)NCCC=C(C)C 34a_100000726020_100011217483 [0,0,0,0,0,2|1,0,1]=4 3208 B16R1.4707 COc1cc(ccc1O)NCCCC(=O)C 34a_100000726020_100000685027 [0,0,0,0,0,2|0,0,2]=4 3209 B16R1.4707 COc1cc(ccc1O)NCCOC(=O)C 34a_100000726020_100009814007 [0,0,0,0,0,2|0,0,2]=4 3210 B16R1.4707 COc1cc(ccc1O)SCCC=C(C)C 62a_100011217483_100000694246 [0,0,0,0,0,2|1,0,1]=4 3211 B16R1.4707 COc1cc(ccc1O)SCCCC(=O)C 62a_100011215641_100000694246 [0,0,0,0,0,2|0,0,2]=4 3212 B16R1.4707 COc1cc(ccc1O)SCCNC(=O)C 62a_100000189650_100000694246 [0,0,0,0,0,2|0,0,2]=4 3213 B16R1.4707 COc1cc(ccc1O)SCCOC(=O)C 62a_100009814007_100000694246 [0,0,0,0,0,2|0,0,2]=4 3214 B16R1.4707 COc1cc(cnc1C)C=CCOC(=O)C 271570a_200000047263_100010254219 [0,0,0,0,0,2|2,0,0]=4 3215 B16R1.4707 COc1cc(cnc1F)C=CCOC(=O)C 271570a_200000047263_100010214931 [0,0,0,0,0,2|2,0,0]=4 3216 B16R1.4707 COc1cc(cnc1N)C=CCOC(=O)C 271570a_200000047263_106354213024 [0,0,0,0,0,2|2,0,0]=4 3217 B16R1.4707 COc1cc(ncc1C)C=CCOC(=O)C 271570a_200000047263_100010067687 [0,0,0,0,0,2|2,0,0]=4 3218 B16R1.4707 COc1cc(ncc1F)C=CCOC(=O)C 271570a_200000047263_200010136270 [0,0,0,0,0,2|2,0,0]=4 3219 B16R1.4707 COc1cc(ncc1N)C=CCOC(=O)C 271570a_200000047263_100009887741 [0,0,0,0,0,2|2,0,0]=4 3220 B16R1.4707 COc1nc(ccc1N)C=CCOC(=O)C 271570a_200000047263_100000687816 [0,0,0,0,0,2|2,0,0]=4 3221 B16R1.4707 COc1nc(ccc1O)C=CCOC(=O)C 271570a_200000047263_100010893133 [0,0,0,0,0,2|1,0,0]=3 3222 B16R1.4707 COc1nc(cnc1O)C=CCOC(=O)C 271570a_200000047263_200010365344 [0,0,0,0,0,2|2,0,0]=4 3223 B16R1.4707 CSc1cc(ccc1F)C=CCOC(=O)C 271570a_200000047263_100010341305 [0,0,0,0,0,2|1,1,0]=4