0 B14R1.42 C=C(C)CNc1ccc(c(c1)C#N)O 34a_100011249283_100000748629 [0,0,0,0,0,0|4,0,0]=4 1 B14R1.42 C=C(C)CNc1ccc(c(c1)CC)Br 2230a_100010109747_100000748629 [0,0,0,0,0,0|4,0,0]=4 2 B14R1.42 C=C(C)CNc1ccc(c(c1)CC)Br 34a_100010109747_100000748629 [0,0,0,0,0,0|4,0,0]=4 3 B14R1.42 C=C(C)CNc1ccc(c(c1)CC)Br 7a_100010109747_100000748629 [0,0,0,0,0,0|4,0,0]=4 4 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000748629 [0,0,0,0,0,0|3,0,0]=3 5 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000748629 [0,0,0,0,0,0|3,0,0]=3 6 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000748629 [0,0,0,0,0,0|3,0,0]=3 7 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 34a_100011279678_100000748629 [0,0,0,0,0,0|3,0,0]=3 8 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000748629 [0,0,0,0,0,0|3,0,0]=3 9 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000748629 [0,0,0,0,0,0|3,0,0]=3 10 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000748629 [0,0,0,0,0,0|3,0,0]=3 11 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 34a_100000701188_100000748629 [0,0,0,0,0,0|3,0,0]=3 12 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)I 34a_100000746945_100000748629 [0,0,0,0,0,0|3,0,0]=3 13 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748629 [0,0,0,0,0,0|2,0,0]=2 14 B14R1.42 C=C(C)COc1ccc(c(c1)CC)Cl 34a_100000212063_100000748629 [0,0,0,0,0,0|4,0,0]=4 15 B14R1.42 C=C(C)COc1ccc(c(c1)CC)Cl 7a_100000212063_100000748629 [0,0,0,0,0,0|4,0,0]=4 16 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 34a_100011827694_100000748629 [0,0,0,0,0,0|3,0,0]=3 17 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 7a_100011827694_100000748629 [0,0,0,0,0,0|3,0,0]=3 18 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 34a_100009865632_100000748629 [0,0,0,0,0,0|3,0,0]=3 19 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 7a_100009865632_100000748629 [0,0,0,0,0,0|3,0,0]=3 20 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000748629 [0,0,0,0,0,0|3,0,0]=3 21 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000748629 [0,0,0,0,0,0|3,0,0]=3 22 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 34a_100012001760_100000748629 [0,0,0,0,0,0|3,0,0]=3 23 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 7a_100012001760_100000748629 [0,0,0,0,0,0|3,0,0]=3 24 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 34a_100015326901_100000748629 [0,0,0,0,0,0|3,0,0]=3 25 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 7a_100015326901_100000748629 [0,0,0,0,0,0|3,0,0]=3 26 B14R1.42 C=C(C)CSc1c[nH]c(=O)c(c1)OC 62a_100000748629_100010125397 [0,0,0,0,0,0|3,0,1]=4 27 B14R1.42 C=C(C)CSc1cc(c(cn1)C)OC 62a_100000748629_100010067687 [0,0,0,0,0,0|4,0,0]=4 28 B14R1.42 C=C(C)CSc1cc(c(cn1)C)OC 62a_100010067687_100000211660 [0,0,0,0,0,0|4,0,0]=4 29 B14R1.42 C=C(C)CSc1cc(c(cn1)F)OC 62a_100000748629_200010136270 [0,0,0,0,0,0|4,0,0]=4 30 B14R1.42 C=C(C)CSc1cc(c(cn1)F)OC 62a_200010136270_100000211660 [0,0,0,0,0,0|4,0,0]=4 31 B14R1.42 C=C(C)CSc1cc(c(cn1)N)OC 62a_100000748629_100009887741 [0,0,0,0,0,0|4,0,0]=4 32 B14R1.42 C=C(C)CSc1cc(c(cn1)N)OC 62a_100009887741_100000211660 [0,0,0,0,0,0|4,0,0]=4 33 B14R1.42 C=C(C)CSc1ccc(c(c1)C#N)O 62a_100000748629_100000687585 [0,0,0,0,0,0|4,0,0]=4 34 B14R1.42 C=C(C)CSc1ccc(c(c1)C=O)O 62a_100000748629_100000186750 [0,0,0,0,0,0|4,0,0]=4 35 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)Br 62a_100000748629_100010244631 [0,0,0,0,0,0|4,0,0]=4 36 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)Br 62a_100010244631_100000211660 [0,0,0,0,0,0|4,0,0]=4 37 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)F 62a_100000748629_100010244625 [0,0,0,0,0,0|4,0,0]=4 38 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)F 62a_100010244625_100000211660 [0,0,0,0,0,0|4,0,0]=4 39 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)N 62a_100000686106_100000211660 [0,0,0,0,0,0|4,0,0]=4 40 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)N 62a_100000748629_100000686106 [0,0,0,0,0,0|4,0,0]=4 41 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)O 62a_100000748629_100012338938 [0,0,0,0,0,0|3,0,0]=3 42 B14R1.42 C=C(C)CSc1ccc(c(c1)CN)O 62a_100000730032_100000211660 [0,0,0,0,0,0|4,0,0]=4 43 B14R1.42 C=C(C)CSc1ccc(c(c1)CN)O 62a_100000748629_100000730032 [0,0,0,0,0,0|4,0,0]=4 44 B14R1.42 C=C(C)CSc1ccc(c(c1)CO)O 62a_100000184703_100000211660 [0,0,0,0,0,0|4,0,0]=4 45 B14R1.42 C=C(C)CSc1ccc(c(c1)CO)O 62a_100000748629_100000184703 [0,0,0,0,0,0|4,0,0]=4 46 B14R1.42 C=C(C)CSc1ccc(c(c1)NC)C 62a_100000748629_100020629602 [0,0,0,0,0,0|4,0,0]=4 47 B14R1.42 C=C(C)CSc1ccc(c(c1)NC)C 62a_100020629602_100000211660 [0,0,0,0,0,0|4,0,0]=4 48 B14R1.42 C=C(C)CSc1ccc(c(c1)NC)F 62a_100000748629_100011314990 [0,0,0,0,0,0|4,0,0]=4 49 B14R1.42 C=C(C)CSc1ccc(c(c1)NC)F 62a_100011314990_100000211660 [0,0,0,0,0,0|4,0,0]=4 50 B14R1.42 C=C(C)CSc1ccc(c(c1)NC)N 62a_100000694363_100000211660 [0,0,0,0,0,0|4,0,0]=4 51 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100000748629_100012353699 [0,0,0,0,0,0|3,0,0]=3 52 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000211660 [0,0,0,0,0,0|3,0,0]=3 53 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100000748629_100011830276 [0,0,0,0,0,0|3,0,0]=3 54 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100011830276_100000211660 [0,0,0,0,0,0|3,0,0]=3 55 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100000748629_100011356853 [0,0,0,0,0,0|3,0,0]=3 56 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000211660 [0,0,0,0,0,0|3,0,0]=3 57 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100000748629_100011934186 [0,0,0,0,0,0|3,0,0]=3 58 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100011934186_100000211660 [0,0,0,0,0,0|3,0,0]=3 59 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100000748629_100015196925 [0,0,0,0,0,0|3,0,0]=3 60 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100011279103_100000211660 [0,0,0,0,0,0|3,0,0]=3 61 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)O 62a_100000748629_100000694246 [0,0,0,0,0,0|2,0,0]=2 62 B14R1.42 C=C(C)CSc1ccc(c(c1)SC)F 62a_100000748629_100010341305 [0,0,0,0,0,0|3,1,0]=4 63 B14R1.42 C=C(C)CSc1ccc(c(c1)SC)F 62a_100010341305_100000211660 [0,0,0,0,0,0|3,1,0]=4 64 B14R1.42 C=C(C)CSc1ccc(c(n1)OC)N 62a_100000687816_100000211660 [0,0,0,0,0,0|4,0,0]=4 65 B14R1.42 C=C(C)CSc1ccc(c(n1)OC)N 62a_100000748629_100000687816 [0,0,0,0,0,0|4,0,0]=4 66 B14R1.42 C=C(C)CSc1ccc(c(n1)OC)O 62a_100000748629_100010893133 [0,0,0,0,0,0|3,0,0]=3 67 B14R1.42 C=C(C)CSc1cnc(c(c1)OC)C 62a_100000748629_100010254219 [0,0,0,0,0,0|4,0,0]=4 68 B14R1.42 C=C(C)CSc1cnc(c(c1)OC)C 62a_100010254219_100000211660 [0,0,0,0,0,0|4,0,0]=4 69 B14R1.42 C=C(C)CSc1cnc(c(c1)OC)F 62a_100000748629_100010214931 [0,0,0,0,0,0|4,0,0]=4 70 B14R1.42 C=C(C)CSc1cnc(c(c1)OC)F 62a_100010214931_100000211660 [0,0,0,0,0,0|4,0,0]=4 71 B14R1.42 C=C(C)CSc1cnc(c(c1)OC)N 62a_100000748629_106354213024 [0,0,0,0,0,0|4,0,0]=4 72 B14R1.42 C=C(C)CSc1cnc(c(c1)OC)N 62a_106354213024_100000211660 [0,0,0,0,0,0|4,0,0]=4 73 B14R1.42 C=C(C)CSc1cnc(c(n1)OC)O 62a_100000748629_200010365344 [0,0,0,0,0,0|4,0,0]=4 74 B14R1.42 C=C(C)CSc1cnc(c(n1)OC)O 62a_200010365344_100000211660 [0,0,0,0,0,0|4,0,0]=4 75 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100009893438 [0,0,0,0,0,0|3,0,1]=4 76 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)Br 34a_100000765947_100009893438 [0,0,0,0,0,0|3,0,1]=4 77 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)C 2230a_100011279678_100009893438 [0,0,0,0,0,0|3,0,1]=4 78 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)C 34a_100011279678_100009893438 [0,0,0,0,0,0|3,0,1]=4 79 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100009893438 [0,0,0,0,0,0|3,0,1]=4 80 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100009893438 [0,0,0,0,0,0|3,0,1]=4 81 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)F 2230a_100000701188_100009893438 [0,0,0,0,0,0|3,0,1]=4 82 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)F 34a_100000701188_100009893438 [0,0,0,0,0,0|3,0,1]=4 83 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)I 34a_100000746945_100009893438 [0,0,0,0,0,0|3,0,1]=4 84 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)O 34a_100000726020_100009893438 [0,0,0,0,0,0|2,0,1]=3 85 B14R1.42 C=C(F)COc1ccc(c(c1)OC)Br 34a_100011827694_100009893438 [0,0,0,0,0,0|3,0,1]=4 86 B14R1.42 C=C(F)COc1ccc(c(c1)OC)Br 7a_100011827694_100000042424 [0,0,0,0,0,0|3,0,1]=4 87 B14R1.42 C=C(F)COc1ccc(c(c1)OC)C 34a_100009865632_100009893438 [0,0,0,0,0,0|3,0,1]=4 88 B14R1.42 C=C(F)COc1ccc(c(c1)OC)C 7a_100009865632_100000042424 [0,0,0,0,0,0|3,0,1]=4 89 B14R1.42 C=C(F)COc1ccc(c(c1)OC)Cl 34a_100012186310_100009893438 [0,0,0,0,0,0|3,0,1]=4 90 B14R1.42 C=C(F)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000042424 [0,0,0,0,0,0|3,0,1]=4 91 B14R1.42 C=C(F)COc1ccc(c(c1)OC)F 34a_100012001760_100009893438 [0,0,0,0,0,0|3,0,1]=4 92 B14R1.42 C=C(F)COc1ccc(c(c1)OC)F 7a_100012001760_100000042424 [0,0,0,0,0,0|3,0,1]=4 93 B14R1.42 C=C(F)COc1ccc(c(c1)OC)N 34a_100015326901_100009893438 [0,0,0,0,0,0|3,0,1]=4 94 B14R1.42 C=C(F)COc1ccc(c(c1)OC)N 7a_100015326901_100000042424 [0,0,0,0,0,0|3,0,1]=4 95 B14R1.42 C=C(F)CSc1ccc(c(c1)CC)O 62a_100000042424_100012338938 [0,0,0,0,0,0|3,0,1]=4 96 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)Br 62a_100000042424_100012353699 [0,0,0,0,0,0|3,0,1]=4 97 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000042424 [0,0,0,0,0,0|3,0,1]=4 98 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)C 62a_100000042424_100011830276 [0,0,0,0,0,0|3,0,1]=4 99 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)C 62a_100011830276_100000042424 [0,0,0,0,0,0|3,0,1]=4 100 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)Cl 62a_100000042424_100011356853 [0,0,0,0,0,0|3,0,1]=4 101 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000042424 [0,0,0,0,0,0|3,0,1]=4 102 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)F 62a_100000042424_100011934186 [0,0,0,0,0,0|3,0,1]=4 103 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)F 62a_100011934186_100000042424 [0,0,0,0,0,0|3,0,1]=4 104 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)N 62a_100000042424_100015196925 [0,0,0,0,0,0|3,0,1]=4 105 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)N 62a_100011279103_100000042424 [0,0,0,0,0,0|3,0,1]=4 106 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)O 62a_100000042424_100000694246 [0,0,0,0,0,0|2,0,1]=3 107 B14R1.42 C=C(F)CSc1ccc(c(n1)OC)O 62a_100000042424_100010893133 [0,0,0,0,0,0|3,0,1]=4 108 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)Cl 11a_100009846983_100015343762 [0,0,0,0,0,0|4,0,0]=4 109 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)Cl 1626a_100009846983_100015343762 [0,0,0,0,0,0|4,0,0]=4 110 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)Cl 240690a_100009846983_100015343762 [0,0,0,0,0,0|4,0,0]=4 111 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)Cl 527a_100009846983_100103153847 [0,0,0,0,0,0|4,0,0]=4 112 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)F 11a_100016992121_100015343762 [0,0,0,0,0,0|4,0,0]=4 113 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)F 1626a_100016992121_100015343762 [0,0,0,0,0,0|4,0,0]=4 114 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)F 240690a_100016992121_100015343762 [0,0,0,0,0,0|4,0,0]=4 115 B14R1.42 CC(=O)NCc1ccc(c(c1)C#N)F 527a_100016992121_100103153847 [0,0,0,0,0,0|4,0,0]=4 116 B14R1.42 CCc1cc(ccc1Br)NCC(=O)N 2230a_100010109747_100000747473 [0,0,0,0,0,0|4,0,0]=4 117 B14R1.42 CCc1cc(ccc1Br)NCC(=O)N 34a_100010109747_100000187820 [0,0,0,0,0,0|4,0,0]=4 118 B14R1.42 CCc1cc(ccc1Br)NCC(=O)N 7a_100010109747_100000187820 [0,0,0,0,0,0|4,0,0]=4 119 B14R1.42 CCc1cc(ccc1Br)NCC(=O)[O-] 34a_100010109747_100020667443 [0,0,0,0,0,0|4,0,0]=4 120 B14R1.42 CCc1cc(ccc1Br)SCC(=O)N 62a_100000747473_100010244631 [0,0,0,0,0,0|4,0,0]=4 121 B14R1.42 CCc1cc(ccc1Br)SCC(=O)N 62a_100010244631_100000747473 [0,0,0,0,0,0|4,0,0]=4 122 B14R1.42 CCc1cc(ccc1Br)SCC(=O)[O-] 62a_100010244631_100020667443 [0,0,0,0,0,0|4,0,0]=4 123 B14R1.42 CCc1cc(ccc1Br)SCC(=O)[O-] 62a_100020667443_100010244631 [0,0,0,0,0,0|4,0,0]=4 124 B14R1.42 CCc1cc(ccc1Cl)OCC(=O)N 34a_100000212063_100000187820 [0,0,0,0,0,0|4,0,0]=4 125 B14R1.42 CCc1cc(ccc1Cl)OCC(=O)N 7a_100000212063_100000187820 [0,0,0,0,0,0|4,0,0]=4 126 B14R1.42 CCc1cc(ccc1Cl)OCC(=O)[O-] 34a_100000212063_100020667443 [0,0,0,0,0,0|4,0,0]=4 127 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 11a_114873767189_100015343762 [0,0,0,0,0,0|3,0,0]=3 128 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 1626a_114873767189_100015343762 [0,0,0,0,0,0|3,0,0]=3 129 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 240690a_114873767189_100015343762 [0,0,0,0,0,0|3,0,0]=3 130 B14R1.42 CCc1cc(ccc1F)CNC(=O)C 527a_114873767189_100103153847 [0,0,0,0,0,0|3,0,0]=3 131 B14R1.42 CCc1cc(ccc1F)SCC(=O)N 62a_100000747473_100010244625 [0,0,0,0,0,0|4,0,0]=4 132 B14R1.42 CCc1cc(ccc1F)SCC(=O)N 62a_100010244625_100000747473 [0,0,0,0,0,0|4,0,0]=4 133 B14R1.42 CCc1cc(ccc1F)SCC(=O)[O-] 62a_100010244625_100020667443 [0,0,0,0,0,0|4,0,0]=4 134 B14R1.42 CCc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100010244625 [0,0,0,0,0,0|4,0,0]=4 135 B14R1.42 CCc1cc(ccc1N)SCC(=O)N 62a_100000686106_100000747473 [0,0,0,0,0,0|4,0,0]=4 136 B14R1.42 CCc1cc(ccc1N)SCC(=O)N 62a_100000747473_100000686106 [0,0,0,0,0,0|4,0,0]=4 137 B14R1.42 CCc1cc(ccc1N)SCC(=O)[O-] 62a_100000686106_100020667443 [0,0,0,0,0,0|4,0,0]=4 138 B14R1.42 CCc1cc(ccc1N)SCC(=O)[O-] 62a_100020667443_100000686106 [0,0,0,0,0,0|4,0,0]=4 139 B14R1.42 CCc1cc(ccc1O)SCC(=O)N 62a_100000747473_100012338938 [0,0,0,0,0,0|3,0,0]=3 140 B14R1.42 CCc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100012338938 [0,0,0,0,0,0|3,0,0]=3 141 B14R1.42 CCc1cc(ccc1O)SCC(C)C 62a_100000210624_100012338938 [0,0,0,0,0,0|3,0,1]=4 142 B14R1.42 CCc1cc(ccc1O)SCC(C)O 62a_100011218427_100012338938 [0,0,0,0,0,0|2,0,2]=4 143 B14R1.42 CCc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100012338938 [0,0,0,0,0,0|2,0,2]=4 144 B14R1.42 CNc1cc(ccc1C)SCC(=O)N 62a_100000747473_100020629602 [0,0,0,0,0,0|4,0,0]=4 145 B14R1.42 CNc1cc(ccc1C)SCC(=O)N 62a_100020629602_100000747473 [0,0,0,0,0,0|4,0,0]=4 146 B14R1.42 CNc1cc(ccc1C)SCC(=O)[O-] 62a_100020629602_100020667443 [0,0,0,0,0,0|4,0,0]=4 147 B14R1.42 CNc1cc(ccc1C)SCC(=O)[O-] 62a_100020667443_100020629602 [0,0,0,0,0,0|4,0,0]=4 148 B14R1.42 CNc1cc(ccc1F)SCC(=O)N 62a_100000747473_100011314990 [0,0,0,0,0,0|4,0,0]=4 149 B14R1.42 CNc1cc(ccc1F)SCC(=O)N 62a_100011314990_100000747473 [0,0,0,0,0,0|4,0,0]=4 150 B14R1.42 CNc1cc(ccc1F)SCC(=O)[O-] 62a_100011314990_100020667443 [0,0,0,0,0,0|4,0,0]=4 151 B14R1.42 CNc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100011314990 [0,0,0,0,0,0|4,0,0]=4 152 B14R1.42 CNc1cc(ccc1N)SCC(=O)N 62a_100000694363_100000747473 [0,0,0,0,0,0|4,0,0]=4 153 B14R1.42 CNc1cc(ccc1N)SCC(=O)[O-] 62a_100000694363_100020667443 [0,0,0,0,0,0|4,0,0]=4 154 B14R1.42 COc1cc(c[nH]c1=O)SCC(=O)N 62a_100000747473_100010125397 [0,0,0,0,0,0|3,0,1]=4 155 B14R1.42 COc1cc(c[nH]c1=O)SCC(=O)[O-] 62a_100020667443_100010125397 [0,0,0,0,0,0|3,0,1]=4 156 B14R1.42 COc1cc(ccc1Br)C=CC(=O)C 1458a_100016267305_200000210301 [0,0,0,0,0,0|1,0,2]=3 157 B14R1.42 COc1cc(ccc1Br)C=CC(=O)[13CH3] 1458a_100016267305_200025704644 [0,0,0,0,0,0|1,0,2]=3 158 B14R1.42 COc1cc(ccc1Br)CNC(C)C 207a_100138425928_100010244714 [0,0,0,0,0,0|3,0,1]=4 159 B14R1.42 COc1cc(ccc1Br)CNC(C)C 2230a_100138425928_100010110085 [0,0,0,0,0,0|3,0,1]=4 160 B14R1.42 COc1cc(ccc1Br)CNC(C)C 34a_100138425928_100010110085 [0,0,0,0,0,0|3,0,1]=4 161 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100000212225_100010110085 [0,0,0,0,0,0|3,0,1]=4 162 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100010234685_100000210206 [0,0,0,0,0,0|3,0,1]=4 163 B14R1.42 COc1cc(ccc1Br)COC(C)C 7a_100010234685_100000210206 [0,0,0,0,0,0|3,0,1]=4 164 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100000210206_100010110085 [0,0,0,0,0,0|3,0,1]=4 165 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100010110085_100000210206 [0,0,0,0,0,0|3,0,1]=4 166 B14R1.42 COc1cc(ccc1Br)NCC(=O)N 2230a_100000765947_100000747473 [0,0,0,0,0,0|3,0,0]=3 167 B14R1.42 COc1cc(ccc1Br)NCC(=O)N 34a_100000765947_100000187820 [0,0,0,0,0,0|3,0,0]=3 168 B14R1.42 COc1cc(ccc1Br)NCC(=O)[O-] 34a_100000765947_100020667443 [0,0,0,0,0,0|3,0,0]=3 169 B14R1.42 COc1cc(ccc1Br)NCC(C)C 2230a_100000765947_100000210760 [0,0,0,0,0,0|3,0,1]=4 170 B14R1.42 COc1cc(ccc1Br)NCC(C)C 34a_100000765947_100000210624 [0,0,0,0,0,0|3,0,1]=4 171 B14R1.42 COc1cc(ccc1Br)NCC(C)O 2230a_100000765947_100011218427 [0,0,0,0,0,0|2,0,2]=4 172 B14R1.42 COc1cc(ccc1Br)NCC(C)O 34a_100000765947_100011218427 [0,0,0,0,0,0|2,0,2]=4 173 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 2230a_100000765947_100009817552 [0,0,0,0,0,0|2,0,2]=4 174 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 34a_100000765947_100009817552 [0,0,0,0,0,0|2,0,2]=4 175 B14R1.42 COc1cc(ccc1Br)NC[N+](=O)[O-] 34a_100000765947_100000761209 [0,0,0,0,0,0|4,0,0]=4 176 B14R1.42 COc1cc(ccc1Br)OCC(=O)N 34a_100011827694_100000187820 [0,0,0,0,0,0|3,0,0]=3 177 B14R1.42 COc1cc(ccc1Br)OCC(=O)N 7a_100011827694_100000187820 [0,0,0,0,0,0|3,0,0]=3 178 B14R1.42 COc1cc(ccc1Br)OCC(=O)[O-] 34a_100011827694_100020667443 [0,0,0,0,0,0|3,0,0]=3 179 B14R1.42 COc1cc(ccc1Br)OCC(C)C 34a_100011827694_100000210624 [0,0,0,0,0,0|3,0,1]=4 180 B14R1.42 COc1cc(ccc1Br)OCC(C)C 7a_100011827694_100000210760 [0,0,0,0,0,0|3,0,1]=4 181 B14R1.42 COc1cc(ccc1Br)OCC(C)O 34a_100011827694_100011218427 [0,0,0,0,0,0|2,0,2]=4 182 B14R1.42 COc1cc(ccc1Br)OCC(C)O 7a_100011827694_100011218427 [0,0,0,0,0,0|2,0,2]=4 183 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 34a_100011827694_100009817552 [0,0,0,0,0,0|2,0,2]=4 184 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 7a_100011827694_100009817552 [0,0,0,0,0,0|2,0,2]=4 185 B14R1.42 COc1cc(ccc1Br)OC[N+](=O)[O-] 34a_100011827694_100000761209 [0,0,0,0,0,0|4,0,0]=4 186 B14R1.42 COc1cc(ccc1Br)SCC(=O)N 62a_100000747473_100012353699 [0,0,0,0,0,0|3,0,0]=3 187 B14R1.42 COc1cc(ccc1Br)SCC(=O)N 62a_100012353699_100000747473 [0,0,0,0,0,0|3,0,0]=3 188 B14R1.42 COc1cc(ccc1Br)SCC(=O)[O-] 62a_100012353699_100020667443 [0,0,0,0,0,0|3,0,0]=3 189 B14R1.42 COc1cc(ccc1Br)SCC(=O)[O-] 62a_100020667443_100012353699 [0,0,0,0,0,0|3,0,0]=3 190 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100000210624_100012353699 [0,0,0,0,0,0|3,0,1]=4 191 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100012353699_100000210760 [0,0,0,0,0,0|3,0,1]=4 192 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100011218427_100012353699 [0,0,0,0,0,0|2,0,2]=4 193 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100012353699_100011218427 [0,0,0,0,0,0|2,0,2]=4 194 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_100012353699 [0,0,0,0,0,0|2,0,2]=4 195 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100012353699_100009817552 [0,0,0,0,0,0|2,0,2]=4 196 B14R1.42 COc1cc(ccc1Br)SC[N+](=O)[O-] 62a_100012353699_100000761209 [0,0,0,0,0,0|4,0,0]=4 197 B14R1.42 COc1cc(ccc1C)CCC(=O)C 1458a_200000066385_200000210301 [0,0,0,0,0,0|1,0,0]=1 198 B14R1.42 COc1cc(ccc1C)CCC(=O)[13CH3] 1458a_200000066385_200025704644 [0,0,0,0,0,0|1,0,0]=1 199 B14R1.42 COc1cc(ccc1C)CNC(C)C 207a_100138425928_100000719150 [0,0,0,0,0,0|3,0,1]=4 200 B14R1.42 COc1cc(ccc1C)COC(C)C 34a_100000752651_100000210206 [0,0,0,0,0,0|3,0,1]=4 201 B14R1.42 COc1cc(ccc1C)COC(C)C 7a_100000752651_100000210206 [0,0,0,0,0,0|3,0,1]=4 202 B14R1.42 COc1cc(ccc1C)NCC(=O)N 2230a_100011279678_100000747473 [0,0,0,0,0,0|3,0,0]=3 203 B14R1.42 COc1cc(ccc1C)NCC(=O)N 34a_100011279678_100000187820 [0,0,0,0,0,0|3,0,0]=3 204 B14R1.42 COc1cc(ccc1C)NCC(=O)[O-] 34a_100011279678_100020667443 [0,0,0,0,0,0|3,0,0]=3 205 B14R1.42 COc1cc(ccc1C)NCC(C)C 2230a_100011279678_100000210760 [0,0,0,0,0,0|3,0,1]=4 206 B14R1.42 COc1cc(ccc1C)NCC(C)C 34a_100011279678_100000210624 [0,0,0,0,0,0|3,0,1]=4 207 B14R1.42 COc1cc(ccc1C)NCC(C)O 2230a_100011279678_100011218427 [0,0,0,0,0,0|2,0,2]=4 208 B14R1.42 COc1cc(ccc1C)NCC(C)O 34a_100011279678_100011218427 [0,0,0,0,0,0|2,0,2]=4 209 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 2230a_100011279678_100009817552 [0,0,0,0,0,0|2,0,2]=4 210 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 34a_100011279678_100009817552 [0,0,0,0,0,0|2,0,2]=4 211 B14R1.42 COc1cc(ccc1C)NC[N+](=O)[O-] 34a_100011279678_100000761209 [0,0,0,0,0,0|4,0,0]=4 212 B14R1.42 COc1cc(ccc1C)OCC(=O)N 34a_100009865632_100000187820 [0,0,0,0,0,0|3,0,0]=3 213 B14R1.42 COc1cc(ccc1C)OCC(=O)N 7a_100009865632_100000187820 [0,0,0,0,0,0|3,0,0]=3 214 B14R1.42 COc1cc(ccc1C)OCC(=O)[O-] 34a_100009865632_100020667443 [0,0,0,0,0,0|3,0,0]=3 215 B14R1.42 COc1cc(ccc1C)OCC(C)C 34a_100009865632_100000210624 [0,0,0,0,0,0|3,0,1]=4 216 B14R1.42 COc1cc(ccc1C)OCC(C)C 7a_100009865632_100000210760 [0,0,0,0,0,0|3,0,1]=4 217 B14R1.42 COc1cc(ccc1C)OCC(C)O 34a_100009865632_100011218427 [0,0,0,0,0,0|2,0,2]=4 218 B14R1.42 COc1cc(ccc1C)OCC(C)O 7a_100009865632_100011218427 [0,0,0,0,0,0|2,0,2]=4 219 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 34a_100009865632_100009817552 [0,0,0,0,0,0|2,0,2]=4 220 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 7a_100009865632_100009817552 [0,0,0,0,0,0|2,0,2]=4 221 B14R1.42 COc1cc(ccc1C)OC[N+](=O)[O-] 34a_100009865632_100000761209 [0,0,0,0,0,0|4,0,0]=4 222 B14R1.42 COc1cc(ccc1C)SCC(=O)N 62a_100000747473_100011830276 [0,0,0,0,0,0|3,0,0]=3 223 B14R1.42 COc1cc(ccc1C)SCC(=O)N 62a_100011830276_100000747473 [0,0,0,0,0,0|3,0,0]=3 224 B14R1.42 COc1cc(ccc1C)SCC(=O)[O-] 62a_100011830276_100020667443 [0,0,0,0,0,0|3,0,0]=3 225 B14R1.42 COc1cc(ccc1C)SCC(=O)[O-] 62a_100020667443_100011830276 [0,0,0,0,0,0|3,0,0]=3 226 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100000210624_100011830276 [0,0,0,0,0,0|3,0,1]=4 227 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100011830276_100000210760 [0,0,0,0,0,0|3,0,1]=4 228 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011218427_100011830276 [0,0,0,0,0,0|2,0,2]=4 229 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011830276_100011218427 [0,0,0,0,0,0|2,0,2]=4 230 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100011830276 [0,0,0,0,0,0|2,0,2]=4 231 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100011830276_100009817552 [0,0,0,0,0,0|2,0,2]=4 232 B14R1.42 COc1cc(ccc1C)SC[N+](=O)[O-] 62a_100011830276_100000761209 [0,0,0,0,0,0|4,0,0]=4 233 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 11a_100015204853_100015343762 [0,0,0,0,0,0|2,0,0]=2 234 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 1626a_100015204853_100015343762 [0,0,0,0,0,0|2,0,0]=2 235 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 240690a_100015204853_100015343762 [0,0,0,0,0,0|2,0,0]=2 236 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 527a_100015204853_100103153847 [0,0,0,0,0,0|2,0,0]=2 237 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 207a_100138425928_100011998524 [0,0,0,0,0,0|3,0,1]=4 238 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100015204853_100000210206 [0,0,0,0,0,0|3,0,1]=4 239 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100138425928_200010214485 [0,0,0,0,0,0|3,0,1]=4 240 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100015204853_100000210206 [0,0,0,0,0,0|3,0,1]=4 241 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100138425928_200010214485 [0,0,0,0,0,0|3,0,1]=4 242 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100000212225_200010214485 [0,0,0,0,0,0|3,0,1]=4 243 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100012179228_100000210206 [0,0,0,0,0,0|3,0,1]=4 244 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_100000210206_200010214485 [0,0,0,0,0,0|3,0,1]=4 245 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_200010214485_100000210206 [0,0,0,0,0,0|3,0,1]=4 246 B14R1.42 COc1cc(ccc1Cl)NCC(=O)N 2230a_100000742311_100000747473 [0,0,0,0,0,0|3,0,0]=3 247 B14R1.42 COc1cc(ccc1Cl)NCC(=O)N 34a_100000742311_100000187820 [0,0,0,0,0,0|3,0,0]=3 248 B14R1.42 COc1cc(ccc1Cl)NCC(=O)[O-] 34a_100000742311_100020667443 [0,0,0,0,0,0|3,0,0]=3 249 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 2230a_100000742311_100000210760 [0,0,0,0,0,0|3,0,1]=4 250 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 34a_100000742311_100000210624 [0,0,0,0,0,0|3,0,1]=4 251 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 2230a_100000742311_100011218427 [0,0,0,0,0,0|2,0,2]=4 252 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 34a_100000742311_100011218427 [0,0,0,0,0,0|2,0,2]=4 253 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 2230a_100000742311_100009817552 [0,0,0,0,0,0|2,0,2]=4 254 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 34a_100000742311_100009817552 [0,0,0,0,0,0|2,0,2]=4 255 B14R1.42 COc1cc(ccc1Cl)NC[N+](=O)[O-] 34a_100000742311_100000761209 [0,0,0,0,0,0|4,0,0]=4 256 B14R1.42 COc1cc(ccc1Cl)OCC(=O)N 34a_100012186310_100000187820 [0,0,0,0,0,0|3,0,0]=3 257 B14R1.42 COc1cc(ccc1Cl)OCC(=O)N 7a_100012186310_100000187820 [0,0,0,0,0,0|3,0,0]=3 258 B14R1.42 COc1cc(ccc1Cl)OCC(=O)[O-] 34a_100012186310_100020667443 [0,0,0,0,0,0|3,0,0]=3 259 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 34a_100012186310_100000210624 [0,0,0,0,0,0|3,0,1]=4 260 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 7a_100012186310_100000210760 [0,0,0,0,0,0|3,0,1]=4 261 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 34a_100012186310_100011218427 [0,0,0,0,0,0|2,0,2]=4 262 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 7a_100012186310_100011218427 [0,0,0,0,0,0|2,0,2]=4 263 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 34a_100012186310_100009817552 [0,0,0,0,0,0|2,0,2]=4 264 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 7a_100012186310_100009817552 [0,0,0,0,0,0|2,0,2]=4 265 B14R1.42 COc1cc(ccc1Cl)OC[N+](=O)[O-] 34a_100012186310_100000761209 [0,0,0,0,0,0|4,0,0]=4 266 B14R1.42 COc1cc(ccc1Cl)SCC(=O)N 62a_100000747473_100011356853 [0,0,0,0,0,0|3,0,0]=3 267 B14R1.42 COc1cc(ccc1Cl)SCC(=O)N 62a_100011356853_100000747473 [0,0,0,0,0,0|3,0,0]=3 268 B14R1.42 COc1cc(ccc1Cl)SCC(=O)[O-] 62a_100011356853_100020667443 [0,0,0,0,0,0|3,0,0]=3 269 B14R1.42 COc1cc(ccc1Cl)SCC(=O)[O-] 62a_100020667443_100011356853 [0,0,0,0,0,0|3,0,0]=3 270 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100000210624_100011356853 [0,0,0,0,0,0|3,0,1]=4 271 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100011356853_100000210760 [0,0,0,0,0,0|3,0,1]=4 272 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011218427_100011356853 [0,0,0,0,0,0|2,0,2]=4 273 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011356853_100011218427 [0,0,0,0,0,0|2,0,2]=4 274 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100009817552_100011356853 [0,0,0,0,0,0|2,0,2]=4 275 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100011356853_100009817552 [0,0,0,0,0,0|2,0,2]=4 276 B14R1.42 COc1cc(ccc1Cl)SC[N+](=O)[O-] 62a_100011356853_100000761209 [0,0,0,0,0,0|4,0,0]=4 277 B14R1.42 COc1cc(ccc1F)CCC(=O)C 1458a_100009849056_200000210301 [0,0,0,0,0,0|1,0,0]=1 278 B14R1.42 COc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100009849056_200025704644 [0,0,0,0,0,0|1,0,0]=1 279 B14R1.42 COc1cc(ccc1F)CNC(=O)C 11a_100020626639_100015343762 [0,0,0,0,0,0|2,0,0]=2 280 B14R1.42 COc1cc(ccc1F)CNC(=O)C 1626a_100020626639_100015343762 [0,0,0,0,0,0|2,0,0]=2 281 B14R1.42 COc1cc(ccc1F)CNC(=O)C 240690a_100020626639_100015343762 [0,0,0,0,0,0|2,0,0]=2 282 B14R1.42 COc1cc(ccc1F)CNC(=O)C 527a_100020626639_100103153847 [0,0,0,0,0,0|2,0,0]=2 283 B14R1.42 COc1cc(ccc1F)CNC(C)C 207a_100138425928_100000692873 [0,0,0,0,0,0|3,0,1]=4 284 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100020626639_100000210206 [0,0,0,0,0,0|3,0,1]=4 285 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100138425928_100012349856 [0,0,0,0,0,0|3,0,1]=4 286 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100020626639_100000210206 [0,0,0,0,0,0|3,0,1]=4 287 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100138425928_100012349856 [0,0,0,0,0,0|3,0,1]=4 288 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000212225_100012349856 [0,0,0,0,0,0|3,0,1]=4 289 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000692429_100000210206 [0,0,0,0,0,0|3,0,1]=4 290 B14R1.42 COc1cc(ccc1F)COC(C)C 7a_100000692429_100000210206 [0,0,0,0,0,0|3,0,1]=4 291 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100000210206_100012349856 [0,0,0,0,0,0|3,0,1]=4 292 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100012349856_100000210206 [0,0,0,0,0,0|3,0,1]=4 293 B14R1.42 COc1cc(ccc1F)NCC(=O)N 2230a_100000701188_100000747473 [0,0,0,0,0,0|3,0,0]=3 294 B14R1.42 COc1cc(ccc1F)NCC(=O)N 34a_100000701188_100000187820 [0,0,0,0,0,0|3,0,0]=3 295 B14R1.42 COc1cc(ccc1F)NCC(=O)[O-] 34a_100000701188_100020667443 [0,0,0,0,0,0|3,0,0]=3 296 B14R1.42 COc1cc(ccc1F)NCC(C)C 2230a_100000701188_100000210760 [0,0,0,0,0,0|3,0,1]=4 297 B14R1.42 COc1cc(ccc1F)NCC(C)C 34a_100000701188_100000210624 [0,0,0,0,0,0|3,0,1]=4 298 B14R1.42 COc1cc(ccc1F)NCC(C)O 2230a_100000701188_100011218427 [0,0,0,0,0,0|2,0,2]=4 299 B14R1.42 COc1cc(ccc1F)NCC(C)O 34a_100000701188_100011218427 [0,0,0,0,0,0|2,0,2]=4 300 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 2230a_100000701188_100009817552 [0,0,0,0,0,0|2,0,2]=4 301 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 34a_100000701188_100009817552 [0,0,0,0,0,0|2,0,2]=4 302 B14R1.42 COc1cc(ccc1F)NC[N+](=O)[O-] 34a_100000701188_100000761209 [0,0,0,0,0,0|4,0,0]=4 303 B14R1.42 COc1cc(ccc1F)NNC(=O)C 22a_102515433066_100000070787 [0,0,0,0,0,0|3,0,0]=3 304 B14R1.42 COc1cc(ccc1F)OCC(=O)N 34a_100012001760_100000187820 [0,0,0,0,0,0|3,0,0]=3 305 B14R1.42 COc1cc(ccc1F)OCC(=O)N 7a_100012001760_100000187820 [0,0,0,0,0,0|3,0,0]=3 306 B14R1.42 COc1cc(ccc1F)OCC(=O)[O-] 34a_100012001760_100020667443 [0,0,0,0,0,0|3,0,0]=3 307 B14R1.42 COc1cc(ccc1F)OCC(C)C 34a_100012001760_100000210624 [0,0,0,0,0,0|3,0,1]=4 308 B14R1.42 COc1cc(ccc1F)OCC(C)C 7a_100012001760_100000210760 [0,0,0,0,0,0|3,0,1]=4 309 B14R1.42 COc1cc(ccc1F)OCC(C)O 34a_100012001760_100011218427 [0,0,0,0,0,0|2,0,2]=4 310 B14R1.42 COc1cc(ccc1F)OCC(C)O 7a_100012001760_100011218427 [0,0,0,0,0,0|2,0,2]=4 311 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 34a_100012001760_100009817552 [0,0,0,0,0,0|2,0,2]=4 312 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 7a_100012001760_100009817552 [0,0,0,0,0,0|2,0,2]=4 313 B14R1.42 COc1cc(ccc1F)OC[N+](=O)[O-] 34a_100012001760_100000761209 [0,0,0,0,0,0|4,0,0]=4 314 B14R1.42 COc1cc(ccc1F)SCC(=O)N 62a_100000747473_100011934186 [0,0,0,0,0,0|3,0,0]=3 315 B14R1.42 COc1cc(ccc1F)SCC(=O)N 62a_100011934186_100000747473 [0,0,0,0,0,0|3,0,0]=3 316 B14R1.42 COc1cc(ccc1F)SCC(=O)[O-] 62a_100011934186_100020667443 [0,0,0,0,0,0|3,0,0]=3 317 B14R1.42 COc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100011934186 [0,0,0,0,0,0|3,0,0]=3 318 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100000210624_100011934186 [0,0,0,0,0,0|3,0,1]=4 319 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100011934186_100000210760 [0,0,0,0,0,0|3,0,1]=4 320 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011218427_100011934186 [0,0,0,0,0,0|2,0,2]=4 321 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011934186_100011218427 [0,0,0,0,0,0|2,0,2]=4 322 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100011934186 [0,0,0,0,0,0|2,0,2]=4 323 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100011934186_100009817552 [0,0,0,0,0,0|2,0,2]=4 324 B14R1.42 COc1cc(ccc1F)SC[N+](=O)[O-] 62a_100011934186_100000761209 [0,0,0,0,0,0|4,0,0]=4 325 B14R1.42 COc1cc(ccc1I)NCC(=O)N 34a_100000746945_100000187820 [0,0,0,0,0,0|3,0,0]=3 326 B14R1.42 COc1cc(ccc1I)NCC(=O)[O-] 34a_100000746945_100020667443 [0,0,0,0,0,0|3,0,0]=3 327 B14R1.42 COc1cc(ccc1I)NCC(C)C 34a_100000746945_100000210624 [0,0,0,0,0,0|3,0,1]=4 328 B14R1.42 COc1cc(ccc1I)NCC(C)O 34a_100000746945_100011218427 [0,0,0,0,0,0|2,0,2]=4 329 B14R1.42 COc1cc(ccc1I)NC[C@@H](C)O 34a_100000746945_100009817552 [0,0,0,0,0,0|2,0,2]=4 330 B14R1.42 COc1cc(ccc1I)NC[N+](=O)[O-] 34a_100000746945_100000761209 [0,0,0,0,0,0|4,0,0]=4 331 B14R1.42 COc1cc(ccc1N)COC(C)C 34a_100000087641_100000210206 [0,0,0,0,0,0|3,0,1]=4 332 B14R1.42 COc1cc(ccc1N)OCC(=O)N 34a_100015326901_100000187820 [0,0,0,0,0,0|3,0,0]=3 333 B14R1.42 COc1cc(ccc1N)OCC(=O)N 7a_100015326901_100000187820 [0,0,0,0,0,0|3,0,0]=3 334 B14R1.42 COc1cc(ccc1N)OCC(=O)[O-] 34a_100015326901_100020667443 [0,0,0,0,0,0|3,0,0]=3 335 B14R1.42 COc1cc(ccc1N)OCC(C)C 34a_100015326901_100000210624 [0,0,0,0,0,0|3,0,1]=4 336 B14R1.42 COc1cc(ccc1N)OCC(C)C 7a_100015326901_100000210760 [0,0,0,0,0,0|3,0,1]=4 337 B14R1.42 COc1cc(ccc1N)OCC(C)O 34a_100015326901_100011218427 [0,0,0,0,0,0|2,0,2]=4 338 B14R1.42 COc1cc(ccc1N)OCC(C)O 7a_100015326901_100011218427 [0,0,0,0,0,0|2,0,2]=4 339 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 34a_100015326901_100009817552 [0,0,0,0,0,0|2,0,2]=4 340 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 7a_100015326901_100009817552 [0,0,0,0,0,0|2,0,2]=4 341 B14R1.42 COc1cc(ccc1N)OC[N+](=O)[O-] 34a_100015326901_100000761209 [0,0,0,0,0,0|4,0,0]=4 342 B14R1.42 COc1cc(ccc1N)SCC(=O)N 62a_100000747473_100015196925 [0,0,0,0,0,0|3,0,0]=3 343 B14R1.42 COc1cc(ccc1N)SCC(=O)N 62a_100011279103_100000747473 [0,0,0,0,0,0|3,0,0]=3 344 B14R1.42 COc1cc(ccc1N)SCC(=O)[O-] 62a_100011279103_100020667443 [0,0,0,0,0,0|3,0,0]=3 345 B14R1.42 COc1cc(ccc1N)SCC(=O)[O-] 62a_100020667443_100015196925 [0,0,0,0,0,0|3,0,0]=3 346 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100000210624_100015196925 [0,0,0,0,0,0|3,0,1]=4 347 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100011279103_100000210760 [0,0,0,0,0,0|3,0,1]=4 348 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011218427_100015196925 [0,0,0,0,0,0|2,0,2]=4 349 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011279103_100011218427 [0,0,0,0,0,0|2,0,2]=4 350 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100009817552_100015196925 [0,0,0,0,0,0|2,0,2]=4 351 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100011279103_100009817552 [0,0,0,0,0,0|2,0,2]=4 352 B14R1.42 COc1cc(ccc1N)SC[N+](=O)[O-] 62a_100011279103_100000761209 [0,0,0,0,0,0|4,0,0]=4 353 B14R1.42 COc1cc(ccc1O)C=CC(=O)C 1458a_100000182119_200000210301 [0,0,0,0,0,0|0,0,2]=2 354 B14R1.42 COc1cc(ccc1O)C=CC(=O)[13CH3] 1458a_100000182119_200025704644 [0,0,0,0,0,0|0,0,2]=2 355 B14R1.42 COc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000694246 [0,0,0,0,0,0|1,0,3]=4 356 B14R1.42 COc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000694246 [0,0,0,0,0,0|0,0,4]=4 357 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [0,0,0,0,0,0|0,0,0]=0 358 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [0,0,0,0,0,0|0,0,0]=0 359 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [0,0,0,0,0,0|0,0,0]=0 360 B14R1.42 COc1cc(ccc1O)CCN(C)C 2230a_100102631434_100010741665 [0,0,0,0,0,0|2,0,0]=2 361 B14R1.42 COc1cc(ccc1O)CCN(C)C 269982a_100102631434_100010741665 [0,0,0,0,0,0|2,0,0]=2 362 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [0,0,0,0,0,0|1,0,0]=1 363 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [0,0,0,0,0,0|1,0,0]=1 364 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [0,0,0,0,0,0|1,0,0]=1 365 B14R1.42 COc1cc(ccc1O)CNC(C)C 34a_100000185554_100000210206 [0,0,0,0,0,0|2,0,1]=3 366 B14R1.42 COc1cc(ccc1O)NCC(=O)N 34a_100000726020_100000187820 [0,0,0,0,0,0|2,0,0]=2 367 B14R1.42 COc1cc(ccc1O)NCC(=O)[O-] 34a_100000726020_100020667443 [0,0,0,0,0,0|2,0,0]=2 368 B14R1.42 COc1cc(ccc1O)NCC(C)C 34a_100000726020_100000210624 [0,0,0,0,0,0|2,0,1]=3 369 B14R1.42 COc1cc(ccc1O)NCC(C)O 34a_100000726020_100011218427 [0,0,0,0,0,0|1,0,2]=3 370 B14R1.42 COc1cc(ccc1O)NCC(F)F 34a_100000726020_100011934356 [0,0,0,0,0,0|3,0,1]=4 371 B14R1.42 COc1cc(ccc1O)NC[C@@H](C)O 34a_100000726020_100009817552 [0,0,0,0,0,0|1,0,2]=3 372 B14R1.42 COc1cc(ccc1O)NC[N+](=O)[O-] 34a_100000726020_100000761209 [0,0,0,0,0,0|3,0,0]=3 373 B14R1.42 COc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000694246 [0,0,0,0,0,0|2,0,0]=2 374 B14R1.42 COc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000694246 [0,0,0,0,0,0|2,0,0]=2 375 B14R1.42 COc1cc(ccc1O)SCC(C)C 62a_100000210624_100000694246 [0,0,0,0,0,0|2,0,1]=3 376 B14R1.42 COc1cc(ccc1O)SCC(C)O 62a_100011218427_100000694246 [0,0,0,0,0,0|1,0,2]=3 377 B14R1.42 COc1cc(ccc1O)SCC(F)F 62a_100011934356_100000694246 [0,0,0,0,0,0|3,0,1]=4 378 B14R1.42 COc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000694246 [0,0,0,0,0,0|1,0,2]=3 379 B14R1.42 COc1cc(cnc1C)SCC(=O)N 62a_100000747473_100010254219 [0,0,0,0,0,0|4,0,0]=4 380 B14R1.42 COc1cc(cnc1C)SCC(=O)N 62a_100010254219_100000747473 [0,0,0,0,0,0|4,0,0]=4 381 B14R1.42 COc1cc(cnc1C)SCC(=O)[O-] 62a_100010254219_100020667443 [0,0,0,0,0,0|4,0,0]=4 382 B14R1.42 COc1cc(cnc1C)SCC(=O)[O-] 62a_100020667443_100010254219 [0,0,0,0,0,0|4,0,0]=4 383 B14R1.42 COc1cc(cnc1F)SCC(=O)N 62a_100000747473_100010214931 [0,0,0,0,0,0|4,0,0]=4 384 B14R1.42 COc1cc(cnc1F)SCC(=O)N 62a_100010214931_100000747473 [0,0,0,0,0,0|4,0,0]=4 385 B14R1.42 COc1cc(cnc1F)SCC(=O)[O-] 62a_100010214931_100020667443 [0,0,0,0,0,0|4,0,0]=4 386 B14R1.42 COc1cc(cnc1F)SCC(=O)[O-] 62a_100020667443_100010214931 [0,0,0,0,0,0|4,0,0]=4 387 B14R1.42 COc1cc(cnc1N)SCC(=O)N 62a_100000747473_106354213024 [0,0,0,0,0,0|4,0,0]=4 388 B14R1.42 COc1cc(cnc1N)SCC(=O)N 62a_106354213024_100000747473 [0,0,0,0,0,0|4,0,0]=4 389 B14R1.42 COc1cc(cnc1N)SCC(=O)[O-] 62a_100020667443_106354213024 [0,0,0,0,0,0|4,0,0]=4 390 B14R1.42 COc1cc(cnc1N)SCC(=O)[O-] 62a_106354213024_100020667443 [0,0,0,0,0,0|4,0,0]=4 391 B14R1.42 COc1cc(ncc1C)SCC(=O)N 62a_100000747473_100010067687 [0,0,0,0,0,0|4,0,0]=4 392 B14R1.42 COc1cc(ncc1C)SCC(=O)N 62a_100010067687_100000747473 [0,0,0,0,0,0|4,0,0]=4 393 B14R1.42 COc1cc(ncc1C)SCC(=O)[O-] 62a_100010067687_100020667443 [0,0,0,0,0,0|4,0,0]=4 394 B14R1.42 COc1cc(ncc1C)SCC(=O)[O-] 62a_100020667443_100010067687 [0,0,0,0,0,0|4,0,0]=4 395 B14R1.42 COc1cc(ncc1F)SCC(=O)N 62a_100000747473_200010136270 [0,0,0,0,0,0|4,0,0]=4 396 B14R1.42 COc1cc(ncc1F)SCC(=O)N 62a_200010136270_100000747473 [0,0,0,0,0,0|4,0,0]=4 397 B14R1.42 COc1cc(ncc1F)SCC(=O)[O-] 62a_100020667443_200010136270 [0,0,0,0,0,0|4,0,0]=4 398 B14R1.42 COc1cc(ncc1F)SCC(=O)[O-] 62a_200010136270_100020667443 [0,0,0,0,0,0|4,0,0]=4 399 B14R1.42 COc1cc(ncc1N)SCC(=O)N 62a_100000747473_100009887741 [0,0,0,0,0,0|4,0,0]=4 400 B14R1.42 COc1cc(ncc1N)SCC(=O)N 62a_100009887741_100000747473 [0,0,0,0,0,0|4,0,0]=4 401 B14R1.42 COc1cc(ncc1N)SCC(=O)[O-] 62a_100009887741_100020667443 [0,0,0,0,0,0|4,0,0]=4 402 B14R1.42 COc1cc(ncc1N)SCC(=O)[O-] 62a_100020667443_100009887741 [0,0,0,0,0,0|4,0,0]=4 403 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 11a_200015507175_100015343762 [0,0,0,0,0,0|3,0,0]=3 404 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 1626a_200015507175_100015343762 [0,0,0,0,0,0|3,0,0]=3 405 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 240690a_200015507175_100015343762 [0,0,0,0,0,0|3,0,0]=3 406 B14R1.42 COc1nc(ccc1Cl)CNC(=O)C 527a_200015507175_100103153847 [0,0,0,0,0,0|3,0,0]=3 407 B14R1.42 COc1nc(ccc1N)SCC(=O)N 62a_100000687816_100000747473 [0,0,0,0,0,0|4,0,0]=4 408 B14R1.42 COc1nc(ccc1N)SCC(=O)N 62a_100000747473_100000687816 [0,0,0,0,0,0|4,0,0]=4 409 B14R1.42 COc1nc(ccc1N)SCC(=O)[O-] 62a_100000687816_100020667443 [0,0,0,0,0,0|4,0,0]=4 410 B14R1.42 COc1nc(ccc1N)SCC(=O)[O-] 62a_100020667443_100000687816 [0,0,0,0,0,0|4,0,0]=4 411 B14R1.42 COc1nc(ccc1O)SCC(=O)N 62a_100000747473_100010893133 [0,0,0,0,0,0|3,0,0]=3 412 B14R1.42 COc1nc(ccc1O)SCC(=O)[O-] 62a_100020667443_100010893133 [0,0,0,0,0,0|3,0,0]=3 413 B14R1.42 COc1nc(ccc1O)SCC(C)C 62a_100000210624_100010893133 [0,0,0,0,0,0|3,0,1]=4 414 B14R1.42 COc1nc(ccc1O)SCC(C)O 62a_100011218427_100010893133 [0,0,0,0,0,0|2,0,2]=4 415 B14R1.42 COc1nc(ccc1O)SC[C@@H](C)O 62a_100009817552_100010893133 [0,0,0,0,0,0|2,0,2]=4 416 B14R1.42 COc1nc(cnc1O)SCC(=O)N 62a_100000747473_200010365344 [0,0,0,0,0,0|4,0,0]=4 417 B14R1.42 COc1nc(cnc1O)SCC(=O)N 62a_200010365344_100000747473 [0,0,0,0,0,0|4,0,0]=4 418 B14R1.42 COc1nc(cnc1O)SCC(=O)[O-] 62a_100020667443_200010365344 [0,0,0,0,0,0|4,0,0]=4 419 B14R1.42 COc1nc(cnc1O)SCC(=O)[O-] 62a_200010365344_100020667443 [0,0,0,0,0,0|4,0,0]=4 420 B14R1.42 CSc1cc(ccc1F)SCC(=O)N 62a_100000747473_100010341305 [0,0,0,0,0,0|3,1,0]=4 421 B14R1.42 CSc1cc(ccc1F)SCC(=O)N 62a_100010341305_100000747473 [0,0,0,0,0,0|3,1,0]=4 422 B14R1.42 CSc1cc(ccc1F)SCC(=O)[O-] 62a_100010341305_100020667443 [0,0,0,0,0,0|3,1,0]=4 423 B14R1.42 CSc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100010341305 [0,0,0,0,0,0|3,1,0]=4 424 B14R1.42 N#Cc1cc(ccc1O)NCC(=O)N 34a_100011249283_100000187820 [0,0,0,0,0,0|4,0,0]=4 425 B14R1.42 N#Cc1cc(ccc1O)NCC(=O)[O-] 34a_100011249283_100020667443 [0,0,0,0,0,0|4,0,0]=4 426 B14R1.42 N#Cc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000687585 [0,0,0,0,0,0|4,0,0]=4 427 B14R1.42 N#Cc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000687585 [0,0,0,0,0,0|4,0,0]=4 428 B14R1.42 NC(=O)CSc1ccc(c(c1)C=O)O 62a_100000747473_100000186750 [0,0,0,0,0,0|4,0,0]=4 429 B14R1.42 NC(=O)CSc1ccc(c(c1)CO)O 62a_100000184703_100000747473 [0,0,0,0,0,0|4,0,0]=4 430 B14R1.42 NC(=O)CSc1ccc(c(c1)CO)O 62a_100000747473_100000184703 [0,0,0,0,0,0|4,0,0]=4 431 B14R1.42 NCc1cc(ccc1O)SCC(=O)N 62a_100000730032_100000747473 [0,0,0,0,0,0|4,0,0]=4 432 B14R1.42 NCc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000730032 [0,0,0,0,0,0|4,0,0]=4 433 B14R1.42 NCc1cc(ccc1O)SCC(=O)[O-] 62a_100000730032_100020667443 [0,0,0,0,0,0|4,0,0]=4 434 B14R1.42 NCc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000730032 [0,0,0,0,0,0|4,0,0]=4 435 B14R1.42 O=C([O-])CSc1ccc(c(c1)CO)O 62a_100000184703_100020667443 [0,0,0,0,0,0|4,0,0]=4 436 B14R1.42 O=C([O-])CSc1ccc(c(c1)CO)O 62a_100020667443_100000184703 [0,0,0,0,0,0|4,0,0]=4 437 B14R1.42 O=Cc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000186750 [0,0,0,0,0,0|4,0,0]=4 438 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000748629 [1,0,0,0,0,0|3,0,0]=4 439 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Br 2230a_100000210723_100000748629 [1,0,0,0,0,0|3,0,0]=4 440 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Br 34a_100000210723_100000748629 [1,0,0,0,0,0|3,0,0]=4 441 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Br 7a_100000210723_100000748629 [1,0,0,0,0,0|3,0,0]=4 442 B13R1.511 C=C(C)CNc1ccc(c(c1)C)C 2230a_100000724040_100000748629 [1,0,0,0,0,0|3,0,0]=4 443 B13R1.511 C=C(C)CNc1ccc(c(c1)C)C 34a_100000724040_100000748629 [1,0,0,0,0,0|3,0,0]=4 444 B13R1.511 C=C(C)CNc1ccc(c(c1)C)C 7a_100000724040_100000748629 [1,0,0,0,0,0|3,0,0]=4 445 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100000748629 [1,0,0,0,0,0|3,0,0]=4 446 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Cl 34a_100000187808_100000748629 [1,0,0,0,0,0|3,0,0]=4 447 B13R1.511 C=C(C)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000748629 [1,0,0,0,0,0|3,0,0]=4 448 B13R1.511 C=C(C)CNc1ccc(c(c1)C)F 2230a_100000750164_100000748629 [1,0,0,0,0,0|3,0,0]=4 449 B13R1.511 C=C(C)CNc1ccc(c(c1)C)F 34a_100000750164_100000748629 [1,0,0,0,0,0|3,0,0]=4 450 B13R1.511 C=C(C)CNc1ccc(c(c1)C)F 7a_100000750164_100000748629 [1,0,0,0,0,0|3,0,0]=4 451 B13R1.511 C=C(C)CNc1ccc(c(c1)C)I 34a_100000198070_100000748629 [1,0,0,0,0,0|3,0,0]=4 452 B13R1.511 C=C(C)CNc1ccc(c(c1)C)I 7a_100000198070_100000748629 [1,0,0,0,0,0|3,0,0]=4 453 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 34a_100011218179_100000748629 [1,0,0,0,0,0|2,0,0]=3 454 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 7a_100011218179_100000748629 [1,0,0,0,0,0|2,0,0]=3 455 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000748629 [1,0,0,0,0,0|3,0,0]=4 456 B13R1.511 C=C(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000748629 [1,0,0,0,0,0|3,0,0]=4 457 B13R1.511 C=C(C)CNc1ccc(c(c1)F)O 7a_100011220035_100000748629 [1,0,0,0,0,0|3,0,0]=4 458 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 34a_100000759471_100000748629 [1,0,0,0,0,0|3,0,0]=4 459 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 7a_100000759471_100000748629 [1,0,0,0,0,0|3,0,0]=4 460 B13R1.511 C=C(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000748629 [1,0,0,0,0,0|3,0,0]=4 461 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000748629 [1,0,0,0,0,0|3,0,0]=4 462 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000748629 [1,0,0,0,0,0|3,0,0]=4 463 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [1,0,0,0,0,0|2,0,0]=3 464 B13R1.511 C=C(C)COc1ccc(c(c1)C)Br 34a_100000690111_100000748629 [1,0,0,0,0,0|3,0,0]=4 465 B13R1.511 C=C(C)COc1ccc(c(c1)C)Br 7a_100000690111_100000748629 [1,0,0,0,0,0|3,0,0]=4 466 B13R1.511 C=C(C)COc1ccc(c(c1)C)C 34a_100000210932_100000748629 [1,0,0,0,0,0|3,0,0]=4 467 B13R1.511 C=C(C)COc1ccc(c(c1)C)C 7a_100000210932_100000748629 [1,0,0,0,0,0|3,0,0]=4 468 B13R1.511 C=C(C)COc1ccc(c(c1)C)Cl 34a_100000211092_100000748629 [1,0,0,0,0,0|3,0,0]=4 469 B13R1.511 C=C(C)COc1ccc(c(c1)C)Cl 7a_100000211092_100000748629 [1,0,0,0,0,0|3,0,0]=4 470 B13R1.511 C=C(C)COc1ccc(c(c1)C)F 34a_100000751312_100000748629 [1,0,0,0,0,0|3,0,0]=4 471 B13R1.511 C=C(C)COc1ccc(c(c1)C)F 7a_100000751312_100000748629 [1,0,0,0,0,0|3,0,0]=4 472 B13R1.511 C=C(C)COc1ccc(c(c1)C)I 34a_100000729255_100000748629 [1,0,0,0,0,0|3,0,0]=4 473 B13R1.511 C=C(C)COc1ccc(c(c1)C)I 7a_100000729255_100000748629 [1,0,0,0,0,0|3,0,0]=4 474 B13R1.511 C=C(C)COc1ccc(c(c1)C)N 34a_100000756630_100000748629 [1,0,0,0,0,0|3,0,0]=4 475 B13R1.511 C=C(C)COc1ccc(c(c1)C)N 7a_100000756630_100000748629 [1,0,0,0,0,0|3,0,0]=4 476 B13R1.511 C=C(C)CSc1cc(c(cn1)O)C 62a_100000748629_100000692680 [1,0,0,0,0,0|3,0,0]=4 477 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)O 62a_100000748629_100012361655 [1,0,0,0,0,0|3,0,0]=4 478 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000211660 [1,0,0,0,0,0|3,0,0]=4 479 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Br 62a_100000748629_100009813585 [1,0,0,0,0,0|3,0,0]=4 480 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Br 62a_100009813585_100000211660 [1,0,0,0,0,0|3,0,0]=4 481 B13R1.511 C=C(C)CSc1ccc(c(c1)C)C 62a_100000748629_100011215607 [1,0,0,0,0,0|3,0,0]=4 482 B13R1.511 C=C(C)CSc1ccc(c(c1)C)C 62a_100011215607_100000211660 [1,0,0,0,0,0|3,0,0]=4 483 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000211660 [1,0,0,0,0,0|3,0,0]=4 484 B13R1.511 C=C(C)CSc1ccc(c(c1)C)Cl 62a_100000748629_100000049509 [1,0,0,0,0,0|3,0,0]=4 485 B13R1.511 C=C(C)CSc1ccc(c(c1)C)F 62a_100000748629_100011218330 [1,0,0,0,0,0|3,0,0]=4 486 B13R1.511 C=C(C)CSc1ccc(c(c1)C)F 62a_100011218330_100000211660 [1,0,0,0,0,0|3,0,0]=4 487 B13R1.511 C=C(C)CSc1ccc(c(c1)C)N 62a_100000211769_100000211660 [1,0,0,0,0,0|3,0,0]=4 488 B13R1.511 C=C(C)CSc1ccc(c(c1)C)N 62a_100000748629_100000211769 [1,0,0,0,0,0|3,0,0]=4 489 B13R1.511 C=C(C)CSc1ccc(c(c1)C)O 62a_100000748629_100000186361 [1,0,0,0,0,0|2,0,0]=3 490 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)O 62a_100000748629_100012360047 [1,0,0,0,0,0|3,0,0]=4 491 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000211660 [1,0,0,0,0,0|3,0,0]=4 492 B13R1.511 C=C(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000211660 [1,0,0,0,0,0|3,0,0]=4 493 B13R1.511 C=C(C)CSc1ccc(c(c1)F)O 62a_100000748629_100000185481 [1,0,0,0,0,0|3,0,0]=4 494 B13R1.511 C=C(C)CSc1ccc(c(c1)N)O 62a_100000748629_100000752626 [1,0,0,0,0,0|3,0,0]=4 495 B13R1.511 C=C(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000211660 [1,0,0,0,0,0|3,0,0]=4 496 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100000748629_100012356990 [1,0,0,0,0,0|3,0,0]=4 497 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000211660 [1,0,0,0,0,0|3,0,0]=4 498 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000685420_100000211660 [1,0,0,0,0,0|3,0,0]=4 499 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000748629_100000685420 [1,0,0,0,0,0|3,0,0]=4 500 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100000748629_100011356854 [1,0,0,0,0,0|3,0,0]=4 501 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000211660 [1,0,0,0,0,0|3,0,0]=4 502 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000211660 [1,0,0,0,0,0|3,0,0]=4 503 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000748629_100000686035 [1,0,0,0,0,0|3,0,0]=4 504 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000211660 [1,0,0,0,0,0|3,0,0]=4 505 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000748629_100000739049 [1,0,0,0,0,0|3,0,0]=4 506 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [1,0,0,0,0,0|2,0,0]=3 507 B13R1.511 C=C(C)CSc1ccc(c(n1)C)O 62a_100000748629_100010233687 [1,0,0,0,0,0|3,0,0]=4 508 B13R1.511 C=C(C)CSc1ccc(c(n1)C)O 62a_100010233687_100000211660 [1,0,0,0,0,0|3,0,0]=4 509 B13R1.511 C=C(C)CSc1cnc(c(c1)C)O 62a_100000685391_100000211660 [1,0,0,0,0,0|3,0,0]=4 510 B13R1.511 C=C(C)CSc1cnc(c(c1)C)O 62a_100000748629_100000685391 [1,0,0,0,0,0|3,0,0]=4 511 B13R1.511 C=C(F)CNc1ccc(c(c1)C)O 34a_100011218179_100009893438 [1,0,0,0,0,0|2,0,1]=4 512 B13R1.511 C=C(F)CNc1ccc(c(c1)C)O 7a_100011218179_100000042424 [1,0,0,0,0,0|2,0,1]=4 513 B13R1.511 C=C(F)CNc1ccc(c(c1)O)O 34a_100102946323_100009893438 [1,0,0,0,0,0|2,0,1]=4 514 B13R1.511 C=C(F)CSc1ccc(c(c1)C)O 62a_100000042424_100000186361 [1,0,0,0,0,0|2,0,1]=4 515 B13R1.511 C=C(F)CSc1ccc(c(c1)O)O 62a_100000042424_100009813601 [1,0,0,0,0,0|2,0,1]=4 516 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200000210301 [1,0,0,0,0,0|1,0,2]=4 517 B13R1.511 CC(=O)C=Cc1ccc(c(c1)C)C 1458a_100011338269_200000210301 [1,0,0,0,0,0|1,0,2]=4 518 B13R1.511 CC(=O)C=Cc1ccc(c(c1)C)F 1458a_100016261966_200000210301 [1,0,0,0,0,0|1,0,2]=4 519 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200000210301 [1,0,0,0,0,0|1,0,2]=4 520 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_200000210301 [1,0,0,0,0,0|2,0,0]=3 521 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200000210301 [1,0,0,0,0,0|2,0,0]=3 522 B13R1.511 CC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_200000210301 [1,0,0,0,0,0|1,0,0]=2 523 B13R1.511 CC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_200000210301 [1,0,0,0,0,0|1,0,0]=2 524 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200000210301 [1,0,0,0,0,0|2,0,0]=3 525 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000070787_100011713676 [1,0,0,0,0,0|2,0,0]=3 526 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200000210301 [1,0,0,0,0,0|2,0,0]=3 527 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000070787_100012361305 [1,0,0,0,0,0|2,0,0]=3 528 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200000210301 [1,0,0,0,0,0|2,0,0]=3 529 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200000210301 [1,0,0,0,0,0|2,0,0]=3 530 B13R1.511 CC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_200000210301 [1,0,0,0,0,0|2,0,0]=3 531 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200000210301 [1,0,0,0,0,0|2,0,0]=3 532 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000070787_100000690553 [1,0,0,0,0,0|2,0,0]=3 533 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200000210301 [1,0,0,0,0,0|2,0,0]=3 534 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [1,0,0,0,0,0|0,0,0]=1 535 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [1,0,0,0,0,0|0,0,0]=1 536 B13R1.511 CC(=O)COc1ccc(c(c1)C)C 1458a_100000182425_200000210301 [1,0,0,0,0,0|2,0,0]=3 537 B13R1.511 CC(=O)COc1ccc(c(c1)C)Cl 1458a_100000182483_200000210301 [1,0,0,0,0,0|2,0,0]=3 538 B13R1.511 CC(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_200000210301 [1,0,0,0,0,0|3,0,0]=4 539 B13R1.511 CC(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_200000210301 [1,0,0,0,0,0|3,0,0]=4 540 B13R1.511 CC(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_200000210301 [1,0,0,0,0,0|3,0,0]=4 541 B13R1.511 CC(=O)COc1ccc(c(c1)F)F 1458a_100000246063_200000210301 [1,0,0,0,0,0|3,0,0]=4 542 B13R1.511 CC(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_200000210301 [1,0,0,0,0,0|3,0,0]=4 543 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 11a_100012351559_100015343762 [1,0,0,0,0,0|3,0,0]=4 544 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 1626a_100012351559_100015343762 [1,0,0,0,0,0|3,0,0]=4 545 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 240690a_100012351559_100015343762 [1,0,0,0,0,0|3,0,0]=4 546 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 527a_100012351559_100103153847 [1,0,0,0,0,0|3,0,0]=4 547 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 11a_100012349490_100015343762 [1,0,0,0,0,0|3,0,0]=4 548 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 1626a_100012349490_100015343762 [1,0,0,0,0,0|3,0,0]=4 549 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 240690a_100012349490_100015343762 [1,0,0,0,0,0|3,0,0]=4 550 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 527a_100012349490_100103153847 [1,0,0,0,0,0|3,0,0]=4 551 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 11a_100015193890_100015343762 [1,0,0,0,0,0|3,0,0]=4 552 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 1626a_100015193890_100015343762 [1,0,0,0,0,0|3,0,0]=4 553 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 240690a_100015193890_100015343762 [1,0,0,0,0,0|3,0,0]=4 554 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 527a_100015193890_100103153847 [1,0,0,0,0,0|3,0,0]=4 555 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 11a_100015205234_100015343762 [1,0,0,0,0,0|2,0,0]=3 556 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 1626a_100015205234_100015343762 [1,0,0,0,0,0|2,0,0]=3 557 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 240690a_100015205234_100015343762 [1,0,0,0,0,0|2,0,0]=3 558 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 527a_100015205234_100103153847 [1,0,0,0,0,0|2,0,0]=3 559 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 11a_100025706692_100015343762 [1,0,0,0,0,0|2,0,0]=3 560 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 1626a_100025706692_100015343762 [1,0,0,0,0,0|2,0,0]=3 561 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 240690a_100025706692_100015343762 [1,0,0,0,0,0|2,0,0]=3 562 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 527a_100025706692_100103153847 [1,0,0,0,0,0|2,0,0]=3 563 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 11a_100000239911_100015343762 [1,0,0,0,0,0|2,0,0]=3 564 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 1626a_100000239911_100015343762 [1,0,0,0,0,0|2,0,0]=3 565 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 240690a_100000239911_100015343762 [1,0,0,0,0,0|2,0,0]=3 566 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 527a_100000239911_100103153847 [1,0,0,0,0,0|2,0,0]=3 567 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 11a_100012362553_100015343762 [1,0,0,0,0,0|3,0,0]=4 568 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 1626a_100012362553_100015343762 [1,0,0,0,0,0|3,0,0]=4 569 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 240690a_100012362553_100015343762 [1,0,0,0,0,0|3,0,0]=4 570 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 527a_100012362553_100103153847 [1,0,0,0,0,0|3,0,0]=4 571 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 11a_102495364989_100015343762 [1,0,0,0,0,0|3,0,0]=4 572 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 1626a_102495364989_100015343762 [1,0,0,0,0,0|3,0,0]=4 573 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 240690a_102495364989_100015343762 [1,0,0,0,0,0|3,0,0]=4 574 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 527a_102495364989_100103153847 [1,0,0,0,0,0|3,0,0]=4 575 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 11a_100000174881_100015343762 [1,0,0,0,0,0|3,0,0]=4 576 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 1626a_100000174881_100015343762 [1,0,0,0,0,0|3,0,0]=4 577 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 240690a_100000174881_100015343762 [1,0,0,0,0,0|3,0,0]=4 578 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 527a_100000174881_100103153847 [1,0,0,0,0,0|3,0,0]=4 579 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 11a_100000749334_100015343762 [1,0,0,0,0,0|3,0,0]=4 580 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 1626a_100000749334_100015343762 [1,0,0,0,0,0|3,0,0]=4 581 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 240690a_100000749334_100015343762 [1,0,0,0,0,0|3,0,0]=4 582 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 527a_100000749334_100103153847 [1,0,0,0,0,0|3,0,0]=4 583 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 11a_100000755036_100015343762 [1,0,0,0,0,0|3,0,0]=4 584 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 1626a_100000755036_100015343762 [1,0,0,0,0,0|3,0,0]=4 585 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 240690a_100000755036_100015343762 [1,0,0,0,0,0|3,0,0]=4 586 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 527a_100000755036_100103153847 [1,0,0,0,0,0|3,0,0]=4 587 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 11a_100102708794_100015343762 [1,0,0,0,0,0|3,0,0]=4 588 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 1626a_100102708794_100015343762 [1,0,0,0,0,0|3,0,0]=4 589 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 240690a_100102708794_100015343762 [1,0,0,0,0,0|3,0,0]=4 590 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 527a_100102708794_100103153847 [1,0,0,0,0,0|3,0,0]=4 591 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 11a_100011219866_100015343762 [1,0,0,0,0,0|3,0,0]=4 592 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 1626a_100011219866_100015343762 [1,0,0,0,0,0|3,0,0]=4 593 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 240690a_100011219866_100015343762 [1,0,0,0,0,0|3,0,0]=4 594 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 527a_100011219866_100103153847 [1,0,0,0,0,0|3,0,0]=4 595 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 11a_100000737897_100015343762 [1,0,0,0,0,0|3,0,0]=4 596 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 1626a_100000737897_100015343762 [1,0,0,0,0,0|3,0,0]=4 597 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 240690a_100000737897_100015343762 [1,0,0,0,0,0|3,0,0]=4 598 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 527a_100000737897_100103153847 [1,0,0,0,0,0|3,0,0]=4 599 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [1,0,0,0,0,0|2,0,0]=3 600 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [1,0,0,0,0,0|2,0,0]=3 601 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100015343762 [1,0,0,0,0,0|2,0,0]=3 602 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100103153847 [1,0,0,0,0,0|2,0,0]=3 603 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100015343762 [1,0,0,0,0,0|2,0,0]=3 604 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100103153847 [1,0,0,0,0,0|2,0,0]=3 605 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [1,0,0,0,0,0|1,0,0]=2 606 B13R1.511 CC(=O)NCc1ccc(c(n1)C)C 11a_202515432893_100015343762 [1,0,0,0,0,0|3,0,0]=4 607 B13R1.511 CC(=O)NCc1ccc(c(n1)C)C 1626a_202515432893_100015343762 [1,0,0,0,0,0|3,0,0]=4 608 B13R1.511 CC(=O)NCc1ccc(c(n1)C)C 240690a_202515432893_100015343762 [1,0,0,0,0,0|3,0,0]=4 609 B13R1.511 CC(=O)NCc1ccc(c(n1)C)C 527a_202515432893_100103153847 [1,0,0,0,0,0|3,0,0]=4 610 B13R1.511 CC(=O)NNc1ccc(c(c1)C)Br 22a_100000745493_100000070787 [1,0,0,0,0,0|3,0,0]=4 611 B13R1.511 CC(=O)NNc1ccc(c(c1)C)Cl 22a_100015233126_100000070787 [1,0,0,0,0,0|3,0,0]=4 612 B13R1.511 CC(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000210624 [1,0,0,0,0,0|2,0,1]=4 613 B13R1.511 CC(C)CSc1ccc(c(c1)O)O 62a_100000210624_100009813601 [1,0,0,0,0,0|2,0,1]=4 614 B13R1.511 CC(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000210206 [1,0,0,0,0,0|2,0,1]=4 615 B13R1.511 CC(O)CNc1ccc(c(c1)O)O 34a_100102946323_100011218427 [1,0,0,0,0,0|1,0,2]=4 616 B13R1.511 CC(O)CSc1ccc(c(c1)O)O 62a_100011218427_100009813601 [1,0,0,0,0,0|1,0,2]=4 617 B13R1.511 CN(C)CCc1ccc(c(c1)O)O 269982a_100102631434_200010393615 [1,0,0,0,0,0|2,0,0]=3 618 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)O 34a_100102946323_100009817552 [1,0,0,0,0,0|1,0,2]=4 619 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)O 62a_100009817552_100009813601 [1,0,0,0,0,0|1,0,2]=4 620 B13R1.511 Cc1cc(ccc1Br)NCC(=O)N 2230a_100000210723_100000747473 [1,0,0,0,0,0|3,0,0]=4 621 B13R1.511 Cc1cc(ccc1Br)NCC(=O)N 34a_100000210723_100000187820 [1,0,0,0,0,0|3,0,0]=4 622 B13R1.511 Cc1cc(ccc1Br)NCC(=O)N 7a_100000210723_100000187820 [1,0,0,0,0,0|3,0,0]=4 623 B13R1.511 Cc1cc(ccc1Br)NCC(=O)[O-] 34a_100000210723_100020667443 [1,0,0,0,0,0|3,0,0]=4 624 B13R1.511 Cc1cc(ccc1Br)OCC(=O)N 34a_100000690111_100000187820 [1,0,0,0,0,0|3,0,0]=4 625 B13R1.511 Cc1cc(ccc1Br)OCC(=O)N 7a_100000690111_100000187820 [1,0,0,0,0,0|3,0,0]=4 626 B13R1.511 Cc1cc(ccc1Br)OCC(=O)[O-] 34a_100000690111_100020667443 [1,0,0,0,0,0|3,0,0]=4 627 B13R1.511 Cc1cc(ccc1Br)SCC(=O)N 62a_100000747473_100009813585 [1,0,0,0,0,0|3,0,0]=4 628 B13R1.511 Cc1cc(ccc1Br)SCC(=O)N 62a_100009813585_100000747473 [1,0,0,0,0,0|3,0,0]=4 629 B13R1.511 Cc1cc(ccc1Br)SCC(=O)[O-] 62a_100009813585_100020667443 [1,0,0,0,0,0|3,0,0]=4 630 B13R1.511 Cc1cc(ccc1Br)SCC(=O)[O-] 62a_100020667443_100009813585 [1,0,0,0,0,0|3,0,0]=4 631 B13R1.511 Cc1cc(ccc1Cl)NCC(=O)N 2230a_100000187808_100000747473 [1,0,0,0,0,0|3,0,0]=4 632 B13R1.511 Cc1cc(ccc1Cl)NCC(=O)N 34a_100000187808_100000187820 [1,0,0,0,0,0|3,0,0]=4 633 B13R1.511 Cc1cc(ccc1Cl)NCC(=O)N 7a_100000187808_100000187820 [1,0,0,0,0,0|3,0,0]=4 634 B13R1.511 Cc1cc(ccc1Cl)NCC(=O)[O-] 34a_100000187808_100020667443 [1,0,0,0,0,0|3,0,0]=4 635 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)N 34a_100000211092_100000187820 [1,0,0,0,0,0|3,0,0]=4 636 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)N 7a_100000211092_100000187820 [1,0,0,0,0,0|3,0,0]=4 637 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)[13CH3] 1458a_100000182483_200025704644 [1,0,0,0,0,0|2,0,0]=3 638 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)[O-] 34a_100000211092_100020667443 [1,0,0,0,0,0|3,0,0]=4 639 B13R1.511 Cc1cc(ccc1Cl)SCC(=O)N 62a_100000049509_100000747473 [1,0,0,0,0,0|3,0,0]=4 640 B13R1.511 Cc1cc(ccc1Cl)SCC(=O)N 62a_100000747473_100000049509 [1,0,0,0,0,0|3,0,0]=4 641 B13R1.511 Cc1cc(ccc1Cl)SCC(=O)[O-] 62a_100000049509_100020667443 [1,0,0,0,0,0|3,0,0]=4 642 B13R1.511 Cc1cc(ccc1Cl)SCC(=O)[O-] 62a_100020667443_100000049509 [1,0,0,0,0,0|3,0,0]=4 643 B13R1.511 Cc1cc(ccc1F)C=CC(=O)[13CH3] 1458a_100016261966_200025704644 [1,0,0,0,0,0|1,0,2]=4 644 B13R1.511 Cc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100011615030_200025704644 [1,0,0,0,0,0|1,0,0]=2 645 B13R1.511 Cc1cc(ccc1F)NCC(=O)N 2230a_100000750164_100000747473 [1,0,0,0,0,0|3,0,0]=4 646 B13R1.511 Cc1cc(ccc1F)NCC(=O)N 34a_100000750164_100000187820 [1,0,0,0,0,0|3,0,0]=4 647 B13R1.511 Cc1cc(ccc1F)NCC(=O)N 7a_100000750164_100000187820 [1,0,0,0,0,0|3,0,0]=4 648 B13R1.511 Cc1cc(ccc1F)NCC(=O)[O-] 34a_100000750164_100020667443 [1,0,0,0,0,0|3,0,0]=4 649 B13R1.511 Cc1cc(ccc1F)OCC(=O)N 34a_100000751312_100000187820 [1,0,0,0,0,0|3,0,0]=4 650 B13R1.511 Cc1cc(ccc1F)OCC(=O)N 7a_100000751312_100000187820 [1,0,0,0,0,0|3,0,0]=4 651 B13R1.511 Cc1cc(ccc1F)OCC(=O)[O-] 34a_100000751312_100020667443 [1,0,0,0,0,0|3,0,0]=4 652 B13R1.511 Cc1cc(ccc1F)SCC(=O)N 62a_100000747473_100011218330 [1,0,0,0,0,0|3,0,0]=4 653 B13R1.511 Cc1cc(ccc1F)SCC(=O)N 62a_100011218330_100000747473 [1,0,0,0,0,0|3,0,0]=4 654 B13R1.511 Cc1cc(ccc1F)SCC(=O)[O-] 62a_100011218330_100020667443 [1,0,0,0,0,0|3,0,0]=4 655 B13R1.511 Cc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100011218330 [1,0,0,0,0,0|3,0,0]=4 656 B13R1.511 Cc1cc(ccc1I)NCC(=O)N 34a_100000198070_100000187820 [1,0,0,0,0,0|3,0,0]=4 657 B13R1.511 Cc1cc(ccc1I)NCC(=O)N 7a_100000198070_100000187820 [1,0,0,0,0,0|3,0,0]=4 658 B13R1.511 Cc1cc(ccc1I)NCC(=O)[O-] 34a_100000198070_100020667443 [1,0,0,0,0,0|3,0,0]=4 659 B13R1.511 Cc1cc(ccc1I)OCC(=O)N 34a_100000729255_100000187820 [1,0,0,0,0,0|3,0,0]=4 660 B13R1.511 Cc1cc(ccc1I)OCC(=O)N 7a_100000729255_100000187820 [1,0,0,0,0,0|3,0,0]=4 661 B13R1.511 Cc1cc(ccc1I)OCC(=O)[O-] 34a_100000729255_100020667443 [1,0,0,0,0,0|3,0,0]=4 662 B13R1.511 Cc1cc(ccc1N)OCC(=O)N 34a_100000756630_100000187820 [1,0,0,0,0,0|3,0,0]=4 663 B13R1.511 Cc1cc(ccc1N)OCC(=O)N 7a_100000756630_100000187820 [1,0,0,0,0,0|3,0,0]=4 664 B13R1.511 Cc1cc(ccc1N)OCC(=O)[O-] 34a_100000756630_100020667443 [1,0,0,0,0,0|3,0,0]=4 665 B13R1.511 Cc1cc(ccc1N)SCC(=O)N 62a_100000211769_100000747473 [1,0,0,0,0,0|3,0,0]=4 666 B13R1.511 Cc1cc(ccc1N)SCC(=O)N 62a_100000747473_100000211769 [1,0,0,0,0,0|3,0,0]=4 667 B13R1.511 Cc1cc(ccc1N)SCC(=O)[O-] 62a_100000211769_100020667443 [1,0,0,0,0,0|3,0,0]=4 668 B13R1.511 Cc1cc(ccc1N)SCC(=O)[O-] 62a_100020667443_100000211769 [1,0,0,0,0,0|3,0,0]=4 669 B13R1.511 Cc1cc(ccc1O)NCC(=O)N 34a_100011218179_100000187820 [1,0,0,0,0,0|2,0,0]=3 670 B13R1.511 Cc1cc(ccc1O)NCC(=O)N 7a_100011218179_100000187820 [1,0,0,0,0,0|2,0,0]=3 671 B13R1.511 Cc1cc(ccc1O)NCC(=O)[O-] 34a_100011218179_100020667443 [1,0,0,0,0,0|2,0,0]=3 672 B13R1.511 Cc1cc(ccc1O)NCC(C)C 34a_100011218179_100000210624 [1,0,0,0,0,0|2,0,1]=4 673 B13R1.511 Cc1cc(ccc1O)NCC(C)C 7a_100011218179_100000210760 [1,0,0,0,0,0|2,0,1]=4 674 B13R1.511 Cc1cc(ccc1O)NCC(C)O 34a_100011218179_100011218427 [1,0,0,0,0,0|1,0,2]=4 675 B13R1.511 Cc1cc(ccc1O)NCC(C)O 7a_100011218179_100011218427 [1,0,0,0,0,0|1,0,2]=4 676 B13R1.511 Cc1cc(ccc1O)NC[C@@H](C)O 34a_100011218179_100009817552 [1,0,0,0,0,0|1,0,2]=4 677 B13R1.511 Cc1cc(ccc1O)NC[C@@H](C)O 7a_100011218179_100009817552 [1,0,0,0,0,0|1,0,2]=4 678 B13R1.511 Cc1cc(ccc1O)NC[N+](=O)[O-] 34a_100011218179_100000761209 [1,0,0,0,0,0|3,0,0]=4 679 B13R1.511 Cc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000186361 [1,0,0,0,0,0|2,0,0]=3 680 B13R1.511 Cc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000186361 [1,0,0,0,0,0|2,0,0]=3 681 B13R1.511 Cc1cc(ccc1O)SCC(C)C 62a_100000210624_100000186361 [1,0,0,0,0,0|2,0,1]=4 682 B13R1.511 Cc1cc(ccc1O)SCC(C)O 62a_100011218427_100000186361 [1,0,0,0,0,0|1,0,2]=4 683 B13R1.511 Cc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000186361 [1,0,0,0,0,0|1,0,2]=4 684 B13R1.511 Cc1cc(cnc1O)SCC(=O)N 62a_100000685391_100000747473 [1,0,0,0,0,0|3,0,0]=4 685 B13R1.511 Cc1cc(cnc1O)SCC(=O)N 62a_100000747473_100000685391 [1,0,0,0,0,0|3,0,0]=4 686 B13R1.511 Cc1cc(cnc1O)SCC(=O)[O-] 62a_100000685391_100020667443 [1,0,0,0,0,0|3,0,0]=4 687 B13R1.511 Cc1cc(cnc1O)SCC(=O)[O-] 62a_100020667443_100000685391 [1,0,0,0,0,0|3,0,0]=4 688 B13R1.511 Cc1cc(ncc1O)SCC(=O)N 62a_100000747473_100000692680 [1,0,0,0,0,0|3,0,0]=4 689 B13R1.511 Cc1cc(ncc1O)SCC(=O)[O-] 62a_100020667443_100000692680 [1,0,0,0,0,0|3,0,0]=4 690 B13R1.511 Cc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100010220830_200025704644 [1,0,0,0,0,0|2,0,0]=3 691 B13R1.511 Cc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100011338269_200025704644 [1,0,0,0,0,0|1,0,2]=4 692 B13R1.511 Cc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011338283_200025704644 [1,0,0,0,0,0|1,0,0]=2 693 B13R1.511 Cc1ccc(cc1C)NCC(=O)N 2230a_100000724040_100000747473 [1,0,0,0,0,0|3,0,0]=4 694 B13R1.511 Cc1ccc(cc1C)NCC(=O)N 34a_100000724040_100000187820 [1,0,0,0,0,0|3,0,0]=4 695 B13R1.511 Cc1ccc(cc1C)NCC(=O)N 7a_100000724040_100000187820 [1,0,0,0,0,0|3,0,0]=4 696 B13R1.511 Cc1ccc(cc1C)NCC(=O)[O-] 34a_100000724040_100020667443 [1,0,0,0,0,0|3,0,0]=4 697 B13R1.511 Cc1ccc(cc1C)OCC(=O)N 34a_100000210932_100000187820 [1,0,0,0,0,0|3,0,0]=4 698 B13R1.511 Cc1ccc(cc1C)OCC(=O)N 7a_100000210932_100000187820 [1,0,0,0,0,0|3,0,0]=4 699 B13R1.511 Cc1ccc(cc1C)OCC(=O)[13CH3] 1458a_100000182425_200025704644 [1,0,0,0,0,0|2,0,0]=3 700 B13R1.511 Cc1ccc(cc1C)OCC(=O)[O-] 34a_100000210932_100020667443 [1,0,0,0,0,0|3,0,0]=4 701 B13R1.511 Cc1ccc(cc1C)SCC(=O)N 62a_100000747473_100011215607 [1,0,0,0,0,0|3,0,0]=4 702 B13R1.511 Cc1ccc(cc1C)SCC(=O)N 62a_100011215607_100000747473 [1,0,0,0,0,0|3,0,0]=4 703 B13R1.511 Cc1ccc(cc1C)SCC(=O)[O-] 62a_100011215607_100020667443 [1,0,0,0,0,0|3,0,0]=4 704 B13R1.511 Cc1ccc(cc1C)SCC(=O)[O-] 62a_100020667443_100011215607 [1,0,0,0,0,0|3,0,0]=4 705 B13R1.511 Cc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100011830284_200025704644 [1,0,0,0,0,0|2,0,0]=3 706 B13R1.511 Cc1ccc(cc1O)NCC(=O)N 34a_100000759471_100000187820 [1,0,0,0,0,0|3,0,0]=4 707 B13R1.511 Cc1ccc(cc1O)NCC(=O)N 7a_100000759471_100000187820 [1,0,0,0,0,0|3,0,0]=4 708 B13R1.511 Cc1ccc(cc1O)NCC(=O)[O-] 34a_100000759471_100020667443 [1,0,0,0,0,0|3,0,0]=4 709 B13R1.511 Cc1ccc(cc1O)SCC(=O)N 62a_100000685420_100000747473 [1,0,0,0,0,0|3,0,0]=4 710 B13R1.511 Cc1ccc(cc1O)SCC(=O)N 62a_100000747473_100000685420 [1,0,0,0,0,0|3,0,0]=4 711 B13R1.511 Cc1ccc(cc1O)SCC(=O)[O-] 62a_100000685420_100020667443 [1,0,0,0,0,0|3,0,0]=4 712 B13R1.511 Cc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100000685420 [1,0,0,0,0,0|3,0,0]=4 713 B13R1.511 Cc1nc(ccc1O)SCC(=O)N 62a_100000747473_100010233687 [1,0,0,0,0,0|3,0,0]=4 714 B13R1.511 Cc1nc(ccc1O)SCC(=O)N 62a_100010233687_100000747473 [1,0,0,0,0,0|3,0,0]=4 715 B13R1.511 Cc1nc(ccc1O)SCC(=O)[O-] 62a_100010233687_100020667443 [1,0,0,0,0,0|3,0,0]=4 716 B13R1.511 Cc1nc(ccc1O)SCC(=O)[O-] 62a_100020667443_100010233687 [1,0,0,0,0,0|3,0,0]=4 717 B13R1.511 NC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000187820 [1,0,0,0,0,0|3,0,0]=4 718 B13R1.511 NC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000187820 [1,0,0,0,0,0|3,0,0]=4 719 B13R1.511 NC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000187820 [1,0,0,0,0,0|3,0,0]=4 720 B13R1.511 NC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000187820 [1,0,0,0,0,0|3,0,0]=4 721 B13R1.511 NC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000187820 [1,0,0,0,0,0|3,0,0]=4 722 B13R1.511 NC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000187820 [1,0,0,0,0,0|3,0,0]=4 723 B13R1.511 NC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000187820 [1,0,0,0,0,0|3,0,0]=4 724 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [1,0,0,0,0,0|2,0,0]=3 725 B13R1.511 NC(=O)CSc1ccc(c(c1)Br)O 62a_100000747473_100012361655 [1,0,0,0,0,0|3,0,0]=4 726 B13R1.511 NC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000747473 [1,0,0,0,0,0|3,0,0]=4 727 B13R1.511 NC(=O)CSc1ccc(c(c1)Cl)O 62a_100000747473_100012360047 [1,0,0,0,0,0|3,0,0]=4 728 B13R1.511 NC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000747473 [1,0,0,0,0,0|3,0,0]=4 729 B13R1.511 NC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000747473 [1,0,0,0,0,0|3,0,0]=4 730 B13R1.511 NC(=O)CSc1ccc(c(c1)F)O 62a_100000747473_100000185481 [1,0,0,0,0,0|3,0,0]=4 731 B13R1.511 NC(=O)CSc1ccc(c(c1)N)O 62a_100000747473_100000752626 [1,0,0,0,0,0|3,0,0]=4 732 B13R1.511 NC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000747473 [1,0,0,0,0,0|3,0,0]=4 733 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Br 62a_100000747473_100012356990 [1,0,0,0,0,0|3,0,0]=4 734 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000747473 [1,0,0,0,0,0|3,0,0]=4 735 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Cl 62a_100000747473_100011356854 [1,0,0,0,0,0|3,0,0]=4 736 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000747473 [1,0,0,0,0,0|3,0,0]=4 737 B13R1.511 NC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000747473 [1,0,0,0,0,0|3,0,0]=4 738 B13R1.511 NC(=O)CSc1ccc(c(c1)O)F 62a_100000747473_100000686035 [1,0,0,0,0,0|3,0,0]=4 739 B13R1.511 NC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000747473 [1,0,0,0,0,0|3,0,0]=4 740 B13R1.511 NC(=O)CSc1ccc(c(c1)O)N 62a_100000747473_100000739049 [1,0,0,0,0,0|3,0,0]=4 741 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [1,0,0,0,0,0|2,0,0]=3 742 B13R1.511 Nc1cc(ccc1O)SCC(=O)[O-] 62a_100000752626_100020667443 [1,0,0,0,0,0|3,0,0]=4 743 B13R1.511 Nc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000752626 [1,0,0,0,0,0|3,0,0]=4 744 B13R1.511 Nc1ccc(cc1O)SCC(=O)[O-] 62a_100000739049_100020667443 [1,0,0,0,0,0|3,0,0]=4 745 B13R1.511 Nc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100000739049 [1,0,0,0,0,0|3,0,0]=4 746 B13R1.511 O=C([O-])CNc1ccc(c(c1)Br)O 34a_100011534360_100020667443 [1,0,0,0,0,0|3,0,0]=4 747 B13R1.511 O=C([O-])CNc1ccc(c(c1)Cl)O 34a_100000744943_100020667443 [1,0,0,0,0,0|3,0,0]=4 748 B13R1.511 O=C([O-])CNc1ccc(c(c1)F)O 34a_100011220035_100020667443 [1,0,0,0,0,0|3,0,0]=4 749 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)Cl 34a_100011934209_100020667443 [1,0,0,0,0,0|3,0,0]=4 750 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)F 34a_100012017398_100020667443 [1,0,0,0,0,0|3,0,0]=4 751 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100020667443 [1,0,0,0,0,0|2,0,0]=3 752 B13R1.511 O=C([O-])CSc1ccc(c(c1)Br)O 62a_100012361655_100020667443 [1,0,0,0,0,0|3,0,0]=4 753 B13R1.511 O=C([O-])CSc1ccc(c(c1)Br)O 62a_100020667443_100012361655 [1,0,0,0,0,0|3,0,0]=4 754 B13R1.511 O=C([O-])CSc1ccc(c(c1)Cl)O 62a_100012360047_100020667443 [1,0,0,0,0,0|3,0,0]=4 755 B13R1.511 O=C([O-])CSc1ccc(c(c1)Cl)O 62a_100020667443_100012360047 [1,0,0,0,0,0|3,0,0]=4 756 B13R1.511 O=C([O-])CSc1ccc(c(c1)F)O 62a_100000185481_100020667443 [1,0,0,0,0,0|3,0,0]=4 757 B13R1.511 O=C([O-])CSc1ccc(c(c1)F)O 62a_100020667443_100000185481 [1,0,0,0,0,0|3,0,0]=4 758 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Br 62a_100012356990_100020667443 [1,0,0,0,0,0|3,0,0]=4 759 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Br 62a_100020667443_100012356990 [1,0,0,0,0,0|3,0,0]=4 760 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Cl 62a_100011356854_100020667443 [1,0,0,0,0,0|3,0,0]=4 761 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Cl 62a_100020667443_100011356854 [1,0,0,0,0,0|3,0,0]=4 762 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)F 62a_100000686035_100020667443 [1,0,0,0,0,0|3,0,0]=4 763 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)F 62a_100020667443_100000686035 [1,0,0,0,0,0|3,0,0]=4 764 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)O 62a_100020667443_100009813601 [1,0,0,0,0,0|2,0,0]=3 765 B13R1.511 O=[N+]([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100000761209 [1,0,0,0,0,0|3,0,0]=4 766 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200025704644 [1,0,0,0,0,0|1,0,2]=4 767 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200025704644 [1,0,0,0,0,0|1,0,2]=4 768 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200025704644 [1,0,0,0,0,0|2,0,0]=3 769 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200025704644 [1,0,0,0,0,0|2,0,0]=3 770 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200025704644 [1,0,0,0,0,0|2,0,0]=3 771 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200025704644 [1,0,0,0,0,0|2,0,0]=3 772 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200025704644 [1,0,0,0,0,0|2,0,0]=3 773 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200025704644 [1,0,0,0,0,0|2,0,0]=3 774 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200025704644 [1,0,0,0,0,0|2,0,0]=3 775 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [1,0,0,0,0,0|0,0,0]=1 776 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_200025704644 [1,0,0,0,0,0|3,0,0]=4 777 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_200025704644 [1,0,0,0,0,0|3,0,0]=4 778 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_200025704644 [1,0,0,0,0,0|3,0,0]=4 779 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)F)F 1458a_100000246063_200025704644 [1,0,0,0,0,0|3,0,0]=4 780 B13R1.511 [13CH3]C(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_200025704644 [1,0,0,0,0,0|3,0,0]=4 781 B13R1.575 C#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000184674 [1,0,0,0,0,0|1,0,2]=4 782 B13R1.575 C#CCSc1ccc(c(c1)OC)O 62a_100000038162_100000694246 [1,0,0,0,0,0|1,0,2]=4 783 B13R1.575 C=CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210623 [1,0,0,0,0,0|2,0,1]=4 784 B13R1.575 C=CCNc1ccc(c(c1)OC)Br 34a_100000765947_100015514636 [1,0,0,0,0,0|2,0,1]=4 785 B13R1.575 C=CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210623 [1,0,0,0,0,0|2,0,1]=4 786 B13R1.575 C=CCNc1ccc(c(c1)OC)C 34a_100011279678_100015514636 [1,0,0,0,0,0|2,0,1]=4 787 B13R1.575 C=CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210623 [1,0,0,0,0,0|2,0,1]=4 788 B13R1.575 C=CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100015514636 [1,0,0,0,0,0|2,0,1]=4 789 B13R1.575 C=CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210623 [1,0,0,0,0,0|2,0,1]=4 790 B13R1.575 C=CCNc1ccc(c(c1)OC)F 34a_100000701188_100015514636 [1,0,0,0,0,0|2,0,1]=4 791 B13R1.575 C=CCNc1ccc(c(c1)OC)I 34a_100000746945_100015514636 [1,0,0,0,0,0|2,0,1]=4 792 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [1,0,0,0,0,0|1,0,1]=3 793 B13R1.575 C=CCOc1ccc(c(c1)OC)Br 34a_100011827694_100015514636 [1,0,0,0,0,0|2,0,1]=4 794 B13R1.575 C=CCOc1ccc(c(c1)OC)Br 7a_100011827694_100015514636 [1,0,0,0,0,0|2,0,1]=4 795 B13R1.575 C=CCOc1ccc(c(c1)OC)C 34a_100009865632_100015514636 [1,0,0,0,0,0|2,0,1]=4 796 B13R1.575 C=CCOc1ccc(c(c1)OC)C 7a_100009865632_100015514636 [1,0,0,0,0,0|2,0,1]=4 797 B13R1.575 C=CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100015514636 [1,0,0,0,0,0|2,0,1]=4 798 B13R1.575 C=CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100015514636 [1,0,0,0,0,0|2,0,1]=4 799 B13R1.575 C=CCOc1ccc(c(c1)OC)F 34a_100012001760_100015514636 [1,0,0,0,0,0|2,0,1]=4 800 B13R1.575 C=CCOc1ccc(c(c1)OC)F 7a_100012001760_100015514636 [1,0,0,0,0,0|2,0,1]=4 801 B13R1.575 C=CCOc1ccc(c(c1)OC)N 34a_100015326901_100015514636 [1,0,0,0,0,0|2,0,1]=4 802 B13R1.575 C=CCOc1ccc(c(c1)OC)N 7a_100015326901_100015514636 [1,0,0,0,0,0|2,0,1]=4 803 B13R1.575 C=CCSc1ccc(c(c1)CC)O 62a_100000210623_100012338938 [1,0,0,0,0,0|2,0,1]=4 804 B13R1.575 C=CCSc1ccc(c(c1)OC)Br 62a_100000210623_100012353699 [1,0,0,0,0,0|2,0,1]=4 805 B13R1.575 C=CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210623 [1,0,0,0,0,0|2,0,1]=4 806 B13R1.575 C=CCSc1ccc(c(c1)OC)C 62a_100000210623_100011830276 [1,0,0,0,0,0|2,0,1]=4 807 B13R1.575 C=CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210623 [1,0,0,0,0,0|2,0,1]=4 808 B13R1.575 C=CCSc1ccc(c(c1)OC)Cl 62a_100000210623_100011356853 [1,0,0,0,0,0|2,0,1]=4 809 B13R1.575 C=CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210623 [1,0,0,0,0,0|2,0,1]=4 810 B13R1.575 C=CCSc1ccc(c(c1)OC)F 62a_100000210623_100011934186 [1,0,0,0,0,0|2,0,1]=4 811 B13R1.575 C=CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210623 [1,0,0,0,0,0|2,0,1]=4 812 B13R1.575 C=CCSc1ccc(c(c1)OC)N 62a_100000210623_100015196925 [1,0,0,0,0,0|2,0,1]=4 813 B13R1.575 C=CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210623 [1,0,0,0,0,0|2,0,1]=4 814 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [1,0,0,0,0,0|1,0,1]=3 815 B13R1.575 C=CCSc1ccc(c(n1)OC)O 62a_100000210623_100010893133 [1,0,0,0,0,0|2,0,1]=4 816 B13R1.575 CC=NNc1ccc(c(c1)OC)F 4a_102515433066_200000210099 [1,0,0,0,0,0|3,0,0]=4 817 B13R1.575 CCCCc1c[nH]c(=O)c(c1)OC 271570a_100020621405_100010125397 [1,0,0,0,0,0|1,0,2]=4 818 B13R1.575 CCCCc1cc(c(cn1)C)OC 271570a_100020621405_100010067687 [1,0,0,0,0,0|2,0,1]=4 819 B13R1.575 CCCCc1cc(c(cn1)F)OC 271570a_100020621405_200010136270 [1,0,0,0,0,0|2,0,1]=4 820 B13R1.575 CCCCc1cc(c(cn1)N)OC 271570a_100020621405_100009887741 [1,0,0,0,0,0|2,0,1]=4 821 B13R1.575 CCCCc1ccc(c(c1)C#N)O 271570a_100020621405_100000687585 [1,0,0,0,0,0|2,0,1]=4 822 B13R1.575 CCCCc1ccc(c(c1)C=O)O 271570a_100020621405_100000186750 [1,0,0,0,0,0|2,0,1]=4 823 B13R1.575 CCCCc1ccc(c(c1)CC)Br 271570a_100020621405_100010244631 [1,0,0,0,0,0|2,0,1]=4 824 B13R1.575 CCCCc1ccc(c(c1)CC)F 271570a_100020621405_100010244625 [1,0,0,0,0,0|2,0,1]=4 825 B13R1.575 CCCCc1ccc(c(c1)CC)N 271570a_100020621405_100000686106 [1,0,0,0,0,0|2,0,1]=4 826 B13R1.575 CCCCc1ccc(c(c1)CC)O 271570a_100020621405_100012338938 [1,0,0,0,0,0|1,0,1]=3 827 B13R1.575 CCCCc1ccc(c(c1)CN)O 271570a_100020621405_100000730032 [1,0,0,0,0,0|2,0,1]=4 828 B13R1.575 CCCCc1ccc(c(c1)CO)O 271570a_100020621405_100000184703 [1,0,0,0,0,0|2,0,1]=4 829 B13R1.575 CCCCc1ccc(c(c1)NC)C 271570a_100020621405_100020629602 [1,0,0,0,0,0|2,0,1]=4 830 B13R1.575 CCCCc1ccc(c(c1)NC)F 271570a_100020621405_100011314990 [1,0,0,0,0,0|2,0,1]=4 831 B13R1.575 CCCCc1ccc(c(c1)NC)N 271570a_100020621405_100000694363 [1,0,0,0,0,0|2,0,1]=4 832 B13R1.575 CCCCc1ccc(c(c1)OC)Br 271570a_100020621405_100012353699 [1,0,0,0,0,0|1,0,1]=3 833 B13R1.575 CCCCc1ccc(c(c1)OC)C 271570a_100020621405_100011830276 [1,0,0,0,0,0|1,0,1]=3 834 B13R1.575 CCCCc1ccc(c(c1)OC)Cl 271570a_100020621405_100011356853 [1,0,0,0,0,0|1,0,1]=3 835 B13R1.575 CCCCc1ccc(c(c1)OC)F 271570a_100020621405_100011934186 [1,0,0,0,0,0|1,0,1]=3 836 B13R1.575 CCCCc1ccc(c(c1)OC)N 271570a_100020621405_100011279103 [1,0,0,0,0,0|1,0,1]=3 837 B13R1.575 CCCCc1ccc(c(c1)OC)O 271570a_100020621405_100000694246 [1,0,0,0,0,0|0,0,1]=2 838 B13R1.575 CCCCc1ccc(c(c1)SC)F 271570a_100020621405_100010341305 [1,0,0,0,0,0|1,1,1]=4 839 B13R1.575 CCCCc1ccc(c(n1)OC)N 271570a_100020621405_100000687816 [1,0,0,0,0,0|2,0,1]=4 840 B13R1.575 CCCCc1ccc(c(n1)OC)O 271570a_100020621405_100010893133 [1,0,0,0,0,0|1,0,1]=3 841 B13R1.575 CCCCc1cnc(c(c1)OC)C 271570a_100020621405_100010254219 [1,0,0,0,0,0|2,0,1]=4 842 B13R1.575 CCCCc1cnc(c(c1)OC)F 271570a_100020621405_100010214931 [1,0,0,0,0,0|2,0,1]=4 843 B13R1.575 CCCCc1cnc(c(c1)OC)N 271570a_100020621405_106354213024 [1,0,0,0,0,0|2,0,1]=4 844 B13R1.575 CCCCc1cnc(c(n1)OC)O 271570a_100020621405_200010365344 [1,0,0,0,0,0|2,0,1]=4 845 B13R1.575 CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210303 [1,0,0,0,0,0|2,0,1]=4 846 B13R1.575 CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210303 [1,0,0,0,0,0|2,0,1]=4 847 B13R1.575 CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210303 [1,0,0,0,0,0|2,0,1]=4 848 B13R1.575 CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210303 [1,0,0,0,0,0|2,0,1]=4 849 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210303 [1,0,0,0,0,0|2,0,1]=4 850 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210303 [1,0,0,0,0,0|2,0,1]=4 851 B13R1.575 CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210303 [1,0,0,0,0,0|2,0,1]=4 852 B13R1.575 CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210303 [1,0,0,0,0,0|2,0,1]=4 853 B13R1.575 CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210303 [1,0,0,0,0,0|2,0,1]=4 854 B13R1.575 CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210303 [1,0,0,0,0,0|1,0,1]=3 855 B13R1.575 CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210303 [1,0,0,0,0,0|2,0,1]=4 856 B13R1.575 CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210303 [1,0,0,0,0,0|2,0,1]=4 857 B13R1.575 CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210303 [1,0,0,0,0,0|2,0,1]=4 858 B13R1.575 CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210303 [1,0,0,0,0,0|2,0,1]=4 859 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210303 [1,0,0,0,0,0|2,0,1]=4 860 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210303 [1,0,0,0,0,0|2,0,1]=4 861 B13R1.575 CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210303 [1,0,0,0,0,0|2,0,1]=4 862 B13R1.575 CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210303 [1,0,0,0,0,0|2,0,1]=4 863 B13R1.575 CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210303 [1,0,0,0,0,0|2,0,1]=4 864 B13R1.575 CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210303 [1,0,0,0,0,0|2,0,1]=4 865 B13R1.575 CCCSc1ccc(c(c1)CC)O 62a_100000210303_100012338938 [1,0,0,0,0,0|2,0,1]=4 866 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100000210303_100012353699 [1,0,0,0,0,0|2,0,1]=4 867 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210303 [1,0,0,0,0,0|2,0,1]=4 868 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100000210303_100011830276 [1,0,0,0,0,0|2,0,1]=4 869 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210303 [1,0,0,0,0,0|2,0,1]=4 870 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100000210303_100011356853 [1,0,0,0,0,0|2,0,1]=4 871 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210303 [1,0,0,0,0,0|2,0,1]=4 872 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100000210303_100011934186 [1,0,0,0,0,0|2,0,1]=4 873 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210303 [1,0,0,0,0,0|2,0,1]=4 874 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100000210303_100015196925 [1,0,0,0,0,0|2,0,1]=4 875 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210303 [1,0,0,0,0,0|2,0,1]=4 876 B13R1.575 CCCSc1ccc(c(c1)OC)O 62a_100000210303_100000694246 [1,0,0,0,0,0|1,0,1]=3 877 B13R1.575 CCCSc1ccc(c(n1)OC)O 62a_100000210303_100010893133 [1,0,0,0,0,0|2,0,1]=4 878 B13R1.575 CCNCc1ccc(c(c1)OC)Br 207a_100015525214_100010244714 [1,0,0,0,0,0|2,0,1]=4 879 B13R1.575 CCNCc1ccc(c(c1)OC)Br 2230a_100015525214_100010110085 [1,0,0,0,0,0|2,0,1]=4 880 B13R1.575 CCNCc1ccc(c(c1)OC)Br 270004a_100015525214_100010244714 [1,0,0,0,0,0|2,0,1]=4 881 B13R1.575 CCNCc1ccc(c(c1)OC)C 207a_100015525214_100000719150 [1,0,0,0,0,0|2,0,1]=4 882 B13R1.575 CCNCc1ccc(c(c1)OC)C 270004a_100015525214_100000719150 [1,0,0,0,0,0|2,0,1]=4 883 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 207a_100015525214_100011998524 [1,0,0,0,0,0|2,0,1]=4 884 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210202 [1,0,0,0,0,0|2,0,1]=4 885 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015525214_200010214485 [1,0,0,0,0,0|2,0,1]=4 886 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 270004a_100015525214_100011998524 [1,0,0,0,0,0|2,0,1]=4 887 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210202 [1,0,0,0,0,0|2,0,1]=4 888 B13R1.575 CCNCc1ccc(c(c1)OC)F 207a_100015525214_100000692873 [1,0,0,0,0,0|2,0,1]=4 889 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100015525214_100012349856 [1,0,0,0,0,0|2,0,1]=4 890 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210202 [1,0,0,0,0,0|2,0,1]=4 891 B13R1.575 CCNCc1ccc(c(c1)OC)F 270004a_100015525214_100000692873 [1,0,0,0,0,0|2,0,1]=4 892 B13R1.575 CCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210202 [1,0,0,0,0,0|2,0,1]=4 893 B13R1.575 CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210202 [1,0,0,0,0,0|1,0,1]=3 894 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210202 [1,0,0,0,0,0|2,0,1]=4 895 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100121572206_100010110085 [1,0,0,0,0,0|2,0,1]=4 896 B13R1.575 CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210202 [1,0,0,0,0,0|2,0,1]=4 897 B13R1.575 CCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210202 [1,0,0,0,0,0|2,0,1]=4 898 B13R1.575 CCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210202 [1,0,0,0,0,0|2,0,1]=4 899 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210202 [1,0,0,0,0,0|2,0,1]=4 900 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100121572206_200010214485 [1,0,0,0,0,0|2,0,1]=4 901 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210202 [1,0,0,0,0,0|2,0,1]=4 902 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100121572206_100012349856 [1,0,0,0,0,0|2,0,1]=4 903 B13R1.575 CCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210202 [1,0,0,0,0,0|2,0,1]=4 904 B13R1.575 CCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210202 [1,0,0,0,0,0|2,0,1]=4 905 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100000210202_100010110085 [1,0,0,0,0,0|2,0,1]=4 906 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210202 [1,0,0,0,0,0|2,0,1]=4 907 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_100000210202_200010214485 [1,0,0,0,0,0|2,0,1]=4 908 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210202 [1,0,0,0,0,0|2,0,1]=4 909 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100000210202_100012349856 [1,0,0,0,0,0|2,0,1]=4 910 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210202 [1,0,0,0,0,0|2,0,1]=4 911 B13R1.575 CCc1cc(ccc1Br)NCC=O 2230a_100010109747_200015260668 [1,0,0,0,0,0|3,0,0]=4 912 B13R1.575 CCc1cc(ccc1Br)NCC=O 34a_100010109747_200009817547 [1,0,0,0,0,0|3,0,0]=4 913 B13R1.575 CCc1cc(ccc1Br)NCC=O 7a_100010109747_200015260668 [1,0,0,0,0,0|3,0,0]=4 914 B13R1.575 CCc1cc(ccc1Br)SCC=O 62a_100010244631_200015260668 [1,0,0,0,0,0|3,0,0]=4 915 B13R1.575 CCc1cc(ccc1Br)SCC=O 62a_200015260668_100010244631 [1,0,0,0,0,0|3,0,0]=4 916 B13R1.575 CCc1cc(ccc1Cl)OCC=O 34a_100000212063_200009817547 [1,0,0,0,0,0|3,0,0]=4 917 B13R1.575 CCc1cc(ccc1Cl)OCC=O 7a_100000212063_200015260668 [1,0,0,0,0,0|3,0,0]=4 918 B13R1.575 CCc1cc(ccc1F)SCC=O 62a_100010244625_200015260668 [1,0,0,0,0,0|3,0,0]=4 919 B13R1.575 CCc1cc(ccc1F)SCC=O 62a_200015260668_100010244625 [1,0,0,0,0,0|3,0,0]=4 920 B13R1.575 CCc1cc(ccc1N)SCC=O 62a_100000686106_200015260668 [1,0,0,0,0,0|3,0,0]=4 921 B13R1.575 CCc1cc(ccc1N)SCC=O 62a_200015260668_100000686106 [1,0,0,0,0,0|3,0,0]=4 922 B13R1.575 CCc1cc(ccc1O)SCC=O 62a_200015260668_100012338938 [1,0,0,0,0,0|2,0,0]=3 923 B13R1.575 CCc1cc(ccc1O)SCOC 62a_100000766300_100012338938 [1,0,0,0,0,0|3,0,0]=4 924 B13R1.575 CCc1cc(ccc1O)SCSC 62a_100011218213_100012338938 [1,0,0,0,0,0|3,0,0]=4 925 B13R1.575 CNCCc1ccc(c(c1)OC)O 2230a_106832991635_100010741665 [1,0,0,0,0,0|1,0,0]=2 926 B13R1.575 CNCCc1ccc(c(c1)OC)O 34a_100000756042_200000210301 [1,0,0,0,0,0|1,0,0]=2 927 B13R1.575 CNCCc1ccc(c(c1)OC)O 7a_106832991635_100010741665 [1,0,0,0,0,0|1,0,0]=2 928 B13R1.575 CNc1cc(ccc1C)SCC=O 62a_100020629602_200015260668 [1,0,0,0,0,0|3,0,0]=4 929 B13R1.575 CNc1cc(ccc1C)SCC=O 62a_200015260668_100020629602 [1,0,0,0,0,0|3,0,0]=4 930 B13R1.575 CNc1cc(ccc1F)SCC=O 62a_100011314990_200015260668 [1,0,0,0,0,0|3,0,0]=4 931 B13R1.575 CNc1cc(ccc1F)SCC=O 62a_200015260668_100011314990 [1,0,0,0,0,0|3,0,0]=4 932 B13R1.575 CNc1cc(ccc1N)SCC=O 62a_100000694363_200015260668 [1,0,0,0,0,0|3,0,0]=4 933 B13R1.575 COCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000766300 [1,0,0,0,0,0|3,0,0]=4 934 B13R1.575 COCNc1ccc(c(c1)OC)C 2230a_100011279678_100000766300 [1,0,0,0,0,0|3,0,0]=4 935 B13R1.575 COCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000766300 [1,0,0,0,0,0|3,0,0]=4 936 B13R1.575 COCNc1ccc(c(c1)OC)F 2230a_100000701188_100000766300 [1,0,0,0,0,0|3,0,0]=4 937 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100000766300_100012353699 [1,0,0,0,0,0|3,0,0]=4 938 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100012353699_100000766300 [1,0,0,0,0,0|3,0,0]=4 939 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100000766300_100011830276 [1,0,0,0,0,0|3,0,0]=4 940 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100011830276_100000766300 [1,0,0,0,0,0|3,0,0]=4 941 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100000766300_100011356853 [1,0,0,0,0,0|3,0,0]=4 942 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000766300 [1,0,0,0,0,0|3,0,0]=4 943 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100000766300_100011934186 [1,0,0,0,0,0|3,0,0]=4 944 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100011934186_100000766300 [1,0,0,0,0,0|3,0,0]=4 945 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100000766300_100015196925 [1,0,0,0,0,0|3,0,0]=4 946 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100011279103_100000766300 [1,0,0,0,0,0|3,0,0]=4 947 B13R1.575 COCSc1ccc(c(c1)OC)O 62a_100000766300_100000694246 [1,0,0,0,0,0|2,0,0]=3 948 B13R1.575 COCSc1ccc(c(n1)OC)O 62a_100000766300_100010893133 [1,0,0,0,0,0|3,0,0]=4 949 B13R1.575 COc1cc(c[nH]c1=O)SCC=O 62a_200015260668_100010125397 [1,0,0,0,0,0|2,0,1]=4 950 B13R1.575 COc1cc(ccc1Br)NCC=O 2230a_100000765947_200015260668 [1,0,0,0,0,0|2,0,0]=3 951 B13R1.575 COc1cc(ccc1Br)NCC=O 34a_100000765947_200009817547 [1,0,0,0,0,0|2,0,0]=3 952 B13R1.575 COc1cc(ccc1Br)NCSC 2230a_100000765947_100011218213 [1,0,0,0,0,0|3,0,0]=4 953 B13R1.575 COc1cc(ccc1Br)NCSC 34a_100000765947_100011218213 [1,0,0,0,0,0|3,0,0]=4 954 B13R1.575 COc1cc(ccc1Br)OCC=O 34a_100011827694_200009817547 [1,0,0,0,0,0|2,0,0]=3 955 B13R1.575 COc1cc(ccc1Br)OCC=O 7a_100011827694_200015260668 [1,0,0,0,0,0|2,0,0]=3 956 B13R1.575 COc1cc(ccc1Br)OCSC 34a_100011827694_100011218213 [1,0,0,0,0,0|3,0,0]=4 957 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_100012353699_200015260668 [1,0,0,0,0,0|2,0,0]=3 958 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_200015260668_100012353699 [1,0,0,0,0,0|2,0,0]=3 959 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100011218213_100012353699 [1,0,0,0,0,0|3,0,0]=4 960 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100012353699_100011218213 [1,0,0,0,0,0|3,0,0]=4 961 B13R1.575 COc1cc(ccc1C)NCC=O 2230a_100011279678_200015260668 [1,0,0,0,0,0|2,0,0]=3 962 B13R1.575 COc1cc(ccc1C)NCC=O 34a_100011279678_200009817547 [1,0,0,0,0,0|2,0,0]=3 963 B13R1.575 COc1cc(ccc1C)NCSC 2230a_100011279678_100011218213 [1,0,0,0,0,0|3,0,0]=4 964 B13R1.575 COc1cc(ccc1C)NCSC 34a_100011279678_100011218213 [1,0,0,0,0,0|3,0,0]=4 965 B13R1.575 COc1cc(ccc1C)OCC=O 34a_100009865632_200009817547 [1,0,0,0,0,0|2,0,0]=3 966 B13R1.575 COc1cc(ccc1C)OCC=O 7a_100009865632_200015260668 [1,0,0,0,0,0|2,0,0]=3 967 B13R1.575 COc1cc(ccc1C)OCSC 34a_100009865632_100011218213 [1,0,0,0,0,0|3,0,0]=4 968 B13R1.575 COc1cc(ccc1C)SCC=O 62a_100011830276_200015260668 [1,0,0,0,0,0|2,0,0]=3 969 B13R1.575 COc1cc(ccc1C)SCC=O 62a_200015260668_100011830276 [1,0,0,0,0,0|2,0,0]=3 970 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011218213_100011830276 [1,0,0,0,0,0|3,0,0]=4 971 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011830276_100011218213 [1,0,0,0,0,0|3,0,0]=4 972 B13R1.575 COc1cc(ccc1Cl)NCC=O 2230a_100000742311_200015260668 [1,0,0,0,0,0|2,0,0]=3 973 B13R1.575 COc1cc(ccc1Cl)NCC=O 34a_100000742311_200009817547 [1,0,0,0,0,0|2,0,0]=3 974 B13R1.575 COc1cc(ccc1Cl)NCSC 2230a_100000742311_100011218213 [1,0,0,0,0,0|3,0,0]=4 975 B13R1.575 COc1cc(ccc1Cl)NCSC 34a_100000742311_100011218213 [1,0,0,0,0,0|3,0,0]=4 976 B13R1.575 COc1cc(ccc1Cl)OCC=O 34a_100012186310_200009817547 [1,0,0,0,0,0|2,0,0]=3 977 B13R1.575 COc1cc(ccc1Cl)OCC=O 7a_100012186310_200015260668 [1,0,0,0,0,0|2,0,0]=3 978 B13R1.575 COc1cc(ccc1Cl)OCSC 34a_100012186310_100011218213 [1,0,0,0,0,0|3,0,0]=4 979 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_100011356853_200015260668 [1,0,0,0,0,0|2,0,0]=3 980 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_200015260668_100011356853 [1,0,0,0,0,0|2,0,0]=3 981 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011218213_100011356853 [1,0,0,0,0,0|3,0,0]=4 982 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011356853_100011218213 [1,0,0,0,0,0|3,0,0]=4 983 B13R1.575 COc1cc(ccc1F)NCC=O 2230a_100000701188_200015260668 [1,0,0,0,0,0|2,0,0]=3 984 B13R1.575 COc1cc(ccc1F)NCC=O 34a_100000701188_200009817547 [1,0,0,0,0,0|2,0,0]=3 985 B13R1.575 COc1cc(ccc1F)NCSC 2230a_100000701188_100011218213 [1,0,0,0,0,0|3,0,0]=4 986 B13R1.575 COc1cc(ccc1F)NCSC 34a_100000701188_100011218213 [1,0,0,0,0,0|3,0,0]=4 987 B13R1.575 COc1cc(ccc1F)OCC=O 34a_100012001760_200009817547 [1,0,0,0,0,0|2,0,0]=3 988 B13R1.575 COc1cc(ccc1F)OCC=O 7a_100012001760_200015260668 [1,0,0,0,0,0|2,0,0]=3 989 B13R1.575 COc1cc(ccc1F)OCSC 34a_100012001760_100011218213 [1,0,0,0,0,0|3,0,0]=4 990 B13R1.575 COc1cc(ccc1F)SCC=O 62a_100011934186_200015260668 [1,0,0,0,0,0|2,0,0]=3 991 B13R1.575 COc1cc(ccc1F)SCC=O 62a_200015260668_100011934186 [1,0,0,0,0,0|2,0,0]=3 992 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011218213_100011934186 [1,0,0,0,0,0|3,0,0]=4 993 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011934186_100011218213 [1,0,0,0,0,0|3,0,0]=4 994 B13R1.575 COc1cc(ccc1I)NCC=O 34a_100000746945_200009817547 [1,0,0,0,0,0|2,0,0]=3 995 B13R1.575 COc1cc(ccc1I)NCSC 34a_100000746945_100011218213 [1,0,0,0,0,0|3,0,0]=4 996 B13R1.575 COc1cc(ccc1N)OCC=O 34a_100015326901_200009817547 [1,0,0,0,0,0|2,0,0]=3 997 B13R1.575 COc1cc(ccc1N)OCC=O 7a_100015326901_200015260668 [1,0,0,0,0,0|2,0,0]=3 998 B13R1.575 COc1cc(ccc1N)OCSC 34a_100015326901_100011218213 [1,0,0,0,0,0|3,0,0]=4 999 B13R1.575 COc1cc(ccc1N)SCC=O 62a_100011279103_200015260668 [1,0,0,0,0,0|2,0,0]=3 1000 B13R1.575 COc1cc(ccc1N)SCC=O 62a_200015260668_100015196925 [1,0,0,0,0,0|2,0,0]=3 1001 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011218213_100015196925 [1,0,0,0,0,0|3,0,0]=4 1002 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011279103_100011218213 [1,0,0,0,0,0|3,0,0]=4 1003 B13R1.575 COc1cc(ccc1O)CCN[13CH3] 34a_100000756042_200025704644 [1,0,0,0,0,0|1,0,0]=2 1004 B13R1.575 COc1cc(ccc1O)CCSC 62a_200000210301_100010741665 [1,0,0,0,0,0|1,0,0]=2 1005 B13R1.575 COc1cc(ccc1O)CCS[13CH3] 62a_200025704644_100010741665 [1,0,0,0,0,0|1,0,0]=2 1006 B13R1.575 COc1cc(ccc1O)CNCF 34a_100000185554_100015361967 [1,0,0,0,0,0|2,0,1]=4 1007 B13R1.575 COc1cc(ccc1O)NCC=O 34a_100000726020_200009817547 [1,0,0,0,0,0|1,0,0]=2 1008 B13R1.575 COc1cc(ccc1O)NCCF 34a_100000726020_100011217306 [1,0,0,0,0,0|2,0,1]=4 1009 B13R1.575 COc1cc(ccc1O)NCCO 34a_100000726020_100000211926 [1,0,0,0,0,0|1,0,2]=4 1010 B13R1.575 COc1cc(ccc1O)NCSC 34a_100000726020_100011218213 [1,0,0,0,0,0|2,0,0]=3 1011 B13R1.575 COc1cc(ccc1O)SCC#N 62a_100011215382_100000694246 [1,0,0,0,0,0|2,0,1]=4 1012 B13R1.575 COc1cc(ccc1O)SCC=O 62a_200015260668_100000694246 [1,0,0,0,0,0|1,0,0]=2 1013 B13R1.575 COc1cc(ccc1O)SCCF 62a_100011217306_100000694246 [1,0,0,0,0,0|2,0,1]=4 1014 B13R1.575 COc1cc(ccc1O)SCCO 62a_100000211926_100000694246 [1,0,0,0,0,0|1,0,2]=4 1015 B13R1.575 COc1cc(ccc1O)SCSC 62a_100011218213_100000694246 [1,0,0,0,0,0|2,0,0]=3 1016 B13R1.575 COc1cc(cnc1C)SCC=O 62a_100010254219_200015260668 [1,0,0,0,0,0|3,0,0]=4 1017 B13R1.575 COc1cc(cnc1C)SCC=O 62a_200015260668_100010254219 [1,0,0,0,0,0|3,0,0]=4 1018 B13R1.575 COc1cc(cnc1F)SCC=O 62a_100010214931_200015260668 [1,0,0,0,0,0|3,0,0]=4 1019 B13R1.575 COc1cc(cnc1F)SCC=O 62a_200015260668_100010214931 [1,0,0,0,0,0|3,0,0]=4 1020 B13R1.575 COc1cc(cnc1N)SCC=O 62a_106354213024_200015260668 [1,0,0,0,0,0|3,0,0]=4 1021 B13R1.575 COc1cc(cnc1N)SCC=O 62a_200015260668_106354213024 [1,0,0,0,0,0|3,0,0]=4 1022 B13R1.575 COc1cc(ncc1C)SCC=O 62a_100010067687_200015260668 [1,0,0,0,0,0|3,0,0]=4 1023 B13R1.575 COc1cc(ncc1C)SCC=O 62a_200015260668_100010067687 [1,0,0,0,0,0|3,0,0]=4 1024 B13R1.575 COc1cc(ncc1F)SCC=O 62a_200010136270_200015260668 [1,0,0,0,0,0|3,0,0]=4 1025 B13R1.575 COc1cc(ncc1F)SCC=O 62a_200015260668_200010136270 [1,0,0,0,0,0|3,0,0]=4 1026 B13R1.575 COc1cc(ncc1N)SCC=O 62a_100009887741_200015260668 [1,0,0,0,0,0|3,0,0]=4 1027 B13R1.575 COc1cc(ncc1N)SCC=O 62a_200015260668_100009887741 [1,0,0,0,0,0|3,0,0]=4 1028 B13R1.575 COc1nc(ccc1N)SCC=O 62a_100000687816_200015260668 [1,0,0,0,0,0|3,0,0]=4 1029 B13R1.575 COc1nc(ccc1N)SCC=O 62a_200015260668_100000687816 [1,0,0,0,0,0|3,0,0]=4 1030 B13R1.575 COc1nc(ccc1O)SCC=O 62a_200015260668_100010893133 [1,0,0,0,0,0|2,0,0]=3 1031 B13R1.575 COc1nc(ccc1O)SCSC 62a_100011218213_100010893133 [1,0,0,0,0,0|3,0,0]=4 1032 B13R1.575 COc1nc(cnc1O)SCC=O 62a_200010365344_200015260668 [1,0,0,0,0,0|3,0,0]=4 1033 B13R1.575 COc1nc(cnc1O)SCC=O 62a_200015260668_200010365344 [1,0,0,0,0,0|3,0,0]=4 1034 B13R1.575 CSc1cc(ccc1F)SCC=O 62a_100010341305_200015260668 [1,0,0,0,0,0|2,1,0]=4 1035 B13R1.575 CSc1cc(ccc1F)SCC=O 62a_200015260668_100010341305 [1,0,0,0,0,0|2,1,0]=4 1036 B13R1.575 N#Cc1cc(ccc1O)NCC=O 34a_100011249283_200009817547 [1,0,0,0,0,0|3,0,0]=4 1037 B13R1.575 N#Cc1cc(ccc1O)SCC=O 62a_200015260668_100000687585 [1,0,0,0,0,0|3,0,0]=4 1038 B13R1.575 NCc1cc(ccc1O)SCC=O 62a_100000730032_200015260668 [1,0,0,0,0,0|3,0,0]=4 1039 B13R1.575 NCc1cc(ccc1O)SCC=O 62a_200015260668_100000730032 [1,0,0,0,0,0|3,0,0]=4 1040 B13R1.575 O=CCSc1ccc(c(c1)C=O)O 62a_200015260668_100000186750 [1,0,0,0,0,0|3,0,0]=4 1041 B13R1.575 O=CCSc1ccc(c(c1)CO)O 62a_100000184703_200015260668 [1,0,0,0,0,0|3,0,0]=4 1042 B13R1.575 O=CCSc1ccc(c(c1)CO)O 62a_200015260668_100000184703 [1,0,0,0,0,0|3,0,0]=4 1043 B13R1.643 C=C(C)CNc1cccc(c1)CC 2230a_100000211250_100000748629 [1,0,0,0,0,0|3,0,0]=4 1044 B13R1.643 C=C(C)CNc1cccc(c1)CC 34a_100000211250_100000748629 [1,0,0,0,0,0|3,0,0]=4 1045 B13R1.643 C=C(C)CNc1cccc(c1)CC 7a_100000211250_100000748629 [1,0,0,0,0,0|3,0,0]=4 1046 B13R1.643 C=C(C)CNc1cccc(c1)OC 34a_100000210024_100000748629 [1,0,0,0,0,0|2,0,0]=3 1047 B13R1.643 C=C(C)CNc1cccc(c1)SC 2230a_100000210049_100000748629 [1,0,0,0,0,0|2,1,0]=4 1048 B13R1.643 C=C(C)CNc1cccc(c1)SC 34a_100000210049_100000748629 [1,0,0,0,0,0|2,1,0]=4 1049 B13R1.643 C=C(C)COc1cccc(c1)CC 34a_100000211550_100000748629 [1,0,0,0,0,0|3,0,0]=4 1050 B13R1.643 C=C(C)COc1cccc(c1)CC 7a_100000211550_100000748629 [1,0,0,0,0,0|3,0,0]=4 1051 B13R1.643 C=C(C)COc1cccc(c1)NC 2230a_100000243820_200000210301 [1,0,0,0,0,0|3,0,0]=4 1052 B13R1.643 C=C(C)COc1cccc(c1)NC 34a_100000243820_200000210301 [1,0,0,0,0,0|3,0,0]=4 1053 B13R1.643 C=C(C)COc1cccc(c1)NC 34a_100000756613_100000748629 [1,0,0,0,0,0|3,0,0]=4 1054 B13R1.643 C=C(C)COc1cccc(c1)NC 7a_100000243820_200000210301 [1,0,0,0,0,0|3,0,0]=4 1055 B13R1.643 C=C(C)COc1cccc(c1)NC 7a_100000756613_100000748629 [1,0,0,0,0,0|3,0,0]=4 1056 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 2230a_100000243820_200025704644 [1,0,0,0,0,0|3,0,0]=4 1057 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 34a_100000243820_200025704644 [1,0,0,0,0,0|3,0,0]=4 1058 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 7a_100000243820_200025704644 [1,0,0,0,0,0|3,0,0]=4 1059 B13R1.643 C=C(C)COc1cccc(c1)OC 34a_100000211255_100000748629 [1,0,0,0,0,0|2,0,0]=3 1060 B13R1.643 C=C(C)COc1cccc(c1)OC 7a_100000211255_100000748629 [1,0,0,0,0,0|2,0,0]=3 1061 B13R1.643 C=C(C)COc1cccc(c1)SC 34a_100011265683_100000748629 [1,0,0,0,0,0|2,1,0]=4 1062 B13R1.643 C=C(C)COc1cccc(c1)SC 7a_100011265683_100000748629 [1,0,0,0,0,0|2,1,0]=4 1063 B13R1.643 C=C(C)COc1ccnc(c1)OC 34a_100012181050_100000748629 [1,0,0,0,0,0|3,0,0]=4 1064 B13R1.643 C=C(C)COc1cncc(c1)OC 34a_100000084572_100000748629 [1,0,0,0,0,0|3,0,0]=4 1065 B13R1.643 C=C(C)COc1cncc(c1)OC 7a_100000084572_100000748629 [1,0,0,0,0,0|3,0,0]=4 1066 B13R1.643 C=C(C)CSc1cc(ccn1)OC 62a_100000748629_100011216251 [1,0,0,0,0,0|3,0,0]=4 1067 B13R1.643 C=C(C)CSc1cc(ccn1)OC 62a_100009817693_100000211660 [1,0,0,0,0,0|3,0,0]=4 1068 B13R1.643 C=C(C)CSc1cccc(c1)CC 62a_100000748629_100011263222 [1,0,0,0,0,0|3,0,0]=4 1069 B13R1.643 C=C(C)CSc1cccc(c1)CC 62a_100011263222_100000211660 [1,0,0,0,0,0|3,0,0]=4 1070 B13R1.643 C=C(C)CSc1cccc(c1)NC 62a_100000219648_100000211660 [1,0,0,0,0,0|3,0,0]=4 1071 B13R1.643 C=C(C)CSc1cccc(c1)NC 62a_100000748629_100000219648 [1,0,0,0,0,0|3,0,0]=4 1072 B13R1.643 C=C(C)CSc1cccc(c1)OC 62a_100000748629_100000170001 [1,0,0,0,0,0|2,0,0]=3 1073 B13R1.643 C=C(C)CSc1cccc(c1)SC 62a_100000748629_100011215954 [1,0,0,0,0,0|2,1,0]=4 1074 B13R1.643 C=C(C)CSc1cccc(c1)SC 62a_100011215954_100000211660 [1,0,0,0,0,0|2,1,0]=4 1075 B13R1.643 C=C(C)CSc1cccc(n1)OC 62a_100000748629_100000760917 [1,0,0,0,0,0|3,0,0]=4 1076 B13R1.643 C=C(C)CSc1cccc(n1)OC 62a_100000760917_100000211660 [1,0,0,0,0,0|3,0,0]=4 1077 B13R1.643 C=C(C)CSc1ccnc(c1)OC 62a_100000117307_100000211660 [1,0,0,0,0,0|3,0,0]=4 1078 B13R1.643 C=C(C)CSc1ccnc(c1)OC 62a_100000748629_100000117307 [1,0,0,0,0,0|3,0,0]=4 1079 B13R1.643 C=C(C)CSc1cncc(c1)OC 62a_100000050176_100000211660 [1,0,0,0,0,0|3,0,0]=4 1080 B13R1.643 C=C(C)CSc1cncc(c1)OC 62a_100000748629_100000050176 [1,0,0,0,0,0|3,0,0]=4 1081 B13R1.643 C=C(F)CNc1cccc(c1)OC 34a_100000210024_100009893438 [1,0,0,0,0,0|2,0,1]=4 1082 B13R1.643 C=C(F)COc1cccc(c1)OC 34a_100000211255_100009893438 [1,0,0,0,0,0|2,0,1]=4 1083 B13R1.643 C=C(F)COc1cccc(c1)OC 7a_100000211255_100000042424 [1,0,0,0,0,0|2,0,1]=4 1084 B13R1.643 C=C(F)CSc1cccc(c1)OC 62a_100000042424_100000170001 [1,0,0,0,0,0|2,0,1]=4 1085 B13R1.643 C=Cc1cccc(c1)CCC(=O)C 271570a_100011290941_100011279149 [1,0,0,0,0,0|1,0,1]=3 1086 B13R1.643 C=Cc1cccc(c1)CCC(=O)N 271570a_100011290941_100000162029 [1,0,0,0,0,0|2,0,1]=4 1087 B13R1.643 C=Cc1cccc(c1)CNC(=O)C 271570a_100011290941_100000766983 [1,0,0,0,0,0|2,0,1]=4 1088 B13R1.643 CC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200016266566_200025704644 [1,0,0,0,0,0|0,1,2]=4 1089 B13R1.643 CC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200025704644_200016266566 [1,0,0,0,0,0|0,1,2]=4 1090 B13R1.643 CC(=O)CCc1cccc(c1)C#N 1458a_100011998624_200000210301 [1,0,0,0,0,0|2,0,0]=3 1091 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_100011279149_200025704644 [1,0,0,0,0,0|0,1,0]=2 1092 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_200025704644_100011279149 [1,0,0,0,0,0|0,1,0]=2 1093 B13R1.643 CC(=O)COc1cccc(c1)C#N 1458a_100000230692_200000210301 [1,0,0,0,0,0|3,0,0]=4 1094 B13R1.643 CC(=O)NCc1cccc(c1)C#N 11a_100000755147_100015343762 [1,0,0,0,0,0|3,0,0]=4 1095 B13R1.643 CC(=O)NCc1cccc(c1)C#N 1626a_100000755147_100015343762 [1,0,0,0,0,0|3,0,0]=4 1096 B13R1.643 CC(=O)NCc1cccc(c1)C#N 240690a_100000755147_100015343762 [1,0,0,0,0,0|3,0,0]=4 1097 B13R1.643 CC(=O)NCc1cccc(c1)C#N 527a_100000755147_100103153847 [1,0,0,0,0,0|3,0,0]=4 1098 B13R1.643 CC(=O)NCc1cccc(c1)CO 240690a_100011269909_100015343762 [1,0,0,0,0,0|3,0,0]=4 1099 B13R1.643 CC(=O)NCc1cccc(c1)CO 527a_100011269909_100103153847 [1,0,0,0,0,0|3,0,0]=4 1100 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_100000766983_200025704644 [1,0,0,0,0,0|1,1,0]=3 1101 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_200025704644_100000766983 [1,0,0,0,0,0|1,1,0]=3 1102 B13R1.643 CCc1cccc(c1)NCC(=O)N 2230a_100000211250_100000747473 [1,0,0,0,0,0|3,0,0]=4 1103 B13R1.643 CCc1cccc(c1)NCC(=O)N 34a_100000211250_100000187820 [1,0,0,0,0,0|3,0,0]=4 1104 B13R1.643 CCc1cccc(c1)NCC(=O)N 7a_100000211250_100000187820 [1,0,0,0,0,0|3,0,0]=4 1105 B13R1.643 CCc1cccc(c1)NCC(=O)[O-] 34a_100000211250_100020667443 [1,0,0,0,0,0|3,0,0]=4 1106 B13R1.643 CCc1cccc(c1)OCC(=O)N 34a_100000211550_100000187820 [1,0,0,0,0,0|3,0,0]=4 1107 B13R1.643 CCc1cccc(c1)OCC(=O)N 7a_100000211550_100000187820 [1,0,0,0,0,0|3,0,0]=4 1108 B13R1.643 CCc1cccc(c1)OCC(=O)[O-] 34a_100000211550_100020667443 [1,0,0,0,0,0|3,0,0]=4 1109 B13R1.643 CCc1cccc(c1)SCC(=O)N 62a_100000747473_100011263222 [1,0,0,0,0,0|3,0,0]=4 1110 B13R1.643 CCc1cccc(c1)SCC(=O)N 62a_100011263222_100000747473 [1,0,0,0,0,0|3,0,0]=4 1111 B13R1.643 CCc1cccc(c1)SCC(=O)[O-] 62a_100011263222_100020667443 [1,0,0,0,0,0|3,0,0]=4 1112 B13R1.643 CCc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011263222 [1,0,0,0,0,0|3,0,0]=4 1113 B13R1.643 CNc1cccc(c1)OCC(=O)N 34a_100000756613_100000187820 [1,0,0,0,0,0|3,0,0]=4 1114 B13R1.643 CNc1cccc(c1)OCC(=O)N 7a_100000756613_100000187820 [1,0,0,0,0,0|3,0,0]=4 1115 B13R1.643 CNc1cccc(c1)OCC(=O)[O-] 34a_100000756613_100020667443 [1,0,0,0,0,0|3,0,0]=4 1116 B13R1.643 CNc1cccc(c1)SCC(=O)N 62a_100000219648_100000747473 [1,0,0,0,0,0|3,0,0]=4 1117 B13R1.643 CNc1cccc(c1)SCC(=O)N 62a_100000747473_100000219648 [1,0,0,0,0,0|3,0,0]=4 1118 B13R1.643 CNc1cccc(c1)SCC(=O)[O-] 62a_100000219648_100020667443 [1,0,0,0,0,0|3,0,0]=4 1119 B13R1.643 CNc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000219648 [1,0,0,0,0,0|3,0,0]=4 1120 B13R1.643 COc1cc(ccn1)CNC(=O)C 11a_100102525109_100015343762 [1,0,0,0,0,0|2,0,0]=3 1121 B13R1.643 COc1cc(ccn1)CNC(=O)C 1626a_100102525109_100015343762 [1,0,0,0,0,0|2,0,0]=3 1122 B13R1.643 COc1cc(ccn1)CNC(=O)C 240690a_100102525109_100015343762 [1,0,0,0,0,0|2,0,0]=3 1123 B13R1.643 COc1cc(ccn1)CNC(=O)C 527a_100102525109_100103153847 [1,0,0,0,0,0|2,0,0]=3 1124 B13R1.643 COc1cc(ccn1)OCC(=O)N 34a_100012181050_100000187820 [1,0,0,0,0,0|3,0,0]=4 1125 B13R1.643 COc1cc(ccn1)OCC(=O)[O-] 34a_100012181050_100020667443 [1,0,0,0,0,0|3,0,0]=4 1126 B13R1.643 COc1cc(ccn1)SCC(=O)N 62a_100000117307_100000747473 [1,0,0,0,0,0|3,0,0]=4 1127 B13R1.643 COc1cc(ccn1)SCC(=O)N 62a_100000747473_100000117307 [1,0,0,0,0,0|3,0,0]=4 1128 B13R1.643 COc1cc(ccn1)SCC(=O)[O-] 62a_100000117307_100020667443 [1,0,0,0,0,0|3,0,0]=4 1129 B13R1.643 COc1cc(ccn1)SCC(=O)[O-] 62a_100020667443_100000117307 [1,0,0,0,0,0|3,0,0]=4 1130 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000070787_100011713679 [1,0,0,0,0,0|0,0,0]=1 1131 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000234931_200000210301 [1,0,0,0,0,0|0,0,0]=1 1132 B13R1.643 COc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234931_200025704644 [1,0,0,0,0,0|0,0,0]=1 1133 B13R1.643 COc1cccc(c1)CCN(C)C 2230a_100011269071_200000210301 [1,0,0,0,0,0|2,0,0]=3 1134 B13R1.643 COc1cccc(c1)CCN(C)C 2230a_100102631434_100011713679 [1,0,0,0,0,0|2,0,0]=3 1135 B13R1.643 COc1cccc(c1)CCN(C)C 269982a_100011269071_200000210301 [1,0,0,0,0,0|2,0,0]=3 1136 B13R1.643 COc1cccc(c1)CCN(C)C 269982a_100102631434_100011713679 [1,0,0,0,0,0|2,0,0]=3 1137 B13R1.643 COc1cccc(c1)CCN(C)C 34a_100011269071_200000210301 [1,0,0,0,0,0|2,0,0]=3 1138 B13R1.643 COc1cccc(c1)CCN(C)[13CH3] 2230a_100011269071_200025704644 [1,0,0,0,0,0|2,0,0]=3 1139 B13R1.643 COc1cccc(c1)CCN(C)[13CH3] 269982a_100011269071_200025704644 [1,0,0,0,0,0|2,0,0]=3 1140 B13R1.643 COc1cccc(c1)CCN(C)[13CH3] 34a_100011269071_200025704644 [1,0,0,0,0,0|2,0,0]=3 1141 B13R1.643 COc1cccc(c1)CNC(=O)C 11a_100000174954_100015343762 [1,0,0,0,0,0|1,0,0]=2 1142 B13R1.643 COc1cccc(c1)CNC(=O)C 1626a_100000174954_100015343762 [1,0,0,0,0,0|1,0,0]=2 1143 B13R1.643 COc1cccc(c1)CNC(=O)C 240690a_100000174954_100015343762 [1,0,0,0,0,0|1,0,0]=2 1144 B13R1.643 COc1cccc(c1)CNC(=O)C 527a_100000174954_100103153847 [1,0,0,0,0,0|1,0,0]=2 1145 B13R1.643 COc1cccc(c1)CNC(C)C 207a_100138425928_100000170238 [1,0,0,0,0,0|2,0,1]=4 1146 B13R1.643 COc1cccc(c1)CNC(C)C 2230a_100000174954_100000210206 [1,0,0,0,0,0|2,0,1]=4 1147 B13R1.643 COc1cccc(c1)CNC(C)C 2230a_100138425928_100000211672 [1,0,0,0,0,0|2,0,1]=4 1148 B13R1.643 COc1cccc(c1)CNC(C)C 34a_100000174954_100000210206 [1,0,0,0,0,0|2,0,1]=4 1149 B13R1.643 COc1cccc(c1)CNC(C)C 34a_100138425928_100000688526 [1,0,0,0,0,0|2,0,1]=4 1150 B13R1.643 COc1cccc(c1)COC(C)C 34a_100000198976_100000210206 [1,0,0,0,0,0|2,0,1]=4 1151 B13R1.643 COc1cccc(c1)COC(C)C 34a_100000212225_100000688526 [1,0,0,0,0,0|2,0,1]=4 1152 B13R1.643 COc1cccc(c1)CSC(C)C 62a_100000210206_100000211672 [1,0,0,0,0,0|2,0,1]=4 1153 B13R1.643 COc1cccc(c1)CSC(C)C 62a_100000688526_100000210206 [1,0,0,0,0,0|2,0,1]=4 1154 B13R1.643 COc1cccc(c1)NCC(=O)N 34a_100000210024_100000187820 [1,0,0,0,0,0|2,0,0]=3 1155 B13R1.643 COc1cccc(c1)NCC(=O)[O-] 34a_100000210024_100020667443 [1,0,0,0,0,0|2,0,0]=3 1156 B13R1.643 COc1cccc(c1)NCC(C)C 34a_100000210024_100000210624 [1,0,0,0,0,0|2,0,1]=4 1157 B13R1.643 COc1cccc(c1)NCC(C)O 34a_100000210024_100011218427 [1,0,0,0,0,0|1,0,2]=4 1158 B13R1.643 COc1cccc(c1)NC[C@@H](C)O 34a_100000210024_100009817552 [1,0,0,0,0,0|1,0,2]=4 1159 B13R1.643 COc1cccc(c1)NC[N+](=O)[O-] 34a_100000210024_100000761209 [1,0,0,0,0,0|3,0,0]=4 1160 B13R1.643 COc1cccc(c1)NNC(=O)C 22a_100000722927_100000070787 [1,0,0,0,0,0|2,0,0]=3 1161 B13R1.643 COc1cccc(c1)OCC(=O)C 1458a_100000182123_200000210301 [1,0,0,0,0,0|1,0,0]=2 1162 B13R1.643 COc1cccc(c1)OCC(=O)N 34a_100000211255_100000187820 [1,0,0,0,0,0|2,0,0]=3 1163 B13R1.643 COc1cccc(c1)OCC(=O)N 7a_100000211255_100000187820 [1,0,0,0,0,0|2,0,0]=3 1164 B13R1.643 COc1cccc(c1)OCC(=O)[13CH3] 1458a_100000182123_200025704644 [1,0,0,0,0,0|1,0,0]=2 1165 B13R1.643 COc1cccc(c1)OCC(=O)[O-] 34a_100000211255_100020667443 [1,0,0,0,0,0|2,0,0]=3 1166 B13R1.643 COc1cccc(c1)OCC(C)C 34a_100000211255_100000210624 [1,0,0,0,0,0|2,0,1]=4 1167 B13R1.643 COc1cccc(c1)OCC(C)C 7a_100000211255_100000210760 [1,0,0,0,0,0|2,0,1]=4 1168 B13R1.643 COc1cccc(c1)OCC(C)O 34a_100000211255_100011218427 [1,0,0,0,0,0|1,0,2]=4 1169 B13R1.643 COc1cccc(c1)OCC(C)O 7a_100000211255_100011218427 [1,0,0,0,0,0|1,0,2]=4 1170 B13R1.643 COc1cccc(c1)OC[C@@H](C)O 34a_100000211255_100009817552 [1,0,0,0,0,0|1,0,2]=4 1171 B13R1.643 COc1cccc(c1)OC[C@@H](C)O 7a_100000211255_100009817552 [1,0,0,0,0,0|1,0,2]=4 1172 B13R1.643 COc1cccc(c1)OC[N+](=O)[O-] 34a_100000211255_100000761209 [1,0,0,0,0,0|3,0,0]=4 1173 B13R1.643 COc1cccc(c1)SCC(=O)C 1458a_100000741315_200000210301 [1,0,0,0,0,0|1,0,0]=2 1174 B13R1.643 COc1cccc(c1)SCC(=O)N 62a_100000747473_100000170001 [1,0,0,0,0,0|2,0,0]=3 1175 B13R1.643 COc1cccc(c1)SCC(=O)[13CH3] 1458a_100000741315_200025704644 [1,0,0,0,0,0|1,0,0]=2 1176 B13R1.643 COc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000170001 [1,0,0,0,0,0|2,0,0]=3 1177 B13R1.643 COc1cccc(c1)SCC(C)C 62a_100000210624_100000170001 [1,0,0,0,0,0|2,0,1]=4 1178 B13R1.643 COc1cccc(c1)SCC(C)O 62a_100011218427_100000170001 [1,0,0,0,0,0|1,0,2]=4 1179 B13R1.643 COc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100000170001 [1,0,0,0,0,0|1,0,2]=4 1180 B13R1.643 COc1cccc(n1)CNC(=O)C 11a_100000746380_100015343762 [1,0,0,0,0,0|2,0,0]=3 1181 B13R1.643 COc1cccc(n1)CNC(=O)C 1626a_100000746380_100015343762 [1,0,0,0,0,0|2,0,0]=3 1182 B13R1.643 COc1cccc(n1)CNC(=O)C 240690a_100000746380_100015343762 [1,0,0,0,0,0|2,0,0]=3 1183 B13R1.643 COc1cccc(n1)CNC(=O)C 527a_100000746380_100103153847 [1,0,0,0,0,0|2,0,0]=3 1184 B13R1.643 COc1cccc(n1)NNC(=O)C 22a_100000698482_100000070787 [1,0,0,0,0,0|3,0,0]=4 1185 B13R1.643 COc1cccc(n1)SCC(=O)N 62a_100000747473_100000760917 [1,0,0,0,0,0|3,0,0]=4 1186 B13R1.643 COc1cccc(n1)SCC(=O)N 62a_100000760917_100000747473 [1,0,0,0,0,0|3,0,0]=4 1187 B13R1.643 COc1cccc(n1)SCC(=O)[O-] 62a_100000760917_100020667443 [1,0,0,0,0,0|3,0,0]=4 1188 B13R1.643 COc1cccc(n1)SCC(=O)[O-] 62a_100020667443_100000760917 [1,0,0,0,0,0|3,0,0]=4 1189 B13R1.643 COc1ccnc(c1)CNC(=O)C 11a_100000706253_100015343762 [1,0,0,0,0,0|2,0,0]=3 1190 B13R1.643 COc1ccnc(c1)CNC(=O)C 1626a_100000706253_100015343762 [1,0,0,0,0,0|2,0,0]=3 1191 B13R1.643 COc1ccnc(c1)CNC(=O)C 240690a_100000706253_100015343762 [1,0,0,0,0,0|2,0,0]=3 1192 B13R1.643 COc1ccnc(c1)CNC(=O)C 527a_100000706253_100103153847 [1,0,0,0,0,0|2,0,0]=3 1193 B13R1.643 COc1ccnc(c1)SCC(=O)N 62a_100000747473_100011216251 [1,0,0,0,0,0|3,0,0]=4 1194 B13R1.643 COc1ccnc(c1)SCC(=O)N 62a_100009817693_100000747473 [1,0,0,0,0,0|3,0,0]=4 1195 B13R1.643 COc1ccnc(c1)SCC(=O)[O-] 62a_100009817693_100020667443 [1,0,0,0,0,0|3,0,0]=4 1196 B13R1.643 COc1ccnc(c1)SCC(=O)[O-] 62a_100020667443_100011216251 [1,0,0,0,0,0|3,0,0]=4 1197 B13R1.643 COc1cncc(c1)CNC(=O)C 11a_100020589029_100015343762 [1,0,0,0,0,0|2,0,0]=3 1198 B13R1.643 COc1cncc(c1)CNC(=O)C 240690a_100020589029_100015343762 [1,0,0,0,0,0|2,0,0]=3 1199 B13R1.643 COc1cncc(c1)CNC(=O)C 527a_100020589029_100103153847 [1,0,0,0,0,0|2,0,0]=3 1200 B13R1.643 COc1cncc(c1)OCC(=O)N 34a_100000084572_100000187820 [1,0,0,0,0,0|3,0,0]=4 1201 B13R1.643 COc1cncc(c1)OCC(=O)N 7a_100000084572_100000187820 [1,0,0,0,0,0|3,0,0]=4 1202 B13R1.643 COc1cncc(c1)OCC(=O)[O-] 34a_100000084572_100020667443 [1,0,0,0,0,0|3,0,0]=4 1203 B13R1.643 COc1cncc(c1)SCC(=O)N 62a_100000050176_100000747473 [1,0,0,0,0,0|3,0,0]=4 1204 B13R1.643 COc1cncc(c1)SCC(=O)N 62a_100000747473_100000050176 [1,0,0,0,0,0|3,0,0]=4 1205 B13R1.643 COc1cncc(c1)SCC(=O)[O-] 62a_100000050176_100020667443 [1,0,0,0,0,0|3,0,0]=4 1206 B13R1.643 COc1cncc(c1)SCC(=O)[O-] 62a_100020667443_100000050176 [1,0,0,0,0,0|3,0,0]=4 1207 B13R1.643 COc1nccc(n1)CNC(=O)C 11a_100025715945_100015343762 [1,0,0,0,0,0|3,0,0]=4 1208 B13R1.643 COc1nccc(n1)CNC(=O)C 1626a_100025715945_100015343762 [1,0,0,0,0,0|3,0,0]=4 1209 B13R1.643 COc1nccc(n1)CNC(=O)C 240690a_100025715945_100015343762 [1,0,0,0,0,0|3,0,0]=4 1210 B13R1.643 COc1nccc(n1)CNC(=O)C 527a_100025715945_100103153847 [1,0,0,0,0,0|3,0,0]=4 1211 B13R1.643 CSc1cccc(c1)/C=C/C(=O)C 62a_200000210301_200016266566 [1,0,0,0,0,0|0,1,2]=4 1212 B13R1.643 CSc1cccc(c1)/C=C/C(=O)C 62a_200016266566_200000210301 [1,0,0,0,0,0|0,1,2]=4 1213 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_100011279149_200000210301 [1,0,0,0,0,0|0,1,0]=2 1214 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_200000210301_100011279149 [1,0,0,0,0,0|0,1,0]=2 1215 B13R1.643 CSc1cccc(c1)CCC(=O)N 62a_100000162029_200000210301 [1,0,0,0,0,0|1,1,0]=3 1216 B13R1.643 CSc1cccc(c1)CCC(=O)N 62a_200000210301_100000162029 [1,0,0,0,0,0|1,1,0]=3 1217 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_100000766983_200000210301 [1,0,0,0,0,0|1,1,0]=3 1218 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_200000210301_100000766983 [1,0,0,0,0,0|1,1,0]=3 1219 B13R1.643 CSc1cccc(c1)NCC(=O)N 2230a_100000210049_100000747473 [1,0,0,0,0,0|2,1,0]=4 1220 B13R1.643 CSc1cccc(c1)NCC(=O)N 34a_100000210049_100000187820 [1,0,0,0,0,0|2,1,0]=4 1221 B13R1.643 CSc1cccc(c1)NCC(=O)[O-] 34a_100000210049_100020667443 [1,0,0,0,0,0|2,1,0]=4 1222 B13R1.643 CSc1cccc(c1)OCC(=O)N 34a_100011265683_100000187820 [1,0,0,0,0,0|2,1,0]=4 1223 B13R1.643 CSc1cccc(c1)OCC(=O)N 62a_200000150604_200000210301 [1,0,0,0,0,0|2,1,0]=4 1224 B13R1.643 CSc1cccc(c1)OCC(=O)N 62a_200000210301_200000150604 [1,0,0,0,0,0|2,1,0]=4 1225 B13R1.643 CSc1cccc(c1)OCC(=O)N 7a_100011265683_100000187820 [1,0,0,0,0,0|2,1,0]=4 1226 B13R1.643 CSc1cccc(c1)OCC(=O)[O-] 34a_100011265683_100020667443 [1,0,0,0,0,0|2,1,0]=4 1227 B13R1.643 CSc1cccc(c1)SCC(=O)N 62a_100000747473_100011215954 [1,0,0,0,0,0|2,1,0]=4 1228 B13R1.643 CSc1cccc(c1)SCC(=O)N 62a_100011215954_100000747473 [1,0,0,0,0,0|2,1,0]=4 1229 B13R1.643 CSc1cccc(c1)SCC(=O)[O-] 62a_100011215954_100020667443 [1,0,0,0,0,0|2,1,0]=4 1230 B13R1.643 CSc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011215954 [1,0,0,0,0,0|2,1,0]=4 1231 B13R1.643 [13CH3]C(=O)CCc1cccc(c1)C#N 1458a_100011998624_200025704644 [1,0,0,0,0,0|2,0,0]=3 1232 B13R1.643 [13CH3]C(=O)COc1cccc(c1)C#N 1458a_100000230692_200025704644 [1,0,0,0,0,0|3,0,0]=4 1233 B13R1.643 [13CH3]Sc1cccc(c1)CCC(=O)N 62a_100000162029_200025704644 [1,0,0,0,0,0|1,1,0]=3 1234 B13R1.643 [13CH3]Sc1cccc(c1)CCC(=O)N 62a_200025704644_100000162029 [1,0,0,0,0,0|1,1,0]=3 1235 B13R1.643 [13CH3]Sc1cccc(c1)OCC(=O)N 62a_200000150604_200025704644 [1,0,0,0,0,0|2,1,0]=4 1236 B13R1.643 [13CH3]Sc1cccc(c1)OCC(=O)N 62a_200025704644_200000150604 [1,0,0,0,0,0|2,1,0]=4 1237 B15R1.392 C=C(C)CNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000748629 [0,1,0,0,0,0|3,0,0]=4 1238 B15R1.392 C=C(C)CNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000748629 [0,1,0,0,0,0|3,0,0]=4 1239 B15R1.392 C=C(C)CNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000748629 [0,1,0,0,0,0|3,0,0]=4 1240 B15R1.392 C=C(C)CSc1cc(c(c(c1)CC)O)C 62a_100000748629_100010659108 [0,1,0,0,0,0|3,0,0]=4 1241 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)F)C 62a_100000748629_100010271686 [0,1,0,0,0,0|3,0,0]=4 1242 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000211660 [0,1,0,0,0,0|3,0,0]=4 1243 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)F)F 62a_100000748629_100011218012 [0,1,0,0,0,0|3,0,0]=4 1244 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000211660 [0,1,0,0,0,0|3,0,0]=4 1245 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)F)O 62a_100000748629_200015524394 [0,1,0,0,0,0|3,0,0]=4 1246 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000211660 [0,1,0,0,0,0|3,0,0]=4 1247 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000211660 [0,1,0,0,0,0|3,0,0]=4 1248 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)N)C 62a_100000748629_100000741850 [0,1,0,0,0,0|3,0,0]=4 1249 B15R1.392 C=C(C)CSc1cc(c(c(c1)OC)O)O 62a_100000748629_200159242197 [0,1,0,0,0,0|2,0,0]=3 1250 B15R1.392 C=C(F)CSc1cc(c(c(c1)OC)O)O 62a_100000042424_200159242197 [0,1,0,0,0,0|2,0,1]=4 1251 B15R1.392 CCc1cc(cc(c1O)C)SCC(=O)N 62a_100000747473_100010659108 [0,1,0,0,0,0|3,0,0]=4 1252 B15R1.392 CCc1cc(cc(c1O)C)SCC(=O)[O-] 62a_100020667443_100010659108 [0,1,0,0,0,0|3,0,0]=4 1253 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(=O)N 2230a_100010131419_100000747473 [0,1,0,0,0,0|3,0,0]=4 1254 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(=O)N 34a_100010131419_100000187820 [0,1,0,0,0,0|3,0,0]=4 1255 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(=O)N 7a_100010131419_100000187820 [0,1,0,0,0,0|3,0,0]=4 1256 B15R1.392 COc1cc(cc(c1Cl)Br)NCC(=O)[O-] 34a_100010131419_100020667443 [0,1,0,0,0,0|3,0,0]=4 1257 B15R1.392 COc1cc(cc(c1F)C)SCC(=O)N 62a_100000747473_100010271686 [0,1,0,0,0,0|3,0,0]=4 1258 B15R1.392 COc1cc(cc(c1F)C)SCC(=O)N 62a_100010271686_100000747473 [0,1,0,0,0,0|3,0,0]=4 1259 B15R1.392 COc1cc(cc(c1F)C)SCC(=O)[O-] 62a_100010271686_100020667443 [0,1,0,0,0,0|3,0,0]=4 1260 B15R1.392 COc1cc(cc(c1F)C)SCC(=O)[O-] 62a_100020667443_100010271686 [0,1,0,0,0,0|3,0,0]=4 1261 B15R1.392 COc1cc(cc(c1F)F)SCC(=O)N 62a_100000747473_100011218012 [0,1,0,0,0,0|3,0,0]=4 1262 B15R1.392 COc1cc(cc(c1F)F)SCC(=O)N 62a_100011218012_100000747473 [0,1,0,0,0,0|3,0,0]=4 1263 B15R1.392 COc1cc(cc(c1F)F)SCC(=O)[O-] 62a_100011218012_100020667443 [0,1,0,0,0,0|3,0,0]=4 1264 B15R1.392 COc1cc(cc(c1F)F)SCC(=O)[O-] 62a_100020667443_100011218012 [0,1,0,0,0,0|3,0,0]=4 1265 B15R1.392 COc1cc(cc(c1F)O)SCC(=O)N 62a_100000747473_200015524394 [0,1,0,0,0,0|3,0,0]=4 1266 B15R1.392 COc1cc(cc(c1F)O)SCC(=O)N 62a_200015524394_100000747473 [0,1,0,0,0,0|3,0,0]=4 1267 B15R1.392 COc1cc(cc(c1F)O)SCC(=O)[O-] 62a_100020667443_200015524394 [0,1,0,0,0,0|3,0,0]=4 1268 B15R1.392 COc1cc(cc(c1F)O)SCC(=O)[O-] 62a_200015524394_100020667443 [0,1,0,0,0,0|3,0,0]=4 1269 B15R1.392 COc1cc(cc(c1N)C)SCC(=O)N 62a_100000741850_100000747473 [0,1,0,0,0,0|3,0,0]=4 1270 B15R1.392 COc1cc(cc(c1N)C)SCC(=O)N 62a_100000747473_100000741850 [0,1,0,0,0,0|3,0,0]=4 1271 B15R1.392 COc1cc(cc(c1N)C)SCC(=O)[O-] 62a_100000741850_100020667443 [0,1,0,0,0,0|3,0,0]=4 1272 B15R1.392 COc1cc(cc(c1N)C)SCC(=O)[O-] 62a_100020667443_100000741850 [0,1,0,0,0,0|3,0,0]=4 1273 B15R1.392 COc1cc(cc(c1O)Br)C=CC(=O)C 1458a_100015195021_200000210301 [0,1,0,0,0,0|0,0,2]=3 1274 B15R1.392 COc1cc(cc(c1O)Br)C=CC(=O)[13CH3] 1458a_100015195021_200025704644 [0,1,0,0,0,0|0,0,2]=3 1275 B15R1.392 COc1cc(cc(c1O)I)C=CC(=O)C 1458a_200021160827_200000210301 [0,1,0,0,0,0|0,0,2]=3 1276 B15R1.392 COc1cc(cc(c1O)I)C=CC(=O)[13CH3] 1458a_200021160827_200025704644 [0,1,0,0,0,0|0,0,2]=3 1277 B15R1.392 COc1cc(cc(c1O)O)SCC(=O)N 62a_100000747473_200159242197 [0,1,0,0,0,0|2,0,0]=3 1278 B15R1.392 COc1cc(cc(c1O)O)SCC(=O)[O-] 62a_100020667443_200159242197 [0,1,0,0,0,0|2,0,0]=3 1279 B15R1.392 COc1cc(cc(c1O)O)SCC(C)C 62a_100000210624_200159242197 [0,1,0,0,0,0|2,0,1]=4 1280 B15R1.392 COc1cc(cc(c1O)O)SCC(C)O 62a_100011218427_200159242197 [0,1,0,0,0,0|1,0,2]=4 1281 B15R1.392 COc1cc(cc(c1O)O)SC[C@@H](C)O 62a_100009817552_200159242197 [0,1,0,0,0,0|1,0,2]=4 1282 B15R1.531 C=C(C)CNc1ccc(c(c1)OCC)Br 2230a_200016990551_100000748629 [0,1,0,0,0,0|3,0,0]=4 1283 B15R1.531 C=C(C)CNc1ccc(c(c1)OCC)Br 34a_200016990551_100000748629 [0,1,0,0,0,0|3,0,0]=4 1284 B15R1.531 C=C(C)CNc1ccc(c(c1)OCC)Br 7a_200016990551_100000748629 [0,1,0,0,0,0|3,0,0]=4 1285 B15R1.531 C=C(C)CNc1ccc(c(c1)OCC)Cl 2230a_100011964961_100000748629 [0,1,0,0,0,0|3,0,0]=4 1286 B15R1.531 C=C(C)CNc1ccc(c(c1)OCC)Cl 34a_100011964961_100000748629 [0,1,0,0,0,0|3,0,0]=4 1287 B15R1.531 C=C(C)CSc1ccc(c(c1)CNC)O 62a_100000748629_100011602694 [0,1,0,0,0,0|3,0,0]=4 1288 B15R1.531 C=C(C)CSc1ccc(c(c1)CNC)O 62a_100011602694_100000211660 [0,1,0,0,0,0|3,0,0]=4 1289 B15R1.531 C=C(C)CSc1ccc(c(c1)COC)Br 62a_100000748629_202125822959 [0,1,0,0,0,0|3,0,0]=4 1290 B15R1.531 C=C(C)CSc1ccc(c(c1)COC)Br 62a_202125822959_100000211660 [0,1,0,0,0,0|3,0,0]=4 1291 B15R1.531 C=C(C)CSc1ccc(c(c1)COC)F 62a_100000748629_100010140362 [0,1,0,0,0,0|3,0,0]=4 1292 B15R1.531 C=C(C)CSc1ccc(c(c1)COC)F 62a_100010140362_100000211660 [0,1,0,0,0,0|3,0,0]=4 1293 B15R1.531 C=C(C)CSc1ccc(c(c1)OCC)C 62a_100000748629_100012361169 [0,1,0,0,0,0|3,0,0]=4 1294 B15R1.531 C=C(C)CSc1ccc(c(c1)OCC)C 62a_100012361169_100000211660 [0,1,0,0,0,0|3,0,0]=4 1295 B15R1.531 C=C(C)CSc1ccc(c(c1)OCC)F 62a_100000748629_200012344967 [0,1,0,0,0,0|3,0,0]=4 1296 B15R1.531 C=C(C)CSc1ccc(c(c1)OCC)F 62a_200012344967_100000211660 [0,1,0,0,0,0|3,0,0]=4 1297 B15R1.531 C=C(C)CSc1ccc(c(c1)OCC)N 62a_100000688918_100000211660 [0,1,0,0,0,0|3,0,0]=4 1298 B15R1.531 CCOc1cc(ccc1Br)NCC(=O)N 2230a_200016990551_100000747473 [0,1,0,0,0,0|3,0,0]=4 1299 B15R1.531 CCOc1cc(ccc1Br)NCC(=O)N 34a_200016990551_100000187820 [0,1,0,0,0,0|3,0,0]=4 1300 B15R1.531 CCOc1cc(ccc1Br)NCC(=O)N 7a_200016990551_100000187820 [0,1,0,0,0,0|3,0,0]=4 1301 B15R1.531 CCOc1cc(ccc1Br)NCC(=O)[O-] 34a_200016990551_100020667443 [0,1,0,0,0,0|3,0,0]=4 1302 B15R1.531 CCOc1cc(ccc1C)SCC(=O)N 62a_100000747473_100012361169 [0,1,0,0,0,0|3,0,0]=4 1303 B15R1.531 CCOc1cc(ccc1C)SCC(=O)N 62a_100012361169_100000747473 [0,1,0,0,0,0|3,0,0]=4 1304 B15R1.531 CCOc1cc(ccc1C)SCC(=O)[O-] 62a_100012361169_100020667443 [0,1,0,0,0,0|3,0,0]=4 1305 B15R1.531 CCOc1cc(ccc1C)SCC(=O)[O-] 62a_100020667443_100012361169 [0,1,0,0,0,0|3,0,0]=4 1306 B15R1.531 CCOc1cc(ccc1Cl)NCC(=O)N 2230a_100011964961_100000747473 [0,1,0,0,0,0|3,0,0]=4 1307 B15R1.531 CCOc1cc(ccc1Cl)NCC(=O)N 34a_100011964961_100000187820 [0,1,0,0,0,0|3,0,0]=4 1308 B15R1.531 CCOc1cc(ccc1Cl)NCC(=O)[O-] 34a_100011964961_100020667443 [0,1,0,0,0,0|3,0,0]=4 1309 B15R1.531 CCOc1cc(ccc1F)SCC(=O)N 62a_100000747473_200012344967 [0,1,0,0,0,0|3,0,0]=4 1310 B15R1.531 CCOc1cc(ccc1F)SCC(=O)N 62a_200012344967_100000747473 [0,1,0,0,0,0|3,0,0]=4 1311 B15R1.531 CCOc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_200012344967 [0,1,0,0,0,0|3,0,0]=4 1312 B15R1.531 CCOc1cc(ccc1F)SCC(=O)[O-] 62a_200012344967_100020667443 [0,1,0,0,0,0|3,0,0]=4 1313 B15R1.531 CCOc1cc(ccc1N)SCC(=O)N 62a_100000688918_100000747473 [0,1,0,0,0,0|3,0,0]=4 1314 B15R1.531 CCOc1cc(ccc1N)SCC(=O)[O-] 62a_100000688918_100020667443 [0,1,0,0,0,0|3,0,0]=4 1315 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 11a_200000751567_100015343762 [0,1,0,0,0,0|1,0,0]=2 1316 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 240690a_200000751567_100015343762 [0,1,0,0,0,0|1,0,0]=2 1317 B15R1.531 CCOc1cc(ccc1O)CNC(=O)C 527a_200000751567_100103153847 [0,1,0,0,0,0|1,0,0]=2 1318 B15R1.531 CCOc1cc(ccc1O)CNC(C)C 34a_200000751567_100000210206 [0,1,0,0,0,0|2,0,1]=4 1319 B15R1.531 CNCc1cc(ccc1O)SCC(=O)N 62a_100000747473_100011602694 [0,1,0,0,0,0|3,0,0]=4 1320 B15R1.531 CNCc1cc(ccc1O)SCC(=O)N 62a_100011602694_100000747473 [0,1,0,0,0,0|3,0,0]=4 1321 B15R1.531 CNCc1cc(ccc1O)SCC(=O)[O-] 62a_100011602694_100020667443 [0,1,0,0,0,0|3,0,0]=4 1322 B15R1.531 CNCc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100011602694 [0,1,0,0,0,0|3,0,0]=4 1323 B15R1.531 COCc1cc(ccc1Br)SCC(=O)N 62a_100000747473_202125822959 [0,1,0,0,0,0|3,0,0]=4 1324 B15R1.531 COCc1cc(ccc1Br)SCC(=O)N 62a_202125822959_100000747473 [0,1,0,0,0,0|3,0,0]=4 1325 B15R1.531 COCc1cc(ccc1Br)SCC(=O)[O-] 62a_100020667443_202125822959 [0,1,0,0,0,0|3,0,0]=4 1326 B15R1.531 COCc1cc(ccc1Br)SCC(=O)[O-] 62a_202125822959_100020667443 [0,1,0,0,0,0|3,0,0]=4 1327 B15R1.531 COCc1cc(ccc1F)SCC(=O)N 62a_100000747473_100010140362 [0,1,0,0,0,0|3,0,0]=4 1328 B15R1.531 COCc1cc(ccc1F)SCC(=O)N 62a_100010140362_100000747473 [0,1,0,0,0,0|3,0,0]=4 1329 B15R1.531 COCc1cc(ccc1F)SCC(=O)[O-] 62a_100010140362_100020667443 [0,1,0,0,0,0|3,0,0]=4 1330 B15R1.531 COCc1cc(ccc1F)SCC(=O)[O-] 62a_100020667443_100010140362 [0,1,0,0,0,0|3,0,0]=4 1331 B15R1.873 C=C(C)CSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000211660 [0,1,0,0,0,0|3,0,0]=4 1332 B15R1.873 C=C(C)CSc1ccc(c(c1)C(C)C)O 62a_100000748629_100000691460 [0,1,0,0,0,0|3,0,0]=4 1333 B15R1.873 CC(=O)CCc1ccc(c(c1)[N+](=O)[O-])F 1458a_200020644490_200000210301 [0,1,0,0,0,0|3,0,0]=4 1334 B15R1.873 CC(=O)CCc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000040362_200000210301 [0,1,0,0,0,0|2,0,0]=3 1335 B15R1.873 CC(C)c1cc(ccc1O)SCC(=O)N 62a_100000691460_100000747473 [0,1,0,0,0,0|3,0,0]=4 1336 B15R1.873 CC(C)c1cc(ccc1O)SCC(=O)N 62a_100000747473_100000691460 [0,1,0,0,0,0|3,0,0]=4 1337 B15R1.873 CC(C)c1cc(ccc1O)SCC(=O)[O-] 62a_100000691460_100020667443 [0,1,0,0,0,0|3,0,0]=4 1338 B15R1.873 CC(C)c1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000691460 [0,1,0,0,0,0|3,0,0]=4 1339 B15R1.873 [13CH3]C(=O)CCc1ccc(c(c1)[N+](=O)[O-])F 1458a_200020644490_200025704644 [0,1,0,0,0,0|3,0,0]=4 1340 B15R1.873 [13CH3]C(=O)CCc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000040362_200025704644 [0,1,0,0,0,0|2,0,0]=3 1341 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000748629 [0,1,0,0,0,0|3,0,0]=4 1342 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000748629 [0,1,0,0,0,0|3,0,0]=4 1343 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)C)OC 34a_100010244135_100000748629 [0,1,0,0,0,0|3,0,0]=4 1344 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)C)OC 7a_100010244135_100000748629 [0,1,0,0,0,0|3,0,0]=4 1345 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000748629 [0,1,0,0,0,0|3,0,0]=4 1346 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000748629 [0,1,0,0,0,0|3,0,0]=4 1347 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)F)OC 34a_100010208193_100000748629 [0,1,0,0,0,0|3,0,0]=4 1348 B15R1.1803 C=C(C)CNc1cc(c(cc1Br)F)OC 7a_100010208193_100000748629 [0,1,0,0,0,0|3,0,0]=4 1349 B15R1.1803 C=C(C)CNc1cc(c(cc1C)Br)OC 34a_100010232211_100000748629 [0,1,0,0,0,0|3,0,0]=4 1350 B15R1.1803 C=C(C)CNc1cc(c(cc1C)Br)OC 7a_100010232211_100000748629 [0,1,0,0,0,0|3,0,0]=4 1351 B15R1.1803 C=C(C)CNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000748629 [0,1,0,0,0,0|3,0,0]=4 1352 B15R1.1803 C=C(C)CNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000748629 [0,1,0,0,0,0|3,0,0]=4 1353 B15R1.1803 C=C(C)CNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000748629 [0,1,0,0,0,0|3,0,0]=4 1354 B15R1.1803 C=C(C)CNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000748629 [0,1,0,0,0,0|3,0,0]=4 1355 B15R1.1803 C=C(C)CNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000748629 [0,1,0,0,0,0|3,0,0]=4 1356 B15R1.1803 C=C(C)CNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000748629 [0,1,0,0,0,0|3,0,0]=4 1357 B15R1.1803 C=C(C)CNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000748629 [0,1,0,0,0,0|3,0,0]=4 1358 B15R1.1803 C=C(C)CNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000748629 [0,1,0,0,0,0|3,0,0]=4 1359 B15R1.1803 C=C(C)CNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000748629 [0,1,0,0,0,0|3,0,0]=4 1360 B15R1.1803 C=C(C)CNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000748629 [0,1,0,0,0,0|3,0,0]=4 1361 B15R1.1803 C=C(C)CSc1cc(c(cc1Br)Br)OC 62a_100000748629_200014006352 [0,1,0,0,0,0|3,0,0]=4 1362 B15R1.1803 C=C(C)CSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000211660 [0,1,0,0,0,0|3,0,0]=4 1363 B15R1.1803 C=C(C)CSc1cc(c(cc1C)F)OC 62a_100000748629_100011009880 [0,1,0,0,0,0|3,0,0]=4 1364 B15R1.1803 C=C(C)CSc1cc(c(cc1C)F)OC 62a_100011009880_100000211660 [0,1,0,0,0,0|3,0,0]=4 1365 B15R1.1803 C=C(C)CSc1cc(c(cc1C)N)OC 62a_100000748629_100010141321 [0,1,0,0,0,0|3,0,0]=4 1366 B15R1.1803 C=C(C)CSc1cc(c(cc1C)N)OC 62a_100010141321_100000211660 [0,1,0,0,0,0|3,0,0]=4 1367 B15R1.1803 C=C(C)CSc1cc(c(cc1F)Cl)OC 62a_100000748629_100010739614 [0,1,0,0,0,0|3,0,0]=4 1368 B15R1.1803 C=C(C)CSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000211660 [0,1,0,0,0,0|3,0,0]=4 1369 B15R1.1803 C=C(C)CSc1cc(c(cc1F)F)OC 62a_100000748629_200015541288 [0,1,0,0,0,0|3,0,0]=4 1370 B15R1.1803 C=C(C)CSc1cc(c(cc1F)F)OC 62a_200015541288_100000211660 [0,1,0,0,0,0|3,0,0]=4 1371 B15R1.1803 C=C(C)CSc1cc(c(cc1F)N)OC 62a_100000748629_100012766639 [0,1,0,0,0,0|3,0,0]=4 1372 B15R1.1803 C=C(C)CSc1cc(c(cc1F)N)OC 62a_100012766639_100000211660 [0,1,0,0,0,0|3,0,0]=4 1373 B15R1.1803 C=C(C)CSc1cc(c(cc1F)O)OC 62a_100000748629_100010189133 [0,1,0,0,0,0|2,0,0]=3 1374 B15R1.1803 C=C(C)CSc1cc(c(cc1N)C)OC 62a_100000748629_200010584344 [0,1,0,0,0,0|3,0,0]=4 1375 B15R1.1803 C=C(C)CSc1cc(c(cc1N)C)OC 62a_200010584344_100000211660 [0,1,0,0,0,0|3,0,0]=4 1376 B15R1.1803 C=C(C)CSc1cc(c(cc1N)F)OC 62a_100000748629_100010365326 [0,1,0,0,0,0|3,0,0]=4 1377 B15R1.1803 C=C(C)CSc1cc(c(cc1N)F)OC 62a_100010365326_100000211660 [0,1,0,0,0,0|3,0,0]=4 1378 B15R1.1803 C=C(F)CSc1cc(c(cc1F)O)OC 62a_100000042424_100010189133 [0,1,0,0,0,0|2,0,1]=4 1379 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(=O)N 34a_100000718616_100000187820 [0,1,0,0,0,0|3,0,0]=4 1380 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(=O)N 7a_100000718616_100000187820 [0,1,0,0,0,0|3,0,0]=4 1381 B15R1.1803 COc1cc(c(cc1Br)Br)NCC(=O)[O-] 34a_100000718616_100020667443 [0,1,0,0,0,0|3,0,0]=4 1382 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(=O)N 62a_100000747473_200014006352 [0,1,0,0,0,0|3,0,0]=4 1383 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(=O)N 62a_200014006352_100000747473 [0,1,0,0,0,0|3,0,0]=4 1384 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(=O)[O-] 62a_100020667443_200014006352 [0,1,0,0,0,0|3,0,0]=4 1385 B15R1.1803 COc1cc(c(cc1Br)Br)SCC(=O)[O-] 62a_200014006352_100020667443 [0,1,0,0,0,0|3,0,0]=4 1386 B15R1.1803 COc1cc(c(cc1Br)C)NCC(=O)N 34a_100010232211_100000187820 [0,1,0,0,0,0|3,0,0]=4 1387 B15R1.1803 COc1cc(c(cc1Br)C)NCC(=O)N 7a_100010232211_100000187820 [0,1,0,0,0,0|3,0,0]=4 1388 B15R1.1803 COc1cc(c(cc1Br)C)NCC(=O)[O-] 34a_100010232211_100020667443 [0,1,0,0,0,0|3,0,0]=4 1389 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(=O)N 34a_100012361290_100000187820 [0,1,0,0,0,0|3,0,0]=4 1390 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(=O)N 7a_100012361290_100000187820 [0,1,0,0,0,0|3,0,0]=4 1391 B15R1.1803 COc1cc(c(cc1Br)Cl)NCC(=O)[O-] 34a_100012361290_100020667443 [0,1,0,0,0,0|3,0,0]=4 1392 B15R1.1803 COc1cc(c(cc1C)Br)NCC(=O)N 34a_100010244135_100000187820 [0,1,0,0,0,0|3,0,0]=4 1393 B15R1.1803 COc1cc(c(cc1C)Br)NCC(=O)N 7a_100010244135_100000187820 [0,1,0,0,0,0|3,0,0]=4 1394 B15R1.1803 COc1cc(c(cc1C)Br)NCC(=O)[O-] 34a_100010244135_100020667443 [0,1,0,0,0,0|3,0,0]=4 1395 B15R1.1803 COc1cc(c(cc1C)N)SCC(=O)N 62a_100000747473_200010584344 [0,1,0,0,0,0|3,0,0]=4 1396 B15R1.1803 COc1cc(c(cc1C)N)SCC(=O)N 62a_200010584344_100000747473 [0,1,0,0,0,0|3,0,0]=4 1397 B15R1.1803 COc1cc(c(cc1C)N)SCC(=O)[O-] 62a_100020667443_200010584344 [0,1,0,0,0,0|3,0,0]=4 1398 B15R1.1803 COc1cc(c(cc1C)N)SCC(=O)[O-] 62a_200010584344_100020667443 [0,1,0,0,0,0|3,0,0]=4 1399 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(=O)N 34a_100013022580_100000187820 [0,1,0,0,0,0|3,0,0]=4 1400 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(=O)N 7a_100013022580_100000187820 [0,1,0,0,0,0|3,0,0]=4 1401 B15R1.1803 COc1cc(c(cc1Cl)Br)NCC(=O)[O-] 34a_100013022580_100020667443 [0,1,0,0,0,0|3,0,0]=4 1402 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(=O)N 2230a_100009858536_100000747473 [0,1,0,0,0,0|3,0,0]=4 1403 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(=O)N 34a_100009858536_100000187820 [0,1,0,0,0,0|3,0,0]=4 1404 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(=O)N 7a_100009858536_100000187820 [0,1,0,0,0,0|3,0,0]=4 1405 B15R1.1803 COc1cc(c(cc1Cl)C)NCC(=O)[O-] 34a_100009858536_100020667443 [0,1,0,0,0,0|3,0,0]=4 1406 B15R1.1803 COc1cc(c(cc1Cl)Cl)NCC(=O)N 34a_100011830341_100000187820 [0,1,0,0,0,0|3,0,0]=4 1407 B15R1.1803 COc1cc(c(cc1Cl)Cl)NCC(=O)[O-] 34a_100011830341_100020667443 [0,1,0,0,0,0|3,0,0]=4 1408 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(=O)N 34a_100009872666_100000187820 [0,1,0,0,0,0|3,0,0]=4 1409 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(=O)N 7a_100009872666_100000187820 [0,1,0,0,0,0|3,0,0]=4 1410 B15R1.1803 COc1cc(c(cc1Cl)F)NCC(=O)[O-] 34a_100009872666_100020667443 [0,1,0,0,0,0|3,0,0]=4 1411 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(=O)N 62a_100000747473_100010739614 [0,1,0,0,0,0|3,0,0]=4 1412 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(=O)N 62a_100010739614_100000747473 [0,1,0,0,0,0|3,0,0]=4 1413 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(=O)[O-] 62a_100010739614_100020667443 [0,1,0,0,0,0|3,0,0]=4 1414 B15R1.1803 COc1cc(c(cc1Cl)F)SCC(=O)[O-] 62a_100020667443_100010739614 [0,1,0,0,0,0|3,0,0]=4 1415 B15R1.1803 COc1cc(c(cc1F)Br)NCC(=O)N 34a_100010208193_100000187820 [0,1,0,0,0,0|3,0,0]=4 1416 B15R1.1803 COc1cc(c(cc1F)Br)NCC(=O)N 7a_100010208193_100000187820 [0,1,0,0,0,0|3,0,0]=4 1417 B15R1.1803 COc1cc(c(cc1F)Br)NCC(=O)[O-] 34a_100010208193_100020667443 [0,1,0,0,0,0|3,0,0]=4 1418 B15R1.1803 COc1cc(c(cc1F)C)SCC(=O)N 62a_100000747473_100011009880 [0,1,0,0,0,0|3,0,0]=4 1419 B15R1.1803 COc1cc(c(cc1F)C)SCC(=O)N 62a_100011009880_100000747473 [0,1,0,0,0,0|3,0,0]=4 1420 B15R1.1803 COc1cc(c(cc1F)C)SCC(=O)[O-] 62a_100011009880_100020667443 [0,1,0,0,0,0|3,0,0]=4 1421 B15R1.1803 COc1cc(c(cc1F)C)SCC(=O)[O-] 62a_100020667443_100011009880 [0,1,0,0,0,0|3,0,0]=4 1422 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(=O)N 34a_100009958774_100000187820 [0,1,0,0,0,0|3,0,0]=4 1423 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(=O)N 7a_100009958774_100000187820 [0,1,0,0,0,0|3,0,0]=4 1424 B15R1.1803 COc1cc(c(cc1F)Cl)NCC(=O)[O-] 34a_100009958774_100020667443 [0,1,0,0,0,0|3,0,0]=4 1425 B15R1.1803 COc1cc(c(cc1F)F)SCC(=O)N 62a_100000747473_200015541288 [0,1,0,0,0,0|3,0,0]=4 1426 B15R1.1803 COc1cc(c(cc1F)F)SCC(=O)N 62a_200015541288_100000747473 [0,1,0,0,0,0|3,0,0]=4 1427 B15R1.1803 COc1cc(c(cc1F)F)SCC(=O)[O-] 62a_100020667443_200015541288 [0,1,0,0,0,0|3,0,0]=4 1428 B15R1.1803 COc1cc(c(cc1F)F)SCC(=O)[O-] 62a_200015541288_100020667443 [0,1,0,0,0,0|3,0,0]=4 1429 B15R1.1803 COc1cc(c(cc1F)N)SCC(=O)N 62a_100000747473_100010365326 [0,1,0,0,0,0|3,0,0]=4 1430 B15R1.1803 COc1cc(c(cc1F)N)SCC(=O)N 62a_100010365326_100000747473 [0,1,0,0,0,0|3,0,0]=4 1431 B15R1.1803 COc1cc(c(cc1F)N)SCC(=O)[O-] 62a_100010365326_100020667443 [0,1,0,0,0,0|3,0,0]=4 1432 B15R1.1803 COc1cc(c(cc1F)N)SCC(=O)[O-] 62a_100020667443_100010365326 [0,1,0,0,0,0|3,0,0]=4 1433 B15R1.1803 COc1cc(c(cc1N)C)SCC(=O)N 62a_100000747473_100010141321 [0,1,0,0,0,0|3,0,0]=4 1434 B15R1.1803 COc1cc(c(cc1N)C)SCC(=O)N 62a_100010141321_100000747473 [0,1,0,0,0,0|3,0,0]=4 1435 B15R1.1803 COc1cc(c(cc1N)C)SCC(=O)[O-] 62a_100010141321_100020667443 [0,1,0,0,0,0|3,0,0]=4 1436 B15R1.1803 COc1cc(c(cc1N)C)SCC(=O)[O-] 62a_100020667443_100010141321 [0,1,0,0,0,0|3,0,0]=4 1437 B15R1.1803 COc1cc(c(cc1N)F)SCC(=O)N 62a_100000747473_100012766639 [0,1,0,0,0,0|3,0,0]=4 1438 B15R1.1803 COc1cc(c(cc1N)F)SCC(=O)N 62a_100012766639_100000747473 [0,1,0,0,0,0|3,0,0]=4 1439 B15R1.1803 COc1cc(c(cc1N)F)SCC(=O)[O-] 62a_100012766639_100020667443 [0,1,0,0,0,0|3,0,0]=4 1440 B15R1.1803 COc1cc(c(cc1N)F)SCC(=O)[O-] 62a_100020667443_100012766639 [0,1,0,0,0,0|3,0,0]=4 1441 B15R1.1803 COc1cc(c(cc1O)F)SCC(=O)N 62a_100000747473_100010189133 [0,1,0,0,0,0|2,0,0]=3 1442 B15R1.1803 COc1cc(c(cc1O)F)SCC(=O)[O-] 62a_100020667443_100010189133 [0,1,0,0,0,0|2,0,0]=3 1443 B15R1.1803 COc1cc(c(cc1O)F)SCC(C)C 62a_100000210624_100010189133 [0,1,0,0,0,0|2,0,1]=4 1444 B15R1.1803 COc1cc(c(cc1O)F)SCC(C)O 62a_100011218427_100010189133 [0,1,0,0,0,0|1,0,2]=4 1445 B15R1.1803 COc1cc(c(cc1O)F)SC[C@@H](C)O 62a_100009817552_100010189133 [0,1,0,0,0,0|1,0,2]=4 1446 B15R1.4027 COc1cc(ccc1Cl)CNS(=O)(=O)C 40a_100015204853_100000738038 [0,1,0,0,0,0|3,0,0]=4 1447 B15R1.4027 COc1cc(ccc1F)CNS(=O)(=O)C 40a_100020626639_100000738038 [0,1,0,0,0,0|3,0,0]=4 1448 B15R1.4027 COc1cc(ccc1O)CNC(C)(C)C 34a_100000185554_100000210625 [0,1,0,0,0,0|2,0,1]=4 1449 B15R1.4027 COc1cc(ccc1O)CNS(=O)(=O)C 40a_100000185554_100000738038 [0,1,0,0,0,0|2,0,0]=3 1450 B15R1.4027 COc1cc(ccc1O)NCC(C)(C)C 34a_100000726020_100011219605 [0,1,0,0,0,0|2,0,1]=4 1451 B15R1.4027 COc1cc(ccc1O)NCC(C)(C)F 34a_100000726020_100011997219 [0,1,0,0,0,0|2,0,1]=4 1452 B15R1.4027 COc1cc(ccc1O)NCC(C)(C)O 34a_100000726020_100000764493 [0,1,0,0,0,0|1,0,2]=4 1453 B15R1.4027 COc1cc(ccc1O)NCS(=O)(=O)[O-] 34a_100000726020_100009817235 [0,1,0,0,0,0|3,0,0]=4 1454 B15R1.4027 COc1cc(ccc1O)SCC(C)(C)C 62a_100011219605_100000694246 [0,1,0,0,0,0|2,0,1]=4 1455 B15R1.4027 COc1cc(ccc1O)SCC(C)(C)F 62a_100011997219_100000694246 [0,1,0,0,0,0|2,0,1]=4 1456 B15R1.4027 COc1cc(ccc1O)SCC(C)(C)O 62a_100000764493_100000694246 [0,1,0,0,0,0|1,0,2]=4 1457 B15R1.4027 COc1cc(ccc1O)SCS(=O)(=O)N 62a_100000741382_100000694246 [0,1,0,0,0,0|3,0,0]=4 1458 B15R1.4027 COc1cc(ccc1O)SCS(=O)(=O)[O-] 62a_100009817235_100000694246 [0,1,0,0,0,0|3,0,0]=4 1459 B15R1.4027 COc1cc(ccc1O)SC[N+](C)(C)C 62a_200000036245_100000694246 [0,1,0,0,0,0|3,0,0]=4 1460 B15R1.4027 COc1cc(ccc1O)SC[Si](C)(C)C 62a_100000037933_100000694246 [0,1,0,0,0,0|2,1,0]=4 1461 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 1462 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 1463 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 1464 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 1465 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 1466 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 1467 B15R1.4037 C=C(C)CN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000748629 [0,1,0,0,0,0|3,0,0]=4 1468 B15R1.4037 C=C(C)CN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000748629 [0,1,0,0,0,0|3,0,0]=4 1469 B15R1.4037 C=C(C)CN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000748629 [0,1,0,0,0,0|3,0,0]=4 1470 B15R1.4037 C=C(C)CN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000748629 [0,1,0,0,0,0|3,0,0]=4 1471 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 1472 B15R1.4037 CC(=O)CC(=O)c1ccc(c(c1)CO)O 1458a_100000070787_100010262812 [0,1,0,0,0,0|2,0,1]=4 1473 B15R1.4037 CCc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100012338938 [0,1,0,0,0,0|2,0,1]=4 1474 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(=O)C 1458a_100000070787_200010710740 [0,1,0,0,0,0|1,0,1]=3 1475 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(=O)N 1458a_100011934951_100000187820 [0,1,0,0,0,0|2,0,1]=4 1476 B15R1.4037 COc1cc(ccc1Br)C(=O)CC(=O)[O-] 1458a_100011934951_100020667443 [0,1,0,0,0,0|2,0,1]=4 1477 B15R1.4037 COc1cc(ccc1Br)[C@@H](N)CC(C)C 271570a_100015190218_100012353699 [0,1,0,0,0,0|2,0,1]=4 1478 B15R1.4037 COc1cc(ccc1C)C(=O)CC(=O)N 1458a_100000212341_100000187820 [0,1,0,0,0,0|2,0,1]=4 1479 B15R1.4037 COc1cc(ccc1C)C(=O)CC(=O)[O-] 1458a_100000212341_100020667443 [0,1,0,0,0,0|2,0,1]=4 1480 B15R1.4037 COc1cc(ccc1C)[C@@H](N)CC(C)C 271570a_100015190218_100011830276 [0,1,0,0,0,0|2,0,1]=4 1481 B15R1.4037 COc1cc(ccc1Cl)C(=O)CC(=O)N 1458a_100000181799_100000187820 [0,1,0,0,0,0|2,0,1]=4 1482 B15R1.4037 COc1cc(ccc1Cl)C(=O)CC(=O)[O-] 1458a_100000181799_100020667443 [0,1,0,0,0,0|2,0,1]=4 1483 B15R1.4037 COc1cc(ccc1Cl)[C@@H](N)CC(C)C 271570a_100015190218_100011356853 [0,1,0,0,0,0|2,0,1]=4 1484 B15R1.4037 COc1cc(ccc1F)C(=O)CC(=O)C 1458a_100000070787_200012348595 [0,1,0,0,0,0|1,0,1]=3 1485 B15R1.4037 COc1cc(ccc1F)C(=O)CC(=O)N 1458a_100000757635_100000187820 [0,1,0,0,0,0|2,0,1]=4 1486 B15R1.4037 COc1cc(ccc1F)C(=O)CC(=O)[O-] 1458a_100000757635_100020667443 [0,1,0,0,0,0|2,0,1]=4 1487 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)N 2230a_200012002703_100000747473 [0,1,0,0,0,0|3,0,0]=4 1488 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)N 269982a_200012002703_100000187820 [0,1,0,0,0,0|3,0,0]=4 1489 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)N 34a_200012002703_100000187820 [0,1,0,0,0,0|3,0,0]=4 1490 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)N 38a_200012002703_100000747473 [0,1,0,0,0,0|3,0,0]=4 1491 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)[O-] 269982a_200012002703_100020667443 [0,1,0,0,0,0|3,0,0]=4 1492 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)[O-] 34a_200012002703_100020667443 [0,1,0,0,0,0|3,0,0]=4 1493 B15R1.4037 COc1cc(ccc1F)N(C)CC(=O)[O-] 38a_200012002703_100020667443 [0,1,0,0,0,0|3,0,0]=4 1494 B15R1.4037 COc1cc(ccc1F)[C@@H](N)CC(C)C 271570a_100015190218_100011934186 [0,1,0,0,0,0|2,0,1]=4 1495 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 11a_100025717271_100015343762 [0,1,0,0,0,0|2,0,0]=3 1496 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 1626a_100025717271_100015343762 [0,1,0,0,0,0|2,0,0]=3 1497 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 240690a_100025717271_100015343762 [0,1,0,0,0,0|2,0,0]=3 1498 B15R1.4037 COc1cc(ccc1F)[C@H](C)NC(=O)C 527a_100025717271_100103153847 [0,1,0,0,0,0|2,0,0]=3 1499 B15R1.4037 COc1cc(ccc1I)C(=O)CC(=O)N 1458a_100012356290_100000187820 [0,1,0,0,0,0|2,0,1]=4 1500 B15R1.4037 COc1cc(ccc1I)C(=O)CC(=O)[O-] 1458a_100012356290_100020667443 [0,1,0,0,0,0|2,0,1]=4 1501 B15R1.4037 COc1cc(ccc1N)[C@@H](N)CC(C)C 271570a_100015190218_100011279103 [0,1,0,0,0,0|2,0,1]=4 1502 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)C 1458a_100000070787_100010206313 [0,1,0,0,0,0|0,0,1]=2 1503 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)N 1458a_100000687070_100000187820 [0,1,0,0,0,0|1,0,1]=3 1504 B15R1.4037 COc1cc(ccc1O)C(=O)CC(=O)[O-] 1458a_100000687070_100020667443 [0,1,0,0,0,0|1,0,1]=3 1505 B15R1.4037 COc1cc(ccc1O)C(=O)CC(C)C 1458a_100000687070_100000210624 [0,1,0,0,0,0|1,0,2]=4 1506 B15R1.4037 COc1cc(ccc1O)C(=O)CC(C)O 1458a_100000687070_100011218427 [0,1,0,0,0,0|0,0,3]=4 1507 B15R1.4037 COc1cc(ccc1O)C(=O)CN(C)C 269982a_100102631434_100010206313 [0,1,0,0,0,0|2,0,1]=4 1508 B15R1.4037 COc1cc(ccc1O)C(=O)C[N+](=O)[O-] 1458a_100000687070_100000761209 [0,1,0,0,0,0|2,0,1]=4 1509 B15R1.4037 COc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000694246 [0,1,0,0,0,0|1,0,1]=3 1510 B15R1.4037 COc1nc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100010893133 [0,1,0,0,0,0|2,0,1]=4 1511 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 1512 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 1513 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 1514 B15R1.4038 C=C(C)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000185857 [0,1,0,0,0,0|2,0,1]=4 1515 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)C#N)O 62a_100009814033_100000687585 [0,1,0,0,0,0|3,0,0]=4 1516 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)C=O)O 62a_100009814033_100000186750 [0,1,0,0,0,0|3,0,0]=4 1517 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)CN)O 62a_100000730032_100009814033 [0,1,0,0,0,0|3,0,0]=4 1518 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)CN)O 62a_100009814033_100000730032 [0,1,0,0,0,0|3,0,0]=4 1519 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100009814033 [0,1,0,0,0,0|3,0,0]=4 1520 B15R1.4038 CC(=O)C(C)Sc1ccc(c(c1)CO)O 62a_100009814033_100000184703 [0,1,0,0,0,0|3,0,0]=4 1521 B15R1.4038 CCc1cc(ccc1Br)NC(C)C(=O)C 2230a_100010109747_100009814033 [0,1,0,0,0,0|3,0,0]=4 1522 B15R1.4038 CCc1cc(ccc1Br)NC(C)C(=O)C 7a_100010109747_100000179758 [0,1,0,0,0,0|3,0,0]=4 1523 B15R1.4038 CCc1cc(ccc1Br)SC(C)C(=O)C 62a_100009814033_100010244631 [0,1,0,0,0,0|3,0,0]=4 1524 B15R1.4038 CCc1cc(ccc1Br)SC(C)C(=O)C 62a_100010244631_100009814033 [0,1,0,0,0,0|3,0,0]=4 1525 B15R1.4038 CCc1cc(ccc1Cl)OC(C)C(=O)C 7a_100000212063_100000179758 [0,1,0,0,0,0|3,0,0]=4 1526 B15R1.4038 CCc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100010244625 [0,1,0,0,0,0|3,0,0]=4 1527 B15R1.4038 CCc1cc(ccc1F)SC(C)C(=O)C 62a_100010244625_100009814033 [0,1,0,0,0,0|3,0,0]=4 1528 B15R1.4038 CCc1cc(ccc1N)SC(C)C(=O)C 62a_100000686106_100009814033 [0,1,0,0,0,0|3,0,0]=4 1529 B15R1.4038 CCc1cc(ccc1N)SC(C)C(=O)C 62a_100009814033_100000686106 [0,1,0,0,0,0|3,0,0]=4 1530 B15R1.4038 CCc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100012338938 [0,1,0,0,0,0|2,0,0]=3 1531 B15R1.4038 CCc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100012338938 [0,1,0,0,0,0|3,0,0]=4 1532 B15R1.4038 CCc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100012338938 [0,1,0,0,0,0|3,0,0]=4 1533 B15R1.4038 CCc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100012338938 [0,1,0,0,0,0|3,0,0]=4 1534 B15R1.4038 CNc1cc(ccc1C)SC(C)C(=O)C 62a_100009814033_100020629602 [0,1,0,0,0,0|3,0,0]=4 1535 B15R1.4038 CNc1cc(ccc1C)SC(C)C(=O)C 62a_100020629602_100009814033 [0,1,0,0,0,0|3,0,0]=4 1536 B15R1.4038 CNc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100011314990 [0,1,0,0,0,0|3,0,0]=4 1537 B15R1.4038 CNc1cc(ccc1F)SC(C)C(=O)C 62a_100011314990_100009814033 [0,1,0,0,0,0|3,0,0]=4 1538 B15R1.4038 CNc1cc(ccc1N)SC(C)C(=O)C 62a_100000694363_100009814033 [0,1,0,0,0,0|3,0,0]=4 1539 B15R1.4038 COc1cc(c[nH]c1=O)SC(C)C(=O)C 62a_100009814033_100010125397 [0,1,0,0,0,0|2,0,1]=4 1540 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)C 2230a_100000765947_100009814033 [0,1,0,0,0,0|2,0,0]=3 1541 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)N 2230a_100000765947_100000702099 [0,1,0,0,0,0|3,0,0]=4 1542 B15R1.4038 COc1cc(ccc1Br)NC(C)C(=O)N 34a_100000765947_100000702099 [0,1,0,0,0,0|3,0,0]=4 1543 B15R1.4038 COc1cc(ccc1Br)NC(F)C(=O)N 2230a_100000765947_100009813875 [0,1,0,0,0,0|3,0,0]=4 1544 B15R1.4038 COc1cc(ccc1Br)NC(F)C(=O)N 34a_100000765947_100009813875 [0,1,0,0,0,0|3,0,0]=4 1545 B15R1.4038 COc1cc(ccc1Br)NC(F)C(=O)[O-] 34a_100000765947_100020610796 [0,1,0,0,0,0|3,0,0]=4 1546 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)C 7a_100011827694_100000179758 [0,1,0,0,0,0|2,0,0]=3 1547 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)N 34a_100011827694_100000702099 [0,1,0,0,0,0|3,0,0]=4 1548 B15R1.4038 COc1cc(ccc1Br)OC(C)C(=O)N 7a_100011827694_100000702099 [0,1,0,0,0,0|3,0,0]=4 1549 B15R1.4038 COc1cc(ccc1Br)OC(F)C(=O)N 34a_100011827694_100009813875 [0,1,0,0,0,0|3,0,0]=4 1550 B15R1.4038 COc1cc(ccc1Br)OC(F)C(=O)N 7a_100011827694_100009813875 [0,1,0,0,0,0|3,0,0]=4 1551 B15R1.4038 COc1cc(ccc1Br)OC(F)C(=O)[O-] 34a_100011827694_100020610796 [0,1,0,0,0,0|3,0,0]=4 1552 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)C 62a_100009814033_100012353699 [0,1,0,0,0,0|2,0,0]=3 1553 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)C 62a_100012353699_100009814033 [0,1,0,0,0,0|2,0,0]=3 1554 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)N 62a_100000702099_100012353699 [0,1,0,0,0,0|3,0,0]=4 1555 B15R1.4038 COc1cc(ccc1Br)SC(C)C(=O)N 62a_100012353699_100000702099 [0,1,0,0,0,0|3,0,0]=4 1556 B15R1.4038 COc1cc(ccc1Br)SC(F)C(=O)N 62a_100009813875_100012353699 [0,1,0,0,0,0|3,0,0]=4 1557 B15R1.4038 COc1cc(ccc1Br)SC(F)C(=O)N 62a_100012353699_100009813875 [0,1,0,0,0,0|3,0,0]=4 1558 B15R1.4038 COc1cc(ccc1Br)SC(F)C(=O)[O-] 62a_100012353699_100020610796 [0,1,0,0,0,0|3,0,0]=4 1559 B15R1.4038 COc1cc(ccc1Br)SC(F)C(=O)[O-] 62a_100020610796_100012353699 [0,1,0,0,0,0|3,0,0]=4 1560 B15R1.4038 COc1cc(ccc1C)CC(C)N(C)C 270004a_100102631434_200000081148 [0,1,0,0,0,0|3,0,0]=4 1561 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)C 2230a_100011279678_100009814033 [0,1,0,0,0,0|2,0,0]=3 1562 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)N 2230a_100011279678_100000702099 [0,1,0,0,0,0|3,0,0]=4 1563 B15R1.4038 COc1cc(ccc1C)NC(C)C(=O)N 34a_100011279678_100000702099 [0,1,0,0,0,0|3,0,0]=4 1564 B15R1.4038 COc1cc(ccc1C)NC(F)C(=O)N 2230a_100011279678_100009813875 [0,1,0,0,0,0|3,0,0]=4 1565 B15R1.4038 COc1cc(ccc1C)NC(F)C(=O)N 34a_100011279678_100009813875 [0,1,0,0,0,0|3,0,0]=4 1566 B15R1.4038 COc1cc(ccc1C)NC(F)C(=O)[O-] 34a_100011279678_100020610796 [0,1,0,0,0,0|3,0,0]=4 1567 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)C 7a_100009865632_100000179758 [0,1,0,0,0,0|2,0,0]=3 1568 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)N 34a_100009865632_100000702099 [0,1,0,0,0,0|3,0,0]=4 1569 B15R1.4038 COc1cc(ccc1C)OC(C)C(=O)N 7a_100009865632_100000702099 [0,1,0,0,0,0|3,0,0]=4 1570 B15R1.4038 COc1cc(ccc1C)OC(F)C(=O)N 34a_100009865632_100009813875 [0,1,0,0,0,0|3,0,0]=4 1571 B15R1.4038 COc1cc(ccc1C)OC(F)C(=O)N 7a_100009865632_100009813875 [0,1,0,0,0,0|3,0,0]=4 1572 B15R1.4038 COc1cc(ccc1C)OC(F)C(=O)[O-] 34a_100009865632_100020610796 [0,1,0,0,0,0|3,0,0]=4 1573 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)C 62a_100009814033_100011830276 [0,1,0,0,0,0|2,0,0]=3 1574 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)C 62a_100011830276_100009814033 [0,1,0,0,0,0|2,0,0]=3 1575 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)N 62a_100000702099_100011830276 [0,1,0,0,0,0|3,0,0]=4 1576 B15R1.4038 COc1cc(ccc1C)SC(C)C(=O)N 62a_100011830276_100000702099 [0,1,0,0,0,0|3,0,0]=4 1577 B15R1.4038 COc1cc(ccc1C)SC(F)C(=O)N 62a_100009813875_100011830276 [0,1,0,0,0,0|3,0,0]=4 1578 B15R1.4038 COc1cc(ccc1C)SC(F)C(=O)N 62a_100011830276_100009813875 [0,1,0,0,0,0|3,0,0]=4 1579 B15R1.4038 COc1cc(ccc1C)SC(F)C(=O)[O-] 62a_100011830276_100020610796 [0,1,0,0,0,0|3,0,0]=4 1580 B15R1.4038 COc1cc(ccc1C)SC(F)C(=O)[O-] 62a_100020610796_100011830276 [0,1,0,0,0,0|3,0,0]=4 1581 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)C 2230a_100000742311_100009814033 [0,1,0,0,0,0|2,0,0]=3 1582 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)N 2230a_100000742311_100000702099 [0,1,0,0,0,0|3,0,0]=4 1583 B15R1.4038 COc1cc(ccc1Cl)NC(C)C(=O)N 34a_100000742311_100000702099 [0,1,0,0,0,0|3,0,0]=4 1584 B15R1.4038 COc1cc(ccc1Cl)NC(F)C(=O)N 2230a_100000742311_100009813875 [0,1,0,0,0,0|3,0,0]=4 1585 B15R1.4038 COc1cc(ccc1Cl)NC(F)C(=O)N 34a_100000742311_100009813875 [0,1,0,0,0,0|3,0,0]=4 1586 B15R1.4038 COc1cc(ccc1Cl)NC(F)C(=O)[O-] 34a_100000742311_100020610796 [0,1,0,0,0,0|3,0,0]=4 1587 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)C 7a_100012186310_100000179758 [0,1,0,0,0,0|2,0,0]=3 1588 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)N 34a_100012186310_100000702099 [0,1,0,0,0,0|3,0,0]=4 1589 B15R1.4038 COc1cc(ccc1Cl)OC(C)C(=O)N 7a_100012186310_100000702099 [0,1,0,0,0,0|3,0,0]=4 1590 B15R1.4038 COc1cc(ccc1Cl)OC(F)C(=O)N 34a_100012186310_100009813875 [0,1,0,0,0,0|3,0,0]=4 1591 B15R1.4038 COc1cc(ccc1Cl)OC(F)C(=O)N 7a_100012186310_100009813875 [0,1,0,0,0,0|3,0,0]=4 1592 B15R1.4038 COc1cc(ccc1Cl)OC(F)C(=O)[O-] 34a_100012186310_100020610796 [0,1,0,0,0,0|3,0,0]=4 1593 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)C 62a_100009814033_100011356853 [0,1,0,0,0,0|2,0,0]=3 1594 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)C 62a_100011356853_100009814033 [0,1,0,0,0,0|2,0,0]=3 1595 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)N 62a_100000702099_100011356853 [0,1,0,0,0,0|3,0,0]=4 1596 B15R1.4038 COc1cc(ccc1Cl)SC(C)C(=O)N 62a_100011356853_100000702099 [0,1,0,0,0,0|3,0,0]=4 1597 B15R1.4038 COc1cc(ccc1Cl)SC(F)C(=O)N 62a_100009813875_100011356853 [0,1,0,0,0,0|3,0,0]=4 1598 B15R1.4038 COc1cc(ccc1Cl)SC(F)C(=O)N 62a_100011356853_100009813875 [0,1,0,0,0,0|3,0,0]=4 1599 B15R1.4038 COc1cc(ccc1Cl)SC(F)C(=O)[O-] 62a_100011356853_100020610796 [0,1,0,0,0,0|3,0,0]=4 1600 B15R1.4038 COc1cc(ccc1Cl)SC(F)C(=O)[O-] 62a_100020610796_100011356853 [0,1,0,0,0,0|3,0,0]=4 1601 B15R1.4038 COc1cc(ccc1F)CC(C)N(C)C 270004a_100102631434_200000078651 [0,1,0,0,0,0|3,0,0]=4 1602 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)C 2230a_100000701188_100009814033 [0,1,0,0,0,0|2,0,0]=3 1603 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)N 2230a_100000701188_100000702099 [0,1,0,0,0,0|3,0,0]=4 1604 B15R1.4038 COc1cc(ccc1F)NC(C)C(=O)N 34a_100000701188_100000702099 [0,1,0,0,0,0|3,0,0]=4 1605 B15R1.4038 COc1cc(ccc1F)NC(F)C(=O)N 2230a_100000701188_100009813875 [0,1,0,0,0,0|3,0,0]=4 1606 B15R1.4038 COc1cc(ccc1F)NC(F)C(=O)N 34a_100000701188_100009813875 [0,1,0,0,0,0|3,0,0]=4 1607 B15R1.4038 COc1cc(ccc1F)NC(F)C(=O)[O-] 34a_100000701188_100020610796 [0,1,0,0,0,0|3,0,0]=4 1608 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)C 7a_100012001760_100000179758 [0,1,0,0,0,0|2,0,0]=3 1609 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)N 34a_100012001760_100000702099 [0,1,0,0,0,0|3,0,0]=4 1610 B15R1.4038 COc1cc(ccc1F)OC(C)C(=O)N 7a_100012001760_100000702099 [0,1,0,0,0,0|3,0,0]=4 1611 B15R1.4038 COc1cc(ccc1F)OC(F)C(=O)N 34a_100012001760_100009813875 [0,1,0,0,0,0|3,0,0]=4 1612 B15R1.4038 COc1cc(ccc1F)OC(F)C(=O)N 7a_100012001760_100009813875 [0,1,0,0,0,0|3,0,0]=4 1613 B15R1.4038 COc1cc(ccc1F)OC(F)C(=O)[O-] 34a_100012001760_100020610796 [0,1,0,0,0,0|3,0,0]=4 1614 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100011934186 [0,1,0,0,0,0|2,0,0]=3 1615 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)C 62a_100011934186_100009814033 [0,1,0,0,0,0|2,0,0]=3 1616 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)N 62a_100000702099_100011934186 [0,1,0,0,0,0|3,0,0]=4 1617 B15R1.4038 COc1cc(ccc1F)SC(C)C(=O)N 62a_100011934186_100000702099 [0,1,0,0,0,0|3,0,0]=4 1618 B15R1.4038 COc1cc(ccc1F)SC(F)C(=O)N 62a_100009813875_100011934186 [0,1,0,0,0,0|3,0,0]=4 1619 B15R1.4038 COc1cc(ccc1F)SC(F)C(=O)N 62a_100011934186_100009813875 [0,1,0,0,0,0|3,0,0]=4 1620 B15R1.4038 COc1cc(ccc1F)SC(F)C(=O)[O-] 62a_100011934186_100020610796 [0,1,0,0,0,0|3,0,0]=4 1621 B15R1.4038 COc1cc(ccc1F)SC(F)C(=O)[O-] 62a_100020610796_100011934186 [0,1,0,0,0,0|3,0,0]=4 1622 B15R1.4038 COc1cc(ccc1I)NC(C)C(=O)N 34a_100000746945_100000702099 [0,1,0,0,0,0|3,0,0]=4 1623 B15R1.4038 COc1cc(ccc1I)NC(F)C(=O)N 34a_100000746945_100009813875 [0,1,0,0,0,0|3,0,0]=4 1624 B15R1.4038 COc1cc(ccc1I)NC(F)C(=O)[O-] 34a_100000746945_100020610796 [0,1,0,0,0,0|3,0,0]=4 1625 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)C 7a_100015326901_100000179758 [0,1,0,0,0,0|2,0,0]=3 1626 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)N 34a_100015326901_100000702099 [0,1,0,0,0,0|3,0,0]=4 1627 B15R1.4038 COc1cc(ccc1N)OC(C)C(=O)N 7a_100015326901_100000702099 [0,1,0,0,0,0|3,0,0]=4 1628 B15R1.4038 COc1cc(ccc1N)OC(F)C(=O)N 34a_100015326901_100009813875 [0,1,0,0,0,0|3,0,0]=4 1629 B15R1.4038 COc1cc(ccc1N)OC(F)C(=O)N 7a_100015326901_100009813875 [0,1,0,0,0,0|3,0,0]=4 1630 B15R1.4038 COc1cc(ccc1N)OC(F)C(=O)[O-] 34a_100015326901_100020610796 [0,1,0,0,0,0|3,0,0]=4 1631 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)C 62a_100009814033_100015196925 [0,1,0,0,0,0|2,0,0]=3 1632 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)C 62a_100011279103_100009814033 [0,1,0,0,0,0|2,0,0]=3 1633 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)N 62a_100000702099_100015196925 [0,1,0,0,0,0|3,0,0]=4 1634 B15R1.4038 COc1cc(ccc1N)SC(C)C(=O)N 62a_100011279103_100000702099 [0,1,0,0,0,0|3,0,0]=4 1635 B15R1.4038 COc1cc(ccc1N)SC(F)C(=O)N 62a_100009813875_100015196925 [0,1,0,0,0,0|3,0,0]=4 1636 B15R1.4038 COc1cc(ccc1N)SC(F)C(=O)N 62a_100011279103_100009813875 [0,1,0,0,0,0|3,0,0]=4 1637 B15R1.4038 COc1cc(ccc1N)SC(F)C(=O)[O-] 62a_100011279103_100020610796 [0,1,0,0,0,0|3,0,0]=4 1638 B15R1.4038 COc1cc(ccc1N)SC(F)C(=O)[O-] 62a_100020610796_100015196925 [0,1,0,0,0,0|3,0,0]=4 1639 B15R1.4038 COc1cc(ccc1O)CC(=O)C(C)C 1458a_100000032101_100000210206 [0,1,0,0,0,0|1,0,2]=4 1640 B15R1.4038 COc1cc(ccc1O)CC(=O)N(C)C 240690a_100102631434_100000032101 [0,1,0,0,0,0|2,0,1]=4 1641 B15R1.4038 COc1cc(ccc1O)CC(=O)N(C)C 527a_100102631434_100000032101 [0,1,0,0,0,0|2,0,1]=4 1642 B15R1.4038 COc1cc(ccc1O)NC(=O)C(=O)N 22a_100000726020_100011215815 [0,1,0,0,0,0|2,0,1]=4 1643 B15R1.4038 COc1cc(ccc1O)NC(C)C(=O)N 34a_100000726020_100000702099 [0,1,0,0,0,0|2,0,0]=3 1644 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)N 34a_100000726020_100009813875 [0,1,0,0,0,0|2,0,0]=3 1645 B15R1.4038 COc1cc(ccc1O)NC(F)C(=O)[O-] 34a_100000726020_100020610796 [0,1,0,0,0,0|2,0,0]=3 1646 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100000694246 [0,1,0,0,0,0|1,0,0]=2 1647 B15R1.4038 COc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000694246 [0,1,0,0,0,0|2,0,0]=3 1648 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000694246 [0,1,0,0,0,0|2,0,0]=3 1649 B15R1.4038 COc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000694246 [0,1,0,0,0,0|2,0,0]=3 1650 B15R1.4038 COc1cc(cnc1C)SC(C)C(=O)C 62a_100009814033_100010254219 [0,1,0,0,0,0|3,0,0]=4 1651 B15R1.4038 COc1cc(cnc1C)SC(C)C(=O)C 62a_100010254219_100009814033 [0,1,0,0,0,0|3,0,0]=4 1652 B15R1.4038 COc1cc(cnc1F)SC(C)C(=O)C 62a_100009814033_100010214931 [0,1,0,0,0,0|3,0,0]=4 1653 B15R1.4038 COc1cc(cnc1F)SC(C)C(=O)C 62a_100010214931_100009814033 [0,1,0,0,0,0|3,0,0]=4 1654 B15R1.4038 COc1cc(cnc1N)SC(C)C(=O)C 62a_100009814033_106354213024 [0,1,0,0,0,0|3,0,0]=4 1655 B15R1.4038 COc1cc(cnc1N)SC(C)C(=O)C 62a_106354213024_100009814033 [0,1,0,0,0,0|3,0,0]=4 1656 B15R1.4038 COc1cc(ncc1C)SC(C)C(=O)C 62a_100009814033_100010067687 [0,1,0,0,0,0|3,0,0]=4 1657 B15R1.4038 COc1cc(ncc1C)SC(C)C(=O)C 62a_100010067687_100009814033 [0,1,0,0,0,0|3,0,0]=4 1658 B15R1.4038 COc1cc(ncc1F)SC(C)C(=O)C 62a_100009814033_200010136270 [0,1,0,0,0,0|3,0,0]=4 1659 B15R1.4038 COc1cc(ncc1F)SC(C)C(=O)C 62a_200010136270_100009814033 [0,1,0,0,0,0|3,0,0]=4 1660 B15R1.4038 COc1cc(ncc1N)SC(C)C(=O)C 62a_100009814033_100009887741 [0,1,0,0,0,0|3,0,0]=4 1661 B15R1.4038 COc1cc(ncc1N)SC(C)C(=O)C 62a_100009887741_100009814033 [0,1,0,0,0,0|3,0,0]=4 1662 B15R1.4038 COc1nc(ccc1N)SC(C)C(=O)C 62a_100000687816_100009814033 [0,1,0,0,0,0|3,0,0]=4 1663 B15R1.4038 COc1nc(ccc1N)SC(C)C(=O)C 62a_100009814033_100000687816 [0,1,0,0,0,0|3,0,0]=4 1664 B15R1.4038 COc1nc(ccc1O)SC(C)C(=O)C 62a_100009814033_100010893133 [0,1,0,0,0,0|2,0,0]=3 1665 B15R1.4038 COc1nc(ccc1O)SC(C)C(=O)N 62a_100000702099_100010893133 [0,1,0,0,0,0|3,0,0]=4 1666 B15R1.4038 COc1nc(ccc1O)SC(F)C(=O)N 62a_100009813875_100010893133 [0,1,0,0,0,0|3,0,0]=4 1667 B15R1.4038 COc1nc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100010893133 [0,1,0,0,0,0|3,0,0]=4 1668 B15R1.4038 COc1nc(cnc1O)SC(C)C(=O)C 62a_100009814033_200010365344 [0,1,0,0,0,0|3,0,0]=4 1669 B15R1.4038 COc1nc(cnc1O)SC(C)C(=O)C 62a_200010365344_100009814033 [0,1,0,0,0,0|3,0,0]=4 1670 B15R1.4038 CSc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100010341305 [0,1,0,0,0,0|2,1,0]=4 1671 B15R1.4038 CSc1cc(ccc1F)SC(C)C(=O)C 62a_100010341305_100009814033 [0,1,0,0,0,0|2,1,0]=4 1672 B15R1.4039 C#CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000211873_100010741665 [0,1,0,0,0,0|0,0,1]=2 1673 B15R1.4039 C#CC(C)NCc1ccc(c(c1)OC)O 34a_100000185554_200000035995 [0,1,0,0,0,0|2,0,1]=4 1674 B15R1.4039 C=C(C#N)CNc1ccc(c(c1)OC)O 34a_100000726020_100000694840 [0,1,0,0,0,0|2,0,1]=4 1675 B15R1.4039 C=CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000185746_100010741665 [0,1,0,0,0,0|0,0,1]=2 1676 B15R1.4039 C=CC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000185746 [0,1,0,0,0,0|2,0,1]=4 1677 B15R1.4039 C=CC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_200121576911 [0,1,0,0,0,0|2,0,1]=4 1678 B15R1.4039 C=CC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000185746 [0,1,0,0,0,0|2,0,1]=4 1679 B15R1.4039 C=CC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_200121576911 [0,1,0,0,0,0|2,0,1]=4 1680 B15R1.4039 C=CC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_200121576911 [0,1,0,0,0,0|1,0,1]=3 1681 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)Br 1458a_100016267305_100000210202 [0,1,0,0,0,0|1,0,2]=4 1682 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)C 6a_100000719150_100000211110 [0,1,0,0,0,0|1,0,2]=4 1683 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)Cl 6a_100011998524_100000211110 [0,1,0,0,0,0|1,0,2]=4 1684 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)F 6a_100000692873_100000211110 [0,1,0,0,0,0|1,0,2]=4 1685 B15R1.4039 CCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000210202 [0,1,0,0,0,0|0,0,2]=3 1686 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)C 1458a_200000066385_100000210202 [0,1,0,0,0,0|1,0,0]=2 1687 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)F 1458a_100009849056_100000210202 [0,1,0,0,0,0|1,0,0]=2 1688 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210414_100010741665 [0,1,0,0,0,0|0,0,0]=1 1689 B15R1.4039 CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210202 [0,1,0,0,0,0|0,0,0]=1 1690 B15R1.4039 CCC(=O)CNc1ccc(c(c1)CC)Br 7a_100010109747_100000747405 [0,1,0,0,0,0|3,0,0]=4 1691 B15R1.4039 CCC(=O)COc1ccc(c(c1)CC)Cl 7a_100000212063_100000747405 [0,1,0,0,0,0|3,0,0]=4 1692 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000747405 [0,1,0,0,0,0|2,0,0]=3 1693 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000747405 [0,1,0,0,0,0|2,0,0]=3 1694 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000747405 [0,1,0,0,0,0|2,0,0]=3 1695 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000747405 [0,1,0,0,0,0|2,0,0]=3 1696 B15R1.4039 CCC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000747405 [0,1,0,0,0,0|2,0,0]=3 1697 B15R1.4039 CCC(=O)CSc1c[nH]c(=O)c(c1)OC 62a_100000747405_100010125397 [0,1,0,0,0,0|2,0,1]=4 1698 B15R1.4039 CCC(=O)CSc1cc(c(cn1)C)OC 62a_100000747405_100010067687 [0,1,0,0,0,0|3,0,0]=4 1699 B15R1.4039 CCC(=O)CSc1cc(c(cn1)C)OC 62a_100010067687_100000747405 [0,1,0,0,0,0|3,0,0]=4 1700 B15R1.4039 CCC(=O)CSc1cc(c(cn1)F)OC 62a_100000747405_200010136270 [0,1,0,0,0,0|3,0,0]=4 1701 B15R1.4039 CCC(=O)CSc1cc(c(cn1)F)OC 62a_200010136270_100000747405 [0,1,0,0,0,0|3,0,0]=4 1702 B15R1.4039 CCC(=O)CSc1cc(c(cn1)N)OC 62a_100000747405_100009887741 [0,1,0,0,0,0|3,0,0]=4 1703 B15R1.4039 CCC(=O)CSc1cc(c(cn1)N)OC 62a_100009887741_100000747405 [0,1,0,0,0,0|3,0,0]=4 1704 B15R1.4039 CCC(=O)CSc1ccc(c(c1)C#N)O 62a_100000747405_100000687585 [0,1,0,0,0,0|3,0,0]=4 1705 B15R1.4039 CCC(=O)CSc1ccc(c(c1)C=O)O 62a_100000747405_100000186750 [0,1,0,0,0,0|3,0,0]=4 1706 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)Br 62a_100000747405_100010244631 [0,1,0,0,0,0|3,0,0]=4 1707 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)Br 62a_100010244631_100000747405 [0,1,0,0,0,0|3,0,0]=4 1708 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)F 62a_100000747405_100010244625 [0,1,0,0,0,0|3,0,0]=4 1709 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)F 62a_100010244625_100000747405 [0,1,0,0,0,0|3,0,0]=4 1710 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)N 62a_100000686106_100000747405 [0,1,0,0,0,0|3,0,0]=4 1711 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)N 62a_100000747405_100000686106 [0,1,0,0,0,0|3,0,0]=4 1712 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CC)O 62a_100000747405_100012338938 [0,1,0,0,0,0|2,0,0]=3 1713 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CN)O 62a_100000730032_100000747405 [0,1,0,0,0,0|3,0,0]=4 1714 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CN)O 62a_100000747405_100000730032 [0,1,0,0,0,0|3,0,0]=4 1715 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CO)O 62a_100000184703_100000747405 [0,1,0,0,0,0|3,0,0]=4 1716 B15R1.4039 CCC(=O)CSc1ccc(c(c1)CO)O 62a_100000747405_100000184703 [0,1,0,0,0,0|3,0,0]=4 1717 B15R1.4039 CCC(=O)CSc1ccc(c(c1)NC)C 62a_100000747405_100020629602 [0,1,0,0,0,0|3,0,0]=4 1718 B15R1.4039 CCC(=O)CSc1ccc(c(c1)NC)C 62a_100020629602_100000747405 [0,1,0,0,0,0|3,0,0]=4 1719 B15R1.4039 CCC(=O)CSc1ccc(c(c1)NC)F 62a_100000747405_100011314990 [0,1,0,0,0,0|3,0,0]=4 1720 B15R1.4039 CCC(=O)CSc1ccc(c(c1)NC)F 62a_100011314990_100000747405 [0,1,0,0,0,0|3,0,0]=4 1721 B15R1.4039 CCC(=O)CSc1ccc(c(c1)NC)N 62a_100000694363_100000747405 [0,1,0,0,0,0|3,0,0]=4 1722 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Br 62a_100000747405_100012353699 [0,1,0,0,0,0|2,0,0]=3 1723 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000747405 [0,1,0,0,0,0|2,0,0]=3 1724 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)C 62a_100000747405_100011830276 [0,1,0,0,0,0|2,0,0]=3 1725 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000747405 [0,1,0,0,0,0|2,0,0]=3 1726 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000747405_100011356853 [0,1,0,0,0,0|2,0,0]=3 1727 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000747405 [0,1,0,0,0,0|2,0,0]=3 1728 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)F 62a_100000747405_100011934186 [0,1,0,0,0,0|2,0,0]=3 1729 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000747405 [0,1,0,0,0,0|2,0,0]=3 1730 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)N 62a_100000747405_100015196925 [0,1,0,0,0,0|2,0,0]=3 1731 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000747405 [0,1,0,0,0,0|2,0,0]=3 1732 B15R1.4039 CCC(=O)CSc1ccc(c(c1)OC)O 62a_100000747405_100000694246 [0,1,0,0,0,0|1,0,0]=2 1733 B15R1.4039 CCC(=O)CSc1ccc(c(c1)SC)F 62a_100000747405_100010341305 [0,1,0,0,0,0|2,1,0]=4 1734 B15R1.4039 CCC(=O)CSc1ccc(c(c1)SC)F 62a_100010341305_100000747405 [0,1,0,0,0,0|2,1,0]=4 1735 B15R1.4039 CCC(=O)CSc1ccc(c(n1)OC)N 62a_100000687816_100000747405 [0,1,0,0,0,0|3,0,0]=4 1736 B15R1.4039 CCC(=O)CSc1ccc(c(n1)OC)N 62a_100000747405_100000687816 [0,1,0,0,0,0|3,0,0]=4 1737 B15R1.4039 CCC(=O)CSc1ccc(c(n1)OC)O 62a_100000747405_100010893133 [0,1,0,0,0,0|2,0,0]=3 1738 B15R1.4039 CCC(=O)CSc1cnc(c(c1)OC)C 62a_100000747405_100010254219 [0,1,0,0,0,0|3,0,0]=4 1739 B15R1.4039 CCC(=O)CSc1cnc(c(c1)OC)C 62a_100010254219_100000747405 [0,1,0,0,0,0|3,0,0]=4 1740 B15R1.4039 CCC(=O)CSc1cnc(c(c1)OC)F 62a_100000747405_100010214931 [0,1,0,0,0,0|3,0,0]=4 1741 B15R1.4039 CCC(=O)CSc1cnc(c(c1)OC)F 62a_100010214931_100000747405 [0,1,0,0,0,0|3,0,0]=4 1742 B15R1.4039 CCC(=O)CSc1cnc(c(c1)OC)N 62a_100000747405_106354213024 [0,1,0,0,0,0|3,0,0]=4 1743 B15R1.4039 CCC(=O)CSc1cnc(c(c1)OC)N 62a_106354213024_100000747405 [0,1,0,0,0,0|3,0,0]=4 1744 B15R1.4039 CCC(=O)CSc1cnc(c(n1)OC)O 62a_100000747405_200010365344 [0,1,0,0,0,0|3,0,0]=4 1745 B15R1.4039 CCC(=O)CSc1cnc(c(n1)OC)O 62a_200010365344_100000747405 [0,1,0,0,0,0|3,0,0]=4 1746 B15R1.4039 CCC(=O)NCc1ccc(c(c1)CC)F 11a_114873767189_100000210414 [0,1,0,0,0,0|3,0,0]=4 1747 B15R1.4039 CCC(=O)NCc1ccc(c(c1)CC)F 1626a_114873767189_100000210414 [0,1,0,0,0,0|3,0,0]=4 1748 B15R1.4039 CCC(=O)NCc1ccc(c(c1)CC)F 240690a_114873767189_100000210414 [0,1,0,0,0,0|3,0,0]=4 1749 B15R1.4039 CCC(=O)NCc1ccc(c(c1)CC)F 527a_114873767189_100000210414 [0,1,0,0,0,0|3,0,0]=4 1750 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 11a_100015204853_100000210414 [0,1,0,0,0,0|2,0,0]=3 1751 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000210414 [0,1,0,0,0,0|2,0,0]=3 1752 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_100000210414 [0,1,0,0,0,0|2,0,0]=3 1753 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)Cl 527a_100015204853_100000210414 [0,1,0,0,0,0|2,0,0]=3 1754 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 11a_100020626639_100000210414 [0,1,0,0,0,0|2,0,0]=3 1755 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000210414 [0,1,0,0,0,0|2,0,0]=3 1756 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_100000210414 [0,1,0,0,0,0|2,0,0]=3 1757 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)F 527a_100020626639_100000210414 [0,1,0,0,0,0|2,0,0]=3 1758 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210414 [0,1,0,0,0,0|1,0,0]=2 1759 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210414 [0,1,0,0,0,0|1,0,0]=2 1760 B15R1.4039 CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210414 [0,1,0,0,0,0|1,0,0]=2 1761 B15R1.4039 CCC(=O)NCc1ccc(c(n1)OC)Cl 11a_200015507175_100000210414 [0,1,0,0,0,0|3,0,0]=4 1762 B15R1.4039 CCC(=O)NCc1ccc(c(n1)OC)Cl 1626a_200015507175_100000210414 [0,1,0,0,0,0|3,0,0]=4 1763 B15R1.4039 CCC(=O)NCc1ccc(c(n1)OC)Cl 240690a_200015507175_100000210414 [0,1,0,0,0,0|3,0,0]=4 1764 B15R1.4039 CCC(=O)NCc1ccc(c(n1)OC)Cl 527a_200015507175_100000210414 [0,1,0,0,0,0|3,0,0]=4 1765 B15R1.4039 CCC(=O)NNc1ccc(c(c1)OC)F 22a_102515433066_100000210414 [0,1,0,0,0,0|3,0,0]=4 1766 B15R1.4039 CCC(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748023 [0,1,0,0,0,0|2,0,1]=4 1767 B15R1.4039 CCC(C)CSc1ccc(c(c1)OC)O 62a_100000748023_100000694246 [0,1,0,0,0,0|2,0,1]=4 1768 B15R1.4039 CCC(C)NCc1ccc(c(c1)OC)O 34a_100000185554_100011215416 [0,1,0,0,0,0|2,0,1]=4 1769 B15R1.4039 CCC(O)CNc1ccc(c(c1)OC)O 34a_100000726020_100011218378 [0,1,0,0,0,0|1,0,2]=4 1770 B15R1.4039 CCC(O)CSc1ccc(c(c1)OC)O 62a_100011218378_100000694246 [0,1,0,0,0,0|1,0,2]=4 1771 B15R1.4039 CCN(C)CCc1ccc(c(c1)OC)O 2230a_100000225621_100010741665 [0,1,0,0,0,0|2,0,0]=3 1772 B15R1.4039 CCN(C)CCc1ccc(c(c1)OC)O 269982a_100000225621_100010741665 [0,1,0,0,0,0|2,0,0]=3 1773 B15R1.4039 CC[C@H](C)CNc1ccc(c(c1)OC)O 34a_100000726020_100009816398 [0,1,0,0,0,0|2,0,1]=4 1774 B15R1.4039 CC[C@H](C)CSc1ccc(c(c1)OC)O 62a_100009816398_100000694246 [0,1,0,0,0,0|2,0,1]=4 1775 B15R1.4039 CCc1cc(ccc1Br)NCC(=O)NC 2230a_100010109747_100000183359 [0,1,0,0,0,0|3,0,0]=4 1776 B15R1.4039 CCc1cc(ccc1Br)NCC(=O)NC 34a_100010109747_100000183359 [0,1,0,0,0,0|3,0,0]=4 1777 B15R1.4039 CCc1cc(ccc1Br)NCC(=O)NC 7a_100010109747_100000183359 [0,1,0,0,0,0|3,0,0]=4 1778 B15R1.4039 CCc1cc(ccc1Br)NCC(=O)OC 2230a_100010109747_100000747449 [0,1,0,0,0,0|3,0,0]=4 1779 B15R1.4039 CCc1cc(ccc1Br)NCC(=O)OC 34a_100010109747_100000747449 [0,1,0,0,0,0|3,0,0]=4 1780 B15R1.4039 CCc1cc(ccc1Br)NCC(=O)OC 7a_100010109747_100000747449 [0,1,0,0,0,0|3,0,0]=4 1781 B15R1.4039 CCc1cc(ccc1Br)SCC(=O)NC 62a_100000183359_100010244631 [0,1,0,0,0,0|3,0,0]=4 1782 B15R1.4039 CCc1cc(ccc1Br)SCC(=O)NC 62a_100010244631_100000183359 [0,1,0,0,0,0|3,0,0]=4 1783 B15R1.4039 CCc1cc(ccc1Br)SCC(=O)OC 62a_100000747449_100010244631 [0,1,0,0,0,0|3,0,0]=4 1784 B15R1.4039 CCc1cc(ccc1Br)SCC(=O)OC 62a_100010244631_100000747449 [0,1,0,0,0,0|3,0,0]=4 1785 B15R1.4039 CCc1cc(ccc1Cl)OCC(=O)NC 34a_100000212063_100000183359 [0,1,0,0,0,0|3,0,0]=4 1786 B15R1.4039 CCc1cc(ccc1Cl)OCC(=O)NC 7a_100000212063_100000183359 [0,1,0,0,0,0|3,0,0]=4 1787 B15R1.4039 CCc1cc(ccc1Cl)OCC(=O)OC 34a_100000212063_100000747449 [0,1,0,0,0,0|3,0,0]=4 1788 B15R1.4039 CCc1cc(ccc1Cl)OCC(=O)OC 7a_100000212063_100000747449 [0,1,0,0,0,0|3,0,0]=4 1789 B15R1.4039 CCc1cc(ccc1F)CNC(=O)CO 240690a_114873767189_100000210174 [0,1,0,0,0,0|3,0,0]=4 1790 B15R1.4039 CCc1cc(ccc1F)CNC(=O)CO 527a_114873767189_100000210174 [0,1,0,0,0,0|3,0,0]=4 1791 B15R1.4039 CCc1cc(ccc1F)CNC(=O)NC 2708a_100102657272_114873767189 [0,1,0,0,0,0|3,0,0]=4 1792 B15R1.4039 CCc1cc(ccc1F)CNC(=O)NC 2708a_114873767189_106832991635 [0,1,0,0,0,0|3,0,0]=4 1793 B15R1.4039 CCc1cc(ccc1F)CNC(=O)NC 273464a_100102657272_114873767189 [0,1,0,0,0,0|3,0,0]=4 1794 B15R1.4039 CCc1cc(ccc1F)CNC(=O)NC 273464a_114873767189_100102657272 [0,1,0,0,0,0|3,0,0]=4 1795 B15R1.4039 CCc1cc(ccc1F)CNC(=O)NC 512a_106832991638_114873767189 [0,1,0,0,0,0|3,0,0]=4 1796 B15R1.4039 CCc1cc(ccc1F)CNC(=O)NC 512a_114873767189_100102657272 [0,1,0,0,0,0|3,0,0]=4 1797 B15R1.4039 CCc1cc(ccc1F)SCC(=O)NC 62a_100000183359_100010244625 [0,1,0,0,0,0|3,0,0]=4 1798 B15R1.4039 CCc1cc(ccc1F)SCC(=O)NC 62a_100010244625_100000183359 [0,1,0,0,0,0|3,0,0]=4 1799 B15R1.4039 CCc1cc(ccc1F)SCC(=O)OC 62a_100000747449_100010244625 [0,1,0,0,0,0|3,0,0]=4 1800 B15R1.4039 CCc1cc(ccc1F)SCC(=O)OC 62a_100010244625_100000747449 [0,1,0,0,0,0|3,0,0]=4 1801 B15R1.4039 CCc1cc(ccc1N)SCC(=O)NC 62a_100000183359_100000686106 [0,1,0,0,0,0|3,0,0]=4 1802 B15R1.4039 CCc1cc(ccc1N)SCC(=O)NC 62a_100000686106_100000183359 [0,1,0,0,0,0|3,0,0]=4 1803 B15R1.4039 CCc1cc(ccc1N)SCC(=O)OC 62a_100000686106_100000747449 [0,1,0,0,0,0|3,0,0]=4 1804 B15R1.4039 CCc1cc(ccc1N)SCC(=O)OC 62a_100000747449_100000686106 [0,1,0,0,0,0|3,0,0]=4 1805 B15R1.4039 CCc1cc(ccc1O)SCC(=O)NC 62a_100000183359_100012338938 [0,1,0,0,0,0|2,0,0]=3 1806 B15R1.4039 CCc1cc(ccc1O)SCC(=O)OC 62a_100000747449_100012338938 [0,1,0,0,0,0|2,0,0]=3 1807 B15R1.4039 CNC(=O)C=Cc1ccc(c(c1)OC)Br 11a_106832991635_100016267305 [0,1,0,0,0,0|1,0,2]=4 1808 B15R1.4039 CNC(=O)C=Cc1ccc(c(c1)OC)Br 1626a_100102657272_100016267305 [0,1,0,0,0,0|1,0,2]=4 1809 B15R1.4039 CNC(=O)C=Cc1ccc(c(c1)OC)Br 240690a_100102657272_100016267305 [0,1,0,0,0,0|1,0,2]=4 1810 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 11a_106832991635_200000066385 [0,1,0,0,0,0|1,0,0]=2 1811 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 1626a_100102657272_200000066385 [0,1,0,0,0,0|1,0,0]=2 1812 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 240690a_100102657272_200000066385 [0,1,0,0,0,0|1,0,0]=2 1813 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)C 527a_100102657272_200000066385 [0,1,0,0,0,0|1,0,0]=2 1814 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 11a_106832991635_100009849056 [0,1,0,0,0,0|1,0,0]=2 1815 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 1626a_100102657272_100009849056 [0,1,0,0,0,0|1,0,0]=2 1816 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 240690a_100102657272_100009849056 [0,1,0,0,0,0|1,0,0]=2 1817 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)F 527a_100102657272_100009849056 [0,1,0,0,0,0|1,0,0]=2 1818 B15R1.4039 CNC(=O)CCc1ccc(c(c1)OC)O 240690a_100102657272_100011216321 [0,1,0,0,0,0|0,0,0]=1 1819 B15R1.4039 CNC(=O)CNc1ccc(c(c1)C#N)O 34a_100011249283_100000183359 [0,1,0,0,0,0|3,0,0]=4 1820 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000183359 [0,1,0,0,0,0|2,0,0]=3 1821 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000183359 [0,1,0,0,0,0|2,0,0]=3 1822 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000183359 [0,1,0,0,0,0|2,0,0]=3 1823 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)C 34a_100011279678_100000183359 [0,1,0,0,0,0|2,0,0]=3 1824 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000183359 [0,1,0,0,0,0|2,0,0]=3 1825 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000183359 [0,1,0,0,0,0|2,0,0]=3 1826 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000183359 [0,1,0,0,0,0|2,0,0]=3 1827 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)F 34a_100000701188_100000183359 [0,1,0,0,0,0|2,0,0]=3 1828 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)I 34a_100000746945_100000183359 [0,1,0,0,0,0|2,0,0]=3 1829 B15R1.4039 CNC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000183359 [0,1,0,0,0,0|1,0,0]=2 1830 B15R1.4039 CNC(=O)COc1ccc(c(c1)NC)Br 2230a_200010369465_200000210301 [0,1,0,0,0,0|3,0,0]=4 1831 B15R1.4039 CNC(=O)COc1ccc(c(c1)NC)Br 34a_200010369465_200000210301 [0,1,0,0,0,0|3,0,0]=4 1832 B15R1.4039 CNC(=O)COc1ccc(c(c1)N[13CH3])Br 2230a_200010369465_200025704644 [0,1,0,0,0,0|3,0,0]=4 1833 B15R1.4039 CNC(=O)COc1ccc(c(c1)N[13CH3])Br 34a_200010369465_200025704644 [0,1,0,0,0,0|3,0,0]=4 1834 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Br 34a_100011827694_100000183359 [0,1,0,0,0,0|2,0,0]=3 1835 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000183359 [0,1,0,0,0,0|2,0,0]=3 1836 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)C 34a_100009865632_100000183359 [0,1,0,0,0,0|2,0,0]=3 1837 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000183359 [0,1,0,0,0,0|2,0,0]=3 1838 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000183359 [0,1,0,0,0,0|2,0,0]=3 1839 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000183359 [0,1,0,0,0,0|2,0,0]=3 1840 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)F 34a_100012001760_100000183359 [0,1,0,0,0,0|2,0,0]=3 1841 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000183359 [0,1,0,0,0,0|2,0,0]=3 1842 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)N 34a_100015326901_100000183359 [0,1,0,0,0,0|2,0,0]=3 1843 B15R1.4039 CNC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000183359 [0,1,0,0,0,0|2,0,0]=3 1844 B15R1.4039 CNC(=O)CSc1c[nH]c(=O)c(c1)OC 62a_100000183359_100010125397 [0,1,0,0,0,0|2,0,1]=4 1845 B15R1.4039 CNC(=O)CSc1cc(c(cn1)C)OC 62a_100000183359_100010067687 [0,1,0,0,0,0|3,0,0]=4 1846 B15R1.4039 CNC(=O)CSc1cc(c(cn1)C)OC 62a_100010067687_100000183359 [0,1,0,0,0,0|3,0,0]=4 1847 B15R1.4039 CNC(=O)CSc1cc(c(cn1)F)OC 62a_100000183359_200010136270 [0,1,0,0,0,0|3,0,0]=4 1848 B15R1.4039 CNC(=O)CSc1cc(c(cn1)F)OC 62a_200010136270_100000183359 [0,1,0,0,0,0|3,0,0]=4 1849 B15R1.4039 CNC(=O)CSc1cc(c(cn1)N)OC 62a_100000183359_100009887741 [0,1,0,0,0,0|3,0,0]=4 1850 B15R1.4039 CNC(=O)CSc1cc(c(cn1)N)OC 62a_100009887741_100000183359 [0,1,0,0,0,0|3,0,0]=4 1851 B15R1.4039 CNC(=O)CSc1ccc(c(c1)C#N)O 62a_100000183359_100000687585 [0,1,0,0,0,0|3,0,0]=4 1852 B15R1.4039 CNC(=O)CSc1ccc(c(c1)C=O)O 62a_100000183359_100000186750 [0,1,0,0,0,0|3,0,0]=4 1853 B15R1.4039 CNC(=O)CSc1ccc(c(c1)CN)O 62a_100000183359_100000730032 [0,1,0,0,0,0|3,0,0]=4 1854 B15R1.4039 CNC(=O)CSc1ccc(c(c1)CN)O 62a_100000730032_100000183359 [0,1,0,0,0,0|3,0,0]=4 1855 B15R1.4039 CNC(=O)CSc1ccc(c(c1)CO)O 62a_100000183359_100000184703 [0,1,0,0,0,0|3,0,0]=4 1856 B15R1.4039 CNC(=O)CSc1ccc(c(c1)CO)O 62a_100000184703_100000183359 [0,1,0,0,0,0|3,0,0]=4 1857 B15R1.4039 CNC(=O)CSc1ccc(c(c1)NC)C 62a_100000183359_100020629602 [0,1,0,0,0,0|3,0,0]=4 1858 B15R1.4039 CNC(=O)CSc1ccc(c(c1)NC)C 62a_100020629602_100000183359 [0,1,0,0,0,0|3,0,0]=4 1859 B15R1.4039 CNC(=O)CSc1ccc(c(c1)NC)F 62a_100000183359_100011314990 [0,1,0,0,0,0|3,0,0]=4 1860 B15R1.4039 CNC(=O)CSc1ccc(c(c1)NC)F 62a_100011314990_100000183359 [0,1,0,0,0,0|3,0,0]=4 1861 B15R1.4039 CNC(=O)CSc1ccc(c(c1)NC)N 62a_100000694363_100000183359 [0,1,0,0,0,0|3,0,0]=4 1862 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Br 62a_100000183359_100012353699 [0,1,0,0,0,0|2,0,0]=3 1863 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000183359 [0,1,0,0,0,0|2,0,0]=3 1864 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)C 62a_100000183359_100011830276 [0,1,0,0,0,0|2,0,0]=3 1865 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000183359 [0,1,0,0,0,0|2,0,0]=3 1866 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000183359_100011356853 [0,1,0,0,0,0|2,0,0]=3 1867 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000183359 [0,1,0,0,0,0|2,0,0]=3 1868 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)F 62a_100000183359_100011934186 [0,1,0,0,0,0|2,0,0]=3 1869 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000183359 [0,1,0,0,0,0|2,0,0]=3 1870 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)N 62a_100000183359_100015196925 [0,1,0,0,0,0|2,0,0]=3 1871 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000183359 [0,1,0,0,0,0|2,0,0]=3 1872 B15R1.4039 CNC(=O)CSc1ccc(c(c1)OC)O 62a_100000183359_100000694246 [0,1,0,0,0,0|1,0,0]=2 1873 B15R1.4039 CNC(=O)CSc1ccc(c(c1)SC)F 62a_100000183359_100010341305 [0,1,0,0,0,0|2,1,0]=4 1874 B15R1.4039 CNC(=O)CSc1ccc(c(c1)SC)F 62a_100010341305_100000183359 [0,1,0,0,0,0|2,1,0]=4 1875 B15R1.4039 CNC(=O)CSc1ccc(c(n1)OC)N 62a_100000183359_100000687816 [0,1,0,0,0,0|3,0,0]=4 1876 B15R1.4039 CNC(=O)CSc1ccc(c(n1)OC)N 62a_100000687816_100000183359 [0,1,0,0,0,0|3,0,0]=4 1877 B15R1.4039 CNC(=O)CSc1ccc(c(n1)OC)O 62a_100000183359_100010893133 [0,1,0,0,0,0|2,0,0]=3 1878 B15R1.4039 CNC(=O)CSc1cnc(c(c1)OC)C 62a_100000183359_100010254219 [0,1,0,0,0,0|3,0,0]=4 1879 B15R1.4039 CNC(=O)CSc1cnc(c(c1)OC)C 62a_100010254219_100000183359 [0,1,0,0,0,0|3,0,0]=4 1880 B15R1.4039 CNC(=O)CSc1cnc(c(c1)OC)F 62a_100000183359_100010214931 [0,1,0,0,0,0|3,0,0]=4 1881 B15R1.4039 CNC(=O)CSc1cnc(c(c1)OC)F 62a_100010214931_100000183359 [0,1,0,0,0,0|3,0,0]=4 1882 B15R1.4039 CNC(=O)CSc1cnc(c(c1)OC)N 62a_100000183359_106354213024 [0,1,0,0,0,0|3,0,0]=4 1883 B15R1.4039 CNC(=O)CSc1cnc(c(c1)OC)N 62a_106354213024_100000183359 [0,1,0,0,0,0|3,0,0]=4 1884 B15R1.4039 CNC(=O)CSc1cnc(c(n1)OC)O 62a_100000183359_200010365344 [0,1,0,0,0,0|3,0,0]=4 1885 B15R1.4039 CNC(=O)CSc1cnc(c(n1)OC)O 62a_200010365344_100000183359 [0,1,0,0,0,0|3,0,0]=4 1886 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 2708a_100015204853_106832991635 [0,1,0,0,0,0|2,0,0]=3 1887 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 2708a_100102657272_100015204853 [0,1,0,0,0,0|2,0,0]=3 1888 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100015204853_100102657272 [0,1,0,0,0,0|2,0,0]=3 1889 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100102657272_100015204853 [0,1,0,0,0,0|2,0,0]=3 1890 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 512a_100015204853_100102657272 [0,1,0,0,0,0|2,0,0]=3 1891 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)Cl 512a_106832991638_100015204853 [0,1,0,0,0,0|2,0,0]=3 1892 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 2708a_100020626639_106832991635 [0,1,0,0,0,0|2,0,0]=3 1893 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 2708a_100102657272_100020626639 [0,1,0,0,0,0|2,0,0]=3 1894 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 273464a_100020626639_100102657272 [0,1,0,0,0,0|2,0,0]=3 1895 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 273464a_100102657272_100020626639 [0,1,0,0,0,0|2,0,0]=3 1896 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 512a_100020626639_100102657272 [0,1,0,0,0,0|2,0,0]=3 1897 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)F 512a_106832991638_100020626639 [0,1,0,0,0,0|2,0,0]=3 1898 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 2708a_100000185554_106832991635 [0,1,0,0,0,0|1,0,0]=2 1899 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 2708a_100102657272_100000185554 [0,1,0,0,0,0|1,0,0]=2 1900 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100102657272 [0,1,0,0,0,0|1,0,0]=2 1901 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 273464a_100102657272_100000185554 [0,1,0,0,0,0|1,0,0]=2 1902 B15R1.4039 CNC(=O)NCc1ccc(c(c1)OC)O 512a_106832991638_100000185554 [0,1,0,0,0,0|1,0,0]=2 1903 B15R1.4039 CNC(=O)NCc1ccc(c(n1)OC)Cl 2708a_100102657272_200015507175 [0,1,0,0,0,0|3,0,0]=4 1904 B15R1.4039 CNC(=O)NCc1ccc(c(n1)OC)Cl 2708a_200015507175_106832991635 [0,1,0,0,0,0|3,0,0]=4 1905 B15R1.4039 CNC(=O)NCc1ccc(c(n1)OC)Cl 273464a_100102657272_200015507175 [0,1,0,0,0,0|3,0,0]=4 1906 B15R1.4039 CNC(=O)NCc1ccc(c(n1)OC)Cl 273464a_200015507175_100102657272 [0,1,0,0,0,0|3,0,0]=4 1907 B15R1.4039 CNC(=O)NCc1ccc(c(n1)OC)Cl 512a_106832991638_200015507175 [0,1,0,0,0,0|3,0,0]=4 1908 B15R1.4039 CNC(=O)NCc1ccc(c(n1)OC)Cl 512a_200015507175_100102657272 [0,1,0,0,0,0|3,0,0]=4 1909 B15R1.4039 CNC(=O)NNc1ccc(c(c1)OC)F 273464a_100102657272_102515433066 [0,1,0,0,0,0|3,0,0]=4 1910 B15R1.4039 CNC(=O)NNc1ccc(c(c1)OC)F 512a_102515433066_100102657272 [0,1,0,0,0,0|3,0,0]=4 1911 B15R1.4039 CNC(=O)NNc1ccc(c(c1)OC)F 512a_106832991638_102515433066 [0,1,0,0,0,0|3,0,0]=4 1912 B15R1.4039 CNc1cc(ccc1C)SCC(=O)OC 62a_100000747449_100020629602 [0,1,0,0,0,0|3,0,0]=4 1913 B15R1.4039 CNc1cc(ccc1C)SCC(=O)OC 62a_100020629602_100000747449 [0,1,0,0,0,0|3,0,0]=4 1914 B15R1.4039 CNc1cc(ccc1F)SCC(=O)OC 62a_100000747449_100011314990 [0,1,0,0,0,0|3,0,0]=4 1915 B15R1.4039 CNc1cc(ccc1F)SCC(=O)OC 62a_100011314990_100000747449 [0,1,0,0,0,0|3,0,0]=4 1916 B15R1.4039 CNc1cc(ccc1N)SCC(=O)OC 62a_100000694363_100000747449 [0,1,0,0,0,0|3,0,0]=4 1917 B15R1.4039 COC(=O)CNc1ccc(c(c1)C#N)O 34a_100011249283_100000747449 [0,1,0,0,0,0|3,0,0]=4 1918 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000747449 [0,1,0,0,0,0|2,0,0]=3 1919 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000747449 [0,1,0,0,0,0|2,0,0]=3 1920 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000747449 [0,1,0,0,0,0|2,0,0]=3 1921 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)C 34a_100011279678_100000747449 [0,1,0,0,0,0|2,0,0]=3 1922 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000747449 [0,1,0,0,0,0|2,0,0]=3 1923 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000747449 [0,1,0,0,0,0|2,0,0]=3 1924 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000747449 [0,1,0,0,0,0|2,0,0]=3 1925 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)F 34a_100000701188_100000747449 [0,1,0,0,0,0|2,0,0]=3 1926 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)I 34a_100000746945_100000747449 [0,1,0,0,0,0|2,0,0]=3 1927 B15R1.4039 COC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000747449 [0,1,0,0,0,0|1,0,0]=2 1928 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Br 34a_100011827694_100000747449 [0,1,0,0,0,0|2,0,0]=3 1929 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000747449 [0,1,0,0,0,0|2,0,0]=3 1930 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)C 34a_100009865632_100000747449 [0,1,0,0,0,0|2,0,0]=3 1931 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000747449 [0,1,0,0,0,0|2,0,0]=3 1932 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000747449 [0,1,0,0,0,0|2,0,0]=3 1933 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000747449 [0,1,0,0,0,0|2,0,0]=3 1934 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)F 34a_100012001760_100000747449 [0,1,0,0,0,0|2,0,0]=3 1935 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000747449 [0,1,0,0,0,0|2,0,0]=3 1936 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)N 34a_100015326901_100000747449 [0,1,0,0,0,0|2,0,0]=3 1937 B15R1.4039 COC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000747449 [0,1,0,0,0,0|2,0,0]=3 1938 B15R1.4039 COC(=O)CSc1c[nH]c(=O)c(c1)OC 62a_100000747449_100010125397 [0,1,0,0,0,0|2,0,1]=4 1939 B15R1.4039 COC(=O)CSc1cc(c(cn1)C)OC 62a_100000747449_100010067687 [0,1,0,0,0,0|3,0,0]=4 1940 B15R1.4039 COC(=O)CSc1cc(c(cn1)C)OC 62a_100010067687_100000747449 [0,1,0,0,0,0|3,0,0]=4 1941 B15R1.4039 COC(=O)CSc1cc(c(cn1)F)OC 62a_100000747449_200010136270 [0,1,0,0,0,0|3,0,0]=4 1942 B15R1.4039 COC(=O)CSc1cc(c(cn1)F)OC 62a_200010136270_100000747449 [0,1,0,0,0,0|3,0,0]=4 1943 B15R1.4039 COC(=O)CSc1cc(c(cn1)N)OC 62a_100000747449_100009887741 [0,1,0,0,0,0|3,0,0]=4 1944 B15R1.4039 COC(=O)CSc1cc(c(cn1)N)OC 62a_100009887741_100000747449 [0,1,0,0,0,0|3,0,0]=4 1945 B15R1.4039 COC(=O)CSc1ccc(c(c1)C#N)O 62a_100000747449_100000687585 [0,1,0,0,0,0|3,0,0]=4 1946 B15R1.4039 COC(=O)CSc1ccc(c(c1)C=O)O 62a_100000747449_100000186750 [0,1,0,0,0,0|3,0,0]=4 1947 B15R1.4039 COC(=O)CSc1ccc(c(c1)CN)O 62a_100000730032_100000747449 [0,1,0,0,0,0|3,0,0]=4 1948 B15R1.4039 COC(=O)CSc1ccc(c(c1)CN)O 62a_100000747449_100000730032 [0,1,0,0,0,0|3,0,0]=4 1949 B15R1.4039 COC(=O)CSc1ccc(c(c1)CO)O 62a_100000184703_100000747449 [0,1,0,0,0,0|3,0,0]=4 1950 B15R1.4039 COC(=O)CSc1ccc(c(c1)CO)O 62a_100000747449_100000184703 [0,1,0,0,0,0|3,0,0]=4 1951 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Br 62a_100000747449_100012353699 [0,1,0,0,0,0|2,0,0]=3 1952 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000747449 [0,1,0,0,0,0|2,0,0]=3 1953 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)C 62a_100000747449_100011830276 [0,1,0,0,0,0|2,0,0]=3 1954 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000747449 [0,1,0,0,0,0|2,0,0]=3 1955 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000747449_100011356853 [0,1,0,0,0,0|2,0,0]=3 1956 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000747449 [0,1,0,0,0,0|2,0,0]=3 1957 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)F 62a_100000747449_100011934186 [0,1,0,0,0,0|2,0,0]=3 1958 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000747449 [0,1,0,0,0,0|2,0,0]=3 1959 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)N 62a_100000747449_100015196925 [0,1,0,0,0,0|2,0,0]=3 1960 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000747449 [0,1,0,0,0,0|2,0,0]=3 1961 B15R1.4039 COC(=O)CSc1ccc(c(c1)OC)O 62a_100000747449_100000694246 [0,1,0,0,0,0|1,0,0]=2 1962 B15R1.4039 COC(=O)CSc1ccc(c(c1)SC)F 62a_100000747449_100010341305 [0,1,0,0,0,0|2,1,0]=4 1963 B15R1.4039 COC(=O)CSc1ccc(c(c1)SC)F 62a_100010341305_100000747449 [0,1,0,0,0,0|2,1,0]=4 1964 B15R1.4039 COC(=O)CSc1ccc(c(n1)OC)N 62a_100000687816_100000747449 [0,1,0,0,0,0|3,0,0]=4 1965 B15R1.4039 COC(=O)CSc1ccc(c(n1)OC)N 62a_100000747449_100000687816 [0,1,0,0,0,0|3,0,0]=4 1966 B15R1.4039 COC(=O)CSc1ccc(c(n1)OC)O 62a_100000747449_100010893133 [0,1,0,0,0,0|2,0,0]=3 1967 B15R1.4039 COC(=O)CSc1cnc(c(c1)OC)C 62a_100000747449_100010254219 [0,1,0,0,0,0|3,0,0]=4 1968 B15R1.4039 COC(=O)CSc1cnc(c(c1)OC)C 62a_100010254219_100000747449 [0,1,0,0,0,0|3,0,0]=4 1969 B15R1.4039 COC(=O)CSc1cnc(c(c1)OC)F 62a_100000747449_100010214931 [0,1,0,0,0,0|3,0,0]=4 1970 B15R1.4039 COC(=O)CSc1cnc(c(c1)OC)F 62a_100010214931_100000747449 [0,1,0,0,0,0|3,0,0]=4 1971 B15R1.4039 COC(=O)CSc1cnc(c(c1)OC)N 62a_100000747449_106354213024 [0,1,0,0,0,0|3,0,0]=4 1972 B15R1.4039 COC(=O)CSc1cnc(c(c1)OC)N 62a_106354213024_100000747449 [0,1,0,0,0,0|3,0,0]=4 1973 B15R1.4039 COC(=O)CSc1cnc(c(n1)OC)O 62a_100000747449_200010365344 [0,1,0,0,0,0|3,0,0]=4 1974 B15R1.4039 COC(=O)CSc1cnc(c(n1)OC)O 62a_200010365344_100000747449 [0,1,0,0,0,0|3,0,0]=4 1975 B15R1.4039 COc1cc(ccc1Br)C=CC(=O)CF 1458a_100016267305_100015361967 [0,1,0,0,0,0|1,0,2]=4 1976 B15R1.4039 COc1cc(ccc1C)C=CC(=O)CBr 6a_100000719150_100009888967 [0,1,0,0,0,0|1,0,2]=4 1977 B15R1.4039 COc1cc(ccc1C)C=CC(=O)CCl 6a_100000719150_100000086384 [0,1,0,0,0,0|1,0,2]=4 1978 B15R1.4039 COc1cc(ccc1C)C=CC(=O)CF 6a_100000719150_100000764096 [0,1,0,0,0,0|1,0,2]=4 1979 B15R1.4039 COc1cc(ccc1C)CCC(=O)CF 1458a_200000066385_100015361967 [0,1,0,0,0,0|1,0,0]=2 1980 B15R1.4039 COc1cc(ccc1Cl)C=CC(=O)CBr 6a_100011998524_100009888967 [0,1,0,0,0,0|1,0,2]=4 1981 B15R1.4039 COc1cc(ccc1Cl)C=CC(=O)CCl 6a_100011998524_100000086384 [0,1,0,0,0,0|1,0,2]=4 1982 B15R1.4039 COc1cc(ccc1Cl)C=CC(=O)CF 6a_100011998524_100000764096 [0,1,0,0,0,0|1,0,2]=4 1983 B15R1.4039 COc1cc(ccc1Cl)CNC(=O)CO 240690a_100015204853_100000210174 [0,1,0,0,0,0|2,0,0]=3 1984 B15R1.4039 COc1cc(ccc1Cl)CNC(=O)CO 527a_100015204853_100000210174 [0,1,0,0,0,0|2,0,0]=3 1985 B15R1.4039 COc1cc(ccc1F)C=CC(=O)CBr 6a_100000692873_100009888967 [0,1,0,0,0,0|1,0,2]=4 1986 B15R1.4039 COc1cc(ccc1F)C=CC(=O)CCl 6a_100000692873_100000086384 [0,1,0,0,0,0|1,0,2]=4 1987 B15R1.4039 COc1cc(ccc1F)C=CC(=O)CF 6a_100000692873_100000764096 [0,1,0,0,0,0|1,0,2]=4 1988 B15R1.4039 COc1cc(ccc1F)CCC(=O)CF 1458a_100009849056_100015361967 [0,1,0,0,0,0|1,0,0]=2 1989 B15R1.4039 COc1cc(ccc1F)CNC(=O)CO 240690a_100020626639_100000210174 [0,1,0,0,0,0|2,0,0]=3 1990 B15R1.4039 COc1cc(ccc1F)CNC(=O)CO 527a_100020626639_100000210174 [0,1,0,0,0,0|2,0,0]=3 1991 B15R1.4039 COc1cc(ccc1F)NNC(=O)CO 22a_102515433066_100000210174 [0,1,0,0,0,0|3,0,0]=4 1992 B15R1.4039 COc1cc(ccc1O)C=CC(=O)CF 1458a_100000182119_100015361967 [0,1,0,0,0,0|0,0,2]=3 1993 B15R1.4039 COc1cc(ccc1O)CCC(=O)CF 1458a_100011216321_100015361967 [0,1,0,0,0,0|0,0,0]=1 1994 B15R1.4039 COc1cc(ccc1O)CCC(=O)CO 1458a_100000210174_100010741665 [0,1,0,0,0,0|0,0,0]=1 1995 B15R1.4039 COc1cc(ccc1O)CNC(=O)CO 240690a_100000185554_100000210174 [0,1,0,0,0,0|1,0,0]=2 1996 B15R1.4039 COc1cc(ccc1O)CNC(=O)CO 527a_100000185554_100000210174 [0,1,0,0,0,0|1,0,0]=2 1997 B15R1.4039 COc1cc(ccc1O)CNC(C)CO 34a_100000185554_100012180447 [0,1,0,0,0,0|1,0,2]=4 1998 B15R1.4039 COc1cc(ccc1O)NCC(O)CO 34a_100000726020_100011219619 [0,1,0,0,0,0|1,0,2]=4 1999 B15R1.4039 COc1cc(ccc1O)NC[C@@H](C)CO 34a_100000726020_100000059175 [0,1,0,0,0,0|1,0,2]=4 2000 B15R1.4039 COc1cc(ccc1O)NC[C@@H](O)CF 34a_100000726020_100015614560 [0,1,0,0,0,0|1,0,2]=4 2001 B15R1.4039 COc1cc(ccc1O)NC[C@@H](O)CO 34a_100000726020_100009815848 [0,1,0,0,0,0|1,0,2]=4 2002 B15R1.4039 COc1cc(ccc1O)SCC(O)CO 62a_100011219619_100000694246 [0,1,0,0,0,0|1,0,2]=4 2003 B15R1.4039 COc1cc(ccc1O)SC[C@@H](C)CO 62a_100000059175_100000694246 [0,1,0,0,0,0|1,0,2]=4 2004 B15R1.4039 COc1cc(ccc1O)SC[C@@H](O)CF 62a_100015614560_100000694246 [0,1,0,0,0,0|1,0,2]=4 2005 B15R1.4039 COc1cc(ccc1O)SC[C@@H](O)CO 62a_100009815848_100000694246 [0,1,0,0,0,0|1,0,2]=4 2006 B15R1.4039 COc1nc(ccc1Cl)CNC(=O)CO 240690a_200015507175_100000210174 [0,1,0,0,0,0|3,0,0]=4 2007 B15R1.4039 COc1nc(ccc1Cl)CNC(=O)CO 527a_200015507175_100000210174 [0,1,0,0,0,0|3,0,0]=4 2008 B15R1.5194 C=C(C)CNc1ccc(c(c1F)OC)F 34a_100137314619_100000748629 [0,1,0,0,0,0|3,0,0]=4 2009 B15R1.5194 C=C(C)COc1ccc(c(c1F)OC)F 34a_100000062073_100000748629 [0,1,0,0,0,0|3,0,0]=4 2010 B15R1.5194 C=C(C)COc1ccc(c(c1F)OC)F 7a_100000062073_100000748629 [0,1,0,0,0,0|3,0,0]=4 2011 B15R1.5194 C=C(C)CSc1ccc(c(c1F)OC)Cl 62a_100000748629_200135222481 [0,1,0,0,0,0|3,0,0]=4 2012 B15R1.5194 C=C(C)CSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000211660 [0,1,0,0,0,0|3,0,0]=4 2013 B15R1.5194 C=C(C)CSc1ccc(c(c1F)OC)N 62a_100000748629_100010734149 [0,1,0,0,0,0|3,0,0]=4 2014 B15R1.5194 C=C(C)CSc1ccc(c(c1F)OC)N 62a_100010734149_100000211660 [0,1,0,0,0,0|3,0,0]=4 2015 B15R1.5194 COc1c(ccc(c1F)C=CC(=O)C)Cl 1458a_100020621803_200000210301 [0,1,0,0,0,0|1,0,2]=4 2016 B15R1.5194 COc1c(ccc(c1F)C=CC(=O)[13CH3])Cl 1458a_100020621803_200025704644 [0,1,0,0,0,0|1,0,2]=4 2017 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 11a_200009889119_100015343762 [0,1,0,0,0,0|2,0,0]=3 2018 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 1626a_200009889119_100015343762 [0,1,0,0,0,0|2,0,0]=3 2019 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 240690a_200009889119_100015343762 [0,1,0,0,0,0|2,0,0]=3 2020 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)Cl 527a_200009889119_100103153847 [0,1,0,0,0,0|2,0,0]=3 2021 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 11a_115082355467_100015343762 [0,1,0,0,0,0|2,0,0]=3 2022 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 1626a_115082355467_100015343762 [0,1,0,0,0,0|2,0,0]=3 2023 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 240690a_115082355467_100015343762 [0,1,0,0,0,0|2,0,0]=3 2024 B15R1.5194 COc1c(ccc(c1F)CNC(=O)C)F 527a_115082355467_100103153847 [0,1,0,0,0,0|2,0,0]=3 2025 B15R1.5194 COc1c(ccc(c1F)NCC(=O)N)F 34a_100137314619_100000187820 [0,1,0,0,0,0|3,0,0]=4 2026 B15R1.5194 COc1c(ccc(c1F)NCC(=O)[O-])F 34a_100137314619_100020667443 [0,1,0,0,0,0|3,0,0]=4 2027 B15R1.5194 COc1c(ccc(c1F)OCC(=O)N)F 34a_100000062073_100000187820 [0,1,0,0,0,0|3,0,0]=4 2028 B15R1.5194 COc1c(ccc(c1F)OCC(=O)N)F 7a_100000062073_100000187820 [0,1,0,0,0,0|3,0,0]=4 2029 B15R1.5194 COc1c(ccc(c1F)OCC(=O)[O-])F 34a_100000062073_100020667443 [0,1,0,0,0,0|3,0,0]=4 2030 B15R1.5194 COc1c(ccc(c1F)SCC(=O)N)Cl 62a_100000747473_200135222481 [0,1,0,0,0,0|3,0,0]=4 2031 B15R1.5194 COc1c(ccc(c1F)SCC(=O)N)Cl 62a_200135222481_100000747473 [0,1,0,0,0,0|3,0,0]=4 2032 B15R1.5194 COc1c(ccc(c1F)SCC(=O)N)N 62a_100000747473_100010734149 [0,1,0,0,0,0|3,0,0]=4 2033 B15R1.5194 COc1c(ccc(c1F)SCC(=O)N)N 62a_100010734149_100000747473 [0,1,0,0,0,0|3,0,0]=4 2034 B15R1.5194 COc1c(ccc(c1F)SCC(=O)[O-])Cl 62a_100020667443_200135222481 [0,1,0,0,0,0|3,0,0]=4 2035 B15R1.5194 COc1c(ccc(c1F)SCC(=O)[O-])Cl 62a_200135222481_100020667443 [0,1,0,0,0,0|3,0,0]=4 2036 B15R1.5194 COc1c(ccc(c1F)SCC(=O)[O-])N 62a_100010734149_100020667443 [0,1,0,0,0,0|3,0,0]=4 2037 B15R1.5194 COc1c(ccc(c1F)SCC(=O)[O-])N 62a_100020667443_100010734149 [0,1,0,0,0,0|3,0,0]=4 2038 B15R1.5194 COc1c(cnc(c1C)CNC(=O)C)C 11a_200015187236_100015343762 [0,1,0,0,0,0|3,0,0]=4 2039 B15R1.5194 COc1c(cnc(c1C)CNC(=O)C)C 1626a_200015187236_100015343762 [0,1,0,0,0,0|3,0,0]=4 2040 B15R1.5194 COc1c(cnc(c1C)CNC(=O)C)C 240690a_200015187236_100015343762 [0,1,0,0,0,0|3,0,0]=4 2041 B15R1.5194 COc1c(cnc(c1C)CNC(=O)C)C 527a_200015187236_100103153847 [0,1,0,0,0,0|3,0,0]=4 2042 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)C#N 34a_100011999456_100000748629 [0,1,0,0,0,0|3,0,0]=4 2043 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000748629 [0,1,0,0,0,0|2,0,0]=3 2044 B15R1.12854 C=C(C)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000748629 [0,1,0,0,0,0|2,0,0]=3 2045 B15R1.12854 C=C(C)COc1ccc(c(c1)OC)CO 34a_200000116926_100000748629 [0,1,0,0,0,0|2,0,0]=3 2046 B15R1.12854 C=C(C)COc1ccc(c(c1)OC)OC 34a_100000039706_100000748629 [0,1,0,0,0,0|2,0,0]=3 2047 B15R1.12854 C=C(C)CSc1cc(c(cn1)CO)OC 62a_100000748629_100010714672 [0,1,0,0,0,0|3,0,0]=4 2048 B15R1.12854 C=C(C)CSc1cc(c(cn1)CO)OC 62a_100010714672_100000211660 [0,1,0,0,0,0|3,0,0]=4 2049 B15R1.12854 C=C(C)CSc1ccc(c(c1)CC)OC 62a_100000748629_200010179862 [0,1,0,0,0,0|3,0,0]=4 2050 B15R1.12854 C=C(C)CSc1ccc(c(c1)CC)OC 62a_200010179862_100000211660 [0,1,0,0,0,0|3,0,0]=4 2051 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)C#N 62a_100000748629_100000694671 [0,1,0,0,0,0|3,0,0]=4 2052 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)C=O 62a_100000697075_100000211660 [0,1,0,0,0,0|2,0,1]=4 2053 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)C=O 62a_100000748629_100010290300 [0,1,0,0,0,0|2,0,1]=4 2054 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CC 62a_100000748629_200010710398 [0,1,0,0,0,0|3,0,0]=4 2055 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CC 62a_200010710398_100000211660 [0,1,0,0,0,0|3,0,0]=4 2056 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CO 62a_100000748629_100011277633 [0,1,0,0,0,0|2,0,0]=3 2057 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000211660 [0,1,0,0,0,0|2,0,0]=3 2058 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)OC 62a_100000748629_100011356967 [0,1,0,0,0,0|2,0,0]=3 2059 B15R1.12854 C=C(C)CSc1ccc(c(c1)OC)SC 62a_200011001119_100000211660 [0,1,0,0,0,0|2,1,0]=4 2060 B15R1.12854 C=C(C)CSc1ccc(c(c1)SC)OC 62a_200009892704_100000211660 [0,1,0,0,0,0|2,1,0]=4 2061 B15R1.12854 C=C(C)CSc1ccc(c(n1)OC)CO 62a_100000748629_100010988397 [0,1,0,0,0,0|3,0,0]=4 2062 B15R1.12854 C=C(C)CSc1ccc(c(n1)OC)CO 62a_100010988397_100000211660 [0,1,0,0,0,0|3,0,0]=4 2063 B15R1.12854 C=C(C)CSc1ccc(c(n1)OC)OC 62a_100000748629_100010214848 [0,1,0,0,0,0|3,0,0]=4 2064 B15R1.12854 C=C(C)CSc1cnc(c(c1)OC)CO 62a_100000748629_200010246159 [0,1,0,0,0,0|3,0,0]=4 2065 B15R1.12854 C=C(C)CSc1cnc(c(c1)OC)CO 62a_200010246159_100000211660 [0,1,0,0,0,0|3,0,0]=4 2066 B15R1.12854 C=C(C)CSc1cnc(c(c1)OC)OC 62a_100000748629_100010234541 [0,1,0,0,0,0|3,0,0]=4 2067 B15R1.12854 C=C(F)CNc1ccc(c(c1)OC)CO 34a_100012183141_100009893438 [0,1,0,0,0,0|2,0,1]=4 2068 B15R1.12854 C=C(F)CNc1ccc(c(c1)OC)OC 34a_100000187404_100009893438 [0,1,0,0,0,0|2,0,1]=4 2069 B15R1.12854 C=C(F)COc1ccc(c(c1)OC)CO 34a_200000116926_100009893438 [0,1,0,0,0,0|2,0,1]=4 2070 B15R1.12854 C=C(F)COc1ccc(c(c1)OC)OC 34a_100000039706_100009893438 [0,1,0,0,0,0|2,0,1]=4 2071 B15R1.12854 C=C(F)CSc1ccc(c(c1)OC)CO 62a_100000042424_100011277633 [0,1,0,0,0,0|2,0,1]=4 2072 B15R1.12854 C=C(F)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000042424 [0,1,0,0,0,0|2,0,1]=4 2073 B15R1.12854 C=C(F)CSc1ccc(c(c1)OC)OC 62a_100000042424_100011356967 [0,1,0,0,0,0|2,0,1]=4 2074 B15R1.12854 CCc1cc(ccc1OC)SCC(=O)N 62a_100000747473_200010179862 [0,1,0,0,0,0|3,0,0]=4 2075 B15R1.12854 CCc1cc(ccc1OC)SCC(=O)N 62a_200010179862_100000747473 [0,1,0,0,0,0|3,0,0]=4 2076 B15R1.12854 CCc1cc(ccc1OC)SCC(=O)[O-] 62a_100020667443_200010179862 [0,1,0,0,0,0|3,0,0]=4 2077 B15R1.12854 CCc1cc(ccc1OC)SCC(=O)[O-] 62a_200010179862_100020667443 [0,1,0,0,0,0|3,0,0]=4 2078 B15R1.12854 CCc1ccc(cc1OC)SCC(=O)N 62a_100000747473_200010710398 [0,1,0,0,0,0|3,0,0]=4 2079 B15R1.12854 CCc1ccc(cc1OC)SCC(=O)N 62a_200010710398_100000747473 [0,1,0,0,0,0|3,0,0]=4 2080 B15R1.12854 CCc1ccc(cc1OC)SCC(=O)[O-] 62a_100020667443_200010710398 [0,1,0,0,0,0|3,0,0]=4 2081 B15R1.12854 CCc1ccc(cc1OC)SCC(=O)[O-] 62a_200010710398_100020667443 [0,1,0,0,0,0|3,0,0]=4 2082 B15R1.12854 COc1cc(ccc1C#N)NCC(=O)N 34a_100011999456_100000187820 [0,1,0,0,0,0|3,0,0]=4 2083 B15R1.12854 COc1cc(ccc1C#N)NCC(=O)[O-] 34a_100011999456_100020667443 [0,1,0,0,0,0|3,0,0]=4 2084 B15R1.12854 COc1cc(ccc1C#N)SCC(=O)N 62a_100000747473_100000694671 [0,1,0,0,0,0|3,0,0]=4 2085 B15R1.12854 COc1cc(ccc1C#N)SCC(=O)[O-] 62a_100020667443_100000694671 [0,1,0,0,0,0|3,0,0]=4 2086 B15R1.12854 COc1cc(ccc1C=O)SCC(=O)N 62a_100000697075_100000747473 [0,1,0,0,0,0|2,0,1]=4 2087 B15R1.12854 COc1cc(ccc1C=O)SCC(=O)N 62a_100000747473_100010290300 [0,1,0,0,0,0|2,0,1]=4 2088 B15R1.12854 COc1cc(ccc1C=O)SCC(=O)[O-] 62a_100000697075_100020667443 [0,1,0,0,0,0|2,0,1]=4 2089 B15R1.12854 COc1cc(ccc1C=O)SCC(=O)[O-] 62a_100020667443_100010290300 [0,1,0,0,0,0|2,0,1]=4 2090 B15R1.12854 COc1cc(ccc1CO)NCC(=O)N 34a_100012183141_100000187820 [0,1,0,0,0,0|2,0,0]=3 2091 B15R1.12854 COc1cc(ccc1CO)NCC(=O)[O-] 34a_100012183141_100020667443 [0,1,0,0,0,0|2,0,0]=3 2092 B15R1.12854 COc1cc(ccc1CO)NCC(C)C 34a_100012183141_100000210624 [0,1,0,0,0,0|2,0,1]=4 2093 B15R1.12854 COc1cc(ccc1CO)NCC(C)O 34a_100012183141_100011218427 [0,1,0,0,0,0|1,0,2]=4 2094 B15R1.12854 COc1cc(ccc1CO)NC[C@@H](C)O 34a_100012183141_100009817552 [0,1,0,0,0,0|1,0,2]=4 2095 B15R1.12854 COc1cc(ccc1CO)NC[N+](=O)[O-] 34a_100012183141_100000761209 [0,1,0,0,0,0|3,0,0]=4 2096 B15R1.12854 COc1cc(ccc1CO)OCC(=O)C 1458a_200000048963_200000210301 [0,1,0,0,0,0|1,0,0]=2 2097 B15R1.12854 COc1cc(ccc1CO)OCC(=O)N 34a_200000116926_100000187820 [0,1,0,0,0,0|2,0,0]=3 2098 B15R1.12854 COc1cc(ccc1CO)OCC(=O)[13CH3] 1458a_200000048963_200025704644 [0,1,0,0,0,0|1,0,0]=2 2099 B15R1.12854 COc1cc(ccc1CO)OCC(=O)[O-] 34a_200000116926_100020667443 [0,1,0,0,0,0|2,0,0]=3 2100 B15R1.12854 COc1cc(ccc1CO)OCC(C)C 34a_200000116926_100000210624 [0,1,0,0,0,0|2,0,1]=4 2101 B15R1.12854 COc1cc(ccc1CO)OCC(C)O 34a_200000116926_100011218427 [0,1,0,0,0,0|1,0,2]=4 2102 B15R1.12854 COc1cc(ccc1CO)OC[C@@H](C)O 34a_200000116926_100009817552 [0,1,0,0,0,0|1,0,2]=4 2103 B15R1.12854 COc1cc(ccc1CO)OC[N+](=O)[O-] 34a_200000116926_100000761209 [0,1,0,0,0,0|3,0,0]=4 2104 B15R1.12854 COc1cc(ccc1CO)SCC(=O)N 62a_100000747473_100011277633 [0,1,0,0,0,0|2,0,0]=3 2105 B15R1.12854 COc1cc(ccc1CO)SCC(=O)N 62a_100011277633_100000747473 [0,1,0,0,0,0|2,0,0]=3 2106 B15R1.12854 COc1cc(ccc1CO)SCC(=O)[O-] 62a_100011277633_100020667443 [0,1,0,0,0,0|2,0,0]=3 2107 B15R1.12854 COc1cc(ccc1CO)SCC(=O)[O-] 62a_100020667443_100011277633 [0,1,0,0,0,0|2,0,0]=3 2108 B15R1.12854 COc1cc(ccc1CO)SCC(C)C 62a_100000210624_100011277633 [0,1,0,0,0,0|2,0,1]=4 2109 B15R1.12854 COc1cc(ccc1CO)SCC(C)C 62a_100011277633_100000210760 [0,1,0,0,0,0|2,0,1]=4 2110 B15R1.12854 COc1cc(ccc1CO)SCC(C)O 62a_100011218427_100011277633 [0,1,0,0,0,0|1,0,2]=4 2111 B15R1.12854 COc1cc(ccc1CO)SCC(C)O 62a_100011277633_100011218427 [0,1,0,0,0,0|1,0,2]=4 2112 B15R1.12854 COc1cc(ccc1CO)SC[C@@H](C)O 62a_100009817552_100011277633 [0,1,0,0,0,0|1,0,2]=4 2113 B15R1.12854 COc1cc(ccc1CO)SC[C@@H](C)O 62a_100011277633_100009817552 [0,1,0,0,0,0|1,0,2]=4 2114 B15R1.12854 COc1cc(ccc1CO)SC[N+](=O)[O-] 62a_100011277633_100000761209 [0,1,0,0,0,0|3,0,0]=4 2115 B15R1.12854 COc1cc(ccc1O[13CH3])/C=C/C(=O)C 34a_100102526088_200025704644 [0,1,0,0,0,0|0,0,2]=3 2116 B15R1.12854 COc1cc(ccc1O[13CH3])CCC(=O)C 34a_100011290831_200025704644 [0,1,0,0,0,0|0,0,0]=1 2117 B15R1.12854 COc1cc(ccc1O[13CH3])CCC(=O)C 7a_100011290831_200025704644 [0,1,0,0,0,0|0,0,0]=1 2118 B15R1.12854 COc1cc(ccc1O[13CH3])CC[N+](=O)[O-] 34a_100000080128_200025704644 [0,1,0,0,0,0|2,0,0]=3 2119 B15R1.12854 COc1cc(ccc1O[13CH3])CC[N+](=O)[O-] 7a_100000080128_200025704644 [0,1,0,0,0,0|2,0,0]=3 2120 B15R1.12854 COc1cc(ccc1O[13CH3])CNC(=O)C 34a_100000046322_200025704644 [0,1,0,0,0,0|1,0,0]=2 2121 B15R1.12854 COc1cc(ccc1O[13CH3])CNC(=O)C 7a_100000046322_200025704644 [0,1,0,0,0,0|1,0,0]=2 2122 B15R1.12854 COc1cc(ccc1SC)SCC(=O)N 62a_200011001119_100000747473 [0,1,0,0,0,0|2,1,0]=4 2123 B15R1.12854 COc1cc(ccc1SC)SCC(=O)[O-] 62a_200011001119_100020667443 [0,1,0,0,0,0|2,1,0]=4 2124 B15R1.12854 COc1cc(cnc1CO)SCC(=O)N 62a_100000747473_200010246159 [0,1,0,0,0,0|3,0,0]=4 2125 B15R1.12854 COc1cc(cnc1CO)SCC(=O)N 62a_200010246159_100000747473 [0,1,0,0,0,0|3,0,0]=4 2126 B15R1.12854 COc1cc(cnc1CO)SCC(=O)[O-] 62a_100020667443_200010246159 [0,1,0,0,0,0|3,0,0]=4 2127 B15R1.12854 COc1cc(cnc1CO)SCC(=O)[O-] 62a_200010246159_100020667443 [0,1,0,0,0,0|3,0,0]=4 2128 B15R1.12854 COc1cc(cnc1OC)SCC(=O)N 62a_100000747473_100010234541 [0,1,0,0,0,0|3,0,0]=4 2129 B15R1.12854 COc1cc(cnc1OC)SCC(=O)[O-] 62a_100020667443_100010234541 [0,1,0,0,0,0|3,0,0]=4 2130 B15R1.12854 COc1cc(ncc1CO)SCC(=O)N 62a_100000747473_100010714672 [0,1,0,0,0,0|3,0,0]=4 2131 B15R1.12854 COc1cc(ncc1CO)SCC(=O)N 62a_100010714672_100000747473 [0,1,0,0,0,0|3,0,0]=4 2132 B15R1.12854 COc1cc(ncc1CO)SCC(=O)[O-] 62a_100010714672_100020667443 [0,1,0,0,0,0|3,0,0]=4 2133 B15R1.12854 COc1cc(ncc1CO)SCC(=O)[O-] 62a_100020667443_100010714672 [0,1,0,0,0,0|3,0,0]=4 2134 B15R1.12854 COc1ccc(cc1OC)/C=C/C(=O)C 34a_100102526088_200000210301 [0,1,0,0,0,0|0,0,2]=3 2135 B15R1.12854 COc1ccc(cc1OC)C=CC(=O)C 1458a_100015194992_200000210301 [0,1,0,0,0,0|0,0,2]=3 2136 B15R1.12854 COc1ccc(cc1OC)C=CC(=O)[13CH3] 1458a_100015194992_200025704644 [0,1,0,0,0,0|0,0,2]=3 2137 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 1458a_100000070787_100011740610 [0,1,0,0,0,0|0,0,0]=1 2138 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 1458a_100000187252_200000210301 [0,1,0,0,0,0|0,0,0]=1 2139 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 34a_100011290831_200000210301 [0,1,0,0,0,0|0,0,0]=1 2140 B15R1.12854 COc1ccc(cc1OC)CCC(=O)C 7a_100011290831_200000210301 [0,1,0,0,0,0|0,0,0]=1 2141 B15R1.12854 COc1ccc(cc1OC)CCC(=O)[13CH3] 1458a_100000187252_200025704644 [0,1,0,0,0,0|0,0,0]=1 2142 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 2230a_100000211294_200000210301 [0,1,0,0,0,0|2,0,0]=3 2143 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 2230a_100102631434_100011273988 [0,1,0,0,0,0|2,0,0]=3 2144 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 269982a_100000211294_200000210301 [0,1,0,0,0,0|2,0,0]=3 2145 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 269982a_100102631434_100011273988 [0,1,0,0,0,0|2,0,0]=3 2146 B15R1.12854 COc1ccc(cc1OC)CCN(C)C 270004a_100102631434_100011754369 [0,1,0,0,0,0|2,0,0]=3 2147 B15R1.12854 COc1ccc(cc1OC)CCN(C)[13CH3] 2230a_100000211294_200025704644 [0,1,0,0,0,0|2,0,0]=3 2148 B15R1.12854 COc1ccc(cc1OC)CCN(C)[13CH3] 269982a_100000211294_200025704644 [0,1,0,0,0,0|2,0,0]=3 2149 B15R1.12854 COc1ccc(cc1OC)CC[N+](=O)[O-] 34a_100000080128_200000210301 [0,1,0,0,0,0|2,0,0]=3 2150 B15R1.12854 COc1ccc(cc1OC)CC[N+](=O)[O-] 34a_200000077489_200000210301 [0,1,0,0,0,0|2,0,0]=3 2151 B15R1.12854 COc1ccc(cc1OC)CC[N+](=O)[O-] 7a_100000080128_200000210301 [0,1,0,0,0,0|2,0,0]=3 2152 B15R1.12854 COc1ccc(cc1OC)CC[N+](=O)[O-] 7a_200000077489_200000210301 [0,1,0,0,0,0|2,0,0]=3 2153 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 11a_100000185555_100015343762 [0,1,0,0,0,0|1,0,0]=2 2154 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 1626a_100000185555_100015343762 [0,1,0,0,0,0|1,0,0]=2 2155 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 240690a_100000185555_100015343762 [0,1,0,0,0,0|1,0,0]=2 2156 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 34a_100000046322_200000210301 [0,1,0,0,0,0|1,0,0]=2 2157 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 527a_100000185555_100103153847 [0,1,0,0,0,0|1,0,0]=2 2158 B15R1.12854 COc1ccc(cc1OC)CNC(=O)C 7a_100000046322_200000210301 [0,1,0,0,0,0|1,0,0]=2 2159 B15R1.12854 COc1ccc(cc1OC)CNC(C)C 207a_100138425928_100000170513 [0,1,0,0,0,0|2,0,1]=4 2160 B15R1.12854 COc1ccc(cc1OC)CNC(C)C 2230a_100138425928_100011233839 [0,1,0,0,0,0|2,0,1]=4 2161 B15R1.12854 COc1ccc(cc1OC)CNC(C)C 34a_100000185555_100000210206 [0,1,0,0,0,0|2,0,1]=4 2162 B15R1.12854 COc1ccc(cc1OC)COC(C)C 34a_100000210929_100000210206 [0,1,0,0,0,0|2,0,1]=4 2163 B15R1.12854 COc1ccc(cc1OC)CSC(C)C 62a_100000210206_100011233839 [0,1,0,0,0,0|2,0,1]=4 2164 B15R1.12854 COc1ccc(cc1OC)NCC(=O)N 34a_100000187404_100000187820 [0,1,0,0,0,0|2,0,0]=3 2165 B15R1.12854 COc1ccc(cc1OC)NCC(=O)[O-] 34a_100000187404_100020667443 [0,1,0,0,0,0|2,0,0]=3 2166 B15R1.12854 COc1ccc(cc1OC)NCC(C)C 34a_100000187404_100000210624 [0,1,0,0,0,0|2,0,1]=4 2167 B15R1.12854 COc1ccc(cc1OC)NCC(C)O 34a_100000187404_100011218427 [0,1,0,0,0,0|1,0,2]=4 2168 B15R1.12854 COc1ccc(cc1OC)NC[C@@H](C)O 34a_100000187404_100009817552 [0,1,0,0,0,0|1,0,2]=4 2169 B15R1.12854 COc1ccc(cc1OC)NC[N+](=O)[O-] 34a_100000187404_100000761209 [0,1,0,0,0,0|3,0,0]=4 2170 B15R1.12854 COc1ccc(cc1OC)OCC(=O)N 34a_100000039706_100000187820 [0,1,0,0,0,0|2,0,0]=3 2171 B15R1.12854 COc1ccc(cc1OC)OCC(=O)[O-] 34a_100000039706_100020667443 [0,1,0,0,0,0|2,0,0]=3 2172 B15R1.12854 COc1ccc(cc1OC)OCC(C)C 34a_100000039706_100000210624 [0,1,0,0,0,0|2,0,1]=4 2173 B15R1.12854 COc1ccc(cc1OC)OCC(C)O 34a_100000039706_100011218427 [0,1,0,0,0,0|1,0,2]=4 2174 B15R1.12854 COc1ccc(cc1OC)OC[C@@H](C)O 34a_100000039706_100009817552 [0,1,0,0,0,0|1,0,2]=4 2175 B15R1.12854 COc1ccc(cc1OC)OC[N+](=O)[O-] 34a_100000039706_100000761209 [0,1,0,0,0,0|3,0,0]=4 2176 B15R1.12854 COc1ccc(cc1OC)SCC(=O)N 62a_100000747473_100011356967 [0,1,0,0,0,0|2,0,0]=3 2177 B15R1.12854 COc1ccc(cc1OC)SCC(=O)[O-] 62a_100020667443_100011356967 [0,1,0,0,0,0|2,0,0]=3 2178 B15R1.12854 COc1ccc(cc1OC)SCC(C)C 62a_100000210624_100011356967 [0,1,0,0,0,0|2,0,1]=4 2179 B15R1.12854 COc1ccc(cc1OC)SCC(C)O 62a_100011218427_100011356967 [0,1,0,0,0,0|1,0,2]=4 2180 B15R1.12854 COc1ccc(cc1OC)SC[C@@H](C)O 62a_100009817552_100011356967 [0,1,0,0,0,0|1,0,2]=4 2181 B15R1.12854 COc1ccc(cc1O[13CH3])CC[N+](=O)[O-] 34a_200000077489_200025704644 [0,1,0,0,0,0|2,0,0]=3 2182 B15R1.12854 COc1ccc(cc1O[13CH3])CC[N+](=O)[O-] 7a_200000077489_200025704644 [0,1,0,0,0,0|2,0,0]=3 2183 B15R1.12854 COc1ccc(cc1SC)/C=C/C(=O)C 62a_200000210301_200016254069 [0,1,0,0,0,0|0,1,2]=4 2184 B15R1.12854 COc1ccc(cc1SC)/C=C/C(=O)C 62a_200016254069_200000210301 [0,1,0,0,0,0|0,1,2]=4 2185 B15R1.12854 COc1ccc(cc1SC)SCC(=O)N 62a_200009892704_100000747473 [0,1,0,0,0,0|2,1,0]=4 2186 B15R1.12854 COc1ccc(cc1SC)SCC(=O)[O-] 62a_200009892704_100020667443 [0,1,0,0,0,0|2,1,0]=4 2187 B15R1.12854 COc1ccc(cc1S[13CH3])/C=C/C(=O)C 62a_200016254069_200025704644 [0,1,0,0,0,0|0,1,2]=4 2188 B15R1.12854 COc1ccc(cc1S[13CH3])/C=C/C(=O)C 62a_200025704644_200016254069 [0,1,0,0,0,0|0,1,2]=4 2189 B15R1.12854 COc1ccc(nc1OC)SCC(=O)N 62a_100000747473_100010214848 [0,1,0,0,0,0|3,0,0]=4 2190 B15R1.12854 COc1ccc(nc1OC)SCC(=O)[O-] 62a_100020667443_100010214848 [0,1,0,0,0,0|3,0,0]=4 2191 B15R1.12854 COc1nc(ccc1CO)SCC(=O)N 62a_100000747473_100010988397 [0,1,0,0,0,0|3,0,0]=4 2192 B15R1.12854 COc1nc(ccc1CO)SCC(=O)N 62a_100010988397_100000747473 [0,1,0,0,0,0|3,0,0]=4 2193 B15R1.12854 COc1nc(ccc1CO)SCC(=O)[O-] 62a_100010988397_100020667443 [0,1,0,0,0,0|3,0,0]=4 2194 B15R1.12854 COc1nc(ccc1CO)SCC(=O)[O-] 62a_100020667443_100010988397 [0,1,0,0,0,0|3,0,0]=4 2195 B15R2.4522 COc1cc(ccc1O)CNC2CC2 34a_100000185554_100000211595 [0,0,0,1,0,0|2,0,1]=4 2196 B15R2.4522 COc1cc(ccc1O)NCC2CC2 34a_100000726020_100000742324 [0,0,0,1,0,0|2,0,1]=4 2197 B15R2.4522 COc1cc(ccc1O)NCC2CO2 34a_100000726020_102125554688 [0,0,0,1,0,0|1,0,2]=4 2198 B15R2.4522 COc1cc(ccc1O)SCC2CC2 62a_100000756562_100000694246 [0,0,0,1,0,0|2,0,1]=4 2199 B15R2.4522 COc1cc(ccc1O)SCC2CO2 62a_102125554688_100000694246 [0,0,0,1,0,0|1,0,2]=4 2200 B15R2.4522 COc1cc(ccc1O)SCC2CS2 62a_100000031435_100000694246 [0,0,0,1,0,0|1,1,1]=4 2201 B15R2.4522 COc1cc(ccc1O)SC[C@@H]2CO2 62a_100000745022_100000694246 [0,0,0,1,0,0|1,0,2]=4 2202 B15R2.7688 C=C(C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000748629 [0,0,0,1,0,0|3,0,0]=4 2203 B15R2.7688 C=C(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100000748629 [0,0,0,1,0,0|3,0,0]=4 2204 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748629 [0,0,0,1,0,0|2,0,0]=3 2205 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748629 [0,0,0,1,0,0|2,0,0]=3 2206 B15R2.7688 C=C(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748629 [0,0,0,1,0,0|2,0,0]=3 2207 B15R2.7688 C=C(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100000211660 [0,0,0,1,0,0|3,0,0]=4 2208 B15R2.7688 C=C(C)CSc1ccc2c(c1)CCO2 62a_100000748629_100000729065 [0,0,0,1,0,0|3,0,0]=4 2209 B15R2.7688 C=C(C)CSc1ccc2c(c1)OCC2 62a_100000748629_100009818566 [0,0,0,1,0,0|3,0,0]=4 2210 B15R2.7688 C=C(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100000211660 [0,0,0,1,0,0|3,0,0]=4 2211 B15R2.7688 C=C(F)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009893438 [0,0,0,1,0,0|2,0,1]=4 2212 B15R2.7688 C=C(F)CNc1ccc2c(c1)OCO2 34a_100000209953_100009893438 [0,0,0,1,0,0|2,0,1]=4 2213 B15R2.7688 C=C(F)COc1ccc2c(c1)OCO2 34a_100000210298_100009893438 [0,0,0,1,0,0|2,0,1]=4 2214 B15R2.7688 CC(=O)C=Cc1ccc2c(c1)CCO2 1458a_100000241297_200000210301 [0,0,0,1,0,0|1,0,2]=4 2215 B15R2.7688 CC(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200000210301 [0,0,0,1,0,0|0,0,2]=3 2216 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000070787_100000763274 [0,0,0,1,0,0|1,0,0]=2 2217 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200000210301 [0,0,0,1,0,0|1,0,0]=2 2218 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200000210301 [0,0,0,1,0,0|0,0,0]=1 2219 B15R2.7688 CC(=O)COc1ccc2c(c1)CCC2 1458a_100000183705_200000210301 [0,0,0,1,0,0|3,0,0]=4 2220 B15R2.7688 CC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200000210301 [0,0,0,1,0,0|1,0,0]=2 2221 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 11a_100011219410_100015343762 [0,0,0,1,0,0|2,0,0]=3 2222 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 1626a_100011219410_100015343762 [0,0,0,1,0,0|2,0,0]=3 2223 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 240690a_100011219410_100015343762 [0,0,0,1,0,0|2,0,0]=3 2224 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 527a_100011219410_100103153847 [0,0,0,1,0,0|2,0,0]=3 2225 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100015343762 [0,0,0,1,0,0|1,0,0]=2 2226 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100015343762 [0,0,0,1,0,0|1,0,0]=2 2227 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100015343762 [0,0,0,1,0,0|1,0,0]=2 2228 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100103153847 [0,0,0,1,0,0|1,0,0]=2 2229 B15R2.7688 CC(=O)NCc1ccc2occc2c1 11a_100020591328_100015343762 [0,0,0,1,0,0|2,0,1]=4 2230 B15R2.7688 CC(=O)NCc1ccc2occc2c1 1626a_100020591328_100015343762 [0,0,0,1,0,0|2,0,1]=4 2231 B15R2.7688 CC(=O)NCc1ccc2occc2c1 240690a_100020591328_100015343762 [0,0,0,1,0,0|2,0,1]=4 2232 B15R2.7688 CC(=O)NCc1ccc2occc2c1 527a_100020591328_100103153847 [0,0,0,1,0,0|2,0,1]=4 2233 B15R2.7688 CC(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000210760 [0,0,0,1,0,0|2,0,1]=4 2234 B15R2.7688 CC(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000210624 [0,0,0,1,0,0|2,0,1]=4 2235 B15R2.7688 CC(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000210624 [0,0,0,1,0,0|2,0,1]=4 2236 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000210206 [0,0,0,1,0,0|2,0,1]=4 2237 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000210206 [0,0,0,1,0,0|2,0,1]=4 2238 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 34a_100138425928_100000189651 [0,0,0,1,0,0|2,0,1]=4 2239 B15R2.7688 CC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000210206 [0,0,0,1,0,0|2,0,1]=4 2240 B15R2.7688 CC(C)OCc1ccc2c(c1)OCO2 34a_100000212225_100000189651 [0,0,0,1,0,0|2,0,1]=4 2241 B15R2.7688 CC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011218427 [0,0,0,1,0,0|1,0,2]=4 2242 B15R2.7688 CC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011218427 [0,0,0,1,0,0|1,0,2]=4 2243 B15R2.7688 CC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011218427 [0,0,0,1,0,0|1,0,2]=4 2244 B15R2.7688 CN(C)CCc1ccc2c(c1)CCO2 2230a_100102631434_100000763274 [0,0,0,1,0,0|3,0,0]=4 2245 B15R2.7688 CN(C)CCc1ccc2c(c1)CCO2 269982a_100102631434_100000763274 [0,0,0,1,0,0|3,0,0]=4 2246 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009817552 [0,0,0,1,0,0|1,0,2]=4 2247 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)OCO2 34a_100000209953_100009817552 [0,0,0,1,0,0|1,0,2]=4 2248 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)OCO2 34a_100000210298_100009817552 [0,0,0,1,0,0|1,0,2]=4 2249 B15R2.7688 NC(=O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000747473 [0,0,0,1,0,0|3,0,0]=4 2250 B15R2.7688 NC(=O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000187820 [0,0,0,1,0,0|3,0,0]=4 2251 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747473 [0,0,0,1,0,0|2,0,0]=3 2252 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000187820 [0,0,0,1,0,0|2,0,0]=3 2253 B15R2.7688 NC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000187820 [0,0,0,1,0,0|2,0,0]=3 2254 B15R2.7688 NC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000747473 [0,0,0,1,0,0|3,0,0]=4 2255 B15R2.7688 NC(=O)CSc1ccc2c(c1)CCO2 62a_100000747473_100000729065 [0,0,0,1,0,0|3,0,0]=4 2256 B15R2.7688 NC(=O)CSc1ccc2c(c1)OCC2 62a_100000747473_100009818566 [0,0,0,1,0,0|3,0,0]=4 2257 B15R2.7688 NC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747473 [0,0,0,1,0,0|3,0,0]=4 2258 B15R2.7688 O=C([O-])CNc1ccc2c(c1)CCO2 34a_100000736984_100020667443 [0,0,0,1,0,0|3,0,0]=4 2259 B15R2.7688 O=C([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100020667443 [0,0,0,1,0,0|2,0,0]=3 2260 B15R2.7688 O=C([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100020667443 [0,0,0,1,0,0|2,0,0]=3 2261 B15R2.7688 O=C([O-])CSc1ccc2c(c1)CCO2 62a_100000729065_100020667443 [0,0,0,1,0,0|3,0,0]=4 2262 B15R2.7688 O=C([O-])CSc1ccc2c(c1)CCO2 62a_100020667443_100000729065 [0,0,0,1,0,0|3,0,0]=4 2263 B15R2.7688 O=C([O-])CSc1ccc2c(c1)OCC2 62a_100009818566_100020667443 [0,0,0,1,0,0|3,0,0]=4 2264 B15R2.7688 O=C([O-])CSc1ccc2c(c1)OCC2 62a_100020667443_100009818566 [0,0,0,1,0,0|3,0,0]=4 2265 B15R2.7688 O=[N+]([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100000761209 [0,0,0,1,0,0|3,0,0]=4 2266 B15R2.7688 O=[N+]([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100000761209 [0,0,0,1,0,0|3,0,0]=4 2267 B15R2.7688 [13CH3]C(=O)C=Cc1ccc2c(c1)CCO2 1458a_100000241297_200025704644 [0,0,0,1,0,0|1,0,2]=4 2268 B15R2.7688 [13CH3]C(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200025704644 [0,0,0,1,0,0|0,0,2]=3 2269 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200025704644 [0,0,0,1,0,0|1,0,0]=2 2270 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200025704644 [0,0,0,1,0,0|0,0,0]=1 2271 B15R2.7688 [13CH3]C(=O)COc1ccc2c(c1)CCC2 1458a_100000183705_200025704644 [0,0,0,1,0,0|3,0,0]=4 2272 B15R2.7688 [13CH3]C(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200025704644 [0,0,0,1,0,0|1,0,0]=2 2273 B13R1.52 C=Cc1cc(ccc1O)CC(=O)C 271570a_100011290941_100010141077 [0,0,0,0,1,0|1,0,1]=3 2274 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)Br 1458a_100000070787_100010128727 [0,0,0,0,1,0|3,0,0]=4 2275 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)Cl 1458a_100000070787_100010147165 [0,0,0,0,1,0|3,0,0]=4 2276 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)F 1458a_100000070787_100000687583 [0,0,0,0,1,0|3,0,0]=4 2277 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)F 1458a_100011218018_200000210301 [0,0,0,0,1,0|3,0,0]=4 2278 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,0,0,0,1,0|0,1,0]=2 2279 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,0,0,0,1,0|0,1,0]=2 2280 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)O 22a_100011249283_100000070787 [0,0,0,0,1,0|3,0,0]=4 2281 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)O 527a_100011249283_100103153847 [0,0,0,0,1,0|3,0,0]=4 2282 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])C 34a_100000739390_200025704644 [0,0,0,0,1,0|3,0,0]=4 2283 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])C 7a_100000739390_200025704644 [0,0,0,0,1,0|3,0,0]=4 2284 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])Cl 34a_100000742996_200025704644 [0,0,0,0,1,0|3,0,0]=4 2285 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])F 34a_106454645589_200025704644 [0,0,0,0,1,0|3,0,0]=4 2286 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 34a_100011935283_200025704644 [0,0,0,0,1,0|2,0,0]=3 2287 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 7a_100011935283_200025704644 [0,0,0,0,1,0|2,0,0]=3 2288 B13R1.52 CC(=O)Nc1ccc(c(c1)S[13CH3])C 62a_200025704644_100011221169 [0,0,0,0,1,0|2,1,0]=4 2289 B13R1.52 CC(=O)Nc1ccc(c(c1)S[13CH3])F 62a_200025704644_100012348134 [0,0,0,0,1,0|2,1,0]=4 2290 B13R1.52 CC(=O)Oc1ccc(c(c1)C=O)O 271570a_203496583355_100009816906 [0,0,0,0,1,0|3,0,0]=4 2291 B13R1.52 CC(=O)Oc1ccc(c(c1)S[13CH3])C 62a_200025704644_200025702335 [0,0,0,0,1,0|2,1,0]=4 2292 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 11a_100010109747_100015343762 [0,0,0,0,1,0|3,0,0]=4 2293 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 1626a_100010109747_100015343762 [0,0,0,0,1,0|3,0,0]=4 2294 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 22a_100010109747_100000070787 [0,0,0,0,1,0|3,0,0]=4 2295 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 527a_100010109747_100103153847 [0,0,0,0,1,0|3,0,0]=4 2296 B13R1.52 CCc1cc(ccc1O)C=C(C)C 271570a_100102525489_100012338938 [0,0,0,0,1,0|2,0,1]=4 2297 B13R1.52 CNc1cc(ccc1C)NC(=O)C 34a_100000739390_200000210301 [0,0,0,0,1,0|3,0,0]=4 2298 B13R1.52 CNc1cc(ccc1C)NC(=O)C 7a_100000739390_200000210301 [0,0,0,0,1,0|3,0,0]=4 2299 B13R1.52 CNc1cc(ccc1Cl)NC(=O)C 34a_100000742996_200000210301 [0,0,0,0,1,0|3,0,0]=4 2300 B13R1.52 CNc1cc(ccc1F)NC(=O)C 34a_106454645589_200000210301 [0,0,0,0,1,0|3,0,0]=4 2301 B13R1.52 COc1cc(ccc1Br)C=C(C)C 271570a_100102525489_100012353699 [0,0,0,0,1,0|2,0,1]=4 2302 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,0,0,0,1,0|1,0,0]=2 2303 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,0,0,0,1,0|1,0,0]=2 2304 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,0,0,0,1,0|1,0,0]=2 2305 B13R1.52 COc1cc(ccc1Br)CN(C)C 2230a_100102631434_100010110085 [0,0,0,0,1,0|3,0,0]=4 2306 B13R1.52 COc1cc(ccc1Br)CN(C)C 269982a_100102631434_100010110085 [0,0,0,0,1,0|3,0,0]=4 2307 B13R1.52 COc1cc(ccc1Br)CN(C)C 270004a_100102631434_100010244714 [0,0,0,0,1,0|3,0,0]=4 2308 B13R1.52 COc1cc(ccc1Br)NC(=O)C 11a_100000765947_100015343762 [0,0,0,0,1,0|2,0,0]=3 2309 B13R1.52 COc1cc(ccc1Br)NC(=O)C 1626a_100000765947_100015343762 [0,0,0,0,1,0|2,0,0]=3 2310 B13R1.52 COc1cc(ccc1Br)NC(=O)C 22a_100000765947_100000070787 [0,0,0,0,1,0|2,0,0]=3 2311 B13R1.52 COc1cc(ccc1Br)NC(=O)C 527a_100000765947_100103153847 [0,0,0,0,1,0|2,0,0]=3 2312 B13R1.52 COc1cc(ccc1C)C=C(C)C 271570a_100102525489_100011830276 [0,0,0,0,1,0|2,0,1]=4 2313 B13R1.52 COc1cc(ccc1C)CN(C)C 270004a_100102631434_100000719150 [0,0,0,0,1,0|3,0,0]=4 2314 B13R1.52 COc1cc(ccc1C)NC(=O)C 11a_100011279678_100015343762 [0,0,0,0,1,0|2,0,0]=3 2315 B13R1.52 COc1cc(ccc1C)NC(=O)C 1626a_100011279678_100015343762 [0,0,0,0,1,0|2,0,0]=3 2316 B13R1.52 COc1cc(ccc1C)NC(=O)C 22a_100011279678_100000070787 [0,0,0,0,1,0|2,0,0]=3 2317 B13R1.52 COc1cc(ccc1C)NC(=O)C 527a_100011279678_100103153847 [0,0,0,0,1,0|2,0,0]=3 2318 B13R1.52 COc1cc(ccc1Cl)C=C(C)C 271570a_100102525489_100011356853 [0,0,0,0,1,0|2,0,1]=4 2319 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,0,0,0,1,0|1,0,0]=2 2320 B13R1.52 COc1cc(ccc1Cl)CN(C)C 2230a_100102631434_200010214485 [0,0,0,0,1,0|3,0,0]=4 2321 B13R1.52 COc1cc(ccc1Cl)CN(C)C 269982a_100102631434_200010214485 [0,0,0,0,1,0|3,0,0]=4 2322 B13R1.52 COc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100011998524 [0,0,0,0,1,0|3,0,0]=4 2323 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 11a_100000742311_100015343762 [0,0,0,0,1,0|2,0,0]=3 2324 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 1626a_100000742311_100015343762 [0,0,0,0,1,0|2,0,0]=3 2325 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 22a_100000742311_100000070787 [0,0,0,0,1,0|2,0,0]=3 2326 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 34a_100011935283_200000210301 [0,0,0,0,1,0|2,0,0]=3 2327 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 527a_100000742311_100103153847 [0,0,0,0,1,0|2,0,0]=3 2328 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 7a_100011935283_200000210301 [0,0,0,0,1,0|2,0,0]=3 2329 B13R1.52 COc1cc(ccc1F)C=C(C)C 271570a_100102525489_100011934186 [0,0,0,0,1,0|2,0,1]=4 2330 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,0,0,0,1,0|1,0,0]=2 2331 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,0,0,0,1,0|1,0,0]=2 2332 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,0,0,0,1,0|1,0,0]=2 2333 B13R1.52 COc1cc(ccc1F)CN(C)C 2230a_100102631434_100012349856 [0,0,0,0,1,0|3,0,0]=4 2334 B13R1.52 COc1cc(ccc1F)CN(C)C 269982a_100102631434_100012349856 [0,0,0,0,1,0|3,0,0]=4 2335 B13R1.52 COc1cc(ccc1F)CN(C)C 270004a_100102631434_100000692873 [0,0,0,0,1,0|3,0,0]=4 2336 B13R1.52 COc1cc(ccc1F)NC(=O)C 11a_100000701188_100015343762 [0,0,0,0,1,0|2,0,0]=3 2337 B13R1.52 COc1cc(ccc1F)NC(=O)C 1626a_100000701188_100015343762 [0,0,0,0,1,0|2,0,0]=3 2338 B13R1.52 COc1cc(ccc1F)NC(=O)C 22a_100000701188_100000070787 [0,0,0,0,1,0|2,0,0]=3 2339 B13R1.52 COc1cc(ccc1F)NC(=O)C 527a_100000701188_100103153847 [0,0,0,0,1,0|2,0,0]=3 2340 B13R1.52 COc1cc(ccc1I)NC(=O)C 11a_100000746945_100015343762 [0,0,0,0,1,0|2,0,0]=3 2341 B13R1.52 COc1cc(ccc1I)NC(=O)C 1626a_100000746945_100015343762 [0,0,0,0,1,0|2,0,0]=3 2342 B13R1.52 COc1cc(ccc1I)NC(=O)C 22a_100000746945_100000070787 [0,0,0,0,1,0|2,0,0]=3 2343 B13R1.52 COc1cc(ccc1I)NC(=O)C 527a_100000746945_100103153847 [0,0,0,0,1,0|2,0,0]=3 2344 B13R1.52 COc1cc(ccc1N)C=C(C)C 271570a_100102525489_100011279103 [0,0,0,0,1,0|2,0,1]=4 2345 B13R1.52 COc1cc(ccc1O)C=C(C)C 271570a_100102525489_100000694246 [0,0,0,0,1,0|1,0,1]=3 2346 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,0,0,0,1,0|0,0,0]=1 2347 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,0,0,0,1,0|0,0,0]=1 2348 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [0,0,0,0,1,0|1,0,0]=2 2349 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [0,0,0,0,1,0|1,0,0]=2 2350 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [0,0,0,0,1,0|2,0,1]=4 2351 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [0,0,0,0,1,0|2,0,1]=4 2352 B13R1.52 COc1nc(ccc1Br)CC(=O)C 1458a_100000070787_200010066506 [0,0,0,0,1,0|2,0,0]=3 2353 B13R1.52 COc1nc(ccc1O)C=C(C)C 271570a_100102525489_100010893133 [0,0,0,0,1,0|2,0,1]=4 2354 B13R1.52 CSc1cc(ccc1C)NC(=O)C 62a_200000210301_100011221169 [0,0,0,0,1,0|2,1,0]=4 2355 B13R1.52 CSc1cc(ccc1C)OC(=O)C 62a_200000210301_200025702335 [0,0,0,0,1,0|2,1,0]=4 2356 B13R1.52 CSc1cc(ccc1F)NC(=O)C 62a_200000210301_100012348134 [0,0,0,0,1,0|2,1,0]=4 2357 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,0,0,0,1,0|0,1,0]=2 2358 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,0,0,0,1,0|0,1,0]=2 2359 B13R1.52 [13CH3]C(=O)Cc1ccc(c(c1)C#N)F 1458a_100011218018_200025704644 [0,0,0,0,1,0|3,0,0]=4 2360 B15R1.4030 C=C(C)CCNc1ccc(c(c1)C#N)O 34a_100011249283_100000730704 [0,0,0,0,0,1|3,0,0]=4 2361 B15R1.4030 C=C(C)CCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000730704 [0,0,0,0,0,1|3,0,0]=4 2362 B15R1.4030 C=C(C)CCNc1ccc(c(c1)CC)Br 34a_100010109747_100000730704 [0,0,0,0,0,1|3,0,0]=4 2363 B15R1.4030 C=C(C)CCNc1ccc(c(c1)CC)Br 7a_100010109747_100000730704 [0,0,0,0,0,1|3,0,0]=4 2364 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000730704 [0,0,0,0,0,1|2,0,0]=3 2365 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000730704 [0,0,0,0,0,1|2,0,0]=3 2366 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000730704 [0,0,0,0,0,1|2,0,0]=3 2367 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)C 34a_100011279678_100000730704 [0,0,0,0,0,1|2,0,0]=3 2368 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000730704 [0,0,0,0,0,1|2,0,0]=3 2369 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000730704 [0,0,0,0,0,1|2,0,0]=3 2370 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000730704 [0,0,0,0,0,1|2,0,0]=3 2371 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)F 34a_100000701188_100000730704 [0,0,0,0,0,1|2,0,0]=3 2372 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)I 34a_100000746945_100000730704 [0,0,0,0,0,1|2,0,0]=3 2373 B15R1.4030 C=C(C)CCNc1ccc(c(c1)OC)O 34a_100000726020_100000730704 [0,0,0,0,0,1|1,0,0]=2 2374 B15R1.4030 C=C(C)CCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000730704 [0,0,0,0,0,1|3,0,0]=4 2375 B15R1.4030 C=C(C)CCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000730704 [0,0,0,0,0,1|3,0,0]=4 2376 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000730704 [0,0,0,0,0,1|2,0,0]=3 2377 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000730704 [0,0,0,0,0,1|2,0,0]=3 2378 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)C 34a_100009865632_100000730704 [0,0,0,0,0,1|2,0,0]=3 2379 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)C 7a_100009865632_100000730704 [0,0,0,0,0,1|2,0,0]=3 2380 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000730704 [0,0,0,0,0,1|2,0,0]=3 2381 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000730704 [0,0,0,0,0,1|2,0,0]=3 2382 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)F 34a_100012001760_100000730704 [0,0,0,0,0,1|2,0,0]=3 2383 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)F 7a_100012001760_100000730704 [0,0,0,0,0,1|2,0,0]=3 2384 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)N 34a_100015326901_100000730704 [0,0,0,0,0,1|2,0,0]=3 2385 B15R1.4030 C=C(C)CCOc1ccc(c(c1)OC)N 7a_100015326901_100000730704 [0,0,0,0,0,1|2,0,0]=3 2386 B15R1.4030 C=C(C)CCSc1c[nH]c(=O)c(c1)OC 62a_100000730704_100010125397 [0,0,0,0,0,1|2,0,1]=4 2387 B15R1.4030 C=C(C)CCSc1cc(c(cn1)C)OC 62a_100000730704_100010067687 [0,0,0,0,0,1|3,0,0]=4 2388 B15R1.4030 C=C(C)CCSc1cc(c(cn1)C)OC 62a_100010067687_100000730704 [0,0,0,0,0,1|3,0,0]=4 2389 B15R1.4030 C=C(C)CCSc1cc(c(cn1)F)OC 62a_100000730704_200010136270 [0,0,0,0,0,1|3,0,0]=4 2390 B15R1.4030 C=C(C)CCSc1cc(c(cn1)F)OC 62a_200010136270_100000730704 [0,0,0,0,0,1|3,0,0]=4 2391 B15R1.4030 C=C(C)CCSc1cc(c(cn1)N)OC 62a_100000730704_100009887741 [0,0,0,0,0,1|3,0,0]=4 2392 B15R1.4030 C=C(C)CCSc1cc(c(cn1)N)OC 62a_100009887741_100000730704 [0,0,0,0,0,1|3,0,0]=4 2393 B15R1.4030 C=C(C)CCSc1ccc(c(c1)C#N)O 62a_100000730704_100000687585 [0,0,0,0,0,1|3,0,0]=4 2394 B15R1.4030 C=C(C)CCSc1ccc(c(c1)C=O)O 62a_100000730704_100000186750 [0,0,0,0,0,1|3,0,0]=4 2395 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CC)F 62a_100000730704_100010244625 [0,0,0,0,0,1|3,0,0]=4 2396 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CC)F 62a_100010244625_100000730704 [0,0,0,0,0,1|3,0,0]=4 2397 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CC)N 62a_100000686106_100000730704 [0,0,0,0,0,1|3,0,0]=4 2398 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CC)N 62a_100000730704_100000686106 [0,0,0,0,0,1|3,0,0]=4 2399 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CC)O 62a_100000730704_100012338938 [0,0,0,0,0,1|2,0,0]=3 2400 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CN)O 62a_100000730032_100000730704 [0,0,0,0,0,1|3,0,0]=4 2401 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CN)O 62a_100000730704_100000730032 [0,0,0,0,0,1|3,0,0]=4 2402 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CO)O 62a_100000184703_100000730704 [0,0,0,0,0,1|3,0,0]=4 2403 B15R1.4030 C=C(C)CCSc1ccc(c(c1)CO)O 62a_100000730704_100000184703 [0,0,0,0,0,1|3,0,0]=4 2404 B15R1.4030 C=C(C)CCSc1ccc(c(c1)NC)C 62a_100000730704_100020629602 [0,0,0,0,0,1|3,0,0]=4 2405 B15R1.4030 C=C(C)CCSc1ccc(c(c1)NC)C 62a_100020629602_100000730704 [0,0,0,0,0,1|3,0,0]=4 2406 B15R1.4030 C=C(C)CCSc1ccc(c(c1)NC)F 62a_100000730704_100011314990 [0,0,0,0,0,1|3,0,0]=4 2407 B15R1.4030 C=C(C)CCSc1ccc(c(c1)NC)F 62a_100011314990_100000730704 [0,0,0,0,0,1|3,0,0]=4 2408 B15R1.4030 C=C(C)CCSc1ccc(c(c1)NC)N 62a_100000694363_100000730704 [0,0,0,0,0,1|3,0,0]=4 2409 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)Br 62a_100000730704_100012353699 [0,0,0,0,0,1|2,0,0]=3 2410 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000730704 [0,0,0,0,0,1|2,0,0]=3 2411 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)C 62a_100000730704_100011830276 [0,0,0,0,0,1|2,0,0]=3 2412 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)C 62a_100011830276_100000730704 [0,0,0,0,0,1|2,0,0]=3 2413 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)Cl 62a_100000730704_100011356853 [0,0,0,0,0,1|2,0,0]=3 2414 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000730704 [0,0,0,0,0,1|2,0,0]=3 2415 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)F 62a_100000730704_100011934186 [0,0,0,0,0,1|2,0,0]=3 2416 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)F 62a_100011934186_100000730704 [0,0,0,0,0,1|2,0,0]=3 2417 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)N 62a_100000730704_100015196925 [0,0,0,0,0,1|2,0,0]=3 2418 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)N 62a_100011279103_100000730704 [0,0,0,0,0,1|2,0,0]=3 2419 B15R1.4030 C=C(C)CCSc1ccc(c(c1)OC)O 62a_100000730704_100000694246 [0,0,0,0,0,1|1,0,0]=2 2420 B15R1.4030 C=C(C)CCSc1ccc(c(c1)SC)F 62a_100000730704_100010341305 [0,0,0,0,0,1|2,1,0]=4 2421 B15R1.4030 C=C(C)CCSc1ccc(c(c1)SC)F 62a_100010341305_100000730704 [0,0,0,0,0,1|2,1,0]=4 2422 B15R1.4030 C=C(C)CCSc1ccc(c(n1)OC)N 62a_100000687816_100000730704 [0,0,0,0,0,1|3,0,0]=4 2423 B15R1.4030 C=C(C)CCSc1ccc(c(n1)OC)N 62a_100000730704_100000687816 [0,0,0,0,0,1|3,0,0]=4 2424 B15R1.4030 C=C(C)CCSc1ccc(c(n1)OC)O 62a_100000730704_100010893133 [0,0,0,0,0,1|2,0,0]=3 2425 B15R1.4030 C=C(C)CCSc1cnc(c(c1)OC)C 62a_100000730704_100010254219 [0,0,0,0,0,1|3,0,0]=4 2426 B15R1.4030 C=C(C)CCSc1cnc(c(c1)OC)C 62a_100010254219_100000730704 [0,0,0,0,0,1|3,0,0]=4 2427 B15R1.4030 C=C(C)CCSc1cnc(c(c1)OC)F 62a_100000730704_100010214931 [0,0,0,0,0,1|3,0,0]=4 2428 B15R1.4030 C=C(C)CCSc1cnc(c(c1)OC)F 62a_100010214931_100000730704 [0,0,0,0,0,1|3,0,0]=4 2429 B15R1.4030 C=C(C)CCSc1cnc(c(c1)OC)N 62a_100000730704_106354213024 [0,0,0,0,0,1|3,0,0]=4 2430 B15R1.4030 C=C(C)CCSc1cnc(c(c1)OC)N 62a_106354213024_100000730704 [0,0,0,0,0,1|3,0,0]=4 2431 B15R1.4030 C=C(C)CCSc1cnc(c(n1)OC)O 62a_100000730704_200010365344 [0,0,0,0,0,1|3,0,0]=4 2432 B15R1.4030 C=C(C)CCSc1cnc(c(n1)OC)O 62a_200010365344_100000730704 [0,0,0,0,0,1|3,0,0]=4 2433 B15R1.4030 C=C(C)CNCc1ccc(c(c1)CC)F 2230a_114873767189_100000748629 [0,0,0,0,0,1|3,0,0]=4 2434 B15R1.4030 C=C(C)CNCc1ccc(c(c1)CC)F 34a_114873767189_100000748629 [0,0,0,0,0,1|3,0,0]=4 2435 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000748629 [0,0,0,0,0,1|2,0,0]=3 2436 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000748629 [0,0,0,0,0,1|2,0,0]=3 2437 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)F 2230a_100020626639_100000748629 [0,0,0,0,0,1|2,0,0]=3 2438 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)F 34a_100020626639_100000748629 [0,0,0,0,0,1|2,0,0]=3 2439 B15R1.4030 C=C(C)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000748629 [0,0,0,0,0,1|1,0,0]=2 2440 B15R1.4030 C=C(C)COCc1cc(c(cn1)Br)OC 34a_100010999569_100000748629 [0,0,0,0,0,1|3,0,0]=4 2441 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)Br 34a_100000210245_100010110085 [0,0,0,0,0,1|2,0,0]=3 2442 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)Br 34a_100010234685_100000748629 [0,0,0,0,0,1|2,0,0]=3 2443 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)Br 7a_100010234685_100000748629 [0,0,0,0,0,1|2,0,0]=3 2444 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)C 34a_100000752651_100000748629 [0,0,0,0,0,1|2,0,0]=3 2445 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)C 7a_100000752651_100000748629 [0,0,0,0,0,1|2,0,0]=3 2446 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)Cl 34a_100000210245_200010214485 [0,0,0,0,0,1|2,0,0]=3 2447 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)Cl 34a_100012179228_100000748629 [0,0,0,0,0,1|2,0,0]=3 2448 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)F 34a_100000210245_100012349856 [0,0,0,0,0,1|2,0,0]=3 2449 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)F 34a_100000692429_100000748629 [0,0,0,0,0,1|2,0,0]=3 2450 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)F 7a_100000692429_100000748629 [0,0,0,0,0,1|2,0,0]=3 2451 B15R1.4030 C=C(C)COCc1ccc(c(c1)OC)N 34a_100000087641_100000748629 [0,0,0,0,0,1|2,0,0]=3 2452 B15R1.4030 C=C(C)COCc1ccc(c(n1)OC)Br 34a_100000210245_200010066506 [0,0,0,0,0,1|3,0,0]=4 2453 B15R1.4030 C=C(C)CSCc1ccc(c(c1)C=O)O 62a_100000748629_100000008128 [0,0,0,0,0,1|3,0,0]=4 2454 B15R1.4030 C=C(C)CSCc1ccc(c(c1)OC)Br 62a_100000748629_100010110085 [0,0,0,0,0,1|2,0,0]=3 2455 B15R1.4030 C=C(C)CSCc1ccc(c(c1)OC)Br 62a_100010110085_100000211660 [0,0,0,0,0,1|2,0,0]=3 2456 B15R1.4030 C=C(C)CSCc1ccc(c(c1)OC)Cl 62a_100000748629_200010214485 [0,0,0,0,0,1|2,0,0]=3 2457 B15R1.4030 C=C(C)CSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000211660 [0,0,0,0,0,1|2,0,0]=3 2458 B15R1.4030 C=C(C)CSCc1ccc(c(c1)OC)F 62a_100000748629_100012349856 [0,0,0,0,0,1|2,0,0]=3 2459 B15R1.4030 C=C(C)CSCc1ccc(c(c1)OC)F 62a_100012349856_100000211660 [0,0,0,0,0,1|2,0,0]=3 2460 B15R1.4030 C=C(C)CSCc1ccc(c(n1)OC)Br 62a_100000748629_200010066506 [0,0,0,0,0,1|3,0,0]=4 2461 B15R1.4030 C=C(C)CSCc1ccc(c(n1)OC)Br 62a_200010066506_100000211660 [0,0,0,0,0,1|3,0,0]=4 2462 B15R1.4030 C=C(F)CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100009893438 [0,0,0,0,0,1|2,0,1]=4 2463 B15R1.4030 C=C(F)CNCc1ccc(c(c1)OC)Cl 34a_100015204853_100009893438 [0,0,0,0,0,1|2,0,1]=4 2464 B15R1.4030 C=C(F)CNCc1ccc(c(c1)OC)F 2230a_100020626639_100009893438 [0,0,0,0,0,1|2,0,1]=4 2465 B15R1.4030 C=C(F)CNCc1ccc(c(c1)OC)F 34a_100020626639_100009893438 [0,0,0,0,0,1|2,0,1]=4 2466 B15R1.4030 C=C(F)CNCc1ccc(c(c1)OC)O 34a_100000185554_100009893438 [0,0,0,0,0,1|1,0,1]=3 2467 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)Br 34a_100010234685_100009893438 [0,0,0,0,0,1|2,0,1]=4 2468 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)Br 34a_200010262243_100010110085 [0,0,0,0,0,1|2,0,1]=4 2469 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)Br 7a_100010234685_100000042424 [0,0,0,0,0,1|2,0,1]=4 2470 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)C 34a_100000752651_100009893438 [0,0,0,0,0,1|2,0,1]=4 2471 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)C 7a_100000752651_100000042424 [0,0,0,0,0,1|2,0,1]=4 2472 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)Cl 34a_100012179228_100009893438 [0,0,0,0,0,1|2,0,1]=4 2473 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)Cl 34a_200010262243_200010214485 [0,0,0,0,0,1|2,0,1]=4 2474 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)F 34a_100000692429_100009893438 [0,0,0,0,0,1|2,0,1]=4 2475 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)F 34a_200010262243_100012349856 [0,0,0,0,0,1|2,0,1]=4 2476 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)F 7a_100000692429_100000042424 [0,0,0,0,0,1|2,0,1]=4 2477 B15R1.4030 C=C(F)COCc1ccc(c(c1)OC)N 34a_100000087641_100009893438 [0,0,0,0,0,1|2,0,1]=4 2478 B15R1.4030 C=C(F)CSCc1ccc(c(c1)OC)Br 62a_100000042424_100010110085 [0,0,0,0,0,1|2,0,1]=4 2479 B15R1.4030 C=C(F)CSCc1ccc(c(c1)OC)Br 62a_100010110085_100000042424 [0,0,0,0,0,1|2,0,1]=4 2480 B15R1.4030 C=C(F)CSCc1ccc(c(c1)OC)Cl 62a_100000042424_200010214485 [0,0,0,0,0,1|2,0,1]=4 2481 B15R1.4030 C=C(F)CSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000042424 [0,0,0,0,0,1|2,0,1]=4 2482 B15R1.4030 C=C(F)CSCc1ccc(c(c1)OC)F 62a_100000042424_100012349856 [0,0,0,0,0,1|2,0,1]=4 2483 B15R1.4030 C=C(F)CSCc1ccc(c(c1)OC)F 62a_100012349856_100000042424 [0,0,0,0,0,1|2,0,1]=4 2484 B15R1.4030 C=Cc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100000688377 [0,0,0,0,0,1|2,0,1]=4 2485 B15R1.4030 C=Cc1cc(ccc1F)SCCC(=O)C 62a_100000688377_100000053229 [0,0,0,0,0,1|2,0,1]=4 2486 B15R1.4030 CC(=O)CCNc1ccc(c(c1)C#N)Br 7a_100011934039_100000053229 [0,0,0,0,0,1|3,0,0]=4 2487 B15R1.4030 CC(=O)CCNc1ccc(c(c1)C#N)C 7a_100011216687_100000053229 [0,0,0,0,0,1|3,0,0]=4 2488 B15R1.4030 CC(=O)CCNc1ccc(c(c1)C#N)Cl 7a_100000239497_100000053229 [0,0,0,0,0,1|3,0,0]=4 2489 B15R1.4030 CC(=O)CCNc1ccc(c(c1)C#N)F 7a_100000748589_100000053229 [0,0,0,0,0,1|3,0,0]=4 2490 B15R1.4030 CC(=O)CCOc1ccc(c(c1)C#N)Br 7a_100009818209_100000053229 [0,0,0,0,0,1|3,0,0]=4 2491 B15R1.4030 CC(=O)CCOc1ccc(c(c1)C#N)Cl 7a_100000092820_100000053229 [0,0,0,0,0,1|3,0,0]=4 2492 B15R1.4030 CC(=O)CCOc1ccc(c(c1)C#N)F 7a_100000070142_100000053229 [0,0,0,0,0,1|3,0,0]=4 2493 B15R1.4030 CC(=O)CCOc1ccc(c(c1)C#N)N 7a_200011997737_100000053229 [0,0,0,0,0,1|3,0,0]=4 2494 B15R1.4030 CC(=O)CCOc1ccc(c(c1)CO)Br 7a_100012351483_100000053229 [0,0,0,0,0,1|3,0,0]=4 2495 B15R1.4030 CC(=O)CCOc1ccc(c(c1)CO)C 7a_100009878257_100000053229 [0,0,0,0,0,1|3,0,0]=4 2496 B15R1.4030 CC(=O)CCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000053229 [0,0,0,0,0,1|3,0,0]=4 2497 B15R1.4030 CC(=O)CCSc1cc(c(cn1)O)C=O 62a_100000053229_100000048449 [0,0,0,0,0,1|3,0,0]=4 2498 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)Br 62a_100000053229_100012355174 [0,0,0,0,0,1|3,0,0]=4 2499 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)Br 62a_100012355174_100000053229 [0,0,0,0,0,1|3,0,0]=4 2500 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)C 62a_100000053229_100011356939 [0,0,0,0,0,1|3,0,0]=4 2501 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)Cl 62a_100000053229_100011356831 [0,0,0,0,0,1|3,0,0]=4 2502 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)F 62a_100000053229_100000037165 [0,0,0,0,0,1|3,0,0]=4 2503 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)N 62a_100000053229_100000688460 [0,0,0,0,0,1|3,0,0]=4 2504 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C#N)O 62a_100000053229_100000687585 [0,0,0,0,0,1|2,0,0]=3 2505 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)Br 62a_100000053229_100010185652 [0,0,0,0,0,1|3,0,0]=4 2506 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)Br 62a_100010185652_100000053229 [0,0,0,0,0,1|3,0,0]=4 2507 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)C 62a_100000053229_100011361606 [0,0,0,0,0,1|3,0,0]=4 2508 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)C 62a_100011361606_100000053229 [0,0,0,0,0,1|3,0,0]=4 2509 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)Cl 62a_100000053229_100010254384 [0,0,0,0,0,1|3,0,0]=4 2510 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)Cl 62a_100010254384_100000053229 [0,0,0,0,0,1|3,0,0]=4 2511 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)F 62a_100000050626_100000053229 [0,0,0,0,0,1|3,0,0]=4 2512 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)F 62a_100000053229_100000050626 [0,0,0,0,0,1|3,0,0]=4 2513 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)N 62a_100011935258_100000053229 [0,0,0,0,0,1|3,0,0]=4 2514 B15R1.4030 CC(=O)CCSc1ccc(c(c1)C=O)O 62a_100000053229_100000186750 [0,0,0,0,0,1|2,0,0]=3 2515 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CN)F 62a_100000053229_100009815772 [0,0,0,0,0,1|3,0,0]=4 2516 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CN)F 62a_100009815772_100000053229 [0,0,0,0,0,1|3,0,0]=4 2517 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CN)N 62a_100000053229_100012349119 [0,0,0,0,0,1|3,0,0]=4 2518 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CN)N 62a_100012349119_100000053229 [0,0,0,0,0,1|3,0,0]=4 2519 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CN)O 62a_100000053229_100000730032 [0,0,0,0,0,1|2,0,0]=3 2520 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CN)O 62a_100000730032_100000053229 [0,0,0,0,0,1|2,0,0]=3 2521 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)Br 62a_100000053229_100012359683 [0,0,0,0,0,1|3,0,0]=4 2522 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)Br 62a_100012359683_100000053229 [0,0,0,0,0,1|3,0,0]=4 2523 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)C 62a_100000053229_100000700630 [0,0,0,0,0,1|3,0,0]=4 2524 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)C 62a_100000700630_100000053229 [0,0,0,0,0,1|3,0,0]=4 2525 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)Cl 62a_100000053229_100010128486 [0,0,0,0,0,1|3,0,0]=4 2526 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000053229 [0,0,0,0,0,1|3,0,0]=4 2527 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)F 62a_100000053229_100000246282 [0,0,0,0,0,1|3,0,0]=4 2528 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)F 62a_100000246282_100000053229 [0,0,0,0,0,1|3,0,0]=4 2529 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)N 62a_100000053229_100012353972 [0,0,0,0,0,1|3,0,0]=4 2530 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)N 62a_100012353972_100000053229 [0,0,0,0,0,1|3,0,0]=4 2531 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)O 62a_100000053229_100000184703 [0,0,0,0,0,1|2,0,0]=3 2532 B15R1.4030 CC(=O)CCSc1ccc(c(c1)CO)O 62a_100000184703_100000053229 [0,0,0,0,0,1|2,0,0]=3 2533 B15R1.4030 CC(=O)CCSc1ccc(c(c1)NN)F 62a_100000053229_100020610843 [0,0,0,0,0,1|3,0,0]=4 2534 B15R1.4030 CC(=O)CCSc1ccc(c(c1)NN)F 62a_100020610843_100000053229 [0,0,0,0,0,1|3,0,0]=4 2535 B15R1.4030 CC(=O)CCSc1cnc(c(c1)C#N)O 62a_100000053229_100000697733 [0,0,0,0,0,1|3,0,0]=4 2536 B15R1.4030 CC(=O)CCSc1cnc(c(c1)C=O)O 62a_100000053229_100010064889 [0,0,0,0,0,1|3,0,0]=4 2537 B15R1.4030 CC(=O)CCSc1cnc(c(c1)C=O)O 62a_100010064889_100000053229 [0,0,0,0,0,1|3,0,0]=4 2538 B15R1.4030 CC(=O)CCSc1cnc(c(c1)CO)O 62a_100000053229_100010065268 [0,0,0,0,0,1|3,0,0]=4 2539 B15R1.4030 CC(=O)CCSc1cnc(c(c1)CO)O 62a_100010065268_100000053229 [0,0,0,0,0,1|3,0,0]=4 2540 B15R1.4030 CC(=O)OCNc1ccc(c(c1)C#N)O 34a_100011249283_100009813279 [0,0,0,0,0,1|3,0,0]=4 2541 B15R1.4030 CC(=O)OCSc1ccc(c(c1)C#N)O 62a_100000076356_100000687585 [0,0,0,0,0,1|3,0,0]=4 2542 B15R1.4030 CC(=O)OCSc1ccc(c(c1)C=O)O 62a_100000076356_100000186750 [0,0,0,0,0,1|3,0,0]=4 2543 B15R1.4030 CC(=O)OCSc1ccc(c(c1)CN)O 62a_100000076356_100000730032 [0,0,0,0,0,1|3,0,0]=4 2544 B15R1.4030 CC(=O)OCSc1ccc(c(c1)CN)O 62a_100000730032_100000076356 [0,0,0,0,0,1|3,0,0]=4 2545 B15R1.4030 CC(=O)OCSc1ccc(c(c1)CO)O 62a_100000076356_100000184703 [0,0,0,0,0,1|3,0,0]=4 2546 B15R1.4030 CC(=O)OCSc1ccc(c(c1)CO)O 62a_100000184703_100000076356 [0,0,0,0,0,1|3,0,0]=4 2547 B15R1.4030 CCc1cc(ccc1Br)NCCC(=O)C 7a_100010109747_100000053229 [0,0,0,0,0,1|2,0,0]=3 2548 B15R1.4030 CCc1cc(ccc1Br)NCCC(=O)N 2230a_100010109747_100000744528 [0,0,0,0,0,1|3,0,0]=4 2549 B15R1.4030 CCc1cc(ccc1Br)NCCC(=O)N 34a_100010109747_100000731001 [0,0,0,0,0,1|3,0,0]=4 2550 B15R1.4030 CCc1cc(ccc1Br)NCCC(=O)N 7a_100010109747_100000744528 [0,0,0,0,0,1|3,0,0]=4 2551 B15R1.4030 CCc1cc(ccc1Br)NCOC(=O)C 34a_100010109747_100009813279 [0,0,0,0,0,1|3,0,0]=4 2552 B15R1.4030 CCc1cc(ccc1Br)SCCC(=O)C 62a_100000053229_100010244631 [0,0,0,0,0,1|2,0,0]=3 2553 B15R1.4030 CCc1cc(ccc1Br)SCCC(=O)C 62a_100010244631_100000053229 [0,0,0,0,0,1|2,0,0]=3 2554 B15R1.4030 CCc1cc(ccc1Br)SCCC(=O)N 62a_100000744528_100010244631 [0,0,0,0,0,1|3,0,0]=4 2555 B15R1.4030 CCc1cc(ccc1Br)SCCC(=O)N 62a_100010244631_100000744528 [0,0,0,0,0,1|3,0,0]=4 2556 B15R1.4030 CCc1cc(ccc1Br)SCOC(=O)C 62a_100000076356_100010244631 [0,0,0,0,0,1|3,0,0]=4 2557 B15R1.4030 CCc1cc(ccc1Br)SCOC(=O)C 62a_100010244631_100000076356 [0,0,0,0,0,1|3,0,0]=4 2558 B15R1.4030 CCc1cc(ccc1Cl)OCCC(=O)C 7a_100000212063_100000053229 [0,0,0,0,0,1|2,0,0]=3 2559 B15R1.4030 CCc1cc(ccc1Cl)OCCC(=O)N 34a_100000212063_100000731001 [0,0,0,0,0,1|3,0,0]=4 2560 B15R1.4030 CCc1cc(ccc1Cl)OCCC(=O)N 7a_100000212063_100000744528 [0,0,0,0,0,1|3,0,0]=4 2561 B15R1.4030 CCc1cc(ccc1Cl)OCOC(=O)C 34a_100000212063_100009813279 [0,0,0,0,0,1|3,0,0]=4 2562 B15R1.4030 CCc1cc(ccc1F)CNCC(=O)N 2230a_114873767189_100000747473 [0,0,0,0,0,1|3,0,0]=4 2563 B15R1.4030 CCc1cc(ccc1F)CNCC(=O)N 34a_114873767189_100000187820 [0,0,0,0,0,1|3,0,0]=4 2564 B15R1.4030 CCc1cc(ccc1F)CNCC(=O)[O-] 34a_114873767189_100020667443 [0,0,0,0,0,1|3,0,0]=4 2565 B15R1.4030 CCc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100010244625 [0,0,0,0,0,1|2,0,0]=3 2566 B15R1.4030 CCc1cc(ccc1F)SCCC(=O)C 62a_100010244625_100000053229 [0,0,0,0,0,1|2,0,0]=3 2567 B15R1.4030 CCc1cc(ccc1F)SCCC(=O)N 62a_100000744528_100010244625 [0,0,0,0,0,1|3,0,0]=4 2568 B15R1.4030 CCc1cc(ccc1F)SCCC(=O)N 62a_100010244625_100000744528 [0,0,0,0,0,1|3,0,0]=4 2569 B15R1.4030 CCc1cc(ccc1F)SCOC(=O)C 62a_100000076356_100010244625 [0,0,0,0,0,1|3,0,0]=4 2570 B15R1.4030 CCc1cc(ccc1F)SCOC(=O)C 62a_100010244625_100000076356 [0,0,0,0,0,1|3,0,0]=4 2571 B15R1.4030 CCc1cc(ccc1N)SCCC(=O)C 62a_100000053229_100000686106 [0,0,0,0,0,1|2,0,0]=3 2572 B15R1.4030 CCc1cc(ccc1N)SCCC(=O)C 62a_100000686106_100000053229 [0,0,0,0,0,1|2,0,0]=3 2573 B15R1.4030 CCc1cc(ccc1N)SCCC(=O)N 62a_100000686106_100000744528 [0,0,0,0,0,1|3,0,0]=4 2574 B15R1.4030 CCc1cc(ccc1N)SCCC(=O)N 62a_100000744528_100000686106 [0,0,0,0,0,1|3,0,0]=4 2575 B15R1.4030 CCc1cc(ccc1N)SCOC(=O)C 62a_100000076356_100000686106 [0,0,0,0,0,1|3,0,0]=4 2576 B15R1.4030 CCc1cc(ccc1N)SCOC(=O)C 62a_100000686106_100000076356 [0,0,0,0,0,1|3,0,0]=4 2577 B15R1.4030 CCc1cc(ccc1O)SCC=C(C)C 62a_100000761012_100012338938 [0,0,0,0,0,1|2,0,1]=4 2578 B15R1.4030 CCc1cc(ccc1O)SCCC(=O)C 62a_100000053229_100012338938 [0,0,0,0,0,1|1,0,0]=2 2579 B15R1.4030 CCc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100012338938 [0,0,0,0,0,1|2,0,0]=3 2580 B15R1.4030 CCc1cc(ccc1O)SCCC(C)C 62a_100000210312_100012338938 [0,0,0,0,0,1|2,0,1]=4 2581 B15R1.4030 CCc1cc(ccc1O)SCCC(C)O 62a_100012276601_100012338938 [0,0,0,0,0,1|1,0,2]=4 2582 B15R1.4030 CCc1cc(ccc1O)SCOC(=O)C 62a_100000076356_100012338938 [0,0,0,0,0,1|2,0,0]=3 2583 B15R1.4030 CCc1nc(ccc1N)SCCC(=O)C 62a_100000053229_100009871203 [0,0,0,0,0,1|3,0,0]=4 2584 B15R1.4030 CCc1nc(ccc1N)SCCC(=O)C 62a_100009871203_100000053229 [0,0,0,0,0,1|3,0,0]=4 2585 B15R1.4030 CCn1cc(ccc1=O)SCCC(=O)C 62a_100000053229_100000231005 [0,0,0,0,0,1|2,0,1]=4 2586 B15R1.4030 CCn1cc(ccc1=O)SCCC(=O)C 62a_100000231005_100000053229 [0,0,0,0,0,1|2,0,1]=4 2587 B15R1.4030 CNc1cc(ccc1C)SCCC(=O)C 62a_100000053229_100020629602 [0,0,0,0,0,1|2,0,0]=3 2588 B15R1.4030 CNc1cc(ccc1C)SCCC(=O)C 62a_100020629602_100000053229 [0,0,0,0,0,1|2,0,0]=3 2589 B15R1.4030 CNc1cc(ccc1C)SCCC(=O)N 62a_100000744528_100020629602 [0,0,0,0,0,1|3,0,0]=4 2590 B15R1.4030 CNc1cc(ccc1C)SCCC(=O)N 62a_100020629602_100000744528 [0,0,0,0,0,1|3,0,0]=4 2591 B15R1.4030 CNc1cc(ccc1C)SCOC(=O)C 62a_100000076356_100020629602 [0,0,0,0,0,1|3,0,0]=4 2592 B15R1.4030 CNc1cc(ccc1C)SCOC(=O)C 62a_100020629602_100000076356 [0,0,0,0,0,1|3,0,0]=4 2593 B15R1.4030 CNc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100011314990 [0,0,0,0,0,1|2,0,0]=3 2594 B15R1.4030 CNc1cc(ccc1F)SCCC(=O)C 62a_100011314990_100000053229 [0,0,0,0,0,1|2,0,0]=3 2595 B15R1.4030 CNc1cc(ccc1F)SCCC(=O)N 62a_100000744528_100011314990 [0,0,0,0,0,1|3,0,0]=4 2596 B15R1.4030 CNc1cc(ccc1F)SCCC(=O)N 62a_100011314990_100000744528 [0,0,0,0,0,1|3,0,0]=4 2597 B15R1.4030 CNc1cc(ccc1F)SCOC(=O)C 62a_100000076356_100011314990 [0,0,0,0,0,1|3,0,0]=4 2598 B15R1.4030 CNc1cc(ccc1F)SCOC(=O)C 62a_100011314990_100000076356 [0,0,0,0,0,1|3,0,0]=4 2599 B15R1.4030 CNc1cc(ccc1N)SCCC(=O)C 62a_100000694363_100000053229 [0,0,0,0,0,1|2,0,0]=3 2600 B15R1.4030 CNc1cc(ccc1N)SCCC(=O)N 62a_100000694363_100000744528 [0,0,0,0,0,1|3,0,0]=4 2601 B15R1.4030 CNc1cc(ccc1N)SCOC(=O)C 62a_100000694363_100000076356 [0,0,0,0,0,1|3,0,0]=4 2602 B15R1.4030 CNc1cc(cnc1N)SCCC(=O)C 62a_100000053229_100010506235 [0,0,0,0,0,1|3,0,0]=4 2603 B15R1.4030 CNc1cc(cnc1N)SCCC(=O)C 62a_100010506235_100000053229 [0,0,0,0,0,1|3,0,0]=4 2604 B15R1.4030 COc1cc(c[nH]c1=O)SCCC(=O)C 62a_100000053229_100010125397 [0,0,0,0,0,1|1,0,1]=3 2605 B15R1.4030 COc1cc(c[nH]c1=O)SCCC(=O)N 62a_100000744528_100010125397 [0,0,0,0,0,1|2,0,1]=4 2606 B15R1.4030 COc1cc(c[nH]c1=O)SCOC(=O)C 62a_100000076356_100010125397 [0,0,0,0,0,1|2,0,1]=4 2607 B15R1.4030 COc1cc(ccc1Br)C=NNC(=O)C 4a_100000189765_100010244714 [0,0,0,0,0,1|2,0,1]=4 2608 B15R1.4030 COc1cc(ccc1Br)CNCC(=O)N 2230a_100000711301_100010110085 [0,0,0,0,0,1|2,0,0]=3 2609 B15R1.4030 COc1cc(ccc1Br)CNCC(=O)O 269956a_100016091260_100010110085 [0,0,0,0,0,1|2,0,0]=3 2610 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 207a_100000210953_100010244714 [0,0,0,0,0,1|2,0,1]=4 2611 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 2230a_100000210953_100010110085 [0,0,0,0,0,1|2,0,1]=4 2612 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 26a_100000210953_100011827694 [0,0,0,0,0,1|2,0,1]=4 2613 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 270004a_100000210953_100010244714 [0,0,0,0,0,1|2,0,1]=4 2614 B15R1.4030 COc1cc(ccc1Br)CNCC(C)C 34a_100000210953_100010110085 [0,0,0,0,0,1|2,0,1]=4 2615 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 207a_100000210904_100010244714 [0,0,0,0,0,1|1,0,2]=4 2616 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 2230a_100000210904_100010110085 [0,0,0,0,0,1|1,0,2]=4 2617 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 270004a_100000210904_100010244714 [0,0,0,0,0,1|1,0,2]=4 2618 B15R1.4030 COc1cc(ccc1Br)CNCC(C)O 34a_100000210904_100010110085 [0,0,0,0,0,1|1,0,2]=4 2619 B15R1.4030 COc1cc(ccc1Br)COCC(=O)C 34a_100000211253_100010110085 [0,0,0,0,0,1|1,0,0]=2 2620 B15R1.4030 COc1cc(ccc1Br)COCC(=O)N 34a_100010234685_100000187820 [0,0,0,0,0,1|2,0,0]=3 2621 B15R1.4030 COc1cc(ccc1Br)COCC(=O)N 7a_100010234685_100000187820 [0,0,0,0,0,1|2,0,0]=3 2622 B15R1.4030 COc1cc(ccc1Br)COCC(=O)[O-] 34a_100010234685_100020667443 [0,0,0,0,0,1|2,0,0]=3 2623 B15R1.4030 COc1cc(ccc1Br)COCC(C)Br 34a_100012180447_100010110085 [0,0,0,0,0,1|2,0,1]=4 2624 B15R1.4030 COc1cc(ccc1Br)COCC(C)C 34a_100000210257_100010110085 [0,0,0,0,0,1|2,0,1]=4 2625 B15R1.4030 COc1cc(ccc1Br)COCC(C)C 34a_100010234685_100000210624 [0,0,0,0,0,1|2,0,1]=4 2626 B15R1.4030 COc1cc(ccc1Br)COCC(C)C 7a_100010234685_100000210760 [0,0,0,0,0,1|2,0,1]=4 2627 B15R1.4030 COc1cc(ccc1Br)COCC(C)F 34a_100015925927_100010110085 [0,0,0,0,0,1|2,0,1]=4 2628 B15R1.4030 COc1cc(ccc1Br)COCC(C)O 34a_100010234685_100011218427 [0,0,0,0,0,1|1,0,2]=4 2629 B15R1.4030 COc1cc(ccc1Br)COCC(C)O 7a_100010234685_100011218427 [0,0,0,0,0,1|1,0,2]=4 2630 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)Cl 34a_100016084084_100010110085 [0,0,0,0,0,1|2,0,1]=4 2631 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)N 34a_100000737577_100010110085 [0,0,0,0,0,1|2,0,1]=4 2632 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)O 34a_100010234685_100009817552 [0,0,0,0,0,1|1,0,2]=4 2633 B15R1.4030 COc1cc(ccc1Br)COC[C@@H](C)O 7a_100010234685_100009817552 [0,0,0,0,0,1|1,0,2]=4 2634 B15R1.4030 COc1cc(ccc1Br)COC[N+](=O)[O-] 34a_100010234685_100000761209 [0,0,0,0,0,1|3,0,0]=4 2635 B15R1.4030 COc1cc(ccc1Br)CSCC(=O)N 62a_100000747473_100010110085 [0,0,0,0,0,1|2,0,0]=3 2636 B15R1.4030 COc1cc(ccc1Br)CSCC(=O)N 62a_100010110085_100000747473 [0,0,0,0,0,1|2,0,0]=3 2637 B15R1.4030 COc1cc(ccc1Br)CSCC(=O)[O-] 62a_100010110085_100020667443 [0,0,0,0,0,1|2,0,0]=3 2638 B15R1.4030 COc1cc(ccc1Br)CSCC(=O)[O-] 62a_100020667443_100010110085 [0,0,0,0,0,1|2,0,0]=3 2639 B15R1.4030 COc1cc(ccc1Br)CSCC(C)C 62a_100000210624_100010110085 [0,0,0,0,0,1|2,0,1]=4 2640 B15R1.4030 COc1cc(ccc1Br)CSCC(C)C 62a_100010110085_100000210760 [0,0,0,0,0,1|2,0,1]=4 2641 B15R1.4030 COc1cc(ccc1Br)CSCC(C)O 62a_100010110085_100011218427 [0,0,0,0,0,1|1,0,2]=4 2642 B15R1.4030 COc1cc(ccc1Br)CSCC(C)O 62a_100011218427_100010110085 [0,0,0,0,0,1|1,0,2]=4 2643 B15R1.4030 COc1cc(ccc1Br)CSC[C@@H](C)O 62a_100009817552_100010110085 [0,0,0,0,0,1|1,0,2]=4 2644 B15R1.4030 COc1cc(ccc1Br)CSC[C@@H](C)O 62a_100010110085_100009817552 [0,0,0,0,0,1|1,0,2]=4 2645 B15R1.4030 COc1cc(ccc1Br)CSC[N+](=O)[O-] 62a_100010110085_100000761209 [0,0,0,0,0,1|3,0,0]=4 2646 B15R1.4030 COc1cc(ccc1Br)NCC=C(C)C 2230a_100000765947_100000761012 [0,0,0,0,0,1|2,0,1]=4 2647 B15R1.4030 COc1cc(ccc1Br)NCC=C(C)C 34a_100000765947_100000761012 [0,0,0,0,0,1|2,0,1]=4 2648 B15R1.4030 COc1cc(ccc1Br)NCCC(=O)N 2230a_100000765947_100000744528 [0,0,0,0,0,1|2,0,0]=3 2649 B15R1.4030 COc1cc(ccc1Br)NCCC(=O)N 34a_100000765947_100000731001 [0,0,0,0,0,1|2,0,0]=3 2650 B15R1.4030 COc1cc(ccc1Br)NCCC(C)C 2230a_100000765947_100000210312 [0,0,0,0,0,1|2,0,1]=4 2651 B15R1.4030 COc1cc(ccc1Br)NCCC(C)C 34a_100000765947_100000210312 [0,0,0,0,0,1|2,0,1]=4 2652 B15R1.4030 COc1cc(ccc1Br)NCCC(C)O 2230a_100000765947_100012276601 [0,0,0,0,0,1|1,0,2]=4 2653 B15R1.4030 COc1cc(ccc1Br)NCCC(C)O 34a_100000765947_100012276601 [0,0,0,0,0,1|1,0,2]=4 2654 B15R1.4030 COc1cc(ccc1Br)NCOC(=O)C 34a_100000765947_100009813279 [0,0,0,0,0,1|2,0,0]=3 2655 B15R1.4030 COc1cc(ccc1Br)OCC=C(C)C 34a_100011827694_100000761012 [0,0,0,0,0,1|2,0,1]=4 2656 B15R1.4030 COc1cc(ccc1Br)OCC=C(C)C 7a_100011827694_100000761012 [0,0,0,0,0,1|2,0,1]=4 2657 B15R1.4030 COc1cc(ccc1Br)OCCC(=O)C 7a_100011827694_100000053229 [0,0,0,0,0,1|1,0,0]=2 2658 B15R1.4030 COc1cc(ccc1Br)OCCC(=O)N 34a_100011827694_100000731001 [0,0,0,0,0,1|2,0,0]=3 2659 B15R1.4030 COc1cc(ccc1Br)OCCC(=O)N 7a_100011827694_100000744528 [0,0,0,0,0,1|2,0,0]=3 2660 B15R1.4030 COc1cc(ccc1Br)OCCC(C)C 34a_100011827694_100000210312 [0,0,0,0,0,1|2,0,1]=4 2661 B15R1.4030 COc1cc(ccc1Br)OCCC(C)C 7a_100011827694_100000210626 [0,0,0,0,0,1|2,0,1]=4 2662 B15R1.4030 COc1cc(ccc1Br)OCCC(C)O 34a_100011827694_100012276601 [0,0,0,0,0,1|1,0,2]=4 2663 B15R1.4030 COc1cc(ccc1Br)OCCC(C)O 7a_100011827694_100012276601 [0,0,0,0,0,1|1,0,2]=4 2664 B15R1.4030 COc1cc(ccc1Br)OCCN(C)C 7a_100011827694_100000755713 [0,0,0,0,0,1|3,0,0]=4 2665 B15R1.4030 COc1cc(ccc1Br)OCOC(=O)C 34a_100011827694_100009813279 [0,0,0,0,0,1|2,0,0]=3 2666 B15R1.4030 COc1cc(ccc1Br)SCC=C(C)C 62a_100000761012_100012353699 [0,0,0,0,0,1|2,0,1]=4 2667 B15R1.4030 COc1cc(ccc1Br)SCC=C(C)C 62a_100012353699_100000761012 [0,0,0,0,0,1|2,0,1]=4 2668 B15R1.4030 COc1cc(ccc1Br)SCCC(=O)C 62a_100000053229_100012353699 [0,0,0,0,0,1|1,0,0]=2 2669 B15R1.4030 COc1cc(ccc1Br)SCCC(=O)C 62a_100012353699_100000053229 [0,0,0,0,0,1|1,0,0]=2 2670 B15R1.4030 COc1cc(ccc1Br)SCCC(=O)N 62a_100000744528_100012353699 [0,0,0,0,0,1|2,0,0]=3 2671 B15R1.4030 COc1cc(ccc1Br)SCCC(=O)N 62a_100012353699_100000744528 [0,0,0,0,0,1|2,0,0]=3 2672 B15R1.4030 COc1cc(ccc1Br)SCCC(C)C 62a_100000210312_100012353699 [0,0,0,0,0,1|2,0,1]=4 2673 B15R1.4030 COc1cc(ccc1Br)SCCC(C)C 62a_100012353699_100000210312 [0,0,0,0,0,1|2,0,1]=4 2674 B15R1.4030 COc1cc(ccc1Br)SCCC(C)O 62a_100012276601_100012353699 [0,0,0,0,0,1|1,0,2]=4 2675 B15R1.4030 COc1cc(ccc1Br)SCCC(C)O 62a_100012353699_100012276601 [0,0,0,0,0,1|1,0,2]=4 2676 B15R1.4030 COc1cc(ccc1Br)SCCN(C)C 62a_100012353699_100000755713 [0,0,0,0,0,1|3,0,0]=4 2677 B15R1.4030 COc1cc(ccc1Br)SCOC(=O)C 62a_100000076356_100012353699 [0,0,0,0,0,1|2,0,0]=3 2678 B15R1.4030 COc1cc(ccc1Br)SCOC(=O)C 62a_100012353699_100000076356 [0,0,0,0,0,1|2,0,0]=3 2679 B15R1.4030 COc1cc(ccc1C)C=NNC(=O)C 4a_100000189765_100000719150 [0,0,0,0,0,1|2,0,1]=4 2680 B15R1.4030 COc1cc(ccc1C)CNCC(C)C 207a_100000210953_100000719150 [0,0,0,0,0,1|2,0,1]=4 2681 B15R1.4030 COc1cc(ccc1C)CNCC(C)C 270004a_100000210953_100000719150 [0,0,0,0,0,1|2,0,1]=4 2682 B15R1.4030 COc1cc(ccc1C)CNCC(C)O 207a_100000210904_100000719150 [0,0,0,0,0,1|1,0,2]=4 2683 B15R1.4030 COc1cc(ccc1C)CNCC(C)O 270004a_100000210904_100000719150 [0,0,0,0,0,1|1,0,2]=4 2684 B15R1.4030 COc1cc(ccc1C)COCC(=O)N 34a_100000752651_100000187820 [0,0,0,0,0,1|2,0,0]=3 2685 B15R1.4030 COc1cc(ccc1C)COCC(=O)N 7a_100000752651_100000187820 [0,0,0,0,0,1|2,0,0]=3 2686 B15R1.4030 COc1cc(ccc1C)COCC(=O)[O-] 34a_100000752651_100020667443 [0,0,0,0,0,1|2,0,0]=3 2687 B15R1.4030 COc1cc(ccc1C)COCC(C)C 34a_100000752651_100000210624 [0,0,0,0,0,1|2,0,1]=4 2688 B15R1.4030 COc1cc(ccc1C)COCC(C)C 7a_100000752651_100000210760 [0,0,0,0,0,1|2,0,1]=4 2689 B15R1.4030 COc1cc(ccc1C)COCC(C)O 34a_100000752651_100011218427 [0,0,0,0,0,1|1,0,2]=4 2690 B15R1.4030 COc1cc(ccc1C)COCC(C)O 7a_100000752651_100011218427 [0,0,0,0,0,1|1,0,2]=4 2691 B15R1.4030 COc1cc(ccc1C)COC[C@@H](C)O 34a_100000752651_100009817552 [0,0,0,0,0,1|1,0,2]=4 2692 B15R1.4030 COc1cc(ccc1C)COC[C@@H](C)O 7a_100000752651_100009817552 [0,0,0,0,0,1|1,0,2]=4 2693 B15R1.4030 COc1cc(ccc1C)COC[N+](=O)[O-] 34a_100000752651_100000761209 [0,0,0,0,0,1|3,0,0]=4 2694 B15R1.4030 COc1cc(ccc1C)NCC=C(C)C 2230a_100011279678_100000761012 [0,0,0,0,0,1|2,0,1]=4 2695 B15R1.4030 COc1cc(ccc1C)NCC=C(C)C 34a_100011279678_100000761012 [0,0,0,0,0,1|2,0,1]=4 2696 B15R1.4030 COc1cc(ccc1C)NCCC(=O)N 2230a_100011279678_100000744528 [0,0,0,0,0,1|2,0,0]=3 2697 B15R1.4030 COc1cc(ccc1C)NCCC(=O)N 34a_100011279678_100000731001 [0,0,0,0,0,1|2,0,0]=3 2698 B15R1.4030 COc1cc(ccc1C)NCCC(C)C 2230a_100011279678_100000210312 [0,0,0,0,0,1|2,0,1]=4 2699 B15R1.4030 COc1cc(ccc1C)NCCC(C)C 34a_100011279678_100000210312 [0,0,0,0,0,1|2,0,1]=4 2700 B15R1.4030 COc1cc(ccc1C)NCCC(C)O 2230a_100011279678_100012276601 [0,0,0,0,0,1|1,0,2]=4 2701 B15R1.4030 COc1cc(ccc1C)NCCC(C)O 34a_100011279678_100012276601 [0,0,0,0,0,1|1,0,2]=4 2702 B15R1.4030 COc1cc(ccc1C)NCOC(=O)C 34a_100011279678_100009813279 [0,0,0,0,0,1|2,0,0]=3 2703 B15R1.4030 COc1cc(ccc1C)OCC=C(C)C 34a_100009865632_100000761012 [0,0,0,0,0,1|2,0,1]=4 2704 B15R1.4030 COc1cc(ccc1C)OCC=C(C)C 7a_100009865632_100000761012 [0,0,0,0,0,1|2,0,1]=4 2705 B15R1.4030 COc1cc(ccc1C)OCCC(=O)C 7a_100009865632_100000053229 [0,0,0,0,0,1|1,0,0]=2 2706 B15R1.4030 COc1cc(ccc1C)OCCC(=O)N 34a_100009865632_100000731001 [0,0,0,0,0,1|2,0,0]=3 2707 B15R1.4030 COc1cc(ccc1C)OCCC(=O)N 7a_100009865632_100000744528 [0,0,0,0,0,1|2,0,0]=3 2708 B15R1.4030 COc1cc(ccc1C)OCCC(C)C 34a_100009865632_100000210312 [0,0,0,0,0,1|2,0,1]=4 2709 B15R1.4030 COc1cc(ccc1C)OCCC(C)C 7a_100009865632_100000210626 [0,0,0,0,0,1|2,0,1]=4 2710 B15R1.4030 COc1cc(ccc1C)OCCC(C)O 34a_100009865632_100012276601 [0,0,0,0,0,1|1,0,2]=4 2711 B15R1.4030 COc1cc(ccc1C)OCCC(C)O 7a_100009865632_100012276601 [0,0,0,0,0,1|1,0,2]=4 2712 B15R1.4030 COc1cc(ccc1C)OCCN(C)C 7a_100009865632_100000755713 [0,0,0,0,0,1|3,0,0]=4 2713 B15R1.4030 COc1cc(ccc1C)OCOC(=O)C 34a_100009865632_100009813279 [0,0,0,0,0,1|2,0,0]=3 2714 B15R1.4030 COc1cc(ccc1C)SCC=C(C)C 62a_100000761012_100011830276 [0,0,0,0,0,1|2,0,1]=4 2715 B15R1.4030 COc1cc(ccc1C)SCC=C(C)C 62a_100011830276_100000761012 [0,0,0,0,0,1|2,0,1]=4 2716 B15R1.4030 COc1cc(ccc1C)SCCC(=O)C 62a_100000053229_100011830276 [0,0,0,0,0,1|1,0,0]=2 2717 B15R1.4030 COc1cc(ccc1C)SCCC(=O)C 62a_100011830276_100000053229 [0,0,0,0,0,1|1,0,0]=2 2718 B15R1.4030 COc1cc(ccc1C)SCCC(=O)N 62a_100000744528_100011830276 [0,0,0,0,0,1|2,0,0]=3 2719 B15R1.4030 COc1cc(ccc1C)SCCC(=O)N 62a_100011830276_100000744528 [0,0,0,0,0,1|2,0,0]=3 2720 B15R1.4030 COc1cc(ccc1C)SCCC(C)C 62a_100000210312_100011830276 [0,0,0,0,0,1|2,0,1]=4 2721 B15R1.4030 COc1cc(ccc1C)SCCC(C)C 62a_100011830276_100000210312 [0,0,0,0,0,1|2,0,1]=4 2722 B15R1.4030 COc1cc(ccc1C)SCCC(C)O 62a_100011830276_100012276601 [0,0,0,0,0,1|1,0,2]=4 2723 B15R1.4030 COc1cc(ccc1C)SCCC(C)O 62a_100012276601_100011830276 [0,0,0,0,0,1|1,0,2]=4 2724 B15R1.4030 COc1cc(ccc1C)SCCN(C)C 62a_100011830276_100000755713 [0,0,0,0,0,1|3,0,0]=4 2725 B15R1.4030 COc1cc(ccc1C)SCOC(=O)C 62a_100000076356_100011830276 [0,0,0,0,0,1|2,0,0]=3 2726 B15R1.4030 COc1cc(ccc1C)SCOC(=O)C 62a_100011830276_100000076356 [0,0,0,0,0,1|2,0,0]=3 2727 B15R1.4030 COc1cc(ccc1Cl)C=NNC(=O)C 4a_100000189765_100011998524 [0,0,0,0,0,1|2,0,1]=4 2728 B15R1.4030 COc1cc(ccc1Cl)CNCC(=O)N 2230a_100000711301_200010214485 [0,0,0,0,0,1|2,0,0]=3 2729 B15R1.4030 COc1cc(ccc1Cl)CNCC(=O)N 2230a_100015204853_100000747473 [0,0,0,0,0,1|2,0,0]=3 2730 B15R1.4030 COc1cc(ccc1Cl)CNCC(=O)N 34a_100015204853_100000187820 [0,0,0,0,0,1|2,0,0]=3 2731 B15R1.4030 COc1cc(ccc1Cl)CNCC(=O)O 269956a_100016091260_200010214485 [0,0,0,0,0,1|2,0,0]=3 2732 B15R1.4030 COc1cc(ccc1Cl)CNCC(=O)[O-] 34a_100015204853_100020667443 [0,0,0,0,0,1|2,0,0]=3 2733 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 207a_100000210953_100011998524 [0,0,0,0,0,1|2,0,1]=4 2734 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 2230a_100000210953_200010214485 [0,0,0,0,0,1|2,0,1]=4 2735 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 2230a_100015204853_100000210760 [0,0,0,0,0,1|2,0,1]=4 2736 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 26a_100000210953_100012186310 [0,0,0,0,0,1|2,0,1]=4 2737 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 270004a_100000210953_100011998524 [0,0,0,0,0,1|2,0,1]=4 2738 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 270004a_100015204853_100000210432 [0,0,0,0,0,1|2,0,1]=4 2739 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 34a_100000210953_200010214485 [0,0,0,0,0,1|2,0,1]=4 2740 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)C 34a_100015204853_100000210624 [0,0,0,0,0,1|2,0,1]=4 2741 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 207a_100000210904_100011998524 [0,0,0,0,0,1|1,0,2]=4 2742 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 2230a_100000210904_200010214485 [0,0,0,0,0,1|1,0,2]=4 2743 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 2230a_100015204853_100011218427 [0,0,0,0,0,1|1,0,2]=4 2744 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 270004a_100000210904_100011998524 [0,0,0,0,0,1|1,0,2]=4 2745 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 34a_100000210904_200010214485 [0,0,0,0,0,1|1,0,2]=4 2746 B15R1.4030 COc1cc(ccc1Cl)CNCC(C)O 34a_100015204853_100011218427 [0,0,0,0,0,1|1,0,2]=4 2747 B15R1.4030 COc1cc(ccc1Cl)CNC[C@@H](C)O 2230a_100015204853_100009817552 [0,0,0,0,0,1|1,0,2]=4 2748 B15R1.4030 COc1cc(ccc1Cl)CNC[C@@H](C)O 34a_100015204853_100009817552 [0,0,0,0,0,1|1,0,2]=4 2749 B15R1.4030 COc1cc(ccc1Cl)CNC[N+](=O)[O-] 34a_100015204853_100000761209 [0,0,0,0,0,1|3,0,0]=4 2750 B15R1.4030 COc1cc(ccc1Cl)COCC(=O)C 34a_100000211253_200010214485 [0,0,0,0,0,1|1,0,0]=2 2751 B15R1.4030 COc1cc(ccc1Cl)COCC(=O)N 34a_100012179228_100000187820 [0,0,0,0,0,1|2,0,0]=3 2752 B15R1.4030 COc1cc(ccc1Cl)COCC(=O)[O-] 34a_100012179228_100020667443 [0,0,0,0,0,1|2,0,0]=3 2753 B15R1.4030 COc1cc(ccc1Cl)COCC(C)Br 34a_100012180447_200010214485 [0,0,0,0,0,1|2,0,1]=4 2754 B15R1.4030 COc1cc(ccc1Cl)COCC(C)C 34a_100000210257_200010214485 [0,0,0,0,0,1|2,0,1]=4 2755 B15R1.4030 COc1cc(ccc1Cl)COCC(C)C 34a_100012179228_100000210624 [0,0,0,0,0,1|2,0,1]=4 2756 B15R1.4030 COc1cc(ccc1Cl)COCC(C)F 34a_100015925927_200010214485 [0,0,0,0,0,1|2,0,1]=4 2757 B15R1.4030 COc1cc(ccc1Cl)COCC(C)O 34a_100012179228_100011218427 [0,0,0,0,0,1|1,0,2]=4 2758 B15R1.4030 COc1cc(ccc1Cl)COC[C@@H](C)Cl 34a_100016084084_200010214485 [0,0,0,0,0,1|2,0,1]=4 2759 B15R1.4030 COc1cc(ccc1Cl)COC[C@@H](C)N 34a_100000737577_200010214485 [0,0,0,0,0,1|2,0,1]=4 2760 B15R1.4030 COc1cc(ccc1Cl)COC[C@@H](C)O 34a_100012179228_100009817552 [0,0,0,0,0,1|1,0,2]=4 2761 B15R1.4030 COc1cc(ccc1Cl)COC[N+](=O)[O-] 34a_100012179228_100000761209 [0,0,0,0,0,1|3,0,0]=4 2762 B15R1.4030 COc1cc(ccc1Cl)CSCC(=O)N 62a_100000747473_200010214485 [0,0,0,0,0,1|2,0,0]=3 2763 B15R1.4030 COc1cc(ccc1Cl)CSCC(=O)N 62a_200010214485_100000747473 [0,0,0,0,0,1|2,0,0]=3 2764 B15R1.4030 COc1cc(ccc1Cl)CSCC(=O)[O-] 62a_100020667443_200010214485 [0,0,0,0,0,1|2,0,0]=3 2765 B15R1.4030 COc1cc(ccc1Cl)CSCC(=O)[O-] 62a_200010214485_100020667443 [0,0,0,0,0,1|2,0,0]=3 2766 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)C 62a_100000210624_200010214485 [0,0,0,0,0,1|2,0,1]=4 2767 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)C 62a_200010214485_100000210760 [0,0,0,0,0,1|2,0,1]=4 2768 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)O 62a_100011218427_200010214485 [0,0,0,0,0,1|1,0,2]=4 2769 B15R1.4030 COc1cc(ccc1Cl)CSCC(C)O 62a_200010214485_100011218427 [0,0,0,0,0,1|1,0,2]=4 2770 B15R1.4030 COc1cc(ccc1Cl)CSC[C@@H](C)O 62a_100009817552_200010214485 [0,0,0,0,0,1|1,0,2]=4 2771 B15R1.4030 COc1cc(ccc1Cl)CSC[C@@H](C)O 62a_200010214485_100009817552 [0,0,0,0,0,1|1,0,2]=4 2772 B15R1.4030 COc1cc(ccc1Cl)CSC[N+](=O)[O-] 62a_200010214485_100000761209 [0,0,0,0,0,1|3,0,0]=4 2773 B15R1.4030 COc1cc(ccc1Cl)NCC=C(C)C 2230a_100000742311_100000761012 [0,0,0,0,0,1|2,0,1]=4 2774 B15R1.4030 COc1cc(ccc1Cl)NCC=C(C)C 34a_100000742311_100000761012 [0,0,0,0,0,1|2,0,1]=4 2775 B15R1.4030 COc1cc(ccc1Cl)NCCC(=O)N 2230a_100000742311_100000744528 [0,0,0,0,0,1|2,0,0]=3 2776 B15R1.4030 COc1cc(ccc1Cl)NCCC(=O)N 34a_100000742311_100000731001 [0,0,0,0,0,1|2,0,0]=3 2777 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)C 2230a_100000742311_100000210312 [0,0,0,0,0,1|2,0,1]=4 2778 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)C 34a_100000742311_100000210312 [0,0,0,0,0,1|2,0,1]=4 2779 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)O 2230a_100000742311_100012276601 [0,0,0,0,0,1|1,0,2]=4 2780 B15R1.4030 COc1cc(ccc1Cl)NCCC(C)O 34a_100000742311_100012276601 [0,0,0,0,0,1|1,0,2]=4 2781 B15R1.4030 COc1cc(ccc1Cl)NCOC(=O)C 34a_100000742311_100009813279 [0,0,0,0,0,1|2,0,0]=3 2782 B15R1.4030 COc1cc(ccc1Cl)OCC=C(C)C 34a_100012186310_100000761012 [0,0,0,0,0,1|2,0,1]=4 2783 B15R1.4030 COc1cc(ccc1Cl)OCC=C(C)C 7a_100012186310_100000761012 [0,0,0,0,0,1|2,0,1]=4 2784 B15R1.4030 COc1cc(ccc1Cl)OCCC(=O)C 7a_100012186310_100000053229 [0,0,0,0,0,1|1,0,0]=2 2785 B15R1.4030 COc1cc(ccc1Cl)OCCC(=O)N 34a_100012186310_100000731001 [0,0,0,0,0,1|2,0,0]=3 2786 B15R1.4030 COc1cc(ccc1Cl)OCCC(=O)N 7a_100012186310_100000744528 [0,0,0,0,0,1|2,0,0]=3 2787 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)C 34a_100012186310_100000210312 [0,0,0,0,0,1|2,0,1]=4 2788 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)C 7a_100012186310_100000210626 [0,0,0,0,0,1|2,0,1]=4 2789 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)O 34a_100012186310_100012276601 [0,0,0,0,0,1|1,0,2]=4 2790 B15R1.4030 COc1cc(ccc1Cl)OCCC(C)O 7a_100012186310_100012276601 [0,0,0,0,0,1|1,0,2]=4 2791 B15R1.4030 COc1cc(ccc1Cl)OCCN(C)C 7a_100012186310_100000755713 [0,0,0,0,0,1|3,0,0]=4 2792 B15R1.4030 COc1cc(ccc1Cl)OCOC(=O)C 34a_100012186310_100009813279 [0,0,0,0,0,1|2,0,0]=3 2793 B15R1.4030 COc1cc(ccc1Cl)SCC=C(C)C 62a_100000761012_100011356853 [0,0,0,0,0,1|2,0,1]=4 2794 B15R1.4030 COc1cc(ccc1Cl)SCC=C(C)C 62a_100011356853_100000761012 [0,0,0,0,0,1|2,0,1]=4 2795 B15R1.4030 COc1cc(ccc1Cl)SCCC(=O)C 62a_100000053229_100011356853 [0,0,0,0,0,1|1,0,0]=2 2796 B15R1.4030 COc1cc(ccc1Cl)SCCC(=O)C 62a_100011356853_100000053229 [0,0,0,0,0,1|1,0,0]=2 2797 B15R1.4030 COc1cc(ccc1Cl)SCCC(=O)N 62a_100000744528_100011356853 [0,0,0,0,0,1|2,0,0]=3 2798 B15R1.4030 COc1cc(ccc1Cl)SCCC(=O)N 62a_100011356853_100000744528 [0,0,0,0,0,1|2,0,0]=3 2799 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)C 62a_100000210312_100011356853 [0,0,0,0,0,1|2,0,1]=4 2800 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)C 62a_100011356853_100000210312 [0,0,0,0,0,1|2,0,1]=4 2801 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)O 62a_100011356853_100012276601 [0,0,0,0,0,1|1,0,2]=4 2802 B15R1.4030 COc1cc(ccc1Cl)SCCC(C)O 62a_100012276601_100011356853 [0,0,0,0,0,1|1,0,2]=4 2803 B15R1.4030 COc1cc(ccc1Cl)SCCN(C)C 62a_100011356853_100000755713 [0,0,0,0,0,1|3,0,0]=4 2804 B15R1.4030 COc1cc(ccc1Cl)SCOC(=O)C 62a_100000076356_100011356853 [0,0,0,0,0,1|2,0,0]=3 2805 B15R1.4030 COc1cc(ccc1Cl)SCOC(=O)C 62a_100011356853_100000076356 [0,0,0,0,0,1|2,0,0]=3 2806 B15R1.4030 COc1cc(ccc1F)C=NNC(=O)C 4a_100000189765_100000692873 [0,0,0,0,0,1|2,0,1]=4 2807 B15R1.4030 COc1cc(ccc1F)CNCC(=O)N 2230a_100000711301_100012349856 [0,0,0,0,0,1|2,0,0]=3 2808 B15R1.4030 COc1cc(ccc1F)CNCC(=O)N 2230a_100020626639_100000747473 [0,0,0,0,0,1|2,0,0]=3 2809 B15R1.4030 COc1cc(ccc1F)CNCC(=O)N 34a_100020626639_100000187820 [0,0,0,0,0,1|2,0,0]=3 2810 B15R1.4030 COc1cc(ccc1F)CNCC(=O)O 269956a_100016091260_100012349856 [0,0,0,0,0,1|2,0,0]=3 2811 B15R1.4030 COc1cc(ccc1F)CNCC(=O)[O-] 34a_100020626639_100020667443 [0,0,0,0,0,1|2,0,0]=3 2812 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 207a_100000210953_100000692873 [0,0,0,0,0,1|2,0,1]=4 2813 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 2230a_100000210953_100012349856 [0,0,0,0,0,1|2,0,1]=4 2814 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 2230a_100020626639_100000210760 [0,0,0,0,0,1|2,0,1]=4 2815 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 270004a_100000210953_100000692873 [0,0,0,0,0,1|2,0,1]=4 2816 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 270004a_100020626639_100000210432 [0,0,0,0,0,1|2,0,1]=4 2817 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 34a_100000210953_100012349856 [0,0,0,0,0,1|2,0,1]=4 2818 B15R1.4030 COc1cc(ccc1F)CNCC(C)C 34a_100020626639_100000210624 [0,0,0,0,0,1|2,0,1]=4 2819 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 207a_100000210904_100000692873 [0,0,0,0,0,1|1,0,2]=4 2820 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 2230a_100000210904_100012349856 [0,0,0,0,0,1|1,0,2]=4 2821 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 2230a_100020626639_100011218427 [0,0,0,0,0,1|1,0,2]=4 2822 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 270004a_100000210904_100000692873 [0,0,0,0,0,1|1,0,2]=4 2823 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 34a_100000210904_100012349856 [0,0,0,0,0,1|1,0,2]=4 2824 B15R1.4030 COc1cc(ccc1F)CNCC(C)O 34a_100020626639_100011218427 [0,0,0,0,0,1|1,0,2]=4 2825 B15R1.4030 COc1cc(ccc1F)CNC[C@@H](C)O 2230a_100020626639_100009817552 [0,0,0,0,0,1|1,0,2]=4 2826 B15R1.4030 COc1cc(ccc1F)CNC[C@@H](C)O 34a_100020626639_100009817552 [0,0,0,0,0,1|1,0,2]=4 2827 B15R1.4030 COc1cc(ccc1F)CNC[N+](=O)[O-] 34a_100020626639_100000761209 [0,0,0,0,0,1|3,0,0]=4 2828 B15R1.4030 COc1cc(ccc1F)COCC(=O)C 34a_100000211253_100012349856 [0,0,0,0,0,1|1,0,0]=2 2829 B15R1.4030 COc1cc(ccc1F)COCC(=O)N 34a_100000692429_100000187820 [0,0,0,0,0,1|2,0,0]=3 2830 B15R1.4030 COc1cc(ccc1F)COCC(=O)N 7a_100000692429_100000187820 [0,0,0,0,0,1|2,0,0]=3 2831 B15R1.4030 COc1cc(ccc1F)COCC(=O)[O-] 34a_100000692429_100020667443 [0,0,0,0,0,1|2,0,0]=3 2832 B15R1.4030 COc1cc(ccc1F)COCC(C)Br 34a_100012180447_100012349856 [0,0,0,0,0,1|2,0,1]=4 2833 B15R1.4030 COc1cc(ccc1F)COCC(C)C 34a_100000210257_100012349856 [0,0,0,0,0,1|2,0,1]=4 2834 B15R1.4030 COc1cc(ccc1F)COCC(C)C 34a_100000692429_100000210624 [0,0,0,0,0,1|2,0,1]=4 2835 B15R1.4030 COc1cc(ccc1F)COCC(C)C 7a_100000692429_100000210760 [0,0,0,0,0,1|2,0,1]=4 2836 B15R1.4030 COc1cc(ccc1F)COCC(C)F 34a_100015925927_100012349856 [0,0,0,0,0,1|2,0,1]=4 2837 B15R1.4030 COc1cc(ccc1F)COCC(C)O 34a_100000692429_100011218427 [0,0,0,0,0,1|1,0,2]=4 2838 B15R1.4030 COc1cc(ccc1F)COCC(C)O 7a_100000692429_100011218427 [0,0,0,0,0,1|1,0,2]=4 2839 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)Cl 34a_100016084084_100012349856 [0,0,0,0,0,1|2,0,1]=4 2840 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)N 34a_100000737577_100012349856 [0,0,0,0,0,1|2,0,1]=4 2841 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)O 34a_100000692429_100009817552 [0,0,0,0,0,1|1,0,2]=4 2842 B15R1.4030 COc1cc(ccc1F)COC[C@@H](C)O 7a_100000692429_100009817552 [0,0,0,0,0,1|1,0,2]=4 2843 B15R1.4030 COc1cc(ccc1F)COC[N+](=O)[O-] 34a_100000692429_100000761209 [0,0,0,0,0,1|3,0,0]=4 2844 B15R1.4030 COc1cc(ccc1F)CSCC(=O)N 62a_100000747473_100012349856 [0,0,0,0,0,1|2,0,0]=3 2845 B15R1.4030 COc1cc(ccc1F)CSCC(=O)N 62a_100012349856_100000747473 [0,0,0,0,0,1|2,0,0]=3 2846 B15R1.4030 COc1cc(ccc1F)CSCC(=O)[O-] 62a_100012349856_100020667443 [0,0,0,0,0,1|2,0,0]=3 2847 B15R1.4030 COc1cc(ccc1F)CSCC(=O)[O-] 62a_100020667443_100012349856 [0,0,0,0,0,1|2,0,0]=3 2848 B15R1.4030 COc1cc(ccc1F)CSCC(C)C 62a_100000210624_100012349856 [0,0,0,0,0,1|2,0,1]=4 2849 B15R1.4030 COc1cc(ccc1F)CSCC(C)C 62a_100012349856_100000210760 [0,0,0,0,0,1|2,0,1]=4 2850 B15R1.4030 COc1cc(ccc1F)CSCC(C)O 62a_100011218427_100012349856 [0,0,0,0,0,1|1,0,2]=4 2851 B15R1.4030 COc1cc(ccc1F)CSCC(C)O 62a_100012349856_100011218427 [0,0,0,0,0,1|1,0,2]=4 2852 B15R1.4030 COc1cc(ccc1F)CSC[C@@H](C)O 62a_100009817552_100012349856 [0,0,0,0,0,1|1,0,2]=4 2853 B15R1.4030 COc1cc(ccc1F)CSC[C@@H](C)O 62a_100012349856_100009817552 [0,0,0,0,0,1|1,0,2]=4 2854 B15R1.4030 COc1cc(ccc1F)CSC[N+](=O)[O-] 62a_100012349856_100000761209 [0,0,0,0,0,1|3,0,0]=4 2855 B15R1.4030 COc1cc(ccc1F)NCC=C(C)C 2230a_100000701188_100000761012 [0,0,0,0,0,1|2,0,1]=4 2856 B15R1.4030 COc1cc(ccc1F)NCC=C(C)C 34a_100000701188_100000761012 [0,0,0,0,0,1|2,0,1]=4 2857 B15R1.4030 COc1cc(ccc1F)NCCC(=O)N 2230a_100000701188_100000744528 [0,0,0,0,0,1|2,0,0]=3 2858 B15R1.4030 COc1cc(ccc1F)NCCC(=O)N 34a_100000701188_100000731001 [0,0,0,0,0,1|2,0,0]=3 2859 B15R1.4030 COc1cc(ccc1F)NCCC(C)C 2230a_100000701188_100000210312 [0,0,0,0,0,1|2,0,1]=4 2860 B15R1.4030 COc1cc(ccc1F)NCCC(C)C 34a_100000701188_100000210312 [0,0,0,0,0,1|2,0,1]=4 2861 B15R1.4030 COc1cc(ccc1F)NCCC(C)O 2230a_100000701188_100012276601 [0,0,0,0,0,1|1,0,2]=4 2862 B15R1.4030 COc1cc(ccc1F)NCCC(C)O 34a_100000701188_100012276601 [0,0,0,0,0,1|1,0,2]=4 2863 B15R1.4030 COc1cc(ccc1F)NCOC(=O)C 34a_100000701188_100009813279 [0,0,0,0,0,1|2,0,0]=3 2864 B15R1.4030 COc1cc(ccc1F)OCC=C(C)C 34a_100012001760_100000761012 [0,0,0,0,0,1|2,0,1]=4 2865 B15R1.4030 COc1cc(ccc1F)OCC=C(C)C 7a_100012001760_100000761012 [0,0,0,0,0,1|2,0,1]=4 2866 B15R1.4030 COc1cc(ccc1F)OCCC(=O)C 7a_100012001760_100000053229 [0,0,0,0,0,1|1,0,0]=2 2867 B15R1.4030 COc1cc(ccc1F)OCCC(=O)N 34a_100012001760_100000731001 [0,0,0,0,0,1|2,0,0]=3 2868 B15R1.4030 COc1cc(ccc1F)OCCC(=O)N 7a_100012001760_100000744528 [0,0,0,0,0,1|2,0,0]=3 2869 B15R1.4030 COc1cc(ccc1F)OCCC(C)C 34a_100012001760_100000210312 [0,0,0,0,0,1|2,0,1]=4 2870 B15R1.4030 COc1cc(ccc1F)OCCC(C)C 7a_100012001760_100000210626 [0,0,0,0,0,1|2,0,1]=4 2871 B15R1.4030 COc1cc(ccc1F)OCCC(C)O 34a_100012001760_100012276601 [0,0,0,0,0,1|1,0,2]=4 2872 B15R1.4030 COc1cc(ccc1F)OCCC(C)O 7a_100012001760_100012276601 [0,0,0,0,0,1|1,0,2]=4 2873 B15R1.4030 COc1cc(ccc1F)OCCN(C)C 7a_100012001760_100000755713 [0,0,0,0,0,1|3,0,0]=4 2874 B15R1.4030 COc1cc(ccc1F)OCOC(=O)C 34a_100012001760_100009813279 [0,0,0,0,0,1|2,0,0]=3 2875 B15R1.4030 COc1cc(ccc1F)SCC=C(C)C 62a_100000761012_100011934186 [0,0,0,0,0,1|2,0,1]=4 2876 B15R1.4030 COc1cc(ccc1F)SCC=C(C)C 62a_100011934186_100000761012 [0,0,0,0,0,1|2,0,1]=4 2877 B15R1.4030 COc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100011934186 [0,0,0,0,0,1|1,0,0]=2 2878 B15R1.4030 COc1cc(ccc1F)SCCC(=O)C 62a_100011934186_100000053229 [0,0,0,0,0,1|1,0,0]=2 2879 B15R1.4030 COc1cc(ccc1F)SCCC(=O)N 62a_100000744528_100011934186 [0,0,0,0,0,1|2,0,0]=3 2880 B15R1.4030 COc1cc(ccc1F)SCCC(=O)N 62a_100011934186_100000744528 [0,0,0,0,0,1|2,0,0]=3 2881 B15R1.4030 COc1cc(ccc1F)SCCC(C)C 62a_100000210312_100011934186 [0,0,0,0,0,1|2,0,1]=4 2882 B15R1.4030 COc1cc(ccc1F)SCCC(C)C 62a_100011934186_100000210312 [0,0,0,0,0,1|2,0,1]=4 2883 B15R1.4030 COc1cc(ccc1F)SCCC(C)O 62a_100011934186_100012276601 [0,0,0,0,0,1|1,0,2]=4 2884 B15R1.4030 COc1cc(ccc1F)SCCC(C)O 62a_100012276601_100011934186 [0,0,0,0,0,1|1,0,2]=4 2885 B15R1.4030 COc1cc(ccc1F)SCCN(C)C 62a_100011934186_100000755713 [0,0,0,0,0,1|3,0,0]=4 2886 B15R1.4030 COc1cc(ccc1F)SCOC(=O)C 62a_100000076356_100011934186 [0,0,0,0,0,1|2,0,0]=3 2887 B15R1.4030 COc1cc(ccc1F)SCOC(=O)C 62a_100011934186_100000076356 [0,0,0,0,0,1|2,0,0]=3 2888 B15R1.4030 COc1cc(ccc1I)NCC=C(C)C 34a_100000746945_100000761012 [0,0,0,0,0,1|2,0,1]=4 2889 B15R1.4030 COc1cc(ccc1I)NCCC(=O)N 34a_100000746945_100000731001 [0,0,0,0,0,1|2,0,0]=3 2890 B15R1.4030 COc1cc(ccc1I)NCCC(C)C 34a_100000746945_100000210312 [0,0,0,0,0,1|2,0,1]=4 2891 B15R1.4030 COc1cc(ccc1I)NCCC(C)O 34a_100000746945_100012276601 [0,0,0,0,0,1|1,0,2]=4 2892 B15R1.4030 COc1cc(ccc1I)NCOC(=O)C 34a_100000746945_100009813279 [0,0,0,0,0,1|2,0,0]=3 2893 B15R1.4030 COc1cc(ccc1N)COCC(=O)N 34a_100000087641_100000187820 [0,0,0,0,0,1|2,0,0]=3 2894 B15R1.4030 COc1cc(ccc1N)COCC(=O)[O-] 34a_100000087641_100020667443 [0,0,0,0,0,1|2,0,0]=3 2895 B15R1.4030 COc1cc(ccc1N)COCC(C)C 34a_100000087641_100000210624 [0,0,0,0,0,1|2,0,1]=4 2896 B15R1.4030 COc1cc(ccc1N)COCC(C)O 34a_100000087641_100011218427 [0,0,0,0,0,1|1,0,2]=4 2897 B15R1.4030 COc1cc(ccc1N)COC[C@@H](C)O 34a_100000087641_100009817552 [0,0,0,0,0,1|1,0,2]=4 2898 B15R1.4030 COc1cc(ccc1N)COC[N+](=O)[O-] 34a_100000087641_100000761209 [0,0,0,0,0,1|3,0,0]=4 2899 B15R1.4030 COc1cc(ccc1N)OCC=C(C)C 34a_100015326901_100000761012 [0,0,0,0,0,1|2,0,1]=4 2900 B15R1.4030 COc1cc(ccc1N)OCC=C(C)C 7a_100015326901_100000761012 [0,0,0,0,0,1|2,0,1]=4 2901 B15R1.4030 COc1cc(ccc1N)OCCC(=O)C 7a_100015326901_100000053229 [0,0,0,0,0,1|1,0,0]=2 2902 B15R1.4030 COc1cc(ccc1N)OCCC(=O)N 34a_100015326901_100000731001 [0,0,0,0,0,1|2,0,0]=3 2903 B15R1.4030 COc1cc(ccc1N)OCCC(=O)N 7a_100015326901_100000744528 [0,0,0,0,0,1|2,0,0]=3 2904 B15R1.4030 COc1cc(ccc1N)OCCC(C)C 34a_100015326901_100000210312 [0,0,0,0,0,1|2,0,1]=4 2905 B15R1.4030 COc1cc(ccc1N)OCCC(C)C 7a_100015326901_100000210626 [0,0,0,0,0,1|2,0,1]=4 2906 B15R1.4030 COc1cc(ccc1N)OCCC(C)O 34a_100015326901_100012276601 [0,0,0,0,0,1|1,0,2]=4 2907 B15R1.4030 COc1cc(ccc1N)OCCC(C)O 7a_100015326901_100012276601 [0,0,0,0,0,1|1,0,2]=4 2908 B15R1.4030 COc1cc(ccc1N)OCCN(C)C 7a_100015326901_100000755713 [0,0,0,0,0,1|3,0,0]=4 2909 B15R1.4030 COc1cc(ccc1N)OCOC(=O)C 34a_100015326901_100009813279 [0,0,0,0,0,1|2,0,0]=3 2910 B15R1.4030 COc1cc(ccc1N)SCC=C(C)C 62a_100000761012_100015196925 [0,0,0,0,0,1|2,0,1]=4 2911 B15R1.4030 COc1cc(ccc1N)SCC=C(C)C 62a_100011279103_100000761012 [0,0,0,0,0,1|2,0,1]=4 2912 B15R1.4030 COc1cc(ccc1N)SCCC(=O)C 62a_100000053229_100015196925 [0,0,0,0,0,1|1,0,0]=2 2913 B15R1.4030 COc1cc(ccc1N)SCCC(=O)C 62a_100011279103_100000053229 [0,0,0,0,0,1|1,0,0]=2 2914 B15R1.4030 COc1cc(ccc1N)SCCC(=O)N 62a_100000744528_100015196925 [0,0,0,0,0,1|2,0,0]=3 2915 B15R1.4030 COc1cc(ccc1N)SCCC(=O)N 62a_100011279103_100000744528 [0,0,0,0,0,1|2,0,0]=3 2916 B15R1.4030 COc1cc(ccc1N)SCCC(C)C 62a_100000210312_100015196925 [0,0,0,0,0,1|2,0,1]=4 2917 B15R1.4030 COc1cc(ccc1N)SCCC(C)C 62a_100011279103_100000210312 [0,0,0,0,0,1|2,0,1]=4 2918 B15R1.4030 COc1cc(ccc1N)SCCC(C)O 62a_100011279103_100012276601 [0,0,0,0,0,1|1,0,2]=4 2919 B15R1.4030 COc1cc(ccc1N)SCCC(C)O 62a_100012276601_100015196925 [0,0,0,0,0,1|1,0,2]=4 2920 B15R1.4030 COc1cc(ccc1N)SCCN(C)C 62a_100011279103_100000755713 [0,0,0,0,0,1|3,0,0]=4 2921 B15R1.4030 COc1cc(ccc1N)SCOC(=O)C 62a_100000076356_100015196925 [0,0,0,0,0,1|2,0,0]=3 2922 B15R1.4030 COc1cc(ccc1N)SCOC(=O)C 62a_100011279103_100000076356 [0,0,0,0,0,1|2,0,0]=3 2923 B15R1.4030 COc1cc(ccc1O)C=CCC(C)C 271570a_100016259101_100000694246 [0,0,0,0,0,1|1,0,2]=4 2924 B15R1.4030 COc1cc(ccc1O)C=NNC(=O)C 4a_100000189765_100000188322 [0,0,0,0,0,1|1,0,1]=3 2925 B15R1.4030 COc1cc(ccc1O)CCNC(=O)C 240690a_100000756042_100015343762 [0,0,0,0,0,1|0,0,0]=1 2926 B15R1.4030 COc1cc(ccc1O)CCNC(=O)C 527a_100000756042_100103153847 [0,0,0,0,0,1|0,0,0]=1 2927 B15R1.4030 COc1cc(ccc1O)CCNC(C)C 2230a_100138425928_100010741665 [0,0,0,0,0,1|1,0,1]=3 2928 B15R1.4030 COc1cc(ccc1O)CCNC(C)C 34a_100000756042_100000210206 [0,0,0,0,0,1|1,0,1]=3 2929 B15R1.4030 COc1cc(ccc1O)CCSC(C)C 62a_100000210206_100010741665 [0,0,0,0,0,1|1,0,1]=3 2930 B15R1.4030 COc1cc(ccc1O)CNCC(=O)N 34a_100000185554_100000187820 [0,0,0,0,0,1|1,0,0]=2 2931 B15R1.4030 COc1cc(ccc1O)CNCC(=O)[O-] 34a_100000185554_100020667443 [0,0,0,0,0,1|1,0,0]=2 2932 B15R1.4030 COc1cc(ccc1O)CNCC(C)C 34a_100000185554_100000210624 [0,0,0,0,0,1|1,0,1]=3 2933 B15R1.4030 COc1cc(ccc1O)CNCC(C)O 34a_100000185554_100011218427 [0,0,0,0,0,1|0,0,2]=3 2934 B15R1.4030 COc1cc(ccc1O)CNCC(F)F 34a_100000185554_100011934356 [0,0,0,0,0,1|2,0,1]=4 2935 B15R1.4030 COc1cc(ccc1O)CNC[C@@H](C)O 34a_100000185554_100009817552 [0,0,0,0,0,1|0,0,2]=3 2936 B15R1.4030 COc1cc(ccc1O)CNC[N+](=O)[O-] 34a_100000185554_100000761209 [0,0,0,0,0,1|2,0,0]=3 2937 B15R1.4030 COc1cc(ccc1O)NCC=C(C)C 34a_100000726020_100000761012 [0,0,0,0,0,1|1,0,1]=3 2938 B15R1.4030 COc1cc(ccc1O)NCCC(=O)N 34a_100000726020_100000731001 [0,0,0,0,0,1|1,0,0]=2 2939 B15R1.4030 COc1cc(ccc1O)NCCC(C)C 34a_100000726020_100000210312 [0,0,0,0,0,1|1,0,1]=3 2940 B15R1.4030 COc1cc(ccc1O)NCCC(C)O 34a_100000726020_100012276601 [0,0,0,0,0,1|0,0,2]=3 2941 B15R1.4030 COc1cc(ccc1O)NCOC(=O)C 34a_100000726020_100009813279 [0,0,0,0,0,1|1,0,0]=2 2942 B15R1.4030 COc1cc(ccc1O)NCOC(C)C 34a_100000726020_100000709892 [0,0,0,0,0,1|2,0,1]=4 2943 B15R1.4030 COc1cc(ccc1O)SCC=C(C)C 62a_100000761012_100000694246 [0,0,0,0,0,1|1,0,1]=3 2944 B15R1.4030 COc1cc(ccc1O)SCCC(=O)C 62a_100000053229_100000694246 [0,0,0,0,0,1|0,0,0]=1 2945 B15R1.4030 COc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000694246 [0,0,0,0,0,1|1,0,0]=2 2946 B15R1.4030 COc1cc(ccc1O)SCCC(C)C 62a_100000210312_100000694246 [0,0,0,0,0,1|1,0,1]=3 2947 B15R1.4030 COc1cc(ccc1O)SCCC(C)O 62a_100012276601_100000694246 [0,0,0,0,0,1|0,0,2]=3 2948 B15R1.4030 COc1cc(ccc1O)SCOC(=O)C 62a_100000076356_100000694246 [0,0,0,0,0,1|1,0,0]=2 2949 B15R1.4030 COc1cc(ccc1O)SCOC(C)C 62a_100000709892_100000694246 [0,0,0,0,0,1|2,0,1]=4 2950 B15R1.4030 COc1cc(cnc1C)SCCC(=O)C 62a_100000053229_100010254219 [0,0,0,0,0,1|2,0,0]=3 2951 B15R1.4030 COc1cc(cnc1C)SCCC(=O)C 62a_100010254219_100000053229 [0,0,0,0,0,1|2,0,0]=3 2952 B15R1.4030 COc1cc(cnc1C)SCCC(=O)N 62a_100000744528_100010254219 [0,0,0,0,0,1|3,0,0]=4 2953 B15R1.4030 COc1cc(cnc1C)SCCC(=O)N 62a_100010254219_100000744528 [0,0,0,0,0,1|3,0,0]=4 2954 B15R1.4030 COc1cc(cnc1C)SCOC(=O)C 62a_100000076356_100010254219 [0,0,0,0,0,1|3,0,0]=4 2955 B15R1.4030 COc1cc(cnc1C)SCOC(=O)C 62a_100010254219_100000076356 [0,0,0,0,0,1|3,0,0]=4 2956 B15R1.4030 COc1cc(cnc1F)SCCC(=O)C 62a_100000053229_100010214931 [0,0,0,0,0,1|2,0,0]=3 2957 B15R1.4030 COc1cc(cnc1F)SCCC(=O)C 62a_100010214931_100000053229 [0,0,0,0,0,1|2,0,0]=3 2958 B15R1.4030 COc1cc(cnc1F)SCCC(=O)N 62a_100000744528_100010214931 [0,0,0,0,0,1|3,0,0]=4 2959 B15R1.4030 COc1cc(cnc1F)SCCC(=O)N 62a_100010214931_100000744528 [0,0,0,0,0,1|3,0,0]=4 2960 B15R1.4030 COc1cc(cnc1F)SCOC(=O)C 62a_100000076356_100010214931 [0,0,0,0,0,1|3,0,0]=4 2961 B15R1.4030 COc1cc(cnc1F)SCOC(=O)C 62a_100010214931_100000076356 [0,0,0,0,0,1|3,0,0]=4 2962 B15R1.4030 COc1cc(cnc1N)SCCC(=O)C 62a_100000053229_106354213024 [0,0,0,0,0,1|2,0,0]=3 2963 B15R1.4030 COc1cc(cnc1N)SCCC(=O)C 62a_106354213024_100000053229 [0,0,0,0,0,1|2,0,0]=3 2964 B15R1.4030 COc1cc(cnc1N)SCCC(=O)N 62a_100000744528_106354213024 [0,0,0,0,0,1|3,0,0]=4 2965 B15R1.4030 COc1cc(cnc1N)SCCC(=O)N 62a_106354213024_100000744528 [0,0,0,0,0,1|3,0,0]=4 2966 B15R1.4030 COc1cc(cnc1N)SCOC(=O)C 62a_100000076356_106354213024 [0,0,0,0,0,1|3,0,0]=4 2967 B15R1.4030 COc1cc(cnc1N)SCOC(=O)C 62a_106354213024_100000076356 [0,0,0,0,0,1|3,0,0]=4 2968 B15R1.4030 COc1cc(ncc1Br)COCC(=O)N 34a_100010999569_100000187820 [0,0,0,0,0,1|3,0,0]=4 2969 B15R1.4030 COc1cc(ncc1Br)COCC(=O)[O-] 34a_100010999569_100020667443 [0,0,0,0,0,1|3,0,0]=4 2970 B15R1.4030 COc1cc(ncc1C)SCCC(=O)C 62a_100000053229_100010067687 [0,0,0,0,0,1|2,0,0]=3 2971 B15R1.4030 COc1cc(ncc1C)SCCC(=O)C 62a_100010067687_100000053229 [0,0,0,0,0,1|2,0,0]=3 2972 B15R1.4030 COc1cc(ncc1C)SCCC(=O)N 62a_100000744528_100010067687 [0,0,0,0,0,1|3,0,0]=4 2973 B15R1.4030 COc1cc(ncc1C)SCCC(=O)N 62a_100010067687_100000744528 [0,0,0,0,0,1|3,0,0]=4 2974 B15R1.4030 COc1cc(ncc1C)SCOC(=O)C 62a_100000076356_100010067687 [0,0,0,0,0,1|3,0,0]=4 2975 B15R1.4030 COc1cc(ncc1C)SCOC(=O)C 62a_100010067687_100000076356 [0,0,0,0,0,1|3,0,0]=4 2976 B15R1.4030 COc1cc(ncc1F)SCCC(=O)C 62a_100000053229_200010136270 [0,0,0,0,0,1|2,0,0]=3 2977 B15R1.4030 COc1cc(ncc1F)SCCC(=O)C 62a_200010136270_100000053229 [0,0,0,0,0,1|2,0,0]=3 2978 B15R1.4030 COc1cc(ncc1F)SCCC(=O)N 62a_100000744528_200010136270 [0,0,0,0,0,1|3,0,0]=4 2979 B15R1.4030 COc1cc(ncc1F)SCCC(=O)N 62a_200010136270_100000744528 [0,0,0,0,0,1|3,0,0]=4 2980 B15R1.4030 COc1cc(ncc1F)SCOC(=O)C 62a_100000076356_200010136270 [0,0,0,0,0,1|3,0,0]=4 2981 B15R1.4030 COc1cc(ncc1F)SCOC(=O)C 62a_200010136270_100000076356 [0,0,0,0,0,1|3,0,0]=4 2982 B15R1.4030 COc1cc(ncc1N)SCCC(=O)C 62a_100000053229_100009887741 [0,0,0,0,0,1|2,0,0]=3 2983 B15R1.4030 COc1cc(ncc1N)SCCC(=O)C 62a_100009887741_100000053229 [0,0,0,0,0,1|2,0,0]=3 2984 B15R1.4030 COc1cc(ncc1N)SCCC(=O)N 62a_100000744528_100009887741 [0,0,0,0,0,1|3,0,0]=4 2985 B15R1.4030 COc1cc(ncc1N)SCCC(=O)N 62a_100009887741_100000744528 [0,0,0,0,0,1|3,0,0]=4 2986 B15R1.4030 COc1cc(ncc1N)SCOC(=O)C 62a_100000076356_100009887741 [0,0,0,0,0,1|3,0,0]=4 2987 B15R1.4030 COc1cc(ncc1N)SCOC(=O)C 62a_100009887741_100000076356 [0,0,0,0,0,1|3,0,0]=4 2988 B15R1.4030 COc1cc(nnc1N)SCCC(=O)C 62a_100000053229_100000688033 [0,0,0,0,0,1|3,0,0]=4 2989 B15R1.4030 COc1cc(nnc1N)SCCC(=O)C 62a_100000688033_100000053229 [0,0,0,0,0,1|3,0,0]=4 2990 B15R1.4030 COc1nc(ccc1Br)CNCC(=O)N 2230a_100000711301_200010066506 [0,0,0,0,0,1|3,0,0]=4 2991 B15R1.4030 COc1nc(ccc1Br)CNCC(=O)O 269956a_100016091260_200010066506 [0,0,0,0,0,1|3,0,0]=4 2992 B15R1.4030 COc1nc(ccc1Br)COCC(=O)C 34a_100000211253_200010066506 [0,0,0,0,0,1|2,0,0]=3 2993 B15R1.4030 COc1nc(ccc1Br)CSCC(=O)N 62a_100000747473_200010066506 [0,0,0,0,0,1|3,0,0]=4 2994 B15R1.4030 COc1nc(ccc1Br)CSCC(=O)N 62a_200010066506_100000747473 [0,0,0,0,0,1|3,0,0]=4 2995 B15R1.4030 COc1nc(ccc1Br)CSCC(=O)[O-] 62a_100020667443_200010066506 [0,0,0,0,0,1|3,0,0]=4 2996 B15R1.4030 COc1nc(ccc1Br)CSCC(=O)[O-] 62a_200010066506_100020667443 [0,0,0,0,0,1|3,0,0]=4 2997 B15R1.4030 COc1nc(ccc1N)SCCC(=O)C 62a_100000053229_100000687816 [0,0,0,0,0,1|2,0,0]=3 2998 B15R1.4030 COc1nc(ccc1N)SCCC(=O)C 62a_100000687816_100000053229 [0,0,0,0,0,1|2,0,0]=3 2999 B15R1.4030 COc1nc(ccc1N)SCCC(=O)N 62a_100000687816_100000744528 [0,0,0,0,0,1|3,0,0]=4 3000 B15R1.4030 COc1nc(ccc1N)SCCC(=O)N 62a_100000744528_100000687816 [0,0,0,0,0,1|3,0,0]=4 3001 B15R1.4030 COc1nc(ccc1N)SCOC(=O)C 62a_100000076356_100000687816 [0,0,0,0,0,1|3,0,0]=4 3002 B15R1.4030 COc1nc(ccc1N)SCOC(=O)C 62a_100000687816_100000076356 [0,0,0,0,0,1|3,0,0]=4 3003 B15R1.4030 COc1nc(ccc1O)SCC=C(C)C 62a_100000761012_100010893133 [0,0,0,0,0,1|2,0,1]=4 3004 B15R1.4030 COc1nc(ccc1O)SCCC(=O)C 62a_100000053229_100010893133 [0,0,0,0,0,1|1,0,0]=2 3005 B15R1.4030 COc1nc(ccc1O)SCCC(=O)N 62a_100000744528_100010893133 [0,0,0,0,0,1|2,0,0]=3 3006 B15R1.4030 COc1nc(ccc1O)SCCC(C)C 62a_100000210312_100010893133 [0,0,0,0,0,1|2,0,1]=4 3007 B15R1.4030 COc1nc(ccc1O)SCCC(C)O 62a_100012276601_100010893133 [0,0,0,0,0,1|1,0,2]=4 3008 B15R1.4030 COc1nc(ccc1O)SCOC(=O)C 62a_100000076356_100010893133 [0,0,0,0,0,1|2,0,0]=3 3009 B15R1.4030 COc1nc(cnc1N)SCCC(=O)C 62a_100000053229_100009816943 [0,0,0,0,0,1|3,0,0]=4 3010 B15R1.4030 COc1nc(cnc1N)SCCC(=O)C 62a_100009816943_100000053229 [0,0,0,0,0,1|3,0,0]=4 3011 B15R1.4030 COc1nc(cnc1O)SCCC(=O)C 62a_100000053229_200010365344 [0,0,0,0,0,1|2,0,0]=3 3012 B15R1.4030 COc1nc(cnc1O)SCCC(=O)C 62a_200010365344_100000053229 [0,0,0,0,0,1|2,0,0]=3 3013 B15R1.4030 COc1nc(cnc1O)SCCC(=O)N 62a_100000744528_200010365344 [0,0,0,0,0,1|3,0,0]=4 3014 B15R1.4030 COc1nc(cnc1O)SCCC(=O)N 62a_200010365344_100000744528 [0,0,0,0,0,1|3,0,0]=4 3015 B15R1.4030 COc1nc(cnc1O)SCOC(=O)C 62a_100000076356_200010365344 [0,0,0,0,0,1|3,0,0]=4 3016 B15R1.4030 COc1nc(cnc1O)SCOC(=O)C 62a_200010365344_100000076356 [0,0,0,0,0,1|3,0,0]=4 3017 B15R1.4030 COc1nc(ncc1C)SCCC(=O)C 62a_100000053229_100012500371 [0,0,0,0,0,1|3,0,0]=4 3018 B15R1.4030 COc1nc(ncc1C)SCCC(=O)C 62a_100012500371_100000053229 [0,0,0,0,0,1|3,0,0]=4 3019 B15R1.4030 COc1nc(ncc1F)SCCC(=O)C 62a_100000053229_100012183945 [0,0,0,0,0,1|3,0,0]=4 3020 B15R1.4030 COc1nc(ncc1F)SCCC(=O)C 62a_100012183945_100000053229 [0,0,0,0,0,1|3,0,0]=4 3021 B15R1.4030 COc1nc(ncc1N)SCCC(=O)C 62a_100000053229_100012122185 [0,0,0,0,0,1|3,0,0]=4 3022 B15R1.4030 COc1nc(ncc1N)SCCC(=O)C 62a_100012122185_100000053229 [0,0,0,0,0,1|3,0,0]=4 3023 B15R1.4030 CSc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100010341305 [0,0,0,0,0,1|1,1,0]=3 3024 B15R1.4030 CSc1cc(ccc1F)SCCC(=O)C 62a_100010341305_100000053229 [0,0,0,0,0,1|1,1,0]=3 3025 B15R1.4030 CSc1cc(ccc1F)SCCC(=O)N 62a_100000744528_100010341305 [0,0,0,0,0,1|2,1,0]=4 3026 B15R1.4030 CSc1cc(ccc1F)SCCC(=O)N 62a_100010341305_100000744528 [0,0,0,0,0,1|2,1,0]=4 3027 B15R1.4030 CSc1cc(ccc1F)SCOC(=O)C 62a_100000076356_100010341305 [0,0,0,0,0,1|2,1,0]=4 3028 B15R1.4030 CSc1cc(ccc1F)SCOC(=O)C 62a_100010341305_100000076356 [0,0,0,0,0,1|2,1,0]=4 3029 B15R1.4030 N#Cc1cc(ccc1O)NCCC(=O)N 34a_100011249283_100000731001 [0,0,0,0,0,1|3,0,0]=4 3030 B15R1.4030 N#Cc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000687585 [0,0,0,0,0,1|3,0,0]=4 3031 B15R1.4030 NC(=O)CCSc1ccc(c(c1)C=O)O 62a_100000744528_100000186750 [0,0,0,0,0,1|3,0,0]=4 3032 B15R1.4030 NC(=O)CCSc1ccc(c(c1)CO)O 62a_100000184703_100000744528 [0,0,0,0,0,1|3,0,0]=4 3033 B15R1.4030 NC(=O)CCSc1ccc(c(c1)CO)O 62a_100000744528_100000184703 [0,0,0,0,0,1|3,0,0]=4 3034 B15R1.4030 NC(=O)CSCc1ccc(c(c1)C=O)O 62a_100000747473_100000008128 [0,0,0,0,0,1|3,0,0]=4 3035 B15R1.4030 NCc1cc(ccc1O)SCCC(=O)N 62a_100000730032_100000744528 [0,0,0,0,0,1|3,0,0]=4 3036 B15R1.4030 NCc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000730032 [0,0,0,0,0,1|3,0,0]=4 3037 B15R1.4030 O=Cc1cc(ccc1O)CNCC(=O)O 269956a_100016091260_100000008128 [0,0,0,0,0,1|3,0,0]=4 3038 B15R1.4030 O=Cc1cc(ccc1O)CSCC(=O)[O-] 62a_100020667443_100000008128 [0,0,0,0,0,1|3,0,0]=4 3039 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [2,0,0,0,0,0|2,0,0]=4 3040 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [2,0,0,0,0,0|2,0,0]=4 3041 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [2,0,0,0,0,0|0,0,2]=4 3042 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [2,0,0,0,0,0|1,0,0]=3 3043 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [2,0,0,0,0,0|1,0,0]=3 3044 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [2,0,0,0,0,0|1,0,0]=3 3045 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [2,0,0,0,0,0|1,0,0]=3 3046 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [2,0,0,0,0,0|1,0,0]=3 3047 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [2,0,0,0,0,0|1,0,0]=3 3048 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [2,0,0,0,0,0|1,0,0]=3 3049 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [2,0,0,0,0,0|1,0,0]=3 3050 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [2,0,0,0,0,0|1,0,0]=3 3051 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [2,0,0,0,0,0|0,0,0]=2 3052 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [2,0,0,0,0,0|0,0,0]=2 3053 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [2,0,0,0,0,0|0,0,0]=2 3054 B12R1.21 CC(=O)COc1ccc(cc1)Br 1458a_100000182358_200000210301 [2,0,0,0,0,0|2,0,0]=4 3055 B12R1.21 CC(=O)COc1ccc(cc1)C 1458a_100000182360_200000210301 [2,0,0,0,0,0|2,0,0]=4 3056 B12R1.21 CC(=O)COc1ccc(cc1)Cl 1458a_100016990877_200000210301 [2,0,0,0,0,0|2,0,0]=4 3057 B12R1.21 CC(=O)COc1ccc(cc1)F 1458a_100000184765_200000210301 [2,0,0,0,0,0|2,0,0]=4 3058 B12R1.21 CC(=O)COc1ccc(cc1)I 1458a_100000184369_200000210301 [2,0,0,0,0,0|2,0,0]=4 3059 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [2,0,0,0,0,0|1,0,0]=3 3060 B12R1.21 CC(=O)CSc1ccc(cc1)Br 1458a_100000179496_200000210301 [2,0,0,0,0,0|2,0,0]=4 3061 B12R1.21 CC(=O)CSc1ccc(cc1)C 1458a_100000179497_200000210301 [2,0,0,0,0,0|2,0,0]=4 3062 B12R1.21 CC(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200000210301 [2,0,0,0,0,0|2,0,0]=4 3063 B12R1.21 CC(=O)CSc1ccc(cc1)F 1458a_100000691584_200000210301 [2,0,0,0,0,0|2,0,0]=4 3064 B12R1.21 CC(=O)NCc1ccc(cc1)Br 11a_100000174875_100015343762 [2,0,0,0,0,0|2,0,0]=4 3065 B12R1.21 CC(=O)NCc1ccc(cc1)Br 1626a_100000174875_100015343762 [2,0,0,0,0,0|2,0,0]=4 3066 B12R1.21 CC(=O)NCc1ccc(cc1)Br 240690a_100000174875_100015343762 [2,0,0,0,0,0|2,0,0]=4 3067 B12R1.21 CC(=O)NCc1ccc(cc1)Br 527a_100000174875_100103153847 [2,0,0,0,0,0|2,0,0]=4 3068 B12R1.21 CC(=O)NCc1ccc(cc1)C 11a_100000174908_100015343762 [2,0,0,0,0,0|2,0,0]=4 3069 B12R1.21 CC(=O)NCc1ccc(cc1)C 1626a_100000174908_100015343762 [2,0,0,0,0,0|2,0,0]=4 3070 B12R1.21 CC(=O)NCc1ccc(cc1)C 240690a_100000174908_100015343762 [2,0,0,0,0,0|2,0,0]=4 3071 B12R1.21 CC(=O)NCc1ccc(cc1)C 527a_100000174908_100103153847 [2,0,0,0,0,0|2,0,0]=4 3072 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 11a_100000174871_100015343762 [2,0,0,0,0,0|2,0,0]=4 3073 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 1626a_100000174871_100015343762 [2,0,0,0,0,0|2,0,0]=4 3074 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 240690a_100000174871_100015343762 [2,0,0,0,0,0|2,0,0]=4 3075 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 527a_100000174871_100103153847 [2,0,0,0,0,0|2,0,0]=4 3076 B12R1.21 CC(=O)NCc1ccc(cc1)F 11a_100000174882_100015343762 [2,0,0,0,0,0|2,0,0]=4 3077 B12R1.21 CC(=O)NCc1ccc(cc1)F 1626a_100000174882_100015343762 [2,0,0,0,0,0|2,0,0]=4 3078 B12R1.21 CC(=O)NCc1ccc(cc1)F 240690a_100000174882_100015343762 [2,0,0,0,0,0|2,0,0]=4 3079 B12R1.21 CC(=O)NCc1ccc(cc1)F 527a_100000174882_100103153847 [2,0,0,0,0,0|2,0,0]=4 3080 B12R1.21 CC(=O)NCc1ccc(cc1)I 11a_100016989417_100015343762 [2,0,0,0,0,0|2,0,0]=4 3081 B12R1.21 CC(=O)NCc1ccc(cc1)I 1626a_100016989417_100015343762 [2,0,0,0,0,0|2,0,0]=4 3082 B12R1.21 CC(=O)NCc1ccc(cc1)I 240690a_100016989417_100015343762 [2,0,0,0,0,0|2,0,0]=4 3083 B12R1.21 CC(=O)NCc1ccc(cc1)I 527a_100016989417_100103153847 [2,0,0,0,0,0|2,0,0]=4 3084 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [2,0,0,0,0,0|1,0,0]=3 3085 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [2,0,0,0,0,0|1,0,0]=3 3086 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [2,0,0,0,0,0|1,0,0]=3 3087 B12R1.21 CC(=O)NCc1ccc(cn1)O 240690a_100020605196_100015343762 [2,0,0,0,0,0|2,0,0]=4 3088 B12R1.21 CC(=O)NCc1ccc(nc1)O 11a_100000757128_100015343762 [2,0,0,0,0,0|2,0,0]=4 3089 B12R1.21 CC(=O)NCc1ccc(nc1)O 240690a_100000757128_100015343762 [2,0,0,0,0,0|2,0,0]=4 3090 B12R1.21 CC(=O)NNc1ccc(cc1)O 271570a_203496583355_200009815283 [2,0,0,0,0,0|2,0,0]=4 3091 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [2,0,0,0,0,0|2,0,0]=4 3092 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [2,0,0,0,0,0|2,0,0]=4 3093 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [2,0,0,0,0,0|2,0,0]=4 3094 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [2,0,0,0,0,0|2,0,0]=4 3095 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [2,0,0,0,0,0|2,0,0]=4 3096 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [2,0,0,0,0,0|2,0,0]=4 3097 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [2,0,0,0,0,0|2,0,0]=4 3098 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [2,0,0,0,0,0|2,0,0]=4 3099 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [2,0,0,0,0,0|1,0,0]=3 3100 B12R1.21 Cc1ccc(cc1)OCC(=O)[13CH3] 1458a_100000182360_200025704644 [2,0,0,0,0,0|2,0,0]=4 3101 B12R1.21 Cc1ccc(cc1)SCC(=O)[13CH3] 1458a_100000179497_200025704644 [2,0,0,0,0,0|2,0,0]=4 3102 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [2,0,0,0,0,0|1,0,0]=3 3103 B12R1.21 NC(=O)CNc1ccc(cc1)O 34a_100000185829_100000187820 [2,0,0,0,0,0|2,0,0]=4 3104 B12R1.21 NC(=O)CSc1ccc(cc1)O 271570a_203496583355_100000149456 [2,0,0,0,0,0|2,0,0]=4 3105 B12R1.21 NC(=O)CSc1ccc(cc1)O 62a_100000747473_100000185759 [2,0,0,0,0,0|2,0,0]=4 3106 B12R1.21 O=C([O-])CNc1ccc(cc1)O 34a_100000185829_100020667443 [2,0,0,0,0,0|2,0,0]=4 3107 B12R1.21 O=C([O-])CSc1ccc(cc1)O 62a_100020667443_100000185759 [2,0,0,0,0,0|2,0,0]=4 3108 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [2,0,0,0,0,0|1,0,0]=3 3109 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [2,0,0,0,0,0|1,0,0]=3 3110 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [2,0,0,0,0,0|1,0,0]=3 3111 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [2,0,0,0,0,0|1,0,0]=3 3112 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [2,0,0,0,0,0|0,0,0]=2 3113 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Br 1458a_100000182358_200025704644 [2,0,0,0,0,0|2,0,0]=4 3114 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)Cl 1458a_100016990877_200025704644 [2,0,0,0,0,0|2,0,0]=4 3115 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)F 1458a_100000184765_200025704644 [2,0,0,0,0,0|2,0,0]=4 3116 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)I 1458a_100000184369_200025704644 [2,0,0,0,0,0|2,0,0]=4 3117 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [2,0,0,0,0,0|1,0,0]=3 3118 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Br 1458a_100000179496_200025704644 [2,0,0,0,0,0|2,0,0]=4 3119 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)Cl 1458a_100000178402_200025704644 [2,0,0,0,0,0|2,0,0]=4 3120 B12R1.21 [13CH3]C(=O)CSc1ccc(cc1)F 1458a_100000691584_200025704644 [2,0,0,0,0,0|2,0,0]=4 3121 B12R1.226 C=C(C)CNc1cccc(c1)C 2230a_100000188690_100000748629 [2,0,0,0,0,0|2,0,0]=4 3122 B12R1.226 C=C(C)CNc1cccc(c1)C 34a_100000188690_100000748629 [2,0,0,0,0,0|2,0,0]=4 3123 B12R1.226 C=C(C)CNc1cccc(c1)O 34a_100000210217_100000748629 [2,0,0,0,0,0|2,0,0]=4 3124 B12R1.226 C=C(C)COc1cccc(c1)C 34a_100000210337_100000748629 [2,0,0,0,0,0|2,0,0]=4 3125 B12R1.226 C=C(C)COc1cccc(c1)C 7a_100000210337_100000748629 [2,0,0,0,0,0|2,0,0]=4 3126 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100000748629_100011215228 [2,0,0,0,0,0|2,0,0]=4 3127 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100011215228_100000211660 [2,0,0,0,0,0|2,0,0]=4 3128 B12R1.226 C=C(C)CSc1cccc(c1)O 62a_100000748629_100000211634 [2,0,0,0,0,0|2,0,0]=4 3129 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [2,0,0,0,0,0|0,0,2]=4 3130 B12R1.226 CC(=O)C#Cc1cccc(c1)C 1458a_100011892726_200000210301 [2,0,0,0,0,0|0,0,2]=4 3131 B12R1.226 CC(=O)C#Cc1cccc(c1)O 1458a_200009909484_200000210301 [2,0,0,0,0,0|0,0,2]=4 3132 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [2,0,0,0,0,0|0,0,2]=4 3133 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [2,0,0,0,0,0|1,0,0]=3 3134 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [2,0,0,0,0,0|1,0,0]=3 3135 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [2,0,0,0,0,0|0,0,0]=2 3136 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [2,0,0,0,0,0|0,0,0]=2 3137 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [2,0,0,0,0,0|1,0,0]=3 3138 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [2,0,0,0,0,0|1,0,0]=3 3139 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [2,0,0,0,0,0|1,0,0]=3 3140 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [2,0,0,0,0,0|1,0,0]=3 3141 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [2,0,0,0,0,0|1,0,0]=3 3142 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [2,0,0,0,0,0|0,0,0]=2 3143 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [2,0,0,0,0,0|0,0,0]=2 3144 B12R1.226 CC(=O)COc1cccc(c1)Br 1458a_100000182359_200000210301 [2,0,0,0,0,0|2,0,0]=4 3145 B12R1.226 CC(=O)COc1cccc(c1)C 1458a_100000183606_200000210301 [2,0,0,0,0,0|1,0,0]=3 3146 B12R1.226 CC(=O)COc1cccc(c1)Cl 1458a_100000184978_200000210301 [2,0,0,0,0,0|2,0,0]=4 3147 B12R1.226 CC(=O)COc1cccc(c1)F 1458a_100000182781_200000210301 [2,0,0,0,0,0|2,0,0]=4 3148 B12R1.226 CC(=O)CSc1cccc(c1)Br 1458a_100000760868_200000210301 [2,0,0,0,0,0|2,0,0]=4 3149 B12R1.226 CC(=O)NCc1cc(ccn1)C 11a_100011934573_100015343762 [2,0,0,0,0,0|2,0,0]=4 3150 B12R1.226 CC(=O)NCc1cc(ccn1)C 1626a_100011934573_100015343762 [2,0,0,0,0,0|2,0,0]=4 3151 B12R1.226 CC(=O)NCc1cc(ccn1)C 240690a_100011934573_100015343762 [2,0,0,0,0,0|2,0,0]=4 3152 B12R1.226 CC(=O)NCc1cc(ccn1)C 527a_100011934573_100103153847 [2,0,0,0,0,0|2,0,0]=4 3153 B12R1.226 CC(=O)NCc1cccc(c1)Br 11a_100000174977_100015343762 [2,0,0,0,0,0|2,0,0]=4 3154 B12R1.226 CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100015343762 [2,0,0,0,0,0|2,0,0]=4 3155 B12R1.226 CC(=O)NCc1cccc(c1)Br 240690a_100000174977_100015343762 [2,0,0,0,0,0|2,0,0]=4 3156 B12R1.226 CC(=O)NCc1cccc(c1)Br 527a_100000174977_100103153847 [2,0,0,0,0,0|2,0,0]=4 3157 B12R1.226 CC(=O)NCc1cccc(c1)C 11a_100000185548_100015343762 [2,0,0,0,0,0|1,0,0]=3 3158 B12R1.226 CC(=O)NCc1cccc(c1)C 1626a_100000185548_100015343762 [2,0,0,0,0,0|1,0,0]=3 3159 B12R1.226 CC(=O)NCc1cccc(c1)C 240690a_100000185548_100015343762 [2,0,0,0,0,0|1,0,0]=3 3160 B12R1.226 CC(=O)NCc1cccc(c1)C 527a_100000185548_100103153847 [2,0,0,0,0,0|1,0,0]=3 3161 B12R1.226 CC(=O)NCc1cccc(c1)Cl 11a_100000174878_100015343762 [2,0,0,0,0,0|2,0,0]=4 3162 B12R1.226 CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100015343762 [2,0,0,0,0,0|2,0,0]=4 3163 B12R1.226 CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100015343762 [2,0,0,0,0,0|2,0,0]=4 3164 B12R1.226 CC(=O)NCc1cccc(c1)Cl 527a_100000174878_100103153847 [2,0,0,0,0,0|2,0,0]=4 3165 B12R1.226 CC(=O)NCc1cccc(c1)F 11a_100000174948_100015343762 [2,0,0,0,0,0|2,0,0]=4 3166 B12R1.226 CC(=O)NCc1cccc(c1)F 1626a_100000174948_100015343762 [2,0,0,0,0,0|2,0,0]=4 3167 B12R1.226 CC(=O)NCc1cccc(c1)F 240690a_100000174948_100015343762 [2,0,0,0,0,0|2,0,0]=4 3168 B12R1.226 CC(=O)NCc1cccc(c1)F 527a_100000174948_100103153847 [2,0,0,0,0,0|2,0,0]=4 3169 B12R1.226 CC(=O)NCc1cccc(c1)I 11a_100000106179_100015343762 [2,0,0,0,0,0|2,0,0]=4 3170 B12R1.226 CC(=O)NCc1cccc(c1)I 1626a_100000106179_100015343762 [2,0,0,0,0,0|2,0,0]=4 3171 B12R1.226 CC(=O)NCc1cccc(c1)I 240690a_100000106179_100015343762 [2,0,0,0,0,0|2,0,0]=4 3172 B12R1.226 CC(=O)NCc1cccc(c1)I 527a_100000106179_100103153847 [2,0,0,0,0,0|2,0,0]=4 3173 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [2,0,0,0,0,0|1,0,0]=3 3174 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [2,0,0,0,0,0|1,0,0]=3 3175 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [2,0,0,0,0,0|1,0,0]=3 3176 B12R1.226 CC(=O)NCc1cccc(n1)C 11a_100000701342_100015343762 [2,0,0,0,0,0|2,0,0]=4 3177 B12R1.226 CC(=O)NCc1cccc(n1)C 1626a_100000701342_100015343762 [2,0,0,0,0,0|2,0,0]=4 3178 B12R1.226 CC(=O)NCc1cccc(n1)C 240690a_100000701342_100015343762 [2,0,0,0,0,0|2,0,0]=4 3179 B12R1.226 CC(=O)NCc1cccc(n1)C 527a_100000701342_100103153847 [2,0,0,0,0,0|2,0,0]=4 3180 B12R1.226 CC(=O)NCc1ccnc(c1)C 11a_100011934566_100015343762 [2,0,0,0,0,0|2,0,0]=4 3181 B12R1.226 CC(=O)NCc1ccnc(c1)C 1626a_100011934566_100015343762 [2,0,0,0,0,0|2,0,0]=4 3182 B12R1.226 CC(=O)NCc1ccnc(c1)C 240690a_100011934566_100015343762 [2,0,0,0,0,0|2,0,0]=4 3183 B12R1.226 CC(=O)NCc1ccnc(c1)C 527a_100011934566_100103153847 [2,0,0,0,0,0|2,0,0]=4 3184 B12R1.226 CC(=O)NCc1ccnc(c1)O 11a_100000748557_100015343762 [2,0,0,0,0,0|2,0,0]=4 3185 B12R1.226 CC(=O)NCc1ccnc(c1)O 240690a_100000748557_100015343762 [2,0,0,0,0,0|2,0,0]=4 3186 B12R1.226 CC(=O)NCc1ccnc(c1)O 527a_100000748557_100103153847 [2,0,0,0,0,0|2,0,0]=4 3187 B12R1.226 CC(=O)NCc1cncc(c1)C 11a_100000692839_100015343762 [2,0,0,0,0,0|2,0,0]=4 3188 B12R1.226 CC(=O)NCc1cncc(c1)C 1626a_100000692839_100015343762 [2,0,0,0,0,0|2,0,0]=4 3189 B12R1.226 CC(=O)NCc1cncc(c1)C 240690a_100000692839_100015343762 [2,0,0,0,0,0|2,0,0]=4 3190 B12R1.226 CC(=O)NCc1cncc(c1)C 527a_100000692839_100103153847 [2,0,0,0,0,0|2,0,0]=4 3191 B12R1.226 CC(=O)NNc1cccc(c1)C 22a_100000681630_100000070787 [2,0,0,0,0,0|2,0,0]=4 3192 B12R1.226 Cc1cccc(c1)C#CC(=O)[13CH3] 1458a_100011892726_200025704644 [2,0,0,0,0,0|0,0,2]=4 3193 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [2,0,0,0,0,0|0,0,2]=4 3194 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [2,0,0,0,0,0|0,0,0]=2 3195 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_100102631434_100011713685 [2,0,0,0,0,0|2,0,0]=4 3196 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_114849113767_200000210301 [2,0,0,0,0,0|2,0,0]=4 3197 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_100102631434_100011713685 [2,0,0,0,0,0|2,0,0]=4 3198 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_114849113767_200000210301 [2,0,0,0,0,0|2,0,0]=4 3199 B12R1.226 Cc1cccc(c1)CCN(C)C 34a_114849113767_200000210301 [2,0,0,0,0,0|2,0,0]=4 3200 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 2230a_114849113767_200025704644 [2,0,0,0,0,0|2,0,0]=4 3201 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 269982a_114849113767_200025704644 [2,0,0,0,0,0|2,0,0]=4 3202 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 34a_114849113767_200025704644 [2,0,0,0,0,0|2,0,0]=4 3203 B12R1.226 Cc1cccc(c1)NCC(=O)N 2230a_100000188690_100000747473 [2,0,0,0,0,0|2,0,0]=4 3204 B12R1.226 Cc1cccc(c1)NCC(=O)N 34a_100000188690_100000187820 [2,0,0,0,0,0|2,0,0]=4 3205 B12R1.226 Cc1cccc(c1)NCC(=O)[O-] 34a_100000188690_100020667443 [2,0,0,0,0,0|2,0,0]=4 3206 B12R1.226 Cc1cccc(c1)OCC(=O)N 34a_100000210337_100000187820 [2,0,0,0,0,0|2,0,0]=4 3207 B12R1.226 Cc1cccc(c1)OCC(=O)N 7a_100000210337_100000187820 [2,0,0,0,0,0|2,0,0]=4 3208 B12R1.226 Cc1cccc(c1)OCC(=O)[13CH3] 1458a_100000183606_200025704644 [2,0,0,0,0,0|1,0,0]=3 3209 B12R1.226 Cc1cccc(c1)OCC(=O)[O-] 34a_100000210337_100020667443 [2,0,0,0,0,0|2,0,0]=4 3210 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100000747473_100011215228 [2,0,0,0,0,0|2,0,0]=4 3211 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100011215228_100000747473 [2,0,0,0,0,0|2,0,0]=4 3212 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100011215228_100020667443 [2,0,0,0,0,0|2,0,0]=4 3213 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011215228 [2,0,0,0,0,0|2,0,0]=4 3214 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [2,0,0,0,0,0|1,0,0]=3 3215 B12R1.226 NC(=O)CNc1cccc(c1)O 34a_100000210217_100000187820 [2,0,0,0,0,0|2,0,0]=4 3216 B12R1.226 NC(=O)COc1cccc(c1)O 271570a_203496583355_200000150604 [2,0,0,0,0,0|2,0,0]=4 3217 B12R1.226 NC(=O)CSc1cccc(c1)O 62a_100000747473_100000211634 [2,0,0,0,0,0|2,0,0]=4 3218 B12R1.226 O=C([O-])CNc1cccc(c1)O 34a_100000210217_100020667443 [2,0,0,0,0,0|2,0,0]=4 3219 B12R1.226 O=C([O-])CSc1cccc(c1)O 62a_100020667443_100000211634 [2,0,0,0,0,0|2,0,0]=4 3220 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)O 1458a_200009909484_200025704644 [2,0,0,0,0,0|0,0,2]=4 3221 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [2,0,0,0,0,0|1,0,0]=3 3222 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [2,0,0,0,0,0|1,0,0]=3 3223 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [2,0,0,0,0,0|1,0,0]=3 3224 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [2,0,0,0,0,0|1,0,0]=3 3225 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [2,0,0,0,0,0|0,0,0]=2 3226 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Br 1458a_100000182359_200025704644 [2,0,0,0,0,0|2,0,0]=4 3227 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Cl 1458a_100000184978_200025704644 [2,0,0,0,0,0|2,0,0]=4 3228 B12R1.226 [13CH3]C(=O)COc1cccc(c1)F 1458a_100000182781_200025704644 [2,0,0,0,0,0|2,0,0]=4 3229 B12R1.226 [13CH3]C(=O)CSc1cccc(c1)Br 1458a_100000760868_200025704644 [2,0,0,0,0,0|2,0,0]=4 3230 B12R1.385 C=CCNc1ccc(c(c1)C)O 34a_100011218179_100015514636 [2,0,0,0,0,0|1,0,1]=4 3231 B12R1.385 C=CCNc1ccc(c(c1)C)O 7a_100011218179_100015514636 [2,0,0,0,0,0|1,0,1]=4 3232 B12R1.385 C=CCNc1ccc(c(c1)O)O 34a_100102946323_100015514636 [2,0,0,0,0,0|1,0,1]=4 3233 B12R1.385 C=CCSc1ccc(c(c1)C)O 62a_100000210623_100000186361 [2,0,0,0,0,0|1,0,1]=4 3234 B12R1.385 C=CCSc1ccc(c(c1)O)O 62a_100000210623_100009813601 [2,0,0,0,0,0|1,0,1]=4 3235 B12R1.385 CCCCc1cc(c(cn1)O)C 271570a_100020621405_100000692680 [2,0,0,0,0,0|1,0,1]=4 3236 B12R1.385 CCCCc1ccc(c(c1)Br)O 271570a_100020621405_100012361655 [2,0,0,0,0,0|1,0,1]=4 3237 B12R1.385 CCCCc1ccc(c(c1)C)Br 271570a_100020621405_100009813585 [2,0,0,0,0,0|1,0,1]=4 3238 B12R1.385 CCCCc1ccc(c(c1)C)C 271570a_100020621405_100011215607 [2,0,0,0,0,0|1,0,1]=4 3239 B12R1.385 CCCCc1ccc(c(c1)C)Cl 271570a_100020621405_100000049509 [2,0,0,0,0,0|1,0,1]=4 3240 B12R1.385 CCCCc1ccc(c(c1)C)F 271570a_100020621405_100011218330 [2,0,0,0,0,0|1,0,1]=4 3241 B12R1.385 CCCCc1ccc(c(c1)C)N 271570a_100020621405_100000211769 [2,0,0,0,0,0|1,0,1]=4 3242 B12R1.385 CCCCc1ccc(c(c1)C)O 271570a_100020621405_100000186361 [2,0,0,0,0,0|0,0,1]=3 3243 B12R1.385 CCCCc1ccc(c(c1)Cl)O 271570a_100020621405_100012360047 [2,0,0,0,0,0|1,0,1]=4 3244 B12R1.385 CCCCc1ccc(c(c1)F)O 271570a_100020621405_100000185481 [2,0,0,0,0,0|1,0,1]=4 3245 B12R1.385 CCCCc1ccc(c(c1)N)O 271570a_100020621405_100000752626 [2,0,0,0,0,0|1,0,1]=4 3246 B12R1.385 CCCCc1ccc(c(c1)O)Br 271570a_100020621405_100012356990 [2,0,0,0,0,0|1,0,1]=4 3247 B12R1.385 CCCCc1ccc(c(c1)O)C 271570a_100020621405_100000766334 [2,0,0,0,0,0|1,0,1]=4 3248 B12R1.385 CCCCc1ccc(c(c1)O)Cl 271570a_100020621405_100011356854 [2,0,0,0,0,0|1,0,1]=4 3249 B12R1.385 CCCCc1ccc(c(c1)O)F 271570a_100020621405_100000686035 [2,0,0,0,0,0|1,0,1]=4 3250 B12R1.385 CCCCc1ccc(c(c1)O)N 271570a_100020621405_100000739049 [2,0,0,0,0,0|1,0,1]=4 3251 B12R1.385 CCCCc1ccc(c(c1)O)O 271570a_100020621405_100009813601 [2,0,0,0,0,0|0,0,1]=3 3252 B12R1.385 CCCCc1ccc(c(n1)C)O 271570a_100020621405_100010233687 [2,0,0,0,0,0|1,0,1]=4 3253 B12R1.385 CCCCc1cnc(c(c1)C)O 271570a_100020621405_100000685391 [2,0,0,0,0,0|1,0,1]=4 3254 B12R1.385 CCCNc1ccc(c(c1)C)O 34a_100011218179_100000210303 [2,0,0,0,0,0|1,0,1]=4 3255 B12R1.385 CCCNc1ccc(c(c1)C)O 7a_100011218179_100000210303 [2,0,0,0,0,0|1,0,1]=4 3256 B12R1.385 CCCNc1ccc(c(c1)O)O 34a_100102946323_100000210303 [2,0,0,0,0,0|1,0,1]=4 3257 B12R1.385 CCCOc1ccc(c(c1)C)O 271570a_203496583355_200012361509 [2,0,0,0,0,0|1,0,1]=4 3258 B12R1.385 CCCSc1ccc(c(c1)C)O 62a_100000210303_100000186361 [2,0,0,0,0,0|1,0,1]=4 3259 B12R1.385 CCCSc1ccc(c(c1)O)O 62a_100000210303_100009813601 [2,0,0,0,0,0|1,0,1]=4 3260 B12R1.385 CCNCc1ccc(c(c1)O)O 34a_100000010075_100000210202 [2,0,0,0,0,0|1,0,1]=4 3261 B12R1.385 CNCCc1ccc(c(c1)C)C 2230a_100020591374_200000210301 [2,0,0,0,0,0|2,0,0]=4 3262 B12R1.385 CNCCc1ccc(c(c1)C)C 34a_100020591374_200000210301 [2,0,0,0,0,0|2,0,0]=4 3263 B12R1.385 CNCCc1ccc(c(c1)O)O 34a_100000210387_200000210301 [2,0,0,0,0,0|1,0,0]=3 3264 B12R1.385 CNCCc1ccc(c(c1)O)O 7a_106832991635_200010393615 [2,0,0,0,0,0|1,0,0]=3 3265 B12R1.385 COCSc1ccc(c(c1)C)O 62a_100000766300_100000186361 [2,0,0,0,0,0|2,0,0]=4 3266 B12R1.385 COCSc1ccc(c(c1)O)O 62a_100000766300_100009813601 [2,0,0,0,0,0|2,0,0]=4 3267 B12R1.385 CSCCc1ccc(c(c1)O)O 62a_200000210301_200010393615 [2,0,0,0,0,0|1,0,0]=3 3268 B12R1.385 CSCNc1ccc(c(c1)C)O 34a_100011218179_100011218213 [2,0,0,0,0,0|2,0,0]=4 3269 B12R1.385 CSCNc1ccc(c(c1)O)O 34a_100102946323_100011218213 [2,0,0,0,0,0|2,0,0]=4 3270 B12R1.385 CSCSc1ccc(c(c1)C)O 62a_100011218213_100000186361 [2,0,0,0,0,0|2,0,0]=4 3271 B12R1.385 CSCSc1ccc(c(c1)O)O 62a_100011218213_100009813601 [2,0,0,0,0,0|2,0,0]=4 3272 B12R1.385 Cc1cc(ccc1Br)NCC=O 2230a_100000210723_200015260668 [2,0,0,0,0,0|2,0,0]=4 3273 B12R1.385 Cc1cc(ccc1Br)NCC=O 34a_100000210723_200009817547 [2,0,0,0,0,0|2,0,0]=4 3274 B12R1.385 Cc1cc(ccc1Br)NCC=O 7a_100000210723_200015260668 [2,0,0,0,0,0|2,0,0]=4 3275 B12R1.385 Cc1cc(ccc1Br)OCC=O 34a_100000690111_200009817547 [2,0,0,0,0,0|2,0,0]=4 3276 B12R1.385 Cc1cc(ccc1Br)OCC=O 7a_100000690111_200015260668 [2,0,0,0,0,0|2,0,0]=4 3277 B12R1.385 Cc1cc(ccc1Br)SCC=O 62a_100009813585_200015260668 [2,0,0,0,0,0|2,0,0]=4 3278 B12R1.385 Cc1cc(ccc1Br)SCC=O 62a_200015260668_100009813585 [2,0,0,0,0,0|2,0,0]=4 3279 B12R1.385 Cc1cc(ccc1Cl)NCC=O 2230a_100000187808_200015260668 [2,0,0,0,0,0|2,0,0]=4 3280 B12R1.385 Cc1cc(ccc1Cl)NCC=O 34a_100000187808_200009817547 [2,0,0,0,0,0|2,0,0]=4 3281 B12R1.385 Cc1cc(ccc1Cl)NCC=O 7a_100000187808_200015260668 [2,0,0,0,0,0|2,0,0]=4 3282 B12R1.385 Cc1cc(ccc1Cl)OCC=O 34a_100000211092_200009817547 [2,0,0,0,0,0|2,0,0]=4 3283 B12R1.385 Cc1cc(ccc1Cl)OCC=O 7a_100000211092_200015260668 [2,0,0,0,0,0|2,0,0]=4 3284 B12R1.385 Cc1cc(ccc1Cl)SCC=O 62a_100000049509_200015260668 [2,0,0,0,0,0|2,0,0]=4 3285 B12R1.385 Cc1cc(ccc1Cl)SCC=O 62a_200015260668_100000049509 [2,0,0,0,0,0|2,0,0]=4 3286 B12R1.385 Cc1cc(ccc1F)NCC=O 2230a_100000750164_200015260668 [2,0,0,0,0,0|2,0,0]=4 3287 B12R1.385 Cc1cc(ccc1F)NCC=O 34a_100000750164_200009817547 [2,0,0,0,0,0|2,0,0]=4 3288 B12R1.385 Cc1cc(ccc1F)NCC=O 7a_100000750164_200015260668 [2,0,0,0,0,0|2,0,0]=4 3289 B12R1.385 Cc1cc(ccc1F)OCC=O 34a_100000751312_200009817547 [2,0,0,0,0,0|2,0,0]=4 3290 B12R1.385 Cc1cc(ccc1F)OCC=O 7a_100000751312_200015260668 [2,0,0,0,0,0|2,0,0]=4 3291 B12R1.385 Cc1cc(ccc1F)SCC=O 62a_100011218330_200015260668 [2,0,0,0,0,0|2,0,0]=4 3292 B12R1.385 Cc1cc(ccc1F)SCC=O 62a_200015260668_100011218330 [2,0,0,0,0,0|2,0,0]=4 3293 B12R1.385 Cc1cc(ccc1I)NCC=O 34a_100000198070_200009817547 [2,0,0,0,0,0|2,0,0]=4 3294 B12R1.385 Cc1cc(ccc1I)NCC=O 7a_100000198070_200015260668 [2,0,0,0,0,0|2,0,0]=4 3295 B12R1.385 Cc1cc(ccc1I)OCC=O 34a_100000729255_200009817547 [2,0,0,0,0,0|2,0,0]=4 3296 B12R1.385 Cc1cc(ccc1I)OCC=O 7a_100000729255_200015260668 [2,0,0,0,0,0|2,0,0]=4 3297 B12R1.385 Cc1cc(ccc1N)OCC=O 34a_100000756630_200009817547 [2,0,0,0,0,0|2,0,0]=4 3298 B12R1.385 Cc1cc(ccc1N)OCC=O 7a_100000756630_200015260668 [2,0,0,0,0,0|2,0,0]=4 3299 B12R1.385 Cc1cc(ccc1N)SCC=O 62a_100000211769_200015260668 [2,0,0,0,0,0|2,0,0]=4 3300 B12R1.385 Cc1cc(ccc1N)SCC=O 62a_200015260668_100000211769 [2,0,0,0,0,0|2,0,0]=4 3301 B12R1.385 Cc1cc(ccc1O)NCC=O 34a_100011218179_200009817547 [2,0,0,0,0,0|1,0,0]=3 3302 B12R1.385 Cc1cc(ccc1O)NCC=O 7a_100011218179_200015260668 [2,0,0,0,0,0|1,0,0]=3 3303 B12R1.385 Cc1cc(ccc1O)SCC=O 62a_200015260668_100000186361 [2,0,0,0,0,0|1,0,0]=3 3304 B12R1.385 Cc1cc(cnc1O)SCC=O 62a_100000685391_200015260668 [2,0,0,0,0,0|2,0,0]=4 3305 B12R1.385 Cc1cc(cnc1O)SCC=O 62a_200015260668_100000685391 [2,0,0,0,0,0|2,0,0]=4 3306 B12R1.385 Cc1cc(ncc1O)SCC=O 62a_200015260668_100000692680 [2,0,0,0,0,0|2,0,0]=4 3307 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 2230a_100020591374_200025704644 [2,0,0,0,0,0|2,0,0]=4 3308 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 34a_100020591374_200025704644 [2,0,0,0,0,0|2,0,0]=4 3309 B12R1.385 Cc1ccc(cc1C)NCC=O 2230a_100000724040_200015260668 [2,0,0,0,0,0|2,0,0]=4 3310 B12R1.385 Cc1ccc(cc1C)NCC=O 34a_100000724040_200009817547 [2,0,0,0,0,0|2,0,0]=4 3311 B12R1.385 Cc1ccc(cc1C)NCC=O 7a_100000724040_200015260668 [2,0,0,0,0,0|2,0,0]=4 3312 B12R1.385 Cc1ccc(cc1C)OCC=O 34a_100000210932_200009817547 [2,0,0,0,0,0|2,0,0]=4 3313 B12R1.385 Cc1ccc(cc1C)OCC=O 7a_100000210932_200015260668 [2,0,0,0,0,0|2,0,0]=4 3314 B12R1.385 Cc1ccc(cc1C)SCC=O 62a_100011215607_200015260668 [2,0,0,0,0,0|2,0,0]=4 3315 B12R1.385 Cc1ccc(cc1C)SCC=O 62a_200015260668_100011215607 [2,0,0,0,0,0|2,0,0]=4 3316 B12R1.385 Cc1ccc(cc1O)NCC=O 34a_100000759471_200009817547 [2,0,0,0,0,0|2,0,0]=4 3317 B12R1.385 Cc1ccc(cc1O)NCC=O 7a_100000759471_200015260668 [2,0,0,0,0,0|2,0,0]=4 3318 B12R1.385 Cc1ccc(cc1O)SCC=O 62a_100000685420_200015260668 [2,0,0,0,0,0|2,0,0]=4 3319 B12R1.385 Cc1ccc(cc1O)SCC=O 62a_200015260668_100000685420 [2,0,0,0,0,0|2,0,0]=4 3320 B12R1.385 Cc1nc(ccc1O)SCC=O 62a_100010233687_200015260668 [2,0,0,0,0,0|2,0,0]=4 3321 B12R1.385 Cc1nc(ccc1O)SCC=O 62a_200015260668_100010233687 [2,0,0,0,0,0|2,0,0]=4 3322 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_100000752626_200015260668 [2,0,0,0,0,0|2,0,0]=4 3323 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_200015260668_100000752626 [2,0,0,0,0,0|2,0,0]=4 3324 B12R1.385 Nc1ccc(cc1O)SCC=O 62a_100000739049_200015260668 [2,0,0,0,0,0|2,0,0]=4 3325 B12R1.385 Nc1ccc(cc1O)SCC=O 62a_200015260668_100000739049 [2,0,0,0,0,0|2,0,0]=4 3326 B12R1.385 O=CCNc1ccc(c(c1)Br)O 34a_100011534360_200009817547 [2,0,0,0,0,0|2,0,0]=4 3327 B12R1.385 O=CCNc1ccc(c(c1)Cl)O 34a_100000744943_200009817547 [2,0,0,0,0,0|2,0,0]=4 3328 B12R1.385 O=CCNc1ccc(c(c1)F)O 34a_100011220035_200009817547 [2,0,0,0,0,0|2,0,0]=4 3329 B12R1.385 O=CCNc1ccc(c(c1)F)O 7a_100011220035_200015260668 [2,0,0,0,0,0|2,0,0]=4 3330 B12R1.385 O=CCNc1ccc(c(c1)O)Cl 34a_100011934209_200009817547 [2,0,0,0,0,0|2,0,0]=4 3331 B12R1.385 O=CCNc1ccc(c(c1)O)F 34a_100012017398_200009817547 [2,0,0,0,0,0|2,0,0]=4 3332 B12R1.385 O=CCNc1ccc(c(c1)O)F 7a_100012017398_200015260668 [2,0,0,0,0,0|2,0,0]=4 3333 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [2,0,0,0,0,0|1,0,0]=3 3334 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_100012361655_200015260668 [2,0,0,0,0,0|2,0,0]=4 3335 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_200015260668_100012361655 [2,0,0,0,0,0|2,0,0]=4 3336 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_100012360047_200015260668 [2,0,0,0,0,0|2,0,0]=4 3337 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_200015260668_100012360047 [2,0,0,0,0,0|2,0,0]=4 3338 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_100000185481_200015260668 [2,0,0,0,0,0|2,0,0]=4 3339 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_200015260668_100000185481 [2,0,0,0,0,0|2,0,0]=4 3340 B12R1.385 O=CCSc1ccc(c(c1)O)Br 62a_100012356990_200015260668 [2,0,0,0,0,0|2,0,0]=4 3341 B12R1.385 O=CCSc1ccc(c(c1)O)Br 62a_200015260668_100012356990 [2,0,0,0,0,0|2,0,0]=4 3342 B12R1.385 O=CCSc1ccc(c(c1)O)Cl 62a_100011356854_200015260668 [2,0,0,0,0,0|2,0,0]=4 3343 B12R1.385 O=CCSc1ccc(c(c1)O)Cl 62a_200015260668_100011356854 [2,0,0,0,0,0|2,0,0]=4 3344 B12R1.385 O=CCSc1ccc(c(c1)O)F 62a_100000686035_200015260668 [2,0,0,0,0,0|2,0,0]=4 3345 B12R1.385 O=CCSc1ccc(c(c1)O)F 62a_200015260668_100000686035 [2,0,0,0,0,0|2,0,0]=4 3346 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [2,0,0,0,0,0|1,0,0]=3 3347 B12R1.385 [13CH3]NCCc1ccc(c(c1)O)O 34a_100000210387_200025704644 [2,0,0,0,0,0|1,0,0]=3 3348 B12R1.385 [13CH3]SCCc1ccc(c(c1)O)O 62a_200025704644_200010393615 [2,0,0,0,0,0|1,0,0]=3 3349 B12R1.286 C=C=Cc1ccc(c(c1)OC)O 271570a_100015277604_100000694246 [2,0,0,0,0,0|0,0,2]=4 3350 B12R1.286 CC=Cc1ccc(c(c1)CC)O 271570a_100016259895_100012338938 [2,0,0,0,0,0|1,0,1]=4 3351 B12R1.286 CC=Cc1ccc(c(c1)OC)Br 271570a_100016259895_100012353699 [2,0,0,0,0,0|1,0,1]=4 3352 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [2,0,0,0,0,0|1,0,1]=4 3353 B12R1.286 CC=Cc1ccc(c(c1)OC)Cl 271570a_100016259895_100011356853 [2,0,0,0,0,0|1,0,1]=4 3354 B12R1.286 CC=Cc1ccc(c(c1)OC)F 271570a_100016259895_100011934186 [2,0,0,0,0,0|1,0,1]=4 3355 B12R1.286 CC=Cc1ccc(c(c1)OC)N 271570a_100016259895_100011279103 [2,0,0,0,0,0|1,0,1]=4 3356 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [2,0,0,0,0,0|0,0,1]=3 3357 B12R1.286 CC=Cc1ccc(c(n1)OC)O 271570a_100016259895_100010893133 [2,0,0,0,0,0|1,0,1]=4 3358 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [2,0,0,0,0,0|2,0,0]=4 3359 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [2,0,0,0,0,0|2,0,0]=4 3360 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [2,0,0,0,0,0|2,0,0]=4 3361 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [2,0,0,0,0,0|2,0,0]=4 3362 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [2,0,0,0,0,0|2,0,0]=4 3363 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [2,0,0,0,0,0|2,0,0]=4 3364 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [2,0,0,0,0,0|2,0,0]=4 3365 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [2,0,0,0,0,0|2,0,0]=4 3366 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [2,0,0,0,0,0|2,0,0]=4 3367 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [2,0,0,0,0,0|1,0,0]=3 3368 B12R1.286 CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210202 [2,0,0,0,0,0|2,0,0]=4 3369 B12R1.286 CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210202 [2,0,0,0,0,0|2,0,0]=4 3370 B12R1.286 CCOc1ccc(c(c1)OC)C 34a_100009865632_100000210202 [2,0,0,0,0,0|2,0,0]=4 3371 B12R1.286 CCOc1ccc(c(c1)OC)C 7a_100009865632_100000210202 [2,0,0,0,0,0|2,0,0]=4 3372 B12R1.286 CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210202 [2,0,0,0,0,0|2,0,0]=4 3373 B12R1.286 CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210202 [2,0,0,0,0,0|2,0,0]=4 3374 B12R1.286 CCOc1ccc(c(c1)OC)F 34a_100012001760_100000210202 [2,0,0,0,0,0|2,0,0]=4 3375 B12R1.286 CCOc1ccc(c(c1)OC)F 7a_100012001760_100000210202 [2,0,0,0,0,0|2,0,0]=4 3376 B12R1.286 CCOc1ccc(c(c1)OC)N 34a_100015326901_100000210202 [2,0,0,0,0,0|2,0,0]=4 3377 B12R1.286 CCOc1ccc(c(c1)OC)N 7a_100015326901_100000210202 [2,0,0,0,0,0|2,0,0]=4 3378 B12R1.286 CCSc1ccc(c(c1)CC)O 62a_100000210202_100012338938 [2,0,0,0,0,0|2,0,0]=4 3379 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100000210202_100012353699 [2,0,0,0,0,0|2,0,0]=4 3380 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210202 [2,0,0,0,0,0|2,0,0]=4 3381 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100000210202_100011830276 [2,0,0,0,0,0|2,0,0]=4 3382 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210202 [2,0,0,0,0,0|2,0,0]=4 3383 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100000210202_100011356853 [2,0,0,0,0,0|2,0,0]=4 3384 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210202 [2,0,0,0,0,0|2,0,0]=4 3385 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100000210202_100011934186 [2,0,0,0,0,0|2,0,0]=4 3386 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210202 [2,0,0,0,0,0|2,0,0]=4 3387 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100000210202_100015196925 [2,0,0,0,0,0|2,0,0]=4 3388 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210202 [2,0,0,0,0,0|2,0,0]=4 3389 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [2,0,0,0,0,0|1,0,0]=3 3390 B12R1.286 CCSc1ccc(c(n1)OC)O 62a_100000210202_100010893133 [2,0,0,0,0,0|2,0,0]=4 3391 B12R1.286 CNCc1ccc(c(c1)OC)Br 207a_100102657272_100010244714 [2,0,0,0,0,0|2,0,0]=4 3392 B12R1.286 CNCc1ccc(c(c1)OC)Br 2230a_106832991635_100010110085 [2,0,0,0,0,0|2,0,0]=4 3393 B12R1.286 CNCc1ccc(c(c1)OC)Br 26a_100102657272_100011827694 [2,0,0,0,0,0|2,0,0]=4 3394 B12R1.286 CNCc1ccc(c(c1)OC)Br 270004a_106832991635_100010244714 [2,0,0,0,0,0|2,0,0]=4 3395 B12R1.286 CNCc1ccc(c(c1)OC)Br 34a_100102657272_100010110085 [2,0,0,0,0,0|2,0,0]=4 3396 B12R1.286 CNCc1ccc(c(c1)OC)Br 7a_106832991635_100010110085 [2,0,0,0,0,0|2,0,0]=4 3397 B12R1.286 CNCc1ccc(c(c1)OC)C 207a_100102657272_100000719150 [2,0,0,0,0,0|2,0,0]=4 3398 B12R1.286 CNCc1ccc(c(c1)OC)C 270004a_106832991635_100000719150 [2,0,0,0,0,0|2,0,0]=4 3399 B12R1.286 CNCc1ccc(c(c1)OC)Cl 207a_100102657272_100011998524 [2,0,0,0,0,0|2,0,0]=4 3400 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_200000210301 [2,0,0,0,0,0|2,0,0]=4 3401 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_106832991635_200010214485 [2,0,0,0,0,0|2,0,0]=4 3402 B12R1.286 CNCc1ccc(c(c1)OC)Cl 26a_100102657272_100012186310 [2,0,0,0,0,0|2,0,0]=4 3403 B12R1.286 CNCc1ccc(c(c1)OC)Cl 270004a_106832991635_100011998524 [2,0,0,0,0,0|2,0,0]=4 3404 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100015204853_200000210301 [2,0,0,0,0,0|2,0,0]=4 3405 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100102657272_200010214485 [2,0,0,0,0,0|2,0,0]=4 3406 B12R1.286 CNCc1ccc(c(c1)OC)Cl 7a_106832991635_200010214485 [2,0,0,0,0,0|2,0,0]=4 3407 B12R1.286 CNCc1ccc(c(c1)OC)F 207a_100102657272_100000692873 [2,0,0,0,0,0|2,0,0]=4 3408 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_100020626639_200000210301 [2,0,0,0,0,0|2,0,0]=4 3409 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_106832991635_100012349856 [2,0,0,0,0,0|2,0,0]=4 3410 B12R1.286 CNCc1ccc(c(c1)OC)F 270004a_106832991635_100000692873 [2,0,0,0,0,0|2,0,0]=4 3411 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100020626639_200000210301 [2,0,0,0,0,0|2,0,0]=4 3412 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100102657272_100012349856 [2,0,0,0,0,0|2,0,0]=4 3413 B12R1.286 CNCc1ccc(c(c1)OC)F 7a_106832991635_100012349856 [2,0,0,0,0,0|2,0,0]=4 3414 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [2,0,0,0,0,0|1,0,0]=3 3415 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100010234685_200000210301 [2,0,0,0,0,0|2,0,0]=4 3416 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100138415774_100010110085 [2,0,0,0,0,0|2,0,0]=4 3417 B12R1.286 COCc1ccc(c(c1)OC)Br 7a_100010234685_200000210301 [2,0,0,0,0,0|2,0,0]=4 3418 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [2,0,0,0,0,0|2,0,0]=4 3419 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [2,0,0,0,0,0|2,0,0]=4 3420 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100012179228_200000210301 [2,0,0,0,0,0|2,0,0]=4 3421 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100138415774_200010214485 [2,0,0,0,0,0|2,0,0]=4 3422 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100000692429_200000210301 [2,0,0,0,0,0|2,0,0]=4 3423 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100138415774_100012349856 [2,0,0,0,0,0|2,0,0]=4 3424 B12R1.286 COCc1ccc(c(c1)OC)F 7a_100000692429_200000210301 [2,0,0,0,0,0|2,0,0]=4 3425 B12R1.286 COCc1ccc(c(c1)OC)N 34a_100000087641_200000210301 [2,0,0,0,0,0|2,0,0]=4 3426 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 34a_100010234685_200025704644 [2,0,0,0,0,0|2,0,0]=4 3427 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 7a_100010234685_200025704644 [2,0,0,0,0,0|2,0,0]=4 3428 B12R1.286 COc1cc(ccc1Br)CSC 62a_100010110085_200000210301 [2,0,0,0,0,0|2,0,0]=4 3429 B12R1.286 COc1cc(ccc1Br)CSC 62a_200000210301_100010110085 [2,0,0,0,0,0|2,0,0]=4 3430 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_100010110085_200025704644 [2,0,0,0,0,0|2,0,0]=4 3431 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100010110085 [2,0,0,0,0,0|2,0,0]=4 3432 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [2,0,0,0,0,0|2,0,0]=4 3433 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [2,0,0,0,0,0|2,0,0]=4 3434 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 2230a_100015204853_200025704644 [2,0,0,0,0,0|2,0,0]=4 3435 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 34a_100015204853_200025704644 [2,0,0,0,0,0|2,0,0]=4 3436 B12R1.286 COc1cc(ccc1Cl)CO[13CH3] 34a_100012179228_200025704644 [2,0,0,0,0,0|2,0,0]=4 3437 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200000210301_200010214485 [2,0,0,0,0,0|2,0,0]=4 3438 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200010214485_200000210301 [2,0,0,0,0,0|2,0,0]=4 3439 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200010214485_200025704644 [2,0,0,0,0,0|2,0,0]=4 3440 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_200010214485 [2,0,0,0,0,0|2,0,0]=4 3441 B12R1.286 COc1cc(ccc1F)CN[13CH3] 2230a_100020626639_200025704644 [2,0,0,0,0,0|2,0,0]=4 3442 B12R1.286 COc1cc(ccc1F)CN[13CH3] 34a_100020626639_200025704644 [2,0,0,0,0,0|2,0,0]=4 3443 B12R1.286 COc1cc(ccc1F)CO[13CH3] 34a_100000692429_200025704644 [2,0,0,0,0,0|2,0,0]=4 3444 B12R1.286 COc1cc(ccc1F)CO[13CH3] 7a_100000692429_200025704644 [2,0,0,0,0,0|2,0,0]=4 3445 B12R1.286 COc1cc(ccc1F)CSC 62a_100012349856_200000210301 [2,0,0,0,0,0|2,0,0]=4 3446 B12R1.286 COc1cc(ccc1F)CSC 62a_200000210301_100012349856 [2,0,0,0,0,0|2,0,0]=4 3447 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_100012349856_200025704644 [2,0,0,0,0,0|2,0,0]=4 3448 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_200025704644_100012349856 [2,0,0,0,0,0|2,0,0]=4 3449 B12R1.286 COc1cc(ccc1N)CO[13CH3] 34a_100000087641_200025704644 [2,0,0,0,0,0|2,0,0]=4 3450 B12R1.286 COc1cc(ccc1O)CC#N 271570a_203496583355_100010176002 [2,0,0,0,0,0|1,0,1]=4 3451 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [2,0,0,0,0,0|1,0,0]=3 3452 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [2,0,0,0,0,0|2,0,0]=4 3453 B12R1.286 COc1cc(ccc1O)SCF 62a_100015361967_100000694246 [2,0,0,0,0,0|2,0,0]=4 3454 B12R1.382 C=CCNc1cccc(c1)OC 34a_100000210024_100015514636 [2,0,0,0,0,0|1,0,1]=4 3455 B12R1.382 C=CCOc1cccc(c1)OC 34a_100000211255_100015514636 [2,0,0,0,0,0|1,0,1]=4 3456 B12R1.382 C=CCOc1cccc(c1)OC 7a_100000211255_100015514636 [2,0,0,0,0,0|1,0,1]=4 3457 B12R1.382 C=CCSc1cccc(c1)OC 62a_100000210623_100000170001 [2,0,0,0,0,0|1,0,1]=4 3458 B12R1.382 CC=NNc1cccc(c1)OC 4a_100000722927_200000210099 [2,0,0,0,0,0|2,0,0]=4 3459 B12R1.382 CCCCc1cc(ccn1)OC 271570a_100020621405_100011216251 [2,0,0,0,0,0|1,0,1]=4 3460 B12R1.382 CCCCc1cccc(c1)CC 271570a_100020621405_100000684523 [2,0,0,0,0,0|1,0,1]=4 3461 B12R1.382 CCCCc1cccc(c1)NC 2230a_200012017287_200000210301 [2,0,0,0,0,0|1,0,1]=4 3462 B12R1.382 CCCCc1cccc(c1)NC 271570a_100020621405_100000219648 [2,0,0,0,0,0|1,0,1]=4 3463 B12R1.382 CCCCc1cccc(c1)NC 34a_200012017287_200000210301 [2,0,0,0,0,0|1,0,1]=4 3464 B12R1.382 CCCCc1cccc(c1)NC 7a_200012017287_200000210301 [2,0,0,0,0,0|1,0,1]=4 3465 B12R1.382 CCCCc1cccc(c1)N[13CH3] 2230a_200012017287_200025704644 [2,0,0,0,0,0|1,0,1]=4 3466 B12R1.382 CCCCc1cccc(c1)N[13CH3] 34a_200012017287_200025704644 [2,0,0,0,0,0|1,0,1]=4 3467 B12R1.382 CCCCc1cccc(c1)N[13CH3] 7a_200012017287_200025704644 [2,0,0,0,0,0|1,0,1]=4 3468 B12R1.382 CCCCc1cccc(c1)OC 271570a_100020621405_100000170001 [2,0,0,0,0,0|0,0,1]=3 3469 B12R1.382 CCCCc1cccc(c1)SC 271570a_100020621405_100011215954 [2,0,0,0,0,0|0,1,1]=4 3470 B12R1.382 CCCCc1cccc(c1)SC 62a_200000210301_200010244551 [2,0,0,0,0,0|0,1,1]=4 3471 B12R1.382 CCCCc1cccc(c1)SC 62a_200010244551_200000210301 [2,0,0,0,0,0|0,1,1]=4 3472 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200010244551_200025704644 [2,0,0,0,0,0|0,1,1]=4 3473 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200025704644_200010244551 [2,0,0,0,0,0|0,1,1]=4 3474 B12R1.382 CCCCc1cccc(n1)OC 271570a_100020621405_100000760917 [2,0,0,0,0,0|1,0,1]=4 3475 B12R1.382 CCCCc1ccnc(c1)OC 271570a_100020621405_100000117307 [2,0,0,0,0,0|1,0,1]=4 3476 B12R1.382 CCCCc1cncc(c1)OC 271570a_100020621405_100000684773 [2,0,0,0,0,0|1,0,1]=4 3477 B12R1.382 CCCNc1cccc(c1)OC 34a_100000210024_100000210303 [2,0,0,0,0,0|1,0,1]=4 3478 B12R1.382 CCCOc1cccc(c1)OC 34a_100000211255_100000210303 [2,0,0,0,0,0|1,0,1]=4 3479 B12R1.382 CCCOc1cccc(c1)OC 34a_100000748497_200000210301 [2,0,0,0,0,0|1,0,1]=4 3480 B12R1.382 CCCOc1cccc(c1)OC 7a_100000211255_100000210303 [2,0,0,0,0,0|1,0,1]=4 3481 B12R1.382 CCCOc1cccc(c1)OC 7a_100000748497_200000210301 [2,0,0,0,0,0|1,0,1]=4 3482 B12R1.382 CCCOc1cccc(c1)O[13CH3] 34a_100000748497_200025704644 [2,0,0,0,0,0|1,0,1]=4 3483 B12R1.382 CCCOc1cccc(c1)O[13CH3] 7a_100000748497_200025704644 [2,0,0,0,0,0|1,0,1]=4 3484 B12R1.382 CCCSc1cccc(c1)OC 62a_100000210303_100000170001 [2,0,0,0,0,0|1,0,1]=4 3485 B12R1.382 CCNCc1cccc(c1)OC 207a_100015525214_100000170238 [2,0,0,0,0,0|1,0,1]=4 3486 B12R1.382 CCNCc1cccc(c1)OC 2230a_100000174954_100000210202 [2,0,0,0,0,0|1,0,1]=4 3487 B12R1.382 CCNCc1cccc(c1)OC 2230a_100015525214_100000211672 [2,0,0,0,0,0|1,0,1]=4 3488 B12R1.382 CCNCc1cccc(c1)OC 270004a_100015525214_100000170238 [2,0,0,0,0,0|1,0,1]=4 3489 B12R1.382 CCNCc1cccc(c1)OC 34a_100000174954_100000210202 [2,0,0,0,0,0|1,0,1]=4 3490 B12R1.382 CCNCc1cccc(c1)OC 34a_100000201218_200000210301 [2,0,0,0,0,0|1,0,1]=4 3491 B12R1.382 CCNCc1cccc(c1)O[13CH3] 34a_100000201218_200025704644 [2,0,0,0,0,0|1,0,1]=4 3492 B12R1.382 CCOCc1cccc(c1)OC 34a_100000198976_100000210202 [2,0,0,0,0,0|1,0,1]=4 3493 B12R1.382 CCOCc1cccc(c1)OC 34a_100121572206_100000688526 [2,0,0,0,0,0|1,0,1]=4 3494 B12R1.382 CCSCc1cccc(c1)OC 62a_100000210202_100000211672 [2,0,0,0,0,0|1,0,1]=4 3495 B12R1.382 CCSCc1cccc(c1)OC 62a_100000688526_100000210202 [2,0,0,0,0,0|1,0,1]=4 3496 B12R1.382 CCc1cccc(c1)NCC=O 2230a_100000211250_200015260668 [2,0,0,0,0,0|2,0,0]=4 3497 B12R1.382 CCc1cccc(c1)NCC=O 34a_100000211250_200009817547 [2,0,0,0,0,0|2,0,0]=4 3498 B12R1.382 CCc1cccc(c1)NCC=O 7a_100000211250_200015260668 [2,0,0,0,0,0|2,0,0]=4 3499 B12R1.382 CCc1cccc(c1)OCC=O 34a_100000211550_200009817547 [2,0,0,0,0,0|2,0,0]=4 3500 B12R1.382 CCc1cccc(c1)OCC=O 7a_100000211550_200015260668 [2,0,0,0,0,0|2,0,0]=4 3501 B12R1.382 CCc1cccc(c1)SCC=O 62a_100011263222_200015260668 [2,0,0,0,0,0|2,0,0]=4 3502 B12R1.382 CCc1cccc(c1)SCC=O 62a_200015260668_100011263222 [2,0,0,0,0,0|2,0,0]=4 3503 B12R1.382 CNCCc1cccc(c1)OC 2230a_100000740386_200000210301 [2,0,0,0,0,0|1,0,0]=3 3504 B12R1.382 CNCCc1cccc(c1)OC 2230a_106832991635_100011713679 [2,0,0,0,0,0|1,0,0]=3 3505 B12R1.382 CNCCc1cccc(c1)OC 34a_100000740386_200000210301 [2,0,0,0,0,0|1,0,0]=3 3506 B12R1.382 CNCCc1cccc(c1)OC 34a_100102657272_100011713679 [2,0,0,0,0,0|1,0,0]=3 3507 B12R1.382 CNCCc1cccc(c1)OC 7a_106832991635_100011713679 [2,0,0,0,0,0|1,0,0]=3 3508 B12R1.382 CNc1cccc(c1)OCC=O 34a_100000756613_200009817547 [2,0,0,0,0,0|2,0,0]=4 3509 B12R1.382 CNc1cccc(c1)OCC=O 7a_100000756613_200015260668 [2,0,0,0,0,0|2,0,0]=4 3510 B12R1.382 CNc1cccc(c1)SCC=O 62a_100000219648_200015260668 [2,0,0,0,0,0|2,0,0]=4 3511 B12R1.382 CNc1cccc(c1)SCC=O 62a_200015260668_100000219648 [2,0,0,0,0,0|2,0,0]=4 3512 B12R1.382 COCCc1cccc(c1)OC 34a_100011215300_200000210301 [2,0,0,0,0,0|1,0,0]=3 3513 B12R1.382 COCCc1cccc(c1)OC 34a_100138415774_100011713679 [2,0,0,0,0,0|1,0,0]=3 3514 B12R1.382 COCCc1cccc(c1)OC 7a_100011215300_200000210301 [2,0,0,0,0,0|1,0,0]=3 3515 B12R1.382 COCSc1cccc(c1)OC 62a_100000766300_100000170001 [2,0,0,0,0,0|2,0,0]=4 3516 B12R1.382 COc1cc(ccn1)OCC=O 34a_100012181050_200009817547 [2,0,0,0,0,0|2,0,0]=4 3517 B12R1.382 COc1cc(ccn1)SCC=O 62a_100000117307_200015260668 [2,0,0,0,0,0|2,0,0]=4 3518 B12R1.382 COc1cc(ccn1)SCC=O 62a_200015260668_100000117307 [2,0,0,0,0,0|2,0,0]=4 3519 B12R1.382 COc1cccc(c1)CCCO 34a_200011999501_200000210301 [2,0,0,0,0,0|0,0,2]=4 3520 B12R1.382 COc1cccc(c1)CCCO 7a_200011999501_200000210301 [2,0,0,0,0,0|0,0,2]=4 3521 B12R1.382 COc1cccc(c1)CCN[13CH3] 2230a_100000740386_200025704644 [2,0,0,0,0,0|1,0,0]=3 3522 B12R1.382 COc1cccc(c1)CCN[13CH3] 34a_100000740386_200025704644 [2,0,0,0,0,0|1,0,0]=3 3523 B12R1.382 COc1cccc(c1)CCO[13CH3] 34a_100011215300_200025704644 [2,0,0,0,0,0|1,0,0]=3 3524 B12R1.382 COc1cccc(c1)CCO[13CH3] 7a_100011215300_200025704644 [2,0,0,0,0,0|1,0,0]=3 3525 B12R1.382 COc1cccc(c1)CCSC 62a_100011713679_200000210301 [2,0,0,0,0,0|1,0,0]=3 3526 B12R1.382 COc1cccc(c1)CCSC 62a_200000210301_100011713679 [2,0,0,0,0,0|1,0,0]=3 3527 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_100011713679_200025704644 [2,0,0,0,0,0|1,0,0]=3 3528 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713679 [2,0,0,0,0,0|1,0,0]=3 3529 B12R1.382 COc1cccc(c1)NCC=O 34a_100000210024_200009817547 [2,0,0,0,0,0|1,0,0]=3 3530 B12R1.382 COc1cccc(c1)NCSC 34a_100000210024_100011218213 [2,0,0,0,0,0|2,0,0]=4 3531 B12R1.382 COc1cccc(c1)OCC=O 34a_100000211255_200009817547 [2,0,0,0,0,0|1,0,0]=3 3532 B12R1.382 COc1cccc(c1)OCC=O 7a_100000211255_200015260668 [2,0,0,0,0,0|1,0,0]=3 3533 B12R1.382 COc1cccc(c1)OCSC 34a_100000211255_100011218213 [2,0,0,0,0,0|2,0,0]=4 3534 B12R1.382 COc1cccc(c1)SCC=O 62a_200015260668_100000170001 [2,0,0,0,0,0|1,0,0]=3 3535 B12R1.382 COc1cccc(c1)SCSC 62a_100011218213_100000170001 [2,0,0,0,0,0|2,0,0]=4 3536 B12R1.382 COc1cccc(n1)SCC=O 62a_100000760917_200015260668 [2,0,0,0,0,0|2,0,0]=4 3537 B12R1.382 COc1cccc(n1)SCC=O 62a_200015260668_100000760917 [2,0,0,0,0,0|2,0,0]=4 3538 B12R1.382 COc1ccnc(c1)SCC=O 62a_100009817693_200015260668 [2,0,0,0,0,0|2,0,0]=4 3539 B12R1.382 COc1ccnc(c1)SCC=O 62a_200015260668_100011216251 [2,0,0,0,0,0|2,0,0]=4 3540 B12R1.382 COc1cncc(c1)OCC=O 34a_100000084572_200009817547 [2,0,0,0,0,0|2,0,0]=4 3541 B12R1.382 COc1cncc(c1)OCC=O 7a_100000084572_200015260668 [2,0,0,0,0,0|2,0,0]=4 3542 B12R1.382 COc1cncc(c1)SCC=O 62a_100000050176_200015260668 [2,0,0,0,0,0|2,0,0]=4 3543 B12R1.382 COc1cncc(c1)SCC=O 62a_200015260668_100000050176 [2,0,0,0,0,0|2,0,0]=4 3544 B12R1.382 CSc1cccc(c1)NCC=O 2230a_100000210049_200015260668 [2,0,0,0,0,0|1,1,0]=4 3545 B12R1.382 CSc1cccc(c1)NCC=O 34a_100000210049_200009817547 [2,0,0,0,0,0|1,1,0]=4 3546 B12R1.382 CSc1cccc(c1)OCC=O 34a_100011265683_200009817547 [2,0,0,0,0,0|1,1,0]=4 3547 B12R1.382 CSc1cccc(c1)OCC=O 7a_100011265683_200015260668 [2,0,0,0,0,0|1,1,0]=4 3548 B12R1.382 CSc1cccc(c1)SCC=O 62a_100011215954_200015260668 [2,0,0,0,0,0|1,1,0]=4 3549 B12R1.382 CSc1cccc(c1)SCC=O 62a_200015260668_100011215954 [2,0,0,0,0,0|1,1,0]=4 3550 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 34a_200011999501_200025704644 [2,0,0,0,0,0|0,0,2]=4 3551 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 7a_200011999501_200025704644 [2,0,0,0,0,0|0,0,2]=4 3552 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 3553 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 3554 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)C)C 1458a_100000070787_100000183365 [1,1,0,0,0,0|1,0,1]=4 3555 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)C)Cl 1458a_100000070787_200011216723 [1,1,0,0,0,0|1,0,1]=4 3556 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)Cl)O 1458a_100000070787_200010170092 [1,1,0,0,0,0|1,0,1]=4 3557 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000070787_100000183813 [1,1,0,0,0,0|0,0,1]=3 3558 B14R1.685 CC(=O)C[C@@H](O)c1ccc(c(c1)F)F 1458a_100000070787_100000761251 [1,1,0,0,0,0|2,0,0]=4 3559 B14R1.685 CC(=O)NC(C)c1ccc(c(c1)C)F 11a_100000705826_100015343762 [1,1,0,0,0,0|2,0,0]=4 3560 B14R1.685 CC(=O)NC(C)c1ccc(c(c1)C)F 1626a_100000705826_100015343762 [1,1,0,0,0,0|2,0,0]=4 3561 B14R1.685 CC(=O)NC(C)c1ccc(c(c1)C)F 240690a_100000705826_100015343762 [1,1,0,0,0,0|2,0,0]=4 3562 B14R1.685 CC(=O)NC(C)c1ccc(c(c1)C)F 527a_100000705826_100103153847 [1,1,0,0,0,0|2,0,0]=4 3563 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)C)C 11a_100015184928_100015343762 [1,1,0,0,0,0|2,0,0]=4 3564 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)C)C 1626a_100015184928_100015343762 [1,1,0,0,0,0|2,0,0]=4 3565 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)C)C 240690a_100015184928_100015343762 [1,1,0,0,0,0|2,0,0]=4 3566 B14R1.685 CC(=O)N[C@H](C)c1ccc(c(c1)C)C 527a_100015184928_100103153847 [1,1,0,0,0,0|2,0,0]=4 3567 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)O 271570a_100015190218_100009813601 [1,1,0,0,0,0|1,0,1]=4 3568 B14R1.685 Cc1cc(ccc1O)C(=O)CC(=O)N 1458a_100000685612_100000187820 [1,1,0,0,0,0|1,0,1]=4 3569 B14R1.685 Cc1cc(ccc1O)C(=O)CC(=O)[O-] 1458a_100000685612_100020667443 [1,1,0,0,0,0|1,0,1]=4 3570 B14R1.685 Cc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000186361 [1,1,0,0,0,0|1,0,1]=4 3571 B14R1.685 NC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000187820 [1,1,0,0,0,0|1,0,1]=4 3572 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 3573 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Br 2230a_100000210723_100009814033 [1,1,0,0,0,0|2,0,0]=4 3574 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Br 7a_100000210723_100000179758 [1,1,0,0,0,0|2,0,0]=4 3575 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)C 2230a_100000724040_100009814033 [1,1,0,0,0,0|2,0,0]=4 3576 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)C 7a_100000724040_100000179758 [1,1,0,0,0,0|2,0,0]=4 3577 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Cl 2230a_100000187808_100009814033 [1,1,0,0,0,0|2,0,0]=4 3578 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)Cl 7a_100000187808_100000179758 [1,1,0,0,0,0|2,0,0]=4 3579 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)F 2230a_100000750164_100009814033 [1,1,0,0,0,0|2,0,0]=4 3580 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)F 7a_100000750164_100000179758 [1,1,0,0,0,0|2,0,0]=4 3581 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)I 7a_100000198070_100000179758 [1,1,0,0,0,0|2,0,0]=4 3582 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000179758 [1,1,0,0,0,0|1,0,0]=3 3583 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000179758 [1,1,0,0,0,0|2,0,0]=4 3584 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000179758 [1,1,0,0,0,0|2,0,0]=4 3585 B14R1.686 CC(=O)C(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000179758 [1,1,0,0,0,0|2,0,0]=4 3586 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)Br 7a_100000690111_100000179758 [1,1,0,0,0,0|2,0,0]=4 3587 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)C 7a_100000210932_100000179758 [1,1,0,0,0,0|2,0,0]=4 3588 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)Cl 1458a_100000230597_200000210301 [1,1,0,0,0,0|2,0,0]=4 3589 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)Cl 7a_100000211092_100000179758 [1,1,0,0,0,0|2,0,0]=4 3590 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)F 7a_100000751312_100000179758 [1,1,0,0,0,0|2,0,0]=4 3591 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)I 7a_100000729255_100000179758 [1,1,0,0,0,0|2,0,0]=4 3592 B14R1.686 CC(=O)C(C)Oc1ccc(c(c1)C)N 7a_100000756630_100000179758 [1,1,0,0,0,0|2,0,0]=4 3593 B14R1.686 CC(=O)C(C)Sc1cc(c(cn1)O)C 62a_100009814033_100000692680 [1,1,0,0,0,0|2,0,0]=4 3594 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100009814033_100012361655 [1,1,0,0,0,0|2,0,0]=4 3595 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100009814033 [1,1,0,0,0,0|2,0,0]=4 3596 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Br 62a_100009813585_100009814033 [1,1,0,0,0,0|2,0,0]=4 3597 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Br 62a_100009814033_100009813585 [1,1,0,0,0,0|2,0,0]=4 3598 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)C 62a_100009814033_100011215607 [1,1,0,0,0,0|2,0,0]=4 3599 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)C 62a_100011215607_100009814033 [1,1,0,0,0,0|2,0,0]=4 3600 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Cl 62a_100000049509_100009814033 [1,1,0,0,0,0|2,0,0]=4 3601 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)Cl 62a_100009814033_100000049509 [1,1,0,0,0,0|2,0,0]=4 3602 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)F 62a_100009814033_100011218330 [1,1,0,0,0,0|2,0,0]=4 3603 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)F 62a_100011218330_100009814033 [1,1,0,0,0,0|2,0,0]=4 3604 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)N 62a_100000211769_100009814033 [1,1,0,0,0,0|2,0,0]=4 3605 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)N 62a_100009814033_100000211769 [1,1,0,0,0,0|2,0,0]=4 3606 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)C)O 62a_100009814033_100000186361 [1,1,0,0,0,0|1,0,0]=3 3607 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100009814033_100012360047 [1,1,0,0,0,0|2,0,0]=4 3608 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009814033 [1,1,0,0,0,0|2,0,0]=4 3609 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100000185481_100009814033 [1,1,0,0,0,0|2,0,0]=4 3610 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)F)O 62a_100009814033_100000185481 [1,1,0,0,0,0|2,0,0]=4 3611 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100000752626_100009814033 [1,1,0,0,0,0|2,0,0]=4 3612 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)N)O 62a_100009814033_100000752626 [1,1,0,0,0,0|2,0,0]=4 3613 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100009814033_100012356990 [1,1,0,0,0,0|2,0,0]=4 3614 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100009814033 [1,1,0,0,0,0|2,0,0]=4 3615 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100000685420_100009814033 [1,1,0,0,0,0|2,0,0]=4 3616 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)C 62a_100009814033_100000685420 [1,1,0,0,0,0|2,0,0]=4 3617 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100009814033_100011356854 [1,1,0,0,0,0|2,0,0]=4 3618 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100009814033 [1,1,0,0,0,0|2,0,0]=4 3619 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100000686035_100009814033 [1,1,0,0,0,0|2,0,0]=4 3620 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)F 62a_100009814033_100000686035 [1,1,0,0,0,0|2,0,0]=4 3621 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100000739049_100009814033 [1,1,0,0,0,0|2,0,0]=4 3622 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)N 62a_100009814033_100000739049 [1,1,0,0,0,0|2,0,0]=4 3623 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [1,1,0,0,0,0|1,0,0]=3 3624 B14R1.686 CC(=O)C(C)Sc1ccc(c(n1)C)O 62a_100009814033_100010233687 [1,1,0,0,0,0|2,0,0]=4 3625 B14R1.686 CC(=O)C(C)Sc1ccc(c(n1)C)O 62a_100010233687_100009814033 [1,1,0,0,0,0|2,0,0]=4 3626 B14R1.686 CC(=O)C(C)Sc1cnc(c(c1)C)O 62a_100000685391_100009814033 [1,1,0,0,0,0|2,0,0]=4 3627 B14R1.686 CC(=O)C(C)Sc1cnc(c(c1)C)O 62a_100009814033_100000685391 [1,1,0,0,0,0|2,0,0]=4 3628 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [1,1,0,0,0,0|0,0,0]=2 3629 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 11a_100015204808_100015343762 [1,1,0,0,0,0|2,0,0]=4 3630 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 1626a_100015204808_100015343762 [1,1,0,0,0,0|2,0,0]=4 3631 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 240690a_100015204808_100015343762 [1,1,0,0,0,0|2,0,0]=4 3632 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)C)C 527a_100015204808_100103153847 [1,1,0,0,0,0|2,0,0]=4 3633 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [1,1,0,0,0,0|1,0,0]=3 3634 B14R1.686 CC(Nc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_100000702099 [1,1,0,0,0,0|2,0,0]=4 3635 B14R1.686 CC(Sc1ccc(c(c1)O)O)C(=O)N 62a_100000702099_100009813601 [1,1,0,0,0,0|2,0,0]=4 3636 B14R1.686 Cc1cc(ccc1Cl)OC(C)C(=O)[13CH3] 1458a_100000230597_200025704644 [1,1,0,0,0,0|2,0,0]=4 3637 B14R1.686 Cc1cc(ccc1O)NC(C)C(=O)N 34a_100011218179_100000702099 [1,1,0,0,0,0|2,0,0]=4 3638 B14R1.686 Cc1cc(ccc1O)NC(C)C(=O)N 7a_100011218179_100000702099 [1,1,0,0,0,0|2,0,0]=4 3639 B14R1.686 Cc1cc(ccc1O)NC(F)C(=O)N 34a_100011218179_100009813875 [1,1,0,0,0,0|2,0,0]=4 3640 B14R1.686 Cc1cc(ccc1O)NC(F)C(=O)N 7a_100011218179_100009813875 [1,1,0,0,0,0|2,0,0]=4 3641 B14R1.686 Cc1cc(ccc1O)NC(F)C(=O)[O-] 34a_100011218179_100020610796 [1,1,0,0,0,0|2,0,0]=4 3642 B14R1.686 Cc1cc(ccc1O)SC(C)C(=O)N 62a_100000702099_100000186361 [1,1,0,0,0,0|2,0,0]=4 3643 B14R1.686 Cc1cc(ccc1O)SC(F)C(=O)N 62a_100009813875_100000186361 [1,1,0,0,0,0|2,0,0]=4 3644 B14R1.686 Cc1cc(ccc1O)SC(F)C(=O)[O-] 62a_100020610796_100000186361 [1,1,0,0,0,0|2,0,0]=4 3645 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100009813875 [1,1,0,0,0,0|2,0,0]=4 3646 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)O 62a_100009813875_100009813601 [1,1,0,0,0,0|2,0,0]=4 3647 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100020610796 [1,1,0,0,0,0|2,0,0]=4 3648 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)O 62a_100020610796_100009813601 [1,1,0,0,0,0|2,0,0]=4 3649 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [1,1,0,0,0,0|0,0,0]=2 3650 B14R1.833 C#CC(=O)CCc1ccc(c(c1)O)O 1458a_100000211873_200010393615 [1,1,0,0,0,0|0,0,1]=3 3651 B14R1.833 C=CC(=O)CCc1ccc(c(c1)O)O 1458a_100000185746_200010393615 [1,1,0,0,0,0|0,0,1]=3 3652 B14R1.833 C=CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_200121576911 [1,1,0,0,0,0|1,0,1]=4 3653 B14R1.833 CCC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_100000210202 [1,1,0,0,0,0|2,0,0]=4 3654 B14R1.833 CCC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_100000210202 [1,1,0,0,0,0|2,0,0]=4 3655 B14R1.833 CCC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_100000210202 [1,1,0,0,0,0|1,0,0]=3 3656 B14R1.833 CCC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_100000210202 [1,1,0,0,0,0|1,0,0]=3 3657 B14R1.833 CCC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_100000210202 [1,1,0,0,0,0|2,0,0]=4 3658 B14R1.833 CCC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000210414_100011713676 [1,1,0,0,0,0|2,0,0]=4 3659 B14R1.833 CCC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_100000210202 [1,1,0,0,0,0|2,0,0]=4 3660 B14R1.833 CCC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000210414_100012361305 [1,1,0,0,0,0|2,0,0]=4 3661 B14R1.833 CCC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_100000210202 [1,1,0,0,0,0|2,0,0]=4 3662 B14R1.833 CCC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_100000210202 [1,1,0,0,0,0|2,0,0]=4 3663 B14R1.833 CCC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_100000210202 [1,1,0,0,0,0|2,0,0]=4 3664 B14R1.833 CCC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_100000210202 [1,1,0,0,0,0|2,0,0]=4 3665 B14R1.833 CCC(=O)CCc1ccc(c(c1)F)F 1458a_100000210414_100000690553 [1,1,0,0,0,0|2,0,0]=4 3666 B14R1.833 CCC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_100000210202 [1,1,0,0,0,0|2,0,0]=4 3667 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_100000210202 [1,1,0,0,0,0|0,0,0]=2 3668 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000210414_200010393615 [1,1,0,0,0,0|0,0,0]=2 3669 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)Br 7a_100000210723_100000747405 [1,1,0,0,0,0|2,0,0]=4 3670 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)C 7a_100000724040_100000747405 [1,1,0,0,0,0|2,0,0]=4 3671 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000747405 [1,1,0,0,0,0|2,0,0]=4 3672 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)F 7a_100000750164_100000747405 [1,1,0,0,0,0|2,0,0]=4 3673 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)I 7a_100000198070_100000747405 [1,1,0,0,0,0|2,0,0]=4 3674 B14R1.833 CCC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000747405 [1,1,0,0,0,0|1,0,0]=3 3675 B14R1.833 CCC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000747405 [1,1,0,0,0,0|2,0,0]=4 3676 B14R1.833 CCC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000747405 [1,1,0,0,0,0|2,0,0]=4 3677 B14R1.833 CCC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000747405 [1,1,0,0,0,0|2,0,0]=4 3678 B14R1.833 CCC(=O)COc1ccc(c(c1)C)Br 7a_100000690111_100000747405 [1,1,0,0,0,0|2,0,0]=4 3679 B14R1.833 CCC(=O)COc1ccc(c(c1)C)C 1458a_100000182425_100000210202 [1,1,0,0,0,0|2,0,0]=4 3680 B14R1.833 CCC(=O)COc1ccc(c(c1)C)C 7a_100000210932_100000747405 [1,1,0,0,0,0|2,0,0]=4 3681 B14R1.833 CCC(=O)COc1ccc(c(c1)C)Cl 1458a_100000182483_100000210202 [1,1,0,0,0,0|2,0,0]=4 3682 B14R1.833 CCC(=O)COc1ccc(c(c1)C)Cl 7a_100000211092_100000747405 [1,1,0,0,0,0|2,0,0]=4 3683 B14R1.833 CCC(=O)COc1ccc(c(c1)C)F 7a_100000751312_100000747405 [1,1,0,0,0,0|2,0,0]=4 3684 B14R1.833 CCC(=O)COc1ccc(c(c1)C)I 7a_100000729255_100000747405 [1,1,0,0,0,0|2,0,0]=4 3685 B14R1.833 CCC(=O)COc1ccc(c(c1)C)N 7a_100000756630_100000747405 [1,1,0,0,0,0|2,0,0]=4 3686 B14R1.833 CCC(=O)CSc1cc(c(cn1)O)C 62a_100000747405_100000692680 [1,1,0,0,0,0|2,0,0]=4 3687 B14R1.833 CCC(=O)CSc1ccc(c(c1)Br)O 62a_100000747405_100012361655 [1,1,0,0,0,0|2,0,0]=4 3688 B14R1.833 CCC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000747405 [1,1,0,0,0,0|2,0,0]=4 3689 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)Br 62a_100000747405_100009813585 [1,1,0,0,0,0|2,0,0]=4 3690 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)Br 62a_100009813585_100000747405 [1,1,0,0,0,0|2,0,0]=4 3691 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)C 62a_100000747405_100011215607 [1,1,0,0,0,0|2,0,0]=4 3692 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)C 62a_100011215607_100000747405 [1,1,0,0,0,0|2,0,0]=4 3693 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000747405 [1,1,0,0,0,0|2,0,0]=4 3694 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)Cl 62a_100000747405_100000049509 [1,1,0,0,0,0|2,0,0]=4 3695 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)F 62a_100000747405_100011218330 [1,1,0,0,0,0|2,0,0]=4 3696 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)F 62a_100011218330_100000747405 [1,1,0,0,0,0|2,0,0]=4 3697 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)N 62a_100000211769_100000747405 [1,1,0,0,0,0|2,0,0]=4 3698 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)N 62a_100000747405_100000211769 [1,1,0,0,0,0|2,0,0]=4 3699 B14R1.833 CCC(=O)CSc1ccc(c(c1)C)O 62a_100000747405_100000186361 [1,1,0,0,0,0|1,0,0]=3 3700 B14R1.833 CCC(=O)CSc1ccc(c(c1)Cl)O 62a_100000747405_100012360047 [1,1,0,0,0,0|2,0,0]=4 3701 B14R1.833 CCC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000747405 [1,1,0,0,0,0|2,0,0]=4 3702 B14R1.833 CCC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000747405 [1,1,0,0,0,0|2,0,0]=4 3703 B14R1.833 CCC(=O)CSc1ccc(c(c1)F)O 62a_100000747405_100000185481 [1,1,0,0,0,0|2,0,0]=4 3704 B14R1.833 CCC(=O)CSc1ccc(c(c1)N)O 62a_100000747405_100000752626 [1,1,0,0,0,0|2,0,0]=4 3705 B14R1.833 CCC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000747405 [1,1,0,0,0,0|2,0,0]=4 3706 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)Br 62a_100000747405_100012356990 [1,1,0,0,0,0|2,0,0]=4 3707 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000747405 [1,1,0,0,0,0|2,0,0]=4 3708 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000747405 [1,1,0,0,0,0|2,0,0]=4 3709 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)C 62a_100000747405_100000685420 [1,1,0,0,0,0|2,0,0]=4 3710 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)Cl 62a_100000747405_100011356854 [1,1,0,0,0,0|2,0,0]=4 3711 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000747405 [1,1,0,0,0,0|2,0,0]=4 3712 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000747405 [1,1,0,0,0,0|2,0,0]=4 3713 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)F 62a_100000747405_100000686035 [1,1,0,0,0,0|2,0,0]=4 3714 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000747405 [1,1,0,0,0,0|2,0,0]=4 3715 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)N 62a_100000747405_100000739049 [1,1,0,0,0,0|2,0,0]=4 3716 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)O 62a_100000747405_100009813601 [1,1,0,0,0,0|1,0,0]=3 3717 B14R1.833 CCC(=O)CSc1ccc(c(n1)C)O 62a_100000747405_100010233687 [1,1,0,0,0,0|2,0,0]=4 3718 B14R1.833 CCC(=O)CSc1ccc(c(n1)C)O 62a_100010233687_100000747405 [1,1,0,0,0,0|2,0,0]=4 3719 B14R1.833 CCC(=O)CSc1cnc(c(c1)C)O 62a_100000685391_100000747405 [1,1,0,0,0,0|2,0,0]=4 3720 B14R1.833 CCC(=O)CSc1cnc(c(c1)C)O 62a_100000747405_100000685391 [1,1,0,0,0,0|2,0,0]=4 3721 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)Br 11a_100015205234_100000210414 [1,1,0,0,0,0|2,0,0]=4 3722 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)Br 1626a_100015205234_100000210414 [1,1,0,0,0,0|2,0,0]=4 3723 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)Br 240690a_100015205234_100000210414 [1,1,0,0,0,0|2,0,0]=4 3724 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)Br 527a_100015205234_100000210414 [1,1,0,0,0,0|2,0,0]=4 3725 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)C 11a_100025706692_100000210414 [1,1,0,0,0,0|2,0,0]=4 3726 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)C 1626a_100025706692_100000210414 [1,1,0,0,0,0|2,0,0]=4 3727 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)C 240690a_100025706692_100000210414 [1,1,0,0,0,0|2,0,0]=4 3728 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)C 527a_100025706692_100000210414 [1,1,0,0,0,0|2,0,0]=4 3729 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)F 11a_100000239911_100000210414 [1,1,0,0,0,0|2,0,0]=4 3730 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)F 1626a_100000239911_100000210414 [1,1,0,0,0,0|2,0,0]=4 3731 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)F 240690a_100000239911_100000210414 [1,1,0,0,0,0|2,0,0]=4 3732 B14R1.833 CCC(=O)NCc1ccc(c(c1)C)F 527a_100000239911_100000210414 [1,1,0,0,0,0|2,0,0]=4 3733 B14R1.833 CCC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100000210414 [1,1,0,0,0,0|2,0,0]=4 3734 B14R1.833 CCC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100000210414 [1,1,0,0,0,0|2,0,0]=4 3735 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100000210414 [1,1,0,0,0,0|2,0,0]=4 3736 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100000210414 [1,1,0,0,0,0|2,0,0]=4 3737 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100000210414 [1,1,0,0,0,0|2,0,0]=4 3738 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100000210414 [1,1,0,0,0,0|2,0,0]=4 3739 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210414 [1,1,0,0,0,0|1,0,0]=3 3740 B14R1.833 CCN(C)CCc1ccc(c(c1)O)O 269982a_100000225621_200010393615 [1,1,0,0,0,0|2,0,0]=4 3741 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)O)O 240690a_100102657272_100011195073 [1,1,0,0,0,0|0,0,2]=4 3742 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 11a_106832991635_100010220830 [1,1,0,0,0,0|2,0,0]=4 3743 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 1626a_100102657272_100010220830 [1,1,0,0,0,0|2,0,0]=4 3744 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 240690a_100102657272_100010220830 [1,1,0,0,0,0|2,0,0]=4 3745 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 527a_100102657272_100010220830 [1,1,0,0,0,0|2,0,0]=4 3746 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 11a_106832991635_100011308364 [1,1,0,0,0,0|2,0,0]=4 3747 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 1626a_100102657272_100011308364 [1,1,0,0,0,0|2,0,0]=4 3748 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 240690a_100102657272_100011308364 [1,1,0,0,0,0|2,0,0]=4 3749 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 527a_100102657272_100011308364 [1,1,0,0,0,0|2,0,0]=4 3750 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 11a_106832991635_100011338283 [1,1,0,0,0,0|1,0,0]=3 3751 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 1626a_100102657272_100011338283 [1,1,0,0,0,0|1,0,0]=3 3752 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 240690a_100102657272_100011338283 [1,1,0,0,0,0|1,0,0]=3 3753 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 527a_100102657272_100011338283 [1,1,0,0,0,0|1,0,0]=3 3754 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 11a_106832991635_100011615030 [1,1,0,0,0,0|1,0,0]=3 3755 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 1626a_100102657272_100011615030 [1,1,0,0,0,0|1,0,0]=3 3756 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 240690a_100102657272_100011615030 [1,1,0,0,0,0|1,0,0]=3 3757 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 527a_100102657272_100011615030 [1,1,0,0,0,0|1,0,0]=3 3758 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 11a_106832991635_100009812081 [1,1,0,0,0,0|2,0,0]=4 3759 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 1626a_100102657272_100009812081 [1,1,0,0,0,0|2,0,0]=4 3760 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 240690a_100102657272_100009812081 [1,1,0,0,0,0|2,0,0]=4 3761 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 527a_100102657272_100009812081 [1,1,0,0,0,0|2,0,0]=4 3762 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 11a_106832991635_100000735579 [1,1,0,0,0,0|2,0,0]=4 3763 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 1626a_100102657272_100000735579 [1,1,0,0,0,0|2,0,0]=4 3764 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000735579 [1,1,0,0,0,0|2,0,0]=4 3765 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 527a_100102657272_100000735579 [1,1,0,0,0,0|2,0,0]=4 3766 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 11a_106832991635_100011218152 [1,1,0,0,0,0|2,0,0]=4 3767 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 1626a_100102657272_100011218152 [1,1,0,0,0,0|2,0,0]=4 3768 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 240690a_100102657272_100011218152 [1,1,0,0,0,0|2,0,0]=4 3769 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 527a_100102657272_100011218152 [1,1,0,0,0,0|2,0,0]=4 3770 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 11a_106832991635_100010146367 [1,1,0,0,0,0|2,0,0]=4 3771 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 1626a_100102657272_100010146367 [1,1,0,0,0,0|2,0,0]=4 3772 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 240690a_100102657272_100010146367 [1,1,0,0,0,0|2,0,0]=4 3773 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 527a_100102657272_100010146367 [1,1,0,0,0,0|2,0,0]=4 3774 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 11a_106832991635_100011830284 [1,1,0,0,0,0|2,0,0]=4 3775 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 1626a_100102657272_100011830284 [1,1,0,0,0,0|2,0,0]=4 3776 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 240690a_100102657272_100011830284 [1,1,0,0,0,0|2,0,0]=4 3777 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 527a_100102657272_100011830284 [1,1,0,0,0,0|2,0,0]=4 3778 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 11a_106832991635_100011518922 [1,1,0,0,0,0|2,0,0]=4 3779 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 1626a_100102657272_100011518922 [1,1,0,0,0,0|2,0,0]=4 3780 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 240690a_100102657272_100011518922 [1,1,0,0,0,0|2,0,0]=4 3781 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 527a_100102657272_100011518922 [1,1,0,0,0,0|2,0,0]=4 3782 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 11a_106832991635_100000737970 [1,1,0,0,0,0|2,0,0]=4 3783 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 1626a_100102657272_100000737970 [1,1,0,0,0,0|2,0,0]=4 3784 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 240690a_100102657272_100000737970 [1,1,0,0,0,0|2,0,0]=4 3785 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 527a_100102657272_100000737970 [1,1,0,0,0,0|2,0,0]=4 3786 B14R1.833 CNC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000183359 [1,1,0,0,0,0|2,0,0]=4 3787 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)Br 2230a_100000210723_100000183359 [1,1,0,0,0,0|2,0,0]=4 3788 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)Br 34a_100000210723_100000183359 [1,1,0,0,0,0|2,0,0]=4 3789 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)Br 7a_100000210723_100000183359 [1,1,0,0,0,0|2,0,0]=4 3790 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)C 2230a_100000724040_100000183359 [1,1,0,0,0,0|2,0,0]=4 3791 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)C 34a_100000724040_100000183359 [1,1,0,0,0,0|2,0,0]=4 3792 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)C 7a_100000724040_100000183359 [1,1,0,0,0,0|2,0,0]=4 3793 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100000183359 [1,1,0,0,0,0|2,0,0]=4 3794 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)Cl 34a_100000187808_100000183359 [1,1,0,0,0,0|2,0,0]=4 3795 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000183359 [1,1,0,0,0,0|2,0,0]=4 3796 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)F 2230a_100000750164_100000183359 [1,1,0,0,0,0|2,0,0]=4 3797 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)F 34a_100000750164_100000183359 [1,1,0,0,0,0|2,0,0]=4 3798 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)F 7a_100000750164_100000183359 [1,1,0,0,0,0|2,0,0]=4 3799 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)I 34a_100000198070_100000183359 [1,1,0,0,0,0|2,0,0]=4 3800 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)I 7a_100000198070_100000183359 [1,1,0,0,0,0|2,0,0]=4 3801 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000183359 [1,1,0,0,0,0|1,0,0]=3 3802 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000183359 [1,1,0,0,0,0|1,0,0]=3 3803 B14R1.833 CNC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000183359 [1,1,0,0,0,0|2,0,0]=4 3804 B14R1.833 CNC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000183359 [1,1,0,0,0,0|2,0,0]=4 3805 B14R1.833 CNC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000183359 [1,1,0,0,0,0|2,0,0]=4 3806 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)C 34a_100000759471_100000183359 [1,1,0,0,0,0|2,0,0]=4 3807 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000183359 [1,1,0,0,0,0|2,0,0]=4 3808 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000183359 [1,1,0,0,0,0|2,0,0]=4 3809 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000183359 [1,1,0,0,0,0|2,0,0]=4 3810 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000183359 [1,1,0,0,0,0|2,0,0]=4 3811 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000183359 [1,1,0,0,0,0|1,0,0]=3 3812 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Br 34a_100000690111_100000183359 [1,1,0,0,0,0|2,0,0]=4 3813 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Br 7a_100000690111_100000183359 [1,1,0,0,0,0|2,0,0]=4 3814 B14R1.833 CNC(=O)COc1ccc(c(c1)C)C 11a_106832991635_100000182425 [1,1,0,0,0,0|2,0,0]=4 3815 B14R1.833 CNC(=O)COc1ccc(c(c1)C)C 1626a_100102657272_100000182425 [1,1,0,0,0,0|2,0,0]=4 3816 B14R1.833 CNC(=O)COc1ccc(c(c1)C)C 240690a_100102657272_100000182425 [1,1,0,0,0,0|2,0,0]=4 3817 B14R1.833 CNC(=O)COc1ccc(c(c1)C)C 34a_100000210932_100000183359 [1,1,0,0,0,0|2,0,0]=4 3818 B14R1.833 CNC(=O)COc1ccc(c(c1)C)C 527a_100102657272_100000182425 [1,1,0,0,0,0|2,0,0]=4 3819 B14R1.833 CNC(=O)COc1ccc(c(c1)C)C 7a_100000210932_100000183359 [1,1,0,0,0,0|2,0,0]=4 3820 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Cl 11a_106832991635_100000182483 [1,1,0,0,0,0|2,0,0]=4 3821 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Cl 1626a_100102657272_100000182483 [1,1,0,0,0,0|2,0,0]=4 3822 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Cl 240690a_100102657272_100000182483 [1,1,0,0,0,0|2,0,0]=4 3823 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Cl 34a_100000211092_100000183359 [1,1,0,0,0,0|2,0,0]=4 3824 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Cl 527a_100102657272_100000182483 [1,1,0,0,0,0|2,0,0]=4 3825 B14R1.833 CNC(=O)COc1ccc(c(c1)C)Cl 7a_100000211092_100000183359 [1,1,0,0,0,0|2,0,0]=4 3826 B14R1.833 CNC(=O)COc1ccc(c(c1)C)F 34a_100000751312_100000183359 [1,1,0,0,0,0|2,0,0]=4 3827 B14R1.833 CNC(=O)COc1ccc(c(c1)C)F 7a_100000751312_100000183359 [1,1,0,0,0,0|2,0,0]=4 3828 B14R1.833 CNC(=O)COc1ccc(c(c1)C)I 34a_100000729255_100000183359 [1,1,0,0,0,0|2,0,0]=4 3829 B14R1.833 CNC(=O)COc1ccc(c(c1)C)I 7a_100000729255_100000183359 [1,1,0,0,0,0|2,0,0]=4 3830 B14R1.833 CNC(=O)COc1ccc(c(c1)C)N 34a_100000756630_100000183359 [1,1,0,0,0,0|2,0,0]=4 3831 B14R1.833 CNC(=O)COc1ccc(c(c1)C)N 7a_100000756630_100000183359 [1,1,0,0,0,0|2,0,0]=4 3832 B14R1.833 CNC(=O)COc1ccc(c(c1)N)O 271570a_203496583355_200010369465 [1,1,0,0,0,0|2,0,0]=4 3833 B14R1.833 CNC(=O)CSc1cc(c(cn1)O)C 62a_100000183359_100000692680 [1,1,0,0,0,0|2,0,0]=4 3834 B14R1.833 CNC(=O)CSc1ccc(c(c1)Br)O 62a_100000183359_100012361655 [1,1,0,0,0,0|2,0,0]=4 3835 B14R1.833 CNC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000183359 [1,1,0,0,0,0|2,0,0]=4 3836 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)Br 62a_100000183359_100009813585 [1,1,0,0,0,0|2,0,0]=4 3837 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)Br 62a_100009813585_100000183359 [1,1,0,0,0,0|2,0,0]=4 3838 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)C 62a_100000183359_100011215607 [1,1,0,0,0,0|2,0,0]=4 3839 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)C 62a_100011215607_100000183359 [1,1,0,0,0,0|2,0,0]=4 3840 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000183359 [1,1,0,0,0,0|2,0,0]=4 3841 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)Cl 62a_100000183359_100000049509 [1,1,0,0,0,0|2,0,0]=4 3842 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)F 62a_100000183359_100011218330 [1,1,0,0,0,0|2,0,0]=4 3843 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)F 62a_100011218330_100000183359 [1,1,0,0,0,0|2,0,0]=4 3844 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)N 62a_100000183359_100000211769 [1,1,0,0,0,0|2,0,0]=4 3845 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)N 62a_100000211769_100000183359 [1,1,0,0,0,0|2,0,0]=4 3846 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)O 62a_100000183359_100000186361 [1,1,0,0,0,0|1,0,0]=3 3847 B14R1.833 CNC(=O)CSc1ccc(c(c1)Cl)O 62a_100000183359_100012360047 [1,1,0,0,0,0|2,0,0]=4 3848 B14R1.833 CNC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000183359 [1,1,0,0,0,0|2,0,0]=4 3849 B14R1.833 CNC(=O)CSc1ccc(c(c1)F)O 62a_100000183359_100000185481 [1,1,0,0,0,0|2,0,0]=4 3850 B14R1.833 CNC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000183359 [1,1,0,0,0,0|2,0,0]=4 3851 B14R1.833 CNC(=O)CSc1ccc(c(c1)N)O 62a_100000183359_100000752626 [1,1,0,0,0,0|2,0,0]=4 3852 B14R1.833 CNC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000183359 [1,1,0,0,0,0|2,0,0]=4 3853 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Br 62a_100000183359_100012356990 [1,1,0,0,0,0|2,0,0]=4 3854 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000183359 [1,1,0,0,0,0|2,0,0]=4 3855 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)C 62a_100000183359_100000685420 [1,1,0,0,0,0|2,0,0]=4 3856 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000183359 [1,1,0,0,0,0|2,0,0]=4 3857 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Cl 62a_100000183359_100011356854 [1,1,0,0,0,0|2,0,0]=4 3858 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000183359 [1,1,0,0,0,0|2,0,0]=4 3859 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)F 62a_100000183359_100000686035 [1,1,0,0,0,0|2,0,0]=4 3860 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000183359 [1,1,0,0,0,0|2,0,0]=4 3861 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)N 62a_100000183359_100000739049 [1,1,0,0,0,0|2,0,0]=4 3862 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000183359 [1,1,0,0,0,0|2,0,0]=4 3863 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)O 62a_100000183359_100009813601 [1,1,0,0,0,0|1,0,0]=3 3864 B14R1.833 CNC(=O)CSc1ccc(c(n1)C)O 62a_100000183359_100010233687 [1,1,0,0,0,0|2,0,0]=4 3865 B14R1.833 CNC(=O)CSc1ccc(c(n1)C)O 62a_100010233687_100000183359 [1,1,0,0,0,0|2,0,0]=4 3866 B14R1.833 CNC(=O)CSc1cnc(c(c1)C)O 62a_100000183359_100000685391 [1,1,0,0,0,0|2,0,0]=4 3867 B14R1.833 CNC(=O)CSc1cnc(c(c1)C)O 62a_100000685391_100000183359 [1,1,0,0,0,0|2,0,0]=4 3868 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)Br 2708a_100015205234_106832991635 [1,1,0,0,0,0|2,0,0]=4 3869 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)Br 2708a_100102657272_100015205234 [1,1,0,0,0,0|2,0,0]=4 3870 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)Br 273464a_100015205234_100102657272 [1,1,0,0,0,0|2,0,0]=4 3871 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)Br 273464a_100102657272_100015205234 [1,1,0,0,0,0|2,0,0]=4 3872 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)Br 512a_100015205234_100102657272 [1,1,0,0,0,0|2,0,0]=4 3873 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)Br 512a_106832991638_100015205234 [1,1,0,0,0,0|2,0,0]=4 3874 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)C 2708a_100025706692_106832991635 [1,1,0,0,0,0|2,0,0]=4 3875 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)C 2708a_100102657272_100025706692 [1,1,0,0,0,0|2,0,0]=4 3876 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)C 273464a_100025706692_100102657272 [1,1,0,0,0,0|2,0,0]=4 3877 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)C 273464a_100102657272_100025706692 [1,1,0,0,0,0|2,0,0]=4 3878 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)C 512a_106832991638_100025706692 [1,1,0,0,0,0|2,0,0]=4 3879 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)F 2708a_100000239911_106832991635 [1,1,0,0,0,0|2,0,0]=4 3880 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)F 2708a_100102657272_100000239911 [1,1,0,0,0,0|2,0,0]=4 3881 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)F 273464a_100000239911_100102657272 [1,1,0,0,0,0|2,0,0]=4 3882 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)F 273464a_100102657272_100000239911 [1,1,0,0,0,0|2,0,0]=4 3883 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)F 512a_100000239911_100102657272 [1,1,0,0,0,0|2,0,0]=4 3884 B14R1.833 CNC(=O)NCc1ccc(c(c1)C)F 512a_106832991638_100000239911 [1,1,0,0,0,0|2,0,0]=4 3885 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 2708a_100000758358_106832991635 [1,1,0,0,0,0|2,0,0]=4 3886 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 2708a_100102657272_100000758358 [1,1,0,0,0,0|2,0,0]=4 3887 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 273464a_100000758358_100102657272 [1,1,0,0,0,0|2,0,0]=4 3888 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 273464a_100102657272_100000758358 [1,1,0,0,0,0|2,0,0]=4 3889 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 512a_106832991638_100000758358 [1,1,0,0,0,0|2,0,0]=4 3890 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 2708a_100020636435_106832991635 [1,1,0,0,0,0|2,0,0]=4 3891 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 2708a_100102657272_100020636435 [1,1,0,0,0,0|2,0,0]=4 3892 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 273464a_100020636435_100102657272 [1,1,0,0,0,0|2,0,0]=4 3893 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 273464a_100102657272_100020636435 [1,1,0,0,0,0|2,0,0]=4 3894 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 512a_100020636435_100102657272 [1,1,0,0,0,0|2,0,0]=4 3895 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 512a_106832991638_100020636435 [1,1,0,0,0,0|2,0,0]=4 3896 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 2708a_100102657272_100160469508 [1,1,0,0,0,0|2,0,0]=4 3897 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 2708a_100160469508_106832991635 [1,1,0,0,0,0|2,0,0]=4 3898 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 273464a_100102657272_100160469508 [1,1,0,0,0,0|2,0,0]=4 3899 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 273464a_100160469508_100102657272 [1,1,0,0,0,0|2,0,0]=4 3900 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 512a_100160469508_100102657272 [1,1,0,0,0,0|2,0,0]=4 3901 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 512a_106832991638_100160469508 [1,1,0,0,0,0|2,0,0]=4 3902 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 2708a_100000010075_106832991635 [1,1,0,0,0,0|1,0,0]=3 3903 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100000010075_100102657272 [1,1,0,0,0,0|1,0,0]=3 3904 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100102657272_100000010075 [1,1,0,0,0,0|1,0,0]=3 3905 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 512a_106832991638_100000010075 [1,1,0,0,0,0|1,0,0]=3 3906 B14R1.833 COC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000747449 [1,1,0,0,0,0|2,0,0]=4 3907 B14R1.833 COC(=O)CNc1ccc(c(c1)C)Br 2230a_100000210723_100000747449 [1,1,0,0,0,0|2,0,0]=4 3908 B14R1.833 COC(=O)CNc1ccc(c(c1)C)Br 34a_100000210723_100000747449 [1,1,0,0,0,0|2,0,0]=4 3909 B14R1.833 COC(=O)CNc1ccc(c(c1)C)Br 7a_100000210723_100000747449 [1,1,0,0,0,0|2,0,0]=4 3910 B14R1.833 COC(=O)CNc1ccc(c(c1)C)C 2230a_100000724040_100000747449 [1,1,0,0,0,0|2,0,0]=4 3911 B14R1.833 COC(=O)CNc1ccc(c(c1)C)C 34a_100000724040_100000747449 [1,1,0,0,0,0|2,0,0]=4 3912 B14R1.833 COC(=O)CNc1ccc(c(c1)C)C 7a_100000724040_100000747449 [1,1,0,0,0,0|2,0,0]=4 3913 B14R1.833 COC(=O)CNc1ccc(c(c1)C)Cl 2230a_100000187808_100000747449 [1,1,0,0,0,0|2,0,0]=4 3914 B14R1.833 COC(=O)CNc1ccc(c(c1)C)Cl 34a_100000187808_100000747449 [1,1,0,0,0,0|2,0,0]=4 3915 B14R1.833 COC(=O)CNc1ccc(c(c1)C)Cl 7a_100000187808_100000747449 [1,1,0,0,0,0|2,0,0]=4 3916 B14R1.833 COC(=O)CNc1ccc(c(c1)C)F 2230a_100000750164_100000747449 [1,1,0,0,0,0|2,0,0]=4 3917 B14R1.833 COC(=O)CNc1ccc(c(c1)C)F 34a_100000750164_100000747449 [1,1,0,0,0,0|2,0,0]=4 3918 B14R1.833 COC(=O)CNc1ccc(c(c1)C)F 7a_100000750164_100000747449 [1,1,0,0,0,0|2,0,0]=4 3919 B14R1.833 COC(=O)CNc1ccc(c(c1)C)I 34a_100000198070_100000747449 [1,1,0,0,0,0|2,0,0]=4 3920 B14R1.833 COC(=O)CNc1ccc(c(c1)C)I 7a_100000198070_100000747449 [1,1,0,0,0,0|2,0,0]=4 3921 B14R1.833 COC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000747449 [1,1,0,0,0,0|1,0,0]=3 3922 B14R1.833 COC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000747449 [1,1,0,0,0,0|1,0,0]=3 3923 B14R1.833 COC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000747449 [1,1,0,0,0,0|2,0,0]=4 3924 B14R1.833 COC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000747449 [1,1,0,0,0,0|2,0,0]=4 3925 B14R1.833 COC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000747449 [1,1,0,0,0,0|2,0,0]=4 3926 B14R1.833 COC(=O)CNc1ccc(c(c1)O)C 34a_100000759471_100000747449 [1,1,0,0,0,0|2,0,0]=4 3927 B14R1.833 COC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000747449 [1,1,0,0,0,0|2,0,0]=4 3928 B14R1.833 COC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000747449 [1,1,0,0,0,0|2,0,0]=4 3929 B14R1.833 COC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000747449 [1,1,0,0,0,0|2,0,0]=4 3930 B14R1.833 COC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000747449 [1,1,0,0,0,0|2,0,0]=4 3931 B14R1.833 COC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000747449 [1,1,0,0,0,0|1,0,0]=3 3932 B14R1.833 COC(=O)COc1ccc(c(c1)C)Br 34a_100000690111_100000747449 [1,1,0,0,0,0|2,0,0]=4 3933 B14R1.833 COC(=O)COc1ccc(c(c1)C)Br 7a_100000690111_100000747449 [1,1,0,0,0,0|2,0,0]=4 3934 B14R1.833 COC(=O)COc1ccc(c(c1)C)C 34a_100000210932_100000747449 [1,1,0,0,0,0|2,0,0]=4 3935 B14R1.833 COC(=O)COc1ccc(c(c1)C)C 7a_100000210932_100000747449 [1,1,0,0,0,0|2,0,0]=4 3936 B14R1.833 COC(=O)COc1ccc(c(c1)C)Cl 34a_100000211092_100000747449 [1,1,0,0,0,0|2,0,0]=4 3937 B14R1.833 COC(=O)COc1ccc(c(c1)C)Cl 7a_100000211092_100000747449 [1,1,0,0,0,0|2,0,0]=4 3938 B14R1.833 COC(=O)COc1ccc(c(c1)C)F 34a_100000751312_100000747449 [1,1,0,0,0,0|2,0,0]=4 3939 B14R1.833 COC(=O)COc1ccc(c(c1)C)F 7a_100000751312_100000747449 [1,1,0,0,0,0|2,0,0]=4 3940 B14R1.833 COC(=O)COc1ccc(c(c1)C)I 34a_100000729255_100000747449 [1,1,0,0,0,0|2,0,0]=4 3941 B14R1.833 COC(=O)COc1ccc(c(c1)C)I 7a_100000729255_100000747449 [1,1,0,0,0,0|2,0,0]=4 3942 B14R1.833 COC(=O)COc1ccc(c(c1)C)N 34a_100000756630_100000747449 [1,1,0,0,0,0|2,0,0]=4 3943 B14R1.833 COC(=O)COc1ccc(c(c1)C)N 7a_100000756630_100000747449 [1,1,0,0,0,0|2,0,0]=4 3944 B14R1.833 COC(=O)COc1ccc(c(c1)N)O 271570a_203496583355_200010369463 [1,1,0,0,0,0|2,0,0]=4 3945 B14R1.833 COC(=O)CSc1cc(c(cn1)O)C 62a_100000747449_100000692680 [1,1,0,0,0,0|2,0,0]=4 3946 B14R1.833 COC(=O)CSc1ccc(c(c1)Br)O 62a_100000747449_100012361655 [1,1,0,0,0,0|2,0,0]=4 3947 B14R1.833 COC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000747449 [1,1,0,0,0,0|2,0,0]=4 3948 B14R1.833 COC(=O)CSc1ccc(c(c1)C)Br 62a_100000747449_100009813585 [1,1,0,0,0,0|2,0,0]=4 3949 B14R1.833 COC(=O)CSc1ccc(c(c1)C)Br 62a_100009813585_100000747449 [1,1,0,0,0,0|2,0,0]=4 3950 B14R1.833 COC(=O)CSc1ccc(c(c1)C)C 62a_100000747449_100011215607 [1,1,0,0,0,0|2,0,0]=4 3951 B14R1.833 COC(=O)CSc1ccc(c(c1)C)C 62a_100011215607_100000747449 [1,1,0,0,0,0|2,0,0]=4 3952 B14R1.833 COC(=O)CSc1ccc(c(c1)C)Cl 62a_100000049509_100000747449 [1,1,0,0,0,0|2,0,0]=4 3953 B14R1.833 COC(=O)CSc1ccc(c(c1)C)Cl 62a_100000747449_100000049509 [1,1,0,0,0,0|2,0,0]=4 3954 B14R1.833 COC(=O)CSc1ccc(c(c1)C)F 62a_100000747449_100011218330 [1,1,0,0,0,0|2,0,0]=4 3955 B14R1.833 COC(=O)CSc1ccc(c(c1)C)F 62a_100011218330_100000747449 [1,1,0,0,0,0|2,0,0]=4 3956 B14R1.833 COC(=O)CSc1ccc(c(c1)C)N 62a_100000211769_100000747449 [1,1,0,0,0,0|2,0,0]=4 3957 B14R1.833 COC(=O)CSc1ccc(c(c1)C)N 62a_100000747449_100000211769 [1,1,0,0,0,0|2,0,0]=4 3958 B14R1.833 COC(=O)CSc1ccc(c(c1)C)O 62a_100000747449_100000186361 [1,1,0,0,0,0|1,0,0]=3 3959 B14R1.833 COC(=O)CSc1ccc(c(c1)Cl)O 62a_100000747449_100012360047 [1,1,0,0,0,0|2,0,0]=4 3960 B14R1.833 COC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000747449 [1,1,0,0,0,0|2,0,0]=4 3961 B14R1.833 COC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000747449 [1,1,0,0,0,0|2,0,0]=4 3962 B14R1.833 COC(=O)CSc1ccc(c(c1)F)O 62a_100000747449_100000185481 [1,1,0,0,0,0|2,0,0]=4 3963 B14R1.833 COC(=O)CSc1ccc(c(c1)N)O 62a_100000747449_100000752626 [1,1,0,0,0,0|2,0,0]=4 3964 B14R1.833 COC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000747449 [1,1,0,0,0,0|2,0,0]=4 3965 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Br 62a_100000747449_100012356990 [1,1,0,0,0,0|2,0,0]=4 3966 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000747449 [1,1,0,0,0,0|2,0,0]=4 3967 B14R1.833 COC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000747449 [1,1,0,0,0,0|2,0,0]=4 3968 B14R1.833 COC(=O)CSc1ccc(c(c1)O)C 62a_100000747449_100000685420 [1,1,0,0,0,0|2,0,0]=4 3969 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Cl 62a_100000747449_100011356854 [1,1,0,0,0,0|2,0,0]=4 3970 B14R1.833 COC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000747449 [1,1,0,0,0,0|2,0,0]=4 3971 B14R1.833 COC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000747449 [1,1,0,0,0,0|2,0,0]=4 3972 B14R1.833 COC(=O)CSc1ccc(c(c1)O)F 62a_100000747449_100000686035 [1,1,0,0,0,0|2,0,0]=4 3973 B14R1.833 COC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000747449 [1,1,0,0,0,0|2,0,0]=4 3974 B14R1.833 COC(=O)CSc1ccc(c(c1)O)N 62a_100000747449_100000739049 [1,1,0,0,0,0|2,0,0]=4 3975 B14R1.833 COC(=O)CSc1ccc(c(c1)O)O 62a_100000747449_100009813601 [1,1,0,0,0,0|1,0,0]=3 3976 B14R1.833 COC(=O)CSc1ccc(c(n1)C)O 62a_100000747449_100010233687 [1,1,0,0,0,0|2,0,0]=4 3977 B14R1.833 COC(=O)CSc1ccc(c(n1)C)O 62a_100010233687_100000747449 [1,1,0,0,0,0|2,0,0]=4 3978 B14R1.833 COC(=O)CSc1cnc(c(c1)C)O 62a_100000685391_100000747449 [1,1,0,0,0,0|2,0,0]=4 3979 B14R1.833 COC(=O)CSc1cnc(c(c1)C)O 62a_100000747449_100000685391 [1,1,0,0,0,0|2,0,0]=4 3980 B14R1.833 Cc1cc(ccc1Br)CNC(=O)CO 240690a_100015205234_100000210174 [1,1,0,0,0,0|2,0,0]=4 3981 B14R1.833 Cc1cc(ccc1Br)CNC(=O)CO 527a_100015205234_100000210174 [1,1,0,0,0,0|2,0,0]=4 3982 B14R1.833 Cc1cc(ccc1Cl)OCC(=O)CF 1458a_100000182483_100015361967 [1,1,0,0,0,0|2,0,0]=4 3983 B14R1.833 Cc1cc(ccc1F)CCC(=O)CF 1458a_100011615030_100015361967 [1,1,0,0,0,0|1,0,0]=3 3984 B14R1.833 Cc1cc(ccc1F)CNC(=O)CO 240690a_100000239911_100000210174 [1,1,0,0,0,0|2,0,0]=4 3985 B14R1.833 Cc1cc(ccc1F)CNC(=O)CO 527a_100000239911_100000210174 [1,1,0,0,0,0|2,0,0]=4 3986 B14R1.833 Cc1ccc(cc1Br)CCC(=O)CF 1458a_100010220830_100015361967 [1,1,0,0,0,0|2,0,0]=4 3987 B14R1.833 Cc1ccc(cc1C)CCC(=O)CF 1458a_100011338283_100015361967 [1,1,0,0,0,0|1,0,0]=3 3988 B14R1.833 Cc1ccc(cc1C)CNC(=O)CO 240690a_100025706692_100000210174 [1,1,0,0,0,0|2,0,0]=4 3989 B14R1.833 Cc1ccc(cc1C)CNC(=O)CO 527a_100025706692_100000210174 [1,1,0,0,0,0|2,0,0]=4 3990 B14R1.833 Cc1ccc(cc1C)OCC(=O)CF 1458a_100000182425_100015361967 [1,1,0,0,0,0|2,0,0]=4 3991 B14R1.833 Cc1ccc(cc1F)CCC(=O)CF 1458a_100011830284_100015361967 [1,1,0,0,0,0|2,0,0]=4 3992 B14R1.833 O=C(CF)CCc1ccc(c(c1)Br)F 1458a_100011308364_100015361967 [1,1,0,0,0,0|2,0,0]=4 3993 B14R1.833 O=C(CF)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_100015361967 [1,1,0,0,0,0|2,0,0]=4 3994 B14R1.833 O=C(CF)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_100015361967 [1,1,0,0,0,0|2,0,0]=4 3995 B14R1.833 O=C(CF)CCc1ccc(c(c1)Cl)F 1458a_100011218152_100015361967 [1,1,0,0,0,0|2,0,0]=4 3996 B14R1.833 O=C(CF)CCc1ccc(c(c1)F)Br 1458a_100010146367_100015361967 [1,1,0,0,0,0|2,0,0]=4 3997 B14R1.833 O=C(CF)CCc1ccc(c(c1)F)Cl 1458a_100011518922_100015361967 [1,1,0,0,0,0|2,0,0]=4 3998 B14R1.833 O=C(CF)CCc1ccc(c(c1)F)F 1458a_100000737970_100015361967 [1,1,0,0,0,0|2,0,0]=4 3999 B14R1.833 O=C(CF)CCc1ccc(c(c1)O)O 1458a_100000042615_100015361967 [1,1,0,0,0,0|0,0,0]=2 4000 B14R1.833 O=C(CO)CCc1ccc(c(c1)Cl)Cl 1458a_100000210174_100011713676 [1,1,0,0,0,0|2,0,0]=4 4001 B14R1.833 O=C(CO)CCc1ccc(c(c1)Cl)F 1458a_100000210174_100012361305 [1,1,0,0,0,0|2,0,0]=4 4002 B14R1.833 O=C(CO)CCc1ccc(c(c1)F)F 1458a_100000210174_100000690553 [1,1,0,0,0,0|2,0,0]=4 4003 B14R1.833 O=C(CO)CCc1ccc(c(c1)O)O 1458a_100000210174_200010393615 [1,1,0,0,0,0|0,0,0]=2 4004 B14R1.833 O=C(CO)NCc1ccc(c(c1)F)O 240690a_100000758358_100000210174 [1,1,0,0,0,0|2,0,0]=4 4005 B14R1.833 O=C(CO)NCc1ccc(c(c1)F)O 527a_100000758358_100000210174 [1,1,0,0,0,0|2,0,0]=4 4006 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100000210174 [1,1,0,0,0,0|2,0,0]=4 4007 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)Cl 527a_100020636435_100000210174 [1,1,0,0,0,0|2,0,0]=4 4008 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)F 240690a_100160469508_100000210174 [1,1,0,0,0,0|2,0,0]=4 4009 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)F 527a_100160469508_100000210174 [1,1,0,0,0,0|2,0,0]=4 4010 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210174 [1,1,0,0,0,0|1,0,0]=3 4011 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)CO 34a_100000102464_100000748629 [1,1,0,0,0,0|2,0,0]=4 4012 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)OC 2230a_100000743268_100000748629 [1,1,0,0,0,0|2,0,0]=4 4013 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)OC 34a_100000743268_100000748629 [1,1,0,0,0,0|2,0,0]=4 4014 B14R1.3653 C=C(C)CNc1ccc(c(c1)C)OC 7a_100000743268_100000748629 [1,1,0,0,0,0|2,0,0]=4 4015 B14R1.3653 C=C(C)CNc1ccc(c(c1)O)OC 34a_100000211920_100000748629 [1,1,0,0,0,0|2,0,0]=4 4016 B14R1.3653 C=C(C)COc1ccc(c(c1)C)OC 34a_100000759738_100000748629 [1,1,0,0,0,0|2,0,0]=4 4017 B14R1.3653 C=C(C)COc1ccc(c(c1)C)OC 7a_100000759738_100000748629 [1,1,0,0,0,0|2,0,0]=4 4018 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)CO 62a_100000748258_100000211660 [1,1,0,0,0,0|2,0,0]=4 4019 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)CO 62a_100000748629_100000748258 [1,1,0,0,0,0|2,0,0]=4 4020 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)OC 62a_100000748629_100011219705 [1,1,0,0,0,0|2,0,0]=4 4021 B14R1.3653 C=C(C)CSc1ccc(c(c1)C)OC 62a_100011219705_100000211660 [1,1,0,0,0,0|2,0,0]=4 4022 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)CO 62a_100000071718_100000211660 [1,1,0,0,0,0|2,0,0]=4 4023 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)CO 62a_100000748629_100000071718 [1,1,0,0,0,0|2,0,0]=4 4024 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)OC 62a_100000748629_100009816560 [1,1,0,0,0,0|2,0,0]=4 4025 B14R1.3653 COc1ccc(cc1Br)CCC(=O)C 1458a_100000736731_200000210301 [1,1,0,0,0,0|1,0,0]=3 4026 B14R1.3653 COc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100000736731_200025704644 [1,1,0,0,0,0|1,0,0]=3 4027 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 11a_100159240714_100015343762 [1,1,0,0,0,0|2,0,0]=4 4028 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 1626a_100159240714_100015343762 [1,1,0,0,0,0|2,0,0]=4 4029 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 240690a_100159240714_100015343762 [1,1,0,0,0,0|2,0,0]=4 4030 B14R1.3653 COc1ccc(cc1Br)CNC(=O)C 527a_100159240714_100103153847 [1,1,0,0,0,0|2,0,0]=4 4031 B14R1.3653 COc1ccc(cc1C)C=CC(=O)C 1458a_100116352456_200000210301 [1,1,0,0,0,0|0,0,2]=4 4032 B14R1.3653 COc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100116352456_200025704644 [1,1,0,0,0,0|0,0,2]=4 4033 B14R1.3653 COc1ccc(cc1C)CCC(=O)C 1458a_100011616661_200000210301 [1,1,0,0,0,0|0,0,0]=2 4034 B14R1.3653 COc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011616661_200025704644 [1,1,0,0,0,0|0,0,0]=2 4035 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 11a_100102679029_100015343762 [1,1,0,0,0,0|1,0,0]=3 4036 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 1626a_100102679029_100015343762 [1,1,0,0,0,0|1,0,0]=3 4037 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 240690a_100102679029_100015343762 [1,1,0,0,0,0|1,0,0]=3 4038 B14R1.3653 COc1ccc(cc1C)CNC(=O)C 527a_100102679029_100103153847 [1,1,0,0,0,0|1,0,0]=3 4039 B14R1.3653 COc1ccc(cc1C)NCC(=O)N 2230a_100000743268_100000747473 [1,1,0,0,0,0|2,0,0]=4 4040 B14R1.3653 COc1ccc(cc1C)NCC(=O)N 34a_100000743268_100000187820 [1,1,0,0,0,0|2,0,0]=4 4041 B14R1.3653 COc1ccc(cc1C)NCC(=O)N 7a_100000743268_100000187820 [1,1,0,0,0,0|2,0,0]=4 4042 B14R1.3653 COc1ccc(cc1C)NCC(=O)[O-] 34a_100000743268_100020667443 [1,1,0,0,0,0|2,0,0]=4 4043 B14R1.3653 COc1ccc(cc1C)OCC(=O)N 34a_100000759738_100000187820 [1,1,0,0,0,0|2,0,0]=4 4044 B14R1.3653 COc1ccc(cc1C)OCC(=O)N 7a_100000759738_100000187820 [1,1,0,0,0,0|2,0,0]=4 4045 B14R1.3653 COc1ccc(cc1C)OCC(=O)[O-] 34a_100000759738_100020667443 [1,1,0,0,0,0|2,0,0]=4 4046 B14R1.3653 COc1ccc(cc1C)SCC(=O)N 62a_100000747473_100011219705 [1,1,0,0,0,0|2,0,0]=4 4047 B14R1.3653 COc1ccc(cc1C)SCC(=O)N 62a_100011219705_100000747473 [1,1,0,0,0,0|2,0,0]=4 4048 B14R1.3653 COc1ccc(cc1C)SCC(=O)[O-] 62a_100011219705_100020667443 [1,1,0,0,0,0|2,0,0]=4 4049 B14R1.3653 COc1ccc(cc1C)SCC(=O)[O-] 62a_100020667443_100011219705 [1,1,0,0,0,0|2,0,0]=4 4050 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)C 1458a_100000735577_200000210301 [1,1,0,0,0,0|1,0,0]=3 4051 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)[13CH3] 1458a_100000735577_200025704644 [1,1,0,0,0,0|1,0,0]=3 4052 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 11a_100000008799_100015343762 [1,1,0,0,0,0|2,0,0]=4 4053 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 1626a_100000008799_100015343762 [1,1,0,0,0,0|2,0,0]=4 4054 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 240690a_100000008799_100015343762 [1,1,0,0,0,0|2,0,0]=4 4055 B14R1.3653 COc1ccc(cc1Cl)CNC(=O)C 527a_100000008799_100103153847 [1,1,0,0,0,0|2,0,0]=4 4056 B14R1.3653 COc1ccc(cc1F)CCC(=O)C 1458a_100000234888_200000210301 [1,1,0,0,0,0|1,0,0]=3 4057 B14R1.3653 COc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100000234888_200025704644 [1,1,0,0,0,0|1,0,0]=3 4058 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 11a_100000737316_100015343762 [1,1,0,0,0,0|2,0,0]=4 4059 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 1626a_100000737316_100015343762 [1,1,0,0,0,0|2,0,0]=4 4060 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 240690a_100000737316_100015343762 [1,1,0,0,0,0|2,0,0]=4 4061 B14R1.3653 COc1ccc(cc1F)CNC(=O)C 527a_100000737316_100103153847 [1,1,0,0,0,0|2,0,0]=4 4062 B14R1.3653 COc1ccc(cc1O)/C=C/C(=O)C 271570a_203496583355_200016254069 [1,1,0,0,0,0|0,0,2]=4 4063 B14R1.3653 COc1ccc(cc1O)C=CC(=O)C 1458a_100000184920_200000210301 [1,1,0,0,0,0|0,0,2]=4 4064 B14R1.3653 COc1ccc(cc1O)C=CC(=O)[13CH3] 1458a_100000184920_200025704644 [1,1,0,0,0,0|0,0,2]=4 4065 B14R1.3653 COc1ccc(cc1O)CCC(=O)C 1458a_100000746301_200000210301 [1,1,0,0,0,0|0,0,0]=2 4066 B14R1.3653 COc1ccc(cc1O)CCC(=O)[13CH3] 1458a_100000746301_200025704644 [1,1,0,0,0,0|0,0,0]=2 4067 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 240690a_100000740000_100015343762 [1,1,0,0,0,0|1,0,0]=3 4068 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 527a_100000740000_100103153847 [1,1,0,0,0,0|1,0,0]=3 4069 B14R1.3653 COc1ccc(cc1O)NCC(=O)N 34a_100000211920_100000187820 [1,1,0,0,0,0|2,0,0]=4 4070 B14R1.3653 COc1ccc(cc1O)NCC(=O)[O-] 34a_100000211920_100020667443 [1,1,0,0,0,0|2,0,0]=4 4071 B14R1.3653 COc1ccc(cc1O)SCC(=O)N 62a_100000747473_100009816560 [1,1,0,0,0,0|2,0,0]=4 4072 B14R1.3653 COc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100009816560 [1,1,0,0,0,0|2,0,0]=4 4073 B14R1.3653 Cc1cc(ccc1CO)NCC(=O)N 34a_100000102464_100000187820 [1,1,0,0,0,0|2,0,0]=4 4074 B14R1.3653 Cc1cc(ccc1CO)NCC(=O)[O-] 34a_100000102464_100020667443 [1,1,0,0,0,0|2,0,0]=4 4075 B14R1.3653 Cc1cc(ccc1CO)SCC(=O)N 62a_100000747473_100000748258 [1,1,0,0,0,0|2,0,0]=4 4076 B14R1.3653 Cc1cc(ccc1CO)SCC(=O)N 62a_100000748258_100000747473 [1,1,0,0,0,0|2,0,0]=4 4077 B14R1.3653 Cc1cc(ccc1CO)SCC(=O)[O-] 62a_100000748258_100020667443 [1,1,0,0,0,0|2,0,0]=4 4078 B14R1.3653 Cc1cc(ccc1CO)SCC(=O)[O-] 62a_100020667443_100000748258 [1,1,0,0,0,0|2,0,0]=4 4079 B14R1.3653 NC(=O)CSc1ccc(c(c1)O)CO 62a_100000071718_100000747473 [1,1,0,0,0,0|2,0,0]=4 4080 B14R1.3653 NC(=O)CSc1ccc(c(c1)O)CO 62a_100000747473_100000071718 [1,1,0,0,0,0|2,0,0]=4 4081 B14R1.3653 O=C([O-])CSc1ccc(c(c1)O)CO 62a_100000071718_100020667443 [1,1,0,0,0,0|2,0,0]=4 4082 B14R1.3653 O=C([O-])CSc1ccc(c(c1)O)CO 62a_100020667443_100000071718 [1,1,0,0,0,0|2,0,0]=4 4083 B14R1.6036 C=C(C)CNc1cc(c(cc1C)O)C 34a_100000720036_100000748629 [1,1,0,0,0,0|2,0,0]=4 4084 B14R1.6036 C=C(C)CNc1cc(c(cc1C)O)C 7a_100000720036_100000748629 [1,1,0,0,0,0|2,0,0]=4 4085 B14R1.6036 C=C(C)CSc1cc(c(cc1C)O)C 62a_100000698207_100000211660 [1,1,0,0,0,0|2,0,0]=4 4086 B14R1.6036 C=C(C)CSc1cc(c(cc1C)O)C 62a_100000748629_100000698207 [1,1,0,0,0,0|2,0,0]=4 4087 B14R1.6036 CC(=O)CCc1cc(c(cc1F)F)F 1458a_100012351503_200000210301 [1,1,0,0,0,0|2,0,0]=4 4088 B14R1.6036 CC(=O)CSc1cc(c(cc1C)Br)C 1458a_100000679840_200000210301 [1,1,0,0,0,0|2,0,0]=4 4089 B14R1.6036 Cc1cc(c(cc1Br)C)SCC(=O)[13CH3] 1458a_100000679840_200025704644 [1,1,0,0,0,0|2,0,0]=4 4090 B14R1.6036 Cc1cc(c(cc1O)C)NCC(=O)N 34a_100000720036_100000187820 [1,1,0,0,0,0|2,0,0]=4 4091 B14R1.6036 Cc1cc(c(cc1O)C)NCC(=O)N 7a_100000720036_100000187820 [1,1,0,0,0,0|2,0,0]=4 4092 B14R1.6036 Cc1cc(c(cc1O)C)NCC(=O)[O-] 34a_100000720036_100020667443 [1,1,0,0,0,0|2,0,0]=4 4093 B14R1.6036 Cc1cc(c(cc1O)C)SCC(=O)N 62a_100000698207_100000747473 [1,1,0,0,0,0|2,0,0]=4 4094 B14R1.6036 Cc1cc(c(cc1O)C)SCC(=O)N 62a_100000747473_100000698207 [1,1,0,0,0,0|2,0,0]=4 4095 B14R1.6036 Cc1cc(c(cc1O)C)SCC(=O)[O-] 62a_100000698207_100020667443 [1,1,0,0,0,0|2,0,0]=4 4096 B14R1.6036 Cc1cc(c(cc1O)C)SCC(=O)[O-] 62a_100020667443_100000698207 [1,1,0,0,0,0|2,0,0]=4 4097 B14R1.6036 [13CH3]C(=O)CCc1cc(c(cc1F)F)F 1458a_100012351503_200025704644 [1,1,0,0,0,0|2,0,0]=4 4098 B14R1.6059 C=C(C)CNc1ccc(c(c1C)C)O 34a_200011216674_100000748629 [1,1,0,0,0,0|2,0,0]=4 4099 B14R1.6059 C=C(C)CNc1ccc(c(c1C)C)O 7a_200011216674_100000748629 [1,1,0,0,0,0|2,0,0]=4 4100 B14R1.6059 C=C(C)CNc1ccc(c(c1F)C)O 34a_200000126710_100000748629 [1,1,0,0,0,0|2,0,0]=4 4101 B14R1.6059 C=C(C)CNc1ccc(c(c1F)C)O 7a_200000126710_100000748629 [1,1,0,0,0,0|2,0,0]=4 4102 B14R1.6059 C=C(C)CSc1ccc(c(c1C)C)O 62a_100000748629_100012353674 [1,1,0,0,0,0|2,0,0]=4 4103 B14R1.6059 C=C(C)CSc1ccc(c(c1C)C)O 62a_100012353674_100000211660 [1,1,0,0,0,0|2,0,0]=4 4104 B14R1.6059 C=C(C)CSc1ccc(c(c1F)C)O 62a_100000748629_100010390934 [1,1,0,0,0,0|2,0,0]=4 4105 B14R1.6059 C=C(C)CSc1ccc(c(c1F)C)O 62a_100010390934_100000211660 [1,1,0,0,0,0|2,0,0]=4 4106 B14R1.6059 CC(=O)CCc1ccc(c(c1F)F)F 1458a_100012351501_200000210301 [1,1,0,0,0,0|2,0,0]=4 4107 B14R1.6059 CC(=O)NCc1ccc(c(c1F)C)F 11a_200000062210_100015343762 [1,1,0,0,0,0|2,0,0]=4 4108 B14R1.6059 CC(=O)NCc1ccc(c(c1F)C)F 1626a_200000062210_100015343762 [1,1,0,0,0,0|2,0,0]=4 4109 B14R1.6059 CC(=O)NCc1ccc(c(c1F)C)F 240690a_200000062210_100015343762 [1,1,0,0,0,0|2,0,0]=4 4110 B14R1.6059 CC(=O)NCc1ccc(c(c1F)C)F 527a_200000062210_100103153847 [1,1,0,0,0,0|2,0,0]=4 4111 B14R1.6059 Cc1c(ccc(c1C)NCC(=O)N)O 34a_200011216674_100000187820 [1,1,0,0,0,0|2,0,0]=4 4112 B14R1.6059 Cc1c(ccc(c1C)NCC(=O)N)O 7a_200011216674_100000187820 [1,1,0,0,0,0|2,0,0]=4 4113 B14R1.6059 Cc1c(ccc(c1C)NCC(=O)[O-])O 34a_200011216674_100020667443 [1,1,0,0,0,0|2,0,0]=4 4114 B14R1.6059 Cc1c(ccc(c1C)SCC(=O)N)O 62a_100000747473_100012353674 [1,1,0,0,0,0|2,0,0]=4 4115 B14R1.6059 Cc1c(ccc(c1C)SCC(=O)N)O 62a_100012353674_100000747473 [1,1,0,0,0,0|2,0,0]=4 4116 B14R1.6059 Cc1c(ccc(c1C)SCC(=O)[O-])O 62a_100012353674_100020667443 [1,1,0,0,0,0|2,0,0]=4 4117 B14R1.6059 Cc1c(ccc(c1C)SCC(=O)[O-])O 62a_100020667443_100012353674 [1,1,0,0,0,0|2,0,0]=4 4118 B14R1.6059 Cc1c(ccc(c1F)NCC(=O)N)O 34a_200000126710_100000187820 [1,1,0,0,0,0|2,0,0]=4 4119 B14R1.6059 Cc1c(ccc(c1F)NCC(=O)N)O 7a_200000126710_100000187820 [1,1,0,0,0,0|2,0,0]=4 4120 B14R1.6059 Cc1c(ccc(c1F)NCC(=O)[O-])O 34a_200000126710_100020667443 [1,1,0,0,0,0|2,0,0]=4 4121 B14R1.6059 Cc1c(ccc(c1F)SCC(=O)N)O 62a_100000747473_100010390934 [1,1,0,0,0,0|2,0,0]=4 4122 B14R1.6059 Cc1c(ccc(c1F)SCC(=O)N)O 62a_100010390934_100000747473 [1,1,0,0,0,0|2,0,0]=4 4123 B14R1.6059 Cc1c(ccc(c1F)SCC(=O)[O-])O 62a_100010390934_100020667443 [1,1,0,0,0,0|2,0,0]=4 4124 B14R1.6059 Cc1c(ccc(c1F)SCC(=O)[O-])O 62a_100020667443_100010390934 [1,1,0,0,0,0|2,0,0]=4 4125 B14R1.6059 [13CH3]C(=O)CCc1ccc(c(c1F)F)F 1458a_100012351501_200025704644 [1,1,0,0,0,0|2,0,0]=4 4126 B14R1.15552 C=C(C)CNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000748629 [1,1,0,0,0,0|2,0,0]=4 4127 B14R1.15552 C=C(C)CNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000748629 [1,1,0,0,0,0|2,0,0]=4 4128 B14R1.15552 C=C(C)CNc1cc(c(c(c1)C)O)C 34a_100000703291_100000748629 [1,1,0,0,0,0|2,0,0]=4 4129 B14R1.15552 C=C(C)CNc1cc(c(c(c1)C)O)C 7a_100000703291_100000748629 [1,1,0,0,0,0|2,0,0]=4 4130 B14R1.15552 C=C(C)CSc1cc(c(c(c1)Br)O)C 62a_100000748629_100010982682 [1,1,0,0,0,0|2,0,0]=4 4131 B14R1.15552 C=C(C)CSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000211660 [1,1,0,0,0,0|2,0,0]=4 4132 B14R1.15552 C=C(C)CSc1cc(c(c(c1)C)O)C 62a_100000748629_100011216129 [1,1,0,0,0,0|2,0,0]=4 4133 B14R1.15552 C=C(C)CSc1cc(c(c(c1)C)O)C 62a_100011216129_100000211660 [1,1,0,0,0,0|2,0,0]=4 4134 B14R1.15552 C=C(C)CSc1cc(c(c(c1)Cl)O)C 62a_100000748629_200015900153 [1,1,0,0,0,0|2,0,0]=4 4135 B14R1.15552 C=C(C)CSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000211660 [1,1,0,0,0,0|2,0,0]=4 4136 B14R1.15552 C=C(C)CSc1cc(c(c(c1)F)O)O 62a_100000748629_100010114375 [1,1,0,0,0,0|2,0,0]=4 4137 B14R1.15552 C=C(C)CSc1cc(c(c(c1)N)O)C 62a_100000748629_100011825904 [1,1,0,0,0,0|2,0,0]=4 4138 B14R1.15552 C=C(C)CSc1cc(c(c(c1)N)O)C 62a_100011825904_100000211660 [1,1,0,0,0,0|2,0,0]=4 4139 B14R1.15552 C=C(C)CSc1cc(c(c(c1)O)O)O 62a_100000748629_100010658518 [1,1,0,0,0,0|2,0,0]=4 4140 B14R1.15552 CC(=O)CCc1cc(c(c(c1)Br)O)Br 1458a_100009814134_200000210301 [1,1,0,0,0,0|1,0,0]=3 4141 B14R1.15552 CC(=O)CCc1cc(c(c(c1)F)F)F 1458a_100011800984_200000210301 [1,1,0,0,0,0|2,0,0]=4 4142 B14R1.15552 CC(=O)CCc1cc(c(c(c1)I)O)I 1458a_200000072802_200000210301 [1,1,0,0,0,0|1,0,0]=3 4143 B14R1.15552 CC(=O)COc1cc(c(c(c1)C)Cl)C 1458a_100000187253_200000210301 [1,1,0,0,0,0|2,0,0]=4 4144 B14R1.15552 Cc1cc(cc(c1Cl)C)OCC(=O)[13CH3] 1458a_100000187253_200025704644 [1,1,0,0,0,0|2,0,0]=4 4145 B14R1.15552 Cc1cc(cc(c1O)Br)NCC(=O)N 34a_100010064301_100000187820 [1,1,0,0,0,0|2,0,0]=4 4146 B14R1.15552 Cc1cc(cc(c1O)Br)NCC(=O)N 7a_100010064301_100000187820 [1,1,0,0,0,0|2,0,0]=4 4147 B14R1.15552 Cc1cc(cc(c1O)Br)NCC(=O)[O-] 34a_100010064301_100020667443 [1,1,0,0,0,0|2,0,0]=4 4148 B14R1.15552 Cc1cc(cc(c1O)Br)SCC(=O)N 62a_100000747473_100010982682 [1,1,0,0,0,0|2,0,0]=4 4149 B14R1.15552 Cc1cc(cc(c1O)Br)SCC(=O)N 62a_100010982682_100000747473 [1,1,0,0,0,0|2,0,0]=4 4150 B14R1.15552 Cc1cc(cc(c1O)Br)SCC(=O)[O-] 62a_100010982682_100020667443 [1,1,0,0,0,0|2,0,0]=4 4151 B14R1.15552 Cc1cc(cc(c1O)Br)SCC(=O)[O-] 62a_100020667443_100010982682 [1,1,0,0,0,0|2,0,0]=4 4152 B14R1.15552 Cc1cc(cc(c1O)C)NCC(=O)N 34a_100000703291_100000187820 [1,1,0,0,0,0|2,0,0]=4 4153 B14R1.15552 Cc1cc(cc(c1O)C)NCC(=O)N 7a_100000703291_100000187820 [1,1,0,0,0,0|2,0,0]=4 4154 B14R1.15552 Cc1cc(cc(c1O)C)NCC(=O)[O-] 34a_100000703291_100020667443 [1,1,0,0,0,0|2,0,0]=4 4155 B14R1.15552 Cc1cc(cc(c1O)C)SCC(=O)N 62a_100000747473_100011216129 [1,1,0,0,0,0|2,0,0]=4 4156 B14R1.15552 Cc1cc(cc(c1O)C)SCC(=O)N 62a_100011216129_100000747473 [1,1,0,0,0,0|2,0,0]=4 4157 B14R1.15552 Cc1cc(cc(c1O)C)SCC(=O)[O-] 62a_100011216129_100020667443 [1,1,0,0,0,0|2,0,0]=4 4158 B14R1.15552 Cc1cc(cc(c1O)C)SCC(=O)[O-] 62a_100020667443_100011216129 [1,1,0,0,0,0|2,0,0]=4 4159 B14R1.15552 Cc1cc(cc(c1O)Cl)SCC(=O)N 62a_100000747473_200015900153 [1,1,0,0,0,0|2,0,0]=4 4160 B14R1.15552 Cc1cc(cc(c1O)Cl)SCC(=O)N 62a_200015900153_100000747473 [1,1,0,0,0,0|2,0,0]=4 4161 B14R1.15552 Cc1cc(cc(c1O)Cl)SCC(=O)[O-] 62a_100020667443_200015900153 [1,1,0,0,0,0|2,0,0]=4 4162 B14R1.15552 Cc1cc(cc(c1O)Cl)SCC(=O)[O-] 62a_200015900153_100020667443 [1,1,0,0,0,0|2,0,0]=4 4163 B14R1.15552 Cc1cc(cc(c1O)N)SCC(=O)N 62a_100000747473_100011825904 [1,1,0,0,0,0|2,0,0]=4 4164 B14R1.15552 Cc1cc(cc(c1O)N)SCC(=O)N 62a_100011825904_100000747473 [1,1,0,0,0,0|2,0,0]=4 4165 B14R1.15552 Cc1cc(cc(c1O)N)SCC(=O)[O-] 62a_100011825904_100020667443 [1,1,0,0,0,0|2,0,0]=4 4166 B14R1.15552 Cc1cc(cc(c1O)N)SCC(=O)[O-] 62a_100020667443_100011825904 [1,1,0,0,0,0|2,0,0]=4 4167 B14R1.15552 NC(=O)CSc1cc(c(c(c1)F)O)O 62a_100000747473_100010114375 [1,1,0,0,0,0|2,0,0]=4 4168 B14R1.15552 NC(=O)CSc1cc(c(c(c1)O)O)O 62a_100000747473_100010658518 [1,1,0,0,0,0|2,0,0]=4 4169 B14R1.15552 O=C([O-])CSc1cc(c(c(c1)F)O)O 62a_100020667443_100010114375 [1,1,0,0,0,0|2,0,0]=4 4170 B14R1.15552 O=C([O-])CSc1cc(c(c(c1)O)O)O 62a_100020667443_100010658518 [1,1,0,0,0,0|2,0,0]=4 4171 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)Br)O)Br 1458a_100009814134_200025704644 [1,1,0,0,0,0|1,0,0]=3 4172 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)F)F)F 1458a_100011800984_200025704644 [1,1,0,0,0,0|2,0,0]=4 4173 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)I)O)I 1458a_200000072802_200025704644 [1,1,0,0,0,0|1,0,0]=3 4174 B14R1.626 C=CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210623 [1,1,0,0,0,0|0,0,2]=4 4175 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210303 [1,1,0,0,0,0|0,0,2]=4 4176 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)O 7a_106832991635_100010206313 [1,1,0,0,0,0|1,0,1]=4 4177 B14R1.626 COC[C@@H](N)c1ccc(c(c1)OC)F 34a_100138412295_200000210301 [1,1,0,0,0,0|2,0,0]=4 4178 B14R1.626 COc1cc(ccc1F)N(C)CC=O 2230a_200012002703_200015260668 [1,1,0,0,0,0|2,0,0]=4 4179 B14R1.626 COc1cc(ccc1F)N(C)CC=O 269982a_200012002703_200015260668 [1,1,0,0,0,0|2,0,0]=4 4180 B14R1.626 COc1cc(ccc1F)N(C)CC=O 34a_200012002703_200009817547 [1,1,0,0,0,0|2,0,0]=4 4181 B14R1.626 COc1cc(ccc1F)[C@H](N)CO[13CH3] 34a_100138412295_200025704644 [1,1,0,0,0,0|2,0,0]=4 4182 B14R1.626 COc1cc(ccc1O)C(=O)CSC 62a_100010206313_200000210301 [1,1,0,0,0,0|1,0,1]=4 4183 B14R1.626 COc1cc(ccc1O)C(=O)CS[13CH3] 62a_100010206313_200025704644 [1,1,0,0,0,0|1,0,1]=4 4184 B14R1.791 CCCCc1ccc(c(c1)CNC)O 271570a_100020621405_100011602694 [1,1,0,0,0,0|1,0,1]=4 4185 B14R1.791 CCCCc1ccc(c(c1)COC)Br 271570a_100020621405_202125822959 [1,1,0,0,0,0|1,0,1]=4 4186 B14R1.791 CCCCc1ccc(c(c1)COC)F 271570a_100020621405_100010140362 [1,1,0,0,0,0|1,0,1]=4 4187 B14R1.791 CCCCc1ccc(c(c1)OCC)C 271570a_100020621405_100012361169 [1,1,0,0,0,0|1,0,1]=4 4188 B14R1.791 CCCCc1ccc(c(c1)OCC)F 271570a_100020621405_200012344967 [1,1,0,0,0,0|1,0,1]=4 4189 B14R1.791 CCCCc1ccc(c(c1)OCC)N 271570a_100020621405_100000688918 [1,1,0,0,0,0|1,0,1]=4 4190 B14R1.791 CCNCc1ccc(c(c1)OCC)O 34a_200000751567_100000210202 [1,1,0,0,0,0|1,0,1]=4 4191 B14R1.791 CCOc1cc(ccc1Br)NCC=O 2230a_200016990551_200015260668 [1,1,0,0,0,0|2,0,0]=4 4192 B14R1.791 CCOc1cc(ccc1Br)NCC=O 34a_200016990551_200009817547 [1,1,0,0,0,0|2,0,0]=4 4193 B14R1.791 CCOc1cc(ccc1Br)NCC=O 7a_200016990551_200015260668 [1,1,0,0,0,0|2,0,0]=4 4194 B14R1.791 CCOc1cc(ccc1C)SCC=O 62a_100012361169_200015260668 [1,1,0,0,0,0|2,0,0]=4 4195 B14R1.791 CCOc1cc(ccc1C)SCC=O 62a_200015260668_100012361169 [1,1,0,0,0,0|2,0,0]=4 4196 B14R1.791 CCOc1cc(ccc1Cl)NCC=O 2230a_100011964961_200015260668 [1,1,0,0,0,0|2,0,0]=4 4197 B14R1.791 CCOc1cc(ccc1Cl)NCC=O 34a_100011964961_200009817547 [1,1,0,0,0,0|2,0,0]=4 4198 B14R1.791 CCOc1cc(ccc1F)SCC=O 62a_200012344967_200015260668 [1,1,0,0,0,0|2,0,0]=4 4199 B14R1.791 CCOc1cc(ccc1F)SCC=O 62a_200015260668_200012344967 [1,1,0,0,0,0|2,0,0]=4 4200 B14R1.791 CCOc1cc(ccc1N)SCC=O 62a_100000688918_200015260668 [1,1,0,0,0,0|2,0,0]=4 4201 B14R1.791 CNCc1cc(ccc1O)SCC=O 62a_100011602694_200015260668 [1,1,0,0,0,0|2,0,0]=4 4202 B14R1.791 CNCc1cc(ccc1O)SCC=O 62a_200015260668_100011602694 [1,1,0,0,0,0|2,0,0]=4 4203 B14R1.791 COCc1cc(ccc1Br)SCC=O 62a_200015260668_202125822959 [1,1,0,0,0,0|2,0,0]=4 4204 B14R1.791 COCc1cc(ccc1Br)SCC=O 62a_202125822959_200015260668 [1,1,0,0,0,0|2,0,0]=4 4205 B14R1.791 COCc1cc(ccc1F)SCC=O 62a_100010140362_200015260668 [1,1,0,0,0,0|2,0,0]=4 4206 B14R1.791 COCc1cc(ccc1F)SCC=O 62a_200015260668_100010140362 [1,1,0,0,0,0|2,0,0]=4 4207 B14R1.793 C=CCNc1ccc(c(c1)OC)CO 34a_100012183141_100015514636 [1,1,0,0,0,0|1,0,1]=4 4208 B14R1.793 C=CCNc1ccc(c(c1)OC)OC 34a_100000187404_100015514636 [1,1,0,0,0,0|1,0,1]=4 4209 B14R1.793 C=CCOc1ccc(c(c1)OC)CO 34a_200000116926_100015514636 [1,1,0,0,0,0|1,0,1]=4 4210 B14R1.793 C=CCOc1ccc(c(c1)OC)OC 34a_100000039706_100015514636 [1,1,0,0,0,0|1,0,1]=4 4211 B14R1.793 C=CCSc1ccc(c(c1)OC)CO 62a_100000210623_100011277633 [1,1,0,0,0,0|1,0,1]=4 4212 B14R1.793 C=CCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210623 [1,1,0,0,0,0|1,0,1]=4 4213 B14R1.793 C=CCSc1ccc(c(c1)OC)OC 62a_100000210623_100011356967 [1,1,0,0,0,0|1,0,1]=4 4214 B14R1.793 CC=NNc1ccc(c(c1)OC)OC 4a_100000071703_200000210099 [1,1,0,0,0,0|2,0,0]=4 4215 B14R1.793 CCCCc1cc(c(cn1)CO)OC 271570a_100020621405_100010714672 [1,1,0,0,0,0|1,0,1]=4 4216 B14R1.793 CCCCc1ccc(c(c1)CC)OC 271570a_100020621405_200010179862 [1,1,0,0,0,0|1,0,1]=4 4217 B14R1.793 CCCCc1ccc(c(c1)OC)C#N 271570a_100020621405_100000694671 [1,1,0,0,0,0|1,0,1]=4 4218 B14R1.793 CCCCc1ccc(c(c1)OC)C=O 271570a_100020621405_100000697075 [1,1,0,0,0,0|0,0,2]=4 4219 B14R1.793 CCCCc1ccc(c(c1)OC)CC 271570a_100020621405_200010710398 [1,1,0,0,0,0|1,0,1]=4 4220 B14R1.793 CCCCc1ccc(c(c1)OC)CO 271570a_100020621405_100011277633 [1,1,0,0,0,0|0,0,1]=3 4221 B14R1.793 CCCCc1ccc(c(c1)OC)OC 271570a_100020621405_100000187503 [1,1,0,0,0,0|0,0,1]=3 4222 B14R1.793 CCCCc1ccc(c(c1)OC)SC 271570a_100020621405_200011001119 [1,1,0,0,0,0|0,1,1]=4 4223 B14R1.793 CCCCc1ccc(c(c1)SC)OC 271570a_100020621405_200009892704 [1,1,0,0,0,0|0,1,1]=4 4224 B14R1.793 CCCCc1ccc(c(n1)OC)CO 271570a_100020621405_100010988397 [1,1,0,0,0,0|1,0,1]=4 4225 B14R1.793 CCCCc1ccc(c(n1)OC)OC 271570a_100020621405_100010214848 [1,1,0,0,0,0|1,0,1]=4 4226 B14R1.793 CCCCc1cnc(c(c1)OC)CO 271570a_100020621405_200010246159 [1,1,0,0,0,0|1,0,1]=4 4227 B14R1.793 CCCCc1cnc(c(c1)OC)OC 271570a_100020621405_100010234541 [1,1,0,0,0,0|1,0,1]=4 4228 B14R1.793 CCCNc1ccc(c(c1)OC)CO 34a_100012183141_100000210303 [1,1,0,0,0,0|1,0,1]=4 4229 B14R1.793 CCCNc1ccc(c(c1)OC)OC 34a_100000187404_100000210303 [1,1,0,0,0,0|1,0,1]=4 4230 B14R1.793 CCCOc1ccc(c(c1)OC)CO 34a_200000116926_100000210303 [1,1,0,0,0,0|1,0,1]=4 4231 B14R1.793 CCCOc1ccc(c(c1)OC)OC 34a_100000039706_100000210303 [1,1,0,0,0,0|1,0,1]=4 4232 B14R1.793 CCCSc1ccc(c(c1)OC)CO 62a_100000210303_100011277633 [1,1,0,0,0,0|1,0,1]=4 4233 B14R1.793 CCCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210303 [1,1,0,0,0,0|1,0,1]=4 4234 B14R1.793 CCCSc1ccc(c(c1)OC)OC 62a_100000210303_100011356967 [1,1,0,0,0,0|1,0,1]=4 4235 B14R1.793 CCNCc1ccc(c(c1)OC)OC 207a_100015525214_100000170513 [1,1,0,0,0,0|1,0,1]=4 4236 B14R1.793 CCNCc1ccc(c(c1)OC)OC 2230a_100015525214_100011233839 [1,1,0,0,0,0|1,0,1]=4 4237 B14R1.793 CCNCc1ccc(c(c1)OC)OC 270004a_100015525214_100000170513 [1,1,0,0,0,0|1,0,1]=4 4238 B14R1.793 CCNCc1ccc(c(c1)OC)OC 34a_100000185555_100000210202 [1,1,0,0,0,0|1,0,1]=4 4239 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000083705_200000210301 [1,1,0,0,0,0|1,0,1]=4 4240 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000210929_100000210202 [1,1,0,0,0,0|1,0,1]=4 4241 B14R1.793 CCOCc1ccc(c(c1)OC)OC 7a_100000083705_200000210301 [1,1,0,0,0,0|1,0,1]=4 4242 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 34a_100000083705_200025704644 [1,1,0,0,0,0|1,0,1]=4 4243 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 7a_100000083705_200025704644 [1,1,0,0,0,0|1,0,1]=4 4244 B14R1.793 CCSCc1ccc(c(c1)OC)OC 62a_100000210202_100011233839 [1,1,0,0,0,0|1,0,1]=4 4245 B14R1.793 CCc1cc(ccc1OC)SCC=O 62a_200010179862_200015260668 [1,1,0,0,0,0|2,0,0]=4 4246 B14R1.793 CCc1cc(ccc1OC)SCC=O 62a_200015260668_200010179862 [1,1,0,0,0,0|2,0,0]=4 4247 B14R1.793 CCc1ccc(cc1OC)SCC=O 62a_200010710398_200015260668 [1,1,0,0,0,0|2,0,0]=4 4248 B14R1.793 CCc1ccc(cc1OC)SCC=O 62a_200015260668_200010710398 [1,1,0,0,0,0|2,0,0]=4 4249 B14R1.793 CNCCc1ccc(c(c1)OC)OC 2230a_100000210947_200000210301 [1,1,0,0,0,0|1,0,0]=3 4250 B14R1.793 CNCCc1ccc(c(c1)OC)OC 2230a_106832991635_100011273988 [1,1,0,0,0,0|1,0,0]=3 4251 B14R1.793 CNCCc1ccc(c(c1)OC)OC 270004a_106832991635_100011754369 [1,1,0,0,0,0|1,0,0]=3 4252 B14R1.793 CNCCc1ccc(c(c1)OC)OC 34a_100000210947_200000210301 [1,1,0,0,0,0|1,0,0]=3 4253 B14R1.793 CNCCc1ccc(c(c1)OC)OC 34a_100102657272_100011273988 [1,1,0,0,0,0|1,0,0]=3 4254 B14R1.793 CNCCc1ccc(c(c1)OC)OC 7a_106832991635_100011740610 [1,1,0,0,0,0|1,0,0]=3 4255 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100011215274_200000210301 [1,1,0,0,0,0|1,0,0]=3 4256 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100138415774_100011273988 [1,1,0,0,0,0|1,0,0]=3 4257 B14R1.793 COCSc1ccc(c(c1)OC)CO 62a_100000766300_100011277633 [1,1,0,0,0,0|2,0,0]=4 4258 B14R1.793 COCSc1ccc(c(c1)OC)CO 62a_100011277633_100000766300 [1,1,0,0,0,0|2,0,0]=4 4259 B14R1.793 COCSc1ccc(c(c1)OC)OC 62a_100000766300_100011356967 [1,1,0,0,0,0|2,0,0]=4 4260 B14R1.793 COc1cc(ccc1C#N)NCC=O 34a_100011999456_200009817547 [1,1,0,0,0,0|2,0,0]=4 4261 B14R1.793 COc1cc(ccc1C#N)SCC=O 62a_200015260668_100000694671 [1,1,0,0,0,0|2,0,0]=4 4262 B14R1.793 COc1cc(ccc1C=O)SCC=O 62a_100000697075_200015260668 [1,1,0,0,0,0|1,0,1]=4 4263 B14R1.793 COc1cc(ccc1C=O)SCC=O 62a_200015260668_100010290300 [1,1,0,0,0,0|1,0,1]=4 4264 B14R1.793 COc1cc(ccc1CO)NCC=O 34a_100012183141_200009817547 [1,1,0,0,0,0|1,0,0]=3 4265 B14R1.793 COc1cc(ccc1CO)NCSC 34a_100012183141_100011218213 [1,1,0,0,0,0|2,0,0]=4 4266 B14R1.793 COc1cc(ccc1CO)OCC=O 34a_200000116926_200009817547 [1,1,0,0,0,0|1,0,0]=3 4267 B14R1.793 COc1cc(ccc1CO)OCSC 34a_200000116926_100011218213 [1,1,0,0,0,0|2,0,0]=4 4268 B14R1.793 COc1cc(ccc1CO)SCC=O 62a_100011277633_200015260668 [1,1,0,0,0,0|1,0,0]=3 4269 B14R1.793 COc1cc(ccc1CO)SCC=O 62a_200015260668_100011277633 [1,1,0,0,0,0|1,0,0]=3 4270 B14R1.793 COc1cc(ccc1CO)SCSC 62a_100011218213_100011277633 [1,1,0,0,0,0|2,0,0]=4 4271 B14R1.793 COc1cc(ccc1CO)SCSC 62a_100011277633_100011218213 [1,1,0,0,0,0|2,0,0]=4 4272 B14R1.793 COc1cc(ccc1O[13CH3])CCCO 34a_100000060467_200025704644 [1,1,0,0,0,0|0,0,2]=4 4273 B14R1.793 COc1cc(ccc1O[13CH3])CCCO 7a_100000060467_200025704644 [1,1,0,0,0,0|0,0,2]=4 4274 B14R1.793 COc1cc(ccc1SC)SCC=O 62a_200011001119_200015260668 [1,1,0,0,0,0|1,1,0]=4 4275 B14R1.793 COc1cc(cnc1CO)SCC=O 62a_200010246159_200015260668 [1,1,0,0,0,0|2,0,0]=4 4276 B14R1.793 COc1cc(cnc1CO)SCC=O 62a_200015260668_200010246159 [1,1,0,0,0,0|2,0,0]=4 4277 B14R1.793 COc1cc(cnc1OC)SCC=O 62a_200015260668_100010234541 [1,1,0,0,0,0|2,0,0]=4 4278 B14R1.793 COc1cc(ncc1CO)SCC=O 62a_100010714672_200015260668 [1,1,0,0,0,0|2,0,0]=4 4279 B14R1.793 COc1cc(ncc1CO)SCC=O 62a_200015260668_100010714672 [1,1,0,0,0,0|2,0,0]=4 4280 B14R1.793 COc1ccc(cc1OC)CCCO 34a_100000060467_200000210301 [1,1,0,0,0,0|0,0,2]=4 4281 B14R1.793 COc1ccc(cc1OC)CCCO 7a_100000060467_200000210301 [1,1,0,0,0,0|0,0,2]=4 4282 B14R1.793 COc1ccc(cc1OC)CCN[13CH3] 2230a_100000210947_200025704644 [1,1,0,0,0,0|1,0,0]=3 4283 B14R1.793 COc1ccc(cc1OC)CCN[13CH3] 34a_100000210947_200025704644 [1,1,0,0,0,0|1,0,0]=3 4284 B14R1.793 COc1ccc(cc1OC)CCO[13CH3] 34a_100011215274_200025704644 [1,1,0,0,0,0|1,0,0]=3 4285 B14R1.793 COc1ccc(cc1OC)CCSC 62a_200000210301_100011740610 [1,1,0,0,0,0|1,0,0]=3 4286 B14R1.793 COc1ccc(cc1OC)CCS[13CH3] 62a_200025704644_100011740610 [1,1,0,0,0,0|1,0,0]=3 4287 B14R1.793 COc1ccc(cc1OC)NCC=O 34a_100000187404_200009817547 [1,1,0,0,0,0|1,0,0]=3 4288 B14R1.793 COc1ccc(cc1OC)NCSC 34a_100000187404_100011218213 [1,1,0,0,0,0|2,0,0]=4 4289 B14R1.793 COc1ccc(cc1OC)OCC=O 34a_100000039706_200009817547 [1,1,0,0,0,0|1,0,0]=3 4290 B14R1.793 COc1ccc(cc1OC)OCSC 34a_100000039706_100011218213 [1,1,0,0,0,0|2,0,0]=4 4291 B14R1.793 COc1ccc(cc1OC)SCC=O 62a_200015260668_100011356967 [1,1,0,0,0,0|1,0,0]=3 4292 B14R1.793 COc1ccc(cc1OC)SCSC 62a_100011218213_100011356967 [1,1,0,0,0,0|2,0,0]=4 4293 B14R1.793 COc1ccc(cc1SC)SCC=O 62a_200009892704_200015260668 [1,1,0,0,0,0|1,1,0]=4 4294 B14R1.793 COc1ccc(nc1OC)SCC=O 62a_200015260668_100010214848 [1,1,0,0,0,0|2,0,0]=4 4295 B14R1.793 COc1nc(ccc1CO)SCC=O 62a_100010988397_200015260668 [1,1,0,0,0,0|2,0,0]=4 4296 B14R1.793 COc1nc(ccc1CO)SCC=O 62a_200015260668_100010988397 [1,1,0,0,0,0|2,0,0]=4 4297 B14R1.794 CC(C)c1cc(ccc1O)SCC=O 62a_100000691460_200015260668 [1,1,0,0,0,0|2,0,0]=4 4298 B14R1.794 CC(C)c1cc(ccc1O)SCC=O 62a_200015260668_100000691460 [1,1,0,0,0,0|2,0,0]=4 4299 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)O 271570a_100020621405_100000212127 [1,1,0,0,0,0|1,0,1]=4 4300 B14R1.794 CCCCc1ccc(c(c1)C(C)C)O 271570a_100020621405_100000691460 [1,1,0,0,0,0|1,0,1]=4 4301 B14R1.907 C#CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000688953 [1,1,0,0,0,0|0,0,2]=4 4302 B14R1.907 C#CCCSc1ccc(c(c1)OC)O 62a_100000688953_100000694246 [1,1,0,0,0,0|0,0,2]=4 4303 B14R1.907 C#CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000184674 [1,1,0,0,0,0|0,0,2]=4 4304 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)Br 34a_100000765947_100102629194 [1,1,0,0,0,0|1,0,1]=4 4305 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)C 34a_100011279678_100102629194 [1,1,0,0,0,0|1,0,1]=4 4306 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)Cl 34a_100000742311_100102629194 [1,1,0,0,0,0|1,0,1]=4 4307 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)F 34a_100000701188_100102629194 [1,1,0,0,0,0|1,0,1]=4 4308 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)I 34a_100000746945_100102629194 [1,1,0,0,0,0|1,0,1]=4 4309 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)O 34a_100000726020_100102629194 [1,1,0,0,0,0|0,0,1]=3 4310 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Br 34a_100011827694_100102629194 [1,1,0,0,0,0|1,0,1]=4 4311 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Br 7a_100011827694_100102629194 [1,1,0,0,0,0|1,0,1]=4 4312 B14R1.907 C/C=C/COc1ccc(c(c1)OC)C 34a_100009865632_100102629194 [1,1,0,0,0,0|1,0,1]=4 4313 B14R1.907 C/C=C/COc1ccc(c(c1)OC)C 7a_100009865632_100102629194 [1,1,0,0,0,0|1,0,1]=4 4314 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Cl 34a_100012186310_100102629194 [1,1,0,0,0,0|1,0,1]=4 4315 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Cl 7a_100012186310_100102629194 [1,1,0,0,0,0|1,0,1]=4 4316 B14R1.907 C/C=C/COc1ccc(c(c1)OC)F 34a_100012001760_100102629194 [1,1,0,0,0,0|1,0,1]=4 4317 B14R1.907 C/C=C/COc1ccc(c(c1)OC)F 7a_100012001760_100102629194 [1,1,0,0,0,0|1,0,1]=4 4318 B14R1.907 C/C=C/COc1ccc(c(c1)OC)N 34a_100015326901_100102629194 [1,1,0,0,0,0|1,0,1]=4 4319 B14R1.907 C/C=C/COc1ccc(c(c1)OC)N 7a_100015326901_100102629194 [1,1,0,0,0,0|1,0,1]=4 4320 B14R1.907 C/C=C/CSc1ccc(c(c1)CC)O 62a_100102629194_100012338938 [1,1,0,0,0,0|1,0,1]=4 4321 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Br 62a_100012353699_100102629194 [1,1,0,0,0,0|1,0,1]=4 4322 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Br 62a_100102629194_100012353699 [1,1,0,0,0,0|1,0,1]=4 4323 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)C 62a_100011830276_100102629194 [1,1,0,0,0,0|1,0,1]=4 4324 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)C 62a_100102629194_100011830276 [1,1,0,0,0,0|1,0,1]=4 4325 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Cl 62a_100011356853_100102629194 [1,1,0,0,0,0|1,0,1]=4 4326 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Cl 62a_100102629194_100011356853 [1,1,0,0,0,0|1,0,1]=4 4327 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)F 62a_100011934186_100102629194 [1,1,0,0,0,0|1,0,1]=4 4328 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)F 62a_100102629194_100011934186 [1,1,0,0,0,0|1,0,1]=4 4329 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)N 62a_100011279103_100102629194 [1,1,0,0,0,0|1,0,1]=4 4330 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)N 62a_100102629194_100015196925 [1,1,0,0,0,0|1,0,1]=4 4331 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)O 62a_100102629194_100000694246 [1,1,0,0,0,0|0,0,1]=3 4332 B14R1.907 C/C=C/CSc1ccc(c(n1)OC)O 62a_100102629194_100010893133 [1,1,0,0,0,0|1,0,1]=4 4333 B14R1.907 C=CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000754431 [1,1,0,0,0,0|1,0,1]=4 4334 B14R1.907 C=CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000754431 [1,1,0,0,0,0|1,0,1]=4 4335 B14R1.907 C=CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000754431 [1,1,0,0,0,0|1,0,1]=4 4336 B14R1.907 C=CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000754431 [1,1,0,0,0,0|1,0,1]=4 4337 B14R1.907 C=CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000754431 [1,1,0,0,0,0|1,0,1]=4 4338 B14R1.907 C=CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000754431 [1,1,0,0,0,0|1,0,1]=4 4339 B14R1.907 C=CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000754431 [1,1,0,0,0,0|1,0,1]=4 4340 B14R1.907 C=CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000754431 [1,1,0,0,0,0|1,0,1]=4 4341 B14R1.907 C=CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000754431 [1,1,0,0,0,0|1,0,1]=4 4342 B14R1.907 C=CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000754431 [1,1,0,0,0,0|0,0,1]=3 4343 B14R1.907 C=CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000754431 [1,1,0,0,0,0|1,0,1]=4 4344 B14R1.907 C=CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000754431 [1,1,0,0,0,0|1,0,1]=4 4345 B14R1.907 C=CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000754431 [1,1,0,0,0,0|1,0,1]=4 4346 B14R1.907 C=CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000754431 [1,1,0,0,0,0|1,0,1]=4 4347 B14R1.907 C=CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000754431 [1,1,0,0,0,0|1,0,1]=4 4348 B14R1.907 C=CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000754431 [1,1,0,0,0,0|1,0,1]=4 4349 B14R1.907 C=CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000754431 [1,1,0,0,0,0|1,0,1]=4 4350 B14R1.907 C=CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000754431 [1,1,0,0,0,0|1,0,1]=4 4351 B14R1.907 C=CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000754431 [1,1,0,0,0,0|1,0,1]=4 4352 B14R1.907 C=CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000754431 [1,1,0,0,0,0|1,0,1]=4 4353 B14R1.907 C=CCCSc1ccc(c(c1)CC)O 62a_100000754431_100012338938 [1,1,0,0,0,0|1,0,1]=4 4354 B14R1.907 C=CCCSc1ccc(c(c1)OC)Br 62a_100000754431_100012353699 [1,1,0,0,0,0|1,0,1]=4 4355 B14R1.907 C=CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000754431 [1,1,0,0,0,0|1,0,1]=4 4356 B14R1.907 C=CCCSc1ccc(c(c1)OC)C 62a_100000754431_100011830276 [1,1,0,0,0,0|1,0,1]=4 4357 B14R1.907 C=CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000754431 [1,1,0,0,0,0|1,0,1]=4 4358 B14R1.907 C=CCCSc1ccc(c(c1)OC)Cl 62a_100000754431_100011356853 [1,1,0,0,0,0|1,0,1]=4 4359 B14R1.907 C=CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000754431 [1,1,0,0,0,0|1,0,1]=4 4360 B14R1.907 C=CCCSc1ccc(c(c1)OC)F 62a_100000754431_100011934186 [1,1,0,0,0,0|1,0,1]=4 4361 B14R1.907 C=CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000754431 [1,1,0,0,0,0|1,0,1]=4 4362 B14R1.907 C=CCCSc1ccc(c(c1)OC)N 62a_100000754431_100015196925 [1,1,0,0,0,0|1,0,1]=4 4363 B14R1.907 C=CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000754431 [1,1,0,0,0,0|1,0,1]=4 4364 B14R1.907 C=CCCSc1ccc(c(c1)OC)O 62a_100000754431_100000694246 [1,1,0,0,0,0|0,0,1]=3 4365 B14R1.907 C=CCCSc1ccc(c(n1)OC)O 62a_100000754431_100010893133 [1,1,0,0,0,0|1,0,1]=4 4366 B14R1.907 C=CCNCc1ccc(c(c1)OC)Br 2230a_100020586998_100010110085 [1,1,0,0,0,0|1,0,1]=4 4367 B14R1.907 C=CCNCc1ccc(c(c1)OC)Br 270004a_100020586998_100010244714 [1,1,0,0,0,0|1,0,1]=4 4368 B14R1.907 C=CCNCc1ccc(c(c1)OC)C 270004a_100020586998_100000719150 [1,1,0,0,0,0|1,0,1]=4 4369 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210623 [1,1,0,0,0,0|1,0,1]=4 4370 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 2230a_100020586998_200010214485 [1,1,0,0,0,0|1,0,1]=4 4371 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 270004a_100020586998_100011998524 [1,1,0,0,0,0|1,0,1]=4 4372 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100015514636 [1,1,0,0,0,0|1,0,1]=4 4373 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 2230a_100020586998_100012349856 [1,1,0,0,0,0|1,0,1]=4 4374 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210623 [1,1,0,0,0,0|1,0,1]=4 4375 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 270004a_100020586998_100000692873 [1,1,0,0,0,0|1,0,1]=4 4376 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 34a_100020626639_100015514636 [1,1,0,0,0,0|1,0,1]=4 4377 B14R1.907 C=CCNCc1ccc(c(c1)OC)O 34a_100000185554_100015514636 [1,1,0,0,0,0|0,0,1]=3 4378 B14R1.907 C=CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100015514636 [1,1,0,0,0,0|1,0,1]=4 4379 B14R1.907 C=CCOCc1ccc(c(c1)OC)Br 34a_200000210373_100010110085 [1,1,0,0,0,0|1,0,1]=4 4380 B14R1.907 C=CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100015514636 [1,1,0,0,0,0|1,0,1]=4 4381 B14R1.907 C=CCOCc1ccc(c(c1)OC)C 34a_100000752651_100015514636 [1,1,0,0,0,0|1,0,1]=4 4382 B14R1.907 C=CCOCc1ccc(c(c1)OC)C 7a_100000752651_100015514636 [1,1,0,0,0,0|1,0,1]=4 4383 B14R1.907 C=CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100015514636 [1,1,0,0,0,0|1,0,1]=4 4384 B14R1.907 C=CCOCc1ccc(c(c1)OC)Cl 34a_200000210373_200010214485 [1,1,0,0,0,0|1,0,1]=4 4385 B14R1.907 C=CCOCc1ccc(c(c1)OC)F 34a_100000692429_100015514636 [1,1,0,0,0,0|1,0,1]=4 4386 B14R1.907 C=CCOCc1ccc(c(c1)OC)F 34a_200000210373_100012349856 [1,1,0,0,0,0|1,0,1]=4 4387 B14R1.907 C=CCOCc1ccc(c(c1)OC)F 7a_100000692429_100015514636 [1,1,0,0,0,0|1,0,1]=4 4388 B14R1.907 C=CCOCc1ccc(c(c1)OC)N 34a_100000087641_100015514636 [1,1,0,0,0,0|1,0,1]=4 4389 B14R1.907 C=CCSCc1ccc(c(c1)OC)Br 62a_100000210623_100010110085 [1,1,0,0,0,0|1,0,1]=4 4390 B14R1.907 C=CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210623 [1,1,0,0,0,0|1,0,1]=4 4391 B14R1.907 C=CCSCc1ccc(c(c1)OC)Cl 62a_100000210623_200010214485 [1,1,0,0,0,0|1,0,1]=4 4392 B14R1.907 C=CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210623 [1,1,0,0,0,0|1,0,1]=4 4393 B14R1.907 C=CCSCc1ccc(c(c1)OC)F 62a_100000210623_100012349856 [1,1,0,0,0,0|1,0,1]=4 4394 B14R1.907 C=CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210623 [1,1,0,0,0,0|1,0,1]=4 4395 B14R1.907 CC#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000748600 [1,1,0,0,0,0|0,0,2]=4 4396 B14R1.907 CC#CCSc1ccc(c(c1)OC)O 62a_100000748600_100000694246 [1,1,0,0,0,0|0,0,2]=4 4397 B14R1.907 CC=CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000070051 [1,1,0,0,0,0|1,0,1]=4 4398 B14R1.907 CC=CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000070051 [1,1,0,0,0,0|1,0,1]=4 4399 B14R1.907 CC=CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000070051 [1,1,0,0,0,0|1,0,1]=4 4400 B14R1.907 CC=CCNc1ccc(c(c1)OC)C 34a_100011279678_100000070051 [1,1,0,0,0,0|1,0,1]=4 4401 B14R1.907 CC=CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000070051 [1,1,0,0,0,0|1,0,1]=4 4402 B14R1.907 CC=CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000070051 [1,1,0,0,0,0|1,0,1]=4 4403 B14R1.907 CC=CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000070051 [1,1,0,0,0,0|1,0,1]=4 4404 B14R1.907 CC=CCNc1ccc(c(c1)OC)F 34a_100000701188_100000070051 [1,1,0,0,0,0|1,0,1]=4 4405 B14R1.907 CC=CCNc1ccc(c(c1)OC)I 34a_100000746945_100000070051 [1,1,0,0,0,0|1,0,1]=4 4406 B14R1.907 CC=CCNc1ccc(c(c1)OC)O 34a_100000726020_100000070051 [1,1,0,0,0,0|0,0,1]=3 4407 B14R1.907 CC=CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000070051 [1,1,0,0,0,0|1,0,1]=4 4408 B14R1.907 CC=CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000070051 [1,1,0,0,0,0|1,0,1]=4 4409 B14R1.907 CC=CCOc1ccc(c(c1)OC)C 34a_100009865632_100000070051 [1,1,0,0,0,0|1,0,1]=4 4410 B14R1.907 CC=CCOc1ccc(c(c1)OC)C 7a_100009865632_100000070051 [1,1,0,0,0,0|1,0,1]=4 4411 B14R1.907 CC=CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000070051 [1,1,0,0,0,0|1,0,1]=4 4412 B14R1.907 CC=CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000070051 [1,1,0,0,0,0|1,0,1]=4 4413 B14R1.907 CC=CCOc1ccc(c(c1)OC)F 34a_100012001760_100000070051 [1,1,0,0,0,0|1,0,1]=4 4414 B14R1.907 CC=CCOc1ccc(c(c1)OC)F 7a_100012001760_100000070051 [1,1,0,0,0,0|1,0,1]=4 4415 B14R1.907 CC=CCOc1ccc(c(c1)OC)N 34a_100015326901_100000070051 [1,1,0,0,0,0|1,0,1]=4 4416 B14R1.907 CC=CCOc1ccc(c(c1)OC)N 7a_100015326901_100000070051 [1,1,0,0,0,0|1,0,1]=4 4417 B14R1.907 CC=CCSc1ccc(c(c1)CC)O 62a_100000070051_100012338938 [1,1,0,0,0,0|1,0,1]=4 4418 B14R1.907 CC=CCSc1ccc(c(c1)OC)Br 62a_100000070051_100012353699 [1,1,0,0,0,0|1,0,1]=4 4419 B14R1.907 CC=CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000070051 [1,1,0,0,0,0|1,0,1]=4 4420 B14R1.907 CC=CCSc1ccc(c(c1)OC)C 62a_100000070051_100011830276 [1,1,0,0,0,0|1,0,1]=4 4421 B14R1.907 CC=CCSc1ccc(c(c1)OC)C 62a_100011830276_100000070051 [1,1,0,0,0,0|1,0,1]=4 4422 B14R1.907 CC=CCSc1ccc(c(c1)OC)Cl 62a_100000070051_100011356853 [1,1,0,0,0,0|1,0,1]=4 4423 B14R1.907 CC=CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000070051 [1,1,0,0,0,0|1,0,1]=4 4424 B14R1.907 CC=CCSc1ccc(c(c1)OC)F 62a_100000070051_100011934186 [1,1,0,0,0,0|1,0,1]=4 4425 B14R1.907 CC=CCSc1ccc(c(c1)OC)F 62a_100011934186_100000070051 [1,1,0,0,0,0|1,0,1]=4 4426 B14R1.907 CC=CCSc1ccc(c(c1)OC)N 62a_100000070051_100015196925 [1,1,0,0,0,0|1,0,1]=4 4427 B14R1.907 CC=CCSc1ccc(c(c1)OC)N 62a_100011279103_100000070051 [1,1,0,0,0,0|1,0,1]=4 4428 B14R1.907 CC=CCSc1ccc(c(c1)OC)O 62a_100000070051_100000694246 [1,1,0,0,0,0|0,0,1]=3 4429 B14R1.907 CC=CCSc1ccc(c(n1)OC)O 62a_100000070051_100010893133 [1,1,0,0,0,0|1,0,1]=4 4430 B14R1.907 CCCC=Cc1ccc(c(c1)OC)O 271570a_100016258520_100000694246 [1,1,0,0,0,0|0,0,2]=4 4431 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210211 [1,1,0,0,0,0|1,0,1]=4 4432 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210210 [1,1,0,0,0,0|1,0,1]=4 4433 B14R1.907 CCCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210211 [1,1,0,0,0,0|1,0,1]=4 4434 B14R1.907 CCCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210210 [1,1,0,0,0,0|1,0,1]=4 4435 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210211 [1,1,0,0,0,0|1,0,1]=4 4436 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210210 [1,1,0,0,0,0|1,0,1]=4 4437 B14R1.907 CCCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210211 [1,1,0,0,0,0|1,0,1]=4 4438 B14R1.907 CCCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210210 [1,1,0,0,0,0|1,0,1]=4 4439 B14R1.907 CCCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210210 [1,1,0,0,0,0|1,0,1]=4 4440 B14R1.907 CCCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210210 [1,1,0,0,0,0|0,0,1]=3 4441 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210210 [1,1,0,0,0,0|1,0,1]=4 4442 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210211 [1,1,0,0,0,0|1,0,1]=4 4443 B14R1.907 CCCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210210 [1,1,0,0,0,0|1,0,1]=4 4444 B14R1.907 CCCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210211 [1,1,0,0,0,0|1,0,1]=4 4445 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210210 [1,1,0,0,0,0|1,0,1]=4 4446 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210211 [1,1,0,0,0,0|1,0,1]=4 4447 B14R1.907 CCCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210210 [1,1,0,0,0,0|1,0,1]=4 4448 B14R1.907 CCCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210211 [1,1,0,0,0,0|1,0,1]=4 4449 B14R1.907 CCCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210210 [1,1,0,0,0,0|1,0,1]=4 4450 B14R1.907 CCCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210211 [1,1,0,0,0,0|1,0,1]=4 4451 B14R1.907 CCCCSc1ccc(c(c1)CC)O 62a_100000210211_100012338938 [1,1,0,0,0,0|1,0,1]=4 4452 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100000210211_100012353699 [1,1,0,0,0,0|1,0,1]=4 4453 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210210 [1,1,0,0,0,0|1,0,1]=4 4454 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100000210211_100011830276 [1,1,0,0,0,0|1,0,1]=4 4455 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210210 [1,1,0,0,0,0|1,0,1]=4 4456 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100000210211_100011356853 [1,1,0,0,0,0|1,0,1]=4 4457 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210210 [1,1,0,0,0,0|1,0,1]=4 4458 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100000210211_100011934186 [1,1,0,0,0,0|1,0,1]=4 4459 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210210 [1,1,0,0,0,0|1,0,1]=4 4460 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100000210211_100015196925 [1,1,0,0,0,0|1,0,1]=4 4461 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210210 [1,1,0,0,0,0|1,0,1]=4 4462 B14R1.907 CCCCSc1ccc(c(c1)OC)O 62a_100000210211_100000694246 [1,1,0,0,0,0|0,0,1]=3 4463 B14R1.907 CCCCSc1ccc(c(n1)OC)O 62a_100000210211_100010893133 [1,1,0,0,0,0|1,0,1]=4 4464 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 207a_100020643023_100010244714 [1,1,0,0,0,0|1,0,1]=4 4465 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 270004a_100020643023_100010244714 [1,1,0,0,0,0|1,0,1]=4 4466 B14R1.907 CCCNCc1ccc(c(c1)OC)C 207a_100020643023_100000719150 [1,1,0,0,0,0|1,0,1]=4 4467 B14R1.907 CCCNCc1ccc(c(c1)OC)C 270004a_100020643023_100000719150 [1,1,0,0,0,0|1,0,1]=4 4468 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 207a_100020643023_100011998524 [1,1,0,0,0,0|1,0,1]=4 4469 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210303 [1,1,0,0,0,0|1,0,1]=4 4470 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 270004a_100020643023_100011998524 [1,1,0,0,0,0|1,0,1]=4 4471 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210303 [1,1,0,0,0,0|1,0,1]=4 4472 B14R1.907 CCCNCc1ccc(c(c1)OC)F 207a_100020643023_100000692873 [1,1,0,0,0,0|1,0,1]=4 4473 B14R1.907 CCCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210303 [1,1,0,0,0,0|1,0,1]=4 4474 B14R1.907 CCCNCc1ccc(c(c1)OC)F 270004a_100020643023_100000692873 [1,1,0,0,0,0|1,0,1]=4 4475 B14R1.907 CCCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210303 [1,1,0,0,0,0|1,0,1]=4 4476 B14R1.907 CCCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210303 [1,1,0,0,0,0|0,0,1]=3 4477 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100000210258_100010110085 [1,1,0,0,0,0|1,0,1]=4 4478 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210303 [1,1,0,0,0,0|1,0,1]=4 4479 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210303 [1,1,0,0,0,0|1,0,1]=4 4480 B14R1.907 CCCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210303 [1,1,0,0,0,0|1,0,1]=4 4481 B14R1.907 CCCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210303 [1,1,0,0,0,0|1,0,1]=4 4482 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100000210258_200010214485 [1,1,0,0,0,0|1,0,1]=4 4483 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210303 [1,1,0,0,0,0|1,0,1]=4 4484 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000210258_100012349856 [1,1,0,0,0,0|1,0,1]=4 4485 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210303 [1,1,0,0,0,0|1,0,1]=4 4486 B14R1.907 CCCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210303 [1,1,0,0,0,0|1,0,1]=4 4487 B14R1.907 CCCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210303 [1,1,0,0,0,0|1,0,1]=4 4488 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100000210303_100010110085 [1,1,0,0,0,0|1,0,1]=4 4489 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210303 [1,1,0,0,0,0|1,0,1]=4 4490 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_100000210303_200010214485 [1,1,0,0,0,0|1,0,1]=4 4491 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210303 [1,1,0,0,0,0|1,0,1]=4 4492 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100000210303_100012349856 [1,1,0,0,0,0|1,0,1]=4 4493 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210303 [1,1,0,0,0,0|1,0,1]=4 4494 B14R1.907 CCNCCc1ccc(c(c1)OC)O 2230a_100015525214_100010741665 [1,1,0,0,0,0|0,0,1]=3 4495 B14R1.907 CCNCCc1ccc(c(c1)OC)O 34a_100000756042_100000210202 [1,1,0,0,0,0|0,0,1]=3 4496 B14R1.907 CCOCSc1ccc(c(c1)OC)O 62a_100000739092_100000694246 [1,1,0,0,0,0|1,0,1]=4 4497 B14R1.907 CCSCCc1ccc(c(c1)OC)O 62a_100000210202_100010741665 [1,1,0,0,0,0|0,0,1]=3 4498 B14R1.907 CCc1cc(ccc1F)CNCC=O 2230a_114873767189_200015260668 [1,1,0,0,0,0|2,0,0]=4 4499 B14R1.907 CCc1cc(ccc1F)CNCC=O 34a_114873767189_200009817547 [1,1,0,0,0,0|2,0,0]=4 4500 B14R1.907 CCc1cc(ccc1O)SCCOC 62a_100000233755_100012338938 [1,1,0,0,0,0|2,0,0]=4 4501 B14R1.907 CCc1cc(ccc1O)SCCSC 62a_100000212216_100012338938 [1,1,0,0,0,0|2,0,0]=4 4502 B14R1.907 COCC=Cc1ccc(c(c1)OC)O 271570a_100016286323_100000694246 [1,1,0,0,0,0|1,0,1]=4 4503 B14R1.907 COCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100011201679 [1,1,0,0,0,0|2,0,0]=4 4504 B14R1.907 COCCNc1ccc(c(c1)OC)Br 34a_100000765947_100011201679 [1,1,0,0,0,0|2,0,0]=4 4505 B14R1.907 COCCNc1ccc(c(c1)OC)C 2230a_100011279678_100011201679 [1,1,0,0,0,0|2,0,0]=4 4506 B14R1.907 COCCNc1ccc(c(c1)OC)C 34a_100011279678_100011201679 [1,1,0,0,0,0|2,0,0]=4 4507 B14R1.907 COCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100011201679 [1,1,0,0,0,0|2,0,0]=4 4508 B14R1.907 COCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100011201679 [1,1,0,0,0,0|2,0,0]=4 4509 B14R1.907 COCCNc1ccc(c(c1)OC)F 2230a_100000701188_100011201679 [1,1,0,0,0,0|2,0,0]=4 4510 B14R1.907 COCCNc1ccc(c(c1)OC)F 34a_100000701188_100011201679 [1,1,0,0,0,0|2,0,0]=4 4511 B14R1.907 COCCNc1ccc(c(c1)OC)I 34a_100000746945_100011201679 [1,1,0,0,0,0|2,0,0]=4 4512 B14R1.907 COCCNc1ccc(c(c1)OC)O 34a_100000726020_100011201679 [1,1,0,0,0,0|1,0,0]=3 4513 B14R1.907 COCCOc1ccc(c(c1)OC)Br 34a_100011827694_100011201679 [1,1,0,0,0,0|2,0,0]=4 4514 B14R1.907 COCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000233755 [1,1,0,0,0,0|2,0,0]=4 4515 B14R1.907 COCCOc1ccc(c(c1)OC)C 34a_100009865632_100011201679 [1,1,0,0,0,0|2,0,0]=4 4516 B14R1.907 COCCOc1ccc(c(c1)OC)C 7a_100009865632_100000233755 [1,1,0,0,0,0|2,0,0]=4 4517 B14R1.907 COCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100011201679 [1,1,0,0,0,0|2,0,0]=4 4518 B14R1.907 COCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000233755 [1,1,0,0,0,0|2,0,0]=4 4519 B14R1.907 COCCOc1ccc(c(c1)OC)F 34a_100012001760_100011201679 [1,1,0,0,0,0|2,0,0]=4 4520 B14R1.907 COCCOc1ccc(c(c1)OC)F 7a_100012001760_100000233755 [1,1,0,0,0,0|2,0,0]=4 4521 B14R1.907 COCCOc1ccc(c(c1)OC)N 34a_100015326901_100011201679 [1,1,0,0,0,0|2,0,0]=4 4522 B14R1.907 COCCOc1ccc(c(c1)OC)N 7a_100015326901_100000233755 [1,1,0,0,0,0|2,0,0]=4 4523 B14R1.907 COCCSc1ccc(c(c1)OC)Br 62a_100000233755_100012353699 [1,1,0,0,0,0|2,0,0]=4 4524 B14R1.907 COCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000233755 [1,1,0,0,0,0|2,0,0]=4 4525 B14R1.907 COCCSc1ccc(c(c1)OC)C 62a_100000233755_100011830276 [1,1,0,0,0,0|2,0,0]=4 4526 B14R1.907 COCCSc1ccc(c(c1)OC)C 62a_100011830276_100000233755 [1,1,0,0,0,0|2,0,0]=4 4527 B14R1.907 COCCSc1ccc(c(c1)OC)Cl 62a_100000233755_100011356853 [1,1,0,0,0,0|2,0,0]=4 4528 B14R1.907 COCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000233755 [1,1,0,0,0,0|2,0,0]=4 4529 B14R1.907 COCCSc1ccc(c(c1)OC)F 62a_100000233755_100011934186 [1,1,0,0,0,0|2,0,0]=4 4530 B14R1.907 COCCSc1ccc(c(c1)OC)F 62a_100011934186_100000233755 [1,1,0,0,0,0|2,0,0]=4 4531 B14R1.907 COCCSc1ccc(c(c1)OC)N 62a_100000233755_100015196925 [1,1,0,0,0,0|2,0,0]=4 4532 B14R1.907 COCCSc1ccc(c(c1)OC)N 62a_100011279103_100000233755 [1,1,0,0,0,0|2,0,0]=4 4533 B14R1.907 COCCSc1ccc(c(c1)OC)O 62a_100000233755_100000694246 [1,1,0,0,0,0|1,0,0]=3 4534 B14R1.907 COCCSc1ccc(c(n1)OC)O 62a_100000233755_100010893133 [1,1,0,0,0,0|2,0,0]=4 4535 B14R1.907 COCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000766300 [1,1,0,0,0,0|2,0,0]=4 4536 B14R1.907 COCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000766300 [1,1,0,0,0,0|2,0,0]=4 4537 B14R1.907 COCSCc1ccc(c(c1)OC)Br 62a_100000766300_100010110085 [1,1,0,0,0,0|2,0,0]=4 4538 B14R1.907 COCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000766300 [1,1,0,0,0,0|2,0,0]=4 4539 B14R1.907 COCSCc1ccc(c(c1)OC)Cl 62a_100000766300_200010214485 [1,1,0,0,0,0|2,0,0]=4 4540 B14R1.907 COCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000766300 [1,1,0,0,0,0|2,0,0]=4 4541 B14R1.907 COCSCc1ccc(c(c1)OC)F 62a_100000766300_100012349856 [1,1,0,0,0,0|2,0,0]=4 4542 B14R1.907 COCSCc1ccc(c(c1)OC)F 62a_100012349856_100000766300 [1,1,0,0,0,0|2,0,0]=4 4543 B14R1.907 COc1cc(ccc1Br)COCC=O 34a_100010234685_200009817547 [1,1,0,0,0,0|1,0,0]=3 4544 B14R1.907 COc1cc(ccc1Br)COCC=O 7a_100010234685_200015260668 [1,1,0,0,0,0|1,0,0]=3 4545 B14R1.907 COc1cc(ccc1Br)COCSC 34a_100010234685_100011218213 [1,1,0,0,0,0|2,0,0]=4 4546 B14R1.907 COc1cc(ccc1Br)CSCC=O 62a_100010110085_200015260668 [1,1,0,0,0,0|1,0,0]=3 4547 B14R1.907 COc1cc(ccc1Br)CSCC=O 62a_200015260668_100010110085 [1,1,0,0,0,0|1,0,0]=3 4548 B14R1.907 COc1cc(ccc1Br)CSCSC 62a_100010110085_100011218213 [1,1,0,0,0,0|2,0,0]=4 4549 B14R1.907 COc1cc(ccc1Br)CSCSC 62a_100011218213_100010110085 [1,1,0,0,0,0|2,0,0]=4 4550 B14R1.907 COc1cc(ccc1Br)NCCSC 2230a_100000765947_100000751147 [1,1,0,0,0,0|2,0,0]=4 4551 B14R1.907 COc1cc(ccc1Br)NCCSC 34a_100000765947_100000212216 [1,1,0,0,0,0|2,0,0]=4 4552 B14R1.907 COc1cc(ccc1Br)OCCSC 34a_100011827694_100000212216 [1,1,0,0,0,0|2,0,0]=4 4553 B14R1.907 COc1cc(ccc1Br)OCCSC 7a_100011827694_100000212216 [1,1,0,0,0,0|2,0,0]=4 4554 B14R1.907 COc1cc(ccc1Br)SCCSC 62a_100000212216_100012353699 [1,1,0,0,0,0|2,0,0]=4 4555 B14R1.907 COc1cc(ccc1Br)SCCSC 62a_100012353699_100000751147 [1,1,0,0,0,0|2,0,0]=4 4556 B14R1.907 COc1cc(ccc1C)COCC=O 34a_100000752651_200009817547 [1,1,0,0,0,0|1,0,0]=3 4557 B14R1.907 COc1cc(ccc1C)COCC=O 7a_100000752651_200015260668 [1,1,0,0,0,0|1,0,0]=3 4558 B14R1.907 COc1cc(ccc1C)COCSC 34a_100000752651_100011218213 [1,1,0,0,0,0|2,0,0]=4 4559 B14R1.907 COc1cc(ccc1C)NCCSC 2230a_100011279678_100000751147 [1,1,0,0,0,0|2,0,0]=4 4560 B14R1.907 COc1cc(ccc1C)NCCSC 34a_100011279678_100000212216 [1,1,0,0,0,0|2,0,0]=4 4561 B14R1.907 COc1cc(ccc1C)OCCSC 34a_100009865632_100000212216 [1,1,0,0,0,0|2,0,0]=4 4562 B14R1.907 COc1cc(ccc1C)OCCSC 7a_100009865632_100000212216 [1,1,0,0,0,0|2,0,0]=4 4563 B14R1.907 COc1cc(ccc1C)SCCSC 62a_100000212216_100011830276 [1,1,0,0,0,0|2,0,0]=4 4564 B14R1.907 COc1cc(ccc1C)SCCSC 62a_100011830276_100000751147 [1,1,0,0,0,0|2,0,0]=4 4565 B14R1.907 COc1cc(ccc1Cl)CNCC=O 2230a_100015204853_200015260668 [1,1,0,0,0,0|1,0,0]=3 4566 B14R1.907 COc1cc(ccc1Cl)CNCC=O 34a_100015204853_200009817547 [1,1,0,0,0,0|1,0,0]=3 4567 B14R1.907 COc1cc(ccc1Cl)CNCSC 2230a_100015204853_100011218213 [1,1,0,0,0,0|2,0,0]=4 4568 B14R1.907 COc1cc(ccc1Cl)CNCSC 34a_100015204853_100011218213 [1,1,0,0,0,0|2,0,0]=4 4569 B14R1.907 COc1cc(ccc1Cl)COCC=O 34a_100012179228_200009817547 [1,1,0,0,0,0|1,0,0]=3 4570 B14R1.907 COc1cc(ccc1Cl)COCSC 34a_100012179228_100011218213 [1,1,0,0,0,0|2,0,0]=4 4571 B14R1.907 COc1cc(ccc1Cl)CSCC=O 62a_200010214485_200015260668 [1,1,0,0,0,0|1,0,0]=3 4572 B14R1.907 COc1cc(ccc1Cl)CSCC=O 62a_200015260668_200010214485 [1,1,0,0,0,0|1,0,0]=3 4573 B14R1.907 COc1cc(ccc1Cl)CSCSC 62a_100011218213_200010214485 [1,1,0,0,0,0|2,0,0]=4 4574 B14R1.907 COc1cc(ccc1Cl)CSCSC 62a_200010214485_100011218213 [1,1,0,0,0,0|2,0,0]=4 4575 B14R1.907 COc1cc(ccc1Cl)NCCSC 2230a_100000742311_100000751147 [1,1,0,0,0,0|2,0,0]=4 4576 B14R1.907 COc1cc(ccc1Cl)NCCSC 34a_100000742311_100000212216 [1,1,0,0,0,0|2,0,0]=4 4577 B14R1.907 COc1cc(ccc1Cl)OCCSC 34a_100012186310_100000212216 [1,1,0,0,0,0|2,0,0]=4 4578 B14R1.907 COc1cc(ccc1Cl)OCCSC 7a_100012186310_100000212216 [1,1,0,0,0,0|2,0,0]=4 4579 B14R1.907 COc1cc(ccc1Cl)SCCSC 62a_100000212216_100011356853 [1,1,0,0,0,0|2,0,0]=4 4580 B14R1.907 COc1cc(ccc1Cl)SCCSC 62a_100011356853_100000751147 [1,1,0,0,0,0|2,0,0]=4 4581 B14R1.907 COc1cc(ccc1F)CNCC=O 2230a_100020626639_200015260668 [1,1,0,0,0,0|1,0,0]=3 4582 B14R1.907 COc1cc(ccc1F)CNCC=O 34a_100020626639_200009817547 [1,1,0,0,0,0|1,0,0]=3 4583 B14R1.907 COc1cc(ccc1F)CNCSC 2230a_100020626639_100011218213 [1,1,0,0,0,0|2,0,0]=4 4584 B14R1.907 COc1cc(ccc1F)CNCSC 34a_100020626639_100011218213 [1,1,0,0,0,0|2,0,0]=4 4585 B14R1.907 COc1cc(ccc1F)COCC=O 34a_100000692429_200009817547 [1,1,0,0,0,0|1,0,0]=3 4586 B14R1.907 COc1cc(ccc1F)COCC=O 7a_100000692429_200015260668 [1,1,0,0,0,0|1,0,0]=3 4587 B14R1.907 COc1cc(ccc1F)COCSC 34a_100000692429_100011218213 [1,1,0,0,0,0|2,0,0]=4 4588 B14R1.907 COc1cc(ccc1F)CSCC=O 62a_100012349856_200015260668 [1,1,0,0,0,0|1,0,0]=3 4589 B14R1.907 COc1cc(ccc1F)CSCC=O 62a_200015260668_100012349856 [1,1,0,0,0,0|1,0,0]=3 4590 B14R1.907 COc1cc(ccc1F)CSCSC 62a_100011218213_100012349856 [1,1,0,0,0,0|2,0,0]=4 4591 B14R1.907 COc1cc(ccc1F)CSCSC 62a_100012349856_100011218213 [1,1,0,0,0,0|2,0,0]=4 4592 B14R1.907 COc1cc(ccc1F)NCCSC 2230a_100000701188_100000751147 [1,1,0,0,0,0|2,0,0]=4 4593 B14R1.907 COc1cc(ccc1F)NCCSC 34a_100000701188_100000212216 [1,1,0,0,0,0|2,0,0]=4 4594 B14R1.907 COc1cc(ccc1F)OCCSC 34a_100012001760_100000212216 [1,1,0,0,0,0|2,0,0]=4 4595 B14R1.907 COc1cc(ccc1F)OCCSC 7a_100012001760_100000212216 [1,1,0,0,0,0|2,0,0]=4 4596 B14R1.907 COc1cc(ccc1F)SCCSC 62a_100000212216_100011934186 [1,1,0,0,0,0|2,0,0]=4 4597 B14R1.907 COc1cc(ccc1F)SCCSC 62a_100011934186_100000751147 [1,1,0,0,0,0|2,0,0]=4 4598 B14R1.907 COc1cc(ccc1I)NCCSC 34a_100000746945_100000212216 [1,1,0,0,0,0|2,0,0]=4 4599 B14R1.907 COc1cc(ccc1N)COCC=O 34a_100000087641_200009817547 [1,1,0,0,0,0|1,0,0]=3 4600 B14R1.907 COc1cc(ccc1N)COCSC 34a_100000087641_100011218213 [1,1,0,0,0,0|2,0,0]=4 4601 B14R1.907 COc1cc(ccc1N)OCCSC 34a_100015326901_100000212216 [1,1,0,0,0,0|2,0,0]=4 4602 B14R1.907 COc1cc(ccc1N)OCCSC 7a_100015326901_100000212216 [1,1,0,0,0,0|2,0,0]=4 4603 B14R1.907 COc1cc(ccc1N)SCCSC 62a_100000212216_100015196925 [1,1,0,0,0,0|2,0,0]=4 4604 B14R1.907 COc1cc(ccc1N)SCCSC 62a_100011279103_100000751147 [1,1,0,0,0,0|2,0,0]=4 4605 B14R1.907 COc1cc(ccc1O)CCNCF 34a_100000756042_100015361967 [1,1,0,0,0,0|1,0,0]=3 4606 B14R1.907 COc1cc(ccc1O)CCSCF 62a_100015361967_100010741665 [1,1,0,0,0,0|1,0,0]=3 4607 B14R1.907 COc1cc(ccc1O)CNCC=O 34a_100000185554_200009817547 [1,1,0,0,0,0|0,0,0]=2 4608 B14R1.907 COc1cc(ccc1O)CNCCF 34a_100000185554_100011217306 [1,1,0,0,0,0|1,0,1]=4 4609 B14R1.907 COc1cc(ccc1O)CNCCO 34a_100000185554_100000211926 [1,1,0,0,0,0|0,0,2]=4 4610 B14R1.907 COc1cc(ccc1O)CNCSC 34a_100000185554_100011218213 [1,1,0,0,0,0|1,0,0]=3 4611 B14R1.907 COc1cc(ccc1O)NCCCF 34a_100000726020_100011934791 [1,1,0,0,0,0|1,0,1]=4 4612 B14R1.907 COc1cc(ccc1O)NCCCO 34a_100000726020_100000230001 [1,1,0,0,0,0|0,0,2]=4 4613 B14R1.907 COc1cc(ccc1O)NCCSC 34a_100000726020_100000212216 [1,1,0,0,0,0|1,0,0]=3 4614 B14R1.907 COc1cc(ccc1O)SCCC#N 62a_100011215226_100000694246 [1,1,0,0,0,0|1,0,1]=4 4615 B14R1.907 COc1cc(ccc1O)SCCCF 62a_100011934791_100000694246 [1,1,0,0,0,0|1,0,1]=4 4616 B14R1.907 COc1cc(ccc1O)SCCCO 62a_100011215043_100000694246 [1,1,0,0,0,0|0,0,2]=4 4617 B14R1.907 COc1cc(ccc1O)SCCSC 62a_100000212216_100000694246 [1,1,0,0,0,0|1,0,0]=3 4618 B14R1.907 COc1cc(ncc1Br)COCC=O 34a_100010999569_200009817547 [1,1,0,0,0,0|2,0,0]=4 4619 B14R1.907 COc1nc(ccc1Br)CSCC=O 62a_200010066506_200015260668 [1,1,0,0,0,0|2,0,0]=4 4620 B14R1.907 COc1nc(ccc1Br)CSCC=O 62a_200015260668_200010066506 [1,1,0,0,0,0|2,0,0]=4 4621 B14R1.907 COc1nc(ccc1O)SCCSC 62a_100000212216_100010893133 [1,1,0,0,0,0|2,0,0]=4 4622 B14R1.907 O=CCSCc1ccc(c(c1)C=O)O 62a_200015260668_100000008128 [1,1,0,0,0,0|2,0,0]=4 4623 B14R1.1362 CCCCc1ccc(c(c1F)OC)Cl 271570a_100020621405_200135222481 [1,1,0,0,0,0|1,0,1]=4 4624 B14R1.1362 CCCCc1ccc(c(c1F)OC)N 271570a_100020621405_100010734149 [1,1,0,0,0,0|1,0,1]=4 4625 B14R1.1362 COc1c(ccc(c1F)NCC=O)F 34a_100137314619_200009817547 [1,1,0,0,0,0|2,0,0]=4 4626 B14R1.1362 COc1c(ccc(c1F)OCC=O)F 34a_100000062073_200009817547 [1,1,0,0,0,0|2,0,0]=4 4627 B14R1.1362 COc1c(ccc(c1F)OCC=O)F 7a_100000062073_200015260668 [1,1,0,0,0,0|2,0,0]=4 4628 B14R1.1362 COc1c(ccc(c1F)SCC=O)Cl 62a_200015260668_200135222481 [1,1,0,0,0,0|2,0,0]=4 4629 B14R1.1362 COc1c(ccc(c1F)SCC=O)Cl 62a_200135222481_200015260668 [1,1,0,0,0,0|2,0,0]=4 4630 B14R1.1362 COc1c(ccc(c1F)SCC=O)N 62a_100010734149_200015260668 [1,1,0,0,0,0|2,0,0]=4 4631 B14R1.1362 COc1c(ccc(c1F)SCC=O)N 62a_200015260668_100010734149 [1,1,0,0,0,0|2,0,0]=4 4632 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)O 62a_100011215867_100000694246 [1,1,0,0,0,0|1,0,1]=4 4633 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210202 [1,1,0,0,0,0|0,0,2]=4 4634 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100011215416 [1,1,0,0,0,0|1,0,1]=4 4635 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)O 62a_100000758301_100000694246 [1,1,0,0,0,0|1,0,1]=4 4636 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 240690a_100102657272_100000032101 [1,1,0,0,0,0|1,0,1]=4 4637 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 527a_100102657272_100000032101 [1,1,0,0,0,0|1,0,1]=4 4638 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)C 270004a_106832991635_200000081148 [1,1,0,0,0,0|2,0,0]=4 4639 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)F 270004a_106832991635_200000078651 [1,1,0,0,0,0|2,0,0]=4 4640 B14R1.3405 COc1cc(ccc1O)SC(C)OC 62a_100009879195_100000694246 [1,1,0,0,0,0|2,0,0]=4 4641 B14R1.4435 C=CCSc1cc(c(cc1F)O)OC 62a_100000210623_100010189133 [1,1,0,0,0,0|1,0,1]=4 4642 B14R1.4435 CCCCc1cc(c(cc1Br)Br)OC 271570a_100020621405_200014006352 [1,1,0,0,0,0|1,0,1]=4 4643 B14R1.4435 CCCCc1cc(c(cc1C)F)OC 271570a_100020621405_100011009880 [1,1,0,0,0,0|1,0,1]=4 4644 B14R1.4435 CCCCc1cc(c(cc1C)N)OC 271570a_100020621405_100010141321 [1,1,0,0,0,0|1,0,1]=4 4645 B14R1.4435 CCCCc1cc(c(cc1F)Cl)OC 271570a_100020621405_100010739614 [1,1,0,0,0,0|1,0,1]=4 4646 B14R1.4435 CCCCc1cc(c(cc1F)F)OC 271570a_100020621405_200015541288 [1,1,0,0,0,0|1,0,1]=4 4647 B14R1.4435 CCCCc1cc(c(cc1F)N)OC 271570a_100020621405_100012766639 [1,1,0,0,0,0|1,0,1]=4 4648 B14R1.4435 CCCCc1cc(c(cc1F)O)OC 271570a_100020621405_100010189133 [1,1,0,0,0,0|0,0,1]=3 4649 B14R1.4435 CCCCc1cc(c(cc1N)C)OC 271570a_100020621405_200010584344 [1,1,0,0,0,0|1,0,1]=4 4650 B14R1.4435 CCCCc1cc(c(cc1N)F)OC 271570a_100020621405_100010365326 [1,1,0,0,0,0|1,0,1]=4 4651 B14R1.4435 CCCSc1cc(c(cc1F)O)OC 62a_100000210303_100010189133 [1,1,0,0,0,0|1,0,1]=4 4652 B14R1.4435 COCSc1cc(c(cc1F)O)OC 62a_100000766300_100010189133 [1,1,0,0,0,0|2,0,0]=4 4653 B14R1.4435 COc1cc(c(cc1Br)Br)NCC=O 34a_100000718616_200009817547 [1,1,0,0,0,0|2,0,0]=4 4654 B14R1.4435 COc1cc(c(cc1Br)Br)NCC=O 7a_100000718616_200015260668 [1,1,0,0,0,0|2,0,0]=4 4655 B14R1.4435 COc1cc(c(cc1Br)Br)SCC=O 62a_200014006352_200015260668 [1,1,0,0,0,0|2,0,0]=4 4656 B14R1.4435 COc1cc(c(cc1Br)Br)SCC=O 62a_200015260668_200014006352 [1,1,0,0,0,0|2,0,0]=4 4657 B14R1.4435 COc1cc(c(cc1Br)C)NCC=O 34a_100010232211_200009817547 [1,1,0,0,0,0|2,0,0]=4 4658 B14R1.4435 COc1cc(c(cc1Br)C)NCC=O 7a_100010232211_200015260668 [1,1,0,0,0,0|2,0,0]=4 4659 B14R1.4435 COc1cc(c(cc1Br)Cl)NCC=O 34a_100012361290_200009817547 [1,1,0,0,0,0|2,0,0]=4 4660 B14R1.4435 COc1cc(c(cc1Br)Cl)NCC=O 7a_100012361290_200015260668 [1,1,0,0,0,0|2,0,0]=4 4661 B14R1.4435 COc1cc(c(cc1C)Br)NCC=O 34a_100010244135_200009817547 [1,1,0,0,0,0|2,0,0]=4 4662 B14R1.4435 COc1cc(c(cc1C)Br)NCC=O 7a_100010244135_200015260668 [1,1,0,0,0,0|2,0,0]=4 4663 B14R1.4435 COc1cc(c(cc1C)N)SCC=O 62a_200010584344_200015260668 [1,1,0,0,0,0|2,0,0]=4 4664 B14R1.4435 COc1cc(c(cc1C)N)SCC=O 62a_200015260668_200010584344 [1,1,0,0,0,0|2,0,0]=4 4665 B14R1.4435 COc1cc(c(cc1Cl)Br)NCC=O 34a_100013022580_200009817547 [1,1,0,0,0,0|2,0,0]=4 4666 B14R1.4435 COc1cc(c(cc1Cl)Br)NCC=O 7a_100013022580_200015260668 [1,1,0,0,0,0|2,0,0]=4 4667 B14R1.4435 COc1cc(c(cc1Cl)C)NCC=O 2230a_100009858536_200015260668 [1,1,0,0,0,0|2,0,0]=4 4668 B14R1.4435 COc1cc(c(cc1Cl)C)NCC=O 34a_100009858536_200009817547 [1,1,0,0,0,0|2,0,0]=4 4669 B14R1.4435 COc1cc(c(cc1Cl)C)NCC=O 7a_100009858536_200015260668 [1,1,0,0,0,0|2,0,0]=4 4670 B14R1.4435 COc1cc(c(cc1Cl)Cl)NCC=O 34a_100011830341_200009817547 [1,1,0,0,0,0|2,0,0]=4 4671 B14R1.4435 COc1cc(c(cc1Cl)F)NCC=O 34a_100009872666_200009817547 [1,1,0,0,0,0|2,0,0]=4 4672 B14R1.4435 COc1cc(c(cc1Cl)F)NCC=O 7a_100009872666_200015260668 [1,1,0,0,0,0|2,0,0]=4 4673 B14R1.4435 COc1cc(c(cc1Cl)F)SCC=O 62a_100010739614_200015260668 [1,1,0,0,0,0|2,0,0]=4 4674 B14R1.4435 COc1cc(c(cc1Cl)F)SCC=O 62a_200015260668_100010739614 [1,1,0,0,0,0|2,0,0]=4 4675 B14R1.4435 COc1cc(c(cc1F)Br)NCC=O 34a_100010208193_200009817547 [1,1,0,0,0,0|2,0,0]=4 4676 B14R1.4435 COc1cc(c(cc1F)Br)NCC=O 7a_100010208193_200015260668 [1,1,0,0,0,0|2,0,0]=4 4677 B14R1.4435 COc1cc(c(cc1F)C)SCC=O 62a_100011009880_200015260668 [1,1,0,0,0,0|2,0,0]=4 4678 B14R1.4435 COc1cc(c(cc1F)C)SCC=O 62a_200015260668_100011009880 [1,1,0,0,0,0|2,0,0]=4 4679 B14R1.4435 COc1cc(c(cc1F)Cl)NCC=O 34a_100009958774_200009817547 [1,1,0,0,0,0|2,0,0]=4 4680 B14R1.4435 COc1cc(c(cc1F)Cl)NCC=O 7a_100009958774_200015260668 [1,1,0,0,0,0|2,0,0]=4 4681 B14R1.4435 COc1cc(c(cc1F)F)SCC=O 62a_200015260668_200015541288 [1,1,0,0,0,0|2,0,0]=4 4682 B14R1.4435 COc1cc(c(cc1F)F)SCC=O 62a_200015541288_200015260668 [1,1,0,0,0,0|2,0,0]=4 4683 B14R1.4435 COc1cc(c(cc1F)N)SCC=O 62a_100010365326_200015260668 [1,1,0,0,0,0|2,0,0]=4 4684 B14R1.4435 COc1cc(c(cc1F)N)SCC=O 62a_200015260668_100010365326 [1,1,0,0,0,0|2,0,0]=4 4685 B14R1.4435 COc1cc(c(cc1N)C)SCC=O 62a_100010141321_200015260668 [1,1,0,0,0,0|2,0,0]=4 4686 B14R1.4435 COc1cc(c(cc1N)C)SCC=O 62a_200015260668_100010141321 [1,1,0,0,0,0|2,0,0]=4 4687 B14R1.4435 COc1cc(c(cc1N)F)SCC=O 62a_100012766639_200015260668 [1,1,0,0,0,0|2,0,0]=4 4688 B14R1.4435 COc1cc(c(cc1N)F)SCC=O 62a_200015260668_100012766639 [1,1,0,0,0,0|2,0,0]=4 4689 B14R1.4435 COc1cc(c(cc1O)F)SCC=O 62a_200015260668_100010189133 [1,1,0,0,0,0|1,0,0]=3 4690 B14R1.4435 COc1cc(c(cc1O)F)SCSC 62a_100011218213_100010189133 [1,1,0,0,0,0|2,0,0]=4 4691 B14R1.7499 C=CCSc1cc(c(c(c1)OC)O)O 62a_100000210623_200159242197 [1,1,0,0,0,0|1,0,1]=4 4692 B14R1.7499 CCCCc1cc(c(c(c1)CC)O)C 271570a_100020621405_100010659108 [1,1,0,0,0,0|1,0,1]=4 4693 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)C 271570a_100020621405_100010271686 [1,1,0,0,0,0|1,0,1]=4 4694 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)F 271570a_100020621405_100011218012 [1,1,0,0,0,0|1,0,1]=4 4695 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)O 271570a_100020621405_200015524394 [1,1,0,0,0,0|1,0,1]=4 4696 B14R1.7499 CCCCc1cc(c(c(c1)OC)N)C 271570a_100020621405_100000741850 [1,1,0,0,0,0|1,0,1]=4 4697 B14R1.7499 CCCSc1cc(c(c(c1)OC)O)O 62a_100000210303_200159242197 [1,1,0,0,0,0|1,0,1]=4 4698 B14R1.7499 CCc1cc(cc(c1O)C)SCC=O 62a_200015260668_100010659108 [1,1,0,0,0,0|2,0,0]=4 4699 B14R1.7499 COCSc1cc(c(c(c1)OC)O)O 62a_100000766300_200159242197 [1,1,0,0,0,0|2,0,0]=4 4700 B14R1.7499 COc1cc(cc(c1Cl)Br)NCC=O 2230a_100010131419_200015260668 [1,1,0,0,0,0|2,0,0]=4 4701 B14R1.7499 COc1cc(cc(c1Cl)Br)NCC=O 34a_100010131419_200009817547 [1,1,0,0,0,0|2,0,0]=4 4702 B14R1.7499 COc1cc(cc(c1Cl)Br)NCC=O 7a_100010131419_200015260668 [1,1,0,0,0,0|2,0,0]=4 4703 B14R1.7499 COc1cc(cc(c1F)C)SCC=O 62a_100010271686_200015260668 [1,1,0,0,0,0|2,0,0]=4 4704 B14R1.7499 COc1cc(cc(c1F)C)SCC=O 62a_200015260668_100010271686 [1,1,0,0,0,0|2,0,0]=4 4705 B14R1.7499 COc1cc(cc(c1F)F)SCC=O 62a_100011218012_200015260668 [1,1,0,0,0,0|2,0,0]=4 4706 B14R1.7499 COc1cc(cc(c1F)F)SCC=O 62a_200015260668_100011218012 [1,1,0,0,0,0|2,0,0]=4 4707 B14R1.7499 COc1cc(cc(c1F)O)SCC=O 62a_200015260668_200015524394 [1,1,0,0,0,0|2,0,0]=4 4708 B14R1.7499 COc1cc(cc(c1F)O)SCC=O 62a_200015524394_200015260668 [1,1,0,0,0,0|2,0,0]=4 4709 B14R1.7499 COc1cc(cc(c1N)C)SCC=O 62a_100000741850_200015260668 [1,1,0,0,0,0|2,0,0]=4 4710 B14R1.7499 COc1cc(cc(c1N)C)SCC=O 62a_200015260668_100000741850 [1,1,0,0,0,0|2,0,0]=4 4711 B14R1.7499 COc1cc(cc(c1O)O)SCC=O 62a_200015260668_200159242197 [1,1,0,0,0,0|1,0,0]=3 4712 B14R1.7499 COc1cc(cc(c1O)O)SCSC 62a_100011218213_200159242197 [1,1,0,0,0,0|2,0,0]=4 4713 B14R1.74 C=C(C)CC(=O)c1cccc(c1)OC 1458a_100000188888_100000748629 [1,1,0,0,0,0|1,0,1]=4 4714 B14R1.74 C=C(C)CN(C)c1cccc(c1)OC 2230a_100000219725_100000748629 [1,1,0,0,0,0|2,0,0]=4 4715 B14R1.74 C=C(C)CN(C)c1cccc(c1)OC 269982a_100000219725_100000748629 [1,1,0,0,0,0|2,0,0]=4 4716 B14R1.74 C=C(C)CN(C)c1cccc(c1)OC 34a_100000219725_100000748629 [1,1,0,0,0,0|2,0,0]=4 4717 B14R1.74 COc1cc(ccn1)[C@H](C)NC(=O)C 11a_100012186823_100015343762 [1,1,0,0,0,0|2,0,0]=4 4718 B14R1.74 COc1cc(ccn1)[C@H](C)NC(=O)C 1626a_100012186823_100015343762 [1,1,0,0,0,0|2,0,0]=4 4719 B14R1.74 COc1cc(ccn1)[C@H](C)NC(=O)C 240690a_100012186823_100015343762 [1,1,0,0,0,0|2,0,0]=4 4720 B14R1.74 COc1cc(ccn1)[C@H](C)NC(=O)C 527a_100012186823_100103153847 [1,1,0,0,0,0|2,0,0]=4 4721 B14R1.74 COc1cccc(c1)C(=O)CC(=O)C 1458a_100000070787_100000211451 [1,1,0,0,0,0|0,0,1]=3 4722 B14R1.74 COc1cccc(c1)C(=O)CC(=O)N 1458a_100000188888_100000187820 [1,1,0,0,0,0|1,0,1]=4 4723 B14R1.74 COc1cccc(c1)C(=O)CC(=O)[O-] 1458a_100000188888_100020667443 [1,1,0,0,0,0|1,0,1]=4 4724 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 11a_100000737859_100015343762 [1,1,0,0,0,0|1,0,0]=3 4725 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 1626a_100000737859_100015343762 [1,1,0,0,0,0|1,0,0]=3 4726 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 240690a_100000737859_100015343762 [1,1,0,0,0,0|1,0,0]=3 4727 B14R1.74 COc1cccc(c1)C(C)NC(=O)C 527a_100000737859_100103153847 [1,1,0,0,0,0|1,0,0]=3 4728 B14R1.74 COc1cccc(c1)N(C)CC(=O)N 2230a_100000219725_100000747473 [1,1,0,0,0,0|2,0,0]=4 4729 B14R1.74 COc1cccc(c1)N(C)CC(=O)N 269982a_100000219725_100000187820 [1,1,0,0,0,0|2,0,0]=4 4730 B14R1.74 COc1cccc(c1)N(C)CC(=O)N 34a_100000219725_100000187820 [1,1,0,0,0,0|2,0,0]=4 4731 B14R1.74 COc1cccc(c1)N(C)CC(=O)[O-] 269982a_100000219725_100020667443 [1,1,0,0,0,0|2,0,0]=4 4732 B14R1.74 COc1cccc(c1)N(C)CC(=O)[O-] 34a_100000219725_100020667443 [1,1,0,0,0,0|2,0,0]=4 4733 B14R1.74 COc1cccc(c1)[C@@H](N)CC(C)C 271570a_100015190218_100000170001 [1,1,0,0,0,0|1,0,1]=4 4734 B14R1.74 COc1cccc(n1)[C@@H](C)NC(=O)C 11a_100016223015_100015343762 [1,1,0,0,0,0|2,0,0]=4 4735 B14R1.74 COc1cccc(n1)[C@@H](C)NC(=O)C 1626a_100016223015_100015343762 [1,1,0,0,0,0|2,0,0]=4 4736 B14R1.74 COc1cccc(n1)[C@@H](C)NC(=O)C 240690a_100016223015_100015343762 [1,1,0,0,0,0|2,0,0]=4 4737 B14R1.74 COc1cccc(n1)[C@@H](C)NC(=O)C 527a_100016223015_100103153847 [1,1,0,0,0,0|2,0,0]=4 4738 B14R1.74 COc1ccnc(c1)C(C)NC(=O)C 11a_100009966388_100015343762 [1,1,0,0,0,0|2,0,0]=4 4739 B14R1.74 COc1ccnc(c1)C(C)NC(=O)C 1626a_100009966388_100015343762 [1,1,0,0,0,0|2,0,0]=4 4740 B14R1.74 COc1ccnc(c1)C(C)NC(=O)C 240690a_100009966388_100015343762 [1,1,0,0,0,0|2,0,0]=4 4741 B14R1.74 COc1ccnc(c1)C(C)NC(=O)C 527a_100009966388_100103153847 [1,1,0,0,0,0|2,0,0]=4 4742 B14R1.75 C=C(C)C(=O)Cc1cccc(c1)OC 1458a_100000185857_100000211672 [1,1,0,0,0,0|1,0,1]=4 4743 B14R1.75 CCc1cccc(c1)NC(C)C(=O)C 2230a_100000211250_100009814033 [1,1,0,0,0,0|2,0,0]=4 4744 B14R1.75 CCc1cccc(c1)NC(C)C(=O)C 7a_100000211250_100000179758 [1,1,0,0,0,0|2,0,0]=4 4745 B14R1.75 CCc1cccc(c1)OC(C)C(=O)C 7a_100000211550_100000179758 [1,1,0,0,0,0|2,0,0]=4 4746 B14R1.75 CCc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100011263222 [1,1,0,0,0,0|2,0,0]=4 4747 B14R1.75 CCc1cccc(c1)SC(C)C(=O)C 62a_100011263222_100009814033 [1,1,0,0,0,0|2,0,0]=4 4748 B14R1.75 CNc1cccc(c1)OC(C)C(=O)C 7a_100000756613_100000179758 [1,1,0,0,0,0|2,0,0]=4 4749 B14R1.75 CNc1cccc(c1)SC(C)C(=O)C 62a_100000219648_100009814033 [1,1,0,0,0,0|2,0,0]=4 4750 B14R1.75 CNc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100000219648 [1,1,0,0,0,0|2,0,0]=4 4751 B14R1.75 COc1cc(ccn1)SC(C)C(=O)C 62a_100000117307_100009814033 [1,1,0,0,0,0|2,0,0]=4 4752 B14R1.75 COc1cc(ccn1)SC(C)C(=O)C 62a_100009814033_100000117307 [1,1,0,0,0,0|2,0,0]=4 4753 B14R1.75 COc1cccc(c1)CC(C)N(C)C 270004a_100102631434_100011218204 [1,1,0,0,0,0|2,0,0]=4 4754 B14R1.75 COc1cccc(c1)CC(O)C(=O)C 1458a_100000693103_200000210301 [1,1,0,0,0,0|0,0,0]=2 4755 B14R1.75 COc1cccc(c1)CC(O)C(=O)[13CH3] 1458a_100000693103_200025704644 [1,1,0,0,0,0|0,0,0]=2 4756 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 11a_100000184262_100015343762 [1,1,0,0,0,0|1,0,0]=3 4757 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 1626a_100000184262_100015343762 [1,1,0,0,0,0|1,0,0]=3 4758 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 240690a_100000184262_100015343762 [1,1,0,0,0,0|1,0,0]=3 4759 B14R1.75 COc1cccc(c1)CN(C)C(=O)C 527a_100000184262_100103153847 [1,1,0,0,0,0|1,0,0]=3 4760 B14R1.75 COc1cccc(c1)NC(C)C(=O)N 34a_100000210024_100000702099 [1,1,0,0,0,0|2,0,0]=4 4761 B14R1.75 COc1cccc(c1)NC(F)C(=O)N 34a_100000210024_100009813875 [1,1,0,0,0,0|2,0,0]=4 4762 B14R1.75 COc1cccc(c1)NC(F)C(=O)[O-] 34a_100000210024_100020610796 [1,1,0,0,0,0|2,0,0]=4 4763 B14R1.75 COc1cccc(c1)OC(C)C(=O)C 1458a_100000216024_200000210301 [1,1,0,0,0,0|1,0,0]=3 4764 B14R1.75 COc1cccc(c1)OC(C)C(=O)C 7a_100000211255_100000179758 [1,1,0,0,0,0|1,0,0]=3 4765 B14R1.75 COc1cccc(c1)OC(C)C(=O)N 34a_100000211255_100000702099 [1,1,0,0,0,0|2,0,0]=4 4766 B14R1.75 COc1cccc(c1)OC(C)C(=O)N 7a_100000211255_100000702099 [1,1,0,0,0,0|2,0,0]=4 4767 B14R1.75 COc1cccc(c1)OC(C)C(=O)[13CH3] 1458a_100000216024_200025704644 [1,1,0,0,0,0|1,0,0]=3 4768 B14R1.75 COc1cccc(c1)OC(F)C(=O)N 34a_100000211255_100009813875 [1,1,0,0,0,0|2,0,0]=4 4769 B14R1.75 COc1cccc(c1)OC(F)C(=O)N 7a_100000211255_100009813875 [1,1,0,0,0,0|2,0,0]=4 4770 B14R1.75 COc1cccc(c1)OC(F)C(=O)[O-] 34a_100000211255_100020610796 [1,1,0,0,0,0|2,0,0]=4 4771 B14R1.75 COc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100000170001 [1,1,0,0,0,0|1,0,0]=3 4772 B14R1.75 COc1cccc(c1)SC(C)C(=O)N 62a_100000702099_100000170001 [1,1,0,0,0,0|2,0,0]=4 4773 B14R1.75 COc1cccc(c1)SC(F)C(=O)N 62a_100009813875_100000170001 [1,1,0,0,0,0|2,0,0]=4 4774 B14R1.75 COc1cccc(c1)SC(F)C(=O)[O-] 62a_100020610796_100000170001 [1,1,0,0,0,0|2,0,0]=4 4775 B14R1.75 COc1cccc(n1)SC(C)C(=O)C 62a_100000760917_100009814033 [1,1,0,0,0,0|2,0,0]=4 4776 B14R1.75 COc1cccc(n1)SC(C)C(=O)C 62a_100009814033_100000760917 [1,1,0,0,0,0|2,0,0]=4 4777 B14R1.75 COc1ccnc(c1)SC(C)C(=O)C 62a_100009814033_100011216251 [1,1,0,0,0,0|2,0,0]=4 4778 B14R1.75 COc1ccnc(c1)SC(C)C(=O)C 62a_100009817693_100009814033 [1,1,0,0,0,0|2,0,0]=4 4779 B14R1.75 COc1cncc(c1)OC(C)C(=O)C 7a_100000084572_100000179758 [1,1,0,0,0,0|2,0,0]=4 4780 B14R1.75 COc1cncc(c1)SC(C)C(=O)C 62a_100000050176_100009814033 [1,1,0,0,0,0|2,0,0]=4 4781 B14R1.75 COc1cncc(c1)SC(C)C(=O)C 62a_100009814033_100000050176 [1,1,0,0,0,0|2,0,0]=4 4782 B14R1.75 CSc1cccc(c1)CN(C)C(=O)C 11a_100011934695_100015343762 [1,1,0,0,0,0|1,1,0]=4 4783 B14R1.75 CSc1cccc(c1)CN(C)C(=O)C 240690a_100011934695_100015343762 [1,1,0,0,0,0|1,1,0]=4 4784 B14R1.75 CSc1cccc(c1)CN(C)C(=O)C 527a_100011934695_100103153847 [1,1,0,0,0,0|1,1,0]=4 4785 B14R1.75 CSc1cccc(c1)NC(C)C(=O)C 2230a_100000210049_100009814033 [1,1,0,0,0,0|1,1,0]=4 4786 B14R1.75 CSc1cccc(c1)OC(C)C(=O)C 7a_100011265683_100000179758 [1,1,0,0,0,0|1,1,0]=4 4787 B14R1.75 CSc1cccc(c1)SC(C)C(=O)C 62a_100009814033_100011215954 [1,1,0,0,0,0|1,1,0]=4 4788 B14R1.75 CSc1cccc(c1)SC(C)C(=O)C 62a_100011215954_100009814033 [1,1,0,0,0,0|1,1,0]=4 4789 B14R1.77 C#CC(=O)CCc1cccc(c1)OC 1458a_100000211873_100011713679 [1,1,0,0,0,0|0,0,1]=3 4790 B14R1.77 C=CC(=O)CCc1cccc(c1)OC 1458a_100000185746_100011713679 [1,1,0,0,0,0|0,0,1]=3 4791 B14R1.77 C=CC(=O)NCc1cccc(c1)OC 1626a_100000174954_100000185746 [1,1,0,0,0,0|1,0,1]=4 4792 B14R1.77 C=CC(=O)NCc1cccc(c1)OC 240690a_100000174954_200121576911 [1,1,0,0,0,0|1,0,1]=4 4793 B14R1.77 C=Cc1cccc(c1)CCC(=O)OC 271570a_100011290941_100000151591 [1,1,0,0,0,0|1,0,1]=4 4794 B14R1.77 CCC(=O)CCc1cccc(c1)C#N 1458a_100011998624_100000210202 [1,1,0,0,0,0|2,0,0]=4 4795 B14R1.77 CCC(=O)CCc1cccc(c1)OC 1458a_100000210414_100011713679 [1,1,0,0,0,0|0,0,0]=2 4796 B14R1.77 CCC(=O)CCc1cccc(c1)OC 1458a_100000234931_100000210202 [1,1,0,0,0,0|0,0,0]=2 4797 B14R1.77 CCC(=O)CNc1cccc(c1)CC 7a_100000211250_100000747405 [1,1,0,0,0,0|2,0,0]=4 4798 B14R1.77 CCC(=O)COc1cccc(c1)CC 7a_100000211550_100000747405 [1,1,0,0,0,0|2,0,0]=4 4799 B14R1.77 CCC(=O)COc1cccc(c1)NC 7a_100000756613_100000747405 [1,1,0,0,0,0|2,0,0]=4 4800 B14R1.77 CCC(=O)COc1cccc(c1)OC 1458a_100000182123_100000210202 [1,1,0,0,0,0|1,0,0]=3 4801 B14R1.77 CCC(=O)COc1cccc(c1)OC 7a_100000211255_100000747405 [1,1,0,0,0,0|1,0,0]=3 4802 B14R1.77 CCC(=O)COc1cccc(c1)SC 7a_100011265683_100000747405 [1,1,0,0,0,0|1,1,0]=4 4803 B14R1.77 CCC(=O)COc1cncc(c1)OC 7a_100000084572_100000747405 [1,1,0,0,0,0|2,0,0]=4 4804 B14R1.77 CCC(=O)CSc1cc(ccn1)OC 62a_100000747405_100011216251 [1,1,0,0,0,0|2,0,0]=4 4805 B14R1.77 CCC(=O)CSc1cc(ccn1)OC 62a_100009817693_100000747405 [1,1,0,0,0,0|2,0,0]=4 4806 B14R1.77 CCC(=O)CSc1cccc(c1)CC 62a_100000747405_100011263222 [1,1,0,0,0,0|2,0,0]=4 4807 B14R1.77 CCC(=O)CSc1cccc(c1)CC 62a_100011263222_100000747405 [1,1,0,0,0,0|2,0,0]=4 4808 B14R1.77 CCC(=O)CSc1cccc(c1)NC 62a_100000219648_100000747405 [1,1,0,0,0,0|2,0,0]=4 4809 B14R1.77 CCC(=O)CSc1cccc(c1)NC 62a_100000747405_100000219648 [1,1,0,0,0,0|2,0,0]=4 4810 B14R1.77 CCC(=O)CSc1cccc(c1)OC 1458a_100000741315_100000210202 [1,1,0,0,0,0|1,0,0]=3 4811 B14R1.77 CCC(=O)CSc1cccc(c1)OC 62a_100000747405_100000170001 [1,1,0,0,0,0|1,0,0]=3 4812 B14R1.77 CCC(=O)CSc1cccc(c1)SC 62a_100000747405_100011215954 [1,1,0,0,0,0|1,1,0]=4 4813 B14R1.77 CCC(=O)CSc1cccc(c1)SC 62a_100011215954_100000747405 [1,1,0,0,0,0|1,1,0]=4 4814 B14R1.77 CCC(=O)CSc1cccc(n1)OC 62a_100000747405_100000760917 [1,1,0,0,0,0|2,0,0]=4 4815 B14R1.77 CCC(=O)CSc1cccc(n1)OC 62a_100000760917_100000747405 [1,1,0,0,0,0|2,0,0]=4 4816 B14R1.77 CCC(=O)CSc1ccnc(c1)OC 62a_100000117307_100000747405 [1,1,0,0,0,0|2,0,0]=4 4817 B14R1.77 CCC(=O)CSc1ccnc(c1)OC 62a_100000747405_100000117307 [1,1,0,0,0,0|2,0,0]=4 4818 B14R1.77 CCC(=O)CSc1cncc(c1)OC 62a_100000050176_100000747405 [1,1,0,0,0,0|2,0,0]=4 4819 B14R1.77 CCC(=O)CSc1cncc(c1)OC 62a_100000747405_100000050176 [1,1,0,0,0,0|2,0,0]=4 4820 B14R1.77 CCC(=O)NCc1cc(ccn1)OC 11a_100000706253_100000210414 [1,1,0,0,0,0|2,0,0]=4 4821 B14R1.77 CCC(=O)NCc1cc(ccn1)OC 1626a_100000706253_100000210414 [1,1,0,0,0,0|2,0,0]=4 4822 B14R1.77 CCC(=O)NCc1cc(ccn1)OC 240690a_100000706253_100000210414 [1,1,0,0,0,0|2,0,0]=4 4823 B14R1.77 CCC(=O)NCc1cc(ccn1)OC 527a_100000706253_100000210414 [1,1,0,0,0,0|2,0,0]=4 4824 B14R1.77 CCC(=O)NCc1cccc(c1)OC 11a_100000174954_100000210414 [1,1,0,0,0,0|1,0,0]=3 4825 B14R1.77 CCC(=O)NCc1cccc(c1)OC 1626a_100000174954_100000210414 [1,1,0,0,0,0|1,0,0]=3 4826 B14R1.77 CCC(=O)NCc1cccc(c1)OC 240690a_100000174954_100000210414 [1,1,0,0,0,0|1,0,0]=3 4827 B14R1.77 CCC(=O)NCc1cccc(c1)OC 527a_100000174954_100000210414 [1,1,0,0,0,0|1,0,0]=3 4828 B14R1.77 CCC(=O)NCc1cccc(c1)SC 62a_200000210301_200011236840 [1,1,0,0,0,0|1,1,0]=4 4829 B14R1.77 CCC(=O)NCc1cccc(c1)SC 62a_200011236840_200000210301 [1,1,0,0,0,0|1,1,0]=4 4830 B14R1.77 CCC(=O)NCc1cccc(c1)S[13CH3] 62a_200011236840_200025704644 [1,1,0,0,0,0|1,1,0]=4 4831 B14R1.77 CCC(=O)NCc1cccc(c1)S[13CH3] 62a_200025704644_200011236840 [1,1,0,0,0,0|1,1,0]=4 4832 B14R1.77 CCC(=O)NCc1cccc(n1)OC 11a_100000746380_100000210414 [1,1,0,0,0,0|2,0,0]=4 4833 B14R1.77 CCC(=O)NCc1cccc(n1)OC 1626a_100000746380_100000210414 [1,1,0,0,0,0|2,0,0]=4 4834 B14R1.77 CCC(=O)NCc1cccc(n1)OC 240690a_100000746380_100000210414 [1,1,0,0,0,0|2,0,0]=4 4835 B14R1.77 CCC(=O)NCc1cccc(n1)OC 527a_100000746380_100000210414 [1,1,0,0,0,0|2,0,0]=4 4836 B14R1.77 CCC(=O)NCc1ccnc(c1)OC 11a_100102525109_100000210414 [1,1,0,0,0,0|2,0,0]=4 4837 B14R1.77 CCC(=O)NCc1ccnc(c1)OC 1626a_100102525109_100000210414 [1,1,0,0,0,0|2,0,0]=4 4838 B14R1.77 CCC(=O)NCc1ccnc(c1)OC 240690a_100102525109_100000210414 [1,1,0,0,0,0|2,0,0]=4 4839 B14R1.77 CCC(=O)NCc1ccnc(c1)OC 527a_100102525109_100000210414 [1,1,0,0,0,0|2,0,0]=4 4840 B14R1.77 CCC(=O)NCc1cncc(c1)OC 11a_100020589029_100000210414 [1,1,0,0,0,0|2,0,0]=4 4841 B14R1.77 CCC(=O)NCc1cncc(c1)OC 240690a_100020589029_100000210414 [1,1,0,0,0,0|2,0,0]=4 4842 B14R1.77 CCC(=O)NCc1cncc(c1)OC 527a_100020589029_100000210414 [1,1,0,0,0,0|2,0,0]=4 4843 B14R1.77 CCC(=O)NNc1cccc(c1)OC 22a_100000722927_100000210414 [1,1,0,0,0,0|2,0,0]=4 4844 B14R1.77 CCN(C)CCc1cccc(c1)OC 2230a_100000225621_100011713679 [1,1,0,0,0,0|2,0,0]=4 4845 B14R1.77 CCN(C)CCc1cccc(c1)OC 2230a_100011269071_100000210202 [1,1,0,0,0,0|2,0,0]=4 4846 B14R1.77 CCN(C)CCc1cccc(c1)OC 269982a_100000225621_100011713679 [1,1,0,0,0,0|2,0,0]=4 4847 B14R1.77 CCN(C)CCc1cccc(c1)OC 269982a_100011269071_100000204670 [1,1,0,0,0,0|2,0,0]=4 4848 B14R1.77 CCN(C)CCc1cccc(c1)OC 34a_100011269071_100000210202 [1,1,0,0,0,0|2,0,0]=4 4849 B14R1.77 CCc1cccc(c1)NCC(=O)NC 2230a_100000211250_100000183359 [1,1,0,0,0,0|2,0,0]=4 4850 B14R1.77 CCc1cccc(c1)NCC(=O)NC 34a_100000211250_100000183359 [1,1,0,0,0,0|2,0,0]=4 4851 B14R1.77 CCc1cccc(c1)NCC(=O)NC 7a_100000211250_100000183359 [1,1,0,0,0,0|2,0,0]=4 4852 B14R1.77 CCc1cccc(c1)NCC(=O)OC 2230a_100000211250_100000747449 [1,1,0,0,0,0|2,0,0]=4 4853 B14R1.77 CCc1cccc(c1)NCC(=O)OC 34a_100000211250_100000747449 [1,1,0,0,0,0|2,0,0]=4 4854 B14R1.77 CCc1cccc(c1)NCC(=O)OC 7a_100000211250_100000747449 [1,1,0,0,0,0|2,0,0]=4 4855 B14R1.77 CCc1cccc(c1)OCC(=O)NC 34a_100000211550_100000183359 [1,1,0,0,0,0|2,0,0]=4 4856 B14R1.77 CCc1cccc(c1)OCC(=O)NC 7a_100000211550_100000183359 [1,1,0,0,0,0|2,0,0]=4 4857 B14R1.77 CCc1cccc(c1)OCC(=O)OC 34a_100000211550_100000747449 [1,1,0,0,0,0|2,0,0]=4 4858 B14R1.77 CCc1cccc(c1)OCC(=O)OC 7a_100000211550_100000747449 [1,1,0,0,0,0|2,0,0]=4 4859 B14R1.77 CCc1cccc(c1)SCC(=O)NC 62a_100000183359_100011263222 [1,1,0,0,0,0|2,0,0]=4 4860 B14R1.77 CCc1cccc(c1)SCC(=O)NC 62a_100011263222_100000183359 [1,1,0,0,0,0|2,0,0]=4 4861 B14R1.77 CCc1cccc(c1)SCC(=O)OC 62a_100000747449_100011263222 [1,1,0,0,0,0|2,0,0]=4 4862 B14R1.77 CCc1cccc(c1)SCC(=O)OC 62a_100011263222_100000747449 [1,1,0,0,0,0|2,0,0]=4 4863 B14R1.77 CNC(=O)CCc1cccc(c1)C#N 11a_106832991635_100011998624 [1,1,0,0,0,0|2,0,0]=4 4864 B14R1.77 CNC(=O)CCc1cccc(c1)C#N 1626a_100102657272_100011998624 [1,1,0,0,0,0|2,0,0]=4 4865 B14R1.77 CNC(=O)CCc1cccc(c1)C#N 240690a_100102657272_100011998624 [1,1,0,0,0,0|2,0,0]=4 4866 B14R1.77 CNC(=O)CCc1cccc(c1)C#N 527a_100102657272_100011998624 [1,1,0,0,0,0|2,0,0]=4 4867 B14R1.77 CNC(=O)CCc1cccc(c1)NC 2230a_100020586499_200000210301 [1,1,0,0,0,0|1,0,0]=3 4868 B14R1.77 CNC(=O)CCc1cccc(c1)NC 34a_100020586499_200000210301 [1,1,0,0,0,0|1,0,0]=3 4869 B14R1.77 CNC(=O)CCc1cccc(c1)NC 7a_100020586499_200000210301 [1,1,0,0,0,0|1,0,0]=3 4870 B14R1.77 CNC(=O)CCc1cccc(c1)N[13CH3] 2230a_100020586499_200025704644 [1,1,0,0,0,0|1,0,0]=3 4871 B14R1.77 CNC(=O)CCc1cccc(c1)N[13CH3] 34a_100020586499_200025704644 [1,1,0,0,0,0|1,0,0]=3 4872 B14R1.77 CNC(=O)CCc1cccc(c1)N[13CH3] 7a_100020586499_200025704644 [1,1,0,0,0,0|1,0,0]=3 4873 B14R1.77 CNC(=O)CCc1cccc(c1)OC 11a_106832991635_100000234931 [1,1,0,0,0,0|0,0,0]=2 4874 B14R1.77 CNC(=O)CCc1cccc(c1)OC 1626a_100102657272_100000234931 [1,1,0,0,0,0|0,0,0]=2 4875 B14R1.77 CNC(=O)CCc1cccc(c1)OC 240690a_100102657272_100000234931 [1,1,0,0,0,0|0,0,0]=2 4876 B14R1.77 CNC(=O)CCc1cccc(c1)OC 527a_100102657272_100000234931 [1,1,0,0,0,0|0,0,0]=2 4877 B14R1.77 CNC(=O)CNc1cccc(c1)OC 34a_100000210024_100000183359 [1,1,0,0,0,0|1,0,0]=3 4878 B14R1.77 CNC(=O)CNc1cccc(c1)SC 2230a_100000210049_100000183359 [1,1,0,0,0,0|1,1,0]=4 4879 B14R1.77 CNC(=O)CNc1cccc(c1)SC 34a_100000210049_100000183359 [1,1,0,0,0,0|1,1,0]=4 4880 B14R1.77 CNC(=O)COc1cccc(c1)NC 2230a_100000738647_200000210301 [1,1,0,0,0,0|2,0,0]=4 4881 B14R1.77 CNC(=O)COc1cccc(c1)NC 34a_100000738647_200000210301 [1,1,0,0,0,0|2,0,0]=4 4882 B14R1.77 CNC(=O)COc1cccc(c1)NC 34a_100000756613_100000183359 [1,1,0,0,0,0|2,0,0]=4 4883 B14R1.77 CNC(=O)COc1cccc(c1)NC 7a_100000756613_100000183359 [1,1,0,0,0,0|2,0,0]=4 4884 B14R1.77 CNC(=O)COc1cccc(c1)N[13CH3] 2230a_100000738647_200025704644 [1,1,0,0,0,0|2,0,0]=4 4885 B14R1.77 CNC(=O)COc1cccc(c1)N[13CH3] 34a_100000738647_200025704644 [1,1,0,0,0,0|2,0,0]=4 4886 B14R1.77 CNC(=O)COc1cccc(c1)OC 11a_106832991635_100000182123 [1,1,0,0,0,0|1,0,0]=3 4887 B14R1.77 CNC(=O)COc1cccc(c1)OC 1626a_100102657272_100000182123 [1,1,0,0,0,0|1,0,0]=3 4888 B14R1.77 CNC(=O)COc1cccc(c1)OC 240690a_100102657272_100000182123 [1,1,0,0,0,0|1,0,0]=3 4889 B14R1.77 CNC(=O)COc1cccc(c1)OC 34a_100000211255_100000183359 [1,1,0,0,0,0|1,0,0]=3 4890 B14R1.77 CNC(=O)COc1cccc(c1)OC 527a_100102657272_100000182123 [1,1,0,0,0,0|1,0,0]=3 4891 B14R1.77 CNC(=O)COc1cccc(c1)OC 7a_100000211255_100000183359 [1,1,0,0,0,0|1,0,0]=3 4892 B14R1.77 CNC(=O)COc1cccc(c1)SC 34a_100011265683_100000183359 [1,1,0,0,0,0|1,1,0]=4 4893 B14R1.77 CNC(=O)COc1cccc(c1)SC 62a_200000150594_200000210301 [1,1,0,0,0,0|1,1,0]=4 4894 B14R1.77 CNC(=O)COc1cccc(c1)SC 62a_200000210301_200000150594 [1,1,0,0,0,0|1,1,0]=4 4895 B14R1.77 CNC(=O)COc1cccc(c1)SC 7a_100011265683_100000183359 [1,1,0,0,0,0|1,1,0]=4 4896 B14R1.77 CNC(=O)COc1cccc(c1)S[13CH3] 62a_200000150594_200025704644 [1,1,0,0,0,0|1,1,0]=4 4897 B14R1.77 CNC(=O)COc1cccc(c1)S[13CH3] 62a_200025704644_200000150594 [1,1,0,0,0,0|1,1,0]=4 4898 B14R1.77 CNC(=O)COc1ccnc(c1)OC 34a_100012181050_100000183359 [1,1,0,0,0,0|2,0,0]=4 4899 B14R1.77 CNC(=O)COc1cncc(c1)OC 34a_100000084572_100000183359 [1,1,0,0,0,0|2,0,0]=4 4900 B14R1.77 CNC(=O)COc1cncc(c1)OC 7a_100000084572_100000183359 [1,1,0,0,0,0|2,0,0]=4 4901 B14R1.77 CNC(=O)CSc1cc(ccn1)OC 62a_100000183359_100011216251 [1,1,0,0,0,0|2,0,0]=4 4902 B14R1.77 CNC(=O)CSc1cc(ccn1)OC 62a_100009817693_100000183359 [1,1,0,0,0,0|2,0,0]=4 4903 B14R1.77 CNC(=O)CSc1cccc(c1)NC 62a_100000183359_100000219648 [1,1,0,0,0,0|2,0,0]=4 4904 B14R1.77 CNC(=O)CSc1cccc(c1)NC 62a_100000219648_100000183359 [1,1,0,0,0,0|2,0,0]=4 4905 B14R1.77 CNC(=O)CSc1cccc(c1)OC 11a_106832991635_100000741315 [1,1,0,0,0,0|1,0,0]=3 4906 B14R1.77 CNC(=O)CSc1cccc(c1)OC 1626a_100102657272_100000741315 [1,1,0,0,0,0|1,0,0]=3 4907 B14R1.77 CNC(=O)CSc1cccc(c1)OC 240690a_100102657272_100000741315 [1,1,0,0,0,0|1,0,0]=3 4908 B14R1.77 CNC(=O)CSc1cccc(c1)OC 527a_100102657272_100000741315 [1,1,0,0,0,0|1,0,0]=3 4909 B14R1.77 CNC(=O)CSc1cccc(c1)OC 62a_100000183359_100000170001 [1,1,0,0,0,0|1,0,0]=3 4910 B14R1.77 CNC(=O)CSc1cccc(c1)SC 62a_100000183359_100011215954 [1,1,0,0,0,0|1,1,0]=4 4911 B14R1.77 CNC(=O)CSc1cccc(c1)SC 62a_100011215954_100000183359 [1,1,0,0,0,0|1,1,0]=4 4912 B14R1.77 CNC(=O)CSc1cccc(n1)OC 62a_100000183359_100000760917 [1,1,0,0,0,0|2,0,0]=4 4913 B14R1.77 CNC(=O)CSc1cccc(n1)OC 62a_100000760917_100000183359 [1,1,0,0,0,0|2,0,0]=4 4914 B14R1.77 CNC(=O)CSc1ccnc(c1)OC 62a_100000117307_100000183359 [1,1,0,0,0,0|2,0,0]=4 4915 B14R1.77 CNC(=O)CSc1ccnc(c1)OC 62a_100000183359_100000117307 [1,1,0,0,0,0|2,0,0]=4 4916 B14R1.77 CNC(=O)CSc1cncc(c1)OC 62a_100000050176_100000183359 [1,1,0,0,0,0|2,0,0]=4 4917 B14R1.77 CNC(=O)CSc1cncc(c1)OC 62a_100000183359_100000050176 [1,1,0,0,0,0|2,0,0]=4 4918 B14R1.77 CNC(=O)NCc1cc(ccn1)OC 2708a_100000706253_106832991635 [1,1,0,0,0,0|2,0,0]=4 4919 B14R1.77 CNC(=O)NCc1cc(ccn1)OC 2708a_100102657272_100000706253 [1,1,0,0,0,0|2,0,0]=4 4920 B14R1.77 CNC(=O)NCc1cc(ccn1)OC 273464a_100102657272_100000706253 [1,1,0,0,0,0|2,0,0]=4 4921 B14R1.77 CNC(=O)NCc1cc(ccn1)OC 512a_100000706253_100102657272 [1,1,0,0,0,0|2,0,0]=4 4922 B14R1.77 CNC(=O)NCc1cc(ccn1)OC 512a_106832991638_100000706253 [1,1,0,0,0,0|2,0,0]=4 4923 B14R1.77 CNC(=O)NCc1cccc(c1)OC 2708a_100000174954_106832991635 [1,1,0,0,0,0|1,0,0]=3 4924 B14R1.77 CNC(=O)NCc1cccc(c1)OC 2708a_100102657272_100000174954 [1,1,0,0,0,0|1,0,0]=3 4925 B14R1.77 CNC(=O)NCc1cccc(c1)OC 273464a_100000174954_100102657272 [1,1,0,0,0,0|1,0,0]=3 4926 B14R1.77 CNC(=O)NCc1cccc(c1)OC 273464a_100102657272_100000174954 [1,1,0,0,0,0|1,0,0]=3 4927 B14R1.77 CNC(=O)NCc1cccc(c1)OC 512a_100000174954_100102657272 [1,1,0,0,0,0|1,0,0]=3 4928 B14R1.77 CNC(=O)NCc1cccc(c1)OC 512a_106832991638_100000174954 [1,1,0,0,0,0|1,0,0]=3 4929 B14R1.77 CNC(=O)NCc1cccc(n1)OC 2708a_100000746380_106832991635 [1,1,0,0,0,0|2,0,0]=4 4930 B14R1.77 CNC(=O)NCc1cccc(n1)OC 2708a_100102657272_100000746380 [1,1,0,0,0,0|2,0,0]=4 4931 B14R1.77 CNC(=O)NCc1cccc(n1)OC 273464a_100000746380_100102657272 [1,1,0,0,0,0|2,0,0]=4 4932 B14R1.77 CNC(=O)NCc1cccc(n1)OC 273464a_100102657272_100000746380 [1,1,0,0,0,0|2,0,0]=4 4933 B14R1.77 CNC(=O)NCc1cccc(n1)OC 512a_100000746380_100102657272 [1,1,0,0,0,0|2,0,0]=4 4934 B14R1.77 CNC(=O)NCc1cccc(n1)OC 512a_106832991638_100000746380 [1,1,0,0,0,0|2,0,0]=4 4935 B14R1.77 CNC(=O)NCc1ccnc(c1)OC 2708a_100102525109_106832991635 [1,1,0,0,0,0|2,0,0]=4 4936 B14R1.77 CNC(=O)NCc1ccnc(c1)OC 2708a_100102657272_100102525109 [1,1,0,0,0,0|2,0,0]=4 4937 B14R1.77 CNC(=O)NCc1ccnc(c1)OC 273464a_100102525109_100102657272 [1,1,0,0,0,0|2,0,0]=4 4938 B14R1.77 CNC(=O)NCc1ccnc(c1)OC 273464a_100102657272_100102525109 [1,1,0,0,0,0|2,0,0]=4 4939 B14R1.77 CNC(=O)NCc1ccnc(c1)OC 512a_100102525109_100102657272 [1,1,0,0,0,0|2,0,0]=4 4940 B14R1.77 CNC(=O)NCc1ccnc(c1)OC 512a_106832991638_100102525109 [1,1,0,0,0,0|2,0,0]=4 4941 B14R1.77 CNC(=O)NCc1cncc(c1)OC 2708a_100020589029_106832991635 [1,1,0,0,0,0|2,0,0]=4 4942 B14R1.77 CNC(=O)NCc1cncc(c1)OC 2708a_100102657272_100020589029 [1,1,0,0,0,0|2,0,0]=4 4943 B14R1.77 CNC(=O)NCc1cncc(c1)OC 273464a_100020589029_100102657272 [1,1,0,0,0,0|2,0,0]=4 4944 B14R1.77 CNC(=O)NCc1cncc(c1)OC 273464a_100102657272_100020589029 [1,1,0,0,0,0|2,0,0]=4 4945 B14R1.77 CNC(=O)NCc1cncc(c1)OC 512a_100020589029_100102657272 [1,1,0,0,0,0|2,0,0]=4 4946 B14R1.77 CNC(=O)NCc1cncc(c1)OC 512a_106832991638_100020589029 [1,1,0,0,0,0|2,0,0]=4 4947 B14R1.77 CNC(=O)NNc1cccc(c1)OC 273464a_100102657272_100000722927 [1,1,0,0,0,0|2,0,0]=4 4948 B14R1.77 CNC(=O)NNc1cccc(c1)OC 512a_100000722927_100102657272 [1,1,0,0,0,0|2,0,0]=4 4949 B14R1.77 CNC(=O)NNc1cccc(c1)OC 512a_106832991638_100000722927 [1,1,0,0,0,0|2,0,0]=4 4950 B14R1.77 CNc1cccc(c1)OCC(=O)OC 34a_100000756613_100000747449 [1,1,0,0,0,0|2,0,0]=4 4951 B14R1.77 CNc1cccc(c1)OCC(=O)OC 7a_100000756613_100000747449 [1,1,0,0,0,0|2,0,0]=4 4952 B14R1.77 CNc1cccc(c1)SCC(=O)OC 62a_100000219648_100000747449 [1,1,0,0,0,0|2,0,0]=4 4953 B14R1.77 CNc1cccc(c1)SCC(=O)OC 62a_100000747449_100000219648 [1,1,0,0,0,0|2,0,0]=4 4954 B14R1.77 COC(=O)/C=C/c1cccc(c1)OC 34a_200102525237_200000210301 [1,1,0,0,0,0|0,0,2]=4 4955 B14R1.77 COC(=O)/C=C/c1cccc(c1)OC 7a_200102525237_200000210301 [1,1,0,0,0,0|0,0,2]=4 4956 B14R1.77 COC(=O)/C=C/c1cccc(c1)O[13CH3] 34a_200102525237_200025704644 [1,1,0,0,0,0|0,0,2]=4 4957 B14R1.77 COC(=O)/C=C/c1cccc(c1)O[13CH3] 7a_200102525237_200025704644 [1,1,0,0,0,0|0,0,2]=4 4958 B14R1.77 COC(=O)CCc1cccc(c1)OC 34a_100000067588_200000210301 [1,1,0,0,0,0|0,0,0]=2 4959 B14R1.77 COC(=O)CCc1cccc(c1)OC 7a_100000067588_200000210301 [1,1,0,0,0,0|0,0,0]=2 4960 B14R1.77 COC(=O)CCc1cccc(c1)O[13CH3] 34a_100000067588_200025704644 [1,1,0,0,0,0|0,0,0]=2 4961 B14R1.77 COC(=O)CCc1cccc(c1)O[13CH3] 7a_100000067588_200025704644 [1,1,0,0,0,0|0,0,0]=2 4962 B14R1.77 COC(=O)CCc1cccc(c1)SC 62a_100000151591_200000210301 [1,1,0,0,0,0|0,1,0]=3 4963 B14R1.77 COC(=O)CCc1cccc(c1)SC 62a_200000210301_100000151591 [1,1,0,0,0,0|0,1,0]=3 4964 B14R1.77 COC(=O)CCc1cccc(c1)S[13CH3] 62a_100000151591_200025704644 [1,1,0,0,0,0|0,1,0]=3 4965 B14R1.77 COC(=O)CCc1cccc(c1)S[13CH3] 62a_200025704644_100000151591 [1,1,0,0,0,0|0,1,0]=3 4966 B14R1.77 COC(=O)CNc1cccc(c1)OC 34a_100000210024_100000747449 [1,1,0,0,0,0|1,0,0]=3 4967 B14R1.77 COC(=O)CNc1cccc(c1)SC 2230a_100000210049_100000747449 [1,1,0,0,0,0|1,1,0]=4 4968 B14R1.77 COC(=O)CNc1cccc(c1)SC 34a_100000210049_100000747449 [1,1,0,0,0,0|1,1,0]=4 4969 B14R1.77 COC(=O)COc1cccc(c1)OC 34a_100000211255_100000747449 [1,1,0,0,0,0|1,0,0]=3 4970 B14R1.77 COC(=O)COc1cccc(c1)OC 7a_100000211255_100000747449 [1,1,0,0,0,0|1,0,0]=3 4971 B14R1.77 COC(=O)COc1cccc(c1)SC 34a_100011265683_100000747449 [1,1,0,0,0,0|1,1,0]=4 4972 B14R1.77 COC(=O)COc1cccc(c1)SC 62a_200000148702_200000210301 [1,1,0,0,0,0|1,1,0]=4 4973 B14R1.77 COC(=O)COc1cccc(c1)SC 62a_200000210301_200000148702 [1,1,0,0,0,0|1,1,0]=4 4974 B14R1.77 COC(=O)COc1cccc(c1)SC 7a_100011265683_100000747449 [1,1,0,0,0,0|1,1,0]=4 4975 B14R1.77 COC(=O)COc1cccc(c1)S[13CH3] 62a_200000148702_200025704644 [1,1,0,0,0,0|1,1,0]=4 4976 B14R1.77 COC(=O)COc1cccc(c1)S[13CH3] 62a_200025704644_200000148702 [1,1,0,0,0,0|1,1,0]=4 4977 B14R1.77 COC(=O)COc1ccnc(c1)OC 34a_100012181050_100000747449 [1,1,0,0,0,0|2,0,0]=4 4978 B14R1.77 COC(=O)COc1cncc(c1)OC 34a_100000084572_100000747449 [1,1,0,0,0,0|2,0,0]=4 4979 B14R1.77 COC(=O)COc1cncc(c1)OC 7a_100000084572_100000747449 [1,1,0,0,0,0|2,0,0]=4 4980 B14R1.77 COC(=O)CSc1cc(ccn1)OC 62a_100000747449_100011216251 [1,1,0,0,0,0|2,0,0]=4 4981 B14R1.77 COC(=O)CSc1cc(ccn1)OC 62a_100009817693_100000747449 [1,1,0,0,0,0|2,0,0]=4 4982 B14R1.77 COC(=O)CSc1cccc(c1)OC 62a_100000747449_100000170001 [1,1,0,0,0,0|1,0,0]=3 4983 B14R1.77 COC(=O)CSc1cccc(c1)SC 62a_100000747449_100011215954 [1,1,0,0,0,0|1,1,0]=4 4984 B14R1.77 COC(=O)CSc1cccc(c1)SC 62a_100011215954_100000747449 [1,1,0,0,0,0|1,1,0]=4 4985 B14R1.77 COC(=O)CSc1cccc(c1)SC 62a_100011756034_200000210301 [1,1,0,0,0,0|1,1,0]=4 4986 B14R1.77 COC(=O)CSc1cccc(c1)SC 62a_200000210301_100011756034 [1,1,0,0,0,0|1,1,0]=4 4987 B14R1.77 COC(=O)CSc1cccc(c1)S[13CH3] 62a_100011756034_200025704644 [1,1,0,0,0,0|1,1,0]=4 4988 B14R1.77 COC(=O)CSc1cccc(c1)S[13CH3] 62a_200025704644_100011756034 [1,1,0,0,0,0|1,1,0]=4 4989 B14R1.77 COC(=O)CSc1cccc(n1)OC 62a_100000747449_100000760917 [1,1,0,0,0,0|2,0,0]=4 4990 B14R1.77 COC(=O)CSc1cccc(n1)OC 62a_100000760917_100000747449 [1,1,0,0,0,0|2,0,0]=4 4991 B14R1.77 COC(=O)CSc1ccnc(c1)OC 62a_100000117307_100000747449 [1,1,0,0,0,0|2,0,0]=4 4992 B14R1.77 COC(=O)CSc1ccnc(c1)OC 62a_100000747449_100000117307 [1,1,0,0,0,0|2,0,0]=4 4993 B14R1.77 COC(=O)CSc1cncc(c1)OC 62a_100000050176_100000747449 [1,1,0,0,0,0|2,0,0]=4 4994 B14R1.77 COC(=O)CSc1cncc(c1)OC 62a_100000747449_100000050176 [1,1,0,0,0,0|2,0,0]=4 4995 B14R1.77 COc1cc(ccn1)CNC(=O)CO 240690a_100102525109_100000210174 [1,1,0,0,0,0|2,0,0]=4 4996 B14R1.77 COc1cc(ccn1)CNC(=O)CO 527a_100102525109_100000210174 [1,1,0,0,0,0|2,0,0]=4 4997 B14R1.77 COc1cccc(c1)CCC(=O)CF 1458a_100000234931_100015361967 [1,1,0,0,0,0|0,0,0]=2 4998 B14R1.77 COc1cccc(c1)CCC(=O)CO 1458a_100000210174_100011713679 [1,1,0,0,0,0|0,0,0]=2 4999 B14R1.77 COc1cccc(c1)CCN(C)CF 269982a_100011269071_100015361967 [1,1,0,0,0,0|2,0,0]=4 5000 B14R1.77 COc1cccc(c1)CCN(C)CF 34a_100011269071_100015361967 [1,1,0,0,0,0|2,0,0]=4 5001 B14R1.77 COc1cccc(c1)CNC(=O)CO 240690a_100000174954_100000210174 [1,1,0,0,0,0|1,0,0]=3 5002 B14R1.77 COc1cccc(c1)CNC(=O)CO 527a_100000174954_100000210174 [1,1,0,0,0,0|1,0,0]=3 5003 B14R1.77 COc1cccc(c1)NNC(=O)CO 22a_100000722927_100000210174 [1,1,0,0,0,0|2,0,0]=4 5004 B14R1.77 COc1cccc(c1)OCC(=O)CF 1458a_100000182123_100015361967 [1,1,0,0,0,0|1,0,0]=3 5005 B14R1.77 COc1cccc(c1)SCC(=O)CF 1458a_100000741315_100015361967 [1,1,0,0,0,0|1,0,0]=3 5006 B14R1.77 COc1cccc(n1)CNC(=O)CO 240690a_100000746380_100000210174 [1,1,0,0,0,0|2,0,0]=4 5007 B14R1.77 COc1cccc(n1)CNC(=O)CO 527a_100000746380_100000210174 [1,1,0,0,0,0|2,0,0]=4 5008 B14R1.77 COc1ccnc(c1)CNC(=O)CO 240690a_100000706253_100000210174 [1,1,0,0,0,0|2,0,0]=4 5009 B14R1.77 COc1ccnc(c1)CNC(=O)CO 527a_100000706253_100000210174 [1,1,0,0,0,0|2,0,0]=4 5010 B14R1.77 COc1cncc(c1)CNC(=O)CO 240690a_100020589029_100000210174 [1,1,0,0,0,0|2,0,0]=4 5011 B14R1.77 COc1cncc(c1)CNC(=O)CO 527a_100020589029_100000210174 [1,1,0,0,0,0|2,0,0]=4 5012 B14R1.77 N#Cc1cccc(c1)CCC(=O)CF 1458a_100011998624_100015361967 [1,1,0,0,0,0|2,0,0]=4 5013 B14R1.81 C=C(C)CNc1cccc(c1Br)OC 34a_100000703447_100000748629 [1,1,0,0,0,0|2,0,0]=4 5014 B14R1.81 C=C(C)CNc1cccc(c1C)OC 34a_100011244893_100000748629 [1,1,0,0,0,0|2,0,0]=4 5015 B14R1.81 C=C(C)CNc1cccc(c1C)OC 7a_100011244893_100000748629 [1,1,0,0,0,0|2,0,0]=4 5016 B14R1.81 C=C(C)CNc1cccc(c1Cl)OC 34a_100000089720_100000748629 [1,1,0,0,0,0|2,0,0]=4 5017 B14R1.81 C=C(C)CNc1cccc(c1F)OC 34a_100000100910_100000748629 [1,1,0,0,0,0|2,0,0]=4 5018 B14R1.81 C=C(C)CNc1cccc(c1I)OC 34a_100010245509_100000748629 [1,1,0,0,0,0|2,0,0]=4 5019 B14R1.81 C=C(C)CNc1cccc(c1O)OC 34a_100000123586_100000748629 [1,1,0,0,0,0|2,0,0]=4 5020 B14R1.81 C=C(C)COc1cccc(c1Br)OC 34a_100010202623_100000748629 [1,1,0,0,0,0|2,0,0]=4 5021 B14R1.81 C=C(C)COc1cccc(c1Br)OC 7a_100010202623_100000748629 [1,1,0,0,0,0|2,0,0]=4 5022 B14R1.81 C=C(C)COc1cccc(c1Cl)OC 34a_100000087810_100000748629 [1,1,0,0,0,0|2,0,0]=4 5023 B14R1.81 C=C(C)COc1cccc(c1Cl)OC 7a_100000087810_100000748629 [1,1,0,0,0,0|2,0,0]=4 5024 B14R1.81 C=C(C)COc1cccc(c1F)OC 34a_100000102366_100000748629 [1,1,0,0,0,0|2,0,0]=4 5025 B14R1.81 C=C(C)COc1cccc(c1F)OC 7a_100000102366_100000748629 [1,1,0,0,0,0|2,0,0]=4 5026 B14R1.81 C=C(C)COc1cccc(c1I)OC 34a_200010201982_100000748629 [1,1,0,0,0,0|2,0,0]=4 5027 B14R1.81 C=C(C)COc1cccc(c1I)OC 7a_200010201982_100000748629 [1,1,0,0,0,0|2,0,0]=4 5028 B14R1.81 C=C(C)COc1cccc(c1N)OC 34a_100012022766_100000748629 [1,1,0,0,0,0|2,0,0]=4 5029 B14R1.81 C=C(C)COc1cccc(c1N)OC 7a_100012022766_100000748629 [1,1,0,0,0,0|2,0,0]=4 5030 B14R1.81 C=C(C)CSc1cccc(c1Br)OC 62a_100000748629_100010146559 [1,1,0,0,0,0|2,0,0]=4 5031 B14R1.81 C=C(C)CSc1cccc(c1Br)OC 62a_100010146559_100000211660 [1,1,0,0,0,0|2,0,0]=4 5032 B14R1.81 C=C(C)CSc1cccc(c1C)OC 62a_100000748629_100010002647 [1,1,0,0,0,0|2,0,0]=4 5033 B14R1.81 C=C(C)CSc1cccc(c1C)OC 62a_100010002647_100000211660 [1,1,0,0,0,0|2,0,0]=4 5034 B14R1.81 C=C(C)CSc1cccc(c1Cl)OC 62a_100000748629_100010147677 [1,1,0,0,0,0|2,0,0]=4 5035 B14R1.81 C=C(C)CSc1cccc(c1Cl)OC 62a_100010147677_100000211660 [1,1,0,0,0,0|2,0,0]=4 5036 B14R1.81 C=C(C)CSc1cccc(c1F)OC 62a_100000748629_100010185846 [1,1,0,0,0,0|2,0,0]=4 5037 B14R1.81 C=C(C)CSc1cccc(c1F)OC 62a_100010185846_100000211660 [1,1,0,0,0,0|2,0,0]=4 5038 B14R1.81 C=C(C)CSc1cccc(c1N)OC 62a_100000708083_100000211660 [1,1,0,0,0,0|2,0,0]=4 5039 B14R1.81 C=C(C)CSc1cccc(c1O)OC 62a_100000748629_100000686866 [1,1,0,0,0,0|2,0,0]=4 5040 B14R1.81 COc1cccc(c1Br)NCC(=O)N 34a_100000703447_100000187820 [1,1,0,0,0,0|2,0,0]=4 5041 B14R1.81 COc1cccc(c1Br)NCC(=O)[O-] 34a_100000703447_100020667443 [1,1,0,0,0,0|2,0,0]=4 5042 B14R1.81 COc1cccc(c1Br)OCC(=O)N 34a_100010202623_100000187820 [1,1,0,0,0,0|2,0,0]=4 5043 B14R1.81 COc1cccc(c1Br)OCC(=O)N 7a_100010202623_100000187820 [1,1,0,0,0,0|2,0,0]=4 5044 B14R1.81 COc1cccc(c1Br)OCC(=O)[O-] 34a_100010202623_100020667443 [1,1,0,0,0,0|2,0,0]=4 5045 B14R1.81 COc1cccc(c1Br)SCC(=O)N 62a_100000747473_100010146559 [1,1,0,0,0,0|2,0,0]=4 5046 B14R1.81 COc1cccc(c1Br)SCC(=O)N 62a_100010146559_100000747473 [1,1,0,0,0,0|2,0,0]=4 5047 B14R1.81 COc1cccc(c1Br)SCC(=O)[O-] 62a_100010146559_100020667443 [1,1,0,0,0,0|2,0,0]=4 5048 B14R1.81 COc1cccc(c1Br)SCC(=O)[O-] 62a_100020667443_100010146559 [1,1,0,0,0,0|2,0,0]=4 5049 B14R1.81 COc1cccc(c1C)NCC(=O)N 34a_100011244893_100000187820 [1,1,0,0,0,0|2,0,0]=4 5050 B14R1.81 COc1cccc(c1C)NCC(=O)N 7a_100011244893_100000187820 [1,1,0,0,0,0|2,0,0]=4 5051 B14R1.81 COc1cccc(c1C)NCC(=O)[O-] 34a_100011244893_100020667443 [1,1,0,0,0,0|2,0,0]=4 5052 B14R1.81 COc1cccc(c1C)SCC(=O)N 62a_100000747473_100010002647 [1,1,0,0,0,0|2,0,0]=4 5053 B14R1.81 COc1cccc(c1C)SCC(=O)N 62a_100010002647_100000747473 [1,1,0,0,0,0|2,0,0]=4 5054 B14R1.81 COc1cccc(c1C)SCC(=O)[O-] 62a_100010002647_100020667443 [1,1,0,0,0,0|2,0,0]=4 5055 B14R1.81 COc1cccc(c1C)SCC(=O)[O-] 62a_100020667443_100010002647 [1,1,0,0,0,0|2,0,0]=4 5056 B14R1.81 COc1cccc(c1Cl)CCC(=O)C 1458a_200000068528_200000210301 [1,1,0,0,0,0|0,0,0]=2 5057 B14R1.81 COc1cccc(c1Cl)CCC(=O)[13CH3] 1458a_200000068528_200025704644 [1,1,0,0,0,0|0,0,0]=2 5058 B14R1.81 COc1cccc(c1Cl)NCC(=O)N 34a_100000089720_100000187820 [1,1,0,0,0,0|2,0,0]=4 5059 B14R1.81 COc1cccc(c1Cl)NCC(=O)[O-] 34a_100000089720_100020667443 [1,1,0,0,0,0|2,0,0]=4 5060 B14R1.81 COc1cccc(c1Cl)OCC(=O)N 34a_100000087810_100000187820 [1,1,0,0,0,0|2,0,0]=4 5061 B14R1.81 COc1cccc(c1Cl)OCC(=O)N 7a_100000087810_100000187820 [1,1,0,0,0,0|2,0,0]=4 5062 B14R1.81 COc1cccc(c1Cl)OCC(=O)[O-] 34a_100000087810_100020667443 [1,1,0,0,0,0|2,0,0]=4 5063 B14R1.81 COc1cccc(c1Cl)SCC(=O)N 62a_100000747473_100010147677 [1,1,0,0,0,0|2,0,0]=4 5064 B14R1.81 COc1cccc(c1Cl)SCC(=O)N 62a_100010147677_100000747473 [1,1,0,0,0,0|2,0,0]=4 5065 B14R1.81 COc1cccc(c1Cl)SCC(=O)[O-] 62a_100010147677_100020667443 [1,1,0,0,0,0|2,0,0]=4 5066 B14R1.81 COc1cccc(c1Cl)SCC(=O)[O-] 62a_100020667443_100010147677 [1,1,0,0,0,0|2,0,0]=4 5067 B14R1.81 COc1cccc(c1F)CNC(=O)C 11a_100137345169_100015343762 [1,1,0,0,0,0|1,0,0]=3 5068 B14R1.81 COc1cccc(c1F)CNC(=O)C 1626a_100137345169_100015343762 [1,1,0,0,0,0|1,0,0]=3 5069 B14R1.81 COc1cccc(c1F)CNC(=O)C 240690a_100137345169_100015343762 [1,1,0,0,0,0|1,0,0]=3 5070 B14R1.81 COc1cccc(c1F)CNC(=O)C 527a_100137345169_100103153847 [1,1,0,0,0,0|1,0,0]=3 5071 B14R1.81 COc1cccc(c1F)NCC(=O)N 34a_100000100910_100000187820 [1,1,0,0,0,0|2,0,0]=4 5072 B14R1.81 COc1cccc(c1F)NCC(=O)[O-] 34a_100000100910_100020667443 [1,1,0,0,0,0|2,0,0]=4 5073 B14R1.81 COc1cccc(c1F)OCC(=O)N 34a_100000102366_100000187820 [1,1,0,0,0,0|2,0,0]=4 5074 B14R1.81 COc1cccc(c1F)OCC(=O)N 7a_100000102366_100000187820 [1,1,0,0,0,0|2,0,0]=4 5075 B14R1.81 COc1cccc(c1F)OCC(=O)[O-] 34a_100000102366_100020667443 [1,1,0,0,0,0|2,0,0]=4 5076 B14R1.81 COc1cccc(c1F)SCC(=O)N 62a_100000747473_100010185846 [1,1,0,0,0,0|2,0,0]=4 5077 B14R1.81 COc1cccc(c1F)SCC(=O)N 62a_100010185846_100000747473 [1,1,0,0,0,0|2,0,0]=4 5078 B14R1.81 COc1cccc(c1F)SCC(=O)[O-] 62a_100010185846_100020667443 [1,1,0,0,0,0|2,0,0]=4 5079 B14R1.81 COc1cccc(c1F)SCC(=O)[O-] 62a_100020667443_100010185846 [1,1,0,0,0,0|2,0,0]=4 5080 B14R1.81 COc1cccc(c1I)NCC(=O)N 34a_100010245509_100000187820 [1,1,0,0,0,0|2,0,0]=4 5081 B14R1.81 COc1cccc(c1I)NCC(=O)[O-] 34a_100010245509_100020667443 [1,1,0,0,0,0|2,0,0]=4 5082 B14R1.81 COc1cccc(c1I)OCC(=O)N 34a_200010201982_100000187820 [1,1,0,0,0,0|2,0,0]=4 5083 B14R1.81 COc1cccc(c1I)OCC(=O)N 7a_200010201982_100000187820 [1,1,0,0,0,0|2,0,0]=4 5084 B14R1.81 COc1cccc(c1I)OCC(=O)[O-] 34a_200010201982_100020667443 [1,1,0,0,0,0|2,0,0]=4 5085 B14R1.81 COc1cccc(c1N)OCC(=O)N 34a_100012022766_100000187820 [1,1,0,0,0,0|2,0,0]=4 5086 B14R1.81 COc1cccc(c1N)OCC(=O)N 7a_100012022766_100000187820 [1,1,0,0,0,0|2,0,0]=4 5087 B14R1.81 COc1cccc(c1N)OCC(=O)[O-] 34a_100012022766_100020667443 [1,1,0,0,0,0|2,0,0]=4 5088 B14R1.81 COc1cccc(c1N)SCC(=O)N 62a_100000708083_100000747473 [1,1,0,0,0,0|2,0,0]=4 5089 B14R1.81 COc1cccc(c1N)SCC(=O)[O-] 62a_100000708083_100020667443 [1,1,0,0,0,0|2,0,0]=4 5090 B14R1.81 COc1cccc(c1O)NCC(=O)N 34a_100000123586_100000187820 [1,1,0,0,0,0|2,0,0]=4 5091 B14R1.81 COc1cccc(c1O)NCC(=O)[O-] 34a_100000123586_100020667443 [1,1,0,0,0,0|2,0,0]=4 5092 B14R1.81 COc1cccc(c1O)SCC(=O)N 62a_100000747473_100000686866 [1,1,0,0,0,0|2,0,0]=4 5093 B14R1.81 COc1cccc(c1O)SCC(=O)[O-] 62a_100020667443_100000686866 [1,1,0,0,0,0|2,0,0]=4 5094 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)Br 34a_100000750983_100000748629 [1,1,0,0,0,0|2,0,0]=4 5095 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)Br 7a_100000750983_100000748629 [1,1,0,0,0,0|2,0,0]=4 5096 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)C 2230a_100012001870_100000748629 [1,1,0,0,0,0|2,0,0]=4 5097 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)C 34a_100012001870_100000748629 [1,1,0,0,0,0|2,0,0]=4 5098 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)C 7a_100012001870_100000748629 [1,1,0,0,0,0|2,0,0]=4 5099 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)Cl 2230a_100000051436_100000748629 [1,1,0,0,0,0|2,0,0]=4 5100 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)Cl 34a_100000051436_100000748629 [1,1,0,0,0,0|2,0,0]=4 5101 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)Cl 7a_100000051436_100000748629 [1,1,0,0,0,0|2,0,0]=4 5102 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)F 2230a_100000687699_100000748629 [1,1,0,0,0,0|2,0,0]=4 5103 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)F 34a_100000687699_100000748629 [1,1,0,0,0,0|2,0,0]=4 5104 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)F 7a_100000687699_100000748629 [1,1,0,0,0,0|2,0,0]=4 5105 B14R1.376 C=C(C)CNc1cc(cc(c1)OC)O 34a_200000692186_100000748629 [1,1,0,0,0,0|2,0,0]=4 5106 B14R1.376 C=C(C)COc1cc(cc(c1)OC)Br 34a_100010068927_100000748629 [1,1,0,0,0,0|2,0,0]=4 5107 B14R1.376 C=C(C)COc1cc(cc(c1)OC)Br 7a_100010068927_100000748629 [1,1,0,0,0,0|2,0,0]=4 5108 B14R1.376 C=C(C)COc1cc(cc(c1)OC)C 34a_100011216608_100000748629 [1,1,0,0,0,0|2,0,0]=4 5109 B14R1.376 C=C(C)COc1cc(cc(c1)OC)C 7a_100011216608_100000748629 [1,1,0,0,0,0|2,0,0]=4 5110 B14R1.376 C=C(C)COc1cc(cc(c1)OC)Cl 34a_100000051430_100000748629 [1,1,0,0,0,0|2,0,0]=4 5111 B14R1.376 C=C(C)COc1cc(cc(c1)OC)Cl 7a_100000051430_100000748629 [1,1,0,0,0,0|2,0,0]=4 5112 B14R1.376 C=C(C)COc1cc(cc(c1)OC)F 34a_100011369910_100000748629 [1,1,0,0,0,0|2,0,0]=4 5113 B14R1.376 C=C(C)COc1cc(cc(c1)OC)F 7a_100011369910_100000748629 [1,1,0,0,0,0|2,0,0]=4 5114 B14R1.376 C=C(C)COc1cc(cc(c1)OC)N 34a_200000692186_100000748629 [1,1,0,0,0,0|2,0,0]=4 5115 B14R1.376 C=C(C)COc1cc(cc(c1)OC)N 7a_200000692186_100000748629 [1,1,0,0,0,0|2,0,0]=4 5116 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)Br 62a_100000748629_100010141301 [1,1,0,0,0,0|2,0,0]=4 5117 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)Br 62a_100010141301_100000211660 [1,1,0,0,0,0|2,0,0]=4 5118 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)C 62a_100000748629_100010187550 [1,1,0,0,0,0|2,0,0]=4 5119 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)Cl 62a_100000748629_100010147680 [1,1,0,0,0,0|2,0,0]=4 5120 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)Cl 62a_100010147680_100000211660 [1,1,0,0,0,0|2,0,0]=4 5121 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)F 62a_100000748629_100011934182 [1,1,0,0,0,0|2,0,0]=4 5122 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)F 62a_100011934182_100000211660 [1,1,0,0,0,0|2,0,0]=4 5123 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)N 62a_100000748629_100000750983 [1,1,0,0,0,0|2,0,0]=4 5124 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)N 62a_100000750983_100000211660 [1,1,0,0,0,0|2,0,0]=4 5125 B14R1.376 C=C(C)CSc1cc(cc(c1)OC)O 62a_100000748629_100010068927 [1,1,0,0,0,0|2,0,0]=4 5126 B14R1.376 COc1cc(cc(c1)CCC(=O)C)Br 1458a_200010146835_200000210301 [1,1,0,0,0,0|0,0,0]=2 5127 B14R1.376 COc1cc(cc(c1)CCC(=O)[13CH3])Br 1458a_200010146835_200025704644 [1,1,0,0,0,0|0,0,0]=2 5128 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 11a_106744500063_100015343762 [1,1,0,0,0,0|1,0,0]=3 5129 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 1626a_106744500063_100015343762 [1,1,0,0,0,0|1,0,0]=3 5130 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 240690a_106744500063_100015343762 [1,1,0,0,0,0|1,0,0]=3 5131 B14R1.376 COc1cc(cc(c1)CNC(=O)C)Cl 527a_106744500063_100103153847 [1,1,0,0,0,0|1,0,0]=3 5132 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 11a_100000696013_100015343762 [1,1,0,0,0,0|1,0,0]=3 5133 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 1626a_100000696013_100015343762 [1,1,0,0,0,0|1,0,0]=3 5134 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 240690a_100000696013_100015343762 [1,1,0,0,0,0|1,0,0]=3 5135 B14R1.376 COc1cc(cc(c1)CNC(=O)C)F 527a_100000696013_100103153847 [1,1,0,0,0,0|1,0,0]=3 5136 B14R1.376 COc1cc(cc(c1)NCC(=O)N)Br 34a_100000750983_100000187820 [1,1,0,0,0,0|2,0,0]=4 5137 B14R1.376 COc1cc(cc(c1)NCC(=O)N)Br 7a_100000750983_100000187820 [1,1,0,0,0,0|2,0,0]=4 5138 B14R1.376 COc1cc(cc(c1)NCC(=O)N)C 2230a_100012001870_100000747473 [1,1,0,0,0,0|2,0,0]=4 5139 B14R1.376 COc1cc(cc(c1)NCC(=O)N)C 34a_100012001870_100000187820 [1,1,0,0,0,0|2,0,0]=4 5140 B14R1.376 COc1cc(cc(c1)NCC(=O)N)C 7a_100012001870_100000187820 [1,1,0,0,0,0|2,0,0]=4 5141 B14R1.376 COc1cc(cc(c1)NCC(=O)N)Cl 2230a_100000051436_100000747473 [1,1,0,0,0,0|2,0,0]=4 5142 B14R1.376 COc1cc(cc(c1)NCC(=O)N)Cl 34a_100000051436_100000187820 [1,1,0,0,0,0|2,0,0]=4 5143 B14R1.376 COc1cc(cc(c1)NCC(=O)N)Cl 7a_100000051436_100000187820 [1,1,0,0,0,0|2,0,0]=4 5144 B14R1.376 COc1cc(cc(c1)NCC(=O)N)F 2230a_100000687699_100000747473 [1,1,0,0,0,0|2,0,0]=4 5145 B14R1.376 COc1cc(cc(c1)NCC(=O)N)F 34a_100000687699_100000187820 [1,1,0,0,0,0|2,0,0]=4 5146 B14R1.376 COc1cc(cc(c1)NCC(=O)N)F 7a_100000687699_100000187820 [1,1,0,0,0,0|2,0,0]=4 5147 B14R1.376 COc1cc(cc(c1)NCC(=O)N)O 34a_200000692186_100000187820 [1,1,0,0,0,0|2,0,0]=4 5148 B14R1.376 COc1cc(cc(c1)NCC(=O)[O-])Br 34a_100000750983_100020667443 [1,1,0,0,0,0|2,0,0]=4 5149 B14R1.376 COc1cc(cc(c1)NCC(=O)[O-])C 34a_100012001870_100020667443 [1,1,0,0,0,0|2,0,0]=4 5150 B14R1.376 COc1cc(cc(c1)NCC(=O)[O-])Cl 34a_100000051436_100020667443 [1,1,0,0,0,0|2,0,0]=4 5151 B14R1.376 COc1cc(cc(c1)NCC(=O)[O-])F 34a_100000687699_100020667443 [1,1,0,0,0,0|2,0,0]=4 5152 B14R1.376 COc1cc(cc(c1)NCC(=O)[O-])O 34a_200000692186_100020667443 [1,1,0,0,0,0|2,0,0]=4 5153 B14R1.376 COc1cc(cc(c1)OCC(=O)N)Br 34a_100010068927_100000187820 [1,1,0,0,0,0|2,0,0]=4 5154 B14R1.376 COc1cc(cc(c1)OCC(=O)N)Br 7a_100010068927_100000187820 [1,1,0,0,0,0|2,0,0]=4 5155 B14R1.376 COc1cc(cc(c1)OCC(=O)N)C 34a_100011216608_100000187820 [1,1,0,0,0,0|2,0,0]=4 5156 B14R1.376 COc1cc(cc(c1)OCC(=O)N)C 7a_100011216608_100000187820 [1,1,0,0,0,0|2,0,0]=4 5157 B14R1.376 COc1cc(cc(c1)OCC(=O)N)Cl 34a_100000051430_100000187820 [1,1,0,0,0,0|2,0,0]=4 5158 B14R1.376 COc1cc(cc(c1)OCC(=O)N)Cl 7a_100000051430_100000187820 [1,1,0,0,0,0|2,0,0]=4 5159 B14R1.376 COc1cc(cc(c1)OCC(=O)N)F 34a_100011369910_100000187820 [1,1,0,0,0,0|2,0,0]=4 5160 B14R1.376 COc1cc(cc(c1)OCC(=O)N)F 7a_100011369910_100000187820 [1,1,0,0,0,0|2,0,0]=4 5161 B14R1.376 COc1cc(cc(c1)OCC(=O)N)N 34a_200000692186_100000187820 [1,1,0,0,0,0|2,0,0]=4 5162 B14R1.376 COc1cc(cc(c1)OCC(=O)N)N 7a_200000692186_100000187820 [1,1,0,0,0,0|2,0,0]=4 5163 B14R1.376 COc1cc(cc(c1)OCC(=O)[O-])Br 34a_100010068927_100020667443 [1,1,0,0,0,0|2,0,0]=4 5164 B14R1.376 COc1cc(cc(c1)OCC(=O)[O-])C 34a_100011216608_100020667443 [1,1,0,0,0,0|2,0,0]=4 5165 B14R1.376 COc1cc(cc(c1)OCC(=O)[O-])Cl 34a_100000051430_100020667443 [1,1,0,0,0,0|2,0,0]=4 5166 B14R1.376 COc1cc(cc(c1)OCC(=O)[O-])F 34a_100011369910_100020667443 [1,1,0,0,0,0|2,0,0]=4 5167 B14R1.376 COc1cc(cc(c1)OCC(=O)[O-])N 34a_200000692186_100020667443 [1,1,0,0,0,0|2,0,0]=4 5168 B14R1.376 COc1cc(cc(c1)SCC(=O)N)Br 62a_100000747473_100010141301 [1,1,0,0,0,0|2,0,0]=4 5169 B14R1.376 COc1cc(cc(c1)SCC(=O)N)Br 62a_100010141301_100000747473 [1,1,0,0,0,0|2,0,0]=4 5170 B14R1.376 COc1cc(cc(c1)SCC(=O)N)C 62a_100000747473_100010187550 [1,1,0,0,0,0|2,0,0]=4 5171 B14R1.376 COc1cc(cc(c1)SCC(=O)N)Cl 62a_100000747473_100010147680 [1,1,0,0,0,0|2,0,0]=4 5172 B14R1.376 COc1cc(cc(c1)SCC(=O)N)Cl 62a_100010147680_100000747473 [1,1,0,0,0,0|2,0,0]=4 5173 B14R1.376 COc1cc(cc(c1)SCC(=O)N)F 62a_100000747473_100011934182 [1,1,0,0,0,0|2,0,0]=4 5174 B14R1.376 COc1cc(cc(c1)SCC(=O)N)F 62a_100011934182_100000747473 [1,1,0,0,0,0|2,0,0]=4 5175 B14R1.376 COc1cc(cc(c1)SCC(=O)N)N 62a_100000747473_100000750983 [1,1,0,0,0,0|2,0,0]=4 5176 B14R1.376 COc1cc(cc(c1)SCC(=O)N)N 62a_100000750983_100000747473 [1,1,0,0,0,0|2,0,0]=4 5177 B14R1.376 COc1cc(cc(c1)SCC(=O)N)O 62a_100000747473_100010068927 [1,1,0,0,0,0|2,0,0]=4 5178 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])Br 62a_100010141301_100020667443 [1,1,0,0,0,0|2,0,0]=4 5179 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])Br 62a_100020667443_100010141301 [1,1,0,0,0,0|2,0,0]=4 5180 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])C 62a_100020667443_100010187550 [1,1,0,0,0,0|2,0,0]=4 5181 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])Cl 62a_100010147680_100020667443 [1,1,0,0,0,0|2,0,0]=4 5182 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])Cl 62a_100020667443_100010147680 [1,1,0,0,0,0|2,0,0]=4 5183 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])F 62a_100011934182_100020667443 [1,1,0,0,0,0|2,0,0]=4 5184 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])F 62a_100020667443_100011934182 [1,1,0,0,0,0|2,0,0]=4 5185 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])N 62a_100000750983_100020667443 [1,1,0,0,0,0|2,0,0]=4 5186 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])N 62a_100020667443_100000750983 [1,1,0,0,0,0|2,0,0]=4 5187 B14R1.376 COc1cc(cc(c1)SCC(=O)[O-])O 62a_100020667443_100010068927 [1,1,0,0,0,0|2,0,0]=4 5188 B14R1.376 COc1cc(cc(n1)Cl)CNC(=O)C 11a_100009841630_100015343762 [1,1,0,0,0,0|2,0,0]=4 5189 B14R1.376 COc1cc(cc(n1)Cl)CNC(=O)C 1626a_100009841630_100015343762 [1,1,0,0,0,0|2,0,0]=4 5190 B14R1.376 COc1cc(cc(n1)Cl)CNC(=O)C 240690a_100009841630_100015343762 [1,1,0,0,0,0|2,0,0]=4 5191 B14R1.376 COc1cc(cc(n1)Cl)CNC(=O)C 527a_100009841630_100103153847 [1,1,0,0,0,0|2,0,0]=4 5192 B14R1.468 C=C(C)CNc1cccc(c1)COC 2230a_100000737370_100000748629 [1,1,0,0,0,0|2,0,0]=4 5193 B14R1.468 C=C(C)CNc1cccc(c1)COC 34a_100000737370_100000748629 [1,1,0,0,0,0|2,0,0]=4 5194 B14R1.468 C=C(C)CNc1cccc(c1)OCC 2230a_100000742568_100000748629 [1,1,0,0,0,0|2,0,0]=4 5195 B14R1.468 C=C(C)CNc1cccc(c1)OCC 34a_100000742568_100000748629 [1,1,0,0,0,0|2,0,0]=4 5196 B14R1.468 C=C(C)COc1cccc(c1)COC 34a_200011232702_200000210301 [1,1,0,0,0,0|2,0,0]=4 5197 B14R1.468 C=C(C)COc1cccc(c1)COC 7a_200011232702_200000210301 [1,1,0,0,0,0|2,0,0]=4 5198 B14R1.468 C=C(C)COc1cccc(c1)CO[13CH3] 34a_200011232702_200025704644 [1,1,0,0,0,0|2,0,0]=4 5199 B14R1.468 C=C(C)COc1cccc(c1)CO[13CH3] 7a_200011232702_200025704644 [1,1,0,0,0,0|2,0,0]=4 5200 B14R1.468 C=C(C)COc1cccc(c1)OCC 34a_100011215941_100000748629 [1,1,0,0,0,0|2,0,0]=4 5201 B14R1.468 C=C(C)COc1cccc(c1)OCC 7a_100011215941_100000748629 [1,1,0,0,0,0|2,0,0]=4 5202 B14R1.468 C=C(C)CSc1cccc(c1)COC 62a_100000748629_100011493687 [1,1,0,0,0,0|2,0,0]=4 5203 B14R1.468 C=C(C)CSc1cccc(c1)COC 62a_100011493687_100000211660 [1,1,0,0,0,0|2,0,0]=4 5204 B14R1.468 C=C(C)CSc1cccc(c1)OCC 62a_100000748629_100000170002 [1,1,0,0,0,0|2,0,0]=4 5205 B14R1.468 C=C=Cc1cccc(c1)CCC(=O)C 271570a_100015277604_100011279149 [1,1,0,0,0,0|1,0,1]=4 5206 B14R1.468 CC(=O)CCc1cccc(c1)SCF 62a_100011279149_100015361967 [1,1,0,0,0,0|0,1,0]=3 5207 B14R1.468 CC(=O)CCc1cccc(c1)SCF 62a_100015361967_100011279149 [1,1,0,0,0,0|0,1,0]=3 5208 B14R1.468 CC(=O)NCc1cccc(c1)SCF 62a_100000766983_100015361967 [1,1,0,0,0,0|1,1,0]=4 5209 B14R1.468 CC(=O)NCc1cccc(c1)SCF 62a_100015361967_100000766983 [1,1,0,0,0,0|1,1,0]=4 5210 B14R1.468 CC=Cc1cccc(c1)CCC(=O)C 271570a_100016259895_100011279149 [1,1,0,0,0,0|1,0,0]=3 5211 B14R1.468 CC=Cc1cccc(c1)CCC(=O)N 271570a_100016259895_100000162029 [1,1,0,0,0,0|2,0,0]=4 5212 B14R1.468 CC=Cc1cccc(c1)CNC(=O)C 271570a_100016259895_100000766983 [1,1,0,0,0,0|2,0,0]=4 5213 B14R1.468 CCOc1cc(ccn1)CNC(=O)C 11a_100160572661_100015343762 [1,1,0,0,0,0|2,0,0]=4 5214 B14R1.468 CCOc1cc(ccn1)CNC(=O)C 1626a_100160572661_100015343762 [1,1,0,0,0,0|2,0,0]=4 5215 B14R1.468 CCOc1cc(ccn1)CNC(=O)C 240690a_100160572661_100015343762 [1,1,0,0,0,0|2,0,0]=4 5216 B14R1.468 CCOc1cc(ccn1)CNC(=O)C 527a_100160572661_100103153847 [1,1,0,0,0,0|2,0,0]=4 5217 B14R1.468 CCOc1cccc(c1)C=CC(=O)C 1458a_100011214976_200000210301 [1,1,0,0,0,0|0,0,2]=4 5218 B14R1.468 CCOc1cccc(c1)C=CC(=O)[13CH3] 1458a_100011214976_200025704644 [1,1,0,0,0,0|0,0,2]=4 5219 B14R1.468 CCOc1cccc(c1)CCC(=O)C 1458a_100011363991_200000210301 [1,1,0,0,0,0|0,0,0]=2 5220 B14R1.468 CCOc1cccc(c1)CCC(=O)[13CH3] 1458a_100011363991_200025704644 [1,1,0,0,0,0|0,0,0]=2 5221 B14R1.468 CCOc1cccc(c1)CNC(=O)C 11a_106359896916_100015343762 [1,1,0,0,0,0|1,0,0]=3 5222 B14R1.468 CCOc1cccc(c1)CNC(=O)C 1626a_106359896916_100015343762 [1,1,0,0,0,0|1,0,0]=3 5223 B14R1.468 CCOc1cccc(c1)CNC(=O)C 240690a_106359896916_100015343762 [1,1,0,0,0,0|1,0,0]=3 5224 B14R1.468 CCOc1cccc(c1)CNC(=O)C 527a_106359896916_100103153847 [1,1,0,0,0,0|1,0,0]=3 5225 B14R1.468 CCOc1cccc(c1)NCC(=O)N 2230a_100000742568_100000747473 [1,1,0,0,0,0|2,0,0]=4 5226 B14R1.468 CCOc1cccc(c1)NCC(=O)N 34a_100000742568_100000187820 [1,1,0,0,0,0|2,0,0]=4 5227 B14R1.468 CCOc1cccc(c1)NCC(=O)[O-] 34a_100000742568_100020667443 [1,1,0,0,0,0|2,0,0]=4 5228 B14R1.468 CCOc1cccc(c1)OCC(=O)N 34a_100011215941_100000187820 [1,1,0,0,0,0|2,0,0]=4 5229 B14R1.468 CCOc1cccc(c1)OCC(=O)N 7a_100011215941_100000187820 [1,1,0,0,0,0|2,0,0]=4 5230 B14R1.468 CCOc1cccc(c1)OCC(=O)[O-] 34a_100011215941_100020667443 [1,1,0,0,0,0|2,0,0]=4 5231 B14R1.468 CCOc1cccc(c1)SCC(=O)N 62a_100000747473_100000170002 [1,1,0,0,0,0|2,0,0]=4 5232 B14R1.468 CCOc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000170002 [1,1,0,0,0,0|2,0,0]=4 5233 B14R1.468 CCSc1cccc(c1)CCC(=O)C 62a_100000210202_100011279149 [1,1,0,0,0,0|0,1,0]=3 5234 B14R1.468 CCSc1cccc(c1)CCC(=O)C 62a_100011279149_100000210202 [1,1,0,0,0,0|0,1,0]=3 5235 B14R1.468 CCSc1cccc(c1)CCC(=O)N 62a_100000162029_100000210202 [1,1,0,0,0,0|1,1,0]=4 5236 B14R1.468 CCSc1cccc(c1)CCC(=O)N 62a_100000210202_100000162029 [1,1,0,0,0,0|1,1,0]=4 5237 B14R1.468 CCSc1cccc(c1)CNC(=O)C 62a_100000210202_100000766983 [1,1,0,0,0,0|1,1,0]=4 5238 B14R1.468 CCSc1cccc(c1)CNC(=O)C 62a_100000766983_100000210202 [1,1,0,0,0,0|1,1,0]=4 5239 B14R1.468 COCc1cccc(c1)NCC(=O)N 2230a_100000737370_100000747473 [1,1,0,0,0,0|2,0,0]=4 5240 B14R1.468 COCc1cccc(c1)NCC(=O)N 34a_100000737370_100000187820 [1,1,0,0,0,0|2,0,0]=4 5241 B14R1.468 COCc1cccc(c1)NCC(=O)[O-] 34a_100000737370_100020667443 [1,1,0,0,0,0|2,0,0]=4 5242 B14R1.468 COCc1cccc(c1)SCC(=O)N 62a_100000747473_100011493687 [1,1,0,0,0,0|2,0,0]=4 5243 B14R1.468 COCc1cccc(c1)SCC(=O)N 62a_100011493687_100000747473 [1,1,0,0,0,0|2,0,0]=4 5244 B14R1.468 COCc1cccc(c1)SCC(=O)[O-] 62a_100011493687_100020667443 [1,1,0,0,0,0|2,0,0]=4 5245 B14R1.468 COCc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011493687 [1,1,0,0,0,0|2,0,0]=4 5246 B14R1.468 NC(=O)CCc1cccc(c1)SCF 62a_100000162029_100015361967 [1,1,0,0,0,0|1,1,0]=4 5247 B14R1.468 NC(=O)CCc1cccc(c1)SCF 62a_100015361967_100000162029 [1,1,0,0,0,0|1,1,0]=4 5248 B14R1.2162 COc1cccc(c1)CNS(=O)(=O)C 40a_100000174954_100000738038 [1,1,0,0,0,0|2,0,0]=4 5249 B14R1.2335 C=C(C)CNc1cc(ccc1Br)OC 34a_100000748603_100000748629 [1,1,0,0,0,0|2,0,0]=4 5250 B14R1.2335 C=C(C)CNc1cc(ccc1C)OC 2230a_100000760359_100000748629 [1,1,0,0,0,0|2,0,0]=4 5251 B14R1.2335 C=C(C)CNc1cc(ccc1C)OC 34a_100000760359_100000748629 [1,1,0,0,0,0|2,0,0]=4 5252 B14R1.2335 C=C(C)CNc1cc(ccc1Cl)OC 34a_100000745576_100000748629 [1,1,0,0,0,0|2,0,0]=4 5253 B14R1.2335 C=C(C)CNc1cc(ccc1F)OC 34a_100000764331_100000748629 [1,1,0,0,0,0|2,0,0]=4 5254 B14R1.2335 C=C(C)CNc1cc(ccc1I)OC 34a_100000748021_100000748629 [1,1,0,0,0,0|2,0,0]=4 5255 B14R1.2335 C=C(C)CNc1cc(ccc1O)OC 34a_100000188146_100000748629 [1,1,0,0,0,0|2,0,0]=4 5256 B14R1.2335 C=C(C)COc1cc(ccc1Br)OC 34a_100000719091_100000748629 [1,1,0,0,0,0|2,0,0]=4 5257 B14R1.2335 C=C(C)COc1cc(ccc1Br)OC 7a_100000719091_100000748629 [1,1,0,0,0,0|2,0,0]=4 5258 B14R1.2335 C=C(C)COc1cc(ccc1C)OC 34a_100012179981_100000748629 [1,1,0,0,0,0|2,0,0]=4 5259 B14R1.2335 C=C(C)COc1cc(ccc1C)OC 7a_100012179981_100000748629 [1,1,0,0,0,0|2,0,0]=4 5260 B14R1.2335 C=C(C)COc1cc(ccc1Cl)OC 34a_100011516019_100000748629 [1,1,0,0,0,0|2,0,0]=4 5261 B14R1.2335 C=C(C)COc1cc(ccc1Cl)OC 7a_100011516019_100000748629 [1,1,0,0,0,0|2,0,0]=4 5262 B14R1.2335 C=C(C)COc1cc(ccc1F)OC 34a_100012178750_100000748629 [1,1,0,0,0,0|2,0,0]=4 5263 B14R1.2335 C=C(C)COc1cc(ccc1F)OC 7a_100012178750_100000748629 [1,1,0,0,0,0|2,0,0]=4 5264 B14R1.2335 C=C(C)COc1cc(ccc1I)OC 34a_100010168831_100000748629 [1,1,0,0,0,0|2,0,0]=4 5265 B14R1.2335 C=C(C)COc1cc(ccc1I)OC 7a_100010168831_100000748629 [1,1,0,0,0,0|2,0,0]=4 5266 B14R1.2335 C=C(C)COc1cc(ccc1N)OC 34a_100016989039_100000748629 [1,1,0,0,0,0|2,0,0]=4 5267 B14R1.2335 C=C(C)COc1cc(ccc1N)OC 7a_100016989039_100000748629 [1,1,0,0,0,0|2,0,0]=4 5268 B14R1.2335 C=C(C)CSc1cc(ccc1Br)OC 62a_100000748629_100009992028 [1,1,0,0,0,0|2,0,0]=4 5269 B14R1.2335 C=C(C)CSc1cc(ccc1Br)OC 62a_100009992028_100000211660 [1,1,0,0,0,0|2,0,0]=4 5270 B14R1.2335 C=C(C)CSc1cc(ccc1C)OC 62a_100000748629_100012349166 [1,1,0,0,0,0|2,0,0]=4 5271 B14R1.2335 C=C(C)CSc1cc(ccc1C)OC 62a_100012349166_100000211660 [1,1,0,0,0,0|2,0,0]=4 5272 B14R1.2335 C=C(C)CSc1cc(ccc1Cl)OC 62a_100000748629_100011356938 [1,1,0,0,0,0|2,0,0]=4 5273 B14R1.2335 C=C(C)CSc1cc(ccc1Cl)OC 62a_100011356938_100000211660 [1,1,0,0,0,0|2,0,0]=4 5274 B14R1.2335 C=C(C)CSc1cc(ccc1F)OC 62a_100000699733_100000211660 [1,1,0,0,0,0|2,0,0]=4 5275 B14R1.2335 C=C(C)CSc1cc(ccc1F)OC 62a_100000748629_100000699733 [1,1,0,0,0,0|2,0,0]=4 5276 B14R1.2335 C=C(C)CSc1cc(ccc1N)OC 62a_100000748629_100015195136 [1,1,0,0,0,0|2,0,0]=4 5277 B14R1.2335 C=C(C)CSc1cc(ccc1N)OC 62a_100015195136_100000211660 [1,1,0,0,0,0|2,0,0]=4 5278 B14R1.2335 C=C(C)CSc1cc(ccc1O)OC 62a_100000748629_100000685887 [1,1,0,0,0,0|2,0,0]=4 5279 B14R1.2335 COc1ccc(c(c1)CCC(=O)C)Br 1458a_200012259420_200000210301 [1,1,0,0,0,0|0,0,0]=2 5280 B14R1.2335 COc1ccc(c(c1)CCC(=O)[13CH3])Br 1458a_200012259420_200025704644 [1,1,0,0,0,0|0,0,0]=2 5281 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 11a_100000741592_100015343762 [1,1,0,0,0,0|1,0,0]=3 5282 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 1626a_100000741592_100015343762 [1,1,0,0,0,0|1,0,0]=3 5283 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 240690a_100000741592_100015343762 [1,1,0,0,0,0|1,0,0]=3 5284 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)Br 527a_100000741592_100103153847 [1,1,0,0,0,0|1,0,0]=3 5285 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 11a_100012180165_100015343762 [1,1,0,0,0,0|1,0,0]=3 5286 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 1626a_100012180165_100015343762 [1,1,0,0,0,0|1,0,0]=3 5287 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 240690a_100012180165_100015343762 [1,1,0,0,0,0|1,0,0]=3 5288 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)C 527a_100012180165_100103153847 [1,1,0,0,0,0|1,0,0]=3 5289 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 11a_100016995475_100015343762 [1,1,0,0,0,0|1,0,0]=3 5290 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 1626a_100016995475_100015343762 [1,1,0,0,0,0|1,0,0]=3 5291 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 240690a_100016995475_100015343762 [1,1,0,0,0,0|1,0,0]=3 5292 B14R1.2335 COc1ccc(c(c1)CNC(=O)C)F 527a_100016995475_100103153847 [1,1,0,0,0,0|1,0,0]=3 5293 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)Br 34a_100000748603_100000187820 [1,1,0,0,0,0|2,0,0]=4 5294 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)C 2230a_100000760359_100000747473 [1,1,0,0,0,0|2,0,0]=4 5295 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)C 34a_100000760359_100000187820 [1,1,0,0,0,0|2,0,0]=4 5296 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)Cl 34a_100000745576_100000187820 [1,1,0,0,0,0|2,0,0]=4 5297 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)F 34a_100000764331_100000187820 [1,1,0,0,0,0|2,0,0]=4 5298 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)I 34a_100000748021_100000187820 [1,1,0,0,0,0|2,0,0]=4 5299 B14R1.2335 COc1ccc(c(c1)NCC(=O)N)O 34a_100000188146_100000187820 [1,1,0,0,0,0|2,0,0]=4 5300 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])Br 34a_100000748603_100020667443 [1,1,0,0,0,0|2,0,0]=4 5301 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])C 34a_100000760359_100020667443 [1,1,0,0,0,0|2,0,0]=4 5302 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])Cl 34a_100000745576_100020667443 [1,1,0,0,0,0|2,0,0]=4 5303 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])F 34a_100000764331_100020667443 [1,1,0,0,0,0|2,0,0]=4 5304 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])I 34a_100000748021_100020667443 [1,1,0,0,0,0|2,0,0]=4 5305 B14R1.2335 COc1ccc(c(c1)NCC(=O)[O-])O 34a_100000188146_100020667443 [1,1,0,0,0,0|2,0,0]=4 5306 B14R1.2335 COc1ccc(c(c1)NNC(=O)C)Cl 22a_200000763216_100000070787 [1,1,0,0,0,0|2,0,0]=4 5307 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)Br 34a_100000719091_100000187820 [1,1,0,0,0,0|2,0,0]=4 5308 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)Br 7a_100000719091_100000187820 [1,1,0,0,0,0|2,0,0]=4 5309 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)C 34a_100012179981_100000187820 [1,1,0,0,0,0|2,0,0]=4 5310 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)C 7a_100012179981_100000187820 [1,1,0,0,0,0|2,0,0]=4 5311 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)Cl 34a_100011516019_100000187820 [1,1,0,0,0,0|2,0,0]=4 5312 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)Cl 7a_100011516019_100000187820 [1,1,0,0,0,0|2,0,0]=4 5313 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)F 34a_100012178750_100000187820 [1,1,0,0,0,0|2,0,0]=4 5314 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)F 7a_100012178750_100000187820 [1,1,0,0,0,0|2,0,0]=4 5315 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)I 34a_100010168831_100000187820 [1,1,0,0,0,0|2,0,0]=4 5316 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)I 7a_100010168831_100000187820 [1,1,0,0,0,0|2,0,0]=4 5317 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)N 34a_100016989039_100000187820 [1,1,0,0,0,0|2,0,0]=4 5318 B14R1.2335 COc1ccc(c(c1)OCC(=O)N)N 7a_100016989039_100000187820 [1,1,0,0,0,0|2,0,0]=4 5319 B14R1.2335 COc1ccc(c(c1)OCC(=O)[O-])Br 34a_100000719091_100020667443 [1,1,0,0,0,0|2,0,0]=4 5320 B14R1.2335 COc1ccc(c(c1)OCC(=O)[O-])C 34a_100012179981_100020667443 [1,1,0,0,0,0|2,0,0]=4 5321 B14R1.2335 COc1ccc(c(c1)OCC(=O)[O-])Cl 34a_100011516019_100020667443 [1,1,0,0,0,0|2,0,0]=4 5322 B14R1.2335 COc1ccc(c(c1)OCC(=O)[O-])F 34a_100012178750_100020667443 [1,1,0,0,0,0|2,0,0]=4 5323 B14R1.2335 COc1ccc(c(c1)OCC(=O)[O-])I 34a_100010168831_100020667443 [1,1,0,0,0,0|2,0,0]=4 5324 B14R1.2335 COc1ccc(c(c1)OCC(=O)[O-])N 34a_100016989039_100020667443 [1,1,0,0,0,0|2,0,0]=4 5325 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)Br 62a_100000747473_100009992028 [1,1,0,0,0,0|2,0,0]=4 5326 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)Br 62a_100009992028_100000747473 [1,1,0,0,0,0|2,0,0]=4 5327 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)C 62a_100000747473_100012349166 [1,1,0,0,0,0|2,0,0]=4 5328 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)C 62a_100012349166_100000747473 [1,1,0,0,0,0|2,0,0]=4 5329 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)Cl 62a_100000747473_100011356938 [1,1,0,0,0,0|2,0,0]=4 5330 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)Cl 62a_100011356938_100000747473 [1,1,0,0,0,0|2,0,0]=4 5331 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)F 62a_100000699733_100000747473 [1,1,0,0,0,0|2,0,0]=4 5332 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)F 62a_100000747473_100000699733 [1,1,0,0,0,0|2,0,0]=4 5333 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)N 62a_100000747473_100015195136 [1,1,0,0,0,0|2,0,0]=4 5334 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)N 62a_100015195136_100000747473 [1,1,0,0,0,0|2,0,0]=4 5335 B14R1.2335 COc1ccc(c(c1)SCC(=O)N)O 62a_100000747473_100000685887 [1,1,0,0,0,0|2,0,0]=4 5336 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])Br 62a_100009992028_100020667443 [1,1,0,0,0,0|2,0,0]=4 5337 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])Br 62a_100020667443_100009992028 [1,1,0,0,0,0|2,0,0]=4 5338 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])C 62a_100012349166_100020667443 [1,1,0,0,0,0|2,0,0]=4 5339 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])C 62a_100020667443_100012349166 [1,1,0,0,0,0|2,0,0]=4 5340 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])Cl 62a_100011356938_100020667443 [1,1,0,0,0,0|2,0,0]=4 5341 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])Cl 62a_100020667443_100011356938 [1,1,0,0,0,0|2,0,0]=4 5342 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])F 62a_100000699733_100020667443 [1,1,0,0,0,0|2,0,0]=4 5343 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])F 62a_100020667443_100000699733 [1,1,0,0,0,0|2,0,0]=4 5344 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])N 62a_100015195136_100020667443 [1,1,0,0,0,0|2,0,0]=4 5345 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])N 62a_100020667443_100015195136 [1,1,0,0,0,0|2,0,0]=4 5346 B14R1.2335 COc1ccc(c(c1)SCC(=O)[O-])O 62a_100020667443_100000685887 [1,1,0,0,0,0|2,0,0]=4 5347 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 11a_100011639525_100015343762 [1,1,0,0,0,0|2,0,0]=4 5348 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 1626a_100011639525_100015343762 [1,1,0,0,0,0|2,0,0]=4 5349 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 240690a_100011639525_100015343762 [1,1,0,0,0,0|2,0,0]=4 5350 B14R1.2335 COc1ccc(c(n1)CNC(=O)C)Cl 527a_100011639525_100103153847 [1,1,0,0,0,0|2,0,0]=4 5351 B14R1.6355 C=C(C)c1cccc(c1)CCC(=O)C 271570a_100000694244_100011279149 [1,1,0,0,0,0|1,0,0]=3 5352 B14R1.6355 C=C(C)c1cccc(c1)CCC(=O)N 271570a_100000694244_100000162029 [1,1,0,0,0,0|2,0,0]=4 5353 B14R1.6355 C=C(C)c1cccc(c1)CNC(=O)C 271570a_100000694244_100000766983 [1,1,0,0,0,0|2,0,0]=4 5354 B14R1.6355 CC(=O)CCc1cccc(c1)[N+](=O)[O-] 1458a_100000070787_100011935270 [1,1,0,0,0,0|2,0,0]=4 5355 B14R1.6355 CC(=O)CCc1cccc(c1)[N+](=O)[O-] 1458a_100000686648_200000210301 [1,1,0,0,0,0|2,0,0]=4 5356 B14R1.6355 CC(=O)COc1cccc(c1)C(C)C 1458a_100000246071_200000210301 [1,1,0,0,0,0|2,0,0]=4 5357 B14R1.6355 CC(=O)COc1cccc(c1)N(C)C 1458a_100011431806_200000210301 [1,1,0,0,0,0|2,0,0]=4 5358 B14R1.6355 CC(=O)NCc1cccc(c1)N(C)C 11a_100000238546_100015343762 [1,1,0,0,0,0|2,0,0]=4 5359 B14R1.6355 CC(=O)NCc1cccc(c1)N(C)C 1626a_100000238546_100015343762 [1,1,0,0,0,0|2,0,0]=4 5360 B14R1.6355 CC(=O)NCc1cccc(c1)N(C)C 240690a_100000238546_100015343762 [1,1,0,0,0,0|2,0,0]=4 5361 B14R1.6355 CC(=O)NCc1cccc(c1)N(C)C 527a_100000238546_100103153847 [1,1,0,0,0,0|2,0,0]=4 5362 B14R1.6355 CC(C)c1cccc(c1)OCC(=O)[13CH3] 1458a_100000246071_200025704644 [1,1,0,0,0,0|2,0,0]=4 5363 B14R1.6355 CN(C)c1cccc(c1)OCC(=O)[13CH3] 1458a_100011431806_200025704644 [1,1,0,0,0,0|2,0,0]=4 5364 B14R1.6355 [13CH3]C(=O)CCc1cccc(c1)[N+](=O)[O-] 1458a_100000686648_200025704644 [1,1,0,0,0,0|2,0,0]=4 5365 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 11a_200012002703_100015343762 [0,1,0,0,1,0|2,0,0]=4 5366 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 1626a_200012002703_100015343762 [0,1,0,0,1,0|2,0,0]=4 5367 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 22a_200012002703_100000070787 [0,1,0,0,1,0|2,0,0]=4 5368 B14R1.41 COc1cc(ccc1F)N(C)C(=O)C 527a_200012002703_100103153847 [0,1,0,0,1,0|2,0,0]=4 5369 B14R1.41 COc1cc(ccc1O)C(=C(C)C)C 271570a_200000049429_100000694246 [0,1,0,0,1,0|1,0,1]=4 5370 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,1,0,0,1,0|0,0,0]=2 5371 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,1,0,0,1,0|0,0,0]=2 5372 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 11a_100010131419_100015343762 [0,1,0,0,1,0|2,0,0]=4 5373 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 1626a_100010131419_100015343762 [0,1,0,0,1,0|2,0,0]=4 5374 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 22a_100010131419_100000070787 [0,1,0,0,1,0|2,0,0]=4 5375 B14R1.343 COc1cc(cc(c1Cl)Br)NC(=O)C 527a_100010131419_100103153847 [0,1,0,0,1,0|2,0,0]=4 5376 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)C 1458a_100009814412_200000210301 [0,1,0,0,1,0|0,0,0]=2 5377 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)[13CH3] 1458a_100009814412_200025704644 [0,1,0,0,1,0|0,0,0]=2 5378 B14R1.439 C=C=Cc1cc(ccc1O)CC(=O)C 271570a_100015277604_100010141077 [0,1,0,0,1,0|1,0,1]=4 5379 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100010141077_100015361967 [0,1,0,0,1,0|0,1,0]=3 5380 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100015361967_100010141077 [0,1,0,0,1,0|0,1,0]=3 5381 B14R1.439 CC(=O)Nc1ccc(c(c1)OCF)Cl 34a_100011935283_100015361967 [0,1,0,0,1,0|2,0,0]=4 5382 B14R1.439 CC(=O)Nc1ccc(c(c1)OCF)Cl 7a_100011935283_100015361967 [0,1,0,0,1,0|2,0,0]=4 5383 B14R1.439 CC=Cc1cc(ccc1O)CC(=O)C 271570a_100016259895_100010141077 [0,1,0,0,1,0|1,0,0]=3 5384 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 11a_200016990551_100015343762 [0,1,0,0,1,0|2,0,0]=4 5385 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 1626a_200016990551_100015343762 [0,1,0,0,1,0|2,0,0]=4 5386 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 22a_200016990551_100000070787 [0,1,0,0,1,0|2,0,0]=4 5387 B14R1.439 CCOc1cc(ccc1Br)NC(=O)C 527a_200016990551_100103153847 [0,1,0,0,1,0|2,0,0]=4 5388 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 11a_100011964961_100015343762 [0,1,0,0,1,0|2,0,0]=4 5389 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 1626a_100011964961_100015343762 [0,1,0,0,1,0|2,0,0]=4 5390 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 22a_100011964961_100000070787 [0,1,0,0,1,0|2,0,0]=4 5391 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 34a_100011935283_100000210202 [0,1,0,0,1,0|2,0,0]=4 5392 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 527a_100011964961_100103153847 [0,1,0,0,1,0|2,0,0]=4 5393 B14R1.439 CCOc1cc(ccc1Cl)NC(=O)C 7a_100011935283_100000210202 [0,1,0,0,1,0|2,0,0]=4 5394 B14R1.439 CCOc1cc(ccc1O)CC(=O)C 1458a_200000048972_200000210301 [0,1,0,0,1,0|0,0,0]=2 5395 B14R1.439 CCOc1cc(ccc1O)CC(=O)[13CH3] 1458a_200000048972_200025704644 [0,1,0,0,1,0|0,0,0]=2 5396 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100000210202_100010141077 [0,1,0,0,1,0|0,1,0]=3 5397 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100010141077_100000210202 [0,1,0,0,1,0|0,1,0]=3 5398 B14R1.705 C=C(C)c1cc(ccc1O)CC(=O)C 271570a_100000694244_100010141077 [0,1,0,0,1,0|1,0,0]=3 5399 B14R1.705 CC(=O)Cc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000039415_200000210301 [0,1,0,0,1,0|2,0,0]=4 5400 B14R1.705 CC(=O)Cc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000070787_100010149780 [0,1,0,0,1,0|2,0,0]=4 5401 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)C)O 1458a_100000743812_200000210301 [0,1,0,0,1,0|2,0,0]=4 5402 B14R1.705 CC(=O)Nc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000743812_200025704644 [0,1,0,0,1,0|2,0,0]=4 5403 B14R1.705 [13CH3]C(=O)Cc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000039415_200025704644 [0,1,0,0,1,0|2,0,0]=4 5404 B14R1.881 CC(=O)Nc1cc(c(cc1Cl)Cl)O[13CH3] 34a_200000039401_200025704644 [0,1,0,0,1,0|2,0,0]=4 5405 B14R1.881 CC(=O)Nc1cc(c(cc1Cl)Cl)O[13CH3] 7a_200000039401_200025704644 [0,1,0,0,1,0|2,0,0]=4 5406 B14R1.881 COc1cc(c(cc1Br)Br)NC(=O)C 11a_100000718616_100015343762 [0,1,0,0,1,0|2,0,0]=4 5407 B14R1.881 COc1cc(c(cc1Br)Br)NC(=O)C 1626a_100000718616_100015343762 [0,1,0,0,1,0|2,0,0]=4 5408 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 11a_100010232211_100015343762 [0,1,0,0,1,0|2,0,0]=4 5409 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 1626a_100010232211_100015343762 [0,1,0,0,1,0|2,0,0]=4 5410 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 22a_100010232211_100000070787 [0,1,0,0,1,0|2,0,0]=4 5411 B14R1.881 COc1cc(c(cc1Br)C)NC(=O)C 527a_100010232211_100103153847 [0,1,0,0,1,0|2,0,0]=4 5412 B14R1.881 COc1cc(c(cc1Br)Cl)NC(=O)C 11a_100012361290_100015343762 [0,1,0,0,1,0|2,0,0]=4 5413 B14R1.881 COc1cc(c(cc1Br)Cl)NC(=O)C 1626a_100012361290_100015343762 [0,1,0,0,1,0|2,0,0]=4 5414 B14R1.881 COc1cc(c(cc1C)Br)NC(=O)C 11a_100010244135_100015343762 [0,1,0,0,1,0|2,0,0]=4 5415 B14R1.881 COc1cc(c(cc1C)Br)NC(=O)C 1626a_100010244135_100015343762 [0,1,0,0,1,0|2,0,0]=4 5416 B14R1.881 COc1cc(c(cc1Cl)Br)NC(=O)C 11a_100013022580_100015343762 [0,1,0,0,1,0|2,0,0]=4 5417 B14R1.881 COc1cc(c(cc1Cl)Br)NC(=O)C 1626a_100013022580_100015343762 [0,1,0,0,1,0|2,0,0]=4 5418 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 11a_100009858536_100015343762 [0,1,0,0,1,0|2,0,0]=4 5419 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 1626a_100009858536_100015343762 [0,1,0,0,1,0|2,0,0]=4 5420 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 22a_100009858536_100000070787 [0,1,0,0,1,0|2,0,0]=4 5421 B14R1.881 COc1cc(c(cc1Cl)C)NC(=O)C 527a_100009858536_100103153847 [0,1,0,0,1,0|2,0,0]=4 5422 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 11a_100011830341_100015343762 [0,1,0,0,1,0|2,0,0]=4 5423 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 1626a_100011830341_100015343762 [0,1,0,0,1,0|2,0,0]=4 5424 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 22a_100011830341_100000070787 [0,1,0,0,1,0|2,0,0]=4 5425 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 34a_200000039401_200000210301 [0,1,0,0,1,0|2,0,0]=4 5426 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(=O)C 7a_200000039401_200000210301 [0,1,0,0,1,0|2,0,0]=4 5427 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 11a_100009872666_100015343762 [0,1,0,0,1,0|2,0,0]=4 5428 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 1626a_100009872666_100015343762 [0,1,0,0,1,0|2,0,0]=4 5429 B14R1.881 COc1cc(c(cc1Cl)F)NC(=O)C 22a_100009872666_100000070787 [0,1,0,0,1,0|2,0,0]=4 5430 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C 11a_100010208193_100015343762 [0,1,0,0,1,0|2,0,0]=4 5431 B14R1.881 COc1cc(c(cc1F)Br)NC(=O)C 1626a_100010208193_100015343762 [0,1,0,0,1,0|2,0,0]=4 5432 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 11a_100009958774_100015343762 [0,1,0,0,1,0|2,0,0]=4 5433 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 1626a_100009958774_100015343762 [0,1,0,0,1,0|2,0,0]=4 5434 B14R1.881 COc1cc(c(cc1F)Cl)NC(=O)C 22a_100009958774_100000070787 [0,1,0,0,1,0|2,0,0]=4 5435 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)C 1458a_100009814189_200000210301 [0,1,0,0,1,0|0,0,0]=2 5436 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)[13CH3] 1458a_100009814189_200025704644 [0,1,0,0,1,0|0,0,0]=2 5437 B14R1.881 COc1cc(c(cc1O)F)C=C(C)C 271570a_100102525489_100010189133 [0,1,0,0,1,0|1,0,1]=4 5438 B14R1.3412 COc1cc(ccc1O)NS(=O)(=O)C 40a_100000726020_100000738038 [0,1,0,0,1,0|2,0,0]=4 5439 B14R1.3651 C=Cc1cc(ccc1OC)CC(=O)C 271570a_100011290941_100011493462 [0,1,0,0,1,0|1,0,1]=4 5440 B14R1.3651 CNc1cc(ccc1OC)NC(=O)C 34a_100000211725_200000210301 [0,1,0,0,1,0|2,0,0]=4 5441 B14R1.3651 COc1cc(ccc1C#N)NC(=O)C 11a_100011999456_100015343762 [0,1,0,0,1,0|2,0,0]=4 5442 B14R1.3651 COc1cc(ccc1C#N)NC(=O)C 1626a_100011999456_100015343762 [0,1,0,0,1,0|2,0,0]=4 5443 B14R1.3651 COc1cc(ccc1C#N)NC(=O)C 527a_100011999456_100103153847 [0,1,0,0,1,0|2,0,0]=4 5444 B14R1.3651 COc1cc(ccc1CO)C=C(C)C 271570a_100102525489_100011277633 [0,1,0,0,1,0|1,0,1]=4 5445 B14R1.3651 COc1cc(ccc1CO)NC(=O)C 22a_100012183141_100000070787 [0,1,0,0,1,0|1,0,0]=3 5446 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [0,1,0,0,1,0|0,0,0]=2 5447 B14R1.3651 COc1ccc(cc1N[13CH3])NC(=O)C 34a_100000211725_200025704644 [0,1,0,0,1,0|2,0,0]=4 5448 B14R1.3651 COc1ccc(cc1OC)C=C(C)C 271570a_100102525489_100000187503 [0,1,0,0,1,0|1,0,1]=4 5449 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [0,1,0,0,1,0|0,0,0]=2 5450 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [0,1,0,0,1,0|0,0,0]=2 5451 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [0,1,0,0,1,0|0,0,0]=2 5452 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100000180827_200000210301 [0,1,0,0,1,0|2,0,0]=4 5453 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100102631434_100011233839 [0,1,0,0,1,0|2,0,0]=4 5454 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100000180827_200000210301 [0,1,0,0,1,0|2,0,0]=4 5455 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100102631434_100011233839 [0,1,0,0,1,0|2,0,0]=4 5456 B14R1.3651 COc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000170513 [0,1,0,0,1,0|2,0,0]=4 5457 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 2230a_100000180827_200025704644 [0,1,0,0,1,0|2,0,0]=4 5458 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 269982a_100000180827_200025704644 [0,1,0,0,1,0|2,0,0]=4 5459 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 11a_100000187404_100015343762 [0,1,0,0,1,0|1,0,0]=3 5460 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 1626a_100000187404_100015343762 [0,1,0,0,1,0|1,0,0]=3 5461 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 22a_100000187404_100000070787 [0,1,0,0,1,0|1,0,0]=3 5462 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 527a_100000187404_100103153847 [0,1,0,0,1,0|1,0,0]=3 5463 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_100011493462_200000210301 [0,1,0,0,1,0|0,1,0]=3 5464 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_200000210301_100011493462 [0,1,0,0,1,0|0,1,0]=3 5465 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_100011493462_200025704644 [0,1,0,0,1,0|0,1,0]=3 5466 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_200025704644_100011493462 [0,1,0,0,1,0|0,1,0]=3 5467 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)Cl 1458a_100000070787_100010116237 [0,1,0,0,1,0|1,0,0]=3 5468 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)F 1458a_100000070787_100009814548 [0,1,0,0,1,0|1,0,0]=3 5469 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 11a_100137314619_100015343762 [0,1,0,0,1,0|2,0,0]=4 5470 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 1626a_100137314619_100015343762 [0,1,0,0,1,0|2,0,0]=4 5471 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 22a_100137314619_100000070787 [0,1,0,0,1,0|2,0,0]=4 5472 B14R1.4106 COc1c(ccc(c1F)NC(=O)C)F 527a_100137314619_100103153847 [0,1,0,0,1,0|2,0,0]=4 5473 B14R1.4106 COc1c(cnc(c1C)CC(=O)C)C 1458a_100000070787_100000737168 [0,1,0,0,1,0|2,0,0]=4 5474 B16R1.406 C=C(C)CCNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000730704 [0,1,0,0,0,1|2,0,0]=4 5475 B16R1.406 C=C(C)CCNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000730704 [0,1,0,0,0,1|2,0,0]=4 5476 B16R1.406 C=C(C)CCNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000730704 [0,1,0,0,0,1|2,0,0]=4 5477 B16R1.406 C=C(C)CCSc1cc(c(c(c1)CC)O)C 62a_100000730704_100010659108 [0,1,0,0,0,1|2,0,0]=4 5478 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)F)C 62a_100000730704_100010271686 [0,1,0,0,0,1|2,0,0]=4 5479 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000730704 [0,1,0,0,0,1|2,0,0]=4 5480 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)F)F 62a_100000730704_100011218012 [0,1,0,0,0,1|2,0,0]=4 5481 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000730704 [0,1,0,0,0,1|2,0,0]=4 5482 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)F)O 62a_100000730704_200015524394 [0,1,0,0,0,1|2,0,0]=4 5483 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000730704 [0,1,0,0,0,1|2,0,0]=4 5484 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)N)C 62a_100000730704_100000741850 [0,1,0,0,0,1|2,0,0]=4 5485 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000730704 [0,1,0,0,0,1|2,0,0]=4 5486 B16R1.406 C=C(C)CCSc1cc(c(c(c1)OC)O)O 62a_100000730704_200159242197 [0,1,0,0,0,1|1,0,0]=3 5487 B16R1.406 CC(=O)CCSc1cc(c(c(c1)C#N)O)C 62a_100000053229_100010195408 [0,1,0,0,0,1|2,0,0]=4 5488 B16R1.406 CC(=O)CCSc1cc(c(c(c1)C=O)O)C 62a_100000053229_100000696164 [0,1,0,0,0,1|2,0,0]=4 5489 B16R1.406 CC(=O)CCSc1cc(c(c(c1)C=O)O)F 62a_100000053229_100011217654 [0,1,0,0,0,1|2,0,0]=4 5490 B16R1.406 CC(=O)CCSc1cc(c(c(c1)C=O)O)F 62a_100011217654_100000053229 [0,1,0,0,0,1|2,0,0]=4 5491 B16R1.406 CC(=O)CCSc1cc(c(c(c1)C=O)O)O 62a_100000053229_100010235811 [0,1,0,0,0,1|2,0,0]=4 5492 B16R1.406 CCc1cc(cc(c1N)C)SCCC(=O)C 62a_100000053229_200000186424 [0,1,0,0,0,1|2,0,0]=4 5493 B16R1.406 CCc1cc(cc(c1N)C)SCCC(=O)C 62a_200000186424_100000053229 [0,1,0,0,0,1|2,0,0]=4 5494 B16R1.406 CCc1cc(cc(c1O)C)SCCC(=O)C 62a_100000053229_100010659108 [0,1,0,0,0,1|1,0,0]=3 5495 B16R1.406 CCc1cc(cc(c1O)C)SCCC(=O)N 62a_100000744528_100010659108 [0,1,0,0,0,1|2,0,0]=4 5496 B16R1.406 CCc1cc(cc(c1O)C)SCOC(=O)C 62a_100000076356_100010659108 [0,1,0,0,0,1|2,0,0]=4 5497 B16R1.406 COc1cc(cc(c1Cl)Br)NCCC(=O)C 7a_100010131419_100000053229 [0,1,0,0,0,1|1,0,0]=3 5498 B16R1.406 COc1cc(cc(c1Cl)Br)NCCC(=O)N 2230a_100010131419_100000744528 [0,1,0,0,0,1|2,0,0]=4 5499 B16R1.406 COc1cc(cc(c1Cl)Br)NCCC(=O)N 34a_100010131419_100000731001 [0,1,0,0,0,1|2,0,0]=4 5500 B16R1.406 COc1cc(cc(c1Cl)Br)NCCC(=O)N 7a_100010131419_100000744528 [0,1,0,0,0,1|2,0,0]=4 5501 B16R1.406 COc1cc(cc(c1Cl)Br)NCOC(=O)C 34a_100010131419_100009813279 [0,1,0,0,0,1|2,0,0]=4 5502 B16R1.406 COc1cc(cc(c1F)C)SCCC(=O)C 62a_100000053229_100010271686 [0,1,0,0,0,1|1,0,0]=3 5503 B16R1.406 COc1cc(cc(c1F)C)SCCC(=O)C 62a_100010271686_100000053229 [0,1,0,0,0,1|1,0,0]=3 5504 B16R1.406 COc1cc(cc(c1F)C)SCCC(=O)N 62a_100000744528_100010271686 [0,1,0,0,0,1|2,0,0]=4 5505 B16R1.406 COc1cc(cc(c1F)C)SCCC(=O)N 62a_100010271686_100000744528 [0,1,0,0,0,1|2,0,0]=4 5506 B16R1.406 COc1cc(cc(c1F)C)SCOC(=O)C 62a_100000076356_100010271686 [0,1,0,0,0,1|2,0,0]=4 5507 B16R1.406 COc1cc(cc(c1F)C)SCOC(=O)C 62a_100010271686_100000076356 [0,1,0,0,0,1|2,0,0]=4 5508 B16R1.406 COc1cc(cc(c1F)F)SCCC(=O)C 62a_100000053229_100011218012 [0,1,0,0,0,1|1,0,0]=3 5509 B16R1.406 COc1cc(cc(c1F)F)SCCC(=O)C 62a_100011218012_100000053229 [0,1,0,0,0,1|1,0,0]=3 5510 B16R1.406 COc1cc(cc(c1F)F)SCCC(=O)N 62a_100000744528_100011218012 [0,1,0,0,0,1|2,0,0]=4 5511 B16R1.406 COc1cc(cc(c1F)F)SCCC(=O)N 62a_100011218012_100000744528 [0,1,0,0,0,1|2,0,0]=4 5512 B16R1.406 COc1cc(cc(c1F)F)SCOC(=O)C 62a_100000076356_100011218012 [0,1,0,0,0,1|2,0,0]=4 5513 B16R1.406 COc1cc(cc(c1F)F)SCOC(=O)C 62a_100011218012_100000076356 [0,1,0,0,0,1|2,0,0]=4 5514 B16R1.406 COc1cc(cc(c1F)O)SCCC(=O)C 62a_100000053229_200015524394 [0,1,0,0,0,1|1,0,0]=3 5515 B16R1.406 COc1cc(cc(c1F)O)SCCC(=O)C 62a_200015524394_100000053229 [0,1,0,0,0,1|1,0,0]=3 5516 B16R1.406 COc1cc(cc(c1F)O)SCCC(=O)N 62a_100000744528_200015524394 [0,1,0,0,0,1|2,0,0]=4 5517 B16R1.406 COc1cc(cc(c1F)O)SCCC(=O)N 62a_200015524394_100000744528 [0,1,0,0,0,1|2,0,0]=4 5518 B16R1.406 COc1cc(cc(c1F)O)SCOC(=O)C 62a_100000076356_200015524394 [0,1,0,0,0,1|2,0,0]=4 5519 B16R1.406 COc1cc(cc(c1F)O)SCOC(=O)C 62a_200015524394_100000076356 [0,1,0,0,0,1|2,0,0]=4 5520 B16R1.406 COc1cc(cc(c1N)C)SCCC(=O)C 62a_100000053229_100000741850 [0,1,0,0,0,1|1,0,0]=3 5521 B16R1.406 COc1cc(cc(c1N)C)SCCC(=O)C 62a_100000741850_100000053229 [0,1,0,0,0,1|1,0,0]=3 5522 B16R1.406 COc1cc(cc(c1N)C)SCCC(=O)N 62a_100000741850_100000744528 [0,1,0,0,0,1|2,0,0]=4 5523 B16R1.406 COc1cc(cc(c1N)C)SCCC(=O)N 62a_100000744528_100000741850 [0,1,0,0,0,1|2,0,0]=4 5524 B16R1.406 COc1cc(cc(c1N)C)SCOC(=O)C 62a_100000076356_100000741850 [0,1,0,0,0,1|2,0,0]=4 5525 B16R1.406 COc1cc(cc(c1N)C)SCOC(=O)C 62a_100000741850_100000076356 [0,1,0,0,0,1|2,0,0]=4 5526 B16R1.406 COc1cc(cc(c1O)Br)C=NNC(=O)C 4a_100000189765_100000186746 [0,1,0,0,0,1|1,0,1]=4 5527 B16R1.406 COc1cc(cc(c1O)C)C=NNC(=O)C 4a_100000189765_100000050991 [0,1,0,0,0,1|1,0,1]=4 5528 B16R1.406 COc1cc(cc(c1O)Cl)C=NNC(=O)C 4a_100000189765_100000010622 [0,1,0,0,0,1|1,0,1]=4 5529 B16R1.406 COc1cc(cc(c1O)F)C=NNC(=O)C 4a_100000189765_100000039941 [0,1,0,0,0,1|1,0,1]=4 5530 B16R1.406 COc1cc(cc(c1O)I)C=NNC(=O)C 4a_100000189765_100000184534 [0,1,0,0,0,1|1,0,1]=4 5531 B16R1.406 COc1cc(cc(c1O)O)C=NNC(=O)C 4a_100000189765_100000010769 [0,1,0,0,0,1|1,0,1]=4 5532 B16R1.406 COc1cc(cc(c1O)O)SCC=C(C)C 62a_100000761012_200159242197 [0,1,0,0,0,1|1,0,1]=4 5533 B16R1.406 COc1cc(cc(c1O)O)SCCC(=O)C 62a_100000053229_200159242197 [0,1,0,0,0,1|0,0,0]=2 5534 B16R1.406 COc1cc(cc(c1O)O)SCCC(=O)N 62a_100000744528_200159242197 [0,1,0,0,0,1|1,0,0]=3 5535 B16R1.406 COc1cc(cc(c1O)O)SCCC(C)C 62a_100000210312_200159242197 [0,1,0,0,0,1|1,0,1]=4 5536 B16R1.406 COc1cc(cc(c1O)O)SCCC(C)O 62a_100012276601_200159242197 [0,1,0,0,0,1|0,0,2]=4 5537 B16R1.406 COc1cc(cc(c1O)O)SCOC(=O)C 62a_100000076356_200159242197 [0,1,0,0,0,1|1,0,0]=3 5538 B16R1.1059 C=C(C)CCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000730704 [0,1,0,0,0,1|2,0,0]=4 5539 B16R1.1059 C=C(C)CCSc1ccc(c(c1)C(C)C)O 62a_100000730704_100000691460 [0,1,0,0,0,1|2,0,0]=4 5540 B16R1.1059 CC(=O)CCOc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_100000053229 [0,1,0,0,0,1|2,0,0]=4 5541 B16R1.1059 CC(=O)CCOc1ccc(c(c1)C(=O)C)F 7a_100000091700_100000053229 [0,1,0,0,0,1|2,0,0]=4 5542 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000053229 [0,1,0,0,0,1|2,0,0]=4 5543 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000053229 [0,1,0,0,0,1|2,0,0]=4 5544 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(=O)C)F 62a_100000053229_100010254839 [0,1,0,0,0,1|2,0,0]=4 5545 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000053229 [0,1,0,0,0,1|2,0,0]=4 5546 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000053229 [0,1,0,0,0,1|2,0,0]=4 5547 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000053229 [0,1,0,0,0,1|2,0,0]=4 5548 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)C)F 62a_100000053229_200053017515 [0,1,0,0,0,1|2,0,0]=4 5549 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)C)F 62a_200053017515_100000053229 [0,1,0,0,0,1|2,0,0]=4 5550 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)C)N 62a_100000053229_100000694223 [0,1,0,0,0,1|2,0,0]=4 5551 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)C)N 62a_100000694223_100000053229 [0,1,0,0,0,1|2,0,0]=4 5552 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)C)O 62a_100000053229_100000691460 [0,1,0,0,0,1|1,0,0]=3 5553 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000053229 [0,1,0,0,0,1|1,0,0]=3 5554 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)O)F 62a_100000053229_100011943926 [0,1,0,0,0,1|2,0,0]=4 5555 B16R1.1059 CC(=O)CCSc1ccc(c(c1)C(C)O)F 62a_100011943926_100000053229 [0,1,0,0,0,1|2,0,0]=4 5556 B16R1.1059 CC(=O)CCSc1ccc(c(c1)N(C)C)F 62a_100000053229_100010288836 [0,1,0,0,0,1|2,0,0]=4 5557 B16R1.1059 CC(=O)CCSc1ccc(c(c1)N(C)C)F 62a_100010288836_100000053229 [0,1,0,0,0,1|2,0,0]=4 5558 B16R1.1059 CC(=O)NCCc1ccc(c(c1)[N+](=O)[O-])O 240690a_100000075816_100015343762 [0,1,0,0,0,1|2,0,0]=4 5559 B16R1.1059 CC(=O)NCCc1ccc(c(c1)[N+](=O)[O-])O 527a_100000075816_100103153847 [0,1,0,0,0,1|2,0,0]=4 5560 B16R1.1059 CC(=O)OCSc1ccc(c(c1)C(C)C)O 62a_100000076356_100000691460 [0,1,0,0,0,1|2,0,0]=4 5561 B16R1.1059 CC(=O)OCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000076356 [0,1,0,0,0,1|2,0,0]=4 5562 B16R1.1059 CC(C)c1cc(ccc1O)SCCC(=O)N 62a_100000691460_100000744528 [0,1,0,0,0,1|2,0,0]=4 5563 B16R1.1059 CC(C)c1cc(ccc1O)SCCC(=O)N 62a_100000744528_100000691460 [0,1,0,0,0,1|2,0,0]=4 5564 B16R1.4275 C=C(C)CCNc1ccc(c(c1)OC)C#N 34a_100011999456_100000730704 [0,1,0,0,0,1|2,0,0]=4 5565 B16R1.4275 C=C(C)CCNc1ccc(c(c1)OC)CO 34a_100012183141_100000730704 [0,1,0,0,0,1|1,0,0]=3 5566 B16R1.4275 C=C(C)CCNc1ccc(c(c1)OC)OC 34a_100000187404_100000730704 [0,1,0,0,0,1|1,0,0]=3 5567 B16R1.4275 C=C(C)CCOc1ccc(c(c1)OC)CO 34a_200000116926_100000730704 [0,1,0,0,0,1|1,0,0]=3 5568 B16R1.4275 C=C(C)CCOc1ccc(c(c1)OC)OC 34a_100000039706_100000730704 [0,1,0,0,0,1|1,0,0]=3 5569 B16R1.4275 C=C(C)CCSc1cc(c(cn1)CO)OC 62a_100000730704_100010714672 [0,1,0,0,0,1|2,0,0]=4 5570 B16R1.4275 C=C(C)CCSc1cc(c(cn1)CO)OC 62a_100010714672_100000730704 [0,1,0,0,0,1|2,0,0]=4 5571 B16R1.4275 C=C(C)CCSc1ccc(c(c1)CC)OC 62a_100000730704_200010179862 [0,1,0,0,0,1|2,0,0]=4 5572 B16R1.4275 C=C(C)CCSc1ccc(c(c1)CC)OC 62a_200010179862_100000730704 [0,1,0,0,0,1|2,0,0]=4 5573 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)C#N 62a_100000730704_100000694671 [0,1,0,0,0,1|2,0,0]=4 5574 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)C=O 62a_100000697075_100000730704 [0,1,0,0,0,1|1,0,1]=4 5575 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)C=O 62a_100000730704_100010290300 [0,1,0,0,0,1|1,0,1]=4 5576 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)CC 62a_100000730704_200010710398 [0,1,0,0,0,1|2,0,0]=4 5577 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)CC 62a_200010710398_100000730704 [0,1,0,0,0,1|2,0,0]=4 5578 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)CO 62a_100000730704_100011277633 [0,1,0,0,0,1|1,0,0]=3 5579 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)CO 62a_100011277633_100000730704 [0,1,0,0,0,1|1,0,0]=3 5580 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)OC 62a_100000730704_100011356967 [0,1,0,0,0,1|1,0,0]=3 5581 B16R1.4275 C=C(C)CCSc1ccc(c(c1)OC)SC 62a_200011001119_100000730704 [0,1,0,0,0,1|1,1,0]=4 5582 B16R1.4275 C=C(C)CCSc1ccc(c(c1)SC)OC 62a_200009892704_100000730704 [0,1,0,0,0,1|1,1,0]=4 5583 B16R1.4275 C=C(C)CCSc1ccc(c(n1)OC)CO 62a_100000730704_100010988397 [0,1,0,0,0,1|2,0,0]=4 5584 B16R1.4275 C=C(C)CCSc1ccc(c(n1)OC)CO 62a_100010988397_100000730704 [0,1,0,0,0,1|2,0,0]=4 5585 B16R1.4275 C=C(C)CCSc1ccc(c(n1)OC)OC 62a_100000730704_100010214848 [0,1,0,0,0,1|2,0,0]=4 5586 B16R1.4275 C=C(C)CCSc1cnc(c(c1)OC)CO 62a_100000730704_200010246159 [0,1,0,0,0,1|2,0,0]=4 5587 B16R1.4275 C=C(C)CCSc1cnc(c(c1)OC)CO 62a_200010246159_100000730704 [0,1,0,0,0,1|2,0,0]=4 5588 B16R1.4275 C=C(C)CCSc1cnc(c(c1)OC)OC 62a_100000730704_100010234541 [0,1,0,0,0,1|2,0,0]=4 5589 B16R1.4275 C=C(C)CNCc1ccc(c(c1)OC)OC 34a_100000185555_100000748629 [0,1,0,0,0,1|1,0,0]=3 5590 B16R1.4275 C=C(C)COCc1ccc(c(c1)OC)OC 34a_100000210929_100000748629 [0,1,0,0,0,1|1,0,0]=3 5591 B16R1.4275 C=C(C)CSCc1ccc(c(c1)OC)OC 62a_100000748629_100011233839 [0,1,0,0,0,1|1,0,0]=3 5592 B16R1.4275 C=C(F)CNCc1ccc(c(c1)OC)OC 34a_100000185555_100009893438 [0,1,0,0,0,1|1,0,1]=4 5593 B16R1.4275 C=C(F)COCc1ccc(c(c1)OC)OC 34a_100000210929_100009893438 [0,1,0,0,0,1|1,0,1]=4 5594 B16R1.4275 C=C(F)CSCc1ccc(c(c1)OC)OC 62a_100000042424_100011233839 [0,1,0,0,0,1|1,0,1]=4 5595 B16R1.4275 CC(=O)CCSc1ccc(c(c1)CO)CO 62a_100000053229_100000719600 [0,1,0,0,0,1|2,0,0]=4 5596 B16R1.4275 CC(=O)CCSc1ccc(c(c1)CO)CO 62a_100000719600_100000053229 [0,1,0,0,0,1|2,0,0]=4 5597 B16R1.4275 CCc1cc(ccc1C=O)SCCC(=O)C 62a_100000053229_100010209654 [0,1,0,0,0,1|1,0,1]=4 5598 B16R1.4275 CCc1cc(ccc1C=O)SCCC(=O)C 62a_100010209654_100000053229 [0,1,0,0,0,1|1,0,1]=4 5599 B16R1.4275 CCc1cc(ccc1NN)SCCC(=O)C 62a_100000053229_100000700371 [0,1,0,0,0,1|2,0,0]=4 5600 B16R1.4275 CCc1cc(ccc1NN)SCCC(=O)C 62a_100000700371_100000053229 [0,1,0,0,0,1|2,0,0]=4 5601 B16R1.4275 CCc1cc(ccc1OC)SCCC(=O)C 62a_100000053229_200010179862 [0,1,0,0,0,1|1,0,0]=3 5602 B16R1.4275 CCc1cc(ccc1OC)SCCC(=O)C 62a_200010179862_100000053229 [0,1,0,0,0,1|1,0,0]=3 5603 B16R1.4275 CCc1cc(ccc1OC)SCCC(=O)N 62a_100000744528_200010179862 [0,1,0,0,0,1|2,0,0]=4 5604 B16R1.4275 CCc1cc(ccc1OC)SCCC(=O)N 62a_200010179862_100000744528 [0,1,0,0,0,1|2,0,0]=4 5605 B16R1.4275 CCc1cc(ccc1OC)SCOC(=O)C 62a_100000076356_200010179862 [0,1,0,0,0,1|2,0,0]=4 5606 B16R1.4275 CCc1cc(ccc1OC)SCOC(=O)C 62a_200010179862_100000076356 [0,1,0,0,0,1|2,0,0]=4 5607 B16R1.4275 CCc1ccc(cc1OC)SCCC(=O)C 62a_100000053229_200010710398 [0,1,0,0,0,1|1,0,0]=3 5608 B16R1.4275 CCc1ccc(cc1OC)SCCC(=O)C 62a_200010710398_100000053229 [0,1,0,0,0,1|1,0,0]=3 5609 B16R1.4275 CCc1ccc(cc1OC)SCCC(=O)N 62a_100000744528_200010710398 [0,1,0,0,0,1|2,0,0]=4 5610 B16R1.4275 CCc1ccc(cc1OC)SCCC(=O)N 62a_200010710398_100000744528 [0,1,0,0,0,1|2,0,0]=4 5611 B16R1.4275 CCc1ccc(cc1OC)SCOC(=O)C 62a_100000076356_200010710398 [0,1,0,0,0,1|2,0,0]=4 5612 B16R1.4275 CCc1ccc(cc1OC)SCOC(=O)C 62a_200010710398_100000076356 [0,1,0,0,0,1|2,0,0]=4 5613 B16R1.4275 CNc1cc(ccc1C#N)SCCC(=O)C 62a_100000053229_200012356631 [0,1,0,0,0,1|2,0,0]=4 5614 B16R1.4275 COc1cc(ccc1C#N)NCCC(=O)N 34a_100011999456_100000731001 [0,1,0,0,0,1|2,0,0]=4 5615 B16R1.4275 COc1cc(ccc1C#N)NCOC(=O)C 34a_100011999456_100009813279 [0,1,0,0,0,1|2,0,0]=4 5616 B16R1.4275 COc1cc(ccc1C#N)SCCC(=O)C 62a_100000053229_100000694671 [0,1,0,0,0,1|1,0,0]=3 5617 B16R1.4275 COc1cc(ccc1C#N)SCCC(=O)N 62a_100000744528_100000694671 [0,1,0,0,0,1|2,0,0]=4 5618 B16R1.4275 COc1cc(ccc1C#N)SCOC(=O)C 62a_100000076356_100000694671 [0,1,0,0,0,1|2,0,0]=4 5619 B16R1.4275 COc1cc(ccc1C=O)SCCC(=O)C 62a_100000053229_100010290300 [0,1,0,0,0,1|0,0,1]=3 5620 B16R1.4275 COc1cc(ccc1C=O)SCCC(=O)C 62a_100000697075_100000053229 [0,1,0,0,0,1|0,0,1]=3 5621 B16R1.4275 COc1cc(ccc1C=O)SCCC(=O)N 62a_100000697075_100000744528 [0,1,0,0,0,1|1,0,1]=4 5622 B16R1.4275 COc1cc(ccc1C=O)SCCC(=O)N 62a_100000744528_100010290300 [0,1,0,0,0,1|1,0,1]=4 5623 B16R1.4275 COc1cc(ccc1C=O)SCOC(=O)C 62a_100000076356_100010290300 [0,1,0,0,0,1|1,0,1]=4 5624 B16R1.4275 COc1cc(ccc1C=O)SCOC(=O)C 62a_100000697075_100000076356 [0,1,0,0,0,1|1,0,1]=4 5625 B16R1.4275 COc1cc(ccc1CO)NCC=C(C)C 34a_100012183141_100000761012 [0,1,0,0,0,1|1,0,1]=4 5626 B16R1.4275 COc1cc(ccc1CO)NCCC(=O)N 34a_100012183141_100000731001 [0,1,0,0,0,1|1,0,0]=3 5627 B16R1.4275 COc1cc(ccc1CO)NCCC(C)C 34a_100012183141_100000210312 [0,1,0,0,0,1|1,0,1]=4 5628 B16R1.4275 COc1cc(ccc1CO)NCCC(C)O 34a_100012183141_100012276601 [0,1,0,0,0,1|0,0,2]=4 5629 B16R1.4275 COc1cc(ccc1CO)NCOC(=O)C 34a_100012183141_100009813279 [0,1,0,0,0,1|1,0,0]=3 5630 B16R1.4275 COc1cc(ccc1CO)OCC=C(C)C 34a_200000116926_100000761012 [0,1,0,0,0,1|1,0,1]=4 5631 B16R1.4275 COc1cc(ccc1CO)OCCC(=O)N 34a_200000116926_100000731001 [0,1,0,0,0,1|1,0,0]=3 5632 B16R1.4275 COc1cc(ccc1CO)OCCC(C)C 34a_200000116926_100000210312 [0,1,0,0,0,1|1,0,1]=4 5633 B16R1.4275 COc1cc(ccc1CO)OCCC(C)O 34a_200000116926_100012276601 [0,1,0,0,0,1|0,0,2]=4 5634 B16R1.4275 COc1cc(ccc1CO)OCOC(=O)C 34a_200000116926_100009813279 [0,1,0,0,0,1|1,0,0]=3 5635 B16R1.4275 COc1cc(ccc1CO)SCC=C(C)C 62a_100000761012_100011277633 [0,1,0,0,0,1|1,0,1]=4 5636 B16R1.4275 COc1cc(ccc1CO)SCC=C(C)C 62a_100011277633_100000761012 [0,1,0,0,0,1|1,0,1]=4 5637 B16R1.4275 COc1cc(ccc1CO)SCCC(=O)C 62a_100000053229_100011277633 [0,1,0,0,0,1|0,0,0]=2 5638 B16R1.4275 COc1cc(ccc1CO)SCCC(=O)C 62a_100011277633_100000053229 [0,1,0,0,0,1|0,0,0]=2 5639 B16R1.4275 COc1cc(ccc1CO)SCCC(=O)N 62a_100000744528_100011277633 [0,1,0,0,0,1|1,0,0]=3 5640 B16R1.4275 COc1cc(ccc1CO)SCCC(=O)N 62a_100011277633_100000744528 [0,1,0,0,0,1|1,0,0]=3 5641 B16R1.4275 COc1cc(ccc1CO)SCCC(C)C 62a_100000210312_100011277633 [0,1,0,0,0,1|1,0,1]=4 5642 B16R1.4275 COc1cc(ccc1CO)SCCC(C)C 62a_100011277633_100000210312 [0,1,0,0,0,1|1,0,1]=4 5643 B16R1.4275 COc1cc(ccc1CO)SCCC(C)O 62a_100011277633_100012276601 [0,1,0,0,0,1|0,0,2]=4 5644 B16R1.4275 COc1cc(ccc1CO)SCCC(C)O 62a_100012276601_100011277633 [0,1,0,0,0,1|0,0,2]=4 5645 B16R1.4275 COc1cc(ccc1CO)SCCN(C)C 62a_100011277633_100000755713 [0,1,0,0,0,1|2,0,0]=4 5646 B16R1.4275 COc1cc(ccc1CO)SCOC(=O)C 62a_100000076356_100011277633 [0,1,0,0,0,1|1,0,0]=3 5647 B16R1.4275 COc1cc(ccc1CO)SCOC(=O)C 62a_100011277633_100000076356 [0,1,0,0,0,1|1,0,0]=3 5648 B16R1.4275 COc1cc(ccc1SC)SCCC(=O)C 62a_200011001119_100000053229 [0,1,0,0,0,1|0,1,0]=3 5649 B16R1.4275 COc1cc(ccc1SC)SCCC(=O)N 62a_200011001119_100000744528 [0,1,0,0,0,1|1,1,0]=4 5650 B16R1.4275 COc1cc(ccc1SC)SCOC(=O)C 62a_200011001119_100000076356 [0,1,0,0,0,1|1,1,0]=4 5651 B16R1.4275 COc1cc(cnc1C#N)SCCC(=O)C 62a_100000053229_100000719880 [0,1,0,0,0,1|2,0,0]=4 5652 B16R1.4275 COc1cc(cnc1C=O)SCCC(=O)C 62a_100000053229_100010246152 [0,1,0,0,0,1|1,0,1]=4 5653 B16R1.4275 COc1cc(cnc1C=O)SCCC(=O)C 62a_100010246152_100000053229 [0,1,0,0,0,1|1,0,1]=4 5654 B16R1.4275 COc1cc(cnc1CO)SCCC(=O)C 62a_100000053229_200010246159 [0,1,0,0,0,1|1,0,0]=3 5655 B16R1.4275 COc1cc(cnc1CO)SCCC(=O)C 62a_200010246159_100000053229 [0,1,0,0,0,1|1,0,0]=3 5656 B16R1.4275 COc1cc(cnc1CO)SCCC(=O)N 62a_100000744528_200010246159 [0,1,0,0,0,1|2,0,0]=4 5657 B16R1.4275 COc1cc(cnc1CO)SCCC(=O)N 62a_200010246159_100000744528 [0,1,0,0,0,1|2,0,0]=4 5658 B16R1.4275 COc1cc(cnc1CO)SCOC(=O)C 62a_100000076356_200010246159 [0,1,0,0,0,1|2,0,0]=4 5659 B16R1.4275 COc1cc(cnc1CO)SCOC(=O)C 62a_200010246159_100000076356 [0,1,0,0,0,1|2,0,0]=4 5660 B16R1.4275 COc1cc(cnc1OC)SCCC(=O)C 62a_100000053229_100010234541 [0,1,0,0,0,1|1,0,0]=3 5661 B16R1.4275 COc1cc(cnc1OC)SCCC(=O)N 62a_100000744528_100010234541 [0,1,0,0,0,1|2,0,0]=4 5662 B16R1.4275 COc1cc(cnc1OC)SCOC(=O)C 62a_100000076356_100010234541 [0,1,0,0,0,1|2,0,0]=4 5663 B16R1.4275 COc1cc(ncc1C#N)SCCC(=O)C 62a_100000053229_100009830018 [0,1,0,0,0,1|2,0,0]=4 5664 B16R1.4275 COc1cc(ncc1C=O)SCCC(=O)C 62a_100000053229_100009846838 [0,1,0,0,0,1|1,0,1]=4 5665 B16R1.4275 COc1cc(ncc1C=O)SCCC(=O)C 62a_100009846838_100000053229 [0,1,0,0,0,1|1,0,1]=4 5666 B16R1.4275 COc1cc(ncc1CO)SCCC(=O)C 62a_100000053229_100010714672 [0,1,0,0,0,1|1,0,0]=3 5667 B16R1.4275 COc1cc(ncc1CO)SCCC(=O)C 62a_100010714672_100000053229 [0,1,0,0,0,1|1,0,0]=3 5668 B16R1.4275 COc1cc(ncc1CO)SCCC(=O)N 62a_100000744528_100010714672 [0,1,0,0,0,1|2,0,0]=4 5669 B16R1.4275 COc1cc(ncc1CO)SCCC(=O)N 62a_100010714672_100000744528 [0,1,0,0,0,1|2,0,0]=4 5670 B16R1.4275 COc1cc(ncc1CO)SCOC(=O)C 62a_100000076356_100010714672 [0,1,0,0,0,1|2,0,0]=4 5671 B16R1.4275 COc1cc(ncc1CO)SCOC(=O)C 62a_100010714672_100000076356 [0,1,0,0,0,1|2,0,0]=4 5672 B16R1.4275 COc1cc(nnc1OC)SCCC(=O)C 62a_100000053229_200000095610 [0,1,0,0,0,1|2,0,0]=4 5673 B16R1.4275 COc1ccc(cc1C#N)NCCC(=O)C 7a_100011204338_100000053229 [0,1,0,0,0,1|2,0,0]=4 5674 B16R1.4275 COc1ccc(cc1C#N)SCCC(=O)C 62a_100000053229_100000188252 [0,1,0,0,0,1|2,0,0]=4 5675 B16R1.4275 COc1ccc(cc1C=O)SCCC(=O)C 62a_100000053229_100000170026 [0,1,0,0,0,1|2,0,0]=4 5676 B16R1.4275 COc1ccc(cc1C=O)SCCC(=O)C 62a_100000170026_100000053229 [0,1,0,0,0,1|2,0,0]=4 5677 B16R1.4275 COc1ccc(cc1CN)SCCC(=O)C 62a_100000053229_100000690498 [0,1,0,0,0,1|2,0,0]=4 5678 B16R1.4275 COc1ccc(cc1CN)SCCC(=O)C 62a_100000690498_100000053229 [0,1,0,0,0,1|2,0,0]=4 5679 B16R1.4275 COc1ccc(cc1CO)SCCC(=O)C 62a_100000053229_100000204679 [0,1,0,0,0,1|2,0,0]=4 5680 B16R1.4275 COc1ccc(cc1CO)SCCC(=O)C 62a_100000204679_100000053229 [0,1,0,0,0,1|2,0,0]=4 5681 B16R1.4275 COc1ccc(cc1OC)C=NNC(=O)C 4a_100000189765_100000170513 [0,1,0,0,0,1|1,0,1]=4 5682 B16R1.4275 COc1ccc(cc1OC)CCCC(=O)C 1458a_100000070787_200012094798 [0,1,0,0,0,1|0,0,0]=2 5683 B16R1.4275 COc1ccc(cc1OC)CCCC(=O)C 1458a_100011217081_200000210301 [0,1,0,0,0,1|0,0,0]=2 5684 B16R1.4275 COc1ccc(cc1OC)CCCC(=O)[13CH3] 1458a_100011217081_200025704644 [0,1,0,0,0,1|0,0,0]=2 5685 B16R1.4275 COc1ccc(cc1OC)CCCN(C)C 2230a_100102631434_200012094798 [0,1,0,0,0,1|2,0,0]=4 5686 B16R1.4275 COc1ccc(cc1OC)CCCN(C)C 269982a_100102631434_200012094798 [0,1,0,0,0,1|2,0,0]=4 5687 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 11a_100000210947_100015343762 [0,1,0,0,0,1|0,0,0]=2 5688 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 1626a_100000210947_100015343762 [0,1,0,0,0,1|0,0,0]=2 5689 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 240690a_100000210947_100015343762 [0,1,0,0,0,1|0,0,0]=2 5690 B16R1.4275 COc1ccc(cc1OC)CCNC(=O)C 527a_100000210947_100103153847 [0,1,0,0,0,1|0,0,0]=2 5691 B16R1.4275 COc1ccc(cc1OC)CCNC(C)C 2230a_100000210947_100000210206 [0,1,0,0,0,1|1,0,1]=4 5692 B16R1.4275 COc1ccc(cc1OC)CCNC(C)C 2230a_100138425928_100011273988 [0,1,0,0,0,1|1,0,1]=4 5693 B16R1.4275 COc1ccc(cc1OC)CCNC(C)C 34a_100000210947_100000210206 [0,1,0,0,0,1|1,0,1]=4 5694 B16R1.4275 COc1ccc(cc1OC)CCNC(C)C 34a_100138425928_100011273988 [0,1,0,0,0,1|1,0,1]=4 5695 B16R1.4275 COc1ccc(cc1OC)CCOC(C)C 34a_100000212225_100011273988 [0,1,0,0,0,1|1,0,1]=4 5696 B16R1.4275 COc1ccc(cc1OC)CCOC(C)C 34a_100011215274_100000210206 [0,1,0,0,0,1|1,0,1]=4 5697 B16R1.4275 COc1ccc(cc1OC)CCSC(C)C 62a_100000210206_100011740610 [0,1,0,0,0,1|1,0,1]=4 5698 B16R1.4275 COc1ccc(cc1OC)CNCC(=O)N 2230a_100000711301_100011233839 [0,1,0,0,0,1|1,0,0]=3 5699 B16R1.4275 COc1ccc(cc1OC)CNCC(=O)N 34a_100000185555_100000187820 [0,1,0,0,0,1|1,0,0]=3 5700 B16R1.4275 COc1ccc(cc1OC)CNCC(=O)O 269956a_100016091260_100011233839 [0,1,0,0,0,1|1,0,0]=3 5701 B16R1.4275 COc1ccc(cc1OC)CNCC(=O)[O-] 34a_100000185555_100020667443 [0,1,0,0,0,1|1,0,0]=3 5702 B16R1.4275 COc1ccc(cc1OC)CNCC(C)C 207a_100000210953_100000170513 [0,1,0,0,0,1|1,0,1]=4 5703 B16R1.4275 COc1ccc(cc1OC)CNCC(C)C 2230a_100000210953_100011233839 [0,1,0,0,0,1|1,0,1]=4 5704 B16R1.4275 COc1ccc(cc1OC)CNCC(C)C 270004a_100000185555_100000210432 [0,1,0,0,0,1|1,0,1]=4 5705 B16R1.4275 COc1ccc(cc1OC)CNCC(C)C 270004a_100000210953_100000170513 [0,1,0,0,0,1|1,0,1]=4 5706 B16R1.4275 COc1ccc(cc1OC)CNCC(C)C 34a_100000185555_100000210624 [0,1,0,0,0,1|1,0,1]=4 5707 B16R1.4275 COc1ccc(cc1OC)CNCC(C)O 207a_100000210904_100000170513 [0,1,0,0,0,1|0,0,2]=4 5708 B16R1.4275 COc1ccc(cc1OC)CNCC(C)O 2230a_100000210904_100011233839 [0,1,0,0,0,1|0,0,2]=4 5709 B16R1.4275 COc1ccc(cc1OC)CNCC(C)O 270004a_100000210904_100000170513 [0,1,0,0,0,1|0,0,2]=4 5710 B16R1.4275 COc1ccc(cc1OC)CNCC(C)O 34a_100000185555_100011218427 [0,1,0,0,0,1|0,0,2]=4 5711 B16R1.4275 COc1ccc(cc1OC)CNC[C@@H](C)O 34a_100000185555_100009817552 [0,1,0,0,0,1|0,0,2]=4 5712 B16R1.4275 COc1ccc(cc1OC)CNC[N+](=O)[O-] 34a_100000185555_100000761209 [0,1,0,0,0,1|2,0,0]=4 5713 B16R1.4275 COc1ccc(cc1OC)COCC(=O)N 34a_100000210929_100000187820 [0,1,0,0,0,1|1,0,0]=3 5714 B16R1.4275 COc1ccc(cc1OC)COCC(=O)[O-] 34a_100000210929_100020667443 [0,1,0,0,0,1|1,0,0]=3 5715 B16R1.4275 COc1ccc(cc1OC)COCC(C)C 34a_100000210929_100000210624 [0,1,0,0,0,1|1,0,1]=4 5716 B16R1.4275 COc1ccc(cc1OC)COCC(C)O 34a_100000210929_100011218427 [0,1,0,0,0,1|0,0,2]=4 5717 B16R1.4275 COc1ccc(cc1OC)COC[C@@H](C)O 34a_100000210929_100009817552 [0,1,0,0,0,1|0,0,2]=4 5718 B16R1.4275 COc1ccc(cc1OC)COC[N+](=O)[O-] 34a_100000210929_100000761209 [0,1,0,0,0,1|2,0,0]=4 5719 B16R1.4275 COc1ccc(cc1OC)CSCC(=O)N 62a_100000747473_100011233839 [0,1,0,0,0,1|1,0,0]=3 5720 B16R1.4275 COc1ccc(cc1OC)CSCC(=O)[O-] 62a_100020667443_100011233839 [0,1,0,0,0,1|1,0,0]=3 5721 B16R1.4275 COc1ccc(cc1OC)CSCC(C)C 62a_100000210624_100011233839 [0,1,0,0,0,1|1,0,1]=4 5722 B16R1.4275 COc1ccc(cc1OC)CSCC(C)O 62a_100011218427_100011233839 [0,1,0,0,0,1|0,0,2]=4 5723 B16R1.4275 COc1ccc(cc1OC)CSC[C@@H](C)O 62a_100009817552_100011233839 [0,1,0,0,0,1|0,0,2]=4 5724 B16R1.4275 COc1ccc(cc1OC)NCC=C(C)C 34a_100000187404_100000761012 [0,1,0,0,0,1|1,0,1]=4 5725 B16R1.4275 COc1ccc(cc1OC)NCCC(=O)N 34a_100000187404_100000731001 [0,1,0,0,0,1|1,0,0]=3 5726 B16R1.4275 COc1ccc(cc1OC)NCCC(C)C 34a_100000187404_100000210312 [0,1,0,0,0,1|1,0,1]=4 5727 B16R1.4275 COc1ccc(cc1OC)NCCC(C)O 34a_100000187404_100012276601 [0,1,0,0,0,1|0,0,2]=4 5728 B16R1.4275 COc1ccc(cc1OC)NCOC(=O)C 34a_100000187404_100009813279 [0,1,0,0,0,1|1,0,0]=3 5729 B16R1.4275 COc1ccc(cc1OC)OCC=C(C)C 34a_100000039706_100000761012 [0,1,0,0,0,1|1,0,1]=4 5730 B16R1.4275 COc1ccc(cc1OC)OCCC(=O)N 34a_100000039706_100000731001 [0,1,0,0,0,1|1,0,0]=3 5731 B16R1.4275 COc1ccc(cc1OC)OCCC(C)C 34a_100000039706_100000210312 [0,1,0,0,0,1|1,0,1]=4 5732 B16R1.4275 COc1ccc(cc1OC)OCCC(C)O 34a_100000039706_100012276601 [0,1,0,0,0,1|0,0,2]=4 5733 B16R1.4275 COc1ccc(cc1OC)OCOC(=O)C 34a_100000039706_100009813279 [0,1,0,0,0,1|1,0,0]=3 5734 B16R1.4275 COc1ccc(cc1OC)SCC=C(C)C 62a_100000761012_100011356967 [0,1,0,0,0,1|1,0,1]=4 5735 B16R1.4275 COc1ccc(cc1OC)SCCC(=O)C 62a_100000053229_100011356967 [0,1,0,0,0,1|0,0,0]=2 5736 B16R1.4275 COc1ccc(cc1OC)SCCC(=O)N 62a_100000744528_100011356967 [0,1,0,0,0,1|1,0,0]=3 5737 B16R1.4275 COc1ccc(cc1OC)SCCC(C)C 62a_100000210312_100011356967 [0,1,0,0,0,1|1,0,1]=4 5738 B16R1.4275 COc1ccc(cc1OC)SCCC(C)O 62a_100012276601_100011356967 [0,1,0,0,0,1|0,0,2]=4 5739 B16R1.4275 COc1ccc(cc1OC)SCOC(=O)C 62a_100000076356_100011356967 [0,1,0,0,0,1|1,0,0]=3 5740 B16R1.4275 COc1ccc(cc1SC)SCCC(=O)C 62a_200009892704_100000053229 [0,1,0,0,0,1|0,1,0]=3 5741 B16R1.4275 COc1ccc(cc1SC)SCCC(=O)N 62a_200009892704_100000744528 [0,1,0,0,0,1|1,1,0]=4 5742 B16R1.4275 COc1ccc(cc1SC)SCOC(=O)C 62a_200009892704_100000076356 [0,1,0,0,0,1|1,1,0]=4 5743 B16R1.4275 COc1ccc(nc1OC)SCCC(=O)C 62a_100000053229_100010214848 [0,1,0,0,0,1|1,0,0]=3 5744 B16R1.4275 COc1ccc(nc1OC)SCCC(=O)N 62a_100000744528_100010214848 [0,1,0,0,0,1|2,0,0]=4 5745 B16R1.4275 COc1ccc(nc1OC)SCOC(=O)C 62a_100000076356_100010214848 [0,1,0,0,0,1|2,0,0]=4 5746 B16R1.4275 COc1cnc(nc1OC)SCCC(=O)C 62a_100000053229_100010280452 [0,1,0,0,0,1|2,0,0]=4 5747 B16R1.4275 COc1nc(ccc1C#N)SCCC(=O)C 62a_100000053229_100000708423 [0,1,0,0,0,1|2,0,0]=4 5748 B16R1.4275 COc1nc(ccc1C=O)SCCC(=O)C 62a_100000053229_100009864722 [0,1,0,0,0,1|1,0,1]=4 5749 B16R1.4275 COc1nc(ccc1C=O)SCCC(=O)C 62a_100009864722_100000053229 [0,1,0,0,0,1|1,0,1]=4 5750 B16R1.4275 COc1nc(ccc1CN)SCCC(=O)C 62a_100000053229_100015687481 [0,1,0,0,0,1|2,0,0]=4 5751 B16R1.4275 COc1nc(ccc1CN)SCCC(=O)C 62a_100015687481_100000053229 [0,1,0,0,0,1|2,0,0]=4 5752 B16R1.4275 COc1nc(ccc1CO)SCCC(=O)C 62a_100000053229_100010988397 [0,1,0,0,0,1|1,0,0]=3 5753 B16R1.4275 COc1nc(ccc1CO)SCCC(=O)C 62a_100010988397_100000053229 [0,1,0,0,0,1|1,0,0]=3 5754 B16R1.4275 COc1nc(ccc1CO)SCCC(=O)N 62a_100000744528_100010988397 [0,1,0,0,0,1|2,0,0]=4 5755 B16R1.4275 COc1nc(ccc1CO)SCCC(=O)N 62a_100010988397_100000744528 [0,1,0,0,0,1|2,0,0]=4 5756 B16R1.4275 COc1nc(ccc1CO)SCOC(=O)C 62a_100000076356_100010988397 [0,1,0,0,0,1|2,0,0]=4 5757 B16R1.4275 COc1nc(ccc1CO)SCOC(=O)C 62a_100010988397_100000076356 [0,1,0,0,0,1|2,0,0]=4 5758 B16R1.4275 COc1nc(ncc1CO)SCCC(=O)C 62a_100000053229_200011024631 [0,1,0,0,0,1|2,0,0]=4 5759 B16R1.4275 COc1nc(ncc1CO)SCCC(=O)C 62a_200011024631_100000053229 [0,1,0,0,0,1|2,0,0]=4 5760 B16R1.4275 COc1ncc(nc1OC)SCCC(=O)C 62a_100000053229_100010132954 [0,1,0,0,0,1|2,0,0]=4 5761 B16R1.4275 COc1ncc(nc1OC)SCCC(=O)C 62a_100010132954_100000053229 [0,1,0,0,0,1|2,0,0]=4 5762 B16R1.4708 C#CC(C)NCCc1ccc(c(c1)OC)O 2230a_100000707721_100010741665 [0,1,0,0,0,1|1,0,1]=4 5763 B16R1.4708 C#CC(C)NCCc1ccc(c(c1)OC)O 34a_100000756042_200000035995 [0,1,0,0,0,1|1,0,1]=4 5764 B16R1.4708 C#CC(C)SCCc1ccc(c(c1)OC)O 62a_200000035995_100010741665 [0,1,0,0,0,1|1,0,1]=4 5765 B16R1.4708 C#C[C@@H](C)OCCc1ccc(c(c1)OC)O 7a_100009815206_100010741665 [0,1,0,0,0,1|1,0,1]=4 5766 B16R1.4708 C=C(C#N)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000694840 [0,1,0,0,0,1|1,0,1]=4 5767 B16R1.4708 C=CC(=O)NCCc1ccc(c(c1)OC)O 240690a_100000756042_200121576911 [0,1,0,0,0,1|0,0,1]=3 5768 B16R1.4708 C=CC(C)SCCc1ccc(c(c1)OC)O 62a_100011215867_100010741665 [0,1,0,0,0,1|1,0,1]=4 5769 B16R1.4708 CCC(=O)COCc1ccc(c(c1)OC)Br 34a_100000725409_100010110085 [0,1,0,0,0,1|1,0,0]=3 5770 B16R1.4708 CCC(=O)COCc1ccc(c(c1)OC)Br 7a_100010234685_100000747405 [0,1,0,0,0,1|1,0,0]=3 5771 B16R1.4708 CCC(=O)COCc1ccc(c(c1)OC)C 7a_100000752651_100000747405 [0,1,0,0,0,1|1,0,0]=3 5772 B16R1.4708 CCC(=O)COCc1ccc(c(c1)OC)Cl 34a_100000725409_200010214485 [0,1,0,0,0,1|1,0,0]=3 5773 B16R1.4708 CCC(=O)COCc1ccc(c(c1)OC)F 34a_100000725409_100012349856 [0,1,0,0,0,1|1,0,0]=3 5774 B16R1.4708 CCC(=O)COCc1ccc(c(c1)OC)F 7a_100000692429_100000747405 [0,1,0,0,0,1|1,0,0]=3 5775 B16R1.4708 CCC(=O)COCc1ccc(c(n1)OC)Br 34a_100000725409_200010066506 [0,1,0,0,0,1|2,0,0]=4 5776 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)C=O)O 62a_100000747405_100000008128 [0,1,0,0,0,1|2,0,0]=4 5777 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)OC)Br 62a_100000747405_100010110085 [0,1,0,0,0,1|1,0,0]=3 5778 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)OC)Br 62a_100010110085_100000747405 [0,1,0,0,0,1|1,0,0]=3 5779 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)OC)Cl 62a_100000747405_200010214485 [0,1,0,0,0,1|1,0,0]=3 5780 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000747405 [0,1,0,0,0,1|1,0,0]=3 5781 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)OC)F 62a_100000747405_100012349856 [0,1,0,0,0,1|1,0,0]=3 5782 B16R1.4708 CCC(=O)CSCc1ccc(c(c1)OC)F 62a_100012349856_100000747405 [0,1,0,0,0,1|1,0,0]=3 5783 B16R1.4708 CCC(=O)CSCc1ccc(c(n1)OC)Br 62a_100000747405_200010066506 [0,1,0,0,0,1|2,0,0]=4 5784 B16R1.4708 CCC(=O)CSCc1ccc(c(n1)OC)Br 62a_200010066506_100000747405 [0,1,0,0,0,1|2,0,0]=4 5785 B16R1.4708 CCC(=O)NCCc1ccc(c(c1)OC)O 240690a_100000756042_100000210414 [0,1,0,0,0,1|0,0,0]=2 5786 B16R1.4708 CCC(=O)NCCc1ccc(c(c1)OC)O 527a_100000756042_100000210414 [0,1,0,0,0,1|0,0,0]=2 5787 B16R1.4708 CCC(=O)NN=Cc1ccc(c(c1)OC)O 4a_100000183195_100000188322 [0,1,0,0,0,1|1,0,1]=4 5788 B16R1.4708 CCC(C)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000748023 [0,1,0,0,0,1|1,0,1]=4 5789 B16R1.4708 CCC(C)NCCc1ccc(c(c1)OC)O 2230a_100000209981_100010741665 [0,1,0,0,0,1|1,0,1]=4 5790 B16R1.4708 CCC(C)NCCc1ccc(c(c1)OC)O 34a_100000756042_100011215416 [0,1,0,0,0,1|1,0,1]=4 5791 B16R1.4708 CCC(C)OCCc1ccc(c(c1)OC)O 7a_100000210228_100010741665 [0,1,0,0,0,1|1,0,1]=4 5792 B16R1.4708 CCC(C)SCCc1ccc(c(c1)OC)O 62a_100000758301_100010741665 [0,1,0,0,0,1|1,0,1]=4 5793 B16R1.4708 CCC(O)CNCc1ccc(c(c1)OC)O 34a_100000185554_100011218378 [0,1,0,0,0,1|0,0,2]=4 5794 B16R1.4708 CC[C@H](C)CNCc1ccc(c(c1)OC)O 34a_100000185554_100009816398 [0,1,0,0,0,1|1,0,1]=4 5795 B16R1.4708 CCc1cc(ccc1Br)NCCC(=O)NC 2230a_100010109747_100000737683 [0,1,0,0,0,1|2,0,0]=4 5796 B16R1.4708 CCc1cc(ccc1Br)NCCC(=O)NC 34a_100010109747_100012179268 [0,1,0,0,0,1|2,0,0]=4 5797 B16R1.4708 CCc1cc(ccc1Br)NCCC(=O)NC 7a_100010109747_100000737683 [0,1,0,0,0,1|2,0,0]=4 5798 B16R1.4708 CCc1cc(ccc1Br)NCCC(=O)OC 2230a_100010109747_100000204255 [0,1,0,0,0,1|2,0,0]=4 5799 B16R1.4708 CCc1cc(ccc1Br)NCCC(=O)OC 34a_100010109747_100000742370 [0,1,0,0,0,1|2,0,0]=4 5800 B16R1.4708 CCc1cc(ccc1Br)NCCC(=O)OC 7a_100010109747_100000204255 [0,1,0,0,0,1|2,0,0]=4 5801 B16R1.4708 CCc1cc(ccc1Br)SCCC(=O)NC 62a_100000737683_100010244631 [0,1,0,0,0,1|2,0,0]=4 5802 B16R1.4708 CCc1cc(ccc1Br)SCCC(=O)NC 62a_100010244631_100000737683 [0,1,0,0,0,1|2,0,0]=4 5803 B16R1.4708 CCc1cc(ccc1Br)SCCC(=O)OC 62a_100000204255_100010244631 [0,1,0,0,0,1|2,0,0]=4 5804 B16R1.4708 CCc1cc(ccc1Br)SCCC(=O)OC 62a_100010244631_100000204255 [0,1,0,0,0,1|2,0,0]=4 5805 B16R1.4708 CCc1cc(ccc1Cl)OCCC(=O)NC 34a_100000212063_100012179268 [0,1,0,0,0,1|2,0,0]=4 5806 B16R1.4708 CCc1cc(ccc1Cl)OCCC(=O)NC 7a_100000212063_100000737683 [0,1,0,0,0,1|2,0,0]=4 5807 B16R1.4708 CCc1cc(ccc1Cl)OCCC(=O)OC 34a_100000212063_100000742370 [0,1,0,0,0,1|2,0,0]=4 5808 B16R1.4708 CCc1cc(ccc1Cl)OCCC(=O)OC 7a_100000212063_100000204255 [0,1,0,0,0,1|2,0,0]=4 5809 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)NC 207a_100000693194_100009840867 [0,1,0,0,0,1|2,0,0]=4 5810 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)NC 2230a_114873767189_100000183359 [0,1,0,0,0,1|2,0,0]=4 5811 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)NC 269862a_100000693194_100009840867 [0,1,0,0,0,1|2,0,0]=4 5812 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)NC 270004a_100000693194_100009840867 [0,1,0,0,0,1|2,0,0]=4 5813 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)NC 34a_114873767189_100000183359 [0,1,0,0,0,1|2,0,0]=4 5814 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)OC 2230a_114873767189_100000747449 [0,1,0,0,0,1|2,0,0]=4 5815 B16R1.4708 CCc1cc(ccc1F)CNCC(=O)OC 34a_114873767189_100000747449 [0,1,0,0,0,1|2,0,0]=4 5816 B16R1.4708 CCc1cc(ccc1F)SCCC(=O)NC 62a_100000737683_100010244625 [0,1,0,0,0,1|2,0,0]=4 5817 B16R1.4708 CCc1cc(ccc1F)SCCC(=O)NC 62a_100010244625_100000737683 [0,1,0,0,0,1|2,0,0]=4 5818 B16R1.4708 CCc1cc(ccc1F)SCCC(=O)OC 62a_100000204255_100010244625 [0,1,0,0,0,1|2,0,0]=4 5819 B16R1.4708 CCc1cc(ccc1F)SCCC(=O)OC 62a_100010244625_100000204255 [0,1,0,0,0,1|2,0,0]=4 5820 B16R1.4708 CCc1cc(ccc1N)SCCC(=O)NC 62a_100000686106_100000737683 [0,1,0,0,0,1|2,0,0]=4 5821 B16R1.4708 CCc1cc(ccc1N)SCCC(=O)NC 62a_100000737683_100000686106 [0,1,0,0,0,1|2,0,0]=4 5822 B16R1.4708 CCc1cc(ccc1N)SCCC(=O)OC 62a_100000204255_100000686106 [0,1,0,0,0,1|2,0,0]=4 5823 B16R1.4708 CCc1cc(ccc1N)SCCC(=O)OC 62a_100000686106_100000204255 [0,1,0,0,0,1|2,0,0]=4 5824 B16R1.4708 CCc1cc(ccc1O)SCCC(=O)NC 62a_100000737683_100012338938 [0,1,0,0,0,1|1,0,0]=3 5825 B16R1.4708 CCc1cc(ccc1O)SCCC(=O)OC 62a_100000204255_100012338938 [0,1,0,0,0,1|1,0,0]=3 5826 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)C#N)O 34a_100011249283_100012179268 [0,1,0,0,0,1|2,0,0]=4 5827 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000737683 [0,1,0,0,0,1|1,0,0]=3 5828 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)Br 34a_100000765947_100012179268 [0,1,0,0,0,1|1,0,0]=3 5829 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000737683 [0,1,0,0,0,1|1,0,0]=3 5830 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)C 34a_100011279678_100012179268 [0,1,0,0,0,1|1,0,0]=3 5831 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000737683 [0,1,0,0,0,1|1,0,0]=3 5832 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100012179268 [0,1,0,0,0,1|1,0,0]=3 5833 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000737683 [0,1,0,0,0,1|1,0,0]=3 5834 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)F 34a_100000701188_100012179268 [0,1,0,0,0,1|1,0,0]=3 5835 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)I 34a_100000746945_100012179268 [0,1,0,0,0,1|1,0,0]=3 5836 B16R1.4708 CNC(=O)CCNc1ccc(c(c1)OC)O 34a_100000726020_100012179268 [0,1,0,0,0,1|0,0,0]=2 5837 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)Br 34a_100011827694_100012179268 [0,1,0,0,0,1|1,0,0]=3 5838 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000737683 [0,1,0,0,0,1|1,0,0]=3 5839 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)C 34a_100009865632_100012179268 [0,1,0,0,0,1|1,0,0]=3 5840 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)C 7a_100009865632_100000737683 [0,1,0,0,0,1|1,0,0]=3 5841 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100012179268 [0,1,0,0,0,1|1,0,0]=3 5842 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000737683 [0,1,0,0,0,1|1,0,0]=3 5843 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)F 34a_100012001760_100012179268 [0,1,0,0,0,1|1,0,0]=3 5844 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)F 7a_100012001760_100000737683 [0,1,0,0,0,1|1,0,0]=3 5845 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)N 34a_100015326901_100012179268 [0,1,0,0,0,1|1,0,0]=3 5846 B16R1.4708 CNC(=O)CCOc1ccc(c(c1)OC)N 7a_100015326901_100000737683 [0,1,0,0,0,1|1,0,0]=3 5847 B16R1.4708 CNC(=O)CCSc1c[nH]c(=O)c(c1)OC 62a_100000737683_100010125397 [0,1,0,0,0,1|1,0,1]=4 5848 B16R1.4708 CNC(=O)CCSc1cc(c(cn1)C)OC 62a_100000737683_100010067687 [0,1,0,0,0,1|2,0,0]=4 5849 B16R1.4708 CNC(=O)CCSc1cc(c(cn1)C)OC 62a_100010067687_100000737683 [0,1,0,0,0,1|2,0,0]=4 5850 B16R1.4708 CNC(=O)CCSc1cc(c(cn1)F)OC 62a_100000737683_200010136270 [0,1,0,0,0,1|2,0,0]=4 5851 B16R1.4708 CNC(=O)CCSc1cc(c(cn1)F)OC 62a_200010136270_100000737683 [0,1,0,0,0,1|2,0,0]=4 5852 B16R1.4708 CNC(=O)CCSc1cc(c(cn1)N)OC 62a_100000737683_100009887741 [0,1,0,0,0,1|2,0,0]=4 5853 B16R1.4708 CNC(=O)CCSc1cc(c(cn1)N)OC 62a_100009887741_100000737683 [0,1,0,0,0,1|2,0,0]=4 5854 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)C#N)O 62a_100000737683_100000687585 [0,1,0,0,0,1|2,0,0]=4 5855 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)C=O)O 62a_100000737683_100000186750 [0,1,0,0,0,1|2,0,0]=4 5856 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)CN)O 62a_100000730032_100000737683 [0,1,0,0,0,1|2,0,0]=4 5857 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)CN)O 62a_100000737683_100000730032 [0,1,0,0,0,1|2,0,0]=4 5858 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)CO)O 62a_100000184703_100000737683 [0,1,0,0,0,1|2,0,0]=4 5859 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)CO)O 62a_100000737683_100000184703 [0,1,0,0,0,1|2,0,0]=4 5860 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)NC)C 62a_100000737683_100020629602 [0,1,0,0,0,1|2,0,0]=4 5861 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)NC)C 62a_100020629602_100000737683 [0,1,0,0,0,1|2,0,0]=4 5862 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)NC)F 62a_100000737683_100011314990 [0,1,0,0,0,1|2,0,0]=4 5863 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)NC)F 62a_100011314990_100000737683 [0,1,0,0,0,1|2,0,0]=4 5864 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)NC)N 62a_100000694363_100000737683 [0,1,0,0,0,1|2,0,0]=4 5865 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)Br 62a_100000737683_100012353699 [0,1,0,0,0,1|1,0,0]=3 5866 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000737683 [0,1,0,0,0,1|1,0,0]=3 5867 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)C 62a_100000737683_100011830276 [0,1,0,0,0,1|1,0,0]=3 5868 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)C 62a_100011830276_100000737683 [0,1,0,0,0,1|1,0,0]=3 5869 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)Cl 62a_100000737683_100011356853 [0,1,0,0,0,1|1,0,0]=3 5870 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000737683 [0,1,0,0,0,1|1,0,0]=3 5871 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)F 62a_100000737683_100011934186 [0,1,0,0,0,1|1,0,0]=3 5872 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)F 62a_100011934186_100000737683 [0,1,0,0,0,1|1,0,0]=3 5873 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)N 62a_100000737683_100015196925 [0,1,0,0,0,1|1,0,0]=3 5874 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)N 62a_100011279103_100000737683 [0,1,0,0,0,1|1,0,0]=3 5875 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)OC)O 62a_100000737683_100000694246 [0,1,0,0,0,1|0,0,0]=2 5876 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)SC)F 62a_100000737683_100010341305 [0,1,0,0,0,1|1,1,0]=4 5877 B16R1.4708 CNC(=O)CCSc1ccc(c(c1)SC)F 62a_100010341305_100000737683 [0,1,0,0,0,1|1,1,0]=4 5878 B16R1.4708 CNC(=O)CCSc1ccc(c(n1)OC)N 62a_100000687816_100000737683 [0,1,0,0,0,1|2,0,0]=4 5879 B16R1.4708 CNC(=O)CCSc1ccc(c(n1)OC)N 62a_100000737683_100000687816 [0,1,0,0,0,1|2,0,0]=4 5880 B16R1.4708 CNC(=O)CCSc1ccc(c(n1)OC)O 62a_100000737683_100010893133 [0,1,0,0,0,1|1,0,0]=3 5881 B16R1.4708 CNC(=O)CCSc1cnc(c(c1)OC)C 62a_100000737683_100010254219 [0,1,0,0,0,1|2,0,0]=4 5882 B16R1.4708 CNC(=O)CCSc1cnc(c(c1)OC)C 62a_100010254219_100000737683 [0,1,0,0,0,1|2,0,0]=4 5883 B16R1.4708 CNC(=O)CCSc1cnc(c(c1)OC)F 62a_100000737683_100010214931 [0,1,0,0,0,1|2,0,0]=4 5884 B16R1.4708 CNC(=O)CCSc1cnc(c(c1)OC)F 62a_100010214931_100000737683 [0,1,0,0,0,1|2,0,0]=4 5885 B16R1.4708 CNC(=O)CCSc1cnc(c(c1)OC)N 62a_100000737683_106354213024 [0,1,0,0,0,1|2,0,0]=4 5886 B16R1.4708 CNC(=O)CCSc1cnc(c(c1)OC)N 62a_106354213024_100000737683 [0,1,0,0,0,1|2,0,0]=4 5887 B16R1.4708 CNC(=O)CCSc1cnc(c(n1)OC)O 62a_100000737683_200010365344 [0,1,0,0,0,1|2,0,0]=4 5888 B16R1.4708 CNC(=O)CCSc1cnc(c(n1)OC)O 62a_200010365344_100000737683 [0,1,0,0,0,1|2,0,0]=4 5889 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Br 207a_100000693194_100010244714 [0,1,0,0,0,1|1,0,0]=3 5890 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Br 2230a_100000693194_100010110085 [0,1,0,0,0,1|1,0,0]=3 5891 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Br 270004a_100000693194_100010244714 [0,1,0,0,0,1|1,0,0]=3 5892 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)C 207a_100000693194_100000719150 [0,1,0,0,0,1|1,0,0]=3 5893 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)C 270004a_100000693194_100000719150 [0,1,0,0,0,1|1,0,0]=3 5894 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Cl 207a_100000693194_100011998524 [0,1,0,0,0,1|1,0,0]=3 5895 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Cl 2230a_100000693194_200010214485 [0,1,0,0,0,1|1,0,0]=3 5896 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000183359 [0,1,0,0,0,1|1,0,0]=3 5897 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Cl 270004a_100000693194_100011998524 [0,1,0,0,0,1|1,0,0]=3 5898 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000183359 [0,1,0,0,0,1|1,0,0]=3 5899 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)F 207a_100000693194_100000692873 [0,1,0,0,0,1|1,0,0]=3 5900 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)F 2230a_100000693194_100012349856 [0,1,0,0,0,1|1,0,0]=3 5901 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)F 2230a_100020626639_100000183359 [0,1,0,0,0,1|1,0,0]=3 5902 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)F 270004a_100000693194_100000692873 [0,1,0,0,0,1|1,0,0]=3 5903 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)F 34a_100020626639_100000183359 [0,1,0,0,0,1|1,0,0]=3 5904 B16R1.4708 CNC(=O)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000183359 [0,1,0,0,0,1|0,0,0]=2 5905 B16R1.4708 CNC(=O)CNCc1ccc(c(n1)OC)Br 2230a_100000693194_200010066506 [0,1,0,0,0,1|2,0,0]=4 5906 B16R1.4708 CNC(=O)COCc1cc(c(cn1)Br)OC 34a_100010999569_100000183359 [0,1,0,0,0,1|2,0,0]=4 5907 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)Br 34a_100000750040_100010110085 [0,1,0,0,0,1|1,0,0]=3 5908 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)Br 34a_100010234685_100000183359 [0,1,0,0,0,1|1,0,0]=3 5909 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)Br 7a_100010234685_100000183359 [0,1,0,0,0,1|1,0,0]=3 5910 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)C 34a_100000752651_100000183359 [0,1,0,0,0,1|1,0,0]=3 5911 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)C 7a_100000752651_100000183359 [0,1,0,0,0,1|1,0,0]=3 5912 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)Cl 34a_100000750040_200010214485 [0,1,0,0,0,1|1,0,0]=3 5913 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)Cl 34a_100012179228_100000183359 [0,1,0,0,0,1|1,0,0]=3 5914 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)F 34a_100000692429_100000183359 [0,1,0,0,0,1|1,0,0]=3 5915 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)F 34a_100000750040_100012349856 [0,1,0,0,0,1|1,0,0]=3 5916 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)F 7a_100000692429_100000183359 [0,1,0,0,0,1|1,0,0]=3 5917 B16R1.4708 CNC(=O)COCc1ccc(c(c1)OC)N 34a_100000087641_100000183359 [0,1,0,0,0,1|1,0,0]=3 5918 B16R1.4708 CNC(=O)COCc1ccc(c(n1)OC)Br 34a_100000750040_200010066506 [0,1,0,0,0,1|2,0,0]=4 5919 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)C=O)O 62a_100000183359_100000008128 [0,1,0,0,0,1|2,0,0]=4 5920 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)OC)Br 62a_100000183359_100010110085 [0,1,0,0,0,1|1,0,0]=3 5921 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)OC)Br 62a_100010110085_100000183359 [0,1,0,0,0,1|1,0,0]=3 5922 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)OC)Cl 62a_100000183359_200010214485 [0,1,0,0,0,1|1,0,0]=3 5923 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000183359 [0,1,0,0,0,1|1,0,0]=3 5924 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)OC)F 62a_100000183359_100012349856 [0,1,0,0,0,1|1,0,0]=3 5925 B16R1.4708 CNC(=O)CSCc1ccc(c(c1)OC)F 62a_100012349856_100000183359 [0,1,0,0,0,1|1,0,0]=3 5926 B16R1.4708 CNC(=O)CSCc1ccc(c(n1)OC)Br 62a_100000183359_200010066506 [0,1,0,0,0,1|2,0,0]=4 5927 B16R1.4708 CNC(=O)CSCc1ccc(c(n1)OC)Br 62a_200010066506_100000183359 [0,1,0,0,0,1|2,0,0]=4 5928 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 2708a_100000756042_106832991635 [0,1,0,0,0,1|0,0,0]=2 5929 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 2708a_100102657272_100000756042 [0,1,0,0,0,1|0,0,0]=2 5930 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 273464a_100000756042_100102657272 [0,1,0,0,0,1|0,0,0]=2 5931 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 273464a_100102657272_100000756042 [0,1,0,0,0,1|0,0,0]=2 5932 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 512a_100000756042_100102657272 [0,1,0,0,0,1|0,0,0]=2 5933 B16R1.4708 CNC(=O)NCCc1ccc(c(c1)OC)O 512a_106832991638_100000756042 [0,1,0,0,0,1|0,0,0]=2 5934 B16R1.4708 CNc1cc(ccc1C)SCCC(=O)OC 62a_100000204255_100020629602 [0,1,0,0,0,1|2,0,0]=4 5935 B16R1.4708 CNc1cc(ccc1C)SCCC(=O)OC 62a_100020629602_100000204255 [0,1,0,0,0,1|2,0,0]=4 5936 B16R1.4708 CNc1cc(ccc1F)SCCC(=O)OC 62a_100000204255_100011314990 [0,1,0,0,0,1|2,0,0]=4 5937 B16R1.4708 CNc1cc(ccc1F)SCCC(=O)OC 62a_100011314990_100000204255 [0,1,0,0,0,1|2,0,0]=4 5938 B16R1.4708 CNc1cc(ccc1N)SCCC(=O)OC 62a_100000694363_100000204255 [0,1,0,0,0,1|2,0,0]=4 5939 B16R1.4708 COC(=O)CCNc1ccc(c(c1)C#N)O 34a_100011249283_100000742370 [0,1,0,0,0,1|2,0,0]=4 5940 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000204255 [0,1,0,0,0,1|1,0,0]=3 5941 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000742370 [0,1,0,0,0,1|1,0,0]=3 5942 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000204255 [0,1,0,0,0,1|1,0,0]=3 5943 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)C 34a_100011279678_100000742370 [0,1,0,0,0,1|1,0,0]=3 5944 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000204255 [0,1,0,0,0,1|1,0,0]=3 5945 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000742370 [0,1,0,0,0,1|1,0,0]=3 5946 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000204255 [0,1,0,0,0,1|1,0,0]=3 5947 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)F 34a_100000701188_100000742370 [0,1,0,0,0,1|1,0,0]=3 5948 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)I 34a_100000746945_100000742370 [0,1,0,0,0,1|1,0,0]=3 5949 B16R1.4708 COC(=O)CCNc1ccc(c(c1)OC)O 34a_100000726020_100000742370 [0,1,0,0,0,1|0,0,0]=2 5950 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000742370 [0,1,0,0,0,1|1,0,0]=3 5951 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000204255 [0,1,0,0,0,1|1,0,0]=3 5952 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)C 34a_100009865632_100000742370 [0,1,0,0,0,1|1,0,0]=3 5953 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)C 7a_100009865632_100000204255 [0,1,0,0,0,1|1,0,0]=3 5954 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000742370 [0,1,0,0,0,1|1,0,0]=3 5955 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000204255 [0,1,0,0,0,1|1,0,0]=3 5956 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)F 34a_100012001760_100000742370 [0,1,0,0,0,1|1,0,0]=3 5957 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)F 7a_100012001760_100000204255 [0,1,0,0,0,1|1,0,0]=3 5958 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)N 34a_100015326901_100000742370 [0,1,0,0,0,1|1,0,0]=3 5959 B16R1.4708 COC(=O)CCOc1ccc(c(c1)OC)N 7a_100015326901_100000204255 [0,1,0,0,0,1|1,0,0]=3 5960 B16R1.4708 COC(=O)CCSc1c[nH]c(=O)c(c1)OC 62a_100000204255_100010125397 [0,1,0,0,0,1|1,0,1]=4 5961 B16R1.4708 COC(=O)CCSc1cc(c(cn1)C)OC 62a_100000204255_100010067687 [0,1,0,0,0,1|2,0,0]=4 5962 B16R1.4708 COC(=O)CCSc1cc(c(cn1)C)OC 62a_100010067687_100000204255 [0,1,0,0,0,1|2,0,0]=4 5963 B16R1.4708 COC(=O)CCSc1cc(c(cn1)F)OC 62a_100000204255_200010136270 [0,1,0,0,0,1|2,0,0]=4 5964 B16R1.4708 COC(=O)CCSc1cc(c(cn1)F)OC 62a_200010136270_100000204255 [0,1,0,0,0,1|2,0,0]=4 5965 B16R1.4708 COC(=O)CCSc1cc(c(cn1)N)OC 62a_100000204255_100009887741 [0,1,0,0,0,1|2,0,0]=4 5966 B16R1.4708 COC(=O)CCSc1cc(c(cn1)N)OC 62a_100009887741_100000204255 [0,1,0,0,0,1|2,0,0]=4 5967 B16R1.4708 COC(=O)CCSc1ccc(c(c1)C#N)O 62a_100000204255_100000687585 [0,1,0,0,0,1|2,0,0]=4 5968 B16R1.4708 COC(=O)CCSc1ccc(c(c1)C=O)O 62a_100000204255_100000186750 [0,1,0,0,0,1|2,0,0]=4 5969 B16R1.4708 COC(=O)CCSc1ccc(c(c1)CN)O 62a_100000204255_100000730032 [0,1,0,0,0,1|2,0,0]=4 5970 B16R1.4708 COC(=O)CCSc1ccc(c(c1)CN)O 62a_100000730032_100000204255 [0,1,0,0,0,1|2,0,0]=4 5971 B16R1.4708 COC(=O)CCSc1ccc(c(c1)CO)O 62a_100000184703_100000204255 [0,1,0,0,0,1|2,0,0]=4 5972 B16R1.4708 COC(=O)CCSc1ccc(c(c1)CO)O 62a_100000204255_100000184703 [0,1,0,0,0,1|2,0,0]=4 5973 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)Br 62a_100000204255_100012353699 [0,1,0,0,0,1|1,0,0]=3 5974 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000204255 [0,1,0,0,0,1|1,0,0]=3 5975 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)C 62a_100000204255_100011830276 [0,1,0,0,0,1|1,0,0]=3 5976 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)C 62a_100011830276_100000204255 [0,1,0,0,0,1|1,0,0]=3 5977 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)Cl 62a_100000204255_100011356853 [0,1,0,0,0,1|1,0,0]=3 5978 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000204255 [0,1,0,0,0,1|1,0,0]=3 5979 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)F 62a_100000204255_100011934186 [0,1,0,0,0,1|1,0,0]=3 5980 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)F 62a_100011934186_100000204255 [0,1,0,0,0,1|1,0,0]=3 5981 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)N 62a_100000204255_100015196925 [0,1,0,0,0,1|1,0,0]=3 5982 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)N 62a_100011279103_100000204255 [0,1,0,0,0,1|1,0,0]=3 5983 B16R1.4708 COC(=O)CCSc1ccc(c(c1)OC)O 62a_100000204255_100000694246 [0,1,0,0,0,1|0,0,0]=2 5984 B16R1.4708 COC(=O)CCSc1ccc(c(c1)SC)F 62a_100000204255_100010341305 [0,1,0,0,0,1|1,1,0]=4 5985 B16R1.4708 COC(=O)CCSc1ccc(c(c1)SC)F 62a_100010341305_100000204255 [0,1,0,0,0,1|1,1,0]=4 5986 B16R1.4708 COC(=O)CCSc1ccc(c(n1)OC)N 62a_100000204255_100000687816 [0,1,0,0,0,1|2,0,0]=4 5987 B16R1.4708 COC(=O)CCSc1ccc(c(n1)OC)N 62a_100000687816_100000204255 [0,1,0,0,0,1|2,0,0]=4 5988 B16R1.4708 COC(=O)CCSc1ccc(c(n1)OC)O 62a_100000204255_100010893133 [0,1,0,0,0,1|1,0,0]=3 5989 B16R1.4708 COC(=O)CCSc1cnc(c(c1)OC)C 62a_100000204255_100010254219 [0,1,0,0,0,1|2,0,0]=4 5990 B16R1.4708 COC(=O)CCSc1cnc(c(c1)OC)C 62a_100010254219_100000204255 [0,1,0,0,0,1|2,0,0]=4 5991 B16R1.4708 COC(=O)CCSc1cnc(c(c1)OC)F 62a_100000204255_100010214931 [0,1,0,0,0,1|2,0,0]=4 5992 B16R1.4708 COC(=O)CCSc1cnc(c(c1)OC)F 62a_100010214931_100000204255 [0,1,0,0,0,1|2,0,0]=4 5993 B16R1.4708 COC(=O)CCSc1cnc(c(c1)OC)N 62a_100000204255_106354213024 [0,1,0,0,0,1|2,0,0]=4 5994 B16R1.4708 COC(=O)CCSc1cnc(c(c1)OC)N 62a_106354213024_100000204255 [0,1,0,0,0,1|2,0,0]=4 5995 B16R1.4708 COC(=O)CCSc1cnc(c(n1)OC)O 62a_100000204255_200010365344 [0,1,0,0,0,1|2,0,0]=4 5996 B16R1.4708 COC(=O)CCSc1cnc(c(n1)OC)O 62a_200010365344_100000204255 [0,1,0,0,0,1|2,0,0]=4 5997 B16R1.4708 COC(=O)CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000747449 [0,1,0,0,0,1|1,0,0]=3 5998 B16R1.4708 COC(=O)CNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000747449 [0,1,0,0,0,1|1,0,0]=3 5999 B16R1.4708 COC(=O)CNCc1ccc(c(c1)OC)F 2230a_100020626639_100000747449 [0,1,0,0,0,1|1,0,0]=3 6000 B16R1.4708 COC(=O)CNCc1ccc(c(c1)OC)F 34a_100020626639_100000747449 [0,1,0,0,0,1|1,0,0]=3 6001 B16R1.4708 COC(=O)CNCc1ccc(c(c1)OC)O 34a_100000185554_100000747449 [0,1,0,0,0,1|0,0,0]=2 6002 B16R1.4708 COC(=O)COCc1cc(c(cn1)Br)OC 34a_100010999569_100000747449 [0,1,0,0,0,1|2,0,0]=4 6003 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)Br 34a_100010234685_100000747449 [0,1,0,0,0,1|1,0,0]=3 6004 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)Br 7a_100010234685_100000747449 [0,1,0,0,0,1|1,0,0]=3 6005 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)C 34a_100000752651_100000747449 [0,1,0,0,0,1|1,0,0]=3 6006 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)C 7a_100000752651_100000747449 [0,1,0,0,0,1|1,0,0]=3 6007 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)Cl 34a_100012179228_100000747449 [0,1,0,0,0,1|1,0,0]=3 6008 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)F 34a_100000692429_100000747449 [0,1,0,0,0,1|1,0,0]=3 6009 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)F 7a_100000692429_100000747449 [0,1,0,0,0,1|1,0,0]=3 6010 B16R1.4708 COC(=O)COCc1ccc(c(c1)OC)N 34a_100000087641_100000747449 [0,1,0,0,0,1|1,0,0]=3 6011 B16R1.4708 COC(=O)CSCc1ccc(c(c1)C=O)O 62a_100000747449_100000008128 [0,1,0,0,0,1|2,0,0]=4 6012 B16R1.4708 COC(=O)CSCc1ccc(c(c1)OC)Br 62a_100000747449_100010110085 [0,1,0,0,0,1|1,0,0]=3 6013 B16R1.4708 COC(=O)CSCc1ccc(c(c1)OC)Br 62a_100010110085_100000747449 [0,1,0,0,0,1|1,0,0]=3 6014 B16R1.4708 COC(=O)CSCc1ccc(c(c1)OC)Cl 62a_100000747449_200010214485 [0,1,0,0,0,1|1,0,0]=3 6015 B16R1.4708 COC(=O)CSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000747449 [0,1,0,0,0,1|1,0,0]=3 6016 B16R1.4708 COC(=O)CSCc1ccc(c(c1)OC)F 62a_100000747449_100012349856 [0,1,0,0,0,1|1,0,0]=3 6017 B16R1.4708 COC(=O)CSCc1ccc(c(c1)OC)F 62a_100012349856_100000747449 [0,1,0,0,0,1|1,0,0]=3 6018 B16R1.4708 COC(=O)CSCc1ccc(c(n1)OC)Br 62a_100000747449_200010066506 [0,1,0,0,0,1|2,0,0]=4 6019 B16R1.4708 COC(=O)CSCc1ccc(c(n1)OC)Br 62a_200010066506_100000747449 [0,1,0,0,0,1|2,0,0]=4 6020 B16R1.4708 COC(=O)OCSc1ccc(c(c1)OC)Br 62a_100012353699_100000139417 [0,1,0,0,0,1|2,0,0]=4 6021 B16R1.4708 COC(=O)OCSc1ccc(c(c1)OC)C 62a_100011830276_100000139417 [0,1,0,0,0,1|2,0,0]=4 6022 B16R1.4708 COC(=O)OCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000139417 [0,1,0,0,0,1|2,0,0]=4 6023 B16R1.4708 COC(=O)OCSc1ccc(c(c1)OC)F 62a_100011934186_100000139417 [0,1,0,0,0,1|2,0,0]=4 6024 B16R1.4708 COC(=O)OCSc1ccc(c(c1)OC)N 62a_100011279103_100000139417 [0,1,0,0,0,1|2,0,0]=4 6025 B16R1.4708 COc1cc(ccc1O)CCNC(=O)CO 240690a_100000756042_100000210174 [0,1,0,0,0,1|0,0,0]=2 6026 B16R1.4708 COc1cc(ccc1O)CCNC(=O)CO 527a_100000756042_100000210174 [0,1,0,0,0,1|0,0,0]=2 6027 B16R1.4708 COc1cc(ccc1O)CCNC(C)C#N 2230a_100000737613_100010741665 [0,1,0,0,0,1|1,0,1]=4 6028 B16R1.4708 COc1cc(ccc1O)CCNC(C)CO 34a_100000756042_100012180447 [0,1,0,0,0,1|0,0,2]=4 6029 B16R1.4708 COc1cc(ccc1O)CCN[C@H](C)CO 2230a_100000737577_100010741665 [0,1,0,0,0,1|0,0,2]=4 6030 B16R1.4708 COc1cc(ccc1O)CCOC(C)CF 7a_100016041109_100010741665 [0,1,0,0,0,1|1,0,1]=4 6031 B16R1.4708 COc1cc(ccc1O)CCSC(C)C#N 62a_100000703298_100010741665 [0,1,0,0,0,1|1,0,1]=4 6032 B16R1.4708 COc1cc(ccc1O)CCSC(C)CO 62a_100012180447_100010741665 [0,1,0,0,0,1|0,0,2]=4 6033 B16R1.4708 COc1cc(ccc1O)CCSC(C)OC 62a_100009879195_100010741665 [0,1,0,0,0,1|0,0,2]=4 6034 B16R1.4708 COc1cc(ccc1O)CCS[C@H](C)CO 62a_100016084084_100010741665 [0,1,0,0,0,1|0,0,2]=4 6035 B16R1.4708 COc1cc(ccc1O)CNCC(O)CO 34a_100000185554_100011219619 [0,1,0,0,0,1|0,0,2]=4 6036 B16R1.4708 COc1cc(ccc1O)CNC[C@@H](C)CO 34a_100000185554_100000059175 [0,1,0,0,0,1|0,0,2]=4 6037 B16R1.4708 COc1cc(ccc1O)CNC[C@@H](O)CF 34a_100000185554_100015614560 [0,1,0,0,0,1|0,0,2]=4 6038 B16R1.4708 COc1cc(ccc1O)CNC[C@@H](O)CO 34a_100000185554_100009815848 [0,1,0,0,0,1|0,0,2]=4 6039 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000730704 [0,1,0,0,0,1|2,0,0]=4 6040 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000730704 [0,1,0,0,0,1|2,0,0]=4 6041 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000730704 [0,1,0,0,0,1|2,0,0]=4 6042 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000730704 [0,1,0,0,0,1|2,0,0]=4 6043 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000730704 [0,1,0,0,0,1|2,0,0]=4 6044 B16R1.4709 C=C(C)CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000730704 [0,1,0,0,0,1|1,0,0]=3 6045 B16R1.4709 C=C(C)CCN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000730704 [0,1,0,0,0,1|2,0,0]=4 6046 B16R1.4709 C=C(C)CCN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000730704 [0,1,0,0,0,1|2,0,0]=4 6047 B16R1.4709 C=C(C)CCN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000730704 [0,1,0,0,0,1|2,0,0]=4 6048 B16R1.4709 C=C(C)CCN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000730704 [0,1,0,0,0,1|2,0,0]=4 6049 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 6050 B16R1.4709 C=C(C)CN[C@@H](C)c1ccc(c(c1)OC)F 2230a_100025717271_100000748629 [0,1,0,0,0,1|2,0,0]=4 6051 B16R1.4709 C=C(C)CN[C@@H](C)c1ccc(c(c1)OC)F 34a_100025717271_100000748629 [0,1,0,0,0,1|2,0,0]=4 6052 B16R1.4709 COc1cc(ccc1F)N(C)CCC(=O)C 269982a_200012002703_100000053229 [0,1,0,0,0,1|1,0,0]=3 6053 B16R1.4709 COc1cc(ccc1F)N(C)CCC(=O)N 2230a_200012002703_100000744528 [0,1,0,0,0,1|2,0,0]=4 6054 B16R1.4709 COc1cc(ccc1F)N(C)CCC(=O)N 269982a_200012002703_100000744528 [0,1,0,0,0,1|2,0,0]=4 6055 B16R1.4709 COc1cc(ccc1F)N(C)CCC(=O)N 34a_200012002703_100000731001 [0,1,0,0,0,1|2,0,0]=4 6056 B16R1.4709 COc1cc(ccc1F)N(C)COC(=O)C 269982a_200012002703_100000076356 [0,1,0,0,0,1|2,0,0]=4 6057 B16R1.4709 COc1cc(ccc1F)N(C)COC(=O)C 34a_200012002703_100009813279 [0,1,0,0,0,1|2,0,0]=4 6058 B16R1.4709 COc1cc(ccc1F)[C@H](C)NCC(=O)N 2230a_100025717271_100000747473 [0,1,0,0,0,1|2,0,0]=4 6059 B16R1.4709 COc1cc(ccc1F)[C@H](C)NCC(=O)N 34a_100025717271_100000187820 [0,1,0,0,0,1|2,0,0]=4 6060 B16R1.4709 COc1cc(ccc1F)[C@H](C)NCC(=O)[O-] 34a_100025717271_100020667443 [0,1,0,0,0,1|2,0,0]=4 6061 B16R1.4709 COc1cc(ccc1O)C(=NNC(=O)C)C 4a_100000189765_100000186468 [0,1,0,0,0,1|1,0,1]=4 6062 B16R1.4709 COc1cc(ccc1O)C(=O)CC=C(C)C 1458a_100000687070_100000761012 [0,1,0,0,0,1|1,0,1]=4 6063 B16R1.4709 COc1cc(ccc1O)C(=O)CCC(C)C 1458a_100000687070_100000210312 [0,1,0,0,0,1|1,0,1]=4 6064 B16R1.4709 COc1cc(ccc1O)C(=O)CCC(C)O 1458a_100000687070_100012276601 [0,1,0,0,0,1|0,0,2]=4 6065 B16R1.4709 COc1cc(ccc1O)C(=O)NCC(=O)N 240690a_100000711301_100000687070 [0,1,0,0,0,1|1,0,1]=4 6066 B16R1.4709 COc1cc(ccc1O)C(=O)NNC(=O)C 22a_100000189765_100000687070 [0,1,0,0,0,1|1,0,1]=4 6067 B16R1.4710 C=C(C)C(=O)CCc1ccc(c(c1)OC)O 1458a_100000185857_100010741665 [0,1,0,0,0,1|1,0,0]=3 6068 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 6069 B16R1.4710 C=C(C)C(C)NCc1ccc(c(c1)OC)Cl 269862a_100015204853_100011216138 [0,1,0,0,0,1|2,0,0]=4 6070 B16R1.4710 C=C(C)C(C)NCc1ccc(c(c1)OC)F 269862a_100020626639_100011216138 [0,1,0,0,0,1|2,0,0]=4 6071 B16R1.4710 CC(=O)C(C)SCc1ccc(c(c1)C=O)O 62a_100009814033_100000008128 [0,1,0,0,0,1|2,0,0]=4 6072 B16R1.4710 CCc1cc(ccc1F)CNC(C)C(=O)C 2230a_114873767189_100009814033 [0,1,0,0,0,1|2,0,0]=4 6073 B16R1.4710 CCc1cc(ccc1O)SCC(=O)C(=O)C 62a_100011261029_100012338938 [0,1,0,0,0,1|1,0,1]=4 6074 B16R1.4710 COc1cc(ccc1Br)CN[C@@H](C)C(=O)O 269956a_100000743915_100010110085 [0,1,0,0,0,1|2,0,0]=4 6075 B16R1.4710 COc1cc(ccc1Br)CN[C@H](C)C(=O)N 2230a_100000119354_100010110085 [0,1,0,0,0,1|2,0,0]=4 6076 B16R1.4710 COc1cc(ccc1Br)CN[C@H](C)C(=O)N 270004a_100000119354_100010244714 [0,1,0,0,0,1|2,0,0]=4 6077 B16R1.4710 COc1cc(ccc1Br)CN[C@H](C)C(=O)N 34a_100000119354_100010110085 [0,1,0,0,0,1|2,0,0]=4 6078 B16R1.4710 COc1cc(ccc1Br)COC(C)C(=O)C 34a_100000212229_100010110085 [0,1,0,0,0,1|1,0,0]=3 6079 B16R1.4710 COc1cc(ccc1Br)COC(C)C(=O)C 7a_100010234685_100000179758 [0,1,0,0,0,1|1,0,0]=3 6080 B16R1.4710 COc1cc(ccc1Br)COC(C)C(=O)N 34a_100010234685_100000702099 [0,1,0,0,0,1|2,0,0]=4 6081 B16R1.4710 COc1cc(ccc1Br)COC(C)C(=O)N 7a_100010234685_100000702099 [0,1,0,0,0,1|2,0,0]=4 6082 B16R1.4710 COc1cc(ccc1Br)COC(F)C(=O)N 34a_100010234685_100009813875 [0,1,0,0,0,1|2,0,0]=4 6083 B16R1.4710 COc1cc(ccc1Br)COC(F)C(=O)N 7a_100010234685_100009813875 [0,1,0,0,0,1|2,0,0]=4 6084 B16R1.4710 COc1cc(ccc1Br)COC(F)C(=O)[O-] 34a_100010234685_100020610796 [0,1,0,0,0,1|2,0,0]=4 6085 B16R1.4710 COc1cc(ccc1Br)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100010110085 [0,1,0,0,0,1|2,0,0]=4 6086 B16R1.4710 COc1cc(ccc1Br)CO[C@H](C)C(=O)N 34a_100000731257_100010110085 [0,1,0,0,0,1|2,0,0]=4 6087 B16R1.4710 COc1cc(ccc1Br)CO[C@H](C)C(=O)N 7a_100000731257_100010110085 [0,1,0,0,0,1|2,0,0]=4 6088 B16R1.4710 COc1cc(ccc1Br)CSC(C)C(=O)C 62a_100009814033_100010110085 [0,1,0,0,0,1|1,0,0]=3 6089 B16R1.4710 COc1cc(ccc1Br)CSC(C)C(=O)C 62a_100010110085_100009814033 [0,1,0,0,0,1|1,0,0]=3 6090 B16R1.4710 COc1cc(ccc1Br)CSC(C)C(=O)N 62a_100000702099_100010110085 [0,1,0,0,0,1|2,0,0]=4 6091 B16R1.4710 COc1cc(ccc1Br)CSC(C)C(=O)N 62a_100010110085_100000702099 [0,1,0,0,0,1|2,0,0]=4 6092 B16R1.4710 COc1cc(ccc1Br)CSC(F)C(=O)N 62a_100009813875_100010110085 [0,1,0,0,0,1|2,0,0]=4 6093 B16R1.4710 COc1cc(ccc1Br)CSC(F)C(=O)N 62a_100010110085_100009813875 [0,1,0,0,0,1|2,0,0]=4 6094 B16R1.4710 COc1cc(ccc1Br)CSC(F)C(=O)[O-] 62a_100010110085_100020610796 [0,1,0,0,0,1|2,0,0]=4 6095 B16R1.4710 COc1cc(ccc1Br)CSC(F)C(=O)[O-] 62a_100020610796_100010110085 [0,1,0,0,0,1|2,0,0]=4 6096 B16R1.4710 COc1cc(ccc1Br)NCC(=O)C(=O)C 34a_100000765947_100011261029 [0,1,0,0,0,1|1,0,1]=4 6097 B16R1.4710 COc1cc(ccc1Br)OCC(=O)C(=O)C 34a_100011827694_100011261029 [0,1,0,0,0,1|1,0,1]=4 6098 B16R1.4710 COc1cc(ccc1Br)SCC(=O)C(=O)C 62a_100011261029_100012353699 [0,1,0,0,0,1|1,0,1]=4 6099 B16R1.4710 COc1cc(ccc1Br)SCC(=O)C(=O)C 62a_100012353699_100011261029 [0,1,0,0,0,1|1,0,1]=4 6100 B16R1.4710 COc1cc(ccc1C)CN[C@H](C)C(=O)N 270004a_100000119354_100000719150 [0,1,0,0,0,1|2,0,0]=4 6101 B16R1.4710 COc1cc(ccc1C)COC(C)C(=O)C 7a_100000752651_100000179758 [0,1,0,0,0,1|1,0,0]=3 6102 B16R1.4710 COc1cc(ccc1C)COC(C)C(=O)N 34a_100000752651_100000702099 [0,1,0,0,0,1|2,0,0]=4 6103 B16R1.4710 COc1cc(ccc1C)COC(C)C(=O)N 7a_100000752651_100000702099 [0,1,0,0,0,1|2,0,0]=4 6104 B16R1.4710 COc1cc(ccc1C)COC(F)C(=O)N 34a_100000752651_100009813875 [0,1,0,0,0,1|2,0,0]=4 6105 B16R1.4710 COc1cc(ccc1C)COC(F)C(=O)N 7a_100000752651_100009813875 [0,1,0,0,0,1|2,0,0]=4 6106 B16R1.4710 COc1cc(ccc1C)COC(F)C(=O)[O-] 34a_100000752651_100020610796 [0,1,0,0,0,1|2,0,0]=4 6107 B16R1.4710 COc1cc(ccc1C)NCC(=O)C(=O)C 34a_100011279678_100011261029 [0,1,0,0,0,1|1,0,1]=4 6108 B16R1.4710 COc1cc(ccc1C)OCC(=O)C(=O)C 34a_100009865632_100011261029 [0,1,0,0,0,1|1,0,1]=4 6109 B16R1.4710 COc1cc(ccc1C)SCC(=O)C(=O)C 62a_100011261029_100011830276 [0,1,0,0,0,1|1,0,1]=4 6110 B16R1.4710 COc1cc(ccc1C)SCC(=O)C(=O)C 62a_100011830276_100011261029 [0,1,0,0,0,1|1,0,1]=4 6111 B16R1.4710 COc1cc(ccc1Cl)CNC(C)C(=O)C 2230a_100015204853_100009814033 [0,1,0,0,0,1|1,0,0]=3 6112 B16R1.4710 COc1cc(ccc1Cl)CNC(C)C(=O)N 2230a_100015204853_100000702099 [0,1,0,0,0,1|2,0,0]=4 6113 B16R1.4710 COc1cc(ccc1Cl)CNC(C)C(=O)N 34a_100015204853_100000702099 [0,1,0,0,0,1|2,0,0]=4 6114 B16R1.4710 COc1cc(ccc1Cl)CNC(F)C(=O)N 2230a_100015204853_100009813875 [0,1,0,0,0,1|2,0,0]=4 6115 B16R1.4710 COc1cc(ccc1Cl)CNC(F)C(=O)N 34a_100015204853_100009813875 [0,1,0,0,0,1|2,0,0]=4 6116 B16R1.4710 COc1cc(ccc1Cl)CNC(F)C(=O)[O-] 34a_100015204853_100020610796 [0,1,0,0,0,1|2,0,0]=4 6117 B16R1.4710 COc1cc(ccc1Cl)CN[C@@H](C)C(=O)O 269956a_100000743915_200010214485 [0,1,0,0,0,1|2,0,0]=4 6118 B16R1.4710 COc1cc(ccc1Cl)CN[C@H](C)C(=O)N 2230a_100000119354_200010214485 [0,1,0,0,0,1|2,0,0]=4 6119 B16R1.4710 COc1cc(ccc1Cl)CN[C@H](C)C(=O)N 270004a_100000119354_100011998524 [0,1,0,0,0,1|2,0,0]=4 6120 B16R1.4710 COc1cc(ccc1Cl)CN[C@H](C)C(=O)N 34a_100000119354_200010214485 [0,1,0,0,0,1|2,0,0]=4 6121 B16R1.4710 COc1cc(ccc1Cl)COC(C)C(=O)C 34a_100000212229_200010214485 [0,1,0,0,0,1|1,0,0]=3 6122 B16R1.4710 COc1cc(ccc1Cl)COC(C)C(=O)N 34a_100012179228_100000702099 [0,1,0,0,0,1|2,0,0]=4 6123 B16R1.4710 COc1cc(ccc1Cl)COC(F)C(=O)N 34a_100012179228_100009813875 [0,1,0,0,0,1|2,0,0]=4 6124 B16R1.4710 COc1cc(ccc1Cl)COC(F)C(=O)[O-] 34a_100012179228_100020610796 [0,1,0,0,0,1|2,0,0]=4 6125 B16R1.4710 COc1cc(ccc1Cl)CO[C@@H](C)C(=O)[O-] 7a_217856618621_200010214485 [0,1,0,0,0,1|2,0,0]=4 6126 B16R1.4710 COc1cc(ccc1Cl)CO[C@H](C)C(=O)N 34a_100000731257_200010214485 [0,1,0,0,0,1|2,0,0]=4 6127 B16R1.4710 COc1cc(ccc1Cl)CO[C@H](C)C(=O)N 7a_100000731257_200010214485 [0,1,0,0,0,1|2,0,0]=4 6128 B16R1.4710 COc1cc(ccc1Cl)CSC(C)C(=O)C 62a_100009814033_200010214485 [0,1,0,0,0,1|1,0,0]=3 6129 B16R1.4710 COc1cc(ccc1Cl)CSC(C)C(=O)C 62a_200010214485_100009814033 [0,1,0,0,0,1|1,0,0]=3 6130 B16R1.4710 COc1cc(ccc1Cl)CSC(C)C(=O)N 62a_100000702099_200010214485 [0,1,0,0,0,1|2,0,0]=4 6131 B16R1.4710 COc1cc(ccc1Cl)CSC(C)C(=O)N 62a_200010214485_100000702099 [0,1,0,0,0,1|2,0,0]=4 6132 B16R1.4710 COc1cc(ccc1Cl)CSC(F)C(=O)N 62a_100009813875_200010214485 [0,1,0,0,0,1|2,0,0]=4 6133 B16R1.4710 COc1cc(ccc1Cl)CSC(F)C(=O)N 62a_200010214485_100009813875 [0,1,0,0,0,1|2,0,0]=4 6134 B16R1.4710 COc1cc(ccc1Cl)CSC(F)C(=O)[O-] 62a_100020610796_200010214485 [0,1,0,0,0,1|2,0,0]=4 6135 B16R1.4710 COc1cc(ccc1Cl)CSC(F)C(=O)[O-] 62a_200010214485_100020610796 [0,1,0,0,0,1|2,0,0]=4 6136 B16R1.4710 COc1cc(ccc1Cl)NCC(=O)C(=O)C 34a_100000742311_100011261029 [0,1,0,0,0,1|1,0,1]=4 6137 B16R1.4710 COc1cc(ccc1Cl)OCC(=O)C(=O)C 34a_100012186310_100011261029 [0,1,0,0,0,1|1,0,1]=4 6138 B16R1.4710 COc1cc(ccc1Cl)SCC(=O)C(=O)C 62a_100011261029_100011356853 [0,1,0,0,0,1|1,0,1]=4 6139 B16R1.4710 COc1cc(ccc1Cl)SCC(=O)C(=O)C 62a_100011356853_100011261029 [0,1,0,0,0,1|1,0,1]=4 6140 B16R1.4710 COc1cc(ccc1F)CNC(C)C(=O)C 2230a_100020626639_100009814033 [0,1,0,0,0,1|1,0,0]=3 6141 B16R1.4710 COc1cc(ccc1F)CNC(C)C(=O)N 2230a_100020626639_100000702099 [0,1,0,0,0,1|2,0,0]=4 6142 B16R1.4710 COc1cc(ccc1F)CNC(C)C(=O)N 34a_100020626639_100000702099 [0,1,0,0,0,1|2,0,0]=4 6143 B16R1.4710 COc1cc(ccc1F)CNC(F)C(=O)N 2230a_100020626639_100009813875 [0,1,0,0,0,1|2,0,0]=4 6144 B16R1.4710 COc1cc(ccc1F)CNC(F)C(=O)N 34a_100020626639_100009813875 [0,1,0,0,0,1|2,0,0]=4 6145 B16R1.4710 COc1cc(ccc1F)CNC(F)C(=O)[O-] 34a_100020626639_100020610796 [0,1,0,0,0,1|2,0,0]=4 6146 B16R1.4710 COc1cc(ccc1F)CN[C@@H](C)C(=O)O 269956a_100000743915_100012349856 [0,1,0,0,0,1|2,0,0]=4 6147 B16R1.4710 COc1cc(ccc1F)CN[C@H](C)C(=O)N 2230a_100000119354_100012349856 [0,1,0,0,0,1|2,0,0]=4 6148 B16R1.4710 COc1cc(ccc1F)CN[C@H](C)C(=O)N 270004a_100000119354_100000692873 [0,1,0,0,0,1|2,0,0]=4 6149 B16R1.4710 COc1cc(ccc1F)CN[C@H](C)C(=O)N 34a_100000119354_100012349856 [0,1,0,0,0,1|2,0,0]=4 6150 B16R1.4710 COc1cc(ccc1F)COC(C)C(=O)C 34a_100000212229_100012349856 [0,1,0,0,0,1|1,0,0]=3 6151 B16R1.4710 COc1cc(ccc1F)COC(C)C(=O)C 7a_100000692429_100000179758 [0,1,0,0,0,1|1,0,0]=3 6152 B16R1.4710 COc1cc(ccc1F)COC(C)C(=O)N 34a_100000692429_100000702099 [0,1,0,0,0,1|2,0,0]=4 6153 B16R1.4710 COc1cc(ccc1F)COC(C)C(=O)N 7a_100000692429_100000702099 [0,1,0,0,0,1|2,0,0]=4 6154 B16R1.4710 COc1cc(ccc1F)COC(F)C(=O)N 34a_100000692429_100009813875 [0,1,0,0,0,1|2,0,0]=4 6155 B16R1.4710 COc1cc(ccc1F)COC(F)C(=O)N 7a_100000692429_100009813875 [0,1,0,0,0,1|2,0,0]=4 6156 B16R1.4710 COc1cc(ccc1F)COC(F)C(=O)[O-] 34a_100000692429_100020610796 [0,1,0,0,0,1|2,0,0]=4 6157 B16R1.4710 COc1cc(ccc1F)CO[C@@H](C)C(=O)[O-] 7a_217856618621_100012349856 [0,1,0,0,0,1|2,0,0]=4 6158 B16R1.4710 COc1cc(ccc1F)CO[C@H](C)C(=O)N 34a_100000731257_100012349856 [0,1,0,0,0,1|2,0,0]=4 6159 B16R1.4710 COc1cc(ccc1F)CO[C@H](C)C(=O)N 7a_100000731257_100012349856 [0,1,0,0,0,1|2,0,0]=4 6160 B16R1.4710 COc1cc(ccc1F)CSC(C)C(=O)C 62a_100009814033_100012349856 [0,1,0,0,0,1|1,0,0]=3 6161 B16R1.4710 COc1cc(ccc1F)CSC(C)C(=O)C 62a_100012349856_100009814033 [0,1,0,0,0,1|1,0,0]=3 6162 B16R1.4710 COc1cc(ccc1F)CSC(C)C(=O)N 62a_100000702099_100012349856 [0,1,0,0,0,1|2,0,0]=4 6163 B16R1.4710 COc1cc(ccc1F)CSC(C)C(=O)N 62a_100012349856_100000702099 [0,1,0,0,0,1|2,0,0]=4 6164 B16R1.4710 COc1cc(ccc1F)CSC(F)C(=O)N 62a_100009813875_100012349856 [0,1,0,0,0,1|2,0,0]=4 6165 B16R1.4710 COc1cc(ccc1F)CSC(F)C(=O)N 62a_100012349856_100009813875 [0,1,0,0,0,1|2,0,0]=4 6166 B16R1.4710 COc1cc(ccc1F)CSC(F)C(=O)[O-] 62a_100012349856_100020610796 [0,1,0,0,0,1|2,0,0]=4 6167 B16R1.4710 COc1cc(ccc1F)CSC(F)C(=O)[O-] 62a_100020610796_100012349856 [0,1,0,0,0,1|2,0,0]=4 6168 B16R1.4710 COc1cc(ccc1F)NCC(=O)C(=O)C 34a_100000701188_100011261029 [0,1,0,0,0,1|1,0,1]=4 6169 B16R1.4710 COc1cc(ccc1F)OCC(=O)C(=O)C 34a_100012001760_100011261029 [0,1,0,0,0,1|1,0,1]=4 6170 B16R1.4710 COc1cc(ccc1F)SCC(=O)C(=O)C 62a_100011261029_100011934186 [0,1,0,0,0,1|1,0,1]=4 6171 B16R1.4710 COc1cc(ccc1F)SCC(=O)C(=O)C 62a_100011934186_100011261029 [0,1,0,0,0,1|1,0,1]=4 6172 B16R1.4710 COc1cc(ccc1I)NCC(=O)C(=O)C 34a_100000746945_100011261029 [0,1,0,0,0,1|1,0,1]=4 6173 B16R1.4710 COc1cc(ccc1N)COC(C)C(=O)N 34a_100000087641_100000702099 [0,1,0,0,0,1|2,0,0]=4 6174 B16R1.4710 COc1cc(ccc1N)COC(F)C(=O)N 34a_100000087641_100009813875 [0,1,0,0,0,1|2,0,0]=4 6175 B16R1.4710 COc1cc(ccc1N)COC(F)C(=O)[O-] 34a_100000087641_100020610796 [0,1,0,0,0,1|2,0,0]=4 6176 B16R1.4710 COc1cc(ccc1N)OCC(=O)C(=O)C 34a_100015326901_100011261029 [0,1,0,0,0,1|1,0,1]=4 6177 B16R1.4710 COc1cc(ccc1N)SCC(=O)C(=O)C 62a_100011261029_100015196925 [0,1,0,0,0,1|1,0,1]=4 6178 B16R1.4710 COc1cc(ccc1N)SCC(=O)C(=O)C 62a_100011279103_100011261029 [0,1,0,0,0,1|1,0,1]=4 6179 B16R1.4710 COc1cc(ccc1O)CCC(=O)C(C)C 1458a_100000210198_100010741665 [0,1,0,0,0,1|1,0,1]=4 6180 B16R1.4710 COc1cc(ccc1O)CCC(=O)C(C)C 1458a_100011216321_100000210206 [0,1,0,0,0,1|1,0,1]=4 6181 B16R1.4710 COc1cc(ccc1O)CCC(=O)C(C)F 1458a_100000062450_100010741665 [0,1,0,0,0,1|1,0,1]=4 6182 B16R1.4710 COc1cc(ccc1O)CCC(=O)N(C)C 240690a_100102631434_100011216321 [0,1,0,0,0,1|2,0,0]=4 6183 B16R1.4710 COc1cc(ccc1O)CCC(=O)N(C)C 271570a_200010232142_100000694246 [0,1,0,0,0,1|2,0,0]=4 6184 B16R1.4710 COc1cc(ccc1O)CCC(=O)[C@@H](C)O 1458a_100000717761_100010741665 [0,1,0,0,0,1|0,0,2]=4 6185 B16R1.4710 COc1cc(ccc1O)CCC(=O)[C@H](C)O 1458a_217856618621_100010741665 [0,1,0,0,0,1|0,0,2]=4 6186 B16R1.4710 COc1cc(ccc1O)CCN(C)C(C)C 269982a_200000211004_100010741665 [0,1,0,0,0,1|1,0,1]=4 6187 B16R1.4710 COc1cc(ccc1O)CNC(=O)C(=O)N 240690a_100000185554_100011215815 [0,1,0,0,0,1|1,0,1]=4 6188 B16R1.4710 COc1cc(ccc1O)CNC(C)C(=O)N 34a_100000185554_100000702099 [0,1,0,0,0,1|1,0,0]=3 6189 B16R1.4710 COc1cc(ccc1O)CNC(F)C(=O)N 34a_100000185554_100009813875 [0,1,0,0,0,1|1,0,0]=3 6190 B16R1.4710 COc1cc(ccc1O)CNC(F)C(=O)[O-] 34a_100000185554_100020610796 [0,1,0,0,0,1|1,0,0]=3 6191 B16R1.4710 COc1cc(ccc1O)NCC(=O)C(=O)C 34a_100000726020_100011261029 [0,1,0,0,0,1|0,0,1]=3 6192 B16R1.4710 COc1cc(ccc1O)SCC(=O)C(=O)C 62a_100011261029_100000694246 [0,1,0,0,0,1|0,0,1]=3 6193 B16R1.4710 COc1nc(ccc1Br)COC(C)C(=O)C 34a_100000212229_200010066506 [0,1,0,0,0,1|2,0,0]=4 6194 B16R1.4710 COc1nc(ccc1Br)CSC(C)C(=O)C 62a_100009814033_200010066506 [0,1,0,0,0,1|2,0,0]=4 6195 B16R1.4710 COc1nc(ccc1Br)CSC(C)C(=O)C 62a_200010066506_100009814033 [0,1,0,0,0,1|2,0,0]=4 6196 B16R1.4710 COc1nc(ccc1O)SCC(=O)C(=O)C 62a_100011261029_100010893133 [0,1,0,0,0,1|1,0,1]=4 6197 B16R1.4728 CCc1cc(ccc1O)SCCS(=O)(=O)C 62a_100000731031_100012338938 [0,1,0,0,0,1|2,0,0]=4 6198 B16R1.4728 COc1cc(ccc1Br)NCCS(=O)(=O)C 2230a_100000765947_100000731031 [0,1,0,0,0,1|2,0,0]=4 6199 B16R1.4728 COc1cc(ccc1Br)NCCS(=O)(=O)C 34a_100000765947_100000731031 [0,1,0,0,0,1|2,0,0]=4 6200 B16R1.4728 COc1cc(ccc1Br)OCCS(=O)(=O)C 34a_100011827694_100000731031 [0,1,0,0,0,1|2,0,0]=4 6201 B16R1.4728 COc1cc(ccc1Br)OCCS(=O)(=O)C 7a_100011827694_100000230027 [0,1,0,0,0,1|2,0,0]=4 6202 B16R1.4728 COc1cc(ccc1Br)SCCS(=O)(=O)C 62a_100000731031_100012353699 [0,1,0,0,0,1|2,0,0]=4 6203 B16R1.4728 COc1cc(ccc1Br)SCCS(=O)(=O)C 62a_100012353699_100000230027 [0,1,0,0,0,1|2,0,0]=4 6204 B16R1.4728 COc1cc(ccc1C)NCCS(=O)(=O)C 2230a_100011279678_100000731031 [0,1,0,0,0,1|2,0,0]=4 6205 B16R1.4728 COc1cc(ccc1C)NCCS(=O)(=O)C 34a_100011279678_100000731031 [0,1,0,0,0,1|2,0,0]=4 6206 B16R1.4728 COc1cc(ccc1C)OCCS(=O)(=O)C 34a_100009865632_100000731031 [0,1,0,0,0,1|2,0,0]=4 6207 B16R1.4728 COc1cc(ccc1C)OCCS(=O)(=O)C 7a_100009865632_100000230027 [0,1,0,0,0,1|2,0,0]=4 6208 B16R1.4728 COc1cc(ccc1C)SCCS(=O)(=O)C 62a_100000731031_100011830276 [0,1,0,0,0,1|2,0,0]=4 6209 B16R1.4728 COc1cc(ccc1C)SCCS(=O)(=O)C 62a_100011830276_100000230027 [0,1,0,0,0,1|2,0,0]=4 6210 B16R1.4728 COc1cc(ccc1Cl)NCCS(=O)(=O)C 2230a_100000742311_100000731031 [0,1,0,0,0,1|2,0,0]=4 6211 B16R1.4728 COc1cc(ccc1Cl)NCCS(=O)(=O)C 34a_100000742311_100000731031 [0,1,0,0,0,1|2,0,0]=4 6212 B16R1.4728 COc1cc(ccc1Cl)OCCS(=O)(=O)C 34a_100012186310_100000731031 [0,1,0,0,0,1|2,0,0]=4 6213 B16R1.4728 COc1cc(ccc1Cl)OCCS(=O)(=O)C 7a_100012186310_100000230027 [0,1,0,0,0,1|2,0,0]=4 6214 B16R1.4728 COc1cc(ccc1Cl)SCCS(=O)(=O)C 62a_100000731031_100011356853 [0,1,0,0,0,1|2,0,0]=4 6215 B16R1.4728 COc1cc(ccc1Cl)SCCS(=O)(=O)C 62a_100011356853_100000230027 [0,1,0,0,0,1|2,0,0]=4 6216 B16R1.4728 COc1cc(ccc1F)NCCS(=O)(=O)C 2230a_100000701188_100000731031 [0,1,0,0,0,1|2,0,0]=4 6217 B16R1.4728 COc1cc(ccc1F)NCCS(=O)(=O)C 34a_100000701188_100000731031 [0,1,0,0,0,1|2,0,0]=4 6218 B16R1.4728 COc1cc(ccc1F)OCCS(=O)(=O)C 34a_100012001760_100000731031 [0,1,0,0,0,1|2,0,0]=4 6219 B16R1.4728 COc1cc(ccc1F)OCCS(=O)(=O)C 7a_100012001760_100000230027 [0,1,0,0,0,1|2,0,0]=4 6220 B16R1.4728 COc1cc(ccc1F)SCCS(=O)(=O)C 62a_100000731031_100011934186 [0,1,0,0,0,1|2,0,0]=4 6221 B16R1.4728 COc1cc(ccc1F)SCCS(=O)(=O)C 62a_100011934186_100000230027 [0,1,0,0,0,1|2,0,0]=4 6222 B16R1.4728 COc1cc(ccc1I)NCCS(=O)(=O)C 34a_100000746945_100000731031 [0,1,0,0,0,1|2,0,0]=4 6223 B16R1.4728 COc1cc(ccc1N)OCCS(=O)(=O)C 34a_100015326901_100000731031 [0,1,0,0,0,1|2,0,0]=4 6224 B16R1.4728 COc1cc(ccc1N)OCCS(=O)(=O)C 7a_100015326901_100000230027 [0,1,0,0,0,1|2,0,0]=4 6225 B16R1.4728 COc1cc(ccc1N)SCCS(=O)(=O)C 62a_100000731031_100015196925 [0,1,0,0,0,1|2,0,0]=4 6226 B16R1.4728 COc1cc(ccc1N)SCCS(=O)(=O)C 62a_100011279103_100000230027 [0,1,0,0,0,1|2,0,0]=4 6227 B16R1.4728 COc1cc(ccc1O)CCNC(C)(C)C 2230a_100000715429_100010741665 [0,1,0,0,0,1|1,0,1]=4 6228 B16R1.4728 COc1cc(ccc1O)CCNC(C)(C)C 34a_100000756042_100000210625 [0,1,0,0,0,1|1,0,1]=4 6229 B16R1.4728 COc1cc(ccc1O)CCNS(=O)(=O)C 40a_100000756042_100000738038 [0,1,0,0,0,1|1,0,0]=3 6230 B16R1.4728 COc1cc(ccc1O)CCOC(C)(C)C 7a_100015890283_100010741665 [0,1,0,0,0,1|1,0,1]=4 6231 B16R1.4728 COc1cc(ccc1O)CCSC(C)(C)C 62a_100000211941_100010741665 [0,1,0,0,0,1|1,0,1]=4 6232 B16R1.4728 COc1cc(ccc1O)CNCC(C)(C)C 34a_100000185554_100011219605 [0,1,0,0,0,1|1,0,1]=4 6233 B16R1.4728 COc1cc(ccc1O)CNCC(C)(C)F 34a_100000185554_100011997219 [0,1,0,0,0,1|1,0,1]=4 6234 B16R1.4728 COc1cc(ccc1O)CNCC(C)(C)O 34a_100000185554_100000764493 [0,1,0,0,0,1|0,0,2]=4 6235 B16R1.4728 COc1cc(ccc1O)CNCS(=O)(=O)[O-] 34a_100000185554_100009817235 [0,1,0,0,0,1|2,0,0]=4 6236 B16R1.4728 COc1cc(ccc1O)NCCC(C)(C)C 34a_100000726020_100000755188 [0,1,0,0,0,1|1,0,1]=4 6237 B16R1.4728 COc1cc(ccc1O)NCCC(C)(C)O 34a_100000726020_100000702414 [0,1,0,0,0,1|0,0,2]=4 6238 B16R1.4728 COc1cc(ccc1O)NCCS(=O)(=O)C 34a_100000726020_100000731031 [0,1,0,0,0,1|1,0,0]=3 6239 B16R1.4728 COc1cc(ccc1O)NCCS(=O)(=O)[O-] 34a_100000726020_100000762736 [0,1,0,0,0,1|2,0,0]=4 6240 B16R1.4728 COc1cc(ccc1O)NCC[N+](C)(C)C 34a_100000726020_100000085578 [0,1,0,0,0,1|2,0,0]=4 6241 B16R1.4728 COc1cc(ccc1O)NCC[Si](C)(C)C 34a_100000726020_200000733723 [0,1,0,0,0,1|1,1,0]=4 6242 B16R1.4728 COc1cc(ccc1O)SCCC(C)(C)C 62a_100000755188_100000694246 [0,1,0,0,0,1|1,0,1]=4 6243 B16R1.4728 COc1cc(ccc1O)SCCC(C)(C)O 62a_100000702414_100000694246 [0,1,0,0,0,1|0,0,2]=4 6244 B16R1.4728 COc1cc(ccc1O)SCCS(=O)(=O)C 62a_100000731031_100000694246 [0,1,0,0,0,1|1,0,0]=3 6245 B16R1.4728 COc1cc(ccc1O)SCCS(=O)(=O)[O-] 62a_100000762736_100000694246 [0,1,0,0,0,1|2,0,0]=4 6246 B16R1.4728 COc1cc(ccc1O)SCC[N+](C)(C)C 62a_100000085578_100000694246 [0,1,0,0,0,1|2,0,0]=4 6247 B16R1.4728 COc1cc(ccc1O)SCC[Si](C)(C)C 62a_200000733723_100000694246 [0,1,0,0,0,1|1,1,0]=4 6248 B16R1.4728 COc1nc(ccc1O)SCCS(=O)(=O)C 62a_100000731031_100010893133 [0,1,0,0,0,1|2,0,0]=4 6249 B16R1.4761 C=C(C)CC(=O)Cc1ccc(c(c1)OC)Br 1458a_200010002685_100000748629 [0,1,0,0,0,1|2,0,0]=4 6250 B16R1.4761 C=C(C)CC(=O)Cc1ccc(c(c1)OC)F 1458a_100000117344_100000748629 [0,1,0,0,0,1|2,0,0]=4 6251 B16R1.4761 C=C(C)CC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000748629 [0,1,0,0,0,1|1,0,0]=3 6252 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)Br 2230a_100000225649_100010110085 [0,1,0,0,0,1|2,0,0]=4 6253 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)Br 269982a_100000225649_100010110085 [0,1,0,0,0,1|2,0,0]=4 6254 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)Br 270004a_100000225649_100010244714 [0,1,0,0,0,1|2,0,0]=4 6255 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)C 270004a_100000225649_100000719150 [0,1,0,0,0,1|2,0,0]=4 6256 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)Cl 2230a_100000225649_200010214485 [0,1,0,0,0,1|2,0,0]=4 6257 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)Cl 269982a_100000225649_200010214485 [0,1,0,0,0,1|2,0,0]=4 6258 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)Cl 270004a_100000225649_100011998524 [0,1,0,0,0,1|2,0,0]=4 6259 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)F 2230a_100000225649_100012349856 [0,1,0,0,0,1|2,0,0]=4 6260 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)F 269982a_100000225649_100012349856 [0,1,0,0,0,1|2,0,0]=4 6261 B16R1.4761 C=C(C)CN(C)Cc1ccc(c(c1)OC)F 270004a_100000225649_100000692873 [0,1,0,0,0,1|2,0,0]=4 6262 B16R1.4761 C=C(F)CC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100009893438 [0,1,0,0,0,1|1,0,1]=4 6263 B16R1.4761 CCc1cc(ccc1O)SC(C)OC(=O)C 62a_100009818208_100012338938 [0,1,0,0,0,1|2,0,0]=4 6264 B16R1.4761 COc1cc(ccc1Br)CC(=O)CC(=O)N 1458a_100134613110_100010110085 [0,1,0,0,0,1|2,0,0]=4 6265 B16R1.4761 COc1cc(ccc1Br)CC(=O)CC(=O)N 1458a_200010002685_100000187820 [0,1,0,0,0,1|2,0,0]=4 6266 B16R1.4761 COc1cc(ccc1Br)CC(=O)CC(=O)[O-] 1458a_200010002685_100020667443 [0,1,0,0,0,1|2,0,0]=4 6267 B16R1.4761 COc1cc(ccc1Br)CN(C)CC(=O)N 2230a_100000739694_100010110085 [0,1,0,0,0,1|2,0,0]=4 6268 B16R1.4761 COc1cc(ccc1Br)CN(C)CC(=O)N 270004a_100000739694_100010244714 [0,1,0,0,0,1|2,0,0]=4 6269 B16R1.4761 COc1cc(ccc1Br)CN(C)CC(=O)O 269956a_100000746989_100010110085 [0,1,0,0,0,1|2,0,0]=4 6270 B16R1.4761 COc1cc(ccc1Br)SC(C)OC(=O)C 62a_100009818208_100012353699 [0,1,0,0,0,1|2,0,0]=4 6271 B16R1.4761 COc1cc(ccc1Br)SC(C)OC(=O)C 62a_100012353699_100009818208 [0,1,0,0,0,1|2,0,0]=4 6272 B16R1.4761 COc1cc(ccc1C)CN(C)CC(=O)N 270004a_100000739694_100000719150 [0,1,0,0,0,1|2,0,0]=4 6273 B16R1.4761 COc1cc(ccc1C)SC(C)OC(=O)C 62a_100009818208_100011830276 [0,1,0,0,0,1|2,0,0]=4 6274 B16R1.4761 COc1cc(ccc1C)SC(C)OC(=O)C 62a_100011830276_100009818208 [0,1,0,0,0,1|2,0,0]=4 6275 B16R1.4761 COc1cc(ccc1Cl)CC(=O)CC(=O)N 1458a_100134613110_200010214485 [0,1,0,0,0,1|2,0,0]=4 6276 B16R1.4761 COc1cc(ccc1Cl)CN(C)CC(=O)N 2230a_100000739694_200010214485 [0,1,0,0,0,1|2,0,0]=4 6277 B16R1.4761 COc1cc(ccc1Cl)CN(C)CC(=O)N 270004a_100000739694_100011998524 [0,1,0,0,0,1|2,0,0]=4 6278 B16R1.4761 COc1cc(ccc1Cl)CN(C)CC(=O)O 269956a_100000746989_200010214485 [0,1,0,0,0,1|2,0,0]=4 6279 B16R1.4761 COc1cc(ccc1Cl)NC(=O)CC(=O)C 1458a_100000070787_100011203113 [0,1,0,0,0,1|1,0,1]=4 6280 B16R1.4761 COc1cc(ccc1Cl)SC(C)OC(=O)C 62a_100009818208_100011356853 [0,1,0,0,0,1|2,0,0]=4 6281 B16R1.4761 COc1cc(ccc1Cl)SC(C)OC(=O)C 62a_100011356853_100009818208 [0,1,0,0,0,1|2,0,0]=4 6282 B16R1.4761 COc1cc(ccc1F)CC(=O)CC(=O)N 1458a_100000117344_100000187820 [0,1,0,0,0,1|2,0,0]=4 6283 B16R1.4761 COc1cc(ccc1F)CC(=O)CC(=O)N 1458a_100134613110_100012349856 [0,1,0,0,0,1|2,0,0]=4 6284 B16R1.4761 COc1cc(ccc1F)CC(=O)CC(=O)[O-] 1458a_100000117344_100020667443 [0,1,0,0,0,1|2,0,0]=4 6285 B16R1.4761 COc1cc(ccc1F)CN(C)CC(=O)N 2230a_100000739694_100012349856 [0,1,0,0,0,1|2,0,0]=4 6286 B16R1.4761 COc1cc(ccc1F)CN(C)CC(=O)N 270004a_100000739694_100000692873 [0,1,0,0,0,1|2,0,0]=4 6287 B16R1.4761 COc1cc(ccc1F)CN(C)CC(=O)O 269956a_100000746989_100012349856 [0,1,0,0,0,1|2,0,0]=4 6288 B16R1.4761 COc1cc(ccc1F)SC(C)OC(=O)C 62a_100009818208_100011934186 [0,1,0,0,0,1|2,0,0]=4 6289 B16R1.4761 COc1cc(ccc1F)SC(C)OC(=O)C 62a_100011934186_100009818208 [0,1,0,0,0,1|2,0,0]=4 6290 B16R1.4761 COc1cc(ccc1N)SC(C)OC(=O)C 62a_100009818208_100015196925 [0,1,0,0,0,1|2,0,0]=4 6291 B16R1.4761 COc1cc(ccc1N)SC(C)OC(=O)C 62a_100011279103_100009818208 [0,1,0,0,0,1|2,0,0]=4 6292 B16R1.4761 COc1cc(ccc1O)CC(=O)CC(=O)N 1458a_100000032101_100000187820 [0,1,0,0,0,1|1,0,0]=3 6293 B16R1.4761 COc1cc(ccc1O)CC(=O)CC(=O)[O-] 1458a_100000032101_100020667443 [0,1,0,0,0,1|1,0,0]=3 6294 B16R1.4761 COc1cc(ccc1O)CC(=O)CC(C)C 1458a_100000032101_100000210624 [0,1,0,0,0,1|1,0,1]=4 6295 B16R1.4761 COc1cc(ccc1O)CC(=O)CC(C)O 1458a_100000032101_100011218427 [0,1,0,0,0,1|0,0,2]=4 6296 B16R1.4761 COc1cc(ccc1O)CC(=O)C[N+](=O)[O-] 1458a_100000032101_100000761209 [0,1,0,0,0,1|2,0,0]=4 6297 B16R1.4761 COc1cc(ccc1O)NC(=O)CC(=O)N 22a_100000726020_100134613110 [0,1,0,0,0,1|1,0,1]=4 6298 B16R1.4761 COc1cc(ccc1O)NC(=O)CC(=O)N 527a_100000726020_100134613110 [0,1,0,0,0,1|1,0,1]=4 6299 B16R1.4761 COc1cc(ccc1O)NC(C)CC(C)C 34a_100000726020_100000731052 [0,1,0,0,0,1|1,0,1]=4 6300 B16R1.4761 COc1cc(ccc1O)SC(C)CC(C)C 62a_100000731052_100000694246 [0,1,0,0,0,1|1,0,1]=4 6301 B16R1.4761 COc1cc(ccc1O)SC(C)CN(C)C 62a_100020606517_100000694246 [0,1,0,0,0,1|2,0,0]=4 6302 B16R1.4761 COc1cc(ccc1O)SC(C)OC(=O)C 62a_100009818208_100000694246 [0,1,0,0,0,1|1,0,0]=3 6303 B16R1.4761 COc1nc(ccc1O)SC(C)OC(=O)C 62a_100009818208_100010893133 [0,1,0,0,0,1|2,0,0]=4 6304 B16R1.12733 C=C(C)CCNc1ccc(c(c1)OCC)Br 2230a_200016990551_100000730704 [0,1,0,0,0,1|2,0,0]=4 6305 B16R1.12733 C=C(C)CCNc1ccc(c(c1)OCC)Br 34a_200016990551_100000730704 [0,1,0,0,0,1|2,0,0]=4 6306 B16R1.12733 C=C(C)CCNc1ccc(c(c1)OCC)Br 7a_200016990551_100000730704 [0,1,0,0,0,1|2,0,0]=4 6307 B16R1.12733 C=C(C)CCNc1ccc(c(c1)OCC)Cl 2230a_100011964961_100000730704 [0,1,0,0,0,1|2,0,0]=4 6308 B16R1.12733 C=C(C)CCNc1ccc(c(c1)OCC)Cl 34a_100011964961_100000730704 [0,1,0,0,0,1|2,0,0]=4 6309 B16R1.12733 C=C(C)CCSc1ccc(c(c1)CNC)O 62a_100000730704_100011602694 [0,1,0,0,0,1|2,0,0]=4 6310 B16R1.12733 C=C(C)CCSc1ccc(c(c1)CNC)O 62a_100011602694_100000730704 [0,1,0,0,0,1|2,0,0]=4 6311 B16R1.12733 C=C(C)CCSc1ccc(c(c1)COC)Br 62a_100000730704_202125822959 [0,1,0,0,0,1|2,0,0]=4 6312 B16R1.12733 C=C(C)CCSc1ccc(c(c1)COC)Br 62a_202125822959_100000730704 [0,1,0,0,0,1|2,0,0]=4 6313 B16R1.12733 C=C(C)CCSc1ccc(c(c1)COC)F 62a_100000730704_100010140362 [0,1,0,0,0,1|2,0,0]=4 6314 B16R1.12733 C=C(C)CCSc1ccc(c(c1)COC)F 62a_100010140362_100000730704 [0,1,0,0,0,1|2,0,0]=4 6315 B16R1.12733 C=C(C)CCSc1ccc(c(c1)OCC)C 62a_100000730704_100012361169 [0,1,0,0,0,1|2,0,0]=4 6316 B16R1.12733 C=C(C)CCSc1ccc(c(c1)OCC)C 62a_100012361169_100000730704 [0,1,0,0,0,1|2,0,0]=4 6317 B16R1.12733 C=C(C)CCSc1ccc(c(c1)OCC)F 62a_100000730704_200012344967 [0,1,0,0,0,1|2,0,0]=4 6318 B16R1.12733 C=C(C)CCSc1ccc(c(c1)OCC)F 62a_200012344967_100000730704 [0,1,0,0,0,1|2,0,0]=4 6319 B16R1.12733 C=C(C)CCSc1ccc(c(c1)OCC)N 62a_100000688918_100000730704 [0,1,0,0,0,1|2,0,0]=4 6320 B16R1.12733 C=C(C)CNCc1ccc(c(c1)OCC)O 34a_200000751567_100000748629 [0,1,0,0,0,1|1,0,0]=3 6321 B16R1.12733 C=C(F)CNCc1ccc(c(c1)OCC)O 34a_200000751567_100009893438 [0,1,0,0,0,1|1,0,1]=4 6322 B16R1.12733 CCNc1cc(ccc1C)OCCC(=O)C 7a_100000211784_100000053229 [0,1,0,0,0,1|2,0,0]=4 6323 B16R1.12733 CCNc1cc(ccc1N)SCCC(=O)C 62a_100000053229_100000696630 [0,1,0,0,0,1|2,0,0]=4 6324 B16R1.12733 CCNc1cc(ccc1N)SCCC(=O)C 62a_100000696630_100000053229 [0,1,0,0,0,1|2,0,0]=4 6325 B16R1.12733 CCOc1cc(ccc1Br)NCCC(=O)C 7a_200016990551_100000053229 [0,1,0,0,0,1|1,0,0]=3 6326 B16R1.12733 CCOc1cc(ccc1Br)NCCC(=O)N 2230a_200016990551_100000744528 [0,1,0,0,0,1|2,0,0]=4 6327 B16R1.12733 CCOc1cc(ccc1Br)NCCC(=O)N 34a_200016990551_100000731001 [0,1,0,0,0,1|2,0,0]=4 6328 B16R1.12733 CCOc1cc(ccc1Br)NCCC(=O)N 7a_200016990551_100000744528 [0,1,0,0,0,1|2,0,0]=4 6329 B16R1.12733 CCOc1cc(ccc1Br)NCOC(=O)C 34a_200016990551_100009813279 [0,1,0,0,0,1|2,0,0]=4 6330 B16R1.12733 CCOc1cc(ccc1C)SCCC(=O)C 62a_100000053229_100012361169 [0,1,0,0,0,1|1,0,0]=3 6331 B16R1.12733 CCOc1cc(ccc1C)SCCC(=O)C 62a_100012361169_100000053229 [0,1,0,0,0,1|1,0,0]=3 6332 B16R1.12733 CCOc1cc(ccc1C)SCCC(=O)N 62a_100000744528_100012361169 [0,1,0,0,0,1|2,0,0]=4 6333 B16R1.12733 CCOc1cc(ccc1C)SCCC(=O)N 62a_100012361169_100000744528 [0,1,0,0,0,1|2,0,0]=4 6334 B16R1.12733 CCOc1cc(ccc1C)SCOC(=O)C 62a_100000076356_100012361169 [0,1,0,0,0,1|2,0,0]=4 6335 B16R1.12733 CCOc1cc(ccc1C)SCOC(=O)C 62a_100012361169_100000076356 [0,1,0,0,0,1|2,0,0]=4 6336 B16R1.12733 CCOc1cc(ccc1Cl)NCCC(=O)N 2230a_100011964961_100000744528 [0,1,0,0,0,1|2,0,0]=4 6337 B16R1.12733 CCOc1cc(ccc1Cl)NCCC(=O)N 34a_100011964961_100000731001 [0,1,0,0,0,1|2,0,0]=4 6338 B16R1.12733 CCOc1cc(ccc1Cl)NCOC(=O)C 34a_100011964961_100009813279 [0,1,0,0,0,1|2,0,0]=4 6339 B16R1.12733 CCOc1cc(ccc1F)SCCC(=O)C 62a_100000053229_200012344967 [0,1,0,0,0,1|1,0,0]=3 6340 B16R1.12733 CCOc1cc(ccc1F)SCCC(=O)C 62a_200012344967_100000053229 [0,1,0,0,0,1|1,0,0]=3 6341 B16R1.12733 CCOc1cc(ccc1F)SCCC(=O)N 62a_100000744528_200012344967 [0,1,0,0,0,1|2,0,0]=4 6342 B16R1.12733 CCOc1cc(ccc1F)SCCC(=O)N 62a_200012344967_100000744528 [0,1,0,0,0,1|2,0,0]=4 6343 B16R1.12733 CCOc1cc(ccc1F)SCOC(=O)C 62a_100000076356_200012344967 [0,1,0,0,0,1|2,0,0]=4 6344 B16R1.12733 CCOc1cc(ccc1F)SCOC(=O)C 62a_200012344967_100000076356 [0,1,0,0,0,1|2,0,0]=4 6345 B16R1.12733 CCOc1cc(ccc1N)SCCC(=O)C 62a_100000688918_100000053229 [0,1,0,0,0,1|1,0,0]=3 6346 B16R1.12733 CCOc1cc(ccc1N)SCCC(=O)N 62a_100000688918_100000744528 [0,1,0,0,0,1|2,0,0]=4 6347 B16R1.12733 CCOc1cc(ccc1N)SCOC(=O)C 62a_100000688918_100000076356 [0,1,0,0,0,1|2,0,0]=4 6348 B16R1.12733 CCOc1cc(ccc1O)C=NNC(=O)C 4a_100000189765_100000188318 [0,1,0,0,0,1|1,0,1]=4 6349 B16R1.12733 CCOc1cc(ccc1O)CNCC(=O)N 34a_200000751567_100000187820 [0,1,0,0,0,1|1,0,0]=3 6350 B16R1.12733 CCOc1cc(ccc1O)CNCC(=O)[O-] 34a_200000751567_100020667443 [0,1,0,0,0,1|1,0,0]=3 6351 B16R1.12733 CCOc1cc(ccc1O)CNCC(C)C 270004a_200000751567_100000210432 [0,1,0,0,0,1|1,0,1]=4 6352 B16R1.12733 CCOc1cc(ccc1O)CNCC(C)C 34a_200000751567_100000210624 [0,1,0,0,0,1|1,0,1]=4 6353 B16R1.12733 CCOc1cc(ccc1O)CNCC(C)O 34a_200000751567_100011218427 [0,1,0,0,0,1|0,0,2]=4 6354 B16R1.12733 CCOc1cc(ccc1O)CNC[C@@H](C)O 34a_200000751567_100009817552 [0,1,0,0,0,1|0,0,2]=4 6355 B16R1.12733 CCOc1cc(ccc1O)CNC[N+](=O)[O-] 34a_200000751567_100000761209 [0,1,0,0,0,1|2,0,0]=4 6356 B16R1.12733 CCOc1cc(cnc1F)SCCC(=O)C 62a_100000053229_100010732568 [0,1,0,0,0,1|2,0,0]=4 6357 B16R1.12733 CCOc1cc(cnc1F)SCCC(=O)C 62a_100010732568_100000053229 [0,1,0,0,0,1|2,0,0]=4 6358 B16R1.12733 CCOc1cc(ncc1N)SCCC(=O)C 62a_100000053229_100015764953 [0,1,0,0,0,1|2,0,0]=4 6359 B16R1.12733 CCOc1cc(ncc1N)SCCC(=O)C 62a_100015764953_100000053229 [0,1,0,0,0,1|2,0,0]=4 6360 B16R1.12733 CNCc1cc(ccc1C)SCCC(=O)C 62a_100000053229_106744473289 [0,1,0,0,0,1|2,0,0]=4 6361 B16R1.12733 CNCc1cc(ccc1C)SCCC(=O)C 62a_106744473289_100000053229 [0,1,0,0,0,1|2,0,0]=4 6362 B16R1.12733 CNCc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100000748472 [0,1,0,0,0,1|2,0,0]=4 6363 B16R1.12733 CNCc1cc(ccc1F)SCCC(=O)C 62a_100000748472_100000053229 [0,1,0,0,0,1|2,0,0]=4 6364 B16R1.12733 CNCc1cc(ccc1O)SCCC(=O)C 62a_100000053229_100011602694 [0,1,0,0,0,1|1,0,0]=3 6365 B16R1.12733 CNCc1cc(ccc1O)SCCC(=O)C 62a_100011602694_100000053229 [0,1,0,0,0,1|1,0,0]=3 6366 B16R1.12733 CNCc1cc(ccc1O)SCCC(=O)N 62a_100000744528_100011602694 [0,1,0,0,0,1|2,0,0]=4 6367 B16R1.12733 CNCc1cc(ccc1O)SCCC(=O)N 62a_100011602694_100000744528 [0,1,0,0,0,1|2,0,0]=4 6368 B16R1.12733 CNCc1cc(ccc1O)SCOC(=O)C 62a_100000076356_100011602694 [0,1,0,0,0,1|2,0,0]=4 6369 B16R1.12733 CNCc1cc(ccc1O)SCOC(=O)C 62a_100011602694_100000076356 [0,1,0,0,0,1|2,0,0]=4 6370 B16R1.12733 COCc1cc(ccc1Br)SCCC(=O)C 62a_100000053229_202125822959 [0,1,0,0,0,1|1,0,0]=3 6371 B16R1.12733 COCc1cc(ccc1Br)SCCC(=O)C 62a_202125822959_100000053229 [0,1,0,0,0,1|1,0,0]=3 6372 B16R1.12733 COCc1cc(ccc1Br)SCCC(=O)N 62a_100000744528_202125822959 [0,1,0,0,0,1|2,0,0]=4 6373 B16R1.12733 COCc1cc(ccc1Br)SCCC(=O)N 62a_202125822959_100000744528 [0,1,0,0,0,1|2,0,0]=4 6374 B16R1.12733 COCc1cc(ccc1Br)SCOC(=O)C 62a_100000076356_202125822959 [0,1,0,0,0,1|2,0,0]=4 6375 B16R1.12733 COCc1cc(ccc1Br)SCOC(=O)C 62a_202125822959_100000076356 [0,1,0,0,0,1|2,0,0]=4 6376 B16R1.12733 COCc1cc(ccc1F)SCCC(=O)C 62a_100000053229_100010140362 [0,1,0,0,0,1|1,0,0]=3 6377 B16R1.12733 COCc1cc(ccc1F)SCCC(=O)C 62a_100010140362_100000053229 [0,1,0,0,0,1|1,0,0]=3 6378 B16R1.12733 COCc1cc(ccc1F)SCCC(=O)N 62a_100000744528_100010140362 [0,1,0,0,0,1|2,0,0]=4 6379 B16R1.12733 COCc1cc(ccc1F)SCCC(=O)N 62a_100010140362_100000744528 [0,1,0,0,0,1|2,0,0]=4 6380 B16R1.12733 COCc1cc(ccc1F)SCOC(=O)C 62a_100000076356_100010140362 [0,1,0,0,0,1|2,0,0]=4 6381 B16R1.12733 COCc1cc(ccc1F)SCOC(=O)C 62a_100010140362_100000076356 [0,1,0,0,0,1|2,0,0]=4 6382 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000730704 [0,1,0,0,0,1|2,0,0]=4 6383 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000730704 [0,1,0,0,0,1|2,0,0]=4 6384 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)C)OC 34a_100010244135_100000730704 [0,1,0,0,0,1|2,0,0]=4 6385 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)C)OC 7a_100010244135_100000730704 [0,1,0,0,0,1|2,0,0]=4 6386 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000730704 [0,1,0,0,0,1|2,0,0]=4 6387 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000730704 [0,1,0,0,0,1|2,0,0]=4 6388 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)F)OC 34a_100010208193_100000730704 [0,1,0,0,0,1|2,0,0]=4 6389 B16R1.20029 C=C(C)CCNc1cc(c(cc1Br)F)OC 7a_100010208193_100000730704 [0,1,0,0,0,1|2,0,0]=4 6390 B16R1.20029 C=C(C)CCNc1cc(c(cc1C)Br)OC 34a_100010232211_100000730704 [0,1,0,0,0,1|2,0,0]=4 6391 B16R1.20029 C=C(C)CCNc1cc(c(cc1C)Br)OC 7a_100010232211_100000730704 [0,1,0,0,0,1|2,0,0]=4 6392 B16R1.20029 C=C(C)CCNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000730704 [0,1,0,0,0,1|2,0,0]=4 6393 B16R1.20029 C=C(C)CCNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000730704 [0,1,0,0,0,1|2,0,0]=4 6394 B16R1.20029 C=C(C)CCNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000730704 [0,1,0,0,0,1|2,0,0]=4 6395 B16R1.20029 C=C(C)CCNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000730704 [0,1,0,0,0,1|2,0,0]=4 6396 B16R1.20029 C=C(C)CCNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000730704 [0,1,0,0,0,1|2,0,0]=4 6397 B16R1.20029 C=C(C)CCNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000730704 [0,1,0,0,0,1|2,0,0]=4 6398 B16R1.20029 C=C(C)CCNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000730704 [0,1,0,0,0,1|2,0,0]=4 6399 B16R1.20029 C=C(C)CCNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000730704 [0,1,0,0,0,1|2,0,0]=4 6400 B16R1.20029 C=C(C)CCNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000730704 [0,1,0,0,0,1|2,0,0]=4 6401 B16R1.20029 C=C(C)CCNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000730704 [0,1,0,0,0,1|2,0,0]=4 6402 B16R1.20029 C=C(C)CCSc1cc(c(cc1C)F)OC 62a_100000730704_100011009880 [0,1,0,0,0,1|2,0,0]=4 6403 B16R1.20029 C=C(C)CCSc1cc(c(cc1C)F)OC 62a_100011009880_100000730704 [0,1,0,0,0,1|2,0,0]=4 6404 B16R1.20029 C=C(C)CCSc1cc(c(cc1C)N)OC 62a_100000730704_100010141321 [0,1,0,0,0,1|2,0,0]=4 6405 B16R1.20029 C=C(C)CCSc1cc(c(cc1C)N)OC 62a_100010141321_100000730704 [0,1,0,0,0,1|2,0,0]=4 6406 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)Cl)OC 62a_100000730704_100010739614 [0,1,0,0,0,1|2,0,0]=4 6407 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000730704 [0,1,0,0,0,1|2,0,0]=4 6408 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)F)OC 62a_100000730704_200015541288 [0,1,0,0,0,1|2,0,0]=4 6409 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)F)OC 62a_200015541288_100000730704 [0,1,0,0,0,1|2,0,0]=4 6410 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)N)OC 62a_100000730704_100012766639 [0,1,0,0,0,1|2,0,0]=4 6411 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)N)OC 62a_100012766639_100000730704 [0,1,0,0,0,1|2,0,0]=4 6412 B16R1.20029 C=C(C)CCSc1cc(c(cc1F)O)OC 62a_100000730704_100010189133 [0,1,0,0,0,1|1,0,0]=3 6413 B16R1.20029 C=C(C)CCSc1cc(c(cc1N)C)OC 62a_100000730704_200010584344 [0,1,0,0,0,1|2,0,0]=4 6414 B16R1.20029 C=C(C)CCSc1cc(c(cc1N)C)OC 62a_200010584344_100000730704 [0,1,0,0,0,1|2,0,0]=4 6415 B16R1.20029 C=C(C)CCSc1cc(c(cc1N)F)OC 62a_100000730704_100010365326 [0,1,0,0,0,1|2,0,0]=4 6416 B16R1.20029 C=C(C)CCSc1cc(c(cc1N)F)OC 62a_100010365326_100000730704 [0,1,0,0,0,1|2,0,0]=4 6417 B16R1.20029 CC(=O)CCSc1cc(c(cc1F)O)C=O 62a_100000053229_100010175118 [0,1,0,0,0,1|2,0,0]=4 6418 B16R1.20029 CC(=O)CCSc1cc(c(cc1F)O)C=O 62a_100010175118_100000053229 [0,1,0,0,0,1|2,0,0]=4 6419 B16R1.20029 CC(=O)CCSc1cc(c(cc1O)O)C=O 62a_100000053229_200010132312 [0,1,0,0,0,1|2,0,0]=4 6420 B16R1.20029 CCc1cc(c(cc1Br)F)OCCC(=O)C 7a_100011156610_100000053229 [0,1,0,0,0,1|2,0,0]=4 6421 B16R1.20029 CNc1cc(c(cc1N)F)SCCC(=O)C 62a_100000053229_100013631271 [0,1,0,0,0,1|2,0,0]=4 6422 B16R1.20029 CNc1cc(c(cc1N)F)SCCC(=O)C 62a_100013631271_100000053229 [0,1,0,0,0,1|2,0,0]=4 6423 B16R1.20029 COc1cc(c(cc1Br)Br)NCCC(=O)C 7a_100000718616_100000053229 [0,1,0,0,0,1|1,0,0]=3 6424 B16R1.20029 COc1cc(c(cc1Br)Br)NCCC(=O)N 34a_100000718616_100000731001 [0,1,0,0,0,1|2,0,0]=4 6425 B16R1.20029 COc1cc(c(cc1Br)Br)NCCC(=O)N 7a_100000718616_100000744528 [0,1,0,0,0,1|2,0,0]=4 6426 B16R1.20029 COc1cc(c(cc1Br)Br)NCOC(=O)C 34a_100000718616_100009813279 [0,1,0,0,0,1|2,0,0]=4 6427 B16R1.20029 COc1cc(c(cc1Br)Br)SCCC(=O)C 62a_100000053229_200014006352 [0,1,0,0,0,1|1,0,0]=3 6428 B16R1.20029 COc1cc(c(cc1Br)Br)SCCC(=O)C 62a_200014006352_100000053229 [0,1,0,0,0,1|1,0,0]=3 6429 B16R1.20029 COc1cc(c(cc1Br)Br)SCCC(=O)N 62a_100000744528_200014006352 [0,1,0,0,0,1|2,0,0]=4 6430 B16R1.20029 COc1cc(c(cc1Br)Br)SCCC(=O)N 62a_200014006352_100000744528 [0,1,0,0,0,1|2,0,0]=4 6431 B16R1.20029 COc1cc(c(cc1Br)Br)SCOC(=O)C 62a_100000076356_200014006352 [0,1,0,0,0,1|2,0,0]=4 6432 B16R1.20029 COc1cc(c(cc1Br)Br)SCOC(=O)C 62a_200014006352_100000076356 [0,1,0,0,0,1|2,0,0]=4 6433 B16R1.20029 COc1cc(c(cc1Br)C)NCCC(=O)C 7a_100010232211_100000053229 [0,1,0,0,0,1|1,0,0]=3 6434 B16R1.20029 COc1cc(c(cc1Br)C)NCCC(=O)N 34a_100010232211_100000731001 [0,1,0,0,0,1|2,0,0]=4 6435 B16R1.20029 COc1cc(c(cc1Br)C)NCCC(=O)N 7a_100010232211_100000744528 [0,1,0,0,0,1|2,0,0]=4 6436 B16R1.20029 COc1cc(c(cc1Br)C)NCOC(=O)C 34a_100010232211_100009813279 [0,1,0,0,0,1|2,0,0]=4 6437 B16R1.20029 COc1cc(c(cc1Br)Cl)NCCC(=O)C 7a_100012361290_100000053229 [0,1,0,0,0,1|1,0,0]=3 6438 B16R1.20029 COc1cc(c(cc1Br)Cl)NCCC(=O)N 34a_100012361290_100000731001 [0,1,0,0,0,1|2,0,0]=4 6439 B16R1.20029 COc1cc(c(cc1Br)Cl)NCCC(=O)N 7a_100012361290_100000744528 [0,1,0,0,0,1|2,0,0]=4 6440 B16R1.20029 COc1cc(c(cc1Br)Cl)NCOC(=O)C 34a_100012361290_100009813279 [0,1,0,0,0,1|2,0,0]=4 6441 B16R1.20029 COc1cc(c(cc1C)Br)NCCC(=O)C 7a_100010244135_100000053229 [0,1,0,0,0,1|1,0,0]=3 6442 B16R1.20029 COc1cc(c(cc1C)Br)NCCC(=O)N 34a_100010244135_100000731001 [0,1,0,0,0,1|2,0,0]=4 6443 B16R1.20029 COc1cc(c(cc1C)Br)NCCC(=O)N 7a_100010244135_100000744528 [0,1,0,0,0,1|2,0,0]=4 6444 B16R1.20029 COc1cc(c(cc1C)Br)NCOC(=O)C 34a_100010244135_100009813279 [0,1,0,0,0,1|2,0,0]=4 6445 B16R1.20029 COc1cc(c(cc1C)N)SCCC(=O)C 62a_100000053229_200010584344 [0,1,0,0,0,1|1,0,0]=3 6446 B16R1.20029 COc1cc(c(cc1C)N)SCCC(=O)C 62a_200010584344_100000053229 [0,1,0,0,0,1|1,0,0]=3 6447 B16R1.20029 COc1cc(c(cc1C)N)SCCC(=O)N 62a_100000744528_200010584344 [0,1,0,0,0,1|2,0,0]=4 6448 B16R1.20029 COc1cc(c(cc1C)N)SCCC(=O)N 62a_200010584344_100000744528 [0,1,0,0,0,1|2,0,0]=4 6449 B16R1.20029 COc1cc(c(cc1C)N)SCOC(=O)C 62a_100000076356_200010584344 [0,1,0,0,0,1|2,0,0]=4 6450 B16R1.20029 COc1cc(c(cc1C)N)SCOC(=O)C 62a_200010584344_100000076356 [0,1,0,0,0,1|2,0,0]=4 6451 B16R1.20029 COc1cc(c(cc1Cl)Br)NCCC(=O)C 7a_100013022580_100000053229 [0,1,0,0,0,1|1,0,0]=3 6452 B16R1.20029 COc1cc(c(cc1Cl)Br)NCCC(=O)N 34a_100013022580_100000731001 [0,1,0,0,0,1|2,0,0]=4 6453 B16R1.20029 COc1cc(c(cc1Cl)Br)NCCC(=O)N 7a_100013022580_100000744528 [0,1,0,0,0,1|2,0,0]=4 6454 B16R1.20029 COc1cc(c(cc1Cl)Br)NCOC(=O)C 34a_100013022580_100009813279 [0,1,0,0,0,1|2,0,0]=4 6455 B16R1.20029 COc1cc(c(cc1Cl)C)NCCC(=O)C 7a_100009858536_100000053229 [0,1,0,0,0,1|1,0,0]=3 6456 B16R1.20029 COc1cc(c(cc1Cl)C)NCCC(=O)N 2230a_100009858536_100000744528 [0,1,0,0,0,1|2,0,0]=4 6457 B16R1.20029 COc1cc(c(cc1Cl)C)NCCC(=O)N 34a_100009858536_100000731001 [0,1,0,0,0,1|2,0,0]=4 6458 B16R1.20029 COc1cc(c(cc1Cl)C)NCCC(=O)N 7a_100009858536_100000744528 [0,1,0,0,0,1|2,0,0]=4 6459 B16R1.20029 COc1cc(c(cc1Cl)C)NCOC(=O)C 34a_100009858536_100009813279 [0,1,0,0,0,1|2,0,0]=4 6460 B16R1.20029 COc1cc(c(cc1Cl)Cl)NCCC(=O)N 34a_100011830341_100000731001 [0,1,0,0,0,1|2,0,0]=4 6461 B16R1.20029 COc1cc(c(cc1Cl)Cl)NCOC(=O)C 34a_100011830341_100009813279 [0,1,0,0,0,1|2,0,0]=4 6462 B16R1.20029 COc1cc(c(cc1Cl)F)NCCC(=O)C 7a_100009872666_100000053229 [0,1,0,0,0,1|1,0,0]=3 6463 B16R1.20029 COc1cc(c(cc1Cl)F)NCCC(=O)N 34a_100009872666_100000731001 [0,1,0,0,0,1|2,0,0]=4 6464 B16R1.20029 COc1cc(c(cc1Cl)F)NCCC(=O)N 7a_100009872666_100000744528 [0,1,0,0,0,1|2,0,0]=4 6465 B16R1.20029 COc1cc(c(cc1Cl)F)NCOC(=O)C 34a_100009872666_100009813279 [0,1,0,0,0,1|2,0,0]=4 6466 B16R1.20029 COc1cc(c(cc1Cl)F)SCCC(=O)C 62a_100000053229_100010739614 [0,1,0,0,0,1|1,0,0]=3 6467 B16R1.20029 COc1cc(c(cc1Cl)F)SCCC(=O)C 62a_100010739614_100000053229 [0,1,0,0,0,1|1,0,0]=3 6468 B16R1.20029 COc1cc(c(cc1Cl)F)SCCC(=O)N 62a_100000744528_100010739614 [0,1,0,0,0,1|2,0,0]=4 6469 B16R1.20029 COc1cc(c(cc1Cl)F)SCCC(=O)N 62a_100010739614_100000744528 [0,1,0,0,0,1|2,0,0]=4 6470 B16R1.20029 COc1cc(c(cc1Cl)F)SCOC(=O)C 62a_100000076356_100010739614 [0,1,0,0,0,1|2,0,0]=4 6471 B16R1.20029 COc1cc(c(cc1Cl)F)SCOC(=O)C 62a_100010739614_100000076356 [0,1,0,0,0,1|2,0,0]=4 6472 B16R1.20029 COc1cc(c(cc1F)Br)NCCC(=O)C 7a_100010208193_100000053229 [0,1,0,0,0,1|1,0,0]=3 6473 B16R1.20029 COc1cc(c(cc1F)Br)NCCC(=O)N 34a_100010208193_100000731001 [0,1,0,0,0,1|2,0,0]=4 6474 B16R1.20029 COc1cc(c(cc1F)Br)NCCC(=O)N 7a_100010208193_100000744528 [0,1,0,0,0,1|2,0,0]=4 6475 B16R1.20029 COc1cc(c(cc1F)Br)NCOC(=O)C 34a_100010208193_100009813279 [0,1,0,0,0,1|2,0,0]=4 6476 B16R1.20029 COc1cc(c(cc1F)C)SCCC(=O)C 62a_100000053229_100011009880 [0,1,0,0,0,1|1,0,0]=3 6477 B16R1.20029 COc1cc(c(cc1F)C)SCCC(=O)C 62a_100011009880_100000053229 [0,1,0,0,0,1|1,0,0]=3 6478 B16R1.20029 COc1cc(c(cc1F)C)SCCC(=O)N 62a_100000744528_100011009880 [0,1,0,0,0,1|2,0,0]=4 6479 B16R1.20029 COc1cc(c(cc1F)C)SCCC(=O)N 62a_100011009880_100000744528 [0,1,0,0,0,1|2,0,0]=4 6480 B16R1.20029 COc1cc(c(cc1F)C)SCOC(=O)C 62a_100000076356_100011009880 [0,1,0,0,0,1|2,0,0]=4 6481 B16R1.20029 COc1cc(c(cc1F)C)SCOC(=O)C 62a_100011009880_100000076356 [0,1,0,0,0,1|2,0,0]=4 6482 B16R1.20029 COc1cc(c(cc1F)Cl)NCCC(=O)C 7a_100009958774_100000053229 [0,1,0,0,0,1|1,0,0]=3 6483 B16R1.20029 COc1cc(c(cc1F)Cl)NCCC(=O)N 34a_100009958774_100000731001 [0,1,0,0,0,1|2,0,0]=4 6484 B16R1.20029 COc1cc(c(cc1F)Cl)NCCC(=O)N 7a_100009958774_100000744528 [0,1,0,0,0,1|2,0,0]=4 6485 B16R1.20029 COc1cc(c(cc1F)Cl)NCOC(=O)C 34a_100009958774_100009813279 [0,1,0,0,0,1|2,0,0]=4 6486 B16R1.20029 COc1cc(c(cc1F)F)SCCC(=O)C 62a_100000053229_200015541288 [0,1,0,0,0,1|1,0,0]=3 6487 B16R1.20029 COc1cc(c(cc1F)F)SCCC(=O)C 62a_200015541288_100000053229 [0,1,0,0,0,1|1,0,0]=3 6488 B16R1.20029 COc1cc(c(cc1F)F)SCCC(=O)N 62a_100000744528_200015541288 [0,1,0,0,0,1|2,0,0]=4 6489 B16R1.20029 COc1cc(c(cc1F)F)SCCC(=O)N 62a_200015541288_100000744528 [0,1,0,0,0,1|2,0,0]=4 6490 B16R1.20029 COc1cc(c(cc1F)F)SCOC(=O)C 62a_100000076356_200015541288 [0,1,0,0,0,1|2,0,0]=4 6491 B16R1.20029 COc1cc(c(cc1F)F)SCOC(=O)C 62a_200015541288_100000076356 [0,1,0,0,0,1|2,0,0]=4 6492 B16R1.20029 COc1cc(c(cc1F)N)SCCC(=O)C 62a_100000053229_100010365326 [0,1,0,0,0,1|1,0,0]=3 6493 B16R1.20029 COc1cc(c(cc1F)N)SCCC(=O)C 62a_100010365326_100000053229 [0,1,0,0,0,1|1,0,0]=3 6494 B16R1.20029 COc1cc(c(cc1F)N)SCCC(=O)N 62a_100000744528_100010365326 [0,1,0,0,0,1|2,0,0]=4 6495 B16R1.20029 COc1cc(c(cc1F)N)SCCC(=O)N 62a_100010365326_100000744528 [0,1,0,0,0,1|2,0,0]=4 6496 B16R1.20029 COc1cc(c(cc1F)N)SCOC(=O)C 62a_100000076356_100010365326 [0,1,0,0,0,1|2,0,0]=4 6497 B16R1.20029 COc1cc(c(cc1F)N)SCOC(=O)C 62a_100010365326_100000076356 [0,1,0,0,0,1|2,0,0]=4 6498 B16R1.20029 COc1cc(c(cc1N)C)SCCC(=O)C 62a_100000053229_100010141321 [0,1,0,0,0,1|1,0,0]=3 6499 B16R1.20029 COc1cc(c(cc1N)C)SCCC(=O)C 62a_100010141321_100000053229 [0,1,0,0,0,1|1,0,0]=3 6500 B16R1.20029 COc1cc(c(cc1N)C)SCCC(=O)N 62a_100000744528_100010141321 [0,1,0,0,0,1|2,0,0]=4 6501 B16R1.20029 COc1cc(c(cc1N)C)SCCC(=O)N 62a_100010141321_100000744528 [0,1,0,0,0,1|2,0,0]=4 6502 B16R1.20029 COc1cc(c(cc1N)C)SCOC(=O)C 62a_100000076356_100010141321 [0,1,0,0,0,1|2,0,0]=4 6503 B16R1.20029 COc1cc(c(cc1N)C)SCOC(=O)C 62a_100010141321_100000076356 [0,1,0,0,0,1|2,0,0]=4 6504 B16R1.20029 COc1cc(c(cc1N)F)SCCC(=O)C 62a_100000053229_100012766639 [0,1,0,0,0,1|1,0,0]=3 6505 B16R1.20029 COc1cc(c(cc1N)F)SCCC(=O)C 62a_100012766639_100000053229 [0,1,0,0,0,1|1,0,0]=3 6506 B16R1.20029 COc1cc(c(cc1N)F)SCCC(=O)N 62a_100000744528_100012766639 [0,1,0,0,0,1|2,0,0]=4 6507 B16R1.20029 COc1cc(c(cc1N)F)SCCC(=O)N 62a_100012766639_100000744528 [0,1,0,0,0,1|2,0,0]=4 6508 B16R1.20029 COc1cc(c(cc1N)F)SCOC(=O)C 62a_100000076356_100012766639 [0,1,0,0,0,1|2,0,0]=4 6509 B16R1.20029 COc1cc(c(cc1N)F)SCOC(=O)C 62a_100012766639_100000076356 [0,1,0,0,0,1|2,0,0]=4 6510 B16R1.20029 COc1cc(c(cc1O)Br)C=NNC(=O)C 4a_100000189765_100000741691 [0,1,0,0,0,1|1,0,1]=4 6511 B16R1.20029 COc1cc(c(cc1O)F)SCC=C(C)C 62a_100000761012_100010189133 [0,1,0,0,0,1|1,0,1]=4 6512 B16R1.20029 COc1cc(c(cc1O)F)SCCC(=O)C 62a_100000053229_100010189133 [0,1,0,0,0,1|0,0,0]=2 6513 B16R1.20029 COc1cc(c(cc1O)F)SCCC(=O)N 62a_100000744528_100010189133 [0,1,0,0,0,1|1,0,0]=3 6514 B16R1.20029 COc1cc(c(cc1O)F)SCCC(C)C 62a_100000210312_100010189133 [0,1,0,0,0,1|1,0,1]=4 6515 B16R1.20029 COc1cc(c(cc1O)F)SCCC(C)O 62a_100012276601_100010189133 [0,1,0,0,0,1|0,0,2]=4 6516 B16R1.20029 COc1cc(c(cc1O)F)SCOC(=O)C 62a_100000076356_100010189133 [0,1,0,0,0,1|1,0,0]=3 6517 B16R1.20029 COc1cc(c(nc1N)C)SCCC(=O)C 62a_100000053229_200010892190 [0,1,0,0,0,1|2,0,0]=4 6518 B16R1.20029 COc1cc(c(nc1N)C)SCCC(=O)C 62a_200010892190_100000053229 [0,1,0,0,0,1|2,0,0]=4 6519 B16R1.33579 C=C(C)CCNc1ccc(c(c1F)OC)F 34a_100137314619_100000730704 [0,1,0,0,0,1|2,0,0]=4 6520 B16R1.33579 C=C(C)CCOc1ccc(c(c1F)OC)F 34a_100000062073_100000730704 [0,1,0,0,0,1|2,0,0]=4 6521 B16R1.33579 C=C(C)CCOc1ccc(c(c1F)OC)F 7a_100000062073_100000730704 [0,1,0,0,0,1|2,0,0]=4 6522 B16R1.33579 C=C(C)CCSc1ccc(c(c1F)OC)Cl 62a_100000730704_200135222481 [0,1,0,0,0,1|2,0,0]=4 6523 B16R1.33579 C=C(C)CCSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000730704 [0,1,0,0,0,1|2,0,0]=4 6524 B16R1.33579 C=C(C)CCSc1ccc(c(c1F)OC)N 62a_100000730704_100010734149 [0,1,0,0,0,1|2,0,0]=4 6525 B16R1.33579 C=C(C)CCSc1ccc(c(c1F)OC)N 62a_100010734149_100000730704 [0,1,0,0,0,1|2,0,0]=4 6526 B16R1.33579 C=C(C)CNCc1ccc(c(c1F)OC)Cl 34a_200009889119_100000748629 [0,1,0,0,0,1|2,0,0]=4 6527 B16R1.33579 C=C(C)CNCc1ccc(c(c1F)OC)F 34a_115082355467_100000748629 [0,1,0,0,0,1|2,0,0]=4 6528 B16R1.33579 C=C(C)COCc1ccc(c(c1F)OC)Cl 34a_100000210245_100010116237 [0,1,0,0,0,1|2,0,0]=4 6529 B16R1.33579 C=C(C)COCc1ccc(c(c1F)OC)Cl 34a_100009889115_100000748629 [0,1,0,0,0,1|2,0,0]=4 6530 B16R1.33579 C=C(C)COCc1ccc(c(c1F)OC)Cl 7a_100009889115_100000748629 [0,1,0,0,0,1|2,0,0]=4 6531 B16R1.33579 C=C(C)COCc1ccc(c(c1F)OC)F 34a_100000081355_100000748629 [0,1,0,0,0,1|2,0,0]=4 6532 B16R1.33579 C=C(C)COCc1ccc(c(c1F)OC)F 34a_100000210245_100009814548 [0,1,0,0,0,1|2,0,0]=4 6533 B16R1.33579 C=C(C)COCc1ccc(c(c1F)OC)F 7a_100000081355_100000748629 [0,1,0,0,0,1|2,0,0]=4 6534 B16R1.33579 C=C(C)CSCc1ccc(c(c1F)OC)Cl 62a_100000748629_100010116237 [0,1,0,0,0,1|2,0,0]=4 6535 B16R1.33579 C=C(C)CSCc1ccc(c(c1F)OC)Cl 62a_100010116237_100000211660 [0,1,0,0,0,1|2,0,0]=4 6536 B16R1.33579 C=C(C)CSCc1ccc(c(c1F)OC)F 62a_100000748629_100009814548 [0,1,0,0,0,1|2,0,0]=4 6537 B16R1.33579 C=C(C)CSCc1ccc(c(c1F)OC)F 62a_100009814548_100000211660 [0,1,0,0,0,1|2,0,0]=4 6538 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)N)Cl 2230a_100000711301_100010116237 [0,1,0,0,0,1|2,0,0]=4 6539 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)N)Cl 34a_200009889119_100000187820 [0,1,0,0,0,1|2,0,0]=4 6540 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)N)F 2230a_100000711301_100009814548 [0,1,0,0,0,1|2,0,0]=4 6541 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)N)F 34a_115082355467_100000187820 [0,1,0,0,0,1|2,0,0]=4 6542 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)O)Cl 269956a_100016091260_100010116237 [0,1,0,0,0,1|2,0,0]=4 6543 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)O)F 269956a_100016091260_100009814548 [0,1,0,0,0,1|2,0,0]=4 6544 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)[O-])Cl 34a_200009889119_100020667443 [0,1,0,0,0,1|2,0,0]=4 6545 B16R1.33579 COc1c(ccc(c1F)CNCC(=O)[O-])F 34a_115082355467_100020667443 [0,1,0,0,0,1|2,0,0]=4 6546 B16R1.33579 COc1c(ccc(c1F)COCC(=O)C)Cl 34a_100000211253_100010116237 [0,1,0,0,0,1|1,0,0]=3 6547 B16R1.33579 COc1c(ccc(c1F)COCC(=O)C)F 34a_100000211253_100009814548 [0,1,0,0,0,1|1,0,0]=3 6548 B16R1.33579 COc1c(ccc(c1F)COCC(=O)N)Cl 34a_100009889115_100000187820 [0,1,0,0,0,1|2,0,0]=4 6549 B16R1.33579 COc1c(ccc(c1F)COCC(=O)N)Cl 7a_100009889115_100000187820 [0,1,0,0,0,1|2,0,0]=4 6550 B16R1.33579 COc1c(ccc(c1F)COCC(=O)N)F 34a_100000081355_100000187820 [0,1,0,0,0,1|2,0,0]=4 6551 B16R1.33579 COc1c(ccc(c1F)COCC(=O)N)F 7a_100000081355_100000187820 [0,1,0,0,0,1|2,0,0]=4 6552 B16R1.33579 COc1c(ccc(c1F)COCC(=O)[O-])Cl 34a_100009889115_100020667443 [0,1,0,0,0,1|2,0,0]=4 6553 B16R1.33579 COc1c(ccc(c1F)COCC(=O)[O-])F 34a_100000081355_100020667443 [0,1,0,0,0,1|2,0,0]=4 6554 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)N)Cl 62a_100000747473_100010116237 [0,1,0,0,0,1|2,0,0]=4 6555 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)N)Cl 62a_100010116237_100000747473 [0,1,0,0,0,1|2,0,0]=4 6556 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)N)F 62a_100000747473_100009814548 [0,1,0,0,0,1|2,0,0]=4 6557 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)N)F 62a_100009814548_100000747473 [0,1,0,0,0,1|2,0,0]=4 6558 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)[O-])Cl 62a_100010116237_100020667443 [0,1,0,0,0,1|2,0,0]=4 6559 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)[O-])Cl 62a_100020667443_100010116237 [0,1,0,0,0,1|2,0,0]=4 6560 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)[O-])F 62a_100009814548_100020667443 [0,1,0,0,0,1|2,0,0]=4 6561 B16R1.33579 COc1c(ccc(c1F)CSCC(=O)[O-])F 62a_100020667443_100009814548 [0,1,0,0,0,1|2,0,0]=4 6562 B16R1.33579 COc1c(ccc(c1F)NCCC(=O)N)F 34a_100137314619_100000731001 [0,1,0,0,0,1|2,0,0]=4 6563 B16R1.33579 COc1c(ccc(c1F)NCOC(=O)C)F 34a_100137314619_100009813279 [0,1,0,0,0,1|2,0,0]=4 6564 B16R1.33579 COc1c(ccc(c1F)OCCC(=O)C)F 7a_100000062073_100000053229 [0,1,0,0,0,1|1,0,0]=3 6565 B16R1.33579 COc1c(ccc(c1F)OCCC(=O)N)F 34a_100000062073_100000731001 [0,1,0,0,0,1|2,0,0]=4 6566 B16R1.33579 COc1c(ccc(c1F)OCCC(=O)N)F 7a_100000062073_100000744528 [0,1,0,0,0,1|2,0,0]=4 6567 B16R1.33579 COc1c(ccc(c1F)OCOC(=O)C)F 34a_100000062073_100009813279 [0,1,0,0,0,1|2,0,0]=4 6568 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)C)Cl 62a_100000053229_200135222481 [0,1,0,0,0,1|1,0,0]=3 6569 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)C)Cl 62a_200135222481_100000053229 [0,1,0,0,0,1|1,0,0]=3 6570 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)C)N 62a_100000053229_100010734149 [0,1,0,0,0,1|1,0,0]=3 6571 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)C)N 62a_100010734149_100000053229 [0,1,0,0,0,1|1,0,0]=3 6572 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)N)Cl 62a_100000744528_200135222481 [0,1,0,0,0,1|2,0,0]=4 6573 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)N)Cl 62a_200135222481_100000744528 [0,1,0,0,0,1|2,0,0]=4 6574 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)N)N 62a_100000744528_100010734149 [0,1,0,0,0,1|2,0,0]=4 6575 B16R1.33579 COc1c(ccc(c1F)SCCC(=O)N)N 62a_100010734149_100000744528 [0,1,0,0,0,1|2,0,0]=4 6576 B16R1.33579 COc1c(ccc(c1F)SCOC(=O)C)Cl 62a_100000076356_200135222481 [0,1,0,0,0,1|2,0,0]=4 6577 B16R1.33579 COc1c(ccc(c1F)SCOC(=O)C)Cl 62a_200135222481_100000076356 [0,1,0,0,0,1|2,0,0]=4 6578 B16R1.33579 COc1c(ccc(c1F)SCOC(=O)C)N 62a_100000076356_100010734149 [0,1,0,0,0,1|2,0,0]=4 6579 B16R1.33579 COc1c(ccc(c1F)SCOC(=O)C)N 62a_100010734149_100000076356 [0,1,0,0,0,1|2,0,0]=4 6580 B16R1.33579 COc1c(ccc(c1O)C=NNC(=O)C)O 4a_100000189765_100009834984 [0,1,0,0,0,1|1,0,1]=4 6581 B16R1.33579 COc1c(cnc(c1C)COCC(=O)C)C 34a_100000211253_100000737168 [0,1,0,0,0,1|2,0,0]=4 6582 B16R1.33579 CSc1c(ccc(c1F)SCCC(=O)C)F 62a_100000053229_202125771753 [0,1,0,0,0,1|1,1,0]=4 6583 B16R1.33579 CSc1c(ccc(c1F)SCCC(=O)C)F 62a_202125771753_100000053229 [0,1,0,0,0,1|1,1,0]=4 6584 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 6585 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 6586 B16R1.404 COc1cc(cc(c1O)Cl)C(=O)CC(=O)N 1458a_100000209947_100000187820 [0,2,0,0,0,0|1,0,1]=4 6587 B16R1.404 COc1cc(cc(c1O)Cl)C(=O)CC(=O)[O-] 1458a_100000209947_100020667443 [0,2,0,0,0,0|1,0,1]=4 6588 B16R1.404 COc1cc(cc(c1O)O)C(=O)CC(=O)N 1458a_100000061230_100000187820 [0,2,0,0,0,0|1,0,1]=4 6589 B16R1.404 COc1cc(cc(c1O)O)C(=O)CC(=O)[O-] 1458a_100000061230_100020667443 [0,2,0,0,0,0|1,0,1]=4 6590 B16R1.405 CCc1cc(cc(c1O)C)SC(C)C(=O)C 62a_100009814033_100010659108 [0,2,0,0,0,0|2,0,0]=4 6591 B16R1.405 COc1cc(cc(c1Cl)Br)NC(C)C(=O)C 2230a_100010131419_100009814033 [0,2,0,0,0,0|2,0,0]=4 6592 B16R1.405 COc1cc(cc(c1Cl)Br)NC(C)C(=O)C 7a_100010131419_100000179758 [0,2,0,0,0,0|2,0,0]=4 6593 B16R1.405 COc1cc(cc(c1F)C)SC(C)C(=O)C 62a_100009814033_100010271686 [0,2,0,0,0,0|2,0,0]=4 6594 B16R1.405 COc1cc(cc(c1F)C)SC(C)C(=O)C 62a_100010271686_100009814033 [0,2,0,0,0,0|2,0,0]=4 6595 B16R1.405 COc1cc(cc(c1F)F)SC(C)C(=O)C 62a_100009814033_100011218012 [0,2,0,0,0,0|2,0,0]=4 6596 B16R1.405 COc1cc(cc(c1F)F)SC(C)C(=O)C 62a_100011218012_100009814033 [0,2,0,0,0,0|2,0,0]=4 6597 B16R1.405 COc1cc(cc(c1F)O)SC(C)C(=O)C 62a_100009814033_200015524394 [0,2,0,0,0,0|2,0,0]=4 6598 B16R1.405 COc1cc(cc(c1F)O)SC(C)C(=O)C 62a_200015524394_100009814033 [0,2,0,0,0,0|2,0,0]=4 6599 B16R1.405 COc1cc(cc(c1N)C)SC(C)C(=O)C 62a_100000741850_100009814033 [0,2,0,0,0,0|2,0,0]=4 6600 B16R1.405 COc1cc(cc(c1N)C)SC(C)C(=O)C 62a_100009814033_100000741850 [0,2,0,0,0,0|2,0,0]=4 6601 B16R1.405 COc1cc(cc(c1O)O)SC(C)C(=O)C 62a_100009814033_200159242197 [0,2,0,0,0,0|1,0,0]=3 6602 B16R1.405 COc1cc(cc(c1O)O)SC(C)C(=O)N 62a_100000702099_200159242197 [0,2,0,0,0,0|2,0,0]=4 6603 B16R1.405 COc1cc(cc(c1O)O)SC(F)C(=O)N 62a_100009813875_200159242197 [0,2,0,0,0,0|2,0,0]=4 6604 B16R1.405 COc1cc(cc(c1O)O)SC(F)C(=O)[O-] 62a_100020610796_200159242197 [0,2,0,0,0,0|2,0,0]=4 6605 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)Br 1458a_100015195021_100000210202 [0,2,0,0,0,0|0,0,2]=4 6606 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)Br 6a_100000186746_100000211110 [0,2,0,0,0,0|0,0,2]=4 6607 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)C 6a_100000050991_100000211110 [0,2,0,0,0,0|0,0,2]=4 6608 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)Cl 6a_100000010622_100000211110 [0,2,0,0,0,0|0,0,2]=4 6609 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)F 6a_100000039941_100000211110 [0,2,0,0,0,0|0,0,2]=4 6610 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)I 1458a_200021160827_100000210202 [0,2,0,0,0,0|0,0,2]=4 6611 B16R1.407 CCC(=O)C=Cc1cc(c(c(c1)OC)O)I 6a_100000184534_100000211110 [0,2,0,0,0,0|0,0,2]=4 6612 B16R1.407 CCC(=O)CNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000747405 [0,2,0,0,0,0|2,0,0]=4 6613 B16R1.407 CCC(=O)CSc1cc(c(c(c1)CC)O)C 62a_100000747405_100010659108 [0,2,0,0,0,0|2,0,0]=4 6614 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)F)C 62a_100000747405_100010271686 [0,2,0,0,0,0|2,0,0]=4 6615 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000747405 [0,2,0,0,0,0|2,0,0]=4 6616 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)F)F 62a_100000747405_100011218012 [0,2,0,0,0,0|2,0,0]=4 6617 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000747405 [0,2,0,0,0,0|2,0,0]=4 6618 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)F)O 62a_100000747405_200015524394 [0,2,0,0,0,0|2,0,0]=4 6619 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000747405 [0,2,0,0,0,0|2,0,0]=4 6620 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000747405 [0,2,0,0,0,0|2,0,0]=4 6621 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)N)C 62a_100000747405_100000741850 [0,2,0,0,0,0|2,0,0]=4 6622 B16R1.407 CCC(=O)CSc1cc(c(c(c1)OC)O)O 62a_100000747405_200159242197 [0,2,0,0,0,0|1,0,0]=3 6623 B16R1.407 CCc1cc(cc(c1O)C)SCC(=O)NC 62a_100000183359_100010659108 [0,2,0,0,0,0|2,0,0]=4 6624 B16R1.407 CCc1cc(cc(c1O)C)SCC(=O)OC 62a_100000747449_100010659108 [0,2,0,0,0,0|2,0,0]=4 6625 B16R1.407 CNC(=O)C=Cc1cc(c(c(c1)OC)O)Br 240690a_100102657272_100015195021 [0,2,0,0,0,0|0,0,2]=4 6626 B16R1.407 CNC(=O)C=Cc1cc(c(c(c1)OC)O)I 240690a_100102657272_200021160827 [0,2,0,0,0,0|0,0,2]=4 6627 B16R1.407 CNC(=O)CNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000183359 [0,2,0,0,0,0|2,0,0]=4 6628 B16R1.407 CNC(=O)CNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000183359 [0,2,0,0,0,0|2,0,0]=4 6629 B16R1.407 CNC(=O)CNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000183359 [0,2,0,0,0,0|2,0,0]=4 6630 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)F)C 62a_100000183359_100010271686 [0,2,0,0,0,0|2,0,0]=4 6631 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000183359 [0,2,0,0,0,0|2,0,0]=4 6632 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)F)F 62a_100000183359_100011218012 [0,2,0,0,0,0|2,0,0]=4 6633 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000183359 [0,2,0,0,0,0|2,0,0]=4 6634 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)F)O 62a_100000183359_200015524394 [0,2,0,0,0,0|2,0,0]=4 6635 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000183359 [0,2,0,0,0,0|2,0,0]=4 6636 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)N)C 62a_100000183359_100000741850 [0,2,0,0,0,0|2,0,0]=4 6637 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000183359 [0,2,0,0,0,0|2,0,0]=4 6638 B16R1.407 CNC(=O)CSc1cc(c(c(c1)OC)O)O 62a_100000183359_200159242197 [0,2,0,0,0,0|1,0,0]=3 6639 B16R1.407 COC(=O)CNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000747449 [0,2,0,0,0,0|2,0,0]=4 6640 B16R1.407 COC(=O)CNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000747449 [0,2,0,0,0,0|2,0,0]=4 6641 B16R1.407 COC(=O)CNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000747449 [0,2,0,0,0,0|2,0,0]=4 6642 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)F)C 62a_100000747449_100010271686 [0,2,0,0,0,0|2,0,0]=4 6643 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000747449 [0,2,0,0,0,0|2,0,0]=4 6644 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)F)F 62a_100000747449_100011218012 [0,2,0,0,0,0|2,0,0]=4 6645 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000747449 [0,2,0,0,0,0|2,0,0]=4 6646 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)F)O 62a_100000747449_200015524394 [0,2,0,0,0,0|2,0,0]=4 6647 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000747449 [0,2,0,0,0,0|2,0,0]=4 6648 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000747449 [0,2,0,0,0,0|2,0,0]=4 6649 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)N)C 62a_100000747449_100000741850 [0,2,0,0,0,0|2,0,0]=4 6650 B16R1.407 COC(=O)CSc1cc(c(c(c1)OC)O)O 62a_100000747449_200159242197 [0,2,0,0,0,0|1,0,0]=3 6651 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CBr 6a_100000186746_100009888967 [0,2,0,0,0,0|0,0,2]=4 6652 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CCl 6a_100000186746_100000086384 [0,2,0,0,0,0|0,0,2]=4 6653 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CF 1458a_100015195021_100015361967 [0,2,0,0,0,0|0,0,2]=4 6654 B16R1.407 COc1cc(cc(c1O)Br)C=CC(=O)CF 6a_100000186746_100000764096 [0,2,0,0,0,0|0,0,2]=4 6655 B16R1.407 COc1cc(cc(c1O)C)C=CC(=O)CBr 6a_100000050991_100009888967 [0,2,0,0,0,0|0,0,2]=4 6656 B16R1.407 COc1cc(cc(c1O)C)C=CC(=O)CCl 6a_100000050991_100000086384 [0,2,0,0,0,0|0,0,2]=4 6657 B16R1.407 COc1cc(cc(c1O)C)C=CC(=O)CF 6a_100000050991_100000764096 [0,2,0,0,0,0|0,0,2]=4 6658 B16R1.407 COc1cc(cc(c1O)Cl)C=CC(=O)CBr 6a_100000010622_100009888967 [0,2,0,0,0,0|0,0,2]=4 6659 B16R1.407 COc1cc(cc(c1O)Cl)C=CC(=O)CCl 6a_100000010622_100000086384 [0,2,0,0,0,0|0,0,2]=4 6660 B16R1.407 COc1cc(cc(c1O)Cl)C=CC(=O)CF 6a_100000010622_100000764096 [0,2,0,0,0,0|0,0,2]=4 6661 B16R1.407 COc1cc(cc(c1O)F)C=CC(=O)CBr 6a_100000039941_100009888967 [0,2,0,0,0,0|0,0,2]=4 6662 B16R1.407 COc1cc(cc(c1O)F)C=CC(=O)CCl 6a_100000039941_100000086384 [0,2,0,0,0,0|0,0,2]=4 6663 B16R1.407 COc1cc(cc(c1O)F)C=CC(=O)CF 6a_100000039941_100000764096 [0,2,0,0,0,0|0,0,2]=4 6664 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CBr 6a_100000184534_100009888967 [0,2,0,0,0,0|0,0,2]=4 6665 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CCl 6a_100000184534_100000086384 [0,2,0,0,0,0|0,0,2]=4 6666 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CF 1458a_200021160827_100015361967 [0,2,0,0,0,0|0,0,2]=4 6667 B16R1.407 COc1cc(cc(c1O)I)C=CC(=O)CF 6a_100000184534_100000764096 [0,2,0,0,0,0|0,0,2]=4 6668 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 11a_100000748475_100015343762 [0,2,0,0,0,0|1,0,0]=3 6669 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 1626a_100000748475_100015343762 [0,2,0,0,0,0|1,0,0]=3 6670 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 240690a_100000748475_100015343762 [0,2,0,0,0,0|1,0,0]=3 6671 B16R1.414 COc1cc(cc(c1OC)Br)CNC(=O)C 527a_100000748475_100103153847 [0,2,0,0,0,0|1,0,0]=3 6672 B16R1.414 COc1cc(cc(c1OC)Cl)C=CC(=O)C 1458a_100000184590_200000210301 [0,2,0,0,0,0|0,0,2]=4 6673 B16R1.414 COc1cc(cc(c1OC)Cl)C=CC(=O)[13CH3] 1458a_100000184590_200025704644 [0,2,0,0,0,0|0,0,2]=4 6674 B16R1.423 C=C(C)CSc1cc(c(c(c1)OC)O)C=O 62a_100000748629_100000047136 [0,2,0,0,0,0|2,0,0]=4 6675 B16R1.423 C=C(C)CSc1cc(c(c(c1)OC)O)CO 62a_100000748629_100000185604 [0,2,0,0,0,0|2,0,0]=4 6676 B16R1.423 COc1cc(cc(c1O)C=O)SCC(=O)N 62a_100000747473_100000047136 [0,2,0,0,0,0|2,0,0]=4 6677 B16R1.423 COc1cc(cc(c1O)C=O)SCC(=O)[O-] 62a_100020667443_100000047136 [0,2,0,0,0,0|2,0,0]=4 6678 B16R1.423 COc1cc(cc(c1O)CO)SCC(=O)N 62a_100000747473_100000185604 [0,2,0,0,0,0|2,0,0]=4 6679 B16R1.423 COc1cc(cc(c1O)CO)SCC(=O)[O-] 62a_100020667443_100000185604 [0,2,0,0,0,0|2,0,0]=4 6680 B16R1.423 COc1cc(cc(c1O)OC)C=CC(=O)C 1458a_100000764192_200000210301 [0,2,0,0,0,0|0,0,2]=4 6681 B16R1.423 COc1cc(cc(c1O)OC)C=CC(=O)[13CH3] 1458a_100000764192_200025704644 [0,2,0,0,0,0|0,0,2]=4 6682 B16R1.423 COc1cc(cc(c1O)OC)CCC(=O)C 1458a_100000024749_200000210301 [0,2,0,0,0,0|0,0,0]=2 6683 B16R1.423 COc1cc(cc(c1O)OC)CCC(=O)[13CH3] 1458a_100000024749_200025704644 [0,2,0,0,0,0|0,0,0]=2 6684 B16R1.4035 CCOc1cc(cc(c1O)Cl)C=CC(=O)C 1458a_100015194376_200000210301 [0,2,0,0,0,0|0,0,2]=4 6685 B16R1.4035 CCOc1cc(cc(c1O)Cl)C=CC(=O)[13CH3] 1458a_100015194376_200025704644 [0,2,0,0,0,0|0,0,2]=4 6686 B16R1.1097 C=C(C)CSc1ccc(c(c1)C(=O)OC)O 62a_100000748629_100000149868 [0,2,0,0,0,0|2,0,0]=4 6687 B16R1.1097 COC(=O)c1cc(ccc1Cl)CNC(=O)C 188690a_100016988414_100015343762 [0,2,0,0,0,0|2,0,0]=4 6688 B16R1.1097 COC(=O)c1cc(ccc1O)CNC(=O)C 188690a_100000068129_100015343762 [0,2,0,0,0,0|1,0,0]=3 6689 B16R1.1097 COC(=O)c1cc(ccc1O)SCC(=O)N 62a_100000747473_100000149868 [0,2,0,0,0,0|2,0,0]=4 6690 B16R1.1097 COC(=O)c1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000149868 [0,2,0,0,0,0|2,0,0]=4 6691 B16R1.10273 C=C(C)CSc1ccc(c(c1)COC)OC 62a_100000748629_200011493686 [0,2,0,0,0,0|2,0,0]=4 6692 B16R1.10273 C=C(C)CSc1ccc(c(c1)COC)OC 62a_200011493686_100000211660 [0,2,0,0,0,0|2,0,0]=4 6693 B16R1.10273 CCOc1cc(ccc1OC)C=CC(=O)C 1458a_100000184759_200000210301 [0,2,0,0,0,0|0,0,2]=4 6694 B16R1.10273 CCOc1cc(ccc1OC)C=CC(=O)[13CH3] 1458a_100000184759_200025704644 [0,2,0,0,0,0|0,0,2]=4 6695 B16R1.10273 CCOc1cc(ccc1OC)CCC(=O)C 1458a_200011356518_200000210301 [0,2,0,0,0,0|0,0,0]=2 6696 B16R1.10273 CCOc1cc(ccc1OC)CCC(=O)[13CH3] 1458a_200011356518_200025704644 [0,2,0,0,0,0|0,0,0]=2 6697 B16R1.10273 CCOc1cc(ccc1OC)CCC(C)O 34a_100012377587_200000210301 [0,2,0,0,0,0|0,0,2]=4 6698 B16R1.10273 CCOc1cc(ccc1OC)CCC(C)O 7a_100012377587_200000210301 [0,2,0,0,0,0|0,0,2]=4 6699 B16R1.10273 CCOc1cc(ccc1OC)CC[N+](=O)[O-] 34a_200000077489_100000210202 [0,2,0,0,0,0|2,0,0]=4 6700 B16R1.10273 CCOc1cc(ccc1OC)CC[N+](=O)[O-] 7a_200000077489_100000210202 [0,2,0,0,0,0|2,0,0]=4 6701 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 11a_100000755831_100015343762 [0,2,0,0,0,0|1,0,0]=3 6702 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 1626a_100000755831_100015343762 [0,2,0,0,0,0|1,0,0]=3 6703 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 240690a_100000755831_100015343762 [0,2,0,0,0,0|1,0,0]=3 6704 B16R1.10273 CCOc1cc(ccc1OC)CNC(=O)C 527a_100000755831_100103153847 [0,2,0,0,0,0|1,0,0]=3 6705 B16R1.10273 CCOc1cc(ccc1O[13CH3])CCC(C)O 34a_100012377587_200025704644 [0,2,0,0,0,0|0,0,2]=4 6706 B16R1.10273 CCOc1cc(ccc1O[13CH3])CCC(C)O 7a_100012377587_200025704644 [0,2,0,0,0,0|0,0,2]=4 6707 B16R1.10273 COCc1cc(ccc1OC)SCC(=O)N 62a_100000747473_200011493686 [0,2,0,0,0,0|2,0,0]=4 6708 B16R1.10273 COCc1cc(ccc1OC)SCC(=O)N 62a_200011493686_100000747473 [0,2,0,0,0,0|2,0,0]=4 6709 B16R1.10273 COCc1cc(ccc1OC)SCC(=O)[O-] 62a_100020667443_200011493686 [0,2,0,0,0,0|2,0,0]=4 6710 B16R1.10273 COCc1cc(ccc1OC)SCC(=O)[O-] 62a_200011493686_100020667443 [0,2,0,0,0,0|2,0,0]=4 6711 B16R1.10273 COc1ccc(cc1OCF)CC[N+](=O)[O-] 34a_200000077489_100015361967 [0,2,0,0,0,0|2,0,0]=4 6712 B16R1.10273 COc1ccc(cc1OCF)CC[N+](=O)[O-] 7a_200000077489_100015361967 [0,2,0,0,0,0|2,0,0]=4 6713 B16R1.12730 CCOc1cc(ccc1O)CNS(=O)(=O)C 40a_200000751567_100000738038 [0,2,0,0,0,0|2,0,0]=4 6714 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 6715 B16R1.12748 CCOc1cc(ccc1O)C(=O)CC(=O)N 1458a_100011260950_100000187820 [0,2,0,0,0,0|1,0,1]=4 6716 B16R1.12748 CCOc1cc(ccc1O)C(=O)CC(=O)[O-] 1458a_100011260950_100020667443 [0,2,0,0,0,0|1,0,1]=4 6717 B16R1.12749 CCOc1cc(ccc1Br)NC(C)C(=O)C 2230a_200016990551_100009814033 [0,2,0,0,0,0|2,0,0]=4 6718 B16R1.12749 CCOc1cc(ccc1Br)NC(C)C(=O)C 7a_200016990551_100000179758 [0,2,0,0,0,0|2,0,0]=4 6719 B16R1.12749 CCOc1cc(ccc1C)SC(C)C(=O)C 62a_100009814033_100012361169 [0,2,0,0,0,0|2,0,0]=4 6720 B16R1.12749 CCOc1cc(ccc1C)SC(C)C(=O)C 62a_100012361169_100009814033 [0,2,0,0,0,0|2,0,0]=4 6721 B16R1.12749 CCOc1cc(ccc1Cl)NC(C)C(=O)C 2230a_100011964961_100009814033 [0,2,0,0,0,0|2,0,0]=4 6722 B16R1.12749 CCOc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_200012344967 [0,2,0,0,0,0|2,0,0]=4 6723 B16R1.12749 CCOc1cc(ccc1F)SC(C)C(=O)C 62a_200012344967_100009814033 [0,2,0,0,0,0|2,0,0]=4 6724 B16R1.12749 CCOc1cc(ccc1N)SC(C)C(=O)C 62a_100000688918_100009814033 [0,2,0,0,0,0|2,0,0]=4 6725 B16R1.12749 CNCc1cc(ccc1O)SC(C)C(=O)C 62a_100009814033_100011602694 [0,2,0,0,0,0|2,0,0]=4 6726 B16R1.12749 CNCc1cc(ccc1O)SC(C)C(=O)C 62a_100011602694_100009814033 [0,2,0,0,0,0|2,0,0]=4 6727 B16R1.12749 COCc1cc(ccc1Br)SC(C)C(=O)C 62a_100009814033_202125822959 [0,2,0,0,0,0|2,0,0]=4 6728 B16R1.12749 COCc1cc(ccc1Br)SC(C)C(=O)C 62a_202125822959_100009814033 [0,2,0,0,0,0|2,0,0]=4 6729 B16R1.12749 COCc1cc(ccc1F)SC(C)C(=O)C 62a_100009814033_100010140362 [0,2,0,0,0,0|2,0,0]=4 6730 B16R1.12749 COCc1cc(ccc1F)SC(C)C(=O)C 62a_100010140362_100009814033 [0,2,0,0,0,0|2,0,0]=4 6731 B16R1.12750 C=CC(=O)NCc1ccc(c(c1)OCC)O 240690a_200000751567_200121576911 [0,2,0,0,0,0|1,0,1]=4 6732 B16R1.12750 CCC(=O)CSc1ccc(c(c1)CNC)O 62a_100000747405_100011602694 [0,2,0,0,0,0|2,0,0]=4 6733 B16R1.12750 CCC(=O)CSc1ccc(c(c1)CNC)O 62a_100011602694_100000747405 [0,2,0,0,0,0|2,0,0]=4 6734 B16R1.12750 CCC(=O)CSc1ccc(c(c1)COC)Br 62a_100000747405_202125822959 [0,2,0,0,0,0|2,0,0]=4 6735 B16R1.12750 CCC(=O)CSc1ccc(c(c1)COC)Br 62a_202125822959_100000747405 [0,2,0,0,0,0|2,0,0]=4 6736 B16R1.12750 CCC(=O)CSc1ccc(c(c1)COC)F 62a_100000747405_100010140362 [0,2,0,0,0,0|2,0,0]=4 6737 B16R1.12750 CCC(=O)CSc1ccc(c(c1)COC)F 62a_100010140362_100000747405 [0,2,0,0,0,0|2,0,0]=4 6738 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)CC 7a_200016990551_100000747405 [0,2,0,0,0,0|2,0,0]=4 6739 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)NC 2230a_200016990551_100000183359 [0,2,0,0,0,0|2,0,0]=4 6740 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)NC 34a_200016990551_100000183359 [0,2,0,0,0,0|2,0,0]=4 6741 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)NC 7a_200016990551_100000183359 [0,2,0,0,0,0|2,0,0]=4 6742 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)OC 2230a_200016990551_100000747449 [0,2,0,0,0,0|2,0,0]=4 6743 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)OC 34a_200016990551_100000747449 [0,2,0,0,0,0|2,0,0]=4 6744 B16R1.12750 CCOc1cc(ccc1Br)NCC(=O)OC 7a_200016990551_100000747449 [0,2,0,0,0,0|2,0,0]=4 6745 B16R1.12750 CCOc1cc(ccc1C)SCC(=O)CC 62a_100000747405_100012361169 [0,2,0,0,0,0|2,0,0]=4 6746 B16R1.12750 CCOc1cc(ccc1C)SCC(=O)CC 62a_100012361169_100000747405 [0,2,0,0,0,0|2,0,0]=4 6747 B16R1.12750 CCOc1cc(ccc1C)SCC(=O)NC 62a_100000183359_100012361169 [0,2,0,0,0,0|2,0,0]=4 6748 B16R1.12750 CCOc1cc(ccc1C)SCC(=O)NC 62a_100012361169_100000183359 [0,2,0,0,0,0|2,0,0]=4 6749 B16R1.12750 CCOc1cc(ccc1C)SCC(=O)OC 62a_100000747449_100012361169 [0,2,0,0,0,0|2,0,0]=4 6750 B16R1.12750 CCOc1cc(ccc1C)SCC(=O)OC 62a_100012361169_100000747449 [0,2,0,0,0,0|2,0,0]=4 6751 B16R1.12750 CCOc1cc(ccc1Cl)NCC(=O)NC 2230a_100011964961_100000183359 [0,2,0,0,0,0|2,0,0]=4 6752 B16R1.12750 CCOc1cc(ccc1Cl)NCC(=O)NC 34a_100011964961_100000183359 [0,2,0,0,0,0|2,0,0]=4 6753 B16R1.12750 CCOc1cc(ccc1Cl)NCC(=O)OC 2230a_100011964961_100000747449 [0,2,0,0,0,0|2,0,0]=4 6754 B16R1.12750 CCOc1cc(ccc1Cl)NCC(=O)OC 34a_100011964961_100000747449 [0,2,0,0,0,0|2,0,0]=4 6755 B16R1.12750 CCOc1cc(ccc1F)SCC(=O)CC 62a_100000747405_200012344967 [0,2,0,0,0,0|2,0,0]=4 6756 B16R1.12750 CCOc1cc(ccc1F)SCC(=O)CC 62a_200012344967_100000747405 [0,2,0,0,0,0|2,0,0]=4 6757 B16R1.12750 CCOc1cc(ccc1F)SCC(=O)NC 62a_100000183359_200012344967 [0,2,0,0,0,0|2,0,0]=4 6758 B16R1.12750 CCOc1cc(ccc1F)SCC(=O)NC 62a_200012344967_100000183359 [0,2,0,0,0,0|2,0,0]=4 6759 B16R1.12750 CCOc1cc(ccc1F)SCC(=O)OC 62a_100000747449_200012344967 [0,2,0,0,0,0|2,0,0]=4 6760 B16R1.12750 CCOc1cc(ccc1F)SCC(=O)OC 62a_200012344967_100000747449 [0,2,0,0,0,0|2,0,0]=4 6761 B16R1.12750 CCOc1cc(ccc1N)SCC(=O)CC 62a_100000688918_100000747405 [0,2,0,0,0,0|2,0,0]=4 6762 B16R1.12750 CCOc1cc(ccc1N)SCC(=O)NC 62a_100000688918_100000183359 [0,2,0,0,0,0|2,0,0]=4 6763 B16R1.12750 CCOc1cc(ccc1N)SCC(=O)OC 62a_100000688918_100000747449 [0,2,0,0,0,0|2,0,0]=4 6764 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CC 11a_200000751567_100000210414 [0,2,0,0,0,0|1,0,0]=3 6765 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CC 240690a_200000751567_100000210414 [0,2,0,0,0,0|1,0,0]=3 6766 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CC 527a_200000751567_100000210414 [0,2,0,0,0,0|1,0,0]=3 6767 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CO 240690a_200000751567_100000210174 [0,2,0,0,0,0|1,0,0]=3 6768 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)CO 527a_200000751567_100000210174 [0,2,0,0,0,0|1,0,0]=3 6769 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 2708a_100102657272_200000751567 [0,2,0,0,0,0|1,0,0]=3 6770 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 2708a_200000751567_106832991635 [0,2,0,0,0,0|1,0,0]=3 6771 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 273464a_100102657272_200000751567 [0,2,0,0,0,0|1,0,0]=3 6772 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 273464a_200000751567_100102657272 [0,2,0,0,0,0|1,0,0]=3 6773 B16R1.12750 CCOc1cc(ccc1O)CNC(=O)NC 512a_106832991638_200000751567 [0,2,0,0,0,0|1,0,0]=3 6774 B16R1.12750 CNC(=O)CSc1ccc(c(c1)COC)Br 62a_100000183359_202125822959 [0,2,0,0,0,0|2,0,0]=4 6775 B16R1.12750 CNC(=O)CSc1ccc(c(c1)COC)Br 62a_202125822959_100000183359 [0,2,0,0,0,0|2,0,0]=4 6776 B16R1.12750 CNC(=O)CSc1ccc(c(c1)COC)F 62a_100000183359_100010140362 [0,2,0,0,0,0|2,0,0]=4 6777 B16R1.12750 CNC(=O)CSc1ccc(c(c1)COC)F 62a_100010140362_100000183359 [0,2,0,0,0,0|2,0,0]=4 6778 B16R1.12750 CNCc1cc(ccc1O)SCC(=O)NC 62a_100000183359_100011602694 [0,2,0,0,0,0|2,0,0]=4 6779 B16R1.12750 CNCc1cc(ccc1O)SCC(=O)NC 62a_100011602694_100000183359 [0,2,0,0,0,0|2,0,0]=4 6780 B16R1.12750 CNCc1cc(ccc1O)SCC(=O)OC 62a_100000747449_100011602694 [0,2,0,0,0,0|2,0,0]=4 6781 B16R1.12750 CNCc1cc(ccc1O)SCC(=O)OC 62a_100011602694_100000747449 [0,2,0,0,0,0|2,0,0]=4 6782 B16R1.12750 COCc1cc(ccc1Br)SCC(=O)OC 62a_100000747449_202125822959 [0,2,0,0,0,0|2,0,0]=4 6783 B16R1.12750 COCc1cc(ccc1Br)SCC(=O)OC 62a_202125822959_100000747449 [0,2,0,0,0,0|2,0,0]=4 6784 B16R1.12750 COCc1cc(ccc1F)SCC(=O)OC 62a_100000747449_100010140362 [0,2,0,0,0,0|2,0,0]=4 6785 B16R1.12750 COCc1cc(ccc1F)SCC(=O)OC 62a_100010140362_100000747449 [0,2,0,0,0,0|2,0,0]=4 6786 B16R1.1058 CC(=O)C(C)Sc1ccc(c(c1)C(C)C)O 62a_100000691460_100009814033 [0,2,0,0,0,0|2,0,0]=4 6787 B16R1.1058 CC(=O)C(C)Sc1ccc(c(c1)C(C)C)O 62a_100009814033_100000691460 [0,2,0,0,0,0|2,0,0]=4 6788 B16R1.1334 CCC(=O)CCc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000040362_100000210202 [0,2,0,0,0,0|2,0,0]=4 6789 B16R1.1334 CCC(=O)CSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000747405 [0,2,0,0,0,0|2,0,0]=4 6790 B16R1.1334 CCC(=O)CSc1ccc(c(c1)C(C)C)O 62a_100000747405_100000691460 [0,2,0,0,0,0|2,0,0]=4 6791 B16R1.1334 CNC(=O)CCc1ccc(c(c1)[N+](=O)[O-])O 240690a_100102657272_100000040362 [0,2,0,0,0,0|2,0,0]=4 6792 B16R1.1334 CNC(=O)CCc1ccc(c(c1)[N+](=O)[O-])O 527a_100102657272_100000040362 [0,2,0,0,0,0|2,0,0]=4 6793 B16R1.1334 CNC(=O)CSc1ccc(c(c1)C(C)C)O 62a_100000183359_100000691460 [0,2,0,0,0,0|2,0,0]=4 6794 B16R1.1334 CNC(=O)CSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000183359 [0,2,0,0,0,0|2,0,0]=4 6795 B16R1.1334 COC(=O)CSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000747449 [0,2,0,0,0,0|2,0,0]=4 6796 B16R1.1334 COC(=O)CSc1ccc(c(c1)C(C)C)O 62a_100000747449_100000691460 [0,2,0,0,0,0|2,0,0]=4 6797 B16R1.1334 O=C(CF)CCc1ccc(c(c1)[N+](=O)[O-])O 1458a_100000040362_100015361967 [0,2,0,0,0,0|2,0,0]=4 6798 B16R1.20027 COc1cc(c(cc1O)F)C(=O)CC(=O)C 1458a_100000070787_100010235139 [0,2,0,0,0,0|0,0,1]=3 6799 B16R1.20027 COc1cc(c(cc1O)F)[C@@H](N)CC(C)C 271570a_100015190218_100010189133 [0,2,0,0,0,0|1,0,1]=4 6800 B16R1.20028 COc1cc(c(cc1Br)Br)NC(C)C(=O)C 7a_100000718616_100000179758 [0,2,0,0,0,0|2,0,0]=4 6801 B16R1.20028 COc1cc(c(cc1Br)Br)SC(C)C(=O)C 62a_100009814033_200014006352 [0,2,0,0,0,0|2,0,0]=4 6802 B16R1.20028 COc1cc(c(cc1Br)Br)SC(C)C(=O)C 62a_200014006352_100009814033 [0,2,0,0,0,0|2,0,0]=4 6803 B16R1.20028 COc1cc(c(cc1Br)C)NC(C)C(=O)C 7a_100010232211_100000179758 [0,2,0,0,0,0|2,0,0]=4 6804 B16R1.20028 COc1cc(c(cc1Br)Cl)NC(C)C(=O)C 7a_100012361290_100000179758 [0,2,0,0,0,0|2,0,0]=4 6805 B16R1.20028 COc1cc(c(cc1C)Br)NC(C)C(=O)C 7a_100010244135_100000179758 [0,2,0,0,0,0|2,0,0]=4 6806 B16R1.20028 COc1cc(c(cc1C)N)SC(C)C(=O)C 62a_100009814033_200010584344 [0,2,0,0,0,0|2,0,0]=4 6807 B16R1.20028 COc1cc(c(cc1C)N)SC(C)C(=O)C 62a_200010584344_100009814033 [0,2,0,0,0,0|2,0,0]=4 6808 B16R1.20028 COc1cc(c(cc1Cl)Br)NC(C)C(=O)C 7a_100013022580_100000179758 [0,2,0,0,0,0|2,0,0]=4 6809 B16R1.20028 COc1cc(c(cc1Cl)C)NC(C)C(=O)C 2230a_100009858536_100009814033 [0,2,0,0,0,0|2,0,0]=4 6810 B16R1.20028 COc1cc(c(cc1Cl)C)NC(C)C(=O)C 7a_100009858536_100000179758 [0,2,0,0,0,0|2,0,0]=4 6811 B16R1.20028 COc1cc(c(cc1Cl)F)NC(C)C(=O)C 7a_100009872666_100000179758 [0,2,0,0,0,0|2,0,0]=4 6812 B16R1.20028 COc1cc(c(cc1Cl)F)SC(C)C(=O)C 62a_100009814033_100010739614 [0,2,0,0,0,0|2,0,0]=4 6813 B16R1.20028 COc1cc(c(cc1Cl)F)SC(C)C(=O)C 62a_100010739614_100009814033 [0,2,0,0,0,0|2,0,0]=4 6814 B16R1.20028 COc1cc(c(cc1F)Br)NC(C)C(=O)C 7a_100010208193_100000179758 [0,2,0,0,0,0|2,0,0]=4 6815 B16R1.20028 COc1cc(c(cc1F)C)SC(C)C(=O)C 62a_100009814033_100011009880 [0,2,0,0,0,0|2,0,0]=4 6816 B16R1.20028 COc1cc(c(cc1F)C)SC(C)C(=O)C 62a_100011009880_100009814033 [0,2,0,0,0,0|2,0,0]=4 6817 B16R1.20028 COc1cc(c(cc1F)Cl)NC(C)C(=O)C 7a_100009958774_100000179758 [0,2,0,0,0,0|2,0,0]=4 6818 B16R1.20028 COc1cc(c(cc1F)F)SC(C)C(=O)C 62a_100009814033_200015541288 [0,2,0,0,0,0|2,0,0]=4 6819 B16R1.20028 COc1cc(c(cc1F)F)SC(C)C(=O)C 62a_200015541288_100009814033 [0,2,0,0,0,0|2,0,0]=4 6820 B16R1.20028 COc1cc(c(cc1F)N)SC(C)C(=O)C 62a_100009814033_100010365326 [0,2,0,0,0,0|2,0,0]=4 6821 B16R1.20028 COc1cc(c(cc1F)N)SC(C)C(=O)C 62a_100010365326_100009814033 [0,2,0,0,0,0|2,0,0]=4 6822 B16R1.20028 COc1cc(c(cc1N)C)SC(C)C(=O)C 62a_100009814033_100010141321 [0,2,0,0,0,0|2,0,0]=4 6823 B16R1.20028 COc1cc(c(cc1N)C)SC(C)C(=O)C 62a_100010141321_100009814033 [0,2,0,0,0,0|2,0,0]=4 6824 B16R1.20028 COc1cc(c(cc1N)F)SC(C)C(=O)C 62a_100009814033_100012766639 [0,2,0,0,0,0|2,0,0]=4 6825 B16R1.20028 COc1cc(c(cc1N)F)SC(C)C(=O)C 62a_100012766639_100009814033 [0,2,0,0,0,0|2,0,0]=4 6826 B16R1.20028 COc1cc(c(cc1O)F)SC(C)C(=O)C 62a_100009814033_100010189133 [0,2,0,0,0,0|1,0,0]=3 6827 B16R1.20028 COc1cc(c(cc1O)F)SC(C)C(=O)N 62a_100000702099_100010189133 [0,2,0,0,0,0|2,0,0]=4 6828 B16R1.20028 COc1cc(c(cc1O)F)SC(F)C(=O)N 62a_100009813875_100010189133 [0,2,0,0,0,0|2,0,0]=4 6829 B16R1.20028 COc1cc(c(cc1O)F)SC(F)C(=O)[O-] 62a_100020610796_100010189133 [0,2,0,0,0,0|2,0,0]=4 6830 B16R1.20030 CCC(=O)CNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000747405 [0,2,0,0,0,0|2,0,0]=4 6831 B16R1.20030 CCC(=O)CNc1cc(c(cc1Br)C)OC 7a_100010244135_100000747405 [0,2,0,0,0,0|2,0,0]=4 6832 B16R1.20030 CCC(=O)CNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000747405 [0,2,0,0,0,0|2,0,0]=4 6833 B16R1.20030 CCC(=O)CNc1cc(c(cc1Br)F)OC 7a_100010208193_100000747405 [0,2,0,0,0,0|2,0,0]=4 6834 B16R1.20030 CCC(=O)CNc1cc(c(cc1C)Br)OC 7a_100010232211_100000747405 [0,2,0,0,0,0|2,0,0]=4 6835 B16R1.20030 CCC(=O)CNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000747405 [0,2,0,0,0,0|2,0,0]=4 6836 B16R1.20030 CCC(=O)CNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000747405 [0,2,0,0,0,0|2,0,0]=4 6837 B16R1.20030 CCC(=O)CNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000747405 [0,2,0,0,0,0|2,0,0]=4 6838 B16R1.20030 CCC(=O)CNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000747405 [0,2,0,0,0,0|2,0,0]=4 6839 B16R1.20030 CCC(=O)CSc1cc(c(cc1Br)Br)OC 62a_100000747405_200014006352 [0,2,0,0,0,0|2,0,0]=4 6840 B16R1.20030 CCC(=O)CSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000747405 [0,2,0,0,0,0|2,0,0]=4 6841 B16R1.20030 CCC(=O)CSc1cc(c(cc1C)F)OC 62a_100000747405_100011009880 [0,2,0,0,0,0|2,0,0]=4 6842 B16R1.20030 CCC(=O)CSc1cc(c(cc1C)F)OC 62a_100011009880_100000747405 [0,2,0,0,0,0|2,0,0]=4 6843 B16R1.20030 CCC(=O)CSc1cc(c(cc1C)N)OC 62a_100000747405_100010141321 [0,2,0,0,0,0|2,0,0]=4 6844 B16R1.20030 CCC(=O)CSc1cc(c(cc1C)N)OC 62a_100010141321_100000747405 [0,2,0,0,0,0|2,0,0]=4 6845 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)Cl)OC 62a_100000747405_100010739614 [0,2,0,0,0,0|2,0,0]=4 6846 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000747405 [0,2,0,0,0,0|2,0,0]=4 6847 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)F)OC 62a_100000747405_200015541288 [0,2,0,0,0,0|2,0,0]=4 6848 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)F)OC 62a_200015541288_100000747405 [0,2,0,0,0,0|2,0,0]=4 6849 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)N)OC 62a_100000747405_100012766639 [0,2,0,0,0,0|2,0,0]=4 6850 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)N)OC 62a_100012766639_100000747405 [0,2,0,0,0,0|2,0,0]=4 6851 B16R1.20030 CCC(=O)CSc1cc(c(cc1F)O)OC 62a_100000747405_100010189133 [0,2,0,0,0,0|1,0,0]=3 6852 B16R1.20030 CCC(=O)CSc1cc(c(cc1N)C)OC 62a_100000747405_200010584344 [0,2,0,0,0,0|2,0,0]=4 6853 B16R1.20030 CCC(=O)CSc1cc(c(cc1N)C)OC 62a_200010584344_100000747405 [0,2,0,0,0,0|2,0,0]=4 6854 B16R1.20030 CCC(=O)CSc1cc(c(cc1N)F)OC 62a_100000747405_100010365326 [0,2,0,0,0,0|2,0,0]=4 6855 B16R1.20030 CCC(=O)CSc1cc(c(cc1N)F)OC 62a_100010365326_100000747405 [0,2,0,0,0,0|2,0,0]=4 6856 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000183359 [0,2,0,0,0,0|2,0,0]=4 6857 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000183359 [0,2,0,0,0,0|2,0,0]=4 6858 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)C)OC 34a_100010244135_100000183359 [0,2,0,0,0,0|2,0,0]=4 6859 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)C)OC 7a_100010244135_100000183359 [0,2,0,0,0,0|2,0,0]=4 6860 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000183359 [0,2,0,0,0,0|2,0,0]=4 6861 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000183359 [0,2,0,0,0,0|2,0,0]=4 6862 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)F)OC 34a_100010208193_100000183359 [0,2,0,0,0,0|2,0,0]=4 6863 B16R1.20030 CNC(=O)CNc1cc(c(cc1Br)F)OC 7a_100010208193_100000183359 [0,2,0,0,0,0|2,0,0]=4 6864 B16R1.20030 CNC(=O)CNc1cc(c(cc1C)Br)OC 34a_100010232211_100000183359 [0,2,0,0,0,0|2,0,0]=4 6865 B16R1.20030 CNC(=O)CNc1cc(c(cc1C)Br)OC 7a_100010232211_100000183359 [0,2,0,0,0,0|2,0,0]=4 6866 B16R1.20030 CNC(=O)CNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000183359 [0,2,0,0,0,0|2,0,0]=4 6867 B16R1.20030 CNC(=O)CNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000183359 [0,2,0,0,0,0|2,0,0]=4 6868 B16R1.20030 CNC(=O)CNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000183359 [0,2,0,0,0,0|2,0,0]=4 6869 B16R1.20030 CNC(=O)CNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000183359 [0,2,0,0,0,0|2,0,0]=4 6870 B16R1.20030 CNC(=O)CNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000183359 [0,2,0,0,0,0|2,0,0]=4 6871 B16R1.20030 CNC(=O)CNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000183359 [0,2,0,0,0,0|2,0,0]=4 6872 B16R1.20030 CNC(=O)CNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000183359 [0,2,0,0,0,0|2,0,0]=4 6873 B16R1.20030 CNC(=O)CNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000183359 [0,2,0,0,0,0|2,0,0]=4 6874 B16R1.20030 CNC(=O)CNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000183359 [0,2,0,0,0,0|2,0,0]=4 6875 B16R1.20030 CNC(=O)CNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000183359 [0,2,0,0,0,0|2,0,0]=4 6876 B16R1.20030 CNC(=O)CSc1cc(c(cc1Br)Br)OC 62a_100000183359_200014006352 [0,2,0,0,0,0|2,0,0]=4 6877 B16R1.20030 CNC(=O)CSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000183359 [0,2,0,0,0,0|2,0,0]=4 6878 B16R1.20030 CNC(=O)CSc1cc(c(cc1C)F)OC 62a_100000183359_100011009880 [0,2,0,0,0,0|2,0,0]=4 6879 B16R1.20030 CNC(=O)CSc1cc(c(cc1C)F)OC 62a_100011009880_100000183359 [0,2,0,0,0,0|2,0,0]=4 6880 B16R1.20030 CNC(=O)CSc1cc(c(cc1C)N)OC 62a_100000183359_100010141321 [0,2,0,0,0,0|2,0,0]=4 6881 B16R1.20030 CNC(=O)CSc1cc(c(cc1C)N)OC 62a_100010141321_100000183359 [0,2,0,0,0,0|2,0,0]=4 6882 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)Cl)OC 62a_100000183359_100010739614 [0,2,0,0,0,0|2,0,0]=4 6883 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000183359 [0,2,0,0,0,0|2,0,0]=4 6884 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)F)OC 62a_100000183359_200015541288 [0,2,0,0,0,0|2,0,0]=4 6885 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)F)OC 62a_200015541288_100000183359 [0,2,0,0,0,0|2,0,0]=4 6886 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)N)OC 62a_100000183359_100012766639 [0,2,0,0,0,0|2,0,0]=4 6887 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)N)OC 62a_100012766639_100000183359 [0,2,0,0,0,0|2,0,0]=4 6888 B16R1.20030 CNC(=O)CSc1cc(c(cc1F)O)OC 62a_100000183359_100010189133 [0,2,0,0,0,0|1,0,0]=3 6889 B16R1.20030 CNC(=O)CSc1cc(c(cc1N)C)OC 62a_100000183359_200010584344 [0,2,0,0,0,0|2,0,0]=4 6890 B16R1.20030 CNC(=O)CSc1cc(c(cc1N)C)OC 62a_200010584344_100000183359 [0,2,0,0,0,0|2,0,0]=4 6891 B16R1.20030 CNC(=O)CSc1cc(c(cc1N)F)OC 62a_100000183359_100010365326 [0,2,0,0,0,0|2,0,0]=4 6892 B16R1.20030 CNC(=O)CSc1cc(c(cc1N)F)OC 62a_100010365326_100000183359 [0,2,0,0,0,0|2,0,0]=4 6893 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000747449 [0,2,0,0,0,0|2,0,0]=4 6894 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000747449 [0,2,0,0,0,0|2,0,0]=4 6895 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)C)OC 34a_100010244135_100000747449 [0,2,0,0,0,0|2,0,0]=4 6896 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)C)OC 7a_100010244135_100000747449 [0,2,0,0,0,0|2,0,0]=4 6897 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000747449 [0,2,0,0,0,0|2,0,0]=4 6898 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000747449 [0,2,0,0,0,0|2,0,0]=4 6899 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)F)OC 34a_100010208193_100000747449 [0,2,0,0,0,0|2,0,0]=4 6900 B16R1.20030 COC(=O)CNc1cc(c(cc1Br)F)OC 7a_100010208193_100000747449 [0,2,0,0,0,0|2,0,0]=4 6901 B16R1.20030 COC(=O)CNc1cc(c(cc1C)Br)OC 34a_100010232211_100000747449 [0,2,0,0,0,0|2,0,0]=4 6902 B16R1.20030 COC(=O)CNc1cc(c(cc1C)Br)OC 7a_100010232211_100000747449 [0,2,0,0,0,0|2,0,0]=4 6903 B16R1.20030 COC(=O)CNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000747449 [0,2,0,0,0,0|2,0,0]=4 6904 B16R1.20030 COC(=O)CNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000747449 [0,2,0,0,0,0|2,0,0]=4 6905 B16R1.20030 COC(=O)CNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000747449 [0,2,0,0,0,0|2,0,0]=4 6906 B16R1.20030 COC(=O)CNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000747449 [0,2,0,0,0,0|2,0,0]=4 6907 B16R1.20030 COC(=O)CNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000747449 [0,2,0,0,0,0|2,0,0]=4 6908 B16R1.20030 COC(=O)CNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000747449 [0,2,0,0,0,0|2,0,0]=4 6909 B16R1.20030 COC(=O)CNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000747449 [0,2,0,0,0,0|2,0,0]=4 6910 B16R1.20030 COC(=O)CNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000747449 [0,2,0,0,0,0|2,0,0]=4 6911 B16R1.20030 COC(=O)CNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000747449 [0,2,0,0,0,0|2,0,0]=4 6912 B16R1.20030 COC(=O)CNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000747449 [0,2,0,0,0,0|2,0,0]=4 6913 B16R1.20030 COC(=O)CSc1cc(c(cc1Br)Br)OC 62a_100000747449_200014006352 [0,2,0,0,0,0|2,0,0]=4 6914 B16R1.20030 COC(=O)CSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000747449 [0,2,0,0,0,0|2,0,0]=4 6915 B16R1.20030 COC(=O)CSc1cc(c(cc1C)F)OC 62a_100000747449_100011009880 [0,2,0,0,0,0|2,0,0]=4 6916 B16R1.20030 COC(=O)CSc1cc(c(cc1C)F)OC 62a_100011009880_100000747449 [0,2,0,0,0,0|2,0,0]=4 6917 B16R1.20030 COC(=O)CSc1cc(c(cc1C)N)OC 62a_100000747449_100010141321 [0,2,0,0,0,0|2,0,0]=4 6918 B16R1.20030 COC(=O)CSc1cc(c(cc1C)N)OC 62a_100010141321_100000747449 [0,2,0,0,0,0|2,0,0]=4 6919 B16R1.20030 COC(=O)CSc1cc(c(cc1F)Cl)OC 62a_100000747449_100010739614 [0,2,0,0,0,0|2,0,0]=4 6920 B16R1.20030 COC(=O)CSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000747449 [0,2,0,0,0,0|2,0,0]=4 6921 B16R1.20030 COC(=O)CSc1cc(c(cc1F)F)OC 62a_100000747449_200015541288 [0,2,0,0,0,0|2,0,0]=4 6922 B16R1.20030 COC(=O)CSc1cc(c(cc1F)F)OC 62a_200015541288_100000747449 [0,2,0,0,0,0|2,0,0]=4 6923 B16R1.20030 COC(=O)CSc1cc(c(cc1F)N)OC 62a_100000747449_100012766639 [0,2,0,0,0,0|2,0,0]=4 6924 B16R1.20030 COC(=O)CSc1cc(c(cc1F)N)OC 62a_100012766639_100000747449 [0,2,0,0,0,0|2,0,0]=4 6925 B16R1.20030 COC(=O)CSc1cc(c(cc1F)O)OC 62a_100000747449_100010189133 [0,2,0,0,0,0|1,0,0]=3 6926 B16R1.20030 COC(=O)CSc1cc(c(cc1N)C)OC 62a_100000747449_200010584344 [0,2,0,0,0,0|2,0,0]=4 6927 B16R1.20030 COC(=O)CSc1cc(c(cc1N)C)OC 62a_200010584344_100000747449 [0,2,0,0,0,0|2,0,0]=4 6928 B16R1.20030 COC(=O)CSc1cc(c(cc1N)F)OC 62a_100000747449_100010365326 [0,2,0,0,0,0|2,0,0]=4 6929 B16R1.20030 COC(=O)CSc1cc(c(cc1N)F)OC 62a_100010365326_100000747449 [0,2,0,0,0,0|2,0,0]=4 6930 B16R1.20040 C=C(C)CNc1cc(c(cc1C)OC)OC 34a_100000183460_100000748629 [0,2,0,0,0,0|2,0,0]=4 6931 B16R1.20040 C=C(C)CNc1cc(c(cc1F)OC)OC 34a_100000753170_100000748629 [0,2,0,0,0,0|2,0,0]=4 6932 B16R1.20040 C=C(C)CSc1cc(c(cc1F)OC)OC 62a_200011765842_100000211660 [0,2,0,0,0,0|2,0,0]=4 6933 B16R1.20040 COc1cc(c(cc1OC)C=CC(=O)C)Br 1458a_200000186731_200000210301 [0,2,0,0,0,0|0,0,2]=4 6934 B16R1.20040 COc1cc(c(cc1OC)C=CC(=O)[13CH3])Br 1458a_200000186731_200025704644 [0,2,0,0,0,0|0,0,2]=4 6935 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 11a_100132302102_100015343762 [0,2,0,0,0,0|1,0,0]=3 6936 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 1626a_100132302102_100015343762 [0,2,0,0,0,0|1,0,0]=3 6937 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 240690a_100132302102_100015343762 [0,2,0,0,0,0|1,0,0]=3 6938 B16R1.20040 COc1cc(c(cc1OC)CNC(=O)C)F 527a_100132302102_100103153847 [0,2,0,0,0,0|1,0,0]=3 6939 B16R1.20040 COc1cc(c(cc1OC)NCC(=O)N)C 34a_100000183460_100000187820 [0,2,0,0,0,0|2,0,0]=4 6940 B16R1.20040 COc1cc(c(cc1OC)NCC(=O)N)F 34a_100000753170_100000187820 [0,2,0,0,0,0|2,0,0]=4 6941 B16R1.20040 COc1cc(c(cc1OC)NCC(=O)[O-])C 34a_100000183460_100020667443 [0,2,0,0,0,0|2,0,0]=4 6942 B16R1.20040 COc1cc(c(cc1OC)NCC(=O)[O-])F 34a_100000753170_100020667443 [0,2,0,0,0,0|2,0,0]=4 6943 B16R1.20040 COc1cc(c(cc1OC)SCC(=O)N)F 62a_200011765842_100000747473 [0,2,0,0,0,0|2,0,0]=4 6944 B16R1.20040 COc1cc(c(cc1OC)SCC(=O)[O-])F 62a_200011765842_100020667443 [0,2,0,0,0,0|2,0,0]=4 6945 B16R1.20060 C=C(C)CSc1cc(c(cc1C=O)O)OC 62a_100000748629_100000183646 [0,2,0,0,0,0|2,0,0]=4 6946 B16R1.20060 COc1cc(c(cc1O)C=O)SCC(=O)N 62a_100000747473_100000183646 [0,2,0,0,0,0|2,0,0]=4 6947 B16R1.20060 COc1cc(c(cc1O)C=O)SCC(=O)[O-] 62a_100020667443_100000183646 [0,2,0,0,0,0|2,0,0]=4 6948 B16R1.27701 CCS(=O)(=O)NCc1ccc(c(c1)OC)O 270084a_100000185554_100000211323 [0,2,0,0,0,0|2,0,0]=4 6949 B16R1.27701 CCS(=O)(=O)NCc1ccc(c(c1)OC)O 274078a_100000185554_100000211323 [0,2,0,0,0,0|2,0,0]=4 6950 B16R1.27701 CCS(=O)(=O)NCc1ccc(c(c1)OC)O 40a_100000185554_100000053943 [0,2,0,0,0,0|2,0,0]=4 6951 B16R1.27701 COc1cc(ccc1O)CNS(=O)(=O)CCl 270084a_100000185554_100000031410 [0,2,0,0,0,0|2,0,0]=4 6952 B16R1.27701 COc1cc(ccc1O)CNS(=O)(=O)CCl 274078a_100000185554_100000031410 [0,2,0,0,0,0|2,0,0]=4 6953 B16R1.84799 COc1ccc(cc1OC)CNS(=O)(=O)C 40a_100000185555_100000738038 [0,2,0,0,0,0|2,0,0]=4 6954 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 6955 B16R1.4273 COc1cc(ccc1CO)[C@@H](N)CC(C)C 271570a_100015190218_100011277633 [0,2,0,0,0,0|1,0,1]=4 6956 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)C 1458a_100000070787_100000184214 [0,2,0,0,0,0|0,0,1]=3 6957 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)N 1458a_100000211223_100000187820 [0,2,0,0,0,0|1,0,1]=4 6958 B16R1.4273 COc1ccc(cc1OC)C(=O)CC(=O)[O-] 1458a_100000211223_100020667443 [0,2,0,0,0,0|1,0,1]=4 6959 B16R1.4273 COc1ccc(cc1OC)C(C)CN(C)C 270004a_100102631434_100000697277 [0,2,0,0,0,0|2,0,0]=4 6960 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 11a_100025717294_100015343762 [0,2,0,0,0,0|1,0,0]=3 6961 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 1626a_100025717294_100015343762 [0,2,0,0,0,0|1,0,0]=3 6962 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 240690a_100025717294_100015343762 [0,2,0,0,0,0|1,0,0]=3 6963 B16R1.4273 COc1ccc(cc1OC)[C@@H](C)NC(=O)C 527a_100025717294_100103153847 [0,2,0,0,0,0|1,0,0]=3 6964 B16R1.4273 COc1ccc(cc1OC)[C@@H](N)CC(C)C 271570a_100015190218_100000187503 [0,2,0,0,0,0|1,0,1]=4 6965 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 6966 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 6967 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100000210414_200010710740 [0,2,0,0,0,0|1,0,1]=4 6968 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000747405 [0,2,0,0,0,0|1,0,1]=4 6969 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000747405 [0,2,0,0,0,0|1,0,1]=4 6970 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000747405 [0,2,0,0,0,0|1,0,1]=4 6971 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000210414_200012348595 [0,2,0,0,0,0|1,0,1]=4 6972 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000747405 [0,2,0,0,0,0|1,0,1]=4 6973 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000747405 [0,2,0,0,0,0|1,0,1]=4 6974 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000210414_100010206313 [0,2,0,0,0,0|0,0,1]=3 6975 B16R1.4727 CCC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000747405 [0,2,0,0,0,0|0,0,1]=3 6976 B16R1.4727 CCC(=O)CN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000747405 [0,2,0,0,0,0|2,0,0]=4 6977 B16R1.4727 CCC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 11a_100025717271_100000210414 [0,2,0,0,0,0|2,0,0]=4 6978 B16R1.4727 CCC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 1626a_100025717271_100000210414 [0,2,0,0,0,0|2,0,0]=4 6979 B16R1.4727 CCC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 240690a_100025717271_100000210414 [0,2,0,0,0,0|2,0,0]=4 6980 B16R1.4727 CCC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 527a_100025717271_100000210414 [0,2,0,0,0,0|2,0,0]=4 6981 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000183359 [0,2,0,0,0,0|1,0,1]=4 6982 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000183359 [0,2,0,0,0,0|1,0,1]=4 6983 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000183359 [0,2,0,0,0,0|1,0,1]=4 6984 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000183359 [0,2,0,0,0,0|1,0,1]=4 6985 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000183359 [0,2,0,0,0,0|1,0,1]=4 6986 B16R1.4727 CNC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000183359 [0,2,0,0,0,0|0,0,1]=3 6987 B16R1.4727 CNC(=O)CN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000183359 [0,2,0,0,0,0|2,0,0]=4 6988 B16R1.4727 CNC(=O)CN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000183359 [0,2,0,0,0,0|2,0,0]=4 6989 B16R1.4727 CNC(=O)CN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000183359 [0,2,0,0,0,0|2,0,0]=4 6990 B16R1.4727 CNC(=O)CN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000243848 [0,2,0,0,0,0|2,0,0]=4 6991 B16R1.4727 CNC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 2708a_100025717271_106832991635 [0,2,0,0,0,0|2,0,0]=4 6992 B16R1.4727 CNC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 2708a_100102657272_100025717271 [0,2,0,0,0,0|2,0,0]=4 6993 B16R1.4727 CNC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 273464a_100025717271_100102657272 [0,2,0,0,0,0|2,0,0]=4 6994 B16R1.4727 CNC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 273464a_100102657272_100025717271 [0,2,0,0,0,0|2,0,0]=4 6995 B16R1.4727 CNC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 512a_100025717271_100102657272 [0,2,0,0,0,0|2,0,0]=4 6996 B16R1.4727 CNC(=O)N[C@@H](C)c1ccc(c(c1)OC)F 512a_106832991638_100025717271 [0,2,0,0,0,0|2,0,0]=4 6997 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000747449 [0,2,0,0,0,0|1,0,1]=4 6998 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000747449 [0,2,0,0,0,0|1,0,1]=4 6999 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000747449 [0,2,0,0,0,0|1,0,1]=4 7000 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000747449 [0,2,0,0,0,0|1,0,1]=4 7001 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000747449 [0,2,0,0,0,0|1,0,1]=4 7002 B16R1.4727 COC(=O)CC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000747449 [0,2,0,0,0,0|0,0,1]=3 7003 B16R1.4727 COC(=O)CN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000747449 [0,2,0,0,0,0|2,0,0]=4 7004 B16R1.4727 COC(=O)CN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000747449 [0,2,0,0,0,0|2,0,0]=4 7005 B16R1.4727 COC(=O)CN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000747449 [0,2,0,0,0,0|2,0,0]=4 7006 B16R1.4727 COC(=O)CN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000747449 [0,2,0,0,0,0|2,0,0]=4 7007 B16R1.4727 COc1cc(ccc1Br)C(=O)CC(=O)CO 1458a_100000210174_200010710740 [0,2,0,0,0,0|1,0,1]=4 7008 B16R1.4727 COc1cc(ccc1F)C(=O)CC(=O)CO 1458a_100000210174_200012348595 [0,2,0,0,0,0|1,0,1]=4 7009 B16R1.4727 COc1cc(ccc1F)[C@H](C)NC(=O)CO 240690a_100025717271_100000210174 [0,2,0,0,0,0|2,0,0]=4 7010 B16R1.4727 COc1cc(ccc1F)[C@H](C)NC(=O)CO 527a_100025717271_100000210174 [0,2,0,0,0,0|2,0,0]=4 7011 B16R1.4727 COc1cc(ccc1O)C(=O)CC(=O)CO 1458a_100000210174_100010206313 [0,2,0,0,0,0|0,0,1]=3 7012 B16R1.4729 COc1cc(ccc1F)[C@@H](CO)NC(=O)C 240690a_100138412295_100015343762 [0,2,0,0,0,0|2,0,0]=4 7013 B16R1.4729 COc1cc(ccc1F)[C@@H](CO)NC(=O)C 527a_100138412295_100103153847 [0,2,0,0,0,0|2,0,0]=4 7014 B16R1.4731 COc1cc(ccc1Br)C(=O)C(C)C(=O)C 1458a_100011934951_100000179758 [0,2,0,0,0,0|1,0,1]=4 7015 B16R1.4731 COc1cc(ccc1C)C(=O)C(C)C(=O)C 1458a_100000212341_100000179758 [0,2,0,0,0,0|1,0,1]=4 7016 B16R1.4731 COc1cc(ccc1Cl)C(=O)C(C)C(=O)C 1458a_100000181799_100000179758 [0,2,0,0,0,0|1,0,1]=4 7017 B16R1.4731 COc1cc(ccc1F)C(=O)C(C)C(=O)C 1458a_100000757635_100000179758 [0,2,0,0,0,0|1,0,1]=4 7018 B16R1.4731 COc1cc(ccc1F)N(C)C(C)C(=O)C 2230a_200012002703_100009814033 [0,2,0,0,0,0|2,0,0]=4 7019 B16R1.4731 COc1cc(ccc1F)N(C)C(C)C(=O)C 269982a_200012002703_100009814033 [0,2,0,0,0,0|2,0,0]=4 7020 B16R1.4731 COc1cc(ccc1I)C(=O)C(C)C(=O)C 1458a_100012356290_100000179758 [0,2,0,0,0,0|1,0,1]=4 7021 B16R1.4731 COc1cc(ccc1O)C(=O)C(C)C(=O)C 1458a_100000687070_100000179758 [0,2,0,0,0,0|0,0,1]=3 7022 B16R1.4731 COc1cc(ccc1O)C(=O)C(C)C(=O)N 1458a_100000687070_100000702099 [0,2,0,0,0,0|1,0,1]=4 7023 B16R1.4731 COc1cc(ccc1O)C(=O)C(F)C(=O)N 1458a_100000687070_100009813875 [0,2,0,0,0,0|1,0,1]=4 7024 B16R1.4731 COc1cc(ccc1O)C(=O)C(F)C(=O)[O-] 1458a_100000687070_100020610796 [0,2,0,0,0,0|1,0,1]=4 7025 B16R1.4274 CCc1cc(ccc1OC)SC(C)C(=O)C 62a_100009814033_200010179862 [0,2,0,0,0,0|2,0,0]=4 7026 B16R1.4274 CCc1cc(ccc1OC)SC(C)C(=O)C 62a_200010179862_100009814033 [0,2,0,0,0,0|2,0,0]=4 7027 B16R1.4274 CCc1ccc(cc1OC)SC(C)C(=O)C 62a_100009814033_200010710398 [0,2,0,0,0,0|2,0,0]=4 7028 B16R1.4274 CCc1ccc(cc1OC)SC(C)C(=O)C 62a_200010710398_100009814033 [0,2,0,0,0,0|2,0,0]=4 7029 B16R1.4274 COc1cc(ccc1C#N)SC(C)C(=O)C 62a_100009814033_100000694671 [0,2,0,0,0,0|2,0,0]=4 7030 B16R1.4274 COc1cc(ccc1C=O)SC(C)C(=O)C 62a_100000697075_100009814033 [0,2,0,0,0,0|1,0,1]=4 7031 B16R1.4274 COc1cc(ccc1C=O)SC(C)C(=O)C 62a_100009814033_100010290300 [0,2,0,0,0,0|1,0,1]=4 7032 B16R1.4274 COc1cc(ccc1CO)NC(C)C(=O)N 34a_100012183141_100000702099 [0,2,0,0,0,0|2,0,0]=4 7033 B16R1.4274 COc1cc(ccc1CO)NC(F)C(=O)N 34a_100012183141_100009813875 [0,2,0,0,0,0|2,0,0]=4 7034 B16R1.4274 COc1cc(ccc1CO)NC(F)C(=O)[O-] 34a_100012183141_100020610796 [0,2,0,0,0,0|2,0,0]=4 7035 B16R1.4274 COc1cc(ccc1CO)OC(C)C(=O)N 34a_200000116926_100000702099 [0,2,0,0,0,0|2,0,0]=4 7036 B16R1.4274 COc1cc(ccc1CO)OC(F)C(=O)N 34a_200000116926_100009813875 [0,2,0,0,0,0|2,0,0]=4 7037 B16R1.4274 COc1cc(ccc1CO)OC(F)C(=O)[O-] 34a_200000116926_100020610796 [0,2,0,0,0,0|2,0,0]=4 7038 B16R1.4274 COc1cc(ccc1CO)SC(C)C(=O)C 62a_100009814033_100011277633 [0,2,0,0,0,0|1,0,0]=3 7039 B16R1.4274 COc1cc(ccc1CO)SC(C)C(=O)C 62a_100011277633_100009814033 [0,2,0,0,0,0|1,0,0]=3 7040 B16R1.4274 COc1cc(ccc1CO)SC(C)C(=O)N 62a_100000702099_100011277633 [0,2,0,0,0,0|2,0,0]=4 7041 B16R1.4274 COc1cc(ccc1CO)SC(C)C(=O)N 62a_100011277633_100000702099 [0,2,0,0,0,0|2,0,0]=4 7042 B16R1.4274 COc1cc(ccc1CO)SC(F)C(=O)N 62a_100009813875_100011277633 [0,2,0,0,0,0|2,0,0]=4 7043 B16R1.4274 COc1cc(ccc1CO)SC(F)C(=O)N 62a_100011277633_100009813875 [0,2,0,0,0,0|2,0,0]=4 7044 B16R1.4274 COc1cc(ccc1CO)SC(F)C(=O)[O-] 62a_100011277633_100020610796 [0,2,0,0,0,0|2,0,0]=4 7045 B16R1.4274 COc1cc(ccc1CO)SC(F)C(=O)[O-] 62a_100020610796_100011277633 [0,2,0,0,0,0|2,0,0]=4 7046 B16R1.4274 COc1cc(ccc1SC)SC(C)C(=O)C 62a_200011001119_100009814033 [0,2,0,0,0,0|1,1,0]=4 7047 B16R1.4274 COc1cc(cnc1CO)SC(C)C(=O)C 62a_100009814033_200010246159 [0,2,0,0,0,0|2,0,0]=4 7048 B16R1.4274 COc1cc(cnc1CO)SC(C)C(=O)C 62a_200010246159_100009814033 [0,2,0,0,0,0|2,0,0]=4 7049 B16R1.4274 COc1cc(cnc1OC)SC(C)C(=O)C 62a_100009814033_100010234541 [0,2,0,0,0,0|2,0,0]=4 7050 B16R1.4274 COc1cc(ncc1CO)SC(C)C(=O)C 62a_100009814033_100010714672 [0,2,0,0,0,0|2,0,0]=4 7051 B16R1.4274 COc1cc(ncc1CO)SC(C)C(=O)C 62a_100010714672_100009814033 [0,2,0,0,0,0|2,0,0]=4 7052 B16R1.4274 COc1ccc(cc1OC)CC(C)N(C)C 270004a_100102631434_100000211454 [0,2,0,0,0,0|2,0,0]=4 7053 B16R1.4274 COc1ccc(cc1OC)CN(C)C(=O)C 1626a_100000180827_100015343762 [0,2,0,0,0,0|1,0,0]=3 7054 B16R1.4274 COc1ccc(cc1OC)CN(C)C(=O)C 240690a_100000180827_100015343762 [0,2,0,0,0,0|1,0,0]=3 7055 B16R1.4274 COc1ccc(cc1OC)CN(C)C(=O)C 527a_100000180827_100103153847 [0,2,0,0,0,0|1,0,0]=3 7056 B16R1.4274 COc1ccc(cc1OC)NC(C)C(=O)N 34a_100000187404_100000702099 [0,2,0,0,0,0|2,0,0]=4 7057 B16R1.4274 COc1ccc(cc1OC)NC(F)C(=O)N 34a_100000187404_100009813875 [0,2,0,0,0,0|2,0,0]=4 7058 B16R1.4274 COc1ccc(cc1OC)NC(F)C(=O)[O-] 34a_100000187404_100020610796 [0,2,0,0,0,0|2,0,0]=4 7059 B16R1.4274 COc1ccc(cc1OC)OC(C)C(=O)N 34a_100000039706_100000702099 [0,2,0,0,0,0|2,0,0]=4 7060 B16R1.4274 COc1ccc(cc1OC)OC(F)C(=O)N 34a_100000039706_100009813875 [0,2,0,0,0,0|2,0,0]=4 7061 B16R1.4274 COc1ccc(cc1OC)OC(F)C(=O)[O-] 34a_100000039706_100020610796 [0,2,0,0,0,0|2,0,0]=4 7062 B16R1.4274 COc1ccc(cc1OC)SC(C)C(=O)C 62a_100009814033_100011356967 [0,2,0,0,0,0|1,0,0]=3 7063 B16R1.4274 COc1ccc(cc1OC)SC(C)C(=O)N 62a_100000702099_100011356967 [0,2,0,0,0,0|2,0,0]=4 7064 B16R1.4274 COc1ccc(cc1OC)SC(F)C(=O)N 62a_100009813875_100011356967 [0,2,0,0,0,0|2,0,0]=4 7065 B16R1.4274 COc1ccc(cc1OC)SC(F)C(=O)[O-] 62a_100020610796_100011356967 [0,2,0,0,0,0|2,0,0]=4 7066 B16R1.4274 COc1ccc(cc1SC)SC(C)C(=O)C 62a_200009892704_100009814033 [0,2,0,0,0,0|1,1,0]=4 7067 B16R1.4274 COc1ccc(nc1OC)SC(C)C(=O)C 62a_100009814033_100010214848 [0,2,0,0,0,0|2,0,0]=4 7068 B16R1.4274 COc1nc(ccc1CO)SC(C)C(=O)C 62a_100009814033_100010988397 [0,2,0,0,0,0|2,0,0]=4 7069 B16R1.4274 COc1nc(ccc1CO)SC(C)C(=O)C 62a_100010988397_100009814033 [0,2,0,0,0,0|2,0,0]=4 7070 B16R1.4730 CCC(=O)C(C)Nc1ccc(c(c1)OC)Br 2230a_100000765947_100000742827 [0,2,0,0,0,0|2,0,0]=4 7071 B16R1.4730 CCC(=O)C(C)Nc1ccc(c(c1)OC)C 2230a_100011279678_100000742827 [0,2,0,0,0,0|2,0,0]=4 7072 B16R1.4730 CCC(=O)C(C)Nc1ccc(c(c1)OC)Cl 2230a_100000742311_100000742827 [0,2,0,0,0,0|2,0,0]=4 7073 B16R1.4730 CCC(=O)C(C)Nc1ccc(c(c1)OC)F 2230a_100000701188_100000742827 [0,2,0,0,0,0|2,0,0]=4 7074 B16R1.4730 CCC(=O)C(C)Oc1ccc(c(c1)OC)Br 7a_100011827694_100000742827 [0,2,0,0,0,0|2,0,0]=4 7075 B16R1.4730 CCC(=O)C(C)Oc1ccc(c(c1)OC)C 7a_100009865632_100000742827 [0,2,0,0,0,0|2,0,0]=4 7076 B16R1.4730 CCC(=O)C(C)Oc1ccc(c(c1)OC)Cl 7a_100012186310_100000742827 [0,2,0,0,0,0|2,0,0]=4 7077 B16R1.4730 CCC(=O)C(C)Oc1ccc(c(c1)OC)F 7a_100012001760_100000742827 [0,2,0,0,0,0|2,0,0]=4 7078 B16R1.4730 CCC(=O)C(C)Oc1ccc(c(c1)OC)N 7a_100015326901_100000742827 [0,2,0,0,0,0|2,0,0]=4 7079 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)CC)O 62a_100000742827_100012338938 [0,2,0,0,0,0|2,0,0]=4 7080 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)Br 62a_100000742827_100012353699 [0,2,0,0,0,0|2,0,0]=4 7081 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)Br 62a_100012353699_100000742827 [0,2,0,0,0,0|2,0,0]=4 7082 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)C 62a_100000742827_100011830276 [0,2,0,0,0,0|2,0,0]=4 7083 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)C 62a_100011830276_100000742827 [0,2,0,0,0,0|2,0,0]=4 7084 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)Cl 62a_100000742827_100011356853 [0,2,0,0,0,0|2,0,0]=4 7085 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)Cl 62a_100011356853_100000742827 [0,2,0,0,0,0|2,0,0]=4 7086 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)F 62a_100000742827_100011934186 [0,2,0,0,0,0|2,0,0]=4 7087 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)F 62a_100011934186_100000742827 [0,2,0,0,0,0|2,0,0]=4 7088 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)N 62a_100000742827_100015196925 [0,2,0,0,0,0|2,0,0]=4 7089 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)N 62a_100011279103_100000742827 [0,2,0,0,0,0|2,0,0]=4 7090 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000742827_100000694246 [0,2,0,0,0,0|1,0,0]=3 7091 B16R1.4730 CCC(=O)C(C)Sc1ccc(c(n1)OC)O 62a_100000742827_100010893133 [0,2,0,0,0,0|2,0,0]=4 7092 B16R1.4730 CCc1cc(ccc1O)SC(C)C(=O)NC 62a_100000209862_100012338938 [0,2,0,0,0,0|2,0,0]=4 7093 B16R1.4730 CCc1cc(ccc1O)SC(C)C(=O)OC 62a_100000211248_100012338938 [0,2,0,0,0,0|2,0,0]=4 7094 B16R1.4730 CCc1cc(ccc1O)SC(F)C(=O)NC 62a_100009813575_100012338938 [0,2,0,0,0,0|2,0,0]=4 7095 B16R1.4730 CNC(=O)C(=O)Cc1ccc(c(c1)OC)Br 1458a_100011218921_100010110085 [0,2,0,0,0,0|1,0,1]=4 7096 B16R1.4730 CNC(=O)C(=O)Cc1ccc(c(c1)OC)Cl 1458a_100011218921_200010214485 [0,2,0,0,0,0|1,0,1]=4 7097 B16R1.4730 CNC(=O)C(=O)Cc1ccc(c(c1)OC)F 1458a_100011218921_100012349856 [0,2,0,0,0,0|1,0,1]=4 7098 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100011218921 [0,2,0,0,0,0|1,0,1]=4 7099 B16R1.4730 CNC(=O)C(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100011218921 [0,2,0,0,0,0|1,0,1]=4 7100 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)Br 2230a_100000765947_100000731044 [0,2,0,0,0,0|2,0,0]=4 7101 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)Br 34a_100000765947_100000731044 [0,2,0,0,0,0|2,0,0]=4 7102 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)C 2230a_100011279678_100000731044 [0,2,0,0,0,0|2,0,0]=4 7103 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)C 34a_100011279678_100000731044 [0,2,0,0,0,0|2,0,0]=4 7104 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)Cl 2230a_100000742311_100000731044 [0,2,0,0,0,0|2,0,0]=4 7105 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)Cl 34a_100000742311_100000731044 [0,2,0,0,0,0|2,0,0]=4 7106 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)F 2230a_100000701188_100000731044 [0,2,0,0,0,0|2,0,0]=4 7107 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)F 34a_100000701188_100000731044 [0,2,0,0,0,0|2,0,0]=4 7108 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)I 34a_100000746945_100000731044 [0,2,0,0,0,0|2,0,0]=4 7109 B16R1.4730 CNC(=O)C(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000731044 [0,2,0,0,0,0|1,0,0]=3 7110 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)Br 34a_100011827694_100000731044 [0,2,0,0,0,0|2,0,0]=4 7111 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)Br 7a_100011827694_100000209862 [0,2,0,0,0,0|2,0,0]=4 7112 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)C 34a_100009865632_100000731044 [0,2,0,0,0,0|2,0,0]=4 7113 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)C 7a_100009865632_100000209862 [0,2,0,0,0,0|2,0,0]=4 7114 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)Cl 34a_100012186310_100000731044 [0,2,0,0,0,0|2,0,0]=4 7115 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)Cl 7a_100012186310_100000209862 [0,2,0,0,0,0|2,0,0]=4 7116 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)F 34a_100012001760_100000731044 [0,2,0,0,0,0|2,0,0]=4 7117 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)F 7a_100012001760_100000209862 [0,2,0,0,0,0|2,0,0]=4 7118 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)N 34a_100015326901_100000731044 [0,2,0,0,0,0|2,0,0]=4 7119 B16R1.4730 CNC(=O)C(C)Oc1ccc(c(c1)OC)N 7a_100015326901_100000209862 [0,2,0,0,0,0|2,0,0]=4 7120 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)Br 62a_100000209862_100012353699 [0,2,0,0,0,0|2,0,0]=4 7121 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)Br 62a_100012353699_100000731044 [0,2,0,0,0,0|2,0,0]=4 7122 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)C 62a_100000209862_100011830276 [0,2,0,0,0,0|2,0,0]=4 7123 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)C 62a_100011830276_100000731044 [0,2,0,0,0,0|2,0,0]=4 7124 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)Cl 62a_100000209862_100011356853 [0,2,0,0,0,0|2,0,0]=4 7125 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)Cl 62a_100011356853_100000731044 [0,2,0,0,0,0|2,0,0]=4 7126 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)F 62a_100000209862_100011934186 [0,2,0,0,0,0|2,0,0]=4 7127 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)F 62a_100011934186_100000731044 [0,2,0,0,0,0|2,0,0]=4 7128 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)N 62a_100000209862_100015196925 [0,2,0,0,0,0|2,0,0]=4 7129 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)N 62a_100011279103_100000731044 [0,2,0,0,0,0|2,0,0]=4 7130 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000209862_100000694246 [0,2,0,0,0,0|1,0,0]=3 7131 B16R1.4730 CNC(=O)C(C)Sc1ccc(c(n1)OC)O 62a_100000209862_100010893133 [0,2,0,0,0,0|2,0,0]=4 7132 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)Br 2230a_100000765947_100009813575 [0,2,0,0,0,0|2,0,0]=4 7133 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)Br 34a_100000765947_100009813575 [0,2,0,0,0,0|2,0,0]=4 7134 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)C 2230a_100011279678_100009813575 [0,2,0,0,0,0|2,0,0]=4 7135 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)C 34a_100011279678_100009813575 [0,2,0,0,0,0|2,0,0]=4 7136 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)Cl 2230a_100000742311_100009813575 [0,2,0,0,0,0|2,0,0]=4 7137 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)Cl 34a_100000742311_100009813575 [0,2,0,0,0,0|2,0,0]=4 7138 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)F 2230a_100000701188_100009813575 [0,2,0,0,0,0|2,0,0]=4 7139 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)F 34a_100000701188_100009813575 [0,2,0,0,0,0|2,0,0]=4 7140 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)I 34a_100000746945_100009813575 [0,2,0,0,0,0|2,0,0]=4 7141 B16R1.4730 CNC(=O)C(F)Nc1ccc(c(c1)OC)O 34a_100000726020_100009813575 [0,2,0,0,0,0|1,0,0]=3 7142 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)Br 34a_100011827694_100009813575 [0,2,0,0,0,0|2,0,0]=4 7143 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)Br 7a_100011827694_100009813575 [0,2,0,0,0,0|2,0,0]=4 7144 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)C 34a_100009865632_100009813575 [0,2,0,0,0,0|2,0,0]=4 7145 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)C 7a_100009865632_100009813575 [0,2,0,0,0,0|2,0,0]=4 7146 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)Cl 34a_100012186310_100009813575 [0,2,0,0,0,0|2,0,0]=4 7147 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)Cl 7a_100012186310_100009813575 [0,2,0,0,0,0|2,0,0]=4 7148 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)F 34a_100012001760_100009813575 [0,2,0,0,0,0|2,0,0]=4 7149 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)F 7a_100012001760_100009813575 [0,2,0,0,0,0|2,0,0]=4 7150 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)N 34a_100015326901_100009813575 [0,2,0,0,0,0|2,0,0]=4 7151 B16R1.4730 CNC(=O)C(F)Oc1ccc(c(c1)OC)N 7a_100015326901_100009813575 [0,2,0,0,0,0|2,0,0]=4 7152 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)Br 62a_100009813575_100012353699 [0,2,0,0,0,0|2,0,0]=4 7153 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)Br 62a_100012353699_100009813575 [0,2,0,0,0,0|2,0,0]=4 7154 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)C 62a_100009813575_100011830276 [0,2,0,0,0,0|2,0,0]=4 7155 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)C 62a_100011830276_100009813575 [0,2,0,0,0,0|2,0,0]=4 7156 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)Cl 62a_100009813575_100011356853 [0,2,0,0,0,0|2,0,0]=4 7157 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)Cl 62a_100011356853_100009813575 [0,2,0,0,0,0|2,0,0]=4 7158 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)F 62a_100009813575_100011934186 [0,2,0,0,0,0|2,0,0]=4 7159 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)F 62a_100011934186_100009813575 [0,2,0,0,0,0|2,0,0]=4 7160 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)N 62a_100009813575_100015196925 [0,2,0,0,0,0|2,0,0]=4 7161 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)N 62a_100011279103_100009813575 [0,2,0,0,0,0|2,0,0]=4 7162 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(c1)OC)O 62a_100009813575_100000694246 [0,2,0,0,0,0|1,0,0]=3 7163 B16R1.4730 CNC(=O)C(F)Sc1ccc(c(n1)OC)O 62a_100009813575_100010893133 [0,2,0,0,0,0|2,0,0]=4 7164 B16R1.4730 COC(=O)C(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100000024059 [0,2,0,0,0,0|1,0,1]=4 7165 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)Br 2230a_100000765947_100000211248 [0,2,0,0,0,0|2,0,0]=4 7166 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)Br 34a_100000765947_100000211248 [0,2,0,0,0,0|2,0,0]=4 7167 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)C 2230a_100011279678_100000211248 [0,2,0,0,0,0|2,0,0]=4 7168 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)C 34a_100011279678_100000211248 [0,2,0,0,0,0|2,0,0]=4 7169 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)Cl 2230a_100000742311_100000211248 [0,2,0,0,0,0|2,0,0]=4 7170 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)Cl 34a_100000742311_100000211248 [0,2,0,0,0,0|2,0,0]=4 7171 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)F 2230a_100000701188_100000211248 [0,2,0,0,0,0|2,0,0]=4 7172 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)F 34a_100000701188_100000211248 [0,2,0,0,0,0|2,0,0]=4 7173 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)I 34a_100000746945_100000211248 [0,2,0,0,0,0|2,0,0]=4 7174 B16R1.4730 COC(=O)C(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100000211248 [0,2,0,0,0,0|1,0,0]=3 7175 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)Br 34a_100011827694_100000211248 [0,2,0,0,0,0|2,0,0]=4 7176 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)Br 7a_100011827694_100000211248 [0,2,0,0,0,0|2,0,0]=4 7177 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)C 34a_100009865632_100000211248 [0,2,0,0,0,0|2,0,0]=4 7178 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)C 7a_100009865632_100000211248 [0,2,0,0,0,0|2,0,0]=4 7179 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)Cl 34a_100012186310_100000211248 [0,2,0,0,0,0|2,0,0]=4 7180 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)Cl 7a_100012186310_100000211248 [0,2,0,0,0,0|2,0,0]=4 7181 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)F 34a_100012001760_100000211248 [0,2,0,0,0,0|2,0,0]=4 7182 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)F 7a_100012001760_100000211248 [0,2,0,0,0,0|2,0,0]=4 7183 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)N 34a_100015326901_100000211248 [0,2,0,0,0,0|2,0,0]=4 7184 B16R1.4730 COC(=O)C(C)Oc1ccc(c(c1)OC)N 7a_100015326901_100000211248 [0,2,0,0,0,0|2,0,0]=4 7185 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)Br 62a_100000211248_100012353699 [0,2,0,0,0,0|2,0,0]=4 7186 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)Br 62a_100012353699_100000211248 [0,2,0,0,0,0|2,0,0]=4 7187 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)C 62a_100000211248_100011830276 [0,2,0,0,0,0|2,0,0]=4 7188 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)C 62a_100011830276_100000211248 [0,2,0,0,0,0|2,0,0]=4 7189 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)Cl 62a_100000211248_100011356853 [0,2,0,0,0,0|2,0,0]=4 7190 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)Cl 62a_100011356853_100000211248 [0,2,0,0,0,0|2,0,0]=4 7191 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)F 62a_100000211248_100011934186 [0,2,0,0,0,0|2,0,0]=4 7192 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)F 62a_100011934186_100000211248 [0,2,0,0,0,0|2,0,0]=4 7193 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)N 62a_100000211248_100015196925 [0,2,0,0,0,0|2,0,0]=4 7194 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)N 62a_100011279103_100000211248 [0,2,0,0,0,0|2,0,0]=4 7195 B16R1.4730 COC(=O)C(C)Sc1ccc(c(c1)OC)O 62a_100000211248_100000694246 [0,2,0,0,0,0|1,0,0]=3 7196 B16R1.4730 COC(=O)C(C)Sc1ccc(c(n1)OC)O 62a_100000211248_100010893133 [0,2,0,0,0,0|2,0,0]=4 7197 B16R1.4763 CCC(Nc1ccc(c(c1)OC)O)C(=O)N 34a_100000726020_100000750255 [0,2,0,0,0,0|2,0,0]=4 7198 B16R1.4763 CCC(Sc1ccc(c(c1)OC)O)C(=O)N 62a_100000750255_100000694246 [0,2,0,0,0,0|2,0,0]=4 7199 B16R1.4763 COc1cc(ccc1O)C=C(C#N)C(=O)C 1458a_100000162688_200000210301 [0,2,0,0,0,0|0,0,2]=4 7200 B16R1.4763 COc1cc(ccc1O)C=C(C#N)C(=O)[13CH3] 1458a_100000162688_200025704644 [0,2,0,0,0,0|0,0,2]=4 7201 B16R1.6436 COc1c(ccc(c1F)OC(C)C(=O)C)F 7a_100000062073_100000179758 [0,2,0,0,0,0|2,0,0]=4 7202 B16R1.6436 COc1c(ccc(c1F)SC(C)C(=O)C)Cl 62a_100009814033_200135222481 [0,2,0,0,0,0|2,0,0]=4 7203 B16R1.6436 COc1c(ccc(c1F)SC(C)C(=O)C)Cl 62a_200135222481_100009814033 [0,2,0,0,0,0|2,0,0]=4 7204 B16R1.6436 COc1c(ccc(c1F)SC(C)C(=O)C)N 62a_100009814033_100010734149 [0,2,0,0,0,0|2,0,0]=4 7205 B16R1.6436 COc1c(ccc(c1F)SC(C)C(=O)C)N 62a_100010734149_100009814033 [0,2,0,0,0,0|2,0,0]=4 7206 B16R1.27683 CCc1cc(ccc1O)SC(C)(C)C(=O)C 62a_100000075568_100012338938 [0,2,0,0,0,0|2,0,0]=4 7207 B16R1.27683 COc1cc(ccc1Br)OC(C)(C)C(=O)C 7a_100011827694_100000075568 [0,2,0,0,0,0|2,0,0]=4 7208 B16R1.27683 COc1cc(ccc1Br)SC(C)(C)C(=O)C 62a_100000075568_100012353699 [0,2,0,0,0,0|2,0,0]=4 7209 B16R1.27683 COc1cc(ccc1Br)SC(C)(C)C(=O)C 62a_100012353699_100000075568 [0,2,0,0,0,0|2,0,0]=4 7210 B16R1.27683 COc1cc(ccc1C)OC(C)(C)C(=O)C 7a_100009865632_100000075568 [0,2,0,0,0,0|2,0,0]=4 7211 B16R1.27683 COc1cc(ccc1C)SC(C)(C)C(=O)C 62a_100000075568_100011830276 [0,2,0,0,0,0|2,0,0]=4 7212 B16R1.27683 COc1cc(ccc1C)SC(C)(C)C(=O)C 62a_100011830276_100000075568 [0,2,0,0,0,0|2,0,0]=4 7213 B16R1.27683 COc1cc(ccc1Cl)OC(C)(C)C(=O)C 7a_100012186310_100000075568 [0,2,0,0,0,0|2,0,0]=4 7214 B16R1.27683 COc1cc(ccc1Cl)SC(C)(C)C(=O)C 62a_100000075568_100011356853 [0,2,0,0,0,0|2,0,0]=4 7215 B16R1.27683 COc1cc(ccc1Cl)SC(C)(C)C(=O)C 62a_100011356853_100000075568 [0,2,0,0,0,0|2,0,0]=4 7216 B16R1.27683 COc1cc(ccc1F)OC(C)(C)C(=O)C 7a_100012001760_100000075568 [0,2,0,0,0,0|2,0,0]=4 7217 B16R1.27683 COc1cc(ccc1F)SC(C)(C)C(=O)C 62a_100000075568_100011934186 [0,2,0,0,0,0|2,0,0]=4 7218 B16R1.27683 COc1cc(ccc1F)SC(C)(C)C(=O)C 62a_100011934186_100000075568 [0,2,0,0,0,0|2,0,0]=4 7219 B16R1.27683 COc1cc(ccc1N)OC(C)(C)C(=O)C 7a_100015326901_100000075568 [0,2,0,0,0,0|2,0,0]=4 7220 B16R1.27683 COc1cc(ccc1N)SC(C)(C)C(=O)C 62a_100000075568_100015196925 [0,2,0,0,0,0|2,0,0]=4 7221 B16R1.27683 COc1cc(ccc1N)SC(C)(C)C(=O)C 62a_100011279103_100000075568 [0,2,0,0,0,0|2,0,0]=4 7222 B16R1.27683 COc1cc(ccc1O)NC(C)(C)C(=O)N 34a_100000726020_100000702505 [0,2,0,0,0,0|2,0,0]=4 7223 B16R1.27683 COc1cc(ccc1O)NC(F)(F)C(=O)[O-] 34a_100000726020_100020612412 [0,2,0,0,0,0|2,0,0]=4 7224 B16R1.27683 COc1cc(ccc1O)SC(C)(C)C(=O)C 62a_100000075568_100000694246 [0,2,0,0,0,0|1,0,0]=3 7225 B16R1.27683 COc1cc(ccc1O)SC(C)(C)C(=O)N 62a_100000702505_100000694246 [0,2,0,0,0,0|2,0,0]=4 7226 B16R1.27683 COc1cc(ccc1O)SC(F)(F)C(=O)N 62a_100009811971_100000694246 [0,2,0,0,0,0|2,0,0]=4 7227 B16R1.27683 COc1cc(ccc1O)SC(F)(F)C(=O)[O-] 62a_100000745680_100000694246 [0,2,0,0,0,0|2,0,0]=4 7228 B16R1.27683 COc1nc(ccc1O)SC(C)(C)C(=O)C 62a_100000075568_100010893133 [0,2,0,0,0,0|2,0,0]=4 7229 B16R1.4276 C#CC(=O)CCc1ccc(c(c1)OC)OC 1458a_100000211873_100011740610 [0,2,0,0,0,0|0,0,1]=3 7230 B16R1.4276 C=CC(=O)CCc1ccc(c(c1)OC)OC 1458a_100000185746_100011740610 [0,2,0,0,0,0|0,0,1]=3 7231 B16R1.4276 C=CC(=O)NCc1ccc(c(c1)OC)OC 1626a_100000185555_100000185746 [0,2,0,0,0,0|1,0,1]=4 7232 B16R1.4276 C=CC(=O)NCc1ccc(c(c1)OC)OC 240690a_100000185555_200121576911 [0,2,0,0,0,0|1,0,1]=4 7233 B16R1.4276 CCC(=O)C=Cc1ccc(c(c1)OC)OC 1458a_100015194992_100000210202 [0,2,0,0,0,0|0,0,2]=4 7234 B16R1.4276 CCC(=O)CCc1ccc(c(c1)OC)OC 1458a_100000187252_100000210202 [0,2,0,0,0,0|0,0,0]=2 7235 B16R1.4276 CCC(=O)CCc1ccc(c(c1)OC)OC 1458a_100000210414_100011740610 [0,2,0,0,0,0|0,0,0]=2 7236 B16R1.4276 CCC(=O)COc1ccc(c(c1)OC)CO 1458a_200000048963_100000210202 [0,2,0,0,0,0|1,0,0]=3 7237 B16R1.4276 CCC(=O)CSc1cc(c(cn1)CO)OC 62a_100000747405_100010714672 [0,2,0,0,0,0|2,0,0]=4 7238 B16R1.4276 CCC(=O)CSc1cc(c(cn1)CO)OC 62a_100010714672_100000747405 [0,2,0,0,0,0|2,0,0]=4 7239 B16R1.4276 CCC(=O)CSc1ccc(c(c1)CC)OC 62a_100000747405_200010179862 [0,2,0,0,0,0|2,0,0]=4 7240 B16R1.4276 CCC(=O)CSc1ccc(c(c1)CC)OC 62a_200010179862_100000747405 [0,2,0,0,0,0|2,0,0]=4 7241 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)C#N 62a_100000747405_100000694671 [0,2,0,0,0,0|2,0,0]=4 7242 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)C=O 62a_100000697075_100000747405 [0,2,0,0,0,0|1,0,1]=4 7243 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)C=O 62a_100000747405_100010290300 [0,2,0,0,0,0|1,0,1]=4 7244 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)CC 62a_100000747405_200010710398 [0,2,0,0,0,0|2,0,0]=4 7245 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)CC 62a_200010710398_100000747405 [0,2,0,0,0,0|2,0,0]=4 7246 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)CO 62a_100000747405_100011277633 [0,2,0,0,0,0|1,0,0]=3 7247 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000747405 [0,2,0,0,0,0|1,0,0]=3 7248 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)OC 62a_100000747405_100011356967 [0,2,0,0,0,0|1,0,0]=3 7249 B16R1.4276 CCC(=O)CSc1ccc(c(c1)OC)SC 62a_200011001119_100000747405 [0,2,0,0,0,0|1,1,0]=4 7250 B16R1.4276 CCC(=O)CSc1ccc(c(c1)SC)OC 62a_200009892704_100000747405 [0,2,0,0,0,0|1,1,0]=4 7251 B16R1.4276 CCC(=O)CSc1ccc(c(n1)OC)CO 62a_100000747405_100010988397 [0,2,0,0,0,0|2,0,0]=4 7252 B16R1.4276 CCC(=O)CSc1ccc(c(n1)OC)CO 62a_100010988397_100000747405 [0,2,0,0,0,0|2,0,0]=4 7253 B16R1.4276 CCC(=O)CSc1ccc(c(n1)OC)OC 62a_100000747405_100010214848 [0,2,0,0,0,0|2,0,0]=4 7254 B16R1.4276 CCC(=O)CSc1cnc(c(c1)OC)CO 62a_100000747405_200010246159 [0,2,0,0,0,0|2,0,0]=4 7255 B16R1.4276 CCC(=O)CSc1cnc(c(c1)OC)CO 62a_200010246159_100000747405 [0,2,0,0,0,0|2,0,0]=4 7256 B16R1.4276 CCC(=O)CSc1cnc(c(c1)OC)OC 62a_100000747405_100010234541 [0,2,0,0,0,0|2,0,0]=4 7257 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 11a_100000185555_100000210414 [0,2,0,0,0,0|1,0,0]=3 7258 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 1626a_100000185555_100000210414 [0,2,0,0,0,0|1,0,0]=3 7259 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 240690a_100000185555_100000210414 [0,2,0,0,0,0|1,0,0]=3 7260 B16R1.4276 CCC(=O)NCc1ccc(c(c1)OC)OC 527a_100000185555_100000210414 [0,2,0,0,0,0|1,0,0]=3 7261 B16R1.4276 CCN(C)CCc1ccc(c(c1)OC)OC 2230a_100000211294_100000210202 [0,2,0,0,0,0|2,0,0]=4 7262 B16R1.4276 CCN(C)CCc1ccc(c(c1)OC)OC 2230a_100000225621_100011273988 [0,2,0,0,0,0|2,0,0]=4 7263 B16R1.4276 CCN(C)CCc1ccc(c(c1)OC)OC 269982a_100000211294_100000204670 [0,2,0,0,0,0|2,0,0]=4 7264 B16R1.4276 CCN(C)CCc1ccc(c(c1)OC)OC 269982a_100000225621_100011273988 [0,2,0,0,0,0|2,0,0]=4 7265 B16R1.4276 CCc1cc(ccc1OC)SCC(=O)NC 62a_100000183359_200010179862 [0,2,0,0,0,0|2,0,0]=4 7266 B16R1.4276 CCc1cc(ccc1OC)SCC(=O)NC 62a_200010179862_100000183359 [0,2,0,0,0,0|2,0,0]=4 7267 B16R1.4276 CCc1cc(ccc1OC)SCC(=O)OC 62a_100000747449_200010179862 [0,2,0,0,0,0|2,0,0]=4 7268 B16R1.4276 CCc1cc(ccc1OC)SCC(=O)OC 62a_200010179862_100000747449 [0,2,0,0,0,0|2,0,0]=4 7269 B16R1.4276 CCc1ccc(cc1OC)SCC(=O)NC 62a_100000183359_200010710398 [0,2,0,0,0,0|2,0,0]=4 7270 B16R1.4276 CCc1ccc(cc1OC)SCC(=O)NC 62a_200010710398_100000183359 [0,2,0,0,0,0|2,0,0]=4 7271 B16R1.4276 CCc1ccc(cc1OC)SCC(=O)OC 62a_100000747449_200010710398 [0,2,0,0,0,0|2,0,0]=4 7272 B16R1.4276 CCc1ccc(cc1OC)SCC(=O)OC 62a_200010710398_100000747449 [0,2,0,0,0,0|2,0,0]=4 7273 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 11a_106832991635_100015194992 [0,2,0,0,0,0|0,0,2]=4 7274 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 1626a_100102657272_100015194992 [0,2,0,0,0,0|0,0,2]=4 7275 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 240690a_100102657272_100015194992 [0,2,0,0,0,0|0,0,2]=4 7276 B16R1.4276 CNC(=O)C=Cc1ccc(c(c1)OC)OC 527a_100102657272_100015194992 [0,2,0,0,0,0|0,0,2]=4 7277 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 11a_106832991635_100000187252 [0,2,0,0,0,0|0,0,0]=2 7278 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 1626a_100102657272_100000187252 [0,2,0,0,0,0|0,0,0]=2 7279 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 240690a_100102657272_100000187252 [0,2,0,0,0,0|0,0,0]=2 7280 B16R1.4276 CNC(=O)CCc1ccc(c(c1)OC)OC 527a_100102657272_100000187252 [0,2,0,0,0,0|0,0,0]=2 7281 B16R1.4276 CNC(=O)CNc1ccc(c(c1)OC)C#N 34a_100011999456_100000183359 [0,2,0,0,0,0|2,0,0]=4 7282 B16R1.4276 CNC(=O)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000183359 [0,2,0,0,0,0|1,0,0]=3 7283 B16R1.4276 CNC(=O)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000183359 [0,2,0,0,0,0|1,0,0]=3 7284 B16R1.4276 CNC(=O)COc1ccc(c(c1)OC)CO 240690a_100102657272_200000048963 [0,2,0,0,0,0|1,0,0]=3 7285 B16R1.4276 CNC(=O)COc1ccc(c(c1)OC)CO 34a_200000116926_100000183359 [0,2,0,0,0,0|1,0,0]=3 7286 B16R1.4276 CNC(=O)COc1ccc(c(c1)OC)OC 34a_100000039706_100000183359 [0,2,0,0,0,0|1,0,0]=3 7287 B16R1.4276 CNC(=O)CSc1cc(c(cn1)CO)OC 62a_100000183359_100010714672 [0,2,0,0,0,0|2,0,0]=4 7288 B16R1.4276 CNC(=O)CSc1cc(c(cn1)CO)OC 62a_100010714672_100000183359 [0,2,0,0,0,0|2,0,0]=4 7289 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)C#N 62a_100000183359_100000694671 [0,2,0,0,0,0|2,0,0]=4 7290 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)C=O 62a_100000183359_100010290300 [0,2,0,0,0,0|1,0,1]=4 7291 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)C=O 62a_100000697075_100000183359 [0,2,0,0,0,0|1,0,1]=4 7292 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)CO 62a_100000183359_100011277633 [0,2,0,0,0,0|1,0,0]=3 7293 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000183359 [0,2,0,0,0,0|1,0,0]=3 7294 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)OC 62a_100000183359_100011356967 [0,2,0,0,0,0|1,0,0]=3 7295 B16R1.4276 CNC(=O)CSc1ccc(c(c1)OC)SC 62a_200011001119_100000183359 [0,2,0,0,0,0|1,1,0]=4 7296 B16R1.4276 CNC(=O)CSc1ccc(c(c1)SC)OC 62a_200009892704_100000183359 [0,2,0,0,0,0|1,1,0]=4 7297 B16R1.4276 CNC(=O)CSc1ccc(c(n1)OC)CO 62a_100000183359_100010988397 [0,2,0,0,0,0|2,0,0]=4 7298 B16R1.4276 CNC(=O)CSc1ccc(c(n1)OC)CO 62a_100010988397_100000183359 [0,2,0,0,0,0|2,0,0]=4 7299 B16R1.4276 CNC(=O)CSc1ccc(c(n1)OC)OC 62a_100000183359_100010214848 [0,2,0,0,0,0|2,0,0]=4 7300 B16R1.4276 CNC(=O)CSc1cnc(c(c1)OC)CO 62a_100000183359_200010246159 [0,2,0,0,0,0|2,0,0]=4 7301 B16R1.4276 CNC(=O)CSc1cnc(c(c1)OC)CO 62a_200010246159_100000183359 [0,2,0,0,0,0|2,0,0]=4 7302 B16R1.4276 CNC(=O)CSc1cnc(c(c1)OC)OC 62a_100000183359_100010234541 [0,2,0,0,0,0|2,0,0]=4 7303 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 2708a_100000185555_106832991635 [0,2,0,0,0,0|1,0,0]=3 7304 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 2708a_100102657272_100000185555 [0,2,0,0,0,0|1,0,0]=3 7305 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 273464a_100000185555_100102657272 [0,2,0,0,0,0|1,0,0]=3 7306 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 273464a_100102657272_100000185555 [0,2,0,0,0,0|1,0,0]=3 7307 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 512a_100000185555_100102657272 [0,2,0,0,0,0|1,0,0]=3 7308 B16R1.4276 CNC(=O)NCc1ccc(c(c1)OC)OC 512a_106832991638_100000185555 [0,2,0,0,0,0|1,0,0]=3 7309 B16R1.4276 CNC(=O)NNc1ccc(c(c1)OC)OC 273464a_100102657272_100000071703 [0,2,0,0,0,0|2,0,0]=4 7310 B16R1.4276 CNC(=O)NNc1ccc(c(c1)OC)OC 512a_106832991638_100000071703 [0,2,0,0,0,0|2,0,0]=4 7311 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)OC 34a_100000149373_200000210301 [0,2,0,0,0,0|0,0,2]=4 7312 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)OC 34a_100000724557_200000210301 [0,2,0,0,0,0|0,0,2]=4 7313 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)OC)O[13CH3] 34a_100000149373_200025704644 [0,2,0,0,0,0|0,0,2]=4 7314 B16R1.4276 COC(=O)C=Cc1ccc(c(c1)O[13CH3])OC 34a_100000724557_200025704644 [0,2,0,0,0,0|0,0,2]=4 7315 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 34a_100000056475_200000210301 [0,2,0,0,0,0|0,0,0]=2 7316 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 34a_100000070228_200000210301 [0,2,0,0,0,0|0,0,0]=2 7317 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 7a_100000056475_200000210301 [0,2,0,0,0,0|0,0,0]=2 7318 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)OC 7a_100000070228_200000210301 [0,2,0,0,0,0|0,0,0]=2 7319 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)O[13CH3] 34a_100000070228_200025704644 [0,2,0,0,0,0|0,0,0]=2 7320 B16R1.4276 COC(=O)CCc1ccc(c(c1)OC)O[13CH3] 7a_100000070228_200025704644 [0,2,0,0,0,0|0,0,0]=2 7321 B16R1.4276 COC(=O)CCc1ccc(c(c1)O[13CH3])OC 34a_100000056475_200025704644 [0,2,0,0,0,0|0,0,0]=2 7322 B16R1.4276 COC(=O)CCc1ccc(c(c1)O[13CH3])OC 7a_100000056475_200025704644 [0,2,0,0,0,0|0,0,0]=2 7323 B16R1.4276 COC(=O)CNc1ccc(c(c1)OC)C#N 34a_100011999456_100000747449 [0,2,0,0,0,0|2,0,0]=4 7324 B16R1.4276 COC(=O)CNc1ccc(c(c1)OC)CO 34a_100012183141_100000747449 [0,2,0,0,0,0|1,0,0]=3 7325 B16R1.4276 COC(=O)CNc1ccc(c(c1)OC)OC 34a_100000187404_100000747449 [0,2,0,0,0,0|1,0,0]=3 7326 B16R1.4276 COC(=O)COc1ccc(c(c1)OC)CO 34a_200000116926_100000747449 [0,2,0,0,0,0|1,0,0]=3 7327 B16R1.4276 COC(=O)COc1ccc(c(c1)OC)OC 34a_100000039706_100000747449 [0,2,0,0,0,0|1,0,0]=3 7328 B16R1.4276 COC(=O)CSc1cc(c(cn1)CO)OC 62a_100000747449_100010714672 [0,2,0,0,0,0|2,0,0]=4 7329 B16R1.4276 COC(=O)CSc1cc(c(cn1)CO)OC 62a_100010714672_100000747449 [0,2,0,0,0,0|2,0,0]=4 7330 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)C#N 62a_100000747449_100000694671 [0,2,0,0,0,0|2,0,0]=4 7331 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)C=O 62a_100000697075_100000747449 [0,2,0,0,0,0|1,0,1]=4 7332 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)C=O 62a_100000747449_100010290300 [0,2,0,0,0,0|1,0,1]=4 7333 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)CO 62a_100000747449_100011277633 [0,2,0,0,0,0|1,0,0]=3 7334 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)CO 62a_100011277633_100000747449 [0,2,0,0,0,0|1,0,0]=3 7335 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)OC 62a_100000747449_100011356967 [0,2,0,0,0,0|1,0,0]=3 7336 B16R1.4276 COC(=O)CSc1ccc(c(c1)OC)SC 62a_200011001119_100000747449 [0,2,0,0,0,0|1,1,0]=4 7337 B16R1.4276 COC(=O)CSc1ccc(c(c1)SC)OC 62a_200009892704_100000747449 [0,2,0,0,0,0|1,1,0]=4 7338 B16R1.4276 COC(=O)CSc1ccc(c(n1)OC)CO 62a_100000747449_100010988397 [0,2,0,0,0,0|2,0,0]=4 7339 B16R1.4276 COC(=O)CSc1ccc(c(n1)OC)CO 62a_100010988397_100000747449 [0,2,0,0,0,0|2,0,0]=4 7340 B16R1.4276 COC(=O)CSc1ccc(c(n1)OC)OC 62a_100000747449_100010214848 [0,2,0,0,0,0|2,0,0]=4 7341 B16R1.4276 COC(=O)CSc1cnc(c(c1)OC)CO 62a_100000747449_200010246159 [0,2,0,0,0,0|2,0,0]=4 7342 B16R1.4276 COC(=O)CSc1cnc(c(c1)OC)CO 62a_200010246159_100000747449 [0,2,0,0,0,0|2,0,0]=4 7343 B16R1.4276 COC(=O)CSc1cnc(c(c1)OC)OC 62a_100000747449_100010234541 [0,2,0,0,0,0|2,0,0]=4 7344 B16R1.4276 COc1cc(ccc1CO)OCC(=O)CF 1458a_200000048963_100015361967 [0,2,0,0,0,0|1,0,0]=3 7345 B16R1.4276 COc1ccc(cc1OC)C=CC(=O)CF 1458a_100015194992_100015361967 [0,2,0,0,0,0|0,0,2]=4 7346 B16R1.4276 COc1ccc(cc1OC)CCC(=O)CF 1458a_100000187252_100015361967 [0,2,0,0,0,0|0,0,0]=2 7347 B16R1.4276 COc1ccc(cc1OC)CCC(=O)CO 1458a_100000210174_100011740610 [0,2,0,0,0,0|0,0,0]=2 7348 B16R1.4276 COc1ccc(cc1OC)CCN(C)CF 269982a_100000211294_100015361967 [0,2,0,0,0,0|2,0,0]=4 7349 B16R1.4276 COc1ccc(cc1OC)CNC(=O)CO 240690a_100000185555_100000210174 [0,2,0,0,0,0|1,0,0]=3 7350 B16R1.4276 COc1ccc(cc1OC)CNC(=O)CO 527a_100000185555_100000210174 [0,2,0,0,0,0|1,0,0]=3 7351 B16R1.4762 CCN(CC)CCc1ccc(c(c1)OC)O 2230a_100000724800_100010741665 [0,2,0,0,0,0|2,0,0]=4 7352 B16R1.4762 CCN(CC)CCc1ccc(c(c1)OC)O 269956a_100000042499_100010741665 [0,2,0,0,0,0|2,0,0]=4 7353 B16R1.4762 CCN(CC)CCc1ccc(c(c1)OC)O 269982a_100000724800_100010741665 [0,2,0,0,0,0|2,0,0]=4 7354 B16R1.15083 C#CCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000184674 [0,2,0,0,0,0|0,0,2]=4 7355 B16R1.15083 C#CCC(=O)CCc1ccc(c(c1)OC)C 1458a_200000066385_100000184674 [0,2,0,0,0,0|1,0,0]=3 7356 B16R1.15083 C#CCC(=O)CCc1ccc(c(c1)OC)F 1458a_100009849056_100000184674 [0,2,0,0,0,0|1,0,0]=3 7357 B16R1.15083 C#CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000184674 [0,2,0,0,0,0|0,0,0]=2 7358 B16R1.15083 C#CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011220946_100010741665 [0,2,0,0,0,0|0,0,0]=2 7359 B16R1.15083 C#CCC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100011220946 [0,2,0,0,0,0|2,0,0]=4 7360 B16R1.15083 C#CCC(=O)NCc1ccc(c(c1)OC)Cl 527a_100015204853_100011220946 [0,2,0,0,0,0|2,0,0]=4 7361 B16R1.15083 C#CCC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100011220946 [0,2,0,0,0,0|2,0,0]=4 7362 B16R1.15083 C#CCC(=O)NCc1ccc(c(c1)OC)F 527a_100020626639_100011220946 [0,2,0,0,0,0|2,0,0]=4 7363 B16R1.15083 C#CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100011220946 [0,2,0,0,0,0|1,0,0]=3 7364 B16R1.15083 C#CCN(C)CCc1ccc(c(c1)OC)O 2230a_100000225692_100010741665 [0,2,0,0,0,0|2,0,0]=4 7365 B16R1.15083 C=CCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000210623 [0,2,0,0,0,0|0,0,2]=4 7366 B16R1.15083 C=CCC(=O)CCc1ccc(c(c1)OC)C 1458a_200000066385_100000210623 [0,2,0,0,0,0|1,0,0]=3 7367 B16R1.15083 C=CCC(=O)CCc1ccc(c(c1)OC)F 1458a_100009849056_100000210623 [0,2,0,0,0,0|1,0,0]=3 7368 B16R1.15083 C=CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210193_100010741665 [0,2,0,0,0,0|0,0,0]=2 7369 B16R1.15083 C=CCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210623 [0,2,0,0,0,0|0,0,0]=2 7370 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)Cl 11a_100015204853_100000210193 [0,2,0,0,0,0|2,0,0]=4 7371 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000210193 [0,2,0,0,0,0|2,0,0]=4 7372 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_100000210193 [0,2,0,0,0,0|2,0,0]=4 7373 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)Cl 527a_100015204853_100000210193 [0,2,0,0,0,0|2,0,0]=4 7374 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)F 11a_100020626639_100000210193 [0,2,0,0,0,0|2,0,0]=4 7375 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000210193 [0,2,0,0,0,0|2,0,0]=4 7376 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_100000210193 [0,2,0,0,0,0|2,0,0]=4 7377 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)F 527a_100020626639_100000210193 [0,2,0,0,0,0|2,0,0]=4 7378 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210193 [0,2,0,0,0,0|1,0,0]=3 7379 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210193 [0,2,0,0,0,0|1,0,0]=3 7380 B16R1.15083 C=CCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210193 [0,2,0,0,0,0|1,0,0]=3 7381 B16R1.15083 C=CCN(C)CCc1ccc(c(c1)OC)O 2230a_100000225617_100010741665 [0,2,0,0,0,0|2,0,0]=4 7382 B16R1.15083 C=CCN(C)CCc1ccc(c(c1)OC)O 269982a_100000225617_100010741665 [0,2,0,0,0,0|2,0,0]=4 7383 B16R1.15083 C=COC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000036128 [0,2,0,0,0,0|1,0,1]=4 7384 B16R1.15083 C=COC(=O)CSc1ccc(c(c1)OC)O 62a_100000036128_100000694246 [0,2,0,0,0,0|1,0,1]=4 7385 B16R1.15083 CC#CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000763181_100010741665 [0,2,0,0,0,0|0,0,0]=2 7386 B16R1.15083 CC=CC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210699_100010741665 [0,2,0,0,0,0|0,0,0]=2 7387 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)Cl 11a_100015204853_100000210699 [0,2,0,0,0,0|2,0,0]=4 7388 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000210699 [0,2,0,0,0,0|2,0,0]=4 7389 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_100000210699 [0,2,0,0,0,0|2,0,0]=4 7390 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)F 11a_100020626639_100000210699 [0,2,0,0,0,0|2,0,0]=4 7391 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000210699 [0,2,0,0,0,0|2,0,0]=4 7392 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_100000210699 [0,2,0,0,0,0|2,0,0]=4 7393 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210699 [0,2,0,0,0,0|1,0,0]=3 7394 B16R1.15083 CC=CC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210699 [0,2,0,0,0,0|1,0,0]=3 7395 B16R1.15083 CCCC(=O)C=Cc1ccc(c(c1)OC)O 1458a_100000182119_100000210303 [0,2,0,0,0,0|0,0,2]=4 7396 B16R1.15083 CCCC(=O)CCc1ccc(c(c1)OC)C 1458a_200000066385_100000210303 [0,2,0,0,0,0|1,0,0]=3 7397 B16R1.15083 CCCC(=O)CCc1ccc(c(c1)OC)F 1458a_100009849056_100000210303 [0,2,0,0,0,0|1,0,0]=3 7398 B16R1.15083 CCCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000211992_100010741665 [0,2,0,0,0,0|0,0,0]=2 7399 B16R1.15083 CCCC(=O)CCc1ccc(c(c1)OC)O 1458a_100011216321_100000210303 [0,2,0,0,0,0|0,0,0]=2 7400 B16R1.15083 CCCC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000747444 [0,2,0,0,0,0|2,0,0]=4 7401 B16R1.15083 CCCC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000747444 [0,2,0,0,0,0|2,0,0]=4 7402 B16R1.15083 CCCC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000747444 [0,2,0,0,0,0|2,0,0]=4 7403 B16R1.15083 CCCC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000747444 [0,2,0,0,0,0|2,0,0]=4 7404 B16R1.15083 CCCC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000747444 [0,2,0,0,0,0|2,0,0]=4 7405 B16R1.15083 CCCC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000747444 [0,2,0,0,0,0|2,0,0]=4 7406 B16R1.15083 CCCC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000747444 [0,2,0,0,0,0|2,0,0]=4 7407 B16R1.15083 CCCC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000747444 [0,2,0,0,0,0|2,0,0]=4 7408 B16R1.15083 CCCC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000747444 [0,2,0,0,0,0|2,0,0]=4 7409 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)CC)O 62a_100000747444_100012338938 [0,2,0,0,0,0|2,0,0]=4 7410 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)Br 62a_100000747444_100012353699 [0,2,0,0,0,0|2,0,0]=4 7411 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000747444 [0,2,0,0,0,0|2,0,0]=4 7412 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)C 62a_100000747444_100011830276 [0,2,0,0,0,0|2,0,0]=4 7413 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000747444 [0,2,0,0,0,0|2,0,0]=4 7414 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000747444_100011356853 [0,2,0,0,0,0|2,0,0]=4 7415 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000747444 [0,2,0,0,0,0|2,0,0]=4 7416 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)F 62a_100000747444_100011934186 [0,2,0,0,0,0|2,0,0]=4 7417 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000747444 [0,2,0,0,0,0|2,0,0]=4 7418 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)N 62a_100000747444_100015196925 [0,2,0,0,0,0|2,0,0]=4 7419 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000747444 [0,2,0,0,0,0|2,0,0]=4 7420 B16R1.15083 CCCC(=O)CSc1ccc(c(c1)OC)O 62a_100000747444_100000694246 [0,2,0,0,0,0|1,0,0]=3 7421 B16R1.15083 CCCC(=O)CSc1ccc(c(n1)OC)O 62a_100000747444_100010893133 [0,2,0,0,0,0|2,0,0]=4 7422 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)Cl 11a_100015204853_100000211992 [0,2,0,0,0,0|2,0,0]=4 7423 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000211992 [0,2,0,0,0,0|2,0,0]=4 7424 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_100000211992 [0,2,0,0,0,0|2,0,0]=4 7425 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)Cl 527a_100015204853_100000211992 [0,2,0,0,0,0|2,0,0]=4 7426 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)F 11a_100020626639_100000211992 [0,2,0,0,0,0|2,0,0]=4 7427 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000211992 [0,2,0,0,0,0|2,0,0]=4 7428 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_100000211992 [0,2,0,0,0,0|2,0,0]=4 7429 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)F 527a_100020626639_100000211992 [0,2,0,0,0,0|2,0,0]=4 7430 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000211992 [0,2,0,0,0,0|1,0,0]=3 7431 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000211992 [0,2,0,0,0,0|1,0,0]=3 7432 B16R1.15083 CCCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000211992 [0,2,0,0,0,0|1,0,0]=3 7433 B16R1.15083 CCCN(C)CCc1ccc(c(c1)OC)O 2230a_100000747261_100010741665 [0,2,0,0,0,0|2,0,0]=4 7434 B16R1.15083 CCCN(C)CCc1ccc(c(c1)OC)O 269982a_100000747261_100010741665 [0,2,0,0,0,0|2,0,0]=4 7435 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)C 11a_100015525214_200000066385 [0,2,0,0,0,0|1,0,0]=3 7436 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)C 240690a_100015525214_200000066385 [0,2,0,0,0,0|1,0,0]=3 7437 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)C 527a_100015525214_200000066385 [0,2,0,0,0,0|1,0,0]=3 7438 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)F 11a_100015525214_100009849056 [0,2,0,0,0,0|1,0,0]=3 7439 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)F 240690a_100015525214_100009849056 [0,2,0,0,0,0|1,0,0]=3 7440 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)F 527a_100015525214_100009849056 [0,2,0,0,0,0|1,0,0]=3 7441 B16R1.15083 CCNC(=O)CCc1ccc(c(c1)OC)O 240690a_100015525214_100011216321 [0,2,0,0,0,0|0,0,0]=2 7442 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000183381 [0,2,0,0,0,0|2,0,0]=4 7443 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000183381 [0,2,0,0,0,0|2,0,0]=4 7444 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000183381 [0,2,0,0,0,0|2,0,0]=4 7445 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)C 34a_100011279678_100000183381 [0,2,0,0,0,0|2,0,0]=4 7446 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000183381 [0,2,0,0,0,0|2,0,0]=4 7447 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000183381 [0,2,0,0,0,0|2,0,0]=4 7448 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000183381 [0,2,0,0,0,0|2,0,0]=4 7449 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)F 34a_100000701188_100000183381 [0,2,0,0,0,0|2,0,0]=4 7450 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)I 34a_100000746945_100000183381 [0,2,0,0,0,0|2,0,0]=4 7451 B16R1.15083 CCNC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000183381 [0,2,0,0,0,0|1,0,0]=3 7452 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)Br 34a_100011827694_100000183381 [0,2,0,0,0,0|2,0,0]=4 7453 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000183381 [0,2,0,0,0,0|2,0,0]=4 7454 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)C 34a_100009865632_100000183381 [0,2,0,0,0,0|2,0,0]=4 7455 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000183381 [0,2,0,0,0,0|2,0,0]=4 7456 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000183381 [0,2,0,0,0,0|2,0,0]=4 7457 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000183381 [0,2,0,0,0,0|2,0,0]=4 7458 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)F 34a_100012001760_100000183381 [0,2,0,0,0,0|2,0,0]=4 7459 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000183381 [0,2,0,0,0,0|2,0,0]=4 7460 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)N 34a_100015326901_100000183381 [0,2,0,0,0,0|2,0,0]=4 7461 B16R1.15083 CCNC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000183381 [0,2,0,0,0,0|2,0,0]=4 7462 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)CC)O 62a_100000183381_100012338938 [0,2,0,0,0,0|2,0,0]=4 7463 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)Br 62a_100000183381_100012353699 [0,2,0,0,0,0|2,0,0]=4 7464 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000183381 [0,2,0,0,0,0|2,0,0]=4 7465 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)C 62a_100000183381_100011830276 [0,2,0,0,0,0|2,0,0]=4 7466 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000183381 [0,2,0,0,0,0|2,0,0]=4 7467 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000183381_100011356853 [0,2,0,0,0,0|2,0,0]=4 7468 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000183381 [0,2,0,0,0,0|2,0,0]=4 7469 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)F 62a_100000183381_100011934186 [0,2,0,0,0,0|2,0,0]=4 7470 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000183381 [0,2,0,0,0,0|2,0,0]=4 7471 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)N 62a_100000183381_100015196925 [0,2,0,0,0,0|2,0,0]=4 7472 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000183381 [0,2,0,0,0,0|2,0,0]=4 7473 B16R1.15083 CCNC(=O)CSc1ccc(c(c1)OC)O 62a_100000183381_100000694246 [0,2,0,0,0,0|1,0,0]=3 7474 B16R1.15083 CCNC(=O)CSc1ccc(c(n1)OC)O 62a_100000183381_100010893133 [0,2,0,0,0,0|2,0,0]=4 7475 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)Cl 2708a_100015204853_100015525214 [0,2,0,0,0,0|2,0,0]=4 7476 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)Cl 2708a_100015525214_100015204853 [0,2,0,0,0,0|2,0,0]=4 7477 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100015204853_100015525214 [0,2,0,0,0,0|2,0,0]=4 7478 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100015525214_100015204853 [0,2,0,0,0,0|2,0,0]=4 7479 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)Cl 512a_100015204853_100015525214 [0,2,0,0,0,0|2,0,0]=4 7480 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)Cl 512a_100015525214_100015204853 [0,2,0,0,0,0|2,0,0]=4 7481 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)F 2708a_100015525214_100020626639 [0,2,0,0,0,0|2,0,0]=4 7482 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)F 2708a_100020626639_100015525214 [0,2,0,0,0,0|2,0,0]=4 7483 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)F 273464a_100015525214_100020626639 [0,2,0,0,0,0|2,0,0]=4 7484 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)F 273464a_100020626639_100015525214 [0,2,0,0,0,0|2,0,0]=4 7485 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)F 512a_100015525214_100020626639 [0,2,0,0,0,0|2,0,0]=4 7486 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)F 512a_100020626639_100015525214 [0,2,0,0,0,0|2,0,0]=4 7487 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 2708a_100000185554_100015525214 [0,2,0,0,0,0|1,0,0]=3 7488 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 2708a_100015525214_100000185554 [0,2,0,0,0,0|1,0,0]=3 7489 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100015525214 [0,2,0,0,0,0|1,0,0]=3 7490 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 273464a_100015525214_100000185554 [0,2,0,0,0,0|1,0,0]=3 7491 B16R1.15083 CCNC(=O)NCc1ccc(c(c1)OC)O 512a_100015525214_100000185554 [0,2,0,0,0,0|1,0,0]=3 7492 B16R1.15083 CCOC(=O)C=Cc1ccc(c(c1)OC)O 271570a_100010199719_100000694246 [0,2,0,0,0,0|0,0,2]=4 7493 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000188475 [0,2,0,0,0,0|2,0,0]=4 7494 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000188475 [0,2,0,0,0,0|2,0,0]=4 7495 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000188475 [0,2,0,0,0,0|2,0,0]=4 7496 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)C 34a_100011279678_100000188475 [0,2,0,0,0,0|2,0,0]=4 7497 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000188475 [0,2,0,0,0,0|2,0,0]=4 7498 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000188475 [0,2,0,0,0,0|2,0,0]=4 7499 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000188475 [0,2,0,0,0,0|2,0,0]=4 7500 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)F 34a_100000701188_100000188475 [0,2,0,0,0,0|2,0,0]=4 7501 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)I 34a_100000746945_100000188475 [0,2,0,0,0,0|2,0,0]=4 7502 B16R1.15083 CCOC(=O)CNc1ccc(c(c1)OC)O 34a_100000726020_100000188475 [0,2,0,0,0,0|1,0,0]=3 7503 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)Br 34a_100011827694_100000188475 [0,2,0,0,0,0|2,0,0]=4 7504 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)Br 7a_100011827694_100000188475 [0,2,0,0,0,0|2,0,0]=4 7505 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)C 34a_100009865632_100000188475 [0,2,0,0,0,0|2,0,0]=4 7506 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)C 7a_100009865632_100000188475 [0,2,0,0,0,0|2,0,0]=4 7507 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000188475 [0,2,0,0,0,0|2,0,0]=4 7508 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000188475 [0,2,0,0,0,0|2,0,0]=4 7509 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)F 34a_100012001760_100000188475 [0,2,0,0,0,0|2,0,0]=4 7510 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)F 7a_100012001760_100000188475 [0,2,0,0,0,0|2,0,0]=4 7511 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)N 34a_100015326901_100000188475 [0,2,0,0,0,0|2,0,0]=4 7512 B16R1.15083 CCOC(=O)COc1ccc(c(c1)OC)N 7a_100015326901_100000188475 [0,2,0,0,0,0|2,0,0]=4 7513 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)CC)O 62a_100000188475_100012338938 [0,2,0,0,0,0|2,0,0]=4 7514 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)Br 62a_100000188475_100012353699 [0,2,0,0,0,0|2,0,0]=4 7515 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000188475 [0,2,0,0,0,0|2,0,0]=4 7516 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)C 62a_100000188475_100011830276 [0,2,0,0,0,0|2,0,0]=4 7517 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)C 62a_100011830276_100000188475 [0,2,0,0,0,0|2,0,0]=4 7518 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)Cl 62a_100000188475_100011356853 [0,2,0,0,0,0|2,0,0]=4 7519 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000188475 [0,2,0,0,0,0|2,0,0]=4 7520 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)F 62a_100000188475_100011934186 [0,2,0,0,0,0|2,0,0]=4 7521 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)F 62a_100011934186_100000188475 [0,2,0,0,0,0|2,0,0]=4 7522 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)N 62a_100000188475_100015196925 [0,2,0,0,0,0|2,0,0]=4 7523 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)N 62a_100011279103_100000188475 [0,2,0,0,0,0|2,0,0]=4 7524 B16R1.15083 CCOC(=O)CSc1ccc(c(c1)OC)O 62a_100000188475_100000694246 [0,2,0,0,0,0|1,0,0]=3 7525 B16R1.15083 CCOC(=O)CSc1ccc(c(n1)OC)O 62a_100000188475_100010893133 [0,2,0,0,0,0|2,0,0]=4 7526 B16R1.15083 CCc1cc(ccc1O)SCC(=O)NCO 62a_100000185155_100012338938 [0,2,0,0,0,0|2,0,0]=4 7527 B16R1.15083 CNNC(=O)CCc1ccc(c(c1)OC)C 22a_100016993582_200000066385 [0,2,0,0,0,0|1,0,0]=3 7528 B16R1.15083 CNNC(=O)CCc1ccc(c(c1)OC)F 22a_100016993582_100009849056 [0,2,0,0,0,0|1,0,0]=3 7529 B16R1.15083 CNNC(=O)CCc1ccc(c(c1)OC)O 22a_100016993582_100011216321 [0,2,0,0,0,0|0,0,0]=2 7530 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)Cl 273464a_100015204853_100016993582 [0,2,0,0,0,0|2,0,0]=4 7531 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)Cl 512a_100015204853_100016993582 [0,2,0,0,0,0|2,0,0]=4 7532 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)Cl 512a_100016993582_100015204853 [0,2,0,0,0,0|2,0,0]=4 7533 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)F 273464a_100020626639_100016993582 [0,2,0,0,0,0|2,0,0]=4 7534 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)F 512a_100016993582_100020626639 [0,2,0,0,0,0|2,0,0]=4 7535 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)F 512a_100020626639_100016993582 [0,2,0,0,0,0|2,0,0]=4 7536 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)O 273464a_100000185554_100016993582 [0,2,0,0,0,0|1,0,0]=3 7537 B16R1.15083 CNNC(=O)NCc1ccc(c(c1)OC)O 512a_100016993582_100000185554 [0,2,0,0,0,0|1,0,0]=3 7538 B16R1.15083 COCC(=O)CCc1ccc(c(c1)OC)O 1458a_100000210968_100010741665 [0,2,0,0,0,0|0,0,0]=2 7539 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)Cl 11a_100015204853_100000210968 [0,2,0,0,0,0|2,0,0]=4 7540 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)Cl 1626a_100015204853_100000210968 [0,2,0,0,0,0|2,0,0]=4 7541 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)Cl 240690a_100015204853_100000210968 [0,2,0,0,0,0|2,0,0]=4 7542 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)Cl 527a_100015204853_100000210968 [0,2,0,0,0,0|2,0,0]=4 7543 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)F 11a_100020626639_100000210968 [0,2,0,0,0,0|2,0,0]=4 7544 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)F 1626a_100020626639_100000210968 [0,2,0,0,0,0|2,0,0]=4 7545 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)F 240690a_100020626639_100000210968 [0,2,0,0,0,0|2,0,0]=4 7546 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)F 527a_100020626639_100000210968 [0,2,0,0,0,0|2,0,0]=4 7547 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O 11a_100000185554_100000210968 [0,2,0,0,0,0|1,0,0]=3 7548 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O 240690a_100000185554_100000210968 [0,2,0,0,0,0|1,0,0]=3 7549 B16R1.15083 COCC(=O)NCc1ccc(c(c1)OC)O 527a_100000185554_100000210968 [0,2,0,0,0,0|1,0,0]=3 7550 B16R1.15083 COc1cc(ccc1Br)NCC(=O)NCO 2230a_100000765947_100000185155 [0,2,0,0,0,0|2,0,0]=4 7551 B16R1.15083 COc1cc(ccc1Br)NCC(=O)NCO 34a_100000765947_100000185155 [0,2,0,0,0,0|2,0,0]=4 7552 B16R1.15083 COc1cc(ccc1Br)OCC(=O)NCO 34a_100011827694_100000185155 [0,2,0,0,0,0|2,0,0]=4 7553 B16R1.15083 COc1cc(ccc1Br)OCC(=O)NCO 7a_100011827694_100000185155 [0,2,0,0,0,0|2,0,0]=4 7554 B16R1.15083 COc1cc(ccc1Br)SCC(=O)NCO 62a_100000185155_100012353699 [0,2,0,0,0,0|2,0,0]=4 7555 B16R1.15083 COc1cc(ccc1Br)SCC(=O)NCO 62a_100012353699_100000185155 [0,2,0,0,0,0|2,0,0]=4 7556 B16R1.15083 COc1cc(ccc1C)CCC(=O)CC#N 1458a_200000066385_100011214920 [0,2,0,0,0,0|1,0,0]=3 7557 B16R1.15083 COc1cc(ccc1C)CCC(=O)CCF 1458a_200000066385_100011217306 [0,2,0,0,0,0|1,0,0]=3 7558 B16R1.15083 COc1cc(ccc1C)CCC(=O)CCO 1458a_200000066385_100000211926 [0,2,0,0,0,0|1,0,0]=3 7559 B16R1.15083 COc1cc(ccc1C)NCC(=O)NCO 2230a_100011279678_100000185155 [0,2,0,0,0,0|2,0,0]=4 7560 B16R1.15083 COc1cc(ccc1C)NCC(=O)NCO 34a_100011279678_100000185155 [0,2,0,0,0,0|2,0,0]=4 7561 B16R1.15083 COc1cc(ccc1C)OCC(=O)NCO 34a_100009865632_100000185155 [0,2,0,0,0,0|2,0,0]=4 7562 B16R1.15083 COc1cc(ccc1C)OCC(=O)NCO 7a_100009865632_100000185155 [0,2,0,0,0,0|2,0,0]=4 7563 B16R1.15083 COc1cc(ccc1C)SCC(=O)NCO 62a_100000185155_100011830276 [0,2,0,0,0,0|2,0,0]=4 7564 B16R1.15083 COc1cc(ccc1C)SCC(=O)NCO 62a_100011830276_100000185155 [0,2,0,0,0,0|2,0,0]=4 7565 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CC#N 1626a_100015204853_100051588842 [0,2,0,0,0,0|2,0,0]=4 7566 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CC#N 240690a_100015204853_100051588842 [0,2,0,0,0,0|2,0,0]=4 7567 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CCO 240690a_100015204853_100011216618 [0,2,0,0,0,0|2,0,0]=4 7568 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CSC 11a_100015204853_100000184570 [0,2,0,0,0,0|2,0,0]=4 7569 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CSC 1626a_100015204853_100000184570 [0,2,0,0,0,0|2,0,0]=4 7570 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CSC 240690a_100015204853_100000184570 [0,2,0,0,0,0|2,0,0]=4 7571 B16R1.15083 COc1cc(ccc1Cl)CNC(=O)CSC 527a_100015204853_100000184570 [0,2,0,0,0,0|2,0,0]=4 7572 B16R1.15083 COc1cc(ccc1Cl)NCC(=O)NCO 2230a_100000742311_100000185155 [0,2,0,0,0,0|2,0,0]=4 7573 B16R1.15083 COc1cc(ccc1Cl)NCC(=O)NCO 34a_100000742311_100000185155 [0,2,0,0,0,0|2,0,0]=4 7574 B16R1.15083 COc1cc(ccc1Cl)OCC(=O)NCO 34a_100012186310_100000185155 [0,2,0,0,0,0|2,0,0]=4 7575 B16R1.15083 COc1cc(ccc1Cl)OCC(=O)NCO 7a_100012186310_100000185155 [0,2,0,0,0,0|2,0,0]=4 7576 B16R1.15083 COc1cc(ccc1Cl)SCC(=O)NCO 62a_100000185155_100011356853 [0,2,0,0,0,0|2,0,0]=4 7577 B16R1.15083 COc1cc(ccc1Cl)SCC(=O)NCO 62a_100011356853_100000185155 [0,2,0,0,0,0|2,0,0]=4 7578 B16R1.15083 COc1cc(ccc1F)CCC(=O)CC#N 1458a_100009849056_100011214920 [0,2,0,0,0,0|1,0,0]=3 7579 B16R1.15083 COc1cc(ccc1F)CCC(=O)CCF 1458a_100009849056_100011217306 [0,2,0,0,0,0|1,0,0]=3 7580 B16R1.15083 COc1cc(ccc1F)CCC(=O)CCO 1458a_100009849056_100000211926 [0,2,0,0,0,0|1,0,0]=3 7581 B16R1.15083 COc1cc(ccc1F)CNC(=O)CC#N 1626a_100020626639_100051588842 [0,2,0,0,0,0|2,0,0]=4 7582 B16R1.15083 COc1cc(ccc1F)CNC(=O)CC#N 240690a_100020626639_100051588842 [0,2,0,0,0,0|2,0,0]=4 7583 B16R1.15083 COc1cc(ccc1F)CNC(=O)CCO 240690a_100020626639_100011216618 [0,2,0,0,0,0|2,0,0]=4 7584 B16R1.15083 COc1cc(ccc1F)CNC(=O)CSC 11a_100020626639_100000184570 [0,2,0,0,0,0|2,0,0]=4 7585 B16R1.15083 COc1cc(ccc1F)CNC(=O)CSC 1626a_100020626639_100000184570 [0,2,0,0,0,0|2,0,0]=4 7586 B16R1.15083 COc1cc(ccc1F)CNC(=O)CSC 240690a_100020626639_100000184570 [0,2,0,0,0,0|2,0,0]=4 7587 B16R1.15083 COc1cc(ccc1F)CNC(=O)CSC 527a_100020626639_100000184570 [0,2,0,0,0,0|2,0,0]=4 7588 B16R1.15083 COc1cc(ccc1F)NCC(=O)NCO 2230a_100000701188_100000185155 [0,2,0,0,0,0|2,0,0]=4 7589 B16R1.15083 COc1cc(ccc1F)NCC(=O)NCO 34a_100000701188_100000185155 [0,2,0,0,0,0|2,0,0]=4 7590 B16R1.15083 COc1cc(ccc1F)OCC(=O)NCO 34a_100012001760_100000185155 [0,2,0,0,0,0|2,0,0]=4 7591 B16R1.15083 COc1cc(ccc1F)OCC(=O)NCO 7a_100012001760_100000185155 [0,2,0,0,0,0|2,0,0]=4 7592 B16R1.15083 COc1cc(ccc1F)SCC(=O)NCO 62a_100000185155_100011934186 [0,2,0,0,0,0|2,0,0]=4 7593 B16R1.15083 COc1cc(ccc1F)SCC(=O)NCO 62a_100011934186_100000185155 [0,2,0,0,0,0|2,0,0]=4 7594 B16R1.15083 COc1cc(ccc1I)NCC(=O)NCO 34a_100000746945_100000185155 [0,2,0,0,0,0|2,0,0]=4 7595 B16R1.15083 COc1cc(ccc1N)OCC(=O)NCO 34a_100015326901_100000185155 [0,2,0,0,0,0|2,0,0]=4 7596 B16R1.15083 COc1cc(ccc1N)OCC(=O)NCO 7a_100015326901_100000185155 [0,2,0,0,0,0|2,0,0]=4 7597 B16R1.15083 COc1cc(ccc1N)SCC(=O)NCO 62a_100000185155_100015196925 [0,2,0,0,0,0|2,0,0]=4 7598 B16R1.15083 COc1cc(ccc1N)SCC(=O)NCO 62a_100011279103_100000185155 [0,2,0,0,0,0|2,0,0]=4 7599 B16R1.15083 COc1cc(ccc1O)C=CC(=O)CC#N 1458a_100000182119_100011214920 [0,2,0,0,0,0|0,0,2]=4 7600 B16R1.15083 COc1cc(ccc1O)C=CC(=O)CCF 1458a_100000182119_100011217306 [0,2,0,0,0,0|0,0,2]=4 7601 B16R1.15083 COc1cc(ccc1O)C=CC(=O)CCO 1458a_100000182119_100000211926 [0,2,0,0,0,0|0,0,2]=4 7602 B16R1.15083 COc1cc(ccc1O)CCC(=O)C=CBr 1458a_100016273825_100010741665 [0,2,0,0,0,0|0,0,1]=3 7603 B16R1.15083 COc1cc(ccc1O)CCC(=O)C=CCl 1458a_200016279998_100010741665 [0,2,0,0,0,0|0,0,1]=3 7604 B16R1.15083 COc1cc(ccc1O)CCC(=O)C=CI 1458a_100016256311_100010741665 [0,2,0,0,0,0|0,0,1]=3 7605 B16R1.15083 COc1cc(ccc1O)CCC(=O)CC#N 1458a_100011216321_100011214920 [0,2,0,0,0,0|0,0,0]=2 7606 B16R1.15083 COc1cc(ccc1O)CCC(=O)CC#N 1458a_100051588842_100010741665 [0,2,0,0,0,0|0,0,0]=2 7607 B16R1.15083 COc1cc(ccc1O)CCC(=O)CCF 1458a_100011216321_100011217306 [0,2,0,0,0,0|0,0,0]=2 7608 B16R1.15083 COc1cc(ccc1O)CCC(=O)CCO 1458a_100011216321_100000211926 [0,2,0,0,0,0|0,0,0]=2 7609 B16R1.15083 COc1cc(ccc1O)CCC(=O)CCO 1458a_100011216618_100010741665 [0,2,0,0,0,0|0,0,0]=2 7610 B16R1.15083 COc1cc(ccc1O)CCC(=O)CSC 1458a_100000184570_100010741665 [0,2,0,0,0,0|0,0,0]=2 7611 B16R1.15083 COc1cc(ccc1O)CCN(C)CC#N 2230a_100000748184_100010741665 [0,2,0,0,0,0|2,0,0]=4 7612 B16R1.15083 COc1cc(ccc1O)CCN(C)CCO 2230a_100000210263_100010741665 [0,2,0,0,0,0|1,0,1]=4 7613 B16R1.15083 COc1cc(ccc1O)CCN(C)CCO 269982a_100000210263_100010741665 [0,2,0,0,0,0|1,0,1]=4 7614 B16R1.15083 COc1cc(ccc1O)CNC(=O)C=CBr 240690a_100000185554_100016273825 [0,2,0,0,0,0|1,0,1]=4 7615 B16R1.15083 COc1cc(ccc1O)CNC(=O)C=CCl 11a_100000185554_200016279998 [0,2,0,0,0,0|1,0,1]=4 7616 B16R1.15083 COc1cc(ccc1O)CNC(=O)C=CCl 240690a_100000185554_200016279998 [0,2,0,0,0,0|1,0,1]=4 7617 B16R1.15083 COc1cc(ccc1O)CNC(=O)CC#N 240690a_100000185554_100051588842 [0,2,0,0,0,0|1,0,0]=3 7618 B16R1.15083 COc1cc(ccc1O)CNC(=O)CCO 240690a_100000185554_100011216618 [0,2,0,0,0,0|1,0,0]=3 7619 B16R1.15083 COc1cc(ccc1O)CNC(=O)CSC 11a_100000185554_100000184570 [0,2,0,0,0,0|1,0,0]=3 7620 B16R1.15083 COc1cc(ccc1O)CNC(=O)CSC 240690a_100000185554_100000184570 [0,2,0,0,0,0|1,0,0]=3 7621 B16R1.15083 COc1cc(ccc1O)CNC(=O)CSC 527a_100000185554_100000184570 [0,2,0,0,0,0|1,0,0]=3 7622 B16R1.15083 COc1cc(ccc1O)NCC(=O)NCO 34a_100000726020_100000185155 [0,2,0,0,0,0|1,0,0]=3 7623 B16R1.15083 COc1cc(ccc1O)SCC(=O)NCO 62a_100000185155_100000694246 [0,2,0,0,0,0|1,0,0]=3 7624 B16R1.15083 COc1nc(ccc1O)SCC(=O)NCO 62a_100000185155_100010893133 [0,2,0,0,0,0|2,0,0]=4 7625 B16R1.35447 CCC(=O)COc1ccc(c(c1F)OC)F 7a_100000062073_100000747405 [0,2,0,0,0,0|2,0,0]=4 7626 B16R1.35447 CCC(=O)CSc1ccc(c(c1F)OC)Cl 62a_100000747405_200135222481 [0,2,0,0,0,0|2,0,0]=4 7627 B16R1.35447 CCC(=O)CSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000747405 [0,2,0,0,0,0|2,0,0]=4 7628 B16R1.35447 CCC(=O)CSc1ccc(c(c1F)OC)N 62a_100000747405_100010734149 [0,2,0,0,0,0|2,0,0]=4 7629 B16R1.35447 CCC(=O)CSc1ccc(c(c1F)OC)N 62a_100010734149_100000747405 [0,2,0,0,0,0|2,0,0]=4 7630 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)Cl 11a_200009889119_100000210414 [0,2,0,0,0,0|2,0,0]=4 7631 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)Cl 1626a_200009889119_100000210414 [0,2,0,0,0,0|2,0,0]=4 7632 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)Cl 240690a_200009889119_100000210414 [0,2,0,0,0,0|2,0,0]=4 7633 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)Cl 527a_200009889119_100000210414 [0,2,0,0,0,0|2,0,0]=4 7634 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)F 11a_115082355467_100000210414 [0,2,0,0,0,0|2,0,0]=4 7635 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)F 1626a_115082355467_100000210414 [0,2,0,0,0,0|2,0,0]=4 7636 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)F 240690a_115082355467_100000210414 [0,2,0,0,0,0|2,0,0]=4 7637 B16R1.35447 CCC(=O)NCc1ccc(c(c1F)OC)F 527a_115082355467_100000210414 [0,2,0,0,0,0|2,0,0]=4 7638 B16R1.35447 CNC(=O)CNc1ccc(c(c1F)OC)F 34a_100137314619_100000183359 [0,2,0,0,0,0|2,0,0]=4 7639 B16R1.35447 CNC(=O)COc1ccc(c(c1F)OC)F 34a_100000062073_100000183359 [0,2,0,0,0,0|2,0,0]=4 7640 B16R1.35447 CNC(=O)COc1ccc(c(c1F)OC)F 7a_100000062073_100000183359 [0,2,0,0,0,0|2,0,0]=4 7641 B16R1.35447 CNC(=O)CSc1ccc(c(c1F)OC)Cl 62a_100000183359_200135222481 [0,2,0,0,0,0|2,0,0]=4 7642 B16R1.35447 CNC(=O)CSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000183359 [0,2,0,0,0,0|2,0,0]=4 7643 B16R1.35447 CNC(=O)CSc1ccc(c(c1F)OC)N 62a_100000183359_100010734149 [0,2,0,0,0,0|2,0,0]=4 7644 B16R1.35447 CNC(=O)CSc1ccc(c(c1F)OC)N 62a_100010734149_100000183359 [0,2,0,0,0,0|2,0,0]=4 7645 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)Cl 2708a_100102657272_200009889119 [0,2,0,0,0,0|2,0,0]=4 7646 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)Cl 2708a_200009889119_106832991635 [0,2,0,0,0,0|2,0,0]=4 7647 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)Cl 273464a_100102657272_200009889119 [0,2,0,0,0,0|2,0,0]=4 7648 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)Cl 273464a_200009889119_100102657272 [0,2,0,0,0,0|2,0,0]=4 7649 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)Cl 512a_106832991638_200009889119 [0,2,0,0,0,0|2,0,0]=4 7650 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)Cl 512a_200009889119_100102657272 [0,2,0,0,0,0|2,0,0]=4 7651 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)F 2708a_100102657272_115082355467 [0,2,0,0,0,0|2,0,0]=4 7652 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)F 2708a_115082355467_106832991635 [0,2,0,0,0,0|2,0,0]=4 7653 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)F 273464a_100102657272_115082355467 [0,2,0,0,0,0|2,0,0]=4 7654 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)F 273464a_115082355467_100102657272 [0,2,0,0,0,0|2,0,0]=4 7655 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)F 512a_106832991638_115082355467 [0,2,0,0,0,0|2,0,0]=4 7656 B16R1.35447 CNC(=O)NCc1ccc(c(c1F)OC)F 512a_115082355467_100102657272 [0,2,0,0,0,0|2,0,0]=4 7657 B16R1.35447 COC(=O)CNc1ccc(c(c1F)OC)F 34a_100137314619_100000747449 [0,2,0,0,0,0|2,0,0]=4 7658 B16R1.35447 COC(=O)COc1ccc(c(c1F)OC)F 34a_100000062073_100000747449 [0,2,0,0,0,0|2,0,0]=4 7659 B16R1.35447 COC(=O)COc1ccc(c(c1F)OC)F 7a_100000062073_100000747449 [0,2,0,0,0,0|2,0,0]=4 7660 B16R1.35447 COC(=O)CSc1ccc(c(c1F)OC)Cl 62a_100000747449_200135222481 [0,2,0,0,0,0|2,0,0]=4 7661 B16R1.35447 COC(=O)CSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000747449 [0,2,0,0,0,0|2,0,0]=4 7662 B16R1.35447 COC(=O)CSc1ccc(c(c1F)OC)N 62a_100000747449_100010734149 [0,2,0,0,0,0|2,0,0]=4 7663 B16R1.35447 COC(=O)CSc1ccc(c(c1F)OC)N 62a_100010734149_100000747449 [0,2,0,0,0,0|2,0,0]=4 7664 B16R1.35447 COc1c(ccc(c1F)CNC(=O)CO)Cl 240690a_200009889119_100000210174 [0,2,0,0,0,0|2,0,0]=4 7665 B16R1.35447 COc1c(ccc(c1F)CNC(=O)CO)Cl 527a_200009889119_100000210174 [0,2,0,0,0,0|2,0,0]=4 7666 B16R1.35447 COc1c(ccc(c1F)CNC(=O)CO)F 240690a_115082355467_100000210174 [0,2,0,0,0,0|2,0,0]=4 7667 B16R1.35447 COc1c(ccc(c1F)CNC(=O)CO)F 527a_115082355467_100000210174 [0,2,0,0,0,0|2,0,0]=4 7668 B16R1.20127 C=C(C)CSc1ccc(c(c1C)OC)OC 62a_100000748629_100010000156 [0,2,0,0,0,0|2,0,0]=4 7669 B16R1.20127 COc1ccc(c(c1OC)C)CCC(=O)C 1458a_200010008019_200000210301 [0,2,0,0,0,0|0,0,0]=2 7670 B16R1.20127 COc1ccc(c(c1OC)C)CCC(=O)[13CH3] 1458a_200010008019_200025704644 [0,2,0,0,0,0|0,0,0]=2 7671 B16R1.20127 COc1ccc(c(c1OC)C)SCC(=O)N 62a_100000747473_100010000156 [0,2,0,0,0,0|2,0,0]=4 7672 B16R1.20127 COc1ccc(c(c1OC)C)SCC(=O)[O-] 62a_100020667443_100010000156 [0,2,0,0,0,0|2,0,0]=4 7673 B16R1.20127 COc1ccc(c(c1OC)Cl)C=CC(=O)C 1458a_200020587463_200000210301 [0,2,0,0,0,0|0,0,2]=4 7674 B16R1.20127 COc1ccc(c(c1OC)Cl)C=CC(=O)[13CH3] 1458a_200020587463_200025704644 [0,2,0,0,0,0|0,0,2]=4 7675 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 11a_102515433231_100015343762 [0,2,0,0,0,0|1,0,0]=3 7676 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 1626a_102515433231_100015343762 [0,2,0,0,0,0|1,0,0]=3 7677 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 240690a_102515433231_100015343762 [0,2,0,0,0,0|1,0,0]=3 7678 B16R1.20127 COc1ccc(c(c1OC)Cl)CNC(=O)C 527a_102515433231_100103153847 [0,2,0,0,0,0|1,0,0]=3 7679 B16R1.4746 C=C(C)CSc1ccc(c(c1)OC)B(O)O 62a_100010245881_100000211660 [0,2,0,0,0,0|2,0,0]=4 7680 B16R1.4746 COc1cc(ccc1B(O)O)SCC(=O)N 62a_100010245881_100000747473 [0,2,0,0,0,0|2,0,0]=4 7681 B16R1.4746 COc1cc(ccc1B(O)O)SCC(=O)[O-] 62a_100010245881_100020667443 [0,2,0,0,0,0|2,0,0]=4 7682 B16R1.9381 C=C(C)CNc1ccc(c(c1)OC)OCC 2230a_100000184985_100000748629 [0,2,0,0,0,0|2,0,0]=4 7683 B16R1.9381 C=C(C)CNc1ccc(c(c1)OC)OCC 34a_100000184985_100000748629 [0,2,0,0,0,0|2,0,0]=4 7684 B16R1.9381 CCOc1ccc(cc1OC)/C=C/C(=O)C 34a_100102526088_100000210202 [0,2,0,0,0,0|0,0,2]=4 7685 B16R1.9381 CCOc1ccc(cc1OC)C=CC(=O)C 1458a_100000179813_200000210301 [0,2,0,0,0,0|0,0,2]=4 7686 B16R1.9381 CCOc1ccc(cc1OC)C=CC(=O)[13CH3] 1458a_100000179813_200025704644 [0,2,0,0,0,0|0,0,2]=4 7687 B16R1.9381 CCOc1ccc(cc1OC)CCC(=O)C 34a_100011290831_100000210202 [0,2,0,0,0,0|0,0,0]=2 7688 B16R1.9381 CCOc1ccc(cc1OC)CCC(=O)C 7a_100011290831_100000210202 [0,2,0,0,0,0|0,0,0]=2 7689 B16R1.9381 CCOc1ccc(cc1OC)CC[N+](=O)[O-] 34a_100000080128_100000210202 [0,2,0,0,0,0|2,0,0]=4 7690 B16R1.9381 CCOc1ccc(cc1OC)CC[N+](=O)[O-] 7a_100000080128_100000210202 [0,2,0,0,0,0|2,0,0]=4 7691 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 11a_200000739100_100015343762 [0,2,0,0,0,0|1,0,0]=3 7692 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 1626a_200000739100_100015343762 [0,2,0,0,0,0|1,0,0]=3 7693 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 240690a_200000739100_100015343762 [0,2,0,0,0,0|1,0,0]=3 7694 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 34a_100000046322_100000210202 [0,2,0,0,0,0|1,0,0]=3 7695 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 527a_200000739100_100103153847 [0,2,0,0,0,0|1,0,0]=3 7696 B16R1.9381 CCOc1ccc(cc1OC)CNC(=O)C 7a_100000046322_100000210202 [0,2,0,0,0,0|1,0,0]=3 7697 B16R1.9381 CCOc1ccc(cc1OC)NCC(=O)N 2230a_100000184985_100000747473 [0,2,0,0,0,0|2,0,0]=4 7698 B16R1.9381 CCOc1ccc(cc1OC)NCC(=O)N 34a_100000184985_100000187820 [0,2,0,0,0,0|2,0,0]=4 7699 B16R1.9381 CCOc1ccc(cc1OC)NCC(=O)[O-] 34a_100000184985_100020667443 [0,2,0,0,0,0|2,0,0]=4 7700 B16R1.9381 COc1cc(ccc1OCF)/C=C/C(=O)C 34a_100102526088_100015361967 [0,2,0,0,0,0|0,0,2]=4 7701 B16R1.9381 COc1cc(ccc1OCF)CCC(=O)C 34a_100011290831_100015361967 [0,2,0,0,0,0|0,0,0]=2 7702 B16R1.9381 COc1cc(ccc1OCF)CCC(=O)C 7a_100011290831_100015361967 [0,2,0,0,0,0|0,0,0]=2 7703 B16R1.9381 COc1cc(ccc1OCF)CC[N+](=O)[O-] 34a_100000080128_100015361967 [0,2,0,0,0,0|2,0,0]=4 7704 B16R1.9381 COc1cc(ccc1OCF)CC[N+](=O)[O-] 7a_100000080128_100015361967 [0,2,0,0,0,0|2,0,0]=4 7705 B16R1.9381 COc1cc(ccc1OCF)CNC(=O)C 34a_100000046322_100015361967 [0,2,0,0,0,0|1,0,0]=3 7706 B16R1.9381 COc1cc(ccc1OCF)CNC(=O)C 7a_100000046322_100015361967 [0,2,0,0,0,0|1,0,0]=3 7707 B14R1.142 CC=Cc1ccc(cc1)CCC(=O)C 271570a_100016259895_100000723691 [0,0,1,1,0,0|2,0,0]=4 7708 B14R1.713 COC(=O)c1ccc([nH]1)CCC(=O)C 1458a_100009926710_200000210301 [0,0,1,1,0,0|2,0,0]=4 7709 B14R1.713 COC(=O)c1ccc([nH]1)CCC(=O)[13CH3] 1458a_100009926710_200025704644 [0,0,1,1,0,0|2,0,0]=4 7710 B14R2.4513 Cc1c(ccc2c1NC(=O)CO2)O 271570a_203496583355_100010272156 [1,0,0,1,0,0|2,0,0]=4 7711 B14R2.8239 CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_200000210301 [1,0,0,1,0,0|2,0,0]=4 7712 B14R2.8239 [13CH3]N1CCc2cc(c(cc2C1)O)O 34a_200015384465_200025704644 [1,0,0,1,0,0|2,0,0]=4 7713 B14R2.203 COc1c(ccc2c1CCCC2)Br 34a_200010391107_200000210301 [1,0,0,1,0,0|1,0,1]=4 7714 B14R2.203 COc1c(ccc2c1CCCC2)Br 7a_200010391107_200000210301 [1,0,0,1,0,0|1,0,1]=4 7715 B14R2.203 [13CH3]Oc1c(ccc2c1CCCC2)Br 34a_200010391107_200025704644 [1,0,0,1,0,0|1,0,1]=4 7716 B14R2.203 [13CH3]Oc1c(ccc2c1CCCC2)Br 7a_200010391107_200025704644 [1,0,0,1,0,0|1,0,1]=4 7717 B14R2.991 C=CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210623 [1,0,0,1,0,0|1,0,1]=4 7718 B14R2.991 C=CCNc1ccc2c(c1)OCO2 34a_100000209953_100015514636 [1,0,0,1,0,0|1,0,1]=4 7719 B14R2.991 C=CCOc1ccc2c(c1)OCO2 34a_100000210298_100015514636 [1,0,0,1,0,0|1,0,1]=4 7720 B14R2.991 CCCCc1ccc2c(c1)CCO2 271570a_100020621405_100000729065 [1,0,0,1,0,0|1,0,1]=4 7721 B14R2.991 CCCCc1ccc2c(c1)OCC2 271570a_100020621405_100009818566 [1,0,0,1,0,0|1,0,1]=4 7722 B14R2.991 CCCCc1ccc2c(c1)OCO2 271570a_100020621405_100000688060 [1,0,0,1,0,0|0,0,1]=3 7723 B14R2.991 CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210303 [1,0,0,1,0,0|1,0,1]=4 7724 B14R2.991 CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000210303 [1,0,0,1,0,0|1,0,1]=4 7725 B14R2.991 CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000210303 [1,0,0,1,0,0|1,0,1]=4 7726 B14R2.991 CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210202 [1,0,0,1,0,0|1,0,1]=4 7727 B14R2.991 CCNCc1ccc2c(c1)OCO2 34a_100000210006_100000210202 [1,0,0,1,0,0|1,0,1]=4 7728 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100000210967_100000210202 [1,0,0,1,0,0|1,0,1]=4 7729 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100121572206_100000189651 [1,0,0,1,0,0|1,0,1]=4 7730 B14R2.991 CNCCc1ccc2c(c1)CCO2 2230a_106832991635_100000763274 [1,0,0,1,0,0|2,0,0]=4 7731 B14R2.991 CNCCc1ccc2c(c1)CCO2 34a_100102657272_100000763274 [1,0,0,1,0,0|2,0,0]=4 7732 B14R2.991 CNCCc1ccc2c(c1)CCO2 7a_106832991635_100000763274 [1,0,0,1,0,0|2,0,0]=4 7733 B14R2.991 CNCCc1ccc2c(c1)OCO2 2230a_100000204656_200000210301 [1,0,0,1,0,0|1,0,0]=3 7734 B14R2.991 CNCCc1ccc2c(c1)OCO2 34a_100000204656_200000210301 [1,0,0,1,0,0|1,0,0]=3 7735 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100012161074_200000210301 [1,0,0,1,0,0|2,0,0]=4 7736 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100138415774_100000763274 [1,0,0,1,0,0|2,0,0]=4 7737 B14R2.991 COCCc1ccc2c(c1)CCO2 7a_100012161074_200000210301 [1,0,0,1,0,0|2,0,0]=4 7738 B14R2.991 COCCc1ccc2c(c1)OCO2 34a_100011934097_200000210301 [1,0,0,1,0,0|1,0,0]=3 7739 B14R2.991 COCNc1ccc2c(c1)OCO2 2230a_100000209953_100000766300 [1,0,0,1,0,0|2,0,0]=4 7740 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_100000763274_200000210301 [1,0,0,1,0,0|2,0,0]=4 7741 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_200000210301_100000763274 [1,0,0,1,0,0|2,0,0]=4 7742 B14R2.991 CSCNc1ccc2c(c1)OCO2 2230a_100000209953_100011218213 [1,0,0,1,0,0|2,0,0]=4 7743 B14R2.991 CSCNc1ccc2c(c1)OCO2 34a_100000209953_100011218213 [1,0,0,1,0,0|2,0,0]=4 7744 B14R2.991 CSCOc1ccc2c(c1)OCO2 34a_100000210298_100011218213 [1,0,0,1,0,0|2,0,0]=4 7745 B14R2.991 O=CCNc1ccc2c(c1)CCO2 2230a_100000736984_200015260668 [1,0,0,1,0,0|2,0,0]=4 7746 B14R2.991 O=CCNc1ccc2c(c1)CCO2 34a_100000736984_200009817547 [1,0,0,1,0,0|2,0,0]=4 7747 B14R2.991 O=CCNc1ccc2c(c1)OCO2 2230a_100000209953_200015260668 [1,0,0,1,0,0|1,0,0]=3 7748 B14R2.991 O=CCNc1ccc2c(c1)OCO2 34a_100000209953_200009817547 [1,0,0,1,0,0|1,0,0]=3 7749 B14R2.991 O=CCOc1ccc2c(c1)OCO2 34a_100000210298_200009817547 [1,0,0,1,0,0|1,0,0]=3 7750 B14R2.991 O=CCSc1ccc2c(c1)CCO2 62a_100000729065_200015260668 [1,0,0,1,0,0|2,0,0]=4 7751 B14R2.991 O=CCSc1ccc2c(c1)CCO2 62a_200015260668_100000729065 [1,0,0,1,0,0|2,0,0]=4 7752 B14R2.991 O=CCSc1ccc2c(c1)OCC2 62a_100009818566_200015260668 [1,0,0,1,0,0|2,0,0]=4 7753 B14R2.991 O=CCSc1ccc2c(c1)OCC2 62a_200015260668_100009818566 [1,0,0,1,0,0|2,0,0]=4 7754 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 2230a_100000204656_200025704644 [1,0,0,1,0,0|1,0,0]=3 7755 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 34a_100000204656_200025704644 [1,0,0,1,0,0|1,0,0]=3 7756 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 34a_100012161074_200025704644 [1,0,0,1,0,0|2,0,0]=4 7757 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 7a_100012161074_200025704644 [1,0,0,1,0,0|2,0,0]=4 7758 B14R2.991 [13CH3]OCCc1ccc2c(c1)OCO2 34a_100011934097_200025704644 [1,0,0,1,0,0|1,0,0]=3 7759 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_100000763274_200025704644 [1,0,0,1,0,0|2,0,0]=4 7760 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_200025704644_100000763274 [1,0,0,1,0,0|2,0,0]=4 7761 B14R2.1416 COc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_200010010916 [1,0,0,1,0,0|0,0,0]=2 7762 B14R2.1416 CSc1cc2c(cc1C)C(=O)CC2 62a_100010010902_200000210301 [1,0,0,1,0,0|1,1,0]=4 7763 B14R2.1416 CSc1cc2c(cc1C)C(=O)CC2 62a_200000210301_100010010902 [1,0,0,1,0,0|1,1,0]=4 7764 B14R2.1416 CSc1cc2c(cc1F)C(=O)CC2 62a_100010010804_200000210301 [1,0,0,1,0,0|1,1,0]=4 7765 B14R2.1416 CSc1cc2c(cc1F)C(=O)CC2 62a_200000210301_100010010804 [1,0,0,1,0,0|1,1,0]=4 7766 B14R2.1416 Cc1cc2c(cc1S[13CH3])CCC2=O 62a_100010010902_200025704644 [1,0,0,1,0,0|1,1,0]=4 7767 B14R2.1416 Cc1cc2c(cc1S[13CH3])CCC2=O 62a_200025704644_100010010902 [1,0,0,1,0,0|1,1,0]=4 7768 B14R2.1416 [13CH3]Sc1cc2c(cc1F)C(=O)CC2 62a_100010010804_200025704644 [1,0,0,1,0,0|1,1,0]=4 7769 B14R2.1416 [13CH3]Sc1cc2c(cc1F)C(=O)CC2 62a_200025704644_100010010804 [1,0,0,1,0,0|1,1,0]=4 7770 B14R2.3168 COc1cc(ccc1O)NC2CC2 34a_100000726020_100000211595 [1,0,0,1,0,0|1,0,1]=4 7771 B14R2.3822 CSc1c(ccc2c1C(=O)CC2)F 62a_200000210301_200010133456 [1,0,0,1,0,0|1,1,0]=4 7772 B14R2.3822 CSc1c(ccc2c1C(=O)CC2)F 62a_200010133456_200000210301 [1,0,0,1,0,0|1,1,0]=4 7773 B14R2.3822 CSc1c(ccc2c1C(=O)CC2)N 62a_100010218033_200000210301 [1,0,0,1,0,0|1,1,0]=4 7774 B14R2.3822 CSc1c(ccc2c1C(=O)CC2)N 62a_200000210301_100010218033 [1,0,0,1,0,0|1,1,0]=4 7775 B14R2.3822 [13CH3]Sc1c(ccc2c1C(=O)CC2)F 62a_200010133456_200025704644 [1,0,0,1,0,0|1,1,0]=4 7776 B14R2.3822 [13CH3]Sc1c(ccc2c1C(=O)CC2)F 62a_200025704644_200010133456 [1,0,0,1,0,0|1,1,0]=4 7777 B14R2.3822 [13CH3]Sc1c(ccc2c1C(=O)CC2)N 62a_100010218033_200025704644 [1,0,0,1,0,0|1,1,0]=4 7778 B14R2.3822 [13CH3]Sc1c(ccc2c1C(=O)CC2)N 62a_200025704644_100010218033 [1,0,0,1,0,0|1,1,0]=4 7779 B14R2.2332 C=Cc1ccc2c(c1)CCC(=O)C2 271570a_100011290941_100000753102 [1,0,0,1,0,0|1,0,1]=4 7780 B14R2.2332 CN1CCc2cc(ccc2C1)O[13CH3] 34a_200009882110_200025704644 [1,0,0,1,0,0|2,0,0]=4 7781 B14R2.2332 CNc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200000210301 [1,0,0,1,0,0|2,0,0]=4 7782 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200000210301 [1,0,0,1,0,0|0,0,0]=2 7783 B14R2.2332 COc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200000210301 [1,0,0,1,0,0|0,0,0]=2 7784 B14R2.2332 COc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200000210301 [1,0,0,1,0,0|1,0,0]=3 7785 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 2230a_100015189960_200000210301 [1,0,0,1,0,0|2,0,0]=4 7786 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 269982a_100015189960_200000210301 [1,0,0,1,0,0|2,0,0]=4 7787 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 34a_100015189960_200000210301 [1,0,0,1,0,0|2,0,0]=4 7788 B14R2.2332 COc1ccc2c(c1)CCN(C2)C 34a_200009882110_200000210301 [1,0,0,1,0,0|2,0,0]=4 7789 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 2230a_100015189960_200025704644 [1,0,0,1,0,0|2,0,0]=4 7790 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 269982a_100015189960_200025704644 [1,0,0,1,0,0|2,0,0]=4 7791 B14R2.2332 COc1ccc2c(c1)CCN(C2)[13CH3] 34a_100015189960_200025704644 [1,0,0,1,0,0|2,0,0]=4 7792 B14R2.2332 CSc1ccc2c(c1)CCC(=O)C2 62a_100000753102_200000210301 [1,0,0,1,0,0|0,1,0]=3 7793 B14R2.2332 CSc1ccc2c(c1)CCC(=O)C2 62a_200000210301_100000753102 [1,0,0,1,0,0|0,1,0]=3 7794 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200000210301 [1,0,0,1,0,0|1,1,0]=4 7795 B14R2.2332 CSc1ccc2c(c1)CCC(=O)N2 62a_200000210301_100000754843 [1,0,0,1,0,0|1,1,0]=4 7796 B14R2.2332 CSc1ccc2c(c1)CCC(=O)O2 62a_100010179853_200000210301 [1,0,0,1,0,0|1,1,0]=4 7797 B14R2.2332 CSc1ccc2c(c1)CCC(=O)O2 62a_200000210301_100010179853 [1,0,0,1,0,0|1,1,0]=4 7798 B14R2.2332 CSc1ccc2c(c1)CNC(=O)C2 62a_100010174877_200000210301 [1,0,0,1,0,0|1,1,0]=4 7799 B14R2.2332 [13CH3]Nc1ccc2c(c1)CCC(=O)N2 34a_100000738032_200025704644 [1,0,0,1,0,0|2,0,0]=4 7800 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 34a_100009852394_200025704644 [1,0,0,1,0,0|0,0,0]=2 7801 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)C2 7a_100009852394_200025704644 [1,0,0,1,0,0|0,0,0]=2 7802 B14R2.2332 [13CH3]Oc1ccc2c(c1)CCC(=O)N2 34a_100000735524_200025704644 [1,0,0,1,0,0|1,0,0]=3 7803 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)C2 62a_100000753102_200025704644 [1,0,0,1,0,0|0,1,0]=3 7804 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)C2 62a_200025704644_100000753102 [1,0,0,1,0,0|0,1,0]=3 7805 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_100000754843_200025704644 [1,0,0,1,0,0|1,1,0]=4 7806 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)N2 62a_200025704644_100000754843 [1,0,0,1,0,0|1,1,0]=4 7807 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)O2 62a_100010179853_200025704644 [1,0,0,1,0,0|1,1,0]=4 7808 B14R2.2332 [13CH3]Sc1ccc2c(c1)CCC(=O)O2 62a_200025704644_100010179853 [1,0,0,1,0,0|1,1,0]=4 7809 B14R2.2332 [13CH3]Sc1ccc2c(c1)CNC(=O)C2 62a_100010174877_200025704644 [1,0,0,1,0,0|1,1,0]=4 7810 B14R2.11684 C=Cc1cccc2c1CC(=O)CC2 271570a_100011290941_100010006498 [1,0,0,1,0,0|1,0,1]=4 7811 B14R2.11684 COc1cccc2c1CN(CC2)C 2230a_100011289678_200000210301 [1,0,0,1,0,0|2,0,0]=4 7812 B14R2.11684 COc1cccc2c1CN(CC2)C 269982a_100011289678_200000210301 [1,0,0,1,0,0|2,0,0]=4 7813 B14R2.11684 COc1cccc2c1CN(CC2)C 34a_100011289678_200000210301 [1,0,0,1,0,0|2,0,0]=4 7814 B14R2.11684 COc1cccc2c1CN(CC2)[13CH3] 2230a_100011289678_200025704644 [1,0,0,1,0,0|2,0,0]=4 7815 B14R2.11684 COc1cccc2c1CN(CC2)[13CH3] 269982a_100011289678_200025704644 [1,0,0,1,0,0|2,0,0]=4 7816 B14R2.11684 COc1cccc2c1CN(CC2)[13CH3] 34a_100011289678_200025704644 [1,0,0,1,0,0|2,0,0]=4 7817 B14R2.11684 COc1cccc2c1NC(=O)CC2 34a_100000082220_200000210301 [1,0,0,1,0,0|1,0,0]=3 7818 B14R2.11684 COc1cccc2c1NC(=O)CO2 7a_100000098422_200000210301 [1,0,0,1,0,0|2,0,0]=4 7819 B14R2.11684 CSc1cccc2c1CC(=O)CC2 62a_100010006498_200000210301 [1,0,0,1,0,0|0,1,0]=3 7820 B14R2.11684 [13CH3]Oc1cccc2c1NC(=O)CC2 34a_100000082220_200025704644 [1,0,0,1,0,0|1,0,0]=3 7821 B14R2.11684 [13CH3]Oc1cccc2c1NC(=O)CO2 7a_100000098422_200025704644 [1,0,0,1,0,0|2,0,0]=4 7822 B14R2.11684 [13CH3]Sc1cccc2c1CC(=O)CC2 62a_100010006498_200025704644 [1,0,0,1,0,0|0,1,0]=3 7823 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [0,0,0,1,1,0|1,0,1]=4 7824 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [0,0,0,1,1,0|1,0,0]=3 7825 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [0,0,0,1,1,0|0,0,0]=2 7826 B14R2.1008 CC(=O)Cc1ccc2ncoc2c1 1458a_100000070787_106359897996 [0,0,0,1,1,0|1,0,1]=4 7827 B14R2.1008 CC(=O)Cc1ccc2occc2c1 1458a_100000096804_200000210301 [0,0,0,1,1,0|1,0,1]=4 7828 B14R2.1008 CC(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200000210301 [0,0,0,1,1,0|1,0,1]=4 7829 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100015343762 [0,0,0,1,1,0|2,0,0]=4 7830 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100015343762 [0,0,0,1,1,0|2,0,0]=4 7831 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000070787 [0,0,0,1,1,0|2,0,0]=4 7832 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100103153847 [0,0,0,1,1,0|2,0,0]=4 7833 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [0,0,0,1,1,0|1,0,0]=3 7834 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [0,0,0,1,1,0|1,0,0]=3 7835 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [0,0,0,1,1,0|1,0,0]=3 7836 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [0,0,0,1,1,0|1,0,0]=3 7837 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [0,0,0,1,1,0|2,0,0]=4 7838 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [0,0,0,1,1,0|2,0,0]=4 7839 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [0,0,0,1,1,0|2,0,0]=4 7840 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [0,0,0,1,1,0|2,0,0]=4 7841 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [0,0,0,1,1,0|2,0,0]=4 7842 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [0,0,0,1,1,0|1,0,0]=3 7843 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [0,0,0,1,1,0|0,0,0]=2 7844 B14R2.1008 [13CH3]C(=O)Cc1ccc2occc2c1 1458a_100000096804_200025704644 [0,0,0,1,1,0|1,0,1]=4 7845 B14R2.1008 [13CH3]C(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200025704644 [0,0,0,1,1,0|1,0,1]=4 7846 B16R2.2324 CCc1cc(ccc1O)C2=CC(=O)CC2 271570a_100010737933_100012338938 [0,0,0,1,0,1|1,0,1]=4 7847 B16R2.2324 COc1cc(ccc1Br)C2=CC(=O)CC2 271570a_100010737933_100012353699 [0,0,0,1,0,1|1,0,1]=4 7848 B16R2.2324 COc1cc(ccc1C)C2=CC(=O)CC2 271570a_100010737933_100011830276 [0,0,0,1,0,1|1,0,1]=4 7849 B16R2.2324 COc1cc(ccc1Cl)C2=CC(=O)CC2 271570a_100010737933_100011356853 [0,0,0,1,0,1|1,0,1]=4 7850 B16R2.2324 COc1cc(ccc1F)C2=CC(=O)CC2 271570a_100010737933_100011934186 [0,0,0,1,0,1|1,0,1]=4 7851 B16R2.2324 COc1cc(ccc1N)C2=CC(=O)CC2 271570a_100010737933_100011279103 [0,0,0,1,0,1|1,0,1]=4 7852 B16R2.2324 COc1cc(ccc1O)C2=CC(=O)CC2 271570a_100010737933_100000694246 [0,0,0,1,0,1|0,0,1]=3 7853 B16R2.2324 COc1nc(ccc1O)C2=CC(=O)CC2 271570a_100010737933_100010893133 [0,0,0,1,0,1|1,0,1]=4 7854 B16R2.6908 CCc1cc(ccc1Br)SC2CC(=O)C2 62a_100009894365_100010244631 [0,0,0,1,0,1|2,0,0]=4 7855 B16R2.6908 CCc1cc(ccc1F)SC2CC(=O)C2 62a_100009894365_100010244625 [0,0,0,1,0,1|2,0,0]=4 7856 B16R2.6908 CCc1cc(ccc1N)SC2CC(=O)C2 62a_100009894365_100000686106 [0,0,0,1,0,1|2,0,0]=4 7857 B16R2.6908 CCc1cc(ccc1O)SC2CC(=O)C2 62a_100009894365_100012338938 [0,0,0,1,0,1|1,0,0]=3 7858 B16R2.6908 CNc1cc(ccc1C)SC2CC(=O)C2 62a_100009894365_100020629602 [0,0,0,1,0,1|2,0,0]=4 7859 B16R2.6908 CNc1cc(ccc1F)SC2CC(=O)C2 62a_100009894365_100011314990 [0,0,0,1,0,1|2,0,0]=4 7860 B16R2.6908 COc1cc(c[nH]c1=O)SC2CC(=O)C2 62a_100009894365_100010125397 [0,0,0,1,0,1|1,0,1]=4 7861 B16R2.6908 COc1cc(ccc1Br)SC2CC(=O)C2 62a_100009894365_100012353699 [0,0,0,1,0,1|1,0,0]=3 7862 B16R2.6908 COc1cc(ccc1C)SC2CC(=O)C2 62a_100009894365_100011830276 [0,0,0,1,0,1|1,0,0]=3 7863 B16R2.6908 COc1cc(ccc1Cl)SC2CC(=O)C2 62a_100009894365_100011356853 [0,0,0,1,0,1|1,0,0]=3 7864 B16R2.6908 COc1cc(ccc1F)SC2CC(=O)C2 62a_100009894365_100011934186 [0,0,0,1,0,1|1,0,0]=3 7865 B16R2.6908 COc1cc(ccc1N)SC2CC(=O)C2 62a_100009894365_100015196925 [0,0,0,1,0,1|1,0,0]=3 7866 B16R2.6908 COc1cc(ccc1O)SC2CC(=O)C2 62a_100009894365_100000694246 [0,0,0,1,0,1|0,0,0]=2 7867 B16R2.6908 COc1cc(cnc1C)SC2CC(=O)C2 62a_100009894365_100010254219 [0,0,0,1,0,1|2,0,0]=4 7868 B16R2.6908 COc1cc(cnc1F)SC2CC(=O)C2 62a_100009894365_100010214931 [0,0,0,1,0,1|2,0,0]=4 7869 B16R2.6908 COc1cc(cnc1N)SC2CC(=O)C2 62a_100009894365_106354213024 [0,0,0,1,0,1|2,0,0]=4 7870 B16R2.6908 COc1cc(ncc1C)SC2CC(=O)C2 62a_100009894365_100010067687 [0,0,0,1,0,1|2,0,0]=4 7871 B16R2.6908 COc1cc(ncc1F)SC2CC(=O)C2 62a_100009894365_200010136270 [0,0,0,1,0,1|2,0,0]=4 7872 B16R2.6908 COc1cc(ncc1N)SC2CC(=O)C2 62a_100009894365_100009887741 [0,0,0,1,0,1|2,0,0]=4 7873 B16R2.6908 COc1nc(ccc1N)SC2CC(=O)C2 62a_100009894365_100000687816 [0,0,0,1,0,1|2,0,0]=4 7874 B16R2.6908 COc1nc(ccc1O)SC2CC(=O)C2 62a_100009894365_100010893133 [0,0,0,1,0,1|1,0,0]=3 7875 B16R2.6908 COc1nc(cnc1O)SC2CC(=O)C2 62a_100009894365_200010365344 [0,0,0,1,0,1|2,0,0]=4 7876 B16R2.6908 CSc1cc(ccc1F)SC2CC(=O)C2 62a_100009894365_100010341305 [0,0,0,1,0,1|1,1,0]=4 7877 B16R2.6908 N#Cc1cc(ccc1O)SC2CC(=O)C2 62a_100009894365_100000687585 [0,0,0,1,0,1|2,0,0]=4 7878 B16R2.6908 NCc1cc(ccc1O)SC2CC(=O)C2 62a_100009894365_100000730032 [0,0,0,1,0,1|2,0,0]=4 7879 B16R2.6908 O=C1CC(C1)Sc2ccc(c(c2)CO)O 62a_100009894365_100000184703 [0,0,0,1,0,1|2,0,0]=4 7880 B16R2.6908 O=Cc1cc(ccc1O)SC2CC(=O)C2 62a_100009894365_100000186750 [0,0,0,1,0,1|2,0,0]=4 7881 B16R2.6912 COc1cc(ccc1O)CCNC2CC2 34a_100000756042_100000211595 [0,0,0,1,0,1|1,0,1]=4 7882 B16R2.6912 COc1cc(ccc1O)CNCC2CC2 34a_100000185554_100000742324 [0,0,0,1,0,1|1,0,1]=4 7883 B16R2.6912 COc1cc(ccc1O)CNCC2CO2 34a_100000185554_102125554688 [0,0,0,1,0,1|0,0,2]=4 7884 B16R2.6912 COc1cc(ccc1O)NCCC2CC2 34a_100000726020_100000694398 [0,0,0,1,0,1|1,0,1]=4 7885 B16R2.6912 COc1cc(ccc1O)NCCC2CO2 34a_100000726020_100000732470 [0,0,0,1,0,1|0,0,2]=4 7886 B16R2.6912 COc1cc(ccc1O)SCCC2CC2 62a_100000764125_100000694246 [0,0,0,1,0,1|1,0,1]=4 7887 B16R2.6912 COc1cc(ccc1O)SCCC2CO2 62a_100000732470_100000694246 [0,0,0,1,0,1|0,0,2]=4 7888 B16R2.27160 C=C(C)CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000730704 [0,0,0,1,0,1|2,0,0]=4 7889 B16R2.27160 C=C(C)CCNc1ccc2c(c1)CCO2 34a_100000736984_100000730704 [0,0,0,1,0,1|2,0,0]=4 7890 B16R2.27160 C=C(C)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000730704 [0,0,0,1,0,1|1,0,0]=3 7891 B16R2.27160 C=C(C)CCNc1ccc2c(c1)OCO2 34a_100000209953_100000730704 [0,0,0,1,0,1|1,0,0]=3 7892 B16R2.27160 C=C(C)CCOc1ccc2c(c1)OCO2 34a_100000210298_100000730704 [0,0,0,1,0,1|1,0,0]=3 7893 B16R2.27160 C=C(C)CCSc1ccc2c(c1)CCO2 62a_100000729065_100000730704 [0,0,0,1,0,1|2,0,0]=4 7894 B16R2.27160 C=C(C)CCSc1ccc2c(c1)CCO2 62a_100000730704_100000729065 [0,0,0,1,0,1|2,0,0]=4 7895 B16R2.27160 C=C(C)CCSc1ccc2c(c1)OCC2 62a_100000730704_100009818566 [0,0,0,1,0,1|2,0,0]=4 7896 B16R2.27160 C=C(C)CCSc1ccc2c(c1)OCC2 62a_100009818566_100000730704 [0,0,0,1,0,1|2,0,0]=4 7897 B16R2.27160 C=C(C)CNCc1ccc2c(c1)CCO2 2230a_100011219410_100000748629 [0,0,0,1,0,1|2,0,0]=4 7898 B16R2.27160 C=C(C)CNCc1ccc2c(c1)CCO2 34a_100011219410_100000748629 [0,0,0,1,0,1|2,0,0]=4 7899 B16R2.27160 C=C(C)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000748629 [0,0,0,1,0,1|1,0,0]=3 7900 B16R2.27160 C=C(C)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000748629 [0,0,0,1,0,1|1,0,0]=3 7901 B16R2.27160 C=C(C)COCc1ccc2c(c1)CCO2 34a_100011219353_100000748629 [0,0,0,1,0,1|2,0,0]=4 7902 B16R2.27160 C=C(C)COCc1ccc2c(c1)CCO2 7a_100011219353_100000748629 [0,0,0,1,0,1|2,0,0]=4 7903 B16R2.27160 C=C(C)COCc1ccc2c(c1)OCO2 34a_100000210245_100000189651 [0,0,0,1,0,1|1,0,0]=3 7904 B16R2.27160 C=C(C)COCc1ccc2c(c1)OCO2 34a_100000210967_100000748629 [0,0,0,1,0,1|1,0,0]=3 7905 B16R2.27160 C=C(F)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100009893438 [0,0,0,1,0,1|1,0,1]=4 7906 B16R2.27160 C=C(F)CNCc1ccc2c(c1)OCO2 34a_100000210006_100009893438 [0,0,0,1,0,1|1,0,1]=4 7907 B16R2.27160 C=C(F)COCc1ccc2c(c1)OCO2 34a_100000210967_100009893438 [0,0,0,1,0,1|1,0,1]=4 7908 B16R2.27160 C=C(F)COCc1ccc2c(c1)OCO2 34a_200010262243_100000189651 [0,0,0,1,0,1|1,0,1]=4 7909 B16R2.27160 CC(=CCNc1ccc2c(c1)OCO2)C 2230a_100000209953_100000761012 [0,0,0,1,0,1|1,0,1]=4 7910 B16R2.27160 CC(=CCNc1ccc2c(c1)OCO2)C 34a_100000209953_100000761012 [0,0,0,1,0,1|1,0,1]=4 7911 B16R2.27160 CC(=CCOc1ccc2c(c1)OCO2)C 34a_100000210298_100000761012 [0,0,0,1,0,1|1,0,1]=4 7912 B16R2.27160 CC(=O)CCOc1ccc2c(c1)CCC2 7a_100000209987_100000053229 [0,0,0,1,0,1|2,0,0]=4 7913 B16R2.27160 CC(=O)CCOc1ccc2ccoc2c1 7a_100000089557_100000053229 [0,0,0,1,0,1|1,0,1]=4 7914 B16R2.27160 CC(=O)CCOc1ccc2cnoc2c1 7a_100000098417_100000053229 [0,0,0,1,0,1|2,0,0]=4 7915 B16R2.27160 CC(=O)CCOc1ccc2occc2c1 7a_100000070125_100000053229 [0,0,0,1,0,1|1,0,1]=4 7916 B16R2.27160 CC(=O)CCSc1cc2c(cn1)OCC2 62a_100000053229_102495363667 [0,0,0,1,0,1|2,0,0]=4 7917 B16R2.27160 CC(=O)CCSc1cc2c(cn1)OCC2 62a_102495363667_100000053229 [0,0,0,1,0,1|2,0,0]=4 7918 B16R2.27160 CC(=O)CCSc1ccc2c(c1)CCC2 62a_100000053229_100000745594 [0,0,0,1,0,1|2,0,0]=4 7919 B16R2.27160 CC(=O)CCSc1ccc2c(c1)CCC2 62a_100000745594_100000053229 [0,0,0,1,0,1|2,0,0]=4 7920 B16R2.27160 CC(=O)CCSc1ccc2c(c1)CCN2 62a_100000053229_100000691068 [0,0,0,1,0,1|2,0,0]=4 7921 B16R2.27160 CC(=O)CCSc1ccc2c(c1)CCN2 62a_100000691068_100000053229 [0,0,0,1,0,1|2,0,0]=4 7922 B16R2.27160 CC(=O)CCSc1ccc2c(c1)CCO2 62a_100000053229_100000729065 [0,0,0,1,0,1|1,0,0]=3 7923 B16R2.27160 CC(=O)CCSc1ccc2c(c1)CCO2 62a_100000729065_100000053229 [0,0,0,1,0,1|1,0,0]=3 7924 B16R2.27160 CC(=O)CCSc1ccc2c(c1)NCC2 62a_100000053229_100000754641 [0,0,0,1,0,1|2,0,0]=4 7925 B16R2.27160 CC(=O)CCSc1ccc2c(c1)NCC2 62a_100000754641_100000053229 [0,0,0,1,0,1|2,0,0]=4 7926 B16R2.27160 CC(=O)CCSc1ccc2c(c1)OCC2 62a_100000053229_100009818566 [0,0,0,1,0,1|1,0,0]=3 7927 B16R2.27160 CC(=O)CCSc1ccc2c(c1)OCC2 62a_100009818566_100000053229 [0,0,0,1,0,1|1,0,0]=3 7928 B16R2.27160 CC(=O)CCSc1ccc2ccoc2c1 62a_100000053229_100000759542 [0,0,0,1,0,1|1,0,1]=4 7929 B16R2.27160 CC(=O)CCSc1ccc2cnoc2c1 62a_100000053229_100009817722 [0,0,0,1,0,1|2,0,0]=4 7930 B16R2.27160 CC(=O)CCSc1ccc2ncoc2c1 62a_100000053229_100009817590 [0,0,0,1,0,1|1,0,1]=4 7931 B16R2.27160 CC(=O)CCSc1ccc2occc2c1 62a_100000053229_100000691453 [0,0,0,1,0,1|1,0,1]=4 7932 B16R2.27160 CC(=O)CCSc1ccc2ocnc2c1 62a_100000053229_100009816175 [0,0,0,1,0,1|1,0,1]=4 7933 B16R2.27160 CC(=O)CCSc1ccc2oncc2c1 62a_100000053229_100009817723 [0,0,0,1,0,1|2,0,0]=4 7934 B16R2.27160 CC(=O)COCc1ccc2c(c1)OCO2 34a_100000211253_100000189651 [0,0,0,1,0,1|0,0,0]=2 7935 B16R2.27160 CC(=O)COCc1ccc2ncoc2c1 34a_100000211253_106359897996 [0,0,0,1,0,1|1,0,1]=4 7936 B16R2.27160 CC(=O)COCc1ccc2ocnc2c1 34a_100000211253_200010203175 [0,0,0,1,0,1|1,0,1]=4 7937 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 11a_100000204656_100015343762 [0,0,0,1,0,1|0,0,0]=2 7938 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 1626a_100000204656_100015343762 [0,0,0,1,0,1|0,0,0]=2 7939 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 240690a_100000204656_100015343762 [0,0,0,1,0,1|0,0,0]=2 7940 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 527a_100000204656_100103153847 [0,0,0,1,0,1|0,0,0]=2 7941 B16R2.27160 CC(=O)OCNc1ccc2c(c1)CCO2 34a_100000736984_100009813279 [0,0,0,1,0,1|2,0,0]=4 7942 B16R2.27160 CC(=O)OCNc1ccc2c(c1)OCO2 34a_100000209953_100009813279 [0,0,0,1,0,1|1,0,0]=3 7943 B16R2.27160 CC(=O)OCOc1ccc2c(c1)OCO2 34a_100000210298_100009813279 [0,0,0,1,0,1|1,0,0]=3 7944 B16R2.27160 CC(=O)OCSc1ccc2c(c1)CCO2 62a_100000076356_100000729065 [0,0,0,1,0,1|2,0,0]=4 7945 B16R2.27160 CC(=O)OCSc1ccc2c(c1)CCO2 62a_100000729065_100000076356 [0,0,0,1,0,1|2,0,0]=4 7946 B16R2.27160 CC(=O)OCSc1ccc2c(c1)OCC2 62a_100000076356_100009818566 [0,0,0,1,0,1|2,0,0]=4 7947 B16R2.27160 CC(=O)OCSc1ccc2c(c1)OCC2 62a_100009818566_100000076356 [0,0,0,1,0,1|2,0,0]=4 7948 B16R2.27160 CC(Br)COCc1ccc2c(c1)OCO2 34a_100012180447_100000189651 [0,0,0,1,0,1|1,0,1]=4 7949 B16R2.27160 CC(C)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210312 [0,0,0,1,0,1|1,0,1]=4 7950 B16R2.27160 CC(C)CCNc1ccc2c(c1)OCO2 34a_100000209953_100000210312 [0,0,0,1,0,1|1,0,1]=4 7951 B16R2.27160 CC(C)CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210312 [0,0,0,1,0,1|1,0,1]=4 7952 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210760 [0,0,0,1,0,1|1,0,1]=4 7953 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 270004a_100000210006_100000210432 [0,0,0,1,0,1|1,0,1]=4 7954 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000210624 [0,0,0,1,0,1|1,0,1]=4 7955 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 34a_100000210953_100000189651 [0,0,0,1,0,1|1,0,1]=4 7956 B16R2.27160 CC(C)COCc1ccc2c(c1)OCO2 34a_100000210257_100000189651 [0,0,0,1,0,1|1,0,1]=4 7957 B16R2.27160 CC(C)COCc1ccc2c(c1)OCO2 34a_100000210967_100000210624 [0,0,0,1,0,1|1,0,1]=4 7958 B16R2.27160 CC(C)NCCc1ccc2c(c1)OCO2 2230a_100000204656_100000210206 [0,0,0,1,0,1|1,0,1]=4 7959 B16R2.27160 CC(C)NCCc1ccc2c(c1)OCO2 34a_100000204656_100000210206 [0,0,0,1,0,1|1,0,1]=4 7960 B16R2.27160 CC(C)OCCc1ccc2c(c1)OCO2 34a_100011934097_100000210206 [0,0,0,1,0,1|1,0,1]=4 7961 B16R2.27160 CC(F)COCc1ccc2c(c1)OCO2 34a_100015925927_100000189651 [0,0,0,1,0,1|1,0,1]=4 7962 B16R2.27160 CC(O)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100012276601 [0,0,0,1,0,1|0,0,2]=4 7963 B16R2.27160 CC(O)CCNc1ccc2c(c1)OCO2 34a_100000209953_100012276601 [0,0,0,1,0,1|0,0,2]=4 7964 B16R2.27160 CC(O)CCOc1ccc2c(c1)OCO2 34a_100000210298_100012276601 [0,0,0,1,0,1|0,0,2]=4 7965 B16R2.27160 CC(O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100011218427 [0,0,0,1,0,1|0,0,2]=4 7966 B16R2.27160 CC(O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100011218427 [0,0,0,1,0,1|0,0,2]=4 7967 B16R2.27160 CC(O)CNCc1ccc2c(c1)OCO2 34a_100000210904_100000189651 [0,0,0,1,0,1|0,0,2]=4 7968 B16R2.27160 CC(O)COCc1ccc2c(c1)OCO2 34a_100000210967_100011218427 [0,0,0,1,0,1|0,0,2]=4 7969 B16R2.27160 C[C@@H](Cl)COCc1ccc2c(c1)OCO2 34a_100016084084_100000189651 [0,0,0,1,0,1|1,0,1]=4 7970 B16R2.27160 C[C@@H](N)COCc1ccc2c(c1)OCO2 34a_100000737577_100000189651 [0,0,0,1,0,1|1,0,1]=4 7971 B16R2.27160 C[C@@H](O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100009817552 [0,0,0,1,0,1|0,0,2]=4 7972 B16R2.27160 C[C@@H](O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100009817552 [0,0,0,1,0,1|0,0,2]=4 7973 B16R2.27160 C[C@@H](O)COCc1ccc2c(c1)OCO2 34a_100000210967_100009817552 [0,0,0,1,0,1|0,0,2]=4 7974 B16R2.27160 NC(=O)CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000744528 [0,0,0,1,0,1|2,0,0]=4 7975 B16R2.27160 NC(=O)CCNc1ccc2c(c1)CCO2 34a_100000736984_100000731001 [0,0,0,1,0,1|2,0,0]=4 7976 B16R2.27160 NC(=O)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000744528 [0,0,0,1,0,1|1,0,0]=3 7977 B16R2.27160 NC(=O)CCNc1ccc2c(c1)OCO2 34a_100000209953_100000731001 [0,0,0,1,0,1|1,0,0]=3 7978 B16R2.27160 NC(=O)CCOc1ccc2c(c1)OCO2 34a_100000210298_100000731001 [0,0,0,1,0,1|1,0,0]=3 7979 B16R2.27160 NC(=O)CCSc1ccc2c(c1)CCO2 62a_100000729065_100000744528 [0,0,0,1,0,1|2,0,0]=4 7980 B16R2.27160 NC(=O)CCSc1ccc2c(c1)CCO2 62a_100000744528_100000729065 [0,0,0,1,0,1|2,0,0]=4 7981 B16R2.27160 NC(=O)CCSc1ccc2c(c1)OCC2 62a_100000744528_100009818566 [0,0,0,1,0,1|2,0,0]=4 7982 B16R2.27160 NC(=O)CCSc1ccc2c(c1)OCC2 62a_100009818566_100000744528 [0,0,0,1,0,1|2,0,0]=4 7983 B16R2.27160 NC(=O)CNCc1ccc2c(c1)CCO2 2230a_100011219410_100000747473 [0,0,0,1,0,1|2,0,0]=4 7984 B16R2.27160 NC(=O)CNCc1ccc2c(c1)CCO2 34a_100011219410_100000187820 [0,0,0,1,0,1|2,0,0]=4 7985 B16R2.27160 NC(=O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000747473 [0,0,0,1,0,1|1,0,0]=3 7986 B16R2.27160 NC(=O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000187820 [0,0,0,1,0,1|1,0,0]=3 7987 B16R2.27160 NC(=O)COCc1ccc2c(c1)CCO2 34a_100011219353_100000187820 [0,0,0,1,0,1|2,0,0]=4 7988 B16R2.27160 NC(=O)COCc1ccc2c(c1)CCO2 7a_100011219353_100000187820 [0,0,0,1,0,1|2,0,0]=4 7989 B16R2.27160 NC(=O)COCc1ccc2c(c1)OCO2 34a_100000210967_100000187820 [0,0,0,1,0,1|1,0,0]=3 7990 B16R2.27160 O=C(O)CNCc1ccc2c(c1)OCO2 269956a_100016091260_100000189651 [0,0,0,1,0,1|1,0,0]=3 7991 B16R2.27160 O=C([O-])CNCc1ccc2c(c1)CCO2 34a_100011219410_100020667443 [0,0,0,1,0,1|2,0,0]=4 7992 B16R2.27160 O=C([O-])CNCc1ccc2c(c1)OCO2 34a_100000210006_100020667443 [0,0,0,1,0,1|1,0,0]=3 7993 B16R2.27160 O=C([O-])COCc1ccc2c(c1)CCO2 34a_100011219353_100020667443 [0,0,0,1,0,1|2,0,0]=4 7994 B16R2.27160 O=C([O-])COCc1ccc2c(c1)OCO2 34a_100000210967_100020667443 [0,0,0,1,0,1|1,0,0]=3 7995 B16R2.27160 O=[N+]([O-])CNCc1ccc2c(c1)OCO2 34a_100000210006_100000761209 [0,0,0,1,0,1|2,0,0]=4 7996 B16R2.27160 O=[N+]([O-])COCc1ccc2c(c1)OCO2 34a_100000210967_100000761209 [0,0,0,1,0,1|2,0,0]=4 7997 B16R2.38127 CC(=O)N1CCc2c1cc(c(c2)O[13CH3])Br 7a_100010742161_200025704644 [0,0,0,1,0,1|1,0,0]=3 7998 B16R2.38127 COc1cc2c(cc1Br)N(CC2)C(=O)C 7a_100010742161_200000210301 [0,0,0,1,0,1|1,0,0]=3 7999 B16R2.477 C=C(C)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000748629 [0,1,0,1,0,0|2,0,0]=4 8000 B16R2.477 C=C(C)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000748629 [0,1,0,1,0,0|2,0,0]=4 8001 B16R2.477 C=C(C)COc1ccc2c(c1)OCCO2 34a_100000234341_100000748629 [0,1,0,1,0,0|2,0,0]=4 8002 B16R2.477 C=C(C)CSc1ccc2c(c1)OCCO2 62a_100000748629_100011216881 [0,1,0,1,0,0|2,0,0]=4 8003 B16R2.477 C=C(C)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000211660 [0,1,0,1,0,0|2,0,0]=4 8004 B16R2.477 CC(=O)C=Cc1ccc2c(c1)OCCO2 1458a_100000179788_200000210301 [0,1,0,1,0,0|0,0,2]=4 8005 B16R2.477 CC(=O)CSc1ccc2c(c1)OCCO2 1458a_100000179515_200000210301 [0,1,0,1,0,0|1,0,0]=3 8006 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 11a_100000684186_100015343762 [0,1,0,1,0,0|1,0,0]=3 8007 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 1626a_100000684186_100015343762 [0,1,0,1,0,0|1,0,0]=3 8008 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 240690a_100000684186_100015343762 [0,1,0,1,0,0|1,0,0]=3 8009 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 527a_100000684186_100103153847 [0,1,0,1,0,0|1,0,0]=3 8010 B16R2.477 NC(=O)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000747473 [0,1,0,1,0,0|2,0,0]=4 8011 B16R2.477 NC(=O)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000187820 [0,1,0,1,0,0|2,0,0]=4 8012 B16R2.477 NC(=O)COc1ccc2c(c1)OCCO2 34a_100000234341_100000187820 [0,1,0,1,0,0|2,0,0]=4 8013 B16R2.477 NC(=O)CSc1ccc2c(c1)OCCO2 62a_100000747473_100011216881 [0,1,0,1,0,0|2,0,0]=4 8014 B16R2.477 NC(=O)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000747473 [0,1,0,1,0,0|2,0,0]=4 8015 B16R2.477 O=C([O-])CNc1ccc2c(c1)OCCO2 34a_100020630400_100020667443 [0,1,0,1,0,0|2,0,0]=4 8016 B16R2.477 O=C([O-])COc1ccc2c(c1)OCCO2 34a_100000234341_100020667443 [0,1,0,1,0,0|2,0,0]=4 8017 B16R2.477 O=C([O-])CSc1ccc2c(c1)OCCO2 62a_100011216881_100020667443 [0,1,0,1,0,0|2,0,0]=4 8018 B16R2.477 O=C([O-])CSc1ccc2c(c1)OCCO2 62a_100020667443_100011216881 [0,1,0,1,0,0|2,0,0]=4 8019 B16R2.477 [13CH3]C(=O)C=Cc1ccc2c(c1)OCCO2 1458a_100000179788_200025704644 [0,1,0,1,0,0|0,0,2]=4 8020 B16R2.477 [13CH3]C(=O)CSc1ccc2c(c1)OCCO2 1458a_100000179515_200025704644 [0,1,0,1,0,0|1,0,0]=3 8021 B16R2.3954 C=C(C)CNc1cc2c(cc1C)OCO2 2230a_100000066439_100000748629 [0,1,0,1,0,0|2,0,0]=4 8022 B16R2.3954 C=C(C)CNc1cc2c(cc1C)OCO2 34a_100000066439_100000748629 [0,1,0,1,0,0|2,0,0]=4 8023 B16R2.3954 C=C(C)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000748629 [0,1,0,1,0,0|2,0,0]=4 8024 B16R2.3954 C=C(C)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000748629 [0,1,0,1,0,0|2,0,0]=4 8025 B16R2.3954 C=C(C)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000748629 [0,1,0,1,0,0|2,0,0]=4 8026 B16R2.3954 C=C(C)COc1cc2c(cc1C)OCO2 34a_100000145572_100000748629 [0,1,0,1,0,0|2,0,0]=4 8027 B16R2.3954 C=C(C)COc1cc2c(cc1C)OCO2 7a_100000145572_100000748629 [0,1,0,1,0,0|2,0,0]=4 8028 B16R2.3954 C=C(C)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000211660 [0,1,0,1,0,0|2,0,0]=4 8029 B16R2.3954 CC(=O)C=Cc1cc2c(cc1Br)OCO2 1458a_100016995997_200000210301 [0,1,0,1,0,0|0,0,2]=4 8030 B16R2.3954 CC(=O)CCc1cc2c(cc1Br)OCO2 1458a_200009827803_200000210301 [0,1,0,1,0,0|0,0,0]=2 8031 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 11a_200011199097_100015343762 [0,1,0,1,0,0|1,0,0]=3 8032 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 1626a_200011199097_100015343762 [0,1,0,1,0,0|1,0,0]=3 8033 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 240690a_200011199097_100015343762 [0,1,0,1,0,0|1,0,0]=3 8034 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 527a_200011199097_100103153847 [0,1,0,1,0,0|1,0,0]=3 8035 B16R2.3954 Cc1cc2c(cc1NCC(=O)N)OCO2 2230a_100000066439_100000747473 [0,1,0,1,0,0|2,0,0]=4 8036 B16R2.3954 Cc1cc2c(cc1NCC(=O)N)OCO2 34a_100000066439_100000187820 [0,1,0,1,0,0|2,0,0]=4 8037 B16R2.3954 Cc1cc2c(cc1NCC(=O)[O-])OCO2 34a_100000066439_100020667443 [0,1,0,1,0,0|2,0,0]=4 8038 B16R2.3954 Cc1cc2c(cc1OCC(=O)N)OCO2 34a_100000145572_100000187820 [0,1,0,1,0,0|2,0,0]=4 8039 B16R2.3954 Cc1cc2c(cc1OCC(=O)N)OCO2 7a_100000145572_100000187820 [0,1,0,1,0,0|2,0,0]=4 8040 B16R2.3954 Cc1cc2c(cc1OCC(=O)[O-])OCO2 34a_100000145572_100020667443 [0,1,0,1,0,0|2,0,0]=4 8041 B16R2.3954 NC(=O)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000187820 [0,1,0,1,0,0|2,0,0]=4 8042 B16R2.3954 NC(=O)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000187820 [0,1,0,1,0,0|2,0,0]=4 8043 B16R2.3954 NC(=O)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000187820 [0,1,0,1,0,0|2,0,0]=4 8044 B16R2.3954 NC(=O)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000747473 [0,1,0,1,0,0|2,0,0]=4 8045 B16R2.3954 Nc1cc2c(cc1SCC(=O)[O-])OCO2 62a_100012557033_100020667443 [0,1,0,1,0,0|2,0,0]=4 8046 B16R2.3954 O=C([O-])CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100020667443 [0,1,0,1,0,0|2,0,0]=4 8047 B16R2.3954 O=C([O-])COc1cc2c(cc1Br)OCO2 34a_100010290809_100020667443 [0,1,0,1,0,0|2,0,0]=4 8048 B16R2.3954 [13CH3]C(=O)C=Cc1cc2c(cc1Br)OCO2 1458a_100016995997_200025704644 [0,1,0,1,0,0|0,0,2]=4 8049 B16R2.3954 [13CH3]C(=O)CCc1cc2c(cc1Br)OCO2 1458a_200009827803_200025704644 [0,1,0,1,0,0|0,0,0]=2 8050 B16R2.82843 CS(=O)(=O)NCc1ccc2c(c1)OCO2 40a_100000210006_100000738038 [0,1,0,1,0,0|2,0,0]=4 8051 B16R2.11587 C=C(C)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000748629 [0,1,0,1,0,0|1,0,1]=4 8052 B16R2.11587 CC(=O)CC(=O)c1ccc2c(c1)CCO2 1458a_100000070787_100000241338 [0,1,0,1,0,0|1,0,1]=4 8053 B16R2.11587 CC(=O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000070787_100000181162 [0,1,0,1,0,0|0,0,1]=3 8054 B16R2.11587 CC(=O)NC(C)c1ccc2c(c1)CCO2 11a_100159266031_100015343762 [0,1,0,1,0,0|2,0,0]=4 8055 B16R2.11587 CC(=O)NC(C)c1ccc2c(c1)CCO2 1626a_100159266031_100015343762 [0,1,0,1,0,0|2,0,0]=4 8056 B16R2.11587 CC(=O)NC(C)c1ccc2c(c1)CCO2 240690a_100159266031_100015343762 [0,1,0,1,0,0|2,0,0]=4 8057 B16R2.11587 CC(=O)NC(C)c1ccc2c(c1)CCO2 527a_100159266031_100103153847 [0,1,0,1,0,0|2,0,0]=4 8058 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 11a_100000744171_100015343762 [0,1,0,1,0,0|1,0,0]=3 8059 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 1626a_100000744171_100015343762 [0,1,0,1,0,0|1,0,0]=3 8060 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 240690a_100000744171_100015343762 [0,1,0,1,0,0|1,0,0]=3 8061 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 527a_100000744171_100103153847 [0,1,0,1,0,0|1,0,0]=3 8062 B16R2.11587 CC(C)C[C@H](N)c1ccc2c(c1)OCO2 271570a_100015190218_100000688060 [0,1,0,1,0,0|1,0,1]=4 8063 B16R2.11587 NC(=O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000187820 [0,1,0,1,0,0|1,0,1]=4 8064 B16R2.11587 O=C([O-])CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100020667443 [0,1,0,1,0,0|1,0,1]=4 8065 B16R2.6257 CC(=O)C(C)Cc1ccc2c(c1)OCO2 1458a_100000062412_200000210301 [0,1,0,1,0,0|0,0,0]=2 8066 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100009814033 [0,1,0,1,0,0|2,0,0]=4 8067 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009814033 [0,1,0,1,0,0|1,0,0]=3 8068 B16R2.6257 CC(=O)C(C)Oc1ccc2c(c1)OCO2 1458a_100000246018_200000210301 [0,1,0,1,0,0|1,0,0]=3 8069 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100009814033 [0,1,0,1,0,0|2,0,0]=4 8070 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)CCO2 62a_100009814033_100000729065 [0,1,0,1,0,0|2,0,0]=4 8071 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)OCC2 62a_100009814033_100009818566 [0,1,0,1,0,0|2,0,0]=4 8072 B16R2.6257 CC(=O)C(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100009814033 [0,1,0,1,0,0|2,0,0]=4 8073 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 11a_100000186720_100015343762 [0,1,0,1,0,0|1,0,0]=3 8074 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 240690a_100000186720_100015343762 [0,1,0,1,0,0|1,0,0]=3 8075 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 527a_100000186720_100103153847 [0,1,0,1,0,0|1,0,0]=3 8076 B16R2.6257 CC(Cc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000062412_200025704644 [0,1,0,1,0,0|0,0,0]=2 8077 B16R2.6257 CC(Nc1ccc2c(c1)OCO2)C(=O)N 2230a_100000209953_100000702099 [0,1,0,1,0,0|2,0,0]=4 8078 B16R2.6257 CC(Nc1ccc2c(c1)OCO2)C(=O)N 34a_100000209953_100000702099 [0,1,0,1,0,0|2,0,0]=4 8079 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)N 34a_100000210298_100000702099 [0,1,0,1,0,0|2,0,0]=4 8080 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000246018_200025704644 [0,1,0,1,0,0|1,0,0]=3 8081 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009813875 [0,1,0,1,0,0|2,0,0]=4 8082 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)OCO2 34a_100000209953_100009813875 [0,1,0,1,0,0|2,0,0]=4 8083 B16R2.6257 NC(=O)C(F)Oc1ccc2c(c1)OCO2 34a_100000210298_100009813875 [0,1,0,1,0,0|2,0,0]=4 8084 B16R2.6257 O=C([O-])C(F)Nc1ccc2c(c1)OCO2 34a_100000209953_100020610796 [0,1,0,1,0,0|2,0,0]=4 8085 B16R2.6257 O=C([O-])C(F)Oc1ccc2c(c1)OCO2 34a_100000210298_100020610796 [0,1,0,1,0,0|2,0,0]=4 8086 B16R2.6906 CCc1cc(ccc1O)SC2CCC2=O 62a_100009892977_100012338938 [0,1,0,1,0,0|2,0,0]=4 8087 B16R2.6906 COc1cc(ccc1Br)NC2CCC2=O 34a_100000765947_100009892977 [0,1,0,1,0,0|2,0,0]=4 8088 B16R2.6906 COc1cc(ccc1Br)OC2CCC2=O 34a_100011827694_100009892977 [0,1,0,1,0,0|2,0,0]=4 8089 B16R2.6906 COc1cc(ccc1Br)OC2CCC2=O 7a_100011827694_100009892977 [0,1,0,1,0,0|2,0,0]=4 8090 B16R2.6906 COc1cc(ccc1Br)SC2CCC2=O 62a_100009892977_100012353699 [0,1,0,1,0,0|2,0,0]=4 8091 B16R2.6906 COc1cc(ccc1Br)SC2CCC2=O 62a_100012353699_100009892977 [0,1,0,1,0,0|2,0,0]=4 8092 B16R2.6906 COc1cc(ccc1C)NC2CCC2=O 34a_100011279678_100009892977 [0,1,0,1,0,0|2,0,0]=4 8093 B16R2.6906 COc1cc(ccc1C)OC2CCC2=O 34a_100009865632_100009892977 [0,1,0,1,0,0|2,0,0]=4 8094 B16R2.6906 COc1cc(ccc1C)OC2CCC2=O 7a_100009865632_100009892977 [0,1,0,1,0,0|2,0,0]=4 8095 B16R2.6906 COc1cc(ccc1C)SC2CCC2=O 62a_100009892977_100011830276 [0,1,0,1,0,0|2,0,0]=4 8096 B16R2.6906 COc1cc(ccc1C)SC2CCC2=O 62a_100011830276_100009892977 [0,1,0,1,0,0|2,0,0]=4 8097 B16R2.6906 COc1cc(ccc1Cl)NC2CCC2=O 34a_100000742311_100009892977 [0,1,0,1,0,0|2,0,0]=4 8098 B16R2.6906 COc1cc(ccc1Cl)OC2CCC2=O 34a_100012186310_100009892977 [0,1,0,1,0,0|2,0,0]=4 8099 B16R2.6906 COc1cc(ccc1Cl)OC2CCC2=O 7a_100012186310_100009892977 [0,1,0,1,0,0|2,0,0]=4 8100 B16R2.6906 COc1cc(ccc1Cl)SC2CCC2=O 62a_100009892977_100011356853 [0,1,0,1,0,0|2,0,0]=4 8101 B16R2.6906 COc1cc(ccc1Cl)SC2CCC2=O 62a_100011356853_100009892977 [0,1,0,1,0,0|2,0,0]=4 8102 B16R2.6906 COc1cc(ccc1F)NC2CCC2=O 34a_100000701188_100009892977 [0,1,0,1,0,0|2,0,0]=4 8103 B16R2.6906 COc1cc(ccc1F)OC2CCC2=O 34a_100012001760_100009892977 [0,1,0,1,0,0|2,0,0]=4 8104 B16R2.6906 COc1cc(ccc1F)OC2CCC2=O 7a_100012001760_100009892977 [0,1,0,1,0,0|2,0,0]=4 8105 B16R2.6906 COc1cc(ccc1F)SC2CCC2=O 62a_100009892977_100011934186 [0,1,0,1,0,0|2,0,0]=4 8106 B16R2.6906 COc1cc(ccc1F)SC2CCC2=O 62a_100011934186_100009892977 [0,1,0,1,0,0|2,0,0]=4 8107 B16R2.6906 COc1cc(ccc1I)NC2CCC2=O 34a_100000746945_100009892977 [0,1,0,1,0,0|2,0,0]=4 8108 B16R2.6906 COc1cc(ccc1N)OC2CCC2=O 34a_100015326901_100009892977 [0,1,0,1,0,0|2,0,0]=4 8109 B16R2.6906 COc1cc(ccc1N)OC2CCC2=O 7a_100015326901_100009892977 [0,1,0,1,0,0|2,0,0]=4 8110 B16R2.6906 COc1cc(ccc1N)SC2CCC2=O 62a_100009892977_100015196925 [0,1,0,1,0,0|2,0,0]=4 8111 B16R2.6906 COc1cc(ccc1N)SC2CCC2=O 62a_100011279103_100009892977 [0,1,0,1,0,0|2,0,0]=4 8112 B16R2.6906 COc1cc(ccc1O)NC2CCC2=O 34a_100000726020_100009892977 [0,1,0,1,0,0|1,0,0]=3 8113 B16R2.6906 COc1cc(ccc1O)SC2CCC2=O 62a_100009892977_100000694246 [0,1,0,1,0,0|1,0,0]=3 8114 B16R2.6906 COc1nc(ccc1O)SC2CCC2=O 62a_100009892977_100010893133 [0,1,0,1,0,0|2,0,0]=4 8115 B16R2.1357 C#CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000211873_100000763274 [0,1,0,1,0,0|1,0,1]=4 8116 B16R2.1357 C=CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000185746_100000763274 [0,1,0,1,0,0|1,0,1]=4 8117 B16R2.1357 C=CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100000185746 [0,1,0,1,0,0|1,0,1]=4 8118 B16R2.1357 C=CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_200121576911 [0,1,0,1,0,0|1,0,1]=4 8119 B16R2.1357 CC(CCc1ccc2c(c1)OCO2)O[13CH3] 34a_100000744918_200025704644 [0,1,0,1,0,0|0,0,2]=4 8120 B16R2.1357 CC(CCc1ccc2c(c1)OCO2)O[13CH3] 7a_100000744918_200025704644 [0,1,0,1,0,0|0,0,2]=4 8121 B16R2.1357 CCC(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_100000210202 [0,1,0,1,0,0|0,0,2]=4 8122 B16R2.1357 CCC(=O)CCc1ccc2c(c1)CCO2 1458a_100000210414_100000763274 [0,1,0,1,0,0|1,0,0]=3 8123 B16R2.1357 CCC(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_100000210202 [0,1,0,1,0,0|1,0,0]=3 8124 B16R2.1357 CCC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_100000210202 [0,1,0,1,0,0|0,0,0]=2 8125 B16R2.1357 CCC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_100000210202 [0,1,0,1,0,0|1,0,0]=3 8126 B16R2.1357 CCC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000747405 [0,1,0,1,0,0|2,0,0]=4 8127 B16R2.1357 CCC(=O)CSc1ccc2c(c1)CCO2 62a_100000747405_100000729065 [0,1,0,1,0,0|2,0,0]=4 8128 B16R2.1357 CCC(=O)CSc1ccc2c(c1)OCC2 62a_100000747405_100009818566 [0,1,0,1,0,0|2,0,0]=4 8129 B16R2.1357 CCC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747405 [0,1,0,1,0,0|2,0,0]=4 8130 B16R2.1357 CCC(=O)NCc1ccc2c(c1)CCO2 11a_100011219410_100000210414 [0,1,0,1,0,0|2,0,0]=4 8131 B16R2.1357 CCC(=O)NCc1ccc2c(c1)CCO2 1626a_100011219410_100000210414 [0,1,0,1,0,0|2,0,0]=4 8132 B16R2.1357 CCC(=O)NCc1ccc2c(c1)CCO2 240690a_100011219410_100000210414 [0,1,0,1,0,0|2,0,0]=4 8133 B16R2.1357 CCC(=O)NCc1ccc2c(c1)CCO2 527a_100011219410_100000210414 [0,1,0,1,0,0|2,0,0]=4 8134 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100000210414 [0,1,0,1,0,0|1,0,0]=3 8135 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100000210414 [0,1,0,1,0,0|1,0,0]=3 8136 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100000210414 [0,1,0,1,0,0|1,0,0]=3 8137 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100000210414 [0,1,0,1,0,0|1,0,0]=3 8138 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)OCO2 11a_106832991635_100000182195 [0,1,0,1,0,0|0,0,2]=4 8139 B16R2.1357 CNC(=O)C=Cc1ccc2c(c1)OCO2 1626a_100102657272_100000182195 [0,1,0,1,0,0|0,0,2]=4 8140 B16R2.1357 CNC(=O)CCc1ccc2c(c1)CCO2 11a_106832991635_100000686558 [0,1,0,1,0,0|1,0,0]=3 8141 B16R2.1357 CNC(=O)CCc1ccc2c(c1)CCO2 1626a_100102657272_100000686558 [0,1,0,1,0,0|1,0,0]=3 8142 B16R2.1357 CNC(=O)CCc1ccc2c(c1)CCO2 240690a_100102657272_100000686558 [0,1,0,1,0,0|1,0,0]=3 8143 B16R2.1357 CNC(=O)CCc1ccc2c(c1)CCO2 527a_100102657272_100000686558 [0,1,0,1,0,0|1,0,0]=3 8144 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 11a_106832991635_100000235677 [0,1,0,1,0,0|0,0,0]=2 8145 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 1626a_100102657272_100000235677 [0,1,0,1,0,0|0,0,0]=2 8146 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 240690a_100102657272_100000235677 [0,1,0,1,0,0|0,0,0]=2 8147 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 527a_100102657272_100000235677 [0,1,0,1,0,0|0,0,0]=2 8148 B16R2.1357 CNC(=O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000183359 [0,1,0,1,0,0|2,0,0]=4 8149 B16R2.1357 CNC(=O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000183359 [0,1,0,1,0,0|2,0,0]=4 8150 B16R2.1357 CNC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000183359 [0,1,0,1,0,0|1,0,0]=3 8151 B16R2.1357 CNC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000183359 [0,1,0,1,0,0|1,0,0]=3 8152 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 11a_106832991635_100000246017 [0,1,0,1,0,0|1,0,0]=3 8153 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 1626a_100102657272_100000246017 [0,1,0,1,0,0|1,0,0]=3 8154 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 240690a_100102657272_100000246017 [0,1,0,1,0,0|1,0,0]=3 8155 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000183359 [0,1,0,1,0,0|1,0,0]=3 8156 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 527a_100102657272_100000246017 [0,1,0,1,0,0|1,0,0]=3 8157 B16R2.1357 CNC(=O)CSc1ccc2c(c1)CCO2 62a_100000183359_100000729065 [0,1,0,1,0,0|2,0,0]=4 8158 B16R2.1357 CNC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000183359 [0,1,0,1,0,0|2,0,0]=4 8159 B16R2.1357 CNC(=O)CSc1ccc2c(c1)OCC2 62a_100000183359_100009818566 [0,1,0,1,0,0|2,0,0]=4 8160 B16R2.1357 CNC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000183359 [0,1,0,1,0,0|2,0,0]=4 8161 B16R2.1357 CNC(=O)NCc1ccc2c(c1)CCO2 2708a_100011219410_106832991635 [0,1,0,1,0,0|2,0,0]=4 8162 B16R2.1357 CNC(=O)NCc1ccc2c(c1)CCO2 2708a_100102657272_100011219410 [0,1,0,1,0,0|2,0,0]=4 8163 B16R2.1357 CNC(=O)NCc1ccc2c(c1)CCO2 273464a_100011219410_100102657272 [0,1,0,1,0,0|2,0,0]=4 8164 B16R2.1357 CNC(=O)NCc1ccc2c(c1)CCO2 273464a_100102657272_100011219410 [0,1,0,1,0,0|2,0,0]=4 8165 B16R2.1357 CNC(=O)NCc1ccc2c(c1)CCO2 512a_100011219410_100102657272 [0,1,0,1,0,0|2,0,0]=4 8166 B16R2.1357 CNC(=O)NCc1ccc2c(c1)CCO2 512a_106832991638_100011219410 [0,1,0,1,0,0|2,0,0]=4 8167 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 2708a_100000210006_106832991635 [0,1,0,1,0,0|1,0,0]=3 8168 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 2708a_100102657272_100000210006 [0,1,0,1,0,0|1,0,0]=3 8169 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 273464a_100000210006_100102657272 [0,1,0,1,0,0|1,0,0]=3 8170 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 273464a_100102657272_100000210006 [0,1,0,1,0,0|1,0,0]=3 8171 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 512a_106832991638_100000210006 [0,1,0,1,0,0|1,0,0]=3 8172 B16R2.1357 CNC(C)CCc1ccc2c(c1)OCO2 270004a_106832991635_100000182259 [0,1,0,1,0,0|1,0,1]=4 8173 B16R2.1357 COC(=O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000747449 [0,1,0,1,0,0|2,0,0]=4 8174 B16R2.1357 COC(=O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000747449 [0,1,0,1,0,0|2,0,0]=4 8175 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747449 [0,1,0,1,0,0|1,0,0]=3 8176 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000747449 [0,1,0,1,0,0|1,0,0]=3 8177 B16R2.1357 COC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000747449 [0,1,0,1,0,0|1,0,0]=3 8178 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000747449 [0,1,0,1,0,0|2,0,0]=4 8179 B16R2.1357 COC(=O)CSc1ccc2c(c1)CCO2 62a_100000747449_100000729065 [0,1,0,1,0,0|2,0,0]=4 8180 B16R2.1357 COC(=O)CSc1ccc2c(c1)OCC2 62a_100000747449_100009818566 [0,1,0,1,0,0|2,0,0]=4 8181 B16R2.1357 COC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747449 [0,1,0,1,0,0|2,0,0]=4 8182 B16R2.1357 COC(C)CCc1ccc2c(c1)OCO2 34a_100000744918_200000210301 [0,1,0,1,0,0|0,0,2]=4 8183 B16R2.1357 COC(C)CCc1ccc2c(c1)OCO2 7a_100000744918_200000210301 [0,1,0,1,0,0|0,0,2]=4 8184 B16R2.1357 O=C(C=Cc1ccc2c(c1)OCO2)CF 1458a_100000182195_100015361967 [0,1,0,1,0,0|0,0,2]=4 8185 B16R2.1357 O=C(CF)CCc1ccc2c(c1)CCO2 1458a_100000686558_100015361967 [0,1,0,1,0,0|1,0,0]=3 8186 B16R2.1357 O=C(CF)CCc1ccc2c(c1)OCO2 1458a_100000235677_100015361967 [0,1,0,1,0,0|0,0,0]=2 8187 B16R2.1357 O=C(CF)COc1ccc2c(c1)OCO2 1458a_100000246017_100015361967 [0,1,0,1,0,0|1,0,0]=3 8188 B16R2.1357 O=C(CO)CCc1ccc2c(c1)CCO2 1458a_100000210174_100000763274 [0,1,0,1,0,0|1,0,0]=3 8189 B16R2.1357 O=C(CO)NCc1ccc2c(c1)CCO2 240690a_100011219410_100000210174 [0,1,0,1,0,0|2,0,0]=4 8190 B16R2.1357 O=C(CO)NCc1ccc2c(c1)CCO2 527a_100011219410_100000210174 [0,1,0,1,0,0|2,0,0]=4 8191 B16R2.1357 O=C(CO)NCc1ccc2c(c1)OCO2 240690a_100000210006_100000210174 [0,1,0,1,0,0|1,0,0]=3 8192 B16R2.1357 O=C(CO)NCc1ccc2c(c1)OCO2 527a_100000210006_100000210174 [0,1,0,1,0,0|1,0,0]=3 8193 B16R2.54916 COc1cc(ccc1O)CCN2CCC2 269982a_100000754969_100010741665 [0,1,0,1,0,0|2,0,0]=4 8194 B16R2.83537 C=C(C)CSc1ccc2c(c1C)OCO2 62a_100010335860_100000211660 [0,1,0,1,0,0|2,0,0]=4 8195 B16R2.83537 C=C(C)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000211660 [0,1,0,1,0,0|2,0,0]=4 8196 B16R2.83537 Cc1c(ccc2c1OCO2)SCC(=O)N 62a_100010335860_100000747473 [0,1,0,1,0,0|2,0,0]=4 8197 B16R2.83537 Cc1c(ccc2c1OCO2)SCC(=O)[O-] 62a_100010335860_100020667443 [0,1,0,1,0,0|2,0,0]=4 8198 B16R2.83537 NC(=O)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000747473 [0,1,0,1,0,0|2,0,0]=4 8199 B16R2.83537 O=C([O-])CSc1ccc2c(c1F)OCO2 62a_100010223184_100020667443 [0,1,0,1,0,0|2,0,0]=4 8200 B16R2.1461 COc1cc2c(cc1OC)CN(CC2)C 2230a_100000185277_200000210301 [0,1,0,1,0,0|2,0,0]=4 8201 B16R2.1461 COc1cc2c(cc1OC)CN(CC2)C 269982a_100000185277_200000210301 [0,1,0,1,0,0|2,0,0]=4 8202 B16R2.1461 COc1cc2c(cc1OC)CN(CC2)C 34a_100000185277_200000210301 [0,1,0,1,0,0|2,0,0]=4 8203 B16R2.1461 COc1cc2c(cc1OC)CN(CC2)[13CH3] 2230a_100000185277_200025704644 [0,1,0,1,0,0|2,0,0]=4 8204 B16R2.1461 COc1cc2c(cc1OC)CN(CC2)[13CH3] 269982a_100000185277_200025704644 [0,1,0,1,0,0|2,0,0]=4 8205 B16R2.1461 COc1cc2c(cc1OC)CN(CC2)[13CH3] 34a_100000185277_200025704644 [0,1,0,1,0,0|2,0,0]=4 8206 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [1,0,0,0,1,0|1,0,1]=4 8207 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,0,0,0,1,0|1,0,1]=4 8208 B12R1.19 CC(=O)Cc1cc(=O)c(co1)O 1458a_100000070787_100000010605 [1,0,0,0,1,0|1,0,1]=4 8209 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000070787_100012353900 [1,0,0,0,1,0|2,0,0]=4 8210 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000070787_100012232412 [1,0,0,0,1,0|2,0,0]=4 8211 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_200000210301 [1,0,0,0,1,0|2,0,0]=4 8212 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000070787_100012353894 [1,0,0,0,1,0|2,0,0]=4 8213 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200000210301 [1,0,0,0,1,0|2,0,0]=4 8214 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000070787_100011206884 [1,0,0,0,1,0|2,0,0]=4 8215 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200000210301 [1,0,0,0,1,0|2,0,0]=4 8216 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,0,0,0,1,0|1,0,0]=3 8217 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [1,0,0,0,1,0|1,0,0]=3 8218 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [1,0,0,0,1,0|1,0,0]=3 8219 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [1,0,0,0,1,0|1,0,0]=3 8220 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [1,0,0,0,1,0|1,0,0]=3 8221 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [1,0,0,0,1,0|1,0,0]=3 8222 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [1,0,0,0,1,0|1,0,0]=3 8223 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [1,0,0,0,1,0|1,0,0]=3 8224 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,0,0,0,1,0|0,0,0]=2 8225 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000070787_100012353895 [1,0,0,0,1,0|2,0,0]=4 8226 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200000210301 [1,0,0,0,1,0|2,0,0]=4 8227 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000070787_100011823929 [1,0,0,0,1,0|2,0,0]=4 8228 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000070787_100000184707 [1,0,0,0,1,0|2,0,0]=4 8229 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200000210301 [1,0,0,0,1,0|2,0,0]=4 8230 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000070787_100000717365 [1,0,0,0,1,0|2,0,0]=4 8231 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200000210301 [1,0,0,0,1,0|2,0,0]=4 8232 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000070787_100012349665 [1,0,0,0,1,0|2,0,0]=4 8233 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,0,0,0,1,0|1,0,0]=3 8234 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000070787_100000767054 [1,0,0,0,1,0|2,0,0]=4 8235 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200000210301 [1,0,0,0,1,0|2,0,0]=4 8236 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100000070787_100011217369 [1,0,0,0,1,0|2,0,0]=4 8237 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_200000210301 [1,0,0,0,1,0|2,0,0]=4 8238 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000070787_100000716492 [1,0,0,0,1,0|2,0,0]=4 8239 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200000210301 [1,0,0,0,1,0|2,0,0]=4 8240 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000070787_100000757363 [1,0,0,0,1,0|2,0,0]=4 8241 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200000210301 [1,0,0,0,1,0|2,0,0]=4 8242 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100000070787_100010149604 [1,0,0,0,1,0|2,0,0]=4 8243 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200000210301 [1,0,0,0,1,0|2,0,0]=4 8244 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,0,0,0,1,0|1,0,0]=3 8245 B12R1.19 CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000070787_100010146616 [1,0,0,0,1,0|2,0,0]=4 8246 B12R1.19 CC(=O)Cc1ccc(c(c1)I)C 1458a_100000070787_100010206137 [1,0,0,0,1,0|2,0,0]=4 8247 B12R1.19 CC(=O)Cc1ccc(c(c1)I)F 1458a_100000070787_100010188208 [1,0,0,0,1,0|2,0,0]=4 8248 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,0,0,0,1,0|1,0,0]=3 8249 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,0,0,0,1,0|0,0,0]=2 8250 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,0,0,0,1,0|0,0,0]=2 8251 B12R1.19 CC(=O)Nc1cc(c(cn1)O)C 271570a_203496583355_100011934553 [1,0,0,0,1,0|2,0,0]=4 8252 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [1,0,0,0,1,0|2,0,0]=4 8253 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [1,0,0,0,1,0|2,0,0]=4 8254 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [1,0,0,0,1,0|2,0,0]=4 8255 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [1,0,0,0,1,0|2,0,0]=4 8256 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [1,0,0,0,1,0|2,0,0]=4 8257 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [1,0,0,0,1,0|2,0,0]=4 8258 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [1,0,0,0,1,0|2,0,0]=4 8259 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [1,0,0,0,1,0|2,0,0]=4 8260 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [1,0,0,0,1,0|2,0,0]=4 8261 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [1,0,0,0,1,0|2,0,0]=4 8262 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [1,0,0,0,1,0|2,0,0]=4 8263 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [1,0,0,0,1,0|2,0,0]=4 8264 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [1,0,0,0,1,0|2,0,0]=4 8265 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [1,0,0,0,1,0|2,0,0]=4 8266 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [1,0,0,0,1,0|2,0,0]=4 8267 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [1,0,0,0,1,0|2,0,0]=4 8268 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [1,0,0,0,1,0|2,0,0]=4 8269 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [1,0,0,0,1,0|2,0,0]=4 8270 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [1,0,0,0,1,0|2,0,0]=4 8271 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [1,0,0,0,1,0|2,0,0]=4 8272 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [1,0,0,0,1,0|2,0,0]=4 8273 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [1,0,0,0,1,0|2,0,0]=4 8274 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [1,0,0,0,1,0|1,0,0]=3 8275 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [1,0,0,0,1,0|1,0,0]=3 8276 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [1,0,0,0,1,0|1,0,0]=3 8277 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [1,0,0,0,1,0|1,0,0]=3 8278 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [1,0,0,0,1,0|2,0,0]=4 8279 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [1,0,0,0,1,0|2,0,0]=4 8280 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [1,0,0,0,1,0|2,0,0]=4 8281 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [1,0,0,0,1,0|2,0,0]=4 8282 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [1,0,0,0,1,0|2,0,0]=4 8283 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [1,0,0,0,1,0|2,0,0]=4 8284 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [1,0,0,0,1,0|2,0,0]=4 8285 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [1,0,0,0,1,0|2,0,0]=4 8286 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [1,0,0,0,1,0|2,0,0]=4 8287 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [1,0,0,0,1,0|2,0,0]=4 8288 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [1,0,0,0,1,0|2,0,0]=4 8289 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [1,0,0,0,1,0|2,0,0]=4 8290 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,0,0,0,1,0|1,0,0]=3 8291 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,0,0,0,1,0|1,0,0]=3 8292 B12R1.19 CC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187074 [1,0,0,0,1,0|2,0,0]=4 8293 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [1,0,0,0,1,0|2,0,0]=4 8294 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [1,0,0,0,1,0|1,0,0]=3 8295 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [1,0,0,0,1,0|1,0,0]=3 8296 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,0,0,0,1,0|0,0,0]=2 8297 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [1,0,0,0,1,0|2,0,0]=4 8298 B12R1.19 Cc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100000709925_200025704644 [1,0,0,0,1,0|2,0,0]=4 8299 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [1,0,0,0,1,0|1,0,0]=3 8300 B12R1.19 Cc1ccc(cc1F)CC(=O)[13CH3] 1458a_100011217375_200025704644 [1,0,0,0,1,0|2,0,0]=4 8301 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,0,0,0,1,0|1,0,0]=3 8302 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200025704644 [1,0,0,0,1,0|2,0,0]=4 8303 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200025704644 [1,0,0,0,1,0|2,0,0]=4 8304 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,0,0,0,1,0|1,0,0]=3 8305 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200025704644 [1,0,0,0,1,0|2,0,0]=4 8306 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200025704644 [1,0,0,0,1,0|2,0,0]=4 8307 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200025704644 [1,0,0,0,1,0|2,0,0]=4 8308 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,0,0,0,1,0|1,0,0]=3 8309 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200025704644 [1,0,0,0,1,0|2,0,0]=4 8310 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200025704644 [1,0,0,0,1,0|2,0,0]=4 8311 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200025704644 [1,0,0,0,1,0|2,0,0]=4 8312 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200025704644 [1,0,0,0,1,0|2,0,0]=4 8313 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,0,0,0,1,0|1,0,0]=3 8314 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,0,0,0,1,0|0,0,0]=2 8315 B12R1.59 COc1cc(on1)CCC(=O)C 1458a_100000081952_200000210301 [1,0,0,0,1,0|2,0,0]=4 8316 B12R1.59 COc1cc(on1)CCC(=O)[13CH3] 1458a_100000081952_200025704644 [1,0,0,0,1,0|2,0,0]=4 8317 B12R1.438 C=Cc1cccc(c1)CC(=O)C 271570a_100011290941_100000689217 [1,0,0,0,1,0|1,0,1]=4 8318 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000070787_100000233786 [1,0,0,0,1,0|2,0,0]=4 8319 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000684415_200000210301 [1,0,0,0,1,0|2,0,0]=4 8320 B12R1.438 CC(=O)Cc1cccc(c1)C=O 1458a_100000070787_100009816774 [1,0,0,0,1,0|2,0,0]=4 8321 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [1,0,0,0,1,0|2,0,0]=4 8322 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [1,0,0,0,1,0|0,1,0]=3 8323 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [1,0,0,0,1,0|0,1,0]=3 8324 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [1,0,0,0,1,0|2,0,0]=4 8325 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [1,0,0,0,1,0|1,0,0]=3 8326 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [1,0,0,0,1,0|1,0,0]=3 8327 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [1,0,0,0,1,0|1,1,0]=4 8328 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [1,0,0,0,1,0|1,0,0]=3 8329 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [1,0,0,0,1,0|1,1,0]=4 8330 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [1,0,0,0,1,0|2,0,0]=4 8331 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [1,0,0,0,1,0|2,0,0]=4 8332 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [1,0,0,0,1,0|2,0,0]=4 8333 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [1,0,0,0,1,0|2,0,0]=4 8334 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [1,0,0,0,1,0|2,0,0]=4 8335 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [1,0,0,0,1,0|2,0,0]=4 8336 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [1,0,0,0,1,0|2,0,0]=4 8337 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [1,0,0,0,1,0|1,0,0]=3 8338 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [1,0,0,0,1,0|1,0,0]=3 8339 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [1,0,0,0,1,0|1,0,0]=3 8340 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [1,0,0,0,1,0|1,0,1]=4 8341 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [1,0,0,0,1,0|0,0,0]=2 8342 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [1,0,0,0,1,0|0,0,0]=2 8343 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [1,0,0,0,1,0|1,0,0]=3 8344 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [1,0,0,0,1,0|1,0,0]=3 8345 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [1,0,0,0,1,0|0,0,0]=2 8346 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [1,0,0,0,1,0|2,0,0]=4 8347 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [1,0,0,0,1,0|2,0,0]=4 8348 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [1,0,0,0,1,0|2,0,0]=4 8349 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [1,0,0,0,1,0|2,0,0]=4 8350 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [1,0,0,0,1,0|2,0,0]=4 8351 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [1,0,0,0,1,0|2,0,0]=4 8352 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [1,0,0,0,1,0|2,0,0]=4 8353 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [1,0,0,0,1,0|1,0,0]=3 8354 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [1,0,0,0,1,0|1,0,0]=3 8355 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [1,0,0,0,1,0|1,0,0]=3 8356 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [1,0,0,0,1,0|1,0,0]=3 8357 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [1,0,0,0,1,0|1,0,0]=3 8358 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [1,0,0,0,1,0|1,0,0]=3 8359 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [1,0,0,0,1,0|2,0,0]=4 8360 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [1,0,0,0,1,0|2,0,0]=4 8361 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [1,0,0,0,1,0|1,0,0]=3 8362 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [1,0,0,0,1,0|1,0,0]=3 8363 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [1,0,0,0,1,0|1,0,0]=3 8364 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [1,0,0,0,1,0|0,1,0]=3 8365 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [1,0,0,0,1,0|0,1,0]=3 8366 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [1,0,0,0,1,0|0,1,0]=3 8367 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [1,0,0,0,1,0|1,1,0]=4 8368 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [1,0,0,0,1,0|1,1,0]=4 8369 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [1,0,0,0,1,0|0,1,0]=3 8370 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [1,0,0,0,1,0|1,1,0]=4 8371 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [1,0,0,0,1,0|1,1,0]=4 8372 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [1,0,0,0,1,0|1,1,0]=4 8373 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [1,0,0,0,1,0|1,1,0]=4 8374 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [1,0,0,0,1,0|1,1,0]=4 8375 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [1,0,0,0,1,0|1,1,0]=4 8376 B12R1.438 [13CH3]C(=O)Cc1cccc(c1)C#N 1458a_100000684415_200025704644 [1,0,0,0,1,0|2,0,0]=4 8377 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [1,0,0,0,1,0|2,0,0]=4 8378 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [1,0,0,0,1,0|2,0,0]=4 8379 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [1,0,0,0,1,0|1,0,0]=3 8380 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [1,0,0,0,1,0|1,0,0]=3 8381 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [1,0,0,0,1,0|2,0,0]=4 8382 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [1,0,0,0,1,0|2,0,0]=4 8383 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [1,0,0,0,1,0|1,1,0]=4 8384 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [1,0,0,0,1,0|1,1,0]=4 8385 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,0,0,0,2,0|2,0,0]=4 8386 B12R1.56 C=C(C)c1ccc(c(c1)OC)Br 271570a_100000694244_100012353699 [0,0,0,0,2,0|2,0,0]=4 8387 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [0,0,0,0,2,0|2,0,0]=4 8388 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [0,0,0,0,2,0|2,0,0]=4 8389 B12R1.56 C=C(C)c1ccc(c(c1)OC)F 271570a_100000694244_100011934186 [0,0,0,0,2,0|2,0,0]=4 8390 B12R1.56 C=C(C)c1ccc(c(c1)OC)N 271570a_100000694244_100011279103 [0,0,0,0,2,0|2,0,0]=4 8391 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,0,0,0,2,0|1,0,0]=3 8392 B12R1.56 C=C(C)c1ccc(c(n1)OC)O 271570a_100000694244_100010893133 [0,0,0,0,2,0|2,0,0]=4 8393 B12R1.56 C=Cc1cc(ccc1O)C(=O)C 271570a_100011290941_100011772453 [0,0,0,0,2,0|1,0,1]=4 8394 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200000210301 [0,0,0,0,2,0|2,0,0]=4 8395 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010125495 [0,0,0,0,2,0|2,0,0]=4 8396 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [0,0,0,0,2,0|1,0,0]=3 8397 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [0,0,0,0,2,0|1,0,0]=3 8398 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [0,0,0,0,2,0|1,0,0]=3 8399 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [0,0,0,0,2,0|1,0,0]=3 8400 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_100010146556_200025704644 [0,0,0,0,2,0|1,1,0]=4 8401 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])Br 62a_200025704644_100010146556 [0,0,0,0,2,0|1,1,0]=4 8402 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_100011934287_200025704644 [0,0,0,0,2,0|1,1,0]=4 8403 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])C 62a_200025704644_100011934287 [0,0,0,0,2,0|1,1,0]=4 8404 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_100000239719_200025704644 [0,0,0,0,2,0|1,1,0]=4 8405 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000239719 [0,0,0,0,2,0|1,1,0]=4 8406 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])N 62a_100012029215_200025704644 [0,0,0,0,2,0|1,1,0]=4 8407 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [0,0,0,0,2,0|0,1,0]=3 8408 B12R1.56 CCc1cc(ccc1Br)C(=O)C 1458a_100010152358_200000210301 [0,0,0,0,2,0|2,0,0]=4 8409 B12R1.56 CCc1cc(ccc1Br)C(=O)[13CH3] 1458a_100010152358_200025704644 [0,0,0,0,2,0|2,0,0]=4 8410 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [0,0,0,0,2,0|2,0,0]=4 8411 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [0,0,0,0,2,0|2,0,0]=4 8412 B12R1.56 CCc1cc(ccc1F)C(=O)C 1458a_100009883079_200000210301 [0,0,0,0,2,0|2,0,0]=4 8413 B12R1.56 CCc1cc(ccc1F)C(=O)[13CH3] 1458a_100009883079_200025704644 [0,0,0,0,2,0|2,0,0]=4 8414 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [0,0,0,0,2,0|1,0,0]=3 8415 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [0,0,0,0,2,0|2,0,0]=4 8416 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [0,0,0,0,2,0|2,0,0]=4 8417 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [0,0,0,0,2,0|1,0,0]=3 8418 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [0,0,0,0,2,0|1,0,0]=3 8419 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [0,0,0,0,2,0|1,0,0]=3 8420 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [0,0,0,0,2,0|1,0,0]=3 8421 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [0,0,0,0,2,0|1,0,0]=3 8422 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [0,0,0,0,2,0|1,0,0]=3 8423 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [0,0,0,0,2,0|1,0,0]=3 8424 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [0,0,0,0,2,0|1,0,0]=3 8425 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [0,0,0,0,2,0|1,0,0]=3 8426 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [0,0,0,0,2,0|1,0,0]=3 8427 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [0,0,0,0,2,0|1,0,0]=3 8428 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [0,0,0,0,2,0|1,0,0]=3 8429 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [0,0,0,0,2,0|1,0,0]=3 8430 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [0,0,0,0,2,0|2,0,0]=4 8431 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [0,0,0,0,2,0|2,0,0]=4 8432 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,0,0,0,2,0|0,0,0]=2 8433 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,0,0,0,2,0|0,0,0]=2 8434 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,0,0,0,2,0|1,0,0]=3 8435 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,0,0,0,2,0|0,0,0]=2 8436 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [0,0,0,0,2,0|1,0,1]=4 8437 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_100010146556_200000210301 [0,0,0,0,2,0|1,1,0]=4 8438 B12R1.56 CSc1cc(ccc1Br)C(=O)C 62a_200000210301_100010146556 [0,0,0,0,2,0|1,1,0]=4 8439 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_100011934287_200000210301 [0,0,0,0,2,0|1,1,0]=4 8440 B12R1.56 CSc1cc(ccc1C)C(=O)C 62a_200000210301_100011934287 [0,0,0,0,2,0|1,1,0]=4 8441 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_100000239719_200000210301 [0,0,0,0,2,0|1,1,0]=4 8442 B12R1.56 CSc1cc(ccc1F)C(=O)C 62a_200000210301_100000239719 [0,0,0,0,2,0|1,1,0]=4 8443 B12R1.56 CSc1cc(ccc1N)C(=O)C 62a_100012029215_200000210301 [0,0,0,0,2,0|1,1,0]=4 8444 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [0,0,0,0,2,0|0,1,0]=3 8445 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200025704644 [0,0,0,0,2,0|2,0,0]=4 8446 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [0,0,0,0,2,0|2,0,0]=4 8447 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [0,0,0,0,2,0|2,0,0]=4 8448 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [0,0,0,0,2,0|2,0,0]=4 8449 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [0,0,0,0,2,0|2,0,0]=4 8450 B14R1.76 C#Cc1cccc(c1)OCCC(=O)C 7a_100011216014_100000053229 [1,0,0,0,0,1|1,0,1]=4 8451 B14R1.76 C=C(C)CCNc1cccc(c1)CC 2230a_100000211250_100000730704 [1,0,0,0,0,1|2,0,0]=4 8452 B14R1.76 C=C(C)CCNc1cccc(c1)CC 34a_100000211250_100000730704 [1,0,0,0,0,1|2,0,0]=4 8453 B14R1.76 C=C(C)CCNc1cccc(c1)CC 7a_100000211250_100000730704 [1,0,0,0,0,1|2,0,0]=4 8454 B14R1.76 C=C(C)CCNc1cccc(c1)OC 34a_100000210024_100000730704 [1,0,0,0,0,1|1,0,0]=3 8455 B14R1.76 C=C(C)CCNc1cccc(c1)SC 2230a_100000210049_100000730704 [1,0,0,0,0,1|1,1,0]=4 8456 B14R1.76 C=C(C)CCNc1cccc(c1)SC 34a_100000210049_100000730704 [1,0,0,0,0,1|1,1,0]=4 8457 B14R1.76 C=C(C)CCOc1cccc(c1)CC 34a_100000211550_100000730704 [1,0,0,0,0,1|2,0,0]=4 8458 B14R1.76 C=C(C)CCOc1cccc(c1)CC 7a_100000211550_100000730704 [1,0,0,0,0,1|2,0,0]=4 8459 B14R1.76 C=C(C)CCOc1cccc(c1)NC 34a_100000756613_100000730704 [1,0,0,0,0,1|2,0,0]=4 8460 B14R1.76 C=C(C)CCOc1cccc(c1)NC 7a_100000756613_100000730704 [1,0,0,0,0,1|2,0,0]=4 8461 B14R1.76 C=C(C)CCOc1cccc(c1)OC 34a_100000211255_100000730704 [1,0,0,0,0,1|1,0,0]=3 8462 B14R1.76 C=C(C)CCOc1cccc(c1)OC 7a_100000211255_100000730704 [1,0,0,0,0,1|1,0,0]=3 8463 B14R1.76 C=C(C)CCOc1cccc(c1)SC 34a_100011265683_100000730704 [1,0,0,0,0,1|1,1,0]=4 8464 B14R1.76 C=C(C)CCOc1cccc(c1)SC 7a_100011265683_100000730704 [1,0,0,0,0,1|1,1,0]=4 8465 B14R1.76 C=C(C)CCOc1ccnc(c1)OC 34a_100012181050_100000730704 [1,0,0,0,0,1|2,0,0]=4 8466 B14R1.76 C=C(C)CCOc1cncc(c1)OC 34a_100000084572_100000730704 [1,0,0,0,0,1|2,0,0]=4 8467 B14R1.76 C=C(C)CCOc1cncc(c1)OC 7a_100000084572_100000730704 [1,0,0,0,0,1|2,0,0]=4 8468 B14R1.76 C=C(C)CCSc1cc(ccn1)OC 62a_100000730704_100011216251 [1,0,0,0,0,1|2,0,0]=4 8469 B14R1.76 C=C(C)CCSc1cc(ccn1)OC 62a_100009817693_100000730704 [1,0,0,0,0,1|2,0,0]=4 8470 B14R1.76 C=C(C)CCSc1cccc(c1)CC 62a_100000730704_100011263222 [1,0,0,0,0,1|2,0,0]=4 8471 B14R1.76 C=C(C)CCSc1cccc(c1)CC 62a_100011263222_100000730704 [1,0,0,0,0,1|2,0,0]=4 8472 B14R1.76 C=C(C)CCSc1cccc(c1)NC 62a_100000219648_100000730704 [1,0,0,0,0,1|2,0,0]=4 8473 B14R1.76 C=C(C)CCSc1cccc(c1)NC 62a_100000730704_100000219648 [1,0,0,0,0,1|2,0,0]=4 8474 B14R1.76 C=C(C)CCSc1cccc(c1)OC 62a_100000730704_100000170001 [1,0,0,0,0,1|1,0,0]=3 8475 B14R1.76 C=C(C)CCSc1cccc(c1)SC 62a_100000730704_100011215954 [1,0,0,0,0,1|1,1,0]=4 8476 B14R1.76 C=C(C)CCSc1cccc(c1)SC 62a_100011215954_100000730704 [1,0,0,0,0,1|1,1,0]=4 8477 B14R1.76 C=C(C)CCSc1cccc(n1)OC 62a_100000730704_100000760917 [1,0,0,0,0,1|2,0,0]=4 8478 B14R1.76 C=C(C)CCSc1cccc(n1)OC 62a_100000760917_100000730704 [1,0,0,0,0,1|2,0,0]=4 8479 B14R1.76 C=C(C)CCSc1ccnc(c1)OC 62a_100000117307_100000730704 [1,0,0,0,0,1|2,0,0]=4 8480 B14R1.76 C=C(C)CCSc1ccnc(c1)OC 62a_100000730704_100000117307 [1,0,0,0,0,1|2,0,0]=4 8481 B14R1.76 C=C(C)CCSc1cncc(c1)OC 62a_100000050176_100000730704 [1,0,0,0,0,1|2,0,0]=4 8482 B14R1.76 C=C(C)CCSc1cncc(c1)OC 62a_100000730704_100000050176 [1,0,0,0,0,1|2,0,0]=4 8483 B14R1.76 C=C(C)CNCc1cccc(c1)OC 2230a_100000174954_100000748629 [1,0,0,0,0,1|1,0,0]=3 8484 B14R1.76 C=C(C)CNCc1cccc(c1)OC 34a_100000174954_100000748629 [1,0,0,0,0,1|1,0,0]=3 8485 B14R1.76 C=C(C)CNCc1cccc(n1)OC 2230a_100000746380_100000748629 [1,0,0,0,0,1|2,0,0]=4 8486 B14R1.76 C=C(C)CNCc1cncc(c1)OC 2230a_100020589029_100000748629 [1,0,0,0,0,1|2,0,0]=4 8487 B14R1.76 C=C(C)CNCc1cncc(c1)OC 34a_100020589029_100000748629 [1,0,0,0,0,1|2,0,0]=4 8488 B14R1.76 C=C(C)COCc1cc(ccn1)OC 34a_100000210245_100000752681 [1,0,0,0,0,1|2,0,0]=4 8489 B14R1.76 C=C(C)COCc1cc(ccn1)OC 34a_100000749536_100000748629 [1,0,0,0,0,1|2,0,0]=4 8490 B14R1.76 C=C(C)COCc1cccc(c1)OC 34a_100000198976_100000748629 [1,0,0,0,0,1|1,0,0]=3 8491 B14R1.76 C=C(C)COCc1cccc(c1)OC 34a_100000210245_100000688526 [1,0,0,0,0,1|1,0,0]=3 8492 B14R1.76 C=C(C)COCc1cccc(n1)OC 34a_100000210245_100000755263 [1,0,0,0,0,1|2,0,0]=4 8493 B14R1.76 C=C(C)COCc1ccnc(c1)OC 34a_100000210245_100103152439 [1,0,0,0,0,1|2,0,0]=4 8494 B14R1.76 C=C(C)COCc1cncc(c1)OC 34a_100000732071_100000748629 [1,0,0,0,0,1|2,0,0]=4 8495 B14R1.76 C=C(C)CSCc1cc(ccn1)OC 62a_100000748629_100000752681 [1,0,0,0,0,1|2,0,0]=4 8496 B14R1.76 C=C(C)CSCc1cc(ccn1)OC 62a_100000752681_100000211660 [1,0,0,0,0,1|2,0,0]=4 8497 B14R1.76 C=C(C)CSCc1cccc(c1)OC 62a_100000688526_100000211660 [1,0,0,0,0,1|1,0,0]=3 8498 B14R1.76 C=C(C)CSCc1cccc(c1)OC 62a_100000748629_100000211672 [1,0,0,0,0,1|1,0,0]=3 8499 B14R1.76 C=C(C)CSCc1cccc(n1)OC 62a_100000748629_100000755263 [1,0,0,0,0,1|2,0,0]=4 8500 B14R1.76 C=C(C)CSCc1cccc(n1)OC 62a_100000755263_100000211660 [1,0,0,0,0,1|2,0,0]=4 8501 B14R1.76 C=C(C)CSCc1ccnc(c1)OC 62a_100000748629_100103152439 [1,0,0,0,0,1|2,0,0]=4 8502 B14R1.76 C=C(C)CSCc1ccnc(c1)OC 62a_100103152439_100000211660 [1,0,0,0,0,1|2,0,0]=4 8503 B14R1.76 C=C(F)CNCc1cccc(c1)OC 2230a_100000174954_100009893438 [1,0,0,0,0,1|1,0,1]=4 8504 B14R1.76 C=C(F)CNCc1cccc(c1)OC 34a_100000174954_100009893438 [1,0,0,0,0,1|1,0,1]=4 8505 B14R1.76 C=C(F)COCc1cccc(c1)OC 34a_100000198976_100009893438 [1,0,0,0,0,1|1,0,1]=4 8506 B14R1.76 C=C(F)COCc1cccc(c1)OC 34a_200010262243_100000688526 [1,0,0,0,0,1|1,0,1]=4 8507 B14R1.76 C=C(F)CSCc1cccc(c1)OC 62a_100000042424_100000211672 [1,0,0,0,0,1|1,0,1]=4 8508 B14R1.76 C=C(F)CSCc1cccc(c1)OC 62a_100000688526_100000042424 [1,0,0,0,0,1|1,0,1]=4 8509 B14R1.76 C=Cc1cccc(c1)OCCC(=O)C 7a_100011309434_100000053229 [1,0,0,0,0,1|1,0,1]=4 8510 B14R1.76 C=Cc1cccc(c1)SCCC(=O)C 62a_100000053229_100011215241 [1,0,0,0,0,1|1,0,1]=4 8511 B14R1.76 C=Cc1cccc(c1)SCCC(=O)C 62a_100011215241_100000053229 [1,0,0,0,0,1|1,0,1]=4 8512 B14R1.76 CC(=O)CCNc1cccc(c1)C#N 7a_100000210922_100000053229 [1,0,0,0,0,1|2,0,0]=4 8513 B14R1.76 CC(=O)CCNc1cccc(c1)CF 7a_100000126320_100000053229 [1,0,0,0,0,1|2,0,0]=4 8514 B14R1.76 CC(=O)CCOc1cccc(c1)C#N 1458a_100000070787_100000742621 [1,0,0,0,0,1|2,0,0]=4 8515 B14R1.76 CC(=O)CCOc1cccc(c1)C#N 1458a_200011209032_200000210301 [1,0,0,0,0,1|2,0,0]=4 8516 B14R1.76 CC(=O)CCOc1cccc(c1)C#N 7a_100000184713_100000053229 [1,0,0,0,0,1|2,0,0]=4 8517 B14R1.76 CC(=O)CCOc1cccc(c1)CBr 7a_100011660834_100000053229 [1,0,0,0,0,1|2,0,0]=4 8518 B14R1.76 CC(=O)CCOc1cccc(c1)CCl 7a_100000084143_100000053229 [1,0,0,0,0,1|2,0,0]=4 8519 B14R1.76 CC(=O)CCOc1cccc(c1)CO 7a_100011214949_100000053229 [1,0,0,0,0,1|2,0,0]=4 8520 B14R1.76 CC(=O)CCSc1cccc(c1)C#N 62a_100000053229_100000189340 [1,0,0,0,0,1|2,0,0]=4 8521 B14R1.76 CC(=O)CCSc1cccc(c1)C=O 62a_100000014684_100000053229 [1,0,0,0,0,1|2,0,0]=4 8522 B14R1.76 CC(=O)CCSc1cccc(c1)C=O 62a_100000053229_100000014684 [1,0,0,0,0,1|2,0,0]=4 8523 B14R1.76 CC(=O)CCSc1cccc(c1)CF 62a_100000053229_100010878472 [1,0,0,0,0,1|2,0,0]=4 8524 B14R1.76 CC(=O)CCSc1cccc(c1)CF 62a_100010878472_100000053229 [1,0,0,0,0,1|2,0,0]=4 8525 B14R1.76 CC(=O)CCSc1cccc(c1)CN 62a_100000053229_100000106179 [1,0,0,0,0,1|2,0,0]=4 8526 B14R1.76 CC(=O)CCSc1cccc(c1)CN 62a_100000106179_100000053229 [1,0,0,0,0,1|2,0,0]=4 8527 B14R1.76 CC(=O)CCSc1cccc(c1)CO 62a_100000053229_100000687537 [1,0,0,0,0,1|2,0,0]=4 8528 B14R1.76 CC(=O)CCSc1cccc(c1)CO 62a_100000687537_100000053229 [1,0,0,0,0,1|2,0,0]=4 8529 B14R1.76 CC(=O)CCSc1cccc(c1)NN 62a_100000053229_100000217339 [1,0,0,0,0,1|2,0,0]=4 8530 B14R1.76 CC(=O)CCSc1cccc(c1)NN 62a_100000217339_100000053229 [1,0,0,0,0,1|2,0,0]=4 8531 B14R1.76 CC(=O)COCc1cccc(c1)C#N 34a_100000211253_100000233786 [1,0,0,0,0,1|2,0,0]=4 8532 B14R1.76 CC(=O)COCc1cccc(c1)C=O 34a_100000211253_100009816774 [1,0,0,0,0,1|2,0,0]=4 8533 B14R1.76 CC(=O)COCc1cccc(c1)CO 34a_100000211253_100010188025 [1,0,0,0,0,1|2,0,0]=4 8534 B14R1.76 CC[n+]1cccc(c1)OCCC(=O)C 7a_100000731997_100000053229 [1,0,0,0,0,1|2,0,0]=4 8535 B14R1.76 CCc1cc(ccn1)SCCC(=O)C 62a_100000053229_100009820011 [1,0,0,0,0,1|2,0,0]=4 8536 B14R1.76 CCc1cc(ccn1)SCCC(=O)C 62a_100009820011_100000053229 [1,0,0,0,0,1|2,0,0]=4 8537 B14R1.76 CCc1cccc(c1)NCCC(=O)C 7a_100000211250_100000053229 [1,0,0,0,0,1|1,0,0]=3 8538 B14R1.76 CCc1cccc(c1)NCCC(=O)N 2230a_100000211250_100000744528 [1,0,0,0,0,1|2,0,0]=4 8539 B14R1.76 CCc1cccc(c1)NCCC(=O)N 34a_100000211250_100000731001 [1,0,0,0,0,1|2,0,0]=4 8540 B14R1.76 CCc1cccc(c1)NCCC(=O)N 7a_100000211250_100000744528 [1,0,0,0,0,1|2,0,0]=4 8541 B14R1.76 CCc1cccc(c1)NCOC(=O)C 34a_100000211250_100009813279 [1,0,0,0,0,1|2,0,0]=4 8542 B14R1.76 CCc1cccc(c1)OCCC(=O)C 1458a_100000070787_100000199093 [1,0,0,0,0,1|1,0,0]=3 8543 B14R1.76 CCc1cccc(c1)OCCC(=O)C 7a_100000211550_100000053229 [1,0,0,0,0,1|1,0,0]=3 8544 B14R1.76 CCc1cccc(c1)OCCC(=O)N 34a_100000211550_100000731001 [1,0,0,0,0,1|2,0,0]=4 8545 B14R1.76 CCc1cccc(c1)OCCC(=O)N 7a_100000211550_100000744528 [1,0,0,0,0,1|2,0,0]=4 8546 B14R1.76 CCc1cccc(c1)OCOC(=O)C 34a_100000211550_100009813279 [1,0,0,0,0,1|2,0,0]=4 8547 B14R1.76 CCc1cccc(c1)SCCC(=O)C 62a_100000053229_100011263222 [1,0,0,0,0,1|1,0,0]=3 8548 B14R1.76 CCc1cccc(c1)SCCC(=O)C 62a_100011263222_100000053229 [1,0,0,0,0,1|1,0,0]=3 8549 B14R1.76 CCc1cccc(c1)SCCC(=O)N 62a_100000744528_100011263222 [1,0,0,0,0,1|2,0,0]=4 8550 B14R1.76 CCc1cccc(c1)SCCC(=O)N 62a_100011263222_100000744528 [1,0,0,0,0,1|2,0,0]=4 8551 B14R1.76 CCc1cccc(c1)SCOC(=O)C 62a_100000076356_100011263222 [1,0,0,0,0,1|2,0,0]=4 8552 B14R1.76 CCc1cccc(c1)SCOC(=O)C 62a_100011263222_100000076356 [1,0,0,0,0,1|2,0,0]=4 8553 B14R1.76 CCc1cccc(n1)SCCC(=O)C 62a_100000053229_100009856026 [1,0,0,0,0,1|2,0,0]=4 8554 B14R1.76 CCc1cccc(n1)SCCC(=O)C 62a_100009856026_100000053229 [1,0,0,0,0,1|2,0,0]=4 8555 B14R1.76 CCc1ccnc(c1)SCCC(=O)C 62a_100000053229_100009817561 [1,0,0,0,0,1|2,0,0]=4 8556 B14R1.76 CCc1ccnc(c1)SCCC(=O)C 62a_100009817561_100000053229 [1,0,0,0,0,1|2,0,0]=4 8557 B14R1.76 CCc1cncc(c1)OCCC(=O)C 7a_200009861530_100000053229 [1,0,0,0,0,1|2,0,0]=4 8558 B14R1.76 CCc1cncc(c1)SCCC(=O)C 62a_100000053229_200009819073 [1,0,0,0,0,1|2,0,0]=4 8559 B14R1.76 CCc1cncc(c1)SCCC(=O)C 62a_200009819073_100000053229 [1,0,0,0,0,1|2,0,0]=4 8560 B14R1.76 CNc1cc(ccn1)SCCC(=O)C 62a_100000053229_100009819592 [1,0,0,0,0,1|2,0,0]=4 8561 B14R1.76 CNc1cc(ccn1)SCCC(=O)C 62a_100009819592_100000053229 [1,0,0,0,0,1|2,0,0]=4 8562 B14R1.76 CNc1cccc(c1)OCCC(=O)C 7a_100000756613_100000053229 [1,0,0,0,0,1|1,0,0]=3 8563 B14R1.76 CNc1cccc(c1)OCCC(=O)N 34a_100000756613_100000731001 [1,0,0,0,0,1|2,0,0]=4 8564 B14R1.76 CNc1cccc(c1)OCCC(=O)N 7a_100000756613_100000744528 [1,0,0,0,0,1|2,0,0]=4 8565 B14R1.76 CNc1cccc(c1)OCOC(=O)C 34a_100000756613_100009813279 [1,0,0,0,0,1|2,0,0]=4 8566 B14R1.76 CNc1cccc(c1)SCCC(=O)C 62a_100000053229_100000219648 [1,0,0,0,0,1|1,0,0]=3 8567 B14R1.76 CNc1cccc(c1)SCCC(=O)C 62a_100000219648_100000053229 [1,0,0,0,0,1|1,0,0]=3 8568 B14R1.76 CNc1cccc(c1)SCCC(=O)N 62a_100000219648_100000744528 [1,0,0,0,0,1|2,0,0]=4 8569 B14R1.76 CNc1cccc(c1)SCCC(=O)N 62a_100000744528_100000219648 [1,0,0,0,0,1|2,0,0]=4 8570 B14R1.76 CNc1cccc(c1)SCOC(=O)C 62a_100000076356_100000219648 [1,0,0,0,0,1|2,0,0]=4 8571 B14R1.76 CNc1cccc(c1)SCOC(=O)C 62a_100000219648_100000076356 [1,0,0,0,0,1|2,0,0]=4 8572 B14R1.76 CNc1cccc(n1)SCCC(=O)C 62a_100000053229_100000703281 [1,0,0,0,0,1|2,0,0]=4 8573 B14R1.76 CNc1cccc(n1)SCCC(=O)C 62a_100000703281_100000053229 [1,0,0,0,0,1|2,0,0]=4 8574 B14R1.76 CNc1ccnc(c1)SCCC(=O)C 62a_100000053229_100009869472 [1,0,0,0,0,1|2,0,0]=4 8575 B14R1.76 CNc1ccnc(c1)SCCC(=O)C 62a_100009869472_100000053229 [1,0,0,0,0,1|2,0,0]=4 8576 B14R1.76 CNc1cncc(c1)SCCC(=O)C 62a_100000053229_100012184536 [1,0,0,0,0,1|2,0,0]=4 8577 B14R1.76 CNc1cncc(c1)SCCC(=O)C 62a_100012184536_100000053229 [1,0,0,0,0,1|2,0,0]=4 8578 B14R1.76 COc1cc(ccn1)CNCC(=O)N 2230a_100000711301_100103152439 [1,0,0,0,0,1|2,0,0]=4 8579 B14R1.76 COc1cc(ccn1)CNCC(=O)O 269956a_100016091260_100103152439 [1,0,0,0,0,1|2,0,0]=4 8580 B14R1.76 COc1cc(ccn1)COCC(=O)C 34a_100000211253_100103152439 [1,0,0,0,0,1|1,0,0]=3 8581 B14R1.76 COc1cc(ccn1)CSCC(=O)N 62a_100000747473_100103152439 [1,0,0,0,0,1|2,0,0]=4 8582 B14R1.76 COc1cc(ccn1)CSCC(=O)N 62a_100103152439_100000747473 [1,0,0,0,0,1|2,0,0]=4 8583 B14R1.76 COc1cc(ccn1)CSCC(=O)[O-] 62a_100020667443_100103152439 [1,0,0,0,0,1|2,0,0]=4 8584 B14R1.76 COc1cc(ccn1)CSCC(=O)[O-] 62a_100103152439_100020667443 [1,0,0,0,0,1|2,0,0]=4 8585 B14R1.76 COc1cc(ccn1)OCCC(=O)N 34a_100012181050_100000731001 [1,0,0,0,0,1|2,0,0]=4 8586 B14R1.76 COc1cc(ccn1)OCOC(=O)C 34a_100012181050_100009813279 [1,0,0,0,0,1|2,0,0]=4 8587 B14R1.76 COc1cc(ccn1)SCCC(=O)C 62a_100000053229_100000117307 [1,0,0,0,0,1|1,0,0]=3 8588 B14R1.76 COc1cc(ccn1)SCCC(=O)C 62a_100000117307_100000053229 [1,0,0,0,0,1|1,0,0]=3 8589 B14R1.76 COc1cc(ccn1)SCCC(=O)N 62a_100000117307_100000744528 [1,0,0,0,0,1|2,0,0]=4 8590 B14R1.76 COc1cc(ccn1)SCCC(=O)N 62a_100000744528_100000117307 [1,0,0,0,0,1|2,0,0]=4 8591 B14R1.76 COc1cc(ccn1)SCOC(=O)C 62a_100000076356_100000117307 [1,0,0,0,0,1|2,0,0]=4 8592 B14R1.76 COc1cc(ccn1)SCOC(=O)C 62a_100000117307_100000076356 [1,0,0,0,0,1|2,0,0]=4 8593 B14R1.76 COc1cc(ncn1)SCCC(=O)C 62a_100000049997_100000053229 [1,0,0,0,0,1|2,0,0]=4 8594 B14R1.76 COc1cc(ncn1)SCCC(=O)C 62a_100000053229_100000049997 [1,0,0,0,0,1|2,0,0]=4 8595 B14R1.76 COc1cccc(c1)C=NNC(=O)C 4a_100000189765_100000170238 [1,0,0,0,0,1|1,0,1]=4 8596 B14R1.76 COc1cccc(c1)CCNC(=O)C 11a_100000740386_100015343762 [1,0,0,0,0,1|0,0,0]=2 8597 B14R1.76 COc1cccc(c1)CCNC(=O)C 1626a_100000740386_100015343762 [1,0,0,0,0,1|0,0,0]=2 8598 B14R1.76 COc1cccc(c1)CCNC(=O)C 240690a_100000740386_100015343762 [1,0,0,0,0,1|0,0,0]=2 8599 B14R1.76 COc1cccc(c1)CCNC(=O)C 527a_100000740386_100103153847 [1,0,0,0,0,1|0,0,0]=2 8600 B14R1.76 COc1cccc(c1)CCNC(C)C 2230a_100000740386_100000210206 [1,0,0,0,0,1|1,0,1]=4 8601 B14R1.76 COc1cccc(c1)CCNC(C)C 2230a_100138425928_100011713679 [1,0,0,0,0,1|1,0,1]=4 8602 B14R1.76 COc1cccc(c1)CCNC(C)C 34a_100000740386_100000210206 [1,0,0,0,0,1|1,0,1]=4 8603 B14R1.76 COc1cccc(c1)CCNC(C)C 34a_100138425928_100011713679 [1,0,0,0,0,1|1,0,1]=4 8604 B14R1.76 COc1cccc(c1)CCOC(C)C 34a_100000212225_100011713679 [1,0,0,0,0,1|1,0,1]=4 8605 B14R1.76 COc1cccc(c1)CCOC(C)C 34a_100011215300_100000210206 [1,0,0,0,0,1|1,0,1]=4 8606 B14R1.76 COc1cccc(c1)CCOC(C)C 7a_100011215300_100000210206 [1,0,0,0,0,1|1,0,1]=4 8607 B14R1.76 COc1cccc(c1)CCSC(C)C 62a_100000210206_100011713679 [1,0,0,0,0,1|1,0,1]=4 8608 B14R1.76 COc1cccc(c1)CCSC(C)C 62a_100011713679_100000210206 [1,0,0,0,0,1|1,0,1]=4 8609 B14R1.76 COc1cccc(c1)CNCC(=O)N 2230a_100000174954_100000747473 [1,0,0,0,0,1|1,0,0]=3 8610 B14R1.76 COc1cccc(c1)CNCC(=O)N 2230a_100000711301_100000211672 [1,0,0,0,0,1|1,0,0]=3 8611 B14R1.76 COc1cccc(c1)CNCC(=O)N 34a_100000174954_100000187820 [1,0,0,0,0,1|1,0,0]=3 8612 B14R1.76 COc1cccc(c1)CNCC(=O)O 269956a_100016091260_100000211672 [1,0,0,0,0,1|1,0,0]=3 8613 B14R1.76 COc1cccc(c1)CNCC(=O)[O-] 34a_100000174954_100020667443 [1,0,0,0,0,1|1,0,0]=3 8614 B14R1.76 COc1cccc(c1)CNCC(C)C 207a_100000210953_100000170238 [1,0,0,0,0,1|1,0,1]=4 8615 B14R1.76 COc1cccc(c1)CNCC(C)C 2230a_100000174954_100000210760 [1,0,0,0,0,1|1,0,1]=4 8616 B14R1.76 COc1cccc(c1)CNCC(C)C 2230a_100000210953_100000211672 [1,0,0,0,0,1|1,0,1]=4 8617 B14R1.76 COc1cccc(c1)CNCC(C)C 26a_100000210953_100000211255 [1,0,0,0,0,1|1,0,1]=4 8618 B14R1.76 COc1cccc(c1)CNCC(C)C 270004a_100000174954_100000210432 [1,0,0,0,0,1|1,0,1]=4 8619 B14R1.76 COc1cccc(c1)CNCC(C)C 270004a_100000210953_100000170238 [1,0,0,0,0,1|1,0,1]=4 8620 B14R1.76 COc1cccc(c1)CNCC(C)C 34a_100000174954_100000210624 [1,0,0,0,0,1|1,0,1]=4 8621 B14R1.76 COc1cccc(c1)CNCC(C)C 34a_100000210953_100000688526 [1,0,0,0,0,1|1,0,1]=4 8622 B14R1.76 COc1cccc(c1)CNCC(C)O 207a_100000210904_100000170238 [1,0,0,0,0,1|0,0,2]=4 8623 B14R1.76 COc1cccc(c1)CNCC(C)O 2230a_100000174954_100011218427 [1,0,0,0,0,1|0,0,2]=4 8624 B14R1.76 COc1cccc(c1)CNCC(C)O 2230a_100000210904_100000211672 [1,0,0,0,0,1|0,0,2]=4 8625 B14R1.76 COc1cccc(c1)CNCC(C)O 270004a_100000210904_100000170238 [1,0,0,0,0,1|0,0,2]=4 8626 B14R1.76 COc1cccc(c1)CNCC(C)O 34a_100000174954_100011218427 [1,0,0,0,0,1|0,0,2]=4 8627 B14R1.76 COc1cccc(c1)CNCC(C)O 34a_100000210904_100000688526 [1,0,0,0,0,1|0,0,2]=4 8628 B14R1.76 COc1cccc(c1)CNC[C@@H](C)O 2230a_100000174954_100009817552 [1,0,0,0,0,1|0,0,2]=4 8629 B14R1.76 COc1cccc(c1)CNC[C@@H](C)O 34a_100000174954_100009817552 [1,0,0,0,0,1|0,0,2]=4 8630 B14R1.76 COc1cccc(c1)CNC[N+](=O)[O-] 34a_100000174954_100000761209 [1,0,0,0,0,1|2,0,0]=4 8631 B14R1.76 COc1cccc(c1)CNNC(=O)C 22a_100015185960_100000070787 [1,0,0,0,0,1|1,0,0]=3 8632 B14R1.76 COc1cccc(c1)COCC(=O)C 34a_100000211253_100000688526 [1,0,0,0,0,1|0,0,0]=2 8633 B14R1.76 COc1cccc(c1)COCC(=O)N 34a_100000198976_100000187820 [1,0,0,0,0,1|1,0,0]=3 8634 B14R1.76 COc1cccc(c1)COCC(=O)[O-] 34a_100000198976_100020667443 [1,0,0,0,0,1|1,0,0]=3 8635 B14R1.76 COc1cccc(c1)COCC(C)Br 34a_100012180447_100000688526 [1,0,0,0,0,1|1,0,1]=4 8636 B14R1.76 COc1cccc(c1)COCC(C)C 34a_100000198976_100000210624 [1,0,0,0,0,1|1,0,1]=4 8637 B14R1.76 COc1cccc(c1)COCC(C)C 34a_100000210257_100000688526 [1,0,0,0,0,1|1,0,1]=4 8638 B14R1.76 COc1cccc(c1)COCC(C)F 34a_100015925927_100000688526 [1,0,0,0,0,1|1,0,1]=4 8639 B14R1.76 COc1cccc(c1)COCC(C)O 34a_100000198976_100011218427 [1,0,0,0,0,1|0,0,2]=4 8640 B14R1.76 COc1cccc(c1)COC[C@@H](C)Cl 34a_100016084084_100000688526 [1,0,0,0,0,1|1,0,1]=4 8641 B14R1.76 COc1cccc(c1)COC[C@@H](C)N 34a_100000737577_100000688526 [1,0,0,0,0,1|1,0,1]=4 8642 B14R1.76 COc1cccc(c1)COC[C@@H](C)O 34a_100000198976_100009817552 [1,0,0,0,0,1|0,0,2]=4 8643 B14R1.76 COc1cccc(c1)COC[N+](=O)[O-] 34a_100000198976_100000761209 [1,0,0,0,0,1|2,0,0]=4 8644 B14R1.76 COc1cccc(c1)CSCC(=O)N 62a_100000688526_100000747473 [1,0,0,0,0,1|1,0,0]=3 8645 B14R1.76 COc1cccc(c1)CSCC(=O)N 62a_100000747473_100000211672 [1,0,0,0,0,1|1,0,0]=3 8646 B14R1.76 COc1cccc(c1)CSCC(=O)[O-] 62a_100000688526_100020667443 [1,0,0,0,0,1|1,0,0]=3 8647 B14R1.76 COc1cccc(c1)CSCC(=O)[O-] 62a_100020667443_100000211672 [1,0,0,0,0,1|1,0,0]=3 8648 B14R1.76 COc1cccc(c1)CSCC(C)C 62a_100000210624_100000211672 [1,0,0,0,0,1|1,0,1]=4 8649 B14R1.76 COc1cccc(c1)CSCC(C)C 62a_100000688526_100000210760 [1,0,0,0,0,1|1,0,1]=4 8650 B14R1.76 COc1cccc(c1)CSCC(C)O 62a_100000688526_100011218427 [1,0,0,0,0,1|0,0,2]=4 8651 B14R1.76 COc1cccc(c1)CSCC(C)O 62a_100011218427_100000211672 [1,0,0,0,0,1|0,0,2]=4 8652 B14R1.76 COc1cccc(c1)CSC[C@@H](C)O 62a_100000688526_100009817552 [1,0,0,0,0,1|0,0,2]=4 8653 B14R1.76 COc1cccc(c1)CSC[C@@H](C)O 62a_100009817552_100000211672 [1,0,0,0,0,1|0,0,2]=4 8654 B14R1.76 COc1cccc(c1)CSC[N+](=O)[O-] 62a_100000688526_100000761209 [1,0,0,0,0,1|2,0,0]=4 8655 B14R1.76 COc1cccc(c1)NCC=C(C)C 34a_100000210024_100000761012 [1,0,0,0,0,1|1,0,1]=4 8656 B14R1.76 COc1cccc(c1)NCCC(=O)N 34a_100000210024_100000731001 [1,0,0,0,0,1|1,0,0]=3 8657 B14R1.76 COc1cccc(c1)NCCC(C)C 34a_100000210024_100000210312 [1,0,0,0,0,1|1,0,1]=4 8658 B14R1.76 COc1cccc(c1)NCCC(C)O 34a_100000210024_100012276601 [1,0,0,0,0,1|0,0,2]=4 8659 B14R1.76 COc1cccc(c1)NCOC(=O)C 34a_100000210024_100009813279 [1,0,0,0,0,1|1,0,0]=3 8660 B14R1.76 COc1cccc(c1)OCC=C(C)C 34a_100000211255_100000761012 [1,0,0,0,0,1|1,0,1]=4 8661 B14R1.76 COc1cccc(c1)OCC=C(C)C 7a_100000211255_100000761012 [1,0,0,0,0,1|1,0,1]=4 8662 B14R1.76 COc1cccc(c1)OCCC(=O)C 1458a_100000070787_100000691273 [1,0,0,0,0,1|0,0,0]=2 8663 B14R1.76 COc1cccc(c1)OCCC(=O)C 1458a_100000188295_200000210301 [1,0,0,0,0,1|0,0,0]=2 8664 B14R1.76 COc1cccc(c1)OCCC(=O)C 7a_100000211255_100000053229 [1,0,0,0,0,1|0,0,0]=2 8665 B14R1.76 COc1cccc(c1)OCCC(=O)N 34a_100000211255_100000731001 [1,0,0,0,0,1|1,0,0]=3 8666 B14R1.76 COc1cccc(c1)OCCC(=O)N 7a_100000211255_100000744528 [1,0,0,0,0,1|1,0,0]=3 8667 B14R1.76 COc1cccc(c1)OCCC(=O)[13CH3] 1458a_100000188295_200025704644 [1,0,0,0,0,1|0,0,0]=2 8668 B14R1.76 COc1cccc(c1)OCCC(C)C 34a_100000211255_100000210312 [1,0,0,0,0,1|1,0,1]=4 8669 B14R1.76 COc1cccc(c1)OCCC(C)C 7a_100000211255_100000210626 [1,0,0,0,0,1|1,0,1]=4 8670 B14R1.76 COc1cccc(c1)OCCC(C)O 34a_100000211255_100012276601 [1,0,0,0,0,1|0,0,2]=4 8671 B14R1.76 COc1cccc(c1)OCCC(C)O 7a_100000211255_100012276601 [1,0,0,0,0,1|0,0,2]=4 8672 B14R1.76 COc1cccc(c1)OCCN(C)C 2230a_100102631434_100000691273 [1,0,0,0,0,1|2,0,0]=4 8673 B14R1.76 COc1cccc(c1)OCCN(C)C 2230a_200011252666_200000210301 [1,0,0,0,0,1|2,0,0]=4 8674 B14R1.76 COc1cccc(c1)OCCN(C)C 269982a_100102631434_100000691273 [1,0,0,0,0,1|2,0,0]=4 8675 B14R1.76 COc1cccc(c1)OCCN(C)C 269982a_200011252666_200000210301 [1,0,0,0,0,1|2,0,0]=4 8676 B14R1.76 COc1cccc(c1)OCCN(C)C 7a_100000211255_100000755713 [1,0,0,0,0,1|2,0,0]=4 8677 B14R1.76 COc1cccc(c1)OCCN(C)[13CH3] 2230a_200011252666_200025704644 [1,0,0,0,0,1|2,0,0]=4 8678 B14R1.76 COc1cccc(c1)OCCN(C)[13CH3] 269982a_200011252666_200025704644 [1,0,0,0,0,1|2,0,0]=4 8679 B14R1.76 COc1cccc(c1)OCOC(=O)C 34a_100000211255_100009813279 [1,0,0,0,0,1|1,0,0]=3 8680 B14R1.76 COc1cccc(c1)SCC=C(C)C 62a_100000761012_100000170001 [1,0,0,0,0,1|1,0,1]=4 8681 B14R1.76 COc1cccc(c1)SCCC(=O)C 62a_100000053229_100000170001 [1,0,0,0,0,1|0,0,0]=2 8682 B14R1.76 COc1cccc(c1)SCCC(=O)N 62a_100000744528_100000170001 [1,0,0,0,0,1|1,0,0]=3 8683 B14R1.76 COc1cccc(c1)SCCC(C)C 62a_100000210312_100000170001 [1,0,0,0,0,1|1,0,1]=4 8684 B14R1.76 COc1cccc(c1)SCCC(C)O 62a_100012276601_100000170001 [1,0,0,0,0,1|0,0,2]=4 8685 B14R1.76 COc1cccc(c1)SCOC(=O)C 62a_100000076356_100000170001 [1,0,0,0,0,1|1,0,0]=3 8686 B14R1.76 COc1cccc(n1)CNCC(=O)N 2230a_100000711301_100000755263 [1,0,0,0,0,1|2,0,0]=4 8687 B14R1.76 COc1cccc(n1)CNCC(=O)N 2230a_100000746380_100000747473 [1,0,0,0,0,1|2,0,0]=4 8688 B14R1.76 COc1cccc(n1)CNCC(=O)O 269956a_100016091260_100000755263 [1,0,0,0,0,1|2,0,0]=4 8689 B14R1.76 COc1cccc(n1)COCC(=O)C 34a_100000211253_100000755263 [1,0,0,0,0,1|1,0,0]=3 8690 B14R1.76 COc1cccc(n1)CSCC(=O)N 62a_100000747473_100000755263 [1,0,0,0,0,1|2,0,0]=4 8691 B14R1.76 COc1cccc(n1)CSCC(=O)N 62a_100000755263_100000747473 [1,0,0,0,0,1|2,0,0]=4 8692 B14R1.76 COc1cccc(n1)CSCC(=O)[O-] 62a_100000755263_100020667443 [1,0,0,0,0,1|2,0,0]=4 8693 B14R1.76 COc1cccc(n1)CSCC(=O)[O-] 62a_100020667443_100000755263 [1,0,0,0,0,1|2,0,0]=4 8694 B14R1.76 COc1cccc(n1)SCCC(=O)C 62a_100000053229_100000760917 [1,0,0,0,0,1|1,0,0]=3 8695 B14R1.76 COc1cccc(n1)SCCC(=O)C 62a_100000760917_100000053229 [1,0,0,0,0,1|1,0,0]=3 8696 B14R1.76 COc1cccc(n1)SCCC(=O)N 62a_100000744528_100000760917 [1,0,0,0,0,1|2,0,0]=4 8697 B14R1.76 COc1cccc(n1)SCCC(=O)N 62a_100000760917_100000744528 [1,0,0,0,0,1|2,0,0]=4 8698 B14R1.76 COc1cccc(n1)SCOC(=O)C 62a_100000076356_100000760917 [1,0,0,0,0,1|2,0,0]=4 8699 B14R1.76 COc1cccc(n1)SCOC(=O)C 62a_100000760917_100000076356 [1,0,0,0,0,1|2,0,0]=4 8700 B14R1.76 COc1ccnc(c1)CNCC(=O)N 2230a_100000711301_100000752681 [1,0,0,0,0,1|2,0,0]=4 8701 B14R1.76 COc1ccnc(c1)CNCC(=O)O 269956a_100016091260_100000752681 [1,0,0,0,0,1|2,0,0]=4 8702 B14R1.76 COc1ccnc(c1)COCC(=O)C 34a_100000211253_100000752681 [1,0,0,0,0,1|1,0,0]=3 8703 B14R1.76 COc1ccnc(c1)COCC(=O)N 34a_100000749536_100000187820 [1,0,0,0,0,1|2,0,0]=4 8704 B14R1.76 COc1ccnc(c1)COCC(=O)[O-] 34a_100000749536_100020667443 [1,0,0,0,0,1|2,0,0]=4 8705 B14R1.76 COc1ccnc(c1)CSCC(=O)N 62a_100000747473_100000752681 [1,0,0,0,0,1|2,0,0]=4 8706 B14R1.76 COc1ccnc(c1)CSCC(=O)N 62a_100000752681_100000747473 [1,0,0,0,0,1|2,0,0]=4 8707 B14R1.76 COc1ccnc(c1)CSCC(=O)[O-] 62a_100000752681_100020667443 [1,0,0,0,0,1|2,0,0]=4 8708 B14R1.76 COc1ccnc(c1)CSCC(=O)[O-] 62a_100020667443_100000752681 [1,0,0,0,0,1|2,0,0]=4 8709 B14R1.76 COc1ccnc(c1)SCCC(=O)C 62a_100000053229_100011216251 [1,0,0,0,0,1|1,0,0]=3 8710 B14R1.76 COc1ccnc(c1)SCCC(=O)C 62a_100009817693_100000053229 [1,0,0,0,0,1|1,0,0]=3 8711 B14R1.76 COc1ccnc(c1)SCCC(=O)N 62a_100000744528_100011216251 [1,0,0,0,0,1|2,0,0]=4 8712 B14R1.76 COc1ccnc(c1)SCCC(=O)N 62a_100009817693_100000744528 [1,0,0,0,0,1|2,0,0]=4 8713 B14R1.76 COc1ccnc(c1)SCOC(=O)C 62a_100000076356_100011216251 [1,0,0,0,0,1|2,0,0]=4 8714 B14R1.76 COc1ccnc(c1)SCOC(=O)C 62a_100009817693_100000076356 [1,0,0,0,0,1|2,0,0]=4 8715 B14R1.76 COc1ccnc(n1)SCCC(=O)C 62a_100000053229_100000182009 [1,0,0,0,0,1|2,0,0]=4 8716 B14R1.76 COc1ccnc(n1)SCCC(=O)C 62a_100000182009_100000053229 [1,0,0,0,0,1|2,0,0]=4 8717 B14R1.76 COc1cncc(c1)CNCC(=O)N 2230a_100020589029_100000747473 [1,0,0,0,0,1|2,0,0]=4 8718 B14R1.76 COc1cncc(c1)CNCC(=O)N 34a_100020589029_100000187820 [1,0,0,0,0,1|2,0,0]=4 8719 B14R1.76 COc1cncc(c1)CNCC(=O)[O-] 34a_100020589029_100020667443 [1,0,0,0,0,1|2,0,0]=4 8720 B14R1.76 COc1cncc(c1)COCC(=O)N 34a_100000732071_100000187820 [1,0,0,0,0,1|2,0,0]=4 8721 B14R1.76 COc1cncc(c1)COCC(=O)[O-] 34a_100000732071_100020667443 [1,0,0,0,0,1|2,0,0]=4 8722 B14R1.76 COc1cncc(c1)OCCC(=O)C 7a_100000084572_100000053229 [1,0,0,0,0,1|1,0,0]=3 8723 B14R1.76 COc1cncc(c1)OCCC(=O)N 34a_100000084572_100000731001 [1,0,0,0,0,1|2,0,0]=4 8724 B14R1.76 COc1cncc(c1)OCCC(=O)N 7a_100000084572_100000744528 [1,0,0,0,0,1|2,0,0]=4 8725 B14R1.76 COc1cncc(c1)OCOC(=O)C 34a_100000084572_100009813279 [1,0,0,0,0,1|2,0,0]=4 8726 B14R1.76 COc1cncc(c1)SCCC(=O)C 62a_100000050176_100000053229 [1,0,0,0,0,1|1,0,0]=3 8727 B14R1.76 COc1cncc(c1)SCCC(=O)C 62a_100000053229_100000050176 [1,0,0,0,0,1|1,0,0]=3 8728 B14R1.76 COc1cncc(c1)SCCC(=O)N 62a_100000050176_100000744528 [1,0,0,0,0,1|2,0,0]=4 8729 B14R1.76 COc1cncc(c1)SCCC(=O)N 62a_100000744528_100000050176 [1,0,0,0,0,1|2,0,0]=4 8730 B14R1.76 COc1cncc(c1)SCOC(=O)C 62a_100000050176_100000076356 [1,0,0,0,0,1|2,0,0]=4 8731 B14R1.76 COc1cncc(c1)SCOC(=O)C 62a_100000076356_100000050176 [1,0,0,0,0,1|2,0,0]=4 8732 B14R1.76 COc1cncc(n1)SCCC(=O)C 62a_100000053229_100000756030 [1,0,0,0,0,1|2,0,0]=4 8733 B14R1.76 COc1cncc(n1)SCCC(=O)C 62a_100000756030_100000053229 [1,0,0,0,0,1|2,0,0]=4 8734 B14R1.76 COc1cnnc(c1)SCCC(=O)C 62a_100000053229_100000087634 [1,0,0,0,0,1|2,0,0]=4 8735 B14R1.76 COc1nccc(n1)SCCC(=O)C 62a_100000053229_100000069072 [1,0,0,0,0,1|2,0,0]=4 8736 B14R1.76 COc1nccc(n1)SCCC(=O)C 62a_100000069072_100000053229 [1,0,0,0,0,1|2,0,0]=4 8737 B14R1.76 CSc1cccc(c1)NCCC(=O)N 2230a_100000210049_100000744528 [1,0,0,0,0,1|1,1,0]=4 8738 B14R1.76 CSc1cccc(c1)NCCC(=O)N 34a_100000210049_100000731001 [1,0,0,0,0,1|1,1,0]=4 8739 B14R1.76 CSc1cccc(c1)NCOC(=O)C 34a_100000210049_100009813279 [1,0,0,0,0,1|1,1,0]=4 8740 B14R1.76 CSc1cccc(c1)OCCC(=O)C 7a_100011265683_100000053229 [1,0,0,0,0,1|0,1,0]=3 8741 B14R1.76 CSc1cccc(c1)OCCC(=O)N 34a_100011265683_100000731001 [1,0,0,0,0,1|1,1,0]=4 8742 B14R1.76 CSc1cccc(c1)OCCC(=O)N 7a_100011265683_100000744528 [1,0,0,0,0,1|1,1,0]=4 8743 B14R1.76 CSc1cccc(c1)OCOC(=O)C 34a_100011265683_100009813279 [1,0,0,0,0,1|1,1,0]=4 8744 B14R1.76 CSc1cccc(c1)SCCC(=O)C 62a_100000053229_100011215954 [1,0,0,0,0,1|0,1,0]=3 8745 B14R1.76 CSc1cccc(c1)SCCC(=O)C 62a_100011215954_100000053229 [1,0,0,0,0,1|0,1,0]=3 8746 B14R1.76 CSc1cccc(c1)SCCC(=O)N 62a_100000744528_100011215954 [1,0,0,0,0,1|1,1,0]=4 8747 B14R1.76 CSc1cccc(c1)SCCC(=O)N 62a_100011215954_100000744528 [1,0,0,0,0,1|1,1,0]=4 8748 B14R1.76 CSc1cccc(c1)SCOC(=O)C 62a_100000076356_100011215954 [1,0,0,0,0,1|1,1,0]=4 8749 B14R1.76 CSc1cccc(c1)SCOC(=O)C 62a_100011215954_100000076356 [1,0,0,0,0,1|1,1,0]=4 8750 B14R1.76 CSc1cccc(n1)SCCC(=O)C 62a_100000053229_100011960944 [1,0,0,0,0,1|1,1,0]=4 8751 B14R1.76 CSc1cccc(n1)SCCC(=O)C 62a_100011960944_100000053229 [1,0,0,0,0,1|1,1,0]=4 8752 B14R1.76 CSc1ccnc(c1)SCCC(=O)C 62a_100000053229_100010883326 [1,0,0,0,0,1|1,1,0]=4 8753 B14R1.76 CSc1ccnc(c1)SCCC(=O)C 62a_100010883326_100000053229 [1,0,0,0,0,1|1,1,0]=4 8754 B14R1.76 CSc1cncc(c1)SCCC(=O)C 62a_100000053229_100009816972 [1,0,0,0,0,1|1,1,0]=4 8755 B14R1.76 CSc1cncc(c1)SCCC(=O)C 62a_100009816972_100000053229 [1,0,0,0,0,1|1,1,0]=4 8756 B14R1.76 [13CH3]C(=O)CCOc1cccc(c1)C#N 1458a_200011209032_200025704644 [1,0,0,0,0,1|2,0,0]=4 8757 B14R1.118 C=C(C)CSc1cccc(c1OC)O 62a_100000748629_100010234590 [0,0,0,0,1,1|2,0,0]=4 8758 B14R1.118 C=C(C)CSc1nccc(c1OC)O 62a_100000748629_100000104430 [0,0,0,0,1,1|2,0,0]=4 8759 B14R1.118 COc1c(cccc1CCC(=O)C)F 1458a_100000061530_200000210301 [0,0,0,0,1,1|1,0,0]=3 8760 B14R1.118 COc1c(cccc1CCC(=O)[13CH3])F 1458a_100000061530_200025704644 [0,0,0,0,1,1|1,0,0]=3 8761 B14R1.118 COc1c(cccc1CNC(=O)C)F 11a_100137345168_100015343762 [0,0,0,0,1,1|2,0,0]=4 8762 B14R1.118 COc1c(cccc1CNC(=O)C)F 1626a_100137345168_100015343762 [0,0,0,0,1,1|2,0,0]=4 8763 B14R1.118 COc1c(cccc1CNC(=O)C)F 240690a_100137345168_100015343762 [0,0,0,0,1,1|2,0,0]=4 8764 B14R1.118 COc1c(cccc1CNC(=O)C)F 527a_100137345168_100103153847 [0,0,0,0,1,1|2,0,0]=4 8765 B14R1.118 COc1c(cccc1SCC(=O)N)O 62a_100000747473_100010234590 [0,0,0,0,1,1|2,0,0]=4 8766 B14R1.118 COc1c(cccc1SCC(=O)[O-])O 62a_100020667443_100010234590 [0,0,0,0,1,1|2,0,0]=4 8767 B14R1.118 COc1c(ccnc1SCC(=O)N)O 62a_100000747473_100000104430 [0,0,0,0,1,1|2,0,0]=4 8768 B14R1.118 COc1c(ccnc1SCC(=O)[O-])O 62a_100020667443_100000104430 [0,0,0,0,1,1|2,0,0]=4 8769 B14R1.1600 C=C(C)CNc1ccc(cc1OC)O 34a_100015326901_100000748629 [0,0,0,0,1,1|2,0,0]=4 8770 B14R1.1600 C=C(C)CSc1ccc(cc1OC)O 62a_100000748629_100011827694 [0,0,0,0,1,1|2,0,0]=4 8771 B14R1.1600 COc1cc(ccc1CCC(=O)C)Br 1458a_100000699604_200000210301 [0,0,0,0,1,1|1,0,0]=3 8772 B14R1.1600 COc1cc(ccc1CCC(=O)[13CH3])Br 1458a_100000699604_200025704644 [0,0,0,0,1,1|1,0,0]=3 8773 B14R1.1600 COc1cc(ccc1CNC(=O)C)F 11a_100000062129_100015343762 [0,0,0,0,1,1|2,0,0]=4 8774 B14R1.1600 COc1cc(ccc1CNC(=O)C)F 1626a_100000062129_100015343762 [0,0,0,0,1,1|2,0,0]=4 8775 B14R1.1600 COc1cc(ccc1CNC(=O)C)F 240690a_100000062129_100015343762 [0,0,0,0,1,1|2,0,0]=4 8776 B14R1.1600 COc1cc(ccc1CNC(=O)C)F 527a_100000062129_100103153847 [0,0,0,0,1,1|2,0,0]=4 8777 B14R1.1600 COc1cc(ccc1NCC(=O)N)O 34a_100015326901_100000187820 [0,0,0,0,1,1|2,0,0]=4 8778 B14R1.1600 COc1cc(ccc1NCC(=O)[O-])O 34a_100015326901_100020667443 [0,0,0,0,1,1|2,0,0]=4 8779 B14R1.1600 COc1cc(ccc1OCC(=O)C)C 1458a_100000183895_200000210301 [0,0,0,0,1,1|2,0,0]=4 8780 B14R1.1600 COc1cc(ccc1OCC(=O)[13CH3])C 1458a_100000183895_200025704644 [0,0,0,0,1,1|2,0,0]=4 8781 B14R1.1600 COc1cc(ccc1SCC(=O)N)O 62a_100000747473_100011827694 [0,0,0,0,1,1|2,0,0]=4 8782 B14R1.1600 COc1cc(ccc1SCC(=O)[O-])O 62a_100020667443_100011827694 [0,0,0,0,1,1|2,0,0]=4 8783 B14R1.1600 COc1nc(ccc1CNC(=O)C)Cl 11a_100015687481_100015343762 [0,0,0,0,1,1|2,0,0]=4 8784 B14R1.1600 COc1nc(ccc1CNC(=O)C)Cl 1626a_100015687481_100015343762 [0,0,0,0,1,1|2,0,0]=4 8785 B14R1.1600 COc1nc(ccc1CNC(=O)C)Cl 240690a_100015687481_100015343762 [0,0,0,0,1,1|2,0,0]=4 8786 B14R1.1600 COc1nc(ccc1CNC(=O)C)Cl 527a_100015687481_100103153847 [0,0,0,0,1,1|2,0,0]=4 8787 B16R1.4707 C=C(C)CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000730704 [0,0,0,0,0,2|2,0,0]=4 8788 B16R1.4707 C=C(C)CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000730704 [0,0,0,0,0,2|2,0,0]=4 8789 B16R1.4707 C=C(C)CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000730704 [0,0,0,0,0,2|2,0,0]=4 8790 B16R1.4707 C=C(C)CCNCc1ccc(c(c1)OC)F 34a_100020626639_100000730704 [0,0,0,0,0,2|2,0,0]=4 8791 B16R1.4707 C=C(C)CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000730704 [0,0,0,0,0,2|1,0,0]=3 8792 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)Br 34a_100000764851_100010110085 [0,0,0,0,0,2|2,0,0]=4 8793 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000730704 [0,0,0,0,0,2|2,0,0]=4 8794 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000730704 [0,0,0,0,0,2|2,0,0]=4 8795 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)C 34a_100000752651_100000730704 [0,0,0,0,0,2|2,0,0]=4 8796 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)C 7a_100000752651_100000730704 [0,0,0,0,0,2|2,0,0]=4 8797 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)Cl 34a_100000764851_200010214485 [0,0,0,0,0,2|2,0,0]=4 8798 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000730704 [0,0,0,0,0,2|2,0,0]=4 8799 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)F 34a_100000692429_100000730704 [0,0,0,0,0,2|2,0,0]=4 8800 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)F 34a_100000764851_100012349856 [0,0,0,0,0,2|2,0,0]=4 8801 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)F 7a_100000692429_100000730704 [0,0,0,0,0,2|2,0,0]=4 8802 B16R1.4707 C=C(C)CCOCc1ccc(c(c1)OC)N 34a_100000087641_100000730704 [0,0,0,0,0,2|2,0,0]=4 8803 B16R1.4707 C=C(C)CCSCc1ccc(c(c1)OC)Br 62a_100000730704_100010110085 [0,0,0,0,0,2|2,0,0]=4 8804 B16R1.4707 C=C(C)CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000730704 [0,0,0,0,0,2|2,0,0]=4 8805 B16R1.4707 C=C(C)CCSCc1ccc(c(c1)OC)Cl 62a_100000730704_200010214485 [0,0,0,0,0,2|2,0,0]=4 8806 B16R1.4707 C=C(C)CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000730704 [0,0,0,0,0,2|2,0,0]=4 8807 B16R1.4707 C=C(C)CCSCc1ccc(c(c1)OC)F 62a_100000730704_100012349856 [0,0,0,0,0,2|2,0,0]=4 8808 B16R1.4707 C=C(C)CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000730704 [0,0,0,0,0,2|2,0,0]=4 8809 B16R1.4707 C=C(C)CNCCc1ccc(c(c1)OC)O 34a_100000756042_100000748629 [0,0,0,0,0,2|1,0,0]=3 8810 B16R1.4707 C=C(C)CSCCc1ccc(c(c1)OC)O 62a_100000748629_100010741665 [0,0,0,0,0,2|1,0,0]=3 8811 B16R1.4707 C=C(F)CNCCc1ccc(c(c1)OC)O 34a_100000756042_100009893438 [0,0,0,0,0,2|1,0,1]=4 8812 B16R1.4707 C=C(F)CSCCc1ccc(c(c1)OC)O 62a_100000042424_100010741665 [0,0,0,0,0,2|1,0,1]=4 8813 B16R1.4707 CC(=O)CCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000685027 [0,0,0,0,0,2|2,0,0]=4 8814 B16R1.4707 CC(=O)CCCSc1ccc(c(c1)C#N)O 62a_100011215641_100000687585 [0,0,0,0,0,2|2,0,0]=4 8815 B16R1.4707 CC(=O)CCCSc1ccc(c(c1)C=O)O 62a_100011215641_100000186750 [0,0,0,0,0,2|2,0,0]=4 8816 B16R1.4707 CC(=O)CCCSc1ccc(c(c1)CN)O 62a_100000730032_100011215641 [0,0,0,0,0,2|2,0,0]=4 8817 B16R1.4707 CC(=O)CCCSc1ccc(c(c1)CN)O 62a_100011215641_100000730032 [0,0,0,0,0,2|2,0,0]=4 8818 B16R1.4707 CC(=O)CCCSc1ccc(c(c1)CO)O 62a_100000184703_100011215641 [0,0,0,0,0,2|2,0,0]=4 8819 B16R1.4707 CC(=O)CCCSc1ccc(c(c1)CO)O 62a_100011215641_100000184703 [0,0,0,0,0,2|2,0,0]=4 8820 B16R1.4707 CC(=O)CCOCc1ccc(c(c1)C=O)O 7a_100000759926_100000008128 [0,0,0,0,0,2|2,0,0]=4 8821 B16R1.4707 CC(=O)CCSCc1ccc(c(c1)C=O)O 62a_100000053229_100000008128 [0,0,0,0,0,2|2,0,0]=4 8822 B16R1.4707 CC(=O)NCCSc1ccc(c(c1)C#N)O 62a_100000189650_100000687585 [0,0,0,0,0,2|2,0,0]=4 8823 B16R1.4707 CC(=O)NCCSc1ccc(c(c1)C=O)O 62a_100000189650_100000186750 [0,0,0,0,0,2|2,0,0]=4 8824 B16R1.4707 CC(=O)NCCSc1ccc(c(c1)CN)O 62a_100000189650_100000730032 [0,0,0,0,0,2|2,0,0]=4 8825 B16R1.4707 CC(=O)NCCSc1ccc(c(c1)CN)O 62a_100000730032_100000189650 [0,0,0,0,0,2|2,0,0]=4 8826 B16R1.4707 CC(=O)NCCSc1ccc(c(c1)CO)O 62a_100000184703_100000189650 [0,0,0,0,0,2|2,0,0]=4 8827 B16R1.4707 CC(=O)NCCSc1ccc(c(c1)CO)O 62a_100000189650_100000184703 [0,0,0,0,0,2|2,0,0]=4 8828 B16R1.4707 CC(=O)OCCNc1ccc(c(c1)C#N)O 34a_100011249283_100009814007 [0,0,0,0,0,2|2,0,0]=4 8829 B16R1.4707 CC(=O)OCCSc1ccc(c(c1)C#N)O 62a_100009814007_100000687585 [0,0,0,0,0,2|2,0,0]=4 8830 B16R1.4707 CC(=O)OCCSc1ccc(c(c1)C=O)O 62a_100009814007_100000186750 [0,0,0,0,0,2|2,0,0]=4 8831 B16R1.4707 CC(=O)OCCSc1ccc(c(c1)CN)O 62a_100000730032_100009814007 [0,0,0,0,0,2|2,0,0]=4 8832 B16R1.4707 CC(=O)OCCSc1ccc(c(c1)CN)O 62a_100009814007_100000730032 [0,0,0,0,0,2|2,0,0]=4 8833 B16R1.4707 CC(=O)OCCSc1ccc(c(c1)CO)O 62a_100000184703_100009814007 [0,0,0,0,0,2|2,0,0]=4 8834 B16R1.4707 CC(=O)OCCSc1ccc(c(c1)CO)O 62a_100009814007_100000184703 [0,0,0,0,0,2|2,0,0]=4 8835 B16R1.4707 CC(=O)OCSCc1ccc(c(c1)C=O)O 62a_100000076356_100000008128 [0,0,0,0,0,2|2,0,0]=4 8836 B16R1.4707 CCc1cc(ccc1Br)NCCCC(=O)C 34a_100010109747_100000685027 [0,0,0,0,0,2|2,0,0]=4 8837 B16R1.4707 CCc1cc(ccc1Br)NCCCC(=O)C 7a_100010109747_100011215641 [0,0,0,0,0,2|2,0,0]=4 8838 B16R1.4707 CCc1cc(ccc1Br)NCCNC(=O)C 2230a_100010109747_100000189650 [0,0,0,0,0,2|2,0,0]=4 8839 B16R1.4707 CCc1cc(ccc1Br)NCCNC(=O)C 7a_100010109747_100000189650 [0,0,0,0,0,2|2,0,0]=4 8840 B16R1.4707 CCc1cc(ccc1Br)NCCOC(=O)C 34a_100010109747_100009814007 [0,0,0,0,0,2|2,0,0]=4 8841 B16R1.4707 CCc1cc(ccc1Br)NCCOC(=O)C 7a_100010109747_100009814007 [0,0,0,0,0,2|2,0,0]=4 8842 B16R1.4707 CCc1cc(ccc1Br)SCCCC(=O)C 62a_100010244631_100011215641 [0,0,0,0,0,2|2,0,0]=4 8843 B16R1.4707 CCc1cc(ccc1Br)SCCCC(=O)C 62a_100011215641_100010244631 [0,0,0,0,0,2|2,0,0]=4 8844 B16R1.4707 CCc1cc(ccc1Br)SCCNC(=O)C 62a_100000189650_100010244631 [0,0,0,0,0,2|2,0,0]=4 8845 B16R1.4707 CCc1cc(ccc1Br)SCCNC(=O)C 62a_100010244631_100000189650 [0,0,0,0,0,2|2,0,0]=4 8846 B16R1.4707 CCc1cc(ccc1Br)SCCOC(=O)C 62a_100009814007_100010244631 [0,0,0,0,0,2|2,0,0]=4 8847 B16R1.4707 CCc1cc(ccc1Br)SCCOC(=O)C 62a_100010244631_100009814007 [0,0,0,0,0,2|2,0,0]=4 8848 B16R1.4707 CCc1cc(ccc1Cl)OCCCC(=O)C 34a_100000212063_100000685027 [0,0,0,0,0,2|2,0,0]=4 8849 B16R1.4707 CCc1cc(ccc1Cl)OCCCC(=O)C 7a_100000212063_100011215641 [0,0,0,0,0,2|2,0,0]=4 8850 B16R1.4707 CCc1cc(ccc1Cl)OCCNC(=O)C 7a_100000212063_100000189650 [0,0,0,0,0,2|2,0,0]=4 8851 B16R1.4707 CCc1cc(ccc1Cl)OCCOC(=O)C 34a_100000212063_100009814007 [0,0,0,0,0,2|2,0,0]=4 8852 B16R1.4707 CCc1cc(ccc1Cl)OCCOC(=O)C 7a_100000212063_100009814007 [0,0,0,0,0,2|2,0,0]=4 8853 B16R1.4707 CCc1cc(ccc1F)CNCOC(=O)C 34a_114873767189_100009813279 [0,0,0,0,0,2|2,0,0]=4 8854 B16R1.4707 CCc1cc(ccc1F)SCCCC(=O)C 62a_100010244625_100011215641 [0,0,0,0,0,2|2,0,0]=4 8855 B16R1.4707 CCc1cc(ccc1F)SCCCC(=O)C 62a_100011215641_100010244625 [0,0,0,0,0,2|2,0,0]=4 8856 B16R1.4707 CCc1cc(ccc1F)SCCNC(=O)C 62a_100000189650_100010244625 [0,0,0,0,0,2|2,0,0]=4 8857 B16R1.4707 CCc1cc(ccc1F)SCCNC(=O)C 62a_100010244625_100000189650 [0,0,0,0,0,2|2,0,0]=4 8858 B16R1.4707 CCc1cc(ccc1F)SCCOC(=O)C 62a_100009814007_100010244625 [0,0,0,0,0,2|2,0,0]=4 8859 B16R1.4707 CCc1cc(ccc1F)SCCOC(=O)C 62a_100010244625_100009814007 [0,0,0,0,0,2|2,0,0]=4 8860 B16R1.4707 CCc1cc(ccc1N)SCCCC(=O)C 62a_100000686106_100011215641 [0,0,0,0,0,2|2,0,0]=4 8861 B16R1.4707 CCc1cc(ccc1N)SCCCC(=O)C 62a_100011215641_100000686106 [0,0,0,0,0,2|2,0,0]=4 8862 B16R1.4707 CCc1cc(ccc1N)SCCNC(=O)C 62a_100000189650_100000686106 [0,0,0,0,0,2|2,0,0]=4 8863 B16R1.4707 CCc1cc(ccc1N)SCCNC(=O)C 62a_100000686106_100000189650 [0,0,0,0,0,2|2,0,0]=4 8864 B16R1.4707 CCc1cc(ccc1N)SCCOC(=O)C 62a_100000686106_100009814007 [0,0,0,0,0,2|2,0,0]=4 8865 B16R1.4707 CCc1cc(ccc1N)SCCOC(=O)C 62a_100009814007_100000686106 [0,0,0,0,0,2|2,0,0]=4 8866 B16R1.4707 CCc1cc(ccc1O)C=CCOC(=O)C 271570a_200000047263_100012338938 [0,0,0,0,0,2|1,0,1]=4 8867 B16R1.4707 CCc1cc(ccc1O)SCCC=C(C)C 62a_100011217483_100012338938 [0,0,0,0,0,2|2,0,0]=4 8868 B16R1.4707 CCc1cc(ccc1O)SCCCC(=O)C 62a_100011215641_100012338938 [0,0,0,0,0,2|1,0,0]=3 8869 B16R1.4707 CCc1cc(ccc1O)SCCCC(=O)N 62a_100102525003_100012338938 [0,0,0,0,0,2|2,0,0]=4 8870 B16R1.4707 CCc1cc(ccc1O)SCCNC(=O)C 62a_100000189650_100012338938 [0,0,0,0,0,2|1,0,0]=3 8871 B16R1.4707 CCc1cc(ccc1O)SCCNC(=O)N 62a_200000034859_100012338938 [0,0,0,0,0,2|2,0,0]=4 8872 B16R1.4707 CCc1cc(ccc1O)SCCOC(=O)C 62a_100009814007_100012338938 [0,0,0,0,0,2|1,0,0]=3 8873 B16R1.4707 CCc1cc(ccc1O)SCCOC(=O)N 62a_200011214921_100012338938 [0,0,0,0,0,2|2,0,0]=4 8874 B16R1.4707 CNc1cc(ccc1C)SCCCC(=O)C 62a_100011215641_100020629602 [0,0,0,0,0,2|2,0,0]=4 8875 B16R1.4707 CNc1cc(ccc1C)SCCCC(=O)C 62a_100020629602_100011215641 [0,0,0,0,0,2|2,0,0]=4 8876 B16R1.4707 CNc1cc(ccc1C)SCCNC(=O)C 62a_100000189650_100020629602 [0,0,0,0,0,2|2,0,0]=4 8877 B16R1.4707 CNc1cc(ccc1C)SCCNC(=O)C 62a_100020629602_100000189650 [0,0,0,0,0,2|2,0,0]=4 8878 B16R1.4707 CNc1cc(ccc1C)SCCOC(=O)C 62a_100009814007_100020629602 [0,0,0,0,0,2|2,0,0]=4 8879 B16R1.4707 CNc1cc(ccc1C)SCCOC(=O)C 62a_100020629602_100009814007 [0,0,0,0,0,2|2,0,0]=4 8880 B16R1.4707 CNc1cc(ccc1F)SCCCC(=O)C 62a_100011215641_100011314990 [0,0,0,0,0,2|2,0,0]=4 8881 B16R1.4707 CNc1cc(ccc1F)SCCCC(=O)C 62a_100011314990_100011215641 [0,0,0,0,0,2|2,0,0]=4 8882 B16R1.4707 CNc1cc(ccc1F)SCCNC(=O)C 62a_100000189650_100011314990 [0,0,0,0,0,2|2,0,0]=4 8883 B16R1.4707 CNc1cc(ccc1F)SCCNC(=O)C 62a_100011314990_100000189650 [0,0,0,0,0,2|2,0,0]=4 8884 B16R1.4707 CNc1cc(ccc1F)SCCOC(=O)C 62a_100009814007_100011314990 [0,0,0,0,0,2|2,0,0]=4 8885 B16R1.4707 CNc1cc(ccc1F)SCCOC(=O)C 62a_100011314990_100009814007 [0,0,0,0,0,2|2,0,0]=4 8886 B16R1.4707 CNc1cc(ccc1N)SCCCC(=O)C 62a_100000694363_100011215641 [0,0,0,0,0,2|2,0,0]=4 8887 B16R1.4707 CNc1cc(ccc1N)SCCNC(=O)C 62a_100000694363_100000189650 [0,0,0,0,0,2|2,0,0]=4 8888 B16R1.4707 CNc1cc(ccc1N)SCCOC(=O)C 62a_100000694363_100009814007 [0,0,0,0,0,2|2,0,0]=4 8889 B16R1.4707 COc1cc(c[nH]c1=O)SCCCC(=O)C 62a_100011215641_100010125397 [0,0,0,0,0,2|1,0,1]=4 8890 B16R1.4707 COc1cc(c[nH]c1=O)SCCNC(=O)C 62a_100000189650_100010125397 [0,0,0,0,0,2|1,0,1]=4 8891 B16R1.4707 COc1cc(c[nH]c1=O)SCCOC(=O)C 62a_100009814007_100010125397 [0,0,0,0,0,2|1,0,1]=4 8892 B16R1.4707 COc1cc(ccc1Br)C=CCOC(=O)C 271570a_200000047263_100012353699 [0,0,0,0,0,2|1,0,1]=4 8893 B16R1.4707 COc1cc(ccc1Br)CNCC=C(C)C 270004a_100000718196_100010244714 [0,0,0,0,0,2|2,0,0]=4 8894 B16R1.4707 COc1cc(ccc1Br)CNCC=C(C)C 34a_100000718196_100010110085 [0,0,0,0,0,2|2,0,0]=4 8895 B16R1.4707 COc1cc(ccc1Br)CNCCC(=O)N 207a_100000740010_100010244714 [0,0,0,0,0,2|2,0,0]=4 8896 B16R1.4707 COc1cc(ccc1Br)CNOCC(=O)O 269956a_100000106656_100010110085 [0,0,0,0,0,2|2,0,0]=4 8897 B16R1.4707 COc1cc(ccc1Br)COCC=C(C)C 34a_100000753907_100010110085 [0,0,0,0,0,2|2,0,0]=4 8898 B16R1.4707 COc1cc(ccc1Br)COCC=C(C)C 34a_100010234685_100000761012 [0,0,0,0,0,2|2,0,0]=4 8899 B16R1.4707 COc1cc(ccc1Br)COCC=C(C)C 7a_100010234685_100000761012 [0,0,0,0,0,2|2,0,0]=4 8900 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)C 34a_100000759926_100010110085 [0,0,0,0,0,2|1,0,0]=3 8901 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)C 7a_100000759926_100010110085 [0,0,0,0,0,2|1,0,0]=3 8902 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)C 7a_100010234685_100000053229 [0,0,0,0,0,2|1,0,0]=3 8903 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)N 34a_100000757172_100010110085 [0,0,0,0,0,2|2,0,0]=4 8904 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)N 34a_100010234685_100000731001 [0,0,0,0,0,2|2,0,0]=4 8905 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)N 7a_100000757172_100010110085 [0,0,0,0,0,2|2,0,0]=4 8906 B16R1.4707 COc1cc(ccc1Br)COCCC(=O)N 7a_100010234685_100000744528 [0,0,0,0,0,2|2,0,0]=4 8907 B16R1.4707 COc1cc(ccc1Br)COCOC(=O)C 34a_100010234685_100009813279 [0,0,0,0,0,2|1,0,0]=3 8908 B16R1.4707 COc1cc(ccc1Br)CSCC=C(C)C 62a_100000761012_100010110085 [0,0,0,0,0,2|2,0,0]=4 8909 B16R1.4707 COc1cc(ccc1Br)CSCC=C(C)C 62a_100010110085_100000761012 [0,0,0,0,0,2|2,0,0]=4 8910 B16R1.4707 COc1cc(ccc1Br)CSCCC(=O)C 62a_100000053229_100010110085 [0,0,0,0,0,2|1,0,0]=3 8911 B16R1.4707 COc1cc(ccc1Br)CSCCC(=O)C 62a_100010110085_100000053229 [0,0,0,0,0,2|1,0,0]=3 8912 B16R1.4707 COc1cc(ccc1Br)CSCCC(=O)N 62a_100000744528_100010110085 [0,0,0,0,0,2|2,0,0]=4 8913 B16R1.4707 COc1cc(ccc1Br)CSCCC(=O)N 62a_100010110085_100000744528 [0,0,0,0,0,2|2,0,0]=4 8914 B16R1.4707 COc1cc(ccc1Br)CSCOC(=O)C 62a_100000076356_100010110085 [0,0,0,0,0,2|1,0,0]=3 8915 B16R1.4707 COc1cc(ccc1Br)CSCOC(=O)C 62a_100010110085_100000076356 [0,0,0,0,0,2|1,0,0]=3 8916 B16R1.4707 COc1cc(ccc1Br)NCCC=C(C)C 2230a_100000765947_100011217483 [0,0,0,0,0,2|2,0,0]=4 8917 B16R1.4707 COc1cc(ccc1Br)NCCC=C(C)C 34a_100000765947_100011217483 [0,0,0,0,0,2|2,0,0]=4 8918 B16R1.4707 COc1cc(ccc1Br)NCCCC(=O)C 34a_100000765947_100000685027 [0,0,0,0,0,2|1,0,0]=3 8919 B16R1.4707 COc1cc(ccc1Br)NCCCC(=O)N 34a_100000765947_100102525003 [0,0,0,0,0,2|2,0,0]=4 8920 B16R1.4707 COc1cc(ccc1Br)NCCNC(=O)C 2230a_100000765947_100000189650 [0,0,0,0,0,2|1,0,0]=3 8921 B16R1.4707 COc1cc(ccc1Br)NCCNC(=O)N 2230a_100000765947_200000034859 [0,0,0,0,0,2|2,0,0]=4 8922 B16R1.4707 COc1cc(ccc1Br)NCCOC(=O)C 34a_100000765947_100009814007 [0,0,0,0,0,2|1,0,0]=3 8923 B16R1.4707 COc1cc(ccc1Br)NCCOC(=O)N 34a_100000765947_200011214921 [0,0,0,0,0,2|2,0,0]=4 8924 B16R1.4707 COc1cc(ccc1Br)OCCC=C(C)C 34a_100011827694_100011217483 [0,0,0,0,0,2|2,0,0]=4 8925 B16R1.4707 COc1cc(ccc1Br)OCCC=C(C)C 7a_100011827694_100011217483 [0,0,0,0,0,2|2,0,0]=4 8926 B16R1.4707 COc1cc(ccc1Br)OCCCC(=O)C 34a_100011827694_100000685027 [0,0,0,0,0,2|1,0,0]=3 8927 B16R1.4707 COc1cc(ccc1Br)OCCCC(=O)C 7a_100011827694_100011215641 [0,0,0,0,0,2|1,0,0]=3 8928 B16R1.4707 COc1cc(ccc1Br)OCCCC(=O)N 34a_100011827694_100102525003 [0,0,0,0,0,2|2,0,0]=4 8929 B16R1.4707 COc1cc(ccc1Br)OCCCC(=O)N 7a_100011827694_100102525003 [0,0,0,0,0,2|2,0,0]=4 8930 B16R1.4707 COc1cc(ccc1Br)OCCNC(=O)C 7a_100011827694_100000189650 [0,0,0,0,0,2|1,0,0]=3 8931 B16R1.4707 COc1cc(ccc1Br)OCCNC(=O)N 7a_100011827694_200000034859 [0,0,0,0,0,2|2,0,0]=4 8932 B16R1.4707 COc1cc(ccc1Br)OCCOC(=O)C 34a_100011827694_100009814007 [0,0,0,0,0,2|1,0,0]=3 8933 B16R1.4707 COc1cc(ccc1Br)OCCOC(=O)C 7a_100011827694_100009814007 [0,0,0,0,0,2|1,0,0]=3 8934 B16R1.4707 COc1cc(ccc1Br)OCCOC(=O)N 34a_100011827694_200011214921 [0,0,0,0,0,2|2,0,0]=4 8935 B16R1.4707 COc1cc(ccc1Br)OCCOC(=O)N 7a_100011827694_200011214921 [0,0,0,0,0,2|2,0,0]=4 8936 B16R1.4707 COc1cc(ccc1Br)SCCC=C(C)C 62a_100011217483_100012353699 [0,0,0,0,0,2|2,0,0]=4 8937 B16R1.4707 COc1cc(ccc1Br)SCCC=C(C)C 62a_100012353699_100011217483 [0,0,0,0,0,2|2,0,0]=4 8938 B16R1.4707 COc1cc(ccc1Br)SCCCC(=O)C 62a_100011215641_100012353699 [0,0,0,0,0,2|1,0,0]=3 8939 B16R1.4707 COc1cc(ccc1Br)SCCCC(=O)C 62a_100012353699_100011215641 [0,0,0,0,0,2|1,0,0]=3 8940 B16R1.4707 COc1cc(ccc1Br)SCCCC(=O)N 62a_100012353699_100102525003 [0,0,0,0,0,2|2,0,0]=4 8941 B16R1.4707 COc1cc(ccc1Br)SCCCC(=O)N 62a_100102525003_100012353699 [0,0,0,0,0,2|2,0,0]=4 8942 B16R1.4707 COc1cc(ccc1Br)SCCNC(=O)C 62a_100000189650_100012353699 [0,0,0,0,0,2|1,0,0]=3 8943 B16R1.4707 COc1cc(ccc1Br)SCCNC(=O)C 62a_100012353699_100000189650 [0,0,0,0,0,2|1,0,0]=3 8944 B16R1.4707 COc1cc(ccc1Br)SCCNC(=O)N 62a_100012353699_200000034859 [0,0,0,0,0,2|2,0,0]=4 8945 B16R1.4707 COc1cc(ccc1Br)SCCNC(=O)N 62a_200000034859_100012353699 [0,0,0,0,0,2|2,0,0]=4 8946 B16R1.4707 COc1cc(ccc1Br)SCCOC(=O)C 62a_100009814007_100012353699 [0,0,0,0,0,2|1,0,0]=3 8947 B16R1.4707 COc1cc(ccc1Br)SCCOC(=O)C 62a_100012353699_100009814007 [0,0,0,0,0,2|1,0,0]=3 8948 B16R1.4707 COc1cc(ccc1Br)SCCOC(=O)N 62a_100012353699_200011214921 [0,0,0,0,0,2|2,0,0]=4 8949 B16R1.4707 COc1cc(ccc1Br)SCCOC(=O)N 62a_200011214921_100012353699 [0,0,0,0,0,2|2,0,0]=4 8950 B16R1.4707 COc1cc(ccc1C)C=CCOC(=O)C 271570a_200000047263_100011830276 [0,0,0,0,0,2|1,0,1]=4 8951 B16R1.4707 COc1cc(ccc1C)CNCC=C(C)C 270004a_100000718196_100000719150 [0,0,0,0,0,2|2,0,0]=4 8952 B16R1.4707 COc1cc(ccc1C)CNCCC(=O)N 207a_100000740010_100000719150 [0,0,0,0,0,2|2,0,0]=4 8953 B16R1.4707 COc1cc(ccc1C)COCC=C(C)C 34a_100000752651_100000761012 [0,0,0,0,0,2|2,0,0]=4 8954 B16R1.4707 COc1cc(ccc1C)COCC=C(C)C 7a_100000752651_100000761012 [0,0,0,0,0,2|2,0,0]=4 8955 B16R1.4707 COc1cc(ccc1C)COCCC(=O)C 7a_100000752651_100000053229 [0,0,0,0,0,2|1,0,0]=3 8956 B16R1.4707 COc1cc(ccc1C)COCCC(=O)N 34a_100000752651_100000731001 [0,0,0,0,0,2|2,0,0]=4 8957 B16R1.4707 COc1cc(ccc1C)COCCC(=O)N 7a_100000752651_100000744528 [0,0,0,0,0,2|2,0,0]=4 8958 B16R1.4707 COc1cc(ccc1C)COCOC(=O)C 34a_100000752651_100009813279 [0,0,0,0,0,2|1,0,0]=3 8959 B16R1.4707 COc1cc(ccc1C)NCCC=C(C)C 2230a_100011279678_100011217483 [0,0,0,0,0,2|2,0,0]=4 8960 B16R1.4707 COc1cc(ccc1C)NCCC=C(C)C 34a_100011279678_100011217483 [0,0,0,0,0,2|2,0,0]=4 8961 B16R1.4707 COc1cc(ccc1C)NCCCC(=O)C 34a_100011279678_100000685027 [0,0,0,0,0,2|1,0,0]=3 8962 B16R1.4707 COc1cc(ccc1C)NCCCC(=O)N 34a_100011279678_100102525003 [0,0,0,0,0,2|2,0,0]=4 8963 B16R1.4707 COc1cc(ccc1C)NCCNC(=O)C 2230a_100011279678_100000189650 [0,0,0,0,0,2|1,0,0]=3 8964 B16R1.4707 COc1cc(ccc1C)NCCNC(=O)N 2230a_100011279678_200000034859 [0,0,0,0,0,2|2,0,0]=4 8965 B16R1.4707 COc1cc(ccc1C)NCCOC(=O)C 34a_100011279678_100009814007 [0,0,0,0,0,2|1,0,0]=3 8966 B16R1.4707 COc1cc(ccc1C)NCCOC(=O)N 34a_100011279678_200011214921 [0,0,0,0,0,2|2,0,0]=4 8967 B16R1.4707 COc1cc(ccc1C)OCCC=C(C)C 34a_100009865632_100011217483 [0,0,0,0,0,2|2,0,0]=4 8968 B16R1.4707 COc1cc(ccc1C)OCCC=C(C)C 7a_100009865632_100011217483 [0,0,0,0,0,2|2,0,0]=4 8969 B16R1.4707 COc1cc(ccc1C)OCCCC(=O)C 34a_100009865632_100000685027 [0,0,0,0,0,2|1,0,0]=3 8970 B16R1.4707 COc1cc(ccc1C)OCCCC(=O)C 7a_100009865632_100011215641 [0,0,0,0,0,2|1,0,0]=3 8971 B16R1.4707 COc1cc(ccc1C)OCCCC(=O)N 34a_100009865632_100102525003 [0,0,0,0,0,2|2,0,0]=4 8972 B16R1.4707 COc1cc(ccc1C)OCCCC(=O)N 7a_100009865632_100102525003 [0,0,0,0,0,2|2,0,0]=4 8973 B16R1.4707 COc1cc(ccc1C)OCCNC(=O)C 7a_100009865632_100000189650 [0,0,0,0,0,2|1,0,0]=3 8974 B16R1.4707 COc1cc(ccc1C)OCCNC(=O)N 7a_100009865632_200000034859 [0,0,0,0,0,2|2,0,0]=4 8975 B16R1.4707 COc1cc(ccc1C)OCCOC(=O)C 34a_100009865632_100009814007 [0,0,0,0,0,2|1,0,0]=3 8976 B16R1.4707 COc1cc(ccc1C)OCCOC(=O)C 7a_100009865632_100009814007 [0,0,0,0,0,2|1,0,0]=3 8977 B16R1.4707 COc1cc(ccc1C)OCCOC(=O)N 34a_100009865632_200011214921 [0,0,0,0,0,2|2,0,0]=4 8978 B16R1.4707 COc1cc(ccc1C)OCCOC(=O)N 7a_100009865632_200011214921 [0,0,0,0,0,2|2,0,0]=4 8979 B16R1.4707 COc1cc(ccc1C)SCCC=C(C)C 62a_100011217483_100011830276 [0,0,0,0,0,2|2,0,0]=4 8980 B16R1.4707 COc1cc(ccc1C)SCCC=C(C)C 62a_100011830276_100011217483 [0,0,0,0,0,2|2,0,0]=4 8981 B16R1.4707 COc1cc(ccc1C)SCCCC(=O)C 62a_100011215641_100011830276 [0,0,0,0,0,2|1,0,0]=3 8982 B16R1.4707 COc1cc(ccc1C)SCCCC(=O)C 62a_100011830276_100011215641 [0,0,0,0,0,2|1,0,0]=3 8983 B16R1.4707 COc1cc(ccc1C)SCCCC(=O)N 62a_100011830276_100102525003 [0,0,0,0,0,2|2,0,0]=4 8984 B16R1.4707 COc1cc(ccc1C)SCCCC(=O)N 62a_100102525003_100011830276 [0,0,0,0,0,2|2,0,0]=4 8985 B16R1.4707 COc1cc(ccc1C)SCCNC(=O)C 62a_100000189650_100011830276 [0,0,0,0,0,2|1,0,0]=3 8986 B16R1.4707 COc1cc(ccc1C)SCCNC(=O)C 62a_100011830276_100000189650 [0,0,0,0,0,2|1,0,0]=3 8987 B16R1.4707 COc1cc(ccc1C)SCCNC(=O)N 62a_100011830276_200000034859 [0,0,0,0,0,2|2,0,0]=4 8988 B16R1.4707 COc1cc(ccc1C)SCCNC(=O)N 62a_200000034859_100011830276 [0,0,0,0,0,2|2,0,0]=4 8989 B16R1.4707 COc1cc(ccc1C)SCCOC(=O)C 62a_100009814007_100011830276 [0,0,0,0,0,2|1,0,0]=3 8990 B16R1.4707 COc1cc(ccc1C)SCCOC(=O)C 62a_100011830276_100009814007 [0,0,0,0,0,2|1,0,0]=3 8991 B16R1.4707 COc1cc(ccc1C)SCCOC(=O)N 62a_100011830276_200011214921 [0,0,0,0,0,2|2,0,0]=4 8992 B16R1.4707 COc1cc(ccc1C)SCCOC(=O)N 62a_200011214921_100011830276 [0,0,0,0,0,2|2,0,0]=4 8993 B16R1.4707 COc1cc(ccc1Cl)C=CCOC(=O)C 271570a_200000047263_100011356853 [0,0,0,0,0,2|1,0,1]=4 8994 B16R1.4707 COc1cc(ccc1Cl)CNCC=C(C)C 2230a_100015204853_100000761012 [0,0,0,0,0,2|2,0,0]=4 8995 B16R1.4707 COc1cc(ccc1Cl)CNCC=C(C)C 270004a_100000718196_100011998524 [0,0,0,0,0,2|2,0,0]=4 8996 B16R1.4707 COc1cc(ccc1Cl)CNCC=C(C)C 34a_100000718196_200010214485 [0,0,0,0,0,2|2,0,0]=4 8997 B16R1.4707 COc1cc(ccc1Cl)CNCC=C(C)C 34a_100015204853_100000761012 [0,0,0,0,0,2|2,0,0]=4 8998 B16R1.4707 COc1cc(ccc1Cl)CNCCC(=O)N 207a_100000740010_100011998524 [0,0,0,0,0,2|2,0,0]=4 8999 B16R1.4707 COc1cc(ccc1Cl)CNCCC(=O)N 2230a_100015204853_100000744528 [0,0,0,0,0,2|2,0,0]=4 9000 B16R1.4707 COc1cc(ccc1Cl)CNCCC(=O)N 34a_100015204853_100000731001 [0,0,0,0,0,2|2,0,0]=4 9001 B16R1.4707 COc1cc(ccc1Cl)CNCOC(=O)C 34a_100015204853_100009813279 [0,0,0,0,0,2|1,0,0]=3 9002 B16R1.4707 COc1cc(ccc1Cl)CNOCC(=O)O 269956a_100000106656_200010214485 [0,0,0,0,0,2|2,0,0]=4 9003 B16R1.4707 COc1cc(ccc1Cl)COCC=C(C)C 34a_100000753907_200010214485 [0,0,0,0,0,2|2,0,0]=4 9004 B16R1.4707 COc1cc(ccc1Cl)COCC=C(C)C 34a_100012179228_100000761012 [0,0,0,0,0,2|2,0,0]=4 9005 B16R1.4707 COc1cc(ccc1Cl)COCCC(=O)C 34a_100000759926_200010214485 [0,0,0,0,0,2|1,0,0]=3 9006 B16R1.4707 COc1cc(ccc1Cl)COCCC(=O)C 7a_100000759926_200010214485 [0,0,0,0,0,2|1,0,0]=3 9007 B16R1.4707 COc1cc(ccc1Cl)COCCC(=O)N 34a_100000757172_200010214485 [0,0,0,0,0,2|2,0,0]=4 9008 B16R1.4707 COc1cc(ccc1Cl)COCCC(=O)N 34a_100012179228_100000731001 [0,0,0,0,0,2|2,0,0]=4 9009 B16R1.4707 COc1cc(ccc1Cl)COCCC(=O)N 7a_100000757172_200010214485 [0,0,0,0,0,2|2,0,0]=4 9010 B16R1.4707 COc1cc(ccc1Cl)COCOC(=O)C 34a_100012179228_100009813279 [0,0,0,0,0,2|1,0,0]=3 9011 B16R1.4707 COc1cc(ccc1Cl)CSCC=C(C)C 62a_100000761012_200010214485 [0,0,0,0,0,2|2,0,0]=4 9012 B16R1.4707 COc1cc(ccc1Cl)CSCC=C(C)C 62a_200010214485_100000761012 [0,0,0,0,0,2|2,0,0]=4 9013 B16R1.4707 COc1cc(ccc1Cl)CSCCC(=O)C 62a_100000053229_200010214485 [0,0,0,0,0,2|1,0,0]=3 9014 B16R1.4707 COc1cc(ccc1Cl)CSCCC(=O)C 62a_200010214485_100000053229 [0,0,0,0,0,2|1,0,0]=3 9015 B16R1.4707 COc1cc(ccc1Cl)CSCCC(=O)N 62a_100000744528_200010214485 [0,0,0,0,0,2|2,0,0]=4 9016 B16R1.4707 COc1cc(ccc1Cl)CSCCC(=O)N 62a_200010214485_100000744528 [0,0,0,0,0,2|2,0,0]=4 9017 B16R1.4707 COc1cc(ccc1Cl)CSCOC(=O)C 62a_100000076356_200010214485 [0,0,0,0,0,2|1,0,0]=3 9018 B16R1.4707 COc1cc(ccc1Cl)CSCOC(=O)C 62a_200010214485_100000076356 [0,0,0,0,0,2|1,0,0]=3 9019 B16R1.4707 COc1cc(ccc1Cl)NCCC=C(C)C 2230a_100000742311_100011217483 [0,0,0,0,0,2|2,0,0]=4 9020 B16R1.4707 COc1cc(ccc1Cl)NCCC=C(C)C 34a_100000742311_100011217483 [0,0,0,0,0,2|2,0,0]=4 9021 B16R1.4707 COc1cc(ccc1Cl)NCCCC(=O)C 34a_100000742311_100000685027 [0,0,0,0,0,2|1,0,0]=3 9022 B16R1.4707 COc1cc(ccc1Cl)NCCCC(=O)N 34a_100000742311_100102525003 [0,0,0,0,0,2|2,0,0]=4 9023 B16R1.4707 COc1cc(ccc1Cl)NCCNC(=O)C 2230a_100000742311_100000189650 [0,0,0,0,0,2|1,0,0]=3 9024 B16R1.4707 COc1cc(ccc1Cl)NCCNC(=O)N 2230a_100000742311_200000034859 [0,0,0,0,0,2|2,0,0]=4 9025 B16R1.4707 COc1cc(ccc1Cl)NCCOC(=O)C 34a_100000742311_100009814007 [0,0,0,0,0,2|1,0,0]=3 9026 B16R1.4707 COc1cc(ccc1Cl)NCCOC(=O)N 34a_100000742311_200011214921 [0,0,0,0,0,2|2,0,0]=4 9027 B16R1.4707 COc1cc(ccc1Cl)OCCC=C(C)C 34a_100012186310_100011217483 [0,0,0,0,0,2|2,0,0]=4 9028 B16R1.4707 COc1cc(ccc1Cl)OCCC=C(C)C 7a_100012186310_100011217483 [0,0,0,0,0,2|2,0,0]=4 9029 B16R1.4707 COc1cc(ccc1Cl)OCCCC(=O)C 34a_100012186310_100000685027 [0,0,0,0,0,2|1,0,0]=3 9030 B16R1.4707 COc1cc(ccc1Cl)OCCCC(=O)C 7a_100012186310_100011215641 [0,0,0,0,0,2|1,0,0]=3 9031 B16R1.4707 COc1cc(ccc1Cl)OCCCC(=O)N 34a_100012186310_100102525003 [0,0,0,0,0,2|2,0,0]=4 9032 B16R1.4707 COc1cc(ccc1Cl)OCCCC(=O)N 7a_100012186310_100102525003 [0,0,0,0,0,2|2,0,0]=4 9033 B16R1.4707 COc1cc(ccc1Cl)OCCNC(=O)C 7a_100012186310_100000189650 [0,0,0,0,0,2|1,0,0]=3 9034 B16R1.4707 COc1cc(ccc1Cl)OCCNC(=O)N 7a_100012186310_200000034859 [0,0,0,0,0,2|2,0,0]=4 9035 B16R1.4707 COc1cc(ccc1Cl)OCCOC(=O)C 34a_100012186310_100009814007 [0,0,0,0,0,2|1,0,0]=3 9036 B16R1.4707 COc1cc(ccc1Cl)OCCOC(=O)C 7a_100012186310_100009814007 [0,0,0,0,0,2|1,0,0]=3 9037 B16R1.4707 COc1cc(ccc1Cl)OCCOC(=O)N 34a_100012186310_200011214921 [0,0,0,0,0,2|2,0,0]=4 9038 B16R1.4707 COc1cc(ccc1Cl)OCCOC(=O)N 7a_100012186310_200011214921 [0,0,0,0,0,2|2,0,0]=4 9039 B16R1.4707 COc1cc(ccc1Cl)SCCC=C(C)C 62a_100011217483_100011356853 [0,0,0,0,0,2|2,0,0]=4 9040 B16R1.4707 COc1cc(ccc1Cl)SCCC=C(C)C 62a_100011356853_100011217483 [0,0,0,0,0,2|2,0,0]=4 9041 B16R1.4707 COc1cc(ccc1Cl)SCCCC(=O)C 62a_100011215641_100011356853 [0,0,0,0,0,2|1,0,0]=3 9042 B16R1.4707 COc1cc(ccc1Cl)SCCCC(=O)C 62a_100011356853_100011215641 [0,0,0,0,0,2|1,0,0]=3 9043 B16R1.4707 COc1cc(ccc1Cl)SCCCC(=O)N 62a_100011356853_100102525003 [0,0,0,0,0,2|2,0,0]=4 9044 B16R1.4707 COc1cc(ccc1Cl)SCCCC(=O)N 62a_100102525003_100011356853 [0,0,0,0,0,2|2,0,0]=4 9045 B16R1.4707 COc1cc(ccc1Cl)SCCNC(=O)C 62a_100000189650_100011356853 [0,0,0,0,0,2|1,0,0]=3 9046 B16R1.4707 COc1cc(ccc1Cl)SCCNC(=O)C 62a_100011356853_100000189650 [0,0,0,0,0,2|1,0,0]=3 9047 B16R1.4707 COc1cc(ccc1Cl)SCCNC(=O)N 62a_100011356853_200000034859 [0,0,0,0,0,2|2,0,0]=4 9048 B16R1.4707 COc1cc(ccc1Cl)SCCNC(=O)N 62a_200000034859_100011356853 [0,0,0,0,0,2|2,0,0]=4 9049 B16R1.4707 COc1cc(ccc1Cl)SCCOC(=O)C 62a_100009814007_100011356853 [0,0,0,0,0,2|1,0,0]=3 9050 B16R1.4707 COc1cc(ccc1Cl)SCCOC(=O)C 62a_100011356853_100009814007 [0,0,0,0,0,2|1,0,0]=3 9051 B16R1.4707 COc1cc(ccc1Cl)SCCOC(=O)N 62a_100011356853_200011214921 [0,0,0,0,0,2|2,0,0]=4 9052 B16R1.4707 COc1cc(ccc1Cl)SCCOC(=O)N 62a_200011214921_100011356853 [0,0,0,0,0,2|2,0,0]=4 9053 B16R1.4707 COc1cc(ccc1F)C=CCOC(=O)C 271570a_200000047263_100011934186 [0,0,0,0,0,2|1,0,1]=4 9054 B16R1.4707 COc1cc(ccc1F)CNCC=C(C)C 2230a_100020626639_100000761012 [0,0,0,0,0,2|2,0,0]=4 9055 B16R1.4707 COc1cc(ccc1F)CNCC=C(C)C 270004a_100000718196_100000692873 [0,0,0,0,0,2|2,0,0]=4 9056 B16R1.4707 COc1cc(ccc1F)CNCC=C(C)C 34a_100000718196_100012349856 [0,0,0,0,0,2|2,0,0]=4 9057 B16R1.4707 COc1cc(ccc1F)CNCC=C(C)C 34a_100020626639_100000761012 [0,0,0,0,0,2|2,0,0]=4 9058 B16R1.4707 COc1cc(ccc1F)CNCCC(=O)N 207a_100000740010_100000692873 [0,0,0,0,0,2|2,0,0]=4 9059 B16R1.4707 COc1cc(ccc1F)CNCCC(=O)N 2230a_100020626639_100000744528 [0,0,0,0,0,2|2,0,0]=4 9060 B16R1.4707 COc1cc(ccc1F)CNCCC(=O)N 34a_100020626639_100000731001 [0,0,0,0,0,2|2,0,0]=4 9061 B16R1.4707 COc1cc(ccc1F)CNCOC(=O)C 34a_100020626639_100009813279 [0,0,0,0,0,2|1,0,0]=3 9062 B16R1.4707 COc1cc(ccc1F)CNOCC(=O)O 269956a_100000106656_100012349856 [0,0,0,0,0,2|2,0,0]=4 9063 B16R1.4707 COc1cc(ccc1F)COCC=C(C)C 34a_100000692429_100000761012 [0,0,0,0,0,2|2,0,0]=4 9064 B16R1.4707 COc1cc(ccc1F)COCC=C(C)C 34a_100000753907_100012349856 [0,0,0,0,0,2|2,0,0]=4 9065 B16R1.4707 COc1cc(ccc1F)COCC=C(C)C 7a_100000692429_100000761012 [0,0,0,0,0,2|2,0,0]=4 9066 B16R1.4707 COc1cc(ccc1F)COCCC(=O)C 34a_100000759926_100012349856 [0,0,0,0,0,2|1,0,0]=3 9067 B16R1.4707 COc1cc(ccc1F)COCCC(=O)C 7a_100000692429_100000053229 [0,0,0,0,0,2|1,0,0]=3 9068 B16R1.4707 COc1cc(ccc1F)COCCC(=O)C 7a_100000759926_100012349856 [0,0,0,0,0,2|1,0,0]=3 9069 B16R1.4707 COc1cc(ccc1F)COCCC(=O)N 34a_100000692429_100000731001 [0,0,0,0,0,2|2,0,0]=4 9070 B16R1.4707 COc1cc(ccc1F)COCCC(=O)N 34a_100000757172_100012349856 [0,0,0,0,0,2|2,0,0]=4 9071 B16R1.4707 COc1cc(ccc1F)COCCC(=O)N 7a_100000692429_100000744528 [0,0,0,0,0,2|2,0,0]=4 9072 B16R1.4707 COc1cc(ccc1F)COCCC(=O)N 7a_100000757172_100012349856 [0,0,0,0,0,2|2,0,0]=4 9073 B16R1.4707 COc1cc(ccc1F)COCOC(=O)C 34a_100000692429_100009813279 [0,0,0,0,0,2|1,0,0]=3 9074 B16R1.4707 COc1cc(ccc1F)CSCC=C(C)C 62a_100000761012_100012349856 [0,0,0,0,0,2|2,0,0]=4 9075 B16R1.4707 COc1cc(ccc1F)CSCC=C(C)C 62a_100012349856_100000761012 [0,0,0,0,0,2|2,0,0]=4 9076 B16R1.4707 COc1cc(ccc1F)CSCCC(=O)C 62a_100000053229_100012349856 [0,0,0,0,0,2|1,0,0]=3 9077 B16R1.4707 COc1cc(ccc1F)CSCCC(=O)C 62a_100012349856_100000053229 [0,0,0,0,0,2|1,0,0]=3 9078 B16R1.4707 COc1cc(ccc1F)CSCCC(=O)N 62a_100000744528_100012349856 [0,0,0,0,0,2|2,0,0]=4 9079 B16R1.4707 COc1cc(ccc1F)CSCCC(=O)N 62a_100012349856_100000744528 [0,0,0,0,0,2|2,0,0]=4 9080 B16R1.4707 COc1cc(ccc1F)CSCOC(=O)C 62a_100000076356_100012349856 [0,0,0,0,0,2|1,0,0]=3 9081 B16R1.4707 COc1cc(ccc1F)CSCOC(=O)C 62a_100012349856_100000076356 [0,0,0,0,0,2|1,0,0]=3 9082 B16R1.4707 COc1cc(ccc1F)NCCC=C(C)C 2230a_100000701188_100011217483 [0,0,0,0,0,2|2,0,0]=4 9083 B16R1.4707 COc1cc(ccc1F)NCCC=C(C)C 34a_100000701188_100011217483 [0,0,0,0,0,2|2,0,0]=4 9084 B16R1.4707 COc1cc(ccc1F)NCCCC(=O)C 34a_100000701188_100000685027 [0,0,0,0,0,2|1,0,0]=3 9085 B16R1.4707 COc1cc(ccc1F)NCCCC(=O)N 34a_100000701188_100102525003 [0,0,0,0,0,2|2,0,0]=4 9086 B16R1.4707 COc1cc(ccc1F)NCCNC(=O)C 2230a_100000701188_100000189650 [0,0,0,0,0,2|1,0,0]=3 9087 B16R1.4707 COc1cc(ccc1F)NCCNC(=O)N 2230a_100000701188_200000034859 [0,0,0,0,0,2|2,0,0]=4 9088 B16R1.4707 COc1cc(ccc1F)NCCOC(=O)C 34a_100000701188_100009814007 [0,0,0,0,0,2|1,0,0]=3 9089 B16R1.4707 COc1cc(ccc1F)NCCOC(=O)N 34a_100000701188_200011214921 [0,0,0,0,0,2|2,0,0]=4 9090 B16R1.4707 COc1cc(ccc1F)OCCC=C(C)C 34a_100012001760_100011217483 [0,0,0,0,0,2|2,0,0]=4 9091 B16R1.4707 COc1cc(ccc1F)OCCC=C(C)C 7a_100012001760_100011217483 [0,0,0,0,0,2|2,0,0]=4 9092 B16R1.4707 COc1cc(ccc1F)OCCCC(=O)C 34a_100012001760_100000685027 [0,0,0,0,0,2|1,0,0]=3 9093 B16R1.4707 COc1cc(ccc1F)OCCCC(=O)C 7a_100012001760_100011215641 [0,0,0,0,0,2|1,0,0]=3 9094 B16R1.4707 COc1cc(ccc1F)OCCCC(=O)N 34a_100012001760_100102525003 [0,0,0,0,0,2|2,0,0]=4 9095 B16R1.4707 COc1cc(ccc1F)OCCCC(=O)N 7a_100012001760_100102525003 [0,0,0,0,0,2|2,0,0]=4 9096 B16R1.4707 COc1cc(ccc1F)OCCNC(=O)C 7a_100012001760_100000189650 [0,0,0,0,0,2|1,0,0]=3 9097 B16R1.4707 COc1cc(ccc1F)OCCNC(=O)N 7a_100012001760_200000034859 [0,0,0,0,0,2|2,0,0]=4 9098 B16R1.4707 COc1cc(ccc1F)OCCOC(=O)C 34a_100012001760_100009814007 [0,0,0,0,0,2|1,0,0]=3 9099 B16R1.4707 COc1cc(ccc1F)OCCOC(=O)C 7a_100012001760_100009814007 [0,0,0,0,0,2|1,0,0]=3 9100 B16R1.4707 COc1cc(ccc1F)OCCOC(=O)N 34a_100012001760_200011214921 [0,0,0,0,0,2|2,0,0]=4 9101 B16R1.4707 COc1cc(ccc1F)OCCOC(=O)N 7a_100012001760_200011214921 [0,0,0,0,0,2|2,0,0]=4 9102 B16R1.4707 COc1cc(ccc1F)SCCC=C(C)C 62a_100011217483_100011934186 [0,0,0,0,0,2|2,0,0]=4 9103 B16R1.4707 COc1cc(ccc1F)SCCC=C(C)C 62a_100011934186_100011217483 [0,0,0,0,0,2|2,0,0]=4 9104 B16R1.4707 COc1cc(ccc1F)SCCCC(=O)C 62a_100011215641_100011934186 [0,0,0,0,0,2|1,0,0]=3 9105 B16R1.4707 COc1cc(ccc1F)SCCCC(=O)C 62a_100011934186_100011215641 [0,0,0,0,0,2|1,0,0]=3 9106 B16R1.4707 COc1cc(ccc1F)SCCCC(=O)N 62a_100011934186_100102525003 [0,0,0,0,0,2|2,0,0]=4 9107 B16R1.4707 COc1cc(ccc1F)SCCCC(=O)N 62a_100102525003_100011934186 [0,0,0,0,0,2|2,0,0]=4 9108 B16R1.4707 COc1cc(ccc1F)SCCNC(=O)C 62a_100000189650_100011934186 [0,0,0,0,0,2|1,0,0]=3 9109 B16R1.4707 COc1cc(ccc1F)SCCNC(=O)C 62a_100011934186_100000189650 [0,0,0,0,0,2|1,0,0]=3 9110 B16R1.4707 COc1cc(ccc1F)SCCNC(=O)N 62a_100011934186_200000034859 [0,0,0,0,0,2|2,0,0]=4 9111 B16R1.4707 COc1cc(ccc1F)SCCNC(=O)N 62a_200000034859_100011934186 [0,0,0,0,0,2|2,0,0]=4 9112 B16R1.4707 COc1cc(ccc1F)SCCOC(=O)C 62a_100009814007_100011934186 [0,0,0,0,0,2|1,0,0]=3 9113 B16R1.4707 COc1cc(ccc1F)SCCOC(=O)C 62a_100011934186_100009814007 [0,0,0,0,0,2|1,0,0]=3 9114 B16R1.4707 COc1cc(ccc1F)SCCOC(=O)N 62a_100011934186_200011214921 [0,0,0,0,0,2|2,0,0]=4 9115 B16R1.4707 COc1cc(ccc1F)SCCOC(=O)N 62a_200011214921_100011934186 [0,0,0,0,0,2|2,0,0]=4 9116 B16R1.4707 COc1cc(ccc1I)NCCC=C(C)C 34a_100000746945_100011217483 [0,0,0,0,0,2|2,0,0]=4 9117 B16R1.4707 COc1cc(ccc1I)NCCCC(=O)C 34a_100000746945_100000685027 [0,0,0,0,0,2|1,0,0]=3 9118 B16R1.4707 COc1cc(ccc1I)NCCCC(=O)N 34a_100000746945_100102525003 [0,0,0,0,0,2|2,0,0]=4 9119 B16R1.4707 COc1cc(ccc1I)NCCOC(=O)C 34a_100000746945_100009814007 [0,0,0,0,0,2|1,0,0]=3 9120 B16R1.4707 COc1cc(ccc1I)NCCOC(=O)N 34a_100000746945_200011214921 [0,0,0,0,0,2|2,0,0]=4 9121 B16R1.4707 COc1cc(ccc1N)C=CCOC(=O)C 271570a_200000047263_100011279103 [0,0,0,0,0,2|1,0,1]=4 9122 B16R1.4707 COc1cc(ccc1N)COCC=C(C)C 34a_100000087641_100000761012 [0,0,0,0,0,2|2,0,0]=4 9123 B16R1.4707 COc1cc(ccc1N)COCCC(=O)N 34a_100000087641_100000731001 [0,0,0,0,0,2|2,0,0]=4 9124 B16R1.4707 COc1cc(ccc1N)COCOC(=O)C 34a_100000087641_100009813279 [0,0,0,0,0,2|1,0,0]=3 9125 B16R1.4707 COc1cc(ccc1N)OCCC=C(C)C 34a_100015326901_100011217483 [0,0,0,0,0,2|2,0,0]=4 9126 B16R1.4707 COc1cc(ccc1N)OCCC=C(C)C 7a_100015326901_100011217483 [0,0,0,0,0,2|2,0,0]=4 9127 B16R1.4707 COc1cc(ccc1N)OCCCC(=O)C 34a_100015326901_100000685027 [0,0,0,0,0,2|1,0,0]=3 9128 B16R1.4707 COc1cc(ccc1N)OCCCC(=O)C 7a_100015326901_100011215641 [0,0,0,0,0,2|1,0,0]=3 9129 B16R1.4707 COc1cc(ccc1N)OCCCC(=O)N 34a_100015326901_100102525003 [0,0,0,0,0,2|2,0,0]=4 9130 B16R1.4707 COc1cc(ccc1N)OCCCC(=O)N 7a_100015326901_100102525003 [0,0,0,0,0,2|2,0,0]=4 9131 B16R1.4707 COc1cc(ccc1N)OCCNC(=O)C 7a_100015326901_100000189650 [0,0,0,0,0,2|1,0,0]=3 9132 B16R1.4707 COc1cc(ccc1N)OCCNC(=O)N 7a_100015326901_200000034859 [0,0,0,0,0,2|2,0,0]=4 9133 B16R1.4707 COc1cc(ccc1N)OCCOC(=O)C 34a_100015326901_100009814007 [0,0,0,0,0,2|1,0,0]=3 9134 B16R1.4707 COc1cc(ccc1N)OCCOC(=O)C 7a_100015326901_100009814007 [0,0,0,0,0,2|1,0,0]=3 9135 B16R1.4707 COc1cc(ccc1N)OCCOC(=O)N 34a_100015326901_200011214921 [0,0,0,0,0,2|2,0,0]=4 9136 B16R1.4707 COc1cc(ccc1N)OCCOC(=O)N 7a_100015326901_200011214921 [0,0,0,0,0,2|2,0,0]=4 9137 B16R1.4707 COc1cc(ccc1N)SCCC=C(C)C 62a_100011217483_100015196925 [0,0,0,0,0,2|2,0,0]=4 9138 B16R1.4707 COc1cc(ccc1N)SCCC=C(C)C 62a_100011279103_100011217483 [0,0,0,0,0,2|2,0,0]=4 9139 B16R1.4707 COc1cc(ccc1N)SCCCC(=O)C 62a_100011215641_100015196925 [0,0,0,0,0,2|1,0,0]=3 9140 B16R1.4707 COc1cc(ccc1N)SCCCC(=O)C 62a_100011279103_100011215641 [0,0,0,0,0,2|1,0,0]=3 9141 B16R1.4707 COc1cc(ccc1N)SCCCC(=O)N 62a_100011279103_100102525003 [0,0,0,0,0,2|2,0,0]=4 9142 B16R1.4707 COc1cc(ccc1N)SCCCC(=O)N 62a_100102525003_100015196925 [0,0,0,0,0,2|2,0,0]=4 9143 B16R1.4707 COc1cc(ccc1N)SCCNC(=O)C 62a_100000189650_100015196925 [0,0,0,0,0,2|1,0,0]=3 9144 B16R1.4707 COc1cc(ccc1N)SCCNC(=O)C 62a_100011279103_100000189650 [0,0,0,0,0,2|1,0,0]=3 9145 B16R1.4707 COc1cc(ccc1N)SCCNC(=O)N 62a_100011279103_200000034859 [0,0,0,0,0,2|2,0,0]=4 9146 B16R1.4707 COc1cc(ccc1N)SCCNC(=O)N 62a_200000034859_100015196925 [0,0,0,0,0,2|2,0,0]=4 9147 B16R1.4707 COc1cc(ccc1N)SCCOC(=O)C 62a_100009814007_100015196925 [0,0,0,0,0,2|1,0,0]=3 9148 B16R1.4707 COc1cc(ccc1N)SCCOC(=O)C 62a_100011279103_100009814007 [0,0,0,0,0,2|1,0,0]=3 9149 B16R1.4707 COc1cc(ccc1N)SCCOC(=O)N 62a_100011279103_200011214921 [0,0,0,0,0,2|2,0,0]=4 9150 B16R1.4707 COc1cc(ccc1N)SCCOC(=O)N 62a_200011214921_100015196925 [0,0,0,0,0,2|2,0,0]=4 9151 B16R1.4707 COc1cc(ccc1O)C=CCOC(=O)C 271570a_200000047263_100000694246 [0,0,0,0,0,2|0,0,1]=3 9152 B16R1.4707 COc1cc(ccc1O)CCNCC(=O)N 2230a_100000711301_100010741665 [0,0,0,0,0,2|1,0,0]=3 9153 B16R1.4707 COc1cc(ccc1O)CCNCC(=O)N 34a_100000756042_100000187820 [0,0,0,0,0,2|1,0,0]=3 9154 B16R1.4707 COc1cc(ccc1O)CCNCC(=O)O 269956a_100016091260_100010741665 [0,0,0,0,0,2|1,0,0]=3 9155 B16R1.4707 COc1cc(ccc1O)CCNCC(=O)[O-] 34a_100000756042_100020667443 [0,0,0,0,0,2|1,0,0]=3 9156 B16R1.4707 COc1cc(ccc1O)CCNCC(C)C 2230a_100000210953_100010741665 [0,0,0,0,0,2|1,0,1]=4 9157 B16R1.4707 COc1cc(ccc1O)CCNCC(C)C 270004a_100000756042_100000210432 [0,0,0,0,0,2|1,0,1]=4 9158 B16R1.4707 COc1cc(ccc1O)CCNCC(C)C 34a_100000756042_100000210624 [0,0,0,0,0,2|1,0,1]=4 9159 B16R1.4707 COc1cc(ccc1O)CCNCC(C)O 2230a_100000210904_100010741665 [0,0,0,0,0,2|0,0,2]=4 9160 B16R1.4707 COc1cc(ccc1O)CCNCC(C)O 34a_100000756042_100011218427 [0,0,0,0,0,2|0,0,2]=4 9161 B16R1.4707 COc1cc(ccc1O)CCNC[C@@H](C)O 34a_100000756042_100009817552 [0,0,0,0,0,2|0,0,2]=4 9162 B16R1.4707 COc1cc(ccc1O)CCNC[N+](=O)[O-] 34a_100000756042_100000761209 [0,0,0,0,0,2|2,0,0]=4 9163 B16R1.4707 COc1cc(ccc1O)CCSCC(=O)N 62a_100000747473_100010741665 [0,0,0,0,0,2|1,0,0]=3 9164 B16R1.4707 COc1cc(ccc1O)CCSCC(=O)[O-] 62a_100020667443_100010741665 [0,0,0,0,0,2|1,0,0]=3 9165 B16R1.4707 COc1cc(ccc1O)CCSCC(C)C 62a_100000210624_100010741665 [0,0,0,0,0,2|1,0,1]=4 9166 B16R1.4707 COc1cc(ccc1O)CCSCC(C)O 62a_100011218427_100010741665 [0,0,0,0,0,2|0,0,2]=4 9167 B16R1.4707 COc1cc(ccc1O)CCSC[C@@H](C)O 62a_100009817552_100010741665 [0,0,0,0,0,2|0,0,2]=4 9168 B16R1.4707 COc1cc(ccc1O)CNCC=C(C)C 34a_100000185554_100000761012 [0,0,0,0,0,2|1,0,0]=3 9169 B16R1.4707 COc1cc(ccc1O)CNCCC(=O)N 34a_100000185554_100000731001 [0,0,0,0,0,2|1,0,0]=3 9170 B16R1.4707 COc1cc(ccc1O)CNCCC(C)C 34a_100000185554_100000210312 [0,0,0,0,0,2|1,0,1]=4 9171 B16R1.4707 COc1cc(ccc1O)CNCCC(C)O 34a_100000185554_100012276601 [0,0,0,0,0,2|0,0,2]=4 9172 B16R1.4707 COc1cc(ccc1O)CNCOC(=O)C 34a_100000185554_100009813279 [0,0,0,0,0,2|0,0,0]=2 9173 B16R1.4707 COc1cc(ccc1O)CNCOC(C)C 34a_100000185554_100000709892 [0,0,0,0,0,2|1,0,1]=4 9174 B16R1.4707 COc1cc(ccc1O)NCCC=C(C)C 34a_100000726020_100011217483 [0,0,0,0,0,2|1,0,0]=3 9175 B16R1.4707 COc1cc(ccc1O)NCCC=C(F)F 34a_100000726020_200009816681 [0,0,0,0,0,2|2,0,0]=4 9176 B16R1.4707 COc1cc(ccc1O)NCCCC(=O)C 34a_100000726020_100000685027 [0,0,0,0,0,2|0,0,0]=2 9177 B16R1.4707 COc1cc(ccc1O)NCCCC(=O)N 34a_100000726020_100102525003 [0,0,0,0,0,2|1,0,0]=3 9178 B16R1.4707 COc1cc(ccc1O)NCCCC(C)C 34a_100000726020_100011214892 [0,0,0,0,0,2|1,0,1]=4 9179 B16R1.4707 COc1cc(ccc1O)NCCCC(C)O 34a_100000726020_200000718107 [0,0,0,0,0,2|0,0,2]=4 9180 B16R1.4707 COc1cc(ccc1O)NCCOC(=O)C 34a_100000726020_100009814007 [0,0,0,0,0,2|0,0,0]=2 9181 B16R1.4707 COc1cc(ccc1O)NCCOC(=O)N 34a_100000726020_200011214921 [0,0,0,0,0,2|1,0,0]=3 9182 B16R1.4707 COc1cc(ccc1O)NCCOC(C)C 34a_100000726020_100000211751 [0,0,0,0,0,2|1,0,1]=4 9183 B16R1.4707 COc1cc(ccc1O)NCCSC(C)C 34a_100000726020_100000730970 [0,0,0,0,0,2|1,0,1]=4 9184 B16R1.4707 COc1cc(ccc1O)SCCC=C(C)C 62a_100011217483_100000694246 [0,0,0,0,0,2|1,0,0]=3 9185 B16R1.4707 COc1cc(ccc1O)SCCC=C(F)F 62a_200009816681_100000694246 [0,0,0,0,0,2|2,0,0]=4 9186 B16R1.4707 COc1cc(ccc1O)SCCCC(=O)C 62a_100011215641_100000694246 [0,0,0,0,0,2|0,0,0]=2 9187 B16R1.4707 COc1cc(ccc1O)SCCCC(=O)N 62a_100102525003_100000694246 [0,0,0,0,0,2|1,0,0]=3 9188 B16R1.4707 COc1cc(ccc1O)SCCCC(C)C 62a_100011214892_100000694246 [0,0,0,0,0,2|1,0,1]=4 9189 B16R1.4707 COc1cc(ccc1O)SCCCC(C)O 62a_200000718107_100000694246 [0,0,0,0,0,2|0,0,2]=4 9190 B16R1.4707 COc1cc(ccc1O)SCCNC(=O)C 62a_100000189650_100000694246 [0,0,0,0,0,2|0,0,0]=2 9191 B16R1.4707 COc1cc(ccc1O)SCCNC(=O)N 62a_200000034859_100000694246 [0,0,0,0,0,2|1,0,0]=3 9192 B16R1.4707 COc1cc(ccc1O)SCCOC(=O)C 62a_100009814007_100000694246 [0,0,0,0,0,2|0,0,0]=2 9193 B16R1.4707 COc1cc(ccc1O)SCCOC(=O)N 62a_200011214921_100000694246 [0,0,0,0,0,2|1,0,0]=3 9194 B16R1.4707 COc1cc(ccc1O)SCCOC(C)C 62a_100000211751_100000694246 [0,0,0,0,0,2|1,0,1]=4 9195 B16R1.4707 COc1cc(ccc1O)SCCSC(C)C 62a_100000730970_100000694246 [0,0,0,0,0,2|1,0,1]=4 9196 B16R1.4707 COc1cc(cnc1C)SCCCC(=O)C 62a_100010254219_100011215641 [0,0,0,0,0,2|2,0,0]=4 9197 B16R1.4707 COc1cc(cnc1C)SCCCC(=O)C 62a_100011215641_100010254219 [0,0,0,0,0,2|2,0,0]=4 9198 B16R1.4707 COc1cc(cnc1C)SCCNC(=O)C 62a_100000189650_100010254219 [0,0,0,0,0,2|2,0,0]=4 9199 B16R1.4707 COc1cc(cnc1C)SCCNC(=O)C 62a_100010254219_100000189650 [0,0,0,0,0,2|2,0,0]=4 9200 B16R1.4707 COc1cc(cnc1C)SCCOC(=O)C 62a_100009814007_100010254219 [0,0,0,0,0,2|2,0,0]=4 9201 B16R1.4707 COc1cc(cnc1C)SCCOC(=O)C 62a_100010254219_100009814007 [0,0,0,0,0,2|2,0,0]=4 9202 B16R1.4707 COc1cc(cnc1F)SCCCC(=O)C 62a_100010214931_100011215641 [0,0,0,0,0,2|2,0,0]=4 9203 B16R1.4707 COc1cc(cnc1F)SCCCC(=O)C 62a_100011215641_100010214931 [0,0,0,0,0,2|2,0,0]=4 9204 B16R1.4707 COc1cc(cnc1F)SCCNC(=O)C 62a_100000189650_100010214931 [0,0,0,0,0,2|2,0,0]=4 9205 B16R1.4707 COc1cc(cnc1F)SCCNC(=O)C 62a_100010214931_100000189650 [0,0,0,0,0,2|2,0,0]=4 9206 B16R1.4707 COc1cc(cnc1F)SCCOC(=O)C 62a_100009814007_100010214931 [0,0,0,0,0,2|2,0,0]=4 9207 B16R1.4707 COc1cc(cnc1F)SCCOC(=O)C 62a_100010214931_100009814007 [0,0,0,0,0,2|2,0,0]=4 9208 B16R1.4707 COc1cc(cnc1N)SCCCC(=O)C 62a_100011215641_106354213024 [0,0,0,0,0,2|2,0,0]=4 9209 B16R1.4707 COc1cc(cnc1N)SCCCC(=O)C 62a_106354213024_100011215641 [0,0,0,0,0,2|2,0,0]=4 9210 B16R1.4707 COc1cc(cnc1N)SCCNC(=O)C 62a_100000189650_106354213024 [0,0,0,0,0,2|2,0,0]=4 9211 B16R1.4707 COc1cc(cnc1N)SCCNC(=O)C 62a_106354213024_100000189650 [0,0,0,0,0,2|2,0,0]=4 9212 B16R1.4707 COc1cc(cnc1N)SCCOC(=O)C 62a_100009814007_106354213024 [0,0,0,0,0,2|2,0,0]=4 9213 B16R1.4707 COc1cc(cnc1N)SCCOC(=O)C 62a_106354213024_100009814007 [0,0,0,0,0,2|2,0,0]=4 9214 B16R1.4707 COc1cc(ncc1Br)COCOC(=O)C 34a_100010999569_100009813279 [0,0,0,0,0,2|2,0,0]=4 9215 B16R1.4707 COc1cc(ncc1C)SCCCC(=O)C 62a_100010067687_100011215641 [0,0,0,0,0,2|2,0,0]=4 9216 B16R1.4707 COc1cc(ncc1C)SCCCC(=O)C 62a_100011215641_100010067687 [0,0,0,0,0,2|2,0,0]=4 9217 B16R1.4707 COc1cc(ncc1C)SCCNC(=O)C 62a_100000189650_100010067687 [0,0,0,0,0,2|2,0,0]=4 9218 B16R1.4707 COc1cc(ncc1C)SCCNC(=O)C 62a_100010067687_100000189650 [0,0,0,0,0,2|2,0,0]=4 9219 B16R1.4707 COc1cc(ncc1C)SCCOC(=O)C 62a_100009814007_100010067687 [0,0,0,0,0,2|2,0,0]=4 9220 B16R1.4707 COc1cc(ncc1C)SCCOC(=O)C 62a_100010067687_100009814007 [0,0,0,0,0,2|2,0,0]=4 9221 B16R1.4707 COc1cc(ncc1F)SCCCC(=O)C 62a_100011215641_200010136270 [0,0,0,0,0,2|2,0,0]=4 9222 B16R1.4707 COc1cc(ncc1F)SCCCC(=O)C 62a_200010136270_100011215641 [0,0,0,0,0,2|2,0,0]=4 9223 B16R1.4707 COc1cc(ncc1F)SCCNC(=O)C 62a_100000189650_200010136270 [0,0,0,0,0,2|2,0,0]=4 9224 B16R1.4707 COc1cc(ncc1F)SCCNC(=O)C 62a_200010136270_100000189650 [0,0,0,0,0,2|2,0,0]=4 9225 B16R1.4707 COc1cc(ncc1F)SCCOC(=O)C 62a_100009814007_200010136270 [0,0,0,0,0,2|2,0,0]=4 9226 B16R1.4707 COc1cc(ncc1F)SCCOC(=O)C 62a_200010136270_100009814007 [0,0,0,0,0,2|2,0,0]=4 9227 B16R1.4707 COc1cc(ncc1N)SCCCC(=O)C 62a_100009887741_100011215641 [0,0,0,0,0,2|2,0,0]=4 9228 B16R1.4707 COc1cc(ncc1N)SCCCC(=O)C 62a_100011215641_100009887741 [0,0,0,0,0,2|2,0,0]=4 9229 B16R1.4707 COc1cc(ncc1N)SCCNC(=O)C 62a_100000189650_100009887741 [0,0,0,0,0,2|2,0,0]=4 9230 B16R1.4707 COc1cc(ncc1N)SCCNC(=O)C 62a_100009887741_100000189650 [0,0,0,0,0,2|2,0,0]=4 9231 B16R1.4707 COc1cc(ncc1N)SCCOC(=O)C 62a_100009814007_100009887741 [0,0,0,0,0,2|2,0,0]=4 9232 B16R1.4707 COc1cc(ncc1N)SCCOC(=O)C 62a_100009887741_100009814007 [0,0,0,0,0,2|2,0,0]=4 9233 B16R1.4707 COc1nc(ccc1Br)COCCC(=O)C 34a_100000759926_200010066506 [0,0,0,0,0,2|2,0,0]=4 9234 B16R1.4707 COc1nc(ccc1Br)COCCC(=O)C 7a_100000759926_200010066506 [0,0,0,0,0,2|2,0,0]=4 9235 B16R1.4707 COc1nc(ccc1Br)CSCCC(=O)C 62a_100000053229_200010066506 [0,0,0,0,0,2|2,0,0]=4 9236 B16R1.4707 COc1nc(ccc1Br)CSCCC(=O)C 62a_200010066506_100000053229 [0,0,0,0,0,2|2,0,0]=4 9237 B16R1.4707 COc1nc(ccc1Br)CSCOC(=O)C 62a_100000076356_200010066506 [0,0,0,0,0,2|2,0,0]=4 9238 B16R1.4707 COc1nc(ccc1Br)CSCOC(=O)C 62a_200010066506_100000076356 [0,0,0,0,0,2|2,0,0]=4 9239 B16R1.4707 COc1nc(ccc1N)SCCCC(=O)C 62a_100000687816_100011215641 [0,0,0,0,0,2|2,0,0]=4 9240 B16R1.4707 COc1nc(ccc1N)SCCCC(=O)C 62a_100011215641_100000687816 [0,0,0,0,0,2|2,0,0]=4 9241 B16R1.4707 COc1nc(ccc1N)SCCNC(=O)C 62a_100000189650_100000687816 [0,0,0,0,0,2|2,0,0]=4 9242 B16R1.4707 COc1nc(ccc1N)SCCNC(=O)C 62a_100000687816_100000189650 [0,0,0,0,0,2|2,0,0]=4 9243 B16R1.4707 COc1nc(ccc1N)SCCOC(=O)C 62a_100000687816_100009814007 [0,0,0,0,0,2|2,0,0]=4 9244 B16R1.4707 COc1nc(ccc1N)SCCOC(=O)C 62a_100009814007_100000687816 [0,0,0,0,0,2|2,0,0]=4 9245 B16R1.4707 COc1nc(ccc1O)C=CCOC(=O)C 271570a_200000047263_100010893133 [0,0,0,0,0,2|1,0,1]=4 9246 B16R1.4707 COc1nc(ccc1O)SCCC=C(C)C 62a_100011217483_100010893133 [0,0,0,0,0,2|2,0,0]=4 9247 B16R1.4707 COc1nc(ccc1O)SCCCC(=O)C 62a_100011215641_100010893133 [0,0,0,0,0,2|1,0,0]=3 9248 B16R1.4707 COc1nc(ccc1O)SCCCC(=O)N 62a_100102525003_100010893133 [0,0,0,0,0,2|2,0,0]=4 9249 B16R1.4707 COc1nc(ccc1O)SCCNC(=O)C 62a_100000189650_100010893133 [0,0,0,0,0,2|1,0,0]=3 9250 B16R1.4707 COc1nc(ccc1O)SCCNC(=O)N 62a_200000034859_100010893133 [0,0,0,0,0,2|2,0,0]=4 9251 B16R1.4707 COc1nc(ccc1O)SCCOC(=O)C 62a_100009814007_100010893133 [0,0,0,0,0,2|1,0,0]=3 9252 B16R1.4707 COc1nc(ccc1O)SCCOC(=O)N 62a_200011214921_100010893133 [0,0,0,0,0,2|2,0,0]=4 9253 B16R1.4707 COc1nc(cnc1O)SCCCC(=O)C 62a_100011215641_200010365344 [0,0,0,0,0,2|2,0,0]=4 9254 B16R1.4707 COc1nc(cnc1O)SCCCC(=O)C 62a_200010365344_100011215641 [0,0,0,0,0,2|2,0,0]=4 9255 B16R1.4707 COc1nc(cnc1O)SCCNC(=O)C 62a_100000189650_200010365344 [0,0,0,0,0,2|2,0,0]=4 9256 B16R1.4707 COc1nc(cnc1O)SCCNC(=O)C 62a_200010365344_100000189650 [0,0,0,0,0,2|2,0,0]=4 9257 B16R1.4707 COc1nc(cnc1O)SCCOC(=O)C 62a_100009814007_200010365344 [0,0,0,0,0,2|2,0,0]=4 9258 B16R1.4707 COc1nc(cnc1O)SCCOC(=O)C 62a_200010365344_100009814007 [0,0,0,0,0,2|2,0,0]=4 9259 B16R1.4707 CSc1cc(ccc1F)SCCCC(=O)C 62a_100010341305_100011215641 [0,0,0,0,0,2|1,1,0]=4 9260 B16R1.4707 CSc1cc(ccc1F)SCCCC(=O)C 62a_100011215641_100010341305 [0,0,0,0,0,2|1,1,0]=4 9261 B16R1.4707 CSc1cc(ccc1F)SCCNC(=O)C 62a_100000189650_100010341305 [0,0,0,0,0,2|1,1,0]=4 9262 B16R1.4707 CSc1cc(ccc1F)SCCNC(=O)C 62a_100010341305_100000189650 [0,0,0,0,0,2|1,1,0]=4 9263 B16R1.4707 CSc1cc(ccc1F)SCCOC(=O)C 62a_100009814007_100010341305 [0,0,0,0,0,2|1,1,0]=4 9264 B16R1.4707 CSc1cc(ccc1F)SCCOC(=O)C 62a_100010341305_100009814007 [0,0,0,0,0,2|1,1,0]=4