0 B11R1.157 CC(=Cc1cc(ccn1)C)C 271570a_100102525489_100000750283 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.157 CC(=Cc1cc(ccn1)Cl)C 271570a_100102525489_100010167805 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.157 CC(=Cc1cc(ccn1)F)C 271570a_100102525489_100009817058 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.157 CC(=Cc1cc(ccn1)N)C 271570a_100102525489_100009814236 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.157 CC(=Cc1cc(ccn1)O)C 271570a_100102525489_100000762945 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.157 CC(=Cc1cc(cnn1)O)C 271570a_100102525489_200010734679 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.157 CC(=Cc1cc(ncn1)O)C 271570a_100102525489_100000765262 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.157 CC(=Cc1cc[nH]c(=O)c1)C 271570a_100102525489_100009816521 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.157 CC(=Cc1ccc[n+](c1)C)C 271570a_100102525489_100009996589 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.157 CC(=Cc1ccc[n+](c1)[O-])C 271570a_100102525489_100009815978 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.157 CC(=Cc1cccc(=O)[nH]1)C 271570a_100102525489_100000761760 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [0,0,0,0,0,0|3,0,0]=3 16 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [0,0,0,0,0,0|2,0,0]=2 17 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [0,0,0,0,0,0|2,1,0]=3 18 B11R1.157 CC(=Cc1cccc(n1)Br)C 271570a_100102525489_100000684672 [0,0,0,0,0,0|4,0,0]=4 19 B11R1.157 CC(=Cc1cccc(n1)C)C 271570a_100102525489_100000742759 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.157 CC(=Cc1cccc(n1)F)C 271570a_100102525489_100009815982 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.157 CC(=Cc1cccc(n1)N)C 271570a_100102525489_100000740741 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.157 CC(=Cc1ccnc(c1)Br)C 271570a_100102525489_100009814637 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.157 CC(=Cc1ccnc(c1)Cl)C 271570a_100102525489_100000035001 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.157 CC(=Cc1ccnc(c1)F)C 271570a_100102525489_100009816116 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.157 CC(=Cc1ccnc(c1)N)C 271570a_100102525489_100000744379 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.157 CC(=Cc1cncc(c1)Br)C 271570a_100102525489_100000728054 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.157 CC(=Cc1cncc(c1)C)C 271570a_100102525489_100000760492 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.157 CC(=Cc1cncc(c1)Cl)C 271570a_100102525489_100000049639 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.157 CC(=Cc1cncc(c1)F)C 271570a_100102525489_100000744099 [0,0,0,0,0,0|4,0,0]=4 31 B11R1.157 CC(=Cc1cncc(c1)N)C 271570a_100102525489_100000687067 [0,0,0,0,0,0|4,0,0]=4 32 B11R1.157 CC(=Cc1cncc(c1)O)C 271570a_100102525489_100000754920 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.157 CC(=Cc1cncc(n1)O)C 271570a_100102525489_100011269956 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.157 CC(=Cc1nccc(n1)O)C 271570a_100102525489_100011649813 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.157 CC(=O)Cc1cc(ccn1)Br 1458a_100000070787_100010173614 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.157 CC(=O)Cc1cc(ccn1)C 1458a_100000070787_100000718516 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.157 CC(=O)Cc1cc(ccn1)Cl 1458a_100000070787_100016988179 [0,0,0,0,0,0|3,0,0]=3 38 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [0,0,0,0,0,0|2,0,0]=2 39 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [0,0,0,0,0,0|2,0,0]=2 40 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [0,0,0,0,0,0|2,0,0]=2 41 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [0,0,0,0,0,0|2,0,0]=2 43 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [0,0,0,0,0,0|2,0,0]=2 44 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [0,0,0,0,0,0|2,0,0]=2 45 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [0,0,0,0,0,0|2,0,0]=2 46 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [0,0,0,0,0,0|2,0,0]=2 47 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [0,0,0,0,0,0|2,0,0]=2 48 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [0,0,0,0,0,0|1,0,0]=1 49 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [0,0,0,0,0,0|1,0,0]=1 50 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [0,0,0,0,0,0|1,0,0]=1 51 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100000070787_100009889011 [0,0,0,0,0,0|3,0,0]=3 52 B11R1.157 CC(=O)Cc1cccc(n1)Br 1458a_100010201708_200000210301 [0,0,0,0,0,0|3,0,0]=3 53 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100000070787_100000757606 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100012001110_200000210301 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000070787_100000086093 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.157 CC(=O)Cc1cccc(n1)Cl 1458a_100000090259_200000210301 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000070787_100009819644 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.157 CC(=O)Cc1cccc(n1)F 1458a_100000096803_200000210301 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100000070787_100010243470 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.157 CC(=O)Cc1ccnc(c1)Br 1458a_100010126891_200000210301 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [0,0,0,0,0,0|3,0,0]=3 62 B11R1.157 CC(=O)Cc1ccnc(c1)Cl 1458a_100000070787_100000764220 [0,0,0,0,0,0|3,0,0]=3 63 B11R1.157 CC(=O)Cc1ccnc(n1)Cl 1458a_100000070787_100000099655 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000070787_100011740620 [0,0,0,0,0,0|3,0,0]=3 65 B11R1.157 CC(=O)Cc1cncc(c1)Br 1458a_100000239331_200000210301 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.157 CC(=O)Cc1cncc(c1)C 1458a_100000070787_100000716715 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.157 CC(=O)Cc1cncc(c1)Cl 1458a_100000070787_100016992070 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100000070787_100000725299 [0,0,0,0,0,0|3,0,0]=3 69 B11R1.157 CC(=O)Cc1cncc(c1)F 1458a_100011667516_200000210301 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.157 CC(=O)Nc1cc(ccn1)O 271570a_203496583355_100012362434 [0,0,0,0,0,0|2,0,0]=2 71 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [0,0,0,0,0,0|2,0,0]=2 72 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [0,0,0,0,0,0|2,0,0]=2 73 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [0,0,0,0,0,0|2,0,0]=2 74 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [0,0,0,0,0,0|2,0,0]=2 75 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [0,0,0,0,0,0|2,0,0]=2 76 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [0,0,0,0,0,0|2,0,0]=2 77 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [0,0,0,0,0,0|2,0,0]=2 78 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [0,0,0,0,0,0|2,0,0]=2 79 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [0,0,0,0,0,0|2,0,0]=2 81 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [0,0,0,0,0,0|2,0,0]=2 82 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [0,0,0,0,0,0|2,0,0]=2 83 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [0,0,0,0,0,0|2,0,0]=2 84 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [0,0,0,0,0,0|2,0,0]=2 85 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [0,0,0,0,0,0|2,0,0]=2 86 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [0,0,0,0,0,0|2,0,0]=2 88 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [0,0,0,0,0,0|2,0,0]=2 90 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [0,0,0,0,0,0|1,0,0]=1 91 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [0,0,0,0,0,0|1,0,0]=1 92 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [0,0,0,0,0,0|1,0,0]=1 93 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [0,0,0,0,0,0|1,0,0]=1 94 B11R1.157 CC(=O)Nc1cccc(n1)O 271570a_203496583355_200011307899 [0,0,0,0,0,0|2,0,0]=2 95 B11R1.157 CC(=O)Nc1ccnc(c1)O 271570a_203496583355_100000238608 [0,0,0,0,0,0|2,0,0]=2 96 B11R1.157 CC(=O)Nc1cncc(c1)O 271570a_203496583355_100012351681 [0,0,0,0,0,0|2,0,0]=2 97 B11R1.157 CC(=O)Nc1cncc(n1)O 271570a_203496583355_100000703374 [0,0,0,0,0,0|3,0,0]=3 98 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [0,0,0,0,0,0|0,0,0]=0 99 B11R1.157 CC(C)Cc1cccc(c1)O 271570a_203496583355_100010883412 [0,0,0,0,0,0|2,0,1]=3 100 B11R1.157 CC(C)Nc1cc(ccn1)O 271570a_203496583355_200012354261 [0,0,0,0,0,0|3,0,1]=4 101 B11R1.157 CC(C)Nc1cccc(c1)Br 34a_100000210019_100000210206 [0,0,0,0,0,0|3,0,1]=4 102 B11R1.157 CC(C)Nc1cccc(c1)Cl 34a_100000185859_100000210206 [0,0,0,0,0,0|3,0,1]=4 103 B11R1.157 CC(C)Nc1cccc(c1)F 34a_100000210047_100000210206 [0,0,0,0,0,0|3,0,1]=4 104 B11R1.157 CC(C)Nc1cccc(c1)I 34a_100000211102_100000210206 [0,0,0,0,0,0|3,0,1]=4 105 B11R1.157 CC(C)Nc1cccc(c1)O 271570a_203496583355_100000219649 [0,0,0,0,0,0|2,0,1]=3 106 B11R1.157 CC(C)Nc1cccc(c1)O 34a_100000210217_100000210206 [0,0,0,0,0,0|2,0,1]=3 107 B11R1.157 CC(C)Oc1cc(ccn1)O 271570a_203496583355_100010247003 [0,0,0,0,0,0|2,0,1]=3 108 B11R1.157 CC(C)Oc1cc(ncn1)O 271570a_203496583355_100011443165 [0,0,0,0,0,0|3,0,1]=4 109 B11R1.157 CC(C)Oc1cc[nH]c(=O)c1 34a_100000032262_100000210206 [0,0,0,0,0,0|2,0,2]=4 110 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] 34a_100000039713_100000210206 [0,0,0,0,0,0|2,0,2]=4 111 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000210206 [0,0,0,0,0,0|2,0,2]=4 112 B11R1.157 CC(C)Oc1cccc(=O)[nH]1 34a_100000033347_100000210206 [0,0,0,0,0,0|2,0,2]=4 113 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [0,0,0,0,0,0|2,0,1]=3 114 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [0,0,0,0,0,0|2,0,1]=3 115 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [0,0,0,0,0,0|2,0,1]=3 116 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [0,0,0,0,0,0|2,0,1]=3 117 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [0,0,0,0,0,0|2,0,1]=3 118 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [0,0,0,0,0,0|2,0,1]=3 119 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [0,0,0,0,0,0|2,0,1]=3 120 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [0,0,0,0,0,0|2,0,1]=3 121 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [0,0,0,0,0,0|2,0,1]=3 122 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [0,0,0,0,0,0|1,0,1]=2 123 B11R1.157 CC(C)Oc1cccc(n1)F 34a_100011432558_100000210206 [0,0,0,0,0,0|3,0,1]=4 124 B11R1.157 CC(C)Oc1cccc(n1)O 271570a_203496583355_100000703025 [0,0,0,0,0,0|2,0,1]=3 125 B11R1.157 CC(C)Oc1ccnc(c1)Cl 34a_100000762945_100000210206 [0,0,0,0,0,0|3,0,1]=4 126 B11R1.157 CC(C)Oc1ccnc(c1)F 34a_100000732698_100000210206 [0,0,0,0,0,0|3,0,1]=4 127 B11R1.157 CC(C)Oc1ccnc(c1)N 34a_100011834064_100000210206 [0,0,0,0,0,0|3,0,1]=4 128 B11R1.157 CC(C)Oc1ccnc(n1)O 271570a_203496583355_100011649790 [0,0,0,0,0,0|3,0,1]=4 129 B11R1.157 CC(C)Oc1cncc(c1)Br 34a_100000754920_100000210206 [0,0,0,0,0,0|3,0,1]=4 130 B11R1.157 CC(C)Oc1cncc(c1)Br 7a_100000754920_100000210206 [0,0,0,0,0,0|3,0,1]=4 131 B11R1.157 CC(C)Oc1cncc(c1)Cl 7a_100000032511_100000210206 [0,0,0,0,0,0|3,0,1]=4 132 B11R1.157 CC(C)Oc1cncc(c1)F 34a_100011830296_100000210206 [0,0,0,0,0,0|3,0,1]=4 133 B11R1.157 CC(C)Oc1cncc(c1)F 7a_100011830296_100000210206 [0,0,0,0,0,0|3,0,1]=4 134 B11R1.157 CC(C)Oc1cncc(c1)N 34a_100011997051_100000210206 [0,0,0,0,0,0|3,0,1]=4 135 B11R1.157 CC(C)Oc1cncc(c1)O 271570a_203496583355_100012029599 [0,0,0,0,0,0|2,0,1]=3 136 B11R1.157 CC(C)Sc1cc(ccn1)O 62a_100000210206_100000762945 [0,0,0,0,0,0|2,1,1]=4 137 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000210206_100000691529 [0,0,0,0,0,0|2,1,1]=4 138 B11R1.157 CC(C)Sc1cccc(c1)Br 62a_100000691529_100000210206 [0,0,0,0,0,0|2,1,1]=4 139 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000210206_100000699651 [0,0,0,0,0,0|2,1,1]=4 140 B11R1.157 CC(C)Sc1cccc(c1)Cl 62a_100000699651_100000210206 [0,0,0,0,0,0|2,1,1]=4 141 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000210206_100000685547 [0,0,0,0,0,0|2,1,1]=4 142 B11R1.157 CC(C)Sc1cccc(c1)F 62a_100000685547_100000210206 [0,0,0,0,0,0|2,1,1]=4 143 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210019_100000210206 [0,0,0,0,0,0|2,1,1]=4 144 B11R1.157 CC(C)Sc1cccc(c1)N 62a_100000210206_100000210019 [0,0,0,0,0,0|2,1,1]=4 145 B11R1.157 CC(C)Sc1cccc(c1)O 271570a_203496583355_100009815759 [0,0,0,0,0,0|1,1,1]=3 146 B11R1.157 CC(C)Sc1cccc(c1)O 62a_100000210206_100000211634 [0,0,0,0,0,0|1,1,1]=3 147 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_100000210206_114929384022 [0,0,0,0,0,0|1,2,1]=4 148 B11R1.157 CC(C)Sc1cccc(c1)[S] 62a_114929384022_100000210206 [0,0,0,0,0,0|1,2,1]=4 149 B11R1.157 CC(C)Sc1cncc(c1)O 62a_100000210206_100000754920 [0,0,0,0,0,0|2,1,1]=4 150 B11R1.157 CC(C)Sc1cncc(c1)O 62a_100000754920_100000210206 [0,0,0,0,0,0|2,1,1]=4 151 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100000187585_200000210301 [0,0,0,0,0,0|4,0,0]=4 152 B11R1.157 CN(C)Cc1cccc(c1)Br 2230a_100102631434_100000698116 [0,0,0,0,0,0|4,0,0]=4 153 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100000187585_200000210301 [0,0,0,0,0,0|4,0,0]=4 154 B11R1.157 CN(C)Cc1cccc(c1)Br 269982a_100102631434_100000211773 [0,0,0,0,0,0|4,0,0]=4 155 B11R1.157 CN(C)Cc1cccc(c1)Br 270004a_100102631434_100000210085 [0,0,0,0,0,0|4,0,0]=4 156 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100020629429_200000210301 [0,0,0,0,0,0|4,0,0]=4 157 B11R1.157 CN(C)Cc1cccc(c1)Cl 2230a_100102631434_100000181238 [0,0,0,0,0,0|4,0,0]=4 158 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100020629429_200000210301 [0,0,0,0,0,0|4,0,0]=4 159 B11R1.157 CN(C)Cc1cccc(c1)Cl 269982a_100102631434_100000181238 [0,0,0,0,0,0|4,0,0]=4 160 B11R1.157 CN(C)Cc1cccc(c1)Cl 270004a_100102631434_100000210801 [0,0,0,0,0,0|4,0,0]=4 161 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100000184398_200000210301 [0,0,0,0,0,0|4,0,0]=4 162 B11R1.157 CN(C)Cc1cccc(c1)F 2230a_100102631434_100000230114 [0,0,0,0,0,0|4,0,0]=4 163 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100000184398_200000210301 [0,0,0,0,0,0|4,0,0]=4 164 B11R1.157 CN(C)Cc1cccc(c1)F 269982a_100102631434_100000230114 [0,0,0,0,0,0|4,0,0]=4 165 B11R1.157 CN(C)Cc1cccc(c1)F 270004a_100102631434_100000210812 [0,0,0,0,0,0|4,0,0]=4 166 B11R1.157 CN(C)Cc1cccc(c1)F 34a_100000184398_200000210301 [0,0,0,0,0,0|4,0,0]=4 167 B11R1.157 CN(C)Cc1cccc(c1)I 2230a_100102631434_100011218688 [0,0,0,0,0,0|4,0,0]=4 168 B11R1.157 CN(C)Cc1cccc(c1)I 269982a_100102631434_100011218688 [0,0,0,0,0,0|4,0,0]=4 169 B11R1.157 CN(C)Cc1cccc(c1)I 270004a_100102631434_100000014684 [0,0,0,0,0,0|4,0,0]=4 170 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100000207540_200000210301 [0,0,0,0,0,0|3,0,0]=3 171 B11R1.157 CN(C)Cc1cccc(c1)O 2230a_100102631434_100011660834 [0,0,0,0,0,0|3,0,0]=3 172 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100000207540_200000210301 [0,0,0,0,0,0|3,0,0]=3 173 B11R1.157 CN(C)Cc1cccc(c1)O 269982a_100102631434_100000084143 [0,0,0,0,0,0|3,0,0]=3 174 B11R1.157 CN(C)Cc1cccc(c1)O 270004a_100102631434_100000188321 [0,0,0,0,0,0|3,0,0]=3 175 B11R1.157 CN(C)Cc1cccc(c1)O 271570a_203496583355_100000174759 [0,0,0,0,0,0|3,0,0]=3 176 B11R1.157 CN(C)Cc1cncc(c1)O 270004a_100102631434_100012187055 [0,0,0,0,0,0|4,0,0]=4 177 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 2230a_100000187585_200025704644 [0,0,0,0,0,0|4,0,0]=4 178 B11R1.157 CN([13CH3])Cc1cccc(c1)Br 269982a_100000187585_200025704644 [0,0,0,0,0,0|4,0,0]=4 179 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 2230a_100020629429_200025704644 [0,0,0,0,0,0|4,0,0]=4 180 B11R1.157 CN([13CH3])Cc1cccc(c1)Cl 269982a_100020629429_200025704644 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.157 CN([13CH3])Cc1cccc(c1)F 2230a_100000184398_200025704644 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.157 CN([13CH3])Cc1cccc(c1)F 269982a_100000184398_200025704644 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.157 CN([13CH3])Cc1cccc(c1)F 34a_100000184398_200025704644 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.157 CN([13CH3])Cc1cccc(c1)O 2230a_100000207540_200025704644 [0,0,0,0,0,0|3,0,0]=3 185 B11R1.157 CN([13CH3])Cc1cccc(c1)O 269982a_100000207540_200025704644 [0,0,0,0,0,0|3,0,0]=3 186 B11R1.157 Cc1cc(ccn1)OC(C)C 34a_100000688365_100000210206 [0,0,0,0,0,0|3,0,1]=4 187 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [0,0,0,0,0,0|2,0,0]=2 188 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [0,0,0,0,0,0|4,0,0]=4 189 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [0,0,0,0,0,0|4,0,0]=4 190 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [0,0,0,0,0,0|4,0,0]=4 191 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [0,0,0,0,0,0|4,0,0]=4 192 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [0,0,0,0,0,0|4,0,0]=4 193 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [0,0,0,0,0,0|4,0,0]=4 194 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [0,0,0,0,0,0|4,0,0]=4 195 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [0,0,0,0,0,0|4,0,0]=4 196 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [0,0,0,0,0,0|4,0,0]=4 197 B11R1.157 Cc1cccc(c1)NC(C)C 2230a_100000188690_100000210206 [0,0,0,0,0,0|3,0,1]=4 198 B11R1.157 Cc1cccc(c1)NC(C)C 34a_100000188690_100000210206 [0,0,0,0,0,0|3,0,1]=4 199 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [0,0,0,0,0,0|2,0,1]=3 200 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [0,0,0,0,0,0|2,0,1]=3 201 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100000210206_100011215228 [0,0,0,0,0,0|2,1,1]=4 202 B11R1.157 Cc1cccc(c1)SC(C)C 62a_100011215228_100000210206 [0,0,0,0,0,0|2,1,1]=4 203 B11R1.157 Cc1cccc(n1)CC(=O)[13CH3] 1458a_100012001110_200025704644 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.157 Cc1cncc(c1)OC(C)C 34a_100011830280_100000210206 [0,0,0,0,0,0|3,0,1]=4 205 B11R1.157 Cc1cncc(c1)OC(C)C 7a_100011830280_100000210206 [0,0,0,0,0,0|3,0,1]=4 206 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [0,0,0,0,0,0|2,0,0]=2 207 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [0,0,0,0,0,0|2,0,0]=2 208 B11R1.157 Oc1cc(ccn1)OC(F)F 271570a_203496583355_100009844305 [0,0,0,0,0,0|3,0,1]=4 209 B11R1.157 Oc1cccc(c1)OC(F)F 271570a_203496583355_100000179092 [0,0,0,0,0,0|2,0,1]=3 210 B11R1.157 Oc1cccc(n1)OC(F)F 271570a_203496583355_100010172928 [0,0,0,0,0,0|3,0,1]=4 211 B11R1.157 Oc1ccnc(c1)OC(F)F 271570a_203496583355_100010184862 [0,0,0,0,0,0|3,0,1]=4 212 B11R1.157 Oc1cncc(c1)OC(F)F 271570a_203496583355_200012029600 [0,0,0,0,0,0|3,0,1]=4 213 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [0,0,0,0,0,0|2,0,0]=2 214 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [0,0,0,0,0,0|2,0,0]=2 215 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [0,0,0,0,0,0|2,0,0]=2 216 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [0,0,0,0,0,0|2,0,0]=2 217 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [0,0,0,0,0,0|1,0,0]=1 218 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Br 1458a_100010201708_200025704644 [0,0,0,0,0,0|3,0,0]=3 219 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)Cl 1458a_100000090259_200025704644 [0,0,0,0,0,0|3,0,0]=3 220 B11R1.157 [13CH3]C(=O)Cc1cccc(n1)F 1458a_100000096803_200025704644 [0,0,0,0,0,0|3,0,0]=3 221 B11R1.157 [13CH3]C(=O)Cc1ccnc(c1)Br 1458a_100010126891_200025704644 [0,0,0,0,0,0|3,0,0]=3 222 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)Br 1458a_100000239331_200025704644 [0,0,0,0,0,0|3,0,0]=3 223 B11R1.157 [13CH3]C(=O)Cc1cncc(c1)F 1458a_100011667516_200025704644 [0,0,0,0,0,0|3,0,0]=3 224 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,0,0,0,0,0|1,0,2]=4 225 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,0,0,0,0|1,0,1]=3 226 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [1,0,0,0,0,0|1,0,1]=3 227 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.10 CC=Cc1cc(ccn1)Cl 271570a_100016259895_100010167805 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.10 CC=Cc1cc(ccn1)F 271570a_100016259895_100009817058 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.10 CC=Cc1cc(ccn1)N 271570a_100016259895_100009814236 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.10 CC=Cc1cc(ccn1)O 271570a_100016259895_100000762945 [1,0,0,0,0,0|2,0,0]=3 232 B10R1.10 CC=Cc1cc(cnn1)O 271570a_100016259895_200010734679 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.10 CC=Cc1cc(ncn1)O 271570a_100016259895_100000765262 [1,0,0,0,0,0|3,0,0]=4 234 B10R1.10 CC=Cc1cc[nH]c(=O)c1 271570a_100016259895_100009816521 [1,0,0,0,0,0|2,0,1]=4 235 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.10 CC=Cc1ccc[n+](c1)[O-] 271570a_100016259895_100009815978 [1,0,0,0,0,0|2,0,1]=4 237 B10R1.10 CC=Cc1cccc(=O)[nH]1 271570a_100016259895_100000761760 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,0,0,0,0,0|2,0,0]=3 239 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,0,0,0,0,0|2,0,0]=3 240 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,0,0,0,0,0|2,0,0]=3 241 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,0,0,0,0,0|2,0,0]=3 243 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,0,0,0,0|1,0,0]=2 244 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,0,0,0,0,0|1,1,0]=3 245 B10R1.10 CC=Cc1cccc(n1)Br 271570a_100016259895_100000684672 [1,0,0,0,0,0|3,0,0]=4 246 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,0,0,0,0,0|3,0,0]=4 247 B10R1.10 CC=Cc1cccc(n1)F 271570a_100016259895_100009815982 [1,0,0,0,0,0|3,0,0]=4 248 B10R1.10 CC=Cc1cccc(n1)N 271570a_100016259895_100000740741 [1,0,0,0,0,0|3,0,0]=4 249 B10R1.10 CC=Cc1ccnc(c1)Br 271570a_100016259895_100009814637 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,0,0,0,0,0|3,0,0]=4 251 B10R1.10 CC=Cc1ccnc(c1)Cl 271570a_100016259895_100000035001 [1,0,0,0,0,0|3,0,0]=4 252 B10R1.10 CC=Cc1ccnc(c1)F 271570a_100016259895_100009816116 [1,0,0,0,0,0|3,0,0]=4 253 B10R1.10 CC=Cc1ccnc(c1)N 271570a_100016259895_100000744379 [1,0,0,0,0,0|3,0,0]=4 254 B10R1.10 CC=Cc1cncc(c1)Br 271570a_100016259895_100000728054 [1,0,0,0,0,0|3,0,0]=4 255 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,0,0,0,0,0|3,0,0]=4 256 B10R1.10 CC=Cc1cncc(c1)Cl 271570a_100016259895_100000049639 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.10 CC=Cc1cncc(c1)F 271570a_100016259895_100000744099 [1,0,0,0,0,0|3,0,0]=4 258 B10R1.10 CC=Cc1cncc(c1)N 271570a_100016259895_100000687067 [1,0,0,0,0,0|3,0,0]=4 259 B10R1.10 CC=Cc1cncc(c1)O 271570a_100016259895_100000754920 [1,0,0,0,0,0|2,0,0]=3 260 B10R1.10 CC=Cc1cncc(n1)O 271570a_100016259895_100011269956 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.10 CC=Cc1nccc(n1)O 271570a_100016259895_100011649813 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,0,0,0,0,0|1,0,1]=3 263 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [1,0,0,0,0,0|2,0,1]=4 264 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,0,0,0,0,0|2,0,1]=4 265 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,0,0,0,0,0|2,0,1]=4 266 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [1,0,0,0,0,0|2,0,1]=4 267 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [1,0,0,0,0,0|2,0,1]=4 268 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [1,0,0,0,0,0|2,0,1]=4 269 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [1,0,0,0,0,0|1,0,1]=3 270 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [1,0,0,0,0,0|1,0,1]=3 271 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [1,0,0,0,0,0|2,0,1]=4 272 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [1,0,0,0,0,0|1,0,1]=3 273 B10R1.10 CCOc1cc(ncn1)O 271570a_203496583355_100000765465 [1,0,0,0,0,0|2,0,1]=4 274 B10R1.10 CCOc1cc[nH]c(=O)c1 34a_100000032262_100000210202 [1,0,0,0,0,0|1,0,2]=4 275 B10R1.10 CCOc1ccc[n+](c1)[O-] 34a_100000039713_100000210202 [1,0,0,0,0,0|1,0,2]=4 276 B10R1.10 CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000210202 [1,0,0,0,0,0|1,0,2]=4 277 B10R1.10 CCOc1cccc(=O)[nH]1 34a_100000033347_100000210202 [1,0,0,0,0,0|1,0,2]=4 278 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [1,0,0,0,0,0|1,0,1]=3 279 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [1,0,0,0,0,0|1,0,1]=3 280 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,0,0,0,0,0|1,0,1]=3 281 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,0,0,0,0,0|1,0,1]=3 282 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [1,0,0,0,0,0|1,0,1]=3 283 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [1,0,0,0,0,0|1,0,1]=3 284 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [1,0,0,0,0,0|1,0,1]=3 285 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [1,0,0,0,0,0|1,0,1]=3 286 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [1,0,0,0,0,0|1,0,1]=3 287 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [1,0,0,0,0,0|1,0,1]=3 288 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [1,0,0,0,0,0|1,0,1]=3 289 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [1,0,0,0,0,0|0,0,1]=2 290 B10R1.10 CCOc1cccc(n1)F 34a_100011432558_100000210202 [1,0,0,0,0,0|2,0,1]=4 291 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [1,0,0,0,0,0|1,0,1]=3 292 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [1,0,0,0,0,0|2,0,1]=4 293 B10R1.10 CCOc1ccnc(c1)Cl 34a_100000762945_100000210202 [1,0,0,0,0,0|2,0,1]=4 294 B10R1.10 CCOc1ccnc(c1)F 34a_100000732698_100000210202 [1,0,0,0,0,0|2,0,1]=4 295 B10R1.10 CCOc1ccnc(c1)N 34a_100011834064_100000210202 [1,0,0,0,0,0|2,0,1]=4 296 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [1,0,0,0,0,0|1,0,1]=3 297 B10R1.10 CCOc1ccnc(n1)O 271570a_203496583355_100011649779 [1,0,0,0,0,0|2,0,1]=4 298 B10R1.10 CCOc1cncc(c1)Br 34a_100000754920_100000210202 [1,0,0,0,0,0|2,0,1]=4 299 B10R1.10 CCOc1cncc(c1)Br 7a_100000754920_100000210202 [1,0,0,0,0,0|2,0,1]=4 300 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [1,0,0,0,0,0|2,0,1]=4 301 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [1,0,0,0,0,0|2,0,1]=4 302 B10R1.10 CCOc1cncc(c1)Cl 7a_100000032511_100000210202 [1,0,0,0,0,0|2,0,1]=4 303 B10R1.10 CCOc1cncc(c1)F 34a_100011830296_100000210202 [1,0,0,0,0,0|2,0,1]=4 304 B10R1.10 CCOc1cncc(c1)F 7a_100011830296_100000210202 [1,0,0,0,0,0|2,0,1]=4 305 B10R1.10 CCOc1cncc(c1)N 34a_100011997051_100000210202 [1,0,0,0,0,0|2,0,1]=4 306 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [1,0,0,0,0,0|1,0,1]=3 307 B10R1.10 CCOc1cncc(n1)O 271570a_203496583355_100000757043 [1,0,0,0,0,0|2,0,1]=4 308 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [1,0,0,0,0,0|1,1,1]=4 309 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [1,0,0,0,0,0|1,1,1]=4 310 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [1,0,0,0,0,0|1,1,1]=4 311 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,0,0,0,0,0|1,1,1]=4 312 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,0,0,0,0,0|1,1,1]=4 313 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [1,0,0,0,0,0|1,1,1]=4 314 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [1,0,0,0,0,0|1,1,1]=4 315 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [1,0,0,0,0,0|1,1,1]=4 316 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [1,0,0,0,0,0|1,1,1]=4 317 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [1,0,0,0,0,0|1,1,1]=4 318 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [1,0,0,0,0,0|1,1,1]=4 319 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [1,0,0,0,0,0|0,1,1]=3 320 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [1,0,0,0,0,0|0,1,1]=3 321 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [1,0,0,0,0,0|0,2,1]=4 322 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [1,0,0,0,0,0|0,2,1]=4 323 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [1,0,0,0,0,0|1,1,1]=4 324 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [1,0,0,0,0,0|1,1,1]=4 325 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [1,0,0,0,0,0|3,0,0]=4 326 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,0,0,0,0,0|3,0,0]=4 327 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,0,0,0,0,0|3,0,0]=4 328 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,0,0,0,0,0|3,0,0]=4 329 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,0,0,0,0,0|3,0,0]=4 330 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,0,0,0,0,0|3,0,0]=4 331 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,0,0,0,0,0|3,0,0]=4 332 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,0,0,0,0,0|3,0,0]=4 333 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,0,0,0,0,0|3,0,0]=4 334 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,0,0,0,0,0|3,0,0]=4 335 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,0,0,0,0,0|3,0,0]=4 336 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,0,0,0,0,0|3,0,0]=4 337 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,0,0,0,0,0|3,0,0]=4 338 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,0,0,0,0,0|3,0,0]=4 339 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,0,0,0,0,0|3,0,0]=4 340 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,0,0,0,0,0|3,0,0]=4 341 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,0,0,0,0,0|3,0,0]=4 342 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,0,0,0,0,0|3,0,0]=4 343 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,0,0,0,0,0|3,0,0]=4 345 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,0,0,0,0,0|3,0,0]=4 347 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,0,0,0,0,0|3,0,0]=4 348 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,0,0,0,0,0|3,0,0]=4 350 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,0,0,0,0,0|3,0,0]=4 351 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,0,0,0,0,0|3,0,0]=4 352 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,0,0,0,0,0|3,0,0]=4 353 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,0,0,0,0,0|3,0,0]=4 354 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,0,0,0,0,0|3,0,0]=4 355 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,0,0,0,0,0|3,0,0]=4 356 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,0,0,0,0,0|3,0,0]=4 357 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,0,0,0,0,0|3,0,0]=4 358 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,0,0,0,0,0|3,0,0]=4 359 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,0,0,0,0,0|3,0,0]=4 360 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,0,0,0,0,0|3,0,0]=4 361 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,0,0,0,0,0|3,0,0]=4 362 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,0,0,0,0,0|2,0,0]=3 363 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,0,0,0,0,0|2,0,0]=3 364 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,0,0,0,0,0|2,0,0]=3 365 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,0,0,0,0,0|2,0,0]=3 366 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,0,0,0,0,0|2,0,0]=3 367 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,0,0,0,0,0|2,0,0]=3 368 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,0,0,0,0,0|2,0,0]=3 369 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,0,0,0,0,0|2,0,0]=3 370 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [1,0,0,0,0,0|3,0,0]=4 371 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [1,0,0,0,0,0|3,0,0]=4 372 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [1,0,0,0,0,0|3,0,0]=4 373 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [1,0,0,0,0,0|3,0,0]=4 374 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [1,0,0,0,0,0|3,0,0]=4 375 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,0,0,0,0,0|3,0,0]=4 376 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,0,0,0,0,0|3,0,0]=4 377 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,0,0,0,0,0|3,0,0]=4 378 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,0,0,0,0,0|3,0,0]=4 379 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,0,0,0,0,0|3,0,0]=4 380 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,0,0,0,0,0|3,0,0]=4 381 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,0,0,0,0,0|3,0,0]=4 382 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,0,0,0,0,0|3,0,0]=4 383 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,0,0,0,0,0|3,0,0]=4 384 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,0,0,0,0,0|3,0,0]=4 385 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,0,0,0,0,0|3,0,0]=4 386 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,0,0,0,0,0|3,0,0]=4 387 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,0,0,0,0,0|3,0,0]=4 388 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,0,0,0,0,0|3,0,0]=4 389 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,0,0,0,0,0|3,0,0]=4 390 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,0,0,0,0,0|3,0,0]=4 391 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,0,0,0,0,0|2,0,0]=3 392 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,0,0,0,0,0|3,0,0]=4 394 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,0,0,0,0,0|3,0,0]=4 395 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,0,0,0,0,0|3,0,0]=4 396 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,0,0,0,0,0|3,0,0]=4 397 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,0,0,0,0,0|3,0,0]=4 398 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,0,0,0,0,0|3,0,0]=4 399 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,0,0,0,0,0|3,0,0]=4 402 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,0,0,0,0,0|2,0,0]=3 404 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,0,0,0,0,0|2,0,0]=3 405 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,0,0,0,0,0|3,0,0]=4 406 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,0,0,0,0,0|3,0,0]=4 407 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,0,0,0,0,0|3,0,0]=4 408 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,0,0,0,0,0|3,0,0]=4 409 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,0,0,0,0,0|3,0,0]=4 410 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,0,0,0,0,0|3,0,0]=4 411 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [1,0,0,0,0,0|2,0,1]=4 412 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [1,0,0,0,0,0|2,0,1]=4 413 B10R1.10 FCOc1cccc(c1)Br 34a_100000210342_100015361967 [1,0,0,0,0,0|2,0,1]=4 414 B10R1.10 FCOc1cccc(c1)Br 7a_100000210342_100015361967 [1,0,0,0,0,0|2,0,1]=4 415 B10R1.10 FCOc1cccc(c1)Cl 34a_100000210295_100015361967 [1,0,0,0,0,0|2,0,1]=4 416 B10R1.10 FCOc1cccc(c1)Cl 7a_100000210295_100015361967 [1,0,0,0,0,0|2,0,1]=4 417 B10R1.10 FCOc1cccc(c1)F 34a_100000210426_100015361967 [1,0,0,0,0,0|2,0,1]=4 418 B10R1.10 FCOc1cccc(c1)F 7a_100000210426_100015361967 [1,0,0,0,0,0|2,0,1]=4 419 B10R1.10 FCOc1cccc(c1)I 34a_100000211634_100015361967 [1,0,0,0,0,0|2,0,1]=4 420 B10R1.10 FCOc1cccc(c1)I 7a_100000211634_100015361967 [1,0,0,0,0,0|2,0,1]=4 421 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [1,0,0,0,0,0|2,0,1]=4 422 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,0,0,0,0,0|2,0,1]=4 423 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,0,0,0,0,0|3,0,0]=4 424 B10R1.10 Nc1cccc(c1)OCF 34a_100000210217_100015361967 [1,0,0,0,0,0|2,0,1]=4 425 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,0,0,0,0,0|1,0,0]=2 426 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,0,0,0,0,0|1,0,2]=4 427 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [1,0,0,0,0,0|2,0,1]=4 428 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [1,0,0,0,0,0|1,1,1]=4 429 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,0,0,0,0,0|3,0,0]=4 431 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,0,0,0,0,0|3,0,0]=4 432 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,0,0,0,0,0|3,0,0]=4 435 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,0,0,0,0,0|3,0,0]=4 436 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,0,0,0,0,0|3,0,0]=4 437 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,0,0,0,0,0|2,0,0]=3 438 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,0,0,0,0,0|2,0,0]=3 439 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,0,0,0,0,0|3,0,0]=4 441 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,0,0,0,0,0|3,0,0]=4 444 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,0,0,0,0,0|3,0,0]=4 445 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,0,0,0,0,0|3,0,0]=4 446 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,0,0,0,0,0|3,0,0]=4 447 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,0,0,0,0,0|3,0,0]=4 448 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,0,0,0,0,0|3,0,0]=4 449 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,0,0,0,0,0|3,0,0]=4 450 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,0,0,0,0,0|3,0,0]=4 451 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,0,0,0,0,0|3,0,0]=4 452 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,0,0,0,0,0|3,0,0]=4 453 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,0,0,0,0,0|3,0,0]=4 454 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,0,0,0,0,0|3,0,0]=4 455 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,0,0,0,0,0|3,0,0]=4 456 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,0,0,0,0,0|2,0,0]=3 457 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,0,0,0,0,0|2,0,0]=3 458 B10R1.10 [N-]=[N+]=Nc1cccc(c1)O 271570a_203496583355_100000735707 [1,0,0,0,0,0|3,0,0]=4 459 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [1,0,0,0,0,0|2,0,0]=3 460 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [1,0,0,0,0,0|3,0,0]=4 461 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [1,0,0,0,0,0|3,0,0]=4 462 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [1,0,0,0,0,0|3,0,0]=4 463 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [1,0,0,0,0,0|2,0,0]=3 464 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [1,0,0,0,0,0|1,0,0]=2 465 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [1,0,0,0,0,0|2,0,0]=3 466 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [1,0,0,0,0,0|2,0,0]=3 467 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [1,0,0,0,0,0|2,0,0]=3 468 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [1,0,0,0,0,0|2,0,0]=3 469 B10R1.18 CC(=O)Cc1cccnn1 1458a_100000070787_100016990269 [1,0,0,0,0,0|3,0,0]=4 470 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [1,0,0,0,0,0|2,0,0]=3 471 B10R1.18 CC(=O)Cc1cnccn1 1458a_100000070787_100016995436 [1,0,0,0,0,0|3,0,0]=4 472 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000070787_100015196519 [1,0,0,0,0,0|3,0,0]=4 473 B10R1.18 CC(=O)Cc1cncnc1 1458a_100000721575_200000210301 [1,0,0,0,0,0|3,0,0]=4 474 B10R1.18 CC(=O)Cc1ncccn1 1458a_100000070787_100000703007 [1,0,0,0,0,0|3,0,0]=4 475 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [1,0,0,0,0,0|1,0,0]=2 476 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [1,0,0,0,0,0|1,0,0]=2 477 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [1,0,0,0,0,0|1,0,0]=2 478 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [1,0,0,0,0,0|1,0,0]=2 479 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [1,0,0,0,0,0|2,0,1]=4 480 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [1,0,0,0,0,0|1,0,1]=3 481 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [1,0,0,0,0,0|1,0,1]=3 482 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [1,0,0,0,0,0|2,0,1]=4 483 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [1,0,0,0,0,0|2,0,1]=4 484 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [1,0,0,0,0,0|2,0,1]=4 485 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [1,0,0,0,0,0|1,1,1]=4 486 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [1,0,0,0,0,0|1,1,1]=4 487 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [1,0,0,0,0,0|3,0,0]=4 488 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [1,0,0,0,0,0|3,0,0]=4 489 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [1,0,0,0,0,0|3,0,0]=4 490 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [1,0,0,0,0,0|3,0,0]=4 491 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [1,0,0,0,0,0|3,0,0]=4 492 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [1,0,0,0,0,0|3,0,0]=4 493 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [1,0,0,0,0,0|3,0,0]=4 494 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [1,0,0,0,0,0|2,0,0]=3 495 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [1,0,0,0,0,0|2,0,0]=3 496 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [1,0,0,0,0,0|2,0,0]=3 497 B10R1.18 [13CH3]C(=O)Cc1cncnc1 1458a_100000721575_200025704644 [1,0,0,0,0,0|3,0,0]=4 498 B12R1.19 CC(=Cc1c[nH]c(=O)c(c1)O)C 271570a_100102525489_100009814561 [0,1,0,0,0,0|3,0,0]=4 499 B12R1.19 CC(=Cc1cc(c(cn1)C)O)C 271570a_100102525489_100000704368 [0,1,0,0,0,0|3,0,0]=4 500 B12R1.19 CC(=Cc1cc(c(cn1)F)O)C 271570a_100102525489_100009854642 [0,1,0,0,0,0|3,0,0]=4 501 B12R1.19 CC(=Cc1ccc(c(c1)Br)Br)C 271570a_100102525489_100012356285 [0,1,0,0,0,0|3,0,0]=4 502 B12R1.19 CC(=Cc1ccc(c(c1)Br)C)C 271570a_100102525489_100011847877 [0,1,0,0,0,0|3,0,0]=4 503 B12R1.19 CC(=Cc1ccc(c(c1)Br)Cl)C 271570a_100102525489_100012353702 [0,1,0,0,0,0|3,0,0]=4 504 B12R1.19 CC(=Cc1ccc(c(c1)Br)F)C 271570a_100102525489_100012047266 [0,1,0,0,0,0|3,0,0]=4 505 B12R1.19 CC(=Cc1ccc(c(c1)Br)N)C 271570a_100102525489_100000750455 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.19 CC(=Cc1ccc(c(c1)Br)O)C 271570a_100102525489_100012361655 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.19 CC(=Cc1ccc(c(c1)C)Br)C 271570a_100102525489_100009813585 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.19 CC(=Cc1ccc(c(c1)C)C)C 271570a_100102525489_100011215607 [0,1,0,0,0,0|3,0,0]=4 509 B12R1.19 CC(=Cc1ccc(c(c1)C)Cl)C 271570a_100102525489_100000049509 [0,1,0,0,0,0|3,0,0]=4 510 B12R1.19 CC(=Cc1ccc(c(c1)C)F)C 271570a_100102525489_100011218330 [0,1,0,0,0,0|3,0,0]=4 511 B12R1.19 CC(=Cc1ccc(c(c1)C)N)C 271570a_100102525489_100000211769 [0,1,0,0,0,0|3,0,0]=4 512 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [0,1,0,0,0,0|3,0,0]=4 513 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Br)C 271570a_100102525489_100012047281 [0,1,0,0,0,0|3,0,0]=4 514 B12R1.19 CC(=Cc1ccc(c(c1)Cl)C)C 271570a_100102525489_100011216363 [0,1,0,0,0,0|3,0,0]=4 515 B12R1.19 CC(=Cc1ccc(c(c1)Cl)Cl)C 271570a_100102525489_100011214914 [0,1,0,0,0,0|3,0,0]=4 516 B12R1.19 CC(=Cc1ccc(c(c1)Cl)F)C 271570a_100102525489_100011215976 [0,1,0,0,0,0|3,0,0]=4 517 B12R1.19 CC(=Cc1ccc(c(c1)Cl)N)C 271570a_100102525489_100011218065 [0,1,0,0,0,0|3,0,0]=4 518 B12R1.19 CC(=Cc1ccc(c(c1)Cl)O)C 271570a_100102525489_100012360047 [0,1,0,0,0,0|3,0,0]=4 519 B12R1.19 CC(=Cc1ccc(c(c1)F)Br)C 271570a_100102525489_100000685389 [0,1,0,0,0,0|3,0,0]=4 520 B12R1.19 CC(=Cc1ccc(c(c1)F)C)C 271570a_100102525489_100000720648 [0,1,0,0,0,0|3,0,0]=4 521 B12R1.19 CC(=Cc1ccc(c(c1)F)Cl)C 271570a_100102525489_100011216805 [0,1,0,0,0,0|3,0,0]=4 522 B12R1.19 CC(=Cc1ccc(c(c1)F)F)C 271570a_100102525489_100000750028 [0,1,0,0,0,0|3,0,0]=4 523 B12R1.19 CC(=Cc1ccc(c(c1)F)N)C 271570a_100102525489_100011215594 [0,1,0,0,0,0|3,0,0]=4 524 B12R1.19 CC(=Cc1ccc(c(c1)F)O)C 271570a_100102525489_100000185481 [0,1,0,0,0,0|3,0,0]=4 525 B12R1.19 CC(=Cc1ccc(c(c1)N)Br)C 271570a_100102525489_100000750456 [0,1,0,0,0,0|3,0,0]=4 526 B12R1.19 CC(=Cc1ccc(c(c1)N)C)C 271570a_100102525489_100000761890 [0,1,0,0,0,0|3,0,0]=4 527 B12R1.19 CC(=Cc1ccc(c(c1)N)Cl)C 271570a_100102525489_200000761891 [0,1,0,0,0,0|3,0,0]=4 528 B12R1.19 CC(=Cc1ccc(c(c1)N)F)C 271570a_100102525489_100000740924 [0,1,0,0,0,0|3,0,0]=4 529 B12R1.19 CC(=Cc1ccc(c(c1)N)N)C 271570a_100102525489_100000741789 [0,1,0,0,0,0|3,0,0]=4 530 B12R1.19 CC(=Cc1ccc(c(c1)N)O)C 271570a_100102525489_100000752626 [0,1,0,0,0,0|3,0,0]=4 531 B12R1.19 CC(=Cc1ccc(c(c1)O)Br)C 271570a_100102525489_100012356990 [0,1,0,0,0,0|2,0,0]=3 532 B12R1.19 CC(=Cc1ccc(c(c1)O)C)C 271570a_100102525489_100000766334 [0,1,0,0,0,0|2,0,0]=3 533 B12R1.19 CC(=Cc1ccc(c(c1)O)Cl)C 271570a_100102525489_100011356854 [0,1,0,0,0,0|2,0,0]=3 534 B12R1.19 CC(=Cc1ccc(c(c1)O)F)C 271570a_100102525489_100000686035 [0,1,0,0,0,0|2,0,0]=3 535 B12R1.19 CC(=Cc1ccc(c(c1)O)N)C 271570a_100102525489_100000739049 [0,1,0,0,0,0|2,0,0]=3 536 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [0,1,0,0,0,0|2,0,0]=3 537 B12R1.19 CC(=Cc1ccc(c(n1)O)F)C 271570a_100102525489_100010729010 [0,1,0,0,0,0|3,0,0]=4 538 B12R1.19 CC(=Cc1ccc(c(n1)O)N)C 271570a_100102525489_100000718904 [0,1,0,0,0,0|3,0,0]=4 539 B12R1.19 CC(=Cc1cnc(c(c1)O)C)C 271570a_100102525489_100009864810 [0,1,0,0,0,0|3,0,0]=4 540 B12R1.19 CC(=Cc1cnc(c(c1)O)F)C 271570a_100102525489_100009819871 [0,1,0,0,0,0|3,0,0]=4 541 B12R1.19 CC(=Cc1cnc(c(c1)O)N)C 271570a_100102525489_100009819042 [0,1,0,0,0,0|3,0,0]=4 542 B12R1.19 CC(=O)Cc1cc(=O)c(co1)O 1458a_100000070787_100000010605 [0,1,0,0,0,0|2,0,1]=4 543 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000070787_100012353900 [0,1,0,0,0,0|2,0,0]=3 544 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000070787_100012232412 [0,1,0,0,0,0|2,0,0]=3 545 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_200000210301 [0,1,0,0,0,0|2,0,0]=3 546 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000070787_100012353894 [0,1,0,0,0,0|2,0,0]=3 547 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200000210301 [0,1,0,0,0,0|2,0,0]=3 548 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000070787_100011206884 [0,1,0,0,0,0|2,0,0]=3 549 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200000210301 [0,1,0,0,0,0|2,0,0]=3 550 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [0,1,0,0,0,0|2,0,0]=3 551 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [0,1,0,0,0,0|2,0,0]=3 552 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [0,1,0,0,0,0|2,0,0]=3 553 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [0,1,0,0,0,0|2,0,0]=3 554 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [0,1,0,0,0,0|2,0,0]=3 555 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [0,1,0,0,0,0|2,0,0]=3 556 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [0,1,0,0,0,0|2,0,0]=3 557 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [0,1,0,0,0,0|2,0,0]=3 558 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [0,1,0,0,0,0|2,0,0]=3 559 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000070787_100012353895 [0,1,0,0,0,0|2,0,0]=3 560 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200000210301 [0,1,0,0,0,0|2,0,0]=3 561 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000070787_100011823929 [0,1,0,0,0,0|2,0,0]=3 562 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000070787_100000184707 [0,1,0,0,0,0|2,0,0]=3 563 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200000210301 [0,1,0,0,0,0|2,0,0]=3 564 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000070787_100000717365 [0,1,0,0,0,0|2,0,0]=3 565 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200000210301 [0,1,0,0,0,0|2,0,0]=3 566 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000070787_100012349665 [0,1,0,0,0,0|2,0,0]=3 567 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [0,1,0,0,0,0|2,0,0]=3 568 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000070787_100000767054 [0,1,0,0,0,0|2,0,0]=3 569 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200000210301 [0,1,0,0,0,0|2,0,0]=3 570 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100000070787_100011217369 [0,1,0,0,0,0|2,0,0]=3 571 B12R1.19 CC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_200000210301 [0,1,0,0,0,0|2,0,0]=3 572 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000070787_100000716492 [0,1,0,0,0,0|2,0,0]=3 573 B12R1.19 CC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200000210301 [0,1,0,0,0,0|2,0,0]=3 574 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000070787_100000757363 [0,1,0,0,0,0|2,0,0]=3 575 B12R1.19 CC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200000210301 [0,1,0,0,0,0|2,0,0]=3 576 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100000070787_100010149604 [0,1,0,0,0,0|2,0,0]=3 577 B12R1.19 CC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200000210301 [0,1,0,0,0,0|2,0,0]=3 578 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [0,1,0,0,0,0|2,0,0]=3 579 B12R1.19 CC(=O)Cc1ccc(c(c1)I)Br 1458a_100000070787_100010146616 [0,1,0,0,0,0|2,0,0]=3 580 B12R1.19 CC(=O)Cc1ccc(c(c1)I)C 1458a_100000070787_100010206137 [0,1,0,0,0,0|2,0,0]=3 581 B12R1.19 CC(=O)Cc1ccc(c(c1)I)F 1458a_100000070787_100010188208 [0,1,0,0,0,0|2,0,0]=3 582 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [0,1,0,0,0,0|1,0,0]=2 583 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [0,1,0,0,0,0|1,0,0]=2 584 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [0,1,0,0,0,0|1,0,0]=2 585 B12R1.19 CC(=O)Cc1cnc(c(c1)Br)F 1458a_100000070787_200010066439 [0,1,0,0,0,0|3,0,0]=4 586 B12R1.19 CC(=O)Cc1cnc(c(c1)Cl)Cl 1458a_100000070787_100009843750 [0,1,0,0,0,0|3,0,0]=4 587 B12R1.19 CC(=O)Cc1cnc(c(c1)I)Cl 1458a_100000070787_100011072623 [0,1,0,0,0,0|3,0,0]=4 588 B12R1.19 CC(=O)Nc1cc(c(cn1)O)C 271570a_203496583355_100011934553 [0,1,0,0,0,0|3,0,0]=4 589 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100015343762 [0,1,0,0,0,0|2,0,0]=3 590 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100015343762 [0,1,0,0,0,0|2,0,0]=3 591 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000070787 [0,1,0,0,0,0|2,0,0]=3 592 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100103153847 [0,1,0,0,0,0|2,0,0]=3 593 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100015343762 [0,1,0,0,0,0|2,0,0]=3 594 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100015343762 [0,1,0,0,0,0|2,0,0]=3 595 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000070787 [0,1,0,0,0,0|2,0,0]=3 596 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100103153847 [0,1,0,0,0,0|2,0,0]=3 597 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100015343762 [0,1,0,0,0,0|2,0,0]=3 598 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100015343762 [0,1,0,0,0,0|2,0,0]=3 599 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000070787 [0,1,0,0,0,0|2,0,0]=3 600 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100103153847 [0,1,0,0,0,0|2,0,0]=3 601 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100015343762 [0,1,0,0,0,0|2,0,0]=3 602 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100015343762 [0,1,0,0,0,0|2,0,0]=3 603 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000070787 [0,1,0,0,0,0|2,0,0]=3 604 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100103153847 [0,1,0,0,0,0|2,0,0]=3 605 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100015343762 [0,1,0,0,0,0|2,0,0]=3 606 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100015343762 [0,1,0,0,0,0|2,0,0]=3 607 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000070787 [0,1,0,0,0,0|2,0,0]=3 608 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100103153847 [0,1,0,0,0,0|2,0,0]=3 609 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000070787 [0,1,0,0,0,0|2,0,0]=3 610 B12R1.19 CC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100103153847 [0,1,0,0,0,0|2,0,0]=3 611 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100015343762 [0,1,0,0,0,0|2,0,0]=3 612 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100015343762 [0,1,0,0,0,0|2,0,0]=3 613 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000070787 [0,1,0,0,0,0|2,0,0]=3 614 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100103153847 [0,1,0,0,0,0|2,0,0]=3 615 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100015343762 [0,1,0,0,0,0|2,0,0]=3 616 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100015343762 [0,1,0,0,0,0|2,0,0]=3 617 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000070787 [0,1,0,0,0,0|2,0,0]=3 618 B12R1.19 CC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100103153847 [0,1,0,0,0,0|2,0,0]=3 619 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100015343762 [0,1,0,0,0,0|2,0,0]=3 620 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100015343762 [0,1,0,0,0,0|2,0,0]=3 621 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000070787 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.19 CC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100103153847 [0,1,0,0,0,0|2,0,0]=3 623 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100015343762 [0,1,0,0,0,0|2,0,0]=3 624 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100015343762 [0,1,0,0,0,0|2,0,0]=3 625 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000070787 [0,1,0,0,0,0|2,0,0]=3 626 B12R1.19 CC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100103153847 [0,1,0,0,0,0|2,0,0]=3 627 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100015343762 [0,1,0,0,0,0|2,0,0]=3 628 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100015343762 [0,1,0,0,0,0|2,0,0]=3 629 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000070787 [0,1,0,0,0,0|2,0,0]=3 630 B12R1.19 CC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100103153847 [0,1,0,0,0,0|2,0,0]=3 631 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [0,1,0,0,0,0|2,0,0]=3 632 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [0,1,0,0,0,0|2,0,0]=3 633 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [0,1,0,0,0,0|2,0,0]=3 634 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100015343762 [0,1,0,0,0,0|2,0,0]=3 636 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100015343762 [0,1,0,0,0,0|2,0,0]=3 637 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000070787 [0,1,0,0,0,0|2,0,0]=3 638 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100103153847 [0,1,0,0,0,0|2,0,0]=3 639 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100015343762 [0,1,0,0,0,0|2,0,0]=3 640 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100015343762 [0,1,0,0,0,0|2,0,0]=3 641 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000070787 [0,1,0,0,0,0|2,0,0]=3 642 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100103153847 [0,1,0,0,0,0|2,0,0]=3 643 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100015343762 [0,1,0,0,0,0|2,0,0]=3 644 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100015343762 [0,1,0,0,0,0|2,0,0]=3 645 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000070787 [0,1,0,0,0,0|2,0,0]=3 646 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100103153847 [0,1,0,0,0,0|2,0,0]=3 647 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100015343762 [0,1,0,0,0,0|2,0,0]=3 648 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100015343762 [0,1,0,0,0,0|2,0,0]=3 649 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000070787 [0,1,0,0,0,0|2,0,0]=3 650 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100103153847 [0,1,0,0,0,0|2,0,0]=3 651 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100015343762 [0,1,0,0,0,0|2,0,0]=3 652 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100015343762 [0,1,0,0,0,0|2,0,0]=3 653 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000070787 [0,1,0,0,0,0|2,0,0]=3 654 B12R1.19 CC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000070787 [0,1,0,0,0,0|2,0,0]=3 655 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100015343762 [0,1,0,0,0,0|2,0,0]=3 656 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100015343762 [0,1,0,0,0,0|2,0,0]=3 657 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000070787 [0,1,0,0,0,0|2,0,0]=3 658 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100103153847 [0,1,0,0,0,0|2,0,0]=3 659 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100015343762 [0,1,0,0,0,0|2,0,0]=3 660 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100015343762 [0,1,0,0,0,0|2,0,0]=3 661 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000070787 [0,1,0,0,0,0|2,0,0]=3 662 B12R1.19 CC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100103153847 [0,1,0,0,0,0|2,0,0]=3 663 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100015343762 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100015343762 [0,1,0,0,0,0|2,0,0]=3 665 B12R1.19 CC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000070787 [0,1,0,0,0,0|2,0,0]=3 666 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100015343762 [0,1,0,0,0,0|2,0,0]=3 667 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100015343762 [0,1,0,0,0,0|2,0,0]=3 668 B12R1.19 CC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000070787 [0,1,0,0,0,0|2,0,0]=3 669 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100015343762 [0,1,0,0,0,0|2,0,0]=3 670 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100015343762 [0,1,0,0,0,0|2,0,0]=3 671 B12R1.19 CC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000070787 [0,1,0,0,0,0|2,0,0]=3 672 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000070787 [0,1,0,0,0,0|2,0,0]=3 673 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 271570a_203496583355_100011219590 [0,1,0,0,0,0|2,0,0]=3 674 B12R1.19 CC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100103153847 [0,1,0,0,0,0|2,0,0]=3 675 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100015343762 [0,1,0,0,0,0|2,0,0]=3 676 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100015343762 [0,1,0,0,0,0|2,0,0]=3 677 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000070787 [0,1,0,0,0,0|2,0,0]=3 678 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100103153847 [0,1,0,0,0,0|2,0,0]=3 679 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100015343762 [0,1,0,0,0,0|2,0,0]=3 680 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100015343762 [0,1,0,0,0,0|2,0,0]=3 681 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000070787 [0,1,0,0,0,0|2,0,0]=3 682 B12R1.19 CC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100103153847 [0,1,0,0,0,0|2,0,0]=3 683 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100015343762 [0,1,0,0,0,0|2,0,0]=3 684 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100015343762 [0,1,0,0,0,0|2,0,0]=3 685 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000070787 [0,1,0,0,0,0|2,0,0]=3 686 B12R1.19 CC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100103153847 [0,1,0,0,0,0|2,0,0]=3 687 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100015343762 [0,1,0,0,0,0|2,0,0]=3 688 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100015343762 [0,1,0,0,0,0|2,0,0]=3 689 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000070787 [0,1,0,0,0,0|2,0,0]=3 690 B12R1.19 CC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100103153847 [0,1,0,0,0,0|2,0,0]=3 691 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100015343762 [0,1,0,0,0,0|1,0,0]=2 692 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000070787 [0,1,0,0,0,0|1,0,0]=2 693 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 271570a_203496583355_100011221169 [0,1,0,0,0,0|1,0,0]=2 694 B12R1.19 CC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100103153847 [0,1,0,0,0,0|1,0,0]=2 695 B12R1.19 CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000070787 [0,1,0,0,0,0|1,0,0]=2 696 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000070787 [0,1,0,0,0,0|1,0,0]=2 697 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348134 [0,1,0,0,0,0|1,0,0]=2 698 B12R1.19 CC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100103153847 [0,1,0,0,0,0|1,0,0]=2 699 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [0,1,0,0,0,0|1,0,0]=2 700 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [0,1,0,0,0,0|1,0,0]=2 701 B12R1.19 CC(=O)Nc1ccc(c(n1)C)O 271570a_203496583355_100000187074 [0,1,0,0,0,0|3,0,0]=4 702 B12R1.19 CC(=O)Nc1ccc(c(n1)F)O 271570a_203496583355_100000050017 [0,1,0,0,0,0|3,0,0]=4 703 B12R1.19 CC(=O)Oc1ccc(c(c1)O)C 271570a_203496583355_200025702335 [0,1,0,0,0,0|0,0,0]=1 704 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [0,1,0,0,0,0|2,0,1]=4 705 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [0,1,0,0,0,0|2,0,1]=4 706 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [0,1,0,0,0,0|2,0,1]=4 707 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [0,1,0,0,0,0|2,0,1]=4 708 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl 34a_100011933957_100000210206 [0,1,0,0,0,0|2,0,1]=4 709 B12R1.19 CC(C)Oc1ccc(c(c1)Br)Cl 7a_100011933957_100000210206 [0,1,0,0,0,0|2,0,1]=4 710 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 34a_100000693481_100000210206 [0,1,0,0,0,0|2,0,1]=4 711 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 7a_100000693481_100000210206 [0,1,0,0,0,0|2,0,1]=4 712 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I 34a_100000701344_100000210206 [0,1,0,0,0,0|2,0,1]=4 713 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I 7a_100000701344_100000210206 [0,1,0,0,0,0|2,0,1]=4 714 B12R1.19 CC(C)Oc1ccc(c(c1)Br)N 34a_100012001276_100000210206 [0,1,0,0,0,0|2,0,1]=4 715 B12R1.19 CC(C)Oc1ccc(c(c1)Br)N 7a_100012001276_100000210206 [0,1,0,0,0,0|2,0,1]=4 716 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 34a_100011215161_100000210206 [0,1,0,0,0,0|2,0,1]=4 717 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 7a_100011215161_100000210206 [0,1,0,0,0,0|2,0,1]=4 718 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210206 [0,1,0,0,0,0|2,0,1]=4 719 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210206 [0,1,0,0,0,0|2,0,1]=4 720 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 34a_100000211030_100000210206 [0,1,0,0,0,0|2,0,1]=4 721 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 7a_100000211030_100000210206 [0,1,0,0,0,0|2,0,1]=4 722 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 34a_100000047559_100000210206 [0,1,0,0,0,0|2,0,1]=4 723 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 7a_100000047559_100000210206 [0,1,0,0,0,0|2,0,1]=4 724 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)N 34a_100011215599_100000210206 [0,1,0,0,0,0|2,0,1]=4 725 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)N 7a_100011215599_100000210206 [0,1,0,0,0,0|2,0,1]=4 726 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br 34a_100000755031_100000210206 [0,1,0,0,0,0|2,0,1]=4 727 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br 7a_100000755031_100000210206 [0,1,0,0,0,0|2,0,1]=4 728 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl 34a_100000691581_100000210206 [0,1,0,0,0,0|2,0,1]=4 729 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl 7a_100000691581_100000210206 [0,1,0,0,0,0|2,0,1]=4 730 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 34a_100000181275_100000210206 [0,1,0,0,0,0|2,0,1]=4 731 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 7a_100000181275_100000210206 [0,1,0,0,0,0|2,0,1]=4 732 B12R1.19 CC(C)Oc1ccc(c(c1)F)I 34a_100009990212_100000210206 [0,1,0,0,0,0|2,0,1]=4 733 B12R1.19 CC(C)Oc1ccc(c(c1)F)I 7a_100009990212_100000210206 [0,1,0,0,0,0|2,0,1]=4 734 B12R1.19 CC(C)Oc1ccc(c(c1)F)N 34a_100000759473_100000210206 [0,1,0,0,0,0|2,0,1]=4 735 B12R1.19 CC(C)Oc1ccc(c(c1)F)N 7a_100000759473_100000210206 [0,1,0,0,0,0|2,0,1]=4 736 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [0,1,0,0,0,0|2,0,1]=4 737 B12R1.19 CC(C)Oc1ccc(c(c1)I)Br 34a_100012339312_100000210206 [0,1,0,0,0,0|2,0,1]=4 738 B12R1.19 CC(C)Oc1ccc(c(c1)I)Br 7a_100012339312_100000210206 [0,1,0,0,0,0|2,0,1]=4 739 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl 34a_100000049588_100000210206 [0,1,0,0,0,0|2,0,1]=4 740 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl 7a_100000049588_100000210206 [0,1,0,0,0,0|2,0,1]=4 741 B12R1.19 CC(C)Oc1ccc(c(c1)I)N 34a_100010084370_100000210206 [0,1,0,0,0,0|2,0,1]=4 742 B12R1.19 CC(C)Oc1ccc(c(c1)I)N 7a_100010084370_100000210206 [0,1,0,0,0,0|2,0,1]=4 743 B12R1.19 CC(C)Oc1ccc(c(c1)N)Br 34a_100011999798_100000210206 [0,1,0,0,0,0|2,0,1]=4 744 B12R1.19 CC(C)Oc1ccc(c(c1)N)Br 7a_100011999798_100000210206 [0,1,0,0,0,0|2,0,1]=4 745 B12R1.19 CC(C)Oc1ccc(c(c1)N)Cl 34a_100011934297_100000210206 [0,1,0,0,0,0|2,0,1]=4 746 B12R1.19 CC(C)Oc1ccc(c(c1)N)F 34a_100012017239_100000210206 [0,1,0,0,0,0|2,0,1]=4 747 B12R1.19 CC(C)Oc1ccc(c(c1)N)F 7a_100012017239_100000210206 [0,1,0,0,0,0|2,0,1]=4 748 B12R1.19 CC(C)Oc1ccc(c(c1)N)N 34a_100025771000_100000210206 [0,1,0,0,0,0|2,0,1]=4 749 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [0,1,0,0,0,0|1,1,1]=4 750 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [0,1,0,0,0,0|1,1,1]=4 751 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [0,1,0,0,0,0|1,1,1]=4 752 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [0,1,0,0,0,0|1,1,1]=4 753 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [0,1,0,0,0,0|1,1,1]=4 754 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [0,1,0,0,0,0|1,1,1]=4 755 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [0,1,0,0,0,0|1,1,1]=4 756 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [0,1,0,0,0,0|1,1,1]=4 757 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [0,1,0,0,0,0|1,1,1]=4 758 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [0,1,0,0,0,0|2,0,0]=3 759 B12R1.19 Cc1cc(ccc1Br)OC(C)C 34a_100000690111_100000210206 [0,1,0,0,0,0|2,0,1]=4 760 B12R1.19 Cc1cc(ccc1Br)OC(C)C 7a_100000690111_100000210206 [0,1,0,0,0,0|2,0,1]=4 761 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 34a_100000211092_100000210206 [0,1,0,0,0,0|2,0,1]=4 762 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 7a_100000211092_100000210206 [0,1,0,0,0,0|2,0,1]=4 763 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [0,1,0,0,0,0|2,0,0]=3 764 B12R1.19 Cc1cc(ccc1F)OC(C)C 34a_100000751312_100000210206 [0,1,0,0,0,0|2,0,1]=4 765 B12R1.19 Cc1cc(ccc1F)OC(C)C 7a_100000751312_100000210206 [0,1,0,0,0,0|2,0,1]=4 766 B12R1.19 Cc1cc(ccc1I)OC(C)C 34a_100000729255_100000210206 [0,1,0,0,0,0|2,0,1]=4 767 B12R1.19 Cc1cc(ccc1I)OC(C)C 7a_100000729255_100000210206 [0,1,0,0,0,0|2,0,1]=4 768 B12R1.19 Cc1cc(ccc1N)OC(C)C 34a_100000756630_100000210206 [0,1,0,0,0,0|2,0,1]=4 769 B12R1.19 Cc1cc(ccc1N)OC(C)C 7a_100000756630_100000210206 [0,1,0,0,0,0|2,0,1]=4 770 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [0,1,0,0,0,0|2,0,0]=3 771 B12R1.19 Cc1cc(ccc1O)NC(=O)N 271570a_203496583355_100000238934 [0,1,0,0,0,0|3,0,0]=4 772 B12R1.19 Cc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100000709925_200025704644 [0,1,0,0,0,0|2,0,0]=3 773 B12R1.19 Cc1ccc(cc1Br)OC(C)C 34a_100011380479_100000210206 [0,1,0,0,0,0|2,0,1]=4 774 B12R1.19 Cc1ccc(cc1Br)OC(C)C 7a_100011380479_100000210206 [0,1,0,0,0,0|2,0,1]=4 775 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [0,1,0,0,0,0|2,0,0]=3 776 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [0,1,0,0,0,0|2,0,1]=4 777 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [0,1,0,0,0,0|2,0,1]=4 778 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 34a_100011265682_100000210206 [0,1,0,0,0,0|2,0,1]=4 779 B12R1.19 Cc1ccc(cc1Cl)OC(C)C 7a_100011265682_100000210206 [0,1,0,0,0,0|2,0,1]=4 780 B12R1.19 Cc1ccc(cc1F)CC(=O)[13CH3] 1458a_100011217375_200025704644 [0,1,0,0,0,0|2,0,0]=3 781 B12R1.19 Cc1ccc(cc1F)OC(C)C 34a_100000722560_100000210206 [0,1,0,0,0,0|2,0,1]=4 782 B12R1.19 Cc1ccc(cc1F)OC(C)C 7a_100000722560_100000210206 [0,1,0,0,0,0|2,0,1]=4 783 B12R1.19 Cc1ccc(cc1N)OC(C)C 34a_100011216113_100000210206 [0,1,0,0,0,0|2,0,1]=4 784 B12R1.19 Cc1ccc(cc1N)OC(C)C 7a_100011216113_100000210206 [0,1,0,0,0,0|2,0,1]=4 785 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [0,1,0,0,0,0|1,0,0]=2 786 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [0,1,0,0,0,0|2,0,1]=4 787 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [0,1,0,0,0,0|2,0,1]=4 788 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [0,1,0,0,0,0|1,0,1]=3 789 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [0,1,0,0,0,0|1,1,1]=4 790 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [0,1,0,0,0,0|1,1,1]=4 791 B12R1.19 Nc1ccc(cc1O)OC(F)F 271570a_203496583355_100010212270 [0,1,0,0,0,0|2,0,1]=4 792 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_200025704644 [0,1,0,0,0,0|2,0,0]=3 793 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_200025704644 [0,1,0,0,0,0|2,0,0]=3 794 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [0,1,0,0,0,0|2,0,0]=3 795 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_200025704644 [0,1,0,0,0,0|2,0,0]=3 796 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_200025704644 [0,1,0,0,0,0|2,0,0]=3 797 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_200025704644 [0,1,0,0,0,0|2,0,0]=3 798 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [0,1,0,0,0,0|2,0,0]=3 799 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_200025704644 [0,1,0,0,0,0|2,0,0]=3 800 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_200025704644 [0,1,0,0,0,0|2,0,0]=3 801 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_200025704644 [0,1,0,0,0,0|2,0,0]=3 802 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_200025704644 [0,1,0,0,0,0|2,0,0]=3 803 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [0,1,0,0,0,0|2,0,0]=3 804 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [0,1,0,0,0,0|1,0,0]=2 805 B12R1.50 C#CC(=O)Cc1cccc(c1)Br 1458a_100000211873_100000211773 [0,1,0,0,0,0|2,0,1]=4 806 B12R1.50 C#CC(=O)Cc1cccc(c1)C 1458a_100000211873_100000211840 [0,1,0,0,0,0|2,0,1]=4 807 B12R1.50 C#CC(=O)Cc1cccc(c1)Cl 1458a_100000211873_100000181238 [0,1,0,0,0,0|2,0,1]=4 808 B12R1.50 C#CC(=O)Cc1cccc(c1)F 1458a_100000211873_100000230114 [0,1,0,0,0,0|2,0,1]=4 809 B12R1.50 C#CC(=O)Cc1cccc(c1)I 1458a_100000211873_100011218688 [0,1,0,0,0,0|2,0,1]=4 810 B12R1.50 C#CC(=O)Cc1cccc(c1)O 1458a_100000211873_100011660834 [0,1,0,0,0,0|1,0,1]=3 811 B12R1.50 C#CC(C)Nc1cccc(c1)O 34a_100000210217_200000035995 [0,1,0,0,0,0|2,0,1]=4 812 B12R1.50 C#CC(C)Oc1cccc(c1)Br 34a_100000210342_200000035995 [0,1,0,0,0,0|2,0,1]=4 813 B12R1.50 C#CC(C)Oc1cccc(c1)C 34a_100000210337_200000035995 [0,1,0,0,0,0|2,0,1]=4 814 B12R1.50 C#CC(C)Oc1cccc(c1)Cl 34a_100000210295_200000035995 [0,1,0,0,0,0|2,0,1]=4 815 B12R1.50 C#CC(C)Oc1cccc(c1)F 34a_100000210426_200000035995 [0,1,0,0,0,0|2,0,1]=4 816 B12R1.50 C#CC(C)Oc1cccc(c1)I 34a_100000211634_200000035995 [0,1,0,0,0,0|2,0,1]=4 817 B12R1.50 C#CC(C)Oc1cccc(c1)N 34a_100000210217_200000035995 [0,1,0,0,0,0|2,0,1]=4 818 B12R1.50 C#CC(C)Sc1cccc(c1)O 62a_200000035995_100000211634 [0,1,0,0,0,0|1,1,1]=4 819 B12R1.50 C=CC(=O)Cc1cccc(c1)Br 1458a_100000185746_100000211773 [0,1,0,0,0,0|2,0,1]=4 820 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [0,1,0,0,0,0|2,0,1]=4 821 B12R1.50 C=CC(=O)Cc1cccc(c1)Cl 1458a_100000185746_100000181238 [0,1,0,0,0,0|2,0,1]=4 822 B12R1.50 C=CC(=O)Cc1cccc(c1)F 1458a_100000185746_100000230114 [0,1,0,0,0,0|2,0,1]=4 823 B12R1.50 C=CC(=O)Cc1cccc(c1)I 1458a_100000185746_100011218688 [0,1,0,0,0,0|2,0,1]=4 824 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [0,1,0,0,0,0|1,0,1]=3 825 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185746 [0,1,0,0,0,0|2,0,1]=4 826 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000185746 [0,1,0,0,0,0|2,0,1]=4 827 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [0,1,0,0,0,0|2,0,1]=4 828 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [0,1,0,0,0,0|2,0,1]=4 829 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185746 [0,1,0,0,0,0|2,0,1]=4 830 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185746 [0,1,0,0,0,0|2,0,1]=4 831 B12R1.50 C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000185746 [0,1,0,0,0,0|2,0,1]=4 832 B12R1.50 C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000185746 [0,1,0,0,0,0|2,0,1]=4 833 B12R1.50 C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000185746 [0,1,0,0,0,0|2,0,1]=4 834 B12R1.50 C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000185746 [0,1,0,0,0,0|2,0,1]=4 835 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [0,1,0,0,0,0|1,0,1]=3 836 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [0,1,0,0,0,0|1,0,1]=3 837 B12R1.50 C=CC(C)Sc1cccc(c1)O 62a_100011215867_100000211634 [0,1,0,0,0,0|1,1,1]=4 838 B12R1.50 CC(=Cc1cccc(c1)Br)C#N 6a_100000210085_200000212204 [0,1,0,0,0,0|3,0,0]=4 839 B12R1.50 CC(=Cc1cccc(c1)F)C#N 6a_100000210812_200000212204 [0,1,0,0,0,0|3,0,0]=4 840 B12R1.50 CC(=Cc1cccc(c1)I)C#N 6a_100000014684_200000212204 [0,1,0,0,0,0|3,0,0]=4 841 B12R1.50 CC(C#N)Oc1cccc(c1)Br 7a_100000210342_100000703298 [0,1,0,0,0,0|2,0,1]=4 842 B12R1.50 CC(C#N)Oc1cccc(c1)Cl 7a_100000210295_100000703298 [0,1,0,0,0,0|2,0,1]=4 843 B12R1.50 CC(C#N)Oc1cccc(c1)F 7a_100000210426_100000703298 [0,1,0,0,0,0|2,0,1]=4 844 B12R1.50 CC(C#N)Oc1cccc(c1)I 7a_100000211634_100000703298 [0,1,0,0,0,0|2,0,1]=4 845 B12R1.50 CC(C#N)Sc1cccc(c1)O 62a_100000703298_100000211634 [0,1,0,0,0,0|1,1,1]=4 846 B12R1.50 CC(CO)Nc1cccc(c1)O 34a_100000210217_100012180447 [0,1,0,0,0,0|1,0,2]=4 847 B12R1.50 CC(CO)Oc1cccc(c1)Br 34a_100000210342_100012180447 [0,1,0,0,0,0|1,0,2]=4 848 B12R1.50 CC(CO)Oc1cccc(c1)Br 7a_100000210342_100012180447 [0,1,0,0,0,0|1,0,2]=4 849 B12R1.50 CC(CO)Oc1cccc(c1)Cl 34a_100000210295_100012180447 [0,1,0,0,0,0|1,0,2]=4 850 B12R1.50 CC(CO)Oc1cccc(c1)Cl 7a_100000210295_100012180447 [0,1,0,0,0,0|1,0,2]=4 851 B12R1.50 CC(CO)Oc1cccc(c1)F 34a_100000210426_100012180447 [0,1,0,0,0,0|1,0,2]=4 852 B12R1.50 CC(CO)Oc1cccc(c1)F 7a_100000210426_100012180447 [0,1,0,0,0,0|1,0,2]=4 853 B12R1.50 CC(CO)Oc1cccc(c1)I 34a_100000211634_100012180447 [0,1,0,0,0,0|1,0,2]=4 854 B12R1.50 CC(CO)Oc1cccc(c1)I 7a_100000211634_100012180447 [0,1,0,0,0,0|1,0,2]=4 855 B12R1.50 CC(CO)Oc1cccc(c1)N 34a_100000210217_100012180447 [0,1,0,0,0,0|1,0,2]=4 856 B12R1.50 CC(CO)Sc1cccc(c1)O 62a_100012180447_100000211634 [0,1,0,0,0,0|0,1,2]=4 857 B12R1.50 CCC(=O)Cc1cc(ccn1)Br 1458a_100000210414_100010173614 [0,1,0,0,0,0|3,0,0]=4 858 B12R1.50 CCC(=O)Cc1cc(ccn1)C 1458a_100000210414_100000718516 [0,1,0,0,0,0|3,0,0]=4 859 B12R1.50 CCC(=O)Cc1cc(ccn1)Cl 1458a_100000210414_100016988179 [0,1,0,0,0,0|3,0,0]=4 860 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000210414_100000211773 [0,1,0,0,0,0|2,0,0]=3 861 B12R1.50 CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210202 [0,1,0,0,0,0|2,0,0]=3 862 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100000210414_100000211840 [0,1,0,0,0,0|2,0,0]=3 863 B12R1.50 CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210202 [0,1,0,0,0,0|2,0,0]=3 864 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000210414_100000181238 [0,1,0,0,0,0|2,0,0]=3 865 B12R1.50 CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210202 [0,1,0,0,0,0|2,0,0]=3 866 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000210414_100000230114 [0,1,0,0,0,0|2,0,0]=3 867 B12R1.50 CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210202 [0,1,0,0,0,0|2,0,0]=3 868 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000210414_100011218688 [0,1,0,0,0,0|2,0,0]=3 869 B12R1.50 CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210202 [0,1,0,0,0,0|2,0,0]=3 870 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [0,1,0,0,0,0|1,0,0]=2 871 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [0,1,0,0,0,0|1,0,0]=2 872 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100000210414_100009889011 [0,1,0,0,0,0|3,0,0]=4 873 B12R1.50 CCC(=O)Cc1cccc(n1)Br 1458a_100010201708_100000210202 [0,1,0,0,0,0|3,0,0]=4 874 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100000210414_100000757606 [0,1,0,0,0,0|3,0,0]=4 875 B12R1.50 CCC(=O)Cc1cccc(n1)C 1458a_100012001110_100000210202 [0,1,0,0,0,0|3,0,0]=4 876 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000090259_100000210202 [0,1,0,0,0,0|3,0,0]=4 877 B12R1.50 CCC(=O)Cc1cccc(n1)Cl 1458a_100000210414_100000086093 [0,1,0,0,0,0|3,0,0]=4 878 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000096803_100000210202 [0,1,0,0,0,0|3,0,0]=4 879 B12R1.50 CCC(=O)Cc1cccc(n1)F 1458a_100000210414_100009819644 [0,1,0,0,0,0|3,0,0]=4 880 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100000210414_100010243470 [0,1,0,0,0,0|3,0,0]=4 881 B12R1.50 CCC(=O)Cc1ccnc(c1)Br 1458a_100010126891_100000210202 [0,1,0,0,0,0|3,0,0]=4 882 B12R1.50 CCC(=O)Cc1ccnc(c1)C 1458a_100000210414_200020672517 [0,1,0,0,0,0|3,0,0]=4 883 B12R1.50 CCC(=O)Cc1ccnc(c1)Cl 1458a_100000210414_100000764220 [0,1,0,0,0,0|3,0,0]=4 884 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000210414_100011740620 [0,1,0,0,0,0|3,0,0]=4 885 B12R1.50 CCC(=O)Cc1cncc(c1)Br 1458a_100000239331_100000210202 [0,1,0,0,0,0|3,0,0]=4 886 B12R1.50 CCC(=O)Cc1cncc(c1)C 1458a_100000210414_100000716715 [0,1,0,0,0,0|3,0,0]=4 887 B12R1.50 CCC(=O)Cc1cncc(c1)Cl 1458a_100000210414_100016992070 [0,1,0,0,0,0|3,0,0]=4 888 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100000210414_100000725299 [0,1,0,0,0,0|3,0,0]=4 889 B12R1.50 CCC(=O)Cc1cncc(c1)F 1458a_100011667516_100000210202 [0,1,0,0,0,0|3,0,0]=4 890 B12R1.50 CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210414 [0,1,0,0,0,0|2,0,0]=3 891 B12R1.50 CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210414 [0,1,0,0,0,0|2,0,0]=3 892 B12R1.50 CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210414 [0,1,0,0,0,0|2,0,0]=3 893 B12R1.50 CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210414 [0,1,0,0,0,0|2,0,0]=3 894 B12R1.50 CCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210414 [0,1,0,0,0,0|2,0,0]=3 895 B12R1.50 CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210414 [0,1,0,0,0,0|2,0,0]=3 896 B12R1.50 CCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210414 [0,1,0,0,0,0|2,0,0]=3 897 B12R1.50 CCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210414 [0,1,0,0,0,0|2,0,0]=3 898 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210414 [0,1,0,0,0,0|2,0,0]=3 899 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210414 [0,1,0,0,0,0|2,0,0]=3 900 B12R1.50 CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210414 [0,1,0,0,0,0|2,0,0]=3 901 B12R1.50 CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210414 [0,1,0,0,0,0|2,0,0]=3 902 B12R1.50 CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210414 [0,1,0,0,0,0|2,0,0]=3 903 B12R1.50 CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210414 [0,1,0,0,0,0|2,0,0]=3 904 B12R1.50 CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210414 [0,1,0,0,0,0|2,0,0]=3 905 B12R1.50 CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210414 [0,1,0,0,0,0|2,0,0]=3 906 B12R1.50 CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210414 [0,1,0,0,0,0|2,0,0]=3 907 B12R1.50 CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210414 [0,1,0,0,0,0|2,0,0]=3 908 B12R1.50 CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210414 [0,1,0,0,0,0|2,0,0]=3 909 B12R1.50 CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210414 [0,1,0,0,0,0|1,0,0]=2 910 B12R1.50 CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210414 [0,1,0,0,0,0|1,0,0]=2 911 B12R1.50 CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210414 [0,1,0,0,0,0|1,0,0]=2 912 B12R1.50 CCC(C)Nc1cccc(c1)O 34a_100000210217_100011215416 [0,1,0,0,0,0|2,0,1]=4 913 B12R1.50 CCC(C)Oc1cccc(c1)Br 34a_100000210342_100011215416 [0,1,0,0,0,0|2,0,1]=4 914 B12R1.50 CCC(C)Oc1cccc(c1)Br 7a_100000210342_100000758301 [0,1,0,0,0,0|2,0,1]=4 915 B12R1.50 CCC(C)Oc1cccc(c1)C 34a_100000210337_100011215416 [0,1,0,0,0,0|2,0,1]=4 916 B12R1.50 CCC(C)Oc1cccc(c1)C 7a_100000210337_100000758301 [0,1,0,0,0,0|2,0,1]=4 917 B12R1.50 CCC(C)Oc1cccc(c1)Cl 34a_100000210295_100011215416 [0,1,0,0,0,0|2,0,1]=4 918 B12R1.50 CCC(C)Oc1cccc(c1)Cl 7a_100000210295_100000758301 [0,1,0,0,0,0|2,0,1]=4 919 B12R1.50 CCC(C)Oc1cccc(c1)F 34a_100000210426_100011215416 [0,1,0,0,0,0|2,0,1]=4 920 B12R1.50 CCC(C)Oc1cccc(c1)F 7a_100000210426_100000758301 [0,1,0,0,0,0|2,0,1]=4 921 B12R1.50 CCC(C)Oc1cccc(c1)I 34a_100000211634_100011215416 [0,1,0,0,0,0|2,0,1]=4 922 B12R1.50 CCC(C)Oc1cccc(c1)I 7a_100000211634_100000758301 [0,1,0,0,0,0|2,0,1]=4 923 B12R1.50 CCC(C)Oc1cccc(c1)N 34a_100000210217_100011215416 [0,1,0,0,0,0|2,0,1]=4 924 B12R1.50 CCC(C)Oc1cccc(c1)O 271570a_203496583355_200011236628 [0,1,0,0,0,0|1,0,1]=3 925 B12R1.50 CCC(C)Sc1cccc(c1)O 62a_100000758301_100000211634 [0,1,0,0,0,0|1,1,1]=4 926 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000201218_200000210301 [0,1,0,0,0,0|3,0,0]=4 927 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210202 [0,1,0,0,0,0|3,0,0]=4 928 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000225621_100011660834 [0,1,0,0,0,0|3,0,0]=4 929 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000201218_200000210301 [0,1,0,0,0,0|3,0,0]=4 930 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000204670 [0,1,0,0,0,0|3,0,0]=4 931 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000225621_100000084143 [0,1,0,0,0,0|3,0,0]=4 932 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 2230a_100000201218_200025704644 [0,1,0,0,0,0|3,0,0]=4 933 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 269982a_100000201218_200025704644 [0,1,0,0,0,0|3,0,0]=4 934 B12R1.50 CN(CF)Cc1cccc(c1)O 269982a_100000207540_100015361967 [0,1,0,0,0,0|3,0,0]=4 935 B12R1.50 CNC(=O)Cc1cccc(c1)Br 11a_106832991635_100000747190 [0,1,0,0,0,0|2,0,0]=3 936 B12R1.50 CNC(=O)Cc1cccc(c1)Br 240690a_100102657272_100000747190 [0,1,0,0,0,0|2,0,0]=3 937 B12R1.50 CNC(=O)Cc1cccc(c1)Br 527a_100102657272_100000747190 [0,1,0,0,0,0|2,0,0]=3 938 B12R1.50 CNC(=O)Cc1cccc(c1)C 11a_106832991635_100011206899 [0,1,0,0,0,0|2,0,0]=3 939 B12R1.50 CNC(=O)Cc1cccc(c1)C 1626a_100102657272_100011206899 [0,1,0,0,0,0|2,0,0]=3 940 B12R1.50 CNC(=O)Cc1cccc(c1)C 240690a_100102657272_100011206899 [0,1,0,0,0,0|2,0,0]=3 941 B12R1.50 CNC(=O)Cc1cccc(c1)C 527a_100102657272_100011206899 [0,1,0,0,0,0|2,0,0]=3 942 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 11a_106832991635_100000749307 [0,1,0,0,0,0|2,0,0]=3 943 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 1626a_100102657272_100000749307 [0,1,0,0,0,0|2,0,0]=3 944 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 240690a_100102657272_100000749307 [0,1,0,0,0,0|2,0,0]=3 945 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 527a_100102657272_100000749307 [0,1,0,0,0,0|2,0,0]=3 946 B12R1.50 CNC(=O)Cc1cccc(c1)F 11a_106832991635_100000211661 [0,1,0,0,0,0|2,0,0]=3 947 B12R1.50 CNC(=O)Cc1cccc(c1)F 1626a_100102657272_100000211661 [0,1,0,0,0,0|2,0,0]=3 948 B12R1.50 CNC(=O)Cc1cccc(c1)F 240690a_100102657272_100000211661 [0,1,0,0,0,0|2,0,0]=3 949 B12R1.50 CNC(=O)Cc1cccc(c1)F 527a_100102657272_100000211661 [0,1,0,0,0,0|2,0,0]=3 950 B12R1.50 CNC(=O)Cc1cccc(c1)I 11a_106832991635_100000238430 [0,1,0,0,0,0|2,0,0]=3 951 B12R1.50 CNC(=O)Cc1cccc(c1)I 1626a_100102657272_100000238430 [0,1,0,0,0,0|2,0,0]=3 952 B12R1.50 CNC(=O)Cc1cccc(c1)I 240690a_100102657272_100000238430 [0,1,0,0,0,0|2,0,0]=3 953 B12R1.50 CNC(=O)Cc1cccc(c1)I 527a_100102657272_100000238430 [0,1,0,0,0,0|2,0,0]=3 954 B12R1.50 CNC(=O)Cc1cccc(c1)O 240690a_100102657272_100000745134 [0,1,0,0,0,0|1,0,0]=2 955 B12R1.50 CNC(=O)Cc1cccc(c1)O 527a_100102657272_100000745134 [0,1,0,0,0,0|1,0,0]=2 956 B12R1.50 CNC(=O)Cc1cccc(n1)Br 11a_106832991635_100010201708 [0,1,0,0,0,0|3,0,0]=4 957 B12R1.50 CNC(=O)Cc1cccc(n1)Br 240690a_100102657272_100010201708 [0,1,0,0,0,0|3,0,0]=4 958 B12R1.50 CNC(=O)Cc1cccc(n1)Br 527a_100102657272_100010201708 [0,1,0,0,0,0|3,0,0]=4 959 B12R1.50 CNC(=O)Cc1cccc(n1)C 11a_106832991635_100012001110 [0,1,0,0,0,0|3,0,0]=4 960 B12R1.50 CNC(=O)Cc1cccc(n1)C 1626a_100102657272_100012001110 [0,1,0,0,0,0|3,0,0]=4 961 B12R1.50 CNC(=O)Cc1cccc(n1)C 240690a_100102657272_100012001110 [0,1,0,0,0,0|3,0,0]=4 962 B12R1.50 CNC(=O)Cc1cccc(n1)C 527a_100102657272_100012001110 [0,1,0,0,0,0|3,0,0]=4 963 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 11a_106832991635_100000090259 [0,1,0,0,0,0|3,0,0]=4 964 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 1626a_100102657272_100000090259 [0,1,0,0,0,0|3,0,0]=4 965 B12R1.50 CNC(=O)Cc1cccc(n1)Cl 240690a_100102657272_100000090259 [0,1,0,0,0,0|3,0,0]=4 966 B12R1.50 CNC(=O)Cc1cccc(n1)F 11a_106832991635_100000096803 [0,1,0,0,0,0|3,0,0]=4 967 B12R1.50 CNC(=O)Cc1cccc(n1)F 1626a_100102657272_100000096803 [0,1,0,0,0,0|3,0,0]=4 968 B12R1.50 CNC(=O)Cc1cccc(n1)F 240690a_100102657272_100000096803 [0,1,0,0,0,0|3,0,0]=4 969 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 11a_106832991635_100010126891 [0,1,0,0,0,0|3,0,0]=4 970 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 240690a_100102657272_100010126891 [0,1,0,0,0,0|3,0,0]=4 971 B12R1.50 CNC(=O)Cc1ccnc(c1)Br 527a_100102657272_100010126891 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 11a_106832991635_100000085289 [0,1,0,0,0,0|3,0,0]=4 973 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 1626a_100102657272_100000085289 [0,1,0,0,0,0|3,0,0]=4 974 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 240690a_100102657272_100000085289 [0,1,0,0,0,0|3,0,0]=4 975 B12R1.50 CNC(=O)Cc1ccnc(c1)Cl 527a_100102657272_100000085289 [0,1,0,0,0,0|3,0,0]=4 976 B12R1.50 CNC(=O)Cc1cncc(c1)Br 11a_106832991635_100000239331 [0,1,0,0,0,0|3,0,0]=4 977 B12R1.50 CNC(=O)Cc1cncc(c1)Br 240690a_100102657272_100000239331 [0,1,0,0,0,0|3,0,0]=4 978 B12R1.50 CNC(=O)Cc1cncc(c1)Br 527a_100102657272_100000239331 [0,1,0,0,0,0|3,0,0]=4 979 B12R1.50 CNC(=O)Cc1cncc(c1)F 11a_106832991635_100011667516 [0,1,0,0,0,0|3,0,0]=4 980 B12R1.50 CNC(=O)Cc1cncc(c1)F 240690a_100102657272_100011667516 [0,1,0,0,0,0|3,0,0]=4 981 B12R1.50 CNC(=O)Cc1cncc(c1)F 527a_100102657272_100011667516 [0,1,0,0,0,0|3,0,0]=4 982 B12R1.50 CNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100102657272 [0,1,0,0,0,0|2,0,0]=3 983 B12R1.50 CNC(=O)Nc1cccc(c1)Br 512a_100000210019_100102657272 [0,1,0,0,0,0|2,0,0]=3 984 B12R1.50 CNC(=O)Nc1cccc(c1)C 2430a_100000188690_100102657272 [0,1,0,0,0,0|2,0,0]=3 985 B12R1.50 CNC(=O)Nc1cccc(c1)C 512a_100000188690_100102657272 [0,1,0,0,0,0|2,0,0]=3 986 B12R1.50 CNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100102657272 [0,1,0,0,0,0|2,0,0]=3 987 B12R1.50 CNC(=O)Nc1cccc(c1)F 2430a_100000210047_100102657272 [0,1,0,0,0,0|2,0,0]=3 988 B12R1.50 CNC(=O)Nc1cccc(c1)F 512a_100000210047_100102657272 [0,1,0,0,0,0|2,0,0]=3 989 B12R1.50 CNC(=O)Nc1cccc(c1)I 2430a_100000211102_100102657272 [0,1,0,0,0,0|2,0,0]=3 990 B12R1.50 CNC(=O)Nc1cccc(c1)I 512a_100000211102_100102657272 [0,1,0,0,0,0|2,0,0]=3 991 B12R1.50 CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100102657272 [0,1,0,0,0,0|1,0,0]=2 992 B12R1.50 CNC(=O)Nc1cccc(c1)O 512a_100000210217_100102657272 [0,1,0,0,0,0|1,0,0]=2 993 B12R1.50 COC(=O)Cc1cc(ccn1)O 271570a_203496583355_100010275543 [0,1,0,0,0,0|2,0,0]=3 994 B12R1.50 COC(=O)Cc1cc(ncn1)O 271570a_203496583355_100000104187 [0,1,0,0,0,0|3,0,0]=4 995 B12R1.50 COC(=O)Cc1cccc(c1)O 271570a_203496583355_100000699549 [0,1,0,0,0,0|1,0,0]=2 996 B12R1.50 COC(=O)Cc1cccc(n1)O 271570a_203496583355_100000094215 [0,1,0,0,0,0|2,0,0]=3 997 B12R1.50 COC(=O)Cc1ccnc(c1)O 271570a_203496583355_100010135589 [0,1,0,0,0,0|2,0,0]=3 998 B12R1.50 COC(C)Sc1cccc(c1)O 62a_100009879195_100000211634 [0,1,0,0,0,0|0,1,2]=4 999 B12R1.50 C[C@H](CO)Sc1cccc(c1)O 62a_100016084084_100000211634 [0,1,0,0,0,0|0,1,2]=4 1000 B12R1.50 Cc1cc(ccn1)CC(=O)CO 1458a_100000210174_200020672517 [0,1,0,0,0,0|3,0,0]=4 1001 B12R1.50 Cc1cccc(c1)CC(=O)CF 1458a_100011206899_100015361967 [0,1,0,0,0,0|2,0,0]=3 1002 B12R1.50 Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211840 [0,1,0,0,0,0|2,0,0]=3 1003 B12R1.50 Cc1cccc(c1)NC(=O)CO 22a_100000188690_100000210174 [0,1,0,0,0,0|2,0,0]=3 1004 B12R1.50 Cc1cccc(c1)NC(=O)CO 527a_100000188690_100000210174 [0,1,0,0,0,0|2,0,0]=3 1005 B12R1.50 Cc1cccc(c1)OC(C)C#N 7a_100000210337_100000703298 [0,1,0,0,0,0|2,0,1]=4 1006 B12R1.50 Cc1cccc(c1)OC(C)CO 34a_100000210337_100012180447 [0,1,0,0,0,0|1,0,2]=4 1007 B12R1.50 Cc1cccc(c1)OC(C)CO 7a_100000210337_100012180447 [0,1,0,0,0,0|1,0,2]=4 1008 B12R1.50 Cc1cccc(n1)CC(=O)CF 1458a_100012001110_100015361967 [0,1,0,0,0,0|3,0,0]=4 1009 B12R1.50 Cc1cccc(n1)CC(=O)CO 1458a_100000210174_100000757606 [0,1,0,0,0,0|3,0,0]=4 1010 B12R1.50 Cc1ccnc(c1)CC(=O)CO 1458a_100000210174_100000718516 [0,1,0,0,0,0|3,0,0]=4 1011 B12R1.50 Cc1cncc(c1)CC(=O)CO 1458a_100000210174_100000716715 [0,1,0,0,0,0|3,0,0]=4 1012 B12R1.50 NC(CO)Cc1cccc(c1)O 271570a_203496583355_114802770106 [0,1,0,0,0,0|2,0,1]=4 1013 B12R1.50 O=C(CF)Cc1cccc(c1)Br 1458a_100000747190_100015361967 [0,1,0,0,0,0|2,0,0]=3 1014 B12R1.50 O=C(CF)Cc1cccc(c1)Cl 1458a_100000749307_100015361967 [0,1,0,0,0,0|2,0,0]=3 1015 B12R1.50 O=C(CF)Cc1cccc(c1)F 1458a_100000211661_100015361967 [0,1,0,0,0,0|2,0,0]=3 1016 B12R1.50 O=C(CF)Cc1cccc(c1)I 1458a_100000238430_100015361967 [0,1,0,0,0,0|2,0,0]=3 1017 B12R1.50 O=C(CF)Cc1cccc(c1)O 1458a_100000745134_100015361967 [0,1,0,0,0,0|1,0,0]=2 1018 B12R1.50 O=C(CF)Cc1cccc(n1)Br 1458a_100010201708_100015361967 [0,1,0,0,0,0|3,0,0]=4 1019 B12R1.50 O=C(CF)Cc1cccc(n1)Cl 1458a_100000090259_100015361967 [0,1,0,0,0,0|3,0,0]=4 1020 B12R1.50 O=C(CF)Cc1cccc(n1)F 1458a_100000096803_100015361967 [0,1,0,0,0,0|3,0,0]=4 1021 B12R1.50 O=C(CF)Cc1ccnc(c1)Br 1458a_100010126891_100015361967 [0,1,0,0,0,0|3,0,0]=4 1022 B12R1.50 O=C(CF)Cc1cncc(c1)Br 1458a_100000239331_100015361967 [0,1,0,0,0,0|3,0,0]=4 1023 B12R1.50 O=C(CF)Cc1cncc(c1)F 1458a_100011667516_100015361967 [0,1,0,0,0,0|3,0,0]=4 1024 B12R1.50 O=C(CO)Cc1cc(ccn1)Br 1458a_100000210174_100010173614 [0,1,0,0,0,0|3,0,0]=4 1025 B12R1.50 O=C(CO)Cc1cc(ccn1)Cl 1458a_100000210174_100016988179 [0,1,0,0,0,0|3,0,0]=4 1026 B12R1.50 O=C(CO)Cc1cccc(c1)Br 1458a_100000210174_100000211773 [0,1,0,0,0,0|2,0,0]=3 1027 B12R1.50 O=C(CO)Cc1cccc(c1)Cl 1458a_100000210174_100000181238 [0,1,0,0,0,0|2,0,0]=3 1028 B12R1.50 O=C(CO)Cc1cccc(c1)F 1458a_100000210174_100000230114 [0,1,0,0,0,0|2,0,0]=3 1029 B12R1.50 O=C(CO)Cc1cccc(c1)I 1458a_100000210174_100011218688 [0,1,0,0,0,0|2,0,0]=3 1030 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [0,1,0,0,0,0|1,0,0]=2 1031 B12R1.50 O=C(CO)Cc1cccc(n1)Br 1458a_100000210174_100009889011 [0,1,0,0,0,0|3,0,0]=4 1032 B12R1.50 O=C(CO)Cc1cccc(n1)Cl 1458a_100000210174_100000086093 [0,1,0,0,0,0|3,0,0]=4 1033 B12R1.50 O=C(CO)Cc1cccc(n1)F 1458a_100000210174_100009819644 [0,1,0,0,0,0|3,0,0]=4 1034 B12R1.50 O=C(CO)Cc1ccnc(c1)Br 1458a_100000210174_100010243470 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.50 O=C(CO)Cc1ccnc(c1)Cl 1458a_100000210174_100000764220 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.50 O=C(CO)Cc1cncc(c1)Br 1458a_100000210174_100011740620 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.50 O=C(CO)Cc1cncc(c1)Cl 1458a_100000210174_100016992070 [0,1,0,0,0,0|3,0,0]=4 1038 B12R1.50 O=C(CO)Cc1cncc(c1)F 1458a_100000210174_100000725299 [0,1,0,0,0,0|3,0,0]=4 1039 B12R1.50 O=C(CO)Nc1cccc(c1)Br 22a_100000210019_100000210174 [0,1,0,0,0,0|2,0,0]=3 1040 B12R1.50 O=C(CO)Nc1cccc(c1)Br 527a_100000210019_100000210174 [0,1,0,0,0,0|2,0,0]=3 1041 B12R1.50 O=C(CO)Nc1cccc(c1)Cl 22a_100000185859_100000210174 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.50 O=C(CO)Nc1cccc(c1)F 22a_100000210047_100000210174 [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.50 O=C(CO)Nc1cccc(c1)F 527a_100000210047_100000210174 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.50 O=C(CO)Nc1cccc(c1)I 22a_100000211102_100000210174 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.50 O=C(CO)Nc1cccc(c1)I 527a_100000211102_100000210174 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.50 O=C(CO)Nc1cccc(c1)O 22a_100000210217_100000210174 [0,1,0,0,0,0|1,0,0]=2 1047 B12R1.50 O=C(CO)Nc1cccc(c1)O 527a_100000210217_100000210174 [0,1,0,0,0,0|1,0,0]=2 1048 B12R1.101 CC(=Cc1cc(cc(c1)Br)Br)C 271570a_100102525489_100009814770 [0,1,0,0,0,0|3,0,0]=4 1049 B12R1.101 CC(=Cc1cc(cc(c1)Br)Cl)C 271570a_100102525489_100009814755 [0,1,0,0,0,0|3,0,0]=4 1050 B12R1.101 CC(=Cc1cc(cc(c1)Br)F)C 271570a_100102525489_100009814764 [0,1,0,0,0,0|3,0,0]=4 1051 B12R1.101 CC(=Cc1cc(cc(c1)Br)N)C 271570a_100102525489_100009814763 [0,1,0,0,0,0|3,0,0]=4 1052 B12R1.101 CC(=Cc1cc(cc(c1)Br)O)C 271570a_100102525489_100010068917 [0,1,0,0,0,0|2,0,0]=3 1053 B12R1.101 CC(=Cc1cc(cc(c1)C)C)C 271570a_100102525489_100011215608 [0,1,0,0,0,0|3,0,0]=4 1054 B12R1.101 CC(=Cc1cc(cc(c1)Cl)C)C 271570a_100102525489_100010172791 [0,1,0,0,0,0|3,0,0]=4 1055 B12R1.101 CC(=Cc1cc(cc(c1)Cl)Cl)C 271570a_100102525489_100000747138 [0,1,0,0,0,0|3,0,0]=4 1056 B12R1.101 CC(=Cc1cc(cc(c1)Cl)F)C 271570a_100102525489_100013859453 [0,1,0,0,0,0|3,0,0]=4 1057 B12R1.101 CC(=Cc1cc(cc(c1)Cl)N)C 271570a_100102525489_100010147676 [0,1,0,0,0,0|3,0,0]=4 1058 B12R1.101 CC(=Cc1cc(cc(c1)Cl)O)C 271570a_100102525489_100010068924 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.101 CC(=Cc1cc(cc(c1)F)C)C 271570a_100102525489_100011356977 [0,1,0,0,0,0|3,0,0]=4 1060 B12R1.101 CC(=Cc1cc(cc(c1)F)F)C 271570a_100102525489_100011218498 [0,1,0,0,0,0|3,0,0]=4 1061 B12R1.101 CC(=Cc1cc(cc(c1)F)N)C 271570a_100102525489_100011356972 [0,1,0,0,0,0|3,0,0]=4 1062 B12R1.101 CC(=Cc1cc(cc(c1)F)O)C 271570a_100102525489_100000717995 [0,1,0,0,0,0|2,0,0]=3 1063 B12R1.101 CC(=Cc1cc(cc(c1)N)C)C 271570a_100102525489_100000695972 [0,1,0,0,0,0|3,0,0]=4 1064 B12R1.101 CC(=Cc1cc(cc(c1)N)N)C 271570a_100102525489_100011999608 [0,1,0,0,0,0|3,0,0]=4 1065 B12R1.101 CC(=Cc1cc(cc(c1)O)C)C 271570a_100102525489_100011999630 [0,1,0,0,0,0|2,0,0]=3 1066 B12R1.101 CC(=Cc1cc(cc(c1)O)O)C 271570a_100102525489_100009868816 [0,1,0,0,0,0|2,0,0]=3 1067 B12R1.101 CC(=O)Cc1cc(=O)[nH]c(n1)O 1458a_100000070787_100000185147 [0,1,0,0,0,0|3,0,0]=4 1068 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000070787_100011216082 [0,1,0,0,0,0|2,0,0]=3 1069 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_200000210301 [0,1,0,0,0,0|2,0,0]=3 1070 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)C 1458a_100000070787_100012348363 [0,1,0,0,0,0|2,0,0]=3 1071 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)F 1458a_100000070787_100000766940 [0,1,0,0,0,0|2,0,0]=3 1072 B12R1.101 CC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_200000210301 [0,1,0,0,0,0|2,0,0]=3 1073 B12R1.101 CC(=O)Cc1cc(cc(c1)C)C 1458a_100000070787_100000181317 [0,1,0,0,0,0|2,0,0]=3 1074 B12R1.101 CC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_200000210301 [0,1,0,0,0,0|2,0,0]=3 1075 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000070787_100011219208 [0,1,0,0,0,0|2,0,0]=3 1076 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_200000210301 [0,1,0,0,0,0|2,0,0]=3 1077 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000070787_100011219885 [0,1,0,0,0,0|2,0,0]=3 1078 B12R1.101 CC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_200000210301 [0,1,0,0,0,0|2,0,0]=3 1079 B12R1.101 CC(=O)Cc1cc(cc(c1)F)C 1458a_100000070787_100011219130 [0,1,0,0,0,0|2,0,0]=3 1080 B12R1.101 CC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_200000210301 [0,1,0,0,0,0|2,0,0]=3 1081 B12R1.101 CC(=O)Cc1cc(cc(c1)F)F 1458a_100000070787_100000697002 [0,1,0,0,0,0|2,0,0]=3 1082 B12R1.101 CC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_200000210301 [0,1,0,0,0,0|2,0,0]=3 1083 B12R1.101 CC(=O)Cc1cc(cc(c1)I)Br 1458a_100000070787_100010146614 [0,1,0,0,0,0|2,0,0]=3 1084 B12R1.101 CC(=O)Cc1cc(cc(c1)I)F 1458a_100000070787_100010149605 [0,1,0,0,0,0|2,0,0]=3 1085 B12R1.101 CC(=O)Cc1cc(cc(n1)C)C 1458a_100000070787_100012357514 [0,1,0,0,0,0|3,0,0]=4 1086 B12R1.101 CC(=O)Cc1cc(nc(c1)C)C 1458a_100000070787_200000139866 [0,1,0,0,0,0|3,0,0]=4 1087 B12R1.101 CC(=O)Cc1cc(nc(c1)Cl)Cl 1458a_100000070787_100000052781 [0,1,0,0,0,0|3,0,0]=4 1088 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 11a_100012047176_100015343762 [0,1,0,0,0,0|2,0,0]=3 1089 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 1626a_100012047176_100015343762 [0,1,0,0,0,0|2,0,0]=3 1090 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000070787 [0,1,0,0,0,0|2,0,0]=3 1091 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Br 527a_100012047176_100103153847 [0,1,0,0,0,0|2,0,0]=3 1092 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 11a_100000695972_100015343762 [0,1,0,0,0,0|2,0,0]=3 1093 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 1626a_100000695972_100015343762 [0,1,0,0,0,0|2,0,0]=3 1094 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 22a_100000695972_100000070787 [0,1,0,0,0,0|2,0,0]=3 1095 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)C 527a_100000695972_100103153847 [0,1,0,0,0,0|2,0,0]=3 1096 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 11a_100011934539_100015343762 [0,1,0,0,0,0|2,0,0]=3 1097 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 1626a_100011934539_100015343762 [0,1,0,0,0,0|2,0,0]=3 1098 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000070787 [0,1,0,0,0,0|2,0,0]=3 1099 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 11a_100000705686_100015343762 [0,1,0,0,0,0|2,0,0]=3 1100 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 1626a_100000705686_100015343762 [0,1,0,0,0,0|2,0,0]=3 1101 B12R1.101 CC(=O)Nc1cc(cc(c1)Br)F 22a_100000705686_100000070787 [0,1,0,0,0,0|2,0,0]=3 1102 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 11a_100000210930_100015343762 [0,1,0,0,0,0|2,0,0]=3 1103 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100015343762 [0,1,0,0,0,0|2,0,0]=3 1104 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000070787 [0,1,0,0,0,0|2,0,0]=3 1105 B12R1.101 CC(=O)Nc1cc(cc(c1)C)C 527a_100000210930_100103153847 [0,1,0,0,0,0|2,0,0]=3 1106 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 11a_100012022512_100015343762 [0,1,0,0,0,0|2,0,0]=3 1107 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 1626a_100012022512_100015343762 [0,1,0,0,0,0|2,0,0]=3 1108 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)C 22a_100012022512_100000070787 [0,1,0,0,0,0|2,0,0]=3 1109 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 11a_100000210456_100015343762 [0,1,0,0,0,0|2,0,0]=3 1110 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 1626a_100000210456_100015343762 [0,1,0,0,0,0|2,0,0]=3 1111 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000070787 [0,1,0,0,0,0|2,0,0]=3 1112 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 11a_100000686136_100015343762 [0,1,0,0,0,0|2,0,0]=3 1113 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 1626a_100000686136_100015343762 [0,1,0,0,0,0|2,0,0]=3 1114 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000070787 [0,1,0,0,0,0|2,0,0]=3 1115 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100015343762 [0,1,0,0,0,0|1,0,0]=2 1116 B12R1.101 CC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000070787 [0,1,0,0,0,0|1,0,0]=2 1117 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 11a_100000742734_100015343762 [0,1,0,0,0,0|2,0,0]=3 1118 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 1626a_100000742734_100015343762 [0,1,0,0,0,0|2,0,0]=3 1119 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 22a_100000742734_100000070787 [0,1,0,0,0,0|2,0,0]=3 1120 B12R1.101 CC(=O)Nc1cc(cc(c1)F)C 527a_100000742734_100103153847 [0,1,0,0,0,0|2,0,0]=3 1121 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 11a_100000233717_100015343762 [0,1,0,0,0,0|2,0,0]=3 1122 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 1626a_100000233717_100015343762 [0,1,0,0,0,0|2,0,0]=3 1123 B12R1.101 CC(=O)Nc1cc(cc(c1)F)F 22a_100000233717_100000070787 [0,1,0,0,0,0|2,0,0]=3 1124 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100015343762 [0,1,0,0,0,0|2,0,0]=3 1125 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100015343762 [0,1,0,0,0,0|2,0,0]=3 1126 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000070787 [0,1,0,0,0,0|2,0,0]=3 1127 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100103153847 [0,1,0,0,0,0|2,0,0]=3 1128 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100015343762 [0,1,0,0,0,0|2,0,0]=3 1129 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100015343762 [0,1,0,0,0,0|2,0,0]=3 1130 B12R1.101 CC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000070787 [0,1,0,0,0,0|2,0,0]=3 1131 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100015343762 [0,1,0,0,0,0|2,0,0]=3 1132 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100015343762 [0,1,0,0,0,0|2,0,0]=3 1133 B12R1.101 CC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000070787 [0,1,0,0,0,0|2,0,0]=3 1134 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100015343762 [0,1,0,0,0,0|2,0,0]=3 1135 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100015343762 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000070787 [0,1,0,0,0,0|2,0,0]=3 1137 B12R1.101 CC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100103153847 [0,1,0,0,0,0|2,0,0]=3 1138 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100015343762 [0,1,0,0,0,0|1,0,0]=2 1139 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000070787 [0,1,0,0,0,0|1,0,0]=2 1140 B12R1.101 CC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100103153847 [0,1,0,0,0,0|1,0,0]=2 1141 B12R1.101 CC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100103153847 [0,1,0,0,0,0|1,0,0]=2 1142 B12R1.101 CC(=O)Oc1cc(cc(c1)F)O 271570a_203496583355_200015324874 [0,1,0,0,0,0|0,0,0]=1 1143 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)O 34a_100000123917_100000210206 [0,1,0,0,0,0|2,0,1]=4 1144 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)O 7a_100000123917_100000210206 [0,1,0,0,0,0|2,0,1]=4 1145 B12R1.101 CC(C)Nc1cc(cc(c1)O)O 34a_100000043371_100000210206 [0,1,0,0,0,0|2,0,1]=4 1146 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Br 34a_100010167048_100000210206 [0,1,0,0,0,0|2,0,1]=4 1147 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Br 7a_100010167048_100000210206 [0,1,0,0,0,0|2,0,1]=4 1148 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Cl 34a_100010185897_100000210206 [0,1,0,0,0,0|2,0,1]=4 1149 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Cl 7a_100010185897_100000210206 [0,1,0,0,0,0|2,0,1]=4 1150 B12R1.101 CC(C)Oc1cc(cc(c1)Br)F 34a_100000688818_100000210206 [0,1,0,0,0,0|2,0,1]=4 1151 B12R1.101 CC(C)Oc1cc(cc(c1)Br)F 7a_100000688818_100000210206 [0,1,0,0,0,0|2,0,1]=4 1152 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)Cl 34a_100000181315_100000210206 [0,1,0,0,0,0|2,0,1]=4 1153 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)Cl 7a_100000181315_100000210206 [0,1,0,0,0,0|2,0,1]=4 1154 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)F 34a_100011219751_100000210206 [0,1,0,0,0,0|2,0,1]=4 1155 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)F 7a_100011219751_100000210206 [0,1,0,0,0,0|2,0,1]=4 1156 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)N 34a_100000123917_100000210206 [0,1,0,0,0,0|2,0,1]=4 1157 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)N 7a_100000123917_100000210206 [0,1,0,0,0,0|2,0,1]=4 1158 B12R1.101 CC(C)Oc1cc(cc(c1)F)F 34a_100000747503_100000210206 [0,1,0,0,0,0|2,0,1]=4 1159 B12R1.101 CC(C)Oc1cc(cc(c1)F)F 7a_100000747503_100000210206 [0,1,0,0,0,0|2,0,1]=4 1160 B12R1.101 CC(C)Oc1cc(cc(c1)I)Br 34a_100010068917_100000210206 [0,1,0,0,0,0|2,0,1]=4 1161 B12R1.101 CC(C)Oc1cc(cc(c1)I)Br 7a_100010068917_100000210206 [0,1,0,0,0,0|2,0,1]=4 1162 B12R1.101 CC(C)Oc1cc(cc(c1)I)Cl 34a_100010068924_100000210206 [0,1,0,0,0,0|2,0,1]=4 1163 B12R1.101 CC(C)Oc1cc(cc(c1)I)Cl 7a_100010068924_100000210206 [0,1,0,0,0,0|2,0,1]=4 1164 B12R1.101 CC(C)Oc1cc(cc(c1)I)F 34a_100000717995_100000210206 [0,1,0,0,0,0|2,0,1]=4 1165 B12R1.101 CC(C)Oc1cc(cc(c1)I)F 7a_100000717995_100000210206 [0,1,0,0,0,0|2,0,1]=4 1166 B12R1.101 CC(C)Sc1cc(cc(c1)Br)O 62a_100000210206_100010068917 [0,1,0,0,0,0|1,1,1]=4 1167 B12R1.101 CC(C)Sc1cc(cc(c1)Br)O 62a_100010068917_100000210206 [0,1,0,0,0,0|1,1,1]=4 1168 B12R1.101 CC(C)Sc1cc(cc(c1)Cl)O 62a_100000210206_100010068924 [0,1,0,0,0,0|1,1,1]=4 1169 B12R1.101 CC(C)Sc1cc(cc(c1)Cl)O 62a_100010068924_100000210206 [0,1,0,0,0,0|1,1,1]=4 1170 B12R1.101 CC(C)Sc1cc(cc(c1)F)O 62a_100000210206_100000688818 [0,1,0,0,0,0|1,1,1]=4 1171 B12R1.101 CC(C)Sc1cc(cc(c1)F)O 62a_100000688818_100000210206 [0,1,0,0,0,0|1,1,1]=4 1172 B12R1.101 CC(C)Sc1cc(cc(c1)O)O 62a_100000210206_100009868816 [0,1,0,0,0,0|1,1,1]=4 1173 B12R1.101 CN(C)Cc1cc(cc(c1)Br)O 270004a_100102631434_100010176088 [0,1,0,0,0,0|3,0,0]=4 1174 B12R1.101 CN(C)Cc1cc(cc(c1)Cl)O 270004a_100102631434_100000050827 [0,1,0,0,0,0|3,0,0]=4 1175 B12R1.101 CN(C)Cc1cc(cc(c1)F)O 270004a_100102631434_100000703664 [0,1,0,0,0,0|3,0,0]=4 1176 B12R1.101 CN(C)Cc1cc(cc(c1)F)O 271570a_203496583355_100012630382 [0,1,0,0,0,0|3,0,0]=4 1177 B12R1.101 Cc1cc(cc(c1)CC(=O)[13CH3])C 1458a_100011202310_200025704644 [0,1,0,0,0,0|2,0,0]=3 1178 B12R1.101 Cc1cc(cc(c1)CC(=O)[13CH3])F 1458a_100011216671_200025704644 [0,1,0,0,0,0|2,0,0]=3 1179 B12R1.101 Cc1cc(cc(c1)CN(C)C)O 270004a_100102631434_100009853434 [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.101 Cc1cc(cc(c1)NC(C)C)O 34a_100011995906_100000210206 [0,1,0,0,0,0|2,0,1]=4 1181 B12R1.101 Cc1cc(cc(c1)NC(C)C)O 7a_100011995906_100000210206 [0,1,0,0,0,0|2,0,1]=4 1182 B12R1.101 Cc1cc(cc(c1)OC(C)C)Br 34a_100011999630_100000210206 [0,1,0,0,0,0|2,0,1]=4 1183 B12R1.101 Cc1cc(cc(c1)OC(C)C)Br 7a_100011999630_100000210206 [0,1,0,0,0,0|2,0,1]=4 1184 B12R1.101 Cc1cc(cc(c1)OC(C)C)C 34a_100000210933_100000210206 [0,1,0,0,0,0|2,0,1]=4 1185 B12R1.101 Cc1cc(cc(c1)OC(C)C)C 7a_100000210933_100000210206 [0,1,0,0,0,0|2,0,1]=4 1186 B12R1.101 Cc1cc(cc(c1)OC(C)C)Cl 34a_100000087485_100000210206 [0,1,0,0,0,0|2,0,1]=4 1187 B12R1.101 Cc1cc(cc(c1)OC(C)C)Cl 7a_100000087485_100000210206 [0,1,0,0,0,0|2,0,1]=4 1188 B12R1.101 Cc1cc(cc(c1)OC(C)C)F 34a_100011830401_100000210206 [0,1,0,0,0,0|2,0,1]=4 1189 B12R1.101 Cc1cc(cc(c1)OC(C)C)F 7a_100011830401_100000210206 [0,1,0,0,0,0|2,0,1]=4 1190 B12R1.101 Cc1cc(cc(c1)OC(C)C)N 34a_100011995906_100000210206 [0,1,0,0,0,0|2,0,1]=4 1191 B12R1.101 Cc1cc(cc(c1)OC(C)C)N 7a_100011995906_100000210206 [0,1,0,0,0,0|2,0,1]=4 1192 B12R1.101 Cc1cc(cc(c1)OC(F)F)O 271570a_203496583355_100010146088 [0,1,0,0,0,0|2,0,1]=4 1193 B12R1.101 Cc1cc(cc(c1)SC(C)C)O 62a_100000210206_100011999630 [0,1,0,0,0,0|1,1,1]=4 1194 B12R1.101 Nc1cc(cc(c1)OC(F)F)O 271570a_203496583355_100012349557 [0,1,0,0,0,0|2,0,1]=4 1195 B12R1.101 Oc1cc(cc(c1)OC(F)F)F 271570a_203496583355_100012349563 [0,1,0,0,0,0|2,0,1]=4 1196 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_200025704644 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_200025704644 [0,1,0,0,0,0|2,0,0]=3 1198 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_200025704644 [0,1,0,0,0,0|2,0,0]=3 1199 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_200025704644 [0,1,0,0,0,0|2,0,0]=3 1200 B12R1.101 [13CH3]C(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_200025704644 [0,1,0,0,0,0|2,0,0]=3 1201 B12R1.119 CC(C)(C)Nc1cccc(c1)O 34a_100000210217_100000210625 [0,1,0,0,0,0|2,0,1]=4 1202 B12R1.119 CC(C)(C)Oc1cc(ccn1)O 271570a_203496583355_200010237921 [0,1,0,0,0,0|2,0,1]=4 1203 B12R1.119 CC(C)(C)Oc1cccc(c1)Br 34a_100000210342_100000210625 [0,1,0,0,0,0|2,0,1]=4 1204 B12R1.119 CC(C)(C)Oc1cccc(c1)Cl 34a_100000210295_100000210625 [0,1,0,0,0,0|2,0,1]=4 1205 B12R1.119 CC(C)(C)Oc1cccc(c1)F 34a_100000210426_100000210625 [0,1,0,0,0,0|2,0,1]=4 1206 B12R1.119 CC(C)(C)Oc1cccc(c1)I 34a_100000211634_100000210625 [0,1,0,0,0,0|2,0,1]=4 1207 B12R1.119 CC(C)(C)Oc1cccc(c1)N 34a_100000210217_100000210625 [0,1,0,0,0,0|2,0,1]=4 1208 B12R1.119 CC(C)(C)Oc1cccc(c1)O 271570a_203496583355_100010078498 [0,1,0,0,0,0|1,0,1]=3 1209 B12R1.119 CC(C)(C)Oc1cccc(n1)O 271570a_203496583355_100011960237 [0,1,0,0,0,0|2,0,1]=4 1210 B12R1.119 CC(C)(C)Sc1cccc(c1)O 62a_100000211941_100000211634 [0,1,0,0,0,0|1,1,1]=4 1211 B12R1.119 CS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_200009814643 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Br 40a_100000210019_100000738038 [0,1,0,0,0,0|3,0,0]=4 1213 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Cl 40a_100000185859_100000738038 [0,1,0,0,0,0|3,0,0]=4 1214 B12R1.119 CS(=O)(=O)Nc1cccc(c1)F 40a_100000210047_100000738038 [0,1,0,0,0,0|3,0,0]=4 1215 B12R1.119 CS(=O)(=O)Nc1cccc(c1)I 40a_100000211102_100000738038 [0,1,0,0,0,0|3,0,0]=4 1216 B12R1.119 CS(=O)(=O)Nc1cccc(c1)O 271570a_203496583355_100000165606 [0,1,0,0,0,0|2,0,0]=3 1217 B12R1.119 CS(=O)(=O)Nc1cccc(c1)O 40a_100000210217_100000738038 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.119 C[Si](C)(C)Oc1cccc(c1)O 271570a_203496583355_200009816539 [0,1,0,0,0,0|1,1,0]=3 1219 B12R1.119 Cc1cccc(c1)NS(=O)(=O)C 40a_100000188690_100000738038 [0,1,0,0,0,0|3,0,0]=4 1220 B12R1.119 Cc1cccc(c1)OC(C)(C)C 34a_100000210337_100000210625 [0,1,0,0,0,0|2,0,1]=4 1221 B12R1.119 NS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_100000725052 [0,1,0,0,0,0|3,0,0]=4 1222 B12R1.119 Oc1cccc(c1)OC(F)(F)F 271570a_203496583355_100000036528 [0,1,0,0,0,0|2,0,1]=4 1223 B12R1.127 CC(=Cc1cc(ccc1Br)Br)C 271570a_100102525489_100011483371 [0,1,0,0,0,0|3,0,0]=4 1224 B12R1.127 CC(=Cc1cc(ccc1Br)C)C 271570a_100102525489_100012353751 [0,1,0,0,0,0|3,0,0]=4 1225 B12R1.127 CC(=Cc1cc(ccc1Br)Cl)C 271570a_100102525489_100012339723 [0,1,0,0,0,0|3,0,0]=4 1226 B12R1.127 CC(=Cc1cc(ccc1Br)F)C 271570a_100102525489_100011217576 [0,1,0,0,0,0|3,0,0]=4 1227 B12R1.127 CC(=Cc1cc(ccc1Br)N)C 271570a_100102525489_100000750459 [0,1,0,0,0,0|3,0,0]=4 1228 B12R1.127 CC(=Cc1cc(ccc1Br)O)C 271570a_100102525489_100012339312 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.127 CC(=Cc1cc(ccc1C)Br)C 271570a_100102525489_100011344865 [0,1,0,0,0,0|3,0,0]=4 1230 B12R1.127 CC(=Cc1cc(ccc1C)C)C 271570a_100102525489_100000210833 [0,1,0,0,0,0|3,0,0]=4 1231 B12R1.127 CC(=Cc1cc(ccc1C)Cl)C 271570a_100102525489_100011263213 [0,1,0,0,0,0|3,0,0]=4 1232 B12R1.127 CC(=Cc1cc(ccc1C)F)C 271570a_100102525489_100011218078 [0,1,0,0,0,0|3,0,0]=4 1233 B12R1.127 CC(=Cc1cc(ccc1C)N)C 271570a_100102525489_100000736455 [0,1,0,0,0,0|3,0,0]=4 1234 B12R1.127 CC(=Cc1cc(ccc1C)O)C 271570a_100102525489_100011380479 [0,1,0,0,0,0|2,0,0]=3 1235 B12R1.127 CC(=Cc1cc(ccc1Cl)Br)C 271570a_100102525489_100011772130 [0,1,0,0,0,0|3,0,0]=4 1236 B12R1.127 CC(=Cc1cc(ccc1Cl)C)C 271570a_100102525489_100012356289 [0,1,0,0,0,0|3,0,0]=4 1237 B12R1.127 CC(=Cc1cc(ccc1Cl)Cl)C 271570a_100102525489_100000707729 [0,1,0,0,0,0|3,0,0]=4 1238 B12R1.127 CC(=Cc1cc(ccc1Cl)F)C 271570a_100102525489_100011217299 [0,1,0,0,0,0|3,0,0]=4 1239 B12R1.127 CC(=Cc1cc(ccc1Cl)N)C 271570a_100102525489_100012360549 [0,1,0,0,0,0|3,0,0]=4 1240 B12R1.127 CC(=Cc1cc(ccc1Cl)O)C 271570a_100102525489_100000049588 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.127 CC(=Cc1cc(ccc1F)Br)C 271570a_100102525489_100011217312 [0,1,0,0,0,0|3,0,0]=4 1242 B12R1.127 CC(=Cc1cc(ccc1F)C)C 271570a_100102525489_100000736223 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.127 CC(=Cc1cc(ccc1F)Cl)C 271570a_100102525489_100011218116 [0,1,0,0,0,0|3,0,0]=4 1244 B12R1.127 CC(=Cc1cc(ccc1F)F)C 271570a_100102525489_100000750033 [0,1,0,0,0,0|3,0,0]=4 1245 B12R1.127 CC(=Cc1cc(ccc1F)N)C 271570a_100102525489_100000760356 [0,1,0,0,0,0|3,0,0]=4 1246 B12R1.127 CC(=Cc1cc(ccc1F)O)C 271570a_100102525489_100000693481 [0,1,0,0,0,0|2,0,0]=3 1247 B12R1.127 CC(=Cc1cc(ccc1N)Br)C 271570a_100102525489_100000187925 [0,1,0,0,0,0|3,0,0]=4 1248 B12R1.127 CC(=Cc1cc(ccc1N)C)C 271570a_100102525489_100000210942 [0,1,0,0,0,0|3,0,0]=4 1249 B12R1.127 CC(=Cc1cc(ccc1N)Cl)C 271570a_100102525489_100000761889 [0,1,0,0,0,0|3,0,0]=4 1250 B12R1.127 CC(=Cc1cc(ccc1N)F)C 271570a_100102525489_100000760547 [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.127 CC(=Cc1cc(ccc1N)N)C 271570a_100102525489_100011534242 [0,1,0,0,0,0|3,0,0]=4 1252 B12R1.127 CC(=Cc1cc(ccc1N)O)C 271570a_100102525489_100012001276 [0,1,0,0,0,0|2,0,0]=3 1253 B12R1.127 CC(=Cc1cc(ccc1O)Br)C 271570a_100102525489_100012355227 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.127 CC(=Cc1cc(ccc1O)C)C 271570a_100102525489_100000765521 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.127 CC(=Cc1cc(ccc1O)Cl)C 271570a_100102525489_100011356953 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.127 CC(=Cc1cc(ccc1O)F)C 271570a_100102525489_100000211999 [0,1,0,0,0,0|3,0,0]=4 1257 B12R1.127 CC(=Cc1cc(ccc1O)N)C 271570a_100102525489_100011534360 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.127 CC(=Cc1cc(ccc1O)O)C 271570a_100102525489_100009813629 [0,1,0,0,0,0|2,0,0]=3 1259 B12R1.127 CC(=Cc1cc(cnc1C)O)C 271570a_100102525489_100009819603 [0,1,0,0,0,0|3,0,0]=4 1260 B12R1.127 CC(=Cc1cc(cnc1F)O)C 271570a_100102525489_100009817267 [0,1,0,0,0,0|3,0,0]=4 1261 B12R1.127 CC(=Cc1cc(ncc1C)O)C 271570a_100102525489_100009831917 [0,1,0,0,0,0|3,0,0]=4 1262 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100000070787_100011982794 [0,1,0,0,0,0|2,0,0]=3 1263 B12R1.127 CC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200000210301 [0,1,0,0,0,0|2,0,0]=3 1264 B12R1.127 CC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_200000210301 [0,1,0,0,0,0|2,0,0]=3 1265 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000070787_100000733903 [0,1,0,0,0,0|2,0,0]=3 1266 B12R1.127 CC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200000210301 [0,1,0,0,0,0|2,0,0]=3 1267 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000070787_100000736370 [0,1,0,0,0,0|2,0,0]=3 1268 B12R1.127 CC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200000210301 [0,1,0,0,0,0|2,0,0]=3 1269 B12R1.127 CC(=O)Cc1cc(ccc1Br)I 1458a_100000070787_100012355412 [0,1,0,0,0,0|2,0,0]=3 1270 B12R1.127 CC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_200000210301 [0,1,0,0,0,0|2,0,0]=3 1271 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000070787_100000184699 [0,1,0,0,0,0|2,0,0]=3 1272 B12R1.127 CC(=O)Cc1cc(ccc1C)C 1458a_100000749331_200000210301 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.127 CC(=O)Cc1cc(ccc1C)Cl 1458a_100000070787_100012186985 [0,1,0,0,0,0|2,0,0]=3 1274 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100000070787_100000709795 [0,1,0,0,0,0|2,0,0]=3 1275 B12R1.127 CC(=O)Cc1cc(ccc1C)F 1458a_100011219217_200000210301 [0,1,0,0,0,0|2,0,0]=3 1276 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100000070787_100000763347 [0,1,0,0,0,0|2,0,0]=3 1277 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200000210301 [0,1,0,0,0,0|2,0,0]=3 1278 B12R1.127 CC(=O)Cc1cc(ccc1Cl)C 1458a_100000070787_100009871730 [0,1,0,0,0,0|2,0,0]=3 1279 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000070787_100000754809 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.127 CC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200000210301 [0,1,0,0,0,0|2,0,0]=3 1281 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100000070787_100000709952 [0,1,0,0,0,0|2,0,0]=3 1282 B12R1.127 CC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200000210301 [0,1,0,0,0,0|2,0,0]=3 1283 B12R1.127 CC(=O)Cc1cc(ccc1Cl)I 1458a_100000070787_100010188191 [0,1,0,0,0,0|2,0,0]=3 1284 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000070787_100000736399 [0,1,0,0,0,0|2,0,0]=3 1285 B12R1.127 CC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200000210301 [0,1,0,0,0,0|2,0,0]=3 1286 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100000070787_100011260760 [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.127 CC(=O)Cc1cc(ccc1F)C 1458a_100011667363_200000210301 [0,1,0,0,0,0|2,0,0]=3 1288 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100000070787_100000716957 [0,1,0,0,0,0|2,0,0]=3 1289 B12R1.127 CC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200000210301 [0,1,0,0,0,0|2,0,0]=3 1290 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000070787_100000741279 [0,1,0,0,0,0|2,0,0]=3 1291 B12R1.127 CC(=O)Cc1cc(ccc1F)F 1458a_100000762760_200000210301 [0,1,0,0,0,0|2,0,0]=3 1292 B12R1.127 CC(=O)Cc1cc(ccc1F)I 1458a_100000070787_200010149601 [0,1,0,0,0,0|2,0,0]=3 1293 B12R1.127 CC(=O)Cc1cc(ccc1I)Br 1458a_100000070787_100012362523 [0,1,0,0,0,0|2,0,0]=3 1294 B12R1.127 CC(=O)Cc1cc(ccc1I)Cl 1458a_100000070787_100012348826 [0,1,0,0,0,0|2,0,0]=3 1295 B12R1.127 CC(=O)Cc1cc(ccc1I)F 1458a_100000070787_100010149606 [0,1,0,0,0,0|2,0,0]=3 1296 B12R1.127 CC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200000210301 [0,1,0,0,0,0|2,0,0]=3 1297 B12R1.127 CC(=O)Cc1cc(ccc1O)F 1458a_100000070787_100010161318 [0,1,0,0,0,0|2,0,0]=3 1298 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [0,1,0,0,0,0|1,0,0]=2 1299 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [0,1,0,0,0,0|1,0,0]=2 1300 B12R1.127 CC(=O)Cc1cc(cnc1Br)Br 1458a_100000070787_100010253922 [0,1,0,0,0,0|3,0,0]=4 1301 B12R1.127 CC(=O)Cc1cc(cnc1Cl)Br 1458a_100000070787_100009816982 [0,1,0,0,0,0|3,0,0]=4 1302 B12R1.127 CC(=O)Cc1nc(ccc1Cl)C 1458a_100000070787_200009852033 [0,1,0,0,0,0|3,0,0]=4 1303 B12R1.127 CC(=O)Cc1nc(ccc1Cl)Cl 1458a_100000070787_100000059412 [0,1,0,0,0,0|3,0,0]=4 1304 B12R1.127 CC(=O)Cc1nc(ccc1F)Br 1458a_100000070787_100010065826 [0,1,0,0,0,0|3,0,0]=4 1305 B12R1.127 CC(=O)Cc1nc(ccc1F)Cl 1458a_100000070787_100009881012 [0,1,0,0,0,0|3,0,0]=4 1306 B12R1.127 CC(=O)Cc1nc(ccc1O)C 1458a_100000070787_100020630696 [0,1,0,0,0,0|3,0,0]=4 1307 B12R1.127 CC(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200000210301 [0,1,0,0,0,0|3,0,0]=4 1308 B12R1.127 CC(=O)Cn1cc(ccc1=O)C 1458a_100009850670_200000210301 [0,1,0,0,0,0|3,0,0]=4 1309 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100015343762 [0,1,0,0,0,0|2,0,0]=3 1310 B12R1.127 CC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100015343762 [0,1,0,0,0,0|2,0,0]=3 1311 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100015343762 [0,1,0,0,0,0|2,0,0]=3 1312 B12R1.127 CC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100015343762 [0,1,0,0,0,0|2,0,0]=3 1313 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100015343762 [0,1,0,0,0,0|2,0,0]=3 1314 B12R1.127 CC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100015343762 [0,1,0,0,0,0|2,0,0]=3 1315 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100015343762 [0,1,0,0,0,0|2,0,0]=3 1316 B12R1.127 CC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100015343762 [0,1,0,0,0,0|2,0,0]=3 1317 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100015343762 [0,1,0,0,0,0|2,0,0]=3 1318 B12R1.127 CC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100015343762 [0,1,0,0,0,0|2,0,0]=3 1319 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000070787 [0,1,0,0,0,0|1,0,0]=2 1320 B12R1.127 CC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100103153847 [0,1,0,0,0,0|1,0,0]=2 1321 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100015343762 [0,1,0,0,0,0|2,0,0]=3 1322 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100015343762 [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000070787 [0,1,0,0,0,0|2,0,0]=3 1324 B12R1.127 CC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100103153847 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.127 CC(=O)Nc1cc(ccc1C)C 11a_100000185781_100015343762 [0,1,0,0,0,0|2,0,0]=3 1326 B12R1.127 CC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100015343762 [0,1,0,0,0,0|2,0,0]=3 1327 B12R1.127 CC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000070787 [0,1,0,0,0,0|2,0,0]=3 1328 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100015343762 [0,1,0,0,0,0|2,0,0]=3 1329 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100015343762 [0,1,0,0,0,0|2,0,0]=3 1330 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000070787 [0,1,0,0,0,0|2,0,0]=3 1331 B12R1.127 CC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100103153847 [0,1,0,0,0,0|2,0,0]=3 1332 B12R1.127 CC(=O)Nc1cc(ccc1C)F 11a_100000211107_100015343762 [0,1,0,0,0,0|2,0,0]=3 1333 B12R1.127 CC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100015343762 [0,1,0,0,0,0|2,0,0]=3 1334 B12R1.127 CC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000070787 [0,1,0,0,0,0|2,0,0]=3 1335 B12R1.127 CC(=O)Nc1cc(ccc1C)I 11a_100000761890_100015343762 [0,1,0,0,0,0|2,0,0]=3 1336 B12R1.127 CC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100015343762 [0,1,0,0,0,0|2,0,0]=3 1337 B12R1.127 CC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000070787 [0,1,0,0,0,0|2,0,0]=3 1338 B12R1.127 CC(=O)Nc1cc(ccc1C)I 527a_100000761890_100103153847 [0,1,0,0,0,0|2,0,0]=3 1339 B12R1.127 CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000070787 [0,1,0,0,0,0|1,0,0]=2 1340 B12R1.127 CC(=O)Nc1cc(ccc1C)O 271570a_203496583355_100011344836 [0,1,0,0,0,0|1,0,0]=2 1341 B12R1.127 CC(=O)Nc1cc(ccc1C)O 527a_100011216113_100103153847 [0,1,0,0,0,0|1,0,0]=2 1342 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100015343762 [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100015343762 [0,1,0,0,0,0|2,0,0]=3 1344 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100015343762 [0,1,0,0,0,0|2,0,0]=3 1345 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100015343762 [0,1,0,0,0,0|2,0,0]=3 1346 B12R1.127 CC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000070787 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100015343762 [0,1,0,0,0,0|2,0,0]=3 1348 B12R1.127 CC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100015343762 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100015343762 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.127 CC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100015343762 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100015343762 [0,1,0,0,0,0|2,0,0]=3 1352 B12R1.127 CC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100015343762 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.127 CC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100103153847 [0,1,0,0,0,0|1,0,0]=2 1354 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100015343762 [0,1,0,0,0,0|2,0,0]=3 1355 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100015343762 [0,1,0,0,0,0|2,0,0]=3 1356 B12R1.127 CC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000070787 [0,1,0,0,0,0|2,0,0]=3 1357 B12R1.127 CC(=O)Nc1cc(ccc1F)C 11a_100000211285_100015343762 [0,1,0,0,0,0|2,0,0]=3 1358 B12R1.127 CC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100015343762 [0,1,0,0,0,0|2,0,0]=3 1359 B12R1.127 CC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000070787 [0,1,0,0,0,0|2,0,0]=3 1360 B12R1.127 CC(=O)Nc1cc(ccc1F)C 527a_100000211285_100103153847 [0,1,0,0,0,0|2,0,0]=3 1361 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100015343762 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.127 CC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100015343762 [0,1,0,0,0,0|2,0,0]=3 1363 B12R1.127 CC(=O)Nc1cc(ccc1F)F 11a_100000210742_100015343762 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.127 CC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100015343762 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.127 CC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000070787 [0,1,0,0,0,0|2,0,0]=3 1366 B12R1.127 CC(=O)Nc1cc(ccc1F)I 11a_100011464823_100015343762 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.127 CC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100015343762 [0,1,0,0,0,0|2,0,0]=3 1368 B12R1.127 CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100015343762 [0,1,0,0,0,0|1,0,0]=2 1369 B12R1.127 CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000070787 [0,1,0,0,0,0|1,0,0]=2 1370 B12R1.127 CC(=O)Nc1cc(ccc1F)O 271570a_203496583355_200011951791 [0,1,0,0,0,0|1,0,0]=2 1371 B12R1.127 CC(=O)Nc1cc(ccc1F)O 527a_100012017239_100103153847 [0,1,0,0,0,0|1,0,0]=2 1372 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100015343762 [0,1,0,0,0,0|2,0,0]=3 1373 B12R1.127 CC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100015343762 [0,1,0,0,0,0|2,0,0]=3 1374 B12R1.127 CC(=O)Nc1cc(ccc1I)C 11a_100011216686_100015343762 [0,1,0,0,0,0|2,0,0]=3 1375 B12R1.127 CC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100015343762 [0,1,0,0,0,0|2,0,0]=3 1376 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100015343762 [0,1,0,0,0,0|2,0,0]=3 1377 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100015343762 [0,1,0,0,0,0|2,0,0]=3 1378 B12R1.127 CC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000070787 [0,1,0,0,0,0|2,0,0]=3 1379 B12R1.127 CC(=O)Nc1cc(ccc1I)F 11a_100011218093_100015343762 [0,1,0,0,0,0|2,0,0]=3 1380 B12R1.127 CC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100015343762 [0,1,0,0,0,0|2,0,0]=3 1381 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000070787 [0,1,0,0,0,0|2,0,0]=3 1382 B12R1.127 CC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100103153847 [0,1,0,0,0,0|2,0,0]=3 1383 B12R1.127 CC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000070787 [0,1,0,0,0,0|2,0,0]=3 1384 B12R1.127 CC(=O)Nc1cc(ccc1O)C 271570a_203496583355_100000182586 [0,1,0,0,0,0|2,0,0]=3 1385 B12R1.127 CC(=O)Nc1cc(ccc1O)C 527a_100011215204_100103153847 [0,1,0,0,0,0|2,0,0]=3 1386 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000070787 [0,1,0,0,0,0|2,0,0]=3 1387 B12R1.127 CC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100103153847 [0,1,0,0,0,0|2,0,0]=3 1388 B12R1.127 CC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000070787 [0,1,0,0,0,0|2,0,0]=3 1389 B12R1.127 CC(=O)Nc1cc(ccc1O)F 271570a_203496583355_100012558231 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.127 CC(=O)Nc1cc(ccc1O)F 527a_100000759472_100103153847 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.127 CC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000070787 [0,1,0,0,0,0|2,0,0]=3 1392 B12R1.127 CC(=O)Nc1cc(ccc1O)I 527a_100000753495_100103153847 [0,1,0,0,0,0|2,0,0]=3 1393 B12R1.127 CC(=O)Nc1cc(cnc1C)O 271570a_203496583355_100010117071 [0,1,0,0,0,0|2,0,0]=3 1394 B12R1.127 CC(=O)Oc1cc(ccc1C)O 271570a_203496583355_100103282185 [0,1,0,0,0,0|0,0,0]=1 1395 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [0,1,0,0,0,0|1,0,0]=2 1396 B12R1.127 CC(C)Nc1cc(ccc1Br)O 34a_100011999798_100000210206 [0,1,0,0,0,0|2,0,1]=4 1397 B12R1.127 CC(C)Nc1cc(ccc1Cl)O 34a_100011934297_100000210206 [0,1,0,0,0,0|2,0,1]=4 1398 B12R1.127 CC(C)Nc1cc(ccc1F)O 34a_100012017239_100000210206 [0,1,0,0,0,0|2,0,1]=4 1399 B12R1.127 CC(C)Oc1cc(ccc1Br)Br 34a_100011220040_100000210206 [0,1,0,0,0,0|2,0,1]=4 1400 B12R1.127 CC(C)Oc1cc(ccc1Br)Br 7a_100011220040_100000210206 [0,1,0,0,0,0|2,0,1]=4 1401 B12R1.127 CC(C)Oc1cc(ccc1Br)Cl 34a_100012339455_100000210206 [0,1,0,0,0,0|2,0,1]=4 1402 B12R1.127 CC(C)Oc1cc(ccc1Br)Cl 7a_100012339455_100000210206 [0,1,0,0,0,0|2,0,1]=4 1403 B12R1.127 CC(C)Oc1cc(ccc1Br)F 34a_100000690578_100000210206 [0,1,0,0,0,0|2,0,1]=4 1404 B12R1.127 CC(C)Oc1cc(ccc1Br)F 7a_100000690578_100000210206 [0,1,0,0,0,0|2,0,1]=4 1405 B12R1.127 CC(C)Oc1cc(ccc1Br)I 34a_100012356990_100000210206 [0,1,0,0,0,0|2,0,1]=4 1406 B12R1.127 CC(C)Oc1cc(ccc1Br)I 7a_100012356990_100000210206 [0,1,0,0,0,0|2,0,1]=4 1407 B12R1.127 CC(C)Oc1cc(ccc1Cl)Br 34a_100000738945_100000210206 [0,1,0,0,0,0|2,0,1]=4 1408 B12R1.127 CC(C)Oc1cc(ccc1Cl)Br 7a_100000738945_100000210206 [0,1,0,0,0,0|2,0,1]=4 1409 B12R1.127 CC(C)Oc1cc(ccc1Cl)Cl 34a_100000211422_100000210206 [0,1,0,0,0,0|2,0,1]=4 1410 B12R1.127 CC(C)Oc1cc(ccc1Cl)Cl 7a_100000211422_100000210206 [0,1,0,0,0,0|2,0,1]=4 1411 B12R1.127 CC(C)Oc1cc(ccc1Cl)F 34a_100000692107_100000210206 [0,1,0,0,0,0|2,0,1]=4 1412 B12R1.127 CC(C)Oc1cc(ccc1Cl)F 7a_100000692107_100000210206 [0,1,0,0,0,0|2,0,1]=4 1413 B12R1.127 CC(C)Oc1cc(ccc1Cl)I 34a_100011356854_100000210206 [0,1,0,0,0,0|2,0,1]=4 1414 B12R1.127 CC(C)Oc1cc(ccc1Cl)I 7a_100011356854_100000210206 [0,1,0,0,0,0|2,0,1]=4 1415 B12R1.127 CC(C)Oc1cc(ccc1Cl)N 34a_100011934209_100000210206 [0,1,0,0,0,0|2,0,1]=4 1416 B12R1.127 CC(C)Oc1cc(ccc1F)Br 34a_100000686035_100000210206 [0,1,0,0,0,0|2,0,1]=4 1417 B12R1.127 CC(C)Oc1cc(ccc1F)Br 7a_100000686035_100000210206 [0,1,0,0,0,0|2,0,1]=4 1418 B12R1.127 CC(C)Oc1cc(ccc1F)Cl 34a_100000757397_100000210206 [0,1,0,0,0,0|2,0,1]=4 1419 B12R1.127 CC(C)Oc1cc(ccc1F)Cl 7a_100000757397_100000210206 [0,1,0,0,0,0|2,0,1]=4 1420 B12R1.127 CC(C)Oc1cc(ccc1F)F 34a_100000752141_100000210206 [0,1,0,0,0,0|2,0,1]=4 1421 B12R1.127 CC(C)Oc1cc(ccc1F)F 7a_100000752141_100000210206 [0,1,0,0,0,0|2,0,1]=4 1422 B12R1.127 CC(C)Oc1cc(ccc1F)I 34a_100009958187_100000210206 [0,1,0,0,0,0|2,0,1]=4 1423 B12R1.127 CC(C)Oc1cc(ccc1F)I 7a_100009958187_100000210206 [0,1,0,0,0,0|2,0,1]=4 1424 B12R1.127 CC(C)Oc1cc(ccc1F)N 34a_100012017398_100000210206 [0,1,0,0,0,0|2,0,1]=4 1425 B12R1.127 CC(C)Oc1cc(ccc1F)N 7a_100012017398_100000210206 [0,1,0,0,0,0|2,0,1]=4 1426 B12R1.127 CC(C)Oc1cc(ccc1F)O 271570a_203496583355_200012350295 [0,1,0,0,0,0|1,0,1]=3 1427 B12R1.127 CC(C)Oc1cc(ccc1I)Br 34a_100012344904_100000210206 [0,1,0,0,0,0|2,0,1]=4 1428 B12R1.127 CC(C)Oc1cc(ccc1I)Br 7a_100012344904_100000210206 [0,1,0,0,0,0|2,0,1]=4 1429 B12R1.127 CC(C)Oc1cc(ccc1I)Cl 34a_100000050036_100000210206 [0,1,0,0,0,0|2,0,1]=4 1430 B12R1.127 CC(C)Oc1cc(ccc1I)Cl 7a_100000050036_100000210206 [0,1,0,0,0,0|2,0,1]=4 1431 B12R1.127 CC(C)Oc1cc(ccc1I)F 34a_100010084537_100000210206 [0,1,0,0,0,0|2,0,1]=4 1432 B12R1.127 CC(C)Oc1cc(ccc1I)F 7a_100010084537_100000210206 [0,1,0,0,0,0|2,0,1]=4 1433 B12R1.127 CC(C)Oc1cc(ccc1N)Br 34a_100000739049_100000210206 [0,1,0,0,0,0|2,0,1]=4 1434 B12R1.127 CC(C)Oc1cc(ccc1N)Br 7a_100000739049_100000210206 [0,1,0,0,0,0|2,0,1]=4 1435 B12R1.127 CC(C)Oc1cc(ccc1N)Cl 34a_100000185728_100000210206 [0,1,0,0,0,0|2,0,1]=4 1436 B12R1.127 CC(C)Oc1cc(ccc1N)Cl 7a_100000185728_100000210206 [0,1,0,0,0,0|2,0,1]=4 1437 B12R1.127 CC(C)Oc1cc(ccc1N)F 34a_100000753323_100000210206 [0,1,0,0,0,0|2,0,1]=4 1438 B12R1.127 CC(C)Oc1cc(ccc1N)F 7a_100000753323_100000210206 [0,1,0,0,0,0|2,0,1]=4 1439 B12R1.127 CC(C)Oc1cc(ccc1N)I 34a_100000057187_100000210206 [0,1,0,0,0,0|2,0,1]=4 1440 B12R1.127 CC(C)Oc1cc(ccc1N)I 7a_100000057187_100000210206 [0,1,0,0,0,0|2,0,1]=4 1441 B12R1.127 CC(C)Oc1cc(ccc1N)N 34a_100025717382_100000210206 [0,1,0,0,0,0|2,0,1]=4 1442 B12R1.127 CC(C)Oc1cc(ccc1O)F 271570a_203496583355_200012359391 [0,1,0,0,0,0|2,0,1]=4 1443 B12R1.127 CC(C)Oc1cc(cnc1F)O 271570a_203496583355_200010713186 [0,1,0,0,0,0|2,0,1]=4 1444 B12R1.127 CC(C)Sc1cc(ccc1Br)O 62a_100000210206_100012339312 [0,1,0,0,0,0|1,1,1]=4 1445 B12R1.127 CC(C)Sc1cc(ccc1Br)O 62a_100012339312_100000210206 [0,1,0,0,0,0|1,1,1]=4 1446 B12R1.127 CC(C)Sc1cc(ccc1Cl)O 62a_100000049588_100000210206 [0,1,0,0,0,0|1,1,1]=4 1447 B12R1.127 CC(C)Sc1cc(ccc1Cl)O 62a_100000210206_100000049588 [0,1,0,0,0,0|1,1,1]=4 1448 B12R1.127 CC(C)Sc1cc(ccc1F)O 62a_100000210206_100000693481 [0,1,0,0,0,0|1,1,1]=4 1449 B12R1.127 CC(C)Sc1cc(ccc1F)O 62a_100000693481_100000210206 [0,1,0,0,0,0|1,1,1]=4 1450 B12R1.127 CC(C)Sc1cc(ccc1N)O 62a_100000210206_100012001276 [0,1,0,0,0,0|1,1,1]=4 1451 B12R1.127 CC(C)Sc1cc(ccc1N)O 62a_100012001276_100000210206 [0,1,0,0,0,0|1,1,1]=4 1452 B12R1.127 CC(C)Sc1cc(ccc1O)O 62a_100000210206_100009813629 [0,1,0,0,0,0|1,1,1]=4 1453 B12R1.127 CN(C)Cc1cc(ccc1F)O 271570a_203496583355_100011597561 [0,1,0,0,0,0|3,0,0]=4 1454 B12R1.127 CN(C)Cc1cc(ccc1O)O 271570a_203496583355_100011934597 [0,1,0,0,0,0|3,0,0]=4 1455 B12R1.127 Cc1ccc(=O)n(c1)CC(=O)[13CH3] 1458a_100009850670_200025704644 [0,1,0,0,0,0|3,0,0]=4 1456 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100010004923_200025704644 [0,1,0,0,0,0|2,0,0]=3 1457 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])C 1458a_100000749331_200025704644 [0,1,0,0,0,0|2,0,0]=3 1458 B12R1.127 Cc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100011667363_200025704644 [0,1,0,0,0,0|2,0,0]=3 1459 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 34a_100012002257_100000210206 [0,1,0,0,0,0|2,0,1]=4 1460 B12R1.127 Cc1ccc(c(c1)OC(C)C)Br 7a_100012002257_100000210206 [0,1,0,0,0,0|2,0,1]=4 1461 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 34a_100000210931_100000210206 [0,1,0,0,0,0|2,0,1]=4 1462 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 7a_100000210931_100000210206 [0,1,0,0,0,0|2,0,1]=4 1463 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 34a_100000211493_100000210206 [0,1,0,0,0,0|2,0,1]=4 1464 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl 7a_100000211493_100000210206 [0,1,0,0,0,0|2,0,1]=4 1465 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 34a_100000759540_100000210206 [0,1,0,0,0,0|2,0,1]=4 1466 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 7a_100000759540_100000210206 [0,1,0,0,0,0|2,0,1]=4 1467 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 34a_100000211527_100000210206 [0,1,0,0,0,0|2,0,1]=4 1468 B12R1.127 Cc1ccc(c(c1)OC(C)C)N 7a_100000211527_100000210206 [0,1,0,0,0,0|2,0,1]=4 1469 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])Br 1458a_100010244045_200025704644 [0,1,0,0,0,0|2,0,0]=3 1470 B12R1.127 Cc1ccc(cc1CC(=O)[13CH3])F 1458a_100011219217_200025704644 [0,1,0,0,0,0|2,0,0]=3 1471 B12R1.127 Cc1ccc(cc1NC(C)C)O 271570a_203496583355_200000714908 [0,1,0,0,0,0|2,0,1]=4 1472 B12R1.127 Cc1ccc(cc1NC(C)C)O 34a_100011216113_100000210206 [0,1,0,0,0,0|2,0,1]=4 1473 B12R1.127 Cc1ccc(cc1OC(C)C)Br 34a_100000685420_100000210206 [0,1,0,0,0,0|2,0,1]=4 1474 B12R1.127 Cc1ccc(cc1OC(C)C)Br 7a_100000685420_100000210206 [0,1,0,0,0,0|2,0,1]=4 1475 B12R1.127 Cc1ccc(cc1OC(C)C)Cl 34a_100000756515_100000210206 [0,1,0,0,0,0|2,0,1]=4 1476 B12R1.127 Cc1ccc(cc1OC(C)C)Cl 7a_100000756515_100000210206 [0,1,0,0,0,0|2,0,1]=4 1477 B12R1.127 Cc1ccc(cc1OC(C)C)F 34a_100000690566_100000210206 [0,1,0,0,0,0|2,0,1]=4 1478 B12R1.127 Cc1ccc(cc1OC(C)C)F 7a_100000690566_100000210206 [0,1,0,0,0,0|2,0,1]=4 1479 B12R1.127 Cc1ccc(cc1OC(C)C)I 7a_100000766334_100000210206 [0,1,0,0,0,0|2,0,1]=4 1480 B12R1.127 Cc1ccc(cc1OC(C)C)N 34a_100000759471_100000210206 [0,1,0,0,0,0|2,0,1]=4 1481 B12R1.127 Cc1ccc(cc1OC(C)C)N 7a_100000759471_100000210206 [0,1,0,0,0,0|2,0,1]=4 1482 B12R1.127 Cc1ccc(cc1OC(C)C)O 271570a_203496583355_200012359587 [0,1,0,0,0,0|1,0,1]=3 1483 B12R1.127 Cc1ccc(cc1SC(C)C)O 62a_100000210206_100011380479 [0,1,0,0,0,0|1,1,1]=4 1484 B12R1.127 Cc1ccc(cc1SC(C)C)O 62a_100011380479_100000210206 [0,1,0,0,0,0|1,1,1]=4 1485 B12R1.127 Nc1ccc(cc1OC(F)F)O 271570a_203496583355_100010212277 [0,1,0,0,0,0|2,0,1]=4 1486 B12R1.127 Oc1ccc(c(c1)OC(F)F)F 271570a_203496583355_100012359426 [0,1,0,0,0,0|2,0,1]=4 1487 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_200025704644 [0,1,0,0,0,0|2,0,0]=3 1488 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_200025704644 [0,1,0,0,0,0|2,0,0]=3 1489 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Br)F 1458a_100000690878_200025704644 [0,1,0,0,0,0|2,0,0]=3 1490 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_200025704644 [0,1,0,0,0,0|2,0,0]=3 1491 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_200025704644 [0,1,0,0,0,0|2,0,0]=3 1492 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_200025704644 [0,1,0,0,0,0|2,0,0]=3 1493 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Br 1458a_100000690877_200025704644 [0,1,0,0,0,0|2,0,0]=3 1494 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_200025704644 [0,1,0,0,0,0|2,0,0]=3 1495 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1F)F 1458a_100000762760_200025704644 [0,1,0,0,0,0|2,0,0]=3 1496 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)Br 1458a_100010072483_200025704644 [0,1,0,0,0,0|2,0,0]=3 1497 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [0,1,0,0,0,0|1,0,0]=2 1498 B12R1.127 [13CH3]C(=O)Cn1cc(ccc1=O)Br 1458a_200000738489_200025704644 [0,1,0,0,0,0|3,0,0]=4 1499 B12R1.224 CC(=Cc1cccc(c1Br)O)C 271570a_100102525489_100010187914 [0,1,0,0,0,0|2,0,0]=3 1500 B12R1.224 CC(=Cc1cccc(c1C)Br)C 271570a_100102525489_100012353703 [0,1,0,0,0,0|3,0,0]=4 1501 B12R1.224 CC(=Cc1cccc(c1C)C)C 271570a_100102525489_100011214922 [0,1,0,0,0,0|3,0,0]=4 1502 B12R1.224 CC(=Cc1cccc(c1C)Cl)C 271570a_100102525489_100000726075 [0,1,0,0,0,0|3,0,0]=4 1503 B12R1.224 CC(=Cc1cccc(c1C)F)C 271570a_100102525489_100011216893 [0,1,0,0,0,0|3,0,0]=4 1504 B12R1.224 CC(=Cc1cccc(c1C)N)C 271570a_100102525489_100000761887 [0,1,0,0,0,0|3,0,0]=4 1505 B12R1.224 CC(=Cc1cccc(c1C)O)C 271570a_100102525489_100012002258 [0,1,0,0,0,0|2,0,0]=3 1506 B12R1.224 CC(=Cc1cccc(c1Cl)Br)C 271570a_100102525489_100010142854 [0,1,0,0,0,0|3,0,0]=4 1507 B12R1.224 CC(=Cc1cccc(c1Cl)C)C 271570a_100102525489_200012352035 [0,1,0,0,0,0|3,0,0]=4 1508 B12R1.224 CC(=Cc1cccc(c1Cl)Cl)C 271570a_100102525489_100011215384 [0,1,0,0,0,0|3,0,0]=4 1509 B12R1.224 CC(=Cc1cccc(c1Cl)F)C 271570a_100102525489_200010234923 [0,1,0,0,0,0|3,0,0]=4 1510 B12R1.224 CC(=Cc1cccc(c1Cl)O)C 271570a_100102525489_100000049636 [0,1,0,0,0,0|2,0,0]=3 1511 B12R1.224 CC(=Cc1cccc(c1F)Br)C 271570a_100102525489_100000702267 [0,1,0,0,0,0|3,0,0]=4 1512 B12R1.224 CC(=Cc1cccc(c1F)C)C 271570a_100102525489_100000717567 [0,1,0,0,0,0|3,0,0]=4 1513 B12R1.224 CC(=Cc1cccc(c1F)Cl)C 271570a_100102525489_100011217346 [0,1,0,0,0,0|3,0,0]=4 1514 B12R1.224 CC(=Cc1cccc(c1F)F)C 271570a_100102525489_100000694657 [0,1,0,0,0,0|3,0,0]=4 1515 B12R1.224 CC(=Cc1cccc(c1F)N)C 271570a_100102525489_100011935091 [0,1,0,0,0,0|3,0,0]=4 1516 B12R1.224 CC(=Cc1cccc(c1F)O)C 271570a_100102525489_100009817021 [0,1,0,0,0,0|2,0,0]=3 1517 B12R1.224 CC(=Cc1cccc(c1N)Br)C 271570a_100102525489_100010146558 [0,1,0,0,0,0|3,0,0]=4 1518 B12R1.224 CC(=Cc1cccc(c1N)C)C 271570a_100102525489_100011834072 [0,1,0,0,0,0|3,0,0]=4 1519 B12R1.224 CC(=Cc1cccc(c1N)Cl)C 271570a_100102525489_100010190421 [0,1,0,0,0,0|3,0,0]=4 1520 B12R1.224 CC(=Cc1cccc(c1N)F)C 271570a_100102525489_100000042321 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.224 CC(=Cc1cccc(c1N)N)C 271570a_100102525489_100015191791 [0,1,0,0,0,0|3,0,0]=4 1522 B12R1.224 CC(=Cc1cccc(c1N)O)C 271570a_100102525489_100011934926 [0,1,0,0,0,0|2,0,0]=3 1523 B12R1.224 CC(=Cc1cccc(c1O)Br)C 271570a_100102525489_100010084509 [0,1,0,0,0,0|3,0,0]=4 1524 B12R1.224 CC(=Cc1cccc(c1O)C)C 271570a_100102525489_100009817157 [0,1,0,0,0,0|3,0,0]=4 1525 B12R1.224 CC(=Cc1cccc(c1O)Cl)C 271570a_100102525489_100010202889 [0,1,0,0,0,0|3,0,0]=4 1526 B12R1.224 CC(=Cc1cccc(c1O)F)C 271570a_100102525489_100009813666 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.224 CC(=Cc1cccc(c1O)N)C 271570a_100102525489_100011934915 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,1,0,0,0,0|2,0,0]=3 1529 B12R1.224 CC(=Cc1ccnc(c1C)O)C 271570a_100102525489_100009858498 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.224 CC(=Cc1nccc(c1F)O)C 271570a_100102525489_100009876375 [0,1,0,0,0,0|3,0,0]=4 1531 B12R1.224 CC(=Cc1nccc(c1N)O)C 271570a_100102525489_100000128729 [0,1,0,0,0,0|3,0,0]=4 1532 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,1,0,0,0,0|2,0,0]=3 1533 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,1,0,0,0,0|2,0,0]=3 1534 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,1,0,0,0,0|2,0,0]=3 1535 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,1,0,0,0,0|2,0,0]=3 1536 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,1,0,0,0,0|2,0,0]=3 1537 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,1,0,0,0,0|2,0,0]=3 1538 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,1,0,0,0,0|2,0,0]=3 1539 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,1,0,0,0,0|2,0,0]=3 1540 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,1,0,0,0,0|2,0,0]=3 1541 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,1,0,0,0,0|2,0,0]=3 1542 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,1,0,0,0,0|2,0,0]=3 1543 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,1,0,0,0,0|2,0,0]=3 1544 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,1,0,0,0,0|2,0,0]=3 1545 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,1,0,0,0,0|2,0,0]=3 1546 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,1,0,0,0,0|2,0,0]=3 1547 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,1,0,0,0,0|2,0,0]=3 1548 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,1,0,0,0,0|2,0,0]=3 1549 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,1,0,0,0,0|2,0,0]=3 1550 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,1,0,0,0,0|2,0,0]=3 1551 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,1,0,0,0,0|2,0,0]=3 1552 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,1,0,0,0,0|2,0,0]=3 1553 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,1,0,0,0,0|2,0,0]=3 1554 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,1,0,0,0,0|2,0,0]=3 1556 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,1,0,0,0,0|2,0,0]=3 1557 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,1,0,0,0,0|2,0,0]=3 1558 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,1,0,0,0,0|2,0,0]=3 1559 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,1,0,0,0,0|2,0,0]=3 1560 B12R1.224 CC(=O)Cc1nccc(c1C)Cl 1458a_100000070787_100020614443 [0,1,0,0,0,0|3,0,0]=4 1561 B12R1.224 CC(=O)Cn1cccc(c1=O)C 1458a_100000697016_200000210301 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.224 CC(=O)Nc1cccc(c1Br)C 11a_100000684715_100015343762 [0,1,0,0,0,0|2,0,0]=3 1563 B12R1.224 CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100015343762 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.224 CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000070787 [0,1,0,0,0,0|2,0,0]=3 1565 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100015343762 [0,1,0,0,0,0|2,0,0]=3 1566 B12R1.224 CC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100015343762 [0,1,0,0,0,0|2,0,0]=3 1567 B12R1.224 CC(=O)Nc1cccc(c1Br)F 11a_100011934729_100015343762 [0,1,0,0,0,0|2,0,0]=3 1568 B12R1.224 CC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100015343762 [0,1,0,0,0,0|2,0,0]=3 1569 B12R1.224 CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000070787 [0,1,0,0,0,0|1,0,0]=2 1570 B12R1.224 CC(=O)Nc1cccc(c1C)Br 11a_100000750434_100015343762 [0,1,0,0,0,0|2,0,0]=3 1571 B12R1.224 CC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100015343762 [0,1,0,0,0,0|2,0,0]=3 1572 B12R1.224 CC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000070787 [0,1,0,0,0,0|2,0,0]=3 1573 B12R1.224 CC(=O)Nc1cccc(c1C)Br 527a_100000750434_100103153847 [0,1,0,0,0,0|2,0,0]=3 1574 B12R1.224 CC(=O)Nc1cccc(c1C)C 11a_100000210026_100015343762 [0,1,0,0,0,0|2,0,0]=3 1575 B12R1.224 CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100015343762 [0,1,0,0,0,0|2,0,0]=3 1576 B12R1.224 CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000070787 [0,1,0,0,0,0|2,0,0]=3 1577 B12R1.224 CC(=O)Nc1cccc(c1C)C 527a_100000210026_100103153847 [0,1,0,0,0,0|2,0,0]=3 1578 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100015343762 [0,1,0,0,0,0|2,0,0]=3 1579 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100015343762 [0,1,0,0,0,0|2,0,0]=3 1580 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000070787 [0,1,0,0,0,0|2,0,0]=3 1581 B12R1.224 CC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100103153847 [0,1,0,0,0,0|2,0,0]=3 1582 B12R1.224 CC(=O)Nc1cccc(c1C)F 11a_100000745574_100015343762 [0,1,0,0,0,0|2,0,0]=3 1583 B12R1.224 CC(=O)Nc1cccc(c1C)F 1626a_100000745574_100015343762 [0,1,0,0,0,0|2,0,0]=3 1584 B12R1.224 CC(=O)Nc1cccc(c1C)F 22a_100000745574_100000070787 [0,1,0,0,0,0|2,0,0]=3 1585 B12R1.224 CC(=O)Nc1cccc(c1C)F 527a_100000745574_100103153847 [0,1,0,0,0,0|2,0,0]=3 1586 B12R1.224 CC(=O)Nc1cccc(c1C)I 11a_100000761887_100015343762 [0,1,0,0,0,0|2,0,0]=3 1587 B12R1.224 CC(=O)Nc1cccc(c1C)I 1626a_100000761887_100015343762 [0,1,0,0,0,0|2,0,0]=3 1588 B12R1.224 CC(=O)Nc1cccc(c1C)I 22a_100000761887_100000070787 [0,1,0,0,0,0|2,0,0]=3 1589 B12R1.224 CC(=O)Nc1cccc(c1C)I 527a_100000761887_100103153847 [0,1,0,0,0,0|2,0,0]=3 1590 B12R1.224 CC(=O)Nc1cccc(c1C)O 11a_100011216573_100015343762 [0,1,0,0,0,0|1,0,0]=2 1591 B12R1.224 CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000070787 [0,1,0,0,0,0|1,0,0]=2 1592 B12R1.224 CC(=O)Nc1cccc(c1C)O 527a_100011216573_100103153847 [0,1,0,0,0,0|1,0,0]=2 1593 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100015343762 [0,1,0,0,0,0|2,0,0]=3 1594 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100015343762 [0,1,0,0,0,0|2,0,0]=3 1595 B12R1.224 CC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100103153847 [0,1,0,0,0,0|2,0,0]=3 1596 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100015343762 [0,1,0,0,0,0|2,0,0]=3 1597 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100015343762 [0,1,0,0,0,0|2,0,0]=3 1598 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000070787 [0,1,0,0,0,0|2,0,0]=3 1599 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100015343762 [0,1,0,0,0,0|2,0,0]=3 1600 B12R1.224 CC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100015343762 [0,1,0,0,0,0|2,0,0]=3 1601 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100015343762 [0,1,0,0,0,0|2,0,0]=3 1602 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100015343762 [0,1,0,0,0,0|2,0,0]=3 1603 B12R1.224 CC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000070787 [0,1,0,0,0,0|2,0,0]=3 1604 B12R1.224 CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000070787 [0,1,0,0,0,0|1,0,0]=2 1605 B12R1.224 CC(=O)Nc1cccc(c1F)Br 11a_100011935091_100015343762 [0,1,0,0,0,0|2,0,0]=3 1606 B12R1.224 CC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100015343762 [0,1,0,0,0,0|2,0,0]=3 1607 B12R1.224 CC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000070787 [0,1,0,0,0,0|2,0,0]=3 1608 B12R1.224 CC(=O)Nc1cccc(c1F)Br 527a_100011935091_100103153847 [0,1,0,0,0,0|2,0,0]=3 1609 B12R1.224 CC(=O)Nc1cccc(c1F)C 11a_100000697159_100015343762 [0,1,0,0,0,0|2,0,0]=3 1610 B12R1.224 CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100015343762 [0,1,0,0,0,0|2,0,0]=3 1611 B12R1.224 CC(=O)Nc1cccc(c1F)C 527a_100000697159_100103153847 [0,1,0,0,0,0|2,0,0]=3 1612 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100015343762 [0,1,0,0,0,0|2,0,0]=3 1613 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100015343762 [0,1,0,0,0,0|2,0,0]=3 1614 B12R1.224 CC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000070787 [0,1,0,0,0,0|2,0,0]=3 1615 B12R1.224 CC(=O)Nc1cccc(c1F)F 11a_100000743855_100015343762 [0,1,0,0,0,0|2,0,0]=3 1616 B12R1.224 CC(=O)Nc1cccc(c1F)F 1626a_100000743855_100015343762 [0,1,0,0,0,0|2,0,0]=3 1617 B12R1.224 CC(=O)Nc1cccc(c1F)F 22a_100000743855_100000070787 [0,1,0,0,0,0|2,0,0]=3 1618 B12R1.224 CC(=O)Nc1cccc(c1I)Br 11a_100020590159_100015343762 [0,1,0,0,0,0|2,0,0]=3 1619 B12R1.224 CC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100015343762 [0,1,0,0,0,0|2,0,0]=3 1620 B12R1.224 CC(=O)Nc1cccc(c1I)C 11a_100000761888_100015343762 [0,1,0,0,0,0|2,0,0]=3 1621 B12R1.224 CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100015343762 [0,1,0,0,0,0|2,0,0]=3 1622 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100015343762 [0,1,0,0,0,0|2,0,0]=3 1623 B12R1.224 CC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100015343762 [0,1,0,0,0,0|2,0,0]=3 1624 B12R1.224 CC(=O)Nc1cccc(c1I)F 11a_100000690935_100015343762 [0,1,0,0,0,0|2,0,0]=3 1625 B12R1.224 CC(=O)Nc1cccc(c1I)F 1626a_100000690935_100015343762 [0,1,0,0,0,0|2,0,0]=3 1626 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,1,0,0,0,0|2,0,0]=3 1627 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,1,0,0,0,0|2,0,0]=3 1628 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,1,0,0,0,0|2,0,0]=3 1629 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,1,0,0,0,0|2,0,0]=3 1630 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,1,0,0,0,0|2,0,0]=3 1631 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,1,0,0,0,0|2,0,0]=3 1632 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,1,0,0,0,0|2,0,0]=3 1633 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,1,0,0,0,0|2,0,0]=3 1634 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,1,0,0,0,0|2,0,0]=3 1635 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,1,0,0,0,0|2,0,0]=3 1636 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,1,0,0,0,0|2,0,0]=3 1637 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,1,0,0,0,0|2,0,0]=3 1638 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,1,0,0,0,0|2,0,0]=3 1639 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,1,0,0,0,0|2,0,0]=3 1640 B12R1.224 CC(C)Nc1cccc(c1Br)O 34a_100012183704_100000210206 [0,1,0,0,0,0|2,0,1]=4 1641 B12R1.224 CC(C)Nc1cccc(c1Br)O 7a_100012183704_100000210206 [0,1,0,0,0,0|2,0,1]=4 1642 B12R1.224 CC(C)Nc1cccc(c1Cl)O 34a_100012002038_100000210206 [0,1,0,0,0,0|2,0,1]=4 1643 B12R1.224 CC(C)Nc1cccc(c1Cl)O 7a_100012002038_100000210206 [0,1,0,0,0,0|2,0,1]=4 1644 B12R1.224 CC(C)Oc1cccc(c1Br)Br 34a_100010187966_100000210206 [0,1,0,0,0,0|2,0,1]=4 1645 B12R1.224 CC(C)Oc1cccc(c1Br)Br 7a_100010187966_100000210206 [0,1,0,0,0,0|2,0,1]=4 1646 B12R1.224 CC(C)Oc1cccc(c1Br)Cl 34a_100012348804_100000210206 [0,1,0,0,0,0|2,0,1]=4 1647 B12R1.224 CC(C)Oc1cccc(c1Br)Cl 7a_100012348804_100000210206 [0,1,0,0,0,0|2,0,1]=4 1648 B12R1.224 CC(C)Oc1cccc(c1Br)F 34a_100009820682_100000210206 [0,1,0,0,0,0|2,0,1]=4 1649 B12R1.224 CC(C)Oc1cccc(c1Br)F 7a_100009820682_100000210206 [0,1,0,0,0,0|2,0,1]=4 1650 B12R1.224 CC(C)Oc1cccc(c1Br)I 34a_100010187914_100000210206 [0,1,0,0,0,0|2,0,1]=4 1651 B12R1.224 CC(C)Oc1cccc(c1Br)I 7a_100010187914_100000210206 [0,1,0,0,0,0|2,0,1]=4 1652 B12R1.224 CC(C)Oc1cccc(c1Br)N 34a_100012183704_100000210206 [0,1,0,0,0,0|2,0,1]=4 1653 B12R1.224 CC(C)Oc1cccc(c1Br)N 7a_100012183704_100000210206 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.224 CC(C)Oc1cccc(c1Cl)Br 34a_100010187913_100000210206 [0,1,0,0,0,0|2,0,1]=4 1655 B12R1.224 CC(C)Oc1cccc(c1Cl)Br 7a_100010187913_100000210206 [0,1,0,0,0,0|2,0,1]=4 1656 B12R1.224 CC(C)Oc1cccc(c1Cl)Cl 34a_100000211076_100000210206 [0,1,0,0,0,0|2,0,1]=4 1657 B12R1.224 CC(C)Oc1cccc(c1Cl)Cl 7a_100000211076_100000210206 [0,1,0,0,0,0|2,0,1]=4 1658 B12R1.224 CC(C)Oc1cccc(c1Cl)F 34a_100000087408_100000210206 [0,1,0,0,0,0|2,0,1]=4 1659 B12R1.224 CC(C)Oc1cccc(c1Cl)F 7a_100000087408_100000210206 [0,1,0,0,0,0|2,0,1]=4 1660 B12R1.224 CC(C)Oc1cccc(c1Cl)I 34a_100000049636_100000210206 [0,1,0,0,0,0|2,0,1]=4 1661 B12R1.224 CC(C)Oc1cccc(c1Cl)I 7a_100000049636_100000210206 [0,1,0,0,0,0|2,0,1]=4 1662 B12R1.224 CC(C)Oc1cccc(c1Cl)N 34a_100012002038_100000210206 [0,1,0,0,0,0|2,0,1]=4 1663 B12R1.224 CC(C)Oc1cccc(c1Cl)N 7a_100012002038_100000210206 [0,1,0,0,0,0|2,0,1]=4 1664 B12R1.224 CC(C)Oc1cccc(c1F)Br 34a_100009817021_100000210206 [0,1,0,0,0,0|2,0,1]=4 1665 B12R1.224 CC(C)Oc1cccc(c1F)Br 7a_100009817021_100000210206 [0,1,0,0,0,0|2,0,1]=4 1666 B12R1.224 CC(C)Oc1cccc(c1F)Cl 34a_100000687438_100000210206 [0,1,0,0,0,0|2,0,1]=4 1667 B12R1.224 CC(C)Oc1cccc(c1F)Cl 7a_100000687438_100000210206 [0,1,0,0,0,0|2,0,1]=4 1668 B12R1.224 CC(C)Oc1cccc(c1F)F 34a_100000751161_100000210206 [0,1,0,0,0,0|2,0,1]=4 1669 B12R1.224 CC(C)Oc1cccc(c1F)F 7a_100000751161_100000210206 [0,1,0,0,0,0|2,0,1]=4 1670 B12R1.224 CC(C)Oc1cccc(c1I)Br 34a_100010187912_100000210206 [0,1,0,0,0,0|2,0,1]=4 1671 B12R1.224 CC(C)Oc1cccc(c1I)Br 7a_100010187912_100000210206 [0,1,0,0,0,0|2,0,1]=4 1672 B12R1.224 CC(C)Oc1cccc(c1I)Cl 34a_100000050174_100000210206 [0,1,0,0,0,0|2,0,1]=4 1673 B12R1.224 CC(C)Oc1cccc(c1I)Cl 7a_100000050174_100000210206 [0,1,0,0,0,0|2,0,1]=4 1674 B12R1.224 CC(C)Oc1cccc(c1I)F 34a_100000690913_100000210206 [0,1,0,0,0,0|2,0,1]=4 1675 B12R1.224 CC(C)Oc1cccc(c1I)F 7a_100000690913_100000210206 [0,1,0,0,0,0|2,0,1]=4 1676 B12R1.224 CC(C)Oc1cccc(c1N)Br 34a_100011934926_100000210206 [0,1,0,0,0,0|2,0,1]=4 1677 B12R1.224 CC(C)Oc1cccc(c1N)Br 7a_100011934926_100000210206 [0,1,0,0,0,0|2,0,1]=4 1678 B12R1.224 CC(C)Oc1cccc(c1N)Cl 34a_100012022510_100000210206 [0,1,0,0,0,0|2,0,1]=4 1679 B12R1.224 CC(C)Oc1cccc(c1N)Cl 7a_100012022510_100000210206 [0,1,0,0,0,0|2,0,1]=4 1680 B12R1.224 CC(C)Oc1cccc(c1N)F 34a_100020591140_100000210206 [0,1,0,0,0,0|2,0,1]=4 1681 B12R1.224 CC(C)Oc1cccc(c1N)F 7a_100020591140_100000210206 [0,1,0,0,0,0|2,0,1]=4 1682 B12R1.224 CC(C)Oc1cccc(c1N)I 34a_200000049512_100000210206 [0,1,0,0,0,0|2,0,1]=4 1683 B12R1.224 CC(C)Oc1cccc(c1N)I 7a_200000049512_100000210206 [0,1,0,0,0,0|2,0,1]=4 1684 B12R1.224 CC(C)Oc1cccc(c1N)N 34a_100000033209_100000210206 [0,1,0,0,0,0|2,0,1]=4 1685 B12R1.224 CC(C)Sc1cccc(c1Br)O 62a_100000210206_100010187914 [0,1,0,0,0,0|1,1,1]=4 1686 B12R1.224 CC(C)Sc1cccc(c1Br)O 62a_100010187914_100000210206 [0,1,0,0,0,0|1,1,1]=4 1687 B12R1.224 CC(C)Sc1cccc(c1Cl)O 62a_100000210206_100000049636 [0,1,0,0,0,0|1,1,1]=4 1688 B12R1.224 CC(C)Sc1cccc(c1F)O 62a_100000210206_100009817021 [0,1,0,0,0,0|1,1,1]=4 1689 B12R1.224 CC(C)Sc1cccc(c1F)O 62a_100009817021_100000210206 [0,1,0,0,0,0|1,1,1]=4 1690 B12R1.224 CC(C)Sc1cccc(c1N)O 62a_100000210206_100011934926 [0,1,0,0,0,0|1,1,1]=4 1691 B12R1.224 CC(C)Sc1cccc(c1O)O 62a_100000210206_100009815950 [0,1,0,0,0,0|1,1,1]=4 1692 B12R1.224 CN(C)Cc1cccc(c1Cl)O 270004a_100102631434_100000050521 [0,1,0,0,0,0|3,0,0]=4 1693 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,1,0,0,0,0|2,0,0]=3 1694 B12R1.224 Cc1c(cccc1CN(C)C)O 270004a_100102631434_100009868165 [0,1,0,0,0,0|3,0,0]=4 1695 B12R1.224 Cc1c(cccc1NC(C)C)O 34a_100011216573_100000210206 [0,1,0,0,0,0|2,0,1]=4 1696 B12R1.224 Cc1c(cccc1NC(C)C)O 7a_100011216573_100000210206 [0,1,0,0,0,0|2,0,1]=4 1697 B12R1.224 Cc1c(cccc1OC(C)C)Br 34a_100012002258_100000210206 [0,1,0,0,0,0|2,0,1]=4 1698 B12R1.224 Cc1c(cccc1OC(C)C)Br 7a_100012002258_100000210206 [0,1,0,0,0,0|2,0,1]=4 1699 B12R1.224 Cc1c(cccc1OC(C)C)Cl 34a_100011265684_100000210206 [0,1,0,0,0,0|2,0,1]=4 1700 B12R1.224 Cc1c(cccc1OC(C)C)Cl 7a_100011265684_100000210206 [0,1,0,0,0,0|2,0,1]=4 1701 B12R1.224 Cc1c(cccc1OC(C)C)F 34a_100011217231_100000210206 [0,1,0,0,0,0|2,0,1]=4 1702 B12R1.224 Cc1c(cccc1OC(C)C)F 7a_100011217231_100000210206 [0,1,0,0,0,0|2,0,1]=4 1703 B12R1.224 Cc1c(cccc1OC(C)C)N 34a_100011216573_100000210206 [0,1,0,0,0,0|2,0,1]=4 1704 B12R1.224 Cc1c(cccc1OC(C)C)N 7a_100011216573_100000210206 [0,1,0,0,0,0|2,0,1]=4 1705 B12R1.224 Cc1c(cccc1OC(F)F)O 271570a_203496583355_200010148667 [0,1,0,0,0,0|2,0,1]=4 1706 B12R1.224 Cc1c(cccc1SC(C)C)O 62a_100000210206_100012002258 [0,1,0,0,0,0|1,1,1]=4 1707 B12R1.224 Cc1c(cccc1SC(C)C)O 62a_100012002258_100000210206 [0,1,0,0,0,0|1,1,1]=4 1708 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.224 Cc1cccc(c1Br)OC(C)C 34a_100000686692_100000210206 [0,1,0,0,0,0|2,0,1]=4 1710 B12R1.224 Cc1cccc(c1Br)OC(C)C 7a_100000686692_100000210206 [0,1,0,0,0,0|2,0,1]=4 1711 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,1,0,0,0,0|2,0,0]=3 1712 B12R1.224 Cc1cccc(c1C)OC(C)C 34a_100000185855_100000210206 [0,1,0,0,0,0|2,0,1]=4 1713 B12R1.224 Cc1cccc(c1C)OC(C)C 7a_100000185855_100000210206 [0,1,0,0,0,0|2,0,1]=4 1714 B12R1.224 Cc1cccc(c1Cl)OC(C)C 34a_100000695629_100000210206 [0,1,0,0,0,0|2,0,1]=4 1715 B12R1.224 Cc1cccc(c1Cl)OC(C)C 7a_100000695629_100000210206 [0,1,0,0,0,0|2,0,1]=4 1716 B12R1.224 Cc1cccc(c1F)OC(C)C 34a_100000751311_100000210206 [0,1,0,0,0,0|2,0,1]=4 1717 B12R1.224 Cc1cccc(c1F)OC(C)C 7a_100000751311_100000210206 [0,1,0,0,0,0|2,0,1]=4 1718 B12R1.224 Cc1cccc(c1I)OC(C)C 34a_100010083724_100000210206 [0,1,0,0,0,0|2,0,1]=4 1719 B12R1.224 Cc1cccc(c1I)OC(C)C 7a_100010083724_100000210206 [0,1,0,0,0,0|2,0,1]=4 1720 B12R1.224 Cc1cccc(c1N)OC(C)C 34a_100000743429_100000210206 [0,1,0,0,0,0|2,0,1]=4 1721 B12R1.224 Cc1cccc(c1N)OC(C)C 7a_100000743429_100000210206 [0,1,0,0,0,0|2,0,1]=4 1722 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,1,0,0,0,0|3,0,0]=4 1723 B12R1.224 Cc1cccn(c1=O)CC(=O)[13CH3] 1458a_100000697016_200025704644 [0,1,0,0,0,0|3,0,0]=4 1724 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,1,0,0,0,0|2,0,0]=3 1725 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,1,0,0,0,0|2,0,0]=3 1726 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,1,0,0,0,0|2,0,0]=3 1727 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,1,0,0,0,0|2,0,0]=3 1728 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,1,0,0,0,0|2,0,0]=3 1729 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,1,0,0,0,0|2,0,0]=3 1730 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,1,0,0,0,0|2,0,0]=3 1731 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,1,0,0,0,0|2,0,0]=3 1732 B12R1.225 CC(=C(C)c1cc(ccn1)O)C 271570a_200000049429_100000762945 [0,1,0,0,0,0|3,0,0]=4 1733 B12R1.225 CC(=C(C)c1cccc(c1)Br)C 271570a_200000049429_100000691529 [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.225 CC(=C(C)c1cccc(c1)C)C 271570a_200000049429_100011215228 [0,1,0,0,0,0|3,0,0]=4 1735 B12R1.225 CC(=C(C)c1cccc(c1)Cl)C 271570a_200000049429_100000699651 [0,1,0,0,0,0|3,0,0]=4 1736 B12R1.225 CC(=C(C)c1cccc(c1)F)C 271570a_200000049429_100000685547 [0,1,0,0,0,0|3,0,0]=4 1737 B12R1.225 CC(=C(C)c1cccc(c1)N)C 271570a_200000049429_100000210019 [0,1,0,0,0,0|3,0,0]=4 1738 B12R1.225 CC(=C(C)c1cccc(c1)O)C 271570a_200000049429_100000211634 [0,1,0,0,0,0|2,0,0]=3 1739 B12R1.225 CC(=C(C)c1cccc(c1)[S])C 271570a_200000049429_114929384022 [0,1,0,0,0,0|2,1,0]=4 1740 B12R1.225 CC(=C(C)c1cncc(c1)O)C 271570a_200000049429_100000754920 [0,1,0,0,0,0|3,0,0]=4 1741 B12R1.225 CC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_200000210301 [0,1,0,0,0,0|2,0,0]=3 1742 B12R1.225 CC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_200000210301 [0,1,0,0,0,0|2,0,0]=3 1743 B12R1.225 CC(=O)C(C)c1cccc(c1)F 1458a_100000762896_200000210301 [0,1,0,0,0,0|2,0,0]=3 1744 B12R1.225 CC(=O)C(O)c1cccc(c1)C 1458a_100011434945_200000210301 [0,1,0,0,0,0|2,0,0]=3 1745 B12R1.225 CC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200000210301 [0,1,0,0,0,0|2,0,0]=3 1746 B12R1.225 CC(=O)C(O)c1cccc(c1)F 1458a_100011434943_200000210301 [0,1,0,0,0,0|2,0,0]=3 1747 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100015343762 [0,1,0,0,0,0|2,0,0]=3 1748 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100015343762 [0,1,0,0,0,0|2,0,0]=3 1749 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000070787 [0,1,0,0,0,0|2,0,0]=3 1750 B12R1.225 CC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100103153847 [0,1,0,0,0,0|2,0,0]=3 1751 B12R1.225 CC(=O)N(C)c1cccc(c1)C 11a_100000219674_100015343762 [0,1,0,0,0,0|2,0,0]=3 1752 B12R1.225 CC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100015343762 [0,1,0,0,0,0|2,0,0]=3 1753 B12R1.225 CC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000070787 [0,1,0,0,0,0|2,0,0]=3 1754 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100015343762 [0,1,0,0,0,0|2,0,0]=3 1755 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100015343762 [0,1,0,0,0,0|2,0,0]=3 1756 B12R1.225 CC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000070787 [0,1,0,0,0,0|2,0,0]=3 1757 B12R1.225 CC(=O)N(C)c1cccc(c1)F 11a_100020633736_100015343762 [0,1,0,0,0,0|2,0,0]=3 1758 B12R1.225 CC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100015343762 [0,1,0,0,0,0|2,0,0]=3 1759 B12R1.225 CC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000070787 [0,1,0,0,0,0|2,0,0]=3 1760 B12R1.225 CC(=O)N(C)c1cccc(c1)I 11a_100000221217_100015343762 [0,1,0,0,0,0|2,0,0]=3 1761 B12R1.225 CC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100015343762 [0,1,0,0,0,0|2,0,0]=3 1762 B12R1.225 CC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000070787 [0,1,0,0,0,0|2,0,0]=3 1763 B12R1.225 CC(=O)N(C)c1cccc(c1)O 527a_100000756613_100103153847 [0,1,0,0,0,0|1,0,0]=2 1764 B12R1.225 CC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_200000210301 [0,1,0,0,0,0|2,0,0]=3 1765 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000722698_200025704644 [0,1,0,0,0,0|2,0,0]=3 1766 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000762818_200025704644 [0,1,0,0,0,0|2,0,0]=3 1767 B12R1.225 CC(C(=O)[13CH3])c1cccc(c1)F 1458a_100000762896_200025704644 [0,1,0,0,0,0|2,0,0]=3 1768 B12R1.225 CC(C)C(=O)c1cccc(c1)O 1458a_100000183914_100000210206 [0,1,0,0,0,0|2,0,1]=4 1769 B12R1.225 CC(C)C(=O)c1cccc(c1)O 271570a_203496583355_100011350656 [0,1,0,0,0,0|2,0,1]=4 1770 B12R1.225 CC(C)N(C)c1cccc(c1)O 2230a_100000756613_100000210206 [0,1,0,0,0,0|2,0,1]=4 1771 B12R1.225 CC(C)N(C)c1cccc(c1)O 269982a_100000756613_100000210206 [0,1,0,0,0,0|2,0,1]=4 1772 B12R1.225 CC(C)N(C)c1cccc(c1)O 34a_100000756613_100000210206 [0,1,0,0,0,0|2,0,1]=4 1773 B12R1.225 CN(C)C(=O)c1cccc(c1)O 240690a_100102631434_100000183914 [0,1,0,0,0,0|3,0,0]=4 1774 B12R1.225 CN(C)C(=O)c1cccc(c1)O 271570a_203496583355_100000159571 [0,1,0,0,0,0|3,0,0]=4 1775 B12R1.225 CN(C)C(=O)c1cccc(c1)O 527a_100102631434_100000183914 [0,1,0,0,0,0|3,0,0]=4 1776 B12R1.225 Cc1cccc(c1)C(O)C(=O)[13CH3] 1458a_100011434945_200025704644 [0,1,0,0,0,0|2,0,0]=3 1777 B12R1.225 Cc1cccc(c1)[C@@H](C)C(=O)[13CH3] 1458a_200009911544_200025704644 [0,1,0,0,0,0|2,0,0]=3 1778 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_200025704644 [0,1,0,0,0,0|2,0,0]=3 1779 B12R1.225 [13CH3]C(=O)C(O)c1cccc(c1)F 1458a_100011434943_200025704644 [0,1,0,0,0,0|2,0,0]=3 1780 B12R1.438 C#Cc1cccc(c1)NC(=O)C 11a_100000735509_100015343762 [0,1,0,0,0,0|2,0,0]=3 1781 B12R1.438 C#Cc1cccc(c1)NC(=O)C 1626a_100000735509_100015343762 [0,1,0,0,0,0|2,0,0]=3 1782 B12R1.438 C#Cc1cccc(c1)NC(=O)C 22a_100000735509_100000070787 [0,1,0,0,0,0|2,0,0]=3 1783 B12R1.438 C#Cc1cccc(c1)NC(=O)C 527a_100000735509_100103153847 [0,1,0,0,0,0|2,0,0]=3 1784 B12R1.438 C#Cc1cccc(c1)OC(C)C 34a_100011216014_100000210206 [0,1,0,0,0,0|2,0,1]=4 1785 B12R1.438 C#Cc1cccc(c1)OC(C)C 7a_100011216014_100000210206 [0,1,0,0,0,0|2,0,1]=4 1786 B12R1.438 C=Cc1cc(ccn1)NC(=O)C 271570a_100011290941_100000238608 [0,1,0,0,0,0|3,0,0]=4 1787 B12R1.438 C=Cc1cccc(c1)CC(=O)C 271570a_100011290941_100000689217 [0,1,0,0,0,0|2,0,0]=3 1788 B12R1.438 C=Cc1cccc(c1)CC(=O)N 271570a_100011290941_100011586816 [0,1,0,0,0,0|3,0,0]=4 1789 B12R1.438 C=Cc1cccc(c1)NC(=O)C 11a_100011827668_100015343762 [0,1,0,0,0,0|2,0,0]=3 1790 B12R1.438 C=Cc1cccc(c1)NC(=O)C 1626a_100011827668_100015343762 [0,1,0,0,0,0|2,0,0]=3 1791 B12R1.438 C=Cc1cccc(c1)NC(=O)C 22a_100011827668_100000070787 [0,1,0,0,0,0|2,0,0]=3 1792 B12R1.438 C=Cc1cccc(c1)NC(=O)C 271570a_100011290941_100000153616 [0,1,0,0,0,0|2,0,0]=3 1793 B12R1.438 C=Cc1cccc(c1)NC(=O)C 527a_100011827668_100103153847 [0,1,0,0,0,0|2,0,0]=3 1794 B12R1.438 C=Cc1cccc(c1)NC(=O)N 271570a_100011290941_100000238923 [0,1,0,0,0,0|3,0,0]=4 1795 B12R1.438 C=Cc1cccc(c1)OC(=O)C 271570a_100011290941_100009811612 [0,1,0,0,0,0|1,0,0]=2 1796 B12R1.438 C=Cc1cccc(c1)OC(C)C 271570a_100011290941_100000170003 [0,1,0,0,0,0|2,0,1]=4 1797 B12R1.438 C=Cc1cccc(c1)OC(C)C 34a_100011309434_100000210206 [0,1,0,0,0,0|2,0,1]=4 1798 B12R1.438 C=Cc1cccc(c1)OC(C)C 7a_100011309434_100000210206 [0,1,0,0,0,0|2,0,1]=4 1799 B12R1.438 C=Cc1cccc(n1)NC(=O)C 271570a_100011290941_200011307899 [0,1,0,0,0,0|3,0,0]=4 1800 B12R1.438 C=Cc1ccnc(c1)NC(=O)C 271570a_100011290941_100012362434 [0,1,0,0,0,0|3,0,0]=4 1801 B12R1.438 C=Cc1cncc(c1)NC(=O)C 271570a_100011290941_100012351681 [0,1,0,0,0,0|3,0,0]=4 1802 B12R1.438 CC(=Cc1cc(ccn1)CO)C 271570a_100102525489_100009814636 [0,1,0,0,0,0|3,0,0]=4 1803 B12R1.438 CC(=Cc1cccc(c1)C#N)C 271570a_100102525489_100000189340 [0,1,0,0,0,0|3,0,0]=4 1804 B12R1.438 CC(=Cc1cccc(c1)C=O)C 271570a_100102525489_100000014684 [0,1,0,0,0,0|2,0,1]=4 1805 B12R1.438 CC(=Cc1cccc(c1)CF)C 271570a_100102525489_100010878472 [0,1,0,0,0,0|3,0,0]=4 1806 B12R1.438 CC(=Cc1cccc(c1)CN)C 271570a_100102525489_100000106179 [0,1,0,0,0,0|3,0,0]=4 1807 B12R1.438 CC(=Cc1cccc(c1)CO)C 271570a_100102525489_100000687537 [0,1,0,0,0,0|2,0,0]=3 1808 B12R1.438 CC(=Cc1cccc(c1)NN)C 271570a_100102525489_100000217339 [0,1,0,0,0,0|3,0,0]=4 1809 B12R1.438 CC(=Cc1cccc(n1)CO)C 271570a_100102525489_100000694195 [0,1,0,0,0,0|3,0,0]=4 1810 B12R1.438 CC(=Cc1ccnc(c1)CO)C 271570a_100102525489_100009819072 [0,1,0,0,0,0|3,0,0]=4 1811 B12R1.438 CC(=Cc1cncc(c1)CO)C 271570a_100102525489_100011259137 [0,1,0,0,0,0|3,0,0]=4 1812 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000070787_100000233786 [0,1,0,0,0,0|2,0,0]=3 1813 B12R1.438 CC(=O)Cc1cccc(c1)C#N 1458a_100000684415_200000210301 [0,1,0,0,0,0|2,0,0]=3 1814 B12R1.438 CC(=O)Cc1cccc(c1)C=O 1458a_100000070787_100009816774 [0,1,0,0,0,0|1,0,1]=3 1815 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [0,1,0,0,0,0|1,0,0]=2 1816 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [0,1,0,0,0,0|1,1,0]=3 1817 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [0,1,0,0,0,0|1,1,0]=3 1818 B12R1.438 CC(=O)Cc1cccc(n1)C#N 1458a_100000070787_100000097530 [0,1,0,0,0,0|3,0,0]=4 1819 B12R1.438 CC(=O)Cc1cccc(n1)CO 1458a_100000070787_100009813551 [0,1,0,0,0,0|2,0,0]=3 1820 B12R1.438 CC(=O)Cc1cncc(c1)C#N 1458a_100000070787_200020634941 [0,1,0,0,0,0|3,0,0]=4 1821 B12R1.438 CC(=O)Nc1cc(ccn1)S[13CH3] 62a_200025704644_100012362434 [0,1,0,0,0,0|2,1,0]=4 1822 B12R1.438 CC(=O)Nc1cccc(c1)C#N 11a_100000210922_100015343762 [0,1,0,0,0,0|2,0,0]=3 1823 B12R1.438 CC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100015343762 [0,1,0,0,0,0|2,0,0]=3 1824 B12R1.438 CC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000070787 [0,1,0,0,0,0|2,0,0]=3 1825 B12R1.438 CC(=O)Nc1cccc(c1)C#N 527a_100000210922_100103153847 [0,1,0,0,0,0|2,0,0]=3 1826 B12R1.438 CC(=O)Nc1cccc(c1)CF 11a_100000126320_100015343762 [0,1,0,0,0,0|2,0,0]=3 1827 B12R1.438 CC(=O)Nc1cccc(c1)CF 1626a_100000126320_100015343762 [0,1,0,0,0,0|2,0,0]=3 1828 B12R1.438 CC(=O)Nc1cccc(c1)CF 22a_100000126320_100000070787 [0,1,0,0,0,0|2,0,0]=3 1829 B12R1.438 CC(=O)Nc1cccc(c1)CF 527a_100000126320_100103153847 [0,1,0,0,0,0|2,0,0]=3 1830 B12R1.438 CC(=O)Nc1cccc(c1)CO 22a_100000211919_100000070787 [0,1,0,0,0,0|1,0,0]=2 1831 B12R1.438 CC(=O)Nc1cccc(c1)N[13CH3] 34a_100000749408_200025704644 [0,1,0,0,0,0|2,0,0]=3 1832 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [0,1,0,0,0,0|1,0,0]=2 1833 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [0,1,0,0,0,0|1,0,0]=2 1834 B12R1.438 CC(=O)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000153616 [0,1,0,0,0,0|1,1,0]=3 1835 B12R1.438 CC(=O)Nc1cccc(n1)S[13CH3] 62a_200025704644_200011307899 [0,1,0,0,0,0|2,1,0]=4 1836 B12R1.438 CC(=O)Nc1ccnc(c1)S[13CH3] 62a_200025704644_100000238608 [0,1,0,0,0,0|2,1,0]=4 1837 B12R1.438 CC(=O)Nc1cncc(c1)S[13CH3] 62a_200025704644_100012351681 [0,1,0,0,0,0|2,1,0]=4 1838 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [0,1,0,0,0,0|0,0,0]=1 1839 B12R1.438 CC(=O)Oc1cccc(c1)S[13CH3] 62a_200025704644_100009811612 [0,1,0,0,0,0|0,1,0]=2 1840 B12R1.438 CC(C)Nc1cccc(c1)CO 2230a_100000211919_100000210206 [0,1,0,0,0,0|2,0,1]=4 1841 B12R1.438 CC(C)Nc1cccc(c1)CO 34a_100000211919_100000210206 [0,1,0,0,0,0|2,0,1]=4 1842 B12R1.438 CC(C)Oc1cccc(c1)C#N 34a_100000184713_100000210206 [0,1,0,0,0,0|2,0,1]=4 1843 B12R1.438 CC(C)Oc1cccc(c1)C#N 7a_100000184713_100000210206 [0,1,0,0,0,0|2,0,1]=4 1844 B12R1.438 CC(C)Oc1cccc(c1)CBr 34a_100011660834_100000210206 [0,1,0,0,0,0|2,0,1]=4 1845 B12R1.438 CC(C)Oc1cccc(c1)CBr 7a_100011660834_100000210206 [0,1,0,0,0,0|2,0,1]=4 1846 B12R1.438 CC(C)Oc1cccc(c1)CCl 34a_100000084143_100000210206 [0,1,0,0,0,0|2,0,1]=4 1847 B12R1.438 CC(C)Oc1cccc(c1)CCl 7a_100000084143_100000210206 [0,1,0,0,0,0|2,0,1]=4 1848 B12R1.438 CC(C)Oc1cccc(c1)CN 34a_100000743036_100000210206 [0,1,0,0,0,0|2,0,1]=4 1849 B12R1.438 CC(C)Oc1cccc(c1)CO 34a_100011214949_100000210206 [0,1,0,0,0,0|1,0,1]=3 1850 B12R1.438 CC(C)Oc1cccc(c1)CO 7a_100011214949_100000210206 [0,1,0,0,0,0|1,0,1]=3 1851 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 2230a_100011194262_200025704644 [0,1,0,0,0,0|2,0,1]=4 1852 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 34a_100011194262_200025704644 [0,1,0,0,0,0|2,0,1]=4 1853 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 7a_100011194262_200025704644 [0,1,0,0,0,0|2,0,1]=4 1854 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 34a_100000753242_200025704644 [0,1,0,0,0,0|1,0,1]=3 1855 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 7a_100000753242_200025704644 [0,1,0,0,0,0|1,0,1]=3 1856 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_100000170003_200025704644 [0,1,0,0,0,0|1,1,1]=4 1857 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_200025704644_100000170003 [0,1,0,0,0,0|1,1,1]=4 1858 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000210206_100000687537 [0,1,0,0,0,0|1,1,1]=4 1859 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000687537_100000210206 [0,1,0,0,0,0|1,1,1]=4 1860 B12R1.438 CCc1cccc(c1)C=C(C)C 271570a_100102525489_100000684523 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [0,1,0,0,0,0|2,0,0]=3 1862 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [0,1,0,0,0,0|2,0,0]=3 1863 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [0,1,0,0,0,0|2,0,0]=3 1864 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [0,1,0,0,0,0|2,0,0]=3 1865 B12R1.438 CCc1cccc(c1)OC(C)C 34a_100000211550_100000210206 [0,1,0,0,0,0|2,0,1]=4 1866 B12R1.438 CCc1cccc(c1)OC(C)C 7a_100000211550_100000210206 [0,1,0,0,0,0|2,0,1]=4 1867 B12R1.438 CN(C)Cc1cccc(c1)CO 2230a_100102631434_100010188025 [0,1,0,0,0,0|3,0,0]=4 1868 B12R1.438 CN(C)Cc1cccc(c1)CO 269982a_100102631434_100010188025 [0,1,0,0,0,0|3,0,0]=4 1869 B12R1.438 CN(C)Cc1cccc(c1)CO 270004a_100102631434_200000050894 [0,1,0,0,0,0|3,0,0]=4 1870 B12R1.438 CNc1cccc(c1)C=C(C)C 271570a_100102525489_100000219648 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [0,1,0,0,0,0|3,0,0]=4 1873 B12R1.438 CNc1cccc(c1)NC(=O)C 34a_100000749408_200000210301 [0,1,0,0,0,0|2,0,0]=3 1874 B12R1.438 CNc1cccc(c1)NC(=O)N 34a_100000736001_200000210301 [0,1,0,0,0,0|3,0,0]=4 1875 B12R1.438 CNc1cccc(c1)OC(C)C 2230a_100011194262_200000210301 [0,1,0,0,0,0|2,0,1]=4 1876 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100000756613_100000210206 [0,1,0,0,0,0|2,0,1]=4 1877 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100011194262_200000210301 [0,1,0,0,0,0|2,0,1]=4 1878 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100000756613_100000210206 [0,1,0,0,0,0|2,0,1]=4 1879 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100011194262_200000210301 [0,1,0,0,0,0|2,0,1]=4 1880 B12R1.438 COc1cc(ccn1)C=C(C)C 271570a_100102525489_100000117307 [0,1,0,0,0,0|3,0,0]=4 1881 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [0,1,0,0,0,0|2,0,0]=3 1882 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [0,1,0,0,0,0|2,0,0]=3 1883 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [0,1,0,0,0,0|2,0,0]=3 1884 B12R1.438 COc1cc(ccn1)OC(C)C 34a_100012181050_100000210206 [0,1,0,0,0,0|2,0,1]=4 1885 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [0,1,0,0,0,0|2,0,0]=3 1886 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [0,1,0,0,0,0|1,0,0]=2 1887 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [0,1,0,0,0,0|1,0,0]=2 1888 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [0,1,0,0,0,0|2,0,0]=3 1889 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [0,1,0,0,0,0|2,0,0]=3 1890 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [0,1,0,0,0,0|1,0,0]=2 1891 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [0,1,0,0,0,0|3,0,0]=4 1892 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [0,1,0,0,0,0|3,0,0]=4 1893 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [0,1,0,0,0,0|3,0,0]=4 1894 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [0,1,0,0,0,0|3,0,0]=4 1895 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [0,1,0,0,0,0|3,0,0]=4 1896 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [0,1,0,0,0,0|3,0,0]=4 1897 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [0,1,0,0,0,0|3,0,0]=4 1898 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [0,1,0,0,0,0|1,0,0]=2 1899 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [0,1,0,0,0,0|1,0,0]=2 1900 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [0,1,0,0,0,0|1,0,0]=2 1901 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [0,1,0,0,0,0|1,0,0]=2 1902 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [0,1,0,0,0,0|1,0,0]=2 1903 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [0,1,0,0,0,0|1,0,0]=2 1904 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [0,1,0,0,0,0|2,0,0]=3 1905 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [0,1,0,0,0,0|2,0,0]=3 1906 B12R1.438 COc1cccc(c1)NC(=S)N 7a_100000023991_200000210301 [0,1,0,0,0,0|2,1,0]=4 1907 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [0,1,0,0,0,0|2,0,1]=4 1908 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [0,1,0,0,0,0|0,0,0]=1 1909 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000211255_100000210206 [0,1,0,0,0,0|1,0,1]=3 1910 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000753242_200000210301 [0,1,0,0,0,0|1,0,1]=3 1911 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000211255_100000210206 [0,1,0,0,0,0|1,0,1]=3 1912 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000753242_200000210301 [0,1,0,0,0,0|1,0,1]=3 1913 B12R1.438 COc1cccc(c1)OC(F)F 34a_100000703596_200000210301 [0,1,0,0,0,0|2,0,1]=4 1914 B12R1.438 COc1cccc(c1)OC(F)F 7a_100000703596_200000210301 [0,1,0,0,0,0|2,0,1]=4 1915 B12R1.438 COc1cccc(c1)SC(C)C 62a_100000210206_100000170001 [0,1,0,0,0,0|1,1,1]=4 1916 B12R1.438 COc1cccc(n1)C=C(C)C 271570a_100102525489_100000760917 [0,1,0,0,0,0|3,0,0]=4 1917 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [0,1,0,0,0,0|2,0,0]=3 1918 B12R1.438 COc1ccnc(c1)C=C(C)C 271570a_100102525489_100011216251 [0,1,0,0,0,0|3,0,0]=4 1919 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [0,1,0,0,0,0|2,0,0]=3 1920 B12R1.438 COc1cncc(c1)C=C(C)C 271570a_100102525489_100000684773 [0,1,0,0,0,0|3,0,0]=4 1921 B12R1.438 COc1cncc(c1)OC(C)C 34a_100000084572_100000210206 [0,1,0,0,0,0|2,0,1]=4 1922 B12R1.438 COc1cncc(c1)OC(C)C 7a_100000084572_100000210206 [0,1,0,0,0,0|2,0,1]=4 1923 B12R1.438 CSc1cc(ccn1)NC(=O)C 62a_200000210301_100000238608 [0,1,0,0,0,0|2,1,0]=4 1924 B12R1.438 CSc1cccc(c1)C=C(C)C 271570a_100102525489_100011215954 [0,1,0,0,0,0|2,1,0]=4 1925 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [0,1,0,0,0,0|1,1,0]=3 1926 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [0,1,0,0,0,0|1,1,0]=3 1927 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [0,1,0,0,0,0|1,1,0]=3 1928 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [0,1,0,0,0,0|2,1,0]=4 1929 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [0,1,0,0,0,0|2,1,0]=4 1930 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [0,1,0,0,0,0|1,1,0]=3 1931 B12R1.438 CSc1cccc(c1)NC(=O)C 11a_100000210049_100015343762 [0,1,0,0,0,0|1,1,0]=3 1932 B12R1.438 CSc1cccc(c1)NC(=O)C 1626a_100000210049_100015343762 [0,1,0,0,0,0|1,1,0]=3 1933 B12R1.438 CSc1cccc(c1)NC(=O)C 22a_100000210049_100000070787 [0,1,0,0,0,0|1,1,0]=3 1934 B12R1.438 CSc1cccc(c1)NC(=O)C 527a_100000210049_100103153847 [0,1,0,0,0,0|1,1,0]=3 1935 B12R1.438 CSc1cccc(c1)NC(=O)C 62a_200000210301_100000153616 [0,1,0,0,0,0|1,1,0]=3 1936 B12R1.438 CSc1cccc(c1)NC(=O)N 62a_200000210301_100000238923 [0,1,0,0,0,0|2,1,0]=4 1937 B12R1.438 CSc1cccc(c1)OC(=O)C 62a_200000210301_100009811612 [0,1,0,0,0,0|0,1,0]=2 1938 B12R1.438 CSc1cccc(c1)OC(C)C 34a_100011265683_100000210206 [0,1,0,0,0,0|1,1,1]=4 1939 B12R1.438 CSc1cccc(c1)OC(C)C 62a_100000170003_200000210301 [0,1,0,0,0,0|1,1,1]=4 1940 B12R1.438 CSc1cccc(c1)OC(C)C 62a_200000210301_100000170003 [0,1,0,0,0,0|1,1,1]=4 1941 B12R1.438 CSc1cccc(c1)OC(C)C 7a_100011265683_100000210206 [0,1,0,0,0,0|1,1,1]=4 1942 B12R1.438 CSc1cccc(n1)NC(=O)C 62a_200000210301_200011307899 [0,1,0,0,0,0|2,1,0]=4 1943 B12R1.438 CSc1ccnc(c1)NC(=O)C 62a_200000210301_100012362434 [0,1,0,0,0,0|2,1,0]=4 1944 B12R1.438 CSc1cncc(c1)NC(=O)C 62a_200000210301_100012351681 [0,1,0,0,0,0|2,1,0]=4 1945 B12R1.438 [13CH3]C(=O)Cc1cccc(c1)C#N 1458a_100000684415_200025704644 [0,1,0,0,0,0|2,0,0]=3 1946 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [0,1,0,0,0,0|3,0,0]=4 1947 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.438 [13CH3]Nc1cccc(c1)NC(=O)N 34a_100000736001_200025704644 [0,1,0,0,0,0|3,0,0]=4 1949 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [0,1,0,0,0,0|2,0,0]=3 1950 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [0,1,0,0,0,0|2,0,0]=3 1951 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [0,1,0,0,0,0|2,0,0]=3 1952 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [0,1,0,0,0,0|2,0,0]=3 1953 B12R1.438 [13CH3]Oc1cccc(c1)NC(=S)N 7a_100000023991_200025704644 [0,1,0,0,0,0|2,1,0]=4 1954 B12R1.438 [13CH3]Oc1cccc(c1)OC(F)F 34a_100000703596_200025704644 [0,1,0,0,0,0|2,0,1]=4 1955 B12R1.438 [13CH3]Oc1cccc(c1)OC(F)F 7a_100000703596_200025704644 [0,1,0,0,0,0|2,0,1]=4 1956 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [0,1,0,0,0,0|2,1,0]=4 1957 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [0,1,0,0,0,0|2,1,0]=4 1958 B12R1.438 [13CH3]Sc1cccc(c1)NC(=O)N 62a_200025704644_100000238923 [0,1,0,0,0,0|2,1,0]=4 1959 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,0,0,1,0,0|2,0,0]=3 1960 B12R2.202 CN1Cc2cccc(c2C1)O 269982a_100015191671_200000210301 [0,0,0,1,0,0|3,0,0]=4 1961 B12R2.202 CN1Cc2cccc(c2C1)O 34a_100015191671_200000210301 [0,0,0,1,0,0|3,0,0]=4 1962 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,0,0,1,0,0|2,0,0]=3 1963 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,0,0,1,0,0|3,0,0]=4 1964 B12R2.202 Cc1cn2c(cccc2n1)O 271570a_203496583355_100009817088 [0,0,0,1,0,0|3,0,0]=4 1965 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,0,0,1,0,0|2,0,0]=3 1966 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,0,0,1,0,0|1,0,0]=2 1967 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,0,0,1,0,0|1,1,0]=3 1968 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,0,0,1,0,0|1,0,1]=3 1969 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,0,0,1,0,0|1,1,0]=3 1970 B12R2.202 Cc1nc2cncc(c2o1)O 271570a_203496583355_100010197357 [0,0,0,1,0,0|2,0,1]=4 1971 B12R2.202 Cn1cc2c(cccc2n1)O 271570a_203496583355_100009817162 [0,0,0,1,0,0|3,0,0]=4 1972 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,0,0,1,0,0|3,0,0]=4 1973 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,0,0,1,0,0|2,1,0]=4 1974 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,0,0,1,0,0|3,0,0]=4 1975 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [0,0,0,1,0,0|2,1,0]=4 1976 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,0,0,1,0,0|2,0,1]=4 1977 B12R2.202 Nc1nc2cccc(c2s1)O 271570a_203496583355_100010235960 [0,0,0,1,0,0|2,1,0]=4 1978 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,0,0,1,0,0|1,0,0]=2 1979 B12R2.202 O=C1Cc2c(ccnc2N1)O 271570a_203496583355_100000104061 [0,0,0,1,0,0|2,0,0]=3 1980 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,0,0,1,0,0|1,0,0]=2 1981 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,0,0,1,0,0|2,0,0]=3 1982 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,0,0,1,0,0|2,0,0]=3 1983 B12R2.202 O=c1[nH]c2nccc(c2[nH]1)O 271570a_203496583355_100009840862 [0,0,0,1,0,0|3,0,0]=4 1984 B12R2.202 Oc1cccc2c1CC(C2)O 271570a_203496583355_100010752598 [0,0,0,1,0,0|1,0,2]=4 1985 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,0,0,1,0,0|2,0,1]=4 1986 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 269982a_100015191671_200025704644 [0,0,0,1,0,0|3,0,0]=4 1987 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 34a_100015191671_200025704644 [0,0,0,1,0,0|3,0,0]=4 1988 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [0,0,0,1,0,0|3,0,0]=4 1989 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [0,0,0,1,0,0|3,0,0]=4 1990 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [0,0,0,1,0,0|3,0,0]=4 1991 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,0,0,1,0,0|2,0,0]=3 1992 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,0,0,1,0,0|1,1,0]=3 1993 B12R2.606 Cc1cc2cc(cnc2[nH]1)O 271570a_203496583355_100010202332 [0,0,0,1,0,0|3,0,0]=4 1994 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,0,0,1,0,0|2,0,0]=3 1995 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [0,0,0,1,0,0|3,0,0]=4 1996 B12R2.606 Cc1cn2cc(ccc2n1)O 271570a_203496583355_100000194050 [0,0,0,1,0,0|3,0,0]=4 1997 B12R2.606 Cc1cn2ccc(cc2n1)O 271570a_203496583355_100000724326 [0,0,0,1,0,0|3,0,0]=4 1998 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,0,0,1,0,0|2,0,0]=3 1999 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,0,0,1,0,0|1,0,1]=3 2000 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,0,0,1,0,0|1,1,0]=3 2001 B12R2.606 Cc1nc2cc(ccn2n1)O 271570a_203496583355_100010063680 [0,0,0,1,0,0|3,0,0]=4 2002 B12R2.606 Cc1nc2cc(cnc2o1)O 271570a_203496583355_100010178690 [0,0,0,1,0,0|2,0,1]=4 2003 B12R2.606 Cc1nc2cc(cnc2s1)O 271570a_203496583355_100010178691 [0,0,0,1,0,0|2,1,0]=4 2004 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,0,0,1,0,0|1,0,0]=2 2005 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,0,0,1,0,0|1,1,0]=3 2006 B12R2.606 Cc1nc2ccc(cn2n1)O 271570a_203496583355_100009815719 [0,0,0,1,0,0|3,0,0]=4 2007 B12R2.606 Cc1nc2ccc(nc2[nH]1)O 271570a_203496583355_100000079090 [0,0,0,1,0,0|3,0,0]=4 2008 B12R2.606 Cc1nc2ncc(cc2[nH]1)O 271570a_203496583355_100000758206 [0,0,0,1,0,0|3,0,0]=4 2009 B12R2.606 Cc1nc2ncc(cc2o1)O 271570a_203496583355_100010235748 [0,0,0,1,0,0|2,0,0]=3 2010 B12R2.606 Cn1cc2cc(ccc2n1)O 271570a_203496583355_100009817163 [0,0,0,1,0,0|3,0,0]=4 2011 B12R2.606 Cn1cc2ccc(cc2n1)O 271570a_203496583355_100009817169 [0,0,0,1,0,0|3,0,0]=4 2012 B12R2.606 NC1Cc2ccc(cc2C1)O 271570a_203496583355_100015193702 [0,0,0,1,0,0|2,0,1]=4 2013 B12R2.606 Nc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000764686 [0,0,0,1,0,0|3,0,0]=4 2014 B12R2.606 Nc1nc2cc(ccc2o1)O 271570a_203496583355_100000737949 [0,0,0,1,0,0|2,0,1]=4 2015 B12R2.606 Nc1nc2cc(ccc2s1)O 271570a_203496583355_100011934045 [0,0,0,1,0,0|2,1,0]=4 2016 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [0,0,0,1,0,0|2,0,0]=3 2017 B12R2.606 Nc1nc2ccc(cc2s1)O 271570a_203496583355_100102524914 [0,0,0,1,0,0|2,1,0]=4 2018 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,0,0,1,0,0|2,0,0]=3 2019 B12R2.606 O=C1Cc2cc(cnc2N1)O 271570a_203496583355_100010177629 [0,0,0,1,0,0|3,0,0]=4 2020 B12R2.606 O=C1Cc2cc(ncc2N1)O 271570a_203496583355_100000104063 [0,0,0,1,0,0|3,0,0]=4 2021 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,0,0,1,0,0|1,0,0]=2 2022 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,0,0,1,0,0|1,0,0]=2 2023 B12R2.606 O=C1Cc2ccc(nc2N1)O 271570a_203496583355_100000104062 [0,0,0,1,0,0|2,0,0]=3 2024 B12R2.606 O=C1Cc2cnc(cc2N1)O 271570a_203496583355_100000089690 [0,0,0,1,0,0|2,0,0]=3 2025 B12R2.606 O=C1Cc2cnc(nc2N1)O 271570a_203496583355_100000086852 [0,0,0,1,0,0|3,0,0]=4 2026 B12R2.606 O=C1Cc2nc(ccc2N1)O 271570a_203496583355_100000087150 [0,0,0,1,0,0|3,0,0]=4 2027 B12R2.606 O=C1Cc2ncc(cc2N1)O 271570a_203496583355_100010168558 [0,0,0,1,0,0|2,0,0]=3 2028 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,0,0,1,0,0|2,0,0]=3 2029 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,0,0,1,0,0|2,0,0]=3 2030 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,0,0,1,0,0|2,0,0]=3 2031 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,0,0,1,0,0|1,0,0]=2 2032 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,0,0,1,0,0|1,1,0]=3 2033 B12R2.606 O=c1[nH]c2ccc(nc2[nH]1)O 271570a_203496583355_100000084209 [0,0,0,1,0,0|3,0,0]=4 2034 B12R2.606 O=c1[nH]c2ncc(cc2o1)O 271570a_203496583355_100000721845 [0,0,0,1,0,0|2,0,0]=3 2035 B12R2.606 Oc1ccc2c(c1)CC(C2)O 271570a_203496583355_100010161096 [0,0,0,1,0,0|1,0,2]=4 2036 B12R2.606 Oc1ccc2nc(sc2c1)Cl 271570a_203496583355_100010163703 [0,0,0,1,0,0|2,1,0]=4 2037 B12R2.606 Oc1ccc2nc(sc2c1)O 271570a_203496583355_100010063415 [0,0,0,1,0,0|1,1,1]=4 2038 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [0,0,0,1,0,0|3,0,0]=4 2039 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [0,0,0,1,0,0|3,0,0]=4 2040 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [0,0,0,1,0,0|3,0,0]=4 2041 B12R2.1286 Brc1cccc(c1)OC2CC2 34a_100000210342_100000211595 [0,0,0,1,0,0|2,0,1]=4 2042 B12R2.1286 Cc1cccc(c1)OC2CC2 34a_100000210337_100000211595 [0,0,0,1,0,0|2,0,1]=4 2043 B12R2.1286 Clc1cccc(c1)OC2CC2 34a_100000210295_100000211595 [0,0,0,1,0,0|2,0,1]=4 2044 B12R2.1286 Fc1cccc(c1)OC2CC2 34a_100000210426_100000211595 [0,0,0,1,0,0|2,0,1]=4 2045 B12R2.1286 Ic1cccc(c1)OC2CC2 34a_100000211634_100000211595 [0,0,0,1,0,0|2,0,1]=4 2046 B12R2.1286 Nc1cccc(c1)OC2CC2 34a_100000210217_100000211595 [0,0,0,1,0,0|2,0,1]=4 2047 B12R2.1286 Oc1cccc(c1)NC2CC2 34a_100000210217_100000211595 [0,0,0,1,0,0|2,0,1]=4 2048 B12R2.1286 Oc1cccc(c1)OC2CC2 271570a_203496583355_100012344912 [0,0,0,1,0,0|1,0,1]=3 2049 B12R2.1286 Oc1cccc(c1)SC2CC2 271570a_203496583355_200010157562 [0,0,0,1,0,0|1,1,1]=4 2050 B12R2.1286 Oc1cccc(n1)OC2CC2 271570a_203496583355_100010191207 [0,0,0,1,0,0|2,0,1]=4 2051 B12R2.1286 Oc1ccnc(c1)OC2CC2 271570a_203496583355_100010191144 [0,0,0,1,0,0|2,0,1]=4 2052 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100000070787_100000746031 [0,0,0,0,1,0|3,0,0]=4 2053 B10R1.54 CC(=O)Cc1cc(cs1)Br 1458a_100011542370_200000210301 [0,0,0,0,1,0|3,0,0]=4 2054 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000070787_100000708592 [0,0,0,0,1,0|3,0,0]=4 2055 B10R1.54 CC(=O)Cc1ccc(s1)Br 1458a_100000238643_200000210301 [0,0,0,0,1,0|3,0,0]=4 2056 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000070787_100000185097 [0,0,0,0,1,0|3,0,0]=4 2057 B10R1.54 CC(=O)Cc1ccc(s1)Cl 1458a_100000238644_200000210301 [0,0,0,0,1,0|3,0,0]=4 2058 B10R1.54 CC(=O)Cn1cc(cn1)O 271570a_203496583355_100000763327 [0,0,0,0,1,0|3,0,0]=4 2059 B10R1.54 CC(=O)Nc1ccc(s1)O 271570a_203496583355_100010002808 [0,0,0,0,1,0|2,0,0]=3 2060 B10R1.54 CC(=O)Nc1ncc(s1)O 271570a_203496583355_100000050200 [0,0,0,0,1,0|3,0,0]=4 2061 B10R1.54 [13CH3]C(=O)Cc1cc(cs1)Br 1458a_100011542370_200025704644 [0,0,0,0,1,0|3,0,0]=4 2062 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Br 1458a_100000238643_200025704644 [0,0,0,0,1,0|3,0,0]=4 2063 B10R1.54 [13CH3]C(=O)Cc1ccc(s1)Cl 1458a_100000238644_200025704644 [0,0,0,0,1,0|3,0,0]=4 2064 B10R1.64 CC(=O)Cc1ccsc1Br 1458a_100000070787_100009814289 [0,0,0,0,1,0|3,0,0]=4 2065 B10R1.64 CC(=O)Cc1ccsc1Cl 1458a_100000070787_100010167017 [0,0,0,0,1,0|3,0,0]=4 2066 B10R1.113 C=C(C)c1cc(ccn1)C 271570a_100000694244_100000750283 [0,0,0,0,1,0|3,0,0]=4 2067 B10R1.113 C=C(C)c1cc(ccn1)Cl 271570a_100000694244_100010167805 [0,0,0,0,1,0|3,0,0]=4 2068 B10R1.113 C=C(C)c1cc(ccn1)F 271570a_100000694244_100009817058 [0,0,0,0,1,0|3,0,0]=4 2069 B10R1.113 C=C(C)c1cc(ccn1)N 271570a_100000694244_100009814236 [0,0,0,0,1,0|3,0,0]=4 2070 B10R1.113 C=C(C)c1cc(ccn1)O 271570a_100000694244_100000762945 [0,0,0,0,1,0|2,0,0]=3 2071 B10R1.113 C=C(C)c1cc(cnn1)O 271570a_100000694244_200010734679 [0,0,0,0,1,0|3,0,0]=4 2072 B10R1.113 C=C(C)c1cc(ncn1)O 271570a_100000694244_100000765262 [0,0,0,0,1,0|3,0,0]=4 2073 B10R1.113 C=C(C)c1cc[nH]c(=O)c1 271570a_100000694244_100009816521 [0,0,0,0,1,0|2,0,1]=4 2074 B10R1.113 C=C(C)c1ccc[n+](c1)C 271570a_100000694244_100009996589 [0,0,0,0,1,0|3,0,0]=4 2075 B10R1.113 C=C(C)c1ccc[n+](c1)[O-] 271570a_100000694244_100009815978 [0,0,0,0,1,0|2,0,1]=4 2076 B10R1.113 C=C(C)c1cccc(=O)[nH]1 271570a_100000694244_100000761760 [0,0,0,0,1,0|2,0,1]=4 2077 B10R1.113 C=C(C)c1cccc(c1)Br 271570a_100000694244_100000691529 [0,0,0,0,1,0|2,0,0]=3 2078 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [0,0,0,0,1,0|2,0,0]=3 2079 B10R1.113 C=C(C)c1cccc(c1)Cl 271570a_100000694244_100000699651 [0,0,0,0,1,0|2,0,0]=3 2080 B10R1.113 C=C(C)c1cccc(c1)F 271570a_100000694244_100000685547 [0,0,0,0,1,0|2,0,0]=3 2081 B10R1.113 C=C(C)c1cccc(c1)N 271570a_100000694244_100000210019 [0,0,0,0,1,0|2,0,0]=3 2082 B10R1.113 C=C(C)c1cccc(c1)O 271570a_100000694244_100000211634 [0,0,0,0,1,0|1,0,0]=2 2083 B10R1.113 C=C(C)c1cccc(c1)O 271570a_203496583355_100012123953 [0,0,0,0,1,0|1,0,0]=2 2084 B10R1.113 C=C(C)c1cccc(c1)[S] 271570a_100000694244_114929384022 [0,0,0,0,1,0|1,1,0]=3 2085 B10R1.113 C=C(C)c1cccc(n1)Br 271570a_100000694244_100000684672 [0,0,0,0,1,0|3,0,0]=4 2086 B10R1.113 C=C(C)c1cccc(n1)C 271570a_100000694244_100000742759 [0,0,0,0,1,0|3,0,0]=4 2087 B10R1.113 C=C(C)c1cccc(n1)F 271570a_100000694244_100009815982 [0,0,0,0,1,0|3,0,0]=4 2088 B10R1.113 C=C(C)c1cccc(n1)N 271570a_100000694244_100000740741 [0,0,0,0,1,0|3,0,0]=4 2089 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [0,0,0,0,1,0|3,0,0]=4 2090 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [0,0,0,0,1,0|3,0,0]=4 2091 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [0,0,0,0,1,0|3,0,0]=4 2092 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [0,0,0,0,1,0|3,0,0]=4 2093 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [0,0,0,0,1,0|3,0,0]=4 2094 B10R1.113 C=C(C)c1cncc(c1)Br 271570a_100000694244_100000728054 [0,0,0,0,1,0|3,0,0]=4 2095 B10R1.113 C=C(C)c1cncc(c1)C 271570a_100000694244_100000760492 [0,0,0,0,1,0|3,0,0]=4 2096 B10R1.113 C=C(C)c1cncc(c1)Cl 271570a_100000694244_100000049639 [0,0,0,0,1,0|3,0,0]=4 2097 B10R1.113 C=C(C)c1cncc(c1)F 271570a_100000694244_100000744099 [0,0,0,0,1,0|3,0,0]=4 2098 B10R1.113 C=C(C)c1cncc(c1)N 271570a_100000694244_100000687067 [0,0,0,0,1,0|3,0,0]=4 2099 B10R1.113 C=C(C)c1cncc(c1)O 271570a_100000694244_100000754920 [0,0,0,0,1,0|2,0,0]=3 2100 B10R1.113 C=C(C)c1cncc(c1)O 271570a_203496583355_200009889500 [0,0,0,0,1,0|2,0,0]=3 2101 B10R1.113 C=C(C)c1cncc(n1)O 271570a_100000694244_100011269956 [0,0,0,0,1,0|3,0,0]=4 2102 B10R1.113 C=C(C)c1nccc(n1)O 271570a_100000694244_100011649813 [0,0,0,0,1,0|3,0,0]=4 2103 B10R1.113 CC(=O)c1cc(ccn1)O 271570a_203496583355_100000709912 [0,0,0,0,1,0|1,0,0]=2 2104 B10R1.113 CC(=O)c1cccc(c1)Br 1458a_100000210664_200000210301 [0,0,0,0,1,0|1,0,0]=2 2105 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [0,0,0,0,1,0|1,0,0]=2 2106 B10R1.113 CC(=O)c1cccc(c1)Cl 1458a_100000210390_200000210301 [0,0,0,0,1,0|1,0,0]=2 2107 B10R1.113 CC(=O)c1cccc(c1)F 1458a_100000210950_200000210301 [0,0,0,0,1,0|1,0,0]=2 2108 B10R1.113 CC(=O)c1cccc(c1)I 1458a_100000184098_200000210301 [0,0,0,0,1,0|1,0,0]=2 2109 B10R1.113 CC(=O)c1cccc(c1)O 1458a_100000183914_200000210301 [0,0,0,0,1,0|0,0,0]=1 2110 B10R1.113 CC(=O)c1cccc(c1)O 271570a_203496583355_100000210093 [0,0,0,0,1,0|0,0,0]=1 2111 B10R1.113 CC(=O)c1cccc(n1)O 271570a_203496583355_100009816502 [0,0,0,0,1,0|1,0,0]=2 2112 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [0,0,0,0,1,0|1,0,0]=2 2113 B10R1.113 CC(=O)c1ccnc(n1)O 271570a_203496583355_100010643186 [0,0,0,0,1,0|2,0,0]=3 2114 B10R1.113 CC(=O)c1cncc(c1)O 271570a_203496583355_100011216243 [0,0,0,0,1,0|1,0,0]=2 2115 B10R1.113 CC(C)c1cc(ccn1)O 271570a_203496583355_100010237922 [0,0,0,0,1,0|2,0,1]=4 2116 B10R1.113 CC(C)c1cccc(c1)O 271570a_203496583355_100011214899 [0,0,0,0,1,0|1,0,1]=3 2117 B10R1.113 CC(C)c1cccc(n1)O 271570a_203496583355_100012318657 [0,0,0,0,1,0|2,0,1]=4 2118 B10R1.113 CC(C)c1ccnc(c1)O 271570a_203496583355_100010237925 [0,0,0,0,1,0|2,0,1]=4 2119 B10R1.113 CC(C)c1cncc(c1)O 271570a_203496583355_200010191214 [0,0,0,0,1,0|2,0,1]=4 2120 B10R1.113 CC(N)c1cccc(c1)O 271570a_203496583355_100020642005 [0,0,0,0,1,0|1,0,1]=3 2121 B10R1.113 CC(N)c1cccc(n1)O 271570a_203496583355_200010173468 [0,0,0,0,1,0|2,0,1]=4 2122 B10R1.113 CC(O)c1cc(ccn1)O 271570a_203496583355_100000144657 [0,0,0,0,1,0|1,0,2]=4 2123 B10R1.113 CC(O)c1cccc(c1)O 271570a_203496583355_100000246457 [0,0,0,0,1,0|0,0,2]=3 2124 B10R1.113 CC(O)c1cccc(n1)O 271570a_203496583355_100009820884 [0,0,0,0,1,0|1,0,2]=4 2125 B10R1.113 CC(O)c1cncc(c1)O 271570a_203496583355_100012351597 [0,0,0,0,1,0|1,0,2]=4 2126 B10R1.113 CN(C)c1cc(ccn1)O 271570a_203496583355_100012361627 [0,0,0,0,1,0|3,0,0]=4 2127 B10R1.113 CN(C)c1cccc(c1)Br 2230a_100000219648_200000210301 [0,0,0,0,1,0|3,0,0]=4 2128 B10R1.113 CN(C)c1cccc(c1)Br 269982a_100000219648_200000210301 [0,0,0,0,1,0|3,0,0]=4 2129 B10R1.113 CN(C)c1cccc(c1)Br 34a_100000219648_200000210301 [0,0,0,0,1,0|3,0,0]=4 2130 B10R1.113 CN(C)c1cccc(c1)Cl 2230a_100000220044_200000210301 [0,0,0,0,1,0|3,0,0]=4 2131 B10R1.113 CN(C)c1cccc(c1)Cl 269982a_100000220044_200000210301 [0,0,0,0,1,0|3,0,0]=4 2132 B10R1.113 CN(C)c1cccc(c1)Cl 34a_100000220044_200000210301 [0,0,0,0,1,0|3,0,0]=4 2133 B10R1.113 CN(C)c1cccc(c1)F 2230a_100020633736_200000210301 [0,0,0,0,1,0|3,0,0]=4 2134 B10R1.113 CN(C)c1cccc(c1)F 269982a_100020633736_200000210301 [0,0,0,0,1,0|3,0,0]=4 2135 B10R1.113 CN(C)c1cccc(c1)F 34a_100020633736_200000210301 [0,0,0,0,1,0|3,0,0]=4 2136 B10R1.113 CN(C)c1cccc(c1)I 2230a_100000221217_200000210301 [0,0,0,0,1,0|3,0,0]=4 2137 B10R1.113 CN(C)c1cccc(c1)I 269982a_100000221217_200000210301 [0,0,0,0,1,0|3,0,0]=4 2138 B10R1.113 CN(C)c1cccc(c1)I 34a_100000221217_200000210301 [0,0,0,0,1,0|3,0,0]=4 2139 B10R1.113 CN(C)c1cccc(c1)O 2230a_100000756613_200000210301 [0,0,0,0,1,0|2,0,0]=3 2140 B10R1.113 CN(C)c1cccc(c1)O 269982a_100000756613_200000210301 [0,0,0,0,1,0|2,0,0]=3 2141 B10R1.113 CN(C)c1cccc(c1)O 271570a_203496583355_100011215952 [0,0,0,0,1,0|2,0,0]=3 2142 B10R1.113 CN(C)c1cccc(c1)O 34a_100000756613_200000210301 [0,0,0,0,1,0|2,0,0]=3 2143 B10R1.113 CN(C)c1cccc(n1)O 271570a_203496583355_100011960435 [0,0,0,0,1,0|3,0,0]=4 2144 B10R1.113 CN(C)c1ccnc(c1)O 271570a_203496583355_100000766659 [0,0,0,0,1,0|3,0,0]=4 2145 B10R1.113 CN(C)c1cncc(c1)O 271570a_203496583355_100012350714 [0,0,0,0,1,0|3,0,0]=4 2146 B10R1.113 CN([13CH3])c1cccc(c1)Br 2230a_100000219648_200025704644 [0,0,0,0,1,0|3,0,0]=4 2147 B10R1.113 CN([13CH3])c1cccc(c1)Br 269982a_100000219648_200025704644 [0,0,0,0,1,0|3,0,0]=4 2148 B10R1.113 CN([13CH3])c1cccc(c1)Br 34a_100000219648_200025704644 [0,0,0,0,1,0|3,0,0]=4 2149 B10R1.113 CN([13CH3])c1cccc(c1)Cl 2230a_100000220044_200025704644 [0,0,0,0,1,0|3,0,0]=4 2150 B10R1.113 CN([13CH3])c1cccc(c1)Cl 269982a_100000220044_200025704644 [0,0,0,0,1,0|3,0,0]=4 2151 B10R1.113 CN([13CH3])c1cccc(c1)Cl 34a_100000220044_200025704644 [0,0,0,0,1,0|3,0,0]=4 2152 B10R1.113 CN([13CH3])c1cccc(c1)F 2230a_100020633736_200025704644 [0,0,0,0,1,0|3,0,0]=4 2153 B10R1.113 CN([13CH3])c1cccc(c1)F 269982a_100020633736_200025704644 [0,0,0,0,1,0|3,0,0]=4 2154 B10R1.113 CN([13CH3])c1cccc(c1)F 34a_100020633736_200025704644 [0,0,0,0,1,0|3,0,0]=4 2155 B10R1.113 CN([13CH3])c1cccc(c1)I 2230a_100000221217_200025704644 [0,0,0,0,1,0|3,0,0]=4 2156 B10R1.113 CN([13CH3])c1cccc(c1)I 269982a_100000221217_200025704644 [0,0,0,0,1,0|3,0,0]=4 2157 B10R1.113 CN([13CH3])c1cccc(c1)I 34a_100000221217_200025704644 [0,0,0,0,1,0|3,0,0]=4 2158 B10R1.113 CN([13CH3])c1cccc(c1)O 2230a_100000756613_200025704644 [0,0,0,0,1,0|2,0,0]=3 2159 B10R1.113 CN([13CH3])c1cccc(c1)O 269982a_100000756613_200025704644 [0,0,0,0,1,0|2,0,0]=3 2160 B10R1.113 CN([13CH3])c1cccc(c1)O 34a_100000756613_200025704644 [0,0,0,0,1,0|2,0,0]=3 2161 B10R1.113 CS(=O)c1cccc(c1)O 271570a_203496583355_100009816267 [0,0,0,0,1,0|1,0,0]=2 2162 B10R1.113 C[C@@H](N)c1cncc(c1)O 271570a_203496583355_100012350620 [0,0,0,0,1,0|2,0,1]=4 2163 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [0,0,0,0,1,0|1,0,0]=2 2164 B10R1.113 Cc1cccc(c1)N(C)C 2230a_100000219674_200000210301 [0,0,0,0,1,0|3,0,0]=4 2165 B10R1.113 Cc1cccc(c1)N(C)C 269982a_100000219674_200000210301 [0,0,0,0,1,0|3,0,0]=4 2166 B10R1.113 Cc1cccc(c1)N(C)C 34a_100000219674_200000210301 [0,0,0,0,1,0|3,0,0]=4 2167 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 2230a_100000219674_200025704644 [0,0,0,0,1,0|3,0,0]=4 2168 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 269982a_100000219674_200025704644 [0,0,0,0,1,0|3,0,0]=4 2169 B10R1.113 Cc1cccc(c1)N(C)[13CH3] 34a_100000219674_200025704644 [0,0,0,0,1,0|3,0,0]=4 2170 B10R1.113 NC(=O)c1cc(ccn1)O 271570a_203496583355_100000229564 [0,0,0,0,1,0|2,0,0]=3 2171 B10R1.113 NC(=O)c1cc(ncn1)O 271570a_203496583355_100000725265 [0,0,0,0,1,0|3,0,0]=4 2172 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [0,0,0,0,1,0|1,0,0]=2 2173 B10R1.113 NC(=O)c1cccc(n1)O 271570a_203496583355_100011834053 [0,0,0,0,1,0|2,0,0]=3 2174 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [0,0,0,0,1,0|2,0,0]=3 2175 B10R1.113 NC(=O)c1ccnc(n1)O 271570a_203496583355_100000066158 [0,0,0,0,1,0|3,0,0]=4 2176 B10R1.113 NC(=O)c1cncc(c1)O 271570a_203496583355_100000162242 [0,0,0,0,1,0|2,0,0]=3 2177 B10R1.113 NC(=O)c1cncc(n1)O 271570a_203496583355_100000764846 [0,0,0,0,1,0|3,0,0]=4 2178 B10R1.113 NC(=O)c1cnnc(c1)O 271570a_203496583355_100015785749 [0,0,0,0,1,0|3,0,0]=4 2179 B10R1.113 OB(O)c1cccc(c1)O 271570a_203496583355_100000687717 [0,0,0,0,1,0|2,0,1]=4 2180 B10R1.113 Oc1cccc(c1)C(F)F 271570a_203496583355_100009892619 [0,0,0,0,1,0|2,0,1]=4 2181 B10R1.113 [13CH3]C(=O)c1cccc(c1)Br 1458a_100000210664_200025704644 [0,0,0,0,1,0|1,0,0]=2 2182 B10R1.113 [13CH3]C(=O)c1cccc(c1)Cl 1458a_100000210390_200025704644 [0,0,0,0,1,0|1,0,0]=2 2183 B10R1.113 [13CH3]C(=O)c1cccc(c1)F 1458a_100000210950_200025704644 [0,0,0,0,1,0|1,0,0]=2 2184 B10R1.113 [13CH3]C(=O)c1cccc(c1)I 1458a_100000184098_200025704644 [0,0,0,0,1,0|1,0,0]=2 2185 B10R1.113 [13CH3]C(=O)c1cccc(c1)O 1458a_100000183914_200025704644 [0,0,0,0,1,0|0,0,0]=1 2186 B12R1.226 C=C(C)CNc1cccc(c1)Br 34a_100000210019_100000748629 [0,0,0,0,0,1|3,0,0]=4 2187 B12R1.226 C=C(C)CNc1cccc(c1)C 2230a_100000188690_100000748629 [0,0,0,0,0,1|3,0,0]=4 2188 B12R1.226 C=C(C)CNc1cccc(c1)C 34a_100000188690_100000748629 [0,0,0,0,0,1|3,0,0]=4 2189 B12R1.226 C=C(C)CNc1cccc(c1)Cl 34a_100000185859_100000748629 [0,0,0,0,0,1|3,0,0]=4 2190 B12R1.226 C=C(C)CNc1cccc(c1)F 34a_100000210047_100000748629 [0,0,0,0,0,1|3,0,0]=4 2191 B12R1.226 C=C(C)CNc1cccc(c1)I 34a_100000211102_100000748629 [0,0,0,0,0,1|3,0,0]=4 2192 B12R1.226 C=C(C)CNc1cccc(c1)O 34a_100000210217_100000748629 [0,0,0,0,0,1|2,0,0]=3 2193 B12R1.226 C=C(C)COc1cc[nH]c(=O)c1 34a_100000032262_100000748629 [0,0,0,0,0,1|2,0,1]=4 2194 B12R1.226 C=C(C)COc1ccc[n+](c1)[O-] 34a_100000039713_100000748629 [0,0,0,0,0,1|2,0,1]=4 2195 B12R1.226 C=C(C)COc1ccc[n+](c1)[O-] 7a_100000039713_100000748629 [0,0,0,0,0,1|2,0,1]=4 2196 B12R1.226 C=C(C)COc1cccc(=O)[nH]1 34a_100000033347_100000748629 [0,0,0,0,0,1|2,0,1]=4 2197 B12R1.226 C=C(C)COc1cccc(c1)Br 34a_100000210342_100000748629 [0,0,0,0,0,1|2,0,0]=3 2198 B12R1.226 C=C(C)COc1cccc(c1)Br 7a_100000210342_100000748629 [0,0,0,0,0,1|2,0,0]=3 2199 B12R1.226 C=C(C)COc1cccc(c1)C 34a_100000210337_100000748629 [0,0,0,0,0,1|2,0,0]=3 2200 B12R1.226 C=C(C)COc1cccc(c1)C 7a_100000210337_100000748629 [0,0,0,0,0,1|2,0,0]=3 2201 B12R1.226 C=C(C)COc1cccc(c1)Cl 34a_100000210295_100000748629 [0,0,0,0,0,1|2,0,0]=3 2202 B12R1.226 C=C(C)COc1cccc(c1)Cl 7a_100000210295_100000748629 [0,0,0,0,0,1|2,0,0]=3 2203 B12R1.226 C=C(C)COc1cccc(c1)F 34a_100000210426_100000748629 [0,0,0,0,0,1|2,0,0]=3 2204 B12R1.226 C=C(C)COc1cccc(c1)F 7a_100000210426_100000748629 [0,0,0,0,0,1|2,0,0]=3 2205 B12R1.226 C=C(C)COc1cccc(c1)I 34a_100000211634_100000748629 [0,0,0,0,0,1|2,0,0]=3 2206 B12R1.226 C=C(C)COc1cccc(c1)I 7a_100000211634_100000748629 [0,0,0,0,0,1|2,0,0]=3 2207 B12R1.226 C=C(C)COc1cccc(c1)N 34a_100000210217_100000748629 [0,0,0,0,0,1|2,0,0]=3 2208 B12R1.226 C=C(C)COc1cccc(n1)F 34a_100011432558_100000748629 [0,0,0,0,0,1|3,0,0]=4 2209 B12R1.226 C=C(C)COc1ccnc(c1)C 34a_100000688365_100000748629 [0,0,0,0,0,1|3,0,0]=4 2210 B12R1.226 C=C(C)COc1ccnc(c1)Cl 34a_100000762945_100000748629 [0,0,0,0,0,1|3,0,0]=4 2211 B12R1.226 C=C(C)COc1ccnc(c1)F 34a_100000732698_100000748629 [0,0,0,0,0,1|3,0,0]=4 2212 B12R1.226 C=C(C)COc1ccnc(c1)N 34a_100011834064_100000748629 [0,0,0,0,0,1|3,0,0]=4 2213 B12R1.226 C=C(C)COc1cncc(c1)Br 34a_100000754920_100000748629 [0,0,0,0,0,1|3,0,0]=4 2214 B12R1.226 C=C(C)COc1cncc(c1)Br 7a_100000754920_100000748629 [0,0,0,0,0,1|3,0,0]=4 2215 B12R1.226 C=C(C)COc1cncc(c1)C 34a_100011830280_100000748629 [0,0,0,0,0,1|3,0,0]=4 2216 B12R1.226 C=C(C)COc1cncc(c1)C 7a_100011830280_100000748629 [0,0,0,0,0,1|3,0,0]=4 2217 B12R1.226 C=C(C)COc1cncc(c1)Cl 7a_100000032511_100000748629 [0,0,0,0,0,1|3,0,0]=4 2218 B12R1.226 C=C(C)COc1cncc(c1)F 34a_100011830296_100000748629 [0,0,0,0,0,1|3,0,0]=4 2219 B12R1.226 C=C(C)COc1cncc(c1)F 7a_100011830296_100000748629 [0,0,0,0,0,1|3,0,0]=4 2220 B12R1.226 C=C(C)COc1cncc(c1)N 34a_100011997051_100000748629 [0,0,0,0,0,1|3,0,0]=4 2221 B12R1.226 C=C(C)CSc1cc(ccn1)O 62a_100000748629_100000762945 [0,0,0,0,0,1|2,1,0]=4 2222 B12R1.226 C=C(C)CSc1cccc(c1)Br 62a_100000691529_100000211660 [0,0,0,0,0,1|2,1,0]=4 2223 B12R1.226 C=C(C)CSc1cccc(c1)Br 62a_100000748629_100000691529 [0,0,0,0,0,1|2,1,0]=4 2224 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100000748629_100011215228 [0,0,0,0,0,1|2,1,0]=4 2225 B12R1.226 C=C(C)CSc1cccc(c1)C 62a_100011215228_100000211660 [0,0,0,0,0,1|2,1,0]=4 2226 B12R1.226 C=C(C)CSc1cccc(c1)Cl 62a_100000699651_100000211660 [0,0,0,0,0,1|2,1,0]=4 2227 B12R1.226 C=C(C)CSc1cccc(c1)Cl 62a_100000748629_100000699651 [0,0,0,0,0,1|2,1,0]=4 2228 B12R1.226 C=C(C)CSc1cccc(c1)F 62a_100000685547_100000211660 [0,0,0,0,0,1|2,1,0]=4 2229 B12R1.226 C=C(C)CSc1cccc(c1)F 62a_100000748629_100000685547 [0,0,0,0,0,1|2,1,0]=4 2230 B12R1.226 C=C(C)CSc1cccc(c1)N 62a_100000210019_100000211660 [0,0,0,0,0,1|2,1,0]=4 2231 B12R1.226 C=C(C)CSc1cccc(c1)N 62a_100000748629_100000210019 [0,0,0,0,0,1|2,1,0]=4 2232 B12R1.226 C=C(C)CSc1cccc(c1)O 62a_100000748629_100000211634 [0,0,0,0,0,1|1,1,0]=3 2233 B12R1.226 C=C(C)CSc1cccc(c1)[S] 62a_100000748629_114929384022 [0,0,0,0,0,1|1,2,0]=4 2234 B12R1.226 C=C(C)CSc1cccc(c1)[S] 62a_114929384022_100000211660 [0,0,0,0,0,1|1,2,0]=4 2235 B12R1.226 C=C(C)CSc1cncc(c1)O 62a_100000748629_100000754920 [0,0,0,0,0,1|2,1,0]=4 2236 B12R1.226 C=C(C)CSc1cncc(c1)O 62a_100000754920_100000211660 [0,0,0,0,0,1|2,1,0]=4 2237 B12R1.226 C=C(F)CNc1cccc(c1)O 34a_100000210217_100009893438 [0,0,0,0,0,1|2,0,1]=4 2238 B12R1.226 C=C(F)COc1cccc(c1)Br 34a_100000210342_100009893438 [0,0,0,0,0,1|2,0,1]=4 2239 B12R1.226 C=C(F)COc1cccc(c1)Br 7a_100000210342_100000042424 [0,0,0,0,0,1|2,0,1]=4 2240 B12R1.226 C=C(F)COc1cccc(c1)C 34a_100000210337_100009893438 [0,0,0,0,0,1|2,0,1]=4 2241 B12R1.226 C=C(F)COc1cccc(c1)C 7a_100000210337_100000042424 [0,0,0,0,0,1|2,0,1]=4 2242 B12R1.226 C=C(F)COc1cccc(c1)Cl 34a_100000210295_100009893438 [0,0,0,0,0,1|2,0,1]=4 2243 B12R1.226 C=C(F)COc1cccc(c1)Cl 7a_100000210295_100000042424 [0,0,0,0,0,1|2,0,1]=4 2244 B12R1.226 C=C(F)COc1cccc(c1)F 34a_100000210426_100009893438 [0,0,0,0,0,1|2,0,1]=4 2245 B12R1.226 C=C(F)COc1cccc(c1)F 7a_100000210426_100000042424 [0,0,0,0,0,1|2,0,1]=4 2246 B12R1.226 C=C(F)COc1cccc(c1)I 34a_100000211634_100009893438 [0,0,0,0,0,1|2,0,1]=4 2247 B12R1.226 C=C(F)COc1cccc(c1)I 7a_100000211634_100000042424 [0,0,0,0,0,1|2,0,1]=4 2248 B12R1.226 C=C(F)COc1cccc(c1)N 34a_100000210217_100009893438 [0,0,0,0,0,1|2,0,1]=4 2249 B12R1.226 C=C(F)CSc1cccc(c1)O 62a_100000042424_100000211634 [0,0,0,0,0,1|1,1,1]=4 2250 B12R1.226 CC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_200016266566 [0,0,0,0,0,1|1,0,0]=2 2251 B12R1.226 CC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200000210301 [0,0,0,0,0,1|2,0,0]=3 2252 B12R1.226 CC(=O)C#Cc1cccc(c1)C 1458a_100011892726_200000210301 [0,0,0,0,0,1|2,0,0]=3 2253 B12R1.226 CC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200000210301 [0,0,0,0,0,1|2,0,0]=3 2254 B12R1.226 CC(=O)C#Cc1cccc(c1)F 1458a_100011892744_200000210301 [0,0,0,0,0,1|2,0,0]=3 2255 B12R1.226 CC(=O)C#Cc1cccc(c1)O 1458a_200009909484_200000210301 [0,0,0,0,0,1|1,0,0]=2 2256 B12R1.226 CC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200000210301 [0,0,0,0,0,1|2,0,0]=3 2257 B12R1.226 CC(=O)C=Cc1cccc(c1)C 1458a_100000690095_200000210301 [0,0,0,0,0,1|2,0,0]=3 2258 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200000210301 [0,0,0,0,0,1|2,0,0]=3 2259 B12R1.226 CC(=O)C=Cc1cccc(c1)F 1458a_100000718793_200000210301 [0,0,0,0,0,1|2,0,0]=3 2260 B12R1.226 CC(=O)C=Cc1cccc(c1)I 1458a_100020647043_200000210301 [0,0,0,0,0,1|2,0,0]=3 2261 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [0,0,0,0,0,1|2,0,0]=3 2262 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [0,0,0,0,0,1|2,0,0]=3 2263 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [0,0,0,0,0,1|2,0,0]=3 2264 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [0,0,0,0,0,1|2,0,0]=3 2265 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [0,0,0,0,0,1|2,0,0]=3 2266 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [0,0,0,0,0,1|2,0,0]=3 2267 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [0,0,0,0,0,1|2,0,0]=3 2268 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [0,0,0,0,0,1|2,0,0]=3 2269 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [0,0,0,0,0,1|2,0,0]=3 2270 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [0,0,0,0,0,1|1,0,0]=2 2271 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [0,0,0,0,0,1|1,0,0]=2 2272 B12R1.226 CC(=O)COc1cccc(c1)Br 1458a_100000182359_200000210301 [0,0,0,0,0,1|1,0,0]=2 2273 B12R1.226 CC(=O)COc1cccc(c1)C 1458a_100000183606_200000210301 [0,0,0,0,0,1|1,0,0]=2 2274 B12R1.226 CC(=O)COc1cccc(c1)Cl 1458a_100000184978_200000210301 [0,0,0,0,0,1|1,0,0]=2 2275 B12R1.226 CC(=O)COc1cccc(c1)F 1458a_100000182781_200000210301 [0,0,0,0,0,1|1,0,0]=2 2276 B12R1.226 CC(=O)CSc1cccc(c1)Br 1458a_100000760868_200000210301 [0,0,0,0,0,1|1,1,0]=3 2277 B12R1.226 CC(=O)NCc1cc(ccn1)Br 11a_100009818019_100015343762 [0,0,0,0,0,1|3,0,0]=4 2278 B12R1.226 CC(=O)NCc1cc(ccn1)Br 1626a_100009818019_100015343762 [0,0,0,0,0,1|3,0,0]=4 2279 B12R1.226 CC(=O)NCc1cc(ccn1)Br 240690a_100009818019_100015343762 [0,0,0,0,0,1|3,0,0]=4 2280 B12R1.226 CC(=O)NCc1cc(ccn1)Br 527a_100009818019_100103153847 [0,0,0,0,0,1|3,0,0]=4 2281 B12R1.226 CC(=O)NCc1cc(ccn1)C 11a_100011934573_100015343762 [0,0,0,0,0,1|3,0,0]=4 2282 B12R1.226 CC(=O)NCc1cc(ccn1)C 1626a_100011934573_100015343762 [0,0,0,0,0,1|3,0,0]=4 2283 B12R1.226 CC(=O)NCc1cc(ccn1)C 240690a_100011934573_100015343762 [0,0,0,0,0,1|3,0,0]=4 2284 B12R1.226 CC(=O)NCc1cc(ccn1)C 527a_100011934573_100103153847 [0,0,0,0,0,1|3,0,0]=4 2285 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 11a_100000085674_100015343762 [0,0,0,0,0,1|3,0,0]=4 2286 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 1626a_100000085674_100015343762 [0,0,0,0,0,1|3,0,0]=4 2287 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 240690a_100000085674_100015343762 [0,0,0,0,0,1|3,0,0]=4 2288 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 527a_100000085674_100103153847 [0,0,0,0,0,1|3,0,0]=4 2289 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 11a_100000696482_100015343762 [0,0,0,0,0,1|2,0,1]=4 2290 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 1626a_100000696482_100015343762 [0,0,0,0,0,1|2,0,1]=4 2291 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 240690a_100000696482_100015343762 [0,0,0,0,0,1|2,0,1]=4 2292 B12R1.226 CC(=O)NCc1cccc(=O)[nH]1 527a_100000696482_100103153847 [0,0,0,0,0,1|2,0,1]=4 2293 B12R1.226 CC(=O)NCc1cccc(c1)Br 11a_100000174977_100015343762 [0,0,0,0,0,1|2,0,0]=3 2294 B12R1.226 CC(=O)NCc1cccc(c1)Br 1626a_100000174977_100015343762 [0,0,0,0,0,1|2,0,0]=3 2295 B12R1.226 CC(=O)NCc1cccc(c1)Br 240690a_100000174977_100015343762 [0,0,0,0,0,1|2,0,0]=3 2296 B12R1.226 CC(=O)NCc1cccc(c1)Br 527a_100000174977_100103153847 [0,0,0,0,0,1|2,0,0]=3 2297 B12R1.226 CC(=O)NCc1cccc(c1)C 11a_100000185548_100015343762 [0,0,0,0,0,1|2,0,0]=3 2298 B12R1.226 CC(=O)NCc1cccc(c1)C 1626a_100000185548_100015343762 [0,0,0,0,0,1|2,0,0]=3 2299 B12R1.226 CC(=O)NCc1cccc(c1)C 240690a_100000185548_100015343762 [0,0,0,0,0,1|2,0,0]=3 2300 B12R1.226 CC(=O)NCc1cccc(c1)C 527a_100000185548_100103153847 [0,0,0,0,0,1|2,0,0]=3 2301 B12R1.226 CC(=O)NCc1cccc(c1)Cl 11a_100000174878_100015343762 [0,0,0,0,0,1|2,0,0]=3 2302 B12R1.226 CC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100015343762 [0,0,0,0,0,1|2,0,0]=3 2303 B12R1.226 CC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100015343762 [0,0,0,0,0,1|2,0,0]=3 2304 B12R1.226 CC(=O)NCc1cccc(c1)Cl 527a_100000174878_100103153847 [0,0,0,0,0,1|2,0,0]=3 2305 B12R1.226 CC(=O)NCc1cccc(c1)F 11a_100000174948_100015343762 [0,0,0,0,0,1|2,0,0]=3 2306 B12R1.226 CC(=O)NCc1cccc(c1)F 1626a_100000174948_100015343762 [0,0,0,0,0,1|2,0,0]=3 2307 B12R1.226 CC(=O)NCc1cccc(c1)F 240690a_100000174948_100015343762 [0,0,0,0,0,1|2,0,0]=3 2308 B12R1.226 CC(=O)NCc1cccc(c1)F 527a_100000174948_100103153847 [0,0,0,0,0,1|2,0,0]=3 2309 B12R1.226 CC(=O)NCc1cccc(c1)I 11a_100000106179_100015343762 [0,0,0,0,0,1|2,0,0]=3 2310 B12R1.226 CC(=O)NCc1cccc(c1)I 1626a_100000106179_100015343762 [0,0,0,0,0,1|2,0,0]=3 2311 B12R1.226 CC(=O)NCc1cccc(c1)I 240690a_100000106179_100015343762 [0,0,0,0,0,1|2,0,0]=3 2312 B12R1.226 CC(=O)NCc1cccc(c1)I 527a_100000106179_100103153847 [0,0,0,0,0,1|2,0,0]=3 2313 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [0,0,0,0,0,1|1,0,0]=2 2314 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [0,0,0,0,0,1|1,0,0]=2 2315 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [0,0,0,0,0,1|1,0,0]=2 2316 B12R1.226 CC(=O)NCc1cccc(n1)Br 11a_100016987751_100015343762 [0,0,0,0,0,1|3,0,0]=4 2317 B12R1.226 CC(=O)NCc1cccc(n1)Br 1626a_100016987751_100015343762 [0,0,0,0,0,1|3,0,0]=4 2318 B12R1.226 CC(=O)NCc1cccc(n1)Br 240690a_100016987751_100015343762 [0,0,0,0,0,1|3,0,0]=4 2319 B12R1.226 CC(=O)NCc1cccc(n1)Br 527a_100016987751_100103153847 [0,0,0,0,0,1|3,0,0]=4 2320 B12R1.226 CC(=O)NCc1cccc(n1)C 11a_100000701342_100015343762 [0,0,0,0,0,1|3,0,0]=4 2321 B12R1.226 CC(=O)NCc1cccc(n1)C 1626a_100000701342_100015343762 [0,0,0,0,0,1|3,0,0]=4 2322 B12R1.226 CC(=O)NCc1cccc(n1)C 240690a_100000701342_100015343762 [0,0,0,0,0,1|3,0,0]=4 2323 B12R1.226 CC(=O)NCc1cccc(n1)C 527a_100000701342_100103153847 [0,0,0,0,0,1|3,0,0]=4 2324 B12R1.226 CC(=O)NCc1cccc(n1)Cl 11a_100016990191_100015343762 [0,0,0,0,0,1|3,0,0]=4 2325 B12R1.226 CC(=O)NCc1cccc(n1)Cl 1626a_100016990191_100015343762 [0,0,0,0,0,1|3,0,0]=4 2326 B12R1.226 CC(=O)NCc1cccc(n1)Cl 240690a_100016990191_100015343762 [0,0,0,0,0,1|3,0,0]=4 2327 B12R1.226 CC(=O)NCc1cccc(n1)Cl 527a_100016990191_100103153847 [0,0,0,0,0,1|3,0,0]=4 2328 B12R1.226 CC(=O)NCc1cccc(n1)F 11a_100015188798_100015343762 [0,0,0,0,0,1|3,0,0]=4 2329 B12R1.226 CC(=O)NCc1cccc(n1)F 1626a_100015188798_100015343762 [0,0,0,0,0,1|3,0,0]=4 2330 B12R1.226 CC(=O)NCc1cccc(n1)F 240690a_100015188798_100015343762 [0,0,0,0,0,1|3,0,0]=4 2331 B12R1.226 CC(=O)NCc1cccc(n1)F 527a_100015188798_100103153847 [0,0,0,0,0,1|3,0,0]=4 2332 B12R1.226 CC(=O)NCc1ccnc(c1)Br 11a_100025757509_100015343762 [0,0,0,0,0,1|3,0,0]=4 2333 B12R1.226 CC(=O)NCc1ccnc(c1)Br 240690a_100025757509_100015343762 [0,0,0,0,0,1|3,0,0]=4 2334 B12R1.226 CC(=O)NCc1ccnc(c1)Br 527a_100025757509_100103153847 [0,0,0,0,0,1|3,0,0]=4 2335 B12R1.226 CC(=O)NCc1ccnc(c1)C 11a_100011934566_100015343762 [0,0,0,0,0,1|3,0,0]=4 2336 B12R1.226 CC(=O)NCc1ccnc(c1)C 1626a_100011934566_100015343762 [0,0,0,0,0,1|3,0,0]=4 2337 B12R1.226 CC(=O)NCc1ccnc(c1)C 240690a_100011934566_100015343762 [0,0,0,0,0,1|3,0,0]=4 2338 B12R1.226 CC(=O)NCc1ccnc(c1)C 527a_100011934566_100103153847 [0,0,0,0,0,1|3,0,0]=4 2339 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 11a_100015205668_100015343762 [0,0,0,0,0,1|3,0,0]=4 2340 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 1626a_100015205668_100015343762 [0,0,0,0,0,1|3,0,0]=4 2341 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 240690a_100015205668_100015343762 [0,0,0,0,0,1|3,0,0]=4 2342 B12R1.226 CC(=O)NCc1ccnc(c1)Cl 527a_100015205668_100103153847 [0,0,0,0,0,1|3,0,0]=4 2343 B12R1.226 CC(=O)NCc1ccnc(c1)F 11a_100015188774_100015343762 [0,0,0,0,0,1|3,0,0]=4 2344 B12R1.226 CC(=O)NCc1ccnc(c1)F 1626a_100015188774_100015343762 [0,0,0,0,0,1|3,0,0]=4 2345 B12R1.226 CC(=O)NCc1ccnc(c1)F 240690a_100015188774_100015343762 [0,0,0,0,0,1|3,0,0]=4 2346 B12R1.226 CC(=O)NCc1ccnc(c1)F 527a_100015188774_100103153847 [0,0,0,0,0,1|3,0,0]=4 2347 B12R1.226 CC(=O)NCc1ccnc(c1)O 11a_100000748557_100015343762 [0,0,0,0,0,1|2,0,0]=3 2348 B12R1.226 CC(=O)NCc1ccnc(c1)O 240690a_100000748557_100015343762 [0,0,0,0,0,1|2,0,0]=3 2349 B12R1.226 CC(=O)NCc1ccnc(c1)O 527a_100000748557_100103153847 [0,0,0,0,0,1|2,0,0]=3 2350 B12R1.226 CC(=O)NCc1cncc(c1)Br 11a_100011249555_100015343762 [0,0,0,0,0,1|3,0,0]=4 2351 B12R1.226 CC(=O)NCc1cncc(c1)Br 240690a_100011249555_100015343762 [0,0,0,0,0,1|3,0,0]=4 2352 B12R1.226 CC(=O)NCc1cncc(c1)Br 527a_100011249555_100103153847 [0,0,0,0,0,1|3,0,0]=4 2353 B12R1.226 CC(=O)NCc1cncc(c1)C 11a_100000692839_100015343762 [0,0,0,0,0,1|3,0,0]=4 2354 B12R1.226 CC(=O)NCc1cncc(c1)C 1626a_100000692839_100015343762 [0,0,0,0,0,1|3,0,0]=4 2355 B12R1.226 CC(=O)NCc1cncc(c1)C 240690a_100000692839_100015343762 [0,0,0,0,0,1|3,0,0]=4 2356 B12R1.226 CC(=O)NCc1cncc(c1)C 527a_100000692839_100103153847 [0,0,0,0,0,1|3,0,0]=4 2357 B12R1.226 CC(=O)NCc1cncc(c1)Cl 11a_200020614424_100015343762 [0,0,0,0,0,1|3,0,0]=4 2358 B12R1.226 CC(=O)NCc1cncc(c1)Cl 1626a_200020614424_100015343762 [0,0,0,0,0,1|3,0,0]=4 2359 B12R1.226 CC(=O)NCc1cncc(c1)Cl 240690a_200020614424_100015343762 [0,0,0,0,0,1|3,0,0]=4 2360 B12R1.226 CC(=O)NCc1cncc(c1)Cl 527a_200020614424_100103153847 [0,0,0,0,0,1|3,0,0]=4 2361 B12R1.226 CC(=O)NCc1cncc(c1)F 11a_100011962886_100015343762 [0,0,0,0,0,1|3,0,0]=4 2362 B12R1.226 CC(=O)NCc1cncc(c1)F 1626a_100011962886_100015343762 [0,0,0,0,0,1|3,0,0]=4 2363 B12R1.226 CC(=O)NCc1cncc(c1)F 240690a_100011962886_100015343762 [0,0,0,0,0,1|3,0,0]=4 2364 B12R1.226 CC(=O)NCc1cncc(c1)F 527a_100011962886_100103153847 [0,0,0,0,0,1|3,0,0]=4 2365 B12R1.226 CC(=O)NNc1cc(ccn1)Br 22a_100000764631_100000070787 [0,0,0,0,0,1|3,0,0]=4 2366 B12R1.226 CC(=O)NNc1cc(ccn1)C 22a_100000746014_100000070787 [0,0,0,0,0,1|3,0,0]=4 2367 B12R1.226 CC(=O)NNc1cc(ccn1)Cl 22a_100102524961_100000070787 [0,0,0,0,0,1|3,0,0]=4 2368 B12R1.226 CC(=O)NNc1cc(ccn1)I 22a_100010221011_100000070787 [0,0,0,0,0,1|3,0,0]=4 2369 B12R1.226 CC(=O)NNc1cc[nH]c(=O)c1 22a_100000120847_100000070787 [0,0,0,0,0,1|2,0,1]=4 2370 B12R1.226 CC(=O)NNc1cccc(c1)Br 22a_100000217339_100000070787 [0,0,0,0,0,1|2,0,0]=3 2371 B12R1.226 CC(=O)NNc1cccc(c1)C 22a_100000681630_100000070787 [0,0,0,0,0,1|2,0,0]=3 2372 B12R1.226 CC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000070787 [0,0,0,0,0,1|2,0,0]=3 2373 B12R1.226 CC(=O)NNc1cccc(c1)F 22a_100000745080_100000070787 [0,0,0,0,0,1|2,0,0]=3 2374 B12R1.226 CC(=O)NNc1cccc(c1)I 22a_100020605690_100000070787 [0,0,0,0,0,1|2,0,0]=3 2375 B12R1.226 CC(=O)NNc1cccc(n1)Br 22a_100009817029_100000070787 [0,0,0,0,0,1|3,0,0]=4 2376 B12R1.226 CC(=O)NNc1cccc(n1)C 22a_100011363444_100000070787 [0,0,0,0,0,1|3,0,0]=4 2377 B12R1.226 CC(=O)NNc1cccc(n1)Cl 22a_100102524919_100000070787 [0,0,0,0,0,1|3,0,0]=4 2378 B12R1.226 CC(=O)NNc1cccc(n1)F 22a_100000075452_100000070787 [0,0,0,0,0,1|3,0,0]=4 2379 B12R1.226 CC(=O)NNc1cccc(n1)O 271570a_203496583355_200000079166 [0,0,0,0,0,1|2,0,0]=3 2380 B12R1.226 CC(=O)NNc1cncc(c1)Br 22a_100000727789_100000070787 [0,0,0,0,0,1|3,0,0]=4 2381 B12R1.226 CC(=O)NNc1cncc(c1)F 22a_200011955905_100000070787 [0,0,0,0,0,1|3,0,0]=4 2382 B12R1.226 CC(C)C=Cc1cccc(c1)O 271570a_100016257149_100000211634 [0,0,0,0,0,1|2,0,1]=4 2383 B12R1.226 CC(C)CNc1cccc(c1)O 34a_100000210217_100000210624 [0,0,0,0,0,1|2,0,1]=4 2384 B12R1.226 CC(C)COc1cccc(c1)Br 34a_100000210342_100000210624 [0,0,0,0,0,1|2,0,1]=4 2385 B12R1.226 CC(C)COc1cccc(c1)Br 7a_100000210342_100000210760 [0,0,0,0,0,1|2,0,1]=4 2386 B12R1.226 CC(C)COc1cccc(c1)Cl 34a_100000210295_100000210624 [0,0,0,0,0,1|2,0,1]=4 2387 B12R1.226 CC(C)COc1cccc(c1)Cl 7a_100000210295_100000210760 [0,0,0,0,0,1|2,0,1]=4 2388 B12R1.226 CC(C)COc1cccc(c1)F 34a_100000210426_100000210624 [0,0,0,0,0,1|2,0,1]=4 2389 B12R1.226 CC(C)COc1cccc(c1)F 7a_100000210426_100000210760 [0,0,0,0,0,1|2,0,1]=4 2390 B12R1.226 CC(C)COc1cccc(c1)I 34a_100000211634_100000210624 [0,0,0,0,0,1|2,0,1]=4 2391 B12R1.226 CC(C)COc1cccc(c1)I 7a_100000211634_100000210760 [0,0,0,0,0,1|2,0,1]=4 2392 B12R1.226 CC(C)COc1cccc(c1)N 34a_100000210217_100000210624 [0,0,0,0,0,1|2,0,1]=4 2393 B12R1.226 CC(C)COc1cccc(c1)O 271570a_203496583355_200000170005 [0,0,0,0,0,1|1,0,1]=3 2394 B12R1.226 CC(C)CSc1cccc(c1)O 62a_100000210624_100000211634 [0,0,0,0,0,1|1,1,1]=4 2395 B12R1.226 CC(C)NCc1cccc(c1)O 207a_100138425928_100000188321 [0,0,0,0,0,1|2,0,1]=4 2396 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100000743036_100000210206 [0,0,0,0,0,1|2,0,1]=4 2397 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100138425928_100011660834 [0,0,0,0,0,1|2,0,1]=4 2398 B12R1.226 CC(C)NCc1cccc(c1)O 271570a_203496583355_100000195767 [0,0,0,0,0,1|2,0,1]=4 2399 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100000743036_100000210206 [0,0,0,0,0,1|2,0,1]=4 2400 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100138425928_100011660834 [0,0,0,0,0,1|2,0,1]=4 2401 B12R1.226 CC(C)OCc1cccc(c1)Br 34a_100000212225_100000698116 [0,0,0,0,0,1|2,0,1]=4 2402 B12R1.226 CC(C)OCc1cccc(c1)Br 34a_100000687537_100000210206 [0,0,0,0,0,1|2,0,1]=4 2403 B12R1.226 CC(C)OCc1cccc(c1)Br 7a_100000687537_100000210206 [0,0,0,0,0,1|2,0,1]=4 2404 B12R1.226 CC(C)OCc1cccc(c1)Cl 34a_100000212225_100000187163 [0,0,0,0,0,1|2,0,1]=4 2405 B12R1.226 CC(C)OCc1cccc(c1)Cl 34a_100000241301_100000210206 [0,0,0,0,0,1|2,0,1]=4 2406 B12R1.226 CC(C)OCc1cccc(c1)Cl 7a_100000241301_100000210206 [0,0,0,0,0,1|2,0,1]=4 2407 B12R1.226 CC(C)OCc1cccc(c1)F 34a_100000210976_100000210206 [0,0,0,0,0,1|2,0,1]=4 2408 B12R1.226 CC(C)OCc1cccc(c1)F 34a_100000212225_100000187166 [0,0,0,0,0,1|2,0,1]=4 2409 B12R1.226 CC(C)OCc1cccc(c1)F 7a_100000210976_100000210206 [0,0,0,0,0,1|2,0,1]=4 2410 B12R1.226 CC(C)OCc1cccc(c1)I 34a_100000212225_100011218688 [0,0,0,0,0,1|2,0,1]=4 2411 B12R1.226 CC(C)OCc1cccc(c1)I 34a_100011215336_100000210206 [0,0,0,0,0,1|2,0,1]=4 2412 B12R1.226 CC(C)OCc1cccc(c1)I 7a_100011215336_100000210206 [0,0,0,0,0,1|2,0,1]=4 2413 B12R1.226 CC(C)OCc1cccc(c1)N 34a_100000211919_100000210206 [0,0,0,0,0,1|2,0,1]=4 2414 B12R1.226 CC(C)OCc1cccc(c1)O 34a_100000212225_100011660834 [0,0,0,0,0,1|1,0,1]=3 2415 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100000210206_100011660834 [0,0,0,0,0,1|1,1,1]=4 2416 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100011660834_100000210206 [0,0,0,0,0,1|1,1,1]=4 2417 B12R1.226 CC(O)C=Cc1cccc(c1)O 271570a_200011019289_100000211634 [0,0,0,0,0,1|1,0,2]=4 2418 B12R1.226 CC(O)CNc1cccc(c1)O 34a_100000210217_100011218427 [0,0,0,0,0,1|1,0,2]=4 2419 B12R1.226 CC(O)COc1cccc(c1)Br 34a_100000210342_100011218427 [0,0,0,0,0,1|1,0,2]=4 2420 B12R1.226 CC(O)COc1cccc(c1)Br 7a_100000210342_100011218427 [0,0,0,0,0,1|1,0,2]=4 2421 B12R1.226 CC(O)COc1cccc(c1)Cl 34a_100000210295_100011218427 [0,0,0,0,0,1|1,0,2]=4 2422 B12R1.226 CC(O)COc1cccc(c1)Cl 7a_100000210295_100011218427 [0,0,0,0,0,1|1,0,2]=4 2423 B12R1.226 CC(O)COc1cccc(c1)F 34a_100000210426_100011218427 [0,0,0,0,0,1|1,0,2]=4 2424 B12R1.226 CC(O)COc1cccc(c1)F 7a_100000210426_100011218427 [0,0,0,0,0,1|1,0,2]=4 2425 B12R1.226 CC(O)COc1cccc(c1)I 34a_100000211634_100011218427 [0,0,0,0,0,1|1,0,2]=4 2426 B12R1.226 CC(O)COc1cccc(c1)I 7a_100000211634_100011218427 [0,0,0,0,0,1|1,0,2]=4 2427 B12R1.226 CC(O)COc1cccc(c1)N 34a_100000210217_100011218427 [0,0,0,0,0,1|1,0,2]=4 2428 B12R1.226 CC(O)CSc1cccc(c1)O 62a_100011218427_100000211634 [0,0,0,0,0,1|0,1,2]=4 2429 B12R1.226 C[C@@H](O)CNc1cccc(c1)O 34a_100000210217_100009817552 [0,0,0,0,0,1|1,0,2]=4 2430 B12R1.226 C[C@@H](O)COc1cccc(c1)Br 34a_100000210342_100009817552 [0,0,0,0,0,1|1,0,2]=4 2431 B12R1.226 C[C@@H](O)COc1cccc(c1)Br 7a_100000210342_100009817552 [0,0,0,0,0,1|1,0,2]=4 2432 B12R1.226 C[C@@H](O)COc1cccc(c1)Cl 34a_100000210295_100009817552 [0,0,0,0,0,1|1,0,2]=4 2433 B12R1.226 C[C@@H](O)COc1cccc(c1)Cl 7a_100000210295_100009817552 [0,0,0,0,0,1|1,0,2]=4 2434 B12R1.226 C[C@@H](O)COc1cccc(c1)F 34a_100000210426_100009817552 [0,0,0,0,0,1|1,0,2]=4 2435 B12R1.226 C[C@@H](O)COc1cccc(c1)F 7a_100000210426_100009817552 [0,0,0,0,0,1|1,0,2]=4 2436 B12R1.226 C[C@@H](O)COc1cccc(c1)I 34a_100000211634_100009817552 [0,0,0,0,0,1|1,0,2]=4 2437 B12R1.226 C[C@@H](O)COc1cccc(c1)I 7a_100000211634_100009817552 [0,0,0,0,0,1|1,0,2]=4 2438 B12R1.226 C[C@@H](O)COc1cccc(c1)N 34a_100000210217_100009817552 [0,0,0,0,0,1|1,0,2]=4 2439 B12R1.226 C[C@@H](O)CSc1cccc(c1)O 62a_100009817552_100000211634 [0,0,0,0,0,1|0,1,2]=4 2440 B12R1.226 Cc1cc(ccn1)OCC(=O)N 34a_100000688365_100000187820 [0,0,0,0,0,1|3,0,0]=4 2441 B12R1.226 Cc1cc(ccn1)OCC(=O)[O-] 34a_100000688365_100020667443 [0,0,0,0,0,1|3,0,0]=4 2442 B12R1.226 Cc1cccc(c1)C#CC(=O)[13CH3] 1458a_100011892726_200025704644 [0,0,0,0,0,1|2,0,0]=3 2443 B12R1.226 Cc1cccc(c1)C=CC(=O)[13CH3] 1458a_100000690095_200025704644 [0,0,0,0,0,1|2,0,0]=3 2444 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [0,0,0,0,0,1|2,0,0]=3 2445 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100000212225_100000211840 [0,0,0,0,0,1|2,0,1]=4 2446 B12R1.226 Cc1cccc(c1)COC(C)C 34a_100011217746_100000210206 [0,0,0,0,0,1|2,0,1]=4 2447 B12R1.226 Cc1cccc(c1)COC(C)C 7a_100011217746_100000210206 [0,0,0,0,0,1|2,0,1]=4 2448 B12R1.226 Cc1cccc(c1)NCC(=O)N 2230a_100000188690_100000747473 [0,0,0,0,0,1|3,0,0]=4 2449 B12R1.226 Cc1cccc(c1)NCC(=O)N 34a_100000188690_100000187820 [0,0,0,0,0,1|3,0,0]=4 2450 B12R1.226 Cc1cccc(c1)NCC(=O)[O-] 34a_100000188690_100020667443 [0,0,0,0,0,1|3,0,0]=4 2451 B12R1.226 Cc1cccc(c1)OCC(=O)N 34a_100000210337_100000187820 [0,0,0,0,0,1|2,0,0]=3 2452 B12R1.226 Cc1cccc(c1)OCC(=O)N 7a_100000210337_100000187820 [0,0,0,0,0,1|2,0,0]=3 2453 B12R1.226 Cc1cccc(c1)OCC(=O)[13CH3] 1458a_100000183606_200025704644 [0,0,0,0,0,1|1,0,0]=2 2454 B12R1.226 Cc1cccc(c1)OCC(=O)[O-] 34a_100000210337_100020667443 [0,0,0,0,0,1|2,0,0]=3 2455 B12R1.226 Cc1cccc(c1)OCC(C)C 34a_100000210337_100000210624 [0,0,0,0,0,1|2,0,1]=4 2456 B12R1.226 Cc1cccc(c1)OCC(C)C 7a_100000210337_100000210760 [0,0,0,0,0,1|2,0,1]=4 2457 B12R1.226 Cc1cccc(c1)OCC(C)O 34a_100000210337_100011218427 [0,0,0,0,0,1|1,0,2]=4 2458 B12R1.226 Cc1cccc(c1)OCC(C)O 7a_100000210337_100011218427 [0,0,0,0,0,1|1,0,2]=4 2459 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 34a_100000210337_100009817552 [0,0,0,0,0,1|1,0,2]=4 2460 B12R1.226 Cc1cccc(c1)OC[C@@H](C)O 7a_100000210337_100009817552 [0,0,0,0,0,1|1,0,2]=4 2461 B12R1.226 Cc1cccc(c1)OC[N+](=O)[O-] 34a_100000210337_100000761209 [0,0,0,0,0,1|3,0,0]=4 2462 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100000747473_100011215228 [0,0,0,0,0,1|2,1,0]=4 2463 B12R1.226 Cc1cccc(c1)SCC(=O)N 62a_100011215228_100000747473 [0,0,0,0,0,1|2,1,0]=4 2464 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100011215228_100020667443 [0,0,0,0,0,1|2,1,0]=4 2465 B12R1.226 Cc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100011215228 [0,0,0,0,0,1|2,1,0]=4 2466 B12R1.226 Cc1cncc(c1)OCC(=O)N 34a_100011830280_100000187820 [0,0,0,0,0,1|3,0,0]=4 2467 B12R1.226 Cc1cncc(c1)OCC(=O)N 7a_100011830280_100000187820 [0,0,0,0,0,1|3,0,0]=4 2468 B12R1.226 Cc1cncc(c1)OCC(=O)[O-] 34a_100011830280_100020667443 [0,0,0,0,0,1|3,0,0]=4 2469 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [0,0,0,0,0,1|2,0,0]=3 2470 B12R1.226 NC(=O)CNc1cccc(c1)Br 34a_100000210019_100000187820 [0,0,0,0,0,1|3,0,0]=4 2471 B12R1.226 NC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000187820 [0,0,0,0,0,1|3,0,0]=4 2472 B12R1.226 NC(=O)CNc1cccc(c1)F 34a_100000210047_100000187820 [0,0,0,0,0,1|3,0,0]=4 2473 B12R1.226 NC(=O)CNc1cccc(c1)I 34a_100000211102_100000187820 [0,0,0,0,0,1|3,0,0]=4 2474 B12R1.226 NC(=O)CNc1cccc(c1)O 34a_100000210217_100000187820 [0,0,0,0,0,1|2,0,0]=3 2475 B12R1.226 NC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000187820 [0,0,0,0,0,1|2,0,1]=4 2476 B12R1.226 NC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000187820 [0,0,0,0,0,1|2,0,1]=4 2477 B12R1.226 NC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000187820 [0,0,0,0,0,1|2,0,1]=4 2478 B12R1.226 NC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000187820 [0,0,0,0,0,1|2,0,1]=4 2479 B12R1.226 NC(=O)COc1cccc(c1)Br 34a_100000210342_100000187820 [0,0,0,0,0,1|2,0,0]=3 2480 B12R1.226 NC(=O)COc1cccc(c1)Br 7a_100000210342_100000187820 [0,0,0,0,0,1|2,0,0]=3 2481 B12R1.226 NC(=O)COc1cccc(c1)Cl 34a_100000210295_100000187820 [0,0,0,0,0,1|2,0,0]=3 2482 B12R1.226 NC(=O)COc1cccc(c1)Cl 7a_100000210295_100000187820 [0,0,0,0,0,1|2,0,0]=3 2483 B12R1.226 NC(=O)COc1cccc(c1)F 34a_100000210426_100000187820 [0,0,0,0,0,1|2,0,0]=3 2484 B12R1.226 NC(=O)COc1cccc(c1)F 7a_100000210426_100000187820 [0,0,0,0,0,1|2,0,0]=3 2485 B12R1.226 NC(=O)COc1cccc(c1)I 34a_100000211634_100000187820 [0,0,0,0,0,1|2,0,0]=3 2486 B12R1.226 NC(=O)COc1cccc(c1)I 7a_100000211634_100000187820 [0,0,0,0,0,1|2,0,0]=3 2487 B12R1.226 NC(=O)COc1cccc(c1)N 34a_100000210217_100000187820 [0,0,0,0,0,1|2,0,0]=3 2488 B12R1.226 NC(=O)COc1cccc(c1)O 271570a_203496583355_200000150604 [0,0,0,0,0,1|1,0,0]=2 2489 B12R1.226 NC(=O)COc1cccc(n1)F 34a_100011432558_100000187820 [0,0,0,0,0,1|3,0,0]=4 2490 B12R1.226 NC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000187820 [0,0,0,0,0,1|3,0,0]=4 2491 B12R1.226 NC(=O)COc1ccnc(c1)F 34a_100000732698_100000187820 [0,0,0,0,0,1|3,0,0]=4 2492 B12R1.226 NC(=O)COc1ccnc(c1)N 34a_100011834064_100000187820 [0,0,0,0,0,1|3,0,0]=4 2493 B12R1.226 NC(=O)COc1cncc(c1)Br 34a_100000754920_100000187820 [0,0,0,0,0,1|3,0,0]=4 2494 B12R1.226 NC(=O)COc1cncc(c1)Br 7a_100000754920_100000187820 [0,0,0,0,0,1|3,0,0]=4 2495 B12R1.226 NC(=O)COc1cncc(c1)Cl 7a_100000032511_100000187820 [0,0,0,0,0,1|3,0,0]=4 2496 B12R1.226 NC(=O)COc1cncc(c1)F 34a_100011830296_100000187820 [0,0,0,0,0,1|3,0,0]=4 2497 B12R1.226 NC(=O)COc1cncc(c1)F 7a_100011830296_100000187820 [0,0,0,0,0,1|3,0,0]=4 2498 B12R1.226 NC(=O)COc1cncc(c1)N 34a_100011997051_100000187820 [0,0,0,0,0,1|3,0,0]=4 2499 B12R1.226 NC(=O)CSc1cc(ccn1)O 62a_100000747473_100000762945 [0,0,0,0,0,1|2,1,0]=4 2500 B12R1.226 NC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747473 [0,0,0,0,0,1|2,1,0]=4 2501 B12R1.226 NC(=O)CSc1cccc(c1)Br 62a_100000747473_100000691529 [0,0,0,0,0,1|2,1,0]=4 2502 B12R1.226 NC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747473 [0,0,0,0,0,1|2,1,0]=4 2503 B12R1.226 NC(=O)CSc1cccc(c1)Cl 62a_100000747473_100000699651 [0,0,0,0,0,1|2,1,0]=4 2504 B12R1.226 NC(=O)CSc1cccc(c1)F 62a_100000685547_100000747473 [0,0,0,0,0,1|2,1,0]=4 2505 B12R1.226 NC(=O)CSc1cccc(c1)F 62a_100000747473_100000685547 [0,0,0,0,0,1|2,1,0]=4 2506 B12R1.226 NC(=O)CSc1cccc(c1)N 62a_100000210019_100000747473 [0,0,0,0,0,1|2,1,0]=4 2507 B12R1.226 NC(=O)CSc1cccc(c1)N 62a_100000747473_100000210019 [0,0,0,0,0,1|2,1,0]=4 2508 B12R1.226 NC(=O)CSc1cccc(c1)O 62a_100000747473_100000211634 [0,0,0,0,0,1|1,1,0]=3 2509 B12R1.226 NC(=O)CSc1cccc(c1)[S] 62a_100000747473_114929384022 [0,0,0,0,0,1|1,2,0]=4 2510 B12R1.226 NC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747473 [0,0,0,0,0,1|1,2,0]=4 2511 B12R1.226 NC(=O)CSc1cncc(c1)O 62a_100000747473_100000754920 [0,0,0,0,0,1|2,1,0]=4 2512 B12R1.226 NC(=O)CSc1cncc(c1)O 62a_100000754920_100000747473 [0,0,0,0,0,1|2,1,0]=4 2513 B12R1.226 Nc1cc(ccn1)OCC(=O)[O-] 34a_100011834064_100020667443 [0,0,0,0,0,1|3,0,0]=4 2514 B12R1.226 Nc1cccc(c1)OCC(=O)[O-] 34a_100000210217_100020667443 [0,0,0,0,0,1|2,0,0]=3 2515 B12R1.226 Nc1cccc(c1)OC[N+](=O)[O-] 34a_100000210217_100000761209 [0,0,0,0,0,1|3,0,0]=4 2516 B12R1.226 Nc1cccc(c1)SCC(=O)[O-] 62a_100000210019_100020667443 [0,0,0,0,0,1|2,1,0]=4 2517 B12R1.226 Nc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000210019 [0,0,0,0,0,1|2,1,0]=4 2518 B12R1.226 Nc1cncc(c1)OCC(=O)[O-] 34a_100011997051_100020667443 [0,0,0,0,0,1|3,0,0]=4 2519 B12R1.226 O=C([O-])CNc1cccc(c1)Br 34a_100000210019_100020667443 [0,0,0,0,0,1|3,0,0]=4 2520 B12R1.226 O=C([O-])CNc1cccc(c1)Cl 34a_100000185859_100020667443 [0,0,0,0,0,1|3,0,0]=4 2521 B12R1.226 O=C([O-])CNc1cccc(c1)F 34a_100000210047_100020667443 [0,0,0,0,0,1|3,0,0]=4 2522 B12R1.226 O=C([O-])CNc1cccc(c1)I 34a_100000211102_100020667443 [0,0,0,0,0,1|3,0,0]=4 2523 B12R1.226 O=C([O-])CNc1cccc(c1)O 34a_100000210217_100020667443 [0,0,0,0,0,1|2,0,0]=3 2524 B12R1.226 O=C([O-])COc1cc[nH]c(=O)c1 34a_100000032262_100020667443 [0,0,0,0,0,1|2,0,1]=4 2525 B12R1.226 O=C([O-])COc1ccc[n+](c1)[O-] 34a_100000039713_100020667443 [0,0,0,0,0,1|2,0,1]=4 2526 B12R1.226 O=C([O-])COc1cccc(=O)[nH]1 34a_100000033347_100020667443 [0,0,0,0,0,1|2,0,1]=4 2527 B12R1.226 O=C([O-])COc1cccc(c1)Br 34a_100000210342_100020667443 [0,0,0,0,0,1|2,0,0]=3 2528 B12R1.226 O=C([O-])COc1cccc(c1)Cl 34a_100000210295_100020667443 [0,0,0,0,0,1|2,0,0]=3 2529 B12R1.226 O=C([O-])COc1cccc(c1)F 34a_100000210426_100020667443 [0,0,0,0,0,1|2,0,0]=3 2530 B12R1.226 O=C([O-])COc1cccc(c1)I 34a_100000211634_100020667443 [0,0,0,0,0,1|2,0,0]=3 2531 B12R1.226 O=C([O-])COc1cccc(n1)F 34a_100011432558_100020667443 [0,0,0,0,0,1|3,0,0]=4 2532 B12R1.226 O=C([O-])COc1ccnc(c1)Cl 34a_100000762945_100020667443 [0,0,0,0,0,1|3,0,0]=4 2533 B12R1.226 O=C([O-])COc1ccnc(c1)F 34a_100000732698_100020667443 [0,0,0,0,0,1|3,0,0]=4 2534 B12R1.226 O=C([O-])COc1cncc(c1)Br 34a_100000754920_100020667443 [0,0,0,0,0,1|3,0,0]=4 2535 B12R1.226 O=C([O-])COc1cncc(c1)F 34a_100011830296_100020667443 [0,0,0,0,0,1|3,0,0]=4 2536 B12R1.226 O=C([O-])CSc1cc(ccn1)O 62a_100020667443_100000762945 [0,0,0,0,0,1|2,1,0]=4 2537 B12R1.226 O=C([O-])CSc1cccc(c1)Br 62a_100000691529_100020667443 [0,0,0,0,0,1|2,1,0]=4 2538 B12R1.226 O=C([O-])CSc1cccc(c1)Br 62a_100020667443_100000691529 [0,0,0,0,0,1|2,1,0]=4 2539 B12R1.226 O=C([O-])CSc1cccc(c1)Cl 62a_100000699651_100020667443 [0,0,0,0,0,1|2,1,0]=4 2540 B12R1.226 O=C([O-])CSc1cccc(c1)Cl 62a_100020667443_100000699651 [0,0,0,0,0,1|2,1,0]=4 2541 B12R1.226 O=C([O-])CSc1cccc(c1)F 62a_100000685547_100020667443 [0,0,0,0,0,1|2,1,0]=4 2542 B12R1.226 O=C([O-])CSc1cccc(c1)F 62a_100020667443_100000685547 [0,0,0,0,0,1|2,1,0]=4 2543 B12R1.226 O=C([O-])CSc1cccc(c1)O 62a_100020667443_100000211634 [0,0,0,0,0,1|1,1,0]=3 2544 B12R1.226 O=C([O-])CSc1cccc(c1)[S] 62a_100020667443_114929384022 [0,0,0,0,0,1|1,2,0]=4 2545 B12R1.226 O=C([O-])CSc1cccc(c1)[S] 62a_114929384022_100020667443 [0,0,0,0,0,1|1,2,0]=4 2546 B12R1.226 O=C([O-])CSc1cncc(c1)O 62a_100000754920_100020667443 [0,0,0,0,0,1|2,1,0]=4 2547 B12R1.226 O=C([O-])CSc1cncc(c1)O 62a_100020667443_100000754920 [0,0,0,0,0,1|2,1,0]=4 2548 B12R1.226 O=[N+]([O-])CNc1cccc(c1)O 34a_100000210217_100000761209 [0,0,0,0,0,1|3,0,0]=4 2549 B12R1.226 O=[N+]([O-])COc1cccc(c1)Br 34a_100000210342_100000761209 [0,0,0,0,0,1|3,0,0]=4 2550 B12R1.226 O=[N+]([O-])COc1cccc(c1)Cl 34a_100000210295_100000761209 [0,0,0,0,0,1|3,0,0]=4 2551 B12R1.226 O=[N+]([O-])COc1cccc(c1)F 34a_100000210426_100000761209 [0,0,0,0,0,1|3,0,0]=4 2552 B12R1.226 O=[N+]([O-])COc1cccc(c1)I 34a_100000211634_100000761209 [0,0,0,0,0,1|3,0,0]=4 2553 B12R1.226 Oc1cccc(c1)OCC(F)F 271570a_203496583355_100000763112 [0,0,0,0,0,1|2,0,1]=4 2554 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Br 1458a_100012100324_200025704644 [0,0,0,0,0,1|2,0,0]=3 2555 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_200025704644 [0,0,0,0,0,1|2,0,0]=3 2556 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)F 1458a_100011892744_200025704644 [0,0,0,0,0,1|2,0,0]=3 2557 B12R1.226 [13CH3]C(=O)C#Cc1cccc(c1)O 1458a_200009909484_200025704644 [0,0,0,0,0,1|1,0,0]=2 2558 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Br 1458a_100016258244_200025704644 [0,0,0,0,0,1|2,0,0]=3 2559 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_200025704644 [0,0,0,0,0,1|2,0,0]=3 2560 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)F 1458a_100000718793_200025704644 [0,0,0,0,0,1|2,0,0]=3 2561 B12R1.226 [13CH3]C(=O)C=Cc1cccc(c1)I 1458a_100020647043_200025704644 [0,0,0,0,0,1|2,0,0]=3 2562 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [0,0,0,0,0,1|2,0,0]=3 2563 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [0,0,0,0,0,1|2,0,0]=3 2564 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [0,0,0,0,0,1|2,0,0]=3 2565 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [0,0,0,0,0,1|2,0,0]=3 2566 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [0,0,0,0,0,1|1,0,0]=2 2567 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Br 1458a_100000182359_200025704644 [0,0,0,0,0,1|1,0,0]=2 2568 B12R1.226 [13CH3]C(=O)COc1cccc(c1)Cl 1458a_100000184978_200025704644 [0,0,0,0,0,1|1,0,0]=2 2569 B12R1.226 [13CH3]C(=O)COc1cccc(c1)F 1458a_100000182781_200025704644 [0,0,0,0,0,1|1,0,0]=2 2570 B12R1.226 [13CH3]C(=O)CSc1cccc(c1)Br 1458a_100000760868_200025704644 [0,0,0,0,0,1|1,1,0]=3 2571 B9R1.2 C=Cc1cc(ccn1)O 271570a_100011290941_100000762945 [2,0,0,0,0,0|1,0,1]=4 2572 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [2,0,0,0,0,0|1,0,1]=4 2573 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,0,0,0,0,0|1,0,1]=4 2574 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [2,0,0,0,0,0|1,0,1]=4 2575 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [2,0,0,0,0,0|1,0,1]=4 2576 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [2,0,0,0,0,0|1,0,1]=4 2577 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,0,0,0,0,0|0,0,1]=3 2578 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [2,0,0,0,0,0|0,1,1]=4 2579 B9R1.2 C=Cc1cncc(c1)O 271570a_100011290941_100000754920 [2,0,0,0,0,0|1,0,1]=4 2580 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [2,0,0,0,0,0|1,0,1]=4 2581 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|0,0,1]=3 2582 B9R1.2 CCc1cccc(n1)O 271570a_203496583355_100009856026 [2,0,0,0,0,0|1,0,1]=4 2583 B9R1.2 CCc1ccnc(c1)O 271570a_203496583355_100009817561 [2,0,0,0,0,0|1,0,1]=4 2584 B9R1.2 CCc1cncc(c1)O 271570a_203496583355_200009819073 [2,0,0,0,0,0|1,0,1]=4 2585 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [2,0,0,0,0,0|2,0,0]=4 2586 B9R1.2 CNc1cccc(c1)Br 34a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 2587 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,0,0,0,0,0|2,0,0]=4 2588 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,0,0,0,0,0|2,0,0]=4 2589 B9R1.2 CNc1cccc(c1)Cl 34a_100000185859_200000210301 [2,0,0,0,0,0|2,0,0]=4 2590 B9R1.2 CNc1cccc(c1)F 34a_100000210047_200000210301 [2,0,0,0,0,0|2,0,0]=4 2591 B9R1.2 CNc1cccc(c1)I 34a_100000211102_200000210301 [2,0,0,0,0,0|2,0,0]=4 2592 B9R1.2 CNc1cccc(c1)O 271570a_203496583355_100000219648 [2,0,0,0,0,0|1,0,0]=3 2593 B9R1.2 CNc1cccc(c1)O 34a_100000210217_200000210301 [2,0,0,0,0,0|1,0,0]=3 2594 B9R1.2 CNc1cccc(n1)O 271570a_203496583355_100000703281 [2,0,0,0,0,0|2,0,0]=4 2595 B9R1.2 CNc1ccnc(c1)O 271570a_203496583355_100009869472 [2,0,0,0,0,0|2,0,0]=4 2596 B9R1.2 CNc1cncc(c1)O 271570a_203496583355_100012184536 [2,0,0,0,0,0|2,0,0]=4 2597 B9R1.2 COc1cc(ccn1)O 271570a_203496583355_100000117307 [2,0,0,0,0,0|1,0,0]=3 2598 B9R1.2 COc1cc(ncn1)O 271570a_203496583355_100012187182 [2,0,0,0,0,0|2,0,0]=4 2599 B9R1.2 COc1cc[nH]c(=O)c1 34a_100000032262_200000210301 [2,0,0,0,0,0|1,0,1]=4 2600 B9R1.2 COc1ccc[n+](c1)[O-] 34a_100000039713_200000210301 [2,0,0,0,0,0|1,0,1]=4 2601 B9R1.2 COc1ccc[n+](c1)[O-] 7a_100000039713_200000210301 [2,0,0,0,0,0|1,0,1]=4 2602 B9R1.2 COc1cccc(=O)[nH]1 34a_100000033347_200000210301 [2,0,0,0,0,0|1,0,1]=4 2603 B9R1.2 COc1cccc(c1)Br 34a_100000210342_200000210301 [2,0,0,0,0,0|1,0,0]=3 2604 B9R1.2 COc1cccc(c1)Br 7a_100000210342_200000210301 [2,0,0,0,0,0|1,0,0]=3 2605 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,0,0,0,0,0|1,0,0]=3 2606 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,0,0,0,0,0|1,0,0]=3 2607 B9R1.2 COc1cccc(c1)Cl 34a_100000210295_200000210301 [2,0,0,0,0,0|1,0,0]=3 2608 B9R1.2 COc1cccc(c1)Cl 7a_100000210295_200000210301 [2,0,0,0,0,0|1,0,0]=3 2609 B9R1.2 COc1cccc(c1)F 34a_100000210426_200000210301 [2,0,0,0,0,0|1,0,0]=3 2610 B9R1.2 COc1cccc(c1)F 7a_100000210426_200000210301 [2,0,0,0,0,0|1,0,0]=3 2611 B9R1.2 COc1cccc(c1)I 34a_100000211634_200000210301 [2,0,0,0,0,0|1,0,0]=3 2612 B9R1.2 COc1cccc(c1)I 7a_100000211634_200000210301 [2,0,0,0,0,0|1,0,0]=3 2613 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,0,0,0,0,0|1,0,0]=3 2614 B9R1.2 COc1cccc(c1)O 271570a_203496583355_100000170001 [2,0,0,0,0,0|0,0,0]=2 2615 B9R1.2 COc1cccc(n1)F 34a_100011432558_200000210301 [2,0,0,0,0,0|2,0,0]=4 2616 B9R1.2 COc1cccc(n1)O 271570a_203496583355_100000760917 [2,0,0,0,0,0|1,0,0]=3 2617 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [2,0,0,0,0,0|2,0,0]=4 2618 B9R1.2 COc1ccnc(c1)Cl 34a_100000762945_200000210301 [2,0,0,0,0,0|2,0,0]=4 2619 B9R1.2 COc1ccnc(c1)F 34a_100000732698_200000210301 [2,0,0,0,0,0|2,0,0]=4 2620 B9R1.2 COc1ccnc(c1)N 34a_100011834064_200000210301 [2,0,0,0,0,0|2,0,0]=4 2621 B9R1.2 COc1ccnc(c1)O 271570a_203496583355_100011216251 [2,0,0,0,0,0|1,0,0]=3 2622 B9R1.2 COc1ccnc(n1)O 271570a_203496583355_100000182009 [2,0,0,0,0,0|2,0,0]=4 2623 B9R1.2 COc1cncc(c1)Br 34a_100000754920_200000210301 [2,0,0,0,0,0|2,0,0]=4 2624 B9R1.2 COc1cncc(c1)Br 7a_100000754920_200000210301 [2,0,0,0,0,0|2,0,0]=4 2625 B9R1.2 COc1cncc(c1)C 34a_100011830280_200000210301 [2,0,0,0,0,0|2,0,0]=4 2626 B9R1.2 COc1cncc(c1)C 7a_100011830280_200000210301 [2,0,0,0,0,0|2,0,0]=4 2627 B9R1.2 COc1cncc(c1)Cl 7a_100000032511_200000210301 [2,0,0,0,0,0|2,0,0]=4 2628 B9R1.2 COc1cncc(c1)F 34a_100011830296_200000210301 [2,0,0,0,0,0|2,0,0]=4 2629 B9R1.2 COc1cncc(c1)F 7a_100011830296_200000210301 [2,0,0,0,0,0|2,0,0]=4 2630 B9R1.2 COc1cncc(c1)N 34a_100011997051_200000210301 [2,0,0,0,0,0|2,0,0]=4 2631 B9R1.2 COc1cncc(c1)O 271570a_203496583355_100000684773 [2,0,0,0,0,0|1,0,0]=3 2632 B9R1.2 COc1cncc(n1)O 271570a_203496583355_100000756030 [2,0,0,0,0,0|2,0,0]=4 2633 B9R1.2 COc1cnnc(c1)O 271570a_203496583355_100000087634 [2,0,0,0,0,0|2,0,0]=4 2634 B9R1.2 COc1nccc(n1)O 271570a_203496583355_100000069072 [2,0,0,0,0,0|2,0,0]=4 2635 B9R1.2 CSc1cc(ccn1)O 62a_200000210301_100000762945 [2,0,0,0,0,0|1,1,0]=4 2636 B9R1.2 CSc1cccc(c1)Br 62a_100000691529_200000210301 [2,0,0,0,0,0|1,1,0]=4 2637 B9R1.2 CSc1cccc(c1)Br 62a_200000210301_100000691529 [2,0,0,0,0,0|1,1,0]=4 2638 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,0,0,0,0,0|1,1,0]=4 2639 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,0,0,0,0,0|1,1,0]=4 2640 B9R1.2 CSc1cccc(c1)Cl 62a_100000699651_200000210301 [2,0,0,0,0,0|1,1,0]=4 2641 B9R1.2 CSc1cccc(c1)Cl 62a_200000210301_100000699651 [2,0,0,0,0,0|1,1,0]=4 2642 B9R1.2 CSc1cccc(c1)F 62a_100000685547_200000210301 [2,0,0,0,0,0|1,1,0]=4 2643 B9R1.2 CSc1cccc(c1)F 62a_200000210301_100000685547 [2,0,0,0,0,0|1,1,0]=4 2644 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,0,0,0,0,0|1,1,0]=4 2645 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,0,0,0,0,0|1,1,0]=4 2646 B9R1.2 CSc1cccc(c1)O 271570a_203496583355_100011215954 [2,0,0,0,0,0|0,1,0]=3 2647 B9R1.2 CSc1cccc(c1)O 62a_200000210301_100000211634 [2,0,0,0,0,0|0,1,0]=3 2648 B9R1.2 CSc1cccc(c1)[S] 62a_114929384022_200000210301 [2,0,0,0,0,0|0,2,0]=4 2649 B9R1.2 CSc1cccc(c1)[S] 62a_200000210301_114929384022 [2,0,0,0,0,0|0,2,0]=4 2650 B9R1.2 CSc1cccc(n1)O 271570a_203496583355_100011960944 [2,0,0,0,0,0|1,1,0]=4 2651 B9R1.2 CSc1ccnc(c1)O 271570a_203496583355_100010883326 [2,0,0,0,0,0|1,1,0]=4 2652 B9R1.2 CSc1cncc(c1)O 271570a_203496583355_100009816972 [2,0,0,0,0,0|1,1,0]=4 2653 B9R1.2 CSc1cncc(c1)O 62a_100000754920_200000210301 [2,0,0,0,0,0|1,1,0]=4 2654 B9R1.2 CSc1cncc(c1)O 62a_200000210301_100000754920 [2,0,0,0,0,0|1,1,0]=4 2655 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [2,0,0,0,0,0|2,0,0]=4 2656 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,0,0,0,0,0|2,0,0]=4 2657 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,0,0,0,0,0|2,0,0]=4 2658 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,0,0,0,0,0|1,0,0]=3 2659 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,0,0,0,0,0|1,0,0]=3 2660 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,0,0,0,0,0|1,1,0]=4 2661 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,0,0,0,0,0|1,1,0]=4 2662 B9R1.2 Cc1cncc(c1)O[13CH3] 34a_100011830280_200025704644 [2,0,0,0,0,0|2,0,0]=4 2663 B9R1.2 Cc1cncc(c1)O[13CH3] 7a_100011830280_200025704644 [2,0,0,0,0,0|2,0,0]=4 2664 B9R1.2 N#Cc1cccc(c1)O 271570a_203496583355_100000189340 [2,0,0,0,0,0|1,0,1]=4 2665 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,0,0,0,0,0|1,0,1]=4 2666 B9R1.2 NNc1cccc(c1)O 271570a_203496583355_100000217339 [2,0,0,0,0,0|2,0,0]=4 2667 B9R1.2 O=Cc1cc(ccn1)O 271570a_203496583355_100011998288 [2,0,0,0,0,0|1,0,0]=3 2668 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,0,0,0,0,0|0,0,0]=2 2669 B9R1.2 O=Cc1cccc(n1)O 271570a_203496583355_100000688028 [2,0,0,0,0,0|1,0,0]=3 2670 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [2,0,0,0,0,0|1,0,0]=3 2671 B9R1.2 O=Cc1cncc(c1)O 271570a_203496583355_100000687066 [2,0,0,0,0,0|1,0,0]=3 2672 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [2,0,0,0,0,0|0,0,2]=4 2673 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [2,0,0,0,0,0|1,0,1]=4 2674 B9R1.2 [13CH3]Nc1cccc(c1)Br 34a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 2675 B9R1.2 [13CH3]Nc1cccc(c1)Cl 34a_100000185859_200025704644 [2,0,0,0,0,0|2,0,0]=4 2676 B9R1.2 [13CH3]Nc1cccc(c1)F 34a_100000210047_200025704644 [2,0,0,0,0,0|2,0,0]=4 2677 B9R1.2 [13CH3]Nc1cccc(c1)I 34a_100000211102_200025704644 [2,0,0,0,0,0|2,0,0]=4 2678 B9R1.2 [13CH3]Nc1cccc(c1)O 34a_100000210217_200025704644 [2,0,0,0,0,0|1,0,0]=3 2679 B9R1.2 [13CH3]Oc1cc[nH]c(=O)c1 34a_100000032262_200025704644 [2,0,0,0,0,0|1,0,1]=4 2680 B9R1.2 [13CH3]Oc1ccc[n+](c1)[O-] 34a_100000039713_200025704644 [2,0,0,0,0,0|1,0,1]=4 2681 B9R1.2 [13CH3]Oc1ccc[n+](c1)[O-] 7a_100000039713_200025704644 [2,0,0,0,0,0|1,0,1]=4 2682 B9R1.2 [13CH3]Oc1cccc(=O)[nH]1 34a_100000033347_200025704644 [2,0,0,0,0,0|1,0,1]=4 2683 B9R1.2 [13CH3]Oc1cccc(c1)Br 34a_100000210342_200025704644 [2,0,0,0,0,0|1,0,0]=3 2684 B9R1.2 [13CH3]Oc1cccc(c1)Br 7a_100000210342_200025704644 [2,0,0,0,0,0|1,0,0]=3 2685 B9R1.2 [13CH3]Oc1cccc(c1)Cl 34a_100000210295_200025704644 [2,0,0,0,0,0|1,0,0]=3 2686 B9R1.2 [13CH3]Oc1cccc(c1)Cl 7a_100000210295_200025704644 [2,0,0,0,0,0|1,0,0]=3 2687 B9R1.2 [13CH3]Oc1cccc(c1)F 34a_100000210426_200025704644 [2,0,0,0,0,0|1,0,0]=3 2688 B9R1.2 [13CH3]Oc1cccc(c1)F 7a_100000210426_200025704644 [2,0,0,0,0,0|1,0,0]=3 2689 B9R1.2 [13CH3]Oc1cccc(c1)I 34a_100000211634_200025704644 [2,0,0,0,0,0|1,0,0]=3 2690 B9R1.2 [13CH3]Oc1cccc(c1)I 7a_100000211634_200025704644 [2,0,0,0,0,0|1,0,0]=3 2691 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,0,0,0,0,0|1,0,0]=3 2692 B9R1.2 [13CH3]Oc1cccc(n1)F 34a_100011432558_200025704644 [2,0,0,0,0,0|2,0,0]=4 2693 B9R1.2 [13CH3]Oc1ccnc(c1)Cl 34a_100000762945_200025704644 [2,0,0,0,0,0|2,0,0]=4 2694 B9R1.2 [13CH3]Oc1ccnc(c1)F 34a_100000732698_200025704644 [2,0,0,0,0,0|2,0,0]=4 2695 B9R1.2 [13CH3]Oc1ccnc(c1)N 34a_100011834064_200025704644 [2,0,0,0,0,0|2,0,0]=4 2696 B9R1.2 [13CH3]Oc1cncc(c1)Br 34a_100000754920_200025704644 [2,0,0,0,0,0|2,0,0]=4 2697 B9R1.2 [13CH3]Oc1cncc(c1)Br 7a_100000754920_200025704644 [2,0,0,0,0,0|2,0,0]=4 2698 B9R1.2 [13CH3]Oc1cncc(c1)Cl 7a_100000032511_200025704644 [2,0,0,0,0,0|2,0,0]=4 2699 B9R1.2 [13CH3]Oc1cncc(c1)F 34a_100011830296_200025704644 [2,0,0,0,0,0|2,0,0]=4 2700 B9R1.2 [13CH3]Oc1cncc(c1)F 7a_100011830296_200025704644 [2,0,0,0,0,0|2,0,0]=4 2701 B9R1.2 [13CH3]Oc1cncc(c1)N 34a_100011997051_200025704644 [2,0,0,0,0,0|2,0,0]=4 2702 B9R1.2 [13CH3]Sc1cc(ccn1)O 62a_200025704644_100000762945 [2,0,0,0,0,0|1,1,0]=4 2703 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_100000691529_200025704644 [2,0,0,0,0,0|1,1,0]=4 2704 B9R1.2 [13CH3]Sc1cccc(c1)Br 62a_200025704644_100000691529 [2,0,0,0,0,0|1,1,0]=4 2705 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_100000699651_200025704644 [2,0,0,0,0,0|1,1,0]=4 2706 B9R1.2 [13CH3]Sc1cccc(c1)Cl 62a_200025704644_100000699651 [2,0,0,0,0,0|1,1,0]=4 2707 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_100000685547_200025704644 [2,0,0,0,0,0|1,1,0]=4 2708 B9R1.2 [13CH3]Sc1cccc(c1)F 62a_200025704644_100000685547 [2,0,0,0,0,0|1,1,0]=4 2709 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,0,0,0,0,0|1,1,0]=4 2710 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,0,0,0,0,0|1,1,0]=4 2711 B9R1.2 [13CH3]Sc1cccc(c1)O 62a_200025704644_100000211634 [2,0,0,0,0,0|0,1,0]=3 2712 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_114929384022_200025704644 [2,0,0,0,0,0|0,2,0]=4 2713 B9R1.2 [13CH3]Sc1cccc(c1)[S] 62a_200025704644_114929384022 [2,0,0,0,0,0|0,2,0]=4 2714 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_100000754920_200025704644 [2,0,0,0,0,0|1,1,0]=4 2715 B9R1.2 [13CH3]Sc1cncc(c1)O 62a_200025704644_100000754920 [2,0,0,0,0,0|1,1,0]=4 2716 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [2,0,0,0,0,0|1,0,0]=3 2717 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [2,0,0,0,0,0|2,0,0]=4 2718 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [2,0,0,0,0,0|2,0,0]=4 2719 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [2,0,0,0,0,0|2,0,0]=4 2720 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [2,0,0,0,0,0|1,0,1]=4 2721 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [2,0,0,0,0,0|0,0,1]=3 2722 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [2,0,0,0,0,0|0,0,1]=3 2723 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [2,0,0,0,0,0|1,0,1]=4 2724 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [2,0,0,0,0,0|1,0,1]=4 2725 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [2,0,0,0,0,0|1,0,1]=4 2726 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [2,0,0,0,0,0|0,1,1]=4 2727 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [2,0,0,0,0,0|0,1,1]=4 2728 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [2,0,0,0,0,0|2,0,0]=4 2729 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [2,0,0,0,0,0|2,0,0]=4 2730 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [2,0,0,0,0,0|2,0,0]=4 2731 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [2,0,0,0,0,0|2,0,0]=4 2732 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [2,0,0,0,0,0|2,0,0]=4 2733 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [2,0,0,0,0,0|2,0,0]=4 2734 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [2,0,0,0,0,0|2,0,0]=4 2735 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [2,0,0,0,0,0|2,0,0]=4 2736 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [2,0,0,0,0,0|2,0,0]=4 2737 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [2,0,0,0,0,0|2,0,0]=4 2738 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [2,0,0,0,0,0|2,0,0]=4 2739 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [2,0,0,0,0,0|2,0,0]=4 2740 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [2,0,0,0,0,0|1,0,1]=4 2741 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [2,0,0,0,0,0|1,0,1]=4 2742 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [2,0,0,0,0,0|2,0,0]=4 2743 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [2,0,0,0,0,0|2,0,0]=4 2744 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [2,0,0,0,0,0|2,0,0]=4 2745 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [2,0,0,0,0,0|2,0,0]=4 2746 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [2,0,0,0,0,0|2,0,0]=4 2747 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [2,0,0,0,0,0|2,0,0]=4 2748 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [1,1,0,0,0,0|1,0,0]=3 2749 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [1,1,0,0,0,0|2,0,0]=4 2750 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [1,1,0,0,0,0|2,0,0]=4 2751 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [1,1,0,0,0,0|2,0,0]=4 2752 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [1,1,0,0,0,0|2,0,0]=4 2753 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [1,1,0,0,0,0|2,0,0]=4 2754 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [1,1,0,0,0,0|1,0,0]=3 2755 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [1,1,0,0,0,0|2,0,0]=4 2756 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [1,1,0,0,0,0|2,0,0]=4 2757 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [1,1,0,0,0,0|2,0,0]=4 2758 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [1,1,0,0,0,0|2,0,0]=4 2759 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [1,1,0,0,0,0|1,0,0]=3 2760 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [1,1,0,0,0,0|2,0,0]=4 2761 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [1,1,0,0,0,0|2,0,0]=4 2762 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [1,1,0,0,0,0|2,0,0]=4 2763 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [1,1,0,0,0,0|2,0,0]=4 2764 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [1,1,0,0,0,0|2,0,0]=4 2765 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [1,1,0,0,0,0|1,0,0]=3 2766 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [1,1,0,0,0,0|2,0,0]=4 2767 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [1,1,0,0,0,0|2,0,0]=4 2768 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [1,1,0,0,0,0|2,0,0]=4 2769 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [1,1,0,0,0,0|2,0,0]=4 2770 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [1,1,0,0,0,0|2,0,0]=4 2771 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [1,1,0,0,0,0|1,0,0]=3 2772 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [1,1,0,0,0,0|2,0,0]=4 2773 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [1,1,0,0,0,0|2,0,0]=4 2774 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [1,1,0,0,0,0|2,0,0]=4 2775 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [1,1,0,0,0,0|2,0,0]=4 2776 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [1,1,0,0,0,0|2,0,0]=4 2777 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [1,1,0,0,0,0|1,0,0]=3 2778 B11R1.13 CC=Cc1ccnc(c1C)O 271570a_100016259895_100009858498 [1,1,0,0,0,0|2,0,0]=4 2779 B11R1.13 CC=Cc1nccc(c1F)O 271570a_100016259895_100009876375 [1,1,0,0,0,0|2,0,0]=4 2780 B11R1.13 CC=Cc1nccc(c1N)O 271570a_100016259895_100000128729 [1,1,0,0,0,0|2,0,0]=4 2781 B11R1.13 CCNc1cccc(c1Br)O 34a_100012183704_100000210202 [1,1,0,0,0,0|1,0,1]=4 2782 B11R1.13 CCNc1cccc(c1Br)O 7a_100012183704_100000210202 [1,1,0,0,0,0|1,0,1]=4 2783 B11R1.13 CCNc1cccc(c1C)O 34a_100011216573_100000210202 [1,1,0,0,0,0|1,0,1]=4 2784 B11R1.13 CCNc1cccc(c1C)O 7a_100011216573_100000210202 [1,1,0,0,0,0|1,0,1]=4 2785 B11R1.13 CCNc1cccc(c1Cl)O 34a_100012002038_100000210202 [1,1,0,0,0,0|1,0,1]=4 2786 B11R1.13 CCNc1cccc(c1Cl)O 7a_100012002038_100000210202 [1,1,0,0,0,0|1,0,1]=4 2787 B11R1.13 CCOc1cccc(c1Br)Br 34a_100010187966_100000210202 [1,1,0,0,0,0|1,0,1]=4 2788 B11R1.13 CCOc1cccc(c1Br)Br 7a_100010187966_100000210202 [1,1,0,0,0,0|1,0,1]=4 2789 B11R1.13 CCOc1cccc(c1Br)C 34a_100000686692_100000210202 [1,1,0,0,0,0|1,0,1]=4 2790 B11R1.13 CCOc1cccc(c1Br)C 7a_100000686692_100000210202 [1,1,0,0,0,0|1,0,1]=4 2791 B11R1.13 CCOc1cccc(c1Br)Cl 34a_100012348804_100000210202 [1,1,0,0,0,0|1,0,1]=4 2792 B11R1.13 CCOc1cccc(c1Br)Cl 7a_100012348804_100000210202 [1,1,0,0,0,0|1,0,1]=4 2793 B11R1.13 CCOc1cccc(c1Br)F 34a_100009820682_100000210202 [1,1,0,0,0,0|1,0,1]=4 2794 B11R1.13 CCOc1cccc(c1Br)F 7a_100009820682_100000210202 [1,1,0,0,0,0|1,0,1]=4 2795 B11R1.13 CCOc1cccc(c1Br)I 34a_100010187914_100000210202 [1,1,0,0,0,0|1,0,1]=4 2796 B11R1.13 CCOc1cccc(c1Br)I 7a_100010187914_100000210202 [1,1,0,0,0,0|1,0,1]=4 2797 B11R1.13 CCOc1cccc(c1Br)N 34a_100012183704_100000210202 [1,1,0,0,0,0|1,0,1]=4 2798 B11R1.13 CCOc1cccc(c1Br)N 7a_100012183704_100000210202 [1,1,0,0,0,0|1,0,1]=4 2799 B11R1.13 CCOc1cccc(c1C)Br 34a_100012002258_100000210202 [1,1,0,0,0,0|1,0,1]=4 2800 B11R1.13 CCOc1cccc(c1C)Br 7a_100012002258_100000210202 [1,1,0,0,0,0|1,0,1]=4 2801 B11R1.13 CCOc1cccc(c1C)C 34a_100000185855_100000210202 [1,1,0,0,0,0|1,0,1]=4 2802 B11R1.13 CCOc1cccc(c1C)C 7a_100000185855_100000210202 [1,1,0,0,0,0|1,0,1]=4 2803 B11R1.13 CCOc1cccc(c1C)Cl 34a_100011265684_100000210202 [1,1,0,0,0,0|1,0,1]=4 2804 B11R1.13 CCOc1cccc(c1C)Cl 7a_100011265684_100000210202 [1,1,0,0,0,0|1,0,1]=4 2805 B11R1.13 CCOc1cccc(c1C)F 34a_100011217231_100000210202 [1,1,0,0,0,0|1,0,1]=4 2806 B11R1.13 CCOc1cccc(c1C)F 7a_100011217231_100000210202 [1,1,0,0,0,0|1,0,1]=4 2807 B11R1.13 CCOc1cccc(c1C)N 34a_100011216573_100000210202 [1,1,0,0,0,0|1,0,1]=4 2808 B11R1.13 CCOc1cccc(c1C)N 7a_100011216573_100000210202 [1,1,0,0,0,0|1,0,1]=4 2809 B11R1.13 CCOc1cccc(c1Cl)Br 34a_100010187913_100000210202 [1,1,0,0,0,0|1,0,1]=4 2810 B11R1.13 CCOc1cccc(c1Cl)Br 7a_100010187913_100000210202 [1,1,0,0,0,0|1,0,1]=4 2811 B11R1.13 CCOc1cccc(c1Cl)C 34a_100000695629_100000210202 [1,1,0,0,0,0|1,0,1]=4 2812 B11R1.13 CCOc1cccc(c1Cl)C 7a_100000695629_100000210202 [1,1,0,0,0,0|1,0,1]=4 2813 B11R1.13 CCOc1cccc(c1Cl)Cl 34a_100000211076_100000210202 [1,1,0,0,0,0|1,0,1]=4 2814 B11R1.13 CCOc1cccc(c1Cl)Cl 7a_100000211076_100000210202 [1,1,0,0,0,0|1,0,1]=4 2815 B11R1.13 CCOc1cccc(c1Cl)F 34a_100000087408_100000210202 [1,1,0,0,0,0|1,0,1]=4 2816 B11R1.13 CCOc1cccc(c1Cl)F 7a_100000087408_100000210202 [1,1,0,0,0,0|1,0,1]=4 2817 B11R1.13 CCOc1cccc(c1Cl)I 34a_100000049636_100000210202 [1,1,0,0,0,0|1,0,1]=4 2818 B11R1.13 CCOc1cccc(c1Cl)I 7a_100000049636_100000210202 [1,1,0,0,0,0|1,0,1]=4 2819 B11R1.13 CCOc1cccc(c1Cl)N 34a_100012002038_100000210202 [1,1,0,0,0,0|1,0,1]=4 2820 B11R1.13 CCOc1cccc(c1Cl)N 7a_100012002038_100000210202 [1,1,0,0,0,0|1,0,1]=4 2821 B11R1.13 CCOc1cccc(c1F)Br 34a_100009817021_100000210202 [1,1,0,0,0,0|1,0,1]=4 2822 B11R1.13 CCOc1cccc(c1F)Br 7a_100009817021_100000210202 [1,1,0,0,0,0|1,0,1]=4 2823 B11R1.13 CCOc1cccc(c1F)C 34a_100000751311_100000210202 [1,1,0,0,0,0|1,0,1]=4 2824 B11R1.13 CCOc1cccc(c1F)C 7a_100000751311_100000210202 [1,1,0,0,0,0|1,0,1]=4 2825 B11R1.13 CCOc1cccc(c1F)Cl 34a_100000687438_100000210202 [1,1,0,0,0,0|1,0,1]=4 2826 B11R1.13 CCOc1cccc(c1F)Cl 7a_100000687438_100000210202 [1,1,0,0,0,0|1,0,1]=4 2827 B11R1.13 CCOc1cccc(c1F)F 34a_100000751161_100000210202 [1,1,0,0,0,0|1,0,1]=4 2828 B11R1.13 CCOc1cccc(c1F)F 7a_100000751161_100000210202 [1,1,0,0,0,0|1,0,1]=4 2829 B11R1.13 CCOc1cccc(c1I)Br 34a_100010187912_100000210202 [1,1,0,0,0,0|1,0,1]=4 2830 B11R1.13 CCOc1cccc(c1I)Br 7a_100010187912_100000210202 [1,1,0,0,0,0|1,0,1]=4 2831 B11R1.13 CCOc1cccc(c1I)C 34a_100010083724_100000210202 [1,1,0,0,0,0|1,0,1]=4 2832 B11R1.13 CCOc1cccc(c1I)C 7a_100010083724_100000210202 [1,1,0,0,0,0|1,0,1]=4 2833 B11R1.13 CCOc1cccc(c1I)Cl 34a_100000050174_100000210202 [1,1,0,0,0,0|1,0,1]=4 2834 B11R1.13 CCOc1cccc(c1I)Cl 7a_100000050174_100000210202 [1,1,0,0,0,0|1,0,1]=4 2835 B11R1.13 CCOc1cccc(c1I)F 34a_100000690913_100000210202 [1,1,0,0,0,0|1,0,1]=4 2836 B11R1.13 CCOc1cccc(c1I)F 7a_100000690913_100000210202 [1,1,0,0,0,0|1,0,1]=4 2837 B11R1.13 CCOc1cccc(c1N)Br 34a_100011934926_100000210202 [1,1,0,0,0,0|1,0,1]=4 2838 B11R1.13 CCOc1cccc(c1N)Br 7a_100011934926_100000210202 [1,1,0,0,0,0|1,0,1]=4 2839 B11R1.13 CCOc1cccc(c1N)C 34a_100000743429_100000210202 [1,1,0,0,0,0|1,0,1]=4 2840 B11R1.13 CCOc1cccc(c1N)C 7a_100000743429_100000210202 [1,1,0,0,0,0|1,0,1]=4 2841 B11R1.13 CCOc1cccc(c1N)Cl 34a_100012022510_100000210202 [1,1,0,0,0,0|1,0,1]=4 2842 B11R1.13 CCOc1cccc(c1N)Cl 7a_100012022510_100000210202 [1,1,0,0,0,0|1,0,1]=4 2843 B11R1.13 CCOc1cccc(c1N)F 34a_100020591140_100000210202 [1,1,0,0,0,0|1,0,1]=4 2844 B11R1.13 CCOc1cccc(c1N)F 7a_100020591140_100000210202 [1,1,0,0,0,0|1,0,1]=4 2845 B11R1.13 CCOc1cccc(c1N)I 34a_200000049512_100000210202 [1,1,0,0,0,0|1,0,1]=4 2846 B11R1.13 CCOc1cccc(c1N)I 7a_200000049512_100000210202 [1,1,0,0,0,0|1,0,1]=4 2847 B11R1.13 CCOc1cccc(c1N)N 34a_100000033209_100000210202 [1,1,0,0,0,0|1,0,1]=4 2848 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [1,1,0,0,0,0|0,0,1]=3 2849 B11R1.13 CCSc1cccc(c1Br)O 62a_100000210202_100010187914 [1,1,0,0,0,0|0,1,1]=4 2850 B11R1.13 CCSc1cccc(c1Br)O 62a_100010187914_100000210202 [1,1,0,0,0,0|0,1,1]=4 2851 B11R1.13 CCSc1cccc(c1C)O 62a_100000210202_100012002258 [1,1,0,0,0,0|0,1,1]=4 2852 B11R1.13 CCSc1cccc(c1C)O 62a_100012002258_100000210202 [1,1,0,0,0,0|0,1,1]=4 2853 B11R1.13 CCSc1cccc(c1Cl)O 62a_100000210202_100000049636 [1,1,0,0,0,0|0,1,1]=4 2854 B11R1.13 CCSc1cccc(c1F)O 62a_100000210202_100009817021 [1,1,0,0,0,0|0,1,1]=4 2855 B11R1.13 CCSc1cccc(c1F)O 62a_100009817021_100000210202 [1,1,0,0,0,0|0,1,1]=4 2856 B11R1.13 CCSc1cccc(c1N)O 62a_100000210202_100011934926 [1,1,0,0,0,0|0,1,1]=4 2857 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [1,1,0,0,0,0|0,1,1]=4 2858 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [1,1,0,0,0,0|2,0,0]=4 2859 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [1,1,0,0,0,0|2,0,0]=4 2860 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [1,1,0,0,0,0|2,0,0]=4 2861 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [1,1,0,0,0,0|2,0,0]=4 2862 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [1,1,0,0,0,0|2,0,0]=4 2863 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [1,1,0,0,0,0|2,0,0]=4 2864 B11R1.23 CC(N[13CH3])c1cccc(c1)O 2230a_100000740644_200025704644 [1,1,0,0,0,0|2,0,0]=4 2865 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [1,1,0,0,0,0|1,0,1]=4 2866 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [1,1,0,0,0,0|1,0,1]=4 2867 B11R1.23 CCC(O)c1cccc(c1)O 271570a_203496583355_200013212081 [1,1,0,0,0,0|1,0,1]=4 2868 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000717746_200000210301 [1,1,0,0,0,0|1,0,1]=4 2869 B11R1.23 CCN(C)c1cccc(c1)O 2230a_100000756613_100000210202 [1,1,0,0,0,0|1,0,1]=4 2870 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000717746_200000210301 [1,1,0,0,0,0|1,0,1]=4 2871 B11R1.23 CCN(C)c1cccc(c1)O 269982a_100000756613_100000204670 [1,1,0,0,0,0|1,0,1]=4 2872 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000717746_200000210301 [1,1,0,0,0,0|1,0,1]=4 2873 B11R1.23 CCN(C)c1cccc(c1)O 34a_100000756613_100000210202 [1,1,0,0,0,0|1,0,1]=4 2874 B11R1.23 CCN([13CH3])c1cccc(c1)O 2230a_100000717746_200025704644 [1,1,0,0,0,0|1,0,1]=4 2875 B11R1.23 CCN([13CH3])c1cccc(c1)O 269982a_100000717746_200025704644 [1,1,0,0,0,0|1,0,1]=4 2876 B11R1.23 CCN([13CH3])c1cccc(c1)O 34a_100000717746_200025704644 [1,1,0,0,0,0|1,0,1]=4 2877 B11R1.23 CC[C@H](N)c1cccc(c1)O 271570a_203496583355_100102422761 [1,1,0,0,0,0|1,0,1]=4 2878 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [1,1,0,0,0,0|2,0,0]=4 2879 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [1,1,0,0,0,0|2,0,0]=4 2880 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [1,1,0,0,0,0|2,0,0]=4 2881 B11R1.23 CNC(C)c1cccc(c1)O 2230a_100000740644_200000210301 [1,1,0,0,0,0|2,0,0]=4 2882 B11R1.23 CNC(C)c1cccc(c1)O 269862a_106832991636_100000211620 [1,1,0,0,0,0|2,0,0]=4 2883 B11R1.23 CNC(C)c1cccc(c1)O 271570a_203496583355_100025717457 [1,1,0,0,0,0|2,0,0]=4 2884 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [1,1,0,0,0,0|2,0,0]=4 2885 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [1,1,0,0,0,0|1,0,0]=3 2886 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [1,1,0,0,0,0|1,0,1]=4 2887 B11R1.24 C=CCOc1cccc(c1)Br 34a_100000210342_100015514636 [1,1,0,0,0,0|1,0,1]=4 2888 B11R1.24 C=CCOc1cccc(c1)Br 7a_100000210342_100015514636 [1,1,0,0,0,0|1,0,1]=4 2889 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [1,1,0,0,0,0|1,0,1]=4 2890 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [1,1,0,0,0,0|1,0,1]=4 2891 B11R1.24 C=CCOc1cccc(c1)Cl 34a_100000210295_100015514636 [1,1,0,0,0,0|1,0,1]=4 2892 B11R1.24 C=CCOc1cccc(c1)Cl 7a_100000210295_100015514636 [1,1,0,0,0,0|1,0,1]=4 2893 B11R1.24 C=CCOc1cccc(c1)F 34a_100000210426_100015514636 [1,1,0,0,0,0|1,0,1]=4 2894 B11R1.24 C=CCOc1cccc(c1)F 7a_100000210426_100015514636 [1,1,0,0,0,0|1,0,1]=4 2895 B11R1.24 C=CCOc1cccc(c1)I 34a_100000211634_100015514636 [1,1,0,0,0,0|1,0,1]=4 2896 B11R1.24 C=CCOc1cccc(c1)I 7a_100000211634_100015514636 [1,1,0,0,0,0|1,0,1]=4 2897 B11R1.24 C=CCOc1cccc(c1)N 34a_100000210217_100015514636 [1,1,0,0,0,0|1,0,1]=4 2898 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [1,1,0,0,0,0|0,1,1]=4 2899 B11R1.24 CC=NNc1cccc(c1)Br 4a_100000217339_200000210099 [1,1,0,0,0,0|2,0,0]=4 2900 B11R1.24 CC=NNc1cccc(c1)C 4a_100000681630_200000210099 [1,1,0,0,0,0|2,0,0]=4 2901 B11R1.24 CC=NNc1cccc(c1)Cl 4a_100000184277_200000210099 [1,1,0,0,0,0|2,0,0]=4 2902 B11R1.24 CC=NNc1cccc(c1)F 4a_100000745080_200000210099 [1,1,0,0,0,0|2,0,0]=4 2903 B11R1.24 CC=NNc1cccc(c1)I 4a_100020605690_200000210099 [1,1,0,0,0,0|2,0,0]=4 2904 B11R1.24 CCCCc1cccc(c1)O 271570a_100020621405_100000211634 [1,1,0,0,0,0|1,0,1]=4 2905 B11R1.24 CCCCc1cccc(c1)O 271570a_203496583355_200010244551 [1,1,0,0,0,0|1,0,1]=4 2906 B11R1.24 CCCNc1cccc(c1)O 34a_100000210217_100000210303 [1,1,0,0,0,0|1,0,1]=4 2907 B11R1.24 CCCOc1cccc(c1)Br 34a_100000210342_100000210303 [1,1,0,0,0,0|1,0,1]=4 2908 B11R1.24 CCCOc1cccc(c1)Br 7a_100000210342_100000210303 [1,1,0,0,0,0|1,0,1]=4 2909 B11R1.24 CCCOc1cccc(c1)C 34a_100000210337_100000210303 [1,1,0,0,0,0|1,0,1]=4 2910 B11R1.24 CCCOc1cccc(c1)C 7a_100000210337_100000210303 [1,1,0,0,0,0|1,0,1]=4 2911 B11R1.24 CCCOc1cccc(c1)Cl 34a_100000210295_100000210303 [1,1,0,0,0,0|1,0,1]=4 2912 B11R1.24 CCCOc1cccc(c1)Cl 7a_100000210295_100000210303 [1,1,0,0,0,0|1,0,1]=4 2913 B11R1.24 CCCOc1cccc(c1)F 34a_100000210426_100000210303 [1,1,0,0,0,0|1,0,1]=4 2914 B11R1.24 CCCOc1cccc(c1)F 7a_100000210426_100000210303 [1,1,0,0,0,0|1,0,1]=4 2915 B11R1.24 CCCOc1cccc(c1)I 34a_100000211634_100000210303 [1,1,0,0,0,0|1,0,1]=4 2916 B11R1.24 CCCOc1cccc(c1)I 7a_100000211634_100000210303 [1,1,0,0,0,0|1,0,1]=4 2917 B11R1.24 CCCOc1cccc(c1)N 34a_100000210217_100000210303 [1,1,0,0,0,0|1,0,1]=4 2918 B11R1.24 CCCOc1cccc(c1)O 271570a_203496583355_100000170004 [1,1,0,0,0,0|0,0,1]=3 2919 B11R1.24 CCCOc1cccc(n1)O 271570a_203496583355_200011960250 [1,1,0,0,0,0|1,0,1]=4 2920 B11R1.24 CCCOc1cncc(c1)O 271570a_203496583355_200012029621 [1,1,0,0,0,0|1,0,1]=4 2921 B11R1.24 CCCSc1cccc(c1)O 271570a_203496583355_200009815762 [1,1,0,0,0,0|0,1,1]=4 2922 B11R1.24 CCCSc1cccc(c1)O 62a_100000210303_100000211634 [1,1,0,0,0,0|0,1,1]=4 2923 B11R1.24 CCNCc1cccc(c1)O 207a_100015525214_100000188321 [1,1,0,0,0,0|1,0,1]=4 2924 B11R1.24 CCNCc1cccc(c1)O 2230a_100000743036_100000210202 [1,1,0,0,0,0|1,0,1]=4 2925 B11R1.24 CCNCc1cccc(c1)O 2230a_100015525214_100011660834 [1,1,0,0,0,0|1,0,1]=4 2926 B11R1.24 CCNCc1cccc(c1)O 270004a_100015525214_100000188321 [1,1,0,0,0,0|1,0,1]=4 2927 B11R1.24 CCNCc1cccc(c1)O 271570a_203496583355_100000187426 [1,1,0,0,0,0|1,0,1]=4 2928 B11R1.24 CCNCc1cccc(c1)O 34a_100000743036_100000210202 [1,1,0,0,0,0|1,0,1]=4 2929 B11R1.24 CCOCc1cccc(c1)Br 34a_100000687537_100000210202 [1,1,0,0,0,0|1,0,1]=4 2930 B11R1.24 CCOCc1cccc(c1)Br 34a_100121572206_100000698116 [1,1,0,0,0,0|1,0,1]=4 2931 B11R1.24 CCOCc1cccc(c1)Br 7a_100000687537_100000210202 [1,1,0,0,0,0|1,0,1]=4 2932 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [1,1,0,0,0,0|1,0,1]=4 2933 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [1,1,0,0,0,0|1,0,1]=4 2934 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [1,1,0,0,0,0|1,0,1]=4 2935 B11R1.24 CCOCc1cccc(c1)Cl 34a_100000241301_100000210202 [1,1,0,0,0,0|1,0,1]=4 2936 B11R1.24 CCOCc1cccc(c1)Cl 34a_100121572206_100000187163 [1,1,0,0,0,0|1,0,1]=4 2937 B11R1.24 CCOCc1cccc(c1)Cl 7a_100000241301_100000210202 [1,1,0,0,0,0|1,0,1]=4 2938 B11R1.24 CCOCc1cccc(c1)F 34a_100000210976_100000210202 [1,1,0,0,0,0|1,0,1]=4 2939 B11R1.24 CCOCc1cccc(c1)F 34a_100121572206_100000187166 [1,1,0,0,0,0|1,0,1]=4 2940 B11R1.24 CCOCc1cccc(c1)F 7a_100000210976_100000210202 [1,1,0,0,0,0|1,0,1]=4 2941 B11R1.24 CCOCc1cccc(c1)I 34a_100011215336_100000210202 [1,1,0,0,0,0|1,0,1]=4 2942 B11R1.24 CCOCc1cccc(c1)I 34a_100121572206_100011218688 [1,1,0,0,0,0|1,0,1]=4 2943 B11R1.24 CCOCc1cccc(c1)I 7a_100011215336_100000210202 [1,1,0,0,0,0|1,0,1]=4 2944 B11R1.24 CCOCc1cccc(c1)N 34a_100000211919_100000210202 [1,1,0,0,0,0|1,0,1]=4 2945 B11R1.24 CCOCc1cccc(c1)O 271570a_203496583355_100011493694 [1,1,0,0,0,0|0,0,1]=3 2946 B11R1.24 CCOCc1cccc(c1)O 34a_100121572206_100011660834 [1,1,0,0,0,0|0,0,1]=3 2947 B11R1.24 CCSCc1cccc(c1)O 62a_100000210202_100011660834 [1,1,0,0,0,0|0,1,1]=4 2948 B11R1.24 CCSCc1cccc(c1)O 62a_100011660834_100000210202 [1,1,0,0,0,0|0,1,1]=4 2949 B11R1.24 CNCCc1cccc(c1)O 2230a_100000747277_200000210301 [1,1,0,0,0,0|1,0,1]=4 2950 B11R1.24 CNCCc1cccc(c1)O 34a_100000747277_200000210301 [1,1,0,0,0,0|1,0,1]=4 2951 B11R1.24 COCOc1cccc(c1)O 271570a_203496583355_100012265688 [1,1,0,0,0,0|0,0,1]=3 2952 B11R1.24 COCSc1cccc(c1)O 62a_100000766300_100000211634 [1,1,0,0,0,0|0,1,1]=4 2953 B11R1.24 CSCNc1cccc(c1)O 34a_100000210217_100011218213 [1,1,0,0,0,0|1,0,1]=4 2954 B11R1.24 CSCOc1cccc(c1)Br 34a_100000210342_100011218213 [1,1,0,0,0,0|1,0,1]=4 2955 B11R1.24 CSCOc1cccc(c1)C 34a_100000210337_100011218213 [1,1,0,0,0,0|1,0,1]=4 2956 B11R1.24 CSCOc1cccc(c1)Cl 34a_100000210295_100011218213 [1,1,0,0,0,0|1,0,1]=4 2957 B11R1.24 CSCOc1cccc(c1)F 34a_100000210426_100011218213 [1,1,0,0,0,0|1,0,1]=4 2958 B11R1.24 CSCOc1cccc(c1)I 34a_100000211634_100011218213 [1,1,0,0,0,0|1,0,1]=4 2959 B11R1.24 CSCOc1cccc(c1)N 34a_100000210217_100011218213 [1,1,0,0,0,0|1,0,1]=4 2960 B11R1.24 CSCSc1cccc(c1)O 62a_100011218213_100000211634 [1,1,0,0,0,0|0,1,1]=4 2961 B11R1.24 Cc1cc(ccn1)OCC=O 34a_100000688365_200009817547 [1,1,0,0,0,0|2,0,0]=4 2962 B11R1.24 Cc1cccc(c1)NCC=O 2230a_100000188690_200015260668 [1,1,0,0,0,0|2,0,0]=4 2963 B11R1.24 Cc1cccc(c1)NCC=O 34a_100000188690_200009817547 [1,1,0,0,0,0|2,0,0]=4 2964 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [1,1,0,0,0,0|1,0,0]=3 2965 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [1,1,0,0,0,0|1,0,0]=3 2966 B11R1.24 Cc1cccc(c1)OCCF 34a_100000210337_100011217306 [1,1,0,0,0,0|1,0,1]=4 2967 B11R1.24 Cc1cccc(c1)OCCF 7a_100000210337_100011217306 [1,1,0,0,0,0|1,0,1]=4 2968 B11R1.24 Cc1cccc(c1)OCCO 34a_100000210337_100000211926 [1,1,0,0,0,0|1,0,1]=4 2969 B11R1.24 Cc1cccc(c1)OCCO 7a_100000210337_100000211926 [1,1,0,0,0,0|1,0,1]=4 2970 B11R1.24 Cc1cccc(c1)SCC=O 62a_100011215228_200015260668 [1,1,0,0,0,0|1,1,0]=4 2971 B11R1.24 Cc1cccc(c1)SCC=O 62a_200015260668_100011215228 [1,1,0,0,0,0|1,1,0]=4 2972 B11R1.24 Cc1cncc(c1)OCC=O 34a_100011830280_200009817547 [1,1,0,0,0,0|2,0,0]=4 2973 B11R1.24 Cc1cncc(c1)OCC=O 7a_100011830280_200015260668 [1,1,0,0,0,0|2,0,0]=4 2974 B11R1.24 FCCOc1cccc(c1)Br 34a_100000210342_100011217306 [1,1,0,0,0,0|1,0,1]=4 2975 B11R1.24 FCCOc1cccc(c1)Br 7a_100000210342_100011217306 [1,1,0,0,0,0|1,0,1]=4 2976 B11R1.24 FCCOc1cccc(c1)Cl 34a_100000210295_100011217306 [1,1,0,0,0,0|1,0,1]=4 2977 B11R1.24 FCCOc1cccc(c1)Cl 7a_100000210295_100011217306 [1,1,0,0,0,0|1,0,1]=4 2978 B11R1.24 FCCOc1cccc(c1)F 34a_100000210426_100011217306 [1,1,0,0,0,0|1,0,1]=4 2979 B11R1.24 FCCOc1cccc(c1)F 7a_100000210426_100011217306 [1,1,0,0,0,0|1,0,1]=4 2980 B11R1.24 FCCOc1cccc(c1)I 34a_100000211634_100011217306 [1,1,0,0,0,0|1,0,1]=4 2981 B11R1.24 FCCOc1cccc(c1)I 7a_100000211634_100011217306 [1,1,0,0,0,0|1,0,1]=4 2982 B11R1.24 N#CCOc1cccc(c1)O 271570a_203496583355_200000169433 [1,1,0,0,0,0|0,0,2]=4 2983 B11R1.24 NCCCc1cccc(c1)O 271570a_203496583355_100000753791 [1,1,0,0,0,0|1,0,1]=4 2984 B11R1.24 NCCOc1cccc(c1)O 271570a_203496583355_100000743521 [1,1,0,0,0,0|0,0,1]=3 2985 B11R1.24 Nc1cc(ccn1)OCC=O 34a_100011834064_200009817547 [1,1,0,0,0,0|2,0,0]=4 2986 B11R1.24 Nc1cccc(c1)OCC=O 34a_100000210217_200009817547 [1,1,0,0,0,0|1,0,0]=3 2987 B11R1.24 Nc1cccc(c1)OCCF 34a_100000210217_100011217306 [1,1,0,0,0,0|1,0,1]=4 2988 B11R1.24 Nc1cccc(c1)OCCO 34a_100000210217_100000211926 [1,1,0,0,0,0|1,0,1]=4 2989 B11R1.24 Nc1cccc(c1)SCC=O 62a_100000210019_200015260668 [1,1,0,0,0,0|1,1,0]=4 2990 B11R1.24 Nc1cccc(c1)SCC=O 62a_200015260668_100000210019 [1,1,0,0,0,0|1,1,0]=4 2991 B11R1.24 Nc1cncc(c1)OCC=O 34a_100011997051_200009817547 [1,1,0,0,0,0|2,0,0]=4 2992 B11R1.24 O=CCNc1cccc(c1)Br 34a_100000210019_200009817547 [1,1,0,0,0,0|2,0,0]=4 2993 B11R1.24 O=CCNc1cccc(c1)Cl 34a_100000185859_200009817547 [1,1,0,0,0,0|2,0,0]=4 2994 B11R1.24 O=CCNc1cccc(c1)F 34a_100000210047_200009817547 [1,1,0,0,0,0|2,0,0]=4 2995 B11R1.24 O=CCNc1cccc(c1)I 34a_100000211102_200009817547 [1,1,0,0,0,0|2,0,0]=4 2996 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [1,1,0,0,0,0|1,0,0]=3 2997 B11R1.24 O=CCOc1cc[nH]c(=O)c1 34a_100000032262_200009817547 [1,1,0,0,0,0|1,0,1]=4 2998 B11R1.24 O=CCOc1ccc[n+](c1)[O-] 34a_100000039713_200009817547 [1,1,0,0,0,0|1,0,1]=4 2999 B11R1.24 O=CCOc1ccc[n+](c1)[O-] 7a_100000039713_200015260668 [1,1,0,0,0,0|1,0,1]=4 3000 B11R1.24 O=CCOc1cccc(=O)[nH]1 34a_100000033347_200009817547 [1,1,0,0,0,0|1,0,1]=4 3001 B11R1.24 O=CCOc1cccc(c1)Br 34a_100000210342_200009817547 [1,1,0,0,0,0|1,0,0]=3 3002 B11R1.24 O=CCOc1cccc(c1)Br 7a_100000210342_200015260668 [1,1,0,0,0,0|1,0,0]=3 3003 B11R1.24 O=CCOc1cccc(c1)Cl 34a_100000210295_200009817547 [1,1,0,0,0,0|1,0,0]=3 3004 B11R1.24 O=CCOc1cccc(c1)Cl 7a_100000210295_200015260668 [1,1,0,0,0,0|1,0,0]=3 3005 B11R1.24 O=CCOc1cccc(c1)F 34a_100000210426_200009817547 [1,1,0,0,0,0|1,0,0]=3 3006 B11R1.24 O=CCOc1cccc(c1)F 7a_100000210426_200015260668 [1,1,0,0,0,0|1,0,0]=3 3007 B11R1.24 O=CCOc1cccc(c1)I 34a_100000211634_200009817547 [1,1,0,0,0,0|1,0,0]=3 3008 B11R1.24 O=CCOc1cccc(c1)I 7a_100000211634_200015260668 [1,1,0,0,0,0|1,0,0]=3 3009 B11R1.24 O=CCOc1cccc(n1)F 34a_100011432558_200009817547 [1,1,0,0,0,0|2,0,0]=4 3010 B11R1.24 O=CCOc1ccnc(c1)Cl 34a_100000762945_200009817547 [1,1,0,0,0,0|2,0,0]=4 3011 B11R1.24 O=CCOc1ccnc(c1)F 34a_100000732698_200009817547 [1,1,0,0,0,0|2,0,0]=4 3012 B11R1.24 O=CCOc1cncc(c1)Br 34a_100000754920_200009817547 [1,1,0,0,0,0|2,0,0]=4 3013 B11R1.24 O=CCOc1cncc(c1)Br 7a_100000754920_200015260668 [1,1,0,0,0,0|2,0,0]=4 3014 B11R1.24 O=CCOc1cncc(c1)Cl 7a_100000032511_200015260668 [1,1,0,0,0,0|2,0,0]=4 3015 B11R1.24 O=CCOc1cncc(c1)F 34a_100011830296_200009817547 [1,1,0,0,0,0|2,0,0]=4 3016 B11R1.24 O=CCOc1cncc(c1)F 7a_100011830296_200015260668 [1,1,0,0,0,0|2,0,0]=4 3017 B11R1.24 O=CCSc1cc(ccn1)O 62a_200015260668_100000762945 [1,1,0,0,0,0|1,1,0]=4 3018 B11R1.24 O=CCSc1cccc(c1)Br 62a_100000691529_200015260668 [1,1,0,0,0,0|1,1,0]=4 3019 B11R1.24 O=CCSc1cccc(c1)Br 62a_200015260668_100000691529 [1,1,0,0,0,0|1,1,0]=4 3020 B11R1.24 O=CCSc1cccc(c1)Cl 62a_100000699651_200015260668 [1,1,0,0,0,0|1,1,0]=4 3021 B11R1.24 O=CCSc1cccc(c1)Cl 62a_200015260668_100000699651 [1,1,0,0,0,0|1,1,0]=4 3022 B11R1.24 O=CCSc1cccc(c1)F 62a_100000685547_200015260668 [1,1,0,0,0,0|1,1,0]=4 3023 B11R1.24 O=CCSc1cccc(c1)F 62a_200015260668_100000685547 [1,1,0,0,0,0|1,1,0]=4 3024 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [1,1,0,0,0,0|0,1,0]=3 3025 B11R1.24 O=CCSc1cccc(c1)[S] 62a_114929384022_200015260668 [1,1,0,0,0,0|0,2,0]=4 3026 B11R1.24 O=CCSc1cccc(c1)[S] 62a_200015260668_114929384022 [1,1,0,0,0,0|0,2,0]=4 3027 B11R1.24 O=CCSc1cncc(c1)O 62a_100000754920_200015260668 [1,1,0,0,0,0|1,1,0]=4 3028 B11R1.24 O=CCSc1cncc(c1)O 62a_200015260668_100000754920 [1,1,0,0,0,0|1,1,0]=4 3029 B11R1.24 O=CNNc1cccc(n1)O 271570a_203496583355_200000117525 [1,1,0,0,0,0|2,0,0]=4 3030 B11R1.24 OCC#Cc1cccc(c1)O 271570a_203496583355_100009814051 [1,1,0,0,0,0|1,0,1]=4 3031 B11R1.24 OCCCc1cccc(c1)O 271570a_203496583355_100011709248 [1,1,0,0,0,0|1,0,1]=4 3032 B11R1.24 OCCNc1cccc(c1)O 34a_100000210217_100000211926 [1,1,0,0,0,0|1,0,1]=4 3033 B11R1.24 OCCOc1cccc(c1)Br 34a_100000210342_100000211926 [1,1,0,0,0,0|1,0,1]=4 3034 B11R1.24 OCCOc1cccc(c1)Br 7a_100000210342_100000211926 [1,1,0,0,0,0|1,0,1]=4 3035 B11R1.24 OCCOc1cccc(c1)Cl 34a_100000210295_100000211926 [1,1,0,0,0,0|1,0,1]=4 3036 B11R1.24 OCCOc1cccc(c1)Cl 7a_100000210295_100000211926 [1,1,0,0,0,0|1,0,1]=4 3037 B11R1.24 OCCOc1cccc(c1)F 34a_100000210426_100000211926 [1,1,0,0,0,0|1,0,1]=4 3038 B11R1.24 OCCOc1cccc(c1)F 7a_100000210426_100000211926 [1,1,0,0,0,0|1,0,1]=4 3039 B11R1.24 OCCOc1cccc(c1)I 34a_100000211634_100000211926 [1,1,0,0,0,0|1,0,1]=4 3040 B11R1.24 OCCOc1cccc(c1)I 7a_100000211634_100000211926 [1,1,0,0,0,0|1,0,1]=4 3041 B11R1.24 OCCOc1cccc(c1)O 271570a_203496583355_100000757546 [1,1,0,0,0,0|0,0,1]=3 3042 B11R1.24 OCCSc1cccc(c1)O 271570a_203496583355_200011756134 [1,1,0,0,0,0|0,1,1]=4 3043 B11R1.24 OCCSc1cccc(c1)O 62a_100000211926_100000211634 [1,1,0,0,0,0|0,1,1]=4 3044 B11R1.24 Oc1cccc(c1)CNCF 34a_100000743036_100015361967 [1,1,0,0,0,0|2,0,0]=4 3045 B11R1.24 Oc1cccc(c1)CSCF 62a_100011660834_100015361967 [1,1,0,0,0,0|2,0,0]=4 3046 B11R1.24 Oc1cccc(c1)CSCF 62a_100015361967_100011660834 [1,1,0,0,0,0|2,0,0]=4 3047 B11R1.24 Oc1cccc(c1)NCCF 34a_100000210217_100011217306 [1,1,0,0,0,0|1,0,1]=4 3048 B11R1.24 Oc1cccc(c1)SCCF 62a_100011217306_100000211634 [1,1,0,0,0,0|0,1,1]=4 3049 B11R1.24 [13CH3]NCCc1cccc(c1)O 2230a_100000747277_200025704644 [1,1,0,0,0,0|1,0,1]=4 3050 B11R1.24 [13CH3]NCCc1cccc(c1)O 34a_100000747277_200025704644 [1,1,0,0,0,0|1,0,1]=4 3051 B11R1.34 CC=Cc1cc(cc(c1)Br)Br 271570a_100016259895_100009814770 [1,1,0,0,0,0|2,0,0]=4 3052 B11R1.34 CC=Cc1cc(cc(c1)Br)Cl 271570a_100016259895_100009814755 [1,1,0,0,0,0|2,0,0]=4 3053 B11R1.34 CC=Cc1cc(cc(c1)Br)F 271570a_100016259895_100009814764 [1,1,0,0,0,0|2,0,0]=4 3054 B11R1.34 CC=Cc1cc(cc(c1)Br)N 271570a_100016259895_100009814763 [1,1,0,0,0,0|2,0,0]=4 3055 B11R1.34 CC=Cc1cc(cc(c1)Br)O 271570a_100016259895_100010068917 [1,1,0,0,0,0|1,0,0]=3 3056 B11R1.34 CC=Cc1cc(cc(c1)C)C 271570a_100016259895_100011215608 [1,1,0,0,0,0|2,0,0]=4 3057 B11R1.34 CC=Cc1cc(cc(c1)Cl)C 271570a_100016259895_100010172791 [1,1,0,0,0,0|2,0,0]=4 3058 B11R1.34 CC=Cc1cc(cc(c1)Cl)Cl 271570a_100016259895_100000747138 [1,1,0,0,0,0|2,0,0]=4 3059 B11R1.34 CC=Cc1cc(cc(c1)Cl)F 271570a_100016259895_100013859453 [1,1,0,0,0,0|2,0,0]=4 3060 B11R1.34 CC=Cc1cc(cc(c1)Cl)N 271570a_100016259895_100010147676 [1,1,0,0,0,0|2,0,0]=4 3061 B11R1.34 CC=Cc1cc(cc(c1)Cl)O 271570a_100016259895_100010068924 [1,1,0,0,0,0|1,0,0]=3 3062 B11R1.34 CC=Cc1cc(cc(c1)F)C 271570a_100016259895_100011356977 [1,1,0,0,0,0|2,0,0]=4 3063 B11R1.34 CC=Cc1cc(cc(c1)F)F 271570a_100016259895_100011218498 [1,1,0,0,0,0|2,0,0]=4 3064 B11R1.34 CC=Cc1cc(cc(c1)F)N 271570a_100016259895_100011356972 [1,1,0,0,0,0|2,0,0]=4 3065 B11R1.34 CC=Cc1cc(cc(c1)F)O 271570a_100016259895_100000717995 [1,1,0,0,0,0|1,0,0]=3 3066 B11R1.34 CC=Cc1cc(cc(c1)N)C 271570a_100016259895_100000695972 [1,1,0,0,0,0|2,0,0]=4 3067 B11R1.34 CC=Cc1cc(cc(c1)N)N 271570a_100016259895_100011999608 [1,1,0,0,0,0|2,0,0]=4 3068 B11R1.34 CC=Cc1cc(cc(c1)O)C 271570a_100016259895_100011999630 [1,1,0,0,0,0|1,0,0]=3 3069 B11R1.34 CC=Cc1cc(cc(c1)O)O 271570a_100016259895_100009868816 [1,1,0,0,0,0|1,0,0]=3 3070 B11R1.34 CCNc1cc(cc(c1)Cl)O 34a_100000123917_100000210202 [1,1,0,0,0,0|1,0,1]=4 3071 B11R1.34 CCNc1cc(cc(c1)Cl)O 7a_100000123917_100000210202 [1,1,0,0,0,0|1,0,1]=4 3072 B11R1.34 CCNc1cc(cc(c1)O)C 34a_100011995906_100000210202 [1,1,0,0,0,0|1,0,1]=4 3073 B11R1.34 CCNc1cc(cc(c1)O)C 7a_100011995906_100000210202 [1,1,0,0,0,0|1,0,1]=4 3074 B11R1.34 CCNc1cc(cc(c1)O)O 34a_100000043371_100000210202 [1,1,0,0,0,0|1,0,1]=4 3075 B11R1.34 CCOc1cc(cc(c1)Br)Br 34a_100010167048_100000210202 [1,1,0,0,0,0|1,0,1]=4 3076 B11R1.34 CCOc1cc(cc(c1)Br)Br 7a_100010167048_100000210202 [1,1,0,0,0,0|1,0,1]=4 3077 B11R1.34 CCOc1cc(cc(c1)Br)C 34a_100011999630_100000210202 [1,1,0,0,0,0|1,0,1]=4 3078 B11R1.34 CCOc1cc(cc(c1)Br)C 7a_100011999630_100000210202 [1,1,0,0,0,0|1,0,1]=4 3079 B11R1.34 CCOc1cc(cc(c1)Br)Cl 34a_100010185897_100000210202 [1,1,0,0,0,0|1,0,1]=4 3080 B11R1.34 CCOc1cc(cc(c1)Br)Cl 7a_100010185897_100000210202 [1,1,0,0,0,0|1,0,1]=4 3081 B11R1.34 CCOc1cc(cc(c1)Br)F 34a_100000688818_100000210202 [1,1,0,0,0,0|1,0,1]=4 3082 B11R1.34 CCOc1cc(cc(c1)Br)F 7a_100000688818_100000210202 [1,1,0,0,0,0|1,0,1]=4 3083 B11R1.34 CCOc1cc(cc(c1)C)C 34a_100000210933_100000210202 [1,1,0,0,0,0|1,0,1]=4 3084 B11R1.34 CCOc1cc(cc(c1)C)C 7a_100000210933_100000210202 [1,1,0,0,0,0|1,0,1]=4 3085 B11R1.34 CCOc1cc(cc(c1)Cl)C 34a_100000087485_100000210202 [1,1,0,0,0,0|1,0,1]=4 3086 B11R1.34 CCOc1cc(cc(c1)Cl)C 7a_100000087485_100000210202 [1,1,0,0,0,0|1,0,1]=4 3087 B11R1.34 CCOc1cc(cc(c1)Cl)Cl 34a_100000181315_100000210202 [1,1,0,0,0,0|1,0,1]=4 3088 B11R1.34 CCOc1cc(cc(c1)Cl)Cl 7a_100000181315_100000210202 [1,1,0,0,0,0|1,0,1]=4 3089 B11R1.34 CCOc1cc(cc(c1)Cl)F 34a_100011219751_100000210202 [1,1,0,0,0,0|1,0,1]=4 3090 B11R1.34 CCOc1cc(cc(c1)Cl)F 7a_100011219751_100000210202 [1,1,0,0,0,0|1,0,1]=4 3091 B11R1.34 CCOc1cc(cc(c1)Cl)N 34a_100000123917_100000210202 [1,1,0,0,0,0|1,0,1]=4 3092 B11R1.34 CCOc1cc(cc(c1)Cl)N 7a_100000123917_100000210202 [1,1,0,0,0,0|1,0,1]=4 3093 B11R1.34 CCOc1cc(cc(c1)F)C 34a_100011830401_100000210202 [1,1,0,0,0,0|1,0,1]=4 3094 B11R1.34 CCOc1cc(cc(c1)F)C 7a_100011830401_100000210202 [1,1,0,0,0,0|1,0,1]=4 3095 B11R1.34 CCOc1cc(cc(c1)F)F 34a_100000747503_100000210202 [1,1,0,0,0,0|1,0,1]=4 3096 B11R1.34 CCOc1cc(cc(c1)F)F 7a_100000747503_100000210202 [1,1,0,0,0,0|1,0,1]=4 3097 B11R1.34 CCOc1cc(cc(c1)F)O 271570a_203496583355_100012343907 [1,1,0,0,0,0|0,0,1]=3 3098 B11R1.34 CCOc1cc(cc(c1)I)Br 34a_100010068917_100000210202 [1,1,0,0,0,0|1,0,1]=4 3099 B11R1.34 CCOc1cc(cc(c1)I)Br 7a_100010068917_100000210202 [1,1,0,0,0,0|1,0,1]=4 3100 B11R1.34 CCOc1cc(cc(c1)I)Cl 34a_100010068924_100000210202 [1,1,0,0,0,0|1,0,1]=4 3101 B11R1.34 CCOc1cc(cc(c1)I)Cl 7a_100010068924_100000210202 [1,1,0,0,0,0|1,0,1]=4 3102 B11R1.34 CCOc1cc(cc(c1)I)F 34a_100000717995_100000210202 [1,1,0,0,0,0|1,0,1]=4 3103 B11R1.34 CCOc1cc(cc(c1)I)F 7a_100000717995_100000210202 [1,1,0,0,0,0|1,0,1]=4 3104 B11R1.34 CCOc1cc(cc(c1)N)C 34a_100011995906_100000210202 [1,1,0,0,0,0|1,0,1]=4 3105 B11R1.34 CCOc1cc(cc(c1)N)C 7a_100011995906_100000210202 [1,1,0,0,0,0|1,0,1]=4 3106 B11R1.34 CCSc1cc(cc(c1)Br)O 62a_100000210202_100010068917 [1,1,0,0,0,0|0,1,1]=4 3107 B11R1.34 CCSc1cc(cc(c1)Br)O 62a_100010068917_100000210202 [1,1,0,0,0,0|0,1,1]=4 3108 B11R1.34 CCSc1cc(cc(c1)Cl)O 62a_100000210202_100010068924 [1,1,0,0,0,0|0,1,1]=4 3109 B11R1.34 CCSc1cc(cc(c1)Cl)O 62a_100010068924_100000210202 [1,1,0,0,0,0|0,1,1]=4 3110 B11R1.34 CCSc1cc(cc(c1)F)O 62a_100000210202_100000688818 [1,1,0,0,0,0|0,1,1]=4 3111 B11R1.34 CCSc1cc(cc(c1)F)O 62a_100000688818_100000210202 [1,1,0,0,0,0|0,1,1]=4 3112 B11R1.34 CCSc1cc(cc(c1)O)C 62a_100000210202_100011999630 [1,1,0,0,0,0|0,1,1]=4 3113 B11R1.34 CCSc1cc(cc(c1)O)O 62a_100000210202_100009868816 [1,1,0,0,0,0|0,1,1]=4 3114 B11R1.34 CNCc1cc(cc(c1)Br)O 207a_100102657272_100010176088 [1,1,0,0,0,0|2,0,0]=4 3115 B11R1.34 CNCc1cc(cc(c1)Br)O 270004a_106832991635_100010176088 [1,1,0,0,0,0|2,0,0]=4 3116 B11R1.34 CNCc1cc(cc(c1)Cl)O 207a_100102657272_100000050827 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.34 CNCc1cc(cc(c1)Cl)O 2230a_107254831445_200000210301 [1,1,0,0,0,0|2,0,0]=4 3118 B11R1.34 CNCc1cc(cc(c1)Cl)O 270004a_106832991635_100000050827 [1,1,0,0,0,0|2,0,0]=4 3119 B11R1.34 CNCc1cc(cc(c1)Cl)O 34a_107254831445_200000210301 [1,1,0,0,0,0|2,0,0]=4 3120 B11R1.34 CNCc1cc(cc(c1)F)O 207a_100102657272_100000703664 [1,1,0,0,0,0|2,0,0]=4 3121 B11R1.34 CNCc1cc(cc(c1)F)O 2230a_100160469513_200000210301 [1,1,0,0,0,0|2,0,0]=4 3122 B11R1.34 CNCc1cc(cc(c1)F)O 270004a_106832991635_100000703664 [1,1,0,0,0,0|2,0,0]=4 3123 B11R1.34 CNCc1cc(cc(c1)F)O 34a_100160469513_200000210301 [1,1,0,0,0,0|2,0,0]=4 3124 B11R1.34 CNCc1cc(cc(c1)O)C 207a_100102657272_100009853434 [1,1,0,0,0,0|2,0,0]=4 3125 B11R1.34 CNCc1cc(cc(c1)O)C 270004a_106832991635_100009853434 [1,1,0,0,0,0|2,0,0]=4 3126 B11R1.34 CNCc1cc(cc(c1)O)O 207a_100102657272_100000043415 [1,1,0,0,0,0|2,0,0]=4 3127 B11R1.34 CNCc1cc(cc(c1)O)O 2230a_100159270720_200000210301 [1,1,0,0,0,0|2,0,0]=4 3128 B11R1.34 CNCc1cc(cc(c1)O)O 34a_100159270720_200000210301 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.34 COCc1cc(cc(c1)F)O 271570a_203496583355_100012630430 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 2230a_107254831445_200025704644 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.34 [13CH3]NCc1cc(cc(c1)Cl)O 34a_107254831445_200025704644 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 2230a_100160469513_200025704644 [1,1,0,0,0,0|2,0,0]=4 3133 B11R1.34 [13CH3]NCc1cc(cc(c1)F)O 34a_100160469513_200025704644 [1,1,0,0,0,0|2,0,0]=4 3134 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 2230a_100159270720_200025704644 [1,1,0,0,0,0|2,0,0]=4 3135 B11R1.34 [13CH3]NCc1cc(cc(c1)O)O 34a_100159270720_200025704644 [1,1,0,0,0,0|2,0,0]=4 3136 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [1,1,0,0,0,0|2,0,0]=4 3137 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [1,1,0,0,0,0|2,0,0]=4 3138 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [1,1,0,0,0,0|2,0,0]=4 3139 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [1,1,0,0,0,0|2,0,0]=4 3140 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [1,1,0,0,0,0|2,0,0]=4 3141 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [1,1,0,0,0,0|1,0,0]=3 3142 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [1,1,0,0,0,0|2,0,0]=4 3143 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [1,1,0,0,0,0|2,0,0]=4 3144 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [1,1,0,0,0,0|2,0,0]=4 3145 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [1,1,0,0,0,0|2,0,0]=4 3146 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [1,1,0,0,0,0|2,0,0]=4 3147 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [1,1,0,0,0,0|1,0,0]=3 3148 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [1,1,0,0,0,0|2,0,0]=4 3149 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [1,1,0,0,0,0|2,0,0]=4 3150 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [1,1,0,0,0,0|2,0,0]=4 3151 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [1,1,0,0,0,0|2,0,0]=4 3152 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [1,1,0,0,0,0|2,0,0]=4 3153 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [1,1,0,0,0,0|1,0,0]=3 3154 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [1,1,0,0,0,0|2,0,0]=4 3155 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [1,1,0,0,0,0|2,0,0]=4 3156 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [1,1,0,0,0,0|2,0,0]=4 3157 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [1,1,0,0,0,0|2,0,0]=4 3158 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [1,1,0,0,0,0|2,0,0]=4 3159 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [1,1,0,0,0,0|1,0,0]=3 3160 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [1,1,0,0,0,0|2,0,0]=4 3161 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [1,1,0,0,0,0|2,0,0]=4 3162 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [1,1,0,0,0,0|2,0,0]=4 3163 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [1,1,0,0,0,0|2,0,0]=4 3164 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [1,1,0,0,0,0|2,0,0]=4 3165 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [1,1,0,0,0,0|1,0,0]=3 3166 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [1,1,0,0,0,0|2,0,0]=4 3167 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [1,1,0,0,0,0|2,0,0]=4 3168 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [1,1,0,0,0,0|2,0,0]=4 3169 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [1,1,0,0,0,0|2,0,0]=4 3170 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [1,1,0,0,0,0|2,0,0]=4 3171 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [1,1,0,0,0,0|1,0,0]=3 3172 B11R1.182 CC=Cc1cc(cnc1C)O 271570a_100016259895_100009819603 [1,1,0,0,0,0|2,0,0]=4 3173 B11R1.182 CC=Cc1cc(cnc1F)O 271570a_100016259895_100009817267 [1,1,0,0,0,0|2,0,0]=4 3174 B11R1.182 CC=Cc1cc(ncc1C)O 271570a_100016259895_100009831917 [1,1,0,0,0,0|2,0,0]=4 3175 B11R1.182 CCNc1cc(ccc1Br)O 34a_100011999798_100000210202 [1,1,0,0,0,0|1,0,1]=4 3176 B11R1.182 CCNc1cc(ccc1C)O 34a_100011216113_100000210202 [1,1,0,0,0,0|1,0,1]=4 3177 B11R1.182 CCNc1cc(ccc1Cl)O 34a_100011934297_100000210202 [1,1,0,0,0,0|1,0,1]=4 3178 B11R1.182 CCNc1cc(ccc1F)O 34a_100012017239_100000210202 [1,1,0,0,0,0|1,0,1]=4 3179 B11R1.182 CCNc1cc(ccc1N)O 271570a_203496583355_100000696630 [1,1,0,0,0,0|1,0,1]=4 3180 B11R1.182 CCOc1cc(ccc1Br)Br 34a_100011220040_100000210202 [1,1,0,0,0,0|1,0,1]=4 3181 B11R1.182 CCOc1cc(ccc1Br)Br 7a_100011220040_100000210202 [1,1,0,0,0,0|1,0,1]=4 3182 B11R1.182 CCOc1cc(ccc1Br)C 34a_100012002257_100000210202 [1,1,0,0,0,0|1,0,1]=4 3183 B11R1.182 CCOc1cc(ccc1Br)C 7a_100012002257_100000210202 [1,1,0,0,0,0|1,0,1]=4 3184 B11R1.182 CCOc1cc(ccc1Br)Cl 34a_100012339455_100000210202 [1,1,0,0,0,0|1,0,1]=4 3185 B11R1.182 CCOc1cc(ccc1Br)Cl 7a_100012339455_100000210202 [1,1,0,0,0,0|1,0,1]=4 3186 B11R1.182 CCOc1cc(ccc1Br)F 34a_100000690578_100000210202 [1,1,0,0,0,0|1,0,1]=4 3187 B11R1.182 CCOc1cc(ccc1Br)F 7a_100000690578_100000210202 [1,1,0,0,0,0|1,0,1]=4 3188 B11R1.182 CCOc1cc(ccc1Br)I 34a_100012356990_100000210202 [1,1,0,0,0,0|1,0,1]=4 3189 B11R1.182 CCOc1cc(ccc1Br)I 7a_100012356990_100000210202 [1,1,0,0,0,0|1,0,1]=4 3190 B11R1.182 CCOc1cc(ccc1C)Br 34a_100000685420_100000210202 [1,1,0,0,0,0|1,0,1]=4 3191 B11R1.182 CCOc1cc(ccc1C)Br 7a_100000685420_100000210202 [1,1,0,0,0,0|1,0,1]=4 3192 B11R1.182 CCOc1cc(ccc1C)C 34a_100000210931_100000210202 [1,1,0,0,0,0|1,0,1]=4 3193 B11R1.182 CCOc1cc(ccc1C)C 7a_100000210931_100000210202 [1,1,0,0,0,0|1,0,1]=4 3194 B11R1.182 CCOc1cc(ccc1C)Cl 34a_100000756515_100000210202 [1,1,0,0,0,0|1,0,1]=4 3195 B11R1.182 CCOc1cc(ccc1C)Cl 7a_100000756515_100000210202 [1,1,0,0,0,0|1,0,1]=4 3196 B11R1.182 CCOc1cc(ccc1C)F 34a_100000690566_100000210202 [1,1,0,0,0,0|1,0,1]=4 3197 B11R1.182 CCOc1cc(ccc1C)F 7a_100000690566_100000210202 [1,1,0,0,0,0|1,0,1]=4 3198 B11R1.182 CCOc1cc(ccc1C)I 7a_100000766334_100000210202 [1,1,0,0,0,0|1,0,1]=4 3199 B11R1.182 CCOc1cc(ccc1C)N 34a_100000759471_100000210202 [1,1,0,0,0,0|1,0,1]=4 3200 B11R1.182 CCOc1cc(ccc1C)N 7a_100000759471_100000210202 [1,1,0,0,0,0|1,0,1]=4 3201 B11R1.182 CCOc1cc(ccc1C)O 271570a_203496583355_100012361169 [1,1,0,0,0,0|0,0,1]=3 3202 B11R1.182 CCOc1cc(ccc1Cl)Br 34a_100000738945_100000210202 [1,1,0,0,0,0|1,0,1]=4 3203 B11R1.182 CCOc1cc(ccc1Cl)Br 7a_100000738945_100000210202 [1,1,0,0,0,0|1,0,1]=4 3204 B11R1.182 CCOc1cc(ccc1Cl)C 34a_100000211493_100000210202 [1,1,0,0,0,0|1,0,1]=4 3205 B11R1.182 CCOc1cc(ccc1Cl)C 7a_100000211493_100000210202 [1,1,0,0,0,0|1,0,1]=4 3206 B11R1.182 CCOc1cc(ccc1Cl)Cl 34a_100000211422_100000210202 [1,1,0,0,0,0|1,0,1]=4 3207 B11R1.182 CCOc1cc(ccc1Cl)Cl 7a_100000211422_100000210202 [1,1,0,0,0,0|1,0,1]=4 3208 B11R1.182 CCOc1cc(ccc1Cl)F 34a_100000692107_100000210202 [1,1,0,0,0,0|1,0,1]=4 3209 B11R1.182 CCOc1cc(ccc1Cl)F 7a_100000692107_100000210202 [1,1,0,0,0,0|1,0,1]=4 3210 B11R1.182 CCOc1cc(ccc1Cl)I 34a_100011356854_100000210202 [1,1,0,0,0,0|1,0,1]=4 3211 B11R1.182 CCOc1cc(ccc1Cl)I 7a_100011356854_100000210202 [1,1,0,0,0,0|1,0,1]=4 3212 B11R1.182 CCOc1cc(ccc1Cl)N 34a_100011934209_100000210202 [1,1,0,0,0,0|1,0,1]=4 3213 B11R1.182 CCOc1cc(ccc1F)Br 34a_100000686035_100000210202 [1,1,0,0,0,0|1,0,1]=4 3214 B11R1.182 CCOc1cc(ccc1F)Br 7a_100000686035_100000210202 [1,1,0,0,0,0|1,0,1]=4 3215 B11R1.182 CCOc1cc(ccc1F)C 34a_100000759540_100000210202 [1,1,0,0,0,0|1,0,1]=4 3216 B11R1.182 CCOc1cc(ccc1F)C 7a_100000759540_100000210202 [1,1,0,0,0,0|1,0,1]=4 3217 B11R1.182 CCOc1cc(ccc1F)Cl 34a_100000757397_100000210202 [1,1,0,0,0,0|1,0,1]=4 3218 B11R1.182 CCOc1cc(ccc1F)Cl 7a_100000757397_100000210202 [1,1,0,0,0,0|1,0,1]=4 3219 B11R1.182 CCOc1cc(ccc1F)F 34a_100000752141_100000210202 [1,1,0,0,0,0|1,0,1]=4 3220 B11R1.182 CCOc1cc(ccc1F)F 7a_100000752141_100000210202 [1,1,0,0,0,0|1,0,1]=4 3221 B11R1.182 CCOc1cc(ccc1F)I 34a_100009958187_100000210202 [1,1,0,0,0,0|1,0,1]=4 3222 B11R1.182 CCOc1cc(ccc1F)I 7a_100009958187_100000210202 [1,1,0,0,0,0|1,0,1]=4 3223 B11R1.182 CCOc1cc(ccc1F)N 34a_100012017398_100000210202 [1,1,0,0,0,0|1,0,1]=4 3224 B11R1.182 CCOc1cc(ccc1F)N 7a_100012017398_100000210202 [1,1,0,0,0,0|1,0,1]=4 3225 B11R1.182 CCOc1cc(ccc1F)O 271570a_203496583355_200012344967 [1,1,0,0,0,0|0,0,1]=3 3226 B11R1.182 CCOc1cc(ccc1I)Br 34a_100012344904_100000210202 [1,1,0,0,0,0|1,0,1]=4 3227 B11R1.182 CCOc1cc(ccc1I)Br 7a_100012344904_100000210202 [1,1,0,0,0,0|1,0,1]=4 3228 B11R1.182 CCOc1cc(ccc1I)Cl 34a_100000050036_100000210202 [1,1,0,0,0,0|1,0,1]=4 3229 B11R1.182 CCOc1cc(ccc1I)Cl 7a_100000050036_100000210202 [1,1,0,0,0,0|1,0,1]=4 3230 B11R1.182 CCOc1cc(ccc1I)F 34a_100010084537_100000210202 [1,1,0,0,0,0|1,0,1]=4 3231 B11R1.182 CCOc1cc(ccc1I)F 7a_100010084537_100000210202 [1,1,0,0,0,0|1,0,1]=4 3232 B11R1.182 CCOc1cc(ccc1N)Br 34a_100000739049_100000210202 [1,1,0,0,0,0|1,0,1]=4 3233 B11R1.182 CCOc1cc(ccc1N)Br 7a_100000739049_100000210202 [1,1,0,0,0,0|1,0,1]=4 3234 B11R1.182 CCOc1cc(ccc1N)C 34a_100000211527_100000210202 [1,1,0,0,0,0|1,0,1]=4 3235 B11R1.182 CCOc1cc(ccc1N)C 7a_100000211527_100000210202 [1,1,0,0,0,0|1,0,1]=4 3236 B11R1.182 CCOc1cc(ccc1N)Cl 34a_100000185728_100000210202 [1,1,0,0,0,0|1,0,1]=4 3237 B11R1.182 CCOc1cc(ccc1N)Cl 7a_100000185728_100000210202 [1,1,0,0,0,0|1,0,1]=4 3238 B11R1.182 CCOc1cc(ccc1N)F 34a_100000753323_100000210202 [1,1,0,0,0,0|1,0,1]=4 3239 B11R1.182 CCOc1cc(ccc1N)F 7a_100000753323_100000210202 [1,1,0,0,0,0|1,0,1]=4 3240 B11R1.182 CCOc1cc(ccc1N)I 34a_100000057187_100000210202 [1,1,0,0,0,0|1,0,1]=4 3241 B11R1.182 CCOc1cc(ccc1N)I 7a_100000057187_100000210202 [1,1,0,0,0,0|1,0,1]=4 3242 B11R1.182 CCOc1cc(ccc1N)N 34a_100025717382_100000210202 [1,1,0,0,0,0|1,0,1]=4 3243 B11R1.182 CCOc1cc(ccc1N)O 271570a_203496583355_100000688918 [1,1,0,0,0,0|0,0,1]=3 3244 B11R1.182 CCOc1cc(ccc1O)C 271570a_203496583355_200010713166 [1,1,0,0,0,0|1,0,1]=4 3245 B11R1.182 CCOc1cc(ccc1O)F 271570a_203496583355_200012340411 [1,1,0,0,0,0|1,0,1]=4 3246 B11R1.182 CCOc1cc(ccc1O)N 271570a_203496583355_200016990551 [1,1,0,0,0,0|1,0,1]=4 3247 B11R1.182 CCOc1cc(cnc1F)O 271570a_203496583355_100010732568 [1,1,0,0,0,0|1,0,1]=4 3248 B11R1.182 CCOc1cc(ncc1N)O 271570a_203496583355_100015764953 [1,1,0,0,0,0|1,0,1]=4 3249 B11R1.182 CCSc1cc(ccc1Br)O 62a_100000210202_100012339312 [1,1,0,0,0,0|0,1,1]=4 3250 B11R1.182 CCSc1cc(ccc1Br)O 62a_100012339312_100000210202 [1,1,0,0,0,0|0,1,1]=4 3251 B11R1.182 CCSc1cc(ccc1C)O 62a_100000210202_100011380479 [1,1,0,0,0,0|0,1,1]=4 3252 B11R1.182 CCSc1cc(ccc1C)O 62a_100011380479_100000210202 [1,1,0,0,0,0|0,1,1]=4 3253 B11R1.182 CCSc1cc(ccc1Cl)O 62a_100000049588_100000210202 [1,1,0,0,0,0|0,1,1]=4 3254 B11R1.182 CCSc1cc(ccc1Cl)O 62a_100000210202_100000049588 [1,1,0,0,0,0|0,1,1]=4 3255 B11R1.182 CCSc1cc(ccc1F)O 62a_100000210202_100000693481 [1,1,0,0,0,0|0,1,1]=4 3256 B11R1.182 CCSc1cc(ccc1F)O 62a_100000693481_100000210202 [1,1,0,0,0,0|0,1,1]=4 3257 B11R1.182 CCSc1cc(ccc1N)O 62a_100000210202_100012001276 [1,1,0,0,0,0|0,1,1]=4 3258 B11R1.182 CCSc1cc(ccc1N)O 62a_100012001276_100000210202 [1,1,0,0,0,0|0,1,1]=4 3259 B11R1.182 CCSc1cc(ccc1O)O 62a_100000210202_100009813629 [1,1,0,0,0,0|0,1,1]=4 3260 B11R1.182 CNCc1cc(ccc1C)O 271570a_203496583355_106744473289 [1,1,0,0,0,0|2,0,0]=4 3261 B11R1.182 CNCc1cc(ccc1C)O 34a_200009844824_200000210301 [1,1,0,0,0,0|2,0,0]=4 3262 B11R1.182 CNCc1cc(ccc1F)O 271570a_203496583355_100000748472 [1,1,0,0,0,0|2,0,0]=4 3263 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [1,1,0,0,0,0|2,0,0]=4 3264 B11R1.182 COCc1cc(ccc1Br)O 271570a_203496583355_202125822959 [1,1,0,0,0,0|2,0,0]=4 3265 B11R1.182 COCc1cc(ccc1F)O 271570a_203496583355_100010140362 [1,1,0,0,0,0|2,0,0]=4 3266 B11R1.182 Cc1ccc(cc1CN[13CH3])O 34a_200009844824_200025704644 [1,1,0,0,0,0|2,0,0]=4 3267 B11R1.189 C#Cc1cccc(c1)OCC 34a_100011216014_100000210202 [1,1,0,0,0,0|1,0,1]=4 3268 B11R1.189 C#Cc1cccc(c1)OCC 7a_100011216014_100000210202 [1,1,0,0,0,0|1,0,1]=4 3269 B11R1.189 C=Cc1cccc(c1)CC=O 271570a_100011290941_200000698211 [1,1,0,0,0,0|2,0,0]=4 3270 B11R1.189 C=Cc1cccc(c1)OCC 271570a_100011290941_100000170002 [1,1,0,0,0,0|1,0,1]=4 3271 B11R1.189 C=Cc1cccc(c1)OCC 34a_100011309434_100000210202 [1,1,0,0,0,0|1,0,1]=4 3272 B11R1.189 C=Cc1cccc(c1)OCC 7a_100011309434_100000210202 [1,1,0,0,0,0|1,0,1]=4 3273 B11R1.189 CC=Cc1cc(ccn1)CO 271570a_100016259895_100009814636 [1,1,0,0,0,0|2,0,0]=4 3274 B11R1.189 CC=Cc1cc(ccn1)OC 271570a_100016259895_100011216251 [1,1,0,0,0,0|2,0,0]=4 3275 B11R1.189 CC=Cc1cccc(c1)C#N 271570a_100016259895_100000189340 [1,1,0,0,0,0|2,0,0]=4 3276 B11R1.189 CC=Cc1cccc(c1)C=O 271570a_100016259895_100000014684 [1,1,0,0,0,0|1,0,1]=4 3277 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,1,0,0,0,0|2,0,0]=4 3278 B11R1.189 CC=Cc1cccc(c1)CF 271570a_100016259895_100010878472 [1,1,0,0,0,0|2,0,0]=4 3279 B11R1.189 CC=Cc1cccc(c1)CN 271570a_100016259895_100000106179 [1,1,0,0,0,0|2,0,0]=4 3280 B11R1.189 CC=Cc1cccc(c1)CO 271570a_100016259895_100000687537 [1,1,0,0,0,0|1,0,0]=3 3281 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [1,1,0,0,0,0|2,0,0]=4 3282 B11R1.189 CC=Cc1cccc(c1)NN 271570a_100016259895_100000217339 [1,1,0,0,0,0|2,0,0]=4 3283 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [1,1,0,0,0,0|1,0,0]=3 3284 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [1,1,0,0,0,0|1,1,0]=4 3285 B11R1.189 CC=Cc1cccc(n1)CO 271570a_100016259895_100000694195 [1,1,0,0,0,0|2,0,0]=4 3286 B11R1.189 CC=Cc1cccc(n1)OC 271570a_100016259895_100000760917 [1,1,0,0,0,0|2,0,0]=4 3287 B11R1.189 CC=Cc1ccnc(c1)CO 271570a_100016259895_100009819072 [1,1,0,0,0,0|2,0,0]=4 3288 B11R1.189 CC=Cc1ccnc(c1)OC 271570a_100016259895_100000117307 [1,1,0,0,0,0|2,0,0]=4 3289 B11R1.189 CC=Cc1cncc(c1)CO 271570a_100016259895_100011259137 [1,1,0,0,0,0|2,0,0]=4 3290 B11R1.189 CC=Cc1cncc(c1)OC 271570a_100016259895_100000684773 [1,1,0,0,0,0|2,0,0]=4 3291 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [1,1,0,0,0,0|1,0,1]=4 3292 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [1,1,0,0,0,0|1,0,1]=4 3293 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [1,1,0,0,0,0|1,0,1]=4 3294 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [1,1,0,0,0,0|1,0,1]=4 3295 B11R1.189 CCNc1cccc(c1)CO 2230a_100000211919_100000210202 [1,1,0,0,0,0|1,0,1]=4 3296 B11R1.189 CCNc1cccc(c1)CO 34a_100000211919_100000210202 [1,1,0,0,0,0|1,0,1]=4 3297 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [1,1,0,0,0,0|1,0,1]=4 3298 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3299 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [1,1,0,0,0,0|1,0,1]=4 3300 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3301 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [1,1,0,0,0,0|1,0,1]=4 3302 B11R1.189 CCOc1cccc(c1)C#N 34a_100000184713_100000210202 [1,1,0,0,0,0|1,0,1]=4 3303 B11R1.189 CCOc1cccc(c1)C#N 7a_100000184713_100000210202 [1,1,0,0,0,0|1,0,1]=4 3304 B11R1.189 CCOc1cccc(c1)CBr 34a_100011660834_100000210202 [1,1,0,0,0,0|1,0,1]=4 3305 B11R1.189 CCOc1cccc(c1)CBr 7a_100011660834_100000210202 [1,1,0,0,0,0|1,0,1]=4 3306 B11R1.189 CCOc1cccc(c1)CC 34a_100000211550_100000210202 [1,1,0,0,0,0|1,0,1]=4 3307 B11R1.189 CCOc1cccc(c1)CC 7a_100000211550_100000210202 [1,1,0,0,0,0|1,0,1]=4 3308 B11R1.189 CCOc1cccc(c1)CCl 34a_100000084143_100000210202 [1,1,0,0,0,0|1,0,1]=4 3309 B11R1.189 CCOc1cccc(c1)CCl 7a_100000084143_100000210202 [1,1,0,0,0,0|1,0,1]=4 3310 B11R1.189 CCOc1cccc(c1)CN 34a_100000743036_100000210202 [1,1,0,0,0,0|1,0,1]=4 3311 B11R1.189 CCOc1cccc(c1)CO 34a_100011214949_100000210202 [1,1,0,0,0,0|0,0,1]=3 3312 B11R1.189 CCOc1cccc(c1)CO 7a_100011214949_100000210202 [1,1,0,0,0,0|0,0,1]=3 3313 B11R1.189 CCOc1cccc(c1)NC 2230a_100000742568_200000210301 [1,1,0,0,0,0|1,0,1]=4 3314 B11R1.189 CCOc1cccc(c1)NC 34a_100000742568_200000210301 [1,1,0,0,0,0|1,0,1]=4 3315 B11R1.189 CCOc1cccc(c1)NC 34a_100000756613_100000210202 [1,1,0,0,0,0|1,0,1]=4 3316 B11R1.189 CCOc1cccc(c1)NC 7a_100000756613_100000210202 [1,1,0,0,0,0|1,0,1]=4 3317 B11R1.189 CCOc1cccc(c1)N[13CH3] 2230a_100000742568_200025704644 [1,1,0,0,0,0|1,0,1]=4 3318 B11R1.189 CCOc1cccc(c1)N[13CH3] 34a_100000742568_200025704644 [1,1,0,0,0,0|1,0,1]=4 3319 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [1,1,0,0,0,0|0,0,1]=3 3320 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [1,1,0,0,0,0|0,0,1]=3 3321 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [1,1,0,0,0,0|0,0,1]=3 3322 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [1,1,0,0,0,0|0,0,1]=3 3323 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [1,1,0,0,0,0|0,0,1]=3 3324 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [1,1,0,0,0,0|0,0,1]=3 3325 B11R1.189 CCOc1cccc(c1)SC 34a_100011265683_100000210202 [1,1,0,0,0,0|0,1,1]=4 3326 B11R1.189 CCOc1cccc(c1)SC 62a_200000210301_100000170002 [1,1,0,0,0,0|0,1,1]=4 3327 B11R1.189 CCOc1cccc(c1)SC 7a_100011265683_100000210202 [1,1,0,0,0,0|0,1,1]=4 3328 B11R1.189 CCOc1cccc(c1)S[13CH3] 62a_200025704644_100000170002 [1,1,0,0,0,0|0,1,1]=4 3329 B11R1.189 CCOc1ccnc(c1)OC 34a_100012181050_100000210202 [1,1,0,0,0,0|1,0,1]=4 3330 B11R1.189 CCOc1cncc(c1)OC 34a_100000084572_100000210202 [1,1,0,0,0,0|1,0,1]=4 3331 B11R1.189 CCOc1cncc(c1)OC 7a_100000084572_100000210202 [1,1,0,0,0,0|1,0,1]=4 3332 B11R1.189 CCSc1cccc(c1)CO 62a_100000210202_100000687537 [1,1,0,0,0,0|0,1,1]=4 3333 B11R1.189 CCSc1cccc(c1)CO 62a_100000687537_100000210202 [1,1,0,0,0,0|0,1,1]=4 3334 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [1,1,0,0,0,0|0,1,1]=4 3335 B11R1.189 CNCc1cccc(c1)CO 207a_100102657272_200000050894 [1,1,0,0,0,0|2,0,0]=4 3336 B11R1.189 CNCc1cccc(c1)CO 2230a_100011269909_200000210301 [1,1,0,0,0,0|2,0,0]=4 3337 B11R1.189 CNCc1cccc(c1)CO 2230a_106832991635_100010188025 [1,1,0,0,0,0|2,0,0]=4 3338 B11R1.189 CNCc1cccc(c1)CO 26a_100102657272_100011214949 [1,1,0,0,0,0|2,0,0]=4 3339 B11R1.189 CNCc1cccc(c1)CO 270004a_106832991635_200000050894 [1,1,0,0,0,0|2,0,0]=4 3340 B11R1.189 CNCc1cccc(c1)CO 34a_100011269909_200000210301 [1,1,0,0,0,0|2,0,0]=4 3341 B11R1.189 CNCc1cccc(c1)CO 34a_100102657272_100010188025 [1,1,0,0,0,0|2,0,0]=4 3342 B11R1.189 CNCc1cccc(c1)CO 7a_106832991635_100010188025 [1,1,0,0,0,0|2,0,0]=4 3343 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,1,0,0,0,0|2,0,0]=4 3344 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,1,0,0,0,0|2,0,0]=4 3345 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,1,0,0,0,0|2,0,0]=4 3346 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,1,0,0,0,0|2,0,0]=4 3347 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,1,0,0,0,0|2,0,0]=4 3348 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,1,0,0,0,0|2,0,0]=4 3349 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,1,0,0,0,0|2,0,0]=4 3350 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,1,0,0,0,0|2,0,0]=4 3351 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,1,0,0,0,0|2,0,0]=4 3352 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,1,0,0,0,0|2,0,0]=4 3353 B11R1.189 COCc1cccc(c1)CO 34a_100138415774_100010188025 [1,1,0,0,0,0|2,0,0]=4 3354 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [1,1,0,0,0,0|2,0,0]=4 3355 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [1,1,0,0,0,0|2,0,0]=4 3356 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,1,0,0,0,0|2,0,0]=4 3357 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,1,0,0,0,0|2,0,0]=4 3358 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [1,1,0,0,0,0|2,0,0]=4 3359 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [1,1,0,0,0,0|2,0,0]=4 3360 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [1,1,0,0,0,0|2,0,0]=4 3361 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [1,1,0,0,0,0|2,0,0]=4 3362 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [1,1,0,0,0,0|2,0,0]=4 3363 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [1,1,0,0,0,0|1,0,1]=4 3364 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [1,1,0,0,0,0|1,0,1]=4 3365 B11R1.189 CSCc1cccc(c1)CO 62a_100010188025_200000210301 [1,1,0,0,0,0|2,0,0]=4 3366 B11R1.189 CSCc1cccc(c1)CO 62a_200000210301_100010188025 [1,1,0,0,0,0|2,0,0]=4 3367 B11R1.189 CSc1cccc(c1)CC=O 62a_200000210301_200000698211 [1,1,0,0,0,0|1,1,0]=4 3368 B11R1.189 CSc1cccc(c1)CC=O 62a_200000698211_200000210301 [1,1,0,0,0,0|1,1,0]=4 3369 B11R1.189 OCc1cccc(c1)OCF 34a_100011214949_100015361967 [1,1,0,0,0,0|1,0,1]=4 3370 B11R1.189 OCc1cccc(c1)OCF 7a_100011214949_100015361967 [1,1,0,0,0,0|1,0,1]=4 3371 B11R1.189 [13CH3]NCc1cccc(c1)CO 2230a_100011269909_200025704644 [1,1,0,0,0,0|2,0,0]=4 3372 B11R1.189 [13CH3]NCc1cccc(c1)CO 34a_100011269909_200025704644 [1,1,0,0,0,0|2,0,0]=4 3373 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_100010188025_200025704644 [1,1,0,0,0,0|2,0,0]=4 3374 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_200025704644_100010188025 [1,1,0,0,0,0|2,0,0]=4 3375 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200000698211_200025704644 [1,1,0,0,0,0|1,1,0]=4 3376 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200025704644_200000698211 [1,1,0,0,0,0|1,1,0]=4 3377 B11R1.192 CC=Cc1c[nH]c(=O)c(c1)O 271570a_100016259895_100009814561 [1,1,0,0,0,0|2,0,0]=4 3378 B11R1.192 CC=Cc1cc(c(cn1)C)O 271570a_100016259895_100000704368 [1,1,0,0,0,0|2,0,0]=4 3379 B11R1.192 CC=Cc1cc(c(cn1)F)O 271570a_100016259895_100009854642 [1,1,0,0,0,0|2,0,0]=4 3380 B11R1.192 CC=Cc1ccc(c(c1)Br)Br 271570a_100016259895_100012356285 [1,1,0,0,0,0|2,0,0]=4 3381 B11R1.192 CC=Cc1ccc(c(c1)Br)C 271570a_100016259895_100011847877 [1,1,0,0,0,0|2,0,0]=4 3382 B11R1.192 CC=Cc1ccc(c(c1)Br)Cl 271570a_100016259895_100012353702 [1,1,0,0,0,0|2,0,0]=4 3383 B11R1.192 CC=Cc1ccc(c(c1)Br)F 271570a_100016259895_100012047266 [1,1,0,0,0,0|2,0,0]=4 3384 B11R1.192 CC=Cc1ccc(c(c1)Br)N 271570a_100016259895_100000750455 [1,1,0,0,0,0|2,0,0]=4 3385 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,1,0,0,0,0|2,0,0]=4 3386 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [1,1,0,0,0,0|2,0,0]=4 3387 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [1,1,0,0,0,0|2,0,0]=4 3388 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [1,1,0,0,0,0|2,0,0]=4 3389 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [1,1,0,0,0,0|2,0,0]=4 3390 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [1,1,0,0,0,0|2,0,0]=4 3391 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,1,0,0,0,0|2,0,0]=4 3392 B11R1.192 CC=Cc1ccc(c(c1)Cl)Br 271570a_100016259895_100012047281 [1,1,0,0,0,0|2,0,0]=4 3393 B11R1.192 CC=Cc1ccc(c(c1)Cl)C 271570a_100016259895_100011216363 [1,1,0,0,0,0|2,0,0]=4 3394 B11R1.192 CC=Cc1ccc(c(c1)Cl)Cl 271570a_100016259895_100011214914 [1,1,0,0,0,0|2,0,0]=4 3395 B11R1.192 CC=Cc1ccc(c(c1)Cl)F 271570a_100016259895_100011215976 [1,1,0,0,0,0|2,0,0]=4 3396 B11R1.192 CC=Cc1ccc(c(c1)Cl)N 271570a_100016259895_100011218065 [1,1,0,0,0,0|2,0,0]=4 3397 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,1,0,0,0,0|2,0,0]=4 3398 B11R1.192 CC=Cc1ccc(c(c1)F)Br 271570a_100016259895_100000685389 [1,1,0,0,0,0|2,0,0]=4 3399 B11R1.192 CC=Cc1ccc(c(c1)F)C 271570a_100016259895_100000720648 [1,1,0,0,0,0|2,0,0]=4 3400 B11R1.192 CC=Cc1ccc(c(c1)F)Cl 271570a_100016259895_100011216805 [1,1,0,0,0,0|2,0,0]=4 3401 B11R1.192 CC=Cc1ccc(c(c1)F)F 271570a_100016259895_100000750028 [1,1,0,0,0,0|2,0,0]=4 3402 B11R1.192 CC=Cc1ccc(c(c1)F)N 271570a_100016259895_100011215594 [1,1,0,0,0,0|2,0,0]=4 3403 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,1,0,0,0,0|2,0,0]=4 3404 B11R1.192 CC=Cc1ccc(c(c1)N)Br 271570a_100016259895_100000750456 [1,1,0,0,0,0|2,0,0]=4 3405 B11R1.192 CC=Cc1ccc(c(c1)N)C 271570a_100016259895_100000761890 [1,1,0,0,0,0|2,0,0]=4 3406 B11R1.192 CC=Cc1ccc(c(c1)N)Cl 271570a_100016259895_200000761891 [1,1,0,0,0,0|2,0,0]=4 3407 B11R1.192 CC=Cc1ccc(c(c1)N)F 271570a_100016259895_100000740924 [1,1,0,0,0,0|2,0,0]=4 3408 B11R1.192 CC=Cc1ccc(c(c1)N)N 271570a_100016259895_100000741789 [1,1,0,0,0,0|2,0,0]=4 3409 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,1,0,0,0,0|2,0,0]=4 3410 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,1,0,0,0,0|1,0,0]=3 3411 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,1,0,0,0,0|1,0,0]=3 3412 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,1,0,0,0,0|1,0,0]=3 3413 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,1,0,0,0,0|1,0,0]=3 3414 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,1,0,0,0,0|1,0,0]=3 3415 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,1,0,0,0,0|1,0,0]=3 3416 B11R1.192 CC=Cc1ccc(c(n1)O)F 271570a_100016259895_100010729010 [1,1,0,0,0,0|2,0,0]=4 3417 B11R1.192 CC=Cc1ccc(c(n1)O)N 271570a_100016259895_100000718904 [1,1,0,0,0,0|2,0,0]=4 3418 B11R1.192 CC=Cc1cnc(c(c1)O)C 271570a_100016259895_100009864810 [1,1,0,0,0,0|2,0,0]=4 3419 B11R1.192 CC=Cc1cnc(c(c1)O)F 271570a_100016259895_100009819871 [1,1,0,0,0,0|2,0,0]=4 3420 B11R1.192 CC=Cc1cnc(c(c1)O)N 271570a_100016259895_100009819042 [1,1,0,0,0,0|2,0,0]=4 3421 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [1,1,0,0,0,0|1,0,1]=4 3422 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [1,1,0,0,0,0|1,0,1]=4 3423 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [1,1,0,0,0,0|1,0,1]=4 3424 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [1,1,0,0,0,0|1,0,1]=4 3425 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [1,1,0,0,0,0|1,0,1]=4 3426 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [1,1,0,0,0,0|1,0,1]=4 3427 B11R1.192 CCOc1ccc(c(c1)Br)C 34a_100011380479_100000210202 [1,1,0,0,0,0|1,0,1]=4 3428 B11R1.192 CCOc1ccc(c(c1)Br)C 7a_100011380479_100000210202 [1,1,0,0,0,0|1,0,1]=4 3429 B11R1.192 CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210202 [1,1,0,0,0,0|1,0,1]=4 3430 B11R1.192 CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210202 [1,1,0,0,0,0|1,0,1]=4 3431 B11R1.192 CCOc1ccc(c(c1)Br)F 34a_100000693481_100000210202 [1,1,0,0,0,0|1,0,1]=4 3432 B11R1.192 CCOc1ccc(c(c1)Br)F 7a_100000693481_100000210202 [1,1,0,0,0,0|1,0,1]=4 3433 B11R1.192 CCOc1ccc(c(c1)Br)I 34a_100000701344_100000210202 [1,1,0,0,0,0|1,0,1]=4 3434 B11R1.192 CCOc1ccc(c(c1)Br)I 7a_100000701344_100000210202 [1,1,0,0,0,0|1,0,1]=4 3435 B11R1.192 CCOc1ccc(c(c1)Br)N 34a_100012001276_100000210202 [1,1,0,0,0,0|1,0,1]=4 3436 B11R1.192 CCOc1ccc(c(c1)Br)N 7a_100012001276_100000210202 [1,1,0,0,0,0|1,0,1]=4 3437 B11R1.192 CCOc1ccc(c(c1)C)Br 34a_100000690111_100000210202 [1,1,0,0,0,0|1,0,1]=4 3438 B11R1.192 CCOc1ccc(c(c1)C)Br 7a_100000690111_100000210202 [1,1,0,0,0,0|1,0,1]=4 3439 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [1,1,0,0,0,0|1,0,1]=4 3440 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [1,1,0,0,0,0|1,0,1]=4 3441 B11R1.192 CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210202 [1,1,0,0,0,0|1,0,1]=4 3442 B11R1.192 CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210202 [1,1,0,0,0,0|1,0,1]=4 3443 B11R1.192 CCOc1ccc(c(c1)C)F 34a_100000751312_100000210202 [1,1,0,0,0,0|1,0,1]=4 3444 B11R1.192 CCOc1ccc(c(c1)C)F 7a_100000751312_100000210202 [1,1,0,0,0,0|1,0,1]=4 3445 B11R1.192 CCOc1ccc(c(c1)C)I 34a_100000729255_100000210202 [1,1,0,0,0,0|1,0,1]=4 3446 B11R1.192 CCOc1ccc(c(c1)C)I 7a_100000729255_100000210202 [1,1,0,0,0,0|1,0,1]=4 3447 B11R1.192 CCOc1ccc(c(c1)C)N 34a_100000756630_100000210202 [1,1,0,0,0,0|1,0,1]=4 3448 B11R1.192 CCOc1ccc(c(c1)C)N 7a_100000756630_100000210202 [1,1,0,0,0,0|1,0,1]=4 3449 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [1,1,0,0,0,0|1,0,1]=4 3450 B11R1.192 CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210202 [1,1,0,0,0,0|1,0,1]=4 3451 B11R1.192 CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210202 [1,1,0,0,0,0|1,0,1]=4 3452 B11R1.192 CCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210202 [1,1,0,0,0,0|1,0,1]=4 3453 B11R1.192 CCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210202 [1,1,0,0,0,0|1,0,1]=4 3454 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210202 [1,1,0,0,0,0|1,0,1]=4 3455 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210202 [1,1,0,0,0,0|1,0,1]=4 3456 B11R1.192 CCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210202 [1,1,0,0,0,0|1,0,1]=4 3457 B11R1.192 CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210202 [1,1,0,0,0,0|1,0,1]=4 3458 B11R1.192 CCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210202 [1,1,0,0,0,0|1,0,1]=4 3459 B11R1.192 CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210202 [1,1,0,0,0,0|1,0,1]=4 3460 B11R1.192 CCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210202 [1,1,0,0,0,0|1,0,1]=4 3461 B11R1.192 CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210202 [1,1,0,0,0,0|1,0,1]=4 3462 B11R1.192 CCOc1ccc(c(c1)F)Br 34a_100000755031_100000210202 [1,1,0,0,0,0|1,0,1]=4 3463 B11R1.192 CCOc1ccc(c(c1)F)Br 7a_100000755031_100000210202 [1,1,0,0,0,0|1,0,1]=4 3464 B11R1.192 CCOc1ccc(c(c1)F)C 34a_100000722560_100000210202 [1,1,0,0,0,0|1,0,1]=4 3465 B11R1.192 CCOc1ccc(c(c1)F)C 7a_100000722560_100000210202 [1,1,0,0,0,0|1,0,1]=4 3466 B11R1.192 CCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210202 [1,1,0,0,0,0|1,0,1]=4 3467 B11R1.192 CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210202 [1,1,0,0,0,0|1,0,1]=4 3468 B11R1.192 CCOc1ccc(c(c1)F)F 34a_100000181275_100000210202 [1,1,0,0,0,0|1,0,1]=4 3469 B11R1.192 CCOc1ccc(c(c1)F)F 7a_100000181275_100000210202 [1,1,0,0,0,0|1,0,1]=4 3470 B11R1.192 CCOc1ccc(c(c1)F)I 34a_100009990212_100000210202 [1,1,0,0,0,0|1,0,1]=4 3471 B11R1.192 CCOc1ccc(c(c1)F)I 7a_100009990212_100000210202 [1,1,0,0,0,0|1,0,1]=4 3472 B11R1.192 CCOc1ccc(c(c1)F)N 34a_100000759473_100000210202 [1,1,0,0,0,0|1,0,1]=4 3473 B11R1.192 CCOc1ccc(c(c1)F)N 7a_100000759473_100000210202 [1,1,0,0,0,0|1,0,1]=4 3474 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [1,1,0,0,0,0|1,0,1]=4 3475 B11R1.192 CCOc1ccc(c(c1)I)Br 34a_100012339312_100000210202 [1,1,0,0,0,0|1,0,1]=4 3476 B11R1.192 CCOc1ccc(c(c1)I)Br 7a_100012339312_100000210202 [1,1,0,0,0,0|1,0,1]=4 3477 B11R1.192 CCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210202 [1,1,0,0,0,0|1,0,1]=4 3478 B11R1.192 CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210202 [1,1,0,0,0,0|1,0,1]=4 3479 B11R1.192 CCOc1ccc(c(c1)I)N 34a_100010084370_100000210202 [1,1,0,0,0,0|1,0,1]=4 3480 B11R1.192 CCOc1ccc(c(c1)I)N 7a_100010084370_100000210202 [1,1,0,0,0,0|1,0,1]=4 3481 B11R1.192 CCOc1ccc(c(c1)N)Br 34a_100011999798_100000210202 [1,1,0,0,0,0|1,0,1]=4 3482 B11R1.192 CCOc1ccc(c(c1)N)Br 7a_100011999798_100000210202 [1,1,0,0,0,0|1,0,1]=4 3483 B11R1.192 CCOc1ccc(c(c1)N)C 34a_100011216113_100000210202 [1,1,0,0,0,0|1,0,1]=4 3484 B11R1.192 CCOc1ccc(c(c1)N)C 7a_100011216113_100000210202 [1,1,0,0,0,0|1,0,1]=4 3485 B11R1.192 CCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210202 [1,1,0,0,0,0|1,0,1]=4 3486 B11R1.192 CCOc1ccc(c(c1)N)F 34a_100012017239_100000210202 [1,1,0,0,0,0|1,0,1]=4 3487 B11R1.192 CCOc1ccc(c(c1)N)F 7a_100012017239_100000210202 [1,1,0,0,0,0|1,0,1]=4 3488 B11R1.192 CCOc1ccc(c(c1)N)N 34a_100025771000_100000210202 [1,1,0,0,0,0|1,0,1]=4 3489 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [1,1,0,0,0,0|0,0,1]=3 3490 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [1,1,0,0,0,0|0,1,1]=4 3491 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [1,1,0,0,0,0|0,1,1]=4 3492 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [1,1,0,0,0,0|0,1,1]=4 3493 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [1,1,0,0,0,0|0,1,1]=4 3494 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [1,1,0,0,0,0|0,1,1]=4 3495 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [1,1,0,0,0,0|0,1,1]=4 3496 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [1,1,0,0,0,0|0,1,1]=4 3497 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [1,1,0,0,0,0|0,1,1]=4 3498 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [1,1,0,0,0,0|0,1,1]=4 3499 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [1,1,0,0,0,0|0,1,1]=4 3500 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [1,1,0,0,0,0|0,1,1]=4 3501 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [1,1,0,0,0,0|2,0,0]=4 3502 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [1,1,0,0,0,0|2,0,0]=4 3503 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,1,0,0,0,0|2,0,0]=4 3504 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [1,1,0,0,0,0|2,0,0]=4 3505 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [1,1,0,0,0,0|2,0,0]=4 3506 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [1,1,0,0,0,0|2,0,0]=4 3507 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [1,1,0,0,0,0|2,0,0]=4 3508 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,1,0,0,0,0|2,0,0]=4 3509 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [1,1,0,0,0,0|2,0,0]=4 3510 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [1,1,0,0,0,0|2,0,0]=4 3511 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [1,1,0,0,0,0|2,0,0]=4 3512 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [1,1,0,0,0,0|2,0,0]=4 3513 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [1,1,0,0,0,0|2,0,0]=4 3514 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [1,1,0,0,0,0|2,0,0]=4 3515 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [1,1,0,0,0,0|1,0,0]=3 3516 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [1,1,0,0,0,0|1,0,0]=3 3517 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [1,1,0,0,0,0|1,0,0]=3 3518 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [1,1,0,0,0,0|1,0,0]=3 3519 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [1,1,0,0,0,0|1,0,0]=3 3520 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [1,1,0,0,0,0|1,0,0]=3 3521 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [1,1,0,0,0,0|1,0,0]=3 3522 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [1,1,0,0,0,0|1,0,0]=3 3523 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [1,1,0,0,0,0|1,0,0]=3 3524 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [1,1,0,0,0,0|1,0,0]=3 3525 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [1,1,0,0,0,0|1,0,0]=3 3526 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [1,1,0,0,0,0|1,0,0]=3 3527 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100000070787_100000702658 [1,1,0,0,0,0|2,0,0]=4 3528 B11R1.20 CC(=O)Cc1ccc(cn1)Br 1458a_100020629044_200000210301 [1,1,0,0,0,0|2,0,0]=4 3529 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100000070787_100000691093 [1,1,0,0,0,0|2,0,0]=4 3530 B11R1.20 CC(=O)Cc1ccc(cn1)C 1458a_100025705728_200000210301 [1,1,0,0,0,0|2,0,0]=4 3531 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000070787_100012066911 [1,1,0,0,0,0|2,0,0]=4 3532 B11R1.20 CC(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200000210301 [1,1,0,0,0,0|2,0,0]=4 3533 B11R1.20 CC(=O)Cc1ccc(cn1)F 1458a_100000070787_100000703193 [1,1,0,0,0,0|2,0,0]=4 3534 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100000070787_100009831999 [1,1,0,0,0,0|2,0,0]=4 3535 B11R1.20 CC(=O)Cc1ccc(nc1)Br 1458a_100010067268_200000210301 [1,1,0,0,0,0|2,0,0]=4 3536 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000070787_100016987292 [1,1,0,0,0,0|2,0,0]=4 3537 B11R1.20 CC(=O)Cc1ccc(nc1)C 1458a_100000740413_200000210301 [1,1,0,0,0,0|2,0,0]=4 3538 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200000210301 [1,1,0,0,0,0|2,0,0]=4 3539 B11R1.20 CC(=O)Cc1ccc(nc1)Cl 1458a_100000070787_100000735431 [1,1,0,0,0,0|2,0,0]=4 3540 B11R1.20 CC(=O)Cc1ccc(nc1)F 1458a_100000070787_100009820150 [1,1,0,0,0,0|2,0,0]=4 3541 B11R1.20 CC(=O)Cn1ccc(=O)cc1 1458a_200000238563_200000210301 [1,1,0,0,0,0|2,0,0]=4 3542 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [1,1,0,0,0,0|1,0,0]=3 3543 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [1,1,0,0,0,0|1,0,0]=3 3544 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [1,1,0,0,0,0|1,0,0]=3 3545 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [1,1,0,0,0,0|1,0,0]=3 3546 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [1,1,0,0,0,0|1,0,0]=3 3547 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [1,1,0,0,0,0|1,0,0]=3 3548 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [1,1,0,0,0,0|1,0,0]=3 3549 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [1,1,0,0,0,0|1,0,0]=3 3550 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [1,1,0,0,0,0|1,0,0]=3 3551 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [1,1,0,0,0,0|1,0,0]=3 3552 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [1,1,0,0,0,0|1,0,0]=3 3553 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [1,1,0,0,0,0|1,0,0]=3 3554 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [1,1,0,0,0,0|1,0,0]=3 3555 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [1,1,0,0,0,0|1,0,0]=3 3556 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [1,1,0,0,0,0|1,0,0]=3 3557 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [1,1,0,0,0,0|1,0,0]=3 3558 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [1,1,0,0,0,0|1,0,0]=3 3559 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [1,1,0,0,0,0|1,0,0]=3 3560 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [1,1,0,0,0,0|1,0,0]=3 3561 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [1,1,0,0,0,0|1,0,0]=3 3562 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [1,1,0,0,0,0|1,0,0]=3 3563 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [1,1,0,0,0,0|1,0,0]=3 3564 B11R1.20 CC(=O)Nc1ccc(cn1)O 271570a_203496583355_100000193312 [1,1,0,0,0,0|2,0,0]=4 3565 B11R1.20 CC(=O)Nc1ccc(nc1)O 271570a_203496583355_100011934715 [1,1,0,0,0,0|2,0,0]=4 3566 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [1,1,0,0,0,0|0,0,0]=2 3567 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [1,1,0,0,0,0|0,1,0]=3 3568 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [1,1,0,0,0,0|0,1,0]=3 3569 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [1,1,0,0,0,0|1,0,1]=4 3570 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [1,1,0,0,0,0|1,0,1]=4 3571 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [1,1,0,0,0,0|1,0,1]=4 3572 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [1,1,0,0,0,0|1,0,1]=4 3573 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [1,1,0,0,0,0|1,0,1]=4 3574 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [1,1,0,0,0,0|1,0,1]=4 3575 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [1,1,0,0,0,0|1,0,1]=4 3576 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [1,1,0,0,0,0|1,0,1]=4 3577 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [1,1,0,0,0,0|1,0,1]=4 3578 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [1,1,0,0,0,0|1,0,0]=3 3579 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [1,1,0,0,0,0|1,0,1]=4 3580 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [1,1,0,0,0,0|1,0,1]=4 3581 B11R1.20 Cc1ccc(cn1)CC(=O)[13CH3] 1458a_100000740413_200025704644 [1,1,0,0,0,0|2,0,0]=4 3582 B11R1.20 Cc1ccc(nc1)CC(=O)[13CH3] 1458a_100025705728_200025704644 [1,1,0,0,0,0|2,0,0]=4 3583 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [1,1,0,0,0,0|2,0,0]=4 3584 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [1,1,0,0,0,0|2,0,0]=4 3585 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [1,1,0,0,0,0|1,0,0]=3 3586 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [1,1,0,0,0,0|1,0,0]=3 3587 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [1,1,0,0,0,0|1,0,0]=3 3588 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [1,1,0,0,0,0|1,0,0]=3 3589 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [1,1,0,0,0,0|1,0,0]=3 3590 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Br 1458a_100020629044_200025704644 [1,1,0,0,0,0|2,0,0]=4 3591 B11R1.20 [13CH3]C(=O)Cc1ccc(cn1)Cl 1458a_100000728320_200025704644 [1,1,0,0,0,0|2,0,0]=4 3592 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Br 1458a_100010067268_200025704644 [1,1,0,0,0,0|2,0,0]=4 3593 B11R1.20 [13CH3]C(=O)Cc1ccc(nc1)Cl 1458a_100000061944_200025704644 [1,1,0,0,0,0|2,0,0]=4 3594 B11R1.20 [13CH3]C(=O)Cn1ccc(=O)cc1 1458a_200000238563_200025704644 [1,1,0,0,0,0|2,0,0]=4 3595 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [1,1,0,0,0,0|1,0,0]=3 3596 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [1,1,0,0,0,0|1,0,0]=3 3597 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [1,1,0,0,0,0|2,0,0]=4 3598 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [1,1,0,0,0,0|1,0,0]=3 3599 B11R1.36 CC(=O)C(C)c1ccccn1 1458a_100000722050_200000210301 [1,1,0,0,0,0|2,0,0]=4 3600 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [1,1,0,0,0,0|1,0,0]=3 3601 B11R1.36 CC(=O)N(C)c1ccccc1 11a_100000210012_100015343762 [1,1,0,0,0,0|1,0,0]=3 3602 B11R1.36 CC(=O)N(C)c1ccccc1 1626a_100000210012_100015343762 [1,1,0,0,0,0|1,0,0]=3 3603 B11R1.36 CC(=O)N(C)c1ccccc1 22a_100000210012_100000070787 [1,1,0,0,0,0|1,0,0]=3 3604 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [1,1,0,0,0,0|1,0,0]=3 3605 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [1,1,0,0,0,0|1,0,0]=3 3606 B11R1.36 CC(C(=O)[13CH3])c1ccccn1 1458a_100000722050_200025704644 [1,1,0,0,0,0|2,0,0]=4 3607 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [1,1,0,0,0,0|1,0,0]=3 3608 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [1,1,0,0,0,0|1,0,0]=3 3609 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [1,1,0,0,0,0|1,0,0]=3 3610 B11R1.40 C#CC(=O)Cc1ccccc1 1458a_100000211873_100015291786 [1,1,0,0,0,0|1,0,1]=4 3611 B11R1.40 C#CC(C)Oc1ccccc1 34a_100000210340_200000035995 [1,1,0,0,0,0|1,0,1]=4 3612 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [1,1,0,0,0,0|1,0,1]=4 3613 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [1,1,0,0,0,0|1,0,1]=4 3614 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [1,1,0,0,0,0|1,0,1]=4 3615 B11R1.40 CC(C#N)Oc1ccccc1 7a_100000210340_100000703298 [1,1,0,0,0,0|1,0,1]=4 3616 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [1,1,0,0,0,0|0,0,2]=4 3617 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [1,1,0,0,0,0|0,0,2]=4 3618 B11R1.40 CCC(=O)C[n+]1ccccc1 1458a_200000086051_100000210202 [1,1,0,0,0,0|2,0,0]=4 3619 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [1,1,0,0,0,0|1,0,0]=3 3620 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000210414_100000721315 [1,1,0,0,0,0|2,0,0]=4 3621 B11R1.40 CCC(=O)Cc1ccccn1 1458a_100000233486_100000210202 [1,1,0,0,0,0|2,0,0]=4 3622 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000210414_100000733263 [1,1,0,0,0,0|2,0,0]=4 3623 B11R1.40 CCC(=O)Cc1cccnc1 1458a_100000737805_100000210202 [1,1,0,0,0,0|2,0,0]=4 3624 B11R1.40 CCC(=O)Cc1ccncc1 1458a_100000210414_100000705612 [1,1,0,0,0,0|2,0,0]=4 3625 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [1,1,0,0,0,0|1,0,0]=3 3626 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [1,1,0,0,0,0|1,0,0]=3 3627 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [1,1,0,0,0,0|1,0,0]=3 3628 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [1,1,0,0,0,0|1,0,0]=3 3629 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [1,1,0,0,0,0|1,0,1]=4 3630 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [1,1,0,0,0,0|1,0,1]=4 3631 B11R1.40 CNC(=O)C[n+]1ccccc1 11a_106832991635_200000086051 [1,1,0,0,0,0|2,0,0]=4 3632 B11R1.40 CNC(=O)C[n+]1ccccc1 240690a_100102657272_200000086051 [1,1,0,0,0,0|2,0,0]=4 3633 B11R1.40 CNC(=O)C[n+]1ccccc1 527a_100102657272_200000086051 [1,1,0,0,0,0|2,0,0]=4 3634 B11R1.40 CNC(=O)Cc1ccccn1 11a_106832991635_100000233486 [1,1,0,0,0,0|2,0,0]=4 3635 B11R1.40 CNC(=O)Cc1cccnc1 11a_106832991635_100000737805 [1,1,0,0,0,0|2,0,0]=4 3636 B11R1.40 CNC(=O)Cc1cccnc1 240690a_100102657272_100000737805 [1,1,0,0,0,0|2,0,0]=4 3637 B11R1.40 CNC(=O)Cc1cccnc1 527a_100102657272_100000737805 [1,1,0,0,0,0|2,0,0]=4 3638 B11R1.40 CNC(=O)Cc1ccncc1 11a_106832991635_100011201483 [1,1,0,0,0,0|2,0,0]=4 3639 B11R1.40 CNC(=O)Cc1ccncc1 240690a_100102657272_100011201483 [1,1,0,0,0,0|2,0,0]=4 3640 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [1,1,0,0,0,0|1,0,0]=3 3641 B11R1.40 O=C(CF)C[n+]1ccccc1 1458a_200000086051_100015361967 [1,1,0,0,0,0|2,0,0]=4 3642 B11R1.40 O=C(CF)Cc1ccccn1 1458a_100000233486_100015361967 [1,1,0,0,0,0|2,0,0]=4 3643 B11R1.40 O=C(CF)Cc1cccnc1 1458a_100000737805_100015361967 [1,1,0,0,0,0|2,0,0]=4 3644 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [1,1,0,0,0,0|1,0,0]=3 3645 B11R1.40 O=C(CO)Cc1ccccn1 1458a_100000210174_100000721315 [1,1,0,0,0,0|2,0,0]=4 3646 B11R1.40 O=C(CO)Cc1cccnc1 1458a_100000210174_100000733263 [1,1,0,0,0,0|2,0,0]=4 3647 B11R1.40 O=C(CO)Cc1ccncc1 1458a_100000210174_100000705612 [1,1,0,0,0,0|2,0,0]=4 3648 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [1,1,0,0,0,0|1,0,0]=3 3649 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [1,1,0,0,0,0|1,0,0]=3 3650 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [1,1,0,0,0,0|2,0,0]=4 3651 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [1,1,0,0,0,0|2,0,0]=4 3652 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [1,1,0,0,0,0|2,0,0]=4 3653 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [1,1,0,0,0,0|2,0,0]=4 3654 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [1,1,0,0,0,0|2,0,0]=4 3655 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [1,1,0,0,0,0|2,0,0]=4 3656 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [1,1,0,0,0,0|1,0,0]=3 3657 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [1,1,0,0,0,0|1,0,0]=3 3658 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [1,1,0,0,0,0|1,0,0]=3 3659 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [1,1,0,0,0,0|1,0,0]=3 3660 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [1,1,0,0,0,0|1,0,0]=3 3661 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [1,1,0,0,0,0|1,0,0]=3 3662 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [1,1,0,0,0,0|1,0,0]=3 3663 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [1,1,0,0,0,0|1,0,0]=3 3664 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [1,1,0,0,0,0|1,0,0]=3 3665 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [1,1,0,0,0,0|1,0,0]=3 3666 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [1,1,0,0,0,0|1,0,0]=3 3667 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [1,1,0,0,0,0|1,0,0]=3 3668 B11R1.86 CC(=O)Cc1cccnc1Br 1458a_100000070787_100010140945 [1,1,0,0,0,0|2,0,0]=4 3669 B11R1.86 CC(=O)Cc1cccnc1C 1458a_100000070787_100000732876 [1,1,0,0,0,0|2,0,0]=4 3670 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000070787_100000045678 [1,1,0,0,0,0|2,0,0]=4 3671 B11R1.86 CC(=O)Cc1cccnc1Cl 1458a_100000093521_200000210301 [1,1,0,0,0,0|2,0,0]=4 3672 B11R1.86 CC(=O)Cc1cccnc1F 1458a_100000070787_100000099810 [1,1,0,0,0,0|2,0,0]=4 3673 B11R1.86 CC(=O)Cc1ccncc1C 1458a_100000070787_100020672808 [1,1,0,0,0,0|2,0,0]=4 3674 B11R1.86 CC(=O)Cc1ccncc1Cl 1458a_100000070787_100000763264 [1,1,0,0,0,0|2,0,0]=4 3675 B11R1.86 CC(=O)Cc1cnccc1C 1458a_100000070787_100000690890 [1,1,0,0,0,0|2,0,0]=4 3676 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_100000070787_100025702911 [1,1,0,0,0,0|2,0,0]=4 3677 B11R1.86 CC(=O)Cc1ncccc1Br 1458a_200012357574_200000210301 [1,1,0,0,0,0|2,0,0]=4 3678 B11R1.86 CC(=O)Cc1ncccc1C 1458a_100000070787_100000696600 [1,1,0,0,0,0|2,0,0]=4 3679 B11R1.86 CC(=O)Cc1ncccc1C 1458a_200000722269_200000210301 [1,1,0,0,0,0|2,0,0]=4 3680 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100000070787_100000099807 [1,1,0,0,0,0|2,0,0]=4 3681 B11R1.86 CC(=O)Cc1ncccc1Cl 1458a_100011998755_200000210301 [1,1,0,0,0,0|2,0,0]=4 3682 B11R1.86 CC(=O)Cc1ncccc1F 1458a_100000070787_100000104219 [1,1,0,0,0,0|2,0,0]=4 3683 B11R1.86 CC(=O)Cc1ncccc1O 1458a_100000070787_200020655725 [1,1,0,0,0,0|2,0,0]=4 3684 B11R1.86 CC(=O)Cn1ccccc1=O 1458a_100000189665_200000210301 [1,1,0,0,0,0|2,0,0]=4 3685 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [1,1,0,0,0,0|1,0,0]=3 3686 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [1,1,0,0,0,0|1,0,0]=3 3687 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [1,1,0,0,0,0|1,0,0]=3 3688 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [1,1,0,0,0,0|1,0,0]=3 3689 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [1,1,0,0,0,0|1,0,0]=3 3690 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [1,1,0,0,0,0|1,0,0]=3 3691 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [1,1,0,0,0,0|1,0,0]=3 3692 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [1,1,0,0,0,0|1,0,0]=3 3693 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [1,1,0,0,0,0|1,0,0]=3 3694 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [1,1,0,0,0,0|1,0,0]=3 3695 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [1,1,0,0,0,0|1,0,0]=3 3696 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [1,1,0,0,0,0|1,0,0]=3 3697 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [1,1,0,0,0,0|1,0,0]=3 3698 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [1,1,0,0,0,0|1,0,0]=3 3699 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [1,1,0,0,0,0|1,0,0]=3 3700 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [1,1,0,0,0,0|1,0,0]=3 3701 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [1,1,0,0,0,0|1,0,0]=3 3702 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [1,1,0,0,0,0|1,0,0]=3 3703 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [1,1,0,0,0,0|1,0,0]=3 3704 B11R1.86 CC(=O)Nc1ccncc1O 271570a_203496583355_100016132053 [1,1,0,0,0,0|2,0,0]=4 3705 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [1,1,0,0,0,0|0,0,0]=2 3706 B11R1.86 CC(=O)Oc1cccnc1O 271570a_203496583355_200009815371 [1,1,0,0,0,0|1,0,0]=3 3707 B11R1.86 CC(C)Oc1ccccc1Br 34a_100000181306_100000210206 [1,1,0,0,0,0|1,0,1]=4 3708 B11R1.86 CC(C)Oc1ccccc1Br 7a_100000181306_100000210206 [1,1,0,0,0,0|1,0,1]=4 3709 B11R1.86 CC(C)Oc1ccccc1Cl 34a_100000210172_100000210206 [1,1,0,0,0,0|1,0,1]=4 3710 B11R1.86 CC(C)Oc1ccccc1Cl 7a_100000210172_100000210206 [1,1,0,0,0,0|1,0,1]=4 3711 B11R1.86 CC(C)Oc1ccccc1F 34a_100000210171_100000210206 [1,1,0,0,0,0|1,0,1]=4 3712 B11R1.86 CC(C)Oc1ccccc1F 7a_100000210171_100000210206 [1,1,0,0,0,0|1,0,1]=4 3713 B11R1.86 CC(C)Oc1ccccc1I 34a_100000739446_100000210206 [1,1,0,0,0,0|1,0,1]=4 3714 B11R1.86 CC(C)Oc1ccccc1I 7a_100000739446_100000210206 [1,1,0,0,0,0|1,0,1]=4 3715 B11R1.86 CC(C)Oc1ccccc1N 34a_100000185747_100000210206 [1,1,0,0,0,0|1,0,1]=4 3716 B11R1.86 CC(C)Oc1ccccc1N 7a_100000185747_100000210206 [1,1,0,0,0,0|1,0,1]=4 3717 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [1,1,0,0,0,0|1,0,1]=4 3718 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [1,1,0,0,0,0|1,0,0]=3 3719 B11R1.86 Cc1ccccc1OC(C)C 34a_100000210338_100000210206 [1,1,0,0,0,0|1,0,1]=4 3720 B11R1.86 Cc1ccccc1OC(C)C 7a_100000210338_100000210206 [1,1,0,0,0,0|1,0,1]=4 3721 B11R1.86 Cc1cccnc1CC(=O)[13CH3] 1458a_200000722269_200025704644 [1,1,0,0,0,0|2,0,0]=4 3722 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [1,1,0,0,0,0|2,0,0]=4 3723 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [1,1,0,0,0,0|2,0,0]=4 3724 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [1,1,0,0,0,0|1,0,0]=3 3725 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [1,1,0,0,0,0|1,0,0]=3 3726 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [1,1,0,0,0,0|1,0,0]=3 3727 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [1,1,0,0,0,0|1,0,0]=3 3728 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [1,1,0,0,0,0|1,0,0]=3 3729 B11R1.86 [13CH3]C(=O)Cc1cccnc1Cl 1458a_100000093521_200025704644 [1,1,0,0,0,0|2,0,0]=4 3730 B11R1.86 [13CH3]C(=O)Cc1ncccc1Br 1458a_200012357574_200025704644 [1,1,0,0,0,0|2,0,0]=4 3731 B11R1.86 [13CH3]C(=O)Cc1ncccc1Cl 1458a_100011998755_200025704644 [1,1,0,0,0,0|2,0,0]=4 3732 B11R1.86 [13CH3]C(=O)Cn1ccccc1=O 1458a_100000189665_200025704644 [1,1,0,0,0,0|2,0,0]=4 3733 B11R1.509 CC(C)(C)Oc1ccccc1 34a_100000210340_100000210625 [1,1,0,0,0,0|1,0,1]=4 3734 B11R1.39 COC(=O)Cc1ccc(s1)O 271570a_203496583355_100012028946 [0,1,0,0,1,0|2,0,0]=4 3735 B11R1.21 C=C(C)c1c[nH]c(=O)c(c1)O 271570a_100000694244_100009814561 [0,1,0,0,1,0|2,0,0]=4 3736 B11R1.21 C=C(C)c1cc(c(cn1)C)O 271570a_100000694244_100000704368 [0,1,0,0,1,0|2,0,0]=4 3737 B11R1.21 C=C(C)c1cc(c(cn1)F)O 271570a_100000694244_100009854642 [0,1,0,0,1,0|2,0,0]=4 3738 B11R1.21 C=C(C)c1ccc(c(c1)Br)Br 271570a_100000694244_100012356285 [0,1,0,0,1,0|2,0,0]=4 3739 B11R1.21 C=C(C)c1ccc(c(c1)Br)C 271570a_100000694244_100011847877 [0,1,0,0,1,0|2,0,0]=4 3740 B11R1.21 C=C(C)c1ccc(c(c1)Br)Cl 271570a_100000694244_100012353702 [0,1,0,0,1,0|2,0,0]=4 3741 B11R1.21 C=C(C)c1ccc(c(c1)Br)F 271570a_100000694244_100012047266 [0,1,0,0,1,0|2,0,0]=4 3742 B11R1.21 C=C(C)c1ccc(c(c1)Br)N 271570a_100000694244_100000750455 [0,1,0,0,1,0|2,0,0]=4 3743 B11R1.21 C=C(C)c1ccc(c(c1)Br)O 271570a_100000694244_100012361655 [0,1,0,0,1,0|2,0,0]=4 3744 B11R1.21 C=C(C)c1ccc(c(c1)C)Br 271570a_100000694244_100009813585 [0,1,0,0,1,0|2,0,0]=4 3745 B11R1.21 C=C(C)c1ccc(c(c1)C)C 271570a_100000694244_100011215607 [0,1,0,0,1,0|2,0,0]=4 3746 B11R1.21 C=C(C)c1ccc(c(c1)C)Cl 271570a_100000694244_100000049509 [0,1,0,0,1,0|2,0,0]=4 3747 B11R1.21 C=C(C)c1ccc(c(c1)C)F 271570a_100000694244_100011218330 [0,1,0,0,1,0|2,0,0]=4 3748 B11R1.21 C=C(C)c1ccc(c(c1)C)N 271570a_100000694244_100000211769 [0,1,0,0,1,0|2,0,0]=4 3749 B11R1.21 C=C(C)c1ccc(c(c1)C)O 271570a_100000694244_100000186361 [0,1,0,0,1,0|2,0,0]=4 3750 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Br 271570a_100000694244_100012047281 [0,1,0,0,1,0|2,0,0]=4 3751 B11R1.21 C=C(C)c1ccc(c(c1)Cl)C 271570a_100000694244_100011216363 [0,1,0,0,1,0|2,0,0]=4 3752 B11R1.21 C=C(C)c1ccc(c(c1)Cl)Cl 271570a_100000694244_100011214914 [0,1,0,0,1,0|2,0,0]=4 3753 B11R1.21 C=C(C)c1ccc(c(c1)Cl)F 271570a_100000694244_100011215976 [0,1,0,0,1,0|2,0,0]=4 3754 B11R1.21 C=C(C)c1ccc(c(c1)Cl)N 271570a_100000694244_100011218065 [0,1,0,0,1,0|2,0,0]=4 3755 B11R1.21 C=C(C)c1ccc(c(c1)Cl)O 271570a_100000694244_100012360047 [0,1,0,0,1,0|2,0,0]=4 3756 B11R1.21 C=C(C)c1ccc(c(c1)F)Br 271570a_100000694244_100000685389 [0,1,0,0,1,0|2,0,0]=4 3757 B11R1.21 C=C(C)c1ccc(c(c1)F)C 271570a_100000694244_100000720648 [0,1,0,0,1,0|2,0,0]=4 3758 B11R1.21 C=C(C)c1ccc(c(c1)F)Cl 271570a_100000694244_100011216805 [0,1,0,0,1,0|2,0,0]=4 3759 B11R1.21 C=C(C)c1ccc(c(c1)F)F 271570a_100000694244_100000750028 [0,1,0,0,1,0|2,0,0]=4 3760 B11R1.21 C=C(C)c1ccc(c(c1)F)N 271570a_100000694244_100011215594 [0,1,0,0,1,0|2,0,0]=4 3761 B11R1.21 C=C(C)c1ccc(c(c1)F)O 271570a_100000694244_100000185481 [0,1,0,0,1,0|2,0,0]=4 3762 B11R1.21 C=C(C)c1ccc(c(c1)N)Br 271570a_100000694244_100000750456 [0,1,0,0,1,0|2,0,0]=4 3763 B11R1.21 C=C(C)c1ccc(c(c1)N)C 271570a_100000694244_100000761890 [0,1,0,0,1,0|2,0,0]=4 3764 B11R1.21 C=C(C)c1ccc(c(c1)N)Cl 271570a_100000694244_200000761891 [0,1,0,0,1,0|2,0,0]=4 3765 B11R1.21 C=C(C)c1ccc(c(c1)N)F 271570a_100000694244_100000740924 [0,1,0,0,1,0|2,0,0]=4 3766 B11R1.21 C=C(C)c1ccc(c(c1)N)N 271570a_100000694244_100000741789 [0,1,0,0,1,0|2,0,0]=4 3767 B11R1.21 C=C(C)c1ccc(c(c1)N)O 271570a_100000694244_100000752626 [0,1,0,0,1,0|2,0,0]=4 3768 B11R1.21 C=C(C)c1ccc(c(c1)O)Br 271570a_100000694244_100012356990 [0,1,0,0,1,0|1,0,0]=3 3769 B11R1.21 C=C(C)c1ccc(c(c1)O)C 271570a_100000694244_100000766334 [0,1,0,0,1,0|1,0,0]=3 3770 B11R1.21 C=C(C)c1ccc(c(c1)O)Cl 271570a_100000694244_100011356854 [0,1,0,0,1,0|1,0,0]=3 3771 B11R1.21 C=C(C)c1ccc(c(c1)O)F 271570a_100000694244_100000686035 [0,1,0,0,1,0|1,0,0]=3 3772 B11R1.21 C=C(C)c1ccc(c(c1)O)N 271570a_100000694244_100000739049 [0,1,0,0,1,0|1,0,0]=3 3773 B11R1.21 C=C(C)c1ccc(c(c1)O)O 271570a_100000694244_100009813601 [0,1,0,0,1,0|1,0,0]=3 3774 B11R1.21 C=C(C)c1ccc(c(n1)O)F 271570a_100000694244_100010729010 [0,1,0,0,1,0|2,0,0]=4 3775 B11R1.21 C=C(C)c1ccc(c(n1)O)N 271570a_100000694244_100000718904 [0,1,0,0,1,0|2,0,0]=4 3776 B11R1.21 C=C(C)c1cnc(c(c1)O)C 271570a_100000694244_100009864810 [0,1,0,0,1,0|2,0,0]=4 3777 B11R1.21 C=C(C)c1cnc(c(c1)O)F 271570a_100000694244_100009819871 [0,1,0,0,1,0|2,0,0]=4 3778 B11R1.21 C=C(C)c1cnc(c(c1)O)N 271570a_100000694244_100009819042 [0,1,0,0,1,0|2,0,0]=4 3779 B11R1.21 CC(=O)c1cc(c(cn1)O)C 271570a_203496583355_100011011822 [0,1,0,0,1,0|2,0,0]=4 3780 B11R1.21 CC(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200000210301 [0,1,0,0,1,0|1,0,0]=3 3781 B11R1.21 CC(=O)c1ccc(c(c1)Br)C 1458a_100000186397_200000210301 [0,1,0,0,1,0|1,0,0]=3 3782 B11R1.21 CC(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200000210301 [0,1,0,0,1,0|1,0,0]=3 3783 B11R1.21 CC(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200000210301 [0,1,0,0,1,0|1,0,0]=3 3784 B11R1.21 CC(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200000210301 [0,1,0,0,1,0|1,0,0]=3 3785 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200000210301 [0,1,0,0,1,0|1,0,0]=3 3786 B11R1.21 CC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100010146554 [0,1,0,0,1,0|1,0,0]=3 3787 B11R1.21 CC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_200000210301 [0,1,0,0,1,0|1,0,0]=3 3788 B11R1.21 CC(=O)c1ccc(c(c1)C)C 1458a_100000210898_200000210301 [0,1,0,0,1,0|1,0,0]=3 3789 B11R1.21 CC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_200000210301 [0,1,0,0,1,0|1,0,0]=3 3790 B11R1.21 CC(=O)c1ccc(c(c1)C)F 1458a_100000751819_200000210301 [0,1,0,0,1,0|1,0,0]=3 3791 B11R1.21 CC(=O)c1ccc(c(c1)C)I 1458a_100000751300_200000210301 [0,1,0,0,1,0|1,0,0]=3 3792 B11R1.21 CC(=O)c1ccc(c(c1)C)O 1458a_100000685612_200000210301 [0,1,0,0,1,0|1,0,0]=3 3793 B11R1.21 CC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100000697869 [0,1,0,0,1,0|1,0,0]=3 3794 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200000210301 [0,1,0,0,1,0|1,0,0]=3 3795 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C 1458a_100000751740_200000210301 [0,1,0,0,1,0|1,0,0]=3 3796 B11R1.21 CC(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200000210301 [0,1,0,0,1,0|1,0,0]=3 3797 B11R1.21 CC(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200000210301 [0,1,0,0,1,0|1,0,0]=3 3798 B11R1.21 CC(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200000210301 [0,1,0,0,1,0|1,0,0]=3 3799 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200000210301 [0,1,0,0,1,0|1,0,0]=3 3800 B11R1.21 CC(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200000210301 [0,1,0,0,1,0|1,0,0]=3 3801 B11R1.21 CC(=O)c1ccc(c(c1)F)C 1458a_100000212313_200000210301 [0,1,0,0,1,0|1,0,0]=3 3802 B11R1.21 CC(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200000210301 [0,1,0,0,1,0|1,0,0]=3 3803 B11R1.21 CC(=O)c1ccc(c(c1)F)F 1458a_100000209822_200000210301 [0,1,0,0,1,0|1,0,0]=3 3804 B11R1.21 CC(=O)c1ccc(c(c1)F)I 1458a_100000062624_200000210301 [0,1,0,0,1,0|1,0,0]=3 3805 B11R1.21 CC(=O)c1ccc(c(c1)F)O 1458a_100000185466_200000210301 [0,1,0,0,1,0|1,0,0]=3 3806 B11R1.21 CC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000690002 [0,1,0,0,1,0|1,0,0]=3 3807 B11R1.21 CC(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200000210301 [0,1,0,0,1,0|1,0,0]=3 3808 B11R1.21 CC(=O)c1ccc(c(c1)I)C 1458a_100000751299_200000210301 [0,1,0,0,1,0|1,0,0]=3 3809 B11R1.21 CC(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200000210301 [0,1,0,0,1,0|1,0,0]=3 3810 B11R1.21 CC(=O)c1ccc(c(c1)I)F 1458a_100000688015_200000210301 [0,1,0,0,1,0|1,0,0]=3 3811 B11R1.21 CC(=O)c1ccc(c(c1)I)I 1458a_100000725830_200000210301 [0,1,0,0,1,0|1,0,0]=3 3812 B11R1.21 CC(=O)c1ccc(c(c1)I)O 1458a_100000037485_200000210301 [0,1,0,0,1,0|1,0,0]=3 3813 B11R1.21 CC(=O)c1ccc(c(c1)N)O 271570a_203496583355_100009816534 [0,1,0,0,1,0|1,0,0]=3 3814 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200000210301 [0,1,0,0,1,0|0,0,0]=2 3815 B11R1.21 CC(=O)c1ccc(c(c1)O)Br 271570a_203496583355_100010146556 [0,1,0,0,1,0|0,0,0]=2 3816 B11R1.21 CC(=O)c1ccc(c(c1)O)C 1458a_100000233767_200000210301 [0,1,0,0,1,0|0,0,0]=2 3817 B11R1.21 CC(=O)c1ccc(c(c1)O)C 271570a_203496583355_100011934287 [0,1,0,0,1,0|0,0,0]=2 3818 B11R1.21 CC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200000210301 [0,1,0,0,1,0|0,0,0]=2 3819 B11R1.21 CC(=O)c1ccc(c(c1)O)F 1458a_100000035894_200000210301 [0,1,0,0,1,0|0,0,0]=2 3820 B11R1.21 CC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100000239719 [0,1,0,0,1,0|0,0,0]=2 3821 B11R1.21 CC(=O)c1ccc(c(c1)O)I 1458a_100000239334_200000210301 [0,1,0,0,1,0|0,0,0]=2 3822 B11R1.21 CC(=O)c1ccc(c(c1)O)N 271570a_203496583355_100012029215 [0,1,0,0,1,0|0,0,0]=2 3823 B11R1.21 CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_200000210301 [0,1,0,0,1,0|0,0,0]=2 3824 B11R1.21 CC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100011772453 [0,1,0,0,1,0|0,0,0]=2 3825 B11R1.21 CC(=O)c1cnc(c(c1)C)O 271570a_203496583355_100009864263 [0,1,0,0,1,0|2,0,0]=4 3826 B11R1.21 CC(=O)c1cnc(c(c1)O)F 271570a_203496583355_200010135287 [0,1,0,0,1,0|1,0,0]=3 3827 B11R1.21 CC(C)c1ccc(c(c1)O)N 271570a_203496583355_100011218581 [0,1,0,0,1,0|1,0,1]=4 3828 B11R1.21 CC(O)c1ccc(c(c1)O)F 271570a_203496583355_100011191524 [0,1,0,0,1,0|0,0,2]=4 3829 B11R1.21 CN(C)c1ccc(c(c1)O)N 271570a_203496583355_200013039233 [0,1,0,0,1,0|2,0,0]=4 3830 B11R1.21 C[C@H](N)c1ccc(c(c1)O)F 271570a_203496583355_100000753309 [0,1,0,0,1,0|1,0,1]=4 3831 B11R1.21 Cc1cc(ccc1Br)C(=O)[13CH3] 1458a_100000692631_200025704644 [0,1,0,0,1,0|1,0,0]=3 3832 B11R1.21 Cc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000686306_200025704644 [0,1,0,0,1,0|1,0,0]=3 3833 B11R1.21 Cc1cc(ccc1F)C(=O)[13CH3] 1458a_100000751819_200025704644 [0,1,0,0,1,0|1,0,0]=3 3834 B11R1.21 Cc1cc(ccc1I)C(=O)[13CH3] 1458a_100000751300_200025704644 [0,1,0,0,1,0|1,0,0]=3 3835 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [0,1,0,0,1,0|2,0,0]=4 3836 B11R1.21 Cc1cc(ccc1O)C(=O)[13CH3] 1458a_100000685612_200025704644 [0,1,0,0,1,0|1,0,0]=3 3837 B11R1.21 Cc1ccc(cc1Br)C(=O)[13CH3] 1458a_100000186397_200025704644 [0,1,0,0,1,0|1,0,0]=3 3838 B11R1.21 Cc1ccc(cc1C)C(=O)[13CH3] 1458a_100000210898_200025704644 [0,1,0,0,1,0|1,0,0]=3 3839 B11R1.21 Cc1ccc(cc1Cl)C(=O)[13CH3] 1458a_100000751740_200025704644 [0,1,0,0,1,0|1,0,0]=3 3840 B11R1.21 Cc1ccc(cc1F)C(=O)[13CH3] 1458a_100000212313_200025704644 [0,1,0,0,1,0|1,0,0]=3 3841 B11R1.21 Cc1ccc(cc1I)C(=O)[13CH3] 1458a_100000751299_200025704644 [0,1,0,0,1,0|1,0,0]=3 3842 B11R1.21 Cc1ccc(cc1O)C(=O)N 271570a_203496583355_100000186401 [0,1,0,0,1,0|1,0,0]=3 3843 B11R1.21 Cc1ccc(cc1O)C(=O)[13CH3] 1458a_100000233767_200025704644 [0,1,0,0,1,0|0,0,0]=2 3844 B11R1.21 NC(=O)c1ccc(c(c1)Br)O 271570a_203496583355_100009814583 [0,1,0,0,1,0|2,0,0]=4 3845 B11R1.21 NC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100000686215 [0,1,0,0,1,0|2,0,0]=4 3846 B11R1.21 NC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011202321 [0,1,0,0,1,0|1,0,0]=3 3847 B11R1.21 NC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012344895 [0,1,0,0,1,0|1,0,0]=3 3848 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Br 1458a_100012339404_200025704644 [0,1,0,0,1,0|1,0,0]=3 3849 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)Cl 1458a_100000691181_200025704644 [0,1,0,0,1,0|1,0,0]=3 3850 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)F 1458a_100000760357_200025704644 [0,1,0,0,1,0|1,0,0]=3 3851 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)I 1458a_100000739115_200025704644 [0,1,0,0,1,0|1,0,0]=3 3852 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Br)O 1458a_100000189672_200025704644 [0,1,0,0,1,0|1,0,0]=3 3853 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Br 1458a_100000687082_200025704644 [0,1,0,0,1,0|1,0,0]=3 3854 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)Cl 1458a_100000210401_200025704644 [0,1,0,0,1,0|1,0,0]=3 3855 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)F 1458a_100000686462_200025704644 [0,1,0,0,1,0|1,0,0]=3 3856 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)I 1458a_100000684831_200025704644 [0,1,0,0,1,0|1,0,0]=3 3857 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_200025704644 [0,1,0,0,1,0|1,0,0]=3 3858 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Br 1458a_100000743946_200025704644 [0,1,0,0,1,0|1,0,0]=3 3859 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)Cl 1458a_100000743183_200025704644 [0,1,0,0,1,0|1,0,0]=3 3860 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)F 1458a_100000209822_200025704644 [0,1,0,0,1,0|1,0,0]=3 3861 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)I 1458a_100000062624_200025704644 [0,1,0,0,1,0|1,0,0]=3 3862 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)F)O 1458a_100000185466_200025704644 [0,1,0,0,1,0|1,0,0]=3 3863 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Br 1458a_100012343876_200025704644 [0,1,0,0,1,0|1,0,0]=3 3864 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)Cl 1458a_100000739381_200025704644 [0,1,0,0,1,0|1,0,0]=3 3865 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)F 1458a_100000688015_200025704644 [0,1,0,0,1,0|1,0,0]=3 3866 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)I 1458a_100000725830_200025704644 [0,1,0,0,1,0|1,0,0]=3 3867 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)I)O 1458a_100000037485_200025704644 [0,1,0,0,1,0|1,0,0]=3 3868 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Br 1458a_100000689001_200025704644 [0,1,0,0,1,0|0,0,0]=2 3869 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_200025704644 [0,1,0,0,1,0|0,0,0]=2 3870 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)F 1458a_100000035894_200025704644 [0,1,0,0,1,0|0,0,0]=2 3871 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)I 1458a_100000239334_200025704644 [0,1,0,0,1,0|0,0,0]=2 3872 B11R1.21 [13CH3]C(=O)c1ccc(c(c1)O)O 1458a_100000212155_200025704644 [0,1,0,0,1,0|0,0,0]=2 3873 B11R1.74 C=C(C)c1cc(cc(c1)Br)Br 271570a_100000694244_100009814770 [0,1,0,0,1,0|2,0,0]=4 3874 B11R1.74 C=C(C)c1cc(cc(c1)Br)Cl 271570a_100000694244_100009814755 [0,1,0,0,1,0|2,0,0]=4 3875 B11R1.74 C=C(C)c1cc(cc(c1)Br)F 271570a_100000694244_100009814764 [0,1,0,0,1,0|2,0,0]=4 3876 B11R1.74 C=C(C)c1cc(cc(c1)Br)N 271570a_100000694244_100009814763 [0,1,0,0,1,0|2,0,0]=4 3877 B11R1.74 C=C(C)c1cc(cc(c1)Br)O 271570a_100000694244_100010068917 [0,1,0,0,1,0|1,0,0]=3 3878 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [0,1,0,0,1,0|2,0,0]=4 3879 B11R1.74 C=C(C)c1cc(cc(c1)Cl)C 271570a_100000694244_100010172791 [0,1,0,0,1,0|2,0,0]=4 3880 B11R1.74 C=C(C)c1cc(cc(c1)Cl)Cl 271570a_100000694244_100000747138 [0,1,0,0,1,0|2,0,0]=4 3881 B11R1.74 C=C(C)c1cc(cc(c1)Cl)F 271570a_100000694244_100013859453 [0,1,0,0,1,0|2,0,0]=4 3882 B11R1.74 C=C(C)c1cc(cc(c1)Cl)N 271570a_100000694244_100010147676 [0,1,0,0,1,0|2,0,0]=4 3883 B11R1.74 C=C(C)c1cc(cc(c1)Cl)O 271570a_100000694244_100010068924 [0,1,0,0,1,0|1,0,0]=3 3884 B11R1.74 C=C(C)c1cc(cc(c1)F)C 271570a_100000694244_100011356977 [0,1,0,0,1,0|2,0,0]=4 3885 B11R1.74 C=C(C)c1cc(cc(c1)F)F 271570a_100000694244_100011218498 [0,1,0,0,1,0|2,0,0]=4 3886 B11R1.74 C=C(C)c1cc(cc(c1)F)N 271570a_100000694244_100011356972 [0,1,0,0,1,0|2,0,0]=4 3887 B11R1.74 C=C(C)c1cc(cc(c1)F)O 271570a_100000694244_100000717995 [0,1,0,0,1,0|1,0,0]=3 3888 B11R1.74 C=C(C)c1cc(cc(c1)N)C 271570a_100000694244_100000695972 [0,1,0,0,1,0|2,0,0]=4 3889 B11R1.74 C=C(C)c1cc(cc(c1)N)N 271570a_100000694244_100011999608 [0,1,0,0,1,0|2,0,0]=4 3890 B11R1.74 C=C(C)c1cc(cc(c1)O)C 271570a_100000694244_100011999630 [0,1,0,0,1,0|1,0,0]=3 3891 B11R1.74 C=C(C)c1cc(cc(c1)O)O 271570a_100000694244_100009868816 [0,1,0,0,1,0|1,0,0]=3 3892 B11R1.74 CC(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200000210301 [0,1,0,0,1,0|1,0,0]=3 3893 B11R1.74 CC(=O)c1cc(cc(c1)Br)C 1458a_100000760426_200000210301 [0,1,0,0,1,0|1,0,0]=3 3894 B11R1.74 CC(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200000210301 [0,1,0,0,1,0|1,0,0]=3 3895 B11R1.74 CC(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200000210301 [0,1,0,0,1,0|1,0,0]=3 3896 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200000210301 [0,1,0,0,1,0|0,0,0]=2 3897 B11R1.74 CC(=O)c1cc(cc(c1)Br)O 271570a_203496583355_100010005435 [0,1,0,0,1,0|0,0,0]=2 3898 B11R1.74 CC(=O)c1cc(cc(c1)C)C 1458a_100000210874_200000210301 [0,1,0,0,1,0|1,0,0]=3 3899 B11R1.74 CC(=O)c1cc(cc(c1)Cl)C 1458a_100000684526_200000210301 [0,1,0,0,1,0|1,0,0]=3 3900 B11R1.74 CC(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200000210301 [0,1,0,0,1,0|1,0,0]=3 3901 B11R1.74 CC(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200000210301 [0,1,0,0,1,0|1,0,0]=3 3902 B11R1.74 CC(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200000210301 [0,1,0,0,1,0|0,0,0]=2 3903 B11R1.74 CC(=O)c1cc(cc(c1)F)C 1458a_100000763163_200000210301 [0,1,0,0,1,0|1,0,0]=3 3904 B11R1.74 CC(=O)c1cc(cc(c1)F)F 1458a_100000211655_200000210301 [0,1,0,0,1,0|1,0,0]=3 3905 B11R1.74 CC(=O)c1cc(cc(c1)F)O 1458a_100012017291_200000210301 [0,1,0,0,1,0|0,0,0]=2 3906 B11R1.74 CC(=O)c1cc(cc(c1)F)O 271570a_203496583355_100012361402 [0,1,0,0,1,0|0,0,0]=2 3907 B11R1.74 CC(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200000210301 [0,1,0,0,1,0|1,0,0]=3 3908 B11R1.74 CC(=O)c1cc(cc(c1)I)C 1458a_100000729426_200000210301 [0,1,0,0,1,0|1,0,0]=3 3909 B11R1.74 CC(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200000210301 [0,1,0,0,1,0|1,0,0]=3 3910 B11R1.74 CC(=O)c1cc(cc(c1)I)F 1458a_100012047268_200000210301 [0,1,0,0,1,0|1,0,0]=3 3911 B11R1.74 CC(=O)c1cc(cc(c1)I)I 1458a_100011204819_200000210301 [0,1,0,0,1,0|1,0,0]=3 3912 B11R1.74 CC(=O)c1cc(cc(c1)O)C 1458a_100000094094_200000210301 [0,1,0,0,1,0|0,0,0]=2 3913 B11R1.74 CC(=O)c1cc(cc(c1)O)C 271570a_203496583355_100000694479 [0,1,0,0,1,0|0,0,0]=2 3914 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [0,1,0,0,1,0|1,0,0]=3 3915 B11R1.74 CC(C)c1cc(cc(c1)Br)O 271570a_203496583355_200015473176 [0,1,0,0,1,0|1,0,1]=4 3916 B11R1.74 CC(C)c1cc(cc(c1)O)N 271570a_203496583355_100010369243 [0,1,0,0,1,0|1,0,1]=4 3917 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [0,1,0,0,1,0|1,0,0]=3 3918 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Br 1458a_100000760426_200025704644 [0,1,0,0,1,0|1,0,0]=3 3919 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])C 1458a_100000210874_200025704644 [0,1,0,0,1,0|1,0,0]=3 3920 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])Cl 1458a_100000684526_200025704644 [0,1,0,0,1,0|1,0,0]=3 3921 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])F 1458a_100000763163_200025704644 [0,1,0,0,1,0|1,0,0]=3 3922 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])I 1458a_100000729426_200025704644 [0,1,0,0,1,0|1,0,0]=3 3923 B11R1.74 Cc1cc(cc(c1)C(=O)[13CH3])O 1458a_100000094094_200025704644 [0,1,0,0,1,0|0,0,0]=2 3924 B11R1.74 NC(=O)c1cc(cc(c1)F)O 271570a_203496583355_200011280034 [0,1,0,0,1,0|1,0,0]=3 3925 B11R1.74 NC(=O)c1cc(cc(c1)O)O 271570a_203496583355_100010084318 [0,1,0,0,1,0|1,0,0]=3 3926 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Br 1458a_100000687083_200025704644 [0,1,0,0,1,0|1,0,0]=3 3927 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)Cl 1458a_100000687899_200025704644 [0,1,0,0,1,0|1,0,0]=3 3928 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)F 1458a_100000739618_200025704644 [0,1,0,0,1,0|1,0,0]=3 3929 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Br)O 1458a_100011934545_200025704644 [0,1,0,0,1,0|0,0,0]=2 3930 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)Cl 1458a_100000210701_200025704644 [0,1,0,0,1,0|1,0,0]=3 3931 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)F 1458a_100000685768_200025704644 [0,1,0,0,1,0|1,0,0]=3 3932 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)Cl)O 1458a_100011997059_200025704644 [0,1,0,0,1,0|0,0,0]=2 3933 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)F 1458a_100000211655_200025704644 [0,1,0,0,1,0|1,0,0]=3 3934 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)F)O 1458a_100012017291_200025704644 [0,1,0,0,1,0|0,0,0]=2 3935 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Br 1458a_100000689235_200025704644 [0,1,0,0,1,0|1,0,0]=3 3936 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)Cl 1458a_100012047205_200025704644 [0,1,0,0,1,0|1,0,0]=3 3937 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)F 1458a_100012047268_200025704644 [0,1,0,0,1,0|1,0,0]=3 3938 B11R1.74 [13CH3]C(=O)c1cc(cc(c1)I)I 1458a_100011204819_200025704644 [0,1,0,0,1,0|1,0,0]=3 3939 B11R1.155 CC(C)(C)c1cccc(c1)O 271570a_203496583355_100009816526 [0,1,0,0,1,0|1,0,1]=4 3940 B11R1.155 CC(C)(N)c1cccc(c1)O 271570a_203496583355_100016995529 [0,1,0,0,1,0|1,0,1]=4 3941 B11R1.155 CC(C)(O)c1cccc(c1)O 271570a_203496583355_100011346009 [0,1,0,0,1,0|0,0,2]=4 3942 B11R1.155 CC(F)(F)c1cccc(c1)O 271570a_203496583355_100010232180 [0,1,0,0,1,0|1,0,1]=4 3943 B11R1.155 CS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815773 [0,1,0,0,1,0|1,0,0]=3 3944 B11R1.155 CS(=O)(=O)c1cccc(n1)O 271570a_203496583355_100010191205 [0,1,0,0,1,0|2,0,0]=4 3945 B11R1.155 CS(=O)(=O)c1ccnc(c1)O 271570a_203496583355_100016215246 [0,1,0,0,1,0|2,0,0]=4 3946 B11R1.155 CS(=O)(=O)c1cncc(c1)O 271570a_203496583355_100000702611 [0,1,0,0,1,0|2,0,0]=4 3947 B11R1.155 C[Si](C)(C)c1cccc(c1)O 271570a_203496583355_100009816414 [0,1,0,0,1,0|1,1,0]=4 3948 B11R1.155 NS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000164563 [0,1,0,0,1,0|2,0,0]=4 3949 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [0,1,0,0,1,0|1,0,0]=3 3950 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [0,1,0,0,1,0|2,0,0]=4 3951 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [0,1,0,0,1,0|2,0,0]=4 3952 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [0,1,0,0,1,0|2,0,0]=4 3953 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [0,1,0,0,1,0|2,0,0]=4 3954 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [0,1,0,0,1,0|2,0,0]=4 3955 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [0,1,0,0,1,0|1,0,0]=3 3956 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [0,1,0,0,1,0|2,0,0]=4 3957 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [0,1,0,0,1,0|2,0,0]=4 3958 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [0,1,0,0,1,0|2,0,0]=4 3959 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [0,1,0,0,1,0|2,0,0]=4 3960 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [0,1,0,0,1,0|1,0,0]=3 3961 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [0,1,0,0,1,0|2,0,0]=4 3962 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [0,1,0,0,1,0|2,0,0]=4 3963 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [0,1,0,0,1,0|2,0,0]=4 3964 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [0,1,0,0,1,0|2,0,0]=4 3965 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [0,1,0,0,1,0|2,0,0]=4 3966 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [0,1,0,0,1,0|1,0,0]=3 3967 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [0,1,0,0,1,0|2,0,0]=4 3968 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [0,1,0,0,1,0|2,0,0]=4 3969 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [0,1,0,0,1,0|2,0,0]=4 3970 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [0,1,0,0,1,0|2,0,0]=4 3971 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [0,1,0,0,1,0|2,0,0]=4 3972 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [0,1,0,0,1,0|1,0,0]=3 3973 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [0,1,0,0,1,0|2,0,0]=4 3974 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [0,1,0,0,1,0|2,0,0]=4 3975 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [0,1,0,0,1,0|2,0,0]=4 3976 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [0,1,0,0,1,0|2,0,0]=4 3977 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [0,1,0,0,1,0|2,0,0]=4 3978 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [0,1,0,0,1,0|1,0,0]=3 3979 B11R1.159 C=C(C)c1ccnc(c1C)O 271570a_100000694244_100009858498 [0,1,0,0,1,0|2,0,0]=4 3980 B11R1.159 C=C(C)c1nccc(c1F)O 271570a_100000694244_100009876375 [0,1,0,0,1,0|2,0,0]=4 3981 B11R1.159 C=C(C)c1nccc(c1N)O 271570a_100000694244_100000128729 [0,1,0,0,1,0|2,0,0]=4 3982 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [0,1,0,0,1,0|1,0,0]=3 3983 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [0,1,0,0,1,0|1,0,0]=3 3984 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [0,1,0,0,1,0|1,0,0]=3 3985 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [0,1,0,0,1,0|1,0,0]=3 3986 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [0,1,0,0,1,0|1,0,0]=3 3987 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [0,1,0,0,1,0|0,0,0]=2 3988 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [0,1,0,0,1,0|1,0,0]=3 3989 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [0,1,0,0,1,0|1,0,0]=3 3990 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [0,1,0,0,1,0|1,0,0]=3 3991 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [0,1,0,0,1,0|1,0,0]=3 3992 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [0,1,0,0,1,0|1,0,0]=3 3993 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [0,1,0,0,1,0|0,0,0]=2 3994 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [0,1,0,0,1,0|0,0,0]=2 3995 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [0,1,0,0,1,0|1,0,0]=3 3996 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [0,1,0,0,1,0|1,0,0]=3 3997 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [0,1,0,0,1,0|1,0,0]=3 3998 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [0,1,0,0,1,0|1,0,0]=3 3999 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [0,1,0,0,1,0|1,0,0]=3 4000 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [0,1,0,0,1,0|0,0,0]=2 4001 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [0,1,0,0,1,0|1,0,0]=3 4002 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [0,1,0,0,1,0|1,0,0]=3 4003 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [0,1,0,0,1,0|1,0,0]=3 4004 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [0,1,0,0,1,0|1,0,0]=3 4005 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [0,1,0,0,1,0|1,0,0]=3 4006 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [0,1,0,0,1,0|0,0,0]=2 4007 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [0,1,0,0,1,0|0,0,0]=2 4008 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [0,1,0,0,1,0|1,0,0]=3 4009 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [0,1,0,0,1,0|1,0,0]=3 4010 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [0,1,0,0,1,0|1,0,0]=3 4011 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [0,1,0,0,1,0|1,0,0]=3 4012 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [0,1,0,0,1,0|0,0,0]=2 4013 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,1,0,0,1,0|1,0,0]=3 4014 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,1,0,0,1,0|1,0,0]=3 4015 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,1,0,0,1,0|1,0,0]=3 4016 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,1,0,0,1,0|1,0,0]=3 4017 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,1,0,0,1,0|1,0,0]=3 4018 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,1,0,0,1,0|0,0,0]=2 4019 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,1,0,0,1,0|0,0,0]=2 4020 B11R1.159 CC(=O)c1ccnc(c1N)O 271570a_203496583355_200000063496 [0,1,0,0,1,0|1,0,0]=3 4021 B11R1.159 CC(=O)c1nccc(c1F)O 271570a_203496583355_100010729024 [0,1,0,0,1,0|1,0,0]=3 4022 B11R1.159 CC(C)c1cccc(c1N)O 271570a_203496583355_100010571509 [0,1,0,0,1,0|1,0,1]=4 4023 B11R1.159 CC(O)c1cccc(c1F)O 271570a_203496583355_200012356376 [0,1,0,0,1,0|0,0,2]=4 4024 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [0,1,0,0,1,0|1,0,0]=3 4025 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [0,1,0,0,1,0|1,0,0]=3 4026 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [0,1,0,0,1,0|1,0,0]=3 4027 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [0,1,0,0,1,0|1,0,0]=3 4028 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [0,1,0,0,1,0|1,0,0]=3 4029 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [0,1,0,0,1,0|0,0,0]=2 4030 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [0,1,0,0,1,0|1,0,0]=3 4031 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [0,1,0,0,1,0|1,0,0]=3 4032 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [0,1,0,0,1,0|1,0,0]=3 4033 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [0,1,0,0,1,0|1,0,0]=3 4034 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [0,1,0,0,1,0|1,0,0]=3 4035 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [0,1,0,0,1,0|2,0,0]=4 4036 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,1,0,0,1,0|1,0,0]=3 4037 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [0,1,0,0,1,0|1,0,0]=3 4038 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [0,1,0,0,1,0|1,0,0]=3 4039 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [0,1,0,0,1,0|2,0,0]=4 4040 B11R1.159 NC(=O)c1ccnc(c1N)O 271570a_203496583355_100000080204 [0,1,0,0,1,0|2,0,0]=4 4041 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [0,1,0,0,1,0|1,0,0]=3 4042 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [0,1,0,0,1,0|1,0,0]=3 4043 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [0,1,0,0,1,0|1,0,0]=3 4044 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [0,1,0,0,1,0|1,0,0]=3 4045 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [0,1,0,0,1,0|0,0,0]=2 4046 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [0,1,0,0,1,0|1,0,0]=3 4047 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [0,1,0,0,1,0|1,0,0]=3 4048 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [0,1,0,0,1,0|1,0,0]=3 4049 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [0,1,0,0,1,0|1,0,0]=3 4050 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [0,1,0,0,1,0|0,0,0]=2 4051 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [0,1,0,0,1,0|1,0,0]=3 4052 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [0,1,0,0,1,0|1,0,0]=3 4053 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [0,1,0,0,1,0|1,0,0]=3 4054 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [0,1,0,0,1,0|1,0,0]=3 4055 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [0,1,0,0,1,0|0,0,0]=2 4056 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [0,1,0,0,1,0|1,0,0]=3 4057 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [0,1,0,0,1,0|1,0,0]=3 4058 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [0,1,0,0,1,0|1,0,0]=3 4059 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [0,1,0,0,1,0|0,0,0]=2 4060 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,1,0,0,1,0|1,0,0]=3 4061 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,1,0,0,1,0|1,0,0]=3 4062 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,1,0,0,1,0|1,0,0]=3 4063 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,1,0,0,1,0|0,0,0]=2 4064 B11R1.167 C=C(C)c1cc(ccc1Br)Br 271570a_100000694244_100011483371 [0,1,0,0,1,0|2,0,0]=4 4065 B11R1.167 C=C(C)c1cc(ccc1Br)C 271570a_100000694244_100012353751 [0,1,0,0,1,0|2,0,0]=4 4066 B11R1.167 C=C(C)c1cc(ccc1Br)Cl 271570a_100000694244_100012339723 [0,1,0,0,1,0|2,0,0]=4 4067 B11R1.167 C=C(C)c1cc(ccc1Br)F 271570a_100000694244_100011217576 [0,1,0,0,1,0|2,0,0]=4 4068 B11R1.167 C=C(C)c1cc(ccc1Br)N 271570a_100000694244_100000750459 [0,1,0,0,1,0|2,0,0]=4 4069 B11R1.167 C=C(C)c1cc(ccc1Br)O 271570a_100000694244_100012339312 [0,1,0,0,1,0|1,0,0]=3 4070 B11R1.167 C=C(C)c1cc(ccc1C)Br 271570a_100000694244_100011344865 [0,1,0,0,1,0|2,0,0]=4 4071 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,1,0,0,1,0|2,0,0]=4 4072 B11R1.167 C=C(C)c1cc(ccc1C)Cl 271570a_100000694244_100011263213 [0,1,0,0,1,0|2,0,0]=4 4073 B11R1.167 C=C(C)c1cc(ccc1C)F 271570a_100000694244_100011218078 [0,1,0,0,1,0|2,0,0]=4 4074 B11R1.167 C=C(C)c1cc(ccc1C)N 271570a_100000694244_100000736455 [0,1,0,0,1,0|2,0,0]=4 4075 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [0,1,0,0,1,0|1,0,0]=3 4076 B11R1.167 C=C(C)c1cc(ccc1Cl)Br 271570a_100000694244_100011772130 [0,1,0,0,1,0|2,0,0]=4 4077 B11R1.167 C=C(C)c1cc(ccc1Cl)C 271570a_100000694244_100012356289 [0,1,0,0,1,0|2,0,0]=4 4078 B11R1.167 C=C(C)c1cc(ccc1Cl)Cl 271570a_100000694244_100000707729 [0,1,0,0,1,0|2,0,0]=4 4079 B11R1.167 C=C(C)c1cc(ccc1Cl)F 271570a_100000694244_100011217299 [0,1,0,0,1,0|2,0,0]=4 4080 B11R1.167 C=C(C)c1cc(ccc1Cl)N 271570a_100000694244_100012360549 [0,1,0,0,1,0|2,0,0]=4 4081 B11R1.167 C=C(C)c1cc(ccc1Cl)O 271570a_100000694244_100000049588 [0,1,0,0,1,0|1,0,0]=3 4082 B11R1.167 C=C(C)c1cc(ccc1F)Br 271570a_100000694244_100011217312 [0,1,0,0,1,0|2,0,0]=4 4083 B11R1.167 C=C(C)c1cc(ccc1F)C 271570a_100000694244_100000736223 [0,1,0,0,1,0|2,0,0]=4 4084 B11R1.167 C=C(C)c1cc(ccc1F)Cl 271570a_100000694244_100011218116 [0,1,0,0,1,0|2,0,0]=4 4085 B11R1.167 C=C(C)c1cc(ccc1F)F 271570a_100000694244_100000750033 [0,1,0,0,1,0|2,0,0]=4 4086 B11R1.167 C=C(C)c1cc(ccc1F)N 271570a_100000694244_100000760356 [0,1,0,0,1,0|2,0,0]=4 4087 B11R1.167 C=C(C)c1cc(ccc1F)O 271570a_100000694244_100000693481 [0,1,0,0,1,0|1,0,0]=3 4088 B11R1.167 C=C(C)c1cc(ccc1N)Br 271570a_100000694244_100000187925 [0,1,0,0,1,0|2,0,0]=4 4089 B11R1.167 C=C(C)c1cc(ccc1N)C 271570a_100000694244_100000210942 [0,1,0,0,1,0|2,0,0]=4 4090 B11R1.167 C=C(C)c1cc(ccc1N)Cl 271570a_100000694244_100000761889 [0,1,0,0,1,0|2,0,0]=4 4091 B11R1.167 C=C(C)c1cc(ccc1N)F 271570a_100000694244_100000760547 [0,1,0,0,1,0|2,0,0]=4 4092 B11R1.167 C=C(C)c1cc(ccc1N)N 271570a_100000694244_100011534242 [0,1,0,0,1,0|2,0,0]=4 4093 B11R1.167 C=C(C)c1cc(ccc1N)O 271570a_100000694244_100012001276 [0,1,0,0,1,0|1,0,0]=3 4094 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [0,1,0,0,1,0|2,0,0]=4 4095 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [0,1,0,0,1,0|2,0,0]=4 4096 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [0,1,0,0,1,0|2,0,0]=4 4097 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [0,1,0,0,1,0|2,0,0]=4 4098 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [0,1,0,0,1,0|2,0,0]=4 4099 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [0,1,0,0,1,0|1,0,0]=3 4100 B11R1.167 C=C(C)c1cc(cnc1C)O 271570a_100000694244_100009819603 [0,1,0,0,1,0|2,0,0]=4 4101 B11R1.167 C=C(C)c1cc(cnc1F)O 271570a_100000694244_100009817267 [0,1,0,0,1,0|2,0,0]=4 4102 B11R1.167 C=C(C)c1cc(ncc1C)O 271570a_100000694244_100009831917 [0,1,0,0,1,0|2,0,0]=4 4103 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [0,1,0,0,1,0|1,0,0]=3 4104 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [0,1,0,0,1,0|1,0,0]=3 4105 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [0,1,0,0,1,0|1,0,0]=3 4106 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [0,1,0,0,1,0|1,0,0]=3 4107 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [0,1,0,0,1,0|1,0,0]=3 4108 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [0,1,0,0,1,0|0,0,0]=2 4109 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [0,1,0,0,1,0|1,0,0]=3 4110 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [0,1,0,0,1,0|1,0,0]=3 4111 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [0,1,0,0,1,0|1,0,0]=3 4112 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [0,1,0,0,1,0|1,0,0]=3 4113 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [0,1,0,0,1,0|1,0,0]=3 4114 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [0,1,0,0,1,0|0,0,0]=2 4115 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [0,1,0,0,1,0|0,0,0]=2 4116 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [0,1,0,0,1,0|1,0,0]=3 4117 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [0,1,0,0,1,0|1,0,0]=3 4118 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [0,1,0,0,1,0|1,0,0]=3 4119 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [0,1,0,0,1,0|1,0,0]=3 4120 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [0,1,0,0,1,0|1,0,0]=3 4121 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [0,1,0,0,1,0|0,0,0]=2 4122 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [0,1,0,0,1,0|0,0,0]=2 4123 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [0,1,0,0,1,0|1,0,0]=3 4124 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [0,1,0,0,1,0|1,0,0]=3 4125 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [0,1,0,0,1,0|1,0,0]=3 4126 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [0,1,0,0,1,0|1,0,0]=3 4127 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [0,1,0,0,1,0|1,0,0]=3 4128 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [0,1,0,0,1,0|0,0,0]=2 4129 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [0,1,0,0,1,0|0,0,0]=2 4130 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [0,1,0,0,1,0|1,0,0]=3 4131 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [0,1,0,0,1,0|1,0,0]=3 4132 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [0,1,0,0,1,0|1,0,0]=3 4133 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [0,1,0,0,1,0|1,0,0]=3 4134 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [0,1,0,0,1,0|1,0,0]=3 4135 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [0,1,0,0,1,0|0,0,0]=2 4136 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [0,1,0,0,1,0|0,0,0]=2 4137 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,1,0,0,1,0|1,0,0]=3 4138 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,1,0,0,1,0|1,0,0]=3 4139 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,1,0,0,1,0|1,0,0]=3 4140 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,1,0,0,1,0|1,0,0]=3 4141 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,1,0,0,1,0|1,0,0]=3 4142 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,1,0,0,1,0|1,0,0]=3 4143 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,1,0,0,1,0|1,0,0]=3 4144 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,1,0,0,1,0|1,0,0]=3 4145 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,1,0,0,1,0|1,0,0]=3 4146 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,1,0,0,1,0|0,0,0]=2 4147 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,1,0,0,1,0|0,0,0]=2 4148 B11R1.167 CC(=O)c1cc(cnc1C)O 271570a_203496583355_100138557192 [0,1,0,0,1,0|1,0,0]=3 4149 B11R1.167 CC(=O)c1cc(cnc1F)O 271570a_203496583355_100010254234 [0,1,0,0,1,0|1,0,0]=3 4150 B11R1.167 CC(=O)c1cc(cnc1N)O 271570a_203496583355_100010173950 [0,1,0,0,1,0|1,0,0]=3 4151 B11R1.167 CC(=O)c1cc(cnc1O)F 271570a_203496583355_100000118324 [0,1,0,0,1,0|2,0,0]=4 4152 B11R1.167 CC(=O)c1cc(ncc1F)O 271570a_203496583355_100000697832 [0,1,0,0,1,0|1,0,0]=3 4153 B11R1.167 CC(=O)c1nc(ccc1F)O 271570a_203496583355_100009887703 [0,1,0,0,1,0|1,0,0]=3 4154 B11R1.167 CC(=O)c1nc(ncc1C)O 271570a_203496583355_100010687370 [0,1,0,0,1,0|2,0,0]=4 4155 B11R1.167 CC(C)c1cc(ccc1F)O 271570a_203496583355_200053017515 [0,1,0,0,1,0|1,0,1]=4 4156 B11R1.167 CC(C)c1cc(ccc1N)O 271570a_203496583355_100000694223 [0,1,0,0,1,0|1,0,1]=4 4157 B11R1.167 CC(C)c1cc(ccc1O)O 271570a_203496583355_100000691460 [0,1,0,0,1,0|1,0,1]=4 4158 B11R1.167 CC(O)c1cc(ccc1F)O 271570a_203496583355_100011943926 [0,1,0,0,1,0|0,0,2]=4 4159 B11R1.167 CN(C)c1cc(ccc1F)O 271570a_203496583355_100010288836 [0,1,0,0,1,0|2,0,0]=4 4160 B11R1.167 CN(C)c1cc(ccc1O)O 271570a_203496583355_200010083878 [0,1,0,0,1,0|2,0,0]=4 4161 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [0,1,0,0,1,0|2,0,0]=4 4162 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [0,1,0,0,1,0|1,0,0]=3 4163 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [0,1,0,0,1,0|1,0,0]=3 4164 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [0,1,0,0,1,0|1,0,0]=3 4165 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [0,1,0,0,1,0|1,0,0]=3 4166 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [0,1,0,0,1,0|1,0,0]=3 4167 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,1,0,0,1,0|1,0,0]=3 4168 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [0,1,0,0,1,0|1,0,0]=3 4169 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [0,1,0,0,1,0|1,0,0]=3 4170 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [0,1,0,0,1,0|1,0,0]=3 4171 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [0,1,0,0,1,0|1,0,0]=3 4172 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [0,1,0,0,1,0|1,0,0]=3 4173 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [0,1,0,0,1,0|0,0,0]=2 4174 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [0,1,0,0,1,0|1,0,0]=3 4175 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [0,1,0,0,1,0|1,0,0]=3 4176 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [0,1,0,0,1,0|2,0,0]=4 4177 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [0,1,0,0,1,0|2,0,0]=4 4178 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [0,1,0,0,1,0|2,0,0]=4 4179 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [0,1,0,0,1,0|1,0,0]=3 4180 B11R1.167 NC(=O)c1cc(cnc1N)O 271570a_203496583355_100000701294 [0,1,0,0,1,0|2,0,0]=4 4181 B11R1.167 NC(=O)c1cc(ncc1F)O 271570a_203496583355_100015943597 [0,1,0,0,1,0|2,0,0]=4 4182 B11R1.167 NC(=O)c1cc(ncc1N)O 271570a_203496583355_100012003536 [0,1,0,0,1,0|2,0,0]=4 4183 B11R1.167 NC(=O)c1nc(ccc1N)O 271570a_203496583355_100000093116 [0,1,0,0,1,0|2,0,0]=4 4184 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [0,1,0,0,1,0|1,0,0]=3 4185 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [0,1,0,0,1,0|1,0,0]=3 4186 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [0,1,0,0,1,0|1,0,0]=3 4187 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [0,1,0,0,1,0|1,0,0]=3 4188 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [0,1,0,0,1,0|0,0,0]=2 4189 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [0,1,0,0,1,0|1,0,0]=3 4190 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [0,1,0,0,1,0|1,0,0]=3 4191 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [0,1,0,0,1,0|1,0,0]=3 4192 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [0,1,0,0,1,0|1,0,0]=3 4193 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [0,1,0,0,1,0|0,0,0]=2 4194 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [0,1,0,0,1,0|1,0,0]=3 4195 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [0,1,0,0,1,0|1,0,0]=3 4196 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [0,1,0,0,1,0|1,0,0]=3 4197 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [0,1,0,0,1,0|1,0,0]=3 4198 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [0,1,0,0,1,0|0,0,0]=2 4199 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [0,1,0,0,1,0|1,0,0]=3 4200 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [0,1,0,0,1,0|1,0,0]=3 4201 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [0,1,0,0,1,0|1,0,0]=3 4202 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [0,1,0,0,1,0|1,0,0]=3 4203 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [0,1,0,0,1,0|0,0,0]=2 4204 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,1,0,0,1,0|1,0,0]=3 4205 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,1,0,0,1,0|1,0,0]=3 4206 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,1,0,0,1,0|1,0,0]=3 4207 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,1,0,0,1,0|1,0,0]=3 4208 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,1,0,0,1,0|0,0,0]=2 4209 B11R1.266 C#Cc1cccc(c1)C(=O)C 1458a_100011997762_200000210301 [0,1,0,0,1,0|1,0,0]=3 4210 B11R1.266 C#Cc1cccc(c1)C(=O)[13CH3] 1458a_100011997762_200025704644 [0,1,0,0,1,0|1,0,0]=3 4211 B11R1.266 C=C(C)c1cc(ccn1)CO 271570a_100000694244_100009814636 [0,1,0,0,1,0|2,0,0]=4 4212 B11R1.266 C=C(C)c1cc(ccn1)OC 271570a_100000694244_100011216251 [0,1,0,0,1,0|2,0,0]=4 4213 B11R1.266 C=C(C)c1cccc(c1)C#N 271570a_100000694244_100000189340 [0,1,0,0,1,0|2,0,0]=4 4214 B11R1.266 C=C(C)c1cccc(c1)C=O 271570a_100000694244_100000014684 [0,1,0,0,1,0|1,0,1]=4 4215 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [0,1,0,0,1,0|2,0,0]=4 4216 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [0,1,0,0,1,0|2,0,0]=4 4217 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [0,1,0,0,1,0|2,0,0]=4 4218 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [0,1,0,0,1,0|1,0,0]=3 4219 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [0,1,0,0,1,0|2,0,0]=4 4220 B11R1.266 C=C(C)c1cccc(c1)NN 271570a_100000694244_100000217339 [0,1,0,0,1,0|2,0,0]=4 4221 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [0,1,0,0,1,0|1,0,0]=3 4222 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [0,1,0,0,1,0|1,1,0]=4 4223 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [0,1,0,0,1,0|1,1,0]=4 4224 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [0,1,0,0,1,0|1,1,0]=4 4225 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [0,1,0,0,1,0|1,1,0]=4 4226 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [0,1,0,0,1,0|1,1,0]=4 4227 B11R1.266 C=C(C)c1cccc(n1)CO 271570a_100000694244_100000694195 [0,1,0,0,1,0|2,0,0]=4 4228 B11R1.266 C=C(C)c1cccc(n1)OC 271570a_100000694244_100000760917 [0,1,0,0,1,0|2,0,0]=4 4229 B11R1.266 C=C(C)c1ccnc(c1)CO 271570a_100000694244_100009819072 [0,1,0,0,1,0|2,0,0]=4 4230 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [0,1,0,0,1,0|2,0,0]=4 4231 B11R1.266 C=C(C)c1cncc(c1)CO 271570a_100000694244_100011259137 [0,1,0,0,1,0|2,0,0]=4 4232 B11R1.266 C=C(C)c1cncc(c1)OC 271570a_100000694244_100000684773 [0,1,0,0,1,0|2,0,0]=4 4233 B11R1.266 C=Cc1cc(ccn1)C(=O)C 271570a_100011290941_100000685609 [0,1,0,0,1,0|2,0,0]=4 4234 B11R1.266 C=Cc1cccc(c1)C(=C)C 271570a_100011290941_100012123953 [0,1,0,0,1,0|2,0,0]=4 4235 B11R1.266 C=Cc1cccc(c1)C(=O)C 1458a_100011215009_200000210301 [0,1,0,0,1,0|1,0,0]=3 4236 B11R1.266 C=Cc1cccc(c1)C(=O)C 271570a_100011290941_100000210093 [0,1,0,0,1,0|1,0,0]=3 4237 B11R1.266 C=Cc1cccc(c1)C(=O)N 271570a_100011290941_100000162208 [0,1,0,0,1,0|2,0,0]=4 4238 B11R1.266 C=Cc1cccc(c1)C(=O)[13CH3] 1458a_100011215009_200025704644 [0,1,0,0,1,0|1,0,0]=3 4239 B11R1.266 C=Cc1cccc(c1)S(=O)C 271570a_100011290941_100009816267 [0,1,0,0,1,0|2,0,0]=4 4240 B11R1.266 C=Cc1cccc(n1)C(=O)C 271570a_100011290941_100009816502 [0,1,0,0,1,0|2,0,0]=4 4241 B11R1.266 C=Cc1ccnc(c1)C(=O)C 271570a_100011290941_100000709912 [0,1,0,0,1,0|2,0,0]=4 4242 B11R1.266 C=Cc1cncc(c1)C(=O)C 271570a_100011290941_100011216243 [0,1,0,0,1,0|2,0,0]=4 4243 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_100000709912_200025704644 [0,1,0,0,1,0|1,1,0]=4 4244 B11R1.266 CC(=O)c1cc(ccn1)S[13CH3] 62a_200025704644_100000709912 [0,1,0,0,1,0|1,1,0]=4 4245 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [0,1,0,0,1,0|1,0,0]=3 4246 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [0,1,0,0,1,0|0,0,0]=2 4247 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [0,1,0,0,1,0|0,0,0]=2 4248 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [0,1,0,0,1,0|0,0,0]=2 4249 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [0,1,0,0,1,0|0,1,0]=3 4250 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [0,1,0,0,1,0|0,1,0]=3 4251 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_100009816502_200025704644 [0,1,0,0,1,0|1,1,0]=4 4252 B11R1.266 CC(=O)c1cccc(n1)S[13CH3] 62a_200025704644_100009816502 [0,1,0,0,1,0|1,1,0]=4 4253 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_100000685609_200025704644 [0,1,0,0,1,0|1,1,0]=4 4254 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000685609 [0,1,0,0,1,0|1,1,0]=4 4255 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_100011216243_200025704644 [0,1,0,0,1,0|1,1,0]=4 4256 B11R1.266 CC(=O)c1cncc(c1)S[13CH3] 62a_200025704644_100011216243 [0,1,0,0,1,0|1,1,0]=4 4257 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 34a_100000211816_200025704644 [0,1,0,0,1,0|1,0,1]=4 4258 B11R1.266 CC(C)c1cccc(c1)O[13CH3] 7a_100000211816_200025704644 [0,1,0,0,1,0|1,0,1]=4 4259 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [0,1,0,0,1,0|1,0,1]=4 4260 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [0,1,0,0,1,0|1,0,1]=4 4261 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 34a_100000748013_200025704644 [0,1,0,0,1,0|0,0,2]=4 4262 B11R1.266 CC(O)c1cccc(c1)O[13CH3] 7a_100000748013_200025704644 [0,1,0,0,1,0|0,0,2]=4 4263 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [0,1,0,0,1,0|1,0,0]=3 4264 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [0,1,0,0,1,0|1,0,0]=3 4265 B11R1.266 CN(C)c1cccc(c1)O[13CH3] 34a_100000738785_200025704644 [0,1,0,0,1,0|2,0,0]=4 4266 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [0,1,0,0,1,0|2,0,0]=4 4267 B11R1.266 CNc1cccc(n1)C(=O)C 27a_100102657272_100000085735 [0,1,0,0,1,0|2,0,0]=4 4268 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [0,1,0,0,1,0|0,0,0]=2 4269 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [0,1,0,0,1,0|0,0,0]=2 4270 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [0,1,0,0,1,0|0,0,0]=2 4271 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [0,1,0,0,1,0|1,0,0]=3 4272 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [0,1,0,0,1,0|1,0,0]=3 4273 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [0,1,0,0,1,0|0,0,0]=2 4274 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [0,1,0,0,1,0|1,1,0]=4 4275 B11R1.266 COc1cccc(c1)C(C)C 34a_100000211816_200000210301 [0,1,0,0,1,0|1,0,1]=4 4276 B11R1.266 COc1cccc(c1)C(C)C 7a_100000211816_200000210301 [0,1,0,0,1,0|1,0,1]=4 4277 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [0,1,0,0,1,0|1,0,1]=4 4278 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [0,1,0,0,1,0|1,0,1]=4 4279 B11R1.266 COc1cccc(c1)C(C)O 34a_100000748013_200000210301 [0,1,0,0,1,0|0,0,2]=4 4280 B11R1.266 COc1cccc(c1)C(C)O 7a_100000748013_200000210301 [0,1,0,0,1,0|0,0,2]=4 4281 B11R1.266 COc1cccc(c1)N(C)C 2230a_100000219725_200000210301 [0,1,0,0,1,0|2,0,0]=4 4282 B11R1.266 COc1cccc(c1)N(C)C 269982a_100000219725_200000210301 [0,1,0,0,1,0|2,0,0]=4 4283 B11R1.266 COc1cccc(c1)N(C)C 34a_100000219725_200000210301 [0,1,0,0,1,0|2,0,0]=4 4284 B11R1.266 COc1cccc(c1)N(C)C 34a_100000738785_200000210301 [0,1,0,0,1,0|2,0,0]=4 4285 B11R1.266 COc1cccc(c1)N(C)[13CH3] 2230a_100000219725_200025704644 [0,1,0,0,1,0|2,0,0]=4 4286 B11R1.266 COc1cccc(c1)N(C)[13CH3] 269982a_100000219725_200025704644 [0,1,0,0,1,0|2,0,0]=4 4287 B11R1.266 COc1cccc(c1)N(C)[13CH3] 34a_100000219725_200025704644 [0,1,0,0,1,0|2,0,0]=4 4288 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [0,1,0,0,1,0|2,0,0]=4 4289 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [0,1,0,0,1,0|2,0,0]=4 4290 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [0,1,0,0,1,0|2,0,0]=4 4291 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_100009816267_200025704644 [0,1,0,0,1,0|1,1,0]=4 4292 B11R1.266 CS(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100009816267 [0,1,0,0,1,0|1,1,0]=4 4293 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_100000685609_200000210301 [0,1,0,0,1,0|1,1,0]=4 4294 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_200000210301_100000685609 [0,1,0,0,1,0|1,1,0]=4 4295 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [0,1,0,0,1,0|0,1,0]=3 4296 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [0,1,0,0,1,0|0,1,0]=3 4297 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [0,1,0,0,1,0|0,1,0]=3 4298 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [0,1,0,0,1,0|1,1,0]=4 4299 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [0,1,0,0,1,0|1,1,0]=4 4300 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [0,1,0,0,1,0|0,1,0]=3 4301 B11R1.266 CSc1cccc(c1)S(=O)C 62a_100009816267_200000210301 [0,1,0,0,1,0|1,1,0]=4 4302 B11R1.266 CSc1cccc(c1)S(=O)C 62a_200000210301_100009816267 [0,1,0,0,1,0|1,1,0]=4 4303 B11R1.266 CSc1cccc(n1)C(=O)C 62a_100009816502_200000210301 [0,1,0,0,1,0|1,1,0]=4 4304 B11R1.266 CSc1cccc(n1)C(=O)C 62a_200000210301_100009816502 [0,1,0,0,1,0|1,1,0]=4 4305 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_100000709912_200000210301 [0,1,0,0,1,0|1,1,0]=4 4306 B11R1.266 CSc1ccnc(c1)C(=O)C 62a_200000210301_100000709912 [0,1,0,0,1,0|1,1,0]=4 4307 B11R1.266 CSc1cncc(c1)C(=O)C 62a_100011216243_200000210301 [0,1,0,0,1,0|1,1,0]=4 4308 B11R1.266 CSc1cncc(c1)C(=O)C 62a_200000210301_100011216243 [0,1,0,0,1,0|1,1,0]=4 4309 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [0,1,0,0,1,0|1,0,0]=3 4310 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [0,1,0,0,1,0|0,0,0]=2 4311 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [0,1,0,0,1,0|2,0,0]=4 4312 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [0,1,0,0,1,0|1,0,0]=3 4313 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [0,1,0,0,1,0|1,0,0]=3 4314 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [0,1,0,0,1,0|1,1,0]=4 4315 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [0,1,0,0,1,0|2,0,0]=4 4316 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [0,1,0,0,1,0|2,0,0]=4 4317 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [0,1,0,0,1,0|2,0,0]=4 4318 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [0,1,0,0,1,0|1,1,0]=4 4319 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [0,1,0,0,1,0|1,1,0]=4 4320 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)O 34a_100009815206_100011660834 [0,1,0,0,0,1|1,0,1]=4 4321 B13R1.15 C#C[C@@H](C)OCc1cccc(c1)O 7a_100009815206_100000084143 [0,1,0,0,0,1|1,0,1]=4 4322 B13R1.15 C=CC(=O)NCc1cccc(c1)O 240690a_100000743036_200121576911 [0,1,0,0,0,1|1,0,1]=4 4323 B13R1.15 C=CC(C)OCc1cccc(c1)O 34a_100000695699_100011660834 [0,1,0,0,0,1|1,0,1]=4 4324 B13R1.15 CC(C#N)OCc1cccc(c1)O 34a_100011218135_100011660834 [0,1,0,0,0,1|1,0,1]=4 4325 B13R1.15 CC(CF)OCc1cccc(c1)O 34a_100016041109_100011660834 [0,1,0,0,0,1|1,0,1]=4 4326 B13R1.15 CC(CF)OCc1cccc(c1)O 7a_100016041109_100000084143 [0,1,0,0,0,1|1,0,1]=4 4327 B13R1.15 CC(CN)OCc1cccc(c1)O 34a_100000210904_100011660834 [0,1,0,0,0,1|1,0,1]=4 4328 B13R1.15 CCC(=O)C#Cc1cccc(c1)Br 1458a_100012100324_100000210202 [0,1,0,0,0,1|2,0,0]=4 4329 B13R1.15 CCC(=O)C#Cc1cccc(c1)C 1458a_100011892726_100000210202 [0,1,0,0,0,1|2,0,0]=4 4330 B13R1.15 CCC(=O)C#Cc1cccc(c1)Cl 1458a_100011892777_100000210202 [0,1,0,0,0,1|2,0,0]=4 4331 B13R1.15 CCC(=O)C#Cc1cccc(c1)F 1458a_100011892744_100000210202 [0,1,0,0,0,1|2,0,0]=4 4332 B13R1.15 CCC(=O)C#Cc1cccc(c1)O 1458a_200009909484_100000210202 [0,1,0,0,0,1|1,0,0]=3 4333 B13R1.15 CCC(=O)C=Cc1cccc(c1)Br 1458a_100016258244_100000210202 [0,1,0,0,0,1|2,0,0]=4 4334 B13R1.15 CCC(=O)C=Cc1cccc(c1)Br 6a_100000210085_100000211110 [0,1,0,0,0,1|2,0,0]=4 4335 B13R1.15 CCC(=O)C=Cc1cccc(c1)C 1458a_100000690095_100000210202 [0,1,0,0,0,1|2,0,0]=4 4336 B13R1.15 CCC(=O)C=Cc1cccc(c1)Cl 1458a_100000184502_100000210202 [0,1,0,0,0,1|2,0,0]=4 4337 B13R1.15 CCC(=O)C=Cc1cccc(c1)F 1458a_100000718793_100000210202 [0,1,0,0,0,1|2,0,0]=4 4338 B13R1.15 CCC(=O)C=Cc1cccc(c1)F 6a_100000210812_100000211110 [0,1,0,0,0,1|2,0,0]=4 4339 B13R1.15 CCC(=O)C=Cc1cccc(c1)I 1458a_100020647043_100000210202 [0,1,0,0,0,1|2,0,0]=4 4340 B13R1.15 CCC(=O)C=Cc1cccc(c1)I 6a_100000014684_100000211110 [0,1,0,0,0,1|2,0,0]=4 4341 B13R1.15 CCC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000210202 [0,1,0,0,0,1|2,0,0]=4 4342 B13R1.15 CCC(=O)CCc1cccc(c1)Br 1458a_100000210414_100011740638 [0,1,0,0,0,1|2,0,0]=4 4343 B13R1.15 CCC(=O)CCc1cccc(c1)C 1458a_100000210414_100011713685 [0,1,0,0,0,1|2,0,0]=4 4344 B13R1.15 CCC(=O)CCc1cccc(c1)C 1458a_100000234952_100000210202 [0,1,0,0,0,1|2,0,0]=4 4345 B13R1.15 CCC(=O)CCc1cccc(c1)Cl 1458a_100000210414_100011713710 [0,1,0,0,0,1|2,0,0]=4 4346 B13R1.15 CCC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000210202 [0,1,0,0,0,1|2,0,0]=4 4347 B13R1.15 CCC(=O)CCc1cccc(c1)F 1458a_100000210414_100011217235 [0,1,0,0,0,1|2,0,0]=4 4348 B13R1.15 CCC(=O)CCc1cccc(c1)F 1458a_100000235673_100000210202 [0,1,0,0,0,1|2,0,0]=4 4349 B13R1.15 CCC(=O)CCc1cccc(c1)I 1458a_100010007846_100000210202 [0,1,0,0,0,1|2,0,0]=4 4350 B13R1.15 CCC(=O)CCc1cccc(c1)O 1458a_100011216126_100000210202 [0,1,0,0,0,1|1,0,0]=3 4351 B13R1.15 CCC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000747405 [0,1,0,0,0,1|1,0,1]=4 4352 B13R1.15 CCC(=O)COc1cccc(c1)Br 1458a_100000182359_100000210202 [0,1,0,0,0,1|1,0,0]=3 4353 B13R1.15 CCC(=O)COc1cccc(c1)Br 7a_100000210342_100000747405 [0,1,0,0,0,1|1,0,0]=3 4354 B13R1.15 CCC(=O)COc1cccc(c1)C 1458a_100000183606_100000210202 [0,1,0,0,0,1|1,0,0]=3 4355 B13R1.15 CCC(=O)COc1cccc(c1)C 7a_100000210337_100000747405 [0,1,0,0,0,1|1,0,0]=3 4356 B13R1.15 CCC(=O)COc1cccc(c1)Cl 1458a_100000184978_100000210202 [0,1,0,0,0,1|1,0,0]=3 4357 B13R1.15 CCC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747405 [0,1,0,0,0,1|1,0,0]=3 4358 B13R1.15 CCC(=O)COc1cccc(c1)F 1458a_100000182781_100000210202 [0,1,0,0,0,1|1,0,0]=3 4359 B13R1.15 CCC(=O)COc1cccc(c1)F 7a_100000210426_100000747405 [0,1,0,0,0,1|1,0,0]=3 4360 B13R1.15 CCC(=O)COc1cccc(c1)I 7a_100000211634_100000747405 [0,1,0,0,0,1|1,0,0]=3 4361 B13R1.15 CCC(=O)COc1cncc(c1)Br 7a_100000754920_100000747405 [0,1,0,0,0,1|2,0,0]=4 4362 B13R1.15 CCC(=O)COc1cncc(c1)C 7a_100011830280_100000747405 [0,1,0,0,0,1|2,0,0]=4 4363 B13R1.15 CCC(=O)COc1cncc(c1)Cl 7a_100000032511_100000747405 [0,1,0,0,0,1|2,0,0]=4 4364 B13R1.15 CCC(=O)COc1cncc(c1)F 7a_100011830296_100000747405 [0,1,0,0,0,1|2,0,0]=4 4365 B13R1.15 CCC(=O)CSc1cc(ccn1)O 62a_100000747405_100000762945 [0,1,0,0,0,1|1,1,0]=4 4366 B13R1.15 CCC(=O)CSc1cccc(c1)Br 1458a_100000760868_100000210202 [0,1,0,0,0,1|1,1,0]=4 4367 B13R1.15 CCC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747405 [0,1,0,0,0,1|1,1,0]=4 4368 B13R1.15 CCC(=O)CSc1cccc(c1)Br 62a_100000747405_100000691529 [0,1,0,0,0,1|1,1,0]=4 4369 B13R1.15 CCC(=O)CSc1cccc(c1)C 62a_100000747405_100011215228 [0,1,0,0,0,1|1,1,0]=4 4370 B13R1.15 CCC(=O)CSc1cccc(c1)C 62a_100011215228_100000747405 [0,1,0,0,0,1|1,1,0]=4 4371 B13R1.15 CCC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747405 [0,1,0,0,0,1|1,1,0]=4 4372 B13R1.15 CCC(=O)CSc1cccc(c1)Cl 62a_100000747405_100000699651 [0,1,0,0,0,1|1,1,0]=4 4373 B13R1.15 CCC(=O)CSc1cccc(c1)F 62a_100000685547_100000747405 [0,1,0,0,0,1|1,1,0]=4 4374 B13R1.15 CCC(=O)CSc1cccc(c1)F 62a_100000747405_100000685547 [0,1,0,0,0,1|1,1,0]=4 4375 B13R1.15 CCC(=O)CSc1cccc(c1)N 62a_100000210019_100000747405 [0,1,0,0,0,1|1,1,0]=4 4376 B13R1.15 CCC(=O)CSc1cccc(c1)N 62a_100000747405_100000210019 [0,1,0,0,0,1|1,1,0]=4 4377 B13R1.15 CCC(=O)CSc1cccc(c1)O 62a_100000747405_100000211634 [0,1,0,0,0,1|0,1,0]=3 4378 B13R1.15 CCC(=O)CSc1cccc(c1)[S] 62a_100000747405_114929384022 [0,1,0,0,0,1|0,2,0]=4 4379 B13R1.15 CCC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747405 [0,1,0,0,0,1|0,2,0]=4 4380 B13R1.15 CCC(=O)CSc1cncc(c1)O 62a_100000747405_100000754920 [0,1,0,0,0,1|1,1,0]=4 4381 B13R1.15 CCC(=O)CSc1cncc(c1)O 62a_100000754920_100000747405 [0,1,0,0,0,1|1,1,0]=4 4382 B13R1.15 CCC(=O)NCc1cccc(c1)Br 11a_100000174977_100000210414 [0,1,0,0,0,1|2,0,0]=4 4383 B13R1.15 CCC(=O)NCc1cccc(c1)Br 1626a_100000174977_100000210414 [0,1,0,0,0,1|2,0,0]=4 4384 B13R1.15 CCC(=O)NCc1cccc(c1)Br 240690a_100000174977_100000210414 [0,1,0,0,0,1|2,0,0]=4 4385 B13R1.15 CCC(=O)NCc1cccc(c1)Br 527a_100000174977_100000210414 [0,1,0,0,0,1|2,0,0]=4 4386 B13R1.15 CCC(=O)NCc1cccc(c1)C 11a_100000185548_100000210414 [0,1,0,0,0,1|2,0,0]=4 4387 B13R1.15 CCC(=O)NCc1cccc(c1)C 1626a_100000185548_100000210414 [0,1,0,0,0,1|2,0,0]=4 4388 B13R1.15 CCC(=O)NCc1cccc(c1)C 240690a_100000185548_100000210414 [0,1,0,0,0,1|2,0,0]=4 4389 B13R1.15 CCC(=O)NCc1cccc(c1)C 527a_100000185548_100000210414 [0,1,0,0,0,1|2,0,0]=4 4390 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 11a_100000174878_100000210414 [0,1,0,0,0,1|2,0,0]=4 4391 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 1626a_100000174878_100000210414 [0,1,0,0,0,1|2,0,0]=4 4392 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 240690a_100000174878_100000210414 [0,1,0,0,0,1|2,0,0]=4 4393 B13R1.15 CCC(=O)NCc1cccc(c1)Cl 527a_100000174878_100000210414 [0,1,0,0,0,1|2,0,0]=4 4394 B13R1.15 CCC(=O)NCc1cccc(c1)F 11a_100000174948_100000210414 [0,1,0,0,0,1|2,0,0]=4 4395 B13R1.15 CCC(=O)NCc1cccc(c1)F 1626a_100000174948_100000210414 [0,1,0,0,0,1|2,0,0]=4 4396 B13R1.15 CCC(=O)NCc1cccc(c1)F 240690a_100000174948_100000210414 [0,1,0,0,0,1|2,0,0]=4 4397 B13R1.15 CCC(=O)NCc1cccc(c1)F 527a_100000174948_100000210414 [0,1,0,0,0,1|2,0,0]=4 4398 B13R1.15 CCC(=O)NCc1cccc(c1)I 11a_100000106179_100000210414 [0,1,0,0,0,1|2,0,0]=4 4399 B13R1.15 CCC(=O)NCc1cccc(c1)I 1626a_100000106179_100000210414 [0,1,0,0,0,1|2,0,0]=4 4400 B13R1.15 CCC(=O)NCc1cccc(c1)I 240690a_100000106179_100000210414 [0,1,0,0,0,1|2,0,0]=4 4401 B13R1.15 CCC(=O)NCc1cccc(c1)I 527a_100000106179_100000210414 [0,1,0,0,0,1|2,0,0]=4 4402 B13R1.15 CCC(=O)NCc1cccc(c1)O 240690a_100000743036_100000210414 [0,1,0,0,0,1|1,0,0]=3 4403 B13R1.15 CCC(=O)NCc1cccc(c1)O 271570a_203496583355_200011236840 [0,1,0,0,0,1|1,0,0]=3 4404 B13R1.15 CCC(=O)NCc1cccc(c1)O 527a_100000743036_100000210414 [0,1,0,0,0,1|1,0,0]=3 4405 B13R1.15 CCC(=O)NCc1ccnc(c1)O 11a_100000748557_100000210414 [0,1,0,0,0,1|2,0,0]=4 4406 B13R1.15 CCC(=O)NCc1ccnc(c1)O 240690a_100000748557_100000210414 [0,1,0,0,0,1|2,0,0]=4 4407 B13R1.15 CCC(=O)NCc1ccnc(c1)O 527a_100000748557_100000210414 [0,1,0,0,0,1|2,0,0]=4 4408 B13R1.15 CCC(=O)NNc1cccc(c1)Br 22a_100000217339_100000210414 [0,1,0,0,0,1|2,0,0]=4 4409 B13R1.15 CCC(=O)NNc1cccc(c1)C 22a_100000681630_100000210414 [0,1,0,0,0,1|2,0,0]=4 4410 B13R1.15 CCC(=O)NNc1cccc(c1)Cl 22a_100000184277_100000210414 [0,1,0,0,0,1|2,0,0]=4 4411 B13R1.15 CCC(=O)NNc1cccc(c1)F 22a_100000745080_100000210414 [0,1,0,0,0,1|2,0,0]=4 4412 B13R1.15 CCC(=O)NNc1cccc(c1)I 22a_100020605690_100000210414 [0,1,0,0,0,1|2,0,0]=4 4413 B13R1.15 CCC(C)OCc1cccc(c1)O 7a_100000210228_100000084143 [0,1,0,0,0,1|1,0,1]=4 4414 B13R1.15 CNC(=O)C#Cc1cccc(c1)C 240690a_100102657272_100011892726 [0,1,0,0,0,1|2,0,0]=4 4415 B13R1.15 CNC(=O)C#Cc1cccc(c1)Cl 240690a_100102657272_100011892777 [0,1,0,0,0,1|2,0,0]=4 4416 B13R1.15 CNC(=O)C#Cc1cccc(c1)F 240690a_100102657272_100011892744 [0,1,0,0,0,1|2,0,0]=4 4417 B13R1.15 CNC(=O)C=Cc1cccc(c1)Br 11a_106832991635_100016258244 [0,1,0,0,0,1|2,0,0]=4 4418 B13R1.15 CNC(=O)C=Cc1cccc(c1)Br 1626a_100102657272_100016258244 [0,1,0,0,0,1|2,0,0]=4 4419 B13R1.15 CNC(=O)C=Cc1cccc(c1)Br 240690a_100102657272_100016258244 [0,1,0,0,0,1|2,0,0]=4 4420 B13R1.15 CNC(=O)C=Cc1cccc(c1)C 11a_106832991635_100000690095 [0,1,0,0,0,1|2,0,0]=4 4421 B13R1.15 CNC(=O)C=Cc1cccc(c1)C 1626a_100102657272_100000690095 [0,1,0,0,0,1|2,0,0]=4 4422 B13R1.15 CNC(=O)C=Cc1cccc(c1)C 240690a_100102657272_100000690095 [0,1,0,0,0,1|2,0,0]=4 4423 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl 11a_106832991635_100000184502 [0,1,0,0,0,1|2,0,0]=4 4424 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl 1626a_100102657272_100000184502 [0,1,0,0,0,1|2,0,0]=4 4425 B13R1.15 CNC(=O)C=Cc1cccc(c1)Cl 240690a_100102657272_100000184502 [0,1,0,0,0,1|2,0,0]=4 4426 B13R1.15 CNC(=O)C=Cc1cccc(c1)F 11a_106832991635_100000718793 [0,1,0,0,0,1|2,0,0]=4 4427 B13R1.15 CNC(=O)C=Cc1cccc(c1)F 1626a_100102657272_100000718793 [0,1,0,0,0,1|2,0,0]=4 4428 B13R1.15 CNC(=O)C=Cc1cccc(c1)F 240690a_100102657272_100000718793 [0,1,0,0,0,1|2,0,0]=4 4429 B13R1.15 CNC(=O)C=Cc1cccc(c1)I 11a_106832991635_100020647043 [0,1,0,0,0,1|2,0,0]=4 4430 B13R1.15 CNC(=O)C=Cc1cccc(c1)I 1626a_100102657272_100020647043 [0,1,0,0,0,1|2,0,0]=4 4431 B13R1.15 CNC(=O)C=Cc1cccc(c1)I 240690a_100102657272_100020647043 [0,1,0,0,0,1|2,0,0]=4 4432 B13R1.15 CNC(=O)CCc1cccc(c1)Br 11a_106832991635_100000184314 [0,1,0,0,0,1|2,0,0]=4 4433 B13R1.15 CNC(=O)CCc1cccc(c1)Br 1626a_100102657272_100000184314 [0,1,0,0,0,1|2,0,0]=4 4434 B13R1.15 CNC(=O)CCc1cccc(c1)Br 240690a_100102657272_100000184314 [0,1,0,0,0,1|2,0,0]=4 4435 B13R1.15 CNC(=O)CCc1cccc(c1)Br 527a_100102657272_100000184314 [0,1,0,0,0,1|2,0,0]=4 4436 B13R1.15 CNC(=O)CCc1cccc(c1)C 11a_106832991635_100000234952 [0,1,0,0,0,1|2,0,0]=4 4437 B13R1.15 CNC(=O)CCc1cccc(c1)C 1626a_100102657272_100000234952 [0,1,0,0,0,1|2,0,0]=4 4438 B13R1.15 CNC(=O)CCc1cccc(c1)C 240690a_100102657272_100000234952 [0,1,0,0,0,1|2,0,0]=4 4439 B13R1.15 CNC(=O)CCc1cccc(c1)C 527a_100102657272_100000234952 [0,1,0,0,0,1|2,0,0]=4 4440 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 11a_106832991635_100000235675 [0,1,0,0,0,1|2,0,0]=4 4441 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 1626a_100102657272_100000235675 [0,1,0,0,0,1|2,0,0]=4 4442 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 240690a_100102657272_100000235675 [0,1,0,0,0,1|2,0,0]=4 4443 B13R1.15 CNC(=O)CCc1cccc(c1)Cl 527a_100102657272_100000235675 [0,1,0,0,0,1|2,0,0]=4 4444 B13R1.15 CNC(=O)CCc1cccc(c1)F 11a_106832991635_100000235673 [0,1,0,0,0,1|2,0,0]=4 4445 B13R1.15 CNC(=O)CCc1cccc(c1)F 1626a_100102657272_100000235673 [0,1,0,0,0,1|2,0,0]=4 4446 B13R1.15 CNC(=O)CCc1cccc(c1)F 240690a_100102657272_100000235673 [0,1,0,0,0,1|2,0,0]=4 4447 B13R1.15 CNC(=O)CCc1cccc(c1)F 527a_100102657272_100000235673 [0,1,0,0,0,1|2,0,0]=4 4448 B13R1.15 CNC(=O)CCc1cccc(c1)I 11a_106832991635_100010007846 [0,1,0,0,0,1|2,0,0]=4 4449 B13R1.15 CNC(=O)CCc1cccc(c1)I 1626a_100102657272_100010007846 [0,1,0,0,0,1|2,0,0]=4 4450 B13R1.15 CNC(=O)CCc1cccc(c1)I 240690a_100102657272_100010007846 [0,1,0,0,0,1|2,0,0]=4 4451 B13R1.15 CNC(=O)CCc1cccc(c1)I 527a_100102657272_100010007846 [0,1,0,0,0,1|2,0,0]=4 4452 B13R1.15 CNC(=O)CCc1cccc(c1)O 240690a_100102657272_100011216126 [0,1,0,0,0,1|1,0,0]=3 4453 B13R1.15 CNC(=O)CCc1cccc(c1)O 527a_100102657272_100011216126 [0,1,0,0,0,1|1,0,0]=3 4454 B13R1.15 CNC(=O)CNc1cccc(c1)Br 34a_100000210019_100000183359 [0,1,0,0,0,1|2,0,0]=4 4455 B13R1.15 CNC(=O)CNc1cccc(c1)C 2230a_100000188690_100000183359 [0,1,0,0,0,1|2,0,0]=4 4456 B13R1.15 CNC(=O)CNc1cccc(c1)C 34a_100000188690_100000183359 [0,1,0,0,0,1|2,0,0]=4 4457 B13R1.15 CNC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000183359 [0,1,0,0,0,1|2,0,0]=4 4458 B13R1.15 CNC(=O)CNc1cccc(c1)F 34a_100000210047_100000183359 [0,1,0,0,0,1|2,0,0]=4 4459 B13R1.15 CNC(=O)CNc1cccc(c1)I 34a_100000211102_100000183359 [0,1,0,0,0,1|2,0,0]=4 4460 B13R1.15 CNC(=O)CNc1cccc(c1)O 34a_100000210217_100000183359 [0,1,0,0,0,1|1,0,0]=3 4461 B13R1.15 CNC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000183359 [0,1,0,0,0,1|1,0,1]=4 4462 B13R1.15 CNC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000183359 [0,1,0,0,0,1|1,0,1]=4 4463 B13R1.15 CNC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000183359 [0,1,0,0,0,1|1,0,1]=4 4464 B13R1.15 CNC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000183359 [0,1,0,0,0,1|1,0,1]=4 4465 B13R1.15 CNC(=O)COc1cccc(c1)Br 11a_106832991635_100000182359 [0,1,0,0,0,1|1,0,0]=3 4466 B13R1.15 CNC(=O)COc1cccc(c1)Br 1626a_100102657272_100000182359 [0,1,0,0,0,1|1,0,0]=3 4467 B13R1.15 CNC(=O)COc1cccc(c1)Br 240690a_100102657272_100000182359 [0,1,0,0,0,1|1,0,0]=3 4468 B13R1.15 CNC(=O)COc1cccc(c1)Br 34a_100000210342_100000183359 [0,1,0,0,0,1|1,0,0]=3 4469 B13R1.15 CNC(=O)COc1cccc(c1)Br 527a_100102657272_100000182359 [0,1,0,0,0,1|1,0,0]=3 4470 B13R1.15 CNC(=O)COc1cccc(c1)Br 7a_100000210342_100000183359 [0,1,0,0,0,1|1,0,0]=3 4471 B13R1.15 CNC(=O)COc1cccc(c1)C 11a_106832991635_100000183606 [0,1,0,0,0,1|1,0,0]=3 4472 B13R1.15 CNC(=O)COc1cccc(c1)C 1626a_100102657272_100000183606 [0,1,0,0,0,1|1,0,0]=3 4473 B13R1.15 CNC(=O)COc1cccc(c1)C 240690a_100102657272_100000183606 [0,1,0,0,0,1|1,0,0]=3 4474 B13R1.15 CNC(=O)COc1cccc(c1)C 34a_100000210337_100000183359 [0,1,0,0,0,1|1,0,0]=3 4475 B13R1.15 CNC(=O)COc1cccc(c1)C 527a_100102657272_100000183606 [0,1,0,0,0,1|1,0,0]=3 4476 B13R1.15 CNC(=O)COc1cccc(c1)C 7a_100000210337_100000183359 [0,1,0,0,0,1|1,0,0]=3 4477 B13R1.15 CNC(=O)COc1cccc(c1)Cl 11a_106832991635_100000184978 [0,1,0,0,0,1|1,0,0]=3 4478 B13R1.15 CNC(=O)COc1cccc(c1)Cl 1626a_100102657272_100000184978 [0,1,0,0,0,1|1,0,0]=3 4479 B13R1.15 CNC(=O)COc1cccc(c1)Cl 240690a_100102657272_100000184978 [0,1,0,0,0,1|1,0,0]=3 4480 B13R1.15 CNC(=O)COc1cccc(c1)Cl 34a_100000210295_100000183359 [0,1,0,0,0,1|1,0,0]=3 4481 B13R1.15 CNC(=O)COc1cccc(c1)Cl 527a_100102657272_100000184978 [0,1,0,0,0,1|1,0,0]=3 4482 B13R1.15 CNC(=O)COc1cccc(c1)Cl 7a_100000210295_100000183359 [0,1,0,0,0,1|1,0,0]=3 4483 B13R1.15 CNC(=O)COc1cccc(c1)F 11a_106832991635_100000182781 [0,1,0,0,0,1|1,0,0]=3 4484 B13R1.15 CNC(=O)COc1cccc(c1)F 1626a_100102657272_100000182781 [0,1,0,0,0,1|1,0,0]=3 4485 B13R1.15 CNC(=O)COc1cccc(c1)F 240690a_100102657272_100000182781 [0,1,0,0,0,1|1,0,0]=3 4486 B13R1.15 CNC(=O)COc1cccc(c1)F 34a_100000210426_100000183359 [0,1,0,0,0,1|1,0,0]=3 4487 B13R1.15 CNC(=O)COc1cccc(c1)F 527a_100102657272_100000182781 [0,1,0,0,0,1|1,0,0]=3 4488 B13R1.15 CNC(=O)COc1cccc(c1)F 7a_100000210426_100000183359 [0,1,0,0,0,1|1,0,0]=3 4489 B13R1.15 CNC(=O)COc1cccc(c1)I 34a_100000211634_100000183359 [0,1,0,0,0,1|1,0,0]=3 4490 B13R1.15 CNC(=O)COc1cccc(c1)I 7a_100000211634_100000183359 [0,1,0,0,0,1|1,0,0]=3 4491 B13R1.15 CNC(=O)COc1cccc(c1)N 34a_100000210217_100000183359 [0,1,0,0,0,1|1,0,0]=3 4492 B13R1.15 CNC(=O)COc1cccc(c1)O 271570a_203496583355_200000150594 [0,1,0,0,0,1|0,0,0]=2 4493 B13R1.15 CNC(=O)COc1cccc(n1)F 34a_100011432558_100000183359 [0,1,0,0,0,1|2,0,0]=4 4494 B13R1.15 CNC(=O)COc1ccnc(c1)C 34a_100000688365_100000183359 [0,1,0,0,0,1|2,0,0]=4 4495 B13R1.15 CNC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000183359 [0,1,0,0,0,1|2,0,0]=4 4496 B13R1.15 CNC(=O)COc1ccnc(c1)F 34a_100000732698_100000183359 [0,1,0,0,0,1|2,0,0]=4 4497 B13R1.15 CNC(=O)COc1ccnc(c1)N 34a_100011834064_100000183359 [0,1,0,0,0,1|2,0,0]=4 4498 B13R1.15 CNC(=O)COc1cncc(c1)Br 34a_100000754920_100000183359 [0,1,0,0,0,1|2,0,0]=4 4499 B13R1.15 CNC(=O)COc1cncc(c1)Br 7a_100000754920_100000183359 [0,1,0,0,0,1|2,0,0]=4 4500 B13R1.15 CNC(=O)COc1cncc(c1)C 34a_100011830280_100000183359 [0,1,0,0,0,1|2,0,0]=4 4501 B13R1.15 CNC(=O)COc1cncc(c1)C 7a_100011830280_100000183359 [0,1,0,0,0,1|2,0,0]=4 4502 B13R1.15 CNC(=O)COc1cncc(c1)Cl 7a_100000032511_100000183359 [0,1,0,0,0,1|2,0,0]=4 4503 B13R1.15 CNC(=O)COc1cncc(c1)F 34a_100011830296_100000183359 [0,1,0,0,0,1|2,0,0]=4 4504 B13R1.15 CNC(=O)COc1cncc(c1)F 7a_100011830296_100000183359 [0,1,0,0,0,1|2,0,0]=4 4505 B13R1.15 CNC(=O)COc1cncc(c1)N 34a_100011997051_100000183359 [0,1,0,0,0,1|2,0,0]=4 4506 B13R1.15 CNC(=O)CSc1cc(ccn1)O 62a_100000183359_100000762945 [0,1,0,0,0,1|1,1,0]=4 4507 B13R1.15 CNC(=O)CSc1cccc(c1)Br 11a_106832991635_100000760868 [0,1,0,0,0,1|1,1,0]=4 4508 B13R1.15 CNC(=O)CSc1cccc(c1)Br 1626a_100102657272_100000760868 [0,1,0,0,0,1|1,1,0]=4 4509 B13R1.15 CNC(=O)CSc1cccc(c1)Br 240690a_100102657272_100000760868 [0,1,0,0,0,1|1,1,0]=4 4510 B13R1.15 CNC(=O)CSc1cccc(c1)Br 527a_100102657272_100000760868 [0,1,0,0,0,1|1,1,0]=4 4511 B13R1.15 CNC(=O)CSc1cccc(c1)Br 62a_100000183359_100000691529 [0,1,0,0,0,1|1,1,0]=4 4512 B13R1.15 CNC(=O)CSc1cccc(c1)Br 62a_100000691529_100000183359 [0,1,0,0,0,1|1,1,0]=4 4513 B13R1.15 CNC(=O)CSc1cccc(c1)C 62a_100000183359_100011215228 [0,1,0,0,0,1|1,1,0]=4 4514 B13R1.15 CNC(=O)CSc1cccc(c1)C 62a_100011215228_100000183359 [0,1,0,0,0,1|1,1,0]=4 4515 B13R1.15 CNC(=O)CSc1cccc(c1)Cl 62a_100000183359_100000699651 [0,1,0,0,0,1|1,1,0]=4 4516 B13R1.15 CNC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000183359 [0,1,0,0,0,1|1,1,0]=4 4517 B13R1.15 CNC(=O)CSc1cccc(c1)F 62a_100000183359_100000685547 [0,1,0,0,0,1|1,1,0]=4 4518 B13R1.15 CNC(=O)CSc1cccc(c1)F 62a_100000685547_100000183359 [0,1,0,0,0,1|1,1,0]=4 4519 B13R1.15 CNC(=O)CSc1cccc(c1)N 62a_100000183359_100000210019 [0,1,0,0,0,1|1,1,0]=4 4520 B13R1.15 CNC(=O)CSc1cccc(c1)N 62a_100000210019_100000183359 [0,1,0,0,0,1|1,1,0]=4 4521 B13R1.15 CNC(=O)CSc1cccc(c1)O 62a_100000183359_100000211634 [0,1,0,0,0,1|0,1,0]=3 4522 B13R1.15 CNC(=O)CSc1cccc(c1)[S] 62a_100000183359_114929384022 [0,1,0,0,0,1|0,2,0]=4 4523 B13R1.15 CNC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000183359 [0,1,0,0,0,1|0,2,0]=4 4524 B13R1.15 CNC(=O)CSc1cncc(c1)O 62a_100000183359_100000754920 [0,1,0,0,0,1|1,1,0]=4 4525 B13R1.15 CNC(=O)CSc1cncc(c1)O 62a_100000754920_100000183359 [0,1,0,0,0,1|1,1,0]=4 4526 B13R1.15 CNC(=O)NCc1cccc(c1)Br 2708a_100000174977_106832991635 [0,1,0,0,0,1|2,0,0]=4 4527 B13R1.15 CNC(=O)NCc1cccc(c1)Br 2708a_100102657272_100000174977 [0,1,0,0,0,1|2,0,0]=4 4528 B13R1.15 CNC(=O)NCc1cccc(c1)Br 273464a_100000174977_100102657272 [0,1,0,0,0,1|2,0,0]=4 4529 B13R1.15 CNC(=O)NCc1cccc(c1)Br 273464a_100102657272_100000174977 [0,1,0,0,0,1|2,0,0]=4 4530 B13R1.15 CNC(=O)NCc1cccc(c1)Br 512a_100000174977_100102657272 [0,1,0,0,0,1|2,0,0]=4 4531 B13R1.15 CNC(=O)NCc1cccc(c1)Br 512a_106832991638_100000174977 [0,1,0,0,0,1|2,0,0]=4 4532 B13R1.15 CNC(=O)NCc1cccc(c1)C 2708a_100000185548_106832991635 [0,1,0,0,0,1|2,0,0]=4 4533 B13R1.15 CNC(=O)NCc1cccc(c1)C 2708a_100102657272_100000185548 [0,1,0,0,0,1|2,0,0]=4 4534 B13R1.15 CNC(=O)NCc1cccc(c1)C 273464a_100000185548_100102657272 [0,1,0,0,0,1|2,0,0]=4 4535 B13R1.15 CNC(=O)NCc1cccc(c1)C 273464a_100102657272_100000185548 [0,1,0,0,0,1|2,0,0]=4 4536 B13R1.15 CNC(=O)NCc1cccc(c1)C 512a_100000185548_100102657272 [0,1,0,0,0,1|2,0,0]=4 4537 B13R1.15 CNC(=O)NCc1cccc(c1)C 512a_106832991638_100000185548 [0,1,0,0,0,1|2,0,0]=4 4538 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 2708a_100000174878_106832991635 [0,1,0,0,0,1|2,0,0]=4 4539 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 2708a_100102657272_100000174878 [0,1,0,0,0,1|2,0,0]=4 4540 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 273464a_100000174878_100102657272 [0,1,0,0,0,1|2,0,0]=4 4541 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 273464a_100102657272_100000174878 [0,1,0,0,0,1|2,0,0]=4 4542 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 512a_100000174878_100102657272 [0,1,0,0,0,1|2,0,0]=4 4543 B13R1.15 CNC(=O)NCc1cccc(c1)Cl 512a_106832991638_100000174878 [0,1,0,0,0,1|2,0,0]=4 4544 B13R1.15 CNC(=O)NCc1cccc(c1)F 2708a_100000174948_106832991635 [0,1,0,0,0,1|2,0,0]=4 4545 B13R1.15 CNC(=O)NCc1cccc(c1)F 2708a_100102657272_100000174948 [0,1,0,0,0,1|2,0,0]=4 4546 B13R1.15 CNC(=O)NCc1cccc(c1)F 273464a_100000174948_100102657272 [0,1,0,0,0,1|2,0,0]=4 4547 B13R1.15 CNC(=O)NCc1cccc(c1)F 273464a_100102657272_100000174948 [0,1,0,0,0,1|2,0,0]=4 4548 B13R1.15 CNC(=O)NCc1cccc(c1)F 512a_100000174948_100102657272 [0,1,0,0,0,1|2,0,0]=4 4549 B13R1.15 CNC(=O)NCc1cccc(c1)F 512a_106832991638_100000174948 [0,1,0,0,0,1|2,0,0]=4 4550 B13R1.15 CNC(=O)NCc1cccc(c1)I 2708a_100000106179_106832991635 [0,1,0,0,0,1|2,0,0]=4 4551 B13R1.15 CNC(=O)NCc1cccc(c1)I 2708a_100102657272_100000106179 [0,1,0,0,0,1|2,0,0]=4 4552 B13R1.15 CNC(=O)NCc1cccc(c1)I 273464a_100000106179_100102657272 [0,1,0,0,0,1|2,0,0]=4 4553 B13R1.15 CNC(=O)NCc1cccc(c1)I 273464a_100102657272_100000106179 [0,1,0,0,0,1|2,0,0]=4 4554 B13R1.15 CNC(=O)NCc1cccc(c1)I 512a_100000106179_100102657272 [0,1,0,0,0,1|2,0,0]=4 4555 B13R1.15 CNC(=O)NCc1cccc(c1)I 512a_106832991638_100000106179 [0,1,0,0,0,1|2,0,0]=4 4556 B13R1.15 CNC(=O)NCc1cccc(c1)O 2708a_100000743036_106832991635 [0,1,0,0,0,1|1,0,0]=3 4557 B13R1.15 CNC(=O)NCc1cccc(c1)O 2708a_100102657272_100000743036 [0,1,0,0,0,1|1,0,0]=3 4558 B13R1.15 CNC(=O)NCc1cccc(c1)O 273464a_100000743036_100102657272 [0,1,0,0,0,1|1,0,0]=3 4559 B13R1.15 CNC(=O)NCc1cccc(c1)O 273464a_100102657272_100000743036 [0,1,0,0,0,1|1,0,0]=3 4560 B13R1.15 CNC(=O)NCc1cccc(c1)O 512a_100000743036_100102657272 [0,1,0,0,0,1|1,0,0]=3 4561 B13R1.15 CNC(=O)NCc1cccc(c1)O 512a_106832991638_100000743036 [0,1,0,0,0,1|1,0,0]=3 4562 B13R1.15 CNC(=O)NCc1ccnc(c1)O 2708a_100000748557_106832991635 [0,1,0,0,0,1|2,0,0]=4 4563 B13R1.15 CNC(=O)NCc1ccnc(c1)O 2708a_100102657272_100000748557 [0,1,0,0,0,1|2,0,0]=4 4564 B13R1.15 CNC(=O)NCc1ccnc(c1)O 273464a_100000748557_100102657272 [0,1,0,0,0,1|2,0,0]=4 4565 B13R1.15 CNC(=O)NCc1ccnc(c1)O 273464a_100102657272_100000748557 [0,1,0,0,0,1|2,0,0]=4 4566 B13R1.15 CNC(=O)NCc1ccnc(c1)O 512a_100000748557_100102657272 [0,1,0,0,0,1|2,0,0]=4 4567 B13R1.15 CNC(=O)NCc1ccnc(c1)O 512a_106832991638_100000748557 [0,1,0,0,0,1|2,0,0]=4 4568 B13R1.15 CNC(=O)NNc1cccc(c1)Br 273464a_100102657272_100000217339 [0,1,0,0,0,1|2,0,0]=4 4569 B13R1.15 CNC(=O)NNc1cccc(c1)Br 512a_100000217339_100102657272 [0,1,0,0,0,1|2,0,0]=4 4570 B13R1.15 CNC(=O)NNc1cccc(c1)Br 512a_106832991638_100000217339 [0,1,0,0,0,1|2,0,0]=4 4571 B13R1.15 CNC(=O)NNc1cccc(c1)C 273464a_100102657272_100000681630 [0,1,0,0,0,1|2,0,0]=4 4572 B13R1.15 CNC(=O)NNc1cccc(c1)C 512a_100000681630_100102657272 [0,1,0,0,0,1|2,0,0]=4 4573 B13R1.15 CNC(=O)NNc1cccc(c1)C 512a_106832991638_100000681630 [0,1,0,0,0,1|2,0,0]=4 4574 B13R1.15 CNC(=O)NNc1cccc(c1)Cl 273464a_100102657272_100000184277 [0,1,0,0,0,1|2,0,0]=4 4575 B13R1.15 CNC(=O)NNc1cccc(c1)Cl 512a_106832991638_100000184277 [0,1,0,0,0,1|2,0,0]=4 4576 B13R1.15 CNC(=O)NNc1cccc(c1)F 273464a_100102657272_100000745080 [0,1,0,0,0,1|2,0,0]=4 4577 B13R1.15 CNC(=O)NNc1cccc(c1)F 512a_100000745080_100102657272 [0,1,0,0,0,1|2,0,0]=4 4578 B13R1.15 CNC(=O)NNc1cccc(c1)F 512a_106832991638_100000745080 [0,1,0,0,0,1|2,0,0]=4 4579 B13R1.15 CNC(=O)NNc1cccc(c1)I 273464a_100102657272_100020605690 [0,1,0,0,0,1|2,0,0]=4 4580 B13R1.15 CNC(=O)NNc1cccc(c1)I 512a_100020605690_100102657272 [0,1,0,0,0,1|2,0,0]=4 4581 B13R1.15 CNC(=O)NNc1cccc(c1)I 512a_106832991638_100020605690 [0,1,0,0,0,1|2,0,0]=4 4582 B13R1.15 COC(=O)/C=C/c1cccc(c1)O 271570a_203496583355_100000149372 [0,1,0,0,0,1|1,0,0]=3 4583 B13R1.15 COC(=O)CCc1cccc(c1)O 271570a_203496583355_100000151591 [0,1,0,0,0,1|1,0,0]=3 4584 B13R1.15 COC(=O)CNc1cccc(c1)Br 34a_100000210019_100000747449 [0,1,0,0,0,1|2,0,0]=4 4585 B13R1.15 COC(=O)CNc1cccc(c1)C 2230a_100000188690_100000747449 [0,1,0,0,0,1|2,0,0]=4 4586 B13R1.15 COC(=O)CNc1cccc(c1)C 34a_100000188690_100000747449 [0,1,0,0,0,1|2,0,0]=4 4587 B13R1.15 COC(=O)CNc1cccc(c1)Cl 34a_100000185859_100000747449 [0,1,0,0,0,1|2,0,0]=4 4588 B13R1.15 COC(=O)CNc1cccc(c1)F 34a_100000210047_100000747449 [0,1,0,0,0,1|2,0,0]=4 4589 B13R1.15 COC(=O)CNc1cccc(c1)I 34a_100000211102_100000747449 [0,1,0,0,0,1|2,0,0]=4 4590 B13R1.15 COC(=O)CNc1cccc(c1)O 34a_100000210217_100000747449 [0,1,0,0,0,1|1,0,0]=3 4591 B13R1.15 COC(=O)COc1cc[nH]c(=O)c1 34a_100000032262_100000747449 [0,1,0,0,0,1|1,0,1]=4 4592 B13R1.15 COC(=O)COc1ccc[n+](c1)[O-] 34a_100000039713_100000747449 [0,1,0,0,0,1|1,0,1]=4 4593 B13R1.15 COC(=O)COc1ccc[n+](c1)[O-] 7a_100000039713_100000747449 [0,1,0,0,0,1|1,0,1]=4 4594 B13R1.15 COC(=O)COc1cccc(=O)[nH]1 34a_100000033347_100000747449 [0,1,0,0,0,1|1,0,1]=4 4595 B13R1.15 COC(=O)COc1cccc(c1)Br 34a_100000210342_100000747449 [0,1,0,0,0,1|1,0,0]=3 4596 B13R1.15 COC(=O)COc1cccc(c1)Br 7a_100000210342_100000747449 [0,1,0,0,0,1|1,0,0]=3 4597 B13R1.15 COC(=O)COc1cccc(c1)C 34a_100000210337_100000747449 [0,1,0,0,0,1|1,0,0]=3 4598 B13R1.15 COC(=O)COc1cccc(c1)C 7a_100000210337_100000747449 [0,1,0,0,0,1|1,0,0]=3 4599 B13R1.15 COC(=O)COc1cccc(c1)Cl 34a_100000210295_100000747449 [0,1,0,0,0,1|1,0,0]=3 4600 B13R1.15 COC(=O)COc1cccc(c1)Cl 7a_100000210295_100000747449 [0,1,0,0,0,1|1,0,0]=3 4601 B13R1.15 COC(=O)COc1cccc(c1)F 34a_100000210426_100000747449 [0,1,0,0,0,1|1,0,0]=3 4602 B13R1.15 COC(=O)COc1cccc(c1)F 7a_100000210426_100000747449 [0,1,0,0,0,1|1,0,0]=3 4603 B13R1.15 COC(=O)COc1cccc(c1)I 34a_100000211634_100000747449 [0,1,0,0,0,1|1,0,0]=3 4604 B13R1.15 COC(=O)COc1cccc(c1)I 7a_100000211634_100000747449 [0,1,0,0,0,1|1,0,0]=3 4605 B13R1.15 COC(=O)COc1cccc(c1)N 34a_100000210217_100000747449 [0,1,0,0,0,1|1,0,0]=3 4606 B13R1.15 COC(=O)COc1cccc(c1)O 271570a_203496583355_200000148702 [0,1,0,0,0,1|0,0,0]=2 4607 B13R1.15 COC(=O)COc1cccc(n1)F 34a_100011432558_100000747449 [0,1,0,0,0,1|2,0,0]=4 4608 B13R1.15 COC(=O)COc1ccnc(c1)C 34a_100000688365_100000747449 [0,1,0,0,0,1|2,0,0]=4 4609 B13R1.15 COC(=O)COc1ccnc(c1)Cl 34a_100000762945_100000747449 [0,1,0,0,0,1|2,0,0]=4 4610 B13R1.15 COC(=O)COc1ccnc(c1)F 34a_100000732698_100000747449 [0,1,0,0,0,1|2,0,0]=4 4611 B13R1.15 COC(=O)COc1ccnc(c1)N 34a_100011834064_100000747449 [0,1,0,0,0,1|2,0,0]=4 4612 B13R1.15 COC(=O)COc1cncc(c1)Br 34a_100000754920_100000747449 [0,1,0,0,0,1|2,0,0]=4 4613 B13R1.15 COC(=O)COc1cncc(c1)Br 7a_100000754920_100000747449 [0,1,0,0,0,1|2,0,0]=4 4614 B13R1.15 COC(=O)COc1cncc(c1)C 34a_100011830280_100000747449 [0,1,0,0,0,1|2,0,0]=4 4615 B13R1.15 COC(=O)COc1cncc(c1)C 7a_100011830280_100000747449 [0,1,0,0,0,1|2,0,0]=4 4616 B13R1.15 COC(=O)COc1cncc(c1)Cl 7a_100000032511_100000747449 [0,1,0,0,0,1|2,0,0]=4 4617 B13R1.15 COC(=O)COc1cncc(c1)F 34a_100011830296_100000747449 [0,1,0,0,0,1|2,0,0]=4 4618 B13R1.15 COC(=O)COc1cncc(c1)F 7a_100011830296_100000747449 [0,1,0,0,0,1|2,0,0]=4 4619 B13R1.15 COC(=O)COc1cncc(c1)N 34a_100011997051_100000747449 [0,1,0,0,0,1|2,0,0]=4 4620 B13R1.15 COC(=O)CSc1cc(ccn1)O 62a_100000747449_100000762945 [0,1,0,0,0,1|1,1,0]=4 4621 B13R1.15 COC(=O)CSc1cccc(c1)Br 62a_100000691529_100000747449 [0,1,0,0,0,1|1,1,0]=4 4622 B13R1.15 COC(=O)CSc1cccc(c1)Br 62a_100000747449_100000691529 [0,1,0,0,0,1|1,1,0]=4 4623 B13R1.15 COC(=O)CSc1cccc(c1)C 62a_100000747449_100011215228 [0,1,0,0,0,1|1,1,0]=4 4624 B13R1.15 COC(=O)CSc1cccc(c1)C 62a_100011215228_100000747449 [0,1,0,0,0,1|1,1,0]=4 4625 B13R1.15 COC(=O)CSc1cccc(c1)Cl 62a_100000699651_100000747449 [0,1,0,0,0,1|1,1,0]=4 4626 B13R1.15 COC(=O)CSc1cccc(c1)Cl 62a_100000747449_100000699651 [0,1,0,0,0,1|1,1,0]=4 4627 B13R1.15 COC(=O)CSc1cccc(c1)F 62a_100000685547_100000747449 [0,1,0,0,0,1|1,1,0]=4 4628 B13R1.15 COC(=O)CSc1cccc(c1)F 62a_100000747449_100000685547 [0,1,0,0,0,1|1,1,0]=4 4629 B13R1.15 COC(=O)CSc1cccc(c1)N 62a_100000210019_100000747449 [0,1,0,0,0,1|1,1,0]=4 4630 B13R1.15 COC(=O)CSc1cccc(c1)N 62a_100000747449_100000210019 [0,1,0,0,0,1|1,1,0]=4 4631 B13R1.15 COC(=O)CSc1cccc(c1)O 271570a_203496583355_100011756034 [0,1,0,0,0,1|0,1,0]=3 4632 B13R1.15 COC(=O)CSc1cccc(c1)O 62a_100000747449_100000211634 [0,1,0,0,0,1|0,1,0]=3 4633 B13R1.15 COC(=O)CSc1cccc(c1)[S] 62a_100000747449_114929384022 [0,1,0,0,0,1|0,2,0]=4 4634 B13R1.15 COC(=O)CSc1cccc(c1)[S] 62a_114929384022_100000747449 [0,1,0,0,0,1|0,2,0]=4 4635 B13R1.15 COC(=O)CSc1cncc(c1)O 62a_100000747449_100000754920 [0,1,0,0,0,1|1,1,0]=4 4636 B13R1.15 COC(=O)CSc1cncc(c1)O 62a_100000754920_100000747449 [0,1,0,0,0,1|1,1,0]=4 4637 B13R1.15 Cc1cccc(c1)C#CC(=O)CF 1458a_100011892726_100015361967 [0,1,0,0,0,1|2,0,0]=4 4638 B13R1.15 Cc1cccc(c1)C=CC(=O)CF 1458a_100000690095_100015361967 [0,1,0,0,0,1|2,0,0]=4 4639 B13R1.15 Cc1cccc(c1)CCC(=O)CF 1458a_100000234952_100015361967 [0,1,0,0,0,1|2,0,0]=4 4640 B13R1.15 Cc1cccc(c1)CCC(=O)CO 1458a_100000210174_100011713685 [0,1,0,0,0,1|2,0,0]=4 4641 B13R1.15 Cc1cccc(c1)CNC(=O)CO 240690a_100000185548_100000210174 [0,1,0,0,0,1|2,0,0]=4 4642 B13R1.15 Cc1cccc(c1)CNC(=O)CO 527a_100000185548_100000210174 [0,1,0,0,0,1|2,0,0]=4 4643 B13R1.15 Cc1cccc(c1)NNC(=O)CO 22a_100000681630_100000210174 [0,1,0,0,0,1|2,0,0]=4 4644 B13R1.15 Cc1cccc(c1)OCC(=O)CF 1458a_100000183606_100015361967 [0,1,0,0,0,1|1,0,0]=3 4645 B13R1.15 NNC(=O)COc1cccc(c1)O 271570a_203496583355_100000184228 [0,1,0,0,0,1|1,0,0]=3 4646 B13R1.15 O=C(C#Cc1cccc(c1)Br)CF 1458a_100012100324_100015361967 [0,1,0,0,0,1|2,0,0]=4 4647 B13R1.15 O=C(C#Cc1cccc(c1)Cl)CF 1458a_100011892777_100015361967 [0,1,0,0,0,1|2,0,0]=4 4648 B13R1.15 O=C(C#Cc1cccc(c1)F)CF 1458a_100011892744_100015361967 [0,1,0,0,0,1|2,0,0]=4 4649 B13R1.15 O=C(C#Cc1cccc(c1)O)CF 1458a_200009909484_100015361967 [0,1,0,0,0,1|1,0,0]=3 4650 B13R1.15 O=C(C=Cc1cccc(c1)Br)CBr 6a_100000210085_100009888967 [0,1,0,0,0,1|2,0,0]=4 4651 B13R1.15 O=C(C=Cc1cccc(c1)Br)CCl 6a_100000210085_100000086384 [0,1,0,0,0,1|2,0,0]=4 4652 B13R1.15 O=C(C=Cc1cccc(c1)Br)CF 1458a_100016258244_100015361967 [0,1,0,0,0,1|2,0,0]=4 4653 B13R1.15 O=C(C=Cc1cccc(c1)Br)CF 6a_100000210085_100000764096 [0,1,0,0,0,1|2,0,0]=4 4654 B13R1.15 O=C(C=Cc1cccc(c1)Cl)CF 1458a_100000184502_100015361967 [0,1,0,0,0,1|2,0,0]=4 4655 B13R1.15 O=C(C=Cc1cccc(c1)F)CBr 6a_100000210812_100009888967 [0,1,0,0,0,1|2,0,0]=4 4656 B13R1.15 O=C(C=Cc1cccc(c1)F)CCl 6a_100000210812_100000086384 [0,1,0,0,0,1|2,0,0]=4 4657 B13R1.15 O=C(C=Cc1cccc(c1)F)CF 1458a_100000718793_100015361967 [0,1,0,0,0,1|2,0,0]=4 4658 B13R1.15 O=C(C=Cc1cccc(c1)F)CF 6a_100000210812_100000764096 [0,1,0,0,0,1|2,0,0]=4 4659 B13R1.15 O=C(C=Cc1cccc(c1)I)CBr 6a_100000014684_100009888967 [0,1,0,0,0,1|2,0,0]=4 4660 B13R1.15 O=C(C=Cc1cccc(c1)I)CCl 6a_100000014684_100000086384 [0,1,0,0,0,1|2,0,0]=4 4661 B13R1.15 O=C(C=Cc1cccc(c1)I)CF 1458a_100020647043_100015361967 [0,1,0,0,0,1|2,0,0]=4 4662 B13R1.15 O=C(C=Cc1cccc(c1)I)CF 6a_100000014684_100000764096 [0,1,0,0,0,1|2,0,0]=4 4663 B13R1.15 O=C(CF)CCc1cccc(c1)Br 1458a_100000184314_100015361967 [0,1,0,0,0,1|2,0,0]=4 4664 B13R1.15 O=C(CF)CCc1cccc(c1)Cl 1458a_100000235675_100015361967 [0,1,0,0,0,1|2,0,0]=4 4665 B13R1.15 O=C(CF)CCc1cccc(c1)F 1458a_100000235673_100015361967 [0,1,0,0,0,1|2,0,0]=4 4666 B13R1.15 O=C(CF)CCc1cccc(c1)I 1458a_100010007846_100015361967 [0,1,0,0,0,1|2,0,0]=4 4667 B13R1.15 O=C(CF)CCc1cccc(c1)O 1458a_100011216126_100015361967 [0,1,0,0,0,1|1,0,0]=3 4668 B13R1.15 O=C(CF)COc1cccc(c1)Br 1458a_100000182359_100015361967 [0,1,0,0,0,1|1,0,0]=3 4669 B13R1.15 O=C(CF)COc1cccc(c1)Cl 1458a_100000184978_100015361967 [0,1,0,0,0,1|1,0,0]=3 4670 B13R1.15 O=C(CF)COc1cccc(c1)F 1458a_100000182781_100015361967 [0,1,0,0,0,1|1,0,0]=3 4671 B13R1.15 O=C(CF)CSc1cccc(c1)Br 1458a_100000760868_100015361967 [0,1,0,0,0,1|1,1,0]=4 4672 B13R1.15 O=C(CO)CCc1cccc(c1)Br 1458a_100000210174_100011740638 [0,1,0,0,0,1|2,0,0]=4 4673 B13R1.15 O=C(CO)CCc1cccc(c1)Cl 1458a_100000210174_100011713710 [0,1,0,0,0,1|2,0,0]=4 4674 B13R1.15 O=C(CO)CCc1cccc(c1)F 1458a_100000210174_100011217235 [0,1,0,0,0,1|2,0,0]=4 4675 B13R1.15 O=C(CO)NCc1cccc(c1)Br 240690a_100000174977_100000210174 [0,1,0,0,0,1|2,0,0]=4 4676 B13R1.15 O=C(CO)NCc1cccc(c1)Br 527a_100000174977_100000210174 [0,1,0,0,0,1|2,0,0]=4 4677 B13R1.15 O=C(CO)NCc1cccc(c1)Cl 240690a_100000174878_100000210174 [0,1,0,0,0,1|2,0,0]=4 4678 B13R1.15 O=C(CO)NCc1cccc(c1)Cl 527a_100000174878_100000210174 [0,1,0,0,0,1|2,0,0]=4 4679 B13R1.15 O=C(CO)NCc1cccc(c1)F 240690a_100000174948_100000210174 [0,1,0,0,0,1|2,0,0]=4 4680 B13R1.15 O=C(CO)NCc1cccc(c1)F 527a_100000174948_100000210174 [0,1,0,0,0,1|2,0,0]=4 4681 B13R1.15 O=C(CO)NCc1cccc(c1)I 240690a_100000106179_100000210174 [0,1,0,0,0,1|2,0,0]=4 4682 B13R1.15 O=C(CO)NCc1cccc(c1)I 527a_100000106179_100000210174 [0,1,0,0,0,1|2,0,0]=4 4683 B13R1.15 O=C(CO)NCc1cccc(c1)O 240690a_100000743036_100000210174 [0,1,0,0,0,1|1,0,0]=3 4684 B13R1.15 O=C(CO)NCc1cccc(c1)O 527a_100000743036_100000210174 [0,1,0,0,0,1|1,0,0]=3 4685 B13R1.15 O=C(CO)NCc1ccnc(c1)O 240690a_100000748557_100000210174 [0,1,0,0,0,1|2,0,0]=4 4686 B13R1.15 O=C(CO)NCc1ccnc(c1)O 527a_100000748557_100000210174 [0,1,0,0,0,1|2,0,0]=4 4687 B13R1.15 O=C(CO)NNc1cccc(c1)Br 22a_100000217339_100000210174 [0,1,0,0,0,1|2,0,0]=4 4688 B13R1.15 O=C(CO)NNc1cccc(c1)Cl 22a_100000184277_100000210174 [0,1,0,0,0,1|2,0,0]=4 4689 B13R1.15 O=C(CO)NNc1cccc(c1)F 22a_100000745080_100000210174 [0,1,0,0,0,1|2,0,0]=4 4690 B13R1.15 O=C(CO)NNc1cccc(c1)I 22a_100020605690_100000210174 [0,1,0,0,0,1|2,0,0]=4 4691 B13R1.147 C=C(C)CC(=O)c1cccc(c1)O 1458a_100000183914_100000748629 [0,1,0,0,0,1|2,0,0]=4 4692 B13R1.147 C=C(C)CN(C)c1cccc(c1)O 2230a_100000756613_100000748629 [0,1,0,0,0,1|2,0,0]=4 4693 B13R1.147 C=C(C)CN(C)c1cccc(c1)O 269982a_100000756613_100000748629 [0,1,0,0,0,1|2,0,0]=4 4694 B13R1.147 C=C(C)CN(C)c1cccc(c1)O 34a_100000756613_100000748629 [0,1,0,0,0,1|2,0,0]=4 4695 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Br 1458a_100000070787_100000212080 [0,1,0,0,0,1|2,0,0]=4 4696 B13R1.147 CC(=O)CC(=O)c1cccc(c1)C 1458a_100000070787_100000739480 [0,1,0,0,0,1|2,0,0]=4 4697 B13R1.147 CC(=O)CC(=O)c1cccc(c1)Cl 1458a_100000070787_100000211444 [0,1,0,0,0,1|2,0,0]=4 4698 B13R1.147 CC(=O)CC(=O)c1cccc(c1)F 1458a_100000070787_100000215616 [0,1,0,0,0,1|2,0,0]=4 4699 B13R1.147 CC(=O)CC(=O)c1cccc(c1)O 1458a_100000070787_100009813753 [0,1,0,0,0,1|1,0,0]=3 4700 B13R1.147 CC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200000210301 [0,1,0,0,0,1|2,0,0]=4 4701 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 11a_100020642005_100015343762 [0,1,0,0,0,1|2,0,0]=4 4702 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 1626a_100020642005_100015343762 [0,1,0,0,0,1|2,0,0]=4 4703 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 240690a_100020642005_100015343762 [0,1,0,0,0,1|2,0,0]=4 4704 B13R1.147 CC(=O)NC(C)c1cccc(c1)Br 527a_100020642005_100103153847 [0,1,0,0,0,1|2,0,0]=4 4705 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 11a_100102723534_100015343762 [0,1,0,0,0,1|2,0,0]=4 4706 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 1626a_100102723534_100015343762 [0,1,0,0,0,1|2,0,0]=4 4707 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 240690a_100102723534_100015343762 [0,1,0,0,0,1|2,0,0]=4 4708 B13R1.147 CC(=O)NC(C)c1cccc(c1)Cl 527a_100102723534_100103153847 [0,1,0,0,0,1|2,0,0]=4 4709 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 240690a_100000740644_100015343762 [0,1,0,0,0,1|1,0,0]=3 4710 B13R1.147 CC(=O)NC(C)c1cccc(c1)O 527a_100000740644_100103153847 [0,1,0,0,0,1|1,0,0]=3 4711 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 11a_100000698126_100015343762 [0,1,0,0,0,1|2,0,0]=4 4712 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 1626a_100000698126_100015343762 [0,1,0,0,0,1|2,0,0]=4 4713 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 240690a_100000698126_100015343762 [0,1,0,0,0,1|2,0,0]=4 4714 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)C 527a_100000698126_100103153847 [0,1,0,0,0,1|2,0,0]=4 4715 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 11a_100015193778_100015343762 [0,1,0,0,0,1|2,0,0]=4 4716 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 1626a_100015193778_100015343762 [0,1,0,0,0,1|2,0,0]=4 4717 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 240690a_100015193778_100015343762 [0,1,0,0,0,1|2,0,0]=4 4718 B13R1.147 CC(=O)N[C@H](C)c1cccc(c1)F 527a_100015193778_100103153847 [0,1,0,0,0,1|2,0,0]=4 4719 B13R1.147 CN(CC(=O)N)c1cccc(c1)O 2230a_100000756613_100000747473 [0,1,0,0,0,1|2,0,0]=4 4720 B13R1.147 CN(CC(=O)N)c1cccc(c1)O 269982a_100000756613_100000187820 [0,1,0,0,0,1|2,0,0]=4 4721 B13R1.147 CN(CC(=O)N)c1cccc(c1)O 34a_100000756613_100000187820 [0,1,0,0,0,1|2,0,0]=4 4722 B13R1.147 CN(CC(=O)[O-])c1cccc(c1)O 269982a_100000756613_100020667443 [0,1,0,0,0,1|2,0,0]=4 4723 B13R1.147 CN(CC(=O)[O-])c1cccc(c1)O 34a_100000756613_100020667443 [0,1,0,0,0,1|2,0,0]=4 4724 B13R1.147 NC(=O)CC(=O)c1cccc(c1)O 1458a_100000183914_100000187820 [0,1,0,0,0,1|2,0,0]=4 4725 B13R1.147 O=C([O-])CC(=O)c1cccc(c1)O 1458a_100000183914_100020667443 [0,1,0,0,0,1|2,0,0]=4 4726 B13R1.147 [13CH3]C(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200025704644 [0,1,0,0,0,1|2,0,0]=4 4727 B13R1.148 C=C(C)C(=O)Cc1cccc(c1)O 1458a_100000185857_100011660834 [0,1,0,0,0,1|2,0,0]=4 4728 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 1626a_100000210217_100000185857 [0,1,0,0,0,1|2,0,0]=4 4729 B13R1.148 C=C(C)C(=O)Nc1cccc(c1)O 22a_100000210217_100000185857 [0,1,0,0,0,1|2,0,0]=4 4730 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200000210301 [0,1,0,0,0,1|2,0,0]=4 4731 B13R1.148 CC(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200000210301 [0,1,0,0,0,1|2,0,0]=4 4732 B13R1.148 CC(=O)C(C)Nc1cccc(c1)C 2230a_100000188690_100009814033 [0,1,0,0,0,1|2,0,0]=4 4733 B13R1.148 CC(=O)C(C)Oc1ccc[n+](c1)[O-] 7a_100000039713_100000179758 [0,1,0,0,0,1|1,0,1]=4 4734 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Br 1458a_100000246016_200000210301 [0,1,0,0,0,1|1,0,0]=3 4735 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Br 7a_100000210342_100000179758 [0,1,0,0,0,1|1,0,0]=3 4736 B13R1.148 CC(=O)C(C)Oc1cccc(c1)C 1458a_100000183885_200000210301 [0,1,0,0,0,1|1,0,0]=3 4737 B13R1.148 CC(=O)C(C)Oc1cccc(c1)C 7a_100000210337_100000179758 [0,1,0,0,0,1|1,0,0]=3 4738 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Cl 1458a_100000185161_200000210301 [0,1,0,0,0,1|1,0,0]=3 4739 B13R1.148 CC(=O)C(C)Oc1cccc(c1)Cl 7a_100000210295_100000179758 [0,1,0,0,0,1|1,0,0]=3 4740 B13R1.148 CC(=O)C(C)Oc1cccc(c1)F 7a_100000210426_100000179758 [0,1,0,0,0,1|1,0,0]=3 4741 B13R1.148 CC(=O)C(C)Oc1cccc(c1)I 7a_100000211634_100000179758 [0,1,0,0,0,1|1,0,0]=3 4742 B13R1.148 CC(=O)C(C)Oc1cncc(c1)Br 7a_100000754920_100000179758 [0,1,0,0,0,1|2,0,0]=4 4743 B13R1.148 CC(=O)C(C)Oc1cncc(c1)C 7a_100011830280_100000179758 [0,1,0,0,0,1|2,0,0]=4 4744 B13R1.148 CC(=O)C(C)Oc1cncc(c1)Cl 7a_100000032511_100000179758 [0,1,0,0,0,1|2,0,0]=4 4745 B13R1.148 CC(=O)C(C)Oc1cncc(c1)F 7a_100011830296_100000179758 [0,1,0,0,0,1|2,0,0]=4 4746 B13R1.148 CC(=O)C(C)Sc1cc(ccn1)O 62a_100009814033_100000762945 [0,1,0,0,0,1|1,1,0]=4 4747 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Br 62a_100000691529_100009814033 [0,1,0,0,0,1|1,1,0]=4 4748 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Br 62a_100009814033_100000691529 [0,1,0,0,0,1|1,1,0]=4 4749 B13R1.148 CC(=O)C(C)Sc1cccc(c1)C 62a_100009814033_100011215228 [0,1,0,0,0,1|1,1,0]=4 4750 B13R1.148 CC(=O)C(C)Sc1cccc(c1)C 62a_100011215228_100009814033 [0,1,0,0,0,1|1,1,0]=4 4751 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Cl 62a_100000699651_100009814033 [0,1,0,0,0,1|1,1,0]=4 4752 B13R1.148 CC(=O)C(C)Sc1cccc(c1)Cl 62a_100009814033_100000699651 [0,1,0,0,0,1|1,1,0]=4 4753 B13R1.148 CC(=O)C(C)Sc1cccc(c1)F 62a_100000685547_100009814033 [0,1,0,0,0,1|1,1,0]=4 4754 B13R1.148 CC(=O)C(C)Sc1cccc(c1)F 62a_100009814033_100000685547 [0,1,0,0,0,1|1,1,0]=4 4755 B13R1.148 CC(=O)C(C)Sc1cccc(c1)N 62a_100000210019_100009814033 [0,1,0,0,0,1|1,1,0]=4 4756 B13R1.148 CC(=O)C(C)Sc1cccc(c1)N 62a_100009814033_100000210019 [0,1,0,0,0,1|1,1,0]=4 4757 B13R1.148 CC(=O)C(C)Sc1cccc(c1)O 62a_100009814033_100000211634 [0,1,0,0,0,1|0,1,0]=3 4758 B13R1.148 CC(=O)C(C)Sc1cccc(c1)[S] 62a_100009814033_114929384022 [0,1,0,0,0,1|0,2,0]=4 4759 B13R1.148 CC(=O)C(C)Sc1cccc(c1)[S] 62a_114929384022_100009814033 [0,1,0,0,0,1|0,2,0]=4 4760 B13R1.148 CC(=O)C(C)Sc1cncc(c1)O 62a_100000754920_100009814033 [0,1,0,0,0,1|1,1,0]=4 4761 B13R1.148 CC(=O)C(C)Sc1cncc(c1)O 62a_100009814033_100000754920 [0,1,0,0,0,1|1,1,0]=4 4762 B13R1.148 CC(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200000210301 [0,1,0,0,0,1|2,0,0]=4 4763 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 11a_100000187585_100015343762 [0,1,0,0,0,1|2,0,0]=4 4764 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 1626a_100000187585_100015343762 [0,1,0,0,0,1|2,0,0]=4 4765 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 240690a_100000187585_100015343762 [0,1,0,0,0,1|2,0,0]=4 4766 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Br 527a_100000187585_100103153847 [0,1,0,0,0,1|2,0,0]=4 4767 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 11a_102495364743_100015343762 [0,1,0,0,0,1|2,0,0]=4 4768 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 1626a_102495364743_100015343762 [0,1,0,0,0,1|2,0,0]=4 4769 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 240690a_102495364743_100015343762 [0,1,0,0,0,1|2,0,0]=4 4770 B13R1.148 CC(=O)N(C)Cc1cccc(c1)C 527a_102495364743_100103153847 [0,1,0,0,0,1|2,0,0]=4 4771 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 11a_100020629429_100015343762 [0,1,0,0,0,1|2,0,0]=4 4772 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 1626a_100020629429_100015343762 [0,1,0,0,0,1|2,0,0]=4 4773 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 240690a_100020629429_100015343762 [0,1,0,0,0,1|2,0,0]=4 4774 B13R1.148 CC(=O)N(C)Cc1cccc(c1)Cl 527a_100020629429_100103153847 [0,1,0,0,0,1|2,0,0]=4 4775 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 11a_100000184398_100015343762 [0,1,0,0,0,1|2,0,0]=4 4776 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 1626a_100000184398_100015343762 [0,1,0,0,0,1|2,0,0]=4 4777 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 240690a_100000184398_100015343762 [0,1,0,0,0,1|2,0,0]=4 4778 B13R1.148 CC(=O)N(C)Cc1cccc(c1)F 527a_100000184398_100103153847 [0,1,0,0,0,1|2,0,0]=4 4779 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 240690a_100000207540_100015343762 [0,1,0,0,0,1|1,0,0]=3 4780 B13R1.148 CC(=O)N(C)Cc1cccc(c1)O 527a_100000207540_100103153847 [0,1,0,0,0,1|1,0,0]=3 4781 B13R1.148 CC(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200000210301 [0,1,0,0,0,1|2,0,0]=4 4782 B13R1.148 CC(Nc1cccc(c1)O)C(=O)N 34a_100000210217_100000702099 [0,1,0,0,0,1|2,0,0]=4 4783 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)N 34a_100000210342_100000702099 [0,1,0,0,0,1|2,0,0]=4 4784 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)N 7a_100000210342_100000702099 [0,1,0,0,0,1|2,0,0]=4 4785 B13R1.148 CC(Oc1cccc(c1)Br)C(=O)[13CH3] 1458a_100000246016_200025704644 [0,1,0,0,0,1|1,0,0]=3 4786 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)N 34a_100000210295_100000702099 [0,1,0,0,0,1|2,0,0]=4 4787 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)N 7a_100000210295_100000702099 [0,1,0,0,0,1|2,0,0]=4 4788 B13R1.148 CC(Oc1cccc(c1)Cl)C(=O)[13CH3] 1458a_100000185161_200025704644 [0,1,0,0,0,1|1,0,0]=3 4789 B13R1.148 CC(Oc1cccc(c1)F)C(=O)N 34a_100000210426_100000702099 [0,1,0,0,0,1|2,0,0]=4 4790 B13R1.148 CC(Oc1cccc(c1)F)C(=O)N 7a_100000210426_100000702099 [0,1,0,0,0,1|2,0,0]=4 4791 B13R1.148 CC(Oc1cccc(c1)I)C(=O)N 34a_100000211634_100000702099 [0,1,0,0,0,1|2,0,0]=4 4792 B13R1.148 CC(Oc1cccc(c1)I)C(=O)N 7a_100000211634_100000702099 [0,1,0,0,0,1|2,0,0]=4 4793 B13R1.148 CC(Oc1cccc(c1)N)C(=O)N 34a_100000210217_100000702099 [0,1,0,0,0,1|2,0,0]=4 4794 B13R1.148 CC(Oc1cccc(c1)O)C(=O)N 271570a_203496583355_200000150601 [0,1,0,0,0,1|1,0,0]=3 4795 B13R1.148 CC(Sc1cccc(c1)O)C(=O)N 62a_100000702099_100000211634 [0,1,0,0,0,1|1,1,0]=4 4796 B13R1.148 Cc1cccc(c1)OC(C)C(=O)N 34a_100000210337_100000702099 [0,1,0,0,0,1|2,0,0]=4 4797 B13R1.148 Cc1cccc(c1)OC(C)C(=O)N 7a_100000210337_100000702099 [0,1,0,0,0,1|2,0,0]=4 4798 B13R1.148 Cc1cccc(c1)OC(C)C(=O)[13CH3] 1458a_100000183885_200025704644 [0,1,0,0,0,1|1,0,0]=3 4799 B13R1.148 Cc1cccc(c1)OC(F)C(=O)N 34a_100000210337_100009813875 [0,1,0,0,0,1|2,0,0]=4 4800 B13R1.148 Cc1cccc(c1)OC(F)C(=O)N 7a_100000210337_100009813875 [0,1,0,0,0,1|2,0,0]=4 4801 B13R1.148 Cc1cccc(c1)OC(F)C(=O)[O-] 34a_100000210337_100020610796 [0,1,0,0,0,1|2,0,0]=4 4802 B13R1.148 NC(=O)C(=O)Nc1cccc(c1)O 22a_100000210217_100011215815 [0,1,0,0,0,1|2,0,0]=4 4803 B13R1.148 NC(=O)C(F)Nc1cccc(c1)O 34a_100000210217_100009813875 [0,1,0,0,0,1|2,0,0]=4 4804 B13R1.148 NC(=O)C(F)Oc1cccc(c1)Br 34a_100000210342_100009813875 [0,1,0,0,0,1|2,0,0]=4 4805 B13R1.148 NC(=O)C(F)Oc1cccc(c1)Br 7a_100000210342_100009813875 [0,1,0,0,0,1|2,0,0]=4 4806 B13R1.148 NC(=O)C(F)Oc1cccc(c1)Cl 34a_100000210295_100009813875 [0,1,0,0,0,1|2,0,0]=4 4807 B13R1.148 NC(=O)C(F)Oc1cccc(c1)Cl 7a_100000210295_100009813875 [0,1,0,0,0,1|2,0,0]=4 4808 B13R1.148 NC(=O)C(F)Oc1cccc(c1)F 34a_100000210426_100009813875 [0,1,0,0,0,1|2,0,0]=4 4809 B13R1.148 NC(=O)C(F)Oc1cccc(c1)F 7a_100000210426_100009813875 [0,1,0,0,0,1|2,0,0]=4 4810 B13R1.148 NC(=O)C(F)Oc1cccc(c1)I 34a_100000211634_100009813875 [0,1,0,0,0,1|2,0,0]=4 4811 B13R1.148 NC(=O)C(F)Oc1cccc(c1)I 7a_100000211634_100009813875 [0,1,0,0,0,1|2,0,0]=4 4812 B13R1.148 NC(=O)C(F)Oc1cccc(c1)N 34a_100000210217_100009813875 [0,1,0,0,0,1|2,0,0]=4 4813 B13R1.148 NC(=O)C(F)Sc1cccc(c1)O 62a_100009813875_100000211634 [0,1,0,0,0,1|1,1,0]=4 4814 B13R1.148 Nc1cccc(c1)OC(F)C(=O)[O-] 34a_100000210217_100020610796 [0,1,0,0,0,1|2,0,0]=4 4815 B13R1.148 O=C([O-])C(F)Nc1cccc(c1)O 34a_100000210217_100020610796 [0,1,0,0,0,1|2,0,0]=4 4816 B13R1.148 O=C([O-])C(F)Oc1cccc(c1)Br 34a_100000210342_100020610796 [0,1,0,0,0,1|2,0,0]=4 4817 B13R1.148 O=C([O-])C(F)Oc1cccc(c1)Cl 34a_100000210295_100020610796 [0,1,0,0,0,1|2,0,0]=4 4818 B13R1.148 O=C([O-])C(F)Oc1cccc(c1)F 34a_100000210426_100020610796 [0,1,0,0,0,1|2,0,0]=4 4819 B13R1.148 O=C([O-])C(F)Oc1cccc(c1)I 34a_100000211634_100020610796 [0,1,0,0,0,1|2,0,0]=4 4820 B13R1.148 O=C([O-])C(F)Sc1cccc(c1)O 62a_100020610796_100000211634 [0,1,0,0,0,1|1,1,0]=4 4821 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)Cl 1458a_200011297299_200025704644 [0,1,0,0,0,1|2,0,0]=4 4822 B13R1.148 [13CH3]C(=O)C(=O)Nc1cccc(c1)F 1458a_200011297300_200025704644 [0,1,0,0,0,1|2,0,0]=4 4823 B13R1.148 [13CH3]C(=O)C(O)Cc1cccc(c1)Br 1458a_100012362086_200025704644 [0,1,0,0,0,1|2,0,0]=4 4824 B13R1.148 [13CH3]C(=O)[C@@H](O)Cc1cccc(c1)F 1458a_200016142683_200025704644 [0,1,0,0,0,1|2,0,0]=4 4825 B13R1.150 C=C(C)CNc1cccc(c1Br)O 34a_100012183704_100000748629 [0,1,0,0,0,1|2,0,0]=4 4826 B13R1.150 C=C(C)CNc1cccc(c1Br)O 7a_100012183704_100000748629 [0,1,0,0,0,1|2,0,0]=4 4827 B13R1.150 C=C(C)CNc1cccc(c1C)O 34a_100011216573_100000748629 [0,1,0,0,0,1|2,0,0]=4 4828 B13R1.150 C=C(C)CNc1cccc(c1C)O 7a_100011216573_100000748629 [0,1,0,0,0,1|2,0,0]=4 4829 B13R1.150 C=C(C)CNc1cccc(c1Cl)O 34a_100012002038_100000748629 [0,1,0,0,0,1|2,0,0]=4 4830 B13R1.150 C=C(C)CNc1cccc(c1Cl)O 7a_100012002038_100000748629 [0,1,0,0,0,1|2,0,0]=4 4831 B13R1.150 C=C(C)COc1cccc(c1Br)Br 34a_100010187966_100000748629 [0,1,0,0,0,1|2,0,0]=4 4832 B13R1.150 C=C(C)COc1cccc(c1Br)Br 7a_100010187966_100000748629 [0,1,0,0,0,1|2,0,0]=4 4833 B13R1.150 C=C(C)COc1cccc(c1Br)C 34a_100000686692_100000748629 [0,1,0,0,0,1|2,0,0]=4 4834 B13R1.150 C=C(C)COc1cccc(c1Br)C 7a_100000686692_100000748629 [0,1,0,0,0,1|2,0,0]=4 4835 B13R1.150 C=C(C)COc1cccc(c1Br)Cl 34a_100012348804_100000748629 [0,1,0,0,0,1|2,0,0]=4 4836 B13R1.150 C=C(C)COc1cccc(c1Br)Cl 7a_100012348804_100000748629 [0,1,0,0,0,1|2,0,0]=4 4837 B13R1.150 C=C(C)COc1cccc(c1Br)F 34a_100009820682_100000748629 [0,1,0,0,0,1|2,0,0]=4 4838 B13R1.150 C=C(C)COc1cccc(c1Br)F 7a_100009820682_100000748629 [0,1,0,0,0,1|2,0,0]=4 4839 B13R1.150 C=C(C)COc1cccc(c1Br)I 34a_100010187914_100000748629 [0,1,0,0,0,1|2,0,0]=4 4840 B13R1.150 C=C(C)COc1cccc(c1Br)I 7a_100010187914_100000748629 [0,1,0,0,0,1|2,0,0]=4 4841 B13R1.150 C=C(C)COc1cccc(c1Br)N 34a_100012183704_100000748629 [0,1,0,0,0,1|2,0,0]=4 4842 B13R1.150 C=C(C)COc1cccc(c1Br)N 7a_100012183704_100000748629 [0,1,0,0,0,1|2,0,0]=4 4843 B13R1.150 C=C(C)COc1cccc(c1C)Br 34a_100012002258_100000748629 [0,1,0,0,0,1|2,0,0]=4 4844 B13R1.150 C=C(C)COc1cccc(c1C)Br 7a_100012002258_100000748629 [0,1,0,0,0,1|2,0,0]=4 4845 B13R1.150 C=C(C)COc1cccc(c1C)C 34a_100000185855_100000748629 [0,1,0,0,0,1|2,0,0]=4 4846 B13R1.150 C=C(C)COc1cccc(c1C)C 7a_100000185855_100000748629 [0,1,0,0,0,1|2,0,0]=4 4847 B13R1.150 C=C(C)COc1cccc(c1C)Cl 34a_100011265684_100000748629 [0,1,0,0,0,1|2,0,0]=4 4848 B13R1.150 C=C(C)COc1cccc(c1C)Cl 7a_100011265684_100000748629 [0,1,0,0,0,1|2,0,0]=4 4849 B13R1.150 C=C(C)COc1cccc(c1C)F 34a_100011217231_100000748629 [0,1,0,0,0,1|2,0,0]=4 4850 B13R1.150 C=C(C)COc1cccc(c1C)F 7a_100011217231_100000748629 [0,1,0,0,0,1|2,0,0]=4 4851 B13R1.150 C=C(C)COc1cccc(c1C)N 34a_100011216573_100000748629 [0,1,0,0,0,1|2,0,0]=4 4852 B13R1.150 C=C(C)COc1cccc(c1C)N 7a_100011216573_100000748629 [0,1,0,0,0,1|2,0,0]=4 4853 B13R1.150 C=C(C)COc1cccc(c1Cl)Br 34a_100010187913_100000748629 [0,1,0,0,0,1|2,0,0]=4 4854 B13R1.150 C=C(C)COc1cccc(c1Cl)Br 7a_100010187913_100000748629 [0,1,0,0,0,1|2,0,0]=4 4855 B13R1.150 C=C(C)COc1cccc(c1Cl)C 34a_100000695629_100000748629 [0,1,0,0,0,1|2,0,0]=4 4856 B13R1.150 C=C(C)COc1cccc(c1Cl)C 7a_100000695629_100000748629 [0,1,0,0,0,1|2,0,0]=4 4857 B13R1.150 C=C(C)COc1cccc(c1Cl)Cl 34a_100000211076_100000748629 [0,1,0,0,0,1|2,0,0]=4 4858 B13R1.150 C=C(C)COc1cccc(c1Cl)Cl 7a_100000211076_100000748629 [0,1,0,0,0,1|2,0,0]=4 4859 B13R1.150 C=C(C)COc1cccc(c1Cl)F 34a_100000087408_100000748629 [0,1,0,0,0,1|2,0,0]=4 4860 B13R1.150 C=C(C)COc1cccc(c1Cl)F 7a_100000087408_100000748629 [0,1,0,0,0,1|2,0,0]=4 4861 B13R1.150 C=C(C)COc1cccc(c1Cl)I 34a_100000049636_100000748629 [0,1,0,0,0,1|2,0,0]=4 4862 B13R1.150 C=C(C)COc1cccc(c1Cl)I 7a_100000049636_100000748629 [0,1,0,0,0,1|2,0,0]=4 4863 B13R1.150 C=C(C)COc1cccc(c1Cl)N 34a_100012002038_100000748629 [0,1,0,0,0,1|2,0,0]=4 4864 B13R1.150 C=C(C)COc1cccc(c1Cl)N 7a_100012002038_100000748629 [0,1,0,0,0,1|2,0,0]=4 4865 B13R1.150 C=C(C)COc1cccc(c1F)Br 34a_100009817021_100000748629 [0,1,0,0,0,1|2,0,0]=4 4866 B13R1.150 C=C(C)COc1cccc(c1F)Br 7a_100009817021_100000748629 [0,1,0,0,0,1|2,0,0]=4 4867 B13R1.150 C=C(C)COc1cccc(c1F)C 34a_100000751311_100000748629 [0,1,0,0,0,1|2,0,0]=4 4868 B13R1.150 C=C(C)COc1cccc(c1F)C 7a_100000751311_100000748629 [0,1,0,0,0,1|2,0,0]=4 4869 B13R1.150 C=C(C)COc1cccc(c1F)Cl 34a_100000687438_100000748629 [0,1,0,0,0,1|2,0,0]=4 4870 B13R1.150 C=C(C)COc1cccc(c1F)Cl 7a_100000687438_100000748629 [0,1,0,0,0,1|2,0,0]=4 4871 B13R1.150 C=C(C)COc1cccc(c1F)F 34a_100000751161_100000748629 [0,1,0,0,0,1|2,0,0]=4 4872 B13R1.150 C=C(C)COc1cccc(c1F)F 7a_100000751161_100000748629 [0,1,0,0,0,1|2,0,0]=4 4873 B13R1.150 C=C(C)COc1cccc(c1I)Br 34a_100010187912_100000748629 [0,1,0,0,0,1|2,0,0]=4 4874 B13R1.150 C=C(C)COc1cccc(c1I)Br 7a_100010187912_100000748629 [0,1,0,0,0,1|2,0,0]=4 4875 B13R1.150 C=C(C)COc1cccc(c1I)C 34a_100010083724_100000748629 [0,1,0,0,0,1|2,0,0]=4 4876 B13R1.150 C=C(C)COc1cccc(c1I)C 7a_100010083724_100000748629 [0,1,0,0,0,1|2,0,0]=4 4877 B13R1.150 C=C(C)COc1cccc(c1I)Cl 34a_100000050174_100000748629 [0,1,0,0,0,1|2,0,0]=4 4878 B13R1.150 C=C(C)COc1cccc(c1I)Cl 7a_100000050174_100000748629 [0,1,0,0,0,1|2,0,0]=4 4879 B13R1.150 C=C(C)COc1cccc(c1I)F 34a_100000690913_100000748629 [0,1,0,0,0,1|2,0,0]=4 4880 B13R1.150 C=C(C)COc1cccc(c1I)F 7a_100000690913_100000748629 [0,1,0,0,0,1|2,0,0]=4 4881 B13R1.150 C=C(C)COc1cccc(c1N)Br 34a_100011934926_100000748629 [0,1,0,0,0,1|2,0,0]=4 4882 B13R1.150 C=C(C)COc1cccc(c1N)Br 7a_100011934926_100000748629 [0,1,0,0,0,1|2,0,0]=4 4883 B13R1.150 C=C(C)COc1cccc(c1N)C 34a_100000743429_100000748629 [0,1,0,0,0,1|2,0,0]=4 4884 B13R1.150 C=C(C)COc1cccc(c1N)C 7a_100000743429_100000748629 [0,1,0,0,0,1|2,0,0]=4 4885 B13R1.150 C=C(C)COc1cccc(c1N)Cl 34a_100012022510_100000748629 [0,1,0,0,0,1|2,0,0]=4 4886 B13R1.150 C=C(C)COc1cccc(c1N)Cl 7a_100012022510_100000748629 [0,1,0,0,0,1|2,0,0]=4 4887 B13R1.150 C=C(C)COc1cccc(c1N)F 34a_100020591140_100000748629 [0,1,0,0,0,1|2,0,0]=4 4888 B13R1.150 C=C(C)COc1cccc(c1N)F 7a_100020591140_100000748629 [0,1,0,0,0,1|2,0,0]=4 4889 B13R1.150 C=C(C)COc1cccc(c1N)I 34a_200000049512_100000748629 [0,1,0,0,0,1|2,0,0]=4 4890 B13R1.150 C=C(C)COc1cccc(c1N)I 7a_200000049512_100000748629 [0,1,0,0,0,1|2,0,0]=4 4891 B13R1.150 C=C(C)COc1cccc(c1N)N 34a_100000033209_100000748629 [0,1,0,0,0,1|2,0,0]=4 4892 B13R1.150 C=C(C)CSc1cccc(c1Br)O 62a_100000748629_100010187914 [0,1,0,0,0,1|1,1,0]=4 4893 B13R1.150 C=C(C)CSc1cccc(c1Br)O 62a_100010187914_100000211660 [0,1,0,0,0,1|1,1,0]=4 4894 B13R1.150 C=C(C)CSc1cccc(c1C)O 62a_100000748629_100012002258 [0,1,0,0,0,1|1,1,0]=4 4895 B13R1.150 C=C(C)CSc1cccc(c1C)O 62a_100012002258_100000211660 [0,1,0,0,0,1|1,1,0]=4 4896 B13R1.150 C=C(C)CSc1cccc(c1Cl)O 62a_100000748629_100000049636 [0,1,0,0,0,1|1,1,0]=4 4897 B13R1.150 C=C(C)CSc1cccc(c1F)O 62a_100000748629_100009817021 [0,1,0,0,0,1|1,1,0]=4 4898 B13R1.150 C=C(C)CSc1cccc(c1F)O 62a_100009817021_100000211660 [0,1,0,0,0,1|1,1,0]=4 4899 B13R1.150 C=C(C)CSc1cccc(c1N)O 62a_100000748629_100011934926 [0,1,0,0,0,1|1,1,0]=4 4900 B13R1.150 C=C(C)CSc1cccc(c1O)O 62a_100000748629_100009815950 [0,1,0,0,0,1|1,1,0]=4 4901 B13R1.150 CC(=O)C=Cc1cccc(c1C)F 1458a_100102526135_200000210301 [0,1,0,0,0,1|2,0,0]=4 4902 B13R1.150 CC(=O)C=Cc1cccc(c1Cl)Cl 1458a_100000184505_200000210301 [0,1,0,0,0,1|2,0,0]=4 4903 B13R1.150 CC(=O)C=Cc1cccc(c1F)Br 1458a_100012351547_200000210301 [0,1,0,0,0,1|2,0,0]=4 4904 B13R1.150 CC(=O)C=Cc1cccc(c1F)Cl 1458a_100011217667_200000210301 [0,1,0,0,0,1|2,0,0]=4 4905 B13R1.150 CC(=O)C=Cc1cccc(c1F)F 1458a_100102526107_200000210301 [0,1,0,0,0,1|2,0,0]=4 4906 B13R1.150 CC(=O)CCc1cccc(c1C)C 1458a_100011218151_200000210301 [0,1,0,0,0,1|2,0,0]=4 4907 B13R1.150 CC(=O)CCc1cccc(c1C)F 1458a_100000069055_200000210301 [0,1,0,0,0,1|2,0,0]=4 4908 B13R1.150 CC(=O)CCc1cccc(c1Cl)Cl 1458a_100000070787_100000723033 [0,1,0,0,0,1|2,0,0]=4 4909 B13R1.150 CC(=O)CCc1cccc(c1Cl)Cl 1458a_100000739359_200000210301 [0,1,0,0,0,1|2,0,0]=4 4910 B13R1.150 CC(=O)CCc1cccc(c1F)Br 1458a_100012349569_200000210301 [0,1,0,0,0,1|2,0,0]=4 4911 B13R1.150 CC(=O)CCc1cccc(c1F)Cl 1458a_100012349026_200000210301 [0,1,0,0,0,1|2,0,0]=4 4912 B13R1.150 CC(=O)CCc1cccc(c1F)F 1458a_100000748811_200000210301 [0,1,0,0,0,1|2,0,0]=4 4913 B13R1.150 CC(=O)CCc1cccc(c1O)O 1458a_100009873524_200000210301 [0,1,0,0,0,1|1,0,0]=3 4914 B13R1.150 CC(=O)COc1cccc(c1C)C 1458a_200000183798_200000210301 [0,1,0,0,0,1|1,0,0]=3 4915 B13R1.150 CC(=O)COc1cccc(c1Cl)Cl 1458a_100000191259_200000210301 [0,1,0,0,0,1|1,0,0]=3 4916 B13R1.150 CC(=O)NCc1cccc(c1Br)F 11a_100020638964_100015343762 [0,1,0,0,0,1|2,0,0]=4 4917 B13R1.150 CC(=O)NCc1cccc(c1Br)F 1626a_100020638964_100015343762 [0,1,0,0,0,1|2,0,0]=4 4918 B13R1.150 CC(=O)NCc1cccc(c1Br)F 240690a_100020638964_100015343762 [0,1,0,0,0,1|2,0,0]=4 4919 B13R1.150 CC(=O)NCc1cccc(c1Br)F 527a_100020638964_100103153847 [0,1,0,0,0,1|2,0,0]=4 4920 B13R1.150 CC(=O)NCc1cccc(c1C)Br 11a_100000724210_100015343762 [0,1,0,0,0,1|2,0,0]=4 4921 B13R1.150 CC(=O)NCc1cccc(c1C)Br 1626a_100000724210_100015343762 [0,1,0,0,0,1|2,0,0]=4 4922 B13R1.150 CC(=O)NCc1cccc(c1C)Br 240690a_100000724210_100015343762 [0,1,0,0,0,1|2,0,0]=4 4923 B13R1.150 CC(=O)NCc1cccc(c1C)Br 527a_100000724210_100103153847 [0,1,0,0,0,1|2,0,0]=4 4924 B13R1.150 CC(=O)NCc1cccc(c1C)C 11a_100011211637_100015343762 [0,1,0,0,0,1|2,0,0]=4 4925 B13R1.150 CC(=O)NCc1cccc(c1C)C 1626a_100011211637_100015343762 [0,1,0,0,0,1|2,0,0]=4 4926 B13R1.150 CC(=O)NCc1cccc(c1C)C 240690a_100011211637_100015343762 [0,1,0,0,0,1|2,0,0]=4 4927 B13R1.150 CC(=O)NCc1cccc(c1C)C 527a_100011211637_100103153847 [0,1,0,0,0,1|2,0,0]=4 4928 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 11a_100020639605_100015343762 [0,1,0,0,0,1|2,0,0]=4 4929 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 1626a_100020639605_100015343762 [0,1,0,0,0,1|2,0,0]=4 4930 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 240690a_100020639605_100015343762 [0,1,0,0,0,1|2,0,0]=4 4931 B13R1.150 CC(=O)NCc1cccc(c1C)Cl 527a_100020639605_100103153847 [0,1,0,0,0,1|2,0,0]=4 4932 B13R1.150 CC(=O)NCc1cccc(c1C)F 11a_100132306986_100015343762 [0,1,0,0,0,1|2,0,0]=4 4933 B13R1.150 CC(=O)NCc1cccc(c1C)F 1626a_100132306986_100015343762 [0,1,0,0,0,1|2,0,0]=4 4934 B13R1.150 CC(=O)NCc1cccc(c1C)F 240690a_100132306986_100015343762 [0,1,0,0,0,1|2,0,0]=4 4935 B13R1.150 CC(=O)NCc1cccc(c1C)F 527a_100132306986_100103153847 [0,1,0,0,0,1|2,0,0]=4 4936 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 11a_100025705714_100015343762 [0,1,0,0,0,1|2,0,0]=4 4937 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 1626a_100025705714_100015343762 [0,1,0,0,0,1|2,0,0]=4 4938 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 240690a_100025705714_100015343762 [0,1,0,0,0,1|2,0,0]=4 4939 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 527a_100025705714_100103153847 [0,1,0,0,0,1|2,0,0]=4 4940 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 11a_100011211633_100015343762 [0,1,0,0,0,1|2,0,0]=4 4941 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 1626a_100011211633_100015343762 [0,1,0,0,0,1|2,0,0]=4 4942 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 240690a_100011211633_100015343762 [0,1,0,0,0,1|2,0,0]=4 4943 B13R1.150 CC(=O)NCc1cccc(c1Cl)Cl 527a_100011211633_100103153847 [0,1,0,0,0,1|2,0,0]=4 4944 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 11a_100012001614_100015343762 [0,1,0,0,0,1|2,0,0]=4 4945 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 1626a_100012001614_100015343762 [0,1,0,0,0,1|2,0,0]=4 4946 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 240690a_100012001614_100015343762 [0,1,0,0,0,1|2,0,0]=4 4947 B13R1.150 CC(=O)NCc1cccc(c1Cl)F 527a_100012001614_100103153847 [0,1,0,0,0,1|2,0,0]=4 4948 B13R1.150 CC(=O)NCc1cccc(c1F)Br 11a_100015189953_100015343762 [0,1,0,0,0,1|2,0,0]=4 4949 B13R1.150 CC(=O)NCc1cccc(c1F)Br 1626a_100015189953_100015343762 [0,1,0,0,0,1|2,0,0]=4 4950 B13R1.150 CC(=O)NCc1cccc(c1F)Br 240690a_100015189953_100015343762 [0,1,0,0,0,1|2,0,0]=4 4951 B13R1.150 CC(=O)NCc1cccc(c1F)Br 527a_100015189953_100103153847 [0,1,0,0,0,1|2,0,0]=4 4952 B13R1.150 CC(=O)NCc1cccc(c1F)C 11a_100012002060_100015343762 [0,1,0,0,0,1|2,0,0]=4 4953 B13R1.150 CC(=O)NCc1cccc(c1F)C 1626a_100012002060_100015343762 [0,1,0,0,0,1|2,0,0]=4 4954 B13R1.150 CC(=O)NCc1cccc(c1F)C 240690a_100012002060_100015343762 [0,1,0,0,0,1|2,0,0]=4 4955 B13R1.150 CC(=O)NCc1cccc(c1F)C 527a_100012002060_100103153847 [0,1,0,0,0,1|2,0,0]=4 4956 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 11a_100000764326_100015343762 [0,1,0,0,0,1|2,0,0]=4 4957 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 1626a_100000764326_100015343762 [0,1,0,0,0,1|2,0,0]=4 4958 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 240690a_100000764326_100015343762 [0,1,0,0,0,1|2,0,0]=4 4959 B13R1.150 CC(=O)NCc1cccc(c1F)Cl 527a_100000764326_100103153847 [0,1,0,0,0,1|2,0,0]=4 4960 B13R1.150 CC(=O)NCc1cccc(c1F)F 11a_100011199105_100015343762 [0,1,0,0,0,1|2,0,0]=4 4961 B13R1.150 CC(=O)NCc1cccc(c1F)F 1626a_100011199105_100015343762 [0,1,0,0,0,1|2,0,0]=4 4962 B13R1.150 CC(=O)NCc1cccc(c1F)F 240690a_100011199105_100015343762 [0,1,0,0,0,1|2,0,0]=4 4963 B13R1.150 CC(=O)NCc1cccc(c1F)F 527a_100011199105_100103153847 [0,1,0,0,0,1|2,0,0]=4 4964 B13R1.150 CC(=O)NCc1cccc(c1F)O 240690a_100025773512_100015343762 [0,1,0,0,0,1|1,0,0]=3 4965 B13R1.150 CC(=O)NCc1cccc(c1F)O 527a_100025773512_100103153847 [0,1,0,0,0,1|1,0,0]=3 4966 B13R1.150 CC(=O)NCc1cccc(c1O)C 11a_100020639391_100015343762 [0,1,0,0,0,1|2,0,0]=4 4967 B13R1.150 CC(=O)NCc1cccc(c1O)C 240690a_100020639391_100015343762 [0,1,0,0,0,1|2,0,0]=4 4968 B13R1.150 CC(=O)NCc1cccc(c1O)C 527a_100020639391_100103153847 [0,1,0,0,0,1|2,0,0]=4 4969 B13R1.150 CC(=O)NNc1cccc(c1Br)Cl 22a_100102837889_100000070787 [0,1,0,0,0,1|2,0,0]=4 4970 B13R1.150 CC(=O)NNc1cccc(c1C)C 22a_100020604495_100000070787 [0,1,0,0,0,1|2,0,0]=4 4971 B13R1.150 CC(=O)NNc1cccc(c1C)Cl 22a_100000738547_100000070787 [0,1,0,0,0,1|2,0,0]=4 4972 B13R1.150 CC(=O)NNc1cccc(c1Cl)Cl 22a_100000009159_100000070787 [0,1,0,0,0,1|2,0,0]=4 4973 B13R1.150 CC(=O)NNc1cccc(c1Cl)F 22a_100000122369_100000070787 [0,1,0,0,0,1|2,0,0]=4 4974 B13R1.150 CC(=O)NNc1cccc(c1F)Cl 22a_100000746303_100000070787 [0,1,0,0,0,1|2,0,0]=4 4975 B13R1.150 CC(=O)NNc1cccc(c1F)F 22a_100020612164_100000070787 [0,1,0,0,0,1|2,0,0]=4 4976 B13R1.150 Cc1c(cccc1C=CC(=O)[13CH3])F 1458a_100102526135_200025704644 [0,1,0,0,0,1|2,0,0]=4 4977 B13R1.150 Cc1c(cccc1CCC(=O)[13CH3])F 1458a_100000069055_200025704644 [0,1,0,0,0,1|2,0,0]=4 4978 B13R1.150 Cc1c(cccc1NCC(=O)N)O 34a_100011216573_100000187820 [0,1,0,0,0,1|2,0,0]=4 4979 B13R1.150 Cc1c(cccc1NCC(=O)N)O 7a_100011216573_100000187820 [0,1,0,0,0,1|2,0,0]=4 4980 B13R1.150 Cc1c(cccc1NCC(=O)[O-])O 34a_100011216573_100020667443 [0,1,0,0,0,1|2,0,0]=4 4981 B13R1.150 Cc1c(cccc1OCC(=O)N)Br 34a_100012002258_100000187820 [0,1,0,0,0,1|2,0,0]=4 4982 B13R1.150 Cc1c(cccc1OCC(=O)N)Br 7a_100012002258_100000187820 [0,1,0,0,0,1|2,0,0]=4 4983 B13R1.150 Cc1c(cccc1OCC(=O)N)Cl 34a_100011265684_100000187820 [0,1,0,0,0,1|2,0,0]=4 4984 B13R1.150 Cc1c(cccc1OCC(=O)N)Cl 7a_100011265684_100000187820 [0,1,0,0,0,1|2,0,0]=4 4985 B13R1.150 Cc1c(cccc1OCC(=O)N)F 34a_100011217231_100000187820 [0,1,0,0,0,1|2,0,0]=4 4986 B13R1.150 Cc1c(cccc1OCC(=O)N)F 7a_100011217231_100000187820 [0,1,0,0,0,1|2,0,0]=4 4987 B13R1.150 Cc1c(cccc1OCC(=O)N)N 34a_100011216573_100000187820 [0,1,0,0,0,1|2,0,0]=4 4988 B13R1.150 Cc1c(cccc1OCC(=O)N)N 7a_100011216573_100000187820 [0,1,0,0,0,1|2,0,0]=4 4989 B13R1.150 Cc1c(cccc1OCC(=O)[O-])Br 34a_100012002258_100020667443 [0,1,0,0,0,1|2,0,0]=4 4990 B13R1.150 Cc1c(cccc1OCC(=O)[O-])Cl 34a_100011265684_100020667443 [0,1,0,0,0,1|2,0,0]=4 4991 B13R1.150 Cc1c(cccc1OCC(=O)[O-])F 34a_100011217231_100020667443 [0,1,0,0,0,1|2,0,0]=4 4992 B13R1.150 Cc1c(cccc1OCC(=O)[O-])N 34a_100011216573_100020667443 [0,1,0,0,0,1|2,0,0]=4 4993 B13R1.150 Cc1c(cccc1SCC(=O)N)O 62a_100000747473_100012002258 [0,1,0,0,0,1|1,1,0]=4 4994 B13R1.150 Cc1c(cccc1SCC(=O)N)O 62a_100012002258_100000747473 [0,1,0,0,0,1|1,1,0]=4 4995 B13R1.150 Cc1c(cccc1SCC(=O)[O-])O 62a_100012002258_100020667443 [0,1,0,0,0,1|1,1,0]=4 4996 B13R1.150 Cc1c(cccc1SCC(=O)[O-])O 62a_100020667443_100012002258 [0,1,0,0,0,1|1,1,0]=4 4997 B13R1.150 Cc1cccc(c1Br)OCC(=O)N 34a_100000686692_100000187820 [0,1,0,0,0,1|2,0,0]=4 4998 B13R1.150 Cc1cccc(c1Br)OCC(=O)N 7a_100000686692_100000187820 [0,1,0,0,0,1|2,0,0]=4 4999 B13R1.150 Cc1cccc(c1Br)OCC(=O)[O-] 34a_100000686692_100020667443 [0,1,0,0,0,1|2,0,0]=4 5000 B13R1.150 Cc1cccc(c1C)CCC(=O)[13CH3] 1458a_100011218151_200025704644 [0,1,0,0,0,1|2,0,0]=4 5001 B13R1.150 Cc1cccc(c1C)OCC(=O)N 34a_100000185855_100000187820 [0,1,0,0,0,1|2,0,0]=4 5002 B13R1.150 Cc1cccc(c1C)OCC(=O)N 7a_100000185855_100000187820 [0,1,0,0,0,1|2,0,0]=4 5003 B13R1.150 Cc1cccc(c1C)OCC(=O)[13CH3] 1458a_200000183798_200025704644 [0,1,0,0,0,1|1,0,0]=3 5004 B13R1.150 Cc1cccc(c1C)OCC(=O)[O-] 34a_100000185855_100020667443 [0,1,0,0,0,1|2,0,0]=4 5005 B13R1.150 Cc1cccc(c1Cl)OCC(=O)N 34a_100000695629_100000187820 [0,1,0,0,0,1|2,0,0]=4 5006 B13R1.150 Cc1cccc(c1Cl)OCC(=O)N 7a_100000695629_100000187820 [0,1,0,0,0,1|2,0,0]=4 5007 B13R1.150 Cc1cccc(c1Cl)OCC(=O)[O-] 34a_100000695629_100020667443 [0,1,0,0,0,1|2,0,0]=4 5008 B13R1.150 Cc1cccc(c1F)OCC(=O)N 34a_100000751311_100000187820 [0,1,0,0,0,1|2,0,0]=4 5009 B13R1.150 Cc1cccc(c1F)OCC(=O)N 7a_100000751311_100000187820 [0,1,0,0,0,1|2,0,0]=4 5010 B13R1.150 Cc1cccc(c1F)OCC(=O)[O-] 34a_100000751311_100020667443 [0,1,0,0,0,1|2,0,0]=4 5011 B13R1.150 Cc1cccc(c1I)OCC(=O)N 34a_100010083724_100000187820 [0,1,0,0,0,1|2,0,0]=4 5012 B13R1.150 Cc1cccc(c1I)OCC(=O)N 7a_100010083724_100000187820 [0,1,0,0,0,1|2,0,0]=4 5013 B13R1.150 Cc1cccc(c1I)OCC(=O)[O-] 34a_100010083724_100020667443 [0,1,0,0,0,1|2,0,0]=4 5014 B13R1.150 Cc1cccc(c1N)OCC(=O)N 34a_100000743429_100000187820 [0,1,0,0,0,1|2,0,0]=4 5015 B13R1.150 Cc1cccc(c1N)OCC(=O)N 7a_100000743429_100000187820 [0,1,0,0,0,1|2,0,0]=4 5016 B13R1.150 Cc1cccc(c1N)OCC(=O)[O-] 34a_100000743429_100020667443 [0,1,0,0,0,1|2,0,0]=4 5017 B13R1.150 NC(=O)CNc1cccc(c1Br)O 34a_100012183704_100000187820 [0,1,0,0,0,1|2,0,0]=4 5018 B13R1.150 NC(=O)CNc1cccc(c1Br)O 7a_100012183704_100000187820 [0,1,0,0,0,1|2,0,0]=4 5019 B13R1.150 NC(=O)CNc1cccc(c1Cl)O 34a_100012002038_100000187820 [0,1,0,0,0,1|2,0,0]=4 5020 B13R1.150 NC(=O)CNc1cccc(c1Cl)O 7a_100012002038_100000187820 [0,1,0,0,0,1|2,0,0]=4 5021 B13R1.150 NC(=O)COc1cccc(c1Br)Br 34a_100010187966_100000187820 [0,1,0,0,0,1|2,0,0]=4 5022 B13R1.150 NC(=O)COc1cccc(c1Br)Br 7a_100010187966_100000187820 [0,1,0,0,0,1|2,0,0]=4 5023 B13R1.150 NC(=O)COc1cccc(c1Br)Cl 34a_100012348804_100000187820 [0,1,0,0,0,1|2,0,0]=4 5024 B13R1.150 NC(=O)COc1cccc(c1Br)Cl 7a_100012348804_100000187820 [0,1,0,0,0,1|2,0,0]=4 5025 B13R1.150 NC(=O)COc1cccc(c1Br)F 34a_100009820682_100000187820 [0,1,0,0,0,1|2,0,0]=4 5026 B13R1.150 NC(=O)COc1cccc(c1Br)F 7a_100009820682_100000187820 [0,1,0,0,0,1|2,0,0]=4 5027 B13R1.150 NC(=O)COc1cccc(c1Br)I 34a_100010187914_100000187820 [0,1,0,0,0,1|2,0,0]=4 5028 B13R1.150 NC(=O)COc1cccc(c1Br)I 7a_100010187914_100000187820 [0,1,0,0,0,1|2,0,0]=4 5029 B13R1.150 NC(=O)COc1cccc(c1Br)N 34a_100012183704_100000187820 [0,1,0,0,0,1|2,0,0]=4 5030 B13R1.150 NC(=O)COc1cccc(c1Br)N 7a_100012183704_100000187820 [0,1,0,0,0,1|2,0,0]=4 5031 B13R1.150 NC(=O)COc1cccc(c1Cl)Br 34a_100010187913_100000187820 [0,1,0,0,0,1|2,0,0]=4 5032 B13R1.150 NC(=O)COc1cccc(c1Cl)Br 7a_100010187913_100000187820 [0,1,0,0,0,1|2,0,0]=4 5033 B13R1.150 NC(=O)COc1cccc(c1Cl)Cl 34a_100000211076_100000187820 [0,1,0,0,0,1|2,0,0]=4 5034 B13R1.150 NC(=O)COc1cccc(c1Cl)Cl 7a_100000211076_100000187820 [0,1,0,0,0,1|2,0,0]=4 5035 B13R1.150 NC(=O)COc1cccc(c1Cl)F 34a_100000087408_100000187820 [0,1,0,0,0,1|2,0,0]=4 5036 B13R1.150 NC(=O)COc1cccc(c1Cl)F 7a_100000087408_100000187820 [0,1,0,0,0,1|2,0,0]=4 5037 B13R1.150 NC(=O)COc1cccc(c1Cl)I 34a_100000049636_100000187820 [0,1,0,0,0,1|2,0,0]=4 5038 B13R1.150 NC(=O)COc1cccc(c1Cl)I 7a_100000049636_100000187820 [0,1,0,0,0,1|2,0,0]=4 5039 B13R1.150 NC(=O)COc1cccc(c1Cl)N 34a_100012002038_100000187820 [0,1,0,0,0,1|2,0,0]=4 5040 B13R1.150 NC(=O)COc1cccc(c1Cl)N 7a_100012002038_100000187820 [0,1,0,0,0,1|2,0,0]=4 5041 B13R1.150 NC(=O)COc1cccc(c1F)Br 34a_100009817021_100000187820 [0,1,0,0,0,1|2,0,0]=4 5042 B13R1.150 NC(=O)COc1cccc(c1F)Br 7a_100009817021_100000187820 [0,1,0,0,0,1|2,0,0]=4 5043 B13R1.150 NC(=O)COc1cccc(c1F)Cl 34a_100000687438_100000187820 [0,1,0,0,0,1|2,0,0]=4 5044 B13R1.150 NC(=O)COc1cccc(c1F)Cl 7a_100000687438_100000187820 [0,1,0,0,0,1|2,0,0]=4 5045 B13R1.150 NC(=O)COc1cccc(c1F)F 34a_100000751161_100000187820 [0,1,0,0,0,1|2,0,0]=4 5046 B13R1.150 NC(=O)COc1cccc(c1F)F 7a_100000751161_100000187820 [0,1,0,0,0,1|2,0,0]=4 5047 B13R1.150 NC(=O)COc1cccc(c1I)Br 34a_100010187912_100000187820 [0,1,0,0,0,1|2,0,0]=4 5048 B13R1.150 NC(=O)COc1cccc(c1I)Br 7a_100010187912_100000187820 [0,1,0,0,0,1|2,0,0]=4 5049 B13R1.150 NC(=O)COc1cccc(c1I)Cl 34a_100000050174_100000187820 [0,1,0,0,0,1|2,0,0]=4 5050 B13R1.150 NC(=O)COc1cccc(c1I)Cl 7a_100000050174_100000187820 [0,1,0,0,0,1|2,0,0]=4 5051 B13R1.150 NC(=O)COc1cccc(c1I)F 34a_100000690913_100000187820 [0,1,0,0,0,1|2,0,0]=4 5052 B13R1.150 NC(=O)COc1cccc(c1I)F 7a_100000690913_100000187820 [0,1,0,0,0,1|2,0,0]=4 5053 B13R1.150 NC(=O)COc1cccc(c1N)Br 34a_100011934926_100000187820 [0,1,0,0,0,1|2,0,0]=4 5054 B13R1.150 NC(=O)COc1cccc(c1N)Br 7a_100011934926_100000187820 [0,1,0,0,0,1|2,0,0]=4 5055 B13R1.150 NC(=O)COc1cccc(c1N)Cl 34a_100012022510_100000187820 [0,1,0,0,0,1|2,0,0]=4 5056 B13R1.150 NC(=O)COc1cccc(c1N)Cl 7a_100012022510_100000187820 [0,1,0,0,0,1|2,0,0]=4 5057 B13R1.150 NC(=O)COc1cccc(c1N)F 34a_100020591140_100000187820 [0,1,0,0,0,1|2,0,0]=4 5058 B13R1.150 NC(=O)COc1cccc(c1N)F 7a_100020591140_100000187820 [0,1,0,0,0,1|2,0,0]=4 5059 B13R1.150 NC(=O)COc1cccc(c1N)I 34a_200000049512_100000187820 [0,1,0,0,0,1|2,0,0]=4 5060 B13R1.150 NC(=O)COc1cccc(c1N)I 7a_200000049512_100000187820 [0,1,0,0,0,1|2,0,0]=4 5061 B13R1.150 NC(=O)COc1cccc(c1N)N 34a_100000033209_100000187820 [0,1,0,0,0,1|2,0,0]=4 5062 B13R1.150 NC(=O)CSc1cccc(c1Br)O 62a_100000747473_100010187914 [0,1,0,0,0,1|1,1,0]=4 5063 B13R1.150 NC(=O)CSc1cccc(c1Br)O 62a_100010187914_100000747473 [0,1,0,0,0,1|1,1,0]=4 5064 B13R1.150 NC(=O)CSc1cccc(c1Cl)O 62a_100000747473_100000049636 [0,1,0,0,0,1|1,1,0]=4 5065 B13R1.150 NC(=O)CSc1cccc(c1F)O 62a_100000747473_100009817021 [0,1,0,0,0,1|1,1,0]=4 5066 B13R1.150 NC(=O)CSc1cccc(c1F)O 62a_100009817021_100000747473 [0,1,0,0,0,1|1,1,0]=4 5067 B13R1.150 NC(=O)CSc1cccc(c1N)O 62a_100000747473_100011934926 [0,1,0,0,0,1|1,1,0]=4 5068 B13R1.150 NC(=O)CSc1cccc(c1O)O 62a_100000747473_100009815950 [0,1,0,0,0,1|1,1,0]=4 5069 B13R1.150 Nc1c(cccc1OCC(=O)[O-])Br 34a_100011934926_100020667443 [0,1,0,0,0,1|2,0,0]=4 5070 B13R1.150 Nc1c(cccc1OCC(=O)[O-])Cl 34a_100012022510_100020667443 [0,1,0,0,0,1|2,0,0]=4 5071 B13R1.150 Nc1c(cccc1OCC(=O)[O-])F 34a_100020591140_100020667443 [0,1,0,0,0,1|2,0,0]=4 5072 B13R1.150 Nc1c(cccc1OCC(=O)[O-])I 34a_200000049512_100020667443 [0,1,0,0,0,1|2,0,0]=4 5073 B13R1.150 Nc1c(cccc1SCC(=O)[O-])O 62a_100020667443_100011934926 [0,1,0,0,0,1|1,1,0]=4 5074 B13R1.150 Nc1cccc(c1Br)OCC(=O)[O-] 34a_100012183704_100020667443 [0,1,0,0,0,1|2,0,0]=4 5075 B13R1.150 Nc1cccc(c1Cl)OCC(=O)[O-] 34a_100012002038_100020667443 [0,1,0,0,0,1|2,0,0]=4 5076 B13R1.150 Nc1cccc(c1N)OCC(=O)[O-] 34a_100000033209_100020667443 [0,1,0,0,0,1|2,0,0]=4 5077 B13R1.150 O=C([O-])CNc1cccc(c1Br)O 34a_100012183704_100020667443 [0,1,0,0,0,1|2,0,0]=4 5078 B13R1.150 O=C([O-])CNc1cccc(c1Cl)O 34a_100012002038_100020667443 [0,1,0,0,0,1|2,0,0]=4 5079 B13R1.150 O=C([O-])COc1cccc(c1Br)Br 34a_100010187966_100020667443 [0,1,0,0,0,1|2,0,0]=4 5080 B13R1.150 O=C([O-])COc1cccc(c1Br)Cl 34a_100012348804_100020667443 [0,1,0,0,0,1|2,0,0]=4 5081 B13R1.150 O=C([O-])COc1cccc(c1Br)F 34a_100009820682_100020667443 [0,1,0,0,0,1|2,0,0]=4 5082 B13R1.150 O=C([O-])COc1cccc(c1Br)I 34a_100010187914_100020667443 [0,1,0,0,0,1|2,0,0]=4 5083 B13R1.150 O=C([O-])COc1cccc(c1Cl)Br 34a_100010187913_100020667443 [0,1,0,0,0,1|2,0,0]=4 5084 B13R1.150 O=C([O-])COc1cccc(c1Cl)Cl 34a_100000211076_100020667443 [0,1,0,0,0,1|2,0,0]=4 5085 B13R1.150 O=C([O-])COc1cccc(c1Cl)F 34a_100000087408_100020667443 [0,1,0,0,0,1|2,0,0]=4 5086 B13R1.150 O=C([O-])COc1cccc(c1Cl)I 34a_100000049636_100020667443 [0,1,0,0,0,1|2,0,0]=4 5087 B13R1.150 O=C([O-])COc1cccc(c1F)Br 34a_100009817021_100020667443 [0,1,0,0,0,1|2,0,0]=4 5088 B13R1.150 O=C([O-])COc1cccc(c1F)Cl 34a_100000687438_100020667443 [0,1,0,0,0,1|2,0,0]=4 5089 B13R1.150 O=C([O-])COc1cccc(c1F)F 34a_100000751161_100020667443 [0,1,0,0,0,1|2,0,0]=4 5090 B13R1.150 O=C([O-])COc1cccc(c1I)Br 34a_100010187912_100020667443 [0,1,0,0,0,1|2,0,0]=4 5091 B13R1.150 O=C([O-])COc1cccc(c1I)Cl 34a_100000050174_100020667443 [0,1,0,0,0,1|2,0,0]=4 5092 B13R1.150 O=C([O-])COc1cccc(c1I)F 34a_100000690913_100020667443 [0,1,0,0,0,1|2,0,0]=4 5093 B13R1.150 O=C([O-])CSc1cccc(c1Br)O 62a_100010187914_100020667443 [0,1,0,0,0,1|1,1,0]=4 5094 B13R1.150 O=C([O-])CSc1cccc(c1Br)O 62a_100020667443_100010187914 [0,1,0,0,0,1|1,1,0]=4 5095 B13R1.150 O=C([O-])CSc1cccc(c1Cl)O 62a_100020667443_100000049636 [0,1,0,0,0,1|1,1,0]=4 5096 B13R1.150 O=C([O-])CSc1cccc(c1F)O 62a_100009817021_100020667443 [0,1,0,0,0,1|1,1,0]=4 5097 B13R1.150 O=C([O-])CSc1cccc(c1F)O 62a_100020667443_100009817021 [0,1,0,0,0,1|1,1,0]=4 5098 B13R1.150 O=C([O-])CSc1cccc(c1O)O 62a_100020667443_100009815950 [0,1,0,0,0,1|1,1,0]=4 5099 B13R1.150 [13CH3]C(=O)C=Cc1cccc(c1Cl)Cl 1458a_100000184505_200025704644 [0,1,0,0,0,1|2,0,0]=4 5100 B13R1.150 [13CH3]C(=O)C=Cc1cccc(c1F)Br 1458a_100012351547_200025704644 [0,1,0,0,0,1|2,0,0]=4 5101 B13R1.150 [13CH3]C(=O)C=Cc1cccc(c1F)Cl 1458a_100011217667_200025704644 [0,1,0,0,0,1|2,0,0]=4 5102 B13R1.150 [13CH3]C(=O)C=Cc1cccc(c1F)F 1458a_100102526107_200025704644 [0,1,0,0,0,1|2,0,0]=4 5103 B13R1.150 [13CH3]C(=O)CCc1cccc(c1Cl)Cl 1458a_100000739359_200025704644 [0,1,0,0,0,1|2,0,0]=4 5104 B13R1.150 [13CH3]C(=O)CCc1cccc(c1F)Br 1458a_100012349569_200025704644 [0,1,0,0,0,1|2,0,0]=4 5105 B13R1.150 [13CH3]C(=O)CCc1cccc(c1F)Cl 1458a_100012349026_200025704644 [0,1,0,0,0,1|2,0,0]=4 5106 B13R1.150 [13CH3]C(=O)CCc1cccc(c1F)F 1458a_100000748811_200025704644 [0,1,0,0,0,1|2,0,0]=4 5107 B13R1.150 [13CH3]C(=O)CCc1cccc(c1O)O 1458a_100009873524_200025704644 [0,1,0,0,0,1|1,0,0]=3 5108 B13R1.150 [13CH3]C(=O)COc1cccc(c1Cl)Cl 1458a_100000191259_200025704644 [0,1,0,0,0,1|1,0,0]=3 5109 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 34a_100000759471_100000748629 [0,1,0,0,0,1|2,0,0]=4 5110 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 7a_100000759471_100000748629 [0,1,0,0,0,1|2,0,0]=4 5111 B13R1.511 C=C(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000748629 [0,1,0,0,0,1|2,0,0]=4 5112 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000748629 [0,1,0,0,0,1|2,0,0]=4 5113 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000748629 [0,1,0,0,0,1|2,0,0]=4 5114 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [0,1,0,0,0,1|2,0,0]=4 5115 B13R1.511 C=C(C)COc1ccc(c(c1)Br)C 34a_100011380479_100000748629 [0,1,0,0,0,1|2,0,0]=4 5116 B13R1.511 C=C(C)COc1ccc(c(c1)Br)C 7a_100011380479_100000748629 [0,1,0,0,0,1|2,0,0]=4 5117 B13R1.511 C=C(C)COc1ccc(c(c1)Br)Cl 34a_100011933957_100000748629 [0,1,0,0,0,1|2,0,0]=4 5118 B13R1.511 C=C(C)COc1ccc(c(c1)Br)Cl 7a_100011933957_100000748629 [0,1,0,0,0,1|2,0,0]=4 5119 B13R1.511 C=C(C)COc1ccc(c(c1)Br)F 34a_100000693481_100000748629 [0,1,0,0,0,1|2,0,0]=4 5120 B13R1.511 C=C(C)COc1ccc(c(c1)Br)F 7a_100000693481_100000748629 [0,1,0,0,0,1|2,0,0]=4 5121 B13R1.511 C=C(C)COc1ccc(c(c1)Br)I 34a_100000701344_100000748629 [0,1,0,0,0,1|2,0,0]=4 5122 B13R1.511 C=C(C)COc1ccc(c(c1)Br)I 7a_100000701344_100000748629 [0,1,0,0,0,1|2,0,0]=4 5123 B13R1.511 C=C(C)COc1ccc(c(c1)Br)N 34a_100012001276_100000748629 [0,1,0,0,0,1|2,0,0]=4 5124 B13R1.511 C=C(C)COc1ccc(c(c1)Br)N 7a_100012001276_100000748629 [0,1,0,0,0,1|2,0,0]=4 5125 B13R1.511 C=C(C)COc1ccc(c(c1)C)Br 34a_100000690111_100000748629 [0,1,0,0,0,1|2,0,0]=4 5126 B13R1.511 C=C(C)COc1ccc(c(c1)C)Br 7a_100000690111_100000748629 [0,1,0,0,0,1|2,0,0]=4 5127 B13R1.511 C=C(C)COc1ccc(c(c1)C)C 34a_100000210932_100000748629 [0,1,0,0,0,1|2,0,0]=4 5128 B13R1.511 C=C(C)COc1ccc(c(c1)C)C 7a_100000210932_100000748629 [0,1,0,0,0,1|2,0,0]=4 5129 B13R1.511 C=C(C)COc1ccc(c(c1)C)Cl 34a_100000211092_100000748629 [0,1,0,0,0,1|2,0,0]=4 5130 B13R1.511 C=C(C)COc1ccc(c(c1)C)Cl 7a_100000211092_100000748629 [0,1,0,0,0,1|2,0,0]=4 5131 B13R1.511 C=C(C)COc1ccc(c(c1)C)F 34a_100000751312_100000748629 [0,1,0,0,0,1|2,0,0]=4 5132 B13R1.511 C=C(C)COc1ccc(c(c1)C)F 7a_100000751312_100000748629 [0,1,0,0,0,1|2,0,0]=4 5133 B13R1.511 C=C(C)COc1ccc(c(c1)C)I 34a_100000729255_100000748629 [0,1,0,0,0,1|2,0,0]=4 5134 B13R1.511 C=C(C)COc1ccc(c(c1)C)I 7a_100000729255_100000748629 [0,1,0,0,0,1|2,0,0]=4 5135 B13R1.511 C=C(C)COc1ccc(c(c1)C)N 34a_100000756630_100000748629 [0,1,0,0,0,1|2,0,0]=4 5136 B13R1.511 C=C(C)COc1ccc(c(c1)C)N 7a_100000756630_100000748629 [0,1,0,0,0,1|2,0,0]=4 5137 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Br 34a_100011215161_100000748629 [0,1,0,0,0,1|2,0,0]=4 5138 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Br 7a_100011215161_100000748629 [0,1,0,0,0,1|2,0,0]=4 5139 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)C 34a_100011265682_100000748629 [0,1,0,0,0,1|2,0,0]=4 5140 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)C 7a_100011265682_100000748629 [0,1,0,0,0,1|2,0,0]=4 5141 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Cl 34a_100000211054_100000748629 [0,1,0,0,0,1|2,0,0]=4 5142 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)Cl 7a_100000211054_100000748629 [0,1,0,0,0,1|2,0,0]=4 5143 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)F 34a_100000211030_100000748629 [0,1,0,0,0,1|2,0,0]=4 5144 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)F 7a_100000211030_100000748629 [0,1,0,0,0,1|2,0,0]=4 5145 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)I 34a_100000047559_100000748629 [0,1,0,0,0,1|2,0,0]=4 5146 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)I 7a_100000047559_100000748629 [0,1,0,0,0,1|2,0,0]=4 5147 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)N 34a_100011215599_100000748629 [0,1,0,0,0,1|2,0,0]=4 5148 B13R1.511 C=C(C)COc1ccc(c(c1)Cl)N 7a_100011215599_100000748629 [0,1,0,0,0,1|2,0,0]=4 5149 B13R1.511 C=C(C)COc1ccc(c(c1)F)Br 34a_100000755031_100000748629 [0,1,0,0,0,1|2,0,0]=4 5150 B13R1.511 C=C(C)COc1ccc(c(c1)F)Br 7a_100000755031_100000748629 [0,1,0,0,0,1|2,0,0]=4 5151 B13R1.511 C=C(C)COc1ccc(c(c1)F)C 34a_100000722560_100000748629 [0,1,0,0,0,1|2,0,0]=4 5152 B13R1.511 C=C(C)COc1ccc(c(c1)F)C 7a_100000722560_100000748629 [0,1,0,0,0,1|2,0,0]=4 5153 B13R1.511 C=C(C)COc1ccc(c(c1)F)Cl 34a_100000691581_100000748629 [0,1,0,0,0,1|2,0,0]=4 5154 B13R1.511 C=C(C)COc1ccc(c(c1)F)Cl 7a_100000691581_100000748629 [0,1,0,0,0,1|2,0,0]=4 5155 B13R1.511 C=C(C)COc1ccc(c(c1)F)F 34a_100000181275_100000748629 [0,1,0,0,0,1|2,0,0]=4 5156 B13R1.511 C=C(C)COc1ccc(c(c1)F)F 7a_100000181275_100000748629 [0,1,0,0,0,1|2,0,0]=4 5157 B13R1.511 C=C(C)COc1ccc(c(c1)F)I 34a_100009990212_100000748629 [0,1,0,0,0,1|2,0,0]=4 5158 B13R1.511 C=C(C)COc1ccc(c(c1)F)I 7a_100009990212_100000748629 [0,1,0,0,0,1|2,0,0]=4 5159 B13R1.511 C=C(C)COc1ccc(c(c1)F)N 34a_100000759473_100000748629 [0,1,0,0,0,1|2,0,0]=4 5160 B13R1.511 C=C(C)COc1ccc(c(c1)F)N 7a_100000759473_100000748629 [0,1,0,0,0,1|2,0,0]=4 5161 B13R1.511 C=C(C)COc1ccc(c(c1)I)Br 34a_100012339312_100000748629 [0,1,0,0,0,1|2,0,0]=4 5162 B13R1.511 C=C(C)COc1ccc(c(c1)I)Br 7a_100012339312_100000748629 [0,1,0,0,0,1|2,0,0]=4 5163 B13R1.511 C=C(C)COc1ccc(c(c1)I)Cl 34a_100000049588_100000748629 [0,1,0,0,0,1|2,0,0]=4 5164 B13R1.511 C=C(C)COc1ccc(c(c1)I)Cl 7a_100000049588_100000748629 [0,1,0,0,0,1|2,0,0]=4 5165 B13R1.511 C=C(C)COc1ccc(c(c1)I)N 34a_100010084370_100000748629 [0,1,0,0,0,1|2,0,0]=4 5166 B13R1.511 C=C(C)COc1ccc(c(c1)I)N 7a_100010084370_100000748629 [0,1,0,0,0,1|2,0,0]=4 5167 B13R1.511 C=C(C)COc1ccc(c(c1)N)Br 34a_100011999798_100000748629 [0,1,0,0,0,1|2,0,0]=4 5168 B13R1.511 C=C(C)COc1ccc(c(c1)N)Br 7a_100011999798_100000748629 [0,1,0,0,0,1|2,0,0]=4 5169 B13R1.511 C=C(C)COc1ccc(c(c1)N)C 34a_100011216113_100000748629 [0,1,0,0,0,1|2,0,0]=4 5170 B13R1.511 C=C(C)COc1ccc(c(c1)N)C 7a_100011216113_100000748629 [0,1,0,0,0,1|2,0,0]=4 5171 B13R1.511 C=C(C)COc1ccc(c(c1)N)Cl 34a_100011934297_100000748629 [0,1,0,0,0,1|2,0,0]=4 5172 B13R1.511 C=C(C)COc1ccc(c(c1)N)F 34a_100012017239_100000748629 [0,1,0,0,0,1|2,0,0]=4 5173 B13R1.511 C=C(C)COc1ccc(c(c1)N)F 7a_100012017239_100000748629 [0,1,0,0,0,1|2,0,0]=4 5174 B13R1.511 C=C(C)COc1ccc(c(c1)N)N 34a_100025771000_100000748629 [0,1,0,0,0,1|2,0,0]=4 5175 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100000748629_100012356990 [0,1,0,0,0,1|1,1,0]=4 5176 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000211660 [0,1,0,0,0,1|1,1,0]=4 5177 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000685420_100000211660 [0,1,0,0,0,1|1,1,0]=4 5178 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000748629_100000685420 [0,1,0,0,0,1|1,1,0]=4 5179 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100000748629_100011356854 [0,1,0,0,0,1|1,1,0]=4 5180 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000211660 [0,1,0,0,0,1|1,1,0]=4 5181 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000211660 [0,1,0,0,0,1|1,1,0]=4 5182 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000748629_100000686035 [0,1,0,0,0,1|1,1,0]=4 5183 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000211660 [0,1,0,0,0,1|1,1,0]=4 5184 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000748629_100000739049 [0,1,0,0,0,1|1,1,0]=4 5185 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [0,1,0,0,0,1|1,1,0]=4 5186 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)Cl 1458a_100102889548_200000210301 [0,1,0,0,0,1|2,0,0]=4 5187 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)F 1458a_100011195070_200000210301 [0,1,0,0,0,1|2,0,0]=4 5188 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200000210301 [0,1,0,0,0,1|2,0,0]=4 5189 B13R1.511 CC(=O)C=Cc1ccc(c(c1)C)C 1458a_100011338269_200000210301 [0,1,0,0,0,1|2,0,0]=4 5190 B13R1.511 CC(=O)C=Cc1ccc(c(c1)C)F 1458a_100016261966_200000210301 [0,1,0,0,0,1|2,0,0]=4 5191 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)Cl 1458a_100000716972_200000210301 [0,1,0,0,0,1|2,0,0]=4 5192 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)F 1458a_100102525453_200000210301 [0,1,0,0,0,1|2,0,0]=4 5193 B13R1.511 CC(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200000210301 [0,1,0,0,0,1|2,0,0]=4 5194 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)Br 1458a_100102601611_200000210301 [0,1,0,0,0,1|2,0,0]=4 5195 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)C 1458a_100102526211_200000210301 [0,1,0,0,0,1|2,0,0]=4 5196 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)Cl 1458a_100020610926_200000210301 [0,1,0,0,0,1|2,0,0]=4 5197 B13R1.511 CC(=O)C=Cc1ccc(c(c1)F)F 1458a_100011195075_200000210301 [0,1,0,0,0,1|2,0,0]=4 5198 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_200000210301 [0,1,0,0,0,1|2,0,0]=4 5199 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200000210301 [0,1,0,0,0,1|2,0,0]=4 5200 B13R1.511 CC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_200000210301 [0,1,0,0,0,1|2,0,0]=4 5201 B13R1.511 CC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_200000210301 [0,1,0,0,0,1|2,0,0]=4 5202 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200000210301 [0,1,0,0,0,1|2,0,0]=4 5203 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000070787_100011713676 [0,1,0,0,0,1|2,0,0]=4 5204 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200000210301 [0,1,0,0,0,1|2,0,0]=4 5205 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000070787_100012361305 [0,1,0,0,0,1|2,0,0]=4 5206 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200000210301 [0,1,0,0,0,1|2,0,0]=4 5207 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200000210301 [0,1,0,0,0,1|2,0,0]=4 5208 B13R1.511 CC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_200000210301 [0,1,0,0,0,1|2,0,0]=4 5209 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200000210301 [0,1,0,0,0,1|2,0,0]=4 5210 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000070787_100000690553 [0,1,0,0,0,1|2,0,0]=4 5211 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200000210301 [0,1,0,0,0,1|2,0,0]=4 5212 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [0,1,0,0,0,1|1,0,0]=3 5213 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [0,1,0,0,0,1|1,0,0]=3 5214 B13R1.511 CC(=O)COc1ccc(c(c1)C)C 1458a_100000182425_200000210301 [0,1,0,0,0,1|1,0,0]=3 5215 B13R1.511 CC(=O)COc1ccc(c(c1)C)Cl 1458a_100000182483_200000210301 [0,1,0,0,0,1|1,0,0]=3 5216 B13R1.511 CC(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_200000210301 [0,1,0,0,0,1|1,0,0]=3 5217 B13R1.511 CC(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_200000210301 [0,1,0,0,0,1|1,0,0]=3 5218 B13R1.511 CC(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_200000210301 [0,1,0,0,0,1|1,0,0]=3 5219 B13R1.511 CC(=O)COc1ccc(c(c1)F)F 1458a_100000246063_200000210301 [0,1,0,0,0,1|1,0,0]=3 5220 B13R1.511 CC(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_200000210301 [0,1,0,0,0,1|1,1,0]=4 5221 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 11a_100012351559_100015343762 [0,1,0,0,0,1|2,0,0]=4 5222 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 1626a_100012351559_100015343762 [0,1,0,0,0,1|2,0,0]=4 5223 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 240690a_100012351559_100015343762 [0,1,0,0,0,1|2,0,0]=4 5224 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Br 527a_100012351559_100103153847 [0,1,0,0,0,1|2,0,0]=4 5225 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 11a_100012349490_100015343762 [0,1,0,0,0,1|2,0,0]=4 5226 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 1626a_100012349490_100015343762 [0,1,0,0,0,1|2,0,0]=4 5227 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 240690a_100012349490_100015343762 [0,1,0,0,0,1|2,0,0]=4 5228 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)Cl 527a_100012349490_100103153847 [0,1,0,0,0,1|2,0,0]=4 5229 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 11a_100015193890_100015343762 [0,1,0,0,0,1|2,0,0]=4 5230 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 1626a_100015193890_100015343762 [0,1,0,0,0,1|2,0,0]=4 5231 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 240690a_100015193890_100015343762 [0,1,0,0,0,1|2,0,0]=4 5232 B13R1.511 CC(=O)NCc1ccc(c(c1)Br)F 527a_100015193890_100103153847 [0,1,0,0,0,1|2,0,0]=4 5233 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 11a_100015205234_100015343762 [0,1,0,0,0,1|2,0,0]=4 5234 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 1626a_100015205234_100015343762 [0,1,0,0,0,1|2,0,0]=4 5235 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 240690a_100015205234_100015343762 [0,1,0,0,0,1|2,0,0]=4 5236 B13R1.511 CC(=O)NCc1ccc(c(c1)C)Br 527a_100015205234_100103153847 [0,1,0,0,0,1|2,0,0]=4 5237 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 11a_100025706692_100015343762 [0,1,0,0,0,1|2,0,0]=4 5238 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 1626a_100025706692_100015343762 [0,1,0,0,0,1|2,0,0]=4 5239 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 240690a_100025706692_100015343762 [0,1,0,0,0,1|2,0,0]=4 5240 B13R1.511 CC(=O)NCc1ccc(c(c1)C)C 527a_100025706692_100103153847 [0,1,0,0,0,1|2,0,0]=4 5241 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 11a_100000239911_100015343762 [0,1,0,0,0,1|2,0,0]=4 5242 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 1626a_100000239911_100015343762 [0,1,0,0,0,1|2,0,0]=4 5243 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 240690a_100000239911_100015343762 [0,1,0,0,0,1|2,0,0]=4 5244 B13R1.511 CC(=O)NCc1ccc(c(c1)C)F 527a_100000239911_100103153847 [0,1,0,0,0,1|2,0,0]=4 5245 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 11a_100012362553_100015343762 [0,1,0,0,0,1|2,0,0]=4 5246 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 1626a_100012362553_100015343762 [0,1,0,0,0,1|2,0,0]=4 5247 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 240690a_100012362553_100015343762 [0,1,0,0,0,1|2,0,0]=4 5248 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Br 527a_100012362553_100103153847 [0,1,0,0,0,1|2,0,0]=4 5249 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 11a_102495364989_100015343762 [0,1,0,0,0,1|2,0,0]=4 5250 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 1626a_102495364989_100015343762 [0,1,0,0,0,1|2,0,0]=4 5251 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 240690a_102495364989_100015343762 [0,1,0,0,0,1|2,0,0]=4 5252 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)C 527a_102495364989_100103153847 [0,1,0,0,0,1|2,0,0]=4 5253 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 11a_100000174881_100015343762 [0,1,0,0,0,1|2,0,0]=4 5254 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 1626a_100000174881_100015343762 [0,1,0,0,0,1|2,0,0]=4 5255 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 240690a_100000174881_100015343762 [0,1,0,0,0,1|2,0,0]=4 5256 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)Cl 527a_100000174881_100103153847 [0,1,0,0,0,1|2,0,0]=4 5257 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 11a_100000749334_100015343762 [0,1,0,0,0,1|2,0,0]=4 5258 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 1626a_100000749334_100015343762 [0,1,0,0,0,1|2,0,0]=4 5259 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 240690a_100000749334_100015343762 [0,1,0,0,0,1|2,0,0]=4 5260 B13R1.511 CC(=O)NCc1ccc(c(c1)Cl)F 527a_100000749334_100103153847 [0,1,0,0,0,1|2,0,0]=4 5261 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 11a_100000755036_100015343762 [0,1,0,0,0,1|2,0,0]=4 5262 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 1626a_100000755036_100015343762 [0,1,0,0,0,1|2,0,0]=4 5263 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 240690a_100000755036_100015343762 [0,1,0,0,0,1|2,0,0]=4 5264 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Br 527a_100000755036_100103153847 [0,1,0,0,0,1|2,0,0]=4 5265 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 11a_100102708794_100015343762 [0,1,0,0,0,1|2,0,0]=4 5266 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 1626a_100102708794_100015343762 [0,1,0,0,0,1|2,0,0]=4 5267 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 240690a_100102708794_100015343762 [0,1,0,0,0,1|2,0,0]=4 5268 B13R1.511 CC(=O)NCc1ccc(c(c1)F)C 527a_100102708794_100103153847 [0,1,0,0,0,1|2,0,0]=4 5269 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 11a_100011219866_100015343762 [0,1,0,0,0,1|2,0,0]=4 5270 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 1626a_100011219866_100015343762 [0,1,0,0,0,1|2,0,0]=4 5271 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 240690a_100011219866_100015343762 [0,1,0,0,0,1|2,0,0]=4 5272 B13R1.511 CC(=O)NCc1ccc(c(c1)F)Cl 527a_100011219866_100103153847 [0,1,0,0,0,1|2,0,0]=4 5273 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 11a_100000737897_100015343762 [0,1,0,0,0,1|2,0,0]=4 5274 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 1626a_100000737897_100015343762 [0,1,0,0,0,1|2,0,0]=4 5275 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 240690a_100000737897_100015343762 [0,1,0,0,0,1|2,0,0]=4 5276 B13R1.511 CC(=O)NCc1ccc(c(c1)F)F 527a_100000737897_100103153847 [0,1,0,0,0,1|2,0,0]=4 5277 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [0,1,0,0,0,1|2,0,0]=4 5278 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [0,1,0,0,0,1|2,0,0]=4 5279 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100015343762 [0,1,0,0,0,1|1,0,0]=3 5280 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100103153847 [0,1,0,0,0,1|1,0,0]=3 5281 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100015343762 [0,1,0,0,0,1|1,0,0]=3 5282 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100103153847 [0,1,0,0,0,1|1,0,0]=3 5283 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [0,1,0,0,0,1|1,0,0]=3 5284 B13R1.511 CC(=O)NNc1ccc(c(c1)Br)C 22a_100016991967_100000070787 [0,1,0,0,0,1|2,0,0]=4 5285 B13R1.511 CC(=O)NNc1ccc(c(c1)Br)F 22a_200025705588_100000070787 [0,1,0,0,0,1|2,0,0]=4 5286 B13R1.511 CC(=O)NNc1ccc(c(c1)C)Br 22a_100000745493_100000070787 [0,1,0,0,0,1|2,0,0]=4 5287 B13R1.511 CC(=O)NNc1ccc(c(c1)C)Cl 22a_100015233126_100000070787 [0,1,0,0,0,1|2,0,0]=4 5288 B13R1.511 CC(=O)NNc1ccc(c(c1)Cl)Br 22a_100102421838_100000070787 [0,1,0,0,0,1|2,0,0]=4 5289 B13R1.511 CC(=O)NNc1ccc(c(c1)Cl)C 22a_100000681537_100000070787 [0,1,0,0,0,1|2,0,0]=4 5290 B13R1.511 CC(=O)NNc1ccc(c(c1)Cl)Cl 22a_100000106602_100000070787 [0,1,0,0,0,1|2,0,0]=4 5291 B13R1.511 CC(=O)NNc1ccc(c(c1)Cl)F 22a_100000007618_100000070787 [0,1,0,0,0,1|2,0,0]=4 5292 B13R1.511 CC(=O)NNc1ccc(c(c1)F)Br 22a_100016992936_100000070787 [0,1,0,0,0,1|2,0,0]=4 5293 B13R1.511 CC(=O)NNc1ccc(c(c1)F)C 22a_100000689702_100000070787 [0,1,0,0,0,1|2,0,0]=4 5294 B13R1.511 CC(=O)NNc1ccc(c(c1)F)F 22a_100015184291_100000070787 [0,1,0,0,0,1|2,0,0]=4 5295 B13R1.511 Cc1cc(ccc1Br)OCC(=O)N 34a_100000690111_100000187820 [0,1,0,0,0,1|2,0,0]=4 5296 B13R1.511 Cc1cc(ccc1Br)OCC(=O)N 7a_100000690111_100000187820 [0,1,0,0,0,1|2,0,0]=4 5297 B13R1.511 Cc1cc(ccc1Br)OCC(=O)[O-] 34a_100000690111_100020667443 [0,1,0,0,0,1|2,0,0]=4 5298 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)N 34a_100000211092_100000187820 [0,1,0,0,0,1|2,0,0]=4 5299 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)N 7a_100000211092_100000187820 [0,1,0,0,0,1|2,0,0]=4 5300 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)[13CH3] 1458a_100000182483_200025704644 [0,1,0,0,0,1|1,0,0]=3 5301 B13R1.511 Cc1cc(ccc1Cl)OCC(=O)[O-] 34a_100000211092_100020667443 [0,1,0,0,0,1|2,0,0]=4 5302 B13R1.511 Cc1cc(ccc1F)C=CC(=O)[13CH3] 1458a_100016261966_200025704644 [0,1,0,0,0,1|2,0,0]=4 5303 B13R1.511 Cc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100011615030_200025704644 [0,1,0,0,0,1|2,0,0]=4 5304 B13R1.511 Cc1cc(ccc1F)OCC(=O)N 34a_100000751312_100000187820 [0,1,0,0,0,1|2,0,0]=4 5305 B13R1.511 Cc1cc(ccc1F)OCC(=O)N 7a_100000751312_100000187820 [0,1,0,0,0,1|2,0,0]=4 5306 B13R1.511 Cc1cc(ccc1F)OCC(=O)[O-] 34a_100000751312_100020667443 [0,1,0,0,0,1|2,0,0]=4 5307 B13R1.511 Cc1cc(ccc1I)OCC(=O)N 34a_100000729255_100000187820 [0,1,0,0,0,1|2,0,0]=4 5308 B13R1.511 Cc1cc(ccc1I)OCC(=O)N 7a_100000729255_100000187820 [0,1,0,0,0,1|2,0,0]=4 5309 B13R1.511 Cc1cc(ccc1I)OCC(=O)[O-] 34a_100000729255_100020667443 [0,1,0,0,0,1|2,0,0]=4 5310 B13R1.511 Cc1cc(ccc1N)OCC(=O)N 34a_100000756630_100000187820 [0,1,0,0,0,1|2,0,0]=4 5311 B13R1.511 Cc1cc(ccc1N)OCC(=O)N 7a_100000756630_100000187820 [0,1,0,0,0,1|2,0,0]=4 5312 B13R1.511 Cc1cc(ccc1N)OCC(=O)[O-] 34a_100000756630_100020667443 [0,1,0,0,0,1|2,0,0]=4 5313 B13R1.511 Cc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100010220830_200025704644 [0,1,0,0,0,1|2,0,0]=4 5314 B13R1.511 Cc1ccc(cc1Br)OCC(=O)N 34a_100011380479_100000187820 [0,1,0,0,0,1|2,0,0]=4 5315 B13R1.511 Cc1ccc(cc1Br)OCC(=O)N 7a_100011380479_100000187820 [0,1,0,0,0,1|2,0,0]=4 5316 B13R1.511 Cc1ccc(cc1Br)OCC(=O)[O-] 34a_100011380479_100020667443 [0,1,0,0,0,1|2,0,0]=4 5317 B13R1.511 Cc1ccc(cc1C)C=CC(=O)[13CH3] 1458a_100011338269_200025704644 [0,1,0,0,0,1|2,0,0]=4 5318 B13R1.511 Cc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011338283_200025704644 [0,1,0,0,0,1|2,0,0]=4 5319 B13R1.511 Cc1ccc(cc1C)OCC(=O)N 34a_100000210932_100000187820 [0,1,0,0,0,1|2,0,0]=4 5320 B13R1.511 Cc1ccc(cc1C)OCC(=O)N 7a_100000210932_100000187820 [0,1,0,0,0,1|2,0,0]=4 5321 B13R1.511 Cc1ccc(cc1C)OCC(=O)[13CH3] 1458a_100000182425_200025704644 [0,1,0,0,0,1|1,0,0]=3 5322 B13R1.511 Cc1ccc(cc1C)OCC(=O)[O-] 34a_100000210932_100020667443 [0,1,0,0,0,1|2,0,0]=4 5323 B13R1.511 Cc1ccc(cc1Cl)OCC(=O)N 34a_100011265682_100000187820 [0,1,0,0,0,1|2,0,0]=4 5324 B13R1.511 Cc1ccc(cc1Cl)OCC(=O)N 7a_100011265682_100000187820 [0,1,0,0,0,1|2,0,0]=4 5325 B13R1.511 Cc1ccc(cc1Cl)OCC(=O)[O-] 34a_100011265682_100020667443 [0,1,0,0,0,1|2,0,0]=4 5326 B13R1.511 Cc1ccc(cc1F)C=CC(=O)[13CH3] 1458a_100102526211_200025704644 [0,1,0,0,0,1|2,0,0]=4 5327 B13R1.511 Cc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100011830284_200025704644 [0,1,0,0,0,1|2,0,0]=4 5328 B13R1.511 Cc1ccc(cc1F)OCC(=O)N 34a_100000722560_100000187820 [0,1,0,0,0,1|2,0,0]=4 5329 B13R1.511 Cc1ccc(cc1F)OCC(=O)N 7a_100000722560_100000187820 [0,1,0,0,0,1|2,0,0]=4 5330 B13R1.511 Cc1ccc(cc1F)OCC(=O)[O-] 34a_100000722560_100020667443 [0,1,0,0,0,1|2,0,0]=4 5331 B13R1.511 Cc1ccc(cc1N)OCC(=O)N 34a_100011216113_100000187820 [0,1,0,0,0,1|2,0,0]=4 5332 B13R1.511 Cc1ccc(cc1N)OCC(=O)N 7a_100011216113_100000187820 [0,1,0,0,0,1|2,0,0]=4 5333 B13R1.511 Cc1ccc(cc1N)OCC(=O)[O-] 34a_100011216113_100020667443 [0,1,0,0,0,1|2,0,0]=4 5334 B13R1.511 Cc1ccc(cc1O)NCC(=O)N 34a_100000759471_100000187820 [0,1,0,0,0,1|2,0,0]=4 5335 B13R1.511 Cc1ccc(cc1O)NCC(=O)N 7a_100000759471_100000187820 [0,1,0,0,0,1|2,0,0]=4 5336 B13R1.511 Cc1ccc(cc1O)NCC(=O)[O-] 34a_100000759471_100020667443 [0,1,0,0,0,1|2,0,0]=4 5337 B13R1.511 Cc1ccc(cc1O)SCC(=O)N 62a_100000685420_100000747473 [0,1,0,0,0,1|1,1,0]=4 5338 B13R1.511 Cc1ccc(cc1O)SCC(=O)N 62a_100000747473_100000685420 [0,1,0,0,0,1|1,1,0]=4 5339 B13R1.511 Cc1ccc(cc1O)SCC(=O)[O-] 62a_100000685420_100020667443 [0,1,0,0,0,1|1,1,0]=4 5340 B13R1.511 Cc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100000685420 [0,1,0,0,0,1|1,1,0]=4 5341 B13R1.511 NC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000187820 [0,1,0,0,0,1|2,0,0]=4 5342 B13R1.511 NC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000187820 [0,1,0,0,0,1|2,0,0]=4 5343 B13R1.511 NC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000187820 [0,1,0,0,0,1|2,0,0]=4 5344 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [0,1,0,0,0,1|2,0,0]=4 5345 B13R1.511 NC(=O)COc1ccc(c(c1)Br)Cl 34a_100011933957_100000187820 [0,1,0,0,0,1|2,0,0]=4 5346 B13R1.511 NC(=O)COc1ccc(c(c1)Br)Cl 7a_100011933957_100000187820 [0,1,0,0,0,1|2,0,0]=4 5347 B13R1.511 NC(=O)COc1ccc(c(c1)Br)F 34a_100000693481_100000187820 [0,1,0,0,0,1|2,0,0]=4 5348 B13R1.511 NC(=O)COc1ccc(c(c1)Br)F 7a_100000693481_100000187820 [0,1,0,0,0,1|2,0,0]=4 5349 B13R1.511 NC(=O)COc1ccc(c(c1)Br)I 34a_100000701344_100000187820 [0,1,0,0,0,1|2,0,0]=4 5350 B13R1.511 NC(=O)COc1ccc(c(c1)Br)I 7a_100000701344_100000187820 [0,1,0,0,0,1|2,0,0]=4 5351 B13R1.511 NC(=O)COc1ccc(c(c1)Br)N 34a_100012001276_100000187820 [0,1,0,0,0,1|2,0,0]=4 5352 B13R1.511 NC(=O)COc1ccc(c(c1)Br)N 7a_100012001276_100000187820 [0,1,0,0,0,1|2,0,0]=4 5353 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)Br 34a_100011215161_100000187820 [0,1,0,0,0,1|2,0,0]=4 5354 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)Br 7a_100011215161_100000187820 [0,1,0,0,0,1|2,0,0]=4 5355 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)Cl 34a_100000211054_100000187820 [0,1,0,0,0,1|2,0,0]=4 5356 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)Cl 7a_100000211054_100000187820 [0,1,0,0,0,1|2,0,0]=4 5357 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)F 34a_100000211030_100000187820 [0,1,0,0,0,1|2,0,0]=4 5358 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)F 7a_100000211030_100000187820 [0,1,0,0,0,1|2,0,0]=4 5359 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)I 34a_100000047559_100000187820 [0,1,0,0,0,1|2,0,0]=4 5360 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)I 7a_100000047559_100000187820 [0,1,0,0,0,1|2,0,0]=4 5361 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)N 34a_100011215599_100000187820 [0,1,0,0,0,1|2,0,0]=4 5362 B13R1.511 NC(=O)COc1ccc(c(c1)Cl)N 7a_100011215599_100000187820 [0,1,0,0,0,1|2,0,0]=4 5363 B13R1.511 NC(=O)COc1ccc(c(c1)F)Br 34a_100000755031_100000187820 [0,1,0,0,0,1|2,0,0]=4 5364 B13R1.511 NC(=O)COc1ccc(c(c1)F)Br 7a_100000755031_100000187820 [0,1,0,0,0,1|2,0,0]=4 5365 B13R1.511 NC(=O)COc1ccc(c(c1)F)Cl 34a_100000691581_100000187820 [0,1,0,0,0,1|2,0,0]=4 5366 B13R1.511 NC(=O)COc1ccc(c(c1)F)Cl 7a_100000691581_100000187820 [0,1,0,0,0,1|2,0,0]=4 5367 B13R1.511 NC(=O)COc1ccc(c(c1)F)F 34a_100000181275_100000187820 [0,1,0,0,0,1|2,0,0]=4 5368 B13R1.511 NC(=O)COc1ccc(c(c1)F)F 7a_100000181275_100000187820 [0,1,0,0,0,1|2,0,0]=4 5369 B13R1.511 NC(=O)COc1ccc(c(c1)F)I 34a_100009990212_100000187820 [0,1,0,0,0,1|2,0,0]=4 5370 B13R1.511 NC(=O)COc1ccc(c(c1)F)I 7a_100009990212_100000187820 [0,1,0,0,0,1|2,0,0]=4 5371 B13R1.511 NC(=O)COc1ccc(c(c1)F)N 34a_100000759473_100000187820 [0,1,0,0,0,1|2,0,0]=4 5372 B13R1.511 NC(=O)COc1ccc(c(c1)F)N 7a_100000759473_100000187820 [0,1,0,0,0,1|2,0,0]=4 5373 B13R1.511 NC(=O)COc1ccc(c(c1)I)Br 34a_100012339312_100000187820 [0,1,0,0,0,1|2,0,0]=4 5374 B13R1.511 NC(=O)COc1ccc(c(c1)I)Br 7a_100012339312_100000187820 [0,1,0,0,0,1|2,0,0]=4 5375 B13R1.511 NC(=O)COc1ccc(c(c1)I)Cl 34a_100000049588_100000187820 [0,1,0,0,0,1|2,0,0]=4 5376 B13R1.511 NC(=O)COc1ccc(c(c1)I)Cl 7a_100000049588_100000187820 [0,1,0,0,0,1|2,0,0]=4 5377 B13R1.511 NC(=O)COc1ccc(c(c1)I)N 34a_100010084370_100000187820 [0,1,0,0,0,1|2,0,0]=4 5378 B13R1.511 NC(=O)COc1ccc(c(c1)I)N 7a_100010084370_100000187820 [0,1,0,0,0,1|2,0,0]=4 5379 B13R1.511 NC(=O)COc1ccc(c(c1)N)Br 34a_100011999798_100000187820 [0,1,0,0,0,1|2,0,0]=4 5380 B13R1.511 NC(=O)COc1ccc(c(c1)N)Br 7a_100011999798_100000187820 [0,1,0,0,0,1|2,0,0]=4 5381 B13R1.511 NC(=O)COc1ccc(c(c1)N)Cl 34a_100011934297_100000187820 [0,1,0,0,0,1|2,0,0]=4 5382 B13R1.511 NC(=O)COc1ccc(c(c1)N)F 34a_100012017239_100000187820 [0,1,0,0,0,1|2,0,0]=4 5383 B13R1.511 NC(=O)COc1ccc(c(c1)N)F 7a_100012017239_100000187820 [0,1,0,0,0,1|2,0,0]=4 5384 B13R1.511 NC(=O)COc1ccc(c(c1)N)N 34a_100025771000_100000187820 [0,1,0,0,0,1|2,0,0]=4 5385 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Br 62a_100000747473_100012356990 [0,1,0,0,0,1|1,1,0]=4 5386 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000747473 [0,1,0,0,0,1|1,1,0]=4 5387 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Cl 62a_100000747473_100011356854 [0,1,0,0,0,1|1,1,0]=4 5388 B13R1.511 NC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000747473 [0,1,0,0,0,1|1,1,0]=4 5389 B13R1.511 NC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000747473 [0,1,0,0,0,1|1,1,0]=4 5390 B13R1.511 NC(=O)CSc1ccc(c(c1)O)F 62a_100000747473_100000686035 [0,1,0,0,0,1|1,1,0]=4 5391 B13R1.511 NC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000747473 [0,1,0,0,0,1|1,1,0]=4 5392 B13R1.511 NC(=O)CSc1ccc(c(c1)O)N 62a_100000747473_100000739049 [0,1,0,0,0,1|1,1,0]=4 5393 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [0,1,0,0,0,1|1,1,0]=4 5394 B13R1.511 Nc1cc(ccc1Br)OCC(=O)[O-] 34a_100011999798_100020667443 [0,1,0,0,0,1|2,0,0]=4 5395 B13R1.511 Nc1cc(ccc1Cl)OCC(=O)[O-] 34a_100011934297_100020667443 [0,1,0,0,0,1|2,0,0]=4 5396 B13R1.511 Nc1cc(ccc1F)OCC(=O)[O-] 34a_100012017239_100020667443 [0,1,0,0,0,1|2,0,0]=4 5397 B13R1.511 Nc1ccc(cc1Br)OCC(=O)[O-] 34a_100012001276_100020667443 [0,1,0,0,0,1|2,0,0]=4 5398 B13R1.511 Nc1ccc(cc1Cl)OCC(=O)[O-] 34a_100011215599_100020667443 [0,1,0,0,0,1|2,0,0]=4 5399 B13R1.511 Nc1ccc(cc1F)OCC(=O)[O-] 34a_100000759473_100020667443 [0,1,0,0,0,1|2,0,0]=4 5400 B13R1.511 Nc1ccc(cc1I)OCC(=O)[O-] 34a_100010084370_100020667443 [0,1,0,0,0,1|2,0,0]=4 5401 B13R1.511 Nc1ccc(cc1N)OCC(=O)[O-] 34a_100025771000_100020667443 [0,1,0,0,0,1|2,0,0]=4 5402 B13R1.511 Nc1ccc(cc1O)SCC(=O)[O-] 62a_100000739049_100020667443 [0,1,0,0,0,1|1,1,0]=4 5403 B13R1.511 Nc1ccc(cc1O)SCC(=O)[O-] 62a_100020667443_100000739049 [0,1,0,0,0,1|1,1,0]=4 5404 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)Cl 34a_100011934209_100020667443 [0,1,0,0,0,1|2,0,0]=4 5405 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)F 34a_100012017398_100020667443 [0,1,0,0,0,1|2,0,0]=4 5406 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100020667443 [0,1,0,0,0,1|2,0,0]=4 5407 B13R1.511 O=C([O-])COc1ccc(c(c1)Br)Cl 34a_100011933957_100020667443 [0,1,0,0,0,1|2,0,0]=4 5408 B13R1.511 O=C([O-])COc1ccc(c(c1)Br)F 34a_100000693481_100020667443 [0,1,0,0,0,1|2,0,0]=4 5409 B13R1.511 O=C([O-])COc1ccc(c(c1)Br)I 34a_100000701344_100020667443 [0,1,0,0,0,1|2,0,0]=4 5410 B13R1.511 O=C([O-])COc1ccc(c(c1)Cl)Br 34a_100011215161_100020667443 [0,1,0,0,0,1|2,0,0]=4 5411 B13R1.511 O=C([O-])COc1ccc(c(c1)Cl)Cl 34a_100000211054_100020667443 [0,1,0,0,0,1|2,0,0]=4 5412 B13R1.511 O=C([O-])COc1ccc(c(c1)Cl)F 34a_100000211030_100020667443 [0,1,0,0,0,1|2,0,0]=4 5413 B13R1.511 O=C([O-])COc1ccc(c(c1)Cl)I 34a_100000047559_100020667443 [0,1,0,0,0,1|2,0,0]=4 5414 B13R1.511 O=C([O-])COc1ccc(c(c1)F)Br 34a_100000755031_100020667443 [0,1,0,0,0,1|2,0,0]=4 5415 B13R1.511 O=C([O-])COc1ccc(c(c1)F)Cl 34a_100000691581_100020667443 [0,1,0,0,0,1|2,0,0]=4 5416 B13R1.511 O=C([O-])COc1ccc(c(c1)F)F 34a_100000181275_100020667443 [0,1,0,0,0,1|2,0,0]=4 5417 B13R1.511 O=C([O-])COc1ccc(c(c1)F)I 34a_100009990212_100020667443 [0,1,0,0,0,1|2,0,0]=4 5418 B13R1.511 O=C([O-])COc1ccc(c(c1)I)Br 34a_100012339312_100020667443 [0,1,0,0,0,1|2,0,0]=4 5419 B13R1.511 O=C([O-])COc1ccc(c(c1)I)Cl 34a_100000049588_100020667443 [0,1,0,0,0,1|2,0,0]=4 5420 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Br 62a_100012356990_100020667443 [0,1,0,0,0,1|1,1,0]=4 5421 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Br 62a_100020667443_100012356990 [0,1,0,0,0,1|1,1,0]=4 5422 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Cl 62a_100011356854_100020667443 [0,1,0,0,0,1|1,1,0]=4 5423 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)Cl 62a_100020667443_100011356854 [0,1,0,0,0,1|1,1,0]=4 5424 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)F 62a_100000686035_100020667443 [0,1,0,0,0,1|1,1,0]=4 5425 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)F 62a_100020667443_100000686035 [0,1,0,0,0,1|1,1,0]=4 5426 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)O 62a_100020667443_100009813601 [0,1,0,0,0,1|1,1,0]=4 5427 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)Cl 1458a_100102889548_200025704644 [0,1,0,0,0,1|2,0,0]=4 5428 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)F 1458a_100011195070_200025704644 [0,1,0,0,0,1|2,0,0]=4 5429 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Br)O 1458a_200103079279_200025704644 [0,1,0,0,0,1|2,0,0]=4 5430 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)Cl 1458a_100000716972_200025704644 [0,1,0,0,0,1|2,0,0]=4 5431 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)F 1458a_100102525453_200025704644 [0,1,0,0,0,1|2,0,0]=4 5432 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)Cl)O 1458a_200103117615_200025704644 [0,1,0,0,0,1|2,0,0]=4 5433 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)F)Br 1458a_100102601611_200025704644 [0,1,0,0,0,1|2,0,0]=4 5434 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)F)Cl 1458a_100020610926_200025704644 [0,1,0,0,0,1|2,0,0]=4 5435 B13R1.511 [13CH3]C(=O)C=Cc1ccc(c(c1)F)F 1458a_100011195075_200025704644 [0,1,0,0,0,1|2,0,0]=4 5436 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200025704644 [0,1,0,0,0,1|2,0,0]=4 5437 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200025704644 [0,1,0,0,0,1|2,0,0]=4 5438 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200025704644 [0,1,0,0,0,1|2,0,0]=4 5439 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200025704644 [0,1,0,0,0,1|2,0,0]=4 5440 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200025704644 [0,1,0,0,0,1|2,0,0]=4 5441 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200025704644 [0,1,0,0,0,1|2,0,0]=4 5442 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200025704644 [0,1,0,0,0,1|2,0,0]=4 5443 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [0,1,0,0,0,1|1,0,0]=3 5444 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)Cl)Cl 1458a_100000191221_200025704644 [0,1,0,0,0,1|1,0,0]=3 5445 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)Cl)F 1458a_100000191248_200025704644 [0,1,0,0,0,1|1,0,0]=3 5446 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)F)Cl 1458a_100012982646_200025704644 [0,1,0,0,0,1|1,0,0]=3 5447 B13R1.511 [13CH3]C(=O)COc1ccc(c(c1)F)F 1458a_100000246063_200025704644 [0,1,0,0,0,1|1,0,0]=3 5448 B13R1.511 [13CH3]C(=O)CSc1ccc(c(c1)F)F 1458a_100000204393_200025704644 [0,1,0,0,0,1|1,1,0]=4 5449 B13R1.643 C#Cc1cccc(c1)OCC(=C)C 34a_100011216014_100000748629 [0,1,0,0,0,1|2,0,0]=4 5450 B13R1.643 C#Cc1cccc(c1)OCC(=C)C 7a_100011216014_100000748629 [0,1,0,0,0,1|2,0,0]=4 5451 B13R1.643 C#Cc1cccc(c1)OCC(=O)N 34a_100011216014_100000187820 [0,1,0,0,0,1|2,0,0]=4 5452 B13R1.643 C#Cc1cccc(c1)OCC(=O)N 7a_100011216014_100000187820 [0,1,0,0,0,1|2,0,0]=4 5453 B13R1.643 C#Cc1cccc(c1)OCC(=O)[O-] 34a_100011216014_100020667443 [0,1,0,0,0,1|2,0,0]=4 5454 B13R1.643 C=C(C)CNc1cccc(c1)CO 2230a_100000211919_100000748629 [0,1,0,0,0,1|2,0,0]=4 5455 B13R1.643 C=C(C)CNc1cccc(c1)CO 34a_100000211919_100000748629 [0,1,0,0,0,1|2,0,0]=4 5456 B13R1.643 C=C(C)CNc1cccc(c1)OC 34a_100000210024_100000748629 [0,1,0,0,0,1|2,0,0]=4 5457 B13R1.643 C=C(C)COc1cccc(c1)C#N 34a_100000184713_100000748629 [0,1,0,0,0,1|2,0,0]=4 5458 B13R1.643 C=C(C)COc1cccc(c1)C#N 7a_100000184713_100000748629 [0,1,0,0,0,1|2,0,0]=4 5459 B13R1.643 C=C(C)COc1cccc(c1)CBr 34a_100011660834_100000748629 [0,1,0,0,0,1|2,0,0]=4 5460 B13R1.643 C=C(C)COc1cccc(c1)CBr 7a_100011660834_100000748629 [0,1,0,0,0,1|2,0,0]=4 5461 B13R1.643 C=C(C)COc1cccc(c1)CC 34a_100000211550_100000748629 [0,1,0,0,0,1|2,0,0]=4 5462 B13R1.643 C=C(C)COc1cccc(c1)CC 7a_100000211550_100000748629 [0,1,0,0,0,1|2,0,0]=4 5463 B13R1.643 C=C(C)COc1cccc(c1)CCl 34a_100000084143_100000748629 [0,1,0,0,0,1|2,0,0]=4 5464 B13R1.643 C=C(C)COc1cccc(c1)CCl 7a_100000084143_100000748629 [0,1,0,0,0,1|2,0,0]=4 5465 B13R1.643 C=C(C)COc1cccc(c1)CN 34a_100000743036_100000748629 [0,1,0,0,0,1|2,0,0]=4 5466 B13R1.643 C=C(C)COc1cccc(c1)CO 34a_100011214949_100000748629 [0,1,0,0,0,1|1,0,0]=3 5467 B13R1.643 C=C(C)COc1cccc(c1)CO 7a_100011214949_100000748629 [0,1,0,0,0,1|1,0,0]=3 5468 B13R1.643 C=C(C)COc1cccc(c1)NC 2230a_100000243820_200000210301 [0,1,0,0,0,1|2,0,0]=4 5469 B13R1.643 C=C(C)COc1cccc(c1)NC 34a_100000243820_200000210301 [0,1,0,0,0,1|2,0,0]=4 5470 B13R1.643 C=C(C)COc1cccc(c1)NC 34a_100000756613_100000748629 [0,1,0,0,0,1|2,0,0]=4 5471 B13R1.643 C=C(C)COc1cccc(c1)NC 7a_100000243820_200000210301 [0,1,0,0,0,1|2,0,0]=4 5472 B13R1.643 C=C(C)COc1cccc(c1)NC 7a_100000756613_100000748629 [0,1,0,0,0,1|2,0,0]=4 5473 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 2230a_100000243820_200025704644 [0,1,0,0,0,1|2,0,0]=4 5474 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 34a_100000243820_200025704644 [0,1,0,0,0,1|2,0,0]=4 5475 B13R1.643 C=C(C)COc1cccc(c1)N[13CH3] 7a_100000243820_200025704644 [0,1,0,0,0,1|2,0,0]=4 5476 B13R1.643 C=C(C)COc1cccc(c1)OC 34a_100000211255_100000748629 [0,1,0,0,0,1|1,0,0]=3 5477 B13R1.643 C=C(C)COc1cccc(c1)OC 7a_100000211255_100000748629 [0,1,0,0,0,1|1,0,0]=3 5478 B13R1.643 C=C(C)COc1cccc(c1)SC 34a_100011265683_100000748629 [0,1,0,0,0,1|1,1,0]=4 5479 B13R1.643 C=C(C)COc1cccc(c1)SC 7a_100011265683_100000748629 [0,1,0,0,0,1|1,1,0]=4 5480 B13R1.643 C=C(C)COc1ccnc(c1)OC 34a_100012181050_100000748629 [0,1,0,0,0,1|2,0,0]=4 5481 B13R1.643 C=C(C)COc1cncc(c1)OC 34a_100000084572_100000748629 [0,1,0,0,0,1|2,0,0]=4 5482 B13R1.643 C=C(C)COc1cncc(c1)OC 7a_100000084572_100000748629 [0,1,0,0,0,1|2,0,0]=4 5483 B13R1.643 C=C(C)CSc1cccc(c1)CO 62a_100000687537_100000211660 [0,1,0,0,0,1|1,1,0]=4 5484 B13R1.643 C=C(C)CSc1cccc(c1)CO 62a_100000748629_100000687537 [0,1,0,0,0,1|1,1,0]=4 5485 B13R1.643 C=C(C)CSc1cccc(c1)OC 62a_100000748629_100000170001 [0,1,0,0,0,1|1,1,0]=4 5486 B13R1.643 C=C(F)COc1cccc(c1)CO 34a_100011214949_100009893438 [0,1,0,0,0,1|1,0,1]=4 5487 B13R1.643 C=C(F)COc1cccc(c1)CO 7a_100011214949_100000042424 [0,1,0,0,0,1|1,0,1]=4 5488 B13R1.643 C=C(F)COc1cccc(c1)OC 34a_100000211255_100009893438 [0,1,0,0,0,1|1,0,1]=4 5489 B13R1.643 C=C(F)COc1cccc(c1)OC 7a_100000211255_100000042424 [0,1,0,0,0,1|1,0,1]=4 5490 B13R1.643 C=Cc1cccc(c1)/C=C/C(=O)C 271570a_100011290941_200016266566 [0,1,0,0,0,1|2,0,0]=4 5491 B13R1.643 C=Cc1cccc(c1)CCC(=O)C 271570a_100011290941_100011279149 [0,1,0,0,0,1|2,0,0]=4 5492 B13R1.643 C=Cc1cccc(c1)CNC(=O)C 271570a_100011290941_100000766983 [0,1,0,0,0,1|2,0,0]=4 5493 B13R1.643 C=Cc1cccc(c1)OCC(=C)C 34a_100011309434_100000748629 [0,1,0,0,0,1|2,0,0]=4 5494 B13R1.643 C=Cc1cccc(c1)OCC(=C)C 7a_100011309434_100000748629 [0,1,0,0,0,1|2,0,0]=4 5495 B13R1.643 C=Cc1cccc(c1)OCC(=O)N 271570a_100011290941_200000150604 [0,1,0,0,0,1|2,0,0]=4 5496 B13R1.643 C=Cc1cccc(c1)OCC(=O)N 34a_100011309434_100000187820 [0,1,0,0,0,1|2,0,0]=4 5497 B13R1.643 C=Cc1cccc(c1)OCC(=O)N 7a_100011309434_100000187820 [0,1,0,0,0,1|2,0,0]=4 5498 B13R1.643 C=Cc1cccc(c1)OCC(=O)[O-] 34a_100011309434_100020667443 [0,1,0,0,0,1|2,0,0]=4 5499 B13R1.643 CC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200016266566_200025704644 [0,1,0,0,0,1|1,1,0]=4 5500 B13R1.643 CC(=O)/C=C/c1cccc(c1)S[13CH3] 62a_200025704644_200016266566 [0,1,0,0,0,1|1,1,0]=4 5501 B13R1.643 CC(=O)C=Cc1cccc(c1)C#N 1458a_100000738773_200000210301 [0,1,0,0,0,1|2,0,0]=4 5502 B13R1.643 CC(=O)CCc1cccc(c1)C#N 1458a_100011998624_200000210301 [0,1,0,0,0,1|2,0,0]=4 5503 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_100011279149_200025704644 [0,1,0,0,0,1|1,1,0]=4 5504 B13R1.643 CC(=O)CCc1cccc(c1)S[13CH3] 62a_200025704644_100011279149 [0,1,0,0,0,1|1,1,0]=4 5505 B13R1.643 CC(=O)COc1cccc(c1)C#N 1458a_100000230692_200000210301 [0,1,0,0,0,1|1,0,0]=3 5506 B13R1.643 CC(=O)NCc1cccc(c1)C#N 11a_100000755147_100015343762 [0,1,0,0,0,1|2,0,0]=4 5507 B13R1.643 CC(=O)NCc1cccc(c1)C#N 1626a_100000755147_100015343762 [0,1,0,0,0,1|2,0,0]=4 5508 B13R1.643 CC(=O)NCc1cccc(c1)C#N 240690a_100000755147_100015343762 [0,1,0,0,0,1|2,0,0]=4 5509 B13R1.643 CC(=O)NCc1cccc(c1)C#N 527a_100000755147_100103153847 [0,1,0,0,0,1|2,0,0]=4 5510 B13R1.643 CC(=O)NCc1cccc(c1)CO 240690a_100011269909_100015343762 [0,1,0,0,0,1|1,0,0]=3 5511 B13R1.643 CC(=O)NCc1cccc(c1)CO 527a_100011269909_100103153847 [0,1,0,0,0,1|1,0,0]=3 5512 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_100000766983_200025704644 [0,1,0,0,0,1|1,1,0]=4 5513 B13R1.643 CC(=O)NCc1cccc(c1)S[13CH3] 62a_200025704644_100000766983 [0,1,0,0,0,1|1,1,0]=4 5514 B13R1.643 CC(=O)NCc1ccnc(c1)CO 240690a_100020589248_100015343762 [0,1,0,0,0,1|2,0,0]=4 5515 B13R1.643 CC(=O)NCc1ccnc(c1)CO 527a_100020589248_100103153847 [0,1,0,0,0,1|2,0,0]=4 5516 B13R1.643 CC(=O)NNc1cccc(c1)C#N 22a_100016987777_100000070787 [0,1,0,0,0,1|2,0,0]=4 5517 B13R1.643 CC(C)COc1cccc(c1)CO 34a_100011214949_100000210624 [0,1,0,0,0,1|1,0,1]=4 5518 B13R1.643 CC(C)COc1cccc(c1)CO 7a_100011214949_100000210760 [0,1,0,0,0,1|1,0,1]=4 5519 B13R1.643 CC(C)OCc1cccc(c1)CO 34a_100000212225_100010188025 [0,1,0,0,0,1|1,0,1]=4 5520 B13R1.643 CC(O)COc1cccc(c1)CO 34a_100011214949_100011218427 [0,1,0,0,0,1|0,0,2]=4 5521 B13R1.643 CC(O)COc1cccc(c1)CO 7a_100011214949_100011218427 [0,1,0,0,0,1|0,0,2]=4 5522 B13R1.643 CCc1cccc(c1)OCC(=O)N 34a_100000211550_100000187820 [0,1,0,0,0,1|2,0,0]=4 5523 B13R1.643 CCc1cccc(c1)OCC(=O)N 7a_100000211550_100000187820 [0,1,0,0,0,1|2,0,0]=4 5524 B13R1.643 CCc1cccc(c1)OCC(=O)[O-] 34a_100000211550_100020667443 [0,1,0,0,0,1|2,0,0]=4 5525 B13R1.643 CNc1cccc(c1)OCC(=O)N 34a_100000756613_100000187820 [0,1,0,0,0,1|2,0,0]=4 5526 B13R1.643 CNc1cccc(c1)OCC(=O)N 7a_100000756613_100000187820 [0,1,0,0,0,1|2,0,0]=4 5527 B13R1.643 CNc1cccc(c1)OCC(=O)[O-] 34a_100000756613_100020667443 [0,1,0,0,0,1|2,0,0]=4 5528 B13R1.643 COc1cc(ccn1)CNC(=O)C 11a_100102525109_100015343762 [0,1,0,0,0,1|2,0,0]=4 5529 B13R1.643 COc1cc(ccn1)CNC(=O)C 1626a_100102525109_100015343762 [0,1,0,0,0,1|2,0,0]=4 5530 B13R1.643 COc1cc(ccn1)CNC(=O)C 240690a_100102525109_100015343762 [0,1,0,0,0,1|2,0,0]=4 5531 B13R1.643 COc1cc(ccn1)CNC(=O)C 527a_100102525109_100103153847 [0,1,0,0,0,1|2,0,0]=4 5532 B13R1.643 COc1cc(ccn1)OCC(=O)N 34a_100012181050_100000187820 [0,1,0,0,0,1|2,0,0]=4 5533 B13R1.643 COc1cc(ccn1)OCC(=O)[O-] 34a_100012181050_100020667443 [0,1,0,0,0,1|2,0,0]=4 5534 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000070787_100011713679 [0,1,0,0,0,1|1,0,0]=3 5535 B13R1.643 COc1cccc(c1)CCC(=O)C 1458a_100000234931_200000210301 [0,1,0,0,0,1|1,0,0]=3 5536 B13R1.643 COc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234931_200025704644 [0,1,0,0,0,1|1,0,0]=3 5537 B13R1.643 COc1cccc(c1)CNC(=O)C 11a_100000174954_100015343762 [0,1,0,0,0,1|1,0,0]=3 5538 B13R1.643 COc1cccc(c1)CNC(=O)C 1626a_100000174954_100015343762 [0,1,0,0,0,1|1,0,0]=3 5539 B13R1.643 COc1cccc(c1)CNC(=O)C 240690a_100000174954_100015343762 [0,1,0,0,0,1|1,0,0]=3 5540 B13R1.643 COc1cccc(c1)CNC(=O)C 527a_100000174954_100103153847 [0,1,0,0,0,1|1,0,0]=3 5541 B13R1.643 COc1cccc(c1)COC(C)C 34a_100000198976_100000210206 [0,1,0,0,0,1|1,0,1]=4 5542 B13R1.643 COc1cccc(c1)COC(C)C 34a_100000212225_100000688526 [0,1,0,0,0,1|1,0,1]=4 5543 B13R1.643 COc1cccc(c1)NCC(=O)N 34a_100000210024_100000187820 [0,1,0,0,0,1|2,0,0]=4 5544 B13R1.643 COc1cccc(c1)NCC(=O)[O-] 34a_100000210024_100020667443 [0,1,0,0,0,1|2,0,0]=4 5545 B13R1.643 COc1cccc(c1)NNC(=O)C 22a_100000722927_100000070787 [0,1,0,0,0,1|1,0,0]=3 5546 B13R1.643 COc1cccc(c1)OCC(=O)C 1458a_100000182123_200000210301 [0,1,0,0,0,1|0,0,0]=2 5547 B13R1.643 COc1cccc(c1)OCC(=O)N 34a_100000211255_100000187820 [0,1,0,0,0,1|1,0,0]=3 5548 B13R1.643 COc1cccc(c1)OCC(=O)N 7a_100000211255_100000187820 [0,1,0,0,0,1|1,0,0]=3 5549 B13R1.643 COc1cccc(c1)OCC(=O)[13CH3] 1458a_100000182123_200025704644 [0,1,0,0,0,1|0,0,0]=2 5550 B13R1.643 COc1cccc(c1)OCC(=O)[O-] 34a_100000211255_100020667443 [0,1,0,0,0,1|1,0,0]=3 5551 B13R1.643 COc1cccc(c1)OCC(C)C 34a_100000211255_100000210624 [0,1,0,0,0,1|1,0,1]=4 5552 B13R1.643 COc1cccc(c1)OCC(C)C 7a_100000211255_100000210760 [0,1,0,0,0,1|1,0,1]=4 5553 B13R1.643 COc1cccc(c1)OCC(C)O 34a_100000211255_100011218427 [0,1,0,0,0,1|0,0,2]=4 5554 B13R1.643 COc1cccc(c1)OCC(C)O 7a_100000211255_100011218427 [0,1,0,0,0,1|0,0,2]=4 5555 B13R1.643 COc1cccc(c1)OC[C@@H](C)O 34a_100000211255_100009817552 [0,1,0,0,0,1|0,0,2]=4 5556 B13R1.643 COc1cccc(c1)OC[C@@H](C)O 7a_100000211255_100009817552 [0,1,0,0,0,1|0,0,2]=4 5557 B13R1.643 COc1cccc(c1)OC[N+](=O)[O-] 34a_100000211255_100000761209 [0,1,0,0,0,1|2,0,0]=4 5558 B13R1.643 COc1cccc(c1)SCC(=O)C 1458a_100000741315_200000210301 [0,1,0,0,0,1|0,1,0]=3 5559 B13R1.643 COc1cccc(c1)SCC(=O)N 62a_100000747473_100000170001 [0,1,0,0,0,1|1,1,0]=4 5560 B13R1.643 COc1cccc(c1)SCC(=O)[13CH3] 1458a_100000741315_200025704644 [0,1,0,0,0,1|0,1,0]=3 5561 B13R1.643 COc1cccc(c1)SCC(=O)[O-] 62a_100020667443_100000170001 [0,1,0,0,0,1|1,1,0]=4 5562 B13R1.643 COc1cccc(n1)CNC(=O)C 11a_100000746380_100015343762 [0,1,0,0,0,1|2,0,0]=4 5563 B13R1.643 COc1cccc(n1)CNC(=O)C 1626a_100000746380_100015343762 [0,1,0,0,0,1|2,0,0]=4 5564 B13R1.643 COc1cccc(n1)CNC(=O)C 240690a_100000746380_100015343762 [0,1,0,0,0,1|2,0,0]=4 5565 B13R1.643 COc1cccc(n1)CNC(=O)C 527a_100000746380_100103153847 [0,1,0,0,0,1|2,0,0]=4 5566 B13R1.643 COc1cccc(n1)NNC(=O)C 22a_100000698482_100000070787 [0,1,0,0,0,1|2,0,0]=4 5567 B13R1.643 COc1ccnc(c1)CNC(=O)C 11a_100000706253_100015343762 [0,1,0,0,0,1|2,0,0]=4 5568 B13R1.643 COc1ccnc(c1)CNC(=O)C 1626a_100000706253_100015343762 [0,1,0,0,0,1|2,0,0]=4 5569 B13R1.643 COc1ccnc(c1)CNC(=O)C 240690a_100000706253_100015343762 [0,1,0,0,0,1|2,0,0]=4 5570 B13R1.643 COc1ccnc(c1)CNC(=O)C 527a_100000706253_100103153847 [0,1,0,0,0,1|2,0,0]=4 5571 B13R1.643 COc1cncc(c1)CNC(=O)C 11a_100020589029_100015343762 [0,1,0,0,0,1|2,0,0]=4 5572 B13R1.643 COc1cncc(c1)CNC(=O)C 240690a_100020589029_100015343762 [0,1,0,0,0,1|2,0,0]=4 5573 B13R1.643 COc1cncc(c1)CNC(=O)C 527a_100020589029_100103153847 [0,1,0,0,0,1|2,0,0]=4 5574 B13R1.643 COc1cncc(c1)OCC(=O)N 34a_100000084572_100000187820 [0,1,0,0,0,1|2,0,0]=4 5575 B13R1.643 COc1cncc(c1)OCC(=O)N 7a_100000084572_100000187820 [0,1,0,0,0,1|2,0,0]=4 5576 B13R1.643 COc1cncc(c1)OCC(=O)[O-] 34a_100000084572_100020667443 [0,1,0,0,0,1|2,0,0]=4 5577 B13R1.643 CSc1cccc(c1)/C=C/C(=O)C 62a_200000210301_200016266566 [0,1,0,0,0,1|1,1,0]=4 5578 B13R1.643 CSc1cccc(c1)/C=C/C(=O)C 62a_200016266566_200000210301 [0,1,0,0,0,1|1,1,0]=4 5579 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_100011279149_200000210301 [0,1,0,0,0,1|1,1,0]=4 5580 B13R1.643 CSc1cccc(c1)CCC(=O)C 62a_200000210301_100011279149 [0,1,0,0,0,1|1,1,0]=4 5581 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_100000766983_200000210301 [0,1,0,0,0,1|1,1,0]=4 5582 B13R1.643 CSc1cccc(c1)CNC(=O)C 62a_200000210301_100000766983 [0,1,0,0,0,1|1,1,0]=4 5583 B13R1.643 CSc1cccc(c1)OCC(=O)N 34a_100011265683_100000187820 [0,1,0,0,0,1|1,1,0]=4 5584 B13R1.643 CSc1cccc(c1)OCC(=O)N 62a_200000150604_200000210301 [0,1,0,0,0,1|1,1,0]=4 5585 B13R1.643 CSc1cccc(c1)OCC(=O)N 62a_200000210301_200000150604 [0,1,0,0,0,1|1,1,0]=4 5586 B13R1.643 CSc1cccc(c1)OCC(=O)N 7a_100011265683_100000187820 [0,1,0,0,0,1|1,1,0]=4 5587 B13R1.643 CSc1cccc(c1)OCC(=O)[O-] 34a_100011265683_100020667443 [0,1,0,0,0,1|1,1,0]=4 5588 B13R1.643 C[C@@H](O)COc1cccc(c1)CO 34a_100011214949_100009817552 [0,1,0,0,0,1|0,0,2]=4 5589 B13R1.643 C[C@@H](O)COc1cccc(c1)CO 7a_100011214949_100009817552 [0,1,0,0,0,1|0,0,2]=4 5590 B13R1.643 N#Cc1cccc(c1)OCC(=O)N 34a_100000184713_100000187820 [0,1,0,0,0,1|2,0,0]=4 5591 B13R1.643 N#Cc1cccc(c1)OCC(=O)N 7a_100000184713_100000187820 [0,1,0,0,0,1|2,0,0]=4 5592 B13R1.643 N#Cc1cccc(c1)OCC(=O)[O-] 34a_100000184713_100020667443 [0,1,0,0,0,1|2,0,0]=4 5593 B13R1.643 NC(=O)CNc1cccc(c1)CO 2230a_100000211919_100000747473 [0,1,0,0,0,1|2,0,0]=4 5594 B13R1.643 NC(=O)CNc1cccc(c1)CO 34a_100000211919_100000187820 [0,1,0,0,0,1|2,0,0]=4 5595 B13R1.643 NC(=O)COc1cccc(c1)CBr 34a_100011660834_100000187820 [0,1,0,0,0,1|2,0,0]=4 5596 B13R1.643 NC(=O)COc1cccc(c1)CBr 7a_100011660834_100000187820 [0,1,0,0,0,1|2,0,0]=4 5597 B13R1.643 NC(=O)COc1cccc(c1)CCl 34a_100000084143_100000187820 [0,1,0,0,0,1|2,0,0]=4 5598 B13R1.643 NC(=O)COc1cccc(c1)CCl 7a_100000084143_100000187820 [0,1,0,0,0,1|2,0,0]=4 5599 B13R1.643 NC(=O)COc1cccc(c1)CO 34a_100011214949_100000187820 [0,1,0,0,0,1|1,0,0]=3 5600 B13R1.643 NC(=O)COc1cccc(c1)CO 7a_100011214949_100000187820 [0,1,0,0,0,1|1,0,0]=3 5601 B13R1.643 NC(=O)CSc1cccc(c1)CO 62a_100000687537_100000747473 [0,1,0,0,0,1|1,1,0]=4 5602 B13R1.643 NC(=O)CSc1cccc(c1)CO 62a_100000747473_100000687537 [0,1,0,0,0,1|1,1,0]=4 5603 B13R1.643 NCc1cccc(c1)OCC(=O)N 34a_100000743036_100000187820 [0,1,0,0,0,1|2,0,0]=4 5604 B13R1.643 NCc1cccc(c1)OCC(=O)[O-] 34a_100000743036_100020667443 [0,1,0,0,0,1|2,0,0]=4 5605 B13R1.643 O=C([O-])CNc1cccc(c1)CO 34a_100000211919_100020667443 [0,1,0,0,0,1|2,0,0]=4 5606 B13R1.643 O=C([O-])COc1cccc(c1)CBr 34a_100011660834_100020667443 [0,1,0,0,0,1|2,0,0]=4 5607 B13R1.643 O=C([O-])COc1cccc(c1)CCl 34a_100000084143_100020667443 [0,1,0,0,0,1|2,0,0]=4 5608 B13R1.643 O=C([O-])COc1cccc(c1)CO 34a_100011214949_100020667443 [0,1,0,0,0,1|1,0,0]=3 5609 B13R1.643 O=C([O-])CSc1cccc(c1)CO 62a_100000687537_100020667443 [0,1,0,0,0,1|1,1,0]=4 5610 B13R1.643 O=C([O-])CSc1cccc(c1)CO 62a_100020667443_100000687537 [0,1,0,0,0,1|1,1,0]=4 5611 B13R1.643 O=[N+]([O-])COc1cccc(c1)CO 34a_100011214949_100000761209 [0,1,0,0,0,1|2,0,0]=4 5612 B13R1.643 [13CH3]C(=O)C=Cc1cccc(c1)C#N 1458a_100000738773_200025704644 [0,1,0,0,0,1|2,0,0]=4 5613 B13R1.643 [13CH3]C(=O)CCc1cccc(c1)C#N 1458a_100011998624_200025704644 [0,1,0,0,0,1|2,0,0]=4 5614 B13R1.643 [13CH3]C(=O)COc1cccc(c1)C#N 1458a_100000230692_200025704644 [0,1,0,0,0,1|1,0,0]=3 5615 B13R1.643 [13CH3]Sc1cccc(c1)OCC(=O)N 62a_200000150604_200025704644 [0,1,0,0,0,1|1,1,0]=4 5616 B13R1.643 [13CH3]Sc1cccc(c1)OCC(=O)N 62a_200025704644_200000150604 [0,1,0,0,0,1|1,1,0]=4 5617 B13R1.838 CC(C)(C)COc1cccc(c1)O 271570a_203496583355_200010229345 [0,1,0,0,0,1|1,0,1]=4 5618 B13R1.838 CC(C)(C)OCc1cccc(c1)O 34a_100015890283_100011660834 [0,1,0,0,0,1|1,0,1]=4 5619 B13R1.838 CC(C)(C)OCc1cccc(c1)O 7a_100015890283_100000084143 [0,1,0,0,0,1|1,0,1]=4 5620 B13R1.838 CS(=O)(=O)NCc1cccc(c1)O 40a_100000743036_100000738038 [0,1,0,0,0,1|2,0,0]=4 5621 B13R1.893 C=C(C)CNc1cc(ccc1Br)O 34a_100011999798_100000748629 [0,1,0,0,0,1|2,0,0]=4 5622 B13R1.893 C=C(C)CNc1cc(ccc1C)O 34a_100011216113_100000748629 [0,1,0,0,0,1|2,0,0]=4 5623 B13R1.893 C=C(C)CNc1cc(ccc1Cl)O 34a_100011934297_100000748629 [0,1,0,0,0,1|2,0,0]=4 5624 B13R1.893 C=C(C)CNc1cc(ccc1F)O 34a_100012017239_100000748629 [0,1,0,0,0,1|2,0,0]=4 5625 B13R1.893 C=C(C)COc1cc(ccc1Br)Br 34a_100011220040_100000748629 [0,1,0,0,0,1|2,0,0]=4 5626 B13R1.893 C=C(C)COc1cc(ccc1Br)Br 7a_100011220040_100000748629 [0,1,0,0,0,1|2,0,0]=4 5627 B13R1.893 C=C(C)COc1cc(ccc1Br)C 34a_100012002257_100000748629 [0,1,0,0,0,1|2,0,0]=4 5628 B13R1.893 C=C(C)COc1cc(ccc1Br)C 7a_100012002257_100000748629 [0,1,0,0,0,1|2,0,0]=4 5629 B13R1.893 C=C(C)COc1cc(ccc1Br)Cl 34a_100012339455_100000748629 [0,1,0,0,0,1|2,0,0]=4 5630 B13R1.893 C=C(C)COc1cc(ccc1Br)Cl 7a_100012339455_100000748629 [0,1,0,0,0,1|2,0,0]=4 5631 B13R1.893 C=C(C)COc1cc(ccc1Br)F 34a_100000690578_100000748629 [0,1,0,0,0,1|2,0,0]=4 5632 B13R1.893 C=C(C)COc1cc(ccc1Br)F 7a_100000690578_100000748629 [0,1,0,0,0,1|2,0,0]=4 5633 B13R1.893 C=C(C)COc1cc(ccc1Br)I 34a_100012356990_100000748629 [0,1,0,0,0,1|2,0,0]=4 5634 B13R1.893 C=C(C)COc1cc(ccc1Br)I 7a_100012356990_100000748629 [0,1,0,0,0,1|2,0,0]=4 5635 B13R1.893 C=C(C)COc1cc(ccc1C)Br 34a_100000685420_100000748629 [0,1,0,0,0,1|2,0,0]=4 5636 B13R1.893 C=C(C)COc1cc(ccc1C)Br 7a_100000685420_100000748629 [0,1,0,0,0,1|2,0,0]=4 5637 B13R1.893 C=C(C)COc1cc(ccc1C)C 34a_100000210931_100000748629 [0,1,0,0,0,1|2,0,0]=4 5638 B13R1.893 C=C(C)COc1cc(ccc1C)C 7a_100000210931_100000748629 [0,1,0,0,0,1|2,0,0]=4 5639 B13R1.893 C=C(C)COc1cc(ccc1C)Cl 34a_100000756515_100000748629 [0,1,0,0,0,1|2,0,0]=4 5640 B13R1.893 C=C(C)COc1cc(ccc1C)Cl 7a_100000756515_100000748629 [0,1,0,0,0,1|2,0,0]=4 5641 B13R1.893 C=C(C)COc1cc(ccc1C)F 34a_100000690566_100000748629 [0,1,0,0,0,1|2,0,0]=4 5642 B13R1.893 C=C(C)COc1cc(ccc1C)F 7a_100000690566_100000748629 [0,1,0,0,0,1|2,0,0]=4 5643 B13R1.893 C=C(C)COc1cc(ccc1C)I 7a_100000766334_100000748629 [0,1,0,0,0,1|2,0,0]=4 5644 B13R1.893 C=C(C)COc1cc(ccc1C)N 34a_100000759471_100000748629 [0,1,0,0,0,1|2,0,0]=4 5645 B13R1.893 C=C(C)COc1cc(ccc1C)N 7a_100000759471_100000748629 [0,1,0,0,0,1|2,0,0]=4 5646 B13R1.893 C=C(C)COc1cc(ccc1Cl)Br 34a_100000738945_100000748629 [0,1,0,0,0,1|2,0,0]=4 5647 B13R1.893 C=C(C)COc1cc(ccc1Cl)Br 7a_100000738945_100000748629 [0,1,0,0,0,1|2,0,0]=4 5648 B13R1.893 C=C(C)COc1cc(ccc1Cl)C 34a_100000211493_100000748629 [0,1,0,0,0,1|2,0,0]=4 5649 B13R1.893 C=C(C)COc1cc(ccc1Cl)C 7a_100000211493_100000748629 [0,1,0,0,0,1|2,0,0]=4 5650 B13R1.893 C=C(C)COc1cc(ccc1Cl)Cl 34a_100000211422_100000748629 [0,1,0,0,0,1|2,0,0]=4 5651 B13R1.893 C=C(C)COc1cc(ccc1Cl)Cl 7a_100000211422_100000748629 [0,1,0,0,0,1|2,0,0]=4 5652 B13R1.893 C=C(C)COc1cc(ccc1Cl)F 34a_100000692107_100000748629 [0,1,0,0,0,1|2,0,0]=4 5653 B13R1.893 C=C(C)COc1cc(ccc1Cl)F 7a_100000692107_100000748629 [0,1,0,0,0,1|2,0,0]=4 5654 B13R1.893 C=C(C)COc1cc(ccc1Cl)I 34a_100011356854_100000748629 [0,1,0,0,0,1|2,0,0]=4 5655 B13R1.893 C=C(C)COc1cc(ccc1Cl)I 7a_100011356854_100000748629 [0,1,0,0,0,1|2,0,0]=4 5656 B13R1.893 C=C(C)COc1cc(ccc1Cl)N 34a_100011934209_100000748629 [0,1,0,0,0,1|2,0,0]=4 5657 B13R1.893 C=C(C)COc1cc(ccc1F)Br 34a_100000686035_100000748629 [0,1,0,0,0,1|2,0,0]=4 5658 B13R1.893 C=C(C)COc1cc(ccc1F)Br 7a_100000686035_100000748629 [0,1,0,0,0,1|2,0,0]=4 5659 B13R1.893 C=C(C)COc1cc(ccc1F)C 34a_100000759540_100000748629 [0,1,0,0,0,1|2,0,0]=4 5660 B13R1.893 C=C(C)COc1cc(ccc1F)C 7a_100000759540_100000748629 [0,1,0,0,0,1|2,0,0]=4 5661 B13R1.893 C=C(C)COc1cc(ccc1F)Cl 34a_100000757397_100000748629 [0,1,0,0,0,1|2,0,0]=4 5662 B13R1.893 C=C(C)COc1cc(ccc1F)Cl 7a_100000757397_100000748629 [0,1,0,0,0,1|2,0,0]=4 5663 B13R1.893 C=C(C)COc1cc(ccc1F)F 34a_100000752141_100000748629 [0,1,0,0,0,1|2,0,0]=4 5664 B13R1.893 C=C(C)COc1cc(ccc1F)F 7a_100000752141_100000748629 [0,1,0,0,0,1|2,0,0]=4 5665 B13R1.893 C=C(C)COc1cc(ccc1F)I 34a_100009958187_100000748629 [0,1,0,0,0,1|2,0,0]=4 5666 B13R1.893 C=C(C)COc1cc(ccc1F)I 7a_100009958187_100000748629 [0,1,0,0,0,1|2,0,0]=4 5667 B13R1.893 C=C(C)COc1cc(ccc1F)N 34a_100012017398_100000748629 [0,1,0,0,0,1|2,0,0]=4 5668 B13R1.893 C=C(C)COc1cc(ccc1F)N 7a_100012017398_100000748629 [0,1,0,0,0,1|2,0,0]=4 5669 B13R1.893 C=C(C)COc1cc(ccc1I)Br 34a_100012344904_100000748629 [0,1,0,0,0,1|2,0,0]=4 5670 B13R1.893 C=C(C)COc1cc(ccc1I)Br 7a_100012344904_100000748629 [0,1,0,0,0,1|2,0,0]=4 5671 B13R1.893 C=C(C)COc1cc(ccc1I)Cl 34a_100000050036_100000748629 [0,1,0,0,0,1|2,0,0]=4 5672 B13R1.893 C=C(C)COc1cc(ccc1I)Cl 7a_100000050036_100000748629 [0,1,0,0,0,1|2,0,0]=4 5673 B13R1.893 C=C(C)COc1cc(ccc1I)F 34a_100010084537_100000748629 [0,1,0,0,0,1|2,0,0]=4 5674 B13R1.893 C=C(C)COc1cc(ccc1I)F 7a_100010084537_100000748629 [0,1,0,0,0,1|2,0,0]=4 5675 B13R1.893 C=C(C)COc1cc(ccc1N)Br 34a_100000739049_100000748629 [0,1,0,0,0,1|2,0,0]=4 5676 B13R1.893 C=C(C)COc1cc(ccc1N)Br 7a_100000739049_100000748629 [0,1,0,0,0,1|2,0,0]=4 5677 B13R1.893 C=C(C)COc1cc(ccc1N)C 34a_100000211527_100000748629 [0,1,0,0,0,1|2,0,0]=4 5678 B13R1.893 C=C(C)COc1cc(ccc1N)C 7a_100000211527_100000748629 [0,1,0,0,0,1|2,0,0]=4 5679 B13R1.893 C=C(C)COc1cc(ccc1N)Cl 34a_100000185728_100000748629 [0,1,0,0,0,1|2,0,0]=4 5680 B13R1.893 C=C(C)COc1cc(ccc1N)Cl 7a_100000185728_100000748629 [0,1,0,0,0,1|2,0,0]=4 5681 B13R1.893 C=C(C)COc1cc(ccc1N)F 34a_100000753323_100000748629 [0,1,0,0,0,1|2,0,0]=4 5682 B13R1.893 C=C(C)COc1cc(ccc1N)F 7a_100000753323_100000748629 [0,1,0,0,0,1|2,0,0]=4 5683 B13R1.893 C=C(C)COc1cc(ccc1N)I 34a_100000057187_100000748629 [0,1,0,0,0,1|2,0,0]=4 5684 B13R1.893 C=C(C)COc1cc(ccc1N)I 7a_100000057187_100000748629 [0,1,0,0,0,1|2,0,0]=4 5685 B13R1.893 C=C(C)COc1cc(ccc1N)N 34a_100025717382_100000748629 [0,1,0,0,0,1|2,0,0]=4 5686 B13R1.893 C=C(C)CSc1cc(ccc1Br)O 62a_100000748629_100012339312 [0,1,0,0,0,1|1,1,0]=4 5687 B13R1.893 C=C(C)CSc1cc(ccc1Br)O 62a_100012339312_100000211660 [0,1,0,0,0,1|1,1,0]=4 5688 B13R1.893 C=C(C)CSc1cc(ccc1C)O 62a_100000748629_100011380479 [0,1,0,0,0,1|1,1,0]=4 5689 B13R1.893 C=C(C)CSc1cc(ccc1C)O 62a_100011380479_100000211660 [0,1,0,0,0,1|1,1,0]=4 5690 B13R1.893 C=C(C)CSc1cc(ccc1Cl)O 62a_100000049588_100000211660 [0,1,0,0,0,1|1,1,0]=4 5691 B13R1.893 C=C(C)CSc1cc(ccc1Cl)O 62a_100000748629_100000049588 [0,1,0,0,0,1|1,1,0]=4 5692 B13R1.893 C=C(C)CSc1cc(ccc1F)O 62a_100000693481_100000211660 [0,1,0,0,0,1|1,1,0]=4 5693 B13R1.893 C=C(C)CSc1cc(ccc1F)O 62a_100000748629_100000693481 [0,1,0,0,0,1|1,1,0]=4 5694 B13R1.893 C=C(C)CSc1cc(ccc1N)O 62a_100000748629_100012001276 [0,1,0,0,0,1|1,1,0]=4 5695 B13R1.893 C=C(C)CSc1cc(ccc1N)O 62a_100012001276_100000211660 [0,1,0,0,0,1|1,1,0]=4 5696 B13R1.893 C=C(C)CSc1cc(ccc1O)O 62a_100000748629_100009813629 [0,1,0,0,0,1|1,1,0]=4 5697 B13R1.893 CC(=O)C=Cc1cc(ccc1Br)F 1458a_100102525183_200000210301 [0,1,0,0,0,1|2,0,0]=4 5698 B13R1.893 CC(=O)C=Cc1cc(ccc1Cl)Cl 1458a_100000234794_200000210301 [0,1,0,0,0,1|2,0,0]=4 5699 B13R1.893 CC(=O)C=Cc1cc(ccc1F)Br 1458a_100000718207_200000210301 [0,1,0,0,0,1|2,0,0]=4 5700 B13R1.893 CC(=O)C=Cc1cc(ccc1F)C 1458a_100102526132_200000210301 [0,1,0,0,0,1|2,0,0]=4 5701 B13R1.893 CC(=O)C=Cc1cc(ccc1F)F 1458a_100000744626_200000210301 [0,1,0,0,0,1|2,0,0]=4 5702 B13R1.893 CC(=O)CCc1cc(ccc1Br)F 1458a_100000685340_200000210301 [0,1,0,0,0,1|2,0,0]=4 5703 B13R1.893 CC(=O)CCc1cc(ccc1C)C 1458a_100011485725_200000210301 [0,1,0,0,0,1|2,0,0]=4 5704 B13R1.893 CC(=O)CCc1cc(ccc1C)F 1458a_100011830270_200000210301 [0,1,0,0,0,1|2,0,0]=4 5705 B13R1.893 CC(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_200000210301 [0,1,0,0,0,1|2,0,0]=4 5706 B13R1.893 CC(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_200000210301 [0,1,0,0,0,1|2,0,0]=4 5707 B13R1.893 CC(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_200000210301 [0,1,0,0,0,1|2,0,0]=4 5708 B13R1.893 CC(=O)CCc1cc(ccc1F)Br 1458a_100000694007_200000210301 [0,1,0,0,0,1|2,0,0]=4 5709 B13R1.893 CC(=O)CCc1cc(ccc1F)C 1458a_100011934859_200000210301 [0,1,0,0,0,1|2,0,0]=4 5710 B13R1.893 CC(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_200000210301 [0,1,0,0,0,1|2,0,0]=4 5711 B13R1.893 CC(=O)CCc1cc(ccc1F)F 1458a_100000070787_100011755056 [0,1,0,0,0,1|2,0,0]=4 5712 B13R1.893 CC(=O)CCc1cc(ccc1F)F 1458a_100000744313_200000210301 [0,1,0,0,0,1|2,0,0]=4 5713 B13R1.893 CC(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_200000210301 [0,1,0,0,0,1|1,0,0]=3 5714 B13R1.893 CC(=O)COc1cc(ccc1C)C 1458a_100000182428_200000210301 [0,1,0,0,0,1|1,0,0]=3 5715 B13R1.893 CC(=O)COc1cc(ccc1Cl)C 1458a_100000183693_200000210301 [0,1,0,0,0,1|1,0,0]=3 5716 B13R1.893 CC(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_200000210301 [0,1,0,0,0,1|1,0,0]=3 5717 B13R1.893 CC(=O)COc1cc(ccc1F)F 1458a_100000752474_200000210301 [0,1,0,0,0,1|1,0,0]=3 5718 B13R1.893 CC(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_200000210301 [0,1,0,0,0,1|1,1,0]=4 5719 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 11a_100000707832_100015343762 [0,1,0,0,0,1|2,0,0]=4 5720 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 1626a_100000707832_100015343762 [0,1,0,0,0,1|2,0,0]=4 5721 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 240690a_100000707832_100015343762 [0,1,0,0,0,1|2,0,0]=4 5722 B13R1.893 CC(=O)NCc1cc(ccc1Br)Br 527a_100000707832_100103153847 [0,1,0,0,0,1|2,0,0]=4 5723 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 11a_100000742738_100015343762 [0,1,0,0,0,1|2,0,0]=4 5724 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 1626a_100000742738_100015343762 [0,1,0,0,0,1|2,0,0]=4 5725 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 240690a_100000742738_100015343762 [0,1,0,0,0,1|2,0,0]=4 5726 B13R1.893 CC(=O)NCc1cc(ccc1Br)F 527a_100000742738_100103153847 [0,1,0,0,0,1|2,0,0]=4 5727 B13R1.893 CC(=O)NCc1cc(ccc1C)C 11a_100000174964_100015343762 [0,1,0,0,0,1|2,0,0]=4 5728 B13R1.893 CC(=O)NCc1cc(ccc1C)C 1626a_100000174964_100015343762 [0,1,0,0,0,1|2,0,0]=4 5729 B13R1.893 CC(=O)NCc1cc(ccc1C)C 240690a_100000174964_100015343762 [0,1,0,0,0,1|2,0,0]=4 5730 B13R1.893 CC(=O)NCc1cc(ccc1C)C 527a_100000174964_100103153847 [0,1,0,0,0,1|2,0,0]=4 5731 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 11a_100000717755_100015343762 [0,1,0,0,0,1|2,0,0]=4 5732 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 1626a_100000717755_100015343762 [0,1,0,0,0,1|2,0,0]=4 5733 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 240690a_100000717755_100015343762 [0,1,0,0,0,1|2,0,0]=4 5734 B13R1.893 CC(=O)NCc1cc(ccc1C)Cl 527a_100000717755_100103153847 [0,1,0,0,0,1|2,0,0]=4 5735 B13R1.893 CC(=O)NCc1cc(ccc1C)F 11a_100011217291_100015343762 [0,1,0,0,0,1|2,0,0]=4 5736 B13R1.893 CC(=O)NCc1cc(ccc1C)F 1626a_100011217291_100015343762 [0,1,0,0,0,1|2,0,0]=4 5737 B13R1.893 CC(=O)NCc1cc(ccc1C)F 240690a_100011217291_100015343762 [0,1,0,0,0,1|2,0,0]=4 5738 B13R1.893 CC(=O)NCc1cc(ccc1C)F 527a_100011217291_100103153847 [0,1,0,0,0,1|2,0,0]=4 5739 B13R1.893 CC(=O)NCc1cc(ccc1C)O 240690a_200009844824_100015343762 [0,1,0,0,0,1|1,0,0]=3 5740 B13R1.893 CC(=O)NCc1cc(ccc1C)O 527a_200009844824_100103153847 [0,1,0,0,0,1|1,0,0]=3 5741 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 11a_100025772652_100015343762 [0,1,0,0,0,1|2,0,0]=4 5742 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 1626a_100025772652_100015343762 [0,1,0,0,0,1|2,0,0]=4 5743 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 240690a_100025772652_100015343762 [0,1,0,0,0,1|2,0,0]=4 5744 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Br 527a_100025772652_100103153847 [0,1,0,0,0,1|2,0,0]=4 5745 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 11a_100025705715_100015343762 [0,1,0,0,0,1|2,0,0]=4 5746 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 1626a_100025705715_100015343762 [0,1,0,0,0,1|2,0,0]=4 5747 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 240690a_100025705715_100015343762 [0,1,0,0,0,1|2,0,0]=4 5748 B13R1.893 CC(=O)NCc1cc(ccc1Cl)C 527a_100025705715_100103153847 [0,1,0,0,0,1|2,0,0]=4 5749 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 11a_100102946428_100015343762 [0,1,0,0,0,1|2,0,0]=4 5750 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 1626a_100102946428_100015343762 [0,1,0,0,0,1|2,0,0]=4 5751 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 240690a_100102946428_100015343762 [0,1,0,0,0,1|2,0,0]=4 5752 B13R1.893 CC(=O)NCc1cc(ccc1Cl)Cl 527a_100102946428_100103153847 [0,1,0,0,0,1|2,0,0]=4 5753 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 11a_100011830483_100015343762 [0,1,0,0,0,1|2,0,0]=4 5754 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 1626a_100011830483_100015343762 [0,1,0,0,0,1|2,0,0]=4 5755 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 240690a_100011830483_100015343762 [0,1,0,0,0,1|2,0,0]=4 5756 B13R1.893 CC(=O)NCc1cc(ccc1Cl)F 527a_100011830483_100103153847 [0,1,0,0,0,1|2,0,0]=4 5757 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 11a_100009815772_100015343762 [0,1,0,0,0,1|2,0,0]=4 5758 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 1626a_100009815772_100015343762 [0,1,0,0,0,1|2,0,0]=4 5759 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 240690a_100009815772_100015343762 [0,1,0,0,0,1|2,0,0]=4 5760 B13R1.893 CC(=O)NCc1cc(ccc1F)Br 527a_100009815772_100103153847 [0,1,0,0,0,1|2,0,0]=4 5761 B13R1.893 CC(=O)NCc1cc(ccc1F)C 11a_100102693586_100015343762 [0,1,0,0,0,1|2,0,0]=4 5762 B13R1.893 CC(=O)NCc1cc(ccc1F)C 1626a_100102693586_100015343762 [0,1,0,0,0,1|2,0,0]=4 5763 B13R1.893 CC(=O)NCc1cc(ccc1F)C 240690a_100102693586_100015343762 [0,1,0,0,0,1|2,0,0]=4 5764 B13R1.893 CC(=O)NCc1cc(ccc1F)C 527a_100102693586_100103153847 [0,1,0,0,0,1|2,0,0]=4 5765 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 11a_100011211646_100015343762 [0,1,0,0,0,1|2,0,0]=4 5766 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 1626a_100011211646_100015343762 [0,1,0,0,0,1|2,0,0]=4 5767 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 240690a_100011211646_100015343762 [0,1,0,0,0,1|2,0,0]=4 5768 B13R1.893 CC(=O)NCc1cc(ccc1F)Cl 527a_100011211646_100103153847 [0,1,0,0,0,1|2,0,0]=4 5769 B13R1.893 CC(=O)NCc1cc(ccc1F)F 11a_100000752317_100015343762 [0,1,0,0,0,1|2,0,0]=4 5770 B13R1.893 CC(=O)NCc1cc(ccc1F)F 1626a_100000752317_100015343762 [0,1,0,0,0,1|2,0,0]=4 5771 B13R1.893 CC(=O)NCc1cc(ccc1F)F 240690a_100000752317_100015343762 [0,1,0,0,0,1|2,0,0]=4 5772 B13R1.893 CC(=O)NCc1cc(ccc1F)F 527a_100000752317_100103153847 [0,1,0,0,0,1|2,0,0]=4 5773 B13R1.893 CC(=O)NCc1cc(ccc1O)Br 240690a_100000730032_100015343762 [0,1,0,0,0,1|2,0,0]=4 5774 B13R1.893 CC(=O)NCc1cc(ccc1O)Br 527a_100000730032_100103153847 [0,1,0,0,0,1|2,0,0]=4 5775 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl 240690a_100000238540_100015343762 [0,1,0,0,0,1|2,0,0]=4 5776 B13R1.893 CC(=O)NCc1cc(ccc1O)Cl 527a_100000238540_100103153847 [0,1,0,0,0,1|2,0,0]=4 5777 B13R1.893 CC(=O)NNc1cc(ccc1Br)Br 22a_200011483129_100000070787 [0,1,0,0,0,1|2,0,0]=4 5778 B13R1.893 CC(=O)NNc1cc(ccc1Br)F 22a_100012362518_100000070787 [0,1,0,0,0,1|2,0,0]=4 5779 B13R1.893 CC(=O)NNc1cc(ccc1C)C 22a_100000683361_100000070787 [0,1,0,0,0,1|2,0,0]=4 5780 B13R1.893 CC(=O)NNc1cc(ccc1C)Cl 22a_100020587667_100000070787 [0,1,0,0,0,1|2,0,0]=4 5781 B13R1.893 CC(=O)NNc1cc(ccc1C)F 22a_100011206524_100000070787 [0,1,0,0,0,1|2,0,0]=4 5782 B13R1.893 CC(=O)NNc1cc(ccc1Cl)C 22a_200020642191_100000070787 [0,1,0,0,0,1|2,0,0]=4 5783 B13R1.893 CC(=O)NNc1cc(ccc1Cl)Cl 22a_100000765587_100000070787 [0,1,0,0,0,1|2,0,0]=4 5784 B13R1.893 CC(=O)NNc1cc(ccc1Cl)F 22a_100016987657_100000070787 [0,1,0,0,0,1|2,0,0]=4 5785 B13R1.893 CC(=O)NNc1cc(ccc1F)Br 22a_100020610843_100000070787 [0,1,0,0,0,1|2,0,0]=4 5786 B13R1.893 CC(=O)NNc1cc(ccc1F)C 22a_100011248256_100000070787 [0,1,0,0,0,1|2,0,0]=4 5787 B13R1.893 CC(=O)NNc1cc(ccc1F)Cl 22a_100016987663_100000070787 [0,1,0,0,0,1|2,0,0]=4 5788 B13R1.893 CC(=O)NNc1cc(ccc1F)F 22a_100000005413_100000070787 [0,1,0,0,0,1|2,0,0]=4 5789 B13R1.893 Cc1ccc(c(c1)C=CC(=O)[13CH3])F 1458a_100102526132_200025704644 [0,1,0,0,0,1|2,0,0]=4 5790 B13R1.893 Cc1ccc(c(c1)CCC(=O)[13CH3])C 1458a_100011485725_200025704644 [0,1,0,0,0,1|2,0,0]=4 5791 B13R1.893 Cc1ccc(c(c1)CCC(=O)[13CH3])F 1458a_100011934859_200025704644 [0,1,0,0,0,1|2,0,0]=4 5792 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Br 34a_100012002257_100000187820 [0,1,0,0,0,1|2,0,0]=4 5793 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Br 7a_100012002257_100000187820 [0,1,0,0,0,1|2,0,0]=4 5794 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)C 34a_100000210931_100000187820 [0,1,0,0,0,1|2,0,0]=4 5795 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)C 7a_100000210931_100000187820 [0,1,0,0,0,1|2,0,0]=4 5796 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Cl 34a_100000211493_100000187820 [0,1,0,0,0,1|2,0,0]=4 5797 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)Cl 7a_100000211493_100000187820 [0,1,0,0,0,1|2,0,0]=4 5798 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)F 34a_100000759540_100000187820 [0,1,0,0,0,1|2,0,0]=4 5799 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)F 7a_100000759540_100000187820 [0,1,0,0,0,1|2,0,0]=4 5800 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)N 34a_100000211527_100000187820 [0,1,0,0,0,1|2,0,0]=4 5801 B13R1.893 Cc1ccc(c(c1)OCC(=O)N)N 7a_100000211527_100000187820 [0,1,0,0,0,1|2,0,0]=4 5802 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])C 1458a_100000182428_200025704644 [0,1,0,0,0,1|1,0,0]=3 5803 B13R1.893 Cc1ccc(c(c1)OCC(=O)[13CH3])Cl 1458a_100000183693_200025704644 [0,1,0,0,0,1|1,0,0]=3 5804 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])Br 34a_100012002257_100020667443 [0,1,0,0,0,1|2,0,0]=4 5805 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])C 34a_100000210931_100020667443 [0,1,0,0,0,1|2,0,0]=4 5806 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])Cl 34a_100000211493_100020667443 [0,1,0,0,0,1|2,0,0]=4 5807 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])F 34a_100000759540_100020667443 [0,1,0,0,0,1|2,0,0]=4 5808 B13R1.893 Cc1ccc(c(c1)OCC(=O)[O-])N 34a_100000211527_100020667443 [0,1,0,0,0,1|2,0,0]=4 5809 B13R1.893 Cc1ccc(cc1CCC(=O)[13CH3])F 1458a_100011830270_200025704644 [0,1,0,0,0,1|2,0,0]=4 5810 B13R1.893 Cc1ccc(cc1NCC(=O)N)O 34a_100011216113_100000187820 [0,1,0,0,0,1|2,0,0]=4 5811 B13R1.893 Cc1ccc(cc1NCC(=O)[O-])O 34a_100011216113_100020667443 [0,1,0,0,0,1|2,0,0]=4 5812 B13R1.893 Cc1ccc(cc1OCC(=O)N)Br 34a_100000685420_100000187820 [0,1,0,0,0,1|2,0,0]=4 5813 B13R1.893 Cc1ccc(cc1OCC(=O)N)Br 7a_100000685420_100000187820 [0,1,0,0,0,1|2,0,0]=4 5814 B13R1.893 Cc1ccc(cc1OCC(=O)N)Cl 34a_100000756515_100000187820 [0,1,0,0,0,1|2,0,0]=4 5815 B13R1.893 Cc1ccc(cc1OCC(=O)N)Cl 7a_100000756515_100000187820 [0,1,0,0,0,1|2,0,0]=4 5816 B13R1.893 Cc1ccc(cc1OCC(=O)N)F 34a_100000690566_100000187820 [0,1,0,0,0,1|2,0,0]=4 5817 B13R1.893 Cc1ccc(cc1OCC(=O)N)F 7a_100000690566_100000187820 [0,1,0,0,0,1|2,0,0]=4 5818 B13R1.893 Cc1ccc(cc1OCC(=O)N)I 7a_100000766334_100000187820 [0,1,0,0,0,1|2,0,0]=4 5819 B13R1.893 Cc1ccc(cc1OCC(=O)N)N 34a_100000759471_100000187820 [0,1,0,0,0,1|2,0,0]=4 5820 B13R1.893 Cc1ccc(cc1OCC(=O)N)N 7a_100000759471_100000187820 [0,1,0,0,0,1|2,0,0]=4 5821 B13R1.893 Cc1ccc(cc1OCC(=O)[O-])Br 34a_100000685420_100020667443 [0,1,0,0,0,1|2,0,0]=4 5822 B13R1.893 Cc1ccc(cc1OCC(=O)[O-])Cl 34a_100000756515_100020667443 [0,1,0,0,0,1|2,0,0]=4 5823 B13R1.893 Cc1ccc(cc1OCC(=O)[O-])F 34a_100000690566_100020667443 [0,1,0,0,0,1|2,0,0]=4 5824 B13R1.893 Cc1ccc(cc1OCC(=O)[O-])N 34a_100000759471_100020667443 [0,1,0,0,0,1|2,0,0]=4 5825 B13R1.893 Cc1ccc(cc1SCC(=O)N)O 62a_100000747473_100011380479 [0,1,0,0,0,1|1,1,0]=4 5826 B13R1.893 Cc1ccc(cc1SCC(=O)N)O 62a_100011380479_100000747473 [0,1,0,0,0,1|1,1,0]=4 5827 B13R1.893 Cc1ccc(cc1SCC(=O)[O-])O 62a_100011380479_100020667443 [0,1,0,0,0,1|1,1,0]=4 5828 B13R1.893 Cc1ccc(cc1SCC(=O)[O-])O 62a_100020667443_100011380479 [0,1,0,0,0,1|1,1,0]=4 5829 B13R1.893 NC(=O)CNc1cc(ccc1Br)O 34a_100011999798_100000187820 [0,1,0,0,0,1|2,0,0]=4 5830 B13R1.893 NC(=O)CNc1cc(ccc1Cl)O 34a_100011934297_100000187820 [0,1,0,0,0,1|2,0,0]=4 5831 B13R1.893 NC(=O)CNc1cc(ccc1F)O 34a_100012017239_100000187820 [0,1,0,0,0,1|2,0,0]=4 5832 B13R1.893 NC(=O)COc1cc(ccc1Br)Br 34a_100011220040_100000187820 [0,1,0,0,0,1|2,0,0]=4 5833 B13R1.893 NC(=O)COc1cc(ccc1Br)Br 7a_100011220040_100000187820 [0,1,0,0,0,1|2,0,0]=4 5834 B13R1.893 NC(=O)COc1cc(ccc1Br)Cl 34a_100012339455_100000187820 [0,1,0,0,0,1|2,0,0]=4 5835 B13R1.893 NC(=O)COc1cc(ccc1Br)Cl 7a_100012339455_100000187820 [0,1,0,0,0,1|2,0,0]=4 5836 B13R1.893 NC(=O)COc1cc(ccc1Br)F 34a_100000690578_100000187820 [0,1,0,0,0,1|2,0,0]=4 5837 B13R1.893 NC(=O)COc1cc(ccc1Br)F 7a_100000690578_100000187820 [0,1,0,0,0,1|2,0,0]=4 5838 B13R1.893 NC(=O)COc1cc(ccc1Br)I 34a_100012356990_100000187820 [0,1,0,0,0,1|2,0,0]=4 5839 B13R1.893 NC(=O)COc1cc(ccc1Br)I 7a_100012356990_100000187820 [0,1,0,0,0,1|2,0,0]=4 5840 B13R1.893 NC(=O)COc1cc(ccc1Cl)Br 34a_100000738945_100000187820 [0,1,0,0,0,1|2,0,0]=4 5841 B13R1.893 NC(=O)COc1cc(ccc1Cl)Br 7a_100000738945_100000187820 [0,1,0,0,0,1|2,0,0]=4 5842 B13R1.893 NC(=O)COc1cc(ccc1Cl)Cl 34a_100000211422_100000187820 [0,1,0,0,0,1|2,0,0]=4 5843 B13R1.893 NC(=O)COc1cc(ccc1Cl)Cl 7a_100000211422_100000187820 [0,1,0,0,0,1|2,0,0]=4 5844 B13R1.893 NC(=O)COc1cc(ccc1Cl)F 34a_100000692107_100000187820 [0,1,0,0,0,1|2,0,0]=4 5845 B13R1.893 NC(=O)COc1cc(ccc1Cl)F 7a_100000692107_100000187820 [0,1,0,0,0,1|2,0,0]=4 5846 B13R1.893 NC(=O)COc1cc(ccc1Cl)I 34a_100011356854_100000187820 [0,1,0,0,0,1|2,0,0]=4 5847 B13R1.893 NC(=O)COc1cc(ccc1Cl)I 7a_100011356854_100000187820 [0,1,0,0,0,1|2,0,0]=4 5848 B13R1.893 NC(=O)COc1cc(ccc1Cl)N 34a_100011934209_100000187820 [0,1,0,0,0,1|2,0,0]=4 5849 B13R1.893 NC(=O)COc1cc(ccc1F)Br 34a_100000686035_100000187820 [0,1,0,0,0,1|2,0,0]=4 5850 B13R1.893 NC(=O)COc1cc(ccc1F)Br 7a_100000686035_100000187820 [0,1,0,0,0,1|2,0,0]=4 5851 B13R1.893 NC(=O)COc1cc(ccc1F)Cl 34a_100000757397_100000187820 [0,1,0,0,0,1|2,0,0]=4 5852 B13R1.893 NC(=O)COc1cc(ccc1F)Cl 7a_100000757397_100000187820 [0,1,0,0,0,1|2,0,0]=4 5853 B13R1.893 NC(=O)COc1cc(ccc1F)F 34a_100000752141_100000187820 [0,1,0,0,0,1|2,0,0]=4 5854 B13R1.893 NC(=O)COc1cc(ccc1F)F 7a_100000752141_100000187820 [0,1,0,0,0,1|2,0,0]=4 5855 B13R1.893 NC(=O)COc1cc(ccc1F)I 34a_100009958187_100000187820 [0,1,0,0,0,1|2,0,0]=4 5856 B13R1.893 NC(=O)COc1cc(ccc1F)I 7a_100009958187_100000187820 [0,1,0,0,0,1|2,0,0]=4 5857 B13R1.893 NC(=O)COc1cc(ccc1F)N 34a_100012017398_100000187820 [0,1,0,0,0,1|2,0,0]=4 5858 B13R1.893 NC(=O)COc1cc(ccc1F)N 7a_100012017398_100000187820 [0,1,0,0,0,1|2,0,0]=4 5859 B13R1.893 NC(=O)COc1cc(ccc1I)Br 34a_100012344904_100000187820 [0,1,0,0,0,1|2,0,0]=4 5860 B13R1.893 NC(=O)COc1cc(ccc1I)Br 7a_100012344904_100000187820 [0,1,0,0,0,1|2,0,0]=4 5861 B13R1.893 NC(=O)COc1cc(ccc1I)Cl 34a_100000050036_100000187820 [0,1,0,0,0,1|2,0,0]=4 5862 B13R1.893 NC(=O)COc1cc(ccc1I)Cl 7a_100000050036_100000187820 [0,1,0,0,0,1|2,0,0]=4 5863 B13R1.893 NC(=O)COc1cc(ccc1I)F 34a_100010084537_100000187820 [0,1,0,0,0,1|2,0,0]=4 5864 B13R1.893 NC(=O)COc1cc(ccc1I)F 7a_100010084537_100000187820 [0,1,0,0,0,1|2,0,0]=4 5865 B13R1.893 NC(=O)COc1cc(ccc1N)Br 34a_100000739049_100000187820 [0,1,0,0,0,1|2,0,0]=4 5866 B13R1.893 NC(=O)COc1cc(ccc1N)Br 7a_100000739049_100000187820 [0,1,0,0,0,1|2,0,0]=4 5867 B13R1.893 NC(=O)COc1cc(ccc1N)Cl 34a_100000185728_100000187820 [0,1,0,0,0,1|2,0,0]=4 5868 B13R1.893 NC(=O)COc1cc(ccc1N)Cl 7a_100000185728_100000187820 [0,1,0,0,0,1|2,0,0]=4 5869 B13R1.893 NC(=O)COc1cc(ccc1N)F 34a_100000753323_100000187820 [0,1,0,0,0,1|2,0,0]=4 5870 B13R1.893 NC(=O)COc1cc(ccc1N)F 7a_100000753323_100000187820 [0,1,0,0,0,1|2,0,0]=4 5871 B13R1.893 NC(=O)COc1cc(ccc1N)I 34a_100000057187_100000187820 [0,1,0,0,0,1|2,0,0]=4 5872 B13R1.893 NC(=O)COc1cc(ccc1N)I 7a_100000057187_100000187820 [0,1,0,0,0,1|2,0,0]=4 5873 B13R1.893 NC(=O)COc1cc(ccc1N)N 34a_100025717382_100000187820 [0,1,0,0,0,1|2,0,0]=4 5874 B13R1.893 NC(=O)CSc1cc(ccc1Br)O 62a_100000747473_100012339312 [0,1,0,0,0,1|1,1,0]=4 5875 B13R1.893 NC(=O)CSc1cc(ccc1Br)O 62a_100012339312_100000747473 [0,1,0,0,0,1|1,1,0]=4 5876 B13R1.893 NC(=O)CSc1cc(ccc1Cl)O 62a_100000049588_100000747473 [0,1,0,0,0,1|1,1,0]=4 5877 B13R1.893 NC(=O)CSc1cc(ccc1Cl)O 62a_100000747473_100000049588 [0,1,0,0,0,1|1,1,0]=4 5878 B13R1.893 NC(=O)CSc1cc(ccc1F)O 62a_100000693481_100000747473 [0,1,0,0,0,1|1,1,0]=4 5879 B13R1.893 NC(=O)CSc1cc(ccc1F)O 62a_100000747473_100000693481 [0,1,0,0,0,1|1,1,0]=4 5880 B13R1.893 NC(=O)CSc1cc(ccc1N)O 62a_100000747473_100012001276 [0,1,0,0,0,1|1,1,0]=4 5881 B13R1.893 NC(=O)CSc1cc(ccc1N)O 62a_100012001276_100000747473 [0,1,0,0,0,1|1,1,0]=4 5882 B13R1.893 NC(=O)CSc1cc(ccc1O)O 62a_100000747473_100009813629 [0,1,0,0,0,1|1,1,0]=4 5883 B13R1.893 Nc1ccc(c(c1)OCC(=O)[O-])Cl 34a_100011934209_100020667443 [0,1,0,0,0,1|2,0,0]=4 5884 B13R1.893 Nc1ccc(c(c1)OCC(=O)[O-])F 34a_100012017398_100020667443 [0,1,0,0,0,1|2,0,0]=4 5885 B13R1.893 Nc1ccc(c(c1)OCC(=O)[O-])N 34a_100025717382_100020667443 [0,1,0,0,0,1|2,0,0]=4 5886 B13R1.893 Nc1ccc(cc1OCC(=O)[O-])Br 34a_100000739049_100020667443 [0,1,0,0,0,1|2,0,0]=4 5887 B13R1.893 Nc1ccc(cc1OCC(=O)[O-])Cl 34a_100000185728_100020667443 [0,1,0,0,0,1|2,0,0]=4 5888 B13R1.893 Nc1ccc(cc1OCC(=O)[O-])F 34a_100000753323_100020667443 [0,1,0,0,0,1|2,0,0]=4 5889 B13R1.893 Nc1ccc(cc1OCC(=O)[O-])I 34a_100000057187_100020667443 [0,1,0,0,0,1|2,0,0]=4 5890 B13R1.893 Nc1ccc(cc1SCC(=O)[O-])O 62a_100012001276_100020667443 [0,1,0,0,0,1|1,1,0]=4 5891 B13R1.893 Nc1ccc(cc1SCC(=O)[O-])O 62a_100020667443_100012001276 [0,1,0,0,0,1|1,1,0]=4 5892 B13R1.893 O=C([O-])CNc1cc(ccc1Br)O 34a_100011999798_100020667443 [0,1,0,0,0,1|2,0,0]=4 5893 B13R1.893 O=C([O-])CNc1cc(ccc1Cl)O 34a_100011934297_100020667443 [0,1,0,0,0,1|2,0,0]=4 5894 B13R1.893 O=C([O-])CNc1cc(ccc1F)O 34a_100012017239_100020667443 [0,1,0,0,0,1|2,0,0]=4 5895 B13R1.893 O=C([O-])COc1cc(ccc1Br)Br 34a_100011220040_100020667443 [0,1,0,0,0,1|2,0,0]=4 5896 B13R1.893 O=C([O-])COc1cc(ccc1Br)Cl 34a_100012339455_100020667443 [0,1,0,0,0,1|2,0,0]=4 5897 B13R1.893 O=C([O-])COc1cc(ccc1Br)F 34a_100000690578_100020667443 [0,1,0,0,0,1|2,0,0]=4 5898 B13R1.893 O=C([O-])COc1cc(ccc1Br)I 34a_100012356990_100020667443 [0,1,0,0,0,1|2,0,0]=4 5899 B13R1.893 O=C([O-])COc1cc(ccc1Cl)Br 34a_100000738945_100020667443 [0,1,0,0,0,1|2,0,0]=4 5900 B13R1.893 O=C([O-])COc1cc(ccc1Cl)Cl 34a_100000211422_100020667443 [0,1,0,0,0,1|2,0,0]=4 5901 B13R1.893 O=C([O-])COc1cc(ccc1Cl)F 34a_100000692107_100020667443 [0,1,0,0,0,1|2,0,0]=4 5902 B13R1.893 O=C([O-])COc1cc(ccc1Cl)I 34a_100011356854_100020667443 [0,1,0,0,0,1|2,0,0]=4 5903 B13R1.893 O=C([O-])COc1cc(ccc1F)Br 34a_100000686035_100020667443 [0,1,0,0,0,1|2,0,0]=4 5904 B13R1.893 O=C([O-])COc1cc(ccc1F)Cl 34a_100000757397_100020667443 [0,1,0,0,0,1|2,0,0]=4 5905 B13R1.893 O=C([O-])COc1cc(ccc1F)F 34a_100000752141_100020667443 [0,1,0,0,0,1|2,0,0]=4 5906 B13R1.893 O=C([O-])COc1cc(ccc1F)I 34a_100009958187_100020667443 [0,1,0,0,0,1|2,0,0]=4 5907 B13R1.893 O=C([O-])COc1cc(ccc1I)Br 34a_100012344904_100020667443 [0,1,0,0,0,1|2,0,0]=4 5908 B13R1.893 O=C([O-])COc1cc(ccc1I)Cl 34a_100000050036_100020667443 [0,1,0,0,0,1|2,0,0]=4 5909 B13R1.893 O=C([O-])COc1cc(ccc1I)F 34a_100010084537_100020667443 [0,1,0,0,0,1|2,0,0]=4 5910 B13R1.893 O=C([O-])CSc1cc(ccc1Br)O 62a_100012339312_100020667443 [0,1,0,0,0,1|1,1,0]=4 5911 B13R1.893 O=C([O-])CSc1cc(ccc1Br)O 62a_100020667443_100012339312 [0,1,0,0,0,1|1,1,0]=4 5912 B13R1.893 O=C([O-])CSc1cc(ccc1Cl)O 62a_100000049588_100020667443 [0,1,0,0,0,1|1,1,0]=4 5913 B13R1.893 O=C([O-])CSc1cc(ccc1Cl)O 62a_100020667443_100000049588 [0,1,0,0,0,1|1,1,0]=4 5914 B13R1.893 O=C([O-])CSc1cc(ccc1F)O 62a_100000693481_100020667443 [0,1,0,0,0,1|1,1,0]=4 5915 B13R1.893 O=C([O-])CSc1cc(ccc1F)O 62a_100020667443_100000693481 [0,1,0,0,0,1|1,1,0]=4 5916 B13R1.893 O=C([O-])CSc1cc(ccc1O)O 62a_100020667443_100009813629 [0,1,0,0,0,1|1,1,0]=4 5917 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1Br)F 1458a_100102525183_200025704644 [0,1,0,0,0,1|2,0,0]=4 5918 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1Cl)Cl 1458a_100000234794_200025704644 [0,1,0,0,0,1|2,0,0]=4 5919 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1F)Br 1458a_100000718207_200025704644 [0,1,0,0,0,1|2,0,0]=4 5920 B13R1.893 [13CH3]C(=O)C=Cc1cc(ccc1F)F 1458a_100000744626_200025704644 [0,1,0,0,0,1|2,0,0]=4 5921 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Br)F 1458a_100000685340_200025704644 [0,1,0,0,0,1|2,0,0]=4 5922 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)Br 1458a_100010145785_200025704644 [0,1,0,0,0,1|2,0,0]=4 5923 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)Cl 1458a_200012258936_200025704644 [0,1,0,0,0,1|2,0,0]=4 5924 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1Cl)F 1458a_100012357546_200025704644 [0,1,0,0,0,1|2,0,0]=4 5925 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)Br 1458a_100000694007_200025704644 [0,1,0,0,0,1|2,0,0]=4 5926 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)Cl 1458a_200012349660_200025704644 [0,1,0,0,0,1|2,0,0]=4 5927 B13R1.893 [13CH3]C(=O)CCc1cc(ccc1F)F 1458a_100000744313_200025704644 [0,1,0,0,0,1|2,0,0]=4 5928 B13R1.893 [13CH3]C(=O)COc1cc(ccc1Br)Cl 1458a_100015481456_200025704644 [0,1,0,0,0,1|1,0,0]=3 5929 B13R1.893 [13CH3]C(=O)COc1cc(ccc1Cl)Cl 1458a_100000187393_200025704644 [0,1,0,0,0,1|1,0,0]=3 5930 B13R1.893 [13CH3]C(=O)COc1cc(ccc1F)F 1458a_100000752474_200025704644 [0,1,0,0,0,1|1,0,0]=3 5931 B13R1.893 [13CH3]C(=O)CSc1cc(ccc1Cl)Cl 1458a_100000179523_200025704644 [0,1,0,0,0,1|1,1,0]=4 5932 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)O 34a_100000123917_100000748629 [0,1,0,0,0,1|2,0,0]=4 5933 B13R1.3420 C=C(C)CNc1cc(cc(c1)Cl)O 7a_100000123917_100000748629 [0,1,0,0,0,1|2,0,0]=4 5934 B13R1.3420 C=C(C)CNc1cc(cc(c1)O)C 34a_100011995906_100000748629 [0,1,0,0,0,1|2,0,0]=4 5935 B13R1.3420 C=C(C)CNc1cc(cc(c1)O)C 7a_100011995906_100000748629 [0,1,0,0,0,1|2,0,0]=4 5936 B13R1.3420 C=C(C)CNc1cc(cc(c1)O)O 34a_100000043371_100000748629 [0,1,0,0,0,1|2,0,0]=4 5937 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Br 34a_100010167048_100000748629 [0,1,0,0,0,1|2,0,0]=4 5938 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Br 7a_100010167048_100000748629 [0,1,0,0,0,1|2,0,0]=4 5939 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)C 34a_100011999630_100000748629 [0,1,0,0,0,1|2,0,0]=4 5940 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)C 7a_100011999630_100000748629 [0,1,0,0,0,1|2,0,0]=4 5941 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Cl 34a_100010185897_100000748629 [0,1,0,0,0,1|2,0,0]=4 5942 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)Cl 7a_100010185897_100000748629 [0,1,0,0,0,1|2,0,0]=4 5943 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)F 34a_100000688818_100000748629 [0,1,0,0,0,1|2,0,0]=4 5944 B13R1.3420 C=C(C)COc1cc(cc(c1)Br)F 7a_100000688818_100000748629 [0,1,0,0,0,1|2,0,0]=4 5945 B13R1.3420 C=C(C)COc1cc(cc(c1)C)C 34a_100000210933_100000748629 [0,1,0,0,0,1|2,0,0]=4 5946 B13R1.3420 C=C(C)COc1cc(cc(c1)C)C 7a_100000210933_100000748629 [0,1,0,0,0,1|2,0,0]=4 5947 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)C 34a_100000087485_100000748629 [0,1,0,0,0,1|2,0,0]=4 5948 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)C 7a_100000087485_100000748629 [0,1,0,0,0,1|2,0,0]=4 5949 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)Cl 34a_100000181315_100000748629 [0,1,0,0,0,1|2,0,0]=4 5950 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)Cl 7a_100000181315_100000748629 [0,1,0,0,0,1|2,0,0]=4 5951 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)F 34a_100011219751_100000748629 [0,1,0,0,0,1|2,0,0]=4 5952 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)F 7a_100011219751_100000748629 [0,1,0,0,0,1|2,0,0]=4 5953 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)N 34a_100000123917_100000748629 [0,1,0,0,0,1|2,0,0]=4 5954 B13R1.3420 C=C(C)COc1cc(cc(c1)Cl)N 7a_100000123917_100000748629 [0,1,0,0,0,1|2,0,0]=4 5955 B13R1.3420 C=C(C)COc1cc(cc(c1)F)C 34a_100011830401_100000748629 [0,1,0,0,0,1|2,0,0]=4 5956 B13R1.3420 C=C(C)COc1cc(cc(c1)F)C 7a_100011830401_100000748629 [0,1,0,0,0,1|2,0,0]=4 5957 B13R1.3420 C=C(C)COc1cc(cc(c1)F)F 34a_100000747503_100000748629 [0,1,0,0,0,1|2,0,0]=4 5958 B13R1.3420 C=C(C)COc1cc(cc(c1)F)F 7a_100000747503_100000748629 [0,1,0,0,0,1|2,0,0]=4 5959 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Br 34a_100010068917_100000748629 [0,1,0,0,0,1|2,0,0]=4 5960 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Br 7a_100010068917_100000748629 [0,1,0,0,0,1|2,0,0]=4 5961 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Cl 34a_100010068924_100000748629 [0,1,0,0,0,1|2,0,0]=4 5962 B13R1.3420 C=C(C)COc1cc(cc(c1)I)Cl 7a_100010068924_100000748629 [0,1,0,0,0,1|2,0,0]=4 5963 B13R1.3420 C=C(C)COc1cc(cc(c1)I)F 34a_100000717995_100000748629 [0,1,0,0,0,1|2,0,0]=4 5964 B13R1.3420 C=C(C)COc1cc(cc(c1)I)F 7a_100000717995_100000748629 [0,1,0,0,0,1|2,0,0]=4 5965 B13R1.3420 C=C(C)COc1cc(cc(c1)N)C 34a_100011995906_100000748629 [0,1,0,0,0,1|2,0,0]=4 5966 B13R1.3420 C=C(C)COc1cc(cc(c1)N)C 7a_100011995906_100000748629 [0,1,0,0,0,1|2,0,0]=4 5967 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)O 62a_100000748629_100010068917 [0,1,0,0,0,1|1,1,0]=4 5968 B13R1.3420 C=C(C)CSc1cc(cc(c1)Br)O 62a_100010068917_100000211660 [0,1,0,0,0,1|1,1,0]=4 5969 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)O 62a_100000748629_100010068924 [0,1,0,0,0,1|1,1,0]=4 5970 B13R1.3420 C=C(C)CSc1cc(cc(c1)Cl)O 62a_100010068924_100000211660 [0,1,0,0,0,1|1,1,0]=4 5971 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)O 62a_100000688818_100000211660 [0,1,0,0,0,1|1,1,0]=4 5972 B13R1.3420 C=C(C)CSc1cc(cc(c1)F)O 62a_100000748629_100000688818 [0,1,0,0,0,1|1,1,0]=4 5973 B13R1.3420 C=C(C)CSc1cc(cc(c1)O)C 62a_100000748629_100011999630 [0,1,0,0,0,1|1,1,0]=4 5974 B13R1.3420 C=C(C)CSc1cc(cc(c1)O)O 62a_100000748629_100009868816 [0,1,0,0,0,1|1,1,0]=4 5975 B13R1.3420 CC(=O)C=Cc1cc(cc(c1)C)C 1458a_100016257640_200000210301 [0,1,0,0,0,1|2,0,0]=4 5976 B13R1.3420 CC(=O)C=Cc1cc(cc(c1)Cl)Cl 1458a_100000234795_200000210301 [0,1,0,0,0,1|2,0,0]=4 5977 B13R1.3420 CC(=O)C=Cc1cc(cc(c1)Cl)F 1458a_100012349021_200000210301 [0,1,0,0,0,1|2,0,0]=4 5978 B13R1.3420 CC(=O)C=Cc1cc(cc(c1)F)C 1458a_100102526130_200000210301 [0,1,0,0,0,1|2,0,0]=4 5979 B13R1.3420 CC(=O)C=Cc1cc(cc(c1)F)F 1458a_100015207409_200000210301 [0,1,0,0,0,1|2,0,0]=4 5980 B13R1.3420 CC(=O)CCc1cc(cc(c1)Br)Br 1458a_100010253072_200000210301 [0,1,0,0,0,1|2,0,0]=4 5981 B13R1.3420 CC(=O)CCc1cc(cc(c1)Br)F 1458a_100012357547_200000210301 [0,1,0,0,0,1|2,0,0]=4 5982 B13R1.3420 CC(=O)CCc1cc(cc(c1)C)C 1458a_100000688337_200000210301 [0,1,0,0,0,1|2,0,0]=4 5983 B13R1.3420 CC(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000070787_100000691793 [0,1,0,0,0,1|2,0,0]=4 5984 B13R1.3420 CC(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000689174_200000210301 [0,1,0,0,0,1|2,0,0]=4 5985 B13R1.3420 CC(=O)CCc1cc(cc(c1)F)F 1458a_100000070787_100011754442 [0,1,0,0,0,1|2,0,0]=4 5986 B13R1.3420 CC(=O)CCc1cc(cc(c1)F)F 1458a_100011934504_200000210301 [0,1,0,0,0,1|2,0,0]=4 5987 B13R1.3420 CC(=O)COc1cc(cc(c1)Br)Cl 1458a_100010899942_200000210301 [0,1,0,0,0,1|1,0,0]=3 5988 B13R1.3420 CC(=O)COc1cc(cc(c1)C)C 1458a_100000182991_200000210301 [0,1,0,0,0,1|1,0,0]=3 5989 B13R1.3420 CC(=O)COc1cc(cc(c1)Cl)Cl 1458a_100000764634_200000210301 [0,1,0,0,0,1|1,0,0]=3 5990 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)Br 11a_100015211796_100015343762 [0,1,0,0,0,1|2,0,0]=4 5991 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)Br 240690a_100015211796_100015343762 [0,1,0,0,0,1|2,0,0]=4 5992 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)Br 527a_100015211796_100103153847 [0,1,0,0,0,1|2,0,0]=4 5993 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 11a_100020611034_100015343762 [0,1,0,0,0,1|2,0,0]=4 5994 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 1626a_100020611034_100015343762 [0,1,0,0,0,1|2,0,0]=4 5995 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 240690a_100020611034_100015343762 [0,1,0,0,0,1|2,0,0]=4 5996 B13R1.3420 CC(=O)NCc1cc(cc(c1)Br)F 527a_100020611034_100103153847 [0,1,0,0,0,1|2,0,0]=4 5997 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 11a_100020591340_100015343762 [0,1,0,0,0,1|2,0,0]=4 5998 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 1626a_100020591340_100015343762 [0,1,0,0,0,1|2,0,0]=4 5999 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 240690a_100020591340_100015343762 [0,1,0,0,0,1|2,0,0]=4 6000 B13R1.3420 CC(=O)NCc1cc(cc(c1)C)C 527a_100020591340_100103153847 [0,1,0,0,0,1|2,0,0]=4 6001 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 11a_100011211636_100015343762 [0,1,0,0,0,1|2,0,0]=4 6002 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 1626a_100011211636_100015343762 [0,1,0,0,0,1|2,0,0]=4 6003 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 240690a_100011211636_100015343762 [0,1,0,0,0,1|2,0,0]=4 6004 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)Cl 527a_100011211636_100103153847 [0,1,0,0,0,1|2,0,0]=4 6005 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 11a_100137329012_100015343762 [0,1,0,0,0,1|2,0,0]=4 6006 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 1626a_100137329012_100015343762 [0,1,0,0,0,1|2,0,0]=4 6007 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 240690a_100137329012_100015343762 [0,1,0,0,0,1|2,0,0]=4 6008 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)F 527a_100137329012_100103153847 [0,1,0,0,0,1|2,0,0]=4 6009 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)O 240690a_107254831445_100015343762 [0,1,0,0,0,1|1,0,0]=3 6010 B13R1.3420 CC(=O)NCc1cc(cc(c1)Cl)O 527a_107254831445_100103153847 [0,1,0,0,0,1|1,0,0]=3 6011 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 11a_100011830484_100015343762 [0,1,0,0,0,1|2,0,0]=4 6012 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 1626a_100011830484_100015343762 [0,1,0,0,0,1|2,0,0]=4 6013 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 240690a_100011830484_100015343762 [0,1,0,0,0,1|2,0,0]=4 6014 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)C 527a_100011830484_100103153847 [0,1,0,0,0,1|2,0,0]=4 6015 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 11a_100000737602_100015343762 [0,1,0,0,0,1|2,0,0]=4 6016 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 1626a_100000737602_100015343762 [0,1,0,0,0,1|2,0,0]=4 6017 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 240690a_100000737602_100015343762 [0,1,0,0,0,1|2,0,0]=4 6018 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)F 527a_100000737602_100103153847 [0,1,0,0,0,1|2,0,0]=4 6019 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)O 240690a_100160469513_100015343762 [0,1,0,0,0,1|1,0,0]=3 6020 B13R1.3420 CC(=O)NCc1cc(cc(c1)F)O 527a_100160469513_100103153847 [0,1,0,0,0,1|1,0,0]=3 6021 B13R1.3420 CC(=O)NCc1cc(cc(c1)O)O 240690a_100159270720_100015343762 [0,1,0,0,0,1|1,0,0]=3 6022 B13R1.3420 CC(=O)NCc1cc(cc(c1)O)O 527a_100159270720_100103153847 [0,1,0,0,0,1|1,0,0]=3 6023 B13R1.3420 CC(=O)NNc1cc(cc(c1)C)C 22a_100000184486_100000070787 [0,1,0,0,0,1|2,0,0]=4 6024 B13R1.3420 CC(=O)NNc1cc(cc(c1)Cl)Cl 22a_100000716695_100000070787 [0,1,0,0,0,1|2,0,0]=4 6025 B13R1.3420 CC(=O)NNc1cc(cc(c1)F)F 22a_100000744470_100000070787 [0,1,0,0,0,1|2,0,0]=4 6026 B13R1.3420 Cc1cc(cc(c1)C=CC(=O)[13CH3])C 1458a_100016257640_200025704644 [0,1,0,0,0,1|2,0,0]=4 6027 B13R1.3420 Cc1cc(cc(c1)C=CC(=O)[13CH3])F 1458a_100102526130_200025704644 [0,1,0,0,0,1|2,0,0]=4 6028 B13R1.3420 Cc1cc(cc(c1)CCC(=O)[13CH3])C 1458a_100000688337_200025704644 [0,1,0,0,0,1|2,0,0]=4 6029 B13R1.3420 Cc1cc(cc(c1)NCC(=O)N)O 34a_100011995906_100000187820 [0,1,0,0,0,1|2,0,0]=4 6030 B13R1.3420 Cc1cc(cc(c1)NCC(=O)N)O 7a_100011995906_100000187820 [0,1,0,0,0,1|2,0,0]=4 6031 B13R1.3420 Cc1cc(cc(c1)NCC(=O)[O-])O 34a_100011995906_100020667443 [0,1,0,0,0,1|2,0,0]=4 6032 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)Br 34a_100011999630_100000187820 [0,1,0,0,0,1|2,0,0]=4 6033 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)Br 7a_100011999630_100000187820 [0,1,0,0,0,1|2,0,0]=4 6034 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)C 34a_100000210933_100000187820 [0,1,0,0,0,1|2,0,0]=4 6035 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)C 7a_100000210933_100000187820 [0,1,0,0,0,1|2,0,0]=4 6036 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)Cl 34a_100000087485_100000187820 [0,1,0,0,0,1|2,0,0]=4 6037 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)Cl 7a_100000087485_100000187820 [0,1,0,0,0,1|2,0,0]=4 6038 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)F 34a_100011830401_100000187820 [0,1,0,0,0,1|2,0,0]=4 6039 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)F 7a_100011830401_100000187820 [0,1,0,0,0,1|2,0,0]=4 6040 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)N 34a_100011995906_100000187820 [0,1,0,0,0,1|2,0,0]=4 6041 B13R1.3420 Cc1cc(cc(c1)OCC(=O)N)N 7a_100011995906_100000187820 [0,1,0,0,0,1|2,0,0]=4 6042 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[13CH3])C 1458a_100000182991_200025704644 [0,1,0,0,0,1|1,0,0]=3 6043 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[O-])Br 34a_100011999630_100020667443 [0,1,0,0,0,1|2,0,0]=4 6044 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[O-])C 34a_100000210933_100020667443 [0,1,0,0,0,1|2,0,0]=4 6045 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[O-])Cl 34a_100000087485_100020667443 [0,1,0,0,0,1|2,0,0]=4 6046 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[O-])F 34a_100011830401_100020667443 [0,1,0,0,0,1|2,0,0]=4 6047 B13R1.3420 Cc1cc(cc(c1)OCC(=O)[O-])N 34a_100011995906_100020667443 [0,1,0,0,0,1|2,0,0]=4 6048 B13R1.3420 Cc1cc(cc(c1)SCC(=O)N)O 62a_100000747473_100011999630 [0,1,0,0,0,1|1,1,0]=4 6049 B13R1.3420 Cc1cc(cc(c1)SCC(=O)[O-])O 62a_100020667443_100011999630 [0,1,0,0,0,1|1,1,0]=4 6050 B13R1.3420 NC(=O)CNc1cc(cc(c1)Cl)O 34a_100000123917_100000187820 [0,1,0,0,0,1|2,0,0]=4 6051 B13R1.3420 NC(=O)CNc1cc(cc(c1)Cl)O 7a_100000123917_100000187820 [0,1,0,0,0,1|2,0,0]=4 6052 B13R1.3420 NC(=O)CNc1cc(cc(c1)O)O 34a_100000043371_100000187820 [0,1,0,0,0,1|2,0,0]=4 6053 B13R1.3420 NC(=O)COc1cc(cc(c1)Br)Br 34a_100010167048_100000187820 [0,1,0,0,0,1|2,0,0]=4 6054 B13R1.3420 NC(=O)COc1cc(cc(c1)Br)Br 7a_100010167048_100000187820 [0,1,0,0,0,1|2,0,0]=4 6055 B13R1.3420 NC(=O)COc1cc(cc(c1)Br)Cl 34a_100010185897_100000187820 [0,1,0,0,0,1|2,0,0]=4 6056 B13R1.3420 NC(=O)COc1cc(cc(c1)Br)Cl 7a_100010185897_100000187820 [0,1,0,0,0,1|2,0,0]=4 6057 B13R1.3420 NC(=O)COc1cc(cc(c1)Br)F 34a_100000688818_100000187820 [0,1,0,0,0,1|2,0,0]=4 6058 B13R1.3420 NC(=O)COc1cc(cc(c1)Br)F 7a_100000688818_100000187820 [0,1,0,0,0,1|2,0,0]=4 6059 B13R1.3420 NC(=O)COc1cc(cc(c1)Cl)Cl 34a_100000181315_100000187820 [0,1,0,0,0,1|2,0,0]=4 6060 B13R1.3420 NC(=O)COc1cc(cc(c1)Cl)Cl 7a_100000181315_100000187820 [0,1,0,0,0,1|2,0,0]=4 6061 B13R1.3420 NC(=O)COc1cc(cc(c1)Cl)F 34a_100011219751_100000187820 [0,1,0,0,0,1|2,0,0]=4 6062 B13R1.3420 NC(=O)COc1cc(cc(c1)Cl)F 7a_100011219751_100000187820 [0,1,0,0,0,1|2,0,0]=4 6063 B13R1.3420 NC(=O)COc1cc(cc(c1)Cl)N 34a_100000123917_100000187820 [0,1,0,0,0,1|2,0,0]=4 6064 B13R1.3420 NC(=O)COc1cc(cc(c1)Cl)N 7a_100000123917_100000187820 [0,1,0,0,0,1|2,0,0]=4 6065 B13R1.3420 NC(=O)COc1cc(cc(c1)F)F 34a_100000747503_100000187820 [0,1,0,0,0,1|2,0,0]=4 6066 B13R1.3420 NC(=O)COc1cc(cc(c1)F)F 7a_100000747503_100000187820 [0,1,0,0,0,1|2,0,0]=4 6067 B13R1.3420 NC(=O)COc1cc(cc(c1)I)Br 34a_100010068917_100000187820 [0,1,0,0,0,1|2,0,0]=4 6068 B13R1.3420 NC(=O)COc1cc(cc(c1)I)Br 7a_100010068917_100000187820 [0,1,0,0,0,1|2,0,0]=4 6069 B13R1.3420 NC(=O)COc1cc(cc(c1)I)Cl 34a_100010068924_100000187820 [0,1,0,0,0,1|2,0,0]=4 6070 B13R1.3420 NC(=O)COc1cc(cc(c1)I)Cl 7a_100010068924_100000187820 [0,1,0,0,0,1|2,0,0]=4 6071 B13R1.3420 NC(=O)COc1cc(cc(c1)I)F 34a_100000717995_100000187820 [0,1,0,0,0,1|2,0,0]=4 6072 B13R1.3420 NC(=O)COc1cc(cc(c1)I)F 7a_100000717995_100000187820 [0,1,0,0,0,1|2,0,0]=4 6073 B13R1.3420 NC(=O)CSc1cc(cc(c1)Br)O 62a_100000747473_100010068917 [0,1,0,0,0,1|1,1,0]=4 6074 B13R1.3420 NC(=O)CSc1cc(cc(c1)Br)O 62a_100010068917_100000747473 [0,1,0,0,0,1|1,1,0]=4 6075 B13R1.3420 NC(=O)CSc1cc(cc(c1)Cl)O 62a_100000747473_100010068924 [0,1,0,0,0,1|1,1,0]=4 6076 B13R1.3420 NC(=O)CSc1cc(cc(c1)Cl)O 62a_100010068924_100000747473 [0,1,0,0,0,1|1,1,0]=4 6077 B13R1.3420 NC(=O)CSc1cc(cc(c1)F)O 62a_100000688818_100000747473 [0,1,0,0,0,1|1,1,0]=4 6078 B13R1.3420 NC(=O)CSc1cc(cc(c1)F)O 62a_100000747473_100000688818 [0,1,0,0,0,1|1,1,0]=4 6079 B13R1.3420 NC(=O)CSc1cc(cc(c1)O)O 62a_100000747473_100009868816 [0,1,0,0,0,1|1,1,0]=4 6080 B13R1.3420 Nc1cc(cc(c1)OCC(=O)[O-])Cl 34a_100000123917_100020667443 [0,1,0,0,0,1|2,0,0]=4 6081 B13R1.3420 O=C([O-])CNc1cc(cc(c1)Cl)O 34a_100000123917_100020667443 [0,1,0,0,0,1|2,0,0]=4 6082 B13R1.3420 O=C([O-])CNc1cc(cc(c1)O)O 34a_100000043371_100020667443 [0,1,0,0,0,1|2,0,0]=4 6083 B13R1.3420 O=C([O-])COc1cc(cc(c1)Br)Br 34a_100010167048_100020667443 [0,1,0,0,0,1|2,0,0]=4 6084 B13R1.3420 O=C([O-])COc1cc(cc(c1)Br)Cl 34a_100010185897_100020667443 [0,1,0,0,0,1|2,0,0]=4 6085 B13R1.3420 O=C([O-])COc1cc(cc(c1)Br)F 34a_100000688818_100020667443 [0,1,0,0,0,1|2,0,0]=4 6086 B13R1.3420 O=C([O-])COc1cc(cc(c1)Cl)Cl 34a_100000181315_100020667443 [0,1,0,0,0,1|2,0,0]=4 6087 B13R1.3420 O=C([O-])COc1cc(cc(c1)Cl)F 34a_100011219751_100020667443 [0,1,0,0,0,1|2,0,0]=4 6088 B13R1.3420 O=C([O-])COc1cc(cc(c1)F)F 34a_100000747503_100020667443 [0,1,0,0,0,1|2,0,0]=4 6089 B13R1.3420 O=C([O-])COc1cc(cc(c1)I)Br 34a_100010068917_100020667443 [0,1,0,0,0,1|2,0,0]=4 6090 B13R1.3420 O=C([O-])COc1cc(cc(c1)I)Cl 34a_100010068924_100020667443 [0,1,0,0,0,1|2,0,0]=4 6091 B13R1.3420 O=C([O-])COc1cc(cc(c1)I)F 34a_100000717995_100020667443 [0,1,0,0,0,1|2,0,0]=4 6092 B13R1.3420 O=C([O-])CSc1cc(cc(c1)Br)O 62a_100010068917_100020667443 [0,1,0,0,0,1|1,1,0]=4 6093 B13R1.3420 O=C([O-])CSc1cc(cc(c1)Br)O 62a_100020667443_100010068917 [0,1,0,0,0,1|1,1,0]=4 6094 B13R1.3420 O=C([O-])CSc1cc(cc(c1)Cl)O 62a_100010068924_100020667443 [0,1,0,0,0,1|1,1,0]=4 6095 B13R1.3420 O=C([O-])CSc1cc(cc(c1)Cl)O 62a_100020667443_100010068924 [0,1,0,0,0,1|1,1,0]=4 6096 B13R1.3420 O=C([O-])CSc1cc(cc(c1)F)O 62a_100000688818_100020667443 [0,1,0,0,0,1|1,1,0]=4 6097 B13R1.3420 O=C([O-])CSc1cc(cc(c1)F)O 62a_100020667443_100000688818 [0,1,0,0,0,1|1,1,0]=4 6098 B13R1.3420 O=C([O-])CSc1cc(cc(c1)O)O 62a_100020667443_100009868816 [0,1,0,0,0,1|1,1,0]=4 6099 B13R1.3420 [13CH3]C(=O)C=Cc1cc(cc(c1)Cl)Cl 1458a_100000234795_200025704644 [0,1,0,0,0,1|2,0,0]=4 6100 B13R1.3420 [13CH3]C(=O)C=Cc1cc(cc(c1)Cl)F 1458a_100012349021_200025704644 [0,1,0,0,0,1|2,0,0]=4 6101 B13R1.3420 [13CH3]C(=O)C=Cc1cc(cc(c1)F)F 1458a_100015207409_200025704644 [0,1,0,0,0,1|2,0,0]=4 6102 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)Br)Br 1458a_100010253072_200025704644 [0,1,0,0,0,1|2,0,0]=4 6103 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)Br)F 1458a_100012357547_200025704644 [0,1,0,0,0,1|2,0,0]=4 6104 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)Cl)Cl 1458a_100000689174_200025704644 [0,1,0,0,0,1|2,0,0]=4 6105 B13R1.3420 [13CH3]C(=O)CCc1cc(cc(c1)F)F 1458a_100011934504_200025704644 [0,1,0,0,0,1|2,0,0]=4 6106 B13R1.3420 [13CH3]C(=O)COc1cc(cc(c1)Br)Cl 1458a_100010899942_200025704644 [0,1,0,0,0,1|1,0,0]=3 6107 B13R1.3420 [13CH3]C(=O)COc1cc(cc(c1)Cl)Cl 1458a_100000764634_200025704644 [0,1,0,0,0,1|1,0,0]=3 6108 B13R1.35 C#Cc1ccc(cc1Cl)NC(=O)C 11a_100012001888_100015343762 [0,2,0,0,0,0|2,0,0]=4 6109 B13R1.35 C#Cc1ccc(cc1Cl)NC(=O)C 1626a_100012001888_100015343762 [0,2,0,0,0,0|2,0,0]=4 6110 B13R1.35 C#Cc1ccc(cc1Cl)NC(=O)C 22a_100012001888_100000070787 [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 11a_100012001886_100015343762 [0,2,0,0,0,0|2,0,0]=4 6112 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 1626a_100012001886_100015343762 [0,2,0,0,0,0|2,0,0]=4 6113 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 22a_100012001886_100000070787 [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.35 C#Cc1ccc(cc1F)NC(=O)C 527a_100012001886_100103153847 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.35 C=Cc1ccc(cc1C)NC(=O)C 271570a_100011290941_100000155607 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.35 C=Cc1ccc(cc1F)NC(=O)C 271570a_100011290941_100011219590 [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.35 CC(=Cc1ccc(c(c1)O)C#N)C 271570a_100102525489_100011934713 [0,2,0,0,0,0|2,0,0]=4 6118 B13R1.35 CC(=Cc1ccc(c(c1)O)C=O)C 271570a_100102525489_100011277552 [0,2,0,0,0,0|2,0,0]=4 6119 B13R1.35 CC(=Cc1ccc(c(c1)O)CO)C 271570a_100102525489_100000071718 [0,2,0,0,0,0|2,0,0]=4 6120 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)C#N 1458a_100000070787_100012355662 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010141077_200025704644 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010141077_200025704644 [0,2,0,0,0,0|2,0,0]=4 6123 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_200000080089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6124 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_200000080089_200025704644 [0,2,0,0,0,0|2,0,0]=4 6125 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)C#N 1458a_100000070787_100010147163 [0,2,0,0,0,0|2,0,0]=4 6126 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_200000080078_200025704644 [0,2,0,0,0,0|2,0,0]=4 6127 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_200000080078_200025704644 [0,2,0,0,0,0|2,0,0]=4 6128 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C#N 1458a_100000070787_100011217145 [0,2,0,0,0,0|2,0,0]=4 6129 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_200000210301 [0,2,0,0,0,0|2,0,0]=4 6130 B13R1.35 CC(=O)Cc1ccc(c(c1)F)C=O 1458a_100000070787_100010142638 [0,2,0,0,0,0|2,0,0]=4 6131 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C#N 11a_100000689153_100015343762 [0,2,0,0,0,0|2,0,0]=4 6132 B13R1.35 CC(=O)Nc1ccc(c(c1)Br)C#N 1626a_100000689153_100015343762 [0,2,0,0,0,0|2,0,0]=4 6133 B13R1.35 CC(=O)Nc1ccc(c(c1)C)C#N 11a_100011999795_100015343762 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.35 CC(=O)Nc1ccc(c(c1)C)C#N 1626a_100011999795_100015343762 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.35 CC(=O)Nc1ccc(c(c1)C)CO 22a_100000102464_100000070787 [0,2,0,0,0,0|2,0,0]=4 6136 B13R1.35 CC(=O)Nc1ccc(c(c1)C)O[13CH3] 34a_100012186693_200025704644 [0,2,0,0,0,0|2,0,0]=4 6137 B13R1.35 CC(=O)Nc1ccc(c(c1)C)O[13CH3] 7a_100012186693_200025704644 [0,2,0,0,0,0|2,0,0]=4 6138 B13R1.35 CC(=O)Nc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100000155607 [0,2,0,0,0,0|2,0,0]=4 6139 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)C#N 11a_100000211542_100015343762 [0,2,0,0,0,0|2,0,0]=4 6140 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)C#N 1626a_100000211542_100015343762 [0,2,0,0,0,0|2,0,0]=4 6141 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)CO 22a_100000689119_100000070787 [0,2,0,0,0,0|2,0,0]=4 6142 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)O[13CH3] 34a_100011215158_200025704644 [0,2,0,0,0,0|2,0,0]=4 6143 B13R1.35 CC(=O)Nc1ccc(c(c1)Cl)O[13CH3] 7a_100011215158_200025704644 [0,2,0,0,0,0|2,0,0]=4 6144 B13R1.35 CC(=O)Nc1ccc(c(c1)F)C#N 11a_100000765089_100015343762 [0,2,0,0,0,0|2,0,0]=4 6145 B13R1.35 CC(=O)Nc1ccc(c(c1)F)C#N 1626a_100000765089_100015343762 [0,2,0,0,0,0|2,0,0]=4 6146 B13R1.35 CC(=O)Nc1ccc(c(c1)F)S[13CH3] 62a_200025704644_100011219590 [0,2,0,0,0,0|2,0,0]=4 6147 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 11a_100000766362_100015343762 [0,2,0,0,0,0|2,0,0]=4 6148 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 1626a_100000766362_100015343762 [0,2,0,0,0,0|2,0,0]=4 6149 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 22a_100000766362_100000070787 [0,2,0,0,0,0|2,0,0]=4 6150 B13R1.35 CCc1ccc(cc1Cl)NC(=O)C 527a_100000766362_100103153847 [0,2,0,0,0,0|2,0,0]=4 6151 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100000070787_200011397701 [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100011202338_200000210301 [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.35 COc1ccc(cc1Br)CC(=O)C 34a_100010141077_200000210301 [0,2,0,0,0,0|2,0,0]=4 6154 B13R1.35 COc1ccc(cc1Br)CC(=O)C 7a_100010141077_200000210301 [0,2,0,0,0,0|2,0,0]=4 6155 B13R1.35 COc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100011202338_200025704644 [0,2,0,0,0,0|2,0,0]=4 6156 B13R1.35 COc1ccc(cc1Br)NC(=O)C 11a_100000187427_100015343762 [0,2,0,0,0,0|2,0,0]=4 6157 B13R1.35 COc1ccc(cc1Br)NC(=O)C 1626a_100000187427_100015343762 [0,2,0,0,0,0|2,0,0]=4 6158 B13R1.35 COc1ccc(cc1Br)NC(=O)C 22a_100000187427_100000070787 [0,2,0,0,0,0|2,0,0]=4 6159 B13R1.35 COc1ccc(cc1Br)NC(=O)C 527a_100000187427_100103153847 [0,2,0,0,0,0|2,0,0]=4 6160 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100000070787_200011290836 [0,2,0,0,0,0|2,0,0]=4 6161 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100011356478_200000210301 [0,2,0,0,0,0|2,0,0]=4 6162 B13R1.35 COc1ccc(cc1C)CC(=O)C 34a_200000080089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6163 B13R1.35 COc1ccc(cc1C)CC(=O)C 7a_200000080089_200000210301 [0,2,0,0,0,0|2,0,0]=4 6164 B13R1.35 COc1ccc(cc1C)CC(=O)[13CH3] 1458a_100011356478_200025704644 [0,2,0,0,0,0|2,0,0]=4 6165 B13R1.35 COc1ccc(cc1C)NC(=O)C 11a_100000743268_100015343762 [0,2,0,0,0,0|2,0,0]=4 6166 B13R1.35 COc1ccc(cc1C)NC(=O)C 1626a_100000743268_100015343762 [0,2,0,0,0,0|2,0,0]=4 6167 B13R1.35 COc1ccc(cc1C)NC(=O)C 22a_100000743268_100000070787 [0,2,0,0,0,0|2,0,0]=4 6168 B13R1.35 COc1ccc(cc1C)NC(=O)C 34a_100012186693_200000210301 [0,2,0,0,0,0|2,0,0]=4 6169 B13R1.35 COc1ccc(cc1C)NC(=O)C 527a_100000743268_100103153847 [0,2,0,0,0,0|2,0,0]=4 6170 B13R1.35 COc1ccc(cc1C)NC(=O)C 7a_100012186693_200000210301 [0,2,0,0,0,0|2,0,0]=4 6171 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100000070787_100000693707 [0,2,0,0,0,0|2,0,0]=4 6172 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100012026953_200000210301 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_200000210301 [0,2,0,0,0,0|2,0,0]=4 6174 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_200000210301 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.35 COc1ccc(cc1Cl)CC(=O)[13CH3] 1458a_100012026953_200025704644 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 11a_100000211044_100015343762 [0,2,0,0,0,0|2,0,0]=4 6177 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 1626a_100000211044_100015343762 [0,2,0,0,0,0|2,0,0]=4 6178 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 22a_100000211044_100000070787 [0,2,0,0,0,0|2,0,0]=4 6179 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 34a_100011215158_200000210301 [0,2,0,0,0,0|2,0,0]=4 6180 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 527a_100000211044_100103153847 [0,2,0,0,0,0|2,0,0]=4 6181 B13R1.35 COc1ccc(cc1Cl)NC(=O)C 7a_100011215158_200000210301 [0,2,0,0,0,0|2,0,0]=4 6182 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000070787_100000189595 [0,2,0,0,0,0|2,0,0]=4 6183 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000204603_200000210301 [0,2,0,0,0,0|2,0,0]=4 6184 B13R1.35 COc1ccc(cc1F)CC(=O)[13CH3] 1458a_100000204603_200025704644 [0,2,0,0,0,0|2,0,0]=4 6185 B13R1.35 COc1ccc(cc1F)NC(=O)C 11a_100000740183_100015343762 [0,2,0,0,0,0|2,0,0]=4 6186 B13R1.35 COc1ccc(cc1F)NC(=O)C 1626a_100000740183_100015343762 [0,2,0,0,0,0|2,0,0]=4 6187 B13R1.35 COc1ccc(cc1F)NC(=O)C 22a_100000740183_100000070787 [0,2,0,0,0,0|2,0,0]=4 6188 B13R1.35 COc1ccc(cc1F)NC(=O)C 527a_100000740183_100103153847 [0,2,0,0,0,0|2,0,0]=4 6189 B13R1.35 COc1ccc(cc1I)NC(=O)C 11a_100011356947_100015343762 [0,2,0,0,0,0|2,0,0]=4 6190 B13R1.35 COc1ccc(cc1I)NC(=O)C 1626a_100011356947_100015343762 [0,2,0,0,0,0|2,0,0]=4 6191 B13R1.35 COc1ccc(cc1I)NC(=O)C 22a_100011356947_100000070787 [0,2,0,0,0,0|2,0,0]=4 6192 B13R1.35 COc1ccc(cc1I)NC(=O)C 527a_100011356947_100103153847 [0,2,0,0,0,0|2,0,0]=4 6193 B13R1.35 COc1ccc(cc1O)C=C(C)C 271570a_100102525489_100009816560 [0,2,0,0,0,0|2,0,0]=4 6194 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [0,2,0,0,0,0|1,0,0]=3 6195 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [0,2,0,0,0,0|1,0,0]=3 6196 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [0,2,0,0,0,0|1,0,0]=3 6197 B13R1.35 COc1ccc(cc1O)NC(=O)C 22a_100000211920_100000070787 [0,2,0,0,0,0|1,0,0]=3 6198 B13R1.35 COc1ccc(cc1O)NC(=O)C 527a_100000211920_100103153847 [0,2,0,0,0,0|1,0,0]=3 6199 B13R1.35 CSc1ccc(cc1C)NC(=O)C 62a_200000210301_100000155607 [0,2,0,0,0,0|2,0,0]=4 6200 B13R1.35 CSc1ccc(cc1F)NC(=O)C 11a_100000762756_100015343762 [0,2,0,0,0,0|2,0,0]=4 6201 B13R1.35 CSc1ccc(cc1F)NC(=O)C 1626a_100000762756_100015343762 [0,2,0,0,0,0|2,0,0]=4 6202 B13R1.35 CSc1ccc(cc1F)NC(=O)C 22a_100000762756_100000070787 [0,2,0,0,0,0|2,0,0]=4 6203 B13R1.35 CSc1ccc(cc1F)NC(=O)C 527a_100000762756_100103153847 [0,2,0,0,0,0|2,0,0]=4 6204 B13R1.35 CSc1ccc(cc1F)NC(=O)C 62a_200000210301_100011219590 [0,2,0,0,0,0|2,0,0]=4 6205 B13R1.35 [13CH3]C(=O)Cc1ccc(c(c1)F)C#N 1458a_100009864126_200025704644 [0,2,0,0,0,0|2,0,0]=4 6206 B13R1.52 C#Cc1cc(ccc1C)NC(=O)C 11a_200012017271_100015343762 [0,2,0,0,0,0|2,0,0]=4 6207 B13R1.52 C#Cc1cc(ccc1C)NC(=O)C 1626a_200012017271_100015343762 [0,2,0,0,0,0|2,0,0]=4 6208 B13R1.52 C#Cc1cc(ccc1C)NC(=O)C 22a_200012017271_100000070787 [0,2,0,0,0,0|2,0,0]=4 6209 B13R1.52 C#Cc1cc(ccc1C)NC(=O)C 527a_200012017271_100103153847 [0,2,0,0,0,0|2,0,0]=4 6210 B13R1.52 C#Cc1cc(ccc1Cl)NC(=O)C 11a_103624766972_100015343762 [0,2,0,0,0,0|2,0,0]=4 6211 B13R1.52 C#Cc1cc(ccc1Cl)NC(=O)C 1626a_103624766972_100015343762 [0,2,0,0,0,0|2,0,0]=4 6212 B13R1.52 C#Cc1cc(ccc1Cl)NC(=O)C 22a_103624766972_100000070787 [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.52 C#Cc1cc(ccc1Cl)NC(=O)C 527a_103624766972_100103153847 [0,2,0,0,0,0|2,0,0]=4 6214 B13R1.52 C#Cc1cc(ccc1F)NC(=O)C 11a_200011999510_100015343762 [0,2,0,0,0,0|2,0,0]=4 6215 B13R1.52 C#Cc1cc(ccc1F)NC(=O)C 1626a_200011999510_100015343762 [0,2,0,0,0,0|2,0,0]=4 6216 B13R1.52 C#Cc1cc(ccc1F)NC(=O)C 22a_200011999510_100000070787 [0,2,0,0,0,0|2,0,0]=4 6217 B13R1.52 C#Cc1cc(ccc1F)NC(=O)C 527a_200011999510_100103153847 [0,2,0,0,0,0|2,0,0]=4 6218 B13R1.52 C=Cc1cc(ccc1C)NC(=O)C 271570a_100011290941_100011221169 [0,2,0,0,0,0|2,0,0]=4 6219 B13R1.52 C=Cc1cc(ccc1C)OC(=O)C 271570a_100011290941_200025702335 [0,2,0,0,0,0|1,0,0]=3 6220 B13R1.52 C=Cc1cc(ccc1F)NC(=O)C 271570a_100011290941_100012348134 [0,2,0,0,0,0|2,0,0]=4 6221 B13R1.52 C=Cc1cc(ccc1O)CC(=O)C 271570a_100011290941_100010141077 [0,2,0,0,0,0|2,0,0]=4 6222 B13R1.52 CC(=Cc1ccc(c(c1)CO)Br)C 271570a_100102525489_100012359683 [0,2,0,0,0,0|2,0,0]=4 6223 B13R1.52 CC(=Cc1ccc(c(c1)CO)C)C 271570a_100102525489_100000700630 [0,2,0,0,0,0|2,0,0]=4 6224 B13R1.52 CC(=Cc1ccc(c(c1)CO)Cl)C 271570a_100102525489_100010128486 [0,2,0,0,0,0|2,0,0]=4 6225 B13R1.52 CC(=Cc1ccc(c(c1)CO)F)C 271570a_100102525489_100000049604 [0,2,0,0,0,0|2,0,0]=4 6226 B13R1.52 CC(=Cc1ccc(c(c1)CO)N)C 271570a_100102525489_100012353972 [0,2,0,0,0,0|2,0,0]=4 6227 B13R1.52 CC(=Cc1ccc(c(c1)CO)O)C 271570a_100102525489_100000184703 [0,2,0,0,0,0|2,0,0]=4 6228 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)Br 1458a_100000070787_100010128727 [0,2,0,0,0,0|2,0,0]=4 6229 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)Cl 1458a_100000070787_100010147165 [0,2,0,0,0,0|2,0,0]=4 6230 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)F 1458a_100000070787_100000687583 [0,2,0,0,0,0|2,0,0]=4 6231 B13R1.52 CC(=O)Cc1ccc(c(c1)C#N)F 1458a_100011218018_200000210301 [0,2,0,0,0,0|2,0,0]=4 6232 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,2,0,0,0,0|1,1,0]=4 6233 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,2,0,0,0,0|1,1,0]=4 6234 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Br 11a_100011934039_100015343762 [0,2,0,0,0,0|2,0,0]=4 6235 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Br 1626a_100011934039_100015343762 [0,2,0,0,0,0|2,0,0]=4 6236 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Br 22a_100011934039_100000070787 [0,2,0,0,0,0|2,0,0]=4 6237 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Br 527a_100011934039_100103153847 [0,2,0,0,0,0|2,0,0]=4 6238 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)C 11a_100011216687_100015343762 [0,2,0,0,0,0|2,0,0]=4 6239 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)C 1626a_100011216687_100015343762 [0,2,0,0,0,0|2,0,0]=4 6240 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)C 22a_100011216687_100000070787 [0,2,0,0,0,0|2,0,0]=4 6241 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)C 527a_100011216687_100103153847 [0,2,0,0,0,0|2,0,0]=4 6242 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Cl 11a_100000239497_100015343762 [0,2,0,0,0,0|2,0,0]=4 6243 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Cl 1626a_100000239497_100015343762 [0,2,0,0,0,0|2,0,0]=4 6244 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)Cl 22a_100000239497_100000070787 [0,2,0,0,0,0|2,0,0]=4 6245 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)F 11a_100000748589_100015343762 [0,2,0,0,0,0|2,0,0]=4 6246 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)F 1626a_100000748589_100015343762 [0,2,0,0,0,0|2,0,0]=4 6247 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)F 22a_100000748589_100000070787 [0,2,0,0,0,0|2,0,0]=4 6248 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)F 527a_100000748589_100103153847 [0,2,0,0,0,0|2,0,0]=4 6249 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)O 22a_100011249283_100000070787 [0,2,0,0,0,0|2,0,0]=4 6250 B13R1.52 CC(=O)Nc1ccc(c(c1)C#N)O 527a_100011249283_100103153847 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.52 CC(=O)Nc1ccc(c(c1)CO)Br 22a_100012347228_100000070787 [0,2,0,0,0,0|1,0,0]=3 6252 B13R1.52 CC(=O)Nc1ccc(c(c1)CO)Br 527a_100012347228_100103153847 [0,2,0,0,0,0|1,0,0]=3 6253 B13R1.52 CC(=O)Nc1ccc(c(c1)CO)Cl 22a_100011273577_100000070787 [0,2,0,0,0,0|1,0,0]=3 6254 B13R1.52 CC(=O)Nc1ccc(c(c1)CO)F 22a_100011218011_100000070787 [0,2,0,0,0,0|1,0,0]=3 6255 B13R1.52 CC(=O)Nc1ccc(c(c1)CO)F 527a_100011218011_100103153847 [0,2,0,0,0,0|1,0,0]=3 6256 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])C 34a_100000739390_200025704644 [0,2,0,0,0,0|2,0,0]=4 6257 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])C 7a_100000739390_200025704644 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])Cl 34a_100000742996_200025704644 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.52 CC(=O)Nc1ccc(c(c1)N[13CH3])F 34a_106454645589_200025704644 [0,2,0,0,0,0|2,0,0]=4 6260 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 34a_100011935283_200025704644 [0,2,0,0,0,0|1,0,0]=3 6261 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 7a_100011935283_200025704644 [0,2,0,0,0,0|1,0,0]=3 6262 B13R1.52 CC(=O)Nc1ccc(c(c1)S[13CH3])C 62a_200025704644_100011221169 [0,2,0,0,0,0|1,1,0]=4 6263 B13R1.52 CC(=O)Nc1ccc(c(c1)S[13CH3])F 62a_200025704644_100012348134 [0,2,0,0,0,0|1,1,0]=4 6264 B13R1.52 CC(=O)Oc1ccc(c(c1)C=O)O 271570a_203496583355_100009816906 [0,2,0,0,0,0|0,0,1]=3 6265 B13R1.52 CC(=O)Oc1ccc(c(c1)S[13CH3])C 62a_200025704644_200025702335 [0,2,0,0,0,0|0,1,0]=3 6266 B13R1.52 CC(C)Oc1ccc(c(c1)CO)Br 34a_100012351483_100000210206 [0,2,0,0,0,0|1,0,1]=4 6267 B13R1.52 CC(C)Oc1ccc(c(c1)CO)Br 7a_100012351483_100000210206 [0,2,0,0,0,0|1,0,1]=4 6268 B13R1.52 CC(C)Oc1ccc(c(c1)CO)Cl 34a_100000091669_100000210206 [0,2,0,0,0,0|1,0,1]=4 6269 B13R1.52 CC(C)Oc1ccc(c(c1)CO)Cl 7a_100000091669_100000210206 [0,2,0,0,0,0|1,0,1]=4 6270 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 11a_100010109747_100015343762 [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 1626a_100010109747_100015343762 [0,2,0,0,0,0|2,0,0]=4 6272 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 22a_100010109747_100000070787 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.52 CCc1cc(ccc1Br)NC(=O)C 527a_100010109747_100103153847 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.52 CNc1cc(ccc1C)NC(=O)C 34a_100000739390_200000210301 [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.52 CNc1cc(ccc1C)NC(=O)C 7a_100000739390_200000210301 [0,2,0,0,0,0|2,0,0]=4 6276 B13R1.52 CNc1cc(ccc1Cl)NC(=O)C 34a_100000742996_200000210301 [0,2,0,0,0,0|2,0,0]=4 6277 B13R1.52 CNc1cc(ccc1F)NC(=O)C 34a_106454645589_200000210301 [0,2,0,0,0,0|2,0,0]=4 6278 B13R1.52 COc1cc(ccc1Br)C=C(C)C 271570a_100102525489_100012353699 [0,2,0,0,0,0|2,0,0]=4 6279 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,2,0,0,0,0|1,0,0]=3 6280 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,2,0,0,0,0|1,0,0]=3 6281 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,2,0,0,0,0|1,0,0]=3 6282 B13R1.52 COc1cc(ccc1Br)NC(=O)C 11a_100000765947_100015343762 [0,2,0,0,0,0|1,0,0]=3 6283 B13R1.52 COc1cc(ccc1Br)NC(=O)C 1626a_100000765947_100015343762 [0,2,0,0,0,0|1,0,0]=3 6284 B13R1.52 COc1cc(ccc1Br)NC(=O)C 22a_100000765947_100000070787 [0,2,0,0,0,0|1,0,0]=3 6285 B13R1.52 COc1cc(ccc1Br)NC(=O)C 527a_100000765947_100103153847 [0,2,0,0,0,0|1,0,0]=3 6286 B13R1.52 COc1cc(ccc1Br)OC(C)C 34a_100011827694_100000210206 [0,2,0,0,0,0|1,0,1]=4 6287 B13R1.52 COc1cc(ccc1Br)OC(C)C 7a_100011827694_100000210206 [0,2,0,0,0,0|1,0,1]=4 6288 B13R1.52 COc1cc(ccc1C)C=C(C)C 271570a_100102525489_100011830276 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.52 COc1cc(ccc1C)NC(=O)C 11a_100011279678_100015343762 [0,2,0,0,0,0|1,0,0]=3 6290 B13R1.52 COc1cc(ccc1C)NC(=O)C 1626a_100011279678_100015343762 [0,2,0,0,0,0|1,0,0]=3 6291 B13R1.52 COc1cc(ccc1C)NC(=O)C 22a_100011279678_100000070787 [0,2,0,0,0,0|1,0,0]=3 6292 B13R1.52 COc1cc(ccc1C)NC(=O)C 527a_100011279678_100103153847 [0,2,0,0,0,0|1,0,0]=3 6293 B13R1.52 COc1cc(ccc1C)OC(C)C 34a_100009865632_100000210206 [0,2,0,0,0,0|1,0,1]=4 6294 B13R1.52 COc1cc(ccc1C)OC(C)C 7a_100009865632_100000210206 [0,2,0,0,0,0|1,0,1]=4 6295 B13R1.52 COc1cc(ccc1Cl)C=C(C)C 271570a_100102525489_100011356853 [0,2,0,0,0,0|2,0,0]=4 6296 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,2,0,0,0,0|1,0,0]=3 6297 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 11a_100000742311_100015343762 [0,2,0,0,0,0|1,0,0]=3 6298 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 1626a_100000742311_100015343762 [0,2,0,0,0,0|1,0,0]=3 6299 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 22a_100000742311_100000070787 [0,2,0,0,0,0|1,0,0]=3 6300 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 34a_100011935283_200000210301 [0,2,0,0,0,0|1,0,0]=3 6301 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 527a_100000742311_100103153847 [0,2,0,0,0,0|1,0,0]=3 6302 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 7a_100011935283_200000210301 [0,2,0,0,0,0|1,0,0]=3 6303 B13R1.52 COc1cc(ccc1Cl)OC(C)C 34a_100012186310_100000210206 [0,2,0,0,0,0|1,0,1]=4 6304 B13R1.52 COc1cc(ccc1Cl)OC(C)C 7a_100012186310_100000210206 [0,2,0,0,0,0|1,0,1]=4 6305 B13R1.52 COc1cc(ccc1F)C=C(C)C 271570a_100102525489_100011934186 [0,2,0,0,0,0|2,0,0]=4 6306 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,2,0,0,0,0|1,0,0]=3 6307 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,2,0,0,0,0|1,0,0]=3 6308 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,2,0,0,0,0|1,0,0]=3 6309 B13R1.52 COc1cc(ccc1F)NC(=O)C 11a_100000701188_100015343762 [0,2,0,0,0,0|1,0,0]=3 6310 B13R1.52 COc1cc(ccc1F)NC(=O)C 1626a_100000701188_100015343762 [0,2,0,0,0,0|1,0,0]=3 6311 B13R1.52 COc1cc(ccc1F)NC(=O)C 22a_100000701188_100000070787 [0,2,0,0,0,0|1,0,0]=3 6312 B13R1.52 COc1cc(ccc1F)NC(=O)C 527a_100000701188_100103153847 [0,2,0,0,0,0|1,0,0]=3 6313 B13R1.52 COc1cc(ccc1F)OC(C)C 34a_100012001760_100000210206 [0,2,0,0,0,0|1,0,1]=4 6314 B13R1.52 COc1cc(ccc1F)OC(C)C 7a_100012001760_100000210206 [0,2,0,0,0,0|1,0,1]=4 6315 B13R1.52 COc1cc(ccc1I)NC(=O)C 11a_100000746945_100015343762 [0,2,0,0,0,0|1,0,0]=3 6316 B13R1.52 COc1cc(ccc1I)NC(=O)C 1626a_100000746945_100015343762 [0,2,0,0,0,0|1,0,0]=3 6317 B13R1.52 COc1cc(ccc1I)NC(=O)C 22a_100000746945_100000070787 [0,2,0,0,0,0|1,0,0]=3 6318 B13R1.52 COc1cc(ccc1I)NC(=O)C 527a_100000746945_100103153847 [0,2,0,0,0,0|1,0,0]=3 6319 B13R1.52 COc1cc(ccc1N)C=C(C)C 271570a_100102525489_100011279103 [0,2,0,0,0,0|2,0,0]=4 6320 B13R1.52 COc1cc(ccc1N)OC(C)C 34a_100015326901_100000210206 [0,2,0,0,0,0|1,0,1]=4 6321 B13R1.52 COc1cc(ccc1N)OC(C)C 7a_100015326901_100000210206 [0,2,0,0,0,0|1,0,1]=4 6322 B13R1.52 COc1cc(ccc1O)C=C(C)C 271570a_100102525489_100000694246 [0,2,0,0,0,0|2,0,0]=4 6323 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,2,0,0,0,0|1,0,0]=3 6324 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,2,0,0,0,0|1,0,0]=3 6325 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [0,2,0,0,0,0|1,0,0]=3 6326 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [0,2,0,0,0,0|1,0,0]=3 6327 B13R1.52 COc1nc(ccc1Br)CC(=O)C 1458a_100000070787_200010066506 [0,2,0,0,0,0|2,0,0]=4 6328 B13R1.52 CSc1cc(ccc1C)NC(=O)C 62a_200000210301_100011221169 [0,2,0,0,0,0|1,1,0]=4 6329 B13R1.52 CSc1cc(ccc1C)OC(=O)C 62a_200000210301_200025702335 [0,2,0,0,0,0|0,1,0]=3 6330 B13R1.52 CSc1cc(ccc1F)NC(=O)C 62a_200000210301_100012348134 [0,2,0,0,0,0|1,1,0]=4 6331 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,2,0,0,0,0|1,1,0]=4 6332 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,2,0,0,0,0|1,1,0]=4 6333 B13R1.52 Cc1ccc(cc1CO)OC(C)C 34a_100009878257_100000210206 [0,2,0,0,0,0|1,0,1]=4 6334 B13R1.52 Cc1ccc(cc1CO)OC(C)C 7a_100009878257_100000210206 [0,2,0,0,0,0|1,0,1]=4 6335 B13R1.52 [13CH3]C(=O)Cc1ccc(c(c1)C#N)F 1458a_100011218018_200025704644 [0,2,0,0,0,0|2,0,0]=4 6336 B13R1.510 CC(=C(C)c1ccc(c(c1)O)Br)C 271570a_200000049429_100012356990 [0,2,0,0,0,0|2,0,0]=4 6337 B13R1.510 CC(=C(C)c1ccc(c(c1)O)C)C 271570a_200000049429_100000766334 [0,2,0,0,0,0|2,0,0]=4 6338 B13R1.510 CC(=C(C)c1ccc(c(c1)O)Cl)C 271570a_200000049429_100011356854 [0,2,0,0,0,0|2,0,0]=4 6339 B13R1.510 CC(=C(C)c1ccc(c(c1)O)F)C 271570a_200000049429_100000686035 [0,2,0,0,0,0|2,0,0]=4 6340 B13R1.510 CC(=C(C)c1ccc(c(c1)O)N)C 271570a_200000049429_100000739049 [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.510 CC(=C(C)c1ccc(c(c1)O)O)C 271570a_200000049429_100009813601 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.510 CC(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200000210301 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [0,2,0,0,0,0|1,0,0]=3 6344 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Br)C 11a_100000707694_100015343762 [0,2,0,0,0,0|2,0,0]=4 6345 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Br)C 1626a_100000707694_100015343762 [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Br)C 527a_100000707694_100103153847 [0,2,0,0,0,0|2,0,0]=4 6347 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Br 11a_100102888905_100015343762 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Br 1626a_100102888905_100015343762 [0,2,0,0,0,0|2,0,0]=4 6349 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Br 22a_100102888905_100000070787 [0,2,0,0,0,0|2,0,0]=4 6350 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Br 527a_100102888905_100103153847 [0,2,0,0,0,0|2,0,0]=4 6351 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Cl 11a_114849113799_100015343762 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Cl 1626a_114849113799_100015343762 [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)Cl 22a_114849113799_100000070787 [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)F 11a_100011756966_100015343762 [0,2,0,0,0,0|2,0,0]=4 6355 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)F 1626a_100011756966_100015343762 [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)F 22a_100011756966_100000070787 [0,2,0,0,0,0|2,0,0]=4 6357 B13R1.510 CC(=O)N(C)c1ccc(c(c1)C)F 527a_100011756966_100103153847 [0,2,0,0,0,0|2,0,0]=4 6358 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)C 11a_100000220120_100015343762 [0,2,0,0,0,0|2,0,0]=4 6359 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)C 1626a_100000220120_100015343762 [0,2,0,0,0,0|2,0,0]=4 6360 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)C 22a_100000220120_100000070787 [0,2,0,0,0,0|2,0,0]=4 6361 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)Cl 11a_100000219944_100015343762 [0,2,0,0,0,0|2,0,0]=4 6362 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)Cl 1626a_100000219944_100015343762 [0,2,0,0,0,0|2,0,0]=4 6363 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)F 11a_100000697440_100015343762 [0,2,0,0,0,0|2,0,0]=4 6364 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)F 1626a_100000697440_100015343762 [0,2,0,0,0,0|2,0,0]=4 6365 B13R1.510 CC(=O)N(C)c1ccc(c(c1)Cl)F 22a_100000697440_100000070787 [0,2,0,0,0,0|2,0,0]=4 6366 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)Br 11a_100012285320_100015343762 [0,2,0,0,0,0|2,0,0]=4 6367 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)Br 1626a_100012285320_100015343762 [0,2,0,0,0,0|2,0,0]=4 6368 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)C 11a_100160572069_100015343762 [0,2,0,0,0,0|2,0,0]=4 6369 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)C 1626a_100160572069_100015343762 [0,2,0,0,0,0|2,0,0]=4 6370 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)C 22a_100160572069_100000070787 [0,2,0,0,0,0|2,0,0]=4 6371 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)C 527a_100160572069_100103153847 [0,2,0,0,0,0|2,0,0]=4 6372 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)F 11a_100000221014_100015343762 [0,2,0,0,0,0|2,0,0]=4 6373 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)F 1626a_100000221014_100015343762 [0,2,0,0,0,0|2,0,0]=4 6374 B13R1.510 CC(=O)N(C)c1ccc(c(c1)F)F 22a_100000221014_100000070787 [0,2,0,0,0,0|2,0,0]=4 6375 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)F)F 1458a_100011217530_200025704644 [0,2,0,0,0,0|2,0,0]=4 6376 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [0,2,0,0,0,0|1,0,0]=3 6377 B13R1.518 CS(=O)(=O)Nc1ccc(c(c1)O)F 271570a_203496583355_100012348136 [0,2,0,0,0,0|2,0,0]=4 6378 B13R1.518 CS(=O)(=O)Nc1ccc(c(c1)O)F 40a_100012017398_100000738038 [0,2,0,0,0,0|2,0,0]=4 6379 B13R1.518 Cc1ccc(cc1O)NS(=O)(=O)C 40a_100000759471_100000738038 [0,2,0,0,0,0|2,0,0]=4 6380 B13R1.876 CC(=Cc1cc(c(cc1Br)Cl)O)C 271570a_100102525489_100021297947 [0,2,0,0,0,0|2,0,0]=4 6381 B13R1.876 CC(=Cc1cc(c(cc1C)F)O)C 271570a_100102525489_100010068922 [0,2,0,0,0,0|2,0,0]=4 6382 B13R1.876 CC(=Cc1cc(c(cc1C)N)O)C 271570a_100102525489_200010107346 [0,2,0,0,0,0|2,0,0]=4 6383 B13R1.876 CC(=Cc1cc(c(cc1F)C)O)C 271570a_100102525489_100014242602 [0,2,0,0,0,0|2,0,0]=4 6384 B13R1.876 CC(=Cc1cc(c(cc1F)Cl)O)C 271570a_100102525489_100010735246 [0,2,0,0,0,0|2,0,0]=4 6385 B13R1.876 CC(=Cc1cc(c(cc1F)F)O)C 271570a_100102525489_100012457948 [0,2,0,0,0,0|2,0,0]=4 6386 B13R1.876 CC(=Cc1cc(c(cc1F)N)O)C 271570a_100102525489_100013038943 [0,2,0,0,0,0|2,0,0]=4 6387 B13R1.876 CC(=O)Cc1cc(c(cc1Br)F)F 1458a_100000070787_100010077255 [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.876 CC(=O)Cc1cc(c(cc1Br)F)F 1458a_100009828490_200000210301 [0,2,0,0,0,0|2,0,0]=4 6389 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)Cl 1458a_100000070787_100010220947 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100000070787_100009813697 [0,2,0,0,0,0|2,0,0]=4 6391 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100011219564_200000210301 [0,2,0,0,0,0|2,0,0]=4 6392 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000062174_200000210301 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.876 CC(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000070787_100011830393 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.876 CC(=O)Cc1cc(c(cc1F)Br)F 1458a_100000070787_100012024439 [0,2,0,0,0,0|2,0,0]=4 6395 B13R1.876 CC(=O)Cc1cc(c(cc1F)Br)F 1458a_100010245136_200000210301 [0,2,0,0,0,0|2,0,0]=4 6396 B13R1.876 CC(=O)Cc1cc(c(cc1F)Cl)F 1458a_100000070787_200012361342 [0,2,0,0,0,0|2,0,0]=4 6397 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)C 1458a_100000070787_100012347589 [0,2,0,0,0,0|2,0,0]=4 6398 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)Cl 1458a_100000070787_100010994231 [0,2,0,0,0,0|2,0,0]=4 6399 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)Cl 1458a_100010154639_200000210301 [0,2,0,0,0,0|2,0,0]=4 6400 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)F 1458a_100000070787_100011218792 [0,2,0,0,0,0|2,0,0]=4 6401 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)F 1458a_100000690282_200000210301 [0,2,0,0,0,0|2,0,0]=4 6402 B13R1.876 CC(=O)Cc1cc(c(cc1F)F)I 1458a_100000070787_100019984567 [0,2,0,0,0,0|2,0,0]=4 6403 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)Br 11a_100009998182_100015343762 [0,2,0,0,0,0|2,0,0]=4 6404 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)C 11a_100009995518_100015343762 [0,2,0,0,0,0|2,0,0]=4 6405 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)C 1626a_100009995518_100015343762 [0,2,0,0,0,0|2,0,0]=4 6406 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)F 11a_100010212202_100015343762 [0,2,0,0,0,0|2,0,0]=4 6407 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)F 1626a_100010212202_100015343762 [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Br 11a_100012348304_100015343762 [0,2,0,0,0,0|2,0,0]=4 6409 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Br 1626a_100012348304_100015343762 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)C 11a_100012337760_100015343762 [0,2,0,0,0,0|2,0,0]=4 6411 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)C 1626a_100012337760_100015343762 [0,2,0,0,0,0|2,0,0]=4 6412 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Cl 11a_100000702286_100015343762 [0,2,0,0,0,0|2,0,0]=4 6413 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Cl 1626a_100000702286_100015343762 [0,2,0,0,0,0|2,0,0]=4 6414 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)Cl 22a_100000702286_100000070787 [0,2,0,0,0,0|2,0,0]=4 6415 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)F 11a_100011218008_100015343762 [0,2,0,0,0,0|2,0,0]=4 6416 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)F 1626a_100011218008_100015343762 [0,2,0,0,0,0|2,0,0]=4 6417 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Cl)F 11a_100010254744_100015343762 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Cl)F 1626a_100010254744_100015343762 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Br 11a_100010131408_100015343762 [0,2,0,0,0,0|2,0,0]=4 6420 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Br 1626a_100010131408_100015343762 [0,2,0,0,0,0|2,0,0]=4 6421 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)C 11a_100010233353_100015343762 [0,2,0,0,0,0|2,0,0]=4 6422 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)C 1626a_100010233353_100015343762 [0,2,0,0,0,0|2,0,0]=4 6423 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Cl 11a_100009817155_100015343762 [0,2,0,0,0,0|2,0,0]=4 6424 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Cl 1626a_100009817155_100015343762 [0,2,0,0,0,0|2,0,0]=4 6425 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)F 11a_100000690790_100015343762 [0,2,0,0,0,0|2,0,0]=4 6426 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)F 1626a_100000690790_100015343762 [0,2,0,0,0,0|2,0,0]=4 6427 B13R1.876 CC(=O)Nc1cc(c(cc1Br)O)Br 527a_100011080774_100103153847 [0,2,0,0,0,0|2,0,0]=4 6428 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 11a_100011934712_100015343762 [0,2,0,0,0,0|2,0,0]=4 6429 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 1626a_100011934712_100015343762 [0,2,0,0,0,0|2,0,0]=4 6430 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 22a_100011934712_100000070787 [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)C 527a_100011934712_100103153847 [0,2,0,0,0,0|2,0,0]=4 6432 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)Cl 11a_100012353740_100015343762 [0,2,0,0,0,0|2,0,0]=4 6433 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)Cl 1626a_100012353740_100015343762 [0,2,0,0,0,0|2,0,0]=4 6434 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)Cl 22a_100012353740_100000070787 [0,2,0,0,0,0|2,0,0]=4 6435 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)F 11a_100000695870_100015343762 [0,2,0,0,0,0|2,0,0]=4 6436 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)F 1626a_100000695870_100015343762 [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.876 CC(=O)Nc1cc(c(cc1C)Br)F 22a_100000695870_100000070787 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 11a_100000703630_100015343762 [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 1626a_100000703630_100015343762 [0,2,0,0,0,0|2,0,0]=4 6440 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 22a_100000703630_100000070787 [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br 527a_100000703630_100103153847 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)C 11a_100011217141_100015343762 [0,2,0,0,0,0|2,0,0]=4 6443 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)C 1626a_100011217141_100015343762 [0,2,0,0,0,0|2,0,0]=4 6444 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)C 22a_100011217141_100000070787 [0,2,0,0,0,0|2,0,0]=4 6445 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 11a_100010244688_100015343762 [0,2,0,0,0,0|2,0,0]=4 6446 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 1626a_100010244688_100015343762 [0,2,0,0,0,0|2,0,0]=4 6447 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 22a_100010244688_100000070787 [0,2,0,0,0,0|2,0,0]=4 6448 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Br 527a_100010244688_100103153847 [0,2,0,0,0,0|2,0,0]=4 6449 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)C 11a_100011830454_100015343762 [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)C 1626a_100011830454_100015343762 [0,2,0,0,0,0|2,0,0]=4 6451 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)C 22a_100011830454_100000070787 [0,2,0,0,0,0|2,0,0]=4 6452 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Cl 11a_100012017293_100015343762 [0,2,0,0,0,0|2,0,0]=4 6453 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Cl 1626a_100012017293_100015343762 [0,2,0,0,0,0|2,0,0]=4 6454 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)Cl 22a_100012017293_100000070787 [0,2,0,0,0,0|2,0,0]=4 6455 B13R1.876 CC(=O)Nc1cc(c(cc1C)Cl)O 22a_100009961766_100000070787 [0,2,0,0,0,0|1,0,0]=3 6456 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 11a_100000717900_100015343762 [0,2,0,0,0,0|2,0,0]=4 6457 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 1626a_100000717900_100015343762 [0,2,0,0,0,0|2,0,0]=4 6458 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 22a_100000717900_100000070787 [0,2,0,0,0,0|2,0,0]=4 6459 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br 527a_100000717900_100103153847 [0,2,0,0,0,0|2,0,0]=4 6460 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Cl 11a_100012017673_100015343762 [0,2,0,0,0,0|2,0,0]=4 6461 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Cl 1626a_100012017673_100015343762 [0,2,0,0,0,0|2,0,0]=4 6462 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Cl 22a_100012017673_100000070787 [0,2,0,0,0,0|2,0,0]=4 6463 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)F 11a_100011830416_100015343762 [0,2,0,0,0,0|2,0,0]=4 6464 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)F 1626a_100011830416_100015343762 [0,2,0,0,0,0|2,0,0]=4 6465 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)F 22a_100011830416_100000070787 [0,2,0,0,0,0|2,0,0]=4 6466 B13R1.876 CC(=O)Nc1cc(c(cc1C)I)F 11a_100010291052_100015343762 [0,2,0,0,0,0|2,0,0]=4 6467 B13R1.876 CC(=O)Nc1cc(c(cc1C)I)F 1626a_100010291052_100015343762 [0,2,0,0,0,0|2,0,0]=4 6468 B13R1.876 CC(=O)Nc1cc(c(cc1C)I)F 22a_100010291052_100000070787 [0,2,0,0,0,0|2,0,0]=4 6469 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 11a_100000720036_100015343762 [0,2,0,0,0,0|2,0,0]=4 6470 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 22a_100000720036_100000070787 [0,2,0,0,0,0|2,0,0]=4 6471 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 271570a_203496583355_100009992581 [0,2,0,0,0,0|2,0,0]=4 6472 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)C 527a_100000720036_100103153847 [0,2,0,0,0,0|2,0,0]=4 6473 B13R1.876 CC(=O)Nc1cc(c(cc1C)O)F 271570a_203496583355_200013212116 [0,2,0,0,0,0|2,0,0]=4 6474 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)Cl 11a_100000246133_100015343762 [0,2,0,0,0,0|2,0,0]=4 6475 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)Cl 1626a_100000246133_100015343762 [0,2,0,0,0,0|2,0,0]=4 6476 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)F 11a_100000688864_100015343762 [0,2,0,0,0,0|2,0,0]=4 6477 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Br)F 1626a_100000688864_100015343762 [0,2,0,0,0,0|2,0,0]=4 6478 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)C 11a_100012183282_100015343762 [0,2,0,0,0,0|2,0,0]=4 6479 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)C 1626a_100012183282_100015343762 [0,2,0,0,0,0|2,0,0]=4 6480 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)C 22a_100012183282_100000070787 [0,2,0,0,0,0|2,0,0]=4 6481 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)C)O 22a_100000092876_100000070787 [0,2,0,0,0,0|1,0,0]=3 6482 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Br 11a_200012360370_100015343762 [0,2,0,0,0,0|2,0,0]=4 6483 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Br 1626a_200012360370_100015343762 [0,2,0,0,0,0|2,0,0]=4 6484 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)C 11a_100012000392_100015343762 [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)C 1626a_100012000392_100015343762 [0,2,0,0,0,0|2,0,0]=4 6486 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Cl 11a_100000211015_100015343762 [0,2,0,0,0,0|2,0,0]=4 6487 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)Cl 1626a_100000211015_100015343762 [0,2,0,0,0,0|2,0,0]=4 6488 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)F 11a_100012017157_100015343762 [0,2,0,0,0,0|2,0,0]=4 6489 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)F 1626a_100012017157_100015343762 [0,2,0,0,0,0|2,0,0]=4 6490 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)I 11a_100016224655_100015343762 [0,2,0,0,0,0|2,0,0]=4 6491 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)Cl)I 1626a_100016224655_100015343762 [0,2,0,0,0,0|2,0,0]=4 6492 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Br 11a_100000685351_100015343762 [0,2,0,0,0,0|2,0,0]=4 6493 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Br 1626a_100000685351_100015343762 [0,2,0,0,0,0|2,0,0]=4 6494 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)C 11a_100000729549_100015343762 [0,2,0,0,0,0|2,0,0]=4 6495 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)C 1626a_100000729549_100015343762 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)C 22a_100000729549_100000070787 [0,2,0,0,0,0|2,0,0]=4 6497 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Cl 11a_100000085081_100015343762 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Cl 1626a_100000085081_100015343762 [0,2,0,0,0,0|2,0,0]=4 6499 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)Cl 22a_100000085081_100000070787 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)F 11a_100000766337_100015343762 [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)F)F 1626a_100000766337_100015343762 [0,2,0,0,0,0|2,0,0]=4 6502 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)O)F 22a_100009886023_100000070787 [0,2,0,0,0,0|2,0,0]=4 6503 B13R1.876 CC(=O)Nc1cc(c(cc1Cl)O)F 527a_100009886023_100103153847 [0,2,0,0,0,0|2,0,0]=4 6504 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 11a_200010212207_100015343762 [0,2,0,0,0,0|2,0,0]=4 6505 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 1626a_200010212207_100015343762 [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 22a_200010212207_100000070787 [0,2,0,0,0,0|2,0,0]=4 6507 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Br 527a_200010212207_100103153847 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)C 11a_100000691575_100015343762 [0,2,0,0,0,0|2,0,0]=4 6509 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)C 1626a_100000691575_100015343762 [0,2,0,0,0,0|2,0,0]=4 6510 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)C 22a_100000691575_100000070787 [0,2,0,0,0,0|2,0,0]=4 6511 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Cl 11a_100012356688_100015343762 [0,2,0,0,0,0|2,0,0]=4 6512 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Cl 1626a_100012356688_100015343762 [0,2,0,0,0,0|2,0,0]=4 6513 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)Cl 22a_100012356688_100000070787 [0,2,0,0,0,0|2,0,0]=4 6514 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F 11a_100000690247_100015343762 [0,2,0,0,0,0|2,0,0]=4 6515 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F 1626a_100000690247_100015343762 [0,2,0,0,0,0|2,0,0]=4 6516 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F 22a_100000690247_100000070787 [0,2,0,0,0,0|2,0,0]=4 6517 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)Br 11a_100010239588_100015343762 [0,2,0,0,0,0|2,0,0]=4 6518 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)Br 1626a_100010239588_100015343762 [0,2,0,0,0,0|2,0,0]=4 6519 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)Br 527a_100010239588_100103153847 [0,2,0,0,0,0|2,0,0]=4 6520 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)F 11a_100012002673_100015343762 [0,2,0,0,0,0|2,0,0]=4 6521 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)F 1626a_100012002673_100015343762 [0,2,0,0,0,0|2,0,0]=4 6522 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)F 22a_100012002673_100000070787 [0,2,0,0,0,0|2,0,0]=4 6523 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 11a_100011014115_100015343762 [0,2,0,0,0,0|2,0,0]=4 6524 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 1626a_100011014115_100015343762 [0,2,0,0,0,0|2,0,0]=4 6525 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 22a_100011014115_100000070787 [0,2,0,0,0,0|2,0,0]=4 6526 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)I 527a_100011014115_100103153847 [0,2,0,0,0,0|2,0,0]=4 6527 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)O 22a_100000117193_100000070787 [0,2,0,0,0,0|1,0,0]=3 6528 B13R1.876 CC(=O)Nc1cc(c(cc1F)C)O 527a_100000117193_100103153847 [0,2,0,0,0,0|1,0,0]=3 6529 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Br 11a_100013023876_100015343762 [0,2,0,0,0,0|2,0,0]=4 6530 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Br 1626a_100013023876_100015343762 [0,2,0,0,0,0|2,0,0]=4 6531 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)C 11a_100000091823_100015343762 [0,2,0,0,0,0|2,0,0]=4 6532 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)C 1626a_100000091823_100015343762 [0,2,0,0,0,0|2,0,0]=4 6533 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)C 22a_100000091823_100000070787 [0,2,0,0,0,0|2,0,0]=4 6534 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Cl 11a_100000724578_100015343762 [0,2,0,0,0,0|2,0,0]=4 6535 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)Cl 1626a_100000724578_100015343762 [0,2,0,0,0,0|2,0,0]=4 6536 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)F 11a_100011998097_100015343762 [0,2,0,0,0,0|2,0,0]=4 6537 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)F 1626a_100011998097_100015343762 [0,2,0,0,0,0|2,0,0]=4 6538 B13R1.876 CC(=O)Nc1cc(c(cc1F)Cl)O 22a_100000042052_100000070787 [0,2,0,0,0,0|1,0,0]=3 6539 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Br 11a_100000700208_100015343762 [0,2,0,0,0,0|2,0,0]=4 6540 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Br 1626a_100000700208_100015343762 [0,2,0,0,0,0|2,0,0]=4 6541 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Br 22a_100000700208_100000070787 [0,2,0,0,0,0|2,0,0]=4 6542 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Cl 11a_100011998096_100015343762 [0,2,0,0,0,0|2,0,0]=4 6543 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Cl 1626a_100011998096_100015343762 [0,2,0,0,0,0|2,0,0]=4 6544 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)Cl 22a_100011998096_100000070787 [0,2,0,0,0,0|2,0,0]=4 6545 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)F 11a_100000750162_100015343762 [0,2,0,0,0,0|2,0,0]=4 6546 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)F 1626a_100000750162_100015343762 [0,2,0,0,0,0|2,0,0]=4 6547 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)F 22a_100000750162_100000070787 [0,2,0,0,0,0|2,0,0]=4 6548 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)O 22a_100011219470_100000070787 [0,2,0,0,0,0|1,0,0]=3 6549 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)O 271570a_203496583355_200013902858 [0,2,0,0,0,0|1,0,0]=3 6550 B13R1.876 CC(=O)Nc1cc(c(cc1F)F)O 527a_100011219470_100103153847 [0,2,0,0,0,0|1,0,0]=3 6551 B13R1.876 CC(=O)Nc1cc(c(cc1F)I)F 11a_100010185194_100015343762 [0,2,0,0,0,0|2,0,0]=4 6552 B13R1.876 CC(=O)Nc1cc(c(cc1F)I)F 1626a_100010185194_100015343762 [0,2,0,0,0,0|2,0,0]=4 6553 B13R1.876 CC(=O)Nc1cc(c(cc1F)O)F 22a_100020635945_100000070787 [0,2,0,0,0,0|2,0,0]=4 6554 B13R1.876 CC(=O)Nc1cc(c(cc1F)O)F 271570a_203496583355_200012359909 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.876 CC(=O)Nc1cc(c(cc1F)O)F 527a_100020635945_100103153847 [0,2,0,0,0,0|2,0,0]=4 6556 B13R1.876 CC(=O)Nc1cc(c(cc1I)Br)F 11a_100010888672_100015343762 [0,2,0,0,0,0|2,0,0]=4 6557 B13R1.876 CC(=O)Nc1cc(c(cc1I)Br)F 1626a_100010888672_100015343762 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)Br 11a_200015600912_100015343762 [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)Br 1626a_200015600912_100015343762 [0,2,0,0,0,0|2,0,0]=4 6560 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)C 11a_100012353678_100015343762 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)C 1626a_100012353678_100015343762 [0,2,0,0,0,0|2,0,0]=4 6562 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)Cl 11a_200011093942_100015343762 [0,2,0,0,0,0|2,0,0]=4 6563 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)Cl 1626a_200011093942_100015343762 [0,2,0,0,0,0|2,0,0]=4 6564 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)F 11a_100010892166_100015343762 [0,2,0,0,0,0|2,0,0]=4 6565 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)F 1626a_100010892166_100015343762 [0,2,0,0,0,0|2,0,0]=4 6566 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Br 11a_200021016574_100015343762 [0,2,0,0,0,0|2,0,0]=4 6567 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Br 1626a_200021016574_100015343762 [0,2,0,0,0,0|2,0,0]=4 6568 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)C 11a_100010238302_100015343762 [0,2,0,0,0,0|2,0,0]=4 6569 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)C 1626a_100010238302_100015343762 [0,2,0,0,0,0|2,0,0]=4 6570 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Cl 11a_200010992381_100015343762 [0,2,0,0,0,0|2,0,0]=4 6571 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)Cl 1626a_200010992381_100015343762 [0,2,0,0,0,0|2,0,0]=4 6572 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)F 11a_100000765032_100015343762 [0,2,0,0,0,0|2,0,0]=4 6573 B13R1.876 CC(=O)Nc1cc(c(cc1I)F)F 1626a_100000765032_100015343762 [0,2,0,0,0,0|2,0,0]=4 6574 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)Br 22a_200010781931_100000070787 [0,2,0,0,0,0|2,0,0]=4 6575 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)Br 527a_200010781931_100103153847 [0,2,0,0,0,0|2,0,0]=4 6576 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)C 22a_200010107346_100000070787 [0,2,0,0,0,0|2,0,0]=4 6577 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)C 527a_200010107346_100103153847 [0,2,0,0,0,0|2,0,0]=4 6578 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)F 22a_100013038943_100000070787 [0,2,0,0,0,0|2,0,0]=4 6579 B13R1.876 CC(=O)Nc1cc(c(cc1O)Br)F 527a_100013038943_100103153847 [0,2,0,0,0,0|2,0,0]=4 6580 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Br 22a_200010235796_100000070787 [0,2,0,0,0,0|2,0,0]=4 6581 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Br 527a_200010235796_100103153847 [0,2,0,0,0,0|2,0,0]=4 6582 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)C 22a_100133014134_100000070787 [0,2,0,0,0,0|2,0,0]=4 6583 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)C 271570a_203496583355_100010006330 [0,2,0,0,0,0|2,0,0]=4 6584 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)C 527a_100133014134_100103153847 [0,2,0,0,0,0|2,0,0]=4 6585 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Cl 22a_100000091707_100000070787 [0,2,0,0,0,0|2,0,0]=4 6586 B13R1.876 CC(=O)Nc1cc(c(cc1O)C)Cl 527a_100000091707_100103153847 [0,2,0,0,0,0|2,0,0]=4 6587 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Br 22a_100013488937_100000070787 [0,2,0,0,0,0|2,0,0]=4 6588 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Br 527a_100013488937_100103153847 [0,2,0,0,0,0|2,0,0]=4 6589 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Cl 22a_100000696747_100000070787 [0,2,0,0,0,0|2,0,0]=4 6590 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Cl 527a_100000696747_100103153847 [0,2,0,0,0,0|2,0,0]=4 6591 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)I 22a_100011011175_100000070787 [0,2,0,0,0,0|2,0,0]=4 6592 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)I 527a_100011011175_100103153847 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)Br 22a_100012359894_100000070787 [0,2,0,0,0,0|2,0,0]=4 6594 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)Br 527a_100012359894_100103153847 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)C 22a_100012022779_100000070787 [0,2,0,0,0,0|2,0,0]=4 6596 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)C 527a_100012022779_100103153847 [0,2,0,0,0,0|2,0,0]=4 6597 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F 22a_106722365970_100000070787 [0,2,0,0,0,0|2,0,0]=4 6598 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F 271570a_203496583355_100010198355 [0,2,0,0,0,0|2,0,0]=4 6599 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F 527a_106722365970_100103153847 [0,2,0,0,0,0|2,0,0]=4 6600 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Br)F)F 1458a_100009828490_200025704644 [0,2,0,0,0,0|2,0,0]=4 6601 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Cl)Cl)F 1458a_100011219564_200025704644 [0,2,0,0,0,0|2,0,0]=4 6602 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1Cl)F)F 1458a_100000062174_200025704644 [0,2,0,0,0,0|2,0,0]=4 6603 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)Br)F 1458a_100010245136_200025704644 [0,2,0,0,0,0|2,0,0]=4 6604 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)F)Cl 1458a_100010154639_200025704644 [0,2,0,0,0,0|2,0,0]=4 6605 B13R1.876 [13CH3]C(=O)Cc1cc(c(cc1F)F)F 1458a_100000690282_200025704644 [0,2,0,0,0,0|2,0,0]=4 6606 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000185746 [0,2,0,0,0,0|1,0,1]=4 6607 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000185746 [0,2,0,0,0,0|1,0,1]=4 6608 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000185746 [0,2,0,0,0,0|1,0,1]=4 6609 B13R1.2879 C=CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000185746 [0,2,0,0,0,0|1,0,1]=4 6610 B13R1.2879 CC(=Cc1ccc(c(c1)O)Cl)C#N 6a_100009876013_200000212204 [0,2,0,0,0,0|2,0,0]=4 6611 B13R1.2879 CC(=Cc1ccc(c(c1)O)F)C#N 6a_100000102368_200000212204 [0,2,0,0,0,0|2,0,0]=4 6612 B13R1.2879 CC(=Cc1ccc(c(c1)O)I)C#N 6a_100000041418_200000212204 [0,2,0,0,0,0|2,0,0]=4 6613 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Br 1458a_100000210414_100012353900 [0,2,0,0,0,0|2,0,0]=4 6614 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000210414_100012232412 [0,2,0,0,0,0|2,0,0]=4 6615 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)C 1458a_100000709925_100000210202 [0,2,0,0,0,0|2,0,0]=4 6616 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100000210414_100012353894 [0,2,0,0,0,0|2,0,0]=4 6617 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100000210202 [0,2,0,0,0,0|2,0,0]=4 6618 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000210414_100011206884 [0,2,0,0,0,0|2,0,0]=4 6619 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)F 1458a_100000742997_100000210202 [0,2,0,0,0,0|2,0,0]=4 6620 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210202 [0,2,0,0,0,0|2,0,0]=4 6621 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100000210414_100000727479 [0,2,0,0,0,0|2,0,0]=4 6622 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_100000210202 [0,2,0,0,0,0|2,0,0]=4 6623 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_100000210202 [0,2,0,0,0,0|2,0,0]=4 6624 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)C 1458a_100000210414_100000742320 [0,2,0,0,0,0|2,0,0]=4 6625 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000210414_100012184735 [0,2,0,0,0,0|2,0,0]=4 6626 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100000210414_100011216667 [0,2,0,0,0,0|2,0,0]=4 6627 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_100000210202 [0,2,0,0,0,0|2,0,0]=4 6628 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [0,2,0,0,0,0|2,0,0]=4 6629 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000210414_100012353895 [0,2,0,0,0,0|2,0,0]=4 6630 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100000210202 [0,2,0,0,0,0|2,0,0]=4 6631 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)C 1458a_100000210414_100011823929 [0,2,0,0,0,0|2,0,0]=4 6632 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210414_100000184707 [0,2,0,0,0,0|2,0,0]=4 6633 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100000210202 [0,2,0,0,0,0|2,0,0]=4 6634 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100000210414_100000717365 [0,2,0,0,0,0|2,0,0]=4 6635 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100000210202 [0,2,0,0,0,0|2,0,0]=4 6636 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)I 1458a_100000210414_100012349665 [0,2,0,0,0,0|2,0,0]=4 6637 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210202 [0,2,0,0,0,0|2,0,0]=4 6638 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000210414_100000767054 [0,2,0,0,0,0|2,0,0]=4 6639 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Br 1458a_100000691132_100000210202 [0,2,0,0,0,0|2,0,0]=4 6640 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100000210414_100011217369 [0,2,0,0,0,0|2,0,0]=4 6641 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)C 1458a_100011217375_100000210202 [0,2,0,0,0,0|2,0,0]=4 6642 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000210414_100000716492 [0,2,0,0,0,0|2,0,0]=4 6643 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100000210202 [0,2,0,0,0,0|2,0,0]=4 6644 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000210414_100000757363 [0,2,0,0,0,0|2,0,0]=4 6645 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)F 1458a_100000684721_100000210202 [0,2,0,0,0,0|2,0,0]=4 6646 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100000210414_100010149604 [0,2,0,0,0,0|2,0,0]=4 6647 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)I 1458a_100010149632_100000210202 [0,2,0,0,0,0|2,0,0]=4 6648 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210202 [0,2,0,0,0,0|2,0,0]=4 6649 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)Br 1458a_100000210414_100010146616 [0,2,0,0,0,0|2,0,0]=4 6650 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)C 1458a_100000210414_100010206137 [0,2,0,0,0,0|2,0,0]=4 6651 B13R1.2879 CCC(=O)Cc1ccc(c(c1)I)F 1458a_100000210414_100010188208 [0,2,0,0,0,0|2,0,0]=4 6652 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210202 [0,2,0,0,0,0|1,0,0]=3 6653 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [0,2,0,0,0,0|1,0,0]=3 6654 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 11a_100011306057_100000210414 [0,2,0,0,0,0|2,0,0]=4 6655 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 1626a_100011306057_100000210414 [0,2,0,0,0,0|2,0,0]=4 6656 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000210414 [0,2,0,0,0,0|2,0,0]=4 6657 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Br 527a_100011306057_100000210414 [0,2,0,0,0,0|2,0,0]=4 6658 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 11a_100000736455_100000210414 [0,2,0,0,0,0|2,0,0]=4 6659 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 1626a_100000736455_100000210414 [0,2,0,0,0,0|2,0,0]=4 6660 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 22a_100000736455_100000210414 [0,2,0,0,0,0|2,0,0]=4 6661 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)C 527a_100000736455_100000210414 [0,2,0,0,0,0|2,0,0]=4 6662 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 11a_100000686031_100000210414 [0,2,0,0,0,0|2,0,0]=4 6663 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 1626a_100000686031_100000210414 [0,2,0,0,0,0|2,0,0]=4 6664 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000210414 [0,2,0,0,0,0|2,0,0]=4 6665 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000210414 [0,2,0,0,0,0|2,0,0]=4 6666 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 11a_100000760356_100000210414 [0,2,0,0,0,0|2,0,0]=4 6667 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 1626a_100000760356_100000210414 [0,2,0,0,0,0|2,0,0]=4 6668 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 22a_100000760356_100000210414 [0,2,0,0,0,0|2,0,0]=4 6669 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)F 527a_100000760356_100000210414 [0,2,0,0,0,0|2,0,0]=4 6670 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 11a_100000750458_100000210414 [0,2,0,0,0,0|2,0,0]=4 6671 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 1626a_100000750458_100000210414 [0,2,0,0,0,0|2,0,0]=4 6672 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 22a_100000750458_100000210414 [0,2,0,0,0,0|2,0,0]=4 6673 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)I 527a_100000750458_100000210414 [0,2,0,0,0,0|2,0,0]=4 6674 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210414 [0,2,0,0,0,0|2,0,0]=4 6675 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210414 [0,2,0,0,0,0|2,0,0]=4 6676 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 11a_100000210723_100000210414 [0,2,0,0,0,0|2,0,0]=4 6677 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 1626a_100000210723_100000210414 [0,2,0,0,0,0|2,0,0]=4 6678 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 22a_100000210723_100000210414 [0,2,0,0,0,0|2,0,0]=4 6679 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Br 527a_100000210723_100000210414 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 11a_100000724040_100000210414 [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 1626a_100000724040_100000210414 [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 22a_100000724040_100000210414 [0,2,0,0,0,0|2,0,0]=4 6683 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)C 527a_100000724040_100000210414 [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 11a_100000187808_100000210414 [0,2,0,0,0,0|2,0,0]=4 6685 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 1626a_100000187808_100000210414 [0,2,0,0,0,0|2,0,0]=4 6686 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 22a_100000187808_100000210414 [0,2,0,0,0,0|2,0,0]=4 6687 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)Cl 527a_100000187808_100000210414 [0,2,0,0,0,0|2,0,0]=4 6688 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 11a_100000750164_100000210414 [0,2,0,0,0,0|2,0,0]=4 6689 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 1626a_100000750164_100000210414 [0,2,0,0,0,0|2,0,0]=4 6690 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 22a_100000750164_100000210414 [0,2,0,0,0,0|2,0,0]=4 6691 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)F 527a_100000750164_100000210414 [0,2,0,0,0,0|2,0,0]=4 6692 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 11a_100000198070_100000210414 [0,2,0,0,0,0|2,0,0]=4 6693 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 1626a_100000198070_100000210414 [0,2,0,0,0,0|2,0,0]=4 6694 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 22a_100000198070_100000210414 [0,2,0,0,0,0|2,0,0]=4 6695 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)I 527a_100000198070_100000210414 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100000210414 [0,2,0,0,0,0|2,0,0]=4 6697 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000210414 [0,2,0,0,0,0|2,0,0]=4 6698 B13R1.2879 CCC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100000210414 [0,2,0,0,0,0|2,0,0]=4 6699 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 11a_100000687081_100000210414 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 1626a_100000687081_100000210414 [0,2,0,0,0,0|2,0,0]=4 6701 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000210414 [0,2,0,0,0,0|2,0,0]=4 6702 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100000210414 [0,2,0,0,0,0|2,0,0]=4 6703 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 11a_100000188892_100000210414 [0,2,0,0,0,0|2,0,0]=4 6704 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 1626a_100000188892_100000210414 [0,2,0,0,0,0|2,0,0]=4 6705 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 22a_100000188892_100000210414 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)C 527a_100000188892_100000210414 [0,2,0,0,0,0|2,0,0]=4 6707 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 11a_100000184108_100000210414 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 1626a_100000184108_100000210414 [0,2,0,0,0,0|2,0,0]=4 6709 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000210414 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000210414 [0,2,0,0,0,0|2,0,0]=4 6711 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 11a_100000211060_100000210414 [0,2,0,0,0,0|2,0,0]=4 6712 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 1626a_100000211060_100000210414 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000210414 [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)F 527a_100000211060_100000210414 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 11a_100000761885_100000210414 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 1626a_100000761885_100000210414 [0,2,0,0,0,0|2,0,0]=4 6717 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000210414 [0,2,0,0,0,0|2,0,0]=4 6718 B13R1.2879 CCC(=O)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210414 [0,2,0,0,0,0|2,0,0]=4 6719 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 11a_100000759894_100000210414 [0,2,0,0,0,0|2,0,0]=4 6720 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 1626a_100000759894_100000210414 [0,2,0,0,0,0|2,0,0]=4 6721 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 22a_100000759894_100000210414 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Br 527a_100000759894_100000210414 [0,2,0,0,0,0|2,0,0]=4 6723 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 11a_100000210958_100000210414 [0,2,0,0,0,0|2,0,0]=4 6724 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 1626a_100000210958_100000210414 [0,2,0,0,0,0|2,0,0]=4 6725 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 22a_100000210958_100000210414 [0,2,0,0,0,0|2,0,0]=4 6726 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)C 527a_100000210958_100000210414 [0,2,0,0,0,0|2,0,0]=4 6727 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 11a_100000739366_100000210414 [0,2,0,0,0,0|2,0,0]=4 6728 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 1626a_100000739366_100000210414 [0,2,0,0,0,0|2,0,0]=4 6729 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000210414 [0,2,0,0,0,0|2,0,0]=4 6730 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 11a_100000210724_100000210414 [0,2,0,0,0,0|2,0,0]=4 6731 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 1626a_100000210724_100000210414 [0,2,0,0,0,0|2,0,0]=4 6732 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)F 22a_100000210724_100000210414 [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 11a_100011356925_100000210414 [0,2,0,0,0,0|2,0,0]=4 6734 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 1626a_100011356925_100000210414 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)I 22a_100011356925_100000210414 [0,2,0,0,0,0|2,0,0]=4 6736 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)O 22a_100011220035_100000210414 [0,2,0,0,0,0|2,0,0]=4 6737 B13R1.2879 CCC(=O)Nc1ccc(c(c1)F)O 527a_100011220035_100000210414 [0,2,0,0,0,0|2,0,0]=4 6738 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 11a_100000750459_100000210414 [0,2,0,0,0,0|2,0,0]=4 6739 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 1626a_100000750459_100000210414 [0,2,0,0,0,0|2,0,0]=4 6740 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 22a_100000750459_100000210414 [0,2,0,0,0,0|2,0,0]=4 6741 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Br 527a_100000750459_100000210414 [0,2,0,0,0,0|2,0,0]=4 6742 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 11a_100000184131_100000210414 [0,2,0,0,0,0|2,0,0]=4 6743 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 1626a_100000184131_100000210414 [0,2,0,0,0,0|2,0,0]=4 6744 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 22a_100000184131_100000210414 [0,2,0,0,0,0|2,0,0]=4 6745 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)C 527a_100000184131_100000210414 [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 11a_100012360549_100000210414 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 1626a_100012360549_100000210414 [0,2,0,0,0,0|2,0,0]=4 6748 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000210414 [0,2,0,0,0,0|2,0,0]=4 6749 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000210414 [0,2,0,0,0,0|2,0,0]=4 6750 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 11a_114828291077_100000210414 [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 1626a_114828291077_100000210414 [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 22a_114828291077_100000210414 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.2879 CCC(=O)Nc1ccc(c(c1)I)F 527a_114828291077_100000210414 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000210414 [0,2,0,0,0,0|1,0,0]=3 6755 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000210414 [0,2,0,0,0,0|1,0,0]=3 6756 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)C 527a_100000759471_100000210414 [0,2,0,0,0,0|1,0,0]=3 6757 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210414 [0,2,0,0,0,0|1,0,0]=3 6758 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000210414 [0,2,0,0,0,0|1,0,0]=3 6759 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)F 527a_100012017398_100000210414 [0,2,0,0,0,0|1,0,0]=3 6760 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210414 [0,2,0,0,0,0|1,0,0]=3 6761 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210414 [0,2,0,0,0,0|1,0,0]=3 6762 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 11a_106832991635_100000709925 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 240690a_100102657272_100000709925 [0,2,0,0,0,0|2,0,0]=4 6764 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 527a_100102657272_100000709925 [0,2,0,0,0,0|2,0,0]=4 6765 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 11a_106832991635_100012349508 [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100102657272_100012349508 [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100102657272_100012349508 [0,2,0,0,0,0|2,0,0]=4 6768 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 11a_106832991635_100000742997 [0,2,0,0,0,0|2,0,0]=4 6769 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 240690a_100102657272_100000742997 [0,2,0,0,0,0|2,0,0]=4 6770 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 527a_100102657272_100000742997 [0,2,0,0,0,0|2,0,0]=4 6771 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 240690a_100102657272_100009990404 [0,2,0,0,0,0|2,0,0]=4 6772 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 527a_100102657272_100009990404 [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 11a_106832991635_100012340274 [0,2,0,0,0,0|2,0,0]=4 6774 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 240690a_100102657272_100012340274 [0,2,0,0,0,0|2,0,0]=4 6775 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 527a_100102657272_100012340274 [0,2,0,0,0,0|2,0,0]=4 6776 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 11a_106832991635_100000184070 [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 240690a_100102657272_100000184070 [0,2,0,0,0,0|2,0,0]=4 6778 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 527a_100102657272_100000184070 [0,2,0,0,0,0|2,0,0]=4 6779 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 11a_106832991635_100011667458 [0,2,0,0,0,0|2,0,0]=4 6780 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 240690a_100102657272_100011667458 [0,2,0,0,0,0|2,0,0]=4 6781 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 527a_100102657272_100011667458 [0,2,0,0,0,0|2,0,0]=4 6782 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [0,2,0,0,0,0|2,0,0]=4 6783 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [0,2,0,0,0,0|2,0,0]=4 6784 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 11a_106832991635_100000766880 [0,2,0,0,0,0|2,0,0]=4 6785 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100102657272_100000766880 [0,2,0,0,0,0|2,0,0]=4 6786 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100102657272_100000766880 [0,2,0,0,0,0|2,0,0]=4 6787 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_106832991635_100000210702 [0,2,0,0,0,0|2,0,0]=4 6788 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210702 [0,2,0,0,0,0|2,0,0]=4 6789 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100102657272_100000210702 [0,2,0,0,0,0|2,0,0]=4 6790 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 11a_106832991635_100011217296 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100102657272_100011217296 [0,2,0,0,0,0|2,0,0]=4 6792 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100102657272_100011217296 [0,2,0,0,0,0|2,0,0]=4 6793 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 527a_100102657272_100011217296 [0,2,0,0,0,0|2,0,0]=4 6794 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100102657272_100000035197 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 527a_100102657272_100000035197 [0,2,0,0,0,0|2,0,0]=4 6796 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 11a_106832991635_100000691132 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 240690a_100102657272_100000691132 [0,2,0,0,0,0|2,0,0]=4 6798 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 527a_100102657272_100000691132 [0,2,0,0,0,0|2,0,0]=4 6799 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 11a_106832991635_100011217375 [0,2,0,0,0,0|2,0,0]=4 6800 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 240690a_100102657272_100011217375 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 527a_100102657272_100011217375 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 11a_106832991635_100000722404 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100102657272_100000722404 [0,2,0,0,0,0|2,0,0]=4 6804 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 527a_100102657272_100000722404 [0,2,0,0,0,0|2,0,0]=4 6805 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 11a_106832991635_100000684721 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 1626a_100102657272_100000684721 [0,2,0,0,0,0|2,0,0]=4 6807 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 240690a_100102657272_100000684721 [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 527a_100102657272_100000684721 [0,2,0,0,0,0|2,0,0]=4 6809 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 11a_106832991635_100010149632 [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 1626a_100102657272_100010149632 [0,2,0,0,0,0|2,0,0]=4 6811 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 240690a_100102657272_100010149632 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 527a_100102657272_100010149632 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 240690a_100102657272_100000039761 [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 527a_100102657272_100000039761 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 11a_106832991635_100000082272 [0,2,0,0,0,0|1,0,0]=3 6816 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 240690a_100102657272_100000082272 [0,2,0,0,0,0|1,0,0]=3 6817 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 527a_100102657272_100000082272 [0,2,0,0,0,0|1,0,0]=3 6818 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [0,2,0,0,0,0|1,0,0]=3 6819 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)Br 2430a_100011306057_100102657272 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)C 2430a_100000736455_100102657272 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)Cl 2430a_100000686031_100102657272 [0,2,0,0,0,0|2,0,0]=4 6822 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)F 2430a_100000760356_100102657272 [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)I 2430a_100000750458_100102657272 [0,2,0,0,0,0|2,0,0]=4 6824 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100102657272 [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Br 2430a_100000210723_100102657272 [0,2,0,0,0,0|2,0,0]=4 6826 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)C 2430a_100000724040_100102657272 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)Cl 2430a_100000187808_100102657272 [0,2,0,0,0,0|2,0,0]=4 6828 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)F 2430a_100000750164_100102657272 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)I 2430a_100000198070_100102657272 [0,2,0,0,0,0|2,0,0]=4 6830 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100102657272 [0,2,0,0,0,0|2,0,0]=4 6831 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)Br 2430a_100000687081_100102657272 [0,2,0,0,0,0|2,0,0]=4 6832 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)C 2430a_100000188892_100102657272 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)Cl 2430a_100000184108_100102657272 [0,2,0,0,0,0|2,0,0]=4 6834 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)F 2430a_100000211060_100102657272 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)I 2430a_100000761885_100102657272 [0,2,0,0,0,0|2,0,0]=4 6836 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100102657272 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Br 2430a_100000759894_100102657272 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)C 2430a_100000210958_100102657272 [0,2,0,0,0,0|2,0,0]=4 6839 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)Cl 2430a_100000739366_100102657272 [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)F 2430a_100000210724_100102657272 [0,2,0,0,0,0|2,0,0]=4 6841 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)I 2430a_100011356925_100102657272 [0,2,0,0,0,0|2,0,0]=4 6842 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100102657272 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)Br 2430a_100000750459_100102657272 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)C 2430a_100000184131_100102657272 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)Cl 2430a_100012360549_100102657272 [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)F 2430a_114828291077_100102657272 [0,2,0,0,0,0|2,0,0]=4 6847 B13R1.2879 CNC(=O)Nc1ccc(c(c1)I)F 512a_114828291077_100102657272 [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100102657272 [0,2,0,0,0,0|1,0,0]=3 6849 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100102657272 [0,2,0,0,0,0|1,0,0]=3 6850 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100102657272 [0,2,0,0,0,0|1,0,0]=3 6851 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100102657272 [0,2,0,0,0,0|1,0,0]=3 6852 B13R1.2879 COC(=O)Cc1cc(c(cn1)C)O 271570a_203496583355_100015669916 [0,2,0,0,0,0|2,0,0]=4 6853 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)O 271570a_203496583355_100010371902 [0,2,0,0,0,0|2,0,0]=4 6854 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)F 271570a_203496583355_100011435807 [0,2,0,0,0,0|1,0,0]=3 6855 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [0,2,0,0,0,0|1,0,0]=3 6856 B13R1.2879 COC(=O)Nc1ccc(c(c1)N)O 271570a_203496583355_100012639261 [0,2,0,0,0,0|2,0,0]=4 6857 B13R1.2879 Cc1cc(ccc1Br)CC(=O)CF 1458a_100012340274_100015361967 [0,2,0,0,0,0|2,0,0]=4 6858 B13R1.2879 Cc1cc(ccc1Br)CC(=O)CO 1458a_100000210174_100000727479 [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.2879 Cc1cc(ccc1Br)NC(=O)CO 22a_100000210723_100000210174 [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.2879 Cc1cc(ccc1Br)NC(=O)CO 527a_100000210723_100000210174 [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.2879 Cc1cc(ccc1Cl)CC(=O)CO 1458a_100000210174_100012184735 [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.2879 Cc1cc(ccc1Cl)NC(=O)CO 22a_100000187808_100000210174 [0,2,0,0,0,0|2,0,0]=4 6863 B13R1.2879 Cc1cc(ccc1Cl)NC(=O)CO 527a_100000187808_100000210174 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.2879 Cc1cc(ccc1F)CC(=O)CF 1458a_100011667458_100015361967 [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.2879 Cc1cc(ccc1F)CC(=O)CO 1458a_100000210174_100011216667 [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.2879 Cc1cc(ccc1F)NC(=O)CO 22a_100000750164_100000210174 [0,2,0,0,0,0|2,0,0]=4 6867 B13R1.2879 Cc1cc(ccc1F)NC(=O)CO 527a_100000750164_100000210174 [0,2,0,0,0,0|2,0,0]=4 6868 B13R1.2879 Cc1cc(ccc1I)NC(=O)CO 22a_100000198070_100000210174 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.2879 Cc1cc(ccc1I)NC(=O)CO 527a_100000198070_100000210174 [0,2,0,0,0,0|2,0,0]=4 6870 B13R1.2879 Cc1cc(ccc1O)CC(=O)CF 1458a_100000083968_100015361967 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.2879 Cc1cc(ccc1O)NC(=O)CO 22a_100011218179_100000210174 [0,2,0,0,0,0|2,0,0]=4 6872 B13R1.2879 Cc1cc(ccc1O)NC(=O)CO 527a_100011218179_100000210174 [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.2879 Cc1ccc(cc1Br)CC(=O)CF 1458a_100000709925_100015361967 [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.2879 Cc1ccc(cc1Br)CC(=O)CO 1458a_100000210174_100012232412 [0,2,0,0,0,0|2,0,0]=4 6875 B13R1.2879 Cc1ccc(cc1Br)NC(=O)CO 22a_100000736455_100000210174 [0,2,0,0,0,0|2,0,0]=4 6876 B13R1.2879 Cc1ccc(cc1Br)NC(=O)CO 527a_100000736455_100000210174 [0,2,0,0,0,0|2,0,0]=4 6877 B13R1.2879 Cc1ccc(cc1C)CC(=O)CF 1458a_100000184070_100015361967 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.2879 Cc1ccc(cc1C)CC(=O)CO 1458a_100000210174_100000742320 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.2879 Cc1ccc(cc1C)NC(=O)CO 22a_100000724040_100000210174 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.2879 Cc1ccc(cc1C)NC(=O)CO 527a_100000724040_100000210174 [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.2879 Cc1ccc(cc1Cl)CC(=O)CO 1458a_100000210174_100011823929 [0,2,0,0,0,0|2,0,0]=4 6882 B13R1.2879 Cc1ccc(cc1Cl)NC(=O)CO 22a_100000188892_100000210174 [0,2,0,0,0,0|2,0,0]=4 6883 B13R1.2879 Cc1ccc(cc1Cl)NC(=O)CO 527a_100000188892_100000210174 [0,2,0,0,0,0|2,0,0]=4 6884 B13R1.2879 Cc1ccc(cc1F)CC(=O)CF 1458a_100011217375_100015361967 [0,2,0,0,0,0|2,0,0]=4 6885 B13R1.2879 Cc1ccc(cc1F)CC(=O)CO 1458a_100000210174_100011217369 [0,2,0,0,0,0|2,0,0]=4 6886 B13R1.2879 Cc1ccc(cc1F)NC(=O)CO 22a_100000210958_100000210174 [0,2,0,0,0,0|2,0,0]=4 6887 B13R1.2879 Cc1ccc(cc1F)NC(=O)CO 527a_100000210958_100000210174 [0,2,0,0,0,0|2,0,0]=4 6888 B13R1.2879 Cc1ccc(cc1I)CC(=O)CO 1458a_100000210174_100010206137 [0,2,0,0,0,0|2,0,0]=4 6889 B13R1.2879 Cc1ccc(cc1I)NC(=O)CO 22a_100000184131_100000210174 [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.2879 Cc1ccc(cc1I)NC(=O)CO 527a_100000184131_100000210174 [0,2,0,0,0,0|2,0,0]=4 6891 B13R1.2879 Cc1ccc(cc1O)CC(=O)CF 1458a_100000082272_100015361967 [0,2,0,0,0,0|1,0,0]=3 6892 B13R1.2879 Cc1ccc(cc1O)NC(=O)CO 22a_100000759471_100000210174 [0,2,0,0,0,0|1,0,0]=3 6893 B13R1.2879 Cc1ccc(cc1O)NC(=O)CO 527a_100000759471_100000210174 [0,2,0,0,0,0|1,0,0]=3 6894 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)Cl 1458a_100012349508_100015361967 [0,2,0,0,0,0|2,0,0]=4 6895 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)F 1458a_100000742997_100015361967 [0,2,0,0,0,0|2,0,0]=4 6896 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Br)O 1458a_100009990404_100015361967 [0,2,0,0,0,0|2,0,0]=4 6897 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)Br 1458a_100000766880_100015361967 [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)Cl 1458a_100000210702_100015361967 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)F 1458a_100011217296_100015361967 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.2879 O=C(CF)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100015361967 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)Br 1458a_100000691132_100015361967 [0,2,0,0,0,0|2,0,0]=4 6902 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)Cl 1458a_100000722404_100015361967 [0,2,0,0,0,0|2,0,0]=4 6903 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)F 1458a_100000684721_100015361967 [0,2,0,0,0,0|2,0,0]=4 6904 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)I 1458a_100010149632_100015361967 [0,2,0,0,0,0|2,0,0]=4 6905 B13R1.2879 O=C(CF)Cc1ccc(c(c1)F)O 1458a_100000039761_100015361967 [0,2,0,0,0,0|2,0,0]=4 6906 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [0,2,0,0,0,0|1,0,0]=3 6907 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)Br 1458a_100000210174_100012353900 [0,2,0,0,0,0|2,0,0]=4 6908 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)Cl 1458a_100000210174_100012353894 [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Br)F 1458a_100000210174_100011206884 [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)Br 1458a_100000210174_100012353895 [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)Cl 1458a_100000210174_100000184707 [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)F 1458a_100000210174_100000717365 [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.2879 O=C(CO)Cc1ccc(c(c1)Cl)I 1458a_100000210174_100012349665 [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)Br 1458a_100000210174_100000767054 [0,2,0,0,0,0|2,0,0]=4 6915 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)Cl 1458a_100000210174_100000716492 [0,2,0,0,0,0|2,0,0]=4 6916 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)F 1458a_100000210174_100000757363 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.2879 O=C(CO)Cc1ccc(c(c1)F)I 1458a_100000210174_100010149604 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.2879 O=C(CO)Cc1ccc(c(c1)I)Br 1458a_100000210174_100010146616 [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.2879 O=C(CO)Cc1ccc(c(c1)I)F 1458a_100000210174_100010188208 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)Br 22a_100011306057_100000210174 [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)Br 527a_100011306057_100000210174 [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)Cl 22a_100000686031_100000210174 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)Cl 527a_100000686031_100000210174 [0,2,0,0,0,0|2,0,0]=4 6924 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)F 22a_100000760356_100000210174 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)F 527a_100000760356_100000210174 [0,2,0,0,0,0|2,0,0]=4 6926 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)I 22a_100000750458_100000210174 [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)I 527a_100000750458_100000210174 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)O 22a_100011534360_100000210174 [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Br)O 527a_100011534360_100000210174 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)Br 22a_100000687081_100000210174 [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)Br 527a_100000687081_100000210174 [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)Cl 22a_100000184108_100000210174 [0,2,0,0,0,0|2,0,0]=4 6933 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)Cl 527a_100000184108_100000210174 [0,2,0,0,0,0|2,0,0]=4 6934 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)F 22a_100000211060_100000210174 [0,2,0,0,0,0|2,0,0]=4 6935 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)F 527a_100000211060_100000210174 [0,2,0,0,0,0|2,0,0]=4 6936 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)I 22a_100000761885_100000210174 [0,2,0,0,0,0|2,0,0]=4 6937 B13R1.2879 O=C(CO)Nc1ccc(c(c1)Cl)O 22a_100000744943_100000210174 [0,2,0,0,0,0|2,0,0]=4 6938 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)Br 22a_100000759894_100000210174 [0,2,0,0,0,0|2,0,0]=4 6939 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)Br 527a_100000759894_100000210174 [0,2,0,0,0,0|2,0,0]=4 6940 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)Cl 22a_100000739366_100000210174 [0,2,0,0,0,0|2,0,0]=4 6941 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)F 22a_100000210724_100000210174 [0,2,0,0,0,0|2,0,0]=4 6942 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)I 22a_100011356925_100000210174 [0,2,0,0,0,0|2,0,0]=4 6943 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)O 22a_100011220035_100000210174 [0,2,0,0,0,0|2,0,0]=4 6944 B13R1.2879 O=C(CO)Nc1ccc(c(c1)F)O 527a_100011220035_100000210174 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.2879 O=C(CO)Nc1ccc(c(c1)I)Br 22a_100000750459_100000210174 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.2879 O=C(CO)Nc1ccc(c(c1)I)Br 527a_100000750459_100000210174 [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.2879 O=C(CO)Nc1ccc(c(c1)I)Cl 22a_100012360549_100000210174 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.2879 O=C(CO)Nc1ccc(c(c1)I)Cl 527a_100012360549_100000210174 [0,2,0,0,0,0|2,0,0]=4 6949 B13R1.2879 O=C(CO)Nc1ccc(c(c1)I)F 22a_114828291077_100000210174 [0,2,0,0,0,0|2,0,0]=4 6950 B13R1.2879 O=C(CO)Nc1ccc(c(c1)I)F 527a_114828291077_100000210174 [0,2,0,0,0,0|2,0,0]=4 6951 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210174 [0,2,0,0,0,0|1,0,0]=3 6952 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)F 22a_100012017398_100000210174 [0,2,0,0,0,0|1,0,0]=3 6953 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)F 527a_100012017398_100000210174 [0,2,0,0,0,0|1,0,0]=3 6954 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)O 22a_100102946323_100000210174 [0,2,0,0,0,0|1,0,0]=3 6955 B13R1.2879 O=C(CO)Nc1ccc(c(c1)O)O 527a_100102946323_100000210174 [0,2,0,0,0,0|1,0,0]=3 6956 B13R1.3528 CC(=Cc1ccc(c(c1F)O)Br)C 271570a_100102525489_200010782288 [0,2,0,0,0,0|2,0,0]=4 6957 B13R1.3528 CC(=Cc1ccc(c(c1F)O)F)C 271570a_100102525489_100010167067 [0,2,0,0,0,0|2,0,0]=4 6958 B13R1.3528 CC(=Cc1ccc(c(c1N)O)Br)C 271570a_100102525489_100020748643 [0,2,0,0,0,0|2,0,0]=4 6959 B13R1.3528 CC(=O)Cc1ccc(c(c1Br)F)F 1458a_100000070787_100016216887 [0,2,0,0,0,0|2,0,0]=4 6960 B13R1.3528 CC(=O)Cc1ccc(c(c1Br)F)F 1458a_200015693364_200000210301 [0,2,0,0,0,0|2,0,0]=4 6961 B13R1.3528 CC(=O)Cc1ccc(c(c1Cl)F)F 1458a_200010154634_200000210301 [0,2,0,0,0,0|2,0,0]=4 6962 B13R1.3528 CC(=O)Cc1ccc(c(c1F)Cl)F 1458a_100000062224_200000210301 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.3528 CC(=O)Cc1ccc(c(c1F)Cl)F 1458a_100000070787_100009814552 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)C 1458a_100000070787_100009813564 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)C 1458a_100011217901_200000210301 [0,2,0,0,0,0|2,0,0]=4 6966 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)F 1458a_100000070787_100011218744 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.3528 CC(=O)Cc1ccc(c(c1F)F)F 1458a_100011217297_200000210301 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)Br)Br 11a_100010151465_100015343762 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)Br)Br 1626a_100010151465_100015343762 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)Cl)Cl 11a_100021501213_100015343762 [0,2,0,0,0,0|2,0,0]=4 6971 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)Cl)Cl 1626a_100021501213_100015343762 [0,2,0,0,0,0|2,0,0]=4 6972 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)F)F 11a_100010232473_100015343762 [0,2,0,0,0,0|2,0,0]=4 6973 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)F)F 1626a_100010232473_100015343762 [0,2,0,0,0,0|2,0,0]=4 6974 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)F)I 11a_100015781493_100015343762 [0,2,0,0,0,0|2,0,0]=4 6975 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)F)I 1626a_100015781493_100015343762 [0,2,0,0,0,0|2,0,0]=4 6976 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Br 11a_100010244494_100015343762 [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Br 1626a_100010244494_100015343762 [0,2,0,0,0,0|2,0,0]=4 6978 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Br 22a_100010244494_100000070787 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Br 527a_100010244494_100103153847 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)C 11a_106354213274_100015343762 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)C 1626a_106354213274_100015343762 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)C 22a_106354213274_100000070787 [0,2,0,0,0,0|2,0,0]=4 6983 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)C 527a_106354213274_100103153847 [0,2,0,0,0,0|2,0,0]=4 6984 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 11a_100016073598_100015343762 [0,2,0,0,0,0|2,0,0]=4 6985 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 1626a_100016073598_100015343762 [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 22a_100016073598_100000070787 [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)Cl 527a_100016073598_100103153847 [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)Br 11a_100009816967_100015343762 [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)Br 1626a_100009816967_100015343762 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)Br 22a_100009816967_100000070787 [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)Br 527a_100009816967_100103153847 [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)C 11a_100000116900_100015343762 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)C 1626a_100000116900_100015343762 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)C 22a_100000116900_100000070787 [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)F 11a_100000062172_100015343762 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)F 1626a_100000062172_100015343762 [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)F 22a_100000062172_100000070787 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)O 11a_200011216674_100015343762 [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)O 22a_200011216674_100000070787 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)O 527a_200011216674_100103153847 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Br 11a_100009816872_100015343762 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Br 1626a_100009816872_100015343762 [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Br 22a_100009816872_100000070787 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Br 527a_100009816872_100103153847 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)C 11a_100009954856_100015343762 [0,2,0,0,0,0|2,0,0]=4 7006 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)C 1626a_100009954856_100015343762 [0,2,0,0,0,0|2,0,0]=4 7007 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)C 22a_100009954856_100000070787 [0,2,0,0,0,0|2,0,0]=4 7008 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)C 527a_100009954856_100103153847 [0,2,0,0,0,0|2,0,0]=4 7009 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Cl 11a_114948340058_100015343762 [0,2,0,0,0,0|2,0,0]=4 7010 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Cl)Cl 1626a_114948340058_100015343762 [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)Br 11a_100010208198_100015343762 [0,2,0,0,0,0|2,0,0]=4 7012 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)Br 1626a_100010208198_100015343762 [0,2,0,0,0,0|2,0,0]=4 7013 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)Br 22a_100010208198_100000070787 [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)Br 527a_100010208198_100103153847 [0,2,0,0,0,0|2,0,0]=4 7015 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)I 11a_100010291050_100015343762 [0,2,0,0,0,0|2,0,0]=4 7016 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)I 1626a_100010291050_100015343762 [0,2,0,0,0,0|2,0,0]=4 7017 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)I 22a_100010291050_100000070787 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.3528 CC(=O)Nc1ccc(c(c1C)F)I 527a_100010291050_100103153847 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.3528 CC(=O)Nc1ccc(c(c1C)I)C 11a_100011170560_100015343762 [0,2,0,0,0,0|2,0,0]=4 7020 B13R1.3528 CC(=O)Nc1ccc(c(c1C)I)C 1626a_100011170560_100015343762 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.3528 CC(=O)Nc1ccc(c(c1C)I)C 22a_100011170560_100000070787 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.3528 CC(=O)Nc1ccc(c(c1C)I)C 527a_100011170560_100103153847 [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)Cl 11a_100011935240_100015343762 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)Cl 1626a_100011935240_100015343762 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)Cl 22a_100011935240_100000070787 [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)F 11a_100009863382_100015343762 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)F 1626a_100009863382_100015343762 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)C)F 22a_100009863382_100000070787 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)Br 11a_100000701039_100015343762 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)Br 1626a_100000701039_100015343762 [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)Cl 11a_200000033989_100015343762 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)Cl 1626a_200000033989_100015343762 [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)F 11a_100000068956_100015343762 [0,2,0,0,0,0|2,0,0]=4 7034 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)F 1626a_100000068956_100015343762 [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)Cl)O 527a_100012017499_100103153847 [0,2,0,0,0,0|2,0,0]=4 7036 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)Br 11a_100010109752_100015343762 [0,2,0,0,0,0|2,0,0]=4 7037 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)Br 1626a_100010109752_100015343762 [0,2,0,0,0,0|2,0,0]=4 7038 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)Cl 11a_100000069711_100015343762 [0,2,0,0,0,0|2,0,0]=4 7039 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)Cl 1626a_100000069711_100015343762 [0,2,0,0,0,0|2,0,0]=4 7040 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)F 11a_100000101296_100015343762 [0,2,0,0,0,0|2,0,0]=4 7041 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)F)F 1626a_100000101296_100015343762 [0,2,0,0,0,0|2,0,0]=4 7042 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)O)C 11a_100000036876_100015343762 [0,2,0,0,0,0|1,0,0]=3 7043 B13R1.3528 CC(=O)Nc1ccc(c(c1Cl)O)C 22a_100000036876_100000070787 [0,2,0,0,0,0|1,0,0]=3 7044 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Br)F 11a_100010070858_100015343762 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Br)F 1626a_100010070858_100015343762 [0,2,0,0,0,0|2,0,0]=4 7046 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)Br 11a_100000722916_100015343762 [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)Br 1626a_100000722916_100015343762 [0,2,0,0,0,0|2,0,0]=4 7048 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)Br 22a_100000722916_100000070787 [0,2,0,0,0,0|2,0,0]=4 7049 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)F 11a_102495366501_100015343762 [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)F 1626a_102495366501_100015343762 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)F 22a_102495366501_100000070787 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)O 11a_200000126710_100015343762 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)O 22a_200000126710_100000070787 [0,2,0,0,0,0|2,0,0]=4 7054 B13R1.3528 CC(=O)Nc1ccc(c(c1F)C)O 527a_200000126710_100103153847 [0,2,0,0,0,0|2,0,0]=4 7055 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Br 11a_100009813730_100015343762 [0,2,0,0,0,0|2,0,0]=4 7056 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Br 1626a_100009813730_100015343762 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Br 22a_100009813730_100000070787 [0,2,0,0,0,0|2,0,0]=4 7058 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Cl 11a_100000036759_100015343762 [0,2,0,0,0,0|2,0,0]=4 7059 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)Cl 1626a_100000036759_100015343762 [0,2,0,0,0,0|2,0,0]=4 7060 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)F 11a_100000038966_100015343762 [0,2,0,0,0,0|2,0,0]=4 7061 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)F 1626a_100000038966_100015343762 [0,2,0,0,0,0|2,0,0]=4 7062 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)O 22a_200000098347_100000070787 [0,2,0,0,0,0|2,0,0]=4 7063 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)O 527a_200000098347_100103153847 [0,2,0,0,0,0|2,0,0]=4 7064 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Br 11a_100010200256_100015343762 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Br 1626a_100010200256_100015343762 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)C 11a_100000062217_100015343762 [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)C 1626a_100000062217_100015343762 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)C 22a_100000062217_100000070787 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Cl 11a_100000088996_100015343762 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Cl 1626a_100000088996_100015343762 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)F 11a_100000210235_100015343762 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)F 1626a_100000210235_100015343762 [0,2,0,0,0,0|2,0,0]=4 7073 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)F 22a_100000210235_100000070787 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)I 11a_100010291506_100015343762 [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)I 1626a_100010291506_100015343762 [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)O 22a_100015204651_100000070787 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)O 527a_100015204651_100103153847 [0,2,0,0,0,0|2,0,0]=4 7078 B13R1.3528 CC(=O)Nc1ccc(c(c1F)I)F 11a_100015510717_100015343762 [0,2,0,0,0,0|2,0,0]=4 7079 B13R1.3528 CC(=O)Nc1ccc(c(c1F)I)F 1626a_100015510717_100015343762 [0,2,0,0,0,0|2,0,0]=4 7080 B13R1.3528 CC(=O)Nc1ccc(c(c1F)I)F 22a_100015510717_100000070787 [0,2,0,0,0,0|2,0,0]=4 7081 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Br)F 11a_100020765651_100015343762 [0,2,0,0,0,0|2,0,0]=4 7082 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Br)F 1626a_100020765651_100015343762 [0,2,0,0,0,0|2,0,0]=4 7083 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Cl)Br 11a_200010779962_100015343762 [0,2,0,0,0,0|2,0,0]=4 7084 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Cl)Br 1626a_200010779962_100015343762 [0,2,0,0,0,0|2,0,0]=4 7085 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Cl)Cl 11a_200011093878_100015343762 [0,2,0,0,0,0|2,0,0]=4 7086 B13R1.3528 CC(=O)Nc1ccc(c(c1I)Cl)Cl 1626a_200011093878_100015343762 [0,2,0,0,0,0|2,0,0]=4 7087 B13R1.3528 CC(=O)Nc1ccc(c(c1I)F)Cl 11a_100010134325_100015343762 [0,2,0,0,0,0|2,0,0]=4 7088 B13R1.3528 CC(=O)Nc1ccc(c(c1I)F)Cl 1626a_100010134325_100015343762 [0,2,0,0,0,0|2,0,0]=4 7089 B13R1.3528 CC(=O)Nc1ccc(c(c1O)Br)F 22a_100010128263_100000070787 [0,2,0,0,0,0|2,0,0]=4 7090 B13R1.3528 CC(=O)Nc1ccc(c(c1O)Br)F 527a_100010128263_100103153847 [0,2,0,0,0,0|2,0,0]=4 7091 B13R1.3528 CC(=O)Nc1ccc(c(c1O)F)F 22a_100015205010_100000070787 [0,2,0,0,0,0|2,0,0]=4 7092 B13R1.3528 CC(=O)Nc1ccc(c(c1O)F)F 527a_100015205010_100103153847 [0,2,0,0,0,0|2,0,0]=4 7093 B13R1.3528 CC(C)Oc1ccc(c(c1F)O)O 271570a_203496583355_202127810487 [0,2,0,0,0,0|1,0,1]=4 7094 B13R1.3528 Cc1ccc(c(c1F)F)CC(=O)[13CH3] 1458a_100011217901_200025704644 [0,2,0,0,0,0|2,0,0]=4 7095 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1Br)F)F 1458a_200015693364_200025704644 [0,2,0,0,0,0|2,0,0]=4 7096 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1Cl)F)F 1458a_200010154634_200025704644 [0,2,0,0,0,0|2,0,0]=4 7097 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1F)Cl)F 1458a_100000062224_200025704644 [0,2,0,0,0,0|2,0,0]=4 7098 B13R1.3528 [13CH3]C(=O)Cc1ccc(c(c1F)F)F 1458a_100011217297_200025704644 [0,2,0,0,0,0|2,0,0]=4 7099 B13R1.3763 CC(=Cc1cc(c(c(c1)F)F)O)C 271570a_100102525489_100000709865 [0,2,0,0,0,0|2,0,0]=4 7100 B13R1.3763 CC(=Cc1cc(c(c(c1)F)N)O)C 271570a_100102525489_100015475841 [0,2,0,0,0,0|2,0,0]=4 7101 B13R1.3763 CC(=Cc1cc(c(c(c1)O)N)C)C 271570a_100102525489_100010371313 [0,2,0,0,0,0|2,0,0]=4 7102 B13R1.3763 CC(=O)Cc1cc(c(c(c1)Br)O)Br 1458a_100009996861_200000210301 [0,2,0,0,0,0|2,0,0]=4 7103 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)F)C 1458a_100000069598_200000210301 [0,2,0,0,0,0|2,0,0]=4 7104 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)F)C 1458a_100000070787_100011352456 [0,2,0,0,0,0|2,0,0]=4 7105 B13R1.3763 CC(=O)Cc1cc(c(c(c1)C)O)C 1458a_200000099080_200000210301 [0,2,0,0,0,0|2,0,0]=4 7106 B13R1.3763 CC(=O)Cc1cc(c(c(c1)F)Cl)F 1458a_100000070787_100010769323 [0,2,0,0,0,0|2,0,0]=4 7107 B13R1.3763 CC(=O)Cc1cc(c(c(c1)F)F)F 1458a_100000070787_100011216845 [0,2,0,0,0,0|2,0,0]=4 7108 B13R1.3763 CC(=O)Cc1cc(c(c(c1)F)F)F 1458a_100011217689_200000210301 [0,2,0,0,0,0|2,0,0]=4 7109 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)Br 11a_100009813276_100015343762 [0,2,0,0,0,0|2,0,0]=4 7110 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)Br 1626a_100009813276_100015343762 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)Br 22a_100009813276_100000070787 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)Br 527a_100009813276_100103153847 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)C 11a_100010368239_100015343762 [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)C 1626a_100010368239_100015343762 [0,2,0,0,0,0|2,0,0]=4 7115 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)C 22a_100010368239_100000070787 [0,2,0,0,0,0|2,0,0]=4 7116 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)C 527a_100010368239_100103153847 [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)F 11a_100010254531_100015343762 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)F 1626a_100010254531_100015343762 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)F 22a_100010254531_100000070787 [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)C)F 527a_100010254531_100103153847 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)Cl)Cl 11a_100010735061_100015343762 [0,2,0,0,0,0|2,0,0]=4 7122 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)Cl)Cl 1626a_100010735061_100015343762 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)Cl)Cl 22a_100010735061_100000070787 [0,2,0,0,0,0|2,0,0]=4 7124 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)Cl)Cl 527a_100010735061_100103153847 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)Br 11a_100010209666_100015343762 [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)Br 1626a_100010209666_100015343762 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)Br 22a_100010209666_100000070787 [0,2,0,0,0,0|2,0,0]=4 7128 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)Br 527a_100010209666_100103153847 [0,2,0,0,0,0|2,0,0]=4 7129 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)F 11a_100009816004_100015343762 [0,2,0,0,0,0|2,0,0]=4 7130 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)F 1626a_100009816004_100015343762 [0,2,0,0,0,0|2,0,0]=4 7131 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)F 22a_100009816004_100000070787 [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)F)F 527a_100009816004_100103153847 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)O)Br 22a_200000186426_100000070787 [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)O)Br 527a_200000186426_100103153847 [0,2,0,0,0,0|2,0,0]=4 7135 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)O)C 11a_100010064301_100015343762 [0,2,0,0,0,0|2,0,0]=4 7136 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)O)C 22a_100010064301_100000070787 [0,2,0,0,0,0|2,0,0]=4 7137 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Br)O)C 527a_100010064301_100103153847 [0,2,0,0,0,0|2,0,0]=4 7138 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)Br)C 11a_100000684802_100015343762 [0,2,0,0,0,0|2,0,0]=4 7139 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)Br)C 1626a_100000684802_100015343762 [0,2,0,0,0,0|2,0,0]=4 7140 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)Br)C 22a_100000684802_100000070787 [0,2,0,0,0,0|2,0,0]=4 7141 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)Br)C 527a_100000684802_100103153847 [0,2,0,0,0,0|2,0,0]=4 7142 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)C)C 11a_100000074974_100015343762 [0,2,0,0,0,0|2,0,0]=4 7143 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)C)C 1626a_100000074974_100015343762 [0,2,0,0,0,0|2,0,0]=4 7144 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)C)C 22a_100000074974_100000070787 [0,2,0,0,0,0|2,0,0]=4 7145 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)C)C 527a_100000074974_100103153847 [0,2,0,0,0,0|2,0,0]=4 7146 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)F)C 11a_100000061604_100015343762 [0,2,0,0,0,0|2,0,0]=4 7147 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)F)C 1626a_100000061604_100015343762 [0,2,0,0,0,0|2,0,0]=4 7148 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)F)C 22a_100000061604_100000070787 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)F)C 527a_100000061604_100103153847 [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)I)C 11a_100000215964_100015343762 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)I)C 1626a_100000215964_100015343762 [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)I)C 22a_100000215964_100000070787 [0,2,0,0,0,0|2,0,0]=4 7153 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)I)C 527a_100000215964_100103153847 [0,2,0,0,0,0|2,0,0]=4 7154 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)O)C 11a_100000703291_100015343762 [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)O)C 1626a_100000703291_100015343762 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)O)C 22a_100000703291_100000070787 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)O)C 271570a_203496583355_200012340666 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.3763 CC(=O)Nc1cc(c(c(c1)C)O)C 527a_100000703291_100103153847 [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)Cl 11a_100010212259_100015343762 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)Cl 1626a_100010212259_100015343762 [0,2,0,0,0,0|2,0,0]=4 7161 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)Cl 22a_100010212259_100000070787 [0,2,0,0,0,0|2,0,0]=4 7162 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)Cl 527a_100010212259_100103153847 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)F 11a_100000728458_100015343762 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)F 1626a_100000728458_100015343762 [0,2,0,0,0,0|2,0,0]=4 7165 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)F 22a_100000728458_100000070787 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Br)F 527a_100000728458_100103153847 [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)C)Cl 11a_100000745310_100015343762 [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)C)Cl 1626a_100000745310_100015343762 [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)C)Cl 22a_100000745310_100000070787 [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)C)Cl 527a_100000745310_100103153847 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)C 11a_100009830880_100015343762 [0,2,0,0,0,0|2,0,0]=4 7172 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)C 1626a_100009830880_100015343762 [0,2,0,0,0,0|2,0,0]=4 7173 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)C 22a_100009830880_100000070787 [0,2,0,0,0,0|2,0,0]=4 7174 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)C 527a_100009830880_100103153847 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)Cl 11a_100000037808_100015343762 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)Cl 1626a_100000037808_100015343762 [0,2,0,0,0,0|2,0,0]=4 7177 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)Cl 22a_100000037808_100000070787 [0,2,0,0,0,0|2,0,0]=4 7178 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)F 11a_100012961779_100015343762 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)F 1626a_100012961779_100015343762 [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)Cl)O 22a_100015839415_100000070787 [0,2,0,0,0,0|1,0,0]=3 7181 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)F)Cl 11a_100000700460_100015343762 [0,2,0,0,0,0|2,0,0]=4 7182 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)F)Cl 1626a_100000700460_100015343762 [0,2,0,0,0,0|2,0,0]=4 7183 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)F)Cl 22a_100000700460_100000070787 [0,2,0,0,0,0|2,0,0]=4 7184 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)F)F 11a_200009857453_100015343762 [0,2,0,0,0,0|2,0,0]=4 7185 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)F)F 1626a_200009857453_100015343762 [0,2,0,0,0,0|2,0,0]=4 7186 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)F)F 22a_200009857453_100000070787 [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)I)F 11a_100014833993_100015343762 [0,2,0,0,0,0|2,0,0]=4 7188 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)I)F 1626a_100014833993_100015343762 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)O)Cl 22a_100000695418_100000070787 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)O)Cl 271570a_203496583355_106256037338 [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.3763 CC(=O)Nc1cc(c(c(c1)Cl)O)Cl 527a_100000695418_100103153847 [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)C 11a_100010115923_100015343762 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)C 1626a_100010115923_100015343762 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)C 22a_100010115923_100000070787 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)C 527a_100010115923_100103153847 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)F 11a_100000687227_100015343762 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)F 1626a_100000687227_100015343762 [0,2,0,0,0,0|2,0,0]=4 7198 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Br)F 527a_100000687227_100103153847 [0,2,0,0,0,0|2,0,0]=4 7199 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)C)F 11a_100011216606_100015343762 [0,2,0,0,0,0|2,0,0]=4 7200 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)C)F 1626a_100011216606_100015343762 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)C)F 22a_100011216606_100000070787 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)C)F 527a_100011216606_100103153847 [0,2,0,0,0,0|2,0,0]=4 7203 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Cl)F 11a_100000094121_100015343762 [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)Cl)F 1626a_100000094121_100015343762 [0,2,0,0,0,0|2,0,0]=4 7205 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)C 11a_100010704045_100015343762 [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)C 1626a_100010704045_100015343762 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)C 22a_100010704045_100000070787 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)C 527a_100010704045_100103153847 [0,2,0,0,0,0|2,0,0]=4 7209 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)F 11a_100000750163_100015343762 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)F 1626a_100000750163_100015343762 [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)F)F 22a_100000750163_100000070787 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)I)F 11a_100000057532_100015343762 [0,2,0,0,0,0|2,0,0]=4 7213 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)I)F 1626a_100000057532_100015343762 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)I)F 22a_100000057532_100000070787 [0,2,0,0,0,0|2,0,0]=4 7215 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)O)F 1626a_100016987357_100015343762 [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)O)F 22a_100016987357_100000070787 [0,2,0,0,0,0|2,0,0]=4 7217 B13R1.3763 CC(=O)Nc1cc(c(c(c1)F)O)F 527a_100016987357_100103153847 [0,2,0,0,0,0|2,0,0]=4 7218 B13R1.3763 Cc1cc(cc(c1F)C)CC(=O)[13CH3] 1458a_100000069598_200025704644 [0,2,0,0,0,0|2,0,0]=4 7219 B13R1.3763 Cc1cc(cc(c1O)C)CC(=O)[13CH3] 1458a_200000099080_200025704644 [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.3763 [13CH3]C(=O)Cc1cc(c(c(c1)Br)O)Br 1458a_100009996861_200025704644 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.3763 [13CH3]C(=O)Cc1cc(c(c(c1)F)F)F 1458a_100011217689_200025704644 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.20 C#CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000184674 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.20 C#CCC(=O)Cc1cccc(c1)Br 1458a_100011220946_100000211773 [0,2,0,0,0,0|2,0,0]=4 7224 B13R1.20 C#CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000184674 [0,2,0,0,0,0|2,0,0]=4 7225 B13R1.20 C#CCC(=O)Cc1cccc(c1)C 1458a_100011220946_100000211840 [0,2,0,0,0,0|2,0,0]=4 7226 B13R1.20 C#CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000184674 [0,2,0,0,0,0|2,0,0]=4 7227 B13R1.20 C#CCC(=O)Cc1cccc(c1)Cl 1458a_100011220946_100000181238 [0,2,0,0,0,0|2,0,0]=4 7228 B13R1.20 C#CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000184674 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.20 C#CCC(=O)Cc1cccc(c1)F 1458a_100011220946_100000230114 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.20 C#CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000184674 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.20 C#CCC(=O)Cc1cccc(c1)I 1458a_100011220946_100011218688 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.20 C#CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000184674 [0,2,0,0,0,0|1,0,0]=3 7233 B13R1.20 C#CCC(=O)Cc1cccc(c1)O 1458a_100011220946_100011660834 [0,2,0,0,0,0|1,0,0]=3 7234 B13R1.20 C#CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100011220946 [0,2,0,0,0,0|2,0,0]=4 7235 B13R1.20 C#CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100011220946 [0,2,0,0,0,0|2,0,0]=4 7236 B13R1.20 C#CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100011220946 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.20 C#CCC(=O)Nc1cccc(c1)C 527a_100000188690_100011220946 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.20 C#CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100011220946 [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.20 C#CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100011220946 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.20 C#CCC(=O)Nc1cccc(c1)F 527a_100000210047_100011220946 [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.20 C#CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100011220946 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.20 C#CCC(=O)Nc1cccc(c1)I 527a_100000211102_100011220946 [0,2,0,0,0,0|2,0,0]=4 7243 B13R1.20 C#CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100011220946 [0,2,0,0,0,0|1,0,0]=3 7244 B13R1.20 C#CCC(=O)Nc1cccc(c1)O 527a_100000210217_100011220946 [0,2,0,0,0,0|1,0,0]=3 7245 B13R1.20 C=CCC(=O)Cc1cccc(c1)Br 1458a_100000210193_100000211773 [0,2,0,0,0,0|2,0,0]=4 7246 B13R1.20 C=CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210623 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.20 C=CCC(=O)Cc1cccc(c1)C 1458a_100000210193_100000211840 [0,2,0,0,0,0|2,0,0]=4 7248 B13R1.20 C=CCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210623 [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.20 C=CCC(=O)Cc1cccc(c1)Cl 1458a_100000210193_100000181238 [0,2,0,0,0,0|2,0,0]=4 7250 B13R1.20 C=CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210623 [0,2,0,0,0,0|2,0,0]=4 7251 B13R1.20 C=CCC(=O)Cc1cccc(c1)F 1458a_100000210193_100000230114 [0,2,0,0,0,0|2,0,0]=4 7252 B13R1.20 C=CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210623 [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.20 C=CCC(=O)Cc1cccc(c1)I 1458a_100000210193_100011218688 [0,2,0,0,0,0|2,0,0]=4 7254 B13R1.20 C=CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210623 [0,2,0,0,0,0|2,0,0]=4 7255 B13R1.20 C=CCC(=O)Cc1cccc(c1)O 1458a_100000210193_100011660834 [0,2,0,0,0,0|1,0,0]=3 7256 B13R1.20 C=CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210623 [0,2,0,0,0,0|1,0,0]=3 7257 B13R1.20 C=CCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210193 [0,2,0,0,0,0|2,0,0]=4 7258 B13R1.20 C=CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210193 [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.20 C=CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210193 [0,2,0,0,0,0|2,0,0]=4 7260 B13R1.20 C=CCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210193 [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.20 C=CCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210193 [0,2,0,0,0,0|2,0,0]=4 7262 B13R1.20 C=CCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210193 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.20 C=CCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210193 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.20 C=CCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210193 [0,2,0,0,0,0|2,0,0]=4 7265 B13R1.20 C=CCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210193 [0,2,0,0,0,0|2,0,0]=4 7266 B13R1.20 C=CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210193 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.20 C=CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210193 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.20 C=CCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210193 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.20 C=CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210193 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.20 C=CCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210193 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.20 C=CCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210193 [0,2,0,0,0,0|2,0,0]=4 7272 B13R1.20 C=CCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210193 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.20 C=CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210193 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.20 C=CCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210193 [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.20 C=CCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210193 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.20 C=CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210193 [0,2,0,0,0,0|1,0,0]=3 7277 B13R1.20 C=CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210193 [0,2,0,0,0,0|1,0,0]=3 7278 B13R1.20 C=CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210193 [0,2,0,0,0,0|1,0,0]=3 7279 B13R1.20 CC#CC(=O)Cc1cccc(c1)Br 1458a_100000763181_100000211773 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.20 CC#CC(=O)Cc1cccc(c1)C 1458a_100000763181_100000211840 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.20 CC#CC(=O)Cc1cccc(c1)Cl 1458a_100000763181_100000181238 [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.20 CC#CC(=O)Cc1cccc(c1)F 1458a_100000763181_100000230114 [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.20 CC#CC(=O)Cc1cccc(c1)I 1458a_100000763181_100011218688 [0,2,0,0,0,0|2,0,0]=4 7284 B13R1.20 CC#CC(=O)Cc1cccc(c1)O 1458a_100000763181_100011660834 [0,2,0,0,0,0|1,0,0]=3 7285 B13R1.20 CC#CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000763181 [0,2,0,0,0,0|2,0,0]=4 7286 B13R1.20 CC#CC(=O)Nc1cccc(c1)C 22a_100000188690_100000763181 [0,2,0,0,0,0|2,0,0]=4 7287 B13R1.20 CC#CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000763181 [0,2,0,0,0,0|2,0,0]=4 7288 B13R1.20 CC#CC(=O)Nc1cccc(c1)F 22a_100000210047_100000763181 [0,2,0,0,0,0|2,0,0]=4 7289 B13R1.20 CC#CC(=O)Nc1cccc(c1)I 22a_100000211102_100000763181 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.20 CC#CC(=O)Nc1cccc(c1)O 22a_100000210217_100000763181 [0,2,0,0,0,0|1,0,0]=3 7291 B13R1.20 CC=CC(=O)Cc1cccc(c1)Br 1458a_100000210699_100000211773 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.20 CC=CC(=O)Cc1cccc(c1)C 1458a_100000210699_100000211840 [0,2,0,0,0,0|2,0,0]=4 7293 B13R1.20 CC=CC(=O)Cc1cccc(c1)Cl 1458a_100000210699_100000181238 [0,2,0,0,0,0|2,0,0]=4 7294 B13R1.20 CC=CC(=O)Cc1cccc(c1)F 1458a_100000210699_100000230114 [0,2,0,0,0,0|2,0,0]=4 7295 B13R1.20 CC=CC(=O)Cc1cccc(c1)I 1458a_100000210699_100011218688 [0,2,0,0,0,0|2,0,0]=4 7296 B13R1.20 CC=CC(=O)Cc1cccc(c1)O 1458a_100000210699_100011660834 [0,2,0,0,0,0|1,0,0]=3 7297 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210699 [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210699 [0,2,0,0,0,0|2,0,0]=4 7299 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210699 [0,2,0,0,0,0|2,0,0]=4 7300 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 11a_100000188690_100000210699 [0,2,0,0,0,0|2,0,0]=4 7301 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210699 [0,2,0,0,0,0|2,0,0]=4 7302 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000210699 [0,2,0,0,0,0|2,0,0]=4 7303 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210699 [0,2,0,0,0,0|2,0,0]=4 7304 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210699 [0,2,0,0,0,0|2,0,0]=4 7305 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210699 [0,2,0,0,0,0|2,0,0]=4 7306 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 11a_100000210047_100000210699 [0,2,0,0,0,0|2,0,0]=4 7307 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210699 [0,2,0,0,0,0|2,0,0]=4 7308 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000210699 [0,2,0,0,0,0|2,0,0]=4 7309 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 11a_100000211102_100000210699 [0,2,0,0,0,0|2,0,0]=4 7310 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210699 [0,2,0,0,0,0|2,0,0]=4 7311 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000210699 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.20 CC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210699 [0,2,0,0,0,0|1,0,0]=3 7313 B13R1.20 CC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000210699 [0,2,0,0,0,0|1,0,0]=3 7314 B13R1.20 CCCC(=O)Cc1cccc(c1)Br 1458a_100000211992_100000211773 [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.20 CCCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100000210303 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.20 CCCC(=O)Cc1cccc(c1)C 1458a_100000211992_100000211840 [0,2,0,0,0,0|2,0,0]=4 7317 B13R1.20 CCCC(=O)Cc1cccc(c1)C 1458a_100011206899_100000210303 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl 1458a_100000211992_100000181238 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.20 CCCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100000210303 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.20 CCCC(=O)Cc1cccc(c1)F 1458a_100000211661_100000210303 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.20 CCCC(=O)Cc1cccc(c1)F 1458a_100000211992_100000230114 [0,2,0,0,0,0|2,0,0]=4 7322 B13R1.20 CCCC(=O)Cc1cccc(c1)I 1458a_100000211992_100011218688 [0,2,0,0,0,0|2,0,0]=4 7323 B13R1.20 CCCC(=O)Cc1cccc(c1)I 1458a_100000238430_100000210303 [0,2,0,0,0,0|2,0,0]=4 7324 B13R1.20 CCCC(=O)Cc1cccc(c1)O 1458a_100000211992_100011660834 [0,2,0,0,0,0|1,0,0]=3 7325 B13R1.20 CCCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210303 [0,2,0,0,0,0|1,0,0]=3 7326 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000211992 [0,2,0,0,0,0|2,0,0]=4 7327 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000211992 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000211992 [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.20 CCCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000211992 [0,2,0,0,0,0|2,0,0]=4 7330 B13R1.20 CCCC(=O)Nc1cccc(c1)C 11a_100000188690_100000211992 [0,2,0,0,0,0|2,0,0]=4 7331 B13R1.20 CCCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000211992 [0,2,0,0,0,0|2,0,0]=4 7332 B13R1.20 CCCC(=O)Nc1cccc(c1)C 22a_100000188690_100000211992 [0,2,0,0,0,0|2,0,0]=4 7333 B13R1.20 CCCC(=O)Nc1cccc(c1)C 527a_100000188690_100000211992 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.20 CCCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000211992 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.20 CCCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000211992 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.20 CCCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000211992 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.20 CCCC(=O)Nc1cccc(c1)F 11a_100000210047_100000211992 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.20 CCCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000211992 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.20 CCCC(=O)Nc1cccc(c1)F 22a_100000210047_100000211992 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.20 CCCC(=O)Nc1cccc(c1)F 527a_100000210047_100000211992 [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.20 CCCC(=O)Nc1cccc(c1)I 11a_100000211102_100000211992 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.20 CCCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000211992 [0,2,0,0,0,0|2,0,0]=4 7343 B13R1.20 CCCC(=O)Nc1cccc(c1)I 22a_100000211102_100000211992 [0,2,0,0,0,0|2,0,0]=4 7344 B13R1.20 CCCC(=O)Nc1cccc(c1)I 527a_100000211102_100000211992 [0,2,0,0,0,0|2,0,0]=4 7345 B13R1.20 CCCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000211992 [0,2,0,0,0,0|1,0,0]=3 7346 B13R1.20 CCCC(=O)Nc1cccc(c1)O 22a_100000210217_100000211992 [0,2,0,0,0,0|1,0,0]=3 7347 B13R1.20 CCCC(=O)Nc1cccc(c1)O 527a_100000210217_100000211992 [0,2,0,0,0,0|1,0,0]=3 7348 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 11a_100015525214_100000747190 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 240690a_100015525214_100000747190 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.20 CCNC(=O)Cc1cccc(c1)Br 527a_100015525214_100000747190 [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.20 CCNC(=O)Cc1cccc(c1)C 11a_100015525214_100011206899 [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.20 CCNC(=O)Cc1cccc(c1)C 240690a_100015525214_100011206899 [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.20 CCNC(=O)Cc1cccc(c1)C 527a_100015525214_100011206899 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 11a_100015525214_100000749307 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 240690a_100015525214_100000749307 [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.20 CCNC(=O)Cc1cccc(c1)Cl 527a_100015525214_100000749307 [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.20 CCNC(=O)Cc1cccc(c1)F 11a_100015525214_100000211661 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.20 CCNC(=O)Cc1cccc(c1)F 240690a_100015525214_100000211661 [0,2,0,0,0,0|2,0,0]=4 7359 B13R1.20 CCNC(=O)Cc1cccc(c1)F 527a_100015525214_100000211661 [0,2,0,0,0,0|2,0,0]=4 7360 B13R1.20 CCNC(=O)Cc1cccc(c1)I 11a_100015525214_100000238430 [0,2,0,0,0,0|2,0,0]=4 7361 B13R1.20 CCNC(=O)Cc1cccc(c1)I 240690a_100015525214_100000238430 [0,2,0,0,0,0|2,0,0]=4 7362 B13R1.20 CCNC(=O)Cc1cccc(c1)I 527a_100015525214_100000238430 [0,2,0,0,0,0|2,0,0]=4 7363 B13R1.20 CCNC(=O)Cc1cccc(c1)O 240690a_100015525214_100000745134 [0,2,0,0,0,0|1,0,0]=3 7364 B13R1.20 CCNC(=O)Cc1cccc(c1)O 527a_100015525214_100000745134 [0,2,0,0,0,0|1,0,0]=3 7365 B13R1.20 CCNC(=O)Nc1cccc(c1)Br 2430a_100000210019_100015525214 [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.20 CCNC(=O)Nc1cccc(c1)Br 512a_100000210019_100015525214 [0,2,0,0,0,0|2,0,0]=4 7367 B13R1.20 CCNC(=O)Nc1cccc(c1)C 2430a_100000188690_100015525214 [0,2,0,0,0,0|2,0,0]=4 7368 B13R1.20 CCNC(=O)Nc1cccc(c1)C 512a_100000188690_100015525214 [0,2,0,0,0,0|2,0,0]=4 7369 B13R1.20 CCNC(=O)Nc1cccc(c1)Cl 2430a_100000185859_100015525214 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.20 CCNC(=O)Nc1cccc(c1)F 2430a_100000210047_100015525214 [0,2,0,0,0,0|2,0,0]=4 7371 B13R1.20 CCNC(=O)Nc1cccc(c1)F 512a_100000210047_100015525214 [0,2,0,0,0,0|2,0,0]=4 7372 B13R1.20 CCNC(=O)Nc1cccc(c1)I 2430a_100000211102_100015525214 [0,2,0,0,0,0|2,0,0]=4 7373 B13R1.20 CCNC(=O)Nc1cccc(c1)I 512a_100000211102_100015525214 [0,2,0,0,0,0|2,0,0]=4 7374 B13R1.20 CCNC(=O)Nc1cccc(c1)O 2430a_100000210217_100015525214 [0,2,0,0,0,0|1,0,0]=3 7375 B13R1.20 CCNC(=O)Nc1cccc(c1)O 512a_100000210217_100015525214 [0,2,0,0,0,0|1,0,0]=3 7376 B13R1.20 CCOC(=O)Cc1cc(ccn1)O 271570a_203496583355_100000716784 [0,2,0,0,0,0|2,0,0]=4 7377 B13R1.20 CCOC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586817 [0,2,0,0,0,0|1,0,0]=3 7378 B13R1.20 CCOC(=O)Cc1cccc(n1)O 271570a_203496583355_100010230180 [0,2,0,0,0,0|2,0,0]=4 7379 B13R1.20 CCOC(=O)Cc1ccnc(c1)O 271570a_203496583355_100000696486 [0,2,0,0,0,0|2,0,0]=4 7380 B13R1.20 CN(CC=O)Cc1cccc(c1)O 2230a_100000207540_200015260668 [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.20 CN(CC=O)Cc1cccc(c1)O 269982a_100000207540_200015260668 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.20 CNCC(=O)Nc1cccc(c1)Br 2230a_106832991635_100000183509 [0,2,0,0,0,0|2,0,0]=4 7383 B13R1.20 CNCC(=O)Nc1cccc(c1)Br 34a_100102657272_100000183509 [0,2,0,0,0,0|2,0,0]=4 7384 B13R1.20 CNCC(=O)Nc1cccc(c1)Br 7a_106832991635_100000183509 [0,2,0,0,0,0|2,0,0]=4 7385 B13R1.20 CNCC(=O)Nc1cccc(c1)C 2230a_106832991635_100000182861 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.20 CNCC(=O)Nc1cccc(c1)C 34a_100102657272_100000182861 [0,2,0,0,0,0|2,0,0]=4 7387 B13R1.20 CNCC(=O)Nc1cccc(c1)C 7a_106832991635_100000182861 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_200000210301 [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 2230a_106832991635_100000182995 [0,2,0,0,0,0|2,0,0]=4 7390 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 34a_100102657272_100000182995 [0,2,0,0,0,0|2,0,0]=4 7391 B13R1.20 CNCC(=O)Nc1cccc(c1)Cl 7a_106832991635_100000182995 [0,2,0,0,0,0|2,0,0]=4 7392 B13R1.20 CNCC(=O)Nc1cccc(c1)F 2230a_100000168492_200000210301 [0,2,0,0,0,0|2,0,0]=4 7393 B13R1.20 CNCC(=O)Nc1cccc(c1)F 2230a_106832991635_100000183335 [0,2,0,0,0,0|2,0,0]=4 7394 B13R1.20 CNCC(=O)Nc1cccc(c1)F 34a_100000168492_200000210301 [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.20 CNCC(=O)Nc1cccc(c1)F 34a_100102657272_100000183335 [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.20 CNCC(=O)Nc1cccc(c1)F 7a_106832991635_100000183335 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.20 CNCC(=O)Nc1cccc(c1)O 2230a_106832991635_100011236192 [0,2,0,0,0,0|1,0,0]=3 7398 B13R1.20 CNCC(=O)Nc1cccc(c1)O 34a_100102657272_100011236192 [0,2,0,0,0,0|1,0,0]=3 7399 B13R1.20 CNCC(=O)Nc1cccc(c1)O 7a_106832991635_100011236192 [0,2,0,0,0,0|1,0,0]=3 7400 B13R1.20 CNNC(=O)Cc1cccc(c1)Br 22a_100016993582_100000747190 [0,2,0,0,0,0|2,0,0]=4 7401 B13R1.20 CNNC(=O)Cc1cccc(c1)C 22a_100016993582_100011206899 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.20 CNNC(=O)Cc1cccc(c1)Cl 22a_100016993582_100000749307 [0,2,0,0,0,0|2,0,0]=4 7403 B13R1.20 CNNC(=O)Cc1cccc(c1)F 22a_100016993582_100000211661 [0,2,0,0,0,0|2,0,0]=4 7404 B13R1.20 CNNC(=O)Cc1cccc(c1)I 22a_100016993582_100000238430 [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.20 CNNC(=O)Cc1cccc(c1)O 22a_100016993582_100000745134 [0,2,0,0,0,0|1,0,0]=3 7406 B13R1.20 CNNC(=O)Nc1cccc(c1)Br 512a_100000210019_100016993582 [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.20 CNNC(=O)Nc1cccc(c1)C 512a_100000188690_100016993582 [0,2,0,0,0,0|2,0,0]=4 7408 B13R1.20 CNNC(=O)Nc1cccc(c1)F 512a_100000210047_100016993582 [0,2,0,0,0,0|2,0,0]=4 7409 B13R1.20 CNNC(=O)Nc1cccc(c1)I 512a_100000211102_100016993582 [0,2,0,0,0,0|2,0,0]=4 7410 B13R1.20 CNNC(=O)Nc1cccc(c1)O 512a_100000210217_100016993582 [0,2,0,0,0,0|1,0,0]=3 7411 B13R1.20 COCC(=O)Cc1cccc(c1)Br 1458a_100000210968_100000211773 [0,2,0,0,0,0|2,0,0]=4 7412 B13R1.20 COCC(=O)Cc1cccc(c1)C 1458a_100000210968_100000211840 [0,2,0,0,0,0|2,0,0]=4 7413 B13R1.20 COCC(=O)Cc1cccc(c1)Cl 1458a_100000210968_100000181238 [0,2,0,0,0,0|2,0,0]=4 7414 B13R1.20 COCC(=O)Cc1cccc(c1)F 1458a_100000210968_100000230114 [0,2,0,0,0,0|2,0,0]=4 7415 B13R1.20 COCC(=O)Cc1cccc(c1)I 1458a_100000210968_100011218688 [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.20 COCC(=O)Cc1cccc(c1)O 1458a_100000210968_100011660834 [0,2,0,0,0,0|1,0,0]=3 7417 B13R1.20 COCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210968 [0,2,0,0,0,0|2,0,0]=4 7418 B13R1.20 COCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210968 [0,2,0,0,0,0|2,0,0]=4 7419 B13R1.20 COCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210968 [0,2,0,0,0,0|2,0,0]=4 7420 B13R1.20 COCC(=O)Nc1cccc(c1)Br 34a_100138415774_100000183509 [0,2,0,0,0,0|2,0,0]=4 7421 B13R1.20 COCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000210968 [0,2,0,0,0,0|2,0,0]=4 7422 B13R1.20 COCC(=O)Nc1cccc(c1)C 11a_100000188690_100000210968 [0,2,0,0,0,0|2,0,0]=4 7423 B13R1.20 COCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210968 [0,2,0,0,0,0|2,0,0]=4 7424 B13R1.20 COCC(=O)Nc1cccc(c1)C 22a_100000188690_100000210968 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.20 COCC(=O)Nc1cccc(c1)C 34a_100000749660_200000210301 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.20 COCC(=O)Nc1cccc(c1)C 34a_100138415774_100000182861 [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.20 COCC(=O)Nc1cccc(c1)C 527a_100000188690_100000210968 [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210968 [0,2,0,0,0,0|2,0,0]=4 7429 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210968 [0,2,0,0,0,0|2,0,0]=4 7430 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210968 [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.20 COCC(=O)Nc1cccc(c1)Cl 34a_100138415774_100000182995 [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.20 COCC(=O)Nc1cccc(c1)F 11a_100000210047_100000210968 [0,2,0,0,0,0|2,0,0]=4 7433 B13R1.20 COCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210968 [0,2,0,0,0,0|2,0,0]=4 7434 B13R1.20 COCC(=O)Nc1cccc(c1)F 22a_100000210047_100000210968 [0,2,0,0,0,0|2,0,0]=4 7435 B13R1.20 COCC(=O)Nc1cccc(c1)F 34a_100138415774_100000183335 [0,2,0,0,0,0|2,0,0]=4 7436 B13R1.20 COCC(=O)Nc1cccc(c1)F 527a_100000210047_100000210968 [0,2,0,0,0,0|2,0,0]=4 7437 B13R1.20 COCC(=O)Nc1cccc(c1)I 11a_100000211102_100000210968 [0,2,0,0,0,0|2,0,0]=4 7438 B13R1.20 COCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210968 [0,2,0,0,0,0|2,0,0]=4 7439 B13R1.20 COCC(=O)Nc1cccc(c1)I 22a_100000211102_100000210968 [0,2,0,0,0,0|2,0,0]=4 7440 B13R1.20 COCC(=O)Nc1cccc(c1)I 527a_100000211102_100000210968 [0,2,0,0,0,0|2,0,0]=4 7441 B13R1.20 COCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210968 [0,2,0,0,0,0|1,0,0]=3 7442 B13R1.20 COCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210968 [0,2,0,0,0,0|1,0,0]=3 7443 B13R1.20 COCC(=O)Nc1cccc(c1)O 271570a_203496583355_100000158352 [0,2,0,0,0,0|1,0,0]=3 7444 B13R1.20 COCC(=O)Nc1cccc(c1)O 34a_100138415774_100011236192 [0,2,0,0,0,0|1,0,0]=3 7445 B13R1.20 COCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210968 [0,2,0,0,0,0|1,0,0]=3 7446 B13R1.20 CSCC(=O)Cc1cccc(c1)Br 1458a_100000184570_100000211773 [0,2,0,0,0,0|2,0,0]=4 7447 B13R1.20 CSCC(=O)Cc1cccc(c1)C 1458a_100000184570_100000211840 [0,2,0,0,0,0|2,0,0]=4 7448 B13R1.20 CSCC(=O)Cc1cccc(c1)Cl 1458a_100000184570_100000181238 [0,2,0,0,0,0|2,0,0]=4 7449 B13R1.20 CSCC(=O)Cc1cccc(c1)F 1458a_100000184570_100000230114 [0,2,0,0,0,0|2,0,0]=4 7450 B13R1.20 CSCC(=O)Cc1cccc(c1)I 1458a_100000184570_100011218688 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.20 CSCC(=O)Cc1cccc(c1)O 1458a_100000184570_100011660834 [0,2,0,0,0,0|1,0,0]=3 7452 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 11a_100000210019_100000184570 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000184570 [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 22a_100000210019_100000184570 [0,2,0,0,0,0|2,0,0]=4 7455 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 527a_100000210019_100000184570 [0,2,0,0,0,0|2,0,0]=4 7456 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 62a_100000183509_200000210301 [0,2,0,0,0,0|2,0,0]=4 7457 B13R1.20 CSCC(=O)Nc1cccc(c1)Br 62a_200000210301_100000183509 [0,2,0,0,0,0|2,0,0]=4 7458 B13R1.20 CSCC(=O)Nc1cccc(c1)C 11a_100000188690_100000184570 [0,2,0,0,0,0|2,0,0]=4 7459 B13R1.20 CSCC(=O)Nc1cccc(c1)C 1626a_100000188690_100000184570 [0,2,0,0,0,0|2,0,0]=4 7460 B13R1.20 CSCC(=O)Nc1cccc(c1)C 22a_100000188690_100000184570 [0,2,0,0,0,0|2,0,0]=4 7461 B13R1.20 CSCC(=O)Nc1cccc(c1)C 527a_100000188690_100000184570 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.20 CSCC(=O)Nc1cccc(c1)C 62a_100000243722_200000210301 [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.20 CSCC(=O)Nc1cccc(c1)C 62a_200000210301_100000182861 [0,2,0,0,0,0|2,0,0]=4 7464 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000184570 [0,2,0,0,0,0|2,0,0]=4 7465 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000184570 [0,2,0,0,0,0|2,0,0]=4 7466 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000184570 [0,2,0,0,0,0|2,0,0]=4 7467 B13R1.20 CSCC(=O)Nc1cccc(c1)Cl 62a_200000210301_100000182995 [0,2,0,0,0,0|2,0,0]=4 7468 B13R1.20 CSCC(=O)Nc1cccc(c1)F 11a_100000210047_100000184570 [0,2,0,0,0,0|2,0,0]=4 7469 B13R1.20 CSCC(=O)Nc1cccc(c1)F 1626a_100000210047_100000184570 [0,2,0,0,0,0|2,0,0]=4 7470 B13R1.20 CSCC(=O)Nc1cccc(c1)F 22a_100000210047_100000184570 [0,2,0,0,0,0|2,0,0]=4 7471 B13R1.20 CSCC(=O)Nc1cccc(c1)F 527a_100000210047_100000184570 [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.20 CSCC(=O)Nc1cccc(c1)F 62a_100000183335_200000210301 [0,2,0,0,0,0|2,0,0]=4 7473 B13R1.20 CSCC(=O)Nc1cccc(c1)F 62a_200000210301_100000183335 [0,2,0,0,0,0|2,0,0]=4 7474 B13R1.20 CSCC(=O)Nc1cccc(c1)I 11a_100000211102_100000184570 [0,2,0,0,0,0|2,0,0]=4 7475 B13R1.20 CSCC(=O)Nc1cccc(c1)I 1626a_100000211102_100000184570 [0,2,0,0,0,0|2,0,0]=4 7476 B13R1.20 CSCC(=O)Nc1cccc(c1)I 22a_100000211102_100000184570 [0,2,0,0,0,0|2,0,0]=4 7477 B13R1.20 CSCC(=O)Nc1cccc(c1)I 527a_100000211102_100000184570 [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.20 CSCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000184570 [0,2,0,0,0,0|1,0,0]=3 7479 B13R1.20 CSCC(=O)Nc1cccc(c1)O 22a_100000210217_100000184570 [0,2,0,0,0,0|1,0,0]=3 7480 B13R1.20 CSCC(=O)Nc1cccc(c1)O 527a_100000210217_100000184570 [0,2,0,0,0,0|1,0,0]=3 7481 B13R1.20 CSCC(=O)Nc1cccc(c1)O 62a_200000210301_100011236192 [0,2,0,0,0,0|1,0,0]=3 7482 B13R1.20 Cc1cccc(c1)CC(=O)CC#N 1458a_100011206899_100011214920 [0,2,0,0,0,0|2,0,0]=4 7483 B13R1.20 Cc1cccc(c1)CC(=O)CC#N 1458a_100051588842_100000211840 [0,2,0,0,0,0|2,0,0]=4 7484 B13R1.20 Cc1cccc(c1)CC(=O)CCF 1458a_100011206899_100011217306 [0,2,0,0,0,0|2,0,0]=4 7485 B13R1.20 Cc1cccc(c1)CC(=O)CCO 1458a_100011206899_100000211926 [0,2,0,0,0,0|2,0,0]=4 7486 B13R1.20 Cc1cccc(c1)CC(=O)CCO 1458a_100011216618_100000211840 [0,2,0,0,0,0|2,0,0]=4 7487 B13R1.20 Cc1cccc(c1)NC(=O)CC#N 1626a_100000188690_100051588842 [0,2,0,0,0,0|2,0,0]=4 7488 B13R1.20 Cc1cccc(c1)NC(=O)CC#N 22a_100000188690_100051588842 [0,2,0,0,0,0|2,0,0]=4 7489 B13R1.20 Cc1cccc(c1)NC(=O)CCO 22a_100000188690_100011216618 [0,2,0,0,0,0|2,0,0]=4 7490 B13R1.20 Cc1cccc(c1)NC(=O)CO[13CH3] 34a_100000749660_200025704644 [0,2,0,0,0,0|2,0,0]=4 7491 B13R1.20 Cc1cccc(c1)NC(=O)CS[13CH3] 62a_100000243722_200025704644 [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.20 Cc1cccc(c1)NC(=O)CS[13CH3] 62a_200025704644_100000182861 [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.20 N#CCC(=O)Cc1cccc(c1)Br 1458a_100000747190_100011214920 [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.20 N#CCC(=O)Cc1cccc(c1)Br 1458a_100051588842_100000211773 [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.20 N#CCC(=O)Cc1cccc(c1)Cl 1458a_100000749307_100011214920 [0,2,0,0,0,0|2,0,0]=4 7496 B13R1.20 N#CCC(=O)Cc1cccc(c1)Cl 1458a_100051588842_100000181238 [0,2,0,0,0,0|2,0,0]=4 7497 B13R1.20 N#CCC(=O)Cc1cccc(c1)F 1458a_100000211661_100011214920 [0,2,0,0,0,0|2,0,0]=4 7498 B13R1.20 N#CCC(=O)Cc1cccc(c1)F 1458a_100051588842_100000230114 [0,2,0,0,0,0|2,0,0]=4 7499 B13R1.20 N#CCC(=O)Cc1cccc(c1)I 1458a_100000238430_100011214920 [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.20 N#CCC(=O)Cc1cccc(c1)I 1458a_100051588842_100011218688 [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.20 N#CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100011214920 [0,2,0,0,0,0|1,0,0]=3 7502 B13R1.20 N#CCC(=O)Cc1cccc(c1)O 1458a_100051588842_100011660834 [0,2,0,0,0,0|1,0,0]=3 7503 B13R1.20 N#CCC(=O)Nc1cccc(c1)Br 1626a_100000210019_100051588842 [0,2,0,0,0,0|2,0,0]=4 7504 B13R1.20 N#CCC(=O)Nc1cccc(c1)Br 22a_100000210019_100051588842 [0,2,0,0,0,0|2,0,0]=4 7505 B13R1.20 N#CCC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100051588842 [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.20 N#CCC(=O)Nc1cccc(c1)Cl 22a_100000185859_100051588842 [0,2,0,0,0,0|2,0,0]=4 7507 B13R1.20 N#CCC(=O)Nc1cccc(c1)F 1626a_100000210047_100051588842 [0,2,0,0,0,0|2,0,0]=4 7508 B13R1.20 N#CCC(=O)Nc1cccc(c1)F 22a_100000210047_100051588842 [0,2,0,0,0,0|2,0,0]=4 7509 B13R1.20 N#CCC(=O)Nc1cccc(c1)I 1626a_100000211102_100051588842 [0,2,0,0,0,0|2,0,0]=4 7510 B13R1.20 N#CCC(=O)Nc1cccc(c1)I 22a_100000211102_100051588842 [0,2,0,0,0,0|2,0,0]=4 7511 B13R1.20 N#CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100051588842 [0,2,0,0,0,0|1,0,0]=3 7512 B13R1.20 N#CCC(=O)Nc1cccc(c1)O 22a_100000210217_100051588842 [0,2,0,0,0,0|1,0,0]=3 7513 B13R1.20 O=C(C=CBr)Cc1cccc(c1)O 1458a_100016273825_100011660834 [0,2,0,0,0,0|1,0,1]=4 7514 B13R1.20 O=C(C=CBr)Nc1cccc(c1)O 1626a_100000210217_100016273825 [0,2,0,0,0,0|1,0,1]=4 7515 B13R1.20 O=C(C=CCl)Cc1cccc(c1)O 1458a_200016279998_100011660834 [0,2,0,0,0,0|1,0,1]=4 7516 B13R1.20 O=C(C=CCl)Nc1cccc(c1)O 1626a_100000210217_200016279998 [0,2,0,0,0,0|1,0,1]=4 7517 B13R1.20 O=C(C=CI)Cc1cccc(c1)O 1458a_100016256311_100011660834 [0,2,0,0,0,0|1,0,1]=4 7518 B13R1.20 O=C(C=CI)Nc1cccc(c1)O 1626a_100000210217_100016256311 [0,2,0,0,0,0|1,0,1]=4 7519 B13R1.20 O=C(CCF)Cc1cccc(c1)Br 1458a_100000747190_100011217306 [0,2,0,0,0,0|2,0,0]=4 7520 B13R1.20 O=C(CCF)Cc1cccc(c1)Cl 1458a_100000749307_100011217306 [0,2,0,0,0,0|2,0,0]=4 7521 B13R1.20 O=C(CCF)Cc1cccc(c1)F 1458a_100000211661_100011217306 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.20 O=C(CCF)Cc1cccc(c1)I 1458a_100000238430_100011217306 [0,2,0,0,0,0|2,0,0]=4 7523 B13R1.20 O=C(CCF)Cc1cccc(c1)O 1458a_100000745134_100011217306 [0,2,0,0,0,0|1,0,0]=3 7524 B13R1.20 O=C(CCO)Cc1cccc(c1)Br 1458a_100000747190_100000211926 [0,2,0,0,0,0|2,0,0]=4 7525 B13R1.20 O=C(CCO)Cc1cccc(c1)Br 1458a_100011216618_100000211773 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.20 O=C(CCO)Cc1cccc(c1)Cl 1458a_100000749307_100000211926 [0,2,0,0,0,0|2,0,0]=4 7527 B13R1.20 O=C(CCO)Cc1cccc(c1)Cl 1458a_100011216618_100000181238 [0,2,0,0,0,0|2,0,0]=4 7528 B13R1.20 O=C(CCO)Cc1cccc(c1)F 1458a_100000211661_100000211926 [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.20 O=C(CCO)Cc1cccc(c1)F 1458a_100011216618_100000230114 [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.20 O=C(CCO)Cc1cccc(c1)I 1458a_100000238430_100000211926 [0,2,0,0,0,0|2,0,0]=4 7531 B13R1.20 O=C(CCO)Cc1cccc(c1)I 1458a_100011216618_100011218688 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100000745134_100000211926 [0,2,0,0,0,0|1,0,0]=3 7533 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100011216618_100011660834 [0,2,0,0,0,0|1,0,0]=3 7534 B13R1.20 O=C(CCO)Nc1cccc(c1)Br 22a_100000210019_100011216618 [0,2,0,0,0,0|2,0,0]=4 7535 B13R1.20 O=C(CCO)Nc1cccc(c1)Cl 22a_100000185859_100011216618 [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.20 O=C(CCO)Nc1cccc(c1)F 22a_100000210047_100011216618 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.20 O=C(CCO)Nc1cccc(c1)I 22a_100000211102_100011216618 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.20 O=C(CCO)Nc1cccc(c1)O 22a_100000210217_100011216618 [0,2,0,0,0,0|1,0,0]=3 7539 B13R1.20 [13CH3]NCC(=O)Nc1cccc(c1)Cl 2230a_100102560372_200025704644 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.20 [13CH3]NCC(=O)Nc1cccc(c1)F 2230a_100000168492_200025704644 [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.20 [13CH3]NCC(=O)Nc1cccc(c1)F 34a_100000168492_200025704644 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)Br 62a_100000183509_200025704644 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)Br 62a_200025704644_100000183509 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)Cl 62a_200025704644_100000182995 [0,2,0,0,0,0|2,0,0]=4 7545 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)F 62a_100000183335_200025704644 [0,2,0,0,0,0|2,0,0]=4 7546 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)F 62a_200025704644_100000183335 [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.20 [13CH3]SCC(=O)Nc1cccc(c1)O 62a_200025704644_100011236192 [0,2,0,0,0,0|1,0,0]=3 7548 B13R1.22 CC(C(=O)CF)c1cccc(c1)Br 1458a_100000722698_100015361967 [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.22 CC(C(=O)CF)c1cccc(c1)Cl 1458a_100000762818_100015361967 [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.22 CC(C(=O)CF)c1cccc(c1)F 1458a_100000762896_100015361967 [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.22 CCC(=O)C(C)c1cccc(c1)Br 1458a_100000722698_100000210202 [0,2,0,0,0,0|2,0,0]=4 7552 B13R1.22 CCC(=O)C(C)c1cccc(c1)Cl 1458a_100000762818_100000210202 [0,2,0,0,0,0|2,0,0]=4 7553 B13R1.22 CCC(=O)C(C)c1cccc(c1)F 1458a_100000762896_100000210202 [0,2,0,0,0,0|2,0,0]=4 7554 B13R1.22 CCC(=O)C(O)c1cccc(c1)C 1458a_100011434945_100000210202 [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.22 CCC(=O)C(O)c1cccc(c1)Cl 1458a_100011216955_100000210202 [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.22 CCC(=O)C(O)c1cccc(c1)F 1458a_100011434943_100000210202 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 11a_100000219648_100000210414 [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 1626a_100000219648_100000210414 [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 22a_100000219648_100000210414 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.22 CCC(=O)N(C)c1cccc(c1)Br 527a_100000219648_100000210414 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.22 CCC(=O)N(C)c1cccc(c1)C 11a_100000219674_100000210414 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.22 CCC(=O)N(C)c1cccc(c1)C 1626a_100000219674_100000210414 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.22 CCC(=O)N(C)c1cccc(c1)C 22a_100000219674_100000210414 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.22 CCC(=O)N(C)c1cccc(c1)Cl 11a_100000220044_100000210414 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.22 CCC(=O)N(C)c1cccc(c1)Cl 1626a_100000220044_100000210414 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.22 CCC(=O)N(C)c1cccc(c1)Cl 22a_100000220044_100000210414 [0,2,0,0,0,0|2,0,0]=4 7567 B13R1.22 CCC(=O)N(C)c1cccc(c1)F 11a_100020633736_100000210414 [0,2,0,0,0,0|2,0,0]=4 7568 B13R1.22 CCC(=O)N(C)c1cccc(c1)F 1626a_100020633736_100000210414 [0,2,0,0,0,0|2,0,0]=4 7569 B13R1.22 CCC(=O)N(C)c1cccc(c1)F 22a_100020633736_100000210414 [0,2,0,0,0,0|2,0,0]=4 7570 B13R1.22 CCC(=O)N(C)c1cccc(c1)I 11a_100000221217_100000210414 [0,2,0,0,0,0|2,0,0]=4 7571 B13R1.22 CCC(=O)N(C)c1cccc(c1)I 1626a_100000221217_100000210414 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.22 CCC(=O)N(C)c1cccc(c1)I 22a_100000221217_100000210414 [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.22 CCC(=O)N(C)c1cccc(c1)O 527a_100000756613_100000210414 [0,2,0,0,0,0|1,0,0]=3 7574 B13R1.22 CCC(=O)[C@H](C)c1cccc(c1)C 1458a_200009911544_100000210202 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.22 CN(C(=O)CO)c1cccc(c1)Br 22a_100000219648_100000210174 [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.22 CN(C(=O)CO)c1cccc(c1)Br 527a_100000219648_100000210174 [0,2,0,0,0,0|2,0,0]=4 7577 B13R1.22 CN(C(=O)CO)c1cccc(c1)Cl 22a_100000220044_100000210174 [0,2,0,0,0,0|2,0,0]=4 7578 B13R1.22 CN(C(=O)CO)c1cccc(c1)F 22a_100020633736_100000210174 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.22 CN(C(=O)CO)c1cccc(c1)I 22a_100000221217_100000210174 [0,2,0,0,0,0|2,0,0]=4 7580 B13R1.22 CN(C(=O)CO)c1cccc(c1)O 527a_100000756613_100000210174 [0,2,0,0,0,0|1,0,0]=3 7581 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 11a_106832991635_100000722698 [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 1626a_100102657272_100000722698 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 240690a_100102657272_100000722698 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.22 CNC(=O)C(C)c1cccc(c1)Br 527a_100102657272_100000722698 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 11a_106832991635_100000762818 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 1626a_100102657272_100000762818 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 240690a_100102657272_100000762818 [0,2,0,0,0,0|2,0,0]=4 7588 B13R1.22 CNC(=O)C(C)c1cccc(c1)Cl 527a_100102657272_100000762818 [0,2,0,0,0,0|2,0,0]=4 7589 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 11a_106832991635_100000762896 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 1626a_100102657272_100000762896 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 240690a_100102657272_100000762896 [0,2,0,0,0,0|2,0,0]=4 7592 B13R1.22 CNC(=O)C(C)c1cccc(c1)F 527a_100102657272_100000762896 [0,2,0,0,0,0|2,0,0]=4 7593 B13R1.22 CNC(=O)C(O)c1cccc(c1)C 240690a_100102657272_100011434945 [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.22 CNC(=O)C(O)c1cccc(c1)Cl 240690a_100102657272_100011216955 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.22 CNC(=O)C(O)c1cccc(c1)F 240690a_100102657272_100011434943 [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.22 CNC(=O)N(C)c1cccc(c1)Br 512a_100000219648_100102657272 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.22 CNC(=O)N(C)c1cccc(c1)Br 512a_106832991638_100000219648 [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.22 CNC(=O)N(C)c1cccc(c1)C 512a_100000219674_100102657272 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.22 CNC(=O)N(C)c1cccc(c1)C 512a_106832991638_100000219674 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.22 CNC(=O)N(C)c1cccc(c1)Cl 512a_100000220044_100102657272 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.22 CNC(=O)N(C)c1cccc(c1)F 512a_100020633736_100102657272 [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.22 CNC(=O)N(C)c1cccc(c1)I 512a_100000221217_100102657272 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.22 CNC(=O)N(C)c1cccc(c1)I 512a_106832991638_100000221217 [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.22 CNC(=O)N(C)c1cccc(c1)O 512a_100000756613_100102657272 [0,2,0,0,0,0|1,0,0]=3 7605 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 11a_106832991635_200009911544 [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 1626a_100102657272_200009911544 [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 240690a_100102657272_200009911544 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.22 CNC(=O)[C@H](C)c1cccc(c1)C 527a_100102657272_200009911544 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.22 COC(=O)C(=O)c1cccc(c1)O 271570a_203496583355_100000699548 [0,2,0,0,0,0|1,0,0]=3 7610 B13R1.22 COC(=O)C(C)c1cccc(c1)O 271570a_203496583355_100010077029 [0,2,0,0,0,0|1,0,0]=3 7611 B13R1.22 COC(=O)C(N)c1cccc(c1)O 271570a_203496583355_100015207118 [0,2,0,0,0,0|1,0,0]=3 7612 B13R1.22 Cc1cccc(c1)C(O)C(=O)CF 1458a_100011434945_100015361967 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.22 Cc1cccc(c1)N(C)C(=O)CO 22a_100000219674_100000210174 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.22 Cc1cccc(c1)[C@@H](C)C(=O)CF 1458a_200009911544_100015361967 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.22 O=C(CF)C(O)c1cccc(c1)Cl 1458a_100011216955_100015361967 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.22 O=C(CF)C(O)c1cccc(c1)F 1458a_100011434943_100015361967 [0,2,0,0,0,0|2,0,0]=4 7617 B13R1.40 C=CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000185746 [0,2,0,0,0,0|1,0,1]=4 7618 B13R1.40 C=CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000185746 [0,2,0,0,0,0|1,0,1]=4 7619 B13R1.40 C=CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000185746 [0,2,0,0,0,0|1,0,1]=4 7620 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100000210414_200012349612 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210202 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.40 CCC(=O)Cc1cccc(c1Br)Cl 1458a_100000210414_100010145525 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.40 CCC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_100000210202 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.40 CCC(=O)Cc1cccc(c1Br)F 1458a_100000210414_100012351116 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.40 CCC(=O)Cc1cccc(c1Br)F 1458a_100012356664_100000210202 [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.40 CCC(=O)Cc1cccc(c1Br)I 1458a_100000210414_100010254545 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.40 CCC(=O)Cc1cccc(c1C)Br 1458a_100000210414_100000694682 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100000210414_100011515928 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210202 [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.40 CCC(=O)Cc1cccc(c1C)Cl 1458a_100000210414_100012186920 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.40 CCC(=O)Cc1cccc(c1C)F 1458a_100000035905_100000210202 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.40 CCC(=O)Cc1cccc(c1C)F 1458a_100000210414_100009813626 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.40 CCC(=O)Cc1cccc(c1C)I 1458a_100000210414_100010150147 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Br 1458a_100000210414_100012349491 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_100000210202 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000210414_100000720918 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.40 CCC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_100000210202 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.40 CCC(=O)Cc1cccc(c1Cl)F 1458a_100000210414_100000696688 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.40 CCC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_100000210202 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.40 CCC(=O)Cc1cccc(c1F)Br 1458a_100000210414_100012356507 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.40 CCC(=O)Cc1cccc(c1F)Br 1458a_100011935088_100000210202 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.40 CCC(=O)Cc1cccc(c1F)C 1458a_100000210414_100011216058 [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.40 CCC(=O)Cc1cccc(c1F)Cl 1458a_100000210414_100000716733 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.40 CCC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_100000210202 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.40 CCC(=O)Cc1cccc(c1F)F 1458a_100000210414_100000217499 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.40 CCC(=O)Cc1cccc(c1F)F 1458a_100000684727_100000210202 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.40 CCC(=O)Cc1cccc(c1I)F 1458a_100000210414_100010149603 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.40 CCC(=O)Nc1cccc(c1Br)C 11a_100000684715_100000210414 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.40 CCC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100000210414 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.40 CCC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000210414 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.40 CCC(=O)Nc1cccc(c1Br)Cl 11a_100000687072_100000210414 [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.40 CCC(=O)Nc1cccc(c1Br)Cl 1626a_100000687072_100000210414 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.40 CCC(=O)Nc1cccc(c1Br)F 11a_100011934729_100000210414 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.40 CCC(=O)Nc1cccc(c1Br)F 1626a_100011934729_100000210414 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.40 CCC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000210414 [0,2,0,0,0,0|1,0,0]=3 7656 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 11a_100000750434_100000210414 [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 1626a_100000750434_100000210414 [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 22a_100000750434_100000210414 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.40 CCC(=O)Nc1cccc(c1C)Br 527a_100000750434_100000210414 [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.40 CCC(=O)Nc1cccc(c1C)C 11a_100000210026_100000210414 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.40 CCC(=O)Nc1cccc(c1C)C 1626a_100000210026_100000210414 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.40 CCC(=O)Nc1cccc(c1C)C 22a_100000210026_100000210414 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.40 CCC(=O)Nc1cccc(c1C)C 527a_100000210026_100000210414 [0,2,0,0,0,0|2,0,0]=4 7664 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 11a_100000210441_100000210414 [0,2,0,0,0,0|2,0,0]=4 7665 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 1626a_100000210441_100000210414 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 22a_100000210441_100000210414 [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.40 CCC(=O)Nc1cccc(c1C)Cl 527a_100000210441_100000210414 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.40 CCC(=O)Nc1cccc(c1C)F 11a_100000745574_100000210414 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.40 CCC(=O)Nc1cccc(c1C)F 1626a_100000745574_100000210414 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.40 CCC(=O)Nc1cccc(c1C)F 22a_100000745574_100000210414 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.40 CCC(=O)Nc1cccc(c1C)F 527a_100000745574_100000210414 [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.40 CCC(=O)Nc1cccc(c1C)I 11a_100000761887_100000210414 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.40 CCC(=O)Nc1cccc(c1C)I 1626a_100000761887_100000210414 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.40 CCC(=O)Nc1cccc(c1C)I 22a_100000761887_100000210414 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.40 CCC(=O)Nc1cccc(c1C)I 527a_100000761887_100000210414 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.40 CCC(=O)Nc1cccc(c1C)O 11a_100011216573_100000210414 [0,2,0,0,0,0|1,0,0]=3 7677 B13R1.40 CCC(=O)Nc1cccc(c1C)O 22a_100011216573_100000210414 [0,2,0,0,0,0|1,0,0]=3 7678 B13R1.40 CCC(=O)Nc1cccc(c1C)O 527a_100011216573_100000210414 [0,2,0,0,0,0|1,0,0]=3 7679 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Br 11a_100000687075_100000210414 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Br 1626a_100000687075_100000210414 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Br 527a_100000687075_100000210414 [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.40 CCC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100000210414 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.40 CCC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100000210414 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.40 CCC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000210414 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Cl 11a_100000185733_100000210414 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.40 CCC(=O)Nc1cccc(c1Cl)Cl 1626a_100000185733_100000210414 [0,2,0,0,0,0|2,0,0]=4 7687 B13R1.40 CCC(=O)Nc1cccc(c1Cl)F 11a_100000692321_100000210414 [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.40 CCC(=O)Nc1cccc(c1Cl)F 1626a_100000692321_100000210414 [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.40 CCC(=O)Nc1cccc(c1Cl)F 22a_100000692321_100000210414 [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.40 CCC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000210414 [0,2,0,0,0,0|1,0,0]=3 7691 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 11a_100011935091_100000210414 [0,2,0,0,0,0|2,0,0]=4 7692 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 1626a_100011935091_100000210414 [0,2,0,0,0,0|2,0,0]=4 7693 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 22a_100011935091_100000210414 [0,2,0,0,0,0|2,0,0]=4 7694 B13R1.40 CCC(=O)Nc1cccc(c1F)Br 527a_100011935091_100000210414 [0,2,0,0,0,0|2,0,0]=4 7695 B13R1.40 CCC(=O)Nc1cccc(c1F)C 11a_100000697159_100000210414 [0,2,0,0,0,0|2,0,0]=4 7696 B13R1.40 CCC(=O)Nc1cccc(c1F)C 1626a_100000697159_100000210414 [0,2,0,0,0,0|2,0,0]=4 7697 B13R1.40 CCC(=O)Nc1cccc(c1F)C 527a_100000697159_100000210414 [0,2,0,0,0,0|2,0,0]=4 7698 B13R1.40 CCC(=O)Nc1cccc(c1F)Cl 11a_100000199060_100000210414 [0,2,0,0,0,0|2,0,0]=4 7699 B13R1.40 CCC(=O)Nc1cccc(c1F)Cl 1626a_100000199060_100000210414 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.40 CCC(=O)Nc1cccc(c1F)Cl 22a_100000199060_100000210414 [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.40 CCC(=O)Nc1cccc(c1F)F 11a_100000743855_100000210414 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.40 CCC(=O)Nc1cccc(c1F)F 1626a_100000743855_100000210414 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.40 CCC(=O)Nc1cccc(c1F)F 22a_100000743855_100000210414 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.40 CCC(=O)Nc1cccc(c1I)Br 11a_100020590159_100000210414 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.40 CCC(=O)Nc1cccc(c1I)Br 1626a_100020590159_100000210414 [0,2,0,0,0,0|2,0,0]=4 7706 B13R1.40 CCC(=O)Nc1cccc(c1I)C 11a_100000761888_100000210414 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.40 CCC(=O)Nc1cccc(c1I)C 1626a_100000761888_100000210414 [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.40 CCC(=O)Nc1cccc(c1I)Cl 11a_100000049713_100000210414 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.40 CCC(=O)Nc1cccc(c1I)Cl 1626a_100000049713_100000210414 [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.40 CCC(=O)Nc1cccc(c1I)F 11a_100000690935_100000210414 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.40 CCC(=O)Nc1cccc(c1I)F 1626a_100000690935_100000210414 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.40 CCC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000210414 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.40 CCC(=O)Nc1cccc(c1O)Br 527a_100011934915_100000210414 [0,2,0,0,0,0|2,0,0]=4 7714 B13R1.40 CCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000210414 [0,2,0,0,0,0|2,0,0]=4 7715 B13R1.40 CCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000210414 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.40 CCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000210414 [0,2,0,0,0,0|2,0,0]=4 7717 B13R1.40 CCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000210414 [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.40 CCC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000210414 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.40 CCC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100000210414 [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.40 CCC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000210414 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.40 CCC(=O)Nc1cccc(c1O)F 22a_100011934987_100000210414 [0,2,0,0,0,0|2,0,0]=4 7722 B13R1.40 CCC(=O)Nc1cccc(c1O)F 527a_100011934987_100000210414 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.40 CCC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000210414 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.40 CCC(=O)Nc1cccc(c1O)I 22a_100010084371_100000210414 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.40 CCC(=O)Nc1cccc(c1O)I 527a_100010084371_100000210414 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 11a_106832991635_100010147021 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 1626a_100102657272_100010147021 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 240690a_100102657272_100010147021 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 527a_100102657272_100010147021 [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 11a_106832991635_100010145769 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 1626a_100102657272_100010145769 [0,2,0,0,0,0|2,0,0]=4 7732 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 240690a_100102657272_100010145769 [0,2,0,0,0,0|2,0,0]=4 7733 B13R1.40 CNC(=O)Cc1cccc(c1Br)Cl 527a_100102657272_100010145769 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 11a_106832991635_100012356664 [0,2,0,0,0,0|2,0,0]=4 7735 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 1626a_100102657272_100012356664 [0,2,0,0,0,0|2,0,0]=4 7736 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 240690a_100102657272_100012356664 [0,2,0,0,0,0|2,0,0]=4 7737 B13R1.40 CNC(=O)Cc1cccc(c1Br)F 527a_100102657272_100012356664 [0,2,0,0,0,0|2,0,0]=4 7738 B13R1.40 CNC(=O)Cc1cccc(c1C)C 11a_106832991635_100011698479 [0,2,0,0,0,0|2,0,0]=4 7739 B13R1.40 CNC(=O)Cc1cccc(c1C)C 1626a_100102657272_100011698479 [0,2,0,0,0,0|2,0,0]=4 7740 B13R1.40 CNC(=O)Cc1cccc(c1C)C 240690a_100102657272_100011698479 [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.40 CNC(=O)Cc1cccc(c1C)C 527a_100102657272_100011698479 [0,2,0,0,0,0|2,0,0]=4 7742 B13R1.40 CNC(=O)Cc1cccc(c1C)F 11a_106832991635_100000035905 [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.40 CNC(=O)Cc1cccc(c1C)F 1626a_100102657272_100000035905 [0,2,0,0,0,0|2,0,0]=4 7744 B13R1.40 CNC(=O)Cc1cccc(c1C)F 240690a_100102657272_100000035905 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.40 CNC(=O)Cc1cccc(c1C)F 527a_100102657272_100000035905 [0,2,0,0,0,0|2,0,0]=4 7746 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 11a_106832991635_100010145770 [0,2,0,0,0,0|2,0,0]=4 7747 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 1626a_100102657272_100010145770 [0,2,0,0,0,0|2,0,0]=4 7748 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 240690a_100102657272_100010145770 [0,2,0,0,0,0|2,0,0]=4 7749 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Br 527a_100102657272_100010145770 [0,2,0,0,0,0|2,0,0]=4 7750 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 11a_106832991635_100000759314 [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 1626a_100102657272_100000759314 [0,2,0,0,0,0|2,0,0]=4 7752 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 240690a_100102657272_100000759314 [0,2,0,0,0,0|2,0,0]=4 7753 B13R1.40 CNC(=O)Cc1cccc(c1Cl)Cl 527a_100102657272_100000759314 [0,2,0,0,0,0|2,0,0]=4 7754 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 11a_106832991635_100012001123 [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 1626a_100102657272_100012001123 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 240690a_100102657272_100012001123 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.40 CNC(=O)Cc1cccc(c1Cl)F 527a_100102657272_100012001123 [0,2,0,0,0,0|2,0,0]=4 7758 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 11a_106832991635_100011935088 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 1626a_100102657272_100011935088 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 240690a_100102657272_100011935088 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.40 CNC(=O)Cc1cccc(c1F)Br 527a_100102657272_100011935088 [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 11a_106832991635_100000709823 [0,2,0,0,0,0|2,0,0]=4 7763 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 1626a_100102657272_100000709823 [0,2,0,0,0,0|2,0,0]=4 7764 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 240690a_100102657272_100000709823 [0,2,0,0,0,0|2,0,0]=4 7765 B13R1.40 CNC(=O)Cc1cccc(c1F)Cl 527a_100102657272_100000709823 [0,2,0,0,0,0|2,0,0]=4 7766 B13R1.40 CNC(=O)Cc1cccc(c1F)F 11a_106832991635_100000684727 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.40 CNC(=O)Cc1cccc(c1F)F 1626a_100102657272_100000684727 [0,2,0,0,0,0|2,0,0]=4 7768 B13R1.40 CNC(=O)Cc1cccc(c1F)F 240690a_100102657272_100000684727 [0,2,0,0,0,0|2,0,0]=4 7769 B13R1.40 CNC(=O)Cc1cccc(c1F)F 527a_100102657272_100000684727 [0,2,0,0,0,0|2,0,0]=4 7770 B13R1.40 CNC(=O)Nc1cccc(c1Br)C 2430a_100000684715_100102657272 [0,2,0,0,0,0|2,0,0]=4 7771 B13R1.40 CNC(=O)Nc1cccc(c1Br)Cl 2430a_100000687072_100102657272 [0,2,0,0,0,0|2,0,0]=4 7772 B13R1.40 CNC(=O)Nc1cccc(c1Br)F 2430a_100011934729_100102657272 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.40 CNC(=O)Nc1cccc(c1Br)O 2430a_100012183704_100102657272 [0,2,0,0,0,0|1,0,0]=3 7774 B13R1.40 CNC(=O)Nc1cccc(c1C)Br 2430a_100000750434_100102657272 [0,2,0,0,0,0|2,0,0]=4 7775 B13R1.40 CNC(=O)Nc1cccc(c1C)C 2430a_100000210026_100102657272 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.40 CNC(=O)Nc1cccc(c1C)Cl 2430a_100000210441_100102657272 [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.40 CNC(=O)Nc1cccc(c1C)F 2430a_100000745574_100102657272 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.40 CNC(=O)Nc1cccc(c1C)I 2430a_100000761887_100102657272 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.40 CNC(=O)Nc1cccc(c1C)O 2430a_100011216573_100102657272 [0,2,0,0,0,0|1,0,0]=3 7780 B13R1.40 CNC(=O)Nc1cccc(c1Cl)Br 2430a_100000687075_100102657272 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.40 CNC(=O)Nc1cccc(c1Cl)C 2430a_100000765562_100102657272 [0,2,0,0,0,0|2,0,0]=4 7782 B13R1.40 CNC(=O)Nc1cccc(c1Cl)Cl 2430a_100000185733_100102657272 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.40 CNC(=O)Nc1cccc(c1Cl)F 2430a_100000692321_100102657272 [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.40 CNC(=O)Nc1cccc(c1Cl)O 2430a_100012002038_100102657272 [0,2,0,0,0,0|1,0,0]=3 7785 B13R1.40 CNC(=O)Nc1cccc(c1F)Br 2430a_100011935091_100102657272 [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.40 CNC(=O)Nc1cccc(c1F)Br 512a_100011935091_100102657272 [0,2,0,0,0,0|2,0,0]=4 7787 B13R1.40 CNC(=O)Nc1cccc(c1F)C 2430a_100000697159_100102657272 [0,2,0,0,0,0|2,0,0]=4 7788 B13R1.40 CNC(=O)Nc1cccc(c1F)C 512a_100000697159_100102657272 [0,2,0,0,0,0|2,0,0]=4 7789 B13R1.40 CNC(=O)Nc1cccc(c1F)Cl 2430a_100000199060_100102657272 [0,2,0,0,0,0|2,0,0]=4 7790 B13R1.40 CNC(=O)Nc1cccc(c1F)F 2430a_100000743855_100102657272 [0,2,0,0,0,0|2,0,0]=4 7791 B13R1.40 CNC(=O)Nc1cccc(c1F)F 512a_100000743855_100102657272 [0,2,0,0,0,0|2,0,0]=4 7792 B13R1.40 CNC(=O)Nc1cccc(c1I)Br 2430a_100020590159_100102657272 [0,2,0,0,0,0|2,0,0]=4 7793 B13R1.40 CNC(=O)Nc1cccc(c1I)Br 512a_100020590159_100102657272 [0,2,0,0,0,0|2,0,0]=4 7794 B13R1.40 CNC(=O)Nc1cccc(c1I)C 2430a_100000761888_100102657272 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.40 CNC(=O)Nc1cccc(c1I)Cl 2430a_100000049713_100102657272 [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.40 CNC(=O)Nc1cccc(c1I)F 512a_100000690935_100102657272 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.40 CNC(=O)Nc1cccc(c1O)Br 2430a_100011934915_100102657272 [0,2,0,0,0,0|2,0,0]=4 7798 B13R1.40 CNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100102657272 [0,2,0,0,0,0|2,0,0]=4 7799 B13R1.40 CNC(=O)Nc1cccc(c1O)Cl 2430a_100000754742_100102657272 [0,2,0,0,0,0|2,0,0]=4 7800 B13R1.40 CNC(=O)Nc1cccc(c1O)F 2430a_100011934987_100102657272 [0,2,0,0,0,0|2,0,0]=4 7801 B13R1.40 CNC(=O)Nc1cccc(c1O)I 2430a_100010084371_100102657272 [0,2,0,0,0,0|2,0,0]=4 7802 B13R1.40 COC(=O)Cc1cccc(c1F)O 271570a_203496583355_100010741560 [0,2,0,0,0,0|1,0,0]=3 7803 B13R1.40 COC(=O)Cc1cccc(c1O)C 271570a_203496583355_200010150888 [0,2,0,0,0,0|2,0,0]=4 7804 B13R1.40 COC(=O)Cc1cccc(c1O)O 271570a_203496583355_100010150830 [0,2,0,0,0,0|1,0,0]=3 7805 B13R1.40 Cc1c(cccc1CC(=O)CF)F 1458a_100000035905_100015361967 [0,2,0,0,0,0|2,0,0]=4 7806 B13R1.40 Cc1c(cccc1CC(=O)CO)Br 1458a_100000210174_100000694682 [0,2,0,0,0,0|2,0,0]=4 7807 B13R1.40 Cc1c(cccc1CC(=O)CO)Cl 1458a_100000210174_100012186920 [0,2,0,0,0,0|2,0,0]=4 7808 B13R1.40 Cc1c(cccc1CC(=O)CO)F 1458a_100000210174_100009813626 [0,2,0,0,0,0|2,0,0]=4 7809 B13R1.40 Cc1c(cccc1CC(=O)CO)I 1458a_100000210174_100010150147 [0,2,0,0,0,0|2,0,0]=4 7810 B13R1.40 Cc1c(cccc1NC(=O)CO)Br 22a_100000750434_100000210174 [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.40 Cc1c(cccc1NC(=O)CO)Br 527a_100000750434_100000210174 [0,2,0,0,0,0|2,0,0]=4 7812 B13R1.40 Cc1c(cccc1NC(=O)CO)Cl 22a_100000210441_100000210174 [0,2,0,0,0,0|2,0,0]=4 7813 B13R1.40 Cc1c(cccc1NC(=O)CO)Cl 527a_100000210441_100000210174 [0,2,0,0,0,0|2,0,0]=4 7814 B13R1.40 Cc1c(cccc1NC(=O)CO)F 22a_100000745574_100000210174 [0,2,0,0,0,0|2,0,0]=4 7815 B13R1.40 Cc1c(cccc1NC(=O)CO)F 527a_100000745574_100000210174 [0,2,0,0,0,0|2,0,0]=4 7816 B13R1.40 Cc1c(cccc1NC(=O)CO)I 22a_100000761887_100000210174 [0,2,0,0,0,0|2,0,0]=4 7817 B13R1.40 Cc1c(cccc1NC(=O)CO)I 527a_100000761887_100000210174 [0,2,0,0,0,0|2,0,0]=4 7818 B13R1.40 Cc1c(cccc1NC(=O)CO)O 22a_100011216573_100000210174 [0,2,0,0,0,0|1,0,0]=3 7819 B13R1.40 Cc1c(cccc1NC(=O)CO)O 527a_100011216573_100000210174 [0,2,0,0,0,0|1,0,0]=3 7820 B13R1.40 Cc1cccc(c1Br)CC(=O)CF 1458a_100010147021_100015361967 [0,2,0,0,0,0|2,0,0]=4 7821 B13R1.40 Cc1cccc(c1Br)CC(=O)CO 1458a_100000210174_200012349612 [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.40 Cc1cccc(c1Br)NC(=O)CO 22a_100000684715_100000210174 [0,2,0,0,0,0|2,0,0]=4 7823 B13R1.40 Cc1cccc(c1C)CC(=O)CF 1458a_100011698479_100015361967 [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.40 Cc1cccc(c1C)CC(=O)CO 1458a_100000210174_100011515928 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.40 Cc1cccc(c1C)NC(=O)CO 22a_100000210026_100000210174 [0,2,0,0,0,0|2,0,0]=4 7826 B13R1.40 Cc1cccc(c1C)NC(=O)CO 527a_100000210026_100000210174 [0,2,0,0,0,0|2,0,0]=4 7827 B13R1.40 Cc1cccc(c1Cl)NC(=O)CO 22a_100000765562_100000210174 [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.40 Cc1cccc(c1F)CC(=O)CO 1458a_100000210174_100011216058 [0,2,0,0,0,0|2,0,0]=4 7829 B13R1.40 Cc1cccc(c1F)NC(=O)CO 527a_100000697159_100000210174 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.40 Cc1cccc(c1O)NC(=O)CO 22a_100000756359_100000210174 [0,2,0,0,0,0|2,0,0]=4 7831 B13R1.40 Cc1cccc(c1O)NC(=O)CO 527a_100000756359_100000210174 [0,2,0,0,0,0|2,0,0]=4 7832 B13R1.40 O=C(CF)Cc1cccc(c1Br)Cl 1458a_100010145769_100015361967 [0,2,0,0,0,0|2,0,0]=4 7833 B13R1.40 O=C(CF)Cc1cccc(c1Br)F 1458a_100012356664_100015361967 [0,2,0,0,0,0|2,0,0]=4 7834 B13R1.40 O=C(CF)Cc1cccc(c1Cl)Br 1458a_100010145770_100015361967 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.40 O=C(CF)Cc1cccc(c1Cl)Cl 1458a_100000759314_100015361967 [0,2,0,0,0,0|2,0,0]=4 7836 B13R1.40 O=C(CF)Cc1cccc(c1Cl)F 1458a_100012001123_100015361967 [0,2,0,0,0,0|2,0,0]=4 7837 B13R1.40 O=C(CF)Cc1cccc(c1F)Br 1458a_100011935088_100015361967 [0,2,0,0,0,0|2,0,0]=4 7838 B13R1.40 O=C(CF)Cc1cccc(c1F)Cl 1458a_100000709823_100015361967 [0,2,0,0,0,0|2,0,0]=4 7839 B13R1.40 O=C(CF)Cc1cccc(c1F)F 1458a_100000684727_100015361967 [0,2,0,0,0,0|2,0,0]=4 7840 B13R1.40 O=C(CO)Cc1cccc(c1Br)Cl 1458a_100000210174_100010145525 [0,2,0,0,0,0|2,0,0]=4 7841 B13R1.40 O=C(CO)Cc1cccc(c1Br)F 1458a_100000210174_100012351116 [0,2,0,0,0,0|2,0,0]=4 7842 B13R1.40 O=C(CO)Cc1cccc(c1Br)I 1458a_100000210174_100010254545 [0,2,0,0,0,0|2,0,0]=4 7843 B13R1.40 O=C(CO)Cc1cccc(c1Cl)Br 1458a_100000210174_100012349491 [0,2,0,0,0,0|2,0,0]=4 7844 B13R1.40 O=C(CO)Cc1cccc(c1Cl)Cl 1458a_100000210174_100000720918 [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.40 O=C(CO)Cc1cccc(c1Cl)F 1458a_100000210174_100000696688 [0,2,0,0,0,0|2,0,0]=4 7846 B13R1.40 O=C(CO)Cc1cccc(c1F)Br 1458a_100000210174_100012356507 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.40 O=C(CO)Cc1cccc(c1F)Cl 1458a_100000210174_100000716733 [0,2,0,0,0,0|2,0,0]=4 7848 B13R1.40 O=C(CO)Cc1cccc(c1F)F 1458a_100000210174_100000217499 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.40 O=C(CO)Cc1cccc(c1I)F 1458a_100000210174_100010149603 [0,2,0,0,0,0|2,0,0]=4 7850 B13R1.40 O=C(CO)Nc1cccc(c1Br)O 22a_100012183704_100000210174 [0,2,0,0,0,0|1,0,0]=3 7851 B13R1.40 O=C(CO)Nc1cccc(c1Cl)Br 527a_100000687075_100000210174 [0,2,0,0,0,0|2,0,0]=4 7852 B13R1.40 O=C(CO)Nc1cccc(c1Cl)F 22a_100000692321_100000210174 [0,2,0,0,0,0|2,0,0]=4 7853 B13R1.40 O=C(CO)Nc1cccc(c1Cl)O 22a_100012002038_100000210174 [0,2,0,0,0,0|1,0,0]=3 7854 B13R1.40 O=C(CO)Nc1cccc(c1F)Br 22a_100011935091_100000210174 [0,2,0,0,0,0|2,0,0]=4 7855 B13R1.40 O=C(CO)Nc1cccc(c1F)Br 527a_100011935091_100000210174 [0,2,0,0,0,0|2,0,0]=4 7856 B13R1.40 O=C(CO)Nc1cccc(c1F)Cl 22a_100000199060_100000210174 [0,2,0,0,0,0|2,0,0]=4 7857 B13R1.40 O=C(CO)Nc1cccc(c1F)F 22a_100000743855_100000210174 [0,2,0,0,0,0|2,0,0]=4 7858 B13R1.40 O=C(CO)Nc1cccc(c1O)Br 22a_100011934915_100000210174 [0,2,0,0,0,0|2,0,0]=4 7859 B13R1.40 O=C(CO)Nc1cccc(c1O)Br 527a_100011934915_100000210174 [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.40 O=C(CO)Nc1cccc(c1O)Cl 22a_100000754742_100000210174 [0,2,0,0,0,0|2,0,0]=4 7861 B13R1.40 O=C(CO)Nc1cccc(c1O)Cl 527a_100000754742_100000210174 [0,2,0,0,0,0|2,0,0]=4 7862 B13R1.40 O=C(CO)Nc1cccc(c1O)F 22a_100011934987_100000210174 [0,2,0,0,0,0|2,0,0]=4 7863 B13R1.40 O=C(CO)Nc1cccc(c1O)F 527a_100011934987_100000210174 [0,2,0,0,0,0|2,0,0]=4 7864 B13R1.40 O=C(CO)Nc1cccc(c1O)I 22a_100010084371_100000210174 [0,2,0,0,0,0|2,0,0]=4 7865 B13R1.40 O=C(CO)Nc1cccc(c1O)I 527a_100010084371_100000210174 [0,2,0,0,0,0|2,0,0]=4 7866 B13R1.81 C#CC(=O)Cc1cccc(c1)CO 1458a_100000211873_100010188025 [0,2,0,0,0,0|1,0,1]=4 7867 B13R1.81 C#CC(=O)Cc1cccc(c1)OC 1458a_100000211873_100000211672 [0,2,0,0,0,0|1,0,1]=4 7868 B13R1.81 C#CC(C)Oc1cccc(c1)CO 34a_100011214949_200000035995 [0,2,0,0,0,0|1,0,1]=4 7869 B13R1.81 C#CC(C)Oc1cccc(c1)OC 34a_100000211255_200000035995 [0,2,0,0,0,0|1,0,1]=4 7870 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 11a_100000735509_100000210414 [0,2,0,0,0,0|2,0,0]=4 7871 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 1626a_100000735509_100000210414 [0,2,0,0,0,0|2,0,0]=4 7872 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 22a_100000735509_100000210414 [0,2,0,0,0,0|2,0,0]=4 7873 B13R1.81 C#Cc1cccc(c1)NC(=O)CC 527a_100000735509_100000210414 [0,2,0,0,0,0|2,0,0]=4 7874 B13R1.81 C#Cc1cccc(c1)NC(=O)CO 22a_100000735509_100000210174 [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.81 C#Cc1cccc(c1)NC(=O)CO 527a_100000735509_100000210174 [0,2,0,0,0,0|2,0,0]=4 7876 B13R1.81 C#Cc1cccc(c1)NC(=O)NC 2430a_100000735509_100102657272 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.81 C#Cc1cccc(c1)NC(=O)NC 512a_100000735509_100102657272 [0,2,0,0,0,0|2,0,0]=4 7878 B13R1.81 C=CC(=O)Cc1cccc(c1)CO 1458a_100000185746_100010188025 [0,2,0,0,0,0|1,0,1]=4 7879 B13R1.81 C=CC(=O)Cc1cccc(c1)OC 1458a_100000185746_100000211672 [0,2,0,0,0,0|1,0,1]=4 7880 B13R1.81 C=CC(=O)Nc1cccc(c1)CO 22a_100000211919_100000185746 [0,2,0,0,0,0|1,0,1]=4 7881 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 1626a_100000210024_100000185746 [0,2,0,0,0,0|1,0,1]=4 7882 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 22a_100000210024_100000185746 [0,2,0,0,0,0|1,0,1]=4 7883 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 34a_100011235909_200000210301 [0,2,0,0,0,0|1,0,1]=4 7884 B13R1.81 C=CC(=O)Nc1cccc(c1)OC 7a_100011235909_200000210301 [0,2,0,0,0,0|1,0,1]=4 7885 B13R1.81 C=CC(=O)Nc1cccc(c1)O[13CH3] 34a_100011235909_200025704644 [0,2,0,0,0,0|1,0,1]=4 7886 B13R1.81 C=CC(=O)Nc1cccc(c1)O[13CH3] 7a_100011235909_200025704644 [0,2,0,0,0,0|1,0,1]=4 7887 B13R1.81 C=Cc1cccc(c1)CC(=O)OC 271570a_100011290941_100000699549 [0,2,0,0,0,0|2,0,0]=4 7888 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 11a_100011827668_100000210414 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 1626a_100011827668_100000210414 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 22a_100011827668_100000210414 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.81 C=Cc1cccc(c1)NC(=O)CC 527a_100011827668_100000210414 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.81 C=Cc1cccc(c1)NC(=O)CO 22a_100011827668_100000210174 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.81 C=Cc1cccc(c1)NC(=O)CO 527a_100011827668_100000210174 [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.81 C=Cc1cccc(c1)NC(=O)NC 2430a_100011827668_100102657272 [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.81 CC(C#N)Oc1cccc(c1)CO 7a_100011214949_100000703298 [0,2,0,0,0,0|1,0,1]=4 7896 B13R1.81 CC(CO)Oc1cccc(c1)CO 34a_100011214949_100012180447 [0,2,0,0,0,0|0,0,2]=4 7897 B13R1.81 CC(CO)Oc1cccc(c1)CO 7a_100011214949_100012180447 [0,2,0,0,0,0|0,0,2]=4 7898 B13R1.81 CCC(=O)Cc1cc(ccn1)OC 1458a_100000210414_100000752681 [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.81 CCC(=O)Cc1cccc(c1)C#N 1458a_100000210414_100000233786 [0,2,0,0,0,0|2,0,0]=4 7900 B13R1.81 CCC(=O)Cc1cccc(c1)C#N 1458a_100000684415_100000210202 [0,2,0,0,0,0|2,0,0]=4 7901 B13R1.81 CCC(=O)Cc1cccc(c1)C=O 1458a_100000210414_100009816774 [0,2,0,0,0,0|1,0,1]=4 7902 B13R1.81 CCC(=O)Cc1cccc(c1)CO 1458a_100000210414_100010188025 [0,2,0,0,0,0|1,0,0]=3 7903 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000210414_100000211672 [0,2,0,0,0,0|1,0,0]=3 7904 B13R1.81 CCC(=O)Cc1cccc(c1)OC 1458a_100000211281_100000210202 [0,2,0,0,0,0|1,0,0]=3 7905 B13R1.81 CCC(=O)Cc1cccc(c1)SC 1458a_100000035702_100000210202 [0,2,0,0,0,0|1,1,0]=4 7906 B13R1.81 CCC(=O)Cc1cccc(n1)CO 1458a_100000210414_100009813551 [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.81 CCC(=O)Cc1cccc(n1)OC 1458a_100000210414_100000755263 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.81 CCC(=O)Cc1ccnc(c1)OC 1458a_100000210414_100103152439 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.81 CCC(=O)Cc1ccnc(c1)OC 1458a_100000718155_100000210202 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 11a_100000210922_100000210414 [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 1626a_100000210922_100000210414 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 22a_100000210922_100000210414 [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.81 CCC(=O)Nc1cccc(c1)C#N 527a_100000210922_100000210414 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.81 CCC(=O)Nc1cccc(c1)CC 11a_100000211250_100000210414 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.81 CCC(=O)Nc1cccc(c1)CC 1626a_100000211250_100000210414 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.81 CCC(=O)Nc1cccc(c1)CC 22a_100000211250_100000210414 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.81 CCC(=O)Nc1cccc(c1)CC 527a_100000211250_100000210414 [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.81 CCC(=O)Nc1cccc(c1)CF 11a_100000126320_100000210414 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.81 CCC(=O)Nc1cccc(c1)CF 1626a_100000126320_100000210414 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.81 CCC(=O)Nc1cccc(c1)CF 22a_100000126320_100000210414 [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.81 CCC(=O)Nc1cccc(c1)CF 527a_100000126320_100000210414 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.81 CCC(=O)Nc1cccc(c1)CO 22a_100000211919_100000210414 [0,2,0,0,0,0|1,0,0]=3 7923 B13R1.81 CCC(=O)Nc1cccc(c1)NC 34a_100000186510_200000210301 [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.81 CCC(=O)Nc1cccc(c1)N[13CH3] 34a_100000186510_200025704644 [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.81 CCC(=O)Nc1cccc(c1)OC 11a_100000210024_100000210414 [0,2,0,0,0,0|1,0,0]=3 7926 B13R1.81 CCC(=O)Nc1cccc(c1)OC 1626a_100000210024_100000210414 [0,2,0,0,0,0|1,0,0]=3 7927 B13R1.81 CCC(=O)Nc1cccc(c1)OC 22a_100000210024_100000210414 [0,2,0,0,0,0|1,0,0]=3 7928 B13R1.81 CCC(=O)Nc1cccc(c1)OC 34a_100000158609_200000210301 [0,2,0,0,0,0|1,0,0]=3 7929 B13R1.81 CCC(=O)Nc1cccc(c1)OC 527a_100000210024_100000210414 [0,2,0,0,0,0|1,0,0]=3 7930 B13R1.81 CCC(=O)Nc1cccc(c1)OC 7a_100000158609_200000210301 [0,2,0,0,0,0|1,0,0]=3 7931 B13R1.81 CCC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158609_200025704644 [0,2,0,0,0,0|1,0,0]=3 7932 B13R1.81 CCC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158609_200025704644 [0,2,0,0,0,0|1,0,0]=3 7933 B13R1.81 CCC(=O)Nc1cccc(c1)SC 11a_100000210049_100000210414 [0,2,0,0,0,0|1,1,0]=4 7934 B13R1.81 CCC(=O)Nc1cccc(c1)SC 1626a_100000210049_100000210414 [0,2,0,0,0,0|1,1,0]=4 7935 B13R1.81 CCC(=O)Nc1cccc(c1)SC 22a_100000210049_100000210414 [0,2,0,0,0,0|1,1,0]=4 7936 B13R1.81 CCC(=O)Nc1cccc(c1)SC 527a_100000210049_100000210414 [0,2,0,0,0,0|1,1,0]=4 7937 B13R1.81 CCC(C)Oc1cccc(c1)CO 34a_100011214949_100011215416 [0,2,0,0,0,0|1,0,1]=4 7938 B13R1.81 CCC(C)Oc1cccc(c1)CO 7a_100011214949_100000758301 [0,2,0,0,0,0|1,0,1]=4 7939 B13R1.81 CCC(C)Oc1cccc(c1)OC 34a_100000211255_100011215416 [0,2,0,0,0,0|1,0,1]=4 7940 B13R1.81 CCC(C)Oc1cccc(c1)OC 7a_100000211255_100000758301 [0,2,0,0,0,0|1,0,1]=4 7941 B13R1.81 CCc1cccc(c1)NC(=O)CO 22a_100000211250_100000210174 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.81 CCc1cccc(c1)NC(=O)CO 527a_100000211250_100000210174 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.81 CCc1cccc(c1)NC(=O)NC 2430a_100000211250_100102657272 [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.81 CCc1cccc(c1)NC(=O)NC 512a_100000211250_100102657272 [0,2,0,0,0,0|2,0,0]=4 7945 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 11a_106832991635_100000684415 [0,2,0,0,0,0|2,0,0]=4 7946 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 1626a_100102657272_100000684415 [0,2,0,0,0,0|2,0,0]=4 7947 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 240690a_100102657272_100000684415 [0,2,0,0,0,0|2,0,0]=4 7948 B13R1.81 CNC(=O)Cc1cccc(c1)C#N 527a_100102657272_100000684415 [0,2,0,0,0,0|2,0,0]=4 7949 B13R1.81 CNC(=O)Cc1cccc(c1)NC 2230a_100011690097_200000210301 [0,2,0,0,0,0|2,0,0]=4 7950 B13R1.81 CNC(=O)Cc1cccc(c1)NC 34a_100011690097_200000210301 [0,2,0,0,0,0|2,0,0]=4 7951 B13R1.81 CNC(=O)Cc1cccc(c1)N[13CH3] 2230a_100011690097_200025704644 [0,2,0,0,0,0|2,0,0]=4 7952 B13R1.81 CNC(=O)Cc1cccc(c1)N[13CH3] 34a_100011690097_200025704644 [0,2,0,0,0,0|2,0,0]=4 7953 B13R1.81 CNC(=O)Cc1cccc(c1)OC 11a_106832991635_100000211281 [0,2,0,0,0,0|1,0,0]=3 7954 B13R1.81 CNC(=O)Cc1cccc(c1)OC 1626a_100102657272_100000211281 [0,2,0,0,0,0|1,0,0]=3 7955 B13R1.81 CNC(=O)Cc1cccc(c1)OC 240690a_100102657272_100000211281 [0,2,0,0,0,0|1,0,0]=3 7956 B13R1.81 CNC(=O)Cc1cccc(c1)OC 527a_100102657272_100000211281 [0,2,0,0,0,0|1,0,0]=3 7957 B13R1.81 CNC(=O)Cc1cccc(c1)SC 11a_106832991635_100000035702 [0,2,0,0,0,0|1,1,0]=4 7958 B13R1.81 CNC(=O)Cc1cccc(c1)SC 1626a_100102657272_100000035702 [0,2,0,0,0,0|1,1,0]=4 7959 B13R1.81 CNC(=O)Cc1cccc(c1)SC 240690a_100102657272_100000035702 [0,2,0,0,0,0|1,1,0]=4 7960 B13R1.81 CNC(=O)Cc1cccc(c1)SC 527a_100102657272_100000035702 [0,2,0,0,0,0|1,1,0]=4 7961 B13R1.81 CNC(=O)Cc1ccnc(c1)OC 11a_106832991635_100000718155 [0,2,0,0,0,0|2,0,0]=4 7962 B13R1.81 CNC(=O)Cc1ccnc(c1)OC 240690a_100102657272_100000718155 [0,2,0,0,0,0|2,0,0]=4 7963 B13R1.81 CNC(=O)Nc1cccc(c1)C#N 2430a_100000210922_100102657272 [0,2,0,0,0,0|2,0,0]=4 7964 B13R1.81 CNC(=O)Nc1cccc(c1)C#N 512a_100000210922_100102657272 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.81 CNC(=O)Nc1cccc(c1)CF 2430a_100000126320_100102657272 [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.81 CNC(=O)Nc1cccc(c1)CF 512a_100000126320_100102657272 [0,2,0,0,0,0|2,0,0]=4 7967 B13R1.81 CNC(=O)Nc1cccc(c1)CO 2430a_100000211919_100102657272 [0,2,0,0,0,0|1,0,0]=3 7968 B13R1.81 CNC(=O)Nc1cccc(c1)OC 2430a_100000210024_100102657272 [0,2,0,0,0,0|1,0,0]=3 7969 B13R1.81 CNC(=O)Nc1cccc(c1)OC 512a_100000210024_100102657272 [0,2,0,0,0,0|1,0,0]=3 7970 B13R1.81 CNC(=O)Nc1cccc(c1)SC 2430a_100000210049_100102657272 [0,2,0,0,0,0|1,1,0]=4 7971 B13R1.81 CNC(=O)Nc1cccc(c1)SC 512a_100000210049_100102657272 [0,2,0,0,0,0|1,1,0]=4 7972 B13R1.81 COC(=O)Cc1cccc(c1)SC 62a_100000699549_200000210301 [0,2,0,0,0,0|1,1,0]=4 7973 B13R1.81 COC(=O)Cc1cccc(c1)SC 62a_200000210301_100000699549 [0,2,0,0,0,0|1,1,0]=4 7974 B13R1.81 COC(=O)Cc1cccc(c1)S[13CH3] 62a_100000699549_200025704644 [0,2,0,0,0,0|1,1,0]=4 7975 B13R1.81 COC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000699549 [0,2,0,0,0,0|1,1,0]=4 7976 B13R1.81 COC(=O)Nc1cccc(c1)OC 34a_100000741004_200000210301 [0,2,0,0,0,0|1,0,0]=3 7977 B13R1.81 COC(=O)Nc1cccc(c1)OC 7a_100000741004_200000210301 [0,2,0,0,0,0|1,0,0]=3 7978 B13R1.81 COC(=O)Nc1cccc(c1)O[13CH3] 34a_100000741004_200025704644 [0,2,0,0,0,0|1,0,0]=3 7979 B13R1.81 COC(=O)Nc1cccc(c1)O[13CH3] 7a_100000741004_200025704644 [0,2,0,0,0,0|1,0,0]=3 7980 B13R1.81 COc1cc(ccn1)CC(=O)CF 1458a_100000718155_100015361967 [0,2,0,0,0,0|2,0,0]=4 7981 B13R1.81 COc1cc(ccn1)CC(=O)CO 1458a_100000210174_100103152439 [0,2,0,0,0,0|2,0,0]=4 7982 B13R1.81 COc1cccc(c1)CC(=O)CF 1458a_100000211281_100015361967 [0,2,0,0,0,0|1,0,0]=3 7983 B13R1.81 COc1cccc(c1)CC(=O)CO 1458a_100000210174_100000211672 [0,2,0,0,0,0|1,0,0]=3 7984 B13R1.81 COc1cccc(c1)CC(=O)NN 34a_100011472680_200000210301 [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.81 COc1cccc(c1)NC(=O)CCl 34a_100011236192_200000210301 [0,2,0,0,0,0|1,0,0]=3 7986 B13R1.81 COc1cccc(c1)NC(=O)CCl 7a_100011236192_200000210301 [0,2,0,0,0,0|1,0,0]=3 7987 B13R1.81 COc1cccc(c1)NC(=O)CO 22a_100000210024_100000210174 [0,2,0,0,0,0|1,0,0]=3 7988 B13R1.81 COc1cccc(c1)NC(=O)CO 527a_100000210024_100000210174 [0,2,0,0,0,0|1,0,0]=3 7989 B13R1.81 COc1cccc(c1)OC(C)C#N 7a_100000211255_100000703298 [0,2,0,0,0,0|1,0,1]=4 7990 B13R1.81 COc1cccc(c1)OC(C)CO 34a_100000211255_100012180447 [0,2,0,0,0,0|0,0,2]=4 7991 B13R1.81 COc1cccc(c1)OC(C)CO 7a_100000211255_100012180447 [0,2,0,0,0,0|0,0,2]=4 7992 B13R1.81 COc1cccc(n1)CC(=O)CO 1458a_100000210174_100000755263 [0,2,0,0,0,0|2,0,0]=4 7993 B13R1.81 COc1ccnc(c1)CC(=O)CO 1458a_100000210174_100000752681 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.81 CSc1cccc(c1)CC(=O)CF 1458a_100000035702_100015361967 [0,2,0,0,0,0|1,1,0]=4 7995 B13R1.81 CSc1cccc(c1)NC(=O)CO 22a_100000210049_100000210174 [0,2,0,0,0,0|1,1,0]=4 7996 B13R1.81 CSc1cccc(c1)NC(=O)CO 527a_100000210049_100000210174 [0,2,0,0,0,0|1,1,0]=4 7997 B13R1.81 N#Cc1cccc(c1)CC(=O)CF 1458a_100000684415_100015361967 [0,2,0,0,0,0|2,0,0]=4 7998 B13R1.81 N#Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100000233786 [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.81 N#Cc1cccc(c1)NC(=O)CO 22a_100000210922_100000210174 [0,2,0,0,0,0|2,0,0]=4 8000 B13R1.81 N#Cc1cccc(c1)NC(=O)CO 527a_100000210922_100000210174 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.81 O=C(CO)Cc1cccc(c1)CO 1458a_100000210174_100010188025 [0,2,0,0,0,0|1,0,0]=3 8002 B13R1.81 O=C(CO)Cc1cccc(n1)CO 1458a_100000210174_100009813551 [0,2,0,0,0,0|2,0,0]=4 8003 B13R1.81 O=C(CO)Nc1cccc(c1)CF 22a_100000126320_100000210174 [0,2,0,0,0,0|2,0,0]=4 8004 B13R1.81 O=C(CO)Nc1cccc(c1)CF 527a_100000126320_100000210174 [0,2,0,0,0,0|2,0,0]=4 8005 B13R1.81 O=C(CO)Nc1cccc(c1)CO 22a_100000211919_100000210174 [0,2,0,0,0,0|1,0,0]=3 8006 B13R1.81 O=Cc1cccc(c1)CC(=O)CO 1458a_100000210174_100009816774 [0,2,0,0,0,0|1,0,1]=4 8007 B13R1.81 [13CH3]Oc1cccc(c1)CC(=O)NN 34a_100011472680_200025704644 [0,2,0,0,0,0|2,0,0]=4 8008 B13R1.81 [13CH3]Oc1cccc(c1)NC(=O)CCl 34a_100011236192_200025704644 [0,2,0,0,0,0|1,0,0]=3 8009 B13R1.81 [13CH3]Oc1cccc(c1)NC(=O)CCl 7a_100011236192_200025704644 [0,2,0,0,0,0|1,0,0]=3 8010 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)O 232682a_100000210217_100000211323 [0,2,0,0,0,0|2,0,0]=4 8011 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)O 40a_100000210217_100000053943 [0,2,0,0,0,0|2,0,0]=4 8012 B13R1.2872 C=CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000185746 [0,2,0,0,0,0|1,0,1]=4 8013 B13R1.2872 C=CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000185746 [0,2,0,0,0,0|1,0,1]=4 8014 B13R1.2872 C=CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000185746 [0,2,0,0,0,0|1,0,1]=4 8015 B13R1.2872 C=CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000185746 [0,2,0,0,0,0|1,0,1]=4 8016 B13R1.2872 CC(=Cc1cc(ccc1I)O)C#N 6a_100000069132_200000212204 [0,2,0,0,0,0|2,0,0]=4 8017 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100000210414_100011982794 [0,2,0,0,0,0|2,0,0]=4 8018 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Br 1458a_100010004897_100000210202 [0,2,0,0,0,0|2,0,0]=4 8019 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)C 1458a_100010004923_100000210202 [0,2,0,0,0,0|2,0,0]=4 8020 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000210414_100000733903 [0,2,0,0,0,0|2,0,0]=4 8021 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)Cl 1458a_100000690875_100000210202 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000210414_100000736370 [0,2,0,0,0,0|2,0,0]=4 8023 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)F 1458a_100000690878_100000210202 [0,2,0,0,0,0|2,0,0]=4 8024 B13R1.2872 CCC(=O)Cc1cc(ccc1Br)I 1458a_100000210414_100012355412 [0,2,0,0,0,0|2,0,0]=4 8025 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Br 1458a_100010244045_100000210202 [0,2,0,0,0,0|2,0,0]=4 8026 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000210414_100000184699 [0,2,0,0,0,0|2,0,0]=4 8027 B13R1.2872 CCC(=O)Cc1cc(ccc1C)C 1458a_100000749331_100000210202 [0,2,0,0,0,0|2,0,0]=4 8028 B13R1.2872 CCC(=O)Cc1cc(ccc1C)Cl 1458a_100000210414_100012186985 [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100000210414_100000709795 [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.2872 CCC(=O)Cc1cc(ccc1C)F 1458a_100011219217_100000210202 [0,2,0,0,0,0|2,0,0]=4 8031 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100000210414_100000763347 [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Br 1458a_100011600618_100000210202 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)C 1458a_100000210414_100009871730 [0,2,0,0,0,0|2,0,0]=4 8034 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000210414_100000754809 [0,2,0,0,0,0|2,0,0]=4 8035 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100000210202 [0,2,0,0,0,0|2,0,0]=4 8036 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100000210414_100000709952 [0,2,0,0,0,0|2,0,0]=4 8037 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)F 1458a_100011830335_100000210202 [0,2,0,0,0,0|2,0,0]=4 8038 B13R1.2872 CCC(=O)Cc1cc(ccc1Cl)I 1458a_100000210414_100010188191 [0,2,0,0,0,0|2,0,0]=4 8039 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000210414_100000736399 [0,2,0,0,0,0|2,0,0]=4 8040 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Br 1458a_100000690877_100000210202 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100000210414_100011260760 [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.2872 CCC(=O)Cc1cc(ccc1F)C 1458a_100011667363_100000210202 [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100000210414_100000716957 [0,2,0,0,0,0|2,0,0]=4 8044 B13R1.2872 CCC(=O)Cc1cc(ccc1F)Cl 1458a_100011217548_100000210202 [0,2,0,0,0,0|2,0,0]=4 8045 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000210414_100000741279 [0,2,0,0,0,0|2,0,0]=4 8046 B13R1.2872 CCC(=O)Cc1cc(ccc1F)F 1458a_100000762760_100000210202 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.2872 CCC(=O)Cc1cc(ccc1F)I 1458a_100000210414_200010149601 [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Br 1458a_100000210414_100012362523 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.2872 CCC(=O)Cc1cc(ccc1I)Cl 1458a_100000210414_100012348826 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.2872 CCC(=O)Cc1cc(ccc1I)F 1458a_100000210414_100010149606 [0,2,0,0,0,0|2,0,0]=4 8051 B13R1.2872 CCC(=O)Cc1cc(ccc1O)Br 1458a_100010072483_100000210202 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.2872 CCC(=O)Cc1cc(ccc1O)F 1458a_100000210414_100010161318 [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.2872 CCC(=O)Cc1cc(ccc1O)O 1458a_100000038496_100000210202 [0,2,0,0,0,0|1,0,0]=3 8054 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Br 11a_100000737762_100000210414 [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Br 1626a_100000737762_100000210414 [0,2,0,0,0,0|2,0,0]=4 8056 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)C 11a_100000745044_100000210414 [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)C 1626a_100000745044_100000210414 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Cl 11a_100000687073_100000210414 [0,2,0,0,0,0|2,0,0]=4 8059 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)Cl 1626a_100000687073_100000210414 [0,2,0,0,0,0|2,0,0]=4 8060 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F 11a_100000687223_100000210414 [0,2,0,0,0,0|2,0,0]=4 8061 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)F 1626a_100000687223_100000210414 [0,2,0,0,0,0|2,0,0]=4 8062 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)I 11a_100000750456_100000210414 [0,2,0,0,0,0|2,0,0]=4 8063 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)I 1626a_100000750456_100000210414 [0,2,0,0,0,0|2,0,0]=4 8064 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000210414 [0,2,0,0,0,0|1,0,0]=3 8065 B13R1.2872 CCC(=O)Nc1cc(ccc1Br)O 527a_100011999798_100000210414 [0,2,0,0,0,0|1,0,0]=3 8066 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 11a_100000741167_100000210414 [0,2,0,0,0,0|2,0,0]=4 8067 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 1626a_100000741167_100000210414 [0,2,0,0,0,0|2,0,0]=4 8068 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 22a_100000741167_100000210414 [0,2,0,0,0,0|2,0,0]=4 8069 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Br 527a_100000741167_100000210414 [0,2,0,0,0,0|2,0,0]=4 8070 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 11a_100000185781_100000210414 [0,2,0,0,0,0|2,0,0]=4 8071 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 1626a_100000185781_100000210414 [0,2,0,0,0,0|2,0,0]=4 8072 B13R1.2872 CCC(=O)Nc1cc(ccc1C)C 22a_100000185781_100000210414 [0,2,0,0,0,0|2,0,0]=4 8073 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 11a_100000211374_100000210414 [0,2,0,0,0,0|2,0,0]=4 8074 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 1626a_100000211374_100000210414 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 22a_100000211374_100000210414 [0,2,0,0,0,0|2,0,0]=4 8076 B13R1.2872 CCC(=O)Nc1cc(ccc1C)Cl 527a_100000211374_100000210414 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 11a_100000211107_100000210414 [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 1626a_100000211107_100000210414 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.2872 CCC(=O)Nc1cc(ccc1C)F 22a_100000211107_100000210414 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 11a_100000761890_100000210414 [0,2,0,0,0,0|2,0,0]=4 8081 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 1626a_100000761890_100000210414 [0,2,0,0,0,0|2,0,0]=4 8082 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 22a_100000761890_100000210414 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.2872 CCC(=O)Nc1cc(ccc1C)I 527a_100000761890_100000210414 [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.2872 CCC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000210414 [0,2,0,0,0,0|1,0,0]=3 8085 B13R1.2872 CCC(=O)Nc1cc(ccc1C)O 527a_100011216113_100000210414 [0,2,0,0,0,0|1,0,0]=3 8086 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Br 11a_100000750497_100000210414 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Br 1626a_100000750497_100000210414 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 11a_100011215360_100000210414 [0,2,0,0,0,0|2,0,0]=4 8089 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 1626a_100011215360_100000210414 [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)C 22a_100011215360_100000210414 [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Cl 11a_100000184485_100000210414 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)Cl 1626a_100000184485_100000210414 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)F 11a_100000751338_100000210414 [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)F 1626a_100000751338_100000210414 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)I 11a_200000761891_100000210414 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)I 1626a_200000761891_100000210414 [0,2,0,0,0,0|2,0,0]=4 8097 B13R1.2872 CCC(=O)Nc1cc(ccc1Cl)O 527a_100011934297_100000210414 [0,2,0,0,0,0|1,0,0]=3 8098 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 11a_100000740924_100000210414 [0,2,0,0,0,0|2,0,0]=4 8099 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 1626a_100000740924_100000210414 [0,2,0,0,0,0|2,0,0]=4 8100 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Br 22a_100000740924_100000210414 [0,2,0,0,0,0|2,0,0]=4 8101 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 11a_100000211285_100000210414 [0,2,0,0,0,0|2,0,0]=4 8102 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 1626a_100000211285_100000210414 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 22a_100000211285_100000210414 [0,2,0,0,0,0|2,0,0]=4 8104 B13R1.2872 CCC(=O)Nc1cc(ccc1F)C 527a_100000211285_100000210414 [0,2,0,0,0,0|2,0,0]=4 8105 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Cl 11a_100000212115_100000210414 [0,2,0,0,0,0|2,0,0]=4 8106 B13R1.2872 CCC(=O)Nc1cc(ccc1F)Cl 1626a_100000212115_100000210414 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 11a_100000210742_100000210414 [0,2,0,0,0,0|2,0,0]=4 8108 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 1626a_100000210742_100000210414 [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.2872 CCC(=O)Nc1cc(ccc1F)F 22a_100000210742_100000210414 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.2872 CCC(=O)Nc1cc(ccc1F)I 11a_100011464823_100000210414 [0,2,0,0,0,0|2,0,0]=4 8111 B13R1.2872 CCC(=O)Nc1cc(ccc1F)I 1626a_100011464823_100000210414 [0,2,0,0,0,0|2,0,0]=4 8112 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000210414 [0,2,0,0,0,0|1,0,0]=3 8113 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000210414 [0,2,0,0,0,0|1,0,0]=3 8114 B13R1.2872 CCC(=O)Nc1cc(ccc1F)O 527a_100012017239_100000210414 [0,2,0,0,0,0|1,0,0]=3 8115 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Br 11a_100000743836_100000210414 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Br 1626a_100000743836_100000210414 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C 11a_100011216686_100000210414 [0,2,0,0,0,0|2,0,0]=4 8118 B13R1.2872 CCC(=O)Nc1cc(ccc1I)C 1626a_100011216686_100000210414 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 11a_100000761886_100000210414 [0,2,0,0,0,0|2,0,0]=4 8120 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 1626a_100000761886_100000210414 [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.2872 CCC(=O)Nc1cc(ccc1I)Cl 22a_100000761886_100000210414 [0,2,0,0,0,0|2,0,0]=4 8122 B13R1.2872 CCC(=O)Nc1cc(ccc1I)F 11a_100011218093_100000210414 [0,2,0,0,0,0|2,0,0]=4 8123 B13R1.2872 CCC(=O)Nc1cc(ccc1I)F 1626a_100011218093_100000210414 [0,2,0,0,0,0|2,0,0]=4 8124 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Br 22a_100000752626_100000210414 [0,2,0,0,0,0|2,0,0]=4 8125 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Br 527a_100000752626_100000210414 [0,2,0,0,0,0|2,0,0]=4 8126 B13R1.2872 CCC(=O)Nc1cc(ccc1O)C 22a_100011215204_100000210414 [0,2,0,0,0,0|2,0,0]=4 8127 B13R1.2872 CCC(=O)Nc1cc(ccc1O)C 527a_100011215204_100000210414 [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl 22a_100000210500_100000210414 [0,2,0,0,0,0|2,0,0]=4 8129 B13R1.2872 CCC(=O)Nc1cc(ccc1O)Cl 527a_100000210500_100000210414 [0,2,0,0,0,0|2,0,0]=4 8130 B13R1.2872 CCC(=O)Nc1cc(ccc1O)F 22a_100000759472_100000210414 [0,2,0,0,0,0|2,0,0]=4 8131 B13R1.2872 CCC(=O)Nc1cc(ccc1O)F 527a_100000759472_100000210414 [0,2,0,0,0,0|2,0,0]=4 8132 B13R1.2872 CCC(=O)Nc1cc(ccc1O)I 22a_100000753495_100000210414 [0,2,0,0,0,0|2,0,0]=4 8133 B13R1.2872 CCC(=O)Nc1cc(ccc1O)I 527a_100000753495_100000210414 [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 11a_106832991635_100010004897 [0,2,0,0,0,0|2,0,0]=4 8135 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 240690a_100102657272_100010004897 [0,2,0,0,0,0|2,0,0]=4 8136 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Br 527a_100102657272_100010004897 [0,2,0,0,0,0|2,0,0]=4 8137 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 11a_106832991635_100010004923 [0,2,0,0,0,0|2,0,0]=4 8138 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 1626a_100102657272_100010004923 [0,2,0,0,0,0|2,0,0]=4 8139 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 240690a_100102657272_100010004923 [0,2,0,0,0,0|2,0,0]=4 8140 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)C 527a_100102657272_100010004923 [0,2,0,0,0,0|2,0,0]=4 8141 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 11a_106832991635_100000690875 [0,2,0,0,0,0|2,0,0]=4 8142 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 1626a_100102657272_100000690875 [0,2,0,0,0,0|2,0,0]=4 8143 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 240690a_100102657272_100000690875 [0,2,0,0,0,0|2,0,0]=4 8144 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)Cl 527a_100102657272_100000690875 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 11a_106832991635_100000690878 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 1626a_100102657272_100000690878 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 240690a_100102657272_100000690878 [0,2,0,0,0,0|2,0,0]=4 8148 B13R1.2872 CNC(=O)Cc1cc(ccc1Br)F 527a_100102657272_100000690878 [0,2,0,0,0,0|2,0,0]=4 8149 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 11a_106832991635_100010244045 [0,2,0,0,0,0|2,0,0]=4 8150 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 1626a_100102657272_100010244045 [0,2,0,0,0,0|2,0,0]=4 8151 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 240690a_100102657272_100010244045 [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.2872 CNC(=O)Cc1cc(ccc1C)Br 527a_100102657272_100010244045 [0,2,0,0,0,0|2,0,0]=4 8153 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 11a_106832991635_100000749331 [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 1626a_100102657272_100000749331 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 240690a_100102657272_100000749331 [0,2,0,0,0,0|2,0,0]=4 8156 B13R1.2872 CNC(=O)Cc1cc(ccc1C)C 527a_100102657272_100000749331 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 11a_106832991635_100011219217 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 1626a_100102657272_100011219217 [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 240690a_100102657272_100011219217 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.2872 CNC(=O)Cc1cc(ccc1C)F 527a_100102657272_100011219217 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 11a_106832991635_100011600618 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 1626a_100102657272_100011600618 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 240690a_100102657272_100011600618 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Br 527a_100102657272_100011600618 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 11a_106832991635_100000748246 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 1626a_100102657272_100000748246 [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 240690a_100102657272_100000748246 [0,2,0,0,0,0|2,0,0]=4 8168 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)Cl 527a_100102657272_100000748246 [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 11a_106832991635_100011830335 [0,2,0,0,0,0|2,0,0]=4 8170 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 1626a_100102657272_100011830335 [0,2,0,0,0,0|2,0,0]=4 8171 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 240690a_100102657272_100011830335 [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.2872 CNC(=O)Cc1cc(ccc1Cl)F 527a_100102657272_100011830335 [0,2,0,0,0,0|2,0,0]=4 8173 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 11a_106832991635_100000690877 [0,2,0,0,0,0|2,0,0]=4 8174 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 1626a_100102657272_100000690877 [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 240690a_100102657272_100000690877 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Br 527a_100102657272_100000690877 [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 11a_106832991635_100011667363 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 1626a_100102657272_100011667363 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 240690a_100102657272_100011667363 [0,2,0,0,0,0|2,0,0]=4 8180 B13R1.2872 CNC(=O)Cc1cc(ccc1F)C 527a_100102657272_100011667363 [0,2,0,0,0,0|2,0,0]=4 8181 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 11a_106832991635_100011217548 [0,2,0,0,0,0|2,0,0]=4 8182 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 1626a_100102657272_100011217548 [0,2,0,0,0,0|2,0,0]=4 8183 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 240690a_100102657272_100011217548 [0,2,0,0,0,0|2,0,0]=4 8184 B13R1.2872 CNC(=O)Cc1cc(ccc1F)Cl 527a_100102657272_100011217548 [0,2,0,0,0,0|2,0,0]=4 8185 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 11a_106832991635_100000762760 [0,2,0,0,0,0|2,0,0]=4 8186 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 1626a_100102657272_100000762760 [0,2,0,0,0,0|2,0,0]=4 8187 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 240690a_100102657272_100000762760 [0,2,0,0,0,0|2,0,0]=4 8188 B13R1.2872 CNC(=O)Cc1cc(ccc1F)F 527a_100102657272_100000762760 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.2872 CNC(=O)Cc1cc(ccc1O)Br 240690a_100102657272_100010072483 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)Br 2430a_100000737762_100102657272 [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)C 2430a_100000745044_100102657272 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)F 2430a_100000687223_100102657272 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)I 2430a_100000750456_100102657272 [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)I 512a_100000750456_100102657272 [0,2,0,0,0,0|2,0,0]=4 8195 B13R1.2872 CNC(=O)Nc1cc(ccc1Br)O 2430a_100011999798_100102657272 [0,2,0,0,0,0|1,0,0]=3 8196 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Br 2430a_100000741167_100102657272 [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Br 512a_100000741167_100102657272 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.2872 CNC(=O)Nc1cc(ccc1C)C 2430a_100000185781_100102657272 [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.2872 CNC(=O)Nc1cc(ccc1C)Cl 2430a_100000211374_100102657272 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.2872 CNC(=O)Nc1cc(ccc1C)F 2430a_100000211107_100102657272 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.2872 CNC(=O)Nc1cc(ccc1C)I 2430a_100000761890_100102657272 [0,2,0,0,0,0|2,0,0]=4 8202 B13R1.2872 CNC(=O)Nc1cc(ccc1C)I 512a_100000761890_100102657272 [0,2,0,0,0,0|2,0,0]=4 8203 B13R1.2872 CNC(=O)Nc1cc(ccc1C)O 2430a_100011216113_100102657272 [0,2,0,0,0,0|1,0,0]=3 8204 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)C 2430a_100011215360_100102657272 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)Cl 2430a_100000184485_100102657272 [0,2,0,0,0,0|2,0,0]=4 8206 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)F 2430a_100000751338_100102657272 [0,2,0,0,0,0|2,0,0]=4 8207 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)I 2430a_200000761891_100102657272 [0,2,0,0,0,0|2,0,0]=4 8208 B13R1.2872 CNC(=O)Nc1cc(ccc1Cl)O 2430a_100011934297_100102657272 [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Br 2430a_100000740924_100102657272 [0,2,0,0,0,0|2,0,0]=4 8210 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Br 512a_100000740924_100102657272 [0,2,0,0,0,0|2,0,0]=4 8211 B13R1.2872 CNC(=O)Nc1cc(ccc1F)C 2430a_100000211285_100102657272 [0,2,0,0,0,0|2,0,0]=4 8212 B13R1.2872 CNC(=O)Nc1cc(ccc1F)Cl 2430a_100000212115_100102657272 [0,2,0,0,0,0|2,0,0]=4 8213 B13R1.2872 CNC(=O)Nc1cc(ccc1F)F 2430a_100000210742_100102657272 [0,2,0,0,0,0|2,0,0]=4 8214 B13R1.2872 CNC(=O)Nc1cc(ccc1F)I 2430a_100011464823_100102657272 [0,2,0,0,0,0|2,0,0]=4 8215 B13R1.2872 CNC(=O)Nc1cc(ccc1F)I 512a_100011464823_100102657272 [0,2,0,0,0,0|2,0,0]=4 8216 B13R1.2872 CNC(=O)Nc1cc(ccc1F)O 2430a_100012017239_100102657272 [0,2,0,0,0,0|1,0,0]=3 8217 B13R1.2872 CNC(=O)Nc1cc(ccc1I)Br 512a_100000743836_100102657272 [0,2,0,0,0,0|2,0,0]=4 8218 B13R1.2872 CNC(=O)Nc1cc(ccc1I)C 2430a_100011216686_100102657272 [0,2,0,0,0,0|2,0,0]=4 8219 B13R1.2872 CNC(=O)Nc1cc(ccc1I)F 2430a_100011218093_100102657272 [0,2,0,0,0,0|2,0,0]=4 8220 B13R1.2872 CNC(=O)Nc1cc(ccc1I)F 512a_100011218093_100102657272 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.2872 CNC(=O)Nc1cc(ccc1O)Br 2430a_100000752626_100102657272 [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.2872 CNC(=O)Nc1cc(ccc1O)C 2430a_100011215204_100102657272 [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.2872 CNC(=O)Nc1cc(ccc1O)Cl 2430a_100000210500_100102657272 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.2872 CNC(=O)Nc1cc(ccc1O)F 2430a_100000759472_100102657272 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.2872 CNC(=O)Nc1cc(ccc1O)I 2430a_100000753495_100102657272 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.2872 COC(=O)Cc1cc(ccc1O)O 271570a_203496583355_100010185610 [0,2,0,0,0,0|1,0,0]=3 8227 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)Br 1458a_100010004923_100015361967 [0,2,0,0,0,0|2,0,0]=4 8228 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)C 1458a_100000749331_100015361967 [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.2872 Cc1ccc(c(c1)CC(=O)CF)F 1458a_100011667363_100015361967 [0,2,0,0,0,0|2,0,0]=4 8230 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)C 1458a_100000210174_100000184699 [0,2,0,0,0,0|2,0,0]=4 8231 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)Cl 1458a_100000210174_100009871730 [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.2872 Cc1ccc(c(c1)CC(=O)CO)F 1458a_100000210174_100011260760 [0,2,0,0,0,0|2,0,0]=4 8233 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)C 22a_100000185781_100000210174 [0,2,0,0,0,0|2,0,0]=4 8234 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)Cl 22a_100011215360_100000210174 [0,2,0,0,0,0|2,0,0]=4 8235 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)F 22a_100000211285_100000210174 [0,2,0,0,0,0|2,0,0]=4 8236 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)F 527a_100000211285_100000210174 [0,2,0,0,0,0|2,0,0]=4 8237 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)O 22a_100011215204_100000210174 [0,2,0,0,0,0|2,0,0]=4 8238 B13R1.2872 Cc1ccc(c(c1)NC(=O)CO)O 527a_100011215204_100000210174 [0,2,0,0,0,0|2,0,0]=4 8239 B13R1.2872 Cc1ccc(cc1CC(=O)CF)Br 1458a_100010244045_100015361967 [0,2,0,0,0,0|2,0,0]=4 8240 B13R1.2872 Cc1ccc(cc1CC(=O)CF)F 1458a_100011219217_100015361967 [0,2,0,0,0,0|2,0,0]=4 8241 B13R1.2872 Cc1ccc(cc1CC(=O)CO)Cl 1458a_100000210174_100012186985 [0,2,0,0,0,0|2,0,0]=4 8242 B13R1.2872 Cc1ccc(cc1CC(=O)CO)F 1458a_100000210174_100000709795 [0,2,0,0,0,0|2,0,0]=4 8243 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Br 22a_100000741167_100000210174 [0,2,0,0,0,0|2,0,0]=4 8244 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Br 527a_100000741167_100000210174 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Cl 22a_100000211374_100000210174 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.2872 Cc1ccc(cc1NC(=O)CO)Cl 527a_100000211374_100000210174 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.2872 Cc1ccc(cc1NC(=O)CO)F 22a_100000211107_100000210174 [0,2,0,0,0,0|2,0,0]=4 8248 B13R1.2872 Cc1ccc(cc1NC(=O)CO)I 22a_100000761890_100000210174 [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.2872 Cc1ccc(cc1NC(=O)CO)I 527a_100000761890_100000210174 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.2872 Cc1ccc(cc1NC(=O)CO)O 22a_100011216113_100000210174 [0,2,0,0,0,0|1,0,0]=3 8251 B13R1.2872 Cc1ccc(cc1NC(=O)CO)O 527a_100011216113_100000210174 [0,2,0,0,0,0|1,0,0]=3 8252 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)Br 1458a_100010004897_100015361967 [0,2,0,0,0,0|2,0,0]=4 8253 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)Cl 1458a_100000690875_100015361967 [0,2,0,0,0,0|2,0,0]=4 8254 B13R1.2872 O=C(CF)Cc1cc(ccc1Br)F 1458a_100000690878_100015361967 [0,2,0,0,0,0|2,0,0]=4 8255 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)Br 1458a_100011600618_100015361967 [0,2,0,0,0,0|2,0,0]=4 8256 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)Cl 1458a_100000748246_100015361967 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.2872 O=C(CF)Cc1cc(ccc1Cl)F 1458a_100011830335_100015361967 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.2872 O=C(CF)Cc1cc(ccc1F)Br 1458a_100000690877_100015361967 [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.2872 O=C(CF)Cc1cc(ccc1F)Cl 1458a_100011217548_100015361967 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.2872 O=C(CF)Cc1cc(ccc1F)F 1458a_100000762760_100015361967 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.2872 O=C(CF)Cc1cc(ccc1O)Br 1458a_100010072483_100015361967 [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.2872 O=C(CF)Cc1cc(ccc1O)O 1458a_100000038496_100015361967 [0,2,0,0,0,0|1,0,0]=3 8263 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)Br 1458a_100000210174_100011982794 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)Cl 1458a_100000210174_100000733903 [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)F 1458a_100000210174_100000736370 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.2872 O=C(CO)Cc1cc(ccc1Br)I 1458a_100000210174_100012355412 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)Br 1458a_100000210174_100000763347 [0,2,0,0,0,0|2,0,0]=4 8268 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)Cl 1458a_100000210174_100000754809 [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)F 1458a_100000210174_100000709952 [0,2,0,0,0,0|2,0,0]=4 8270 B13R1.2872 O=C(CO)Cc1cc(ccc1Cl)I 1458a_100000210174_100010188191 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.2872 O=C(CO)Cc1cc(ccc1F)Br 1458a_100000210174_100000736399 [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.2872 O=C(CO)Cc1cc(ccc1F)Cl 1458a_100000210174_100000716957 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.2872 O=C(CO)Cc1cc(ccc1F)F 1458a_100000210174_100000741279 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.2872 O=C(CO)Cc1cc(ccc1F)I 1458a_100000210174_200010149601 [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.2872 O=C(CO)Cc1cc(ccc1I)Br 1458a_100000210174_100012362523 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.2872 O=C(CO)Cc1cc(ccc1I)Cl 1458a_100000210174_100012348826 [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.2872 O=C(CO)Cc1cc(ccc1I)F 1458a_100000210174_100010149606 [0,2,0,0,0,0|2,0,0]=4 8278 B13R1.2872 O=C(CO)Cc1cc(ccc1O)F 1458a_100000210174_100010161318 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.2872 O=C(CO)Nc1cc(ccc1Br)O 22a_100011999798_100000210174 [0,2,0,0,0,0|1,0,0]=3 8280 B13R1.2872 O=C(CO)Nc1cc(ccc1Br)O 527a_100011999798_100000210174 [0,2,0,0,0,0|1,0,0]=3 8281 B13R1.2872 O=C(CO)Nc1cc(ccc1Cl)O 527a_100011934297_100000210174 [0,2,0,0,0,0|1,0,0]=3 8282 B13R1.2872 O=C(CO)Nc1cc(ccc1F)Br 22a_100000740924_100000210174 [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.2872 O=C(CO)Nc1cc(ccc1F)F 22a_100000210742_100000210174 [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.2872 O=C(CO)Nc1cc(ccc1F)O 22a_100012017239_100000210174 [0,2,0,0,0,0|1,0,0]=3 8285 B13R1.2872 O=C(CO)Nc1cc(ccc1F)O 527a_100012017239_100000210174 [0,2,0,0,0,0|1,0,0]=3 8286 B13R1.2872 O=C(CO)Nc1cc(ccc1I)Cl 22a_100000761886_100000210174 [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Br 22a_100000752626_100000210174 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Br 527a_100000752626_100000210174 [0,2,0,0,0,0|2,0,0]=4 8289 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Cl 22a_100000210500_100000210174 [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.2872 O=C(CO)Nc1cc(ccc1O)Cl 527a_100000210500_100000210174 [0,2,0,0,0,0|2,0,0]=4 8291 B13R1.2872 O=C(CO)Nc1cc(ccc1O)F 22a_100000759472_100000210174 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.2872 O=C(CO)Nc1cc(ccc1O)F 527a_100000759472_100000210174 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.2872 O=C(CO)Nc1cc(ccc1O)I 22a_100000753495_100000210174 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.2872 O=C(CO)Nc1cc(ccc1O)I 527a_100000753495_100000210174 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100000185746 [0,2,0,0,0,0|1,0,1]=4 8296 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000185746 [0,2,0,0,0,0|1,0,1]=4 8297 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000185746 [0,2,0,0,0,0|1,0,1]=4 8298 B13R1.2874 C=CC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000185746 [0,2,0,0,0,0|1,0,1]=4 8299 B13R1.2874 CC(=Cc1cc(cc(c1)Br)O)C#N 6a_100010176088_200000212204 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.2874 CC(=Cc1cc(cc(c1)Cl)O)C#N 6a_100000050827_200000212204 [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.2874 CC(=Cc1cc(cc(c1)F)O)C#N 6a_100000703664_200000212204 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.2874 CC(=Cc1cc(cc(c1)O)C)C#N 6a_100009853434_200000212204 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.2874 CC(=Cc1cc(cc(c1)O)O)C#N 6a_100000043415_200000212204 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100000210414_100011216082 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100000210202 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)C 1458a_100000210414_100012348363 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)F 1458a_100000210414_100000766940 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Br)F 1458a_100011935118_100000210202 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.2874 CCC(=O)Cc1cc(cc(c1)C)C 1458a_100000210414_100000181317 [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.2874 CCC(=O)Cc1cc(cc(c1)C)C 1458a_100011202310_100000210202 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100000210414_100011219208 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100000210202 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100000210414_100011219885 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.2874 CCC(=O)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100000210202 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)C 1458a_100000210414_100011219130 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)C 1458a_100011216671_100000210202 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)F 1458a_100000210414_100000697002 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.2874 CCC(=O)Cc1cc(cc(c1)F)F 1458a_100011220011_100000210202 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.2874 CCC(=O)Cc1cc(cc(c1)I)Br 1458a_100000210414_100010146614 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.2874 CCC(=O)Cc1cc(cc(c1)I)F 1458a_100000210414_100010149605 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 11a_100012047176_100000210414 [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 1626a_100012047176_100000210414 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000210414 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Br 527a_100012047176_100000210414 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 11a_100000695972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 1626a_100000695972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 22a_100000695972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)C 527a_100000695972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Cl 11a_100011934539_100000210414 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Cl 1626a_100011934539_100000210414 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000210414 [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)F 11a_100000705686_100000210414 [0,2,0,0,0,0|2,0,0]=4 8333 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)F 1626a_100000705686_100000210414 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Br)F 22a_100000705686_100000210414 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 11a_100000210930_100000210414 [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 1626a_100000210930_100000210414 [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 22a_100000210930_100000210414 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.2874 CCC(=O)Nc1cc(cc(c1)C)C 527a_100000210930_100000210414 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)C 11a_100012022512_100000210414 [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)C 1626a_100012022512_100000210414 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)C 22a_100012022512_100000210414 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)Cl 11a_100000210456_100000210414 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)Cl 1626a_100000210456_100000210414 [0,2,0,0,0,0|2,0,0]=4 8344 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000210414 [0,2,0,0,0,0|2,0,0]=4 8345 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)F 11a_100000686136_100000210414 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)F 1626a_100000686136_100000210414 [0,2,0,0,0,0|2,0,0]=4 8347 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000210414 [0,2,0,0,0,0|2,0,0]=4 8348 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100000210414 [0,2,0,0,0,0|1,0,0]=3 8349 B13R1.2874 CCC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000210414 [0,2,0,0,0,0|1,0,0]=3 8350 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 11a_100000742734_100000210414 [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 1626a_100000742734_100000210414 [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 22a_100000742734_100000210414 [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)C 527a_100000742734_100000210414 [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)F 11a_100000233717_100000210414 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)F 1626a_100000233717_100000210414 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.2874 CCC(=O)Nc1cc(cc(c1)F)F 22a_100000233717_100000210414 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 11a_100009814763_100000210414 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 1626a_100009814763_100000210414 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 22a_100009814763_100000210414 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Br 527a_100009814763_100000210414 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Cl 11a_100010147676_100000210414 [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Cl 1626a_100010147676_100000210414 [0,2,0,0,0,0|2,0,0]=4 8363 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000210414 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)F 11a_100011356972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)F 1626a_100011356972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)F 22a_100011356972_100000210414 [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 11a_200000696836_100000210414 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 1626a_200000696836_100000210414 [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 22a_200000696836_100000210414 [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.2874 CCC(=O)Nc1cc(cc(c1)I)I 527a_200000696836_100000210414 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000210414 [0,2,0,0,0,0|1,0,0]=3 8372 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000210414 [0,2,0,0,0,0|1,0,0]=3 8373 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)C 527a_100011995906_100000210414 [0,2,0,0,0,0|1,0,0]=3 8374 B13R1.2874 CCC(=O)Nc1cc(cc(c1)O)O 527a_100000043371_100000210414 [0,2,0,0,0,0|1,0,0]=3 8375 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 11a_106832991635_100010186705 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 240690a_100102657272_100010186705 [0,2,0,0,0,0|2,0,0]=4 8377 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)Br 527a_100102657272_100010186705 [0,2,0,0,0,0|2,0,0]=4 8378 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 11a_106832991635_100011935118 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 240690a_100102657272_100011935118 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Br)F 527a_100102657272_100011935118 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 11a_106832991635_100011202310 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 240690a_100102657272_100011202310 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.2874 CNC(=O)Cc1cc(cc(c1)C)C 527a_100102657272_100011202310 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 11a_106832991635_100012340057 [0,2,0,0,0,0|2,0,0]=4 8385 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 1626a_100102657272_100012340057 [0,2,0,0,0,0|2,0,0]=4 8386 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 240690a_100102657272_100012340057 [0,2,0,0,0,0|2,0,0]=4 8387 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)Cl 527a_100102657272_100012340057 [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 11a_106832991635_100011217690 [0,2,0,0,0,0|2,0,0]=4 8389 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 1626a_100102657272_100011217690 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 240690a_100102657272_100011217690 [0,2,0,0,0,0|2,0,0]=4 8391 B13R1.2874 CNC(=O)Cc1cc(cc(c1)Cl)F 527a_100102657272_100011217690 [0,2,0,0,0,0|2,0,0]=4 8392 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 11a_106832991635_100011216671 [0,2,0,0,0,0|2,0,0]=4 8393 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 1626a_100102657272_100011216671 [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 240690a_100102657272_100011216671 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)C 527a_100102657272_100011216671 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 11a_106832991635_100011220011 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 1626a_100102657272_100011220011 [0,2,0,0,0,0|2,0,0]=4 8398 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 240690a_100102657272_100011220011 [0,2,0,0,0,0|2,0,0]=4 8399 B13R1.2874 CNC(=O)Cc1cc(cc(c1)F)F 527a_100102657272_100011220011 [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.2874 CNC(=O)Cc1cc(cc(c1)O)O 240690a_100102657272_100000080560 [0,2,0,0,0,0|1,0,0]=3 8401 B13R1.2874 CNC(=O)Cc1cc(cc(c1)O)O 527a_100102657272_100000080560 [0,2,0,0,0,0|1,0,0]=3 8402 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Br 2430a_100012047176_100102657272 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Br 512a_100012047176_100102657272 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)C 2430a_100000695972_100102657272 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)C 512a_100000695972_100102657272 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Cl 2430a_100011934539_100102657272 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)Cl 512a_100011934539_100102657272 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)F 2430a_100000705686_100102657272 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Br)F 512a_100000705686_100102657272 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.2874 CNC(=O)Nc1cc(cc(c1)C)C 2430a_100000210930_100102657272 [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.2874 CNC(=O)Nc1cc(cc(c1)C)C 512a_100000210930_100102657272 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)C 2430a_100012022512_100102657272 [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)C 512a_100012022512_100102657272 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)Cl 2430a_100000210456_100102657272 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)Cl 512a_100000210456_100102657272 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)F 2430a_100000686136_100102657272 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)F 512a_100000686136_100102657272 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)O 2430a_100000123917_100102657272 [0,2,0,0,0,0|1,0,0]=3 8419 B13R1.2874 CNC(=O)Nc1cc(cc(c1)Cl)O 512a_100000123917_100102657272 [0,2,0,0,0,0|1,0,0]=3 8420 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)C 2430a_100000742734_100102657272 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)C 512a_100000742734_100102657272 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)F 2430a_100000233717_100102657272 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.2874 CNC(=O)Nc1cc(cc(c1)F)F 512a_100000233717_100102657272 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Br 2430a_100009814763_100102657272 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Br 512a_100009814763_100102657272 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Cl 2430a_100010147676_100102657272 [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)Cl 512a_100010147676_100102657272 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)F 2430a_100011356972_100102657272 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)F 512a_100011356972_100102657272 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)I 2430a_200000696836_100102657272 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.2874 CNC(=O)Nc1cc(cc(c1)I)I 512a_200000696836_100102657272 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)C 2430a_100011995906_100102657272 [0,2,0,0,0,0|1,0,0]=3 8433 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)C 512a_100011995906_100102657272 [0,2,0,0,0,0|1,0,0]=3 8434 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)O 2430a_100000043371_100102657272 [0,2,0,0,0,0|1,0,0]=3 8435 B13R1.2874 CNC(=O)Nc1cc(cc(c1)O)O 512a_100000043371_100102657272 [0,2,0,0,0,0|1,0,0]=3 8436 B13R1.2874 COC(=O)Cc1cc(cc(c1)F)O 271570a_203496583355_100012569085 [0,2,0,0,0,0|1,0,0]=3 8437 B13R1.2874 Cc1cc(cc(c1)CC(=O)CF)C 1458a_100011202310_100015361967 [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.2874 Cc1cc(cc(c1)CC(=O)CF)F 1458a_100011216671_100015361967 [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.2874 Cc1cc(cc(c1)CC(=O)CO)Br 1458a_100000210174_100012348363 [0,2,0,0,0,0|2,0,0]=4 8440 B13R1.2874 Cc1cc(cc(c1)CC(=O)CO)C 1458a_100000210174_100000181317 [0,2,0,0,0,0|2,0,0]=4 8441 B13R1.2874 Cc1cc(cc(c1)CC(=O)CO)F 1458a_100000210174_100011219130 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)Br 22a_100000695972_100000210174 [0,2,0,0,0,0|2,0,0]=4 8443 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)Br 527a_100000695972_100000210174 [0,2,0,0,0,0|2,0,0]=4 8444 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)C 22a_100000210930_100000210174 [0,2,0,0,0,0|2,0,0]=4 8445 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)C 527a_100000210930_100000210174 [0,2,0,0,0,0|2,0,0]=4 8446 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)Cl 22a_100012022512_100000210174 [0,2,0,0,0,0|2,0,0]=4 8447 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)F 22a_100000742734_100000210174 [0,2,0,0,0,0|2,0,0]=4 8448 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)F 527a_100000742734_100000210174 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)O 22a_100011995906_100000210174 [0,2,0,0,0,0|1,0,0]=3 8450 B13R1.2874 Cc1cc(cc(c1)NC(=O)CO)O 527a_100011995906_100000210174 [0,2,0,0,0,0|1,0,0]=3 8451 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Br)Br 1458a_100010186705_100015361967 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Br)F 1458a_100011935118_100015361967 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Cl)Cl 1458a_100012340057_100015361967 [0,2,0,0,0,0|2,0,0]=4 8454 B13R1.2874 O=C(CF)Cc1cc(cc(c1)Cl)F 1458a_100011217690_100015361967 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.2874 O=C(CF)Cc1cc(cc(c1)F)F 1458a_100011220011_100015361967 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Br)Br 1458a_100000210174_100011216082 [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Br)F 1458a_100000210174_100000766940 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Cl)Cl 1458a_100000210174_100011219208 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.2874 O=C(CO)Cc1cc(cc(c1)Cl)F 1458a_100000210174_100011219885 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.2874 O=C(CO)Cc1cc(cc(c1)F)F 1458a_100000210174_100000697002 [0,2,0,0,0,0|2,0,0]=4 8461 B13R1.2874 O=C(CO)Cc1cc(cc(c1)I)Br 1458a_100000210174_100010146614 [0,2,0,0,0,0|2,0,0]=4 8462 B13R1.2874 O=C(CO)Cc1cc(cc(c1)I)F 1458a_100000210174_100010149605 [0,2,0,0,0,0|2,0,0]=4 8463 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Br)Br 22a_100012047176_100000210174 [0,2,0,0,0,0|2,0,0]=4 8464 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Br)Br 527a_100012047176_100000210174 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Br)Cl 22a_100011934539_100000210174 [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Br)F 22a_100000705686_100000210174 [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Cl)Cl 22a_100000210456_100000210174 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Cl)F 22a_100000686136_100000210174 [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.2874 O=C(CO)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000210174 [0,2,0,0,0,0|1,0,0]=3 8470 B13R1.2874 O=C(CO)Nc1cc(cc(c1)F)F 22a_100000233717_100000210174 [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.2874 O=C(CO)Nc1cc(cc(c1)I)Br 22a_100009814763_100000210174 [0,2,0,0,0,0|2,0,0]=4 8472 B13R1.2874 O=C(CO)Nc1cc(cc(c1)I)Br 527a_100009814763_100000210174 [0,2,0,0,0,0|2,0,0]=4 8473 B13R1.2874 O=C(CO)Nc1cc(cc(c1)I)Cl 22a_100010147676_100000210174 [0,2,0,0,0,0|2,0,0]=4 8474 B13R1.2874 O=C(CO)Nc1cc(cc(c1)I)F 22a_100011356972_100000210174 [0,2,0,0,0,0|2,0,0]=4 8475 B13R1.2874 O=C(CO)Nc1cc(cc(c1)I)I 22a_200000696836_100000210174 [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.2874 O=C(CO)Nc1cc(cc(c1)I)I 527a_200000696836_100000210174 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.2874 O=C(CO)Nc1cc(cc(c1)O)O 527a_100000043371_100000210174 [0,2,0,0,0,0|1,0,0]=3 8478 B13R1.56 C=Cc1cc(cc(c1)OC(=O)C)F 271570a_100011290941_200015324874 [0,2,0,0,0,0|1,0,0]=3 8479 B13R1.56 CC(=Cc1cc(cc(c1)C#N)O)C 271570a_100102525489_100012180112 [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.56 CC(=Cc1cc(cc(c1)C=O)O)C 271570a_100102525489_100010176088 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.56 CC(=Cc1cc(cc(c1)CO)Br)C 271570a_100102525489_100009814756 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.56 CC(=Cc1cc(cc(c1)CO)C)C 271570a_100102525489_100000720511 [0,2,0,0,0,0|2,0,0]=4 8483 B13R1.56 CC(=Cc1cc(cc(c1)CO)F)C 271570a_100102525489_100000766897 [0,2,0,0,0,0|2,0,0]=4 8484 B13R1.56 CC(=O)Cc1cc(cc(c1)C#N)Br 1458a_100000070787_100010204237 [0,2,0,0,0,0|2,0,0]=4 8485 B13R1.56 CC(=O)Cc1cc(cc(c1)C#N)F 1458a_100000070787_100012349702 [0,2,0,0,0,0|2,0,0]=4 8486 B13R1.56 CC(=O)Cc1cc(cc(c1)C#N)F 1458a_200012184419_200000210301 [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Br 11a_100012002331_100015343762 [0,2,0,0,0,0|2,0,0]=4 8488 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Br 1626a_100012002331_100015343762 [0,2,0,0,0,0|2,0,0]=4 8489 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Br 22a_100012002331_100000070787 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Br 527a_100012002331_100103153847 [0,2,0,0,0,0|2,0,0]=4 8491 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)C 11a_100012017395_100015343762 [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)C 1626a_100012017395_100015343762 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)C 22a_100012017395_100000070787 [0,2,0,0,0,0|2,0,0]=4 8494 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)C 527a_100012017395_100103153847 [0,2,0,0,0,0|2,0,0]=4 8495 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Cl 11a_100000068067_100015343762 [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Cl 1626a_100000068067_100015343762 [0,2,0,0,0,0|2,0,0]=4 8497 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Cl 22a_100000068067_100000070787 [0,2,0,0,0,0|2,0,0]=4 8498 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)Cl 527a_100000068067_100103153847 [0,2,0,0,0,0|2,0,0]=4 8499 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)F 11a_100011362962_100015343762 [0,2,0,0,0,0|2,0,0]=4 8500 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)F 1626a_100011362962_100015343762 [0,2,0,0,0,0|2,0,0]=4 8501 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)F 22a_100011362962_100000070787 [0,2,0,0,0,0|2,0,0]=4 8502 B13R1.56 CC(=O)Nc1cc(cc(c1)C#N)F 527a_100011362962_100103153847 [0,2,0,0,0,0|2,0,0]=4 8503 B13R1.56 CC(=O)Nc1cc(cc(c1)CO)Cl 22a_100012002482_100000070787 [0,2,0,0,0,0|1,0,0]=3 8504 B13R1.56 CC(=O)Nc1cc(cc(c1)CO)O 22a_200000124675_100000070787 [0,2,0,0,0,0|1,0,0]=3 8505 B13R1.56 CC(=O)Nc1cc(cc(c1)CO)O 527a_200000124675_100103153847 [0,2,0,0,0,0|1,0,0]=3 8506 B13R1.56 CC(=O)Oc1cc(cc(c1)S[13CH3])F 62a_200015324874_200025704644 [0,2,0,0,0,0|0,1,0]=3 8507 B13R1.56 CC(=O)Oc1cc(cc(c1)S[13CH3])F 62a_200025704644_200015324874 [0,2,0,0,0,0|0,1,0]=3 8508 B13R1.56 CC(C)Oc1cc(cc(c1)CO)N 34a_200000124675_100000210206 [0,2,0,0,0,0|1,0,1]=4 8509 B13R1.56 CCc1cc(cc(c1)NC(=O)C)Br 11a_100010074814_100015343762 [0,2,0,0,0,0|2,0,0]=4 8510 B13R1.56 CCc1cc(cc(c1)NC(=O)C)Br 1626a_100010074814_100015343762 [0,2,0,0,0,0|2,0,0]=4 8511 B13R1.56 CCc1cc(cc(c1)NC(=O)C)Br 22a_100010074814_100000070787 [0,2,0,0,0,0|2,0,0]=4 8512 B13R1.56 CCc1cc(cc(c1)NC(=O)C)Br 527a_100010074814_100103153847 [0,2,0,0,0,0|2,0,0]=4 8513 B13R1.56 CCc1cc(cc(c1)NC(=O)C)C 11a_100012022893_100015343762 [0,2,0,0,0,0|2,0,0]=4 8514 B13R1.56 CCc1cc(cc(c1)NC(=O)C)C 1626a_100012022893_100015343762 [0,2,0,0,0,0|2,0,0]=4 8515 B13R1.56 CCc1cc(cc(c1)NC(=O)C)C 22a_100012022893_100000070787 [0,2,0,0,0,0|2,0,0]=4 8516 B13R1.56 CCc1cc(cc(c1)NC(=O)C)C 527a_100012022893_100103153847 [0,2,0,0,0,0|2,0,0]=4 8517 B13R1.56 CCc1cc(cc(c1)NC(=O)C)O 271570a_203496583355_200011092971 [0,2,0,0,0,0|1,0,0]=3 8518 B13R1.56 COc1cc(cc(c1)C=C(C)C)Br 271570a_100102525489_100010141301 [0,2,0,0,0,0|2,0,0]=4 8519 B13R1.56 COc1cc(cc(c1)C=C(C)C)C 271570a_100102525489_100010187550 [0,2,0,0,0,0|2,0,0]=4 8520 B13R1.56 COc1cc(cc(c1)C=C(C)C)Cl 271570a_100102525489_100010147680 [0,2,0,0,0,0|2,0,0]=4 8521 B13R1.56 COc1cc(cc(c1)C=C(C)C)F 271570a_100102525489_100011934182 [0,2,0,0,0,0|2,0,0]=4 8522 B13R1.56 COc1cc(cc(c1)C=C(C)C)N 271570a_100102525489_100000750983 [0,2,0,0,0,0|2,0,0]=4 8523 B13R1.56 COc1cc(cc(c1)C=C(C)C)O 271570a_100102525489_100010068927 [0,2,0,0,0,0|2,0,0]=4 8524 B13R1.56 COc1cc(cc(c1)CC(=O)C)Br 1458a_100000070787_100010162483 [0,2,0,0,0,0|1,0,0]=3 8525 B13R1.56 COc1cc(cc(c1)CC(=O)C)Cl 1458a_100000070787_100010188059 [0,2,0,0,0,0|1,0,0]=3 8526 B13R1.56 COc1cc(cc(c1)CC(=O)C)F 1458a_100000070787_100011934817 [0,2,0,0,0,0|1,0,0]=3 8527 B13R1.56 COc1cc(cc(c1)NC(=O)C)Br 11a_100000750983_100015343762 [0,2,0,0,0,0|1,0,0]=3 8528 B13R1.56 COc1cc(cc(c1)NC(=O)C)Br 1626a_100000750983_100015343762 [0,2,0,0,0,0|1,0,0]=3 8529 B13R1.56 COc1cc(cc(c1)NC(=O)C)Br 22a_100000750983_100000070787 [0,2,0,0,0,0|1,0,0]=3 8530 B13R1.56 COc1cc(cc(c1)NC(=O)C)Br 527a_100000750983_100103153847 [0,2,0,0,0,0|1,0,0]=3 8531 B13R1.56 COc1cc(cc(c1)NC(=O)C)C 11a_100012001870_100015343762 [0,2,0,0,0,0|1,0,0]=3 8532 B13R1.56 COc1cc(cc(c1)NC(=O)C)C 1626a_100012001870_100015343762 [0,2,0,0,0,0|1,0,0]=3 8533 B13R1.56 COc1cc(cc(c1)NC(=O)C)C 22a_100012001870_100000070787 [0,2,0,0,0,0|1,0,0]=3 8534 B13R1.56 COc1cc(cc(c1)NC(=O)C)C 527a_100012001870_100103153847 [0,2,0,0,0,0|1,0,0]=3 8535 B13R1.56 COc1cc(cc(c1)NC(=O)C)Cl 11a_100000051436_100015343762 [0,2,0,0,0,0|1,0,0]=3 8536 B13R1.56 COc1cc(cc(c1)NC(=O)C)Cl 1626a_100000051436_100015343762 [0,2,0,0,0,0|1,0,0]=3 8537 B13R1.56 COc1cc(cc(c1)NC(=O)C)Cl 22a_100000051436_100000070787 [0,2,0,0,0,0|1,0,0]=3 8538 B13R1.56 COc1cc(cc(c1)NC(=O)C)Cl 527a_100000051436_100103153847 [0,2,0,0,0,0|1,0,0]=3 8539 B13R1.56 COc1cc(cc(c1)NC(=O)C)F 11a_100000687699_100015343762 [0,2,0,0,0,0|1,0,0]=3 8540 B13R1.56 COc1cc(cc(c1)NC(=O)C)F 1626a_100000687699_100015343762 [0,2,0,0,0,0|1,0,0]=3 8541 B13R1.56 COc1cc(cc(c1)NC(=O)C)F 22a_100000687699_100000070787 [0,2,0,0,0,0|1,0,0]=3 8542 B13R1.56 COc1cc(cc(c1)NC(=O)C)F 527a_100000687699_100103153847 [0,2,0,0,0,0|1,0,0]=3 8543 B13R1.56 COc1cc(cc(c1)NC(=O)C)O 1626a_200000692186_100015343762 [0,2,0,0,0,0|1,0,0]=3 8544 B13R1.56 COc1cc(cc(c1)NC(=O)C)O 22a_200000692186_100000070787 [0,2,0,0,0,0|1,0,0]=3 8545 B13R1.56 COc1cc(cc(c1)NC(=O)C)O 527a_200000692186_100103153847 [0,2,0,0,0,0|1,0,0]=3 8546 B13R1.56 COc1cc(cc(c1)OC(C)C)Br 34a_100010068927_100000210206 [0,2,0,0,0,0|1,0,1]=4 8547 B13R1.56 COc1cc(cc(c1)OC(C)C)Br 7a_100010068927_100000210206 [0,2,0,0,0,0|1,0,1]=4 8548 B13R1.56 COc1cc(cc(c1)OC(C)C)C 34a_100011216608_100000210206 [0,2,0,0,0,0|1,0,1]=4 8549 B13R1.56 COc1cc(cc(c1)OC(C)C)C 7a_100011216608_100000210206 [0,2,0,0,0,0|1,0,1]=4 8550 B13R1.56 COc1cc(cc(c1)OC(C)C)Cl 34a_100000051430_100000210206 [0,2,0,0,0,0|1,0,1]=4 8551 B13R1.56 COc1cc(cc(c1)OC(C)C)Cl 7a_100000051430_100000210206 [0,2,0,0,0,0|1,0,1]=4 8552 B13R1.56 COc1cc(cc(c1)OC(C)C)F 34a_100011369910_100000210206 [0,2,0,0,0,0|1,0,1]=4 8553 B13R1.56 COc1cc(cc(c1)OC(C)C)F 7a_100011369910_100000210206 [0,2,0,0,0,0|1,0,1]=4 8554 B13R1.56 COc1cc(cc(c1)OC(C)C)N 34a_200000692186_100000210206 [0,2,0,0,0,0|1,0,1]=4 8555 B13R1.56 COc1cc(cc(c1)OC(C)C)N 7a_200000692186_100000210206 [0,2,0,0,0,0|1,0,1]=4 8556 B13R1.56 COc1cc(cc(n1)C)CC(=O)C 1458a_100000070787_200012183585 [0,2,0,0,0,0|2,0,0]=4 8557 B13R1.56 CSc1cc(cc(c1)OC(=O)C)F 62a_200000210301_200015324874 [0,2,0,0,0,0|0,1,0]=3 8558 B13R1.56 CSc1cc(cc(c1)OC(=O)C)F 62a_200015324874_200000210301 [0,2,0,0,0,0|0,1,0]=3 8559 B13R1.56 [13CH3]C(=O)Cc1cc(cc(c1)C#N)F 1458a_200012184419_200025704644 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.2816 CC(=Cc1cc(cc(c1C)C)O)C 271570a_100102525489_100010068915 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.2816 CC(=O)Cc1cc(cc(c1Br)F)F 1458a_100000070787_100015714476 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.2816 CC(=O)Cc1cc(cc(c1Cl)Br)I 1458a_100000070787_100021522891 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)C 1458a_100000070787_100015889675 [0,2,0,0,0,0|2,0,0]=4 8564 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)F 1458a_100000070787_100009813678 [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.2816 CC(=O)Cc1cc(cc(c1F)F)F 1458a_100011217549_200000210301 [0,2,0,0,0,0|2,0,0]=4 8566 B13R1.2816 CC(=O)Cc1cc(cc(c1I)I)I 1458a_100000070787_100010206063 [0,2,0,0,0,0|2,0,0]=4 8567 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Br)Br 1458a_100000070787_200009814416 [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200000210301 [0,2,0,0,0,0|2,0,0]=4 8569 B13R1.2816 CC(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200000210301 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)Cl)Cl 11a_200010220950_100015343762 [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)Cl)Cl 1626a_200010220950_100015343762 [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)F)F 11a_100000716482_100015343762 [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.2816 CC(=O)Nc1cc(cc(c1Br)F)F 1626a_100000716482_100015343762 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Br 11a_100010206801_100015343762 [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Br 1626a_100010206801_100015343762 [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Br 527a_100010206801_100103153847 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 11a_102495365385_100015343762 [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 1626a_102495365385_100015343762 [0,2,0,0,0,0|2,0,0]=4 8579 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 22a_102495365385_100000070787 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)C 527a_102495365385_100103153847 [0,2,0,0,0,0|2,0,0]=4 8581 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Cl 11a_100010063005_100015343762 [0,2,0,0,0,0|2,0,0]=4 8582 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Cl 1626a_100010063005_100015343762 [0,2,0,0,0,0|2,0,0]=4 8583 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)Cl 527a_100010063005_100103153847 [0,2,0,0,0,0|2,0,0]=4 8584 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 11a_100009814351_100015343762 [0,2,0,0,0,0|2,0,0]=4 8585 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 1626a_100009814351_100015343762 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 22a_100009814351_100000070787 [0,2,0,0,0,0|2,0,0]=4 8587 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Br)F 527a_100009814351_100103153847 [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.2816 CC(=O)Nc1cc(cc(c1C)C)C 11a_100000035412_100015343762 [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.2816 CC(=O)Nc1cc(cc(c1C)C)C 1626a_100000035412_100015343762 [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.2816 CC(=O)Nc1cc(cc(c1C)C)C 22a_100000035412_100000070787 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Cl)Cl 11a_200009956477_100015343762 [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.2816 CC(=O)Nc1cc(cc(c1C)Cl)Cl 1626a_200009956477_100015343762 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br 11a_100009813729_100015343762 [0,2,0,0,0,0|2,0,0]=4 8594 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br 1626a_100009813729_100015343762 [0,2,0,0,0,0|2,0,0]=4 8595 B13R1.2816 CC(=O)Nc1cc(cc(c1C)F)Br 527a_100009813729_100103153847 [0,2,0,0,0,0|2,0,0]=4 8596 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 11a_200000050010_100015343762 [0,2,0,0,0,0|2,0,0]=4 8597 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 1626a_200000050010_100015343762 [0,2,0,0,0,0|2,0,0]=4 8598 B13R1.2816 CC(=O)Nc1cc(cc(c1C)I)Cl 527a_200000050010_100103153847 [0,2,0,0,0,0|2,0,0]=4 8599 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)Cl)Cl 11a_106623411496_100015343762 [0,2,0,0,0,0|2,0,0]=4 8600 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)Cl)Cl 1626a_106623411496_100015343762 [0,2,0,0,0,0|2,0,0]=4 8601 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)F)F 11a_100000037168_100015343762 [0,2,0,0,0,0|2,0,0]=4 8602 B13R1.2816 CC(=O)Nc1cc(cc(c1Cl)F)F 1626a_100000037168_100015343762 [0,2,0,0,0,0|2,0,0]=4 8603 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)C 11a_100010589139_100015343762 [0,2,0,0,0,0|2,0,0]=4 8604 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)C 1626a_100010589139_100015343762 [0,2,0,0,0,0|2,0,0]=4 8605 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)C 22a_100010589139_100000070787 [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)Cl 11a_100010110407_100015343762 [0,2,0,0,0,0|2,0,0]=4 8607 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)Cl 1626a_100010110407_100015343762 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)F 11a_100000722353_100015343762 [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)F 1626a_100000722353_100015343762 [0,2,0,0,0,0|2,0,0]=4 8610 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Br)F 22a_100000722353_100000070787 [0,2,0,0,0,0|2,0,0]=4 8611 B13R1.2816 CC(=O)Nc1cc(cc(c1F)C)Br 11a_100010381932_100015343762 [0,2,0,0,0,0|2,0,0]=4 8612 B13R1.2816 CC(=O)Nc1cc(cc(c1F)C)Br 1626a_100010381932_100015343762 [0,2,0,0,0,0|2,0,0]=4 8613 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Cl)Cl 11a_100010713094_100015343762 [0,2,0,0,0,0|2,0,0]=4 8614 B13R1.2816 CC(=O)Nc1cc(cc(c1F)Cl)Cl 1626a_100010713094_100015343762 [0,2,0,0,0,0|2,0,0]=4 8615 B13R1.2816 CC(=O)Nc1cc(cc(c1F)F)F 11a_100000037171_100015343762 [0,2,0,0,0,0|2,0,0]=4 8616 B13R1.2816 CC(=O)Nc1cc(cc(c1F)F)F 1626a_100000037171_100015343762 [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)Cl 11a_100011155807_100015343762 [0,2,0,0,0,0|2,0,0]=4 8618 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)Cl 1626a_100011155807_100015343762 [0,2,0,0,0,0|2,0,0]=4 8619 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)F 11a_200010740111_100015343762 [0,2,0,0,0,0|2,0,0]=4 8620 B13R1.2816 CC(=O)Nc1cc(cc(c1I)Br)F 1626a_200010740111_100015343762 [0,2,0,0,0,0|2,0,0]=4 8621 B13R1.2816 CC(=O)Nc1cc(cc(c1I)C)Cl 11a_100000698757_100015343762 [0,2,0,0,0,0|2,0,0]=4 8622 B13R1.2816 CC(=O)Nc1cc(cc(c1I)C)Cl 1626a_100000698757_100015343762 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)C 11a_100021129147_100015343762 [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)C 1626a_100021129147_100015343762 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)Cl 11a_200021297760_100015343762 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)Cl 1626a_200021297760_100015343762 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)F 11a_100016149863_100015343762 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.2816 CC(=O)Nc1cc(cc(c1I)F)F 1626a_100016149863_100015343762 [0,2,0,0,0,0|2,0,0]=4 8629 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Br 22a_100010781877_100000070787 [0,2,0,0,0,0|2,0,0]=4 8630 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Br 527a_100010781877_100103153847 [0,2,0,0,0,0|2,0,0]=4 8631 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl 22a_106741647128_100000070787 [0,2,0,0,0,0|2,0,0]=4 8632 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)Cl 527a_106741647128_100103153847 [0,2,0,0,0,0|2,0,0]=4 8633 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)F 22a_200011217456_100000070787 [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Br)F 527a_200011217456_100103153847 [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 11a_100011825904_100015343762 [0,2,0,0,0,0|2,0,0]=4 8636 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 22a_100011825904_100000070787 [0,2,0,0,0,0|2,0,0]=4 8637 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 527a_100011825904_100103153847 [0,2,0,0,0,0|2,0,0]=4 8638 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 11a_100011216242_100015343762 [0,2,0,0,0,0|2,0,0]=4 8639 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 22a_100011216242_100000070787 [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 527a_100011216242_100103153847 [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 11a_100000130126_100015343762 [0,2,0,0,0,0|2,0,0]=4 8642 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 22a_100000130126_100000070787 [0,2,0,0,0,0|2,0,0]=4 8643 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 527a_100000130126_100103153847 [0,2,0,0,0,0|2,0,0]=4 8644 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Br 22a_100000694353_100000070787 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Br 527a_100000694353_100103153847 [0,2,0,0,0,0|2,0,0]=4 8646 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Cl 22a_100000695819_100000070787 [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.2816 CC(=O)Nc1cc(cc(c1O)Cl)Cl 527a_100000695819_100103153847 [0,2,0,0,0,0|2,0,0]=4 8648 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)Br 22a_100011217383_100000070787 [0,2,0,0,0,0|2,0,0]=4 8649 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)Br 527a_100011217383_100103153847 [0,2,0,0,0,0|2,0,0]=4 8650 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 1626a_100015205836_100015343762 [0,2,0,0,0,0|2,0,0]=4 8651 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 22a_100015205836_100000070787 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.2816 CC(=O)Nc1cc(cc(c1O)F)F 527a_100015205836_100103153847 [0,2,0,0,0,0|2,0,0]=4 8653 B13R1.2816 CC(=O)Nc1cc(cc(c1O)I)Br 22a_100016071998_100000070787 [0,2,0,0,0,0|2,0,0]=4 8654 B13R1.2816 CC(=O)Nc1cc(cc(c1O)I)Br 527a_100016071998_100103153847 [0,2,0,0,0,0|2,0,0]=4 8655 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1F)F)F 1458a_100011217549_200025704644 [0,2,0,0,0,0|2,0,0]=4 8656 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200025704644 [0,2,0,0,0,0|2,0,0]=4 8657 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200025704644 [0,2,0,0,0,0|2,0,0]=4 8658 B13R1.3421 Cc1cc(cc(c1)NS(=O)(=O)C)O 40a_100011995906_100000738038 [0,2,0,0,0,0|2,0,0]=4 8659 B13R1.3423 CC(=C(C)c1cc(cc(c1)Br)O)C 271570a_200000049429_100010068917 [0,2,0,0,0,0|2,0,0]=4 8660 B13R1.3423 CC(=C(C)c1cc(cc(c1)Cl)O)C 271570a_200000049429_100010068924 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.3423 CC(=C(C)c1cc(cc(c1)F)O)C 271570a_200000049429_100000717995 [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.3423 CC(=C(C)c1cc(cc(c1)O)C)C 271570a_200000049429_100011999630 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.3423 CC(=C(C)c1cc(cc(c1)O)O)C 271570a_200000049429_100009868816 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.3423 CC(=O)C(O)c1cc(cc(c1)F)F 1458a_100011218751_200000210301 [0,2,0,0,0,0|2,0,0]=4 8665 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)Br)F 11a_106741647397_100015343762 [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)Br)F 1626a_106741647397_100015343762 [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)Br)F 22a_106741647397_100000070787 [0,2,0,0,0,0|2,0,0]=4 8668 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)Cl)Cl 11a_100000220458_100015343762 [0,2,0,0,0,0|2,0,0]=4 8669 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)Cl)Cl 1626a_100000220458_100015343762 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)Cl)Cl 22a_100000220458_100000070787 [0,2,0,0,0,0|2,0,0]=4 8671 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)F)C 11a_103496528823_100015343762 [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)F)C 1626a_103496528823_100015343762 [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)F)C 22a_103496528823_100000070787 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)F)F 11a_100011233154_100015343762 [0,2,0,0,0,0|2,0,0]=4 8675 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)F)F 1626a_100011233154_100015343762 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.3423 CC(=O)N(C)c1cc(cc(c1)F)F 22a_100011233154_100000070787 [0,2,0,0,0,0|2,0,0]=4 8677 B13R1.3423 [13CH3]C(=O)C(O)c1cc(cc(c1)F)F 1458a_100011218751_200025704644 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.80 CC(C)(C)Oc1cccc(c1)CO 34a_100011214949_100000210625 [0,2,0,0,0,0|1,0,1]=4 8679 B13R1.80 COc1cccc(c1)NS(=O)(=O)C 40a_100000210024_100000738038 [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.80 COc1cccc(c1)OC(C)(C)C 34a_100000211255_100000210625 [0,2,0,0,0,0|1,0,1]=4 8681 B13R1.80 CS(=O)(=O)Nc1cccc(c1)CO 40a_100000211919_100000738038 [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.151 Cc1c(cccc1NS(=O)(=O)C)O 40a_100011216573_100000738038 [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 11a_100012022948_100015343762 [0,2,0,0,0,0|2,0,0]=4 8684 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 1626a_100012022948_100015343762 [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 22a_100012022948_100000070787 [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)C 527a_100012022948_100103153847 [0,2,0,0,0,0|2,0,0]=4 8687 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 11a_100000100531_100015343762 [0,2,0,0,0,0|2,0,0]=4 8688 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 1626a_100000100531_100015343762 [0,2,0,0,0,0|2,0,0]=4 8689 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 22a_100000100531_100000070787 [0,2,0,0,0,0|2,0,0]=4 8690 B13R1.97 C#Cc1ccc(c(c1)NC(=O)C)F 527a_100000100531_100103153847 [0,2,0,0,0,0|2,0,0]=4 8691 B13R1.97 C=Cc1ccc(c(c1)CC(=O)C)O 271570a_100011290941_200010006938 [0,2,0,0,0,0|2,0,0]=4 8692 B13R1.97 C=Cc1ccc(c(c1)NC(=O)C)C 271570a_100011290941_100011344836 [0,2,0,0,0,0|2,0,0]=4 8693 B13R1.97 C=Cc1ccc(c(c1)NC(=O)C)F 271570a_100011290941_200011951791 [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.97 C=Cc1ccc(c(c1)OC(=O)C)C 271570a_100011290941_100103282185 [0,2,0,0,0,0|1,0,0]=3 8695 B13R1.97 CC(=Cc1cc(ccc1C)CO)C 271570a_100102525489_100000050133 [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.97 CC(=Cc1cc(ccc1F)CO)C 271570a_100102525489_100000246287 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.97 CC(=Cc1cc(ccc1O)CO)C 271570a_100102525489_100011191544 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.97 CC(=O)Cc1cc(ccc1Br)C#N 1458a_100000070787_100012145668 [0,2,0,0,0,0|2,0,0]=4 8699 B13R1.97 CC(=O)Cc1cc(ccc1F)C#N 1458a_100000070787_100000239971 [0,2,0,0,0,0|2,0,0]=4 8700 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200010006938_200025704644 [0,2,0,0,0,0|1,1,0]=4 8701 B13R1.97 CC(=O)Cc1cc(ccc1O)S[13CH3] 62a_200025704644_200010006938 [0,2,0,0,0,0|1,1,0]=4 8702 B13R1.97 CC(=O)Nc1cc(ccc1Br)C#N 11a_100012001879_100015343762 [0,2,0,0,0,0|2,0,0]=4 8703 B13R1.97 CC(=O)Nc1cc(ccc1Br)C#N 1626a_100012001879_100015343762 [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 11a_100000748024_100015343762 [0,2,0,0,0,0|2,0,0]=4 8705 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 1626a_100000748024_100015343762 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 22a_100000748024_100000070787 [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.97 CC(=O)Nc1cc(ccc1C)C#N 527a_100000748024_100103153847 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.97 CC(=O)Nc1cc(ccc1C)CO 22a_100000758420_100000070787 [0,2,0,0,0,0|1,0,0]=3 8709 B13R1.97 CC(=O)Nc1cc(ccc1C)N[13CH3] 34a_100000740626_200025704644 [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.97 CC(=O)Nc1cc(ccc1C)N[13CH3] 7a_100000740626_200025704644 [0,2,0,0,0,0|2,0,0]=4 8711 B13R1.97 CC(=O)Nc1cc(ccc1C)S[13CH3] 62a_200025704644_100011344836 [0,2,0,0,0,0|1,1,0]=4 8712 B13R1.97 CC(=O)Nc1cc(ccc1Cl)C#N 11a_100000766345_100015343762 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.97 CC(=O)Nc1cc(ccc1Cl)C#N 1626a_100000766345_100015343762 [0,2,0,0,0,0|2,0,0]=4 8714 B13R1.97 CC(=O)Nc1cc(ccc1Cl)N[13CH3] 34a_100000745429_200025704644 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.97 CC(=O)Nc1cc(ccc1Cl)N[13CH3] 7a_100000745429_200025704644 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 11a_100011934650_100015343762 [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 1626a_100011934650_100015343762 [0,2,0,0,0,0|2,0,0]=4 8718 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 22a_100011934650_100000070787 [0,2,0,0,0,0|2,0,0]=4 8719 B13R1.97 CC(=O)Nc1cc(ccc1F)C#N 527a_100011934650_100103153847 [0,2,0,0,0,0|2,0,0]=4 8720 B13R1.97 CC(=O)Nc1cc(ccc1F)CO 22a_102125399562_100000070787 [0,2,0,0,0,0|1,0,0]=3 8721 B13R1.97 CC(=O)Nc1cc(ccc1F)N[13CH3] 34a_100000736141_200025704644 [0,2,0,0,0,0|2,0,0]=4 8722 B13R1.97 CC(=O)Nc1cc(ccc1F)N[13CH3] 7a_100000736141_200025704644 [0,2,0,0,0,0|2,0,0]=4 8723 B13R1.97 CC(=O)Nc1cc(ccc1F)S[13CH3] 62a_200025704644_200011951791 [0,2,0,0,0,0|1,1,0]=4 8724 B13R1.97 CC(=O)Nc1cc(ccc1I)C#N 11a_200012349464_100015343762 [0,2,0,0,0,0|2,0,0]=4 8725 B13R1.97 CC(=O)Nc1cc(ccc1I)C#N 1626a_200012349464_100015343762 [0,2,0,0,0,0|2,0,0]=4 8726 B13R1.97 CC(=O)Nc1cc(ccc1O)C#N 22a_100000766272_100000070787 [0,2,0,0,0,0|2,0,0]=4 8727 B13R1.97 CC(=O)Nc1cc(ccc1O)C#N 527a_100000766272_100103153847 [0,2,0,0,0,0|2,0,0]=4 8728 B13R1.97 CC(=O)Nc1cc(ccc1O)CO 22a_100000123545_100000070787 [0,2,0,0,0,0|1,0,0]=3 8729 B13R1.97 CC(=O)Nc1cc(ccc1O)CO 527a_100000123545_100103153847 [0,2,0,0,0,0|1,0,0]=3 8730 B13R1.97 CC(=O)Nc1cc(ccc1O)N[13CH3] 34a_100000070259_200025704644 [0,2,0,0,0,0|2,0,0]=4 8731 B13R1.97 CC(=O)Nc1cc(ccc1O)N[13CH3] 7a_100000070259_200025704644 [0,2,0,0,0,0|2,0,0]=4 8732 B13R1.97 CC(=O)Oc1cc(ccc1C)S[13CH3] 62a_100103282185_200025704644 [0,2,0,0,0,0|0,1,0]=3 8733 B13R1.97 CC(=O)Oc1cc(ccc1C)S[13CH3] 62a_200025704644_100103282185 [0,2,0,0,0,0|0,1,0]=3 8734 B13R1.97 CC(C)Oc1cc(ccc1Br)CO 34a_100010191536_100000210206 [0,2,0,0,0,0|1,0,1]=4 8735 B13R1.97 CC(C)Oc1cc(ccc1Br)CO 7a_100010191536_100000210206 [0,2,0,0,0,0|1,0,1]=4 8736 B13R1.97 CC(C)Oc1cc(ccc1Cl)CO 34a_100009876509_100000210206 [0,2,0,0,0,0|1,0,1]=4 8737 B13R1.97 CC(C)Oc1cc(ccc1Cl)CO 7a_100009876509_100000210206 [0,2,0,0,0,0|1,0,1]=4 8738 B13R1.97 CC(C)Oc1cc(ccc1F)CO 34a_100009842347_100000210206 [0,2,0,0,0,0|1,0,1]=4 8739 B13R1.97 CC(C)Oc1cc(ccc1F)CO 7a_100009842347_100000210206 [0,2,0,0,0,0|1,0,1]=4 8740 B13R1.97 CC(C)Oc1cc(ccc1I)CO 34a_100000049605_100000210206 [0,2,0,0,0,0|1,0,1]=4 8741 B13R1.97 CC(C)Oc1cc(ccc1I)CO 7a_100000049605_100000210206 [0,2,0,0,0,0|1,0,1]=4 8742 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 11a_200012022522_100015343762 [0,2,0,0,0,0|2,0,0]=4 8743 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 1626a_200012022522_100015343762 [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 22a_200012022522_100000070787 [0,2,0,0,0,0|2,0,0]=4 8745 B13R1.97 CCc1ccc(c(c1)NC(=O)C)C 527a_200012022522_100103153847 [0,2,0,0,0,0|2,0,0]=4 8746 B13R1.97 CCc1ccc(c(c1)NC(=O)C)O 22a_100000765835_100000070787 [0,2,0,0,0,0|2,0,0]=4 8747 B13R1.97 CCc1ccc(c(c1)NC(=O)C)O 527a_100000765835_100103153847 [0,2,0,0,0,0|2,0,0]=4 8748 B13R1.97 CNc1ccc(c(c1)NC(=O)C)C 34a_100000740626_200000210301 [0,2,0,0,0,0|2,0,0]=4 8749 B13R1.97 CNc1ccc(c(c1)NC(=O)C)C 7a_100000740626_200000210301 [0,2,0,0,0,0|2,0,0]=4 8750 B13R1.97 CNc1ccc(c(c1)NC(=O)C)Cl 34a_100000745429_200000210301 [0,2,0,0,0,0|2,0,0]=4 8751 B13R1.97 CNc1ccc(c(c1)NC(=O)C)Cl 7a_100000745429_200000210301 [0,2,0,0,0,0|2,0,0]=4 8752 B13R1.97 CNc1ccc(c(c1)NC(=O)C)F 34a_100000736141_200000210301 [0,2,0,0,0,0|2,0,0]=4 8753 B13R1.97 CNc1ccc(c(c1)NC(=O)C)F 7a_100000736141_200000210301 [0,2,0,0,0,0|2,0,0]=4 8754 B13R1.97 CNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_200000210301 [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.97 CNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_200000210301 [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.97 COc1ccc(c(c1)C=C(C)C)Br 271570a_100102525489_100009992028 [0,2,0,0,0,0|2,0,0]=4 8757 B13R1.97 COc1ccc(c(c1)C=C(C)C)C 271570a_100102525489_100012349166 [0,2,0,0,0,0|2,0,0]=4 8758 B13R1.97 COc1ccc(c(c1)C=C(C)C)Cl 271570a_100102525489_100011356938 [0,2,0,0,0,0|2,0,0]=4 8759 B13R1.97 COc1ccc(c(c1)C=C(C)C)F 271570a_100102525489_100000699733 [0,2,0,0,0,0|2,0,0]=4 8760 B13R1.97 COc1ccc(c(c1)C=C(C)C)N 271570a_100102525489_100015195136 [0,2,0,0,0,0|2,0,0]=4 8761 B13R1.97 COc1ccc(c(c1)C=C(C)C)O 271570a_100102525489_100000685887 [0,2,0,0,0,0|2,0,0]=4 8762 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000070787_100000761528 [0,2,0,0,0,0|1,0,0]=3 8763 B13R1.97 COc1ccc(c(c1)CC(=O)C)Br 1458a_100000690513_200000210301 [0,2,0,0,0,0|1,0,0]=3 8764 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100000070787_100000718613 [0,2,0,0,0,0|1,0,0]=3 8765 B13R1.97 COc1ccc(c(c1)CC(=O)C)Cl 1458a_100010217559_200000210301 [0,2,0,0,0,0|1,0,0]=3 8766 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100000070787_100010243555 [0,2,0,0,0,0|1,0,0]=3 8767 B13R1.97 COc1ccc(c(c1)CC(=O)C)F 1458a_100009868546_200000210301 [0,2,0,0,0,0|1,0,0]=3 8768 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Br 1458a_100000690513_200025704644 [0,2,0,0,0,0|1,0,0]=3 8769 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])Cl 1458a_100010217559_200025704644 [0,2,0,0,0,0|1,0,0]=3 8770 B13R1.97 COc1ccc(c(c1)CC(=O)[13CH3])F 1458a_100009868546_200025704644 [0,2,0,0,0,0|1,0,0]=3 8771 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 11a_100000748603_100015343762 [0,2,0,0,0,0|1,0,0]=3 8772 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 1626a_100000748603_100015343762 [0,2,0,0,0,0|1,0,0]=3 8773 B13R1.97 COc1ccc(c(c1)NC(=O)C)Br 22a_100000748603_100000070787 [0,2,0,0,0,0|1,0,0]=3 8774 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 11a_100000760359_100015343762 [0,2,0,0,0,0|1,0,0]=3 8775 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 1626a_100000760359_100015343762 [0,2,0,0,0,0|1,0,0]=3 8776 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 22a_100000760359_100000070787 [0,2,0,0,0,0|1,0,0]=3 8777 B13R1.97 COc1ccc(c(c1)NC(=O)C)C 527a_100000760359_100103153847 [0,2,0,0,0,0|1,0,0]=3 8778 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 11a_100000745576_100015343762 [0,2,0,0,0,0|1,0,0]=3 8779 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 1626a_100000745576_100015343762 [0,2,0,0,0,0|1,0,0]=3 8780 B13R1.97 COc1ccc(c(c1)NC(=O)C)Cl 22a_100000745576_100000070787 [0,2,0,0,0,0|1,0,0]=3 8781 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 11a_100000764331_100015343762 [0,2,0,0,0,0|1,0,0]=3 8782 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 1626a_100000764331_100015343762 [0,2,0,0,0,0|1,0,0]=3 8783 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 22a_100000764331_100000070787 [0,2,0,0,0,0|1,0,0]=3 8784 B13R1.97 COc1ccc(c(c1)NC(=O)C)F 527a_100000764331_100103153847 [0,2,0,0,0,0|1,0,0]=3 8785 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 11a_100000748021_100015343762 [0,2,0,0,0,0|1,0,0]=3 8786 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 1626a_100000748021_100015343762 [0,2,0,0,0,0|1,0,0]=3 8787 B13R1.97 COc1ccc(c(c1)NC(=O)C)I 22a_100000748021_100000070787 [0,2,0,0,0,0|1,0,0]=3 8788 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 22a_100000188146_100000070787 [0,2,0,0,0,0|1,0,0]=3 8789 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 271570a_203496583355_100011665069 [0,2,0,0,0,0|1,0,0]=3 8790 B13R1.97 COc1ccc(c(c1)NC(=O)C)O 527a_100000188146_100103153847 [0,2,0,0,0,0|1,0,0]=3 8791 B13R1.97 COc1ccc(c(c1)OC(C)C)Br 34a_100000719091_100000210206 [0,2,0,0,0,0|1,0,1]=4 8792 B13R1.97 COc1ccc(c(c1)OC(C)C)Br 7a_100000719091_100000210206 [0,2,0,0,0,0|1,0,1]=4 8793 B13R1.97 COc1ccc(c(c1)OC(C)C)C 34a_100012179981_100000210206 [0,2,0,0,0,0|1,0,1]=4 8794 B13R1.97 COc1ccc(c(c1)OC(C)C)C 7a_100012179981_100000210206 [0,2,0,0,0,0|1,0,1]=4 8795 B13R1.97 COc1ccc(c(c1)OC(C)C)Cl 34a_100011516019_100000210206 [0,2,0,0,0,0|1,0,1]=4 8796 B13R1.97 COc1ccc(c(c1)OC(C)C)Cl 7a_100011516019_100000210206 [0,2,0,0,0,0|1,0,1]=4 8797 B13R1.97 COc1ccc(c(c1)OC(C)C)F 34a_100012178750_100000210206 [0,2,0,0,0,0|1,0,1]=4 8798 B13R1.97 COc1ccc(c(c1)OC(C)C)F 7a_100012178750_100000210206 [0,2,0,0,0,0|1,0,1]=4 8799 B13R1.97 COc1ccc(c(c1)OC(C)C)I 34a_100010168831_100000210206 [0,2,0,0,0,0|1,0,1]=4 8800 B13R1.97 COc1ccc(c(c1)OC(C)C)I 7a_100010168831_100000210206 [0,2,0,0,0,0|1,0,1]=4 8801 B13R1.97 COc1ccc(c(c1)OC(C)C)N 34a_100016989039_100000210206 [0,2,0,0,0,0|1,0,1]=4 8802 B13R1.97 COc1ccc(c(c1)OC(C)C)N 7a_100016989039_100000210206 [0,2,0,0,0,0|1,0,1]=4 8803 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200000210301_200010006938 [0,2,0,0,0,0|1,1,0]=4 8804 B13R1.97 CSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_200000210301 [0,2,0,0,0,0|1,1,0]=4 8805 B13R1.97 CSc1ccc(c(c1)NC(=O)C)C 62a_200000210301_100011344836 [0,2,0,0,0,0|1,1,0]=4 8806 B13R1.97 CSc1ccc(c(c1)NC(=O)C)F 62a_200000210301_200011951791 [0,2,0,0,0,0|1,1,0]=4 8807 B13R1.97 CSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_200000210301 [0,2,0,0,0,0|0,1,0]=3 8808 B13R1.97 CSc1ccc(c(c1)OC(=O)C)C 62a_200000210301_100103282185 [0,2,0,0,0,0|0,1,0]=3 8809 B13R1.885 CC(=Cc1c(ccc(c1C)O)C)C 271570a_100102525489_100010659238 [0,2,0,0,0,0|2,0,0]=4 8810 B13R1.885 CC(=O)Cc1c(ccc(c1Br)Cl)F 1458a_100000070787_100011099539 [0,2,0,0,0,0|2,0,0]=4 8811 B13R1.885 CC(=O)Cc1c(ccc(c1Br)F)F 1458a_100016070055_200000210301 [0,2,0,0,0,0|2,0,0]=4 8812 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)Cl 1458a_100000070787_200010220899 [0,2,0,0,0,0|2,0,0]=4 8813 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000038137_200000210301 [0,2,0,0,0,0|2,0,0]=4 8814 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000070787_100009813558 [0,2,0,0,0,0|2,0,0]=4 8815 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)Cl)F 1458a_100000062034_200000210301 [0,2,0,0,0,0|2,0,0]=4 8816 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000037411_200000210301 [0,2,0,0,0,0|2,0,0]=4 8817 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000070787_100009813715 [0,2,0,0,0,0|2,0,0]=4 8818 B13R1.885 CC(=O)Cc1c(ccc(c1F)Br)Cl 1458a_100000070787_100010993448 [0,2,0,0,0,0|2,0,0]=4 8819 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000035286_200000210301 [0,2,0,0,0,0|2,0,0]=4 8820 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000070787_100009813557 [0,2,0,0,0,0|2,0,0]=4 8821 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100000070787_100011217880 [0,2,0,0,0,0|2,0,0]=4 8822 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100011218906_200000210301 [0,2,0,0,0,0|2,0,0]=4 8823 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)Br 1458a_100000070787_100011071994 [0,2,0,0,0,0|2,0,0]=4 8824 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)Cl 1458a_100000070787_100009814555 [0,2,0,0,0,0|2,0,0]=4 8825 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000038211_200000210301 [0,2,0,0,0,0|2,0,0]=4 8826 B13R1.885 CC(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000070787_100009813610 [0,2,0,0,0,0|2,0,0]=4 8827 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Br 1458a_100000070787_100011070584 [0,2,0,0,0,0|2,0,0]=4 8828 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Br 1458a_100010177769_200000210301 [0,2,0,0,0,0|2,0,0]=4 8829 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)Cl 1458a_100000070787_100010381632 [0,2,0,0,0,0|2,0,0]=4 8830 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)F 1458a_100000042514_200000210301 [0,2,0,0,0,0|2,0,0]=4 8831 B13R1.885 CC(=O)Cc1c(ccc(c1F)F)F 1458a_100000070787_100009813269 [0,2,0,0,0,0|2,0,0]=4 8832 B13R1.885 CC(=O)Nc1c(ccc(c1Br)F)F 11a_100014094178_100015343762 [0,2,0,0,0,0|2,0,0]=4 8833 B13R1.885 CC(=O)Nc1c(ccc(c1Br)F)F 1626a_100014094178_100015343762 [0,2,0,0,0,0|2,0,0]=4 8834 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)C 11a_200010074581_100015343762 [0,2,0,0,0,0|2,0,0]=4 8835 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)C 1626a_200010074581_100015343762 [0,2,0,0,0,0|2,0,0]=4 8836 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)C 22a_200010074581_100000070787 [0,2,0,0,0,0|2,0,0]=4 8837 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)F 11a_100010588651_100015343762 [0,2,0,0,0,0|2,0,0]=4 8838 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)F 1626a_100010588651_100015343762 [0,2,0,0,0,0|2,0,0]=4 8839 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)O 22a_100013039247_100000070787 [0,2,0,0,0,0|2,0,0]=4 8840 B13R1.885 CC(=O)Nc1c(ccc(c1C)Br)O 527a_100013039247_100103153847 [0,2,0,0,0,0|2,0,0]=4 8841 B13R1.885 CC(=O)Nc1c(ccc(c1C)C)C 11a_100000117417_100015343762 [0,2,0,0,0,0|2,0,0]=4 8842 B13R1.885 CC(=O)Nc1c(ccc(c1C)C)C 1626a_100000117417_100015343762 [0,2,0,0,0,0|2,0,0]=4 8843 B13R1.885 CC(=O)Nc1c(ccc(c1C)C)C 22a_100000117417_100000070787 [0,2,0,0,0,0|2,0,0]=4 8844 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)C 11a_200020642106_100015343762 [0,2,0,0,0,0|2,0,0]=4 8845 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)C 1626a_200020642106_100015343762 [0,2,0,0,0,0|2,0,0]=4 8846 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)Cl 11a_100009961198_100015343762 [0,2,0,0,0,0|2,0,0]=4 8847 B13R1.885 CC(=O)Nc1c(ccc(c1C)Cl)Cl 1626a_100009961198_100015343762 [0,2,0,0,0,0|2,0,0]=4 8848 B13R1.885 CC(=O)Nc1c(ccc(c1C)F)Br 11a_100011009917_100015343762 [0,2,0,0,0,0|2,0,0]=4 8849 B13R1.885 CC(=O)Nc1c(ccc(c1C)F)Br 1626a_100011009917_100015343762 [0,2,0,0,0,0|2,0,0]=4 8850 B13R1.885 CC(=O)Nc1c(ccc(c1C)I)C 11a_200010115591_100015343762 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.885 CC(=O)Nc1c(ccc(c1C)I)C 1626a_200010115591_100015343762 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.885 CC(=O)Nc1c(ccc(c1C)I)C 22a_200010115591_100000070787 [0,2,0,0,0,0|2,0,0]=4 8853 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)C)Cl 11a_100000210993_100015343762 [0,2,0,0,0,0|2,0,0]=4 8854 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)C)F 11a_106744479701_100015343762 [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)C)F 1626a_106744479701_100015343762 [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)Cl 11a_103437851083_100015343762 [0,2,0,0,0,0|2,0,0]=4 8857 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)Cl 1626a_103437851083_100015343762 [0,2,0,0,0,0|2,0,0]=4 8858 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)F 11a_100000061523_100015343762 [0,2,0,0,0,0|2,0,0]=4 8859 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)Cl)F 1626a_100000061523_100015343762 [0,2,0,0,0,0|2,0,0]=4 8860 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)F)F 11a_100000062006_100015343762 [0,2,0,0,0,0|2,0,0]=4 8861 B13R1.885 CC(=O)Nc1c(ccc(c1Cl)F)F 1626a_100000062006_100015343762 [0,2,0,0,0,0|2,0,0]=4 8862 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)Cl 11a_100010995236_100015343762 [0,2,0,0,0,0|2,0,0]=4 8863 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)Cl 1626a_100010995236_100015343762 [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)F 11a_100025793129_100015343762 [0,2,0,0,0,0|2,0,0]=4 8865 B13R1.885 CC(=O)Nc1c(ccc(c1F)Br)F 1626a_100025793129_100015343762 [0,2,0,0,0,0|2,0,0]=4 8866 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)Cl 11a_100000062009_100015343762 [0,2,0,0,0,0|2,0,0]=4 8867 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)Cl 1626a_100000062009_100015343762 [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)F 11a_102495364760_100015343762 [0,2,0,0,0,0|2,0,0]=4 8869 B13R1.885 CC(=O)Nc1c(ccc(c1F)C)F 1626a_102495364760_100015343762 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Br 11a_100011010633_100015343762 [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Br 1626a_100011010633_100015343762 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Cl 11a_200000061452_100015343762 [0,2,0,0,0,0|2,0,0]=4 8873 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)Cl 1626a_200000061452_100015343762 [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)F 11a_102495364764_100015343762 [0,2,0,0,0,0|2,0,0]=4 8875 B13R1.885 CC(=O)Nc1c(ccc(c1F)Cl)F 1626a_102495364764_100015343762 [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Br 11a_100010008850_100015343762 [0,2,0,0,0,0|2,0,0]=4 8877 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Br 1626a_100010008850_100015343762 [0,2,0,0,0,0|2,0,0]=4 8878 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Cl 11a_200010381624_100015343762 [0,2,0,0,0,0|2,0,0]=4 8879 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)Cl 1626a_200010381624_100015343762 [0,2,0,0,0,0|2,0,0]=4 8880 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)F 11a_100000037384_100015343762 [0,2,0,0,0,0|2,0,0]=4 8881 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)F 1626a_100000037384_100015343762 [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)I 11a_100015763296_100015343762 [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.885 CC(=O)Nc1c(ccc(c1F)F)I 1626a_100015763296_100015343762 [0,2,0,0,0,0|2,0,0]=4 8884 B13R1.885 CC(=O)Nc1c(ccc(c1O)Br)I 527a_100020748643_100103153847 [0,2,0,0,0,0|2,0,0]=4 8885 B13R1.885 Cc1ccc(c(c1Cl)CC(=O)[13CH3])F 1458a_100000038137_200025704644 [0,2,0,0,0,0|2,0,0]=4 8886 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])Cl 1458a_100000035286_200025704644 [0,2,0,0,0,0|2,0,0]=4 8887 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])F 1458a_100011218906_200025704644 [0,2,0,0,0,0|2,0,0]=4 8888 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Br)F)F 1458a_100016070055_200025704644 [0,2,0,0,0,0|2,0,0]=4 8889 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Cl)Cl)F 1458a_100000062034_200025704644 [0,2,0,0,0,0|2,0,0]=4 8890 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1Cl)F)F 1458a_100000037411_200025704644 [0,2,0,0,0,0|2,0,0]=4 8891 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)Cl)F 1458a_100000038211_200025704644 [0,2,0,0,0,0|2,0,0]=4 8892 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)F)Br 1458a_100010177769_200025704644 [0,2,0,0,0,0|2,0,0]=4 8893 B13R1.885 [13CH3]C(=O)Cc1c(ccc(c1F)F)F 1458a_100000042514_200025704644 [0,2,0,0,0,0|2,0,0]=4 8894 B13R1.897 CC(=C(C)c1cc(ccc1Br)O)C 271570a_200000049429_100012339312 [0,2,0,0,0,0|2,0,0]=4 8895 B13R1.897 CC(=C(C)c1cc(ccc1C)O)C 271570a_200000049429_100011380479 [0,2,0,0,0,0|2,0,0]=4 8896 B13R1.897 CC(=C(C)c1cc(ccc1Cl)O)C 271570a_200000049429_100000049588 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.897 CC(=C(C)c1cc(ccc1F)O)C 271570a_200000049429_100000693481 [0,2,0,0,0,0|2,0,0]=4 8898 B13R1.897 CC(=C(C)c1cc(ccc1N)O)C 271570a_200000049429_100012001276 [0,2,0,0,0,0|2,0,0]=4 8899 B13R1.897 CC(=C(C)c1cc(ccc1O)O)C 271570a_200000049429_100009813629 [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.897 CC(=O)C(O)c1cc(ccc1C)C 1458a_100011497465_200000210301 [0,2,0,0,0,0|2,0,0]=4 8901 B13R1.897 CC(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200000210301 [0,2,0,0,0,0|2,0,0]=4 8902 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)Cl 11a_100020633006_100015343762 [0,2,0,0,0,0|2,0,0]=4 8903 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)Cl 1626a_100020633006_100015343762 [0,2,0,0,0,0|2,0,0]=4 8904 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)F 11a_100020633008_100015343762 [0,2,0,0,0,0|2,0,0]=4 8905 B13R1.897 CC(=O)N(C)c1cc(ccc1Br)F 1626a_100020633008_100015343762 [0,2,0,0,0,0|2,0,0]=4 8906 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Br 11a_100020629602_100015343762 [0,2,0,0,0,0|2,0,0]=4 8907 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Br 1626a_100020629602_100015343762 [0,2,0,0,0,0|2,0,0]=4 8908 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Br 527a_100020629602_100103153847 [0,2,0,0,0,0|2,0,0]=4 8909 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Cl 11a_100000221440_100015343762 [0,2,0,0,0,0|2,0,0]=4 8910 B13R1.897 CC(=O)N(C)c1cc(ccc1C)Cl 1626a_100000221440_100015343762 [0,2,0,0,0,0|2,0,0]=4 8911 B13R1.897 CC(=O)N(C)c1cc(ccc1C)F 11a_114849113390_100015343762 [0,2,0,0,0,0|2,0,0]=4 8912 B13R1.897 CC(=O)N(C)c1cc(ccc1C)F 1626a_114849113390_100015343762 [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Br 11a_100011772073_100015343762 [0,2,0,0,0,0|2,0,0]=4 8914 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Br 1626a_100011772073_100015343762 [0,2,0,0,0,0|2,0,0]=4 8915 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Cl 11a_100000742562_100015343762 [0,2,0,0,0,0|2,0,0]=4 8916 B13R1.897 CC(=O)N(C)c1cc(ccc1Cl)Cl 1626a_100000742562_100015343762 [0,2,0,0,0,0|2,0,0]=4 8917 B13R1.897 CC(=O)N(C)c1cc(ccc1F)Br 11a_100011314990_100015343762 [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.897 CC(=O)N(C)c1cc(ccc1F)Br 1626a_100011314990_100015343762 [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.897 Cc1ccc(c(c1)C(O)C(=O)[13CH3])C 1458a_100011497465_200025704644 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.897 [13CH3]C(=O)C(O)c1cc(ccc1F)F 1458a_200011216140_200025704644 [0,2,0,0,0,0|2,0,0]=4 8921 B13R1.3089 C=Cc1ccc(cc1NC(=O)C)C 271570a_100011290941_100000182586 [0,2,0,0,0,0|2,0,0]=4 8922 B13R1.3089 C=Cc1ccc(cc1NC(=O)C)F 271570a_100011290941_100012558231 [0,2,0,0,0,0|2,0,0]=4 8923 B13R1.3089 C=Cc1ccc(cc1OC(=O)C)F 271570a_100011290941_200015685721 [0,2,0,0,0,0|1,0,0]=3 8924 B13R1.3089 CC(=Cc1cc(ccc1C#N)O)C 271570a_100102525489_100012184851 [0,2,0,0,0,0|2,0,0]=4 8925 B13R1.3089 CC(=Cc1cc(ccc1C=O)O)C 271570a_100102525489_100011236494 [0,2,0,0,0,0|2,0,0]=4 8926 B13R1.3089 CC(=Cc1cc(ccc1CO)O)C 271570a_100102525489_100010146404 [0,2,0,0,0,0|2,0,0]=4 8927 B13R1.3089 CC(=O)Cc1cc(ccc1C#N)Br 1458a_100000070787_100000718229 [0,2,0,0,0,0|2,0,0]=4 8928 B13R1.3089 CC(=O)Cc1cc(ccc1C#N)F 1458a_100000070787_100000759424 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.3089 CC(=O)Cc1cc(ccc1C=O)F 1458a_100000070787_100010132768 [0,2,0,0,0,0|2,0,0]=4 8930 B13R1.3089 CC(=O)Cc1cc(ccc1O[13CH3])Br 34a_200010006938_200025704644 [0,2,0,0,0,0|2,0,0]=4 8931 B13R1.3089 CC(=O)Cc1cc(ccc1O[13CH3])Br 7a_200010006938_200025704644 [0,2,0,0,0,0|2,0,0]=4 8932 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)Br 1626a_100000699244_100015343762 [0,2,0,0,0,0|2,0,0]=4 8933 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)C 11a_100011218341_100015343762 [0,2,0,0,0,0|2,0,0]=4 8934 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)C 1626a_100011218341_100015343762 [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)Cl 11a_100000211392_100015343762 [0,2,0,0,0,0|2,0,0]=4 8936 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)Cl 1626a_100000211392_100015343762 [0,2,0,0,0,0|2,0,0]=4 8937 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)F 11a_100011935279_100015343762 [0,2,0,0,0,0|2,0,0]=4 8938 B13R1.3089 CC(=O)Nc1cc(ccc1C#N)F 1626a_100011935279_100015343762 [0,2,0,0,0,0|2,0,0]=4 8939 B13R1.3089 CC(=O)Nc1cc(ccc1CO)C 22a_100000087799_100000070787 [0,2,0,0,0,0|2,0,0]=4 8940 B13R1.3089 CC(=O)Nc1cc(ccc1N[13CH3])Cl 34a_100000749253_200025704644 [0,2,0,0,0,0|2,0,0]=4 8941 B13R1.3089 CC(=O)Nc1cc(ccc1N[13CH3])Cl 7a_100000749253_200025704644 [0,2,0,0,0,0|2,0,0]=4 8942 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])C 34a_100000035807_200025704644 [0,2,0,0,0,0|2,0,0]=4 8943 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])C 7a_100000035807_200025704644 [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])Cl 34a_100000012038_200025704644 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])Cl 7a_100000012038_200025704644 [0,2,0,0,0,0|2,0,0]=4 8946 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])N 34a_100000070259_200025704644 [0,2,0,0,0,0|2,0,0]=4 8947 B13R1.3089 CC(=O)Nc1cc(ccc1O[13CH3])N 7a_100000070259_200025704644 [0,2,0,0,0,0|2,0,0]=4 8948 B13R1.3089 CC(=O)Nc1cc(ccc1S[13CH3])C 62a_200025704644_100000182586 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.3089 CC(=O)Nc1cc(ccc1S[13CH3])F 62a_200025704644_100012558231 [0,2,0,0,0,0|2,0,0]=4 8950 B13R1.3089 CC(=O)Oc1cc(ccc1S[13CH3])F 62a_200015685721_200025704644 [0,2,0,0,0,0|1,0,0]=3 8951 B13R1.3089 CC(=O)Oc1cc(ccc1S[13CH3])F 62a_200025704644_200015685721 [0,2,0,0,0,0|1,0,0]=3 8952 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 11a_100012354963_100015343762 [0,2,0,0,0,0|2,0,0]=4 8953 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 1626a_100012354963_100015343762 [0,2,0,0,0,0|2,0,0]=4 8954 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 22a_100012354963_100000070787 [0,2,0,0,0,0|2,0,0]=4 8955 B13R1.3089 CCc1ccc(cc1NC(=O)C)Br 527a_100012354963_100103153847 [0,2,0,0,0,0|2,0,0]=4 8956 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 11a_200012281948_100015343762 [0,2,0,0,0,0|2,0,0]=4 8957 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 1626a_200012281948_100015343762 [0,2,0,0,0,0|2,0,0]=4 8958 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 22a_200012281948_100000070787 [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.3089 CCc1ccc(cc1NC(=O)C)Cl 527a_200012281948_100103153847 [0,2,0,0,0,0|2,0,0]=4 8960 B13R1.3089 CNc1ccc(cc1NC(=O)C)Cl 34a_100000749253_200000210301 [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.3089 CNc1ccc(cc1NC(=O)C)Cl 7a_100000749253_200000210301 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.3089 COc1ccc(cc1C=C(C)C)O 271570a_100102525489_100010084122 [0,2,0,0,0,0|2,0,0]=4 8963 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 1458a_100000070787_100000204665 [0,2,0,0,0,0|2,0,0]=4 8964 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 1458a_100000763194_200000210301 [0,2,0,0,0,0|2,0,0]=4 8965 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 34a_200010006938_200000210301 [0,2,0,0,0,0|2,0,0]=4 8966 B13R1.3089 COc1ccc(cc1CC(=O)C)Br 7a_200010006938_200000210301 [0,2,0,0,0,0|2,0,0]=4 8967 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000070787_100000199068 [0,2,0,0,0,0|2,0,0]=4 8968 B13R1.3089 COc1ccc(cc1CC(=O)C)C 1458a_100000204598_200000210301 [0,2,0,0,0,0|2,0,0]=4 8969 B13R1.3089 COc1ccc(cc1CC(=O)C)Cl 1458a_100000070787_100000209806 [0,2,0,0,0,0|2,0,0]=4 8970 B13R1.3089 COc1ccc(cc1CC(=O)C)Cl 1458a_100000209874_200000210301 [0,2,0,0,0,0|2,0,0]=4 8971 B13R1.3089 COc1ccc(cc1CC(=O)C)F 1458a_100000070787_100011830354 [0,2,0,0,0,0|2,0,0]=4 8972 B13R1.3089 COc1ccc(cc1CC(=O)C)F 1458a_100000707523_200000210301 [0,2,0,0,0,0|2,0,0]=4 8973 B13R1.3089 COc1ccc(cc1CC(=O)C)O 271570a_203496583355_200011493461 [0,2,0,0,0,0|1,0,0]=3 8974 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])Br 1458a_100000763194_200025704644 [0,2,0,0,0,0|2,0,0]=4 8975 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])C 1458a_100000204598_200025704644 [0,2,0,0,0,0|2,0,0]=4 8976 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])Cl 1458a_100000209874_200025704644 [0,2,0,0,0,0|2,0,0]=4 8977 B13R1.3089 COc1ccc(cc1CC(=O)[13CH3])F 1458a_100000707523_200025704644 [0,2,0,0,0,0|2,0,0]=4 8978 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 11a_100000743470_100015343762 [0,2,0,0,0,0|2,0,0]=4 8979 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 1626a_100000743470_100015343762 [0,2,0,0,0,0|2,0,0]=4 8980 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 22a_100000743470_100000070787 [0,2,0,0,0,0|2,0,0]=4 8981 B13R1.3089 COc1ccc(cc1NC(=O)C)Br 527a_100000743470_100103153847 [0,2,0,0,0,0|2,0,0]=4 8982 B13R1.3089 COc1ccc(cc1NC(=O)C)C 11a_100000210980_100015343762 [0,2,0,0,0,0|2,0,0]=4 8983 B13R1.3089 COc1ccc(cc1NC(=O)C)C 1626a_100000210980_100015343762 [0,2,0,0,0,0|2,0,0]=4 8984 B13R1.3089 COc1ccc(cc1NC(=O)C)C 22a_100000210980_100000070787 [0,2,0,0,0,0|2,0,0]=4 8985 B13R1.3089 COc1ccc(cc1NC(=O)C)C 34a_100000035807_200000210301 [0,2,0,0,0,0|2,0,0]=4 8986 B13R1.3089 COc1ccc(cc1NC(=O)C)C 527a_100000210980_100103153847 [0,2,0,0,0,0|2,0,0]=4 8987 B13R1.3089 COc1ccc(cc1NC(=O)C)C 7a_100000035807_200000210301 [0,2,0,0,0,0|2,0,0]=4 8988 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 11a_100000182114_100015343762 [0,2,0,0,0,0|2,0,0]=4 8989 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 1626a_100000182114_100015343762 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 22a_100000182114_100000070787 [0,2,0,0,0,0|2,0,0]=4 8991 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 34a_100000012038_200000210301 [0,2,0,0,0,0|2,0,0]=4 8992 B13R1.3089 COc1ccc(cc1NC(=O)C)Cl 7a_100000012038_200000210301 [0,2,0,0,0,0|2,0,0]=4 8993 B13R1.3089 COc1ccc(cc1NC(=O)C)F 11a_100000757179_100015343762 [0,2,0,0,0,0|2,0,0]=4 8994 B13R1.3089 COc1ccc(cc1NC(=O)C)F 1626a_100000757179_100015343762 [0,2,0,0,0,0|2,0,0]=4 8995 B13R1.3089 COc1ccc(cc1NC(=O)C)F 22a_100000757179_100000070787 [0,2,0,0,0,0|2,0,0]=4 8996 B13R1.3089 COc1ccc(cc1NC(=O)C)F 527a_100000757179_100103153847 [0,2,0,0,0,0|2,0,0]=4 8997 B13R1.3089 COc1ccc(cc1NC(=O)C)I 11a_100011249504_100015343762 [0,2,0,0,0,0|2,0,0]=4 8998 B13R1.3089 COc1ccc(cc1NC(=O)C)I 1626a_100011249504_100015343762 [0,2,0,0,0,0|2,0,0]=4 8999 B13R1.3089 COc1ccc(cc1NC(=O)C)I 22a_100011249504_100000070787 [0,2,0,0,0,0|2,0,0]=4 9000 B13R1.3089 COc1ccc(cc1NC(=O)C)N 34a_100000070259_200000210301 [0,2,0,0,0,0|2,0,0]=4 9001 B13R1.3089 COc1ccc(cc1NC(=O)C)N 7a_100000070259_200000210301 [0,2,0,0,0,0|2,0,0]=4 9002 B13R1.3089 COc1ccc(cc1NC(=O)C)O 271570a_203496583355_200011407902 [0,2,0,0,0,0|1,0,0]=3 9003 B13R1.3089 COc1ccc(cc1OC(=O)C)O 271570a_203496583355_200011016479 [0,2,0,0,0,0|0,0,0]=2 9004 B13R1.3089 COc1ccc(cc1OC(C)C)O 271570a_203496583355_200010232110 [0,2,0,0,0,0|1,0,1]=4 9005 B13R1.3089 CSc1ccc(cc1NC(=O)C)C 62a_200000210301_100000182586 [0,2,0,0,0,0|2,0,0]=4 9006 B13R1.3089 CSc1ccc(cc1NC(=O)C)Cl 11a_100000745667_100015343762 [0,2,0,0,0,0|2,0,0]=4 9007 B13R1.3089 CSc1ccc(cc1NC(=O)C)Cl 1626a_100000745667_100015343762 [0,2,0,0,0,0|2,0,0]=4 9008 B13R1.3089 CSc1ccc(cc1NC(=O)C)Cl 22a_100000745667_100000070787 [0,2,0,0,0,0|2,0,0]=4 9009 B13R1.3089 CSc1ccc(cc1NC(=O)C)F 62a_200000210301_100012558231 [0,2,0,0,0,0|2,0,0]=4 9010 B13R1.3089 CSc1ccc(cc1OC(=O)C)F 62a_200000210301_200015685721 [0,2,0,0,0,0|1,0,0]=3 9011 B13R1.3089 CSc1ccc(cc1OC(=O)C)F 62a_200015685721_200000210301 [0,2,0,0,0,0|1,0,0]=3 9012 B13R1.115 CC(=Cc1cccc(c1C#N)O)C 271570a_100102525489_100012180507 [0,2,0,0,0,0|2,0,0]=4 9013 B13R1.115 CC(=Cc1cccc(c1C=O)O)C 271570a_100102525489_100009814793 [0,2,0,0,0,0|2,0,0]=4 9014 B13R1.115 CC(=O)Cc1cccc(c1C#N)Br 1458a_100000070787_200010145453 [0,2,0,0,0,0|2,0,0]=4 9015 B13R1.115 CC(=O)Cc1cccc(c1C#N)F 1458a_100000070787_100000707650 [0,2,0,0,0,0|2,0,0]=4 9016 B13R1.115 CC(=O)Nc1cccc(c1C#N)Br 11a_100011935054_100015343762 [0,2,0,0,0,0|2,0,0]=4 9017 B13R1.115 CC(=O)Nc1cccc(c1C#N)Br 1626a_100011935054_100015343762 [0,2,0,0,0,0|2,0,0]=4 9018 B13R1.115 CC(=O)Nc1cccc(c1C#N)C 11a_100000763283_100015343762 [0,2,0,0,0,0|2,0,0]=4 9019 B13R1.115 CC(=O)Nc1cccc(c1C#N)C 1626a_100000763283_100015343762 [0,2,0,0,0,0|2,0,0]=4 9020 B13R1.115 CC(=O)Nc1cccc(c1C#N)Cl 11a_100000236969_100015343762 [0,2,0,0,0,0|2,0,0]=4 9021 B13R1.115 CC(=O)Nc1cccc(c1C#N)Cl 1626a_100000236969_100015343762 [0,2,0,0,0,0|2,0,0]=4 9022 B13R1.115 CC(=O)Nc1cccc(c1C#N)F 11a_100000236971_100015343762 [0,2,0,0,0,0|2,0,0]=4 9023 B13R1.115 CC(=O)Nc1cccc(c1C#N)F 1626a_100000236971_100015343762 [0,2,0,0,0,0|2,0,0]=4 9024 B13R1.115 CC(=O)Nc1cccc(c1CO)Br 527a_100000747656_100103153847 [0,2,0,0,0,0|2,0,0]=4 9025 B13R1.115 CC(=O)Nc1cccc(c1CO)F 22a_100011846719_100000070787 [0,2,0,0,0,0|2,0,0]=4 9026 B13R1.115 COc1c(cccc1C=C(C)C)O 271570a_100102525489_100010234590 [0,2,0,0,0,0|2,0,0]=4 9027 B13R1.115 COc1c(cccc1CC(=O)C)Br 1458a_100000070787_100011470457 [0,2,0,0,0,0|2,0,0]=4 9028 B13R1.115 COc1c(cccc1CC(=O)C)C 1458a_100000070787_100012349798 [0,2,0,0,0,0|2,0,0]=4 9029 B13R1.115 COc1c(cccc1CC(=O)C)F 1458a_100000061543_200000210301 [0,2,0,0,0,0|2,0,0]=4 9030 B13R1.115 COc1c(cccc1CC(=O)[13CH3])F 1458a_100000061543_200025704644 [0,2,0,0,0,0|2,0,0]=4 9031 B13R1.115 COc1c(cccc1NC(=O)C)Br 11a_100011935253_100015343762 [0,2,0,0,0,0|2,0,0]=4 9032 B13R1.115 COc1c(cccc1NC(=O)C)Br 1626a_100011935253_100015343762 [0,2,0,0,0,0|2,0,0]=4 9033 B13R1.115 COc1c(cccc1NC(=O)C)Br 22a_100011935253_100000070787 [0,2,0,0,0,0|2,0,0]=4 9034 B13R1.115 COc1c(cccc1NC(=O)C)Br 527a_100011935253_100103153847 [0,2,0,0,0,0|2,0,0]=4 9035 B13R1.115 COc1c(cccc1NC(=O)C)C 11a_100012017360_100015343762 [0,2,0,0,0,0|2,0,0]=4 9036 B13R1.115 COc1c(cccc1NC(=O)C)C 1626a_100012017360_100015343762 [0,2,0,0,0,0|2,0,0]=4 9037 B13R1.115 COc1c(cccc1NC(=O)C)C 22a_100012017360_100000070787 [0,2,0,0,0,0|2,0,0]=4 9038 B13R1.115 COc1c(cccc1NC(=O)C)C 527a_100012017360_100103153847 [0,2,0,0,0,0|2,0,0]=4 9039 B13R1.115 COc1c(cccc1NC(=O)C)Cl 11a_100000743799_100015343762 [0,2,0,0,0,0|2,0,0]=4 9040 B13R1.115 COc1c(cccc1NC(=O)C)Cl 1626a_100000743799_100015343762 [0,2,0,0,0,0|2,0,0]=4 9041 B13R1.115 COc1c(cccc1NC(=O)C)Cl 22a_100000743799_100000070787 [0,2,0,0,0,0|2,0,0]=4 9042 B13R1.115 COc1c(cccc1NC(=O)C)Cl 527a_100000743799_100103153847 [0,2,0,0,0,0|2,0,0]=4 9043 B13R1.115 COc1c(cccc1NC(=O)C)F 11a_100011215007_100015343762 [0,2,0,0,0,0|2,0,0]=4 9044 B13R1.115 COc1c(cccc1NC(=O)C)F 1626a_100011215007_100015343762 [0,2,0,0,0,0|2,0,0]=4 9045 B13R1.115 COc1c(cccc1NC(=O)C)F 22a_100011215007_100000070787 [0,2,0,0,0,0|2,0,0]=4 9046 B13R1.115 COc1c(cccc1NC(=O)C)F 527a_100011215007_100103153847 [0,2,0,0,0,0|2,0,0]=4 9047 B13R1.641 CC(=Cc1cccc(c1Br)CO)C 271570a_100102525489_100010240205 [0,2,0,0,0,0|2,0,0]=4 9048 B13R1.641 CC(=Cc1cccc(c1C)CO)C 271570a_100102525489_100000694458 [0,2,0,0,0,0|2,0,0]=4 9049 B13R1.641 CC(=Cc1cccc(c1F)CO)C 271570a_100102525489_100011935076 [0,2,0,0,0,0|2,0,0]=4 9050 B13R1.641 CC(=Cc1cccc(c1N)CO)C 271570a_100102525489_100012349457 [0,2,0,0,0,0|2,0,0]=4 9051 B13R1.641 CC(=O)Cc1cccc(c1Br)C#N 1458a_100000070787_100010145452 [0,2,0,0,0,0|2,0,0]=4 9052 B13R1.641 CC(=O)Cc1cccc(c1Cl)C#N 1458a_100000070787_100010147161 [0,2,0,0,0,0|2,0,0]=4 9053 B13R1.641 CC(=O)Cc1cccc(c1F)C#N 1458a_100000070787_100000695645 [0,2,0,0,0,0|2,0,0]=4 9054 B13R1.641 CC(=O)Nc1cccc(c1Br)C#N 11a_100009877206_100015343762 [0,2,0,0,0,0|2,0,0]=4 9055 B13R1.641 CC(=O)Nc1cccc(c1Br)C#N 1626a_100009877206_100015343762 [0,2,0,0,0,0|2,0,0]=4 9056 B13R1.641 CC(=O)Nc1cccc(c1C)CO 22a_102495339961_100000070787 [0,2,0,0,0,0|1,0,0]=3 9057 B13R1.641 CC(=O)Nc1cccc(c1C)CO 527a_102495339961_100103153847 [0,2,0,0,0,0|1,0,0]=3 9058 B13R1.641 CC(=O)Nc1cccc(c1C)N[13CH3] 34a_100000736503_200025704644 [0,2,0,0,0,0|2,0,0]=4 9059 B13R1.641 CC(=O)Nc1cccc(c1C)N[13CH3] 7a_100000736503_200025704644 [0,2,0,0,0,0|2,0,0]=4 9060 B13R1.641 CC(=O)Nc1cccc(c1Cl)C#N 11a_100012184300_100015343762 [0,2,0,0,0,0|2,0,0]=4 9061 B13R1.641 CC(=O)Nc1cccc(c1Cl)C#N 1626a_100012184300_100015343762 [0,2,0,0,0,0|2,0,0]=4 9062 B13R1.641 CC(=O)Nc1cccc(c1F)C#N 11a_100000087142_100015343762 [0,2,0,0,0,0|2,0,0]=4 9063 B13R1.641 CC(=O)Nc1cccc(c1F)C#N 1626a_100000087142_100015343762 [0,2,0,0,0,0|2,0,0]=4 9064 B13R1.641 CC(=O)Nc1cccc(c1F)C#N 22a_100000087142_100000070787 [0,2,0,0,0,0|2,0,0]=4 9065 B13R1.641 CC(=O)Nc1cccc(c1F)C#N 527a_100000087142_100103153847 [0,2,0,0,0,0|2,0,0]=4 9066 B13R1.641 CC(=O)Nc1cccc(c1I)C#N 11a_200010145139_100015343762 [0,2,0,0,0,0|2,0,0]=4 9067 B13R1.641 CC(=O)Nc1cccc(c1I)C#N 1626a_200010145139_100015343762 [0,2,0,0,0,0|2,0,0]=4 9068 B13R1.641 CNc1cccc(c1C)NC(=O)C 34a_100000736503_200000210301 [0,2,0,0,0,0|2,0,0]=4 9069 B13R1.641 CNc1cccc(c1C)NC(=O)C 7a_100000736503_200000210301 [0,2,0,0,0,0|2,0,0]=4 9070 B13R1.641 COc1cccc(c1Br)NC(=O)C 11a_100000703447_100015343762 [0,2,0,0,0,0|1,0,0]=3 9071 B13R1.641 COc1cccc(c1Br)NC(=O)C 1626a_100000703447_100015343762 [0,2,0,0,0,0|1,0,0]=3 9072 B13R1.641 COc1cccc(c1Br)NC(=O)C 22a_100000703447_100000070787 [0,2,0,0,0,0|1,0,0]=3 9073 B13R1.641 COc1cccc(c1Br)NC(=O)C 527a_100000703447_100103153847 [0,2,0,0,0,0|1,0,0]=3 9074 B13R1.641 COc1cccc(c1Br)OC(C)C 34a_100010202623_100000210206 [0,2,0,0,0,0|1,0,1]=4 9075 B13R1.641 COc1cccc(c1Br)OC(C)C 7a_100010202623_100000210206 [0,2,0,0,0,0|1,0,1]=4 9076 B13R1.641 COc1cccc(c1C)C=C(C)C 271570a_100102525489_100010002647 [0,2,0,0,0,0|2,0,0]=4 9077 B13R1.641 COc1cccc(c1C)CC(=O)C 1458a_100000070787_100009876938 [0,2,0,0,0,0|1,0,0]=3 9078 B13R1.641 COc1cccc(c1C)NC(=O)C 11a_100011244893_100015343762 [0,2,0,0,0,0|1,0,0]=3 9079 B13R1.641 COc1cccc(c1C)NC(=O)C 1626a_100011244893_100015343762 [0,2,0,0,0,0|1,0,0]=3 9080 B13R1.641 COc1cccc(c1C)NC(=O)C 22a_100011244893_100000070787 [0,2,0,0,0,0|1,0,0]=3 9081 B13R1.641 COc1cccc(c1C)NC(=O)C 527a_100011244893_100103153847 [0,2,0,0,0,0|1,0,0]=3 9082 B13R1.641 COc1cccc(c1Cl)C=C(C)C 271570a_100102525489_100010147677 [0,2,0,0,0,0|2,0,0]=4 9083 B13R1.641 COc1cccc(c1Cl)CC(=O)C 1458a_100000070787_200010147866 [0,2,0,0,0,0|1,0,0]=3 9084 B13R1.641 COc1cccc(c1Cl)NC(=O)C 11a_100000089720_100015343762 [0,2,0,0,0,0|1,0,0]=3 9085 B13R1.641 COc1cccc(c1Cl)NC(=O)C 1626a_100000089720_100015343762 [0,2,0,0,0,0|1,0,0]=3 9086 B13R1.641 COc1cccc(c1Cl)NC(=O)C 22a_100000089720_100000070787 [0,2,0,0,0,0|1,0,0]=3 9087 B13R1.641 COc1cccc(c1Cl)NC(=O)C 527a_100000089720_100103153847 [0,2,0,0,0,0|1,0,0]=3 9088 B13R1.641 COc1cccc(c1Cl)OC(C)C 34a_100000087810_100000210206 [0,2,0,0,0,0|1,0,1]=4 9089 B13R1.641 COc1cccc(c1Cl)OC(C)C 7a_100000087810_100000210206 [0,2,0,0,0,0|1,0,1]=4 9090 B13R1.641 COc1cccc(c1F)C=C(C)C 271570a_100102525489_100010185846 [0,2,0,0,0,0|2,0,0]=4 9091 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000070787_100011260763 [0,2,0,0,0,0|1,0,0]=3 9092 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000698549_200000210301 [0,2,0,0,0,0|1,0,0]=3 9093 B13R1.641 COc1cccc(c1F)CC(=O)[13CH3] 1458a_100000698549_200025704644 [0,2,0,0,0,0|1,0,0]=3 9094 B13R1.641 COc1cccc(c1F)NC(=O)C 11a_100000100910_100015343762 [0,2,0,0,0,0|1,0,0]=3 9095 B13R1.641 COc1cccc(c1F)NC(=O)C 1626a_100000100910_100015343762 [0,2,0,0,0,0|1,0,0]=3 9096 B13R1.641 COc1cccc(c1F)NC(=O)C 22a_100000100910_100000070787 [0,2,0,0,0,0|1,0,0]=3 9097 B13R1.641 COc1cccc(c1F)NC(=O)C 527a_100000100910_100103153847 [0,2,0,0,0,0|1,0,0]=3 9098 B13R1.641 COc1cccc(c1F)OC(C)C 34a_100000102366_100000210206 [0,2,0,0,0,0|1,0,1]=4 9099 B13R1.641 COc1cccc(c1F)OC(C)C 7a_100000102366_100000210206 [0,2,0,0,0,0|1,0,1]=4 9100 B13R1.641 COc1cccc(c1I)NC(=O)C 11a_100010245509_100015343762 [0,2,0,0,0,0|1,0,0]=3 9101 B13R1.641 COc1cccc(c1I)NC(=O)C 1626a_100010245509_100015343762 [0,2,0,0,0,0|1,0,0]=3 9102 B13R1.641 COc1cccc(c1I)OC(C)C 34a_200010201982_100000210206 [0,2,0,0,0,0|1,0,1]=4 9103 B13R1.641 COc1cccc(c1I)OC(C)C 7a_200010201982_100000210206 [0,2,0,0,0,0|1,0,1]=4 9104 B13R1.641 COc1cccc(c1N)C=C(C)C 271570a_100102525489_100000708083 [0,2,0,0,0,0|2,0,0]=4 9105 B13R1.641 COc1cccc(c1N)OC(C)C 34a_100012022766_100000210206 [0,2,0,0,0,0|1,0,1]=4 9106 B13R1.641 COc1cccc(c1N)OC(C)C 7a_100012022766_100000210206 [0,2,0,0,0,0|1,0,1]=4 9107 B13R1.641 COc1cccc(c1O)C=C(C)C 271570a_100102525489_100000686866 [0,2,0,0,0,0|2,0,0]=4 9108 B13R1.641 COc1cccc(c1O)NC(=O)C 22a_100000123586_100000070787 [0,2,0,0,0,0|1,0,0]=3 9109 B13R1.641 COc1cccc(c1O)NC(=O)C 527a_100000123586_100103153847 [0,2,0,0,0,0|1,0,0]=3 9110 B13R1.641 COc1ccnc(c1C)CC(=O)C 1458a_100000070787_100016994983 [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.641 Cc1c(cccc1OC(C)C)CO 34a_200000084602_100000210206 [0,2,0,0,0,0|1,0,1]=4 9112 B13R1.641 Cc1c(cccc1OC(C)C)CO 7a_200000084602_100000210206 [0,2,0,0,0,0|1,0,1]=4 9113 B13R1.3768 CC(=C(C)c1cccc(c1Br)O)C 271570a_200000049429_100010187914 [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.3768 CC(=C(C)c1cccc(c1C)O)C 271570a_200000049429_100012002258 [0,2,0,0,0,0|2,0,0]=4 9115 B13R1.3768 CC(=C(C)c1cccc(c1Cl)O)C 271570a_200000049429_100000049636 [0,2,0,0,0,0|2,0,0]=4 9116 B13R1.3768 CC(=C(C)c1cccc(c1F)O)C 271570a_200000049429_100009817021 [0,2,0,0,0,0|2,0,0]=4 9117 B13R1.3768 CC(=C(C)c1cccc(c1N)O)C 271570a_200000049429_100011934926 [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.3768 CC(=C(C)c1cccc(c1O)O)C 271570a_200000049429_100009815950 [0,2,0,0,0,0|2,0,0]=4 9119 B13R1.3768 CC(=O)C(C)c1cccc(c1C)C 1458a_100000070787_100012183177 [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.3768 CC(=O)C(O)c1cccc(c1F)F 1458a_200011215923_200000210301 [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.3768 CC(=O)N(C)c1cccc(c1C)Cl 11a_100020606106_100015343762 [0,2,0,0,0,0|2,0,0]=4 9122 B13R1.3768 CC(=O)N(C)c1cccc(c1C)Cl 1626a_100020606106_100015343762 [0,2,0,0,0,0|2,0,0]=4 9123 B13R1.3768 CC(=O)N(C)c1cccc(c1C)Cl 22a_100020606106_100000070787 [0,2,0,0,0,0|2,0,0]=4 9124 B13R1.3768 CC(=O)N(C)c1cccc(c1Cl)Cl 11a_100000742713_100015343762 [0,2,0,0,0,0|2,0,0]=4 9125 B13R1.3768 CC(=O)N(C)c1cccc(c1Cl)Cl 1626a_100000742713_100015343762 [0,2,0,0,0,0|2,0,0]=4 9126 B13R1.3768 CC(=O)N(C)c1cccc(c1F)Cl 11a_100020633735_100015343762 [0,2,0,0,0,0|2,0,0]=4 9127 B13R1.3768 CC(=O)N(C)c1cccc(c1F)Cl 1626a_100020633735_100015343762 [0,2,0,0,0,0|2,0,0]=4 9128 B13R1.3768 [13CH3]C(=O)C(O)c1cccc(c1F)F 1458a_200011215923_200025704644 [0,2,0,0,0,0|2,0,0]=4 9129 B13R1.642 CC(=C(C)c1cccc(c1)CO)C 271570a_200000049429_100000687537 [0,2,0,0,0,0|2,0,0]=4 9130 B13R1.642 CC(=O)N(C)c1cccc(c1)C#N 11a_100000221292_100015343762 [0,2,0,0,0,0|2,0,0]=4 9131 B13R1.642 CC(=O)N(C)c1cccc(c1)C#N 1626a_100000221292_100015343762 [0,2,0,0,0,0|2,0,0]=4 9132 B13R1.642 CC(=O)N(C)c1cccc(c1)C#N 22a_100000221292_100000070787 [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.642 CC(=O)N(C)c1cccc(c1)C#N 527a_100000221292_100103153847 [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.642 CC(=O)N(C)c1cccc(c1)N[13CH3] 34a_100000765750_200025704644 [0,2,0,0,0,0|2,0,0]=4 9135 B13R1.642 CNc1cccc(c1)N(C)C(=O)C 34a_100000765750_200000210301 [0,2,0,0,0,0|2,0,0]=4 9136 B13R1.642 COc1cccc(c1)C(=C(C)C)C 271570a_200000049429_100000170001 [0,2,0,0,0,0|2,0,0]=4 9137 B13R1.642 COc1cccc(c1)N(C)C(=O)C 11a_100000219725_100015343762 [0,2,0,0,0,0|1,0,0]=3 9138 B13R1.642 COc1cccc(c1)N(C)C(=O)C 1626a_100000219725_100015343762 [0,2,0,0,0,0|1,0,0]=3 9139 B13R1.642 COc1cccc(c1)N(C)C(=O)C 22a_100000219725_100000070787 [0,2,0,0,0,0|1,0,0]=3 9140 B13R1.642 COc1cccc(c1)N(C)C(=O)C 527a_100000219725_100103153847 [0,2,0,0,0,0|1,0,0]=3 9141 B13R1.642 CSc1cccc(c1)N(C)C(=O)C 11a_100020672454_100015343762 [0,2,0,0,0,0|1,1,0]=4 9142 B13R1.642 CSc1cccc(c1)N(C)C(=O)C 22a_100020672454_100000070787 [0,2,0,0,0,0|1,1,0]=4 9143 B13R1.642 CSc1cccc(c1)N(C)C(=O)C 527a_100020672454_100103153847 [0,2,0,0,0,0|1,1,0]=4 9144 B13R1.716 CCN(C(=O)C)c1cccc(c1)Br 11a_100000738899_100015343762 [0,2,0,0,0,0|2,0,0]=4 9145 B13R1.716 CCN(C(=O)C)c1cccc(c1)Br 1626a_100000738899_100015343762 [0,2,0,0,0,0|2,0,0]=4 9146 B13R1.716 CCN(C(=O)C)c1cccc(c1)Br 22a_100000738899_100000070787 [0,2,0,0,0,0|2,0,0]=4 9147 B13R1.716 CCN(C(=O)C)c1cccc(c1)C 11a_100000182157_100015343762 [0,2,0,0,0,0|2,0,0]=4 9148 B13R1.716 CCN(C(=O)C)c1cccc(c1)C 1626a_100000182157_100015343762 [0,2,0,0,0,0|2,0,0]=4 9149 B13R1.716 CCN(C(=O)C)c1cccc(c1)C 22a_100000182157_100000070787 [0,2,0,0,0,0|2,0,0]=4 9150 B13R1.716 CCN(C(=O)C)c1cccc(c1)O 1626a_100000717746_100015343762 [0,2,0,0,0,0|1,0,0]=3 9151 B13R1.716 COC(C(=O)C)c1cccc(c1)Cl 1458a_100012350482_200000210301 [0,2,0,0,0,0|2,0,0]=4 9152 B13R1.716 COC(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100012350482_200025704644 [0,2,0,0,0,0|2,0,0]=4 9153 B13R1.3493 CC(=O)C(C)(C)c1cccc(c1)Br 1458a_100000749669_200000210301 [0,2,0,0,0,0|2,0,0]=4 9154 B13R1.3493 CC(=O)C(C)(C)c1cccc(c1)Cl 1458a_100000758063_200000210301 [0,2,0,0,0,0|2,0,0]=4 9155 B13R1.3493 CC(C)(C(=O)N)c1cccc(c1)O 271570a_203496583355_200009815690 [0,2,0,0,0,0|2,0,0]=4 9156 B13R1.3493 CC(C)(C(=O)[13CH3])c1cccc(c1)Br 1458a_100000749669_200025704644 [0,2,0,0,0,0|2,0,0]=4 9157 B13R1.3493 CC(C)(C(=O)[13CH3])c1cccc(c1)Cl 1458a_100000758063_200025704644 [0,2,0,0,0,0|2,0,0]=4 9158 B13R1.373 C=C=Cc1cccc(c1)CC(=O)C 271570a_100015277604_100000689217 [0,2,0,0,0,0|2,0,0]=4 9159 B13R1.373 C=C=Cc1cccc(c1)NC(=O)C 271570a_100015277604_100000153616 [0,2,0,0,0,0|2,0,0]=4 9160 B13R1.373 C=C=Cc1cccc(c1)OC(=O)C 271570a_100015277604_100009811612 [0,2,0,0,0,0|1,0,0]=3 9161 B13R1.373 CC(=Cc1cccc(c1)CCO)C 271570a_100102525489_100011217444 [0,2,0,0,0,0|2,0,0]=4 9162 B13R1.373 CC(=O)Cc1cccc(c1)SCF 62a_100000689217_100015361967 [0,2,0,0,0,0|1,1,0]=4 9163 B13R1.373 CC(=O)Cc1cccc(c1)SCF 62a_100015361967_100000689217 [0,2,0,0,0,0|1,1,0]=4 9164 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 11a_100000017804_100015343762 [0,2,0,0,0,0|2,0,0]=4 9165 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 1626a_100000017804_100015343762 [0,2,0,0,0,0|2,0,0]=4 9166 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 22a_100000017804_100000070787 [0,2,0,0,0,0|2,0,0]=4 9167 B13R1.373 CC(=O)Nc1cccc(c1)CC#N 527a_100000017804_100103153847 [0,2,0,0,0,0|2,0,0]=4 9168 B13R1.373 CC(=O)Nc1cccc(c1)CCO 22a_100011996697_100000070787 [0,2,0,0,0,0|1,0,0]=3 9169 B13R1.373 CC(=O)Nc1cccc(c1)CCO 527a_100011996697_100103153847 [0,2,0,0,0,0|1,0,0]=3 9170 B13R1.373 CC(=O)Nc1cccc(c1)CN[13CH3] 2230a_100000740035_200025704644 [0,2,0,0,0,0|2,0,0]=4 9171 B13R1.373 CC(=O)Nc1cccc(c1)CN[13CH3] 34a_100000740035_200025704644 [0,2,0,0,0,0|2,0,0]=4 9172 B13R1.373 CC(=O)Nc1cccc(c1)NCF 34a_100000749408_100015361967 [0,2,0,0,0,0|2,0,0]=4 9173 B13R1.373 CC(=O)Nc1cccc(c1)OCF 34a_100000158604_100015361967 [0,2,0,0,0,0|1,0,0]=3 9174 B13R1.373 CC(=O)Nc1cccc(c1)OCF 7a_100000158604_100015361967 [0,2,0,0,0,0|1,0,0]=3 9175 B13R1.373 CC(=O)Nc1cccc(c1)SCF 62a_100015361967_100000153616 [0,2,0,0,0,0|1,1,0]=4 9176 B13R1.373 CC(=O)Oc1cccc(c1)CS[13CH3] 62a_200009816940_200025704644 [0,2,0,0,0,0|0,1,0]=3 9177 B13R1.373 CC(=O)Oc1cccc(c1)CS[13CH3] 62a_200025704644_200009816940 [0,2,0,0,0,0|0,1,0]=3 9178 B13R1.373 CC(=O)Oc1cccc(c1)OCF 7a_100011218754_100015361967 [0,2,0,0,0,0|0,0,0]=2 9179 B13R1.373 CC(=O)Oc1cccc(c1)SCF 62a_100015361967_100009811612 [0,2,0,0,0,0|0,1,0]=3 9180 B13R1.373 CC(C)Oc1cccc(c1)CCO 34a_100011215281_100000210206 [0,2,0,0,0,0|1,0,1]=4 9181 B13R1.373 CC(C)Oc1cccc(c1)CCO 7a_100011215281_100000210206 [0,2,0,0,0,0|1,0,1]=4 9182 B13R1.373 CC(C)Oc1cccc(c1)OCF 34a_100000753242_100015361967 [0,2,0,0,0,0|1,0,1]=4 9183 B13R1.373 CC(C)Oc1cccc(c1)OCF 7a_100000753242_100015361967 [0,2,0,0,0,0|1,0,1]=4 9184 B13R1.373 CC=Cc1cccc(c1)CC(=O)C 271570a_100016259895_100000689217 [0,2,0,0,0,0|2,0,0]=4 9185 B13R1.373 CC=Cc1cccc(c1)NC(=O)C 271570a_100016259895_100000153616 [0,2,0,0,0,0|2,0,0]=4 9186 B13R1.373 CC=Cc1cccc(c1)OC(=O)C 271570a_100016259895_100009811612 [0,2,0,0,0,0|1,0,0]=3 9187 B13R1.373 CCNc1cccc(c1)NC(=O)C 34a_100000749408_100000210202 [0,2,0,0,0,0|2,0,0]=4 9188 B13R1.373 CCOc1cccc(c1)C=C(C)C 271570a_100102525489_100000170002 [0,2,0,0,0,0|2,0,0]=4 9189 B13R1.373 CCOc1cccc(c1)CC(=O)C 1458a_100000690747_200000210301 [0,2,0,0,0,0|1,0,0]=3 9190 B13R1.373 CCOc1cccc(c1)CC(=O)N 34a_200000747573_100000210202 [0,2,0,0,0,0|2,0,0]=4 9191 B13R1.373 CCOc1cccc(c1)CC(=O)N 7a_200000747573_100000210202 [0,2,0,0,0,0|2,0,0]=4 9192 B13R1.373 CCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690747_200025704644 [0,2,0,0,0,0|1,0,0]=3 9193 B13R1.373 CCOc1cccc(c1)NC(=O)C 11a_100000742568_100015343762 [0,2,0,0,0,0|1,0,0]=3 9194 B13R1.373 CCOc1cccc(c1)NC(=O)C 1626a_100000742568_100015343762 [0,2,0,0,0,0|1,0,0]=3 9195 B13R1.373 CCOc1cccc(c1)NC(=O)C 22a_100000742568_100000070787 [0,2,0,0,0,0|1,0,0]=3 9196 B13R1.373 CCOc1cccc(c1)NC(=O)C 34a_100000158604_100000210202 [0,2,0,0,0,0|1,0,0]=3 9197 B13R1.373 CCOc1cccc(c1)NC(=O)C 527a_100000742568_100103153847 [0,2,0,0,0,0|1,0,0]=3 9198 B13R1.373 CCOc1cccc(c1)NC(=O)C 7a_100000158604_100000210202 [0,2,0,0,0,0|1,0,0]=3 9199 B13R1.373 CCOc1cccc(c1)NC(=O)N 34a_100011219624_100000210202 [0,2,0,0,0,0|2,0,0]=4 9200 B13R1.373 CCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210202 [0,2,0,0,0,0|2,0,0]=4 9201 B13R1.373 CCOc1cccc(c1)OC(=O)C 7a_100011218754_100000210202 [0,2,0,0,0,0|0,0,0]=2 9202 B13R1.373 CCOc1cccc(c1)OC(C)C 34a_100000753242_100000210202 [0,2,0,0,0,0|1,0,1]=4 9203 B13R1.373 CCOc1cccc(c1)OC(C)C 34a_100011215941_100000210206 [0,2,0,0,0,0|1,0,1]=4 9204 B13R1.373 CCOc1cccc(c1)OC(C)C 7a_100000753242_100000210202 [0,2,0,0,0,0|1,0,1]=4 9205 B13R1.373 CCOc1cccc(c1)OC(C)C 7a_100011215941_100000210206 [0,2,0,0,0,0|1,0,1]=4 9206 B13R1.373 CCSc1cccc(c1)CC(=O)C 62a_100000210202_100000689217 [0,2,0,0,0,0|1,1,0]=4 9207 B13R1.373 CCSc1cccc(c1)CC(=O)C 62a_100000689217_100000210202 [0,2,0,0,0,0|1,1,0]=4 9208 B13R1.373 CCSc1cccc(c1)NC(=O)C 62a_100000210202_100000153616 [0,2,0,0,0,0|1,1,0]=4 9209 B13R1.373 CCSc1cccc(c1)OC(=O)C 62a_100000210202_100009811612 [0,2,0,0,0,0|0,1,0]=3 9210 B13R1.373 CNCc1cccc(c1)NC(=O)C 207a_100102657272_100011257792 [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.373 CNCc1cccc(c1)NC(=O)C 2230a_100000740035_200000210301 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.373 CNCc1cccc(c1)NC(=O)C 270004a_106832991635_100011257792 [0,2,0,0,0,0|2,0,0]=4 9213 B13R1.373 CNCc1cccc(c1)NC(=O)C 34a_100000740035_200000210301 [0,2,0,0,0,0|2,0,0]=4 9214 B13R1.373 CNCc1cccc(c1)OC(=O)C 207a_100102657272_100000014719 [0,2,0,0,0,0|1,0,0]=3 9215 B13R1.373 CNCc1cccc(c1)OC(=O)C 2230a_106832991635_200009816940 [0,2,0,0,0,0|1,0,0]=3 9216 B13R1.373 CNCc1cccc(c1)OC(=O)C 270004a_106832991635_100000014719 [0,2,0,0,0,0|1,0,0]=3 9217 B13R1.373 CNCc1cccc(c1)OC(=O)C 34a_100102657272_200009816940 [0,2,0,0,0,0|1,0,0]=3 9218 B13R1.373 CNCc1cccc(c1)OC(=O)C 7a_106832991635_200009816940 [0,2,0,0,0,0|1,0,0]=3 9219 B13R1.373 COCc1cccc(c1)C=C(C)C 271570a_100102525489_100011493687 [0,2,0,0,0,0|2,0,0]=4 9220 B13R1.373 COCc1cccc(c1)NC(=O)C 11a_100000737370_100015343762 [0,2,0,0,0,0|1,0,0]=3 9221 B13R1.373 COCc1cccc(c1)NC(=O)C 1626a_100000737370_100015343762 [0,2,0,0,0,0|1,0,0]=3 9222 B13R1.373 COCc1cccc(c1)NC(=O)C 22a_100000737370_100000070787 [0,2,0,0,0,0|1,0,0]=3 9223 B13R1.373 COCc1cccc(c1)NC(=O)C 527a_100000737370_100103153847 [0,2,0,0,0,0|1,0,0]=3 9224 B13R1.373 COCc1cccc(c1)OC(=O)C 34a_100138415774_200009816940 [0,2,0,0,0,0|0,0,0]=2 9225 B13R1.373 CSCc1cccc(c1)OC(=O)C 62a_200000210301_200009816940 [0,2,0,0,0,0|0,1,0]=3 9226 B13R1.373 CSCc1cccc(c1)OC(=O)C 62a_200009816940_200000210301 [0,2,0,0,0,0|0,1,0]=3 9227 B13R1.373 NC(=O)Cc1cccc(c1)OCF 34a_200000747573_100015361967 [0,2,0,0,0,0|2,0,0]=4 9228 B13R1.373 NC(=O)Cc1cccc(c1)OCF 7a_200000747573_100015361967 [0,2,0,0,0,0|2,0,0]=4 9229 B13R1.373 NC(=O)Nc1cccc(c1)OCF 34a_100011219624_100015361967 [0,2,0,0,0,0|2,0,0]=4 9230 B13R1.373 NC(=O)Nc1cccc(c1)OCF 7a_100011219624_100015361967 [0,2,0,0,0,0|2,0,0]=4 9231 B13R1.587 C=C(C)c1cccc(c1)CC(=O)C 271570a_100000694244_100000689217 [0,2,0,0,0,0|2,0,0]=4 9232 B13R1.587 C=C(C)c1cccc(c1)NC(=O)C 271570a_100000694244_100000153616 [0,2,0,0,0,0|2,0,0]=4 9233 B13R1.587 C=C(C)c1cccc(c1)OC(=O)C 271570a_100000694244_100009811612 [0,2,0,0,0,0|1,0,0]=3 9234 B13R1.587 CC(=Cc1cccc(c1)B(O)O)C 271570a_100102525489_100000687717 [0,2,0,0,0,0|2,0,0]=4 9235 B13R1.587 CC(=Cc1cccc(c1)C(C)O)C 271570a_100102525489_100000246457 [0,2,0,0,0,0|2,0,0]=4 9236 B13R1.587 CC(=O)Cc1cccc(c1)B(O)O 1458a_100000070787_100009814088 [0,2,0,0,0,0|1,0,0]=3 9237 B13R1.587 CC(=O)Cc1cccc(c1)C(=O)C 1458a_100000070787_100000084091 [0,2,0,0,0,0|1,0,1]=4 9238 B13R1.587 CC(=O)Cc1cccc(c1)C(=O)N 1458a_100000070787_100000738444 [0,2,0,0,0,0|1,0,1]=4 9239 B13R1.587 CC(=O)Cc1cccc(c1)C(F)F 1458a_100000070787_100012343606 [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.587 CC(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000070787_100000737091 [0,2,0,0,0,0|1,0,1]=4 9241 B13R1.587 CC(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000749288_200000210301 [0,2,0,0,0,0|1,0,1]=4 9242 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)C 1458a_100000188798_200000210301 [0,2,0,0,0,0|1,0,1]=4 9243 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)N 11a_100000217337_100015343762 [0,2,0,0,0,0|1,0,1]=4 9244 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)N 1626a_100000217337_100015343762 [0,2,0,0,0,0|1,0,1]=4 9245 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)N 22a_100000217337_100000070787 [0,2,0,0,0,0|1,0,1]=4 9246 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)[13CH3] 1458a_100000188798_200025704644 [0,2,0,0,0,0|1,0,1]=4 9247 B13R1.587 CC(=O)Nc1cccc(c1)C(=S)N 11a_200011830438_100015343762 [0,2,0,0,0,0|1,1,0]=4 9248 B13R1.587 CC(=O)Nc1cccc(c1)C(=S)N 1626a_200011830438_100015343762 [0,2,0,0,0,0|1,1,0]=4 9249 B13R1.587 CC(=O)Nc1cccc(c1)C(=S)N 527a_200011830438_100103153847 [0,2,0,0,0,0|1,1,0]=4 9250 B13R1.587 CC(=O)Nc1cccc(c1)C(C)C 11a_100000211879_100015343762 [0,2,0,0,0,0|2,0,0]=4 9251 B13R1.587 CC(=O)Nc1cccc(c1)C(C)C 1626a_100000211879_100015343762 [0,2,0,0,0,0|2,0,0]=4 9252 B13R1.587 CC(=O)Nc1cccc(c1)C(C)C 22a_100000211879_100000070787 [0,2,0,0,0,0|2,0,0]=4 9253 B13R1.587 CC(=O)Nc1cccc(c1)C(C)C 527a_100000211879_100103153847 [0,2,0,0,0,0|2,0,0]=4 9254 B13R1.587 CC(=O)Nc1cccc(c1)C(C)O 22a_100011217120_100000070787 [0,2,0,0,0,0|1,0,0]=3 9255 B13R1.587 CC(=O)Nc1cccc(c1)C(C)O 527a_100011217120_100103153847 [0,2,0,0,0,0|1,0,0]=3 9256 B13R1.587 CC(=O)Nc1cccc(c1)C(F)F 11a_100000058342_100015343762 [0,2,0,0,0,0|2,0,0]=4 9257 B13R1.587 CC(=O)Nc1cccc(c1)C(F)F 1626a_100000058342_100015343762 [0,2,0,0,0,0|2,0,0]=4 9258 B13R1.587 CC(=O)Nc1cccc(c1)C(F)F 22a_100000058342_100000070787 [0,2,0,0,0,0|2,0,0]=4 9259 B13R1.587 CC(=O)Nc1cccc(c1)C(F)F 527a_100000058342_100103153847 [0,2,0,0,0,0|2,0,0]=4 9260 B13R1.587 CC(=O)Nc1cccc(c1)N(C)C 11a_100000209982_100015343762 [0,2,0,0,0,0|2,0,0]=4 9261 B13R1.587 CC(=O)Nc1cccc(c1)N(C)C 1626a_100000209982_100015343762 [0,2,0,0,0,0|2,0,0]=4 9262 B13R1.587 CC(=O)Nc1cccc(c1)N(C)C 22a_100000209982_100000070787 [0,2,0,0,0,0|2,0,0]=4 9263 B13R1.587 CC(=O)Nc1cccc(c1)N(C)C 527a_100000209982_100103153847 [0,2,0,0,0,0|2,0,0]=4 9264 B13R1.587 CC(=O)Nc1cccc(c1)[N+](=O)[O-] 11a_100000184103_100015343762 [0,2,0,0,0,0|1,0,1]=4 9265 B13R1.587 CC(=O)Nc1cccc(c1)[N+](=O)[O-] 1626a_100000184103_100015343762 [0,2,0,0,0,0|1,0,1]=4 9266 B13R1.587 CC(=O)Nc1cccc(c1)[N+](=O)[O-] 22a_100000184103_100000070787 [0,2,0,0,0,0|1,0,1]=4 9267 B13R1.587 CC(C)Oc1cccc(c1)C(C)O 34a_100000748013_100000210206 [0,2,0,0,0,0|1,0,1]=4 9268 B13R1.587 CC(C)Oc1cccc(c1)C(C)O 7a_100000748013_100000210206 [0,2,0,0,0,0|1,0,1]=4 9269 B13R1.587 [13CH3]C(=O)Cc1cccc(c1)[N+](=O)[O-] 1458a_100000749288_200025704644 [0,2,0,0,0,0|1,0,1]=4 9270 B11R1.124 C=C=Cc1ccc(o1)C(=O)C 271570a_100015277604_100000229899 [0,0,1,1,0,0|1,0,1]=4 9271 B11R1.124 CC=Cc1ccc(o1)C(=O)C 271570a_100016259895_100000229899 [0,0,1,1,0,0|1,0,1]=4 9272 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,0,1,1,0,0|2,0,0]=4 9273 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,0,1,1,0,0|1,0,1]=4 9274 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,0,1,1,0,0|1,0,1]=4 9275 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,0,1,1,0,0|2,0,0]=4 9276 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,0,1,1,0,0|2,0,0]=4 9277 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,0,1,1,0,0|2,0,0]=4 9278 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,0,1,1,0,0|2,0,0]=4 9279 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,0,1,1,0,0|2,0,0]=4 9280 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,0,1,1,0,0|2,0,0]=4 9281 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,0,1,1,0,0|2,0,0]=4 9282 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,0,1,1,0,0|1,0,1]=4 9283 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,0,1,1,0,0|2,0,0]=4 9284 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,0,1,1,0,0|2,0,0]=4 9285 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,0,1,1,0,0|2,0,0]=4 9286 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,0,1,1,0,0|2,0,0]=4 9287 B11R1.172 CC(=O)NN=Cc1ccco1 4a_100000189765_100000186105 [0,0,1,1,0,0|2,0,0]=4 9288 B11R1.172 CC(=O)OCSc1ccco1 62a_100000076356_100009814098 [0,0,1,1,0,0|1,0,1]=4 9289 B11R1.172 CC(=O)OCSc1ccco1 62a_100009814098_100000076356 [0,0,1,1,0,0|1,0,1]=4 9290 B11R1.77 CC(=O)CC(=O)c1ccco1 1458a_100000070787_100000211439 [0,0,1,1,0,0|2,0,0]=4 9291 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [0,0,1,1,0,0|2,0,0]=4 9292 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [0,0,1,1,0,0|2,0,0]=4 9293 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [0,0,1,1,0,0|2,0,0]=4 9294 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [0,0,1,1,0,0|2,0,0]=4 9295 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [0,0,1,1,0,0|1,0,1]=4 9296 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [0,0,1,1,0,0|2,0,0]=4 9297 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [0,0,1,1,0,0|2,0,0]=4 9298 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [0,0,1,1,0,0|1,0,1]=4 9299 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [0,0,1,1,0,0|2,0,0]=4 9300 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [0,0,1,1,0,0|2,0,0]=4 9301 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [0,0,1,1,0,0|2,0,0]=4 9302 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [0,0,1,1,0,0|2,0,0]=4 9303 B11R1.75 CC(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200000210301 [0,0,1,1,0,0|2,0,0]=4 9304 B11R1.75 CC(=O)C=Cc1ccc(o1)C 1458a_100000183563_200000210301 [0,0,1,1,0,0|1,0,1]=4 9305 B11R1.75 CC(=O)C=Cc1ccc(o1)I 1458a_100000679848_200000210301 [0,0,1,1,0,0|2,0,0]=4 9306 B11R1.75 Cc1ccc(o1)C=CC(=O)[13CH3] 1458a_100000183563_200025704644 [0,0,1,1,0,0|1,0,1]=4 9307 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200025704644 [0,0,1,1,0,0|2,0,0]=4 9308 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)I 1458a_100000679848_200025704644 [0,0,1,1,0,0|2,0,0]=4 9309 B11R2.35 Oc1cccc(c1)C2CC2 271570a_100011220607_100000211634 [1,0,0,1,0,0|1,0,1]=4 9310 B11R2.35 Oc1cccc(c1)C2CC2 271570a_203496583355_100009816567 [1,0,0,1,0,0|1,0,1]=4 9311 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,0,0,1,0,0|2,0,0]=4 9312 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [1,0,0,1,0,0|2,0,0]=4 9313 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,0,0,1,0,0|1,0,0]=3 9314 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,0,0,1,0,0|1,0,1]=4 9315 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [1,0,0,1,0,0|1,0,1]=4 9316 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [1,0,0,1,0,0|2,0,0]=4 9317 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [1,0,0,1,0,0|2,0,0]=4 9318 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [1,0,0,1,0,0|1,0,1]=4 9319 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,0,0,1,0,0|0,0,1]=3 9320 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,0,0,1,0,0|0,0,2]=4 9321 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,0,0,1,0,0|1,0,1]=4 9322 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,0,0,1,0,0|0,0,1]=3 9323 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,0,0,1,0,0|0,1,1]=4 9324 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,0,0,1,0,0|1,0,1]=4 9325 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [1,0,0,1,0,0|1,0,0]=3 9326 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [1,0,0,1,0,0|1,1,0]=4 9327 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,0,0,1,0,0|1,0,1]=4 9328 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [1,0,0,1,0,0|1,0,1]=4 9329 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,0,0,1,0,0|1,1,0]=4 9330 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [1,0,0,1,0,0|1,1,0]=4 9331 B11R2.36 Oc1cnc2ncoc2c1 271570a_203496583355_100000721906 [1,0,0,1,0,0|2,0,0]=4 9332 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,0,0,1,0,0|1,0,0]=3 9333 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [1,0,0,1,0,0|1,0,1]=4 9334 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [1,0,0,1,0,0|1,0,1]=4 9335 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [1,0,0,1,0,0|0,0,1]=3 9336 B11R2.106 Oc1cccc2c1CNC2 271570a_203496583355_100000703859 [1,0,0,1,0,0|2,0,0]=4 9337 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [1,0,0,1,0,0|2,0,0]=4 9338 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [1,0,0,1,0,0|0,0,2]=4 9339 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,0,0,1,0,0|2,0,0]=4 9340 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [1,0,0,1,0,0|1,0,1]=4 9341 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,0,0,1,0,0|0,0,1]=3 9342 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [1,0,0,1,0,0|0,1,1]=4 9343 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [1,0,0,1,0,0|1,0,1]=4 9344 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [1,0,0,1,0,0|2,0,0]=4 9345 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [1,0,0,1,0,0|1,0,0]=3 9346 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [1,0,0,1,0,0|1,1,0]=4 9347 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,0,0,1,0,0|1,0,1]=4 9348 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,0,0,1,0,0|1,0,1]=4 9349 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,0,0,1,0,0|1,1,0]=4 9350 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [1,0,0,1,0,0|1,1,0]=4 9351 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [1,0,0,1,0,0|1,0,1]=4 9352 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [1,0,0,1,0,0|0,0,2]=4 9353 B11R2.238 c1ccc(cc1)OC2CC2 34a_100000210340_100000211595 [1,0,0,1,0,0|1,0,1]=4 9354 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [0,0,0,1,0,1|2,0,0]=4 9355 B13R2.162 O=C1CCc2cccc(c2C1)O 271570a_203496583355_100010006498 [0,0,0,1,0,1|1,0,0]=3 9356 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,0,0,1,0,1|2,0,0]=4 9357 B13R2.3683 Cc1ccc2cc(ccc2n1)O 271570a_203496583355_100000686635 [0,0,0,1,0,1|2,0,0]=4 9358 B13R2.3683 Cc1cnc2cc(ccc2c1)O 271570a_203496583355_100010751441 [0,0,0,1,0,1|2,0,0]=4 9359 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [0,0,0,1,0,1|1,0,0]=3 9360 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [0,0,0,1,0,1|2,0,0]=4 9361 B13R2.3683 O=C1CCc2cc(ccc2O1)O 271570a_203496583355_100010179853 [0,0,0,1,0,1|2,0,0]=4 9362 B13R2.3683 O=C1CNc2cc(ccc2N1)O 271570a_203496583355_100000693460 [0,0,0,1,0,1|2,0,0]=4 9363 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,0,0,1,0,1|1,0,0]=3 9364 B13R2.3683 O=C1COc2cc(cnc2N1)O 271570a_203496583355_100010209494 [0,0,0,1,0,1|2,0,0]=4 9365 B13R2.3683 O=C1COc2nc(ccc2N1)O 271570a_203496583355_100010201792 [0,0,0,1,0,1|2,0,0]=4 9366 B13R2.3683 O=C1CSc2cc(ccc2N1)O 271570a_203496583355_100011830382 [0,0,0,1,0,1|1,1,0]=4 9367 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,0,0,1,0,1|1,0,0]=3 9368 B13R2.3683 O=C1NCc2cc(ccc2N1)O 271570a_203496583355_100010171468 [0,0,0,1,0,1|2,0,0]=4 9369 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,0,0,1,0,1|1,0,0]=3 9370 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,0,0,1,0,1|2,0,0]=4 9371 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [0,0,0,1,0,1|2,0,0]=4 9372 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,0,0,1,0,1|2,0,0]=4 9373 B13R2.5331 Oc1cccc(c1)OCC2CC2 271570a_203496583355_100011316337 [0,0,0,1,0,1|1,0,1]=4 9374 B13R2.3050 Cc1ccc2c(c1O)CC(=O)N2 271570a_203496583355_100015548004 [0,1,0,1,0,0|1,0,0]=3 9375 B13R2.13083 Cc1cc2[nH]c(=O)[nH]c2cc1O 271570a_203496583355_100010107294 [0,1,0,1,0,0|2,0,0]=4 9376 B13R2.13083 Cc1cc2c(cc1O)CC(=O)N2 271570a_203496583355_100010201617 [0,1,0,1,0,0|2,0,0]=4 9377 B13R2.13083 Cc1cc2cc(c(cc2[nH]1)F)O 271570a_203496583355_200010763346 [0,1,0,1,0,0|2,0,0]=4 9378 B13R2.13083 Cc1nc2cc(c(cc2[nH]1)F)O 271570a_203496583355_100000733457 [0,1,0,1,0,0|2,0,0]=4 9379 B13R2.13083 Cc1nc2cc(c(cc2s1)O)C 271570a_203496583355_200010762721 [0,1,0,1,0,0|1,1,0]=4 9380 B13R2.13083 O=C1Cc2cc(c(cc2N1)Cl)O 271570a_203496583355_100012929135 [0,1,0,1,0,0|2,0,0]=4 9381 B13R2.13083 O=C1Cc2cc(c(cc2N1)F)O 271570a_203496583355_100000727509 [0,1,0,1,0,0|2,0,0]=4 9382 B13R2.13083 O=C1Cc2cc(c(cc2N1)O)F 271570a_203496583355_200010218348 [0,1,0,1,0,0|1,0,0]=3 9383 B13R2.43 CCc1cc2cc(ccc2o1)O 271570a_203496583355_200010233821 [0,1,0,1,0,0|1,0,1]=4 9384 B13R2.43 CCc1nc2cc(ccc2o1)O 271570a_203496583355_100009817032 [0,1,0,1,0,0|1,0,1]=4 9385 B13R2.43 CNc1nc2ccc(cc2s1)O 271570a_203496583355_100012351673 [0,1,0,1,0,0|1,1,0]=4 9386 B13R2.43 CNc1nc2ccc(cc2s1)O 27a_100102657272_100010063415 [0,1,0,1,0,0|1,1,0]=4 9387 B13R2.43 CSc1nc2cc(ccc2s1)O 271570a_203496583355_200010003198 [0,1,0,1,0,0|1,1,0]=4 9388 B13R2.43 CSc1nc2ccc(cc2s1)O 271570a_203496583355_100010193624 [0,1,0,1,0,0|1,1,0]=4 9389 B13R2.43 CSc1nc2ccc(cc2s1)O 62a_200000210301_100010063415 [0,1,0,1,0,0|1,1,0]=4 9390 B13R2.43 O=Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009820874 [0,1,0,1,0,0|2,0,0]=4 9391 B13R2.43 O=Cc1cc2cc(ccc2o1)O 271570a_203496583355_100000755920 [0,1,0,1,0,0|2,0,0]=4 9392 B13R2.43 O=Cc1cc2cc(ccc2s1)O 271570a_203496583355_100010238522 [0,1,0,1,0,0|2,0,0]=4 9393 B13R2.43 O=Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000736022 [0,1,0,1,0,0|1,0,1]=4 9394 B13R2.43 O=Cc1cc2ccc(cc2s1)O 271570a_203496583355_100009814784 [0,1,0,1,0,0|0,1,1]=4 9395 B13R2.43 O=Cc1nc2ccc(cc2[nH]1)O 271570a_203496583355_200011361486 [0,1,0,1,0,0|2,0,0]=4 9396 B13R2.43 OCc1cc2cc(ccc2o1)O 271570a_203496583355_100011934623 [0,1,0,1,0,0|1,0,1]=4 9397 B13R2.43 OCc1cc2cc(ccc2s1)O 271570a_203496583355_100010255381 [0,1,0,1,0,0|1,1,0]=4 9398 B13R2.43 OCc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000735881 [0,1,0,1,0,0|2,0,0]=4 9399 B13R2.43 OCc1cc2ccc(cc2s1)O 271570a_203496583355_100010244134 [0,1,0,1,0,0|1,1,0]=4 9400 B13R2.43 OCc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000698547 [0,1,0,1,0,0|2,0,0]=4 9401 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)O 62a_200025704644_100010063415 [0,1,0,1,0,0|1,1,0]=4 9402 B13R2.54 O=Cc1cc2c(cccc2s1)O 271570a_203496583355_100010109917 [0,1,0,1,0,0|0,1,1]=4 9403 B13R2.54 O=Cc1cc2cccc(c2s1)O 271570a_203496583355_100010110135 [0,1,0,1,0,0|2,0,0]=4 9404 B13R2.54 OCc1cc2cccc(c2s1)O 271570a_203496583355_100010255382 [0,1,0,1,0,0|1,1,0]=4 9405 B13R2.155 CC1CNc2ccc(cc2O1)O 271570a_203496583355_200010108538 [0,1,0,1,0,0|1,0,1]=4 9406 B13R2.155 Cc1ccc2ccc(cc2n1)O 271570a_203496583355_100009817087 [0,1,0,1,0,0|2,0,0]=4 9407 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [0,1,0,1,0,0|2,0,0]=4 9408 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [0,1,0,1,0,0|2,0,0]=4 9409 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [0,1,0,1,0,0|1,0,0]=3 9410 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [0,1,0,1,0,0|1,0,0]=3 9411 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,1,0,1,0,0|1,0,0]=3 9412 B13R2.155 O=C1COc2ccc(nc2N1)O 271570a_203496583355_100010235088 [0,1,0,1,0,0|2,0,0]=4 9413 B13R2.155 O=C1COc2ncc(cc2N1)O 271570a_203496583355_100000699640 [0,1,0,1,0,0|2,0,0]=4 9414 B13R2.155 O=C1CSc2ccc(cc2N1)O 271570a_203496583355_100012361575 [0,1,0,1,0,0|1,0,0]=3 9415 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [0,1,0,1,0,0|1,0,0]=3 9416 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [0,1,0,1,0,0|1,0,0]=3 9417 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [0,1,0,1,0,0|0,0,1]=3 9418 B13R2.3021 Oc1cccc(c1)OC2CCC2 271570a_203496583355_200010986888 [0,1,0,1,0,0|1,0,1]=4 9419 B13R2.4856 CN1C(=O)Cc2c1c(ccc2)O 271570a_203496583355_100010870571 [0,1,0,1,0,0|1,0,0]=3 9420 B13R2.4856 Cn1c(=O)[nH]c2c1c(ccc2)O 271570a_203496583355_100010994120 [0,1,0,1,0,0|1,0,0]=3 9421 B13R2.4856 O=C1Nc2cccc(c2C1=O)O 271570a_203496583355_100000697038 [0,1,0,1,0,0|1,0,1]=4 9422 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [0,1,0,1,0,0|2,0,0]=4 9423 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,1,0,1,0,0|1,0,0]=3 9424 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,1,0,1,0,0|1,0,0]=3 9425 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,1,0,1,0,0|0,0,0]=2 9426 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,1,0,0|1,0,0]=3 9427 B13R2.5179 O=C1COc2c(ccnc2O)N1 271570a_203496583355_100009863569 [0,1,0,1,0,0|2,0,0]=4 9428 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,1,0,0|1,0,1]=4 9429 B13R2.5190 CC1C(=O)Nc2c1ccc(c2)O 271570a_203496583355_100010201481 [0,1,0,1,0,0|1,0,0]=3 9430 B13R2.5190 CC1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010169280 [0,1,0,1,0,0|1,0,1]=4 9431 B13R2.5190 CN1C(=O)Cc2c1ccc(c2)O 271570a_203496583355_100000183948 [0,1,0,1,0,0|1,0,0]=3 9432 B13R2.5190 CN1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010161043 [0,1,0,1,0,0|2,0,0]=4 9433 B13R2.5190 Cc1nc2cc(ccc2n1C)O 271570a_203496583355_100000729442 [0,1,0,1,0,0|2,0,0]=4 9434 B13R2.5190 Cn1c(=O)oc2c1ccc(c2)O 271570a_203496583355_100000753874 [0,1,0,1,0,0|0,0,0]=2 9435 B13R2.5190 Cn1c(nc2c1ccc(c2)O)O 271570a_203496583355_100013992850 [0,1,0,1,0,0|1,0,1]=4 9436 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,1,0,1,0,0|1,0,1]=4 9437 B13R2.5397 Cc1nc2c(cc(cc2s1)O)F 271570a_203496583355_100000719245 [0,1,0,1,0,0|1,1,0]=4 9438 B13R2.3051 CC1(Oc2ccc(cc2O1)O)C 271570a_203496583355_100010187540 [0,1,0,1,0,0|0,0,2]=4 9439 B13R2.5139 O=C1Cc2c(ccc(c2N1)F)O 271570a_203496583355_100012355367 [0,1,0,1,0,0|1,0,0]=3 9440 B13R2.3028 CC1C(=O)Nc2c1cc(cc2)O 271570a_203496583355_100010251565 [0,1,0,1,0,0|2,0,0]=4 9441 B13R2.3028 CN1C(=O)Cc2c1cc(cc2)O 271570a_203496583355_100010285470 [0,1,0,1,0,0|1,0,0]=3 9442 B13R2.3028 Cc1[nH]c2ccc(cc2c1C)O 271570a_203496583355_100012262263 [0,1,0,1,0,0|2,0,0]=4 9443 B13R2.3028 Cc1nc2ccc(cc2n1C)O 271570a_203496583355_200010218347 [0,1,0,1,0,0|2,0,0]=4 9444 B13R2.3028 Cn1c(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100010393459 [0,1,0,1,0,0|2,0,0]=4 9445 B13R2.3028 O=C1Nc2ccc(cc2C1=O)O 271570a_203496583355_100000024671 [0,1,0,1,0,0|2,0,0]=4 9446 B13R2.4825 O=C1Nc2c(cccc2C1=O)O 271570a_203496583355_100000183292 [0,1,0,1,0,0|2,0,0]=4 9447 B13R2.581 C=Cc1cccc2c1CC(=O)C2 271570a_100011290941_100010205903 [0,1,0,1,0,0|2,0,0]=4 9448 B13R2.581 C=Cc1cccc2c1CC(=O)N2 271570a_100011290941_100009816812 [0,1,0,1,0,0|2,0,0]=4 9449 B13R2.581 C=Cc1cccc2c1nc(o2)C 271570a_100011290941_100010883239 [0,1,0,1,0,0|2,0,0]=4 9450 B13R2.581 CNc1cccc2c1nc(o2)C 34a_100011934982_200000210301 [0,1,0,1,0,0|2,0,0]=4 9451 B13R2.581 COc1cccc2c1cc([nH]2)C 34a_200000059750_200000210301 [0,1,0,1,0,0|2,0,0]=4 9452 B13R2.581 COc1cccc2c1nc(o2)N 7a_100009892541_200000210301 [0,1,0,1,0,0|2,0,0]=4 9453 B13R2.581 CSc1cccc2c1CC(=O)C2 62a_100010205903_200000210301 [0,1,0,1,0,0|1,1,0]=4 9454 B13R2.581 CSc1cccc2c1CC(=O)N2 62a_200000210301_100009816812 [0,1,0,1,0,0|1,1,0]=4 9455 B13R2.581 CSc1cccc2c1nc(o2)C 62a_200000210301_100010883239 [0,1,0,1,0,0|1,1,0]=4 9456 B13R2.581 Cc1cc2c(cccc2[nH]1)O[13CH3] 34a_200000059750_200025704644 [0,1,0,1,0,0|2,0,0]=4 9457 B13R2.581 Cc1nc2c(cccc2o1)N[13CH3] 34a_100011934982_200025704644 [0,1,0,1,0,0|2,0,0]=4 9458 B13R2.581 Cc1nc2c(cccc2o1)S[13CH3] 62a_200025704644_100010883239 [0,1,0,1,0,0|1,1,0]=4 9459 B13R2.581 [13CH3]Oc1cccc2c1nc(o2)N 7a_100009892541_200025704644 [0,1,0,1,0,0|2,0,0]=4 9460 B13R2.581 [13CH3]Sc1cccc2c1CC(=O)C2 62a_100010205903_200025704644 [0,1,0,1,0,0|1,1,0]=4 9461 B13R2.581 [13CH3]Sc1cccc2c1CC(=O)N2 62a_200025704644_100009816812 [0,1,0,1,0,0|1,1,0]=4 9462 B13R2.2038 COc1cccc(c1)OC2CC2 34a_100000211255_100000211595 [0,1,0,1,0,0|1,0,1]=4 9463 B13R2.2038 OCc1cccc(c1)OC2CC2 34a_100011214949_100000211595 [0,1,0,1,0,0|1,0,1]=4 9464 B13R2.2121 C=Cc1ccc2[nH]c(=O)oc2c1 271570a_100011290941_100000697996 [0,1,0,1,0,0|2,0,0]=4 9465 B13R2.2121 C=Cc1ccc2c(c1)CC(=O)C2 271570a_100011290941_100010185598 [0,1,0,1,0,0|2,0,0]=4 9466 B13R2.2121 C=Cc1ccc2c(c1)NC(=O)C2 271570a_100011290941_100000760487 [0,1,0,1,0,0|2,0,0]=4 9467 B13R2.2121 C=Cc1ccc2nc(oc2c1)C 271570a_100011290941_100010171164 [0,1,0,1,0,0|2,0,0]=4 9468 B13R2.2121 CNc1ccc2nc(oc2c1)C 34a_100000736495_200000210301 [0,1,0,1,0,0|2,0,0]=4 9469 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200000210301 [0,1,0,1,0,0|1,0,0]=3 9470 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [0,1,0,1,0,0|2,0,0]=4 9471 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [0,1,0,1,0,0|2,0,0]=4 9472 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 34a_100000035078_200000210301 [0,1,0,1,0,0|2,0,0]=4 9473 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 7a_100000035078_200000210301 [0,1,0,1,0,0|2,0,0]=4 9474 B13R2.2121 COc1ccc2cc([nH]c2c1)C 34a_100000058111_200000210301 [0,1,0,1,0,0|2,0,0]=4 9475 B13R2.2121 COc1ccc2cc(oc2c1)C 34a_100000095638_200000210301 [0,1,0,1,0,0|1,0,0]=3 9476 B13R2.2121 COc1ccc2cc(oc2c1)C 7a_100000095638_200000210301 [0,1,0,1,0,0|1,0,0]=3 9477 B13R2.2121 COc1ccc2nc(oc2c1)C 34a_100000116946_200000210301 [0,1,0,1,0,0|1,0,0]=3 9478 B13R2.2121 COc1ccc2nc(oc2c1)C 7a_100000116946_200000210301 [0,1,0,1,0,0|1,0,0]=3 9479 B13R2.2121 COc1ccc2nc(sc2c1)C 34a_100000008955_200000210301 [0,1,0,1,0,0|1,1,0]=4 9480 B13R2.2121 COc1ccc2nc(sc2c1)C 7a_100000008955_200000210301 [0,1,0,1,0,0|1,1,0]=4 9481 B13R2.2121 COc1ccc2oc(nc2c1)C 34a_100000102623_200000210301 [0,1,0,1,0,0|1,0,1]=4 9482 B13R2.2121 COc1ccc2oc(nc2c1)C 7a_100000102623_200000210301 [0,1,0,1,0,0|1,0,1]=4 9483 B13R2.2121 COc1ccc2sc(nc2c1)C 34a_100000031546_200000210301 [0,1,0,1,0,0|1,1,0]=4 9484 B13R2.2121 COc1ccc2sc(nc2c1)C 7a_100000031546_200000210301 [0,1,0,1,0,0|1,1,0]=4 9485 B13R2.2121 CSc1ccc2[nH]c(=O)oc2c1 62a_200000210301_100000697996 [0,1,0,1,0,0|1,1,0]=4 9486 B13R2.2121 CSc1ccc2c(c1)CC(=O)C2 62a_100010185598_200000210301 [0,1,0,1,0,0|1,1,0]=4 9487 B13R2.2121 CSc1ccc2c(c1)NC(=O)C2 62a_200000210301_100000760487 [0,1,0,1,0,0|1,1,0]=4 9488 B13R2.2121 CSc1ccc2nc(oc2c1)C 62a_200000210301_100010171164 [0,1,0,1,0,0|1,1,0]=4 9489 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [0,1,0,1,0,0|2,0,0]=4 9490 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [0,1,0,1,0,0|2,0,0]=4 9491 B13R2.2121 Cc1cc2ccc(cc2[nH]1)O[13CH3] 34a_100000058111_200025704644 [0,1,0,1,0,0|2,0,0]=4 9492 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 34a_100000095638_200025704644 [0,1,0,1,0,0|1,0,0]=3 9493 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 7a_100000095638_200025704644 [0,1,0,1,0,0|1,0,0]=3 9494 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 34a_100000102623_200025704644 [0,1,0,1,0,0|1,0,1]=4 9495 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 7a_100000102623_200025704644 [0,1,0,1,0,0|1,0,1]=4 9496 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 34a_100000031546_200025704644 [0,1,0,1,0,0|1,1,0]=4 9497 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 7a_100000031546_200025704644 [0,1,0,1,0,0|1,1,0]=4 9498 B13R2.2121 Cc1nc2ccc(cc2o1)N[13CH3] 34a_100000736495_200025704644 [0,1,0,1,0,0|2,0,0]=4 9499 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 34a_100000116946_200025704644 [0,1,0,1,0,0|1,0,0]=3 9500 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 7a_100000116946_200025704644 [0,1,0,1,0,0|1,0,0]=3 9501 B13R2.2121 Cc1nc2ccc(cc2o1)S[13CH3] 62a_200025704644_100010171164 [0,1,0,1,0,0|1,1,0]=4 9502 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 34a_100000008955_200025704644 [0,1,0,1,0,0|1,1,0]=4 9503 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 7a_100000008955_200025704644 [0,1,0,1,0,0|1,1,0]=4 9504 B13R2.2121 [13CH3]Oc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200025704644 [0,1,0,1,0,0|1,0,0]=3 9505 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 34a_100000035078_200025704644 [0,1,0,1,0,0|2,0,0]=4 9506 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 7a_100000035078_200025704644 [0,1,0,1,0,0|2,0,0]=4 9507 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)oc2c1 62a_200025704644_100000697996 [0,1,0,1,0,0|1,1,0]=4 9508 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)C2 62a_100010185598_200025704644 [0,1,0,1,0,0|1,1,0]=4 9509 B13R2.2121 [13CH3]Sc1ccc2c(c1)NC(=O)C2 62a_200025704644_100000760487 [0,1,0,1,0,0|1,1,0]=4 9510 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,0,0,1,0|1,0,0]=3 9511 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,0,0,0,1,0|2,0,0]=4 9512 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,0,0,0,1,0|2,0,0]=4 9513 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [1,0,0,0,1,0|2,0,0]=4 9514 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,0,0,1,0|0,0,0]=2 9515 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,0,0,1,0|2,0,0]=4 9516 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,0,0,1,0|2,0,0]=4 9517 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,0,0,1,0|2,0,0]=4 9518 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,0,0,1,0|2,0,0]=4 9519 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,0,0,1,0|2,0,0]=4 9520 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,0,0,1,0|2,0,0]=4 9521 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,0,0,1,0|0,0,0]=2 9522 B9R1.13 CC(=O)Cc1ccc[nH]1 1458a_100000238377_200000210301 [1,0,0,0,1,0|2,0,0]=4 9523 B9R1.13 CC(=O)Cc1ccco1 1458a_100011217309_200000210301 [1,0,0,0,1,0|2,0,0]=4 9524 B9R1.13 CC(=O)Cc1cccs1 1458a_100000210189_200000210301 [1,0,0,0,1,0|2,0,0]=4 9525 B9R1.13 CC(=O)Cc1ccoc1 1458a_100000684892_200000210301 [1,0,0,0,1,0|2,0,0]=4 9526 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000070787_100011233845 [1,0,0,0,1,0|2,0,0]=4 9527 B9R1.13 CC(=O)Cc1ccsc1 1458a_100000184062_200000210301 [1,0,0,0,1,0|2,0,0]=4 9528 B9R1.13 CC(=O)Cn1cccc1 1458a_100011196272_200000210301 [1,0,0,0,1,0|2,0,0]=4 9529 B9R1.13 [13CH3]C(=O)Cc1ccc[nH]1 1458a_100000238377_200025704644 [1,0,0,0,1,0|2,0,0]=4 9530 B9R1.13 [13CH3]C(=O)Cc1ccco1 1458a_100011217309_200025704644 [1,0,0,0,1,0|2,0,0]=4 9531 B9R1.13 [13CH3]C(=O)Cc1cccs1 1458a_100000210189_200025704644 [1,0,0,0,1,0|2,0,0]=4 9532 B9R1.13 [13CH3]C(=O)Cc1ccoc1 1458a_100000684892_200025704644 [1,0,0,0,1,0|2,0,0]=4 9533 B9R1.13 [13CH3]C(=O)Cc1ccsc1 1458a_100000184062_200025704644 [1,0,0,0,1,0|2,0,0]=4 9534 B9R1.13 [13CH3]C(=O)Cn1cccc1 1458a_100011196272_200025704644 [1,0,0,0,1,0|2,0,0]=4 9535 B9R1.35 CC(=O)c1cc(cs1)O 271570a_203496583355_100000718618 [0,0,0,0,2,0|1,0,0]=3 9536 B9R1.35 CC(=O)c1ccc([nH]1)O 271570a_203496583355_200010494458 [0,0,0,0,2,0|1,0,0]=3 9537 B9R1.35 CC(=O)c1ccc(o1)O 271570a_203496583355_100000229899 [0,0,0,0,2,0|1,0,0]=3 9538 B9R1.35 CC(=O)c1ccc(s1)O 271570a_203496583355_100000183331 [0,0,0,0,2,0|1,0,0]=3 9539 B9R1.35 CC(=O)c1cnc(s1)O 271570a_203496583355_200010173910 [0,0,0,0,2,0|2,0,0]=4 9540 B9R1.35 CC(=O)c1csc(c1)O 271570a_203496583355_200012344231 [0,0,0,0,2,0|1,0,0]=3 9541 B9R1.35 CC(=O)c1nc(cs1)O 271570a_203496583355_100010231720 [0,0,0,0,2,0|2,0,0]=4 9542 B9R1.35 CC(=O)c1ncc(s1)O 271570a_203496583355_100000693680 [0,0,0,0,2,0|2,0,0]=4 9543 B9R1.35 CC(=O)n1cc(cn1)O 271570a_203496583355_100010205889 [0,0,0,0,2,0|2,0,0]=4 9544 B9R1.35 NC(=O)c1cc(c[nH]1)O 271570a_203496583355_100000229580 [0,0,0,0,2,0|2,0,0]=4 9545 B9R1.35 NC(=O)c1cc(co1)O 271570a_203496583355_200009817131 [0,0,0,0,2,0|2,0,0]=4 9546 B9R1.35 NC(=O)c1cc(cs1)O 271570a_203496583355_100009812991 [0,0,0,0,2,0|2,0,0]=4 9547 B9R1.35 NC(=O)c1ccc(s1)O 271570a_203496583355_100000162267 [0,0,0,0,2,0|2,0,0]=4 9548 B9R1.35 NC(=O)c1csc(c1)O 271570a_203496583355_100000747962 [0,0,0,0,2,0|2,0,0]=4 9549 B9R1.41 CC(=O)c1sccc1O 271570a_203496583355_100000738688 [0,0,0,0,2,0|1,0,0]=3 9550 B9R1.41 CC(=O)c1scnc1O 271570a_203496583355_200010339033 [0,0,0,0,2,0|2,0,0]=4 9551 B9R1.41 NC(=O)c1cscc1O 271570a_203496583355_100009817205 [0,0,0,0,2,0|2,0,0]=4 9552 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [1,0,0,0,0,1|2,0,0]=4 9553 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [1,0,0,0,0,1|1,0,0]=3 9554 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [1,0,0,0,0,1|1,0,0]=3 9555 B11R1.91 C=C(C)COc1cccnc1 34a_100000210849_100000748629 [1,0,0,0,0,1|2,0,0]=4 9556 B11R1.91 C=C(C)COc1cccnc1 7a_100000210849_100000748629 [1,0,0,0,0,1|2,0,0]=4 9557 B11R1.91 C=C(C)COc1ccncc1 34a_100000212176_100000748629 [1,0,0,0,0,1|2,0,0]=4 9558 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [1,0,0,0,0,1|1,1,0]=4 9559 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [1,0,0,0,0,1|1,1,0]=4 9560 B11R1.91 C=C(F)COc1ccccc1 34a_100000210340_100009893438 [1,0,0,0,0,1|1,0,1]=4 9561 B11R1.91 C=C(F)COc1ccccc1 7a_100000210340_100000042424 [1,0,0,0,0,1|1,0,1]=4 9562 B11R1.91 CC(=O)C#Cc1ccccc1 1458a_100000736102_200000210301 [1,0,0,0,0,1|1,0,0]=3 9563 B11R1.91 CC(=O)C#Cc1ccccn1 1458a_102125277312_200000210301 [1,0,0,0,0,1|2,0,0]=4 9564 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [1,0,0,0,0,1|1,0,0]=3 9565 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [1,0,0,0,0,1|2,0,0]=4 9566 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [1,0,0,0,0,1|2,0,0]=4 9567 B11R1.91 CC(=O)C=Cc1ccncc1 1458a_100000682801_200000210301 [1,0,0,0,0,1|2,0,0]=4 9568 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [1,0,0,0,0,1|1,0,0]=3 9569 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [1,0,0,0,0,1|1,0,0]=3 9570 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [1,0,0,0,0,1|2,0,0]=4 9571 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [1,0,0,0,0,1|2,0,0]=4 9572 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000070787_200011713674 [1,0,0,0,0,1|2,0,0]=4 9573 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000198484_200000210301 [1,0,0,0,0,1|2,0,0]=4 9574 B11R1.91 CC(=O)CCc1ccncc1 1458a_100000070787_100000723409 [1,0,0,0,0,1|2,0,0]=4 9575 B11R1.91 CC(=O)CCc1ccncc1 1458a_100011225043_200000210301 [1,0,0,0,0,1|2,0,0]=4 9576 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [1,0,0,0,0,1|0,0,0]=2 9577 B11R1.91 CC(=O)COc1ccccn1 1458a_100102699861_200000210301 [1,0,0,0,0,1|1,0,0]=3 9578 B11R1.91 CC(=O)COc1cccnc1 1458a_100015207166_200000210301 [1,0,0,0,0,1|1,0,0]=3 9579 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [1,0,0,0,0,1|0,1,0]=3 9580 B11R1.91 CC(=O)CSc1ccccn1 1458a_100000156281_200000210301 [1,0,0,0,0,1|1,1,0]=4 9581 B11R1.91 CC(=O)CSc1ccncc1 1458a_100000211328_200000210301 [1,0,0,0,0,1|1,1,0]=4 9582 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [1,0,0,0,0,1|1,0,0]=3 9583 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [1,0,0,0,0,1|1,0,0]=3 9584 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [1,0,0,0,0,1|1,0,0]=3 9585 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [1,0,0,0,0,1|1,0,0]=3 9586 B11R1.91 CC(=O)NCc1ccccn1 11a_100000210449_100015343762 [1,0,0,0,0,1|2,0,0]=4 9587 B11R1.91 CC(=O)NCc1ccccn1 1626a_100000210449_100015343762 [1,0,0,0,0,1|2,0,0]=4 9588 B11R1.91 CC(=O)NCc1ccccn1 240690a_100000210449_100015343762 [1,0,0,0,0,1|2,0,0]=4 9589 B11R1.91 CC(=O)NCc1ccccn1 527a_100000210449_100103153847 [1,0,0,0,0,1|2,0,0]=4 9590 B11R1.91 CC(=O)NCc1cccnc1 11a_100000210453_100015343762 [1,0,0,0,0,1|2,0,0]=4 9591 B11R1.91 CC(=O)NCc1cccnc1 240690a_100000210453_100015343762 [1,0,0,0,0,1|2,0,0]=4 9592 B11R1.91 CC(=O)NCc1cccnc1 527a_100000210453_100103153847 [1,0,0,0,0,1|2,0,0]=4 9593 B11R1.91 CC(=O)NCc1ccncc1 11a_100000210450_100015343762 [1,0,0,0,0,1|2,0,0]=4 9594 B11R1.91 CC(=O)NCc1ccncc1 1626a_100000210450_100015343762 [1,0,0,0,0,1|2,0,0]=4 9595 B11R1.91 CC(=O)NCc1ccncc1 240690a_100000210450_100015343762 [1,0,0,0,0,1|2,0,0]=4 9596 B11R1.91 CC(=O)NCc1ccncc1 527a_100000210450_100103153847 [1,0,0,0,0,1|2,0,0]=4 9597 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [1,0,0,0,0,1|1,0,0]=3 9598 B11R1.91 CC(=O)NNc1ccccn1 22a_100000183288_100000070787 [1,0,0,0,0,1|2,0,0]=4 9599 B11R1.91 CC(=O)NNc1cccnc1 22a_100000728903_100000070787 [1,0,0,0,0,1|2,0,0]=4 9600 B11R1.91 CC(=O)NNc1ccncc1 22a_100000698918_100000070787 [1,0,0,0,0,1|2,0,0]=4 9601 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [1,0,0,0,0,1|1,0,1]=4 9602 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [1,0,0,0,0,1|1,0,1]=4 9603 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [1,0,0,0,0,1|1,0,1]=4 9604 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [1,0,0,0,0,1|1,0,1]=4 9605 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [1,0,0,0,0,1|1,0,1]=4 9606 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [1,0,0,0,0,1|0,0,2]=4 9607 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [1,0,0,0,0,1|0,0,2]=4 9608 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [1,0,0,0,0,1|0,0,2]=4 9609 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [1,0,0,0,0,1|0,0,2]=4 9610 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [1,0,0,0,0,1|2,0,0]=4 9611 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [1,0,0,0,0,1|1,0,0]=3 9612 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [1,0,0,0,0,1|1,0,0]=3 9613 B11R1.91 NC(=O)COc1cccnc1 34a_100000210849_100000187820 [1,0,0,0,0,1|2,0,0]=4 9614 B11R1.91 NC(=O)COc1cccnc1 7a_100000210849_100000187820 [1,0,0,0,0,1|2,0,0]=4 9615 B11R1.91 NC(=O)COc1ccncc1 34a_100000212176_100000187820 [1,0,0,0,0,1|2,0,0]=4 9616 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [1,0,0,0,0,1|1,1,0]=4 9617 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [1,0,0,0,0,1|1,1,0]=4 9618 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [1,0,0,0,0,1|2,0,0]=4 9619 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [1,0,0,0,0,1|1,0,0]=3 9620 B11R1.91 O=C([O-])COc1cccnc1 34a_100000210849_100020667443 [1,0,0,0,0,1|2,0,0]=4 9621 B11R1.91 O=C([O-])COc1ccncc1 34a_100000212176_100020667443 [1,0,0,0,0,1|2,0,0]=4 9622 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [1,0,0,0,0,1|1,1,0]=4 9623 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [1,0,0,0,0,1|1,1,0]=4 9624 B11R1.91 O=[N+]([O-])COc1ccccc1 34a_100000210340_100000761209 [1,0,0,0,0,1|2,0,0]=4 9625 B11R1.91 [13CH3]C(=O)C#Cc1ccccc1 1458a_100000736102_200025704644 [1,0,0,0,0,1|1,0,0]=3 9626 B11R1.91 [13CH3]C(=O)C#Cc1ccccn1 1458a_102125277312_200025704644 [1,0,0,0,0,1|2,0,0]=4 9627 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [1,0,0,0,0,1|1,0,0]=3 9628 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [1,0,0,0,0,1|2,0,0]=4 9629 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [1,0,0,0,0,1|2,0,0]=4 9630 B11R1.91 [13CH3]C(=O)C=Cc1ccncc1 1458a_100000682801_200025704644 [1,0,0,0,0,1|2,0,0]=4 9631 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [1,0,0,0,0,1|1,0,0]=3 9632 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [1,0,0,0,0,1|2,0,0]=4 9633 B11R1.91 [13CH3]C(=O)CCc1cccnc1 1458a_100000198484_200025704644 [1,0,0,0,0,1|2,0,0]=4 9634 B11R1.91 [13CH3]C(=O)CCc1ccncc1 1458a_100011225043_200025704644 [1,0,0,0,0,1|2,0,0]=4 9635 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [1,0,0,0,0,1|0,0,0]=2 9636 B11R1.91 [13CH3]C(=O)COc1ccccn1 1458a_100102699861_200025704644 [1,0,0,0,0,1|1,0,0]=3 9637 B11R1.91 [13CH3]C(=O)COc1cccnc1 1458a_100015207166_200025704644 [1,0,0,0,0,1|1,0,0]=3 9638 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [1,0,0,0,0,1|0,1,0]=3 9639 B11R1.91 [13CH3]C(=O)CSc1ccccn1 1458a_100000156281_200025704644 [1,0,0,0,0,1|1,1,0]=4 9640 B11R1.91 [13CH3]C(=O)CSc1ccncc1 1458a_100000211328_200025704644 [1,0,0,0,0,1|1,1,0]=4 9641 B13R1.149 C=C(C)CCNc1cccc(c1)O 34a_100000210217_100000730704 [0,0,0,0,0,2|2,0,0]=4 9642 B13R1.149 C=C(C)CCOc1cccc(c1)Br 34a_100000210342_100000730704 [0,0,0,0,0,2|2,0,0]=4 9643 B13R1.149 C=C(C)CCOc1cccc(c1)Br 7a_100000210342_100000730704 [0,0,0,0,0,2|2,0,0]=4 9644 B13R1.149 C=C(C)CCOc1cccc(c1)C 34a_100000210337_100000730704 [0,0,0,0,0,2|2,0,0]=4 9645 B13R1.149 C=C(C)CCOc1cccc(c1)C 7a_100000210337_100000730704 [0,0,0,0,0,2|2,0,0]=4 9646 B13R1.149 C=C(C)CCOc1cccc(c1)Cl 34a_100000210295_100000730704 [0,0,0,0,0,2|2,0,0]=4 9647 B13R1.149 C=C(C)CCOc1cccc(c1)Cl 7a_100000210295_100000730704 [0,0,0,0,0,2|2,0,0]=4 9648 B13R1.149 C=C(C)CCOc1cccc(c1)F 34a_100000210426_100000730704 [0,0,0,0,0,2|2,0,0]=4 9649 B13R1.149 C=C(C)CCOc1cccc(c1)F 7a_100000210426_100000730704 [0,0,0,0,0,2|2,0,0]=4 9650 B13R1.149 C=C(C)CCOc1cccc(c1)I 34a_100000211634_100000730704 [0,0,0,0,0,2|2,0,0]=4 9651 B13R1.149 C=C(C)CCOc1cccc(c1)I 7a_100000211634_100000730704 [0,0,0,0,0,2|2,0,0]=4 9652 B13R1.149 C=C(C)CCOc1cccc(c1)N 34a_100000210217_100000730704 [0,0,0,0,0,2|2,0,0]=4 9653 B13R1.149 C=C(C)CCSc1cccc(c1)O 62a_100000730704_100000211634 [0,0,0,0,0,2|1,1,0]=4 9654 B13R1.149 C=C(C)CNCc1cccc(c1)O 2230a_100000743036_100000748629 [0,0,0,0,0,2|2,0,0]=4 9655 B13R1.149 C=C(C)CNCc1cccc(c1)O 34a_100000743036_100000748629 [0,0,0,0,0,2|2,0,0]=4 9656 B13R1.149 C=C(C)COCc1cccc(c1)Br 34a_100000210245_100000698116 [0,0,0,0,0,2|2,0,0]=4 9657 B13R1.149 C=C(C)COCc1cccc(c1)Br 34a_100000687537_100000748629 [0,0,0,0,0,2|2,0,0]=4 9658 B13R1.149 C=C(C)COCc1cccc(c1)Br 7a_100000687537_100000748629 [0,0,0,0,0,2|2,0,0]=4 9659 B13R1.149 C=C(C)COCc1cccc(c1)C 34a_100000210245_100000211840 [0,0,0,0,0,2|2,0,0]=4 9660 B13R1.149 C=C(C)COCc1cccc(c1)C 34a_100011217746_100000748629 [0,0,0,0,0,2|2,0,0]=4 9661 B13R1.149 C=C(C)COCc1cccc(c1)C 7a_100011217746_100000748629 [0,0,0,0,0,2|2,0,0]=4 9662 B13R1.149 C=C(C)COCc1cccc(c1)Cl 34a_100000210245_100000187163 [0,0,0,0,0,2|2,0,0]=4 9663 B13R1.149 C=C(C)COCc1cccc(c1)Cl 34a_100000241301_100000748629 [0,0,0,0,0,2|2,0,0]=4 9664 B13R1.149 C=C(C)COCc1cccc(c1)Cl 7a_100000241301_100000748629 [0,0,0,0,0,2|2,0,0]=4 9665 B13R1.149 C=C(C)COCc1cccc(c1)F 34a_100000210245_100000187166 [0,0,0,0,0,2|2,0,0]=4 9666 B13R1.149 C=C(C)COCc1cccc(c1)F 34a_100000210976_100000748629 [0,0,0,0,0,2|2,0,0]=4 9667 B13R1.149 C=C(C)COCc1cccc(c1)F 7a_100000210976_100000748629 [0,0,0,0,0,2|2,0,0]=4 9668 B13R1.149 C=C(C)COCc1cccc(c1)I 34a_100000210245_100011218688 [0,0,0,0,0,2|2,0,0]=4 9669 B13R1.149 C=C(C)COCc1cccc(c1)I 34a_100011215336_100000748629 [0,0,0,0,0,2|2,0,0]=4 9670 B13R1.149 C=C(C)COCc1cccc(c1)I 7a_100011215336_100000748629 [0,0,0,0,0,2|2,0,0]=4 9671 B13R1.149 C=C(C)COCc1cccc(c1)N 34a_100000211919_100000748629 [0,0,0,0,0,2|2,0,0]=4 9672 B13R1.149 C=C(C)COCc1cccc(c1)O 34a_100000210245_100011660834 [0,0,0,0,0,2|1,0,0]=3 9673 B13R1.149 C=C(C)CSCc1cccc(c1)O 62a_100000748629_100011660834 [0,0,0,0,0,2|1,1,0]=4 9674 B13R1.149 C=C(C)CSCc1cccc(c1)O 62a_100011660834_100000211660 [0,0,0,0,0,2|1,1,0]=4 9675 B13R1.149 C=C(F)COCc1cccc(c1)O 34a_200010262243_100011660834 [0,0,0,0,0,2|1,0,1]=4 9676 B13R1.149 CC(=CCNc1cccc(c1)O)C 34a_100000210217_100000761012 [0,0,0,0,0,2|2,0,0]=4 9677 B13R1.149 CC(=CCOc1cccc(c1)Br)C 34a_100000210342_100000761012 [0,0,0,0,0,2|2,0,0]=4 9678 B13R1.149 CC(=CCOc1cccc(c1)Br)C 7a_100000210342_100000761012 [0,0,0,0,0,2|2,0,0]=4 9679 B13R1.149 CC(=CCOc1cccc(c1)C)C 34a_100000210337_100000761012 [0,0,0,0,0,2|2,0,0]=4 9680 B13R1.149 CC(=CCOc1cccc(c1)C)C 7a_100000210337_100000761012 [0,0,0,0,0,2|2,0,0]=4 9681 B13R1.149 CC(=CCOc1cccc(c1)Cl)C 34a_100000210295_100000761012 [0,0,0,0,0,2|2,0,0]=4 9682 B13R1.149 CC(=CCOc1cccc(c1)Cl)C 7a_100000210295_100000761012 [0,0,0,0,0,2|2,0,0]=4 9683 B13R1.149 CC(=CCOc1cccc(c1)F)C 34a_100000210426_100000761012 [0,0,0,0,0,2|2,0,0]=4 9684 B13R1.149 CC(=CCOc1cccc(c1)F)C 7a_100000210426_100000761012 [0,0,0,0,0,2|2,0,0]=4 9685 B13R1.149 CC(=CCOc1cccc(c1)I)C 34a_100000211634_100000761012 [0,0,0,0,0,2|2,0,0]=4 9686 B13R1.149 CC(=CCOc1cccc(c1)I)C 7a_100000211634_100000761012 [0,0,0,0,0,2|2,0,0]=4 9687 B13R1.149 CC(=CCOc1cccc(c1)N)C 34a_100000210217_100000761012 [0,0,0,0,0,2|2,0,0]=4 9688 B13R1.149 CC(=CCSc1cccc(c1)O)C 62a_100000761012_100000211634 [0,0,0,0,0,2|1,1,0]=4 9689 B13R1.149 CC(=O)CC#Cc1cccc(c1)Br 1458a_100000070787_100010706776 [0,0,0,0,0,2|2,0,0]=4 9690 B13R1.149 CC(=O)CC#Cc1cccc(c1)F 1458a_100000070787_100010402994 [0,0,0,0,0,2|2,0,0]=4 9691 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000070787_100011713683 [0,0,0,0,0,2|2,0,0]=4 9692 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000685939_200000210301 [0,0,0,0,0,2|2,0,0]=4 9693 B13R1.149 CC(=O)CCCc1cccc(c1)F 1458a_100000070787_200000698031 [0,0,0,0,0,2|2,0,0]=4 9694 B13R1.149 CC(=O)CCOc1ccc[n+](c1)[O-] 7a_100000039713_100000053229 [0,0,0,0,0,2|1,0,1]=4 9695 B13R1.149 CC(=O)CCOc1cccc(c1)Br 1458a_100000070787_100000183150 [0,0,0,0,0,2|1,0,0]=3 9696 B13R1.149 CC(=O)CCOc1cccc(c1)Br 1458a_100000183437_200000210301 [0,0,0,0,0,2|1,0,0]=3 9697 B13R1.149 CC(=O)CCOc1cccc(c1)Br 7a_100000210342_100000053229 [0,0,0,0,0,2|1,0,0]=3 9698 B13R1.149 CC(=O)CCOc1cccc(c1)C 1458a_100000182325_200000210301 [0,0,0,0,0,2|1,0,0]=3 9699 B13R1.149 CC(=O)CCOc1cccc(c1)C 7a_100000210337_100000053229 [0,0,0,0,0,2|1,0,0]=3 9700 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1458a_100000070787_100000181161 [0,0,0,0,0,2|1,0,0]=3 9701 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1458a_100000738917_200000210301 [0,0,0,0,0,2|1,0,0]=3 9702 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100000053229 [0,0,0,0,0,2|1,0,0]=3 9703 B13R1.149 CC(=O)CCOc1cccc(c1)F 1458a_100000070787_100000739188 [0,0,0,0,0,2|1,0,0]=3 9704 B13R1.149 CC(=O)CCOc1cccc(c1)F 1458a_100000737089_200000210301 [0,0,0,0,0,2|1,0,0]=3 9705 B13R1.149 CC(=O)CCOc1cccc(c1)F 7a_100000210426_100000053229 [0,0,0,0,0,2|1,0,0]=3 9706 B13R1.149 CC(=O)CCOc1cccc(c1)I 7a_100000211634_100000053229 [0,0,0,0,0,2|1,0,0]=3 9707 B13R1.149 CC(=O)CCOc1cncc(c1)Br 7a_100000754920_100000053229 [0,0,0,0,0,2|2,0,0]=4 9708 B13R1.149 CC(=O)CCOc1cncc(c1)C 7a_100011830280_100000053229 [0,0,0,0,0,2|2,0,0]=4 9709 B13R1.149 CC(=O)CCOc1cncc(c1)Cl 7a_100000032511_100000053229 [0,0,0,0,0,2|2,0,0]=4 9710 B13R1.149 CC(=O)CCOc1cncc(c1)F 7a_100011830296_100000053229 [0,0,0,0,0,2|2,0,0]=4 9711 B13R1.149 CC(=O)CCSc1cc(ccn1)O 62a_100000053229_100000762945 [0,0,0,0,0,2|1,1,0]=4 9712 B13R1.149 CC(=O)CCSc1cccc(c1)Br 62a_100000053229_100000691529 [0,0,0,0,0,2|1,1,0]=4 9713 B13R1.149 CC(=O)CCSc1cccc(c1)Br 62a_100000691529_100000053229 [0,0,0,0,0,2|1,1,0]=4 9714 B13R1.149 CC(=O)CCSc1cccc(c1)C 62a_100000053229_100011215228 [0,0,0,0,0,2|1,1,0]=4 9715 B13R1.149 CC(=O)CCSc1cccc(c1)C 62a_100011215228_100000053229 [0,0,0,0,0,2|1,1,0]=4 9716 B13R1.149 CC(=O)CCSc1cccc(c1)Cl 62a_100000053229_100000699651 [0,0,0,0,0,2|1,1,0]=4 9717 B13R1.149 CC(=O)CCSc1cccc(c1)Cl 62a_100000699651_100000053229 [0,0,0,0,0,2|1,1,0]=4 9718 B13R1.149 CC(=O)CCSc1cccc(c1)F 62a_100000053229_100000685547 [0,0,0,0,0,2|1,1,0]=4 9719 B13R1.149 CC(=O)CCSc1cccc(c1)F 62a_100000685547_100000053229 [0,0,0,0,0,2|1,1,0]=4 9720 B13R1.149 CC(=O)CCSc1cccc(c1)N 62a_100000053229_100000210019 [0,0,0,0,0,2|1,1,0]=4 9721 B13R1.149 CC(=O)CCSc1cccc(c1)N 62a_100000210019_100000053229 [0,0,0,0,0,2|1,1,0]=4 9722 B13R1.149 CC(=O)CCSc1cccc(c1)O 62a_100000053229_100000211634 [0,0,0,0,0,2|0,1,0]=3 9723 B13R1.149 CC(=O)CCSc1cccc(c1)[S] 62a_100000053229_114929384022 [0,0,0,0,0,2|0,2,0]=4 9724 B13R1.149 CC(=O)CCSc1cccc(c1)[S] 62a_114929384022_100000053229 [0,0,0,0,0,2|0,2,0]=4 9725 B13R1.149 CC(=O)CCSc1cncc(c1)O 62a_100000053229_100000754920 [0,0,0,0,0,2|1,1,0]=4 9726 B13R1.149 CC(=O)CCSc1cncc(c1)O 62a_100000754920_100000053229 [0,0,0,0,0,2|1,1,0]=4 9727 B13R1.149 CC(=O)COCc1cc(ccn1)Br 34a_100000211253_100010173614 [0,0,0,0,0,2|2,0,0]=4 9728 B13R1.149 CC(=O)COCc1cc(ccn1)C 34a_100000211253_100000718516 [0,0,0,0,0,2|2,0,0]=4 9729 B13R1.149 CC(=O)COCc1cc(ccn1)Cl 34a_100000211253_100016988179 [0,0,0,0,0,2|2,0,0]=4 9730 B13R1.149 CC(=O)COCc1cccc(c1)Br 34a_100000211253_100000698116 [0,0,0,0,0,2|1,0,0]=3 9731 B13R1.149 CC(=O)COCc1cccc(c1)C 34a_100000211253_100000211840 [0,0,0,0,0,2|1,0,0]=3 9732 B13R1.149 CC(=O)COCc1cccc(c1)Cl 34a_100000211253_100000187163 [0,0,0,0,0,2|1,0,0]=3 9733 B13R1.149 CC(=O)COCc1cccc(c1)F 34a_100000211253_100000187166 [0,0,0,0,0,2|1,0,0]=3 9734 B13R1.149 CC(=O)COCc1cccc(c1)I 34a_100000211253_100011218688 [0,0,0,0,0,2|1,0,0]=3 9735 B13R1.149 CC(=O)COCc1cccc(c1)O 34a_100000211253_100011660834 [0,0,0,0,0,2|0,0,0]=2 9736 B13R1.149 CC(=O)COCc1cccc(n1)Br 34a_100000211253_100009889011 [0,0,0,0,0,2|2,0,0]=4 9737 B13R1.149 CC(=O)COCc1cccc(n1)C 34a_100000211253_100000757606 [0,0,0,0,0,2|2,0,0]=4 9738 B13R1.149 CC(=O)COCc1cccc(n1)Cl 34a_100000211253_100000086093 [0,0,0,0,0,2|2,0,0]=4 9739 B13R1.149 CC(=O)COCc1cccc(n1)F 34a_100000211253_100009819644 [0,0,0,0,0,2|2,0,0]=4 9740 B13R1.149 CC(=O)COCc1ccnc(c1)Br 34a_100000211253_100010243470 [0,0,0,0,0,2|2,0,0]=4 9741 B13R1.149 CC(=O)COCc1ccnc(c1)C 34a_100000211253_200020672517 [0,0,0,0,0,2|2,0,0]=4 9742 B13R1.149 CC(=O)COCc1ccnc(c1)Cl 34a_100000211253_100000764220 [0,0,0,0,0,2|2,0,0]=4 9743 B13R1.149 CC(=O)COCc1cncc(c1)Br 34a_100000211253_100000738771 [0,0,0,0,0,2|2,0,0]=4 9744 B13R1.149 CC(=O)COCc1cncc(c1)C 34a_100000211253_100000716715 [0,0,0,0,0,2|2,0,0]=4 9745 B13R1.149 CC(=O)COCc1cncc(c1)Cl 34a_100000211253_100016992070 [0,0,0,0,0,2|2,0,0]=4 9746 B13R1.149 CC(=O)COCc1cncc(c1)F 34a_100000211253_100000725299 [0,0,0,0,0,2|2,0,0]=4 9747 B13R1.149 CC(=O)CSCc1cccc(c1)Cl 1458a_100000150269_200000210301 [0,0,0,0,0,2|1,1,0]=4 9748 B13R1.149 CC(=O)NCCc1cccc(c1)Br 11a_100011207229_100015343762 [0,0,0,0,0,2|2,0,0]=4 9749 B13R1.149 CC(=O)NCCc1cccc(c1)Br 1626a_100011207229_100015343762 [0,0,0,0,0,2|2,0,0]=4 9750 B13R1.149 CC(=O)NCCc1cccc(c1)Br 240690a_100011207229_100015343762 [0,0,0,0,0,2|2,0,0]=4 9751 B13R1.149 CC(=O)NCCc1cccc(c1)Br 527a_100011207229_100103153847 [0,0,0,0,0,2|2,0,0]=4 9752 B13R1.149 CC(=O)NCCc1cccc(c1)C 11a_100000749837_100015343762 [0,0,0,0,0,2|2,0,0]=4 9753 B13R1.149 CC(=O)NCCc1cccc(c1)C 1626a_100000749837_100015343762 [0,0,0,0,0,2|2,0,0]=4 9754 B13R1.149 CC(=O)NCCc1cccc(c1)C 240690a_100000749837_100015343762 [0,0,0,0,0,2|2,0,0]=4 9755 B13R1.149 CC(=O)NCCc1cccc(c1)C 527a_100000749837_100103153847 [0,0,0,0,0,2|2,0,0]=4 9756 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 11a_100000185263_100015343762 [0,0,0,0,0,2|2,0,0]=4 9757 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 1626a_100000185263_100015343762 [0,0,0,0,0,2|2,0,0]=4 9758 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 240690a_100000185263_100015343762 [0,0,0,0,0,2|2,0,0]=4 9759 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 527a_100000185263_100103153847 [0,0,0,0,0,2|2,0,0]=4 9760 B13R1.149 CC(=O)NCCc1cccc(c1)F 11a_100000205154_100015343762 [0,0,0,0,0,2|2,0,0]=4 9761 B13R1.149 CC(=O)NCCc1cccc(c1)F 1626a_100000205154_100015343762 [0,0,0,0,0,2|2,0,0]=4 9762 B13R1.149 CC(=O)NCCc1cccc(c1)F 240690a_100000205154_100015343762 [0,0,0,0,0,2|2,0,0]=4 9763 B13R1.149 CC(=O)NCCc1cccc(c1)F 527a_100000205154_100103153847 [0,0,0,0,0,2|2,0,0]=4 9764 B13R1.149 CC(=O)NCCc1cccc(c1)O 240690a_100000747277_100015343762 [0,0,0,0,0,2|1,0,0]=3 9765 B13R1.149 CC(=O)NCCc1cccc(c1)O 527a_100000747277_100103153847 [0,0,0,0,0,2|1,0,0]=3 9766 B13R1.149 CC(=O)NN=Cc1cccc(c1)Br 4a_100000189765_100000210085 [0,0,0,0,0,2|2,0,0]=4 9767 B13R1.149 CC(=O)NN=Cc1cccc(c1)C 4a_100000189765_100000211157 [0,0,0,0,0,2|2,0,0]=4 9768 B13R1.149 CC(=O)NN=Cc1cccc(c1)Cl 4a_100000189765_100000210801 [0,0,0,0,0,2|2,0,0]=4 9769 B13R1.149 CC(=O)NN=Cc1cccc(c1)F 4a_100000189765_100000210812 [0,0,0,0,0,2|2,0,0]=4 9770 B13R1.149 CC(=O)NN=Cc1cccc(c1)I 4a_100000189765_100000014684 [0,0,0,0,0,2|2,0,0]=4 9771 B13R1.149 CC(=O)NN=Cc1cccc(c1)O 4a_100000189765_100000188321 [0,0,0,0,0,2|1,0,0]=3 9772 B13R1.149 CC(=O)NN=Cc1ccnc(c1)O 4a_100000189765_100000688113 [0,0,0,0,0,2|2,0,0]=4 9773 B13R1.149 CC(=O)NN=Cc1cncc(c1)O 4a_100000189765_100012187055 [0,0,0,0,0,2|2,0,0]=4 9774 B13R1.149 CC(=O)NNCc1cccc(c1)Br 22a_100000686200_100000070787 [0,0,0,0,0,2|2,0,0]=4 9775 B13R1.149 CC(=O)NNCc1cccc(c1)C 22a_100000689898_100000070787 [0,0,0,0,0,2|2,0,0]=4 9776 B13R1.149 CC(=O)NNCc1cccc(c1)Cl 22a_100000685877_100000070787 [0,0,0,0,0,2|2,0,0]=4 9777 B13R1.149 CC(=O)NNCc1cccc(c1)F 22a_100016993953_100000070787 [0,0,0,0,0,2|2,0,0]=4 9778 B13R1.149 CC(=O)NNCc1cccc(c1)O 22a_100000008902_100000070787 [0,0,0,0,0,2|1,0,0]=3 9779 B13R1.149 CC(=O)OCNc1cccc(c1)Br 34a_100000210019_100009813279 [0,0,0,0,0,2|1,0,0]=3 9780 B13R1.149 CC(=O)OCNc1cccc(c1)C 34a_100000188690_100009813279 [0,0,0,0,0,2|1,0,0]=3 9781 B13R1.149 CC(=O)OCNc1cccc(c1)Cl 34a_100000185859_100009813279 [0,0,0,0,0,2|1,0,0]=3 9782 B13R1.149 CC(=O)OCNc1cccc(c1)F 34a_100000210047_100009813279 [0,0,0,0,0,2|1,0,0]=3 9783 B13R1.149 CC(=O)OCNc1cccc(c1)I 34a_100000211102_100009813279 [0,0,0,0,0,2|1,0,0]=3 9784 B13R1.149 CC(=O)OCNc1cccc(c1)O 34a_100000210217_100009813279 [0,0,0,0,0,2|0,0,0]=2 9785 B13R1.149 CC(=O)OCOc1cc[nH]c(=O)c1 34a_100000032262_100009813279 [0,0,0,0,0,2|1,0,1]=4 9786 B13R1.149 CC(=O)OCOc1ccc[n+](c1)[O-] 34a_100000039713_100009813279 [0,0,0,0,0,2|1,0,1]=4 9787 B13R1.149 CC(=O)OCOc1cccc(=O)[nH]1 34a_100000033347_100009813279 [0,0,0,0,0,2|1,0,1]=4 9788 B13R1.149 CC(=O)OCOc1cccc(c1)Br 34a_100000210342_100009813279 [0,0,0,0,0,2|1,0,0]=3 9789 B13R1.149 CC(=O)OCOc1cccc(c1)C 34a_100000210337_100009813279 [0,0,0,0,0,2|1,0,0]=3 9790 B13R1.149 CC(=O)OCOc1cccc(c1)Cl 34a_100000210295_100009813279 [0,0,0,0,0,2|1,0,0]=3 9791 B13R1.149 CC(=O)OCOc1cccc(c1)F 34a_100000210426_100009813279 [0,0,0,0,0,2|1,0,0]=3 9792 B13R1.149 CC(=O)OCOc1cccc(c1)I 34a_100000211634_100009813279 [0,0,0,0,0,2|1,0,0]=3 9793 B13R1.149 CC(=O)OCOc1cccc(c1)N 34a_100000210217_100009813279 [0,0,0,0,0,2|1,0,0]=3 9794 B13R1.149 CC(=O)OCOc1cccc(n1)F 34a_100011432558_100009813279 [0,0,0,0,0,2|2,0,0]=4 9795 B13R1.149 CC(=O)OCOc1ccnc(c1)C 34a_100000688365_100009813279 [0,0,0,0,0,2|2,0,0]=4 9796 B13R1.149 CC(=O)OCOc1ccnc(c1)Cl 34a_100000762945_100009813279 [0,0,0,0,0,2|2,0,0]=4 9797 B13R1.149 CC(=O)OCOc1ccnc(c1)F 34a_100000732698_100009813279 [0,0,0,0,0,2|2,0,0]=4 9798 B13R1.149 CC(=O)OCOc1ccnc(c1)N 34a_100011834064_100009813279 [0,0,0,0,0,2|2,0,0]=4 9799 B13R1.149 CC(=O)OCOc1cncc(c1)Br 34a_100000754920_100009813279 [0,0,0,0,0,2|2,0,0]=4 9800 B13R1.149 CC(=O)OCOc1cncc(c1)C 34a_100011830280_100009813279 [0,0,0,0,0,2|2,0,0]=4 9801 B13R1.149 CC(=O)OCOc1cncc(c1)F 34a_100011830296_100009813279 [0,0,0,0,0,2|2,0,0]=4 9802 B13R1.149 CC(=O)OCOc1cncc(c1)N 34a_100011997051_100009813279 [0,0,0,0,0,2|2,0,0]=4 9803 B13R1.149 CC(=O)OCSc1cc(=O)cc[nH]1 62a_100009817434_100000076356 [0,0,0,0,0,2|1,0,1]=4 9804 B13R1.149 CC(=O)OCSc1cc(ccn1)C 62a_100000076356_100000750283 [0,0,0,0,0,2|2,0,0]=4 9805 B13R1.149 CC(=O)OCSc1cc(ccn1)C 62a_100000750283_100000076356 [0,0,0,0,0,2|2,0,0]=4 9806 B13R1.149 CC(=O)OCSc1cc(ccn1)Cl 62a_100000076356_100010167805 [0,0,0,0,0,2|2,0,0]=4 9807 B13R1.149 CC(=O)OCSc1cc(ccn1)Cl 62a_100010167805_100000076356 [0,0,0,0,0,2|2,0,0]=4 9808 B13R1.149 CC(=O)OCSc1cc(ccn1)F 62a_100000076356_100000764206 [0,0,0,0,0,2|2,0,0]=4 9809 B13R1.149 CC(=O)OCSc1cc(ccn1)F 62a_100000764206_100000076356 [0,0,0,0,0,2|2,0,0]=4 9810 B13R1.149 CC(=O)OCSc1cc(ccn1)N 62a_100000076356_100009814236 [0,0,0,0,0,2|2,0,0]=4 9811 B13R1.149 CC(=O)OCSc1cc(ccn1)N 62a_100009814236_100000076356 [0,0,0,0,0,2|2,0,0]=4 9812 B13R1.149 CC(=O)OCSc1cc(ccn1)O 62a_100000076356_100000762945 [0,0,0,0,0,2|1,0,0]=3 9813 B13R1.149 CC(=O)OCSc1cc(cnn1)O 62a_100000076356_200010734679 [0,0,0,0,0,2|2,0,0]=4 9814 B13R1.149 CC(=O)OCSc1cc(ncn1)O 62a_100000076356_100000765262 [0,0,0,0,0,2|2,0,0]=4 9815 B13R1.149 CC(=O)OCSc1cc[nH]c(=O)c1 62a_100000076356_100009816521 [0,0,0,0,0,2|1,0,1]=4 9816 B13R1.149 CC(=O)OCSc1cc[nH]c(=O)c1 62a_100009816521_100000076356 [0,0,0,0,0,2|1,0,1]=4 9817 B13R1.149 CC(=O)OCSc1ccc[n+](c1)C 62a_100000076356_100009996589 [0,0,0,0,0,2|2,0,0]=4 9818 B13R1.149 CC(=O)OCSc1ccc[n+](c1)C 62a_100009996589_100000076356 [0,0,0,0,0,2|2,0,0]=4 9819 B13R1.149 CC(=O)OCSc1ccc[n+](c1)[O-] 62a_100000076356_100009815978 [0,0,0,0,0,2|1,0,1]=4 9820 B13R1.149 CC(=O)OCSc1cccc(=O)[nH]1 62a_100000076356_100000752884 [0,0,0,0,0,2|1,0,1]=4 9821 B13R1.149 CC(=O)OCSc1cccc(c1)Br 62a_100000076356_100000691529 [0,0,0,0,0,2|1,0,0]=3 9822 B13R1.149 CC(=O)OCSc1cccc(c1)Br 62a_100000691529_100000076356 [0,0,0,0,0,2|1,0,0]=3 9823 B13R1.149 CC(=O)OCSc1cccc(c1)C 62a_100000076356_100011215228 [0,0,0,0,0,2|1,0,0]=3 9824 B13R1.149 CC(=O)OCSc1cccc(c1)C 62a_100011215228_100000076356 [0,0,0,0,0,2|1,0,0]=3 9825 B13R1.149 CC(=O)OCSc1cccc(c1)Cl 62a_100000076356_100000699651 [0,0,0,0,0,2|1,0,0]=3 9826 B13R1.149 CC(=O)OCSc1cccc(c1)Cl 62a_100000699651_100000076356 [0,0,0,0,0,2|1,0,0]=3 9827 B13R1.149 CC(=O)OCSc1cccc(c1)F 62a_100000076356_100000685547 [0,0,0,0,0,2|1,0,0]=3 9828 B13R1.149 CC(=O)OCSc1cccc(c1)F 62a_100000685547_100000076356 [0,0,0,0,0,2|1,0,0]=3 9829 B13R1.149 CC(=O)OCSc1cccc(c1)N 62a_100000076356_100000210019 [0,0,0,0,0,2|1,0,0]=3 9830 B13R1.149 CC(=O)OCSc1cccc(c1)N 62a_100000210019_100000076356 [0,0,0,0,0,2|1,0,0]=3 9831 B13R1.149 CC(=O)OCSc1cccc(c1)O 62a_100000076356_100000211634 [0,0,0,0,0,2|0,0,0]=2 9832 B13R1.149 CC(=O)OCSc1cccc(c1)[S] 62a_100000076356_114929384022 [0,0,0,0,0,2|0,1,0]=3 9833 B13R1.149 CC(=O)OCSc1cccc(c1)[S] 62a_114929384022_100000076356 [0,0,0,0,0,2|0,1,0]=3 9834 B13R1.149 CC(=O)OCSc1cccc(n1)Br 62a_100000076356_100000684672 [0,0,0,0,0,2|2,0,0]=4 9835 B13R1.149 CC(=O)OCSc1cccc(n1)Br 62a_100000684672_100000076356 [0,0,0,0,0,2|2,0,0]=4 9836 B13R1.149 CC(=O)OCSc1cccc(n1)C 62a_100000076356_100000742759 [0,0,0,0,0,2|2,0,0]=4 9837 B13R1.149 CC(=O)OCSc1cccc(n1)C 62a_100000742759_100000076356 [0,0,0,0,0,2|2,0,0]=4 9838 B13R1.149 CC(=O)OCSc1cccc(n1)Cl 62a_100000051397_100000076356 [0,0,0,0,0,2|2,0,0]=4 9839 B13R1.149 CC(=O)OCSc1cccc(n1)Cl 62a_100000076356_100000051397 [0,0,0,0,0,2|2,0,0]=4 9840 B13R1.149 CC(=O)OCSc1cccc(n1)F 62a_100000076356_100009815982 [0,0,0,0,0,2|2,0,0]=4 9841 B13R1.149 CC(=O)OCSc1cccc(n1)F 62a_100009815982_100000076356 [0,0,0,0,0,2|2,0,0]=4 9842 B13R1.149 CC(=O)OCSc1cccc(n1)N 62a_100000076356_100000740741 [0,0,0,0,0,2|2,0,0]=4 9843 B13R1.149 CC(=O)OCSc1cccc(n1)N 62a_100000740741_100000076356 [0,0,0,0,0,2|2,0,0]=4 9844 B13R1.149 CC(=O)OCSc1ccnc(c1)Br 62a_100000076356_100009814637 [0,0,0,0,0,2|2,0,0]=4 9845 B13R1.149 CC(=O)OCSc1ccnc(c1)Br 62a_100009814637_100000076356 [0,0,0,0,0,2|2,0,0]=4 9846 B13R1.149 CC(=O)OCSc1ccnc(c1)C 62a_100000076356_100000758586 [0,0,0,0,0,2|2,0,0]=4 9847 B13R1.149 CC(=O)OCSc1ccnc(c1)C 62a_100000758586_100000076356 [0,0,0,0,0,2|2,0,0]=4 9848 B13R1.149 CC(=O)OCSc1ccnc(c1)Cl 62a_100000035001_100000076356 [0,0,0,0,0,2|2,0,0]=4 9849 B13R1.149 CC(=O)OCSc1ccnc(c1)Cl 62a_100000076356_100000035001 [0,0,0,0,0,2|2,0,0]=4 9850 B13R1.149 CC(=O)OCSc1ccnc(c1)F 62a_100000076356_100009816116 [0,0,0,0,0,2|2,0,0]=4 9851 B13R1.149 CC(=O)OCSc1ccnc(c1)F 62a_100009816116_100000076356 [0,0,0,0,0,2|2,0,0]=4 9852 B13R1.149 CC(=O)OCSc1ccnc(c1)N 62a_100000049665_100000076356 [0,0,0,0,0,2|2,0,0]=4 9853 B13R1.149 CC(=O)OCSc1ccnc(c1)N 62a_100000076356_100000049665 [0,0,0,0,0,2|2,0,0]=4 9854 B13R1.149 CC(=O)OCSc1cncc(c1)Br 62a_100000076356_100000728054 [0,0,0,0,0,2|2,0,0]=4 9855 B13R1.149 CC(=O)OCSc1cncc(c1)Br 62a_100000728054_100000076356 [0,0,0,0,0,2|2,0,0]=4 9856 B13R1.149 CC(=O)OCSc1cncc(c1)C 62a_100000076356_100000760492 [0,0,0,0,0,2|2,0,0]=4 9857 B13R1.149 CC(=O)OCSc1cncc(c1)C 62a_100000760492_100000076356 [0,0,0,0,0,2|2,0,0]=4 9858 B13R1.149 CC(=O)OCSc1cncc(c1)Cl 62a_100000049639_100000076356 [0,0,0,0,0,2|2,0,0]=4 9859 B13R1.149 CC(=O)OCSc1cncc(c1)Cl 62a_100000076356_100000049639 [0,0,0,0,0,2|2,0,0]=4 9860 B13R1.149 CC(=O)OCSc1cncc(c1)F 62a_100000076356_100000744099 [0,0,0,0,0,2|2,0,0]=4 9861 B13R1.149 CC(=O)OCSc1cncc(c1)F 62a_100000744099_100000076356 [0,0,0,0,0,2|2,0,0]=4 9862 B13R1.149 CC(=O)OCSc1cncc(c1)N 62a_100000076356_100000687067 [0,0,0,0,0,2|2,0,0]=4 9863 B13R1.149 CC(=O)OCSc1cncc(c1)N 62a_100000687067_100000076356 [0,0,0,0,0,2|2,0,0]=4 9864 B13R1.149 CC(=O)OCSc1cncc(c1)O 62a_100000076356_100000754920 [0,0,0,0,0,2|1,0,0]=3 9865 B13R1.149 CC(=O)OCSc1cncc(c1)O 62a_100000754920_100000076356 [0,0,0,0,0,2|1,0,0]=3 9866 B13R1.149 CC(=O)OCSc1cncc(n1)O 62a_100000076356_100011269956 [0,0,0,0,0,2|2,0,0]=4 9867 B13R1.149 CC(=O)OCSc1nccc(n1)O 62a_100000076356_100011649813 [0,0,0,0,0,2|2,0,0]=4 9868 B13R1.149 CC(Br)COCc1cccc(c1)O 34a_100012180447_100011660834 [0,0,0,0,0,2|1,0,1]=4 9869 B13R1.149 CC(C)COCc1cccc(c1)O 34a_100000210257_100011660834 [0,0,0,0,0,2|1,0,1]=4 9870 B13R1.149 CC(C)OCNc1cccc(c1)O 34a_100000210217_100000709892 [0,0,0,0,0,2|1,0,1]=4 9871 B13R1.149 CC(C)OCSc1cccc(c1)O 62a_100000709892_100000211634 [0,0,0,0,0,2|1,0,1]=4 9872 B13R1.149 CC(F)COCc1cccc(c1)O 34a_100015925927_100011660834 [0,0,0,0,0,2|1,0,1]=4 9873 B13R1.149 CN(C)CCOc1cccc(c1)O 271570a_203496583355_100138557206 [0,0,0,0,0,2|2,0,0]=4 9874 B13R1.149 C[C@@H](Cl)COCc1cccc(c1)O 34a_100016084084_100011660834 [0,0,0,0,0,2|1,0,1]=4 9875 B13R1.149 C[C@@H](N)COCc1cccc(c1)O 34a_100000737577_100011660834 [0,0,0,0,0,2|1,0,1]=4 9876 B13R1.149 Cc1cccc(c1)COCC(=O)N 34a_100011217746_100000187820 [0,0,0,0,0,2|2,0,0]=4 9877 B13R1.149 Cc1cccc(c1)COCC(=O)N 7a_100011217746_100000187820 [0,0,0,0,0,2|2,0,0]=4 9878 B13R1.149 Cc1cccc(c1)COCC(=O)[O-] 34a_100011217746_100020667443 [0,0,0,0,0,2|2,0,0]=4 9879 B13R1.149 Cc1cccc(c1)OCCC(=O)N 34a_100000210337_100000731001 [0,0,0,0,0,2|2,0,0]=4 9880 B13R1.149 Cc1cccc(c1)OCCC(=O)N 7a_100000210337_100000744528 [0,0,0,0,0,2|2,0,0]=4 9881 B13R1.149 Cc1cccc(c1)OCCC(=O)[13CH3] 1458a_100000182325_200025704644 [0,0,0,0,0,2|1,0,0]=3 9882 B13R1.149 NC(=O)CCNc1cccc(c1)O 34a_100000210217_100000731001 [0,0,0,0,0,2|2,0,0]=4 9883 B13R1.149 NC(=O)CCOc1cccc(c1)Br 34a_100000210342_100000731001 [0,0,0,0,0,2|2,0,0]=4 9884 B13R1.149 NC(=O)CCOc1cccc(c1)Br 7a_100000210342_100000744528 [0,0,0,0,0,2|2,0,0]=4 9885 B13R1.149 NC(=O)CCOc1cccc(c1)Cl 34a_100000210295_100000731001 [0,0,0,0,0,2|2,0,0]=4 9886 B13R1.149 NC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100000744528 [0,0,0,0,0,2|2,0,0]=4 9887 B13R1.149 NC(=O)CCOc1cccc(c1)F 34a_100000210426_100000731001 [0,0,0,0,0,2|2,0,0]=4 9888 B13R1.149 NC(=O)CCOc1cccc(c1)F 7a_100000210426_100000744528 [0,0,0,0,0,2|2,0,0]=4 9889 B13R1.149 NC(=O)CCOc1cccc(c1)I 34a_100000211634_100000731001 [0,0,0,0,0,2|2,0,0]=4 9890 B13R1.149 NC(=O)CCOc1cccc(c1)I 7a_100000211634_100000744528 [0,0,0,0,0,2|2,0,0]=4 9891 B13R1.149 NC(=O)CCOc1cccc(c1)N 34a_100000210217_100000731001 [0,0,0,0,0,2|2,0,0]=4 9892 B13R1.149 NC(=O)CCSc1cccc(c1)O 62a_100000744528_100000211634 [0,0,0,0,0,2|1,1,0]=4 9893 B13R1.149 NC(=O)CNCc1cccc(c1)O 2230a_100000711301_100011660834 [0,0,0,0,0,2|2,0,0]=4 9894 B13R1.149 NC(=O)CNCc1cccc(c1)O 2230a_100000743036_100000747473 [0,0,0,0,0,2|2,0,0]=4 9895 B13R1.149 NC(=O)CNCc1cccc(c1)O 34a_100000743036_100000187820 [0,0,0,0,0,2|2,0,0]=4 9896 B13R1.149 NC(=O)COCc1cccc(c1)Br 34a_100000687537_100000187820 [0,0,0,0,0,2|2,0,0]=4 9897 B13R1.149 NC(=O)COCc1cccc(c1)Br 7a_100000687537_100000187820 [0,0,0,0,0,2|2,0,0]=4 9898 B13R1.149 NC(=O)COCc1cccc(c1)Cl 34a_100000241301_100000187820 [0,0,0,0,0,2|2,0,0]=4 9899 B13R1.149 NC(=O)COCc1cccc(c1)Cl 7a_100000241301_100000187820 [0,0,0,0,0,2|2,0,0]=4 9900 B13R1.149 NC(=O)COCc1cccc(c1)F 34a_100000210976_100000187820 [0,0,0,0,0,2|2,0,0]=4 9901 B13R1.149 NC(=O)COCc1cccc(c1)F 7a_100000210976_100000187820 [0,0,0,0,0,2|2,0,0]=4 9902 B13R1.149 NC(=O)COCc1cccc(c1)I 34a_100011215336_100000187820 [0,0,0,0,0,2|2,0,0]=4 9903 B13R1.149 NC(=O)COCc1cccc(c1)I 7a_100011215336_100000187820 [0,0,0,0,0,2|2,0,0]=4 9904 B13R1.149 NC(=O)COCc1cccc(c1)N 34a_100000211919_100000187820 [0,0,0,0,0,2|2,0,0]=4 9905 B13R1.149 NC(=O)CSCc1cccc(c1)O 62a_100000747473_100011660834 [0,0,0,0,0,2|1,1,0]=4 9906 B13R1.149 NC(=O)CSCc1cccc(c1)O 62a_100011660834_100000747473 [0,0,0,0,0,2|1,1,0]=4 9907 B13R1.149 Nc1cccc(c1)COCC(=O)[O-] 34a_100000211919_100020667443 [0,0,0,0,0,2|2,0,0]=4 9908 B13R1.149 O=C(O)CNCc1cccc(c1)O 269956a_100016091260_100011660834 [0,0,0,0,0,2|2,0,0]=4 9909 B13R1.149 O=C([O-])CNCc1cccc(c1)O 34a_100000743036_100020667443 [0,0,0,0,0,2|2,0,0]=4 9910 B13R1.149 O=C([O-])COCc1cccc(c1)Br 34a_100000687537_100020667443 [0,0,0,0,0,2|2,0,0]=4 9911 B13R1.149 O=C([O-])COCc1cccc(c1)Cl 34a_100000241301_100020667443 [0,0,0,0,0,2|2,0,0]=4 9912 B13R1.149 O=C([O-])COCc1cccc(c1)F 34a_100000210976_100020667443 [0,0,0,0,0,2|2,0,0]=4 9913 B13R1.149 O=C([O-])COCc1cccc(c1)I 34a_100011215336_100020667443 [0,0,0,0,0,2|2,0,0]=4 9914 B13R1.149 O=C([O-])CSCc1cccc(c1)O 62a_100011660834_100020667443 [0,0,0,0,0,2|1,1,0]=4 9915 B13R1.149 O=C([O-])CSCc1cccc(c1)O 62a_100020667443_100011660834 [0,0,0,0,0,2|1,1,0]=4 9916 B13R1.149 [13CH3]C(=O)CCCc1cccc(c1)Br 1458a_100000685939_200025704644 [0,0,0,0,0,2|2,0,0]=4 9917 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)Br 1458a_100000183437_200025704644 [0,0,0,0,0,2|1,0,0]=3 9918 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)Cl 1458a_100000738917_200025704644 [0,0,0,0,0,2|1,0,0]=3 9919 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)F 1458a_100000737089_200025704644 [0,0,0,0,0,2|1,0,0]=3 9920 B13R1.149 [13CH3]C(=O)CSCc1cccc(c1)Cl 1458a_100000150269_200025704644 [0,0,0,0,0,2|1,1,0]=4