0 B12R1.385 C#CCNc1ccc(c(c1)Br)O 34a_100011534360_100000184674 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.385 C#CCNc1ccc(c(c1)C)O 34a_100011218179_100000184674 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.385 C#CCNc1ccc(c(c1)C)O 7a_100011218179_100000038162 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.385 C#CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000184674 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.385 C#CCNc1ccc(c(c1)F)O 34a_100011220035_100000184674 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.385 C#CCNc1ccc(c(c1)F)O 7a_100011220035_100000038162 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.385 C#CCNc1ccc(c(c1)O)C 34a_100000759471_100000184674 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.385 C#CCNc1ccc(c(c1)O)C 7a_100000759471_100000038162 [0,0,0,0,0,0|3,0,1]=4 8 B12R1.385 C#CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000184674 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.385 C#CCNc1ccc(c(c1)O)F 34a_100012017398_100000184674 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.385 C#CCNc1ccc(c(c1)O)F 7a_100012017398_100000038162 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.385 C#CCNc1ccc(c(c1)O)O 34a_100102946323_100000184674 [0,0,0,0,0,0|2,0,1]=3 12 B12R1.385 C#CCSc1ccc(c(c1)Br)O 62a_100000038162_100012361655 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.385 C#CCSc1ccc(c(c1)C)O 62a_100000038162_100000186361 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.385 C#CCSc1ccc(c(c1)Cl)O 62a_100000038162_100012360047 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.385 C#CCSc1ccc(c(c1)F)O 62a_100000038162_100000185481 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.385 C#CCSc1ccc(c(c1)N)O 62a_100000038162_100000752626 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.385 C#CCSc1ccc(c(c1)O)Br 62a_100000038162_100012356990 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.385 C#CCSc1ccc(c(c1)O)C 62a_100000038162_100000685420 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.385 C#CCSc1ccc(c(c1)O)Cl 62a_100000038162_100011356854 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.385 C#CCSc1ccc(c(c1)O)F 62a_100000038162_100000686035 [0,0,0,0,0,0|3,0,1]=4 21 B12R1.385 C#CCSc1ccc(c(c1)O)N 62a_100000038162_100000739049 [0,0,0,0,0,0|3,0,1]=4 22 B12R1.385 C#CCSc1ccc(c(c1)O)O 62a_100000038162_100009813601 [0,0,0,0,0,0|2,0,1]=3 23 B12R1.385 C=CCNc1ccc(c(c1)Br)O 34a_100011534360_100015514636 [0,0,0,0,0,0|3,0,1]=4 24 B12R1.385 C=CCNc1ccc(c(c1)C)O 34a_100011218179_100015514636 [0,0,0,0,0,0|3,0,1]=4 25 B12R1.385 C=CCNc1ccc(c(c1)C)O 7a_100011218179_100015514636 [0,0,0,0,0,0|3,0,1]=4 26 B12R1.385 C=CCNc1ccc(c(c1)Cl)O 34a_100000744943_100015514636 [0,0,0,0,0,0|3,0,1]=4 27 B12R1.385 C=CCNc1ccc(c(c1)F)O 34a_100011220035_100015514636 [0,0,0,0,0,0|3,0,1]=4 28 B12R1.385 C=CCNc1ccc(c(c1)F)O 7a_100011220035_100015514636 [0,0,0,0,0,0|3,0,1]=4 29 B12R1.385 C=CCNc1ccc(c(c1)O)C 34a_100000759471_100015514636 [0,0,0,0,0,0|3,0,1]=4 30 B12R1.385 C=CCNc1ccc(c(c1)O)C 7a_100000759471_100015514636 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.385 C=CCNc1ccc(c(c1)O)Cl 34a_100011934209_100015514636 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.385 C=CCNc1ccc(c(c1)O)F 34a_100012017398_100015514636 [0,0,0,0,0,0|3,0,1]=4 33 B12R1.385 C=CCNc1ccc(c(c1)O)F 7a_100012017398_100015514636 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.385 C=CCNc1ccc(c(c1)O)O 34a_100102946323_100015514636 [0,0,0,0,0,0|2,0,1]=3 35 B12R1.385 C=CCSc1ccc(c(c1)Br)O 62a_100000210623_100012361655 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.385 C=CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210623 [0,0,0,0,0,0|3,0,1]=4 37 B12R1.385 C=CCSc1ccc(c(c1)C)O 62a_100000210623_100000186361 [0,0,0,0,0,0|3,0,1]=4 38 B12R1.385 C=CCSc1ccc(c(c1)Cl)O 62a_100000210623_100012360047 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.385 C=CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210623 [0,0,0,0,0,0|3,0,1]=4 40 B12R1.385 C=CCSc1ccc(c(c1)F)O 62a_100000185481_100000210623 [0,0,0,0,0,0|3,0,1]=4 41 B12R1.385 C=CCSc1ccc(c(c1)F)O 62a_100000210623_100000185481 [0,0,0,0,0,0|3,0,1]=4 42 B12R1.385 C=CCSc1ccc(c(c1)N)O 62a_100000210623_100000752626 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.385 C=CCSc1ccc(c(c1)N)O 62a_100000752626_100000210623 [0,0,0,0,0,0|3,0,1]=4 44 B12R1.385 C=CCSc1ccc(c(c1)O)Br 62a_100000210623_100012356990 [0,0,0,0,0,0|3,0,1]=4 45 B12R1.385 C=CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210623 [0,0,0,0,0,0|3,0,1]=4 46 B12R1.385 C=CCSc1ccc(c(c1)O)C 62a_100000210623_100000685420 [0,0,0,0,0,0|3,0,1]=4 47 B12R1.385 C=CCSc1ccc(c(c1)O)C 62a_100000685420_100000210623 [0,0,0,0,0,0|3,0,1]=4 48 B12R1.385 C=CCSc1ccc(c(c1)O)Cl 62a_100000210623_100011356854 [0,0,0,0,0,0|3,0,1]=4 49 B12R1.385 C=CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210623 [0,0,0,0,0,0|3,0,1]=4 50 B12R1.385 C=CCSc1ccc(c(c1)O)F 62a_100000210623_100000686035 [0,0,0,0,0,0|3,0,1]=4 51 B12R1.385 C=CCSc1ccc(c(c1)O)F 62a_100000686035_100000210623 [0,0,0,0,0,0|3,0,1]=4 52 B12R1.385 C=CCSc1ccc(c(c1)O)N 62a_100000210623_100000739049 [0,0,0,0,0,0|3,0,1]=4 53 B12R1.385 C=CCSc1ccc(c(c1)O)N 62a_100000739049_100000210623 [0,0,0,0,0,0|3,0,1]=4 54 B12R1.385 C=CCSc1ccc(c(c1)O)O 62a_100000210623_100009813601 [0,0,0,0,0,0|2,0,1]=3 55 B12R1.385 CCCCc1c[nH]c(=O)c(c1)Br 271570a_100020621405_100010125443 [0,0,0,0,0,0|3,0,1]=4 56 B12R1.385 CCCCc1c[nH]c(=O)c(c1)F 271570a_100020621405_100000723523 [0,0,0,0,0,0|3,0,1]=4 57 B12R1.385 CCCCc1c[nH]c(=O)c(c1)O 271570a_100020621405_100009814561 [0,0,0,0,0,0|2,0,1]=3 58 B12R1.385 CCCCc1cc(c(cn1)Br)C 271570a_100020621405_100012356354 [0,0,0,0,0,0|4,0,0]=4 59 B12R1.385 CCCCc1cc(c(cn1)C)C 271570a_100020621405_100009850809 [0,0,0,0,0,0|4,0,0]=4 60 B12R1.385 CCCCc1cc(c(cn1)C)F 271570a_100020621405_100009841206 [0,0,0,0,0,0|4,0,0]=4 61 B12R1.385 CCCCc1cc(c(cn1)C)N 271570a_100020621405_100000690170 [0,0,0,0,0,0|4,0,0]=4 62 B12R1.385 CCCCc1cc(c(cn1)C)O 271570a_100020621405_100000704368 [0,0,0,0,0,0|3,0,0]=3 63 B12R1.385 CCCCc1cc(c(cn1)F)C 271570a_100020621405_100009818257 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.385 CCCCc1cc(c(cn1)F)N 271570a_100020621405_100000126464 [0,0,0,0,0,0|4,0,0]=4 65 B12R1.385 CCCCc1cc(c(cn1)F)O 271570a_100020621405_100009854642 [0,0,0,0,0,0|3,0,0]=3 66 B12R1.385 CCCCc1cc(c(cn1)N)C 271570a_100020621405_100000765520 [0,0,0,0,0,0|4,0,0]=4 67 B12R1.385 CCCCc1cc(c(cn1)N)N 271570a_100020621405_100000067514 [0,0,0,0,0,0|4,0,0]=4 68 B12R1.385 CCCCc1cc(c(cn1)O)C 271570a_100020621405_100000692680 [0,0,0,0,0,0|3,0,0]=3 69 B12R1.385 CCCCc1cc(c(cn1)O)N 271570a_100020621405_100009819941 [0,0,0,0,0,0|3,0,0]=3 70 B12R1.385 CCCCc1ccc(=O)n(c1)C 271570a_100020621405_100011245003 [0,0,0,0,0,0|3,0,1]=4 71 B12R1.385 CCCCc1ccc([n+](c1)[O-])C 271570a_100020621405_100000703231 [0,0,0,0,0,0|3,0,1]=4 72 B12R1.385 CCCCc1ccc(c(=S)[nH]1)N 271570a_100020621405_100116329207 [0,0,0,0,0,0|3,1,0]=4 73 B12R1.385 CCCCc1ccc(c(c1)Br)Br 271570a_100020621405_100012356285 [0,0,0,0,0,0|3,0,0]=3 74 B12R1.385 CCCCc1ccc(c(c1)Br)C 271570a_100020621405_100011847877 [0,0,0,0,0,0|3,0,0]=3 75 B12R1.385 CCCCc1ccc(c(c1)Br)Cl 271570a_100020621405_100012353702 [0,0,0,0,0,0|3,0,0]=3 76 B12R1.385 CCCCc1ccc(c(c1)Br)F 271570a_100020621405_100012047266 [0,0,0,0,0,0|3,0,0]=3 77 B12R1.385 CCCCc1ccc(c(c1)Br)N 271570a_100020621405_100000750455 [0,0,0,0,0,0|3,0,0]=3 78 B12R1.385 CCCCc1ccc(c(c1)Br)O 271570a_100020621405_100012361655 [0,0,0,0,0,0|2,0,0]=2 79 B12R1.385 CCCCc1ccc(c(c1)C)Br 271570a_100020621405_100009813585 [0,0,0,0,0,0|3,0,0]=3 80 B12R1.385 CCCCc1ccc(c(c1)C)C 271570a_100020621405_100011215607 [0,0,0,0,0,0|3,0,0]=3 81 B12R1.385 CCCCc1ccc(c(c1)C)Cl 271570a_100020621405_100000049509 [0,0,0,0,0,0|3,0,0]=3 82 B12R1.385 CCCCc1ccc(c(c1)C)F 271570a_100020621405_100011218330 [0,0,0,0,0,0|3,0,0]=3 83 B12R1.385 CCCCc1ccc(c(c1)C)N 271570a_100020621405_100000211769 [0,0,0,0,0,0|3,0,0]=3 84 B12R1.385 CCCCc1ccc(c(c1)C)O 271570a_100020621405_100000186361 [0,0,0,0,0,0|2,0,0]=2 85 B12R1.385 CCCCc1ccc(c(c1)Cl)Br 271570a_100020621405_100012047281 [0,0,0,0,0,0|3,0,0]=3 86 B12R1.385 CCCCc1ccc(c(c1)Cl)C 271570a_100020621405_100011216363 [0,0,0,0,0,0|3,0,0]=3 87 B12R1.385 CCCCc1ccc(c(c1)Cl)Cl 271570a_100020621405_100011214914 [0,0,0,0,0,0|3,0,0]=3 88 B12R1.385 CCCCc1ccc(c(c1)Cl)F 271570a_100020621405_100011215976 [0,0,0,0,0,0|3,0,0]=3 89 B12R1.385 CCCCc1ccc(c(c1)Cl)N 271570a_100020621405_100011218065 [0,0,0,0,0,0|3,0,0]=3 90 B12R1.385 CCCCc1ccc(c(c1)Cl)O 271570a_100020621405_100012360047 [0,0,0,0,0,0|2,0,0]=2 91 B12R1.385 CCCCc1ccc(c(c1)F)Br 271570a_100020621405_100000685389 [0,0,0,0,0,0|3,0,0]=3 92 B12R1.385 CCCCc1ccc(c(c1)F)C 271570a_100020621405_100000720648 [0,0,0,0,0,0|3,0,0]=3 93 B12R1.385 CCCCc1ccc(c(c1)F)Cl 271570a_100020621405_100011216805 [0,0,0,0,0,0|3,0,0]=3 94 B12R1.385 CCCCc1ccc(c(c1)F)F 271570a_100020621405_100000750028 [0,0,0,0,0,0|3,0,0]=3 95 B12R1.385 CCCCc1ccc(c(c1)F)N 271570a_100020621405_100011215594 [0,0,0,0,0,0|3,0,0]=3 96 B12R1.385 CCCCc1ccc(c(c1)F)O 271570a_100020621405_100000185481 [0,0,0,0,0,0|2,0,0]=2 97 B12R1.385 CCCCc1ccc(c(c1)N)Br 271570a_100020621405_100000750456 [0,0,0,0,0,0|3,0,0]=3 98 B12R1.385 CCCCc1ccc(c(c1)N)C 271570a_100020621405_100000761890 [0,0,0,0,0,0|3,0,0]=3 99 B12R1.385 CCCCc1ccc(c(c1)N)Cl 271570a_100020621405_200000761891 [0,0,0,0,0,0|3,0,0]=3 100 B12R1.385 CCCCc1ccc(c(c1)N)F 271570a_100020621405_100000740924 [0,0,0,0,0,0|3,0,0]=3 101 B12R1.385 CCCCc1ccc(c(c1)N)N 271570a_100020621405_100000741789 [0,0,0,0,0,0|3,0,0]=3 102 B12R1.385 CCCCc1ccc(c(c1)N)O 271570a_100020621405_100000752626 [0,0,0,0,0,0|2,0,0]=2 103 B12R1.385 CCCCc1ccc(c(c1)O)Br 271570a_100020621405_100012356990 [0,0,0,0,0,0|2,0,0]=2 104 B12R1.385 CCCCc1ccc(c(c1)O)C 271570a_100020621405_100000766334 [0,0,0,0,0,0|2,0,0]=2 105 B12R1.385 CCCCc1ccc(c(c1)O)Cl 271570a_100020621405_100011356854 [0,0,0,0,0,0|2,0,0]=2 106 B12R1.385 CCCCc1ccc(c(c1)O)F 271570a_100020621405_100000686035 [0,0,0,0,0,0|2,0,0]=2 107 B12R1.385 CCCCc1ccc(c(c1)O)N 271570a_100020621405_100000739049 [0,0,0,0,0,0|2,0,0]=2 108 B12R1.385 CCCCc1ccc(c(c1)O)O 271570a_100020621405_100009813601 [0,0,0,0,0,0|1,0,0]=1 109 B12R1.385 CCCCc1ccc(c(n1)Br)O 271570a_100020621405_100000725334 [0,0,0,0,0,0|3,0,0]=3 110 B12R1.385 CCCCc1ccc(c(n1)C)Br 271570a_100020621405_100012360386 [0,0,0,0,0,0|4,0,0]=4 111 B12R1.385 CCCCc1ccc(c(n1)C)C 271570a_100020621405_100000103781 [0,0,0,0,0,0|4,0,0]=4 112 B12R1.385 CCCCc1ccc(c(n1)C)F 271570a_100020621405_100009814307 [0,0,0,0,0,0|4,0,0]=4 113 B12R1.385 CCCCc1ccc(c(n1)C)N 271570a_100020621405_100000760127 [0,0,0,0,0,0|4,0,0]=4 114 B12R1.385 CCCCc1ccc(c(n1)C)O 271570a_100020621405_100010233687 [0,0,0,0,0,0|3,0,0]=3 115 B12R1.385 CCCCc1ccc(c(n1)Cl)N 271570a_100020621405_200010233646 [0,0,0,0,0,0|4,0,0]=4 116 B12R1.385 CCCCc1ccc(c(n1)Cl)O 271570a_100020621405_100000721234 [0,0,0,0,0,0|3,0,0]=3 117 B12R1.385 CCCCc1ccc(c(n1)F)Br 271570a_100020621405_100010134343 [0,0,0,0,0,0|4,0,0]=4 118 B12R1.385 CCCCc1ccc(c(n1)F)N 271570a_100020621405_100009856439 [0,0,0,0,0,0|4,0,0]=4 119 B12R1.385 CCCCc1ccc(c(n1)F)O 271570a_100020621405_100009819667 [0,0,0,0,0,0|3,0,0]=3 120 B12R1.385 CCCCc1ccc(c(n1)N)C 271570a_100020621405_100009857032 [0,0,0,0,0,0|4,0,0]=4 121 B12R1.385 CCCCc1ccc(c(n1)N)F 271570a_100020621405_100016091773 [0,0,0,0,0,0|4,0,0]=4 122 B12R1.385 CCCCc1ccc(c(n1)N)N 271570a_100020621405_100000747239 [0,0,0,0,0,0|4,0,0]=4 123 B12R1.385 CCCCc1ccc(c(n1)N)O 271570a_100020621405_100000685527 [0,0,0,0,0,0|3,0,0]=3 124 B12R1.385 CCCCc1ccc(c(n1)O)F 271570a_100020621405_100010729010 [0,0,0,0,0,0|3,0,0]=3 125 B12R1.385 CCCCc1ccc(c(n1)O)N 271570a_100020621405_100000718904 [0,0,0,0,0,0|3,0,0]=3 126 B12R1.385 CCCCc1ccn(c(=O)c1)C 271570a_100020621405_100009820031 [0,0,0,0,0,0|3,0,1]=4 127 B12R1.385 CCCCc1cnc(c(c1)Br)Cl 271570a_100020621405_100010172733 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.385 CCCCc1cnc(c(c1)Br)N 271570a_100020621405_100012353989 [0,0,0,0,0,0|4,0,0]=4 129 B12R1.385 CCCCc1cnc(c(c1)C)Br 271570a_100020621405_100009816107 [0,0,0,0,0,0|4,0,0]=4 130 B12R1.385 CCCCc1cnc(c(c1)C)C 271570a_100020621405_100000697892 [0,0,0,0,0,0|4,0,0]=4 131 B12R1.385 CCCCc1cnc(c(c1)C)Cl 271570a_100020621405_100009922867 [0,0,0,0,0,0|4,0,0]=4 132 B12R1.385 CCCCc1cnc(c(c1)C)F 271570a_100020621405_100000709442 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.385 CCCCc1cnc(c(c1)C)N 271570a_100020621405_100000186686 [0,0,0,0,0,0|4,0,0]=4 134 B12R1.385 CCCCc1cnc(c(c1)C)O 271570a_100020621405_100000685391 [0,0,0,0,0,0|3,0,0]=3 135 B12R1.385 CCCCc1cnc(c(c1)Cl)N 271570a_100020621405_100012356299 [0,0,0,0,0,0|4,0,0]=4 136 B12R1.385 CCCCc1cnc(c(c1)Cl)O 271570a_100020621405_100010238531 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.385 CCCCc1cnc(c(c1)F)C 271570a_100020621405_100009845756 [0,0,0,0,0,0|4,0,0]=4 138 B12R1.385 CCCCc1cnc(c(c1)F)F 271570a_100020621405_100009817721 [0,0,0,0,0,0|4,0,0]=4 139 B12R1.385 CCCCc1cnc(c(c1)F)N 271570a_100020621405_100000693161 [0,0,0,0,0,0|4,0,0]=4 140 B12R1.385 CCCCc1cnc(c(c1)N)C 271570a_100020621405_100011999542 [0,0,0,0,0,0|4,0,0]=4 141 B12R1.385 CCCCc1cnc(c(c1)N)Cl 271570a_100020621405_100009828400 [0,0,0,0,0,0|4,0,0]=4 142 B12R1.385 CCCCc1cnc(c(c1)N)F 271570a_100020621405_100009816798 [0,0,0,0,0,0|4,0,0]=4 143 B12R1.385 CCCCc1cnc(c(c1)N)N 271570a_100020621405_100000184470 [0,0,0,0,0,0|4,0,0]=4 144 B12R1.385 CCCCc1cnc(c(c1)N)O 271570a_100020621405_100000743729 [0,0,0,0,0,0|3,0,0]=3 145 B12R1.385 CCCCc1cnc(c(c1)O)C 271570a_100020621405_100009864810 [0,0,0,0,0,0|3,0,0]=3 146 B12R1.385 CCCCc1cnc(c(c1)O)F 271570a_100020621405_100009819871 [0,0,0,0,0,0|3,0,0]=3 147 B12R1.385 CCCCc1cnc(c(c1)O)N 271570a_100020621405_100009819042 [0,0,0,0,0,0|3,0,0]=3 148 B12R1.385 CCCCc1ncc(c(n1)O)F 271570a_100020621405_100011995740 [0,0,0,0,0,0|4,0,0]=4 149 B12R1.385 CCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210303 [0,0,0,0,0,0|4,0,0]=4 150 B12R1.385 CCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210303 [0,0,0,0,0,0|4,0,0]=4 151 B12R1.385 CCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210303 [0,0,0,0,0,0|4,0,0]=4 152 B12R1.385 CCCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210303 [0,0,0,0,0,0|4,0,0]=4 153 B12R1.385 CCCNc1ccc(c(c1)Br)C 34a_100000736455_100000210303 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.385 CCCNc1ccc(c(c1)Br)C 7a_100000736455_100000210303 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210303 [0,0,0,0,0,0|4,0,0]=4 156 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210303 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.385 CCCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210303 [0,0,0,0,0,0|4,0,0]=4 158 B12R1.385 CCCNc1ccc(c(c1)Br)F 34a_100000760356_100000210303 [0,0,0,0,0,0|4,0,0]=4 159 B12R1.385 CCCNc1ccc(c(c1)Br)F 7a_100000760356_100000210303 [0,0,0,0,0,0|4,0,0]=4 160 B12R1.385 CCCNc1ccc(c(c1)Br)I 34a_100000750458_100000210303 [0,0,0,0,0,0|4,0,0]=4 161 B12R1.385 CCCNc1ccc(c(c1)Br)O 34a_100011534360_100000210303 [0,0,0,0,0,0|3,0,0]=3 162 B12R1.385 CCCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210303 [0,0,0,0,0,0|4,0,0]=4 163 B12R1.385 CCCNc1ccc(c(c1)C)Br 34a_100000210723_100000210303 [0,0,0,0,0,0|4,0,0]=4 164 B12R1.385 CCCNc1ccc(c(c1)C)Br 7a_100000210723_100000210303 [0,0,0,0,0,0|4,0,0]=4 165 B12R1.385 CCCNc1ccc(c(c1)C)C 2230a_100000724040_100000210303 [0,0,0,0,0,0|4,0,0]=4 166 B12R1.385 CCCNc1ccc(c(c1)C)C 34a_100000724040_100000210303 [0,0,0,0,0,0|4,0,0]=4 167 B12R1.385 CCCNc1ccc(c(c1)C)C 7a_100000724040_100000210303 [0,0,0,0,0,0|4,0,0]=4 168 B12R1.385 CCCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210303 [0,0,0,0,0,0|4,0,0]=4 169 B12R1.385 CCCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210303 [0,0,0,0,0,0|4,0,0]=4 170 B12R1.385 CCCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210303 [0,0,0,0,0,0|4,0,0]=4 171 B12R1.385 CCCNc1ccc(c(c1)C)F 2230a_100000750164_100000210303 [0,0,0,0,0,0|4,0,0]=4 172 B12R1.385 CCCNc1ccc(c(c1)C)F 34a_100000750164_100000210303 [0,0,0,0,0,0|4,0,0]=4 173 B12R1.385 CCCNc1ccc(c(c1)C)F 7a_100000750164_100000210303 [0,0,0,0,0,0|4,0,0]=4 174 B12R1.385 CCCNc1ccc(c(c1)C)I 34a_100000198070_100000210303 [0,0,0,0,0,0|4,0,0]=4 175 B12R1.385 CCCNc1ccc(c(c1)C)I 7a_100000198070_100000210303 [0,0,0,0,0,0|4,0,0]=4 176 B12R1.385 CCCNc1ccc(c(c1)C)O 34a_100011218179_100000210303 [0,0,0,0,0,0|3,0,0]=3 177 B12R1.385 CCCNc1ccc(c(c1)C)O 7a_100011218179_100000210303 [0,0,0,0,0,0|3,0,0]=3 178 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210303 [0,0,0,0,0,0|4,0,0]=4 179 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210303 [0,0,0,0,0,0|4,0,0]=4 180 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210303 [0,0,0,0,0,0|4,0,0]=4 181 B12R1.385 CCCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210303 [0,0,0,0,0,0|4,0,0]=4 182 B12R1.385 CCCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210303 [0,0,0,0,0,0|4,0,0]=4 183 B12R1.385 CCCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210303 [0,0,0,0,0,0|4,0,0]=4 184 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210303 [0,0,0,0,0,0|4,0,0]=4 185 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210303 [0,0,0,0,0,0|4,0,0]=4 186 B12R1.385 CCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210303 [0,0,0,0,0,0|4,0,0]=4 187 B12R1.385 CCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210303 [0,0,0,0,0,0|4,0,0]=4 188 B12R1.385 CCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210303 [0,0,0,0,0,0|4,0,0]=4 189 B12R1.385 CCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210303 [0,0,0,0,0,0|4,0,0]=4 190 B12R1.385 CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210303 [0,0,0,0,0,0|3,0,0]=3 191 B12R1.385 CCCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210303 [0,0,0,0,0,0|4,0,0]=4 192 B12R1.385 CCCNc1ccc(c(c1)F)Br 34a_100000759894_100000210303 [0,0,0,0,0,0|4,0,0]=4 193 B12R1.385 CCCNc1ccc(c(c1)F)Br 7a_100000759894_100000210303 [0,0,0,0,0,0|4,0,0]=4 194 B12R1.385 CCCNc1ccc(c(c1)F)C 2230a_100000210958_100000210303 [0,0,0,0,0,0|4,0,0]=4 195 B12R1.385 CCCNc1ccc(c(c1)F)C 34a_100000210958_100000210303 [0,0,0,0,0,0|4,0,0]=4 196 B12R1.385 CCCNc1ccc(c(c1)F)C 7a_100000210958_100000210303 [0,0,0,0,0,0|4,0,0]=4 197 B12R1.385 CCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210303 [0,0,0,0,0,0|4,0,0]=4 198 B12R1.385 CCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210303 [0,0,0,0,0,0|4,0,0]=4 199 B12R1.385 CCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210303 [0,0,0,0,0,0|4,0,0]=4 200 B12R1.385 CCCNc1ccc(c(c1)F)F 2230a_100000210724_100000210303 [0,0,0,0,0,0|4,0,0]=4 201 B12R1.385 CCCNc1ccc(c(c1)F)F 34a_100000210724_100000210303 [0,0,0,0,0,0|4,0,0]=4 202 B12R1.385 CCCNc1ccc(c(c1)F)F 7a_100000210724_100000210303 [0,0,0,0,0,0|4,0,0]=4 203 B12R1.385 CCCNc1ccc(c(c1)F)I 34a_100011356925_100000210303 [0,0,0,0,0,0|4,0,0]=4 204 B12R1.385 CCCNc1ccc(c(c1)F)I 7a_100011356925_100000210303 [0,0,0,0,0,0|4,0,0]=4 205 B12R1.385 CCCNc1ccc(c(c1)F)O 34a_100011220035_100000210303 [0,0,0,0,0,0|3,0,0]=3 206 B12R1.385 CCCNc1ccc(c(c1)F)O 7a_100011220035_100000210303 [0,0,0,0,0,0|3,0,0]=3 207 B12R1.385 CCCNc1ccc(c(c1)I)Br 34a_100000750459_100000210303 [0,0,0,0,0,0|4,0,0]=4 208 B12R1.385 CCCNc1ccc(c(c1)I)C 34a_100000184131_100000210303 [0,0,0,0,0,0|4,0,0]=4 209 B12R1.385 CCCNc1ccc(c(c1)I)C 7a_100000184131_100000210303 [0,0,0,0,0,0|4,0,0]=4 210 B12R1.385 CCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210303 [0,0,0,0,0,0|4,0,0]=4 211 B12R1.385 CCCNc1ccc(c(c1)I)F 34a_114828291077_100000210303 [0,0,0,0,0,0|4,0,0]=4 212 B12R1.385 CCCNc1ccc(c(c1)I)F 7a_114828291077_100000210303 [0,0,0,0,0,0|4,0,0]=4 213 B12R1.385 CCCNc1ccc(c(c1)O)C 34a_100000759471_100000210303 [0,0,0,0,0,0|3,0,0]=3 214 B12R1.385 CCCNc1ccc(c(c1)O)C 7a_100000759471_100000210303 [0,0,0,0,0,0|3,0,0]=3 215 B12R1.385 CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210303 [0,0,0,0,0,0|3,0,0]=3 216 B12R1.385 CCCNc1ccc(c(c1)O)F 34a_100012017398_100000210303 [0,0,0,0,0,0|3,0,0]=3 217 B12R1.385 CCCNc1ccc(c(c1)O)F 7a_100012017398_100000210303 [0,0,0,0,0,0|3,0,0]=3 218 B12R1.385 CCCNc1ccc(c(c1)O)O 34a_100102946323_100000210303 [0,0,0,0,0,0|2,0,0]=2 219 B12R1.385 CCCOc1ccc(c(c1)Br)C 34a_100011380479_100000210303 [0,0,0,0,0,0|4,0,0]=4 220 B12R1.385 CCCOc1ccc(c(c1)Br)C 7a_100011380479_100000210303 [0,0,0,0,0,0|4,0,0]=4 221 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210303 [0,0,0,0,0,0|4,0,0]=4 222 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210303 [0,0,0,0,0,0|4,0,0]=4 223 B12R1.385 CCCOc1ccc(c(c1)Br)F 34a_100000693481_100000210303 [0,0,0,0,0,0|4,0,0]=4 224 B12R1.385 CCCOc1ccc(c(c1)Br)F 7a_100000693481_100000210303 [0,0,0,0,0,0|4,0,0]=4 225 B12R1.385 CCCOc1ccc(c(c1)Br)I 34a_100000701344_100000210303 [0,0,0,0,0,0|4,0,0]=4 226 B12R1.385 CCCOc1ccc(c(c1)Br)I 7a_100000701344_100000210303 [0,0,0,0,0,0|4,0,0]=4 227 B12R1.385 CCCOc1ccc(c(c1)Br)N 34a_100012001276_100000210303 [0,0,0,0,0,0|4,0,0]=4 228 B12R1.385 CCCOc1ccc(c(c1)Br)N 7a_100012001276_100000210303 [0,0,0,0,0,0|4,0,0]=4 229 B12R1.385 CCCOc1ccc(c(c1)C)Br 34a_100000690111_100000210303 [0,0,0,0,0,0|4,0,0]=4 230 B12R1.385 CCCOc1ccc(c(c1)C)Br 7a_100000690111_100000210303 [0,0,0,0,0,0|4,0,0]=4 231 B12R1.385 CCCOc1ccc(c(c1)C)C 34a_100000210932_100000210303 [0,0,0,0,0,0|4,0,0]=4 232 B12R1.385 CCCOc1ccc(c(c1)C)C 7a_100000210932_100000210303 [0,0,0,0,0,0|4,0,0]=4 233 B12R1.385 CCCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210303 [0,0,0,0,0,0|4,0,0]=4 234 B12R1.385 CCCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210303 [0,0,0,0,0,0|4,0,0]=4 235 B12R1.385 CCCOc1ccc(c(c1)C)F 34a_100000751312_100000210303 [0,0,0,0,0,0|4,0,0]=4 236 B12R1.385 CCCOc1ccc(c(c1)C)F 7a_100000751312_100000210303 [0,0,0,0,0,0|4,0,0]=4 237 B12R1.385 CCCOc1ccc(c(c1)C)I 34a_100000729255_100000210303 [0,0,0,0,0,0|4,0,0]=4 238 B12R1.385 CCCOc1ccc(c(c1)C)I 7a_100000729255_100000210303 [0,0,0,0,0,0|4,0,0]=4 239 B12R1.385 CCCOc1ccc(c(c1)C)N 34a_100000756630_100000210303 [0,0,0,0,0,0|4,0,0]=4 240 B12R1.385 CCCOc1ccc(c(c1)C)N 7a_100000756630_100000210303 [0,0,0,0,0,0|4,0,0]=4 241 B12R1.385 CCCOc1ccc(c(c1)C)O 271570a_203496583355_200012361509 [0,0,0,0,0,0|3,0,0]=3 242 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210303 [0,0,0,0,0,0|4,0,0]=4 243 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210303 [0,0,0,0,0,0|4,0,0]=4 244 B12R1.385 CCCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210303 [0,0,0,0,0,0|4,0,0]=4 245 B12R1.385 CCCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210303 [0,0,0,0,0,0|4,0,0]=4 246 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210303 [0,0,0,0,0,0|4,0,0]=4 247 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210303 [0,0,0,0,0,0|4,0,0]=4 248 B12R1.385 CCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210303 [0,0,0,0,0,0|4,0,0]=4 249 B12R1.385 CCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210303 [0,0,0,0,0,0|4,0,0]=4 250 B12R1.385 CCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210303 [0,0,0,0,0,0|4,0,0]=4 251 B12R1.385 CCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210303 [0,0,0,0,0,0|4,0,0]=4 252 B12R1.385 CCCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210303 [0,0,0,0,0,0|4,0,0]=4 253 B12R1.385 CCCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210303 [0,0,0,0,0,0|4,0,0]=4 254 B12R1.385 CCCOc1ccc(c(c1)F)Br 34a_100000755031_100000210303 [0,0,0,0,0,0|4,0,0]=4 255 B12R1.385 CCCOc1ccc(c(c1)F)Br 7a_100000755031_100000210303 [0,0,0,0,0,0|4,0,0]=4 256 B12R1.385 CCCOc1ccc(c(c1)F)C 34a_100000722560_100000210303 [0,0,0,0,0,0|4,0,0]=4 257 B12R1.385 CCCOc1ccc(c(c1)F)C 7a_100000722560_100000210303 [0,0,0,0,0,0|4,0,0]=4 258 B12R1.385 CCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210303 [0,0,0,0,0,0|4,0,0]=4 259 B12R1.385 CCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210303 [0,0,0,0,0,0|4,0,0]=4 260 B12R1.385 CCCOc1ccc(c(c1)F)F 34a_100000181275_100000210303 [0,0,0,0,0,0|4,0,0]=4 261 B12R1.385 CCCOc1ccc(c(c1)F)F 7a_100000181275_100000210303 [0,0,0,0,0,0|4,0,0]=4 262 B12R1.385 CCCOc1ccc(c(c1)F)I 34a_100009990212_100000210303 [0,0,0,0,0,0|4,0,0]=4 263 B12R1.385 CCCOc1ccc(c(c1)F)I 7a_100009990212_100000210303 [0,0,0,0,0,0|4,0,0]=4 264 B12R1.385 CCCOc1ccc(c(c1)F)N 34a_100000759473_100000210303 [0,0,0,0,0,0|4,0,0]=4 265 B12R1.385 CCCOc1ccc(c(c1)F)N 7a_100000759473_100000210303 [0,0,0,0,0,0|4,0,0]=4 266 B12R1.385 CCCOc1ccc(c(c1)F)O 271570a_203496583355_200012236930 [0,0,0,0,0,0|3,0,0]=3 267 B12R1.385 CCCOc1ccc(c(c1)I)Br 34a_100012339312_100000210303 [0,0,0,0,0,0|4,0,0]=4 268 B12R1.385 CCCOc1ccc(c(c1)I)Br 7a_100012339312_100000210303 [0,0,0,0,0,0|4,0,0]=4 269 B12R1.385 CCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210303 [0,0,0,0,0,0|4,0,0]=4 270 B12R1.385 CCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210303 [0,0,0,0,0,0|4,0,0]=4 271 B12R1.385 CCCOc1ccc(c(c1)I)N 34a_100010084370_100000210303 [0,0,0,0,0,0|4,0,0]=4 272 B12R1.385 CCCOc1ccc(c(c1)I)N 7a_100010084370_100000210303 [0,0,0,0,0,0|4,0,0]=4 273 B12R1.385 CCCOc1ccc(c(c1)N)Br 34a_100011999798_100000210303 [0,0,0,0,0,0|4,0,0]=4 274 B12R1.385 CCCOc1ccc(c(c1)N)Br 7a_100011999798_100000210303 [0,0,0,0,0,0|4,0,0]=4 275 B12R1.385 CCCOc1ccc(c(c1)N)C 34a_100011216113_100000210303 [0,0,0,0,0,0|4,0,0]=4 276 B12R1.385 CCCOc1ccc(c(c1)N)C 7a_100011216113_100000210303 [0,0,0,0,0,0|4,0,0]=4 277 B12R1.385 CCCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210303 [0,0,0,0,0,0|4,0,0]=4 278 B12R1.385 CCCOc1ccc(c(c1)N)F 34a_100012017239_100000210303 [0,0,0,0,0,0|4,0,0]=4 279 B12R1.385 CCCOc1ccc(c(c1)N)F 7a_100012017239_100000210303 [0,0,0,0,0,0|4,0,0]=4 280 B12R1.385 CCCOc1ccc(c(c1)N)N 34a_100025771000_100000210303 [0,0,0,0,0,0|4,0,0]=4 281 B12R1.385 CCCOc1ccc(c(n1)C)O 271570a_203496583355_200012343549 [0,0,0,0,0,0|4,0,0]=4 282 B12R1.385 CCCSc1c[nH]c(=O)c(c1)O 62a_100000210303_100009814561 [0,0,0,0,0,0|3,0,1]=4 283 B12R1.385 CCCSc1cc(c(cn1)C)O 62a_100000210303_100000704368 [0,0,0,0,0,0|4,0,0]=4 284 B12R1.385 CCCSc1cc(c(cn1)C)O 62a_100000704368_100000210303 [0,0,0,0,0,0|4,0,0]=4 285 B12R1.385 CCCSc1cc(c(cn1)F)O 62a_100000210303_100009854642 [0,0,0,0,0,0|4,0,0]=4 286 B12R1.385 CCCSc1cc(c(cn1)F)O 62a_100009854642_100000210303 [0,0,0,0,0,0|4,0,0]=4 287 B12R1.385 CCCSc1cc(c(cn1)O)C 62a_100000210303_100000692680 [0,0,0,0,0,0|4,0,0]=4 288 B12R1.385 CCCSc1cc(c(cn1)O)N 62a_100000210303_100009819941 [0,0,0,0,0,0|4,0,0]=4 289 B12R1.385 CCCSc1cc(c(cn1)O)N 62a_100009819941_100000210303 [0,0,0,0,0,0|4,0,0]=4 290 B12R1.385 CCCSc1ccc(c(c1)Br)Br 62a_100000210303_100012356285 [0,0,0,0,0,0|4,0,0]=4 291 B12R1.385 CCCSc1ccc(c(c1)Br)Br 62a_100012356285_100000210303 [0,0,0,0,0,0|4,0,0]=4 292 B12R1.385 CCCSc1ccc(c(c1)Br)C 62a_100000210303_100011847877 [0,0,0,0,0,0|4,0,0]=4 293 B12R1.385 CCCSc1ccc(c(c1)Br)C 62a_100011847877_100000210303 [0,0,0,0,0,0|4,0,0]=4 294 B12R1.385 CCCSc1ccc(c(c1)Br)Cl 62a_100000210303_100012353702 [0,0,0,0,0,0|4,0,0]=4 295 B12R1.385 CCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210303 [0,0,0,0,0,0|4,0,0]=4 296 B12R1.385 CCCSc1ccc(c(c1)Br)F 62a_100000210303_100012047266 [0,0,0,0,0,0|4,0,0]=4 297 B12R1.385 CCCSc1ccc(c(c1)Br)F 62a_100012047266_100000210303 [0,0,0,0,0,0|4,0,0]=4 298 B12R1.385 CCCSc1ccc(c(c1)Br)N 62a_100000210303_100000750455 [0,0,0,0,0,0|4,0,0]=4 299 B12R1.385 CCCSc1ccc(c(c1)Br)N 62a_100000750455_100000210303 [0,0,0,0,0,0|4,0,0]=4 300 B12R1.385 CCCSc1ccc(c(c1)Br)O 62a_100000210303_100012361655 [0,0,0,0,0,0|3,0,0]=3 301 B12R1.385 CCCSc1ccc(c(c1)Br)O 62a_100012361655_100000210303 [0,0,0,0,0,0|3,0,0]=3 302 B12R1.385 CCCSc1ccc(c(c1)C)Br 62a_100000210303_100009813585 [0,0,0,0,0,0|4,0,0]=4 303 B12R1.385 CCCSc1ccc(c(c1)C)Br 62a_100009813585_100000210303 [0,0,0,0,0,0|4,0,0]=4 304 B12R1.385 CCCSc1ccc(c(c1)C)C 62a_100000210303_100011215607 [0,0,0,0,0,0|4,0,0]=4 305 B12R1.385 CCCSc1ccc(c(c1)C)C 62a_100011215607_100000210303 [0,0,0,0,0,0|4,0,0]=4 306 B12R1.385 CCCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210303 [0,0,0,0,0,0|4,0,0]=4 307 B12R1.385 CCCSc1ccc(c(c1)C)Cl 62a_100000210303_100000049509 [0,0,0,0,0,0|4,0,0]=4 308 B12R1.385 CCCSc1ccc(c(c1)C)F 62a_100000210303_100011218330 [0,0,0,0,0,0|4,0,0]=4 309 B12R1.385 CCCSc1ccc(c(c1)C)F 62a_100011218330_100000210303 [0,0,0,0,0,0|4,0,0]=4 310 B12R1.385 CCCSc1ccc(c(c1)C)N 62a_100000210303_100000211769 [0,0,0,0,0,0|4,0,0]=4 311 B12R1.385 CCCSc1ccc(c(c1)C)N 62a_100000211769_100000210303 [0,0,0,0,0,0|4,0,0]=4 312 B12R1.385 CCCSc1ccc(c(c1)C)O 62a_100000210303_100000186361 [0,0,0,0,0,0|3,0,0]=3 313 B12R1.385 CCCSc1ccc(c(c1)Cl)Br 62a_100000210303_100012047281 [0,0,0,0,0,0|4,0,0]=4 314 B12R1.385 CCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210303 [0,0,0,0,0,0|4,0,0]=4 315 B12R1.385 CCCSc1ccc(c(c1)Cl)C 62a_100000210303_100011216363 [0,0,0,0,0,0|4,0,0]=4 316 B12R1.385 CCCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210303 [0,0,0,0,0,0|4,0,0]=4 317 B12R1.385 CCCSc1ccc(c(c1)Cl)Cl 62a_100000210303_100011214914 [0,0,0,0,0,0|4,0,0]=4 318 B12R1.385 CCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210303 [0,0,0,0,0,0|4,0,0]=4 319 B12R1.385 CCCSc1ccc(c(c1)Cl)F 62a_100000210303_100011215976 [0,0,0,0,0,0|4,0,0]=4 320 B12R1.385 CCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210303 [0,0,0,0,0,0|4,0,0]=4 321 B12R1.385 CCCSc1ccc(c(c1)Cl)N 62a_100000210303_100011218065 [0,0,0,0,0,0|4,0,0]=4 322 B12R1.385 CCCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210303 [0,0,0,0,0,0|4,0,0]=4 323 B12R1.385 CCCSc1ccc(c(c1)Cl)O 62a_100000210303_100012360047 [0,0,0,0,0,0|3,0,0]=3 324 B12R1.385 CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210303 [0,0,0,0,0,0|3,0,0]=3 325 B12R1.385 CCCSc1ccc(c(c1)F)Br 62a_100000210303_100000685389 [0,0,0,0,0,0|4,0,0]=4 326 B12R1.385 CCCSc1ccc(c(c1)F)Br 62a_100000685389_100000210303 [0,0,0,0,0,0|4,0,0]=4 327 B12R1.385 CCCSc1ccc(c(c1)F)C 62a_100000210303_100000720648 [0,0,0,0,0,0|4,0,0]=4 328 B12R1.385 CCCSc1ccc(c(c1)F)C 62a_100000720648_100000210303 [0,0,0,0,0,0|4,0,0]=4 329 B12R1.385 CCCSc1ccc(c(c1)F)Cl 62a_100000210303_100011216805 [0,0,0,0,0,0|4,0,0]=4 330 B12R1.385 CCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210303 [0,0,0,0,0,0|4,0,0]=4 331 B12R1.385 CCCSc1ccc(c(c1)F)F 62a_100000210303_100000703953 [0,0,0,0,0,0|4,0,0]=4 332 B12R1.385 CCCSc1ccc(c(c1)F)F 62a_100000703953_100000210303 [0,0,0,0,0,0|4,0,0]=4 333 B12R1.385 CCCSc1ccc(c(c1)F)N 62a_100000210303_100011215594 [0,0,0,0,0,0|4,0,0]=4 334 B12R1.385 CCCSc1ccc(c(c1)F)N 62a_100011215594_100000210303 [0,0,0,0,0,0|4,0,0]=4 335 B12R1.385 CCCSc1ccc(c(c1)F)O 62a_100000185481_100000210303 [0,0,0,0,0,0|3,0,0]=3 336 B12R1.385 CCCSc1ccc(c(c1)F)O 62a_100000210303_100000185481 [0,0,0,0,0,0|3,0,0]=3 337 B12R1.385 CCCSc1ccc(c(c1)N)Br 62a_100000210303_100000750456 [0,0,0,0,0,0|4,0,0]=4 338 B12R1.385 CCCSc1ccc(c(c1)N)Br 62a_100000750456_100000210303 [0,0,0,0,0,0|4,0,0]=4 339 B12R1.385 CCCSc1ccc(c(c1)N)C 62a_100000210303_100000761890 [0,0,0,0,0,0|4,0,0]=4 340 B12R1.385 CCCSc1ccc(c(c1)N)C 62a_100000761890_100000210303 [0,0,0,0,0,0|4,0,0]=4 341 B12R1.385 CCCSc1ccc(c(c1)N)Cl 62a_100000210303_200000761891 [0,0,0,0,0,0|4,0,0]=4 342 B12R1.385 CCCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210303 [0,0,0,0,0,0|4,0,0]=4 343 B12R1.385 CCCSc1ccc(c(c1)N)F 62a_100000210303_100000740924 [0,0,0,0,0,0|4,0,0]=4 344 B12R1.385 CCCSc1ccc(c(c1)N)F 62a_100000740924_100000210303 [0,0,0,0,0,0|4,0,0]=4 345 B12R1.385 CCCSc1ccc(c(c1)N)N 62a_100000210303_100011534411 [0,0,0,0,0,0|4,0,0]=4 346 B12R1.385 CCCSc1ccc(c(c1)N)N 62a_100000741789_100000210303 [0,0,0,0,0,0|4,0,0]=4 347 B12R1.385 CCCSc1ccc(c(c1)N)O 62a_100000210303_100000752626 [0,0,0,0,0,0|3,0,0]=3 348 B12R1.385 CCCSc1ccc(c(c1)N)O 62a_100000752626_100000210303 [0,0,0,0,0,0|3,0,0]=3 349 B12R1.385 CCCSc1ccc(c(c1)O)Br 62a_100000210303_100012356990 [0,0,0,0,0,0|3,0,0]=3 350 B12R1.385 CCCSc1ccc(c(c1)O)Br 62a_100012356990_100000210303 [0,0,0,0,0,0|3,0,0]=3 351 B12R1.385 CCCSc1ccc(c(c1)O)C 62a_100000210303_100000685420 [0,0,0,0,0,0|3,0,0]=3 352 B12R1.385 CCCSc1ccc(c(c1)O)C 62a_100000685420_100000210303 [0,0,0,0,0,0|3,0,0]=3 353 B12R1.385 CCCSc1ccc(c(c1)O)Cl 62a_100000210303_100011356854 [0,0,0,0,0,0|3,0,0]=3 354 B12R1.385 CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210303 [0,0,0,0,0,0|3,0,0]=3 355 B12R1.385 CCCSc1ccc(c(c1)O)F 62a_100000210303_100000686035 [0,0,0,0,0,0|3,0,0]=3 356 B12R1.385 CCCSc1ccc(c(c1)O)F 62a_100000686035_100000210303 [0,0,0,0,0,0|3,0,0]=3 357 B12R1.385 CCCSc1ccc(c(c1)O)N 62a_100000210303_100000739049 [0,0,0,0,0,0|3,0,0]=3 358 B12R1.385 CCCSc1ccc(c(c1)O)N 62a_100000739049_100000210303 [0,0,0,0,0,0|3,0,0]=3 359 B12R1.385 CCCSc1ccc(c(c1)O)O 62a_100000210303_100009813601 [0,0,0,0,0,0|2,0,0]=2 360 B12R1.385 CCCSc1ccc(c(n1)Br)O 62a_100000210303_100000725334 [0,0,0,0,0,0|4,0,0]=4 361 B12R1.385 CCCSc1ccc(c(n1)Br)O 62a_100000725334_100000210303 [0,0,0,0,0,0|4,0,0]=4 362 B12R1.385 CCCSc1ccc(c(n1)C)O 62a_100000210303_100010233687 [0,0,0,0,0,0|4,0,0]=4 363 B12R1.385 CCCSc1ccc(c(n1)C)O 62a_100010233687_100000210303 [0,0,0,0,0,0|4,0,0]=4 364 B12R1.385 CCCSc1ccc(c(n1)Cl)O 62a_100000210303_100000721234 [0,0,0,0,0,0|4,0,0]=4 365 B12R1.385 CCCSc1ccc(c(n1)F)O 62a_100000210303_100009819667 [0,0,0,0,0,0|4,0,0]=4 366 B12R1.385 CCCSc1ccc(c(n1)F)O 62a_100009819667_100000210303 [0,0,0,0,0,0|4,0,0]=4 367 B12R1.385 CCCSc1ccc(c(n1)N)O 62a_100000210303_100000685527 [0,0,0,0,0,0|4,0,0]=4 368 B12R1.385 CCCSc1ccc(c(n1)N)O 62a_100000685527_100000210303 [0,0,0,0,0,0|4,0,0]=4 369 B12R1.385 CCCSc1ccc(c(n1)O)F 62a_100000210303_100010729010 [0,0,0,0,0,0|4,0,0]=4 370 B12R1.385 CCCSc1ccc(c(n1)O)N 62a_100000718904_100000210303 [0,0,0,0,0,0|4,0,0]=4 371 B12R1.385 CCCSc1cnc(c(c1)C)O 62a_100000210303_100000685391 [0,0,0,0,0,0|4,0,0]=4 372 B12R1.385 CCCSc1cnc(c(c1)C)O 62a_100000685391_100000210303 [0,0,0,0,0,0|4,0,0]=4 373 B12R1.385 CCCSc1cnc(c(c1)Cl)O 62a_100000210303_100010238531 [0,0,0,0,0,0|4,0,0]=4 374 B12R1.385 CCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210303 [0,0,0,0,0,0|4,0,0]=4 375 B12R1.385 CCCSc1cnc(c(c1)N)O 62a_100000210303_100000743729 [0,0,0,0,0,0|4,0,0]=4 376 B12R1.385 CCCSc1cnc(c(c1)N)O 62a_100000743729_100000210303 [0,0,0,0,0,0|4,0,0]=4 377 B12R1.385 CCCSc1cnc(c(c1)O)C 62a_100000210303_100009864810 [0,0,0,0,0,0|4,0,0]=4 378 B12R1.385 CCCSc1cnc(c(c1)O)C 62a_100009864810_100000210303 [0,0,0,0,0,0|4,0,0]=4 379 B12R1.385 CCCSc1cnc(c(c1)O)F 62a_100000210303_100009819871 [0,0,0,0,0,0|4,0,0]=4 380 B12R1.385 CCCSc1cnc(c(c1)O)F 62a_100009819871_100000210303 [0,0,0,0,0,0|4,0,0]=4 381 B12R1.385 CCCSc1cnc(c(c1)O)N 62a_100000210303_100009819042 [0,0,0,0,0,0|4,0,0]=4 382 B12R1.385 CCCSc1cnc(c(c1)O)N 62a_100009819042_100000210303 [0,0,0,0,0,0|4,0,0]=4 383 B12R1.385 CCNCc1cc(=O)c(co1)O 2230a_100015525214_100000010605 [0,0,0,0,0,0|3,0,1]=4 384 B12R1.385 CCNCc1ccc(c(c1)Br)Br 207a_100015525214_100011215943 [0,0,0,0,0,0|4,0,0]=4 385 B12R1.385 CCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000210202 [0,0,0,0,0,0|4,0,0]=4 386 B12R1.385 CCNCc1ccc(c(c1)Br)Br 2230a_100015525214_100012353900 [0,0,0,0,0,0|4,0,0]=4 387 B12R1.385 CCNCc1ccc(c(c1)Br)Br 270004a_100015525214_100011215943 [0,0,0,0,0,0|4,0,0]=4 388 B12R1.385 CCNCc1ccc(c(c1)Br)Br 34a_100012351559_100000210202 [0,0,0,0,0,0|4,0,0]=4 389 B12R1.385 CCNCc1ccc(c(c1)Br)C 207a_100015525214_100000695567 [0,0,0,0,0,0|4,0,0]=4 390 B12R1.385 CCNCc1ccc(c(c1)Br)C 2230a_100015525214_100012232412 [0,0,0,0,0,0|4,0,0]=4 391 B12R1.385 CCNCc1ccc(c(c1)Br)C 270004a_100015525214_100000695567 [0,0,0,0,0,0|4,0,0]=4 392 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 207a_100015525214_100000693810 [0,0,0,0,0,0|4,0,0]=4 393 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000210202 [0,0,0,0,0,0|4,0,0]=4 394 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 2230a_100015525214_100012353894 [0,0,0,0,0,0|4,0,0]=4 395 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 270004a_100015525214_100000693810 [0,0,0,0,0,0|4,0,0]=4 396 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000210202 [0,0,0,0,0,0|4,0,0]=4 397 B12R1.385 CCNCc1ccc(c(c1)Br)F 207a_100015525214_100000211747 [0,0,0,0,0,0|4,0,0]=4 398 B12R1.385 CCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000210202 [0,0,0,0,0,0|4,0,0]=4 399 B12R1.385 CCNCc1ccc(c(c1)Br)F 2230a_100015525214_100011206884 [0,0,0,0,0,0|4,0,0]=4 400 B12R1.385 CCNCc1ccc(c(c1)Br)F 270004a_100015525214_100000211747 [0,0,0,0,0,0|4,0,0]=4 401 B12R1.385 CCNCc1ccc(c(c1)Br)F 34a_100015193890_100000210202 [0,0,0,0,0,0|4,0,0]=4 402 B12R1.385 CCNCc1ccc(c(c1)C)Br 207a_100015525214_100000765772 [0,0,0,0,0,0|4,0,0]=4 403 B12R1.385 CCNCc1ccc(c(c1)C)Br 2230a_100015205234_100000210202 [0,0,0,0,0,0|4,0,0]=4 404 B12R1.385 CCNCc1ccc(c(c1)C)Br 2230a_100015525214_100000727479 [0,0,0,0,0,0|4,0,0]=4 405 B12R1.385 CCNCc1ccc(c(c1)C)Br 270004a_100015525214_100000765772 [0,0,0,0,0,0|4,0,0]=4 406 B12R1.385 CCNCc1ccc(c(c1)C)Br 34a_100015205234_100000210202 [0,0,0,0,0,0|4,0,0]=4 407 B12R1.385 CCNCc1ccc(c(c1)C)C 207a_100015525214_100000229942 [0,0,0,0,0,0|4,0,0]=4 408 B12R1.385 CCNCc1ccc(c(c1)C)C 2230a_100015525214_100000742320 [0,0,0,0,0,0|4,0,0]=4 409 B12R1.385 CCNCc1ccc(c(c1)C)C 2230a_100025706692_100000210202 [0,0,0,0,0,0|4,0,0]=4 410 B12R1.385 CCNCc1ccc(c(c1)C)C 270004a_100015525214_100000229942 [0,0,0,0,0,0|4,0,0]=4 411 B12R1.385 CCNCc1ccc(c(c1)C)C 34a_100025706692_100000210202 [0,0,0,0,0,0|4,0,0]=4 412 B12R1.385 CCNCc1ccc(c(c1)C)Cl 207a_100015525214_100000698814 [0,0,0,0,0,0|4,0,0]=4 413 B12R1.385 CCNCc1ccc(c(c1)C)Cl 2230a_100015525214_100012184735 [0,0,0,0,0,0|4,0,0]=4 414 B12R1.385 CCNCc1ccc(c(c1)C)Cl 270004a_100015525214_100000698814 [0,0,0,0,0,0|4,0,0]=4 415 B12R1.385 CCNCc1ccc(c(c1)C)F 207a_100015525214_100000748208 [0,0,0,0,0,0|4,0,0]=4 416 B12R1.385 CCNCc1ccc(c(c1)C)F 2230a_100000239911_100000210202 [0,0,0,0,0,0|4,0,0]=4 417 B12R1.385 CCNCc1ccc(c(c1)C)F 2230a_100015525214_100011216667 [0,0,0,0,0,0|4,0,0]=4 418 B12R1.385 CCNCc1ccc(c(c1)C)F 270004a_100015525214_100000748208 [0,0,0,0,0,0|4,0,0]=4 419 B12R1.385 CCNCc1ccc(c(c1)C)F 34a_100000239911_100000210202 [0,0,0,0,0,0|4,0,0]=4 420 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 207a_100015525214_100000690054 [0,0,0,0,0,0|4,0,0]=4 421 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000210202 [0,0,0,0,0,0|4,0,0]=4 422 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 2230a_100015525214_100012353895 [0,0,0,0,0,0|4,0,0]=4 423 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 270004a_100015525214_100000690054 [0,0,0,0,0,0|4,0,0]=4 424 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100000210202 [0,0,0,0,0,0|4,0,0]=4 425 B12R1.385 CCNCc1ccc(c(c1)Cl)C 207a_100015525214_100000760539 [0,0,0,0,0,0|4,0,0]=4 426 B12R1.385 CCNCc1ccc(c(c1)Cl)C 2230a_100015525214_100011823929 [0,0,0,0,0,0|4,0,0]=4 427 B12R1.385 CCNCc1ccc(c(c1)Cl)C 2230a_102495364989_100000210202 [0,0,0,0,0,0|4,0,0]=4 428 B12R1.385 CCNCc1ccc(c(c1)Cl)C 270004a_100015525214_100000760539 [0,0,0,0,0,0|4,0,0]=4 429 B12R1.385 CCNCc1ccc(c(c1)Cl)C 34a_102495364989_100000210202 [0,0,0,0,0,0|4,0,0]=4 430 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 207a_100015525214_100000188533 [0,0,0,0,0,0|4,0,0]=4 431 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000210202 [0,0,0,0,0,0|4,0,0]=4 432 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 2230a_100015525214_100000184707 [0,0,0,0,0,0|4,0,0]=4 433 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 270004a_100015525214_100000188533 [0,0,0,0,0,0|4,0,0]=4 434 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000210202 [0,0,0,0,0,0|4,0,0]=4 435 B12R1.385 CCNCc1ccc(c(c1)Cl)F 207a_100015525214_100000742290 [0,0,0,0,0,0|4,0,0]=4 436 B12R1.385 CCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000210202 [0,0,0,0,0,0|4,0,0]=4 437 B12R1.385 CCNCc1ccc(c(c1)Cl)F 2230a_100015525214_100000717365 [0,0,0,0,0,0|4,0,0]=4 438 B12R1.385 CCNCc1ccc(c(c1)Cl)F 270004a_100015525214_100000742290 [0,0,0,0,0,0|4,0,0]=4 439 B12R1.385 CCNCc1ccc(c(c1)Cl)F 34a_100000749334_100000210202 [0,0,0,0,0,0|4,0,0]=4 440 B12R1.385 CCNCc1ccc(c(c1)Cl)I 2230a_100015525214_100012349665 [0,0,0,0,0,0|4,0,0]=4 441 B12R1.385 CCNCc1ccc(c(c1)F)Br 207a_100015525214_100000686674 [0,0,0,0,0,0|4,0,0]=4 442 B12R1.385 CCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000210202 [0,0,0,0,0,0|4,0,0]=4 443 B12R1.385 CCNCc1ccc(c(c1)F)Br 2230a_100015525214_100000767054 [0,0,0,0,0,0|4,0,0]=4 444 B12R1.385 CCNCc1ccc(c(c1)F)Br 270004a_100015525214_100000686674 [0,0,0,0,0,0|4,0,0]=4 445 B12R1.385 CCNCc1ccc(c(c1)F)Br 34a_100000755036_100000210202 [0,0,0,0,0,0|4,0,0]=4 446 B12R1.385 CCNCc1ccc(c(c1)F)C 207a_100015525214_100000753222 [0,0,0,0,0,0|4,0,0]=4 447 B12R1.385 CCNCc1ccc(c(c1)F)C 2230a_100015525214_100011217369 [0,0,0,0,0,0|4,0,0]=4 448 B12R1.385 CCNCc1ccc(c(c1)F)C 2230a_100102708794_100000210202 [0,0,0,0,0,0|4,0,0]=4 449 B12R1.385 CCNCc1ccc(c(c1)F)C 270004a_100015525214_100000753222 [0,0,0,0,0,0|4,0,0]=4 450 B12R1.385 CCNCc1ccc(c(c1)F)C 34a_100102708794_100000210202 [0,0,0,0,0,0|4,0,0]=4 451 B12R1.385 CCNCc1ccc(c(c1)F)Cl 207a_100015525214_100000745630 [0,0,0,0,0,0|4,0,0]=4 452 B12R1.385 CCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000210202 [0,0,0,0,0,0|4,0,0]=4 453 B12R1.385 CCNCc1ccc(c(c1)F)Cl 2230a_100015525214_100000716492 [0,0,0,0,0,0|4,0,0]=4 454 B12R1.385 CCNCc1ccc(c(c1)F)Cl 270004a_100015525214_100000745630 [0,0,0,0,0,0|4,0,0]=4 455 B12R1.385 CCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000210202 [0,0,0,0,0,0|4,0,0]=4 456 B12R1.385 CCNCc1ccc(c(c1)F)F 207a_100015525214_100000211062 [0,0,0,0,0,0|4,0,0]=4 457 B12R1.385 CCNCc1ccc(c(c1)F)F 2230a_100000737897_100000210202 [0,0,0,0,0,0|4,0,0]=4 458 B12R1.385 CCNCc1ccc(c(c1)F)F 2230a_100015525214_100000757363 [0,0,0,0,0,0|4,0,0]=4 459 B12R1.385 CCNCc1ccc(c(c1)F)F 270004a_100015525214_100000211062 [0,0,0,0,0,0|4,0,0]=4 460 B12R1.385 CCNCc1ccc(c(c1)F)F 34a_100000737897_100000210202 [0,0,0,0,0,0|4,0,0]=4 461 B12R1.385 CCNCc1ccc(c(c1)F)I 207a_100015525214_100000050832 [0,0,0,0,0,0|4,0,0]=4 462 B12R1.385 CCNCc1ccc(c(c1)F)I 2230a_100015525214_100010149604 [0,0,0,0,0,0|4,0,0]=4 463 B12R1.385 CCNCc1ccc(c(c1)F)I 270004a_100015525214_100000050832 [0,0,0,0,0,0|4,0,0]=4 464 B12R1.385 CCNCc1ccc(c(c1)F)O 34a_100000758358_100000210202 [0,0,0,0,0,0|3,0,0]=3 465 B12R1.385 CCNCc1ccc(c(c1)I)Br 207a_100015525214_100010146563 [0,0,0,0,0,0|4,0,0]=4 466 B12R1.385 CCNCc1ccc(c(c1)I)Br 2230a_100015525214_100010146616 [0,0,0,0,0,0|4,0,0]=4 467 B12R1.385 CCNCc1ccc(c(c1)I)Br 270004a_100015525214_100010146563 [0,0,0,0,0,0|4,0,0]=4 468 B12R1.385 CCNCc1ccc(c(c1)I)C 207a_100015525214_100010197721 [0,0,0,0,0,0|4,0,0]=4 469 B12R1.385 CCNCc1ccc(c(c1)I)C 2230a_100015525214_100010206137 [0,0,0,0,0,0|4,0,0]=4 470 B12R1.385 CCNCc1ccc(c(c1)I)C 270004a_100015525214_100010197721 [0,0,0,0,0,0|4,0,0]=4 471 B12R1.385 CCNCc1ccc(c(c1)I)Cl 207a_100015525214_100010209939 [0,0,0,0,0,0|4,0,0]=4 472 B12R1.385 CCNCc1ccc(c(c1)I)Cl 270004a_100015525214_100010209939 [0,0,0,0,0,0|4,0,0]=4 473 B12R1.385 CCNCc1ccc(c(c1)I)F 207a_100015525214_100010188209 [0,0,0,0,0,0|4,0,0]=4 474 B12R1.385 CCNCc1ccc(c(c1)I)F 2230a_100015525214_100010188208 [0,0,0,0,0,0|4,0,0]=4 475 B12R1.385 CCNCc1ccc(c(c1)I)F 270004a_100015525214_100010188209 [0,0,0,0,0,0|4,0,0]=4 476 B12R1.385 CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210202 [0,0,0,0,0,0|3,0,0]=3 477 B12R1.385 CCNCc1ccc(c(c1)O)F 34a_100160469508_100000210202 [0,0,0,0,0,0|3,0,0]=3 478 B12R1.385 CCNCc1ccc(c(c1)O)O 34a_100000010075_100000210202 [0,0,0,0,0,0|2,0,0]=2 479 B12R1.385 CCNCc1cnc(c(c1)Br)O 207a_100015525214_100010064886 [0,0,0,0,0,0|4,0,0]=4 480 B12R1.385 CCNCc1cnc(c(c1)Br)O 270004a_100015525214_100010064886 [0,0,0,0,0,0|4,0,0]=4 481 B12R1.385 CCOCc1ccc(c(c1)Br)Br 34a_100121572206_100012353900 [0,0,0,0,0,0|4,0,0]=4 482 B12R1.385 CCOCc1ccc(c(c1)Br)C 34a_100000708995_100000210202 [0,0,0,0,0,0|4,0,0]=4 483 B12R1.385 CCOCc1ccc(c(c1)Br)C 34a_100121572206_100012232412 [0,0,0,0,0,0|4,0,0]=4 484 B12R1.385 CCOCc1ccc(c(c1)Br)C 7a_100000708995_100000210202 [0,0,0,0,0,0|4,0,0]=4 485 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100000210202 [0,0,0,0,0,0|4,0,0]=4 486 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 34a_100121572206_100012353894 [0,0,0,0,0,0|4,0,0]=4 487 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000210202 [0,0,0,0,0,0|4,0,0]=4 488 B12R1.385 CCOCc1ccc(c(c1)Br)F 34a_100000246287_100000210202 [0,0,0,0,0,0|4,0,0]=4 489 B12R1.385 CCOCc1ccc(c(c1)Br)F 34a_100121572206_100011206884 [0,0,0,0,0,0|4,0,0]=4 490 B12R1.385 CCOCc1ccc(c(c1)Br)F 7a_100000246287_100000210202 [0,0,0,0,0,0|4,0,0]=4 491 B12R1.385 CCOCc1ccc(c(c1)C)Br 34a_100000718852_100000210202 [0,0,0,0,0,0|4,0,0]=4 492 B12R1.385 CCOCc1ccc(c(c1)C)Br 34a_100121572206_100000727479 [0,0,0,0,0,0|4,0,0]=4 493 B12R1.385 CCOCc1ccc(c(c1)C)Br 7a_100000718852_100000210202 [0,0,0,0,0,0|4,0,0]=4 494 B12R1.385 CCOCc1ccc(c(c1)C)C 34a_100011215342_100000210202 [0,0,0,0,0,0|4,0,0]=4 495 B12R1.385 CCOCc1ccc(c(c1)C)C 34a_100121572206_100000742320 [0,0,0,0,0,0|4,0,0]=4 496 B12R1.385 CCOCc1ccc(c(c1)C)C 7a_100011215342_100000210202 [0,0,0,0,0,0|4,0,0]=4 497 B12R1.385 CCOCc1ccc(c(c1)C)Cl 34a_100121572206_100012184735 [0,0,0,0,0,0|4,0,0]=4 498 B12R1.385 CCOCc1ccc(c(c1)C)F 34a_100011219793_100000210202 [0,0,0,0,0,0|4,0,0]=4 499 B12R1.385 CCOCc1ccc(c(c1)C)F 34a_100121572206_100011216667 [0,0,0,0,0,0|4,0,0]=4 500 B12R1.385 CCOCc1ccc(c(c1)C)F 7a_100011219793_100000210202 [0,0,0,0,0,0|4,0,0]=4 501 B12R1.385 CCOCc1ccc(c(c1)C)N 34a_200011997030_100000210202 [0,0,0,0,0,0|4,0,0]=4 502 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100000210202 [0,0,0,0,0,0|4,0,0]=4 503 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 34a_100121572206_100012353895 [0,0,0,0,0,0|4,0,0]=4 504 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100000210202 [0,0,0,0,0,0|4,0,0]=4 505 B12R1.385 CCOCc1ccc(c(c1)Cl)C 34a_100011290783_100000210202 [0,0,0,0,0,0|4,0,0]=4 506 B12R1.385 CCOCc1ccc(c(c1)Cl)C 34a_100121572206_100011823929 [0,0,0,0,0,0|4,0,0]=4 507 B12R1.385 CCOCc1ccc(c(c1)Cl)C 7a_100011290783_100000210202 [0,0,0,0,0,0|4,0,0]=4 508 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100000210202 [0,0,0,0,0,0|4,0,0]=4 509 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 34a_100121572206_100000184707 [0,0,0,0,0,0|4,0,0]=4 510 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000210202 [0,0,0,0,0,0|4,0,0]=4 511 B12R1.385 CCOCc1ccc(c(c1)Cl)F 34a_100011217911_100000210202 [0,0,0,0,0,0|4,0,0]=4 512 B12R1.385 CCOCc1ccc(c(c1)Cl)F 34a_100121572206_100011934319 [0,0,0,0,0,0|4,0,0]=4 513 B12R1.385 CCOCc1ccc(c(c1)Cl)F 7a_100011217911_100000210202 [0,0,0,0,0,0|4,0,0]=4 514 B12R1.385 CCOCc1ccc(c(c1)Cl)I 34a_100000718186_100000210202 [0,0,0,0,0,0|4,0,0]=4 515 B12R1.385 CCOCc1ccc(c(c1)Cl)I 34a_100121572206_100012349665 [0,0,0,0,0,0|4,0,0]=4 516 B12R1.385 CCOCc1ccc(c(c1)Cl)I 7a_100000718186_100000210202 [0,0,0,0,0,0|4,0,0]=4 517 B12R1.385 CCOCc1ccc(c(c1)F)Br 34a_100011533735_100000210202 [0,0,0,0,0,0|4,0,0]=4 518 B12R1.385 CCOCc1ccc(c(c1)F)Br 34a_100121572206_100000767054 [0,0,0,0,0,0|4,0,0]=4 519 B12R1.385 CCOCc1ccc(c(c1)F)Br 7a_100011533735_100000210202 [0,0,0,0,0,0|4,0,0]=4 520 B12R1.385 CCOCc1ccc(c(c1)F)C 34a_100000702247_100000210202 [0,0,0,0,0,0|4,0,0]=4 521 B12R1.385 CCOCc1ccc(c(c1)F)C 34a_100121572206_100011217369 [0,0,0,0,0,0|4,0,0]=4 522 B12R1.385 CCOCc1ccc(c(c1)F)C 7a_100000702247_100000210202 [0,0,0,0,0,0|4,0,0]=4 523 B12R1.385 CCOCc1ccc(c(c1)F)Cl 34a_100011218299_100000210202 [0,0,0,0,0,0|4,0,0]=4 524 B12R1.385 CCOCc1ccc(c(c1)F)Cl 34a_100121572206_100011519011 [0,0,0,0,0,0|4,0,0]=4 525 B12R1.385 CCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000210202 [0,0,0,0,0,0|4,0,0]=4 526 B12R1.385 CCOCc1ccc(c(c1)F)F 34a_100011215442_100000210202 [0,0,0,0,0,0|4,0,0]=4 527 B12R1.385 CCOCc1ccc(c(c1)F)F 34a_100121572206_100000757363 [0,0,0,0,0,0|4,0,0]=4 528 B12R1.385 CCOCc1ccc(c(c1)F)F 7a_100011215442_100000210202 [0,0,0,0,0,0|4,0,0]=4 529 B12R1.385 CCOCc1ccc(c(c1)F)I 34a_100010149597_100000210202 [0,0,0,0,0,0|4,0,0]=4 530 B12R1.385 CCOCc1ccc(c(c1)F)I 34a_100121572206_100010149604 [0,0,0,0,0,0|4,0,0]=4 531 B12R1.385 CCOCc1ccc(c(c1)F)I 7a_100010149597_100000210202 [0,0,0,0,0,0|4,0,0]=4 532 B12R1.385 CCOCc1ccc(c(c1)F)N 34a_100011217239_100000210202 [0,0,0,0,0,0|4,0,0]=4 533 B12R1.385 CCOCc1ccc(c(c1)I)Br 34a_100121572206_100010146616 [0,0,0,0,0,0|4,0,0]=4 534 B12R1.385 CCOCc1ccc(c(c1)I)C 34a_100000050133_100000210202 [0,0,0,0,0,0|4,0,0]=4 535 B12R1.385 CCOCc1ccc(c(c1)I)C 34a_100121572206_100010206137 [0,0,0,0,0,0|4,0,0]=4 536 B12R1.385 CCOCc1ccc(c(c1)I)C 7a_100000050133_100000210202 [0,0,0,0,0,0|4,0,0]=4 537 B12R1.385 CCOCc1ccc(c(c1)I)F 34a_100000049585_100000210202 [0,0,0,0,0,0|4,0,0]=4 538 B12R1.385 CCOCc1ccc(c(c1)I)F 34a_100121572206_100010188208 [0,0,0,0,0,0|4,0,0]=4 539 B12R1.385 CCOCc1ccc(c(c1)I)F 7a_100000049585_100000210202 [0,0,0,0,0,0|4,0,0]=4 540 B12R1.385 CCOCc1ccc(c(c1)N)Br 34a_100012347568_100000210202 [0,0,0,0,0,0|4,0,0]=4 541 B12R1.385 CCOCc1ccc(c(c1)N)C 34a_100000758420_100000210202 [0,0,0,0,0,0|4,0,0]=4 542 B12R1.385 CCOCc1ccc(c(c1)N)Cl 34a_106256033963_100000210202 [0,0,0,0,0,0|4,0,0]=4 543 B12R1.385 CCOCc1ccc(c(c1)N)F 34a_102125399562_100000210202 [0,0,0,0,0,0|4,0,0]=4 544 B12R1.385 CCSCc1cc(=O)c(co1)O 62a_100000210202_100000010605 [0,0,0,0,0,0|3,0,1]=4 545 B12R1.385 CCSCc1ccc(c(c1)Br)Br 62a_100000210202_100012353900 [0,0,0,0,0,0|4,0,0]=4 546 B12R1.385 CCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000210202 [0,0,0,0,0,0|4,0,0]=4 547 B12R1.385 CCSCc1ccc(c(c1)Br)C 62a_100000210202_100012232412 [0,0,0,0,0,0|4,0,0]=4 548 B12R1.385 CCSCc1ccc(c(c1)Br)C 62a_100012232412_100000210202 [0,0,0,0,0,0|4,0,0]=4 549 B12R1.385 CCSCc1ccc(c(c1)Br)Cl 62a_100000210202_100012353894 [0,0,0,0,0,0|4,0,0]=4 550 B12R1.385 CCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000210202 [0,0,0,0,0,0|4,0,0]=4 551 B12R1.385 CCSCc1ccc(c(c1)Br)F 62a_100000210202_100011206884 [0,0,0,0,0,0|4,0,0]=4 552 B12R1.385 CCSCc1ccc(c(c1)Br)F 62a_100011206884_100000210202 [0,0,0,0,0,0|4,0,0]=4 553 B12R1.385 CCSCc1ccc(c(c1)C)Br 62a_100000210202_100000727479 [0,0,0,0,0,0|4,0,0]=4 554 B12R1.385 CCSCc1ccc(c(c1)C)Br 62a_100000727479_100000210202 [0,0,0,0,0,0|4,0,0]=4 555 B12R1.385 CCSCc1ccc(c(c1)C)C 62a_100000210202_100000742320 [0,0,0,0,0,0|4,0,0]=4 556 B12R1.385 CCSCc1ccc(c(c1)C)C 62a_100000742320_100000210202 [0,0,0,0,0,0|4,0,0]=4 557 B12R1.385 CCSCc1ccc(c(c1)C)Cl 62a_100000210202_100012184735 [0,0,0,0,0,0|4,0,0]=4 558 B12R1.385 CCSCc1ccc(c(c1)C)Cl 62a_100012184735_100000210202 [0,0,0,0,0,0|4,0,0]=4 559 B12R1.385 CCSCc1ccc(c(c1)C)F 62a_100000210202_100011216667 [0,0,0,0,0,0|4,0,0]=4 560 B12R1.385 CCSCc1ccc(c(c1)C)F 62a_100011216667_100000210202 [0,0,0,0,0,0|4,0,0]=4 561 B12R1.385 CCSCc1ccc(c(c1)Cl)Br 62a_100000210202_100012353895 [0,0,0,0,0,0|4,0,0]=4 562 B12R1.385 CCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000210202 [0,0,0,0,0,0|4,0,0]=4 563 B12R1.385 CCSCc1ccc(c(c1)Cl)C 62a_100000210202_100011823929 [0,0,0,0,0,0|4,0,0]=4 564 B12R1.385 CCSCc1ccc(c(c1)Cl)C 62a_100011823929_100000210202 [0,0,0,0,0,0|4,0,0]=4 565 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000210202 [0,0,0,0,0,0|4,0,0]=4 566 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl 62a_100000210202_100000184707 [0,0,0,0,0,0|4,0,0]=4 567 B12R1.385 CCSCc1ccc(c(c1)Cl)F 62a_100000210202_100011934319 [0,0,0,0,0,0|4,0,0]=4 568 B12R1.385 CCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000210202 [0,0,0,0,0,0|4,0,0]=4 569 B12R1.385 CCSCc1ccc(c(c1)Cl)I 62a_100000210202_100012349665 [0,0,0,0,0,0|4,0,0]=4 570 B12R1.385 CCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000210202 [0,0,0,0,0,0|4,0,0]=4 571 B12R1.385 CCSCc1ccc(c(c1)F)Br 62a_100000210202_100000767054 [0,0,0,0,0,0|4,0,0]=4 572 B12R1.385 CCSCc1ccc(c(c1)F)Br 62a_100000767054_100000210202 [0,0,0,0,0,0|4,0,0]=4 573 B12R1.385 CCSCc1ccc(c(c1)F)C 62a_100000210202_100011217369 [0,0,0,0,0,0|4,0,0]=4 574 B12R1.385 CCSCc1ccc(c(c1)F)C 62a_100011217369_100000210202 [0,0,0,0,0,0|4,0,0]=4 575 B12R1.385 CCSCc1ccc(c(c1)F)Cl 62a_100000210202_100000716492 [0,0,0,0,0,0|4,0,0]=4 576 B12R1.385 CCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000210202 [0,0,0,0,0,0|4,0,0]=4 577 B12R1.385 CCSCc1ccc(c(c1)F)F 62a_100000210202_100000757363 [0,0,0,0,0,0|4,0,0]=4 578 B12R1.385 CCSCc1ccc(c(c1)F)F 62a_100000757363_100000210202 [0,0,0,0,0,0|4,0,0]=4 579 B12R1.385 CCSCc1ccc(c(c1)F)I 62a_100000210202_100010149604 [0,0,0,0,0,0|4,0,0]=4 580 B12R1.385 CCSCc1ccc(c(c1)F)I 62a_100010149604_100000210202 [0,0,0,0,0,0|4,0,0]=4 581 B12R1.385 CCSCc1ccc(c(c1)I)Br 62a_100000210202_100010146616 [0,0,0,0,0,0|4,0,0]=4 582 B12R1.385 CCSCc1ccc(c(c1)I)Br 62a_100010146616_100000210202 [0,0,0,0,0,0|4,0,0]=4 583 B12R1.385 CCSCc1ccc(c(c1)I)C 62a_100000210202_100010206137 [0,0,0,0,0,0|4,0,0]=4 584 B12R1.385 CCSCc1ccc(c(c1)I)C 62a_100010206137_100000210202 [0,0,0,0,0,0|4,0,0]=4 585 B12R1.385 CCSCc1ccc(c(c1)I)F 62a_100000210202_100010188208 [0,0,0,0,0,0|4,0,0]=4 586 B12R1.385 CCSCc1ccc(c(c1)I)F 62a_100010188208_100000210202 [0,0,0,0,0,0|4,0,0]=4 587 B12R1.385 CNCCc1ccc(c(c1)C)C 2230a_100020591374_200000210301 [0,0,0,0,0,0|2,0,0]=2 588 B12R1.385 CNCCc1ccc(c(c1)C)C 34a_100020591374_200000210301 [0,0,0,0,0,0|2,0,0]=2 589 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200000210301 [0,0,0,0,0,0|2,0,0]=2 590 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100011713676 [0,0,0,0,0,0|2,0,0]=2 591 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200000210301 [0,0,0,0,0,0|2,0,0]=2 592 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 34a_100102657272_100011713676 [0,0,0,0,0,0|2,0,0]=2 593 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 7a_106832991635_100011713676 [0,0,0,0,0,0|2,0,0]=2 594 B12R1.385 CNCCc1ccc(c(c1)Cl)F 2230a_106832991635_100012361305 [0,0,0,0,0,0|2,0,0]=2 595 B12R1.385 CNCCc1ccc(c(c1)Cl)F 2230a_200011997520_200000210301 [0,0,0,0,0,0|2,0,0]=2 596 B12R1.385 CNCCc1ccc(c(c1)Cl)F 34a_100102657272_100012361305 [0,0,0,0,0,0|2,0,0]=2 597 B12R1.385 CNCCc1ccc(c(c1)Cl)F 34a_200011997520_200000210301 [0,0,0,0,0,0|2,0,0]=2 598 B12R1.385 CNCCc1ccc(c(c1)Cl)F 7a_106832991635_100012361305 [0,0,0,0,0,0|2,0,0]=2 599 B12R1.385 CNCCc1ccc(c(c1)F)F 2230a_106832991635_100000690553 [0,0,0,0,0,0|2,0,0]=2 600 B12R1.385 CNCCc1ccc(c(c1)F)F 2230a_200000706328_200000210301 [0,0,0,0,0,0|2,0,0]=2 601 B12R1.385 CNCCc1ccc(c(c1)F)F 34a_100102657272_100000690553 [0,0,0,0,0,0|2,0,0]=2 602 B12R1.385 CNCCc1ccc(c(c1)F)F 34a_200000706328_200000210301 [0,0,0,0,0,0|2,0,0]=2 603 B12R1.385 CNCCc1ccc(c(c1)F)F 7a_106832991635_100000690553 [0,0,0,0,0,0|2,0,0]=2 604 B12R1.385 CNCCc1ccc(c(c1)O)O 34a_100000210387_200000210301 [0,0,0,0,0,0|0,0,0]=0 605 B12R1.385 CNCCc1ccc(c(c1)O)O 7a_106832991635_200010393615 [0,0,0,0,0,0|0,0,0]=0 606 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 34a_100011709245_200000210301 [0,0,0,0,0,0|3,0,0]=3 607 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 34a_100138415774_100011713676 [0,0,0,0,0,0|3,0,0]=3 608 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 7a_100011709245_200000210301 [0,0,0,0,0,0|3,0,0]=3 609 B12R1.385 COCCc1ccc(c(c1)Cl)F 34a_100011830478_200000210301 [0,0,0,0,0,0|3,0,0]=3 610 B12R1.385 COCCc1ccc(c(c1)Cl)F 34a_100138415774_100012361305 [0,0,0,0,0,0|3,0,0]=3 611 B12R1.385 COCCc1ccc(c(c1)Cl)F 7a_100011830478_200000210301 [0,0,0,0,0,0|3,0,0]=3 612 B12R1.385 COCCc1ccc(c(c1)F)Br 34a_100012921202_200000210301 [0,0,0,0,0,0|3,0,0]=3 613 B12R1.385 COCCc1ccc(c(c1)F)Br 7a_100012921202_200000210301 [0,0,0,0,0,0|3,0,0]=3 614 B12R1.385 COCCc1ccc(c(c1)F)Cl 34a_100011934464_200000210301 [0,0,0,0,0,0|3,0,0]=3 615 B12R1.385 COCCc1ccc(c(c1)F)Cl 7a_100011934464_200000210301 [0,0,0,0,0,0|3,0,0]=3 616 B12R1.385 COCCc1ccc(c(c1)F)F 34a_100000690376_200000210301 [0,0,0,0,0,0|3,0,0]=3 617 B12R1.385 COCCc1ccc(c(c1)F)F 34a_100138415774_100000690553 [0,0,0,0,0,0|3,0,0]=3 618 B12R1.385 COCCc1ccc(c(c1)F)F 7a_100000690376_200000210301 [0,0,0,0,0,0|3,0,0]=3 619 B12R1.385 COCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000766300 [0,0,0,0,0,0|4,0,0]=4 620 B12R1.385 COCNc1ccc(c(c1)Br)C 2230a_100000736455_100000766300 [0,0,0,0,0,0|4,0,0]=4 621 B12R1.385 COCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000766300 [0,0,0,0,0,0|4,0,0]=4 622 B12R1.385 COCNc1ccc(c(c1)Br)F 2230a_100000760356_100000766300 [0,0,0,0,0,0|4,0,0]=4 623 B12R1.385 COCNc1ccc(c(c1)C)Br 2230a_100000210723_100000766300 [0,0,0,0,0,0|4,0,0]=4 624 B12R1.385 COCNc1ccc(c(c1)C)C 2230a_100000724040_100000766300 [0,0,0,0,0,0|4,0,0]=4 625 B12R1.385 COCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000766300 [0,0,0,0,0,0|4,0,0]=4 626 B12R1.385 COCNc1ccc(c(c1)C)F 2230a_100000750164_100000766300 [0,0,0,0,0,0|4,0,0]=4 627 B12R1.385 COCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000766300 [0,0,0,0,0,0|4,0,0]=4 628 B12R1.385 COCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000766300 [0,0,0,0,0,0|4,0,0]=4 629 B12R1.385 COCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000766300 [0,0,0,0,0,0|4,0,0]=4 630 B12R1.385 COCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000766300 [0,0,0,0,0,0|4,0,0]=4 631 B12R1.385 COCNc1ccc(c(c1)F)Br 2230a_100000759894_100000766300 [0,0,0,0,0,0|4,0,0]=4 632 B12R1.385 COCNc1ccc(c(c1)F)C 2230a_100000210958_100000766300 [0,0,0,0,0,0|4,0,0]=4 633 B12R1.385 COCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000766300 [0,0,0,0,0,0|4,0,0]=4 634 B12R1.385 COCNc1ccc(c(c1)F)F 2230a_100000210724_100000766300 [0,0,0,0,0,0|4,0,0]=4 635 B12R1.385 COCOc1ccc(c(c1)F)O 271570a_203496583355_100012265695 [0,0,0,0,0,0|3,0,0]=3 636 B12R1.385 COCOc1ccc(c(c1)O)C 271570a_203496583355_200015918306 [0,0,0,0,0,0|3,0,0]=3 637 B12R1.385 COCSc1c[nH]c(=O)c(c1)O 62a_100000766300_100009814561 [0,0,0,0,0,0|3,0,1]=4 638 B12R1.385 COCSc1cc(c(cn1)C)O 62a_100000704368_100000766300 [0,0,0,0,0,0|4,0,0]=4 639 B12R1.385 COCSc1cc(c(cn1)C)O 62a_100000766300_100000704368 [0,0,0,0,0,0|4,0,0]=4 640 B12R1.385 COCSc1cc(c(cn1)F)O 62a_100000766300_100009854642 [0,0,0,0,0,0|4,0,0]=4 641 B12R1.385 COCSc1cc(c(cn1)F)O 62a_100009854642_100000766300 [0,0,0,0,0,0|4,0,0]=4 642 B12R1.385 COCSc1cc(c(cn1)O)C 62a_100000766300_100000692680 [0,0,0,0,0,0|4,0,0]=4 643 B12R1.385 COCSc1cc(c(cn1)O)N 62a_100000766300_100009819941 [0,0,0,0,0,0|4,0,0]=4 644 B12R1.385 COCSc1cc(c(cn1)O)N 62a_100009819941_100000766300 [0,0,0,0,0,0|4,0,0]=4 645 B12R1.385 COCSc1ccc(c(c1)Br)Br 62a_100000766300_100012356285 [0,0,0,0,0,0|4,0,0]=4 646 B12R1.385 COCSc1ccc(c(c1)Br)Br 62a_100012356285_100000766300 [0,0,0,0,0,0|4,0,0]=4 647 B12R1.385 COCSc1ccc(c(c1)Br)C 62a_100000766300_100011847877 [0,0,0,0,0,0|4,0,0]=4 648 B12R1.385 COCSc1ccc(c(c1)Br)C 62a_100011847877_100000766300 [0,0,0,0,0,0|4,0,0]=4 649 B12R1.385 COCSc1ccc(c(c1)Br)Cl 62a_100000766300_100012353702 [0,0,0,0,0,0|4,0,0]=4 650 B12R1.385 COCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000766300 [0,0,0,0,0,0|4,0,0]=4 651 B12R1.385 COCSc1ccc(c(c1)Br)F 62a_100000766300_100012047266 [0,0,0,0,0,0|4,0,0]=4 652 B12R1.385 COCSc1ccc(c(c1)Br)F 62a_100012047266_100000766300 [0,0,0,0,0,0|4,0,0]=4 653 B12R1.385 COCSc1ccc(c(c1)Br)N 62a_100000750455_100000766300 [0,0,0,0,0,0|4,0,0]=4 654 B12R1.385 COCSc1ccc(c(c1)Br)N 62a_100000766300_100000750455 [0,0,0,0,0,0|4,0,0]=4 655 B12R1.385 COCSc1ccc(c(c1)Br)O 62a_100000766300_100012361655 [0,0,0,0,0,0|3,0,0]=3 656 B12R1.385 COCSc1ccc(c(c1)Br)O 62a_100012361655_100000766300 [0,0,0,0,0,0|3,0,0]=3 657 B12R1.385 COCSc1ccc(c(c1)C)Br 62a_100000766300_100009813585 [0,0,0,0,0,0|4,0,0]=4 658 B12R1.385 COCSc1ccc(c(c1)C)Br 62a_100009813585_100000766300 [0,0,0,0,0,0|4,0,0]=4 659 B12R1.385 COCSc1ccc(c(c1)C)C 62a_100000766300_100011215607 [0,0,0,0,0,0|4,0,0]=4 660 B12R1.385 COCSc1ccc(c(c1)C)C 62a_100011215607_100000766300 [0,0,0,0,0,0|4,0,0]=4 661 B12R1.385 COCSc1ccc(c(c1)C)Cl 62a_100000049509_100000766300 [0,0,0,0,0,0|4,0,0]=4 662 B12R1.385 COCSc1ccc(c(c1)C)Cl 62a_100000766300_100000049509 [0,0,0,0,0,0|4,0,0]=4 663 B12R1.385 COCSc1ccc(c(c1)C)F 62a_100000766300_100011218330 [0,0,0,0,0,0|4,0,0]=4 664 B12R1.385 COCSc1ccc(c(c1)C)F 62a_100011218330_100000766300 [0,0,0,0,0,0|4,0,0]=4 665 B12R1.385 COCSc1ccc(c(c1)C)N 62a_100000211769_100000766300 [0,0,0,0,0,0|4,0,0]=4 666 B12R1.385 COCSc1ccc(c(c1)C)N 62a_100000766300_100000211769 [0,0,0,0,0,0|4,0,0]=4 667 B12R1.385 COCSc1ccc(c(c1)C)O 62a_100000766300_100000186361 [0,0,0,0,0,0|3,0,0]=3 668 B12R1.385 COCSc1ccc(c(c1)Cl)Br 62a_100000766300_100012047281 [0,0,0,0,0,0|4,0,0]=4 669 B12R1.385 COCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000766300 [0,0,0,0,0,0|4,0,0]=4 670 B12R1.385 COCSc1ccc(c(c1)Cl)C 62a_100000766300_100011216363 [0,0,0,0,0,0|4,0,0]=4 671 B12R1.385 COCSc1ccc(c(c1)Cl)C 62a_100011216363_100000766300 [0,0,0,0,0,0|4,0,0]=4 672 B12R1.385 COCSc1ccc(c(c1)Cl)Cl 62a_100000766300_100011214914 [0,0,0,0,0,0|4,0,0]=4 673 B12R1.385 COCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000766300 [0,0,0,0,0,0|4,0,0]=4 674 B12R1.385 COCSc1ccc(c(c1)Cl)F 62a_100000766300_100011215976 [0,0,0,0,0,0|4,0,0]=4 675 B12R1.385 COCSc1ccc(c(c1)Cl)F 62a_100011215976_100000766300 [0,0,0,0,0,0|4,0,0]=4 676 B12R1.385 COCSc1ccc(c(c1)Cl)N 62a_100000766300_100011218065 [0,0,0,0,0,0|4,0,0]=4 677 B12R1.385 COCSc1ccc(c(c1)Cl)N 62a_100011218065_100000766300 [0,0,0,0,0,0|4,0,0]=4 678 B12R1.385 COCSc1ccc(c(c1)Cl)O 62a_100000766300_100012360047 [0,0,0,0,0,0|3,0,0]=3 679 B12R1.385 COCSc1ccc(c(c1)Cl)O 62a_100012360047_100000766300 [0,0,0,0,0,0|3,0,0]=3 680 B12R1.385 COCSc1ccc(c(c1)F)Br 62a_100000685389_100000766300 [0,0,0,0,0,0|4,0,0]=4 681 B12R1.385 COCSc1ccc(c(c1)F)Br 62a_100000766300_100000685389 [0,0,0,0,0,0|4,0,0]=4 682 B12R1.385 COCSc1ccc(c(c1)F)C 62a_100000720648_100000766300 [0,0,0,0,0,0|4,0,0]=4 683 B12R1.385 COCSc1ccc(c(c1)F)C 62a_100000766300_100000720648 [0,0,0,0,0,0|4,0,0]=4 684 B12R1.385 COCSc1ccc(c(c1)F)Cl 62a_100000766300_100011216805 [0,0,0,0,0,0|4,0,0]=4 685 B12R1.385 COCSc1ccc(c(c1)F)Cl 62a_100011216805_100000766300 [0,0,0,0,0,0|4,0,0]=4 686 B12R1.385 COCSc1ccc(c(c1)F)F 62a_100000703953_100000766300 [0,0,0,0,0,0|4,0,0]=4 687 B12R1.385 COCSc1ccc(c(c1)F)F 62a_100000766300_100000703953 [0,0,0,0,0,0|4,0,0]=4 688 B12R1.385 COCSc1ccc(c(c1)F)N 62a_100000766300_100011215594 [0,0,0,0,0,0|4,0,0]=4 689 B12R1.385 COCSc1ccc(c(c1)F)N 62a_100011215594_100000766300 [0,0,0,0,0,0|4,0,0]=4 690 B12R1.385 COCSc1ccc(c(c1)F)O 62a_100000185481_100000766300 [0,0,0,0,0,0|3,0,0]=3 691 B12R1.385 COCSc1ccc(c(c1)F)O 62a_100000766300_100000185481 [0,0,0,0,0,0|3,0,0]=3 692 B12R1.385 COCSc1ccc(c(c1)N)Br 62a_100000750456_100000766300 [0,0,0,0,0,0|4,0,0]=4 693 B12R1.385 COCSc1ccc(c(c1)N)Br 62a_100000766300_100000750456 [0,0,0,0,0,0|4,0,0]=4 694 B12R1.385 COCSc1ccc(c(c1)N)C 62a_100000761890_100000766300 [0,0,0,0,0,0|4,0,0]=4 695 B12R1.385 COCSc1ccc(c(c1)N)C 62a_100000766300_100000761890 [0,0,0,0,0,0|4,0,0]=4 696 B12R1.385 COCSc1ccc(c(c1)N)Cl 62a_100000766300_200000761891 [0,0,0,0,0,0|4,0,0]=4 697 B12R1.385 COCSc1ccc(c(c1)N)Cl 62a_200000761891_100000766300 [0,0,0,0,0,0|4,0,0]=4 698 B12R1.385 COCSc1ccc(c(c1)N)F 62a_100000740924_100000766300 [0,0,0,0,0,0|4,0,0]=4 699 B12R1.385 COCSc1ccc(c(c1)N)F 62a_100000766300_100000740924 [0,0,0,0,0,0|4,0,0]=4 700 B12R1.385 COCSc1ccc(c(c1)N)N 62a_100000741789_100000766300 [0,0,0,0,0,0|4,0,0]=4 701 B12R1.385 COCSc1ccc(c(c1)N)N 62a_100000766300_100011534411 [0,0,0,0,0,0|4,0,0]=4 702 B12R1.385 COCSc1ccc(c(c1)N)O 62a_100000752626_100000766300 [0,0,0,0,0,0|3,0,0]=3 703 B12R1.385 COCSc1ccc(c(c1)N)O 62a_100000766300_100000752626 [0,0,0,0,0,0|3,0,0]=3 704 B12R1.385 COCSc1ccc(c(c1)O)Br 62a_100000766300_100012356990 [0,0,0,0,0,0|3,0,0]=3 705 B12R1.385 COCSc1ccc(c(c1)O)Br 62a_100012356990_100000766300 [0,0,0,0,0,0|3,0,0]=3 706 B12R1.385 COCSc1ccc(c(c1)O)C 62a_100000685420_100000766300 [0,0,0,0,0,0|3,0,0]=3 707 B12R1.385 COCSc1ccc(c(c1)O)C 62a_100000766300_100000685420 [0,0,0,0,0,0|3,0,0]=3 708 B12R1.385 COCSc1ccc(c(c1)O)Cl 62a_100000766300_100011356854 [0,0,0,0,0,0|3,0,0]=3 709 B12R1.385 COCSc1ccc(c(c1)O)Cl 62a_100011356854_100000766300 [0,0,0,0,0,0|3,0,0]=3 710 B12R1.385 COCSc1ccc(c(c1)O)F 62a_100000686035_100000766300 [0,0,0,0,0,0|3,0,0]=3 711 B12R1.385 COCSc1ccc(c(c1)O)F 62a_100000766300_100000686035 [0,0,0,0,0,0|3,0,0]=3 712 B12R1.385 COCSc1ccc(c(c1)O)N 62a_100000739049_100000766300 [0,0,0,0,0,0|3,0,0]=3 713 B12R1.385 COCSc1ccc(c(c1)O)N 62a_100000766300_100000739049 [0,0,0,0,0,0|3,0,0]=3 714 B12R1.385 COCSc1ccc(c(c1)O)O 62a_100000766300_100009813601 [0,0,0,0,0,0|2,0,0]=2 715 B12R1.385 COCSc1ccc(c(n1)Br)O 62a_100000725334_100000766300 [0,0,0,0,0,0|4,0,0]=4 716 B12R1.385 COCSc1ccc(c(n1)Br)O 62a_100000766300_100000725334 [0,0,0,0,0,0|4,0,0]=4 717 B12R1.385 COCSc1ccc(c(n1)C)O 62a_100000766300_100010233687 [0,0,0,0,0,0|4,0,0]=4 718 B12R1.385 COCSc1ccc(c(n1)C)O 62a_100010233687_100000766300 [0,0,0,0,0,0|4,0,0]=4 719 B12R1.385 COCSc1ccc(c(n1)Cl)O 62a_100000766300_100000721234 [0,0,0,0,0,0|4,0,0]=4 720 B12R1.385 COCSc1ccc(c(n1)F)O 62a_100000766300_100009819667 [0,0,0,0,0,0|4,0,0]=4 721 B12R1.385 COCSc1ccc(c(n1)F)O 62a_100009819667_100000766300 [0,0,0,0,0,0|4,0,0]=4 722 B12R1.385 COCSc1ccc(c(n1)N)O 62a_100000685527_100000766300 [0,0,0,0,0,0|4,0,0]=4 723 B12R1.385 COCSc1ccc(c(n1)N)O 62a_100000766300_100000685527 [0,0,0,0,0,0|4,0,0]=4 724 B12R1.385 COCSc1ccc(c(n1)O)F 62a_100000766300_100010729010 [0,0,0,0,0,0|4,0,0]=4 725 B12R1.385 COCSc1ccc(c(n1)O)N 62a_100000718904_100000766300 [0,0,0,0,0,0|4,0,0]=4 726 B12R1.385 COCSc1cnc(c(c1)C)O 62a_100000685391_100000766300 [0,0,0,0,0,0|4,0,0]=4 727 B12R1.385 COCSc1cnc(c(c1)C)O 62a_100000766300_100000685391 [0,0,0,0,0,0|4,0,0]=4 728 B12R1.385 COCSc1cnc(c(c1)Cl)O 62a_100000766300_100010238531 [0,0,0,0,0,0|4,0,0]=4 729 B12R1.385 COCSc1cnc(c(c1)Cl)O 62a_100010238531_100000766300 [0,0,0,0,0,0|4,0,0]=4 730 B12R1.385 COCSc1cnc(c(c1)N)O 62a_100000743729_100000766300 [0,0,0,0,0,0|4,0,0]=4 731 B12R1.385 COCSc1cnc(c(c1)N)O 62a_100000766300_100000743729 [0,0,0,0,0,0|4,0,0]=4 732 B12R1.385 COCSc1cnc(c(c1)O)C 62a_100000766300_100009864810 [0,0,0,0,0,0|4,0,0]=4 733 B12R1.385 COCSc1cnc(c(c1)O)C 62a_100009864810_100000766300 [0,0,0,0,0,0|4,0,0]=4 734 B12R1.385 COCSc1cnc(c(c1)O)F 62a_100000766300_100009819871 [0,0,0,0,0,0|4,0,0]=4 735 B12R1.385 COCSc1cnc(c(c1)O)F 62a_100009819871_100000766300 [0,0,0,0,0,0|4,0,0]=4 736 B12R1.385 COCSc1cnc(c(c1)O)N 62a_100000766300_100009819042 [0,0,0,0,0,0|4,0,0]=4 737 B12R1.385 COCSc1cnc(c(c1)O)N 62a_100009819042_100000766300 [0,0,0,0,0,0|4,0,0]=4 738 B12R1.385 CSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_200000210301 [0,0,0,0,0,0|3,0,0]=3 739 B12R1.385 CSCCc1ccc(c(c1)Cl)Cl 62a_200000210301_100011713676 [0,0,0,0,0,0|3,0,0]=3 740 B12R1.385 CSCCc1ccc(c(c1)Cl)F 62a_100012361305_200000210301 [0,0,0,0,0,0|3,0,0]=3 741 B12R1.385 CSCCc1ccc(c(c1)Cl)F 62a_200000210301_100012361305 [0,0,0,0,0,0|3,0,0]=3 742 B12R1.385 CSCCc1ccc(c(c1)F)F 62a_100000690553_200000210301 [0,0,0,0,0,0|3,0,0]=3 743 B12R1.385 CSCCc1ccc(c(c1)F)F 62a_200000210301_100000690553 [0,0,0,0,0,0|3,0,0]=3 744 B12R1.385 CSCCc1ccc(c(c1)O)O 62a_200000210301_200010393615 [0,0,0,0,0,0|1,0,0]=1 745 B12R1.385 CSCNc1ccc(c(c1)Br)Br 2230a_100011306057_100011218213 [0,0,0,0,0,0|4,0,0]=4 746 B12R1.385 CSCNc1ccc(c(c1)Br)Br 34a_100011306057_100011218213 [0,0,0,0,0,0|4,0,0]=4 747 B12R1.385 CSCNc1ccc(c(c1)Br)C 2230a_100000736455_100011218213 [0,0,0,0,0,0|4,0,0]=4 748 B12R1.385 CSCNc1ccc(c(c1)Br)C 34a_100000736455_100011218213 [0,0,0,0,0,0|4,0,0]=4 749 B12R1.385 CSCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100011218213 [0,0,0,0,0,0|4,0,0]=4 750 B12R1.385 CSCNc1ccc(c(c1)Br)Cl 34a_100000686031_100011218213 [0,0,0,0,0,0|4,0,0]=4 751 B12R1.385 CSCNc1ccc(c(c1)Br)F 2230a_100000760356_100011218213 [0,0,0,0,0,0|4,0,0]=4 752 B12R1.385 CSCNc1ccc(c(c1)Br)F 34a_100000760356_100011218213 [0,0,0,0,0,0|4,0,0]=4 753 B12R1.385 CSCNc1ccc(c(c1)Br)I 34a_100000750458_100011218213 [0,0,0,0,0,0|4,0,0]=4 754 B12R1.385 CSCNc1ccc(c(c1)Br)O 34a_100011534360_100011218213 [0,0,0,0,0,0|3,0,0]=3 755 B12R1.385 CSCNc1ccc(c(c1)C)Br 2230a_100000210723_100011218213 [0,0,0,0,0,0|4,0,0]=4 756 B12R1.385 CSCNc1ccc(c(c1)C)Br 34a_100000210723_100011218213 [0,0,0,0,0,0|4,0,0]=4 757 B12R1.385 CSCNc1ccc(c(c1)C)C 2230a_100000724040_100011218213 [0,0,0,0,0,0|4,0,0]=4 758 B12R1.385 CSCNc1ccc(c(c1)C)C 34a_100000724040_100011218213 [0,0,0,0,0,0|4,0,0]=4 759 B12R1.385 CSCNc1ccc(c(c1)C)Cl 2230a_100000187808_100011218213 [0,0,0,0,0,0|4,0,0]=4 760 B12R1.385 CSCNc1ccc(c(c1)C)Cl 34a_100000187808_100011218213 [0,0,0,0,0,0|4,0,0]=4 761 B12R1.385 CSCNc1ccc(c(c1)C)F 2230a_100000750164_100011218213 [0,0,0,0,0,0|4,0,0]=4 762 B12R1.385 CSCNc1ccc(c(c1)C)F 34a_100000750164_100011218213 [0,0,0,0,0,0|4,0,0]=4 763 B12R1.385 CSCNc1ccc(c(c1)C)I 34a_100000198070_100011218213 [0,0,0,0,0,0|4,0,0]=4 764 B12R1.385 CSCNc1ccc(c(c1)C)O 34a_100011218179_100011218213 [0,0,0,0,0,0|3,0,0]=3 765 B12R1.385 CSCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100011218213 [0,0,0,0,0,0|4,0,0]=4 766 B12R1.385 CSCNc1ccc(c(c1)Cl)Br 34a_100000687081_100011218213 [0,0,0,0,0,0|4,0,0]=4 767 B12R1.385 CSCNc1ccc(c(c1)Cl)C 2230a_100000188892_100011218213 [0,0,0,0,0,0|4,0,0]=4 768 B12R1.385 CSCNc1ccc(c(c1)Cl)C 34a_100000188892_100011218213 [0,0,0,0,0,0|4,0,0]=4 769 B12R1.385 CSCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100011218213 [0,0,0,0,0,0|4,0,0]=4 770 B12R1.385 CSCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100011218213 [0,0,0,0,0,0|4,0,0]=4 771 B12R1.385 CSCNc1ccc(c(c1)Cl)F 2230a_100000211060_100011218213 [0,0,0,0,0,0|4,0,0]=4 772 B12R1.385 CSCNc1ccc(c(c1)Cl)F 34a_100000211060_100011218213 [0,0,0,0,0,0|4,0,0]=4 773 B12R1.385 CSCNc1ccc(c(c1)Cl)I 34a_100000761885_100011218213 [0,0,0,0,0,0|4,0,0]=4 774 B12R1.385 CSCNc1ccc(c(c1)Cl)O 34a_100000744943_100011218213 [0,0,0,0,0,0|3,0,0]=3 775 B12R1.385 CSCNc1ccc(c(c1)F)Br 2230a_100000759894_100011218213 [0,0,0,0,0,0|4,0,0]=4 776 B12R1.385 CSCNc1ccc(c(c1)F)Br 34a_100000759894_100011218213 [0,0,0,0,0,0|4,0,0]=4 777 B12R1.385 CSCNc1ccc(c(c1)F)C 2230a_100000210958_100011218213 [0,0,0,0,0,0|4,0,0]=4 778 B12R1.385 CSCNc1ccc(c(c1)F)C 34a_100000210958_100011218213 [0,0,0,0,0,0|4,0,0]=4 779 B12R1.385 CSCNc1ccc(c(c1)F)Cl 2230a_100000739366_100011218213 [0,0,0,0,0,0|4,0,0]=4 780 B12R1.385 CSCNc1ccc(c(c1)F)Cl 34a_100000739366_100011218213 [0,0,0,0,0,0|4,0,0]=4 781 B12R1.385 CSCNc1ccc(c(c1)F)F 2230a_100000210724_100011218213 [0,0,0,0,0,0|4,0,0]=4 782 B12R1.385 CSCNc1ccc(c(c1)F)F 34a_100000210724_100011218213 [0,0,0,0,0,0|4,0,0]=4 783 B12R1.385 CSCNc1ccc(c(c1)F)I 34a_100011356925_100011218213 [0,0,0,0,0,0|4,0,0]=4 784 B12R1.385 CSCNc1ccc(c(c1)F)O 34a_100011220035_100011218213 [0,0,0,0,0,0|3,0,0]=3 785 B12R1.385 CSCNc1ccc(c(c1)I)Br 34a_100000750459_100011218213 [0,0,0,0,0,0|4,0,0]=4 786 B12R1.385 CSCNc1ccc(c(c1)I)C 34a_100000184131_100011218213 [0,0,0,0,0,0|4,0,0]=4 787 B12R1.385 CSCNc1ccc(c(c1)I)Cl 34a_100012360549_100011218213 [0,0,0,0,0,0|4,0,0]=4 788 B12R1.385 CSCNc1ccc(c(c1)I)F 34a_114828291077_100011218213 [0,0,0,0,0,0|4,0,0]=4 789 B12R1.385 CSCNc1ccc(c(c1)O)C 34a_100000759471_100011218213 [0,0,0,0,0,0|3,0,0]=3 790 B12R1.385 CSCNc1ccc(c(c1)O)Cl 34a_100011934209_100011218213 [0,0,0,0,0,0|3,0,0]=3 791 B12R1.385 CSCNc1ccc(c(c1)O)F 34a_100012017398_100011218213 [0,0,0,0,0,0|3,0,0]=3 792 B12R1.385 CSCNc1ccc(c(c1)O)O 34a_100102946323_100011218213 [0,0,0,0,0,0|2,0,0]=2 793 B12R1.385 CSCOc1ccc(c(c1)Br)C 34a_100011380479_100011218213 [0,0,0,0,0,0|4,0,0]=4 794 B12R1.385 CSCOc1ccc(c(c1)Br)Cl 34a_100011933957_100011218213 [0,0,0,0,0,0|4,0,0]=4 795 B12R1.385 CSCOc1ccc(c(c1)Br)F 34a_100000693481_100011218213 [0,0,0,0,0,0|4,0,0]=4 796 B12R1.385 CSCOc1ccc(c(c1)Br)I 34a_100000701344_100011218213 [0,0,0,0,0,0|4,0,0]=4 797 B12R1.385 CSCOc1ccc(c(c1)Br)N 34a_100012001276_100011218213 [0,0,0,0,0,0|4,0,0]=4 798 B12R1.385 CSCOc1ccc(c(c1)C)Br 34a_100000690111_100011218213 [0,0,0,0,0,0|4,0,0]=4 799 B12R1.385 CSCOc1ccc(c(c1)C)C 34a_100000210932_100011218213 [0,0,0,0,0,0|4,0,0]=4 800 B12R1.385 CSCOc1ccc(c(c1)C)Cl 34a_100000211092_100011218213 [0,0,0,0,0,0|4,0,0]=4 801 B12R1.385 CSCOc1ccc(c(c1)C)F 34a_100000751312_100011218213 [0,0,0,0,0,0|4,0,0]=4 802 B12R1.385 CSCOc1ccc(c(c1)C)I 34a_100000729255_100011218213 [0,0,0,0,0,0|4,0,0]=4 803 B12R1.385 CSCOc1ccc(c(c1)C)N 34a_100000756630_100011218213 [0,0,0,0,0,0|4,0,0]=4 804 B12R1.385 CSCOc1ccc(c(c1)Cl)Br 34a_100011215161_100011218213 [0,0,0,0,0,0|4,0,0]=4 805 B12R1.385 CSCOc1ccc(c(c1)Cl)C 34a_100011265682_100011218213 [0,0,0,0,0,0|4,0,0]=4 806 B12R1.385 CSCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100011218213 [0,0,0,0,0,0|4,0,0]=4 807 B12R1.385 CSCOc1ccc(c(c1)Cl)F 34a_100000211030_100011218213 [0,0,0,0,0,0|4,0,0]=4 808 B12R1.385 CSCOc1ccc(c(c1)Cl)I 34a_100000047559_100011218213 [0,0,0,0,0,0|4,0,0]=4 809 B12R1.385 CSCOc1ccc(c(c1)Cl)N 34a_100011215599_100011218213 [0,0,0,0,0,0|4,0,0]=4 810 B12R1.385 CSCOc1ccc(c(c1)F)Br 34a_100000755031_100011218213 [0,0,0,0,0,0|4,0,0]=4 811 B12R1.385 CSCOc1ccc(c(c1)F)C 34a_100000722560_100011218213 [0,0,0,0,0,0|4,0,0]=4 812 B12R1.385 CSCOc1ccc(c(c1)F)Cl 34a_100000691581_100011218213 [0,0,0,0,0,0|4,0,0]=4 813 B12R1.385 CSCOc1ccc(c(c1)F)F 34a_100000181275_100011218213 [0,0,0,0,0,0|4,0,0]=4 814 B12R1.385 CSCOc1ccc(c(c1)F)I 34a_100009990212_100011218213 [0,0,0,0,0,0|4,0,0]=4 815 B12R1.385 CSCOc1ccc(c(c1)F)N 34a_100000759473_100011218213 [0,0,0,0,0,0|4,0,0]=4 816 B12R1.385 CSCOc1ccc(c(c1)I)Br 34a_100012339312_100011218213 [0,0,0,0,0,0|4,0,0]=4 817 B12R1.385 CSCOc1ccc(c(c1)I)Cl 34a_100000049588_100011218213 [0,0,0,0,0,0|4,0,0]=4 818 B12R1.385 CSCOc1ccc(c(c1)I)N 34a_100010084370_100011218213 [0,0,0,0,0,0|4,0,0]=4 819 B12R1.385 CSCOc1ccc(c(c1)N)Br 34a_100011999798_100011218213 [0,0,0,0,0,0|4,0,0]=4 820 B12R1.385 CSCOc1ccc(c(c1)N)C 34a_100011216113_100011218213 [0,0,0,0,0,0|4,0,0]=4 821 B12R1.385 CSCOc1ccc(c(c1)N)Cl 34a_100011934297_100011218213 [0,0,0,0,0,0|4,0,0]=4 822 B12R1.385 CSCOc1ccc(c(c1)N)F 34a_100012017239_100011218213 [0,0,0,0,0,0|4,0,0]=4 823 B12R1.385 CSCOc1ccc(c(c1)N)N 34a_100025771000_100011218213 [0,0,0,0,0,0|4,0,0]=4 824 B12R1.385 CSCSc1c[nH]c(=O)c(c1)O 62a_100011218213_100009814561 [0,0,0,0,0,0|3,0,1]=4 825 B12R1.385 CSCSc1cc(c(cn1)C)O 62a_100000704368_100011218213 [0,0,0,0,0,0|4,0,0]=4 826 B12R1.385 CSCSc1cc(c(cn1)C)O 62a_100011218213_100000704368 [0,0,0,0,0,0|4,0,0]=4 827 B12R1.385 CSCSc1cc(c(cn1)F)O 62a_100009854642_100011218213 [0,0,0,0,0,0|4,0,0]=4 828 B12R1.385 CSCSc1cc(c(cn1)F)O 62a_100011218213_100009854642 [0,0,0,0,0,0|4,0,0]=4 829 B12R1.385 CSCSc1cc(c(cn1)O)C 62a_100011218213_100000692680 [0,0,0,0,0,0|4,0,0]=4 830 B12R1.385 CSCSc1cc(c(cn1)O)N 62a_100009819941_100011218213 [0,0,0,0,0,0|4,0,0]=4 831 B12R1.385 CSCSc1cc(c(cn1)O)N 62a_100011218213_100009819941 [0,0,0,0,0,0|4,0,0]=4 832 B12R1.385 CSCSc1ccc(c(c1)Br)Br 62a_100011218213_100012356285 [0,0,0,0,0,0|4,0,0]=4 833 B12R1.385 CSCSc1ccc(c(c1)Br)Br 62a_100012356285_100011218213 [0,0,0,0,0,0|4,0,0]=4 834 B12R1.385 CSCSc1ccc(c(c1)Br)C 62a_100011218213_100011847877 [0,0,0,0,0,0|4,0,0]=4 835 B12R1.385 CSCSc1ccc(c(c1)Br)C 62a_100011847877_100011218213 [0,0,0,0,0,0|4,0,0]=4 836 B12R1.385 CSCSc1ccc(c(c1)Br)Cl 62a_100011218213_100012353702 [0,0,0,0,0,0|4,0,0]=4 837 B12R1.385 CSCSc1ccc(c(c1)Br)Cl 62a_100012353702_100011218213 [0,0,0,0,0,0|4,0,0]=4 838 B12R1.385 CSCSc1ccc(c(c1)Br)F 62a_100011218213_100012047266 [0,0,0,0,0,0|4,0,0]=4 839 B12R1.385 CSCSc1ccc(c(c1)Br)F 62a_100012047266_100011218213 [0,0,0,0,0,0|4,0,0]=4 840 B12R1.385 CSCSc1ccc(c(c1)Br)N 62a_100000750455_100011218213 [0,0,0,0,0,0|4,0,0]=4 841 B12R1.385 CSCSc1ccc(c(c1)Br)N 62a_100011218213_100000750455 [0,0,0,0,0,0|4,0,0]=4 842 B12R1.385 CSCSc1ccc(c(c1)Br)O 62a_100011218213_100012361655 [0,0,0,0,0,0|3,0,0]=3 843 B12R1.385 CSCSc1ccc(c(c1)Br)O 62a_100012361655_100011218213 [0,0,0,0,0,0|3,0,0]=3 844 B12R1.385 CSCSc1ccc(c(c1)C)Br 62a_100009813585_100011218213 [0,0,0,0,0,0|4,0,0]=4 845 B12R1.385 CSCSc1ccc(c(c1)C)Br 62a_100011218213_100009813585 [0,0,0,0,0,0|4,0,0]=4 846 B12R1.385 CSCSc1ccc(c(c1)C)C 62a_100011215607_100011218213 [0,0,0,0,0,0|4,0,0]=4 847 B12R1.385 CSCSc1ccc(c(c1)C)C 62a_100011218213_100011215607 [0,0,0,0,0,0|4,0,0]=4 848 B12R1.385 CSCSc1ccc(c(c1)C)Cl 62a_100000049509_100011218213 [0,0,0,0,0,0|4,0,0]=4 849 B12R1.385 CSCSc1ccc(c(c1)C)Cl 62a_100011218213_100000049509 [0,0,0,0,0,0|4,0,0]=4 850 B12R1.385 CSCSc1ccc(c(c1)C)F 62a_100011218213_100011218330 [0,0,0,0,0,0|4,0,0]=4 851 B12R1.385 CSCSc1ccc(c(c1)C)F 62a_100011218330_100011218213 [0,0,0,0,0,0|4,0,0]=4 852 B12R1.385 CSCSc1ccc(c(c1)C)N 62a_100000211769_100011218213 [0,0,0,0,0,0|4,0,0]=4 853 B12R1.385 CSCSc1ccc(c(c1)C)N 62a_100011218213_100000211769 [0,0,0,0,0,0|4,0,0]=4 854 B12R1.385 CSCSc1ccc(c(c1)C)O 62a_100011218213_100000186361 [0,0,0,0,0,0|3,0,0]=3 855 B12R1.385 CSCSc1ccc(c(c1)Cl)Br 62a_100011218213_100012047281 [0,0,0,0,0,0|4,0,0]=4 856 B12R1.385 CSCSc1ccc(c(c1)Cl)Br 62a_100012047281_100011218213 [0,0,0,0,0,0|4,0,0]=4 857 B12R1.385 CSCSc1ccc(c(c1)Cl)C 62a_100011216363_100011218213 [0,0,0,0,0,0|4,0,0]=4 858 B12R1.385 CSCSc1ccc(c(c1)Cl)C 62a_100011218213_100011216363 [0,0,0,0,0,0|4,0,0]=4 859 B12R1.385 CSCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100011218213 [0,0,0,0,0,0|4,0,0]=4 860 B12R1.385 CSCSc1ccc(c(c1)Cl)Cl 62a_100011218213_100011214914 [0,0,0,0,0,0|4,0,0]=4 861 B12R1.385 CSCSc1ccc(c(c1)Cl)F 62a_100011215976_100011218213 [0,0,0,0,0,0|4,0,0]=4 862 B12R1.385 CSCSc1ccc(c(c1)Cl)F 62a_100011218213_100011215976 [0,0,0,0,0,0|4,0,0]=4 863 B12R1.385 CSCSc1ccc(c(c1)Cl)N 62a_100011218065_100011218213 [0,0,0,0,0,0|4,0,0]=4 864 B12R1.385 CSCSc1ccc(c(c1)Cl)N 62a_100011218213_100011218065 [0,0,0,0,0,0|4,0,0]=4 865 B12R1.385 CSCSc1ccc(c(c1)Cl)O 62a_100011218213_100012360047 [0,0,0,0,0,0|3,0,0]=3 866 B12R1.385 CSCSc1ccc(c(c1)Cl)O 62a_100012360047_100011218213 [0,0,0,0,0,0|3,0,0]=3 867 B12R1.385 CSCSc1ccc(c(c1)F)Br 62a_100000685389_100011218213 [0,0,0,0,0,0|4,0,0]=4 868 B12R1.385 CSCSc1ccc(c(c1)F)Br 62a_100011218213_100000685389 [0,0,0,0,0,0|4,0,0]=4 869 B12R1.385 CSCSc1ccc(c(c1)F)C 62a_100000720648_100011218213 [0,0,0,0,0,0|4,0,0]=4 870 B12R1.385 CSCSc1ccc(c(c1)F)C 62a_100011218213_100000720648 [0,0,0,0,0,0|4,0,0]=4 871 B12R1.385 CSCSc1ccc(c(c1)F)Cl 62a_100011216805_100011218213 [0,0,0,0,0,0|4,0,0]=4 872 B12R1.385 CSCSc1ccc(c(c1)F)Cl 62a_100011218213_100011216805 [0,0,0,0,0,0|4,0,0]=4 873 B12R1.385 CSCSc1ccc(c(c1)F)F 62a_100000703953_100011218213 [0,0,0,0,0,0|4,0,0]=4 874 B12R1.385 CSCSc1ccc(c(c1)F)F 62a_100011218213_100000703953 [0,0,0,0,0,0|4,0,0]=4 875 B12R1.385 CSCSc1ccc(c(c1)F)N 62a_100011215594_100011218213 [0,0,0,0,0,0|4,0,0]=4 876 B12R1.385 CSCSc1ccc(c(c1)F)N 62a_100011218213_100011215594 [0,0,0,0,0,0|4,0,0]=4 877 B12R1.385 CSCSc1ccc(c(c1)F)O 62a_100000185481_100011218213 [0,0,0,0,0,0|3,0,0]=3 878 B12R1.385 CSCSc1ccc(c(c1)F)O 62a_100011218213_100000185481 [0,0,0,0,0,0|3,0,0]=3 879 B12R1.385 CSCSc1ccc(c(c1)N)Br 62a_100000750456_100011218213 [0,0,0,0,0,0|4,0,0]=4 880 B12R1.385 CSCSc1ccc(c(c1)N)Br 62a_100011218213_100000750456 [0,0,0,0,0,0|4,0,0]=4 881 B12R1.385 CSCSc1ccc(c(c1)N)C 62a_100000761890_100011218213 [0,0,0,0,0,0|4,0,0]=4 882 B12R1.385 CSCSc1ccc(c(c1)N)C 62a_100011218213_100000761890 [0,0,0,0,0,0|4,0,0]=4 883 B12R1.385 CSCSc1ccc(c(c1)N)Cl 62a_100011218213_200000761891 [0,0,0,0,0,0|4,0,0]=4 884 B12R1.385 CSCSc1ccc(c(c1)N)Cl 62a_200000761891_100011218213 [0,0,0,0,0,0|4,0,0]=4 885 B12R1.385 CSCSc1ccc(c(c1)N)F 62a_100000740924_100011218213 [0,0,0,0,0,0|4,0,0]=4 886 B12R1.385 CSCSc1ccc(c(c1)N)F 62a_100011218213_100000740924 [0,0,0,0,0,0|4,0,0]=4 887 B12R1.385 CSCSc1ccc(c(c1)N)N 62a_100000741789_100011218213 [0,0,0,0,0,0|4,0,0]=4 888 B12R1.385 CSCSc1ccc(c(c1)N)N 62a_100011218213_100011534411 [0,0,0,0,0,0|4,0,0]=4 889 B12R1.385 CSCSc1ccc(c(c1)N)O 62a_100000752626_100011218213 [0,0,0,0,0,0|3,0,0]=3 890 B12R1.385 CSCSc1ccc(c(c1)N)O 62a_100011218213_100000752626 [0,0,0,0,0,0|3,0,0]=3 891 B12R1.385 CSCSc1ccc(c(c1)O)Br 62a_100011218213_100012356990 [0,0,0,0,0,0|3,0,0]=3 892 B12R1.385 CSCSc1ccc(c(c1)O)Br 62a_100012356990_100011218213 [0,0,0,0,0,0|3,0,0]=3 893 B12R1.385 CSCSc1ccc(c(c1)O)C 62a_100000685420_100011218213 [0,0,0,0,0,0|3,0,0]=3 894 B12R1.385 CSCSc1ccc(c(c1)O)C 62a_100011218213_100000685420 [0,0,0,0,0,0|3,0,0]=3 895 B12R1.385 CSCSc1ccc(c(c1)O)Cl 62a_100011218213_100011356854 [0,0,0,0,0,0|3,0,0]=3 896 B12R1.385 CSCSc1ccc(c(c1)O)Cl 62a_100011356854_100011218213 [0,0,0,0,0,0|3,0,0]=3 897 B12R1.385 CSCSc1ccc(c(c1)O)F 62a_100000686035_100011218213 [0,0,0,0,0,0|3,0,0]=3 898 B12R1.385 CSCSc1ccc(c(c1)O)F 62a_100011218213_100000686035 [0,0,0,0,0,0|3,0,0]=3 899 B12R1.385 CSCSc1ccc(c(c1)O)N 62a_100000739049_100011218213 [0,0,0,0,0,0|3,0,0]=3 900 B12R1.385 CSCSc1ccc(c(c1)O)N 62a_100011218213_100000739049 [0,0,0,0,0,0|3,0,0]=3 901 B12R1.385 CSCSc1ccc(c(c1)O)O 62a_100011218213_100009813601 [0,0,0,0,0,0|2,0,0]=2 902 B12R1.385 CSCSc1ccc(c(n1)Br)O 62a_100000725334_100011218213 [0,0,0,0,0,0|4,0,0]=4 903 B12R1.385 CSCSc1ccc(c(n1)Br)O 62a_100011218213_100000725334 [0,0,0,0,0,0|4,0,0]=4 904 B12R1.385 CSCSc1ccc(c(n1)C)O 62a_100010233687_100011218213 [0,0,0,0,0,0|4,0,0]=4 905 B12R1.385 CSCSc1ccc(c(n1)C)O 62a_100011218213_100010233687 [0,0,0,0,0,0|4,0,0]=4 906 B12R1.385 CSCSc1ccc(c(n1)Cl)O 62a_100011218213_100000721234 [0,0,0,0,0,0|4,0,0]=4 907 B12R1.385 CSCSc1ccc(c(n1)F)O 62a_100009819667_100011218213 [0,0,0,0,0,0|4,0,0]=4 908 B12R1.385 CSCSc1ccc(c(n1)F)O 62a_100011218213_100009819667 [0,0,0,0,0,0|4,0,0]=4 909 B12R1.385 CSCSc1ccc(c(n1)N)O 62a_100000685527_100011218213 [0,0,0,0,0,0|4,0,0]=4 910 B12R1.385 CSCSc1ccc(c(n1)N)O 62a_100011218213_100000685527 [0,0,0,0,0,0|4,0,0]=4 911 B12R1.385 CSCSc1ccc(c(n1)O)F 62a_100011218213_100010729010 [0,0,0,0,0,0|4,0,0]=4 912 B12R1.385 CSCSc1ccc(c(n1)O)N 62a_100000718904_100011218213 [0,0,0,0,0,0|4,0,0]=4 913 B12R1.385 CSCSc1cnc(c(c1)C)O 62a_100000685391_100011218213 [0,0,0,0,0,0|4,0,0]=4 914 B12R1.385 CSCSc1cnc(c(c1)C)O 62a_100011218213_100000685391 [0,0,0,0,0,0|4,0,0]=4 915 B12R1.385 CSCSc1cnc(c(c1)Cl)O 62a_100010238531_100011218213 [0,0,0,0,0,0|4,0,0]=4 916 B12R1.385 CSCSc1cnc(c(c1)Cl)O 62a_100011218213_100010238531 [0,0,0,0,0,0|4,0,0]=4 917 B12R1.385 CSCSc1cnc(c(c1)N)O 62a_100000743729_100011218213 [0,0,0,0,0,0|4,0,0]=4 918 B12R1.385 CSCSc1cnc(c(c1)N)O 62a_100011218213_100000743729 [0,0,0,0,0,0|4,0,0]=4 919 B12R1.385 CSCSc1cnc(c(c1)O)C 62a_100009864810_100011218213 [0,0,0,0,0,0|4,0,0]=4 920 B12R1.385 CSCSc1cnc(c(c1)O)C 62a_100011218213_100009864810 [0,0,0,0,0,0|4,0,0]=4 921 B12R1.385 CSCSc1cnc(c(c1)O)F 62a_100009819871_100011218213 [0,0,0,0,0,0|4,0,0]=4 922 B12R1.385 CSCSc1cnc(c(c1)O)F 62a_100011218213_100009819871 [0,0,0,0,0,0|4,0,0]=4 923 B12R1.385 CSCSc1cnc(c(c1)O)N 62a_100009819042_100011218213 [0,0,0,0,0,0|4,0,0]=4 924 B12R1.385 CSCSc1cnc(c(c1)O)N 62a_100011218213_100009819042 [0,0,0,0,0,0|4,0,0]=4 925 B12R1.385 Cc1cc(ccc1O)NCC#N 7a_100011218179_100011215382 [0,0,0,0,0,0|4,0,0]=4 926 B12R1.385 Cc1cc(ccc1O)NCC=O 34a_100011218179_200009817547 [0,0,0,0,0,0|4,0,0]=4 927 B12R1.385 Cc1cc(ccc1O)NCC=O 7a_100011218179_200015260668 [0,0,0,0,0,0|4,0,0]=4 928 B12R1.385 Cc1cc(ccc1O)NCCF 34a_100011218179_100011217306 [0,0,0,0,0,0|4,0,0]=4 929 B12R1.385 Cc1cc(ccc1O)NCCF 7a_100011218179_100011217306 [0,0,0,0,0,0|4,0,0]=4 930 B12R1.385 Cc1cc(ccc1O)NCCO 34a_100011218179_100000211926 [0,0,0,0,0,0|4,0,0]=4 931 B12R1.385 Cc1cc(ccc1O)NCCO 7a_100011218179_100000211926 [0,0,0,0,0,0|4,0,0]=4 932 B12R1.385 Cc1cc(ccc1O)SCC#N 62a_100011215382_100000186361 [0,0,0,0,0,0|4,0,0]=4 933 B12R1.385 Cc1cc(ccc1O)SCC=O 62a_200015260668_100000186361 [0,0,0,0,0,0|4,0,0]=4 934 B12R1.385 Cc1cc(ccc1O)SCCF 62a_100011217306_100000186361 [0,0,0,0,0,0|4,0,0]=4 935 B12R1.385 Cc1cc(ccc1O)SCCO 62a_100000211926_100000186361 [0,0,0,0,0,0|4,0,0]=4 936 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 2230a_100020591374_200025704644 [0,0,0,0,0,0|2,0,0]=2 937 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 34a_100020591374_200025704644 [0,0,0,0,0,0|2,0,0]=2 938 B12R1.385 Cc1ccc(cc1O)NCC#N 7a_100000759471_100011215382 [0,0,0,0,0,0|4,0,0]=4 939 B12R1.385 Cc1ccc(cc1O)NCC=O 34a_100000759471_200009817547 [0,0,0,0,0,0|4,0,0]=4 940 B12R1.385 Cc1ccc(cc1O)NCC=O 7a_100000759471_200015260668 [0,0,0,0,0,0|4,0,0]=4 941 B12R1.385 Cc1ccc(cc1O)NCCF 34a_100000759471_100011217306 [0,0,0,0,0,0|4,0,0]=4 942 B12R1.385 Cc1ccc(cc1O)NCCF 7a_100000759471_100011217306 [0,0,0,0,0,0|4,0,0]=4 943 B12R1.385 Cc1ccc(cc1O)NCCO 34a_100000759471_100000211926 [0,0,0,0,0,0|4,0,0]=4 944 B12R1.385 Cc1ccc(cc1O)NCCO 7a_100000759471_100000211926 [0,0,0,0,0,0|4,0,0]=4 945 B12R1.385 Cc1ccc(cc1O)SCC#N 62a_100000685420_100011215382 [0,0,0,0,0,0|4,0,0]=4 946 B12R1.385 Cc1ccc(cc1O)SCC#N 62a_100011215382_100000685420 [0,0,0,0,0,0|4,0,0]=4 947 B12R1.385 Cc1ccc(cc1O)SCC=O 62a_100000685420_200015260668 [0,0,0,0,0,0|4,0,0]=4 948 B12R1.385 Cc1ccc(cc1O)SCC=O 62a_200015260668_100000685420 [0,0,0,0,0,0|4,0,0]=4 949 B12R1.385 Cc1ccc(cc1O)SCCF 62a_100000685420_100011217306 [0,0,0,0,0,0|4,0,0]=4 950 B12R1.385 Cc1ccc(cc1O)SCCF 62a_100011217306_100000685420 [0,0,0,0,0,0|4,0,0]=4 951 B12R1.385 Cc1ccc(cc1O)SCCO 271570a_203496583355_100010989109 [0,0,0,0,0,0|4,0,0]=4 952 B12R1.385 Cc1ccc(cc1O)SCCO 62a_100000211926_100000685420 [0,0,0,0,0,0|4,0,0]=4 953 B12R1.385 Cc1ccc(cc1O)SCCO 62a_100000685420_100000211926 [0,0,0,0,0,0|4,0,0]=4 954 B12R1.385 N#CCNc1ccc(c(c1)F)O 7a_100011220035_100011215382 [0,0,0,0,0,0|4,0,0]=4 955 B12R1.385 N#CCNc1ccc(c(c1)O)F 7a_100012017398_100011215382 [0,0,0,0,0,0|4,0,0]=4 956 B12R1.385 N#CCSc1ccc(c(c1)Br)O 62a_100011215382_100012361655 [0,0,0,0,0,0|4,0,0]=4 957 B12R1.385 N#CCSc1ccc(c(c1)Br)O 62a_100012361655_100011215382 [0,0,0,0,0,0|4,0,0]=4 958 B12R1.385 N#CCSc1ccc(c(c1)Cl)O 62a_100011215382_100012360047 [0,0,0,0,0,0|4,0,0]=4 959 B12R1.385 N#CCSc1ccc(c(c1)Cl)O 62a_100012360047_100011215382 [0,0,0,0,0,0|4,0,0]=4 960 B12R1.385 N#CCSc1ccc(c(c1)F)O 62a_100000185481_100011215382 [0,0,0,0,0,0|4,0,0]=4 961 B12R1.385 N#CCSc1ccc(c(c1)F)O 62a_100011215382_100000185481 [0,0,0,0,0,0|4,0,0]=4 962 B12R1.385 N#CCSc1ccc(c(c1)N)O 62a_100000752626_100011215382 [0,0,0,0,0,0|4,0,0]=4 963 B12R1.385 N#CCSc1ccc(c(c1)N)O 62a_100011215382_100000752626 [0,0,0,0,0,0|4,0,0]=4 964 B12R1.385 N#CCSc1ccc(c(c1)O)Br 62a_100011215382_100012356990 [0,0,0,0,0,0|4,0,0]=4 965 B12R1.385 N#CCSc1ccc(c(c1)O)Br 62a_100012356990_100011215382 [0,0,0,0,0,0|4,0,0]=4 966 B12R1.385 N#CCSc1ccc(c(c1)O)Cl 62a_100011215382_100011356854 [0,0,0,0,0,0|4,0,0]=4 967 B12R1.385 N#CCSc1ccc(c(c1)O)Cl 62a_100011356854_100011215382 [0,0,0,0,0,0|4,0,0]=4 968 B12R1.385 N#CCSc1ccc(c(c1)O)F 62a_100000686035_100011215382 [0,0,0,0,0,0|4,0,0]=4 969 B12R1.385 N#CCSc1ccc(c(c1)O)F 62a_100011215382_100000686035 [0,0,0,0,0,0|4,0,0]=4 970 B12R1.385 N#CCSc1ccc(c(c1)O)N 62a_100000739049_100011215382 [0,0,0,0,0,0|4,0,0]=4 971 B12R1.385 N#CCSc1ccc(c(c1)O)N 62a_100011215382_100000739049 [0,0,0,0,0,0|4,0,0]=4 972 B12R1.385 N#CCSc1ccc(c(c1)O)O 62a_100011215382_100009813601 [0,0,0,0,0,0|3,0,0]=3 973 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_100000752626_200015260668 [0,0,0,0,0,0|4,0,0]=4 974 B12R1.385 Nc1cc(ccc1O)SCC=O 62a_200015260668_100000752626 [0,0,0,0,0,0|4,0,0]=4 975 B12R1.385 Nc1cc(ccc1O)SCCF 62a_100000752626_100011217306 [0,0,0,0,0,0|4,0,0]=4 976 B12R1.385 Nc1cc(ccc1O)SCCF 62a_100011217306_100000752626 [0,0,0,0,0,0|4,0,0]=4 977 B12R1.385 Nc1cc(ccc1O)SCCO 62a_100000211926_100000752626 [0,0,0,0,0,0|4,0,0]=4 978 B12R1.385 Nc1cc(ccc1O)SCCO 62a_100000752626_100000211926 [0,0,0,0,0,0|4,0,0]=4 979 B12R1.385 Nc1ccc(cc1O)SCC=O 62a_100000739049_200015260668 [0,0,0,0,0,0|4,0,0]=4 980 B12R1.385 Nc1ccc(cc1O)SCC=O 62a_200015260668_100000739049 [0,0,0,0,0,0|4,0,0]=4 981 B12R1.385 Nc1ccc(cc1O)SCCF 62a_100000739049_100011217306 [0,0,0,0,0,0|4,0,0]=4 982 B12R1.385 Nc1ccc(cc1O)SCCF 62a_100011217306_100000739049 [0,0,0,0,0,0|4,0,0]=4 983 B12R1.385 Nc1ccc(cc1O)SCCO 62a_100000211926_100000739049 [0,0,0,0,0,0|4,0,0]=4 984 B12R1.385 Nc1ccc(cc1O)SCCO 62a_100000739049_100000211926 [0,0,0,0,0,0|4,0,0]=4 985 B12R1.385 O=CCNc1ccc(c(c1)Br)O 34a_100011534360_200009817547 [0,0,0,0,0,0|4,0,0]=4 986 B12R1.385 O=CCNc1ccc(c(c1)Cl)O 34a_100000744943_200009817547 [0,0,0,0,0,0|4,0,0]=4 987 B12R1.385 O=CCNc1ccc(c(c1)F)O 34a_100011220035_200009817547 [0,0,0,0,0,0|4,0,0]=4 988 B12R1.385 O=CCNc1ccc(c(c1)F)O 7a_100011220035_200015260668 [0,0,0,0,0,0|4,0,0]=4 989 B12R1.385 O=CCNc1ccc(c(c1)O)Cl 34a_100011934209_200009817547 [0,0,0,0,0,0|4,0,0]=4 990 B12R1.385 O=CCNc1ccc(c(c1)O)F 34a_100012017398_200009817547 [0,0,0,0,0,0|4,0,0]=4 991 B12R1.385 O=CCNc1ccc(c(c1)O)F 7a_100012017398_200015260668 [0,0,0,0,0,0|4,0,0]=4 992 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [0,0,0,0,0,0|3,0,0]=3 993 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_100012361655_200015260668 [0,0,0,0,0,0|4,0,0]=4 994 B12R1.385 O=CCSc1ccc(c(c1)Br)O 62a_200015260668_100012361655 [0,0,0,0,0,0|4,0,0]=4 995 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_100012360047_200015260668 [0,0,0,0,0,0|4,0,0]=4 996 B12R1.385 O=CCSc1ccc(c(c1)Cl)O 62a_200015260668_100012360047 [0,0,0,0,0,0|4,0,0]=4 997 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_100000185481_200015260668 [0,0,0,0,0,0|4,0,0]=4 998 B12R1.385 O=CCSc1ccc(c(c1)F)O 62a_200015260668_100000185481 [0,0,0,0,0,0|4,0,0]=4 999 B12R1.385 O=CCSc1ccc(c(c1)O)Br 62a_100012356990_200015260668 [0,0,0,0,0,0|4,0,0]=4 1000 B12R1.385 O=CCSc1ccc(c(c1)O)Br 62a_200015260668_100012356990 [0,0,0,0,0,0|4,0,0]=4 1001 B12R1.385 O=CCSc1ccc(c(c1)O)Cl 62a_100011356854_200015260668 [0,0,0,0,0,0|4,0,0]=4 1002 B12R1.385 O=CCSc1ccc(c(c1)O)Cl 62a_200015260668_100011356854 [0,0,0,0,0,0|4,0,0]=4 1003 B12R1.385 O=CCSc1ccc(c(c1)O)F 62a_100000686035_200015260668 [0,0,0,0,0,0|4,0,0]=4 1004 B12R1.385 O=CCSc1ccc(c(c1)O)F 62a_200015260668_100000686035 [0,0,0,0,0,0|4,0,0]=4 1005 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [0,0,0,0,0,0|3,0,0]=3 1006 B12R1.385 OCCNc1ccc(c(c1)Br)O 34a_100011534360_100000211926 [0,0,0,0,0,0|4,0,0]=4 1007 B12R1.385 OCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000211926 [0,0,0,0,0,0|4,0,0]=4 1008 B12R1.385 OCCNc1ccc(c(c1)F)O 34a_100011220035_100000211926 [0,0,0,0,0,0|4,0,0]=4 1009 B12R1.385 OCCNc1ccc(c(c1)F)O 7a_100011220035_100000211926 [0,0,0,0,0,0|4,0,0]=4 1010 B12R1.385 OCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000211926 [0,0,0,0,0,0|4,0,0]=4 1011 B12R1.385 OCCNc1ccc(c(c1)O)F 34a_100012017398_100000211926 [0,0,0,0,0,0|4,0,0]=4 1012 B12R1.385 OCCNc1ccc(c(c1)O)F 7a_100012017398_100000211926 [0,0,0,0,0,0|4,0,0]=4 1013 B12R1.385 OCCNc1ccc(c(c1)O)O 34a_100102946323_100000211926 [0,0,0,0,0,0|3,0,0]=3 1014 B12R1.385 OCCSc1ccc(c(c1)Br)O 62a_100000211926_100012361655 [0,0,0,0,0,0|4,0,0]=4 1015 B12R1.385 OCCSc1ccc(c(c1)Br)O 62a_100012361655_100000211926 [0,0,0,0,0,0|4,0,0]=4 1016 B12R1.385 OCCSc1ccc(c(c1)Cl)O 62a_100000211926_100012360047 [0,0,0,0,0,0|4,0,0]=4 1017 B12R1.385 OCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000211926 [0,0,0,0,0,0|4,0,0]=4 1018 B12R1.385 OCCSc1ccc(c(c1)F)O 62a_100000185481_100000211926 [0,0,0,0,0,0|4,0,0]=4 1019 B12R1.385 OCCSc1ccc(c(c1)F)O 62a_100000211926_100000185481 [0,0,0,0,0,0|4,0,0]=4 1020 B12R1.385 OCCSc1ccc(c(c1)O)Br 62a_100000211926_100012356990 [0,0,0,0,0,0|4,0,0]=4 1021 B12R1.385 OCCSc1ccc(c(c1)O)Br 62a_100012356990_100000211926 [0,0,0,0,0,0|4,0,0]=4 1022 B12R1.385 OCCSc1ccc(c(c1)O)Cl 62a_100000211926_100011356854 [0,0,0,0,0,0|4,0,0]=4 1023 B12R1.385 OCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000211926 [0,0,0,0,0,0|4,0,0]=4 1024 B12R1.385 OCCSc1ccc(c(c1)O)F 62a_100000211926_100000686035 [0,0,0,0,0,0|4,0,0]=4 1025 B12R1.385 OCCSc1ccc(c(c1)O)F 62a_100000686035_100000211926 [0,0,0,0,0,0|4,0,0]=4 1026 B12R1.385 OCCSc1ccc(c(c1)O)O 62a_100000211926_100009813601 [0,0,0,0,0,0|3,0,0]=3 1027 B12R1.385 Oc1cc(ccc1Br)SCCF 62a_100011217306_100012356990 [0,0,0,0,0,0|4,0,0]=4 1028 B12R1.385 Oc1cc(ccc1Br)SCCF 62a_100012356990_100011217306 [0,0,0,0,0,0|4,0,0]=4 1029 B12R1.385 Oc1cc(ccc1Cl)CNCF 34a_100020636435_100015361967 [0,0,0,0,0,0|4,0,0]=4 1030 B12R1.385 Oc1cc(ccc1Cl)NCCF 34a_100011934209_100011217306 [0,0,0,0,0,0|4,0,0]=4 1031 B12R1.385 Oc1cc(ccc1Cl)SCCF 62a_100011217306_100011356854 [0,0,0,0,0,0|4,0,0]=4 1032 B12R1.385 Oc1cc(ccc1Cl)SCCF 62a_100011356854_100011217306 [0,0,0,0,0,0|4,0,0]=4 1033 B12R1.385 Oc1cc(ccc1F)CNCF 34a_100160469508_100015361967 [0,0,0,0,0,0|4,0,0]=4 1034 B12R1.385 Oc1cc(ccc1F)NCCF 34a_100012017398_100011217306 [0,0,0,0,0,0|4,0,0]=4 1035 B12R1.385 Oc1cc(ccc1F)NCCF 7a_100012017398_100011217306 [0,0,0,0,0,0|4,0,0]=4 1036 B12R1.385 Oc1cc(ccc1F)SCCF 62a_100000686035_100011217306 [0,0,0,0,0,0|4,0,0]=4 1037 B12R1.385 Oc1cc(ccc1F)SCCF 62a_100011217306_100000686035 [0,0,0,0,0,0|4,0,0]=4 1038 B12R1.385 Oc1ccc(cc1Br)NCCF 34a_100011534360_100011217306 [0,0,0,0,0,0|4,0,0]=4 1039 B12R1.385 Oc1ccc(cc1Br)SCCF 62a_100011217306_100012361655 [0,0,0,0,0,0|4,0,0]=4 1040 B12R1.385 Oc1ccc(cc1Br)SCCF 62a_100012361655_100011217306 [0,0,0,0,0,0|4,0,0]=4 1041 B12R1.385 Oc1ccc(cc1Cl)NCCF 34a_100000744943_100011217306 [0,0,0,0,0,0|4,0,0]=4 1042 B12R1.385 Oc1ccc(cc1Cl)SCCF 62a_100011217306_100012360047 [0,0,0,0,0,0|4,0,0]=4 1043 B12R1.385 Oc1ccc(cc1Cl)SCCF 62a_100012360047_100011217306 [0,0,0,0,0,0|4,0,0]=4 1044 B12R1.385 Oc1ccc(cc1F)CNCF 34a_100000758358_100015361967 [0,0,0,0,0,0|4,0,0]=4 1045 B12R1.385 Oc1ccc(cc1F)NCCF 34a_100011220035_100011217306 [0,0,0,0,0,0|4,0,0]=4 1046 B12R1.385 Oc1ccc(cc1F)NCCF 7a_100011220035_100011217306 [0,0,0,0,0,0|4,0,0]=4 1047 B12R1.385 Oc1ccc(cc1F)SCCF 62a_100000185481_100011217306 [0,0,0,0,0,0|4,0,0]=4 1048 B12R1.385 Oc1ccc(cc1F)SCCF 62a_100011217306_100000185481 [0,0,0,0,0,0|4,0,0]=4 1049 B12R1.385 Oc1ccc(cc1O)CNCF 34a_100000010075_100015361967 [0,0,0,0,0,0|3,0,0]=3 1050 B12R1.385 Oc1ccc(cc1O)NCCF 34a_100102946323_100011217306 [0,0,0,0,0,0|3,0,0]=3 1051 B12R1.385 Oc1ccc(cc1O)SCCF 62a_100011217306_100009813601 [0,0,0,0,0,0|3,0,0]=3 1052 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200025704644 [0,0,0,0,0,0|2,0,0]=2 1053 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200025704644 [0,0,0,0,0,0|2,0,0]=2 1054 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)F 2230a_200011997520_200025704644 [0,0,0,0,0,0|2,0,0]=2 1055 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)F 34a_200011997520_200025704644 [0,0,0,0,0,0|2,0,0]=2 1056 B12R1.385 [13CH3]NCCc1ccc(c(c1)F)F 2230a_200000706328_200025704644 [0,0,0,0,0,0|2,0,0]=2 1057 B12R1.385 [13CH3]NCCc1ccc(c(c1)F)F 34a_200000706328_200025704644 [0,0,0,0,0,0|2,0,0]=2 1058 B12R1.385 [13CH3]NCCc1ccc(c(c1)O)O 34a_100000210387_200025704644 [0,0,0,0,0,0|0,0,0]=0 1059 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)Cl 34a_100011709245_200025704644 [0,0,0,0,0,0|3,0,0]=3 1060 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)Cl 7a_100011709245_200025704644 [0,0,0,0,0,0|3,0,0]=3 1061 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)F 34a_100011830478_200025704644 [0,0,0,0,0,0|3,0,0]=3 1062 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)F 7a_100011830478_200025704644 [0,0,0,0,0,0|3,0,0]=3 1063 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Br 34a_100012921202_200025704644 [0,0,0,0,0,0|3,0,0]=3 1064 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Br 7a_100012921202_200025704644 [0,0,0,0,0,0|3,0,0]=3 1065 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Cl 34a_100011934464_200025704644 [0,0,0,0,0,0|3,0,0]=3 1066 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Cl 7a_100011934464_200025704644 [0,0,0,0,0,0|3,0,0]=3 1067 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)F 34a_100000690376_200025704644 [0,0,0,0,0,0|3,0,0]=3 1068 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)F 7a_100000690376_200025704644 [0,0,0,0,0,0|3,0,0]=3 1069 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)Cl 62a_100011713676_200025704644 [0,0,0,0,0,0|3,0,0]=3 1070 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)Cl 62a_200025704644_100011713676 [0,0,0,0,0,0|3,0,0]=3 1071 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)F 62a_100012361305_200025704644 [0,0,0,0,0,0|3,0,0]=3 1072 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)F 62a_200025704644_100012361305 [0,0,0,0,0,0|3,0,0]=3 1073 B12R1.385 [13CH3]SCCc1ccc(c(c1)F)F 62a_100000690553_200025704644 [0,0,0,0,0,0|3,0,0]=3 1074 B12R1.385 [13CH3]SCCc1ccc(c(c1)F)F 62a_200025704644_100000690553 [0,0,0,0,0,0|3,0,0]=3 1075 B12R1.385 [13CH3]SCCc1ccc(c(c1)O)O 62a_200025704644_200010393615 [0,0,0,0,0,0|1,0,0]=1 1076 B11R1.1 C#CCNc1ccc(cc1)O 34a_100000185829_100000184674 [1,0,0,0,0,0|2,0,1]=4 1077 B11R1.1 C#CCSc1ccc(cc1)O 62a_100000038162_100000185759 [1,0,0,0,0,0|2,0,1]=4 1078 B11R1.1 C=CCNc1ccc(cc1)O 34a_100000185829_100015514636 [1,0,0,0,0,0|2,0,1]=4 1079 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [1,0,0,0,0,0|2,0,1]=4 1080 B11R1.1 C=CCSc1ccc(cc1)O 62a_100000210623_100000185759 [1,0,0,0,0,0|2,0,1]=4 1081 B11R1.1 CCCCc1cc[n+](cc1)[O-] 271570a_100020621405_100000039755 [1,0,0,0,0,0|2,0,1]=4 1082 B11R1.1 CCCCc1ccc(=O)[nH]c1 271570a_100020621405_100000212171 [1,0,0,0,0,0|2,0,1]=4 1083 B11R1.1 CCCCc1ccc(cc1)Br 271570a_100020621405_100000752885 [1,0,0,0,0,0|2,0,0]=3 1084 B11R1.1 CCCCc1ccc(cc1)C 271570a_100020621405_100000186775 [1,0,0,0,0,0|2,0,0]=3 1085 B11R1.1 CCCCc1ccc(cc1)Cl 271570a_100020621405_100000755918 [1,0,0,0,0,0|2,0,0]=3 1086 B11R1.1 CCCCc1ccc(cc1)F 271570a_100020621405_100000211213 [1,0,0,0,0,0|2,0,0]=3 1087 B11R1.1 CCCCc1ccc(cc1)N 271570a_100020621405_100000185761 [1,0,0,0,0,0|2,0,0]=3 1088 B11R1.1 CCCCc1ccc(cc1)O 271570a_100020621405_100000185759 [1,0,0,0,0,0|1,0,0]=2 1089 B11R1.1 CCCCc1ccc(cc1)O 271570a_203496583355_100011215597 [1,0,0,0,0,0|1,0,0]=2 1090 B11R1.1 CCCCc1ccc(cn1)Br 271570a_100020621405_100000686858 [1,0,0,0,0,0|3,0,0]=4 1091 B11R1.1 CCCCc1ccc(cn1)C 271570a_100020621405_100000754016 [1,0,0,0,0,0|3,0,0]=4 1092 B11R1.1 CCCCc1ccc(cn1)Cl 271570a_100020621405_100011356976 [1,0,0,0,0,0|3,0,0]=4 1093 B11R1.1 CCCCc1ccc(cn1)F 271570a_100020621405_100000744514 [1,0,0,0,0,0|3,0,0]=4 1094 B11R1.1 CCCCc1ccc(cn1)N 271570a_100020621405_100000744251 [1,0,0,0,0,0|3,0,0]=4 1095 B11R1.1 CCCCc1ccc(cn1)O 271570a_100020621405_100000685995 [1,0,0,0,0,0|2,0,0]=3 1096 B11R1.1 CCCCc1ccc(nc1)Br 271570a_100020621405_100009814638 [1,0,0,0,0,0|3,0,0]=4 1097 B11R1.1 CCCCc1ccc(nc1)C 271570a_100020621405_100000751577 [1,0,0,0,0,0|3,0,0]=4 1098 B11R1.1 CCCCc1ccc(nc1)Cl 271570a_100020621405_100000034144 [1,0,0,0,0,0|3,0,0]=4 1099 B11R1.1 CCCCc1ccc(nc1)F 271570a_100020621405_100000748661 [1,0,0,0,0,0|3,0,0]=4 1100 B11R1.1 CCCCc1ccc(nc1)N 271570a_100020621405_100000187370 [1,0,0,0,0,0|3,0,0]=4 1101 B11R1.1 CCCCc1ncc(cn1)O 271570a_100020621405_100000730009 [1,0,0,0,0,0|3,0,0]=4 1102 B11R1.1 CCCNc1ccc(cc1)Br 2230a_100000210018_100000210303 [1,0,0,0,0,0|3,0,0]=4 1103 B11R1.1 CCCNc1ccc(cc1)Br 34a_100000210018_100000210303 [1,0,0,0,0,0|3,0,0]=4 1104 B11R1.1 CCCNc1ccc(cc1)C 34a_100000124888_100000210303 [1,0,0,0,0,0|3,0,0]=4 1105 B11R1.1 CCCNc1ccc(cc1)Cl 2230a_100000210052_100000210303 [1,0,0,0,0,0|3,0,0]=4 1106 B11R1.1 CCCNc1ccc(cc1)Cl 34a_100000210052_100000210303 [1,0,0,0,0,0|3,0,0]=4 1107 B11R1.1 CCCNc1ccc(cc1)F 34a_100000185862_100000210303 [1,0,0,0,0,0|3,0,0]=4 1108 B11R1.1 CCCNc1ccc(cc1)I 34a_100000185761_100000210303 [1,0,0,0,0,0|3,0,0]=4 1109 B11R1.1 CCCNc1ccc(cc1)O 34a_100000185829_100000210303 [1,0,0,0,0,0|2,0,0]=3 1110 B11R1.1 CCCOc1ccc(cc1)Br 34a_100000185759_100000210303 [1,0,0,0,0,0|3,0,0]=4 1111 B11R1.1 CCCOc1ccc(cc1)Br 7a_100000185759_100000210303 [1,0,0,0,0,0|3,0,0]=4 1112 B11R1.1 CCCOc1ccc(cc1)C 34a_100000210336_100000210303 [1,0,0,0,0,0|3,0,0]=4 1113 B11R1.1 CCCOc1ccc(cc1)C 7a_100000210336_100000210303 [1,0,0,0,0,0|3,0,0]=4 1114 B11R1.1 CCCOc1ccc(cc1)Cl 34a_100000210216_100000210303 [1,0,0,0,0,0|3,0,0]=4 1115 B11R1.1 CCCOc1ccc(cc1)Cl 7a_100000210216_100000210303 [1,0,0,0,0,0|3,0,0]=4 1116 B11R1.1 CCCOc1ccc(cc1)F 34a_100000210339_100000210303 [1,0,0,0,0,0|3,0,0]=4 1117 B11R1.1 CCCOc1ccc(cc1)I 34a_100000212066_100000210303 [1,0,0,0,0,0|3,0,0]=4 1118 B11R1.1 CCCOc1ccc(cc1)I 7a_100000212066_100000210303 [1,0,0,0,0,0|3,0,0]=4 1119 B11R1.1 CCCOc1ccc(cc1)N 34a_100000185829_100000210303 [1,0,0,0,0,0|3,0,0]=4 1120 B11R1.1 CCCOc1ccc(cc1)O 271570a_203496583355_100000169948 [1,0,0,0,0,0|2,0,0]=3 1121 B11R1.1 CCCOc1ccc(cn1)O 271570a_203496583355_100011465619 [1,0,0,0,0,0|3,0,0]=4 1122 B11R1.1 CCCOc1ccc(nc1)O 271570a_203496583355_100000719977 [1,0,0,0,0,0|3,0,0]=4 1123 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000210303_100000752885 [1,0,0,0,0,0|3,0,0]=4 1124 B11R1.1 CCCSc1ccc(cc1)Br 62a_100000752885_100000210303 [1,0,0,0,0,0|3,0,0]=4 1125 B11R1.1 CCCSc1ccc(cc1)C 62a_100000186775_100000210303 [1,0,0,0,0,0|3,0,0]=4 1126 B11R1.1 CCCSc1ccc(cc1)C 62a_100000210303_100000186775 [1,0,0,0,0,0|3,0,0]=4 1127 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000210303_100000755918 [1,0,0,0,0,0|3,0,0]=4 1128 B11R1.1 CCCSc1ccc(cc1)Cl 62a_100000755918_100000210303 [1,0,0,0,0,0|3,0,0]=4 1129 B11R1.1 CCCSc1ccc(cc1)F 62a_100000210303_100000211213 [1,0,0,0,0,0|3,0,0]=4 1130 B11R1.1 CCCSc1ccc(cc1)F 62a_100000211213_100000210303 [1,0,0,0,0,0|3,0,0]=4 1131 B11R1.1 CCCSc1ccc(cc1)N 62a_100000185761_100000210303 [1,0,0,0,0,0|3,0,0]=4 1132 B11R1.1 CCCSc1ccc(cc1)N 62a_100000210303_100000185761 [1,0,0,0,0,0|3,0,0]=4 1133 B11R1.1 CCCSc1ccc(cc1)O 271570a_203496583355_200009811899 [1,0,0,0,0,0|2,0,0]=3 1134 B11R1.1 CCCSc1ccc(cc1)O 62a_100000210303_100000185759 [1,0,0,0,0,0|2,0,0]=3 1135 B11R1.1 CCCSc1ccc(cn1)O 62a_100000210303_100000744096 [1,0,0,0,0,0|3,0,0]=4 1136 B11R1.1 CCCSc1ccc(cn1)O 62a_100000685995_100000210303 [1,0,0,0,0,0|3,0,0]=4 1137 B11R1.1 CCNCc1ccc(cc1)Br 207a_100015525214_100000186029 [1,0,0,0,0,0|3,0,0]=4 1138 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100000174875_100000210202 [1,0,0,0,0,0|3,0,0]=4 1139 B11R1.1 CCNCc1ccc(cc1)Br 2230a_100015525214_100011217064 [1,0,0,0,0,0|3,0,0]=4 1140 B11R1.1 CCNCc1ccc(cc1)Br 270004a_100015525214_100000186029 [1,0,0,0,0,0|3,0,0]=4 1141 B11R1.1 CCNCc1ccc(cc1)Br 34a_100000174875_100000210202 [1,0,0,0,0,0|3,0,0]=4 1142 B11R1.1 CCNCc1ccc(cc1)C 207a_100015525214_100000211033 [1,0,0,0,0,0|3,0,0]=4 1143 B11R1.1 CCNCc1ccc(cc1)C 2230a_100000174908_100000210202 [1,0,0,0,0,0|3,0,0]=4 1144 B11R1.1 CCNCc1ccc(cc1)C 2230a_100015525214_100000210814 [1,0,0,0,0,0|3,0,0]=4 1145 B11R1.1 CCNCc1ccc(cc1)C 270004a_100015525214_100000211033 [1,0,0,0,0,0|3,0,0]=4 1146 B11R1.1 CCNCc1ccc(cc1)C 34a_100000174908_100000210202 [1,0,0,0,0,0|3,0,0]=4 1147 B11R1.1 CCNCc1ccc(cc1)Cl 207a_100015525214_100000189385 [1,0,0,0,0,0|3,0,0]=4 1148 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100000174871_100000210202 [1,0,0,0,0,0|3,0,0]=4 1149 B11R1.1 CCNCc1ccc(cc1)Cl 2230a_100015525214_100000694040 [1,0,0,0,0,0|3,0,0]=4 1150 B11R1.1 CCNCc1ccc(cc1)Cl 270004a_100015525214_100000189385 [1,0,0,0,0,0|3,0,0]=4 1151 B11R1.1 CCNCc1ccc(cc1)Cl 34a_100000174871_100000210202 [1,0,0,0,0,0|3,0,0]=4 1152 B11R1.1 CCNCc1ccc(cc1)F 207a_100015525214_100000210084 [1,0,0,0,0,0|3,0,0]=4 1153 B11R1.1 CCNCc1ccc(cc1)F 2230a_100000174882_100000210202 [1,0,0,0,0,0|3,0,0]=4 1154 B11R1.1 CCNCc1ccc(cc1)F 2230a_100015525214_100000198546 [1,0,0,0,0,0|3,0,0]=4 1155 B11R1.1 CCNCc1ccc(cc1)F 270004a_100015525214_100000210084 [1,0,0,0,0,0|3,0,0]=4 1156 B11R1.1 CCNCc1ccc(cc1)F 34a_100000174882_100000210202 [1,0,0,0,0,0|3,0,0]=4 1157 B11R1.1 CCNCc1ccc(cc1)I 207a_100015525214_100000188517 [1,0,0,0,0,0|3,0,0]=4 1158 B11R1.1 CCNCc1ccc(cc1)I 2230a_100015525214_100000189116 [1,0,0,0,0,0|3,0,0]=4 1159 B11R1.1 CCNCc1ccc(cc1)I 2230a_100016989417_100000210202 [1,0,0,0,0,0|3,0,0]=4 1160 B11R1.1 CCNCc1ccc(cc1)I 34a_100016989417_100000210202 [1,0,0,0,0,0|3,0,0]=4 1161 B11R1.1 CCNCc1ccc(cc1)O 271570a_203496583355_100000187385 [1,0,0,0,0,0|2,0,0]=3 1162 B11R1.1 CCNCc1ccc(cc1)O 34a_100000185549_100000210202 [1,0,0,0,0,0|2,0,0]=3 1163 B11R1.1 CCNCc1ccc(nc1)O 207a_100015525214_100011361521 [1,0,0,0,0,0|3,0,0]=4 1164 B11R1.1 CCNCc1ccc(nc1)O 2230a_100000757128_100000210202 [1,0,0,0,0,0|3,0,0]=4 1165 B11R1.1 CCOCc1ccc(cc1)Br 34a_100000695286_100000210202 [1,0,0,0,0,0|3,0,0]=4 1166 B11R1.1 CCOCc1ccc(cc1)Br 34a_100121572206_100000189115 [1,0,0,0,0,0|3,0,0]=4 1167 B11R1.1 CCOCc1ccc(cc1)C 34a_100011215236_100000210202 [1,0,0,0,0,0|3,0,0]=4 1168 B11R1.1 CCOCc1ccc(cc1)C 34a_100121572206_100000210814 [1,0,0,0,0,0|3,0,0]=4 1169 B11R1.1 CCOCc1ccc(cc1)C 7a_100011215236_100000210202 [1,0,0,0,0,0|3,0,0]=4 1170 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [1,0,0,0,0,0|3,0,0]=4 1171 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [1,0,0,0,0,0|3,0,0]=4 1172 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [1,0,0,0,0,0|3,0,0]=4 1173 B11R1.1 CCOCc1ccc(cc1)F 34a_100000210977_100000210202 [1,0,0,0,0,0|3,0,0]=4 1174 B11R1.1 CCOCc1ccc(cc1)F 34a_100121572206_100000198546 [1,0,0,0,0,0|3,0,0]=4 1175 B11R1.1 CCOCc1ccc(cc1)F 7a_100000210977_100000210202 [1,0,0,0,0,0|3,0,0]=4 1176 B11R1.1 CCOCc1ccc(cc1)I 34a_100000690907_100000210202 [1,0,0,0,0,0|3,0,0]=4 1177 B11R1.1 CCOCc1ccc(cc1)I 34a_100121572206_100000189116 [1,0,0,0,0,0|3,0,0]=4 1178 B11R1.1 CCOCc1ccc(cc1)I 7a_100000690907_100000210202 [1,0,0,0,0,0|3,0,0]=4 1179 B11R1.1 CCOCc1ccc(cc1)N 34a_100011215238_100000210202 [1,0,0,0,0,0|3,0,0]=4 1180 B11R1.1 CCOCc1ccc(cc1)O 271570a_203496583355_100000758564 [1,0,0,0,0,0|2,0,0]=3 1181 B11R1.1 CCOCc1ccc(nc1)O 271570a_203496583355_100011206209 [1,0,0,0,0,0|3,0,0]=4 1182 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000189115_100000210202 [1,0,0,0,0,0|3,0,0]=4 1183 B11R1.1 CCSCc1ccc(cc1)Br 62a_100000210202_100000189115 [1,0,0,0,0,0|3,0,0]=4 1184 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210202_100000210814 [1,0,0,0,0,0|3,0,0]=4 1185 B11R1.1 CCSCc1ccc(cc1)C 62a_100000210814_100000210202 [1,0,0,0,0,0|3,0,0]=4 1186 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000187161_100000210202 [1,0,0,0,0,0|3,0,0]=4 1187 B11R1.1 CCSCc1ccc(cc1)Cl 62a_100000210202_100000187161 [1,0,0,0,0,0|3,0,0]=4 1188 B11R1.1 CCSCc1ccc(cc1)F 62a_100000198546_100000210202 [1,0,0,0,0,0|3,0,0]=4 1189 B11R1.1 CCSCc1ccc(cc1)F 62a_100000210202_100000187164 [1,0,0,0,0,0|3,0,0]=4 1190 B11R1.1 CCSCc1ccc(cc1)I 62a_100000189116_100000210202 [1,0,0,0,0,0|3,0,0]=4 1191 B11R1.1 CCSCc1ccc(cc1)I 62a_100000210202_100000189116 [1,0,0,0,0,0|3,0,0]=4 1192 B11R1.1 CNCCc1ccc(cc1)Br 2230a_100000755846_200000210301 [1,0,0,0,0,0|1,0,0]=2 1193 B11R1.1 CNCCc1ccc(cc1)Br 2230a_106832991635_100011740612 [1,0,0,0,0,0|1,0,0]=2 1194 B11R1.1 CNCCc1ccc(cc1)Br 34a_100000755846_200000210301 [1,0,0,0,0,0|1,0,0]=2 1195 B11R1.1 CNCCc1ccc(cc1)Br 34a_100102657272_100011740612 [1,0,0,0,0,0|1,0,0]=2 1196 B11R1.1 CNCCc1ccc(cc1)Br 7a_106832991635_100011740612 [1,0,0,0,0,0|1,0,0]=2 1197 B11R1.1 CNCCc1ccc(cc1)C 2230a_100000705350_200000210301 [1,0,0,0,0,0|1,0,0]=2 1198 B11R1.1 CNCCc1ccc(cc1)C 2230a_106832991635_100011713686 [1,0,0,0,0,0|1,0,0]=2 1199 B11R1.1 CNCCc1ccc(cc1)C 34a_100000705350_200000210301 [1,0,0,0,0,0|1,0,0]=2 1200 B11R1.1 CNCCc1ccc(cc1)C 34a_100102657272_100011713686 [1,0,0,0,0,0|1,0,0]=2 1201 B11R1.1 CNCCc1ccc(cc1)C 7a_106832991635_100011713686 [1,0,0,0,0,0|1,0,0]=2 1202 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_100000185265_200000210301 [1,0,0,0,0,0|1,0,0]=2 1203 B11R1.1 CNCCc1ccc(cc1)Cl 2230a_106832991635_100011713675 [1,0,0,0,0,0|1,0,0]=2 1204 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100000185265_200000210301 [1,0,0,0,0,0|1,0,0]=2 1205 B11R1.1 CNCCc1ccc(cc1)Cl 34a_100102657272_100011713675 [1,0,0,0,0,0|1,0,0]=2 1206 B11R1.1 CNCCc1ccc(cc1)Cl 7a_106832991635_100011713675 [1,0,0,0,0,0|1,0,0]=2 1207 B11R1.1 CNCCc1ccc(cc1)F 2230a_100000199005_200000210301 [1,0,0,0,0,0|1,0,0]=2 1208 B11R1.1 CNCCc1ccc(cc1)F 2230a_106832991635_100011217392 [1,0,0,0,0,0|1,0,0]=2 1209 B11R1.1 CNCCc1ccc(cc1)F 34a_100000199005_200000210301 [1,0,0,0,0,0|1,0,0]=2 1210 B11R1.1 CNCCc1ccc(cc1)F 34a_100102657272_100011217392 [1,0,0,0,0,0|1,0,0]=2 1211 B11R1.1 CNCCc1ccc(cc1)F 7a_106832991635_100011217392 [1,0,0,0,0,0|1,0,0]=2 1212 B11R1.1 CNCCc1ccc(cc1)O 2230a_106832991635_100009816426 [1,0,0,0,0,0|0,0,0]=1 1213 B11R1.1 CNCCc1ccc(cc1)O 271570a_203496583355_100000752880 [1,0,0,0,0,0|0,0,0]=1 1214 B11R1.1 CNCCc1ccc(cc1)O 34a_100000743037_200000210301 [1,0,0,0,0,0|0,0,0]=1 1215 B11R1.1 CNCCc1ccc(cc1)O 7a_106832991635_100009816426 [1,0,0,0,0,0|0,0,0]=1 1216 B11R1.1 COC=Cc1ccc(cc1)O 271570a_203496583355_100020630460 [1,0,0,0,0,0|1,0,2]=4 1217 B11R1.1 COCCc1ccc(cc1)Br 34a_100000766406_200000210301 [1,0,0,0,0,0|2,0,0]=3 1218 B11R1.1 COCCc1ccc(cc1)Br 34a_100138415774_100011740612 [1,0,0,0,0,0|2,0,0]=3 1219 B11R1.1 COCCc1ccc(cc1)Br 7a_100000766406_200000210301 [1,0,0,0,0,0|2,0,0]=3 1220 B11R1.1 COCCc1ccc(cc1)C 34a_100000756670_200000210301 [1,0,0,0,0,0|2,0,0]=3 1221 B11R1.1 COCCc1ccc(cc1)C 34a_100138415774_100011713686 [1,0,0,0,0,0|2,0,0]=3 1222 B11R1.1 COCCc1ccc(cc1)C 7a_100000756670_200000210301 [1,0,0,0,0,0|2,0,0]=3 1223 B11R1.1 COCCc1ccc(cc1)Cl 34a_100011219627_200000210301 [1,0,0,0,0,0|2,0,0]=3 1224 B11R1.1 COCCc1ccc(cc1)Cl 34a_100138415774_100011713675 [1,0,0,0,0,0|2,0,0]=3 1225 B11R1.1 COCCc1ccc(cc1)Cl 7a_100011219627_200000210301 [1,0,0,0,0,0|2,0,0]=3 1226 B11R1.1 COCCc1ccc(cc1)F 34a_100000754732_200000210301 [1,0,0,0,0,0|2,0,0]=3 1227 B11R1.1 COCCc1ccc(cc1)F 34a_100138415774_100011217392 [1,0,0,0,0,0|2,0,0]=3 1228 B11R1.1 COCCc1ccc(cc1)F 7a_100000754732_200000210301 [1,0,0,0,0,0|2,0,0]=3 1229 B11R1.1 COCCc1ccc(cc1)I 34a_100012291149_200000210301 [1,0,0,0,0,0|2,0,0]=3 1230 B11R1.1 COCCc1ccc(cc1)I 7a_100012291149_200000210301 [1,0,0,0,0,0|2,0,0]=3 1231 B11R1.1 COCCc1ccc(cc1)N 34a_100011204434_200000210301 [1,0,0,0,0,0|2,0,0]=3 1232 B11R1.1 COCCc1ccc(cc1)O 271570a_203496583355_100000739703 [1,0,0,0,0,0|1,0,0]=2 1233 B11R1.1 COCCc1ccc(cn1)Br 34a_100012357577_200000210301 [1,0,0,0,0,0|3,0,0]=4 1234 B11R1.1 COCCc1ccc(nc1)C 34a_100011815783_200000210301 [1,0,0,0,0,0|3,0,0]=4 1235 B11R1.1 COCCc1ccc(nc1)Cl 34a_100009880866_200000210301 [1,0,0,0,0,0|3,0,0]=4 1236 B11R1.1 COCCc1ccc(nc1)Cl 7a_100009880866_200000210301 [1,0,0,0,0,0|3,0,0]=4 1237 B11R1.1 COCNc1ccc(cc1)Br 2230a_100000210018_100000766300 [1,0,0,0,0,0|3,0,0]=4 1238 B11R1.1 COCNc1ccc(cc1)Cl 2230a_100000210052_100000766300 [1,0,0,0,0,0|3,0,0]=4 1239 B11R1.1 COCOc1ccc(cc1)O 271570a_203496583355_100012265687 [1,0,0,0,0,0|2,0,0]=3 1240 B11R1.1 COCOc1ccc(nc1)O 271570a_203496583355_100012568617 [1,0,0,0,0,0|3,0,0]=4 1241 B11R1.1 COCSc1ccc(cc1)Br 62a_100000752885_100000766300 [1,0,0,0,0,0|3,0,0]=4 1242 B11R1.1 COCSc1ccc(cc1)Br 62a_100000766300_100000752885 [1,0,0,0,0,0|3,0,0]=4 1243 B11R1.1 COCSc1ccc(cc1)C 62a_100000186775_100000766300 [1,0,0,0,0,0|3,0,0]=4 1244 B11R1.1 COCSc1ccc(cc1)C 62a_100000766300_100000186775 [1,0,0,0,0,0|3,0,0]=4 1245 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000755918_100000766300 [1,0,0,0,0,0|3,0,0]=4 1246 B11R1.1 COCSc1ccc(cc1)Cl 62a_100000766300_100000755918 [1,0,0,0,0,0|3,0,0]=4 1247 B11R1.1 COCSc1ccc(cc1)F 62a_100000211213_100000766300 [1,0,0,0,0,0|3,0,0]=4 1248 B11R1.1 COCSc1ccc(cc1)F 62a_100000766300_100000211213 [1,0,0,0,0,0|3,0,0]=4 1249 B11R1.1 COCSc1ccc(cc1)N 62a_100000185761_100000766300 [1,0,0,0,0,0|3,0,0]=4 1250 B11R1.1 COCSc1ccc(cc1)N 62a_100000766300_100000185761 [1,0,0,0,0,0|3,0,0]=4 1251 B11R1.1 COCSc1ccc(cc1)O 62a_100000766300_100000185759 [1,0,0,0,0,0|2,0,0]=3 1252 B11R1.1 COCSc1ccc(cn1)O 62a_100000685995_100000766300 [1,0,0,0,0,0|3,0,0]=4 1253 B11R1.1 COCSc1ccc(cn1)O 62a_100000766300_100000744096 [1,0,0,0,0,0|3,0,0]=4 1254 B11R1.1 CSCCc1ccc(cc1)Br 62a_100011740612_200000210301 [1,0,0,0,0,0|2,0,0]=3 1255 B11R1.1 CSCCc1ccc(cc1)Br 62a_200000210301_100011740612 [1,0,0,0,0,0|2,0,0]=3 1256 B11R1.1 CSCCc1ccc(cc1)C 62a_100011713686_200000210301 [1,0,0,0,0,0|2,0,0]=3 1257 B11R1.1 CSCCc1ccc(cc1)C 62a_200000210301_100011713686 [1,0,0,0,0,0|2,0,0]=3 1258 B11R1.1 CSCCc1ccc(cc1)Cl 62a_100011713675_200000210301 [1,0,0,0,0,0|2,0,0]=3 1259 B11R1.1 CSCCc1ccc(cc1)Cl 62a_200000210301_100011713675 [1,0,0,0,0,0|2,0,0]=3 1260 B11R1.1 CSCCc1ccc(cc1)F 62a_100011217392_200000210301 [1,0,0,0,0,0|2,0,0]=3 1261 B11R1.1 CSCCc1ccc(cc1)F 62a_200000210301_100011217392 [1,0,0,0,0,0|2,0,0]=3 1262 B11R1.1 CSCCc1ccc(cc1)O 62a_100009816426_200000210301 [1,0,0,0,0,0|1,0,0]=2 1263 B11R1.1 CSCCc1ccc(cc1)O 62a_200000210301_100009816426 [1,0,0,0,0,0|1,0,0]=2 1264 B11R1.1 CSCNc1ccc(cc1)Br 2230a_100000210018_100011218213 [1,0,0,0,0,0|3,0,0]=4 1265 B11R1.1 CSCNc1ccc(cc1)Br 34a_100000210018_100011218213 [1,0,0,0,0,0|3,0,0]=4 1266 B11R1.1 CSCNc1ccc(cc1)C 34a_100000124888_100011218213 [1,0,0,0,0,0|3,0,0]=4 1267 B11R1.1 CSCNc1ccc(cc1)Cl 2230a_100000210052_100011218213 [1,0,0,0,0,0|3,0,0]=4 1268 B11R1.1 CSCNc1ccc(cc1)Cl 34a_100000210052_100011218213 [1,0,0,0,0,0|3,0,0]=4 1269 B11R1.1 CSCNc1ccc(cc1)F 34a_100000185862_100011218213 [1,0,0,0,0,0|3,0,0]=4 1270 B11R1.1 CSCNc1ccc(cc1)I 34a_100000185761_100011218213 [1,0,0,0,0,0|3,0,0]=4 1271 B11R1.1 CSCNc1ccc(cc1)O 34a_100000185829_100011218213 [1,0,0,0,0,0|2,0,0]=3 1272 B11R1.1 CSCOc1ccc(cc1)Br 34a_100000185759_100011218213 [1,0,0,0,0,0|3,0,0]=4 1273 B11R1.1 CSCOc1ccc(cc1)C 34a_100000210336_100011218213 [1,0,0,0,0,0|3,0,0]=4 1274 B11R1.1 CSCOc1ccc(cc1)Cl 34a_100000210216_100011218213 [1,0,0,0,0,0|3,0,0]=4 1275 B11R1.1 CSCOc1ccc(cc1)F 34a_100000210339_100011218213 [1,0,0,0,0,0|3,0,0]=4 1276 B11R1.1 CSCOc1ccc(cc1)I 34a_100000212066_100011218213 [1,0,0,0,0,0|3,0,0]=4 1277 B11R1.1 CSCOc1ccc(cc1)N 34a_100000185829_100011218213 [1,0,0,0,0,0|3,0,0]=4 1278 B11R1.1 CSCSc1ccc(cc1)Br 62a_100000752885_100011218213 [1,0,0,0,0,0|3,0,0]=4 1279 B11R1.1 CSCSc1ccc(cc1)Br 62a_100011218213_100000752885 [1,0,0,0,0,0|3,0,0]=4 1280 B11R1.1 CSCSc1ccc(cc1)C 62a_100000186775_100011218213 [1,0,0,0,0,0|3,0,0]=4 1281 B11R1.1 CSCSc1ccc(cc1)C 62a_100011218213_100000186775 [1,0,0,0,0,0|3,0,0]=4 1282 B11R1.1 CSCSc1ccc(cc1)Cl 62a_100000755918_100011218213 [1,0,0,0,0,0|3,0,0]=4 1283 B11R1.1 CSCSc1ccc(cc1)Cl 62a_100011218213_100000755918 [1,0,0,0,0,0|3,0,0]=4 1284 B11R1.1 CSCSc1ccc(cc1)F 62a_100000211213_100011218213 [1,0,0,0,0,0|3,0,0]=4 1285 B11R1.1 CSCSc1ccc(cc1)F 62a_100011218213_100000211213 [1,0,0,0,0,0|3,0,0]=4 1286 B11R1.1 CSCSc1ccc(cc1)N 62a_100000185761_100011218213 [1,0,0,0,0,0|3,0,0]=4 1287 B11R1.1 CSCSc1ccc(cc1)N 62a_100011218213_100000185761 [1,0,0,0,0,0|3,0,0]=4 1288 B11R1.1 CSCSc1ccc(cc1)O 62a_100011218213_100000185759 [1,0,0,0,0,0|2,0,0]=3 1289 B11R1.1 CSCSc1ccc(cn1)O 62a_100000685995_100011218213 [1,0,0,0,0,0|3,0,0]=4 1290 B11R1.1 CSCSc1ccc(cn1)O 62a_100011218213_100000744096 [1,0,0,0,0,0|3,0,0]=4 1291 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 2230a_100000705350_200025704644 [1,0,0,0,0,0|1,0,0]=2 1292 B11R1.1 Cc1ccc(cc1)CCN[13CH3] 34a_100000705350_200025704644 [1,0,0,0,0,0|1,0,0]=2 1293 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 34a_100000756670_200025704644 [1,0,0,0,0,0|2,0,0]=3 1294 B11R1.1 Cc1ccc(cc1)CCO[13CH3] 7a_100000756670_200025704644 [1,0,0,0,0,0|2,0,0]=3 1295 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_100011713686_200025704644 [1,0,0,0,0,0|2,0,0]=3 1296 B11R1.1 Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713686 [1,0,0,0,0,0|2,0,0]=3 1297 B11R1.1 Cc1ccc(cn1)CCO[13CH3] 34a_100011815783_200025704644 [1,0,0,0,0,0|3,0,0]=4 1298 B11R1.1 N#CCCc1ccc(cc1)O 271570a_203496583355_100011216407 [1,0,0,0,0,0|2,0,0]=3 1299 B11R1.1 N#CCOc1ccc(cc1)O 271570a_203496583355_200000169425 [1,0,0,0,0,0|3,0,0]=4 1300 B11R1.1 N#CCSc1ccc(cc1)O 62a_100011215382_100000185759 [1,0,0,0,0,0|3,0,0]=4 1301 B11R1.1 N#CSCc1ccc(cc1)O 271570a_203496583355_200010141448 [1,0,0,0,0,0|3,0,0]=4 1302 B11R1.1 NCCCc1ccc(cc1)O 271570a_203496583355_100011297623 [1,0,0,0,0,0|2,0,0]=3 1303 B11R1.1 NCCOc1ccc(cc1)O 271570a_203496583355_100000746992 [1,0,0,0,0,0|3,0,0]=4 1304 B11R1.1 NCCSc1ccc(cc1)O 271570a_203496583355_100000184645 [1,0,0,0,0,0|3,0,0]=4 1305 B11R1.1 O=CCCc1ccc(cc1)O 271570a_203496583355_100011361538 [1,0,0,0,0,0|2,0,0]=3 1306 B11R1.1 O=CCNc1ccc(cc1)O 34a_100000185829_200009817547 [1,0,0,0,0,0|3,0,0]=4 1307 B11R1.1 O=CCSc1ccc(cc1)O 62a_200015260668_100000185759 [1,0,0,0,0,0|3,0,0]=4 1308 B11R1.1 OCCCc1ccc(cc1)O 271570a_203496583355_100011709247 [1,0,0,0,0,0|2,0,0]=3 1309 B11R1.1 OCCNc1ccc(cc1)O 34a_100000185829_100000211926 [1,0,0,0,0,0|3,0,0]=4 1310 B11R1.1 OCCOc1ccc(cc1)O 271570a_203496583355_100000686261 [1,0,0,0,0,0|3,0,0]=4 1311 B11R1.1 OCCSc1ccc(cc1)O 62a_100000211926_100000185759 [1,0,0,0,0,0|3,0,0]=4 1312 B11R1.1 Oc1ccc(cc1)CNCF 34a_100000185549_100015361967 [1,0,0,0,0,0|3,0,0]=4 1313 B11R1.1 Oc1ccc(cc1)NCCF 34a_100000185829_100011217306 [1,0,0,0,0,0|3,0,0]=4 1314 B11R1.1 Oc1ccc(cc1)OCCF 271570a_203496583355_100012347556 [1,0,0,0,0,0|3,0,0]=4 1315 B11R1.1 Oc1ccc(cc1)SCCF 62a_100011217306_100000185759 [1,0,0,0,0,0|3,0,0]=4 1316 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 2230a_100000755846_200025704644 [1,0,0,0,0,0|1,0,0]=2 1317 B11R1.1 [13CH3]NCCc1ccc(cc1)Br 34a_100000755846_200025704644 [1,0,0,0,0,0|1,0,0]=2 1318 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 2230a_100000185265_200025704644 [1,0,0,0,0,0|1,0,0]=2 1319 B11R1.1 [13CH3]NCCc1ccc(cc1)Cl 34a_100000185265_200025704644 [1,0,0,0,0,0|1,0,0]=2 1320 B11R1.1 [13CH3]NCCc1ccc(cc1)F 2230a_100000199005_200025704644 [1,0,0,0,0,0|1,0,0]=2 1321 B11R1.1 [13CH3]NCCc1ccc(cc1)F 34a_100000199005_200025704644 [1,0,0,0,0,0|1,0,0]=2 1322 B11R1.1 [13CH3]NCCc1ccc(cc1)O 34a_100000743037_200025704644 [1,0,0,0,0,0|0,0,0]=1 1323 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 34a_100000766406_200025704644 [1,0,0,0,0,0|2,0,0]=3 1324 B11R1.1 [13CH3]OCCc1ccc(cc1)Br 7a_100000766406_200025704644 [1,0,0,0,0,0|2,0,0]=3 1325 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 34a_100011219627_200025704644 [1,0,0,0,0,0|2,0,0]=3 1326 B11R1.1 [13CH3]OCCc1ccc(cc1)Cl 7a_100011219627_200025704644 [1,0,0,0,0,0|2,0,0]=3 1327 B11R1.1 [13CH3]OCCc1ccc(cc1)F 34a_100000754732_200025704644 [1,0,0,0,0,0|2,0,0]=3 1328 B11R1.1 [13CH3]OCCc1ccc(cc1)F 7a_100000754732_200025704644 [1,0,0,0,0,0|2,0,0]=3 1329 B11R1.1 [13CH3]OCCc1ccc(cc1)I 34a_100012291149_200025704644 [1,0,0,0,0,0|2,0,0]=3 1330 B11R1.1 [13CH3]OCCc1ccc(cc1)I 7a_100012291149_200025704644 [1,0,0,0,0,0|2,0,0]=3 1331 B11R1.1 [13CH3]OCCc1ccc(cc1)N 34a_100011204434_200025704644 [1,0,0,0,0,0|2,0,0]=3 1332 B11R1.1 [13CH3]OCCc1ccc(cn1)Br 34a_100012357577_200025704644 [1,0,0,0,0,0|3,0,0]=4 1333 B11R1.1 [13CH3]OCCc1ccc(nc1)Cl 34a_100009880866_200025704644 [1,0,0,0,0,0|3,0,0]=4 1334 B11R1.1 [13CH3]OCCc1ccc(nc1)Cl 7a_100009880866_200025704644 [1,0,0,0,0,0|3,0,0]=4 1335 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_100011740612_200025704644 [1,0,0,0,0,0|2,0,0]=3 1336 B11R1.1 [13CH3]SCCc1ccc(cc1)Br 62a_200025704644_100011740612 [1,0,0,0,0,0|2,0,0]=3 1337 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_100011713675_200025704644 [1,0,0,0,0,0|2,0,0]=3 1338 B11R1.1 [13CH3]SCCc1ccc(cc1)Cl 62a_200025704644_100011713675 [1,0,0,0,0,0|2,0,0]=3 1339 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_100011217392_200025704644 [1,0,0,0,0,0|2,0,0]=3 1340 B11R1.1 [13CH3]SCCc1ccc(cc1)F 62a_200025704644_100011217392 [1,0,0,0,0,0|2,0,0]=3 1341 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_100009816426_200025704644 [1,0,0,0,0,0|1,0,0]=2 1342 B11R1.1 [13CH3]SCCc1ccc(cc1)O 62a_200025704644_100009816426 [1,0,0,0,0,0|1,0,0]=2 1343 B11R1.24 C#CCNc1cccc(c1)O 34a_100000210217_100000184674 [1,0,0,0,0,0|2,0,1]=4 1344 B11R1.24 C#CCSc1cccc(c1)O 62a_100000038162_100000211634 [1,0,0,0,0,0|2,0,1]=4 1345 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [1,0,0,0,0,0|2,0,1]=4 1346 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [1,0,0,0,0,0|2,0,1]=4 1347 B11R1.24 CCCCc1cc(ccn1)C 271570a_100020621405_100000750283 [1,0,0,0,0,0|3,0,0]=4 1348 B11R1.24 CCCCc1cc(ccn1)Cl 271570a_100020621405_100010167805 [1,0,0,0,0,0|3,0,0]=4 1349 B11R1.24 CCCCc1cc(ccn1)F 271570a_100020621405_100009817058 [1,0,0,0,0,0|3,0,0]=4 1350 B11R1.24 CCCCc1cc(ccn1)N 271570a_100020621405_100009814236 [1,0,0,0,0,0|3,0,0]=4 1351 B11R1.24 CCCCc1cc(ccn1)O 271570a_100020621405_100000762945 [1,0,0,0,0,0|2,0,0]=3 1352 B11R1.24 CCCCc1cc(cnn1)O 271570a_100020621405_200010734679 [1,0,0,0,0,0|3,0,0]=4 1353 B11R1.24 CCCCc1cc(ncn1)O 271570a_100020621405_100000765262 [1,0,0,0,0,0|3,0,0]=4 1354 B11R1.24 CCCCc1cc[nH]c(=O)c1 271570a_100020621405_100009816521 [1,0,0,0,0,0|2,0,1]=4 1355 B11R1.24 CCCCc1ccc[n+](c1)C 271570a_100020621405_100009996589 [1,0,0,0,0,0|3,0,0]=4 1356 B11R1.24 CCCCc1ccc[n+](c1)[O-] 271570a_100020621405_100009815978 [1,0,0,0,0,0|2,0,1]=4 1357 B11R1.24 CCCCc1cccc(=O)[nH]1 271570a_100020621405_100000761760 [1,0,0,0,0,0|2,0,1]=4 1358 B11R1.24 CCCCc1cccc(c1)Br 271570a_100020621405_100000691529 [1,0,0,0,0,0|2,0,0]=3 1359 B11R1.24 CCCCc1cccc(c1)C 271570a_100020621405_100011215228 [1,0,0,0,0,0|2,0,0]=3 1360 B11R1.24 CCCCc1cccc(c1)Cl 271570a_100020621405_100000699651 [1,0,0,0,0,0|2,0,0]=3 1361 B11R1.24 CCCCc1cccc(c1)F 271570a_100020621405_100000685547 [1,0,0,0,0,0|2,0,0]=3 1362 B11R1.24 CCCCc1cccc(c1)N 271570a_100020621405_100000210019 [1,0,0,0,0,0|2,0,0]=3 1363 B11R1.24 CCCCc1cccc(c1)O 271570a_100020621405_100000211634 [1,0,0,0,0,0|1,0,0]=2 1364 B11R1.24 CCCCc1cccc(c1)O 271570a_203496583355_200010244551 [1,0,0,0,0,0|1,0,0]=2 1365 B11R1.24 CCCCc1cccc(c1)[S] 271570a_100020621405_114929384022 [1,0,0,0,0,0|1,1,0]=3 1366 B11R1.24 CCCCc1cccc(n1)Br 271570a_100020621405_100000684672 [1,0,0,0,0,0|3,0,0]=4 1367 B11R1.24 CCCCc1cccc(n1)C 271570a_100020621405_100000742759 [1,0,0,0,0,0|3,0,0]=4 1368 B11R1.24 CCCCc1cccc(n1)F 271570a_100020621405_100009815982 [1,0,0,0,0,0|3,0,0]=4 1369 B11R1.24 CCCCc1cccc(n1)N 271570a_100020621405_100000740741 [1,0,0,0,0,0|3,0,0]=4 1370 B11R1.24 CCCCc1ccnc(c1)Br 271570a_100020621405_100009814637 [1,0,0,0,0,0|3,0,0]=4 1371 B11R1.24 CCCCc1ccnc(c1)C 271570a_100020621405_100000758586 [1,0,0,0,0,0|3,0,0]=4 1372 B11R1.24 CCCCc1ccnc(c1)Cl 271570a_100020621405_100000035001 [1,0,0,0,0,0|3,0,0]=4 1373 B11R1.24 CCCCc1ccnc(c1)F 271570a_100020621405_100009816116 [1,0,0,0,0,0|3,0,0]=4 1374 B11R1.24 CCCCc1ccnc(c1)N 271570a_100020621405_100000744379 [1,0,0,0,0,0|3,0,0]=4 1375 B11R1.24 CCCCc1cncc(c1)Br 271570a_100020621405_100000728054 [1,0,0,0,0,0|3,0,0]=4 1376 B11R1.24 CCCCc1cncc(c1)C 271570a_100020621405_100000760492 [1,0,0,0,0,0|3,0,0]=4 1377 B11R1.24 CCCCc1cncc(c1)Cl 271570a_100020621405_100000049639 [1,0,0,0,0,0|3,0,0]=4 1378 B11R1.24 CCCCc1cncc(c1)F 271570a_100020621405_100000744099 [1,0,0,0,0,0|3,0,0]=4 1379 B11R1.24 CCCCc1cncc(c1)N 271570a_100020621405_100000687067 [1,0,0,0,0,0|3,0,0]=4 1380 B11R1.24 CCCCc1cncc(c1)O 271570a_100020621405_100000754920 [1,0,0,0,0,0|2,0,0]=3 1381 B11R1.24 CCCCc1cncc(n1)O 271570a_100020621405_100011269956 [1,0,0,0,0,0|3,0,0]=4 1382 B11R1.24 CCCCc1nccc(n1)O 271570a_100020621405_100011649813 [1,0,0,0,0,0|3,0,0]=4 1383 B11R1.24 CCCNc1cccc(c1)Br 34a_100000210019_100000210303 [1,0,0,0,0,0|3,0,0]=4 1384 B11R1.24 CCCNc1cccc(c1)C 2230a_100000188690_100000210303 [1,0,0,0,0,0|3,0,0]=4 1385 B11R1.24 CCCNc1cccc(c1)C 34a_100000188690_100000210303 [1,0,0,0,0,0|3,0,0]=4 1386 B11R1.24 CCCNc1cccc(c1)Cl 34a_100000185859_100000210303 [1,0,0,0,0,0|3,0,0]=4 1387 B11R1.24 CCCNc1cccc(c1)F 34a_100000210047_100000210303 [1,0,0,0,0,0|3,0,0]=4 1388 B11R1.24 CCCNc1cccc(c1)I 34a_100000211102_100000210303 [1,0,0,0,0,0|3,0,0]=4 1389 B11R1.24 CCCNc1cccc(c1)O 34a_100000210217_100000210303 [1,0,0,0,0,0|2,0,0]=3 1390 B11R1.24 CCCNc1cccc(n1)O 271570a_203496583355_200025756634 [1,0,0,0,0,0|3,0,0]=4 1391 B11R1.24 CCCOc1cccc(c1)Br 34a_100000210342_100000210303 [1,0,0,0,0,0|3,0,0]=4 1392 B11R1.24 CCCOc1cccc(c1)Br 7a_100000210342_100000210303 [1,0,0,0,0,0|3,0,0]=4 1393 B11R1.24 CCCOc1cccc(c1)C 34a_100000210337_100000210303 [1,0,0,0,0,0|3,0,0]=4 1394 B11R1.24 CCCOc1cccc(c1)C 7a_100000210337_100000210303 [1,0,0,0,0,0|3,0,0]=4 1395 B11R1.24 CCCOc1cccc(c1)Cl 34a_100000210295_100000210303 [1,0,0,0,0,0|3,0,0]=4 1396 B11R1.24 CCCOc1cccc(c1)Cl 7a_100000210295_100000210303 [1,0,0,0,0,0|3,0,0]=4 1397 B11R1.24 CCCOc1cccc(c1)F 34a_100000210426_100000210303 [1,0,0,0,0,0|3,0,0]=4 1398 B11R1.24 CCCOc1cccc(c1)F 7a_100000210426_100000210303 [1,0,0,0,0,0|3,0,0]=4 1399 B11R1.24 CCCOc1cccc(c1)I 34a_100000211634_100000210303 [1,0,0,0,0,0|3,0,0]=4 1400 B11R1.24 CCCOc1cccc(c1)I 7a_100000211634_100000210303 [1,0,0,0,0,0|3,0,0]=4 1401 B11R1.24 CCCOc1cccc(c1)N 34a_100000210217_100000210303 [1,0,0,0,0,0|3,0,0]=4 1402 B11R1.24 CCCOc1cccc(c1)O 271570a_203496583355_100000170004 [1,0,0,0,0,0|2,0,0]=3 1403 B11R1.24 CCCOc1cccc(n1)O 271570a_203496583355_200011960250 [1,0,0,0,0,0|3,0,0]=4 1404 B11R1.24 CCCOc1cncc(c1)O 271570a_203496583355_200012029621 [1,0,0,0,0,0|3,0,0]=4 1405 B11R1.24 CCCSc1cc(ccn1)O 62a_100000210303_100000762945 [1,0,0,0,0,0|3,0,0]=4 1406 B11R1.24 CCCSc1cccc(c1)Br 62a_100000210303_100000691529 [1,0,0,0,0,0|3,0,0]=4 1407 B11R1.24 CCCSc1cccc(c1)Br 62a_100000691529_100000210303 [1,0,0,0,0,0|3,0,0]=4 1408 B11R1.24 CCCSc1cccc(c1)C 62a_100000210303_100011215228 [1,0,0,0,0,0|3,0,0]=4 1409 B11R1.24 CCCSc1cccc(c1)C 62a_100011215228_100000210303 [1,0,0,0,0,0|3,0,0]=4 1410 B11R1.24 CCCSc1cccc(c1)Cl 62a_100000210303_100000699651 [1,0,0,0,0,0|3,0,0]=4 1411 B11R1.24 CCCSc1cccc(c1)Cl 62a_100000699651_100000210303 [1,0,0,0,0,0|3,0,0]=4 1412 B11R1.24 CCCSc1cccc(c1)F 62a_100000210303_100000685547 [1,0,0,0,0,0|3,0,0]=4 1413 B11R1.24 CCCSc1cccc(c1)F 62a_100000685547_100000210303 [1,0,0,0,0,0|3,0,0]=4 1414 B11R1.24 CCCSc1cccc(c1)N 62a_100000210019_100000210303 [1,0,0,0,0,0|3,0,0]=4 1415 B11R1.24 CCCSc1cccc(c1)N 62a_100000210303_100000210019 [1,0,0,0,0,0|3,0,0]=4 1416 B11R1.24 CCCSc1cccc(c1)O 271570a_203496583355_200009815762 [1,0,0,0,0,0|2,0,0]=3 1417 B11R1.24 CCCSc1cccc(c1)O 62a_100000210303_100000211634 [1,0,0,0,0,0|2,0,0]=3 1418 B11R1.24 CCCSc1cccc(c1)[S] 62a_100000210303_114929384022 [1,0,0,0,0,0|2,1,0]=4 1419 B11R1.24 CCCSc1cccc(c1)[S] 62a_114929384022_100000210303 [1,0,0,0,0,0|2,1,0]=4 1420 B11R1.24 CCCSc1cncc(c1)O 62a_100000210303_100000754920 [1,0,0,0,0,0|3,0,0]=4 1421 B11R1.24 CCCSc1cncc(c1)O 62a_100000754920_100000210303 [1,0,0,0,0,0|3,0,0]=4 1422 B11R1.24 CCNCc1cccc(c1)Br 207a_100015525214_100000210085 [1,0,0,0,0,0|3,0,0]=4 1423 B11R1.24 CCNCc1cccc(c1)Br 2230a_100000174977_100000210202 [1,0,0,0,0,0|3,0,0]=4 1424 B11R1.24 CCNCc1cccc(c1)Br 2230a_100015525214_100000698116 [1,0,0,0,0,0|3,0,0]=4 1425 B11R1.24 CCNCc1cccc(c1)Br 270004a_100015525214_100000210085 [1,0,0,0,0,0|3,0,0]=4 1426 B11R1.24 CCNCc1cccc(c1)Br 34a_100000174977_100000210202 [1,0,0,0,0,0|3,0,0]=4 1427 B11R1.24 CCNCc1cccc(c1)C 207a_100015525214_100000211157 [1,0,0,0,0,0|3,0,0]=4 1428 B11R1.24 CCNCc1cccc(c1)C 2230a_100000185548_100000210202 [1,0,0,0,0,0|3,0,0]=4 1429 B11R1.24 CCNCc1cccc(c1)C 2230a_100015525214_100000211840 [1,0,0,0,0,0|3,0,0]=4 1430 B11R1.24 CCNCc1cccc(c1)C 270004a_100015525214_100000211157 [1,0,0,0,0,0|3,0,0]=4 1431 B11R1.24 CCNCc1cccc(c1)C 34a_100000185548_100000210202 [1,0,0,0,0,0|3,0,0]=4 1432 B11R1.24 CCNCc1cccc(c1)Cl 207a_100015525214_100000210801 [1,0,0,0,0,0|3,0,0]=4 1433 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100000174878_100000210202 [1,0,0,0,0,0|3,0,0]=4 1434 B11R1.24 CCNCc1cccc(c1)Cl 2230a_100015525214_100000181238 [1,0,0,0,0,0|3,0,0]=4 1435 B11R1.24 CCNCc1cccc(c1)Cl 270004a_100015525214_100000210801 [1,0,0,0,0,0|3,0,0]=4 1436 B11R1.24 CCNCc1cccc(c1)Cl 34a_100000174878_100000210202 [1,0,0,0,0,0|3,0,0]=4 1437 B11R1.24 CCNCc1cccc(c1)F 207a_100015525214_100000210812 [1,0,0,0,0,0|3,0,0]=4 1438 B11R1.24 CCNCc1cccc(c1)F 2230a_100000174948_100000210202 [1,0,0,0,0,0|3,0,0]=4 1439 B11R1.24 CCNCc1cccc(c1)F 2230a_100015525214_100000230114 [1,0,0,0,0,0|3,0,0]=4 1440 B11R1.24 CCNCc1cccc(c1)F 270004a_100015525214_100000210812 [1,0,0,0,0,0|3,0,0]=4 1441 B11R1.24 CCNCc1cccc(c1)F 34a_100000174948_100000210202 [1,0,0,0,0,0|3,0,0]=4 1442 B11R1.24 CCNCc1cccc(c1)I 207a_100015525214_100000014684 [1,0,0,0,0,0|3,0,0]=4 1443 B11R1.24 CCNCc1cccc(c1)I 2230a_100000106179_100000210202 [1,0,0,0,0,0|3,0,0]=4 1444 B11R1.24 CCNCc1cccc(c1)I 2230a_100015525214_100011218688 [1,0,0,0,0,0|3,0,0]=4 1445 B11R1.24 CCNCc1cccc(c1)I 270004a_100015525214_100000014684 [1,0,0,0,0,0|3,0,0]=4 1446 B11R1.24 CCNCc1cccc(c1)I 34a_100000106179_100000210202 [1,0,0,0,0,0|3,0,0]=4 1447 B11R1.24 CCNCc1cccc(c1)O 207a_100015525214_100000188321 [1,0,0,0,0,0|2,0,0]=3 1448 B11R1.24 CCNCc1cccc(c1)O 2230a_100000743036_100000210202 [1,0,0,0,0,0|2,0,0]=3 1449 B11R1.24 CCNCc1cccc(c1)O 2230a_100015525214_100011660834 [1,0,0,0,0,0|2,0,0]=3 1450 B11R1.24 CCNCc1cccc(c1)O 270004a_100015525214_100000188321 [1,0,0,0,0,0|2,0,0]=3 1451 B11R1.24 CCNCc1cccc(c1)O 271570a_203496583355_100000187426 [1,0,0,0,0,0|2,0,0]=3 1452 B11R1.24 CCNCc1cccc(c1)O 34a_100000743036_100000210202 [1,0,0,0,0,0|2,0,0]=3 1453 B11R1.24 CCNCc1ccnc(c1)O 207a_100015525214_100000688113 [1,0,0,0,0,0|3,0,0]=4 1454 B11R1.24 CCNCc1cncc(c1)O 207a_100015525214_100012187055 [1,0,0,0,0,0|3,0,0]=4 1455 B11R1.24 CCNCc1cncc(c1)O 270004a_100015525214_100012187055 [1,0,0,0,0,0|3,0,0]=4 1456 B11R1.24 CCOCc1cccc(c1)Br 34a_100000687537_100000210202 [1,0,0,0,0,0|3,0,0]=4 1457 B11R1.24 CCOCc1cccc(c1)Br 34a_100121572206_100000698116 [1,0,0,0,0,0|3,0,0]=4 1458 B11R1.24 CCOCc1cccc(c1)Br 7a_100000687537_100000210202 [1,0,0,0,0,0|3,0,0]=4 1459 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [1,0,0,0,0,0|3,0,0]=4 1460 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [1,0,0,0,0,0|3,0,0]=4 1461 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [1,0,0,0,0,0|3,0,0]=4 1462 B11R1.24 CCOCc1cccc(c1)Cl 34a_100000241301_100000210202 [1,0,0,0,0,0|3,0,0]=4 1463 B11R1.24 CCOCc1cccc(c1)Cl 34a_100121572206_100000187163 [1,0,0,0,0,0|3,0,0]=4 1464 B11R1.24 CCOCc1cccc(c1)Cl 7a_100000241301_100000210202 [1,0,0,0,0,0|3,0,0]=4 1465 B11R1.24 CCOCc1cccc(c1)F 34a_100000210976_100000210202 [1,0,0,0,0,0|3,0,0]=4 1466 B11R1.24 CCOCc1cccc(c1)F 34a_100121572206_100000187166 [1,0,0,0,0,0|3,0,0]=4 1467 B11R1.24 CCOCc1cccc(c1)F 7a_100000210976_100000210202 [1,0,0,0,0,0|3,0,0]=4 1468 B11R1.24 CCOCc1cccc(c1)I 34a_100011215336_100000210202 [1,0,0,0,0,0|3,0,0]=4 1469 B11R1.24 CCOCc1cccc(c1)I 34a_100121572206_100011218688 [1,0,0,0,0,0|3,0,0]=4 1470 B11R1.24 CCOCc1cccc(c1)I 7a_100011215336_100000210202 [1,0,0,0,0,0|3,0,0]=4 1471 B11R1.24 CCOCc1cccc(c1)N 34a_100000211919_100000210202 [1,0,0,0,0,0|3,0,0]=4 1472 B11R1.24 CCOCc1cccc(c1)O 271570a_203496583355_100011493694 [1,0,0,0,0,0|2,0,0]=3 1473 B11R1.24 CCOCc1cccc(c1)O 34a_100121572206_100011660834 [1,0,0,0,0,0|2,0,0]=3 1474 B11R1.24 CCSCc1cccc(c1)Br 62a_100000210202_100000211773 [1,0,0,0,0,0|3,0,0]=4 1475 B11R1.24 CCSCc1cccc(c1)Br 62a_100000211773_100000210202 [1,0,0,0,0,0|3,0,0]=4 1476 B11R1.24 CCSCc1cccc(c1)C 62a_100000210202_100000211840 [1,0,0,0,0,0|3,0,0]=4 1477 B11R1.24 CCSCc1cccc(c1)C 62a_100000211840_100000210202 [1,0,0,0,0,0|3,0,0]=4 1478 B11R1.24 CCSCc1cccc(c1)Cl 62a_100000187163_100000210202 [1,0,0,0,0,0|3,0,0]=4 1479 B11R1.24 CCSCc1cccc(c1)Cl 62a_100000210202_100000187163 [1,0,0,0,0,0|3,0,0]=4 1480 B11R1.24 CCSCc1cccc(c1)F 62a_100000210202_100000230114 [1,0,0,0,0,0|3,0,0]=4 1481 B11R1.24 CCSCc1cccc(c1)F 62a_100000230114_100000210202 [1,0,0,0,0,0|3,0,0]=4 1482 B11R1.24 CCSCc1cccc(c1)I 62a_100000210202_100011218688 [1,0,0,0,0,0|3,0,0]=4 1483 B11R1.24 CCSCc1cccc(c1)I 62a_100011218688_100000210202 [1,0,0,0,0,0|3,0,0]=4 1484 B11R1.24 CCSCc1cccc(c1)O 62a_100000210202_100011660834 [1,0,0,0,0,0|2,0,0]=3 1485 B11R1.24 CCSCc1cccc(c1)O 62a_100011660834_100000210202 [1,0,0,0,0,0|2,0,0]=3 1486 B11R1.24 CNCCc1cccc(c1)Br 2230a_100011207229_200000210301 [1,0,0,0,0,0|1,0,0]=2 1487 B11R1.24 CNCCc1cccc(c1)Br 2230a_106832991635_100011740638 [1,0,0,0,0,0|1,0,0]=2 1488 B11R1.24 CNCCc1cccc(c1)Br 34a_100011207229_200000210301 [1,0,0,0,0,0|1,0,0]=2 1489 B11R1.24 CNCCc1cccc(c1)Br 34a_100102657272_100011740638 [1,0,0,0,0,0|1,0,0]=2 1490 B11R1.24 CNCCc1cccc(c1)Br 7a_106832991635_100011740638 [1,0,0,0,0,0|1,0,0]=2 1491 B11R1.24 CNCCc1cccc(c1)C 2230a_100000749837_200000210301 [1,0,0,0,0,0|1,0,0]=2 1492 B11R1.24 CNCCc1cccc(c1)C 2230a_106832991635_100011713685 [1,0,0,0,0,0|1,0,0]=2 1493 B11R1.24 CNCCc1cccc(c1)C 34a_100000749837_200000210301 [1,0,0,0,0,0|1,0,0]=2 1494 B11R1.24 CNCCc1cccc(c1)C 34a_100102657272_100011713685 [1,0,0,0,0,0|1,0,0]=2 1495 B11R1.24 CNCCc1cccc(c1)C 7a_106832991635_100011713685 [1,0,0,0,0,0|1,0,0]=2 1496 B11R1.24 CNCCc1cccc(c1)Cl 2230a_100000185263_200000210301 [1,0,0,0,0,0|1,0,0]=2 1497 B11R1.24 CNCCc1cccc(c1)Cl 2230a_106832991635_100011713710 [1,0,0,0,0,0|1,0,0]=2 1498 B11R1.24 CNCCc1cccc(c1)Cl 34a_100000185263_200000210301 [1,0,0,0,0,0|1,0,0]=2 1499 B11R1.24 CNCCc1cccc(c1)Cl 34a_100102657272_100011713710 [1,0,0,0,0,0|1,0,0]=2 1500 B11R1.24 CNCCc1cccc(c1)Cl 7a_106832991635_100011713710 [1,0,0,0,0,0|1,0,0]=2 1501 B11R1.24 CNCCc1cccc(c1)F 2230a_100000205154_200000210301 [1,0,0,0,0,0|1,0,0]=2 1502 B11R1.24 CNCCc1cccc(c1)F 2230a_106832991635_100011217235 [1,0,0,0,0,0|1,0,0]=2 1503 B11R1.24 CNCCc1cccc(c1)F 34a_100000205154_200000210301 [1,0,0,0,0,0|1,0,0]=2 1504 B11R1.24 CNCCc1cccc(c1)F 34a_100102657272_100011217235 [1,0,0,0,0,0|1,0,0]=2 1505 B11R1.24 CNCCc1cccc(c1)F 7a_106832991635_100011217235 [1,0,0,0,0,0|1,0,0]=2 1506 B11R1.24 CNCCc1cccc(c1)O 2230a_100000747277_200000210301 [1,0,0,0,0,0|0,0,0]=1 1507 B11R1.24 CNCCc1cccc(c1)O 34a_100000747277_200000210301 [1,0,0,0,0,0|0,0,0]=1 1508 B11R1.24 CNCCc1cccc(n1)C 2230a_100011824523_200000210301 [1,0,0,0,0,0|2,0,0]=3 1509 B11R1.24 CNCCc1cccc(n1)C 34a_100011824523_200000210301 [1,0,0,0,0,0|2,0,0]=3 1510 B11R1.24 COCCc1cccc(c1)Br 34a_100011217444_200000210301 [1,0,0,0,0,0|2,0,0]=3 1511 B11R1.24 COCCc1cccc(c1)Br 34a_100138415774_100011740638 [1,0,0,0,0,0|2,0,0]=3 1512 B11R1.24 COCCc1cccc(c1)Br 7a_100011217444_200000210301 [1,0,0,0,0,0|2,0,0]=3 1513 B11R1.24 COCCc1cccc(c1)C 34a_100011217157_200000210301 [1,0,0,0,0,0|2,0,0]=3 1514 B11R1.24 COCCc1cccc(c1)C 34a_100138415774_100011713685 [1,0,0,0,0,0|2,0,0]=3 1515 B11R1.24 COCCc1cccc(c1)C 7a_100011217157_200000210301 [1,0,0,0,0,0|2,0,0]=3 1516 B11R1.24 COCCc1cccc(c1)Cl 34a_100000754733_200000210301 [1,0,0,0,0,0|2,0,0]=3 1517 B11R1.24 COCCc1cccc(c1)Cl 34a_100138415774_100011713710 [1,0,0,0,0,0|2,0,0]=3 1518 B11R1.24 COCCc1cccc(c1)Cl 7a_100000754733_200000210301 [1,0,0,0,0,0|2,0,0]=3 1519 B11R1.24 COCCc1cccc(c1)F 34a_100000763591_200000210301 [1,0,0,0,0,0|2,0,0]=3 1520 B11R1.24 COCCc1cccc(c1)F 34a_100138415774_100011217235 [1,0,0,0,0,0|2,0,0]=3 1521 B11R1.24 COCCc1cccc(c1)F 7a_100000763591_200000210301 [1,0,0,0,0,0|2,0,0]=3 1522 B11R1.24 COCCc1cccc(c1)N 34a_100011996697_200000210301 [1,0,0,0,0,0|2,0,0]=3 1523 B11R1.24 COCCc1cccc(n1)Br 34a_100010221043_200000210301 [1,0,0,0,0,0|3,0,0]=4 1524 B11R1.24 COCCc1cccc(n1)Br 7a_100010221043_200000210301 [1,0,0,0,0,0|3,0,0]=4 1525 B11R1.24 COCNc1cccc(c1)C 2230a_100000188690_100000766300 [1,0,0,0,0,0|3,0,0]=4 1526 B11R1.24 COCOc1cccc(c1)O 271570a_203496583355_100012265688 [1,0,0,0,0,0|2,0,0]=3 1527 B11R1.24 COCSc1cc(ccn1)O 62a_100000766300_100000762945 [1,0,0,0,0,0|3,0,0]=4 1528 B11R1.24 COCSc1cccc(c1)Br 62a_100000691529_100000766300 [1,0,0,0,0,0|3,0,0]=4 1529 B11R1.24 COCSc1cccc(c1)Br 62a_100000766300_100000691529 [1,0,0,0,0,0|3,0,0]=4 1530 B11R1.24 COCSc1cccc(c1)C 62a_100000766300_100011215228 [1,0,0,0,0,0|3,0,0]=4 1531 B11R1.24 COCSc1cccc(c1)C 62a_100011215228_100000766300 [1,0,0,0,0,0|3,0,0]=4 1532 B11R1.24 COCSc1cccc(c1)Cl 62a_100000699651_100000766300 [1,0,0,0,0,0|3,0,0]=4 1533 B11R1.24 COCSc1cccc(c1)Cl 62a_100000766300_100000699651 [1,0,0,0,0,0|3,0,0]=4 1534 B11R1.24 COCSc1cccc(c1)F 62a_100000685547_100000766300 [1,0,0,0,0,0|3,0,0]=4 1535 B11R1.24 COCSc1cccc(c1)F 62a_100000766300_100000685547 [1,0,0,0,0,0|3,0,0]=4 1536 B11R1.24 COCSc1cccc(c1)N 62a_100000210019_100000766300 [1,0,0,0,0,0|3,0,0]=4 1537 B11R1.24 COCSc1cccc(c1)N 62a_100000766300_100000210019 [1,0,0,0,0,0|3,0,0]=4 1538 B11R1.24 COCSc1cccc(c1)O 62a_100000766300_100000211634 [1,0,0,0,0,0|2,0,0]=3 1539 B11R1.24 COCSc1cccc(c1)[S] 62a_100000766300_114929384022 [1,0,0,0,0,0|2,1,0]=4 1540 B11R1.24 COCSc1cccc(c1)[S] 62a_114929384022_100000766300 [1,0,0,0,0,0|2,1,0]=4 1541 B11R1.24 COCSc1cncc(c1)O 62a_100000754920_100000766300 [1,0,0,0,0,0|3,0,0]=4 1542 B11R1.24 COCSc1cncc(c1)O 62a_100000766300_100000754920 [1,0,0,0,0,0|3,0,0]=4 1543 B11R1.24 CSCCc1cccc(c1)Br 62a_100011740638_200000210301 [1,0,0,0,0,0|2,0,0]=3 1544 B11R1.24 CSCCc1cccc(c1)Br 62a_200000210301_100011740638 [1,0,0,0,0,0|2,0,0]=3 1545 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [1,0,0,0,0,0|2,0,0]=3 1546 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [1,0,0,0,0,0|2,0,0]=3 1547 B11R1.24 CSCCc1cccc(c1)Cl 62a_100011713710_200000210301 [1,0,0,0,0,0|2,0,0]=3 1548 B11R1.24 CSCCc1cccc(c1)Cl 62a_200000210301_100011713710 [1,0,0,0,0,0|2,0,0]=3 1549 B11R1.24 CSCCc1cccc(c1)F 62a_100011217235_200000210301 [1,0,0,0,0,0|2,0,0]=3 1550 B11R1.24 CSCCc1cccc(c1)F 62a_200000210301_100011217235 [1,0,0,0,0,0|2,0,0]=3 1551 B11R1.24 CSCNc1cccc(c1)Br 34a_100000210019_100011218213 [1,0,0,0,0,0|3,0,0]=4 1552 B11R1.24 CSCNc1cccc(c1)C 2230a_100000188690_100011218213 [1,0,0,0,0,0|3,0,0]=4 1553 B11R1.24 CSCNc1cccc(c1)C 34a_100000188690_100011218213 [1,0,0,0,0,0|3,0,0]=4 1554 B11R1.24 CSCNc1cccc(c1)Cl 34a_100000185859_100011218213 [1,0,0,0,0,0|3,0,0]=4 1555 B11R1.24 CSCNc1cccc(c1)F 34a_100000210047_100011218213 [1,0,0,0,0,0|3,0,0]=4 1556 B11R1.24 CSCNc1cccc(c1)I 34a_100000211102_100011218213 [1,0,0,0,0,0|3,0,0]=4 1557 B11R1.24 CSCNc1cccc(c1)O 34a_100000210217_100011218213 [1,0,0,0,0,0|2,0,0]=3 1558 B11R1.24 CSCOc1cccc(c1)Br 34a_100000210342_100011218213 [1,0,0,0,0,0|3,0,0]=4 1559 B11R1.24 CSCOc1cccc(c1)C 34a_100000210337_100011218213 [1,0,0,0,0,0|3,0,0]=4 1560 B11R1.24 CSCOc1cccc(c1)Cl 34a_100000210295_100011218213 [1,0,0,0,0,0|3,0,0]=4 1561 B11R1.24 CSCOc1cccc(c1)F 34a_100000210426_100011218213 [1,0,0,0,0,0|3,0,0]=4 1562 B11R1.24 CSCOc1cccc(c1)I 34a_100000211634_100011218213 [1,0,0,0,0,0|3,0,0]=4 1563 B11R1.24 CSCOc1cccc(c1)N 34a_100000210217_100011218213 [1,0,0,0,0,0|3,0,0]=4 1564 B11R1.24 CSCSc1cc(ccn1)O 62a_100011218213_100000762945 [1,0,0,0,0,0|3,0,0]=4 1565 B11R1.24 CSCSc1cccc(c1)Br 62a_100000691529_100011218213 [1,0,0,0,0,0|3,0,0]=4 1566 B11R1.24 CSCSc1cccc(c1)Br 62a_100011218213_100000691529 [1,0,0,0,0,0|3,0,0]=4 1567 B11R1.24 CSCSc1cccc(c1)C 62a_100011215228_100011218213 [1,0,0,0,0,0|3,0,0]=4 1568 B11R1.24 CSCSc1cccc(c1)C 62a_100011218213_100011215228 [1,0,0,0,0,0|3,0,0]=4 1569 B11R1.24 CSCSc1cccc(c1)Cl 62a_100000699651_100011218213 [1,0,0,0,0,0|3,0,0]=4 1570 B11R1.24 CSCSc1cccc(c1)Cl 62a_100011218213_100000699651 [1,0,0,0,0,0|3,0,0]=4 1571 B11R1.24 CSCSc1cccc(c1)F 62a_100000685547_100011218213 [1,0,0,0,0,0|3,0,0]=4 1572 B11R1.24 CSCSc1cccc(c1)F 62a_100011218213_100000685547 [1,0,0,0,0,0|3,0,0]=4 1573 B11R1.24 CSCSc1cccc(c1)N 62a_100000210019_100011218213 [1,0,0,0,0,0|3,0,0]=4 1574 B11R1.24 CSCSc1cccc(c1)N 62a_100011218213_100000210019 [1,0,0,0,0,0|3,0,0]=4 1575 B11R1.24 CSCSc1cccc(c1)O 62a_100011218213_100000211634 [1,0,0,0,0,0|2,0,0]=3 1576 B11R1.24 CSCSc1cccc(c1)[S] 62a_100011218213_114929384022 [1,0,0,0,0,0|2,1,0]=4 1577 B11R1.24 CSCSc1cccc(c1)[S] 62a_114929384022_100011218213 [1,0,0,0,0,0|2,1,0]=4 1578 B11R1.24 CSCSc1cncc(c1)O 62a_100000754920_100011218213 [1,0,0,0,0,0|3,0,0]=4 1579 B11R1.24 CSCSc1cncc(c1)O 62a_100011218213_100000754920 [1,0,0,0,0,0|3,0,0]=4 1580 B11R1.24 Cc1cccc(c1)CCN[13CH3] 2230a_100000749837_200025704644 [1,0,0,0,0,0|1,0,0]=2 1581 B11R1.24 Cc1cccc(c1)CCN[13CH3] 34a_100000749837_200025704644 [1,0,0,0,0,0|1,0,0]=2 1582 B11R1.24 Cc1cccc(c1)CCO[13CH3] 34a_100011217157_200025704644 [1,0,0,0,0,0|2,0,0]=3 1583 B11R1.24 Cc1cccc(c1)CCO[13CH3] 7a_100011217157_200025704644 [1,0,0,0,0,0|2,0,0]=3 1584 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [1,0,0,0,0,0|2,0,0]=3 1585 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [1,0,0,0,0,0|2,0,0]=3 1586 B11R1.24 Cc1cccc(n1)CCN[13CH3] 2230a_100011824523_200025704644 [1,0,0,0,0,0|2,0,0]=3 1587 B11R1.24 Cc1cccc(n1)CCN[13CH3] 34a_100011824523_200025704644 [1,0,0,0,0,0|2,0,0]=3 1588 B11R1.24 N#CCCc1cccc(c1)O 271570a_203496583355_100011219771 [1,0,0,0,0,0|2,0,0]=3 1589 B11R1.24 N#CCOc1cccc(c1)O 271570a_203496583355_200000169433 [1,0,0,0,0,0|3,0,0]=4 1590 B11R1.24 N#CCSc1cccc(c1)O 271570a_203496583355_200011756096 [1,0,0,0,0,0|3,0,0]=4 1591 B11R1.24 N#CCSc1cccc(c1)O 62a_100011215382_100000211634 [1,0,0,0,0,0|3,0,0]=4 1592 B11R1.24 N#CSCc1cccc(c1)O 271570a_203496583355_200010199461 [1,0,0,0,0,0|3,0,0]=4 1593 B11R1.24 NCCCc1cccc(c1)O 271570a_203496583355_100000753791 [1,0,0,0,0,0|2,0,0]=3 1594 B11R1.24 NCCOc1cccc(c1)O 271570a_203496583355_100000743521 [1,0,0,0,0,0|3,0,0]=4 1595 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [1,0,0,0,0,0|3,0,0]=4 1596 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [1,0,0,0,0,0|3,0,0]=4 1597 B11R1.24 OCCCc1cccc(c1)O 271570a_203496583355_100011709248 [1,0,0,0,0,0|2,0,0]=3 1598 B11R1.24 OCCNc1cccc(c1)O 34a_100000210217_100000211926 [1,0,0,0,0,0|3,0,0]=4 1599 B11R1.24 OCCOc1cccc(c1)O 271570a_203496583355_100000757546 [1,0,0,0,0,0|3,0,0]=4 1600 B11R1.24 OCCSc1cccc(c1)O 271570a_203496583355_200011756134 [1,0,0,0,0,0|3,0,0]=4 1601 B11R1.24 OCCSc1cccc(c1)O 62a_100000211926_100000211634 [1,0,0,0,0,0|3,0,0]=4 1602 B11R1.24 Oc1cccc(c1)CNCF 34a_100000743036_100015361967 [1,0,0,0,0,0|3,0,0]=4 1603 B11R1.24 Oc1cccc(c1)CSCF 62a_100011660834_100015361967 [1,0,0,0,0,0|3,0,0]=4 1604 B11R1.24 Oc1cccc(c1)CSCF 62a_100015361967_100011660834 [1,0,0,0,0,0|3,0,0]=4 1605 B11R1.24 Oc1cccc(c1)NCCF 34a_100000210217_100011217306 [1,0,0,0,0,0|3,0,0]=4 1606 B11R1.24 Oc1cccc(c1)SCCF 62a_100011217306_100000211634 [1,0,0,0,0,0|3,0,0]=4 1607 B11R1.24 [13CH3]NCCc1cccc(c1)Br 2230a_100011207229_200025704644 [1,0,0,0,0,0|1,0,0]=2 1608 B11R1.24 [13CH3]NCCc1cccc(c1)Br 34a_100011207229_200025704644 [1,0,0,0,0,0|1,0,0]=2 1609 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 2230a_100000185263_200025704644 [1,0,0,0,0,0|1,0,0]=2 1610 B11R1.24 [13CH3]NCCc1cccc(c1)Cl 34a_100000185263_200025704644 [1,0,0,0,0,0|1,0,0]=2 1611 B11R1.24 [13CH3]NCCc1cccc(c1)F 2230a_100000205154_200025704644 [1,0,0,0,0,0|1,0,0]=2 1612 B11R1.24 [13CH3]NCCc1cccc(c1)F 34a_100000205154_200025704644 [1,0,0,0,0,0|1,0,0]=2 1613 B11R1.24 [13CH3]NCCc1cccc(c1)O 2230a_100000747277_200025704644 [1,0,0,0,0,0|0,0,0]=1 1614 B11R1.24 [13CH3]NCCc1cccc(c1)O 34a_100000747277_200025704644 [1,0,0,0,0,0|0,0,0]=1 1615 B11R1.24 [13CH3]OCCc1cccc(c1)Br 34a_100011217444_200025704644 [1,0,0,0,0,0|2,0,0]=3 1616 B11R1.24 [13CH3]OCCc1cccc(c1)Br 7a_100011217444_200025704644 [1,0,0,0,0,0|2,0,0]=3 1617 B11R1.24 [13CH3]OCCc1cccc(c1)Cl 34a_100000754733_200025704644 [1,0,0,0,0,0|2,0,0]=3 1618 B11R1.24 [13CH3]OCCc1cccc(c1)Cl 7a_100000754733_200025704644 [1,0,0,0,0,0|2,0,0]=3 1619 B11R1.24 [13CH3]OCCc1cccc(c1)F 34a_100000763591_200025704644 [1,0,0,0,0,0|2,0,0]=3 1620 B11R1.24 [13CH3]OCCc1cccc(c1)F 7a_100000763591_200025704644 [1,0,0,0,0,0|2,0,0]=3 1621 B11R1.24 [13CH3]OCCc1cccc(c1)N 34a_100011996697_200025704644 [1,0,0,0,0,0|2,0,0]=3 1622 B11R1.24 [13CH3]OCCc1cccc(n1)Br 34a_100010221043_200025704644 [1,0,0,0,0,0|3,0,0]=4 1623 B11R1.24 [13CH3]OCCc1cccc(n1)Br 7a_100010221043_200025704644 [1,0,0,0,0,0|3,0,0]=4 1624 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_100011740638_200025704644 [1,0,0,0,0,0|2,0,0]=3 1625 B11R1.24 [13CH3]SCCc1cccc(c1)Br 62a_200025704644_100011740638 [1,0,0,0,0,0|2,0,0]=3 1626 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_100011713710_200025704644 [1,0,0,0,0,0|2,0,0]=3 1627 B11R1.24 [13CH3]SCCc1cccc(c1)Cl 62a_200025704644_100011713710 [1,0,0,0,0,0|2,0,0]=3 1628 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_100011217235_200025704644 [1,0,0,0,0,0|2,0,0]=3 1629 B11R1.24 [13CH3]SCCc1cccc(c1)F 62a_200025704644_100011217235 [1,0,0,0,0,0|2,0,0]=3 1630 B11R1.192 C=C=Cc1ccc(c(c1)O)O 271570a_100015277604_100009813601 [1,0,0,0,0,0|0,0,3]=4 1631 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,0,0,0,0,0|1,0,2]=4 1632 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,0,0,0,0,0|1,0,2]=4 1633 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,0,0,0,0,0|1,0,2]=4 1634 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,0,0,0,0,0|1,0,2]=4 1635 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,0,0,0,0,0|1,0,2]=4 1636 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,0,0,0,0,0|1,0,2]=4 1637 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,0,0,0,0,0|1,0,2]=4 1638 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,0,0,0,0,0|1,0,2]=4 1639 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,0,0,0,0,0|1,0,2]=4 1640 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,0,0,0,0,0|1,0,2]=4 1641 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,0,0,0,0,0|0,0,2]=3 1642 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [1,0,0,0,0,0|1,0,0]=2 1643 B11R1.192 CCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210202 [1,0,0,0,0,0|3,0,0]=4 1644 B11R1.192 CCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210202 [1,0,0,0,0,0|3,0,0]=4 1645 B11R1.192 CCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210202 [1,0,0,0,0,0|3,0,0]=4 1646 B11R1.192 CCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210202 [1,0,0,0,0,0|3,0,0]=4 1647 B11R1.192 CCNc1ccc(c(c1)Br)C 34a_100000736455_100000210202 [1,0,0,0,0,0|3,0,0]=4 1648 B11R1.192 CCNc1ccc(c(c1)Br)C 7a_100000736455_100000210202 [1,0,0,0,0,0|3,0,0]=4 1649 B11R1.192 CCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210202 [1,0,0,0,0,0|3,0,0]=4 1650 B11R1.192 CCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210202 [1,0,0,0,0,0|3,0,0]=4 1651 B11R1.192 CCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210202 [1,0,0,0,0,0|3,0,0]=4 1652 B11R1.192 CCNc1ccc(c(c1)Br)F 34a_100000760356_100000210202 [1,0,0,0,0,0|3,0,0]=4 1653 B11R1.192 CCNc1ccc(c(c1)Br)F 7a_100000760356_100000210202 [1,0,0,0,0,0|3,0,0]=4 1654 B11R1.192 CCNc1ccc(c(c1)Br)I 34a_100000750458_100000210202 [1,0,0,0,0,0|3,0,0]=4 1655 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [1,0,0,0,0,0|2,0,0]=3 1656 B11R1.192 CCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210202 [1,0,0,0,0,0|3,0,0]=4 1657 B11R1.192 CCNc1ccc(c(c1)C)Br 34a_100000210723_100000210202 [1,0,0,0,0,0|3,0,0]=4 1658 B11R1.192 CCNc1ccc(c(c1)C)Br 7a_100000210723_100000210202 [1,0,0,0,0,0|3,0,0]=4 1659 B11R1.192 CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210202 [1,0,0,0,0,0|3,0,0]=4 1660 B11R1.192 CCNc1ccc(c(c1)C)C 34a_100000724040_100000210202 [1,0,0,0,0,0|3,0,0]=4 1661 B11R1.192 CCNc1ccc(c(c1)C)C 7a_100000724040_100000210202 [1,0,0,0,0,0|3,0,0]=4 1662 B11R1.192 CCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210202 [1,0,0,0,0,0|3,0,0]=4 1663 B11R1.192 CCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210202 [1,0,0,0,0,0|3,0,0]=4 1664 B11R1.192 CCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210202 [1,0,0,0,0,0|3,0,0]=4 1665 B11R1.192 CCNc1ccc(c(c1)C)F 2230a_100000750164_100000210202 [1,0,0,0,0,0|3,0,0]=4 1666 B11R1.192 CCNc1ccc(c(c1)C)F 34a_100000750164_100000210202 [1,0,0,0,0,0|3,0,0]=4 1667 B11R1.192 CCNc1ccc(c(c1)C)F 7a_100000750164_100000210202 [1,0,0,0,0,0|3,0,0]=4 1668 B11R1.192 CCNc1ccc(c(c1)C)I 34a_100000198070_100000210202 [1,0,0,0,0,0|3,0,0]=4 1669 B11R1.192 CCNc1ccc(c(c1)C)I 7a_100000198070_100000210202 [1,0,0,0,0,0|3,0,0]=4 1670 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [1,0,0,0,0,0|2,0,0]=3 1671 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [1,0,0,0,0,0|2,0,0]=3 1672 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [1,0,0,0,0,0|2,0,0]=3 1673 B11R1.192 CCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210202 [1,0,0,0,0,0|3,0,0]=4 1674 B11R1.192 CCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210202 [1,0,0,0,0,0|3,0,0]=4 1675 B11R1.192 CCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210202 [1,0,0,0,0,0|3,0,0]=4 1676 B11R1.192 CCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210202 [1,0,0,0,0,0|3,0,0]=4 1677 B11R1.192 CCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210202 [1,0,0,0,0,0|3,0,0]=4 1678 B11R1.192 CCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210202 [1,0,0,0,0,0|3,0,0]=4 1679 B11R1.192 CCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210202 [1,0,0,0,0,0|3,0,0]=4 1680 B11R1.192 CCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210202 [1,0,0,0,0,0|3,0,0]=4 1681 B11R1.192 CCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210202 [1,0,0,0,0,0|3,0,0]=4 1682 B11R1.192 CCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210202 [1,0,0,0,0,0|3,0,0]=4 1683 B11R1.192 CCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210202 [1,0,0,0,0,0|3,0,0]=4 1684 B11R1.192 CCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210202 [1,0,0,0,0,0|3,0,0]=4 1685 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [1,0,0,0,0,0|2,0,0]=3 1686 B11R1.192 CCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210202 [1,0,0,0,0,0|3,0,0]=4 1687 B11R1.192 CCNc1ccc(c(c1)F)Br 34a_100000759894_100000210202 [1,0,0,0,0,0|3,0,0]=4 1688 B11R1.192 CCNc1ccc(c(c1)F)Br 7a_100000759894_100000210202 [1,0,0,0,0,0|3,0,0]=4 1689 B11R1.192 CCNc1ccc(c(c1)F)C 2230a_100000210958_100000210202 [1,0,0,0,0,0|3,0,0]=4 1690 B11R1.192 CCNc1ccc(c(c1)F)C 34a_100000210958_100000210202 [1,0,0,0,0,0|3,0,0]=4 1691 B11R1.192 CCNc1ccc(c(c1)F)C 7a_100000210958_100000210202 [1,0,0,0,0,0|3,0,0]=4 1692 B11R1.192 CCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210202 [1,0,0,0,0,0|3,0,0]=4 1693 B11R1.192 CCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210202 [1,0,0,0,0,0|3,0,0]=4 1694 B11R1.192 CCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210202 [1,0,0,0,0,0|3,0,0]=4 1695 B11R1.192 CCNc1ccc(c(c1)F)F 2230a_100000210724_100000210202 [1,0,0,0,0,0|3,0,0]=4 1696 B11R1.192 CCNc1ccc(c(c1)F)F 34a_100000210724_100000210202 [1,0,0,0,0,0|3,0,0]=4 1697 B11R1.192 CCNc1ccc(c(c1)F)F 7a_100000210724_100000210202 [1,0,0,0,0,0|3,0,0]=4 1698 B11R1.192 CCNc1ccc(c(c1)F)I 34a_100011356925_100000210202 [1,0,0,0,0,0|3,0,0]=4 1699 B11R1.192 CCNc1ccc(c(c1)F)I 7a_100011356925_100000210202 [1,0,0,0,0,0|3,0,0]=4 1700 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [1,0,0,0,0,0|2,0,0]=3 1701 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [1,0,0,0,0,0|2,0,0]=3 1702 B11R1.192 CCNc1ccc(c(c1)I)Br 34a_100000750459_100000210202 [1,0,0,0,0,0|3,0,0]=4 1703 B11R1.192 CCNc1ccc(c(c1)I)C 34a_100000184131_100000210202 [1,0,0,0,0,0|3,0,0]=4 1704 B11R1.192 CCNc1ccc(c(c1)I)C 7a_100000184131_100000210202 [1,0,0,0,0,0|3,0,0]=4 1705 B11R1.192 CCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210202 [1,0,0,0,0,0|3,0,0]=4 1706 B11R1.192 CCNc1ccc(c(c1)I)F 34a_114828291077_100000210202 [1,0,0,0,0,0|3,0,0]=4 1707 B11R1.192 CCNc1ccc(c(c1)I)F 7a_114828291077_100000210202 [1,0,0,0,0,0|3,0,0]=4 1708 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [1,0,0,0,0,0|2,0,0]=3 1709 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [1,0,0,0,0,0|2,0,0]=3 1710 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [1,0,0,0,0,0|2,0,0]=3 1711 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [1,0,0,0,0,0|2,0,0]=3 1712 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [1,0,0,0,0,0|2,0,0]=3 1713 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [1,0,0,0,0,0|1,0,0]=2 1714 B11R1.192 CCOc1cc(c(cn1)O)C 271570a_203496583355_200012351029 [1,0,0,0,0,0|3,0,0]=4 1715 B11R1.192 CCOc1ccc(c(c1)Br)C 34a_100011380479_100000210202 [1,0,0,0,0,0|3,0,0]=4 1716 B11R1.192 CCOc1ccc(c(c1)Br)C 7a_100011380479_100000210202 [1,0,0,0,0,0|3,0,0]=4 1717 B11R1.192 CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210202 [1,0,0,0,0,0|3,0,0]=4 1718 B11R1.192 CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210202 [1,0,0,0,0,0|3,0,0]=4 1719 B11R1.192 CCOc1ccc(c(c1)Br)F 34a_100000693481_100000210202 [1,0,0,0,0,0|3,0,0]=4 1720 B11R1.192 CCOc1ccc(c(c1)Br)F 7a_100000693481_100000210202 [1,0,0,0,0,0|3,0,0]=4 1721 B11R1.192 CCOc1ccc(c(c1)Br)I 34a_100000701344_100000210202 [1,0,0,0,0,0|3,0,0]=4 1722 B11R1.192 CCOc1ccc(c(c1)Br)I 7a_100000701344_100000210202 [1,0,0,0,0,0|3,0,0]=4 1723 B11R1.192 CCOc1ccc(c(c1)Br)N 34a_100012001276_100000210202 [1,0,0,0,0,0|3,0,0]=4 1724 B11R1.192 CCOc1ccc(c(c1)Br)N 7a_100012001276_100000210202 [1,0,0,0,0,0|3,0,0]=4 1725 B11R1.192 CCOc1ccc(c(c1)C)Br 34a_100000690111_100000210202 [1,0,0,0,0,0|3,0,0]=4 1726 B11R1.192 CCOc1ccc(c(c1)C)Br 7a_100000690111_100000210202 [1,0,0,0,0,0|3,0,0]=4 1727 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [1,0,0,0,0,0|3,0,0]=4 1728 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [1,0,0,0,0,0|3,0,0]=4 1729 B11R1.192 CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210202 [1,0,0,0,0,0|3,0,0]=4 1730 B11R1.192 CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210202 [1,0,0,0,0,0|3,0,0]=4 1731 B11R1.192 CCOc1ccc(c(c1)C)F 34a_100000751312_100000210202 [1,0,0,0,0,0|3,0,0]=4 1732 B11R1.192 CCOc1ccc(c(c1)C)F 7a_100000751312_100000210202 [1,0,0,0,0,0|3,0,0]=4 1733 B11R1.192 CCOc1ccc(c(c1)C)I 34a_100000729255_100000210202 [1,0,0,0,0,0|3,0,0]=4 1734 B11R1.192 CCOc1ccc(c(c1)C)I 7a_100000729255_100000210202 [1,0,0,0,0,0|3,0,0]=4 1735 B11R1.192 CCOc1ccc(c(c1)C)N 34a_100000756630_100000210202 [1,0,0,0,0,0|3,0,0]=4 1736 B11R1.192 CCOc1ccc(c(c1)C)N 7a_100000756630_100000210202 [1,0,0,0,0,0|3,0,0]=4 1737 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [1,0,0,0,0,0|2,0,0]=3 1738 B11R1.192 CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210202 [1,0,0,0,0,0|3,0,0]=4 1739 B11R1.192 CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210202 [1,0,0,0,0,0|3,0,0]=4 1740 B11R1.192 CCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210202 [1,0,0,0,0,0|3,0,0]=4 1741 B11R1.192 CCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210202 [1,0,0,0,0,0|3,0,0]=4 1742 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210202 [1,0,0,0,0,0|3,0,0]=4 1743 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210202 [1,0,0,0,0,0|3,0,0]=4 1744 B11R1.192 CCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210202 [1,0,0,0,0,0|3,0,0]=4 1745 B11R1.192 CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210202 [1,0,0,0,0,0|3,0,0]=4 1746 B11R1.192 CCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210202 [1,0,0,0,0,0|3,0,0]=4 1747 B11R1.192 CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210202 [1,0,0,0,0,0|3,0,0]=4 1748 B11R1.192 CCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210202 [1,0,0,0,0,0|3,0,0]=4 1749 B11R1.192 CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210202 [1,0,0,0,0,0|3,0,0]=4 1750 B11R1.192 CCOc1ccc(c(c1)F)Br 34a_100000755031_100000210202 [1,0,0,0,0,0|3,0,0]=4 1751 B11R1.192 CCOc1ccc(c(c1)F)Br 7a_100000755031_100000210202 [1,0,0,0,0,0|3,0,0]=4 1752 B11R1.192 CCOc1ccc(c(c1)F)C 34a_100000722560_100000210202 [1,0,0,0,0,0|3,0,0]=4 1753 B11R1.192 CCOc1ccc(c(c1)F)C 7a_100000722560_100000210202 [1,0,0,0,0,0|3,0,0]=4 1754 B11R1.192 CCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210202 [1,0,0,0,0,0|3,0,0]=4 1755 B11R1.192 CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210202 [1,0,0,0,0,0|3,0,0]=4 1756 B11R1.192 CCOc1ccc(c(c1)F)F 34a_100000181275_100000210202 [1,0,0,0,0,0|3,0,0]=4 1757 B11R1.192 CCOc1ccc(c(c1)F)F 7a_100000181275_100000210202 [1,0,0,0,0,0|3,0,0]=4 1758 B11R1.192 CCOc1ccc(c(c1)F)I 34a_100009990212_100000210202 [1,0,0,0,0,0|3,0,0]=4 1759 B11R1.192 CCOc1ccc(c(c1)F)I 7a_100009990212_100000210202 [1,0,0,0,0,0|3,0,0]=4 1760 B11R1.192 CCOc1ccc(c(c1)F)N 34a_100000759473_100000210202 [1,0,0,0,0,0|3,0,0]=4 1761 B11R1.192 CCOc1ccc(c(c1)F)N 7a_100000759473_100000210202 [1,0,0,0,0,0|3,0,0]=4 1762 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [1,0,0,0,0,0|2,0,0]=3 1763 B11R1.192 CCOc1ccc(c(c1)I)Br 34a_100012339312_100000210202 [1,0,0,0,0,0|3,0,0]=4 1764 B11R1.192 CCOc1ccc(c(c1)I)Br 7a_100012339312_100000210202 [1,0,0,0,0,0|3,0,0]=4 1765 B11R1.192 CCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210202 [1,0,0,0,0,0|3,0,0]=4 1766 B11R1.192 CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210202 [1,0,0,0,0,0|3,0,0]=4 1767 B11R1.192 CCOc1ccc(c(c1)I)N 34a_100010084370_100000210202 [1,0,0,0,0,0|3,0,0]=4 1768 B11R1.192 CCOc1ccc(c(c1)I)N 7a_100010084370_100000210202 [1,0,0,0,0,0|3,0,0]=4 1769 B11R1.192 CCOc1ccc(c(c1)N)Br 34a_100011999798_100000210202 [1,0,0,0,0,0|3,0,0]=4 1770 B11R1.192 CCOc1ccc(c(c1)N)Br 7a_100011999798_100000210202 [1,0,0,0,0,0|3,0,0]=4 1771 B11R1.192 CCOc1ccc(c(c1)N)C 34a_100011216113_100000210202 [1,0,0,0,0,0|3,0,0]=4 1772 B11R1.192 CCOc1ccc(c(c1)N)C 7a_100011216113_100000210202 [1,0,0,0,0,0|3,0,0]=4 1773 B11R1.192 CCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210202 [1,0,0,0,0,0|3,0,0]=4 1774 B11R1.192 CCOc1ccc(c(c1)N)F 34a_100012017239_100000210202 [1,0,0,0,0,0|3,0,0]=4 1775 B11R1.192 CCOc1ccc(c(c1)N)F 7a_100012017239_100000210202 [1,0,0,0,0,0|3,0,0]=4 1776 B11R1.192 CCOc1ccc(c(c1)N)N 34a_100025771000_100000210202 [1,0,0,0,0,0|3,0,0]=4 1777 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [1,0,0,0,0,0|2,0,0]=3 1778 B11R1.192 CCSc1c[nH]c(=O)c(c1)O 62a_100000210202_100009814561 [1,0,0,0,0,0|2,0,1]=4 1779 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000210202_100000704368 [1,0,0,0,0,0|3,0,0]=4 1780 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000704368_100000210202 [1,0,0,0,0,0|3,0,0]=4 1781 B11R1.192 CCSc1cc(c(cn1)F)O 62a_100000210202_100009854642 [1,0,0,0,0,0|3,0,0]=4 1782 B11R1.192 CCSc1cc(c(cn1)F)O 62a_100009854642_100000210202 [1,0,0,0,0,0|3,0,0]=4 1783 B11R1.192 CCSc1cc(c(cn1)O)C 62a_100000210202_100000692680 [1,0,0,0,0,0|3,0,0]=4 1784 B11R1.192 CCSc1cc(c(cn1)O)N 62a_100000210202_100009819941 [1,0,0,0,0,0|3,0,0]=4 1785 B11R1.192 CCSc1cc(c(cn1)O)N 62a_100009819941_100000210202 [1,0,0,0,0,0|3,0,0]=4 1786 B11R1.192 CCSc1ccc(c(c1)Br)Br 62a_100000210202_100012356285 [1,0,0,0,0,0|3,0,0]=4 1787 B11R1.192 CCSc1ccc(c(c1)Br)Br 62a_100012356285_100000210202 [1,0,0,0,0,0|3,0,0]=4 1788 B11R1.192 CCSc1ccc(c(c1)Br)C 62a_100000210202_100011847877 [1,0,0,0,0,0|3,0,0]=4 1789 B11R1.192 CCSc1ccc(c(c1)Br)C 62a_100011847877_100000210202 [1,0,0,0,0,0|3,0,0]=4 1790 B11R1.192 CCSc1ccc(c(c1)Br)Cl 62a_100000210202_100012353702 [1,0,0,0,0,0|3,0,0]=4 1791 B11R1.192 CCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210202 [1,0,0,0,0,0|3,0,0]=4 1792 B11R1.192 CCSc1ccc(c(c1)Br)F 62a_100000210202_100012047266 [1,0,0,0,0,0|3,0,0]=4 1793 B11R1.192 CCSc1ccc(c(c1)Br)F 62a_100012047266_100000210202 [1,0,0,0,0,0|3,0,0]=4 1794 B11R1.192 CCSc1ccc(c(c1)Br)N 62a_100000210202_100000750455 [1,0,0,0,0,0|3,0,0]=4 1795 B11R1.192 CCSc1ccc(c(c1)Br)N 62a_100000750455_100000210202 [1,0,0,0,0,0|3,0,0]=4 1796 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [1,0,0,0,0,0|2,0,0]=3 1797 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [1,0,0,0,0,0|2,0,0]=3 1798 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100000210202_100009813585 [1,0,0,0,0,0|3,0,0]=4 1799 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100009813585_100000210202 [1,0,0,0,0,0|3,0,0]=4 1800 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100000210202_100011215607 [1,0,0,0,0,0|3,0,0]=4 1801 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100011215607_100000210202 [1,0,0,0,0,0|3,0,0]=4 1802 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210202 [1,0,0,0,0,0|3,0,0]=4 1803 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000210202_100000049509 [1,0,0,0,0,0|3,0,0]=4 1804 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100000210202_100011218330 [1,0,0,0,0,0|3,0,0]=4 1805 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100011218330_100000210202 [1,0,0,0,0,0|3,0,0]=4 1806 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000210202_100000211769 [1,0,0,0,0,0|3,0,0]=4 1807 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000211769_100000210202 [1,0,0,0,0,0|3,0,0]=4 1808 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [1,0,0,0,0,0|2,0,0]=3 1809 B11R1.192 CCSc1ccc(c(c1)Cl)Br 62a_100000210202_100012047281 [1,0,0,0,0,0|3,0,0]=4 1810 B11R1.192 CCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210202 [1,0,0,0,0,0|3,0,0]=4 1811 B11R1.192 CCSc1ccc(c(c1)Cl)C 62a_100000210202_100011216363 [1,0,0,0,0,0|3,0,0]=4 1812 B11R1.192 CCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210202 [1,0,0,0,0,0|3,0,0]=4 1813 B11R1.192 CCSc1ccc(c(c1)Cl)Cl 62a_100000210202_100011214914 [1,0,0,0,0,0|3,0,0]=4 1814 B11R1.192 CCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210202 [1,0,0,0,0,0|3,0,0]=4 1815 B11R1.192 CCSc1ccc(c(c1)Cl)F 62a_100000210202_100011215976 [1,0,0,0,0,0|3,0,0]=4 1816 B11R1.192 CCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210202 [1,0,0,0,0,0|3,0,0]=4 1817 B11R1.192 CCSc1ccc(c(c1)Cl)N 62a_100000210202_100011218065 [1,0,0,0,0,0|3,0,0]=4 1818 B11R1.192 CCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210202 [1,0,0,0,0,0|3,0,0]=4 1819 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [1,0,0,0,0,0|2,0,0]=3 1820 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [1,0,0,0,0,0|2,0,0]=3 1821 B11R1.192 CCSc1ccc(c(c1)F)Br 62a_100000210202_100000685389 [1,0,0,0,0,0|3,0,0]=4 1822 B11R1.192 CCSc1ccc(c(c1)F)Br 62a_100000685389_100000210202 [1,0,0,0,0,0|3,0,0]=4 1823 B11R1.192 CCSc1ccc(c(c1)F)C 62a_100000210202_100000720648 [1,0,0,0,0,0|3,0,0]=4 1824 B11R1.192 CCSc1ccc(c(c1)F)C 62a_100000720648_100000210202 [1,0,0,0,0,0|3,0,0]=4 1825 B11R1.192 CCSc1ccc(c(c1)F)Cl 62a_100000210202_100011216805 [1,0,0,0,0,0|3,0,0]=4 1826 B11R1.192 CCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210202 [1,0,0,0,0,0|3,0,0]=4 1827 B11R1.192 CCSc1ccc(c(c1)F)F 62a_100000210202_100000703953 [1,0,0,0,0,0|3,0,0]=4 1828 B11R1.192 CCSc1ccc(c(c1)F)F 62a_100000703953_100000210202 [1,0,0,0,0,0|3,0,0]=4 1829 B11R1.192 CCSc1ccc(c(c1)F)N 62a_100000210202_100011215594 [1,0,0,0,0,0|3,0,0]=4 1830 B11R1.192 CCSc1ccc(c(c1)F)N 62a_100011215594_100000210202 [1,0,0,0,0,0|3,0,0]=4 1831 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [1,0,0,0,0,0|2,0,0]=3 1832 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [1,0,0,0,0,0|2,0,0]=3 1833 B11R1.192 CCSc1ccc(c(c1)N)Br 62a_100000210202_100000750456 [1,0,0,0,0,0|3,0,0]=4 1834 B11R1.192 CCSc1ccc(c(c1)N)Br 62a_100000750456_100000210202 [1,0,0,0,0,0|3,0,0]=4 1835 B11R1.192 CCSc1ccc(c(c1)N)C 62a_100000210202_100000761890 [1,0,0,0,0,0|3,0,0]=4 1836 B11R1.192 CCSc1ccc(c(c1)N)C 62a_100000761890_100000210202 [1,0,0,0,0,0|3,0,0]=4 1837 B11R1.192 CCSc1ccc(c(c1)N)Cl 62a_100000210202_200000761891 [1,0,0,0,0,0|3,0,0]=4 1838 B11R1.192 CCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210202 [1,0,0,0,0,0|3,0,0]=4 1839 B11R1.192 CCSc1ccc(c(c1)N)F 62a_100000210202_100000740924 [1,0,0,0,0,0|3,0,0]=4 1840 B11R1.192 CCSc1ccc(c(c1)N)F 62a_100000740924_100000210202 [1,0,0,0,0,0|3,0,0]=4 1841 B11R1.192 CCSc1ccc(c(c1)N)N 62a_100000210202_100011534411 [1,0,0,0,0,0|3,0,0]=4 1842 B11R1.192 CCSc1ccc(c(c1)N)N 62a_100000741789_100000210202 [1,0,0,0,0,0|3,0,0]=4 1843 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [1,0,0,0,0,0|2,0,0]=3 1844 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [1,0,0,0,0,0|2,0,0]=3 1845 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [1,0,0,0,0,0|2,0,0]=3 1846 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [1,0,0,0,0,0|2,0,0]=3 1847 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [1,0,0,0,0,0|2,0,0]=3 1848 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [1,0,0,0,0,0|2,0,0]=3 1849 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [1,0,0,0,0,0|2,0,0]=3 1850 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [1,0,0,0,0,0|2,0,0]=3 1851 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [1,0,0,0,0,0|2,0,0]=3 1852 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [1,0,0,0,0,0|2,0,0]=3 1853 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [1,0,0,0,0,0|2,0,0]=3 1854 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [1,0,0,0,0,0|2,0,0]=3 1855 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [1,0,0,0,0,0|1,0,0]=2 1856 B11R1.192 CCSc1ccc(c(n1)Br)O 62a_100000210202_100000725334 [1,0,0,0,0,0|3,0,0]=4 1857 B11R1.192 CCSc1ccc(c(n1)Br)O 62a_100000725334_100000210202 [1,0,0,0,0,0|3,0,0]=4 1858 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100000210202_100010233687 [1,0,0,0,0,0|3,0,0]=4 1859 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100010233687_100000210202 [1,0,0,0,0,0|3,0,0]=4 1860 B11R1.192 CCSc1ccc(c(n1)Cl)O 62a_100000210202_100000721234 [1,0,0,0,0,0|3,0,0]=4 1861 B11R1.192 CCSc1ccc(c(n1)F)O 62a_100000210202_100009819667 [1,0,0,0,0,0|3,0,0]=4 1862 B11R1.192 CCSc1ccc(c(n1)F)O 62a_100009819667_100000210202 [1,0,0,0,0,0|3,0,0]=4 1863 B11R1.192 CCSc1ccc(c(n1)N)O 62a_100000210202_100000685527 [1,0,0,0,0,0|3,0,0]=4 1864 B11R1.192 CCSc1ccc(c(n1)N)O 62a_100000685527_100000210202 [1,0,0,0,0,0|3,0,0]=4 1865 B11R1.192 CCSc1ccc(c(n1)O)F 62a_100000210202_100010729010 [1,0,0,0,0,0|3,0,0]=4 1866 B11R1.192 CCSc1ccc(c(n1)O)N 62a_100000718904_100000210202 [1,0,0,0,0,0|3,0,0]=4 1867 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000210202_100000685391 [1,0,0,0,0,0|3,0,0]=4 1868 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000685391_100000210202 [1,0,0,0,0,0|3,0,0]=4 1869 B11R1.192 CCSc1cnc(c(c1)Cl)O 62a_100000210202_100010238531 [1,0,0,0,0,0|3,0,0]=4 1870 B11R1.192 CCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210202 [1,0,0,0,0,0|3,0,0]=4 1871 B11R1.192 CCSc1cnc(c(c1)N)O 62a_100000210202_100000743729 [1,0,0,0,0,0|3,0,0]=4 1872 B11R1.192 CCSc1cnc(c(c1)N)O 62a_100000743729_100000210202 [1,0,0,0,0,0|3,0,0]=4 1873 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100000210202_100009864810 [1,0,0,0,0,0|3,0,0]=4 1874 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100009864810_100000210202 [1,0,0,0,0,0|3,0,0]=4 1875 B11R1.192 CCSc1cnc(c(c1)O)F 62a_100000210202_100009819871 [1,0,0,0,0,0|3,0,0]=4 1876 B11R1.192 CCSc1cnc(c(c1)O)F 62a_100009819871_100000210202 [1,0,0,0,0,0|3,0,0]=4 1877 B11R1.192 CCSc1cnc(c(c1)O)N 62a_100000210202_100009819042 [1,0,0,0,0,0|3,0,0]=4 1878 B11R1.192 CCSc1cnc(c(c1)O)N 62a_100009819042_100000210202 [1,0,0,0,0,0|3,0,0]=4 1879 B11R1.192 CNCc1c[nH]c(=O)c(c1)Cl 207a_100102657272_100000051075 [1,0,0,0,0,0|2,0,1]=4 1880 B11R1.192 CNCc1c[nH]c(=O)c(c1)Cl 270004a_106832991635_100000051075 [1,0,0,0,0,0|2,0,1]=4 1881 B11R1.192 CNCc1cc(=O)c(co1)O 2230a_106832991635_100000010605 [1,0,0,0,0,0|1,0,1]=3 1882 B11R1.192 CNCc1cc(=O)c(co1)O 7a_106832991635_100000010605 [1,0,0,0,0,0|1,0,1]=3 1883 B11R1.192 CNCc1cc(c(cn1)Br)C 207a_100102657272_100009814806 [1,0,0,0,0,0|3,0,0]=4 1884 B11R1.192 CNCc1cc(c(cn1)Br)C 270004a_106832991635_100009814806 [1,0,0,0,0,0|3,0,0]=4 1885 B11R1.192 CNCc1cc(c(cn1)C)Br 207a_100102657272_100010174032 [1,0,0,0,0,0|3,0,0]=4 1886 B11R1.192 CNCc1cc(c(cn1)C)Br 270004a_106832991635_100010174032 [1,0,0,0,0,0|3,0,0]=4 1887 B11R1.192 CNCc1ccc(=O)n(c1)C 207a_100102657272_100010620449 [1,0,0,0,0,0|2,0,1]=4 1888 B11R1.192 CNCc1ccc(=O)n(c1)C 270004a_106832991635_100010620449 [1,0,0,0,0,0|2,0,1]=4 1889 B11R1.192 CNCc1ccc(c(c1)Br)Br 207a_100102657272_100011215943 [1,0,0,0,0,0|2,0,0]=3 1890 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_100012351559_200000210301 [1,0,0,0,0,0|2,0,0]=3 1891 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_106832991635_100012353900 [1,0,0,0,0,0|2,0,0]=3 1892 B11R1.192 CNCc1ccc(c(c1)Br)Br 270004a_106832991635_100011215943 [1,0,0,0,0,0|2,0,0]=3 1893 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100012351559_200000210301 [1,0,0,0,0,0|2,0,0]=3 1894 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100102657272_100012353900 [1,0,0,0,0,0|2,0,0]=3 1895 B11R1.192 CNCc1ccc(c(c1)Br)Br 7a_106832991635_100012353900 [1,0,0,0,0,0|2,0,0]=3 1896 B11R1.192 CNCc1ccc(c(c1)Br)C 207a_100102657272_100000695567 [1,0,0,0,0,0|2,0,0]=3 1897 B11R1.192 CNCc1ccc(c(c1)Br)C 2230a_106832991635_100012232412 [1,0,0,0,0,0|2,0,0]=3 1898 B11R1.192 CNCc1ccc(c(c1)Br)C 26a_100102657272_100011380479 [1,0,0,0,0,0|2,0,0]=3 1899 B11R1.192 CNCc1ccc(c(c1)Br)C 270004a_106832991635_100000695567 [1,0,0,0,0,0|2,0,0]=3 1900 B11R1.192 CNCc1ccc(c(c1)Br)C 34a_100102657272_100012232412 [1,0,0,0,0,0|2,0,0]=3 1901 B11R1.192 CNCc1ccc(c(c1)Br)C 7a_106832991635_100012232412 [1,0,0,0,0,0|2,0,0]=3 1902 B11R1.192 CNCc1ccc(c(c1)Br)Cl 207a_100102657272_100000693810 [1,0,0,0,0,0|2,0,0]=3 1903 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_100012349490_200000210301 [1,0,0,0,0,0|2,0,0]=3 1904 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_106832991635_100012353894 [1,0,0,0,0,0|2,0,0]=3 1905 B11R1.192 CNCc1ccc(c(c1)Br)Cl 26a_100102657272_100011933957 [1,0,0,0,0,0|2,0,0]=3 1906 B11R1.192 CNCc1ccc(c(c1)Br)Cl 270004a_106832991635_100000693810 [1,0,0,0,0,0|2,0,0]=3 1907 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100012349490_200000210301 [1,0,0,0,0,0|2,0,0]=3 1908 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100102657272_100012353894 [1,0,0,0,0,0|2,0,0]=3 1909 B11R1.192 CNCc1ccc(c(c1)Br)Cl 7a_106832991635_100012353894 [1,0,0,0,0,0|2,0,0]=3 1910 B11R1.192 CNCc1ccc(c(c1)Br)F 207a_100102657272_100000211747 [1,0,0,0,0,0|2,0,0]=3 1911 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_100015193890_200000210301 [1,0,0,0,0,0|2,0,0]=3 1912 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_106832991635_100011206884 [1,0,0,0,0,0|2,0,0]=3 1913 B11R1.192 CNCc1ccc(c(c1)Br)F 26a_100102657272_100000693481 [1,0,0,0,0,0|2,0,0]=3 1914 B11R1.192 CNCc1ccc(c(c1)Br)F 270004a_106832991635_100000211747 [1,0,0,0,0,0|2,0,0]=3 1915 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100015193890_200000210301 [1,0,0,0,0,0|2,0,0]=3 1916 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100102657272_100011206884 [1,0,0,0,0,0|2,0,0]=3 1917 B11R1.192 CNCc1ccc(c(c1)Br)F 7a_106832991635_100011206884 [1,0,0,0,0,0|2,0,0]=3 1918 B11R1.192 CNCc1ccc(c(c1)Br)I 26a_100102657272_100000701344 [1,0,0,0,0,0|2,0,0]=3 1919 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [1,0,0,0,0,0|2,0,0]=3 1920 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [1,0,0,0,0,0|2,0,0]=3 1921 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [1,0,0,0,0,0|2,0,0]=3 1922 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [1,0,0,0,0,0|2,0,0]=3 1923 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [1,0,0,0,0,0|2,0,0]=3 1924 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [1,0,0,0,0,0|2,0,0]=3 1925 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [1,0,0,0,0,0|2,0,0]=3 1926 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [1,0,0,0,0,0|2,0,0]=3 1927 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [1,0,0,0,0,0|2,0,0]=3 1928 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [1,0,0,0,0,0|2,0,0]=3 1929 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [1,0,0,0,0,0|2,0,0]=3 1930 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [1,0,0,0,0,0|2,0,0]=3 1931 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [1,0,0,0,0,0|2,0,0]=3 1932 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [1,0,0,0,0,0|2,0,0]=3 1933 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [1,0,0,0,0,0|2,0,0]=3 1934 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [1,0,0,0,0,0|2,0,0]=3 1935 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [1,0,0,0,0,0|2,0,0]=3 1936 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [1,0,0,0,0,0|2,0,0]=3 1937 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [1,0,0,0,0,0|2,0,0]=3 1938 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [1,0,0,0,0,0|2,0,0]=3 1939 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [1,0,0,0,0,0|2,0,0]=3 1940 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [1,0,0,0,0,0|2,0,0]=3 1941 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [1,0,0,0,0,0|2,0,0]=3 1942 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [1,0,0,0,0,0|2,0,0]=3 1943 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [1,0,0,0,0,0|2,0,0]=3 1944 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [1,0,0,0,0,0|2,0,0]=3 1945 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [1,0,0,0,0,0|2,0,0]=3 1946 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [1,0,0,0,0,0|2,0,0]=3 1947 B11R1.192 CNCc1ccc(c(c1)Cl)Br 207a_100102657272_100000690054 [1,0,0,0,0,0|2,0,0]=3 1948 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_100012362553_200000210301 [1,0,0,0,0,0|2,0,0]=3 1949 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_106832991635_100012353895 [1,0,0,0,0,0|2,0,0]=3 1950 B11R1.192 CNCc1ccc(c(c1)Cl)Br 26a_100102657272_100011215161 [1,0,0,0,0,0|2,0,0]=3 1951 B11R1.192 CNCc1ccc(c(c1)Cl)Br 270004a_106832991635_100000690054 [1,0,0,0,0,0|2,0,0]=3 1952 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100012362553_200000210301 [1,0,0,0,0,0|2,0,0]=3 1953 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100102657272_100012353895 [1,0,0,0,0,0|2,0,0]=3 1954 B11R1.192 CNCc1ccc(c(c1)Cl)Br 7a_106832991635_100012353895 [1,0,0,0,0,0|2,0,0]=3 1955 B11R1.192 CNCc1ccc(c(c1)Cl)C 207a_100102657272_100000760539 [1,0,0,0,0,0|2,0,0]=3 1956 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_102495364989_200000210301 [1,0,0,0,0,0|2,0,0]=3 1957 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_106832991635_100011823929 [1,0,0,0,0,0|2,0,0]=3 1958 B11R1.192 CNCc1ccc(c(c1)Cl)C 26a_100102657272_100011265682 [1,0,0,0,0,0|2,0,0]=3 1959 B11R1.192 CNCc1ccc(c(c1)Cl)C 270004a_106832991635_100000760539 [1,0,0,0,0,0|2,0,0]=3 1960 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_100102657272_100011823929 [1,0,0,0,0,0|2,0,0]=3 1961 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_102495364989_200000210301 [1,0,0,0,0,0|2,0,0]=3 1962 B11R1.192 CNCc1ccc(c(c1)Cl)C 7a_106832991635_100011823929 [1,0,0,0,0,0|2,0,0]=3 1963 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 207a_100102657272_100000188533 [1,0,0,0,0,0|2,0,0]=3 1964 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200000210301 [1,0,0,0,0,0|2,0,0]=3 1965 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100000184707 [1,0,0,0,0,0|2,0,0]=3 1966 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 26a_100102657272_100000211054 [1,0,0,0,0,0|2,0,0]=3 1967 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 270004a_106832991635_100000188533 [1,0,0,0,0,0|2,0,0]=3 1968 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100000174881_200000210301 [1,0,0,0,0,0|2,0,0]=3 1969 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100102657272_100000184707 [1,0,0,0,0,0|2,0,0]=3 1970 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 7a_106832991635_100000184707 [1,0,0,0,0,0|2,0,0]=3 1971 B11R1.192 CNCc1ccc(c(c1)Cl)F 207a_100102657272_100000742290 [1,0,0,0,0,0|2,0,0]=3 1972 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_100000749334_200000210301 [1,0,0,0,0,0|2,0,0]=3 1973 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_106832991635_100000717365 [1,0,0,0,0,0|2,0,0]=3 1974 B11R1.192 CNCc1ccc(c(c1)Cl)F 26a_100102657272_100000211030 [1,0,0,0,0,0|2,0,0]=3 1975 B11R1.192 CNCc1ccc(c(c1)Cl)F 270004a_106832991635_100000742290 [1,0,0,0,0,0|2,0,0]=3 1976 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100000749334_200000210301 [1,0,0,0,0,0|2,0,0]=3 1977 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100102657272_100011934319 [1,0,0,0,0,0|2,0,0]=3 1978 B11R1.192 CNCc1ccc(c(c1)Cl)F 7a_106832991635_100000717365 [1,0,0,0,0,0|2,0,0]=3 1979 B11R1.192 CNCc1ccc(c(c1)Cl)I 2230a_106832991635_100012349665 [1,0,0,0,0,0|2,0,0]=3 1980 B11R1.192 CNCc1ccc(c(c1)Cl)I 26a_100102657272_100000047559 [1,0,0,0,0,0|2,0,0]=3 1981 B11R1.192 CNCc1ccc(c(c1)Cl)I 34a_100102657272_100012349665 [1,0,0,0,0,0|2,0,0]=3 1982 B11R1.192 CNCc1ccc(c(c1)Cl)I 7a_106832991635_100012349665 [1,0,0,0,0,0|2,0,0]=3 1983 B11R1.192 CNCc1ccc(c(c1)F)Br 207a_100102657272_100000686674 [1,0,0,0,0,0|2,0,0]=3 1984 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_100000755036_200000210301 [1,0,0,0,0,0|2,0,0]=3 1985 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_106832991635_100000767054 [1,0,0,0,0,0|2,0,0]=3 1986 B11R1.192 CNCc1ccc(c(c1)F)Br 26a_100102657272_100000755031 [1,0,0,0,0,0|2,0,0]=3 1987 B11R1.192 CNCc1ccc(c(c1)F)Br 270004a_106832991635_100000686674 [1,0,0,0,0,0|2,0,0]=3 1988 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100000755036_200000210301 [1,0,0,0,0,0|2,0,0]=3 1989 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100102657272_100000767054 [1,0,0,0,0,0|2,0,0]=3 1990 B11R1.192 CNCc1ccc(c(c1)F)Br 7a_106832991635_100000767054 [1,0,0,0,0,0|2,0,0]=3 1991 B11R1.192 CNCc1ccc(c(c1)F)C 207a_100102657272_100000753222 [1,0,0,0,0,0|2,0,0]=3 1992 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_100102708794_200000210301 [1,0,0,0,0,0|2,0,0]=3 1993 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_106832991635_100011217369 [1,0,0,0,0,0|2,0,0]=3 1994 B11R1.192 CNCc1ccc(c(c1)F)C 270004a_106832991635_100000753222 [1,0,0,0,0,0|2,0,0]=3 1995 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102657272_100011217369 [1,0,0,0,0,0|2,0,0]=3 1996 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102708794_200000210301 [1,0,0,0,0,0|2,0,0]=3 1997 B11R1.192 CNCc1ccc(c(c1)F)C 7a_106832991635_100011217369 [1,0,0,0,0,0|2,0,0]=3 1998 B11R1.192 CNCc1ccc(c(c1)F)Cl 207a_100102657272_100000745630 [1,0,0,0,0,0|2,0,0]=3 1999 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_100011219866_200000210301 [1,0,0,0,0,0|2,0,0]=3 2000 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_106832991635_100000716492 [1,0,0,0,0,0|2,0,0]=3 2001 B11R1.192 CNCc1ccc(c(c1)F)Cl 26a_100102657272_100000691581 [1,0,0,0,0,0|2,0,0]=3 2002 B11R1.192 CNCc1ccc(c(c1)F)Cl 270004a_106832991635_100000745630 [1,0,0,0,0,0|2,0,0]=3 2003 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100011219866_200000210301 [1,0,0,0,0,0|2,0,0]=3 2004 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100102657272_100011519011 [1,0,0,0,0,0|2,0,0]=3 2005 B11R1.192 CNCc1ccc(c(c1)F)Cl 7a_106832991635_100000716492 [1,0,0,0,0,0|2,0,0]=3 2006 B11R1.192 CNCc1ccc(c(c1)F)F 207a_100102657272_100000211062 [1,0,0,0,0,0|2,0,0]=3 2007 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_100000737897_200000210301 [1,0,0,0,0,0|2,0,0]=3 2008 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_106832991635_100000757363 [1,0,0,0,0,0|2,0,0]=3 2009 B11R1.192 CNCc1ccc(c(c1)F)F 270004a_106832991635_100000211062 [1,0,0,0,0,0|2,0,0]=3 2010 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100000737897_200000210301 [1,0,0,0,0,0|2,0,0]=3 2011 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100102657272_100000757363 [1,0,0,0,0,0|2,0,0]=3 2012 B11R1.192 CNCc1ccc(c(c1)F)F 7a_106832991635_100000757363 [1,0,0,0,0,0|2,0,0]=3 2013 B11R1.192 CNCc1ccc(c(c1)F)I 207a_100102657272_100000050832 [1,0,0,0,0,0|2,0,0]=3 2014 B11R1.192 CNCc1ccc(c(c1)F)I 2230a_106832991635_100010149604 [1,0,0,0,0,0|2,0,0]=3 2015 B11R1.192 CNCc1ccc(c(c1)F)I 270004a_106832991635_100000050832 [1,0,0,0,0,0|2,0,0]=3 2016 B11R1.192 CNCc1ccc(c(c1)F)I 34a_100102657272_100010149604 [1,0,0,0,0,0|2,0,0]=3 2017 B11R1.192 CNCc1ccc(c(c1)F)I 7a_106832991635_100010149604 [1,0,0,0,0,0|2,0,0]=3 2018 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [1,0,0,0,0,0|1,0,0]=2 2019 B11R1.192 CNCc1ccc(c(c1)I)Br 207a_100102657272_100010146563 [1,0,0,0,0,0|2,0,0]=3 2020 B11R1.192 CNCc1ccc(c(c1)I)Br 2230a_106832991635_100010146616 [1,0,0,0,0,0|2,0,0]=3 2021 B11R1.192 CNCc1ccc(c(c1)I)Br 26a_100102657272_100012339312 [1,0,0,0,0,0|2,0,0]=3 2022 B11R1.192 CNCc1ccc(c(c1)I)Br 270004a_106832991635_100010146563 [1,0,0,0,0,0|2,0,0]=3 2023 B11R1.192 CNCc1ccc(c(c1)I)Br 34a_100102657272_100010146616 [1,0,0,0,0,0|2,0,0]=3 2024 B11R1.192 CNCc1ccc(c(c1)I)Br 7a_106832991635_100010146616 [1,0,0,0,0,0|2,0,0]=3 2025 B11R1.192 CNCc1ccc(c(c1)I)C 207a_100102657272_100010197721 [1,0,0,0,0,0|2,0,0]=3 2026 B11R1.192 CNCc1ccc(c(c1)I)C 2230a_106832991635_100010206137 [1,0,0,0,0,0|2,0,0]=3 2027 B11R1.192 CNCc1ccc(c(c1)I)C 270004a_106832991635_100010197721 [1,0,0,0,0,0|2,0,0]=3 2028 B11R1.192 CNCc1ccc(c(c1)I)C 34a_100102657272_100010206137 [1,0,0,0,0,0|2,0,0]=3 2029 B11R1.192 CNCc1ccc(c(c1)I)C 7a_106832991635_100010206137 [1,0,0,0,0,0|2,0,0]=3 2030 B11R1.192 CNCc1ccc(c(c1)I)Cl 207a_100102657272_100010209939 [1,0,0,0,0,0|2,0,0]=3 2031 B11R1.192 CNCc1ccc(c(c1)I)Cl 26a_100102657272_100000049588 [1,0,0,0,0,0|2,0,0]=3 2032 B11R1.192 CNCc1ccc(c(c1)I)Cl 270004a_106832991635_100010209939 [1,0,0,0,0,0|2,0,0]=3 2033 B11R1.192 CNCc1ccc(c(c1)I)F 207a_100102657272_100010188209 [1,0,0,0,0,0|2,0,0]=3 2034 B11R1.192 CNCc1ccc(c(c1)I)F 2230a_106832991635_100010188208 [1,0,0,0,0,0|2,0,0]=3 2035 B11R1.192 CNCc1ccc(c(c1)I)F 270004a_106832991635_100010188209 [1,0,0,0,0,0|2,0,0]=3 2036 B11R1.192 CNCc1ccc(c(c1)I)F 34a_100102657272_100010188208 [1,0,0,0,0,0|2,0,0]=3 2037 B11R1.192 CNCc1ccc(c(c1)I)F 7a_106832991635_100010188208 [1,0,0,0,0,0|2,0,0]=3 2038 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [1,0,0,0,0,0|1,0,0]=2 2039 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [1,0,0,0,0,0|1,0,0]=2 2040 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,0,0,0,0,0|0,0,0]=1 2041 B11R1.192 CNCc1ccc(c(n1)C)Br 207a_100102657272_100010238520 [1,0,0,0,0,0|3,0,0]=4 2042 B11R1.192 CNCc1ccc(c(n1)C)Br 270004a_106832991635_100010238520 [1,0,0,0,0,0|3,0,0]=4 2043 B11R1.192 CNCc1ccc(c(n1)C)C 2230a_202515432893_200000210301 [1,0,0,0,0,0|3,0,0]=4 2044 B11R1.192 CNCc1ccc(c(n1)C)C 34a_202515432893_200000210301 [1,0,0,0,0,0|3,0,0]=4 2045 B11R1.192 CNCc1ccc(c(n1)Cl)Cl 2230a_100009887527_200000210301 [1,0,0,0,0,0|3,0,0]=4 2046 B11R1.192 CNCc1ccc(c(n1)Cl)Cl 34a_100009887527_200000210301 [1,0,0,0,0,0|3,0,0]=4 2047 B11R1.192 CNCc1cnc(c(c1)Br)Cl 207a_100102657272_100010244460 [1,0,0,0,0,0|3,0,0]=4 2048 B11R1.192 CNCc1cnc(c(c1)Br)F 2230a_106832991635_200010066439 [1,0,0,0,0,0|3,0,0]=4 2049 B11R1.192 CNCc1cnc(c(c1)Br)F 34a_100102657272_200010066439 [1,0,0,0,0,0|3,0,0]=4 2050 B11R1.192 CNCc1cnc(c(c1)Br)F 7a_106832991635_200010066439 [1,0,0,0,0,0|3,0,0]=4 2051 B11R1.192 CNCc1cnc(c(c1)Br)O 207a_100102657272_100010064886 [1,0,0,0,0,0|2,0,0]=3 2052 B11R1.192 CNCc1cnc(c(c1)Br)O 270004a_106832991635_100010064886 [1,0,0,0,0,0|2,0,0]=3 2053 B11R1.192 CNCc1cnc(c(c1)C)Br 270004a_106832991635_100009814818 [1,0,0,0,0,0|3,0,0]=4 2054 B11R1.192 CNCc1cnc(c(c1)C)Cl 207a_100102657272_100000070293 [1,0,0,0,0,0|3,0,0]=4 2055 B11R1.192 CNCc1cnc(c(c1)C)Cl 270004a_106832991635_100000070293 [1,0,0,0,0,0|3,0,0]=4 2056 B11R1.192 CNCc1cnc(c(c1)C)F 270004a_106832991635_100000050577 [1,0,0,0,0,0|3,0,0]=4 2057 B11R1.192 CNCc1cnc(c(c1)Cl)Cl 2230a_106832991635_100009843750 [1,0,0,0,0,0|3,0,0]=4 2058 B11R1.192 CNCc1cnc(c(c1)Cl)Cl 34a_100102657272_100009843750 [1,0,0,0,0,0|3,0,0]=4 2059 B11R1.192 CNCc1cnc(c(c1)Cl)Cl 7a_106832991635_100009843750 [1,0,0,0,0,0|3,0,0]=4 2060 B11R1.192 CNCc1cnc(c(c1)F)Br 270004a_106832991635_100010064875 [1,0,0,0,0,0|3,0,0]=4 2061 B11R1.192 CNCc1cnc(c(c1)F)Cl 270004a_106832991635_100009866847 [1,0,0,0,0,0|3,0,0]=4 2062 B11R1.192 CNCc1cnc(c(c1)I)Cl 2230a_106832991635_100011072623 [1,0,0,0,0,0|3,0,0]=4 2063 B11R1.192 CNCc1cnc(c(c1)I)Cl 34a_100102657272_100011072623 [1,0,0,0,0,0|3,0,0]=4 2064 B11R1.192 CNCc1cnc(c(c1)I)Cl 7a_106832991635_100011072623 [1,0,0,0,0,0|3,0,0]=4 2065 B11R1.192 COCc1ccc(c(c1)Br)Br 34a_100138415774_100012353900 [1,0,0,0,0,0|3,0,0]=4 2066 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100000708995_200000210301 [1,0,0,0,0,0|3,0,0]=4 2067 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100138415774_100012232412 [1,0,0,0,0,0|3,0,0]=4 2068 B11R1.192 COCc1ccc(c(c1)Br)C 7a_100000708995_200000210301 [1,0,0,0,0,0|3,0,0]=4 2069 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100012353893_200000210301 [1,0,0,0,0,0|3,0,0]=4 2070 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100138415774_100012353894 [1,0,0,0,0,0|3,0,0]=4 2071 B11R1.192 COCc1ccc(c(c1)Br)Cl 7a_100012353893_200000210301 [1,0,0,0,0,0|3,0,0]=4 2072 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100000246287_200000210301 [1,0,0,0,0,0|3,0,0]=4 2073 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100138415774_100011206884 [1,0,0,0,0,0|3,0,0]=4 2074 B11R1.192 COCc1ccc(c(c1)Br)F 7a_100000246287_200000210301 [1,0,0,0,0,0|3,0,0]=4 2075 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [1,0,0,0,0,0|3,0,0]=4 2076 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [1,0,0,0,0,0|3,0,0]=4 2077 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [1,0,0,0,0,0|3,0,0]=4 2078 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [1,0,0,0,0,0|3,0,0]=4 2079 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [1,0,0,0,0,0|3,0,0]=4 2080 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [1,0,0,0,0,0|3,0,0]=4 2081 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [1,0,0,0,0,0|3,0,0]=4 2082 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [1,0,0,0,0,0|3,0,0]=4 2083 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [1,0,0,0,0,0|3,0,0]=4 2084 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [1,0,0,0,0,0|3,0,0]=4 2085 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [1,0,0,0,0,0|3,0,0]=4 2086 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100000709168_200000210301 [1,0,0,0,0,0|3,0,0]=4 2087 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100138415774_100012353895 [1,0,0,0,0,0|3,0,0]=4 2088 B11R1.192 COCc1ccc(c(c1)Cl)Br 7a_100000709168_200000210301 [1,0,0,0,0,0|3,0,0]=4 2089 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100011290783_200000210301 [1,0,0,0,0,0|3,0,0]=4 2090 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100138415774_100011823929 [1,0,0,0,0,0|3,0,0]=4 2091 B11R1.192 COCc1ccc(c(c1)Cl)C 7a_100011290783_200000210301 [1,0,0,0,0,0|3,0,0]=4 2092 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100000211588_200000210301 [1,0,0,0,0,0|3,0,0]=4 2093 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100138415774_100000184707 [1,0,0,0,0,0|3,0,0]=4 2094 B11R1.192 COCc1ccc(c(c1)Cl)Cl 7a_100000211588_200000210301 [1,0,0,0,0,0|3,0,0]=4 2095 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100011217911_200000210301 [1,0,0,0,0,0|3,0,0]=4 2096 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100138415774_100011934319 [1,0,0,0,0,0|3,0,0]=4 2097 B11R1.192 COCc1ccc(c(c1)Cl)F 7a_100011217911_200000210301 [1,0,0,0,0,0|3,0,0]=4 2098 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100000718186_200000210301 [1,0,0,0,0,0|3,0,0]=4 2099 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100138415774_100012349665 [1,0,0,0,0,0|3,0,0]=4 2100 B11R1.192 COCc1ccc(c(c1)Cl)I 7a_100000718186_200000210301 [1,0,0,0,0,0|3,0,0]=4 2101 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100011533735_200000210301 [1,0,0,0,0,0|3,0,0]=4 2102 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100138415774_100000767054 [1,0,0,0,0,0|3,0,0]=4 2103 B11R1.192 COCc1ccc(c(c1)F)Br 7a_100011533735_200000210301 [1,0,0,0,0,0|3,0,0]=4 2104 B11R1.192 COCc1ccc(c(c1)F)C 34a_100000702247_200000210301 [1,0,0,0,0,0|3,0,0]=4 2105 B11R1.192 COCc1ccc(c(c1)F)C 34a_100138415774_100011217369 [1,0,0,0,0,0|3,0,0]=4 2106 B11R1.192 COCc1ccc(c(c1)F)C 7a_100000702247_200000210301 [1,0,0,0,0,0|3,0,0]=4 2107 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100011218299_200000210301 [1,0,0,0,0,0|3,0,0]=4 2108 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100138415774_100011519011 [1,0,0,0,0,0|3,0,0]=4 2109 B11R1.192 COCc1ccc(c(c1)F)Cl 7a_100011218299_200000210301 [1,0,0,0,0,0|3,0,0]=4 2110 B11R1.192 COCc1ccc(c(c1)F)F 34a_100011215442_200000210301 [1,0,0,0,0,0|3,0,0]=4 2111 B11R1.192 COCc1ccc(c(c1)F)F 34a_100138415774_100000757363 [1,0,0,0,0,0|3,0,0]=4 2112 B11R1.192 COCc1ccc(c(c1)F)F 7a_100011215442_200000210301 [1,0,0,0,0,0|3,0,0]=4 2113 B11R1.192 COCc1ccc(c(c1)F)I 34a_100010149597_200000210301 [1,0,0,0,0,0|3,0,0]=4 2114 B11R1.192 COCc1ccc(c(c1)F)I 34a_100138415774_100010149604 [1,0,0,0,0,0|3,0,0]=4 2115 B11R1.192 COCc1ccc(c(c1)F)I 7a_100010149597_200000210301 [1,0,0,0,0,0|3,0,0]=4 2116 B11R1.192 COCc1ccc(c(c1)F)N 34a_100011217239_200000210301 [1,0,0,0,0,0|3,0,0]=4 2117 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [1,0,0,0,0,0|2,0,0]=3 2118 B11R1.192 COCc1ccc(c(c1)I)Br 34a_100138415774_100010146616 [1,0,0,0,0,0|3,0,0]=4 2119 B11R1.192 COCc1ccc(c(c1)I)C 34a_100000050133_200000210301 [1,0,0,0,0,0|3,0,0]=4 2120 B11R1.192 COCc1ccc(c(c1)I)C 34a_100138415774_100010206137 [1,0,0,0,0,0|3,0,0]=4 2121 B11R1.192 COCc1ccc(c(c1)I)C 7a_100000050133_200000210301 [1,0,0,0,0,0|3,0,0]=4 2122 B11R1.192 COCc1ccc(c(c1)I)F 34a_100000049585_200000210301 [1,0,0,0,0,0|3,0,0]=4 2123 B11R1.192 COCc1ccc(c(c1)I)F 34a_100138415774_100010188208 [1,0,0,0,0,0|3,0,0]=4 2124 B11R1.192 COCc1ccc(c(c1)I)F 7a_100000049585_200000210301 [1,0,0,0,0,0|3,0,0]=4 2125 B11R1.192 COCc1ccc(c(c1)N)Br 34a_100012347568_200000210301 [1,0,0,0,0,0|3,0,0]=4 2126 B11R1.192 COCc1ccc(c(c1)N)C 34a_100000758420_200000210301 [1,0,0,0,0,0|3,0,0]=4 2127 B11R1.192 COCc1ccc(c(c1)N)Cl 34a_106256033963_200000210301 [1,0,0,0,0,0|3,0,0]=4 2128 B11R1.192 COCc1ccc(c(c1)N)F 34a_102125399562_200000210301 [1,0,0,0,0,0|3,0,0]=4 2129 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [1,0,0,0,0,0|2,0,0]=3 2130 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [1,0,0,0,0,0|2,0,0]=3 2131 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [1,0,0,0,0,0|2,0,0]=3 2132 B11R1.192 CSCc1cc(=O)c(co1)O 62a_200000210301_100000010605 [1,0,0,0,0,0|2,0,1]=4 2133 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_100012353900_200000210301 [1,0,0,0,0,0|3,0,0]=4 2134 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_200000210301_100012353900 [1,0,0,0,0,0|3,0,0]=4 2135 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_100012232412_200000210301 [1,0,0,0,0,0|3,0,0]=4 2136 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_200000210301_100012232412 [1,0,0,0,0,0|3,0,0]=4 2137 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_100012353894_200000210301 [1,0,0,0,0,0|3,0,0]=4 2138 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_200000210301_100012353894 [1,0,0,0,0,0|3,0,0]=4 2139 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_100011206884_200000210301 [1,0,0,0,0,0|3,0,0]=4 2140 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_200000210301_100011206884 [1,0,0,0,0,0|3,0,0]=4 2141 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_100000727479_200000210301 [1,0,0,0,0,0|3,0,0]=4 2142 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_200000210301_100000727479 [1,0,0,0,0,0|3,0,0]=4 2143 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [1,0,0,0,0,0|3,0,0]=4 2144 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [1,0,0,0,0,0|3,0,0]=4 2145 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_100012184735_200000210301 [1,0,0,0,0,0|3,0,0]=4 2146 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_200000210301_100012184735 [1,0,0,0,0,0|3,0,0]=4 2147 B11R1.192 CSCc1ccc(c(c1)C)F 62a_100011216667_200000210301 [1,0,0,0,0,0|3,0,0]=4 2148 B11R1.192 CSCc1ccc(c(c1)C)F 62a_200000210301_100011216667 [1,0,0,0,0,0|3,0,0]=4 2149 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_100012353895_200000210301 [1,0,0,0,0,0|3,0,0]=4 2150 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_200000210301_100012353895 [1,0,0,0,0,0|3,0,0]=4 2151 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_100011823929_200000210301 [1,0,0,0,0,0|3,0,0]=4 2152 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_200000210301_100011823929 [1,0,0,0,0,0|3,0,0]=4 2153 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_100000184707_200000210301 [1,0,0,0,0,0|3,0,0]=4 2154 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_200000210301_100000184707 [1,0,0,0,0,0|3,0,0]=4 2155 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_100000717365_200000210301 [1,0,0,0,0,0|3,0,0]=4 2156 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_200000210301_100011934319 [1,0,0,0,0,0|3,0,0]=4 2157 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_100012349665_200000210301 [1,0,0,0,0,0|3,0,0]=4 2158 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_200000210301_100012349665 [1,0,0,0,0,0|3,0,0]=4 2159 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_100000767054_200000210301 [1,0,0,0,0,0|3,0,0]=4 2160 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_200000210301_100000767054 [1,0,0,0,0,0|3,0,0]=4 2161 B11R1.192 CSCc1ccc(c(c1)F)C 62a_100011217369_200000210301 [1,0,0,0,0,0|3,0,0]=4 2162 B11R1.192 CSCc1ccc(c(c1)F)C 62a_200000210301_100011217369 [1,0,0,0,0,0|3,0,0]=4 2163 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_100000716492_200000210301 [1,0,0,0,0,0|3,0,0]=4 2164 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_200000210301_100000716492 [1,0,0,0,0,0|3,0,0]=4 2165 B11R1.192 CSCc1ccc(c(c1)F)F 62a_100000757363_200000210301 [1,0,0,0,0,0|3,0,0]=4 2166 B11R1.192 CSCc1ccc(c(c1)F)F 62a_200000210301_100000757363 [1,0,0,0,0,0|3,0,0]=4 2167 B11R1.192 CSCc1ccc(c(c1)F)I 62a_100010149604_200000210301 [1,0,0,0,0,0|3,0,0]=4 2168 B11R1.192 CSCc1ccc(c(c1)F)I 62a_200000210301_100010149604 [1,0,0,0,0,0|3,0,0]=4 2169 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_100010146616_200000210301 [1,0,0,0,0,0|3,0,0]=4 2170 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_200000210301_100010146616 [1,0,0,0,0,0|3,0,0]=4 2171 B11R1.192 CSCc1ccc(c(c1)I)C 62a_100010206137_200000210301 [1,0,0,0,0,0|3,0,0]=4 2172 B11R1.192 CSCc1ccc(c(c1)I)C 62a_200000210301_100010206137 [1,0,0,0,0,0|3,0,0]=4 2173 B11R1.192 CSCc1ccc(c(c1)I)F 62a_100010188208_200000210301 [1,0,0,0,0,0|3,0,0]=4 2174 B11R1.192 CSCc1ccc(c(c1)I)F 62a_200000210301_100010188208 [1,0,0,0,0,0|3,0,0]=4 2175 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [1,0,0,0,0,0|2,0,0]=3 2176 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [1,0,0,0,0,0|2,0,0]=3 2177 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [1,0,0,0,0,0|3,0,0]=4 2178 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [1,0,0,0,0,0|3,0,0]=4 2179 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_100000727479_200025704644 [1,0,0,0,0,0|3,0,0]=4 2180 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100000727479 [1,0,0,0,0,0|3,0,0]=4 2181 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_100012184735_200025704644 [1,0,0,0,0,0|3,0,0]=4 2182 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100012184735 [1,0,0,0,0,0|3,0,0]=4 2183 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [1,0,0,0,0,0|2,0,0]=3 2184 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [1,0,0,0,0,0|2,0,0]=3 2185 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [1,0,0,0,0,0|3,0,0]=4 2186 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [1,0,0,0,0,0|3,0,0]=4 2187 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_100011216667_200025704644 [1,0,0,0,0,0|3,0,0]=4 2188 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_200025704644_100011216667 [1,0,0,0,0,0|3,0,0]=4 2189 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [1,0,0,0,0,0|3,0,0]=4 2190 B11R1.192 Cc1cc(ccc1O)CC#N 271570a_203496583355_100000726167 [1,0,0,0,0,0|1,0,2]=4 2191 B11R1.192 Cc1cc(ccc1O)NCF 34a_100011218179_100015361967 [1,0,0,0,0,0|3,0,0]=4 2192 B11R1.192 Cc1cc(ccc1O)NCF 7a_100011218179_100015361967 [1,0,0,0,0,0|3,0,0]=4 2193 B11R1.192 Cc1cc(ccc1O)SCF 62a_100015361967_100000186361 [1,0,0,0,0,0|3,0,0]=4 2194 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 34a_100000708995_200025704644 [1,0,0,0,0,0|3,0,0]=4 2195 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 7a_100000708995_200025704644 [1,0,0,0,0,0|3,0,0]=4 2196 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_100012232412_200025704644 [1,0,0,0,0,0|3,0,0]=4 2197 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_200025704644_100012232412 [1,0,0,0,0,0|3,0,0]=4 2198 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [1,0,0,0,0,0|2,0,0]=3 2199 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [1,0,0,0,0,0|2,0,0]=3 2200 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [1,0,0,0,0,0|3,0,0]=4 2201 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [1,0,0,0,0,0|3,0,0]=4 2202 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [1,0,0,0,0,0|3,0,0]=4 2203 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [1,0,0,0,0,0|3,0,0]=4 2204 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 2230a_102495364989_200025704644 [1,0,0,0,0,0|2,0,0]=3 2205 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 34a_102495364989_200025704644 [1,0,0,0,0,0|2,0,0]=3 2206 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 34a_100011290783_200025704644 [1,0,0,0,0,0|3,0,0]=4 2207 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 7a_100011290783_200025704644 [1,0,0,0,0,0|3,0,0]=4 2208 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_100011823929_200025704644 [1,0,0,0,0,0|3,0,0]=4 2209 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100011823929 [1,0,0,0,0,0|3,0,0]=4 2210 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 2230a_100102708794_200025704644 [1,0,0,0,0,0|2,0,0]=3 2211 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 34a_100102708794_200025704644 [1,0,0,0,0,0|2,0,0]=3 2212 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 34a_100000702247_200025704644 [1,0,0,0,0,0|3,0,0]=4 2213 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 7a_100000702247_200025704644 [1,0,0,0,0,0|3,0,0]=4 2214 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_100011217369_200025704644 [1,0,0,0,0,0|3,0,0]=4 2215 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_200025704644_100011217369 [1,0,0,0,0,0|3,0,0]=4 2216 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 34a_100000050133_200025704644 [1,0,0,0,0,0|3,0,0]=4 2217 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 7a_100000050133_200025704644 [1,0,0,0,0,0|3,0,0]=4 2218 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_100010206137_200025704644 [1,0,0,0,0,0|3,0,0]=4 2219 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_200025704644_100010206137 [1,0,0,0,0,0|3,0,0]=4 2220 B11R1.192 Cc1ccc(cc1N)CO[13CH3] 34a_100000758420_200025704644 [1,0,0,0,0,0|3,0,0]=4 2221 B11R1.192 Cc1ccc(cc1O)NCF 34a_100000759471_100015361967 [1,0,0,0,0,0|3,0,0]=4 2222 B11R1.192 Cc1ccc(cc1O)NCF 7a_100000759471_100015361967 [1,0,0,0,0,0|3,0,0]=4 2223 B11R1.192 Cc1ccc(cc1O)SCF 62a_100000685420_100015361967 [1,0,0,0,0,0|3,0,0]=4 2224 B11R1.192 Cc1ccc(cc1O)SCF 62a_100015361967_100000685420 [1,0,0,0,0,0|3,0,0]=4 2225 B11R1.192 Cc1ccc(nc1C)CN[13CH3] 2230a_202515432893_200025704644 [1,0,0,0,0,0|3,0,0]=4 2226 B11R1.192 Cc1ccc(nc1C)CN[13CH3] 34a_202515432893_200025704644 [1,0,0,0,0,0|3,0,0]=4 2227 B11R1.192 N#CCc1ccc(c(c1)F)O 271570a_203496583355_100000691973 [1,0,0,0,0,0|1,0,2]=4 2228 B11R1.192 N#CCc1ccc(c(c1)O)F 271570a_203496583355_100000742998 [1,0,0,0,0,0|1,0,2]=4 2229 B11R1.192 N#CCc1ccc(c(c1)O)N 271570a_203496583355_100010188563 [1,0,0,0,0,0|1,0,2]=4 2230 B11R1.192 Nc1cc(ccc1O)SCF 62a_100000752626_100015361967 [1,0,0,0,0,0|3,0,0]=4 2231 B11R1.192 Nc1cc(ccc1O)SCF 62a_100015361967_100000752626 [1,0,0,0,0,0|3,0,0]=4 2232 B11R1.192 Nc1ccc(cc1O)SCF 62a_100000739049_100015361967 [1,0,0,0,0,0|3,0,0]=4 2233 B11R1.192 Nc1ccc(cc1O)SCF 62a_100015361967_100000739049 [1,0,0,0,0,0|3,0,0]=4 2234 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [1,0,0,0,0,0|2,0,0]=3 2235 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100012356990_100015361967 [1,0,0,0,0,0|3,0,0]=4 2236 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100015361967_100012356990 [1,0,0,0,0,0|3,0,0]=4 2237 B11R1.192 Oc1cc(ccc1Cl)NCF 34a_100011934209_100015361967 [1,0,0,0,0,0|3,0,0]=4 2238 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100011356854_100015361967 [1,0,0,0,0,0|3,0,0]=4 2239 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100015361967_100011356854 [1,0,0,0,0,0|3,0,0]=4 2240 B11R1.192 Oc1cc(ccc1F)NCF 34a_100012017398_100015361967 [1,0,0,0,0,0|3,0,0]=4 2241 B11R1.192 Oc1cc(ccc1F)NCF 7a_100012017398_100015361967 [1,0,0,0,0,0|3,0,0]=4 2242 B11R1.192 Oc1cc(ccc1F)SCF 62a_100000686035_100015361967 [1,0,0,0,0,0|3,0,0]=4 2243 B11R1.192 Oc1cc(ccc1F)SCF 62a_100015361967_100000686035 [1,0,0,0,0,0|3,0,0]=4 2244 B11R1.192 Oc1ccc(cc1Br)NCF 34a_100011534360_100015361967 [1,0,0,0,0,0|3,0,0]=4 2245 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100012361655_100015361967 [1,0,0,0,0,0|3,0,0]=4 2246 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100015361967_100012361655 [1,0,0,0,0,0|3,0,0]=4 2247 B11R1.192 Oc1ccc(cc1Cl)NCF 34a_100000744943_100015361967 [1,0,0,0,0,0|3,0,0]=4 2248 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100012360047_100015361967 [1,0,0,0,0,0|3,0,0]=4 2249 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100015361967_100012360047 [1,0,0,0,0,0|3,0,0]=4 2250 B11R1.192 Oc1ccc(cc1F)NCF 34a_100011220035_100015361967 [1,0,0,0,0,0|3,0,0]=4 2251 B11R1.192 Oc1ccc(cc1F)NCF 7a_100011220035_100015361967 [1,0,0,0,0,0|3,0,0]=4 2252 B11R1.192 Oc1ccc(cc1F)SCF 62a_100000185481_100015361967 [1,0,0,0,0,0|3,0,0]=4 2253 B11R1.192 Oc1ccc(cc1F)SCF 62a_100015361967_100000185481 [1,0,0,0,0,0|3,0,0]=4 2254 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [1,0,0,0,0,0|2,0,0]=3 2255 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [1,0,0,0,0,0|2,0,0]=3 2256 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 2230a_100012351559_200025704644 [1,0,0,0,0,0|2,0,0]=3 2257 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 34a_100012351559_200025704644 [1,0,0,0,0,0|2,0,0]=3 2258 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 2230a_100012349490_200025704644 [1,0,0,0,0,0|2,0,0]=3 2259 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 34a_100012349490_200025704644 [1,0,0,0,0,0|2,0,0]=3 2260 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 2230a_100015193890_200025704644 [1,0,0,0,0,0|2,0,0]=3 2261 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 34a_100015193890_200025704644 [1,0,0,0,0,0|2,0,0]=3 2262 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 2230a_100012362553_200025704644 [1,0,0,0,0,0|2,0,0]=3 2263 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 34a_100012362553_200025704644 [1,0,0,0,0,0|2,0,0]=3 2264 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200025704644 [1,0,0,0,0,0|2,0,0]=3 2265 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 34a_100000174881_200025704644 [1,0,0,0,0,0|2,0,0]=3 2266 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 2230a_100000749334_200025704644 [1,0,0,0,0,0|2,0,0]=3 2267 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 34a_100000749334_200025704644 [1,0,0,0,0,0|2,0,0]=3 2268 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 2230a_100000755036_200025704644 [1,0,0,0,0,0|2,0,0]=3 2269 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 34a_100000755036_200025704644 [1,0,0,0,0,0|2,0,0]=3 2270 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 2230a_100011219866_200025704644 [1,0,0,0,0,0|2,0,0]=3 2271 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 34a_100011219866_200025704644 [1,0,0,0,0,0|2,0,0]=3 2272 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 2230a_100000737897_200025704644 [1,0,0,0,0,0|2,0,0]=3 2273 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 34a_100000737897_200025704644 [1,0,0,0,0,0|2,0,0]=3 2274 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [1,0,0,0,0,0|1,0,0]=2 2275 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [1,0,0,0,0,0|1,0,0]=2 2276 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [1,0,0,0,0,0|1,0,0]=2 2277 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,0,0,0,0,0|0,0,0]=1 2278 B11R1.192 [13CH3]NCc1ccc(c(n1)Cl)Cl 2230a_100009887527_200025704644 [1,0,0,0,0,0|3,0,0]=4 2279 B11R1.192 [13CH3]NCc1ccc(c(n1)Cl)Cl 34a_100009887527_200025704644 [1,0,0,0,0,0|3,0,0]=4 2280 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 34a_100012353893_200025704644 [1,0,0,0,0,0|3,0,0]=4 2281 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 7a_100012353893_200025704644 [1,0,0,0,0,0|3,0,0]=4 2282 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 34a_100000246287_200025704644 [1,0,0,0,0,0|3,0,0]=4 2283 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 7a_100000246287_200025704644 [1,0,0,0,0,0|3,0,0]=4 2284 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 34a_100000709168_200025704644 [1,0,0,0,0,0|3,0,0]=4 2285 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 7a_100000709168_200025704644 [1,0,0,0,0,0|3,0,0]=4 2286 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 34a_100000211588_200025704644 [1,0,0,0,0,0|3,0,0]=4 2287 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 7a_100000211588_200025704644 [1,0,0,0,0,0|3,0,0]=4 2288 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 34a_100011217911_200025704644 [1,0,0,0,0,0|3,0,0]=4 2289 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 7a_100011217911_200025704644 [1,0,0,0,0,0|3,0,0]=4 2290 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 34a_100000718186_200025704644 [1,0,0,0,0,0|3,0,0]=4 2291 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 7a_100000718186_200025704644 [1,0,0,0,0,0|3,0,0]=4 2292 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 34a_100011533735_200025704644 [1,0,0,0,0,0|3,0,0]=4 2293 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 7a_100011533735_200025704644 [1,0,0,0,0,0|3,0,0]=4 2294 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 34a_100011218299_200025704644 [1,0,0,0,0,0|3,0,0]=4 2295 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 7a_100011218299_200025704644 [1,0,0,0,0,0|3,0,0]=4 2296 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 34a_100011215442_200025704644 [1,0,0,0,0,0|3,0,0]=4 2297 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 7a_100011215442_200025704644 [1,0,0,0,0,0|3,0,0]=4 2298 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 34a_100010149597_200025704644 [1,0,0,0,0,0|3,0,0]=4 2299 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 7a_100010149597_200025704644 [1,0,0,0,0,0|3,0,0]=4 2300 B11R1.192 [13CH3]OCc1ccc(c(c1)F)N 34a_100011217239_200025704644 [1,0,0,0,0,0|3,0,0]=4 2301 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 34a_100000049585_200025704644 [1,0,0,0,0,0|3,0,0]=4 2302 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 7a_100000049585_200025704644 [1,0,0,0,0,0|3,0,0]=4 2303 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Br 34a_100012347568_200025704644 [1,0,0,0,0,0|3,0,0]=4 2304 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Cl 34a_106256033963_200025704644 [1,0,0,0,0,0|3,0,0]=4 2305 B11R1.192 [13CH3]OCc1ccc(c(c1)N)F 34a_102125399562_200025704644 [1,0,0,0,0,0|3,0,0]=4 2306 B11R1.192 [13CH3]SCc1cc(=O)c(co1)O 62a_200025704644_100000010605 [1,0,0,0,0,0|2,0,1]=4 2307 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_100012353900_200025704644 [1,0,0,0,0,0|3,0,0]=4 2308 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_200025704644_100012353900 [1,0,0,0,0,0|3,0,0]=4 2309 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_100012353894_200025704644 [1,0,0,0,0,0|3,0,0]=4 2310 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_200025704644_100012353894 [1,0,0,0,0,0|3,0,0]=4 2311 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_100011206884_200025704644 [1,0,0,0,0,0|3,0,0]=4 2312 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_200025704644_100011206884 [1,0,0,0,0,0|3,0,0]=4 2313 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_100012353895_200025704644 [1,0,0,0,0,0|3,0,0]=4 2314 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_200025704644_100012353895 [1,0,0,0,0,0|3,0,0]=4 2315 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_100000184707_200025704644 [1,0,0,0,0,0|3,0,0]=4 2316 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_200025704644_100000184707 [1,0,0,0,0,0|3,0,0]=4 2317 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_100000717365_200025704644 [1,0,0,0,0,0|3,0,0]=4 2318 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_200025704644_100011934319 [1,0,0,0,0,0|3,0,0]=4 2319 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_100012349665_200025704644 [1,0,0,0,0,0|3,0,0]=4 2320 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_200025704644_100012349665 [1,0,0,0,0,0|3,0,0]=4 2321 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_100000767054_200025704644 [1,0,0,0,0,0|3,0,0]=4 2322 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_200025704644_100000767054 [1,0,0,0,0,0|3,0,0]=4 2323 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_100000716492_200025704644 [1,0,0,0,0,0|3,0,0]=4 2324 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_200025704644_100000716492 [1,0,0,0,0,0|3,0,0]=4 2325 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_100000757363_200025704644 [1,0,0,0,0,0|3,0,0]=4 2326 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_200025704644_100000757363 [1,0,0,0,0,0|3,0,0]=4 2327 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_100010149604_200025704644 [1,0,0,0,0,0|3,0,0]=4 2328 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_200025704644_100010149604 [1,0,0,0,0,0|3,0,0]=4 2329 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_100010146616_200025704644 [1,0,0,0,0,0|3,0,0]=4 2330 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_200025704644_100010146616 [1,0,0,0,0,0|3,0,0]=4 2331 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_100010188208_200025704644 [1,0,0,0,0,0|3,0,0]=4 2332 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_200025704644_100010188208 [1,0,0,0,0,0|3,0,0]=4 2333 B13R1.136 C#CCSc1cc(c(c(c1)F)O)O 62a_100000038162_100010114375 [0,1,0,0,0,0|2,0,1]=4 2334 B13R1.136 C#CCSc1cc(c(c(c1)O)O)O 62a_100000038162_100010658518 [0,1,0,0,0,0|2,0,1]=4 2335 B13R1.136 C=CCSc1cc(c(c(c1)F)O)O 62a_100000210623_100010114375 [0,1,0,0,0,0|2,0,1]=4 2336 B13R1.136 C=CCSc1cc(c(c(c1)O)O)O 62a_100000210623_100010658518 [0,1,0,0,0,0|2,0,1]=4 2337 B13R1.136 CCCCc1cc(c(c(c1)Br)C)Br 271570a_100020621405_100011099977 [0,1,0,0,0,0|3,0,0]=4 2338 B13R1.136 CCCCc1cc(c(c(c1)Br)O)C 271570a_100020621405_100010982682 [0,1,0,0,0,0|2,0,0]=3 2339 B13R1.136 CCCCc1cc(c(c(c1)C)C)C 271570a_100020621405_200011015895 [0,1,0,0,0,0|3,0,0]=4 2340 B13R1.136 CCCCc1cc(c(c(c1)C)F)C 271570a_100020621405_100009814169 [0,1,0,0,0,0|3,0,0]=4 2341 B13R1.136 CCCCc1cc(c(c(c1)C)N)C 271570a_100020621405_100000737279 [0,1,0,0,0,0|3,0,0]=4 2342 B13R1.136 CCCCc1cc(c(c(c1)C)O)C 271570a_100020621405_100000187306 [0,1,0,0,0,0|2,0,0]=3 2343 B13R1.136 CCCCc1cc(c(c(c1)Cl)F)Cl 271570a_100020621405_100012357505 [0,1,0,0,0,0|3,0,0]=4 2344 B13R1.136 CCCCc1cc(c(c(c1)Cl)O)C 271570a_100020621405_200015900153 [0,1,0,0,0,0|2,0,0]=3 2345 B13R1.136 CCCCc1cc(c(c(c1)Cl)O)Cl 271570a_100020621405_100012339652 [0,1,0,0,0,0|2,0,0]=3 2346 B13R1.136 CCCCc1cc(c(c(c1)F)C)F 271570a_100020621405_100009814309 [0,1,0,0,0,0|3,0,0]=4 2347 B13R1.136 CCCCc1cc(c(c(c1)F)C)N 271570a_100020621405_100009813729 [0,1,0,0,0,0|3,0,0]=4 2348 B13R1.136 CCCCc1cc(c(c(c1)F)Cl)F 271570a_100020621405_100010154629 [0,1,0,0,0,0|3,0,0]=4 2349 B13R1.136 CCCCc1cc(c(c(c1)F)F)C 271570a_100020621405_200011068660 [0,1,0,0,0,0|3,0,0]=4 2350 B13R1.136 CCCCc1cc(c(c(c1)F)F)F 271570a_100020621405_100011215606 [0,1,0,0,0,0|3,0,0]=4 2351 B13R1.136 CCCCc1cc(c(c(c1)F)F)O 271570a_100020621405_100000709865 [0,1,0,0,0,0|2,0,0]=3 2352 B13R1.136 CCCCc1cc(c(c(c1)F)N)C 271570a_100020621405_100000709789 [0,1,0,0,0,0|3,0,0]=4 2353 B13R1.136 CCCCc1cc(c(c(c1)F)N)F 271570a_100020621405_100000758902 [0,1,0,0,0,0|3,0,0]=4 2354 B13R1.136 CCCCc1cc(c(c(c1)F)N)N 271570a_100020621405_100011218333 [0,1,0,0,0,0|3,0,0]=4 2355 B13R1.136 CCCCc1cc(c(c(c1)F)N)O 271570a_100020621405_100015475841 [0,1,0,0,0,0|2,0,0]=3 2356 B13R1.136 CCCCc1cc(c(c(c1)F)O)F 271570a_100020621405_100011216917 [0,1,0,0,0,0|2,0,0]=3 2357 B13R1.136 CCCCc1cc(c(c(c1)F)O)N 271570a_100020621405_100011217383 [0,1,0,0,0,0|2,0,0]=3 2358 B13R1.136 CCCCc1cc(c(c(c1)N)F)C 271570a_100020621405_100010381932 [0,1,0,0,0,0|3,0,0]=4 2359 B13R1.136 CCCCc1cc(c(c(c1)N)N)C 271570a_100020621405_100000688557 [0,1,0,0,0,0|3,0,0]=4 2360 B13R1.136 CCCCc1cc(c(c(c1)N)O)C 271570a_100020621405_100011825904 [0,1,0,0,0,0|2,0,0]=3 2361 B13R1.136 CCCCc1cc(c(c(c1)O)N)C 271570a_100020621405_100010371313 [0,1,0,0,0,0|2,0,0]=3 2362 B13R1.136 CCCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100000210303 [0,1,0,0,0,0|3,0,0]=4 2363 B13R1.136 CCCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000210303 [0,1,0,0,0,0|3,0,0]=4 2364 B13R1.136 CCCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000210303 [0,1,0,0,0,0|3,0,0]=4 2365 B13R1.136 CCCNc1cc(c(c(c1)C)O)C 34a_100000703291_100000210303 [0,1,0,0,0,0|3,0,0]=4 2366 B13R1.136 CCCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000210303 [0,1,0,0,0,0|3,0,0]=4 2367 B13R1.136 CCCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100000210303 [0,1,0,0,0,0|3,0,0]=4 2368 B13R1.136 CCCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000210303 [0,1,0,0,0,0|3,0,0]=4 2369 B13R1.136 CCCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100000210303 [0,1,0,0,0,0|3,0,0]=4 2370 B13R1.136 CCCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000210303 [0,1,0,0,0,0|3,0,0]=4 2371 B13R1.136 CCCNc1cc(c(c(c1)F)O)F 34a_100016987357_100000210303 [0,1,0,0,0,0|3,0,0]=4 2372 B13R1.136 CCCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000210303 [0,1,0,0,0,0|3,0,0]=4 2373 B13R1.136 CCCSc1cc(c(c(c1)Br)O)C 62a_100000210303_100010982682 [0,1,0,0,0,0|3,0,0]=4 2374 B13R1.136 CCCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000210303 [0,1,0,0,0,0|3,0,0]=4 2375 B13R1.136 CCCSc1cc(c(c(c1)C)O)C 62a_100000210303_100011216129 [0,1,0,0,0,0|3,0,0]=4 2376 B13R1.136 CCCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000210303 [0,1,0,0,0,0|3,0,0]=4 2377 B13R1.136 CCCSc1cc(c(c(c1)Cl)O)C 62a_100000210303_200015900153 [0,1,0,0,0,0|3,0,0]=4 2378 B13R1.136 CCCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000210303 [0,1,0,0,0,0|3,0,0]=4 2379 B13R1.136 CCCSc1cc(c(c(c1)Cl)O)Cl 62a_100000210303_100012339652 [0,1,0,0,0,0|3,0,0]=4 2380 B13R1.136 CCCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000210303 [0,1,0,0,0,0|3,0,0]=4 2381 B13R1.136 CCCSc1cc(c(c(c1)F)F)O 62a_100000210303_100000709865 [0,1,0,0,0,0|3,0,0]=4 2382 B13R1.136 CCCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000210303 [0,1,0,0,0,0|3,0,0]=4 2383 B13R1.136 CCCSc1cc(c(c(c1)F)N)O 62a_100000210303_100015475841 [0,1,0,0,0,0|3,0,0]=4 2384 B13R1.136 CCCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000210303 [0,1,0,0,0,0|3,0,0]=4 2385 B13R1.136 CCCSc1cc(c(c(c1)F)O)F 62a_100000210303_100011216917 [0,1,0,0,0,0|3,0,0]=4 2386 B13R1.136 CCCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000210303 [0,1,0,0,0,0|3,0,0]=4 2387 B13R1.136 CCCSc1cc(c(c(c1)F)O)N 62a_100000210303_100011217383 [0,1,0,0,0,0|3,0,0]=4 2388 B13R1.136 CCCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000210303 [0,1,0,0,0,0|3,0,0]=4 2389 B13R1.136 CCCSc1cc(c(c(c1)F)O)O 62a_100000210303_100010114375 [0,1,0,0,0,0|2,0,0]=3 2390 B13R1.136 CCCSc1cc(c(c(c1)N)O)C 62a_100000210303_100011825904 [0,1,0,0,0,0|3,0,0]=4 2391 B13R1.136 CCCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000210303 [0,1,0,0,0,0|3,0,0]=4 2392 B13R1.136 CCCSc1cc(c(c(c1)O)N)C 62a_100000210303_100010371313 [0,1,0,0,0,0|3,0,0]=4 2393 B13R1.136 CCCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000210303 [0,1,0,0,0,0|3,0,0]=4 2394 B13R1.136 CCCSc1cc(c(c(c1)O)O)O 62a_100000210303_100010658518 [0,1,0,0,0,0|2,0,0]=3 2395 B13R1.136 COCCc1cc(c(c(c1)F)F)F 34a_200011830273_200000210301 [0,1,0,0,0,0|3,0,0]=4 2396 B13R1.136 COCCc1cc(c(c(c1)F)F)F 7a_200011830273_200000210301 [0,1,0,0,0,0|3,0,0]=4 2397 B13R1.136 COCSc1cc(c(c(c1)Br)O)C 62a_100000766300_100010982682 [0,1,0,0,0,0|3,0,0]=4 2398 B13R1.136 COCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000766300 [0,1,0,0,0,0|3,0,0]=4 2399 B13R1.136 COCSc1cc(c(c(c1)C)O)C 62a_100000766300_100011216129 [0,1,0,0,0,0|3,0,0]=4 2400 B13R1.136 COCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000766300 [0,1,0,0,0,0|3,0,0]=4 2401 B13R1.136 COCSc1cc(c(c(c1)Cl)O)C 62a_100000766300_200015900153 [0,1,0,0,0,0|3,0,0]=4 2402 B13R1.136 COCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000766300 [0,1,0,0,0,0|3,0,0]=4 2403 B13R1.136 COCSc1cc(c(c(c1)Cl)O)Cl 62a_100000766300_100012339652 [0,1,0,0,0,0|3,0,0]=4 2404 B13R1.136 COCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000766300 [0,1,0,0,0,0|3,0,0]=4 2405 B13R1.136 COCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000766300 [0,1,0,0,0,0|3,0,0]=4 2406 B13R1.136 COCSc1cc(c(c(c1)F)F)O 62a_100000766300_100000709865 [0,1,0,0,0,0|3,0,0]=4 2407 B13R1.136 COCSc1cc(c(c(c1)F)N)O 62a_100000766300_100015475841 [0,1,0,0,0,0|3,0,0]=4 2408 B13R1.136 COCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000766300 [0,1,0,0,0,0|3,0,0]=4 2409 B13R1.136 COCSc1cc(c(c(c1)F)O)F 62a_100000766300_100011216917 [0,1,0,0,0,0|3,0,0]=4 2410 B13R1.136 COCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000766300 [0,1,0,0,0,0|3,0,0]=4 2411 B13R1.136 COCSc1cc(c(c(c1)F)O)N 62a_100000766300_100011217383 [0,1,0,0,0,0|3,0,0]=4 2412 B13R1.136 COCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000766300 [0,1,0,0,0,0|3,0,0]=4 2413 B13R1.136 COCSc1cc(c(c(c1)F)O)O 62a_100000766300_100010114375 [0,1,0,0,0,0|2,0,0]=3 2414 B13R1.136 COCSc1cc(c(c(c1)N)O)C 62a_100000766300_100011825904 [0,1,0,0,0,0|3,0,0]=4 2415 B13R1.136 COCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000766300 [0,1,0,0,0,0|3,0,0]=4 2416 B13R1.136 COCSc1cc(c(c(c1)O)N)C 62a_100000766300_100010371313 [0,1,0,0,0,0|3,0,0]=4 2417 B13R1.136 COCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000766300 [0,1,0,0,0,0|3,0,0]=4 2418 B13R1.136 COCSc1cc(c(c(c1)O)O)O 62a_100000766300_100010658518 [0,1,0,0,0,0|2,0,0]=3 2419 B13R1.136 CSCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100011218213 [0,1,0,0,0,0|3,0,0]=4 2420 B13R1.136 CSCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100011218213 [0,1,0,0,0,0|3,0,0]=4 2421 B13R1.136 CSCNc1cc(c(c(c1)C)O)C 34a_100000703291_100011218213 [0,1,0,0,0,0|3,0,0]=4 2422 B13R1.136 CSCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100011218213 [0,1,0,0,0,0|3,0,0]=4 2423 B13R1.136 CSCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100011218213 [0,1,0,0,0,0|3,0,0]=4 2424 B13R1.136 CSCNc1cc(c(c(c1)F)O)F 34a_100016987357_100011218213 [0,1,0,0,0,0|3,0,0]=4 2425 B13R1.136 CSCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100011218213 [0,1,0,0,0,0|3,0,0]=4 2426 B13R1.136 CSCSc1cc(c(c(c1)Br)O)C 62a_100011218213_100010982682 [0,1,0,0,0,0|3,0,0]=4 2427 B13R1.136 CSCSc1cc(c(c(c1)C)O)C 62a_100011216129_100011218213 [0,1,0,0,0,0|3,0,0]=4 2428 B13R1.136 CSCSc1cc(c(c(c1)C)O)C 62a_100011218213_100011216129 [0,1,0,0,0,0|3,0,0]=4 2429 B13R1.136 CSCSc1cc(c(c(c1)Cl)O)C 62a_100011218213_200015900153 [0,1,0,0,0,0|3,0,0]=4 2430 B13R1.136 CSCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100011218213 [0,1,0,0,0,0|3,0,0]=4 2431 B13R1.136 CSCSc1cc(c(c(c1)Cl)O)Cl 62a_100011218213_100012339652 [0,1,0,0,0,0|3,0,0]=4 2432 B13R1.136 CSCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100011218213 [0,1,0,0,0,0|3,0,0]=4 2433 B13R1.136 CSCSc1cc(c(c(c1)F)F)O 62a_100000709865_100011218213 [0,1,0,0,0,0|3,0,0]=4 2434 B13R1.136 CSCSc1cc(c(c(c1)F)F)O 62a_100011218213_100000709865 [0,1,0,0,0,0|3,0,0]=4 2435 B13R1.136 CSCSc1cc(c(c(c1)F)N)O 62a_100011218213_100015475841 [0,1,0,0,0,0|3,0,0]=4 2436 B13R1.136 CSCSc1cc(c(c(c1)F)N)O 62a_100015475841_100011218213 [0,1,0,0,0,0|3,0,0]=4 2437 B13R1.136 CSCSc1cc(c(c(c1)F)O)F 62a_100011216917_100011218213 [0,1,0,0,0,0|3,0,0]=4 2438 B13R1.136 CSCSc1cc(c(c(c1)F)O)F 62a_100011218213_100011216917 [0,1,0,0,0,0|3,0,0]=4 2439 B13R1.136 CSCSc1cc(c(c(c1)F)O)N 62a_100011217383_100011218213 [0,1,0,0,0,0|3,0,0]=4 2440 B13R1.136 CSCSc1cc(c(c(c1)F)O)N 62a_100011218213_100011217383 [0,1,0,0,0,0|3,0,0]=4 2441 B13R1.136 CSCSc1cc(c(c(c1)F)O)O 62a_100011218213_100010114375 [0,1,0,0,0,0|2,0,0]=3 2442 B13R1.136 CSCSc1cc(c(c(c1)N)O)C 62a_100011218213_100011825904 [0,1,0,0,0,0|3,0,0]=4 2443 B13R1.136 CSCSc1cc(c(c(c1)N)O)C 62a_100011825904_100011218213 [0,1,0,0,0,0|3,0,0]=4 2444 B13R1.136 CSCSc1cc(c(c(c1)O)N)C 62a_100010371313_100011218213 [0,1,0,0,0,0|3,0,0]=4 2445 B13R1.136 CSCSc1cc(c(c(c1)O)N)C 62a_100011218213_100010371313 [0,1,0,0,0,0|3,0,0]=4 2446 B13R1.136 CSCSc1cc(c(c(c1)O)O)O 62a_100011218213_100010658518 [0,1,0,0,0,0|2,0,0]=3 2447 B13R1.136 N#CCSc1cc(c(c(c1)F)O)O 62a_100011215382_100010114375 [0,1,0,0,0,0|3,0,0]=4 2448 B13R1.136 N#CCSc1cc(c(c(c1)O)O)O 62a_100011215382_100010658518 [0,1,0,0,0,0|3,0,0]=4 2449 B13R1.136 O=CCSc1cc(c(c(c1)F)O)O 62a_200015260668_100010114375 [0,1,0,0,0,0|3,0,0]=4 2450 B13R1.136 O=CCSc1cc(c(c(c1)O)O)O 62a_200015260668_100010658518 [0,1,0,0,0,0|3,0,0]=4 2451 B13R1.136 OCCSc1cc(c(c(c1)F)O)O 62a_100000211926_100010114375 [0,1,0,0,0,0|3,0,0]=4 2452 B13R1.136 OCCSc1cc(c(c(c1)O)O)O 62a_100000211926_100010658518 [0,1,0,0,0,0|3,0,0]=4 2453 B13R1.136 Oc1cc(cc(c1O)F)SCCF 62a_100011217306_100010114375 [0,1,0,0,0,0|3,0,0]=4 2454 B13R1.136 Oc1cc(cc(c1O)O)SCCF 62a_100011217306_100010658518 [0,1,0,0,0,0|3,0,0]=4 2455 B13R1.136 [13CH3]OCCc1cc(c(c(c1)F)F)F 34a_200011830273_200025704644 [0,1,0,0,0,0|3,0,0]=4 2456 B13R1.136 [13CH3]OCCc1cc(c(c(c1)F)F)F 7a_200011830273_200025704644 [0,1,0,0,0,0|3,0,0]=4 2457 B13R1.466 C#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000184674 [0,1,0,0,0,0|1,0,2]=4 2458 B13R1.466 C=CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210623 [0,1,0,0,0,0|1,0,2]=4 2459 B13R1.466 CCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210303 [0,1,0,0,0,0|2,0,1]=4 2460 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210303 [0,1,0,0,0,0|2,0,1]=4 2461 B13R1.466 CCCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012345043 [0,1,0,0,0,0|2,0,1]=4 2462 B13R1.466 CCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210303 [0,1,0,0,0,0|2,0,1]=4 2463 B13R1.466 CCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210303 [0,1,0,0,0,0|2,0,1]=4 2464 B13R1.466 CCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210303 [0,1,0,0,0,0|2,0,1]=4 2465 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210303 [0,1,0,0,0,0|2,0,1]=4 2466 B13R1.466 CCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210303 [0,1,0,0,0,0|2,0,1]=4 2467 B13R1.466 CCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210303 [0,1,0,0,0,0|2,0,1]=4 2468 B13R1.466 CCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210303 [0,1,0,0,0,0|2,0,1]=4 2469 B13R1.466 CCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210303 [0,1,0,0,0,0|2,0,1]=4 2470 B13R1.466 CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210303 [0,1,0,0,0,0|1,0,1]=3 2471 B13R1.466 CCNC(C)c1ccc(c(c1)Br)O 269862a_100015525214_100011772453 [0,1,0,0,0,0|3,0,0]=4 2472 B13R1.466 CCNC(C)c1ccc(c(c1)C)O 269862a_100015525214_100000188726 [0,1,0,0,0,0|3,0,0]=4 2473 B13R1.466 CCNC(C)c1ccc(c(c1)Cl)O 269862a_100015525214_100000188625 [0,1,0,0,0,0|3,0,0]=4 2474 B13R1.466 CCNC(C)c1ccc(c(c1)F)O 269862a_100015525214_100000751691 [0,1,0,0,0,0|3,0,0]=4 2475 B13R1.466 CCNC(C)c1ccc(c(c1)O)C 269862a_100015525214_100000084092 [0,1,0,0,0,0|3,0,0]=4 2476 B13R1.466 CCNC(C)c1ccc(c(c1)O)F 269862a_100015525214_100000117923 [0,1,0,0,0,0|3,0,0]=4 2477 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100009812659 [0,1,0,0,0,0|2,0,1]=4 2478 B13R1.466 CCOC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012355281 [0,1,0,0,0,0|2,0,1]=4 2479 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 2230a_106832991635_100012346676 [0,1,0,0,0,0|2,0,1]=4 2480 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 34a_100102657272_100012346676 [0,1,0,0,0,0|2,0,1]=4 2481 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)C 7a_106832991635_100012346676 [0,1,0,0,0,0|2,0,1]=4 2482 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 2230a_106832991635_100011217175 [0,1,0,0,0,0|2,0,1]=4 2483 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 34a_100102657272_100011217175 [0,1,0,0,0,0|2,0,1]=4 2484 B13R1.466 CNCC(=O)c1ccc(c(c1)Br)F 7a_106832991635_100011217175 [0,1,0,0,0,0|2,0,1]=4 2485 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 2230a_106832991635_100000183365 [0,1,0,0,0,0|2,0,1]=4 2486 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C 7a_106832991635_100000183365 [0,1,0,0,0,0|2,0,1]=4 2487 B13R1.466 CNCC(=O)c1ccc(c(c1)C)Cl 7a_106832991635_200011216723 [0,1,0,0,0,0|2,0,1]=4 2488 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Br 2230a_106832991635_200012349649 [0,1,0,0,0,0|2,0,1]=4 2489 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Br 34a_100102657272_200012349649 [0,1,0,0,0,0|2,0,1]=4 2490 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 2230a_106832991635_100000211430 [0,1,0,0,0,0|2,0,1]=4 2491 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl 7a_106832991635_100000211430 [0,1,0,0,0,0|2,0,1]=4 2492 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 2230a_106832991635_100000757878 [0,1,0,0,0,0|2,0,1]=4 2493 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 34a_100102657272_100000757878 [0,1,0,0,0,0|2,0,1]=4 2494 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)F 7a_106832991635_100000757878 [0,1,0,0,0,0|2,0,1]=4 2495 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)O 7a_106832991635_200010170092 [0,1,0,0,0,0|1,0,1]=3 2496 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 2230a_106832991635_100012361357 [0,1,0,0,0,0|2,0,1]=4 2497 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 34a_100102657272_100012361357 [0,1,0,0,0,0|2,0,1]=4 2498 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Br 7a_106832991635_100012361357 [0,1,0,0,0,0|2,0,1]=4 2499 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 2230a_106832991635_100011219196 [0,1,0,0,0,0|2,0,1]=4 2500 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 34a_100102657272_100011219196 [0,1,0,0,0,0|2,0,1]=4 2501 B13R1.466 CNCC(=O)c1ccc(c(c1)F)C 7a_106832991635_100011219196 [0,1,0,0,0,0|2,0,1]=4 2502 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 2230a_106832991635_100012351892 [0,1,0,0,0,0|2,0,1]=4 2503 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 34a_100102657272_100012351892 [0,1,0,0,0,0|2,0,1]=4 2504 B13R1.466 CNCC(=O)c1ccc(c(c1)F)Cl 7a_106832991635_100012351892 [0,1,0,0,0,0|2,0,1]=4 2505 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 2230a_106832991635_100000183380 [0,1,0,0,0,0|2,0,1]=4 2506 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 34a_100102657272_100000183380 [0,1,0,0,0,0|2,0,1]=4 2507 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F 7a_106832991635_100000183380 [0,1,0,0,0,0|2,0,1]=4 2508 B13R1.466 CNCC(=O)c1ccc(c(c1)O)O 7a_106832991635_100000183813 [0,1,0,0,0,0|0,0,1]=2 2509 B13R1.466 CNCC(O)c1ccc(c(c1)O)O 34a_100000106456_200000210301 [0,1,0,0,0,0|0,0,0]=1 2510 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 2230a_106832991635_100000761251 [0,1,0,0,0,0|2,0,0]=3 2511 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 34a_100102657272_100000761251 [0,1,0,0,0,0|2,0,0]=3 2512 B13R1.466 CNC[C@@H](O)c1ccc(c(c1)F)F 7a_106832991635_100000761251 [0,1,0,0,0,0|2,0,0]=3 2513 B13R1.466 CNNC(=O)c1ccc(c(c1)Br)O 22a_100016993582_100000189672 [0,1,0,0,0,0|2,0,1]=4 2514 B13R1.466 CNNC(=O)c1ccc(c(c1)C)O 22a_100016993582_100000685612 [0,1,0,0,0,0|2,0,1]=4 2515 B13R1.466 CNNC(=O)c1ccc(c(c1)Cl)O 22a_100016993582_100000212196 [0,1,0,0,0,0|2,0,1]=4 2516 B13R1.466 CNNC(=O)c1ccc(c(c1)F)O 22a_100016993582_100000185466 [0,1,0,0,0,0|2,0,1]=4 2517 B13R1.466 CNNC(=O)c1ccc(c(c1)I)O 22a_100016993582_100000037485 [0,1,0,0,0,0|2,0,1]=4 2518 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Br 22a_100016993582_100000689001 [0,1,0,0,0,0|2,0,1]=4 2519 B13R1.466 CNNC(=O)c1ccc(c(c1)O)C 22a_100016993582_100000233767 [0,1,0,0,0,0|2,0,1]=4 2520 B13R1.466 CNNC(=O)c1ccc(c(c1)O)Cl 22a_100016993582_100011933997 [0,1,0,0,0,0|2,0,1]=4 2521 B13R1.466 CNNC(=O)c1ccc(c(c1)O)F 22a_100016993582_100000035894 [0,1,0,0,0,0|2,0,1]=4 2522 B13R1.466 CNNC(=O)c1ccc(c(c1)O)I 22a_100016993582_100000239334 [0,1,0,0,0,0|2,0,1]=4 2523 B13R1.466 COCC(N)c1ccc(c(c1)Cl)Cl 34a_100011404344_200000210301 [0,1,0,0,0,0|3,0,0]=4 2524 B13R1.466 COC[C@@H](O)c1ccc(c(c1)F)F 34a_100138415774_100000761251 [0,1,0,0,0,0|3,0,0]=4 2525 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200000210301_200010170092 [0,1,0,0,0,0|2,0,1]=4 2526 B13R1.466 CSCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200000210301 [0,1,0,0,0,0|2,0,1]=4 2527 B13R1.466 CSCC(=O)c1ccc(c(c1)O)O 62a_200000210301_100000183813 [0,1,0,0,0,0|1,0,1]=3 2528 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200000210301 [0,1,0,0,0,0|3,0,0]=4 2529 B13R1.466 CSC[C@@H](O)c1ccc(c(c1)F)F 62a_200000210301_100000761251 [0,1,0,0,0,0|3,0,0]=4 2530 B13R1.466 N#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011214920 [0,1,0,0,0,0|2,0,1]=4 2531 B13R1.466 O=C(CCF)c1ccc(c(c1)O)O 1458a_100000212155_100011217306 [0,1,0,0,0,0|2,0,1]=4 2532 B13R1.466 O=C(CCO)c1ccc(c(c1)O)O 1458a_100000212155_100000211926 [0,1,0,0,0,0|2,0,1]=4 2533 B13R1.466 [13CH3]NCC(O)c1ccc(c(c1)O)O 34a_100000106456_200025704644 [0,1,0,0,0,0|0,0,0]=1 2534 B13R1.466 [13CH3]OCC(N)c1ccc(c(c1)Cl)Cl 34a_100011404344_200025704644 [0,1,0,0,0,0|3,0,0]=4 2535 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200010170092_200025704644 [0,1,0,0,0,0|2,0,1]=4 2536 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)Cl)O 62a_200025704644_200010170092 [0,1,0,0,0,0|2,0,1]=4 2537 B13R1.466 [13CH3]SCC(=O)c1ccc(c(c1)O)O 62a_200025704644_100000183813 [0,1,0,0,0,0|1,0,1]=3 2538 B13R1.466 [13CH3]SC[C@@H](O)c1ccc(c(c1)F)F 62a_100000761251_200025704644 [0,1,0,0,0,0|3,0,0]=4 2539 B13R1.466 [13CH3]SC[C@@H](O)c1ccc(c(c1)F)F 62a_200025704644_100000761251 [0,1,0,0,0,0|3,0,0]=4 2540 B13R1.511 C=C(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000748629 [0,1,0,0,0,0|3,0,0]=4 2541 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 34a_100011218179_100000748629 [0,1,0,0,0,0|3,0,0]=4 2542 B13R1.511 C=C(C)CNc1ccc(c(c1)C)O 7a_100011218179_100000748629 [0,1,0,0,0,0|3,0,0]=4 2543 B13R1.511 C=C(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000748629 [0,1,0,0,0,0|3,0,0]=4 2544 B13R1.511 C=C(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000748629 [0,1,0,0,0,0|3,0,0]=4 2545 B13R1.511 C=C(C)CNc1ccc(c(c1)F)O 7a_100011220035_100000748629 [0,1,0,0,0,0|3,0,0]=4 2546 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 34a_100000759471_100000748629 [0,1,0,0,0,0|3,0,0]=4 2547 B13R1.511 C=C(C)CNc1ccc(c(c1)O)C 7a_100000759471_100000748629 [0,1,0,0,0,0|3,0,0]=4 2548 B13R1.511 C=C(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000748629 [0,1,0,0,0,0|3,0,0]=4 2549 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000748629 [0,1,0,0,0,0|3,0,0]=4 2550 B13R1.511 C=C(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000748629 [0,1,0,0,0,0|3,0,0]=4 2551 B13R1.511 C=C(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748629 [0,1,0,0,0,0|2,0,0]=3 2552 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)O 62a_100000748629_100012361655 [0,1,0,0,0,0|3,0,0]=4 2553 B13R1.511 C=C(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000211660 [0,1,0,0,0,0|3,0,0]=4 2554 B13R1.511 C=C(C)CSc1ccc(c(c1)C)O 62a_100000748629_100000186361 [0,1,0,0,0,0|3,0,0]=4 2555 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)O 62a_100000748629_100012360047 [0,1,0,0,0,0|3,0,0]=4 2556 B13R1.511 C=C(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000211660 [0,1,0,0,0,0|3,0,0]=4 2557 B13R1.511 C=C(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000211660 [0,1,0,0,0,0|3,0,0]=4 2558 B13R1.511 C=C(C)CSc1ccc(c(c1)F)O 62a_100000748629_100000185481 [0,1,0,0,0,0|3,0,0]=4 2559 B13R1.511 C=C(C)CSc1ccc(c(c1)N)O 62a_100000748629_100000752626 [0,1,0,0,0,0|3,0,0]=4 2560 B13R1.511 C=C(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000211660 [0,1,0,0,0,0|3,0,0]=4 2561 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100000748629_100012356990 [0,1,0,0,0,0|3,0,0]=4 2562 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000211660 [0,1,0,0,0,0|3,0,0]=4 2563 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000685420_100000211660 [0,1,0,0,0,0|3,0,0]=4 2564 B13R1.511 C=C(C)CSc1ccc(c(c1)O)C 62a_100000748629_100000685420 [0,1,0,0,0,0|3,0,0]=4 2565 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100000748629_100011356854 [0,1,0,0,0,0|3,0,0]=4 2566 B13R1.511 C=C(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000211660 [0,1,0,0,0,0|3,0,0]=4 2567 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000211660 [0,1,0,0,0,0|3,0,0]=4 2568 B13R1.511 C=C(C)CSc1ccc(c(c1)O)F 62a_100000748629_100000686035 [0,1,0,0,0,0|3,0,0]=4 2569 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000211660 [0,1,0,0,0,0|3,0,0]=4 2570 B13R1.511 C=C(C)CSc1ccc(c(c1)O)N 62a_100000748629_100000739049 [0,1,0,0,0,0|3,0,0]=4 2571 B13R1.511 C=C(C)CSc1ccc(c(c1)O)O 62a_100000748629_100009813601 [0,1,0,0,0,0|2,0,0]=3 2572 B13R1.511 C=C(F)CNc1ccc(c(c1)O)O 34a_100102946323_100009893438 [0,1,0,0,0,0|2,0,1]=4 2573 B13R1.511 C=C(F)CSc1ccc(c(c1)O)O 62a_100000042424_100009813601 [0,1,0,0,0,0|2,0,1]=4 2574 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)C 1458a_100010220830_200000210301 [0,1,0,0,0,0|3,0,0]=4 2575 B13R1.511 CC(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200000210301 [0,1,0,0,0,0|3,0,0]=4 2576 B13R1.511 CC(=O)CCc1ccc(c(c1)C)C 1458a_100011338283_200000210301 [0,1,0,0,0,0|3,0,0]=4 2577 B13R1.511 CC(=O)CCc1ccc(c(c1)C)F 1458a_100011615030_200000210301 [0,1,0,0,0,0|3,0,0]=4 2578 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200000210301 [0,1,0,0,0,0|3,0,0]=4 2579 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000070787_100011713676 [0,1,0,0,0,0|3,0,0]=4 2580 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200000210301 [0,1,0,0,0,0|3,0,0]=4 2581 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100000070787_100012361305 [0,1,0,0,0,0|3,0,0]=4 2582 B13R1.511 CC(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200000210301 [0,1,0,0,0,0|3,0,0]=4 2583 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200000210301 [0,1,0,0,0,0|3,0,0]=4 2584 B13R1.511 CC(=O)CCc1ccc(c(c1)F)C 1458a_100011830284_200000210301 [0,1,0,0,0,0|3,0,0]=4 2585 B13R1.511 CC(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200000210301 [0,1,0,0,0,0|3,0,0]=4 2586 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000070787_100000690553 [0,1,0,0,0,0|3,0,0]=4 2587 B13R1.511 CC(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200000210301 [0,1,0,0,0,0|3,0,0]=4 2588 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [0,1,0,0,0,0|1,0,0]=2 2589 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [0,1,0,0,0,0|1,0,0]=2 2590 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 240690a_100000758358_100015343762 [0,1,0,0,0,0|3,0,0]=4 2591 B13R1.511 CC(=O)NCc1ccc(c(c1)F)O 527a_100000758358_100103153847 [0,1,0,0,0,0|3,0,0]=4 2592 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 240690a_100020636435_100015343762 [0,1,0,0,0,0|3,0,0]=4 2593 B13R1.511 CC(=O)NCc1ccc(c(c1)O)Cl 527a_100020636435_100103153847 [0,1,0,0,0,0|3,0,0]=4 2594 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 240690a_100160469508_100015343762 [0,1,0,0,0,0|3,0,0]=4 2595 B13R1.511 CC(=O)NCc1ccc(c(c1)O)F 527a_100160469508_100103153847 [0,1,0,0,0,0|3,0,0]=4 2596 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [0,1,0,0,0,0|2,0,0]=3 2597 B13R1.511 CC(C)C=Cc1ccc(c(c1)O)O 271570a_100016257149_100009813601 [0,1,0,0,0,0|1,0,2]=4 2598 B13R1.511 CC(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000210624 [0,1,0,0,0,0|3,0,0]=4 2599 B13R1.511 CC(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000210624 [0,1,0,0,0,0|3,0,0]=4 2600 B13R1.511 CC(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000210624 [0,1,0,0,0,0|3,0,0]=4 2601 B13R1.511 CC(C)CNc1ccc(c(c1)F)O 7a_100011220035_100000210760 [0,1,0,0,0,0|3,0,0]=4 2602 B13R1.511 CC(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000210624 [0,1,0,0,0,0|3,0,0]=4 2603 B13R1.511 CC(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000210624 [0,1,0,0,0,0|3,0,0]=4 2604 B13R1.511 CC(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000210760 [0,1,0,0,0,0|3,0,0]=4 2605 B13R1.511 CC(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000210624 [0,1,0,0,0,0|2,0,0]=3 2606 B13R1.511 CC(C)COc1ccc(c(c1)Br)O 271570a_203496583355_201991077984 [0,1,0,0,0,0|3,0,0]=4 2607 B13R1.511 CC(C)CSc1ccc(c(c1)Br)O 62a_100000210624_100012361655 [0,1,0,0,0,0|3,0,0]=4 2608 B13R1.511 CC(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000210760 [0,1,0,0,0,0|3,0,0]=4 2609 B13R1.511 CC(C)CSc1ccc(c(c1)Cl)O 62a_100000210624_100012360047 [0,1,0,0,0,0|3,0,0]=4 2610 B13R1.511 CC(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000210760 [0,1,0,0,0,0|3,0,0]=4 2611 B13R1.511 CC(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000210760 [0,1,0,0,0,0|3,0,0]=4 2612 B13R1.511 CC(C)CSc1ccc(c(c1)F)O 62a_100000210624_100000185481 [0,1,0,0,0,0|3,0,0]=4 2613 B13R1.511 CC(C)CSc1ccc(c(c1)N)O 62a_100000210624_100000752626 [0,1,0,0,0,0|3,0,0]=4 2614 B13R1.511 CC(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000210760 [0,1,0,0,0,0|3,0,0]=4 2615 B13R1.511 CC(C)CSc1ccc(c(c1)O)Br 62a_100000210624_100012356990 [0,1,0,0,0,0|3,0,0]=4 2616 B13R1.511 CC(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000210760 [0,1,0,0,0,0|3,0,0]=4 2617 B13R1.511 CC(C)CSc1ccc(c(c1)O)Cl 62a_100000210624_100011356854 [0,1,0,0,0,0|3,0,0]=4 2618 B13R1.511 CC(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000210760 [0,1,0,0,0,0|3,0,0]=4 2619 B13R1.511 CC(C)CSc1ccc(c(c1)O)F 62a_100000210624_100000686035 [0,1,0,0,0,0|3,0,0]=4 2620 B13R1.511 CC(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000210760 [0,1,0,0,0,0|3,0,0]=4 2621 B13R1.511 CC(C)CSc1ccc(c(c1)O)N 62a_100000210624_100000739049 [0,1,0,0,0,0|3,0,0]=4 2622 B13R1.511 CC(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000210760 [0,1,0,0,0,0|3,0,0]=4 2623 B13R1.511 CC(C)CSc1ccc(c(c1)O)O 62a_100000210624_100009813601 [0,1,0,0,0,0|2,0,0]=3 2624 B13R1.511 CC(C)NCc1ccc(c(c1)F)O 34a_100000758358_100000210206 [0,1,0,0,0,0|3,0,0]=4 2625 B13R1.511 CC(C)NCc1ccc(c(c1)O)Cl 34a_100020636435_100000210206 [0,1,0,0,0,0|3,0,0]=4 2626 B13R1.511 CC(C)NCc1ccc(c(c1)O)F 34a_100160469508_100000210206 [0,1,0,0,0,0|3,0,0]=4 2627 B13R1.511 CC(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000210206 [0,1,0,0,0,0|2,0,0]=3 2628 B13R1.511 CC(O)C=Cc1ccc(c(c1)O)O 271570a_200011019289_100009813601 [0,1,0,0,0,0|1,0,2]=4 2629 B13R1.511 CC(O)CNc1ccc(c(c1)Br)O 34a_100011534360_100011218427 [0,1,0,0,0,0|3,0,0]=4 2630 B13R1.511 CC(O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100011218427 [0,1,0,0,0,0|3,0,0]=4 2631 B13R1.511 CC(O)CNc1ccc(c(c1)F)O 34a_100011220035_100011218427 [0,1,0,0,0,0|3,0,0]=4 2632 B13R1.511 CC(O)CNc1ccc(c(c1)F)O 7a_100011220035_100011218427 [0,1,0,0,0,0|3,0,0]=4 2633 B13R1.511 CC(O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100011218427 [0,1,0,0,0,0|3,0,0]=4 2634 B13R1.511 CC(O)CNc1ccc(c(c1)O)F 34a_100012017398_100011218427 [0,1,0,0,0,0|3,0,0]=4 2635 B13R1.511 CC(O)CNc1ccc(c(c1)O)F 7a_100012017398_100011218427 [0,1,0,0,0,0|3,0,0]=4 2636 B13R1.511 CC(O)CNc1ccc(c(c1)O)O 34a_100102946323_100011218427 [0,1,0,0,0,0|2,0,0]=3 2637 B13R1.511 CC(O)CSc1ccc(c(c1)Br)O 62a_100011218427_100012361655 [0,1,0,0,0,0|3,0,0]=4 2638 B13R1.511 CC(O)CSc1ccc(c(c1)Br)O 62a_100012361655_100011218427 [0,1,0,0,0,0|3,0,0]=4 2639 B13R1.511 CC(O)CSc1ccc(c(c1)Cl)O 62a_100011218427_100012360047 [0,1,0,0,0,0|3,0,0]=4 2640 B13R1.511 CC(O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100011218427 [0,1,0,0,0,0|3,0,0]=4 2641 B13R1.511 CC(O)CSc1ccc(c(c1)F)O 62a_100000185481_100011218427 [0,1,0,0,0,0|3,0,0]=4 2642 B13R1.511 CC(O)CSc1ccc(c(c1)F)O 62a_100011218427_100000185481 [0,1,0,0,0,0|3,0,0]=4 2643 B13R1.511 CC(O)CSc1ccc(c(c1)N)O 62a_100000752626_100011218427 [0,1,0,0,0,0|3,0,0]=4 2644 B13R1.511 CC(O)CSc1ccc(c(c1)N)O 62a_100011218427_100000752626 [0,1,0,0,0,0|3,0,0]=4 2645 B13R1.511 CC(O)CSc1ccc(c(c1)O)Br 62a_100011218427_100012356990 [0,1,0,0,0,0|3,0,0]=4 2646 B13R1.511 CC(O)CSc1ccc(c(c1)O)Br 62a_100012356990_100011218427 [0,1,0,0,0,0|3,0,0]=4 2647 B13R1.511 CC(O)CSc1ccc(c(c1)O)Cl 62a_100011218427_100011356854 [0,1,0,0,0,0|3,0,0]=4 2648 B13R1.511 CC(O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100011218427 [0,1,0,0,0,0|3,0,0]=4 2649 B13R1.511 CC(O)CSc1ccc(c(c1)O)F 62a_100000686035_100011218427 [0,1,0,0,0,0|3,0,0]=4 2650 B13R1.511 CC(O)CSc1ccc(c(c1)O)F 62a_100011218427_100000686035 [0,1,0,0,0,0|3,0,0]=4 2651 B13R1.511 CC(O)CSc1ccc(c(c1)O)N 62a_100000739049_100011218427 [0,1,0,0,0,0|3,0,0]=4 2652 B13R1.511 CC(O)CSc1ccc(c(c1)O)N 62a_100011218427_100000739049 [0,1,0,0,0,0|3,0,0]=4 2653 B13R1.511 CC(O)CSc1ccc(c(c1)O)O 62a_100011218427_100009813601 [0,1,0,0,0,0|2,0,0]=3 2654 B13R1.511 CN(C)CCc1ccc(c(c1)Cl)Cl 2230a_100102631434_100011713676 [0,1,0,0,0,0|2,0,0]=3 2655 B13R1.511 CN(C)CCc1ccc(c(c1)Cl)Cl 269982a_100102631434_100011713676 [0,1,0,0,0,0|2,0,0]=3 2656 B13R1.511 CN(C)CCc1ccc(c(c1)Cl)F 2230a_100102631434_100012361305 [0,1,0,0,0,0|2,0,0]=3 2657 B13R1.511 CN(C)CCc1ccc(c(c1)Cl)F 269982a_100102631434_100012361305 [0,1,0,0,0,0|2,0,0]=3 2658 B13R1.511 CN(C)CCc1ccc(c(c1)F)F 2230a_100102631434_100000690553 [0,1,0,0,0,0|2,0,0]=3 2659 B13R1.511 CN(C)CCc1ccc(c(c1)F)F 269982a_100102631434_100000690553 [0,1,0,0,0,0|2,0,0]=3 2660 B13R1.511 CN(C)CCc1ccc(c(c1)O)O 269982a_100102631434_200010393615 [0,1,0,0,0,0|0,0,0]=1 2661 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Br)O 34a_100011534360_100009817552 [0,1,0,0,0,0|3,0,0]=4 2662 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100009817552 [0,1,0,0,0,0|3,0,0]=4 2663 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)F)O 34a_100011220035_100009817552 [0,1,0,0,0,0|3,0,0]=4 2664 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)F)O 7a_100011220035_100009817552 [0,1,0,0,0,0|3,0,0]=4 2665 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100009817552 [0,1,0,0,0,0|3,0,0]=4 2666 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)F 34a_100012017398_100009817552 [0,1,0,0,0,0|3,0,0]=4 2667 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)F 7a_100012017398_100009817552 [0,1,0,0,0,0|3,0,0]=4 2668 B13R1.511 C[C@@H](O)CNc1ccc(c(c1)O)O 34a_100102946323_100009817552 [0,1,0,0,0,0|2,0,0]=3 2669 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Br)O 62a_100009817552_100012361655 [0,1,0,0,0,0|3,0,0]=4 2670 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Br)O 62a_100012361655_100009817552 [0,1,0,0,0,0|3,0,0]=4 2671 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Cl)O 62a_100009817552_100012360047 [0,1,0,0,0,0|3,0,0]=4 2672 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100009817552 [0,1,0,0,0,0|3,0,0]=4 2673 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)F)O 62a_100000185481_100009817552 [0,1,0,0,0,0|3,0,0]=4 2674 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)F)O 62a_100009817552_100000185481 [0,1,0,0,0,0|3,0,0]=4 2675 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)N)O 62a_100000752626_100009817552 [0,1,0,0,0,0|3,0,0]=4 2676 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)N)O 62a_100009817552_100000752626 [0,1,0,0,0,0|3,0,0]=4 2677 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Br 62a_100009817552_100012356990 [0,1,0,0,0,0|3,0,0]=4 2678 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Br 62a_100012356990_100009817552 [0,1,0,0,0,0|3,0,0]=4 2679 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Cl 62a_100009817552_100011356854 [0,1,0,0,0,0|3,0,0]=4 2680 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100009817552 [0,1,0,0,0,0|3,0,0]=4 2681 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)F 62a_100000686035_100009817552 [0,1,0,0,0,0|3,0,0]=4 2682 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)F 62a_100009817552_100000686035 [0,1,0,0,0,0|3,0,0]=4 2683 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)N 62a_100000739049_100009817552 [0,1,0,0,0,0|3,0,0]=4 2684 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)N 62a_100009817552_100000739049 [0,1,0,0,0,0|3,0,0]=4 2685 B13R1.511 C[C@@H](O)CSc1ccc(c(c1)O)O 62a_100009817552_100009813601 [0,1,0,0,0,0|2,0,0]=3 2686 B13R1.511 Cc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100011615030_200025704644 [0,1,0,0,0,0|3,0,0]=4 2687 B13R1.511 Cc1cc(ccc1O)NCC(C)C 34a_100011218179_100000210624 [0,1,0,0,0,0|3,0,0]=4 2688 B13R1.511 Cc1cc(ccc1O)NCC(C)C 7a_100011218179_100000210760 [0,1,0,0,0,0|3,0,0]=4 2689 B13R1.511 Cc1cc(ccc1O)NCC(C)O 34a_100011218179_100011218427 [0,1,0,0,0,0|3,0,0]=4 2690 B13R1.511 Cc1cc(ccc1O)NCC(C)O 7a_100011218179_100011218427 [0,1,0,0,0,0|3,0,0]=4 2691 B13R1.511 Cc1cc(ccc1O)NC[C@@H](C)O 34a_100011218179_100009817552 [0,1,0,0,0,0|3,0,0]=4 2692 B13R1.511 Cc1cc(ccc1O)NC[C@@H](C)O 7a_100011218179_100009817552 [0,1,0,0,0,0|3,0,0]=4 2693 B13R1.511 Cc1cc(ccc1O)SCC(C)C 62a_100000210624_100000186361 [0,1,0,0,0,0|3,0,0]=4 2694 B13R1.511 Cc1cc(ccc1O)SCC(C)O 62a_100011218427_100000186361 [0,1,0,0,0,0|3,0,0]=4 2695 B13R1.511 Cc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000186361 [0,1,0,0,0,0|3,0,0]=4 2696 B13R1.511 Cc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100010220830_200025704644 [0,1,0,0,0,0|3,0,0]=4 2697 B13R1.511 Cc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011338283_200025704644 [0,1,0,0,0,0|3,0,0]=4 2698 B13R1.511 Cc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100011830284_200025704644 [0,1,0,0,0,0|3,0,0]=4 2699 B13R1.511 Cc1ccc(cc1O)NCC(C)C 34a_100000759471_100000210624 [0,1,0,0,0,0|3,0,0]=4 2700 B13R1.511 Cc1ccc(cc1O)NCC(C)C 7a_100000759471_100000210760 [0,1,0,0,0,0|3,0,0]=4 2701 B13R1.511 Cc1ccc(cc1O)NCC(C)O 34a_100000759471_100011218427 [0,1,0,0,0,0|3,0,0]=4 2702 B13R1.511 Cc1ccc(cc1O)NCC(C)O 7a_100000759471_100011218427 [0,1,0,0,0,0|3,0,0]=4 2703 B13R1.511 Cc1ccc(cc1O)NC[C@@H](C)O 34a_100000759471_100009817552 [0,1,0,0,0,0|3,0,0]=4 2704 B13R1.511 Cc1ccc(cc1O)NC[C@@H](C)O 7a_100000759471_100009817552 [0,1,0,0,0,0|3,0,0]=4 2705 B13R1.511 Cc1ccc(cc1O)SCC(C)C 62a_100000210624_100000685420 [0,1,0,0,0,0|3,0,0]=4 2706 B13R1.511 Cc1ccc(cc1O)SCC(C)C 62a_100000685420_100000210760 [0,1,0,0,0,0|3,0,0]=4 2707 B13R1.511 Cc1ccc(cc1O)SCC(C)O 62a_100000685420_100011218427 [0,1,0,0,0,0|3,0,0]=4 2708 B13R1.511 Cc1ccc(cc1O)SCC(C)O 62a_100011218427_100000685420 [0,1,0,0,0,0|3,0,0]=4 2709 B13R1.511 Cc1ccc(cc1O)SC[C@@H](C)O 62a_100000685420_100009817552 [0,1,0,0,0,0|3,0,0]=4 2710 B13R1.511 Cc1ccc(cc1O)SC[C@@H](C)O 62a_100009817552_100000685420 [0,1,0,0,0,0|3,0,0]=4 2711 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [0,1,0,0,0,0|3,0,0]=4 2712 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [0,1,0,0,0,0|3,0,0]=4 2713 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100020667443 [0,1,0,0,0,0|3,0,0]=4 2714 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)O 62a_100020667443_100009813601 [0,1,0,0,0,0|3,0,0]=4 2715 B13R1.511 O=[N+]([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100000761209 [0,1,0,0,0,0|2,0,1]=4 2716 B13R1.511 Oc1ccc(cc1O)NCC(F)F 34a_100102946323_100011934356 [0,1,0,0,0,0|3,0,0]=4 2717 B13R1.511 Oc1ccc(cc1O)SCC(F)F 62a_100011934356_100009813601 [0,1,0,0,0,0|3,0,0]=4 2718 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Br)F 1458a_100011308364_200025704644 [0,1,0,0,0,0|3,0,0]=4 2719 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Br 1458a_100009812081_200025704644 [0,1,0,0,0,0|3,0,0]=4 2720 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)Cl 1458a_100000735579_200025704644 [0,1,0,0,0,0|3,0,0]=4 2721 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)Cl)F 1458a_100011218152_200025704644 [0,1,0,0,0,0|3,0,0]=4 2722 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Br 1458a_100010146367_200025704644 [0,1,0,0,0,0|3,0,0]=4 2723 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)Cl 1458a_100011518922_200025704644 [0,1,0,0,0,0|3,0,0]=4 2724 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)F)F 1458a_100000737970_200025704644 [0,1,0,0,0,0|3,0,0]=4 2725 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [0,1,0,0,0,0|1,0,0]=2 2726 B13R1.575 C#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000184674 [0,1,0,0,0,0|2,0,1]=4 2727 B13R1.575 C#CCSc1ccc(c(c1)CO)O 62a_100000038162_100000184703 [0,1,0,0,0,0|2,0,1]=4 2728 B13R1.575 C#CCSc1ccc(c(c1)OC)O 62a_100000038162_100000694246 [0,1,0,0,0,0|2,0,1]=4 2729 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [0,1,0,0,0,0|2,0,1]=4 2730 B13R1.575 C=CCSc1ccc(c(c1)CO)O 62a_100000184703_100000210623 [0,1,0,0,0,0|2,0,1]=4 2731 B13R1.575 C=CCSc1ccc(c(c1)CO)O 62a_100000210623_100000184703 [0,1,0,0,0,0|2,0,1]=4 2732 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [0,1,0,0,0,0|2,0,1]=4 2733 B13R1.575 CCCCc1c[nH]c(=O)c(c1)OC 271570a_100020621405_100010125397 [0,1,0,0,0,0|2,0,1]=4 2734 B13R1.575 CCCCc1cc(c(cn1)C)OC 271570a_100020621405_100010067687 [0,1,0,0,0,0|3,0,0]=4 2735 B13R1.575 CCCCc1cc(c(cn1)F)CO 271570a_100020621405_100000081974 [0,1,0,0,0,0|3,0,0]=4 2736 B13R1.575 CCCCc1cc(c(cn1)F)OC 271570a_100020621405_200010136270 [0,1,0,0,0,0|3,0,0]=4 2737 B13R1.575 CCCCc1cc(c(cn1)N)OC 271570a_100020621405_100009887741 [0,1,0,0,0,0|3,0,0]=4 2738 B13R1.575 CCCCc1ccc(c(c1)C#N)Br 271570a_100020621405_100012355174 [0,1,0,0,0,0|3,0,0]=4 2739 B13R1.575 CCCCc1ccc(c(c1)C#N)C 271570a_100020621405_100000698047 [0,1,0,0,0,0|3,0,0]=4 2740 B13R1.575 CCCCc1ccc(c(c1)C#N)Cl 271570a_100020621405_100011356831 [0,1,0,0,0,0|3,0,0]=4 2741 B13R1.575 CCCCc1ccc(c(c1)C#N)F 271570a_100020621405_100000037165 [0,1,0,0,0,0|3,0,0]=4 2742 B13R1.575 CCCCc1ccc(c(c1)C#N)N 271570a_100020621405_100000688460 [0,1,0,0,0,0|3,0,0]=4 2743 B13R1.575 CCCCc1ccc(c(c1)C#N)O 271570a_100020621405_100000687585 [0,1,0,0,0,0|2,0,0]=3 2744 B13R1.575 CCCCc1ccc(c(c1)C=O)Br 271570a_100020621405_100010185652 [0,1,0,0,0,0|2,0,1]=4 2745 B13R1.575 CCCCc1ccc(c(c1)C=O)C 271570a_100020621405_100011361606 [0,1,0,0,0,0|2,0,1]=4 2746 B13R1.575 CCCCc1ccc(c(c1)C=O)Cl 271570a_100020621405_100010254384 [0,1,0,0,0,0|2,0,1]=4 2747 B13R1.575 CCCCc1ccc(c(c1)C=O)F 271570a_100020621405_100000211465 [0,1,0,0,0,0|2,0,1]=4 2748 B13R1.575 CCCCc1ccc(c(c1)C=O)N 271570a_100020621405_100011935258 [0,1,0,0,0,0|2,0,1]=4 2749 B13R1.575 CCCCc1ccc(c(c1)C=O)O 271570a_100020621405_100000186750 [0,1,0,0,0,0|1,0,1]=3 2750 B13R1.575 CCCCc1ccc(c(c1)CC)Br 271570a_100020621405_100010244631 [0,1,0,0,0,0|3,0,0]=4 2751 B13R1.575 CCCCc1ccc(c(c1)CC)F 271570a_100020621405_100010244625 [0,1,0,0,0,0|3,0,0]=4 2752 B13R1.575 CCCCc1ccc(c(c1)CC)N 271570a_100020621405_100000686106 [0,1,0,0,0,0|3,0,0]=4 2753 B13R1.575 CCCCc1ccc(c(c1)CC)O 271570a_100020621405_100012338938 [0,1,0,0,0,0|2,0,0]=3 2754 B13R1.575 CCCCc1ccc(c(c1)CN)F 271570a_100020621405_100009815772 [0,1,0,0,0,0|3,0,0]=4 2755 B13R1.575 CCCCc1ccc(c(c1)CN)N 271570a_100020621405_100012349119 [0,1,0,0,0,0|3,0,0]=4 2756 B13R1.575 CCCCc1ccc(c(c1)CN)O 271570a_100020621405_100000730032 [0,1,0,0,0,0|2,0,0]=3 2757 B13R1.575 CCCCc1ccc(c(c1)CO)Br 271570a_100020621405_100012359683 [0,1,0,0,0,0|2,0,0]=3 2758 B13R1.575 CCCCc1ccc(c(c1)CO)C 271570a_100020621405_100000700630 [0,1,0,0,0,0|2,0,0]=3 2759 B13R1.575 CCCCc1ccc(c(c1)CO)Cl 271570a_100020621405_100010128486 [0,1,0,0,0,0|2,0,0]=3 2760 B13R1.575 CCCCc1ccc(c(c1)CO)F 271570a_100020621405_100000049604 [0,1,0,0,0,0|2,0,0]=3 2761 B13R1.575 CCCCc1ccc(c(c1)CO)N 271570a_100020621405_100012353972 [0,1,0,0,0,0|2,0,0]=3 2762 B13R1.575 CCCCc1ccc(c(c1)CO)O 271570a_100020621405_100000184703 [0,1,0,0,0,0|1,0,0]=2 2763 B13R1.575 CCCCc1ccc(c(c1)NC)C 271570a_100020621405_100020629602 [0,1,0,0,0,0|3,0,0]=4 2764 B13R1.575 CCCCc1ccc(c(c1)NC)F 271570a_100020621405_100011314990 [0,1,0,0,0,0|3,0,0]=4 2765 B13R1.575 CCCCc1ccc(c(c1)NC)N 271570a_100020621405_100000694363 [0,1,0,0,0,0|3,0,0]=4 2766 B13R1.575 CCCCc1ccc(c(c1)NN)F 271570a_100020621405_100020610843 [0,1,0,0,0,0|3,0,0]=4 2767 B13R1.575 CCCCc1ccc(c(c1)OC)Br 271570a_100020621405_100012353699 [0,1,0,0,0,0|2,0,0]=3 2768 B13R1.575 CCCCc1ccc(c(c1)OC)C 271570a_100020621405_100011830276 [0,1,0,0,0,0|2,0,0]=3 2769 B13R1.575 CCCCc1ccc(c(c1)OC)Cl 271570a_100020621405_100011356853 [0,1,0,0,0,0|2,0,0]=3 2770 B13R1.575 CCCCc1ccc(c(c1)OC)F 271570a_100020621405_100011934186 [0,1,0,0,0,0|2,0,0]=3 2771 B13R1.575 CCCCc1ccc(c(c1)OC)N 271570a_100020621405_100011279103 [0,1,0,0,0,0|2,0,0]=3 2772 B13R1.575 CCCCc1ccc(c(c1)OC)O 271570a_100020621405_100000694246 [0,1,0,0,0,0|1,0,0]=2 2773 B13R1.575 CCCCc1ccc(c(c1)SC)F 271570a_100020621405_100010341305 [0,1,0,0,0,0|2,1,0]=4 2774 B13R1.575 CCCCc1ccc(c(n1)OC)N 271570a_100020621405_100000687816 [0,1,0,0,0,0|3,0,0]=4 2775 B13R1.575 CCCCc1ccc(c(n1)OC)O 271570a_100020621405_100010893133 [0,1,0,0,0,0|2,0,0]=3 2776 B13R1.575 CCCCc1cnc(c(c1)C#N)O 271570a_100020621405_100000697733 [0,1,0,0,0,0|3,0,0]=4 2777 B13R1.575 CCCCc1cnc(c(c1)CO)C 271570a_100020621405_100010894652 [0,1,0,0,0,0|3,0,0]=4 2778 B13R1.575 CCCCc1cnc(c(c1)CO)F 271570a_100020621405_100010202234 [0,1,0,0,0,0|3,0,0]=4 2779 B13R1.575 CCCCc1cnc(c(c1)CO)N 271570a_100020621405_100011934449 [0,1,0,0,0,0|3,0,0]=4 2780 B13R1.575 CCCCc1cnc(c(c1)CO)O 271570a_100020621405_100010065268 [0,1,0,0,0,0|2,0,0]=3 2781 B13R1.575 CCCCc1cnc(c(c1)OC)C 271570a_100020621405_100010254219 [0,1,0,0,0,0|3,0,0]=4 2782 B13R1.575 CCCCc1cnc(c(c1)OC)F 271570a_100020621405_100010214931 [0,1,0,0,0,0|3,0,0]=4 2783 B13R1.575 CCCCc1cnc(c(c1)OC)N 271570a_100020621405_106354213024 [0,1,0,0,0,0|3,0,0]=4 2784 B13R1.575 CCCCc1cnc(c(n1)OC)O 271570a_100020621405_200010365344 [0,1,0,0,0,0|3,0,0]=4 2785 B13R1.575 CCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210303 [0,1,0,0,0,0|3,0,0]=4 2786 B13R1.575 CCCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000210303 [0,1,0,0,0,0|3,0,0]=4 2787 B13R1.575 CCCNc1ccc(c(c1)CO)Br 34a_100012347228_100000210303 [0,1,0,0,0,0|3,0,0]=4 2788 B13R1.575 CCCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000210303 [0,1,0,0,0,0|3,0,0]=4 2789 B13R1.575 CCCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000210303 [0,1,0,0,0,0|3,0,0]=4 2790 B13R1.575 CCCNc1ccc(c(c1)CO)F 34a_100011218011_100000210303 [0,1,0,0,0,0|3,0,0]=4 2791 B13R1.575 CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210303 [0,1,0,0,0,0|3,0,0]=4 2792 B13R1.575 CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210303 [0,1,0,0,0,0|3,0,0]=4 2793 B13R1.575 CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210303 [0,1,0,0,0,0|3,0,0]=4 2794 B13R1.575 CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210303 [0,1,0,0,0,0|3,0,0]=4 2795 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210303 [0,1,0,0,0,0|3,0,0]=4 2796 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210303 [0,1,0,0,0,0|3,0,0]=4 2797 B13R1.575 CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210303 [0,1,0,0,0,0|3,0,0]=4 2798 B13R1.575 CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210303 [0,1,0,0,0,0|3,0,0]=4 2799 B13R1.575 CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210303 [0,1,0,0,0,0|3,0,0]=4 2800 B13R1.575 CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210303 [0,1,0,0,0,0|2,0,0]=3 2801 B13R1.575 CCCOc1ccc(c(c1)CO)Br 34a_100012351483_100000210303 [0,1,0,0,0,0|3,0,0]=4 2802 B13R1.575 CCCOc1ccc(c(c1)CO)Br 7a_100012351483_100000210303 [0,1,0,0,0,0|3,0,0]=4 2803 B13R1.575 CCCOc1ccc(c(c1)CO)C 34a_100009878257_100000210303 [0,1,0,0,0,0|3,0,0]=4 2804 B13R1.575 CCCOc1ccc(c(c1)CO)C 7a_100009878257_100000210303 [0,1,0,0,0,0|3,0,0]=4 2805 B13R1.575 CCCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000210303 [0,1,0,0,0,0|3,0,0]=4 2806 B13R1.575 CCCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000210303 [0,1,0,0,0,0|3,0,0]=4 2807 B13R1.575 CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210303 [0,1,0,0,0,0|3,0,0]=4 2808 B13R1.575 CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210303 [0,1,0,0,0,0|3,0,0]=4 2809 B13R1.575 CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210303 [0,1,0,0,0,0|3,0,0]=4 2810 B13R1.575 CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210303 [0,1,0,0,0,0|3,0,0]=4 2811 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210303 [0,1,0,0,0,0|3,0,0]=4 2812 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210303 [0,1,0,0,0,0|3,0,0]=4 2813 B13R1.575 CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210303 [0,1,0,0,0,0|3,0,0]=4 2814 B13R1.575 CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210303 [0,1,0,0,0,0|3,0,0]=4 2815 B13R1.575 CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210303 [0,1,0,0,0,0|3,0,0]=4 2816 B13R1.575 CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210303 [0,1,0,0,0,0|3,0,0]=4 2817 B13R1.575 CCCSc1ccc(c(c1)C#N)O 62a_100000210303_100000687585 [0,1,0,0,0,0|3,0,0]=4 2818 B13R1.575 CCCSc1ccc(c(c1)C=O)O 62a_100000210303_100000186750 [0,1,0,0,0,0|2,0,1]=4 2819 B13R1.575 CCCSc1ccc(c(c1)CC)O 62a_100000210303_100012338938 [0,1,0,0,0,0|3,0,0]=4 2820 B13R1.575 CCCSc1ccc(c(c1)CN)O 62a_100000210303_100000730032 [0,1,0,0,0,0|3,0,0]=4 2821 B13R1.575 CCCSc1ccc(c(c1)CN)O 62a_100000730032_100000210303 [0,1,0,0,0,0|3,0,0]=4 2822 B13R1.575 CCCSc1ccc(c(c1)CO)Br 62a_100000210303_100012359683 [0,1,0,0,0,0|3,0,0]=4 2823 B13R1.575 CCCSc1ccc(c(c1)CO)Br 62a_100012359683_100000210303 [0,1,0,0,0,0|3,0,0]=4 2824 B13R1.575 CCCSc1ccc(c(c1)CO)C 62a_100000210303_100000700630 [0,1,0,0,0,0|3,0,0]=4 2825 B13R1.575 CCCSc1ccc(c(c1)CO)C 62a_100000700630_100000210303 [0,1,0,0,0,0|3,0,0]=4 2826 B13R1.575 CCCSc1ccc(c(c1)CO)Cl 62a_100000210303_100010128486 [0,1,0,0,0,0|3,0,0]=4 2827 B13R1.575 CCCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000210303 [0,1,0,0,0,0|3,0,0]=4 2828 B13R1.575 CCCSc1ccc(c(c1)CO)F 62a_100000210303_100000246282 [0,1,0,0,0,0|3,0,0]=4 2829 B13R1.575 CCCSc1ccc(c(c1)CO)F 62a_100000246282_100000210303 [0,1,0,0,0,0|3,0,0]=4 2830 B13R1.575 CCCSc1ccc(c(c1)CO)N 62a_100000210303_100012353972 [0,1,0,0,0,0|3,0,0]=4 2831 B13R1.575 CCCSc1ccc(c(c1)CO)N 62a_100012353972_100000210303 [0,1,0,0,0,0|3,0,0]=4 2832 B13R1.575 CCCSc1ccc(c(c1)CO)O 62a_100000184703_100000210303 [0,1,0,0,0,0|2,0,0]=3 2833 B13R1.575 CCCSc1ccc(c(c1)CO)O 62a_100000210303_100000184703 [0,1,0,0,0,0|2,0,0]=3 2834 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100000210303_100012353699 [0,1,0,0,0,0|3,0,0]=4 2835 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210303 [0,1,0,0,0,0|3,0,0]=4 2836 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100000210303_100011830276 [0,1,0,0,0,0|3,0,0]=4 2837 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210303 [0,1,0,0,0,0|3,0,0]=4 2838 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100000210303_100011356853 [0,1,0,0,0,0|3,0,0]=4 2839 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210303 [0,1,0,0,0,0|3,0,0]=4 2840 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100000210303_100011934186 [0,1,0,0,0,0|3,0,0]=4 2841 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210303 [0,1,0,0,0,0|3,0,0]=4 2842 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100000210303_100015196925 [0,1,0,0,0,0|3,0,0]=4 2843 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210303 [0,1,0,0,0,0|3,0,0]=4 2844 B13R1.575 CCCSc1ccc(c(c1)OC)O 62a_100000210303_100000694246 [0,1,0,0,0,0|2,0,0]=3 2845 B13R1.575 CCCSc1ccc(c(n1)OC)O 62a_100000210303_100010893133 [0,1,0,0,0,0|3,0,0]=4 2846 B13R1.575 CCCSc1cnc(c(c1)CO)O 62a_100000210303_100010065268 [0,1,0,0,0,0|3,0,0]=4 2847 B13R1.575 CCCSc1cnc(c(c1)CO)O 62a_100010065268_100000210303 [0,1,0,0,0,0|3,0,0]=4 2848 B13R1.575 CCNCc1ccc(c(c1)CO)Br 207a_100015525214_100015639582 [0,1,0,0,0,0|3,0,0]=4 2849 B13R1.575 CCNCc1ccc(c(c1)CO)Br 270004a_100015525214_100015639582 [0,1,0,0,0,0|3,0,0]=4 2850 B13R1.575 CCNCc1ccc(c(c1)OC)Br 207a_100015525214_100010244714 [0,1,0,0,0,0|3,0,0]=4 2851 B13R1.575 CCNCc1ccc(c(c1)OC)Br 2230a_100015525214_100010110085 [0,1,0,0,0,0|3,0,0]=4 2852 B13R1.575 CCNCc1ccc(c(c1)OC)Br 270004a_100015525214_100010244714 [0,1,0,0,0,0|3,0,0]=4 2853 B13R1.575 CCNCc1ccc(c(c1)OC)C 207a_100015525214_100000719150 [0,1,0,0,0,0|3,0,0]=4 2854 B13R1.575 CCNCc1ccc(c(c1)OC)C 270004a_100015525214_100000719150 [0,1,0,0,0,0|3,0,0]=4 2855 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 207a_100015525214_100011998524 [0,1,0,0,0,0|3,0,0]=4 2856 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210202 [0,1,0,0,0,0|3,0,0]=4 2857 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015525214_200010214485 [0,1,0,0,0,0|3,0,0]=4 2858 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 270004a_100015525214_100011998524 [0,1,0,0,0,0|3,0,0]=4 2859 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210202 [0,1,0,0,0,0|3,0,0]=4 2860 B13R1.575 CCNCc1ccc(c(c1)OC)F 207a_100015525214_100000692873 [0,1,0,0,0,0|3,0,0]=4 2861 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100015525214_100012349856 [0,1,0,0,0,0|3,0,0]=4 2862 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210202 [0,1,0,0,0,0|3,0,0]=4 2863 B13R1.575 CCNCc1ccc(c(c1)OC)F 270004a_100015525214_100000692873 [0,1,0,0,0,0|3,0,0]=4 2864 B13R1.575 CCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210202 [0,1,0,0,0,0|3,0,0]=4 2865 B13R1.575 CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210202 [0,1,0,0,0,0|2,0,0]=3 2866 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210202 [0,1,0,0,0,0|3,0,0]=4 2867 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100121572206_100010110085 [0,1,0,0,0,0|3,0,0]=4 2868 B13R1.575 CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210202 [0,1,0,0,0,0|3,0,0]=4 2869 B13R1.575 CCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210202 [0,1,0,0,0,0|3,0,0]=4 2870 B13R1.575 CCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210202 [0,1,0,0,0,0|3,0,0]=4 2871 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210202 [0,1,0,0,0,0|3,0,0]=4 2872 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100121572206_200010214485 [0,1,0,0,0,0|3,0,0]=4 2873 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210202 [0,1,0,0,0,0|3,0,0]=4 2874 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100121572206_100012349856 [0,1,0,0,0,0|3,0,0]=4 2875 B13R1.575 CCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210202 [0,1,0,0,0,0|3,0,0]=4 2876 B13R1.575 CCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210202 [0,1,0,0,0,0|3,0,0]=4 2877 B13R1.575 CCSCc1ccc(c(c1)C=O)O 62a_100000210202_100000008128 [0,1,0,0,0,0|2,0,1]=4 2878 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100000210202_100010110085 [0,1,0,0,0,0|3,0,0]=4 2879 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210202 [0,1,0,0,0,0|3,0,0]=4 2880 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_100000210202_200010214485 [0,1,0,0,0,0|3,0,0]=4 2881 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210202 [0,1,0,0,0,0|3,0,0]=4 2882 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100000210202_100012349856 [0,1,0,0,0,0|3,0,0]=4 2883 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210202 [0,1,0,0,0,0|3,0,0]=4 2884 B13R1.575 CCc1cc(ccc1O)SCOC 62a_100000766300_100012338938 [0,1,0,0,0,0|3,0,0]=4 2885 B13R1.575 CCc1cc(ccc1O)SCSC 62a_100011218213_100012338938 [0,1,0,0,0,0|3,0,0]=4 2886 B13R1.575 CNCCc1ccc(c(c1)OC)O 2230a_106832991635_100010741665 [0,1,0,0,0,0|0,0,0]=1 2887 B13R1.575 CNCCc1ccc(c(c1)OC)O 34a_100000756042_200000210301 [0,1,0,0,0,0|0,0,0]=1 2888 B13R1.575 CNCCc1ccc(c(c1)OC)O 7a_106832991635_100010741665 [0,1,0,0,0,0|0,0,0]=1 2889 B13R1.575 COCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000766300 [0,1,0,0,0,0|3,0,0]=4 2890 B13R1.575 COCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000766300 [0,1,0,0,0,0|3,0,0]=4 2891 B13R1.575 COCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000766300 [0,1,0,0,0,0|3,0,0]=4 2892 B13R1.575 COCNc1ccc(c(c1)OC)C 2230a_100011279678_100000766300 [0,1,0,0,0,0|3,0,0]=4 2893 B13R1.575 COCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000766300 [0,1,0,0,0,0|3,0,0]=4 2894 B13R1.575 COCNc1ccc(c(c1)OC)F 2230a_100000701188_100000766300 [0,1,0,0,0,0|3,0,0]=4 2895 B13R1.575 COCSc1ccc(c(c1)C#N)O 62a_100000766300_100000687585 [0,1,0,0,0,0|3,0,0]=4 2896 B13R1.575 COCSc1ccc(c(c1)C=O)O 62a_100000766300_100000186750 [0,1,0,0,0,0|2,0,1]=4 2897 B13R1.575 COCSc1ccc(c(c1)CN)O 62a_100000730032_100000766300 [0,1,0,0,0,0|3,0,0]=4 2898 B13R1.575 COCSc1ccc(c(c1)CN)O 62a_100000766300_100000730032 [0,1,0,0,0,0|3,0,0]=4 2899 B13R1.575 COCSc1ccc(c(c1)CO)Br 62a_100000766300_100012359683 [0,1,0,0,0,0|3,0,0]=4 2900 B13R1.575 COCSc1ccc(c(c1)CO)Br 62a_100012359683_100000766300 [0,1,0,0,0,0|3,0,0]=4 2901 B13R1.575 COCSc1ccc(c(c1)CO)C 62a_100000700630_100000766300 [0,1,0,0,0,0|3,0,0]=4 2902 B13R1.575 COCSc1ccc(c(c1)CO)C 62a_100000766300_100000700630 [0,1,0,0,0,0|3,0,0]=4 2903 B13R1.575 COCSc1ccc(c(c1)CO)Cl 62a_100000766300_100010128486 [0,1,0,0,0,0|3,0,0]=4 2904 B13R1.575 COCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000766300 [0,1,0,0,0,0|3,0,0]=4 2905 B13R1.575 COCSc1ccc(c(c1)CO)F 62a_100000246282_100000766300 [0,1,0,0,0,0|3,0,0]=4 2906 B13R1.575 COCSc1ccc(c(c1)CO)F 62a_100000766300_100000246282 [0,1,0,0,0,0|3,0,0]=4 2907 B13R1.575 COCSc1ccc(c(c1)CO)N 62a_100000766300_100012353972 [0,1,0,0,0,0|3,0,0]=4 2908 B13R1.575 COCSc1ccc(c(c1)CO)N 62a_100012353972_100000766300 [0,1,0,0,0,0|3,0,0]=4 2909 B13R1.575 COCSc1ccc(c(c1)CO)O 62a_100000184703_100000766300 [0,1,0,0,0,0|2,0,0]=3 2910 B13R1.575 COCSc1ccc(c(c1)CO)O 62a_100000766300_100000184703 [0,1,0,0,0,0|2,0,0]=3 2911 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100000766300_100012353699 [0,1,0,0,0,0|3,0,0]=4 2912 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100012353699_100000766300 [0,1,0,0,0,0|3,0,0]=4 2913 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100000766300_100011830276 [0,1,0,0,0,0|3,0,0]=4 2914 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100011830276_100000766300 [0,1,0,0,0,0|3,0,0]=4 2915 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100000766300_100011356853 [0,1,0,0,0,0|3,0,0]=4 2916 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000766300 [0,1,0,0,0,0|3,0,0]=4 2917 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100000766300_100011934186 [0,1,0,0,0,0|3,0,0]=4 2918 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100011934186_100000766300 [0,1,0,0,0,0|3,0,0]=4 2919 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100000766300_100015196925 [0,1,0,0,0,0|3,0,0]=4 2920 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100011279103_100000766300 [0,1,0,0,0,0|3,0,0]=4 2921 B13R1.575 COCSc1ccc(c(c1)OC)O 62a_100000766300_100000694246 [0,1,0,0,0,0|2,0,0]=3 2922 B13R1.575 COCSc1ccc(c(n1)OC)O 62a_100000766300_100010893133 [0,1,0,0,0,0|3,0,0]=4 2923 B13R1.575 COCSc1cnc(c(c1)CO)O 62a_100000766300_100010065268 [0,1,0,0,0,0|3,0,0]=4 2924 B13R1.575 COCSc1cnc(c(c1)CO)O 62a_100010065268_100000766300 [0,1,0,0,0,0|3,0,0]=4 2925 B13R1.575 COc1cc(ccc1Br)NCSC 2230a_100000765947_100011218213 [0,1,0,0,0,0|3,0,0]=4 2926 B13R1.575 COc1cc(ccc1Br)NCSC 34a_100000765947_100011218213 [0,1,0,0,0,0|3,0,0]=4 2927 B13R1.575 COc1cc(ccc1Br)OCSC 34a_100011827694_100011218213 [0,1,0,0,0,0|3,0,0]=4 2928 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100011218213_100012353699 [0,1,0,0,0,0|3,0,0]=4 2929 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100012353699_100011218213 [0,1,0,0,0,0|3,0,0]=4 2930 B13R1.575 COc1cc(ccc1C)NCSC 2230a_100011279678_100011218213 [0,1,0,0,0,0|3,0,0]=4 2931 B13R1.575 COc1cc(ccc1C)NCSC 34a_100011279678_100011218213 [0,1,0,0,0,0|3,0,0]=4 2932 B13R1.575 COc1cc(ccc1C)OCSC 34a_100009865632_100011218213 [0,1,0,0,0,0|3,0,0]=4 2933 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011218213_100011830276 [0,1,0,0,0,0|3,0,0]=4 2934 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011830276_100011218213 [0,1,0,0,0,0|3,0,0]=4 2935 B13R1.575 COc1cc(ccc1Cl)NCSC 2230a_100000742311_100011218213 [0,1,0,0,0,0|3,0,0]=4 2936 B13R1.575 COc1cc(ccc1Cl)NCSC 34a_100000742311_100011218213 [0,1,0,0,0,0|3,0,0]=4 2937 B13R1.575 COc1cc(ccc1Cl)OCSC 34a_100012186310_100011218213 [0,1,0,0,0,0|3,0,0]=4 2938 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011218213_100011356853 [0,1,0,0,0,0|3,0,0]=4 2939 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011356853_100011218213 [0,1,0,0,0,0|3,0,0]=4 2940 B13R1.575 COc1cc(ccc1F)NCSC 2230a_100000701188_100011218213 [0,1,0,0,0,0|3,0,0]=4 2941 B13R1.575 COc1cc(ccc1F)NCSC 34a_100000701188_100011218213 [0,1,0,0,0,0|3,0,0]=4 2942 B13R1.575 COc1cc(ccc1F)OCSC 34a_100012001760_100011218213 [0,1,0,0,0,0|3,0,0]=4 2943 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011218213_100011934186 [0,1,0,0,0,0|3,0,0]=4 2944 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011934186_100011218213 [0,1,0,0,0,0|3,0,0]=4 2945 B13R1.575 COc1cc(ccc1I)NCSC 34a_100000746945_100011218213 [0,1,0,0,0,0|3,0,0]=4 2946 B13R1.575 COc1cc(ccc1N)OCSC 34a_100015326901_100011218213 [0,1,0,0,0,0|3,0,0]=4 2947 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011218213_100015196925 [0,1,0,0,0,0|3,0,0]=4 2948 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011279103_100011218213 [0,1,0,0,0,0|3,0,0]=4 2949 B13R1.575 COc1cc(ccc1O)CCN[13CH3] 34a_100000756042_200025704644 [0,1,0,0,0,0|0,0,0]=1 2950 B13R1.575 COc1cc(ccc1O)CCSC 62a_200000210301_100010741665 [0,1,0,0,0,0|1,0,0]=2 2951 B13R1.575 COc1cc(ccc1O)CCS[13CH3] 62a_200025704644_100010741665 [0,1,0,0,0,0|1,0,0]=2 2952 B13R1.575 COc1cc(ccc1O)CNCF 34a_100000185554_100015361967 [0,1,0,0,0,0|3,0,0]=4 2953 B13R1.575 COc1cc(ccc1O)NCC=O 34a_100000726020_200009817547 [0,1,0,0,0,0|3,0,0]=4 2954 B13R1.575 COc1cc(ccc1O)NCCF 34a_100000726020_100011217306 [0,1,0,0,0,0|3,0,0]=4 2955 B13R1.575 COc1cc(ccc1O)NCCO 34a_100000726020_100000211926 [0,1,0,0,0,0|3,0,0]=4 2956 B13R1.575 COc1cc(ccc1O)NCSC 34a_100000726020_100011218213 [0,1,0,0,0,0|2,0,0]=3 2957 B13R1.575 COc1cc(ccc1O)SCC#N 62a_100011215382_100000694246 [0,1,0,0,0,0|3,0,0]=4 2958 B13R1.575 COc1cc(ccc1O)SCC=O 62a_200015260668_100000694246 [0,1,0,0,0,0|3,0,0]=4 2959 B13R1.575 COc1cc(ccc1O)SCCF 62a_100011217306_100000694246 [0,1,0,0,0,0|3,0,0]=4 2960 B13R1.575 COc1cc(ccc1O)SCCO 62a_100000211926_100000694246 [0,1,0,0,0,0|3,0,0]=4 2961 B13R1.575 COc1cc(ccc1O)SCSC 62a_100011218213_100000694246 [0,1,0,0,0,0|2,0,0]=3 2962 B13R1.575 COc1nc(ccc1O)SCSC 62a_100011218213_100010893133 [0,1,0,0,0,0|3,0,0]=4 2963 B13R1.575 CSCNc1ccc(c(c1)C#N)O 34a_100011249283_100011218213 [0,1,0,0,0,0|3,0,0]=4 2964 B13R1.575 CSCNc1ccc(c(c1)CO)Br 2230a_100012347228_100011218213 [0,1,0,0,0,0|3,0,0]=4 2965 B13R1.575 CSCNc1ccc(c(c1)CO)Br 34a_100012347228_100011218213 [0,1,0,0,0,0|3,0,0]=4 2966 B13R1.575 CSCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100011218213 [0,1,0,0,0,0|3,0,0]=4 2967 B13R1.575 CSCNc1ccc(c(c1)CO)Cl 34a_100011273577_100011218213 [0,1,0,0,0,0|3,0,0]=4 2968 B13R1.575 CSCNc1ccc(c(c1)CO)F 34a_100011218011_100011218213 [0,1,0,0,0,0|3,0,0]=4 2969 B13R1.575 CSCOc1ccc(c(c1)CO)Br 34a_100012351483_100011218213 [0,1,0,0,0,0|3,0,0]=4 2970 B13R1.575 CSCOc1ccc(c(c1)CO)C 34a_100009878257_100011218213 [0,1,0,0,0,0|3,0,0]=4 2971 B13R1.575 CSCOc1ccc(c(c1)CO)Cl 34a_100000091669_100011218213 [0,1,0,0,0,0|3,0,0]=4 2972 B13R1.575 CSCSc1ccc(c(c1)C#N)O 62a_100011218213_100000687585 [0,1,0,0,0,0|3,0,0]=4 2973 B13R1.575 CSCSc1ccc(c(c1)C=O)O 62a_100011218213_100000186750 [0,1,0,0,0,0|2,0,1]=4 2974 B13R1.575 CSCSc1ccc(c(c1)CN)O 62a_100000730032_100011218213 [0,1,0,0,0,0|3,0,0]=4 2975 B13R1.575 CSCSc1ccc(c(c1)CN)O 62a_100011218213_100000730032 [0,1,0,0,0,0|3,0,0]=4 2976 B13R1.575 CSCSc1ccc(c(c1)CO)Br 62a_100011218213_100012359683 [0,1,0,0,0,0|3,0,0]=4 2977 B13R1.575 CSCSc1ccc(c(c1)CO)Br 62a_100012359683_100011218213 [0,1,0,0,0,0|3,0,0]=4 2978 B13R1.575 CSCSc1ccc(c(c1)CO)C 62a_100000700630_100011218213 [0,1,0,0,0,0|3,0,0]=4 2979 B13R1.575 CSCSc1ccc(c(c1)CO)C 62a_100011218213_100000700630 [0,1,0,0,0,0|3,0,0]=4 2980 B13R1.575 CSCSc1ccc(c(c1)CO)Cl 62a_100010128486_100011218213 [0,1,0,0,0,0|3,0,0]=4 2981 B13R1.575 CSCSc1ccc(c(c1)CO)Cl 62a_100011218213_100010128486 [0,1,0,0,0,0|3,0,0]=4 2982 B13R1.575 CSCSc1ccc(c(c1)CO)F 62a_100000246282_100011218213 [0,1,0,0,0,0|3,0,0]=4 2983 B13R1.575 CSCSc1ccc(c(c1)CO)F 62a_100011218213_100000246282 [0,1,0,0,0,0|3,0,0]=4 2984 B13R1.575 CSCSc1ccc(c(c1)CO)N 62a_100011218213_100012353972 [0,1,0,0,0,0|3,0,0]=4 2985 B13R1.575 CSCSc1ccc(c(c1)CO)N 62a_100012353972_100011218213 [0,1,0,0,0,0|3,0,0]=4 2986 B13R1.575 CSCSc1ccc(c(c1)CO)O 62a_100000184703_100011218213 [0,1,0,0,0,0|2,0,0]=3 2987 B13R1.575 CSCSc1ccc(c(c1)CO)O 62a_100011218213_100000184703 [0,1,0,0,0,0|2,0,0]=3 2988 B13R1.575 CSCSc1cnc(c(c1)CO)O 62a_100010065268_100011218213 [0,1,0,0,0,0|3,0,0]=4 2989 B13R1.575 CSCSc1cnc(c(c1)CO)O 62a_100011218213_100010065268 [0,1,0,0,0,0|3,0,0]=4 2990 B13R1.575 N#CCSc1ccc(c(c1)CO)O 62a_100000184703_100011215382 [0,1,0,0,0,0|3,0,0]=4 2991 B13R1.575 N#CCSc1ccc(c(c1)CO)O 62a_100011215382_100000184703 [0,1,0,0,0,0|3,0,0]=4 2992 B13R1.575 O=CCSc1ccc(c(c1)CO)O 62a_100000184703_200015260668 [0,1,0,0,0,0|3,0,0]=4 2993 B13R1.575 O=CCSc1ccc(c(c1)CO)O 62a_200015260668_100000184703 [0,1,0,0,0,0|3,0,0]=4 2994 B13R1.575 OCCSc1ccc(c(c1)CO)O 62a_100000184703_100000211926 [0,1,0,0,0,0|3,0,0]=4 2995 B13R1.575 OCCSc1ccc(c(c1)CO)O 62a_100000211926_100000184703 [0,1,0,0,0,0|3,0,0]=4 2996 B13R1.575 OCc1cc(ccc1O)SCCF 62a_100000184703_100011217306 [0,1,0,0,0,0|3,0,0]=4 2997 B13R1.575 OCc1cc(ccc1O)SCCF 62a_100011217306_100000184703 [0,1,0,0,0,0|3,0,0]=4 2998 B13R1.577 C#CCNc1ccc(c(c1)O)OC 34a_100000211920_100000184674 [0,1,0,0,0,0|2,0,1]=4 2999 B13R1.577 C#CCSc1ccc(c(c1)O)CO 62a_100000038162_100000071718 [0,1,0,0,0,0|2,0,1]=4 3000 B13R1.577 C#CCSc1ccc(c(c1)O)OC 62a_100000038162_100009816560 [0,1,0,0,0,0|2,0,1]=4 3001 B13R1.577 C=CCNc1ccc(c(c1)O)OC 34a_100000211920_100015514636 [0,1,0,0,0,0|2,0,1]=4 3002 B13R1.577 C=CCSc1ccc(c(c1)O)CO 62a_100000071718_100000210623 [0,1,0,0,0,0|2,0,1]=4 3003 B13R1.577 C=CCSc1ccc(c(c1)O)CO 62a_100000210623_100000071718 [0,1,0,0,0,0|2,0,1]=4 3004 B13R1.577 C=CCSc1ccc(c(c1)O)OC 62a_100000210623_100009816560 [0,1,0,0,0,0|2,0,1]=4 3005 B13R1.577 CCCCc1cc(c(cn1)CO)C 271570a_100020621405_100010277336 [0,1,0,0,0,0|3,0,0]=4 3006 B13R1.577 CCCCc1cc(c(cn1)CO)N 271570a_100020621405_100009830438 [0,1,0,0,0,0|3,0,0]=4 3007 B13R1.577 CCCCc1cc(c(cn1)OC)N 271570a_100020621405_100010896307 [0,1,0,0,0,0|3,0,0]=4 3008 B13R1.577 CCCCc1cc(c(cn1)OC)O 271570a_100020621405_100010264082 [0,1,0,0,0,0|2,0,0]=3 3009 B13R1.577 CCCCc1ccc(c(c1)Br)C#N 271570a_100020621405_100012349582 [0,1,0,0,0,0|3,0,0]=4 3010 B13R1.577 CCCCc1ccc(c(c1)Br)C=O 271570a_100020621405_100010185650 [0,1,0,0,0,0|2,0,1]=4 3011 B13R1.577 CCCCc1ccc(c(c1)Br)CO 271570a_100020621405_100010240206 [0,1,0,0,0,0|2,0,0]=3 3012 B13R1.577 CCCCc1ccc(c(c1)Br)OC 271570a_100020621405_100011249507 [0,1,0,0,0,0|2,0,0]=3 3013 B13R1.577 CCCCc1ccc(c(c1)C)C#N 271570a_100020621405_100000687762 [0,1,0,0,0,0|3,0,0]=4 3014 B13R1.577 CCCCc1ccc(c(c1)C)C=O 271570a_100020621405_100000687586 [0,1,0,0,0,0|2,0,1]=4 3015 B13R1.577 CCCCc1ccc(c(c1)C)CF 271570a_100020621405_200010711859 [0,1,0,0,0,0|3,0,0]=4 3016 B13R1.577 CCCCc1ccc(c(c1)C)CN 271570a_100020621405_100000753881 [0,1,0,0,0,0|3,0,0]=4 3017 B13R1.577 CCCCc1ccc(c(c1)C)CO 271570a_100020621405_100000748258 [0,1,0,0,0,0|2,0,0]=3 3018 B13R1.577 CCCCc1ccc(c(c1)C)NC 2230a_200011219056_200000210301 [0,1,0,0,0,0|3,0,0]=4 3019 B13R1.577 CCCCc1ccc(c(c1)C)NC 271570a_100020621405_100000221803 [0,1,0,0,0,0|3,0,0]=4 3020 B13R1.577 CCCCc1ccc(c(c1)C)NC 34a_200011219056_200000210301 [0,1,0,0,0,0|3,0,0]=4 3021 B13R1.577 CCCCc1ccc(c(c1)C)NC 7a_200011219056_200000210301 [0,1,0,0,0,0|3,0,0]=4 3022 B13R1.577 CCCCc1ccc(c(c1)C)NN 271570a_100020621405_100000751375 [0,1,0,0,0,0|3,0,0]=4 3023 B13R1.577 CCCCc1ccc(c(c1)C)N[13CH3] 2230a_200011219056_200025704644 [0,1,0,0,0,0|3,0,0]=4 3024 B13R1.577 CCCCc1ccc(c(c1)C)N[13CH3] 34a_200011219056_200025704644 [0,1,0,0,0,0|3,0,0]=4 3025 B13R1.577 CCCCc1ccc(c(c1)C)N[13CH3] 7a_200011219056_200025704644 [0,1,0,0,0,0|3,0,0]=4 3026 B13R1.577 CCCCc1ccc(c(c1)C)OC 271570a_100020621405_100011219705 [0,1,0,0,0,0|2,0,0]=3 3027 B13R1.577 CCCCc1ccc(c(c1)Cl)C#N 271570a_100020621405_100012349662 [0,1,0,0,0,0|3,0,0]=4 3028 B13R1.577 CCCCc1ccc(c(c1)Cl)C=O 271570a_100020621405_100000727542 [0,1,0,0,0,0|2,0,1]=4 3029 B13R1.577 CCCCc1ccc(c(c1)Cl)OC 271570a_100020621405_100012355395 [0,1,0,0,0,0|2,0,0]=3 3030 B13R1.577 CCCCc1ccc(c(c1)Cl)SC 271570a_100020621405_206447510565 [0,1,0,0,0,0|2,1,0]=4 3031 B13R1.577 CCCCc1ccc(c(c1)F)C#N 271570a_100020621405_100000037869 [0,1,0,0,0,0|3,0,0]=4 3032 B13R1.577 CCCCc1ccc(c(c1)F)C=O 271570a_100020621405_100000211676 [0,1,0,0,0,0|2,0,1]=4 3033 B13R1.577 CCCCc1ccc(c(c1)F)CC 271570a_100020621405_200010071577 [0,1,0,0,0,0|3,0,0]=4 3034 B13R1.577 CCCCc1ccc(c(c1)F)CN 271570a_100020621405_100000754580 [0,1,0,0,0,0|3,0,0]=4 3035 B13R1.577 CCCCc1ccc(c(c1)F)CO 271570a_100020621405_100011191541 [0,1,0,0,0,0|2,0,0]=3 3036 B13R1.577 CCCCc1ccc(c(c1)F)NC 271570a_100020621405_100000743884 [0,1,0,0,0,0|3,0,0]=4 3037 B13R1.577 CCCCc1ccc(c(c1)F)NN 271570a_100020621405_100000751572 [0,1,0,0,0,0|3,0,0]=4 3038 B13R1.577 CCCCc1ccc(c(c1)F)OC 271570a_100020621405_100000185480 [0,1,0,0,0,0|2,0,0]=3 3039 B13R1.577 CCCCc1ccc(c(c1)F)SC 271570a_100020621405_100010161220 [0,1,0,0,0,0|2,1,0]=4 3040 B13R1.577 CCCCc1ccc(c(c1)N)C#N 271570a_100020621405_100000699244 [0,1,0,0,0,0|3,0,0]=4 3041 B13R1.577 CCCCc1ccc(c(c1)N)C=O 271570a_100020621405_100009814810 [0,1,0,0,0,0|2,0,1]=4 3042 B13R1.577 CCCCc1ccc(c(c1)N)CC 271570a_100020621405_100012354963 [0,1,0,0,0,0|3,0,0]=4 3043 B13R1.577 CCCCc1ccc(c(c1)N)CO 271570a_100020621405_100000718831 [0,1,0,0,0,0|2,0,0]=3 3044 B13R1.577 CCCCc1ccc(c(c1)N)NC 271570a_100020621405_100000741790 [0,1,0,0,0,0|3,0,0]=4 3045 B13R1.577 CCCCc1ccc(c(c1)N)OC 271570a_100020621405_100000743470 [0,1,0,0,0,0|2,0,0]=3 3046 B13R1.577 CCCCc1ccc(c(c1)O)C#N 271570a_100020621405_100011934713 [0,1,0,0,0,0|2,0,0]=3 3047 B13R1.577 CCCCc1ccc(c(c1)O)C=O 271570a_100020621405_100011277552 [0,1,0,0,0,0|1,0,1]=3 3048 B13R1.577 CCCCc1ccc(c(c1)O)CO 271570a_100020621405_100000071718 [0,1,0,0,0,0|1,0,0]=2 3049 B13R1.577 CCCCc1ccc(c(c1)O)OC 271570a_100020621405_100009816560 [0,1,0,0,0,0|1,0,0]=2 3050 B13R1.577 CCCCc1ccc(c(n1)Br)OC 271570a_100020621405_100010214827 [0,1,0,0,0,0|3,0,0]=4 3051 B13R1.577 CCCCc1ccc(c(n1)C)OC 271570a_100020621405_100010244750 [0,1,0,0,0,0|3,0,0]=4 3052 B13R1.577 CCCCc1ccc(c(n1)Cl)OC 271570a_100020621405_100010233546 [0,1,0,0,0,0|3,0,0]=4 3053 B13R1.577 CCCCc1ccc(c(n1)F)CO 271570a_100020621405_100009870654 [0,1,0,0,0,0|3,0,0]=4 3054 B13R1.577 CCCCc1ccc(c(n1)F)OC 271570a_100020621405_100010138636 [0,1,0,0,0,0|3,0,0]=4 3055 B13R1.577 CCCCc1ccc(c(n1)N)OC 271570a_100020621405_100010192976 [0,1,0,0,0,0|3,0,0]=4 3056 B13R1.577 CCCCc1cnc(c(c1)Br)OC 271570a_100020621405_200010988584 [0,1,0,0,0,0|3,0,0]=4 3057 B13R1.577 CCCCc1cnc(c(c1)C)CO 271570a_100020621405_100010116297 [0,1,0,0,0,0|3,0,0]=4 3058 B13R1.577 CCCCc1cnc(c(c1)C)OC 271570a_100020621405_100011290809 [0,1,0,0,0,0|3,0,0]=4 3059 B13R1.577 CCCCc1cnc(c(c1)F)CO 271570a_100020621405_100010065252 [0,1,0,0,0,0|3,0,0]=4 3060 B13R1.577 CCCCc1cnc(c(c1)F)OC 271570a_100020621405_100011880707 [0,1,0,0,0,0|3,0,0]=4 3061 B13R1.577 CCCCc1cnc(c(c1)N)OC 271570a_100020621405_100000748608 [0,1,0,0,0,0|3,0,0]=4 3062 B13R1.577 CCCCc1cnc(c(c1)O)C#N 271570a_100020621405_200013853302 [0,1,0,0,0,0|3,0,0]=4 3063 B13R1.577 CCCCc1cnc(c(c1)O)OC 271570a_100020621405_100010135713 [0,1,0,0,0,0|2,0,0]=3 3064 B13R1.577 CCCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210303 [0,1,0,0,0,0|3,0,0]=4 3065 B13R1.577 CCCNc1ccc(c(c1)C)CO 34a_100000102464_100000210303 [0,1,0,0,0,0|3,0,0]=4 3066 B13R1.577 CCCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210303 [0,1,0,0,0,0|3,0,0]=4 3067 B13R1.577 CCCNc1ccc(c(c1)C)OC 34a_100000743268_100000210303 [0,1,0,0,0,0|3,0,0]=4 3068 B13R1.577 CCCNc1ccc(c(c1)C)OC 7a_100000743268_100000210303 [0,1,0,0,0,0|3,0,0]=4 3069 B13R1.577 CCCNc1ccc(c(c1)Cl)CO 34a_100000689119_100000210303 [0,1,0,0,0,0|3,0,0]=4 3070 B13R1.577 CCCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210303 [0,1,0,0,0,0|3,0,0]=4 3071 B13R1.577 CCCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210303 [0,1,0,0,0,0|3,0,0]=4 3072 B13R1.577 CCCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210303 [0,1,0,0,0,0|3,0,0]=4 3073 B13R1.577 CCCNc1ccc(c(c1)F)OC 34a_100000740183_100000210303 [0,1,0,0,0,0|3,0,0]=4 3074 B13R1.577 CCCNc1ccc(c(c1)I)OC 34a_100011356947_100000210303 [0,1,0,0,0,0|3,0,0]=4 3075 B13R1.577 CCCNc1ccc(c(c1)O)C#N 34a_100000094571_100000210303 [0,1,0,0,0,0|3,0,0]=4 3076 B13R1.577 CCCNc1ccc(c(c1)O)C#N 7a_100000094571_100000210303 [0,1,0,0,0,0|3,0,0]=4 3077 B13R1.577 CCCNc1ccc(c(c1)O)OC 34a_100000211920_100000210303 [0,1,0,0,0,0|2,0,0]=3 3078 B13R1.577 CCCOc1ccc(c(c1)Br)CO 34a_100010146404_100000210303 [0,1,0,0,0,0|3,0,0]=4 3079 B13R1.577 CCCOc1ccc(c(c1)Br)CO 7a_100010146404_100000210303 [0,1,0,0,0,0|3,0,0]=4 3080 B13R1.577 CCCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210303 [0,1,0,0,0,0|3,0,0]=4 3081 B13R1.577 CCCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210303 [0,1,0,0,0,0|3,0,0]=4 3082 B13R1.577 CCCOc1ccc(c(c1)C)OC 34a_100000759738_100000210303 [0,1,0,0,0,0|3,0,0]=4 3083 B13R1.577 CCCOc1ccc(c(c1)C)OC 7a_100000759738_100000210303 [0,1,0,0,0,0|3,0,0]=4 3084 B13R1.577 CCCOc1ccc(c(c1)Cl)CO 34a_200000075811_100000210303 [0,1,0,0,0,0|3,0,0]=4 3085 B13R1.577 CCCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000210303 [0,1,0,0,0,0|3,0,0]=4 3086 B13R1.577 CCCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210303 [0,1,0,0,0,0|3,0,0]=4 3087 B13R1.577 CCCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210303 [0,1,0,0,0,0|3,0,0]=4 3088 B13R1.577 CCCOc1ccc(c(c1)F)CO 34a_100000084598_100000210303 [0,1,0,0,0,0|3,0,0]=4 3089 B13R1.577 CCCOc1ccc(c(c1)F)CO 7a_100000084598_100000210303 [0,1,0,0,0,0|3,0,0]=4 3090 B13R1.577 CCCOc1ccc(c(c1)F)OC 34a_100000746305_100000210303 [0,1,0,0,0,0|3,0,0]=4 3091 B13R1.577 CCCOc1ccc(c(c1)F)OC 7a_100000746305_100000210303 [0,1,0,0,0,0|3,0,0]=4 3092 B13R1.577 CCCOc1ccc(c(c1)I)OC 34a_100010084122_100000210303 [0,1,0,0,0,0|3,0,0]=4 3093 B13R1.577 CCCOc1ccc(c(c1)I)OC 7a_100010084122_100000210303 [0,1,0,0,0,0|3,0,0]=4 3094 B13R1.577 CCCSc1cc(c(cn1)OC)O 62a_100000210303_100010264082 [0,1,0,0,0,0|3,0,0]=4 3095 B13R1.577 CCCSc1ccc(c(c1)Br)CO 62a_100000210303_100010240206 [0,1,0,0,0,0|3,0,0]=4 3096 B13R1.577 CCCSc1ccc(c(c1)Br)CO 62a_100010240206_100000210303 [0,1,0,0,0,0|3,0,0]=4 3097 B13R1.577 CCCSc1ccc(c(c1)Br)OC 62a_100000210303_100011249507 [0,1,0,0,0,0|3,0,0]=4 3098 B13R1.577 CCCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210303 [0,1,0,0,0,0|3,0,0]=4 3099 B13R1.577 CCCSc1ccc(c(c1)C)CO 62a_100000210303_100000748258 [0,1,0,0,0,0|3,0,0]=4 3100 B13R1.577 CCCSc1ccc(c(c1)C)CO 62a_100000748258_100000210303 [0,1,0,0,0,0|3,0,0]=4 3101 B13R1.577 CCCSc1ccc(c(c1)C)OC 62a_100000210303_100011219705 [0,1,0,0,0,0|3,0,0]=4 3102 B13R1.577 CCCSc1ccc(c(c1)C)OC 62a_100011219705_100000210303 [0,1,0,0,0,0|3,0,0]=4 3103 B13R1.577 CCCSc1ccc(c(c1)Cl)OC 62a_100000210303_100012355395 [0,1,0,0,0,0|3,0,0]=4 3104 B13R1.577 CCCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210303 [0,1,0,0,0,0|3,0,0]=4 3105 B13R1.577 CCCSc1ccc(c(c1)F)CO 62a_100000210303_100011191541 [0,1,0,0,0,0|3,0,0]=4 3106 B13R1.577 CCCSc1ccc(c(c1)F)CO 62a_100011191541_100000210303 [0,1,0,0,0,0|3,0,0]=4 3107 B13R1.577 CCCSc1ccc(c(c1)F)OC 62a_100000171752_100000210303 [0,1,0,0,0,0|3,0,0]=4 3108 B13R1.577 CCCSc1ccc(c(c1)F)OC 62a_100000210303_100000171752 [0,1,0,0,0,0|3,0,0]=4 3109 B13R1.577 CCCSc1ccc(c(c1)N)CO 62a_100000210303_100000718831 [0,1,0,0,0,0|3,0,0]=4 3110 B13R1.577 CCCSc1ccc(c(c1)N)CO 62a_100000718831_100000210303 [0,1,0,0,0,0|3,0,0]=4 3111 B13R1.577 CCCSc1ccc(c(c1)N)OC 62a_100000210303_100011249504 [0,1,0,0,0,0|3,0,0]=4 3112 B13R1.577 CCCSc1ccc(c(c1)N)OC 62a_100011249504_100000210303 [0,1,0,0,0,0|3,0,0]=4 3113 B13R1.577 CCCSc1ccc(c(c1)O)C#N 62a_100000210303_100011934713 [0,1,0,0,0,0|3,0,0]=4 3114 B13R1.577 CCCSc1ccc(c(c1)O)C=O 62a_100000210303_100011277552 [0,1,0,0,0,0|2,0,1]=4 3115 B13R1.577 CCCSc1ccc(c(c1)O)C=O 62a_100011277552_100000210303 [0,1,0,0,0,0|2,0,1]=4 3116 B13R1.577 CCCSc1ccc(c(c1)O)CO 62a_100000071718_100000210303 [0,1,0,0,0,0|2,0,0]=3 3117 B13R1.577 CCCSc1ccc(c(c1)O)CO 62a_100000210303_100000071718 [0,1,0,0,0,0|2,0,0]=3 3118 B13R1.577 CCCSc1ccc(c(c1)O)OC 62a_100000210303_100009816560 [0,1,0,0,0,0|2,0,0]=3 3119 B13R1.577 CCCSc1cnc(c(c1)O)OC 62a_100000210303_100010135713 [0,1,0,0,0,0|3,0,0]=4 3120 B13R1.577 CCNCc1ccc(c(c1)Br)OC 207a_100015525214_100000173361 [0,1,0,0,0,0|3,0,0]=4 3121 B13R1.577 CCNCc1ccc(c(c1)Br)OC 2230a_100015525214_200011397701 [0,1,0,0,0,0|3,0,0]=4 3122 B13R1.577 CCNCc1ccc(c(c1)Br)OC 270004a_100015525214_100000173361 [0,1,0,0,0,0|3,0,0]=4 3123 B13R1.577 CCNCc1ccc(c(c1)Br)OC 34a_100159240714_100000210202 [0,1,0,0,0,0|3,0,0]=4 3124 B13R1.577 CCNCc1ccc(c(c1)C)OC 207a_100015525214_100000239718 [0,1,0,0,0,0|3,0,0]=4 3125 B13R1.577 CCNCc1ccc(c(c1)C)OC 2230a_100015525214_200011290836 [0,1,0,0,0,0|3,0,0]=4 3126 B13R1.577 CCNCc1ccc(c(c1)C)OC 2230a_100102679029_100000210202 [0,1,0,0,0,0|3,0,0]=4 3127 B13R1.577 CCNCc1ccc(c(c1)C)OC 270004a_100015525214_100000239718 [0,1,0,0,0,0|3,0,0]=4 3128 B13R1.577 CCNCc1ccc(c(c1)C)OC 34a_100102679029_100000210202 [0,1,0,0,0,0|3,0,0]=4 3129 B13R1.577 CCNCc1ccc(c(c1)Cl)OC 207a_100015525214_100000186747 [0,1,0,0,0,0|3,0,0]=4 3130 B13R1.577 CCNCc1ccc(c(c1)Cl)OC 2230a_100000008799_100000210202 [0,1,0,0,0,0|3,0,0]=4 3131 B13R1.577 CCNCc1ccc(c(c1)Cl)OC 2230a_100015525214_100000693707 [0,1,0,0,0,0|3,0,0]=4 3132 B13R1.577 CCNCc1ccc(c(c1)Cl)OC 270004a_100015525214_100000186747 [0,1,0,0,0,0|3,0,0]=4 3133 B13R1.577 CCNCc1ccc(c(c1)Cl)OC 34a_100000008799_100000210202 [0,1,0,0,0,0|3,0,0]=4 3134 B13R1.577 CCNCc1ccc(c(c1)F)OC 207a_100015525214_100000204617 [0,1,0,0,0,0|3,0,0]=4 3135 B13R1.577 CCNCc1ccc(c(c1)F)OC 2230a_100000737316_100000210202 [0,1,0,0,0,0|3,0,0]=4 3136 B13R1.577 CCNCc1ccc(c(c1)F)OC 2230a_100015525214_100000189595 [0,1,0,0,0,0|3,0,0]=4 3137 B13R1.577 CCNCc1ccc(c(c1)F)OC 270004a_100015525214_100000204617 [0,1,0,0,0,0|3,0,0]=4 3138 B13R1.577 CCNCc1ccc(c(c1)F)OC 34a_100000737316_100000210202 [0,1,0,0,0,0|3,0,0]=4 3139 B13R1.577 CCNCc1ccc(c(c1)I)OC 207a_100015525214_100009827998 [0,1,0,0,0,0|3,0,0]=4 3140 B13R1.577 CCNCc1ccc(c(c1)I)OC 270004a_100015525214_100009827998 [0,1,0,0,0,0|3,0,0]=4 3141 B13R1.577 CCNCc1ccc(c(c1)O)OC 34a_100000740000_100000210202 [0,1,0,0,0,0|2,0,0]=3 3142 B13R1.577 CCOCc1ccc(c(c1)Br)OC 34a_100000246451_100000210202 [0,1,0,0,0,0|3,0,0]=4 3143 B13R1.577 CCOCc1ccc(c(c1)Br)OC 34a_100121572206_200011397701 [0,1,0,0,0,0|3,0,0]=4 3144 B13R1.577 CCOCc1ccc(c(c1)Br)OC 7a_100000246451_100000210202 [0,1,0,0,0,0|3,0,0]=4 3145 B13R1.577 CCOCc1ccc(c(c1)C)OC 34a_100121572206_200011290836 [0,1,0,0,0,0|3,0,0]=4 3146 B13R1.577 CCOCc1ccc(c(c1)C)OC 34a_200011290855_100000210202 [0,1,0,0,0,0|3,0,0]=4 3147 B13R1.577 CCOCc1ccc(c(c1)C)OC 7a_200011290855_100000210202 [0,1,0,0,0,0|3,0,0]=4 3148 B13R1.577 CCOCc1ccc(c(c1)Cl)OC 34a_100000694469_100000210202 [0,1,0,0,0,0|3,0,0]=4 3149 B13R1.577 CCOCc1ccc(c(c1)Cl)OC 34a_100121572206_100000693707 [0,1,0,0,0,0|3,0,0]=4 3150 B13R1.577 CCOCc1ccc(c(c1)Cl)OC 7a_100000694469_100000210202 [0,1,0,0,0,0|3,0,0]=4 3151 B13R1.577 CCOCc1ccc(c(c1)F)OC 34a_100000246395_100000210202 [0,1,0,0,0,0|3,0,0]=4 3152 B13R1.577 CCOCc1ccc(c(c1)F)OC 34a_100121572206_100000189595 [0,1,0,0,0,0|3,0,0]=4 3153 B13R1.577 CCOCc1ccc(c(c1)F)OC 7a_100000246395_100000210202 [0,1,0,0,0,0|3,0,0]=4 3154 B13R1.577 CCOCc1ccc(c(c1)I)OC 34a_200000013966_100000210202 [0,1,0,0,0,0|3,0,0]=4 3155 B13R1.577 CCOCc1ccc(c(c1)I)OC 7a_200000013966_100000210202 [0,1,0,0,0,0|3,0,0]=4 3156 B13R1.577 CCOCc1ccc(c(c1)N)OC 34a_100011269841_100000210202 [0,1,0,0,0,0|3,0,0]=4 3157 B13R1.577 CCSCc1ccc(c(c1)Br)OC 62a_100000210202_200011397701 [0,1,0,0,0,0|3,0,0]=4 3158 B13R1.577 CCSCc1ccc(c(c1)Br)OC 62a_200011397701_100000210202 [0,1,0,0,0,0|3,0,0]=4 3159 B13R1.577 CCSCc1ccc(c(c1)C)OC 62a_100000210202_200011290836 [0,1,0,0,0,0|3,0,0]=4 3160 B13R1.577 CCSCc1ccc(c(c1)C)OC 62a_200011290836_100000210202 [0,1,0,0,0,0|3,0,0]=4 3161 B13R1.577 CCSCc1ccc(c(c1)Cl)OC 62a_100000210202_100000693707 [0,1,0,0,0,0|3,0,0]=4 3162 B13R1.577 CCSCc1ccc(c(c1)Cl)OC 62a_100000693707_100000210202 [0,1,0,0,0,0|3,0,0]=4 3163 B13R1.577 CCSCc1ccc(c(c1)F)OC 62a_100000189595_100000210202 [0,1,0,0,0,0|3,0,0]=4 3164 B13R1.577 CCSCc1ccc(c(c1)F)OC 62a_100000210202_100000189595 [0,1,0,0,0,0|3,0,0]=4 3165 B13R1.577 CNCCc1ccc(c(c1)Br)OC 2230a_103549771065_200000210301 [0,1,0,0,0,0|1,0,0]=2 3166 B13R1.577 CNCCc1ccc(c(c1)Br)OC 34a_103549771065_200000210301 [0,1,0,0,0,0|1,0,0]=2 3167 B13R1.577 CNCCc1ccc(c(c1)Cl)OC 2230a_100025770840_200000210301 [0,1,0,0,0,0|1,0,0]=2 3168 B13R1.577 CNCCc1ccc(c(c1)Cl)OC 34a_100025770840_200000210301 [0,1,0,0,0,0|1,0,0]=2 3169 B13R1.577 CNCCc1ccc(c(c1)O)OC 2230a_100011207234_200000210301 [0,1,0,0,0,0|0,0,0]=1 3170 B13R1.577 CNCCc1ccc(c(c1)O)OC 34a_100011207234_200000210301 [0,1,0,0,0,0|0,0,0]=1 3171 B13R1.577 COCCc1ccc(c(c1)Br)OC 34a_100011962876_200000210301 [0,1,0,0,0,0|2,0,0]=3 3172 B13R1.577 COCCc1ccc(c(c1)Br)OC 7a_100011962876_200000210301 [0,1,0,0,0,0|2,0,0]=3 3173 B13R1.577 COCCc1ccc(c(c1)F)OC 34a_100011755164_200000210301 [0,1,0,0,0,0|2,0,0]=3 3174 B13R1.577 COCCc1ccc(c(c1)F)OC 7a_100011755164_200000210301 [0,1,0,0,0,0|2,0,0]=3 3175 B13R1.577 COCNc1ccc(c(c1)C)OC 2230a_100000743268_100000766300 [0,1,0,0,0,0|3,0,0]=4 3176 B13R1.577 COCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000766300 [0,1,0,0,0,0|3,0,0]=4 3177 B13R1.577 COCNc1ccc(c(c1)F)OC 2230a_100000740183_100000766300 [0,1,0,0,0,0|3,0,0]=4 3178 B13R1.577 COCOc1ccc(c(c1)O)OC 271570a_203496583355_200161107199 [0,1,0,0,0,0|2,0,0]=3 3179 B13R1.577 COCSc1cc(c(cn1)OC)O 62a_100000766300_100010264082 [0,1,0,0,0,0|3,0,0]=4 3180 B13R1.577 COCSc1ccc(c(c1)Br)CO 62a_100000766300_100010240206 [0,1,0,0,0,0|3,0,0]=4 3181 B13R1.577 COCSc1ccc(c(c1)Br)CO 62a_100010240206_100000766300 [0,1,0,0,0,0|3,0,0]=4 3182 B13R1.577 COCSc1ccc(c(c1)Br)OC 62a_100000766300_100011249507 [0,1,0,0,0,0|3,0,0]=4 3183 B13R1.577 COCSc1ccc(c(c1)Br)OC 62a_100011249507_100000766300 [0,1,0,0,0,0|3,0,0]=4 3184 B13R1.577 COCSc1ccc(c(c1)C)CO 62a_100000748258_100000766300 [0,1,0,0,0,0|3,0,0]=4 3185 B13R1.577 COCSc1ccc(c(c1)C)CO 62a_100000766300_100000748258 [0,1,0,0,0,0|3,0,0]=4 3186 B13R1.577 COCSc1ccc(c(c1)C)OC 62a_100000766300_100011219705 [0,1,0,0,0,0|3,0,0]=4 3187 B13R1.577 COCSc1ccc(c(c1)C)OC 62a_100011219705_100000766300 [0,1,0,0,0,0|3,0,0]=4 3188 B13R1.577 COCSc1ccc(c(c1)Cl)OC 62a_100000766300_100012355395 [0,1,0,0,0,0|3,0,0]=4 3189 B13R1.577 COCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000766300 [0,1,0,0,0,0|3,0,0]=4 3190 B13R1.577 COCSc1ccc(c(c1)F)CO 62a_100000766300_100011191541 [0,1,0,0,0,0|3,0,0]=4 3191 B13R1.577 COCSc1ccc(c(c1)F)CO 62a_100011191541_100000766300 [0,1,0,0,0,0|3,0,0]=4 3192 B13R1.577 COCSc1ccc(c(c1)F)OC 62a_100000171752_100000766300 [0,1,0,0,0,0|3,0,0]=4 3193 B13R1.577 COCSc1ccc(c(c1)F)OC 62a_100000766300_100000171752 [0,1,0,0,0,0|3,0,0]=4 3194 B13R1.577 COCSc1ccc(c(c1)N)CO 62a_100000718831_100000766300 [0,1,0,0,0,0|3,0,0]=4 3195 B13R1.577 COCSc1ccc(c(c1)N)CO 62a_100000766300_100000718831 [0,1,0,0,0,0|3,0,0]=4 3196 B13R1.577 COCSc1ccc(c(c1)N)OC 62a_100000766300_100011249504 [0,1,0,0,0,0|3,0,0]=4 3197 B13R1.577 COCSc1ccc(c(c1)N)OC 62a_100011249504_100000766300 [0,1,0,0,0,0|3,0,0]=4 3198 B13R1.577 COCSc1ccc(c(c1)O)C#N 62a_100000766300_100011934713 [0,1,0,0,0,0|3,0,0]=4 3199 B13R1.577 COCSc1ccc(c(c1)O)C=O 62a_100000766300_100011277552 [0,1,0,0,0,0|2,0,1]=4 3200 B13R1.577 COCSc1ccc(c(c1)O)C=O 62a_100011277552_100000766300 [0,1,0,0,0,0|2,0,1]=4 3201 B13R1.577 COCSc1ccc(c(c1)O)CO 62a_100000071718_100000766300 [0,1,0,0,0,0|2,0,0]=3 3202 B13R1.577 COCSc1ccc(c(c1)O)CO 62a_100000766300_100000071718 [0,1,0,0,0,0|2,0,0]=3 3203 B13R1.577 COCSc1ccc(c(c1)O)OC 62a_100000766300_100009816560 [0,1,0,0,0,0|2,0,0]=3 3204 B13R1.577 COCSc1cnc(c(c1)O)OC 62a_100000766300_100010135713 [0,1,0,0,0,0|3,0,0]=4 3205 B13R1.577 COc1ccc(cc1Br)CCN[13CH3] 2230a_103549771065_200025704644 [0,1,0,0,0,0|1,0,0]=2 3206 B13R1.577 COc1ccc(cc1Br)CCN[13CH3] 34a_103549771065_200025704644 [0,1,0,0,0,0|1,0,0]=2 3207 B13R1.577 COc1ccc(cc1Br)CCO[13CH3] 34a_100011962876_200025704644 [0,1,0,0,0,0|2,0,0]=3 3208 B13R1.577 COc1ccc(cc1Br)CCO[13CH3] 7a_100011962876_200025704644 [0,1,0,0,0,0|2,0,0]=3 3209 B13R1.577 COc1ccc(cc1Br)NCSC 34a_100000187427_100011218213 [0,1,0,0,0,0|3,0,0]=4 3210 B13R1.577 COc1ccc(cc1Br)OCSC 34a_100010234764_100011218213 [0,1,0,0,0,0|3,0,0]=4 3211 B13R1.577 COc1ccc(cc1Br)SCSC 62a_100011218213_100011249507 [0,1,0,0,0,0|3,0,0]=4 3212 B13R1.577 COc1ccc(cc1Br)SCSC 62a_100011249507_100011218213 [0,1,0,0,0,0|3,0,0]=4 3213 B13R1.577 COc1ccc(cc1C)NCSC 2230a_100000743268_100011218213 [0,1,0,0,0,0|3,0,0]=4 3214 B13R1.577 COc1ccc(cc1C)NCSC 34a_100000743268_100011218213 [0,1,0,0,0,0|3,0,0]=4 3215 B13R1.577 COc1ccc(cc1C)OCSC 34a_100000759738_100011218213 [0,1,0,0,0,0|3,0,0]=4 3216 B13R1.577 COc1ccc(cc1C)SCSC 62a_100011218213_100011219705 [0,1,0,0,0,0|3,0,0]=4 3217 B13R1.577 COc1ccc(cc1C)SCSC 62a_100011219705_100011218213 [0,1,0,0,0,0|3,0,0]=4 3218 B13R1.577 COc1ccc(cc1Cl)CCN[13CH3] 2230a_100025770840_200025704644 [0,1,0,0,0,0|1,0,0]=2 3219 B13R1.577 COc1ccc(cc1Cl)CCN[13CH3] 34a_100025770840_200025704644 [0,1,0,0,0,0|1,0,0]=2 3220 B13R1.577 COc1ccc(cc1Cl)NCSC 2230a_100000211044_100011218213 [0,1,0,0,0,0|3,0,0]=4 3221 B13R1.577 COc1ccc(cc1Cl)NCSC 34a_100000211044_100011218213 [0,1,0,0,0,0|3,0,0]=4 3222 B13R1.577 COc1ccc(cc1Cl)OCSC 34a_200009861682_100011218213 [0,1,0,0,0,0|3,0,0]=4 3223 B13R1.577 COc1ccc(cc1Cl)SCSC 62a_100011218213_100012355395 [0,1,0,0,0,0|3,0,0]=4 3224 B13R1.577 COc1ccc(cc1Cl)SCSC 62a_100012355395_100011218213 [0,1,0,0,0,0|3,0,0]=4 3225 B13R1.577 COc1ccc(cc1F)CCO[13CH3] 34a_100011755164_200025704644 [0,1,0,0,0,0|2,0,0]=3 3226 B13R1.577 COc1ccc(cc1F)CCO[13CH3] 7a_100011755164_200025704644 [0,1,0,0,0,0|2,0,0]=3 3227 B13R1.577 COc1ccc(cc1F)NCSC 2230a_100000740183_100011218213 [0,1,0,0,0,0|3,0,0]=4 3228 B13R1.577 COc1ccc(cc1F)NCSC 34a_100000740183_100011218213 [0,1,0,0,0,0|3,0,0]=4 3229 B13R1.577 COc1ccc(cc1F)OCSC 34a_100000746305_100011218213 [0,1,0,0,0,0|3,0,0]=4 3230 B13R1.577 COc1ccc(cc1F)SCSC 62a_100000171752_100011218213 [0,1,0,0,0,0|3,0,0]=4 3231 B13R1.577 COc1ccc(cc1F)SCSC 62a_100011218213_100000171752 [0,1,0,0,0,0|3,0,0]=4 3232 B13R1.577 COc1ccc(cc1I)NCSC 34a_100011356947_100011218213 [0,1,0,0,0,0|3,0,0]=4 3233 B13R1.577 COc1ccc(cc1I)OCSC 34a_100010084122_100011218213 [0,1,0,0,0,0|3,0,0]=4 3234 B13R1.577 COc1ccc(cc1N)SCSC 62a_100011218213_100011249504 [0,1,0,0,0,0|3,0,0]=4 3235 B13R1.577 COc1ccc(cc1N)SCSC 62a_100011249504_100011218213 [0,1,0,0,0,0|3,0,0]=4 3236 B13R1.577 COc1ccc(cc1O)CCN[13CH3] 2230a_100011207234_200025704644 [0,1,0,0,0,0|0,0,0]=1 3237 B13R1.577 COc1ccc(cc1O)CCN[13CH3] 34a_100011207234_200025704644 [0,1,0,0,0,0|0,0,0]=1 3238 B13R1.577 COc1ccc(cc1O)CNCF 34a_100000740000_100015361967 [0,1,0,0,0,0|3,0,0]=4 3239 B13R1.577 COc1ccc(cc1O)NCC=O 34a_100000211920_200009817547 [0,1,0,0,0,0|3,0,0]=4 3240 B13R1.577 COc1ccc(cc1O)NCCF 34a_100000211920_100011217306 [0,1,0,0,0,0|3,0,0]=4 3241 B13R1.577 COc1ccc(cc1O)NCCO 34a_100000211920_100000211926 [0,1,0,0,0,0|3,0,0]=4 3242 B13R1.577 COc1ccc(cc1O)NCSC 34a_100000211920_100011218213 [0,1,0,0,0,0|2,0,0]=3 3243 B13R1.577 COc1ccc(cc1O)SCC#N 62a_100011215382_100009816560 [0,1,0,0,0,0|3,0,0]=4 3244 B13R1.577 COc1ccc(cc1O)SCC=O 62a_200015260668_100009816560 [0,1,0,0,0,0|3,0,0]=4 3245 B13R1.577 COc1ccc(cc1O)SCCF 62a_100011217306_100009816560 [0,1,0,0,0,0|3,0,0]=4 3246 B13R1.577 COc1ccc(cc1O)SCCO 62a_100000211926_100009816560 [0,1,0,0,0,0|3,0,0]=4 3247 B13R1.577 COc1ccc(cc1O)SCSC 62a_100011218213_100009816560 [0,1,0,0,0,0|2,0,0]=3 3248 B13R1.577 COc1cnc(cc1O)SCSC 62a_100011218213_100010264082 [0,1,0,0,0,0|3,0,0]=4 3249 B13R1.577 COc1ncc(cc1O)SCSC 62a_100011218213_100010135713 [0,1,0,0,0,0|3,0,0]=4 3250 B13R1.577 CSCNc1ccc(c(c1)C)CO 34a_100000102464_100011218213 [0,1,0,0,0,0|3,0,0]=4 3251 B13R1.577 CSCNc1ccc(c(c1)Cl)CO 34a_100000689119_100011218213 [0,1,0,0,0,0|3,0,0]=4 3252 B13R1.577 CSCNc1ccc(c(c1)O)C#N 34a_100000094571_100011218213 [0,1,0,0,0,0|3,0,0]=4 3253 B13R1.577 CSCOc1ccc(c(c1)Br)CO 34a_100010146404_100011218213 [0,1,0,0,0,0|3,0,0]=4 3254 B13R1.577 CSCOc1ccc(c(c1)Cl)CO 34a_200000075811_100011218213 [0,1,0,0,0,0|3,0,0]=4 3255 B13R1.577 CSCOc1ccc(c(c1)F)CO 34a_100000084598_100011218213 [0,1,0,0,0,0|3,0,0]=4 3256 B13R1.577 CSCSc1ccc(c(c1)Br)CO 62a_100010240206_100011218213 [0,1,0,0,0,0|3,0,0]=4 3257 B13R1.577 CSCSc1ccc(c(c1)Br)CO 62a_100011218213_100010240206 [0,1,0,0,0,0|3,0,0]=4 3258 B13R1.577 CSCSc1ccc(c(c1)C)CO 62a_100000748258_100011218213 [0,1,0,0,0,0|3,0,0]=4 3259 B13R1.577 CSCSc1ccc(c(c1)C)CO 62a_100011218213_100000748258 [0,1,0,0,0,0|3,0,0]=4 3260 B13R1.577 CSCSc1ccc(c(c1)F)CO 62a_100011191541_100011218213 [0,1,0,0,0,0|3,0,0]=4 3261 B13R1.577 CSCSc1ccc(c(c1)F)CO 62a_100011218213_100011191541 [0,1,0,0,0,0|3,0,0]=4 3262 B13R1.577 CSCSc1ccc(c(c1)N)CO 62a_100000718831_100011218213 [0,1,0,0,0,0|3,0,0]=4 3263 B13R1.577 CSCSc1ccc(c(c1)N)CO 62a_100011218213_100000718831 [0,1,0,0,0,0|3,0,0]=4 3264 B13R1.577 CSCSc1ccc(c(c1)O)C#N 62a_100011218213_100011934713 [0,1,0,0,0,0|3,0,0]=4 3265 B13R1.577 CSCSc1ccc(c(c1)O)C=O 62a_100011218213_100011277552 [0,1,0,0,0,0|2,0,1]=4 3266 B13R1.577 CSCSc1ccc(c(c1)O)C=O 62a_100011277552_100011218213 [0,1,0,0,0,0|2,0,1]=4 3267 B13R1.577 CSCSc1ccc(c(c1)O)CO 62a_100000071718_100011218213 [0,1,0,0,0,0|2,0,0]=3 3268 B13R1.577 CSCSc1ccc(c(c1)O)CO 62a_100011218213_100000071718 [0,1,0,0,0,0|2,0,0]=3 3269 B13R1.577 N#CCSc1ccc(c(c1)O)CO 62a_100000071718_100011215382 [0,1,0,0,0,0|3,0,0]=4 3270 B13R1.577 N#CCSc1ccc(c(c1)O)CO 62a_100011215382_100000071718 [0,1,0,0,0,0|3,0,0]=4 3271 B13R1.577 O=CCSc1ccc(c(c1)O)CO 62a_100000071718_200015260668 [0,1,0,0,0,0|3,0,0]=4 3272 B13R1.577 O=CCSc1ccc(c(c1)O)CO 62a_200015260668_100000071718 [0,1,0,0,0,0|3,0,0]=4 3273 B13R1.577 OCCSc1ccc(c(c1)O)CO 62a_100000071718_100000211926 [0,1,0,0,0,0|3,0,0]=4 3274 B13R1.577 OCCSc1ccc(c(c1)O)CO 62a_100000211926_100000071718 [0,1,0,0,0,0|3,0,0]=4 3275 B13R1.577 OCc1ccc(cc1O)SCCF 62a_100000071718_100011217306 [0,1,0,0,0,0|3,0,0]=4 3276 B13R1.577 OCc1ccc(cc1O)SCCF 62a_100011217306_100000071718 [0,1,0,0,0,0|3,0,0]=4 3277 B13R1.669 C#CCCNc1ccc(c(c1)Br)O 34a_100011534360_100000688953 [0,1,0,0,0,0|2,0,1]=4 3278 B13R1.669 C#CCCNc1ccc(c(c1)C)O 34a_100011218179_100000688953 [0,1,0,0,0,0|2,0,1]=4 3279 B13R1.669 C#CCCNc1ccc(c(c1)C)O 7a_100011218179_100000688953 [0,1,0,0,0,0|2,0,1]=4 3280 B13R1.669 C#CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000688953 [0,1,0,0,0,0|2,0,1]=4 3281 B13R1.669 C#CCCNc1ccc(c(c1)F)O 34a_100011220035_100000688953 [0,1,0,0,0,0|2,0,1]=4 3282 B13R1.669 C#CCCNc1ccc(c(c1)F)O 7a_100011220035_100000688953 [0,1,0,0,0,0|2,0,1]=4 3283 B13R1.669 C#CCCNc1ccc(c(c1)O)C 34a_100000759471_100000688953 [0,1,0,0,0,0|2,0,1]=4 3284 B13R1.669 C#CCCNc1ccc(c(c1)O)C 7a_100000759471_100000688953 [0,1,0,0,0,0|2,0,1]=4 3285 B13R1.669 C#CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000688953 [0,1,0,0,0,0|2,0,1]=4 3286 B13R1.669 C#CCCNc1ccc(c(c1)O)F 34a_100012017398_100000688953 [0,1,0,0,0,0|2,0,1]=4 3287 B13R1.669 C#CCCNc1ccc(c(c1)O)F 7a_100012017398_100000688953 [0,1,0,0,0,0|2,0,1]=4 3288 B13R1.669 C#CCCNc1ccc(c(c1)O)O 34a_100102946323_100000688953 [0,1,0,0,0,0|1,0,1]=3 3289 B13R1.669 C#CCCSc1ccc(c(c1)Br)O 62a_100000688953_100012361655 [0,1,0,0,0,0|2,0,1]=4 3290 B13R1.669 C#CCCSc1ccc(c(c1)Br)O 62a_100012361655_100000688953 [0,1,0,0,0,0|2,0,1]=4 3291 B13R1.669 C#CCCSc1ccc(c(c1)C)O 62a_100000688953_100000186361 [0,1,0,0,0,0|2,0,1]=4 3292 B13R1.669 C#CCCSc1ccc(c(c1)Cl)O 62a_100000688953_100012360047 [0,1,0,0,0,0|2,0,1]=4 3293 B13R1.669 C#CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000688953 [0,1,0,0,0,0|2,0,1]=4 3294 B13R1.669 C#CCCSc1ccc(c(c1)F)O 62a_100000185481_100000688953 [0,1,0,0,0,0|2,0,1]=4 3295 B13R1.669 C#CCCSc1ccc(c(c1)F)O 62a_100000688953_100000185481 [0,1,0,0,0,0|2,0,1]=4 3296 B13R1.669 C#CCCSc1ccc(c(c1)N)O 62a_100000688953_100000752626 [0,1,0,0,0,0|2,0,1]=4 3297 B13R1.669 C#CCCSc1ccc(c(c1)N)O 62a_100000752626_100000688953 [0,1,0,0,0,0|2,0,1]=4 3298 B13R1.669 C#CCCSc1ccc(c(c1)O)Br 62a_100000688953_100012356990 [0,1,0,0,0,0|2,0,1]=4 3299 B13R1.669 C#CCCSc1ccc(c(c1)O)Br 62a_100012356990_100000688953 [0,1,0,0,0,0|2,0,1]=4 3300 B13R1.669 C#CCCSc1ccc(c(c1)O)C 62a_100000685420_100000688953 [0,1,0,0,0,0|2,0,1]=4 3301 B13R1.669 C#CCCSc1ccc(c(c1)O)C 62a_100000688953_100000685420 [0,1,0,0,0,0|2,0,1]=4 3302 B13R1.669 C#CCCSc1ccc(c(c1)O)Cl 62a_100000688953_100011356854 [0,1,0,0,0,0|2,0,1]=4 3303 B13R1.669 C#CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000688953 [0,1,0,0,0,0|2,0,1]=4 3304 B13R1.669 C#CCCSc1ccc(c(c1)O)F 62a_100000686035_100000688953 [0,1,0,0,0,0|2,0,1]=4 3305 B13R1.669 C#CCCSc1ccc(c(c1)O)F 62a_100000688953_100000686035 [0,1,0,0,0,0|2,0,1]=4 3306 B13R1.669 C#CCCSc1ccc(c(c1)O)N 62a_100000688953_100000739049 [0,1,0,0,0,0|2,0,1]=4 3307 B13R1.669 C#CCCSc1ccc(c(c1)O)N 62a_100000739049_100000688953 [0,1,0,0,0,0|2,0,1]=4 3308 B13R1.669 C#CCCSc1ccc(c(c1)O)O 62a_100000688953_100009813601 [0,1,0,0,0,0|1,0,1]=3 3309 B13R1.669 C#CCNCc1ccc(c(c1)F)O 34a_100000758358_100000184674 [0,1,0,0,0,0|2,0,1]=4 3310 B13R1.669 C#CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000184674 [0,1,0,0,0,0|2,0,1]=4 3311 B13R1.669 C#CCNCc1ccc(c(c1)O)F 34a_100160469508_100000184674 [0,1,0,0,0,0|2,0,1]=4 3312 B13R1.669 C#CCNCc1ccc(c(c1)O)O 34a_100000010075_100000184674 [0,1,0,0,0,0|1,0,1]=3 3313 B13R1.669 C/C=C/CNc1ccc(c(c1)Br)O 34a_100011534360_100102629194 [0,1,0,0,0,0|2,0,1]=4 3314 B13R1.669 C/C=C/CNc1ccc(c(c1)C)O 34a_100011218179_100102629194 [0,1,0,0,0,0|2,0,1]=4 3315 B13R1.669 C/C=C/CNc1ccc(c(c1)C)O 7a_100011218179_100102629194 [0,1,0,0,0,0|2,0,1]=4 3316 B13R1.669 C/C=C/CNc1ccc(c(c1)Cl)O 34a_100000744943_100102629194 [0,1,0,0,0,0|2,0,1]=4 3317 B13R1.669 C/C=C/CNc1ccc(c(c1)F)O 34a_100011220035_100102629194 [0,1,0,0,0,0|2,0,1]=4 3318 B13R1.669 C/C=C/CNc1ccc(c(c1)F)O 7a_100011220035_100102629194 [0,1,0,0,0,0|2,0,1]=4 3319 B13R1.669 C/C=C/CNc1ccc(c(c1)O)C 34a_100000759471_100102629194 [0,1,0,0,0,0|2,0,1]=4 3320 B13R1.669 C/C=C/CNc1ccc(c(c1)O)C 7a_100000759471_100102629194 [0,1,0,0,0,0|2,0,1]=4 3321 B13R1.669 C/C=C/CNc1ccc(c(c1)O)Cl 34a_100011934209_100102629194 [0,1,0,0,0,0|2,0,1]=4 3322 B13R1.669 C/C=C/CNc1ccc(c(c1)O)F 34a_100012017398_100102629194 [0,1,0,0,0,0|2,0,1]=4 3323 B13R1.669 C/C=C/CNc1ccc(c(c1)O)F 7a_100012017398_100102629194 [0,1,0,0,0,0|2,0,1]=4 3324 B13R1.669 C/C=C/CNc1ccc(c(c1)O)O 34a_100102946323_100102629194 [0,1,0,0,0,0|1,0,1]=3 3325 B13R1.669 C/C=C/CSc1ccc(c(c1)Br)O 62a_100012361655_100102629194 [0,1,0,0,0,0|2,0,1]=4 3326 B13R1.669 C/C=C/CSc1ccc(c(c1)Br)O 62a_100102629194_100012361655 [0,1,0,0,0,0|2,0,1]=4 3327 B13R1.669 C/C=C/CSc1ccc(c(c1)C)O 62a_100102629194_100000186361 [0,1,0,0,0,0|2,0,1]=4 3328 B13R1.669 C/C=C/CSc1ccc(c(c1)Cl)O 62a_100012360047_100102629194 [0,1,0,0,0,0|2,0,1]=4 3329 B13R1.669 C/C=C/CSc1ccc(c(c1)Cl)O 62a_100102629194_100012360047 [0,1,0,0,0,0|2,0,1]=4 3330 B13R1.669 C/C=C/CSc1ccc(c(c1)F)O 62a_100000185481_100102629194 [0,1,0,0,0,0|2,0,1]=4 3331 B13R1.669 C/C=C/CSc1ccc(c(c1)F)O 62a_100102629194_100000185481 [0,1,0,0,0,0|2,0,1]=4 3332 B13R1.669 C/C=C/CSc1ccc(c(c1)N)O 62a_100000752626_100102629194 [0,1,0,0,0,0|2,0,1]=4 3333 B13R1.669 C/C=C/CSc1ccc(c(c1)N)O 62a_100102629194_100000752626 [0,1,0,0,0,0|2,0,1]=4 3334 B13R1.669 C/C=C/CSc1ccc(c(c1)O)Br 62a_100012356990_100102629194 [0,1,0,0,0,0|2,0,1]=4 3335 B13R1.669 C/C=C/CSc1ccc(c(c1)O)Br 62a_100102629194_100012356990 [0,1,0,0,0,0|2,0,1]=4 3336 B13R1.669 C/C=C/CSc1ccc(c(c1)O)C 62a_100000685420_100102629194 [0,1,0,0,0,0|2,0,1]=4 3337 B13R1.669 C/C=C/CSc1ccc(c(c1)O)C 62a_100102629194_100000685420 [0,1,0,0,0,0|2,0,1]=4 3338 B13R1.669 C/C=C/CSc1ccc(c(c1)O)Cl 62a_100011356854_100102629194 [0,1,0,0,0,0|2,0,1]=4 3339 B13R1.669 C/C=C/CSc1ccc(c(c1)O)Cl 62a_100102629194_100011356854 [0,1,0,0,0,0|2,0,1]=4 3340 B13R1.669 C/C=C/CSc1ccc(c(c1)O)F 62a_100000686035_100102629194 [0,1,0,0,0,0|2,0,1]=4 3341 B13R1.669 C/C=C/CSc1ccc(c(c1)O)F 62a_100102629194_100000686035 [0,1,0,0,0,0|2,0,1]=4 3342 B13R1.669 C/C=C/CSc1ccc(c(c1)O)N 62a_100000739049_100102629194 [0,1,0,0,0,0|2,0,1]=4 3343 B13R1.669 C/C=C/CSc1ccc(c(c1)O)N 62a_100102629194_100000739049 [0,1,0,0,0,0|2,0,1]=4 3344 B13R1.669 C/C=C/CSc1ccc(c(c1)O)O 62a_100102629194_100009813601 [0,1,0,0,0,0|1,0,1]=3 3345 B13R1.669 C=CCCNc1ccc(c(c1)Br)O 34a_100011534360_100000754431 [0,1,0,0,0,0|2,0,1]=4 3346 B13R1.669 C=CCCNc1ccc(c(c1)C)O 34a_100011218179_100000754431 [0,1,0,0,0,0|2,0,1]=4 3347 B13R1.669 C=CCCNc1ccc(c(c1)C)O 7a_100011218179_100000754431 [0,1,0,0,0,0|2,0,1]=4 3348 B13R1.669 C=CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000754431 [0,1,0,0,0,0|2,0,1]=4 3349 B13R1.669 C=CCCNc1ccc(c(c1)F)O 34a_100011220035_100000754431 [0,1,0,0,0,0|2,0,1]=4 3350 B13R1.669 C=CCCNc1ccc(c(c1)F)O 7a_100011220035_100000754431 [0,1,0,0,0,0|2,0,1]=4 3351 B13R1.669 C=CCCNc1ccc(c(c1)O)C 34a_100000759471_100000754431 [0,1,0,0,0,0|2,0,1]=4 3352 B13R1.669 C=CCCNc1ccc(c(c1)O)C 7a_100000759471_100000754431 [0,1,0,0,0,0|2,0,1]=4 3353 B13R1.669 C=CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000754431 [0,1,0,0,0,0|2,0,1]=4 3354 B13R1.669 C=CCCNc1ccc(c(c1)O)F 34a_100012017398_100000754431 [0,1,0,0,0,0|2,0,1]=4 3355 B13R1.669 C=CCCNc1ccc(c(c1)O)F 7a_100012017398_100000754431 [0,1,0,0,0,0|2,0,1]=4 3356 B13R1.669 C=CCCNc1ccc(c(c1)O)O 34a_100102946323_100000754431 [0,1,0,0,0,0|1,0,1]=3 3357 B13R1.669 C=CCCSc1ccc(c(c1)Br)O 62a_100000754431_100012361655 [0,1,0,0,0,0|2,0,1]=4 3358 B13R1.669 C=CCCSc1ccc(c(c1)Br)O 62a_100012361655_100000754431 [0,1,0,0,0,0|2,0,1]=4 3359 B13R1.669 C=CCCSc1ccc(c(c1)C)O 62a_100000754431_100000186361 [0,1,0,0,0,0|2,0,1]=4 3360 B13R1.669 C=CCCSc1ccc(c(c1)Cl)O 62a_100000754431_100012360047 [0,1,0,0,0,0|2,0,1]=4 3361 B13R1.669 C=CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000754431 [0,1,0,0,0,0|2,0,1]=4 3362 B13R1.669 C=CCCSc1ccc(c(c1)F)O 62a_100000185481_100000754431 [0,1,0,0,0,0|2,0,1]=4 3363 B13R1.669 C=CCCSc1ccc(c(c1)F)O 62a_100000754431_100000185481 [0,1,0,0,0,0|2,0,1]=4 3364 B13R1.669 C=CCCSc1ccc(c(c1)N)O 62a_100000752626_100000754431 [0,1,0,0,0,0|2,0,1]=4 3365 B13R1.669 C=CCCSc1ccc(c(c1)N)O 62a_100000754431_100000752626 [0,1,0,0,0,0|2,0,1]=4 3366 B13R1.669 C=CCCSc1ccc(c(c1)O)Br 62a_100000754431_100012356990 [0,1,0,0,0,0|2,0,1]=4 3367 B13R1.669 C=CCCSc1ccc(c(c1)O)Br 62a_100012356990_100000754431 [0,1,0,0,0,0|2,0,1]=4 3368 B13R1.669 C=CCCSc1ccc(c(c1)O)C 62a_100000685420_100000754431 [0,1,0,0,0,0|2,0,1]=4 3369 B13R1.669 C=CCCSc1ccc(c(c1)O)C 62a_100000754431_100000685420 [0,1,0,0,0,0|2,0,1]=4 3370 B13R1.669 C=CCCSc1ccc(c(c1)O)Cl 62a_100000754431_100011356854 [0,1,0,0,0,0|2,0,1]=4 3371 B13R1.669 C=CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000754431 [0,1,0,0,0,0|2,0,1]=4 3372 B13R1.669 C=CCCSc1ccc(c(c1)O)F 62a_100000686035_100000754431 [0,1,0,0,0,0|2,0,1]=4 3373 B13R1.669 C=CCCSc1ccc(c(c1)O)F 62a_100000754431_100000686035 [0,1,0,0,0,0|2,0,1]=4 3374 B13R1.669 C=CCCSc1ccc(c(c1)O)N 62a_100000739049_100000754431 [0,1,0,0,0,0|2,0,1]=4 3375 B13R1.669 C=CCCSc1ccc(c(c1)O)N 62a_100000754431_100000739049 [0,1,0,0,0,0|2,0,1]=4 3376 B13R1.669 C=CCCSc1ccc(c(c1)O)O 62a_100000754431_100009813601 [0,1,0,0,0,0|1,0,1]=3 3377 B13R1.669 C=CCNCc1ccc(c(c1)F)O 34a_100000758358_100015514636 [0,1,0,0,0,0|2,0,1]=4 3378 B13R1.669 C=CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100015514636 [0,1,0,0,0,0|2,0,1]=4 3379 B13R1.669 C=CCNCc1ccc(c(c1)O)F 34a_100160469508_100015514636 [0,1,0,0,0,0|2,0,1]=4 3380 B13R1.669 C=CCNCc1ccc(c(c1)O)O 34a_100000010075_100015514636 [0,1,0,0,0,0|1,0,1]=3 3381 B13R1.669 CC#CCNc1ccc(c(c1)Br)O 34a_100011534360_100000748600 [0,1,0,0,0,0|2,0,1]=4 3382 B13R1.669 CC#CCNc1ccc(c(c1)C)O 34a_100011218179_100000748600 [0,1,0,0,0,0|2,0,1]=4 3383 B13R1.669 CC#CCNc1ccc(c(c1)C)O 7a_100011218179_100000748600 [0,1,0,0,0,0|2,0,1]=4 3384 B13R1.669 CC#CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000748600 [0,1,0,0,0,0|2,0,1]=4 3385 B13R1.669 CC#CCNc1ccc(c(c1)F)O 34a_100011220035_100000748600 [0,1,0,0,0,0|2,0,1]=4 3386 B13R1.669 CC#CCNc1ccc(c(c1)F)O 7a_100011220035_100000748600 [0,1,0,0,0,0|2,0,1]=4 3387 B13R1.669 CC#CCNc1ccc(c(c1)O)C 34a_100000759471_100000748600 [0,1,0,0,0,0|2,0,1]=4 3388 B13R1.669 CC#CCNc1ccc(c(c1)O)C 7a_100000759471_100000748600 [0,1,0,0,0,0|2,0,1]=4 3389 B13R1.669 CC#CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000748600 [0,1,0,0,0,0|2,0,1]=4 3390 B13R1.669 CC#CCNc1ccc(c(c1)O)F 34a_100012017398_100000748600 [0,1,0,0,0,0|2,0,1]=4 3391 B13R1.669 CC#CCNc1ccc(c(c1)O)F 7a_100012017398_100000748600 [0,1,0,0,0,0|2,0,1]=4 3392 B13R1.669 CC#CCNc1ccc(c(c1)O)O 34a_100102946323_100000748600 [0,1,0,0,0,0|1,0,1]=3 3393 B13R1.669 CC#CCSc1ccc(c(c1)Br)O 62a_100000748600_100012361655 [0,1,0,0,0,0|2,0,1]=4 3394 B13R1.669 CC#CCSc1ccc(c(c1)Br)O 62a_100012361655_100000748600 [0,1,0,0,0,0|2,0,1]=4 3395 B13R1.669 CC#CCSc1ccc(c(c1)C)O 62a_100000748600_100000186361 [0,1,0,0,0,0|2,0,1]=4 3396 B13R1.669 CC#CCSc1ccc(c(c1)Cl)O 62a_100000748600_100012360047 [0,1,0,0,0,0|2,0,1]=4 3397 B13R1.669 CC#CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000748600 [0,1,0,0,0,0|2,0,1]=4 3398 B13R1.669 CC#CCSc1ccc(c(c1)F)O 62a_100000185481_100000748600 [0,1,0,0,0,0|2,0,1]=4 3399 B13R1.669 CC#CCSc1ccc(c(c1)F)O 62a_100000748600_100000185481 [0,1,0,0,0,0|2,0,1]=4 3400 B13R1.669 CC#CCSc1ccc(c(c1)N)O 62a_100000748600_100000752626 [0,1,0,0,0,0|2,0,1]=4 3401 B13R1.669 CC#CCSc1ccc(c(c1)N)O 62a_100000752626_100000748600 [0,1,0,0,0,0|2,0,1]=4 3402 B13R1.669 CC#CCSc1ccc(c(c1)O)Br 62a_100000748600_100012356990 [0,1,0,0,0,0|2,0,1]=4 3403 B13R1.669 CC#CCSc1ccc(c(c1)O)Br 62a_100012356990_100000748600 [0,1,0,0,0,0|2,0,1]=4 3404 B13R1.669 CC#CCSc1ccc(c(c1)O)C 62a_100000685420_100000748600 [0,1,0,0,0,0|2,0,1]=4 3405 B13R1.669 CC#CCSc1ccc(c(c1)O)C 62a_100000748600_100000685420 [0,1,0,0,0,0|2,0,1]=4 3406 B13R1.669 CC#CCSc1ccc(c(c1)O)Cl 62a_100000748600_100011356854 [0,1,0,0,0,0|2,0,1]=4 3407 B13R1.669 CC#CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000748600 [0,1,0,0,0,0|2,0,1]=4 3408 B13R1.669 CC#CCSc1ccc(c(c1)O)F 62a_100000686035_100000748600 [0,1,0,0,0,0|2,0,1]=4 3409 B13R1.669 CC#CCSc1ccc(c(c1)O)F 62a_100000748600_100000686035 [0,1,0,0,0,0|2,0,1]=4 3410 B13R1.669 CC#CCSc1ccc(c(c1)O)N 62a_100000739049_100000748600 [0,1,0,0,0,0|2,0,1]=4 3411 B13R1.669 CC#CCSc1ccc(c(c1)O)N 62a_100000748600_100000739049 [0,1,0,0,0,0|2,0,1]=4 3412 B13R1.669 CC#CCSc1ccc(c(c1)O)O 62a_100000748600_100009813601 [0,1,0,0,0,0|1,0,1]=3 3413 B13R1.669 CC=CCNc1ccc(c(c1)Br)O 34a_100011534360_100000070051 [0,1,0,0,0,0|2,0,1]=4 3414 B13R1.669 CC=CCNc1ccc(c(c1)C)O 34a_100011218179_100000070051 [0,1,0,0,0,0|2,0,1]=4 3415 B13R1.669 CC=CCNc1ccc(c(c1)C)O 7a_100011218179_100000070051 [0,1,0,0,0,0|2,0,1]=4 3416 B13R1.669 CC=CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000070051 [0,1,0,0,0,0|2,0,1]=4 3417 B13R1.669 CC=CCNc1ccc(c(c1)F)O 34a_100011220035_100000070051 [0,1,0,0,0,0|2,0,1]=4 3418 B13R1.669 CC=CCNc1ccc(c(c1)F)O 7a_100011220035_100000070051 [0,1,0,0,0,0|2,0,1]=4 3419 B13R1.669 CC=CCNc1ccc(c(c1)O)C 34a_100000759471_100000070051 [0,1,0,0,0,0|2,0,1]=4 3420 B13R1.669 CC=CCNc1ccc(c(c1)O)C 7a_100000759471_100000070051 [0,1,0,0,0,0|2,0,1]=4 3421 B13R1.669 CC=CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000070051 [0,1,0,0,0,0|2,0,1]=4 3422 B13R1.669 CC=CCNc1ccc(c(c1)O)F 34a_100012017398_100000070051 [0,1,0,0,0,0|2,0,1]=4 3423 B13R1.669 CC=CCNc1ccc(c(c1)O)F 7a_100012017398_100000070051 [0,1,0,0,0,0|2,0,1]=4 3424 B13R1.669 CC=CCNc1ccc(c(c1)O)O 34a_100102946323_100000070051 [0,1,0,0,0,0|1,0,1]=3 3425 B13R1.669 CC=CCSc1ccc(c(c1)Br)O 62a_100000070051_100012361655 [0,1,0,0,0,0|2,0,1]=4 3426 B13R1.669 CC=CCSc1ccc(c(c1)Br)O 62a_100012361655_100000070051 [0,1,0,0,0,0|2,0,1]=4 3427 B13R1.669 CC=CCSc1ccc(c(c1)C)O 62a_100000070051_100000186361 [0,1,0,0,0,0|2,0,1]=4 3428 B13R1.669 CC=CCSc1ccc(c(c1)Cl)O 62a_100000070051_100012360047 [0,1,0,0,0,0|2,0,1]=4 3429 B13R1.669 CC=CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000070051 [0,1,0,0,0,0|2,0,1]=4 3430 B13R1.669 CC=CCSc1ccc(c(c1)F)O 62a_100000070051_100000185481 [0,1,0,0,0,0|2,0,1]=4 3431 B13R1.669 CC=CCSc1ccc(c(c1)F)O 62a_100000185481_100000070051 [0,1,0,0,0,0|2,0,1]=4 3432 B13R1.669 CC=CCSc1ccc(c(c1)N)O 62a_100000070051_100000752626 [0,1,0,0,0,0|2,0,1]=4 3433 B13R1.669 CC=CCSc1ccc(c(c1)N)O 62a_100000752626_100000070051 [0,1,0,0,0,0|2,0,1]=4 3434 B13R1.669 CC=CCSc1ccc(c(c1)O)Br 62a_100000070051_100012356990 [0,1,0,0,0,0|2,0,1]=4 3435 B13R1.669 CC=CCSc1ccc(c(c1)O)Br 62a_100012356990_100000070051 [0,1,0,0,0,0|2,0,1]=4 3436 B13R1.669 CC=CCSc1ccc(c(c1)O)C 62a_100000070051_100000685420 [0,1,0,0,0,0|2,0,1]=4 3437 B13R1.669 CC=CCSc1ccc(c(c1)O)C 62a_100000685420_100000070051 [0,1,0,0,0,0|2,0,1]=4 3438 B13R1.669 CC=CCSc1ccc(c(c1)O)Cl 62a_100000070051_100011356854 [0,1,0,0,0,0|2,0,1]=4 3439 B13R1.669 CC=CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000070051 [0,1,0,0,0,0|2,0,1]=4 3440 B13R1.669 CC=CCSc1ccc(c(c1)O)F 62a_100000070051_100000686035 [0,1,0,0,0,0|2,0,1]=4 3441 B13R1.669 CC=CCSc1ccc(c(c1)O)F 62a_100000686035_100000070051 [0,1,0,0,0,0|2,0,1]=4 3442 B13R1.669 CC=CCSc1ccc(c(c1)O)N 62a_100000070051_100000739049 [0,1,0,0,0,0|2,0,1]=4 3443 B13R1.669 CC=CCSc1ccc(c(c1)O)N 62a_100000739049_100000070051 [0,1,0,0,0,0|2,0,1]=4 3444 B13R1.669 CC=CCSc1ccc(c(c1)O)O 62a_100000070051_100009813601 [0,1,0,0,0,0|1,0,1]=3 3445 B13R1.669 CCCC=Cc1ccc(c(c1)Br)O 271570a_100016258520_100012361655 [0,1,0,0,0,0|2,0,1]=4 3446 B13R1.669 CCCC=Cc1ccc(c(c1)C)O 271570a_100016258520_100000186361 [0,1,0,0,0,0|2,0,1]=4 3447 B13R1.669 CCCC=Cc1ccc(c(c1)Cl)O 271570a_100016258520_100012360047 [0,1,0,0,0,0|2,0,1]=4 3448 B13R1.669 CCCC=Cc1ccc(c(c1)F)O 271570a_100016258520_100000185481 [0,1,0,0,0,0|2,0,1]=4 3449 B13R1.669 CCCC=Cc1ccc(c(c1)N)O 271570a_100016258520_100000752626 [0,1,0,0,0,0|2,0,1]=4 3450 B13R1.669 CCCC=Cc1ccc(c(c1)O)Br 271570a_100016258520_100012356990 [0,1,0,0,0,0|2,0,1]=4 3451 B13R1.669 CCCC=Cc1ccc(c(c1)O)C 271570a_100016258520_100000766334 [0,1,0,0,0,0|2,0,1]=4 3452 B13R1.669 CCCC=Cc1ccc(c(c1)O)Cl 271570a_100016258520_100011356854 [0,1,0,0,0,0|2,0,1]=4 3453 B13R1.669 CCCC=Cc1ccc(c(c1)O)F 271570a_100016258520_100000686035 [0,1,0,0,0,0|2,0,1]=4 3454 B13R1.669 CCCC=Cc1ccc(c(c1)O)N 271570a_100016258520_100000739049 [0,1,0,0,0,0|2,0,1]=4 3455 B13R1.669 CCCC=Cc1ccc(c(c1)O)O 271570a_100016258520_100009813601 [0,1,0,0,0,0|1,0,1]=3 3456 B13R1.669 CCCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210211 [0,1,0,0,0,0|3,0,0]=4 3457 B13R1.669 CCCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210210 [0,1,0,0,0,0|3,0,0]=4 3458 B13R1.669 CCCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210211 [0,1,0,0,0,0|3,0,0]=4 3459 B13R1.669 CCCCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210211 [0,1,0,0,0,0|3,0,0]=4 3460 B13R1.669 CCCCNc1ccc(c(c1)Br)C 34a_100000736455_100000210210 [0,1,0,0,0,0|3,0,0]=4 3461 B13R1.669 CCCCNc1ccc(c(c1)Br)C 7a_100000736455_100000210211 [0,1,0,0,0,0|3,0,0]=4 3462 B13R1.669 CCCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210211 [0,1,0,0,0,0|3,0,0]=4 3463 B13R1.669 CCCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210210 [0,1,0,0,0,0|3,0,0]=4 3464 B13R1.669 CCCCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210211 [0,1,0,0,0,0|3,0,0]=4 3465 B13R1.669 CCCCNc1ccc(c(c1)Br)F 34a_100000760356_100000210210 [0,1,0,0,0,0|3,0,0]=4 3466 B13R1.669 CCCCNc1ccc(c(c1)Br)F 7a_100000760356_100000210211 [0,1,0,0,0,0|3,0,0]=4 3467 B13R1.669 CCCCNc1ccc(c(c1)Br)I 34a_100000750458_100000210210 [0,1,0,0,0,0|3,0,0]=4 3468 B13R1.669 CCCCNc1ccc(c(c1)Br)O 34a_100011534360_100000210210 [0,1,0,0,0,0|2,0,0]=3 3469 B13R1.669 CCCCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210211 [0,1,0,0,0,0|3,0,0]=4 3470 B13R1.669 CCCCNc1ccc(c(c1)C)Br 34a_100000210723_100000210210 [0,1,0,0,0,0|3,0,0]=4 3471 B13R1.669 CCCCNc1ccc(c(c1)C)Br 7a_100000210723_100000210211 [0,1,0,0,0,0|3,0,0]=4 3472 B13R1.669 CCCCNc1ccc(c(c1)C)C 2230a_100000724040_100000210211 [0,1,0,0,0,0|3,0,0]=4 3473 B13R1.669 CCCCNc1ccc(c(c1)C)C 34a_100000724040_100000210210 [0,1,0,0,0,0|3,0,0]=4 3474 B13R1.669 CCCCNc1ccc(c(c1)C)C 7a_100000724040_100000210211 [0,1,0,0,0,0|3,0,0]=4 3475 B13R1.669 CCCCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210211 [0,1,0,0,0,0|3,0,0]=4 3476 B13R1.669 CCCCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210210 [0,1,0,0,0,0|3,0,0]=4 3477 B13R1.669 CCCCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210211 [0,1,0,0,0,0|3,0,0]=4 3478 B13R1.669 CCCCNc1ccc(c(c1)C)F 2230a_100000750164_100000210211 [0,1,0,0,0,0|3,0,0]=4 3479 B13R1.669 CCCCNc1ccc(c(c1)C)F 34a_100000750164_100000210210 [0,1,0,0,0,0|3,0,0]=4 3480 B13R1.669 CCCCNc1ccc(c(c1)C)F 7a_100000750164_100000210211 [0,1,0,0,0,0|3,0,0]=4 3481 B13R1.669 CCCCNc1ccc(c(c1)C)I 34a_100000198070_100000210210 [0,1,0,0,0,0|3,0,0]=4 3482 B13R1.669 CCCCNc1ccc(c(c1)C)I 7a_100000198070_100000210211 [0,1,0,0,0,0|3,0,0]=4 3483 B13R1.669 CCCCNc1ccc(c(c1)C)O 34a_100011218179_100000210210 [0,1,0,0,0,0|2,0,0]=3 3484 B13R1.669 CCCCNc1ccc(c(c1)C)O 7a_100011218179_100000210211 [0,1,0,0,0,0|2,0,0]=3 3485 B13R1.669 CCCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210211 [0,1,0,0,0,0|3,0,0]=4 3486 B13R1.669 CCCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210210 [0,1,0,0,0,0|3,0,0]=4 3487 B13R1.669 CCCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210211 [0,1,0,0,0,0|3,0,0]=4 3488 B13R1.669 CCCCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210211 [0,1,0,0,0,0|3,0,0]=4 3489 B13R1.669 CCCCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210210 [0,1,0,0,0,0|3,0,0]=4 3490 B13R1.669 CCCCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210211 [0,1,0,0,0,0|3,0,0]=4 3491 B13R1.669 CCCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210211 [0,1,0,0,0,0|3,0,0]=4 3492 B13R1.669 CCCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210210 [0,1,0,0,0,0|3,0,0]=4 3493 B13R1.669 CCCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210211 [0,1,0,0,0,0|3,0,0]=4 3494 B13R1.669 CCCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210210 [0,1,0,0,0,0|3,0,0]=4 3495 B13R1.669 CCCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210211 [0,1,0,0,0,0|3,0,0]=4 3496 B13R1.669 CCCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210210 [0,1,0,0,0,0|3,0,0]=4 3497 B13R1.669 CCCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210210 [0,1,0,0,0,0|2,0,0]=3 3498 B13R1.669 CCCCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210211 [0,1,0,0,0,0|3,0,0]=4 3499 B13R1.669 CCCCNc1ccc(c(c1)F)Br 34a_100000759894_100000210210 [0,1,0,0,0,0|3,0,0]=4 3500 B13R1.669 CCCCNc1ccc(c(c1)F)Br 7a_100000759894_100000210211 [0,1,0,0,0,0|3,0,0]=4 3501 B13R1.669 CCCCNc1ccc(c(c1)F)C 2230a_100000210958_100000210211 [0,1,0,0,0,0|3,0,0]=4 3502 B13R1.669 CCCCNc1ccc(c(c1)F)C 34a_100000210958_100000210210 [0,1,0,0,0,0|3,0,0]=4 3503 B13R1.669 CCCCNc1ccc(c(c1)F)C 7a_100000210958_100000210211 [0,1,0,0,0,0|3,0,0]=4 3504 B13R1.669 CCCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210211 [0,1,0,0,0,0|3,0,0]=4 3505 B13R1.669 CCCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210210 [0,1,0,0,0,0|3,0,0]=4 3506 B13R1.669 CCCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210211 [0,1,0,0,0,0|3,0,0]=4 3507 B13R1.669 CCCCNc1ccc(c(c1)F)F 2230a_100000210724_100000210211 [0,1,0,0,0,0|3,0,0]=4 3508 B13R1.669 CCCCNc1ccc(c(c1)F)F 34a_100000210724_100000210210 [0,1,0,0,0,0|3,0,0]=4 3509 B13R1.669 CCCCNc1ccc(c(c1)F)F 7a_100000210724_100000210211 [0,1,0,0,0,0|3,0,0]=4 3510 B13R1.669 CCCCNc1ccc(c(c1)F)I 34a_100011356925_100000210210 [0,1,0,0,0,0|3,0,0]=4 3511 B13R1.669 CCCCNc1ccc(c(c1)F)I 7a_100011356925_100000210211 [0,1,0,0,0,0|3,0,0]=4 3512 B13R1.669 CCCCNc1ccc(c(c1)F)O 34a_100011220035_100000210210 [0,1,0,0,0,0|2,0,0]=3 3513 B13R1.669 CCCCNc1ccc(c(c1)F)O 7a_100011220035_100000210211 [0,1,0,0,0,0|2,0,0]=3 3514 B13R1.669 CCCCNc1ccc(c(c1)I)Br 34a_100000750459_100000210210 [0,1,0,0,0,0|3,0,0]=4 3515 B13R1.669 CCCCNc1ccc(c(c1)I)C 34a_100000184131_100000210210 [0,1,0,0,0,0|3,0,0]=4 3516 B13R1.669 CCCCNc1ccc(c(c1)I)C 7a_100000184131_100000210211 [0,1,0,0,0,0|3,0,0]=4 3517 B13R1.669 CCCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210210 [0,1,0,0,0,0|3,0,0]=4 3518 B13R1.669 CCCCNc1ccc(c(c1)I)F 34a_114828291077_100000210210 [0,1,0,0,0,0|3,0,0]=4 3519 B13R1.669 CCCCNc1ccc(c(c1)I)F 7a_114828291077_100000210211 [0,1,0,0,0,0|3,0,0]=4 3520 B13R1.669 CCCCNc1ccc(c(c1)O)C 34a_100000759471_100000210210 [0,1,0,0,0,0|2,0,0]=3 3521 B13R1.669 CCCCNc1ccc(c(c1)O)C 7a_100000759471_100000210211 [0,1,0,0,0,0|2,0,0]=3 3522 B13R1.669 CCCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210210 [0,1,0,0,0,0|2,0,0]=3 3523 B13R1.669 CCCCNc1ccc(c(c1)O)F 34a_100012017398_100000210210 [0,1,0,0,0,0|2,0,0]=3 3524 B13R1.669 CCCCNc1ccc(c(c1)O)F 7a_100012017398_100000210211 [0,1,0,0,0,0|2,0,0]=3 3525 B13R1.669 CCCCNc1ccc(c(c1)O)O 34a_100102946323_100000210210 [0,1,0,0,0,0|1,0,0]=2 3526 B13R1.669 CCCCOc1cc(c(cn1)O)C 271570a_203496583355_200013759037 [0,1,0,0,0,0|3,0,0]=4 3527 B13R1.669 CCCCOc1ccc(c(c1)Br)C 34a_100011380479_100000210210 [0,1,0,0,0,0|3,0,0]=4 3528 B13R1.669 CCCCOc1ccc(c(c1)Br)C 7a_100011380479_100000210211 [0,1,0,0,0,0|3,0,0]=4 3529 B13R1.669 CCCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210210 [0,1,0,0,0,0|3,0,0]=4 3530 B13R1.669 CCCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210211 [0,1,0,0,0,0|3,0,0]=4 3531 B13R1.669 CCCCOc1ccc(c(c1)Br)F 34a_100000693481_100000210210 [0,1,0,0,0,0|3,0,0]=4 3532 B13R1.669 CCCCOc1ccc(c(c1)Br)F 7a_100000693481_100000210211 [0,1,0,0,0,0|3,0,0]=4 3533 B13R1.669 CCCCOc1ccc(c(c1)Br)I 34a_100000701344_100000210210 [0,1,0,0,0,0|3,0,0]=4 3534 B13R1.669 CCCCOc1ccc(c(c1)Br)I 7a_100000701344_100000210211 [0,1,0,0,0,0|3,0,0]=4 3535 B13R1.669 CCCCOc1ccc(c(c1)Br)N 34a_100012001276_100000210210 [0,1,0,0,0,0|3,0,0]=4 3536 B13R1.669 CCCCOc1ccc(c(c1)Br)N 7a_100012001276_100000210211 [0,1,0,0,0,0|3,0,0]=4 3537 B13R1.669 CCCCOc1ccc(c(c1)C)Br 34a_100000690111_100000210210 [0,1,0,0,0,0|3,0,0]=4 3538 B13R1.669 CCCCOc1ccc(c(c1)C)Br 7a_100000690111_100000210211 [0,1,0,0,0,0|3,0,0]=4 3539 B13R1.669 CCCCOc1ccc(c(c1)C)C 34a_100000210932_100000210210 [0,1,0,0,0,0|3,0,0]=4 3540 B13R1.669 CCCCOc1ccc(c(c1)C)C 7a_100000210932_100000210211 [0,1,0,0,0,0|3,0,0]=4 3541 B13R1.669 CCCCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210210 [0,1,0,0,0,0|3,0,0]=4 3542 B13R1.669 CCCCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210211 [0,1,0,0,0,0|3,0,0]=4 3543 B13R1.669 CCCCOc1ccc(c(c1)C)F 34a_100000751312_100000210210 [0,1,0,0,0,0|3,0,0]=4 3544 B13R1.669 CCCCOc1ccc(c(c1)C)F 7a_100000751312_100000210211 [0,1,0,0,0,0|3,0,0]=4 3545 B13R1.669 CCCCOc1ccc(c(c1)C)I 34a_100000729255_100000210210 [0,1,0,0,0,0|3,0,0]=4 3546 B13R1.669 CCCCOc1ccc(c(c1)C)I 7a_100000729255_100000210211 [0,1,0,0,0,0|3,0,0]=4 3547 B13R1.669 CCCCOc1ccc(c(c1)C)N 34a_100000756630_100000210210 [0,1,0,0,0,0|3,0,0]=4 3548 B13R1.669 CCCCOc1ccc(c(c1)C)N 7a_100000756630_100000210211 [0,1,0,0,0,0|3,0,0]=4 3549 B13R1.669 CCCCOc1ccc(c(c1)C)O 271570a_203496583355_200012350294 [0,1,0,0,0,0|2,0,0]=3 3550 B13R1.669 CCCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210210 [0,1,0,0,0,0|3,0,0]=4 3551 B13R1.669 CCCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210211 [0,1,0,0,0,0|3,0,0]=4 3552 B13R1.669 CCCCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210210 [0,1,0,0,0,0|3,0,0]=4 3553 B13R1.669 CCCCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210211 [0,1,0,0,0,0|3,0,0]=4 3554 B13R1.669 CCCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210210 [0,1,0,0,0,0|3,0,0]=4 3555 B13R1.669 CCCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210211 [0,1,0,0,0,0|3,0,0]=4 3556 B13R1.669 CCCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210210 [0,1,0,0,0,0|3,0,0]=4 3557 B13R1.669 CCCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210211 [0,1,0,0,0,0|3,0,0]=4 3558 B13R1.669 CCCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210210 [0,1,0,0,0,0|3,0,0]=4 3559 B13R1.669 CCCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210211 [0,1,0,0,0,0|3,0,0]=4 3560 B13R1.669 CCCCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210210 [0,1,0,0,0,0|3,0,0]=4 3561 B13R1.669 CCCCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210211 [0,1,0,0,0,0|3,0,0]=4 3562 B13R1.669 CCCCOc1ccc(c(c1)F)Br 34a_100000755031_100000210210 [0,1,0,0,0,0|3,0,0]=4 3563 B13R1.669 CCCCOc1ccc(c(c1)F)Br 7a_100000755031_100000210211 [0,1,0,0,0,0|3,0,0]=4 3564 B13R1.669 CCCCOc1ccc(c(c1)F)C 34a_100000722560_100000210210 [0,1,0,0,0,0|3,0,0]=4 3565 B13R1.669 CCCCOc1ccc(c(c1)F)C 7a_100000722560_100000210211 [0,1,0,0,0,0|3,0,0]=4 3566 B13R1.669 CCCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210210 [0,1,0,0,0,0|3,0,0]=4 3567 B13R1.669 CCCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210211 [0,1,0,0,0,0|3,0,0]=4 3568 B13R1.669 CCCCOc1ccc(c(c1)F)F 34a_100000181275_100000210210 [0,1,0,0,0,0|3,0,0]=4 3569 B13R1.669 CCCCOc1ccc(c(c1)F)F 7a_100000181275_100000210211 [0,1,0,0,0,0|3,0,0]=4 3570 B13R1.669 CCCCOc1ccc(c(c1)F)I 34a_100009990212_100000210210 [0,1,0,0,0,0|3,0,0]=4 3571 B13R1.669 CCCCOc1ccc(c(c1)F)I 7a_100009990212_100000210211 [0,1,0,0,0,0|3,0,0]=4 3572 B13R1.669 CCCCOc1ccc(c(c1)F)N 34a_100000759473_100000210210 [0,1,0,0,0,0|3,0,0]=4 3573 B13R1.669 CCCCOc1ccc(c(c1)F)N 7a_100000759473_100000210211 [0,1,0,0,0,0|3,0,0]=4 3574 B13R1.669 CCCCOc1ccc(c(c1)F)O 271570a_203496583355_200012236941 [0,1,0,0,0,0|2,0,0]=3 3575 B13R1.669 CCCCOc1ccc(c(c1)I)Br 34a_100012339312_100000210210 [0,1,0,0,0,0|3,0,0]=4 3576 B13R1.669 CCCCOc1ccc(c(c1)I)Br 7a_100012339312_100000210211 [0,1,0,0,0,0|3,0,0]=4 3577 B13R1.669 CCCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210210 [0,1,0,0,0,0|3,0,0]=4 3578 B13R1.669 CCCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210211 [0,1,0,0,0,0|3,0,0]=4 3579 B13R1.669 CCCCOc1ccc(c(c1)I)N 34a_100010084370_100000210210 [0,1,0,0,0,0|3,0,0]=4 3580 B13R1.669 CCCCOc1ccc(c(c1)I)N 7a_100010084370_100000210211 [0,1,0,0,0,0|3,0,0]=4 3581 B13R1.669 CCCCOc1ccc(c(c1)N)Br 34a_100011999798_100000210210 [0,1,0,0,0,0|3,0,0]=4 3582 B13R1.669 CCCCOc1ccc(c(c1)N)Br 7a_100011999798_100000210211 [0,1,0,0,0,0|3,0,0]=4 3583 B13R1.669 CCCCOc1ccc(c(c1)N)C 34a_100011216113_100000210210 [0,1,0,0,0,0|3,0,0]=4 3584 B13R1.669 CCCCOc1ccc(c(c1)N)C 7a_100011216113_100000210211 [0,1,0,0,0,0|3,0,0]=4 3585 B13R1.669 CCCCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210210 [0,1,0,0,0,0|3,0,0]=4 3586 B13R1.669 CCCCOc1ccc(c(c1)N)F 34a_100012017239_100000210210 [0,1,0,0,0,0|3,0,0]=4 3587 B13R1.669 CCCCOc1ccc(c(c1)N)F 7a_100012017239_100000210211 [0,1,0,0,0,0|3,0,0]=4 3588 B13R1.669 CCCCOc1ccc(c(c1)N)N 34a_100025771000_100000210210 [0,1,0,0,0,0|3,0,0]=4 3589 B13R1.669 CCCCSc1c[nH]c(=O)c(c1)O 62a_100000210211_100009814561 [0,1,0,0,0,0|2,0,1]=4 3590 B13R1.669 CCCCSc1cc(c(cn1)C)O 62a_100000210211_100000704368 [0,1,0,0,0,0|3,0,0]=4 3591 B13R1.669 CCCCSc1cc(c(cn1)C)O 62a_100000704368_100000210210 [0,1,0,0,0,0|3,0,0]=4 3592 B13R1.669 CCCCSc1cc(c(cn1)F)O 62a_100000210211_100009854642 [0,1,0,0,0,0|3,0,0]=4 3593 B13R1.669 CCCCSc1cc(c(cn1)F)O 62a_100009854642_100000210210 [0,1,0,0,0,0|3,0,0]=4 3594 B13R1.669 CCCCSc1cc(c(cn1)O)C 62a_100000210211_100000692680 [0,1,0,0,0,0|3,0,0]=4 3595 B13R1.669 CCCCSc1cc(c(cn1)O)N 62a_100000210211_100009819941 [0,1,0,0,0,0|3,0,0]=4 3596 B13R1.669 CCCCSc1cc(c(cn1)O)N 62a_100009819941_100000210210 [0,1,0,0,0,0|3,0,0]=4 3597 B13R1.669 CCCCSc1ccc(c(c1)Br)C 62a_100000210211_100011847877 [0,1,0,0,0,0|3,0,0]=4 3598 B13R1.669 CCCCSc1ccc(c(c1)Br)C 62a_100011847877_100000210210 [0,1,0,0,0,0|3,0,0]=4 3599 B13R1.669 CCCCSc1ccc(c(c1)Br)Cl 62a_100000210211_100012353702 [0,1,0,0,0,0|3,0,0]=4 3600 B13R1.669 CCCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210210 [0,1,0,0,0,0|3,0,0]=4 3601 B13R1.669 CCCCSc1ccc(c(c1)Br)F 62a_100000210211_100012047266 [0,1,0,0,0,0|3,0,0]=4 3602 B13R1.669 CCCCSc1ccc(c(c1)Br)F 62a_100012047266_100000210210 [0,1,0,0,0,0|3,0,0]=4 3603 B13R1.669 CCCCSc1ccc(c(c1)Br)N 62a_100000210211_100000750455 [0,1,0,0,0,0|3,0,0]=4 3604 B13R1.669 CCCCSc1ccc(c(c1)Br)N 62a_100000750455_100000210210 [0,1,0,0,0,0|3,0,0]=4 3605 B13R1.669 CCCCSc1ccc(c(c1)Br)O 62a_100000210211_100012361655 [0,1,0,0,0,0|2,0,0]=3 3606 B13R1.669 CCCCSc1ccc(c(c1)Br)O 62a_100012361655_100000210210 [0,1,0,0,0,0|2,0,0]=3 3607 B13R1.669 CCCCSc1ccc(c(c1)C)Br 62a_100000210211_100009813585 [0,1,0,0,0,0|3,0,0]=4 3608 B13R1.669 CCCCSc1ccc(c(c1)C)Br 62a_100009813585_100000210210 [0,1,0,0,0,0|3,0,0]=4 3609 B13R1.669 CCCCSc1ccc(c(c1)C)C 62a_100000210211_100011215607 [0,1,0,0,0,0|3,0,0]=4 3610 B13R1.669 CCCCSc1ccc(c(c1)C)C 62a_100011215607_100000210210 [0,1,0,0,0,0|3,0,0]=4 3611 B13R1.669 CCCCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210210 [0,1,0,0,0,0|3,0,0]=4 3612 B13R1.669 CCCCSc1ccc(c(c1)C)Cl 62a_100000210211_100000049509 [0,1,0,0,0,0|3,0,0]=4 3613 B13R1.669 CCCCSc1ccc(c(c1)C)F 62a_100000210211_100011218330 [0,1,0,0,0,0|3,0,0]=4 3614 B13R1.669 CCCCSc1ccc(c(c1)C)F 62a_100011218330_100000210210 [0,1,0,0,0,0|3,0,0]=4 3615 B13R1.669 CCCCSc1ccc(c(c1)C)N 62a_100000210211_100000211769 [0,1,0,0,0,0|3,0,0]=4 3616 B13R1.669 CCCCSc1ccc(c(c1)C)N 62a_100000211769_100000210210 [0,1,0,0,0,0|3,0,0]=4 3617 B13R1.669 CCCCSc1ccc(c(c1)C)O 62a_100000210211_100000186361 [0,1,0,0,0,0|2,0,0]=3 3618 B13R1.669 CCCCSc1ccc(c(c1)Cl)Br 62a_100000210211_100012047281 [0,1,0,0,0,0|3,0,0]=4 3619 B13R1.669 CCCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210210 [0,1,0,0,0,0|3,0,0]=4 3620 B13R1.669 CCCCSc1ccc(c(c1)Cl)C 62a_100000210211_100011216363 [0,1,0,0,0,0|3,0,0]=4 3621 B13R1.669 CCCCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210210 [0,1,0,0,0,0|3,0,0]=4 3622 B13R1.669 CCCCSc1ccc(c(c1)Cl)Cl 62a_100000210211_100011214914 [0,1,0,0,0,0|3,0,0]=4 3623 B13R1.669 CCCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210210 [0,1,0,0,0,0|3,0,0]=4 3624 B13R1.669 CCCCSc1ccc(c(c1)Cl)F 62a_100000210211_100011215976 [0,1,0,0,0,0|3,0,0]=4 3625 B13R1.669 CCCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210210 [0,1,0,0,0,0|3,0,0]=4 3626 B13R1.669 CCCCSc1ccc(c(c1)Cl)N 62a_100000210211_100011218065 [0,1,0,0,0,0|3,0,0]=4 3627 B13R1.669 CCCCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210210 [0,1,0,0,0,0|3,0,0]=4 3628 B13R1.669 CCCCSc1ccc(c(c1)Cl)O 62a_100000210211_100012360047 [0,1,0,0,0,0|2,0,0]=3 3629 B13R1.669 CCCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210210 [0,1,0,0,0,0|2,0,0]=3 3630 B13R1.669 CCCCSc1ccc(c(c1)F)Br 62a_100000210211_100000685389 [0,1,0,0,0,0|3,0,0]=4 3631 B13R1.669 CCCCSc1ccc(c(c1)F)Br 62a_100000685389_100000210210 [0,1,0,0,0,0|3,0,0]=4 3632 B13R1.669 CCCCSc1ccc(c(c1)F)C 62a_100000210211_100000720648 [0,1,0,0,0,0|3,0,0]=4 3633 B13R1.669 CCCCSc1ccc(c(c1)F)C 62a_100000720648_100000210210 [0,1,0,0,0,0|3,0,0]=4 3634 B13R1.669 CCCCSc1ccc(c(c1)F)Cl 62a_100000210211_100011216805 [0,1,0,0,0,0|3,0,0]=4 3635 B13R1.669 CCCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210210 [0,1,0,0,0,0|3,0,0]=4 3636 B13R1.669 CCCCSc1ccc(c(c1)F)F 62a_100000210211_100000703953 [0,1,0,0,0,0|3,0,0]=4 3637 B13R1.669 CCCCSc1ccc(c(c1)F)F 62a_100000703953_100000210210 [0,1,0,0,0,0|3,0,0]=4 3638 B13R1.669 CCCCSc1ccc(c(c1)F)N 62a_100000210211_100011215594 [0,1,0,0,0,0|3,0,0]=4 3639 B13R1.669 CCCCSc1ccc(c(c1)F)N 62a_100011215594_100000210210 [0,1,0,0,0,0|3,0,0]=4 3640 B13R1.669 CCCCSc1ccc(c(c1)F)O 62a_100000185481_100000210210 [0,1,0,0,0,0|2,0,0]=3 3641 B13R1.669 CCCCSc1ccc(c(c1)F)O 62a_100000210211_100000185481 [0,1,0,0,0,0|2,0,0]=3 3642 B13R1.669 CCCCSc1ccc(c(c1)N)Br 62a_100000210211_100000750456 [0,1,0,0,0,0|3,0,0]=4 3643 B13R1.669 CCCCSc1ccc(c(c1)N)Br 62a_100000750456_100000210210 [0,1,0,0,0,0|3,0,0]=4 3644 B13R1.669 CCCCSc1ccc(c(c1)N)C 62a_100000210211_100000761890 [0,1,0,0,0,0|3,0,0]=4 3645 B13R1.669 CCCCSc1ccc(c(c1)N)C 62a_100000761890_100000210210 [0,1,0,0,0,0|3,0,0]=4 3646 B13R1.669 CCCCSc1ccc(c(c1)N)Cl 62a_100000210211_200000761891 [0,1,0,0,0,0|3,0,0]=4 3647 B13R1.669 CCCCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210210 [0,1,0,0,0,0|3,0,0]=4 3648 B13R1.669 CCCCSc1ccc(c(c1)N)F 62a_100000210211_100000740924 [0,1,0,0,0,0|3,0,0]=4 3649 B13R1.669 CCCCSc1ccc(c(c1)N)F 62a_100000740924_100000210210 [0,1,0,0,0,0|3,0,0]=4 3650 B13R1.669 CCCCSc1ccc(c(c1)N)N 62a_100000210211_100011534411 [0,1,0,0,0,0|3,0,0]=4 3651 B13R1.669 CCCCSc1ccc(c(c1)N)N 62a_100000741789_100000210210 [0,1,0,0,0,0|3,0,0]=4 3652 B13R1.669 CCCCSc1ccc(c(c1)N)O 62a_100000210211_100000752626 [0,1,0,0,0,0|2,0,0]=3 3653 B13R1.669 CCCCSc1ccc(c(c1)N)O 62a_100000752626_100000210210 [0,1,0,0,0,0|2,0,0]=3 3654 B13R1.669 CCCCSc1ccc(c(c1)O)Br 62a_100000210211_100012356990 [0,1,0,0,0,0|2,0,0]=3 3655 B13R1.669 CCCCSc1ccc(c(c1)O)Br 62a_100012356990_100000210210 [0,1,0,0,0,0|2,0,0]=3 3656 B13R1.669 CCCCSc1ccc(c(c1)O)C 62a_100000210211_100000685420 [0,1,0,0,0,0|2,0,0]=3 3657 B13R1.669 CCCCSc1ccc(c(c1)O)C 62a_100000685420_100000210210 [0,1,0,0,0,0|2,0,0]=3 3658 B13R1.669 CCCCSc1ccc(c(c1)O)Cl 62a_100000210211_100011356854 [0,1,0,0,0,0|2,0,0]=3 3659 B13R1.669 CCCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210210 [0,1,0,0,0,0|2,0,0]=3 3660 B13R1.669 CCCCSc1ccc(c(c1)O)F 62a_100000210211_100000686035 [0,1,0,0,0,0|2,0,0]=3 3661 B13R1.669 CCCCSc1ccc(c(c1)O)F 62a_100000686035_100000210210 [0,1,0,0,0,0|2,0,0]=3 3662 B13R1.669 CCCCSc1ccc(c(c1)O)N 62a_100000210211_100000739049 [0,1,0,0,0,0|2,0,0]=3 3663 B13R1.669 CCCCSc1ccc(c(c1)O)N 62a_100000739049_100000210210 [0,1,0,0,0,0|2,0,0]=3 3664 B13R1.669 CCCCSc1ccc(c(c1)O)O 62a_100000210211_100009813601 [0,1,0,0,0,0|1,0,0]=2 3665 B13R1.669 CCCCSc1ccc(c(n1)Br)O 62a_100000210211_100000725334 [0,1,0,0,0,0|3,0,0]=4 3666 B13R1.669 CCCCSc1ccc(c(n1)Br)O 62a_100000725334_100000210210 [0,1,0,0,0,0|3,0,0]=4 3667 B13R1.669 CCCCSc1ccc(c(n1)C)O 62a_100000210211_100010233687 [0,1,0,0,0,0|3,0,0]=4 3668 B13R1.669 CCCCSc1ccc(c(n1)C)O 62a_100010233687_100000210210 [0,1,0,0,0,0|3,0,0]=4 3669 B13R1.669 CCCCSc1ccc(c(n1)Cl)O 62a_100000210211_100000721234 [0,1,0,0,0,0|3,0,0]=4 3670 B13R1.669 CCCCSc1ccc(c(n1)F)O 62a_100000210211_100009819667 [0,1,0,0,0,0|3,0,0]=4 3671 B13R1.669 CCCCSc1ccc(c(n1)F)O 62a_100009819667_100000210210 [0,1,0,0,0,0|3,0,0]=4 3672 B13R1.669 CCCCSc1ccc(c(n1)N)O 62a_100000210211_100000685527 [0,1,0,0,0,0|3,0,0]=4 3673 B13R1.669 CCCCSc1ccc(c(n1)N)O 62a_100000685527_100000210210 [0,1,0,0,0,0|3,0,0]=4 3674 B13R1.669 CCCCSc1ccc(c(n1)O)F 62a_100000210211_100010729010 [0,1,0,0,0,0|3,0,0]=4 3675 B13R1.669 CCCCSc1ccc(c(n1)O)N 62a_100000718904_100000210210 [0,1,0,0,0,0|3,0,0]=4 3676 B13R1.669 CCCCSc1cnc(c(c1)C)O 62a_100000210211_100000685391 [0,1,0,0,0,0|3,0,0]=4 3677 B13R1.669 CCCCSc1cnc(c(c1)C)O 62a_100000685391_100000210210 [0,1,0,0,0,0|3,0,0]=4 3678 B13R1.669 CCCCSc1cnc(c(c1)Cl)O 62a_100000210211_100010238531 [0,1,0,0,0,0|3,0,0]=4 3679 B13R1.669 CCCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210210 [0,1,0,0,0,0|3,0,0]=4 3680 B13R1.669 CCCCSc1cnc(c(c1)N)O 62a_100000210211_100000743729 [0,1,0,0,0,0|3,0,0]=4 3681 B13R1.669 CCCCSc1cnc(c(c1)N)O 62a_100000743729_100000210210 [0,1,0,0,0,0|3,0,0]=4 3682 B13R1.669 CCCCSc1cnc(c(c1)O)C 62a_100000210211_100009864810 [0,1,0,0,0,0|3,0,0]=4 3683 B13R1.669 CCCCSc1cnc(c(c1)O)C 62a_100009864810_100000210210 [0,1,0,0,0,0|3,0,0]=4 3684 B13R1.669 CCCCSc1cnc(c(c1)O)F 62a_100000210211_100009819871 [0,1,0,0,0,0|3,0,0]=4 3685 B13R1.669 CCCCSc1cnc(c(c1)O)F 62a_100009819871_100000210210 [0,1,0,0,0,0|3,0,0]=4 3686 B13R1.669 CCCCSc1cnc(c(c1)O)N 62a_100000210211_100009819042 [0,1,0,0,0,0|3,0,0]=4 3687 B13R1.669 CCCCSc1cnc(c(c1)O)N 62a_100009819042_100000210210 [0,1,0,0,0,0|3,0,0]=4 3688 B13R1.669 CCCNCc1ccc(c(c1)Br)Br 207a_100020643023_100011215943 [0,1,0,0,0,0|3,0,0]=4 3689 B13R1.669 CCCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000210303 [0,1,0,0,0,0|3,0,0]=4 3690 B13R1.669 CCCNCc1ccc(c(c1)Br)Br 270004a_100020643023_100011215943 [0,1,0,0,0,0|3,0,0]=4 3691 B13R1.669 CCCNCc1ccc(c(c1)Br)Br 34a_100012351559_100000210303 [0,1,0,0,0,0|3,0,0]=4 3692 B13R1.669 CCCNCc1ccc(c(c1)Br)C 207a_100020643023_100000695567 [0,1,0,0,0,0|3,0,0]=4 3693 B13R1.669 CCCNCc1ccc(c(c1)Br)C 270004a_100020643023_100000695567 [0,1,0,0,0,0|3,0,0]=4 3694 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 207a_100020643023_100000693810 [0,1,0,0,0,0|3,0,0]=4 3695 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000210303 [0,1,0,0,0,0|3,0,0]=4 3696 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 270004a_100020643023_100000693810 [0,1,0,0,0,0|3,0,0]=4 3697 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000210303 [0,1,0,0,0,0|3,0,0]=4 3698 B13R1.669 CCCNCc1ccc(c(c1)Br)F 207a_100020643023_100000211747 [0,1,0,0,0,0|3,0,0]=4 3699 B13R1.669 CCCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000210303 [0,1,0,0,0,0|3,0,0]=4 3700 B13R1.669 CCCNCc1ccc(c(c1)Br)F 270004a_100020643023_100000211747 [0,1,0,0,0,0|3,0,0]=4 3701 B13R1.669 CCCNCc1ccc(c(c1)Br)F 34a_100015193890_100000210303 [0,1,0,0,0,0|3,0,0]=4 3702 B13R1.669 CCCNCc1ccc(c(c1)C)Br 207a_100020643023_100000765772 [0,1,0,0,0,0|3,0,0]=4 3703 B13R1.669 CCCNCc1ccc(c(c1)C)Br 2230a_100015205234_100000210303 [0,1,0,0,0,0|3,0,0]=4 3704 B13R1.669 CCCNCc1ccc(c(c1)C)Br 270004a_100020643023_100000765772 [0,1,0,0,0,0|3,0,0]=4 3705 B13R1.669 CCCNCc1ccc(c(c1)C)Br 34a_100015205234_100000210303 [0,1,0,0,0,0|3,0,0]=4 3706 B13R1.669 CCCNCc1ccc(c(c1)C)C 207a_100020643023_100000229942 [0,1,0,0,0,0|3,0,0]=4 3707 B13R1.669 CCCNCc1ccc(c(c1)C)C 2230a_100025706692_100000210303 [0,1,0,0,0,0|3,0,0]=4 3708 B13R1.669 CCCNCc1ccc(c(c1)C)C 270004a_100020643023_100000229942 [0,1,0,0,0,0|3,0,0]=4 3709 B13R1.669 CCCNCc1ccc(c(c1)C)C 34a_100025706692_100000210303 [0,1,0,0,0,0|3,0,0]=4 3710 B13R1.669 CCCNCc1ccc(c(c1)C)Cl 207a_100020643023_100000698814 [0,1,0,0,0,0|3,0,0]=4 3711 B13R1.669 CCCNCc1ccc(c(c1)C)Cl 270004a_100020643023_100000698814 [0,1,0,0,0,0|3,0,0]=4 3712 B13R1.669 CCCNCc1ccc(c(c1)C)F 207a_100020643023_100000748208 [0,1,0,0,0,0|3,0,0]=4 3713 B13R1.669 CCCNCc1ccc(c(c1)C)F 2230a_100000239911_100000210303 [0,1,0,0,0,0|3,0,0]=4 3714 B13R1.669 CCCNCc1ccc(c(c1)C)F 270004a_100020643023_100000748208 [0,1,0,0,0,0|3,0,0]=4 3715 B13R1.669 CCCNCc1ccc(c(c1)C)F 34a_100000239911_100000210303 [0,1,0,0,0,0|3,0,0]=4 3716 B13R1.669 CCCNCc1ccc(c(c1)Cl)Br 207a_100020643023_100000690054 [0,1,0,0,0,0|3,0,0]=4 3717 B13R1.669 CCCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000210303 [0,1,0,0,0,0|3,0,0]=4 3718 B13R1.669 CCCNCc1ccc(c(c1)Cl)Br 270004a_100020643023_100000690054 [0,1,0,0,0,0|3,0,0]=4 3719 B13R1.669 CCCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100000210303 [0,1,0,0,0,0|3,0,0]=4 3720 B13R1.669 CCCNCc1ccc(c(c1)Cl)C 207a_100020643023_100000760539 [0,1,0,0,0,0|3,0,0]=4 3721 B13R1.669 CCCNCc1ccc(c(c1)Cl)C 2230a_102495364989_100000210303 [0,1,0,0,0,0|3,0,0]=4 3722 B13R1.669 CCCNCc1ccc(c(c1)Cl)C 270004a_100020643023_100000760539 [0,1,0,0,0,0|3,0,0]=4 3723 B13R1.669 CCCNCc1ccc(c(c1)Cl)C 34a_102495364989_100000210303 [0,1,0,0,0,0|3,0,0]=4 3724 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 207a_100020643023_100000188533 [0,1,0,0,0,0|3,0,0]=4 3725 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000210303 [0,1,0,0,0,0|3,0,0]=4 3726 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 270004a_100020643023_100000188533 [0,1,0,0,0,0|3,0,0]=4 3727 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000210303 [0,1,0,0,0,0|3,0,0]=4 3728 B13R1.669 CCCNCc1ccc(c(c1)Cl)F 207a_100020643023_100000742290 [0,1,0,0,0,0|3,0,0]=4 3729 B13R1.669 CCCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000210303 [0,1,0,0,0,0|3,0,0]=4 3730 B13R1.669 CCCNCc1ccc(c(c1)Cl)F 270004a_100020643023_100000742290 [0,1,0,0,0,0|3,0,0]=4 3731 B13R1.669 CCCNCc1ccc(c(c1)Cl)F 34a_100000749334_100000210303 [0,1,0,0,0,0|3,0,0]=4 3732 B13R1.669 CCCNCc1ccc(c(c1)F)Br 207a_100020643023_100000686674 [0,1,0,0,0,0|3,0,0]=4 3733 B13R1.669 CCCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000210303 [0,1,0,0,0,0|3,0,0]=4 3734 B13R1.669 CCCNCc1ccc(c(c1)F)Br 270004a_100020643023_100000686674 [0,1,0,0,0,0|3,0,0]=4 3735 B13R1.669 CCCNCc1ccc(c(c1)F)Br 34a_100000755036_100000210303 [0,1,0,0,0,0|3,0,0]=4 3736 B13R1.669 CCCNCc1ccc(c(c1)F)C 207a_100020643023_100000753222 [0,1,0,0,0,0|3,0,0]=4 3737 B13R1.669 CCCNCc1ccc(c(c1)F)C 2230a_100102708794_100000210303 [0,1,0,0,0,0|3,0,0]=4 3738 B13R1.669 CCCNCc1ccc(c(c1)F)C 270004a_100020643023_100000753222 [0,1,0,0,0,0|3,0,0]=4 3739 B13R1.669 CCCNCc1ccc(c(c1)F)C 34a_100102708794_100000210303 [0,1,0,0,0,0|3,0,0]=4 3740 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 207a_100020643023_100000745630 [0,1,0,0,0,0|3,0,0]=4 3741 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000210303 [0,1,0,0,0,0|3,0,0]=4 3742 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 270004a_100020643023_100000745630 [0,1,0,0,0,0|3,0,0]=4 3743 B13R1.669 CCCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000210303 [0,1,0,0,0,0|3,0,0]=4 3744 B13R1.669 CCCNCc1ccc(c(c1)F)F 207a_100020643023_100000211062 [0,1,0,0,0,0|3,0,0]=4 3745 B13R1.669 CCCNCc1ccc(c(c1)F)F 2230a_100000737897_100000210303 [0,1,0,0,0,0|3,0,0]=4 3746 B13R1.669 CCCNCc1ccc(c(c1)F)F 270004a_100020643023_100000211062 [0,1,0,0,0,0|3,0,0]=4 3747 B13R1.669 CCCNCc1ccc(c(c1)F)F 34a_100000737897_100000210303 [0,1,0,0,0,0|3,0,0]=4 3748 B13R1.669 CCCNCc1ccc(c(c1)F)I 207a_100020643023_100000050832 [0,1,0,0,0,0|3,0,0]=4 3749 B13R1.669 CCCNCc1ccc(c(c1)F)I 270004a_100020643023_100000050832 [0,1,0,0,0,0|3,0,0]=4 3750 B13R1.669 CCCNCc1ccc(c(c1)F)O 34a_100000758358_100000210303 [0,1,0,0,0,0|2,0,0]=3 3751 B13R1.669 CCCNCc1ccc(c(c1)I)Br 207a_100020643023_100010146563 [0,1,0,0,0,0|3,0,0]=4 3752 B13R1.669 CCCNCc1ccc(c(c1)I)Br 270004a_100020643023_100010146563 [0,1,0,0,0,0|3,0,0]=4 3753 B13R1.669 CCCNCc1ccc(c(c1)I)C 207a_100020643023_100010197721 [0,1,0,0,0,0|3,0,0]=4 3754 B13R1.669 CCCNCc1ccc(c(c1)I)C 270004a_100020643023_100010197721 [0,1,0,0,0,0|3,0,0]=4 3755 B13R1.669 CCCNCc1ccc(c(c1)I)Cl 207a_100020643023_100010209939 [0,1,0,0,0,0|3,0,0]=4 3756 B13R1.669 CCCNCc1ccc(c(c1)I)Cl 270004a_100020643023_100010209939 [0,1,0,0,0,0|3,0,0]=4 3757 B13R1.669 CCCNCc1ccc(c(c1)I)F 207a_100020643023_100010188209 [0,1,0,0,0,0|3,0,0]=4 3758 B13R1.669 CCCNCc1ccc(c(c1)I)F 270004a_100020643023_100010188209 [0,1,0,0,0,0|3,0,0]=4 3759 B13R1.669 CCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210303 [0,1,0,0,0,0|2,0,0]=3 3760 B13R1.669 CCCNCc1ccc(c(c1)O)F 34a_100160469508_100000210303 [0,1,0,0,0,0|2,0,0]=3 3761 B13R1.669 CCCNCc1ccc(c(c1)O)O 34a_100000010075_100000210303 [0,1,0,0,0,0|1,0,0]=2 3762 B13R1.669 CCCNCc1cnc(c(c1)Br)O 207a_100020643023_100010064886 [0,1,0,0,0,0|3,0,0]=4 3763 B13R1.669 CCCNCc1cnc(c(c1)Br)O 270004a_100020643023_100010064886 [0,1,0,0,0,0|3,0,0]=4 3764 B13R1.669 CCCOCc1ccc(c(c1)Br)Br 34a_100000210258_100012353900 [0,1,0,0,0,0|3,0,0]=4 3765 B13R1.669 CCCOCc1ccc(c(c1)Br)C 34a_100000210258_100012232412 [0,1,0,0,0,0|3,0,0]=4 3766 B13R1.669 CCCOCc1ccc(c(c1)Br)C 34a_100000708995_100000210303 [0,1,0,0,0,0|3,0,0]=4 3767 B13R1.669 CCCOCc1ccc(c(c1)Br)C 7a_100000708995_100000210303 [0,1,0,0,0,0|3,0,0]=4 3768 B13R1.669 CCCOCc1ccc(c(c1)Br)Cl 34a_100000210258_100012353894 [0,1,0,0,0,0|3,0,0]=4 3769 B13R1.669 CCCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100000210303 [0,1,0,0,0,0|3,0,0]=4 3770 B13R1.669 CCCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000210303 [0,1,0,0,0,0|3,0,0]=4 3771 B13R1.669 CCCOCc1ccc(c(c1)Br)F 34a_100000210258_100011206884 [0,1,0,0,0,0|3,0,0]=4 3772 B13R1.669 CCCOCc1ccc(c(c1)Br)F 34a_100000246287_100000210303 [0,1,0,0,0,0|3,0,0]=4 3773 B13R1.669 CCCOCc1ccc(c(c1)Br)F 7a_100000246287_100000210303 [0,1,0,0,0,0|3,0,0]=4 3774 B13R1.669 CCCOCc1ccc(c(c1)C)Br 34a_100000210258_100000727479 [0,1,0,0,0,0|3,0,0]=4 3775 B13R1.669 CCCOCc1ccc(c(c1)C)Br 34a_100000718852_100000210303 [0,1,0,0,0,0|3,0,0]=4 3776 B13R1.669 CCCOCc1ccc(c(c1)C)Br 7a_100000718852_100000210303 [0,1,0,0,0,0|3,0,0]=4 3777 B13R1.669 CCCOCc1ccc(c(c1)C)C 34a_100000210258_100000742320 [0,1,0,0,0,0|3,0,0]=4 3778 B13R1.669 CCCOCc1ccc(c(c1)C)C 34a_100011215342_100000210303 [0,1,0,0,0,0|3,0,0]=4 3779 B13R1.669 CCCOCc1ccc(c(c1)C)C 7a_100011215342_100000210303 [0,1,0,0,0,0|3,0,0]=4 3780 B13R1.669 CCCOCc1ccc(c(c1)C)Cl 34a_100000210258_100012184735 [0,1,0,0,0,0|3,0,0]=4 3781 B13R1.669 CCCOCc1ccc(c(c1)C)F 34a_100000210258_100011216667 [0,1,0,0,0,0|3,0,0]=4 3782 B13R1.669 CCCOCc1ccc(c(c1)C)F 34a_100011219793_100000210303 [0,1,0,0,0,0|3,0,0]=4 3783 B13R1.669 CCCOCc1ccc(c(c1)C)F 7a_100011219793_100000210303 [0,1,0,0,0,0|3,0,0]=4 3784 B13R1.669 CCCOCc1ccc(c(c1)C)N 34a_200011997030_100000210303 [0,1,0,0,0,0|3,0,0]=4 3785 B13R1.669 CCCOCc1ccc(c(c1)Cl)Br 34a_100000210258_100012353895 [0,1,0,0,0,0|3,0,0]=4 3786 B13R1.669 CCCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100000210303 [0,1,0,0,0,0|3,0,0]=4 3787 B13R1.669 CCCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100000210303 [0,1,0,0,0,0|3,0,0]=4 3788 B13R1.669 CCCOCc1ccc(c(c1)Cl)C 34a_100000210258_100011823929 [0,1,0,0,0,0|3,0,0]=4 3789 B13R1.669 CCCOCc1ccc(c(c1)Cl)C 34a_100011290783_100000210303 [0,1,0,0,0,0|3,0,0]=4 3790 B13R1.669 CCCOCc1ccc(c(c1)Cl)C 7a_100011290783_100000210303 [0,1,0,0,0,0|3,0,0]=4 3791 B13R1.669 CCCOCc1ccc(c(c1)Cl)Cl 34a_100000210258_100000184707 [0,1,0,0,0,0|3,0,0]=4 3792 B13R1.669 CCCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100000210303 [0,1,0,0,0,0|3,0,0]=4 3793 B13R1.669 CCCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000210303 [0,1,0,0,0,0|3,0,0]=4 3794 B13R1.669 CCCOCc1ccc(c(c1)Cl)F 34a_100000210258_100011934319 [0,1,0,0,0,0|3,0,0]=4 3795 B13R1.669 CCCOCc1ccc(c(c1)Cl)F 34a_100011217911_100000210303 [0,1,0,0,0,0|3,0,0]=4 3796 B13R1.669 CCCOCc1ccc(c(c1)Cl)F 7a_100011217911_100000210303 [0,1,0,0,0,0|3,0,0]=4 3797 B13R1.669 CCCOCc1ccc(c(c1)Cl)I 34a_100000210258_100012349665 [0,1,0,0,0,0|3,0,0]=4 3798 B13R1.669 CCCOCc1ccc(c(c1)Cl)I 34a_100000718186_100000210303 [0,1,0,0,0,0|3,0,0]=4 3799 B13R1.669 CCCOCc1ccc(c(c1)Cl)I 7a_100000718186_100000210303 [0,1,0,0,0,0|3,0,0]=4 3800 B13R1.669 CCCOCc1ccc(c(c1)F)Br 34a_100000210258_100000767054 [0,1,0,0,0,0|3,0,0]=4 3801 B13R1.669 CCCOCc1ccc(c(c1)F)Br 34a_100011533735_100000210303 [0,1,0,0,0,0|3,0,0]=4 3802 B13R1.669 CCCOCc1ccc(c(c1)F)Br 7a_100011533735_100000210303 [0,1,0,0,0,0|3,0,0]=4 3803 B13R1.669 CCCOCc1ccc(c(c1)F)C 34a_100000210258_100011217369 [0,1,0,0,0,0|3,0,0]=4 3804 B13R1.669 CCCOCc1ccc(c(c1)F)C 34a_100000702247_100000210303 [0,1,0,0,0,0|3,0,0]=4 3805 B13R1.669 CCCOCc1ccc(c(c1)F)C 7a_100000702247_100000210303 [0,1,0,0,0,0|3,0,0]=4 3806 B13R1.669 CCCOCc1ccc(c(c1)F)Cl 34a_100000210258_100011519011 [0,1,0,0,0,0|3,0,0]=4 3807 B13R1.669 CCCOCc1ccc(c(c1)F)Cl 34a_100011218299_100000210303 [0,1,0,0,0,0|3,0,0]=4 3808 B13R1.669 CCCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000210303 [0,1,0,0,0,0|3,0,0]=4 3809 B13R1.669 CCCOCc1ccc(c(c1)F)F 34a_100000210258_100000757363 [0,1,0,0,0,0|3,0,0]=4 3810 B13R1.669 CCCOCc1ccc(c(c1)F)F 34a_100011215442_100000210303 [0,1,0,0,0,0|3,0,0]=4 3811 B13R1.669 CCCOCc1ccc(c(c1)F)F 7a_100011215442_100000210303 [0,1,0,0,0,0|3,0,0]=4 3812 B13R1.669 CCCOCc1ccc(c(c1)F)I 34a_100000210258_100010149604 [0,1,0,0,0,0|3,0,0]=4 3813 B13R1.669 CCCOCc1ccc(c(c1)F)I 34a_100010149597_100000210303 [0,1,0,0,0,0|3,0,0]=4 3814 B13R1.669 CCCOCc1ccc(c(c1)F)I 7a_100010149597_100000210303 [0,1,0,0,0,0|3,0,0]=4 3815 B13R1.669 CCCOCc1ccc(c(c1)F)N 34a_100011217239_100000210303 [0,1,0,0,0,0|3,0,0]=4 3816 B13R1.669 CCCOCc1ccc(c(c1)I)Br 34a_100000210258_100010146616 [0,1,0,0,0,0|3,0,0]=4 3817 B13R1.669 CCCOCc1ccc(c(c1)I)C 34a_100000050133_100000210303 [0,1,0,0,0,0|3,0,0]=4 3818 B13R1.669 CCCOCc1ccc(c(c1)I)C 34a_100000210258_100010206137 [0,1,0,0,0,0|3,0,0]=4 3819 B13R1.669 CCCOCc1ccc(c(c1)I)C 7a_100000050133_100000210303 [0,1,0,0,0,0|3,0,0]=4 3820 B13R1.669 CCCOCc1ccc(c(c1)I)F 34a_100000049585_100000210303 [0,1,0,0,0,0|3,0,0]=4 3821 B13R1.669 CCCOCc1ccc(c(c1)I)F 34a_100000210258_100010188208 [0,1,0,0,0,0|3,0,0]=4 3822 B13R1.669 CCCOCc1ccc(c(c1)I)F 7a_100000049585_100000210303 [0,1,0,0,0,0|3,0,0]=4 3823 B13R1.669 CCCOCc1ccc(c(c1)N)Br 34a_100012347568_100000210303 [0,1,0,0,0,0|3,0,0]=4 3824 B13R1.669 CCCOCc1ccc(c(c1)N)C 34a_100000758420_100000210303 [0,1,0,0,0,0|3,0,0]=4 3825 B13R1.669 CCCOCc1ccc(c(c1)N)Cl 34a_106256033963_100000210303 [0,1,0,0,0,0|3,0,0]=4 3826 B13R1.669 CCCOCc1ccc(c(c1)N)F 34a_102125399562_100000210303 [0,1,0,0,0,0|3,0,0]=4 3827 B13R1.669 CCCSCc1cc(=O)c(co1)O 62a_100000210303_100000010605 [0,1,0,0,0,0|2,0,1]=4 3828 B13R1.669 CCCSCc1ccc(c(c1)Br)Br 62a_100000210303_100012353900 [0,1,0,0,0,0|3,0,0]=4 3829 B13R1.669 CCCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000210303 [0,1,0,0,0,0|3,0,0]=4 3830 B13R1.669 CCCSCc1ccc(c(c1)Br)C 62a_100000210303_100012232412 [0,1,0,0,0,0|3,0,0]=4 3831 B13R1.669 CCCSCc1ccc(c(c1)Br)C 62a_100012232412_100000210303 [0,1,0,0,0,0|3,0,0]=4 3832 B13R1.669 CCCSCc1ccc(c(c1)Br)Cl 62a_100000210303_100012353894 [0,1,0,0,0,0|3,0,0]=4 3833 B13R1.669 CCCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000210303 [0,1,0,0,0,0|3,0,0]=4 3834 B13R1.669 CCCSCc1ccc(c(c1)Br)F 62a_100000210303_100011206884 [0,1,0,0,0,0|3,0,0]=4 3835 B13R1.669 CCCSCc1ccc(c(c1)Br)F 62a_100011206884_100000210303 [0,1,0,0,0,0|3,0,0]=4 3836 B13R1.669 CCCSCc1ccc(c(c1)C)Br 62a_100000210303_100000727479 [0,1,0,0,0,0|3,0,0]=4 3837 B13R1.669 CCCSCc1ccc(c(c1)C)Br 62a_100000727479_100000210303 [0,1,0,0,0,0|3,0,0]=4 3838 B13R1.669 CCCSCc1ccc(c(c1)C)C 62a_100000210303_100000742320 [0,1,0,0,0,0|3,0,0]=4 3839 B13R1.669 CCCSCc1ccc(c(c1)C)C 62a_100000742320_100000210303 [0,1,0,0,0,0|3,0,0]=4 3840 B13R1.669 CCCSCc1ccc(c(c1)C)Cl 62a_100000210303_100012184735 [0,1,0,0,0,0|3,0,0]=4 3841 B13R1.669 CCCSCc1ccc(c(c1)C)Cl 62a_100012184735_100000210303 [0,1,0,0,0,0|3,0,0]=4 3842 B13R1.669 CCCSCc1ccc(c(c1)C)F 62a_100000210303_100011216667 [0,1,0,0,0,0|3,0,0]=4 3843 B13R1.669 CCCSCc1ccc(c(c1)C)F 62a_100011216667_100000210303 [0,1,0,0,0,0|3,0,0]=4 3844 B13R1.669 CCCSCc1ccc(c(c1)Cl)Br 62a_100000210303_100012353895 [0,1,0,0,0,0|3,0,0]=4 3845 B13R1.669 CCCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000210303 [0,1,0,0,0,0|3,0,0]=4 3846 B13R1.669 CCCSCc1ccc(c(c1)Cl)C 62a_100000210303_100011823929 [0,1,0,0,0,0|3,0,0]=4 3847 B13R1.669 CCCSCc1ccc(c(c1)Cl)C 62a_100011823929_100000210303 [0,1,0,0,0,0|3,0,0]=4 3848 B13R1.669 CCCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000210303 [0,1,0,0,0,0|3,0,0]=4 3849 B13R1.669 CCCSCc1ccc(c(c1)Cl)Cl 62a_100000210303_100000184707 [0,1,0,0,0,0|3,0,0]=4 3850 B13R1.669 CCCSCc1ccc(c(c1)Cl)F 62a_100000210303_100011934319 [0,1,0,0,0,0|3,0,0]=4 3851 B13R1.669 CCCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000210303 [0,1,0,0,0,0|3,0,0]=4 3852 B13R1.669 CCCSCc1ccc(c(c1)Cl)I 62a_100000210303_100012349665 [0,1,0,0,0,0|3,0,0]=4 3853 B13R1.669 CCCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000210303 [0,1,0,0,0,0|3,0,0]=4 3854 B13R1.669 CCCSCc1ccc(c(c1)F)Br 62a_100000210303_100000767054 [0,1,0,0,0,0|3,0,0]=4 3855 B13R1.669 CCCSCc1ccc(c(c1)F)Br 62a_100000767054_100000210303 [0,1,0,0,0,0|3,0,0]=4 3856 B13R1.669 CCCSCc1ccc(c(c1)F)C 62a_100000210303_100011217369 [0,1,0,0,0,0|3,0,0]=4 3857 B13R1.669 CCCSCc1ccc(c(c1)F)C 62a_100011217369_100000210303 [0,1,0,0,0,0|3,0,0]=4 3858 B13R1.669 CCCSCc1ccc(c(c1)F)Cl 62a_100000210303_100000716492 [0,1,0,0,0,0|3,0,0]=4 3859 B13R1.669 CCCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000210303 [0,1,0,0,0,0|3,0,0]=4 3860 B13R1.669 CCCSCc1ccc(c(c1)F)F 62a_100000210303_100000757363 [0,1,0,0,0,0|3,0,0]=4 3861 B13R1.669 CCCSCc1ccc(c(c1)F)F 62a_100000757363_100000210303 [0,1,0,0,0,0|3,0,0]=4 3862 B13R1.669 CCCSCc1ccc(c(c1)F)I 62a_100000210303_100010149604 [0,1,0,0,0,0|3,0,0]=4 3863 B13R1.669 CCCSCc1ccc(c(c1)F)I 62a_100010149604_100000210303 [0,1,0,0,0,0|3,0,0]=4 3864 B13R1.669 CCCSCc1ccc(c(c1)I)Br 62a_100000210303_100010146616 [0,1,0,0,0,0|3,0,0]=4 3865 B13R1.669 CCCSCc1ccc(c(c1)I)Br 62a_100010146616_100000210303 [0,1,0,0,0,0|3,0,0]=4 3866 B13R1.669 CCCSCc1ccc(c(c1)I)C 62a_100000210303_100010206137 [0,1,0,0,0,0|3,0,0]=4 3867 B13R1.669 CCCSCc1ccc(c(c1)I)C 62a_100010206137_100000210303 [0,1,0,0,0,0|3,0,0]=4 3868 B13R1.669 CCCSCc1ccc(c(c1)I)F 62a_100000210303_100010188208 [0,1,0,0,0,0|3,0,0]=4 3869 B13R1.669 CCCSCc1ccc(c(c1)I)F 62a_100010188208_100000210303 [0,1,0,0,0,0|3,0,0]=4 3870 B13R1.669 CCNCCc1ccc(c(c1)C)C 2230a_100020591374_100000210202 [0,1,0,0,0,0|2,0,0]=3 3871 B13R1.669 CCNCCc1ccc(c(c1)C)C 34a_100020591374_100000210202 [0,1,0,0,0,0|2,0,0]=3 3872 B13R1.669 CCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000210202 [0,1,0,0,0,0|2,0,0]=3 3873 B13R1.669 CCNCCc1ccc(c(c1)Cl)Cl 2230a_100015525214_100011713676 [0,1,0,0,0,0|2,0,0]=3 3874 B13R1.669 CCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100000210202 [0,1,0,0,0,0|2,0,0]=3 3875 B13R1.669 CCNCCc1ccc(c(c1)Cl)F 2230a_100015525214_100012361305 [0,1,0,0,0,0|2,0,0]=3 3876 B13R1.669 CCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000210202 [0,1,0,0,0,0|2,0,0]=3 3877 B13R1.669 CCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100000210202 [0,1,0,0,0,0|2,0,0]=3 3878 B13R1.669 CCNCCc1ccc(c(c1)F)F 2230a_100015525214_100000690553 [0,1,0,0,0,0|2,0,0]=3 3879 B13R1.669 CCNCCc1ccc(c(c1)F)F 2230a_200000706328_100000210202 [0,1,0,0,0,0|2,0,0]=3 3880 B13R1.669 CCNCCc1ccc(c(c1)F)F 34a_200000706328_100000210202 [0,1,0,0,0,0|2,0,0]=3 3881 B13R1.669 CCNCCc1ccc(c(c1)O)O 34a_100000210387_100000210202 [0,1,0,0,0,0|0,0,0]=1 3882 B13R1.669 CCNN=Cc1ccc(c(c1)Br)O 4a_100000756455_100000184552 [0,1,0,0,0,0|2,0,1]=4 3883 B13R1.669 CCNN=Cc1ccc(c(c1)C)O 4a_100000756455_100011215669 [0,1,0,0,0,0|2,0,1]=4 3884 B13R1.669 CCNN=Cc1ccc(c(c1)Cl)O 4a_100000756455_100000186751 [0,1,0,0,0,0|2,0,1]=4 3885 B13R1.669 CCNN=Cc1ccc(c(c1)F)O 4a_100000756455_100000742332 [0,1,0,0,0,0|2,0,1]=4 3886 B13R1.669 CCNN=Cc1ccc(c(c1)I)O 4a_100000756455_100000186752 [0,1,0,0,0,0|2,0,1]=4 3887 B13R1.669 CCNN=Cc1ccc(c(c1)O)Br 4a_100000756455_100010235083 [0,1,0,0,0,0|2,0,1]=4 3888 B13R1.669 CCNN=Cc1ccc(c(c1)O)C 4a_100000756455_100011361566 [0,1,0,0,0,0|2,0,1]=4 3889 B13R1.669 CCNN=Cc1ccc(c(c1)O)Cl 4a_100000756455_100009876013 [0,1,0,0,0,0|2,0,1]=4 3890 B13R1.669 CCNN=Cc1ccc(c(c1)O)F 4a_100000756455_100000102368 [0,1,0,0,0,0|2,0,1]=4 3891 B13R1.669 CCNN=Cc1ccc(c(c1)O)I 4a_100000756455_100000041418 [0,1,0,0,0,0|2,0,1]=4 3892 B13R1.669 CCNN=Cc1ccc(c(c1)O)O 4a_100000756455_100000184535 [0,1,0,0,0,0|1,0,1]=3 3893 B13R1.669 CCOC=Cc1ccc(c(c1)O)O 271570a_100016256518_100009813601 [0,1,0,0,0,0|1,0,2]=4 3894 B13R1.669 CCOCCc1ccc(c(c1)Cl)Cl 34a_100011709245_100000210202 [0,1,0,0,0,0|3,0,0]=4 3895 B13R1.669 CCOCCc1ccc(c(c1)Cl)Cl 34a_100121572206_100011713676 [0,1,0,0,0,0|3,0,0]=4 3896 B13R1.669 CCOCCc1ccc(c(c1)Cl)Cl 7a_100011709245_100000210202 [0,1,0,0,0,0|3,0,0]=4 3897 B13R1.669 CCOCCc1ccc(c(c1)Cl)F 34a_100011830478_100000210202 [0,1,0,0,0,0|3,0,0]=4 3898 B13R1.669 CCOCCc1ccc(c(c1)Cl)F 34a_100121572206_100012361305 [0,1,0,0,0,0|3,0,0]=4 3899 B13R1.669 CCOCCc1ccc(c(c1)Cl)F 7a_100011830478_100000210202 [0,1,0,0,0,0|3,0,0]=4 3900 B13R1.669 CCOCCc1ccc(c(c1)F)Br 34a_100012921202_100000210202 [0,1,0,0,0,0|3,0,0]=4 3901 B13R1.669 CCOCCc1ccc(c(c1)F)Br 7a_100012921202_100000210202 [0,1,0,0,0,0|3,0,0]=4 3902 B13R1.669 CCOCCc1ccc(c(c1)F)Cl 34a_100011934464_100000210202 [0,1,0,0,0,0|3,0,0]=4 3903 B13R1.669 CCOCCc1ccc(c(c1)F)Cl 7a_100011934464_100000210202 [0,1,0,0,0,0|3,0,0]=4 3904 B13R1.669 CCOCCc1ccc(c(c1)F)F 34a_100000690376_100000210202 [0,1,0,0,0,0|3,0,0]=4 3905 B13R1.669 CCOCCc1ccc(c(c1)F)F 34a_100121572206_100000690553 [0,1,0,0,0,0|3,0,0]=4 3906 B13R1.669 CCOCCc1ccc(c(c1)F)F 7a_100000690376_100000210202 [0,1,0,0,0,0|3,0,0]=4 3907 B13R1.669 CCOCSc1ccc(c(c1)Br)O 62a_100000739092_100012361655 [0,1,0,0,0,0|3,0,0]=4 3908 B13R1.669 CCOCSc1ccc(c(c1)Br)O 62a_100012361655_100000739092 [0,1,0,0,0,0|3,0,0]=4 3909 B13R1.669 CCOCSc1ccc(c(c1)C)O 62a_100000739092_100000186361 [0,1,0,0,0,0|3,0,0]=4 3910 B13R1.669 CCOCSc1ccc(c(c1)Cl)O 62a_100000739092_100012360047 [0,1,0,0,0,0|3,0,0]=4 3911 B13R1.669 CCOCSc1ccc(c(c1)Cl)O 62a_100012360047_100000739092 [0,1,0,0,0,0|3,0,0]=4 3912 B13R1.669 CCOCSc1ccc(c(c1)F)O 62a_100000185481_100000739092 [0,1,0,0,0,0|3,0,0]=4 3913 B13R1.669 CCOCSc1ccc(c(c1)F)O 62a_100000739092_100000185481 [0,1,0,0,0,0|3,0,0]=4 3914 B13R1.669 CCOCSc1ccc(c(c1)N)O 62a_100000739092_100000752626 [0,1,0,0,0,0|3,0,0]=4 3915 B13R1.669 CCOCSc1ccc(c(c1)N)O 62a_100000752626_100000739092 [0,1,0,0,0,0|3,0,0]=4 3916 B13R1.669 CCOCSc1ccc(c(c1)O)Br 62a_100000739092_100012356990 [0,1,0,0,0,0|3,0,0]=4 3917 B13R1.669 CCOCSc1ccc(c(c1)O)Br 62a_100012356990_100000739092 [0,1,0,0,0,0|3,0,0]=4 3918 B13R1.669 CCOCSc1ccc(c(c1)O)C 62a_100000685420_100000739092 [0,1,0,0,0,0|3,0,0]=4 3919 B13R1.669 CCOCSc1ccc(c(c1)O)C 62a_100000739092_100000685420 [0,1,0,0,0,0|3,0,0]=4 3920 B13R1.669 CCOCSc1ccc(c(c1)O)Cl 62a_100000739092_100011356854 [0,1,0,0,0,0|3,0,0]=4 3921 B13R1.669 CCOCSc1ccc(c(c1)O)Cl 62a_100011356854_100000739092 [0,1,0,0,0,0|3,0,0]=4 3922 B13R1.669 CCOCSc1ccc(c(c1)O)F 62a_100000686035_100000739092 [0,1,0,0,0,0|3,0,0]=4 3923 B13R1.669 CCOCSc1ccc(c(c1)O)F 62a_100000739092_100000686035 [0,1,0,0,0,0|3,0,0]=4 3924 B13R1.669 CCOCSc1ccc(c(c1)O)N 62a_100000739049_100000739092 [0,1,0,0,0,0|3,0,0]=4 3925 B13R1.669 CCOCSc1ccc(c(c1)O)N 62a_100000739092_100000739049 [0,1,0,0,0,0|3,0,0]=4 3926 B13R1.669 CCOCSc1ccc(c(c1)O)O 62a_100000739092_100009813601 [0,1,0,0,0,0|2,0,0]=3 3927 B13R1.669 CCSCCc1ccc(c(c1)Cl)Cl 62a_100000210202_100011713676 [0,1,0,0,0,0|3,0,0]=4 3928 B13R1.669 CCSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_100000210202 [0,1,0,0,0,0|3,0,0]=4 3929 B13R1.669 CCSCCc1ccc(c(c1)Cl)F 62a_100000210202_100012361305 [0,1,0,0,0,0|3,0,0]=4 3930 B13R1.669 CCSCCc1ccc(c(c1)Cl)F 62a_100012361305_100000210202 [0,1,0,0,0,0|3,0,0]=4 3931 B13R1.669 CCSCCc1ccc(c(c1)F)F 62a_100000210202_100000690553 [0,1,0,0,0,0|3,0,0]=4 3932 B13R1.669 CCSCCc1ccc(c(c1)F)F 62a_100000690553_100000210202 [0,1,0,0,0,0|3,0,0]=4 3933 B13R1.669 CCSCCc1ccc(c(c1)O)O 62a_100000210202_200010393615 [0,1,0,0,0,0|1,0,0]=2 3934 B13R1.669 CNCCOc1ccc(c(c1)C)C 2230a_100015185357_200000210301 [0,1,0,0,0,0|2,0,0]=3 3935 B13R1.669 CNCCOc1ccc(c(c1)C)C 2230a_106832991635_200011210794 [0,1,0,0,0,0|2,0,0]=3 3936 B13R1.669 CNCCOc1ccc(c(c1)C)C 34a_100015185357_200000210301 [0,1,0,0,0,0|2,0,0]=3 3937 B13R1.669 CNCCOc1ccc(c(c1)C)C 34a_100102657272_200011210794 [0,1,0,0,0,0|2,0,0]=3 3938 B13R1.669 CNCCOc1ccc(c(c1)C)C 7a_106832991635_200011210794 [0,1,0,0,0,0|2,0,0]=3 3939 B13R1.669 CNCCOc1ccc(c(c1)C)Cl 2230a_100025718798_200000210301 [0,1,0,0,0,0|2,0,0]=3 3940 B13R1.669 CNCCOc1ccc(c(c1)C)Cl 34a_100025718798_200000210301 [0,1,0,0,0,0|2,0,0]=3 3941 B13R1.669 CNCCOc1ccc(c(c1)Cl)Cl 2230a_100015199673_200000210301 [0,1,0,0,0,0|2,0,0]=3 3942 B13R1.669 CNCCOc1ccc(c(c1)Cl)Cl 34a_100015199673_200000210301 [0,1,0,0,0,0|2,0,0]=3 3943 B13R1.669 CNCCOc1ccc(c(c1)Cl)F 2230a_106832991635_100011936913 [0,1,0,0,0,0|2,0,0]=3 3944 B13R1.669 CNCCOc1ccc(c(c1)Cl)F 34a_100102657272_100011936913 [0,1,0,0,0,0|2,0,0]=3 3945 B13R1.669 CNCCOc1ccc(c(c1)Cl)F 7a_106832991635_100011936913 [0,1,0,0,0,0|2,0,0]=3 3946 B13R1.669 COCC=Cc1ccc(c(c1)Br)O 271570a_100016286323_100012361655 [0,1,0,0,0,0|2,0,1]=4 3947 B13R1.669 COCC=Cc1ccc(c(c1)C)O 271570a_100016286323_100000186361 [0,1,0,0,0,0|2,0,1]=4 3948 B13R1.669 COCC=Cc1ccc(c(c1)Cl)O 271570a_100016286323_100012360047 [0,1,0,0,0,0|2,0,1]=4 3949 B13R1.669 COCC=Cc1ccc(c(c1)F)O 271570a_100016286323_100000185481 [0,1,0,0,0,0|2,0,1]=4 3950 B13R1.669 COCC=Cc1ccc(c(c1)N)O 271570a_100016286323_100000752626 [0,1,0,0,0,0|2,0,1]=4 3951 B13R1.669 COCC=Cc1ccc(c(c1)O)Br 271570a_100016286323_100012356990 [0,1,0,0,0,0|2,0,1]=4 3952 B13R1.669 COCC=Cc1ccc(c(c1)O)C 271570a_100016286323_100000766334 [0,1,0,0,0,0|2,0,1]=4 3953 B13R1.669 COCC=Cc1ccc(c(c1)O)Cl 271570a_100016286323_100011356854 [0,1,0,0,0,0|2,0,1]=4 3954 B13R1.669 COCC=Cc1ccc(c(c1)O)F 271570a_100016286323_100000686035 [0,1,0,0,0,0|2,0,1]=4 3955 B13R1.669 COCC=Cc1ccc(c(c1)O)N 271570a_100016286323_100000739049 [0,1,0,0,0,0|2,0,1]=4 3956 B13R1.669 COCC=Cc1ccc(c(c1)O)O 271570a_100016286323_100009813601 [0,1,0,0,0,0|1,0,1]=3 3957 B13R1.669 COCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100011201679 [0,1,0,0,0,0|3,0,0]=4 3958 B13R1.669 COCCNc1ccc(c(c1)Br)Br 34a_100011306057_100011201679 [0,1,0,0,0,0|3,0,0]=4 3959 B13R1.669 COCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000233755 [0,1,0,0,0,0|3,0,0]=4 3960 B13R1.669 COCCNc1ccc(c(c1)Br)C 2230a_100000736455_100011201679 [0,1,0,0,0,0|3,0,0]=4 3961 B13R1.669 COCCNc1ccc(c(c1)Br)C 34a_100000736455_100011201679 [0,1,0,0,0,0|3,0,0]=4 3962 B13R1.669 COCCNc1ccc(c(c1)Br)C 7a_100000736455_100000233755 [0,1,0,0,0,0|3,0,0]=4 3963 B13R1.669 COCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100011201679 [0,1,0,0,0,0|3,0,0]=4 3964 B13R1.669 COCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100011201679 [0,1,0,0,0,0|3,0,0]=4 3965 B13R1.669 COCCNc1ccc(c(c1)Br)F 2230a_100000760356_100011201679 [0,1,0,0,0,0|3,0,0]=4 3966 B13R1.669 COCCNc1ccc(c(c1)Br)F 34a_100000760356_100011201679 [0,1,0,0,0,0|3,0,0]=4 3967 B13R1.669 COCCNc1ccc(c(c1)Br)F 7a_100000760356_100000233755 [0,1,0,0,0,0|3,0,0]=4 3968 B13R1.669 COCCNc1ccc(c(c1)Br)I 34a_100000750458_100011201679 [0,1,0,0,0,0|3,0,0]=4 3969 B13R1.669 COCCNc1ccc(c(c1)Br)O 34a_100011534360_100011201679 [0,1,0,0,0,0|2,0,0]=3 3970 B13R1.669 COCCNc1ccc(c(c1)C)Br 2230a_100000210723_100011201679 [0,1,0,0,0,0|3,0,0]=4 3971 B13R1.669 COCCNc1ccc(c(c1)C)Br 34a_100000210723_100011201679 [0,1,0,0,0,0|3,0,0]=4 3972 B13R1.669 COCCNc1ccc(c(c1)C)Br 7a_100000210723_100000233755 [0,1,0,0,0,0|3,0,0]=4 3973 B13R1.669 COCCNc1ccc(c(c1)C)C 2230a_100000724040_100011201679 [0,1,0,0,0,0|3,0,0]=4 3974 B13R1.669 COCCNc1ccc(c(c1)C)C 34a_100000724040_100011201679 [0,1,0,0,0,0|3,0,0]=4 3975 B13R1.669 COCCNc1ccc(c(c1)C)C 7a_100000724040_100000233755 [0,1,0,0,0,0|3,0,0]=4 3976 B13R1.669 COCCNc1ccc(c(c1)C)Cl 2230a_100000187808_100011201679 [0,1,0,0,0,0|3,0,0]=4 3977 B13R1.669 COCCNc1ccc(c(c1)C)Cl 34a_100000187808_100011201679 [0,1,0,0,0,0|3,0,0]=4 3978 B13R1.669 COCCNc1ccc(c(c1)C)Cl 7a_100000187808_100000233755 [0,1,0,0,0,0|3,0,0]=4 3979 B13R1.669 COCCNc1ccc(c(c1)C)F 2230a_100000750164_100011201679 [0,1,0,0,0,0|3,0,0]=4 3980 B13R1.669 COCCNc1ccc(c(c1)C)F 34a_100000750164_100011201679 [0,1,0,0,0,0|3,0,0]=4 3981 B13R1.669 COCCNc1ccc(c(c1)C)F 7a_100000750164_100000233755 [0,1,0,0,0,0|3,0,0]=4 3982 B13R1.669 COCCNc1ccc(c(c1)C)I 34a_100000198070_100011201679 [0,1,0,0,0,0|3,0,0]=4 3983 B13R1.669 COCCNc1ccc(c(c1)C)I 7a_100000198070_100000233755 [0,1,0,0,0,0|3,0,0]=4 3984 B13R1.669 COCCNc1ccc(c(c1)C)O 34a_100011218179_100011201679 [0,1,0,0,0,0|2,0,0]=3 3985 B13R1.669 COCCNc1ccc(c(c1)C)O 7a_100011218179_100000233755 [0,1,0,0,0,0|2,0,0]=3 3986 B13R1.669 COCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100011201679 [0,1,0,0,0,0|3,0,0]=4 3987 B13R1.669 COCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100011201679 [0,1,0,0,0,0|3,0,0]=4 3988 B13R1.669 COCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000233755 [0,1,0,0,0,0|3,0,0]=4 3989 B13R1.669 COCCNc1ccc(c(c1)Cl)C 2230a_100000188892_100011201679 [0,1,0,0,0,0|3,0,0]=4 3990 B13R1.669 COCCNc1ccc(c(c1)Cl)C 34a_100000188892_100011201679 [0,1,0,0,0,0|3,0,0]=4 3991 B13R1.669 COCCNc1ccc(c(c1)Cl)C 7a_100000188892_100000233755 [0,1,0,0,0,0|3,0,0]=4 3992 B13R1.669 COCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100011201679 [0,1,0,0,0,0|3,0,0]=4 3993 B13R1.669 COCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100011201679 [0,1,0,0,0,0|3,0,0]=4 3994 B13R1.669 COCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100011201679 [0,1,0,0,0,0|3,0,0]=4 3995 B13R1.669 COCCNc1ccc(c(c1)Cl)F 34a_100000211060_100011201679 [0,1,0,0,0,0|3,0,0]=4 3996 B13R1.669 COCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000233755 [0,1,0,0,0,0|3,0,0]=4 3997 B13R1.669 COCCNc1ccc(c(c1)Cl)I 34a_100000761885_100011201679 [0,1,0,0,0,0|3,0,0]=4 3998 B13R1.669 COCCNc1ccc(c(c1)Cl)O 34a_100000744943_100011201679 [0,1,0,0,0,0|2,0,0]=3 3999 B13R1.669 COCCNc1ccc(c(c1)F)Br 2230a_100000759894_100011201679 [0,1,0,0,0,0|3,0,0]=4 4000 B13R1.669 COCCNc1ccc(c(c1)F)Br 34a_100000759894_100011201679 [0,1,0,0,0,0|3,0,0]=4 4001 B13R1.669 COCCNc1ccc(c(c1)F)Br 7a_100000759894_100000233755 [0,1,0,0,0,0|3,0,0]=4 4002 B13R1.669 COCCNc1ccc(c(c1)F)C 2230a_100000210958_100011201679 [0,1,0,0,0,0|3,0,0]=4 4003 B13R1.669 COCCNc1ccc(c(c1)F)C 34a_100000210958_100011201679 [0,1,0,0,0,0|3,0,0]=4 4004 B13R1.669 COCCNc1ccc(c(c1)F)C 7a_100000210958_100000233755 [0,1,0,0,0,0|3,0,0]=4 4005 B13R1.669 COCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100011201679 [0,1,0,0,0,0|3,0,0]=4 4006 B13R1.669 COCCNc1ccc(c(c1)F)Cl 34a_100000739366_100011201679 [0,1,0,0,0,0|3,0,0]=4 4007 B13R1.669 COCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000233755 [0,1,0,0,0,0|3,0,0]=4 4008 B13R1.669 COCCNc1ccc(c(c1)F)F 2230a_100000210724_100011201679 [0,1,0,0,0,0|3,0,0]=4 4009 B13R1.669 COCCNc1ccc(c(c1)F)F 34a_100000210724_100011201679 [0,1,0,0,0,0|3,0,0]=4 4010 B13R1.669 COCCNc1ccc(c(c1)F)F 7a_100000210724_100000233755 [0,1,0,0,0,0|3,0,0]=4 4011 B13R1.669 COCCNc1ccc(c(c1)F)I 34a_100011356925_100011201679 [0,1,0,0,0,0|3,0,0]=4 4012 B13R1.669 COCCNc1ccc(c(c1)F)I 7a_100011356925_100000233755 [0,1,0,0,0,0|3,0,0]=4 4013 B13R1.669 COCCNc1ccc(c(c1)F)O 34a_100011220035_100011201679 [0,1,0,0,0,0|2,0,0]=3 4014 B13R1.669 COCCNc1ccc(c(c1)F)O 7a_100011220035_100000233755 [0,1,0,0,0,0|2,0,0]=3 4015 B13R1.669 COCCNc1ccc(c(c1)I)Br 34a_100000750459_100011201679 [0,1,0,0,0,0|3,0,0]=4 4016 B13R1.669 COCCNc1ccc(c(c1)I)C 34a_100000184131_100011201679 [0,1,0,0,0,0|3,0,0]=4 4017 B13R1.669 COCCNc1ccc(c(c1)I)C 7a_100000184131_100000233755 [0,1,0,0,0,0|3,0,0]=4 4018 B13R1.669 COCCNc1ccc(c(c1)I)Cl 34a_100012360549_100011201679 [0,1,0,0,0,0|3,0,0]=4 4019 B13R1.669 COCCNc1ccc(c(c1)I)F 34a_114828291077_100011201679 [0,1,0,0,0,0|3,0,0]=4 4020 B13R1.669 COCCNc1ccc(c(c1)I)F 7a_114828291077_100000233755 [0,1,0,0,0,0|3,0,0]=4 4021 B13R1.669 COCCNc1ccc(c(c1)O)C 34a_100000759471_100011201679 [0,1,0,0,0,0|2,0,0]=3 4022 B13R1.669 COCCNc1ccc(c(c1)O)C 7a_100000759471_100000233755 [0,1,0,0,0,0|2,0,0]=3 4023 B13R1.669 COCCNc1ccc(c(c1)O)Cl 34a_100011934209_100011201679 [0,1,0,0,0,0|2,0,0]=3 4024 B13R1.669 COCCNc1ccc(c(c1)O)F 34a_100012017398_100011201679 [0,1,0,0,0,0|2,0,0]=3 4025 B13R1.669 COCCNc1ccc(c(c1)O)F 7a_100012017398_100000233755 [0,1,0,0,0,0|2,0,0]=3 4026 B13R1.669 COCCNc1ccc(c(c1)O)O 34a_100102946323_100011201679 [0,1,0,0,0,0|1,0,0]=2 4027 B13R1.669 COCCOc1ccc(c(c1)Br)C 34a_100011380479_100011201679 [0,1,0,0,0,0|3,0,0]=4 4028 B13R1.669 COCCOc1ccc(c(c1)Br)C 7a_100011380479_100000233755 [0,1,0,0,0,0|3,0,0]=4 4029 B13R1.669 COCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100011201679 [0,1,0,0,0,0|3,0,0]=4 4030 B13R1.669 COCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000233755 [0,1,0,0,0,0|3,0,0]=4 4031 B13R1.669 COCCOc1ccc(c(c1)Br)F 34a_100000693481_100011201679 [0,1,0,0,0,0|3,0,0]=4 4032 B13R1.669 COCCOc1ccc(c(c1)Br)F 7a_100000693481_100000233755 [0,1,0,0,0,0|3,0,0]=4 4033 B13R1.669 COCCOc1ccc(c(c1)Br)I 34a_100000701344_100011201679 [0,1,0,0,0,0|3,0,0]=4 4034 B13R1.669 COCCOc1ccc(c(c1)Br)I 7a_100000701344_100000233755 [0,1,0,0,0,0|3,0,0]=4 4035 B13R1.669 COCCOc1ccc(c(c1)Br)N 34a_100012001276_100011201679 [0,1,0,0,0,0|3,0,0]=4 4036 B13R1.669 COCCOc1ccc(c(c1)Br)N 7a_100012001276_100000233755 [0,1,0,0,0,0|3,0,0]=4 4037 B13R1.669 COCCOc1ccc(c(c1)C)Br 34a_100000690111_100011201679 [0,1,0,0,0,0|3,0,0]=4 4038 B13R1.669 COCCOc1ccc(c(c1)C)Br 7a_100000690111_100000233755 [0,1,0,0,0,0|3,0,0]=4 4039 B13R1.669 COCCOc1ccc(c(c1)C)C 34a_100000210932_100011201679 [0,1,0,0,0,0|3,0,0]=4 4040 B13R1.669 COCCOc1ccc(c(c1)C)C 34a_100138415774_200011210794 [0,1,0,0,0,0|3,0,0]=4 4041 B13R1.669 COCCOc1ccc(c(c1)C)C 7a_100000210932_100000233755 [0,1,0,0,0,0|3,0,0]=4 4042 B13R1.669 COCCOc1ccc(c(c1)C)Cl 34a_100000211092_100011201679 [0,1,0,0,0,0|3,0,0]=4 4043 B13R1.669 COCCOc1ccc(c(c1)C)Cl 7a_100000211092_100000233755 [0,1,0,0,0,0|3,0,0]=4 4044 B13R1.669 COCCOc1ccc(c(c1)C)F 34a_100000751312_100011201679 [0,1,0,0,0,0|3,0,0]=4 4045 B13R1.669 COCCOc1ccc(c(c1)C)F 7a_100000751312_100000233755 [0,1,0,0,0,0|3,0,0]=4 4046 B13R1.669 COCCOc1ccc(c(c1)C)I 34a_100000729255_100011201679 [0,1,0,0,0,0|3,0,0]=4 4047 B13R1.669 COCCOc1ccc(c(c1)C)I 7a_100000729255_100000233755 [0,1,0,0,0,0|3,0,0]=4 4048 B13R1.669 COCCOc1ccc(c(c1)C)N 34a_100000756630_100011201679 [0,1,0,0,0,0|3,0,0]=4 4049 B13R1.669 COCCOc1ccc(c(c1)C)N 7a_100000756630_100000233755 [0,1,0,0,0,0|3,0,0]=4 4050 B13R1.669 COCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100011201679 [0,1,0,0,0,0|3,0,0]=4 4051 B13R1.669 COCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000233755 [0,1,0,0,0,0|3,0,0]=4 4052 B13R1.669 COCCOc1ccc(c(c1)Cl)C 34a_100011265682_100011201679 [0,1,0,0,0,0|3,0,0]=4 4053 B13R1.669 COCCOc1ccc(c(c1)Cl)C 7a_100011265682_100000233755 [0,1,0,0,0,0|3,0,0]=4 4054 B13R1.669 COCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100011201679 [0,1,0,0,0,0|3,0,0]=4 4055 B13R1.669 COCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000233755 [0,1,0,0,0,0|3,0,0]=4 4056 B13R1.669 COCCOc1ccc(c(c1)Cl)F 34a_100000211030_100011201679 [0,1,0,0,0,0|3,0,0]=4 4057 B13R1.669 COCCOc1ccc(c(c1)Cl)F 34a_100138415774_100011936913 [0,1,0,0,0,0|3,0,0]=4 4058 B13R1.669 COCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000233755 [0,1,0,0,0,0|3,0,0]=4 4059 B13R1.669 COCCOc1ccc(c(c1)Cl)I 34a_100000047559_100011201679 [0,1,0,0,0,0|3,0,0]=4 4060 B13R1.669 COCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000233755 [0,1,0,0,0,0|3,0,0]=4 4061 B13R1.669 COCCOc1ccc(c(c1)Cl)N 34a_100011215599_100011201679 [0,1,0,0,0,0|3,0,0]=4 4062 B13R1.669 COCCOc1ccc(c(c1)Cl)N 7a_100011215599_100000233755 [0,1,0,0,0,0|3,0,0]=4 4063 B13R1.669 COCCOc1ccc(c(c1)F)Br 34a_100000755031_100011201679 [0,1,0,0,0,0|3,0,0]=4 4064 B13R1.669 COCCOc1ccc(c(c1)F)Br 7a_100000755031_100000233755 [0,1,0,0,0,0|3,0,0]=4 4065 B13R1.669 COCCOc1ccc(c(c1)F)C 34a_100000722560_100011201679 [0,1,0,0,0,0|3,0,0]=4 4066 B13R1.669 COCCOc1ccc(c(c1)F)C 7a_100000722560_100000233755 [0,1,0,0,0,0|3,0,0]=4 4067 B13R1.669 COCCOc1ccc(c(c1)F)Cl 34a_100000691581_100011201679 [0,1,0,0,0,0|3,0,0]=4 4068 B13R1.669 COCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000233755 [0,1,0,0,0,0|3,0,0]=4 4069 B13R1.669 COCCOc1ccc(c(c1)F)F 34a_100000181275_100011201679 [0,1,0,0,0,0|3,0,0]=4 4070 B13R1.669 COCCOc1ccc(c(c1)F)F 7a_100000181275_100000233755 [0,1,0,0,0,0|3,0,0]=4 4071 B13R1.669 COCCOc1ccc(c(c1)F)I 34a_100009990212_100011201679 [0,1,0,0,0,0|3,0,0]=4 4072 B13R1.669 COCCOc1ccc(c(c1)F)I 7a_100009990212_100000233755 [0,1,0,0,0,0|3,0,0]=4 4073 B13R1.669 COCCOc1ccc(c(c1)F)N 34a_100000759473_100011201679 [0,1,0,0,0,0|3,0,0]=4 4074 B13R1.669 COCCOc1ccc(c(c1)F)N 7a_100000759473_100000233755 [0,1,0,0,0,0|3,0,0]=4 4075 B13R1.669 COCCOc1ccc(c(c1)I)Br 34a_100012339312_100011201679 [0,1,0,0,0,0|3,0,0]=4 4076 B13R1.669 COCCOc1ccc(c(c1)I)Br 7a_100012339312_100000233755 [0,1,0,0,0,0|3,0,0]=4 4077 B13R1.669 COCCOc1ccc(c(c1)I)Cl 34a_100000049588_100011201679 [0,1,0,0,0,0|3,0,0]=4 4078 B13R1.669 COCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000233755 [0,1,0,0,0,0|3,0,0]=4 4079 B13R1.669 COCCOc1ccc(c(c1)I)N 34a_100010084370_100011201679 [0,1,0,0,0,0|3,0,0]=4 4080 B13R1.669 COCCOc1ccc(c(c1)I)N 7a_100010084370_100000233755 [0,1,0,0,0,0|3,0,0]=4 4081 B13R1.669 COCCOc1ccc(c(c1)N)Br 34a_100011999798_100011201679 [0,1,0,0,0,0|3,0,0]=4 4082 B13R1.669 COCCOc1ccc(c(c1)N)Br 7a_100011999798_100000233755 [0,1,0,0,0,0|3,0,0]=4 4083 B13R1.669 COCCOc1ccc(c(c1)N)C 34a_100011216113_100011201679 [0,1,0,0,0,0|3,0,0]=4 4084 B13R1.669 COCCOc1ccc(c(c1)N)C 34a_100012283766_200000210301 [0,1,0,0,0,0|3,0,0]=4 4085 B13R1.669 COCCOc1ccc(c(c1)N)C 7a_100011216113_100000233755 [0,1,0,0,0,0|3,0,0]=4 4086 B13R1.669 COCCOc1ccc(c(c1)N)C 7a_100012283766_200000210301 [0,1,0,0,0,0|3,0,0]=4 4087 B13R1.669 COCCOc1ccc(c(c1)N)Cl 34a_100011934297_100011201679 [0,1,0,0,0,0|3,0,0]=4 4088 B13R1.669 COCCOc1ccc(c(c1)N)F 34a_100012017239_100011201679 [0,1,0,0,0,0|3,0,0]=4 4089 B13R1.669 COCCOc1ccc(c(c1)N)F 7a_100012017239_100000233755 [0,1,0,0,0,0|3,0,0]=4 4090 B13R1.669 COCCOc1ccc(c(c1)N)N 34a_100025771000_100011201679 [0,1,0,0,0,0|3,0,0]=4 4091 B13R1.669 COCCSc1c[nH]c(=O)c(c1)O 62a_100000233755_100009814561 [0,1,0,0,0,0|2,0,1]=4 4092 B13R1.669 COCCSc1cc(c(cn1)C)O 62a_100000233755_100000704368 [0,1,0,0,0,0|3,0,0]=4 4093 B13R1.669 COCCSc1cc(c(cn1)C)O 62a_100000704368_100000233755 [0,1,0,0,0,0|3,0,0]=4 4094 B13R1.669 COCCSc1cc(c(cn1)F)O 62a_100000233755_100009854642 [0,1,0,0,0,0|3,0,0]=4 4095 B13R1.669 COCCSc1cc(c(cn1)F)O 62a_100009854642_100000233755 [0,1,0,0,0,0|3,0,0]=4 4096 B13R1.669 COCCSc1cc(c(cn1)O)C 62a_100000233755_100000692680 [0,1,0,0,0,0|3,0,0]=4 4097 B13R1.669 COCCSc1cc(c(cn1)O)N 62a_100000233755_100009819941 [0,1,0,0,0,0|3,0,0]=4 4098 B13R1.669 COCCSc1cc(c(cn1)O)N 62a_100009819941_100000233755 [0,1,0,0,0,0|3,0,0]=4 4099 B13R1.669 COCCSc1ccc(c(c1)Br)Br 62a_100000233755_100012356285 [0,1,0,0,0,0|3,0,0]=4 4100 B13R1.669 COCCSc1ccc(c(c1)Br)Br 62a_100012356285_100000233755 [0,1,0,0,0,0|3,0,0]=4 4101 B13R1.669 COCCSc1ccc(c(c1)Br)C 34a_100010989109_200000210301 [0,1,0,0,0,0|3,0,0]=4 4102 B13R1.669 COCCSc1ccc(c(c1)Br)C 62a_100000233755_100011847877 [0,1,0,0,0,0|3,0,0]=4 4103 B13R1.669 COCCSc1ccc(c(c1)Br)C 62a_100011847877_100000233755 [0,1,0,0,0,0|3,0,0]=4 4104 B13R1.669 COCCSc1ccc(c(c1)Br)C 7a_100010989109_200000210301 [0,1,0,0,0,0|3,0,0]=4 4105 B13R1.669 COCCSc1ccc(c(c1)Br)Cl 62a_100000233755_100012353702 [0,1,0,0,0,0|3,0,0]=4 4106 B13R1.669 COCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000233755 [0,1,0,0,0,0|3,0,0]=4 4107 B13R1.669 COCCSc1ccc(c(c1)Br)F 62a_100000233755_100012047266 [0,1,0,0,0,0|3,0,0]=4 4108 B13R1.669 COCCSc1ccc(c(c1)Br)F 62a_100012047266_100000233755 [0,1,0,0,0,0|3,0,0]=4 4109 B13R1.669 COCCSc1ccc(c(c1)Br)N 62a_100000233755_100000750455 [0,1,0,0,0,0|3,0,0]=4 4110 B13R1.669 COCCSc1ccc(c(c1)Br)N 62a_100000750455_100000233755 [0,1,0,0,0,0|3,0,0]=4 4111 B13R1.669 COCCSc1ccc(c(c1)Br)O 62a_100000233755_100012361655 [0,1,0,0,0,0|2,0,0]=3 4112 B13R1.669 COCCSc1ccc(c(c1)Br)O 62a_100012361655_100000233755 [0,1,0,0,0,0|2,0,0]=3 4113 B13R1.669 COCCSc1ccc(c(c1)C)Br 62a_100000233755_100009813585 [0,1,0,0,0,0|3,0,0]=4 4114 B13R1.669 COCCSc1ccc(c(c1)C)Br 62a_100009813585_100000233755 [0,1,0,0,0,0|3,0,0]=4 4115 B13R1.669 COCCSc1ccc(c(c1)C)C 62a_100000233755_100011215607 [0,1,0,0,0,0|3,0,0]=4 4116 B13R1.669 COCCSc1ccc(c(c1)C)C 62a_100011215607_100000233755 [0,1,0,0,0,0|3,0,0]=4 4117 B13R1.669 COCCSc1ccc(c(c1)C)Cl 62a_100000049509_100000233755 [0,1,0,0,0,0|3,0,0]=4 4118 B13R1.669 COCCSc1ccc(c(c1)C)Cl 62a_100000233755_100000049509 [0,1,0,0,0,0|3,0,0]=4 4119 B13R1.669 COCCSc1ccc(c(c1)C)F 62a_100000233755_100011218330 [0,1,0,0,0,0|3,0,0]=4 4120 B13R1.669 COCCSc1ccc(c(c1)C)F 62a_100011218330_100000233755 [0,1,0,0,0,0|3,0,0]=4 4121 B13R1.669 COCCSc1ccc(c(c1)C)N 62a_100000211769_100000233755 [0,1,0,0,0,0|3,0,0]=4 4122 B13R1.669 COCCSc1ccc(c(c1)C)N 62a_100000233755_100000211769 [0,1,0,0,0,0|3,0,0]=4 4123 B13R1.669 COCCSc1ccc(c(c1)C)O 62a_100000233755_100000186361 [0,1,0,0,0,0|2,0,0]=3 4124 B13R1.669 COCCSc1ccc(c(c1)Cl)Br 62a_100000233755_100012047281 [0,1,0,0,0,0|3,0,0]=4 4125 B13R1.669 COCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000233755 [0,1,0,0,0,0|3,0,0]=4 4126 B13R1.669 COCCSc1ccc(c(c1)Cl)C 62a_100000233755_100011216363 [0,1,0,0,0,0|3,0,0]=4 4127 B13R1.669 COCCSc1ccc(c(c1)Cl)C 62a_100011216363_100000233755 [0,1,0,0,0,0|3,0,0]=4 4128 B13R1.669 COCCSc1ccc(c(c1)Cl)Cl 34a_200012295044_200000210301 [0,1,0,0,0,0|3,0,0]=4 4129 B13R1.669 COCCSc1ccc(c(c1)Cl)Cl 62a_100000233755_100011214914 [0,1,0,0,0,0|3,0,0]=4 4130 B13R1.669 COCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000233755 [0,1,0,0,0,0|3,0,0]=4 4131 B13R1.669 COCCSc1ccc(c(c1)Cl)Cl 7a_200012295044_200000210301 [0,1,0,0,0,0|3,0,0]=4 4132 B13R1.669 COCCSc1ccc(c(c1)Cl)F 62a_100000233755_100011215976 [0,1,0,0,0,0|3,0,0]=4 4133 B13R1.669 COCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000233755 [0,1,0,0,0,0|3,0,0]=4 4134 B13R1.669 COCCSc1ccc(c(c1)Cl)N 62a_100000233755_100011218065 [0,1,0,0,0,0|3,0,0]=4 4135 B13R1.669 COCCSc1ccc(c(c1)Cl)N 62a_100011218065_100000233755 [0,1,0,0,0,0|3,0,0]=4 4136 B13R1.669 COCCSc1ccc(c(c1)Cl)O 62a_100000233755_100012360047 [0,1,0,0,0,0|2,0,0]=3 4137 B13R1.669 COCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000233755 [0,1,0,0,0,0|2,0,0]=3 4138 B13R1.669 COCCSc1ccc(c(c1)F)Br 62a_100000233755_100000685389 [0,1,0,0,0,0|3,0,0]=4 4139 B13R1.669 COCCSc1ccc(c(c1)F)Br 62a_100000685389_100000233755 [0,1,0,0,0,0|3,0,0]=4 4140 B13R1.669 COCCSc1ccc(c(c1)F)C 62a_100000233755_100000720648 [0,1,0,0,0,0|3,0,0]=4 4141 B13R1.669 COCCSc1ccc(c(c1)F)C 62a_100000720648_100000233755 [0,1,0,0,0,0|3,0,0]=4 4142 B13R1.669 COCCSc1ccc(c(c1)F)Cl 62a_100000233755_100011216805 [0,1,0,0,0,0|3,0,0]=4 4143 B13R1.669 COCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000233755 [0,1,0,0,0,0|3,0,0]=4 4144 B13R1.669 COCCSc1ccc(c(c1)F)F 62a_100000233755_100000703953 [0,1,0,0,0,0|3,0,0]=4 4145 B13R1.669 COCCSc1ccc(c(c1)F)F 62a_100000703953_100000233755 [0,1,0,0,0,0|3,0,0]=4 4146 B13R1.669 COCCSc1ccc(c(c1)F)N 62a_100000233755_100011215594 [0,1,0,0,0,0|3,0,0]=4 4147 B13R1.669 COCCSc1ccc(c(c1)F)N 62a_100011215594_100000233755 [0,1,0,0,0,0|3,0,0]=4 4148 B13R1.669 COCCSc1ccc(c(c1)F)O 62a_100000185481_100000233755 [0,1,0,0,0,0|2,0,0]=3 4149 B13R1.669 COCCSc1ccc(c(c1)F)O 62a_100000233755_100000185481 [0,1,0,0,0,0|2,0,0]=3 4150 B13R1.669 COCCSc1ccc(c(c1)N)Br 62a_100000233755_100000750456 [0,1,0,0,0,0|3,0,0]=4 4151 B13R1.669 COCCSc1ccc(c(c1)N)Br 62a_100000750456_100000233755 [0,1,0,0,0,0|3,0,0]=4 4152 B13R1.669 COCCSc1ccc(c(c1)N)C 62a_100000233755_100000761890 [0,1,0,0,0,0|3,0,0]=4 4153 B13R1.669 COCCSc1ccc(c(c1)N)C 62a_100000761890_100000233755 [0,1,0,0,0,0|3,0,0]=4 4154 B13R1.669 COCCSc1ccc(c(c1)N)Cl 62a_100000233755_200000761891 [0,1,0,0,0,0|3,0,0]=4 4155 B13R1.669 COCCSc1ccc(c(c1)N)Cl 62a_200000761891_100000233755 [0,1,0,0,0,0|3,0,0]=4 4156 B13R1.669 COCCSc1ccc(c(c1)N)F 62a_100000233755_100000740924 [0,1,0,0,0,0|3,0,0]=4 4157 B13R1.669 COCCSc1ccc(c(c1)N)F 62a_100000740924_100000233755 [0,1,0,0,0,0|3,0,0]=4 4158 B13R1.669 COCCSc1ccc(c(c1)N)N 62a_100000233755_100011534411 [0,1,0,0,0,0|3,0,0]=4 4159 B13R1.669 COCCSc1ccc(c(c1)N)N 62a_100000741789_100000233755 [0,1,0,0,0,0|3,0,0]=4 4160 B13R1.669 COCCSc1ccc(c(c1)N)O 62a_100000233755_100000752626 [0,1,0,0,0,0|2,0,0]=3 4161 B13R1.669 COCCSc1ccc(c(c1)N)O 62a_100000752626_100000233755 [0,1,0,0,0,0|2,0,0]=3 4162 B13R1.669 COCCSc1ccc(c(c1)O)Br 62a_100000233755_100012356990 [0,1,0,0,0,0|2,0,0]=3 4163 B13R1.669 COCCSc1ccc(c(c1)O)Br 62a_100012356990_100000233755 [0,1,0,0,0,0|2,0,0]=3 4164 B13R1.669 COCCSc1ccc(c(c1)O)C 62a_100000233755_100000685420 [0,1,0,0,0,0|2,0,0]=3 4165 B13R1.669 COCCSc1ccc(c(c1)O)C 62a_100000685420_100000233755 [0,1,0,0,0,0|2,0,0]=3 4166 B13R1.669 COCCSc1ccc(c(c1)O)Cl 62a_100000233755_100011356854 [0,1,0,0,0,0|2,0,0]=3 4167 B13R1.669 COCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000233755 [0,1,0,0,0,0|2,0,0]=3 4168 B13R1.669 COCCSc1ccc(c(c1)O)F 62a_100000233755_100000686035 [0,1,0,0,0,0|2,0,0]=3 4169 B13R1.669 COCCSc1ccc(c(c1)O)F 62a_100000686035_100000233755 [0,1,0,0,0,0|2,0,0]=3 4170 B13R1.669 COCCSc1ccc(c(c1)O)N 62a_100000233755_100000739049 [0,1,0,0,0,0|2,0,0]=3 4171 B13R1.669 COCCSc1ccc(c(c1)O)N 62a_100000739049_100000233755 [0,1,0,0,0,0|2,0,0]=3 4172 B13R1.669 COCCSc1ccc(c(c1)O)O 62a_100000233755_100009813601 [0,1,0,0,0,0|1,0,0]=2 4173 B13R1.669 COCCSc1ccc(c(n1)Br)O 62a_100000233755_100000725334 [0,1,0,0,0,0|3,0,0]=4 4174 B13R1.669 COCCSc1ccc(c(n1)Br)O 62a_100000725334_100000233755 [0,1,0,0,0,0|3,0,0]=4 4175 B13R1.669 COCCSc1ccc(c(n1)C)O 62a_100000233755_100010233687 [0,1,0,0,0,0|3,0,0]=4 4176 B13R1.669 COCCSc1ccc(c(n1)C)O 62a_100010233687_100000233755 [0,1,0,0,0,0|3,0,0]=4 4177 B13R1.669 COCCSc1ccc(c(n1)Cl)O 62a_100000233755_100000721234 [0,1,0,0,0,0|3,0,0]=4 4178 B13R1.669 COCCSc1ccc(c(n1)F)O 62a_100000233755_100009819667 [0,1,0,0,0,0|3,0,0]=4 4179 B13R1.669 COCCSc1ccc(c(n1)F)O 62a_100009819667_100000233755 [0,1,0,0,0,0|3,0,0]=4 4180 B13R1.669 COCCSc1ccc(c(n1)N)O 62a_100000233755_100000685527 [0,1,0,0,0,0|3,0,0]=4 4181 B13R1.669 COCCSc1ccc(c(n1)N)O 62a_100000685527_100000233755 [0,1,0,0,0,0|3,0,0]=4 4182 B13R1.669 COCCSc1ccc(c(n1)O)F 62a_100000233755_100010729010 [0,1,0,0,0,0|3,0,0]=4 4183 B13R1.669 COCCSc1ccc(c(n1)O)N 62a_100000718904_100000233755 [0,1,0,0,0,0|3,0,0]=4 4184 B13R1.669 COCCSc1cnc(c(c1)C)O 62a_100000233755_100000685391 [0,1,0,0,0,0|3,0,0]=4 4185 B13R1.669 COCCSc1cnc(c(c1)C)O 62a_100000685391_100000233755 [0,1,0,0,0,0|3,0,0]=4 4186 B13R1.669 COCCSc1cnc(c(c1)Cl)O 62a_100000233755_100010238531 [0,1,0,0,0,0|3,0,0]=4 4187 B13R1.669 COCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000233755 [0,1,0,0,0,0|3,0,0]=4 4188 B13R1.669 COCCSc1cnc(c(c1)N)O 62a_100000233755_100000743729 [0,1,0,0,0,0|3,0,0]=4 4189 B13R1.669 COCCSc1cnc(c(c1)N)O 62a_100000743729_100000233755 [0,1,0,0,0,0|3,0,0]=4 4190 B13R1.669 COCCSc1cnc(c(c1)O)C 62a_100000233755_100009864810 [0,1,0,0,0,0|3,0,0]=4 4191 B13R1.669 COCCSc1cnc(c(c1)O)C 62a_100009864810_100000233755 [0,1,0,0,0,0|3,0,0]=4 4192 B13R1.669 COCCSc1cnc(c(c1)O)F 62a_100000233755_100009819871 [0,1,0,0,0,0|3,0,0]=4 4193 B13R1.669 COCCSc1cnc(c(c1)O)F 62a_100009819871_100000233755 [0,1,0,0,0,0|3,0,0]=4 4194 B13R1.669 COCCSc1cnc(c(c1)O)N 62a_100000233755_100009819042 [0,1,0,0,0,0|3,0,0]=4 4195 B13R1.669 COCCSc1cnc(c(c1)O)N 62a_100009819042_100000233755 [0,1,0,0,0,0|3,0,0]=4 4196 B13R1.669 COCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000766300 [0,1,0,0,0,0|3,0,0]=4 4197 B13R1.669 COCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000766300 [0,1,0,0,0,0|3,0,0]=4 4198 B13R1.669 COCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000766300 [0,1,0,0,0,0|3,0,0]=4 4199 B13R1.669 COCNCc1ccc(c(c1)C)Br 2230a_100015205234_100000766300 [0,1,0,0,0,0|3,0,0]=4 4200 B13R1.669 COCNCc1ccc(c(c1)C)C 2230a_100025706692_100000766300 [0,1,0,0,0,0|3,0,0]=4 4201 B13R1.669 COCNCc1ccc(c(c1)C)F 2230a_100000239911_100000766300 [0,1,0,0,0,0|3,0,0]=4 4202 B13R1.669 COCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000766300 [0,1,0,0,0,0|3,0,0]=4 4203 B13R1.669 COCNCc1ccc(c(c1)Cl)C 2230a_102495364989_100000766300 [0,1,0,0,0,0|3,0,0]=4 4204 B13R1.669 COCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000766300 [0,1,0,0,0,0|3,0,0]=4 4205 B13R1.669 COCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000766300 [0,1,0,0,0,0|3,0,0]=4 4206 B13R1.669 COCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000766300 [0,1,0,0,0,0|3,0,0]=4 4207 B13R1.669 COCNCc1ccc(c(c1)F)C 2230a_100102708794_100000766300 [0,1,0,0,0,0|3,0,0]=4 4208 B13R1.669 COCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000766300 [0,1,0,0,0,0|3,0,0]=4 4209 B13R1.669 COCNCc1ccc(c(c1)F)F 2230a_100000737897_100000766300 [0,1,0,0,0,0|3,0,0]=4 4210 B13R1.669 COCSCc1cc(=O)c(co1)O 62a_100000766300_100000010605 [0,1,0,0,0,0|2,0,1]=4 4211 B13R1.669 COCSCc1ccc(c(c1)Br)Br 62a_100000766300_100012353900 [0,1,0,0,0,0|3,0,0]=4 4212 B13R1.669 COCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000766300 [0,1,0,0,0,0|3,0,0]=4 4213 B13R1.669 COCSCc1ccc(c(c1)Br)C 62a_100000766300_100012232412 [0,1,0,0,0,0|3,0,0]=4 4214 B13R1.669 COCSCc1ccc(c(c1)Br)C 62a_100012232412_100000766300 [0,1,0,0,0,0|3,0,0]=4 4215 B13R1.669 COCSCc1ccc(c(c1)Br)Cl 62a_100000766300_100012353894 [0,1,0,0,0,0|3,0,0]=4 4216 B13R1.669 COCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000766300 [0,1,0,0,0,0|3,0,0]=4 4217 B13R1.669 COCSCc1ccc(c(c1)Br)F 62a_100000766300_100011206884 [0,1,0,0,0,0|3,0,0]=4 4218 B13R1.669 COCSCc1ccc(c(c1)Br)F 62a_100011206884_100000766300 [0,1,0,0,0,0|3,0,0]=4 4219 B13R1.669 COCSCc1ccc(c(c1)C)Br 62a_100000727479_100000766300 [0,1,0,0,0,0|3,0,0]=4 4220 B13R1.669 COCSCc1ccc(c(c1)C)Br 62a_100000766300_100000727479 [0,1,0,0,0,0|3,0,0]=4 4221 B13R1.669 COCSCc1ccc(c(c1)C)C 62a_100000742320_100000766300 [0,1,0,0,0,0|3,0,0]=4 4222 B13R1.669 COCSCc1ccc(c(c1)C)C 62a_100000766300_100000742320 [0,1,0,0,0,0|3,0,0]=4 4223 B13R1.669 COCSCc1ccc(c(c1)C)Cl 62a_100000766300_100012184735 [0,1,0,0,0,0|3,0,0]=4 4224 B13R1.669 COCSCc1ccc(c(c1)C)Cl 62a_100012184735_100000766300 [0,1,0,0,0,0|3,0,0]=4 4225 B13R1.669 COCSCc1ccc(c(c1)C)F 62a_100000766300_100011216667 [0,1,0,0,0,0|3,0,0]=4 4226 B13R1.669 COCSCc1ccc(c(c1)C)F 62a_100011216667_100000766300 [0,1,0,0,0,0|3,0,0]=4 4227 B13R1.669 COCSCc1ccc(c(c1)Cl)Br 62a_100000766300_100012353895 [0,1,0,0,0,0|3,0,0]=4 4228 B13R1.669 COCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000766300 [0,1,0,0,0,0|3,0,0]=4 4229 B13R1.669 COCSCc1ccc(c(c1)Cl)C 62a_100000766300_100011823929 [0,1,0,0,0,0|3,0,0]=4 4230 B13R1.669 COCSCc1ccc(c(c1)Cl)C 62a_100011823929_100000766300 [0,1,0,0,0,0|3,0,0]=4 4231 B13R1.669 COCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000766300 [0,1,0,0,0,0|3,0,0]=4 4232 B13R1.669 COCSCc1ccc(c(c1)Cl)Cl 62a_100000766300_100000184707 [0,1,0,0,0,0|3,0,0]=4 4233 B13R1.669 COCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000766300 [0,1,0,0,0,0|3,0,0]=4 4234 B13R1.669 COCSCc1ccc(c(c1)Cl)F 62a_100000766300_100011934319 [0,1,0,0,0,0|3,0,0]=4 4235 B13R1.669 COCSCc1ccc(c(c1)Cl)I 62a_100000766300_100012349665 [0,1,0,0,0,0|3,0,0]=4 4236 B13R1.669 COCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000766300 [0,1,0,0,0,0|3,0,0]=4 4237 B13R1.669 COCSCc1ccc(c(c1)F)Br 62a_100000766300_100000767054 [0,1,0,0,0,0|3,0,0]=4 4238 B13R1.669 COCSCc1ccc(c(c1)F)Br 62a_100000767054_100000766300 [0,1,0,0,0,0|3,0,0]=4 4239 B13R1.669 COCSCc1ccc(c(c1)F)C 62a_100000766300_100011217369 [0,1,0,0,0,0|3,0,0]=4 4240 B13R1.669 COCSCc1ccc(c(c1)F)C 62a_100011217369_100000766300 [0,1,0,0,0,0|3,0,0]=4 4241 B13R1.669 COCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000766300 [0,1,0,0,0,0|3,0,0]=4 4242 B13R1.669 COCSCc1ccc(c(c1)F)Cl 62a_100000766300_100000716492 [0,1,0,0,0,0|3,0,0]=4 4243 B13R1.669 COCSCc1ccc(c(c1)F)F 62a_100000757363_100000766300 [0,1,0,0,0,0|3,0,0]=4 4244 B13R1.669 COCSCc1ccc(c(c1)F)F 62a_100000766300_100000757363 [0,1,0,0,0,0|3,0,0]=4 4245 B13R1.669 COCSCc1ccc(c(c1)F)I 62a_100000766300_100010149604 [0,1,0,0,0,0|3,0,0]=4 4246 B13R1.669 COCSCc1ccc(c(c1)F)I 62a_100010149604_100000766300 [0,1,0,0,0,0|3,0,0]=4 4247 B13R1.669 COCSCc1ccc(c(c1)I)Br 62a_100000766300_100010146616 [0,1,0,0,0,0|3,0,0]=4 4248 B13R1.669 COCSCc1ccc(c(c1)I)Br 62a_100010146616_100000766300 [0,1,0,0,0,0|3,0,0]=4 4249 B13R1.669 COCSCc1ccc(c(c1)I)C 62a_100000766300_100010206137 [0,1,0,0,0,0|3,0,0]=4 4250 B13R1.669 COCSCc1ccc(c(c1)I)C 62a_100010206137_100000766300 [0,1,0,0,0,0|3,0,0]=4 4251 B13R1.669 COCSCc1ccc(c(c1)I)F 62a_100000766300_100010188208 [0,1,0,0,0,0|3,0,0]=4 4252 B13R1.669 COCSCc1ccc(c(c1)I)F 62a_100010188208_100000766300 [0,1,0,0,0,0|3,0,0]=4 4253 B13R1.669 CSCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000751147 [0,1,0,0,0,0|3,0,0]=4 4254 B13R1.669 CSCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000212216 [0,1,0,0,0,0|3,0,0]=4 4255 B13R1.669 CSCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000212216 [0,1,0,0,0,0|3,0,0]=4 4256 B13R1.669 CSCCNc1ccc(c(c1)Br)C 2230a_100000736455_100000751147 [0,1,0,0,0,0|3,0,0]=4 4257 B13R1.669 CSCCNc1ccc(c(c1)Br)C 34a_100000736455_100000212216 [0,1,0,0,0,0|3,0,0]=4 4258 B13R1.669 CSCCNc1ccc(c(c1)Br)C 7a_100000736455_100000212216 [0,1,0,0,0,0|3,0,0]=4 4259 B13R1.669 CSCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000751147 [0,1,0,0,0,0|3,0,0]=4 4260 B13R1.669 CSCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000212216 [0,1,0,0,0,0|3,0,0]=4 4261 B13R1.669 CSCCNc1ccc(c(c1)Br)F 2230a_100000760356_100000751147 [0,1,0,0,0,0|3,0,0]=4 4262 B13R1.669 CSCCNc1ccc(c(c1)Br)F 34a_100000760356_100000212216 [0,1,0,0,0,0|3,0,0]=4 4263 B13R1.669 CSCCNc1ccc(c(c1)Br)F 7a_100000760356_100000212216 [0,1,0,0,0,0|3,0,0]=4 4264 B13R1.669 CSCCNc1ccc(c(c1)Br)I 34a_100000750458_100000212216 [0,1,0,0,0,0|3,0,0]=4 4265 B13R1.669 CSCCNc1ccc(c(c1)Br)O 34a_100011534360_100000212216 [0,1,0,0,0,0|2,0,0]=3 4266 B13R1.669 CSCCNc1ccc(c(c1)C)Br 2230a_100000210723_100000751147 [0,1,0,0,0,0|3,0,0]=4 4267 B13R1.669 CSCCNc1ccc(c(c1)C)Br 34a_100000210723_100000212216 [0,1,0,0,0,0|3,0,0]=4 4268 B13R1.669 CSCCNc1ccc(c(c1)C)Br 7a_100000210723_100000212216 [0,1,0,0,0,0|3,0,0]=4 4269 B13R1.669 CSCCNc1ccc(c(c1)C)C 2230a_100000724040_100000751147 [0,1,0,0,0,0|3,0,0]=4 4270 B13R1.669 CSCCNc1ccc(c(c1)C)C 34a_100000724040_100000212216 [0,1,0,0,0,0|3,0,0]=4 4271 B13R1.669 CSCCNc1ccc(c(c1)C)C 7a_100000724040_100000212216 [0,1,0,0,0,0|3,0,0]=4 4272 B13R1.669 CSCCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000751147 [0,1,0,0,0,0|3,0,0]=4 4273 B13R1.669 CSCCNc1ccc(c(c1)C)Cl 34a_100000187808_100000212216 [0,1,0,0,0,0|3,0,0]=4 4274 B13R1.669 CSCCNc1ccc(c(c1)C)Cl 7a_100000187808_100000212216 [0,1,0,0,0,0|3,0,0]=4 4275 B13R1.669 CSCCNc1ccc(c(c1)C)F 2230a_100000750164_100000751147 [0,1,0,0,0,0|3,0,0]=4 4276 B13R1.669 CSCCNc1ccc(c(c1)C)F 34a_100000750164_100000212216 [0,1,0,0,0,0|3,0,0]=4 4277 B13R1.669 CSCCNc1ccc(c(c1)C)F 7a_100000750164_100000212216 [0,1,0,0,0,0|3,0,0]=4 4278 B13R1.669 CSCCNc1ccc(c(c1)C)I 34a_100000198070_100000212216 [0,1,0,0,0,0|3,0,0]=4 4279 B13R1.669 CSCCNc1ccc(c(c1)C)I 7a_100000198070_100000212216 [0,1,0,0,0,0|3,0,0]=4 4280 B13R1.669 CSCCNc1ccc(c(c1)C)O 34a_100011218179_100000212216 [0,1,0,0,0,0|2,0,0]=3 4281 B13R1.669 CSCCNc1ccc(c(c1)C)O 7a_100011218179_100000212216 [0,1,0,0,0,0|2,0,0]=3 4282 B13R1.669 CSCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000751147 [0,1,0,0,0,0|3,0,0]=4 4283 B13R1.669 CSCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000212216 [0,1,0,0,0,0|3,0,0]=4 4284 B13R1.669 CSCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000212216 [0,1,0,0,0,0|3,0,0]=4 4285 B13R1.669 CSCCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000751147 [0,1,0,0,0,0|3,0,0]=4 4286 B13R1.669 CSCCNc1ccc(c(c1)Cl)C 34a_100000188892_100000212216 [0,1,0,0,0,0|3,0,0]=4 4287 B13R1.669 CSCCNc1ccc(c(c1)Cl)C 7a_100000188892_100000212216 [0,1,0,0,0,0|3,0,0]=4 4288 B13R1.669 CSCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000751147 [0,1,0,0,0,0|3,0,0]=4 4289 B13R1.669 CSCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000212216 [0,1,0,0,0,0|3,0,0]=4 4290 B13R1.669 CSCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000751147 [0,1,0,0,0,0|3,0,0]=4 4291 B13R1.669 CSCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000212216 [0,1,0,0,0,0|3,0,0]=4 4292 B13R1.669 CSCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000212216 [0,1,0,0,0,0|3,0,0]=4 4293 B13R1.669 CSCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000212216 [0,1,0,0,0,0|3,0,0]=4 4294 B13R1.669 CSCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000212216 [0,1,0,0,0,0|2,0,0]=3 4295 B13R1.669 CSCCNc1ccc(c(c1)F)Br 2230a_100000759894_100000751147 [0,1,0,0,0,0|3,0,0]=4 4296 B13R1.669 CSCCNc1ccc(c(c1)F)Br 34a_100000759894_100000212216 [0,1,0,0,0,0|3,0,0]=4 4297 B13R1.669 CSCCNc1ccc(c(c1)F)Br 7a_100000759894_100000212216 [0,1,0,0,0,0|3,0,0]=4 4298 B13R1.669 CSCCNc1ccc(c(c1)F)C 2230a_100000210958_100000751147 [0,1,0,0,0,0|3,0,0]=4 4299 B13R1.669 CSCCNc1ccc(c(c1)F)C 34a_100000210958_100000212216 [0,1,0,0,0,0|3,0,0]=4 4300 B13R1.669 CSCCNc1ccc(c(c1)F)C 7a_100000210958_100000212216 [0,1,0,0,0,0|3,0,0]=4 4301 B13R1.669 CSCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000751147 [0,1,0,0,0,0|3,0,0]=4 4302 B13R1.669 CSCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000212216 [0,1,0,0,0,0|3,0,0]=4 4303 B13R1.669 CSCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000212216 [0,1,0,0,0,0|3,0,0]=4 4304 B13R1.669 CSCCNc1ccc(c(c1)F)F 2230a_100000210724_100000751147 [0,1,0,0,0,0|3,0,0]=4 4305 B13R1.669 CSCCNc1ccc(c(c1)F)F 34a_100000210724_100000212216 [0,1,0,0,0,0|3,0,0]=4 4306 B13R1.669 CSCCNc1ccc(c(c1)F)F 7a_100000210724_100000212216 [0,1,0,0,0,0|3,0,0]=4 4307 B13R1.669 CSCCNc1ccc(c(c1)F)I 34a_100011356925_100000212216 [0,1,0,0,0,0|3,0,0]=4 4308 B13R1.669 CSCCNc1ccc(c(c1)F)I 7a_100011356925_100000212216 [0,1,0,0,0,0|3,0,0]=4 4309 B13R1.669 CSCCNc1ccc(c(c1)F)O 34a_100011220035_100000212216 [0,1,0,0,0,0|2,0,0]=3 4310 B13R1.669 CSCCNc1ccc(c(c1)F)O 7a_100011220035_100000212216 [0,1,0,0,0,0|2,0,0]=3 4311 B13R1.669 CSCCNc1ccc(c(c1)I)Br 34a_100000750459_100000212216 [0,1,0,0,0,0|3,0,0]=4 4312 B13R1.669 CSCCNc1ccc(c(c1)I)C 34a_100000184131_100000212216 [0,1,0,0,0,0|3,0,0]=4 4313 B13R1.669 CSCCNc1ccc(c(c1)I)C 7a_100000184131_100000212216 [0,1,0,0,0,0|3,0,0]=4 4314 B13R1.669 CSCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000212216 [0,1,0,0,0,0|3,0,0]=4 4315 B13R1.669 CSCCNc1ccc(c(c1)I)F 34a_114828291077_100000212216 [0,1,0,0,0,0|3,0,0]=4 4316 B13R1.669 CSCCNc1ccc(c(c1)I)F 7a_114828291077_100000212216 [0,1,0,0,0,0|3,0,0]=4 4317 B13R1.669 CSCCNc1ccc(c(c1)O)C 34a_100000759471_100000212216 [0,1,0,0,0,0|2,0,0]=3 4318 B13R1.669 CSCCNc1ccc(c(c1)O)C 7a_100000759471_100000212216 [0,1,0,0,0,0|2,0,0]=3 4319 B13R1.669 CSCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000212216 [0,1,0,0,0,0|2,0,0]=3 4320 B13R1.669 CSCCNc1ccc(c(c1)O)F 34a_100012017398_100000212216 [0,1,0,0,0,0|2,0,0]=3 4321 B13R1.669 CSCCNc1ccc(c(c1)O)F 7a_100012017398_100000212216 [0,1,0,0,0,0|2,0,0]=3 4322 B13R1.669 CSCCNc1ccc(c(c1)O)O 34a_100102946323_100000212216 [0,1,0,0,0,0|1,0,0]=2 4323 B13R1.669 CSCCOc1ccc(c(c1)Br)C 34a_100011380479_100000212216 [0,1,0,0,0,0|3,0,0]=4 4324 B13R1.669 CSCCOc1ccc(c(c1)Br)C 7a_100011380479_100000212216 [0,1,0,0,0,0|3,0,0]=4 4325 B13R1.669 CSCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000212216 [0,1,0,0,0,0|3,0,0]=4 4326 B13R1.669 CSCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000212216 [0,1,0,0,0,0|3,0,0]=4 4327 B13R1.669 CSCCOc1ccc(c(c1)Br)F 34a_100000693481_100000212216 [0,1,0,0,0,0|3,0,0]=4 4328 B13R1.669 CSCCOc1ccc(c(c1)Br)F 7a_100000693481_100000212216 [0,1,0,0,0,0|3,0,0]=4 4329 B13R1.669 CSCCOc1ccc(c(c1)Br)I 34a_100000701344_100000212216 [0,1,0,0,0,0|3,0,0]=4 4330 B13R1.669 CSCCOc1ccc(c(c1)Br)I 7a_100000701344_100000212216 [0,1,0,0,0,0|3,0,0]=4 4331 B13R1.669 CSCCOc1ccc(c(c1)Br)N 34a_100012001276_100000212216 [0,1,0,0,0,0|3,0,0]=4 4332 B13R1.669 CSCCOc1ccc(c(c1)Br)N 7a_100012001276_100000212216 [0,1,0,0,0,0|3,0,0]=4 4333 B13R1.669 CSCCOc1ccc(c(c1)C)Br 34a_100000690111_100000212216 [0,1,0,0,0,0|3,0,0]=4 4334 B13R1.669 CSCCOc1ccc(c(c1)C)Br 7a_100000690111_100000212216 [0,1,0,0,0,0|3,0,0]=4 4335 B13R1.669 CSCCOc1ccc(c(c1)C)C 34a_100000210932_100000212216 [0,1,0,0,0,0|3,0,0]=4 4336 B13R1.669 CSCCOc1ccc(c(c1)C)C 62a_200000210301_200011210794 [0,1,0,0,0,0|3,0,0]=4 4337 B13R1.669 CSCCOc1ccc(c(c1)C)C 62a_200011210794_200000210301 [0,1,0,0,0,0|3,0,0]=4 4338 B13R1.669 CSCCOc1ccc(c(c1)C)C 7a_100000210932_100000212216 [0,1,0,0,0,0|3,0,0]=4 4339 B13R1.669 CSCCOc1ccc(c(c1)C)Cl 34a_100000211092_100000212216 [0,1,0,0,0,0|3,0,0]=4 4340 B13R1.669 CSCCOc1ccc(c(c1)C)Cl 7a_100000211092_100000212216 [0,1,0,0,0,0|3,0,0]=4 4341 B13R1.669 CSCCOc1ccc(c(c1)C)F 34a_100000751312_100000212216 [0,1,0,0,0,0|3,0,0]=4 4342 B13R1.669 CSCCOc1ccc(c(c1)C)F 7a_100000751312_100000212216 [0,1,0,0,0,0|3,0,0]=4 4343 B13R1.669 CSCCOc1ccc(c(c1)C)I 34a_100000729255_100000212216 [0,1,0,0,0,0|3,0,0]=4 4344 B13R1.669 CSCCOc1ccc(c(c1)C)I 7a_100000729255_100000212216 [0,1,0,0,0,0|3,0,0]=4 4345 B13R1.669 CSCCOc1ccc(c(c1)C)N 34a_100000756630_100000212216 [0,1,0,0,0,0|3,0,0]=4 4346 B13R1.669 CSCCOc1ccc(c(c1)C)N 7a_100000756630_100000212216 [0,1,0,0,0,0|3,0,0]=4 4347 B13R1.669 CSCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000212216 [0,1,0,0,0,0|3,0,0]=4 4348 B13R1.669 CSCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000212216 [0,1,0,0,0,0|3,0,0]=4 4349 B13R1.669 CSCCOc1ccc(c(c1)Cl)C 34a_100011265682_100000212216 [0,1,0,0,0,0|3,0,0]=4 4350 B13R1.669 CSCCOc1ccc(c(c1)Cl)C 7a_100011265682_100000212216 [0,1,0,0,0,0|3,0,0]=4 4351 B13R1.669 CSCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000212216 [0,1,0,0,0,0|3,0,0]=4 4352 B13R1.669 CSCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000212216 [0,1,0,0,0,0|3,0,0]=4 4353 B13R1.669 CSCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000212216 [0,1,0,0,0,0|3,0,0]=4 4354 B13R1.669 CSCCOc1ccc(c(c1)Cl)F 62a_100011936913_200000210301 [0,1,0,0,0,0|3,0,0]=4 4355 B13R1.669 CSCCOc1ccc(c(c1)Cl)F 62a_200000210301_100011936913 [0,1,0,0,0,0|3,0,0]=4 4356 B13R1.669 CSCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000212216 [0,1,0,0,0,0|3,0,0]=4 4357 B13R1.669 CSCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000212216 [0,1,0,0,0,0|3,0,0]=4 4358 B13R1.669 CSCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000212216 [0,1,0,0,0,0|3,0,0]=4 4359 B13R1.669 CSCCOc1ccc(c(c1)Cl)N 34a_100011215599_100000212216 [0,1,0,0,0,0|3,0,0]=4 4360 B13R1.669 CSCCOc1ccc(c(c1)Cl)N 7a_100011215599_100000212216 [0,1,0,0,0,0|3,0,0]=4 4361 B13R1.669 CSCCOc1ccc(c(c1)F)Br 34a_100000755031_100000212216 [0,1,0,0,0,0|3,0,0]=4 4362 B13R1.669 CSCCOc1ccc(c(c1)F)Br 7a_100000755031_100000212216 [0,1,0,0,0,0|3,0,0]=4 4363 B13R1.669 CSCCOc1ccc(c(c1)F)C 34a_100000722560_100000212216 [0,1,0,0,0,0|3,0,0]=4 4364 B13R1.669 CSCCOc1ccc(c(c1)F)C 7a_100000722560_100000212216 [0,1,0,0,0,0|3,0,0]=4 4365 B13R1.669 CSCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000212216 [0,1,0,0,0,0|3,0,0]=4 4366 B13R1.669 CSCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000212216 [0,1,0,0,0,0|3,0,0]=4 4367 B13R1.669 CSCCOc1ccc(c(c1)F)F 34a_100000181275_100000212216 [0,1,0,0,0,0|3,0,0]=4 4368 B13R1.669 CSCCOc1ccc(c(c1)F)F 7a_100000181275_100000212216 [0,1,0,0,0,0|3,0,0]=4 4369 B13R1.669 CSCCOc1ccc(c(c1)F)I 34a_100009990212_100000212216 [0,1,0,0,0,0|3,0,0]=4 4370 B13R1.669 CSCCOc1ccc(c(c1)F)I 7a_100009990212_100000212216 [0,1,0,0,0,0|3,0,0]=4 4371 B13R1.669 CSCCOc1ccc(c(c1)F)N 34a_100000759473_100000212216 [0,1,0,0,0,0|3,0,0]=4 4372 B13R1.669 CSCCOc1ccc(c(c1)F)N 7a_100000759473_100000212216 [0,1,0,0,0,0|3,0,0]=4 4373 B13R1.669 CSCCOc1ccc(c(c1)I)Br 34a_100012339312_100000212216 [0,1,0,0,0,0|3,0,0]=4 4374 B13R1.669 CSCCOc1ccc(c(c1)I)Br 7a_100012339312_100000212216 [0,1,0,0,0,0|3,0,0]=4 4375 B13R1.669 CSCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000212216 [0,1,0,0,0,0|3,0,0]=4 4376 B13R1.669 CSCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000212216 [0,1,0,0,0,0|3,0,0]=4 4377 B13R1.669 CSCCOc1ccc(c(c1)I)N 34a_100010084370_100000212216 [0,1,0,0,0,0|3,0,0]=4 4378 B13R1.669 CSCCOc1ccc(c(c1)I)N 7a_100010084370_100000212216 [0,1,0,0,0,0|3,0,0]=4 4379 B13R1.669 CSCCOc1ccc(c(c1)N)Br 34a_100011999798_100000212216 [0,1,0,0,0,0|3,0,0]=4 4380 B13R1.669 CSCCOc1ccc(c(c1)N)Br 7a_100011999798_100000212216 [0,1,0,0,0,0|3,0,0]=4 4381 B13R1.669 CSCCOc1ccc(c(c1)N)C 34a_100011216113_100000212216 [0,1,0,0,0,0|3,0,0]=4 4382 B13R1.669 CSCCOc1ccc(c(c1)N)C 7a_100011216113_100000212216 [0,1,0,0,0,0|3,0,0]=4 4383 B13R1.669 CSCCOc1ccc(c(c1)N)Cl 34a_100011934297_100000212216 [0,1,0,0,0,0|3,0,0]=4 4384 B13R1.669 CSCCOc1ccc(c(c1)N)F 34a_100012017239_100000212216 [0,1,0,0,0,0|3,0,0]=4 4385 B13R1.669 CSCCOc1ccc(c(c1)N)F 7a_100012017239_100000212216 [0,1,0,0,0,0|3,0,0]=4 4386 B13R1.669 CSCCOc1ccc(c(c1)N)N 34a_100025771000_100000212216 [0,1,0,0,0,0|3,0,0]=4 4387 B13R1.669 CSCCSc1c[nH]c(=O)c(c1)O 62a_100000212216_100009814561 [0,1,0,0,0,0|2,0,1]=4 4388 B13R1.669 CSCCSc1cc(c(cn1)C)O 62a_100000212216_100000704368 [0,1,0,0,0,0|3,0,0]=4 4389 B13R1.669 CSCCSc1cc(c(cn1)C)O 62a_100000704368_100000751147 [0,1,0,0,0,0|3,0,0]=4 4390 B13R1.669 CSCCSc1cc(c(cn1)F)O 62a_100000212216_100009854642 [0,1,0,0,0,0|3,0,0]=4 4391 B13R1.669 CSCCSc1cc(c(cn1)F)O 62a_100009854642_100000751147 [0,1,0,0,0,0|3,0,0]=4 4392 B13R1.669 CSCCSc1cc(c(cn1)O)C 62a_100000212216_100000692680 [0,1,0,0,0,0|3,0,0]=4 4393 B13R1.669 CSCCSc1cc(c(cn1)O)N 62a_100000212216_100009819941 [0,1,0,0,0,0|3,0,0]=4 4394 B13R1.669 CSCCSc1cc(c(cn1)O)N 62a_100009819941_100000751147 [0,1,0,0,0,0|3,0,0]=4 4395 B13R1.669 CSCCSc1ccc(c(c1)Br)Br 62a_100000212216_100012356285 [0,1,0,0,0,0|3,0,0]=4 4396 B13R1.669 CSCCSc1ccc(c(c1)Br)Br 62a_100012356285_100000751147 [0,1,0,0,0,0|3,0,0]=4 4397 B13R1.669 CSCCSc1ccc(c(c1)Br)C 62a_100000212216_100011847877 [0,1,0,0,0,0|3,0,0]=4 4398 B13R1.669 CSCCSc1ccc(c(c1)Br)C 62a_100011847877_100000751147 [0,1,0,0,0,0|3,0,0]=4 4399 B13R1.669 CSCCSc1ccc(c(c1)Br)Cl 62a_100000212216_100012353702 [0,1,0,0,0,0|3,0,0]=4 4400 B13R1.669 CSCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000751147 [0,1,0,0,0,0|3,0,0]=4 4401 B13R1.669 CSCCSc1ccc(c(c1)Br)F 62a_100000212216_100012047266 [0,1,0,0,0,0|3,0,0]=4 4402 B13R1.669 CSCCSc1ccc(c(c1)Br)F 62a_100012047266_100000751147 [0,1,0,0,0,0|3,0,0]=4 4403 B13R1.669 CSCCSc1ccc(c(c1)Br)N 62a_100000212216_100000750455 [0,1,0,0,0,0|3,0,0]=4 4404 B13R1.669 CSCCSc1ccc(c(c1)Br)N 62a_100000750455_100000751147 [0,1,0,0,0,0|3,0,0]=4 4405 B13R1.669 CSCCSc1ccc(c(c1)Br)O 62a_100000212216_100012361655 [0,1,0,0,0,0|2,0,0]=3 4406 B13R1.669 CSCCSc1ccc(c(c1)Br)O 62a_100012361655_100000751147 [0,1,0,0,0,0|2,0,0]=3 4407 B13R1.669 CSCCSc1ccc(c(c1)C)Br 62a_100000212216_100009813585 [0,1,0,0,0,0|3,0,0]=4 4408 B13R1.669 CSCCSc1ccc(c(c1)C)Br 62a_100009813585_100000751147 [0,1,0,0,0,0|3,0,0]=4 4409 B13R1.669 CSCCSc1ccc(c(c1)C)C 62a_100000212216_100011215607 [0,1,0,0,0,0|3,0,0]=4 4410 B13R1.669 CSCCSc1ccc(c(c1)C)C 62a_100011215607_100000751147 [0,1,0,0,0,0|3,0,0]=4 4411 B13R1.669 CSCCSc1ccc(c(c1)C)Cl 62a_100000049509_100000751147 [0,1,0,0,0,0|3,0,0]=4 4412 B13R1.669 CSCCSc1ccc(c(c1)C)Cl 62a_100000212216_100000049509 [0,1,0,0,0,0|3,0,0]=4 4413 B13R1.669 CSCCSc1ccc(c(c1)C)F 62a_100000212216_100011218330 [0,1,0,0,0,0|3,0,0]=4 4414 B13R1.669 CSCCSc1ccc(c(c1)C)F 62a_100011218330_100000751147 [0,1,0,0,0,0|3,0,0]=4 4415 B13R1.669 CSCCSc1ccc(c(c1)C)N 62a_100000211769_100000751147 [0,1,0,0,0,0|3,0,0]=4 4416 B13R1.669 CSCCSc1ccc(c(c1)C)N 62a_100000212216_100000211769 [0,1,0,0,0,0|3,0,0]=4 4417 B13R1.669 CSCCSc1ccc(c(c1)C)O 62a_100000212216_100000186361 [0,1,0,0,0,0|2,0,0]=3 4418 B13R1.669 CSCCSc1ccc(c(c1)Cl)Br 62a_100000212216_100012047281 [0,1,0,0,0,0|3,0,0]=4 4419 B13R1.669 CSCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000751147 [0,1,0,0,0,0|3,0,0]=4 4420 B13R1.669 CSCCSc1ccc(c(c1)Cl)C 62a_100000212216_100011216363 [0,1,0,0,0,0|3,0,0]=4 4421 B13R1.669 CSCCSc1ccc(c(c1)Cl)C 62a_100011216363_100000751147 [0,1,0,0,0,0|3,0,0]=4 4422 B13R1.669 CSCCSc1ccc(c(c1)Cl)Cl 62a_100000212216_100011214914 [0,1,0,0,0,0|3,0,0]=4 4423 B13R1.669 CSCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000751147 [0,1,0,0,0,0|3,0,0]=4 4424 B13R1.669 CSCCSc1ccc(c(c1)Cl)F 62a_100000212216_100011215976 [0,1,0,0,0,0|3,0,0]=4 4425 B13R1.669 CSCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000751147 [0,1,0,0,0,0|3,0,0]=4 4426 B13R1.669 CSCCSc1ccc(c(c1)Cl)N 62a_100000212216_100011218065 [0,1,0,0,0,0|3,0,0]=4 4427 B13R1.669 CSCCSc1ccc(c(c1)Cl)N 62a_100011218065_100000751147 [0,1,0,0,0,0|3,0,0]=4 4428 B13R1.669 CSCCSc1ccc(c(c1)Cl)O 62a_100000212216_100012360047 [0,1,0,0,0,0|2,0,0]=3 4429 B13R1.669 CSCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000751147 [0,1,0,0,0,0|2,0,0]=3 4430 B13R1.669 CSCCSc1ccc(c(c1)F)Br 62a_100000212216_100000685389 [0,1,0,0,0,0|3,0,0]=4 4431 B13R1.669 CSCCSc1ccc(c(c1)F)Br 62a_100000685389_100000751147 [0,1,0,0,0,0|3,0,0]=4 4432 B13R1.669 CSCCSc1ccc(c(c1)F)C 62a_100000212216_100000720648 [0,1,0,0,0,0|3,0,0]=4 4433 B13R1.669 CSCCSc1ccc(c(c1)F)C 62a_100000720648_100000751147 [0,1,0,0,0,0|3,0,0]=4 4434 B13R1.669 CSCCSc1ccc(c(c1)F)Cl 62a_100000212216_100011216805 [0,1,0,0,0,0|3,0,0]=4 4435 B13R1.669 CSCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000751147 [0,1,0,0,0,0|3,0,0]=4 4436 B13R1.669 CSCCSc1ccc(c(c1)F)F 62a_100000212216_100000703953 [0,1,0,0,0,0|3,0,0]=4 4437 B13R1.669 CSCCSc1ccc(c(c1)F)F 62a_100000703953_100000751147 [0,1,0,0,0,0|3,0,0]=4 4438 B13R1.669 CSCCSc1ccc(c(c1)F)N 62a_100000212216_100011215594 [0,1,0,0,0,0|3,0,0]=4 4439 B13R1.669 CSCCSc1ccc(c(c1)F)N 62a_100011215594_100000751147 [0,1,0,0,0,0|3,0,0]=4 4440 B13R1.669 CSCCSc1ccc(c(c1)F)O 62a_100000185481_100000751147 [0,1,0,0,0,0|2,0,0]=3 4441 B13R1.669 CSCCSc1ccc(c(c1)F)O 62a_100000212216_100000185481 [0,1,0,0,0,0|2,0,0]=3 4442 B13R1.669 CSCCSc1ccc(c(c1)N)Br 62a_100000212216_100000750456 [0,1,0,0,0,0|3,0,0]=4 4443 B13R1.669 CSCCSc1ccc(c(c1)N)Br 62a_100000750456_100000751147 [0,1,0,0,0,0|3,0,0]=4 4444 B13R1.669 CSCCSc1ccc(c(c1)N)C 62a_100000212216_100000761890 [0,1,0,0,0,0|3,0,0]=4 4445 B13R1.669 CSCCSc1ccc(c(c1)N)C 62a_100000761890_100000751147 [0,1,0,0,0,0|3,0,0]=4 4446 B13R1.669 CSCCSc1ccc(c(c1)N)Cl 62a_100000212216_200000761891 [0,1,0,0,0,0|3,0,0]=4 4447 B13R1.669 CSCCSc1ccc(c(c1)N)Cl 62a_200000761891_100000751147 [0,1,0,0,0,0|3,0,0]=4 4448 B13R1.669 CSCCSc1ccc(c(c1)N)F 62a_100000212216_100000740924 [0,1,0,0,0,0|3,0,0]=4 4449 B13R1.669 CSCCSc1ccc(c(c1)N)F 62a_100000740924_100000751147 [0,1,0,0,0,0|3,0,0]=4 4450 B13R1.669 CSCCSc1ccc(c(c1)N)N 62a_100000212216_100011534411 [0,1,0,0,0,0|3,0,0]=4 4451 B13R1.669 CSCCSc1ccc(c(c1)N)N 62a_100000741789_100000751147 [0,1,0,0,0,0|3,0,0]=4 4452 B13R1.669 CSCCSc1ccc(c(c1)N)O 62a_100000212216_100000752626 [0,1,0,0,0,0|2,0,0]=3 4453 B13R1.669 CSCCSc1ccc(c(c1)N)O 62a_100000752626_100000751147 [0,1,0,0,0,0|2,0,0]=3 4454 B13R1.669 CSCCSc1ccc(c(c1)O)Br 62a_100000212216_100012356990 [0,1,0,0,0,0|2,0,0]=3 4455 B13R1.669 CSCCSc1ccc(c(c1)O)Br 62a_100012356990_100000751147 [0,1,0,0,0,0|2,0,0]=3 4456 B13R1.669 CSCCSc1ccc(c(c1)O)C 62a_100000212216_100000685420 [0,1,0,0,0,0|2,0,0]=3 4457 B13R1.669 CSCCSc1ccc(c(c1)O)C 62a_100000685420_100000751147 [0,1,0,0,0,0|2,0,0]=3 4458 B13R1.669 CSCCSc1ccc(c(c1)O)Cl 62a_100000212216_100011356854 [0,1,0,0,0,0|2,0,0]=3 4459 B13R1.669 CSCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000751147 [0,1,0,0,0,0|2,0,0]=3 4460 B13R1.669 CSCCSc1ccc(c(c1)O)F 62a_100000212216_100000686035 [0,1,0,0,0,0|2,0,0]=3 4461 B13R1.669 CSCCSc1ccc(c(c1)O)F 62a_100000686035_100000751147 [0,1,0,0,0,0|2,0,0]=3 4462 B13R1.669 CSCCSc1ccc(c(c1)O)N 62a_100000212216_100000739049 [0,1,0,0,0,0|2,0,0]=3 4463 B13R1.669 CSCCSc1ccc(c(c1)O)N 62a_100000739049_100000751147 [0,1,0,0,0,0|2,0,0]=3 4464 B13R1.669 CSCCSc1ccc(c(c1)O)O 62a_100000212216_100009813601 [0,1,0,0,0,0|1,0,0]=2 4465 B13R1.669 CSCCSc1ccc(c(n1)Br)O 62a_100000212216_100000725334 [0,1,0,0,0,0|3,0,0]=4 4466 B13R1.669 CSCCSc1ccc(c(n1)Br)O 62a_100000725334_100000751147 [0,1,0,0,0,0|3,0,0]=4 4467 B13R1.669 CSCCSc1ccc(c(n1)C)O 62a_100000212216_100010233687 [0,1,0,0,0,0|3,0,0]=4 4468 B13R1.669 CSCCSc1ccc(c(n1)C)O 62a_100010233687_100000751147 [0,1,0,0,0,0|3,0,0]=4 4469 B13R1.669 CSCCSc1ccc(c(n1)Cl)O 62a_100000212216_100000721234 [0,1,0,0,0,0|3,0,0]=4 4470 B13R1.669 CSCCSc1ccc(c(n1)F)O 62a_100000212216_100009819667 [0,1,0,0,0,0|3,0,0]=4 4471 B13R1.669 CSCCSc1ccc(c(n1)F)O 62a_100009819667_100000751147 [0,1,0,0,0,0|3,0,0]=4 4472 B13R1.669 CSCCSc1ccc(c(n1)N)O 62a_100000212216_100000685527 [0,1,0,0,0,0|3,0,0]=4 4473 B13R1.669 CSCCSc1ccc(c(n1)N)O 62a_100000685527_100000751147 [0,1,0,0,0,0|3,0,0]=4 4474 B13R1.669 CSCCSc1ccc(c(n1)O)F 62a_100000212216_100010729010 [0,1,0,0,0,0|3,0,0]=4 4475 B13R1.669 CSCCSc1ccc(c(n1)O)N 62a_100000718904_100000751147 [0,1,0,0,0,0|3,0,0]=4 4476 B13R1.669 CSCCSc1cnc(c(c1)C)O 62a_100000212216_100000685391 [0,1,0,0,0,0|3,0,0]=4 4477 B13R1.669 CSCCSc1cnc(c(c1)C)O 62a_100000685391_100000751147 [0,1,0,0,0,0|3,0,0]=4 4478 B13R1.669 CSCCSc1cnc(c(c1)Cl)O 62a_100000212216_100010238531 [0,1,0,0,0,0|3,0,0]=4 4479 B13R1.669 CSCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000751147 [0,1,0,0,0,0|3,0,0]=4 4480 B13R1.669 CSCCSc1cnc(c(c1)N)O 62a_100000212216_100000743729 [0,1,0,0,0,0|3,0,0]=4 4481 B13R1.669 CSCCSc1cnc(c(c1)N)O 62a_100000743729_100000751147 [0,1,0,0,0,0|3,0,0]=4 4482 B13R1.669 CSCCSc1cnc(c(c1)O)C 62a_100000212216_100009864810 [0,1,0,0,0,0|3,0,0]=4 4483 B13R1.669 CSCCSc1cnc(c(c1)O)C 62a_100009864810_100000751147 [0,1,0,0,0,0|3,0,0]=4 4484 B13R1.669 CSCCSc1cnc(c(c1)O)F 62a_100000212216_100009819871 [0,1,0,0,0,0|3,0,0]=4 4485 B13R1.669 CSCCSc1cnc(c(c1)O)F 62a_100009819871_100000751147 [0,1,0,0,0,0|3,0,0]=4 4486 B13R1.669 CSCCSc1cnc(c(c1)O)N 62a_100000212216_100009819042 [0,1,0,0,0,0|3,0,0]=4 4487 B13R1.669 CSCCSc1cnc(c(c1)O)N 62a_100009819042_100000751147 [0,1,0,0,0,0|3,0,0]=4 4488 B13R1.669 CSCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100011218213 [0,1,0,0,0,0|3,0,0]=4 4489 B13R1.669 CSCNCc1ccc(c(c1)Br)Br 34a_100012351559_100011218213 [0,1,0,0,0,0|3,0,0]=4 4490 B13R1.669 CSCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100011218213 [0,1,0,0,0,0|3,0,0]=4 4491 B13R1.669 CSCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100011218213 [0,1,0,0,0,0|3,0,0]=4 4492 B13R1.669 CSCNCc1ccc(c(c1)Br)F 2230a_100015193890_100011218213 [0,1,0,0,0,0|3,0,0]=4 4493 B13R1.669 CSCNCc1ccc(c(c1)Br)F 34a_100015193890_100011218213 [0,1,0,0,0,0|3,0,0]=4 4494 B13R1.669 CSCNCc1ccc(c(c1)C)Br 2230a_100015205234_100011218213 [0,1,0,0,0,0|3,0,0]=4 4495 B13R1.669 CSCNCc1ccc(c(c1)C)Br 34a_100015205234_100011218213 [0,1,0,0,0,0|3,0,0]=4 4496 B13R1.669 CSCNCc1ccc(c(c1)C)C 2230a_100025706692_100011218213 [0,1,0,0,0,0|3,0,0]=4 4497 B13R1.669 CSCNCc1ccc(c(c1)C)C 34a_100025706692_100011218213 [0,1,0,0,0,0|3,0,0]=4 4498 B13R1.669 CSCNCc1ccc(c(c1)C)F 2230a_100000239911_100011218213 [0,1,0,0,0,0|3,0,0]=4 4499 B13R1.669 CSCNCc1ccc(c(c1)C)F 34a_100000239911_100011218213 [0,1,0,0,0,0|3,0,0]=4 4500 B13R1.669 CSCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100011218213 [0,1,0,0,0,0|3,0,0]=4 4501 B13R1.669 CSCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100011218213 [0,1,0,0,0,0|3,0,0]=4 4502 B13R1.669 CSCNCc1ccc(c(c1)Cl)C 2230a_102495364989_100011218213 [0,1,0,0,0,0|3,0,0]=4 4503 B13R1.669 CSCNCc1ccc(c(c1)Cl)C 34a_102495364989_100011218213 [0,1,0,0,0,0|3,0,0]=4 4504 B13R1.669 CSCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100011218213 [0,1,0,0,0,0|3,0,0]=4 4505 B13R1.669 CSCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100011218213 [0,1,0,0,0,0|3,0,0]=4 4506 B13R1.669 CSCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100011218213 [0,1,0,0,0,0|3,0,0]=4 4507 B13R1.669 CSCNCc1ccc(c(c1)Cl)F 34a_100000749334_100011218213 [0,1,0,0,0,0|3,0,0]=4 4508 B13R1.669 CSCNCc1ccc(c(c1)F)Br 2230a_100000755036_100011218213 [0,1,0,0,0,0|3,0,0]=4 4509 B13R1.669 CSCNCc1ccc(c(c1)F)Br 34a_100000755036_100011218213 [0,1,0,0,0,0|3,0,0]=4 4510 B13R1.669 CSCNCc1ccc(c(c1)F)C 2230a_100102708794_100011218213 [0,1,0,0,0,0|3,0,0]=4 4511 B13R1.669 CSCNCc1ccc(c(c1)F)C 34a_100102708794_100011218213 [0,1,0,0,0,0|3,0,0]=4 4512 B13R1.669 CSCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100011218213 [0,1,0,0,0,0|3,0,0]=4 4513 B13R1.669 CSCNCc1ccc(c(c1)F)Cl 34a_100011219866_100011218213 [0,1,0,0,0,0|3,0,0]=4 4514 B13R1.669 CSCNCc1ccc(c(c1)F)F 2230a_100000737897_100011218213 [0,1,0,0,0,0|3,0,0]=4 4515 B13R1.669 CSCNCc1ccc(c(c1)F)F 34a_100000737897_100011218213 [0,1,0,0,0,0|3,0,0]=4 4516 B13R1.669 CSCNCc1ccc(c(c1)F)O 34a_100000758358_100011218213 [0,1,0,0,0,0|2,0,0]=3 4517 B13R1.669 CSCNCc1ccc(c(c1)O)Cl 34a_100020636435_100011218213 [0,1,0,0,0,0|2,0,0]=3 4518 B13R1.669 CSCNCc1ccc(c(c1)O)F 34a_100160469508_100011218213 [0,1,0,0,0,0|2,0,0]=3 4519 B13R1.669 CSCNCc1ccc(c(c1)O)O 34a_100000010075_100011218213 [0,1,0,0,0,0|1,0,0]=2 4520 B13R1.669 CSCOCc1ccc(c(c1)Br)C 34a_100000708995_100011218213 [0,1,0,0,0,0|3,0,0]=4 4521 B13R1.669 CSCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100011218213 [0,1,0,0,0,0|3,0,0]=4 4522 B13R1.669 CSCOCc1ccc(c(c1)Br)F 34a_100000246287_100011218213 [0,1,0,0,0,0|3,0,0]=4 4523 B13R1.669 CSCOCc1ccc(c(c1)C)Br 34a_100000718852_100011218213 [0,1,0,0,0,0|3,0,0]=4 4524 B13R1.669 CSCOCc1ccc(c(c1)C)C 34a_100011215342_100011218213 [0,1,0,0,0,0|3,0,0]=4 4525 B13R1.669 CSCOCc1ccc(c(c1)C)F 34a_100011219793_100011218213 [0,1,0,0,0,0|3,0,0]=4 4526 B13R1.669 CSCOCc1ccc(c(c1)C)N 34a_200011997030_100011218213 [0,1,0,0,0,0|3,0,0]=4 4527 B13R1.669 CSCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100011218213 [0,1,0,0,0,0|3,0,0]=4 4528 B13R1.669 CSCOCc1ccc(c(c1)Cl)C 34a_100011290783_100011218213 [0,1,0,0,0,0|3,0,0]=4 4529 B13R1.669 CSCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100011218213 [0,1,0,0,0,0|3,0,0]=4 4530 B13R1.669 CSCOCc1ccc(c(c1)Cl)F 34a_100011217911_100011218213 [0,1,0,0,0,0|3,0,0]=4 4531 B13R1.669 CSCOCc1ccc(c(c1)Cl)I 34a_100000718186_100011218213 [0,1,0,0,0,0|3,0,0]=4 4532 B13R1.669 CSCOCc1ccc(c(c1)F)Br 34a_100011533735_100011218213 [0,1,0,0,0,0|3,0,0]=4 4533 B13R1.669 CSCOCc1ccc(c(c1)F)C 34a_100000702247_100011218213 [0,1,0,0,0,0|3,0,0]=4 4534 B13R1.669 CSCOCc1ccc(c(c1)F)Cl 34a_100011218299_100011218213 [0,1,0,0,0,0|3,0,0]=4 4535 B13R1.669 CSCOCc1ccc(c(c1)F)F 34a_100011215442_100011218213 [0,1,0,0,0,0|3,0,0]=4 4536 B13R1.669 CSCOCc1ccc(c(c1)F)I 34a_100010149597_100011218213 [0,1,0,0,0,0|3,0,0]=4 4537 B13R1.669 CSCOCc1ccc(c(c1)F)N 34a_100011217239_100011218213 [0,1,0,0,0,0|3,0,0]=4 4538 B13R1.669 CSCOCc1ccc(c(c1)I)C 34a_100000050133_100011218213 [0,1,0,0,0,0|3,0,0]=4 4539 B13R1.669 CSCOCc1ccc(c(c1)I)F 34a_100000049585_100011218213 [0,1,0,0,0,0|3,0,0]=4 4540 B13R1.669 CSCOCc1ccc(c(c1)N)Br 34a_100012347568_100011218213 [0,1,0,0,0,0|3,0,0]=4 4541 B13R1.669 CSCOCc1ccc(c(c1)N)C 34a_100000758420_100011218213 [0,1,0,0,0,0|3,0,0]=4 4542 B13R1.669 CSCOCc1ccc(c(c1)N)Cl 34a_106256033963_100011218213 [0,1,0,0,0,0|3,0,0]=4 4543 B13R1.669 CSCOCc1ccc(c(c1)N)F 34a_102125399562_100011218213 [0,1,0,0,0,0|3,0,0]=4 4544 B13R1.669 CSCSCc1cc(=O)c(co1)O 62a_100011218213_100000010605 [0,1,0,0,0,0|2,0,1]=4 4545 B13R1.669 CSCSCc1ccc(c(c1)Br)Br 62a_100011218213_100012353900 [0,1,0,0,0,0|3,0,0]=4 4546 B13R1.669 CSCSCc1ccc(c(c1)Br)Br 62a_100012353900_100011218213 [0,1,0,0,0,0|3,0,0]=4 4547 B13R1.669 CSCSCc1ccc(c(c1)Br)C 62a_100011218213_100012232412 [0,1,0,0,0,0|3,0,0]=4 4548 B13R1.669 CSCSCc1ccc(c(c1)Br)C 62a_100012232412_100011218213 [0,1,0,0,0,0|3,0,0]=4 4549 B13R1.669 CSCSCc1ccc(c(c1)Br)Cl 62a_100011218213_100012353894 [0,1,0,0,0,0|3,0,0]=4 4550 B13R1.669 CSCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100011218213 [0,1,0,0,0,0|3,0,0]=4 4551 B13R1.669 CSCSCc1ccc(c(c1)Br)F 62a_100011206884_100011218213 [0,1,0,0,0,0|3,0,0]=4 4552 B13R1.669 CSCSCc1ccc(c(c1)Br)F 62a_100011218213_100011206884 [0,1,0,0,0,0|3,0,0]=4 4553 B13R1.669 CSCSCc1ccc(c(c1)C)Br 62a_100000727479_100011218213 [0,1,0,0,0,0|3,0,0]=4 4554 B13R1.669 CSCSCc1ccc(c(c1)C)Br 62a_100011218213_100000727479 [0,1,0,0,0,0|3,0,0]=4 4555 B13R1.669 CSCSCc1ccc(c(c1)C)C 62a_100000742320_100011218213 [0,1,0,0,0,0|3,0,0]=4 4556 B13R1.669 CSCSCc1ccc(c(c1)C)C 62a_100011218213_100000742320 [0,1,0,0,0,0|3,0,0]=4 4557 B13R1.669 CSCSCc1ccc(c(c1)C)Cl 62a_100011218213_100012184735 [0,1,0,0,0,0|3,0,0]=4 4558 B13R1.669 CSCSCc1ccc(c(c1)C)Cl 62a_100012184735_100011218213 [0,1,0,0,0,0|3,0,0]=4 4559 B13R1.669 CSCSCc1ccc(c(c1)C)F 62a_100011216667_100011218213 [0,1,0,0,0,0|3,0,0]=4 4560 B13R1.669 CSCSCc1ccc(c(c1)C)F 62a_100011218213_100011216667 [0,1,0,0,0,0|3,0,0]=4 4561 B13R1.669 CSCSCc1ccc(c(c1)Cl)Br 62a_100011218213_100012353895 [0,1,0,0,0,0|3,0,0]=4 4562 B13R1.669 CSCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100011218213 [0,1,0,0,0,0|3,0,0]=4 4563 B13R1.669 CSCSCc1ccc(c(c1)Cl)C 62a_100011218213_100011823929 [0,1,0,0,0,0|3,0,0]=4 4564 B13R1.669 CSCSCc1ccc(c(c1)Cl)C 62a_100011823929_100011218213 [0,1,0,0,0,0|3,0,0]=4 4565 B13R1.669 CSCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100011218213 [0,1,0,0,0,0|3,0,0]=4 4566 B13R1.669 CSCSCc1ccc(c(c1)Cl)Cl 62a_100011218213_100000184707 [0,1,0,0,0,0|3,0,0]=4 4567 B13R1.669 CSCSCc1ccc(c(c1)Cl)F 62a_100000717365_100011218213 [0,1,0,0,0,0|3,0,0]=4 4568 B13R1.669 CSCSCc1ccc(c(c1)Cl)F 62a_100011218213_100011934319 [0,1,0,0,0,0|3,0,0]=4 4569 B13R1.669 CSCSCc1ccc(c(c1)Cl)I 62a_100011218213_100012349665 [0,1,0,0,0,0|3,0,0]=4 4570 B13R1.669 CSCSCc1ccc(c(c1)Cl)I 62a_100012349665_100011218213 [0,1,0,0,0,0|3,0,0]=4 4571 B13R1.669 CSCSCc1ccc(c(c1)F)Br 62a_100000767054_100011218213 [0,1,0,0,0,0|3,0,0]=4 4572 B13R1.669 CSCSCc1ccc(c(c1)F)Br 62a_100011218213_100000767054 [0,1,0,0,0,0|3,0,0]=4 4573 B13R1.669 CSCSCc1ccc(c(c1)F)C 62a_100011217369_100011218213 [0,1,0,0,0,0|3,0,0]=4 4574 B13R1.669 CSCSCc1ccc(c(c1)F)C 62a_100011218213_100011217369 [0,1,0,0,0,0|3,0,0]=4 4575 B13R1.669 CSCSCc1ccc(c(c1)F)Cl 62a_100000716492_100011218213 [0,1,0,0,0,0|3,0,0]=4 4576 B13R1.669 CSCSCc1ccc(c(c1)F)Cl 62a_100011218213_100000716492 [0,1,0,0,0,0|3,0,0]=4 4577 B13R1.669 CSCSCc1ccc(c(c1)F)F 62a_100000757363_100011218213 [0,1,0,0,0,0|3,0,0]=4 4578 B13R1.669 CSCSCc1ccc(c(c1)F)F 62a_100011218213_100000757363 [0,1,0,0,0,0|3,0,0]=4 4579 B13R1.669 CSCSCc1ccc(c(c1)F)I 62a_100010149604_100011218213 [0,1,0,0,0,0|3,0,0]=4 4580 B13R1.669 CSCSCc1ccc(c(c1)F)I 62a_100011218213_100010149604 [0,1,0,0,0,0|3,0,0]=4 4581 B13R1.669 CSCSCc1ccc(c(c1)I)Br 62a_100010146616_100011218213 [0,1,0,0,0,0|3,0,0]=4 4582 B13R1.669 CSCSCc1ccc(c(c1)I)Br 62a_100011218213_100010146616 [0,1,0,0,0,0|3,0,0]=4 4583 B13R1.669 CSCSCc1ccc(c(c1)I)C 62a_100010206137_100011218213 [0,1,0,0,0,0|3,0,0]=4 4584 B13R1.669 CSCSCc1ccc(c(c1)I)C 62a_100011218213_100010206137 [0,1,0,0,0,0|3,0,0]=4 4585 B13R1.669 CSCSCc1ccc(c(c1)I)F 62a_100010188208_100011218213 [0,1,0,0,0,0|3,0,0]=4 4586 B13R1.669 CSCSCc1ccc(c(c1)I)F 62a_100011218213_100010188208 [0,1,0,0,0,0|3,0,0]=4 4587 B13R1.669 Cc1cc(ccc1Cl)OCCN[13CH3] 2230a_100025718798_200025704644 [0,1,0,0,0,0|2,0,0]=3 4588 B13R1.669 Cc1cc(ccc1Cl)OCCN[13CH3] 34a_100025718798_200025704644 [0,1,0,0,0,0|2,0,0]=3 4589 B13R1.669 Cc1cc(ccc1O)NCCC#N 7a_100011218179_100000184422 [0,1,0,0,0,0|3,0,0]=4 4590 B13R1.669 Cc1cc(ccc1O)NCCCF 34a_100011218179_100011934791 [0,1,0,0,0,0|3,0,0]=4 4591 B13R1.669 Cc1cc(ccc1O)NCCCF 7a_100011218179_100011934791 [0,1,0,0,0,0|3,0,0]=4 4592 B13R1.669 Cc1cc(ccc1O)NCCCO 34a_100011218179_100000230001 [0,1,0,0,0,0|3,0,0]=4 4593 B13R1.669 Cc1cc(ccc1O)NCCCO 7a_100011218179_100011215043 [0,1,0,0,0,0|3,0,0]=4 4594 B13R1.669 Cc1cc(ccc1O)SCCC#N 62a_100011215226_100000186361 [0,1,0,0,0,0|3,0,0]=4 4595 B13R1.669 Cc1cc(ccc1O)SCCCF 62a_100011934791_100000186361 [0,1,0,0,0,0|3,0,0]=4 4596 B13R1.669 Cc1cc(ccc1O)SCCCO 62a_100011215043_100000186361 [0,1,0,0,0,0|3,0,0]=4 4597 B13R1.669 Cc1ccc(cc1Br)SCCO[13CH3] 34a_100010989109_200025704644 [0,1,0,0,0,0|3,0,0]=4 4598 B13R1.669 Cc1ccc(cc1Br)SCCO[13CH3] 7a_100010989109_200025704644 [0,1,0,0,0,0|3,0,0]=4 4599 B13R1.669 Cc1ccc(cc1C)CCNCF 34a_100020591374_100015361967 [0,1,0,0,0,0|2,0,0]=3 4600 B13R1.669 Cc1ccc(cc1C)OCCN[13CH3] 2230a_100015185357_200025704644 [0,1,0,0,0,0|2,0,0]=3 4601 B13R1.669 Cc1ccc(cc1C)OCCN[13CH3] 34a_100015185357_200025704644 [0,1,0,0,0,0|2,0,0]=3 4602 B13R1.669 Cc1ccc(cc1C)OCCS[13CH3] 62a_200011210794_200025704644 [0,1,0,0,0,0|3,0,0]=4 4603 B13R1.669 Cc1ccc(cc1C)OCCS[13CH3] 62a_200025704644_200011210794 [0,1,0,0,0,0|3,0,0]=4 4604 B13R1.669 Cc1ccc(cc1N)OCCO[13CH3] 34a_100012283766_200025704644 [0,1,0,0,0,0|3,0,0]=4 4605 B13R1.669 Cc1ccc(cc1N)OCCO[13CH3] 7a_100012283766_200025704644 [0,1,0,0,0,0|3,0,0]=4 4606 B13R1.669 Cc1ccc(cc1O)NCCC#N 7a_100000759471_100000184422 [0,1,0,0,0,0|3,0,0]=4 4607 B13R1.669 Cc1ccc(cc1O)NCCCF 34a_100000759471_100011934791 [0,1,0,0,0,0|3,0,0]=4 4608 B13R1.669 Cc1ccc(cc1O)NCCCF 7a_100000759471_100011934791 [0,1,0,0,0,0|3,0,0]=4 4609 B13R1.669 Cc1ccc(cc1O)NCCCO 34a_100000759471_100000230001 [0,1,0,0,0,0|3,0,0]=4 4610 B13R1.669 Cc1ccc(cc1O)NCCCO 7a_100000759471_100011215043 [0,1,0,0,0,0|3,0,0]=4 4611 B13R1.669 Cc1ccc(cc1O)SCCC#N 62a_100000685420_100011215226 [0,1,0,0,0,0|3,0,0]=4 4612 B13R1.669 Cc1ccc(cc1O)SCCC#N 62a_100011215226_100000685420 [0,1,0,0,0,0|3,0,0]=4 4613 B13R1.669 Cc1ccc(cc1O)SCCCF 62a_100000685420_100011934791 [0,1,0,0,0,0|3,0,0]=4 4614 B13R1.669 Cc1ccc(cc1O)SCCCF 62a_100011934791_100000685420 [0,1,0,0,0,0|3,0,0]=4 4615 B13R1.669 Cc1ccc(cc1O)SCCCO 62a_100000685420_100011215043 [0,1,0,0,0,0|3,0,0]=4 4616 B13R1.669 Cc1ccc(cc1O)SCCCO 62a_100011215043_100000685420 [0,1,0,0,0,0|3,0,0]=4 4617 B13R1.669 FCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100015361967 [0,1,0,0,0,0|2,0,0]=3 4618 B13R1.669 FCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100015361967 [0,1,0,0,0,0|2,0,0]=3 4619 B13R1.669 FCNCCc1ccc(c(c1)F)F 34a_200000706328_100015361967 [0,1,0,0,0,0|2,0,0]=3 4620 B13R1.669 FCOCCc1ccc(c(c1)Cl)Cl 34a_100011709245_100015361967 [0,1,0,0,0,0|3,0,0]=4 4621 B13R1.669 FCOCCc1ccc(c(c1)Cl)Cl 7a_100011709245_100015361967 [0,1,0,0,0,0|3,0,0]=4 4622 B13R1.669 FCOCCc1ccc(c(c1)Cl)F 34a_100011830478_100015361967 [0,1,0,0,0,0|3,0,0]=4 4623 B13R1.669 FCOCCc1ccc(c(c1)Cl)F 7a_100011830478_100015361967 [0,1,0,0,0,0|3,0,0]=4 4624 B13R1.669 FCOCCc1ccc(c(c1)F)Br 34a_100012921202_100015361967 [0,1,0,0,0,0|3,0,0]=4 4625 B13R1.669 FCOCCc1ccc(c(c1)F)Br 7a_100012921202_100015361967 [0,1,0,0,0,0|3,0,0]=4 4626 B13R1.669 FCOCCc1ccc(c(c1)F)Cl 34a_100011934464_100015361967 [0,1,0,0,0,0|3,0,0]=4 4627 B13R1.669 FCOCCc1ccc(c(c1)F)Cl 7a_100011934464_100015361967 [0,1,0,0,0,0|3,0,0]=4 4628 B13R1.669 FCOCCc1ccc(c(c1)F)F 34a_100000690376_100015361967 [0,1,0,0,0,0|3,0,0]=4 4629 B13R1.669 FCOCCc1ccc(c(c1)F)F 7a_100000690376_100015361967 [0,1,0,0,0,0|3,0,0]=4 4630 B13R1.669 FCSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_100015361967 [0,1,0,0,0,0|3,0,0]=4 4631 B13R1.669 FCSCCc1ccc(c(c1)Cl)Cl 62a_100015361967_100011713676 [0,1,0,0,0,0|3,0,0]=4 4632 B13R1.669 FCSCCc1ccc(c(c1)Cl)F 62a_100012361305_100015361967 [0,1,0,0,0,0|3,0,0]=4 4633 B13R1.669 FCSCCc1ccc(c(c1)Cl)F 62a_100015361967_100012361305 [0,1,0,0,0,0|3,0,0]=4 4634 B13R1.669 FCSCCc1ccc(c(c1)F)F 62a_100000690553_100015361967 [0,1,0,0,0,0|3,0,0]=4 4635 B13R1.669 FCSCCc1ccc(c(c1)F)F 62a_100015361967_100000690553 [0,1,0,0,0,0|3,0,0]=4 4636 B13R1.669 N#CCCNc1ccc(c(c1)F)O 7a_100011220035_100000184422 [0,1,0,0,0,0|3,0,0]=4 4637 B13R1.669 N#CCCNc1ccc(c(c1)O)F 7a_100012017398_100000184422 [0,1,0,0,0,0|3,0,0]=4 4638 B13R1.669 N#CCCSc1ccc(c(c1)Br)O 62a_100011215226_100012361655 [0,1,0,0,0,0|3,0,0]=4 4639 B13R1.669 N#CCCSc1ccc(c(c1)Br)O 62a_100012361655_100011215226 [0,1,0,0,0,0|3,0,0]=4 4640 B13R1.669 N#CCCSc1ccc(c(c1)Cl)O 62a_100011215226_100012360047 [0,1,0,0,0,0|3,0,0]=4 4641 B13R1.669 N#CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100011215226 [0,1,0,0,0,0|3,0,0]=4 4642 B13R1.669 N#CCCSc1ccc(c(c1)F)O 62a_100000185481_100011215226 [0,1,0,0,0,0|3,0,0]=4 4643 B13R1.669 N#CCCSc1ccc(c(c1)F)O 62a_100011215226_100000185481 [0,1,0,0,0,0|3,0,0]=4 4644 B13R1.669 N#CCCSc1ccc(c(c1)N)O 62a_100000752626_100011215226 [0,1,0,0,0,0|3,0,0]=4 4645 B13R1.669 N#CCCSc1ccc(c(c1)N)O 62a_100011215226_100000752626 [0,1,0,0,0,0|3,0,0]=4 4646 B13R1.669 N#CCCSc1ccc(c(c1)O)Br 62a_100011215226_100012356990 [0,1,0,0,0,0|3,0,0]=4 4647 B13R1.669 N#CCCSc1ccc(c(c1)O)Br 62a_100012356990_100011215226 [0,1,0,0,0,0|3,0,0]=4 4648 B13R1.669 N#CCCSc1ccc(c(c1)O)Cl 62a_100011215226_100011356854 [0,1,0,0,0,0|3,0,0]=4 4649 B13R1.669 N#CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100011215226 [0,1,0,0,0,0|3,0,0]=4 4650 B13R1.669 N#CCCSc1ccc(c(c1)O)F 62a_100000686035_100011215226 [0,1,0,0,0,0|3,0,0]=4 4651 B13R1.669 N#CCCSc1ccc(c(c1)O)F 62a_100011215226_100000686035 [0,1,0,0,0,0|3,0,0]=4 4652 B13R1.669 N#CCCSc1ccc(c(c1)O)N 62a_100000739049_100011215226 [0,1,0,0,0,0|3,0,0]=4 4653 B13R1.669 N#CCCSc1ccc(c(c1)O)N 62a_100011215226_100000739049 [0,1,0,0,0,0|3,0,0]=4 4654 B13R1.669 N#CCCSc1ccc(c(c1)O)O 62a_100011215226_100009813601 [0,1,0,0,0,0|2,0,0]=3 4655 B13R1.669 N#CSCSc1ccc(c(c1)O)O 62a_100000211825_100009813601 [0,1,0,0,0,0|2,0,1]=4 4656 B13R1.669 Nc1cc(ccc1O)SCCCF 62a_100000752626_100011934791 [0,1,0,0,0,0|3,0,0]=4 4657 B13R1.669 Nc1cc(ccc1O)SCCCF 62a_100011934791_100000752626 [0,1,0,0,0,0|3,0,0]=4 4658 B13R1.669 Nc1cc(ccc1O)SCCCO 62a_100000752626_100011215043 [0,1,0,0,0,0|3,0,0]=4 4659 B13R1.669 Nc1cc(ccc1O)SCCCO 62a_100011215043_100000752626 [0,1,0,0,0,0|3,0,0]=4 4660 B13R1.669 Nc1ccc(cc1O)SCCCF 62a_100000739049_100011934791 [0,1,0,0,0,0|3,0,0]=4 4661 B13R1.669 Nc1ccc(cc1O)SCCCF 62a_100011934791_100000739049 [0,1,0,0,0,0|3,0,0]=4 4662 B13R1.669 Nc1ccc(cc1O)SCCCO 62a_100000739049_100011215043 [0,1,0,0,0,0|3,0,0]=4 4663 B13R1.669 Nc1ccc(cc1O)SCCCO 62a_100011215043_100000739049 [0,1,0,0,0,0|3,0,0]=4 4664 B13R1.669 O=CCNCc1ccc(c(c1)F)O 34a_100000758358_200009817547 [0,1,0,0,0,0|3,0,0]=4 4665 B13R1.669 O=CCNCc1ccc(c(c1)O)Cl 34a_100020636435_200009817547 [0,1,0,0,0,0|3,0,0]=4 4666 B13R1.669 O=CCNCc1ccc(c(c1)O)F 34a_100160469508_200009817547 [0,1,0,0,0,0|3,0,0]=4 4667 B13R1.669 O=CCNCc1ccc(c(c1)O)O 34a_100000010075_200009817547 [0,1,0,0,0,0|2,0,0]=3 4668 B13R1.669 OCCCNc1ccc(c(c1)Br)O 34a_100011534360_100000230001 [0,1,0,0,0,0|3,0,0]=4 4669 B13R1.669 OCCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000230001 [0,1,0,0,0,0|3,0,0]=4 4670 B13R1.669 OCCCNc1ccc(c(c1)F)O 34a_100011220035_100000230001 [0,1,0,0,0,0|3,0,0]=4 4671 B13R1.669 OCCCNc1ccc(c(c1)F)O 7a_100011220035_100011215043 [0,1,0,0,0,0|3,0,0]=4 4672 B13R1.669 OCCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000230001 [0,1,0,0,0,0|3,0,0]=4 4673 B13R1.669 OCCCNc1ccc(c(c1)O)F 34a_100012017398_100000230001 [0,1,0,0,0,0|3,0,0]=4 4674 B13R1.669 OCCCNc1ccc(c(c1)O)F 7a_100012017398_100011215043 [0,1,0,0,0,0|3,0,0]=4 4675 B13R1.669 OCCCNc1ccc(c(c1)O)O 34a_100102946323_100000230001 [0,1,0,0,0,0|2,0,0]=3 4676 B13R1.669 OCCCSc1ccc(c(c1)Br)O 62a_100011215043_100012361655 [0,1,0,0,0,0|3,0,0]=4 4677 B13R1.669 OCCCSc1ccc(c(c1)Br)O 62a_100012361655_100011215043 [0,1,0,0,0,0|3,0,0]=4 4678 B13R1.669 OCCCSc1ccc(c(c1)Cl)O 62a_100011215043_100012360047 [0,1,0,0,0,0|3,0,0]=4 4679 B13R1.669 OCCCSc1ccc(c(c1)Cl)O 62a_100012360047_100011215043 [0,1,0,0,0,0|3,0,0]=4 4680 B13R1.669 OCCCSc1ccc(c(c1)F)O 62a_100000185481_100011215043 [0,1,0,0,0,0|3,0,0]=4 4681 B13R1.669 OCCCSc1ccc(c(c1)F)O 62a_100011215043_100000185481 [0,1,0,0,0,0|3,0,0]=4 4682 B13R1.669 OCCCSc1ccc(c(c1)O)Br 62a_100011215043_100012356990 [0,1,0,0,0,0|3,0,0]=4 4683 B13R1.669 OCCCSc1ccc(c(c1)O)Br 62a_100012356990_100011215043 [0,1,0,0,0,0|3,0,0]=4 4684 B13R1.669 OCCCSc1ccc(c(c1)O)Cl 62a_100011215043_100011356854 [0,1,0,0,0,0|3,0,0]=4 4685 B13R1.669 OCCCSc1ccc(c(c1)O)Cl 62a_100011356854_100011215043 [0,1,0,0,0,0|3,0,0]=4 4686 B13R1.669 OCCCSc1ccc(c(c1)O)F 62a_100000686035_100011215043 [0,1,0,0,0,0|3,0,0]=4 4687 B13R1.669 OCCCSc1ccc(c(c1)O)F 62a_100011215043_100000686035 [0,1,0,0,0,0|3,0,0]=4 4688 B13R1.669 OCCCSc1ccc(c(c1)O)O 62a_100011215043_100009813601 [0,1,0,0,0,0|2,0,0]=3 4689 B13R1.669 OCCNCc1ccc(c(c1)F)O 34a_100000758358_100000211926 [0,1,0,0,0,0|3,0,0]=4 4690 B13R1.669 OCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000211926 [0,1,0,0,0,0|3,0,0]=4 4691 B13R1.669 OCCNCc1ccc(c(c1)O)F 34a_100160469508_100000211926 [0,1,0,0,0,0|3,0,0]=4 4692 B13R1.669 OCCNCc1ccc(c(c1)O)O 34a_100000010075_100000211926 [0,1,0,0,0,0|2,0,0]=3 4693 B13R1.669 Oc1cc(ccc1Br)SCCCF 62a_100011934791_100012356990 [0,1,0,0,0,0|3,0,0]=4 4694 B13R1.669 Oc1cc(ccc1Br)SCCCF 62a_100012356990_100011934791 [0,1,0,0,0,0|3,0,0]=4 4695 B13R1.669 Oc1cc(ccc1Cl)CNCCF 34a_100020636435_100011217306 [0,1,0,0,0,0|3,0,0]=4 4696 B13R1.669 Oc1cc(ccc1Cl)NCCCF 34a_100011934209_100011934791 [0,1,0,0,0,0|3,0,0]=4 4697 B13R1.669 Oc1cc(ccc1Cl)SCCCF 62a_100011356854_100011934791 [0,1,0,0,0,0|3,0,0]=4 4698 B13R1.669 Oc1cc(ccc1Cl)SCCCF 62a_100011934791_100011356854 [0,1,0,0,0,0|3,0,0]=4 4699 B13R1.669 Oc1cc(ccc1F)CNCCF 34a_100160469508_100011217306 [0,1,0,0,0,0|3,0,0]=4 4700 B13R1.669 Oc1cc(ccc1F)NCCCF 34a_100012017398_100011934791 [0,1,0,0,0,0|3,0,0]=4 4701 B13R1.669 Oc1cc(ccc1F)NCCCF 7a_100012017398_100011934791 [0,1,0,0,0,0|3,0,0]=4 4702 B13R1.669 Oc1cc(ccc1F)SCCCF 62a_100000686035_100011934791 [0,1,0,0,0,0|3,0,0]=4 4703 B13R1.669 Oc1cc(ccc1F)SCCCF 62a_100011934791_100000686035 [0,1,0,0,0,0|3,0,0]=4 4704 B13R1.669 Oc1ccc(cc1Br)NCCCF 34a_100011534360_100011934791 [0,1,0,0,0,0|3,0,0]=4 4705 B13R1.669 Oc1ccc(cc1Br)SCCCF 62a_100011934791_100012361655 [0,1,0,0,0,0|3,0,0]=4 4706 B13R1.669 Oc1ccc(cc1Br)SCCCF 62a_100012361655_100011934791 [0,1,0,0,0,0|3,0,0]=4 4707 B13R1.669 Oc1ccc(cc1Cl)NCCCF 34a_100000744943_100011934791 [0,1,0,0,0,0|3,0,0]=4 4708 B13R1.669 Oc1ccc(cc1Cl)SCCCF 62a_100011934791_100012360047 [0,1,0,0,0,0|3,0,0]=4 4709 B13R1.669 Oc1ccc(cc1Cl)SCCCF 62a_100012360047_100011934791 [0,1,0,0,0,0|3,0,0]=4 4710 B13R1.669 Oc1ccc(cc1F)CNCCF 34a_100000758358_100011217306 [0,1,0,0,0,0|3,0,0]=4 4711 B13R1.669 Oc1ccc(cc1F)NCCCF 34a_100011220035_100011934791 [0,1,0,0,0,0|3,0,0]=4 4712 B13R1.669 Oc1ccc(cc1F)NCCCF 7a_100011220035_100011934791 [0,1,0,0,0,0|3,0,0]=4 4713 B13R1.669 Oc1ccc(cc1F)SCCCF 62a_100000185481_100011934791 [0,1,0,0,0,0|3,0,0]=4 4714 B13R1.669 Oc1ccc(cc1F)SCCCF 62a_100011934791_100000185481 [0,1,0,0,0,0|3,0,0]=4 4715 B13R1.669 Oc1ccc(cc1O)CCNCF 34a_100000210387_100015361967 [0,1,0,0,0,0|0,0,0]=1 4716 B13R1.669 Oc1ccc(cc1O)CCSCF 62a_100015361967_200010393615 [0,1,0,0,0,0|1,0,0]=2 4717 B13R1.669 Oc1ccc(cc1O)CNCCF 34a_100000010075_100011217306 [0,1,0,0,0,0|2,0,0]=3 4718 B13R1.669 Oc1ccc(cc1O)NCCCF 34a_100102946323_100011934791 [0,1,0,0,0,0|2,0,0]=3 4719 B13R1.669 Oc1ccc(cc1O)SCCCF 62a_100011934791_100009813601 [0,1,0,0,0,0|2,0,0]=3 4720 B13R1.669 [13CH3]NCCOc1ccc(c(c1)Cl)Cl 2230a_100015199673_200025704644 [0,1,0,0,0,0|2,0,0]=3 4721 B13R1.669 [13CH3]NCCOc1ccc(c(c1)Cl)Cl 34a_100015199673_200025704644 [0,1,0,0,0,0|2,0,0]=3 4722 B13R1.669 [13CH3]OCCSc1ccc(c(c1)Cl)Cl 34a_200012295044_200025704644 [0,1,0,0,0,0|3,0,0]=4 4723 B13R1.669 [13CH3]OCCSc1ccc(c(c1)Cl)Cl 7a_200012295044_200025704644 [0,1,0,0,0,0|3,0,0]=4 4724 B13R1.669 [13CH3]SCCOc1ccc(c(c1)Cl)F 62a_100011936913_200025704644 [0,1,0,0,0,0|3,0,0]=4 4725 B13R1.669 [13CH3]SCCOc1ccc(c(c1)Cl)F 62a_200025704644_100011936913 [0,1,0,0,0,0|3,0,0]=4 4726 B13R1.1630 CCCCc1cc(c(cc1Br)Br)F 271570a_100020621405_200010212206 [0,1,0,0,0,0|3,0,0]=4 4727 B13R1.1630 CCCCc1cc(c(cc1Br)C)Br 271570a_100020621405_100012929169 [0,1,0,0,0,0|3,0,0]=4 4728 B13R1.1630 CCCCc1cc(c(cc1Br)C)F 271570a_100020621405_200009814774 [0,1,0,0,0,0|3,0,0]=4 4729 B13R1.1630 CCCCc1cc(c(cc1Br)Cl)F 271570a_100020621405_100010254745 [0,1,0,0,0,0|3,0,0]=4 4730 B13R1.1630 CCCCc1cc(c(cc1Br)Cl)O 271570a_100020621405_100021297947 [0,1,0,0,0,0|2,0,0]=3 4731 B13R1.1630 CCCCc1cc(c(cc1Br)F)C 271570a_100020621405_200009814773 [0,1,0,0,0,0|3,0,0]=4 4732 B13R1.1630 CCCCc1cc(c(cc1Br)F)F 271570a_100020621405_100010259568 [0,1,0,0,0,0|3,0,0]=4 4733 B13R1.1630 CCCCc1cc(c(cc1C)Br)C 271570a_100020621405_100011356911 [0,1,0,0,0,0|3,0,0]=4 4734 B13R1.1630 CCCCc1cc(c(cc1C)Br)Cl 271570a_100020621405_200009814780 [0,1,0,0,0,0|3,0,0]=4 4735 B13R1.1630 CCCCc1cc(c(cc1C)Br)F 271570a_100020621405_100011356895 [0,1,0,0,0,0|3,0,0]=4 4736 B13R1.1630 CCCCc1cc(c(cc1C)C)C 271570a_100020621405_100000759388 [0,1,0,0,0,0|3,0,0]=4 4737 B13R1.1630 CCCCc1cc(c(cc1C)C)N 271570a_100020621405_100000703630 [0,1,0,0,0,0|3,0,0]=4 4738 B13R1.1630 CCCCc1cc(c(cc1C)Cl)C 271570a_100020621405_100012357408 [0,1,0,0,0,0|3,0,0]=4 4739 B13R1.1630 CCCCc1cc(c(cc1C)F)Br 271570a_100020621405_100011216669 [0,1,0,0,0,0|3,0,0]=4 4740 B13R1.1630 CCCCc1cc(c(cc1C)F)C 271570a_100020621405_100010212296 [0,1,0,0,0,0|3,0,0]=4 4741 B13R1.1630 CCCCc1cc(c(cc1C)F)F 271570a_100020621405_100009815990 [0,1,0,0,0,0|3,0,0]=4 4742 B13R1.1630 CCCCc1cc(c(cc1C)F)N 271570a_100020621405_100011014115 [0,1,0,0,0,0|3,0,0]=4 4743 B13R1.1630 CCCCc1cc(c(cc1C)F)O 271570a_100020621405_100010068922 [0,1,0,0,0,0|2,0,0]=3 4744 B13R1.1630 CCCCc1cc(c(cc1C)N)C 271570a_100020621405_100011934712 [0,1,0,0,0,0|3,0,0]=4 4745 B13R1.1630 CCCCc1cc(c(cc1C)N)F 271570a_100020621405_100000691575 [0,1,0,0,0,0|3,0,0]=4 4746 B13R1.1630 CCCCc1cc(c(cc1C)N)N 271570a_100020621405_100010080480 [0,1,0,0,0,0|3,0,0]=4 4747 B13R1.1630 CCCCc1cc(c(cc1C)N)O 271570a_100020621405_200010107346 [0,1,0,0,0,0|2,0,0]=3 4748 B13R1.1630 CCCCc1cc(c(cc1C)O)C 271570a_100020621405_100000698207 [0,1,0,0,0,0|2,0,0]=3 4749 B13R1.1630 CCCCc1cc(c(cc1C)O)F 271570a_100020621405_100012355673 [0,1,0,0,0,0|2,0,0]=3 4750 B13R1.1630 CCCCc1cc(c(cc1C)O)N 271570a_100020621405_200010235796 [0,1,0,0,0,0|2,0,0]=3 4751 B13R1.1630 CCCCc1cc(c(cc1Cl)Br)C 271570a_100020621405_100010259621 [0,1,0,0,0,0|3,0,0]=4 4752 B13R1.1630 CCCCc1cc(c(cc1Cl)Br)F 271570a_100020621405_100010212230 [0,1,0,0,0,0|3,0,0]=4 4753 B13R1.1630 CCCCc1cc(c(cc1Cl)Cl)Cl 271570a_100020621405_200011216203 [0,1,0,0,0,0|3,0,0]=4 4754 B13R1.1630 CCCCc1cc(c(cc1Cl)Cl)N 271570a_100020621405_100016224655 [0,1,0,0,0,0|3,0,0]=4 4755 B13R1.1630 CCCCc1cc(c(cc1Cl)F)F 271570a_100020621405_100012349977 [0,1,0,0,0,0|3,0,0]=4 4756 B13R1.1630 CCCCc1cc(c(cc1Cl)O)N 271570a_100020621405_100011011175 [0,1,0,0,0,0|2,0,0]=3 4757 B13R1.1630 CCCCc1cc(c(cc1F)Br)Br 271570a_100020621405_200010212210 [0,1,0,0,0,0|3,0,0]=4 4758 B13R1.1630 CCCCc1cc(c(cc1F)Br)C 271570a_100020621405_200009814772 [0,1,0,0,0,0|3,0,0]=4 4759 B13R1.1630 CCCCc1cc(c(cc1F)Br)F 271570a_100020621405_100011356857 [0,1,0,0,0,0|3,0,0]=4 4760 B13R1.1630 CCCCc1cc(c(cc1F)C)Br 271570a_100020621405_100011068846 [0,1,0,0,0,0|3,0,0]=4 4761 B13R1.1630 CCCCc1cc(c(cc1F)C)C 271570a_100020621405_100010197417 [0,1,0,0,0,0|3,0,0]=4 4762 B13R1.1630 CCCCc1cc(c(cc1F)C)F 271570a_100020621405_100011219510 [0,1,0,0,0,0|3,0,0]=4 4763 B13R1.1630 CCCCc1cc(c(cc1F)C)N 271570a_100020621405_100000717900 [0,1,0,0,0,0|3,0,0]=4 4764 B13R1.1630 CCCCc1cc(c(cc1F)C)O 271570a_100020621405_100014242602 [0,1,0,0,0,0|2,0,0]=3 4765 B13R1.1630 CCCCc1cc(c(cc1F)Cl)F 271570a_100020621405_100010142863 [0,1,0,0,0,0|3,0,0]=4 4766 B13R1.1630 CCCCc1cc(c(cc1F)Cl)O 271570a_100020621405_100010735246 [0,1,0,0,0,0|2,0,0]=3 4767 B13R1.1630 CCCCc1cc(c(cc1F)F)Br 271570a_100020621405_100011356914 [0,1,0,0,0,0|3,0,0]=4 4768 B13R1.1630 CCCCc1cc(c(cc1F)F)C 271570a_100020621405_100000692463 [0,1,0,0,0,0|3,0,0]=4 4769 B13R1.1630 CCCCc1cc(c(cc1F)F)F 271570a_100020621405_100000686897 [0,1,0,0,0,0|3,0,0]=4 4770 B13R1.1630 CCCCc1cc(c(cc1F)F)N 271570a_100020621405_100000700208 [0,1,0,0,0,0|3,0,0]=4 4771 B13R1.1630 CCCCc1cc(c(cc1F)F)O 271570a_100020621405_100012457948 [0,1,0,0,0,0|2,0,0]=3 4772 B13R1.1630 CCCCc1cc(c(cc1F)N)C 271570a_100020621405_100000695870 [0,1,0,0,0,0|3,0,0]=4 4773 B13R1.1630 CCCCc1cc(c(cc1F)N)F 271570a_100020621405_100000690247 [0,1,0,0,0,0|3,0,0]=4 4774 B13R1.1630 CCCCc1cc(c(cc1F)N)N 271570a_100020621405_100000766667 [0,1,0,0,0,0|3,0,0]=4 4775 B13R1.1630 CCCCc1cc(c(cc1F)N)O 271570a_100020621405_100013038943 [0,1,0,0,0,0|2,0,0]=3 4776 B13R1.1630 CCCCc1cc(c(cc1F)O)F 271570a_100020621405_100011830439 [0,1,0,0,0,0|2,0,0]=3 4777 B13R1.1630 CCCCc1cc(c(cc1F)O)N 271570a_100020621405_100012359894 [0,1,0,0,0,0|2,0,0]=3 4778 B13R1.1630 CCCCc1cc(c(cc1N)Br)C 271570a_100020621405_200015600912 [0,1,0,0,0,0|3,0,0]=4 4779 B13R1.1630 CCCCc1cc(c(cc1N)Br)F 271570a_100020621405_200021016574 [0,1,0,0,0,0|3,0,0]=4 4780 B13R1.1630 CCCCc1cc(c(cc1N)C)C 271570a_100020621405_100012337760 [0,1,0,0,0,0|3,0,0]=4 4781 B13R1.1630 CCCCc1cc(c(cc1N)C)F 271570a_100020621405_100010233353 [0,1,0,0,0,0|3,0,0]=4 4782 B13R1.1630 CCCCc1cc(c(cc1N)Cl)Cl 271570a_100020621405_200011093942 [0,1,0,0,0,0|3,0,0]=4 4783 B13R1.1630 CCCCc1cc(c(cc1N)Cl)F 271570a_100020621405_200010992381 [0,1,0,0,0,0|3,0,0]=4 4784 B13R1.1630 CCCCc1cc(c(cc1N)F)Br 271570a_100020621405_100010888672 [0,1,0,0,0,0|3,0,0]=4 4785 B13R1.1630 CCCCc1cc(c(cc1N)F)C 271570a_100020621405_100011218008 [0,1,0,0,0,0|3,0,0]=4 4786 B13R1.1630 CCCCc1cc(c(cc1N)F)Cl 271570a_100020621405_100010892166 [0,1,0,0,0,0|3,0,0]=4 4787 B13R1.1630 CCCCc1cc(c(cc1N)F)F 271570a_100020621405_100000765032 [0,1,0,0,0,0|3,0,0]=4 4788 B13R1.1630 CCCCc1cc(c(cc1N)N)C 271570a_100020621405_200013038441 [0,1,0,0,0,0|3,0,0]=4 4789 B13R1.1630 CCCCc1cc(c(cc1N)N)F 271570a_100020621405_200010115645 [0,1,0,0,0,0|3,0,0]=4 4790 B13R1.1630 CCCCc1cc(c(cc1O)C)C 271570a_100020621405_100009814663 [0,1,0,0,0,0|3,0,0]=4 4791 B13R1.1630 CCCCc1cc(c(cc1O)F)F 271570a_100020621405_100009813768 [0,1,0,0,0,0|3,0,0]=4 4792 B13R1.1630 CCCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000210303 [0,1,0,0,0,0|3,0,0]=4 4793 B13R1.1630 CCCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000210303 [0,1,0,0,0,0|3,0,0]=4 4794 B13R1.1630 CCCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000210303 [0,1,0,0,0,0|3,0,0]=4 4795 B13R1.1630 CCCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000210303 [0,1,0,0,0,0|3,0,0]=4 4796 B13R1.1630 CCCNc1cc(c(cc1C)O)C 34a_100000720036_100000210303 [0,1,0,0,0,0|3,0,0]=4 4797 B13R1.1630 CCCNc1cc(c(cc1C)O)C 7a_100000720036_100000210303 [0,1,0,0,0,0|3,0,0]=4 4798 B13R1.1630 CCCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000210303 [0,1,0,0,0,0|3,0,0]=4 4799 B13R1.1630 CCCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000210303 [0,1,0,0,0,0|3,0,0]=4 4800 B13R1.1630 CCCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000210303 [0,1,0,0,0,0|3,0,0]=4 4801 B13R1.1630 CCCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000210303 [0,1,0,0,0,0|3,0,0]=4 4802 B13R1.1630 CCCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000210303 [0,1,0,0,0,0|3,0,0]=4 4803 B13R1.1630 CCCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000210303 [0,1,0,0,0,0|3,0,0]=4 4804 B13R1.1630 CCCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000210303 [0,1,0,0,0,0|3,0,0]=4 4805 B13R1.1630 CCCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000210303 [0,1,0,0,0,0|3,0,0]=4 4806 B13R1.1630 CCCNc1cc(c(cc1F)C)O 34a_100000117193_100000210303 [0,1,0,0,0,0|3,0,0]=4 4807 B13R1.1630 CCCNc1cc(c(cc1F)C)O 7a_100000117193_100000210303 [0,1,0,0,0,0|3,0,0]=4 4808 B13R1.1630 CCCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000210303 [0,1,0,0,0,0|3,0,0]=4 4809 B13R1.1630 CCCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000210303 [0,1,0,0,0,0|3,0,0]=4 4810 B13R1.1630 CCCNc1cc(c(cc1F)F)O 34a_100011219470_100000210303 [0,1,0,0,0,0|3,0,0]=4 4811 B13R1.1630 CCCNc1cc(c(cc1F)F)O 7a_100011219470_100000210303 [0,1,0,0,0,0|3,0,0]=4 4812 B13R1.1630 CCCNc1cc(c(cc1F)O)F 34a_100020635945_100000210303 [0,1,0,0,0,0|3,0,0]=4 4813 B13R1.1630 CCCNc1cc(c(cc1F)O)F 7a_100020635945_100000210303 [0,1,0,0,0,0|3,0,0]=4 4814 B13R1.1630 CCCNc1cc(c(cc1N)O)F 271570a_203496583355_200012411973 [0,1,0,0,0,0|3,0,0]=4 4815 B13R1.1630 CCCSc1cc(c(cc1Br)Cl)O 62a_100000210303_100021297947 [0,1,0,0,0,0|3,0,0]=4 4816 B13R1.1630 CCCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000210303 [0,1,0,0,0,0|3,0,0]=4 4817 B13R1.1630 CCCSc1cc(c(cc1C)F)O 62a_100000210303_100010068922 [0,1,0,0,0,0|3,0,0]=4 4818 B13R1.1630 CCCSc1cc(c(cc1C)F)O 62a_100010068922_100000210303 [0,1,0,0,0,0|3,0,0]=4 4819 B13R1.1630 CCCSc1cc(c(cc1C)N)O 62a_100000210303_200010107346 [0,1,0,0,0,0|3,0,0]=4 4820 B13R1.1630 CCCSc1cc(c(cc1C)N)O 62a_200010107346_100000210303 [0,1,0,0,0,0|3,0,0]=4 4821 B13R1.1630 CCCSc1cc(c(cc1C)O)C 62a_100000210303_100000698207 [0,1,0,0,0,0|3,0,0]=4 4822 B13R1.1630 CCCSc1cc(c(cc1C)O)C 62a_100000698207_100000210303 [0,1,0,0,0,0|3,0,0]=4 4823 B13R1.1630 CCCSc1cc(c(cc1C)O)F 62a_100000210303_100012355673 [0,1,0,0,0,0|3,0,0]=4 4824 B13R1.1630 CCCSc1cc(c(cc1C)O)F 62a_100012355673_100000210303 [0,1,0,0,0,0|3,0,0]=4 4825 B13R1.1630 CCCSc1cc(c(cc1C)O)N 62a_100000210303_200010235796 [0,1,0,0,0,0|3,0,0]=4 4826 B13R1.1630 CCCSc1cc(c(cc1C)O)N 62a_200010235796_100000210303 [0,1,0,0,0,0|3,0,0]=4 4827 B13R1.1630 CCCSc1cc(c(cc1Cl)O)N 62a_100000210303_100011011175 [0,1,0,0,0,0|3,0,0]=4 4828 B13R1.1630 CCCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000210303 [0,1,0,0,0,0|3,0,0]=4 4829 B13R1.1630 CCCSc1cc(c(cc1F)C)O 62a_100000210303_100014242602 [0,1,0,0,0,0|3,0,0]=4 4830 B13R1.1630 CCCSc1cc(c(cc1F)C)O 62a_100014242602_100000210303 [0,1,0,0,0,0|3,0,0]=4 4831 B13R1.1630 CCCSc1cc(c(cc1F)Cl)O 62a_100000210303_100010735246 [0,1,0,0,0,0|3,0,0]=4 4832 B13R1.1630 CCCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000210303 [0,1,0,0,0,0|3,0,0]=4 4833 B13R1.1630 CCCSc1cc(c(cc1F)F)O 62a_100000210303_100012457948 [0,1,0,0,0,0|3,0,0]=4 4834 B13R1.1630 CCCSc1cc(c(cc1F)F)O 62a_100012457948_100000210303 [0,1,0,0,0,0|3,0,0]=4 4835 B13R1.1630 CCCSc1cc(c(cc1F)N)O 62a_100000210303_100013038943 [0,1,0,0,0,0|3,0,0]=4 4836 B13R1.1630 CCCSc1cc(c(cc1F)N)O 62a_100013038943_100000210303 [0,1,0,0,0,0|3,0,0]=4 4837 B13R1.1630 CCCSc1cc(c(cc1F)O)F 62a_100000210303_100011830439 [0,1,0,0,0,0|3,0,0]=4 4838 B13R1.1630 CCCSc1cc(c(cc1F)O)F 62a_100011830439_100000210303 [0,1,0,0,0,0|3,0,0]=4 4839 B13R1.1630 CCCSc1cc(c(cc1F)O)N 62a_100000210303_100012359894 [0,1,0,0,0,0|3,0,0]=4 4840 B13R1.1630 CCCSc1cc(c(cc1F)O)N 62a_100012359894_100000210303 [0,1,0,0,0,0|3,0,0]=4 4841 B13R1.1630 COCCc1cc(c(cc1F)F)F 34a_100011830277_200000210301 [0,1,0,0,0,0|3,0,0]=4 4842 B13R1.1630 COCCc1cc(c(cc1F)F)F 7a_100011830277_200000210301 [0,1,0,0,0,0|3,0,0]=4 4843 B13R1.1630 COCOc1cc(c(cc1F)O)C 271570a_203496583355_202517114884 [0,1,0,0,0,0|3,0,0]=4 4844 B13R1.1630 COCOc1cc(c(cc1F)O)F 271570a_203496583355_200135144590 [0,1,0,0,0,0|3,0,0]=4 4845 B13R1.1630 COCSc1cc(c(cc1Br)Cl)O 62a_100000766300_100021297947 [0,1,0,0,0,0|3,0,0]=4 4846 B13R1.1630 COCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000766300 [0,1,0,0,0,0|3,0,0]=4 4847 B13R1.1630 COCSc1cc(c(cc1C)F)O 62a_100000766300_100010068922 [0,1,0,0,0,0|3,0,0]=4 4848 B13R1.1630 COCSc1cc(c(cc1C)F)O 62a_100010068922_100000766300 [0,1,0,0,0,0|3,0,0]=4 4849 B13R1.1630 COCSc1cc(c(cc1C)N)O 62a_100000766300_200010107346 [0,1,0,0,0,0|3,0,0]=4 4850 B13R1.1630 COCSc1cc(c(cc1C)N)O 62a_200010107346_100000766300 [0,1,0,0,0,0|3,0,0]=4 4851 B13R1.1630 COCSc1cc(c(cc1C)O)C 62a_100000698207_100000766300 [0,1,0,0,0,0|3,0,0]=4 4852 B13R1.1630 COCSc1cc(c(cc1C)O)C 62a_100000766300_100000698207 [0,1,0,0,0,0|3,0,0]=4 4853 B13R1.1630 COCSc1cc(c(cc1C)O)F 62a_100000766300_100012355673 [0,1,0,0,0,0|3,0,0]=4 4854 B13R1.1630 COCSc1cc(c(cc1C)O)F 62a_100012355673_100000766300 [0,1,0,0,0,0|3,0,0]=4 4855 B13R1.1630 COCSc1cc(c(cc1C)O)N 62a_100000766300_200010235796 [0,1,0,0,0,0|3,0,0]=4 4856 B13R1.1630 COCSc1cc(c(cc1C)O)N 62a_200010235796_100000766300 [0,1,0,0,0,0|3,0,0]=4 4857 B13R1.1630 COCSc1cc(c(cc1Cl)O)N 62a_100000766300_100011011175 [0,1,0,0,0,0|3,0,0]=4 4858 B13R1.1630 COCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000766300 [0,1,0,0,0,0|3,0,0]=4 4859 B13R1.1630 COCSc1cc(c(cc1F)C)O 62a_100000766300_100014242602 [0,1,0,0,0,0|3,0,0]=4 4860 B13R1.1630 COCSc1cc(c(cc1F)C)O 62a_100014242602_100000766300 [0,1,0,0,0,0|3,0,0]=4 4861 B13R1.1630 COCSc1cc(c(cc1F)Cl)O 62a_100000766300_100010735246 [0,1,0,0,0,0|3,0,0]=4 4862 B13R1.1630 COCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000766300 [0,1,0,0,0,0|3,0,0]=4 4863 B13R1.1630 COCSc1cc(c(cc1F)F)O 62a_100000766300_100012457948 [0,1,0,0,0,0|3,0,0]=4 4864 B13R1.1630 COCSc1cc(c(cc1F)F)O 62a_100012457948_100000766300 [0,1,0,0,0,0|3,0,0]=4 4865 B13R1.1630 COCSc1cc(c(cc1F)N)O 62a_100000766300_100013038943 [0,1,0,0,0,0|3,0,0]=4 4866 B13R1.1630 COCSc1cc(c(cc1F)N)O 62a_100013038943_100000766300 [0,1,0,0,0,0|3,0,0]=4 4867 B13R1.1630 COCSc1cc(c(cc1F)O)F 62a_100000766300_100011830439 [0,1,0,0,0,0|3,0,0]=4 4868 B13R1.1630 COCSc1cc(c(cc1F)O)F 62a_100011830439_100000766300 [0,1,0,0,0,0|3,0,0]=4 4869 B13R1.1630 COCSc1cc(c(cc1F)O)N 62a_100000766300_100012359894 [0,1,0,0,0,0|3,0,0]=4 4870 B13R1.1630 COCSc1cc(c(cc1F)O)N 62a_100012359894_100000766300 [0,1,0,0,0,0|3,0,0]=4 4871 B13R1.1630 CSCNc1cc(c(cc1Br)O)Br 34a_100011080774_100011218213 [0,1,0,0,0,0|3,0,0]=4 4872 B13R1.1630 CSCNc1cc(c(cc1C)Cl)O 34a_100009961766_100011218213 [0,1,0,0,0,0|3,0,0]=4 4873 B13R1.1630 CSCNc1cc(c(cc1C)O)C 34a_100000720036_100011218213 [0,1,0,0,0,0|3,0,0]=4 4874 B13R1.1630 CSCNc1cc(c(cc1Cl)C)O 34a_100000092876_100011218213 [0,1,0,0,0,0|3,0,0]=4 4875 B13R1.1630 CSCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100011218213 [0,1,0,0,0,0|3,0,0]=4 4876 B13R1.1630 CSCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100011218213 [0,1,0,0,0,0|3,0,0]=4 4877 B13R1.1630 CSCNc1cc(c(cc1Cl)O)F 34a_100009886023_100011218213 [0,1,0,0,0,0|3,0,0]=4 4878 B13R1.1630 CSCNc1cc(c(cc1F)C)O 34a_100000117193_100011218213 [0,1,0,0,0,0|3,0,0]=4 4879 B13R1.1630 CSCNc1cc(c(cc1F)Cl)O 34a_100000042052_100011218213 [0,1,0,0,0,0|3,0,0]=4 4880 B13R1.1630 CSCNc1cc(c(cc1F)F)O 34a_100011219470_100011218213 [0,1,0,0,0,0|3,0,0]=4 4881 B13R1.1630 CSCNc1cc(c(cc1F)O)F 34a_100020635945_100011218213 [0,1,0,0,0,0|3,0,0]=4 4882 B13R1.1630 CSCSc1cc(c(cc1Br)Cl)O 62a_100011218213_100021297947 [0,1,0,0,0,0|3,0,0]=4 4883 B13R1.1630 CSCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100011218213 [0,1,0,0,0,0|3,0,0]=4 4884 B13R1.1630 CSCSc1cc(c(cc1C)F)O 62a_100010068922_100011218213 [0,1,0,0,0,0|3,0,0]=4 4885 B13R1.1630 CSCSc1cc(c(cc1C)F)O 62a_100011218213_100010068922 [0,1,0,0,0,0|3,0,0]=4 4886 B13R1.1630 CSCSc1cc(c(cc1C)N)O 62a_100011218213_200010107346 [0,1,0,0,0,0|3,0,0]=4 4887 B13R1.1630 CSCSc1cc(c(cc1C)N)O 62a_200010107346_100011218213 [0,1,0,0,0,0|3,0,0]=4 4888 B13R1.1630 CSCSc1cc(c(cc1C)O)C 62a_100000698207_100011218213 [0,1,0,0,0,0|3,0,0]=4 4889 B13R1.1630 CSCSc1cc(c(cc1C)O)C 62a_100011218213_100000698207 [0,1,0,0,0,0|3,0,0]=4 4890 B13R1.1630 CSCSc1cc(c(cc1C)O)F 62a_100011218213_100012355673 [0,1,0,0,0,0|3,0,0]=4 4891 B13R1.1630 CSCSc1cc(c(cc1C)O)F 62a_100012355673_100011218213 [0,1,0,0,0,0|3,0,0]=4 4892 B13R1.1630 CSCSc1cc(c(cc1C)O)N 62a_100011218213_200010235796 [0,1,0,0,0,0|3,0,0]=4 4893 B13R1.1630 CSCSc1cc(c(cc1C)O)N 62a_200010235796_100011218213 [0,1,0,0,0,0|3,0,0]=4 4894 B13R1.1630 CSCSc1cc(c(cc1Cl)O)N 62a_100011011175_100011218213 [0,1,0,0,0,0|3,0,0]=4 4895 B13R1.1630 CSCSc1cc(c(cc1Cl)O)N 62a_100011218213_100011011175 [0,1,0,0,0,0|3,0,0]=4 4896 B13R1.1630 CSCSc1cc(c(cc1F)C)O 62a_100011218213_100014242602 [0,1,0,0,0,0|3,0,0]=4 4897 B13R1.1630 CSCSc1cc(c(cc1F)C)O 62a_100014242602_100011218213 [0,1,0,0,0,0|3,0,0]=4 4898 B13R1.1630 CSCSc1cc(c(cc1F)Cl)O 62a_100010735246_100011218213 [0,1,0,0,0,0|3,0,0]=4 4899 B13R1.1630 CSCSc1cc(c(cc1F)Cl)O 62a_100011218213_100010735246 [0,1,0,0,0,0|3,0,0]=4 4900 B13R1.1630 CSCSc1cc(c(cc1F)F)O 62a_100011218213_100012457948 [0,1,0,0,0,0|3,0,0]=4 4901 B13R1.1630 CSCSc1cc(c(cc1F)F)O 62a_100012457948_100011218213 [0,1,0,0,0,0|3,0,0]=4 4902 B13R1.1630 CSCSc1cc(c(cc1F)N)O 62a_100011218213_100013038943 [0,1,0,0,0,0|3,0,0]=4 4903 B13R1.1630 CSCSc1cc(c(cc1F)N)O 62a_100013038943_100011218213 [0,1,0,0,0,0|3,0,0]=4 4904 B13R1.1630 CSCSc1cc(c(cc1F)O)F 62a_100011218213_100011830439 [0,1,0,0,0,0|3,0,0]=4 4905 B13R1.1630 CSCSc1cc(c(cc1F)O)F 62a_100011830439_100011218213 [0,1,0,0,0,0|3,0,0]=4 4906 B13R1.1630 CSCSc1cc(c(cc1F)O)N 62a_100011218213_100012359894 [0,1,0,0,0,0|3,0,0]=4 4907 B13R1.1630 CSCSc1cc(c(cc1F)O)N 62a_100012359894_100011218213 [0,1,0,0,0,0|3,0,0]=4 4908 B13R1.1630 [13CH3]OCCc1cc(c(cc1F)F)F 34a_100011830277_200025704644 [0,1,0,0,0,0|3,0,0]=4 4909 B13R1.1630 [13CH3]OCCc1cc(c(cc1F)F)F 7a_100011830277_200025704644 [0,1,0,0,0,0|3,0,0]=4 4910 B13R1.2879 C#CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_200000035995 [0,1,0,0,0,0|2,0,1]=4 4911 B13R1.2879 C#CC(C)Sc1ccc(c(c1)O)O 62a_200000035995_100009813601 [0,1,0,0,0,0|2,0,1]=4 4912 B13R1.2879 C=CC(C)Sc1ccc(c(c1)O)O 62a_100011215867_100009813601 [0,1,0,0,0,0|2,0,1]=4 4913 B13R1.2879 CC(C#N)Sc1ccc(c(c1)O)O 62a_100000703298_100009813601 [0,1,0,0,0,0|3,0,0]=4 4914 B13R1.2879 CC(CO)Nc1ccc(c(c1)O)O 34a_100102946323_100012180447 [0,1,0,0,0,0|3,0,0]=4 4915 B13R1.2879 CC(CO)Sc1ccc(c(c1)O)O 62a_100012180447_100009813601 [0,1,0,0,0,0|3,0,0]=4 4916 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210202 [0,1,0,0,0,0|2,0,1]=4 4917 B13R1.2879 CCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210202 [0,1,0,0,0,0|2,0,1]=4 4918 B13R1.2879 CCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210202 [0,1,0,0,0,0|2,0,1]=4 4919 B13R1.2879 CCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210202 [0,1,0,0,0,0|2,0,1]=4 4920 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210202 [0,1,0,0,0,0|2,0,1]=4 4921 B13R1.2879 CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210202 [0,1,0,0,0,0|1,0,1]=3 4922 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210414 [0,1,0,0,0,0|2,0,1]=4 4923 B13R1.2879 CCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210414 [0,1,0,0,0,0|2,0,1]=4 4924 B13R1.2879 CCC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100011215416 [0,1,0,0,0,0|3,0,0]=4 4925 B13R1.2879 CCC(C)Nc1ccc(c(c1)C)O 34a_100011218179_100011215416 [0,1,0,0,0,0|3,0,0]=4 4926 B13R1.2879 CCC(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000758301 [0,1,0,0,0,0|3,0,0]=4 4927 B13R1.2879 CCC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100011215416 [0,1,0,0,0,0|3,0,0]=4 4928 B13R1.2879 CCC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100011215416 [0,1,0,0,0,0|3,0,0]=4 4929 B13R1.2879 CCC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000758301 [0,1,0,0,0,0|3,0,0]=4 4930 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)C 34a_100000759471_100011215416 [0,1,0,0,0,0|3,0,0]=4 4931 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000758301 [0,1,0,0,0,0|3,0,0]=4 4932 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100011215416 [0,1,0,0,0,0|3,0,0]=4 4933 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100011215416 [0,1,0,0,0,0|3,0,0]=4 4934 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000758301 [0,1,0,0,0,0|3,0,0]=4 4935 B13R1.2879 CCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100011215416 [0,1,0,0,0,0|2,0,0]=3 4936 B13R1.2879 CCC(C)Sc1ccc(c(c1)Br)O 62a_100000758301_100012361655 [0,1,0,0,0,0|3,0,0]=4 4937 B13R1.2879 CCC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000758301 [0,1,0,0,0,0|3,0,0]=4 4938 B13R1.2879 CCC(C)Sc1ccc(c(c1)C)O 62a_100000758301_100000186361 [0,1,0,0,0,0|3,0,0]=4 4939 B13R1.2879 CCC(C)Sc1ccc(c(c1)Cl)O 62a_100000758301_100012360047 [0,1,0,0,0,0|3,0,0]=4 4940 B13R1.2879 CCC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000758301 [0,1,0,0,0,0|3,0,0]=4 4941 B13R1.2879 CCC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000758301 [0,1,0,0,0,0|3,0,0]=4 4942 B13R1.2879 CCC(C)Sc1ccc(c(c1)F)O 62a_100000758301_100000185481 [0,1,0,0,0,0|3,0,0]=4 4943 B13R1.2879 CCC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000758301 [0,1,0,0,0,0|3,0,0]=4 4944 B13R1.2879 CCC(C)Sc1ccc(c(c1)N)O 62a_100000758301_100000752626 [0,1,0,0,0,0|3,0,0]=4 4945 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Br 62a_100000758301_100012356990 [0,1,0,0,0,0|3,0,0]=4 4946 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000758301 [0,1,0,0,0,0|3,0,0]=4 4947 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)C 62a_100000685420_100000758301 [0,1,0,0,0,0|3,0,0]=4 4948 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)C 62a_100000758301_100000685420 [0,1,0,0,0,0|3,0,0]=4 4949 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Cl 62a_100000758301_100011356854 [0,1,0,0,0,0|3,0,0]=4 4950 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000758301 [0,1,0,0,0,0|3,0,0]=4 4951 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000758301 [0,1,0,0,0,0|3,0,0]=4 4952 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)F 62a_100000758301_100000686035 [0,1,0,0,0,0|3,0,0]=4 4953 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000758301 [0,1,0,0,0,0|3,0,0]=4 4954 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)N 62a_100000758301_100000739049 [0,1,0,0,0,0|3,0,0]=4 4955 B13R1.2879 CCC(C)Sc1ccc(c(c1)O)O 62a_100000758301_100009813601 [0,1,0,0,0,0|2,0,0]=3 4956 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 11a_106832991635_100000709925 [0,1,0,0,0,0|2,0,1]=4 4957 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 240690a_100102657272_100000709925 [0,1,0,0,0,0|2,0,1]=4 4958 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)C 527a_100102657272_100000709925 [0,1,0,0,0,0|2,0,1]=4 4959 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 11a_106832991635_100012349508 [0,1,0,0,0,0|2,0,1]=4 4960 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 240690a_100102657272_100012349508 [0,1,0,0,0,0|2,0,1]=4 4961 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)Cl 527a_100102657272_100012349508 [0,1,0,0,0,0|2,0,1]=4 4962 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 11a_106832991635_100000742997 [0,1,0,0,0,0|2,0,1]=4 4963 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 240690a_100102657272_100000742997 [0,1,0,0,0,0|2,0,1]=4 4964 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)F 527a_100102657272_100000742997 [0,1,0,0,0,0|2,0,1]=4 4965 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 240690a_100102657272_100009990404 [0,1,0,0,0,0|1,0,1]=3 4966 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Br)O 527a_100102657272_100009990404 [0,1,0,0,0,0|1,0,1]=3 4967 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 11a_106832991635_100012340274 [0,1,0,0,0,0|2,0,1]=4 4968 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 240690a_100102657272_100012340274 [0,1,0,0,0,0|2,0,1]=4 4969 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)Br 527a_100102657272_100012340274 [0,1,0,0,0,0|2,0,1]=4 4970 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 11a_106832991635_100000184070 [0,1,0,0,0,0|2,0,1]=4 4971 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 240690a_100102657272_100000184070 [0,1,0,0,0,0|2,0,1]=4 4972 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)C 527a_100102657272_100000184070 [0,1,0,0,0,0|2,0,1]=4 4973 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 11a_106832991635_100011667458 [0,1,0,0,0,0|2,0,1]=4 4974 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 240690a_100102657272_100011667458 [0,1,0,0,0,0|2,0,1]=4 4975 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)F 527a_100102657272_100011667458 [0,1,0,0,0,0|2,0,1]=4 4976 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 240690a_100102657272_100000083968 [0,1,0,0,0,0|1,0,1]=3 4977 B13R1.2879 CNC(=O)Cc1ccc(c(c1)C)O 527a_100102657272_100000083968 [0,1,0,0,0,0|1,0,1]=3 4978 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 11a_106832991635_100000766880 [0,1,0,0,0,0|2,0,1]=4 4979 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 240690a_100102657272_100000766880 [0,1,0,0,0,0|2,0,1]=4 4980 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Br 527a_100102657272_100000766880 [0,1,0,0,0,0|2,0,1]=4 4981 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 11a_106832991635_100000210702 [0,1,0,0,0,0|2,0,1]=4 4982 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000210702 [0,1,0,0,0,0|2,0,1]=4 4983 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)Cl 527a_100102657272_100000210702 [0,1,0,0,0,0|2,0,1]=4 4984 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 11a_106832991635_100011217296 [0,1,0,0,0,0|2,0,1]=4 4985 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 1626a_100102657272_100011217296 [0,1,0,0,0,0|2,0,1]=4 4986 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 240690a_100102657272_100011217296 [0,1,0,0,0,0|2,0,1]=4 4987 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)F 527a_100102657272_100011217296 [0,1,0,0,0,0|2,0,1]=4 4988 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100102657272_100000035197 [0,1,0,0,0,0|1,0,1]=3 4989 B13R1.2879 CNC(=O)Cc1ccc(c(c1)Cl)O 527a_100102657272_100000035197 [0,1,0,0,0,0|1,0,1]=3 4990 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 11a_106832991635_100000691132 [0,1,0,0,0,0|2,0,1]=4 4991 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 240690a_100102657272_100000691132 [0,1,0,0,0,0|2,0,1]=4 4992 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Br 527a_100102657272_100000691132 [0,1,0,0,0,0|2,0,1]=4 4993 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 11a_106832991635_100011217375 [0,1,0,0,0,0|2,0,1]=4 4994 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 240690a_100102657272_100011217375 [0,1,0,0,0,0|2,0,1]=4 4995 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)C 527a_100102657272_100011217375 [0,1,0,0,0,0|2,0,1]=4 4996 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 11a_106832991635_100000722404 [0,1,0,0,0,0|2,0,1]=4 4997 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 240690a_100102657272_100000722404 [0,1,0,0,0,0|2,0,1]=4 4998 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)Cl 527a_100102657272_100000722404 [0,1,0,0,0,0|2,0,1]=4 4999 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 11a_106832991635_100000684721 [0,1,0,0,0,0|2,0,1]=4 5000 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 1626a_100102657272_100000684721 [0,1,0,0,0,0|2,0,1]=4 5001 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 240690a_100102657272_100000684721 [0,1,0,0,0,0|2,0,1]=4 5002 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)F 527a_100102657272_100000684721 [0,1,0,0,0,0|2,0,1]=4 5003 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 11a_106832991635_100010149632 [0,1,0,0,0,0|2,0,1]=4 5004 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 1626a_100102657272_100010149632 [0,1,0,0,0,0|2,0,1]=4 5005 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 240690a_100102657272_100010149632 [0,1,0,0,0,0|2,0,1]=4 5006 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)I 527a_100102657272_100010149632 [0,1,0,0,0,0|2,0,1]=4 5007 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 240690a_100102657272_100000039761 [0,1,0,0,0,0|1,0,1]=3 5008 B13R1.2879 CNC(=O)Cc1ccc(c(c1)F)O 527a_100102657272_100000039761 [0,1,0,0,0,0|1,0,1]=3 5009 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 11a_106832991635_100000082272 [0,1,0,0,0,0|1,0,1]=3 5010 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 240690a_100102657272_100000082272 [0,1,0,0,0,0|1,0,1]=3 5011 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)C 527a_100102657272_100000082272 [0,1,0,0,0,0|1,0,1]=3 5012 B13R1.2879 CNC(=O)Cc1ccc(c(c1)O)O 527a_100102657272_100000031429 [0,1,0,0,0,0|0,0,1]=2 5013 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Br)O 2430a_100011534360_100102657272 [0,1,0,0,0,0|2,0,1]=4 5014 B13R1.2879 CNC(=O)Nc1ccc(c(c1)C)O 2430a_100011218179_100102657272 [0,1,0,0,0,0|2,0,1]=4 5015 B13R1.2879 CNC(=O)Nc1ccc(c(c1)Cl)O 2430a_100000744943_100102657272 [0,1,0,0,0,0|2,0,1]=4 5016 B13R1.2879 CNC(=O)Nc1ccc(c(c1)F)O 2430a_100011220035_100102657272 [0,1,0,0,0,0|2,0,1]=4 5017 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)C 2430a_100000759471_100102657272 [0,1,0,0,0,0|2,0,1]=4 5018 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)Cl 2430a_100011934209_100102657272 [0,1,0,0,0,0|2,0,1]=4 5019 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)F 2430a_100012017398_100102657272 [0,1,0,0,0,0|2,0,1]=4 5020 B13R1.2879 CNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100102657272 [0,1,0,0,0,0|1,0,1]=3 5021 B13R1.2879 CNC(C)Cc1ccc(c(c1)Cl)Cl 270004a_106832991635_100011586667 [0,1,0,0,0,0|2,0,0]=3 5022 B13R1.2879 COC(=O)Cc1ccc(c(c1)F)O 271570a_203496583355_100010371902 [0,1,0,0,0,0|2,0,1]=4 5023 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)F 271570a_203496583355_100011435807 [0,1,0,0,0,0|2,0,1]=4 5024 B13R1.2879 COC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222482 [0,1,0,0,0,0|1,0,1]=3 5025 B13R1.2879 COC(C)Sc1ccc(c(c1)Br)O 62a_100009879195_100012361655 [0,1,0,0,0,0|3,0,0]=4 5026 B13R1.2879 COC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100009879195 [0,1,0,0,0,0|3,0,0]=4 5027 B13R1.2879 COC(C)Sc1ccc(c(c1)C)O 62a_100009879195_100000186361 [0,1,0,0,0,0|3,0,0]=4 5028 B13R1.2879 COC(C)Sc1ccc(c(c1)Cl)O 62a_100009879195_100012360047 [0,1,0,0,0,0|3,0,0]=4 5029 B13R1.2879 COC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100009879195 [0,1,0,0,0,0|3,0,0]=4 5030 B13R1.2879 COC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100009879195 [0,1,0,0,0,0|3,0,0]=4 5031 B13R1.2879 COC(C)Sc1ccc(c(c1)F)O 62a_100009879195_100000185481 [0,1,0,0,0,0|3,0,0]=4 5032 B13R1.2879 COC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100009879195 [0,1,0,0,0,0|3,0,0]=4 5033 B13R1.2879 COC(C)Sc1ccc(c(c1)N)O 62a_100009879195_100000752626 [0,1,0,0,0,0|3,0,0]=4 5034 B13R1.2879 COC(C)Sc1ccc(c(c1)O)Br 62a_100009879195_100012356990 [0,1,0,0,0,0|3,0,0]=4 5035 B13R1.2879 COC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100009879195 [0,1,0,0,0,0|3,0,0]=4 5036 B13R1.2879 COC(C)Sc1ccc(c(c1)O)C 62a_100000685420_100009879195 [0,1,0,0,0,0|3,0,0]=4 5037 B13R1.2879 COC(C)Sc1ccc(c(c1)O)C 62a_100009879195_100000685420 [0,1,0,0,0,0|3,0,0]=4 5038 B13R1.2879 COC(C)Sc1ccc(c(c1)O)Cl 62a_100009879195_100011356854 [0,1,0,0,0,0|3,0,0]=4 5039 B13R1.2879 COC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100009879195 [0,1,0,0,0,0|3,0,0]=4 5040 B13R1.2879 COC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100009879195 [0,1,0,0,0,0|3,0,0]=4 5041 B13R1.2879 COC(C)Sc1ccc(c(c1)O)F 62a_100009879195_100000686035 [0,1,0,0,0,0|3,0,0]=4 5042 B13R1.2879 COC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100009879195 [0,1,0,0,0,0|3,0,0]=4 5043 B13R1.2879 COC(C)Sc1ccc(c(c1)O)N 62a_100009879195_100000739049 [0,1,0,0,0,0|3,0,0]=4 5044 B13R1.2879 COC(C)Sc1ccc(c(c1)O)O 62a_100009879195_100009813601 [0,1,0,0,0,0|2,0,0]=3 5045 B13R1.2879 C[C@H](CO)Sc1ccc(c(c1)O)O 62a_100016084084_100009813601 [0,1,0,0,0,0|3,0,0]=4 5046 B13R1.2879 N#CC(F)Sc1ccc(c(c1)O)O 62a_200000117898_100009813601 [0,1,0,0,0,0|3,0,0]=4 5047 B13R1.2879 O=C(CF)Cc1ccc(c(c1)O)O 1458a_100000031429_100015361967 [0,1,0,0,0,0|2,0,1]=4 5048 B13R1.3518 CCCCc1ccc(c(c1C)C)Br 271570a_100020621405_200010185626 [0,1,0,0,0,0|3,0,0]=4 5049 B13R1.3518 CCCCc1ccc(c(c1C)C)F 271570a_100020621405_100009816033 [0,1,0,0,0,0|3,0,0]=4 5050 B13R1.3518 CCCCc1ccc(c(c1C)C)N 271570a_100020621405_100009816967 [0,1,0,0,0,0|3,0,0]=4 5051 B13R1.3518 CCCCc1ccc(c(c1C)C)O 271570a_100020621405_100012353674 [0,1,0,0,0,0|2,0,0]=3 5052 B13R1.3518 CCCCc1ccc(c(c1C)Cl)Br 271570a_100020621405_200010212245 [0,1,0,0,0,0|3,0,0]=4 5053 B13R1.3518 CCCCc1ccc(c(c1C)F)Br 271570a_100020621405_100010208201 [0,1,0,0,0,0|3,0,0]=4 5054 B13R1.3518 CCCCc1ccc(c(c1C)F)F 271570a_100020621405_100009815991 [0,1,0,0,0,0|3,0,0]=4 5055 B13R1.3518 CCCCc1ccc(c(c1C)F)N 271570a_100020621405_100000722916 [0,1,0,0,0,0|3,0,0]=4 5056 B13R1.3518 CCCCc1ccc(c(c1C)N)C 271570a_100020621405_200010074581 [0,1,0,0,0,0|3,0,0]=4 5057 B13R1.3518 CCCCc1ccc(c(c1C)N)F 271570a_100020621405_100010588651 [0,1,0,0,0,0|3,0,0]=4 5058 B13R1.3518 CCCCc1ccc(c(c1C)N)N 271570a_100020621405_100010009725 [0,1,0,0,0,0|3,0,0]=4 5059 B13R1.3518 CCCCc1ccc(c(c1C)N)O 271570a_100020621405_100013039247 [0,1,0,0,0,0|2,0,0]=3 5060 B13R1.3518 CCCCc1ccc(c(c1Cl)C)Br 271570a_100020621405_100055076181 [0,1,0,0,0,0|3,0,0]=4 5061 B13R1.3518 CCCCc1ccc(c(c1Cl)C)Cl 271570a_100020621405_100010730154 [0,1,0,0,0,0|3,0,0]=4 5062 B13R1.3518 CCCCc1ccc(c(c1F)Br)F 271570a_100020621405_100010167943 [0,1,0,0,0,0|3,0,0]=4 5063 B13R1.3518 CCCCc1ccc(c(c1F)Br)N 271570a_100020621405_100015781493 [0,1,0,0,0,0|3,0,0]=4 5064 B13R1.3518 CCCCc1ccc(c(c1F)C)C 271570a_100020621405_200015555822 [0,1,0,0,0,0|3,0,0]=4 5065 B13R1.3518 CCCCc1ccc(c(c1F)C)F 271570a_100020621405_100009815987 [0,1,0,0,0,0|3,0,0]=4 5066 B13R1.3518 CCCCc1ccc(c(c1F)C)N 271570a_100020621405_100010208198 [0,1,0,0,0,0|3,0,0]=4 5067 B13R1.3518 CCCCc1ccc(c(c1F)C)O 271570a_100020621405_100010390934 [0,1,0,0,0,0|2,0,0]=3 5068 B13R1.3518 CCCCc1ccc(c(c1F)Cl)Br 271570a_100020621405_100010212236 [0,1,0,0,0,0|3,0,0]=4 5069 B13R1.3518 CCCCc1ccc(c(c1F)Cl)F 271570a_100020621405_200000038702 [0,1,0,0,0,0|3,0,0]=4 5070 B13R1.3518 CCCCc1ccc(c(c1F)F)Br 271570a_100020621405_100010212264 [0,1,0,0,0,0|3,0,0]=4 5071 B13R1.3518 CCCCc1ccc(c(c1F)F)C 271570a_100020621405_100012766498 [0,1,0,0,0,0|3,0,0]=4 5072 B13R1.3518 CCCCc1ccc(c(c1F)F)F 271570a_100020621405_100000750562 [0,1,0,0,0,0|3,0,0]=4 5073 B13R1.3518 CCCCc1ccc(c(c1F)F)N 271570a_100020621405_100010200256 [0,1,0,0,0,0|3,0,0]=4 5074 B13R1.3518 CCCCc1ccc(c(c1F)F)O 271570a_100020621405_100011830415 [0,1,0,0,0,0|2,0,0]=3 5075 B13R1.3518 CCCCc1ccc(c(c1F)N)F 271570a_100020621405_100025793129 [0,1,0,0,0,0|3,0,0]=4 5076 B13R1.3518 CCCCc1ccc(c(c1F)N)N 271570a_100020621405_100009814308 [0,1,0,0,0,0|3,0,0]=4 5077 B13R1.3518 CCCCc1ccc(c(c1F)O)Br 271570a_100020621405_200010782288 [0,1,0,0,0,0|2,0,0]=3 5078 B13R1.3518 CCCCc1ccc(c(c1F)O)F 271570a_100020621405_100010167067 [0,1,0,0,0,0|2,0,0]=3 5079 B13R1.3518 CCCCc1ccc(c(c1N)C)F 271570a_100020621405_100011009917 [0,1,0,0,0,0|3,0,0]=4 5080 B13R1.3518 CCCCc1ccc(c(c1N)F)F 271570a_100020621405_100010008850 [0,1,0,0,0,0|3,0,0]=4 5081 B13R1.3518 CCCCc1ccc(c(c1N)N)F 271570a_100020621405_100011102919 [0,1,0,0,0,0|3,0,0]=4 5082 B13R1.3518 CCCCc1ccc(c(c1N)O)Br 271570a_100020621405_100020748643 [0,1,0,0,0,0|2,0,0]=3 5083 B13R1.3518 CCCCc1ccc(c(c1O)C)F 271570a_100020621405_200010391124 [0,1,0,0,0,0|3,0,0]=4 5084 B13R1.3518 CCCCc1ccc(c(c1O)F)C 271570a_100020621405_100000722096 [0,1,0,0,0,0|3,0,0]=4 5085 B13R1.3518 CCCCc1ccc(c(c1O)F)F 271570a_100020621405_100010243909 [0,1,0,0,0,0|3,0,0]=4 5086 B13R1.3518 CCCCc1cnc(c(c1C)C)O 271570a_100020621405_200011099879 [0,1,0,0,0,0|3,0,0]=4 5087 B13R1.3518 CCCNc1ccc(c(c1C)C)O 34a_200011216674_100000210303 [0,1,0,0,0,0|3,0,0]=4 5088 B13R1.3518 CCCNc1ccc(c(c1C)C)O 7a_200011216674_100000210303 [0,1,0,0,0,0|3,0,0]=4 5089 B13R1.3518 CCCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000210303 [0,1,0,0,0,0|3,0,0]=4 5090 B13R1.3518 CCCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000210303 [0,1,0,0,0,0|3,0,0]=4 5091 B13R1.3518 CCCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000210303 [0,1,0,0,0,0|3,0,0]=4 5092 B13R1.3518 CCCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000210303 [0,1,0,0,0,0|3,0,0]=4 5093 B13R1.3518 CCCNc1ccc(c(c1F)C)O 34a_200000126710_100000210303 [0,1,0,0,0,0|3,0,0]=4 5094 B13R1.3518 CCCNc1ccc(c(c1F)C)O 7a_200000126710_100000210303 [0,1,0,0,0,0|3,0,0]=4 5095 B13R1.3518 CCCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000210303 [0,1,0,0,0,0|3,0,0]=4 5096 B13R1.3518 CCCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000210303 [0,1,0,0,0,0|3,0,0]=4 5097 B13R1.3518 CCCNc1ccc(c(c1F)F)O 34a_100015204651_100000210303 [0,1,0,0,0,0|3,0,0]=4 5098 B13R1.3518 CCCNc1ccc(c(c1F)F)O 7a_100015204651_100000210303 [0,1,0,0,0,0|3,0,0]=4 5099 B13R1.3518 CCCSc1ccc(c(c1C)C)O 62a_100000210303_100012353674 [0,1,0,0,0,0|3,0,0]=4 5100 B13R1.3518 CCCSc1ccc(c(c1C)C)O 62a_100012353674_100000210303 [0,1,0,0,0,0|3,0,0]=4 5101 B13R1.3518 CCCSc1ccc(c(c1C)N)O 62a_100000210303_100013039247 [0,1,0,0,0,0|3,0,0]=4 5102 B13R1.3518 CCCSc1ccc(c(c1C)N)O 62a_100013039247_100000210303 [0,1,0,0,0,0|3,0,0]=4 5103 B13R1.3518 CCCSc1ccc(c(c1F)C)O 62a_100000210303_100010390934 [0,1,0,0,0,0|3,0,0]=4 5104 B13R1.3518 CCCSc1ccc(c(c1F)C)O 62a_100010390934_100000210303 [0,1,0,0,0,0|3,0,0]=4 5105 B13R1.3518 CCCSc1ccc(c(c1F)F)O 62a_100000210303_100011830415 [0,1,0,0,0,0|3,0,0]=4 5106 B13R1.3518 CCCSc1ccc(c(c1F)F)O 62a_100011830415_100000210303 [0,1,0,0,0,0|3,0,0]=4 5107 B13R1.3518 CCCSc1ccc(c(c1F)O)Br 62a_100000210303_200010782288 [0,1,0,0,0,0|3,0,0]=4 5108 B13R1.3518 CCCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210303 [0,1,0,0,0,0|3,0,0]=4 5109 B13R1.3518 CCCSc1ccc(c(c1F)O)F 62a_100000210303_100010167067 [0,1,0,0,0,0|3,0,0]=4 5110 B13R1.3518 CCCSc1ccc(c(c1F)O)F 62a_100010167067_100000210303 [0,1,0,0,0,0|3,0,0]=4 5111 B13R1.3518 CCCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210303 [0,1,0,0,0,0|3,0,0]=4 5112 B13R1.3518 COCCc1ccc(c(c1F)F)F 34a_100011778489_200000210301 [0,1,0,0,0,0|3,0,0]=4 5113 B13R1.3518 COCCc1ccc(c(c1F)F)F 7a_100011778489_200000210301 [0,1,0,0,0,0|3,0,0]=4 5114 B13R1.3518 COCSc1ccc(c(c1C)C)O 62a_100000766300_100012353674 [0,1,0,0,0,0|3,0,0]=4 5115 B13R1.3518 COCSc1ccc(c(c1C)C)O 62a_100012353674_100000766300 [0,1,0,0,0,0|3,0,0]=4 5116 B13R1.3518 COCSc1ccc(c(c1C)N)O 62a_100000766300_100013039247 [0,1,0,0,0,0|3,0,0]=4 5117 B13R1.3518 COCSc1ccc(c(c1C)N)O 62a_100013039247_100000766300 [0,1,0,0,0,0|3,0,0]=4 5118 B13R1.3518 COCSc1ccc(c(c1F)C)O 62a_100000766300_100010390934 [0,1,0,0,0,0|3,0,0]=4 5119 B13R1.3518 COCSc1ccc(c(c1F)C)O 62a_100010390934_100000766300 [0,1,0,0,0,0|3,0,0]=4 5120 B13R1.3518 COCSc1ccc(c(c1F)F)O 62a_100000766300_100011830415 [0,1,0,0,0,0|3,0,0]=4 5121 B13R1.3518 COCSc1ccc(c(c1F)F)O 62a_100011830415_100000766300 [0,1,0,0,0,0|3,0,0]=4 5122 B13R1.3518 COCSc1ccc(c(c1F)O)Br 62a_100000766300_200010782288 [0,1,0,0,0,0|3,0,0]=4 5123 B13R1.3518 COCSc1ccc(c(c1F)O)Br 62a_200010782288_100000766300 [0,1,0,0,0,0|3,0,0]=4 5124 B13R1.3518 COCSc1ccc(c(c1F)O)F 62a_100000766300_100010167067 [0,1,0,0,0,0|3,0,0]=4 5125 B13R1.3518 COCSc1ccc(c(c1F)O)F 62a_100010167067_100000766300 [0,1,0,0,0,0|3,0,0]=4 5126 B13R1.3518 COCSc1ccc(c(c1N)O)Br 62a_100020748643_100000766300 [0,1,0,0,0,0|3,0,0]=4 5127 B13R1.3518 CSCNc1ccc(c(c1C)C)O 34a_200011216674_100011218213 [0,1,0,0,0,0|3,0,0]=4 5128 B13R1.3518 CSCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100011218213 [0,1,0,0,0,0|3,0,0]=4 5129 B13R1.3518 CSCNc1ccc(c(c1Cl)O)C 34a_100000036876_100011218213 [0,1,0,0,0,0|3,0,0]=4 5130 B13R1.3518 CSCNc1ccc(c(c1F)C)O 34a_200000126710_100011218213 [0,1,0,0,0,0|3,0,0]=4 5131 B13R1.3518 CSCNc1ccc(c(c1F)Cl)O 34a_200000098347_100011218213 [0,1,0,0,0,0|3,0,0]=4 5132 B13R1.3518 CSCNc1ccc(c(c1F)F)O 34a_100015204651_100011218213 [0,1,0,0,0,0|3,0,0]=4 5133 B13R1.3518 CSCSc1ccc(c(c1C)C)O 62a_100011218213_100012353674 [0,1,0,0,0,0|3,0,0]=4 5134 B13R1.3518 CSCSc1ccc(c(c1C)C)O 62a_100012353674_100011218213 [0,1,0,0,0,0|3,0,0]=4 5135 B13R1.3518 CSCSc1ccc(c(c1C)N)O 62a_100011218213_100013039247 [0,1,0,0,0,0|3,0,0]=4 5136 B13R1.3518 CSCSc1ccc(c(c1C)N)O 62a_100013039247_100011218213 [0,1,0,0,0,0|3,0,0]=4 5137 B13R1.3518 CSCSc1ccc(c(c1F)C)O 62a_100010390934_100011218213 [0,1,0,0,0,0|3,0,0]=4 5138 B13R1.3518 CSCSc1ccc(c(c1F)C)O 62a_100011218213_100010390934 [0,1,0,0,0,0|3,0,0]=4 5139 B13R1.3518 CSCSc1ccc(c(c1F)F)O 62a_100011218213_100011830415 [0,1,0,0,0,0|3,0,0]=4 5140 B13R1.3518 CSCSc1ccc(c(c1F)F)O 62a_100011830415_100011218213 [0,1,0,0,0,0|3,0,0]=4 5141 B13R1.3518 CSCSc1ccc(c(c1F)O)Br 62a_100011218213_200010782288 [0,1,0,0,0,0|3,0,0]=4 5142 B13R1.3518 CSCSc1ccc(c(c1F)O)Br 62a_200010782288_100011218213 [0,1,0,0,0,0|3,0,0]=4 5143 B13R1.3518 CSCSc1ccc(c(c1F)O)F 62a_100010167067_100011218213 [0,1,0,0,0,0|3,0,0]=4 5144 B13R1.3518 CSCSc1ccc(c(c1F)O)F 62a_100011218213_100010167067 [0,1,0,0,0,0|3,0,0]=4 5145 B13R1.3518 CSCSc1ccc(c(c1N)O)Br 62a_100020748643_100011218213 [0,1,0,0,0,0|3,0,0]=4 5146 B13R1.3518 [13CH3]OCCc1ccc(c(c1F)F)F 34a_100011778489_200025704644 [0,1,0,0,0,0|3,0,0]=4 5147 B13R1.3518 [13CH3]OCCc1ccc(c(c1F)F)F 7a_100011778489_200025704644 [0,1,0,0,0,0|3,0,0]=4 5148 B13R2.32 Oc1ccc2c(c1F)CCNC2 271570a_203496583355_100015699739 [0,0,0,1,0,0|3,0,0]=4 5149 B13R2.32 Oc1ccc2c(c1O)CCCC2 271570a_203496583355_200010391107 [0,0,0,1,0,0|1,0,0]=2 5150 B13R2.369 Oc1cc2c(cc1F)NCCC2 271570a_203496583355_100000762356 [0,0,0,1,0,0|3,0,0]=4 5151 B13R2.467 CCCCc1ccc2c(c1)CC2 271570a_100020621405_100009818592 [0,0,0,1,0,0|3,0,0]=4 5152 B13R2.521 Cc1cc(ccc1O)NC2CC2 34a_100011218179_100000211595 [0,0,0,1,0,0|3,0,0]=4 5153 B13R2.521 Cc1ccc(cc1O)NC2CC2 34a_100000759471_100000211595 [0,0,0,1,0,0|3,0,0]=4 5154 B13R2.521 Cc1ccc(cc1O)SC2CC2 62a_100000685420_100000211595 [0,0,0,1,0,0|3,0,0]=4 5155 B13R2.521 Nc1cc(ccc1O)SC2CC2 62a_100000752626_100000211595 [0,0,0,1,0,0|3,0,0]=4 5156 B13R2.521 Nc1ccc(cc1O)SC2CC2 62a_100000739049_100000211595 [0,0,0,1,0,0|3,0,0]=4 5157 B13R2.521 Oc1cc(ccc1Br)SC2CC2 62a_100012356990_100000211595 [0,0,0,1,0,0|3,0,0]=4 5158 B13R2.521 Oc1cc(ccc1Cl)NC2CC2 34a_100011934209_100000211595 [0,0,0,1,0,0|3,0,0]=4 5159 B13R2.521 Oc1cc(ccc1Cl)SC2CC2 62a_100011356854_100000211595 [0,0,0,1,0,0|3,0,0]=4 5160 B13R2.521 Oc1cc(ccc1F)NC2CC2 34a_100012017398_100000211595 [0,0,0,1,0,0|3,0,0]=4 5161 B13R2.521 Oc1cc(ccc1F)SC2CC2 62a_100000686035_100000211595 [0,0,0,1,0,0|3,0,0]=4 5162 B13R2.521 Oc1ccc(cc1Br)NC2CC2 34a_100011534360_100000211595 [0,0,0,1,0,0|3,0,0]=4 5163 B13R2.521 Oc1ccc(cc1Br)SC2CC2 62a_100012361655_100000211595 [0,0,0,1,0,0|3,0,0]=4 5164 B13R2.521 Oc1ccc(cc1Cl)NC2CC2 34a_100000744943_100000211595 [0,0,0,1,0,0|3,0,0]=4 5165 B13R2.521 Oc1ccc(cc1Cl)SC2CC2 62a_100012360047_100000211595 [0,0,0,1,0,0|3,0,0]=4 5166 B13R2.521 Oc1ccc(cc1F)NC2CC2 34a_100011220035_100000211595 [0,0,0,1,0,0|3,0,0]=4 5167 B13R2.521 Oc1ccc(cc1F)SC2CC2 62a_100000185481_100000211595 [0,0,0,1,0,0|3,0,0]=4 5168 B13R2.521 Oc1ccc(cc1O)NC2CC2 34a_100102946323_100000211595 [0,0,0,1,0,0|2,0,0]=3 5169 B13R2.3790 Nc1ccc2c(c1O)C(=O)CC2 271570a_203496583355_100010218033 [0,0,0,1,0,0|3,0,0]=4 5170 B13R2.3790 O=C1CCc2c1c(c(cc2)F)O 271570a_203496583355_200010133456 [0,0,0,1,0,0|3,0,0]=4 5171 B13R2.11634 Cc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010133461 [0,0,0,1,0,0|3,0,0]=4 5172 B13R2.11634 Cc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010010902 [0,0,0,1,0,0|3,0,0]=4 5173 B13R2.11634 Cc1cc2c(cnn2C)cc1O 271570a_203496583355_100010255091 [0,0,0,1,0,0|2,0,1]=4 5174 B13R2.11634 Cc1cc2cnn(c2cc1O)C 271570a_203496583355_100010255094 [0,0,0,1,0,0|2,0,1]=4 5175 B13R2.11634 Cn1ncc2c1cc(c(c2)F)O 271570a_203496583355_100010131893 [0,0,0,1,0,0|2,0,1]=4 5176 B13R2.11634 Nc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010080117 [0,0,0,1,0,0|3,0,0]=4 5177 B13R2.11634 O=C1CCc2c1cc(c(c2)F)O 271570a_203496583355_100010010871 [0,0,0,1,0,0|3,0,0]=4 5178 B13R2.11634 O=C1CCc2c1cc(c(c2)O)F 271570a_203496583355_100010010804 [0,0,0,1,0,0|3,0,0]=4 5179 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [2,0,0,0,0,0|0,0,2]=4 5180 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [2,0,0,0,0,0|0,0,2]=4 5181 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [2,0,0,0,0,0|0,0,0]=2 5182 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [2,0,0,0,0,0|2,0,0]=4 5183 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [2,0,0,0,0,0|2,0,0]=4 5184 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [2,0,0,0,0,0|2,0,0]=4 5185 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [2,0,0,0,0,0|2,0,0]=4 5186 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [2,0,0,0,0,0|2,0,0]=4 5187 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [2,0,0,0,0,0|2,0,0]=4 5188 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [2,0,0,0,0,0|2,0,0]=4 5189 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [2,0,0,0,0,0|2,0,0]=4 5190 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [2,0,0,0,0,0|1,0,0]=3 5191 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [2,0,0,0,0,0|1,0,0]=3 5192 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [2,0,0,0,0,0|2,0,0]=4 5193 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [2,0,0,0,0,0|2,0,0]=4 5194 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [2,0,0,0,0,0|2,0,0]=4 5195 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [2,0,0,0,0,0|2,0,0]=4 5196 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [2,0,0,0,0,0|2,0,0]=4 5197 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [2,0,0,0,0,0|2,0,0]=4 5198 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [2,0,0,0,0,0|2,0,0]=4 5199 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [2,0,0,0,0,0|2,0,0]=4 5200 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [2,0,0,0,0,0|2,0,0]=4 5201 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [2,0,0,0,0,0|2,0,0]=4 5202 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [2,0,0,0,0,0|2,0,0]=4 5203 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [2,0,0,0,0,0|1,0,0]=3 5204 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [2,0,0,0,0,0|2,0,0]=4 5205 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [2,0,0,0,0,0|2,0,0]=4 5206 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [2,0,0,0,0,0|2,0,0]=4 5207 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [2,0,0,0,0,0|2,0,0]=4 5208 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [2,0,0,0,0,0|2,0,0]=4 5209 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [2,0,0,0,0,0|2,0,0]=4 5210 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [2,0,0,0,0,0|2,0,0]=4 5211 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [2,0,0,0,0,0|2,0,0]=4 5212 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [2,0,0,0,0,0|2,0,0]=4 5213 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [2,0,0,0,0,0|2,0,0]=4 5214 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [2,0,0,0,0,0|2,0,0]=4 5215 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [2,0,0,0,0,0|2,0,0]=4 5216 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [2,0,0,0,0,0|1,0,0]=3 5217 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [2,0,0,0,0,0|1,0,0]=3 5218 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [2,0,0,0,0,0|2,0,0]=4 5219 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [2,0,0,0,0,0|2,0,0]=4 5220 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [2,0,0,0,0,0|2,0,0]=4 5221 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [2,0,0,0,0,0|1,0,0]=3 5222 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [2,0,0,0,0,0|1,0,0]=3 5223 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [2,0,0,0,0,0|1,0,0]=3 5224 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [2,0,0,0,0,0|1,0,0]=3 5225 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [2,0,0,0,0,0|1,0,0]=3 5226 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [2,0,0,0,0,0|1,0,0]=3 5227 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [2,0,0,0,0,0|1,0,0]=3 5228 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [2,0,0,0,0,0|1,0,0]=3 5229 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [2,0,0,0,0,0|1,0,0]=3 5230 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [2,0,0,0,0,0|1,0,0]=3 5231 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [2,0,0,0,0,0|1,0,0]=3 5232 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [2,0,0,0,0,0|1,0,0]=3 5233 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [2,0,0,0,0,0|1,0,0]=3 5234 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [2,0,0,0,0,0|1,0,0]=3 5235 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [2,0,0,0,0,0|1,0,0]=3 5236 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [2,0,0,0,0,0|1,0,0]=3 5237 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [2,0,0,0,0,0|1,0,0]=3 5238 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [2,0,0,0,0,0|1,0,0]=3 5239 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [2,0,0,0,0,0|1,0,0]=3 5240 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [2,0,0,0,0,0|1,0,0]=3 5241 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [2,0,0,0,0,0|1,0,0]=3 5242 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [2,0,0,0,0,0|1,0,0]=3 5243 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [2,0,0,0,0,0|1,0,0]=3 5244 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [2,0,0,0,0,0|1,0,0]=3 5245 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [2,0,0,0,0,0|1,0,0]=3 5246 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [2,0,0,0,0,0|1,0,0]=3 5247 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [2,0,0,0,0,0|1,0,0]=3 5248 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [2,0,0,0,0,0|1,0,0]=3 5249 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [2,0,0,0,0,0|1,0,0]=3 5250 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [2,0,0,0,0,0|1,0,0]=3 5251 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [2,0,0,0,0,0|1,0,0]=3 5252 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [2,0,0,0,0,0|1,0,0]=3 5253 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [2,0,0,0,0,0|1,0,0]=3 5254 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [2,0,0,0,0,0|1,0,0]=3 5255 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [2,0,0,0,0,0|1,0,0]=3 5256 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [2,0,0,0,0,0|1,0,0]=3 5257 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [2,0,0,0,0,0|0,0,0]=2 5258 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [2,0,0,0,0,0|0,0,0]=2 5259 B10R1.1 CNCc1ccc(cn1)Br 207a_100102657272_100000754260 [2,0,0,0,0,0|2,0,0]=4 5260 B10R1.1 CNCc1ccc(cn1)Br 2230a_106832991635_100000702658 [2,0,0,0,0,0|2,0,0]=4 5261 B10R1.1 CNCc1ccc(cn1)Br 270004a_106832991635_100000754260 [2,0,0,0,0,0|2,0,0]=4 5262 B10R1.1 CNCc1ccc(cn1)Br 34a_100015188789_200000210301 [2,0,0,0,0,0|2,0,0]=4 5263 B10R1.1 CNCc1ccc(cn1)Br 34a_100102657272_100000702658 [2,0,0,0,0,0|2,0,0]=4 5264 B10R1.1 CNCc1ccc(cn1)Br 7a_106832991635_100000702658 [2,0,0,0,0,0|2,0,0]=4 5265 B10R1.1 CNCc1ccc(cn1)C 207a_100102657272_100000050478 [2,0,0,0,0,0|2,0,0]=4 5266 B10R1.1 CNCc1ccc(cn1)C 2230a_106832991635_100000691093 [2,0,0,0,0,0|2,0,0]=4 5267 B10R1.1 CNCc1ccc(cn1)C 270004a_106832991635_100000050478 [2,0,0,0,0,0|2,0,0]=4 5268 B10R1.1 CNCc1ccc(cn1)C 34a_100015187455_200000210301 [2,0,0,0,0,0|2,0,0]=4 5269 B10R1.1 CNCc1ccc(cn1)C 34a_100102657272_100000691093 [2,0,0,0,0,0|2,0,0]=4 5270 B10R1.1 CNCc1ccc(cn1)C 7a_106832991635_100000691093 [2,0,0,0,0,0|2,0,0]=4 5271 B10R1.1 CNCc1ccc(cn1)Cl 207a_100102657272_100011361569 [2,0,0,0,0,0|2,0,0]=4 5272 B10R1.1 CNCc1ccc(cn1)Cl 2230a_106832991635_100012066911 [2,0,0,0,0,0|2,0,0]=4 5273 B10R1.1 CNCc1ccc(cn1)Cl 270004a_106832991635_100011361569 [2,0,0,0,0,0|2,0,0]=4 5274 B10R1.1 CNCc1ccc(cn1)Cl 34a_100000697193_200000210301 [2,0,0,0,0,0|2,0,0]=4 5275 B10R1.1 CNCc1ccc(cn1)Cl 34a_100102657272_100012066911 [2,0,0,0,0,0|2,0,0]=4 5276 B10R1.1 CNCc1ccc(cn1)Cl 7a_106832991635_100012066911 [2,0,0,0,0,0|2,0,0]=4 5277 B10R1.1 CNCc1ccc(cn1)F 207a_100102657272_100011934744 [2,0,0,0,0,0|2,0,0]=4 5278 B10R1.1 CNCc1ccc(cn1)F 2230a_106832991635_100000703193 [2,0,0,0,0,0|2,0,0]=4 5279 B10R1.1 CNCc1ccc(cn1)F 270004a_106832991635_100011934744 [2,0,0,0,0,0|2,0,0]=4 5280 B10R1.1 CNCc1ccc(cn1)F 34a_100020620131_200000210301 [2,0,0,0,0,0|2,0,0]=4 5281 B10R1.1 CNCc1ccc(cn1)F 34a_100102657272_100000703193 [2,0,0,0,0,0|2,0,0]=4 5282 B10R1.1 CNCc1ccc(cn1)F 7a_106832991635_100000703193 [2,0,0,0,0,0|2,0,0]=4 5283 B10R1.1 CNCc1ccc(nc1)Br 2230a_100009817727_200000210301 [2,0,0,0,0,0|2,0,0]=4 5284 B10R1.1 CNCc1ccc(nc1)Br 2230a_106832991635_100009831999 [2,0,0,0,0,0|2,0,0]=4 5285 B10R1.1 CNCc1ccc(nc1)Br 34a_100009817727_200000210301 [2,0,0,0,0,0|2,0,0]=4 5286 B10R1.1 CNCc1ccc(nc1)Br 34a_100102657272_100009831999 [2,0,0,0,0,0|2,0,0]=4 5287 B10R1.1 CNCc1ccc(nc1)Br 7a_106832991635_100009831999 [2,0,0,0,0,0|2,0,0]=4 5288 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [2,0,0,0,0,0|2,0,0]=4 5289 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [2,0,0,0,0,0|2,0,0]=4 5290 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [2,0,0,0,0,0|2,0,0]=4 5291 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [2,0,0,0,0,0|2,0,0]=4 5292 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [2,0,0,0,0,0|2,0,0]=4 5293 B10R1.1 CNCc1ccc(nc1)Cl 2230a_100000735879_200000210301 [2,0,0,0,0,0|2,0,0]=4 5294 B10R1.1 CNCc1ccc(nc1)Cl 2230a_106832991635_100000735431 [2,0,0,0,0,0|2,0,0]=4 5295 B10R1.1 CNCc1ccc(nc1)Cl 34a_100000735879_200000210301 [2,0,0,0,0,0|2,0,0]=4 5296 B10R1.1 CNCc1ccc(nc1)Cl 34a_100102657272_100000735431 [2,0,0,0,0,0|2,0,0]=4 5297 B10R1.1 CNCc1ccc(nc1)Cl 7a_106832991635_100000735431 [2,0,0,0,0,0|2,0,0]=4 5298 B10R1.1 CNCc1ccc(nc1)F 2230a_100000101913_200000210301 [2,0,0,0,0,0|2,0,0]=4 5299 B10R1.1 CNCc1ccc(nc1)F 2230a_106832991635_100009820150 [2,0,0,0,0,0|2,0,0]=4 5300 B10R1.1 CNCc1ccc(nc1)F 34a_100000101913_200000210301 [2,0,0,0,0,0|2,0,0]=4 5301 B10R1.1 CNCc1ccc(nc1)F 34a_100102657272_100000099788 [2,0,0,0,0,0|2,0,0]=4 5302 B10R1.1 CNCc1ccc(nc1)F 7a_106832991635_100009820150 [2,0,0,0,0,0|2,0,0]=4 5303 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [2,0,0,0,0,0|1,0,0]=3 5304 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [2,0,0,0,0,0|1,0,0]=3 5305 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [2,0,0,0,0,0|1,0,0]=3 5306 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [2,0,0,0,0,0|2,0,0]=4 5307 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [2,0,0,0,0,0|2,0,0]=4 5308 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [2,0,0,0,0,0|2,0,0]=4 5309 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [2,0,0,0,0,0|2,0,0]=4 5310 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [2,0,0,0,0,0|2,0,0]=4 5311 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 5312 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [2,0,0,0,0,0|2,0,0]=4 5313 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 5314 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 5315 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [2,0,0,0,0,0|2,0,0]=4 5316 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 5317 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 5318 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [2,0,0,0,0,0|2,0,0]=4 5319 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 5320 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [2,0,0,0,0,0|2,0,0]=4 5321 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [2,0,0,0,0,0|1,0,0]=3 5322 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [2,0,0,0,0,0|2,0,0]=4 5323 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [2,0,0,0,0,0|2,0,0]=4 5324 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [2,0,0,0,0,0|2,0,0]=4 5325 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [2,0,0,0,0,0|2,0,0]=4 5326 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [2,0,0,0,0,0|2,0,0]=4 5327 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [2,0,0,0,0,0|2,0,0]=4 5328 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [2,0,0,0,0,0|2,0,0]=4 5329 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [2,0,0,0,0,0|2,0,0]=4 5330 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [2,0,0,0,0,0|2,0,0]=4 5331 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [2,0,0,0,0,0|2,0,0]=4 5332 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [2,0,0,0,0,0|2,0,0]=4 5333 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [2,0,0,0,0,0|1,0,0]=3 5334 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [2,0,0,0,0,0|1,0,0]=3 5335 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [2,0,0,0,0,0|2,0,0]=4 5336 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [2,0,0,0,0,0|2,0,0]=4 5337 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [2,0,0,0,0,0|2,0,0]=4 5338 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [2,0,0,0,0,0|2,0,0]=4 5339 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [2,0,0,0,0,0|2,0,0]=4 5340 B10R1.1 Cc1ccc(nc1)CN[13CH3] 34a_100015187455_200025704644 [2,0,0,0,0,0|2,0,0]=4 5341 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [2,0,0,0,0,0|0,0,2]=4 5342 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [2,0,0,0,0,0|0,0,0]=2 5343 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [2,0,0,0,0,0|1,0,0]=3 5344 B10R1.1 NNCc1ccc(nc1)O 271570a_203496583355_106726394036 [2,0,0,0,0,0|2,0,0]=4 5345 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [2,0,0,0,0,0|1,0,1]=4 5346 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [2,0,0,0,0,0|1,0,0]=3 5347 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [2,0,0,0,0,0|2,0,0]=4 5348 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [2,0,0,0,0,0|2,0,0]=4 5349 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [2,0,0,0,0,0|2,0,0]=4 5350 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [2,0,0,0,0,0|2,0,0]=4 5351 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [2,0,0,0,0,0|1,0,0]=3 5352 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [2,0,0,0,0,0|1,0,0]=3 5353 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [2,0,0,0,0,0|1,0,0]=3 5354 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [2,0,0,0,0,0|1,0,0]=3 5355 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [2,0,0,0,0,0|1,0,0]=3 5356 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [2,0,0,0,0,0|1,0,0]=3 5357 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [2,0,0,0,0,0|1,0,0]=3 5358 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [2,0,0,0,0,0|1,0,0]=3 5359 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [2,0,0,0,0,0|0,0,0]=2 5360 B10R1.1 [13CH3]NCc1ccc(cn1)Br 34a_100015188789_200025704644 [2,0,0,0,0,0|2,0,0]=4 5361 B10R1.1 [13CH3]NCc1ccc(cn1)Cl 34a_100000697193_200025704644 [2,0,0,0,0,0|2,0,0]=4 5362 B10R1.1 [13CH3]NCc1ccc(cn1)F 34a_100020620131_200025704644 [2,0,0,0,0,0|2,0,0]=4 5363 B10R1.1 [13CH3]NCc1ccc(nc1)Br 2230a_100009817727_200025704644 [2,0,0,0,0,0|2,0,0]=4 5364 B10R1.1 [13CH3]NCc1ccc(nc1)Br 34a_100009817727_200025704644 [2,0,0,0,0,0|2,0,0]=4 5365 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 2230a_100000735879_200025704644 [2,0,0,0,0,0|2,0,0]=4 5366 B10R1.1 [13CH3]NCc1ccc(nc1)Cl 34a_100000735879_200025704644 [2,0,0,0,0,0|2,0,0]=4 5367 B10R1.1 [13CH3]NCc1ccc(nc1)F 2230a_100000101913_200025704644 [2,0,0,0,0,0|2,0,0]=4 5368 B10R1.1 [13CH3]NCc1ccc(nc1)F 34a_100000101913_200025704644 [2,0,0,0,0,0|2,0,0]=4 5369 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [2,0,0,0,0,0|1,0,0]=3 5370 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [2,0,0,0,0,0|2,0,0]=4 5371 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 5372 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 5373 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 5374 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 5375 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 5376 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 5377 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [2,0,0,0,0,0|2,0,0]=4 5378 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [2,0,0,0,0,0|2,0,0]=4 5379 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [2,0,0,0,0,0|2,0,0]=4 5380 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [2,0,0,0,0,0|2,0,0]=4 5381 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [2,0,0,0,0,0|2,0,0]=4 5382 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [2,0,0,0,0,0|2,0,0]=4 5383 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [2,0,0,0,0,0|2,0,0]=4 5384 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [2,0,0,0,0,0|2,0,0]=4 5385 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [2,0,0,0,0,0|2,0,0]=4 5386 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [2,0,0,0,0,0|1,0,0]=3 5387 B10R1.17 CCCCc1ccccn1 271570a_100020621405_100011216584 [2,0,0,0,0,0|2,0,0]=4 5388 B10R1.17 CCCCc1cccnc1 271570a_100020621405_100000752921 [2,0,0,0,0,0|2,0,0]=4 5389 B10R1.17 CCCCc1ccncc1 271570a_100020621405_100000035832 [2,0,0,0,0,0|2,0,0]=4 5390 B10R1.17 CCCNc1ccccc1 34a_100000106764_100000210303 [2,0,0,0,0,0|2,0,0]=4 5391 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [2,0,0,0,0,0|2,0,0]=4 5392 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [2,0,0,0,0,0|2,0,0]=4 5393 B10R1.17 CCCSc1ccccc1 62a_100000210303_100000041952 [2,0,0,0,0,0|2,0,0]=4 5394 B10R1.17 CCCSc1ccccc1 62a_100000719477_100000210303 [2,0,0,0,0,0|2,0,0]=4 5395 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [2,0,0,0,0,0|2,0,0]=4 5396 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [2,0,0,0,0,0|2,0,0]=4 5397 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [2,0,0,0,0,0|2,0,0]=4 5398 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [2,0,0,0,0,0|2,0,0]=4 5399 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [2,0,0,0,0,0|2,0,0]=4 5400 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [2,0,0,0,0,0|2,0,0]=4 5401 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [2,0,0,0,0,0|2,0,0]=4 5402 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [2,0,0,0,0,0|2,0,0]=4 5403 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [2,0,0,0,0,0|2,0,0]=4 5404 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [2,0,0,0,0,0|2,0,0]=4 5405 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [2,0,0,0,0,0|0,0,0]=2 5406 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [2,0,0,0,0,0|0,0,0]=2 5407 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [2,0,0,0,0,0|0,0,0]=2 5408 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [2,0,0,0,0,0|0,0,0]=2 5409 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [2,0,0,0,0,0|0,0,0]=2 5410 B10R1.17 CNCCc1ccccn1 2230a_106832991635_100015183660 [2,0,0,0,0,0|1,0,0]=3 5411 B10R1.17 CNCCc1ccccn1 7a_106832991635_100015183660 [2,0,0,0,0,0|1,0,0]=3 5412 B10R1.17 CNCCc1cccnc1 2230a_100000736294_200000210301 [2,0,0,0,0,0|1,0,0]=3 5413 B10R1.17 CNCCc1cccnc1 2230a_106832991635_200011713674 [2,0,0,0,0,0|1,0,0]=3 5414 B10R1.17 CNCCc1cccnc1 7a_106832991635_200011713674 [2,0,0,0,0,0|1,0,0]=3 5415 B10R1.17 CNCCc1ccncc1 2230a_106832991635_100000723409 [2,0,0,0,0,0|1,0,0]=3 5416 B10R1.17 CNCCc1ccncc1 7a_106832991635_100000723409 [2,0,0,0,0,0|1,0,0]=3 5417 B10R1.17 CNCSc1ccccc1 2230a_106832991635_100011218342 [2,0,0,0,0,0|1,0,0]=3 5418 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [2,0,0,0,0,0|1,0,0]=3 5419 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [2,0,0,0,0,0|1,0,0]=3 5420 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [2,0,0,0,0,0|1,0,0]=3 5421 B10R1.17 COCCc1ccccn1 34a_100000210271_200000210301 [2,0,0,0,0,0|2,0,0]=4 5422 B10R1.17 COCCc1cccnc1 34a_100011217484_200000210301 [2,0,0,0,0,0|2,0,0]=4 5423 B10R1.17 COCCc1ccncc1 34a_100011216225_200000210301 [2,0,0,0,0,0|2,0,0]=4 5424 B10R1.17 COCSc1ccccc1 62a_100000719477_100000766300 [2,0,0,0,0,0|2,0,0]=4 5425 B10R1.17 COCSc1ccccc1 62a_100000766300_100000041952 [2,0,0,0,0,0|2,0,0]=4 5426 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [2,0,0,0,0,0|1,0,0]=3 5427 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [2,0,0,0,0,0|1,0,0]=3 5428 B10R1.17 CSCCc1ccccn1 62a_100015183660_200000210301 [2,0,0,0,0,0|2,0,0]=4 5429 B10R1.17 CSCCc1ccccn1 62a_200000210301_100015183660 [2,0,0,0,0,0|2,0,0]=4 5430 B10R1.17 CSCCc1cccnc1 62a_200000210301_200011713674 [2,0,0,0,0,0|2,0,0]=4 5431 B10R1.17 CSCCc1cccnc1 62a_200011713674_200000210301 [2,0,0,0,0,0|2,0,0]=4 5432 B10R1.17 CSCCc1ccncc1 62a_100000723409_200000210301 [2,0,0,0,0,0|2,0,0]=4 5433 B10R1.17 CSCCc1ccncc1 62a_200000210301_100000723409 [2,0,0,0,0,0|2,0,0]=4 5434 B10R1.17 CSCNc1ccccc1 34a_100000106764_100011218213 [2,0,0,0,0,0|2,0,0]=4 5435 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [2,0,0,0,0,0|2,0,0]=4 5436 B10R1.17 CSCSc1ccccc1 62a_100000719477_100011218213 [2,0,0,0,0,0|2,0,0]=4 5437 B10R1.17 CSCSc1ccccc1 62a_100011218213_100000041952 [2,0,0,0,0,0|2,0,0]=4 5438 B10R1.17 CSCSc1ccccc1 62a_100011218342_200000210301 [2,0,0,0,0,0|2,0,0]=4 5439 B10R1.17 CSCSc1ccccc1 62a_200000210301_100011218342 [2,0,0,0,0,0|2,0,0]=4 5440 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [2,0,0,0,0,0|0,0,0]=2 5441 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [2,0,0,0,0,0|0,0,0]=2 5442 B10R1.17 [13CH3]NCCc1cccnc1 2230a_100000736294_200025704644 [2,0,0,0,0,0|1,0,0]=3 5443 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [2,0,0,0,0,0|1,0,0]=3 5444 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [2,0,0,0,0,0|1,0,0]=3 5445 B10R1.17 [13CH3]OCCc1ccccn1 34a_100000210271_200025704644 [2,0,0,0,0,0|2,0,0]=4 5446 B10R1.17 [13CH3]OCCc1cccnc1 34a_100011217484_200025704644 [2,0,0,0,0,0|2,0,0]=4 5447 B10R1.17 [13CH3]OCCc1ccncc1 34a_100011216225_200025704644 [2,0,0,0,0,0|2,0,0]=4 5448 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [2,0,0,0,0,0|1,0,0]=3 5449 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [2,0,0,0,0,0|1,0,0]=3 5450 B10R1.17 [13CH3]SCCc1ccccn1 62a_100015183660_200025704644 [2,0,0,0,0,0|2,0,0]=4 5451 B10R1.17 [13CH3]SCCc1ccccn1 62a_200025704644_100015183660 [2,0,0,0,0,0|2,0,0]=4 5452 B10R1.17 [13CH3]SCCc1cccnc1 62a_200011713674_200025704644 [2,0,0,0,0,0|2,0,0]=4 5453 B10R1.17 [13CH3]SCCc1cccnc1 62a_200025704644_200011713674 [2,0,0,0,0,0|2,0,0]=4 5454 B10R1.17 [13CH3]SCCc1ccncc1 62a_100000723409_200025704644 [2,0,0,0,0,0|2,0,0]=4 5455 B10R1.17 [13CH3]SCCc1ccncc1 62a_200025704644_100000723409 [2,0,0,0,0,0|2,0,0]=4 5456 B10R1.17 [13CH3]SCSc1ccccc1 62a_100011218342_200025704644 [2,0,0,0,0,0|2,0,0]=4 5457 B10R1.17 [13CH3]SCSc1ccccc1 62a_200025704644_100011218342 [2,0,0,0,0,0|2,0,0]=4 5458 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [2,0,0,0,0,0|0,0,2]=4 5459 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [2,0,0,0,0,0|0,0,2]=4 5460 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [2,0,0,0,0,0|0,0,2]=4 5461 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [2,0,0,0,0,0|0,0,0]=2 5462 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [2,0,0,0,0,0|2,0,0]=4 5463 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [2,0,0,0,0,0|2,0,0]=4 5464 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [2,0,0,0,0,0|2,0,0]=4 5465 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [2,0,0,0,0,0|2,0,0]=4 5466 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [2,0,0,0,0,0|2,0,0]=4 5467 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [2,0,0,0,0,0|2,0,0]=4 5468 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [2,0,0,0,0,0|1,0,0]=3 5469 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [2,0,0,0,0,0|1,0,0]=3 5470 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [2,0,0,0,0,0|2,0,0]=4 5471 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [2,0,0,0,0,0|2,0,0]=4 5472 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [2,0,0,0,0,0|2,0,0]=4 5473 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [2,0,0,0,0,0|2,0,0]=4 5474 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [2,0,0,0,0,0|2,0,0]=4 5475 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [2,0,0,0,0,0|2,0,0]=4 5476 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [2,0,0,0,0,0|2,0,0]=4 5477 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [2,0,0,0,0,0|2,0,0]=4 5478 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [2,0,0,0,0,0|2,0,0]=4 5479 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [2,0,0,0,0,0|2,0,0]=4 5480 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [2,0,0,0,0,0|2,0,0]=4 5481 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [2,0,0,0,0,0|2,0,0]=4 5482 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [2,0,0,0,0,0|2,0,0]=4 5483 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [2,0,0,0,0,0|1,0,0]=3 5484 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [2,0,0,0,0,0|2,0,0]=4 5485 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [2,0,0,0,0,0|2,0,0]=4 5486 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [2,0,0,0,0,0|2,0,0]=4 5487 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [2,0,0,0,0,0|2,0,0]=4 5488 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [2,0,0,0,0,0|2,0,0]=4 5489 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [2,0,0,0,0,0|2,0,0]=4 5490 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [2,0,0,0,0,0|2,0,0]=4 5491 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [2,0,0,0,0,0|2,0,0]=4 5492 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [2,0,0,0,0,0|2,0,0]=4 5493 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [2,0,0,0,0,0|2,0,0]=4 5494 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [2,0,0,0,0,0|2,0,0]=4 5495 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [2,0,0,0,0,0|2,0,0]=4 5496 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [2,0,0,0,0,0|2,0,0]=4 5497 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [2,0,0,0,0,0|2,0,0]=4 5498 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [2,0,0,0,0,0|1,0,0]=3 5499 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [2,0,0,0,0,0|1,0,0]=3 5500 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [2,0,0,0,0,0|1,1,0]=4 5501 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [2,0,0,0,0,0|1,1,0]=4 5502 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [2,0,0,0,0,0|2,0,0]=4 5503 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [2,0,0,0,0,0|2,0,0]=4 5504 B10R1.10 CNCc1cc(ccn1)Br 2230a_106832991635_100010173614 [2,0,0,0,0,0|2,0,0]=4 5505 B10R1.10 CNCc1cc(ccn1)Br 270004a_106832991635_100009818557 [2,0,0,0,0,0|2,0,0]=4 5506 B10R1.10 CNCc1cc(ccn1)Br 34a_100102657272_100010173614 [2,0,0,0,0,0|2,0,0]=4 5507 B10R1.10 CNCc1cc(ccn1)Br 7a_106832991635_100010173614 [2,0,0,0,0,0|2,0,0]=4 5508 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [2,0,0,0,0,0|2,0,0]=4 5509 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [2,0,0,0,0,0|2,0,0]=4 5510 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [2,0,0,0,0,0|2,0,0]=4 5511 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [2,0,0,0,0,0|2,0,0]=4 5512 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [2,0,0,0,0,0|2,0,0]=4 5513 B10R1.10 CNCc1cc(ccn1)Cl 2230a_106832991635_100016988179 [2,0,0,0,0,0|2,0,0]=4 5514 B10R1.10 CNCc1cc(ccn1)Cl 270004a_106832991635_100011998288 [2,0,0,0,0,0|2,0,0]=4 5515 B10R1.10 CNCc1cc(ccn1)Cl 34a_100102657272_100016988179 [2,0,0,0,0,0|2,0,0]=4 5516 B10R1.10 CNCc1cc(ccn1)Cl 7a_106832991635_100016988179 [2,0,0,0,0,0|2,0,0]=4 5517 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [2,0,0,0,0,0|1,0,0]=3 5518 B10R1.10 CNCc1cccc(=O)[nH]1 207a_100102657272_100011935257 [2,0,0,0,0,0|1,0,1]=4 5519 B10R1.10 CNCc1cccc(=O)[nH]1 2230a_100000696482_200000210301 [2,0,0,0,0,0|1,0,1]=4 5520 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [2,0,0,0,0,0|1,0,0]=3 5521 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [2,0,0,0,0,0|1,0,0]=3 5522 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [2,0,0,0,0,0|1,0,0]=3 5523 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [2,0,0,0,0,0|1,0,0]=3 5524 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [2,0,0,0,0,0|1,0,0]=3 5525 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [2,0,0,0,0,0|1,0,0]=3 5526 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [2,0,0,0,0,0|1,0,0]=3 5527 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [2,0,0,0,0,0|1,0,0]=3 5528 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [2,0,0,0,0,0|1,0,0]=3 5529 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [2,0,0,0,0,0|1,0,0]=3 5530 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [2,0,0,0,0,0|1,0,0]=3 5531 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [2,0,0,0,0,0|1,0,0]=3 5532 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [2,0,0,0,0,0|1,0,0]=3 5533 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [2,0,0,0,0,0|1,0,0]=3 5534 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [2,0,0,0,0,0|1,0,0]=3 5535 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [2,0,0,0,0,0|1,0,0]=3 5536 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [2,0,0,0,0,0|1,0,0]=3 5537 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [2,0,0,0,0,0|1,0,0]=3 5538 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [2,0,0,0,0,0|1,0,0]=3 5539 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [2,0,0,0,0,0|1,0,0]=3 5540 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [2,0,0,0,0,0|1,0,0]=3 5541 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [2,0,0,0,0,0|1,0,0]=3 5542 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [2,0,0,0,0,0|1,0,0]=3 5543 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [2,0,0,0,0,0|1,0,0]=3 5544 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [2,0,0,0,0,0|1,0,0]=3 5545 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [2,0,0,0,0,0|1,0,0]=3 5546 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [2,0,0,0,0,0|1,0,0]=3 5547 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [2,0,0,0,0,0|1,0,0]=3 5548 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [2,0,0,0,0,0|1,0,0]=3 5549 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [2,0,0,0,0,0|1,0,0]=3 5550 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [2,0,0,0,0,0|1,0,0]=3 5551 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [2,0,0,0,0,0|1,0,0]=3 5552 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [2,0,0,0,0,0|1,0,0]=3 5553 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [2,0,0,0,0,0|1,0,0]=3 5554 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [2,0,0,0,0,0|1,0,0]=3 5555 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [2,0,0,0,0,0|1,0,0]=3 5556 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [2,0,0,0,0,0|0,0,0]=2 5557 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [2,0,0,0,0,0|0,0,0]=2 5558 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [2,0,0,0,0,0|0,0,0]=2 5559 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [2,0,0,0,0,0|0,0,0]=2 5560 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [2,0,0,0,0,0|0,0,0]=2 5561 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [2,0,0,0,0,0|0,0,0]=2 5562 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [2,0,0,0,0,0|0,0,0]=2 5563 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [2,0,0,0,0,0|0,0,0]=2 5564 B10R1.10 CNCc1cccc(n1)Br 2230a_100016987751_200000210301 [2,0,0,0,0,0|2,0,0]=4 5565 B10R1.10 CNCc1cccc(n1)Br 2230a_106832991635_100009889011 [2,0,0,0,0,0|2,0,0]=4 5566 B10R1.10 CNCc1cccc(n1)Br 270004a_106832991635_100000688028 [2,0,0,0,0,0|2,0,0]=4 5567 B10R1.10 CNCc1cccc(n1)Br 34a_100102657272_100009889011 [2,0,0,0,0,0|2,0,0]=4 5568 B10R1.10 CNCc1cccc(n1)Br 7a_106832991635_100009889011 [2,0,0,0,0,0|2,0,0]=4 5569 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [2,0,0,0,0,0|2,0,0]=4 5570 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [2,0,0,0,0,0|2,0,0]=4 5571 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [2,0,0,0,0,0|2,0,0]=4 5572 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [2,0,0,0,0,0|2,0,0]=4 5573 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [2,0,0,0,0,0|2,0,0]=4 5574 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [2,0,0,0,0,0|2,0,0]=4 5575 B10R1.10 CNCc1cccc(n1)Cl 2230a_100016990191_200000210301 [2,0,0,0,0,0|2,0,0]=4 5576 B10R1.10 CNCc1cccc(n1)Cl 2230a_106832991635_100000086093 [2,0,0,0,0,0|2,0,0]=4 5577 B10R1.10 CNCc1cccc(n1)Cl 270004a_106832991635_100011361687 [2,0,0,0,0,0|2,0,0]=4 5578 B10R1.10 CNCc1cccc(n1)Cl 34a_100102657272_100000086093 [2,0,0,0,0,0|2,0,0]=4 5579 B10R1.10 CNCc1cccc(n1)Cl 7a_106832991635_100000086093 [2,0,0,0,0,0|2,0,0]=4 5580 B10R1.10 CNCc1cccc(n1)F 2230a_100015188798_200000210301 [2,0,0,0,0,0|2,0,0]=4 5581 B10R1.10 CNCc1cccc(n1)F 2230a_106832991635_100009819644 [2,0,0,0,0,0|2,0,0]=4 5582 B10R1.10 CNCc1cccc(n1)F 270004a_106832991635_100000050434 [2,0,0,0,0,0|2,0,0]=4 5583 B10R1.10 CNCc1cccc(n1)F 34a_100015188798_200000210301 [2,0,0,0,0,0|2,0,0]=4 5584 B10R1.10 CNCc1cccc(n1)F 34a_100102657272_100009819644 [2,0,0,0,0,0|2,0,0]=4 5585 B10R1.10 CNCc1cccc(n1)F 7a_106832991635_100009819644 [2,0,0,0,0,0|2,0,0]=4 5586 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [2,0,0,0,0,0|1,0,0]=3 5587 B10R1.10 CNCc1ccnc(c1)Br 2230a_100025757509_200000210301 [2,0,0,0,0,0|2,0,0]=4 5588 B10R1.10 CNCc1ccnc(c1)Br 2230a_106832991635_100010243470 [2,0,0,0,0,0|2,0,0]=4 5589 B10R1.10 CNCc1ccnc(c1)Br 270004a_106832991635_100009814634 [2,0,0,0,0,0|2,0,0]=4 5590 B10R1.10 CNCc1ccnc(c1)Br 34a_100025757509_200000210301 [2,0,0,0,0,0|2,0,0]=4 5591 B10R1.10 CNCc1ccnc(c1)Br 34a_100102657272_100010243470 [2,0,0,0,0,0|2,0,0]=4 5592 B10R1.10 CNCc1ccnc(c1)Br 7a_106832991635_100010254460 [2,0,0,0,0,0|2,0,0]=4 5593 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [2,0,0,0,0,0|2,0,0]=4 5594 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [2,0,0,0,0,0|2,0,0]=4 5595 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [2,0,0,0,0,0|2,0,0]=4 5596 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [2,0,0,0,0,0|2,0,0]=4 5597 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [2,0,0,0,0,0|2,0,0]=4 5598 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [2,0,0,0,0,0|2,0,0]=4 5599 B10R1.10 CNCc1ccnc(c1)Cl 2230a_100015205668_200000210301 [2,0,0,0,0,0|2,0,0]=4 5600 B10R1.10 CNCc1ccnc(c1)Cl 2230a_106832991635_100000764220 [2,0,0,0,0,0|2,0,0]=4 5601 B10R1.10 CNCc1ccnc(c1)Cl 270004a_106832991635_100011290808 [2,0,0,0,0,0|2,0,0]=4 5602 B10R1.10 CNCc1ccnc(c1)Cl 34a_100015205668_200000210301 [2,0,0,0,0,0|2,0,0]=4 5603 B10R1.10 CNCc1ccnc(c1)Cl 34a_100102657272_100000764220 [2,0,0,0,0,0|2,0,0]=4 5604 B10R1.10 CNCc1ccnc(c1)Cl 7a_106832991635_100000764220 [2,0,0,0,0,0|2,0,0]=4 5605 B10R1.10 CNCc1ccnc(c1)F 2230a_100015188774_200000210301 [2,0,0,0,0,0|2,0,0]=4 5606 B10R1.10 CNCc1ccnc(c1)F 270004a_106832991635_100000068331 [2,0,0,0,0,0|2,0,0]=4 5607 B10R1.10 CNCc1ccnc(c1)F 34a_100015188774_200000210301 [2,0,0,0,0,0|2,0,0]=4 5608 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [2,0,0,0,0,0|1,0,0]=3 5609 B10R1.10 CNCc1cncc(c1)Br 207a_100102657272_100000687066 [2,0,0,0,0,0|2,0,0]=4 5610 B10R1.10 CNCc1cncc(c1)Br 2230a_106832991635_100000738771 [2,0,0,0,0,0|2,0,0]=4 5611 B10R1.10 CNCc1cncc(c1)Br 270004a_106832991635_100000687066 [2,0,0,0,0,0|2,0,0]=4 5612 B10R1.10 CNCc1cncc(c1)Br 34a_100102657272_100000738771 [2,0,0,0,0,0|2,0,0]=4 5613 B10R1.10 CNCc1cncc(c1)Br 7a_106832991635_100000738771 [2,0,0,0,0,0|2,0,0]=4 5614 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [2,0,0,0,0,0|2,0,0]=4 5615 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [2,0,0,0,0,0|2,0,0]=4 5616 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [2,0,0,0,0,0|2,0,0]=4 5617 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [2,0,0,0,0,0|2,0,0]=4 5618 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [2,0,0,0,0,0|2,0,0]=4 5619 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [2,0,0,0,0,0|2,0,0]=4 5620 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [2,0,0,0,0,0|2,0,0]=4 5621 B10R1.10 CNCc1cncc(c1)Cl 207a_100102657272_100000088910 [2,0,0,0,0,0|2,0,0]=4 5622 B10R1.10 CNCc1cncc(c1)Cl 2230a_106832991635_100016992070 [2,0,0,0,0,0|2,0,0]=4 5623 B10R1.10 CNCc1cncc(c1)Cl 2230a_200020614424_200000210301 [2,0,0,0,0,0|2,0,0]=4 5624 B10R1.10 CNCc1cncc(c1)Cl 270004a_106832991635_100000088910 [2,0,0,0,0,0|2,0,0]=4 5625 B10R1.10 CNCc1cncc(c1)Cl 34a_100102657272_100016992070 [2,0,0,0,0,0|2,0,0]=4 5626 B10R1.10 CNCc1cncc(c1)Cl 7a_106832991635_100016992070 [2,0,0,0,0,0|2,0,0]=4 5627 B10R1.10 CNCc1cncc(c1)F 207a_100102657272_100011361476 [2,0,0,0,0,0|2,0,0]=4 5628 B10R1.10 CNCc1cncc(c1)F 2230a_100011962886_200000210301 [2,0,0,0,0,0|2,0,0]=4 5629 B10R1.10 CNCc1cncc(c1)F 2230a_106832991635_100000725299 [2,0,0,0,0,0|2,0,0]=4 5630 B10R1.10 CNCc1cncc(c1)F 270004a_106832991635_100011361476 [2,0,0,0,0,0|2,0,0]=4 5631 B10R1.10 CNCc1cncc(c1)F 34a_100011962886_200000210301 [2,0,0,0,0,0|2,0,0]=4 5632 B10R1.10 CNCc1cncc(c1)F 34a_100102657272_100000725299 [2,0,0,0,0,0|2,0,0]=4 5633 B10R1.10 CNCc1cncc(c1)F 7a_106832991635_100000725299 [2,0,0,0,0,0|2,0,0]=4 5634 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [2,0,0,0,0,0|1,0,0]=3 5635 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [2,0,0,0,0,0|1,0,0]=3 5636 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [2,0,0,0,0,0|1,0,0]=3 5637 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [2,0,0,0,0,0|2,0,0]=4 5638 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [2,0,0,0,0,0|2,0,0]=4 5639 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [2,0,0,0,0,0|2,0,0]=4 5640 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [2,0,0,0,0,0|2,0,0]=4 5641 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [2,0,0,0,0,0|2,0,0]=4 5642 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [2,0,0,0,0,0|2,0,0]=4 5643 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [2,0,0,0,0,0|2,0,0]=4 5644 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [2,0,0,0,0,0|2,0,0]=4 5645 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [2,0,0,0,0,0|2,0,0]=4 5646 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [2,0,0,0,0,0|2,0,0]=4 5647 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [2,0,0,0,0,0|2,0,0]=4 5648 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [2,0,0,0,0,0|2,0,0]=4 5649 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [2,0,0,0,0,0|2,0,0]=4 5650 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [2,0,0,0,0,0|2,0,0]=4 5651 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [2,0,0,0,0,0|2,0,0]=4 5652 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [2,0,0,0,0,0|2,0,0]=4 5653 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [2,0,0,0,0,0|1,0,0]=3 5654 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [2,0,0,0,0,0|1,0,0]=3 5655 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [2,0,0,0,0,0|2,0,0]=4 5656 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [2,0,0,0,0,0|2,0,0]=4 5657 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [2,0,0,0,0,0|2,0,0]=4 5658 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [2,0,0,0,0,0|2,0,0]=4 5659 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [2,0,0,0,0,0|2,0,0]=4 5660 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [2,0,0,0,0,0|2,0,0]=4 5661 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [2,0,0,0,0,0|2,0,0]=4 5662 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [2,0,0,0,0,0|2,0,0]=4 5663 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [2,0,0,0,0,0|2,0,0]=4 5664 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [2,0,0,0,0,0|2,0,0]=4 5665 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [2,0,0,0,0,0|1,0,0]=3 5666 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [2,0,0,0,0,0|1,0,0]=3 5667 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [2,0,0,0,0,0|2,0,0]=4 5668 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [2,0,0,0,0,0|1,0,0]=3 5669 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [2,0,0,0,0,0|1,0,0]=3 5670 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [2,0,0,0,0,0|2,0,0]=4 5671 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [2,0,0,0,0,0|2,0,0]=4 5672 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [2,0,0,0,0,0|2,0,0]=4 5673 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [2,0,0,0,0,0|2,0,0]=4 5674 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [2,0,0,0,0,0|2,0,0]=4 5675 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [2,0,0,0,0,0|2,0,0]=4 5676 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [2,0,0,0,0,0|2,0,0]=4 5677 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [2,0,0,0,0,0|0,0,2]=4 5678 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [2,0,0,0,0,0|0,0,0]=2 5679 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [2,0,0,0,0,0|1,0,0]=3 5680 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [2,0,0,0,0,0|1,0,1]=4 5681 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [2,0,0,0,0,0|1,0,0]=3 5682 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [2,0,0,0,0,0|2,0,0]=4 5683 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [2,0,0,0,0,0|2,0,0]=4 5684 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [2,0,0,0,0,0|2,0,0]=4 5685 B10R1.10 [13CH3]NCc1cccc(=O)[nH]1 2230a_100000696482_200025704644 [2,0,0,0,0,0|1,0,1]=4 5686 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [2,0,0,0,0,0|1,0,0]=3 5687 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [2,0,0,0,0,0|1,0,0]=3 5688 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [2,0,0,0,0,0|1,0,0]=3 5689 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [2,0,0,0,0,0|1,0,0]=3 5690 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [2,0,0,0,0,0|1,0,0]=3 5691 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [2,0,0,0,0,0|1,0,0]=3 5692 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [2,0,0,0,0,0|1,0,0]=3 5693 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [2,0,0,0,0,0|1,0,0]=3 5694 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [2,0,0,0,0,0|0,0,0]=2 5695 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [2,0,0,0,0,0|0,0,0]=2 5696 B10R1.10 [13CH3]NCc1cccc(n1)Br 2230a_100016987751_200025704644 [2,0,0,0,0,0|2,0,0]=4 5697 B10R1.10 [13CH3]NCc1cccc(n1)Cl 2230a_100016990191_200025704644 [2,0,0,0,0,0|2,0,0]=4 5698 B10R1.10 [13CH3]NCc1cccc(n1)F 2230a_100015188798_200025704644 [2,0,0,0,0,0|2,0,0]=4 5699 B10R1.10 [13CH3]NCc1cccc(n1)F 34a_100015188798_200025704644 [2,0,0,0,0,0|2,0,0]=4 5700 B10R1.10 [13CH3]NCc1ccnc(c1)Br 2230a_100025757509_200025704644 [2,0,0,0,0,0|2,0,0]=4 5701 B10R1.10 [13CH3]NCc1ccnc(c1)Br 34a_100025757509_200025704644 [2,0,0,0,0,0|2,0,0]=4 5702 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 2230a_100015205668_200025704644 [2,0,0,0,0,0|2,0,0]=4 5703 B10R1.10 [13CH3]NCc1ccnc(c1)Cl 34a_100015205668_200025704644 [2,0,0,0,0,0|2,0,0]=4 5704 B10R1.10 [13CH3]NCc1ccnc(c1)F 2230a_100015188774_200025704644 [2,0,0,0,0,0|2,0,0]=4 5705 B10R1.10 [13CH3]NCc1ccnc(c1)F 34a_100015188774_200025704644 [2,0,0,0,0,0|2,0,0]=4 5706 B10R1.10 [13CH3]NCc1cncc(c1)Cl 2230a_200020614424_200025704644 [2,0,0,0,0,0|2,0,0]=4 5707 B10R1.10 [13CH3]NCc1cncc(c1)F 2230a_100011962886_200025704644 [2,0,0,0,0,0|2,0,0]=4 5708 B10R1.10 [13CH3]NCc1cncc(c1)F 34a_100011962886_200025704644 [2,0,0,0,0,0|2,0,0]=4 5709 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [2,0,0,0,0,0|2,0,0]=4 5710 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [2,0,0,0,0,0|2,0,0]=4 5711 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [2,0,0,0,0,0|2,0,0]=4 5712 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [2,0,0,0,0,0|2,0,0]=4 5713 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [2,0,0,0,0,0|2,0,0]=4 5714 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [2,0,0,0,0,0|2,0,0]=4 5715 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [2,0,0,0,0,0|2,0,0]=4 5716 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [2,0,0,0,0,0|2,0,0]=4 5717 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [2,0,0,0,0,0|2,0,0]=4 5718 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [2,0,0,0,0,0|2,0,0]=4 5719 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [2,0,0,0,0,0|2,0,0]=4 5720 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [2,0,0,0,0,0|2,0,0]=4 5721 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [2,0,0,0,0,0|2,0,0]=4 5722 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [2,0,0,0,0,0|2,0,0]=4 5723 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [2,0,0,0,0,0|2,0,0]=4 5724 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [2,0,0,0,0,0|2,0,0]=4 5725 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [2,0,0,0,0,0|2,0,0]=4 5726 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [2,0,0,0,0,0|1,0,0]=3 5727 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [2,0,0,0,0,0|1,0,0]=3 5728 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [2,0,0,0,0,0|0,0,2]=4 5729 B10R1.176 CCc1ccc(c(c1)Br)O 271570a_203496583355_200009997437 [2,0,0,0,0,0|1,0,0]=3 5730 B10R1.176 CCc1ccc(c(c1)F)O 271570a_203496583355_200010339503 [2,0,0,0,0,0|1,0,0]=3 5731 B10R1.176 CCc1ccc(c(c1)O)F 271570a_203496583355_200010244628 [2,0,0,0,0,0|1,0,0]=3 5732 B10R1.176 CCc1ccc(c(c1)O)N 271570a_203496583355_100012339725 [2,0,0,0,0,0|1,0,0]=3 5733 B10R1.176 CCc1ccc(c(c1)O)O 271570a_203496583355_100012339963 [2,0,0,0,0,0|0,0,0]=2 5734 B10R1.176 CNc1cc(c(cn1)O)C 271570a_203496583355_100012352278 [2,0,0,0,0,0|2,0,0]=4 5735 B10R1.176 CNc1ccc(c(c1)Br)Br 2230a_100011306057_200000210301 [2,0,0,0,0,0|2,0,0]=4 5736 B10R1.176 CNc1ccc(c(c1)Br)Br 34a_100011306057_200000210301 [2,0,0,0,0,0|2,0,0]=4 5737 B10R1.176 CNc1ccc(c(c1)Br)Br 7a_100011306057_200000210301 [2,0,0,0,0,0|2,0,0]=4 5738 B10R1.176 CNc1ccc(c(c1)Br)C 2230a_100000736455_200000210301 [2,0,0,0,0,0|2,0,0]=4 5739 B10R1.176 CNc1ccc(c(c1)Br)C 34a_100000736455_200000210301 [2,0,0,0,0,0|2,0,0]=4 5740 B10R1.176 CNc1ccc(c(c1)Br)C 7a_100000736455_200000210301 [2,0,0,0,0,0|2,0,0]=4 5741 B10R1.176 CNc1ccc(c(c1)Br)Cl 2230a_100000686031_200000210301 [2,0,0,0,0,0|2,0,0]=4 5742 B10R1.176 CNc1ccc(c(c1)Br)Cl 34a_100000686031_200000210301 [2,0,0,0,0,0|2,0,0]=4 5743 B10R1.176 CNc1ccc(c(c1)Br)F 2230a_100000760356_200000210301 [2,0,0,0,0,0|2,0,0]=4 5744 B10R1.176 CNc1ccc(c(c1)Br)F 34a_100000760356_200000210301 [2,0,0,0,0,0|2,0,0]=4 5745 B10R1.176 CNc1ccc(c(c1)Br)F 7a_100000760356_200000210301 [2,0,0,0,0,0|2,0,0]=4 5746 B10R1.176 CNc1ccc(c(c1)Br)I 34a_100000750458_200000210301 [2,0,0,0,0,0|2,0,0]=4 5747 B10R1.176 CNc1ccc(c(c1)Br)O 34a_100011534360_200000210301 [2,0,0,0,0,0|1,0,0]=3 5748 B10R1.176 CNc1ccc(c(c1)C)Br 2230a_100000210723_200000210301 [2,0,0,0,0,0|2,0,0]=4 5749 B10R1.176 CNc1ccc(c(c1)C)Br 34a_100000210723_200000210301 [2,0,0,0,0,0|2,0,0]=4 5750 B10R1.176 CNc1ccc(c(c1)C)Br 7a_100000210723_200000210301 [2,0,0,0,0,0|2,0,0]=4 5751 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [2,0,0,0,0,0|2,0,0]=4 5752 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [2,0,0,0,0,0|2,0,0]=4 5753 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [2,0,0,0,0,0|2,0,0]=4 5754 B10R1.176 CNc1ccc(c(c1)C)Cl 2230a_100000187808_200000210301 [2,0,0,0,0,0|2,0,0]=4 5755 B10R1.176 CNc1ccc(c(c1)C)Cl 34a_100000187808_200000210301 [2,0,0,0,0,0|2,0,0]=4 5756 B10R1.176 CNc1ccc(c(c1)C)Cl 7a_100000187808_200000210301 [2,0,0,0,0,0|2,0,0]=4 5757 B10R1.176 CNc1ccc(c(c1)C)F 2230a_100000750164_200000210301 [2,0,0,0,0,0|2,0,0]=4 5758 B10R1.176 CNc1ccc(c(c1)C)F 34a_100000750164_200000210301 [2,0,0,0,0,0|2,0,0]=4 5759 B10R1.176 CNc1ccc(c(c1)C)F 7a_100000750164_200000210301 [2,0,0,0,0,0|2,0,0]=4 5760 B10R1.176 CNc1ccc(c(c1)C)I 34a_100000198070_200000210301 [2,0,0,0,0,0|2,0,0]=4 5761 B10R1.176 CNc1ccc(c(c1)C)I 7a_100000198070_200000210301 [2,0,0,0,0,0|2,0,0]=4 5762 B10R1.176 CNc1ccc(c(c1)C)O 271570a_203496583355_100102888905 [2,0,0,0,0,0|1,0,0]=3 5763 B10R1.176 CNc1ccc(c(c1)C)O 34a_100011218179_200000210301 [2,0,0,0,0,0|1,0,0]=3 5764 B10R1.176 CNc1ccc(c(c1)C)O 7a_100011218179_200000210301 [2,0,0,0,0,0|1,0,0]=3 5765 B10R1.176 CNc1ccc(c(c1)Cl)Br 2230a_100000687081_200000210301 [2,0,0,0,0,0|2,0,0]=4 5766 B10R1.176 CNc1ccc(c(c1)Cl)Br 34a_100000687081_200000210301 [2,0,0,0,0,0|2,0,0]=4 5767 B10R1.176 CNc1ccc(c(c1)Cl)Br 7a_100000687081_200000210301 [2,0,0,0,0,0|2,0,0]=4 5768 B10R1.176 CNc1ccc(c(c1)Cl)C 2230a_100000188892_200000210301 [2,0,0,0,0,0|2,0,0]=4 5769 B10R1.176 CNc1ccc(c(c1)Cl)C 34a_100000188892_200000210301 [2,0,0,0,0,0|2,0,0]=4 5770 B10R1.176 CNc1ccc(c(c1)Cl)C 7a_100000188892_200000210301 [2,0,0,0,0,0|2,0,0]=4 5771 B10R1.176 CNc1ccc(c(c1)Cl)Cl 2230a_100000184108_200000210301 [2,0,0,0,0,0|2,0,0]=4 5772 B10R1.176 CNc1ccc(c(c1)Cl)Cl 34a_100000184108_200000210301 [2,0,0,0,0,0|2,0,0]=4 5773 B10R1.176 CNc1ccc(c(c1)Cl)F 2230a_100000211060_200000210301 [2,0,0,0,0,0|2,0,0]=4 5774 B10R1.176 CNc1ccc(c(c1)Cl)F 34a_100000211060_200000210301 [2,0,0,0,0,0|2,0,0]=4 5775 B10R1.176 CNc1ccc(c(c1)Cl)F 7a_100000211060_200000210301 [2,0,0,0,0,0|2,0,0]=4 5776 B10R1.176 CNc1ccc(c(c1)Cl)I 34a_100000761885_200000210301 [2,0,0,0,0,0|2,0,0]=4 5777 B10R1.176 CNc1ccc(c(c1)Cl)O 34a_100000744943_200000210301 [2,0,0,0,0,0|1,0,0]=3 5778 B10R1.176 CNc1ccc(c(c1)F)Br 2230a_100000759894_200000210301 [2,0,0,0,0,0|2,0,0]=4 5779 B10R1.176 CNc1ccc(c(c1)F)Br 34a_100000759894_200000210301 [2,0,0,0,0,0|2,0,0]=4 5780 B10R1.176 CNc1ccc(c(c1)F)Br 7a_100000759894_200000210301 [2,0,0,0,0,0|2,0,0]=4 5781 B10R1.176 CNc1ccc(c(c1)F)C 2230a_100000210958_200000210301 [2,0,0,0,0,0|2,0,0]=4 5782 B10R1.176 CNc1ccc(c(c1)F)C 34a_100000210958_200000210301 [2,0,0,0,0,0|2,0,0]=4 5783 B10R1.176 CNc1ccc(c(c1)F)C 7a_100000210958_200000210301 [2,0,0,0,0,0|2,0,0]=4 5784 B10R1.176 CNc1ccc(c(c1)F)Cl 2230a_100000739366_200000210301 [2,0,0,0,0,0|2,0,0]=4 5785 B10R1.176 CNc1ccc(c(c1)F)Cl 34a_100000739366_200000210301 [2,0,0,0,0,0|2,0,0]=4 5786 B10R1.176 CNc1ccc(c(c1)F)Cl 7a_100000739366_200000210301 [2,0,0,0,0,0|2,0,0]=4 5787 B10R1.176 CNc1ccc(c(c1)F)F 2230a_100000210724_200000210301 [2,0,0,0,0,0|2,0,0]=4 5788 B10R1.176 CNc1ccc(c(c1)F)F 34a_100000210724_200000210301 [2,0,0,0,0,0|2,0,0]=4 5789 B10R1.176 CNc1ccc(c(c1)F)F 7a_100000210724_200000210301 [2,0,0,0,0,0|2,0,0]=4 5790 B10R1.176 CNc1ccc(c(c1)F)I 34a_100011356925_200000210301 [2,0,0,0,0,0|2,0,0]=4 5791 B10R1.176 CNc1ccc(c(c1)F)I 7a_100011356925_200000210301 [2,0,0,0,0,0|2,0,0]=4 5792 B10R1.176 CNc1ccc(c(c1)F)O 271570a_203496583355_100012285320 [2,0,0,0,0,0|1,0,0]=3 5793 B10R1.176 CNc1ccc(c(c1)F)O 34a_100011220035_200000210301 [2,0,0,0,0,0|1,0,0]=3 5794 B10R1.176 CNc1ccc(c(c1)F)O 7a_100011220035_200000210301 [2,0,0,0,0,0|1,0,0]=3 5795 B10R1.176 CNc1ccc(c(c1)I)Br 34a_100000750459_200000210301 [2,0,0,0,0,0|2,0,0]=4 5796 B10R1.176 CNc1ccc(c(c1)I)C 34a_100000184131_200000210301 [2,0,0,0,0,0|2,0,0]=4 5797 B10R1.176 CNc1ccc(c(c1)I)C 7a_100000184131_200000210301 [2,0,0,0,0,0|2,0,0]=4 5798 B10R1.176 CNc1ccc(c(c1)I)Cl 34a_100012360549_200000210301 [2,0,0,0,0,0|2,0,0]=4 5799 B10R1.176 CNc1ccc(c(c1)I)F 34a_114828291077_200000210301 [2,0,0,0,0,0|2,0,0]=4 5800 B10R1.176 CNc1ccc(c(c1)I)F 7a_114828291077_200000210301 [2,0,0,0,0,0|2,0,0]=4 5801 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [2,0,0,0,0,0|1,0,0]=3 5802 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [2,0,0,0,0,0|1,0,0]=3 5803 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [2,0,0,0,0,0|1,0,0]=3 5804 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [2,0,0,0,0,0|1,0,0]=3 5805 B10R1.176 CNc1ccc(c(c1)O)F 34a_100012017398_200000210301 [2,0,0,0,0,0|1,0,0]=3 5806 B10R1.176 CNc1ccc(c(c1)O)F 7a_100012017398_200000210301 [2,0,0,0,0,0|1,0,0]=3 5807 B10R1.176 CNc1ccc(c(c1)O)O 34a_100102946323_200000210301 [2,0,0,0,0,0|0,0,0]=2 5808 B10R1.176 COc1cc(c(cn1)O)O 271570a_203496583355_100010738159 [2,0,0,0,0,0|2,0,0]=4 5809 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [2,0,0,0,0,0|2,0,0]=4 5810 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [2,0,0,0,0,0|2,0,0]=4 5811 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [2,0,0,0,0,0|2,0,0]=4 5812 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [2,0,0,0,0,0|2,0,0]=4 5813 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [2,0,0,0,0,0|2,0,0]=4 5814 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [2,0,0,0,0,0|2,0,0]=4 5815 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [2,0,0,0,0,0|2,0,0]=4 5816 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [2,0,0,0,0,0|2,0,0]=4 5817 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [2,0,0,0,0,0|2,0,0]=4 5818 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [2,0,0,0,0,0|1,0,0]=3 5819 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [2,0,0,0,0,0|1,0,0]=3 5820 B10R1.176 CSc1ccc(c(c1)Br)O 62a_100012361655_200000210301 [2,0,0,0,0,0|2,0,0]=4 5821 B10R1.176 CSc1ccc(c(c1)Br)O 62a_200000210301_100012361655 [2,0,0,0,0,0|2,0,0]=4 5822 B10R1.176 CSc1ccc(c(c1)C)O 62a_200000210301_100000186361 [2,0,0,0,0,0|2,0,0]=4 5823 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_100012360047_200000210301 [2,0,0,0,0,0|2,0,0]=4 5824 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_200000210301_100012360047 [2,0,0,0,0,0|2,0,0]=4 5825 B10R1.176 CSc1ccc(c(c1)F)O 271570a_203496583355_100009816902 [2,0,0,0,0,0|2,0,0]=4 5826 B10R1.176 CSc1ccc(c(c1)F)O 62a_100000185481_200000210301 [2,0,0,0,0,0|2,0,0]=4 5827 B10R1.176 CSc1ccc(c(c1)F)O 62a_200000210301_100000185481 [2,0,0,0,0,0|2,0,0]=4 5828 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [2,0,0,0,0,0|2,0,0]=4 5829 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [2,0,0,0,0,0|2,0,0]=4 5830 B10R1.176 CSc1ccc(c(c1)O)Br 62a_100012356990_200000210301 [2,0,0,0,0,0|2,0,0]=4 5831 B10R1.176 CSc1ccc(c(c1)O)Br 62a_200000210301_100012356990 [2,0,0,0,0,0|2,0,0]=4 5832 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [2,0,0,0,0,0|2,0,0]=4 5833 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [2,0,0,0,0,0|2,0,0]=4 5834 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [2,0,0,0,0,0|2,0,0]=4 5835 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [2,0,0,0,0,0|2,0,0]=4 5836 B10R1.176 CSc1ccc(c(c1)O)F 271570a_203496583355_200010708804 [2,0,0,0,0,0|2,0,0]=4 5837 B10R1.176 CSc1ccc(c(c1)O)F 62a_100000686035_200000210301 [2,0,0,0,0,0|2,0,0]=4 5838 B10R1.176 CSc1ccc(c(c1)O)F 62a_200000210301_100000686035 [2,0,0,0,0,0|2,0,0]=4 5839 B10R1.176 CSc1ccc(c(c1)O)N 62a_100000739049_200000210301 [2,0,0,0,0,0|2,0,0]=4 5840 B10R1.176 CSc1ccc(c(c1)O)N 62a_200000210301_100000739049 [2,0,0,0,0,0|2,0,0]=4 5841 B10R1.176 CSc1ccc(c(c1)O)O 62a_200000210301_100009813601 [2,0,0,0,0,0|1,0,0]=3 5842 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 2230a_100000210723_200025704644 [2,0,0,0,0,0|2,0,0]=4 5843 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 34a_100000210723_200025704644 [2,0,0,0,0,0|2,0,0]=4 5844 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 7a_100000210723_200025704644 [2,0,0,0,0,0|2,0,0]=4 5845 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 2230a_100000187808_200025704644 [2,0,0,0,0,0|2,0,0]=4 5846 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 34a_100000187808_200025704644 [2,0,0,0,0,0|2,0,0]=4 5847 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 7a_100000187808_200025704644 [2,0,0,0,0,0|2,0,0]=4 5848 B10R1.176 Cc1cc(ccc1F)N[13CH3] 2230a_100000750164_200025704644 [2,0,0,0,0,0|2,0,0]=4 5849 B10R1.176 Cc1cc(ccc1F)N[13CH3] 34a_100000750164_200025704644 [2,0,0,0,0,0|2,0,0]=4 5850 B10R1.176 Cc1cc(ccc1F)N[13CH3] 7a_100000750164_200025704644 [2,0,0,0,0,0|2,0,0]=4 5851 B10R1.176 Cc1cc(ccc1I)N[13CH3] 34a_100000198070_200025704644 [2,0,0,0,0,0|2,0,0]=4 5852 B10R1.176 Cc1cc(ccc1I)N[13CH3] 7a_100000198070_200025704644 [2,0,0,0,0,0|2,0,0]=4 5853 B10R1.176 Cc1cc(ccc1O)CN 271570a_203496583355_100015205234 [2,0,0,0,0,0|1,0,0]=3 5854 B10R1.176 Cc1cc(ccc1O)CO 271570a_203496583355_100000718852 [2,0,0,0,0,0|2,0,0]=4 5855 B10R1.176 Cc1cc(ccc1O)NN 271570a_203496583355_100000745493 [2,0,0,0,0,0|2,0,0]=4 5856 B10R1.176 Cc1cc(ccc1O)N[13CH3] 34a_100011218179_200025704644 [2,0,0,0,0,0|1,0,0]=3 5857 B10R1.176 Cc1cc(ccc1O)N[13CH3] 7a_100011218179_200025704644 [2,0,0,0,0,0|1,0,0]=3 5858 B10R1.176 Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100000186361 [2,0,0,0,0,0|2,0,0]=4 5859 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 2230a_100000736455_200025704644 [2,0,0,0,0,0|2,0,0]=4 5860 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 34a_100000736455_200025704644 [2,0,0,0,0,0|2,0,0]=4 5861 B10R1.176 Cc1ccc(cc1Br)N[13CH3] 7a_100000736455_200025704644 [2,0,0,0,0,0|2,0,0]=4 5862 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [2,0,0,0,0,0|2,0,0]=4 5863 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [2,0,0,0,0,0|2,0,0]=4 5864 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [2,0,0,0,0,0|2,0,0]=4 5865 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 2230a_100000188892_200025704644 [2,0,0,0,0,0|2,0,0]=4 5866 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 34a_100000188892_200025704644 [2,0,0,0,0,0|2,0,0]=4 5867 B10R1.176 Cc1ccc(cc1Cl)N[13CH3] 7a_100000188892_200025704644 [2,0,0,0,0,0|2,0,0]=4 5868 B10R1.176 Cc1ccc(cc1F)N[13CH3] 2230a_100000210958_200025704644 [2,0,0,0,0,0|2,0,0]=4 5869 B10R1.176 Cc1ccc(cc1F)N[13CH3] 34a_100000210958_200025704644 [2,0,0,0,0,0|2,0,0]=4 5870 B10R1.176 Cc1ccc(cc1F)N[13CH3] 7a_100000210958_200025704644 [2,0,0,0,0,0|2,0,0]=4 5871 B10R1.176 Cc1ccc(cc1I)N[13CH3] 34a_100000184131_200025704644 [2,0,0,0,0,0|2,0,0]=4 5872 B10R1.176 Cc1ccc(cc1I)N[13CH3] 7a_100000184131_200025704644 [2,0,0,0,0,0|2,0,0]=4 5873 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [2,0,0,0,0,0|2,0,0]=4 5874 B10R1.176 Cc1ccc(cc1O)NN 271570a_203496583355_100016991967 [2,0,0,0,0,0|2,0,0]=4 5875 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [2,0,0,0,0,0|1,0,0]=3 5876 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [2,0,0,0,0,0|1,0,0]=3 5877 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [2,0,0,0,0,0|2,0,0]=4 5878 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [2,0,0,0,0,0|2,0,0]=4 5879 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000724445 [2,0,0,0,0,0|0,0,2]=4 5880 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000725478 [2,0,0,0,0,0|0,0,2]=4 5881 B10R1.176 NCc1ccc(c(c1)F)O 271570a_203496583355_100000755036 [2,0,0,0,0,0|1,0,0]=3 5882 B10R1.176 NCc1ccc(c(c1)O)F 271570a_203496583355_100015193890 [2,0,0,0,0,0|1,0,0]=3 5883 B10R1.176 NNc1ccc(c(c1)F)O 271570a_203496583355_100016992936 [2,0,0,0,0,0|2,0,0]=4 5884 B10R1.176 NNc1ccc(c(c1)O)F 271570a_203496583355_200025705588 [2,0,0,0,0,0|2,0,0]=4 5885 B10R1.176 Nc1cc(ccc1O)CO 271570a_203496583355_100012347568 [2,0,0,0,0,0|2,0,0]=4 5886 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [2,0,0,0,0,0|1,0,1]=4 5887 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [2,0,0,0,0,0|1,0,1]=4 5888 B10R1.176 OCc1ccc(c(c1)Cl)O 271570a_203496583355_100000718186 [2,0,0,0,0,0|2,0,0]=4 5889 B10R1.176 OCc1ccc(c(c1)F)O 271570a_203496583355_100011533735 [2,0,0,0,0,0|2,0,0]=4 5890 B10R1.176 OCc1ccc(c(c1)O)F 271570a_203496583355_100000246287 [2,0,0,0,0,0|2,0,0]=4 5891 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100000049605 [2,0,0,0,0,0|1,0,0]=3 5892 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100011191544 [2,0,0,0,0,0|1,0,0]=3 5893 B10R1.176 OCc1ccc(c(n1)O)O 271570a_203496583355_200000118097 [2,0,0,0,0,0|2,0,0]=4 5894 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 2230a_100011306057_200025704644 [2,0,0,0,0,0|2,0,0]=4 5895 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 34a_100011306057_200025704644 [2,0,0,0,0,0|2,0,0]=4 5896 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Br 7a_100011306057_200025704644 [2,0,0,0,0,0|2,0,0]=4 5897 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 2230a_100000686031_200025704644 [2,0,0,0,0,0|2,0,0]=4 5898 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)Cl 34a_100000686031_200025704644 [2,0,0,0,0,0|2,0,0]=4 5899 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 2230a_100000760356_200025704644 [2,0,0,0,0,0|2,0,0]=4 5900 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 34a_100000760356_200025704644 [2,0,0,0,0,0|2,0,0]=4 5901 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)F 7a_100000760356_200025704644 [2,0,0,0,0,0|2,0,0]=4 5902 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)I 34a_100000750458_200025704644 [2,0,0,0,0,0|2,0,0]=4 5903 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)O 34a_100011534360_200025704644 [2,0,0,0,0,0|1,0,0]=3 5904 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 2230a_100000687081_200025704644 [2,0,0,0,0,0|2,0,0]=4 5905 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 34a_100000687081_200025704644 [2,0,0,0,0,0|2,0,0]=4 5906 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Br 7a_100000687081_200025704644 [2,0,0,0,0,0|2,0,0]=4 5907 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 2230a_100000184108_200025704644 [2,0,0,0,0,0|2,0,0]=4 5908 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)Cl 34a_100000184108_200025704644 [2,0,0,0,0,0|2,0,0]=4 5909 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 2230a_100000211060_200025704644 [2,0,0,0,0,0|2,0,0]=4 5910 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 34a_100000211060_200025704644 [2,0,0,0,0,0|2,0,0]=4 5911 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)F 7a_100000211060_200025704644 [2,0,0,0,0,0|2,0,0]=4 5912 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)I 34a_100000761885_200025704644 [2,0,0,0,0,0|2,0,0]=4 5913 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)O 34a_100000744943_200025704644 [2,0,0,0,0,0|1,0,0]=3 5914 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 2230a_100000759894_200025704644 [2,0,0,0,0,0|2,0,0]=4 5915 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 34a_100000759894_200025704644 [2,0,0,0,0,0|2,0,0]=4 5916 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Br 7a_100000759894_200025704644 [2,0,0,0,0,0|2,0,0]=4 5917 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 2230a_100000739366_200025704644 [2,0,0,0,0,0|2,0,0]=4 5918 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 34a_100000739366_200025704644 [2,0,0,0,0,0|2,0,0]=4 5919 B10R1.176 [13CH3]Nc1ccc(c(c1)F)Cl 7a_100000739366_200025704644 [2,0,0,0,0,0|2,0,0]=4 5920 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 2230a_100000210724_200025704644 [2,0,0,0,0,0|2,0,0]=4 5921 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 34a_100000210724_200025704644 [2,0,0,0,0,0|2,0,0]=4 5922 B10R1.176 [13CH3]Nc1ccc(c(c1)F)F 7a_100000210724_200025704644 [2,0,0,0,0,0|2,0,0]=4 5923 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 34a_100011356925_200025704644 [2,0,0,0,0,0|2,0,0]=4 5924 B10R1.176 [13CH3]Nc1ccc(c(c1)F)I 7a_100011356925_200025704644 [2,0,0,0,0,0|2,0,0]=4 5925 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 34a_100011220035_200025704644 [2,0,0,0,0,0|1,0,0]=3 5926 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 7a_100011220035_200025704644 [2,0,0,0,0,0|1,0,0]=3 5927 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Br 34a_100000750459_200025704644 [2,0,0,0,0,0|2,0,0]=4 5928 B10R1.176 [13CH3]Nc1ccc(c(c1)I)Cl 34a_100012360549_200025704644 [2,0,0,0,0,0|2,0,0]=4 5929 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 34a_114828291077_200025704644 [2,0,0,0,0,0|2,0,0]=4 5930 B10R1.176 [13CH3]Nc1ccc(c(c1)I)F 7a_114828291077_200025704644 [2,0,0,0,0,0|2,0,0]=4 5931 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [2,0,0,0,0,0|1,0,0]=3 5932 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 34a_100012017398_200025704644 [2,0,0,0,0,0|1,0,0]=3 5933 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 7a_100012017398_200025704644 [2,0,0,0,0,0|1,0,0]=3 5934 B10R1.176 [13CH3]Nc1ccc(c(c1)O)O 34a_100102946323_200025704644 [2,0,0,0,0,0|0,0,0]=2 5935 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_100012361655_200025704644 [2,0,0,0,0,0|2,0,0]=4 5936 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_200025704644_100012361655 [2,0,0,0,0,0|2,0,0]=4 5937 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_100012360047_200025704644 [2,0,0,0,0,0|2,0,0]=4 5938 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_200025704644_100012360047 [2,0,0,0,0,0|2,0,0]=4 5939 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_100000185481_200025704644 [2,0,0,0,0,0|2,0,0]=4 5940 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_200025704644_100000185481 [2,0,0,0,0,0|2,0,0]=4 5941 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [2,0,0,0,0,0|2,0,0]=4 5942 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [2,0,0,0,0,0|2,0,0]=4 5943 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_100012356990_200025704644 [2,0,0,0,0,0|2,0,0]=4 5944 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_200025704644_100012356990 [2,0,0,0,0,0|2,0,0]=4 5945 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [2,0,0,0,0,0|2,0,0]=4 5946 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [2,0,0,0,0,0|2,0,0]=4 5947 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_100000686035_200025704644 [2,0,0,0,0,0|2,0,0]=4 5948 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_200025704644_100000686035 [2,0,0,0,0,0|2,0,0]=4 5949 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_100000739049_200025704644 [2,0,0,0,0,0|2,0,0]=4 5950 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_200025704644_100000739049 [2,0,0,0,0,0|2,0,0]=4 5951 B10R1.176 [13CH3]Sc1ccc(c(c1)O)O 62a_200025704644_100009813601 [2,0,0,0,0,0|1,0,0]=3 5952 B12R1.1 C#CCCNc1ccc(cc1)O 34a_100000185829_100000688953 [1,1,0,0,0,0|1,0,1]=4 5953 B12R1.1 C#CCCSc1ccc(cc1)O 62a_100000688953_100000185759 [1,1,0,0,0,0|1,0,1]=4 5954 B12R1.1 C#CCNCc1ccc(cc1)O 34a_100000185549_100000184674 [1,1,0,0,0,0|1,0,1]=4 5955 B12R1.1 C/C=C/CNc1ccc(cc1)O 34a_100000185829_100102629194 [1,1,0,0,0,0|1,0,1]=4 5956 B12R1.1 C/C=C/CSc1ccc(cc1)O 62a_100102629194_100000185759 [1,1,0,0,0,0|1,0,1]=4 5957 B12R1.1 C=CCCNc1ccc(cc1)O 34a_100000185829_100000754431 [1,1,0,0,0,0|1,0,1]=4 5958 B12R1.1 C=CCCOc1ccc(cc1)O 271570a_203496583355_100012049633 [1,1,0,0,0,0|1,0,1]=4 5959 B12R1.1 C=CCCSc1ccc(cc1)O 62a_100000754431_100000185759 [1,1,0,0,0,0|1,0,1]=4 5960 B12R1.1 C=CCNCc1ccc(cc1)O 34a_100000185549_100015514636 [1,1,0,0,0,0|1,0,1]=4 5961 B12R1.1 CC#CCNc1ccc(cc1)O 34a_100000185829_100000748600 [1,1,0,0,0,0|1,0,1]=4 5962 B12R1.1 CC#CCSc1ccc(cc1)O 62a_100000748600_100000185759 [1,1,0,0,0,0|1,0,1]=4 5963 B12R1.1 CC=CCNc1ccc(cc1)O 34a_100000185829_100000070051 [1,1,0,0,0,0|1,0,1]=4 5964 B12R1.1 CC=CCSc1ccc(cc1)O 62a_100000070051_100000185759 [1,1,0,0,0,0|1,0,1]=4 5965 B12R1.1 CCCC=Cc1ccc(cc1)O 271570a_100016258520_100000185759 [1,1,0,0,0,0|1,0,1]=4 5966 B12R1.1 CCCCCc1ccc(cc1)O 271570a_203496583355_100009813665 [1,1,0,0,0,0|1,0,0]=3 5967 B12R1.1 CCCCNc1ccc(cc1)Br 2230a_100000210018_100000210211 [1,1,0,0,0,0|2,0,0]=4 5968 B12R1.1 CCCCNc1ccc(cc1)Br 34a_100000210018_100000210210 [1,1,0,0,0,0|2,0,0]=4 5969 B12R1.1 CCCCNc1ccc(cc1)C 34a_100000124888_100000210210 [1,1,0,0,0,0|2,0,0]=4 5970 B12R1.1 CCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210211 [1,1,0,0,0,0|2,0,0]=4 5971 B12R1.1 CCCCNc1ccc(cc1)Cl 34a_100000210052_100000210210 [1,1,0,0,0,0|2,0,0]=4 5972 B12R1.1 CCCCNc1ccc(cc1)F 34a_100000185862_100000210210 [1,1,0,0,0,0|2,0,0]=4 5973 B12R1.1 CCCCNc1ccc(cc1)I 34a_100000185761_100000210210 [1,1,0,0,0,0|2,0,0]=4 5974 B12R1.1 CCCCNc1ccc(cc1)O 34a_100000185829_100000210210 [1,1,0,0,0,0|1,0,0]=3 5975 B12R1.1 CCCCNc1ccc(cn1)O 271570a_203496583355_200011243049 [1,1,0,0,0,0|2,0,0]=4 5976 B12R1.1 CCCCOc1ccc(cc1)Br 34a_100000185759_100000210210 [1,1,0,0,0,0|2,0,0]=4 5977 B12R1.1 CCCCOc1ccc(cc1)Br 7a_100000185759_100000210211 [1,1,0,0,0,0|2,0,0]=4 5978 B12R1.1 CCCCOc1ccc(cc1)C 34a_100000210336_100000210210 [1,1,0,0,0,0|2,0,0]=4 5979 B12R1.1 CCCCOc1ccc(cc1)C 7a_100000210336_100000210211 [1,1,0,0,0,0|2,0,0]=4 5980 B12R1.1 CCCCOc1ccc(cc1)Cl 34a_100000210216_100000210210 [1,1,0,0,0,0|2,0,0]=4 5981 B12R1.1 CCCCOc1ccc(cc1)Cl 7a_100000210216_100000210211 [1,1,0,0,0,0|2,0,0]=4 5982 B12R1.1 CCCCOc1ccc(cc1)F 34a_100000210339_100000210210 [1,1,0,0,0,0|2,0,0]=4 5983 B12R1.1 CCCCOc1ccc(cc1)I 34a_100000212066_100000210210 [1,1,0,0,0,0|2,0,0]=4 5984 B12R1.1 CCCCOc1ccc(cc1)I 7a_100000212066_100000210211 [1,1,0,0,0,0|2,0,0]=4 5985 B12R1.1 CCCCOc1ccc(cc1)N 34a_100000185829_100000210210 [1,1,0,0,0,0|2,0,0]=4 5986 B12R1.1 CCCCOc1ccc(cc1)O 271570a_203496583355_100000230682 [1,1,0,0,0,0|1,0,0]=3 5987 B12R1.1 CCCCSc1ccc(cc1)Br 62a_100000210211_100000752885 [1,1,0,0,0,0|2,0,0]=4 5988 B12R1.1 CCCCSc1ccc(cc1)Br 62a_100000752885_100000210210 [1,1,0,0,0,0|2,0,0]=4 5989 B12R1.1 CCCCSc1ccc(cc1)C 62a_100000186775_100000210210 [1,1,0,0,0,0|2,0,0]=4 5990 B12R1.1 CCCCSc1ccc(cc1)C 62a_100000210211_100000186775 [1,1,0,0,0,0|2,0,0]=4 5991 B12R1.1 CCCCSc1ccc(cc1)Cl 62a_100000210211_100000755918 [1,1,0,0,0,0|2,0,0]=4 5992 B12R1.1 CCCCSc1ccc(cc1)Cl 62a_100000755918_100000210210 [1,1,0,0,0,0|2,0,0]=4 5993 B12R1.1 CCCCSc1ccc(cc1)F 62a_100000210211_100000211213 [1,1,0,0,0,0|2,0,0]=4 5994 B12R1.1 CCCCSc1ccc(cc1)F 62a_100000211213_100000210210 [1,1,0,0,0,0|2,0,0]=4 5995 B12R1.1 CCCCSc1ccc(cc1)N 62a_100000185761_100000210210 [1,1,0,0,0,0|2,0,0]=4 5996 B12R1.1 CCCCSc1ccc(cc1)N 62a_100000210211_100000185761 [1,1,0,0,0,0|2,0,0]=4 5997 B12R1.1 CCCCSc1ccc(cc1)O 62a_100000210211_100000185759 [1,1,0,0,0,0|1,0,0]=3 5998 B12R1.1 CCCCSc1ccc(cn1)O 62a_100000210211_100000744096 [1,1,0,0,0,0|2,0,0]=4 5999 B12R1.1 CCCCSc1ccc(cn1)O 62a_100000685995_100000210210 [1,1,0,0,0,0|2,0,0]=4 6000 B12R1.1 CCCNCc1ccc(cc1)Br 207a_100020643023_100000186029 [1,1,0,0,0,0|2,0,0]=4 6001 B12R1.1 CCCNCc1ccc(cc1)Br 2230a_100000174875_100000210303 [1,1,0,0,0,0|2,0,0]=4 6002 B12R1.1 CCCNCc1ccc(cc1)Br 270004a_100020643023_100000186029 [1,1,0,0,0,0|2,0,0]=4 6003 B12R1.1 CCCNCc1ccc(cc1)Br 34a_100000174875_100000210303 [1,1,0,0,0,0|2,0,0]=4 6004 B12R1.1 CCCNCc1ccc(cc1)C 207a_100020643023_100000211033 [1,1,0,0,0,0|2,0,0]=4 6005 B12R1.1 CCCNCc1ccc(cc1)C 2230a_100000174908_100000210303 [1,1,0,0,0,0|2,0,0]=4 6006 B12R1.1 CCCNCc1ccc(cc1)C 270004a_100020643023_100000211033 [1,1,0,0,0,0|2,0,0]=4 6007 B12R1.1 CCCNCc1ccc(cc1)C 34a_100000174908_100000210303 [1,1,0,0,0,0|2,0,0]=4 6008 B12R1.1 CCCNCc1ccc(cc1)Cl 207a_100020643023_100000189385 [1,1,0,0,0,0|2,0,0]=4 6009 B12R1.1 CCCNCc1ccc(cc1)Cl 2230a_100000174871_100000210303 [1,1,0,0,0,0|2,0,0]=4 6010 B12R1.1 CCCNCc1ccc(cc1)Cl 270004a_100020643023_100000189385 [1,1,0,0,0,0|2,0,0]=4 6011 B12R1.1 CCCNCc1ccc(cc1)Cl 34a_100000174871_100000210303 [1,1,0,0,0,0|2,0,0]=4 6012 B12R1.1 CCCNCc1ccc(cc1)F 207a_100020643023_100000210084 [1,1,0,0,0,0|2,0,0]=4 6013 B12R1.1 CCCNCc1ccc(cc1)F 2230a_100000174882_100000210303 [1,1,0,0,0,0|2,0,0]=4 6014 B12R1.1 CCCNCc1ccc(cc1)F 270004a_100020643023_100000210084 [1,1,0,0,0,0|2,0,0]=4 6015 B12R1.1 CCCNCc1ccc(cc1)F 34a_100000174882_100000210303 [1,1,0,0,0,0|2,0,0]=4 6016 B12R1.1 CCCNCc1ccc(cc1)I 207a_100020643023_100000188517 [1,1,0,0,0,0|2,0,0]=4 6017 B12R1.1 CCCNCc1ccc(cc1)I 2230a_100016989417_100000210303 [1,1,0,0,0,0|2,0,0]=4 6018 B12R1.1 CCCNCc1ccc(cc1)I 34a_100016989417_100000210303 [1,1,0,0,0,0|2,0,0]=4 6019 B12R1.1 CCCNCc1ccc(cc1)O 34a_100000185549_100000210303 [1,1,0,0,0,0|1,0,0]=3 6020 B12R1.1 CCCNCc1ccc(nc1)O 207a_100020643023_100011361521 [1,1,0,0,0,0|2,0,0]=4 6021 B12R1.1 CCCNCc1ccc(nc1)O 2230a_100000757128_100000210303 [1,1,0,0,0,0|2,0,0]=4 6022 B12R1.1 CCCOCc1ccc(cc1)Br 34a_100000210258_100000189115 [1,1,0,0,0,0|2,0,0]=4 6023 B12R1.1 CCCOCc1ccc(cc1)Br 34a_100000695286_100000210303 [1,1,0,0,0,0|2,0,0]=4 6024 B12R1.1 CCCOCc1ccc(cc1)C 34a_100000210258_100000210814 [1,1,0,0,0,0|2,0,0]=4 6025 B12R1.1 CCCOCc1ccc(cc1)C 34a_100011215236_100000210303 [1,1,0,0,0,0|2,0,0]=4 6026 B12R1.1 CCCOCc1ccc(cc1)C 7a_100011215236_100000210303 [1,1,0,0,0,0|2,0,0]=4 6027 B12R1.1 CCCOCc1ccc(cc1)Cl 34a_100000210258_100000694040 [1,1,0,0,0,0|2,0,0]=4 6028 B12R1.1 CCCOCc1ccc(cc1)Cl 34a_100000211118_100000210303 [1,1,0,0,0,0|2,0,0]=4 6029 B12R1.1 CCCOCc1ccc(cc1)Cl 7a_100000211118_100000210303 [1,1,0,0,0,0|2,0,0]=4 6030 B12R1.1 CCCOCc1ccc(cc1)F 34a_100000210258_100000198546 [1,1,0,0,0,0|2,0,0]=4 6031 B12R1.1 CCCOCc1ccc(cc1)F 34a_100000210977_100000210303 [1,1,0,0,0,0|2,0,0]=4 6032 B12R1.1 CCCOCc1ccc(cc1)F 7a_100000210977_100000210303 [1,1,0,0,0,0|2,0,0]=4 6033 B12R1.1 CCCOCc1ccc(cc1)I 34a_100000210258_100000189116 [1,1,0,0,0,0|2,0,0]=4 6034 B12R1.1 CCCOCc1ccc(cc1)I 34a_100000690907_100000210303 [1,1,0,0,0,0|2,0,0]=4 6035 B12R1.1 CCCOCc1ccc(cc1)I 7a_100000690907_100000210303 [1,1,0,0,0,0|2,0,0]=4 6036 B12R1.1 CCCOCc1ccc(cc1)N 34a_100011215238_100000210303 [1,1,0,0,0,0|2,0,0]=4 6037 B12R1.1 CCCSCc1ccc(cc1)Br 62a_100000189115_100000210303 [1,1,0,0,0,0|2,0,0]=4 6038 B12R1.1 CCCSCc1ccc(cc1)Br 62a_100000210303_100000189115 [1,1,0,0,0,0|2,0,0]=4 6039 B12R1.1 CCCSCc1ccc(cc1)C 62a_100000210303_100000210814 [1,1,0,0,0,0|2,0,0]=4 6040 B12R1.1 CCCSCc1ccc(cc1)C 62a_100000210814_100000210303 [1,1,0,0,0,0|2,0,0]=4 6041 B12R1.1 CCCSCc1ccc(cc1)Cl 62a_100000187161_100000210303 [1,1,0,0,0,0|2,0,0]=4 6042 B12R1.1 CCCSCc1ccc(cc1)Cl 62a_100000210303_100000187161 [1,1,0,0,0,0|2,0,0]=4 6043 B12R1.1 CCCSCc1ccc(cc1)F 62a_100000198546_100000210303 [1,1,0,0,0,0|2,0,0]=4 6044 B12R1.1 CCCSCc1ccc(cc1)F 62a_100000210303_100000187164 [1,1,0,0,0,0|2,0,0]=4 6045 B12R1.1 CCCSCc1ccc(cc1)I 62a_100000189116_100000210303 [1,1,0,0,0,0|2,0,0]=4 6046 B12R1.1 CCCSCc1ccc(cc1)I 62a_100000210303_100000189116 [1,1,0,0,0,0|2,0,0]=4 6047 B12R1.1 CCNCCc1ccc(cc1)Br 2230a_100000755846_100000210202 [1,1,0,0,0,0|1,0,0]=3 6048 B12R1.1 CCNCCc1ccc(cc1)Br 2230a_100015525214_100011740612 [1,1,0,0,0,0|1,0,0]=3 6049 B12R1.1 CCNCCc1ccc(cc1)Br 34a_100000755846_100000210202 [1,1,0,0,0,0|1,0,0]=3 6050 B12R1.1 CCNCCc1ccc(cc1)C 2230a_100000705350_100000210202 [1,1,0,0,0,0|1,0,0]=3 6051 B12R1.1 CCNCCc1ccc(cc1)C 2230a_100015525214_100011713686 [1,1,0,0,0,0|1,0,0]=3 6052 B12R1.1 CCNCCc1ccc(cc1)C 34a_100000705350_100000210202 [1,1,0,0,0,0|1,0,0]=3 6053 B12R1.1 CCNCCc1ccc(cc1)Cl 2230a_100000185265_100000210202 [1,1,0,0,0,0|1,0,0]=3 6054 B12R1.1 CCNCCc1ccc(cc1)Cl 2230a_100015525214_100011713675 [1,1,0,0,0,0|1,0,0]=3 6055 B12R1.1 CCNCCc1ccc(cc1)Cl 34a_100000185265_100000210202 [1,1,0,0,0,0|1,0,0]=3 6056 B12R1.1 CCNCCc1ccc(cc1)F 2230a_100000199005_100000210202 [1,1,0,0,0,0|1,0,0]=3 6057 B12R1.1 CCNCCc1ccc(cc1)F 2230a_100015525214_100011217392 [1,1,0,0,0,0|1,0,0]=3 6058 B12R1.1 CCNCCc1ccc(cc1)F 34a_100000199005_100000210202 [1,1,0,0,0,0|1,0,0]=3 6059 B12R1.1 CCNCCc1ccc(cc1)O 2230a_100015525214_100009816426 [1,1,0,0,0,0|0,0,0]=2 6060 B12R1.1 CCNCCc1ccc(cc1)O 34a_100000743037_100000210202 [1,1,0,0,0,0|0,0,0]=2 6061 B12R1.1 CCNN=Cc1ccc(cc1)O 4a_100000756455_100000185832 [1,1,0,0,0,0|1,0,1]=4 6062 B12R1.1 CCOCCc1ccc(cc1)Br 34a_100000766406_100000210202 [1,1,0,0,0,0|2,0,0]=4 6063 B12R1.1 CCOCCc1ccc(cc1)Br 34a_100121572206_100011740612 [1,1,0,0,0,0|2,0,0]=4 6064 B12R1.1 CCOCCc1ccc(cc1)Br 7a_100000766406_100000210202 [1,1,0,0,0,0|2,0,0]=4 6065 B12R1.1 CCOCCc1ccc(cc1)C 34a_100000756670_100000210202 [1,1,0,0,0,0|2,0,0]=4 6066 B12R1.1 CCOCCc1ccc(cc1)C 34a_100121572206_100011713686 [1,1,0,0,0,0|2,0,0]=4 6067 B12R1.1 CCOCCc1ccc(cc1)C 7a_100000756670_100000210202 [1,1,0,0,0,0|2,0,0]=4 6068 B12R1.1 CCOCCc1ccc(cc1)Cl 34a_100011219627_100000210202 [1,1,0,0,0,0|2,0,0]=4 6069 B12R1.1 CCOCCc1ccc(cc1)Cl 34a_100121572206_100011713675 [1,1,0,0,0,0|2,0,0]=4 6070 B12R1.1 CCOCCc1ccc(cc1)Cl 7a_100011219627_100000210202 [1,1,0,0,0,0|2,0,0]=4 6071 B12R1.1 CCOCCc1ccc(cc1)F 34a_100000754732_100000210202 [1,1,0,0,0,0|2,0,0]=4 6072 B12R1.1 CCOCCc1ccc(cc1)F 34a_100121572206_100011217392 [1,1,0,0,0,0|2,0,0]=4 6073 B12R1.1 CCOCCc1ccc(cc1)F 7a_100000754732_100000210202 [1,1,0,0,0,0|2,0,0]=4 6074 B12R1.1 CCOCCc1ccc(cc1)I 34a_100012291149_100000210202 [1,1,0,0,0,0|2,0,0]=4 6075 B12R1.1 CCOCCc1ccc(cc1)I 7a_100012291149_100000210202 [1,1,0,0,0,0|2,0,0]=4 6076 B12R1.1 CCOCCc1ccc(cc1)N 34a_100011204434_100000210202 [1,1,0,0,0,0|2,0,0]=4 6077 B12R1.1 CCOCSc1ccc(cc1)O 62a_100000739092_100000185759 [1,1,0,0,0,0|2,0,0]=4 6078 B12R1.1 CCSCCc1ccc(cc1)Br 62a_100000210202_100011740612 [1,1,0,0,0,0|2,0,0]=4 6079 B12R1.1 CCSCCc1ccc(cc1)Br 62a_100011740612_100000210202 [1,1,0,0,0,0|2,0,0]=4 6080 B12R1.1 CCSCCc1ccc(cc1)C 62a_100000210202_100011713686 [1,1,0,0,0,0|2,0,0]=4 6081 B12R1.1 CCSCCc1ccc(cc1)C 62a_100011713686_100000210202 [1,1,0,0,0,0|2,0,0]=4 6082 B12R1.1 CCSCCc1ccc(cc1)Cl 62a_100000210202_100011713675 [1,1,0,0,0,0|2,0,0]=4 6083 B12R1.1 CCSCCc1ccc(cc1)Cl 62a_100011713675_100000210202 [1,1,0,0,0,0|2,0,0]=4 6084 B12R1.1 CCSCCc1ccc(cc1)F 62a_100000210202_100011217392 [1,1,0,0,0,0|2,0,0]=4 6085 B12R1.1 CCSCCc1ccc(cc1)F 62a_100011217392_100000210202 [1,1,0,0,0,0|2,0,0]=4 6086 B12R1.1 CCSCCc1ccc(cc1)O 62a_100000210202_100009816426 [1,1,0,0,0,0|1,0,0]=3 6087 B12R1.1 CCSCCc1ccc(cc1)O 62a_100009816426_100000210202 [1,1,0,0,0,0|1,0,0]=3 6088 B12R1.1 CNCC#Cc1ccc(cc1)Br 2230a_106832991635_100010706785 [1,1,0,0,0,0|1,0,1]=4 6089 B12R1.1 CNCC#Cc1ccc(cc1)Br 34a_100102657272_100010706785 [1,1,0,0,0,0|1,0,1]=4 6090 B12R1.1 CNCC#Cc1ccc(cc1)Br 7a_106832991635_100010706785 [1,1,0,0,0,0|1,0,1]=4 6091 B12R1.1 CNCC#Cc1ccc(cc1)Cl 2230a_100011352944_200000210301 [1,1,0,0,0,0|1,0,1]=4 6092 B12R1.1 CNCC#Cc1ccc(cc1)Cl 34a_100011352944_200000210301 [1,1,0,0,0,0|1,0,1]=4 6093 B12R1.1 CNCC#Cc1ccc(cc1)F 2230a_106832991635_100010402171 [1,1,0,0,0,0|1,0,1]=4 6094 B12R1.1 CNCC#Cc1ccc(cc1)F 34a_100102657272_100010402171 [1,1,0,0,0,0|1,0,1]=4 6095 B12R1.1 CNCC#Cc1ccc(cc1)F 7a_106832991635_100010402171 [1,1,0,0,0,0|1,0,1]=4 6096 B12R1.1 CNCC=Cc1ccc(cc1)Br 270004a_106832991635_100016291818 [1,1,0,0,0,0|1,0,1]=4 6097 B12R1.1 CNCC=Cc1ccc(cc1)C 270004a_106832991635_100016257026 [1,1,0,0,0,0|1,0,1]=4 6098 B12R1.1 CNCC=Cc1ccc(cc1)Cl 270004a_106832991635_100102525842 [1,1,0,0,0,0|1,0,1]=4 6099 B12R1.1 CNCC=Cc1ccc(cc1)F 270004a_106832991635_100016272083 [1,1,0,0,0,0|1,0,1]=4 6100 B12R1.1 CNCCCc1ccc(cc1)Br 2230a_100011297623_200000210301 [1,1,0,0,0,0|1,0,0]=3 6101 B12R1.1 CNCCCc1ccc(cc1)Br 2230a_106832991635_100011713682 [1,1,0,0,0,0|1,0,0]=3 6102 B12R1.1 CNCCCc1ccc(cc1)Br 34a_100011297623_200000210301 [1,1,0,0,0,0|1,0,0]=3 6103 B12R1.1 CNCCCc1ccc(cc1)Br 34a_100102657272_100011713682 [1,1,0,0,0,0|1,0,0]=3 6104 B12R1.1 CNCCCc1ccc(cc1)Br 7a_106832991635_100011713682 [1,1,0,0,0,0|1,0,0]=3 6105 B12R1.1 CNCCCc1ccc(cc1)C 2230a_100011236272_200000210301 [1,1,0,0,0,0|1,0,0]=3 6106 B12R1.1 CNCCCc1ccc(cc1)C 34a_100011236272_200000210301 [1,1,0,0,0,0|1,0,0]=3 6107 B12R1.1 CNCCCc1ccc(cc1)Cl 2230a_100000748451_200000210301 [1,1,0,0,0,0|1,0,0]=3 6108 B12R1.1 CNCCCc1ccc(cc1)Cl 2230a_106832991635_100000759440 [1,1,0,0,0,0|1,0,0]=3 6109 B12R1.1 CNCCCc1ccc(cc1)Cl 34a_100000748451_200000210301 [1,1,0,0,0,0|1,0,0]=3 6110 B12R1.1 CNCCCc1ccc(cc1)Cl 34a_100102657272_100000759440 [1,1,0,0,0,0|1,0,0]=3 6111 B12R1.1 CNCCCc1ccc(cc1)Cl 7a_106832991635_100000759440 [1,1,0,0,0,0|1,0,0]=3 6112 B12R1.1 CNCCCc1ccc(cc1)F 2230a_100025745824_200000210301 [1,1,0,0,0,0|1,0,0]=3 6113 B12R1.1 CNCCCc1ccc(cc1)F 2230a_106832991635_200011713563 [1,1,0,0,0,0|1,0,0]=3 6114 B12R1.1 CNCCCc1ccc(cc1)F 34a_100025745824_200000210301 [1,1,0,0,0,0|1,0,0]=3 6115 B12R1.1 CNCCCc1ccc(cc1)F 34a_100102657272_200011713563 [1,1,0,0,0,0|1,0,0]=3 6116 B12R1.1 CNCCCc1ccc(cc1)F 7a_106832991635_200011713563 [1,1,0,0,0,0|1,0,0]=3 6117 B12R1.1 CNCCOc1ccc(cc1)Br 2230a_100000746992_200000210301 [1,1,0,0,0,0|1,0,0]=3 6118 B12R1.1 CNCCOc1ccc(cc1)Br 2230a_106832991635_100000183278 [1,1,0,0,0,0|1,0,0]=3 6119 B12R1.1 CNCCOc1ccc(cc1)Br 34a_100000746992_200000210301 [1,1,0,0,0,0|1,0,0]=3 6120 B12R1.1 CNCCOc1ccc(cc1)Br 34a_100102657272_100000183278 [1,1,0,0,0,0|1,0,0]=3 6121 B12R1.1 CNCCOc1ccc(cc1)Br 7a_106832991635_100000183278 [1,1,0,0,0,0|1,0,0]=3 6122 B12R1.1 CNCCOc1ccc(cc1)C 2230a_100020666663_200000210301 [1,1,0,0,0,0|1,0,0]=3 6123 B12R1.1 CNCCOc1ccc(cc1)C 2230a_106832991635_100000183172 [1,1,0,0,0,0|1,0,0]=3 6124 B12R1.1 CNCCOc1ccc(cc1)C 34a_100020666663_200000210301 [1,1,0,0,0,0|1,0,0]=3 6125 B12R1.1 CNCCOc1ccc(cc1)C 34a_100102657272_100000183172 [1,1,0,0,0,0|1,0,0]=3 6126 B12R1.1 CNCCOc1ccc(cc1)C 7a_106832991635_100000183172 [1,1,0,0,0,0|1,0,0]=3 6127 B12R1.1 CNCCOc1ccc(cc1)Cl 2230a_100000697975_200000210301 [1,1,0,0,0,0|1,0,0]=3 6128 B12R1.1 CNCCOc1ccc(cc1)Cl 2230a_106832991635_100000184122 [1,1,0,0,0,0|1,0,0]=3 6129 B12R1.1 CNCCOc1ccc(cc1)Cl 34a_100000697975_200000210301 [1,1,0,0,0,0|1,0,0]=3 6130 B12R1.1 CNCCOc1ccc(cc1)Cl 34a_100102657272_100000184122 [1,1,0,0,0,0|1,0,0]=3 6131 B12R1.1 CNCCOc1ccc(cc1)Cl 7a_106832991635_100000184122 [1,1,0,0,0,0|1,0,0]=3 6132 B12R1.1 CNCCOc1ccc(cc1)F 2230a_100000737420_200000210301 [1,1,0,0,0,0|1,0,0]=3 6133 B12R1.1 CNCCOc1ccc(cc1)F 2230a_106832991635_100000184936 [1,1,0,0,0,0|1,0,0]=3 6134 B12R1.1 CNCCOc1ccc(cc1)F 34a_100000737420_200000210301 [1,1,0,0,0,0|1,0,0]=3 6135 B12R1.1 CNCCOc1ccc(cc1)F 34a_100102657272_100000184936 [1,1,0,0,0,0|1,0,0]=3 6136 B12R1.1 CNCCOc1ccc(cc1)F 7a_106832991635_100000184936 [1,1,0,0,0,0|1,0,0]=3 6137 B12R1.1 CNCCSc1ccc(cc1)Br 2230a_100000184645_200000210301 [1,1,0,0,0,0|1,0,0]=3 6138 B12R1.1 CNCCSc1ccc(cc1)C 2230a_100000739754_200000210301 [1,1,0,0,0,0|1,0,0]=3 6139 B12R1.1 CNCCSc1ccc(cc1)Cl 2230a_100000174974_200000210301 [1,1,0,0,0,0|1,0,0]=3 6140 B12R1.1 COCC=Cc1ccc(cc1)O 271570a_100016286323_100000185759 [1,1,0,0,0,0|1,0,1]=4 6141 B12R1.1 COCCCc1ccc(cc1)Br 34a_100011709247_200000210301 [1,1,0,0,0,0|2,0,0]=4 6142 B12R1.1 COCCCc1ccc(cc1)Br 34a_100138415774_100011713682 [1,1,0,0,0,0|2,0,0]=4 6143 B12R1.1 COCCCc1ccc(cc1)Br 7a_100011709247_200000210301 [1,1,0,0,0,0|2,0,0]=4 6144 B12R1.1 COCCCc1ccc(cc1)C 34a_100000189427_200000210301 [1,1,0,0,0,0|2,0,0]=4 6145 B12R1.1 COCCCc1ccc(cc1)C 7a_100000189427_200000210301 [1,1,0,0,0,0|2,0,0]=4 6146 B12R1.1 COCCCc1ccc(cc1)Cl 34a_100011217485_200000210301 [1,1,0,0,0,0|2,0,0]=4 6147 B12R1.1 COCCCc1ccc(cc1)Cl 34a_100138415774_100000759440 [1,1,0,0,0,0|2,0,0]=4 6148 B12R1.1 COCCCc1ccc(cc1)Cl 7a_100011217485_200000210301 [1,1,0,0,0,0|2,0,0]=4 6149 B12R1.1 COCCCc1ccc(cc1)F 34a_100000757351_200000210301 [1,1,0,0,0,0|2,0,0]=4 6150 B12R1.1 COCCCc1ccc(cc1)F 34a_100138415774_200011713563 [1,1,0,0,0,0|2,0,0]=4 6151 B12R1.1 COCCCc1ccc(cc1)F 7a_100000757351_200000210301 [1,1,0,0,0,0|2,0,0]=4 6152 B12R1.1 COCCNc1ccc(cc1)Br 2230a_100000210018_100011201679 [1,1,0,0,0,0|2,0,0]=4 6153 B12R1.1 COCCNc1ccc(cc1)Br 34a_100000210018_100011201679 [1,1,0,0,0,0|2,0,0]=4 6154 B12R1.1 COCCNc1ccc(cc1)C 34a_100000124888_100011201679 [1,1,0,0,0,0|2,0,0]=4 6155 B12R1.1 COCCNc1ccc(cc1)Cl 2230a_100000210052_100011201679 [1,1,0,0,0,0|2,0,0]=4 6156 B12R1.1 COCCNc1ccc(cc1)Cl 34a_100000210052_100011201679 [1,1,0,0,0,0|2,0,0]=4 6157 B12R1.1 COCCNc1ccc(cc1)F 34a_100000185862_100011201679 [1,1,0,0,0,0|2,0,0]=4 6158 B12R1.1 COCCNc1ccc(cc1)I 34a_100000185761_100011201679 [1,1,0,0,0,0|2,0,0]=4 6159 B12R1.1 COCCNc1ccc(cc1)O 34a_100000185829_100011201679 [1,1,0,0,0,0|1,0,0]=3 6160 B12R1.1 COCCOc1ccc(cc1)Br 34a_100000185759_100011201679 [1,1,0,0,0,0|2,0,0]=4 6161 B12R1.1 COCCOc1ccc(cc1)Br 34a_100000686261_200000210301 [1,1,0,0,0,0|2,0,0]=4 6162 B12R1.1 COCCOc1ccc(cc1)Br 34a_100138415774_100000183278 [1,1,0,0,0,0|2,0,0]=4 6163 B12R1.1 COCCOc1ccc(cc1)Br 7a_100000185759_100000233755 [1,1,0,0,0,0|2,0,0]=4 6164 B12R1.1 COCCOc1ccc(cc1)Br 7a_100000686261_200000210301 [1,1,0,0,0,0|2,0,0]=4 6165 B12R1.1 COCCOc1ccc(cc1)C 34a_100000210336_100011201679 [1,1,0,0,0,0|2,0,0]=4 6166 B12R1.1 COCCOc1ccc(cc1)C 34a_100011219107_200000210301 [1,1,0,0,0,0|2,0,0]=4 6167 B12R1.1 COCCOc1ccc(cc1)C 34a_100138415774_100000183172 [1,1,0,0,0,0|2,0,0]=4 6168 B12R1.1 COCCOc1ccc(cc1)C 7a_100000210336_100000233755 [1,1,0,0,0,0|2,0,0]=4 6169 B12R1.1 COCCOc1ccc(cc1)C 7a_100011219107_200000210301 [1,1,0,0,0,0|2,0,0]=4 6170 B12R1.1 COCCOc1ccc(cc1)Cl 34a_100000210216_100011201679 [1,1,0,0,0,0|2,0,0]=4 6171 B12R1.1 COCCOc1ccc(cc1)Cl 34a_100000237962_200000210301 [1,1,0,0,0,0|2,0,0]=4 6172 B12R1.1 COCCOc1ccc(cc1)Cl 34a_100138415774_100000184122 [1,1,0,0,0,0|2,0,0]=4 6173 B12R1.1 COCCOc1ccc(cc1)Cl 7a_100000210216_100000233755 [1,1,0,0,0,0|2,0,0]=4 6174 B12R1.1 COCCOc1ccc(cc1)Cl 7a_100000237962_200000210301 [1,1,0,0,0,0|2,0,0]=4 6175 B12R1.1 COCCOc1ccc(cc1)F 34a_100000210339_100011201679 [1,1,0,0,0,0|2,0,0]=4 6176 B12R1.1 COCCOc1ccc(cc1)F 34a_100138415774_100000184936 [1,1,0,0,0,0|2,0,0]=4 6177 B12R1.1 COCCOc1ccc(cc1)I 34a_100000212066_100011201679 [1,1,0,0,0,0|2,0,0]=4 6178 B12R1.1 COCCOc1ccc(cc1)I 7a_100000212066_100000233755 [1,1,0,0,0,0|2,0,0]=4 6179 B12R1.1 COCCOc1ccc(cc1)N 34a_100000185829_100011201679 [1,1,0,0,0,0|2,0,0]=4 6180 B12R1.1 COCCOc1ccc(cc1)N 34a_100000754363_200000210301 [1,1,0,0,0,0|2,0,0]=4 6181 B12R1.1 COCCOc1ccc(cc1)O 271570a_203496583355_100000234135 [1,1,0,0,0,0|1,0,0]=3 6182 B12R1.1 COCCOc1ccc(cn1)O 271570a_203496583355_100000758753 [1,1,0,0,0,0|2,0,0]=4 6183 B12R1.1 COCCSc1ccc(cc1)Br 62a_100000233755_100000752885 [1,1,0,0,0,0|2,0,0]=4 6184 B12R1.1 COCCSc1ccc(cc1)Br 62a_100000752885_100000233755 [1,1,0,0,0,0|2,0,0]=4 6185 B12R1.1 COCCSc1ccc(cc1)C 34a_200000230582_200000210301 [1,1,0,0,0,0|2,0,0]=4 6186 B12R1.1 COCCSc1ccc(cc1)C 62a_100000186775_100000233755 [1,1,0,0,0,0|2,0,0]=4 6187 B12R1.1 COCCSc1ccc(cc1)C 62a_100000233755_100000186775 [1,1,0,0,0,0|2,0,0]=4 6188 B12R1.1 COCCSc1ccc(cc1)C 7a_200000230582_200000210301 [1,1,0,0,0,0|2,0,0]=4 6189 B12R1.1 COCCSc1ccc(cc1)Cl 34a_100000230527_200000210301 [1,1,0,0,0,0|2,0,0]=4 6190 B12R1.1 COCCSc1ccc(cc1)Cl 62a_100000233755_100000755918 [1,1,0,0,0,0|2,0,0]=4 6191 B12R1.1 COCCSc1ccc(cc1)Cl 62a_100000755918_100000233755 [1,1,0,0,0,0|2,0,0]=4 6192 B12R1.1 COCCSc1ccc(cc1)Cl 7a_100000230527_200000210301 [1,1,0,0,0,0|2,0,0]=4 6193 B12R1.1 COCCSc1ccc(cc1)F 34a_200000230679_200000210301 [1,1,0,0,0,0|2,0,0]=4 6194 B12R1.1 COCCSc1ccc(cc1)F 62a_100000211213_100000233755 [1,1,0,0,0,0|2,0,0]=4 6195 B12R1.1 COCCSc1ccc(cc1)F 62a_100000233755_100000211213 [1,1,0,0,0,0|2,0,0]=4 6196 B12R1.1 COCCSc1ccc(cc1)F 7a_200000230679_200000210301 [1,1,0,0,0,0|2,0,0]=4 6197 B12R1.1 COCCSc1ccc(cc1)N 62a_100000185761_100000233755 [1,1,0,0,0,0|2,0,0]=4 6198 B12R1.1 COCCSc1ccc(cc1)N 62a_100000233755_100000185761 [1,1,0,0,0,0|2,0,0]=4 6199 B12R1.1 COCCSc1ccc(cc1)O 271570a_203496583355_200009813259 [1,1,0,0,0,0|1,0,0]=3 6200 B12R1.1 COCCSc1ccc(cc1)O 62a_100000233755_100000185759 [1,1,0,0,0,0|1,0,0]=3 6201 B12R1.1 COCCSc1ccc(cn1)O 62a_100000233755_100000744096 [1,1,0,0,0,0|2,0,0]=4 6202 B12R1.1 COCCSc1ccc(cn1)O 62a_100000685995_100000233755 [1,1,0,0,0,0|2,0,0]=4 6203 B12R1.1 COCNCc1ccc(cc1)Br 2230a_100000174875_100000766300 [1,1,0,0,0,0|2,0,0]=4 6204 B12R1.1 COCNCc1ccc(cc1)C 2230a_100000174908_100000766300 [1,1,0,0,0,0|2,0,0]=4 6205 B12R1.1 COCNCc1ccc(cc1)Cl 2230a_100000174871_100000766300 [1,1,0,0,0,0|2,0,0]=4 6206 B12R1.1 COCNCc1ccc(cc1)F 2230a_100000174882_100000766300 [1,1,0,0,0,0|2,0,0]=4 6207 B12R1.1 COCNCc1ccc(cc1)I 2230a_100016989417_100000766300 [1,1,0,0,0,0|2,0,0]=4 6208 B12R1.1 COCNCc1ccc(nc1)O 2230a_100000757128_100000766300 [1,1,0,0,0,0|2,0,0]=4 6209 B12R1.1 COCSCc1ccc(cc1)Br 62a_100000189115_100000766300 [1,1,0,0,0,0|2,0,0]=4 6210 B12R1.1 COCSCc1ccc(cc1)Br 62a_100000766300_100000189115 [1,1,0,0,0,0|2,0,0]=4 6211 B12R1.1 COCSCc1ccc(cc1)C 62a_100000210814_100000766300 [1,1,0,0,0,0|2,0,0]=4 6212 B12R1.1 COCSCc1ccc(cc1)C 62a_100000766300_100000210814 [1,1,0,0,0,0|2,0,0]=4 6213 B12R1.1 COCSCc1ccc(cc1)Cl 62a_100000187161_100000766300 [1,1,0,0,0,0|2,0,0]=4 6214 B12R1.1 COCSCc1ccc(cc1)Cl 62a_100000766300_100000187161 [1,1,0,0,0,0|2,0,0]=4 6215 B12R1.1 COCSCc1ccc(cc1)F 62a_100000198546_100000766300 [1,1,0,0,0,0|2,0,0]=4 6216 B12R1.1 COCSCc1ccc(cc1)F 62a_100000766300_100000187164 [1,1,0,0,0,0|2,0,0]=4 6217 B12R1.1 COCSCc1ccc(cc1)I 62a_100000189116_100000766300 [1,1,0,0,0,0|2,0,0]=4 6218 B12R1.1 COCSCc1ccc(cc1)I 62a_100000766300_100000189116 [1,1,0,0,0,0|2,0,0]=4 6219 B12R1.1 CSCCCc1ccc(cc1)Br 62a_100011713682_200000210301 [1,1,0,0,0,0|2,0,0]=4 6220 B12R1.1 CSCCCc1ccc(cc1)Br 62a_200000210301_100011713682 [1,1,0,0,0,0|2,0,0]=4 6221 B12R1.1 CSCCCc1ccc(cc1)Cl 62a_100000759440_200000210301 [1,1,0,0,0,0|2,0,0]=4 6222 B12R1.1 CSCCCc1ccc(cc1)Cl 62a_200000210301_100000759440 [1,1,0,0,0,0|2,0,0]=4 6223 B12R1.1 CSCCCc1ccc(cc1)F 62a_200000210301_200011713563 [1,1,0,0,0,0|2,0,0]=4 6224 B12R1.1 CSCCCc1ccc(cc1)F 62a_200011713563_200000210301 [1,1,0,0,0,0|2,0,0]=4 6225 B12R1.1 CSCCNc1ccc(cc1)Br 2230a_100000210018_100000751147 [1,1,0,0,0,0|2,0,0]=4 6226 B12R1.1 CSCCNc1ccc(cc1)Br 34a_100000210018_100000212216 [1,1,0,0,0,0|2,0,0]=4 6227 B12R1.1 CSCCNc1ccc(cc1)C 34a_100000124888_100000212216 [1,1,0,0,0,0|2,0,0]=4 6228 B12R1.1 CSCCNc1ccc(cc1)Cl 2230a_100000210052_100000751147 [1,1,0,0,0,0|2,0,0]=4 6229 B12R1.1 CSCCNc1ccc(cc1)Cl 34a_100000210052_100000212216 [1,1,0,0,0,0|2,0,0]=4 6230 B12R1.1 CSCCNc1ccc(cc1)F 34a_100000185862_100000212216 [1,1,0,0,0,0|2,0,0]=4 6231 B12R1.1 CSCCNc1ccc(cc1)I 34a_100000185761_100000212216 [1,1,0,0,0,0|2,0,0]=4 6232 B12R1.1 CSCCNc1ccc(cc1)O 34a_100000185829_100000212216 [1,1,0,0,0,0|1,0,0]=3 6233 B12R1.1 CSCCOc1ccc(cc1)Br 34a_100000185759_100000212216 [1,1,0,0,0,0|2,0,0]=4 6234 B12R1.1 CSCCOc1ccc(cc1)Br 62a_100000183278_200000210301 [1,1,0,0,0,0|2,0,0]=4 6235 B12R1.1 CSCCOc1ccc(cc1)Br 62a_200000210301_100000183278 [1,1,0,0,0,0|2,0,0]=4 6236 B12R1.1 CSCCOc1ccc(cc1)Br 7a_100000185759_100000212216 [1,1,0,0,0,0|2,0,0]=4 6237 B12R1.1 CSCCOc1ccc(cc1)C 34a_100000210336_100000212216 [1,1,0,0,0,0|2,0,0]=4 6238 B12R1.1 CSCCOc1ccc(cc1)C 62a_100000183172_200000210301 [1,1,0,0,0,0|2,0,0]=4 6239 B12R1.1 CSCCOc1ccc(cc1)C 62a_200000210301_100000183172 [1,1,0,0,0,0|2,0,0]=4 6240 B12R1.1 CSCCOc1ccc(cc1)C 7a_100000210336_100000212216 [1,1,0,0,0,0|2,0,0]=4 6241 B12R1.1 CSCCOc1ccc(cc1)Cl 34a_100000210216_100000212216 [1,1,0,0,0,0|2,0,0]=4 6242 B12R1.1 CSCCOc1ccc(cc1)Cl 62a_100000184122_200000210301 [1,1,0,0,0,0|2,0,0]=4 6243 B12R1.1 CSCCOc1ccc(cc1)Cl 62a_200000210301_100000184122 [1,1,0,0,0,0|2,0,0]=4 6244 B12R1.1 CSCCOc1ccc(cc1)Cl 7a_100000210216_100000212216 [1,1,0,0,0,0|2,0,0]=4 6245 B12R1.1 CSCCOc1ccc(cc1)F 34a_100000210339_100000212216 [1,1,0,0,0,0|2,0,0]=4 6246 B12R1.1 CSCCOc1ccc(cc1)F 62a_100000184936_200000210301 [1,1,0,0,0,0|2,0,0]=4 6247 B12R1.1 CSCCOc1ccc(cc1)F 62a_200000210301_100000184936 [1,1,0,0,0,0|2,0,0]=4 6248 B12R1.1 CSCCOc1ccc(cc1)I 34a_100000212066_100000212216 [1,1,0,0,0,0|2,0,0]=4 6249 B12R1.1 CSCCOc1ccc(cc1)I 7a_100000212066_100000212216 [1,1,0,0,0,0|2,0,0]=4 6250 B12R1.1 CSCCOc1ccc(cc1)N 34a_100000185829_100000212216 [1,1,0,0,0,0|2,0,0]=4 6251 B12R1.1 CSCCSc1ccc(cc1)Br 62a_100000212216_100000752885 [1,1,0,0,0,0|2,0,0]=4 6252 B12R1.1 CSCCSc1ccc(cc1)Br 62a_100000752885_100000751147 [1,1,0,0,0,0|2,0,0]=4 6253 B12R1.1 CSCCSc1ccc(cc1)C 62a_100000186775_100000751147 [1,1,0,0,0,0|2,0,0]=4 6254 B12R1.1 CSCCSc1ccc(cc1)C 62a_100000212216_100000186775 [1,1,0,0,0,0|2,0,0]=4 6255 B12R1.1 CSCCSc1ccc(cc1)Cl 62a_100000212216_100000755918 [1,1,0,0,0,0|2,0,0]=4 6256 B12R1.1 CSCCSc1ccc(cc1)Cl 62a_100000755918_100000751147 [1,1,0,0,0,0|2,0,0]=4 6257 B12R1.1 CSCCSc1ccc(cc1)F 62a_100000211213_100000751147 [1,1,0,0,0,0|2,0,0]=4 6258 B12R1.1 CSCCSc1ccc(cc1)F 62a_100000212216_100000211213 [1,1,0,0,0,0|2,0,0]=4 6259 B12R1.1 CSCCSc1ccc(cc1)N 62a_100000185761_100000751147 [1,1,0,0,0,0|2,0,0]=4 6260 B12R1.1 CSCCSc1ccc(cc1)N 62a_100000212216_100000185761 [1,1,0,0,0,0|2,0,0]=4 6261 B12R1.1 CSCCSc1ccc(cc1)O 62a_100000212216_100000185759 [1,1,0,0,0,0|1,0,0]=3 6262 B12R1.1 CSCCSc1ccc(cn1)O 62a_100000212216_100000744096 [1,1,0,0,0,0|2,0,0]=4 6263 B12R1.1 CSCCSc1ccc(cn1)O 62a_100000685995_100000751147 [1,1,0,0,0,0|2,0,0]=4 6264 B12R1.1 CSCNCc1ccc(cc1)Br 2230a_100000174875_100011218213 [1,1,0,0,0,0|2,0,0]=4 6265 B12R1.1 CSCNCc1ccc(cc1)Br 34a_100000174875_100011218213 [1,1,0,0,0,0|2,0,0]=4 6266 B12R1.1 CSCNCc1ccc(cc1)C 2230a_100000174908_100011218213 [1,1,0,0,0,0|2,0,0]=4 6267 B12R1.1 CSCNCc1ccc(cc1)C 34a_100000174908_100011218213 [1,1,0,0,0,0|2,0,0]=4 6268 B12R1.1 CSCNCc1ccc(cc1)Cl 2230a_100000174871_100011218213 [1,1,0,0,0,0|2,0,0]=4 6269 B12R1.1 CSCNCc1ccc(cc1)Cl 34a_100000174871_100011218213 [1,1,0,0,0,0|2,0,0]=4 6270 B12R1.1 CSCNCc1ccc(cc1)F 2230a_100000174882_100011218213 [1,1,0,0,0,0|2,0,0]=4 6271 B12R1.1 CSCNCc1ccc(cc1)F 34a_100000174882_100011218213 [1,1,0,0,0,0|2,0,0]=4 6272 B12R1.1 CSCNCc1ccc(cc1)I 2230a_100016989417_100011218213 [1,1,0,0,0,0|2,0,0]=4 6273 B12R1.1 CSCNCc1ccc(cc1)I 34a_100016989417_100011218213 [1,1,0,0,0,0|2,0,0]=4 6274 B12R1.1 CSCNCc1ccc(cc1)O 34a_100000185549_100011218213 [1,1,0,0,0,0|1,0,0]=3 6275 B12R1.1 CSCNCc1ccc(nc1)O 2230a_100000757128_100011218213 [1,1,0,0,0,0|2,0,0]=4 6276 B12R1.1 CSCOCc1ccc(cc1)Br 34a_100000695286_100011218213 [1,1,0,0,0,0|2,0,0]=4 6277 B12R1.1 CSCOCc1ccc(cc1)C 34a_100011215236_100011218213 [1,1,0,0,0,0|2,0,0]=4 6278 B12R1.1 CSCOCc1ccc(cc1)Cl 34a_100000211118_100011218213 [1,1,0,0,0,0|2,0,0]=4 6279 B12R1.1 CSCOCc1ccc(cc1)F 34a_100000210977_100011218213 [1,1,0,0,0,0|2,0,0]=4 6280 B12R1.1 CSCOCc1ccc(cc1)I 34a_100000690907_100011218213 [1,1,0,0,0,0|2,0,0]=4 6281 B12R1.1 CSCOCc1ccc(cc1)N 34a_100011215238_100011218213 [1,1,0,0,0,0|2,0,0]=4 6282 B12R1.1 CSCSCc1ccc(cc1)Br 62a_100000189115_100011218213 [1,1,0,0,0,0|2,0,0]=4 6283 B12R1.1 CSCSCc1ccc(cc1)Br 62a_100011218213_100000189115 [1,1,0,0,0,0|2,0,0]=4 6284 B12R1.1 CSCSCc1ccc(cc1)C 62a_100000210814_100011218213 [1,1,0,0,0,0|2,0,0]=4 6285 B12R1.1 CSCSCc1ccc(cc1)C 62a_100011218213_100000210814 [1,1,0,0,0,0|2,0,0]=4 6286 B12R1.1 CSCSCc1ccc(cc1)Cl 62a_100000187161_100011218213 [1,1,0,0,0,0|2,0,0]=4 6287 B12R1.1 CSCSCc1ccc(cc1)Cl 62a_100011218213_100000187161 [1,1,0,0,0,0|2,0,0]=4 6288 B12R1.1 CSCSCc1ccc(cc1)F 62a_100000198546_100011218213 [1,1,0,0,0,0|2,0,0]=4 6289 B12R1.1 CSCSCc1ccc(cc1)F 62a_100011218213_100000187164 [1,1,0,0,0,0|2,0,0]=4 6290 B12R1.1 CSCSCc1ccc(cc1)I 62a_100000189116_100011218213 [1,1,0,0,0,0|2,0,0]=4 6291 B12R1.1 CSCSCc1ccc(cc1)I 62a_100011218213_100000189116 [1,1,0,0,0,0|2,0,0]=4 6292 B12R1.1 Cc1ccc(cc1)CCCN[13CH3] 2230a_100011236272_200025704644 [1,1,0,0,0,0|1,0,0]=3 6293 B12R1.1 Cc1ccc(cc1)CCCN[13CH3] 34a_100011236272_200025704644 [1,1,0,0,0,0|1,0,0]=3 6294 B12R1.1 Cc1ccc(cc1)CCCO[13CH3] 34a_100000189427_200025704644 [1,1,0,0,0,0|2,0,0]=4 6295 B12R1.1 Cc1ccc(cc1)CCCO[13CH3] 7a_100000189427_200025704644 [1,1,0,0,0,0|2,0,0]=4 6296 B12R1.1 Cc1ccc(cc1)CCNCF 34a_100000705350_100015361967 [1,1,0,0,0,0|1,0,0]=3 6297 B12R1.1 Cc1ccc(cc1)CCOCF 34a_100000756670_100015361967 [1,1,0,0,0,0|2,0,0]=4 6298 B12R1.1 Cc1ccc(cc1)CCOCF 7a_100000756670_100015361967 [1,1,0,0,0,0|2,0,0]=4 6299 B12R1.1 Cc1ccc(cc1)CCSCF 62a_100011713686_100015361967 [1,1,0,0,0,0|2,0,0]=4 6300 B12R1.1 Cc1ccc(cc1)CCSCF 62a_100015361967_100011713686 [1,1,0,0,0,0|2,0,0]=4 6301 B12R1.1 Cc1ccc(cc1)OCCN[13CH3] 2230a_100020666663_200025704644 [1,1,0,0,0,0|1,0,0]=3 6302 B12R1.1 Cc1ccc(cc1)OCCN[13CH3] 34a_100020666663_200025704644 [1,1,0,0,0,0|1,0,0]=3 6303 B12R1.1 Cc1ccc(cc1)OCCO[13CH3] 34a_100011219107_200025704644 [1,1,0,0,0,0|2,0,0]=4 6304 B12R1.1 Cc1ccc(cc1)OCCO[13CH3] 7a_100011219107_200025704644 [1,1,0,0,0,0|2,0,0]=4 6305 B12R1.1 Cc1ccc(cc1)OCCS[13CH3] 62a_100000183172_200025704644 [1,1,0,0,0,0|2,0,0]=4 6306 B12R1.1 Cc1ccc(cc1)OCCS[13CH3] 62a_200025704644_100000183172 [1,1,0,0,0,0|2,0,0]=4 6307 B12R1.1 Cc1ccc(cc1)SCCN[13CH3] 2230a_100000739754_200025704644 [1,1,0,0,0,0|1,0,0]=3 6308 B12R1.1 Cc1ccc(cc1)SCCO[13CH3] 34a_200000230582_200025704644 [1,1,0,0,0,0|2,0,0]=4 6309 B12R1.1 Cc1ccc(cc1)SCCO[13CH3] 7a_200000230582_200025704644 [1,1,0,0,0,0|2,0,0]=4 6310 B12R1.1 FCNCCc1ccc(cc1)Br 34a_100000755846_100015361967 [1,1,0,0,0,0|1,0,0]=3 6311 B12R1.1 FCNCCc1ccc(cc1)Cl 34a_100000185265_100015361967 [1,1,0,0,0,0|1,0,0]=3 6312 B12R1.1 FCNCCc1ccc(cc1)F 34a_100000199005_100015361967 [1,1,0,0,0,0|1,0,0]=3 6313 B12R1.1 FCOCCc1ccc(cc1)Br 34a_100000766406_100015361967 [1,1,0,0,0,0|2,0,0]=4 6314 B12R1.1 FCOCCc1ccc(cc1)Br 7a_100000766406_100015361967 [1,1,0,0,0,0|2,0,0]=4 6315 B12R1.1 FCOCCc1ccc(cc1)Cl 34a_100011219627_100015361967 [1,1,0,0,0,0|2,0,0]=4 6316 B12R1.1 FCOCCc1ccc(cc1)Cl 7a_100011219627_100015361967 [1,1,0,0,0,0|2,0,0]=4 6317 B12R1.1 FCOCCc1ccc(cc1)F 34a_100000754732_100015361967 [1,1,0,0,0,0|2,0,0]=4 6318 B12R1.1 FCOCCc1ccc(cc1)F 7a_100000754732_100015361967 [1,1,0,0,0,0|2,0,0]=4 6319 B12R1.1 FCOCCc1ccc(cc1)I 34a_100012291149_100015361967 [1,1,0,0,0,0|2,0,0]=4 6320 B12R1.1 FCOCCc1ccc(cc1)I 7a_100012291149_100015361967 [1,1,0,0,0,0|2,0,0]=4 6321 B12R1.1 FCSCCc1ccc(cc1)Br 62a_100011740612_100015361967 [1,1,0,0,0,0|2,0,0]=4 6322 B12R1.1 FCSCCc1ccc(cc1)Br 62a_100015361967_100011740612 [1,1,0,0,0,0|2,0,0]=4 6323 B12R1.1 FCSCCc1ccc(cc1)Cl 62a_100011713675_100015361967 [1,1,0,0,0,0|2,0,0]=4 6324 B12R1.1 FCSCCc1ccc(cc1)Cl 62a_100015361967_100011713675 [1,1,0,0,0,0|2,0,0]=4 6325 B12R1.1 FCSCCc1ccc(cc1)F 62a_100011217392_100015361967 [1,1,0,0,0,0|2,0,0]=4 6326 B12R1.1 FCSCCc1ccc(cc1)F 62a_100015361967_100011217392 [1,1,0,0,0,0|2,0,0]=4 6327 B12R1.1 N#CCCOc1ccc(cc1)O 271570a_203496583355_100000172056 [1,1,0,0,0,0|2,0,0]=4 6328 B12R1.1 N#CCCSc1ccc(cc1)O 62a_100011215226_100000185759 [1,1,0,0,0,0|2,0,0]=4 6329 B12R1.1 Nc1ccc(cc1)CCOCF 34a_100011204434_100015361967 [1,1,0,0,0,0|2,0,0]=4 6330 B12R1.1 O=CCNCc1ccc(cc1)O 34a_100000185549_200009817547 [1,1,0,0,0,0|2,0,0]=4 6331 B12R1.1 O=CNCCc1ccc(cc1)O 271570a_203496583355_200012351260 [1,1,0,0,0,0|0,0,1]=3 6332 B12R1.1 OCCCNc1ccc(cc1)O 34a_100000185829_100000230001 [1,1,0,0,0,0|2,0,0]=4 6333 B12R1.1 OCCCOc1ccc(cc1)O 271570a_203496583355_100000756186 [1,1,0,0,0,0|2,0,0]=4 6334 B12R1.1 OCCCSc1ccc(cc1)O 62a_100011215043_100000185759 [1,1,0,0,0,0|2,0,0]=4 6335 B12R1.1 OCCNCc1ccc(cc1)O 271570a_203496583355_100000186819 [1,1,0,0,0,0|2,0,0]=4 6336 B12R1.1 OCCNCc1ccc(cc1)O 34a_100000185549_100000211926 [1,1,0,0,0,0|2,0,0]=4 6337 B12R1.1 Oc1ccc(cc1)CCNCF 34a_100000743037_100015361967 [1,1,0,0,0,0|0,0,0]=2 6338 B12R1.1 Oc1ccc(cc1)CCSCF 62a_100009816426_100015361967 [1,1,0,0,0,0|1,0,0]=3 6339 B12R1.1 Oc1ccc(cc1)CCSCF 62a_100015361967_100009816426 [1,1,0,0,0,0|1,0,0]=3 6340 B12R1.1 Oc1ccc(cc1)CNCCF 34a_100000185549_100011217306 [1,1,0,0,0,0|2,0,0]=4 6341 B12R1.1 Oc1ccc(cc1)NCCCF 34a_100000185829_100011934791 [1,1,0,0,0,0|2,0,0]=4 6342 B12R1.1 Oc1ccc(cc1)SCCCF 62a_100011934791_100000185759 [1,1,0,0,0,0|2,0,0]=4 6343 B12R1.1 [13CH3]NCC#Cc1ccc(cc1)Cl 2230a_100011352944_200025704644 [1,1,0,0,0,0|1,0,1]=4 6344 B12R1.1 [13CH3]NCC#Cc1ccc(cc1)Cl 34a_100011352944_200025704644 [1,1,0,0,0,0|1,0,1]=4 6345 B12R1.1 [13CH3]NCCCc1ccc(cc1)Br 2230a_100011297623_200025704644 [1,1,0,0,0,0|1,0,0]=3 6346 B12R1.1 [13CH3]NCCCc1ccc(cc1)Br 34a_100011297623_200025704644 [1,1,0,0,0,0|1,0,0]=3 6347 B12R1.1 [13CH3]NCCCc1ccc(cc1)Cl 2230a_100000748451_200025704644 [1,1,0,0,0,0|1,0,0]=3 6348 B12R1.1 [13CH3]NCCCc1ccc(cc1)Cl 34a_100000748451_200025704644 [1,1,0,0,0,0|1,0,0]=3 6349 B12R1.1 [13CH3]NCCCc1ccc(cc1)F 2230a_100025745824_200025704644 [1,1,0,0,0,0|1,0,0]=3 6350 B12R1.1 [13CH3]NCCCc1ccc(cc1)F 34a_100025745824_200025704644 [1,1,0,0,0,0|1,0,0]=3 6351 B12R1.1 [13CH3]NCCOc1ccc(cc1)Br 2230a_100000746992_200025704644 [1,1,0,0,0,0|1,0,0]=3 6352 B12R1.1 [13CH3]NCCOc1ccc(cc1)Br 34a_100000746992_200025704644 [1,1,0,0,0,0|1,0,0]=3 6353 B12R1.1 [13CH3]NCCOc1ccc(cc1)Cl 2230a_100000697975_200025704644 [1,1,0,0,0,0|1,0,0]=3 6354 B12R1.1 [13CH3]NCCOc1ccc(cc1)Cl 34a_100000697975_200025704644 [1,1,0,0,0,0|1,0,0]=3 6355 B12R1.1 [13CH3]NCCOc1ccc(cc1)F 2230a_100000737420_200025704644 [1,1,0,0,0,0|1,0,0]=3 6356 B12R1.1 [13CH3]NCCOc1ccc(cc1)F 34a_100000737420_200025704644 [1,1,0,0,0,0|1,0,0]=3 6357 B12R1.1 [13CH3]NCCSc1ccc(cc1)Br 2230a_100000184645_200025704644 [1,1,0,0,0,0|1,0,0]=3 6358 B12R1.1 [13CH3]NCCSc1ccc(cc1)Cl 2230a_100000174974_200025704644 [1,1,0,0,0,0|1,0,0]=3 6359 B12R1.1 [13CH3]OCCCc1ccc(cc1)Br 34a_100011709247_200025704644 [1,1,0,0,0,0|2,0,0]=4 6360 B12R1.1 [13CH3]OCCCc1ccc(cc1)Br 7a_100011709247_200025704644 [1,1,0,0,0,0|2,0,0]=4 6361 B12R1.1 [13CH3]OCCCc1ccc(cc1)Cl 34a_100011217485_200025704644 [1,1,0,0,0,0|2,0,0]=4 6362 B12R1.1 [13CH3]OCCCc1ccc(cc1)Cl 7a_100011217485_200025704644 [1,1,0,0,0,0|2,0,0]=4 6363 B12R1.1 [13CH3]OCCCc1ccc(cc1)F 34a_100000757351_200025704644 [1,1,0,0,0,0|2,0,0]=4 6364 B12R1.1 [13CH3]OCCCc1ccc(cc1)F 7a_100000757351_200025704644 [1,1,0,0,0,0|2,0,0]=4 6365 B12R1.1 [13CH3]OCCOc1ccc(cc1)Br 34a_100000686261_200025704644 [1,1,0,0,0,0|2,0,0]=4 6366 B12R1.1 [13CH3]OCCOc1ccc(cc1)Br 7a_100000686261_200025704644 [1,1,0,0,0,0|2,0,0]=4 6367 B12R1.1 [13CH3]OCCOc1ccc(cc1)Cl 34a_100000237962_200025704644 [1,1,0,0,0,0|2,0,0]=4 6368 B12R1.1 [13CH3]OCCOc1ccc(cc1)Cl 7a_100000237962_200025704644 [1,1,0,0,0,0|2,0,0]=4 6369 B12R1.1 [13CH3]OCCOc1ccc(cc1)N 34a_100000754363_200025704644 [1,1,0,0,0,0|2,0,0]=4 6370 B12R1.1 [13CH3]OCCSc1ccc(cc1)Cl 34a_100000230527_200025704644 [1,1,0,0,0,0|2,0,0]=4 6371 B12R1.1 [13CH3]OCCSc1ccc(cc1)Cl 7a_100000230527_200025704644 [1,1,0,0,0,0|2,0,0]=4 6372 B12R1.1 [13CH3]OCCSc1ccc(cc1)F 34a_200000230679_200025704644 [1,1,0,0,0,0|2,0,0]=4 6373 B12R1.1 [13CH3]OCCSc1ccc(cc1)F 7a_200000230679_200025704644 [1,1,0,0,0,0|2,0,0]=4 6374 B12R1.1 [13CH3]SCCCc1ccc(cc1)Br 62a_100011713682_200025704644 [1,1,0,0,0,0|2,0,0]=4 6375 B12R1.1 [13CH3]SCCCc1ccc(cc1)Br 62a_200025704644_100011713682 [1,1,0,0,0,0|2,0,0]=4 6376 B12R1.1 [13CH3]SCCCc1ccc(cc1)Cl 62a_100000759440_200025704644 [1,1,0,0,0,0|2,0,0]=4 6377 B12R1.1 [13CH3]SCCCc1ccc(cc1)Cl 62a_200025704644_100000759440 [1,1,0,0,0,0|2,0,0]=4 6378 B12R1.1 [13CH3]SCCCc1ccc(cc1)F 62a_200011713563_200025704644 [1,1,0,0,0,0|2,0,0]=4 6379 B12R1.1 [13CH3]SCCCc1ccc(cc1)F 62a_200025704644_200011713563 [1,1,0,0,0,0|2,0,0]=4 6380 B12R1.1 [13CH3]SCCOc1ccc(cc1)Br 62a_100000183278_200025704644 [1,1,0,0,0,0|2,0,0]=4 6381 B12R1.1 [13CH3]SCCOc1ccc(cc1)Br 62a_200025704644_100000183278 [1,1,0,0,0,0|2,0,0]=4 6382 B12R1.1 [13CH3]SCCOc1ccc(cc1)Cl 62a_100000184122_200025704644 [1,1,0,0,0,0|2,0,0]=4 6383 B12R1.1 [13CH3]SCCOc1ccc(cc1)Cl 62a_200025704644_100000184122 [1,1,0,0,0,0|2,0,0]=4 6384 B12R1.1 [13CH3]SCCOc1ccc(cc1)F 62a_100000184936_200025704644 [1,1,0,0,0,0|2,0,0]=4 6385 B12R1.1 [13CH3]SCCOc1ccc(cc1)F 62a_200025704644_100000184936 [1,1,0,0,0,0|2,0,0]=4 6386 B12R1.16 C=CCC(O)c1ccc(cc1)O 271570a_203496583355_100011466436 [1,1,0,0,0,0|1,0,1]=4 6387 B12R1.16 CC(CN[13CH3])c1ccc(cc1)O 34a_200015188644_200025704644 [1,1,0,0,0,0|0,0,0]=2 6388 B12R1.16 CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210303 [1,1,0,0,0,0|1,0,1]=4 6389 B12R1.16 CCCC(=O)c1ccc(cc1)O 271570a_203496583355_100011267722 [1,1,0,0,0,0|1,0,1]=4 6390 B12R1.16 CCCC(O)c1ccc(cc1)O 271570a_203496583355_100011350873 [1,1,0,0,0,0|1,0,0]=3 6391 B12R1.16 CCCN(C)c1ccc(cc1)O 269982a_100000182112_100000210303 [1,1,0,0,0,0|2,0,0]=4 6392 B12R1.16 CCCN(C)c1ccc(cc1)O 34a_100000182112_100000210303 [1,1,0,0,0,0|2,0,0]=4 6393 B12R1.16 CCN[C@@H](C)c1ccc(cc1)O 2230a_100161106496_100000210202 [1,1,0,0,0,0|2,0,0]=4 6394 B12R1.16 CNCC(=O)c1ccc(cc1)Br 34a_100102657272_100000188085 [1,1,0,0,0,0|1,0,1]=4 6395 B12R1.16 CNCC(=O)c1ccc(cc1)Br 7a_106832991635_100000188085 [1,1,0,0,0,0|1,0,1]=4 6396 B12R1.16 CNCC(=O)c1ccc(cc1)C 2230a_106832991635_100000211441 [1,1,0,0,0,0|1,0,1]=4 6397 B12R1.16 CNCC(=O)c1ccc(cc1)C 34a_100102657272_100000211441 [1,1,0,0,0,0|1,0,1]=4 6398 B12R1.16 CNCC(=O)c1ccc(cc1)C 7a_106832991635_100000211441 [1,1,0,0,0,0|1,0,1]=4 6399 B12R1.16 CNCC(=O)c1ccc(cc1)Cl 7a_106832991635_100000211071 [1,1,0,0,0,0|1,0,1]=4 6400 B12R1.16 CNCC(=O)c1ccc(cc1)F 7a_106832991635_100000211279 [1,1,0,0,0,0|1,0,1]=4 6401 B12R1.16 CNCC(=O)c1ccc(cc1)I 34a_100102657272_100011216261 [1,1,0,0,0,0|1,0,1]=4 6402 B12R1.16 CNCC(=O)c1ccc(cc1)I 7a_106832991635_100011216261 [1,1,0,0,0,0|1,0,1]=4 6403 B12R1.16 CNCC(=O)c1ccc(cc1)O 34a_100102657272_100009814261 [1,1,0,0,0,0|0,0,1]=3 6404 B12R1.16 CNCC(=O)c1ccc(cc1)O 7a_106832991635_100000018856 [1,1,0,0,0,0|0,0,1]=3 6405 B12R1.16 CNCC(C)c1ccc(cc1)O 34a_200015188644_200000210301 [1,1,0,0,0,0|0,0,0]=2 6406 B12R1.16 CNCC(O)c1ccc(cc1)Br 2230a_100020626992_200000210301 [1,1,0,0,0,0|1,0,0]=3 6407 B12R1.16 CNCC(O)c1ccc(cc1)Br 34a_100020626992_200000210301 [1,1,0,0,0,0|1,0,0]=3 6408 B12R1.16 CNCC(O)c1ccc(cc1)C 2230a_200020610344_200000210301 [1,1,0,0,0,0|1,0,0]=3 6409 B12R1.16 CNCC(O)c1ccc(cc1)C 34a_200020610344_200000210301 [1,1,0,0,0,0|1,0,0]=3 6410 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_200000210301 [1,1,0,0,0,0|1,0,0]=3 6411 B12R1.16 CNCC(O)c1ccc(cc1)Cl 2230a_106832991635_200011996143 [1,1,0,0,0,0|1,0,0]=3 6412 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100000736658_200000210301 [1,1,0,0,0,0|1,0,0]=3 6413 B12R1.16 CNCC(O)c1ccc(cc1)Cl 34a_100102657272_200011996143 [1,1,0,0,0,0|1,0,0]=3 6414 B12R1.16 CNCC(O)c1ccc(cc1)Cl 7a_106832991635_200011996143 [1,1,0,0,0,0|1,0,0]=3 6415 B12R1.16 CNCC(O)c1ccc(cc1)O 34a_100000067596_200000210301 [1,1,0,0,0,0|0,0,0]=2 6416 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 2230a_106832991635_100000720402 [1,1,0,0,0,0|1,0,0]=3 6417 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 34a_100102657272_100000720402 [1,1,0,0,0,0|1,0,0]=3 6418 B12R1.16 CNC[C@H](O)c1ccc(cc1)F 7a_106832991635_100000720402 [1,1,0,0,0,0|1,0,0]=3 6419 B12R1.16 CNNC(=O)c1ccc(cc1)O 22a_100016993582_100000212099 [1,1,0,0,0,0|1,0,1]=4 6420 B12R1.16 COCC(=O)c1ccc(cc1)O 271570a_203496583355_200011343064 [1,1,0,0,0,0|1,0,1]=4 6421 B12R1.16 COCC(=O)c1ccc(cc1)O 34a_100138415774_100009814261 [1,1,0,0,0,0|1,0,1]=4 6422 B12R1.16 COCC(N)c1ccc(cc1)Br 34a_100000734186_200000210301 [1,1,0,0,0,0|2,0,0]=4 6423 B12R1.16 COCC(N)c1ccc(cc1)F 34a_100000705410_200000210301 [1,1,0,0,0,0|2,0,0]=4 6424 B12R1.16 COCC(O)c1ccc(cc1)Cl 34a_100138415774_200011996143 [1,1,0,0,0,0|2,0,0]=4 6425 B12R1.16 COCN(C)c1ccc(cc1)O 269982a_100000182112_100000766300 [1,1,0,0,0,0|2,0,0]=4 6426 B12R1.16 COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200000210301 [1,1,0,0,0,0|2,0,0]=4 6427 B12R1.16 COC[C@H](N)c1ccc(cc1)C 34a_100009818840_200000210301 [1,1,0,0,0,0|2,0,0]=4 6428 B12R1.16 COC[C@H](O)c1ccc(cc1)F 34a_100138415774_100000720402 [1,1,0,0,0,0|2,0,0]=4 6429 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_100009814261_200000210301 [1,1,0,0,0,0|1,0,1]=4 6430 B12R1.16 CSCC(=O)c1ccc(cc1)O 62a_200000210301_100009814261 [1,1,0,0,0,0|1,0,1]=4 6431 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200000210301_200011996143 [1,1,0,0,0,0|2,0,0]=4 6432 B12R1.16 CSCC(O)c1ccc(cc1)Cl 62a_200011996143_200000210301 [1,1,0,0,0,0|2,0,0]=4 6433 B12R1.16 CSCN(C)c1ccc(cc1)O 269982a_100000182112_100011218213 [1,1,0,0,0,0|2,0,0]=4 6434 B12R1.16 CSCN(C)c1ccc(cc1)O 34a_100000182112_100011218213 [1,1,0,0,0,0|2,0,0]=4 6435 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_100000720402_200000210301 [1,1,0,0,0,0|2,0,0]=4 6436 B12R1.16 CSC[C@H](O)c1ccc(cc1)F 62a_200000210301_100000720402 [1,1,0,0,0,0|2,0,0]=4 6437 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 2230a_200020610344_200025704644 [1,1,0,0,0,0|1,0,0]=3 6438 B12R1.16 Cc1ccc(cc1)C(O)CN[13CH3] 34a_200020610344_200025704644 [1,1,0,0,0,0|1,0,0]=3 6439 B12R1.16 Cc1ccc(cc1)[C@@H](N)CO[13CH3] 34a_100009818840_200025704644 [1,1,0,0,0,0|2,0,0]=4 6440 B12R1.16 N[C@@H](CCO)c1ccc(cc1)O 271570a_203496583355_102125605589 [1,1,0,0,0,0|2,0,0]=4 6441 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 2230a_100020626992_200025704644 [1,1,0,0,0,0|1,0,0]=3 6442 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Br 34a_100020626992_200025704644 [1,1,0,0,0,0|1,0,0]=3 6443 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 2230a_100000736658_200025704644 [1,1,0,0,0,0|1,0,0]=3 6444 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)Cl 34a_100000736658_200025704644 [1,1,0,0,0,0|1,0,0]=3 6445 B12R1.16 [13CH3]NCC(O)c1ccc(cc1)O 34a_100000067596_200025704644 [1,1,0,0,0,0|0,0,0]=2 6446 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)Br 34a_100000734186_200025704644 [1,1,0,0,0,0|2,0,0]=4 6447 B12R1.16 [13CH3]OCC(N)c1ccc(cc1)F 34a_100000705410_200025704644 [1,1,0,0,0,0|2,0,0]=4 6448 B12R1.16 [13CH3]OC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_200025704644 [1,1,0,0,0,0|2,0,0]=4 6449 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_100009814261_200025704644 [1,1,0,0,0,0|1,0,1]=4 6450 B12R1.16 [13CH3]SCC(=O)c1ccc(cc1)O 62a_200025704644_100009814261 [1,1,0,0,0,0|1,0,1]=4 6451 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200011996143_200025704644 [1,1,0,0,0,0|2,0,0]=4 6452 B12R1.16 [13CH3]SCC(O)c1ccc(cc1)Cl 62a_200025704644_200011996143 [1,1,0,0,0,0|2,0,0]=4 6453 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_100000720402_200025704644 [1,1,0,0,0,0|2,0,0]=4 6454 B12R1.16 [13CH3]SC[C@H](O)c1ccc(cc1)F 62a_200025704644_100000720402 [1,1,0,0,0,0|2,0,0]=4 6455 B12R1.21 C=C(C)CNc1ccc(cc1)O 34a_100000185829_100000748629 [1,1,0,0,0,0|2,0,0]=4 6456 B12R1.21 C=C(C)CSc1ccc(cc1)O 62a_100000748629_100000185759 [1,1,0,0,0,0|2,0,0]=4 6457 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000070787_100011740612 [1,1,0,0,0,0|2,0,0]=4 6458 B12R1.21 CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_200000210301 [1,1,0,0,0,0|2,0,0]=4 6459 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000070787_100011713686 [1,1,0,0,0,0|2,0,0]=4 6460 B12R1.21 CC(=O)CCc1ccc(cc1)C 1458a_100000234883_200000210301 [1,1,0,0,0,0|2,0,0]=4 6461 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000070787_100011713675 [1,1,0,0,0,0|2,0,0]=4 6462 B12R1.21 CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200000210301 [1,1,0,0,0,0|2,0,0]=4 6463 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000070787_100011217392 [1,1,0,0,0,0|2,0,0]=4 6464 B12R1.21 CC(=O)CCc1ccc(cc1)F 1458a_100000198493_200000210301 [1,1,0,0,0,0|2,0,0]=4 6465 B12R1.21 CC(=O)CCc1ccc(cc1)I 1458a_100011217499_200000210301 [1,1,0,0,0,0|2,0,0]=4 6466 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000070787_100009816426 [1,1,0,0,0,0|1,0,0]=3 6467 B12R1.21 CC(=O)CCc1ccc(cc1)O 1458a_100000742835_200000210301 [1,1,0,0,0,0|1,0,0]=3 6468 B12R1.21 CC(=O)CCc1ccc(cc1)O 271570a_203496583355_100000723691 [1,1,0,0,0,0|1,0,0]=3 6469 B12R1.21 CC(=O)COc1ccc(cc1)O 1458a_100000031633_200000210301 [1,1,0,0,0,0|2,0,0]=4 6470 B12R1.21 CC(=O)NCc1ccc(cc1)O 240690a_100000185549_100015343762 [1,1,0,0,0,0|2,0,0]=4 6471 B12R1.21 CC(=O)NCc1ccc(cc1)O 271570a_203496583355_200000685173 [1,1,0,0,0,0|2,0,0]=4 6472 B12R1.21 CC(=O)NCc1ccc(cc1)O 527a_100000185549_100103153847 [1,1,0,0,0,0|2,0,0]=4 6473 B12R1.21 CC(C)CNc1ccc(cc1)O 271570a_203496583355_200011231703 [1,1,0,0,0,0|2,0,0]=4 6474 B12R1.21 CC(C)CNc1ccc(cc1)O 34a_100000185829_100000210624 [1,1,0,0,0,0|2,0,0]=4 6475 B12R1.21 CC(C)COc1ccc(cc1)O 271570a_203496583355_200000169949 [1,1,0,0,0,0|2,0,0]=4 6476 B12R1.21 CC(C)CSc1ccc(cc1)O 62a_100000210624_100000185759 [1,1,0,0,0,0|2,0,0]=4 6477 B12R1.21 CC(C)NCc1ccc(cc1)O 271570a_203496583355_100000195760 [1,1,0,0,0,0|2,0,0]=4 6478 B12R1.21 CC(C)NCc1ccc(cc1)O 34a_100000185549_100000210206 [1,1,0,0,0,0|2,0,0]=4 6479 B12R1.21 CC(C)OCc1ccc(cc1)O 271570a_203496583355_100000758563 [1,1,0,0,0,0|2,0,0]=4 6480 B12R1.21 CC(C)SCc1ccc(cc1)O 271570a_203496583355_100000173087 [1,1,0,0,0,0|2,0,0]=4 6481 B12R1.21 CC(O)CNc1ccc(cc1)O 34a_100000185829_100011218427 [1,1,0,0,0,0|2,0,0]=4 6482 B12R1.21 CC(O)CSc1ccc(cc1)O 62a_100011218427_100000185759 [1,1,0,0,0,0|2,0,0]=4 6483 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100000752880_200000210301 [1,1,0,0,0,0|1,0,0]=3 6484 B12R1.21 CN(C)CCc1ccc(cc1)Br 2230a_100102631434_100011740612 [1,1,0,0,0,0|1,0,0]=3 6485 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100000752880_200000210301 [1,1,0,0,0,0|1,0,0]=3 6486 B12R1.21 CN(C)CCc1ccc(cc1)Br 269982a_100102631434_100011740612 [1,1,0,0,0,0|1,0,0]=3 6487 B12R1.21 CN(C)CCc1ccc(cc1)Br 34a_100000752880_200000210301 [1,1,0,0,0,0|1,0,0]=3 6488 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100000698262_200000210301 [1,1,0,0,0,0|1,0,0]=3 6489 B12R1.21 CN(C)CCc1ccc(cc1)Cl 2230a_100102631434_100011713675 [1,1,0,0,0,0|1,0,0]=3 6490 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100000698262_200000210301 [1,1,0,0,0,0|1,0,0]=3 6491 B12R1.21 CN(C)CCc1ccc(cc1)Cl 269982a_100102631434_100011713675 [1,1,0,0,0,0|1,0,0]=3 6492 B12R1.21 CN(C)CCc1ccc(cc1)Cl 34a_100000698262_200000210301 [1,1,0,0,0,0|1,0,0]=3 6493 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102631434_100011217392 [1,1,0,0,0,0|1,0,0]=3 6494 B12R1.21 CN(C)CCc1ccc(cc1)F 2230a_100102946585_200000210301 [1,1,0,0,0,0|1,0,0]=3 6495 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102631434_100011217392 [1,1,0,0,0,0|1,0,0]=3 6496 B12R1.21 CN(C)CCc1ccc(cc1)F 269982a_100102946585_200000210301 [1,1,0,0,0,0|1,0,0]=3 6497 B12R1.21 CN(C)CCc1ccc(cc1)F 34a_100102946585_200000210301 [1,1,0,0,0,0|1,0,0]=3 6498 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100016989440_200000210301 [1,1,0,0,0,0|0,0,0]=2 6499 B12R1.21 CN(C)CCc1ccc(cc1)O 2230a_100102631434_100009816426 [1,1,0,0,0,0|0,0,0]=2 6500 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100016989440_200000210301 [1,1,0,0,0,0|0,0,0]=2 6501 B12R1.21 CN(C)CCc1ccc(cc1)O 269982a_100102631434_100009816426 [1,1,0,0,0,0|0,0,0]=2 6502 B12R1.21 CN(C)CCc1ccc(cc1)O 34a_100016989440_200000210301 [1,1,0,0,0,0|0,0,0]=2 6503 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 2230a_100000752880_200025704644 [1,1,0,0,0,0|1,0,0]=3 6504 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 269982a_100000752880_200025704644 [1,1,0,0,0,0|1,0,0]=3 6505 B12R1.21 CN([13CH3])CCc1ccc(cc1)Br 34a_100000752880_200025704644 [1,1,0,0,0,0|1,0,0]=3 6506 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 2230a_100000698262_200025704644 [1,1,0,0,0,0|1,0,0]=3 6507 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 269982a_100000698262_200025704644 [1,1,0,0,0,0|1,0,0]=3 6508 B12R1.21 CN([13CH3])CCc1ccc(cc1)Cl 34a_100000698262_200025704644 [1,1,0,0,0,0|1,0,0]=3 6509 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 2230a_100102946585_200025704644 [1,1,0,0,0,0|1,0,0]=3 6510 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 269982a_100102946585_200025704644 [1,1,0,0,0,0|1,0,0]=3 6511 B12R1.21 CN([13CH3])CCc1ccc(cc1)F 34a_100102946585_200025704644 [1,1,0,0,0,0|1,0,0]=3 6512 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 2230a_100016989440_200025704644 [1,1,0,0,0,0|0,0,0]=2 6513 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 269982a_100016989440_200025704644 [1,1,0,0,0,0|0,0,0]=2 6514 B12R1.21 CN([13CH3])CCc1ccc(cc1)O 34a_100016989440_200025704644 [1,1,0,0,0,0|0,0,0]=2 6515 B12R1.21 C[C@@H](O)CNc1ccc(cc1)O 34a_100000185829_100009817552 [1,1,0,0,0,0|2,0,0]=4 6516 B12R1.21 C[C@@H](O)CSc1ccc(cc1)O 62a_100009817552_100000185759 [1,1,0,0,0,0|2,0,0]=4 6517 B12R1.21 Cc1ccc(cc1)CCC(=O)[13CH3] 1458a_100000234883_200025704644 [1,1,0,0,0,0|2,0,0]=4 6518 B12R1.21 Cc1ccc(cc1)CCN(C)C 2230a_100102631434_100011713686 [1,1,0,0,0,0|1,0,0]=3 6519 B12R1.21 Cc1ccc(cc1)CCN(C)C 269982a_100102631434_100011713686 [1,1,0,0,0,0|1,0,0]=3 6520 B12R1.21 NC(=O)CCc1ccc(cc1)O 271570a_203496583355_200010110666 [1,1,0,0,0,0|2,0,0]=4 6521 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Br 1458a_100000217147_200025704644 [1,1,0,0,0,0|2,0,0]=4 6522 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)Cl 1458a_100000235379_200025704644 [1,1,0,0,0,0|2,0,0]=4 6523 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)F 1458a_100000198493_200025704644 [1,1,0,0,0,0|2,0,0]=4 6524 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)I 1458a_100011217499_200025704644 [1,1,0,0,0,0|2,0,0]=4 6525 B12R1.21 [13CH3]C(=O)CCc1ccc(cc1)O 1458a_100000742835_200025704644 [1,1,0,0,0,0|1,0,0]=3 6526 B12R1.21 [13CH3]C(=O)COc1ccc(cc1)O 1458a_100000031633_200025704644 [1,1,0,0,0,0|2,0,0]=4 6527 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 34a_100011351027_200025704644 [1,1,0,0,0,0|2,0,0]=4 6528 B12R1.49 CC(Cc1ccc(cc1)F)O[13CH3] 7a_100011351027_200025704644 [1,1,0,0,0,0|2,0,0]=4 6529 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 2230a_100102634573_200025704644 [1,1,0,0,0,0|0,0,0]=2 6530 B12R1.49 CC(Cc1ccc(cc1)O)N[13CH3] 34a_100102634573_200025704644 [1,1,0,0,0,0|0,0,0]=2 6531 B12R1.49 CCC(=O)Cc1ccc(cc1)O 1458a_100000198540_100000210202 [1,1,0,0,0,0|1,0,1]=4 6532 B12R1.49 CCC(C)Nc1ccc(cc1)O 34a_100000185829_100011215416 [1,1,0,0,0,0|2,0,0]=4 6533 B12R1.49 CCC(C)Sc1ccc(cc1)O 62a_100000758301_100000185759 [1,1,0,0,0,0|2,0,0]=4 6534 B12R1.49 CCN(C)Cc1ccc(cc1)O 2230a_100000207500_100000210202 [1,1,0,0,0,0|2,0,0]=4 6535 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000204670 [1,1,0,0,0,0|2,0,0]=4 6536 B12R1.49 CCN(C)Cc1ccc(cc1)O 269982a_100000748449_200000210301 [1,1,0,0,0,0|2,0,0]=4 6537 B12R1.49 CCN([13CH3])Cc1ccc(cc1)O 269982a_100000748449_200025704644 [1,1,0,0,0,0|2,0,0]=4 6538 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 11a_106832991635_100000198978 [1,1,0,0,0,0|1,0,1]=4 6539 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 240690a_100102657272_100000198978 [1,1,0,0,0,0|1,0,1]=4 6540 B12R1.49 CNC(=O)Cc1ccc(cc1)Br 527a_100102657272_100000198978 [1,1,0,0,0,0|1,0,1]=4 6541 B12R1.49 CNC(=O)Cc1ccc(cc1)C 11a_106832991635_100000212244 [1,1,0,0,0,0|1,0,1]=4 6542 B12R1.49 CNC(=O)Cc1ccc(cc1)C 240690a_100102657272_100000212244 [1,1,0,0,0,0|1,0,1]=4 6543 B12R1.49 CNC(=O)Cc1ccc(cc1)C 527a_100102657272_100000212244 [1,1,0,0,0,0|1,0,1]=4 6544 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 11a_106832991635_100000211027 [1,1,0,0,0,0|1,0,1]=4 6545 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 240690a_100102657272_100000211027 [1,1,0,0,0,0|1,0,1]=4 6546 B12R1.49 CNC(=O)Cc1ccc(cc1)Cl 527a_100102657272_100000211027 [1,1,0,0,0,0|1,0,1]=4 6547 B12R1.49 CNC(=O)Cc1ccc(cc1)F 11a_106832991635_100000210951 [1,1,0,0,0,0|1,0,1]=4 6548 B12R1.49 CNC(=O)Cc1ccc(cc1)F 1626a_100102657272_100000210951 [1,1,0,0,0,0|1,0,1]=4 6549 B12R1.49 CNC(=O)Cc1ccc(cc1)F 240690a_100102657272_100000210951 [1,1,0,0,0,0|1,0,1]=4 6550 B12R1.49 CNC(=O)Cc1ccc(cc1)F 527a_100102657272_100000210951 [1,1,0,0,0,0|1,0,1]=4 6551 B12R1.49 CNC(=O)Cc1ccc(cc1)I 11a_106832991635_100000688869 [1,1,0,0,0,0|1,0,1]=4 6552 B12R1.49 CNC(=O)Cc1ccc(cc1)I 1626a_100102657272_100000688869 [1,1,0,0,0,0|1,0,1]=4 6553 B12R1.49 CNC(=O)Cc1ccc(cc1)I 240690a_100102657272_100000688869 [1,1,0,0,0,0|1,0,1]=4 6554 B12R1.49 CNC(=O)Cc1ccc(cc1)I 527a_100102657272_100000688869 [1,1,0,0,0,0|1,0,1]=4 6555 B12R1.49 CNC(=O)Cc1ccc(cc1)O 1626a_100102657272_100000198540 [1,1,0,0,0,0|0,0,1]=3 6556 B12R1.49 CNC(=O)Cc1ccc(cc1)O 240690a_100102657272_100000198540 [1,1,0,0,0,0|0,0,1]=3 6557 B12R1.49 CNC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000155101 [1,1,0,0,0,0|0,0,1]=3 6558 B12R1.49 CNC(=O)Cc1ccc(cc1)O 527a_100102657272_100000198540 [1,1,0,0,0,0|0,0,1]=3 6559 B12R1.49 CNC(=O)Nc1ccc(cc1)O 2430a_100000185829_100102657272 [1,1,0,0,0,0|1,0,1]=4 6560 B12R1.49 CNC(C)Cc1ccc(cc1)Br 270004a_106832991635_100000691760 [1,1,0,0,0,0|1,0,0]=3 6561 B12R1.49 CNC(C)Cc1ccc(cc1)C 270004a_106832991635_100000751045 [1,1,0,0,0,0|1,0,0]=3 6562 B12R1.49 CNC(C)Cc1ccc(cc1)Cl 270004a_106832991635_100000747806 [1,1,0,0,0,0|1,0,0]=3 6563 B12R1.49 CNC(C)Cc1ccc(cc1)F 270004a_106832991635_100000745281 [1,1,0,0,0,0|1,0,0]=3 6564 B12R1.49 CNC(C)Cc1ccc(cc1)O 2230a_100102634573_200000210301 [1,1,0,0,0,0|0,0,0]=2 6565 B12R1.49 CNC(C)Cc1ccc(cc1)O 270004a_106832991635_100011218180 [1,1,0,0,0,0|0,0,0]=2 6566 B12R1.49 CNC(C)Cc1ccc(cc1)O 34a_100102634573_200000210301 [1,1,0,0,0,0|0,0,0]=2 6567 B12R1.49 COC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000149743 [1,1,0,0,0,0|1,0,1]=4 6568 B12R1.49 COC(C)Cc1ccc(cc1)F 34a_100011351027_200000210301 [1,1,0,0,0,0|2,0,0]=4 6569 B12R1.49 COC(C)Cc1ccc(cc1)F 7a_100011351027_200000210301 [1,1,0,0,0,0|2,0,0]=4 6570 B12R1.49 COC(C)Sc1ccc(cc1)O 62a_100009879195_100000185759 [1,1,0,0,0,0|2,0,0]=4 6571 B12R1.69 CCCCc1ccc(cc1Br)Br 271570a_100020621405_100011484698 [1,1,0,0,0,0|2,0,0]=4 6572 B12R1.69 CCCCc1ccc(cc1Br)C 271570a_100020621405_100009813563 [1,1,0,0,0,0|2,0,0]=4 6573 B12R1.69 CCCCc1ccc(cc1Br)Cl 271570a_100020621405_100011219703 [1,1,0,0,0,0|2,0,0]=4 6574 B12R1.69 CCCCc1ccc(cc1Br)F 271570a_100020621405_100011217111 [1,1,0,0,0,0|2,0,0]=4 6575 B12R1.69 CCCCc1ccc(cc1Br)N 271570a_100020621405_100000750458 [1,1,0,0,0,0|2,0,0]=4 6576 B12R1.69 CCCCc1ccc(cc1Br)O 271570a_100020621405_100000701344 [1,1,0,0,0,0|1,0,0]=3 6577 B12R1.69 CCCCc1ccc(cc1C)Br 271570a_100020621405_100000701812 [1,1,0,0,0,0|2,0,0]=4 6578 B12R1.69 CCCCc1ccc(cc1C)C 271570a_100020621405_100011217332 [1,1,0,0,0,0|2,0,0]=4 6579 B12R1.69 CCCCc1ccc(cc1C)Cl 271570a_100020621405_100011219607 [1,1,0,0,0,0|2,0,0]=4 6580 B12R1.69 CCCCc1ccc(cc1C)F 271570a_100020621405_100011205405 [1,1,0,0,0,0|2,0,0]=4 6581 B12R1.69 CCCCc1ccc(cc1C)N 271570a_100020621405_100000210723 [1,1,0,0,0,0|2,0,0]=4 6582 B12R1.69 CCCCc1ccc(cc1C)O 271570a_100020621405_100000729255 [1,1,0,0,0,0|1,0,0]=3 6583 B12R1.69 CCCCc1ccc(cc1Cl)Br 271570a_100020621405_100011216062 [1,1,0,0,0,0|2,0,0]=4 6584 B12R1.69 CCCCc1ccc(cc1Cl)C 271570a_100020621405_100011263221 [1,1,0,0,0,0|2,0,0]=4 6585 B12R1.69 CCCCc1ccc(cc1Cl)Cl 271570a_100020621405_100000699841 [1,1,0,0,0,0|2,0,0]=4 6586 B12R1.69 CCCCc1ccc(cc1Cl)F 271570a_100020621405_100000733362 [1,1,0,0,0,0|2,0,0]=4 6587 B12R1.69 CCCCc1ccc(cc1Cl)N 271570a_100020621405_100000761885 [1,1,0,0,0,0|2,0,0]=4 6588 B12R1.69 CCCCc1ccc(cc1Cl)O 271570a_100020621405_100000047559 [1,1,0,0,0,0|1,0,0]=3 6589 B12R1.69 CCCCc1ccc(cc1F)Br 271570a_100020621405_100009814013 [1,1,0,0,0,0|2,0,0]=4 6590 B12R1.69 CCCCc1ccc(cc1F)C 271570a_100020621405_100011216119 [1,1,0,0,0,0|2,0,0]=4 6591 B12R1.69 CCCCc1ccc(cc1F)Cl 271570a_100020621405_100011216042 [1,1,0,0,0,0|2,0,0]=4 6592 B12R1.69 CCCCc1ccc(cc1F)F 271570a_100020621405_100000750030 [1,1,0,0,0,0|2,0,0]=4 6593 B12R1.69 CCCCc1ccc(cc1F)N 271570a_100020621405_100011356925 [1,1,0,0,0,0|2,0,0]=4 6594 B12R1.69 CCCCc1ccc(cc1F)O 271570a_100020621405_100000755031 [1,1,0,0,0,0|1,0,0]=3 6595 B12R1.69 CCCCc1ccc(cc1N)Br 271570a_100020621405_100000743836 [1,1,0,0,0,0|2,0,0]=4 6596 B12R1.69 CCCCc1ccc(cc1N)C 271570a_100020621405_100011216686 [1,1,0,0,0,0|2,0,0]=4 6597 B12R1.69 CCCCc1ccc(cc1N)Cl 271570a_100020621405_100000761886 [1,1,0,0,0,0|2,0,0]=4 6598 B12R1.69 CCCCc1ccc(cc1N)F 271570a_100020621405_100011218093 [1,1,0,0,0,0|2,0,0]=4 6599 B12R1.69 CCCCc1ccc(cc1N)N 271570a_100020621405_200012175722 [1,1,0,0,0,0|2,0,0]=4 6600 B12R1.69 CCCCc1ccc(cc1N)O 271570a_100020621405_100011999798 [1,1,0,0,0,0|1,0,0]=3 6601 B12R1.69 CCCCc1ccc(cc1O)Br 271570a_100020621405_100012344904 [1,1,0,0,0,0|2,0,0]=4 6602 B12R1.69 CCCCc1ccc(cc1O)C 271570a_100020621405_100012002257 [1,1,0,0,0,0|2,0,0]=4 6603 B12R1.69 CCCCc1ccc(cc1O)Cl 271570a_100020621405_100000050036 [1,1,0,0,0,0|2,0,0]=4 6604 B12R1.69 CCCCc1ccc(cc1O)F 271570a_100020621405_100000690578 [1,1,0,0,0,0|2,0,0]=4 6605 B12R1.69 CCCCc1ccc(cc1O)O 271570a_100020621405_100009813921 [1,1,0,0,0,0|1,0,0]=3 6606 B12R1.69 CCCCc1ccc(nc1C)O 271570a_100020621405_100000691680 [1,1,0,0,0,0|2,0,0]=4 6607 B12R1.69 CCCCc1ccc(nc1F)O 271570a_100020621405_100009879308 [1,1,0,0,0,0|2,0,0]=4 6608 B12R1.69 CCCCc1cnc(cc1C)O 271570a_100020621405_100010114363 [1,1,0,0,0,0|2,0,0]=4 6609 B12R1.69 CCCCc1ncc(cc1C)O 271570a_100020621405_100012000486 [1,1,0,0,0,0|2,0,0]=4 6610 B12R1.69 CCCCc1ncc(cc1F)O 271570a_100020621405_100000063512 [1,1,0,0,0,0|2,0,0]=4 6611 B12R1.69 CCCNc1ccc(cc1Br)O 34a_100012001276_100000210303 [1,1,0,0,0,0|2,0,0]=4 6612 B12R1.69 CCCNc1ccc(cc1C)O 34a_100000756630_100000210303 [1,1,0,0,0,0|2,0,0]=4 6613 B12R1.69 CCCNc1ccc(cc1Cl)O 34a_100011215599_100000210303 [1,1,0,0,0,0|2,0,0]=4 6614 B12R1.69 CCCNc1ccc(cc1F)O 34a_100000759473_100000210303 [1,1,0,0,0,0|2,0,0]=4 6615 B12R1.69 CCCNc1ccc(cc1I)O 34a_100010084370_100000210303 [1,1,0,0,0,0|2,0,0]=4 6616 B12R1.69 CCCNc1ccc(cc1O)O 34a_100000106777_100000210303 [1,1,0,0,0,0|2,0,0]=4 6617 B12R1.69 CCCSc1ccc(cc1Br)O 62a_100000210303_100000701344 [1,1,0,0,0,0|2,0,0]=4 6618 B12R1.69 CCCSc1ccc(cc1Br)O 62a_100000701344_100000210303 [1,1,0,0,0,0|2,0,0]=4 6619 B12R1.69 CCCSc1ccc(cc1C)O 62a_100000210303_100000690111 [1,1,0,0,0,0|2,0,0]=4 6620 B12R1.69 CCCSc1ccc(cc1Cl)O 62a_100000047559_100000210303 [1,1,0,0,0,0|2,0,0]=4 6621 B12R1.69 CCCSc1ccc(cc1Cl)O 62a_100000210303_100000047559 [1,1,0,0,0,0|2,0,0]=4 6622 B12R1.69 CCCSc1ccc(cc1F)O 62a_100000210303_100000755031 [1,1,0,0,0,0|2,0,0]=4 6623 B12R1.69 CCCSc1ccc(cc1F)O 62a_100000755031_100000210303 [1,1,0,0,0,0|2,0,0]=4 6624 B12R1.69 CCCSc1ccc(cc1N)O 62a_100000210303_100011999798 [1,1,0,0,0,0|2,0,0]=4 6625 B12R1.69 CCCSc1ccc(cc1N)O 62a_100011999798_100000210303 [1,1,0,0,0,0|2,0,0]=4 6626 B12R1.69 CCCSc1ccc(cc1O)O 62a_100000210303_100009813921 [1,1,0,0,0,0|2,0,0]=4 6627 B12R1.69 CCNCc1ccc(cc1Cl)O 34a_200161156549_100000210202 [1,1,0,0,0,0|2,0,0]=4 6628 B12R1.69 CNCCc1ccc(cc1Br)Cl 2230a_106832991635_200012945151 [1,1,0,0,0,0|1,0,0]=3 6629 B12R1.69 CNCCc1ccc(cc1Br)Cl 34a_100102657272_200012945151 [1,1,0,0,0,0|1,0,0]=3 6630 B12R1.69 CNCCc1ccc(cc1Br)Cl 7a_106832991635_200012945151 [1,1,0,0,0,0|1,0,0]=3 6631 B12R1.69 CNCCc1ccc(cc1C)C 2230a_100000745621_200000210301 [1,1,0,0,0,0|1,0,0]=3 6632 B12R1.69 CNCCc1ccc(cc1C)C 270004a_106832991635_100011754701 [1,1,0,0,0,0|1,0,0]=3 6633 B12R1.69 CNCCc1ccc(cc1C)C 34a_100000745621_200000210301 [1,1,0,0,0,0|1,0,0]=3 6634 B12R1.69 CNCCc1ccc(cc1Cl)Cl 2230a_100000210994_200000210301 [1,1,0,0,0,0|1,0,0]=3 6635 B12R1.69 CNCCc1ccc(cc1Cl)Cl 2230a_106832991635_200012161198 [1,1,0,0,0,0|1,0,0]=3 6636 B12R1.69 CNCCc1ccc(cc1Cl)Cl 34a_100000210994_200000210301 [1,1,0,0,0,0|1,0,0]=3 6637 B12R1.69 CNCCc1ccc(cc1Cl)Cl 34a_100102657272_200012161198 [1,1,0,0,0,0|1,0,0]=3 6638 B12R1.69 CNCCc1ccc(cc1Cl)Cl 7a_106832991635_200012161198 [1,1,0,0,0,0|1,0,0]=3 6639 B12R1.69 CNCCc1ccc(cc1F)Cl 2230a_103496529009_200000210301 [1,1,0,0,0,0|1,0,0]=3 6640 B12R1.69 CNCCc1ccc(cc1F)Cl 34a_103496529009_200000210301 [1,1,0,0,0,0|1,0,0]=3 6641 B12R1.69 CNCCc1ccc(cc1F)F 2230a_100000754870_200000210301 [1,1,0,0,0,0|1,0,0]=3 6642 B12R1.69 CNCCc1ccc(cc1F)F 34a_100000754870_200000210301 [1,1,0,0,0,0|1,0,0]=3 6643 B12R1.69 COCCc1ccc(cc1Br)Cl 34a_100138415774_200012945151 [1,1,0,0,0,0|2,0,0]=4 6644 B12R1.69 COCCc1ccc(cc1Cl)Br 34a_100013445822_200000210301 [1,1,0,0,0,0|2,0,0]=4 6645 B12R1.69 COCCc1ccc(cc1Cl)Br 7a_100013445822_200000210301 [1,1,0,0,0,0|2,0,0]=4 6646 B12R1.69 COCCc1ccc(cc1Cl)Cl 34a_100011215701_200000210301 [1,1,0,0,0,0|2,0,0]=4 6647 B12R1.69 COCCc1ccc(cc1Cl)Cl 34a_100138415774_200012161198 [1,1,0,0,0,0|2,0,0]=4 6648 B12R1.69 COCCc1ccc(cc1Cl)Cl 7a_100011215701_200000210301 [1,1,0,0,0,0|2,0,0]=4 6649 B12R1.69 COCCc1ccc(cc1Cl)F 34a_100011962860_200000210301 [1,1,0,0,0,0|2,0,0]=4 6650 B12R1.69 COCCc1ccc(cc1Cl)F 7a_100011962860_200000210301 [1,1,0,0,0,0|2,0,0]=4 6651 B12R1.69 COCCc1ccc(cc1F)Br 34a_100011962869_200000210301 [1,1,0,0,0,0|2,0,0]=4 6652 B12R1.69 COCCc1ccc(cc1F)Br 7a_100011962869_200000210301 [1,1,0,0,0,0|2,0,0]=4 6653 B12R1.69 COCCc1ccc(cc1F)F 34a_100000697962_200000210301 [1,1,0,0,0,0|2,0,0]=4 6654 B12R1.69 COCCc1ccc(cc1F)F 7a_100000697962_200000210301 [1,1,0,0,0,0|2,0,0]=4 6655 B12R1.69 COCCn1ccc(cc1=O)O 271570a_203496583355_200015743058 [1,1,0,0,0,0|2,0,0]=4 6656 B12R1.69 COCOc1ccc(cc1F)O 271570a_203496583355_100009812708 [1,1,0,0,0,0|2,0,0]=4 6657 B12R1.69 COCSc1ccc(cc1Br)O 62a_100000701344_100000766300 [1,1,0,0,0,0|2,0,0]=4 6658 B12R1.69 COCSc1ccc(cc1Br)O 62a_100000766300_100000701344 [1,1,0,0,0,0|2,0,0]=4 6659 B12R1.69 COCSc1ccc(cc1C)O 62a_100000766300_100000690111 [1,1,0,0,0,0|2,0,0]=4 6660 B12R1.69 COCSc1ccc(cc1Cl)O 62a_100000047559_100000766300 [1,1,0,0,0,0|2,0,0]=4 6661 B12R1.69 COCSc1ccc(cc1Cl)O 62a_100000766300_100000047559 [1,1,0,0,0,0|2,0,0]=4 6662 B12R1.69 COCSc1ccc(cc1F)O 62a_100000755031_100000766300 [1,1,0,0,0,0|2,0,0]=4 6663 B12R1.69 COCSc1ccc(cc1F)O 62a_100000766300_100000755031 [1,1,0,0,0,0|2,0,0]=4 6664 B12R1.69 COCSc1ccc(cc1N)O 62a_100000766300_100011999798 [1,1,0,0,0,0|2,0,0]=4 6665 B12R1.69 COCSc1ccc(cc1N)O 62a_100011999798_100000766300 [1,1,0,0,0,0|2,0,0]=4 6666 B12R1.69 COCSc1ccc(cc1O)O 62a_100000766300_100009813921 [1,1,0,0,0,0|2,0,0]=4 6667 B12R1.69 CSCCc1ccc(cc1Br)Cl 62a_200000210301_200012945151 [1,1,0,0,0,0|2,0,0]=4 6668 B12R1.69 CSCCc1ccc(cc1Br)Cl 62a_200012945151_200000210301 [1,1,0,0,0,0|2,0,0]=4 6669 B12R1.69 CSCCc1ccc(cc1Cl)Cl 62a_200000210301_200012161198 [1,1,0,0,0,0|2,0,0]=4 6670 B12R1.69 CSCCc1ccc(cc1Cl)Cl 62a_200012161198_200000210301 [1,1,0,0,0,0|2,0,0]=4 6671 B12R1.69 CSCNc1ccc(cc1Br)O 34a_100012001276_100011218213 [1,1,0,0,0,0|2,0,0]=4 6672 B12R1.69 CSCNc1ccc(cc1C)O 34a_100000756630_100011218213 [1,1,0,0,0,0|2,0,0]=4 6673 B12R1.69 CSCNc1ccc(cc1Cl)O 34a_100011215599_100011218213 [1,1,0,0,0,0|2,0,0]=4 6674 B12R1.69 CSCNc1ccc(cc1F)O 34a_100000759473_100011218213 [1,1,0,0,0,0|2,0,0]=4 6675 B12R1.69 CSCNc1ccc(cc1I)O 34a_100010084370_100011218213 [1,1,0,0,0,0|2,0,0]=4 6676 B12R1.69 CSCNc1ccc(cc1O)O 34a_100000106777_100011218213 [1,1,0,0,0,0|2,0,0]=4 6677 B12R1.69 CSCSc1ccc(cc1Br)O 62a_100000701344_100011218213 [1,1,0,0,0,0|2,0,0]=4 6678 B12R1.69 CSCSc1ccc(cc1Br)O 62a_100011218213_100000701344 [1,1,0,0,0,0|2,0,0]=4 6679 B12R1.69 CSCSc1ccc(cc1C)O 62a_100011218213_100000690111 [1,1,0,0,0,0|2,0,0]=4 6680 B12R1.69 CSCSc1ccc(cc1Cl)O 62a_100000047559_100011218213 [1,1,0,0,0,0|2,0,0]=4 6681 B12R1.69 CSCSc1ccc(cc1Cl)O 62a_100011218213_100000047559 [1,1,0,0,0,0|2,0,0]=4 6682 B12R1.69 CSCSc1ccc(cc1F)O 62a_100000755031_100011218213 [1,1,0,0,0,0|2,0,0]=4 6683 B12R1.69 CSCSc1ccc(cc1F)O 62a_100011218213_100000755031 [1,1,0,0,0,0|2,0,0]=4 6684 B12R1.69 CSCSc1ccc(cc1N)O 62a_100011218213_100011999798 [1,1,0,0,0,0|2,0,0]=4 6685 B12R1.69 CSCSc1ccc(cc1N)O 62a_100011999798_100011218213 [1,1,0,0,0,0|2,0,0]=4 6686 B12R1.69 CSCSc1ccc(cc1O)O 62a_100011218213_100009813921 [1,1,0,0,0,0|2,0,0]=4 6687 B12R1.69 Cc1ccc(c(c1)C)CCN[13CH3] 2230a_100000745621_200025704644 [1,1,0,0,0,0|1,0,0]=3 6688 B12R1.69 Cc1ccc(c(c1)C)CCN[13CH3] 34a_100000745621_200025704644 [1,1,0,0,0,0|1,0,0]=3 6689 B12R1.69 [13CH3]NCCc1ccc(cc1Cl)Cl 2230a_100000210994_200025704644 [1,1,0,0,0,0|1,0,0]=3 6690 B12R1.69 [13CH3]NCCc1ccc(cc1Cl)Cl 34a_100000210994_200025704644 [1,1,0,0,0,0|1,0,0]=3 6691 B12R1.69 [13CH3]NCCc1ccc(cc1F)Cl 2230a_103496529009_200025704644 [1,1,0,0,0,0|1,0,0]=3 6692 B12R1.69 [13CH3]NCCc1ccc(cc1F)Cl 34a_103496529009_200025704644 [1,1,0,0,0,0|1,0,0]=3 6693 B12R1.69 [13CH3]NCCc1ccc(cc1F)F 2230a_100000754870_200025704644 [1,1,0,0,0,0|1,0,0]=3 6694 B12R1.69 [13CH3]NCCc1ccc(cc1F)F 34a_100000754870_200025704644 [1,1,0,0,0,0|1,0,0]=3 6695 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Br 34a_100013445822_200025704644 [1,1,0,0,0,0|2,0,0]=4 6696 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Br 7a_100013445822_200025704644 [1,1,0,0,0,0|2,0,0]=4 6697 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Cl 34a_100011215701_200025704644 [1,1,0,0,0,0|2,0,0]=4 6698 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)Cl 7a_100011215701_200025704644 [1,1,0,0,0,0|2,0,0]=4 6699 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)F 34a_100011962860_200025704644 [1,1,0,0,0,0|2,0,0]=4 6700 B12R1.69 [13CH3]OCCc1ccc(cc1Cl)F 7a_100011962860_200025704644 [1,1,0,0,0,0|2,0,0]=4 6701 B12R1.69 [13CH3]OCCc1ccc(cc1F)Br 34a_100011962869_200025704644 [1,1,0,0,0,0|2,0,0]=4 6702 B12R1.69 [13CH3]OCCc1ccc(cc1F)Br 7a_100011962869_200025704644 [1,1,0,0,0,0|2,0,0]=4 6703 B12R1.69 [13CH3]OCCc1ccc(cc1F)F 34a_100000697962_200025704644 [1,1,0,0,0,0|2,0,0]=4 6704 B12R1.69 [13CH3]OCCc1ccc(cc1F)F 7a_100000697962_200025704644 [1,1,0,0,0,0|2,0,0]=4 6705 B12R1.69 [13CH3]SCCc1ccc(cc1Br)Cl 62a_200012945151_200025704644 [1,1,0,0,0,0|2,0,0]=4 6706 B12R1.69 [13CH3]SCCc1ccc(cc1Br)Cl 62a_200025704644_200012945151 [1,1,0,0,0,0|2,0,0]=4 6707 B12R1.69 [13CH3]SCCc1ccc(cc1Cl)Cl 62a_200012161198_200025704644 [1,1,0,0,0,0|2,0,0]=4 6708 B12R1.69 [13CH3]SCCc1ccc(cc1Cl)Cl 62a_200025704644_200012161198 [1,1,0,0,0,0|2,0,0]=4 6709 B12R1.71 C=Cc1ccc(cc1)CCCC 271570a_100011290941_100011215597 [1,1,0,0,0,0|2,0,0]=4 6710 B12R1.71 C=Cc1ccc(cc1)CCNC 2230a_106832991635_100000142037 [1,1,0,0,0,0|1,0,0]=3 6711 B12R1.71 C=Cc1ccc(cc1)CCNC 271570a_100011290941_100000752880 [1,1,0,0,0,0|1,0,0]=3 6712 B12R1.71 C=Cc1ccc(cc1)CCNC 34a_100102657272_100000142037 [1,1,0,0,0,0|1,0,0]=3 6713 B12R1.71 C=Cc1ccc(cc1)CCNC 7a_106832991635_100000142037 [1,1,0,0,0,0|1,0,0]=3 6714 B12R1.71 C=Cc1ccc(cc1)CCOC 271570a_100011290941_100000739703 [1,1,0,0,0,0|2,0,0]=4 6715 B12R1.71 C=Cc1ccc(cc1)CCOC 34a_100138415774_100000142037 [1,1,0,0,0,0|2,0,0]=4 6716 B12R1.71 C=Cc1ccc(cc1)CCSC 62a_100000142037_200000210301 [1,1,0,0,0,0|2,0,0]=4 6717 B12R1.71 C=Cc1ccc(cc1)CCSC 62a_200000210301_100000142037 [1,1,0,0,0,0|2,0,0]=4 6718 B12R1.71 C=Cc1ccc(cc1)CCS[13CH3] 62a_100000142037_200025704644 [1,1,0,0,0,0|2,0,0]=4 6719 B12R1.71 C=Cc1ccc(cc1)CCS[13CH3] 62a_200025704644_100000142037 [1,1,0,0,0,0|2,0,0]=4 6720 B12R1.71 CCCCc1ccc(cc1)C#N 271570a_100020621405_100000179745 [1,1,0,0,0,0|2,0,0]=4 6721 B12R1.71 CCCCc1ccc(cc1)C=O 271570a_100020621405_100000186029 [1,1,0,0,0,0|1,0,1]=4 6722 B12R1.71 CCCCc1ccc(cc1)CC 271570a_100020621405_100011215824 [1,1,0,0,0,0|2,0,0]=4 6723 B12R1.71 CCCCc1ccc(cc1)CF 271570a_100020621405_100010268989 [1,1,0,0,0,0|2,0,0]=4 6724 B12R1.71 CCCCc1ccc(cc1)CN 271570a_100020621405_100016989417 [1,1,0,0,0,0|2,0,0]=4 6725 B12R1.71 CCCCc1ccc(cc1)CO 271570a_100020621405_100000690907 [1,1,0,0,0,0|1,0,0]=3 6726 B12R1.71 CCCCc1ccc(cc1)NC 2230a_100000210628_200000210301 [1,1,0,0,0,0|2,0,0]=4 6727 B12R1.71 CCCCc1ccc(cc1)NC 271570a_100020621405_100000219623 [1,1,0,0,0,0|2,0,0]=4 6728 B12R1.71 CCCCc1ccc(cc1)NC 34a_100000210628_200000210301 [1,1,0,0,0,0|2,0,0]=4 6729 B12R1.71 CCCCc1ccc(cc1)NN 271570a_100020621405_100016988836 [1,1,0,0,0,0|2,0,0]=4 6730 B12R1.71 CCCCc1ccc(cc1)N[13CH3] 2230a_100000210628_200025704644 [1,1,0,0,0,0|2,0,0]=4 6731 B12R1.71 CCCCc1ccc(cc1)N[13CH3] 34a_100000210628_200025704644 [1,1,0,0,0,0|2,0,0]=4 6732 B12R1.71 CCCCc1ccc(cc1)OC 271570a_100020621405_100000171711 [1,1,0,0,0,0|1,0,0]=3 6733 B12R1.71 CCCCc1ccc(cc1)OC 34a_100011216022_200000210301 [1,1,0,0,0,0|1,0,0]=3 6734 B12R1.71 CCCCc1ccc(cc1)OC 7a_100011216022_200000210301 [1,1,0,0,0,0|1,0,0]=3 6735 B12R1.71 CCCCc1ccc(cc1)O[13CH3] 34a_100011216022_200025704644 [1,1,0,0,0,0|1,0,0]=3 6736 B12R1.71 CCCCc1ccc(cc1)O[13CH3] 7a_100011216022_200025704644 [1,1,0,0,0,0|1,0,0]=3 6737 B12R1.71 CCCCc1ccc(cc1)SC 271570a_100020621405_100011263217 [1,1,0,0,0,0|1,1,0]=4 6738 B12R1.71 CCCCc1ccc(cc1)SC 62a_100011218101_200000210301 [1,1,0,0,0,0|1,1,0]=4 6739 B12R1.71 CCCCc1ccc(cc1)SC 62a_200000210301_100011218101 [1,1,0,0,0,0|1,1,0]=4 6740 B12R1.71 CCCCc1ccc(cc1)S[13CH3] 62a_100011218101_200025704644 [1,1,0,0,0,0|1,1,0]=4 6741 B12R1.71 CCCCc1ccc(cc1)S[13CH3] 62a_200025704644_100011218101 [1,1,0,0,0,0|1,1,0]=4 6742 B12R1.71 CCCCc1ccc(cn1)CO 271570a_100020621405_100009816760 [1,1,0,0,0,0|2,0,0]=4 6743 B12R1.71 CCCCc1ccc(cn1)OC 271570a_100020621405_100000755202 [1,1,0,0,0,0|2,0,0]=4 6744 B12R1.71 CCCCc1ccc(nc1)CO 271570a_100020621405_100000754261 [1,1,0,0,0,0|2,0,0]=4 6745 B12R1.71 CCCCc1ccc(nc1)OC 271570a_100020621405_100000047065 [1,1,0,0,0,0|2,0,0]=4 6746 B12R1.71 CCCNc1ccc(cc1)CO 2230a_100011215238_100000210303 [1,1,0,0,0,0|2,0,0]=4 6747 B12R1.71 CCCNc1ccc(cc1)CO 34a_100011215238_100000210303 [1,1,0,0,0,0|2,0,0]=4 6748 B12R1.71 CCCNc1ccc(cc1)OC 34a_100000184247_100000210303 [1,1,0,0,0,0|2,0,0]=4 6749 B12R1.71 CCCOc1ccc(cc1)CO 34a_100000211755_100000210303 [1,1,0,0,0,0|2,0,0]=4 6750 B12R1.71 CCCOc1ccc(cc1)OC 34a_100000185468_200000210301 [1,1,0,0,0,0|2,0,0]=4 6751 B12R1.71 CCCOc1ccc(cc1)OC 34a_100000210503_100000210303 [1,1,0,0,0,0|2,0,0]=4 6752 B12R1.71 CCCOc1ccc(cc1)OC 7a_100000185468_200000210301 [1,1,0,0,0,0|2,0,0]=4 6753 B12R1.71 CCCOc1ccc(cc1)O[13CH3] 34a_100000185468_200025704644 [1,1,0,0,0,0|2,0,0]=4 6754 B12R1.71 CCCOc1ccc(cc1)O[13CH3] 7a_100000185468_200025704644 [1,1,0,0,0,0|2,0,0]=4 6755 B12R1.71 CCCSc1ccc(cc1)CO 62a_100000210303_100000690907 [1,1,0,0,0,0|2,0,0]=4 6756 B12R1.71 CCCSc1ccc(cc1)CO 62a_100000690907_100000210303 [1,1,0,0,0,0|2,0,0]=4 6757 B12R1.71 CCCSc1ccc(cc1)OC 62a_100000210303_100000171711 [1,1,0,0,0,0|2,0,0]=4 6758 B12R1.71 CCNCc1ccc(cc1)CO 207a_100015525214_100009832023 [1,1,0,0,0,0|2,0,0]=4 6759 B12R1.71 CCNCc1ccc(cc1)CO 2230a_100015189231_100000210202 [1,1,0,0,0,0|2,0,0]=4 6760 B12R1.71 CCNCc1ccc(cc1)CO 2230a_100015525214_100000067286 [1,1,0,0,0,0|2,0,0]=4 6761 B12R1.71 CCNCc1ccc(cc1)CO 270004a_100015525214_100009832023 [1,1,0,0,0,0|2,0,0]=4 6762 B12R1.71 CCNCc1ccc(cc1)CO 34a_100015189231_100000210202 [1,1,0,0,0,0|2,0,0]=4 6763 B12R1.71 CCNCc1ccc(cc1)OC 207a_100015525214_100000169835 [1,1,0,0,0,0|2,0,0]=4 6764 B12R1.71 CCNCc1ccc(cc1)OC 2230a_100015525214_100000742318 [1,1,0,0,0,0|2,0,0]=4 6765 B12R1.71 CCNCc1ccc(cc1)OC 270004a_100015525214_100000169835 [1,1,0,0,0,0|2,0,0]=4 6766 B12R1.71 CCNCc1ccc(cc1)OC 34a_100000185587_100000210202 [1,1,0,0,0,0|2,0,0]=4 6767 B12R1.71 CCNCc1ccc(cc1)OC 34a_100000748449_200000210301 [1,1,0,0,0,0|2,0,0]=4 6768 B12R1.71 CCNCc1ccc(cc1)O[13CH3] 34a_100000748449_200025704644 [1,1,0,0,0,0|2,0,0]=4 6769 B12R1.71 CCOCc1ccc(cc1)CO 34a_100121572206_100000067286 [1,1,0,0,0,0|2,0,0]=4 6770 B12R1.71 CCOCc1ccc(cc1)OC 34a_100000173359_100000210202 [1,1,0,0,0,0|2,0,0]=4 6771 B12R1.71 CCOCc1ccc(cc1)OC 34a_100121572206_100000742318 [1,1,0,0,0,0|2,0,0]=4 6772 B12R1.71 CCSCc1ccc(cc1)CO 62a_100000067286_100000210202 [1,1,0,0,0,0|2,0,0]=4 6773 B12R1.71 CCSCc1ccc(cc1)CO 62a_100000210202_100000067286 [1,1,0,0,0,0|2,0,0]=4 6774 B12R1.71 CCSCc1ccc(cc1)OC 62a_100000210202_100000742318 [1,1,0,0,0,0|2,0,0]=4 6775 B12R1.71 CCc1ccc(cc1)CCNC 2230a_100025712186_200000210301 [1,1,0,0,0,0|1,0,0]=3 6776 B12R1.71 CCc1ccc(cc1)CCNC 34a_100025712186_200000210301 [1,1,0,0,0,0|1,0,0]=3 6777 B12R1.71 CCc1ccc(cc1)CCN[13CH3] 2230a_100025712186_200025704644 [1,1,0,0,0,0|1,0,0]=3 6778 B12R1.71 CCc1ccc(cc1)CCN[13CH3] 34a_100025712186_200025704644 [1,1,0,0,0,0|1,0,0]=3 6779 B12R1.71 CNCCc1ccc(cc1)C#N 2230a_100015189369_200000210301 [1,1,0,0,0,0|1,0,0]=3 6780 B12R1.71 CNCCc1ccc(cc1)C#N 2230a_106832991635_100012161189 [1,1,0,0,0,0|1,0,0]=3 6781 B12R1.71 CNCCc1ccc(cc1)C#N 34a_100015189369_200000210301 [1,1,0,0,0,0|1,0,0]=3 6782 B12R1.71 CNCCc1ccc(cc1)C#N 34a_100102657272_100012161189 [1,1,0,0,0,0|1,0,0]=3 6783 B12R1.71 CNCCc1ccc(cc1)C#N 7a_106832991635_100012161189 [1,1,0,0,0,0|1,0,0]=3 6784 B12R1.71 CNCCc1ccc(cc1)OC 2230a_100000210796_200000210301 [1,1,0,0,0,0|0,0,0]=2 6785 B12R1.71 CNCCc1ccc(cc1)OC 2230a_106832991635_100011713689 [1,1,0,0,0,0|0,0,0]=2 6786 B12R1.71 CNCCc1ccc(cc1)OC 270004a_106832991635_100011242372 [1,1,0,0,0,0|0,0,0]=2 6787 B12R1.71 CNCCc1ccc(cc1)OC 34a_100000210796_200000210301 [1,1,0,0,0,0|0,0,0]=2 6788 B12R1.71 CNCCc1ccc(cc1)OC 34a_100016989440_200000210301 [1,1,0,0,0,0|0,0,0]=2 6789 B12R1.71 CNCCc1ccc(cc1)OC 34a_100102657272_100000184700 [1,1,0,0,0,0|0,0,0]=2 6790 B12R1.71 CNCCc1ccc(cc1)OC 7a_106832991635_100000184700 [1,1,0,0,0,0|0,0,0]=2 6791 B12R1.71 CNCCc1ccc(cc1)O[13CH3] 34a_100016989440_200025704644 [1,1,0,0,0,0|0,0,0]=2 6792 B12R1.71 CNCCc1ccc(cc1)SC 62a_100000752880_200000210301 [1,1,0,0,0,0|0,1,0]=3 6793 B12R1.71 CNCCc1ccc(cc1)SC 62a_200000210301_100000752880 [1,1,0,0,0,0|0,1,0]=3 6794 B12R1.71 CNCCc1ccc(cc1)S[13CH3] 62a_100000752880_200025704644 [1,1,0,0,0,0|0,1,0]=3 6795 B12R1.71 CNCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000752880 [1,1,0,0,0,0|0,1,0]=3 6796 B12R1.71 CNCCc1ccc(nc1)OC 2230a_100011998949_200000210301 [1,1,0,0,0,0|1,0,0]=3 6797 B12R1.71 CNCCc1ccc(nc1)OC 34a_100011998949_200000210301 [1,1,0,0,0,0|1,0,0]=3 6798 B12R1.71 CNc1ccc(cc1)CCSC 2230a_100000750819_200000210301 [1,1,0,0,0,0|2,0,0]=4 6799 B12R1.71 CNc1ccc(cc1)CCSC 34a_100000750819_200000210301 [1,1,0,0,0,0|2,0,0]=4 6800 B12R1.71 CNc1ccc(cc1)CCSC 7a_100000750819_200000210301 [1,1,0,0,0,0|2,0,0]=4 6801 B12R1.71 COCCc1ccc(cc1)C#N 34a_100011219507_200000210301 [1,1,0,0,0,0|2,0,0]=4 6802 B12R1.71 COCCc1ccc(cc1)C#N 34a_100138415774_100012161189 [1,1,0,0,0,0|2,0,0]=4 6803 B12R1.71 COCCc1ccc(cc1)C#N 7a_100011219507_200000210301 [1,1,0,0,0,0|2,0,0]=4 6804 B12R1.71 COCCc1ccc(cc1)OC 34a_100000211638_200000210301 [1,1,0,0,0,0|1,0,0]=3 6805 B12R1.71 COCCc1ccc(cc1)OC 34a_100011219623_200000210301 [1,1,0,0,0,0|1,0,0]=3 6806 B12R1.71 COCCc1ccc(cc1)OC 34a_100138415774_100000184700 [1,1,0,0,0,0|1,0,0]=3 6807 B12R1.71 COCCc1ccc(cc1)OC 7a_100000211638_200000210301 [1,1,0,0,0,0|1,0,0]=3 6808 B12R1.71 COCCc1ccc(cc1)OC 7a_100011219623_200000210301 [1,1,0,0,0,0|1,0,0]=3 6809 B12R1.71 COCCc1ccc(cc1)O[13CH3] 34a_100000211638_200025704644 [1,1,0,0,0,0|1,0,0]=3 6810 B12R1.71 COCCc1ccc(cc1)O[13CH3] 7a_100000211638_200025704644 [1,1,0,0,0,0|1,0,0]=3 6811 B12R1.71 COCCc1ccc(cc1)SC 62a_100000739703_200000210301 [1,1,0,0,0,0|1,1,0]=4 6812 B12R1.71 COCCc1ccc(cc1)SC 62a_200000210301_100000739703 [1,1,0,0,0,0|1,1,0]=4 6813 B12R1.71 COCCc1ccc(cc1)S[13CH3] 62a_100000739703_200025704644 [1,1,0,0,0,0|1,1,0]=4 6814 B12R1.71 COCCc1ccc(cc1)S[13CH3] 62a_200025704644_100000739703 [1,1,0,0,0,0|1,1,0]=4 6815 B12R1.71 COCNc1ccc(cc1)CO 2230a_100011215238_100000766300 [1,1,0,0,0,0|2,0,0]=4 6816 B12R1.71 COCOc1ccc(cc1)OC 34a_200012265912_200000210301 [1,1,0,0,0,0|2,0,0]=4 6817 B12R1.71 COCOc1ccc(cc1)O[13CH3] 34a_200012265912_200025704644 [1,1,0,0,0,0|2,0,0]=4 6818 B12R1.71 COCSc1ccc(cc1)CO 62a_100000690907_100000766300 [1,1,0,0,0,0|2,0,0]=4 6819 B12R1.71 COCSc1ccc(cc1)CO 62a_100000766300_100000690907 [1,1,0,0,0,0|2,0,0]=4 6820 B12R1.71 COCSc1ccc(cc1)OC 62a_100000766300_100000171711 [1,1,0,0,0,0|2,0,0]=4 6821 B12R1.71 COc1ccc(cc1)CCC#N 34a_200011217972_200000210301 [1,1,0,0,0,0|2,0,0]=4 6822 B12R1.71 COc1ccc(cc1)CCC#N 7a_200011217972_200000210301 [1,1,0,0,0,0|2,0,0]=4 6823 B12R1.71 COc1ccc(cc1)CCCO 34a_100011215268_200000210301 [1,1,0,0,0,0|2,0,0]=4 6824 B12R1.71 COc1ccc(cc1)CCCO 7a_100011215268_200000210301 [1,1,0,0,0,0|2,0,0]=4 6825 B12R1.71 COc1ccc(cc1)CCN[13CH3] 2230a_100000210796_200025704644 [1,1,0,0,0,0|0,0,0]=2 6826 B12R1.71 COc1ccc(cc1)CCN[13CH3] 34a_100000210796_200025704644 [1,1,0,0,0,0|0,0,0]=2 6827 B12R1.71 COc1ccc(cc1)CCO[13CH3] 34a_100011219623_200025704644 [1,1,0,0,0,0|1,0,0]=3 6828 B12R1.71 COc1ccc(cc1)CCO[13CH3] 7a_100011219623_200025704644 [1,1,0,0,0,0|1,0,0]=3 6829 B12R1.71 COc1ccc(cc1)CCSC 62a_100011713689_200000210301 [1,1,0,0,0,0|1,0,0]=3 6830 B12R1.71 COc1ccc(cc1)CCSC 62a_200000210301_100011713689 [1,1,0,0,0,0|1,0,0]=3 6831 B12R1.71 COc1ccc(cc1)CCS[13CH3] 62a_100011713689_200025704644 [1,1,0,0,0,0|1,0,0]=3 6832 B12R1.71 COc1ccc(cc1)CCS[13CH3] 62a_200025704644_100011713689 [1,1,0,0,0,0|1,0,0]=3 6833 B12R1.71 COc1ccc(cc1)NCSC 34a_100000184247_100011218213 [1,1,0,0,0,0|2,0,0]=4 6834 B12R1.71 COc1ccc(cc1)OCSC 34a_100000210503_100011218213 [1,1,0,0,0,0|2,0,0]=4 6835 B12R1.71 COc1ccc(cc1)SCSC 62a_100011218213_100000171711 [1,1,0,0,0,0|2,0,0]=4 6836 B12R1.71 COc1ccc(cn1)CCN[13CH3] 2230a_100011998949_200025704644 [1,1,0,0,0,0|1,0,0]=3 6837 B12R1.71 COc1ccc(cn1)CCN[13CH3] 34a_100011998949_200025704644 [1,1,0,0,0,0|1,0,0]=3 6838 B12R1.71 CSCCc1ccc(cc1)C#N 62a_200000210301_100012161189 [1,1,0,0,0,0|2,0,0]=4 6839 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 2230a_100000750819_200025704644 [1,1,0,0,0,0|2,0,0]=4 6840 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 34a_100000750819_200025704644 [1,1,0,0,0,0|2,0,0]=4 6841 B12R1.71 CSCCc1ccc(cc1)N[13CH3] 7a_100000750819_200025704644 [1,1,0,0,0,0|2,0,0]=4 6842 B12R1.71 CSCNc1ccc(cc1)CO 2230a_100011215238_100011218213 [1,1,0,0,0,0|2,0,0]=4 6843 B12R1.71 CSCNc1ccc(cc1)CO 34a_100011215238_100011218213 [1,1,0,0,0,0|2,0,0]=4 6844 B12R1.71 CSCOc1ccc(cc1)CO 34a_100000211755_100011218213 [1,1,0,0,0,0|2,0,0]=4 6845 B12R1.71 CSCSc1ccc(cc1)CO 62a_100000690907_100011218213 [1,1,0,0,0,0|2,0,0]=4 6846 B12R1.71 CSCSc1ccc(cc1)CO 62a_100011218213_100000690907 [1,1,0,0,0,0|2,0,0]=4 6847 B12R1.71 [13CH3]NCCc1ccc(cc1)C#N 2230a_100015189369_200025704644 [1,1,0,0,0,0|1,0,0]=3 6848 B12R1.71 [13CH3]NCCc1ccc(cc1)C#N 34a_100015189369_200025704644 [1,1,0,0,0,0|1,0,0]=3 6849 B12R1.71 [13CH3]OCCc1ccc(cc1)C#N 34a_100011219507_200025704644 [1,1,0,0,0,0|2,0,0]=4 6850 B12R1.71 [13CH3]OCCc1ccc(cc1)C#N 7a_100011219507_200025704644 [1,1,0,0,0,0|2,0,0]=4 6851 B12R1.71 [13CH3]Oc1ccc(cc1)CCC#N 34a_200011217972_200025704644 [1,1,0,0,0,0|2,0,0]=4 6852 B12R1.71 [13CH3]Oc1ccc(cc1)CCC#N 7a_200011217972_200025704644 [1,1,0,0,0,0|2,0,0]=4 6853 B12R1.71 [13CH3]Oc1ccc(cc1)CCCO 34a_100011215268_200025704644 [1,1,0,0,0,0|2,0,0]=4 6854 B12R1.71 [13CH3]Oc1ccc(cc1)CCCO 7a_100011215268_200025704644 [1,1,0,0,0,0|2,0,0]=4 6855 B12R1.71 [13CH3]SCCc1ccc(cc1)C#N 62a_200025704644_100012161189 [1,1,0,0,0,0|2,0,0]=4 6856 B12R1.17 CCCC(=O)c1cccc(c1)O 1458a_100000183914_100000210303 [1,1,0,0,0,0|1,0,1]=4 6857 B12R1.17 CCCN(C)c1cccc(c1)O 2230a_100000756613_100000210303 [1,1,0,0,0,0|2,0,0]=4 6858 B12R1.17 CCCN(C)c1cccc(c1)O 269982a_100000756613_100000210303 [1,1,0,0,0,0|2,0,0]=4 6859 B12R1.17 CCCN(C)c1cccc(c1)O 34a_100000756613_100000210303 [1,1,0,0,0,0|2,0,0]=4 6860 B12R1.17 CCNC(C)c1cccc(c1)O 2230a_100000740644_100000210202 [1,1,0,0,0,0|2,0,0]=4 6861 B12R1.17 CCNC(C)c1cccc(c1)O 269862a_100015525214_100000211620 [1,1,0,0,0,0|2,0,0]=4 6862 B12R1.17 CNCC(=O)c1cccc(c1)Br 2230a_106832991635_100000212080 [1,1,0,0,0,0|1,0,1]=4 6863 B12R1.17 CNCC(=O)c1cccc(c1)Br 34a_100102657272_100000212080 [1,1,0,0,0,0|1,0,1]=4 6864 B12R1.17 CNCC(=O)c1cccc(c1)Br 7a_106832991635_100000212080 [1,1,0,0,0,0|1,0,1]=4 6865 B12R1.17 CNCC(=O)c1cccc(c1)C 2230a_106832991635_100000739480 [1,1,0,0,0,0|1,0,1]=4 6866 B12R1.17 CNCC(=O)c1cccc(c1)C 34a_100102657272_100000739480 [1,1,0,0,0,0|1,0,1]=4 6867 B12R1.17 CNCC(=O)c1cccc(c1)C 7a_106832991635_100000739480 [1,1,0,0,0,0|1,0,1]=4 6868 B12R1.17 CNCC(=O)c1cccc(c1)Cl 2230a_106832991635_100000211444 [1,1,0,0,0,0|1,0,1]=4 6869 B12R1.17 CNCC(=O)c1cccc(c1)Cl 34a_100102657272_100000211444 [1,1,0,0,0,0|1,0,1]=4 6870 B12R1.17 CNCC(=O)c1cccc(c1)Cl 7a_106832991635_100000211444 [1,1,0,0,0,0|1,0,1]=4 6871 B12R1.17 CNCC(=O)c1cccc(c1)F 2230a_106832991635_100000215616 [1,1,0,0,0,0|1,0,1]=4 6872 B12R1.17 CNCC(=O)c1cccc(c1)F 34a_100102657272_100000215616 [1,1,0,0,0,0|1,0,1]=4 6873 B12R1.17 CNCC(=O)c1cccc(c1)O 34a_100102657272_100009813753 [1,1,0,0,0,0|0,0,1]=3 6874 B12R1.17 CNCC(=O)c1cccc(c1)O 7a_106832991635_100009813753 [1,1,0,0,0,0|0,0,1]=3 6875 B12R1.17 CNCC(O)c1cccc(c1)O 2230a_100020657549_200000210301 [1,1,0,0,0,0|0,0,0]=2 6876 B12R1.17 CNCC(O)c1cccc(c1)O 271570a_203496583355_200000733937 [1,1,0,0,0,0|0,0,0]=2 6877 B12R1.17 CNCC(O)c1cccc(c1)O 34a_100020657549_200000210301 [1,1,0,0,0,0|0,0,0]=2 6878 B12R1.17 CNNC(=O)c1cccc(c1)O 22a_100016993582_100000183914 [1,1,0,0,0,0|1,0,1]=4 6879 B12R1.17 COCC(=O)c1cccc(c1)O 34a_100138415774_100009813753 [1,1,0,0,0,0|1,0,1]=4 6880 B12R1.17 COCC(N)c1cccc(c1)Br 34a_100000690078_200000210301 [1,1,0,0,0,0|2,0,0]=4 6881 B12R1.17 COCN(C)c1cccc(c1)O 2230a_100000756613_100000766300 [1,1,0,0,0,0|2,0,0]=4 6882 B12R1.17 COCN(C)c1cccc(c1)O 269982a_100000756613_100000766300 [1,1,0,0,0,0|2,0,0]=4 6883 B12R1.17 COC[C@@H](N)c1cccc(c1)C 34a_100009818812_200000210301 [1,1,0,0,0,0|2,0,0]=4 6884 B12R1.17 COC[C@@H](N)c1cccc(c1)F 34a_100020641251_200000210301 [1,1,0,0,0,0|2,0,0]=4 6885 B12R1.17 COC[C@H](N)c1cccc(c1)Cl 34a_100032004910_200000210301 [1,1,0,0,0,0|2,0,0]=4 6886 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_100009813753_200000210301 [1,1,0,0,0,0|1,0,1]=4 6887 B12R1.17 CSCC(=O)c1cccc(c1)O 62a_200000210301_100009813753 [1,1,0,0,0,0|1,0,1]=4 6888 B12R1.17 CSCN(C)c1cccc(c1)O 2230a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 6889 B12R1.17 CSCN(C)c1cccc(c1)O 269982a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 6890 B12R1.17 CSCN(C)c1cccc(c1)O 34a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 6891 B12R1.17 Cc1cccc(c1)[C@H](N)CO[13CH3] 34a_100009818812_200025704644 [1,1,0,0,0,0|2,0,0]=4 6892 B12R1.17 NC(CCO)c1cccc(c1)O 271570a_203496583355_200011661555 [1,1,0,0,0,0|2,0,0]=4 6893 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 2230a_100020657549_200025704644 [1,1,0,0,0,0|0,0,0]=2 6894 B12R1.17 [13CH3]NCC(O)c1cccc(c1)O 34a_100020657549_200025704644 [1,1,0,0,0,0|0,0,0]=2 6895 B12R1.17 [13CH3]OCC(N)c1cccc(c1)Br 34a_100000690078_200025704644 [1,1,0,0,0,0|2,0,0]=4 6896 B12R1.17 [13CH3]OC[C@@H](N)c1cccc(c1)F 34a_100020641251_200025704644 [1,1,0,0,0,0|2,0,0]=4 6897 B12R1.17 [13CH3]OC[C@H](N)c1cccc(c1)Cl 34a_100032004910_200025704644 [1,1,0,0,0,0|2,0,0]=4 6898 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_100009813753_200025704644 [1,1,0,0,0,0|1,0,1]=4 6899 B12R1.17 [13CH3]SCC(=O)c1cccc(c1)O 62a_200025704644_100009813753 [1,1,0,0,0,0|1,0,1]=4 6900 B12R1.25 CCCCc1cccc(c1Br)O 271570a_100020621405_100010187914 [1,1,0,0,0,0|1,0,0]=3 6901 B12R1.25 CCCCc1cccc(c1C)Br 271570a_100020621405_100012353703 [1,1,0,0,0,0|2,0,0]=4 6902 B12R1.25 CCCCc1cccc(c1C)C 271570a_100020621405_100011214922 [1,1,0,0,0,0|2,0,0]=4 6903 B12R1.25 CCCCc1cccc(c1C)Cl 271570a_100020621405_100000726075 [1,1,0,0,0,0|2,0,0]=4 6904 B12R1.25 CCCCc1cccc(c1C)F 271570a_100020621405_100011216893 [1,1,0,0,0,0|2,0,0]=4 6905 B12R1.25 CCCCc1cccc(c1C)N 271570a_100020621405_100000761887 [1,1,0,0,0,0|2,0,0]=4 6906 B12R1.25 CCCCc1cccc(c1C)O 271570a_100020621405_100012002258 [1,1,0,0,0,0|1,0,0]=3 6907 B12R1.25 CCCCc1cccc(c1Cl)Br 271570a_100020621405_100010142854 [1,1,0,0,0,0|2,0,0]=4 6908 B12R1.25 CCCCc1cccc(c1Cl)C 271570a_100020621405_200012352035 [1,1,0,0,0,0|2,0,0]=4 6909 B12R1.25 CCCCc1cccc(c1Cl)Cl 271570a_100020621405_100011215384 [1,1,0,0,0,0|2,0,0]=4 6910 B12R1.25 CCCCc1cccc(c1Cl)F 271570a_100020621405_200010234923 [1,1,0,0,0,0|2,0,0]=4 6911 B12R1.25 CCCCc1cccc(c1Cl)O 271570a_100020621405_100000049636 [1,1,0,0,0,0|1,0,0]=3 6912 B12R1.25 CCCCc1cccc(c1F)Br 271570a_100020621405_100000702267 [1,1,0,0,0,0|2,0,0]=4 6913 B12R1.25 CCCCc1cccc(c1F)C 271570a_100020621405_100000717567 [1,1,0,0,0,0|2,0,0]=4 6914 B12R1.25 CCCCc1cccc(c1F)Cl 271570a_100020621405_100011217346 [1,1,0,0,0,0|2,0,0]=4 6915 B12R1.25 CCCCc1cccc(c1F)F 271570a_100020621405_100000694657 [1,1,0,0,0,0|2,0,0]=4 6916 B12R1.25 CCCCc1cccc(c1F)N 271570a_100020621405_100011935091 [1,1,0,0,0,0|2,0,0]=4 6917 B12R1.25 CCCCc1cccc(c1F)O 271570a_100020621405_100009817021 [1,1,0,0,0,0|1,0,0]=3 6918 B12R1.25 CCCCc1cccc(c1N)Br 271570a_100020621405_100010146558 [1,1,0,0,0,0|2,0,0]=4 6919 B12R1.25 CCCCc1cccc(c1N)C 271570a_100020621405_100011834072 [1,1,0,0,0,0|2,0,0]=4 6920 B12R1.25 CCCCc1cccc(c1N)Cl 271570a_100020621405_100010190421 [1,1,0,0,0,0|2,0,0]=4 6921 B12R1.25 CCCCc1cccc(c1N)F 271570a_100020621405_100000042321 [1,1,0,0,0,0|2,0,0]=4 6922 B12R1.25 CCCCc1cccc(c1N)N 271570a_100020621405_100015191791 [1,1,0,0,0,0|2,0,0]=4 6923 B12R1.25 CCCCc1cccc(c1N)O 271570a_100020621405_100011934926 [1,1,0,0,0,0|1,0,0]=3 6924 B12R1.25 CCCCc1cccc(c1O)Br 271570a_100020621405_100010084509 [1,1,0,0,0,0|2,0,0]=4 6925 B12R1.25 CCCCc1cccc(c1O)C 271570a_100020621405_100009817157 [1,1,0,0,0,0|2,0,0]=4 6926 B12R1.25 CCCCc1cccc(c1O)Cl 271570a_100020621405_100010202889 [1,1,0,0,0,0|2,0,0]=4 6927 B12R1.25 CCCCc1cccc(c1O)F 271570a_100020621405_100009813666 [1,1,0,0,0,0|2,0,0]=4 6928 B12R1.25 CCCCc1cccc(c1O)N 271570a_100020621405_100011934915 [1,1,0,0,0,0|2,0,0]=4 6929 B12R1.25 CCCCc1cccc(c1O)O 271570a_100020621405_100009815950 [1,1,0,0,0,0|1,0,0]=3 6930 B12R1.25 CCCCc1ccnc(c1C)O 271570a_100020621405_100009858498 [1,1,0,0,0,0|2,0,0]=4 6931 B12R1.25 CCCCc1nccc(c1F)O 271570a_100020621405_100009876375 [1,1,0,0,0,0|2,0,0]=4 6932 B12R1.25 CCCCc1nccc(c1N)O 271570a_100020621405_100000128729 [1,1,0,0,0,0|2,0,0]=4 6933 B12R1.25 CCCNc1cccc(c1Br)O 34a_100012183704_100000210303 [1,1,0,0,0,0|2,0,0]=4 6934 B12R1.25 CCCNc1cccc(c1Br)O 7a_100012183704_100000210303 [1,1,0,0,0,0|2,0,0]=4 6935 B12R1.25 CCCNc1cccc(c1C)O 34a_100011216573_100000210303 [1,1,0,0,0,0|2,0,0]=4 6936 B12R1.25 CCCNc1cccc(c1C)O 7a_100011216573_100000210303 [1,1,0,0,0,0|2,0,0]=4 6937 B12R1.25 CCCNc1cccc(c1Cl)O 34a_100012002038_100000210303 [1,1,0,0,0,0|2,0,0]=4 6938 B12R1.25 CCCNc1cccc(c1Cl)O 7a_100012002038_100000210303 [1,1,0,0,0,0|2,0,0]=4 6939 B12R1.25 CCCSc1cccc(c1Br)O 62a_100000210303_100010187914 [1,1,0,0,0,0|2,0,0]=4 6940 B12R1.25 CCCSc1cccc(c1Br)O 62a_100010187914_100000210303 [1,1,0,0,0,0|2,0,0]=4 6941 B12R1.25 CCCSc1cccc(c1C)O 62a_100000210303_100012002258 [1,1,0,0,0,0|2,0,0]=4 6942 B12R1.25 CCCSc1cccc(c1C)O 62a_100012002258_100000210303 [1,1,0,0,0,0|2,0,0]=4 6943 B12R1.25 CCCSc1cccc(c1Cl)O 62a_100000210303_100000049636 [1,1,0,0,0,0|2,0,0]=4 6944 B12R1.25 CCCSc1cccc(c1F)O 62a_100000210303_100009817021 [1,1,0,0,0,0|2,0,0]=4 6945 B12R1.25 CCCSc1cccc(c1F)O 62a_100009817021_100000210303 [1,1,0,0,0,0|2,0,0]=4 6946 B12R1.25 CCCSc1cccc(c1N)O 62a_100000210303_100011934926 [1,1,0,0,0,0|2,0,0]=4 6947 B12R1.25 CCCSc1cccc(c1O)O 62a_100000210303_100009815950 [1,1,0,0,0,0|2,0,0]=4 6948 B12R1.25 CCNCc1cccc(c1C)O 270004a_100015525214_100009868165 [1,1,0,0,0,0|2,0,0]=4 6949 B12R1.25 CCNCc1cccc(c1Cl)O 270004a_100015525214_100000050521 [1,1,0,0,0,0|2,0,0]=4 6950 B12R1.25 CCNCc1cccc(c1F)O 34a_100025773512_100000210202 [1,1,0,0,0,0|2,0,0]=4 6951 B12R1.25 CNCCc1cccc(c1C)Br 2230a_100161000114_200000210301 [1,1,0,0,0,0|1,0,0]=3 6952 B12R1.25 CNCCc1cccc(c1C)Br 34a_100161000114_200000210301 [1,1,0,0,0,0|1,0,0]=3 6953 B12R1.25 CNCCc1cccc(c1Cl)Cl 2230a_100000741019_200000210301 [1,1,0,0,0,0|1,0,0]=3 6954 B12R1.25 CNCCc1cccc(c1Cl)Cl 2230a_106832991635_100000723033 [1,1,0,0,0,0|1,0,0]=3 6955 B12R1.25 CNCCc1cccc(c1Cl)Cl 34a_100000741019_200000210301 [1,1,0,0,0,0|1,0,0]=3 6956 B12R1.25 CNCCc1cccc(c1Cl)Cl 34a_100102657272_100000723033 [1,1,0,0,0,0|1,0,0]=3 6957 B12R1.25 CNCCc1cccc(c1Cl)Cl 7a_106832991635_100000723033 [1,1,0,0,0,0|1,0,0]=3 6958 B12R1.25 COCCc1cccc(c1Cl)Cl 34a_100011754357_200000210301 [1,1,0,0,0,0|2,0,0]=4 6959 B12R1.25 COCCc1cccc(c1Cl)Cl 34a_100138415774_100000723033 [1,1,0,0,0,0|2,0,0]=4 6960 B12R1.25 COCCc1cccc(c1Cl)Cl 7a_100011754357_200000210301 [1,1,0,0,0,0|2,0,0]=4 6961 B12R1.25 COCCc1cccc(c1F)Cl 34a_100011830271_200000210301 [1,1,0,0,0,0|2,0,0]=4 6962 B12R1.25 COCCc1cccc(c1F)Cl 7a_100011830271_200000210301 [1,1,0,0,0,0|2,0,0]=4 6963 B12R1.25 COCCc1cccc(c1F)F 34a_100000698707_200000210301 [1,1,0,0,0,0|2,0,0]=4 6964 B12R1.25 COCCc1cccc(c1F)F 7a_100000698707_200000210301 [1,1,0,0,0,0|2,0,0]=4 6965 B12R1.25 COCSc1cccc(c1Br)O 62a_100000766300_100010187914 [1,1,0,0,0,0|2,0,0]=4 6966 B12R1.25 COCSc1cccc(c1Br)O 62a_100010187914_100000766300 [1,1,0,0,0,0|2,0,0]=4 6967 B12R1.25 COCSc1cccc(c1C)O 62a_100000766300_100012002258 [1,1,0,0,0,0|2,0,0]=4 6968 B12R1.25 COCSc1cccc(c1C)O 62a_100012002258_100000766300 [1,1,0,0,0,0|2,0,0]=4 6969 B12R1.25 COCSc1cccc(c1Cl)O 62a_100000766300_100000049636 [1,1,0,0,0,0|2,0,0]=4 6970 B12R1.25 COCSc1cccc(c1F)O 62a_100000766300_100009817021 [1,1,0,0,0,0|2,0,0]=4 6971 B12R1.25 COCSc1cccc(c1F)O 62a_100009817021_100000766300 [1,1,0,0,0,0|2,0,0]=4 6972 B12R1.25 COCSc1cccc(c1N)O 62a_100000766300_100011934926 [1,1,0,0,0,0|2,0,0]=4 6973 B12R1.25 COCSc1cccc(c1O)O 62a_100000766300_100009815950 [1,1,0,0,0,0|2,0,0]=4 6974 B12R1.25 CSCCc1cccc(c1Cl)Cl 62a_100000723033_200000210301 [1,1,0,0,0,0|2,0,0]=4 6975 B12R1.25 CSCCc1cccc(c1Cl)Cl 62a_200000210301_100000723033 [1,1,0,0,0,0|2,0,0]=4 6976 B12R1.25 CSCNc1cccc(c1Br)O 34a_100012183704_100011218213 [1,1,0,0,0,0|2,0,0]=4 6977 B12R1.25 CSCNc1cccc(c1C)O 34a_100011216573_100011218213 [1,1,0,0,0,0|2,0,0]=4 6978 B12R1.25 CSCNc1cccc(c1Cl)O 34a_100012002038_100011218213 [1,1,0,0,0,0|2,0,0]=4 6979 B12R1.25 CSCSc1cccc(c1Br)O 62a_100010187914_100011218213 [1,1,0,0,0,0|2,0,0]=4 6980 B12R1.25 CSCSc1cccc(c1Br)O 62a_100011218213_100010187914 [1,1,0,0,0,0|2,0,0]=4 6981 B12R1.25 CSCSc1cccc(c1C)O 62a_100011218213_100012002258 [1,1,0,0,0,0|2,0,0]=4 6982 B12R1.25 CSCSc1cccc(c1C)O 62a_100012002258_100011218213 [1,1,0,0,0,0|2,0,0]=4 6983 B12R1.25 CSCSc1cccc(c1Cl)O 62a_100011218213_100000049636 [1,1,0,0,0,0|2,0,0]=4 6984 B12R1.25 CSCSc1cccc(c1F)O 62a_100009817021_100011218213 [1,1,0,0,0,0|2,0,0]=4 6985 B12R1.25 CSCSc1cccc(c1F)O 62a_100011218213_100009817021 [1,1,0,0,0,0|2,0,0]=4 6986 B12R1.25 CSCSc1cccc(c1N)O 62a_100011218213_100011934926 [1,1,0,0,0,0|2,0,0]=4 6987 B12R1.25 CSCSc1cccc(c1O)O 62a_100011218213_100009815950 [1,1,0,0,0,0|2,0,0]=4 6988 B12R1.25 Cc1c(cccc1CCN[13CH3])Br 2230a_100161000114_200025704644 [1,1,0,0,0,0|1,0,0]=3 6989 B12R1.25 Cc1c(cccc1CCN[13CH3])Br 34a_100161000114_200025704644 [1,1,0,0,0,0|1,0,0]=3 6990 B12R1.25 [13CH3]NCCc1cccc(c1Cl)Cl 2230a_100000741019_200025704644 [1,1,0,0,0,0|1,0,0]=3 6991 B12R1.25 [13CH3]NCCc1cccc(c1Cl)Cl 34a_100000741019_200025704644 [1,1,0,0,0,0|1,0,0]=3 6992 B12R1.25 [13CH3]OCCc1cccc(c1Cl)Cl 34a_100011754357_200025704644 [1,1,0,0,0,0|2,0,0]=4 6993 B12R1.25 [13CH3]OCCc1cccc(c1Cl)Cl 7a_100011754357_200025704644 [1,1,0,0,0,0|2,0,0]=4 6994 B12R1.25 [13CH3]OCCc1cccc(c1F)Cl 34a_100011830271_200025704644 [1,1,0,0,0,0|2,0,0]=4 6995 B12R1.25 [13CH3]OCCc1cccc(c1F)Cl 7a_100011830271_200025704644 [1,1,0,0,0,0|2,0,0]=4 6996 B12R1.25 [13CH3]OCCc1cccc(c1F)F 34a_100000698707_200025704644 [1,1,0,0,0,0|2,0,0]=4 6997 B12R1.25 [13CH3]OCCc1cccc(c1F)F 7a_100000698707_200025704644 [1,1,0,0,0,0|2,0,0]=4 6998 B12R1.25 [13CH3]SCCc1cccc(c1Cl)Cl 62a_100000723033_200025704644 [1,1,0,0,0,0|2,0,0]=4 6999 B12R1.25 [13CH3]SCCc1cccc(c1Cl)Cl 62a_200025704644_100000723033 [1,1,0,0,0,0|2,0,0]=4 7000 B12R1.28 C#CCCNc1cccc(c1)O 34a_100000210217_100000688953 [1,1,0,0,0,0|1,0,1]=4 7001 B12R1.28 C#CCCSc1cccc(c1)O 62a_100000688953_100000211634 [1,1,0,0,0,0|1,0,1]=4 7002 B12R1.28 C#CCNCc1cccc(c1)O 2230a_100000743036_100000038162 [1,1,0,0,0,0|1,0,1]=4 7003 B12R1.28 C#CCNCc1cccc(c1)O 34a_100000212058_100011660834 [1,1,0,0,0,0|1,0,1]=4 7004 B12R1.28 C#CCNCc1cccc(c1)O 34a_100000743036_100000184674 [1,1,0,0,0,0|1,0,1]=4 7005 B12R1.28 C#CCOCc1cccc(c1)O 34a_100000210247_100011660834 [1,1,0,0,0,0|1,0,1]=4 7006 B12R1.28 C#CCSCc1cccc(c1)O 62a_100000038162_100011660834 [1,1,0,0,0,0|1,0,1]=4 7007 B12R1.28 C/C=C/CNc1cccc(c1)O 34a_100000210217_100102629194 [1,1,0,0,0,0|1,0,1]=4 7008 B12R1.28 C/C=C/CSc1cccc(c1)O 62a_100102629194_100000211634 [1,1,0,0,0,0|1,0,1]=4 7009 B12R1.28 C=CCCNc1cccc(c1)O 34a_100000210217_100000754431 [1,1,0,0,0,0|1,0,1]=4 7010 B12R1.28 C=CCCSc1cccc(c1)O 62a_100000754431_100000211634 [1,1,0,0,0,0|1,0,1]=4 7011 B12R1.28 C=CCNCc1cccc(c1)O 2230a_100000743036_100000210623 [1,1,0,0,0,0|1,0,1]=4 7012 B12R1.28 C=CCNCc1cccc(c1)O 2230a_100020586998_100011660834 [1,1,0,0,0,0|1,0,1]=4 7013 B12R1.28 C=CCNCc1cccc(c1)O 270004a_100020586998_100000188321 [1,1,0,0,0,0|1,0,1]=4 7014 B12R1.28 C=CCNCc1cccc(c1)O 34a_100000743036_100015514636 [1,1,0,0,0,0|1,0,1]=4 7015 B12R1.28 C=CCOCc1cccc(c1)O 34a_200000210373_100011660834 [1,1,0,0,0,0|1,0,1]=4 7016 B12R1.28 C=CCSCc1cccc(c1)O 62a_100000210623_100011660834 [1,1,0,0,0,0|1,0,1]=4 7017 B12R1.28 C=CCSCc1cccc(c1)O 62a_100011660834_100000210623 [1,1,0,0,0,0|1,0,1]=4 7018 B12R1.28 CC#CCNc1cccc(c1)O 34a_100000210217_100000748600 [1,1,0,0,0,0|1,0,1]=4 7019 B12R1.28 CC#CCSc1cccc(c1)O 62a_100000748600_100000211634 [1,1,0,0,0,0|1,0,1]=4 7020 B12R1.28 CC=CCNc1cccc(c1)O 34a_100000210217_100000070051 [1,1,0,0,0,0|1,0,1]=4 7021 B12R1.28 CC=CCSc1cccc(c1)O 62a_100000070051_100000211634 [1,1,0,0,0,0|1,0,1]=4 7022 B12R1.28 CCCC=Cc1cccc(c1)O 271570a_100016258520_100000211634 [1,1,0,0,0,0|1,0,1]=4 7023 B12R1.28 CCCCNc1cccc(c1)Br 34a_100000210019_100000210210 [1,1,0,0,0,0|2,0,0]=4 7024 B12R1.28 CCCCNc1cccc(c1)C 2230a_100000188690_100000210211 [1,1,0,0,0,0|2,0,0]=4 7025 B12R1.28 CCCCNc1cccc(c1)C 34a_100000188690_100000210210 [1,1,0,0,0,0|2,0,0]=4 7026 B12R1.28 CCCCNc1cccc(c1)Cl 34a_100000185859_100000210210 [1,1,0,0,0,0|2,0,0]=4 7027 B12R1.28 CCCCNc1cccc(c1)F 34a_100000210047_100000210210 [1,1,0,0,0,0|2,0,0]=4 7028 B12R1.28 CCCCNc1cccc(c1)I 34a_100000211102_100000210210 [1,1,0,0,0,0|2,0,0]=4 7029 B12R1.28 CCCCNc1cccc(c1)O 34a_100000210217_100000210210 [1,1,0,0,0,0|1,0,0]=3 7030 B12R1.28 CCCCOc1cccc(c1)Br 34a_100000210342_100000210210 [1,1,0,0,0,0|2,0,0]=4 7031 B12R1.28 CCCCOc1cccc(c1)Br 7a_100000210342_100000210211 [1,1,0,0,0,0|2,0,0]=4 7032 B12R1.28 CCCCOc1cccc(c1)C 34a_100000210337_100000210210 [1,1,0,0,0,0|2,0,0]=4 7033 B12R1.28 CCCCOc1cccc(c1)C 7a_100000210337_100000210211 [1,1,0,0,0,0|2,0,0]=4 7034 B12R1.28 CCCCOc1cccc(c1)Cl 34a_100000210295_100000210210 [1,1,0,0,0,0|2,0,0]=4 7035 B12R1.28 CCCCOc1cccc(c1)Cl 7a_100000210295_100000210211 [1,1,0,0,0,0|2,0,0]=4 7036 B12R1.28 CCCCOc1cccc(c1)F 34a_100000210426_100000210210 [1,1,0,0,0,0|2,0,0]=4 7037 B12R1.28 CCCCOc1cccc(c1)F 7a_100000210426_100000210211 [1,1,0,0,0,0|2,0,0]=4 7038 B12R1.28 CCCCOc1cccc(c1)I 34a_100000211634_100000210210 [1,1,0,0,0,0|2,0,0]=4 7039 B12R1.28 CCCCOc1cccc(c1)I 7a_100000211634_100000210211 [1,1,0,0,0,0|2,0,0]=4 7040 B12R1.28 CCCCOc1cccc(c1)N 34a_100000210217_100000210210 [1,1,0,0,0,0|2,0,0]=4 7041 B12R1.28 CCCCOc1cccc(c1)O 271570a_203496583355_200011212284 [1,1,0,0,0,0|1,0,0]=3 7042 B12R1.28 CCCCOc1cccc(n1)O 271570a_203496583355_200011960251 [1,1,0,0,0,0|2,0,0]=4 7043 B12R1.28 CCCCSc1cc(ccn1)O 62a_100000210211_100000762945 [1,1,0,0,0,0|2,0,0]=4 7044 B12R1.28 CCCCSc1cccc(c1)Br 62a_100000210211_100000691529 [1,1,0,0,0,0|2,0,0]=4 7045 B12R1.28 CCCCSc1cccc(c1)Br 62a_100000691529_100000210210 [1,1,0,0,0,0|2,0,0]=4 7046 B12R1.28 CCCCSc1cccc(c1)C 62a_100000210211_100011215228 [1,1,0,0,0,0|2,0,0]=4 7047 B12R1.28 CCCCSc1cccc(c1)C 62a_100011215228_100000210210 [1,1,0,0,0,0|2,0,0]=4 7048 B12R1.28 CCCCSc1cccc(c1)Cl 62a_100000210211_100000699651 [1,1,0,0,0,0|2,0,0]=4 7049 B12R1.28 CCCCSc1cccc(c1)Cl 62a_100000699651_100000210210 [1,1,0,0,0,0|2,0,0]=4 7050 B12R1.28 CCCCSc1cccc(c1)F 62a_100000210211_100000685547 [1,1,0,0,0,0|2,0,0]=4 7051 B12R1.28 CCCCSc1cccc(c1)F 62a_100000685547_100000210210 [1,1,0,0,0,0|2,0,0]=4 7052 B12R1.28 CCCCSc1cccc(c1)N 62a_100000210019_100000210210 [1,1,0,0,0,0|2,0,0]=4 7053 B12R1.28 CCCCSc1cccc(c1)N 62a_100000210211_100000210019 [1,1,0,0,0,0|2,0,0]=4 7054 B12R1.28 CCCCSc1cccc(c1)O 271570a_203496583355_100010128134 [1,1,0,0,0,0|1,0,0]=3 7055 B12R1.28 CCCCSc1cccc(c1)O 62a_100000210211_100000211634 [1,1,0,0,0,0|1,0,0]=3 7056 B12R1.28 CCCCSc1cccc(c1)[S] 62a_100000210211_114929384022 [1,1,0,0,0,0|1,1,0]=4 7057 B12R1.28 CCCCSc1cccc(c1)[S] 62a_114929384022_100000210210 [1,1,0,0,0,0|1,1,0]=4 7058 B12R1.28 CCCCSc1cncc(c1)O 62a_100000210211_100000754920 [1,1,0,0,0,0|2,0,0]=4 7059 B12R1.28 CCCCSc1cncc(c1)O 62a_100000754920_100000210210 [1,1,0,0,0,0|2,0,0]=4 7060 B12R1.28 CCCNCc1cccc(c1)Br 207a_100020643023_100000210085 [1,1,0,0,0,0|2,0,0]=4 7061 B12R1.28 CCCNCc1cccc(c1)Br 2230a_100000174977_100000210303 [1,1,0,0,0,0|2,0,0]=4 7062 B12R1.28 CCCNCc1cccc(c1)Br 270004a_100020643023_100000210085 [1,1,0,0,0,0|2,0,0]=4 7063 B12R1.28 CCCNCc1cccc(c1)Br 34a_100000174977_100000210303 [1,1,0,0,0,0|2,0,0]=4 7064 B12R1.28 CCCNCc1cccc(c1)C 207a_100020643023_100000211157 [1,1,0,0,0,0|2,0,0]=4 7065 B12R1.28 CCCNCc1cccc(c1)C 2230a_100000185548_100000210303 [1,1,0,0,0,0|2,0,0]=4 7066 B12R1.28 CCCNCc1cccc(c1)C 270004a_100020643023_100000211157 [1,1,0,0,0,0|2,0,0]=4 7067 B12R1.28 CCCNCc1cccc(c1)C 34a_100000185548_100000210303 [1,1,0,0,0,0|2,0,0]=4 7068 B12R1.28 CCCNCc1cccc(c1)Cl 207a_100020643023_100000210801 [1,1,0,0,0,0|2,0,0]=4 7069 B12R1.28 CCCNCc1cccc(c1)Cl 2230a_100000174878_100000210303 [1,1,0,0,0,0|2,0,0]=4 7070 B12R1.28 CCCNCc1cccc(c1)Cl 270004a_100020643023_100000210801 [1,1,0,0,0,0|2,0,0]=4 7071 B12R1.28 CCCNCc1cccc(c1)Cl 34a_100000174878_100000210303 [1,1,0,0,0,0|2,0,0]=4 7072 B12R1.28 CCCNCc1cccc(c1)F 207a_100020643023_100000210812 [1,1,0,0,0,0|2,0,0]=4 7073 B12R1.28 CCCNCc1cccc(c1)F 2230a_100000174948_100000210303 [1,1,0,0,0,0|2,0,0]=4 7074 B12R1.28 CCCNCc1cccc(c1)F 270004a_100020643023_100000210812 [1,1,0,0,0,0|2,0,0]=4 7075 B12R1.28 CCCNCc1cccc(c1)F 34a_100000174948_100000210303 [1,1,0,0,0,0|2,0,0]=4 7076 B12R1.28 CCCNCc1cccc(c1)I 207a_100020643023_100000014684 [1,1,0,0,0,0|2,0,0]=4 7077 B12R1.28 CCCNCc1cccc(c1)I 2230a_100000106179_100000210303 [1,1,0,0,0,0|2,0,0]=4 7078 B12R1.28 CCCNCc1cccc(c1)I 270004a_100020643023_100000014684 [1,1,0,0,0,0|2,0,0]=4 7079 B12R1.28 CCCNCc1cccc(c1)I 34a_100000106179_100000210303 [1,1,0,0,0,0|2,0,0]=4 7080 B12R1.28 CCCNCc1cccc(c1)O 207a_100020643023_100000188321 [1,1,0,0,0,0|1,0,0]=3 7081 B12R1.28 CCCNCc1cccc(c1)O 2230a_100000743036_100000210303 [1,1,0,0,0,0|1,0,0]=3 7082 B12R1.28 CCCNCc1cccc(c1)O 270004a_100020643023_100000188321 [1,1,0,0,0,0|1,0,0]=3 7083 B12R1.28 CCCNCc1cccc(c1)O 271570a_203496583355_100015184641 [1,1,0,0,0,0|1,0,0]=3 7084 B12R1.28 CCCNCc1cccc(c1)O 34a_100000743036_100000210303 [1,1,0,0,0,0|1,0,0]=3 7085 B12R1.28 CCCNCc1ccnc(c1)O 207a_100020643023_100000688113 [1,1,0,0,0,0|2,0,0]=4 7086 B12R1.28 CCCNCc1cncc(c1)O 207a_100020643023_100012187055 [1,1,0,0,0,0|2,0,0]=4 7087 B12R1.28 CCCNCc1cncc(c1)O 270004a_100020643023_100012187055 [1,1,0,0,0,0|2,0,0]=4 7088 B12R1.28 CCCOCc1cccc(c1)Br 34a_100000210258_100000698116 [1,1,0,0,0,0|2,0,0]=4 7089 B12R1.28 CCCOCc1cccc(c1)Br 34a_100000687537_100000210303 [1,1,0,0,0,0|2,0,0]=4 7090 B12R1.28 CCCOCc1cccc(c1)Br 7a_100000687537_100000210303 [1,1,0,0,0,0|2,0,0]=4 7091 B12R1.28 CCCOCc1cccc(c1)C 34a_100000210258_100000211840 [1,1,0,0,0,0|2,0,0]=4 7092 B12R1.28 CCCOCc1cccc(c1)C 34a_100011217746_100000210303 [1,1,0,0,0,0|2,0,0]=4 7093 B12R1.28 CCCOCc1cccc(c1)C 7a_100011217746_100000210303 [1,1,0,0,0,0|2,0,0]=4 7094 B12R1.28 CCCOCc1cccc(c1)Cl 34a_100000210258_100000187163 [1,1,0,0,0,0|2,0,0]=4 7095 B12R1.28 CCCOCc1cccc(c1)Cl 34a_100000241301_100000210303 [1,1,0,0,0,0|2,0,0]=4 7096 B12R1.28 CCCOCc1cccc(c1)Cl 7a_100000241301_100000210303 [1,1,0,0,0,0|2,0,0]=4 7097 B12R1.28 CCCOCc1cccc(c1)F 34a_100000210258_100000187166 [1,1,0,0,0,0|2,0,0]=4 7098 B12R1.28 CCCOCc1cccc(c1)F 34a_100000210976_100000210303 [1,1,0,0,0,0|2,0,0]=4 7099 B12R1.28 CCCOCc1cccc(c1)F 7a_100000210976_100000210303 [1,1,0,0,0,0|2,0,0]=4 7100 B12R1.28 CCCOCc1cccc(c1)I 34a_100000210258_100011218688 [1,1,0,0,0,0|2,0,0]=4 7101 B12R1.28 CCCOCc1cccc(c1)I 34a_100011215336_100000210303 [1,1,0,0,0,0|2,0,0]=4 7102 B12R1.28 CCCOCc1cccc(c1)I 7a_100011215336_100000210303 [1,1,0,0,0,0|2,0,0]=4 7103 B12R1.28 CCCOCc1cccc(c1)N 34a_100000211919_100000210303 [1,1,0,0,0,0|2,0,0]=4 7104 B12R1.28 CCCOCc1cccc(c1)O 34a_100000210258_100011660834 [1,1,0,0,0,0|1,0,0]=3 7105 B12R1.28 CCCSCc1cccc(c1)Br 62a_100000210303_100000211773 [1,1,0,0,0,0|2,0,0]=4 7106 B12R1.28 CCCSCc1cccc(c1)Br 62a_100000211773_100000210303 [1,1,0,0,0,0|2,0,0]=4 7107 B12R1.28 CCCSCc1cccc(c1)C 62a_100000210303_100000211840 [1,1,0,0,0,0|2,0,0]=4 7108 B12R1.28 CCCSCc1cccc(c1)C 62a_100000211840_100000210303 [1,1,0,0,0,0|2,0,0]=4 7109 B12R1.28 CCCSCc1cccc(c1)Cl 62a_100000187163_100000210303 [1,1,0,0,0,0|2,0,0]=4 7110 B12R1.28 CCCSCc1cccc(c1)Cl 62a_100000210303_100000187163 [1,1,0,0,0,0|2,0,0]=4 7111 B12R1.28 CCCSCc1cccc(c1)F 62a_100000210303_100000230114 [1,1,0,0,0,0|2,0,0]=4 7112 B12R1.28 CCCSCc1cccc(c1)F 62a_100000230114_100000210303 [1,1,0,0,0,0|2,0,0]=4 7113 B12R1.28 CCCSCc1cccc(c1)I 62a_100000210303_100011218688 [1,1,0,0,0,0|2,0,0]=4 7114 B12R1.28 CCCSCc1cccc(c1)I 62a_100011218688_100000210303 [1,1,0,0,0,0|2,0,0]=4 7115 B12R1.28 CCCSCc1cccc(c1)O 62a_100000210303_100011660834 [1,1,0,0,0,0|1,0,0]=3 7116 B12R1.28 CCCSCc1cccc(c1)O 62a_100011660834_100000210303 [1,1,0,0,0,0|1,0,0]=3 7117 B12R1.28 CCNCCc1cccc(c1)Br 2230a_100011207229_100000210202 [1,1,0,0,0,0|1,0,0]=3 7118 B12R1.28 CCNCCc1cccc(c1)Br 2230a_100015525214_100011740638 [1,1,0,0,0,0|1,0,0]=3 7119 B12R1.28 CCNCCc1cccc(c1)Br 34a_100011207229_100000210202 [1,1,0,0,0,0|1,0,0]=3 7120 B12R1.28 CCNCCc1cccc(c1)C 2230a_100000749837_100000210202 [1,1,0,0,0,0|1,0,0]=3 7121 B12R1.28 CCNCCc1cccc(c1)C 2230a_100015525214_100011713685 [1,1,0,0,0,0|1,0,0]=3 7122 B12R1.28 CCNCCc1cccc(c1)C 34a_100000749837_100000210202 [1,1,0,0,0,0|1,0,0]=3 7123 B12R1.28 CCNCCc1cccc(c1)Cl 2230a_100000185263_100000210202 [1,1,0,0,0,0|1,0,0]=3 7124 B12R1.28 CCNCCc1cccc(c1)Cl 2230a_100015525214_100011713710 [1,1,0,0,0,0|1,0,0]=3 7125 B12R1.28 CCNCCc1cccc(c1)Cl 34a_100000185263_100000210202 [1,1,0,0,0,0|1,0,0]=3 7126 B12R1.28 CCNCCc1cccc(c1)F 2230a_100000205154_100000210202 [1,1,0,0,0,0|1,0,0]=3 7127 B12R1.28 CCNCCc1cccc(c1)F 2230a_100015525214_100011217235 [1,1,0,0,0,0|1,0,0]=3 7128 B12R1.28 CCNCCc1cccc(c1)F 34a_100000205154_100000210202 [1,1,0,0,0,0|1,0,0]=3 7129 B12R1.28 CCNCCc1cccc(c1)O 2230a_100000747277_100000210202 [1,1,0,0,0,0|0,0,0]=2 7130 B12R1.28 CCNCCc1cccc(c1)O 34a_100000747277_100000210202 [1,1,0,0,0,0|0,0,0]=2 7131 B12R1.28 CCNCCc1cccc(n1)C 2230a_100011824523_100000210202 [1,1,0,0,0,0|2,0,0]=4 7132 B12R1.28 CCNCCc1cccc(n1)C 34a_100011824523_100000210202 [1,1,0,0,0,0|2,0,0]=4 7133 B12R1.28 CCNN=Cc1cccc(c1)O 4a_100000756455_100000188321 [1,1,0,0,0,0|1,0,1]=4 7134 B12R1.28 CCOCCc1cccc(c1)Br 34a_100011217444_100000210202 [1,1,0,0,0,0|2,0,0]=4 7135 B12R1.28 CCOCCc1cccc(c1)Br 34a_100121572206_100011740638 [1,1,0,0,0,0|2,0,0]=4 7136 B12R1.28 CCOCCc1cccc(c1)Br 7a_100011217444_100000210202 [1,1,0,0,0,0|2,0,0]=4 7137 B12R1.28 CCOCCc1cccc(c1)C 34a_100011217157_100000210202 [1,1,0,0,0,0|2,0,0]=4 7138 B12R1.28 CCOCCc1cccc(c1)C 34a_100121572206_100011713685 [1,1,0,0,0,0|2,0,0]=4 7139 B12R1.28 CCOCCc1cccc(c1)C 7a_100011217157_100000210202 [1,1,0,0,0,0|2,0,0]=4 7140 B12R1.28 CCOCCc1cccc(c1)Cl 34a_100000754733_100000210202 [1,1,0,0,0,0|2,0,0]=4 7141 B12R1.28 CCOCCc1cccc(c1)Cl 34a_100121572206_100011713710 [1,1,0,0,0,0|2,0,0]=4 7142 B12R1.28 CCOCCc1cccc(c1)Cl 7a_100000754733_100000210202 [1,1,0,0,0,0|2,0,0]=4 7143 B12R1.28 CCOCCc1cccc(c1)F 34a_100000763591_100000210202 [1,1,0,0,0,0|2,0,0]=4 7144 B12R1.28 CCOCCc1cccc(c1)F 34a_100121572206_100011217235 [1,1,0,0,0,0|2,0,0]=4 7145 B12R1.28 CCOCCc1cccc(c1)F 7a_100000763591_100000210202 [1,1,0,0,0,0|2,0,0]=4 7146 B12R1.28 CCOCCc1cccc(c1)N 34a_100011996697_100000210202 [1,1,0,0,0,0|2,0,0]=4 7147 B12R1.28 CCOCSc1cccc(c1)O 62a_100000739092_100000211634 [1,1,0,0,0,0|2,0,0]=4 7148 B12R1.28 CCSCCc1cccc(c1)Br 62a_100000210202_100011740638 [1,1,0,0,0,0|2,0,0]=4 7149 B12R1.28 CCSCCc1cccc(c1)Br 62a_100011740638_100000210202 [1,1,0,0,0,0|2,0,0]=4 7150 B12R1.28 CCSCCc1cccc(c1)C 62a_100000210202_100011713685 [1,1,0,0,0,0|2,0,0]=4 7151 B12R1.28 CCSCCc1cccc(c1)C 62a_100011713685_100000210202 [1,1,0,0,0,0|2,0,0]=4 7152 B12R1.28 CCSCCc1cccc(c1)Cl 62a_100000210202_100011713710 [1,1,0,0,0,0|2,0,0]=4 7153 B12R1.28 CCSCCc1cccc(c1)Cl 62a_100011713710_100000210202 [1,1,0,0,0,0|2,0,0]=4 7154 B12R1.28 CCSCCc1cccc(c1)F 62a_100000210202_100011217235 [1,1,0,0,0,0|2,0,0]=4 7155 B12R1.28 CCSCCc1cccc(c1)F 62a_100011217235_100000210202 [1,1,0,0,0,0|2,0,0]=4 7156 B12R1.28 CNCC#Cc1cccc(c1)Br 2230a_106832991635_100010706776 [1,1,0,0,0,0|1,0,1]=4 7157 B12R1.28 CNCC#Cc1cccc(c1)Br 34a_100102657272_100010706776 [1,1,0,0,0,0|1,0,1]=4 7158 B12R1.28 CNCC#Cc1cccc(c1)Br 7a_106832991635_100010706776 [1,1,0,0,0,0|1,0,1]=4 7159 B12R1.28 CNCC#Cc1cccc(c1)F 2230a_106832991635_100010402994 [1,1,0,0,0,0|1,0,1]=4 7160 B12R1.28 CNCC#Cc1cccc(c1)F 34a_100102657272_100010402994 [1,1,0,0,0,0|1,0,1]=4 7161 B12R1.28 CNCC#Cc1cccc(c1)F 7a_106832991635_100010402994 [1,1,0,0,0,0|1,0,1]=4 7162 B12R1.28 CNCC=Cc1cccc(c1)C 270004a_106832991635_100102525846 [1,1,0,0,0,0|1,0,1]=4 7163 B12R1.28 CNCC=Cc1cccc(c1)Cl 270004a_106832991635_100016268971 [1,1,0,0,0,0|1,0,1]=4 7164 B12R1.28 CNCCCc1cccc(c1)Br 2230a_100000753791_200000210301 [1,1,0,0,0,0|1,0,0]=3 7165 B12R1.28 CNCCCc1cccc(c1)Br 2230a_106832991635_100011713683 [1,1,0,0,0,0|1,0,0]=3 7166 B12R1.28 CNCCCc1cccc(c1)Br 34a_100000753791_200000210301 [1,1,0,0,0,0|1,0,0]=3 7167 B12R1.28 CNCCCc1cccc(c1)Br 34a_100102657272_100011713683 [1,1,0,0,0,0|1,0,0]=3 7168 B12R1.28 CNCCCc1cccc(c1)Br 7a_106832991635_100011713683 [1,1,0,0,0,0|1,0,0]=3 7169 B12R1.28 CNCCCc1cccc(c1)C 2230a_103496528808_200000210301 [1,1,0,0,0,0|1,0,0]=3 7170 B12R1.28 CNCCCc1cccc(c1)C 34a_103496528808_200000210301 [1,1,0,0,0,0|1,0,0]=3 7171 B12R1.28 CNCCCc1cccc(c1)Cl 2230a_100000704586_200000210301 [1,1,0,0,0,0|1,0,0]=3 7172 B12R1.28 CNCCCc1cccc(c1)Cl 34a_100000704586_200000210301 [1,1,0,0,0,0|1,0,0]=3 7173 B12R1.28 CNCCCc1cccc(c1)F 2230a_100000754185_200000210301 [1,1,0,0,0,0|1,0,0]=3 7174 B12R1.28 CNCCCc1cccc(c1)F 2230a_106832991635_200000698031 [1,1,0,0,0,0|1,0,0]=3 7175 B12R1.28 CNCCCc1cccc(c1)F 34a_100000754185_200000210301 [1,1,0,0,0,0|1,0,0]=3 7176 B12R1.28 CNCCCc1cccc(c1)F 34a_100102657272_200000698031 [1,1,0,0,0,0|1,0,0]=3 7177 B12R1.28 CNCCCc1cccc(c1)F 7a_106832991635_200000698031 [1,1,0,0,0,0|1,0,0]=3 7178 B12R1.28 CNCCOc1cccc(c1)Br 2230a_100000743521_200000210301 [1,1,0,0,0,0|1,0,0]=3 7179 B12R1.28 CNCCOc1cccc(c1)Br 2230a_106832991635_100000183150 [1,1,0,0,0,0|1,0,0]=3 7180 B12R1.28 CNCCOc1cccc(c1)Br 34a_100000743521_200000210301 [1,1,0,0,0,0|1,0,0]=3 7181 B12R1.28 CNCCOc1cccc(c1)Br 34a_100102657272_100000183150 [1,1,0,0,0,0|1,0,0]=3 7182 B12R1.28 CNCCOc1cccc(c1)Br 7a_106832991635_100000183150 [1,1,0,0,0,0|1,0,0]=3 7183 B12R1.28 CNCCOc1cccc(c1)C 2230a_100015185188_200000210301 [1,1,0,0,0,0|1,0,0]=3 7184 B12R1.28 CNCCOc1cccc(c1)C 34a_100015185188_200000210301 [1,1,0,0,0,0|1,0,0]=3 7185 B12R1.28 CNCCOc1cccc(c1)Cl 2230a_100000740232_200000210301 [1,1,0,0,0,0|1,0,0]=3 7186 B12R1.28 CNCCOc1cccc(c1)Cl 2230a_106832991635_100000181161 [1,1,0,0,0,0|1,0,0]=3 7187 B12R1.28 CNCCOc1cccc(c1)Cl 34a_100000740232_200000210301 [1,1,0,0,0,0|1,0,0]=3 7188 B12R1.28 CNCCOc1cccc(c1)Cl 34a_100102657272_100000181161 [1,1,0,0,0,0|1,0,0]=3 7189 B12R1.28 CNCCOc1cccc(c1)Cl 7a_106832991635_100000181161 [1,1,0,0,0,0|1,0,0]=3 7190 B12R1.28 CNCCOc1cccc(c1)F 2230a_100000738948_200000210301 [1,1,0,0,0,0|1,0,0]=3 7191 B12R1.28 CNCCOc1cccc(c1)F 2230a_106832991635_100000739188 [1,1,0,0,0,0|1,0,0]=3 7192 B12R1.28 CNCCOc1cccc(c1)F 34a_100000738948_200000210301 [1,1,0,0,0,0|1,0,0]=3 7193 B12R1.28 CNCCOc1cccc(c1)F 34a_100102657272_100000739188 [1,1,0,0,0,0|1,0,0]=3 7194 B12R1.28 CNCCOc1cccc(c1)F 7a_106832991635_100000739188 [1,1,0,0,0,0|1,0,0]=3 7195 B12R1.28 CNCCOc1cccc(c1)O 271570a_203496583355_200000225663 [1,1,0,0,0,0|0,0,0]=2 7196 B12R1.28 COCC=Cc1cccc(c1)O 271570a_100016286323_100000211634 [1,1,0,0,0,0|1,0,1]=4 7197 B12R1.28 COCCCc1cccc(c1)Br 34a_100011709248_200000210301 [1,1,0,0,0,0|2,0,0]=4 7198 B12R1.28 COCCCc1cccc(c1)Br 34a_100138415774_100011713683 [1,1,0,0,0,0|2,0,0]=4 7199 B12R1.28 COCCCc1cccc(c1)Br 7a_100011709248_200000210301 [1,1,0,0,0,0|2,0,0]=4 7200 B12R1.28 COCCCc1cccc(c1)Cl 34a_100011709246_200000210301 [1,1,0,0,0,0|2,0,0]=4 7201 B12R1.28 COCCCc1cccc(c1)Cl 7a_100011709246_200000210301 [1,1,0,0,0,0|2,0,0]=4 7202 B12R1.28 COCCCc1cccc(c1)F 34a_100138415774_200000698031 [1,1,0,0,0,0|2,0,0]=4 7203 B12R1.28 COCCCc1cccc(c1)N 34a_200000698965_200000210301 [1,1,0,0,0,0|2,0,0]=4 7204 B12R1.28 COCCCc1cccc(c1)N 7a_200000698965_200000210301 [1,1,0,0,0,0|2,0,0]=4 7205 B12R1.28 COCCNc1cccc(c1)Br 34a_100000210019_100011201679 [1,1,0,0,0,0|2,0,0]=4 7206 B12R1.28 COCCNc1cccc(c1)C 2230a_100000188690_100011201679 [1,1,0,0,0,0|2,0,0]=4 7207 B12R1.28 COCCNc1cccc(c1)C 34a_100000188690_100011201679 [1,1,0,0,0,0|2,0,0]=4 7208 B12R1.28 COCCNc1cccc(c1)Cl 34a_100000185859_100011201679 [1,1,0,0,0,0|2,0,0]=4 7209 B12R1.28 COCCNc1cccc(c1)F 34a_100000210047_100011201679 [1,1,0,0,0,0|2,0,0]=4 7210 B12R1.28 COCCNc1cccc(c1)I 34a_100000211102_100011201679 [1,1,0,0,0,0|2,0,0]=4 7211 B12R1.28 COCCNc1cccc(c1)O 34a_100000210217_100011201679 [1,1,0,0,0,0|1,0,0]=3 7212 B12R1.28 COCCOc1cc(ccn1)O 271570a_203496583355_200010734593 [1,1,0,0,0,0|2,0,0]=4 7213 B12R1.28 COCCOc1cccc(c1)Br 34a_100000210342_100011201679 [1,1,0,0,0,0|2,0,0]=4 7214 B12R1.28 COCCOc1cccc(c1)Br 34a_100000757546_200000210301 [1,1,0,0,0,0|2,0,0]=4 7215 B12R1.28 COCCOc1cccc(c1)Br 34a_100138415774_100000183150 [1,1,0,0,0,0|2,0,0]=4 7216 B12R1.28 COCCOc1cccc(c1)Br 7a_100000210342_100000233755 [1,1,0,0,0,0|2,0,0]=4 7217 B12R1.28 COCCOc1cccc(c1)Br 7a_100000757546_200000210301 [1,1,0,0,0,0|2,0,0]=4 7218 B12R1.28 COCCOc1cccc(c1)C 34a_100000210337_100011201679 [1,1,0,0,0,0|2,0,0]=4 7219 B12R1.28 COCCOc1cccc(c1)C 34a_200011215094_200000210301 [1,1,0,0,0,0|2,0,0]=4 7220 B12R1.28 COCCOc1cccc(c1)C 7a_100000210337_100000233755 [1,1,0,0,0,0|2,0,0]=4 7221 B12R1.28 COCCOc1cccc(c1)C 7a_200011215094_200000210301 [1,1,0,0,0,0|2,0,0]=4 7222 B12R1.28 COCCOc1cccc(c1)Cl 34a_100000210295_100011201679 [1,1,0,0,0,0|2,0,0]=4 7223 B12R1.28 COCCOc1cccc(c1)Cl 34a_100000230539_200000210301 [1,1,0,0,0,0|2,0,0]=4 7224 B12R1.28 COCCOc1cccc(c1)Cl 34a_100138415774_100000181161 [1,1,0,0,0,0|2,0,0]=4 7225 B12R1.28 COCCOc1cccc(c1)Cl 7a_100000210295_100000233755 [1,1,0,0,0,0|2,0,0]=4 7226 B12R1.28 COCCOc1cccc(c1)Cl 7a_100000230539_200000210301 [1,1,0,0,0,0|2,0,0]=4 7227 B12R1.28 COCCOc1cccc(c1)F 34a_100000210426_100011201679 [1,1,0,0,0,0|2,0,0]=4 7228 B12R1.28 COCCOc1cccc(c1)F 34a_100138415774_100000739188 [1,1,0,0,0,0|2,0,0]=4 7229 B12R1.28 COCCOc1cccc(c1)F 7a_100000210426_100000233755 [1,1,0,0,0,0|2,0,0]=4 7230 B12R1.28 COCCOc1cccc(c1)I 34a_100000211634_100011201679 [1,1,0,0,0,0|2,0,0]=4 7231 B12R1.28 COCCOc1cccc(c1)I 7a_100000211634_100000233755 [1,1,0,0,0,0|2,0,0]=4 7232 B12R1.28 COCCOc1cccc(c1)N 34a_100000210217_100011201679 [1,1,0,0,0,0|2,0,0]=4 7233 B12R1.28 COCCOc1cccc(c1)N 34a_100011232151_200000210301 [1,1,0,0,0,0|2,0,0]=4 7234 B12R1.28 COCCOc1cccc(c1)O 271570a_203496583355_100000742273 [1,1,0,0,0,0|1,0,0]=3 7235 B12R1.28 COCCSc1cc(ccn1)O 62a_100000233755_100000762945 [1,1,0,0,0,0|2,0,0]=4 7236 B12R1.28 COCCSc1cccc(c1)Br 62a_100000233755_100000691529 [1,1,0,0,0,0|2,0,0]=4 7237 B12R1.28 COCCSc1cccc(c1)Br 62a_100000691529_100000233755 [1,1,0,0,0,0|2,0,0]=4 7238 B12R1.28 COCCSc1cccc(c1)Br 7a_200011756134_200000210301 [1,1,0,0,0,0|2,0,0]=4 7239 B12R1.28 COCCSc1cccc(c1)C 34a_200011432187_200000210301 [1,1,0,0,0,0|2,0,0]=4 7240 B12R1.28 COCCSc1cccc(c1)C 62a_100000233755_100011215228 [1,1,0,0,0,0|2,0,0]=4 7241 B12R1.28 COCCSc1cccc(c1)C 62a_100011215228_100000233755 [1,1,0,0,0,0|2,0,0]=4 7242 B12R1.28 COCCSc1cccc(c1)C 7a_200011432187_200000210301 [1,1,0,0,0,0|2,0,0]=4 7243 B12R1.28 COCCSc1cccc(c1)Cl 34a_200011721761_200000210301 [1,1,0,0,0,0|2,0,0]=4 7244 B12R1.28 COCCSc1cccc(c1)Cl 62a_100000233755_100000699651 [1,1,0,0,0,0|2,0,0]=4 7245 B12R1.28 COCCSc1cccc(c1)Cl 62a_100000699651_100000233755 [1,1,0,0,0,0|2,0,0]=4 7246 B12R1.28 COCCSc1cccc(c1)Cl 7a_200011721761_200000210301 [1,1,0,0,0,0|2,0,0]=4 7247 B12R1.28 COCCSc1cccc(c1)F 34a_200011996949_200000210301 [1,1,0,0,0,0|2,0,0]=4 7248 B12R1.28 COCCSc1cccc(c1)F 62a_100000233755_100000685547 [1,1,0,0,0,0|2,0,0]=4 7249 B12R1.28 COCCSc1cccc(c1)F 62a_100000685547_100000233755 [1,1,0,0,0,0|2,0,0]=4 7250 B12R1.28 COCCSc1cccc(c1)F 7a_200011996949_200000210301 [1,1,0,0,0,0|2,0,0]=4 7251 B12R1.28 COCCSc1cccc(c1)N 62a_100000210019_100000233755 [1,1,0,0,0,0|2,0,0]=4 7252 B12R1.28 COCCSc1cccc(c1)N 62a_100000233755_100000210019 [1,1,0,0,0,0|2,0,0]=4 7253 B12R1.28 COCCSc1cccc(c1)O 271570a_203496583355_200009815756 [1,1,0,0,0,0|1,0,0]=3 7254 B12R1.28 COCCSc1cccc(c1)O 62a_100000233755_100000211634 [1,1,0,0,0,0|1,0,0]=3 7255 B12R1.28 COCCSc1cccc(c1)[S] 62a_100000233755_114929384022 [1,1,0,0,0,0|1,1,0]=4 7256 B12R1.28 COCCSc1cccc(c1)[S] 62a_114929384022_100000233755 [1,1,0,0,0,0|1,1,0]=4 7257 B12R1.28 COCCSc1cncc(c1)O 62a_100000233755_100000754920 [1,1,0,0,0,0|2,0,0]=4 7258 B12R1.28 COCCSc1cncc(c1)O 62a_100000754920_100000233755 [1,1,0,0,0,0|2,0,0]=4 7259 B12R1.28 COCNCc1cccc(c1)Br 2230a_100000174977_100000766300 [1,1,0,0,0,0|2,0,0]=4 7260 B12R1.28 COCNCc1cccc(c1)C 2230a_100000185548_100000766300 [1,1,0,0,0,0|2,0,0]=4 7261 B12R1.28 COCNCc1cccc(c1)Cl 2230a_100000174878_100000766300 [1,1,0,0,0,0|2,0,0]=4 7262 B12R1.28 COCNCc1cccc(c1)F 2230a_100000174948_100000766300 [1,1,0,0,0,0|2,0,0]=4 7263 B12R1.28 COCNCc1cccc(c1)I 2230a_100000106179_100000766300 [1,1,0,0,0,0|2,0,0]=4 7264 B12R1.28 COCNCc1cccc(c1)O 2230a_100000743036_100000766300 [1,1,0,0,0,0|1,0,0]=3 7265 B12R1.28 COCSCc1cccc(c1)Br 62a_100000211773_100000766300 [1,1,0,0,0,0|2,0,0]=4 7266 B12R1.28 COCSCc1cccc(c1)Br 62a_100000766300_100000211773 [1,1,0,0,0,0|2,0,0]=4 7267 B12R1.28 COCSCc1cccc(c1)C 62a_100000211840_100000766300 [1,1,0,0,0,0|2,0,0]=4 7268 B12R1.28 COCSCc1cccc(c1)C 62a_100000766300_100000211840 [1,1,0,0,0,0|2,0,0]=4 7269 B12R1.28 COCSCc1cccc(c1)Cl 62a_100000187163_100000766300 [1,1,0,0,0,0|2,0,0]=4 7270 B12R1.28 COCSCc1cccc(c1)Cl 62a_100000766300_100000187163 [1,1,0,0,0,0|2,0,0]=4 7271 B12R1.28 COCSCc1cccc(c1)F 62a_100000230114_100000766300 [1,1,0,0,0,0|2,0,0]=4 7272 B12R1.28 COCSCc1cccc(c1)F 62a_100000766300_100000230114 [1,1,0,0,0,0|2,0,0]=4 7273 B12R1.28 COCSCc1cccc(c1)I 62a_100000766300_100011218688 [1,1,0,0,0,0|2,0,0]=4 7274 B12R1.28 COCSCc1cccc(c1)I 62a_100011218688_100000766300 [1,1,0,0,0,0|2,0,0]=4 7275 B12R1.28 COCSCc1cccc(c1)O 62a_100000766300_100011660834 [1,1,0,0,0,0|1,0,0]=3 7276 B12R1.28 COCSCc1cccc(c1)O 62a_100011660834_100000766300 [1,1,0,0,0,0|1,0,0]=3 7277 B12R1.28 CSCCCc1cccc(c1)Br 62a_100011713683_200000210301 [1,1,0,0,0,0|2,0,0]=4 7278 B12R1.28 CSCCCc1cccc(c1)Br 62a_200000210301_100011713683 [1,1,0,0,0,0|2,0,0]=4 7279 B12R1.28 CSCCCc1cccc(c1)F 62a_200000210301_200000698031 [1,1,0,0,0,0|2,0,0]=4 7280 B12R1.28 CSCCCc1cccc(c1)F 62a_200000698031_200000210301 [1,1,0,0,0,0|2,0,0]=4 7281 B12R1.28 CSCCNc1cccc(c1)Br 34a_100000210019_100000212216 [1,1,0,0,0,0|2,0,0]=4 7282 B12R1.28 CSCCNc1cccc(c1)C 2230a_100000188690_100000751147 [1,1,0,0,0,0|2,0,0]=4 7283 B12R1.28 CSCCNc1cccc(c1)C 34a_100000188690_100000212216 [1,1,0,0,0,0|2,0,0]=4 7284 B12R1.28 CSCCNc1cccc(c1)Cl 34a_100000185859_100000212216 [1,1,0,0,0,0|2,0,0]=4 7285 B12R1.28 CSCCNc1cccc(c1)F 34a_100000210047_100000212216 [1,1,0,0,0,0|2,0,0]=4 7286 B12R1.28 CSCCNc1cccc(c1)I 34a_100000211102_100000212216 [1,1,0,0,0,0|2,0,0]=4 7287 B12R1.28 CSCCNc1cccc(c1)O 34a_100000210217_100000212216 [1,1,0,0,0,0|1,0,0]=3 7288 B12R1.28 CSCCOc1cccc(c1)Br 34a_100000210342_100000212216 [1,1,0,0,0,0|2,0,0]=4 7289 B12R1.28 CSCCOc1cccc(c1)Br 62a_100000183150_200000210301 [1,1,0,0,0,0|2,0,0]=4 7290 B12R1.28 CSCCOc1cccc(c1)Br 62a_200000210301_100000183150 [1,1,0,0,0,0|2,0,0]=4 7291 B12R1.28 CSCCOc1cccc(c1)Br 7a_100000210342_100000212216 [1,1,0,0,0,0|2,0,0]=4 7292 B12R1.28 CSCCOc1cccc(c1)C 34a_100000210337_100000212216 [1,1,0,0,0,0|2,0,0]=4 7293 B12R1.28 CSCCOc1cccc(c1)C 7a_100000210337_100000212216 [1,1,0,0,0,0|2,0,0]=4 7294 B12R1.28 CSCCOc1cccc(c1)Cl 34a_100000210295_100000212216 [1,1,0,0,0,0|2,0,0]=4 7295 B12R1.28 CSCCOc1cccc(c1)Cl 62a_100000181161_200000210301 [1,1,0,0,0,0|2,0,0]=4 7296 B12R1.28 CSCCOc1cccc(c1)Cl 62a_200000210301_100000181161 [1,1,0,0,0,0|2,0,0]=4 7297 B12R1.28 CSCCOc1cccc(c1)Cl 7a_100000210295_100000212216 [1,1,0,0,0,0|2,0,0]=4 7298 B12R1.28 CSCCOc1cccc(c1)F 34a_100000210426_100000212216 [1,1,0,0,0,0|2,0,0]=4 7299 B12R1.28 CSCCOc1cccc(c1)F 62a_100000739188_200000210301 [1,1,0,0,0,0|2,0,0]=4 7300 B12R1.28 CSCCOc1cccc(c1)F 62a_200000210301_100000739188 [1,1,0,0,0,0|2,0,0]=4 7301 B12R1.28 CSCCOc1cccc(c1)F 7a_100000210426_100000212216 [1,1,0,0,0,0|2,0,0]=4 7302 B12R1.28 CSCCOc1cccc(c1)I 34a_100000211634_100000212216 [1,1,0,0,0,0|2,0,0]=4 7303 B12R1.28 CSCCOc1cccc(c1)I 7a_100000211634_100000212216 [1,1,0,0,0,0|2,0,0]=4 7304 B12R1.28 CSCCOc1cccc(c1)N 34a_100000210217_100000212216 [1,1,0,0,0,0|2,0,0]=4 7305 B12R1.28 CSCCSc1cc(ccn1)O 62a_100000212216_100000762945 [1,1,0,0,0,0|2,0,0]=4 7306 B12R1.28 CSCCSc1cccc(c1)Br 62a_100000212216_100000691529 [1,1,0,0,0,0|2,0,0]=4 7307 B12R1.28 CSCCSc1cccc(c1)Br 62a_100000691529_100000751147 [1,1,0,0,0,0|2,0,0]=4 7308 B12R1.28 CSCCSc1cccc(c1)C 62a_100000212216_100011215228 [1,1,0,0,0,0|2,0,0]=4 7309 B12R1.28 CSCCSc1cccc(c1)C 62a_100011215228_100000751147 [1,1,0,0,0,0|2,0,0]=4 7310 B12R1.28 CSCCSc1cccc(c1)Cl 62a_100000212216_100000699651 [1,1,0,0,0,0|2,0,0]=4 7311 B12R1.28 CSCCSc1cccc(c1)Cl 62a_100000699651_100000751147 [1,1,0,0,0,0|2,0,0]=4 7312 B12R1.28 CSCCSc1cccc(c1)F 62a_100000212216_100000685547 [1,1,0,0,0,0|2,0,0]=4 7313 B12R1.28 CSCCSc1cccc(c1)F 62a_100000685547_100000751147 [1,1,0,0,0,0|2,0,0]=4 7314 B12R1.28 CSCCSc1cccc(c1)N 62a_100000210019_100000751147 [1,1,0,0,0,0|2,0,0]=4 7315 B12R1.28 CSCCSc1cccc(c1)N 62a_100000212216_100000210019 [1,1,0,0,0,0|2,0,0]=4 7316 B12R1.28 CSCCSc1cccc(c1)O 62a_100000212216_100000211634 [1,1,0,0,0,0|1,0,0]=3 7317 B12R1.28 CSCCSc1cccc(c1)[S] 62a_100000212216_114929384022 [1,1,0,0,0,0|1,1,0]=4 7318 B12R1.28 CSCCSc1cccc(c1)[S] 62a_114929384022_100000751147 [1,1,0,0,0,0|1,1,0]=4 7319 B12R1.28 CSCCSc1cncc(c1)O 62a_100000212216_100000754920 [1,1,0,0,0,0|2,0,0]=4 7320 B12R1.28 CSCCSc1cncc(c1)O 62a_100000754920_100000751147 [1,1,0,0,0,0|2,0,0]=4 7321 B12R1.28 CSCNCc1cccc(c1)Br 2230a_100000174977_100011218213 [1,1,0,0,0,0|2,0,0]=4 7322 B12R1.28 CSCNCc1cccc(c1)Br 34a_100000174977_100011218213 [1,1,0,0,0,0|2,0,0]=4 7323 B12R1.28 CSCNCc1cccc(c1)C 2230a_100000185548_100011218213 [1,1,0,0,0,0|2,0,0]=4 7324 B12R1.28 CSCNCc1cccc(c1)C 34a_100000185548_100011218213 [1,1,0,0,0,0|2,0,0]=4 7325 B12R1.28 CSCNCc1cccc(c1)Cl 2230a_100000174878_100011218213 [1,1,0,0,0,0|2,0,0]=4 7326 B12R1.28 CSCNCc1cccc(c1)Cl 34a_100000174878_100011218213 [1,1,0,0,0,0|2,0,0]=4 7327 B12R1.28 CSCNCc1cccc(c1)F 2230a_100000174948_100011218213 [1,1,0,0,0,0|2,0,0]=4 7328 B12R1.28 CSCNCc1cccc(c1)F 34a_100000174948_100011218213 [1,1,0,0,0,0|2,0,0]=4 7329 B12R1.28 CSCNCc1cccc(c1)I 2230a_100000106179_100011218213 [1,1,0,0,0,0|2,0,0]=4 7330 B12R1.28 CSCNCc1cccc(c1)I 34a_100000106179_100011218213 [1,1,0,0,0,0|2,0,0]=4 7331 B12R1.28 CSCNCc1cccc(c1)O 2230a_100000743036_100011218213 [1,1,0,0,0,0|1,0,0]=3 7332 B12R1.28 CSCNCc1cccc(c1)O 34a_100000743036_100011218213 [1,1,0,0,0,0|1,0,0]=3 7333 B12R1.28 CSCOCc1cccc(c1)Br 34a_100000687537_100011218213 [1,1,0,0,0,0|2,0,0]=4 7334 B12R1.28 CSCOCc1cccc(c1)C 34a_100011217746_100011218213 [1,1,0,0,0,0|2,0,0]=4 7335 B12R1.28 CSCOCc1cccc(c1)Cl 34a_100000241301_100011218213 [1,1,0,0,0,0|2,0,0]=4 7336 B12R1.28 CSCOCc1cccc(c1)F 34a_100000210976_100011218213 [1,1,0,0,0,0|2,0,0]=4 7337 B12R1.28 CSCOCc1cccc(c1)I 34a_100011215336_100011218213 [1,1,0,0,0,0|2,0,0]=4 7338 B12R1.28 CSCOCc1cccc(c1)N 34a_100000211919_100011218213 [1,1,0,0,0,0|2,0,0]=4 7339 B12R1.28 CSCSCc1cccc(c1)Br 62a_100000211773_100011218213 [1,1,0,0,0,0|2,0,0]=4 7340 B12R1.28 CSCSCc1cccc(c1)Br 62a_100011218213_100000211773 [1,1,0,0,0,0|2,0,0]=4 7341 B12R1.28 CSCSCc1cccc(c1)C 62a_100000211840_100011218213 [1,1,0,0,0,0|2,0,0]=4 7342 B12R1.28 CSCSCc1cccc(c1)C 62a_100011218213_100000211840 [1,1,0,0,0,0|2,0,0]=4 7343 B12R1.28 CSCSCc1cccc(c1)Cl 62a_100000187163_100011218213 [1,1,0,0,0,0|2,0,0]=4 7344 B12R1.28 CSCSCc1cccc(c1)Cl 62a_100011218213_100000187163 [1,1,0,0,0,0|2,0,0]=4 7345 B12R1.28 CSCSCc1cccc(c1)F 62a_100000230114_100011218213 [1,1,0,0,0,0|2,0,0]=4 7346 B12R1.28 CSCSCc1cccc(c1)F 62a_100011218213_100000230114 [1,1,0,0,0,0|2,0,0]=4 7347 B12R1.28 CSCSCc1cccc(c1)I 62a_100011218213_100011218688 [1,1,0,0,0,0|2,0,0]=4 7348 B12R1.28 CSCSCc1cccc(c1)I 62a_100011218688_100011218213 [1,1,0,0,0,0|2,0,0]=4 7349 B12R1.28 CSCSCc1cccc(c1)O 62a_100011218213_100011660834 [1,1,0,0,0,0|1,0,0]=3 7350 B12R1.28 CSCSCc1cccc(c1)O 62a_100011660834_100011218213 [1,1,0,0,0,0|1,0,0]=3 7351 B12R1.28 Cc1cccc(c1)CCCN[13CH3] 2230a_103496528808_200025704644 [1,1,0,0,0,0|1,0,0]=3 7352 B12R1.28 Cc1cccc(c1)CCCN[13CH3] 34a_103496528808_200025704644 [1,1,0,0,0,0|1,0,0]=3 7353 B12R1.28 Cc1cccc(c1)CCNCF 34a_100000749837_100015361967 [1,1,0,0,0,0|1,0,0]=3 7354 B12R1.28 Cc1cccc(c1)CCOCF 34a_100011217157_100015361967 [1,1,0,0,0,0|2,0,0]=4 7355 B12R1.28 Cc1cccc(c1)CCOCF 7a_100011217157_100015361967 [1,1,0,0,0,0|2,0,0]=4 7356 B12R1.28 Cc1cccc(c1)CCSCF 62a_100011713685_100015361967 [1,1,0,0,0,0|2,0,0]=4 7357 B12R1.28 Cc1cccc(c1)CCSCF 62a_100015361967_100011713685 [1,1,0,0,0,0|2,0,0]=4 7358 B12R1.28 Cc1cccc(c1)OCCN[13CH3] 2230a_100015185188_200025704644 [1,1,0,0,0,0|1,0,0]=3 7359 B12R1.28 Cc1cccc(c1)OCCN[13CH3] 34a_100015185188_200025704644 [1,1,0,0,0,0|1,0,0]=3 7360 B12R1.28 Cc1cccc(c1)OCCO[13CH3] 34a_200011215094_200025704644 [1,1,0,0,0,0|2,0,0]=4 7361 B12R1.28 Cc1cccc(c1)OCCO[13CH3] 7a_200011215094_200025704644 [1,1,0,0,0,0|2,0,0]=4 7362 B12R1.28 Cc1cccc(c1)SCCO[13CH3] 34a_200011432187_200025704644 [1,1,0,0,0,0|2,0,0]=4 7363 B12R1.28 Cc1cccc(c1)SCCO[13CH3] 7a_200011432187_200025704644 [1,1,0,0,0,0|2,0,0]=4 7364 B12R1.28 Cc1cccc(n1)CCNCF 34a_100011824523_100015361967 [1,1,0,0,0,0|2,0,0]=4 7365 B12R1.28 FCNCCc1cccc(c1)Br 34a_100011207229_100015361967 [1,1,0,0,0,0|1,0,0]=3 7366 B12R1.28 FCNCCc1cccc(c1)Cl 34a_100000185263_100015361967 [1,1,0,0,0,0|1,0,0]=3 7367 B12R1.28 FCNCCc1cccc(c1)F 34a_100000205154_100015361967 [1,1,0,0,0,0|1,0,0]=3 7368 B12R1.28 FCOCCc1cccc(c1)Br 34a_100011217444_100015361967 [1,1,0,0,0,0|2,0,0]=4 7369 B12R1.28 FCOCCc1cccc(c1)Br 7a_100011217444_100015361967 [1,1,0,0,0,0|2,0,0]=4 7370 B12R1.28 FCOCCc1cccc(c1)Cl 34a_100000754733_100015361967 [1,1,0,0,0,0|2,0,0]=4 7371 B12R1.28 FCOCCc1cccc(c1)Cl 7a_100000754733_100015361967 [1,1,0,0,0,0|2,0,0]=4 7372 B12R1.28 FCOCCc1cccc(c1)F 34a_100000763591_100015361967 [1,1,0,0,0,0|2,0,0]=4 7373 B12R1.28 FCOCCc1cccc(c1)F 7a_100000763591_100015361967 [1,1,0,0,0,0|2,0,0]=4 7374 B12R1.28 FCSCCc1cccc(c1)Br 62a_100011740638_100015361967 [1,1,0,0,0,0|2,0,0]=4 7375 B12R1.28 FCSCCc1cccc(c1)Br 62a_100015361967_100011740638 [1,1,0,0,0,0|2,0,0]=4 7376 B12R1.28 FCSCCc1cccc(c1)Cl 62a_100011713710_100015361967 [1,1,0,0,0,0|2,0,0]=4 7377 B12R1.28 FCSCCc1cccc(c1)Cl 62a_100015361967_100011713710 [1,1,0,0,0,0|2,0,0]=4 7378 B12R1.28 FCSCCc1cccc(c1)F 62a_100011217235_100015361967 [1,1,0,0,0,0|2,0,0]=4 7379 B12R1.28 FCSCCc1cccc(c1)F 62a_100015361967_100011217235 [1,1,0,0,0,0|2,0,0]=4 7380 B12R1.28 N#CCCSc1cccc(c1)O 62a_100011215226_100000211634 [1,1,0,0,0,0|2,0,0]=4 7381 B12R1.28 N#CCNCc1cccc(c1)O 2230a_100000743036_100011215382 [1,1,0,0,0,0|2,0,0]=4 7382 B12R1.28 N#CCSCc1cccc(c1)O 62a_100011215382_100011660834 [1,1,0,0,0,0|2,0,0]=4 7383 B12R1.28 N#CCSCc1cccc(c1)O 62a_100011660834_100011215382 [1,1,0,0,0,0|2,0,0]=4 7384 B12R1.28 NCCOCc1cccc(c1)O 34a_100000210304_100011660834 [1,1,0,0,0,0|2,0,0]=4 7385 B12R1.28 Nc1cccc(c1)CCOCF 34a_100011996697_100015361967 [1,1,0,0,0,0|2,0,0]=4 7386 B12R1.28 O=CCNCc1cccc(c1)O 2230a_100000743036_200015260668 [1,1,0,0,0,0|2,0,0]=4 7387 B12R1.28 O=CCNCc1cccc(c1)O 34a_100000743036_200009817547 [1,1,0,0,0,0|2,0,0]=4 7388 B12R1.28 O=CCSCc1cccc(c1)O 62a_100011660834_200015260668 [1,1,0,0,0,0|2,0,0]=4 7389 B12R1.28 O=CCSCc1cccc(c1)O 62a_200015260668_100011660834 [1,1,0,0,0,0|2,0,0]=4 7390 B12R1.28 OCCCNc1cccc(c1)O 34a_100000210217_100000230001 [1,1,0,0,0,0|2,0,0]=4 7391 B12R1.28 OCCCSc1cccc(c1)O 62a_100011215043_100000211634 [1,1,0,0,0,0|2,0,0]=4 7392 B12R1.28 OCCNCc1cccc(c1)O 207a_100000210304_100000188321 [1,1,0,0,0,0|2,0,0]=4 7393 B12R1.28 OCCNCc1cccc(c1)O 2230a_100000743036_100000211926 [1,1,0,0,0,0|2,0,0]=4 7394 B12R1.28 OCCNCc1cccc(c1)O 2230a_100016997473_100011660834 [1,1,0,0,0,0|2,0,0]=4 7395 B12R1.28 OCCNCc1cccc(c1)O 270004a_100000210304_100000188321 [1,1,0,0,0,0|2,0,0]=4 7396 B12R1.28 OCCNCc1cccc(c1)O 34a_100000743036_100000211926 [1,1,0,0,0,0|2,0,0]=4 7397 B12R1.28 OCCNCc1cccc(c1)O 34a_100016990907_100011660834 [1,1,0,0,0,0|2,0,0]=4 7398 B12R1.28 OCCSCc1cccc(c1)O 62a_100000211926_100011660834 [1,1,0,0,0,0|2,0,0]=4 7399 B12R1.28 OCCSCc1cccc(c1)O 62a_100011660834_100000211926 [1,1,0,0,0,0|2,0,0]=4 7400 B12R1.28 Oc1cccc(c1)CCNCF 34a_100000747277_100015361967 [1,1,0,0,0,0|0,0,0]=2 7401 B12R1.28 Oc1cccc(c1)CNCCF 2230a_100000743036_100011217306 [1,1,0,0,0,0|2,0,0]=4 7402 B12R1.28 Oc1cccc(c1)CNCCF 34a_100000724931_100011660834 [1,1,0,0,0,0|2,0,0]=4 7403 B12R1.28 Oc1cccc(c1)CNCCF 34a_100000743036_100011217306 [1,1,0,0,0,0|2,0,0]=4 7404 B12R1.28 Oc1cccc(c1)COCCBr 34a_100000211926_100011660834 [1,1,0,0,0,0|2,0,0]=4 7405 B12R1.28 Oc1cccc(c1)CSCCF 62a_100011217306_100011660834 [1,1,0,0,0,0|2,0,0]=4 7406 B12R1.28 Oc1cccc(c1)CSCCF 62a_100011660834_100011217306 [1,1,0,0,0,0|2,0,0]=4 7407 B12R1.28 Oc1cccc(c1)NCCCF 34a_100000210217_100011934791 [1,1,0,0,0,0|2,0,0]=4 7408 B12R1.28 Oc1cccc(c1)SCCCF 62a_100011934791_100000211634 [1,1,0,0,0,0|2,0,0]=4 7409 B12R1.28 [13CH3]NCCCc1cccc(c1)Br 2230a_100000753791_200025704644 [1,1,0,0,0,0|1,0,0]=3 7410 B12R1.28 [13CH3]NCCCc1cccc(c1)Br 34a_100000753791_200025704644 [1,1,0,0,0,0|1,0,0]=3 7411 B12R1.28 [13CH3]NCCCc1cccc(c1)Cl 2230a_100000704586_200025704644 [1,1,0,0,0,0|1,0,0]=3 7412 B12R1.28 [13CH3]NCCCc1cccc(c1)Cl 34a_100000704586_200025704644 [1,1,0,0,0,0|1,0,0]=3 7413 B12R1.28 [13CH3]NCCCc1cccc(c1)F 2230a_100000754185_200025704644 [1,1,0,0,0,0|1,0,0]=3 7414 B12R1.28 [13CH3]NCCCc1cccc(c1)F 34a_100000754185_200025704644 [1,1,0,0,0,0|1,0,0]=3 7415 B12R1.28 [13CH3]NCCOc1cccc(c1)Br 2230a_100000743521_200025704644 [1,1,0,0,0,0|1,0,0]=3 7416 B12R1.28 [13CH3]NCCOc1cccc(c1)Br 34a_100000743521_200025704644 [1,1,0,0,0,0|1,0,0]=3 7417 B12R1.28 [13CH3]NCCOc1cccc(c1)Cl 2230a_100000740232_200025704644 [1,1,0,0,0,0|1,0,0]=3 7418 B12R1.28 [13CH3]NCCOc1cccc(c1)Cl 34a_100000740232_200025704644 [1,1,0,0,0,0|1,0,0]=3 7419 B12R1.28 [13CH3]NCCOc1cccc(c1)F 2230a_100000738948_200025704644 [1,1,0,0,0,0|1,0,0]=3 7420 B12R1.28 [13CH3]NCCOc1cccc(c1)F 34a_100000738948_200025704644 [1,1,0,0,0,0|1,0,0]=3 7421 B12R1.28 [13CH3]OCCCc1cccc(c1)Br 34a_100011709248_200025704644 [1,1,0,0,0,0|2,0,0]=4 7422 B12R1.28 [13CH3]OCCCc1cccc(c1)Br 7a_100011709248_200025704644 [1,1,0,0,0,0|2,0,0]=4 7423 B12R1.28 [13CH3]OCCCc1cccc(c1)Cl 34a_100011709246_200025704644 [1,1,0,0,0,0|2,0,0]=4 7424 B12R1.28 [13CH3]OCCCc1cccc(c1)Cl 7a_100011709246_200025704644 [1,1,0,0,0,0|2,0,0]=4 7425 B12R1.28 [13CH3]OCCCc1cccc(c1)N 34a_200000698965_200025704644 [1,1,0,0,0,0|2,0,0]=4 7426 B12R1.28 [13CH3]OCCCc1cccc(c1)N 7a_200000698965_200025704644 [1,1,0,0,0,0|2,0,0]=4 7427 B12R1.28 [13CH3]OCCOc1cccc(c1)Br 34a_100000757546_200025704644 [1,1,0,0,0,0|2,0,0]=4 7428 B12R1.28 [13CH3]OCCOc1cccc(c1)Br 7a_100000757546_200025704644 [1,1,0,0,0,0|2,0,0]=4 7429 B12R1.28 [13CH3]OCCOc1cccc(c1)Cl 34a_100000230539_200025704644 [1,1,0,0,0,0|2,0,0]=4 7430 B12R1.28 [13CH3]OCCOc1cccc(c1)Cl 7a_100000230539_200025704644 [1,1,0,0,0,0|2,0,0]=4 7431 B12R1.28 [13CH3]OCCOc1cccc(c1)N 34a_100011232151_200025704644 [1,1,0,0,0,0|2,0,0]=4 7432 B12R1.28 [13CH3]OCCSc1cccc(c1)Br 7a_200011756134_200025704644 [1,1,0,0,0,0|2,0,0]=4 7433 B12R1.28 [13CH3]OCCSc1cccc(c1)Cl 34a_200011721761_200025704644 [1,1,0,0,0,0|2,0,0]=4 7434 B12R1.28 [13CH3]OCCSc1cccc(c1)Cl 7a_200011721761_200025704644 [1,1,0,0,0,0|2,0,0]=4 7435 B12R1.28 [13CH3]OCCSc1cccc(c1)F 34a_200011996949_200025704644 [1,1,0,0,0,0|2,0,0]=4 7436 B12R1.28 [13CH3]OCCSc1cccc(c1)F 7a_200011996949_200025704644 [1,1,0,0,0,0|2,0,0]=4 7437 B12R1.28 [13CH3]SCCCc1cccc(c1)Br 62a_100011713683_200025704644 [1,1,0,0,0,0|2,0,0]=4 7438 B12R1.28 [13CH3]SCCCc1cccc(c1)Br 62a_200025704644_100011713683 [1,1,0,0,0,0|2,0,0]=4 7439 B12R1.28 [13CH3]SCCCc1cccc(c1)F 62a_200000698031_200025704644 [1,1,0,0,0,0|2,0,0]=4 7440 B12R1.28 [13CH3]SCCCc1cccc(c1)F 62a_200025704644_200000698031 [1,1,0,0,0,0|2,0,0]=4 7441 B12R1.28 [13CH3]SCCOc1cccc(c1)Br 62a_100000183150_200025704644 [1,1,0,0,0,0|2,0,0]=4 7442 B12R1.28 [13CH3]SCCOc1cccc(c1)Br 62a_200025704644_100000183150 [1,1,0,0,0,0|2,0,0]=4 7443 B12R1.28 [13CH3]SCCOc1cccc(c1)Cl 62a_100000181161_200025704644 [1,1,0,0,0,0|2,0,0]=4 7444 B12R1.28 [13CH3]SCCOc1cccc(c1)Cl 62a_200025704644_100000181161 [1,1,0,0,0,0|2,0,0]=4 7445 B12R1.28 [13CH3]SCCOc1cccc(c1)F 62a_100000739188_200025704644 [1,1,0,0,0,0|2,0,0]=4 7446 B12R1.28 [13CH3]SCCOc1cccc(c1)F 62a_200025704644_100000739188 [1,1,0,0,0,0|2,0,0]=4 7447 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000210414_100011660834 [1,1,0,0,0,0|1,0,1]=4 7448 B12R1.50 CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210202 [1,1,0,0,0,0|1,0,1]=4 7449 B12R1.50 CCC(C)Nc1cccc(c1)O 34a_100000210217_100011215416 [1,1,0,0,0,0|2,0,0]=4 7450 B12R1.50 CCC(C)Oc1cccc(c1)O 271570a_203496583355_200011236628 [1,1,0,0,0,0|2,0,0]=4 7451 B12R1.50 CCC(C)Sc1cccc(c1)O 62a_100000758301_100000211634 [1,1,0,0,0,0|2,0,0]=4 7452 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000201218_200000210301 [1,1,0,0,0,0|2,0,0]=4 7453 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000207540_100000210202 [1,1,0,0,0,0|2,0,0]=4 7454 B12R1.50 CCN(C)Cc1cccc(c1)O 2230a_100000225621_100011660834 [1,1,0,0,0,0|2,0,0]=4 7455 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000201218_200000210301 [1,1,0,0,0,0|2,0,0]=4 7456 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000204670 [1,1,0,0,0,0|2,0,0]=4 7457 B12R1.50 CCN(C)Cc1cccc(c1)O 269982a_100000225621_100000084143 [1,1,0,0,0,0|2,0,0]=4 7458 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 2230a_100000201218_200025704644 [1,1,0,0,0,0|2,0,0]=4 7459 B12R1.50 CCN([13CH3])Cc1cccc(c1)O 269982a_100000201218_200025704644 [1,1,0,0,0,0|2,0,0]=4 7460 B12R1.50 CNC(=O)Cc1cccc(c1)Br 11a_106832991635_100000747190 [1,1,0,0,0,0|1,0,1]=4 7461 B12R1.50 CNC(=O)Cc1cccc(c1)Br 240690a_100102657272_100000747190 [1,1,0,0,0,0|1,0,1]=4 7462 B12R1.50 CNC(=O)Cc1cccc(c1)Br 527a_100102657272_100000747190 [1,1,0,0,0,0|1,0,1]=4 7463 B12R1.50 CNC(=O)Cc1cccc(c1)C 11a_106832991635_100011206899 [1,1,0,0,0,0|1,0,1]=4 7464 B12R1.50 CNC(=O)Cc1cccc(c1)C 1626a_100102657272_100011206899 [1,1,0,0,0,0|1,0,1]=4 7465 B12R1.50 CNC(=O)Cc1cccc(c1)C 240690a_100102657272_100011206899 [1,1,0,0,0,0|1,0,1]=4 7466 B12R1.50 CNC(=O)Cc1cccc(c1)C 527a_100102657272_100011206899 [1,1,0,0,0,0|1,0,1]=4 7467 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 11a_106832991635_100000749307 [1,1,0,0,0,0|1,0,1]=4 7468 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 1626a_100102657272_100000749307 [1,1,0,0,0,0|1,0,1]=4 7469 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 240690a_100102657272_100000749307 [1,1,0,0,0,0|1,0,1]=4 7470 B12R1.50 CNC(=O)Cc1cccc(c1)Cl 527a_100102657272_100000749307 [1,1,0,0,0,0|1,0,1]=4 7471 B12R1.50 CNC(=O)Cc1cccc(c1)F 11a_106832991635_100000211661 [1,1,0,0,0,0|1,0,1]=4 7472 B12R1.50 CNC(=O)Cc1cccc(c1)F 1626a_100102657272_100000211661 [1,1,0,0,0,0|1,0,1]=4 7473 B12R1.50 CNC(=O)Cc1cccc(c1)F 240690a_100102657272_100000211661 [1,1,0,0,0,0|1,0,1]=4 7474 B12R1.50 CNC(=O)Cc1cccc(c1)F 527a_100102657272_100000211661 [1,1,0,0,0,0|1,0,1]=4 7475 B12R1.50 CNC(=O)Cc1cccc(c1)I 11a_106832991635_100000238430 [1,1,0,0,0,0|1,0,1]=4 7476 B12R1.50 CNC(=O)Cc1cccc(c1)I 1626a_100102657272_100000238430 [1,1,0,0,0,0|1,0,1]=4 7477 B12R1.50 CNC(=O)Cc1cccc(c1)I 240690a_100102657272_100000238430 [1,1,0,0,0,0|1,0,1]=4 7478 B12R1.50 CNC(=O)Cc1cccc(c1)I 527a_100102657272_100000238430 [1,1,0,0,0,0|1,0,1]=4 7479 B12R1.50 CNC(=O)Cc1cccc(c1)O 240690a_100102657272_100000745134 [1,1,0,0,0,0|0,0,1]=3 7480 B12R1.50 CNC(=O)Cc1cccc(c1)O 527a_100102657272_100000745134 [1,1,0,0,0,0|0,0,1]=3 7481 B12R1.50 CNC(=O)Nc1cccc(c1)O 2430a_100000210217_100102657272 [1,1,0,0,0,0|1,0,1]=4 7482 B12R1.50 CNC(=O)Nc1cccc(c1)O 512a_100000210217_100102657272 [1,1,0,0,0,0|1,0,1]=4 7483 B12R1.50 CNC(C)Cc1cc(ccn1)C 270004a_106832991635_200015184229 [1,1,0,0,0,0|2,0,0]=4 7484 B12R1.50 CNC(C)Cc1cccc(c1)Br 270004a_106832991635_100000689217 [1,1,0,0,0,0|1,0,0]=3 7485 B12R1.50 CNC(C)Cc1cccc(c1)Cl 270004a_106832991635_100000727212 [1,1,0,0,0,0|1,0,0]=3 7486 B12R1.50 CNC(C)Cc1cccc(c1)F 270004a_106832991635_100000687711 [1,1,0,0,0,0|1,0,0]=3 7487 B12R1.50 COC(=O)Cc1cccc(c1)O 271570a_203496583355_100000699549 [1,1,0,0,0,0|1,0,1]=4 7488 B12R1.50 COC(C)Sc1cccc(c1)O 62a_100009879195_100000211634 [1,1,0,0,0,0|2,0,0]=4 7489 B12R1.50 NC(CO)Cc1cccc(c1)O 271570a_203496583355_114802770106 [1,1,0,0,0,0|2,0,0]=4 7490 B12R1.100 CCCCc1cc(cc(c1)Br)Br 271570a_100020621405_100009814770 [1,1,0,0,0,0|2,0,0]=4 7491 B12R1.100 CCCCc1cc(cc(c1)Br)Cl 271570a_100020621405_100009814755 [1,1,0,0,0,0|2,0,0]=4 7492 B12R1.100 CCCCc1cc(cc(c1)Br)F 271570a_100020621405_100009814764 [1,1,0,0,0,0|2,0,0]=4 7493 B12R1.100 CCCCc1cc(cc(c1)Br)N 271570a_100020621405_100009814763 [1,1,0,0,0,0|2,0,0]=4 7494 B12R1.100 CCCCc1cc(cc(c1)Br)O 271570a_100020621405_100010068917 [1,1,0,0,0,0|1,0,0]=3 7495 B12R1.100 CCCCc1cc(cc(c1)C)C 271570a_100020621405_100011215608 [1,1,0,0,0,0|2,0,0]=4 7496 B12R1.100 CCCCc1cc(cc(c1)Cl)C 271570a_100020621405_100010172791 [1,1,0,0,0,0|2,0,0]=4 7497 B12R1.100 CCCCc1cc(cc(c1)Cl)Cl 271570a_100020621405_100000747138 [1,1,0,0,0,0|2,0,0]=4 7498 B12R1.100 CCCCc1cc(cc(c1)Cl)F 271570a_100020621405_100013859453 [1,1,0,0,0,0|2,0,0]=4 7499 B12R1.100 CCCCc1cc(cc(c1)Cl)N 271570a_100020621405_100010147676 [1,1,0,0,0,0|2,0,0]=4 7500 B12R1.100 CCCCc1cc(cc(c1)Cl)O 271570a_100020621405_100010068924 [1,1,0,0,0,0|1,0,0]=3 7501 B12R1.100 CCCCc1cc(cc(c1)F)C 271570a_100020621405_100011356977 [1,1,0,0,0,0|2,0,0]=4 7502 B12R1.100 CCCCc1cc(cc(c1)F)F 271570a_100020621405_100011218498 [1,1,0,0,0,0|2,0,0]=4 7503 B12R1.100 CCCCc1cc(cc(c1)F)N 271570a_100020621405_100011356972 [1,1,0,0,0,0|2,0,0]=4 7504 B12R1.100 CCCCc1cc(cc(c1)F)O 271570a_100020621405_100000717995 [1,1,0,0,0,0|1,0,0]=3 7505 B12R1.100 CCCCc1cc(cc(c1)N)C 271570a_100020621405_100000695972 [1,1,0,0,0,0|2,0,0]=4 7506 B12R1.100 CCCCc1cc(cc(c1)N)N 271570a_100020621405_100011999608 [1,1,0,0,0,0|2,0,0]=4 7507 B12R1.100 CCCCc1cc(cc(c1)O)C 271570a_100020621405_100011999630 [1,1,0,0,0,0|1,0,0]=3 7508 B12R1.100 CCCCc1cc(cc(c1)O)O 271570a_100020621405_100009868816 [1,1,0,0,0,0|1,0,0]=3 7509 B12R1.100 CCCNc1cc(cc(c1)Cl)O 34a_100000123917_100000210303 [1,1,0,0,0,0|2,0,0]=4 7510 B12R1.100 CCCNc1cc(cc(c1)Cl)O 7a_100000123917_100000210303 [1,1,0,0,0,0|2,0,0]=4 7511 B12R1.100 CCCNc1cc(cc(c1)O)C 34a_100011995906_100000210303 [1,1,0,0,0,0|2,0,0]=4 7512 B12R1.100 CCCNc1cc(cc(c1)O)C 7a_100011995906_100000210303 [1,1,0,0,0,0|2,0,0]=4 7513 B12R1.100 CCCNc1cc(cc(c1)O)O 34a_100000043371_100000210303 [1,1,0,0,0,0|2,0,0]=4 7514 B12R1.100 CCCSc1cc(cc(c1)Br)O 62a_100000210303_100010068917 [1,1,0,0,0,0|2,0,0]=4 7515 B12R1.100 CCCSc1cc(cc(c1)Br)O 62a_100010068917_100000210303 [1,1,0,0,0,0|2,0,0]=4 7516 B12R1.100 CCCSc1cc(cc(c1)Cl)O 62a_100000210303_100010068924 [1,1,0,0,0,0|2,0,0]=4 7517 B12R1.100 CCCSc1cc(cc(c1)Cl)O 62a_100010068924_100000210303 [1,1,0,0,0,0|2,0,0]=4 7518 B12R1.100 CCCSc1cc(cc(c1)F)O 62a_100000210303_100000688818 [1,1,0,0,0,0|2,0,0]=4 7519 B12R1.100 CCCSc1cc(cc(c1)F)O 62a_100000688818_100000210303 [1,1,0,0,0,0|2,0,0]=4 7520 B12R1.100 CCCSc1cc(cc(c1)O)C 62a_100000210303_100011999630 [1,1,0,0,0,0|2,0,0]=4 7521 B12R1.100 CCCSc1cc(cc(c1)O)O 62a_100000210303_100009868816 [1,1,0,0,0,0|2,0,0]=4 7522 B12R1.100 CCNCc1cc(cc(c1)Br)O 207a_100015525214_100010176088 [1,1,0,0,0,0|2,0,0]=4 7523 B12R1.100 CCNCc1cc(cc(c1)Br)O 270004a_100015525214_100010176088 [1,1,0,0,0,0|2,0,0]=4 7524 B12R1.100 CCNCc1cc(cc(c1)Cl)O 207a_100015525214_100000050827 [1,1,0,0,0,0|2,0,0]=4 7525 B12R1.100 CCNCc1cc(cc(c1)Cl)O 2230a_107254831445_100000210202 [1,1,0,0,0,0|2,0,0]=4 7526 B12R1.100 CCNCc1cc(cc(c1)Cl)O 270004a_100015525214_100000050827 [1,1,0,0,0,0|2,0,0]=4 7527 B12R1.100 CCNCc1cc(cc(c1)Cl)O 34a_107254831445_100000210202 [1,1,0,0,0,0|2,0,0]=4 7528 B12R1.100 CCNCc1cc(cc(c1)F)O 207a_100015525214_100000703664 [1,1,0,0,0,0|2,0,0]=4 7529 B12R1.100 CCNCc1cc(cc(c1)F)O 2230a_100160469513_100000210202 [1,1,0,0,0,0|2,0,0]=4 7530 B12R1.100 CCNCc1cc(cc(c1)F)O 270004a_100015525214_100000703664 [1,1,0,0,0,0|2,0,0]=4 7531 B12R1.100 CCNCc1cc(cc(c1)F)O 34a_100160469513_100000210202 [1,1,0,0,0,0|2,0,0]=4 7532 B12R1.100 CCNCc1cc(cc(c1)O)C 207a_100015525214_100009853434 [1,1,0,0,0,0|2,0,0]=4 7533 B12R1.100 CCNCc1cc(cc(c1)O)C 270004a_100015525214_100009853434 [1,1,0,0,0,0|2,0,0]=4 7534 B12R1.100 CCNCc1cc(cc(c1)O)O 207a_100015525214_100000043415 [1,1,0,0,0,0|2,0,0]=4 7535 B12R1.100 CCNCc1cc(cc(c1)O)O 2230a_100159270720_100000210202 [1,1,0,0,0,0|2,0,0]=4 7536 B12R1.100 CCNCc1cc(cc(c1)O)O 34a_100159270720_100000210202 [1,1,0,0,0,0|2,0,0]=4 7537 B12R1.100 CNCCc1cc(cc(c1)Cl)Cl 2230a_100000746052_200000210301 [1,1,0,0,0,0|1,0,0]=3 7538 B12R1.100 CNCCc1cc(cc(c1)Cl)Cl 2230a_106832991635_100000691793 [1,1,0,0,0,0|1,0,0]=3 7539 B12R1.100 CNCCc1cc(cc(c1)Cl)Cl 34a_100000746052_200000210301 [1,1,0,0,0,0|1,0,0]=3 7540 B12R1.100 CNCCc1cc(cc(c1)Cl)Cl 34a_100102657272_100000691793 [1,1,0,0,0,0|1,0,0]=3 7541 B12R1.100 CNCCc1cc(cc(c1)Cl)Cl 7a_106832991635_100000691793 [1,1,0,0,0,0|1,0,0]=3 7542 B12R1.100 CNCCc1cc(cc(c1)F)F 2230a_100000748410_200000210301 [1,1,0,0,0,0|1,0,0]=3 7543 B12R1.100 CNCCc1cc(cc(c1)F)F 2230a_106832991635_100011754442 [1,1,0,0,0,0|1,0,0]=3 7544 B12R1.100 CNCCc1cc(cc(c1)F)F 34a_100000748410_200000210301 [1,1,0,0,0,0|1,0,0]=3 7545 B12R1.100 CNCCc1cc(cc(c1)F)F 34a_100102657272_100011754442 [1,1,0,0,0,0|1,0,0]=3 7546 B12R1.100 CNCCc1cc(cc(c1)F)F 7a_106832991635_100011754442 [1,1,0,0,0,0|1,0,0]=3 7547 B12R1.100 COCCc1cc(cc(c1)Br)Br 34a_100010243668_200000210301 [1,1,0,0,0,0|2,0,0]=4 7548 B12R1.100 COCCc1cc(cc(c1)Br)Br 7a_100010243668_200000210301 [1,1,0,0,0,0|2,0,0]=4 7549 B12R1.100 COCCc1cc(cc(c1)Br)F 34a_100012630564_200000210301 [1,1,0,0,0,0|2,0,0]=4 7550 B12R1.100 COCCc1cc(cc(c1)Br)F 7a_100012630564_200000210301 [1,1,0,0,0,0|2,0,0]=4 7551 B12R1.100 COCCc1cc(cc(c1)Cl)Cl 34a_100000720051_200000210301 [1,1,0,0,0,0|2,0,0]=4 7552 B12R1.100 COCCc1cc(cc(c1)Cl)Cl 34a_100138415774_100000691793 [1,1,0,0,0,0|2,0,0]=4 7553 B12R1.100 COCCc1cc(cc(c1)Cl)Cl 7a_100000720051_200000210301 [1,1,0,0,0,0|2,0,0]=4 7554 B12R1.100 COCCc1cc(cc(c1)F)F 34a_100011754358_200000210301 [1,1,0,0,0,0|2,0,0]=4 7555 B12R1.100 COCCc1cc(cc(c1)F)F 34a_100138415774_100011754442 [1,1,0,0,0,0|2,0,0]=4 7556 B12R1.100 COCCc1cc(cc(c1)F)F 7a_100011754358_200000210301 [1,1,0,0,0,0|2,0,0]=4 7557 B12R1.100 COCSc1cc(cc(c1)Br)O 62a_100000766300_100010068917 [1,1,0,0,0,0|2,0,0]=4 7558 B12R1.100 COCSc1cc(cc(c1)Br)O 62a_100010068917_100000766300 [1,1,0,0,0,0|2,0,0]=4 7559 B12R1.100 COCSc1cc(cc(c1)Cl)O 62a_100000766300_100010068924 [1,1,0,0,0,0|2,0,0]=4 7560 B12R1.100 COCSc1cc(cc(c1)Cl)O 62a_100010068924_100000766300 [1,1,0,0,0,0|2,0,0]=4 7561 B12R1.100 COCSc1cc(cc(c1)F)O 62a_100000688818_100000766300 [1,1,0,0,0,0|2,0,0]=4 7562 B12R1.100 COCSc1cc(cc(c1)F)O 62a_100000766300_100000688818 [1,1,0,0,0,0|2,0,0]=4 7563 B12R1.100 COCSc1cc(cc(c1)O)C 62a_100000766300_100011999630 [1,1,0,0,0,0|2,0,0]=4 7564 B12R1.100 COCSc1cc(cc(c1)O)O 62a_100000766300_100009868816 [1,1,0,0,0,0|2,0,0]=4 7565 B12R1.100 CSCCc1cc(cc(c1)Cl)Cl 62a_100000691793_200000210301 [1,1,0,0,0,0|2,0,0]=4 7566 B12R1.100 CSCCc1cc(cc(c1)Cl)Cl 62a_200000210301_100000691793 [1,1,0,0,0,0|2,0,0]=4 7567 B12R1.100 CSCCc1cc(cc(c1)F)F 62a_100011754442_200000210301 [1,1,0,0,0,0|2,0,0]=4 7568 B12R1.100 CSCCc1cc(cc(c1)F)F 62a_200000210301_100011754442 [1,1,0,0,0,0|2,0,0]=4 7569 B12R1.100 CSCNc1cc(cc(c1)Cl)O 34a_100000123917_100011218213 [1,1,0,0,0,0|2,0,0]=4 7570 B12R1.100 CSCNc1cc(cc(c1)O)C 34a_100011995906_100011218213 [1,1,0,0,0,0|2,0,0]=4 7571 B12R1.100 CSCNc1cc(cc(c1)O)O 34a_100000043371_100011218213 [1,1,0,0,0,0|2,0,0]=4 7572 B12R1.100 CSCSc1cc(cc(c1)Br)O 62a_100010068917_100011218213 [1,1,0,0,0,0|2,0,0]=4 7573 B12R1.100 CSCSc1cc(cc(c1)Br)O 62a_100011218213_100010068917 [1,1,0,0,0,0|2,0,0]=4 7574 B12R1.100 CSCSc1cc(cc(c1)Cl)O 62a_100010068924_100011218213 [1,1,0,0,0,0|2,0,0]=4 7575 B12R1.100 CSCSc1cc(cc(c1)Cl)O 62a_100011218213_100010068924 [1,1,0,0,0,0|2,0,0]=4 7576 B12R1.100 CSCSc1cc(cc(c1)F)O 62a_100000688818_100011218213 [1,1,0,0,0,0|2,0,0]=4 7577 B12R1.100 CSCSc1cc(cc(c1)F)O 62a_100011218213_100000688818 [1,1,0,0,0,0|2,0,0]=4 7578 B12R1.100 CSCSc1cc(cc(c1)O)C 62a_100011218213_100011999630 [1,1,0,0,0,0|2,0,0]=4 7579 B12R1.100 CSCSc1cc(cc(c1)O)O 62a_100011218213_100009868816 [1,1,0,0,0,0|2,0,0]=4 7580 B12R1.100 [13CH3]NCCc1cc(cc(c1)Cl)Cl 2230a_100000746052_200025704644 [1,1,0,0,0,0|1,0,0]=3 7581 B12R1.100 [13CH3]NCCc1cc(cc(c1)Cl)Cl 34a_100000746052_200025704644 [1,1,0,0,0,0|1,0,0]=3 7582 B12R1.100 [13CH3]NCCc1cc(cc(c1)F)F 2230a_100000748410_200025704644 [1,1,0,0,0,0|1,0,0]=3 7583 B12R1.100 [13CH3]NCCc1cc(cc(c1)F)F 34a_100000748410_200025704644 [1,1,0,0,0,0|1,0,0]=3 7584 B12R1.100 [13CH3]OCCc1cc(cc(c1)Br)Br 34a_100010243668_200025704644 [1,1,0,0,0,0|2,0,0]=4 7585 B12R1.100 [13CH3]OCCc1cc(cc(c1)Br)Br 7a_100010243668_200025704644 [1,1,0,0,0,0|2,0,0]=4 7586 B12R1.100 [13CH3]OCCc1cc(cc(c1)Br)F 34a_100012630564_200025704644 [1,1,0,0,0,0|2,0,0]=4 7587 B12R1.100 [13CH3]OCCc1cc(cc(c1)Br)F 7a_100012630564_200025704644 [1,1,0,0,0,0|2,0,0]=4 7588 B12R1.100 [13CH3]OCCc1cc(cc(c1)Cl)Cl 34a_100000720051_200025704644 [1,1,0,0,0,0|2,0,0]=4 7589 B12R1.100 [13CH3]OCCc1cc(cc(c1)Cl)Cl 7a_100000720051_200025704644 [1,1,0,0,0,0|2,0,0]=4 7590 B12R1.100 [13CH3]OCCc1cc(cc(c1)F)F 34a_100011754358_200025704644 [1,1,0,0,0,0|2,0,0]=4 7591 B12R1.100 [13CH3]OCCc1cc(cc(c1)F)F 7a_100011754358_200025704644 [1,1,0,0,0,0|2,0,0]=4 7592 B12R1.100 [13CH3]SCCc1cc(cc(c1)Cl)Cl 62a_100000691793_200025704644 [1,1,0,0,0,0|2,0,0]=4 7593 B12R1.100 [13CH3]SCCc1cc(cc(c1)Cl)Cl 62a_200025704644_100000691793 [1,1,0,0,0,0|2,0,0]=4 7594 B12R1.100 [13CH3]SCCc1cc(cc(c1)F)F 62a_100011754442_200025704644 [1,1,0,0,0,0|2,0,0]=4 7595 B12R1.100 [13CH3]SCCc1cc(cc(c1)F)F 62a_200025704644_100011754442 [1,1,0,0,0,0|2,0,0]=4 7596 B12R1.226 C=C(C)CNc1cccc(c1)O 34a_100000210217_100000748629 [1,1,0,0,0,0|2,0,0]=4 7597 B12R1.226 C=C(C)CSc1cccc(c1)O 62a_100000748629_100000211634 [1,1,0,0,0,0|2,0,0]=4 7598 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000070787_100011740638 [1,1,0,0,0,0|2,0,0]=4 7599 B12R1.226 CC(=O)CCc1cccc(c1)Br 1458a_100000184314_200000210301 [1,1,0,0,0,0|2,0,0]=4 7600 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000070787_100011713685 [1,1,0,0,0,0|2,0,0]=4 7601 B12R1.226 CC(=O)CCc1cccc(c1)C 1458a_100000234952_200000210301 [1,1,0,0,0,0|2,0,0]=4 7602 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000070787_100011713710 [1,1,0,0,0,0|2,0,0]=4 7603 B12R1.226 CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_200000210301 [1,1,0,0,0,0|2,0,0]=4 7604 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000070787_100011217235 [1,1,0,0,0,0|2,0,0]=4 7605 B12R1.226 CC(=O)CCc1cccc(c1)F 1458a_100000235673_200000210301 [1,1,0,0,0,0|2,0,0]=4 7606 B12R1.226 CC(=O)CCc1cccc(c1)I 1458a_100010007846_200000210301 [1,1,0,0,0,0|2,0,0]=4 7607 B12R1.226 CC(=O)CCc1cccc(c1)O 1458a_100011216126_200000210301 [1,1,0,0,0,0|1,0,0]=3 7608 B12R1.226 CC(=O)CCc1cccc(c1)O 271570a_203496583355_100011279149 [1,1,0,0,0,0|1,0,0]=3 7609 B12R1.226 CC(=O)NCc1cccc(c1)O 240690a_100000743036_100015343762 [1,1,0,0,0,0|2,0,0]=4 7610 B12R1.226 CC(=O)NCc1cccc(c1)O 271570a_203496583355_100000766983 [1,1,0,0,0,0|2,0,0]=4 7611 B12R1.226 CC(=O)NCc1cccc(c1)O 527a_100000743036_100103153847 [1,1,0,0,0,0|2,0,0]=4 7612 B12R1.226 CC(C)CNc1cccc(c1)O 34a_100000210217_100000210624 [1,1,0,0,0,0|2,0,0]=4 7613 B12R1.226 CC(C)COc1cccc(c1)O 271570a_203496583355_200000170005 [1,1,0,0,0,0|2,0,0]=4 7614 B12R1.226 CC(C)CSc1cccc(c1)O 62a_100000210624_100000211634 [1,1,0,0,0,0|2,0,0]=4 7615 B12R1.226 CC(C)NCc1cccc(c1)O 207a_100138425928_100000188321 [1,1,0,0,0,0|2,0,0]=4 7616 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100000743036_100000210206 [1,1,0,0,0,0|2,0,0]=4 7617 B12R1.226 CC(C)NCc1cccc(c1)O 2230a_100138425928_100011660834 [1,1,0,0,0,0|2,0,0]=4 7618 B12R1.226 CC(C)NCc1cccc(c1)O 271570a_203496583355_100000195767 [1,1,0,0,0,0|2,0,0]=4 7619 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100000743036_100000210206 [1,1,0,0,0,0|2,0,0]=4 7620 B12R1.226 CC(C)NCc1cccc(c1)O 34a_100138425928_100011660834 [1,1,0,0,0,0|2,0,0]=4 7621 B12R1.226 CC(C)OCc1cccc(c1)O 34a_100000212225_100011660834 [1,1,0,0,0,0|2,0,0]=4 7622 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100000210206_100011660834 [1,1,0,0,0,0|2,0,0]=4 7623 B12R1.226 CC(C)SCc1cccc(c1)O 62a_100011660834_100000210206 [1,1,0,0,0,0|2,0,0]=4 7624 B12R1.226 CC(O)CNc1cccc(c1)O 34a_100000210217_100011218427 [1,1,0,0,0,0|2,0,0]=4 7625 B12R1.226 CC(O)CSc1cccc(c1)O 62a_100011218427_100000211634 [1,1,0,0,0,0|2,0,0]=4 7626 B12R1.226 CN(C)CCc1cccc(c1)Br 2230a_100102631434_100011740638 [1,1,0,0,0,0|1,0,0]=3 7627 B12R1.226 CN(C)CCc1cccc(c1)Br 269982a_100102631434_100011740638 [1,1,0,0,0,0|1,0,0]=3 7628 B12R1.226 CN(C)CCc1cccc(c1)Cl 2230a_100102631434_100011713710 [1,1,0,0,0,0|1,0,0]=3 7629 B12R1.226 CN(C)CCc1cccc(c1)Cl 2230a_106726388433_200000210301 [1,1,0,0,0,0|1,0,0]=3 7630 B12R1.226 CN(C)CCc1cccc(c1)Cl 269982a_100102631434_100011713710 [1,1,0,0,0,0|1,0,0]=3 7631 B12R1.226 CN(C)CCc1cccc(c1)Cl 269982a_106726388433_200000210301 [1,1,0,0,0,0|1,0,0]=3 7632 B12R1.226 CN(C)CCc1cccc(c1)Cl 34a_106726388433_200000210301 [1,1,0,0,0,0|1,0,0]=3 7633 B12R1.226 CN(C)CCc1cccc(c1)F 2230a_100102631434_100011217235 [1,1,0,0,0,0|1,0,0]=3 7634 B12R1.226 CN(C)CCc1cccc(c1)F 2230a_106726388868_200000210301 [1,1,0,0,0,0|1,0,0]=3 7635 B12R1.226 CN(C)CCc1cccc(c1)F 269982a_100102631434_100011217235 [1,1,0,0,0,0|1,0,0]=3 7636 B12R1.226 CN(C)CCc1cccc(c1)F 269982a_106726388868_200000210301 [1,1,0,0,0,0|1,0,0]=3 7637 B12R1.226 CN(C)CCc1cccc(c1)F 34a_106726388868_200000210301 [1,1,0,0,0,0|1,0,0]=3 7638 B12R1.226 CN([13CH3])CCc1cccc(c1)Cl 2230a_106726388433_200025704644 [1,1,0,0,0,0|1,0,0]=3 7639 B12R1.226 CN([13CH3])CCc1cccc(c1)Cl 269982a_106726388433_200025704644 [1,1,0,0,0,0|1,0,0]=3 7640 B12R1.226 CN([13CH3])CCc1cccc(c1)Cl 34a_106726388433_200025704644 [1,1,0,0,0,0|1,0,0]=3 7641 B12R1.226 CN([13CH3])CCc1cccc(c1)F 2230a_106726388868_200025704644 [1,1,0,0,0,0|1,0,0]=3 7642 B12R1.226 CN([13CH3])CCc1cccc(c1)F 269982a_106726388868_200025704644 [1,1,0,0,0,0|1,0,0]=3 7643 B12R1.226 CN([13CH3])CCc1cccc(c1)F 34a_106726388868_200025704644 [1,1,0,0,0,0|1,0,0]=3 7644 B12R1.226 C[C@@H](O)CNc1cccc(c1)O 34a_100000210217_100009817552 [1,1,0,0,0,0|2,0,0]=4 7645 B12R1.226 C[C@@H](O)CSc1cccc(c1)O 62a_100009817552_100000211634 [1,1,0,0,0,0|2,0,0]=4 7646 B12R1.226 Cc1cccc(c1)CCC(=O)[13CH3] 1458a_100000234952_200025704644 [1,1,0,0,0,0|2,0,0]=4 7647 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_100102631434_100011713685 [1,1,0,0,0,0|1,0,0]=3 7648 B12R1.226 Cc1cccc(c1)CCN(C)C 2230a_114849113767_200000210301 [1,1,0,0,0,0|1,0,0]=3 7649 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_100102631434_100011713685 [1,1,0,0,0,0|1,0,0]=3 7650 B12R1.226 Cc1cccc(c1)CCN(C)C 269982a_114849113767_200000210301 [1,1,0,0,0,0|1,0,0]=3 7651 B12R1.226 Cc1cccc(c1)CCN(C)C 34a_114849113767_200000210301 [1,1,0,0,0,0|1,0,0]=3 7652 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 2230a_114849113767_200025704644 [1,1,0,0,0,0|1,0,0]=3 7653 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 269982a_114849113767_200025704644 [1,1,0,0,0,0|1,0,0]=3 7654 B12R1.226 Cc1cccc(c1)CCN(C)[13CH3] 34a_114849113767_200025704644 [1,1,0,0,0,0|1,0,0]=3 7655 B12R1.226 NC(=O)CCc1cccc(c1)O 271570a_203496583355_100000162029 [1,1,0,0,0,0|2,0,0]=4 7656 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Br 1458a_100000184314_200025704644 [1,1,0,0,0,0|2,0,0]=4 7657 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)Cl 1458a_100000235675_200025704644 [1,1,0,0,0,0|2,0,0]=4 7658 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)F 1458a_100000235673_200025704644 [1,1,0,0,0,0|2,0,0]=4 7659 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)I 1458a_100010007846_200025704644 [1,1,0,0,0,0|2,0,0]=4 7660 B12R1.226 [13CH3]C(=O)CCc1cccc(c1)O 1458a_100011216126_200025704644 [1,1,0,0,0,0|1,0,0]=3 7661 B12R1.374 CCCCc1cc(ccc1Br)Br 271570a_100020621405_100011483371 [1,1,0,0,0,0|2,0,0]=4 7662 B12R1.374 CCCCc1cc(ccc1Br)C 271570a_100020621405_100012353751 [1,1,0,0,0,0|2,0,0]=4 7663 B12R1.374 CCCCc1cc(ccc1Br)Cl 271570a_100020621405_100012339723 [1,1,0,0,0,0|2,0,0]=4 7664 B12R1.374 CCCCc1cc(ccc1Br)F 271570a_100020621405_100011217576 [1,1,0,0,0,0|2,0,0]=4 7665 B12R1.374 CCCCc1cc(ccc1Br)N 271570a_100020621405_100000750459 [1,1,0,0,0,0|2,0,0]=4 7666 B12R1.374 CCCCc1cc(ccc1Br)O 271570a_100020621405_100012339312 [1,1,0,0,0,0|1,0,0]=3 7667 B12R1.374 CCCCc1cc(ccc1C)Br 271570a_100020621405_100011344865 [1,1,0,0,0,0|2,0,0]=4 7668 B12R1.374 CCCCc1cc(ccc1C)C 271570a_100020621405_100000210833 [1,1,0,0,0,0|2,0,0]=4 7669 B12R1.374 CCCCc1cc(ccc1C)Cl 271570a_100020621405_100011263213 [1,1,0,0,0,0|2,0,0]=4 7670 B12R1.374 CCCCc1cc(ccc1C)F 271570a_100020621405_100011218078 [1,1,0,0,0,0|2,0,0]=4 7671 B12R1.374 CCCCc1cc(ccc1C)N 271570a_100020621405_100000736455 [1,1,0,0,0,0|2,0,0]=4 7672 B12R1.374 CCCCc1cc(ccc1C)O 271570a_100020621405_100011380479 [1,1,0,0,0,0|1,0,0]=3 7673 B12R1.374 CCCCc1cc(ccc1Cl)Br 271570a_100020621405_100011772130 [1,1,0,0,0,0|2,0,0]=4 7674 B12R1.374 CCCCc1cc(ccc1Cl)C 271570a_100020621405_100012356289 [1,1,0,0,0,0|2,0,0]=4 7675 B12R1.374 CCCCc1cc(ccc1Cl)Cl 271570a_100020621405_100000707729 [1,1,0,0,0,0|2,0,0]=4 7676 B12R1.374 CCCCc1cc(ccc1Cl)F 271570a_100020621405_100011217299 [1,1,0,0,0,0|2,0,0]=4 7677 B12R1.374 CCCCc1cc(ccc1Cl)N 271570a_100020621405_100012360549 [1,1,0,0,0,0|2,0,0]=4 7678 B12R1.374 CCCCc1cc(ccc1Cl)O 271570a_100020621405_100000049588 [1,1,0,0,0,0|1,0,0]=3 7679 B12R1.374 CCCCc1cc(ccc1F)Br 271570a_100020621405_100011217312 [1,1,0,0,0,0|2,0,0]=4 7680 B12R1.374 CCCCc1cc(ccc1F)C 271570a_100020621405_100000736223 [1,1,0,0,0,0|2,0,0]=4 7681 B12R1.374 CCCCc1cc(ccc1F)Cl 271570a_100020621405_100011218116 [1,1,0,0,0,0|2,0,0]=4 7682 B12R1.374 CCCCc1cc(ccc1F)F 271570a_100020621405_100000750033 [1,1,0,0,0,0|2,0,0]=4 7683 B12R1.374 CCCCc1cc(ccc1F)N 271570a_100020621405_100000760356 [1,1,0,0,0,0|2,0,0]=4 7684 B12R1.374 CCCCc1cc(ccc1F)O 271570a_100020621405_100000693481 [1,1,0,0,0,0|1,0,0]=3 7685 B12R1.374 CCCCc1cc(ccc1N)Br 271570a_100020621405_100000187925 [1,1,0,0,0,0|2,0,0]=4 7686 B12R1.374 CCCCc1cc(ccc1N)C 271570a_100020621405_100000210942 [1,1,0,0,0,0|2,0,0]=4 7687 B12R1.374 CCCCc1cc(ccc1N)Cl 271570a_100020621405_100000761889 [1,1,0,0,0,0|2,0,0]=4 7688 B12R1.374 CCCCc1cc(ccc1N)F 271570a_100020621405_100000760547 [1,1,0,0,0,0|2,0,0]=4 7689 B12R1.374 CCCCc1cc(ccc1N)N 271570a_100020621405_100011534242 [1,1,0,0,0,0|2,0,0]=4 7690 B12R1.374 CCCCc1cc(ccc1N)O 271570a_100020621405_100012001276 [1,1,0,0,0,0|1,0,0]=3 7691 B12R1.374 CCCCc1cc(ccc1O)Br 271570a_100020621405_100012355227 [1,1,0,0,0,0|2,0,0]=4 7692 B12R1.374 CCCCc1cc(ccc1O)C 271570a_100020621405_100000765521 [1,1,0,0,0,0|2,0,0]=4 7693 B12R1.374 CCCCc1cc(ccc1O)Cl 271570a_100020621405_100011356953 [1,1,0,0,0,0|2,0,0]=4 7694 B12R1.374 CCCCc1cc(ccc1O)F 271570a_100020621405_100000211999 [1,1,0,0,0,0|2,0,0]=4 7695 B12R1.374 CCCCc1cc(ccc1O)N 271570a_100020621405_100011534360 [1,1,0,0,0,0|2,0,0]=4 7696 B12R1.374 CCCCc1cc(ccc1O)O 271570a_100020621405_100009813629 [1,1,0,0,0,0|1,0,0]=3 7697 B12R1.374 CCCCc1cc(cnc1C)O 271570a_100020621405_100009819603 [1,1,0,0,0,0|2,0,0]=4 7698 B12R1.374 CCCCc1cc(cnc1F)O 271570a_100020621405_100009817267 [1,1,0,0,0,0|2,0,0]=4 7699 B12R1.374 CCCCc1cc(ncc1C)O 271570a_100020621405_100009831917 [1,1,0,0,0,0|2,0,0]=4 7700 B12R1.374 CCCNc1cc(ccc1Br)O 34a_100011999798_100000210303 [1,1,0,0,0,0|2,0,0]=4 7701 B12R1.374 CCCNc1cc(ccc1C)O 34a_100011216113_100000210303 [1,1,0,0,0,0|2,0,0]=4 7702 B12R1.374 CCCNc1cc(ccc1Cl)O 34a_100011934297_100000210303 [1,1,0,0,0,0|2,0,0]=4 7703 B12R1.374 CCCNc1cc(ccc1F)O 34a_100012017239_100000210303 [1,1,0,0,0,0|2,0,0]=4 7704 B12R1.374 CCCSc1cc(ccc1Br)O 62a_100000210303_100012339312 [1,1,0,0,0,0|2,0,0]=4 7705 B12R1.374 CCCSc1cc(ccc1Br)O 62a_100012339312_100000210303 [1,1,0,0,0,0|2,0,0]=4 7706 B12R1.374 CCCSc1cc(ccc1C)O 62a_100000210303_100011380479 [1,1,0,0,0,0|2,0,0]=4 7707 B12R1.374 CCCSc1cc(ccc1C)O 62a_100011380479_100000210303 [1,1,0,0,0,0|2,0,0]=4 7708 B12R1.374 CCCSc1cc(ccc1Cl)O 62a_100000049588_100000210303 [1,1,0,0,0,0|2,0,0]=4 7709 B12R1.374 CCCSc1cc(ccc1Cl)O 62a_100000210303_100000049588 [1,1,0,0,0,0|2,0,0]=4 7710 B12R1.374 CCCSc1cc(ccc1F)O 62a_100000210303_100000693481 [1,1,0,0,0,0|2,0,0]=4 7711 B12R1.374 CCCSc1cc(ccc1F)O 62a_100000693481_100000210303 [1,1,0,0,0,0|2,0,0]=4 7712 B12R1.374 CCCSc1cc(ccc1N)O 62a_100000210303_100012001276 [1,1,0,0,0,0|2,0,0]=4 7713 B12R1.374 CCCSc1cc(ccc1N)O 62a_100012001276_100000210303 [1,1,0,0,0,0|2,0,0]=4 7714 B12R1.374 CCCSc1cc(ccc1O)O 62a_100000210303_100009813629 [1,1,0,0,0,0|2,0,0]=4 7715 B12R1.374 CCNCc1cc(ccc1C)O 34a_200009844824_100000210202 [1,1,0,0,0,0|2,0,0]=4 7716 B12R1.374 CCNCc1cc(ccc1F)O 271570a_203496583355_100000748473 [1,1,0,0,0,0|2,0,0]=4 7717 B12R1.374 CCNCc1cc(ccc1O)O 271570a_203496583355_100000765307 [1,1,0,0,0,0|2,0,0]=4 7718 B12R1.374 CNCCc1cc(ccc1C)C 2230a_200011485678_200000210301 [1,1,0,0,0,0|1,0,0]=3 7719 B12R1.374 CNCCc1cc(ccc1C)C 34a_200011485678_200000210301 [1,1,0,0,0,0|1,0,0]=3 7720 B12R1.374 CNCCc1cc(ccc1Cl)Cl 2230a_100000705354_200000210301 [1,1,0,0,0,0|1,0,0]=3 7721 B12R1.374 CNCCc1cc(ccc1Cl)Cl 34a_100000705354_200000210301 [1,1,0,0,0,0|1,0,0]=3 7722 B12R1.374 CNCCc1cc(ccc1F)Cl 2230a_200011997525_200000210301 [1,1,0,0,0,0|1,0,0]=3 7723 B12R1.374 CNCCc1cc(ccc1F)Cl 34a_200011997525_200000210301 [1,1,0,0,0,0|1,0,0]=3 7724 B12R1.374 CNCCc1cc(ccc1F)F 2230a_106832991635_100011755056 [1,1,0,0,0,0|1,0,0]=3 7725 B12R1.374 CNCCc1cc(ccc1F)F 34a_100102657272_100011755056 [1,1,0,0,0,0|1,0,0]=3 7726 B12R1.374 CNCCc1cc(ccc1F)F 7a_106832991635_100011755056 [1,1,0,0,0,0|1,0,0]=3 7727 B12R1.374 COCCc1cc(ccc1Br)Cl 34a_100012426913_200000210301 [1,1,0,0,0,0|2,0,0]=4 7728 B12R1.374 COCCc1cc(ccc1Br)Cl 7a_100012426913_200000210301 [1,1,0,0,0,0|2,0,0]=4 7729 B12R1.374 COCCc1cc(ccc1C)C 34a_100011694955_200000210301 [1,1,0,0,0,0|2,0,0]=4 7730 B12R1.374 COCCc1cc(ccc1C)C 7a_100011694955_200000210301 [1,1,0,0,0,0|2,0,0]=4 7731 B12R1.374 COCCc1cc(ccc1Cl)Cl 34a_100011754359_200000210301 [1,1,0,0,0,0|2,0,0]=4 7732 B12R1.374 COCCc1cc(ccc1Cl)Cl 7a_100011754359_200000210301 [1,1,0,0,0,0|2,0,0]=4 7733 B12R1.374 COCCc1cc(ccc1F)F 34a_100011755048_200000210301 [1,1,0,0,0,0|2,0,0]=4 7734 B12R1.374 COCCc1cc(ccc1F)F 34a_100138415774_100011755056 [1,1,0,0,0,0|2,0,0]=4 7735 B12R1.374 COCCc1cc(ccc1F)F 7a_100011755048_200000210301 [1,1,0,0,0,0|2,0,0]=4 7736 B12R1.374 COCSc1cc(ccc1Br)O 62a_100000766300_100012339312 [1,1,0,0,0,0|2,0,0]=4 7737 B12R1.374 COCSc1cc(ccc1Br)O 62a_100012339312_100000766300 [1,1,0,0,0,0|2,0,0]=4 7738 B12R1.374 COCSc1cc(ccc1C)O 62a_100000766300_100011380479 [1,1,0,0,0,0|2,0,0]=4 7739 B12R1.374 COCSc1cc(ccc1C)O 62a_100011380479_100000766300 [1,1,0,0,0,0|2,0,0]=4 7740 B12R1.374 COCSc1cc(ccc1Cl)O 62a_100000049588_100000766300 [1,1,0,0,0,0|2,0,0]=4 7741 B12R1.374 COCSc1cc(ccc1Cl)O 62a_100000766300_100000049588 [1,1,0,0,0,0|2,0,0]=4 7742 B12R1.374 COCSc1cc(ccc1F)O 62a_100000693481_100000766300 [1,1,0,0,0,0|2,0,0]=4 7743 B12R1.374 COCSc1cc(ccc1F)O 62a_100000766300_100000693481 [1,1,0,0,0,0|2,0,0]=4 7744 B12R1.374 COCSc1cc(ccc1N)O 62a_100000766300_100012001276 [1,1,0,0,0,0|2,0,0]=4 7745 B12R1.374 COCSc1cc(ccc1N)O 62a_100012001276_100000766300 [1,1,0,0,0,0|2,0,0]=4 7746 B12R1.374 COCSc1cc(ccc1O)O 62a_100000766300_100009813629 [1,1,0,0,0,0|2,0,0]=4 7747 B12R1.374 CSCCc1cc(ccc1F)F 62a_100011755056_200000210301 [1,1,0,0,0,0|2,0,0]=4 7748 B12R1.374 CSCCc1cc(ccc1F)F 62a_200000210301_100011755056 [1,1,0,0,0,0|2,0,0]=4 7749 B12R1.374 CSCNc1cc(ccc1Br)O 34a_100011999798_100011218213 [1,1,0,0,0,0|2,0,0]=4 7750 B12R1.374 CSCNc1cc(ccc1C)O 34a_100011216113_100011218213 [1,1,0,0,0,0|2,0,0]=4 7751 B12R1.374 CSCNc1cc(ccc1Cl)O 34a_100011934297_100011218213 [1,1,0,0,0,0|2,0,0]=4 7752 B12R1.374 CSCNc1cc(ccc1F)O 34a_100012017239_100011218213 [1,1,0,0,0,0|2,0,0]=4 7753 B12R1.374 CSCSc1cc(ccc1Br)O 62a_100011218213_100012339312 [1,1,0,0,0,0|2,0,0]=4 7754 B12R1.374 CSCSc1cc(ccc1Br)O 62a_100012339312_100011218213 [1,1,0,0,0,0|2,0,0]=4 7755 B12R1.374 CSCSc1cc(ccc1C)O 62a_100011218213_100011380479 [1,1,0,0,0,0|2,0,0]=4 7756 B12R1.374 CSCSc1cc(ccc1C)O 62a_100011380479_100011218213 [1,1,0,0,0,0|2,0,0]=4 7757 B12R1.374 CSCSc1cc(ccc1Cl)O 62a_100000049588_100011218213 [1,1,0,0,0,0|2,0,0]=4 7758 B12R1.374 CSCSc1cc(ccc1Cl)O 62a_100011218213_100000049588 [1,1,0,0,0,0|2,0,0]=4 7759 B12R1.374 CSCSc1cc(ccc1F)O 62a_100000693481_100011218213 [1,1,0,0,0,0|2,0,0]=4 7760 B12R1.374 CSCSc1cc(ccc1F)O 62a_100011218213_100000693481 [1,1,0,0,0,0|2,0,0]=4 7761 B12R1.374 CSCSc1cc(ccc1N)O 62a_100011218213_100012001276 [1,1,0,0,0,0|2,0,0]=4 7762 B12R1.374 CSCSc1cc(ccc1N)O 62a_100012001276_100011218213 [1,1,0,0,0,0|2,0,0]=4 7763 B12R1.374 CSCSc1cc(ccc1O)O 62a_100011218213_100009813629 [1,1,0,0,0,0|2,0,0]=4 7764 B12R1.374 Cc1ccc(c(c1)CCN[13CH3])C 2230a_200011485678_200025704644 [1,1,0,0,0,0|1,0,0]=3 7765 B12R1.374 Cc1ccc(c(c1)CCN[13CH3])C 34a_200011485678_200025704644 [1,1,0,0,0,0|1,0,0]=3 7766 B12R1.374 Cc1ccc(c(c1)CCO[13CH3])C 34a_100011694955_200025704644 [1,1,0,0,0,0|2,0,0]=4 7767 B12R1.374 Cc1ccc(c(c1)CCO[13CH3])C 7a_100011694955_200025704644 [1,1,0,0,0,0|2,0,0]=4 7768 B12R1.374 [13CH3]NCCc1cc(ccc1Cl)Cl 2230a_100000705354_200025704644 [1,1,0,0,0,0|1,0,0]=3 7769 B12R1.374 [13CH3]NCCc1cc(ccc1Cl)Cl 34a_100000705354_200025704644 [1,1,0,0,0,0|1,0,0]=3 7770 B12R1.374 [13CH3]NCCc1cc(ccc1F)Cl 2230a_200011997525_200025704644 [1,1,0,0,0,0|1,0,0]=3 7771 B12R1.374 [13CH3]NCCc1cc(ccc1F)Cl 34a_200011997525_200025704644 [1,1,0,0,0,0|1,0,0]=3 7772 B12R1.374 [13CH3]OCCc1cc(ccc1Br)Cl 34a_100012426913_200025704644 [1,1,0,0,0,0|2,0,0]=4 7773 B12R1.374 [13CH3]OCCc1cc(ccc1Br)Cl 7a_100012426913_200025704644 [1,1,0,0,0,0|2,0,0]=4 7774 B12R1.374 [13CH3]OCCc1cc(ccc1Cl)Cl 34a_100011754359_200025704644 [1,1,0,0,0,0|2,0,0]=4 7775 B12R1.374 [13CH3]OCCc1cc(ccc1Cl)Cl 7a_100011754359_200025704644 [1,1,0,0,0,0|2,0,0]=4 7776 B12R1.374 [13CH3]OCCc1cc(ccc1F)F 34a_100011755048_200025704644 [1,1,0,0,0,0|2,0,0]=4 7777 B12R1.374 [13CH3]OCCc1cc(ccc1F)F 7a_100011755048_200025704644 [1,1,0,0,0,0|2,0,0]=4 7778 B12R1.374 [13CH3]SCCc1cc(ccc1F)F 62a_100011755056_200025704644 [1,1,0,0,0,0|2,0,0]=4 7779 B12R1.374 [13CH3]SCCc1cc(ccc1F)F 62a_200025704644_100011755056 [1,1,0,0,0,0|2,0,0]=4 7780 B12R1.382 C=Cc1cccc(c1)CCCC 271570a_100011290941_200010244551 [1,1,0,0,0,0|2,0,0]=4 7781 B12R1.382 CCCCc1cc(ccn1)CO 271570a_100020621405_100009814636 [1,1,0,0,0,0|2,0,0]=4 7782 B12R1.382 CCCCc1cc(ccn1)OC 271570a_100020621405_100011216251 [1,1,0,0,0,0|2,0,0]=4 7783 B12R1.382 CCCCc1cccc(c1)C#N 271570a_100020621405_100000189340 [1,1,0,0,0,0|2,0,0]=4 7784 B12R1.382 CCCCc1cccc(c1)C=O 271570a_100020621405_100000014684 [1,1,0,0,0,0|1,0,1]=4 7785 B12R1.382 CCCCc1cccc(c1)CC 271570a_100020621405_100000684523 [1,1,0,0,0,0|2,0,0]=4 7786 B12R1.382 CCCCc1cccc(c1)CF 271570a_100020621405_100010878472 [1,1,0,0,0,0|2,0,0]=4 7787 B12R1.382 CCCCc1cccc(c1)CN 271570a_100020621405_100000106179 [1,1,0,0,0,0|2,0,0]=4 7788 B12R1.382 CCCCc1cccc(c1)CO 271570a_100020621405_100000687537 [1,1,0,0,0,0|1,0,0]=3 7789 B12R1.382 CCCCc1cccc(c1)NC 2230a_200012017287_200000210301 [1,1,0,0,0,0|2,0,0]=4 7790 B12R1.382 CCCCc1cccc(c1)NC 271570a_100020621405_100000219648 [1,1,0,0,0,0|2,0,0]=4 7791 B12R1.382 CCCCc1cccc(c1)NC 34a_200012017287_200000210301 [1,1,0,0,0,0|2,0,0]=4 7792 B12R1.382 CCCCc1cccc(c1)NC 7a_200012017287_200000210301 [1,1,0,0,0,0|2,0,0]=4 7793 B12R1.382 CCCCc1cccc(c1)NN 271570a_100020621405_100000217339 [1,1,0,0,0,0|2,0,0]=4 7794 B12R1.382 CCCCc1cccc(c1)N[13CH3] 2230a_200012017287_200025704644 [1,1,0,0,0,0|2,0,0]=4 7795 B12R1.382 CCCCc1cccc(c1)N[13CH3] 34a_200012017287_200025704644 [1,1,0,0,0,0|2,0,0]=4 7796 B12R1.382 CCCCc1cccc(c1)N[13CH3] 7a_200012017287_200025704644 [1,1,0,0,0,0|2,0,0]=4 7797 B12R1.382 CCCCc1cccc(c1)OC 271570a_100020621405_100000170001 [1,1,0,0,0,0|1,0,0]=3 7798 B12R1.382 CCCCc1cccc(c1)SC 271570a_100020621405_100011215954 [1,1,0,0,0,0|1,1,0]=4 7799 B12R1.382 CCCCc1cccc(c1)SC 62a_200000210301_200010244551 [1,1,0,0,0,0|1,1,0]=4 7800 B12R1.382 CCCCc1cccc(c1)SC 62a_200010244551_200000210301 [1,1,0,0,0,0|1,1,0]=4 7801 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200010244551_200025704644 [1,1,0,0,0,0|1,1,0]=4 7802 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200025704644_200010244551 [1,1,0,0,0,0|1,1,0]=4 7803 B12R1.382 CCCCc1cccc(n1)CO 271570a_100020621405_100000694195 [1,1,0,0,0,0|2,0,0]=4 7804 B12R1.382 CCCCc1cccc(n1)OC 271570a_100020621405_100000760917 [1,1,0,0,0,0|2,0,0]=4 7805 B12R1.382 CCCCc1ccnc(c1)CO 271570a_100020621405_100009819072 [1,1,0,0,0,0|2,0,0]=4 7806 B12R1.382 CCCCc1ccnc(c1)OC 271570a_100020621405_100000117307 [1,1,0,0,0,0|2,0,0]=4 7807 B12R1.382 CCCCc1cncc(c1)CO 271570a_100020621405_100011259137 [1,1,0,0,0,0|2,0,0]=4 7808 B12R1.382 CCCCc1cncc(c1)OC 271570a_100020621405_100000684773 [1,1,0,0,0,0|2,0,0]=4 7809 B12R1.382 CCCNc1cccc(c1)CO 2230a_100000211919_100000210303 [1,1,0,0,0,0|2,0,0]=4 7810 B12R1.382 CCCNc1cccc(c1)CO 34a_100000211919_100000210303 [1,1,0,0,0,0|2,0,0]=4 7811 B12R1.382 CCCNc1cccc(c1)OC 34a_100000210024_100000210303 [1,1,0,0,0,0|2,0,0]=4 7812 B12R1.382 CCCOc1cccc(c1)CO 34a_100011214949_100000210303 [1,1,0,0,0,0|2,0,0]=4 7813 B12R1.382 CCCOc1cccc(c1)CO 7a_100011214949_100000210303 [1,1,0,0,0,0|2,0,0]=4 7814 B12R1.382 CCCOc1cccc(c1)OC 34a_100000211255_100000210303 [1,1,0,0,0,0|2,0,0]=4 7815 B12R1.382 CCCOc1cccc(c1)OC 34a_100000748497_200000210301 [1,1,0,0,0,0|2,0,0]=4 7816 B12R1.382 CCCOc1cccc(c1)OC 7a_100000211255_100000210303 [1,1,0,0,0,0|2,0,0]=4 7817 B12R1.382 CCCOc1cccc(c1)OC 7a_100000748497_200000210301 [1,1,0,0,0,0|2,0,0]=4 7818 B12R1.382 CCCOc1cccc(c1)O[13CH3] 34a_100000748497_200025704644 [1,1,0,0,0,0|2,0,0]=4 7819 B12R1.382 CCCOc1cccc(c1)O[13CH3] 7a_100000748497_200025704644 [1,1,0,0,0,0|2,0,0]=4 7820 B12R1.382 CCCSc1cccc(c1)CO 62a_100000210303_100000687537 [1,1,0,0,0,0|2,0,0]=4 7821 B12R1.382 CCCSc1cccc(c1)CO 62a_100000687537_100000210303 [1,1,0,0,0,0|2,0,0]=4 7822 B12R1.382 CCCSc1cccc(c1)OC 62a_100000210303_100000170001 [1,1,0,0,0,0|2,0,0]=4 7823 B12R1.382 CCNCc1cccc(c1)CO 207a_100015525214_200000050894 [1,1,0,0,0,0|2,0,0]=4 7824 B12R1.382 CCNCc1cccc(c1)CO 2230a_100011269909_100000210202 [1,1,0,0,0,0|2,0,0]=4 7825 B12R1.382 CCNCc1cccc(c1)CO 2230a_100015525214_100010188025 [1,1,0,0,0,0|2,0,0]=4 7826 B12R1.382 CCNCc1cccc(c1)CO 270004a_100015525214_200000050894 [1,1,0,0,0,0|2,0,0]=4 7827 B12R1.382 CCNCc1cccc(c1)CO 34a_100011269909_100000210202 [1,1,0,0,0,0|2,0,0]=4 7828 B12R1.382 CCNCc1cccc(c1)OC 207a_100015525214_100000170238 [1,1,0,0,0,0|2,0,0]=4 7829 B12R1.382 CCNCc1cccc(c1)OC 2230a_100000174954_100000210202 [1,1,0,0,0,0|2,0,0]=4 7830 B12R1.382 CCNCc1cccc(c1)OC 2230a_100015525214_100000211672 [1,1,0,0,0,0|2,0,0]=4 7831 B12R1.382 CCNCc1cccc(c1)OC 270004a_100015525214_100000170238 [1,1,0,0,0,0|2,0,0]=4 7832 B12R1.382 CCNCc1cccc(c1)OC 34a_100000174954_100000210202 [1,1,0,0,0,0|2,0,0]=4 7833 B12R1.382 CCNCc1cccc(c1)OC 34a_100000201218_200000210301 [1,1,0,0,0,0|2,0,0]=4 7834 B12R1.382 CCNCc1cccc(c1)O[13CH3] 34a_100000201218_200025704644 [1,1,0,0,0,0|2,0,0]=4 7835 B12R1.382 CCOCc1cccc(c1)CO 34a_100121572206_100010188025 [1,1,0,0,0,0|2,0,0]=4 7836 B12R1.382 CCOCc1cccc(c1)OC 34a_100000198976_100000210202 [1,1,0,0,0,0|2,0,0]=4 7837 B12R1.382 CCOCc1cccc(c1)OC 34a_100121572206_100000688526 [1,1,0,0,0,0|2,0,0]=4 7838 B12R1.382 CCSCc1cccc(c1)CO 62a_100000210202_100010188025 [1,1,0,0,0,0|2,0,0]=4 7839 B12R1.382 CCSCc1cccc(c1)CO 62a_100010188025_100000210202 [1,1,0,0,0,0|2,0,0]=4 7840 B12R1.382 CCSCc1cccc(c1)OC 62a_100000210202_100000211672 [1,1,0,0,0,0|2,0,0]=4 7841 B12R1.382 CCSCc1cccc(c1)OC 62a_100000688526_100000210202 [1,1,0,0,0,0|2,0,0]=4 7842 B12R1.382 CNCCc1cccc(c1)OC 2230a_100000740386_200000210301 [1,1,0,0,0,0|0,0,0]=2 7843 B12R1.382 CNCCc1cccc(c1)OC 2230a_106832991635_100011713679 [1,1,0,0,0,0|0,0,0]=2 7844 B12R1.382 CNCCc1cccc(c1)OC 34a_100000740386_200000210301 [1,1,0,0,0,0|0,0,0]=2 7845 B12R1.382 CNCCc1cccc(c1)OC 34a_100102657272_100011713679 [1,1,0,0,0,0|0,0,0]=2 7846 B12R1.382 CNCCc1cccc(c1)OC 7a_106832991635_100011713679 [1,1,0,0,0,0|0,0,0]=2 7847 B12R1.382 COCCc1cccc(c1)C#N 34a_100012001419_200000210301 [1,1,0,0,0,0|2,0,0]=4 7848 B12R1.382 COCCc1cccc(c1)C#N 7a_100012001419_200000210301 [1,1,0,0,0,0|2,0,0]=4 7849 B12R1.382 COCCc1cccc(c1)OC 34a_100011215300_200000210301 [1,1,0,0,0,0|1,0,0]=3 7850 B12R1.382 COCCc1cccc(c1)OC 34a_100138415774_100011713679 [1,1,0,0,0,0|1,0,0]=3 7851 B12R1.382 COCCc1cccc(c1)OC 7a_100011215300_200000210301 [1,1,0,0,0,0|1,0,0]=3 7852 B12R1.382 COCNc1cccc(c1)CO 2230a_100000211919_100000766300 [1,1,0,0,0,0|2,0,0]=4 7853 B12R1.382 COCSc1cccc(c1)CO 62a_100000687537_100000766300 [1,1,0,0,0,0|2,0,0]=4 7854 B12R1.382 COCSc1cccc(c1)CO 62a_100000766300_100000687537 [1,1,0,0,0,0|2,0,0]=4 7855 B12R1.382 COCSc1cccc(c1)OC 62a_100000766300_100000170001 [1,1,0,0,0,0|2,0,0]=4 7856 B12R1.382 COc1cccc(c1)CCCO 34a_200011999501_200000210301 [1,1,0,0,0,0|2,0,0]=4 7857 B12R1.382 COc1cccc(c1)CCCO 7a_200011999501_200000210301 [1,1,0,0,0,0|2,0,0]=4 7858 B12R1.382 COc1cccc(c1)CCN[13CH3] 2230a_100000740386_200025704644 [1,1,0,0,0,0|0,0,0]=2 7859 B12R1.382 COc1cccc(c1)CCN[13CH3] 34a_100000740386_200025704644 [1,1,0,0,0,0|0,0,0]=2 7860 B12R1.382 COc1cccc(c1)CCO[13CH3] 34a_100011215300_200025704644 [1,1,0,0,0,0|1,0,0]=3 7861 B12R1.382 COc1cccc(c1)CCO[13CH3] 7a_100011215300_200025704644 [1,1,0,0,0,0|1,0,0]=3 7862 B12R1.382 COc1cccc(c1)CCSC 62a_100011713679_200000210301 [1,1,0,0,0,0|1,0,0]=3 7863 B12R1.382 COc1cccc(c1)CCSC 62a_200000210301_100011713679 [1,1,0,0,0,0|1,0,0]=3 7864 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_100011713679_200025704644 [1,1,0,0,0,0|1,0,0]=3 7865 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713679 [1,1,0,0,0,0|1,0,0]=3 7866 B12R1.382 COc1cccc(c1)NCSC 34a_100000210024_100011218213 [1,1,0,0,0,0|2,0,0]=4 7867 B12R1.382 COc1cccc(c1)OCSC 34a_100000211255_100011218213 [1,1,0,0,0,0|2,0,0]=4 7868 B12R1.382 COc1cccc(c1)SCSC 62a_100011218213_100000170001 [1,1,0,0,0,0|2,0,0]=4 7869 B12R1.382 CSCNc1cccc(c1)CO 2230a_100000211919_100011218213 [1,1,0,0,0,0|2,0,0]=4 7870 B12R1.382 CSCNc1cccc(c1)CO 34a_100000211919_100011218213 [1,1,0,0,0,0|2,0,0]=4 7871 B12R1.382 CSCOc1cccc(c1)CO 34a_100011214949_100011218213 [1,1,0,0,0,0|2,0,0]=4 7872 B12R1.382 CSCSc1cccc(c1)CO 62a_100000687537_100011218213 [1,1,0,0,0,0|2,0,0]=4 7873 B12R1.382 CSCSc1cccc(c1)CO 62a_100011218213_100000687537 [1,1,0,0,0,0|2,0,0]=4 7874 B12R1.382 [13CH3]OCCc1cccc(c1)C#N 34a_100012001419_200025704644 [1,1,0,0,0,0|2,0,0]=4 7875 B12R1.382 [13CH3]OCCc1cccc(c1)C#N 7a_100012001419_200025704644 [1,1,0,0,0,0|2,0,0]=4 7876 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 34a_200011999501_200025704644 [1,1,0,0,0,0|2,0,0]=4 7877 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 7a_200011999501_200025704644 [1,1,0,0,0,0|2,0,0]=4 7878 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,1,0,0,0,0|0,0,2]=4 7879 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,1,0,0,0,0|1,0,1]=4 7880 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,1,0,0,0,0|1,0,1]=4 7881 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,1,0,0,0,0|1,0,1]=4 7882 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,1,0,0,0,0|1,0,1]=4 7883 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,1,0,0,0,0|1,0,1]=4 7884 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,1,0,0,0,0|0,0,1]=3 7885 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,1,0,0,0,0|0,0,1]=3 7886 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,1,0,0,0,0|1,0,1]=4 7887 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,1,0,0,0,0|1,0,1]=4 7888 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [1,1,0,0,0,0|2,0,0]=4 7889 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [1,1,0,0,0,0|2,0,0]=4 7890 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [1,1,0,0,0,0|2,0,0]=4 7891 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [1,1,0,0,0,0|2,0,0]=4 7892 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [1,1,0,0,0,0|2,0,0]=4 7893 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [1,1,0,0,0,0|2,0,0]=4 7894 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [1,1,0,0,0,0|2,0,0]=4 7895 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,1,0,0,0,0|1,0,0]=3 7896 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [1,1,0,0,0,0|2,0,0]=4 7897 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [1,1,0,0,0,0|2,0,0]=4 7898 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [1,1,0,0,0,0|2,0,0]=4 7899 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [1,1,0,0,0,0|2,0,0]=4 7900 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [1,1,0,0,0,0|2,0,0]=4 7901 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [1,1,0,0,0,0|2,0,0]=4 7902 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [1,1,0,0,0,0|2,0,0]=4 7903 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [1,1,0,0,0,0|2,0,0]=4 7904 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [1,1,0,0,0,0|2,0,0]=4 7905 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [1,1,0,0,0,0|2,0,0]=4 7906 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [1,1,0,0,0,0|2,0,0]=4 7907 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [1,1,0,0,0,0|2,0,0]=4 7908 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [1,1,0,0,0,0|2,0,0]=4 7909 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [1,1,0,0,0,0|2,0,0]=4 7910 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [1,1,0,0,0,0|2,0,0]=4 7911 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [1,1,0,0,0,0|2,0,0]=4 7912 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [1,1,0,0,0,0|2,0,0]=4 7913 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,1,0,0,0,0|1,0,0]=3 7914 B12R1.19 CN(C)Cc1cc(=O)c(co1)O 2230a_100102631434_100000010605 [1,1,0,0,0,0|1,0,1]=4 7915 B12R1.19 CN(C)Cc1cc(=O)c(co1)O 269982a_100102631434_100000010605 [1,1,0,0,0,0|1,0,1]=4 7916 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 2230a_100102631434_100012353900 [1,1,0,0,0,0|2,0,0]=4 7917 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 269982a_100102631434_100012353900 [1,1,0,0,0,0|2,0,0]=4 7918 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Br 270004a_100102631434_100011215943 [1,1,0,0,0,0|2,0,0]=4 7919 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 2230a_100102631434_100012353894 [1,1,0,0,0,0|2,0,0]=4 7920 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 269982a_100102631434_100012353894 [1,1,0,0,0,0|2,0,0]=4 7921 B12R1.19 CN(C)Cc1ccc(c(c1)Br)Cl 270004a_100102631434_100000693810 [1,1,0,0,0,0|2,0,0]=4 7922 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 2230a_100102631434_100011206884 [1,1,0,0,0,0|2,0,0]=4 7923 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 269982a_100102631434_100000743011 [1,1,0,0,0,0|2,0,0]=4 7924 B12R1.19 CN(C)Cc1ccc(c(c1)Br)F 270004a_100102631434_100000211747 [1,1,0,0,0,0|2,0,0]=4 7925 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 2230a_100102631434_100012353895 [1,1,0,0,0,0|2,0,0]=4 7926 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 269982a_100102631434_100012353895 [1,1,0,0,0,0|2,0,0]=4 7927 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Br 270004a_100102631434_100000690054 [1,1,0,0,0,0|2,0,0]=4 7928 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 2230a_100000184578_200000210301 [1,1,0,0,0,0|2,0,0]=4 7929 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 2230a_100102631434_100000184707 [1,1,0,0,0,0|2,0,0]=4 7930 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 269982a_100000184578_200000210301 [1,1,0,0,0,0|2,0,0]=4 7931 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 269982a_100102631434_100000188800 [1,1,0,0,0,0|2,0,0]=4 7932 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 270004a_100102631434_100000188533 [1,1,0,0,0,0|2,0,0]=4 7933 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)Cl 34a_100000184578_200000210301 [1,1,0,0,0,0|2,0,0]=4 7934 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 2230a_100102631434_100000717365 [1,1,0,0,0,0|2,0,0]=4 7935 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 269982a_100102631434_100011934319 [1,1,0,0,0,0|2,0,0]=4 7936 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)F 270004a_100102631434_100000742290 [1,1,0,0,0,0|2,0,0]=4 7937 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)I 2230a_100102631434_100012349665 [1,1,0,0,0,0|2,0,0]=4 7938 B12R1.19 CN(C)Cc1ccc(c(c1)Cl)I 269982a_100102631434_100012349665 [1,1,0,0,0,0|2,0,0]=4 7939 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 2230a_100102631434_100000767054 [1,1,0,0,0,0|2,0,0]=4 7940 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 269982a_100102631434_100000767054 [1,1,0,0,0,0|2,0,0]=4 7941 B12R1.19 CN(C)Cc1ccc(c(c1)F)Br 270004a_100102631434_100000686674 [1,1,0,0,0,0|2,0,0]=4 7942 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 2230a_100102631434_100000716492 [1,1,0,0,0,0|2,0,0]=4 7943 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 269982a_100102631434_100000716492 [1,1,0,0,0,0|2,0,0]=4 7944 B12R1.19 CN(C)Cc1ccc(c(c1)F)Cl 270004a_100102631434_100000745630 [1,1,0,0,0,0|2,0,0]=4 7945 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 2230a_100102631434_100000757363 [1,1,0,0,0,0|2,0,0]=4 7946 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 269982a_100102631434_100000757363 [1,1,0,0,0,0|2,0,0]=4 7947 B12R1.19 CN(C)Cc1ccc(c(c1)F)F 270004a_100102631434_100000211062 [1,1,0,0,0,0|2,0,0]=4 7948 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 2230a_100102631434_100010149604 [1,1,0,0,0,0|2,0,0]=4 7949 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 269982a_100102631434_100010149604 [1,1,0,0,0,0|2,0,0]=4 7950 B12R1.19 CN(C)Cc1ccc(c(c1)F)I 270004a_100102631434_100000050832 [1,1,0,0,0,0|2,0,0]=4 7951 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 2230a_100102631434_100010146616 [1,1,0,0,0,0|2,0,0]=4 7952 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 269982a_100102631434_100010146616 [1,1,0,0,0,0|2,0,0]=4 7953 B12R1.19 CN(C)Cc1ccc(c(c1)I)Br 270004a_100102631434_100010146563 [1,1,0,0,0,0|2,0,0]=4 7954 B12R1.19 CN(C)Cc1ccc(c(c1)I)Cl 270004a_100102631434_100010209939 [1,1,0,0,0,0|2,0,0]=4 7955 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 2230a_100102631434_100010188208 [1,1,0,0,0,0|2,0,0]=4 7956 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 269982a_100102631434_100010188208 [1,1,0,0,0,0|2,0,0]=4 7957 B12R1.19 CN(C)Cc1ccc(c(c1)I)F 270004a_100102631434_100010188209 [1,1,0,0,0,0|2,0,0]=4 7958 B12R1.19 CN(C)Cc1cnc(c(c1)Br)O 270004a_100102631434_100010064886 [1,1,0,0,0,0|2,0,0]=4 7959 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 2230a_100000184578_200025704644 [1,1,0,0,0,0|2,0,0]=4 7960 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 269982a_100000184578_200025704644 [1,1,0,0,0,0|2,0,0]=4 7961 B12R1.19 CN([13CH3])Cc1ccc(c(c1)Cl)Cl 34a_100000184578_200025704644 [1,1,0,0,0,0|2,0,0]=4 7962 B12R1.19 Cc1cc(ccc1Br)CN(C)C 2230a_100102631434_100000727479 [1,1,0,0,0,0|2,0,0]=4 7963 B12R1.19 Cc1cc(ccc1Br)CN(C)C 269982a_100102631434_100000727479 [1,1,0,0,0,0|2,0,0]=4 7964 B12R1.19 Cc1cc(ccc1Br)CN(C)C 270004a_100102631434_100000765772 [1,1,0,0,0,0|2,0,0]=4 7965 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 2230a_100102631434_100012184735 [1,1,0,0,0,0|2,0,0]=4 7966 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 269982a_100102631434_100012184735 [1,1,0,0,0,0|2,0,0]=4 7967 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100000698814 [1,1,0,0,0,0|2,0,0]=4 7968 B12R1.19 Cc1cc(ccc1F)CN(C)C 2230a_100102631434_100011216667 [1,1,0,0,0,0|2,0,0]=4 7969 B12R1.19 Cc1cc(ccc1F)CN(C)C 269982a_100102631434_100011216667 [1,1,0,0,0,0|2,0,0]=4 7970 B12R1.19 Cc1cc(ccc1F)CN(C)C 270004a_100102631434_100000748208 [1,1,0,0,0,0|2,0,0]=4 7971 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,1,0,0,0,0|1,0,1]=4 7972 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [1,1,0,0,0,0|2,0,0]=4 7973 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [1,1,0,0,0,0|2,0,0]=4 7974 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [1,1,0,0,0,0|2,0,0]=4 7975 B12R1.19 Cc1ccc(cc1Br)CN(C)C 2230a_100102631434_100012232412 [1,1,0,0,0,0|2,0,0]=4 7976 B12R1.19 Cc1ccc(cc1Br)CN(C)C 269982a_100102631434_100012232412 [1,1,0,0,0,0|2,0,0]=4 7977 B12R1.19 Cc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000695567 [1,1,0,0,0,0|2,0,0]=4 7978 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 7979 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [1,1,0,0,0,0|2,0,0]=4 7980 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 7981 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [1,1,0,0,0,0|2,0,0]=4 7982 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [1,1,0,0,0,0|2,0,0]=4 7983 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 7984 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 7985 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 7986 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 7987 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100011823929 [1,1,0,0,0,0|2,0,0]=4 7988 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100011823929 [1,1,0,0,0,0|2,0,0]=4 7989 B12R1.19 Cc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000760539 [1,1,0,0,0,0|2,0,0]=4 7990 B12R1.19 Cc1ccc(cc1F)CN(C)C 2230a_100102631434_100011217369 [1,1,0,0,0,0|2,0,0]=4 7991 B12R1.19 Cc1ccc(cc1F)CN(C)C 269982a_100102631434_100011217369 [1,1,0,0,0,0|2,0,0]=4 7992 B12R1.19 Cc1ccc(cc1F)CN(C)C 270004a_100102631434_100000753222 [1,1,0,0,0,0|2,0,0]=4 7993 B12R1.19 Cc1ccc(cc1I)CN(C)C 2230a_100102631434_100010206137 [1,1,0,0,0,0|2,0,0]=4 7994 B12R1.19 Cc1ccc(cc1I)CN(C)C 269982a_100102631434_100010206137 [1,1,0,0,0,0|2,0,0]=4 7995 B12R1.19 Cc1ccc(cc1I)CN(C)C 270004a_100102631434_100010197721 [1,1,0,0,0,0|2,0,0]=4 7996 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,1,0,0,0,0|1,0,1]=4 7997 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [1,1,0,0,0,0|2,0,0]=4 7998 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [1,1,0,0,0,0|2,0,0]=4 7999 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [1,1,0,0,0,0|2,0,0]=4 8000 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [1,1,0,0,0,0|2,0,0]=4 8001 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [1,1,0,0,0,0|2,0,0]=4 8002 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,1,0,0,0,0|1,0,1]=4 8003 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,1,0,0,0,0|1,0,1]=4 8004 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,1,0,0,0,0|1,0,1]=4 8005 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,1,0,0,0,0|0,0,1]=3 8006 B12R1.44 CCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100000210202 [1,1,0,0,0,0|2,0,0]=4 8007 B12R1.44 CCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000210202 [1,1,0,0,0,0|2,0,0]=4 8008 B12R1.44 CCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000210202 [1,1,0,0,0,0|2,0,0]=4 8009 B12R1.44 CCNc1cc(c(c(c1)C)O)C 34a_100000703291_100000210202 [1,1,0,0,0,0|2,0,0]=4 8010 B12R1.44 CCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000210202 [1,1,0,0,0,0|2,0,0]=4 8011 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100000210202 [1,1,0,0,0,0|2,0,0]=4 8012 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000210202 [1,1,0,0,0,0|2,0,0]=4 8013 B12R1.44 CCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100000210202 [1,1,0,0,0,0|2,0,0]=4 8014 B12R1.44 CCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000210202 [1,1,0,0,0,0|2,0,0]=4 8015 B12R1.44 CCNc1cc(c(c(c1)F)O)F 34a_100016987357_100000210202 [1,1,0,0,0,0|2,0,0]=4 8016 B12R1.44 CCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000210202 [1,1,0,0,0,0|2,0,0]=4 8017 B12R1.44 CCSc1cc(c(c(c1)Br)O)C 62a_100000210202_100010982682 [1,1,0,0,0,0|2,0,0]=4 8018 B12R1.44 CCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000210202 [1,1,0,0,0,0|2,0,0]=4 8019 B12R1.44 CCSc1cc(c(c(c1)C)O)C 62a_100000210202_100011216129 [1,1,0,0,0,0|2,0,0]=4 8020 B12R1.44 CCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000210202 [1,1,0,0,0,0|2,0,0]=4 8021 B12R1.44 CCSc1cc(c(c(c1)Cl)O)C 62a_100000210202_200015900153 [1,1,0,0,0,0|2,0,0]=4 8022 B12R1.44 CCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000210202 [1,1,0,0,0,0|2,0,0]=4 8023 B12R1.44 CCSc1cc(c(c(c1)Cl)O)Cl 62a_100000210202_100012339652 [1,1,0,0,0,0|2,0,0]=4 8024 B12R1.44 CCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000210202 [1,1,0,0,0,0|2,0,0]=4 8025 B12R1.44 CCSc1cc(c(c(c1)F)F)O 62a_100000210202_100000709865 [1,1,0,0,0,0|2,0,0]=4 8026 B12R1.44 CCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000210202 [1,1,0,0,0,0|2,0,0]=4 8027 B12R1.44 CCSc1cc(c(c(c1)F)N)O 62a_100000210202_100015475841 [1,1,0,0,0,0|2,0,0]=4 8028 B12R1.44 CCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000210202 [1,1,0,0,0,0|2,0,0]=4 8029 B12R1.44 CCSc1cc(c(c(c1)F)O)F 62a_100000210202_100011216917 [1,1,0,0,0,0|2,0,0]=4 8030 B12R1.44 CCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000210202 [1,1,0,0,0,0|2,0,0]=4 8031 B12R1.44 CCSc1cc(c(c(c1)F)O)N 62a_100000210202_100011217383 [1,1,0,0,0,0|2,0,0]=4 8032 B12R1.44 CCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000210202 [1,1,0,0,0,0|2,0,0]=4 8033 B12R1.44 CCSc1cc(c(c(c1)F)O)O 62a_100000210202_100010114375 [1,1,0,0,0,0|1,0,0]=3 8034 B12R1.44 CCSc1cc(c(c(c1)N)O)C 62a_100000210202_100011825904 [1,1,0,0,0,0|2,0,0]=4 8035 B12R1.44 CCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000210202 [1,1,0,0,0,0|2,0,0]=4 8036 B12R1.44 CCSc1cc(c(c(c1)O)N)C 62a_100000210202_100010371313 [1,1,0,0,0,0|2,0,0]=4 8037 B12R1.44 CCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000210202 [1,1,0,0,0,0|2,0,0]=4 8038 B12R1.44 CCSc1cc(c(c(c1)O)O)O 62a_100000210202_100010658518 [1,1,0,0,0,0|1,0,0]=3 8039 B12R1.44 CNCc1cc(c(c(c1)Br)C)Br 26a_100102657272_100009813510 [1,1,0,0,0,0|2,0,0]=4 8040 B12R1.44 CNCc1cc(c(c(c1)Br)C)C 26a_100102657272_100010068915 [1,1,0,0,0,0|2,0,0]=4 8041 B12R1.44 CNCc1cc(c(c(c1)Br)C)F 207a_100102657272_100010132949 [1,1,0,0,0,0|2,0,0]=4 8042 B12R1.44 CNCc1cc(c(c(c1)Br)C)F 270004a_106832991635_100010132949 [1,1,0,0,0,0|2,0,0]=4 8043 B12R1.44 CNCc1cc(c(c(c1)Br)Cl)Cl 26a_100102657272_100016179818 [1,1,0,0,0,0|2,0,0]=4 8044 B12R1.44 CNCc1cc(c(c(c1)Br)F)Cl 26a_100102657272_200011105948 [1,1,0,0,0,0|2,0,0]=4 8045 B12R1.44 CNCc1cc(c(c(c1)Br)F)F 207a_100102657272_200010341283 [1,1,0,0,0,0|2,0,0]=4 8046 B12R1.44 CNCc1cc(c(c(c1)Br)F)F 270004a_106832991635_200010341283 [1,1,0,0,0,0|2,0,0]=4 8047 B12R1.44 CNCc1cc(c(c(c1)C)Br)C 207a_100102657272_100012353953 [1,1,0,0,0,0|2,0,0]=4 8048 B12R1.44 CNCc1cc(c(c(c1)C)Br)C 26a_100102657272_100000243743 [1,1,0,0,0,0|2,0,0]=4 8049 B12R1.44 CNCc1cc(c(c(c1)C)Br)C 270004a_106832991635_100012353953 [1,1,0,0,0,0|2,0,0]=4 8050 B12R1.44 CNCc1cc(c(c(c1)C)Cl)C 207a_100102657272_100000102522 [1,1,0,0,0,0|2,0,0]=4 8051 B12R1.44 CNCc1cc(c(c(c1)C)Cl)C 26a_100102657272_100000739557 [1,1,0,0,0,0|2,0,0]=4 8052 B12R1.44 CNCc1cc(c(c(c1)C)Cl)C 270004a_106832991635_100000102522 [1,1,0,0,0,0|2,0,0]=4 8053 B12R1.44 CNCc1cc(c(c(c1)C)F)C 207a_100102657272_100011352458 [1,1,0,0,0,0|2,0,0]=4 8054 B12R1.44 CNCc1cc(c(c(c1)C)F)C 2230a_106832991635_100011352456 [1,1,0,0,0,0|2,0,0]=4 8055 B12R1.44 CNCc1cc(c(c(c1)C)F)C 270004a_106832991635_100011352458 [1,1,0,0,0,0|2,0,0]=4 8056 B12R1.44 CNCc1cc(c(c(c1)C)F)C 34a_100102657272_100011352456 [1,1,0,0,0,0|2,0,0]=4 8057 B12R1.44 CNCc1cc(c(c(c1)C)F)C 7a_106832991635_100011352456 [1,1,0,0,0,0|2,0,0]=4 8058 B12R1.44 CNCc1cc(c(c(c1)Cl)Br)Cl 207a_100102657272_100010115940 [1,1,0,0,0,0|2,0,0]=4 8059 B12R1.44 CNCc1cc(c(c(c1)Cl)Br)Cl 26a_100102657272_100009888979 [1,1,0,0,0,0|2,0,0]=4 8060 B12R1.44 CNCc1cc(c(c(c1)Cl)Br)Cl 270004a_106832991635_100010115940 [1,1,0,0,0,0|2,0,0]=4 8061 B12R1.44 CNCc1cc(c(c(c1)Cl)Cl)Cl 207a_100102657272_100010151593 [1,1,0,0,0,0|2,0,0]=4 8062 B12R1.44 CNCc1cc(c(c(c1)Cl)Cl)Cl 26a_100102657272_100000074982 [1,1,0,0,0,0|2,0,0]=4 8063 B12R1.44 CNCc1cc(c(c(c1)Cl)Cl)Cl 270004a_106832991635_100010151593 [1,1,0,0,0,0|2,0,0]=4 8064 B12R1.44 CNCc1cc(c(c(c1)Cl)F)Cl 207a_100102657272_100000117590 [1,1,0,0,0,0|2,0,0]=4 8065 B12R1.44 CNCc1cc(c(c(c1)Cl)F)Cl 26a_100102657272_100012242831 [1,1,0,0,0,0|2,0,0]=4 8066 B12R1.44 CNCc1cc(c(c(c1)Cl)F)Cl 270004a_106832991635_100000117590 [1,1,0,0,0,0|2,0,0]=4 8067 B12R1.44 CNCc1cc(c(c(c1)F)Br)F 207a_100102657272_100010074712 [1,1,0,0,0,0|2,0,0]=4 8068 B12R1.44 CNCc1cc(c(c(c1)F)Br)F 26a_100102657272_100009816007 [1,1,0,0,0,0|2,0,0]=4 8069 B12R1.44 CNCc1cc(c(c(c1)F)Br)F 270004a_106832991635_100010074712 [1,1,0,0,0,0|2,0,0]=4 8070 B12R1.44 CNCc1cc(c(c(c1)F)C)F 207a_100102657272_100010871986 [1,1,0,0,0,0|2,0,0]=4 8071 B12R1.44 CNCc1cc(c(c(c1)F)C)F 270004a_106832991635_100010871986 [1,1,0,0,0,0|2,0,0]=4 8072 B12R1.44 CNCc1cc(c(c(c1)F)Cl)F 207a_100102657272_100000104493 [1,1,0,0,0,0|2,0,0]=4 8073 B12R1.44 CNCc1cc(c(c(c1)F)Cl)F 2230a_106832991635_100010769323 [1,1,0,0,0,0|2,0,0]=4 8074 B12R1.44 CNCc1cc(c(c(c1)F)Cl)F 26a_100102657272_100000117300 [1,1,0,0,0,0|2,0,0]=4 8075 B12R1.44 CNCc1cc(c(c(c1)F)Cl)F 270004a_106832991635_100000104493 [1,1,0,0,0,0|2,0,0]=4 8076 B12R1.44 CNCc1cc(c(c(c1)F)Cl)F 34a_100102657272_100010769323 [1,1,0,0,0,0|2,0,0]=4 8077 B12R1.44 CNCc1cc(c(c(c1)F)Cl)F 7a_106832991635_100010769323 [1,1,0,0,0,0|2,0,0]=4 8078 B12R1.44 CNCc1cc(c(c(c1)F)F)C 207a_100102657272_100000051022 [1,1,0,0,0,0|2,0,0]=4 8079 B12R1.44 CNCc1cc(c(c(c1)F)F)C 270004a_106832991635_100000051022 [1,1,0,0,0,0|2,0,0]=4 8080 B12R1.44 CNCc1cc(c(c(c1)F)F)F 207a_100102657272_100000751186 [1,1,0,0,0,0|2,0,0]=4 8081 B12R1.44 CNCc1cc(c(c(c1)F)F)F 2230a_100011216785_200000210301 [1,1,0,0,0,0|2,0,0]=4 8082 B12R1.44 CNCc1cc(c(c(c1)F)F)F 2230a_106832991635_100011216845 [1,1,0,0,0,0|2,0,0]=4 8083 B12R1.44 CNCc1cc(c(c(c1)F)F)F 26a_100102657272_100000237451 [1,1,0,0,0,0|2,0,0]=4 8084 B12R1.44 CNCc1cc(c(c(c1)F)F)F 270004a_106832991635_100000751186 [1,1,0,0,0,0|2,0,0]=4 8085 B12R1.44 CNCc1cc(c(c(c1)F)F)F 34a_100011216785_200000210301 [1,1,0,0,0,0|2,0,0]=4 8086 B12R1.44 CNCc1cc(c(c(c1)F)F)F 34a_100102657272_100011216845 [1,1,0,0,0,0|2,0,0]=4 8087 B12R1.44 CNCc1cc(c(c(c1)F)F)F 7a_106832991635_100011216845 [1,1,0,0,0,0|2,0,0]=4 8088 B12R1.44 CNCc1cc(c(c(c1)F)I)F 207a_100102657272_200010713148 [1,1,0,0,0,0|2,0,0]=4 8089 B12R1.44 CNCc1cc(c(c(c1)F)I)F 270004a_106832991635_200010713148 [1,1,0,0,0,0|2,0,0]=4 8090 B12R1.44 CNCc1cc(c(c(c1)I)C)I 207a_100102657272_100010200668 [1,1,0,0,0,0|2,0,0]=4 8091 B12R1.44 CNCc1cc(c(c(c1)I)F)Br 207a_100102657272_100010270029 [1,1,0,0,0,0|2,0,0]=4 8092 B12R1.44 CNCc1cc(c(c(c1)I)F)Br 270004a_106832991635_100010270029 [1,1,0,0,0,0|2,0,0]=4 8093 B12R1.44 CNCc1cc(c(c(c1)I)I)I 207a_100102657272_200010235600 [1,1,0,0,0,0|2,0,0]=4 8094 B12R1.44 Oc1cc(cc(c1O)F)SCF 62a_100015361967_100010114375 [1,1,0,0,0,0|2,0,0]=4 8095 B12R1.44 Oc1cc(cc(c1O)O)SCF 62a_100015361967_100010658518 [1,1,0,0,0,0|2,0,0]=4 8096 B12R1.44 [13CH3]NCc1cc(c(c(c1)F)F)F 2230a_100011216785_200025704644 [1,1,0,0,0,0|2,0,0]=4 8097 B12R1.44 [13CH3]NCc1cc(c(c(c1)F)F)F 34a_100011216785_200025704644 [1,1,0,0,0,0|2,0,0]=4 8098 B12R1.286 CC=Cc1ccc(c(c1)CO)O 271570a_100016259895_100000184703 [1,1,0,0,0,0|0,0,2]=4 8099 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [1,1,0,0,0,0|0,0,2]=4 8100 B12R1.286 CCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210202 [1,1,0,0,0,0|2,0,0]=4 8101 B12R1.286 CCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000210202 [1,1,0,0,0,0|2,0,0]=4 8102 B12R1.286 CCNc1ccc(c(c1)CO)Br 34a_100012347228_100000210202 [1,1,0,0,0,0|2,0,0]=4 8103 B12R1.286 CCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000210202 [1,1,0,0,0,0|2,0,0]=4 8104 B12R1.286 CCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000210202 [1,1,0,0,0,0|2,0,0]=4 8105 B12R1.286 CCNc1ccc(c(c1)CO)F 34a_100011218011_100000210202 [1,1,0,0,0,0|2,0,0]=4 8106 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [1,1,0,0,0,0|2,0,0]=4 8107 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [1,1,0,0,0,0|2,0,0]=4 8108 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [1,1,0,0,0,0|2,0,0]=4 8109 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [1,1,0,0,0,0|2,0,0]=4 8110 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [1,1,0,0,0,0|2,0,0]=4 8111 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [1,1,0,0,0,0|2,0,0]=4 8112 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [1,1,0,0,0,0|2,0,0]=4 8113 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [1,1,0,0,0,0|2,0,0]=4 8114 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [1,1,0,0,0,0|2,0,0]=4 8115 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [1,1,0,0,0,0|1,0,0]=3 8116 B12R1.286 CCOc1ccc(c(c1)C=O)O 271570a_203496583355_100012345016 [1,1,0,0,0,0|1,0,1]=4 8117 B12R1.286 CCOc1ccc(c(c1)CO)Br 34a_100012351483_100000210202 [1,1,0,0,0,0|2,0,0]=4 8118 B12R1.286 CCOc1ccc(c(c1)CO)Br 7a_100012351483_100000210202 [1,1,0,0,0,0|2,0,0]=4 8119 B12R1.286 CCOc1ccc(c(c1)CO)C 34a_100009878257_100000210202 [1,1,0,0,0,0|2,0,0]=4 8120 B12R1.286 CCOc1ccc(c(c1)CO)C 7a_100009878257_100000210202 [1,1,0,0,0,0|2,0,0]=4 8121 B12R1.286 CCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000210202 [1,1,0,0,0,0|2,0,0]=4 8122 B12R1.286 CCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000210202 [1,1,0,0,0,0|2,0,0]=4 8123 B12R1.286 CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210202 [1,1,0,0,0,0|2,0,0]=4 8124 B12R1.286 CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210202 [1,1,0,0,0,0|2,0,0]=4 8125 B12R1.286 CCOc1ccc(c(c1)OC)C 34a_100009865632_100000210202 [1,1,0,0,0,0|2,0,0]=4 8126 B12R1.286 CCOc1ccc(c(c1)OC)C 7a_100009865632_100000210202 [1,1,0,0,0,0|2,0,0]=4 8127 B12R1.286 CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210202 [1,1,0,0,0,0|2,0,0]=4 8128 B12R1.286 CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210202 [1,1,0,0,0,0|2,0,0]=4 8129 B12R1.286 CCOc1ccc(c(c1)OC)F 34a_100012001760_100000210202 [1,1,0,0,0,0|2,0,0]=4 8130 B12R1.286 CCOc1ccc(c(c1)OC)F 7a_100012001760_100000210202 [1,1,0,0,0,0|2,0,0]=4 8131 B12R1.286 CCOc1ccc(c(c1)OC)N 34a_100015326901_100000210202 [1,1,0,0,0,0|2,0,0]=4 8132 B12R1.286 CCOc1ccc(c(c1)OC)N 7a_100015326901_100000210202 [1,1,0,0,0,0|2,0,0]=4 8133 B12R1.286 CCSc1ccc(c(c1)C#N)O 62a_100000210202_100000687585 [1,1,0,0,0,0|2,0,0]=4 8134 B12R1.286 CCSc1ccc(c(c1)C=O)O 62a_100000210202_100000186750 [1,1,0,0,0,0|1,0,1]=4 8135 B12R1.286 CCSc1ccc(c(c1)CC)O 62a_100000210202_100012338938 [1,1,0,0,0,0|2,0,0]=4 8136 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000210202_100000730032 [1,1,0,0,0,0|2,0,0]=4 8137 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000730032_100000210202 [1,1,0,0,0,0|2,0,0]=4 8138 B12R1.286 CCSc1ccc(c(c1)CO)Br 62a_100000210202_100012359683 [1,1,0,0,0,0|2,0,0]=4 8139 B12R1.286 CCSc1ccc(c(c1)CO)Br 62a_100012359683_100000210202 [1,1,0,0,0,0|2,0,0]=4 8140 B12R1.286 CCSc1ccc(c(c1)CO)C 62a_100000210202_100000700630 [1,1,0,0,0,0|2,0,0]=4 8141 B12R1.286 CCSc1ccc(c(c1)CO)C 62a_100000700630_100000210202 [1,1,0,0,0,0|2,0,0]=4 8142 B12R1.286 CCSc1ccc(c(c1)CO)Cl 62a_100000210202_100010128486 [1,1,0,0,0,0|2,0,0]=4 8143 B12R1.286 CCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000210202 [1,1,0,0,0,0|2,0,0]=4 8144 B12R1.286 CCSc1ccc(c(c1)CO)F 62a_100000210202_100000246282 [1,1,0,0,0,0|2,0,0]=4 8145 B12R1.286 CCSc1ccc(c(c1)CO)F 62a_100000246282_100000210202 [1,1,0,0,0,0|2,0,0]=4 8146 B12R1.286 CCSc1ccc(c(c1)CO)N 62a_100000210202_100012353972 [1,1,0,0,0,0|2,0,0]=4 8147 B12R1.286 CCSc1ccc(c(c1)CO)N 62a_100012353972_100000210202 [1,1,0,0,0,0|2,0,0]=4 8148 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000184703_100000210202 [1,1,0,0,0,0|1,0,0]=3 8149 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000210202_100000184703 [1,1,0,0,0,0|1,0,0]=3 8150 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100000210202_100012353699 [1,1,0,0,0,0|2,0,0]=4 8151 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210202 [1,1,0,0,0,0|2,0,0]=4 8152 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100000210202_100011830276 [1,1,0,0,0,0|2,0,0]=4 8153 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210202 [1,1,0,0,0,0|2,0,0]=4 8154 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100000210202_100011356853 [1,1,0,0,0,0|2,0,0]=4 8155 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210202 [1,1,0,0,0,0|2,0,0]=4 8156 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100000210202_100011934186 [1,1,0,0,0,0|2,0,0]=4 8157 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210202 [1,1,0,0,0,0|2,0,0]=4 8158 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100000210202_100015196925 [1,1,0,0,0,0|2,0,0]=4 8159 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210202 [1,1,0,0,0,0|2,0,0]=4 8160 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [1,1,0,0,0,0|1,0,0]=3 8161 B12R1.286 CCSc1ccc(c(n1)OC)O 62a_100000210202_100010893133 [1,1,0,0,0,0|2,0,0]=4 8162 B12R1.286 CCSc1cnc(c(c1)CO)O 62a_100000210202_100010065268 [1,1,0,0,0,0|2,0,0]=4 8163 B12R1.286 CCSc1cnc(c(c1)CO)O 62a_100010065268_100000210202 [1,1,0,0,0,0|2,0,0]=4 8164 B12R1.286 CCc1cc(ccc1Cl)CNC 26a_100102657272_100000212063 [1,1,0,0,0,0|2,0,0]=4 8165 B12R1.286 CCc1cc(ccc1F)CNC 207a_100102657272_100009840867 [1,1,0,0,0,0|2,0,0]=4 8166 B12R1.286 CCc1cc(ccc1F)CNC 2230a_114873767189_200000210301 [1,1,0,0,0,0|2,0,0]=4 8167 B12R1.286 CCc1cc(ccc1F)CNC 269862a_106832991636_100009840867 [1,1,0,0,0,0|2,0,0]=4 8168 B12R1.286 CCc1cc(ccc1F)CNC 270004a_106832991635_100009840867 [1,1,0,0,0,0|2,0,0]=4 8169 B12R1.286 CCc1cc(ccc1F)CNC 34a_114873767189_200000210301 [1,1,0,0,0,0|2,0,0]=4 8170 B12R1.286 CCc1cc(ccc1F)CN[13CH3] 2230a_114873767189_200025704644 [1,1,0,0,0,0|2,0,0]=4 8171 B12R1.286 CCc1cc(ccc1F)CN[13CH3] 34a_114873767189_200025704644 [1,1,0,0,0,0|2,0,0]=4 8172 B12R1.286 CNCc1ccc(c(c1)C#N)Br 2230a_106832991635_100010128727 [1,1,0,0,0,0|2,0,0]=4 8173 B12R1.286 CNCc1ccc(c(c1)C#N)Br 26a_100102657272_100009818209 [1,1,0,0,0,0|2,0,0]=4 8174 B12R1.286 CNCc1ccc(c(c1)C#N)Br 7a_106832991635_100010128727 [1,1,0,0,0,0|2,0,0]=4 8175 B12R1.286 CNCc1ccc(c(c1)C#N)C 207a_100102657272_100012017333 [1,1,0,0,0,0|2,0,0]=4 8176 B12R1.286 CNCc1ccc(c(c1)C#N)C 270004a_106832991635_100012017333 [1,1,0,0,0,0|2,0,0]=4 8177 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 2230a_106832991635_100010147165 [1,1,0,0,0,0|2,0,0]=4 8178 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 26a_100102657272_100000092820 [1,1,0,0,0,0|2,0,0]=4 8179 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 34a_100009846983_200000210301 [1,1,0,0,0,0|2,0,0]=4 8180 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 7a_106832991635_100010147165 [1,1,0,0,0,0|2,0,0]=4 8181 B12R1.286 CNCc1ccc(c(c1)C#N)F 2230a_106832991635_100000687583 [1,1,0,0,0,0|2,0,0]=4 8182 B12R1.286 CNCc1ccc(c(c1)C#N)F 34a_100016992121_200000210301 [1,1,0,0,0,0|2,0,0]=4 8183 B12R1.286 CNCc1ccc(c(c1)C#N)F 7a_106832991635_100000687583 [1,1,0,0,0,0|2,0,0]=4 8184 B12R1.286 CNCc1ccc(c(c1)C=O)O 7a_106832991635_100000008128 [1,1,0,0,0,0|0,0,1]=3 8185 B12R1.286 CNCc1ccc(c(c1)CO)Br 207a_100102657272_100015639582 [1,1,0,0,0,0|1,0,0]=3 8186 B12R1.286 CNCc1ccc(c(c1)CO)Br 26a_100102657272_100012351483 [1,1,0,0,0,0|1,0,0]=3 8187 B12R1.286 CNCc1ccc(c(c1)CO)Br 270004a_106832991635_100015639582 [1,1,0,0,0,0|1,0,0]=3 8188 B12R1.286 CNCc1ccc(c(c1)CO)Cl 26a_100102657272_100000091669 [1,1,0,0,0,0|1,0,0]=3 8189 B12R1.286 CNCc1ccc(c(c1)OC)Br 207a_100102657272_100010244714 [1,1,0,0,0,0|1,0,0]=3 8190 B12R1.286 CNCc1ccc(c(c1)OC)Br 2230a_106832991635_100010110085 [1,1,0,0,0,0|1,0,0]=3 8191 B12R1.286 CNCc1ccc(c(c1)OC)Br 26a_100102657272_100011827694 [1,1,0,0,0,0|1,0,0]=3 8192 B12R1.286 CNCc1ccc(c(c1)OC)Br 270004a_106832991635_100010244714 [1,1,0,0,0,0|1,0,0]=3 8193 B12R1.286 CNCc1ccc(c(c1)OC)Br 34a_100102657272_100010110085 [1,1,0,0,0,0|1,0,0]=3 8194 B12R1.286 CNCc1ccc(c(c1)OC)Br 7a_106832991635_100010110085 [1,1,0,0,0,0|1,0,0]=3 8195 B12R1.286 CNCc1ccc(c(c1)OC)C 207a_100102657272_100000719150 [1,1,0,0,0,0|1,0,0]=3 8196 B12R1.286 CNCc1ccc(c(c1)OC)C 270004a_106832991635_100000719150 [1,1,0,0,0,0|1,0,0]=3 8197 B12R1.286 CNCc1ccc(c(c1)OC)Cl 207a_100102657272_100011998524 [1,1,0,0,0,0|1,0,0]=3 8198 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_200000210301 [1,1,0,0,0,0|1,0,0]=3 8199 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_106832991635_200010214485 [1,1,0,0,0,0|1,0,0]=3 8200 B12R1.286 CNCc1ccc(c(c1)OC)Cl 26a_100102657272_100012186310 [1,1,0,0,0,0|1,0,0]=3 8201 B12R1.286 CNCc1ccc(c(c1)OC)Cl 270004a_106832991635_100011998524 [1,1,0,0,0,0|1,0,0]=3 8202 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100015204853_200000210301 [1,1,0,0,0,0|1,0,0]=3 8203 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100102657272_200010214485 [1,1,0,0,0,0|1,0,0]=3 8204 B12R1.286 CNCc1ccc(c(c1)OC)Cl 7a_106832991635_200010214485 [1,1,0,0,0,0|1,0,0]=3 8205 B12R1.286 CNCc1ccc(c(c1)OC)F 207a_100102657272_100000692873 [1,1,0,0,0,0|1,0,0]=3 8206 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_100020626639_200000210301 [1,1,0,0,0,0|1,0,0]=3 8207 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_106832991635_100012349856 [1,1,0,0,0,0|1,0,0]=3 8208 B12R1.286 CNCc1ccc(c(c1)OC)F 270004a_106832991635_100000692873 [1,1,0,0,0,0|1,0,0]=3 8209 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100020626639_200000210301 [1,1,0,0,0,0|1,0,0]=3 8210 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100102657272_100012349856 [1,1,0,0,0,0|1,0,0]=3 8211 B12R1.286 CNCc1ccc(c(c1)OC)F 7a_106832991635_100012349856 [1,1,0,0,0,0|1,0,0]=3 8212 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [1,1,0,0,0,0|0,0,0]=2 8213 B12R1.286 CNCc1ccc(c(n1)OC)Br 2230a_106832991635_200010066506 [1,1,0,0,0,0|2,0,0]=4 8214 B12R1.286 CNCc1ccc(c(n1)OC)Br 34a_100102657272_200010066506 [1,1,0,0,0,0|2,0,0]=4 8215 B12R1.286 CNCc1ccc(c(n1)OC)Br 7a_106832991635_200010066506 [1,1,0,0,0,0|2,0,0]=4 8216 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100010234685_200000210301 [1,1,0,0,0,0|2,0,0]=4 8217 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100138415774_100010110085 [1,1,0,0,0,0|2,0,0]=4 8218 B12R1.286 COCc1ccc(c(c1)OC)Br 7a_100010234685_200000210301 [1,1,0,0,0,0|2,0,0]=4 8219 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [1,1,0,0,0,0|2,0,0]=4 8220 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [1,1,0,0,0,0|2,0,0]=4 8221 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100012179228_200000210301 [1,1,0,0,0,0|2,0,0]=4 8222 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100138415774_200010214485 [1,1,0,0,0,0|2,0,0]=4 8223 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100000692429_200000210301 [1,1,0,0,0,0|2,0,0]=4 8224 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100138415774_100012349856 [1,1,0,0,0,0|2,0,0]=4 8225 B12R1.286 COCc1ccc(c(c1)OC)F 7a_100000692429_200000210301 [1,1,0,0,0,0|2,0,0]=4 8226 B12R1.286 COCc1ccc(c(c1)OC)N 34a_100000087641_200000210301 [1,1,0,0,0,0|2,0,0]=4 8227 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 34a_100010234685_200025704644 [1,1,0,0,0,0|2,0,0]=4 8228 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 7a_100010234685_200025704644 [1,1,0,0,0,0|2,0,0]=4 8229 B12R1.286 COc1cc(ccc1Br)CSC 62a_100010110085_200000210301 [1,1,0,0,0,0|2,0,0]=4 8230 B12R1.286 COc1cc(ccc1Br)CSC 62a_200000210301_100010110085 [1,1,0,0,0,0|2,0,0]=4 8231 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_100010110085_200025704644 [1,1,0,0,0,0|2,0,0]=4 8232 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100010110085 [1,1,0,0,0,0|2,0,0]=4 8233 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [1,1,0,0,0,0|2,0,0]=4 8234 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [1,1,0,0,0,0|2,0,0]=4 8235 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 2230a_100015204853_200025704644 [1,1,0,0,0,0|1,0,0]=3 8236 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 34a_100015204853_200025704644 [1,1,0,0,0,0|1,0,0]=3 8237 B12R1.286 COc1cc(ccc1Cl)CO[13CH3] 34a_100012179228_200025704644 [1,1,0,0,0,0|2,0,0]=4 8238 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200000210301_200010214485 [1,1,0,0,0,0|2,0,0]=4 8239 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200010214485_200000210301 [1,1,0,0,0,0|2,0,0]=4 8240 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200010214485_200025704644 [1,1,0,0,0,0|2,0,0]=4 8241 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_200010214485 [1,1,0,0,0,0|2,0,0]=4 8242 B12R1.286 COc1cc(ccc1F)CN[13CH3] 2230a_100020626639_200025704644 [1,1,0,0,0,0|1,0,0]=3 8243 B12R1.286 COc1cc(ccc1F)CN[13CH3] 34a_100020626639_200025704644 [1,1,0,0,0,0|1,0,0]=3 8244 B12R1.286 COc1cc(ccc1F)CO[13CH3] 34a_100000692429_200025704644 [1,1,0,0,0,0|2,0,0]=4 8245 B12R1.286 COc1cc(ccc1F)CO[13CH3] 7a_100000692429_200025704644 [1,1,0,0,0,0|2,0,0]=4 8246 B12R1.286 COc1cc(ccc1F)CSC 62a_100012349856_200000210301 [1,1,0,0,0,0|2,0,0]=4 8247 B12R1.286 COc1cc(ccc1F)CSC 62a_200000210301_100012349856 [1,1,0,0,0,0|2,0,0]=4 8248 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_100012349856_200025704644 [1,1,0,0,0,0|2,0,0]=4 8249 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_200025704644_100012349856 [1,1,0,0,0,0|2,0,0]=4 8250 B12R1.286 COc1cc(ccc1N)CO[13CH3] 34a_100000087641_200025704644 [1,1,0,0,0,0|2,0,0]=4 8251 B12R1.286 COc1cc(ccc1O)CC#N 271570a_203496583355_100010176002 [1,1,0,0,0,0|0,0,2]=4 8252 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [1,1,0,0,0,0|0,0,0]=2 8253 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [1,1,0,0,0,0|2,0,0]=4 8254 B12R1.286 COc1cc(ccc1O)SCF 62a_100015361967_100000694246 [1,1,0,0,0,0|2,0,0]=4 8255 B12R1.286 CSCc1ccc(c(c1)C=O)O 62a_200000210301_100000008128 [1,1,0,0,0,0|1,0,1]=4 8256 B12R1.286 OCc1cc(ccc1O)SCF 62a_100000184703_100015361967 [1,1,0,0,0,0|2,0,0]=4 8257 B12R1.286 OCc1cc(ccc1O)SCF 62a_100015361967_100000184703 [1,1,0,0,0,0|2,0,0]=4 8258 B12R1.286 [13CH3]NCc1ccc(c(c1)C#N)Cl 34a_100009846983_200025704644 [1,1,0,0,0,0|2,0,0]=4 8259 B12R1.286 [13CH3]NCc1ccc(c(c1)C#N)F 34a_100016992121_200025704644 [1,1,0,0,0,0|2,0,0]=4 8260 B12R1.286 [13CH3]SCc1ccc(c(c1)C=O)O 62a_200025704644_100000008128 [1,1,0,0,0,0|1,0,1]=4 8261 B12R1.288 C=Cc1ccc(cc1F)CCC 271570a_100011290941_200010686677 [1,1,0,0,0,0|2,0,0]=4 8262 B12R1.288 CC=Cc1ccc(c(c1)O)CO 271570a_100016259895_100000071718 [1,1,0,0,0,0|0,0,2]=4 8263 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [1,1,0,0,0,0|0,0,2]=4 8264 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200000210301_200010686677 [1,1,0,0,0,0|1,1,0]=4 8265 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200010686677_200000210301 [1,1,0,0,0,0|1,1,0]=4 8266 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200010686677_200025704644 [1,1,0,0,0,0|1,1,0]=4 8267 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_200010686677 [1,1,0,0,0,0|1,1,0]=4 8268 B12R1.288 CCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210202 [1,1,0,0,0,0|2,0,0]=4 8269 B12R1.288 CCNc1ccc(c(c1)C)CO 34a_100000102464_100000210202 [1,1,0,0,0,0|2,0,0]=4 8270 B12R1.288 CCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210202 [1,1,0,0,0,0|2,0,0]=4 8271 B12R1.288 CCNc1ccc(c(c1)C)OC 34a_100000743268_100000210202 [1,1,0,0,0,0|2,0,0]=4 8272 B12R1.288 CCNc1ccc(c(c1)C)OC 7a_100000743268_100000210202 [1,1,0,0,0,0|2,0,0]=4 8273 B12R1.288 CCNc1ccc(c(c1)Cl)CO 34a_100000689119_100000210202 [1,1,0,0,0,0|2,0,0]=4 8274 B12R1.288 CCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210202 [1,1,0,0,0,0|2,0,0]=4 8275 B12R1.288 CCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210202 [1,1,0,0,0,0|2,0,0]=4 8276 B12R1.288 CCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210202 [1,1,0,0,0,0|2,0,0]=4 8277 B12R1.288 CCNc1ccc(c(c1)F)OC 34a_100000740183_100000210202 [1,1,0,0,0,0|2,0,0]=4 8278 B12R1.288 CCNc1ccc(c(c1)I)OC 34a_100011356947_100000210202 [1,1,0,0,0,0|2,0,0]=4 8279 B12R1.288 CCNc1ccc(c(c1)O)C#N 34a_100000094571_100000210202 [1,1,0,0,0,0|2,0,0]=4 8280 B12R1.288 CCNc1ccc(c(c1)O)C#N 7a_100000094571_100000210202 [1,1,0,0,0,0|2,0,0]=4 8281 B12R1.288 CCNc1ccc(c(c1)O)OC 34a_100000211920_100000210202 [1,1,0,0,0,0|1,0,0]=3 8282 B12R1.288 CCOc1ccc(c(c1)Br)CO 34a_100010146404_100000210202 [1,1,0,0,0,0|2,0,0]=4 8283 B12R1.288 CCOc1ccc(c(c1)Br)CO 7a_100010146404_100000210202 [1,1,0,0,0,0|2,0,0]=4 8284 B12R1.288 CCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210202 [1,1,0,0,0,0|2,0,0]=4 8285 B12R1.288 CCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210202 [1,1,0,0,0,0|2,0,0]=4 8286 B12R1.288 CCOc1ccc(c(c1)C)OC 34a_100000759738_100000210202 [1,1,0,0,0,0|2,0,0]=4 8287 B12R1.288 CCOc1ccc(c(c1)C)OC 7a_100000759738_100000210202 [1,1,0,0,0,0|2,0,0]=4 8288 B12R1.288 CCOc1ccc(c(c1)Cl)CO 34a_200000075811_100000210202 [1,1,0,0,0,0|2,0,0]=4 8289 B12R1.288 CCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000210202 [1,1,0,0,0,0|2,0,0]=4 8290 B12R1.288 CCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210202 [1,1,0,0,0,0|2,0,0]=4 8291 B12R1.288 CCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210202 [1,1,0,0,0,0|2,0,0]=4 8292 B12R1.288 CCOc1ccc(c(c1)F)CO 34a_100000084598_100000210202 [1,1,0,0,0,0|2,0,0]=4 8293 B12R1.288 CCOc1ccc(c(c1)F)CO 7a_100000084598_100000210202 [1,1,0,0,0,0|2,0,0]=4 8294 B12R1.288 CCOc1ccc(c(c1)F)OC 34a_100000746305_100000210202 [1,1,0,0,0,0|2,0,0]=4 8295 B12R1.288 CCOc1ccc(c(c1)F)OC 7a_100000746305_100000210202 [1,1,0,0,0,0|2,0,0]=4 8296 B12R1.288 CCOc1ccc(c(c1)I)OC 34a_100010084122_100000210202 [1,1,0,0,0,0|2,0,0]=4 8297 B12R1.288 CCOc1ccc(c(c1)I)OC 7a_100010084122_100000210202 [1,1,0,0,0,0|2,0,0]=4 8298 B12R1.288 CCOc1ccc(c(c1)O)C=O 271570a_203496583355_200012721597 [1,1,0,0,0,0|1,0,1]=4 8299 B12R1.288 CCSc1cc(c(cn1)OC)O 62a_100000210202_100010264082 [1,1,0,0,0,0|2,0,0]=4 8300 B12R1.288 CCSc1ccc(c(c1)Br)CO 62a_100000210202_100010240206 [1,1,0,0,0,0|2,0,0]=4 8301 B12R1.288 CCSc1ccc(c(c1)Br)CO 62a_100010240206_100000210202 [1,1,0,0,0,0|2,0,0]=4 8302 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100000210202_100011249507 [1,1,0,0,0,0|2,0,0]=4 8303 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210202 [1,1,0,0,0,0|2,0,0]=4 8304 B12R1.288 CCSc1ccc(c(c1)C)CO 62a_100000210202_100000748258 [1,1,0,0,0,0|2,0,0]=4 8305 B12R1.288 CCSc1ccc(c(c1)C)CO 62a_100000748258_100000210202 [1,1,0,0,0,0|2,0,0]=4 8306 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100000210202_100011219705 [1,1,0,0,0,0|2,0,0]=4 8307 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100011219705_100000210202 [1,1,0,0,0,0|2,0,0]=4 8308 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100000210202_100012355395 [1,1,0,0,0,0|2,0,0]=4 8309 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210202 [1,1,0,0,0,0|2,0,0]=4 8310 B12R1.288 CCSc1ccc(c(c1)F)CO 62a_100000210202_100011191541 [1,1,0,0,0,0|2,0,0]=4 8311 B12R1.288 CCSc1ccc(c(c1)F)CO 62a_100011191541_100000210202 [1,1,0,0,0,0|2,0,0]=4 8312 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000171752_100000210202 [1,1,0,0,0,0|2,0,0]=4 8313 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000210202_100000171752 [1,1,0,0,0,0|2,0,0]=4 8314 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000210202_100000718831 [1,1,0,0,0,0|2,0,0]=4 8315 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000718831_100000210202 [1,1,0,0,0,0|2,0,0]=4 8316 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100000210202_100011249504 [1,1,0,0,0,0|2,0,0]=4 8317 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100011249504_100000210202 [1,1,0,0,0,0|2,0,0]=4 8318 B12R1.288 CCSc1ccc(c(c1)O)C#N 62a_100000210202_100011934713 [1,1,0,0,0,0|2,0,0]=4 8319 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100000210202_100011277552 [1,1,0,0,0,0|1,0,1]=4 8320 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100011277552_100000210202 [1,1,0,0,0,0|1,0,1]=4 8321 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000071718_100000210202 [1,1,0,0,0,0|1,0,0]=3 8322 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000210202_100000071718 [1,1,0,0,0,0|1,0,0]=3 8323 B12R1.288 CCSc1ccc(c(c1)O)OC 62a_100000210202_100009816560 [1,1,0,0,0,0|1,0,0]=3 8324 B12R1.288 CCSc1cnc(c(c1)O)OC 62a_100000210202_100010135713 [1,1,0,0,0,0|2,0,0]=4 8325 B12R1.288 CCc1ccc(cc1Cl)CNC 26a_100102657272_100009886192 [1,1,0,0,0,0|2,0,0]=4 8326 B12R1.288 CNCc1cc(=O)c(co1)OC 2230a_106832991635_100000081511 [1,1,0,0,0,0|1,0,1]=4 8327 B12R1.288 CNCc1cc(=O)c(co1)OC 7a_106832991635_100000081511 [1,1,0,0,0,0|1,0,1]=4 8328 B12R1.288 CNCc1cc(c(cn1)OC)Br 207a_100102657272_100010893078 [1,1,0,0,0,0|2,0,0]=4 8329 B12R1.288 CNCc1cc(c(cn1)OC)Br 270004a_106832991635_100010893078 [1,1,0,0,0,0|2,0,0]=4 8330 B12R1.288 CNCc1ccc(c(c1)Br)C#N 2230a_106832991635_100012355662 [1,1,0,0,0,0|2,0,0]=4 8331 B12R1.288 CNCc1ccc(c(c1)Br)C#N 26a_100102657272_100012184851 [1,1,0,0,0,0|2,0,0]=4 8332 B12R1.288 CNCc1ccc(c(c1)Br)C#N 270004a_106832991635_100012355660 [1,1,0,0,0,0|2,0,0]=4 8333 B12R1.288 CNCc1ccc(c(c1)Br)C#N 7a_106832991635_100012355662 [1,1,0,0,0,0|2,0,0]=4 8334 B12R1.288 CNCc1ccc(c(c1)Br)CO 26a_100102657272_100010146404 [1,1,0,0,0,0|1,0,0]=3 8335 B12R1.288 CNCc1ccc(c(c1)Br)OC 207a_100102657272_100000173361 [1,1,0,0,0,0|1,0,0]=3 8336 B12R1.288 CNCc1ccc(c(c1)Br)OC 2230a_106832991635_200011397701 [1,1,0,0,0,0|1,0,0]=3 8337 B12R1.288 CNCc1ccc(c(c1)Br)OC 26a_100102657272_100010234764 [1,1,0,0,0,0|1,0,0]=3 8338 B12R1.288 CNCc1ccc(c(c1)Br)OC 270004a_106832991635_100000173361 [1,1,0,0,0,0|1,0,0]=3 8339 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100102657272_200011397701 [1,1,0,0,0,0|1,0,0]=3 8340 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100159240714_200000210301 [1,1,0,0,0,0|1,0,0]=3 8341 B12R1.288 CNCc1ccc(c(c1)Br)OC 7a_106832991635_200011397701 [1,1,0,0,0,0|1,0,0]=3 8342 B12R1.288 CNCc1ccc(c(c1)C)C#N 207a_100102657272_100000720088 [1,1,0,0,0,0|2,0,0]=4 8343 B12R1.288 CNCc1ccc(c(c1)C)C#N 270004a_106832991635_100000720088 [1,1,0,0,0,0|2,0,0]=4 8344 B12R1.288 CNCc1ccc(c(c1)C)OC 207a_100102657272_100000239718 [1,1,0,0,0,0|1,0,0]=3 8345 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_100102679029_200000210301 [1,1,0,0,0,0|1,0,0]=3 8346 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_106832991635_200011290836 [1,1,0,0,0,0|1,0,0]=3 8347 B12R1.288 CNCc1ccc(c(c1)C)OC 270004a_106832991635_100000239718 [1,1,0,0,0,0|1,0,0]=3 8348 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102657272_200011290836 [1,1,0,0,0,0|1,0,0]=3 8349 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102679029_200000210301 [1,1,0,0,0,0|1,0,0]=3 8350 B12R1.288 CNCc1ccc(c(c1)C)OC 7a_106832991635_200011290836 [1,1,0,0,0,0|1,0,0]=3 8351 B12R1.288 CNCc1ccc(c(c1)Cl)C#N 2230a_106832991635_100010147163 [1,1,0,0,0,0|2,0,0]=4 8352 B12R1.288 CNCc1ccc(c(c1)Cl)C#N 26a_100102657272_100000716493 [1,1,0,0,0,0|2,0,0]=4 8353 B12R1.288 CNCc1ccc(c(c1)Cl)C#N 7a_106832991635_100010147163 [1,1,0,0,0,0|2,0,0]=4 8354 B12R1.288 CNCc1ccc(c(c1)Cl)CO 26a_100102657272_200000075811 [1,1,0,0,0,0|1,0,0]=3 8355 B12R1.288 CNCc1ccc(c(c1)Cl)OC 207a_100102657272_100000186747 [1,1,0,0,0,0|1,0,0]=3 8356 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_100000008799_200000210301 [1,1,0,0,0,0|1,0,0]=3 8357 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_106832991635_100000693707 [1,1,0,0,0,0|1,0,0]=3 8358 B12R1.288 CNCc1ccc(c(c1)Cl)OC 26a_100102657272_200009861682 [1,1,0,0,0,0|1,0,0]=3 8359 B12R1.288 CNCc1ccc(c(c1)Cl)OC 270004a_106832991635_100000186747 [1,1,0,0,0,0|1,0,0]=3 8360 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100000008799_200000210301 [1,1,0,0,0,0|1,0,0]=3 8361 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100102657272_100000693707 [1,1,0,0,0,0|1,0,0]=3 8362 B12R1.288 CNCc1ccc(c(c1)Cl)OC 7a_106832991635_100000693707 [1,1,0,0,0,0|1,0,0]=3 8363 B12R1.288 CNCc1ccc(c(c1)F)C#N 2230a_100015204769_200000210301 [1,1,0,0,0,0|2,0,0]=4 8364 B12R1.288 CNCc1ccc(c(c1)F)C#N 2230a_106832991635_100011217145 [1,1,0,0,0,0|2,0,0]=4 8365 B12R1.288 CNCc1ccc(c(c1)F)C#N 34a_100015204769_200000210301 [1,1,0,0,0,0|2,0,0]=4 8366 B12R1.288 CNCc1ccc(c(c1)F)C#N 34a_100102657272_100011217145 [1,1,0,0,0,0|2,0,0]=4 8367 B12R1.288 CNCc1ccc(c(c1)F)C#N 7a_106832991635_100011217145 [1,1,0,0,0,0|2,0,0]=4 8368 B12R1.288 CNCc1ccc(c(c1)F)C=O 2230a_106832991635_100010142638 [1,1,0,0,0,0|1,0,1]=4 8369 B12R1.288 CNCc1ccc(c(c1)F)C=O 34a_100102657272_100010142638 [1,1,0,0,0,0|1,0,1]=4 8370 B12R1.288 CNCc1ccc(c(c1)F)C=O 7a_106832991635_100010142638 [1,1,0,0,0,0|1,0,1]=4 8371 B12R1.288 CNCc1ccc(c(c1)F)OC 207a_100102657272_100000204617 [1,1,0,0,0,0|1,0,0]=3 8372 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_100000737316_200000210301 [1,1,0,0,0,0|1,0,0]=3 8373 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_106832991635_100000189595 [1,1,0,0,0,0|1,0,0]=3 8374 B12R1.288 CNCc1ccc(c(c1)F)OC 270004a_106832991635_100000204617 [1,1,0,0,0,0|1,0,0]=3 8375 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100000737316_200000210301 [1,1,0,0,0,0|1,0,0]=3 8376 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100102657272_100000189595 [1,1,0,0,0,0|1,0,0]=3 8377 B12R1.288 CNCc1ccc(c(c1)F)OC 7a_106832991635_100000189595 [1,1,0,0,0,0|1,0,0]=3 8378 B12R1.288 CNCc1ccc(c(c1)I)OC 207a_100102657272_100009827998 [1,1,0,0,0,0|1,0,0]=3 8379 B12R1.288 CNCc1ccc(c(c1)I)OC 270004a_106832991635_100009827998 [1,1,0,0,0,0|1,0,0]=3 8380 B12R1.288 CNCc1ccc(c(c1)O)OC 34a_100000740000_200000210301 [1,1,0,0,0,0|0,0,0]=2 8381 B12R1.288 CNCc1ccc(c(n1)Br)OC 207a_100102657272_100010174741 [1,1,0,0,0,0|2,0,0]=4 8382 B12R1.288 CNCc1ccc(c(n1)Br)OC 270004a_106832991635_100010174741 [1,1,0,0,0,0|2,0,0]=4 8383 B12R1.288 CNCc1cnc(c(c1)Br)OC 207a_100102657272_200010064893 [1,1,0,0,0,0|2,0,0]=4 8384 B12R1.288 CNCc1cnc(c(c1)Br)OC 270004a_106832991635_200010064893 [1,1,0,0,0,0|2,0,0]=4 8385 B12R1.288 CNCc1cnc(c(c1)C)OC 207a_100102657272_100012183433 [1,1,0,0,0,0|2,0,0]=4 8386 B12R1.288 CNCc1cnc(c(c1)C)OC 270004a_106832991635_100012183433 [1,1,0,0,0,0|2,0,0]=4 8387 B12R1.288 CNCc1cnc(c(c1)Cl)OC 207a_100102657272_100000081810 [1,1,0,0,0,0|2,0,0]=4 8388 B12R1.288 CNCc1cnc(c(c1)Cl)OC 270004a_106832991635_100000081810 [1,1,0,0,0,0|2,0,0]=4 8389 B12R1.288 CNCc1cnc(c(c1)F)OC 207a_100102657272_100000081167 [1,1,0,0,0,0|2,0,0]=4 8390 B12R1.288 CNCc1cnc(c(c1)F)OC 270004a_106832991635_100000081167 [1,1,0,0,0,0|2,0,0]=4 8391 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100000246451_200000210301 [1,1,0,0,0,0|2,0,0]=4 8392 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100138415774_200011397701 [1,1,0,0,0,0|2,0,0]=4 8393 B12R1.288 COCc1ccc(c(c1)Br)OC 7a_100000246451_200000210301 [1,1,0,0,0,0|2,0,0]=4 8394 B12R1.288 COCc1ccc(c(c1)C)OC 34a_100138415774_200011290836 [1,1,0,0,0,0|2,0,0]=4 8395 B12R1.288 COCc1ccc(c(c1)C)OC 34a_200011290855_200000210301 [1,1,0,0,0,0|2,0,0]=4 8396 B12R1.288 COCc1ccc(c(c1)C)OC 7a_200011290855_200000210301 [1,1,0,0,0,0|2,0,0]=4 8397 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100000694469_200000210301 [1,1,0,0,0,0|2,0,0]=4 8398 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100138415774_100000693707 [1,1,0,0,0,0|2,0,0]=4 8399 B12R1.288 COCc1ccc(c(c1)Cl)OC 7a_100000694469_200000210301 [1,1,0,0,0,0|2,0,0]=4 8400 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100000246395_200000210301 [1,1,0,0,0,0|2,0,0]=4 8401 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100138415774_100000189595 [1,1,0,0,0,0|2,0,0]=4 8402 B12R1.288 COCc1ccc(c(c1)F)OC 7a_100000246395_200000210301 [1,1,0,0,0,0|2,0,0]=4 8403 B12R1.288 COCc1ccc(c(c1)I)OC 34a_200000013966_200000210301 [1,1,0,0,0,0|2,0,0]=4 8404 B12R1.288 COCc1ccc(c(c1)I)OC 7a_200000013966_200000210301 [1,1,0,0,0,0|2,0,0]=4 8405 B12R1.288 COCc1ccc(c(c1)N)OC 34a_100011269841_200000210301 [1,1,0,0,0,0|2,0,0]=4 8406 B12R1.288 COc1ccc(cc1Br)CN[13CH3] 34a_100159240714_200025704644 [1,1,0,0,0,0|1,0,0]=3 8407 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 34a_100000246451_200025704644 [1,1,0,0,0,0|2,0,0]=4 8408 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 7a_100000246451_200025704644 [1,1,0,0,0,0|2,0,0]=4 8409 B12R1.288 COc1ccc(cc1Br)CSC 62a_200000210301_200011397701 [1,1,0,0,0,0|2,0,0]=4 8410 B12R1.288 COc1ccc(cc1Br)CSC 62a_200011397701_200000210301 [1,1,0,0,0,0|2,0,0]=4 8411 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200011397701_200025704644 [1,1,0,0,0,0|2,0,0]=4 8412 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200025704644_200011397701 [1,1,0,0,0,0|2,0,0]=4 8413 B12R1.288 COc1ccc(cc1C)CN[13CH3] 2230a_100102679029_200025704644 [1,1,0,0,0,0|1,0,0]=3 8414 B12R1.288 COc1ccc(cc1C)CN[13CH3] 34a_100102679029_200025704644 [1,1,0,0,0,0|1,0,0]=3 8415 B12R1.288 COc1ccc(cc1C)CO[13CH3] 34a_200011290855_200025704644 [1,1,0,0,0,0|2,0,0]=4 8416 B12R1.288 COc1ccc(cc1C)CO[13CH3] 7a_200011290855_200025704644 [1,1,0,0,0,0|2,0,0]=4 8417 B12R1.288 COc1ccc(cc1C)CSC 62a_200000210301_200011290836 [1,1,0,0,0,0|2,0,0]=4 8418 B12R1.288 COc1ccc(cc1C)CSC 62a_200011290836_200000210301 [1,1,0,0,0,0|2,0,0]=4 8419 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200011290836_200025704644 [1,1,0,0,0,0|2,0,0]=4 8420 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200025704644_200011290836 [1,1,0,0,0,0|2,0,0]=4 8421 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 2230a_100000008799_200025704644 [1,1,0,0,0,0|1,0,0]=3 8422 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 34a_100000008799_200025704644 [1,1,0,0,0,0|1,0,0]=3 8423 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 34a_100000694469_200025704644 [1,1,0,0,0,0|2,0,0]=4 8424 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 7a_100000694469_200025704644 [1,1,0,0,0,0|2,0,0]=4 8425 B12R1.288 COc1ccc(cc1Cl)CSC 62a_100000693707_200000210301 [1,1,0,0,0,0|2,0,0]=4 8426 B12R1.288 COc1ccc(cc1Cl)CSC 62a_200000210301_100000693707 [1,1,0,0,0,0|2,0,0]=4 8427 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_100000693707_200025704644 [1,1,0,0,0,0|2,0,0]=4 8428 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100000693707 [1,1,0,0,0,0|2,0,0]=4 8429 B12R1.288 COc1ccc(cc1F)CN[13CH3] 2230a_100000737316_200025704644 [1,1,0,0,0,0|1,0,0]=3 8430 B12R1.288 COc1ccc(cc1F)CN[13CH3] 34a_100000737316_200025704644 [1,1,0,0,0,0|1,0,0]=3 8431 B12R1.288 COc1ccc(cc1F)CO[13CH3] 34a_100000246395_200025704644 [1,1,0,0,0,0|2,0,0]=4 8432 B12R1.288 COc1ccc(cc1F)CO[13CH3] 7a_100000246395_200025704644 [1,1,0,0,0,0|2,0,0]=4 8433 B12R1.288 COc1ccc(cc1F)CSC 62a_100000189595_200000210301 [1,1,0,0,0,0|2,0,0]=4 8434 B12R1.288 COc1ccc(cc1F)CSC 62a_200000210301_100000189595 [1,1,0,0,0,0|2,0,0]=4 8435 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_100000189595_200025704644 [1,1,0,0,0,0|2,0,0]=4 8436 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_200025704644_100000189595 [1,1,0,0,0,0|2,0,0]=4 8437 B12R1.288 COc1ccc(cc1I)CO[13CH3] 34a_200000013966_200025704644 [1,1,0,0,0,0|2,0,0]=4 8438 B12R1.288 COc1ccc(cc1I)CO[13CH3] 7a_200000013966_200025704644 [1,1,0,0,0,0|2,0,0]=4 8439 B12R1.288 COc1ccc(cc1N)CO[13CH3] 34a_100011269841_200025704644 [1,1,0,0,0,0|2,0,0]=4 8440 B12R1.288 COc1ccc(cc1O)CC#N 271570a_203496583355_100011215974 [1,1,0,0,0,0|0,0,2]=4 8441 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [1,1,0,0,0,0|0,0,0]=2 8442 B12R1.288 COc1ccc(cc1O)CCO 271570a_203496583355_100011962876 [1,1,0,0,0,0|1,0,0]=3 8443 B12R1.288 COc1ccc(cc1O)CN[13CH3] 34a_100000740000_200025704644 [1,1,0,0,0,0|0,0,0]=2 8444 B12R1.288 COc1ccc(cc1O)NCF 34a_100000211920_100015361967 [1,1,0,0,0,0|2,0,0]=4 8445 B12R1.288 COc1ccc(cc1O)SCF 62a_100015361967_100009816560 [1,1,0,0,0,0|2,0,0]=4 8446 B12R1.288 OCc1ccc(cc1O)SCF 62a_100000071718_100015361967 [1,1,0,0,0,0|2,0,0]=4 8447 B12R1.288 OCc1ccc(cc1O)SCF 62a_100015361967_100000071718 [1,1,0,0,0,0|2,0,0]=4 8448 B12R1.288 [13CH3]NCc1ccc(c(c1)F)C#N 2230a_100015204769_200025704644 [1,1,0,0,0,0|2,0,0]=4 8449 B12R1.288 [13CH3]NCc1ccc(c(c1)F)C#N 34a_100015204769_200025704644 [1,1,0,0,0,0|2,0,0]=4 8450 B12R1.367 CC(N[13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000743459_200025704644 [1,1,0,0,0,0|2,0,0]=4 8451 B12R1.367 CC(N[13CH3])c1ccc(c(c1)Cl)Cl 34a_100000743459_200025704644 [1,1,0,0,0,0|2,0,0]=4 8452 B12R1.367 CC(N[13CH3])c1ccc(c(c1)F)F 2230a_100000756309_200025704644 [1,1,0,0,0,0|2,0,0]=4 8453 B12R1.367 CC(N[13CH3])c1ccc(c(c1)F)F 34a_100000756309_200025704644 [1,1,0,0,0,0|2,0,0]=4 8454 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [1,1,0,0,0,0|1,0,1]=4 8455 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [1,1,0,0,0,0|1,0,1]=4 8456 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [1,1,0,0,0,0|1,0,1]=4 8457 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [1,1,0,0,0,0|1,0,1]=4 8458 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [1,1,0,0,0,0|1,0,1]=4 8459 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [1,1,0,0,0,0|1,0,1]=4 8460 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [1,1,0,0,0,0|1,0,1]=4 8461 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [1,1,0,0,0,0|1,0,1]=4 8462 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [1,1,0,0,0,0|1,0,1]=4 8463 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [1,1,0,0,0,0|1,0,1]=4 8464 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [1,1,0,0,0,0|1,0,1]=4 8465 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [1,1,0,0,0,0|1,0,1]=4 8466 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [1,1,0,0,0,0|0,0,1]=3 8467 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O 240690a_100102657272_100000189672 [1,1,0,0,0,0|1,0,1]=4 8468 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [1,1,0,0,0,0|1,0,1]=4 8469 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [1,1,0,0,0,0|1,0,1]=4 8470 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 240690a_100102657272_100000212196 [1,1,0,0,0,0|1,0,1]=4 8471 B12R1.367 CNC(=O)c1ccc(c(c1)Cl)O 527a_100102657272_100000212196 [1,1,0,0,0,0|1,0,1]=4 8472 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 240690a_100102657272_100000185466 [1,1,0,0,0,0|1,0,1]=4 8473 B12R1.367 CNC(=O)c1ccc(c(c1)F)O 527a_100102657272_100000185466 [1,1,0,0,0,0|1,0,1]=4 8474 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 1626a_100102657272_100000037485 [1,1,0,0,0,0|1,0,1]=4 8475 B12R1.367 CNC(=O)c1ccc(c(c1)I)O 240690a_100102657272_100000037485 [1,1,0,0,0,0|1,0,1]=4 8476 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 240690a_100102657272_100000689001 [1,1,0,0,0,0|1,0,1]=4 8477 B12R1.367 CNC(=O)c1ccc(c(c1)O)Br 527a_100102657272_100000689001 [1,1,0,0,0,0|1,0,1]=4 8478 B12R1.367 CNC(=O)c1ccc(c(c1)O)C 240690a_100102657272_100000233767 [1,1,0,0,0,0|1,0,1]=4 8479 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 240690a_100102657272_100011933997 [1,1,0,0,0,0|1,0,1]=4 8480 B12R1.367 CNC(=O)c1ccc(c(c1)O)Cl 527a_100102657272_100011933997 [1,1,0,0,0,0|1,0,1]=4 8481 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 240690a_100102657272_100000035894 [1,1,0,0,0,0|1,0,1]=4 8482 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 271570a_203496583355_200012359898 [1,1,0,0,0,0|1,0,1]=4 8483 B12R1.367 CNC(=O)c1ccc(c(c1)O)F 527a_100102657272_100000035894 [1,1,0,0,0,0|1,0,1]=4 8484 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 1626a_100102657272_100000239334 [1,1,0,0,0,0|1,0,1]=4 8485 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 240690a_100102657272_100000239334 [1,1,0,0,0,0|1,0,1]=4 8486 B12R1.367 CNC(=O)c1ccc(c(c1)O)I 527a_100102657272_100000239334 [1,1,0,0,0,0|1,0,1]=4 8487 B12R1.367 CNC(C)c1ccc(c(c1)Br)Br 269862a_106832991636_100009814466 [1,1,0,0,0,0|2,0,0]=4 8488 B12R1.367 CNC(C)c1ccc(c(c1)Br)C 269862a_106832991636_100011934287 [1,1,0,0,0,0|2,0,0]=4 8489 B12R1.367 CNC(C)c1ccc(c(c1)Br)Cl 269862a_106832991636_100012356427 [1,1,0,0,0,0|2,0,0]=4 8490 B12R1.367 CNC(C)c1ccc(c(c1)Br)F 269862a_106832991636_100000239719 [1,1,0,0,0,0|2,0,0]=4 8491 B12R1.367 CNC(C)c1ccc(c(c1)Br)I 269862a_106832991636_100010146554 [1,1,0,0,0,0|2,0,0]=4 8492 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [1,1,0,0,0,0|1,0,0]=3 8493 B12R1.367 CNC(C)c1ccc(c(c1)C)Br 269862a_106832991636_100000697869 [1,1,0,0,0,0|2,0,0]=4 8494 B12R1.367 CNC(C)c1ccc(c(c1)C)C 269862a_106832991636_100000210971 [1,1,0,0,0,0|2,0,0]=4 8495 B12R1.367 CNC(C)c1ccc(c(c1)C)Cl 269862a_106832991636_100011216000 [1,1,0,0,0,0|2,0,0]=4 8496 B12R1.367 CNC(C)c1ccc(c(c1)C)F 2230a_100000705826_200000210301 [1,1,0,0,0,0|2,0,0]=4 8497 B12R1.367 CNC(C)c1ccc(c(c1)C)F 269862a_106832991636_100000754758 [1,1,0,0,0,0|2,0,0]=4 8498 B12R1.367 CNC(C)c1ccc(c(c1)C)F 34a_100000705826_200000210301 [1,1,0,0,0,0|2,0,0]=4 8499 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [1,1,0,0,0,0|1,0,0]=3 8500 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Br 269862a_106832991636_100012353846 [1,1,0,0,0,0|2,0,0]=4 8501 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 2230a_100012005020_200000210301 [1,1,0,0,0,0|2,0,0]=4 8502 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 269862a_106832991636_100012002458 [1,1,0,0,0,0|2,0,0]=4 8503 B12R1.367 CNC(C)c1ccc(c(c1)Cl)C 34a_100012005020_200000210301 [1,1,0,0,0,0|2,0,0]=4 8504 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 2230a_100000743459_200000210301 [1,1,0,0,0,0|2,0,0]=4 8505 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 269862a_106832991636_100000210641 [1,1,0,0,0,0|2,0,0]=4 8506 B12R1.367 CNC(C)c1ccc(c(c1)Cl)Cl 34a_100000743459_200000210301 [1,1,0,0,0,0|2,0,0]=4 8507 B12R1.367 CNC(C)c1ccc(c(c1)Cl)F 269862a_106832991636_100000737303 [1,1,0,0,0,0|2,0,0]=4 8508 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [1,1,0,0,0,0|1,0,0]=3 8509 B12R1.367 CNC(C)c1ccc(c(c1)F)Br 269862a_106832991636_100000690002 [1,1,0,0,0,0|2,0,0]=4 8510 B12R1.367 CNC(C)c1ccc(c(c1)F)C 269862a_106832991636_100000767010 [1,1,0,0,0,0|2,0,0]=4 8511 B12R1.367 CNC(C)c1ccc(c(c1)F)Cl 269862a_106832991636_100000693814 [1,1,0,0,0,0|2,0,0]=4 8512 B12R1.367 CNC(C)c1ccc(c(c1)F)F 2230a_100000756309_200000210301 [1,1,0,0,0,0|2,0,0]=4 8513 B12R1.367 CNC(C)c1ccc(c(c1)F)F 269862a_106832991636_100000184692 [1,1,0,0,0,0|2,0,0]=4 8514 B12R1.367 CNC(C)c1ccc(c(c1)F)F 34a_100000756309_200000210301 [1,1,0,0,0,0|2,0,0]=4 8515 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [1,1,0,0,0,0|1,0,0]=3 8516 B12R1.367 CNC(C)c1ccc(c(c1)I)Br 269862a_106832991636_100010146556 [1,1,0,0,0,0|2,0,0]=4 8517 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [1,1,0,0,0,0|1,0,0]=3 8518 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [1,1,0,0,0,0|1,0,0]=3 8519 B12R1.367 CN[C@@H](C)c1ccc(c(c1)Br)F 2230a_100000753309_200000210301 [1,1,0,0,0,0|2,0,0]=4 8520 B12R1.367 CN[C@@H](C)c1ccc(c(c1)Br)F 34a_100000753309_200000210301 [1,1,0,0,0,0|2,0,0]=4 8521 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)Br 2230a_100134618348_200000210301 [1,1,0,0,0,0|2,0,0]=4 8522 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)Br 34a_100134618348_200000210301 [1,1,0,0,0,0|2,0,0]=4 8523 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 2230a_100011997884_200000210301 [1,1,0,0,0,0|2,0,0]=4 8524 B12R1.367 CN[C@@H](C)c1ccc(c(c1)F)C 34a_100011997884_200000210301 [1,1,0,0,0,0|2,0,0]=4 8525 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 2230a_100015184928_200000210301 [1,1,0,0,0,0|2,0,0]=4 8526 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 34a_100015184928_200000210301 [1,1,0,0,0,0|2,0,0]=4 8527 B12R1.367 CN[C@H](C)c1ccc(c(c1)Cl)F 2230a_100016987892_200000210301 [1,1,0,0,0,0|2,0,0]=4 8528 B12R1.367 CN[C@H](C)c1ccc(c(c1)Cl)F 34a_100016987892_200000210301 [1,1,0,0,0,0|2,0,0]=4 8529 B12R1.367 CN[C@H](C)c1ccc(c(c1)F)Cl 2230a_100016987903_200000210301 [1,1,0,0,0,0|2,0,0]=4 8530 B12R1.367 CN[C@H](C)c1ccc(c(c1)F)Cl 34a_100016987903_200000210301 [1,1,0,0,0,0|2,0,0]=4 8531 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [1,1,0,0,0,0|1,0,1]=4 8532 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [1,1,0,0,0,0|1,0,1]=4 8533 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)Cl)F 2230a_100016987892_200025704644 [1,1,0,0,0,0|2,0,0]=4 8534 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)Cl)F 34a_100016987892_200025704644 [1,1,0,0,0,0|2,0,0]=4 8535 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)F)Cl 2230a_100016987903_200025704644 [1,1,0,0,0,0|2,0,0]=4 8536 B12R1.367 C[C@@H](N[13CH3])c1ccc(c(c1)F)Cl 34a_100016987903_200025704644 [1,1,0,0,0,0|2,0,0]=4 8537 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)Br)F 2230a_100000753309_200025704644 [1,1,0,0,0,0|2,0,0]=4 8538 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)Br)F 34a_100000753309_200025704644 [1,1,0,0,0,0|2,0,0]=4 8539 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)F)Br 2230a_100134618348_200025704644 [1,1,0,0,0,0|2,0,0]=4 8540 B12R1.367 C[C@H](N[13CH3])c1ccc(c(c1)F)Br 34a_100134618348_200025704644 [1,1,0,0,0,0|2,0,0]=4 8541 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 2230a_100000705826_200025704644 [1,1,0,0,0,0|2,0,0]=4 8542 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 34a_100000705826_200025704644 [1,1,0,0,0,0|2,0,0]=4 8543 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 2230a_100015184928_200025704644 [1,1,0,0,0,0|2,0,0]=4 8544 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 34a_100015184928_200025704644 [1,1,0,0,0,0|2,0,0]=4 8545 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 2230a_100012005020_200025704644 [1,1,0,0,0,0|2,0,0]=4 8546 B12R1.367 Cc1ccc(cc1Cl)C(C)N[13CH3] 34a_100012005020_200025704644 [1,1,0,0,0,0|2,0,0]=4 8547 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 2230a_100011997884_200025704644 [1,1,0,0,0,0|2,0,0]=4 8548 B12R1.367 Cc1ccc(cc1F)[C@H](C)N[13CH3] 34a_100011997884_200025704644 [1,1,0,0,0,0|2,0,0]=4 8549 B12R1.367 NCC(=O)c1ccc(c(c1)F)O 271570a_203496583355_100016989600 [1,1,0,0,0,0|1,0,1]=4 8550 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [1,1,0,0,0,0|1,0,1]=4 8551 B12R1.544 CCNc1ccc(c(c1C)C)O 34a_200011216674_100000210202 [1,1,0,0,0,0|2,0,0]=4 8552 B12R1.544 CCNc1ccc(c(c1C)C)O 7a_200011216674_100000210202 [1,1,0,0,0,0|2,0,0]=4 8553 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000210202 [1,1,0,0,0,0|2,0,0]=4 8554 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000210202 [1,1,0,0,0,0|2,0,0]=4 8555 B12R1.544 CCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000210202 [1,1,0,0,0,0|2,0,0]=4 8556 B12R1.544 CCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000210202 [1,1,0,0,0,0|2,0,0]=4 8557 B12R1.544 CCNc1ccc(c(c1F)C)O 34a_200000126710_100000210202 [1,1,0,0,0,0|2,0,0]=4 8558 B12R1.544 CCNc1ccc(c(c1F)C)O 7a_200000126710_100000210202 [1,1,0,0,0,0|2,0,0]=4 8559 B12R1.544 CCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000210202 [1,1,0,0,0,0|2,0,0]=4 8560 B12R1.544 CCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000210202 [1,1,0,0,0,0|2,0,0]=4 8561 B12R1.544 CCNc1ccc(c(c1F)F)O 34a_100015204651_100000210202 [1,1,0,0,0,0|2,0,0]=4 8562 B12R1.544 CCNc1ccc(c(c1F)F)O 7a_100015204651_100000210202 [1,1,0,0,0,0|2,0,0]=4 8563 B12R1.544 CCOc1ccc(c(c1F)F)O 271570a_203496583355_100010177744 [1,1,0,0,0,0|2,0,0]=4 8564 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100000210202_100012353674 [1,1,0,0,0,0|2,0,0]=4 8565 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100012353674_100000210202 [1,1,0,0,0,0|2,0,0]=4 8566 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100000210202_100013039247 [1,1,0,0,0,0|2,0,0]=4 8567 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100013039247_100000210202 [1,1,0,0,0,0|2,0,0]=4 8568 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100000210202_100010390934 [1,1,0,0,0,0|2,0,0]=4 8569 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100010390934_100000210202 [1,1,0,0,0,0|2,0,0]=4 8570 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100000210202_100011830415 [1,1,0,0,0,0|2,0,0]=4 8571 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100011830415_100000210202 [1,1,0,0,0,0|2,0,0]=4 8572 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_100000210202_200010782288 [1,1,0,0,0,0|2,0,0]=4 8573 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210202 [1,1,0,0,0,0|2,0,0]=4 8574 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100000210202_100010167067 [1,1,0,0,0,0|2,0,0]=4 8575 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100010167067_100000210202 [1,1,0,0,0,0|2,0,0]=4 8576 B12R1.544 CCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210202 [1,1,0,0,0,0|2,0,0]=4 8577 B12R1.544 CNCc1ccc(c(c1Br)F)F 207a_100102657272_100015087033 [1,1,0,0,0,0|2,0,0]=4 8578 B12R1.544 CNCc1ccc(c(c1Br)F)F 2230a_106832991635_100016216887 [1,1,0,0,0,0|2,0,0]=4 8579 B12R1.544 CNCc1ccc(c(c1Br)F)F 34a_100102657272_100016216887 [1,1,0,0,0,0|2,0,0]=4 8580 B12R1.544 CNCc1ccc(c(c1Br)F)F 7a_106832991635_100016216887 [1,1,0,0,0,0|2,0,0]=4 8581 B12R1.544 CNCc1ccc(c(c1C)Br)C 26a_100102657272_100010659238 [1,1,0,0,0,0|2,0,0]=4 8582 B12R1.544 CNCc1ccc(c(c1C)F)Br 26a_100102657272_100010390934 [1,1,0,0,0,0|2,0,0]=4 8583 B12R1.544 CNCc1ccc(c(c1C)F)F 207a_100102657272_100000070781 [1,1,0,0,0,0|2,0,0]=4 8584 B12R1.544 CNCc1ccc(c(c1C)F)F 2230a_103437846394_200000210301 [1,1,0,0,0,0|2,0,0]=4 8585 B12R1.544 CNCc1ccc(c(c1C)F)F 270004a_106832991635_100000070781 [1,1,0,0,0,0|2,0,0]=4 8586 B12R1.544 CNCc1ccc(c(c1C)F)F 34a_103437846394_200000210301 [1,1,0,0,0,0|2,0,0]=4 8587 B12R1.544 CNCc1ccc(c(c1Cl)C)Br 26a_100102657272_100021574527 [1,1,0,0,0,0|2,0,0]=4 8588 B12R1.544 CNCc1ccc(c(c1Cl)C)F 207a_100102657272_100009872231 [1,1,0,0,0,0|2,0,0]=4 8589 B12R1.544 CNCc1ccc(c(c1Cl)C)F 270004a_106832991635_100009872231 [1,1,0,0,0,0|2,0,0]=4 8590 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Br 26a_100102657272_100011988769 [1,1,0,0,0,0|2,0,0]=4 8591 B12R1.544 CNCc1ccc(c(c1Cl)Cl)C 207a_100102657272_100009830617 [1,1,0,0,0,0|2,0,0]=4 8592 B12R1.544 CNCc1ccc(c(c1Cl)Cl)C 270004a_106832991635_100009830617 [1,1,0,0,0,0|2,0,0]=4 8593 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Cl 207a_100102657272_100009994748 [1,1,0,0,0,0|2,0,0]=4 8594 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Cl 26a_100102657272_200011215298 [1,1,0,0,0,0|2,0,0]=4 8595 B12R1.544 CNCc1ccc(c(c1Cl)Cl)Cl 270004a_106832991635_100009994748 [1,1,0,0,0,0|2,0,0]=4 8596 B12R1.544 CNCc1ccc(c(c1Cl)F)Br 26a_100102657272_100010245746 [1,1,0,0,0,0|2,0,0]=4 8597 B12R1.544 CNCc1ccc(c(c1Cl)F)Cl 207a_100102657272_100010892301 [1,1,0,0,0,0|2,0,0]=4 8598 B12R1.544 CNCc1ccc(c(c1Cl)F)Cl 270004a_106832991635_100010892301 [1,1,0,0,0,0|2,0,0]=4 8599 B12R1.544 CNCc1ccc(c(c1Cl)F)F 207a_100102657272_100009876578 [1,1,0,0,0,0|2,0,0]=4 8600 B12R1.544 CNCc1ccc(c(c1F)Br)C 207a_100102657272_100010381662 [1,1,0,0,0,0|2,0,0]=4 8601 B12R1.544 CNCc1ccc(c(c1F)Br)C 270004a_106832991635_100010381662 [1,1,0,0,0,0|2,0,0]=4 8602 B12R1.544 CNCc1ccc(c(c1F)Br)F 207a_100102657272_100010713142 [1,1,0,0,0,0|2,0,0]=4 8603 B12R1.544 CNCc1ccc(c(c1F)C)Br 207a_100102657272_100015546853 [1,1,0,0,0,0|2,0,0]=4 8604 B12R1.544 CNCc1ccc(c(c1F)C)Br 270004a_106832991635_100015546853 [1,1,0,0,0,0|2,0,0]=4 8605 B12R1.544 CNCc1ccc(c(c1F)C)F 207a_100102657272_100000068945 [1,1,0,0,0,0|2,0,0]=4 8606 B12R1.544 CNCc1ccc(c(c1F)C)F 2230a_200000062210_200000210301 [1,1,0,0,0,0|2,0,0]=4 8607 B12R1.544 CNCc1ccc(c(c1F)C)F 270004a_106832991635_100000068945 [1,1,0,0,0,0|2,0,0]=4 8608 B12R1.544 CNCc1ccc(c(c1F)C)F 34a_200000062210_200000210301 [1,1,0,0,0,0|2,0,0]=4 8609 B12R1.544 CNCc1ccc(c(c1F)Cl)Cl 207a_100102657272_100009892358 [1,1,0,0,0,0|2,0,0]=4 8610 B12R1.544 CNCc1ccc(c(c1F)Cl)Cl 270004a_106832991635_100009892358 [1,1,0,0,0,0|2,0,0]=4 8611 B12R1.544 CNCc1ccc(c(c1F)Cl)F 207a_100102657272_100000050342 [1,1,0,0,0,0|2,0,0]=4 8612 B12R1.544 CNCc1ccc(c(c1F)Cl)F 2230a_100000062223_200000210301 [1,1,0,0,0,0|2,0,0]=4 8613 B12R1.544 CNCc1ccc(c(c1F)Cl)F 2230a_106832991635_100009814552 [1,1,0,0,0,0|2,0,0]=4 8614 B12R1.544 CNCc1ccc(c(c1F)Cl)F 270004a_106832991635_100000050342 [1,1,0,0,0,0|2,0,0]=4 8615 B12R1.544 CNCc1ccc(c(c1F)Cl)F 34a_100000062223_200000210301 [1,1,0,0,0,0|2,0,0]=4 8616 B12R1.544 CNCc1ccc(c(c1F)Cl)F 34a_100102657272_100009814552 [1,1,0,0,0,0|2,0,0]=4 8617 B12R1.544 CNCc1ccc(c(c1F)Cl)F 7a_106832991635_100009814552 [1,1,0,0,0,0|2,0,0]=4 8618 B12R1.544 CNCc1ccc(c(c1F)F)Br 207a_100102657272_100011361484 [1,1,0,0,0,0|2,0,0]=4 8619 B12R1.544 CNCc1ccc(c(c1F)F)Br 2230a_100020621914_200000210301 [1,1,0,0,0,0|2,0,0]=4 8620 B12R1.544 CNCc1ccc(c(c1F)F)Br 26a_100102657272_100011830415 [1,1,0,0,0,0|2,0,0]=4 8621 B12R1.544 CNCc1ccc(c(c1F)F)Br 34a_100020621914_200000210301 [1,1,0,0,0,0|2,0,0]=4 8622 B12R1.544 CNCc1ccc(c(c1F)F)C 207a_100102657272_100011216850 [1,1,0,0,0,0|2,0,0]=4 8623 B12R1.544 CNCc1ccc(c(c1F)F)C 2230a_102516457222_200000210301 [1,1,0,0,0,0|2,0,0]=4 8624 B12R1.544 CNCc1ccc(c(c1F)F)C 2230a_106832991635_100009813564 [1,1,0,0,0,0|2,0,0]=4 8625 B12R1.544 CNCc1ccc(c(c1F)F)C 34a_100102657272_100009813564 [1,1,0,0,0,0|2,0,0]=4 8626 B12R1.544 CNCc1ccc(c(c1F)F)C 34a_102516457222_200000210301 [1,1,0,0,0,0|2,0,0]=4 8627 B12R1.544 CNCc1ccc(c(c1F)F)C 7a_106832991635_100009813564 [1,1,0,0,0,0|2,0,0]=4 8628 B12R1.544 CNCc1ccc(c(c1F)F)F 207a_100102657272_100011215601 [1,1,0,0,0,0|2,0,0]=4 8629 B12R1.544 CNCc1ccc(c(c1F)F)F 2230a_102516457209_200000210301 [1,1,0,0,0,0|2,0,0]=4 8630 B12R1.544 CNCc1ccc(c(c1F)F)F 2230a_106832991635_100011218744 [1,1,0,0,0,0|2,0,0]=4 8631 B12R1.544 CNCc1ccc(c(c1F)F)F 26a_100102657272_100000230025 [1,1,0,0,0,0|2,0,0]=4 8632 B12R1.544 CNCc1ccc(c(c1F)F)F 34a_100102657272_100011218744 [1,1,0,0,0,0|2,0,0]=4 8633 B12R1.544 CNCc1ccc(c(c1F)F)F 34a_102516457209_200000210301 [1,1,0,0,0,0|2,0,0]=4 8634 B12R1.544 CNCc1ccc(c(c1F)F)F 7a_106832991635_100011218744 [1,1,0,0,0,0|2,0,0]=4 8635 B12R1.544 CNCc1ccc(c(c1F)F)I 207a_100102657272_100010209662 [1,1,0,0,0,0|2,0,0]=4 8636 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 2230a_200000062210_200025704644 [1,1,0,0,0,0|2,0,0]=4 8637 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 34a_200000062210_200025704644 [1,1,0,0,0,0|2,0,0]=4 8638 B12R1.544 Cc1c(ccc(c1F)F)CN[13CH3] 2230a_103437846394_200025704644 [1,1,0,0,0,0|2,0,0]=4 8639 B12R1.544 Cc1c(ccc(c1F)F)CN[13CH3] 34a_103437846394_200025704644 [1,1,0,0,0,0|2,0,0]=4 8640 B12R1.544 Cc1ccc(c(c1F)F)CN[13CH3] 2230a_102516457222_200025704644 [1,1,0,0,0,0|2,0,0]=4 8641 B12R1.544 Cc1ccc(c(c1F)F)CN[13CH3] 34a_102516457222_200025704644 [1,1,0,0,0,0|2,0,0]=4 8642 B12R1.544 [13CH3]NCc1ccc(c(c1F)Cl)F 2230a_100000062223_200025704644 [1,1,0,0,0,0|2,0,0]=4 8643 B12R1.544 [13CH3]NCc1ccc(c(c1F)Cl)F 34a_100000062223_200025704644 [1,1,0,0,0,0|2,0,0]=4 8644 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)Br 2230a_100020621914_200025704644 [1,1,0,0,0,0|2,0,0]=4 8645 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)Br 34a_100020621914_200025704644 [1,1,0,0,0,0|2,0,0]=4 8646 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)F 2230a_102516457209_200025704644 [1,1,0,0,0,0|2,0,0]=4 8647 B12R1.544 [13CH3]NCc1ccc(c(c1F)F)F 34a_102516457209_200025704644 [1,1,0,0,0,0|2,0,0]=4 8648 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000210202 [1,1,0,0,0,0|2,0,0]=4 8649 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000210202 [1,1,0,0,0,0|2,0,0]=4 8650 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000210202 [1,1,0,0,0,0|2,0,0]=4 8651 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000210202 [1,1,0,0,0,0|2,0,0]=4 8652 B12R1.1123 CCNc1cc(c(cc1C)O)C 34a_100000720036_100000210202 [1,1,0,0,0,0|2,0,0]=4 8653 B12R1.1123 CCNc1cc(c(cc1C)O)C 7a_100000720036_100000210202 [1,1,0,0,0,0|2,0,0]=4 8654 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000210202 [1,1,0,0,0,0|2,0,0]=4 8655 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000210202 [1,1,0,0,0,0|2,0,0]=4 8656 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000210202 [1,1,0,0,0,0|2,0,0]=4 8657 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000210202 [1,1,0,0,0,0|2,0,0]=4 8658 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000210202 [1,1,0,0,0,0|2,0,0]=4 8659 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000210202 [1,1,0,0,0,0|2,0,0]=4 8660 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000210202 [1,1,0,0,0,0|2,0,0]=4 8661 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000210202 [1,1,0,0,0,0|2,0,0]=4 8662 B12R1.1123 CCNc1cc(c(cc1F)C)O 34a_100000117193_100000210202 [1,1,0,0,0,0|2,0,0]=4 8663 B12R1.1123 CCNc1cc(c(cc1F)C)O 7a_100000117193_100000210202 [1,1,0,0,0,0|2,0,0]=4 8664 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000210202 [1,1,0,0,0,0|2,0,0]=4 8665 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000210202 [1,1,0,0,0,0|2,0,0]=4 8666 B12R1.1123 CCNc1cc(c(cc1F)F)O 34a_100011219470_100000210202 [1,1,0,0,0,0|2,0,0]=4 8667 B12R1.1123 CCNc1cc(c(cc1F)F)O 7a_100011219470_100000210202 [1,1,0,0,0,0|2,0,0]=4 8668 B12R1.1123 CCNc1cc(c(cc1F)O)F 34a_100020635945_100000210202 [1,1,0,0,0,0|2,0,0]=4 8669 B12R1.1123 CCNc1cc(c(cc1F)O)F 7a_100020635945_100000210202 [1,1,0,0,0,0|2,0,0]=4 8670 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100000210202_100021297947 [1,1,0,0,0,0|2,0,0]=4 8671 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000210202 [1,1,0,0,0,0|2,0,0]=4 8672 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100000210202_100010068922 [1,1,0,0,0,0|2,0,0]=4 8673 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100010068922_100000210202 [1,1,0,0,0,0|2,0,0]=4 8674 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_100000210202_200010107346 [1,1,0,0,0,0|2,0,0]=4 8675 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_200010107346_100000210202 [1,1,0,0,0,0|2,0,0]=4 8676 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000210202_100000698207 [1,1,0,0,0,0|2,0,0]=4 8677 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000698207_100000210202 [1,1,0,0,0,0|2,0,0]=4 8678 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100000210202_100012355673 [1,1,0,0,0,0|2,0,0]=4 8679 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100012355673_100000210202 [1,1,0,0,0,0|2,0,0]=4 8680 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_100000210202_200010235796 [1,1,0,0,0,0|2,0,0]=4 8681 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_200010235796_100000210202 [1,1,0,0,0,0|2,0,0]=4 8682 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100000210202_100011011175 [1,1,0,0,0,0|2,0,0]=4 8683 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000210202 [1,1,0,0,0,0|2,0,0]=4 8684 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100000210202_100014242602 [1,1,0,0,0,0|2,0,0]=4 8685 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100014242602_100000210202 [1,1,0,0,0,0|2,0,0]=4 8686 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100000210202_100010735246 [1,1,0,0,0,0|2,0,0]=4 8687 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000210202 [1,1,0,0,0,0|2,0,0]=4 8688 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100000210202_100012457948 [1,1,0,0,0,0|2,0,0]=4 8689 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100012457948_100000210202 [1,1,0,0,0,0|2,0,0]=4 8690 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100000210202_100013038943 [1,1,0,0,0,0|2,0,0]=4 8691 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100013038943_100000210202 [1,1,0,0,0,0|2,0,0]=4 8692 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100000210202_100011830439 [1,1,0,0,0,0|2,0,0]=4 8693 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100011830439_100000210202 [1,1,0,0,0,0|2,0,0]=4 8694 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100000210202_100012359894 [1,1,0,0,0,0|2,0,0]=4 8695 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100012359894_100000210202 [1,1,0,0,0,0|2,0,0]=4 8696 B12R1.1123 CNCc1cc(c(cc1Br)C)C 26a_100102657272_100009814663 [1,1,0,0,0,0|2,0,0]=4 8697 B12R1.1123 CNCc1cc(c(cc1Br)C)F 207a_100102657272_100010186290 [1,1,0,0,0,0|2,0,0]=4 8698 B12R1.1123 CNCc1cc(c(cc1Br)C)F 270004a_106832991635_100010186290 [1,1,0,0,0,0|2,0,0]=4 8699 B12R1.1123 CNCc1cc(c(cc1Br)Cl)C 26a_100102657272_100022700756 [1,1,0,0,0,0|2,0,0]=4 8700 B12R1.1123 CNCc1cc(c(cc1Br)Cl)F 270004a_106832991635_100010270164 [1,1,0,0,0,0|2,0,0]=4 8701 B12R1.1123 CNCc1cc(c(cc1Br)F)C 207a_100102657272_100009814814 [1,1,0,0,0,0|2,0,0]=4 8702 B12R1.1123 CNCc1cc(c(cc1Br)F)C 270004a_106832991635_100009814814 [1,1,0,0,0,0|2,0,0]=4 8703 B12R1.1123 CNCc1cc(c(cc1Br)F)F 2230a_106832991635_100010077255 [1,1,0,0,0,0|2,0,0]=4 8704 B12R1.1123 CNCc1cc(c(cc1Br)F)F 26a_100102657272_100009813768 [1,1,0,0,0,0|2,0,0]=4 8705 B12R1.1123 CNCc1cc(c(cc1Br)F)F 270004a_106832991635_100012344232 [1,1,0,0,0,0|2,0,0]=4 8706 B12R1.1123 CNCc1cc(c(cc1Br)F)F 34a_100102657272_100010077255 [1,1,0,0,0,0|2,0,0]=4 8707 B12R1.1123 CNCc1cc(c(cc1Br)F)F 7a_106832991635_100010077255 [1,1,0,0,0,0|2,0,0]=4 8708 B12R1.1123 CNCc1cc(c(cc1Br)N)Br 26a_100102657272_100011080774 [1,1,0,0,0,0|2,0,0]=4 8709 B12R1.1123 CNCc1cc(c(cc1C)Br)C 207a_100102657272_100012024176 [1,1,0,0,0,0|2,0,0]=4 8710 B12R1.1123 CNCc1cc(c(cc1C)Br)C 26a_100102657272_100000698207 [1,1,0,0,0,0|2,0,0]=4 8711 B12R1.1123 CNCc1cc(c(cc1C)Br)C 270004a_106832991635_100012024176 [1,1,0,0,0,0|2,0,0]=4 8712 B12R1.1123 CNCc1cc(c(cc1C)Br)F 207a_100102657272_100010186292 [1,1,0,0,0,0|2,0,0]=4 8713 B12R1.1123 CNCc1cc(c(cc1C)Br)F 270004a_106832991635_100010186292 [1,1,0,0,0,0|2,0,0]=4 8714 B12R1.1123 CNCc1cc(c(cc1C)C)C 207a_100102657272_100000211818 [1,1,0,0,0,0|2,0,0]=4 8715 B12R1.1123 CNCc1cc(c(cc1C)C)C 270004a_106832991635_100000211818 [1,1,0,0,0,0|2,0,0]=4 8716 B12R1.1123 CNCc1cc(c(cc1C)Cl)Cl 207a_100102657272_100010724756 [1,1,0,0,0,0|2,0,0]=4 8717 B12R1.1123 CNCc1cc(c(cc1C)Cl)Cl 270004a_106832991635_100010724756 [1,1,0,0,0,0|2,0,0]=4 8718 B12R1.1123 CNCc1cc(c(cc1C)F)Br 26a_100102657272_100014242602 [1,1,0,0,0,0|2,0,0]=4 8719 B12R1.1123 CNCc1cc(c(cc1Cl)Br)C 26a_100102657272_200012350488 [1,1,0,0,0,0|2,0,0]=4 8720 B12R1.1123 CNCc1cc(c(cc1Cl)Br)Cl 26a_100102657272_100000719705 [1,1,0,0,0,0|2,0,0]=4 8721 B12R1.1123 CNCc1cc(c(cc1Cl)Br)F 207a_100102657272_100010172941 [1,1,0,0,0,0|2,0,0]=4 8722 B12R1.1123 CNCc1cc(c(cc1Cl)Br)F 26a_100102657272_100000726166 [1,1,0,0,0,0|2,0,0]=4 8723 B12R1.1123 CNCc1cc(c(cc1Cl)Br)F 270004a_106832991635_100010172941 [1,1,0,0,0,0|2,0,0]=4 8724 B12R1.1123 CNCc1cc(c(cc1Cl)Br)I 26a_100102657272_100021297947 [1,1,0,0,0,0|2,0,0]=4 8725 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Br 26a_100102657272_100010203734 [1,1,0,0,0,0|2,0,0]=4 8726 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)C 26a_100102657272_100012002691 [1,1,0,0,0,0|2,0,0]=4 8727 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 207a_100102657272_100010220946 [1,1,0,0,0,0|2,0,0]=4 8728 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 2230a_106832991635_100010220947 [1,1,0,0,0,0|2,0,0]=4 8729 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 26a_100102657272_100000211312 [1,1,0,0,0,0|2,0,0]=4 8730 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 270004a_106832991635_100010220946 [1,1,0,0,0,0|2,0,0]=4 8731 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 34a_100102657272_100010220947 [1,1,0,0,0,0|2,0,0]=4 8732 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)Cl 7a_106832991635_100010220947 [1,1,0,0,0,0|2,0,0]=4 8733 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 207a_100102657272_100000036543 [1,1,0,0,0,0|2,0,0]=4 8734 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 2230a_106832991635_100009813697 [1,1,0,0,0,0|2,0,0]=4 8735 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 2230a_114828290983_200000210301 [1,1,0,0,0,0|2,0,0]=4 8736 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 270004a_106832991635_100000036543 [1,1,0,0,0,0|2,0,0]=4 8737 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 34a_100102657272_100009813697 [1,1,0,0,0,0|2,0,0]=4 8738 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 34a_114828290983_200000210301 [1,1,0,0,0,0|2,0,0]=4 8739 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)F 7a_106832991635_100009813697 [1,1,0,0,0,0|2,0,0]=4 8740 B12R1.1123 CNCc1cc(c(cc1Cl)F)Br 207a_100102657272_100015727512 [1,1,0,0,0,0|2,0,0]=4 8741 B12R1.1123 CNCc1cc(c(cc1Cl)F)Br 26a_100102657272_100010189047 [1,1,0,0,0,0|2,0,0]=4 8742 B12R1.1123 CNCc1cc(c(cc1Cl)F)Br 270004a_106832991635_100015727512 [1,1,0,0,0,0|2,0,0]=4 8743 B12R1.1123 CNCc1cc(c(cc1Cl)F)Cl 207a_100102657272_100010623807 [1,1,0,0,0,0|2,0,0]=4 8744 B12R1.1123 CNCc1cc(c(cc1Cl)F)Cl 270004a_106832991635_100010623807 [1,1,0,0,0,0|2,0,0]=4 8745 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 207a_100102657272_100011998482 [1,1,0,0,0,0|2,0,0]=4 8746 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 2230a_100011830481_200000210301 [1,1,0,0,0,0|2,0,0]=4 8747 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 2230a_106832991635_100011830393 [1,1,0,0,0,0|2,0,0]=4 8748 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 26a_100102657272_100009848785 [1,1,0,0,0,0|2,0,0]=4 8749 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 270004a_106832991635_100011998482 [1,1,0,0,0,0|2,0,0]=4 8750 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 34a_100011830481_200000210301 [1,1,0,0,0,0|2,0,0]=4 8751 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 34a_100102657272_100011830393 [1,1,0,0,0,0|2,0,0]=4 8752 B12R1.1123 CNCc1cc(c(cc1Cl)F)F 7a_106832991635_100011830393 [1,1,0,0,0,0|2,0,0]=4 8753 B12R1.1123 CNCc1cc(c(cc1F)Br)C 207a_100102657272_100010186291 [1,1,0,0,0,0|2,0,0]=4 8754 B12R1.1123 CNCc1cc(c(cc1F)Br)C 26a_100102657272_100012355673 [1,1,0,0,0,0|2,0,0]=4 8755 B12R1.1123 CNCc1cc(c(cc1F)Br)C 270004a_106832991635_100010186291 [1,1,0,0,0,0|2,0,0]=4 8756 B12R1.1123 CNCc1cc(c(cc1F)Br)Cl 207a_100102657272_100013713083 [1,1,0,0,0,0|2,0,0]=4 8757 B12R1.1123 CNCc1cc(c(cc1F)Br)F 207a_100102657272_100012024334 [1,1,0,0,0,0|2,0,0]=4 8758 B12R1.1123 CNCc1cc(c(cc1F)Br)F 2230a_106832991635_100012024439 [1,1,0,0,0,0|2,0,0]=4 8759 B12R1.1123 CNCc1cc(c(cc1F)Br)F 26a_100102657272_100011830439 [1,1,0,0,0,0|2,0,0]=4 8760 B12R1.1123 CNCc1cc(c(cc1F)Br)F 270004a_106832991635_100012024334 [1,1,0,0,0,0|2,0,0]=4 8761 B12R1.1123 CNCc1cc(c(cc1F)Br)F 34a_100102657272_100012024439 [1,1,0,0,0,0|2,0,0]=4 8762 B12R1.1123 CNCc1cc(c(cc1F)Br)F 7a_106832991635_100012024439 [1,1,0,0,0,0|2,0,0]=4 8763 B12R1.1123 CNCc1cc(c(cc1F)C)Br 207a_100102657272_100010138641 [1,1,0,0,0,0|2,0,0]=4 8764 B12R1.1123 CNCc1cc(c(cc1F)C)Br 26a_100102657272_100010068922 [1,1,0,0,0,0|2,0,0]=4 8765 B12R1.1123 CNCc1cc(c(cc1F)C)Br 270004a_106832991635_100010138641 [1,1,0,0,0,0|2,0,0]=4 8766 B12R1.1123 CNCc1cc(c(cc1F)Cl)C 207a_100102657272_100015641705 [1,1,0,0,0,0|2,0,0]=4 8767 B12R1.1123 CNCc1cc(c(cc1F)Cl)C 270004a_106832991635_100015641705 [1,1,0,0,0,0|2,0,0]=4 8768 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 207a_100102657272_100011998483 [1,1,0,0,0,0|2,0,0]=4 8769 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 2230a_106832991635_200012361342 [1,1,0,0,0,0|2,0,0]=4 8770 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 270004a_106832991635_100011998483 [1,1,0,0,0,0|2,0,0]=4 8771 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 34a_100102657272_200012361342 [1,1,0,0,0,0|2,0,0]=4 8772 B12R1.1123 CNCc1cc(c(cc1F)Cl)F 7a_106832991635_200012361342 [1,1,0,0,0,0|2,0,0]=4 8773 B12R1.1123 CNCc1cc(c(cc1F)F)Br 207a_100102657272_100009814802 [1,1,0,0,0,0|2,0,0]=4 8774 B12R1.1123 CNCc1cc(c(cc1F)F)Br 26a_100102657272_100012457948 [1,1,0,0,0,0|2,0,0]=4 8775 B12R1.1123 CNCc1cc(c(cc1F)F)Br 270004a_106832991635_100009814802 [1,1,0,0,0,0|2,0,0]=4 8776 B12R1.1123 CNCc1cc(c(cc1F)F)C 207a_100102657272_100012017330 [1,1,0,0,0,0|2,0,0]=4 8777 B12R1.1123 CNCc1cc(c(cc1F)F)C 2230a_106832991635_100012347589 [1,1,0,0,0,0|2,0,0]=4 8778 B12R1.1123 CNCc1cc(c(cc1F)F)C 270004a_106832991635_100012017330 [1,1,0,0,0,0|2,0,0]=4 8779 B12R1.1123 CNCc1cc(c(cc1F)F)C 34a_100102657272_100012347589 [1,1,0,0,0,0|2,0,0]=4 8780 B12R1.1123 CNCc1cc(c(cc1F)F)C 7a_106832991635_100012347589 [1,1,0,0,0,0|2,0,0]=4 8781 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 207a_100102657272_100000086691 [1,1,0,0,0,0|2,0,0]=4 8782 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 2230a_103624766871_200000210301 [1,1,0,0,0,0|2,0,0]=4 8783 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 2230a_106832991635_100010994231 [1,1,0,0,0,0|2,0,0]=4 8784 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 270004a_106832991635_100000086691 [1,1,0,0,0,0|2,0,0]=4 8785 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 34a_100102657272_100010994231 [1,1,0,0,0,0|2,0,0]=4 8786 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 34a_103624766871_200000210301 [1,1,0,0,0,0|2,0,0]=4 8787 B12R1.1123 CNCc1cc(c(cc1F)F)Cl 7a_106832991635_100010994231 [1,1,0,0,0,0|2,0,0]=4 8788 B12R1.1123 CNCc1cc(c(cc1F)F)F 207a_100102657272_100000690286 [1,1,0,0,0,0|2,0,0]=4 8789 B12R1.1123 CNCc1cc(c(cc1F)F)F 2230a_102495337830_200000210301 [1,1,0,0,0,0|2,0,0]=4 8790 B12R1.1123 CNCc1cc(c(cc1F)F)F 2230a_106832991635_100011218792 [1,1,0,0,0,0|2,0,0]=4 8791 B12R1.1123 CNCc1cc(c(cc1F)F)F 270004a_106832991635_100000690286 [1,1,0,0,0,0|2,0,0]=4 8792 B12R1.1123 CNCc1cc(c(cc1F)F)F 34a_100102657272_100011218792 [1,1,0,0,0,0|2,0,0]=4 8793 B12R1.1123 CNCc1cc(c(cc1F)F)F 34a_102495337830_200000210301 [1,1,0,0,0,0|2,0,0]=4 8794 B12R1.1123 CNCc1cc(c(cc1F)F)F 7a_106832991635_100011218792 [1,1,0,0,0,0|2,0,0]=4 8795 B12R1.1123 CNCc1cc(c(cc1F)F)I 207a_100102657272_100015839132 [1,1,0,0,0,0|2,0,0]=4 8796 B12R1.1123 CNCc1cc(c(cc1F)F)I 2230a_106832991635_100019984567 [1,1,0,0,0,0|2,0,0]=4 8797 B12R1.1123 CNCc1cc(c(cc1F)F)I 34a_100102657272_100019984567 [1,1,0,0,0,0|2,0,0]=4 8798 B12R1.1123 CNCc1cc(c(cc1F)F)I 7a_106832991635_100019984567 [1,1,0,0,0,0|2,0,0]=4 8799 B12R1.1123 CNCc1cc(c(cc1I)C)C 207a_100102657272_100010184403 [1,1,0,0,0,0|2,0,0]=4 8800 B12R1.1123 CNCc1cc(c(cc1I)C)C 270004a_106832991635_100010184403 [1,1,0,0,0,0|2,0,0]=4 8801 B12R1.1123 CNCc1cc(c(cc1N)Br)Br 26a_100102657272_200010781931 [1,1,0,0,0,0|2,0,0]=4 8802 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)Cl)F 2230a_114828290983_200025704644 [1,1,0,0,0,0|2,0,0]=4 8803 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)Cl)F 34a_114828290983_200025704644 [1,1,0,0,0,0|2,0,0]=4 8804 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)F)F 2230a_100011830481_200025704644 [1,1,0,0,0,0|2,0,0]=4 8805 B12R1.1123 [13CH3]NCc1cc(c(cc1Cl)F)F 34a_100011830481_200025704644 [1,1,0,0,0,0|2,0,0]=4 8806 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)Cl 2230a_103624766871_200025704644 [1,1,0,0,0,0|2,0,0]=4 8807 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)Cl 34a_103624766871_200025704644 [1,1,0,0,0,0|2,0,0]=4 8808 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)F 2230a_102495337830_200025704644 [1,1,0,0,0,0|2,0,0]=4 8809 B12R1.1123 [13CH3]NCc1cc(c(cc1F)F)F 34a_102495337830_200025704644 [1,1,0,0,0,0|2,0,0]=4 8810 B14R1.61 C#CCCSc1cc(c(c(c1)F)O)O 62a_100000688953_100010114375 [0,2,0,0,0,0|1,0,1]=4 8811 B14R1.61 C#CCCSc1cc(c(c(c1)O)O)O 62a_100000688953_100010658518 [0,2,0,0,0,0|1,0,1]=4 8812 B14R1.61 C/C=C/CSc1cc(c(c(c1)F)O)O 62a_100102629194_100010114375 [0,2,0,0,0,0|1,0,1]=4 8813 B14R1.61 C/C=C/CSc1cc(c(c(c1)O)O)O 62a_100102629194_100010658518 [0,2,0,0,0,0|1,0,1]=4 8814 B14R1.61 C=CCCSc1cc(c(c(c1)F)O)O 62a_100000754431_100010114375 [0,2,0,0,0,0|1,0,1]=4 8815 B14R1.61 C=CCCSc1cc(c(c(c1)O)O)O 62a_100000754431_100010658518 [0,2,0,0,0,0|1,0,1]=4 8816 B14R1.61 CC#CCSc1cc(c(c(c1)F)O)O 62a_100000748600_100010114375 [0,2,0,0,0,0|1,0,1]=4 8817 B14R1.61 CC#CCSc1cc(c(c(c1)O)O)O 62a_100000748600_100010658518 [0,2,0,0,0,0|1,0,1]=4 8818 B14R1.61 CC=CCSc1cc(c(c(c1)F)O)O 62a_100000070051_100010114375 [0,2,0,0,0,0|1,0,1]=4 8819 B14R1.61 CC=CCSc1cc(c(c(c1)O)O)O 62a_100000070051_100010658518 [0,2,0,0,0,0|1,0,1]=4 8820 B14R1.61 CCCCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100000210210 [0,2,0,0,0,0|2,0,0]=4 8821 B14R1.61 CCCCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000210210 [0,2,0,0,0,0|2,0,0]=4 8822 B14R1.61 CCCCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000210211 [0,2,0,0,0,0|2,0,0]=4 8823 B14R1.61 CCCCNc1cc(c(c(c1)C)O)C 34a_100000703291_100000210210 [0,2,0,0,0,0|2,0,0]=4 8824 B14R1.61 CCCCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000210211 [0,2,0,0,0,0|2,0,0]=4 8825 B14R1.61 CCCCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100000210210 [0,2,0,0,0,0|2,0,0]=4 8826 B14R1.61 CCCCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000210211 [0,2,0,0,0,0|2,0,0]=4 8827 B14R1.61 CCCCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100000210210 [0,2,0,0,0,0|2,0,0]=4 8828 B14R1.61 CCCCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000210211 [0,2,0,0,0,0|2,0,0]=4 8829 B14R1.61 CCCCNc1cc(c(c(c1)F)O)F 34a_100016987357_100000210210 [0,2,0,0,0,0|2,0,0]=4 8830 B14R1.61 CCCCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000210211 [0,2,0,0,0,0|2,0,0]=4 8831 B14R1.61 CCCCSc1cc(c(c(c1)Br)O)C 62a_100000210211_100010982682 [0,2,0,0,0,0|2,0,0]=4 8832 B14R1.61 CCCCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000210210 [0,2,0,0,0,0|2,0,0]=4 8833 B14R1.61 CCCCSc1cc(c(c(c1)C)O)C 62a_100000210211_100011216129 [0,2,0,0,0,0|2,0,0]=4 8834 B14R1.61 CCCCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000210210 [0,2,0,0,0,0|2,0,0]=4 8835 B14R1.61 CCCCSc1cc(c(c(c1)Cl)O)C 62a_100000210211_200015900153 [0,2,0,0,0,0|2,0,0]=4 8836 B14R1.61 CCCCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000210210 [0,2,0,0,0,0|2,0,0]=4 8837 B14R1.61 CCCCSc1cc(c(c(c1)Cl)O)Cl 62a_100000210211_100012339652 [0,2,0,0,0,0|2,0,0]=4 8838 B14R1.61 CCCCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000210210 [0,2,0,0,0,0|2,0,0]=4 8839 B14R1.61 CCCCSc1cc(c(c(c1)F)F)O 62a_100000210211_100000709865 [0,2,0,0,0,0|2,0,0]=4 8840 B14R1.61 CCCCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000210210 [0,2,0,0,0,0|2,0,0]=4 8841 B14R1.61 CCCCSc1cc(c(c(c1)F)N)O 62a_100000210211_100015475841 [0,2,0,0,0,0|2,0,0]=4 8842 B14R1.61 CCCCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000210210 [0,2,0,0,0,0|2,0,0]=4 8843 B14R1.61 CCCCSc1cc(c(c(c1)F)O)F 62a_100000210211_100011216917 [0,2,0,0,0,0|2,0,0]=4 8844 B14R1.61 CCCCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000210210 [0,2,0,0,0,0|2,0,0]=4 8845 B14R1.61 CCCCSc1cc(c(c(c1)F)O)N 62a_100000210211_100011217383 [0,2,0,0,0,0|2,0,0]=4 8846 B14R1.61 CCCCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000210210 [0,2,0,0,0,0|2,0,0]=4 8847 B14R1.61 CCCCSc1cc(c(c(c1)F)O)O 62a_100000210211_100010114375 [0,2,0,0,0,0|1,0,0]=3 8848 B14R1.61 CCCCSc1cc(c(c(c1)N)O)C 62a_100000210211_100011825904 [0,2,0,0,0,0|2,0,0]=4 8849 B14R1.61 CCCCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000210210 [0,2,0,0,0,0|2,0,0]=4 8850 B14R1.61 CCCCSc1cc(c(c(c1)O)N)C 62a_100000210211_100010371313 [0,2,0,0,0,0|2,0,0]=4 8851 B14R1.61 CCCCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000210210 [0,2,0,0,0,0|2,0,0]=4 8852 B14R1.61 CCCCSc1cc(c(c(c1)O)O)O 62a_100000210211_100010658518 [0,2,0,0,0,0|1,0,0]=3 8853 B14R1.61 CCNN=Cc1cc(c(c(c1)Br)O)O 4a_100000756455_100000687232 [0,2,0,0,0,0|1,0,1]=4 8854 B14R1.61 CCNN=Cc1cc(c(c(c1)O)O)O 4a_100000756455_100000042491 [0,2,0,0,0,0|1,0,1]=4 8855 B14R1.61 CCOCSc1cc(c(c(c1)F)O)O 62a_100000739092_100010114375 [0,2,0,0,0,0|2,0,0]=4 8856 B14R1.61 CCOCSc1cc(c(c(c1)O)O)O 62a_100000739092_100010658518 [0,2,0,0,0,0|2,0,0]=4 8857 B14R1.61 COCCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100011201679 [0,2,0,0,0,0|2,0,0]=4 8858 B14R1.61 COCCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100011201679 [0,2,0,0,0,0|2,0,0]=4 8859 B14R1.61 COCCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000233755 [0,2,0,0,0,0|2,0,0]=4 8860 B14R1.61 COCCNc1cc(c(c(c1)C)O)C 34a_100000703291_100011201679 [0,2,0,0,0,0|2,0,0]=4 8861 B14R1.61 COCCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000233755 [0,2,0,0,0,0|2,0,0]=4 8862 B14R1.61 COCCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100011201679 [0,2,0,0,0,0|2,0,0]=4 8863 B14R1.61 COCCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000233755 [0,2,0,0,0,0|2,0,0]=4 8864 B14R1.61 COCCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100011201679 [0,2,0,0,0,0|2,0,0]=4 8865 B14R1.61 COCCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000233755 [0,2,0,0,0,0|2,0,0]=4 8866 B14R1.61 COCCNc1cc(c(c(c1)F)O)F 34a_100016987357_100011201679 [0,2,0,0,0,0|2,0,0]=4 8867 B14R1.61 COCCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000233755 [0,2,0,0,0,0|2,0,0]=4 8868 B14R1.61 COCCSc1cc(c(c(c1)Br)O)C 62a_100000233755_100010982682 [0,2,0,0,0,0|2,0,0]=4 8869 B14R1.61 COCCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000233755 [0,2,0,0,0,0|2,0,0]=4 8870 B14R1.61 COCCSc1cc(c(c(c1)C)O)C 62a_100000233755_100011216129 [0,2,0,0,0,0|2,0,0]=4 8871 B14R1.61 COCCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000233755 [0,2,0,0,0,0|2,0,0]=4 8872 B14R1.61 COCCSc1cc(c(c(c1)Cl)O)C 62a_100000233755_200015900153 [0,2,0,0,0,0|2,0,0]=4 8873 B14R1.61 COCCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000233755 [0,2,0,0,0,0|2,0,0]=4 8874 B14R1.61 COCCSc1cc(c(c(c1)Cl)O)Cl 62a_100000233755_100012339652 [0,2,0,0,0,0|2,0,0]=4 8875 B14R1.61 COCCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000233755 [0,2,0,0,0,0|2,0,0]=4 8876 B14R1.61 COCCSc1cc(c(c(c1)F)F)O 62a_100000233755_100000709865 [0,2,0,0,0,0|2,0,0]=4 8877 B14R1.61 COCCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000233755 [0,2,0,0,0,0|2,0,0]=4 8878 B14R1.61 COCCSc1cc(c(c(c1)F)N)O 62a_100000233755_100015475841 [0,2,0,0,0,0|2,0,0]=4 8879 B14R1.61 COCCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000233755 [0,2,0,0,0,0|2,0,0]=4 8880 B14R1.61 COCCSc1cc(c(c(c1)F)O)F 62a_100000233755_100011216917 [0,2,0,0,0,0|2,0,0]=4 8881 B14R1.61 COCCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000233755 [0,2,0,0,0,0|2,0,0]=4 8882 B14R1.61 COCCSc1cc(c(c(c1)F)O)N 62a_100000233755_100011217383 [0,2,0,0,0,0|2,0,0]=4 8883 B14R1.61 COCCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000233755 [0,2,0,0,0,0|2,0,0]=4 8884 B14R1.61 COCCSc1cc(c(c(c1)F)O)O 62a_100000233755_100010114375 [0,2,0,0,0,0|1,0,0]=3 8885 B14R1.61 COCCSc1cc(c(c(c1)N)O)C 62a_100000233755_100011825904 [0,2,0,0,0,0|2,0,0]=4 8886 B14R1.61 COCCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000233755 [0,2,0,0,0,0|2,0,0]=4 8887 B14R1.61 COCCSc1cc(c(c(c1)O)N)C 62a_100000233755_100010371313 [0,2,0,0,0,0|2,0,0]=4 8888 B14R1.61 COCCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000233755 [0,2,0,0,0,0|2,0,0]=4 8889 B14R1.61 COCCSc1cc(c(c(c1)O)O)O 62a_100000233755_100010658518 [0,2,0,0,0,0|1,0,0]=3 8890 B14R1.61 CSCCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100000212216 [0,2,0,0,0,0|2,0,0]=4 8891 B14R1.61 CSCCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000212216 [0,2,0,0,0,0|2,0,0]=4 8892 B14R1.61 CSCCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000212216 [0,2,0,0,0,0|2,0,0]=4 8893 B14R1.61 CSCCNc1cc(c(c(c1)C)O)C 34a_100000703291_100000212216 [0,2,0,0,0,0|2,0,0]=4 8894 B14R1.61 CSCCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000212216 [0,2,0,0,0,0|2,0,0]=4 8895 B14R1.61 CSCCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100000212216 [0,2,0,0,0,0|2,0,0]=4 8896 B14R1.61 CSCCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000212216 [0,2,0,0,0,0|2,0,0]=4 8897 B14R1.61 CSCCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100000212216 [0,2,0,0,0,0|2,0,0]=4 8898 B14R1.61 CSCCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000212216 [0,2,0,0,0,0|2,0,0]=4 8899 B14R1.61 CSCCNc1cc(c(c(c1)F)O)F 34a_100016987357_100000212216 [0,2,0,0,0,0|2,0,0]=4 8900 B14R1.61 CSCCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000212216 [0,2,0,0,0,0|2,0,0]=4 8901 B14R1.61 CSCCSc1cc(c(c(c1)Br)O)C 62a_100000212216_100010982682 [0,2,0,0,0,0|2,0,0]=4 8902 B14R1.61 CSCCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000751147 [0,2,0,0,0,0|2,0,0]=4 8903 B14R1.61 CSCCSc1cc(c(c(c1)C)O)C 62a_100000212216_100011216129 [0,2,0,0,0,0|2,0,0]=4 8904 B14R1.61 CSCCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000751147 [0,2,0,0,0,0|2,0,0]=4 8905 B14R1.61 CSCCSc1cc(c(c(c1)Cl)O)C 62a_100000212216_200015900153 [0,2,0,0,0,0|2,0,0]=4 8906 B14R1.61 CSCCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000751147 [0,2,0,0,0,0|2,0,0]=4 8907 B14R1.61 CSCCSc1cc(c(c(c1)Cl)O)Cl 62a_100000212216_100012339652 [0,2,0,0,0,0|2,0,0]=4 8908 B14R1.61 CSCCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000751147 [0,2,0,0,0,0|2,0,0]=4 8909 B14R1.61 CSCCSc1cc(c(c(c1)F)F)O 62a_100000212216_100000709865 [0,2,0,0,0,0|2,0,0]=4 8910 B14R1.61 CSCCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000751147 [0,2,0,0,0,0|2,0,0]=4 8911 B14R1.61 CSCCSc1cc(c(c(c1)F)N)O 62a_100000212216_100015475841 [0,2,0,0,0,0|2,0,0]=4 8912 B14R1.61 CSCCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000751147 [0,2,0,0,0,0|2,0,0]=4 8913 B14R1.61 CSCCSc1cc(c(c(c1)F)O)F 62a_100000212216_100011216917 [0,2,0,0,0,0|2,0,0]=4 8914 B14R1.61 CSCCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000751147 [0,2,0,0,0,0|2,0,0]=4 8915 B14R1.61 CSCCSc1cc(c(c(c1)F)O)N 62a_100000212216_100011217383 [0,2,0,0,0,0|2,0,0]=4 8916 B14R1.61 CSCCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000751147 [0,2,0,0,0,0|2,0,0]=4 8917 B14R1.61 CSCCSc1cc(c(c(c1)F)O)O 62a_100000212216_100010114375 [0,2,0,0,0,0|1,0,0]=3 8918 B14R1.61 CSCCSc1cc(c(c(c1)N)O)C 62a_100000212216_100011825904 [0,2,0,0,0,0|2,0,0]=4 8919 B14R1.61 CSCCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000751147 [0,2,0,0,0,0|2,0,0]=4 8920 B14R1.61 CSCCSc1cc(c(c(c1)O)N)C 62a_100000212216_100010371313 [0,2,0,0,0,0|2,0,0]=4 8921 B14R1.61 CSCCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000751147 [0,2,0,0,0,0|2,0,0]=4 8922 B14R1.61 CSCCSc1cc(c(c(c1)O)O)O 62a_100000212216_100010658518 [0,2,0,0,0,0|1,0,0]=3 8923 B14R1.61 N#CCCSc1cc(c(c(c1)F)O)O 62a_100011215226_100010114375 [0,2,0,0,0,0|2,0,0]=4 8924 B14R1.61 N#CCCSc1cc(c(c(c1)O)O)O 62a_100011215226_100010658518 [0,2,0,0,0,0|2,0,0]=4 8925 B14R1.61 OCCCSc1cc(c(c(c1)F)O)O 62a_100011215043_100010114375 [0,2,0,0,0,0|2,0,0]=4 8926 B14R1.61 OCCCSc1cc(c(c(c1)O)O)O 62a_100011215043_100010658518 [0,2,0,0,0,0|2,0,0]=4 8927 B14R1.61 Oc1cc(cc(c1O)F)SCCCF 62a_100011934791_100010114375 [0,2,0,0,0,0|2,0,0]=4 8928 B14R1.61 Oc1cc(cc(c1O)O)SCCCF 62a_100011934791_100010658518 [0,2,0,0,0,0|2,0,0]=4 8929 B14R1.136 CCCCc1cc(c(c(c1C)C)O)C 271570a_100020621405_200012339818 [0,2,0,0,0,0|2,0,0]=4 8930 B14R1.136 CCCCc1cc(c(c(c1F)F)F)O 271570a_100020621405_100009816144 [0,2,0,0,0,0|2,0,0]=4 8931 B14R1.708 CCC(C)Sc1cc(c(c(c1)F)O)O 62a_100000758301_100010114375 [0,2,0,0,0,0|2,0,0]=4 8932 B14R1.708 CCC(C)Sc1cc(c(c(c1)O)O)O 62a_100000758301_100010658518 [0,2,0,0,0,0|2,0,0]=4 8933 B14R1.708 CNC(=O)Cc1cc(c(c(c1)Br)O)Br 240690a_100102657272_100009996861 [0,2,0,0,0,0|1,0,1]=4 8934 B14R1.708 CNC(=O)Cc1cc(c(c(c1)Br)O)Br 527a_100102657272_100009996861 [0,2,0,0,0,0|1,0,1]=4 8935 B14R1.708 CNC(=O)Cc1cc(c(c(c1)C)O)C 240690a_100102657272_200000099080 [0,2,0,0,0,0|1,0,1]=4 8936 B14R1.708 CNC(=O)Cc1cc(c(c(c1)C)O)C 527a_100102657272_200000099080 [0,2,0,0,0,0|1,0,1]=4 8937 B14R1.708 CNC(C)Cc1cc(c(c(c1)C)O)C 270004a_106832991635_200000080086 [0,2,0,0,0,0|1,0,0]=3 8938 B14R1.708 COC(C)Sc1cc(c(c(c1)F)O)O 62a_100009879195_100010114375 [0,2,0,0,0,0|2,0,0]=4 8939 B14R1.708 COC(C)Sc1cc(c(c(c1)O)O)O 62a_100009879195_100010658518 [0,2,0,0,0,0|2,0,0]=4 8940 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Br)O)O 1458a_200009992764_100000210303 [0,2,0,0,0,0|1,0,1]=4 8941 B14R1.6821 CCCC(=O)c1cc(c(c(c1)Cl)O)O 1458a_200000078382_100000210303 [0,2,0,0,0,0|1,0,1]=4 8942 B14R1.6821 CCCC(=O)c1cc(c(c(c1)O)O)O 1458a_100000212154_100000210303 [0,2,0,0,0,0|1,0,1]=4 8943 B14R1.6821 CNNC(=O)c1cc(c(c(c1)Br)O)O 22a_100016993582_200009992764 [0,2,0,0,0,0|1,0,1]=4 8944 B14R1.6821 CNNC(=O)c1cc(c(c(c1)Cl)O)O 22a_100016993582_200000078382 [0,2,0,0,0,0|1,0,1]=4 8945 B14R1.7499 CCCCc1cc(c(c(c1)C#N)O)C 271570a_100020621405_100010195408 [0,2,0,0,0,0|2,0,0]=4 8946 B14R1.7499 CCCCc1cc(c(c(c1)C=O)O)F 271570a_100020621405_100011217654 [0,2,0,0,0,0|1,0,1]=4 8947 B14R1.7499 CCCCc1cc(c(c(c1)CC)O)C 271570a_100020621405_100010659108 [0,2,0,0,0,0|2,0,0]=4 8948 B14R1.7499 CCCCc1cc(c(c(c1)CO)F)C 271570a_100020621405_200010782270 [0,2,0,0,0,0|2,0,0]=4 8949 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)C 271570a_100020621405_100010271686 [0,2,0,0,0,0|2,0,0]=4 8950 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)F 271570a_100020621405_100011218012 [0,2,0,0,0,0|2,0,0]=4 8951 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)O 271570a_100020621405_200015524394 [0,2,0,0,0,0|2,0,0]=4 8952 B14R1.7499 CCCCc1cc(c(c(c1)OC)N)C 271570a_100020621405_100000741850 [0,2,0,0,0,0|2,0,0]=4 8953 B14R1.7499 CCCSc1cc(c(c(c1)C=O)O)O 62a_100000210303_100010235811 [0,2,0,0,0,0|2,0,0]=4 8954 B14R1.7499 CCCSc1cc(c(c(c1)OC)O)O 62a_100000210303_200159242197 [0,2,0,0,0,0|2,0,0]=4 8955 B14R1.7499 COCSc1cc(c(c(c1)C=O)O)O 62a_100000766300_100010235811 [0,2,0,0,0,0|2,0,0]=4 8956 B14R1.7499 COCSc1cc(c(c(c1)OC)O)O 62a_100000766300_200159242197 [0,2,0,0,0,0|2,0,0]=4 8957 B14R1.7499 COc1cc(cc(c1O)O)SCSC 62a_100011218213_200159242197 [0,2,0,0,0,0|2,0,0]=4 8958 B14R1.7499 CSCSc1cc(c(c(c1)C=O)O)O 62a_100011218213_100010235811 [0,2,0,0,0,0|2,0,0]=4 8959 B14R1.7500 CCCCc1cc(c(c(c1)Br)OC)C 271570a_100020621405_100010997178 [0,2,0,0,0,0|2,0,0]=4 8960 B14R1.7500 CCCCc1cc(c(c(c1)C)CO)C 271570a_100020621405_100010128451 [0,2,0,0,0,0|2,0,0]=4 8961 B14R1.7500 CCCCc1cc(c(c(c1)C)OC)C 271570a_100020621405_100000211903 [0,2,0,0,0,0|2,0,0]=4 8962 B14R1.7500 CCCCc1cc(c(c(c1)Cl)CO)Cl 271570a_100020621405_200011001976 [0,2,0,0,0,0|2,0,0]=4 8963 B14R1.7500 CCCCc1cc(c(c(c1)Cl)OC)Cl 271570a_100020621405_200010110313 [0,2,0,0,0,0|2,0,0]=4 8964 B14R1.7500 CCCCc1cc(c(c(c1)F)C#N)O 271570a_100020621405_200011156622 [0,2,0,0,0,0|2,0,0]=4 8965 B14R1.7500 CCCCc1cc(c(c(c1)F)C=O)O 271570a_100020621405_100010762571 [0,2,0,0,0,0|1,0,1]=4 8966 B14R1.7500 CCCCc1cc(c(c(c1)F)CO)F 271570a_100020621405_100011219983 [0,2,0,0,0,0|2,0,0]=4 8967 B14R1.7500 CCCCc1cc(c(c(c1)F)OC)F 271570a_100020621405_100009813559 [0,2,0,0,0,0|2,0,0]=4 8968 B14R1.7500 CCCCc1cc(c(c(c1)F)OC)N 271570a_100020621405_200010245146 [0,2,0,0,0,0|2,0,0]=4 8969 B14R1.7500 CCNCc1cc(c(c(c1)Cl)OC)O 270004a_100015525214_200010620221 [0,2,0,0,0,0|2,0,0]=4 8970 B14R1.15552 C=C(C)CSc1cc(c(c(c1)F)O)O 62a_100000748629_100010114375 [0,2,0,0,0,0|2,0,0]=4 8971 B14R1.15552 C=C(C)CSc1cc(c(c(c1)O)O)O 62a_100000748629_100010658518 [0,2,0,0,0,0|2,0,0]=4 8972 B14R1.15552 CC(=O)CCc1cc(c(c(c1)Br)O)Br 1458a_100009814134_200000210301 [0,2,0,0,0,0|2,0,0]=4 8973 B14R1.15552 CC(=O)CCc1cc(c(c(c1)I)O)I 1458a_200000072802_200000210301 [0,2,0,0,0,0|2,0,0]=4 8974 B14R1.15552 CC(C)CSc1cc(c(c(c1)F)O)O 62a_100000210624_100010114375 [0,2,0,0,0,0|2,0,0]=4 8975 B14R1.15552 CC(C)CSc1cc(c(c(c1)O)O)O 62a_100000210624_100010658518 [0,2,0,0,0,0|2,0,0]=4 8976 B14R1.15552 CC(O)CSc1cc(c(c(c1)F)O)O 62a_100011218427_100010114375 [0,2,0,0,0,0|2,0,0]=4 8977 B14R1.15552 CC(O)CSc1cc(c(c(c1)O)O)O 62a_100011218427_100010658518 [0,2,0,0,0,0|2,0,0]=4 8978 B14R1.15552 C[C@@H](O)CSc1cc(c(c(c1)F)O)O 62a_100009817552_100010114375 [0,2,0,0,0,0|2,0,0]=4 8979 B14R1.15552 C[C@@H](O)CSc1cc(c(c(c1)O)O)O 62a_100009817552_100010658518 [0,2,0,0,0,0|2,0,0]=4 8980 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)Br)O)Br 1458a_100009814134_200025704644 [0,2,0,0,0,0|2,0,0]=4 8981 B14R1.15552 [13CH3]C(=O)CCc1cc(c(c(c1)I)O)I 1458a_200000072802_200025704644 [0,2,0,0,0,0|2,0,0]=4 8982 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210303 [0,2,0,0,0,0|1,0,1]=4 8983 B14R1.626 CNCC(=O)c1ccc(c(c1)CO)O 34a_100102657272_100010262812 [0,2,0,0,0,0|0,0,1]=3 8984 B14R1.626 CNCC(=O)c1ccc(c(c1)CO)O 7a_106832991635_100010262812 [0,2,0,0,0,0|0,0,1]=3 8985 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)Br 2230a_106832991635_200010710740 [0,2,0,0,0,0|1,0,1]=4 8986 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)Br 34a_100102657272_200010710740 [0,2,0,0,0,0|1,0,1]=4 8987 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)F 2230a_106832991635_200012348595 [0,2,0,0,0,0|1,0,1]=4 8988 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)F 34a_100102657272_200012348595 [0,2,0,0,0,0|1,0,1]=4 8989 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)F 7a_106832991635_200012348595 [0,2,0,0,0,0|1,0,1]=4 8990 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)O 7a_106832991635_100010206313 [0,2,0,0,0,0|0,0,1]=3 8991 B14R1.626 CNNC(=O)c1ccc(c(c1)OC)O 22a_100016993582_100000687070 [0,2,0,0,0,0|1,0,1]=4 8992 B14R1.626 COCC(=O)c1ccc(c(c1)CO)O 34a_100138415774_100010262812 [0,2,0,0,0,0|1,0,1]=4 8993 B14R1.626 COC[C@@H](N)c1ccc(c(c1)OC)F 34a_100138412295_200000210301 [0,2,0,0,0,0|2,0,0]=4 8994 B14R1.626 COc1cc(ccc1F)[C@H](N)CO[13CH3] 34a_100138412295_200025704644 [0,2,0,0,0,0|2,0,0]=4 8995 B14R1.626 COc1cc(ccc1O)C(=O)CSC 62a_100010206313_200000210301 [0,2,0,0,0,0|1,0,1]=4 8996 B14R1.626 COc1cc(ccc1O)C(=O)CS[13CH3] 62a_100010206313_200025704644 [0,2,0,0,0,0|1,0,1]=4 8997 B14R1.626 CSCC(=O)c1ccc(c(c1)CO)O 62a_100010262812_200000210301 [0,2,0,0,0,0|1,0,1]=4 8998 B14R1.626 CSCC(=O)c1ccc(c(c1)CO)O 62a_200000210301_100010262812 [0,2,0,0,0,0|1,0,1]=4 8999 B14R1.626 [13CH3]SCC(=O)c1ccc(c(c1)CO)O 62a_100010262812_200025704644 [0,2,0,0,0,0|1,0,1]=4 9000 B14R1.626 [13CH3]SCC(=O)c1ccc(c(c1)CO)O 62a_200025704644_100010262812 [0,2,0,0,0,0|1,0,1]=4 9001 B14R1.628 CCCC(=O)c1ccc(c(c1)O)OC 1458a_100000766810_100000210303 [0,2,0,0,0,0|1,0,1]=4 9002 B14R1.628 CCNC(C)c1ccc(c(c1)O)OC 269862a_100015525214_100000732934 [0,2,0,0,0,0|2,0,0]=4 9003 B14R1.628 CNCC(=O)c1ccc(c(c1)Br)OC 2230a_106832991635_100000185116 [0,2,0,0,0,0|1,0,1]=4 9004 B14R1.628 CNCC(=O)c1ccc(c(c1)Br)OC 34a_100102657272_100011262385 [0,2,0,0,0,0|1,0,1]=4 9005 B14R1.628 CNCC(=O)c1ccc(c(c1)Br)OC 7a_106832991635_100000185116 [0,2,0,0,0,0|1,0,1]=4 9006 B14R1.628 CNCC(=O)c1ccc(c(c1)Cl)OC 2230a_106832991635_100000198526 [0,2,0,0,0,0|1,0,1]=4 9007 B14R1.628 CNCC(=O)c1ccc(c(c1)Cl)OC 7a_106832991635_100000198526 [0,2,0,0,0,0|1,0,1]=4 9008 B14R1.628 CNCC(=O)c1ccc(c(c1)F)OC 2230a_106832991635_100000195436 [0,2,0,0,0,0|1,0,1]=4 9009 B14R1.628 CNCC(=O)c1ccc(c(c1)F)OC 34a_100102657272_100000195436 [0,2,0,0,0,0|1,0,1]=4 9010 B14R1.628 CNCC(=O)c1ccc(c(c1)F)OC 7a_106832991635_100000195436 [0,2,0,0,0,0|1,0,1]=4 9011 B14R1.628 CNNC(=O)c1ccc(c(c1)O)OC 22a_100016993582_100000766810 [0,2,0,0,0,0|1,0,1]=4 9012 B14R1.685 C=C(C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000748629 [0,2,0,0,0,0|1,0,1]=4 9013 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000070787_100000183813 [0,2,0,0,0,0|1,0,1]=4 9014 B14R1.685 CC(C)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210624 [0,2,0,0,0,0|1,0,1]=4 9015 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)Br)O 271570a_100015190218_100012361655 [0,2,0,0,0,0|2,0,0]=4 9016 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)Cl)O 271570a_100015190218_100012360047 [0,2,0,0,0,0|2,0,0]=4 9017 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)F)O 271570a_100015190218_100000185481 [0,2,0,0,0,0|2,0,0]=4 9018 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)N)O 271570a_100015190218_100000752626 [0,2,0,0,0,0|2,0,0]=4 9019 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)Br 271570a_100015190218_100012356990 [0,2,0,0,0,0|2,0,0]=4 9020 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)Cl 271570a_100015190218_100011356854 [0,2,0,0,0,0|2,0,0]=4 9021 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)F 271570a_100015190218_100000686035 [0,2,0,0,0,0|2,0,0]=4 9022 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)N 271570a_100015190218_100000739049 [0,2,0,0,0,0|2,0,0]=4 9023 B14R1.685 CC(C)C[C@H](N)c1ccc(c(c1)O)O 271570a_100015190218_100009813601 [0,2,0,0,0,0|1,0,0]=3 9024 B14R1.685 CC(O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011218427 [0,2,0,0,0,0|1,0,1]=4 9025 B14R1.685 CN(C)CC(=O)c1ccc(c(c1)Cl)O 269982a_100102631434_200010170092 [0,2,0,0,0,0|1,0,1]=4 9026 B14R1.685 CN(C)CC(=O)c1ccc(c(c1)O)O 269982a_100102631434_100000183813 [0,2,0,0,0,0|0,0,1]=3 9027 B14R1.685 CN(C)C[C@@H](O)c1ccc(c(c1)F)F 2230a_100102631434_100000761251 [0,2,0,0,0,0|2,0,0]=4 9028 B14R1.685 CN(C)C[C@@H](O)c1ccc(c(c1)F)F 269982a_100102631434_100000761251 [0,2,0,0,0,0|2,0,0]=4 9029 B14R1.685 Cc1cc(ccc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000186361 [0,2,0,0,0,0|2,0,0]=4 9030 B14R1.685 Cc1ccc(cc1O)[C@@H](N)CC(C)C 271570a_100015190218_100000766334 [0,2,0,0,0,0|2,0,0]=4 9031 B14R1.941 C#CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000753159 [0,2,0,0,0,0|1,0,1]=4 9032 B14R1.941 C/C=C/CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100102629194 [0,2,0,0,0,0|1,0,1]=4 9033 B14R1.941 C=CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000754431 [0,2,0,0,0,0|1,0,1]=4 9034 B14R1.941 CC#CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000748600 [0,2,0,0,0,0|1,0,1]=4 9035 B14R1.941 CC=CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000070051 [0,2,0,0,0,0|1,0,1]=4 9036 B14R1.941 CCCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210211 [0,2,0,0,0,0|2,0,0]=4 9037 B14R1.941 CCCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210211 [0,2,0,0,0,0|2,0,0]=4 9038 B14R1.941 CCCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210211 [0,2,0,0,0,0|2,0,0]=4 9039 B14R1.941 CCCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210211 [0,2,0,0,0,0|2,0,0]=4 9040 B14R1.941 CCCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210211 [0,2,0,0,0,0|2,0,0]=4 9041 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210211 [0,2,0,0,0,0|2,0,0]=4 9042 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210211 [0,2,0,0,0,0|2,0,0]=4 9043 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210211 [0,2,0,0,0,0|2,0,0]=4 9044 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210211 [0,2,0,0,0,0|2,0,0]=4 9045 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210211 [0,2,0,0,0,0|2,0,0]=4 9046 B14R1.941 CCCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210211 [0,2,0,0,0,0|1,0,0]=3 9047 B14R1.941 CCCNC(C)c1ccc(c(c1)Br)O 269862a_100020643023_100011772453 [0,2,0,0,0,0|2,0,0]=4 9048 B14R1.941 CCCNC(C)c1ccc(c(c1)C)O 269862a_100020643023_100000188726 [0,2,0,0,0,0|2,0,0]=4 9049 B14R1.941 CCCNC(C)c1ccc(c(c1)Cl)O 269862a_100020643023_100000188625 [0,2,0,0,0,0|2,0,0]=4 9050 B14R1.941 CCCNC(C)c1ccc(c(c1)F)O 269862a_100020643023_100000751691 [0,2,0,0,0,0|2,0,0]=4 9051 B14R1.941 CCCNC(C)c1ccc(c(c1)O)C 269862a_100020643023_100000084092 [0,2,0,0,0,0|2,0,0]=4 9052 B14R1.941 CCCNC(C)c1ccc(c(c1)O)F 269862a_100020643023_100000117923 [0,2,0,0,0,0|2,0,0]=4 9053 B14R1.941 CCNCC(O)c1ccc(c(c1)O)O 34a_100000106456_100000210202 [0,2,0,0,0,0|0,0,0]=2 9054 B14R1.941 CCNC[C@@H](O)c1ccc(c(c1)F)F 2230a_100015525214_100000761251 [0,2,0,0,0,0|2,0,0]=4 9055 B14R1.941 CCNN=C(C)c1ccc(c(c1)O)O 4a_100000756455_100000025746 [0,2,0,0,0,0|1,0,1]=4 9056 B14R1.941 CCSCC(=O)c1ccc(c(c1)O)O 62a_100000210202_100000183813 [0,2,0,0,0,0|1,0,1]=4 9057 B14R1.941 CNCCC(=O)c1ccc(c(c1)Cl)Cl 2230a_106832991635_100012356702 [0,2,0,0,0,0|2,0,0]=4 9058 B14R1.941 CNCCC(=O)c1ccc(c(c1)Cl)Cl 7a_106832991635_100012356702 [0,2,0,0,0,0|2,0,0]=4 9059 B14R1.941 COCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000233755 [0,2,0,0,0,0|2,0,0]=4 9060 B14R1.941 COCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000233755 [0,2,0,0,0,0|2,0,0]=4 9061 B14R1.941 COCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000233755 [0,2,0,0,0,0|2,0,0]=4 9062 B14R1.941 COCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000233755 [0,2,0,0,0,0|2,0,0]=4 9063 B14R1.941 COCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000233755 [0,2,0,0,0,0|2,0,0]=4 9064 B14R1.941 COCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000233755 [0,2,0,0,0,0|2,0,0]=4 9065 B14R1.941 COCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000233755 [0,2,0,0,0,0|2,0,0]=4 9066 B14R1.941 COCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000233755 [0,2,0,0,0,0|2,0,0]=4 9067 B14R1.941 COCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000233755 [0,2,0,0,0,0|2,0,0]=4 9068 B14R1.941 COCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000233755 [0,2,0,0,0,0|2,0,0]=4 9069 B14R1.941 COCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000233755 [0,2,0,0,0,0|1,0,0]=3 9070 B14R1.941 CSCCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000751147 [0,2,0,0,0,0|2,0,0]=4 9071 B14R1.941 CSCCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000751147 [0,2,0,0,0,0|2,0,0]=4 9072 B14R1.941 CSCCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000751147 [0,2,0,0,0,0|2,0,0]=4 9073 B14R1.941 CSCCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000751147 [0,2,0,0,0,0|2,0,0]=4 9074 B14R1.941 CSCCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000751147 [0,2,0,0,0,0|2,0,0]=4 9075 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000751147 [0,2,0,0,0,0|2,0,0]=4 9076 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000751147 [0,2,0,0,0,0|2,0,0]=4 9077 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000751147 [0,2,0,0,0,0|2,0,0]=4 9078 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000751147 [0,2,0,0,0,0|2,0,0]=4 9079 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000751147 [0,2,0,0,0,0|2,0,0]=4 9080 B14R1.941 CSCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000751147 [0,2,0,0,0,0|1,0,0]=3 9081 B14R1.941 N#CCCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100011215226 [0,2,0,0,0,0|2,0,0]=4 9082 B14R1.941 O=C(CCCF)c1ccc(c(c1)O)O 1458a_100000212155_100011934791 [0,2,0,0,0,0|1,0,1]=4 9083 B14R1.941 O=C(CCCO)c1ccc(c(c1)O)O 1458a_100000212155_100011215043 [0,2,0,0,0,0|1,0,1]=4 9084 B14R1.941 O=C(CSCF)c1ccc(c(c1)O)O 62a_100015361967_100000183813 [0,2,0,0,0,0|1,0,1]=4 9085 B14R1.941 Oc1ccc(cc1O)C(O)CNCF 34a_100000106456_100015361967 [0,2,0,0,0,0|0,0,0]=2 9086 B14R1.1003 CCC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000210202 [0,2,0,0,0,0|1,0,1]=4 9087 B14R1.1003 CCC(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000758301 [0,2,0,0,0,0|1,0,1]=4 9088 B14R1.1003 CNC(=O)C(O)c1ccc(c(c1)O)O 240690a_100102657272_200000032065 [0,2,0,0,0,0|0,0,1]=3 9089 B14R1.3190 CC(C)(CN[13CH3])c1ccc(c(c1)Cl)Cl 2230a_100000747966_200025704644 [0,2,0,0,0,0|2,0,0]=4 9090 B14R1.3190 CC(C)(CN[13CH3])c1ccc(c(c1)Cl)Cl 34a_100000747966_200025704644 [0,2,0,0,0,0|2,0,0]=4 9091 B14R1.3190 CNCC(C)(C)c1ccc(c(c1)Cl)Cl 2230a_100000747966_200000210301 [0,2,0,0,0,0|2,0,0]=4 9092 B14R1.3190 CNCC(C)(C)c1ccc(c(c1)Cl)Cl 34a_100000747966_200000210301 [0,2,0,0,0,0|2,0,0]=4 9093 B14R1.7265 CCCC(=O)c1ccc(c(c1Cl)O)O 1458a_100009910189_100000210303 [0,2,0,0,0,0|1,0,1]=4 9094 B14R1.7265 CCCC(=O)c1ccc(c(c1O)O)O 1458a_100000037941_100000210303 [0,2,0,0,0,0|1,0,1]=4 9095 B14R1.7265 CNNC(=O)c1ccc(c(c1Cl)O)O 22a_100016993582_100009910189 [0,2,0,0,0,0|1,0,1]=4 9096 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748629 [0,2,0,0,0,0|2,0,0]=4 9097 B14R1.42 C=C(C)CSc1ccc(c(c1)CO)O 62a_100000184703_100000211660 [0,2,0,0,0,0|2,0,0]=4 9098 B14R1.42 C=C(C)CSc1ccc(c(c1)CO)O 62a_100000748629_100000184703 [0,2,0,0,0,0|2,0,0]=4 9099 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)O 62a_100000748629_100000694246 [0,2,0,0,0,0|2,0,0]=4 9100 B14R1.42 CC(C)CSc1ccc(c(c1)CO)O 62a_100000184703_100000210760 [0,2,0,0,0,0|2,0,0]=4 9101 B14R1.42 CC(C)CSc1ccc(c(c1)CO)O 62a_100000210624_100000184703 [0,2,0,0,0,0|2,0,0]=4 9102 B14R1.42 CC(O)CSc1ccc(c(c1)CO)O 62a_100000184703_100011218427 [0,2,0,0,0,0|2,0,0]=4 9103 B14R1.42 CC(O)CSc1ccc(c(c1)CO)O 62a_100011218427_100000184703 [0,2,0,0,0,0|2,0,0]=4 9104 B14R1.42 COc1cc(ccc1C)CCC(=O)C 1458a_200000066385_200000210301 [0,2,0,0,0,0|2,0,0]=4 9105 B14R1.42 COc1cc(ccc1C)CCC(=O)[13CH3] 1458a_200000066385_200025704644 [0,2,0,0,0,0|2,0,0]=4 9106 B14R1.42 COc1cc(ccc1F)CCC(=O)C 1458a_100009849056_200000210301 [0,2,0,0,0,0|2,0,0]=4 9107 B14R1.42 COc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100009849056_200025704644 [0,2,0,0,0,0|2,0,0]=4 9108 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [0,2,0,0,0,0|1,0,0]=3 9109 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [0,2,0,0,0,0|1,0,0]=3 9110 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [0,2,0,0,0,0|1,0,0]=3 9111 B14R1.42 COc1cc(ccc1O)CCN(C)C 2230a_100102631434_100010741665 [0,2,0,0,0,0|0,0,0]=2 9112 B14R1.42 COc1cc(ccc1O)CCN(C)C 269982a_100102631434_100010741665 [0,2,0,0,0,0|0,0,0]=2 9113 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [0,2,0,0,0,0|2,0,0]=4 9114 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [0,2,0,0,0,0|2,0,0]=4 9115 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [0,2,0,0,0,0|2,0,0]=4 9116 B14R1.42 COc1cc(ccc1O)CNC(C)C 34a_100000185554_100000210206 [0,2,0,0,0,0|2,0,0]=4 9117 B14R1.42 COc1cc(ccc1O)NCC(C)C 34a_100000726020_100000210624 [0,2,0,0,0,0|2,0,0]=4 9118 B14R1.42 COc1cc(ccc1O)NCC(C)O 34a_100000726020_100011218427 [0,2,0,0,0,0|2,0,0]=4 9119 B14R1.42 COc1cc(ccc1O)NC[C@@H](C)O 34a_100000726020_100009817552 [0,2,0,0,0,0|2,0,0]=4 9120 B14R1.42 COc1cc(ccc1O)SCC(C)C 62a_100000210624_100000694246 [0,2,0,0,0,0|2,0,0]=4 9121 B14R1.42 COc1cc(ccc1O)SCC(C)O 62a_100011218427_100000694246 [0,2,0,0,0,0|2,0,0]=4 9122 B14R1.42 COc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000694246 [0,2,0,0,0,0|2,0,0]=4 9123 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CO)O 62a_100000184703_100009817552 [0,2,0,0,0,0|2,0,0]=4 9124 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CO)O 62a_100009817552_100000184703 [0,2,0,0,0,0|2,0,0]=4 9125 B14R1.684 CC(C)(C)CNc1ccc(c(c1)O)O 34a_100102946323_100011219605 [0,2,0,0,0,0|2,0,0]=4 9126 B14R1.684 CC(C)(C)CSc1ccc(c(c1)O)O 62a_100011219605_100009813601 [0,2,0,0,0,0|2,0,0]=4 9127 B14R1.684 CC(C)(C)NCc1ccc(c(c1)O)O 34a_100000010075_100000210625 [0,2,0,0,0,0|2,0,0]=4 9128 B14R1.684 CC(C)(F)CNc1ccc(c(c1)O)O 34a_100102946323_100011997219 [0,2,0,0,0,0|2,0,0]=4 9129 B14R1.684 CC(C)(F)CSc1ccc(c(c1)O)O 62a_100011997219_100009813601 [0,2,0,0,0,0|2,0,0]=4 9130 B14R1.684 CC(C)(O)CNc1ccc(c(c1)O)O 34a_100102946323_100000764493 [0,2,0,0,0,0|2,0,0]=4 9131 B14R1.684 CC(C)(O)CSc1ccc(c(c1)O)O 62a_100000764493_100009813601 [0,2,0,0,0,0|2,0,0]=4 9132 B14R1.684 C[N+](C)(C)CSc1ccc(c(c1)O)O 62a_200000036245_100009813601 [0,2,0,0,0,0|1,0,1]=4 9133 B14R1.684 C[Si](C)(C)CSc1ccc(c(c1)O)O 62a_100000037933_100009813601 [0,2,0,0,0,0|2,0,0]=4 9134 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [0,2,0,0,0,0|2,0,0]=4 9135 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [0,2,0,0,0,0|1,0,0]=3 9136 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [0,2,0,0,0,0|2,0,0]=4 9137 B14R1.686 CC(C)C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210206 [0,2,0,0,0,0|1,0,1]=4 9138 B14R1.686 CC(Cc1ccc(c(c1)Cl)Cl)N(C)C 270004a_100102631434_100011586667 [0,2,0,0,0,0|2,0,0]=4 9139 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Br)O 240690a_100102631434_100009990404 [0,2,0,0,0,0|1,0,1]=4 9140 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Br)O 527a_100102631434_100009990404 [0,2,0,0,0,0|1,0,1]=4 9141 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Cl)O 240690a_100102631434_100000035197 [0,2,0,0,0,0|1,0,1]=4 9142 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)Cl)O 527a_100102631434_100000035197 [0,2,0,0,0,0|1,0,1]=4 9143 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)F)O 240690a_100102631434_100000039761 [0,2,0,0,0,0|1,0,1]=4 9144 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)F)O 527a_100102631434_100000039761 [0,2,0,0,0,0|1,0,1]=4 9145 B14R1.686 CN(C)C(=O)Cc1ccc(c(c1)O)O 527a_100102631434_100000031429 [0,2,0,0,0,0|0,0,1]=3 9146 B14R1.686 CN(C)C(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100102631434 [0,2,0,0,0,0|1,0,1]=4 9147 B14R1.686 Cc1cc(ccc1O)CC(=O)N(C)C 240690a_100102631434_100000083968 [0,2,0,0,0,0|1,0,1]=4 9148 B14R1.686 Cc1cc(ccc1O)CC(=O)N(C)C 527a_100102631434_100000083968 [0,2,0,0,0,0|1,0,1]=4 9149 B14R1.686 Cc1ccc(cc1O)CC(=O)N(C)C 11a_100102631434_100000082272 [0,2,0,0,0,0|1,0,1]=4 9150 B14R1.686 Cc1ccc(cc1O)CC(=O)N(C)C 240690a_100102631434_100000082272 [0,2,0,0,0,0|1,0,1]=4 9151 B14R1.686 Cc1ccc(cc1O)CC(=O)N(C)C 527a_100102631434_100000082272 [0,2,0,0,0,0|1,0,1]=4 9152 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [0,2,0,0,0,0|1,0,0]=3 9153 B14R1.833 C#CC(=O)CCc1ccc(c(c1)O)O 1458a_100000211873_200010393615 [0,2,0,0,0,0|1,0,1]=4 9154 B14R1.833 C#CC(C)NCc1ccc(c(c1)O)O 34a_100000010075_200000035995 [0,2,0,0,0,0|1,0,1]=4 9155 B14R1.833 C=CC(=O)CCc1ccc(c(c1)O)O 1458a_100000185746_200010393615 [0,2,0,0,0,0|1,0,1]=4 9156 B14R1.833 C=CC(O)CNc1ccc(c(c1)O)O 34a_100102946323_100000730141 [0,2,0,0,0,0|1,0,1]=4 9157 B14R1.833 C=CC(O)CSc1ccc(c(c1)O)O 62a_100000730141_100009813601 [0,2,0,0,0,0|1,0,1]=4 9158 B14R1.833 CC(CO)NCc1ccc(c(c1)O)O 34a_100000010075_100012180447 [0,2,0,0,0,0|2,0,0]=4 9159 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_100000210202 [0,2,0,0,0,0|1,0,0]=3 9160 B14R1.833 CCC(=O)CCc1ccc(c(c1)O)O 1458a_100000210414_200010393615 [0,2,0,0,0,0|1,0,0]=3 9161 B14R1.833 CCC(=O)CSc1ccc(c(c1)O)O 62a_100000747405_100009813601 [0,2,0,0,0,0|1,0,1]=4 9162 B14R1.833 CCC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210414 [0,2,0,0,0,0|1,0,1]=4 9163 B14R1.833 CCC(C)CNc1ccc(c(c1)Br)O 34a_100011534360_100000748023 [0,2,0,0,0,0|2,0,0]=4 9164 B14R1.833 CCC(C)CNc1ccc(c(c1)C)O 34a_100011218179_100000748023 [0,2,0,0,0,0|2,0,0]=4 9165 B14R1.833 CCC(C)CNc1ccc(c(c1)C)O 7a_100011218179_100000748023 [0,2,0,0,0,0|2,0,0]=4 9166 B14R1.833 CCC(C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000748023 [0,2,0,0,0,0|2,0,0]=4 9167 B14R1.833 CCC(C)CNc1ccc(c(c1)F)O 34a_100011220035_100000748023 [0,2,0,0,0,0|2,0,0]=4 9168 B14R1.833 CCC(C)CNc1ccc(c(c1)F)O 7a_100011220035_100000748023 [0,2,0,0,0,0|2,0,0]=4 9169 B14R1.833 CCC(C)CNc1ccc(c(c1)O)C 34a_100000759471_100000748023 [0,2,0,0,0,0|2,0,0]=4 9170 B14R1.833 CCC(C)CNc1ccc(c(c1)O)C 7a_100000759471_100000748023 [0,2,0,0,0,0|2,0,0]=4 9171 B14R1.833 CCC(C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000748023 [0,2,0,0,0,0|2,0,0]=4 9172 B14R1.833 CCC(C)CNc1ccc(c(c1)O)F 34a_100012017398_100000748023 [0,2,0,0,0,0|2,0,0]=4 9173 B14R1.833 CCC(C)CNc1ccc(c(c1)O)F 7a_100012017398_100000748023 [0,2,0,0,0,0|2,0,0]=4 9174 B14R1.833 CCC(C)CNc1ccc(c(c1)O)O 34a_100102946323_100000748023 [0,2,0,0,0,0|1,0,0]=3 9175 B14R1.833 CCC(C)CSc1ccc(c(c1)Br)O 62a_100000748023_100012361655 [0,2,0,0,0,0|2,0,0]=4 9176 B14R1.833 CCC(C)CSc1ccc(c(c1)Br)O 62a_100012361655_100000748023 [0,2,0,0,0,0|2,0,0]=4 9177 B14R1.833 CCC(C)CSc1ccc(c(c1)C)O 62a_100000748023_100000186361 [0,2,0,0,0,0|2,0,0]=4 9178 B14R1.833 CCC(C)CSc1ccc(c(c1)Cl)O 62a_100000748023_100012360047 [0,2,0,0,0,0|2,0,0]=4 9179 B14R1.833 CCC(C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000748023 [0,2,0,0,0,0|2,0,0]=4 9180 B14R1.833 CCC(C)CSc1ccc(c(c1)F)O 62a_100000185481_100000748023 [0,2,0,0,0,0|2,0,0]=4 9181 B14R1.833 CCC(C)CSc1ccc(c(c1)F)O 62a_100000748023_100000185481 [0,2,0,0,0,0|2,0,0]=4 9182 B14R1.833 CCC(C)CSc1ccc(c(c1)N)O 62a_100000748023_100000752626 [0,2,0,0,0,0|2,0,0]=4 9183 B14R1.833 CCC(C)CSc1ccc(c(c1)N)O 62a_100000752626_100000748023 [0,2,0,0,0,0|2,0,0]=4 9184 B14R1.833 CCC(C)CSc1ccc(c(c1)O)Br 62a_100000748023_100012356990 [0,2,0,0,0,0|2,0,0]=4 9185 B14R1.833 CCC(C)CSc1ccc(c(c1)O)Br 62a_100012356990_100000748023 [0,2,0,0,0,0|2,0,0]=4 9186 B14R1.833 CCC(C)CSc1ccc(c(c1)O)C 62a_100000685420_100000748023 [0,2,0,0,0,0|2,0,0]=4 9187 B14R1.833 CCC(C)CSc1ccc(c(c1)O)C 62a_100000748023_100000685420 [0,2,0,0,0,0|2,0,0]=4 9188 B14R1.833 CCC(C)CSc1ccc(c(c1)O)Cl 62a_100000748023_100011356854 [0,2,0,0,0,0|2,0,0]=4 9189 B14R1.833 CCC(C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000748023 [0,2,0,0,0,0|2,0,0]=4 9190 B14R1.833 CCC(C)CSc1ccc(c(c1)O)F 62a_100000686035_100000748023 [0,2,0,0,0,0|2,0,0]=4 9191 B14R1.833 CCC(C)CSc1ccc(c(c1)O)F 62a_100000748023_100000686035 [0,2,0,0,0,0|2,0,0]=4 9192 B14R1.833 CCC(C)CSc1ccc(c(c1)O)N 62a_100000739049_100000748023 [0,2,0,0,0,0|2,0,0]=4 9193 B14R1.833 CCC(C)CSc1ccc(c(c1)O)N 62a_100000748023_100000739049 [0,2,0,0,0,0|2,0,0]=4 9194 B14R1.833 CCC(C)CSc1ccc(c(c1)O)O 62a_100000748023_100009813601 [0,2,0,0,0,0|1,0,0]=3 9195 B14R1.833 CCC(C)NCc1ccc(c(c1)F)O 34a_100000758358_100011215416 [0,2,0,0,0,0|2,0,0]=4 9196 B14R1.833 CCC(C)NCc1ccc(c(c1)O)Cl 34a_100020636435_100011215416 [0,2,0,0,0,0|2,0,0]=4 9197 B14R1.833 CCC(C)NCc1ccc(c(c1)O)F 34a_100160469508_100011215416 [0,2,0,0,0,0|2,0,0]=4 9198 B14R1.833 CCC(C)NCc1ccc(c(c1)O)O 34a_100000010075_100011215416 [0,2,0,0,0,0|1,0,0]=3 9199 B14R1.833 CCC(O)CNc1ccc(c(c1)Br)O 34a_100011534360_100011218378 [0,2,0,0,0,0|2,0,0]=4 9200 B14R1.833 CCC(O)CNc1ccc(c(c1)C)O 34a_100011218179_100011218378 [0,2,0,0,0,0|2,0,0]=4 9201 B14R1.833 CCC(O)CNc1ccc(c(c1)C)O 7a_100011218179_100011218378 [0,2,0,0,0,0|2,0,0]=4 9202 B14R1.833 CCC(O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100011218378 [0,2,0,0,0,0|2,0,0]=4 9203 B14R1.833 CCC(O)CNc1ccc(c(c1)F)O 34a_100011220035_100011218378 [0,2,0,0,0,0|2,0,0]=4 9204 B14R1.833 CCC(O)CNc1ccc(c(c1)F)O 7a_100011220035_100011218378 [0,2,0,0,0,0|2,0,0]=4 9205 B14R1.833 CCC(O)CNc1ccc(c(c1)O)C 34a_100000759471_100011218378 [0,2,0,0,0,0|2,0,0]=4 9206 B14R1.833 CCC(O)CNc1ccc(c(c1)O)C 7a_100000759471_100011218378 [0,2,0,0,0,0|2,0,0]=4 9207 B14R1.833 CCC(O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100011218378 [0,2,0,0,0,0|2,0,0]=4 9208 B14R1.833 CCC(O)CNc1ccc(c(c1)O)F 34a_100012017398_100011218378 [0,2,0,0,0,0|2,0,0]=4 9209 B14R1.833 CCC(O)CNc1ccc(c(c1)O)F 7a_100012017398_100011218378 [0,2,0,0,0,0|2,0,0]=4 9210 B14R1.833 CCC(O)CNc1ccc(c(c1)O)O 34a_100102946323_100011218378 [0,2,0,0,0,0|1,0,0]=3 9211 B14R1.833 CCC(O)CSc1ccc(c(c1)Br)O 62a_100011218378_100012361655 [0,2,0,0,0,0|2,0,0]=4 9212 B14R1.833 CCC(O)CSc1ccc(c(c1)Br)O 62a_100012361655_100011218378 [0,2,0,0,0,0|2,0,0]=4 9213 B14R1.833 CCC(O)CSc1ccc(c(c1)C)O 62a_100011218378_100000186361 [0,2,0,0,0,0|2,0,0]=4 9214 B14R1.833 CCC(O)CSc1ccc(c(c1)Cl)O 62a_100011218378_100012360047 [0,2,0,0,0,0|2,0,0]=4 9215 B14R1.833 CCC(O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100011218378 [0,2,0,0,0,0|2,0,0]=4 9216 B14R1.833 CCC(O)CSc1ccc(c(c1)F)O 62a_100000185481_100011218378 [0,2,0,0,0,0|2,0,0]=4 9217 B14R1.833 CCC(O)CSc1ccc(c(c1)F)O 62a_100011218378_100000185481 [0,2,0,0,0,0|2,0,0]=4 9218 B14R1.833 CCC(O)CSc1ccc(c(c1)N)O 62a_100000752626_100011218378 [0,2,0,0,0,0|2,0,0]=4 9219 B14R1.833 CCC(O)CSc1ccc(c(c1)N)O 62a_100011218378_100000752626 [0,2,0,0,0,0|2,0,0]=4 9220 B14R1.833 CCC(O)CSc1ccc(c(c1)O)Br 62a_100011218378_100012356990 [0,2,0,0,0,0|2,0,0]=4 9221 B14R1.833 CCC(O)CSc1ccc(c(c1)O)Br 62a_100012356990_100011218378 [0,2,0,0,0,0|2,0,0]=4 9222 B14R1.833 CCC(O)CSc1ccc(c(c1)O)C 62a_100000685420_100011218378 [0,2,0,0,0,0|2,0,0]=4 9223 B14R1.833 CCC(O)CSc1ccc(c(c1)O)C 62a_100011218378_100000685420 [0,2,0,0,0,0|2,0,0]=4 9224 B14R1.833 CCC(O)CSc1ccc(c(c1)O)Cl 62a_100011218378_100011356854 [0,2,0,0,0,0|2,0,0]=4 9225 B14R1.833 CCC(O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100011218378 [0,2,0,0,0,0|2,0,0]=4 9226 B14R1.833 CCC(O)CSc1ccc(c(c1)O)F 62a_100000686035_100011218378 [0,2,0,0,0,0|2,0,0]=4 9227 B14R1.833 CCC(O)CSc1ccc(c(c1)O)F 62a_100011218378_100000686035 [0,2,0,0,0,0|2,0,0]=4 9228 B14R1.833 CCC(O)CSc1ccc(c(c1)O)N 62a_100000739049_100011218378 [0,2,0,0,0,0|2,0,0]=4 9229 B14R1.833 CCC(O)CSc1ccc(c(c1)O)N 62a_100011218378_100000739049 [0,2,0,0,0,0|2,0,0]=4 9230 B14R1.833 CCC(O)CSc1ccc(c(c1)O)O 62a_100011218378_100009813601 [0,2,0,0,0,0|1,0,0]=3 9231 B14R1.833 CCN(C)CCc1ccc(c(c1)Cl)Cl 2230a_100000225621_100011713676 [0,2,0,0,0,0|2,0,0]=4 9232 B14R1.833 CCN(C)CCc1ccc(c(c1)Cl)Cl 269982a_100000225621_100011713676 [0,2,0,0,0,0|2,0,0]=4 9233 B14R1.833 CCN(C)CCc1ccc(c(c1)Cl)F 2230a_100000225621_100012361305 [0,2,0,0,0,0|2,0,0]=4 9234 B14R1.833 CCN(C)CCc1ccc(c(c1)Cl)F 269982a_100000225621_100012361305 [0,2,0,0,0,0|2,0,0]=4 9235 B14R1.833 CCN(C)CCc1ccc(c(c1)F)F 2230a_100000225621_100000690553 [0,2,0,0,0,0|2,0,0]=4 9236 B14R1.833 CCN(C)CCc1ccc(c(c1)F)F 269982a_100000225621_100000690553 [0,2,0,0,0,0|2,0,0]=4 9237 B14R1.833 CCN(C)CCc1ccc(c(c1)O)O 269982a_100000225621_200010393615 [0,2,0,0,0,0|0,0,0]=2 9238 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)Br)O 34a_100011534360_100009816398 [0,2,0,0,0,0|2,0,0]=4 9239 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)C)O 34a_100011218179_100009816398 [0,2,0,0,0,0|2,0,0]=4 9240 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)C)O 7a_100011218179_100009816398 [0,2,0,0,0,0|2,0,0]=4 9241 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)Cl)O 34a_100000744943_100009816398 [0,2,0,0,0,0|2,0,0]=4 9242 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)F)O 34a_100011220035_100009816398 [0,2,0,0,0,0|2,0,0]=4 9243 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)F)O 7a_100011220035_100009816398 [0,2,0,0,0,0|2,0,0]=4 9244 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)O)C 34a_100000759471_100009816398 [0,2,0,0,0,0|2,0,0]=4 9245 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)O)C 7a_100000759471_100009816398 [0,2,0,0,0,0|2,0,0]=4 9246 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)O)Cl 34a_100011934209_100009816398 [0,2,0,0,0,0|2,0,0]=4 9247 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)O)F 34a_100012017398_100009816398 [0,2,0,0,0,0|2,0,0]=4 9248 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)O)F 7a_100012017398_100009816398 [0,2,0,0,0,0|2,0,0]=4 9249 B14R1.833 CC[C@H](C)CNc1ccc(c(c1)O)O 34a_100102946323_100009816398 [0,2,0,0,0,0|1,0,0]=3 9250 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)Br)O 62a_100009816398_100012361655 [0,2,0,0,0,0|2,0,0]=4 9251 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)Br)O 62a_100012361655_100009816398 [0,2,0,0,0,0|2,0,0]=4 9252 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)C)O 62a_100009816398_100000186361 [0,2,0,0,0,0|2,0,0]=4 9253 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)Cl)O 62a_100009816398_100012360047 [0,2,0,0,0,0|2,0,0]=4 9254 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)Cl)O 62a_100012360047_100009816398 [0,2,0,0,0,0|2,0,0]=4 9255 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)F)O 62a_100000185481_100009816398 [0,2,0,0,0,0|2,0,0]=4 9256 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)F)O 62a_100009816398_100000185481 [0,2,0,0,0,0|2,0,0]=4 9257 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)N)O 62a_100000752626_100009816398 [0,2,0,0,0,0|2,0,0]=4 9258 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)N)O 62a_100009816398_100000752626 [0,2,0,0,0,0|2,0,0]=4 9259 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)Br 62a_100009816398_100012356990 [0,2,0,0,0,0|2,0,0]=4 9260 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)Br 62a_100012356990_100009816398 [0,2,0,0,0,0|2,0,0]=4 9261 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)C 62a_100000685420_100009816398 [0,2,0,0,0,0|2,0,0]=4 9262 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)C 62a_100009816398_100000685420 [0,2,0,0,0,0|2,0,0]=4 9263 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)Cl 62a_100009816398_100011356854 [0,2,0,0,0,0|2,0,0]=4 9264 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)Cl 62a_100011356854_100009816398 [0,2,0,0,0,0|2,0,0]=4 9265 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)F 62a_100000686035_100009816398 [0,2,0,0,0,0|2,0,0]=4 9266 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)F 62a_100009816398_100000686035 [0,2,0,0,0,0|2,0,0]=4 9267 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)N 62a_100000739049_100009816398 [0,2,0,0,0,0|2,0,0]=4 9268 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)N 62a_100009816398_100000739049 [0,2,0,0,0,0|2,0,0]=4 9269 B14R1.833 CC[C@H](C)CSc1ccc(c(c1)O)O 62a_100009816398_100009813601 [0,2,0,0,0,0|1,0,0]=3 9270 B14R1.833 CNC(=O)C=Cc1ccc(c(c1)O)O 240690a_100102657272_100011195073 [0,2,0,0,0,0|0,0,2]=4 9271 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 11a_106832991635_100010220830 [0,2,0,0,0,0|2,0,0]=4 9272 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 1626a_100102657272_100010220830 [0,2,0,0,0,0|2,0,0]=4 9273 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 240690a_100102657272_100010220830 [0,2,0,0,0,0|2,0,0]=4 9274 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)C 527a_100102657272_100010220830 [0,2,0,0,0,0|2,0,0]=4 9275 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 11a_106832991635_100011308364 [0,2,0,0,0,0|2,0,0]=4 9276 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 1626a_100102657272_100011308364 [0,2,0,0,0,0|2,0,0]=4 9277 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 240690a_100102657272_100011308364 [0,2,0,0,0,0|2,0,0]=4 9278 B14R1.833 CNC(=O)CCc1ccc(c(c1)Br)F 527a_100102657272_100011308364 [0,2,0,0,0,0|2,0,0]=4 9279 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 11a_106832991635_100011338283 [0,2,0,0,0,0|2,0,0]=4 9280 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 1626a_100102657272_100011338283 [0,2,0,0,0,0|2,0,0]=4 9281 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 240690a_100102657272_100011338283 [0,2,0,0,0,0|2,0,0]=4 9282 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)C 527a_100102657272_100011338283 [0,2,0,0,0,0|2,0,0]=4 9283 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 11a_106832991635_100011615030 [0,2,0,0,0,0|2,0,0]=4 9284 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 1626a_100102657272_100011615030 [0,2,0,0,0,0|2,0,0]=4 9285 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 240690a_100102657272_100011615030 [0,2,0,0,0,0|2,0,0]=4 9286 B14R1.833 CNC(=O)CCc1ccc(c(c1)C)F 527a_100102657272_100011615030 [0,2,0,0,0,0|2,0,0]=4 9287 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 11a_106832991635_100009812081 [0,2,0,0,0,0|2,0,0]=4 9288 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 1626a_100102657272_100009812081 [0,2,0,0,0,0|2,0,0]=4 9289 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 240690a_100102657272_100009812081 [0,2,0,0,0,0|2,0,0]=4 9290 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Br 527a_100102657272_100009812081 [0,2,0,0,0,0|2,0,0]=4 9291 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 11a_106832991635_100000735579 [0,2,0,0,0,0|2,0,0]=4 9292 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 1626a_100102657272_100000735579 [0,2,0,0,0,0|2,0,0]=4 9293 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 240690a_100102657272_100000735579 [0,2,0,0,0,0|2,0,0]=4 9294 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)Cl 527a_100102657272_100000735579 [0,2,0,0,0,0|2,0,0]=4 9295 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 11a_106832991635_100011218152 [0,2,0,0,0,0|2,0,0]=4 9296 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 1626a_100102657272_100011218152 [0,2,0,0,0,0|2,0,0]=4 9297 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 240690a_100102657272_100011218152 [0,2,0,0,0,0|2,0,0]=4 9298 B14R1.833 CNC(=O)CCc1ccc(c(c1)Cl)F 527a_100102657272_100011218152 [0,2,0,0,0,0|2,0,0]=4 9299 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 11a_106832991635_100010146367 [0,2,0,0,0,0|2,0,0]=4 9300 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 1626a_100102657272_100010146367 [0,2,0,0,0,0|2,0,0]=4 9301 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 240690a_100102657272_100010146367 [0,2,0,0,0,0|2,0,0]=4 9302 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Br 527a_100102657272_100010146367 [0,2,0,0,0,0|2,0,0]=4 9303 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 11a_106832991635_100011830284 [0,2,0,0,0,0|2,0,0]=4 9304 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 1626a_100102657272_100011830284 [0,2,0,0,0,0|2,0,0]=4 9305 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 240690a_100102657272_100011830284 [0,2,0,0,0,0|2,0,0]=4 9306 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)C 527a_100102657272_100011830284 [0,2,0,0,0,0|2,0,0]=4 9307 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 11a_106832991635_100011518922 [0,2,0,0,0,0|2,0,0]=4 9308 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 1626a_100102657272_100011518922 [0,2,0,0,0,0|2,0,0]=4 9309 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 240690a_100102657272_100011518922 [0,2,0,0,0,0|2,0,0]=4 9310 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)Cl 527a_100102657272_100011518922 [0,2,0,0,0,0|2,0,0]=4 9311 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 11a_106832991635_100000737970 [0,2,0,0,0,0|2,0,0]=4 9312 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 1626a_100102657272_100000737970 [0,2,0,0,0,0|2,0,0]=4 9313 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 240690a_100102657272_100000737970 [0,2,0,0,0,0|2,0,0]=4 9314 B14R1.833 CNC(=O)CCc1ccc(c(c1)F)F 527a_100102657272_100000737970 [0,2,0,0,0,0|2,0,0]=4 9315 B14R1.833 CNC(=O)CNc1ccc(c(c1)Br)O 34a_100011534360_100000183359 [0,2,0,0,0,0|1,0,1]=4 9316 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)O 34a_100011218179_100000183359 [0,2,0,0,0,0|1,0,1]=4 9317 B14R1.833 CNC(=O)CNc1ccc(c(c1)C)O 7a_100011218179_100000183359 [0,2,0,0,0,0|1,0,1]=4 9318 B14R1.833 CNC(=O)CNc1ccc(c(c1)Cl)O 34a_100000744943_100000183359 [0,2,0,0,0,0|1,0,1]=4 9319 B14R1.833 CNC(=O)CNc1ccc(c(c1)F)O 34a_100011220035_100000183359 [0,2,0,0,0,0|1,0,1]=4 9320 B14R1.833 CNC(=O)CNc1ccc(c(c1)F)O 7a_100011220035_100000183359 [0,2,0,0,0,0|1,0,1]=4 9321 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)C 34a_100000759471_100000183359 [0,2,0,0,0,0|1,0,1]=4 9322 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)C 7a_100000759471_100000183359 [0,2,0,0,0,0|1,0,1]=4 9323 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)Cl 34a_100011934209_100000183359 [0,2,0,0,0,0|1,0,1]=4 9324 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)F 34a_100012017398_100000183359 [0,2,0,0,0,0|1,0,1]=4 9325 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)F 7a_100012017398_100000183359 [0,2,0,0,0,0|1,0,1]=4 9326 B14R1.833 CNC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000183359 [0,2,0,0,0,0|0,0,1]=3 9327 B14R1.833 CNC(=O)COc1ccc(c(c1)N)O 271570a_203496583355_200010369465 [0,2,0,0,0,0|1,0,1]=4 9328 B14R1.833 CNC(=O)CSc1ccc(c(c1)Br)O 62a_100000183359_100012361655 [0,2,0,0,0,0|1,0,1]=4 9329 B14R1.833 CNC(=O)CSc1ccc(c(c1)Br)O 62a_100012361655_100000183359 [0,2,0,0,0,0|1,0,1]=4 9330 B14R1.833 CNC(=O)CSc1ccc(c(c1)C)O 62a_100000183359_100000186361 [0,2,0,0,0,0|1,0,1]=4 9331 B14R1.833 CNC(=O)CSc1ccc(c(c1)Cl)O 62a_100000183359_100012360047 [0,2,0,0,0,0|1,0,1]=4 9332 B14R1.833 CNC(=O)CSc1ccc(c(c1)Cl)O 62a_100012360047_100000183359 [0,2,0,0,0,0|1,0,1]=4 9333 B14R1.833 CNC(=O)CSc1ccc(c(c1)F)O 62a_100000183359_100000185481 [0,2,0,0,0,0|1,0,1]=4 9334 B14R1.833 CNC(=O)CSc1ccc(c(c1)F)O 62a_100000185481_100000183359 [0,2,0,0,0,0|1,0,1]=4 9335 B14R1.833 CNC(=O)CSc1ccc(c(c1)N)O 62a_100000183359_100000752626 [0,2,0,0,0,0|1,0,1]=4 9336 B14R1.833 CNC(=O)CSc1ccc(c(c1)N)O 62a_100000752626_100000183359 [0,2,0,0,0,0|1,0,1]=4 9337 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Br 62a_100000183359_100012356990 [0,2,0,0,0,0|1,0,1]=4 9338 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Br 62a_100012356990_100000183359 [0,2,0,0,0,0|1,0,1]=4 9339 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)C 62a_100000183359_100000685420 [0,2,0,0,0,0|1,0,1]=4 9340 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)C 62a_100000685420_100000183359 [0,2,0,0,0,0|1,0,1]=4 9341 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Cl 62a_100000183359_100011356854 [0,2,0,0,0,0|1,0,1]=4 9342 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)Cl 62a_100011356854_100000183359 [0,2,0,0,0,0|1,0,1]=4 9343 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)F 62a_100000183359_100000686035 [0,2,0,0,0,0|1,0,1]=4 9344 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)F 62a_100000686035_100000183359 [0,2,0,0,0,0|1,0,1]=4 9345 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)N 62a_100000183359_100000739049 [0,2,0,0,0,0|1,0,1]=4 9346 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)N 62a_100000739049_100000183359 [0,2,0,0,0,0|1,0,1]=4 9347 B14R1.833 CNC(=O)CSc1ccc(c(c1)O)O 62a_100000183359_100009813601 [0,2,0,0,0,0|0,0,1]=3 9348 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 2708a_100000758358_106832991635 [0,2,0,0,0,0|1,0,1]=4 9349 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 2708a_100102657272_100000758358 [0,2,0,0,0,0|1,0,1]=4 9350 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 273464a_100000758358_100102657272 [0,2,0,0,0,0|1,0,1]=4 9351 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 273464a_100102657272_100000758358 [0,2,0,0,0,0|1,0,1]=4 9352 B14R1.833 CNC(=O)NCc1ccc(c(c1)F)O 512a_106832991638_100000758358 [0,2,0,0,0,0|1,0,1]=4 9353 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 2708a_100020636435_106832991635 [0,2,0,0,0,0|1,0,1]=4 9354 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 2708a_100102657272_100020636435 [0,2,0,0,0,0|1,0,1]=4 9355 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 273464a_100020636435_100102657272 [0,2,0,0,0,0|1,0,1]=4 9356 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 273464a_100102657272_100020636435 [0,2,0,0,0,0|1,0,1]=4 9357 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 512a_100020636435_100102657272 [0,2,0,0,0,0|1,0,1]=4 9358 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)Cl 512a_106832991638_100020636435 [0,2,0,0,0,0|1,0,1]=4 9359 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 2708a_100102657272_100160469508 [0,2,0,0,0,0|1,0,1]=4 9360 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 2708a_100160469508_106832991635 [0,2,0,0,0,0|1,0,1]=4 9361 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 273464a_100102657272_100160469508 [0,2,0,0,0,0|1,0,1]=4 9362 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 273464a_100160469508_100102657272 [0,2,0,0,0,0|1,0,1]=4 9363 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 512a_100160469508_100102657272 [0,2,0,0,0,0|1,0,1]=4 9364 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)F 512a_106832991638_100160469508 [0,2,0,0,0,0|1,0,1]=4 9365 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 2708a_100000010075_106832991635 [0,2,0,0,0,0|0,0,1]=3 9366 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100000010075_100102657272 [0,2,0,0,0,0|0,0,1]=3 9367 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 273464a_100102657272_100000010075 [0,2,0,0,0,0|0,0,1]=3 9368 B14R1.833 CNC(=O)NCc1ccc(c(c1)O)O 512a_106832991638_100000010075 [0,2,0,0,0,0|0,0,1]=3 9369 B14R1.833 COC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000747449 [0,2,0,0,0,0|1,0,1]=4 9370 B14R1.833 COC(=O)CSc1ccc(c(c1)O)O 62a_100000747449_100009813601 [0,2,0,0,0,0|1,0,1]=4 9371 B14R1.833 C[C@@H](CO)CNc1ccc(c(c1)O)O 34a_100102946323_100000059175 [0,2,0,0,0,0|2,0,0]=4 9372 B14R1.833 C[C@@H](CO)CSc1ccc(c(c1)O)O 62a_100000059175_100009813601 [0,2,0,0,0,0|2,0,0]=4 9373 B14R1.833 O=C(CF)CCc1ccc(c(c1)O)O 1458a_100000042615_100015361967 [0,2,0,0,0,0|1,0,0]=3 9374 B14R1.833 O=C(CO)CCc1ccc(c(c1)O)O 1458a_100000210174_200010393615 [0,2,0,0,0,0|1,0,0]=3 9375 B14R1.833 O=C(CO)NCc1ccc(c(c1)O)O 240690a_100000010075_100000210174 [0,2,0,0,0,0|2,0,0]=4 9376 B14R1.833 OCC(O)CSc1ccc(c(c1)O)O 62a_100011219619_100009813601 [0,2,0,0,0,0|2,0,0]=4 9377 B14R1.833 OC[C@H](O)CSc1ccc(c(c1)O)O 62a_100009815848_100009813601 [0,2,0,0,0,0|2,0,0]=4 9378 B14R1.833 Oc1ccc(cc1O)NC[C@@H](O)CF 34a_100102946323_100015614560 [0,2,0,0,0,0|2,0,0]=4 9379 B14R1.833 Oc1ccc(cc1O)SC[C@@H](O)CF 62a_100015614560_100009813601 [0,2,0,0,0,0|2,0,0]=4 9380 B14R1.3653 C=C(C)CNc1ccc(c(c1)O)OC 34a_100000211920_100000748629 [0,2,0,0,0,0|2,0,0]=4 9381 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)CO 62a_100000071718_100000211660 [0,2,0,0,0,0|2,0,0]=4 9382 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)CO 62a_100000748629_100000071718 [0,2,0,0,0,0|2,0,0]=4 9383 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)OC 62a_100000748629_100009816560 [0,2,0,0,0,0|2,0,0]=4 9384 B14R1.3653 CC(C)CSc1ccc(c(c1)O)CO 62a_100000071718_100000210760 [0,2,0,0,0,0|2,0,0]=4 9385 B14R1.3653 CC(C)CSc1ccc(c(c1)O)CO 62a_100000210624_100000071718 [0,2,0,0,0,0|2,0,0]=4 9386 B14R1.3653 CC(O)CSc1ccc(c(c1)O)CO 62a_100000071718_100011218427 [0,2,0,0,0,0|2,0,0]=4 9387 B14R1.3653 CC(O)CSc1ccc(c(c1)O)CO 62a_100011218427_100000071718 [0,2,0,0,0,0|2,0,0]=4 9388 B14R1.3653 COc1ccc(cc1Br)CCC(=O)C 1458a_100000736731_200000210301 [0,2,0,0,0,0|2,0,0]=4 9389 B14R1.3653 COc1ccc(cc1Br)CCC(=O)[13CH3] 1458a_100000736731_200025704644 [0,2,0,0,0,0|2,0,0]=4 9390 B14R1.3653 COc1ccc(cc1C)CCC(=O)C 1458a_100011616661_200000210301 [0,2,0,0,0,0|2,0,0]=4 9391 B14R1.3653 COc1ccc(cc1C)CCC(=O)[13CH3] 1458a_100011616661_200025704644 [0,2,0,0,0,0|2,0,0]=4 9392 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)C 1458a_100000735577_200000210301 [0,2,0,0,0,0|2,0,0]=4 9393 B14R1.3653 COc1ccc(cc1Cl)CCC(=O)[13CH3] 1458a_100000735577_200025704644 [0,2,0,0,0,0|2,0,0]=4 9394 B14R1.3653 COc1ccc(cc1F)CCC(=O)C 1458a_100000234888_200000210301 [0,2,0,0,0,0|2,0,0]=4 9395 B14R1.3653 COc1ccc(cc1F)CCC(=O)[13CH3] 1458a_100000234888_200025704644 [0,2,0,0,0,0|2,0,0]=4 9396 B14R1.3653 COc1ccc(cc1O)CCC(=O)C 1458a_100000746301_200000210301 [0,2,0,0,0,0|1,0,0]=3 9397 B14R1.3653 COc1ccc(cc1O)CCC(=O)[13CH3] 1458a_100000746301_200025704644 [0,2,0,0,0,0|1,0,0]=3 9398 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 240690a_100000740000_100015343762 [0,2,0,0,0,0|2,0,0]=4 9399 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 527a_100000740000_100103153847 [0,2,0,0,0,0|2,0,0]=4 9400 B14R1.3653 COc1ccc(cc1O)CNC(C)C 34a_100000740000_100000210206 [0,2,0,0,0,0|2,0,0]=4 9401 B14R1.3653 COc1ccc(cc1O)NCC(C)C 34a_100000211920_100000210624 [0,2,0,0,0,0|2,0,0]=4 9402 B14R1.3653 COc1ccc(cc1O)NCC(C)O 34a_100000211920_100011218427 [0,2,0,0,0,0|2,0,0]=4 9403 B14R1.3653 COc1ccc(cc1O)NC[C@@H](C)O 34a_100000211920_100009817552 [0,2,0,0,0,0|2,0,0]=4 9404 B14R1.3653 COc1ccc(cc1O)SCC(C)C 62a_100000210624_100009816560 [0,2,0,0,0,0|2,0,0]=4 9405 B14R1.3653 COc1ccc(cc1O)SCC(C)O 62a_100011218427_100009816560 [0,2,0,0,0,0|2,0,0]=4 9406 B14R1.3653 COc1ccc(cc1O)SC[C@@H](C)O 62a_100009817552_100009816560 [0,2,0,0,0,0|2,0,0]=4 9407 B14R1.3653 C[C@@H](O)CSc1ccc(c(c1)O)CO 62a_100000071718_100009817552 [0,2,0,0,0,0|2,0,0]=4 9408 B14R1.3653 C[C@@H](O)CSc1ccc(c(c1)O)CO 62a_100009817552_100000071718 [0,2,0,0,0,0|2,0,0]=4 9409 B14R1.791 CCCCc1ccc(c(c1)CNC)O 271570a_100020621405_100011602694 [0,2,0,0,0,0|2,0,0]=4 9410 B14R1.791 CCCCc1ccc(c(c1)COC)Br 271570a_100020621405_202125822959 [0,2,0,0,0,0|2,0,0]=4 9411 B14R1.791 CCCCc1ccc(c(c1)COC)F 271570a_100020621405_100010140362 [0,2,0,0,0,0|2,0,0]=4 9412 B14R1.791 CCCCc1ccc(c(c1)OCC)C 271570a_100020621405_100012361169 [0,2,0,0,0,0|2,0,0]=4 9413 B14R1.791 CCCCc1ccc(c(c1)OCC)F 271570a_100020621405_200012344967 [0,2,0,0,0,0|2,0,0]=4 9414 B14R1.791 CCCCc1ccc(c(c1)OCC)N 271570a_100020621405_100000688918 [0,2,0,0,0,0|2,0,0]=4 9415 B14R1.791 CCNCc1ccc(c(c1)OCC)O 34a_200000751567_100000210202 [0,2,0,0,0,0|2,0,0]=4 9416 B14R1.793 CCCCc1cc(c(cn1)CO)OC 271570a_100020621405_100010714672 [0,2,0,0,0,0|2,0,0]=4 9417 B14R1.793 CCCCc1ccc(c(c1)C#N)OC 271570a_100020621405_100000188252 [0,2,0,0,0,0|2,0,0]=4 9418 B14R1.793 CCCCc1ccc(c(c1)C=O)OC 271570a_100020621405_100000170026 [0,2,0,0,0,0|1,0,1]=4 9419 B14R1.793 CCCCc1ccc(c(c1)CC)OC 271570a_100020621405_200010179862 [0,2,0,0,0,0|2,0,0]=4 9420 B14R1.793 CCCCc1ccc(c(c1)CN)OC 271570a_100020621405_100000690498 [0,2,0,0,0,0|2,0,0]=4 9421 B14R1.793 CCCCc1ccc(c(c1)CO)CC 271570a_100020621405_100010766240 [0,2,0,0,0,0|2,0,0]=4 9422 B14R1.793 CCCCc1ccc(c(c1)CO)CO 271570a_100020621405_100000719600 [0,2,0,0,0,0|1,0,0]=3 9423 B14R1.793 CCCCc1ccc(c(c1)CO)OC 271570a_100020621405_100000204679 [0,2,0,0,0,0|1,0,0]=3 9424 B14R1.793 CCCCc1ccc(c(c1)OC)C#N 271570a_100020621405_100000694671 [0,2,0,0,0,0|2,0,0]=4 9425 B14R1.793 CCCCc1ccc(c(c1)OC)C=O 271570a_100020621405_100000697075 [0,2,0,0,0,0|1,0,1]=4 9426 B14R1.793 CCCCc1ccc(c(c1)OC)CC 271570a_100020621405_200010710398 [0,2,0,0,0,0|2,0,0]=4 9427 B14R1.793 CCCCc1ccc(c(c1)OC)CO 271570a_100020621405_100011277633 [0,2,0,0,0,0|1,0,0]=3 9428 B14R1.793 CCCCc1ccc(c(c1)OC)OC 271570a_100020621405_100000187503 [0,2,0,0,0,0|1,0,0]=3 9429 B14R1.793 CCCCc1ccc(c(c1)OC)SC 271570a_100020621405_200011001119 [0,2,0,0,0,0|1,1,0]=4 9430 B14R1.793 CCCCc1ccc(c(c1)SC)OC 271570a_100020621405_200009892704 [0,2,0,0,0,0|1,1,0]=4 9431 B14R1.793 CCCCc1ccc(c(n1)OC)CO 271570a_100020621405_100010988397 [0,2,0,0,0,0|2,0,0]=4 9432 B14R1.793 CCCCc1ccc(c(n1)OC)OC 271570a_100020621405_100010214848 [0,2,0,0,0,0|2,0,0]=4 9433 B14R1.793 CCCCc1cnc(c(c1)CO)OC 271570a_100020621405_100000695684 [0,2,0,0,0,0|2,0,0]=4 9434 B14R1.793 CCCCc1cnc(c(c1)OC)CO 271570a_100020621405_200010246159 [0,2,0,0,0,0|2,0,0]=4 9435 B14R1.793 CCCCc1cnc(c(c1)OC)OC 271570a_100020621405_100010234541 [0,2,0,0,0,0|2,0,0]=4 9436 B14R1.793 CCCNc1ccc(c(c1)OC)CO 34a_100012183141_100000210303 [0,2,0,0,0,0|2,0,0]=4 9437 B14R1.793 CCCNc1ccc(c(c1)OC)OC 34a_100000187404_100000210303 [0,2,0,0,0,0|2,0,0]=4 9438 B14R1.793 CCCOc1ccc(c(c1)OC)CO 34a_200000116926_100000210303 [0,2,0,0,0,0|2,0,0]=4 9439 B14R1.793 CCCOc1ccc(c(c1)OC)OC 34a_100000039706_100000210303 [0,2,0,0,0,0|2,0,0]=4 9440 B14R1.793 CCCSc1ccc(c(c1)CO)CO 62a_100000210303_100000719600 [0,2,0,0,0,0|2,0,0]=4 9441 B14R1.793 CCCSc1ccc(c(c1)CO)CO 62a_100000719600_100000210303 [0,2,0,0,0,0|2,0,0]=4 9442 B14R1.793 CCCSc1ccc(c(c1)CO)OC 62a_100000204679_100000210303 [0,2,0,0,0,0|2,0,0]=4 9443 B14R1.793 CCCSc1ccc(c(c1)CO)OC 62a_100000210303_100000204679 [0,2,0,0,0,0|2,0,0]=4 9444 B14R1.793 CCCSc1ccc(c(c1)OC)CO 62a_100000210303_100011277633 [0,2,0,0,0,0|2,0,0]=4 9445 B14R1.793 CCCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210303 [0,2,0,0,0,0|2,0,0]=4 9446 B14R1.793 CCCSc1ccc(c(c1)OC)OC 62a_100000210303_100011356967 [0,2,0,0,0,0|2,0,0]=4 9447 B14R1.793 CCNCc1ccc(c(c1)CO)OC 207a_100015525214_100011361677 [0,2,0,0,0,0|2,0,0]=4 9448 B14R1.793 CCNCc1ccc(c(c1)CO)OC 270004a_100015525214_100011361677 [0,2,0,0,0,0|2,0,0]=4 9449 B14R1.793 CCNCc1ccc(c(c1)OC)OC 207a_100015525214_100000170513 [0,2,0,0,0,0|2,0,0]=4 9450 B14R1.793 CCNCc1ccc(c(c1)OC)OC 2230a_100015525214_100011233839 [0,2,0,0,0,0|2,0,0]=4 9451 B14R1.793 CCNCc1ccc(c(c1)OC)OC 270004a_100015525214_100000170513 [0,2,0,0,0,0|2,0,0]=4 9452 B14R1.793 CCNCc1ccc(c(c1)OC)OC 34a_100000185555_100000210202 [0,2,0,0,0,0|2,0,0]=4 9453 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000083705_200000210301 [0,2,0,0,0,0|2,0,0]=4 9454 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000210929_100000210202 [0,2,0,0,0,0|2,0,0]=4 9455 B14R1.793 CCOCc1ccc(c(c1)OC)OC 7a_100000083705_200000210301 [0,2,0,0,0,0|2,0,0]=4 9456 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 34a_100000083705_200025704644 [0,2,0,0,0,0|2,0,0]=4 9457 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 7a_100000083705_200025704644 [0,2,0,0,0,0|2,0,0]=4 9458 B14R1.793 CCSCc1ccc(c(c1)OC)OC 62a_100000210202_100011233839 [0,2,0,0,0,0|2,0,0]=4 9459 B14R1.793 CNCCc1ccc(c(c1)OC)OC 2230a_100000210947_200000210301 [0,2,0,0,0,0|0,0,0]=2 9460 B14R1.793 CNCCc1ccc(c(c1)OC)OC 2230a_106832991635_100011273988 [0,2,0,0,0,0|0,0,0]=2 9461 B14R1.793 CNCCc1ccc(c(c1)OC)OC 270004a_106832991635_100011754369 [0,2,0,0,0,0|0,0,0]=2 9462 B14R1.793 CNCCc1ccc(c(c1)OC)OC 34a_100000210947_200000210301 [0,2,0,0,0,0|0,0,0]=2 9463 B14R1.793 CNCCc1ccc(c(c1)OC)OC 34a_100102657272_100011273988 [0,2,0,0,0,0|0,0,0]=2 9464 B14R1.793 CNCCc1ccc(c(c1)OC)OC 7a_106832991635_100011740610 [0,2,0,0,0,0|0,0,0]=2 9465 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100011215274_200000210301 [0,2,0,0,0,0|1,0,0]=3 9466 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100138415774_100011273988 [0,2,0,0,0,0|1,0,0]=3 9467 B14R1.793 COCSc1ccc(c(c1)CO)CO 62a_100000719600_100000766300 [0,2,0,0,0,0|2,0,0]=4 9468 B14R1.793 COCSc1ccc(c(c1)CO)CO 62a_100000766300_100000719600 [0,2,0,0,0,0|2,0,0]=4 9469 B14R1.793 COCSc1ccc(c(c1)CO)OC 62a_100000204679_100000766300 [0,2,0,0,0,0|2,0,0]=4 9470 B14R1.793 COCSc1ccc(c(c1)CO)OC 62a_100000766300_100000204679 [0,2,0,0,0,0|2,0,0]=4 9471 B14R1.793 COCSc1ccc(c(c1)OC)CO 62a_100000766300_100011277633 [0,2,0,0,0,0|2,0,0]=4 9472 B14R1.793 COCSc1ccc(c(c1)OC)CO 62a_100011277633_100000766300 [0,2,0,0,0,0|2,0,0]=4 9473 B14R1.793 COCSc1ccc(c(c1)OC)OC 62a_100000766300_100011356967 [0,2,0,0,0,0|2,0,0]=4 9474 B14R1.793 COc1cc(ccc1CO)NCSC 34a_100012183141_100011218213 [0,2,0,0,0,0|2,0,0]=4 9475 B14R1.793 COc1cc(ccc1CO)OCSC 34a_200000116926_100011218213 [0,2,0,0,0,0|2,0,0]=4 9476 B14R1.793 COc1cc(ccc1CO)SCSC 62a_100011218213_100011277633 [0,2,0,0,0,0|2,0,0]=4 9477 B14R1.793 COc1cc(ccc1CO)SCSC 62a_100011277633_100011218213 [0,2,0,0,0,0|2,0,0]=4 9478 B14R1.793 COc1cc(ccc1O[13CH3])CCCO 34a_100000060467_200025704644 [0,2,0,0,0,0|2,0,0]=4 9479 B14R1.793 COc1cc(ccc1O[13CH3])CCCO 7a_100000060467_200025704644 [0,2,0,0,0,0|2,0,0]=4 9480 B14R1.793 COc1ccc(cc1CO)SCSC 62a_100000204679_100011218213 [0,2,0,0,0,0|2,0,0]=4 9481 B14R1.793 COc1ccc(cc1CO)SCSC 62a_100011218213_100000204679 [0,2,0,0,0,0|2,0,0]=4 9482 B14R1.793 COc1ccc(cc1OC)CCCO 34a_100000060467_200000210301 [0,2,0,0,0,0|2,0,0]=4 9483 B14R1.793 COc1ccc(cc1OC)CCCO 7a_100000060467_200000210301 [0,2,0,0,0,0|2,0,0]=4 9484 B14R1.793 COc1ccc(cc1OC)CCN[13CH3] 2230a_100000210947_200025704644 [0,2,0,0,0,0|0,0,0]=2 9485 B14R1.793 COc1ccc(cc1OC)CCN[13CH3] 34a_100000210947_200025704644 [0,2,0,0,0,0|0,0,0]=2 9486 B14R1.793 COc1ccc(cc1OC)CCO[13CH3] 34a_100011215274_200025704644 [0,2,0,0,0,0|1,0,0]=3 9487 B14R1.793 COc1ccc(cc1OC)CCSC 62a_200000210301_100011740610 [0,2,0,0,0,0|1,0,0]=3 9488 B14R1.793 COc1ccc(cc1OC)CCS[13CH3] 62a_200025704644_100011740610 [0,2,0,0,0,0|1,0,0]=3 9489 B14R1.793 COc1ccc(cc1OC)NCSC 34a_100000187404_100011218213 [0,2,0,0,0,0|2,0,0]=4 9490 B14R1.793 COc1ccc(cc1OC)OCSC 34a_100000039706_100011218213 [0,2,0,0,0,0|2,0,0]=4 9491 B14R1.793 COc1ccc(cc1OC)SCSC 62a_100011218213_100011356967 [0,2,0,0,0,0|2,0,0]=4 9492 B14R1.793 CSCSc1ccc(c(c1)CO)CO 62a_100000719600_100011218213 [0,2,0,0,0,0|2,0,0]=4 9493 B14R1.793 CSCSc1ccc(c(c1)CO)CO 62a_100011218213_100000719600 [0,2,0,0,0,0|2,0,0]=4 9494 B14R1.794 CCCCc1ccc(c(c1)B(O)O)Br 271570a_100020621405_200010171685 [0,2,0,0,0,0|2,0,0]=4 9495 B14R1.794 CCCCc1ccc(c(c1)B(O)O)C 271570a_100020621405_100010223188 [0,2,0,0,0,0|2,0,0]=4 9496 B14R1.794 CCCCc1ccc(c(c1)B(O)O)F 271570a_100020621405_100011356809 [0,2,0,0,0,0|2,0,0]=4 9497 B14R1.794 CCCCc1ccc(c(c1)B(O)O)O 271570a_100020621405_200009814749 [0,2,0,0,0,0|1,0,0]=3 9498 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)O 271570a_100020621405_100000212127 [0,2,0,0,0,0|1,0,1]=4 9499 B14R1.794 CCCCc1ccc(c(c1)C(=O)N)O 271570a_100020621405_100000192807 [0,2,0,0,0,0|1,0,1]=4 9500 B14R1.794 CCCCc1ccc(c(c1)C(C)C)O 271570a_100020621405_100000691460 [0,2,0,0,0,0|2,0,0]=4 9501 B14R1.794 CCCCc1ccc(c(c1)C(C)O)F 271570a_100020621405_100011943926 [0,2,0,0,0,0|2,0,0]=4 9502 B14R1.794 CNCCc1ccc(c(c1)[N+](=O)[O-])O 2230a_100000075816_200000210301 [0,2,0,0,0,0|0,0,1]=3 9503 B14R1.794 [13CH3]NCCc1ccc(c(c1)[N+](=O)[O-])O 2230a_100000075816_200025704644 [0,2,0,0,0,0|0,0,1]=3 9504 B14R1.907 C#CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000688953 [0,2,0,0,0,0|1,0,1]=4 9505 B14R1.907 C#CCCSc1ccc(c(c1)CO)O 62a_100000184703_100000688953 [0,2,0,0,0,0|1,0,1]=4 9506 B14R1.907 C#CCCSc1ccc(c(c1)CO)O 62a_100000688953_100000184703 [0,2,0,0,0,0|1,0,1]=4 9507 B14R1.907 C#CCCSc1ccc(c(c1)OC)O 62a_100000688953_100000694246 [0,2,0,0,0,0|1,0,1]=4 9508 B14R1.907 C#CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000184674 [0,2,0,0,0,0|1,0,1]=4 9509 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)O 34a_100000726020_100102629194 [0,2,0,0,0,0|1,0,1]=4 9510 B14R1.907 C/C=C/CSc1ccc(c(c1)CO)O 62a_100000184703_100102629194 [0,2,0,0,0,0|1,0,1]=4 9511 B14R1.907 C/C=C/CSc1ccc(c(c1)CO)O 62a_100102629194_100000184703 [0,2,0,0,0,0|1,0,1]=4 9512 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)O 62a_100102629194_100000694246 [0,2,0,0,0,0|1,0,1]=4 9513 B14R1.907 C=CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000754431 [0,2,0,0,0,0|1,0,1]=4 9514 B14R1.907 C=CCCSc1ccc(c(c1)CO)O 62a_100000184703_100000754431 [0,2,0,0,0,0|1,0,1]=4 9515 B14R1.907 C=CCCSc1ccc(c(c1)CO)O 62a_100000754431_100000184703 [0,2,0,0,0,0|1,0,1]=4 9516 B14R1.907 C=CCCSc1ccc(c(c1)OC)O 62a_100000754431_100000694246 [0,2,0,0,0,0|1,0,1]=4 9517 B14R1.907 C=CCNCc1ccc(c(c1)OC)O 34a_100000185554_100015514636 [0,2,0,0,0,0|1,0,1]=4 9518 B14R1.907 CC#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000748600 [0,2,0,0,0,0|1,0,1]=4 9519 B14R1.907 CC#CCSc1ccc(c(c1)CO)O 62a_100000184703_100000748600 [0,2,0,0,0,0|1,0,1]=4 9520 B14R1.907 CC#CCSc1ccc(c(c1)CO)O 62a_100000748600_100000184703 [0,2,0,0,0,0|1,0,1]=4 9521 B14R1.907 CC#CCSc1ccc(c(c1)OC)O 62a_100000748600_100000694246 [0,2,0,0,0,0|1,0,1]=4 9522 B14R1.907 CC=CCNc1ccc(c(c1)OC)O 34a_100000726020_100000070051 [0,2,0,0,0,0|1,0,1]=4 9523 B14R1.907 CC=CCSc1ccc(c(c1)CO)O 62a_100000070051_100000184703 [0,2,0,0,0,0|1,0,1]=4 9524 B14R1.907 CC=CCSc1ccc(c(c1)CO)O 62a_100000184703_100000070051 [0,2,0,0,0,0|1,0,1]=4 9525 B14R1.907 CC=CCSc1ccc(c(c1)OC)O 62a_100000070051_100000694246 [0,2,0,0,0,0|1,0,1]=4 9526 B14R1.907 CCCC=Cc1ccc(c(c1)CO)O 271570a_100016258520_100000184703 [0,2,0,0,0,0|1,0,1]=4 9527 B14R1.907 CCCC=Cc1ccc(c(c1)OC)O 271570a_100016258520_100000694246 [0,2,0,0,0,0|1,0,1]=4 9528 B14R1.907 CCCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210210 [0,2,0,0,0,0|2,0,0]=4 9529 B14R1.907 CCCCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000210211 [0,2,0,0,0,0|2,0,0]=4 9530 B14R1.907 CCCCNc1ccc(c(c1)CO)Br 34a_100012347228_100000210210 [0,2,0,0,0,0|2,0,0]=4 9531 B14R1.907 CCCCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000210211 [0,2,0,0,0,0|2,0,0]=4 9532 B14R1.907 CCCCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000210210 [0,2,0,0,0,0|2,0,0]=4 9533 B14R1.907 CCCCNc1ccc(c(c1)CO)F 34a_100011218011_100000210210 [0,2,0,0,0,0|2,0,0]=4 9534 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210211 [0,2,0,0,0,0|2,0,0]=4 9535 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210210 [0,2,0,0,0,0|2,0,0]=4 9536 B14R1.907 CCCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210211 [0,2,0,0,0,0|2,0,0]=4 9537 B14R1.907 CCCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210210 [0,2,0,0,0,0|2,0,0]=4 9538 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210211 [0,2,0,0,0,0|2,0,0]=4 9539 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210210 [0,2,0,0,0,0|2,0,0]=4 9540 B14R1.907 CCCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210211 [0,2,0,0,0,0|2,0,0]=4 9541 B14R1.907 CCCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210210 [0,2,0,0,0,0|2,0,0]=4 9542 B14R1.907 CCCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210210 [0,2,0,0,0,0|2,0,0]=4 9543 B14R1.907 CCCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210210 [0,2,0,0,0,0|1,0,0]=3 9544 B14R1.907 CCCCOc1ccc(c(c1)CO)Br 34a_100012351483_100000210210 [0,2,0,0,0,0|2,0,0]=4 9545 B14R1.907 CCCCOc1ccc(c(c1)CO)Br 7a_100012351483_100000210211 [0,2,0,0,0,0|2,0,0]=4 9546 B14R1.907 CCCCOc1ccc(c(c1)CO)C 34a_100009878257_100000210210 [0,2,0,0,0,0|2,0,0]=4 9547 B14R1.907 CCCCOc1ccc(c(c1)CO)C 7a_100009878257_100000210211 [0,2,0,0,0,0|2,0,0]=4 9548 B14R1.907 CCCCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000210210 [0,2,0,0,0,0|2,0,0]=4 9549 B14R1.907 CCCCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000210211 [0,2,0,0,0,0|2,0,0]=4 9550 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210210 [0,2,0,0,0,0|2,0,0]=4 9551 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210211 [0,2,0,0,0,0|2,0,0]=4 9552 B14R1.907 CCCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210210 [0,2,0,0,0,0|2,0,0]=4 9553 B14R1.907 CCCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210211 [0,2,0,0,0,0|2,0,0]=4 9554 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210210 [0,2,0,0,0,0|2,0,0]=4 9555 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210211 [0,2,0,0,0,0|2,0,0]=4 9556 B14R1.907 CCCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210210 [0,2,0,0,0,0|2,0,0]=4 9557 B14R1.907 CCCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210211 [0,2,0,0,0,0|2,0,0]=4 9558 B14R1.907 CCCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210210 [0,2,0,0,0,0|2,0,0]=4 9559 B14R1.907 CCCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210211 [0,2,0,0,0,0|2,0,0]=4 9560 B14R1.907 CCCCSc1ccc(c(c1)C#N)O 62a_100000210211_100000687585 [0,2,0,0,0,0|2,0,0]=4 9561 B14R1.907 CCCCSc1ccc(c(c1)C=O)O 62a_100000210211_100000186750 [0,2,0,0,0,0|1,0,1]=4 9562 B14R1.907 CCCCSc1ccc(c(c1)CC)O 62a_100000210211_100012338938 [0,2,0,0,0,0|2,0,0]=4 9563 B14R1.907 CCCCSc1ccc(c(c1)CN)O 62a_100000210211_100000730032 [0,2,0,0,0,0|2,0,0]=4 9564 B14R1.907 CCCCSc1ccc(c(c1)CN)O 62a_100000730032_100000210210 [0,2,0,0,0,0|2,0,0]=4 9565 B14R1.907 CCCCSc1ccc(c(c1)CO)Br 62a_100000210211_100012359683 [0,2,0,0,0,0|2,0,0]=4 9566 B14R1.907 CCCCSc1ccc(c(c1)CO)Br 62a_100012359683_100000210210 [0,2,0,0,0,0|2,0,0]=4 9567 B14R1.907 CCCCSc1ccc(c(c1)CO)C 62a_100000210211_100000700630 [0,2,0,0,0,0|2,0,0]=4 9568 B14R1.907 CCCCSc1ccc(c(c1)CO)C 62a_100000700630_100000210210 [0,2,0,0,0,0|2,0,0]=4 9569 B14R1.907 CCCCSc1ccc(c(c1)CO)Cl 62a_100000210211_100010128486 [0,2,0,0,0,0|2,0,0]=4 9570 B14R1.907 CCCCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000210210 [0,2,0,0,0,0|2,0,0]=4 9571 B14R1.907 CCCCSc1ccc(c(c1)CO)F 62a_100000210211_100000246282 [0,2,0,0,0,0|2,0,0]=4 9572 B14R1.907 CCCCSc1ccc(c(c1)CO)F 62a_100000246282_100000210210 [0,2,0,0,0,0|2,0,0]=4 9573 B14R1.907 CCCCSc1ccc(c(c1)CO)N 62a_100000210211_100012353972 [0,2,0,0,0,0|2,0,0]=4 9574 B14R1.907 CCCCSc1ccc(c(c1)CO)N 62a_100012353972_100000210210 [0,2,0,0,0,0|2,0,0]=4 9575 B14R1.907 CCCCSc1ccc(c(c1)CO)O 62a_100000184703_100000210210 [0,2,0,0,0,0|1,0,0]=3 9576 B14R1.907 CCCCSc1ccc(c(c1)CO)O 62a_100000210211_100000184703 [0,2,0,0,0,0|1,0,0]=3 9577 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100000210211_100012353699 [0,2,0,0,0,0|2,0,0]=4 9578 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210210 [0,2,0,0,0,0|2,0,0]=4 9579 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100000210211_100011830276 [0,2,0,0,0,0|2,0,0]=4 9580 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210210 [0,2,0,0,0,0|2,0,0]=4 9581 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100000210211_100011356853 [0,2,0,0,0,0|2,0,0]=4 9582 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210210 [0,2,0,0,0,0|2,0,0]=4 9583 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100000210211_100011934186 [0,2,0,0,0,0|2,0,0]=4 9584 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210210 [0,2,0,0,0,0|2,0,0]=4 9585 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100000210211_100015196925 [0,2,0,0,0,0|2,0,0]=4 9586 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210210 [0,2,0,0,0,0|2,0,0]=4 9587 B14R1.907 CCCCSc1ccc(c(c1)OC)O 62a_100000210211_100000694246 [0,2,0,0,0,0|1,0,0]=3 9588 B14R1.907 CCCCSc1ccc(c(n1)OC)O 62a_100000210211_100010893133 [0,2,0,0,0,0|2,0,0]=4 9589 B14R1.907 CCCCSc1cnc(c(c1)CO)O 62a_100000210211_100010065268 [0,2,0,0,0,0|2,0,0]=4 9590 B14R1.907 CCCCSc1cnc(c(c1)CO)O 62a_100010065268_100000210210 [0,2,0,0,0,0|2,0,0]=4 9591 B14R1.907 CCCNCc1ccc(c(c1)CO)Br 207a_100020643023_100015639582 [0,2,0,0,0,0|2,0,0]=4 9592 B14R1.907 CCCNCc1ccc(c(c1)CO)Br 270004a_100020643023_100015639582 [0,2,0,0,0,0|2,0,0]=4 9593 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 207a_100020643023_100010244714 [0,2,0,0,0,0|2,0,0]=4 9594 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 270004a_100020643023_100010244714 [0,2,0,0,0,0|2,0,0]=4 9595 B14R1.907 CCCNCc1ccc(c(c1)OC)C 207a_100020643023_100000719150 [0,2,0,0,0,0|2,0,0]=4 9596 B14R1.907 CCCNCc1ccc(c(c1)OC)C 270004a_100020643023_100000719150 [0,2,0,0,0,0|2,0,0]=4 9597 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 207a_100020643023_100011998524 [0,2,0,0,0,0|2,0,0]=4 9598 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210303 [0,2,0,0,0,0|2,0,0]=4 9599 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 270004a_100020643023_100011998524 [0,2,0,0,0,0|2,0,0]=4 9600 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210303 [0,2,0,0,0,0|2,0,0]=4 9601 B14R1.907 CCCNCc1ccc(c(c1)OC)F 207a_100020643023_100000692873 [0,2,0,0,0,0|2,0,0]=4 9602 B14R1.907 CCCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210303 [0,2,0,0,0,0|2,0,0]=4 9603 B14R1.907 CCCNCc1ccc(c(c1)OC)F 270004a_100020643023_100000692873 [0,2,0,0,0,0|2,0,0]=4 9604 B14R1.907 CCCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210303 [0,2,0,0,0,0|2,0,0]=4 9605 B14R1.907 CCCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210303 [0,2,0,0,0,0|1,0,0]=3 9606 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100000210258_100010110085 [0,2,0,0,0,0|2,0,0]=4 9607 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210303 [0,2,0,0,0,0|2,0,0]=4 9608 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210303 [0,2,0,0,0,0|2,0,0]=4 9609 B14R1.907 CCCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210303 [0,2,0,0,0,0|2,0,0]=4 9610 B14R1.907 CCCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210303 [0,2,0,0,0,0|2,0,0]=4 9611 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100000210258_200010214485 [0,2,0,0,0,0|2,0,0]=4 9612 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210303 [0,2,0,0,0,0|2,0,0]=4 9613 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000210258_100012349856 [0,2,0,0,0,0|2,0,0]=4 9614 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210303 [0,2,0,0,0,0|2,0,0]=4 9615 B14R1.907 CCCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210303 [0,2,0,0,0,0|2,0,0]=4 9616 B14R1.907 CCCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210303 [0,2,0,0,0,0|2,0,0]=4 9617 B14R1.907 CCCSCc1ccc(c(c1)C=O)O 62a_100000210303_100000008128 [0,2,0,0,0,0|1,0,1]=4 9618 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100000210303_100010110085 [0,2,0,0,0,0|2,0,0]=4 9619 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210303 [0,2,0,0,0,0|2,0,0]=4 9620 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_100000210303_200010214485 [0,2,0,0,0,0|2,0,0]=4 9621 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210303 [0,2,0,0,0,0|2,0,0]=4 9622 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100000210303_100012349856 [0,2,0,0,0,0|2,0,0]=4 9623 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210303 [0,2,0,0,0,0|2,0,0]=4 9624 B14R1.907 CCNCCc1ccc(c(c1)OC)O 2230a_100015525214_100010741665 [0,2,0,0,0,0|0,0,0]=2 9625 B14R1.907 CCNCCc1ccc(c(c1)OC)O 34a_100000756042_100000210202 [0,2,0,0,0,0|0,0,0]=2 9626 B14R1.907 CCNN=Cc1ccc(c(c1)OC)O 4a_100000756455_100000188322 [0,2,0,0,0,0|1,0,1]=4 9627 B14R1.907 CCOCSc1ccc(c(c1)CO)O 62a_100000184703_100000739092 [0,2,0,0,0,0|2,0,0]=4 9628 B14R1.907 CCOCSc1ccc(c(c1)CO)O 62a_100000739092_100000184703 [0,2,0,0,0,0|2,0,0]=4 9629 B14R1.907 CCOCSc1ccc(c(c1)OC)O 62a_100000739092_100000694246 [0,2,0,0,0,0|2,0,0]=4 9630 B14R1.907 CCSCCc1ccc(c(c1)OC)O 62a_100000210202_100010741665 [0,2,0,0,0,0|1,0,0]=3 9631 B14R1.907 CCc1cc(ccc1O)SCCOC 62a_100000233755_100012338938 [0,2,0,0,0,0|2,0,0]=4 9632 B14R1.907 CCc1cc(ccc1O)SCCSC 62a_100000212216_100012338938 [0,2,0,0,0,0|2,0,0]=4 9633 B14R1.907 COCC=Cc1ccc(c(c1)CO)O 271570a_100016286323_100000184703 [0,2,0,0,0,0|1,0,1]=4 9634 B14R1.907 COCC=Cc1ccc(c(c1)OC)O 271570a_100016286323_100000694246 [0,2,0,0,0,0|1,0,1]=4 9635 B14R1.907 COCCNc1ccc(c(c1)C#N)O 34a_100011249283_100011201679 [0,2,0,0,0,0|2,0,0]=4 9636 B14R1.907 COCCNc1ccc(c(c1)CO)Br 2230a_100012347228_100011201679 [0,2,0,0,0,0|2,0,0]=4 9637 B14R1.907 COCCNc1ccc(c(c1)CO)Br 34a_100012347228_100011201679 [0,2,0,0,0,0|2,0,0]=4 9638 B14R1.907 COCCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100011201679 [0,2,0,0,0,0|2,0,0]=4 9639 B14R1.907 COCCNc1ccc(c(c1)CO)Cl 34a_100011273577_100011201679 [0,2,0,0,0,0|2,0,0]=4 9640 B14R1.907 COCCNc1ccc(c(c1)CO)F 34a_100011218011_100011201679 [0,2,0,0,0,0|2,0,0]=4 9641 B14R1.907 COCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100011201679 [0,2,0,0,0,0|2,0,0]=4 9642 B14R1.907 COCCNc1ccc(c(c1)OC)Br 34a_100000765947_100011201679 [0,2,0,0,0,0|2,0,0]=4 9643 B14R1.907 COCCNc1ccc(c(c1)OC)C 2230a_100011279678_100011201679 [0,2,0,0,0,0|2,0,0]=4 9644 B14R1.907 COCCNc1ccc(c(c1)OC)C 34a_100011279678_100011201679 [0,2,0,0,0,0|2,0,0]=4 9645 B14R1.907 COCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100011201679 [0,2,0,0,0,0|2,0,0]=4 9646 B14R1.907 COCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100011201679 [0,2,0,0,0,0|2,0,0]=4 9647 B14R1.907 COCCNc1ccc(c(c1)OC)F 2230a_100000701188_100011201679 [0,2,0,0,0,0|2,0,0]=4 9648 B14R1.907 COCCNc1ccc(c(c1)OC)F 34a_100000701188_100011201679 [0,2,0,0,0,0|2,0,0]=4 9649 B14R1.907 COCCNc1ccc(c(c1)OC)I 34a_100000746945_100011201679 [0,2,0,0,0,0|2,0,0]=4 9650 B14R1.907 COCCNc1ccc(c(c1)OC)O 34a_100000726020_100011201679 [0,2,0,0,0,0|1,0,0]=3 9651 B14R1.907 COCCOc1ccc(c(c1)CO)Br 34a_100012351483_100011201679 [0,2,0,0,0,0|2,0,0]=4 9652 B14R1.907 COCCOc1ccc(c(c1)CO)Br 7a_100012351483_100000233755 [0,2,0,0,0,0|2,0,0]=4 9653 B14R1.907 COCCOc1ccc(c(c1)CO)C 34a_100009878257_100011201679 [0,2,0,0,0,0|2,0,0]=4 9654 B14R1.907 COCCOc1ccc(c(c1)CO)C 7a_100009878257_100000233755 [0,2,0,0,0,0|2,0,0]=4 9655 B14R1.907 COCCOc1ccc(c(c1)CO)Cl 34a_100000091669_100011201679 [0,2,0,0,0,0|2,0,0]=4 9656 B14R1.907 COCCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000233755 [0,2,0,0,0,0|2,0,0]=4 9657 B14R1.907 COCCOc1ccc(c(c1)OC)Br 34a_100011827694_100011201679 [0,2,0,0,0,0|2,0,0]=4 9658 B14R1.907 COCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000233755 [0,2,0,0,0,0|2,0,0]=4 9659 B14R1.907 COCCOc1ccc(c(c1)OC)C 34a_100009865632_100011201679 [0,2,0,0,0,0|2,0,0]=4 9660 B14R1.907 COCCOc1ccc(c(c1)OC)C 7a_100009865632_100000233755 [0,2,0,0,0,0|2,0,0]=4 9661 B14R1.907 COCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100011201679 [0,2,0,0,0,0|2,0,0]=4 9662 B14R1.907 COCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000233755 [0,2,0,0,0,0|2,0,0]=4 9663 B14R1.907 COCCOc1ccc(c(c1)OC)F 34a_100012001760_100011201679 [0,2,0,0,0,0|2,0,0]=4 9664 B14R1.907 COCCOc1ccc(c(c1)OC)F 7a_100012001760_100000233755 [0,2,0,0,0,0|2,0,0]=4 9665 B14R1.907 COCCOc1ccc(c(c1)OC)N 34a_100015326901_100011201679 [0,2,0,0,0,0|2,0,0]=4 9666 B14R1.907 COCCOc1ccc(c(c1)OC)N 7a_100015326901_100000233755 [0,2,0,0,0,0|2,0,0]=4 9667 B14R1.907 COCCSc1ccc(c(c1)C#N)O 62a_100000233755_100000687585 [0,2,0,0,0,0|2,0,0]=4 9668 B14R1.907 COCCSc1ccc(c(c1)C=O)O 62a_100000233755_100000186750 [0,2,0,0,0,0|1,0,1]=4 9669 B14R1.907 COCCSc1ccc(c(c1)CN)O 62a_100000233755_100000730032 [0,2,0,0,0,0|2,0,0]=4 9670 B14R1.907 COCCSc1ccc(c(c1)CN)O 62a_100000730032_100000233755 [0,2,0,0,0,0|2,0,0]=4 9671 B14R1.907 COCCSc1ccc(c(c1)CO)Br 62a_100000233755_100012359683 [0,2,0,0,0,0|2,0,0]=4 9672 B14R1.907 COCCSc1ccc(c(c1)CO)Br 62a_100012359683_100000233755 [0,2,0,0,0,0|2,0,0]=4 9673 B14R1.907 COCCSc1ccc(c(c1)CO)C 62a_100000233755_100000700630 [0,2,0,0,0,0|2,0,0]=4 9674 B14R1.907 COCCSc1ccc(c(c1)CO)C 62a_100000700630_100000233755 [0,2,0,0,0,0|2,0,0]=4 9675 B14R1.907 COCCSc1ccc(c(c1)CO)Cl 62a_100000233755_100010128486 [0,2,0,0,0,0|2,0,0]=4 9676 B14R1.907 COCCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000233755 [0,2,0,0,0,0|2,0,0]=4 9677 B14R1.907 COCCSc1ccc(c(c1)CO)F 62a_100000233755_100000246282 [0,2,0,0,0,0|2,0,0]=4 9678 B14R1.907 COCCSc1ccc(c(c1)CO)F 62a_100000246282_100000233755 [0,2,0,0,0,0|2,0,0]=4 9679 B14R1.907 COCCSc1ccc(c(c1)CO)N 62a_100000233755_100012353972 [0,2,0,0,0,0|2,0,0]=4 9680 B14R1.907 COCCSc1ccc(c(c1)CO)N 62a_100012353972_100000233755 [0,2,0,0,0,0|2,0,0]=4 9681 B14R1.907 COCCSc1ccc(c(c1)CO)O 62a_100000184703_100000233755 [0,2,0,0,0,0|1,0,0]=3 9682 B14R1.907 COCCSc1ccc(c(c1)CO)O 62a_100000233755_100000184703 [0,2,0,0,0,0|1,0,0]=3 9683 B14R1.907 COCCSc1ccc(c(c1)OC)Br 62a_100000233755_100012353699 [0,2,0,0,0,0|2,0,0]=4 9684 B14R1.907 COCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000233755 [0,2,0,0,0,0|2,0,0]=4 9685 B14R1.907 COCCSc1ccc(c(c1)OC)C 62a_100000233755_100011830276 [0,2,0,0,0,0|2,0,0]=4 9686 B14R1.907 COCCSc1ccc(c(c1)OC)C 62a_100011830276_100000233755 [0,2,0,0,0,0|2,0,0]=4 9687 B14R1.907 COCCSc1ccc(c(c1)OC)Cl 62a_100000233755_100011356853 [0,2,0,0,0,0|2,0,0]=4 9688 B14R1.907 COCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000233755 [0,2,0,0,0,0|2,0,0]=4 9689 B14R1.907 COCCSc1ccc(c(c1)OC)F 62a_100000233755_100011934186 [0,2,0,0,0,0|2,0,0]=4 9690 B14R1.907 COCCSc1ccc(c(c1)OC)F 62a_100011934186_100000233755 [0,2,0,0,0,0|2,0,0]=4 9691 B14R1.907 COCCSc1ccc(c(c1)OC)N 62a_100000233755_100015196925 [0,2,0,0,0,0|2,0,0]=4 9692 B14R1.907 COCCSc1ccc(c(c1)OC)N 62a_100011279103_100000233755 [0,2,0,0,0,0|2,0,0]=4 9693 B14R1.907 COCCSc1ccc(c(c1)OC)O 62a_100000233755_100000694246 [0,2,0,0,0,0|1,0,0]=3 9694 B14R1.907 COCCSc1ccc(c(n1)OC)O 62a_100000233755_100010893133 [0,2,0,0,0,0|2,0,0]=4 9695 B14R1.907 COCCSc1cnc(c(c1)CO)O 62a_100000233755_100010065268 [0,2,0,0,0,0|2,0,0]=4 9696 B14R1.907 COCCSc1cnc(c(c1)CO)O 62a_100010065268_100000233755 [0,2,0,0,0,0|2,0,0]=4 9697 B14R1.907 COCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000766300 [0,2,0,0,0,0|2,0,0]=4 9698 B14R1.907 COCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000766300 [0,2,0,0,0,0|2,0,0]=4 9699 B14R1.907 COCSCc1ccc(c(c1)C=O)O 62a_100000766300_100000008128 [0,2,0,0,0,0|1,0,1]=4 9700 B14R1.907 COCSCc1ccc(c(c1)OC)Br 62a_100000766300_100010110085 [0,2,0,0,0,0|2,0,0]=4 9701 B14R1.907 COCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000766300 [0,2,0,0,0,0|2,0,0]=4 9702 B14R1.907 COCSCc1ccc(c(c1)OC)Cl 62a_100000766300_200010214485 [0,2,0,0,0,0|2,0,0]=4 9703 B14R1.907 COCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000766300 [0,2,0,0,0,0|2,0,0]=4 9704 B14R1.907 COCSCc1ccc(c(c1)OC)F 62a_100000766300_100012349856 [0,2,0,0,0,0|2,0,0]=4 9705 B14R1.907 COCSCc1ccc(c(c1)OC)F 62a_100012349856_100000766300 [0,2,0,0,0,0|2,0,0]=4 9706 B14R1.907 COc1cc(ccc1Br)COCSC 34a_100010234685_100011218213 [0,2,0,0,0,0|2,0,0]=4 9707 B14R1.907 COc1cc(ccc1Br)CSCSC 62a_100010110085_100011218213 [0,2,0,0,0,0|2,0,0]=4 9708 B14R1.907 COc1cc(ccc1Br)CSCSC 62a_100011218213_100010110085 [0,2,0,0,0,0|2,0,0]=4 9709 B14R1.907 COc1cc(ccc1Br)NCCSC 2230a_100000765947_100000751147 [0,2,0,0,0,0|2,0,0]=4 9710 B14R1.907 COc1cc(ccc1Br)NCCSC 34a_100000765947_100000212216 [0,2,0,0,0,0|2,0,0]=4 9711 B14R1.907 COc1cc(ccc1Br)OCCSC 34a_100011827694_100000212216 [0,2,0,0,0,0|2,0,0]=4 9712 B14R1.907 COc1cc(ccc1Br)OCCSC 7a_100011827694_100000212216 [0,2,0,0,0,0|2,0,0]=4 9713 B14R1.907 COc1cc(ccc1Br)SCCSC 62a_100000212216_100012353699 [0,2,0,0,0,0|2,0,0]=4 9714 B14R1.907 COc1cc(ccc1Br)SCCSC 62a_100012353699_100000751147 [0,2,0,0,0,0|2,0,0]=4 9715 B14R1.907 COc1cc(ccc1C)COCSC 34a_100000752651_100011218213 [0,2,0,0,0,0|2,0,0]=4 9716 B14R1.907 COc1cc(ccc1C)NCCSC 2230a_100011279678_100000751147 [0,2,0,0,0,0|2,0,0]=4 9717 B14R1.907 COc1cc(ccc1C)NCCSC 34a_100011279678_100000212216 [0,2,0,0,0,0|2,0,0]=4 9718 B14R1.907 COc1cc(ccc1C)OCCSC 34a_100009865632_100000212216 [0,2,0,0,0,0|2,0,0]=4 9719 B14R1.907 COc1cc(ccc1C)OCCSC 7a_100009865632_100000212216 [0,2,0,0,0,0|2,0,0]=4 9720 B14R1.907 COc1cc(ccc1C)SCCSC 62a_100000212216_100011830276 [0,2,0,0,0,0|2,0,0]=4 9721 B14R1.907 COc1cc(ccc1C)SCCSC 62a_100011830276_100000751147 [0,2,0,0,0,0|2,0,0]=4 9722 B14R1.907 COc1cc(ccc1Cl)CNCSC 2230a_100015204853_100011218213 [0,2,0,0,0,0|2,0,0]=4 9723 B14R1.907 COc1cc(ccc1Cl)CNCSC 34a_100015204853_100011218213 [0,2,0,0,0,0|2,0,0]=4 9724 B14R1.907 COc1cc(ccc1Cl)COCSC 34a_100012179228_100011218213 [0,2,0,0,0,0|2,0,0]=4 9725 B14R1.907 COc1cc(ccc1Cl)CSCSC 62a_100011218213_200010214485 [0,2,0,0,0,0|2,0,0]=4 9726 B14R1.907 COc1cc(ccc1Cl)CSCSC 62a_200010214485_100011218213 [0,2,0,0,0,0|2,0,0]=4 9727 B14R1.907 COc1cc(ccc1Cl)NCCSC 2230a_100000742311_100000751147 [0,2,0,0,0,0|2,0,0]=4 9728 B14R1.907 COc1cc(ccc1Cl)NCCSC 34a_100000742311_100000212216 [0,2,0,0,0,0|2,0,0]=4 9729 B14R1.907 COc1cc(ccc1Cl)OCCSC 34a_100012186310_100000212216 [0,2,0,0,0,0|2,0,0]=4 9730 B14R1.907 COc1cc(ccc1Cl)OCCSC 7a_100012186310_100000212216 [0,2,0,0,0,0|2,0,0]=4 9731 B14R1.907 COc1cc(ccc1Cl)SCCSC 62a_100000212216_100011356853 [0,2,0,0,0,0|2,0,0]=4 9732 B14R1.907 COc1cc(ccc1Cl)SCCSC 62a_100011356853_100000751147 [0,2,0,0,0,0|2,0,0]=4 9733 B14R1.907 COc1cc(ccc1F)CNCSC 2230a_100020626639_100011218213 [0,2,0,0,0,0|2,0,0]=4 9734 B14R1.907 COc1cc(ccc1F)CNCSC 34a_100020626639_100011218213 [0,2,0,0,0,0|2,0,0]=4 9735 B14R1.907 COc1cc(ccc1F)COCSC 34a_100000692429_100011218213 [0,2,0,0,0,0|2,0,0]=4 9736 B14R1.907 COc1cc(ccc1F)CSCSC 62a_100011218213_100012349856 [0,2,0,0,0,0|2,0,0]=4 9737 B14R1.907 COc1cc(ccc1F)CSCSC 62a_100012349856_100011218213 [0,2,0,0,0,0|2,0,0]=4 9738 B14R1.907 COc1cc(ccc1F)NCCSC 2230a_100000701188_100000751147 [0,2,0,0,0,0|2,0,0]=4 9739 B14R1.907 COc1cc(ccc1F)NCCSC 34a_100000701188_100000212216 [0,2,0,0,0,0|2,0,0]=4 9740 B14R1.907 COc1cc(ccc1F)OCCSC 34a_100012001760_100000212216 [0,2,0,0,0,0|2,0,0]=4 9741 B14R1.907 COc1cc(ccc1F)OCCSC 7a_100012001760_100000212216 [0,2,0,0,0,0|2,0,0]=4 9742 B14R1.907 COc1cc(ccc1F)SCCSC 62a_100000212216_100011934186 [0,2,0,0,0,0|2,0,0]=4 9743 B14R1.907 COc1cc(ccc1F)SCCSC 62a_100011934186_100000751147 [0,2,0,0,0,0|2,0,0]=4 9744 B14R1.907 COc1cc(ccc1I)NCCSC 34a_100000746945_100000212216 [0,2,0,0,0,0|2,0,0]=4 9745 B14R1.907 COc1cc(ccc1N)COCSC 34a_100000087641_100011218213 [0,2,0,0,0,0|2,0,0]=4 9746 B14R1.907 COc1cc(ccc1N)OCCSC 34a_100015326901_100000212216 [0,2,0,0,0,0|2,0,0]=4 9747 B14R1.907 COc1cc(ccc1N)OCCSC 7a_100015326901_100000212216 [0,2,0,0,0,0|2,0,0]=4 9748 B14R1.907 COc1cc(ccc1N)SCCSC 62a_100000212216_100015196925 [0,2,0,0,0,0|2,0,0]=4 9749 B14R1.907 COc1cc(ccc1N)SCCSC 62a_100011279103_100000751147 [0,2,0,0,0,0|2,0,0]=4 9750 B14R1.907 COc1cc(ccc1O)CCNCF 34a_100000756042_100015361967 [0,2,0,0,0,0|0,0,0]=2 9751 B14R1.907 COc1cc(ccc1O)CCSCF 62a_100015361967_100010741665 [0,2,0,0,0,0|1,0,0]=3 9752 B14R1.907 COc1cc(ccc1O)CNCC=O 34a_100000185554_200009817547 [0,2,0,0,0,0|2,0,0]=4 9753 B14R1.907 COc1cc(ccc1O)CNCCF 34a_100000185554_100011217306 [0,2,0,0,0,0|2,0,0]=4 9754 B14R1.907 COc1cc(ccc1O)CNCCO 34a_100000185554_100000211926 [0,2,0,0,0,0|2,0,0]=4 9755 B14R1.907 COc1cc(ccc1O)CNCSC 34a_100000185554_100011218213 [0,2,0,0,0,0|1,0,0]=3 9756 B14R1.907 COc1cc(ccc1O)NCCCF 34a_100000726020_100011934791 [0,2,0,0,0,0|2,0,0]=4 9757 B14R1.907 COc1cc(ccc1O)NCCCO 34a_100000726020_100000230001 [0,2,0,0,0,0|2,0,0]=4 9758 B14R1.907 COc1cc(ccc1O)NCCSC 34a_100000726020_100000212216 [0,2,0,0,0,0|1,0,0]=3 9759 B14R1.907 COc1cc(ccc1O)SCCC#N 62a_100011215226_100000694246 [0,2,0,0,0,0|2,0,0]=4 9760 B14R1.907 COc1cc(ccc1O)SCCCF 62a_100011934791_100000694246 [0,2,0,0,0,0|2,0,0]=4 9761 B14R1.907 COc1cc(ccc1O)SCCCO 62a_100011215043_100000694246 [0,2,0,0,0,0|2,0,0]=4 9762 B14R1.907 COc1cc(ccc1O)SCCSC 62a_100000212216_100000694246 [0,2,0,0,0,0|1,0,0]=3 9763 B14R1.907 COc1nc(ccc1O)SCCSC 62a_100000212216_100010893133 [0,2,0,0,0,0|2,0,0]=4 9764 B14R1.907 CSCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000212216 [0,2,0,0,0,0|2,0,0]=4 9765 B14R1.907 CSCCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000751147 [0,2,0,0,0,0|2,0,0]=4 9766 B14R1.907 CSCCNc1ccc(c(c1)CO)Br 34a_100012347228_100000212216 [0,2,0,0,0,0|2,0,0]=4 9767 B14R1.907 CSCCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000751147 [0,2,0,0,0,0|2,0,0]=4 9768 B14R1.907 CSCCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000212216 [0,2,0,0,0,0|2,0,0]=4 9769 B14R1.907 CSCCNc1ccc(c(c1)CO)F 34a_100011218011_100000212216 [0,2,0,0,0,0|2,0,0]=4 9770 B14R1.907 CSCCOc1ccc(c(c1)CO)Br 34a_100012351483_100000212216 [0,2,0,0,0,0|2,0,0]=4 9771 B14R1.907 CSCCOc1ccc(c(c1)CO)Br 7a_100012351483_100000212216 [0,2,0,0,0,0|2,0,0]=4 9772 B14R1.907 CSCCOc1ccc(c(c1)CO)C 34a_100009878257_100000212216 [0,2,0,0,0,0|2,0,0]=4 9773 B14R1.907 CSCCOc1ccc(c(c1)CO)C 7a_100009878257_100000212216 [0,2,0,0,0,0|2,0,0]=4 9774 B14R1.907 CSCCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000212216 [0,2,0,0,0,0|2,0,0]=4 9775 B14R1.907 CSCCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000212216 [0,2,0,0,0,0|2,0,0]=4 9776 B14R1.907 CSCCSc1ccc(c(c1)C#N)O 62a_100000212216_100000687585 [0,2,0,0,0,0|2,0,0]=4 9777 B14R1.907 CSCCSc1ccc(c(c1)C=O)O 62a_100000212216_100000186750 [0,2,0,0,0,0|1,0,1]=4 9778 B14R1.907 CSCCSc1ccc(c(c1)CN)O 62a_100000212216_100000730032 [0,2,0,0,0,0|2,0,0]=4 9779 B14R1.907 CSCCSc1ccc(c(c1)CN)O 62a_100000730032_100000751147 [0,2,0,0,0,0|2,0,0]=4 9780 B14R1.907 CSCCSc1ccc(c(c1)CO)Br 62a_100000212216_100012359683 [0,2,0,0,0,0|2,0,0]=4 9781 B14R1.907 CSCCSc1ccc(c(c1)CO)Br 62a_100012359683_100000751147 [0,2,0,0,0,0|2,0,0]=4 9782 B14R1.907 CSCCSc1ccc(c(c1)CO)C 62a_100000212216_100000700630 [0,2,0,0,0,0|2,0,0]=4 9783 B14R1.907 CSCCSc1ccc(c(c1)CO)C 62a_100000700630_100000751147 [0,2,0,0,0,0|2,0,0]=4 9784 B14R1.907 CSCCSc1ccc(c(c1)CO)Cl 62a_100000212216_100010128486 [0,2,0,0,0,0|2,0,0]=4 9785 B14R1.907 CSCCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000751147 [0,2,0,0,0,0|2,0,0]=4 9786 B14R1.907 CSCCSc1ccc(c(c1)CO)F 62a_100000212216_100000246282 [0,2,0,0,0,0|2,0,0]=4 9787 B14R1.907 CSCCSc1ccc(c(c1)CO)F 62a_100000246282_100000751147 [0,2,0,0,0,0|2,0,0]=4 9788 B14R1.907 CSCCSc1ccc(c(c1)CO)N 62a_100000212216_100012353972 [0,2,0,0,0,0|2,0,0]=4 9789 B14R1.907 CSCCSc1ccc(c(c1)CO)N 62a_100012353972_100000751147 [0,2,0,0,0,0|2,0,0]=4 9790 B14R1.907 CSCCSc1ccc(c(c1)CO)O 62a_100000184703_100000751147 [0,2,0,0,0,0|1,0,0]=3 9791 B14R1.907 CSCCSc1ccc(c(c1)CO)O 62a_100000212216_100000184703 [0,2,0,0,0,0|1,0,0]=3 9792 B14R1.907 CSCCSc1cnc(c(c1)CO)O 62a_100000212216_100010065268 [0,2,0,0,0,0|2,0,0]=4 9793 B14R1.907 CSCCSc1cnc(c(c1)CO)O 62a_100010065268_100000751147 [0,2,0,0,0,0|2,0,0]=4 9794 B14R1.907 CSCSCc1ccc(c(c1)C=O)O 62a_100011218213_100000008128 [0,2,0,0,0,0|1,0,1]=4 9795 B14R1.907 N#CCCSc1ccc(c(c1)CO)O 62a_100000184703_100011215226 [0,2,0,0,0,0|2,0,0]=4 9796 B14R1.907 N#CCCSc1ccc(c(c1)CO)O 62a_100011215226_100000184703 [0,2,0,0,0,0|2,0,0]=4 9797 B14R1.907 OCCCSc1ccc(c(c1)CO)O 62a_100000184703_100011215043 [0,2,0,0,0,0|2,0,0]=4 9798 B14R1.907 OCCCSc1ccc(c(c1)CO)O 62a_100011215043_100000184703 [0,2,0,0,0,0|2,0,0]=4 9799 B14R1.907 OCc1cc(ccc1O)SCCCF 62a_100000184703_100011934791 [0,2,0,0,0,0|2,0,0]=4 9800 B14R1.907 OCc1cc(ccc1O)SCCCF 62a_100011934791_100000184703 [0,2,0,0,0,0|2,0,0]=4 9801 B14R1.1362 CCCCc1ccc(c(c1F)CO)Br 271570a_100020621405_200010782277 [0,2,0,0,0,0|2,0,0]=4 9802 B14R1.1362 CCCCc1ccc(c(c1F)CO)F 271570a_100020621405_100000725363 [0,2,0,0,0,0|2,0,0]=4 9803 B14R1.1362 CCCCc1ccc(c(c1F)OC)Cl 271570a_100020621405_200135222481 [0,2,0,0,0,0|2,0,0]=4 9804 B14R1.1362 CCCCc1ccc(c(c1F)OC)N 271570a_100020621405_100010734149 [0,2,0,0,0,0|2,0,0]=4 9805 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210202 [0,2,0,0,0,0|1,0,1]=4 9806 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100011215416 [0,2,0,0,0,0|2,0,0]=4 9807 B14R1.3405 CCC(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100000758301 [0,2,0,0,0,0|2,0,0]=4 9808 B14R1.3405 CCC(C)Sc1ccc(c(c1)CO)O 62a_100000758301_100000184703 [0,2,0,0,0,0|2,0,0]=4 9809 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)O 62a_100000758301_100000694246 [0,2,0,0,0,0|2,0,0]=4 9810 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 11a_106832991635_200010002685 [0,2,0,0,0,0|1,0,1]=4 9811 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 240690a_100102657272_200010002685 [0,2,0,0,0,0|1,0,1]=4 9812 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 527a_100102657272_200010002685 [0,2,0,0,0,0|1,0,1]=4 9813 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 11a_106832991635_100000117344 [0,2,0,0,0,0|1,0,1]=4 9814 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 1626a_100102657272_100000117344 [0,2,0,0,0,0|1,0,1]=4 9815 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 240690a_100102657272_100000117344 [0,2,0,0,0,0|1,0,1]=4 9816 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 527a_100102657272_100000117344 [0,2,0,0,0,0|1,0,1]=4 9817 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 240690a_100102657272_100000032101 [0,2,0,0,0,0|0,0,1]=3 9818 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 527a_100102657272_100000032101 [0,2,0,0,0,0|0,0,1]=3 9819 B14R1.3405 CNC(=O)Nc1ccc(c(c1)OC)O 2430a_100000726020_100102657272 [0,2,0,0,0,0|1,0,1]=4 9820 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)C 270004a_106832991635_200000081148 [0,2,0,0,0,0|1,0,0]=3 9821 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)F 270004a_106832991635_200000078651 [0,2,0,0,0,0|1,0,0]=3 9822 B14R1.3405 COC(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100009879195 [0,2,0,0,0,0|2,0,0]=4 9823 B14R1.3405 COC(C)Sc1ccc(c(c1)CO)O 62a_100009879195_100000184703 [0,2,0,0,0,0|2,0,0]=4 9824 B14R1.3405 COc1cc(ccc1O)SC(C)OC 62a_100009879195_100000694246 [0,2,0,0,0,0|2,0,0]=4 9825 B14R1.4435 CCCCc1cc(c(cc1Br)Br)OC 271570a_100020621405_200014006352 [0,2,0,0,0,0|2,0,0]=4 9826 B14R1.4435 CCCCc1cc(c(cc1C)F)OC 271570a_100020621405_100011009880 [0,2,0,0,0,0|2,0,0]=4 9827 B14R1.4435 CCCCc1cc(c(cc1C)N)OC 271570a_100020621405_100010141321 [0,2,0,0,0,0|2,0,0]=4 9828 B14R1.4435 CCCCc1cc(c(cc1F)Cl)OC 271570a_100020621405_100010739614 [0,2,0,0,0,0|2,0,0]=4 9829 B14R1.4435 CCCCc1cc(c(cc1F)F)CO 271570a_100020621405_100016029355 [0,2,0,0,0,0|2,0,0]=4 9830 B14R1.4435 CCCCc1cc(c(cc1F)F)OC 271570a_100020621405_200015541288 [0,2,0,0,0,0|2,0,0]=4 9831 B14R1.4435 CCCCc1cc(c(cc1F)N)OC 271570a_100020621405_100012766639 [0,2,0,0,0,0|2,0,0]=4 9832 B14R1.4435 CCCCc1cc(c(cc1F)O)C=O 271570a_100020621405_100010175118 [0,2,0,0,0,0|1,0,1]=4 9833 B14R1.4435 CCCCc1cc(c(cc1F)O)OC 271570a_100020621405_100010189133 [0,2,0,0,0,0|1,0,0]=3 9834 B14R1.4435 CCCCc1cc(c(cc1N)C)OC 271570a_100020621405_200010584344 [0,2,0,0,0,0|2,0,0]=4 9835 B14R1.4435 CCCCc1cc(c(cc1N)F)OC 271570a_100020621405_100010365326 [0,2,0,0,0,0|2,0,0]=4 9836 B14R1.4435 CCCCc1cc(c(cc1O)O)C=O 271570a_100020621405_200010132312 [0,2,0,0,0,0|1,0,1]=4 9837 B14R1.4435 CCCSc1cc(c(cc1F)O)OC 62a_100000210303_100010189133 [0,2,0,0,0,0|2,0,0]=4 9838 B14R1.4435 COCSc1cc(c(cc1F)O)OC 62a_100000766300_100010189133 [0,2,0,0,0,0|2,0,0]=4 9839 B14R1.4435 COc1cc(c(cc1O)F)SCSC 62a_100011218213_100010189133 [0,2,0,0,0,0|2,0,0]=4 9840 B14R1.792 CCCCc1ccc(c(c1)C)B(O)O 271570a_100020621405_100010074995 [0,2,0,0,0,0|2,0,0]=4 9841 B14R1.792 CCCCc1ccc(c(c1)F)B(O)O 271570a_100020621405_100009813958 [0,2,0,0,0,0|2,0,0]=4 9842 B14R1.792 CCCCc1ccc(c(c1)O)B(O)O 271570a_100020621405_100010158982 [0,2,0,0,0,0|1,0,0]=3 9843 B14R1.792 CCCCc1ccc(c(c1)O)C(=O)C 271570a_100020621405_100000188348 [0,2,0,0,0,0|1,0,1]=4 9844 B14R1.792 CCCCc1ccc(c(c1)O)C(=O)N 271570a_100020621405_100011550861 [0,2,0,0,0,0|1,0,1]=4 9845 B14R1.792 CCCSc1ccc(c(c1)O)B(O)O 62a_100000210303_100010158982 [0,2,0,0,0,0|2,0,0]=4 9846 B14R1.792 COCSc1ccc(c(c1)O)B(O)O 62a_100000766300_100010158982 [0,2,0,0,0,0|2,0,0]=4 9847 B14R1.792 CSCSc1ccc(c(c1)O)B(O)O 62a_100011218213_100010158982 [0,2,0,0,0,0|2,0,0]=4 9848 B14R1.795 CCCCc1ccc(c(c1)C)OCC 271570a_100020621405_100011308936 [0,2,0,0,0,0|2,0,0]=4 9849 B14R1.795 CCCCc1ccc(c(c1)F)CCO 271570a_100020621405_100011962869 [0,2,0,0,0,0|2,0,0]=4 9850 B14R1.795 CCCCc1ccc(c(c1)F)OCC 271570a_100020621405_200000171753 [0,2,0,0,0,0|2,0,0]=4 9851 B14R1.795 CCCCc1ccc(c(c1)N)COC 271570a_100020621405_100013084866 [0,2,0,0,0,0|2,0,0]=4 9852 B14R1.795 CCCCc1ccc(c(c1)N)OCC 271570a_100020621405_100000751366 [0,2,0,0,0,0|2,0,0]=4 9853 B14R1.909 C#CCCNc1ccc(c(c1)O)OC 34a_100000211920_100000688953 [0,2,0,0,0,0|1,0,1]=4 9854 B14R1.909 C#CCCSc1ccc(c(c1)O)CO 62a_100000071718_100000688953 [0,2,0,0,0,0|1,0,1]=4 9855 B14R1.909 C#CCCSc1ccc(c(c1)O)CO 62a_100000688953_100000071718 [0,2,0,0,0,0|1,0,1]=4 9856 B14R1.909 C#CCCSc1ccc(c(c1)O)OC 62a_100000688953_100009816560 [0,2,0,0,0,0|1,0,1]=4 9857 B14R1.909 C#CCNCc1ccc(c(c1)O)OC 34a_100000740000_100000184674 [0,2,0,0,0,0|1,0,1]=4 9858 B14R1.909 C/C=C/CNc1ccc(c(c1)O)OC 34a_100000211920_100102629194 [0,2,0,0,0,0|1,0,1]=4 9859 B14R1.909 C/C=C/CSc1ccc(c(c1)O)CO 62a_100000071718_100102629194 [0,2,0,0,0,0|1,0,1]=4 9860 B14R1.909 C/C=C/CSc1ccc(c(c1)O)CO 62a_100102629194_100000071718 [0,2,0,0,0,0|1,0,1]=4 9861 B14R1.909 C/C=C/CSc1ccc(c(c1)O)OC 62a_100102629194_100009816560 [0,2,0,0,0,0|1,0,1]=4 9862 B14R1.909 C=CCCNc1ccc(c(c1)O)OC 34a_100000211920_100000754431 [0,2,0,0,0,0|1,0,1]=4 9863 B14R1.909 C=CCCSc1ccc(c(c1)O)CO 62a_100000071718_100000754431 [0,2,0,0,0,0|1,0,1]=4 9864 B14R1.909 C=CCCSc1ccc(c(c1)O)CO 62a_100000754431_100000071718 [0,2,0,0,0,0|1,0,1]=4 9865 B14R1.909 C=CCCSc1ccc(c(c1)O)OC 62a_100000754431_100009816560 [0,2,0,0,0,0|1,0,1]=4 9866 B14R1.909 C=CCNCc1ccc(c(c1)O)OC 34a_100000740000_100015514636 [0,2,0,0,0,0|1,0,1]=4 9867 B14R1.909 CC#CCNc1ccc(c(c1)O)OC 34a_100000211920_100000748600 [0,2,0,0,0,0|1,0,1]=4 9868 B14R1.909 CC#CCSc1ccc(c(c1)O)CO 62a_100000071718_100000748600 [0,2,0,0,0,0|1,0,1]=4 9869 B14R1.909 CC#CCSc1ccc(c(c1)O)CO 62a_100000748600_100000071718 [0,2,0,0,0,0|1,0,1]=4 9870 B14R1.909 CC#CCSc1ccc(c(c1)O)OC 62a_100000748600_100009816560 [0,2,0,0,0,0|1,0,1]=4 9871 B14R1.909 CC=CCNc1ccc(c(c1)O)OC 34a_100000211920_100000070051 [0,2,0,0,0,0|1,0,1]=4 9872 B14R1.909 CC=CCSc1ccc(c(c1)O)CO 62a_100000070051_100000071718 [0,2,0,0,0,0|1,0,1]=4 9873 B14R1.909 CC=CCSc1ccc(c(c1)O)CO 62a_100000071718_100000070051 [0,2,0,0,0,0|1,0,1]=4 9874 B14R1.909 CC=CCSc1ccc(c(c1)O)OC 62a_100000070051_100009816560 [0,2,0,0,0,0|1,0,1]=4 9875 B14R1.909 CCCC=Cc1ccc(c(c1)O)CO 271570a_100016258520_100000071718 [0,2,0,0,0,0|1,0,1]=4 9876 B14R1.909 CCCC=Cc1ccc(c(c1)O)OC 271570a_100016258520_100009816560 [0,2,0,0,0,0|1,0,1]=4 9877 B14R1.909 CCCCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210210 [0,2,0,0,0,0|2,0,0]=4 9878 B14R1.909 CCCCNc1ccc(c(c1)C)CO 34a_100000102464_100000210210 [0,2,0,0,0,0|2,0,0]=4 9879 B14R1.909 CCCCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210211 [0,2,0,0,0,0|2,0,0]=4 9880 B14R1.909 CCCCNc1ccc(c(c1)C)OC 34a_100000743268_100000210210 [0,2,0,0,0,0|2,0,0]=4 9881 B14R1.909 CCCCNc1ccc(c(c1)C)OC 7a_100000743268_100000210211 [0,2,0,0,0,0|2,0,0]=4 9882 B14R1.909 CCCCNc1ccc(c(c1)Cl)CO 34a_100000689119_100000210210 [0,2,0,0,0,0|2,0,0]=4 9883 B14R1.909 CCCCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210211 [0,2,0,0,0,0|2,0,0]=4 9884 B14R1.909 CCCCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210210 [0,2,0,0,0,0|2,0,0]=4 9885 B14R1.909 CCCCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210211 [0,2,0,0,0,0|2,0,0]=4 9886 B14R1.909 CCCCNc1ccc(c(c1)F)OC 34a_100000740183_100000210210 [0,2,0,0,0,0|2,0,0]=4 9887 B14R1.909 CCCCNc1ccc(c(c1)I)OC 34a_100011356947_100000210210 [0,2,0,0,0,0|2,0,0]=4 9888 B14R1.909 CCCCNc1ccc(c(c1)O)C#N 34a_100000094571_100000210210 [0,2,0,0,0,0|2,0,0]=4 9889 B14R1.909 CCCCNc1ccc(c(c1)O)C#N 7a_100000094571_100000210211 [0,2,0,0,0,0|2,0,0]=4 9890 B14R1.909 CCCCNc1ccc(c(c1)O)OC 34a_100000211920_100000210210 [0,2,0,0,0,0|1,0,0]=3 9891 B14R1.909 CCCCOc1ccc(c(c1)Br)CO 34a_100010146404_100000210210 [0,2,0,0,0,0|2,0,0]=4 9892 B14R1.909 CCCCOc1ccc(c(c1)Br)CO 7a_100010146404_100000210211 [0,2,0,0,0,0|2,0,0]=4 9893 B14R1.909 CCCCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210210 [0,2,0,0,0,0|2,0,0]=4 9894 B14R1.909 CCCCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210211 [0,2,0,0,0,0|2,0,0]=4 9895 B14R1.909 CCCCOc1ccc(c(c1)C)OC 34a_100000759738_100000210210 [0,2,0,0,0,0|2,0,0]=4 9896 B14R1.909 CCCCOc1ccc(c(c1)C)OC 7a_100000759738_100000210211 [0,2,0,0,0,0|2,0,0]=4 9897 B14R1.909 CCCCOc1ccc(c(c1)Cl)CO 34a_200000075811_100000210210 [0,2,0,0,0,0|2,0,0]=4 9898 B14R1.909 CCCCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000210211 [0,2,0,0,0,0|2,0,0]=4 9899 B14R1.909 CCCCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210210 [0,2,0,0,0,0|2,0,0]=4 9900 B14R1.909 CCCCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210211 [0,2,0,0,0,0|2,0,0]=4 9901 B14R1.909 CCCCOc1ccc(c(c1)F)CO 34a_100000084598_100000210210 [0,2,0,0,0,0|2,0,0]=4 9902 B14R1.909 CCCCOc1ccc(c(c1)F)CO 7a_100000084598_100000210211 [0,2,0,0,0,0|2,0,0]=4 9903 B14R1.909 CCCCOc1ccc(c(c1)F)OC 34a_100000746305_100000210210 [0,2,0,0,0,0|2,0,0]=4 9904 B14R1.909 CCCCOc1ccc(c(c1)F)OC 7a_100000746305_100000210211 [0,2,0,0,0,0|2,0,0]=4 9905 B14R1.909 CCCCOc1ccc(c(c1)I)OC 34a_100010084122_100000210210 [0,2,0,0,0,0|2,0,0]=4 9906 B14R1.909 CCCCOc1ccc(c(c1)I)OC 7a_100010084122_100000210211 [0,2,0,0,0,0|2,0,0]=4 9907 B14R1.909 CCCCSc1cc(c(cn1)OC)O 62a_100000210211_100010264082 [0,2,0,0,0,0|2,0,0]=4 9908 B14R1.909 CCCCSc1ccc(c(c1)Br)CO 62a_100000210211_100010240206 [0,2,0,0,0,0|2,0,0]=4 9909 B14R1.909 CCCCSc1ccc(c(c1)Br)CO 62a_100010240206_100000210210 [0,2,0,0,0,0|2,0,0]=4 9910 B14R1.909 CCCCSc1ccc(c(c1)Br)OC 62a_100000210211_100011249507 [0,2,0,0,0,0|2,0,0]=4 9911 B14R1.909 CCCCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210210 [0,2,0,0,0,0|2,0,0]=4 9912 B14R1.909 CCCCSc1ccc(c(c1)C)CO 62a_100000210211_100000748258 [0,2,0,0,0,0|2,0,0]=4 9913 B14R1.909 CCCCSc1ccc(c(c1)C)CO 62a_100000748258_100000210210 [0,2,0,0,0,0|2,0,0]=4 9914 B14R1.909 CCCCSc1ccc(c(c1)C)OC 62a_100000210211_100011219705 [0,2,0,0,0,0|2,0,0]=4 9915 B14R1.909 CCCCSc1ccc(c(c1)C)OC 62a_100011219705_100000210210 [0,2,0,0,0,0|2,0,0]=4 9916 B14R1.909 CCCCSc1ccc(c(c1)Cl)OC 62a_100000210211_100012355395 [0,2,0,0,0,0|2,0,0]=4 9917 B14R1.909 CCCCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210210 [0,2,0,0,0,0|2,0,0]=4 9918 B14R1.909 CCCCSc1ccc(c(c1)F)CO 62a_100000210211_100011191541 [0,2,0,0,0,0|2,0,0]=4 9919 B14R1.909 CCCCSc1ccc(c(c1)F)CO 62a_100011191541_100000210210 [0,2,0,0,0,0|2,0,0]=4 9920 B14R1.909 CCCCSc1ccc(c(c1)F)OC 62a_100000171752_100000210210 [0,2,0,0,0,0|2,0,0]=4 9921 B14R1.909 CCCCSc1ccc(c(c1)F)OC 62a_100000210211_100000171752 [0,2,0,0,0,0|2,0,0]=4 9922 B14R1.909 CCCCSc1ccc(c(c1)N)CO 62a_100000210211_100000718831 [0,2,0,0,0,0|2,0,0]=4 9923 B14R1.909 CCCCSc1ccc(c(c1)N)CO 62a_100000718831_100000210210 [0,2,0,0,0,0|2,0,0]=4 9924 B14R1.909 CCCCSc1ccc(c(c1)N)OC 62a_100000210211_100011249504 [0,2,0,0,0,0|2,0,0]=4 9925 B14R1.909 CCCCSc1ccc(c(c1)N)OC 62a_100011249504_100000210210 [0,2,0,0,0,0|2,0,0]=4 9926 B14R1.909 CCCCSc1ccc(c(c1)O)C#N 62a_100000210211_100011934713 [0,2,0,0,0,0|2,0,0]=4 9927 B14R1.909 CCCCSc1ccc(c(c1)O)C=O 62a_100000210211_100011277552 [0,2,0,0,0,0|1,0,1]=4 9928 B14R1.909 CCCCSc1ccc(c(c1)O)C=O 62a_100011277552_100000210210 [0,2,0,0,0,0|1,0,1]=4 9929 B14R1.909 CCCCSc1ccc(c(c1)O)CO 62a_100000071718_100000210210 [0,2,0,0,0,0|1,0,0]=3 9930 B14R1.909 CCCCSc1ccc(c(c1)O)CO 62a_100000210211_100000071718 [0,2,0,0,0,0|1,0,0]=3 9931 B14R1.909 CCCCSc1ccc(c(c1)O)OC 62a_100000210211_100009816560 [0,2,0,0,0,0|1,0,0]=3 9932 B14R1.909 CCCCSc1cnc(c(c1)O)OC 62a_100000210211_100010135713 [0,2,0,0,0,0|2,0,0]=4 9933 B14R1.909 CCCNCc1ccc(c(c1)Br)OC 207a_100020643023_100000173361 [0,2,0,0,0,0|2,0,0]=4 9934 B14R1.909 CCCNCc1ccc(c(c1)Br)OC 270004a_100020643023_100000173361 [0,2,0,0,0,0|2,0,0]=4 9935 B14R1.909 CCCNCc1ccc(c(c1)Br)OC 34a_100159240714_100000210303 [0,2,0,0,0,0|2,0,0]=4 9936 B14R1.909 CCCNCc1ccc(c(c1)C)OC 207a_100020643023_100000239718 [0,2,0,0,0,0|2,0,0]=4 9937 B14R1.909 CCCNCc1ccc(c(c1)C)OC 2230a_100102679029_100000210303 [0,2,0,0,0,0|2,0,0]=4 9938 B14R1.909 CCCNCc1ccc(c(c1)C)OC 270004a_100020643023_100000239718 [0,2,0,0,0,0|2,0,0]=4 9939 B14R1.909 CCCNCc1ccc(c(c1)C)OC 34a_100102679029_100000210303 [0,2,0,0,0,0|2,0,0]=4 9940 B14R1.909 CCCNCc1ccc(c(c1)Cl)OC 207a_100020643023_100000186747 [0,2,0,0,0,0|2,0,0]=4 9941 B14R1.909 CCCNCc1ccc(c(c1)Cl)OC 2230a_100000008799_100000210303 [0,2,0,0,0,0|2,0,0]=4 9942 B14R1.909 CCCNCc1ccc(c(c1)Cl)OC 270004a_100020643023_100000186747 [0,2,0,0,0,0|2,0,0]=4 9943 B14R1.909 CCCNCc1ccc(c(c1)Cl)OC 34a_100000008799_100000210303 [0,2,0,0,0,0|2,0,0]=4 9944 B14R1.909 CCCNCc1ccc(c(c1)F)OC 207a_100020643023_100000204617 [0,2,0,0,0,0|2,0,0]=4 9945 B14R1.909 CCCNCc1ccc(c(c1)F)OC 2230a_100000737316_100000210303 [0,2,0,0,0,0|2,0,0]=4 9946 B14R1.909 CCCNCc1ccc(c(c1)F)OC 270004a_100020643023_100000204617 [0,2,0,0,0,0|2,0,0]=4 9947 B14R1.909 CCCNCc1ccc(c(c1)F)OC 34a_100000737316_100000210303 [0,2,0,0,0,0|2,0,0]=4 9948 B14R1.909 CCCNCc1ccc(c(c1)I)OC 207a_100020643023_100009827998 [0,2,0,0,0,0|2,0,0]=4 9949 B14R1.909 CCCNCc1ccc(c(c1)I)OC 270004a_100020643023_100009827998 [0,2,0,0,0,0|2,0,0]=4 9950 B14R1.909 CCCNCc1ccc(c(c1)O)OC 34a_100000740000_100000210303 [0,2,0,0,0,0|1,0,0]=3 9951 B14R1.909 CCCOCc1ccc(c(c1)Br)OC 34a_100000210258_200011397701 [0,2,0,0,0,0|2,0,0]=4 9952 B14R1.909 CCCOCc1ccc(c(c1)Br)OC 34a_100000246451_100000210303 [0,2,0,0,0,0|2,0,0]=4 9953 B14R1.909 CCCOCc1ccc(c(c1)Br)OC 7a_100000246451_100000210303 [0,2,0,0,0,0|2,0,0]=4 9954 B14R1.909 CCCOCc1ccc(c(c1)C)OC 34a_100000210258_200011290836 [0,2,0,0,0,0|2,0,0]=4 9955 B14R1.909 CCCOCc1ccc(c(c1)C)OC 34a_200011290855_100000210303 [0,2,0,0,0,0|2,0,0]=4 9956 B14R1.909 CCCOCc1ccc(c(c1)C)OC 7a_200011290855_100000210303 [0,2,0,0,0,0|2,0,0]=4 9957 B14R1.909 CCCOCc1ccc(c(c1)Cl)OC 34a_100000210258_100000693707 [0,2,0,0,0,0|2,0,0]=4 9958 B14R1.909 CCCOCc1ccc(c(c1)Cl)OC 34a_100000694469_100000210303 [0,2,0,0,0,0|2,0,0]=4 9959 B14R1.909 CCCOCc1ccc(c(c1)Cl)OC 7a_100000694469_100000210303 [0,2,0,0,0,0|2,0,0]=4 9960 B14R1.909 CCCOCc1ccc(c(c1)F)OC 34a_100000210258_100000189595 [0,2,0,0,0,0|2,0,0]=4 9961 B14R1.909 CCCOCc1ccc(c(c1)F)OC 34a_100000246395_100000210303 [0,2,0,0,0,0|2,0,0]=4 9962 B14R1.909 CCCOCc1ccc(c(c1)F)OC 7a_100000246395_100000210303 [0,2,0,0,0,0|2,0,0]=4 9963 B14R1.909 CCCOCc1ccc(c(c1)I)OC 34a_200000013966_100000210303 [0,2,0,0,0,0|2,0,0]=4 9964 B14R1.909 CCCOCc1ccc(c(c1)I)OC 7a_200000013966_100000210303 [0,2,0,0,0,0|2,0,0]=4 9965 B14R1.909 CCCOCc1ccc(c(c1)N)OC 34a_100011269841_100000210303 [0,2,0,0,0,0|2,0,0]=4 9966 B14R1.909 CCCSCc1ccc(c(c1)Br)OC 62a_100000210303_200011397701 [0,2,0,0,0,0|2,0,0]=4 9967 B14R1.909 CCCSCc1ccc(c(c1)Br)OC 62a_200011397701_100000210303 [0,2,0,0,0,0|2,0,0]=4 9968 B14R1.909 CCCSCc1ccc(c(c1)C)OC 62a_100000210303_200011290836 [0,2,0,0,0,0|2,0,0]=4 9969 B14R1.909 CCCSCc1ccc(c(c1)C)OC 62a_200011290836_100000210303 [0,2,0,0,0,0|2,0,0]=4 9970 B14R1.909 CCCSCc1ccc(c(c1)Cl)OC 62a_100000210303_100000693707 [0,2,0,0,0,0|2,0,0]=4 9971 B14R1.909 CCCSCc1ccc(c(c1)Cl)OC 62a_100000693707_100000210303 [0,2,0,0,0,0|2,0,0]=4 9972 B14R1.909 CCCSCc1ccc(c(c1)F)OC 62a_100000189595_100000210303 [0,2,0,0,0,0|2,0,0]=4 9973 B14R1.909 CCCSCc1ccc(c(c1)F)OC 62a_100000210303_100000189595 [0,2,0,0,0,0|2,0,0]=4 9974 B14R1.909 CCNCCc1ccc(c(c1)Br)OC 2230a_103549771065_100000210202 [0,2,0,0,0,0|1,0,0]=3 9975 B14R1.909 CCNCCc1ccc(c(c1)Br)OC 34a_103549771065_100000210202 [0,2,0,0,0,0|1,0,0]=3 9976 B14R1.909 CCNCCc1ccc(c(c1)Cl)OC 2230a_100025770840_100000210202 [0,2,0,0,0,0|1,0,0]=3 9977 B14R1.909 CCNCCc1ccc(c(c1)Cl)OC 34a_100025770840_100000210202 [0,2,0,0,0,0|1,0,0]=3 9978 B14R1.909 CCNCCc1ccc(c(c1)O)OC 2230a_100011207234_100000210202 [0,2,0,0,0,0|0,0,0]=2 9979 B14R1.909 CCNCCc1ccc(c(c1)O)OC 34a_100011207234_100000210202 [0,2,0,0,0,0|0,0,0]=2 9980 B14R1.909 CCNN=Cc1ccc(c(c1)O)OC 4a_100000756455_100000211151 [0,2,0,0,0,0|1,0,1]=4 9981 B14R1.909 CCOCCc1ccc(c(c1)Br)OC 34a_100011962876_100000210202 [0,2,0,0,0,0|2,0,0]=4 9982 B14R1.909 CCOCCc1ccc(c(c1)Br)OC 7a_100011962876_100000210202 [0,2,0,0,0,0|2,0,0]=4 9983 B14R1.909 CCOCCc1ccc(c(c1)F)OC 34a_100011755164_100000210202 [0,2,0,0,0,0|2,0,0]=4 9984 B14R1.909 CCOCCc1ccc(c(c1)F)OC 7a_100011755164_100000210202 [0,2,0,0,0,0|2,0,0]=4 9985 B14R1.909 CCOCSc1ccc(c(c1)O)CO 62a_100000071718_100000739092 [0,2,0,0,0,0|2,0,0]=4 9986 B14R1.909 CCOCSc1ccc(c(c1)O)CO 62a_100000739092_100000071718 [0,2,0,0,0,0|2,0,0]=4 9987 B14R1.909 CCOCSc1ccc(c(c1)O)OC 62a_100000739092_100009816560 [0,2,0,0,0,0|2,0,0]=4 9988 B14R1.909 COCC=Cc1ccc(c(c1)O)CO 271570a_100016286323_100000071718 [0,2,0,0,0,0|1,0,1]=4 9989 B14R1.909 COCC=Cc1ccc(c(c1)O)OC 271570a_100016286323_100009816560 [0,2,0,0,0,0|1,0,1]=4 9990 B14R1.909 COCCNc1ccc(c(c1)Br)OC 34a_100000187427_100011201679 [0,2,0,0,0,0|2,0,0]=4 9991 B14R1.909 COCCNc1ccc(c(c1)C)CO 34a_100000102464_100011201679 [0,2,0,0,0,0|2,0,0]=4 9992 B14R1.909 COCCNc1ccc(c(c1)C)OC 2230a_100000743268_100011201679 [0,2,0,0,0,0|2,0,0]=4 9993 B14R1.909 COCCNc1ccc(c(c1)C)OC 34a_100000743268_100011201679 [0,2,0,0,0,0|2,0,0]=4 9994 B14R1.909 COCCNc1ccc(c(c1)C)OC 7a_100000743268_100000233755 [0,2,0,0,0,0|2,0,0]=4 9995 B14R1.909 COCCNc1ccc(c(c1)Cl)CO 34a_100000689119_100011201679 [0,2,0,0,0,0|2,0,0]=4 9996 B14R1.909 COCCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100011201679 [0,2,0,0,0,0|2,0,0]=4 9997 B14R1.909 COCCNc1ccc(c(c1)Cl)OC 34a_100000211044_100011201679 [0,2,0,0,0,0|2,0,0]=4 9998 B14R1.909 COCCNc1ccc(c(c1)F)OC 2230a_100000740183_100011201679 [0,2,0,0,0,0|2,0,0]=4 9999 B14R1.909 COCCNc1ccc(c(c1)F)OC 34a_100000740183_100011201679 [0,2,0,0,0,0|2,0,0]=4 10000 B14R1.909 COCCNc1ccc(c(c1)I)OC 34a_100011356947_100011201679 [0,2,0,0,0,0|2,0,0]=4 10001 B14R1.909 COCCNc1ccc(c(c1)O)C#N 34a_100000094571_100011201679 [0,2,0,0,0,0|2,0,0]=4 10002 B14R1.909 COCCNc1ccc(c(c1)O)C#N 7a_100000094571_100000233755 [0,2,0,0,0,0|2,0,0]=4 10003 B14R1.909 COCCNc1ccc(c(c1)O)OC 34a_100000211920_100011201679 [0,2,0,0,0,0|1,0,0]=3 10004 B14R1.909 COCCOc1ccc(c(c1)Br)CO 34a_100010146404_100011201679 [0,2,0,0,0,0|2,0,0]=4 10005 B14R1.909 COCCOc1ccc(c(c1)Br)CO 7a_100010146404_100000233755 [0,2,0,0,0,0|2,0,0]=4 10006 B14R1.909 COCCOc1ccc(c(c1)Br)OC 34a_100010234764_100011201679 [0,2,0,0,0,0|2,0,0]=4 10007 B14R1.909 COCCOc1ccc(c(c1)Br)OC 7a_100010234764_100000233755 [0,2,0,0,0,0|2,0,0]=4 10008 B14R1.909 COCCOc1ccc(c(c1)C)OC 34a_100000759738_100011201679 [0,2,0,0,0,0|2,0,0]=4 10009 B14R1.909 COCCOc1ccc(c(c1)C)OC 7a_100000759738_100000233755 [0,2,0,0,0,0|2,0,0]=4 10010 B14R1.909 COCCOc1ccc(c(c1)Cl)CO 34a_200000075811_100011201679 [0,2,0,0,0,0|2,0,0]=4 10011 B14R1.909 COCCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000233755 [0,2,0,0,0,0|2,0,0]=4 10012 B14R1.909 COCCOc1ccc(c(c1)Cl)OC 34a_200009861682_100011201679 [0,2,0,0,0,0|2,0,0]=4 10013 B14R1.909 COCCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000233755 [0,2,0,0,0,0|2,0,0]=4 10014 B14R1.909 COCCOc1ccc(c(c1)F)CO 34a_100000084598_100011201679 [0,2,0,0,0,0|2,0,0]=4 10015 B14R1.909 COCCOc1ccc(c(c1)F)CO 7a_100000084598_100000233755 [0,2,0,0,0,0|2,0,0]=4 10016 B14R1.909 COCCOc1ccc(c(c1)F)OC 34a_100000746305_100011201679 [0,2,0,0,0,0|2,0,0]=4 10017 B14R1.909 COCCOc1ccc(c(c1)F)OC 7a_100000746305_100000233755 [0,2,0,0,0,0|2,0,0]=4 10018 B14R1.909 COCCOc1ccc(c(c1)I)OC 34a_100010084122_100011201679 [0,2,0,0,0,0|2,0,0]=4 10019 B14R1.909 COCCOc1ccc(c(c1)I)OC 7a_100010084122_100000233755 [0,2,0,0,0,0|2,0,0]=4 10020 B14R1.909 COCCSc1cc(c(cn1)OC)O 62a_100000233755_100010264082 [0,2,0,0,0,0|2,0,0]=4 10021 B14R1.909 COCCSc1ccc(c(c1)Br)CO 62a_100000233755_100010240206 [0,2,0,0,0,0|2,0,0]=4 10022 B14R1.909 COCCSc1ccc(c(c1)Br)CO 62a_100010240206_100000233755 [0,2,0,0,0,0|2,0,0]=4 10023 B14R1.909 COCCSc1ccc(c(c1)Br)OC 62a_100000233755_100011249507 [0,2,0,0,0,0|2,0,0]=4 10024 B14R1.909 COCCSc1ccc(c(c1)Br)OC 62a_100011249507_100000233755 [0,2,0,0,0,0|2,0,0]=4 10025 B14R1.909 COCCSc1ccc(c(c1)C)CO 62a_100000233755_100000748258 [0,2,0,0,0,0|2,0,0]=4 10026 B14R1.909 COCCSc1ccc(c(c1)C)CO 62a_100000748258_100000233755 [0,2,0,0,0,0|2,0,0]=4 10027 B14R1.909 COCCSc1ccc(c(c1)C)OC 62a_100000233755_100011219705 [0,2,0,0,0,0|2,0,0]=4 10028 B14R1.909 COCCSc1ccc(c(c1)C)OC 62a_100011219705_100000233755 [0,2,0,0,0,0|2,0,0]=4 10029 B14R1.909 COCCSc1ccc(c(c1)Cl)OC 62a_100000233755_100012355395 [0,2,0,0,0,0|2,0,0]=4 10030 B14R1.909 COCCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000233755 [0,2,0,0,0,0|2,0,0]=4 10031 B14R1.909 COCCSc1ccc(c(c1)F)CO 62a_100000233755_100011191541 [0,2,0,0,0,0|2,0,0]=4 10032 B14R1.909 COCCSc1ccc(c(c1)F)CO 62a_100011191541_100000233755 [0,2,0,0,0,0|2,0,0]=4 10033 B14R1.909 COCCSc1ccc(c(c1)F)OC 62a_100000171752_100000233755 [0,2,0,0,0,0|2,0,0]=4 10034 B14R1.909 COCCSc1ccc(c(c1)F)OC 62a_100000233755_100000171752 [0,2,0,0,0,0|2,0,0]=4 10035 B14R1.909 COCCSc1ccc(c(c1)N)CO 62a_100000233755_100000718831 [0,2,0,0,0,0|2,0,0]=4 10036 B14R1.909 COCCSc1ccc(c(c1)N)CO 62a_100000718831_100000233755 [0,2,0,0,0,0|2,0,0]=4 10037 B14R1.909 COCCSc1ccc(c(c1)N)OC 62a_100000233755_100011249504 [0,2,0,0,0,0|2,0,0]=4 10038 B14R1.909 COCCSc1ccc(c(c1)N)OC 62a_100011249504_100000233755 [0,2,0,0,0,0|2,0,0]=4 10039 B14R1.909 COCCSc1ccc(c(c1)O)C#N 62a_100000233755_100011934713 [0,2,0,0,0,0|2,0,0]=4 10040 B14R1.909 COCCSc1ccc(c(c1)O)C=O 62a_100000233755_100011277552 [0,2,0,0,0,0|1,0,1]=4 10041 B14R1.909 COCCSc1ccc(c(c1)O)C=O 62a_100011277552_100000233755 [0,2,0,0,0,0|1,0,1]=4 10042 B14R1.909 COCCSc1ccc(c(c1)O)CO 62a_100000071718_100000233755 [0,2,0,0,0,0|1,0,0]=3 10043 B14R1.909 COCCSc1ccc(c(c1)O)CO 62a_100000233755_100000071718 [0,2,0,0,0,0|1,0,0]=3 10044 B14R1.909 COCCSc1ccc(c(c1)O)OC 62a_100000233755_100009816560 [0,2,0,0,0,0|1,0,0]=3 10045 B14R1.909 COCCSc1cnc(c(c1)O)OC 62a_100000233755_100010135713 [0,2,0,0,0,0|2,0,0]=4 10046 B14R1.909 COCNCc1ccc(c(c1)C)OC 2230a_100102679029_100000766300 [0,2,0,0,0,0|2,0,0]=4 10047 B14R1.909 COCNCc1ccc(c(c1)Cl)OC 2230a_100000008799_100000766300 [0,2,0,0,0,0|2,0,0]=4 10048 B14R1.909 COCNCc1ccc(c(c1)F)OC 2230a_100000737316_100000766300 [0,2,0,0,0,0|2,0,0]=4 10049 B14R1.909 COCSCc1ccc(c(c1)Br)OC 62a_100000766300_200011397701 [0,2,0,0,0,0|2,0,0]=4 10050 B14R1.909 COCSCc1ccc(c(c1)Br)OC 62a_200011397701_100000766300 [0,2,0,0,0,0|2,0,0]=4 10051 B14R1.909 COCSCc1ccc(c(c1)C)OC 62a_100000766300_200011290836 [0,2,0,0,0,0|2,0,0]=4 10052 B14R1.909 COCSCc1ccc(c(c1)C)OC 62a_200011290836_100000766300 [0,2,0,0,0,0|2,0,0]=4 10053 B14R1.909 COCSCc1ccc(c(c1)Cl)OC 62a_100000693707_100000766300 [0,2,0,0,0,0|2,0,0]=4 10054 B14R1.909 COCSCc1ccc(c(c1)Cl)OC 62a_100000766300_100000693707 [0,2,0,0,0,0|2,0,0]=4 10055 B14R1.909 COCSCc1ccc(c(c1)F)OC 62a_100000189595_100000766300 [0,2,0,0,0,0|2,0,0]=4 10056 B14R1.909 COCSCc1ccc(c(c1)F)OC 62a_100000766300_100000189595 [0,2,0,0,0,0|2,0,0]=4 10057 B14R1.909 COc1ccc(cc1Br)CCNCF 34a_103549771065_100015361967 [0,2,0,0,0,0|1,0,0]=3 10058 B14R1.909 COc1ccc(cc1Br)CCOCF 34a_100011962876_100015361967 [0,2,0,0,0,0|2,0,0]=4 10059 B14R1.909 COc1ccc(cc1Br)CCOCF 7a_100011962876_100015361967 [0,2,0,0,0,0|2,0,0]=4 10060 B14R1.909 COc1ccc(cc1Br)CNCSC 34a_100159240714_100011218213 [0,2,0,0,0,0|2,0,0]=4 10061 B14R1.909 COc1ccc(cc1Br)COCSC 34a_100000246451_100011218213 [0,2,0,0,0,0|2,0,0]=4 10062 B14R1.909 COc1ccc(cc1Br)CSCSC 62a_100011218213_200011397701 [0,2,0,0,0,0|2,0,0]=4 10063 B14R1.909 COc1ccc(cc1Br)CSCSC 62a_200011397701_100011218213 [0,2,0,0,0,0|2,0,0]=4 10064 B14R1.909 COc1ccc(cc1Br)NCCSC 34a_100000187427_100000212216 [0,2,0,0,0,0|2,0,0]=4 10065 B14R1.909 COc1ccc(cc1Br)OCCSC 34a_100010234764_100000212216 [0,2,0,0,0,0|2,0,0]=4 10066 B14R1.909 COc1ccc(cc1Br)OCCSC 7a_100010234764_100000212216 [0,2,0,0,0,0|2,0,0]=4 10067 B14R1.909 COc1ccc(cc1Br)SCCSC 62a_100000212216_100011249507 [0,2,0,0,0,0|2,0,0]=4 10068 B14R1.909 COc1ccc(cc1Br)SCCSC 62a_100011249507_100000751147 [0,2,0,0,0,0|2,0,0]=4 10069 B14R1.909 COc1ccc(cc1C)CNCSC 2230a_100102679029_100011218213 [0,2,0,0,0,0|2,0,0]=4 10070 B14R1.909 COc1ccc(cc1C)CNCSC 34a_100102679029_100011218213 [0,2,0,0,0,0|2,0,0]=4 10071 B14R1.909 COc1ccc(cc1C)COCSC 34a_200011290855_100011218213 [0,2,0,0,0,0|2,0,0]=4 10072 B14R1.909 COc1ccc(cc1C)CSCSC 62a_100011218213_200011290836 [0,2,0,0,0,0|2,0,0]=4 10073 B14R1.909 COc1ccc(cc1C)CSCSC 62a_200011290836_100011218213 [0,2,0,0,0,0|2,0,0]=4 10074 B14R1.909 COc1ccc(cc1C)NCCSC 2230a_100000743268_100000751147 [0,2,0,0,0,0|2,0,0]=4 10075 B14R1.909 COc1ccc(cc1C)NCCSC 34a_100000743268_100000212216 [0,2,0,0,0,0|2,0,0]=4 10076 B14R1.909 COc1ccc(cc1C)NCCSC 7a_100000743268_100000212216 [0,2,0,0,0,0|2,0,0]=4 10077 B14R1.909 COc1ccc(cc1C)OCCSC 34a_100000759738_100000212216 [0,2,0,0,0,0|2,0,0]=4 10078 B14R1.909 COc1ccc(cc1C)OCCSC 7a_100000759738_100000212216 [0,2,0,0,0,0|2,0,0]=4 10079 B14R1.909 COc1ccc(cc1C)SCCSC 62a_100000212216_100011219705 [0,2,0,0,0,0|2,0,0]=4 10080 B14R1.909 COc1ccc(cc1C)SCCSC 62a_100011219705_100000751147 [0,2,0,0,0,0|2,0,0]=4 10081 B14R1.909 COc1ccc(cc1Cl)CCNCF 34a_100025770840_100015361967 [0,2,0,0,0,0|1,0,0]=3 10082 B14R1.909 COc1ccc(cc1Cl)CNCSC 2230a_100000008799_100011218213 [0,2,0,0,0,0|2,0,0]=4 10083 B14R1.909 COc1ccc(cc1Cl)CNCSC 34a_100000008799_100011218213 [0,2,0,0,0,0|2,0,0]=4 10084 B14R1.909 COc1ccc(cc1Cl)COCSC 34a_100000694469_100011218213 [0,2,0,0,0,0|2,0,0]=4 10085 B14R1.909 COc1ccc(cc1Cl)CSCSC 62a_100000693707_100011218213 [0,2,0,0,0,0|2,0,0]=4 10086 B14R1.909 COc1ccc(cc1Cl)CSCSC 62a_100011218213_100000693707 [0,2,0,0,0,0|2,0,0]=4 10087 B14R1.909 COc1ccc(cc1Cl)NCCSC 2230a_100000211044_100000751147 [0,2,0,0,0,0|2,0,0]=4 10088 B14R1.909 COc1ccc(cc1Cl)NCCSC 34a_100000211044_100000212216 [0,2,0,0,0,0|2,0,0]=4 10089 B14R1.909 COc1ccc(cc1Cl)OCCSC 34a_200009861682_100000212216 [0,2,0,0,0,0|2,0,0]=4 10090 B14R1.909 COc1ccc(cc1Cl)OCCSC 7a_200009861682_100000212216 [0,2,0,0,0,0|2,0,0]=4 10091 B14R1.909 COc1ccc(cc1Cl)SCCSC 62a_100000212216_100012355395 [0,2,0,0,0,0|2,0,0]=4 10092 B14R1.909 COc1ccc(cc1Cl)SCCSC 62a_100012355395_100000751147 [0,2,0,0,0,0|2,0,0]=4 10093 B14R1.909 COc1ccc(cc1F)CCOCF 34a_100011755164_100015361967 [0,2,0,0,0,0|2,0,0]=4 10094 B14R1.909 COc1ccc(cc1F)CCOCF 7a_100011755164_100015361967 [0,2,0,0,0,0|2,0,0]=4 10095 B14R1.909 COc1ccc(cc1F)CNCSC 2230a_100000737316_100011218213 [0,2,0,0,0,0|2,0,0]=4 10096 B14R1.909 COc1ccc(cc1F)CNCSC 34a_100000737316_100011218213 [0,2,0,0,0,0|2,0,0]=4 10097 B14R1.909 COc1ccc(cc1F)COCSC 34a_100000246395_100011218213 [0,2,0,0,0,0|2,0,0]=4 10098 B14R1.909 COc1ccc(cc1F)CSCSC 62a_100000189595_100011218213 [0,2,0,0,0,0|2,0,0]=4 10099 B14R1.909 COc1ccc(cc1F)CSCSC 62a_100011218213_100000189595 [0,2,0,0,0,0|2,0,0]=4 10100 B14R1.909 COc1ccc(cc1F)NCCSC 2230a_100000740183_100000751147 [0,2,0,0,0,0|2,0,0]=4 10101 B14R1.909 COc1ccc(cc1F)NCCSC 34a_100000740183_100000212216 [0,2,0,0,0,0|2,0,0]=4 10102 B14R1.909 COc1ccc(cc1F)OCCSC 34a_100000746305_100000212216 [0,2,0,0,0,0|2,0,0]=4 10103 B14R1.909 COc1ccc(cc1F)OCCSC 7a_100000746305_100000212216 [0,2,0,0,0,0|2,0,0]=4 10104 B14R1.909 COc1ccc(cc1F)SCCSC 62a_100000171752_100000751147 [0,2,0,0,0,0|2,0,0]=4 10105 B14R1.909 COc1ccc(cc1F)SCCSC 62a_100000212216_100000171752 [0,2,0,0,0,0|2,0,0]=4 10106 B14R1.909 COc1ccc(cc1I)COCSC 34a_200000013966_100011218213 [0,2,0,0,0,0|2,0,0]=4 10107 B14R1.909 COc1ccc(cc1I)NCCSC 34a_100011356947_100000212216 [0,2,0,0,0,0|2,0,0]=4 10108 B14R1.909 COc1ccc(cc1I)OCCSC 34a_100010084122_100000212216 [0,2,0,0,0,0|2,0,0]=4 10109 B14R1.909 COc1ccc(cc1I)OCCSC 7a_100010084122_100000212216 [0,2,0,0,0,0|2,0,0]=4 10110 B14R1.909 COc1ccc(cc1N)COCSC 34a_100011269841_100011218213 [0,2,0,0,0,0|2,0,0]=4 10111 B14R1.909 COc1ccc(cc1N)SCCSC 62a_100000212216_100011249504 [0,2,0,0,0,0|2,0,0]=4 10112 B14R1.909 COc1ccc(cc1N)SCCSC 62a_100011249504_100000751147 [0,2,0,0,0,0|2,0,0]=4 10113 B14R1.909 COc1ccc(cc1O)CCNCF 34a_100011207234_100015361967 [0,2,0,0,0,0|0,0,0]=2 10114 B14R1.909 COc1ccc(cc1O)CNCC=O 34a_100000740000_200009817547 [0,2,0,0,0,0|2,0,0]=4 10115 B14R1.909 COc1ccc(cc1O)CNCCF 34a_100000740000_100011217306 [0,2,0,0,0,0|2,0,0]=4 10116 B14R1.909 COc1ccc(cc1O)CNCCO 34a_100000740000_100000211926 [0,2,0,0,0,0|2,0,0]=4 10117 B14R1.909 COc1ccc(cc1O)CNCSC 34a_100000740000_100011218213 [0,2,0,0,0,0|1,0,0]=3 10118 B14R1.909 COc1ccc(cc1O)NCCCF 34a_100000211920_100011934791 [0,2,0,0,0,0|2,0,0]=4 10119 B14R1.909 COc1ccc(cc1O)NCCCO 34a_100000211920_100000230001 [0,2,0,0,0,0|2,0,0]=4 10120 B14R1.909 COc1ccc(cc1O)NCCSC 34a_100000211920_100000212216 [0,2,0,0,0,0|1,0,0]=3 10121 B14R1.909 COc1ccc(cc1O)SCCC#N 62a_100011215226_100009816560 [0,2,0,0,0,0|2,0,0]=4 10122 B14R1.909 COc1ccc(cc1O)SCCCF 62a_100011934791_100009816560 [0,2,0,0,0,0|2,0,0]=4 10123 B14R1.909 COc1ccc(cc1O)SCCCO 62a_100011215043_100009816560 [0,2,0,0,0,0|2,0,0]=4 10124 B14R1.909 COc1ccc(cc1O)SCCSC 62a_100000212216_100009816560 [0,2,0,0,0,0|1,0,0]=3 10125 B14R1.909 COc1cnc(cc1O)SCCSC 62a_100000212216_100010264082 [0,2,0,0,0,0|2,0,0]=4 10126 B14R1.909 COc1ncc(cc1O)SCCSC 62a_100000212216_100010135713 [0,2,0,0,0,0|2,0,0]=4 10127 B14R1.909 CSCCNc1ccc(c(c1)C)CO 34a_100000102464_100000212216 [0,2,0,0,0,0|2,0,0]=4 10128 B14R1.909 CSCCNc1ccc(c(c1)Cl)CO 34a_100000689119_100000212216 [0,2,0,0,0,0|2,0,0]=4 10129 B14R1.909 CSCCNc1ccc(c(c1)O)C#N 34a_100000094571_100000212216 [0,2,0,0,0,0|2,0,0]=4 10130 B14R1.909 CSCCNc1ccc(c(c1)O)C#N 7a_100000094571_100000212216 [0,2,0,0,0,0|2,0,0]=4 10131 B14R1.909 CSCCOc1ccc(c(c1)Br)CO 34a_100010146404_100000212216 [0,2,0,0,0,0|2,0,0]=4 10132 B14R1.909 CSCCOc1ccc(c(c1)Br)CO 7a_100010146404_100000212216 [0,2,0,0,0,0|2,0,0]=4 10133 B14R1.909 CSCCOc1ccc(c(c1)Cl)CO 34a_200000075811_100000212216 [0,2,0,0,0,0|2,0,0]=4 10134 B14R1.909 CSCCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000212216 [0,2,0,0,0,0|2,0,0]=4 10135 B14R1.909 CSCCOc1ccc(c(c1)F)CO 34a_100000084598_100000212216 [0,2,0,0,0,0|2,0,0]=4 10136 B14R1.909 CSCCOc1ccc(c(c1)F)CO 7a_100000084598_100000212216 [0,2,0,0,0,0|2,0,0]=4 10137 B14R1.909 CSCCSc1ccc(c(c1)Br)CO 62a_100000212216_100010240206 [0,2,0,0,0,0|2,0,0]=4 10138 B14R1.909 CSCCSc1ccc(c(c1)Br)CO 62a_100010240206_100000751147 [0,2,0,0,0,0|2,0,0]=4 10139 B14R1.909 CSCCSc1ccc(c(c1)C)CO 62a_100000212216_100000748258 [0,2,0,0,0,0|2,0,0]=4 10140 B14R1.909 CSCCSc1ccc(c(c1)C)CO 62a_100000748258_100000751147 [0,2,0,0,0,0|2,0,0]=4 10141 B14R1.909 CSCCSc1ccc(c(c1)F)CO 62a_100000212216_100011191541 [0,2,0,0,0,0|2,0,0]=4 10142 B14R1.909 CSCCSc1ccc(c(c1)F)CO 62a_100011191541_100000751147 [0,2,0,0,0,0|2,0,0]=4 10143 B14R1.909 CSCCSc1ccc(c(c1)N)CO 62a_100000212216_100000718831 [0,2,0,0,0,0|2,0,0]=4 10144 B14R1.909 CSCCSc1ccc(c(c1)N)CO 62a_100000718831_100000751147 [0,2,0,0,0,0|2,0,0]=4 10145 B14R1.909 CSCCSc1ccc(c(c1)O)C#N 62a_100000212216_100011934713 [0,2,0,0,0,0|2,0,0]=4 10146 B14R1.909 CSCCSc1ccc(c(c1)O)C=O 62a_100000212216_100011277552 [0,2,0,0,0,0|1,0,1]=4 10147 B14R1.909 CSCCSc1ccc(c(c1)O)C=O 62a_100011277552_100000751147 [0,2,0,0,0,0|1,0,1]=4 10148 B14R1.909 CSCCSc1ccc(c(c1)O)CO 62a_100000071718_100000751147 [0,2,0,0,0,0|1,0,0]=3 10149 B14R1.909 CSCCSc1ccc(c(c1)O)CO 62a_100000212216_100000071718 [0,2,0,0,0,0|1,0,0]=3 10150 B14R1.909 N#CCCSc1ccc(c(c1)O)CO 62a_100000071718_100011215226 [0,2,0,0,0,0|2,0,0]=4 10151 B14R1.909 N#CCCSc1ccc(c(c1)O)CO 62a_100011215226_100000071718 [0,2,0,0,0,0|2,0,0]=4 10152 B14R1.909 OCCCSc1ccc(c(c1)O)CO 62a_100000071718_100011215043 [0,2,0,0,0,0|2,0,0]=4 10153 B14R1.909 OCCCSc1ccc(c(c1)O)CO 62a_100011215043_100000071718 [0,2,0,0,0,0|2,0,0]=4 10154 B14R1.909 OCc1ccc(cc1O)SCCCF 62a_100000071718_100011934791 [0,2,0,0,0,0|2,0,0]=4 10155 B14R1.909 OCc1ccc(cc1O)SCCCF 62a_100011934791_100000071718 [0,2,0,0,0,0|2,0,0]=4 10156 B14R1.1361 CCCCc1ccc(c(c1C)C)OC 271570a_100020621405_100000049725 [0,2,0,0,0,0|2,0,0]=4 10157 B14R1.1361 CCCCc1ccc(c(c1F)F)CO 271570a_100020621405_100010712623 [0,2,0,0,0,0|2,0,0]=4 10158 B14R1.1361 CCCCc1ccc(c(c1F)F)OC 271570a_100020621405_100009816879 [0,2,0,0,0,0|2,0,0]=4 10159 B14R1.1361 CCCCc1ccc(c(c1F)O)C=O 271570a_100020621405_100010762540 [0,2,0,0,0,0|1,0,1]=4 10160 B14R1.3276 CCC(=O)Cc1ccc(c(c1)O)OC 1458a_100000049095_100000210202 [0,2,0,0,0,0|1,0,1]=4 10161 B14R1.3276 CCC(C)Nc1ccc(c(c1)O)OC 34a_100000211920_100011215416 [0,2,0,0,0,0|2,0,0]=4 10162 B14R1.3276 CCC(C)Sc1ccc(c(c1)O)CO 62a_100000071718_100000758301 [0,2,0,0,0,0|2,0,0]=4 10163 B14R1.3276 CCC(C)Sc1ccc(c(c1)O)CO 62a_100000758301_100000071718 [0,2,0,0,0,0|2,0,0]=4 10164 B14R1.3276 CCC(C)Sc1ccc(c(c1)O)OC 62a_100000758301_100009816560 [0,2,0,0,0,0|2,0,0]=4 10165 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 2230a_100000188468_100000210202 [0,2,0,0,0,0|2,0,0]=4 10166 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 269982a_100000188468_100000204670 [0,2,0,0,0,0|2,0,0]=4 10167 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 11a_106832991635_100011202338 [0,2,0,0,0,0|1,0,1]=4 10168 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 1626a_100102657272_100011202338 [0,2,0,0,0,0|1,0,1]=4 10169 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 240690a_100102657272_100011202338 [0,2,0,0,0,0|1,0,1]=4 10170 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Br)OC 527a_100102657272_100011202338 [0,2,0,0,0,0|1,0,1]=4 10171 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 11a_106832991635_100011356478 [0,2,0,0,0,0|1,0,1]=4 10172 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 1626a_100102657272_100011356478 [0,2,0,0,0,0|1,0,1]=4 10173 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 240690a_100102657272_100011356478 [0,2,0,0,0,0|1,0,1]=4 10174 B14R1.3276 CNC(=O)Cc1ccc(c(c1)C)OC 527a_100102657272_100011356478 [0,2,0,0,0,0|1,0,1]=4 10175 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 11a_106832991635_100012026953 [0,2,0,0,0,0|1,0,1]=4 10176 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 1626a_100102657272_100012026953 [0,2,0,0,0,0|1,0,1]=4 10177 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 240690a_100102657272_100012026953 [0,2,0,0,0,0|1,0,1]=4 10178 B14R1.3276 CNC(=O)Cc1ccc(c(c1)Cl)OC 527a_100102657272_100012026953 [0,2,0,0,0,0|1,0,1]=4 10179 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 11a_106832991635_100000204603 [0,2,0,0,0,0|1,0,1]=4 10180 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 1626a_100102657272_100000204603 [0,2,0,0,0,0|1,0,1]=4 10181 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 240690a_100102657272_100000204603 [0,2,0,0,0,0|1,0,1]=4 10182 B14R1.3276 CNC(=O)Cc1ccc(c(c1)F)OC 527a_100102657272_100000204603 [0,2,0,0,0,0|1,0,1]=4 10183 B14R1.3276 CNC(=O)Cc1ccc(c(c1)O)OC 240690a_100102657272_100000049095 [0,2,0,0,0,0|0,0,1]=3 10184 B14R1.3276 CNC(=O)Cc1ccc(c(c1)O)OC 527a_100102657272_100000049095 [0,2,0,0,0,0|0,0,1]=3 10185 B14R1.3276 CNC(=O)Nc1ccc(c(c1)O)OC 2430a_100000211920_100102657272 [0,2,0,0,0,0|1,0,1]=4 10186 B14R1.3276 CNC(C)Cc1ccc(c(c1)Br)OC 270004a_106832991635_100011493462 [0,2,0,0,0,0|1,0,0]=3 10187 B14R1.3276 CNC(C)Cc1ccc(c(c1)Cl)OC 270004a_106832991635_200000078656 [0,2,0,0,0,0|1,0,0]=3 10188 B14R1.3276 COC(=O)Cc1ccc(c(c1)O)OC 271570a_203496583355_200012357789 [0,2,0,0,0,0|1,0,1]=4 10189 B14R1.3276 COC(C)Sc1ccc(c(c1)O)CO 62a_100000071718_100009879195 [0,2,0,0,0,0|2,0,0]=4 10190 B14R1.3276 COC(C)Sc1ccc(c(c1)O)CO 62a_100009879195_100000071718 [0,2,0,0,0,0|2,0,0]=4 10191 B14R1.3276 COc1ccc(cc1O)SC(C)OC 62a_100009879195_100009816560 [0,2,0,0,0,0|2,0,0]=4 10192 B14R1.4436 CCCCc1cc(c(cc1C)C=O)O 271570a_100020621405_200010762526 [0,2,0,0,0,0|1,0,1]=4 10193 B14R1.4436 CCCCc1cc(c(cc1C)OC)C 271570a_100020621405_100000698960 [0,2,0,0,0,0|2,0,0]=4 10194 B14R1.4436 CCCCc1cc(c(cc1C)OC)F 271570a_100020621405_100010074640 [0,2,0,0,0,0|2,0,0]=4 10195 B14R1.4436 CCCCc1cc(c(cc1Cl)OC)N 271570a_100020621405_100011011177 [0,2,0,0,0,0|2,0,0]=4 10196 B14R1.4436 CCCCc1cc(c(cc1F)C#N)O 271570a_100020621405_200010827376 [0,2,0,0,0,0|2,0,0]=4 10197 B14R1.4436 CCCCc1cc(c(cc1F)C=O)O 271570a_100020621405_200010762562 [0,2,0,0,0,0|1,0,1]=4 10198 B14R1.4436 CCCCc1cc(c(cc1F)CO)F 271570a_100020621405_100012024398 [0,2,0,0,0,0|2,0,0]=4 10199 B14R1.4436 CCCCc1cc(c(cc1F)OC)F 271570a_100020621405_100009813720 [0,2,0,0,0,0|2,0,0]=4 10200 B14R1.4436 CCCCc1cc(c(cc1F)OC)N 271570a_100020621405_100012361397 [0,2,0,0,0,0|2,0,0]=4 10201 B14R1.4436 CCCCc1cc(c(cc1N)OC)C 271570a_100020621405_100010244135 [0,2,0,0,0,0|2,0,0]=4 10202 B14R1.4436 CCCCc1cc(c(cc1N)OC)F 271570a_100020621405_100010208193 [0,2,0,0,0,0|2,0,0]=4 10203 B14R1.4436 CCCCc1cc(c(cc1O)C=O)O 271570a_100020621405_100010888506 [0,2,0,0,0,0|1,0,1]=4 10204 B14R1.232 C#CCCCNc1ccc(c(c1)O)O 34a_100102946323_100000695029 [0,2,0,0,0,0|1,0,1]=4 10205 B14R1.232 C#CCCCSc1ccc(c(c1)O)O 62a_100011215417_100009813601 [0,2,0,0,0,0|1,0,1]=4 10206 B14R1.232 C#CCCNCc1ccc(c(c1)O)O 34a_100000010075_100000688953 [0,2,0,0,0,0|1,0,1]=4 10207 B14R1.232 C#CCNCCc1ccc(c(c1)C)C 2230a_100020591374_100000038162 [0,2,0,0,0,0|2,0,0]=4 10208 B14R1.232 C#CCNCCc1ccc(c(c1)C)C 34a_100020591374_100000184674 [0,2,0,0,0,0|2,0,0]=4 10209 B14R1.232 C#CCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000038162 [0,2,0,0,0,0|2,0,0]=4 10210 B14R1.232 C#CCNCCc1ccc(c(c1)Cl)Cl 34a_100000212058_100011713676 [0,2,0,0,0,0|2,0,0]=4 10211 B14R1.232 C#CCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100000184674 [0,2,0,0,0,0|2,0,0]=4 10212 B14R1.232 C#CCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000038162 [0,2,0,0,0,0|2,0,0]=4 10213 B14R1.232 C#CCNCCc1ccc(c(c1)Cl)F 34a_100000212058_100012361305 [0,2,0,0,0,0|2,0,0]=4 10214 B14R1.232 C#CCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100000184674 [0,2,0,0,0,0|2,0,0]=4 10215 B14R1.232 C#CCNCCc1ccc(c(c1)F)F 2230a_200000706328_100000038162 [0,2,0,0,0,0|2,0,0]=4 10216 B14R1.232 C#CCNCCc1ccc(c(c1)F)F 34a_100000212058_100000690553 [0,2,0,0,0,0|2,0,0]=4 10217 B14R1.232 C#CCNCCc1ccc(c(c1)F)F 34a_200000706328_100000184674 [0,2,0,0,0,0|2,0,0]=4 10218 B14R1.232 C#CCNCCc1ccc(c(c1)O)O 34a_100000210387_100000184674 [0,2,0,0,0,0|0,0,0]=2 10219 B14R1.232 C#CCSCCc1ccc(c(c1)O)O 62a_100000038162_200010393615 [0,2,0,0,0,0|1,0,0]=3 10220 B14R1.232 C/C=C/CNCc1ccc(c(c1)F)O 34a_100000758358_100102629194 [0,2,0,0,0,0|2,0,0]=4 10221 B14R1.232 C/C=C/CNCc1ccc(c(c1)O)Cl 34a_100020636435_100102629194 [0,2,0,0,0,0|2,0,0]=4 10222 B14R1.232 C/C=C/CNCc1ccc(c(c1)O)F 34a_100160469508_100102629194 [0,2,0,0,0,0|2,0,0]=4 10223 B14R1.232 C/C=C/CNCc1ccc(c(c1)O)O 34a_100000010075_100102629194 [0,2,0,0,0,0|1,0,0]=3 10224 B14R1.232 C=CCCCNc1ccc(c(c1)O)O 34a_100102946323_100000757094 [0,2,0,0,0,0|1,0,1]=4 10225 B14R1.232 C=CCCCSc1ccc(c(c1)O)O 62a_100011713584_100009813601 [0,2,0,0,0,0|1,0,1]=4 10226 B14R1.232 C=CCCNCc1ccc(c(c1)O)O 34a_100000010075_100000754431 [0,2,0,0,0,0|1,0,1]=4 10227 B14R1.232 C=CCNCCc1ccc(c(c1)C)C 2230a_100020591374_100000210623 [0,2,0,0,0,0|2,0,0]=4 10228 B14R1.232 C=CCNCCc1ccc(c(c1)C)C 34a_100020591374_100015514636 [0,2,0,0,0,0|2,0,0]=4 10229 B14R1.232 C=CCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000210623 [0,2,0,0,0,0|2,0,0]=4 10230 B14R1.232 C=CCNCCc1ccc(c(c1)Cl)Cl 2230a_100020586998_100011713676 [0,2,0,0,0,0|2,0,0]=4 10231 B14R1.232 C=CCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100015514636 [0,2,0,0,0,0|2,0,0]=4 10232 B14R1.232 C=CCNCCc1ccc(c(c1)Cl)F 2230a_100020586998_100012361305 [0,2,0,0,0,0|2,0,0]=4 10233 B14R1.232 C=CCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000210623 [0,2,0,0,0,0|2,0,0]=4 10234 B14R1.232 C=CCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100015514636 [0,2,0,0,0,0|2,0,0]=4 10235 B14R1.232 C=CCNCCc1ccc(c(c1)F)F 2230a_100020586998_100000690553 [0,2,0,0,0,0|2,0,0]=4 10236 B14R1.232 C=CCNCCc1ccc(c(c1)F)F 2230a_200000706328_100000210623 [0,2,0,0,0,0|2,0,0]=4 10237 B14R1.232 C=CCNCCc1ccc(c(c1)F)F 34a_200000706328_100015514636 [0,2,0,0,0,0|2,0,0]=4 10238 B14R1.232 C=CCNCCc1ccc(c(c1)O)O 34a_100000210387_100015514636 [0,2,0,0,0,0|0,0,0]=2 10239 B14R1.232 C=CCSCCc1ccc(c(c1)O)O 62a_100000210623_200010393615 [0,2,0,0,0,0|1,0,0]=3 10240 B14R1.232 C=COCCNc1ccc(c(c1)O)O 34a_100102946323_100000039644 [0,2,0,0,0,0|1,0,1]=4 10241 B14R1.232 C=COCCSc1ccc(c(c1)O)O 62a_100000039644_100009813601 [0,2,0,0,0,0|1,0,1]=4 10242 B14R1.232 CC#CCNCc1ccc(c(c1)F)O 34a_100000758358_100000748600 [0,2,0,0,0,0|2,0,0]=4 10243 B14R1.232 CC#CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000748600 [0,2,0,0,0,0|2,0,0]=4 10244 B14R1.232 CC#CCNCc1ccc(c(c1)O)F 34a_100160469508_100000748600 [0,2,0,0,0,0|2,0,0]=4 10245 B14R1.232 CC#CCNCc1ccc(c(c1)O)O 34a_100000010075_100000748600 [0,2,0,0,0,0|1,0,0]=3 10246 B14R1.232 CC/C=C\CNc1ccc(c(c1)O)O 34a_100102946323_100103147603 [0,2,0,0,0,0|1,0,1]=4 10247 B14R1.232 CC/C=C\CSc1ccc(c(c1)O)O 62a_100103147603_100009813601 [0,2,0,0,0,0|1,0,1]=4 10248 B14R1.232 CC=CCNCc1ccc(c(c1)F)O 34a_100000758358_100000070051 [0,2,0,0,0,0|2,0,0]=4 10249 B14R1.232 CC=CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000070051 [0,2,0,0,0,0|2,0,0]=4 10250 B14R1.232 CC=CCNCc1ccc(c(c1)O)F 34a_100160469508_100000070051 [0,2,0,0,0,0|2,0,0]=4 10251 B14R1.232 CC=CCNCc1ccc(c(c1)O)O 34a_100000010075_100000070051 [0,2,0,0,0,0|1,0,0]=3 10252 B14R1.232 CCC#CCNc1ccc(c(c1)O)O 34a_100102946323_100009813939 [0,2,0,0,0,0|1,0,1]=4 10253 B14R1.232 CCC#CCSc1ccc(c(c1)O)O 62a_100009813939_100009813601 [0,2,0,0,0,0|1,0,1]=4 10254 B14R1.232 CCCCC=Cc1ccc(c(c1)Br)O 271570a_100016275911_100012361655 [0,2,0,0,0,0|2,0,0]=4 10255 B14R1.232 CCCCC=Cc1ccc(c(c1)C)O 271570a_100016275911_100000186361 [0,2,0,0,0,0|2,0,0]=4 10256 B14R1.232 CCCCC=Cc1ccc(c(c1)Cl)O 271570a_100016275911_100012360047 [0,2,0,0,0,0|2,0,0]=4 10257 B14R1.232 CCCCC=Cc1ccc(c(c1)F)O 271570a_100016275911_100000185481 [0,2,0,0,0,0|2,0,0]=4 10258 B14R1.232 CCCCC=Cc1ccc(c(c1)N)O 271570a_100016275911_100000752626 [0,2,0,0,0,0|2,0,0]=4 10259 B14R1.232 CCCCC=Cc1ccc(c(c1)O)Br 271570a_100016275911_100012356990 [0,2,0,0,0,0|2,0,0]=4 10260 B14R1.232 CCCCC=Cc1ccc(c(c1)O)C 271570a_100016275911_100000766334 [0,2,0,0,0,0|2,0,0]=4 10261 B14R1.232 CCCCC=Cc1ccc(c(c1)O)Cl 271570a_100016275911_100011356854 [0,2,0,0,0,0|2,0,0]=4 10262 B14R1.232 CCCCC=Cc1ccc(c(c1)O)F 271570a_100016275911_100000686035 [0,2,0,0,0,0|2,0,0]=4 10263 B14R1.232 CCCCC=Cc1ccc(c(c1)O)N 271570a_100016275911_100000739049 [0,2,0,0,0,0|2,0,0]=4 10264 B14R1.232 CCCCC=Cc1ccc(c(c1)O)O 271570a_100016275911_100009813601 [0,2,0,0,0,0|1,0,0]=3 10265 B14R1.232 CCCCCNc1ccc(c(c1)Br)O 34a_100011534360_100000718602 [0,2,0,0,0,0|2,0,0]=4 10266 B14R1.232 CCCCCNc1ccc(c(c1)C)O 34a_100011218179_100000718602 [0,2,0,0,0,0|2,0,0]=4 10267 B14R1.232 CCCCCNc1ccc(c(c1)C)O 7a_100011218179_100000210326 [0,2,0,0,0,0|2,0,0]=4 10268 B14R1.232 CCCCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000718602 [0,2,0,0,0,0|2,0,0]=4 10269 B14R1.232 CCCCCNc1ccc(c(c1)F)O 34a_100011220035_100000718602 [0,2,0,0,0,0|2,0,0]=4 10270 B14R1.232 CCCCCNc1ccc(c(c1)F)O 7a_100011220035_100000210326 [0,2,0,0,0,0|2,0,0]=4 10271 B14R1.232 CCCCCNc1ccc(c(c1)O)C 34a_100000759471_100000718602 [0,2,0,0,0,0|2,0,0]=4 10272 B14R1.232 CCCCCNc1ccc(c(c1)O)C 7a_100000759471_100000210326 [0,2,0,0,0,0|2,0,0]=4 10273 B14R1.232 CCCCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000718602 [0,2,0,0,0,0|2,0,0]=4 10274 B14R1.232 CCCCCNc1ccc(c(c1)O)F 34a_100012017398_100000718602 [0,2,0,0,0,0|2,0,0]=4 10275 B14R1.232 CCCCCNc1ccc(c(c1)O)F 7a_100012017398_100000210326 [0,2,0,0,0,0|2,0,0]=4 10276 B14R1.232 CCCCCNc1ccc(c(c1)O)O 34a_100102946323_100000718602 [0,2,0,0,0,0|1,0,0]=3 10277 B14R1.232 CCCCCSc1ccc(c(c1)Br)O 62a_100000210326_100012361655 [0,2,0,0,0,0|2,0,0]=4 10278 B14R1.232 CCCCCSc1ccc(c(c1)Br)O 62a_100012361655_100000210326 [0,2,0,0,0,0|2,0,0]=4 10279 B14R1.232 CCCCCSc1ccc(c(c1)C)O 62a_100000210326_100000186361 [0,2,0,0,0,0|2,0,0]=4 10280 B14R1.232 CCCCCSc1ccc(c(c1)Cl)O 62a_100000210326_100012360047 [0,2,0,0,0,0|2,0,0]=4 10281 B14R1.232 CCCCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210326 [0,2,0,0,0,0|2,0,0]=4 10282 B14R1.232 CCCCCSc1ccc(c(c1)F)O 62a_100000185481_100000210326 [0,2,0,0,0,0|2,0,0]=4 10283 B14R1.232 CCCCCSc1ccc(c(c1)F)O 62a_100000210326_100000185481 [0,2,0,0,0,0|2,0,0]=4 10284 B14R1.232 CCCCCSc1ccc(c(c1)N)O 62a_100000210326_100000752626 [0,2,0,0,0,0|2,0,0]=4 10285 B14R1.232 CCCCCSc1ccc(c(c1)N)O 62a_100000752626_100000210326 [0,2,0,0,0,0|2,0,0]=4 10286 B14R1.232 CCCCCSc1ccc(c(c1)O)Br 62a_100000210326_100012356990 [0,2,0,0,0,0|2,0,0]=4 10287 B14R1.232 CCCCCSc1ccc(c(c1)O)Br 62a_100012356990_100000210326 [0,2,0,0,0,0|2,0,0]=4 10288 B14R1.232 CCCCCSc1ccc(c(c1)O)C 62a_100000210326_100000685420 [0,2,0,0,0,0|2,0,0]=4 10289 B14R1.232 CCCCCSc1ccc(c(c1)O)C 62a_100000685420_100000210326 [0,2,0,0,0,0|2,0,0]=4 10290 B14R1.232 CCCCCSc1ccc(c(c1)O)Cl 62a_100000210326_100011356854 [0,2,0,0,0,0|2,0,0]=4 10291 B14R1.232 CCCCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210326 [0,2,0,0,0,0|2,0,0]=4 10292 B14R1.232 CCCCCSc1ccc(c(c1)O)F 62a_100000210326_100000686035 [0,2,0,0,0,0|2,0,0]=4 10293 B14R1.232 CCCCCSc1ccc(c(c1)O)F 62a_100000686035_100000210326 [0,2,0,0,0,0|2,0,0]=4 10294 B14R1.232 CCCCCSc1ccc(c(c1)O)N 62a_100000210326_100000739049 [0,2,0,0,0,0|2,0,0]=4 10295 B14R1.232 CCCCCSc1ccc(c(c1)O)N 62a_100000739049_100000210326 [0,2,0,0,0,0|2,0,0]=4 10296 B14R1.232 CCCCCSc1ccc(c(c1)O)O 62a_100000210326_100009813601 [0,2,0,0,0,0|1,0,0]=3 10297 B14R1.232 CCCCNCc1ccc(c(c1)F)O 34a_100000758358_100000210210 [0,2,0,0,0,0|2,0,0]=4 10298 B14R1.232 CCCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210210 [0,2,0,0,0,0|2,0,0]=4 10299 B14R1.232 CCCCNCc1ccc(c(c1)O)F 34a_100160469508_100000210210 [0,2,0,0,0,0|2,0,0]=4 10300 B14R1.232 CCCCNCc1ccc(c(c1)O)O 34a_100000010075_100000210210 [0,2,0,0,0,0|1,0,0]=3 10301 B14R1.232 CCCNCCc1ccc(c(c1)C)C 2230a_100020591374_100000210303 [0,2,0,0,0,0|2,0,0]=4 10302 B14R1.232 CCCNCCc1ccc(c(c1)C)C 34a_100020591374_100000210303 [0,2,0,0,0,0|2,0,0]=4 10303 B14R1.232 CCCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000210303 [0,2,0,0,0,0|2,0,0]=4 10304 B14R1.232 CCCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100000210303 [0,2,0,0,0,0|2,0,0]=4 10305 B14R1.232 CCCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000210303 [0,2,0,0,0,0|2,0,0]=4 10306 B14R1.232 CCCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100000210303 [0,2,0,0,0,0|2,0,0]=4 10307 B14R1.232 CCCNCCc1ccc(c(c1)F)F 2230a_200000706328_100000210303 [0,2,0,0,0,0|2,0,0]=4 10308 B14R1.232 CCCNCCc1ccc(c(c1)F)F 34a_200000706328_100000210303 [0,2,0,0,0,0|2,0,0]=4 10309 B14R1.232 CCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000210303 [0,2,0,0,0,0|0,0,0]=2 10310 B14R1.232 CCCNN=Cc1ccc(c(c1)O)O 4a_100000740057_100000184535 [0,2,0,0,0,0|1,0,1]=4 10311 B14R1.232 CCCSCCc1ccc(c(c1)O)O 62a_100000210303_200010393615 [0,2,0,0,0,0|1,0,0]=3 10312 B14R1.232 CCNCCOc1ccc(c(c1)C)C 2230a_100015185357_100000210202 [0,2,0,0,0,0|2,0,0]=4 10313 B14R1.232 CCNCCOc1ccc(c(c1)C)C 2230a_100015525214_200011210794 [0,2,0,0,0,0|2,0,0]=4 10314 B14R1.232 CCNCCOc1ccc(c(c1)C)C 34a_100015185357_100000210202 [0,2,0,0,0,0|2,0,0]=4 10315 B14R1.232 CCNCCOc1ccc(c(c1)C)Cl 2230a_100025718798_100000210202 [0,2,0,0,0,0|2,0,0]=4 10316 B14R1.232 CCNCCOc1ccc(c(c1)C)Cl 34a_100025718798_100000210202 [0,2,0,0,0,0|2,0,0]=4 10317 B14R1.232 CCNCCOc1ccc(c(c1)Cl)Cl 2230a_100015199673_100000210202 [0,2,0,0,0,0|2,0,0]=4 10318 B14R1.232 CCNCCOc1ccc(c(c1)Cl)Cl 34a_100015199673_100000210202 [0,2,0,0,0,0|2,0,0]=4 10319 B14R1.232 CCNCCOc1ccc(c(c1)Cl)F 2230a_100015525214_100011936913 [0,2,0,0,0,0|2,0,0]=4 10320 B14R1.232 CCOCCNc1ccc(c(c1)Br)O 34a_100011534360_100000210147 [0,2,0,0,0,0|2,0,0]=4 10321 B14R1.232 CCOCCNc1ccc(c(c1)C)O 34a_100011218179_100000210147 [0,2,0,0,0,0|2,0,0]=4 10322 B14R1.232 CCOCCNc1ccc(c(c1)C)O 7a_100011218179_100011215890 [0,2,0,0,0,0|2,0,0]=4 10323 B14R1.232 CCOCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210147 [0,2,0,0,0,0|2,0,0]=4 10324 B14R1.232 CCOCCNc1ccc(c(c1)F)O 34a_100011220035_100000210147 [0,2,0,0,0,0|2,0,0]=4 10325 B14R1.232 CCOCCNc1ccc(c(c1)F)O 7a_100011220035_100011215890 [0,2,0,0,0,0|2,0,0]=4 10326 B14R1.232 CCOCCNc1ccc(c(c1)O)C 34a_100000759471_100000210147 [0,2,0,0,0,0|2,0,0]=4 10327 B14R1.232 CCOCCNc1ccc(c(c1)O)C 7a_100000759471_100011215890 [0,2,0,0,0,0|2,0,0]=4 10328 B14R1.232 CCOCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210147 [0,2,0,0,0,0|2,0,0]=4 10329 B14R1.232 CCOCCNc1ccc(c(c1)O)F 34a_100012017398_100000210147 [0,2,0,0,0,0|2,0,0]=4 10330 B14R1.232 CCOCCNc1ccc(c(c1)O)F 7a_100012017398_100011215890 [0,2,0,0,0,0|2,0,0]=4 10331 B14R1.232 CCOCCNc1ccc(c(c1)O)O 34a_100102946323_100000210147 [0,2,0,0,0,0|1,0,0]=3 10332 B14R1.232 CCOCCSc1ccc(c(c1)Br)O 62a_100000210147_100012361655 [0,2,0,0,0,0|2,0,0]=4 10333 B14R1.232 CCOCCSc1ccc(c(c1)Br)O 62a_100012361655_100011215890 [0,2,0,0,0,0|2,0,0]=4 10334 B14R1.232 CCOCCSc1ccc(c(c1)C)O 62a_100000210147_100000186361 [0,2,0,0,0,0|2,0,0]=4 10335 B14R1.232 CCOCCSc1ccc(c(c1)Cl)O 62a_100000210147_100012360047 [0,2,0,0,0,0|2,0,0]=4 10336 B14R1.232 CCOCCSc1ccc(c(c1)Cl)O 62a_100012360047_100011215890 [0,2,0,0,0,0|2,0,0]=4 10337 B14R1.232 CCOCCSc1ccc(c(c1)F)O 62a_100000185481_100011215890 [0,2,0,0,0,0|2,0,0]=4 10338 B14R1.232 CCOCCSc1ccc(c(c1)F)O 62a_100000210147_100000185481 [0,2,0,0,0,0|2,0,0]=4 10339 B14R1.232 CCOCCSc1ccc(c(c1)N)O 62a_100000210147_100000752626 [0,2,0,0,0,0|2,0,0]=4 10340 B14R1.232 CCOCCSc1ccc(c(c1)N)O 62a_100000752626_100011215890 [0,2,0,0,0,0|2,0,0]=4 10341 B14R1.232 CCOCCSc1ccc(c(c1)O)Br 62a_100000210147_100012356990 [0,2,0,0,0,0|2,0,0]=4 10342 B14R1.232 CCOCCSc1ccc(c(c1)O)Br 62a_100012356990_100011215890 [0,2,0,0,0,0|2,0,0]=4 10343 B14R1.232 CCOCCSc1ccc(c(c1)O)C 62a_100000210147_100000685420 [0,2,0,0,0,0|2,0,0]=4 10344 B14R1.232 CCOCCSc1ccc(c(c1)O)C 62a_100000685420_100011215890 [0,2,0,0,0,0|2,0,0]=4 10345 B14R1.232 CCOCCSc1ccc(c(c1)O)Cl 62a_100000210147_100011356854 [0,2,0,0,0,0|2,0,0]=4 10346 B14R1.232 CCOCCSc1ccc(c(c1)O)Cl 62a_100011356854_100011215890 [0,2,0,0,0,0|2,0,0]=4 10347 B14R1.232 CCOCCSc1ccc(c(c1)O)F 62a_100000210147_100000686035 [0,2,0,0,0,0|2,0,0]=4 10348 B14R1.232 CCOCCSc1ccc(c(c1)O)F 62a_100000686035_100011215890 [0,2,0,0,0,0|2,0,0]=4 10349 B14R1.232 CCOCCSc1ccc(c(c1)O)N 62a_100000210147_100000739049 [0,2,0,0,0,0|2,0,0]=4 10350 B14R1.232 CCOCCSc1ccc(c(c1)O)N 62a_100000739049_100011215890 [0,2,0,0,0,0|2,0,0]=4 10351 B14R1.232 CCOCCSc1ccc(c(c1)O)O 62a_100000210147_100009813601 [0,2,0,0,0,0|1,0,0]=3 10352 B14R1.232 CCSCCNc1ccc(c(c1)Br)O 34a_100011534360_100000757381 [0,2,0,0,0,0|2,0,0]=4 10353 B14R1.232 CCSCCNc1ccc(c(c1)C)O 34a_100011218179_100000757381 [0,2,0,0,0,0|2,0,0]=4 10354 B14R1.232 CCSCCNc1ccc(c(c1)C)O 7a_100011218179_100000757381 [0,2,0,0,0,0|2,0,0]=4 10355 B14R1.232 CCSCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000757381 [0,2,0,0,0,0|2,0,0]=4 10356 B14R1.232 CCSCCNc1ccc(c(c1)F)O 34a_100011220035_100000757381 [0,2,0,0,0,0|2,0,0]=4 10357 B14R1.232 CCSCCNc1ccc(c(c1)F)O 7a_100011220035_100000757381 [0,2,0,0,0,0|2,0,0]=4 10358 B14R1.232 CCSCCNc1ccc(c(c1)O)C 34a_100000759471_100000757381 [0,2,0,0,0,0|2,0,0]=4 10359 B14R1.232 CCSCCNc1ccc(c(c1)O)C 7a_100000759471_100000757381 [0,2,0,0,0,0|2,0,0]=4 10360 B14R1.232 CCSCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000757381 [0,2,0,0,0,0|2,0,0]=4 10361 B14R1.232 CCSCCNc1ccc(c(c1)O)F 34a_100012017398_100000757381 [0,2,0,0,0,0|2,0,0]=4 10362 B14R1.232 CCSCCNc1ccc(c(c1)O)F 7a_100012017398_100000757381 [0,2,0,0,0,0|2,0,0]=4 10363 B14R1.232 CCSCCNc1ccc(c(c1)O)O 34a_100102946323_100000757381 [0,2,0,0,0,0|1,0,0]=3 10364 B14R1.232 CCSCCSc1ccc(c(c1)Br)O 62a_100000757381_100012361655 [0,2,0,0,0,0|2,0,0]=4 10365 B14R1.232 CCSCCSc1ccc(c(c1)Br)O 62a_100012361655_100000757381 [0,2,0,0,0,0|2,0,0]=4 10366 B14R1.232 CCSCCSc1ccc(c(c1)C)O 62a_100000757381_100000186361 [0,2,0,0,0,0|2,0,0]=4 10367 B14R1.232 CCSCCSc1ccc(c(c1)Cl)O 62a_100000757381_100012360047 [0,2,0,0,0,0|2,0,0]=4 10368 B14R1.232 CCSCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000757381 [0,2,0,0,0,0|2,0,0]=4 10369 B14R1.232 CCSCCSc1ccc(c(c1)F)O 62a_100000185481_100000757381 [0,2,0,0,0,0|2,0,0]=4 10370 B14R1.232 CCSCCSc1ccc(c(c1)F)O 62a_100000757381_100000185481 [0,2,0,0,0,0|2,0,0]=4 10371 B14R1.232 CCSCCSc1ccc(c(c1)N)O 62a_100000752626_100000757381 [0,2,0,0,0,0|2,0,0]=4 10372 B14R1.232 CCSCCSc1ccc(c(c1)N)O 62a_100000757381_100000752626 [0,2,0,0,0,0|2,0,0]=4 10373 B14R1.232 CCSCCSc1ccc(c(c1)O)Br 62a_100000757381_100012356990 [0,2,0,0,0,0|2,0,0]=4 10374 B14R1.232 CCSCCSc1ccc(c(c1)O)Br 62a_100012356990_100000757381 [0,2,0,0,0,0|2,0,0]=4 10375 B14R1.232 CCSCCSc1ccc(c(c1)O)C 62a_100000685420_100000757381 [0,2,0,0,0,0|2,0,0]=4 10376 B14R1.232 CCSCCSc1ccc(c(c1)O)C 62a_100000757381_100000685420 [0,2,0,0,0,0|2,0,0]=4 10377 B14R1.232 CCSCCSc1ccc(c(c1)O)Cl 62a_100000757381_100011356854 [0,2,0,0,0,0|2,0,0]=4 10378 B14R1.232 CCSCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000757381 [0,2,0,0,0,0|2,0,0]=4 10379 B14R1.232 CCSCCSc1ccc(c(c1)O)F 62a_100000686035_100000757381 [0,2,0,0,0,0|2,0,0]=4 10380 B14R1.232 CCSCCSc1ccc(c(c1)O)F 62a_100000757381_100000686035 [0,2,0,0,0,0|2,0,0]=4 10381 B14R1.232 CCSCCSc1ccc(c(c1)O)N 62a_100000739049_100000757381 [0,2,0,0,0,0|2,0,0]=4 10382 B14R1.232 CCSCCSc1ccc(c(c1)O)N 62a_100000757381_100000739049 [0,2,0,0,0,0|2,0,0]=4 10383 B14R1.232 CCSCCSc1ccc(c(c1)O)O 62a_100000757381_100009813601 [0,2,0,0,0,0|1,0,0]=3 10384 B14R1.232 CNCCCOc1ccc(c(c1)C)C 2230a_106832991635_100000737685 [0,2,0,0,0,0|2,0,0]=4 10385 B14R1.232 CNCCCOc1ccc(c(c1)C)C 34a_100102657272_100000737685 [0,2,0,0,0,0|2,0,0]=4 10386 B14R1.232 CNCCCOc1ccc(c(c1)C)C 7a_106832991635_100000737685 [0,2,0,0,0,0|2,0,0]=4 10387 B14R1.232 COCCCNc1ccc(c(c1)Br)O 34a_100011534360_100000740836 [0,2,0,0,0,0|2,0,0]=4 10388 B14R1.232 COCCCNc1ccc(c(c1)C)O 34a_100011218179_100000740836 [0,2,0,0,0,0|2,0,0]=4 10389 B14R1.232 COCCCNc1ccc(c(c1)C)O 7a_100011218179_100000740836 [0,2,0,0,0,0|2,0,0]=4 10390 B14R1.232 COCCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000740836 [0,2,0,0,0,0|2,0,0]=4 10391 B14R1.232 COCCCNc1ccc(c(c1)F)O 34a_100011220035_100000740836 [0,2,0,0,0,0|2,0,0]=4 10392 B14R1.232 COCCCNc1ccc(c(c1)F)O 7a_100011220035_100000740836 [0,2,0,0,0,0|2,0,0]=4 10393 B14R1.232 COCCCNc1ccc(c(c1)O)C 34a_100000759471_100000740836 [0,2,0,0,0,0|2,0,0]=4 10394 B14R1.232 COCCCNc1ccc(c(c1)O)C 7a_100000759471_100000740836 [0,2,0,0,0,0|2,0,0]=4 10395 B14R1.232 COCCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000740836 [0,2,0,0,0,0|2,0,0]=4 10396 B14R1.232 COCCCNc1ccc(c(c1)O)F 34a_100012017398_100000740836 [0,2,0,0,0,0|2,0,0]=4 10397 B14R1.232 COCCCNc1ccc(c(c1)O)F 7a_100012017398_100000740836 [0,2,0,0,0,0|2,0,0]=4 10398 B14R1.232 COCCCNc1ccc(c(c1)O)O 34a_100102946323_100000740836 [0,2,0,0,0,0|1,0,0]=3 10399 B14R1.232 COCCCSc1ccc(c(c1)Br)O 62a_100000709357_100012361655 [0,2,0,0,0,0|2,0,0]=4 10400 B14R1.232 COCCCSc1ccc(c(c1)Br)O 62a_100012361655_100000709357 [0,2,0,0,0,0|2,0,0]=4 10401 B14R1.232 COCCCSc1ccc(c(c1)C)O 62a_100000709357_100000186361 [0,2,0,0,0,0|2,0,0]=4 10402 B14R1.232 COCCCSc1ccc(c(c1)Cl)O 62a_100000709357_100012360047 [0,2,0,0,0,0|2,0,0]=4 10403 B14R1.232 COCCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000709357 [0,2,0,0,0,0|2,0,0]=4 10404 B14R1.232 COCCCSc1ccc(c(c1)F)O 62a_100000185481_100000709357 [0,2,0,0,0,0|2,0,0]=4 10405 B14R1.232 COCCCSc1ccc(c(c1)F)O 62a_100000709357_100000185481 [0,2,0,0,0,0|2,0,0]=4 10406 B14R1.232 COCCCSc1ccc(c(c1)N)O 62a_100000709357_100000752626 [0,2,0,0,0,0|2,0,0]=4 10407 B14R1.232 COCCCSc1ccc(c(c1)N)O 62a_100000752626_100000709357 [0,2,0,0,0,0|2,0,0]=4 10408 B14R1.232 COCCCSc1ccc(c(c1)O)Br 62a_100000709357_100012356990 [0,2,0,0,0,0|2,0,0]=4 10409 B14R1.232 COCCCSc1ccc(c(c1)O)Br 62a_100012356990_100000709357 [0,2,0,0,0,0|2,0,0]=4 10410 B14R1.232 COCCCSc1ccc(c(c1)O)C 62a_100000685420_100000709357 [0,2,0,0,0,0|2,0,0]=4 10411 B14R1.232 COCCCSc1ccc(c(c1)O)C 62a_100000709357_100000685420 [0,2,0,0,0,0|2,0,0]=4 10412 B14R1.232 COCCCSc1ccc(c(c1)O)Cl 62a_100000709357_100011356854 [0,2,0,0,0,0|2,0,0]=4 10413 B14R1.232 COCCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000709357 [0,2,0,0,0,0|2,0,0]=4 10414 B14R1.232 COCCCSc1ccc(c(c1)O)F 62a_100000686035_100000709357 [0,2,0,0,0,0|2,0,0]=4 10415 B14R1.232 COCCCSc1ccc(c(c1)O)F 62a_100000709357_100000686035 [0,2,0,0,0,0|2,0,0]=4 10416 B14R1.232 COCCCSc1ccc(c(c1)O)N 62a_100000709357_100000739049 [0,2,0,0,0,0|2,0,0]=4 10417 B14R1.232 COCCCSc1ccc(c(c1)O)N 62a_100000739049_100000709357 [0,2,0,0,0,0|2,0,0]=4 10418 B14R1.232 COCCCSc1ccc(c(c1)O)O 62a_100000709357_100009813601 [0,2,0,0,0,0|1,0,0]=3 10419 B14R1.232 COCCNCc1ccc(c(c1)F)O 34a_100000758358_100011201679 [0,2,0,0,0,0|2,0,0]=4 10420 B14R1.232 COCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100011201679 [0,2,0,0,0,0|2,0,0]=4 10421 B14R1.232 COCCNCc1ccc(c(c1)O)F 34a_100160469508_100011201679 [0,2,0,0,0,0|2,0,0]=4 10422 B14R1.232 COCCNCc1ccc(c(c1)O)O 34a_100000010075_100011201679 [0,2,0,0,0,0|1,0,0]=3 10423 B14R1.232 COCNCCc1ccc(c(c1)C)C 2230a_100020591374_100000766300 [0,2,0,0,0,0|2,0,0]=4 10424 B14R1.232 COCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000766300 [0,2,0,0,0,0|2,0,0]=4 10425 B14R1.232 COCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000766300 [0,2,0,0,0,0|2,0,0]=4 10426 B14R1.232 COCNCCc1ccc(c(c1)F)F 2230a_200000706328_100000766300 [0,2,0,0,0,0|2,0,0]=4 10427 B14R1.232 COCSCCc1ccc(c(c1)O)O 62a_100000766300_200010393615 [0,2,0,0,0,0|1,0,0]=3 10428 B14R1.232 CSCCNCc1ccc(c(c1)F)O 34a_100000758358_100000212216 [0,2,0,0,0,0|2,0,0]=4 10429 B14R1.232 CSCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000212216 [0,2,0,0,0,0|2,0,0]=4 10430 B14R1.232 CSCCNCc1ccc(c(c1)O)F 34a_100160469508_100000212216 [0,2,0,0,0,0|2,0,0]=4 10431 B14R1.232 CSCCNCc1ccc(c(c1)O)O 34a_100000010075_100000212216 [0,2,0,0,0,0|1,0,0]=3 10432 B14R1.232 CSCNCCc1ccc(c(c1)C)C 2230a_100020591374_100011218213 [0,2,0,0,0,0|2,0,0]=4 10433 B14R1.232 CSCNCCc1ccc(c(c1)C)C 34a_100020591374_100011218213 [0,2,0,0,0,0|2,0,0]=4 10434 B14R1.232 CSCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100011218213 [0,2,0,0,0,0|2,0,0]=4 10435 B14R1.232 CSCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100011218213 [0,2,0,0,0,0|2,0,0]=4 10436 B14R1.232 CSCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100011218213 [0,2,0,0,0,0|2,0,0]=4 10437 B14R1.232 CSCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100011218213 [0,2,0,0,0,0|2,0,0]=4 10438 B14R1.232 CSCNCCc1ccc(c(c1)F)F 2230a_200000706328_100011218213 [0,2,0,0,0,0|2,0,0]=4 10439 B14R1.232 CSCNCCc1ccc(c(c1)F)F 34a_200000706328_100011218213 [0,2,0,0,0,0|2,0,0]=4 10440 B14R1.232 CSCNCCc1ccc(c(c1)O)O 34a_100000210387_100011218213 [0,2,0,0,0,0|0,0,0]=2 10441 B14R1.232 CSCSCCc1ccc(c(c1)O)O 62a_100011218213_200010393615 [0,2,0,0,0,0|1,0,0]=3 10442 B14R1.232 Cc1cc(ccc1Cl)OCCNCF 34a_100025718798_100015361967 [0,2,0,0,0,0|2,0,0]=4 10443 B14R1.232 Cc1cc(ccc1O)NCCCCF 34a_100011218179_100000729493 [0,2,0,0,0,0|2,0,0]=4 10444 B14R1.232 Cc1cc(ccc1O)NCCCCF 7a_100011218179_100000729493 [0,2,0,0,0,0|2,0,0]=4 10445 B14R1.232 Cc1cc(ccc1O)NCCCCO 34a_100011218179_100011216708 [0,2,0,0,0,0|2,0,0]=4 10446 B14R1.232 Cc1cc(ccc1O)NCCCCO 7a_100011218179_100000210776 [0,2,0,0,0,0|2,0,0]=4 10447 B14R1.232 Cc1cc(ccc1O)SCCCCF 62a_100000729493_100000186361 [0,2,0,0,0,0|2,0,0]=4 10448 B14R1.232 Cc1cc(ccc1O)SCCCCO 62a_100000210776_100000186361 [0,2,0,0,0,0|2,0,0]=4 10449 B14R1.232 Cc1ccc(cc1C)CCNCC#N 2230a_100020591374_100011215382 [0,2,0,0,0,0|2,0,0]=4 10450 B14R1.232 Cc1ccc(cc1C)CCNCC=O 2230a_100020591374_200015260668 [0,2,0,0,0,0|2,0,0]=4 10451 B14R1.232 Cc1ccc(cc1C)CCNCC=O 34a_100020591374_200009817547 [0,2,0,0,0,0|2,0,0]=4 10452 B14R1.232 Cc1ccc(cc1C)CCNCCF 2230a_100020591374_100011217306 [0,2,0,0,0,0|2,0,0]=4 10453 B14R1.232 Cc1ccc(cc1C)CCNCCF 34a_100020591374_100011217306 [0,2,0,0,0,0|2,0,0]=4 10454 B14R1.232 Cc1ccc(cc1C)CCNCCO 2230a_100020591374_100000211926 [0,2,0,0,0,0|2,0,0]=4 10455 B14R1.232 Cc1ccc(cc1C)CCNCCO 34a_100020591374_100000211926 [0,2,0,0,0,0|2,0,0]=4 10456 B14R1.232 Cc1ccc(cc1C)OCCNCF 34a_100015185357_100015361967 [0,2,0,0,0,0|2,0,0]=4 10457 B14R1.232 Cc1ccc(cc1O)NCCCCF 34a_100000759471_100000729493 [0,2,0,0,0,0|2,0,0]=4 10458 B14R1.232 Cc1ccc(cc1O)NCCCCF 7a_100000759471_100000729493 [0,2,0,0,0,0|2,0,0]=4 10459 B14R1.232 Cc1ccc(cc1O)NCCCCO 34a_100000759471_100011216708 [0,2,0,0,0,0|2,0,0]=4 10460 B14R1.232 Cc1ccc(cc1O)NCCCCO 7a_100000759471_100000210776 [0,2,0,0,0,0|2,0,0]=4 10461 B14R1.232 Cc1ccc(cc1O)SCCCCF 62a_100000685420_100000729493 [0,2,0,0,0,0|2,0,0]=4 10462 B14R1.232 Cc1ccc(cc1O)SCCCCF 62a_100000729493_100000685420 [0,2,0,0,0,0|2,0,0]=4 10463 B14R1.232 Cc1ccc(cc1O)SCCCCO 62a_100000210776_100000685420 [0,2,0,0,0,0|2,0,0]=4 10464 B14R1.232 Cc1ccc(cc1O)SCCCCO 62a_100000685420_100000210776 [0,2,0,0,0,0|2,0,0]=4 10465 B14R1.232 FCCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100011217306 [0,2,0,0,0,0|2,0,0]=4 10466 B14R1.232 FCCNCCc1ccc(c(c1)Cl)Cl 34a_100000724931_100011713676 [0,2,0,0,0,0|2,0,0]=4 10467 B14R1.232 FCCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100011217306 [0,2,0,0,0,0|2,0,0]=4 10468 B14R1.232 FCCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100011217306 [0,2,0,0,0,0|2,0,0]=4 10469 B14R1.232 FCCNCCc1ccc(c(c1)Cl)F 34a_100000724931_100012361305 [0,2,0,0,0,0|2,0,0]=4 10470 B14R1.232 FCCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100011217306 [0,2,0,0,0,0|2,0,0]=4 10471 B14R1.232 FCCNCCc1ccc(c(c1)F)F 2230a_200000706328_100011217306 [0,2,0,0,0,0|2,0,0]=4 10472 B14R1.232 FCCNCCc1ccc(c(c1)F)F 34a_100000724931_100000690553 [0,2,0,0,0,0|2,0,0]=4 10473 B14R1.232 FCCNCCc1ccc(c(c1)F)F 34a_200000706328_100011217306 [0,2,0,0,0,0|2,0,0]=4 10474 B14R1.232 FCNCCOc1ccc(c(c1)Cl)Cl 34a_100015199673_100015361967 [0,2,0,0,0,0|2,0,0]=4 10475 B14R1.232 N#CCCCSc1ccc(c(c1)O)O 62a_100000687738_100009813601 [0,2,0,0,0,0|1,0,1]=4 10476 B14R1.232 N#CCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100011215382 [0,2,0,0,0,0|2,0,0]=4 10477 B14R1.232 N#CCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100011215382 [0,2,0,0,0,0|2,0,0]=4 10478 B14R1.232 N#CCNCCc1ccc(c(c1)F)F 2230a_200000706328_100011215382 [0,2,0,0,0,0|2,0,0]=4 10479 B14R1.232 N#CCSCCc1ccc(c(c1)O)O 62a_100011215382_200010393615 [0,2,0,0,0,0|1,0,0]=3 10480 B14R1.232 N#CSCCSc1ccc(c(c1)O)O 62a_100000034367_100009813601 [0,2,0,0,0,0|1,0,1]=4 10481 B14R1.232 Nc1cc(ccc1O)SCCCCF 62a_100000729493_100000752626 [0,2,0,0,0,0|2,0,0]=4 10482 B14R1.232 Nc1cc(ccc1O)SCCCCF 62a_100000752626_100000729493 [0,2,0,0,0,0|2,0,0]=4 10483 B14R1.232 Nc1cc(ccc1O)SCCCCO 62a_100000210776_100000752626 [0,2,0,0,0,0|2,0,0]=4 10484 B14R1.232 Nc1cc(ccc1O)SCCCCO 62a_100000752626_100000210776 [0,2,0,0,0,0|2,0,0]=4 10485 B14R1.232 Nc1ccc(cc1O)SCCCCF 62a_100000729493_100000739049 [0,2,0,0,0,0|2,0,0]=4 10486 B14R1.232 Nc1ccc(cc1O)SCCCCF 62a_100000739049_100000729493 [0,2,0,0,0,0|2,0,0]=4 10487 B14R1.232 Nc1ccc(cc1O)SCCCCO 62a_100000210776_100000739049 [0,2,0,0,0,0|2,0,0]=4 10488 B14R1.232 Nc1ccc(cc1O)SCCCCO 62a_100000739049_100000210776 [0,2,0,0,0,0|2,0,0]=4 10489 B14R1.232 O=CCCCSc1ccc(c(c1)O)O 62a_200011292268_100009813601 [0,2,0,0,0,0|1,0,1]=4 10490 B14R1.232 O=CCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200015260668 [0,2,0,0,0,0|2,0,0]=4 10491 B14R1.232 O=CCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200009817547 [0,2,0,0,0,0|2,0,0]=4 10492 B14R1.232 O=CCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_200015260668 [0,2,0,0,0,0|2,0,0]=4 10493 B14R1.232 O=CCNCCc1ccc(c(c1)Cl)F 34a_200011997520_200009817547 [0,2,0,0,0,0|2,0,0]=4 10494 B14R1.232 O=CCNCCc1ccc(c(c1)F)F 2230a_200000706328_200015260668 [0,2,0,0,0,0|2,0,0]=4 10495 B14R1.232 O=CCNCCc1ccc(c(c1)F)F 34a_200000706328_200009817547 [0,2,0,0,0,0|2,0,0]=4 10496 B14R1.232 O=CCNCCc1ccc(c(c1)O)O 34a_100000210387_200009817547 [0,2,0,0,0,0|0,0,0]=2 10497 B14R1.232 O=CCSCCc1ccc(c(c1)O)O 62a_200015260668_200010393615 [0,2,0,0,0,0|1,0,0]=3 10498 B14R1.232 OCC#CCNc1ccc(c(c1)O)O 34a_100102946323_200000047223 [0,2,0,0,0,0|1,0,1]=4 10499 B14R1.232 OCC#CCSc1ccc(c(c1)O)O 62a_200000047223_100009813601 [0,2,0,0,0,0|1,0,1]=4 10500 B14R1.232 OCCCCNc1ccc(c(c1)Br)O 34a_100011534360_100011216708 [0,2,0,0,0,0|2,0,0]=4 10501 B14R1.232 OCCCCNc1ccc(c(c1)Cl)O 34a_100000744943_100011216708 [0,2,0,0,0,0|2,0,0]=4 10502 B14R1.232 OCCCCNc1ccc(c(c1)F)O 34a_100011220035_100011216708 [0,2,0,0,0,0|2,0,0]=4 10503 B14R1.232 OCCCCNc1ccc(c(c1)F)O 7a_100011220035_100000210776 [0,2,0,0,0,0|2,0,0]=4 10504 B14R1.232 OCCCCNc1ccc(c(c1)O)Cl 34a_100011934209_100011216708 [0,2,0,0,0,0|2,0,0]=4 10505 B14R1.232 OCCCCNc1ccc(c(c1)O)F 34a_100012017398_100011216708 [0,2,0,0,0,0|2,0,0]=4 10506 B14R1.232 OCCCCNc1ccc(c(c1)O)F 7a_100012017398_100000210776 [0,2,0,0,0,0|2,0,0]=4 10507 B14R1.232 OCCCCNc1ccc(c(c1)O)O 34a_100102946323_100011216708 [0,2,0,0,0,0|1,0,0]=3 10508 B14R1.232 OCCCCSc1ccc(c(c1)Br)O 62a_100000210776_100012361655 [0,2,0,0,0,0|2,0,0]=4 10509 B14R1.232 OCCCCSc1ccc(c(c1)Br)O 62a_100012361655_100000210776 [0,2,0,0,0,0|2,0,0]=4 10510 B14R1.232 OCCCCSc1ccc(c(c1)Cl)O 62a_100000210776_100012360047 [0,2,0,0,0,0|2,0,0]=4 10511 B14R1.232 OCCCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210776 [0,2,0,0,0,0|2,0,0]=4 10512 B14R1.232 OCCCCSc1ccc(c(c1)F)O 62a_100000185481_100000210776 [0,2,0,0,0,0|2,0,0]=4 10513 B14R1.232 OCCCCSc1ccc(c(c1)F)O 62a_100000210776_100000185481 [0,2,0,0,0,0|2,0,0]=4 10514 B14R1.232 OCCCCSc1ccc(c(c1)O)Br 62a_100000210776_100012356990 [0,2,0,0,0,0|2,0,0]=4 10515 B14R1.232 OCCCCSc1ccc(c(c1)O)Br 62a_100012356990_100000210776 [0,2,0,0,0,0|2,0,0]=4 10516 B14R1.232 OCCCCSc1ccc(c(c1)O)Cl 62a_100000210776_100011356854 [0,2,0,0,0,0|2,0,0]=4 10517 B14R1.232 OCCCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210776 [0,2,0,0,0,0|2,0,0]=4 10518 B14R1.232 OCCCCSc1ccc(c(c1)O)F 62a_100000210776_100000686035 [0,2,0,0,0,0|2,0,0]=4 10519 B14R1.232 OCCCCSc1ccc(c(c1)O)F 62a_100000686035_100000210776 [0,2,0,0,0,0|2,0,0]=4 10520 B14R1.232 OCCCCSc1ccc(c(c1)O)O 62a_100000210776_100009813601 [0,2,0,0,0,0|1,0,0]=3 10521 B14R1.232 OCCCNCc1ccc(c(c1)F)O 34a_100000758358_100000230001 [0,2,0,0,0,0|2,0,0]=4 10522 B14R1.232 OCCCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000230001 [0,2,0,0,0,0|2,0,0]=4 10523 B14R1.232 OCCCNCc1ccc(c(c1)O)F 34a_100160469508_100000230001 [0,2,0,0,0,0|2,0,0]=4 10524 B14R1.232 OCCCNCc1ccc(c(c1)O)O 34a_100000010075_100000230001 [0,2,0,0,0,0|1,0,0]=3 10525 B14R1.232 OCCNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000211926 [0,2,0,0,0,0|2,0,0]=4 10526 B14R1.232 OCCNCCc1ccc(c(c1)Cl)Cl 2230a_100016997473_100011713676 [0,2,0,0,0,0|2,0,0]=4 10527 B14R1.232 OCCNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100000211926 [0,2,0,0,0,0|2,0,0]=4 10528 B14R1.232 OCCNCCc1ccc(c(c1)Cl)Cl 34a_100016990907_100011713676 [0,2,0,0,0,0|2,0,0]=4 10529 B14R1.232 OCCNCCc1ccc(c(c1)Cl)F 2230a_100016997473_100012361305 [0,2,0,0,0,0|2,0,0]=4 10530 B14R1.232 OCCNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000211926 [0,2,0,0,0,0|2,0,0]=4 10531 B14R1.232 OCCNCCc1ccc(c(c1)Cl)F 34a_100016990907_100012361305 [0,2,0,0,0,0|2,0,0]=4 10532 B14R1.232 OCCNCCc1ccc(c(c1)Cl)F 34a_200011997520_100000211926 [0,2,0,0,0,0|2,0,0]=4 10533 B14R1.232 OCCNCCc1ccc(c(c1)F)F 2230a_100016997473_100000690553 [0,2,0,0,0,0|2,0,0]=4 10534 B14R1.232 OCCNCCc1ccc(c(c1)F)F 2230a_200000706328_100000211926 [0,2,0,0,0,0|2,0,0]=4 10535 B14R1.232 OCCNCCc1ccc(c(c1)F)F 34a_100016990907_100000690553 [0,2,0,0,0,0|2,0,0]=4 10536 B14R1.232 OCCNCCc1ccc(c(c1)F)F 34a_200000706328_100000211926 [0,2,0,0,0,0|2,0,0]=4 10537 B14R1.232 OCCNCCc1ccc(c(c1)O)O 34a_100000210387_100000211926 [0,2,0,0,0,0|0,0,0]=2 10538 B14R1.232 OCCNN=Cc1ccc(c(c1)O)O 4a_100000210001_100000184535 [0,2,0,0,0,0|1,0,1]=4 10539 B14R1.232 OCCSCCc1ccc(c(c1)O)O 62a_100000211926_200010393615 [0,2,0,0,0,0|1,0,0]=3 10540 B14R1.232 Oc1cc(ccc1Br)SCCCCF 62a_100000729493_100012356990 [0,2,0,0,0,0|2,0,0]=4 10541 B14R1.232 Oc1cc(ccc1Br)SCCCCF 62a_100012356990_100000729493 [0,2,0,0,0,0|2,0,0]=4 10542 B14R1.232 Oc1cc(ccc1Cl)CNCCCF 34a_100020636435_100011934791 [0,2,0,0,0,0|2,0,0]=4 10543 B14R1.232 Oc1cc(ccc1Cl)NCCCCF 34a_100011934209_100000729493 [0,2,0,0,0,0|2,0,0]=4 10544 B14R1.232 Oc1cc(ccc1Cl)SCCCCF 62a_100000729493_100011356854 [0,2,0,0,0,0|2,0,0]=4 10545 B14R1.232 Oc1cc(ccc1Cl)SCCCCF 62a_100011356854_100000729493 [0,2,0,0,0,0|2,0,0]=4 10546 B14R1.232 Oc1cc(ccc1F)CNCCCF 34a_100160469508_100011934791 [0,2,0,0,0,0|2,0,0]=4 10547 B14R1.232 Oc1cc(ccc1F)NCCCCF 34a_100012017398_100000729493 [0,2,0,0,0,0|2,0,0]=4 10548 B14R1.232 Oc1cc(ccc1F)NCCCCF 7a_100012017398_100000729493 [0,2,0,0,0,0|2,0,0]=4 10549 B14R1.232 Oc1cc(ccc1F)SCCCCF 62a_100000686035_100000729493 [0,2,0,0,0,0|2,0,0]=4 10550 B14R1.232 Oc1cc(ccc1F)SCCCCF 62a_100000729493_100000686035 [0,2,0,0,0,0|2,0,0]=4 10551 B14R1.232 Oc1ccc(cc1Br)NCCCCF 34a_100011534360_100000729493 [0,2,0,0,0,0|2,0,0]=4 10552 B14R1.232 Oc1ccc(cc1Br)SCCCCF 62a_100000729493_100012361655 [0,2,0,0,0,0|2,0,0]=4 10553 B14R1.232 Oc1ccc(cc1Br)SCCCCF 62a_100012361655_100000729493 [0,2,0,0,0,0|2,0,0]=4 10554 B14R1.232 Oc1ccc(cc1Cl)NCCCCF 34a_100000744943_100000729493 [0,2,0,0,0,0|2,0,0]=4 10555 B14R1.232 Oc1ccc(cc1Cl)SCCCCF 62a_100000729493_100012360047 [0,2,0,0,0,0|2,0,0]=4 10556 B14R1.232 Oc1ccc(cc1Cl)SCCCCF 62a_100012360047_100000729493 [0,2,0,0,0,0|2,0,0]=4 10557 B14R1.232 Oc1ccc(cc1F)CNCCCF 34a_100000758358_100011934791 [0,2,0,0,0,0|2,0,0]=4 10558 B14R1.232 Oc1ccc(cc1F)NCCCCF 34a_100011220035_100000729493 [0,2,0,0,0,0|2,0,0]=4 10559 B14R1.232 Oc1ccc(cc1F)NCCCCF 7a_100011220035_100000729493 [0,2,0,0,0,0|2,0,0]=4 10560 B14R1.232 Oc1ccc(cc1F)SCCCCF 62a_100000185481_100000729493 [0,2,0,0,0,0|2,0,0]=4 10561 B14R1.232 Oc1ccc(cc1F)SCCCCF 62a_100000729493_100000185481 [0,2,0,0,0,0|2,0,0]=4 10562 B14R1.232 Oc1ccc(cc1O)CCNCCF 34a_100000210387_100011217306 [0,2,0,0,0,0|0,0,0]=2 10563 B14R1.232 Oc1ccc(cc1O)CCSCCF 62a_100011217306_200010393615 [0,2,0,0,0,0|1,0,0]=3 10564 B14R1.232 Oc1ccc(cc1O)CNCCCF 34a_100000010075_100011934791 [0,2,0,0,0,0|1,0,0]=3 10565 B14R1.232 Oc1ccc(cc1O)NCCCCF 34a_100102946323_100000729493 [0,2,0,0,0,0|1,0,0]=3 10566 B14R1.232 Oc1ccc(cc1O)SCCCCF 62a_100000729493_100009813601 [0,2,0,0,0,0|1,0,0]=3 10567 B14R1.687 C=C(C)CCNc1ccc(c(c1)Br)O 34a_100011534360_100000730704 [0,2,0,0,0,0|2,0,0]=4 10568 B14R1.687 C=C(C)CCNc1ccc(c(c1)C)O 34a_100011218179_100000730704 [0,2,0,0,0,0|2,0,0]=4 10569 B14R1.687 C=C(C)CCNc1ccc(c(c1)C)O 7a_100011218179_100000730704 [0,2,0,0,0,0|2,0,0]=4 10570 B14R1.687 C=C(C)CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000730704 [0,2,0,0,0,0|2,0,0]=4 10571 B14R1.687 C=C(C)CCNc1ccc(c(c1)F)O 34a_100011220035_100000730704 [0,2,0,0,0,0|2,0,0]=4 10572 B14R1.687 C=C(C)CCNc1ccc(c(c1)F)O 7a_100011220035_100000730704 [0,2,0,0,0,0|2,0,0]=4 10573 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)C 34a_100000759471_100000730704 [0,2,0,0,0,0|2,0,0]=4 10574 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)C 7a_100000759471_100000730704 [0,2,0,0,0,0|2,0,0]=4 10575 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000730704 [0,2,0,0,0,0|2,0,0]=4 10576 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)F 34a_100012017398_100000730704 [0,2,0,0,0,0|2,0,0]=4 10577 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)F 7a_100012017398_100000730704 [0,2,0,0,0,0|2,0,0]=4 10578 B14R1.687 C=C(C)CCNc1ccc(c(c1)O)O 34a_100102946323_100000730704 [0,2,0,0,0,0|1,0,0]=3 10579 B14R1.687 C=C(C)CCSc1ccc(c(c1)Br)O 62a_100000730704_100012361655 [0,2,0,0,0,0|2,0,0]=4 10580 B14R1.687 C=C(C)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000730704 [0,2,0,0,0,0|2,0,0]=4 10581 B14R1.687 C=C(C)CCSc1ccc(c(c1)C)O 62a_100000730704_100000186361 [0,2,0,0,0,0|2,0,0]=4 10582 B14R1.687 C=C(C)CCSc1ccc(c(c1)Cl)O 62a_100000730704_100012360047 [0,2,0,0,0,0|2,0,0]=4 10583 B14R1.687 C=C(C)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000730704 [0,2,0,0,0,0|2,0,0]=4 10584 B14R1.687 C=C(C)CCSc1ccc(c(c1)F)O 62a_100000185481_100000730704 [0,2,0,0,0,0|2,0,0]=4 10585 B14R1.687 C=C(C)CCSc1ccc(c(c1)F)O 62a_100000730704_100000185481 [0,2,0,0,0,0|2,0,0]=4 10586 B14R1.687 C=C(C)CCSc1ccc(c(c1)N)O 62a_100000730704_100000752626 [0,2,0,0,0,0|2,0,0]=4 10587 B14R1.687 C=C(C)CCSc1ccc(c(c1)N)O 62a_100000752626_100000730704 [0,2,0,0,0,0|2,0,0]=4 10588 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)Br 62a_100000730704_100012356990 [0,2,0,0,0,0|2,0,0]=4 10589 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000730704 [0,2,0,0,0,0|2,0,0]=4 10590 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)C 62a_100000685420_100000730704 [0,2,0,0,0,0|2,0,0]=4 10591 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)C 62a_100000730704_100000685420 [0,2,0,0,0,0|2,0,0]=4 10592 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)Cl 62a_100000730704_100011356854 [0,2,0,0,0,0|2,0,0]=4 10593 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000730704 [0,2,0,0,0,0|2,0,0]=4 10594 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)F 62a_100000686035_100000730704 [0,2,0,0,0,0|2,0,0]=4 10595 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)F 62a_100000730704_100000686035 [0,2,0,0,0,0|2,0,0]=4 10596 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)N 62a_100000730704_100000739049 [0,2,0,0,0,0|2,0,0]=4 10597 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)N 62a_100000739049_100000730704 [0,2,0,0,0,0|2,0,0]=4 10598 B14R1.687 C=C(C)CCSc1ccc(c(c1)O)O 62a_100000730704_100009813601 [0,2,0,0,0,0|1,0,0]=3 10599 B14R1.687 C=C(C)CNCc1ccc(c(c1)F)O 34a_100000758358_100000748629 [0,2,0,0,0,0|2,0,0]=4 10600 B14R1.687 C=C(C)CNCc1ccc(c(c1)O)Cl 34a_100020636435_100000748629 [0,2,0,0,0,0|2,0,0]=4 10601 B14R1.687 C=C(C)CNCc1ccc(c(c1)O)F 34a_100160469508_100000748629 [0,2,0,0,0,0|2,0,0]=4 10602 B14R1.687 C=C(C)CNCc1ccc(c(c1)O)O 34a_100000010075_100000748629 [0,2,0,0,0,0|1,0,0]=3 10603 B14R1.687 C=C(F)CNCc1ccc(c(c1)O)O 34a_100000010075_100009893438 [0,2,0,0,0,0|1,0,1]=4 10604 B14R1.687 CC(=CCNc1ccc(c(c1)O)O)C 34a_100102946323_100000761012 [0,2,0,0,0,0|1,0,1]=4 10605 B14R1.687 CC(=CCSc1ccc(c(c1)O)O)C 62a_100000761012_100009813601 [0,2,0,0,0,0|1,0,1]=4 10606 B14R1.687 CC(=O)CCNc1ccc(c(c1)C)O 7a_100011218179_100000053229 [0,2,0,0,0,0|2,0,0]=4 10607 B14R1.687 CC(=O)CCNc1ccc(c(c1)F)O 7a_100011220035_100000053229 [0,2,0,0,0,0|2,0,0]=4 10608 B14R1.687 CC(=O)CCNc1ccc(c(c1)O)C 7a_100000759471_100000053229 [0,2,0,0,0,0|2,0,0]=4 10609 B14R1.687 CC(=O)CCNc1ccc(c(c1)O)F 7a_100012017398_100000053229 [0,2,0,0,0,0|2,0,0]=4 10610 B14R1.687 CC(=O)CCSc1ccc(c(c1)Br)O 62a_100000053229_100012361655 [0,2,0,0,0,0|2,0,0]=4 10611 B14R1.687 CC(=O)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000053229 [0,2,0,0,0,0|2,0,0]=4 10612 B14R1.687 CC(=O)CCSc1ccc(c(c1)C)O 62a_100000053229_100000186361 [0,2,0,0,0,0|2,0,0]=4 10613 B14R1.687 CC(=O)CCSc1ccc(c(c1)Cl)O 62a_100000053229_100012360047 [0,2,0,0,0,0|2,0,0]=4 10614 B14R1.687 CC(=O)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000053229 [0,2,0,0,0,0|2,0,0]=4 10615 B14R1.687 CC(=O)CCSc1ccc(c(c1)F)O 62a_100000053229_100000185481 [0,2,0,0,0,0|2,0,0]=4 10616 B14R1.687 CC(=O)CCSc1ccc(c(c1)F)O 62a_100000185481_100000053229 [0,2,0,0,0,0|2,0,0]=4 10617 B14R1.687 CC(=O)CCSc1ccc(c(c1)N)O 62a_100000053229_100000752626 [0,2,0,0,0,0|2,0,0]=4 10618 B14R1.687 CC(=O)CCSc1ccc(c(c1)N)O 62a_100000752626_100000053229 [0,2,0,0,0,0|2,0,0]=4 10619 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Br 62a_100000053229_100012356990 [0,2,0,0,0,0|2,0,0]=4 10620 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000053229 [0,2,0,0,0,0|2,0,0]=4 10621 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)C 62a_100000053229_100000685420 [0,2,0,0,0,0|2,0,0]=4 10622 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)C 62a_100000685420_100000053229 [0,2,0,0,0,0|2,0,0]=4 10623 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Cl 62a_100000053229_100011356854 [0,2,0,0,0,0|2,0,0]=4 10624 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000053229 [0,2,0,0,0,0|2,0,0]=4 10625 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)F 62a_100000053229_100000686035 [0,2,0,0,0,0|2,0,0]=4 10626 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)F 62a_100000686035_100000053229 [0,2,0,0,0,0|2,0,0]=4 10627 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)N 62a_100000053229_100000739049 [0,2,0,0,0,0|2,0,0]=4 10628 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)N 62a_100000739049_100000053229 [0,2,0,0,0,0|2,0,0]=4 10629 B14R1.687 CC(=O)CCSc1ccc(c(c1)O)O 62a_100000053229_100009813601 [0,2,0,0,0,0|1,0,0]=3 10630 B14R1.687 CC(=O)NCCc1ccc(c(c1)C)C 11a_100020591374_100015343762 [0,2,0,0,0,0|2,0,0]=4 10631 B14R1.687 CC(=O)NCCc1ccc(c(c1)C)C 1626a_100020591374_100015343762 [0,2,0,0,0,0|2,0,0]=4 10632 B14R1.687 CC(=O)NCCc1ccc(c(c1)C)C 240690a_100020591374_100015343762 [0,2,0,0,0,0|2,0,0]=4 10633 B14R1.687 CC(=O)NCCc1ccc(c(c1)C)C 527a_100020591374_100103153847 [0,2,0,0,0,0|2,0,0]=4 10634 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)Cl 11a_100011207230_100015343762 [0,2,0,0,0,0|2,0,0]=4 10635 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)Cl 1626a_100011207230_100015343762 [0,2,0,0,0,0|2,0,0]=4 10636 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)Cl 240690a_100011207230_100015343762 [0,2,0,0,0,0|2,0,0]=4 10637 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)Cl 527a_100011207230_100103153847 [0,2,0,0,0,0|2,0,0]=4 10638 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)F 11a_200011997520_100015343762 [0,2,0,0,0,0|2,0,0]=4 10639 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)F 1626a_200011997520_100015343762 [0,2,0,0,0,0|2,0,0]=4 10640 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)F 240690a_200011997520_100015343762 [0,2,0,0,0,0|2,0,0]=4 10641 B14R1.687 CC(=O)NCCc1ccc(c(c1)Cl)F 527a_200011997520_100103153847 [0,2,0,0,0,0|2,0,0]=4 10642 B14R1.687 CC(=O)NCCc1ccc(c(c1)F)F 11a_200000706328_100015343762 [0,2,0,0,0,0|2,0,0]=4 10643 B14R1.687 CC(=O)NCCc1ccc(c(c1)F)F 1626a_200000706328_100015343762 [0,2,0,0,0,0|2,0,0]=4 10644 B14R1.687 CC(=O)NCCc1ccc(c(c1)F)F 240690a_200000706328_100015343762 [0,2,0,0,0,0|2,0,0]=4 10645 B14R1.687 CC(=O)NCCc1ccc(c(c1)F)F 527a_200000706328_100103153847 [0,2,0,0,0,0|2,0,0]=4 10646 B14R1.687 CC(=O)NCCc1ccc(c(c1)O)O 240690a_100000210387_100015343762 [0,2,0,0,0,0|0,0,0]=2 10647 B14R1.687 CC(=O)NCCc1ccc(c(c1)O)O 527a_100000210387_100103153847 [0,2,0,0,0,0|0,0,0]=2 10648 B14R1.687 CC(=O)NN=Cc1ccc(c(c1)O)O 4a_100000189765_100000184535 [0,2,0,0,0,0|1,0,1]=4 10649 B14R1.687 CC(=O)OCNc1ccc(c(c1)O)O 34a_100102946323_100009813279 [0,2,0,0,0,0|2,0,0]=4 10650 B14R1.687 CC(=O)OCSc1ccc(c(c1)O)O 62a_100000076356_100009813601 [0,2,0,0,0,0|2,0,0]=4 10651 B14R1.687 CC(C)CC=Cc1ccc(c(c1)O)O 271570a_100016259101_100009813601 [0,2,0,0,0,0|1,0,1]=4 10652 B14R1.687 CC(C)CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210312 [0,2,0,0,0,0|2,0,0]=4 10653 B14R1.687 CC(C)CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210312 [0,2,0,0,0,0|2,0,0]=4 10654 B14R1.687 CC(C)CCNc1ccc(c(c1)F)O 34a_100011220035_100000210312 [0,2,0,0,0,0|2,0,0]=4 10655 B14R1.687 CC(C)CCNc1ccc(c(c1)F)O 7a_100011220035_100000210626 [0,2,0,0,0,0|2,0,0]=4 10656 B14R1.687 CC(C)CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210312 [0,2,0,0,0,0|2,0,0]=4 10657 B14R1.687 CC(C)CCNc1ccc(c(c1)O)F 34a_100012017398_100000210312 [0,2,0,0,0,0|2,0,0]=4 10658 B14R1.687 CC(C)CCNc1ccc(c(c1)O)F 7a_100012017398_100000210626 [0,2,0,0,0,0|2,0,0]=4 10659 B14R1.687 CC(C)CCNc1ccc(c(c1)O)O 34a_100102946323_100000210312 [0,2,0,0,0,0|1,0,0]=3 10660 B14R1.687 CC(C)CCSc1ccc(c(c1)Br)O 62a_100000210312_100012361655 [0,2,0,0,0,0|2,0,0]=4 10661 B14R1.687 CC(C)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210312 [0,2,0,0,0,0|2,0,0]=4 10662 B14R1.687 CC(C)CCSc1ccc(c(c1)Cl)O 62a_100000210312_100012360047 [0,2,0,0,0,0|2,0,0]=4 10663 B14R1.687 CC(C)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210312 [0,2,0,0,0,0|2,0,0]=4 10664 B14R1.687 CC(C)CCSc1ccc(c(c1)F)O 62a_100000185481_100000210312 [0,2,0,0,0,0|2,0,0]=4 10665 B14R1.687 CC(C)CCSc1ccc(c(c1)F)O 62a_100000210312_100000185481 [0,2,0,0,0,0|2,0,0]=4 10666 B14R1.687 CC(C)CCSc1ccc(c(c1)N)O 62a_100000210312_100000752626 [0,2,0,0,0,0|2,0,0]=4 10667 B14R1.687 CC(C)CCSc1ccc(c(c1)N)O 62a_100000752626_100000210312 [0,2,0,0,0,0|2,0,0]=4 10668 B14R1.687 CC(C)CCSc1ccc(c(c1)O)Br 62a_100000210312_100012356990 [0,2,0,0,0,0|2,0,0]=4 10669 B14R1.687 CC(C)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210312 [0,2,0,0,0,0|2,0,0]=4 10670 B14R1.687 CC(C)CCSc1ccc(c(c1)O)Cl 62a_100000210312_100011356854 [0,2,0,0,0,0|2,0,0]=4 10671 B14R1.687 CC(C)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210312 [0,2,0,0,0,0|2,0,0]=4 10672 B14R1.687 CC(C)CCSc1ccc(c(c1)O)F 62a_100000210312_100000686035 [0,2,0,0,0,0|2,0,0]=4 10673 B14R1.687 CC(C)CCSc1ccc(c(c1)O)F 62a_100000686035_100000210312 [0,2,0,0,0,0|2,0,0]=4 10674 B14R1.687 CC(C)CCSc1ccc(c(c1)O)N 62a_100000210312_100000739049 [0,2,0,0,0,0|2,0,0]=4 10675 B14R1.687 CC(C)CCSc1ccc(c(c1)O)N 62a_100000739049_100000210312 [0,2,0,0,0,0|2,0,0]=4 10676 B14R1.687 CC(C)CCSc1ccc(c(c1)O)O 62a_100000210312_100009813601 [0,2,0,0,0,0|1,0,0]=3 10677 B14R1.687 CC(C)CNCc1ccc(c(c1)F)O 270004a_100000758358_100000210432 [0,2,0,0,0,0|2,0,0]=4 10678 B14R1.687 CC(C)CNCc1ccc(c(c1)F)O 34a_100000758358_100000210624 [0,2,0,0,0,0|2,0,0]=4 10679 B14R1.687 CC(C)CNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210624 [0,2,0,0,0,0|2,0,0]=4 10680 B14R1.687 CC(C)CNCc1ccc(c(c1)O)F 270004a_100160469508_100000210432 [0,2,0,0,0,0|2,0,0]=4 10681 B14R1.687 CC(C)CNCc1ccc(c(c1)O)F 34a_100160469508_100000210624 [0,2,0,0,0,0|2,0,0]=4 10682 B14R1.687 CC(C)CNCc1ccc(c(c1)O)O 34a_100000010075_100000210624 [0,2,0,0,0,0|1,0,0]=3 10683 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000210206 [0,2,0,0,0,0|2,0,0]=4 10684 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)Cl 2230a_100138425928_100011713676 [0,2,0,0,0,0|2,0,0]=4 10685 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100000210206 [0,2,0,0,0,0|2,0,0]=4 10686 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)Cl 34a_100138425928_100011713676 [0,2,0,0,0,0|2,0,0]=4 10687 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)F 2230a_100138425928_100012361305 [0,2,0,0,0,0|2,0,0]=4 10688 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000210206 [0,2,0,0,0,0|2,0,0]=4 10689 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)F 34a_100138425928_100012361305 [0,2,0,0,0,0|2,0,0]=4 10690 B14R1.687 CC(C)NCCc1ccc(c(c1)Cl)F 34a_200011997520_100000210206 [0,2,0,0,0,0|2,0,0]=4 10691 B14R1.687 CC(C)NCCc1ccc(c(c1)F)F 2230a_100138425928_100000690553 [0,2,0,0,0,0|2,0,0]=4 10692 B14R1.687 CC(C)NCCc1ccc(c(c1)F)F 2230a_200000706328_100000210206 [0,2,0,0,0,0|2,0,0]=4 10693 B14R1.687 CC(C)NCCc1ccc(c(c1)F)F 34a_100138425928_100000690553 [0,2,0,0,0,0|2,0,0]=4 10694 B14R1.687 CC(C)NCCc1ccc(c(c1)F)F 34a_200000706328_100000210206 [0,2,0,0,0,0|2,0,0]=4 10695 B14R1.687 CC(C)NCCc1ccc(c(c1)O)O 34a_100000210387_100000210206 [0,2,0,0,0,0|0,0,0]=2 10696 B14R1.687 CC(C)NN=Cc1ccc(c(c1)O)O 4a_100000741168_100000184535 [0,2,0,0,0,0|1,0,1]=4 10697 B14R1.687 CC(C)OCNc1ccc(c(c1)O)O 34a_100102946323_100000709892 [0,2,0,0,0,0|2,0,0]=4 10698 B14R1.687 CC(C)OCSc1ccc(c(c1)O)O 62a_100000709892_100009813601 [0,2,0,0,0,0|2,0,0]=4 10699 B14R1.687 CC(C)SCCc1ccc(c(c1)O)O 62a_100000210206_200010393615 [0,2,0,0,0,0|1,0,0]=3 10700 B14R1.687 CC(O)CCNc1ccc(c(c1)Br)O 34a_100011534360_100012276601 [0,2,0,0,0,0|2,0,0]=4 10701 B14R1.687 CC(O)CCNc1ccc(c(c1)Cl)O 34a_100000744943_100012276601 [0,2,0,0,0,0|2,0,0]=4 10702 B14R1.687 CC(O)CCNc1ccc(c(c1)F)O 34a_100011220035_100012276601 [0,2,0,0,0,0|2,0,0]=4 10703 B14R1.687 CC(O)CCNc1ccc(c(c1)F)O 7a_100011220035_100012276601 [0,2,0,0,0,0|2,0,0]=4 10704 B14R1.687 CC(O)CCNc1ccc(c(c1)O)Cl 34a_100011934209_100012276601 [0,2,0,0,0,0|2,0,0]=4 10705 B14R1.687 CC(O)CCNc1ccc(c(c1)O)F 34a_100012017398_100012276601 [0,2,0,0,0,0|2,0,0]=4 10706 B14R1.687 CC(O)CCNc1ccc(c(c1)O)F 7a_100012017398_100012276601 [0,2,0,0,0,0|2,0,0]=4 10707 B14R1.687 CC(O)CCNc1ccc(c(c1)O)O 34a_100102946323_100012276601 [0,2,0,0,0,0|1,0,0]=3 10708 B14R1.687 CC(O)CCSc1ccc(c(c1)Br)O 62a_100012276601_100012361655 [0,2,0,0,0,0|2,0,0]=4 10709 B14R1.687 CC(O)CCSc1ccc(c(c1)Br)O 62a_100012361655_100012276601 [0,2,0,0,0,0|2,0,0]=4 10710 B14R1.687 CC(O)CCSc1ccc(c(c1)Cl)O 62a_100012276601_100012360047 [0,2,0,0,0,0|2,0,0]=4 10711 B14R1.687 CC(O)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100012276601 [0,2,0,0,0,0|2,0,0]=4 10712 B14R1.687 CC(O)CCSc1ccc(c(c1)F)O 62a_100000185481_100012276601 [0,2,0,0,0,0|2,0,0]=4 10713 B14R1.687 CC(O)CCSc1ccc(c(c1)F)O 62a_100012276601_100000185481 [0,2,0,0,0,0|2,0,0]=4 10714 B14R1.687 CC(O)CCSc1ccc(c(c1)N)O 62a_100000752626_100012276601 [0,2,0,0,0,0|2,0,0]=4 10715 B14R1.687 CC(O)CCSc1ccc(c(c1)N)O 62a_100012276601_100000752626 [0,2,0,0,0,0|2,0,0]=4 10716 B14R1.687 CC(O)CCSc1ccc(c(c1)O)Br 62a_100012276601_100012356990 [0,2,0,0,0,0|2,0,0]=4 10717 B14R1.687 CC(O)CCSc1ccc(c(c1)O)Br 62a_100012356990_100012276601 [0,2,0,0,0,0|2,0,0]=4 10718 B14R1.687 CC(O)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100012276601 [0,2,0,0,0,0|2,0,0]=4 10719 B14R1.687 CC(O)CCSc1ccc(c(c1)O)Cl 62a_100012276601_100011356854 [0,2,0,0,0,0|2,0,0]=4 10720 B14R1.687 CC(O)CCSc1ccc(c(c1)O)F 62a_100000686035_100012276601 [0,2,0,0,0,0|2,0,0]=4 10721 B14R1.687 CC(O)CCSc1ccc(c(c1)O)F 62a_100012276601_100000686035 [0,2,0,0,0,0|2,0,0]=4 10722 B14R1.687 CC(O)CCSc1ccc(c(c1)O)N 62a_100000739049_100012276601 [0,2,0,0,0,0|2,0,0]=4 10723 B14R1.687 CC(O)CCSc1ccc(c(c1)O)N 62a_100012276601_100000739049 [0,2,0,0,0,0|2,0,0]=4 10724 B14R1.687 CC(O)CCSc1ccc(c(c1)O)O 62a_100012276601_100009813601 [0,2,0,0,0,0|1,0,0]=3 10725 B14R1.687 CC(O)CNCc1ccc(c(c1)F)O 34a_100000758358_100011218427 [0,2,0,0,0,0|2,0,0]=4 10726 B14R1.687 CC(O)CNCc1ccc(c(c1)O)Cl 34a_100020636435_100011218427 [0,2,0,0,0,0|2,0,0]=4 10727 B14R1.687 CC(O)CNCc1ccc(c(c1)O)F 34a_100160469508_100011218427 [0,2,0,0,0,0|2,0,0]=4 10728 B14R1.687 CC(O)CNCc1ccc(c(c1)O)O 34a_100000010075_100011218427 [0,2,0,0,0,0|1,0,0]=3 10729 B14R1.687 CN(C)CCNc1ccc(c(c1)Br)Br 7a_100011306057_100000755713 [0,2,0,0,0,0|2,0,0]=4 10730 B14R1.687 CN(C)CCNc1ccc(c(c1)Br)F 7a_100000760356_100000755713 [0,2,0,0,0,0|2,0,0]=4 10731 B14R1.687 CN(C)CCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000755713 [0,2,0,0,0,0|2,0,0]=4 10732 B14R1.687 CN(C)CCNc1ccc(c(c1)Cl)F 7a_100000211060_100000755713 [0,2,0,0,0,0|2,0,0]=4 10733 B14R1.687 CN(C)CCNc1ccc(c(c1)F)Br 7a_100000759894_100000755713 [0,2,0,0,0,0|2,0,0]=4 10734 B14R1.687 CN(C)CCNc1ccc(c(c1)F)Cl 7a_100000739366_100000755713 [0,2,0,0,0,0|2,0,0]=4 10735 B14R1.687 CN(C)CCNc1ccc(c(c1)F)F 7a_100000210724_100000755713 [0,2,0,0,0,0|2,0,0]=4 10736 B14R1.687 CN(C)CCNc1ccc(c(c1)F)I 7a_100011356925_100000755713 [0,2,0,0,0,0|2,0,0]=4 10737 B14R1.687 CN(C)CCNc1ccc(c(c1)F)O 7a_100011220035_100000755713 [0,2,0,0,0,0|1,0,0]=3 10738 B14R1.687 CN(C)CCNc1ccc(c(c1)I)F 7a_114828291077_100000755713 [0,2,0,0,0,0|2,0,0]=4 10739 B14R1.687 CN(C)CCNc1ccc(c(c1)O)F 7a_100012017398_100000755713 [0,2,0,0,0,0|1,0,0]=3 10740 B14R1.687 CN(C)CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000755713 [0,2,0,0,0,0|2,0,0]=4 10741 B14R1.687 CN(C)CCOc1ccc(c(c1)Br)F 7a_100000693481_100000755713 [0,2,0,0,0,0|2,0,0]=4 10742 B14R1.687 CN(C)CCOc1ccc(c(c1)Br)I 7a_100000701344_100000755713 [0,2,0,0,0,0|2,0,0]=4 10743 B14R1.687 CN(C)CCOc1ccc(c(c1)Br)N 7a_100012001276_100000755713 [0,2,0,0,0,0|2,0,0]=4 10744 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000755713 [0,2,0,0,0,0|2,0,0]=4 10745 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000755713 [0,2,0,0,0,0|2,0,0]=4 10746 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)F 2230a_100102631434_100011936913 [0,2,0,0,0,0|2,0,0]=4 10747 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)F 269982a_100102631434_100011936913 [0,2,0,0,0,0|2,0,0]=4 10748 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000755713 [0,2,0,0,0,0|2,0,0]=4 10749 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000755713 [0,2,0,0,0,0|2,0,0]=4 10750 B14R1.687 CN(C)CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000755713 [0,2,0,0,0,0|2,0,0]=4 10751 B14R1.687 CN(C)CCOc1ccc(c(c1)F)Br 7a_100000755031_100000755713 [0,2,0,0,0,0|2,0,0]=4 10752 B14R1.687 CN(C)CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000755713 [0,2,0,0,0,0|2,0,0]=4 10753 B14R1.687 CN(C)CCOc1ccc(c(c1)F)F 7a_100000181275_100000755713 [0,2,0,0,0,0|2,0,0]=4 10754 B14R1.687 CN(C)CCOc1ccc(c(c1)F)I 7a_100009990212_100000755713 [0,2,0,0,0,0|2,0,0]=4 10755 B14R1.687 CN(C)CCOc1ccc(c(c1)F)N 7a_100000759473_100000755713 [0,2,0,0,0,0|2,0,0]=4 10756 B14R1.687 CN(C)CCOc1ccc(c(c1)I)Br 7a_100012339312_100000755713 [0,2,0,0,0,0|2,0,0]=4 10757 B14R1.687 CN(C)CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000755713 [0,2,0,0,0,0|2,0,0]=4 10758 B14R1.687 CN(C)CCOc1ccc(c(c1)I)N 7a_100010084370_100000755713 [0,2,0,0,0,0|2,0,0]=4 10759 B14R1.687 CN(C)CCOc1ccc(c(c1)N)Br 7a_100011999798_100000755713 [0,2,0,0,0,0|2,0,0]=4 10760 B14R1.687 CN(C)CCOc1ccc(c(c1)N)F 7a_100012017239_100000755713 [0,2,0,0,0,0|2,0,0]=4 10761 B14R1.687 CN(C)CCSc1cc(c(cn1)F)O 62a_100009854642_100000755713 [0,2,0,0,0,0|2,0,0]=4 10762 B14R1.687 CN(C)CCSc1cc(c(cn1)O)N 62a_100009819941_100000755713 [0,2,0,0,0,0|2,0,0]=4 10763 B14R1.687 CN(C)CCSc1ccc(c(c1)Br)Br 62a_100012356285_100000755713 [0,2,0,0,0,0|2,0,0]=4 10764 B14R1.687 CN(C)CCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000755713 [0,2,0,0,0,0|2,0,0]=4 10765 B14R1.687 CN(C)CCSc1ccc(c(c1)Br)F 62a_100012047266_100000755713 [0,2,0,0,0,0|2,0,0]=4 10766 B14R1.687 CN(C)CCSc1ccc(c(c1)Br)N 62a_100000750455_100000755713 [0,2,0,0,0,0|2,0,0]=4 10767 B14R1.687 CN(C)CCSc1ccc(c(c1)Br)O 62a_100012361655_100000755713 [0,2,0,0,0,0|1,0,0]=3 10768 B14R1.687 CN(C)CCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000755713 [0,2,0,0,0,0|2,0,0]=4 10769 B14R1.687 CN(C)CCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000755713 [0,2,0,0,0,0|2,0,0]=4 10770 B14R1.687 CN(C)CCSc1ccc(c(c1)Cl)F 62a_100011215976_100000755713 [0,2,0,0,0,0|2,0,0]=4 10771 B14R1.687 CN(C)CCSc1ccc(c(c1)Cl)N 62a_100011218065_100000755713 [0,2,0,0,0,0|2,0,0]=4 10772 B14R1.687 CN(C)CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000755713 [0,2,0,0,0,0|1,0,0]=3 10773 B14R1.687 CN(C)CCSc1ccc(c(c1)F)Br 62a_100000685389_100000755713 [0,2,0,0,0,0|2,0,0]=4 10774 B14R1.687 CN(C)CCSc1ccc(c(c1)F)Cl 62a_100011216805_100000755713 [0,2,0,0,0,0|2,0,0]=4 10775 B14R1.687 CN(C)CCSc1ccc(c(c1)F)F 62a_100000703953_100000755713 [0,2,0,0,0,0|2,0,0]=4 10776 B14R1.687 CN(C)CCSc1ccc(c(c1)F)N 62a_100011215594_100000755713 [0,2,0,0,0,0|2,0,0]=4 10777 B14R1.687 CN(C)CCSc1ccc(c(c1)F)O 62a_100000185481_100000755713 [0,2,0,0,0,0|1,0,0]=3 10778 B14R1.687 CN(C)CCSc1ccc(c(c1)N)Br 62a_100000750456_100000755713 [0,2,0,0,0,0|2,0,0]=4 10779 B14R1.687 CN(C)CCSc1ccc(c(c1)N)Cl 62a_200000761891_100000755713 [0,2,0,0,0,0|2,0,0]=4 10780 B14R1.687 CN(C)CCSc1ccc(c(c1)N)F 62a_100000740924_100000755713 [0,2,0,0,0,0|2,0,0]=4 10781 B14R1.687 CN(C)CCSc1ccc(c(c1)N)N 62a_100000741789_100000755713 [0,2,0,0,0,0|2,0,0]=4 10782 B14R1.687 CN(C)CCSc1ccc(c(c1)N)O 62a_100000752626_100000755713 [0,2,0,0,0,0|1,0,0]=3 10783 B14R1.687 CN(C)CCSc1ccc(c(c1)O)Br 62a_100012356990_100000755713 [0,2,0,0,0,0|1,0,0]=3 10784 B14R1.687 CN(C)CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000755713 [0,2,0,0,0,0|1,0,0]=3 10785 B14R1.687 CN(C)CCSc1ccc(c(c1)O)F 62a_100000686035_100000755713 [0,2,0,0,0,0|1,0,0]=3 10786 B14R1.687 CN(C)CCSc1ccc(c(c1)O)N 62a_100000739049_100000755713 [0,2,0,0,0,0|1,0,0]=3 10787 B14R1.687 CN(C)CCSc1ccc(c(n1)Br)O 62a_100000725334_100000755713 [0,2,0,0,0,0|2,0,0]=4 10788 B14R1.687 CN(C)CCSc1ccc(c(n1)F)O 62a_100009819667_100000755713 [0,2,0,0,0,0|2,0,0]=4 10789 B14R1.687 CN(C)CCSc1ccc(c(n1)N)O 62a_100000685527_100000755713 [0,2,0,0,0,0|2,0,0]=4 10790 B14R1.687 CN(C)CCSc1ccc(c(n1)O)N 62a_100000718904_100000755713 [0,2,0,0,0,0|2,0,0]=4 10791 B14R1.687 CN(C)CCSc1cnc(c(c1)Cl)O 62a_100010238531_100000755713 [0,2,0,0,0,0|2,0,0]=4 10792 B14R1.687 CN(C)CCSc1cnc(c(c1)N)O 62a_100000743729_100000755713 [0,2,0,0,0,0|2,0,0]=4 10793 B14R1.687 CN(C)CCSc1cnc(c(c1)O)F 62a_100009819871_100000755713 [0,2,0,0,0,0|2,0,0]=4 10794 B14R1.687 CN(C)CCSc1cnc(c(c1)O)N 62a_100009819042_100000755713 [0,2,0,0,0,0|2,0,0]=4 10795 B14R1.687 C[C@@H](O)CNCc1ccc(c(c1)F)O 34a_100000758358_100009817552 [0,2,0,0,0,0|2,0,0]=4 10796 B14R1.687 C[C@@H](O)CNCc1ccc(c(c1)O)Cl 34a_100020636435_100009817552 [0,2,0,0,0,0|2,0,0]=4 10797 B14R1.687 C[C@@H](O)CNCc1ccc(c(c1)O)F 34a_100160469508_100009817552 [0,2,0,0,0,0|2,0,0]=4 10798 B14R1.687 C[C@@H](O)CNCc1ccc(c(c1)O)O 34a_100000010075_100009817552 [0,2,0,0,0,0|1,0,0]=3 10799 B14R1.687 Cc1cc(ccc1Br)NCCN(C)C 7a_100000210723_100000755713 [0,2,0,0,0,0|2,0,0]=4 10800 B14R1.687 Cc1cc(ccc1Br)OCCN(C)C 7a_100000690111_100000755713 [0,2,0,0,0,0|2,0,0]=4 10801 B14R1.687 Cc1cc(ccc1Br)SCCN(C)C 62a_100009813585_100000755713 [0,2,0,0,0,0|2,0,0]=4 10802 B14R1.687 Cc1cc(ccc1Cl)NCCN(C)C 7a_100000187808_100000755713 [0,2,0,0,0,0|2,0,0]=4 10803 B14R1.687 Cc1cc(ccc1Cl)OCCN(C)C 7a_100000211092_100000755713 [0,2,0,0,0,0|2,0,0]=4 10804 B14R1.687 Cc1cc(ccc1Cl)SCCN(C)C 62a_100000049509_100000755713 [0,2,0,0,0,0|2,0,0]=4 10805 B14R1.687 Cc1cc(ccc1F)NCCN(C)C 7a_100000750164_100000755713 [0,2,0,0,0,0|2,0,0]=4 10806 B14R1.687 Cc1cc(ccc1F)OCCN(C)C 7a_100000751312_100000755713 [0,2,0,0,0,0|2,0,0]=4 10807 B14R1.687 Cc1cc(ccc1F)SCCN(C)C 62a_100011218330_100000755713 [0,2,0,0,0,0|2,0,0]=4 10808 B14R1.687 Cc1cc(ccc1I)NCCN(C)C 7a_100000198070_100000755713 [0,2,0,0,0,0|2,0,0]=4 10809 B14R1.687 Cc1cc(ccc1I)OCCN(C)C 7a_100000729255_100000755713 [0,2,0,0,0,0|2,0,0]=4 10810 B14R1.687 Cc1cc(ccc1N)OCCN(C)C 7a_100000756630_100000755713 [0,2,0,0,0,0|2,0,0]=4 10811 B14R1.687 Cc1cc(ccc1N)SCCN(C)C 62a_100000211769_100000755713 [0,2,0,0,0,0|2,0,0]=4 10812 B14R1.687 Cc1cc(ccc1O)NCCC(C)C 34a_100011218179_100000210312 [0,2,0,0,0,0|2,0,0]=4 10813 B14R1.687 Cc1cc(ccc1O)NCCC(C)C 7a_100011218179_100000210626 [0,2,0,0,0,0|2,0,0]=4 10814 B14R1.687 Cc1cc(ccc1O)NCCC(C)O 34a_100011218179_100012276601 [0,2,0,0,0,0|2,0,0]=4 10815 B14R1.687 Cc1cc(ccc1O)NCCC(C)O 7a_100011218179_100012276601 [0,2,0,0,0,0|2,0,0]=4 10816 B14R1.687 Cc1cc(ccc1O)NCCN(C)C 7a_100011218179_100000755713 [0,2,0,0,0,0|1,0,0]=3 10817 B14R1.687 Cc1cc(ccc1O)SCCC(C)C 62a_100000210312_100000186361 [0,2,0,0,0,0|2,0,0]=4 10818 B14R1.687 Cc1cc(ccc1O)SCCC(C)O 62a_100012276601_100000186361 [0,2,0,0,0,0|2,0,0]=4 10819 B14R1.687 Cc1cc(cnc1O)SCCN(C)C 62a_100000685391_100000755713 [0,2,0,0,0,0|2,0,0]=4 10820 B14R1.687 Cc1ccc(cc1Br)NCCN(C)C 7a_100000736455_100000755713 [0,2,0,0,0,0|2,0,0]=4 10821 B14R1.687 Cc1ccc(cc1Br)OCCN(C)C 7a_100011380479_100000755713 [0,2,0,0,0,0|2,0,0]=4 10822 B14R1.687 Cc1ccc(cc1Br)SCCN(C)C 62a_100011847877_100000755713 [0,2,0,0,0,0|2,0,0]=4 10823 B14R1.687 Cc1ccc(cc1C)CCNC(C)C 2230a_100020591374_100000210206 [0,2,0,0,0,0|2,0,0]=4 10824 B14R1.687 Cc1ccc(cc1C)CCNC(C)C 34a_100020591374_100000210206 [0,2,0,0,0,0|2,0,0]=4 10825 B14R1.687 Cc1ccc(cc1C)NCCN(C)C 7a_100000724040_100000755713 [0,2,0,0,0,0|2,0,0]=4 10826 B14R1.687 Cc1ccc(cc1C)OCCN(C)C 2230a_100102631434_200011210794 [0,2,0,0,0,0|2,0,0]=4 10827 B14R1.687 Cc1ccc(cc1C)OCCN(C)C 269982a_100102631434_200011210794 [0,2,0,0,0,0|2,0,0]=4 10828 B14R1.687 Cc1ccc(cc1C)OCCN(C)C 7a_100000210932_100000755713 [0,2,0,0,0,0|2,0,0]=4 10829 B14R1.687 Cc1ccc(cc1C)SCCN(C)C 62a_100011215607_100000755713 [0,2,0,0,0,0|2,0,0]=4 10830 B14R1.687 Cc1ccc(cc1Cl)NCCN(C)C 7a_100000188892_100000755713 [0,2,0,0,0,0|2,0,0]=4 10831 B14R1.687 Cc1ccc(cc1Cl)OCCN(C)C 7a_100011265682_100000755713 [0,2,0,0,0,0|2,0,0]=4 10832 B14R1.687 Cc1ccc(cc1Cl)SCCN(C)C 62a_100011216363_100000755713 [0,2,0,0,0,0|2,0,0]=4 10833 B14R1.687 Cc1ccc(cc1F)NCCN(C)C 7a_100000210958_100000755713 [0,2,0,0,0,0|2,0,0]=4 10834 B14R1.687 Cc1ccc(cc1F)OCCN(C)C 7a_100000722560_100000755713 [0,2,0,0,0,0|2,0,0]=4 10835 B14R1.687 Cc1ccc(cc1F)SCCN(C)C 62a_100000720648_100000755713 [0,2,0,0,0,0|2,0,0]=4 10836 B14R1.687 Cc1ccc(cc1I)NCCN(C)C 7a_100000184131_100000755713 [0,2,0,0,0,0|2,0,0]=4 10837 B14R1.687 Cc1ccc(cc1N)OCCN(C)C 7a_100011216113_100000755713 [0,2,0,0,0,0|2,0,0]=4 10838 B14R1.687 Cc1ccc(cc1N)SCCN(C)C 62a_100000761890_100000755713 [0,2,0,0,0,0|2,0,0]=4 10839 B14R1.687 Cc1ccc(cc1O)NCCC(C)C 34a_100000759471_100000210312 [0,2,0,0,0,0|2,0,0]=4 10840 B14R1.687 Cc1ccc(cc1O)NCCC(C)C 7a_100000759471_100000210626 [0,2,0,0,0,0|2,0,0]=4 10841 B14R1.687 Cc1ccc(cc1O)NCCC(C)O 34a_100000759471_100012276601 [0,2,0,0,0,0|2,0,0]=4 10842 B14R1.687 Cc1ccc(cc1O)NCCC(C)O 7a_100000759471_100012276601 [0,2,0,0,0,0|2,0,0]=4 10843 B14R1.687 Cc1ccc(cc1O)NCCN(C)C 7a_100000759471_100000755713 [0,2,0,0,0,0|1,0,0]=3 10844 B14R1.687 Cc1ccc(cc1O)SCCC(C)C 62a_100000210312_100000685420 [0,2,0,0,0,0|2,0,0]=4 10845 B14R1.687 Cc1ccc(cc1O)SCCC(C)C 62a_100000685420_100000210312 [0,2,0,0,0,0|2,0,0]=4 10846 B14R1.687 Cc1ccc(cc1O)SCCC(C)O 62a_100000685420_100012276601 [0,2,0,0,0,0|2,0,0]=4 10847 B14R1.687 Cc1ccc(cc1O)SCCC(C)O 62a_100012276601_100000685420 [0,2,0,0,0,0|2,0,0]=4 10848 B14R1.687 Cc1ccc(cc1O)SCCN(C)C 62a_100000685420_100000755713 [0,2,0,0,0,0|1,0,0]=3 10849 B14R1.687 Cc1cnc(cc1O)SCCN(C)C 62a_100000704368_100000755713 [0,2,0,0,0,0|2,0,0]=4 10850 B14R1.687 Cc1nc(ccc1O)SCCN(C)C 62a_100010233687_100000755713 [0,2,0,0,0,0|2,0,0]=4 10851 B14R1.687 Cc1ncc(cc1O)SCCN(C)C 62a_100009864810_100000755713 [0,2,0,0,0,0|2,0,0]=4 10852 B14R1.687 NC(=O)CCNc1ccc(c(c1)O)O 34a_100102946323_100000731001 [0,2,0,0,0,0|2,0,0]=4 10853 B14R1.687 NC(=O)CCSc1ccc(c(c1)O)O 62a_100000744528_100009813601 [0,2,0,0,0,0|2,0,0]=4 10854 B14R1.687 NC(=O)CNCc1ccc(c(c1)O)O 34a_100000010075_100000187820 [0,2,0,0,0,0|2,0,0]=4 10855 B14R1.687 O=C([O-])CNCc1ccc(c(c1)O)O 34a_100000010075_100020667443 [0,2,0,0,0,0|2,0,0]=4 10856 B14R1.687 O=[N+]([O-])CNCc1ccc(c(c1)O)O 34a_100000010075_100000761209 [0,2,0,0,0,0|1,0,1]=4 10857 B14R1.687 Oc1ccc(cc1O)CNCC(F)F 34a_100000010075_100011934356 [0,2,0,0,0,0|2,0,0]=4 10858 B14R1.967 C#CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000184674 [0,2,0,0,0,0|1,0,1]=4 10859 B14R1.967 C=CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210623 [0,2,0,0,0,0|1,0,1]=4 10860 B14R1.967 CC(CC#N)Sc1ccc(c(c1)O)O 62a_100009813641_100009813601 [0,2,0,0,0,0|2,0,0]=4 10861 B14R1.967 CC(CCO)Nc1ccc(c(c1)O)O 34a_100102946323_100009893172 [0,2,0,0,0,0|2,0,0]=4 10862 B14R1.967 CC(CCO)Sc1ccc(c(c1)O)O 62a_100009893172_100009813601 [0,2,0,0,0,0|2,0,0]=4 10863 B14R1.967 CCCC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_100000210303 [0,2,0,0,0,0|2,0,0]=4 10864 B14R1.967 CCCC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_100000210303 [0,2,0,0,0,0|2,0,0]=4 10865 B14R1.967 CCCC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_100000210303 [0,2,0,0,0,0|2,0,0]=4 10866 B14R1.967 CCCC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_100000210303 [0,2,0,0,0,0|2,0,0]=4 10867 B14R1.967 CCCC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_100000210303 [0,2,0,0,0,0|2,0,0]=4 10868 B14R1.967 CCCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100000210303 [0,2,0,0,0,0|1,0,0]=3 10869 B14R1.967 CCCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000211992 [0,2,0,0,0,0|1,0,1]=4 10870 B14R1.967 CCCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000211992 [0,2,0,0,0,0|1,0,1]=4 10871 B14R1.967 CCCC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000766640 [0,2,0,0,0,0|2,0,0]=4 10872 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)O 34a_100011218179_100000766640 [0,2,0,0,0,0|2,0,0]=4 10873 B14R1.967 CCCC(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000766640 [0,2,0,0,0,0|2,0,0]=4 10874 B14R1.967 CCCC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000766640 [0,2,0,0,0,0|2,0,0]=4 10875 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000766640 [0,2,0,0,0,0|2,0,0]=4 10876 B14R1.967 CCCC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000766640 [0,2,0,0,0,0|2,0,0]=4 10877 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)C 34a_100000759471_100000766640 [0,2,0,0,0,0|2,0,0]=4 10878 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000766640 [0,2,0,0,0,0|2,0,0]=4 10879 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000766640 [0,2,0,0,0,0|2,0,0]=4 10880 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000766640 [0,2,0,0,0,0|2,0,0]=4 10881 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000766640 [0,2,0,0,0,0|2,0,0]=4 10882 B14R1.967 CCCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000766640 [0,2,0,0,0,0|1,0,0]=3 10883 B14R1.967 CCCC(C)Sc1ccc(c(c1)Br)O 62a_100000766640_100012361655 [0,2,0,0,0,0|2,0,0]=4 10884 B14R1.967 CCCC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000766640 [0,2,0,0,0,0|2,0,0]=4 10885 B14R1.967 CCCC(C)Sc1ccc(c(c1)C)O 62a_100000766640_100000186361 [0,2,0,0,0,0|2,0,0]=4 10886 B14R1.967 CCCC(C)Sc1ccc(c(c1)Cl)O 62a_100000766640_100012360047 [0,2,0,0,0,0|2,0,0]=4 10887 B14R1.967 CCCC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000766640 [0,2,0,0,0,0|2,0,0]=4 10888 B14R1.967 CCCC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000766640 [0,2,0,0,0,0|2,0,0]=4 10889 B14R1.967 CCCC(C)Sc1ccc(c(c1)F)O 62a_100000766640_100000185481 [0,2,0,0,0,0|2,0,0]=4 10890 B14R1.967 CCCC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000766640 [0,2,0,0,0,0|2,0,0]=4 10891 B14R1.967 CCCC(C)Sc1ccc(c(c1)N)O 62a_100000766640_100000752626 [0,2,0,0,0,0|2,0,0]=4 10892 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)Br 62a_100000766640_100012356990 [0,2,0,0,0,0|2,0,0]=4 10893 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000766640 [0,2,0,0,0,0|2,0,0]=4 10894 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)C 62a_100000685420_100000766640 [0,2,0,0,0,0|2,0,0]=4 10895 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)C 62a_100000766640_100000685420 [0,2,0,0,0,0|2,0,0]=4 10896 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)Cl 62a_100000766640_100011356854 [0,2,0,0,0,0|2,0,0]=4 10897 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000766640 [0,2,0,0,0,0|2,0,0]=4 10898 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000766640 [0,2,0,0,0,0|2,0,0]=4 10899 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)F 62a_100000766640_100000686035 [0,2,0,0,0,0|2,0,0]=4 10900 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000766640 [0,2,0,0,0,0|2,0,0]=4 10901 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)N 62a_100000766640_100000739049 [0,2,0,0,0,0|2,0,0]=4 10902 B14R1.967 CCCC(C)Sc1ccc(c(c1)O)O 62a_100000766640_100009813601 [0,2,0,0,0,0|1,0,0]=3 10903 B14R1.967 CCNC(=O)Cc1ccc(c(c1)Br)O 240690a_100015525214_100009990404 [0,2,0,0,0,0|1,0,1]=4 10904 B14R1.967 CCNC(=O)Cc1ccc(c(c1)Br)O 527a_100015525214_100009990404 [0,2,0,0,0,0|1,0,1]=4 10905 B14R1.967 CCNC(=O)Cc1ccc(c(c1)C)O 240690a_100015525214_100000083968 [0,2,0,0,0,0|1,0,1]=4 10906 B14R1.967 CCNC(=O)Cc1ccc(c(c1)C)O 527a_100015525214_100000083968 [0,2,0,0,0,0|1,0,1]=4 10907 B14R1.967 CCNC(=O)Cc1ccc(c(c1)Cl)O 240690a_100015525214_100000035197 [0,2,0,0,0,0|1,0,1]=4 10908 B14R1.967 CCNC(=O)Cc1ccc(c(c1)Cl)O 527a_100015525214_100000035197 [0,2,0,0,0,0|1,0,1]=4 10909 B14R1.967 CCNC(=O)Cc1ccc(c(c1)F)O 240690a_100015525214_100000039761 [0,2,0,0,0,0|1,0,1]=4 10910 B14R1.967 CCNC(=O)Cc1ccc(c(c1)F)O 527a_100015525214_100000039761 [0,2,0,0,0,0|1,0,1]=4 10911 B14R1.967 CCNC(=O)Cc1ccc(c(c1)O)C 11a_100015525214_100000082272 [0,2,0,0,0,0|1,0,1]=4 10912 B14R1.967 CCNC(=O)Cc1ccc(c(c1)O)C 240690a_100015525214_100000082272 [0,2,0,0,0,0|1,0,1]=4 10913 B14R1.967 CCNC(=O)Cc1ccc(c(c1)O)C 527a_100015525214_100000082272 [0,2,0,0,0,0|1,0,1]=4 10914 B14R1.967 CCNC(=O)Cc1ccc(c(c1)O)O 527a_100015525214_100000031429 [0,2,0,0,0,0|0,0,1]=3 10915 B14R1.967 CCNC(=O)Nc1ccc(c(c1)O)O 2430a_100102946323_100015525214 [0,2,0,0,0,0|1,0,1]=4 10916 B14R1.967 CCNC(C)Cc1ccc(c(c1)Cl)Cl 270004a_100015525214_100011586667 [0,2,0,0,0,0|2,0,0]=4 10917 B14R1.967 CCOC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010222481 [0,2,0,0,0,0|1,0,1]=4 10918 B14R1.967 CNNC(=O)Cc1ccc(c(c1)Br)O 22a_100016993582_100009990404 [0,2,0,0,0,0|1,0,1]=4 10919 B14R1.967 CNNC(=O)Cc1ccc(c(c1)C)O 22a_100016993582_100000083968 [0,2,0,0,0,0|1,0,1]=4 10920 B14R1.967 CNNC(=O)Cc1ccc(c(c1)Cl)O 22a_100016993582_100000035197 [0,2,0,0,0,0|1,0,1]=4 10921 B14R1.967 CNNC(=O)Cc1ccc(c(c1)F)O 22a_100016993582_100000039761 [0,2,0,0,0,0|1,0,1]=4 10922 B14R1.967 CNNC(=O)Cc1ccc(c(c1)O)C 22a_100016993582_100000082272 [0,2,0,0,0,0|1,0,1]=4 10923 B14R1.967 CNNC(=O)Cc1ccc(c(c1)O)O 22a_100016993582_100000031429 [0,2,0,0,0,0|0,0,1]=3 10924 B14R1.967 COCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210968 [0,2,0,0,0,0|1,0,1]=4 10925 B14R1.967 COCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000210968 [0,2,0,0,0,0|1,0,1]=4 10926 B14R1.967 COCC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000765312 [0,2,0,0,0,0|2,0,0]=4 10927 B14R1.967 COCC(C)Nc1ccc(c(c1)C)O 34a_100011218179_100000765312 [0,2,0,0,0,0|2,0,0]=4 10928 B14R1.967 COCC(C)Nc1ccc(c(c1)C)O 7a_100011218179_100000765312 [0,2,0,0,0,0|2,0,0]=4 10929 B14R1.967 COCC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000765312 [0,2,0,0,0,0|2,0,0]=4 10930 B14R1.967 COCC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000765312 [0,2,0,0,0,0|2,0,0]=4 10931 B14R1.967 COCC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000765312 [0,2,0,0,0,0|2,0,0]=4 10932 B14R1.967 COCC(C)Nc1ccc(c(c1)O)C 34a_100000759471_100000765312 [0,2,0,0,0,0|2,0,0]=4 10933 B14R1.967 COCC(C)Nc1ccc(c(c1)O)C 7a_100000759471_100000765312 [0,2,0,0,0,0|2,0,0]=4 10934 B14R1.967 COCC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000765312 [0,2,0,0,0,0|2,0,0]=4 10935 B14R1.967 COCC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000765312 [0,2,0,0,0,0|2,0,0]=4 10936 B14R1.967 COCC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000765312 [0,2,0,0,0,0|2,0,0]=4 10937 B14R1.967 COCC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000765312 [0,2,0,0,0,0|1,0,0]=3 10938 B14R1.967 COCC(C)Sc1ccc(c(c1)Br)O 62a_100000765312_100012361655 [0,2,0,0,0,0|2,0,0]=4 10939 B14R1.967 COCC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000765312 [0,2,0,0,0,0|2,0,0]=4 10940 B14R1.967 COCC(C)Sc1ccc(c(c1)C)O 62a_100000765312_100000186361 [0,2,0,0,0,0|2,0,0]=4 10941 B14R1.967 COCC(C)Sc1ccc(c(c1)Cl)O 62a_100000765312_100012360047 [0,2,0,0,0,0|2,0,0]=4 10942 B14R1.967 COCC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000765312 [0,2,0,0,0,0|2,0,0]=4 10943 B14R1.967 COCC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000765312 [0,2,0,0,0,0|2,0,0]=4 10944 B14R1.967 COCC(C)Sc1ccc(c(c1)F)O 62a_100000765312_100000185481 [0,2,0,0,0,0|2,0,0]=4 10945 B14R1.967 COCC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000765312 [0,2,0,0,0,0|2,0,0]=4 10946 B14R1.967 COCC(C)Sc1ccc(c(c1)N)O 62a_100000765312_100000752626 [0,2,0,0,0,0|2,0,0]=4 10947 B14R1.967 COCC(C)Sc1ccc(c(c1)O)Br 62a_100000765312_100012356990 [0,2,0,0,0,0|2,0,0]=4 10948 B14R1.967 COCC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000765312 [0,2,0,0,0,0|2,0,0]=4 10949 B14R1.967 COCC(C)Sc1ccc(c(c1)O)C 62a_100000685420_100000765312 [0,2,0,0,0,0|2,0,0]=4 10950 B14R1.967 COCC(C)Sc1ccc(c(c1)O)C 62a_100000765312_100000685420 [0,2,0,0,0,0|2,0,0]=4 10951 B14R1.967 COCC(C)Sc1ccc(c(c1)O)Cl 62a_100000765312_100011356854 [0,2,0,0,0,0|2,0,0]=4 10952 B14R1.967 COCC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000765312 [0,2,0,0,0,0|2,0,0]=4 10953 B14R1.967 COCC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000765312 [0,2,0,0,0,0|2,0,0]=4 10954 B14R1.967 COCC(C)Sc1ccc(c(c1)O)F 62a_100000765312_100000686035 [0,2,0,0,0,0|2,0,0]=4 10955 B14R1.967 COCC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000765312 [0,2,0,0,0,0|2,0,0]=4 10956 B14R1.967 COCC(C)Sc1ccc(c(c1)O)N 62a_100000765312_100000739049 [0,2,0,0,0,0|2,0,0]=4 10957 B14R1.967 COCC(C)Sc1ccc(c(c1)O)O 62a_100000765312_100009813601 [0,2,0,0,0,0|1,0,0]=3 10958 B14R1.967 CSCC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000184570 [0,2,0,0,0,0|1,0,1]=4 10959 B14R1.967 CSCC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100000184570 [0,2,0,0,0,0|1,0,1]=4 10960 B14R1.967 N#CCC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_100011214920 [0,2,0,0,0,0|2,0,0]=4 10961 B14R1.967 O=C(CCF)Cc1ccc(c(c1)O)O 1458a_100000031429_100011217306 [0,2,0,0,0,0|1,0,1]=4 10962 B14R1.967 O=C(CCO)Cc1ccc(c(c1)O)O 1458a_100000031429_100000211926 [0,2,0,0,0,0|1,0,1]=4 10963 B14R1.3621 CCCCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000210210 [0,2,0,0,0,0|2,0,0]=4 10964 B14R1.3621 CCCCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000210211 [0,2,0,0,0,0|2,0,0]=4 10965 B14R1.3621 CCCCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000210210 [0,2,0,0,0,0|2,0,0]=4 10966 B14R1.3621 CCCCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000210211 [0,2,0,0,0,0|2,0,0]=4 10967 B14R1.3621 CCCCNc1cc(c(cc1C)O)C 34a_100000720036_100000210210 [0,2,0,0,0,0|2,0,0]=4 10968 B14R1.3621 CCCCNc1cc(c(cc1C)O)C 7a_100000720036_100000210211 [0,2,0,0,0,0|2,0,0]=4 10969 B14R1.3621 CCCCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000210210 [0,2,0,0,0,0|2,0,0]=4 10970 B14R1.3621 CCCCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000210211 [0,2,0,0,0,0|2,0,0]=4 10971 B14R1.3621 CCCCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000210210 [0,2,0,0,0,0|2,0,0]=4 10972 B14R1.3621 CCCCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000210211 [0,2,0,0,0,0|2,0,0]=4 10973 B14R1.3621 CCCCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000210210 [0,2,0,0,0,0|2,0,0]=4 10974 B14R1.3621 CCCCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000210211 [0,2,0,0,0,0|2,0,0]=4 10975 B14R1.3621 CCCCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000210210 [0,2,0,0,0,0|2,0,0]=4 10976 B14R1.3621 CCCCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000210211 [0,2,0,0,0,0|2,0,0]=4 10977 B14R1.3621 CCCCNc1cc(c(cc1F)C)O 34a_100000117193_100000210210 [0,2,0,0,0,0|2,0,0]=4 10978 B14R1.3621 CCCCNc1cc(c(cc1F)C)O 7a_100000117193_100000210211 [0,2,0,0,0,0|2,0,0]=4 10979 B14R1.3621 CCCCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000210210 [0,2,0,0,0,0|2,0,0]=4 10980 B14R1.3621 CCCCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000210211 [0,2,0,0,0,0|2,0,0]=4 10981 B14R1.3621 CCCCNc1cc(c(cc1F)F)O 34a_100011219470_100000210210 [0,2,0,0,0,0|2,0,0]=4 10982 B14R1.3621 CCCCNc1cc(c(cc1F)F)O 7a_100011219470_100000210211 [0,2,0,0,0,0|2,0,0]=4 10983 B14R1.3621 CCCCNc1cc(c(cc1F)O)F 34a_100020635945_100000210210 [0,2,0,0,0,0|2,0,0]=4 10984 B14R1.3621 CCCCNc1cc(c(cc1F)O)F 7a_100020635945_100000210211 [0,2,0,0,0,0|2,0,0]=4 10985 B14R1.3621 CCCCSc1cc(c(cc1Br)Cl)O 62a_100000210211_100021297947 [0,2,0,0,0,0|2,0,0]=4 10986 B14R1.3621 CCCCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000210210 [0,2,0,0,0,0|2,0,0]=4 10987 B14R1.3621 CCCCSc1cc(c(cc1C)F)O 62a_100000210211_100010068922 [0,2,0,0,0,0|2,0,0]=4 10988 B14R1.3621 CCCCSc1cc(c(cc1C)F)O 62a_100010068922_100000210210 [0,2,0,0,0,0|2,0,0]=4 10989 B14R1.3621 CCCCSc1cc(c(cc1C)N)O 62a_100000210211_200010107346 [0,2,0,0,0,0|2,0,0]=4 10990 B14R1.3621 CCCCSc1cc(c(cc1C)N)O 62a_200010107346_100000210210 [0,2,0,0,0,0|2,0,0]=4 10991 B14R1.3621 CCCCSc1cc(c(cc1C)O)C 62a_100000210211_100000698207 [0,2,0,0,0,0|2,0,0]=4 10992 B14R1.3621 CCCCSc1cc(c(cc1C)O)C 62a_100000698207_100000210210 [0,2,0,0,0,0|2,0,0]=4 10993 B14R1.3621 CCCCSc1cc(c(cc1C)O)F 62a_100000210211_100012355673 [0,2,0,0,0,0|2,0,0]=4 10994 B14R1.3621 CCCCSc1cc(c(cc1C)O)F 62a_100012355673_100000210210 [0,2,0,0,0,0|2,0,0]=4 10995 B14R1.3621 CCCCSc1cc(c(cc1C)O)N 62a_100000210211_200010235796 [0,2,0,0,0,0|2,0,0]=4 10996 B14R1.3621 CCCCSc1cc(c(cc1C)O)N 62a_200010235796_100000210210 [0,2,0,0,0,0|2,0,0]=4 10997 B14R1.3621 CCCCSc1cc(c(cc1Cl)O)N 62a_100000210211_100011011175 [0,2,0,0,0,0|2,0,0]=4 10998 B14R1.3621 CCCCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000210210 [0,2,0,0,0,0|2,0,0]=4 10999 B14R1.3621 CCCCSc1cc(c(cc1F)C)O 62a_100000210211_100014242602 [0,2,0,0,0,0|2,0,0]=4 11000 B14R1.3621 CCCCSc1cc(c(cc1F)C)O 62a_100014242602_100000210210 [0,2,0,0,0,0|2,0,0]=4 11001 B14R1.3621 CCCCSc1cc(c(cc1F)Cl)O 62a_100000210211_100010735246 [0,2,0,0,0,0|2,0,0]=4 11002 B14R1.3621 CCCCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000210210 [0,2,0,0,0,0|2,0,0]=4 11003 B14R1.3621 CCCCSc1cc(c(cc1F)F)O 62a_100000210211_100012457948 [0,2,0,0,0,0|2,0,0]=4 11004 B14R1.3621 CCCCSc1cc(c(cc1F)F)O 62a_100012457948_100000210210 [0,2,0,0,0,0|2,0,0]=4 11005 B14R1.3621 CCCCSc1cc(c(cc1F)N)O 62a_100000210211_100013038943 [0,2,0,0,0,0|2,0,0]=4 11006 B14R1.3621 CCCCSc1cc(c(cc1F)N)O 62a_100013038943_100000210210 [0,2,0,0,0,0|2,0,0]=4 11007 B14R1.3621 CCCCSc1cc(c(cc1F)O)F 62a_100000210211_100011830439 [0,2,0,0,0,0|2,0,0]=4 11008 B14R1.3621 CCCCSc1cc(c(cc1F)O)F 62a_100011830439_100000210210 [0,2,0,0,0,0|2,0,0]=4 11009 B14R1.3621 CCCCSc1cc(c(cc1F)O)N 62a_100000210211_100012359894 [0,2,0,0,0,0|2,0,0]=4 11010 B14R1.3621 CCCCSc1cc(c(cc1F)O)N 62a_100012359894_100000210210 [0,2,0,0,0,0|2,0,0]=4 11011 B14R1.3621 CCNN=Cc1cc(c(cc1O)O)O 4a_100000756455_100000042415 [0,2,0,0,0,0|1,0,1]=4 11012 B14R1.3621 COCCNc1cc(c(cc1Br)O)Br 34a_100011080774_100011201679 [0,2,0,0,0,0|2,0,0]=4 11013 B14R1.3621 COCCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000233755 [0,2,0,0,0,0|2,0,0]=4 11014 B14R1.3621 COCCNc1cc(c(cc1C)Cl)O 34a_100009961766_100011201679 [0,2,0,0,0,0|2,0,0]=4 11015 B14R1.3621 COCCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000233755 [0,2,0,0,0,0|2,0,0]=4 11016 B14R1.3621 COCCNc1cc(c(cc1C)O)C 34a_100000720036_100011201679 [0,2,0,0,0,0|2,0,0]=4 11017 B14R1.3621 COCCNc1cc(c(cc1C)O)C 7a_100000720036_100000233755 [0,2,0,0,0,0|2,0,0]=4 11018 B14R1.3621 COCCNc1cc(c(cc1Cl)C)O 34a_100000092876_100011201679 [0,2,0,0,0,0|2,0,0]=4 11019 B14R1.3621 COCCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000233755 [0,2,0,0,0,0|2,0,0]=4 11020 B14R1.3621 COCCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100011201679 [0,2,0,0,0,0|2,0,0]=4 11021 B14R1.3621 COCCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000233755 [0,2,0,0,0,0|2,0,0]=4 11022 B14R1.3621 COCCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100011201679 [0,2,0,0,0,0|2,0,0]=4 11023 B14R1.3621 COCCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000233755 [0,2,0,0,0,0|2,0,0]=4 11024 B14R1.3621 COCCNc1cc(c(cc1Cl)O)F 34a_100009886023_100011201679 [0,2,0,0,0,0|2,0,0]=4 11025 B14R1.3621 COCCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000233755 [0,2,0,0,0,0|2,0,0]=4 11026 B14R1.3621 COCCNc1cc(c(cc1F)C)O 34a_100000117193_100011201679 [0,2,0,0,0,0|2,0,0]=4 11027 B14R1.3621 COCCNc1cc(c(cc1F)C)O 7a_100000117193_100000233755 [0,2,0,0,0,0|2,0,0]=4 11028 B14R1.3621 COCCNc1cc(c(cc1F)Cl)O 34a_100000042052_100011201679 [0,2,0,0,0,0|2,0,0]=4 11029 B14R1.3621 COCCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000233755 [0,2,0,0,0,0|2,0,0]=4 11030 B14R1.3621 COCCNc1cc(c(cc1F)F)O 34a_100011219470_100011201679 [0,2,0,0,0,0|2,0,0]=4 11031 B14R1.3621 COCCNc1cc(c(cc1F)F)O 7a_100011219470_100000233755 [0,2,0,0,0,0|2,0,0]=4 11032 B14R1.3621 COCCNc1cc(c(cc1F)O)F 34a_100020635945_100011201679 [0,2,0,0,0,0|2,0,0]=4 11033 B14R1.3621 COCCNc1cc(c(cc1F)O)F 7a_100020635945_100000233755 [0,2,0,0,0,0|2,0,0]=4 11034 B14R1.3621 COCCSc1cc(c(cc1Br)Cl)O 62a_100000233755_100021297947 [0,2,0,0,0,0|2,0,0]=4 11035 B14R1.3621 COCCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000233755 [0,2,0,0,0,0|2,0,0]=4 11036 B14R1.3621 COCCSc1cc(c(cc1C)F)O 62a_100000233755_100010068922 [0,2,0,0,0,0|2,0,0]=4 11037 B14R1.3621 COCCSc1cc(c(cc1C)F)O 62a_100010068922_100000233755 [0,2,0,0,0,0|2,0,0]=4 11038 B14R1.3621 COCCSc1cc(c(cc1C)N)O 62a_100000233755_200010107346 [0,2,0,0,0,0|2,0,0]=4 11039 B14R1.3621 COCCSc1cc(c(cc1C)N)O 62a_200010107346_100000233755 [0,2,0,0,0,0|2,0,0]=4 11040 B14R1.3621 COCCSc1cc(c(cc1C)O)C 62a_100000233755_100000698207 [0,2,0,0,0,0|2,0,0]=4 11041 B14R1.3621 COCCSc1cc(c(cc1C)O)C 62a_100000698207_100000233755 [0,2,0,0,0,0|2,0,0]=4 11042 B14R1.3621 COCCSc1cc(c(cc1C)O)F 62a_100000233755_100012355673 [0,2,0,0,0,0|2,0,0]=4 11043 B14R1.3621 COCCSc1cc(c(cc1C)O)F 62a_100012355673_100000233755 [0,2,0,0,0,0|2,0,0]=4 11044 B14R1.3621 COCCSc1cc(c(cc1C)O)N 62a_100000233755_200010235796 [0,2,0,0,0,0|2,0,0]=4 11045 B14R1.3621 COCCSc1cc(c(cc1C)O)N 62a_200010235796_100000233755 [0,2,0,0,0,0|2,0,0]=4 11046 B14R1.3621 COCCSc1cc(c(cc1Cl)O)N 62a_100000233755_100011011175 [0,2,0,0,0,0|2,0,0]=4 11047 B14R1.3621 COCCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000233755 [0,2,0,0,0,0|2,0,0]=4 11048 B14R1.3621 COCCSc1cc(c(cc1F)C)O 62a_100000233755_100014242602 [0,2,0,0,0,0|2,0,0]=4 11049 B14R1.3621 COCCSc1cc(c(cc1F)C)O 62a_100014242602_100000233755 [0,2,0,0,0,0|2,0,0]=4 11050 B14R1.3621 COCCSc1cc(c(cc1F)Cl)O 62a_100000233755_100010735246 [0,2,0,0,0,0|2,0,0]=4 11051 B14R1.3621 COCCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000233755 [0,2,0,0,0,0|2,0,0]=4 11052 B14R1.3621 COCCSc1cc(c(cc1F)F)O 62a_100000233755_100012457948 [0,2,0,0,0,0|2,0,0]=4 11053 B14R1.3621 COCCSc1cc(c(cc1F)F)O 62a_100012457948_100000233755 [0,2,0,0,0,0|2,0,0]=4 11054 B14R1.3621 COCCSc1cc(c(cc1F)N)O 62a_100000233755_100013038943 [0,2,0,0,0,0|2,0,0]=4 11055 B14R1.3621 COCCSc1cc(c(cc1F)N)O 62a_100013038943_100000233755 [0,2,0,0,0,0|2,0,0]=4 11056 B14R1.3621 COCCSc1cc(c(cc1F)O)F 62a_100000233755_100011830439 [0,2,0,0,0,0|2,0,0]=4 11057 B14R1.3621 COCCSc1cc(c(cc1F)O)F 62a_100011830439_100000233755 [0,2,0,0,0,0|2,0,0]=4 11058 B14R1.3621 COCCSc1cc(c(cc1F)O)N 62a_100000233755_100012359894 [0,2,0,0,0,0|2,0,0]=4 11059 B14R1.3621 COCCSc1cc(c(cc1F)O)N 62a_100012359894_100000233755 [0,2,0,0,0,0|2,0,0]=4 11060 B14R1.3621 CSCCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000212216 [0,2,0,0,0,0|2,0,0]=4 11061 B14R1.3621 CSCCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000212216 [0,2,0,0,0,0|2,0,0]=4 11062 B14R1.3621 CSCCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000212216 [0,2,0,0,0,0|2,0,0]=4 11063 B14R1.3621 CSCCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000212216 [0,2,0,0,0,0|2,0,0]=4 11064 B14R1.3621 CSCCNc1cc(c(cc1C)O)C 34a_100000720036_100000212216 [0,2,0,0,0,0|2,0,0]=4 11065 B14R1.3621 CSCCNc1cc(c(cc1C)O)C 7a_100000720036_100000212216 [0,2,0,0,0,0|2,0,0]=4 11066 B14R1.3621 CSCCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000212216 [0,2,0,0,0,0|2,0,0]=4 11067 B14R1.3621 CSCCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000212216 [0,2,0,0,0,0|2,0,0]=4 11068 B14R1.3621 CSCCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000212216 [0,2,0,0,0,0|2,0,0]=4 11069 B14R1.3621 CSCCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000212216 [0,2,0,0,0,0|2,0,0]=4 11070 B14R1.3621 CSCCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000212216 [0,2,0,0,0,0|2,0,0]=4 11071 B14R1.3621 CSCCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000212216 [0,2,0,0,0,0|2,0,0]=4 11072 B14R1.3621 CSCCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000212216 [0,2,0,0,0,0|2,0,0]=4 11073 B14R1.3621 CSCCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000212216 [0,2,0,0,0,0|2,0,0]=4 11074 B14R1.3621 CSCCNc1cc(c(cc1F)C)O 34a_100000117193_100000212216 [0,2,0,0,0,0|2,0,0]=4 11075 B14R1.3621 CSCCNc1cc(c(cc1F)C)O 7a_100000117193_100000212216 [0,2,0,0,0,0|2,0,0]=4 11076 B14R1.3621 CSCCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000212216 [0,2,0,0,0,0|2,0,0]=4 11077 B14R1.3621 CSCCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000212216 [0,2,0,0,0,0|2,0,0]=4 11078 B14R1.3621 CSCCNc1cc(c(cc1F)F)O 34a_100011219470_100000212216 [0,2,0,0,0,0|2,0,0]=4 11079 B14R1.3621 CSCCNc1cc(c(cc1F)F)O 7a_100011219470_100000212216 [0,2,0,0,0,0|2,0,0]=4 11080 B14R1.3621 CSCCNc1cc(c(cc1F)O)F 34a_100020635945_100000212216 [0,2,0,0,0,0|2,0,0]=4 11081 B14R1.3621 CSCCNc1cc(c(cc1F)O)F 7a_100020635945_100000212216 [0,2,0,0,0,0|2,0,0]=4 11082 B14R1.3621 CSCCSc1cc(c(cc1Br)Cl)O 62a_100000212216_100021297947 [0,2,0,0,0,0|2,0,0]=4 11083 B14R1.3621 CSCCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000751147 [0,2,0,0,0,0|2,0,0]=4 11084 B14R1.3621 CSCCSc1cc(c(cc1C)F)O 62a_100000212216_100010068922 [0,2,0,0,0,0|2,0,0]=4 11085 B14R1.3621 CSCCSc1cc(c(cc1C)F)O 62a_100010068922_100000751147 [0,2,0,0,0,0|2,0,0]=4 11086 B14R1.3621 CSCCSc1cc(c(cc1C)N)O 62a_100000212216_200010107346 [0,2,0,0,0,0|2,0,0]=4 11087 B14R1.3621 CSCCSc1cc(c(cc1C)N)O 62a_200010107346_100000751147 [0,2,0,0,0,0|2,0,0]=4 11088 B14R1.3621 CSCCSc1cc(c(cc1C)O)C 62a_100000212216_100000698207 [0,2,0,0,0,0|2,0,0]=4 11089 B14R1.3621 CSCCSc1cc(c(cc1C)O)C 62a_100000698207_100000751147 [0,2,0,0,0,0|2,0,0]=4 11090 B14R1.3621 CSCCSc1cc(c(cc1C)O)F 62a_100000212216_100012355673 [0,2,0,0,0,0|2,0,0]=4 11091 B14R1.3621 CSCCSc1cc(c(cc1C)O)F 62a_100012355673_100000751147 [0,2,0,0,0,0|2,0,0]=4 11092 B14R1.3621 CSCCSc1cc(c(cc1C)O)N 62a_100000212216_200010235796 [0,2,0,0,0,0|2,0,0]=4 11093 B14R1.3621 CSCCSc1cc(c(cc1C)O)N 62a_200010235796_100000751147 [0,2,0,0,0,0|2,0,0]=4 11094 B14R1.3621 CSCCSc1cc(c(cc1Cl)O)N 62a_100000212216_100011011175 [0,2,0,0,0,0|2,0,0]=4 11095 B14R1.3621 CSCCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000751147 [0,2,0,0,0,0|2,0,0]=4 11096 B14R1.3621 CSCCSc1cc(c(cc1F)C)O 62a_100000212216_100014242602 [0,2,0,0,0,0|2,0,0]=4 11097 B14R1.3621 CSCCSc1cc(c(cc1F)C)O 62a_100014242602_100000751147 [0,2,0,0,0,0|2,0,0]=4 11098 B14R1.3621 CSCCSc1cc(c(cc1F)Cl)O 62a_100000212216_100010735246 [0,2,0,0,0,0|2,0,0]=4 11099 B14R1.3621 CSCCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000751147 [0,2,0,0,0,0|2,0,0]=4 11100 B14R1.3621 CSCCSc1cc(c(cc1F)F)O 62a_100000212216_100012457948 [0,2,0,0,0,0|2,0,0]=4 11101 B14R1.3621 CSCCSc1cc(c(cc1F)F)O 62a_100012457948_100000751147 [0,2,0,0,0,0|2,0,0]=4 11102 B14R1.3621 CSCCSc1cc(c(cc1F)N)O 62a_100000212216_100013038943 [0,2,0,0,0,0|2,0,0]=4 11103 B14R1.3621 CSCCSc1cc(c(cc1F)N)O 62a_100013038943_100000751147 [0,2,0,0,0,0|2,0,0]=4 11104 B14R1.3621 CSCCSc1cc(c(cc1F)O)F 62a_100000212216_100011830439 [0,2,0,0,0,0|2,0,0]=4 11105 B14R1.3621 CSCCSc1cc(c(cc1F)O)F 62a_100011830439_100000751147 [0,2,0,0,0,0|2,0,0]=4 11106 B14R1.3621 CSCCSc1cc(c(cc1F)O)N 62a_100000212216_100012359894 [0,2,0,0,0,0|2,0,0]=4 11107 B14R1.3621 CSCCSc1cc(c(cc1F)O)N 62a_100012359894_100000751147 [0,2,0,0,0,0|2,0,0]=4 11108 B14R1.3622 CCCCNc1ccc(c(c1C)C)O 34a_200011216674_100000210210 [0,2,0,0,0,0|2,0,0]=4 11109 B14R1.3622 CCCCNc1ccc(c(c1C)C)O 7a_200011216674_100000210211 [0,2,0,0,0,0|2,0,0]=4 11110 B14R1.3622 CCCCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000210210 [0,2,0,0,0,0|2,0,0]=4 11111 B14R1.3622 CCCCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000210211 [0,2,0,0,0,0|2,0,0]=4 11112 B14R1.3622 CCCCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000210210 [0,2,0,0,0,0|2,0,0]=4 11113 B14R1.3622 CCCCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000210211 [0,2,0,0,0,0|2,0,0]=4 11114 B14R1.3622 CCCCNc1ccc(c(c1F)C)O 34a_200000126710_100000210210 [0,2,0,0,0,0|2,0,0]=4 11115 B14R1.3622 CCCCNc1ccc(c(c1F)C)O 7a_200000126710_100000210211 [0,2,0,0,0,0|2,0,0]=4 11116 B14R1.3622 CCCCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000210210 [0,2,0,0,0,0|2,0,0]=4 11117 B14R1.3622 CCCCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000210211 [0,2,0,0,0,0|2,0,0]=4 11118 B14R1.3622 CCCCNc1ccc(c(c1F)F)O 34a_100015204651_100000210210 [0,2,0,0,0,0|2,0,0]=4 11119 B14R1.3622 CCCCNc1ccc(c(c1F)F)O 7a_100015204651_100000210211 [0,2,0,0,0,0|2,0,0]=4 11120 B14R1.3622 CCCCOc1ccc(c(c1F)F)O 271570a_203496583355_100010177746 [0,2,0,0,0,0|2,0,0]=4 11121 B14R1.3622 CCCCSc1ccc(c(c1C)C)O 62a_100000210211_100012353674 [0,2,0,0,0,0|2,0,0]=4 11122 B14R1.3622 CCCCSc1ccc(c(c1C)C)O 62a_100012353674_100000210210 [0,2,0,0,0,0|2,0,0]=4 11123 B14R1.3622 CCCCSc1ccc(c(c1C)N)O 62a_100000210211_100013039247 [0,2,0,0,0,0|2,0,0]=4 11124 B14R1.3622 CCCCSc1ccc(c(c1C)N)O 62a_100013039247_100000210210 [0,2,0,0,0,0|2,0,0]=4 11125 B14R1.3622 CCCCSc1ccc(c(c1F)C)O 62a_100000210211_100010390934 [0,2,0,0,0,0|2,0,0]=4 11126 B14R1.3622 CCCCSc1ccc(c(c1F)C)O 62a_100010390934_100000210210 [0,2,0,0,0,0|2,0,0]=4 11127 B14R1.3622 CCCCSc1ccc(c(c1F)F)O 62a_100000210211_100011830415 [0,2,0,0,0,0|2,0,0]=4 11128 B14R1.3622 CCCCSc1ccc(c(c1F)F)O 62a_100011830415_100000210210 [0,2,0,0,0,0|2,0,0]=4 11129 B14R1.3622 CCCCSc1ccc(c(c1F)O)Br 62a_100000210211_200010782288 [0,2,0,0,0,0|2,0,0]=4 11130 B14R1.3622 CCCCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210210 [0,2,0,0,0,0|2,0,0]=4 11131 B14R1.3622 CCCCSc1ccc(c(c1F)O)F 62a_100000210211_100010167067 [0,2,0,0,0,0|2,0,0]=4 11132 B14R1.3622 CCCCSc1ccc(c(c1F)O)F 62a_100010167067_100000210210 [0,2,0,0,0,0|2,0,0]=4 11133 B14R1.3622 CCCCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210210 [0,2,0,0,0,0|2,0,0]=4 11134 B14R1.3622 CCNN=Cc1ccc(c(c1Br)O)O 4a_100000756455_200010659824 [0,2,0,0,0,0|1,0,1]=4 11135 B14R1.3622 CCNN=Cc1ccc(c(c1O)O)O 4a_100000756455_100000212131 [0,2,0,0,0,0|1,0,1]=4 11136 B14R1.3622 COCCNc1ccc(c(c1C)C)O 34a_200011216674_100011201679 [0,2,0,0,0,0|2,0,0]=4 11137 B14R1.3622 COCCNc1ccc(c(c1C)C)O 7a_200011216674_100000233755 [0,2,0,0,0,0|2,0,0]=4 11138 B14R1.3622 COCCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100011201679 [0,2,0,0,0,0|2,0,0]=4 11139 B14R1.3622 COCCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000233755 [0,2,0,0,0,0|2,0,0]=4 11140 B14R1.3622 COCCNc1ccc(c(c1Cl)O)C 34a_100000036876_100011201679 [0,2,0,0,0,0|2,0,0]=4 11141 B14R1.3622 COCCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000233755 [0,2,0,0,0,0|2,0,0]=4 11142 B14R1.3622 COCCNc1ccc(c(c1F)C)O 34a_200000126710_100011201679 [0,2,0,0,0,0|2,0,0]=4 11143 B14R1.3622 COCCNc1ccc(c(c1F)C)O 7a_200000126710_100000233755 [0,2,0,0,0,0|2,0,0]=4 11144 B14R1.3622 COCCNc1ccc(c(c1F)Cl)O 34a_200000098347_100011201679 [0,2,0,0,0,0|2,0,0]=4 11145 B14R1.3622 COCCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000233755 [0,2,0,0,0,0|2,0,0]=4 11146 B14R1.3622 COCCNc1ccc(c(c1F)F)O 34a_100015204651_100011201679 [0,2,0,0,0,0|2,0,0]=4 11147 B14R1.3622 COCCNc1ccc(c(c1F)F)O 7a_100015204651_100000233755 [0,2,0,0,0,0|2,0,0]=4 11148 B14R1.3622 COCCSc1ccc(c(c1C)C)O 62a_100000233755_100012353674 [0,2,0,0,0,0|2,0,0]=4 11149 B14R1.3622 COCCSc1ccc(c(c1C)C)O 62a_100012353674_100000233755 [0,2,0,0,0,0|2,0,0]=4 11150 B14R1.3622 COCCSc1ccc(c(c1C)N)O 62a_100000233755_100013039247 [0,2,0,0,0,0|2,0,0]=4 11151 B14R1.3622 COCCSc1ccc(c(c1C)N)O 62a_100013039247_100000233755 [0,2,0,0,0,0|2,0,0]=4 11152 B14R1.3622 COCCSc1ccc(c(c1F)C)O 62a_100000233755_100010390934 [0,2,0,0,0,0|2,0,0]=4 11153 B14R1.3622 COCCSc1ccc(c(c1F)C)O 62a_100010390934_100000233755 [0,2,0,0,0,0|2,0,0]=4 11154 B14R1.3622 COCCSc1ccc(c(c1F)F)O 62a_100000233755_100011830415 [0,2,0,0,0,0|2,0,0]=4 11155 B14R1.3622 COCCSc1ccc(c(c1F)F)O 62a_100011830415_100000233755 [0,2,0,0,0,0|2,0,0]=4 11156 B14R1.3622 COCCSc1ccc(c(c1F)O)Br 62a_100000233755_200010782288 [0,2,0,0,0,0|2,0,0]=4 11157 B14R1.3622 COCCSc1ccc(c(c1F)O)Br 62a_200010782288_100000233755 [0,2,0,0,0,0|2,0,0]=4 11158 B14R1.3622 COCCSc1ccc(c(c1F)O)F 62a_100000233755_100010167067 [0,2,0,0,0,0|2,0,0]=4 11159 B14R1.3622 COCCSc1ccc(c(c1F)O)F 62a_100010167067_100000233755 [0,2,0,0,0,0|2,0,0]=4 11160 B14R1.3622 COCCSc1ccc(c(c1N)O)Br 62a_100020748643_100000233755 [0,2,0,0,0,0|2,0,0]=4 11161 B14R1.3622 CSCCNc1ccc(c(c1C)C)O 34a_200011216674_100000212216 [0,2,0,0,0,0|2,0,0]=4 11162 B14R1.3622 CSCCNc1ccc(c(c1C)C)O 7a_200011216674_100000212216 [0,2,0,0,0,0|2,0,0]=4 11163 B14R1.3622 CSCCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000212216 [0,2,0,0,0,0|2,0,0]=4 11164 B14R1.3622 CSCCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000212216 [0,2,0,0,0,0|2,0,0]=4 11165 B14R1.3622 CSCCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000212216 [0,2,0,0,0,0|2,0,0]=4 11166 B14R1.3622 CSCCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000212216 [0,2,0,0,0,0|2,0,0]=4 11167 B14R1.3622 CSCCNc1ccc(c(c1F)C)O 34a_200000126710_100000212216 [0,2,0,0,0,0|2,0,0]=4 11168 B14R1.3622 CSCCNc1ccc(c(c1F)C)O 7a_200000126710_100000212216 [0,2,0,0,0,0|2,0,0]=4 11169 B14R1.3622 CSCCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000212216 [0,2,0,0,0,0|2,0,0]=4 11170 B14R1.3622 CSCCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000212216 [0,2,0,0,0,0|2,0,0]=4 11171 B14R1.3622 CSCCNc1ccc(c(c1F)F)O 34a_100015204651_100000212216 [0,2,0,0,0,0|2,0,0]=4 11172 B14R1.3622 CSCCNc1ccc(c(c1F)F)O 7a_100015204651_100000212216 [0,2,0,0,0,0|2,0,0]=4 11173 B14R1.3622 CSCCSc1ccc(c(c1C)C)O 62a_100000212216_100012353674 [0,2,0,0,0,0|2,0,0]=4 11174 B14R1.3622 CSCCSc1ccc(c(c1C)C)O 62a_100012353674_100000751147 [0,2,0,0,0,0|2,0,0]=4 11175 B14R1.3622 CSCCSc1ccc(c(c1C)N)O 62a_100000212216_100013039247 [0,2,0,0,0,0|2,0,0]=4 11176 B14R1.3622 CSCCSc1ccc(c(c1C)N)O 62a_100013039247_100000751147 [0,2,0,0,0,0|2,0,0]=4 11177 B14R1.3622 CSCCSc1ccc(c(c1F)C)O 62a_100000212216_100010390934 [0,2,0,0,0,0|2,0,0]=4 11178 B14R1.3622 CSCCSc1ccc(c(c1F)C)O 62a_100010390934_100000751147 [0,2,0,0,0,0|2,0,0]=4 11179 B14R1.3622 CSCCSc1ccc(c(c1F)F)O 62a_100000212216_100011830415 [0,2,0,0,0,0|2,0,0]=4 11180 B14R1.3622 CSCCSc1ccc(c(c1F)F)O 62a_100011830415_100000751147 [0,2,0,0,0,0|2,0,0]=4 11181 B14R1.3622 CSCCSc1ccc(c(c1F)O)Br 62a_100000212216_200010782288 [0,2,0,0,0,0|2,0,0]=4 11182 B14R1.3622 CSCCSc1ccc(c(c1F)O)Br 62a_200010782288_100000751147 [0,2,0,0,0,0|2,0,0]=4 11183 B14R1.3622 CSCCSc1ccc(c(c1F)O)F 62a_100000212216_100010167067 [0,2,0,0,0,0|2,0,0]=4 11184 B14R1.3622 CSCCSc1ccc(c(c1F)O)F 62a_100010167067_100000751147 [0,2,0,0,0,0|2,0,0]=4 11185 B14R1.3622 CSCCSc1ccc(c(c1N)O)Br 62a_100020748643_100000751147 [0,2,0,0,0,0|2,0,0]=4 11186 B14R1.4205 CCCCc1c(cc(c(c1C)C)O)C 271570a_100020621405_100000730119 [0,2,0,0,0,0|2,0,0]=4 11187 B14R1.4434 CCCCc1cc(c(cc1C=O)O)C 271570a_100020621405_100010186689 [0,2,0,0,0,0|2,0,0]=4 11188 B14R1.4434 CCCCc1cc(c(cc1CC)O)F 271570a_100020621405_100011156610 [0,2,0,0,0,0|2,0,0]=4 11189 B14R1.4398 CCC(CC)Sc1ccc(c(c1)O)O 62a_100000210505_100009813601 [0,2,0,0,0,0|2,0,0]=4 11190 B14R1.4398 CN[C@H](CO)Cc1ccc(c(c1)Cl)Cl 2230a_100010113527_200000210301 [0,2,0,0,0,0|2,0,0]=4 11191 B14R1.4398 CN[C@H](CO)Cc1ccc(c(c1)Cl)Cl 34a_100010113527_200000210301 [0,2,0,0,0,0|2,0,0]=4 11192 B14R1.4398 [13CH3]N[C@H](CO)Cc1ccc(c(c1)Cl)Cl 2230a_100010113527_200025704644 [0,2,0,0,0,0|2,0,0]=4 11193 B14R1.4398 [13CH3]N[C@H](CO)Cc1ccc(c(c1)Cl)Cl 34a_100010113527_200025704644 [0,2,0,0,0,0|2,0,0]=4 11194 B14R1.5612 CCC(C)(C)Sc1ccc(c(c1)O)O 62a_100000032637_100009813601 [0,2,0,0,0,0|2,0,0]=4 11195 B14R1.1360 CCCCc1ccc(c(c1OC)O)F 271570a_100020621405_200010167157 [0,2,0,0,0,0|2,0,0]=4 11196 B12R1.121 CNCCc1ccccc1C=O 2230a_106832991635_100010186698 [0,0,1,1,0,0|1,0,1]=4 11197 B12R1.121 CNCCc1ccccc1C=O 34a_100102657272_100010186698 [0,0,1,1,0,0|1,0,1]=4 11198 B12R1.121 CNCCc1ccccc1C=O 7a_106832991635_100010186698 [0,0,1,1,0,0|1,0,1]=4 11199 B12R2.24 Oc1ccc2c(c1)CCCC2 271570a_203496583355_100011221367 [1,0,0,1,0,0|1,0,0]=3 11200 B12R2.24 Oc1ccc2c(c1)CCCN2 271570a_203496583355_100016994925 [1,0,0,1,0,0|2,0,0]=4 11201 B12R2.24 Oc1ccc2c(c1)CCCO2 271570a_203496583355_100011393166 [1,0,0,1,0,0|2,0,0]=4 11202 B12R2.24 Oc1ccc2c(c1)CCNC2 271570a_203496583355_100000686056 [1,0,0,1,0,0|2,0,0]=4 11203 B12R2.24 Oc1ccc2c(c1)CNCC2 271570a_203496583355_100015189961 [1,0,0,1,0,0|0,0,0]=2 11204 B12R2.24 Oc1ccc2c(c1)COCC2 271570a_203496583355_100010128096 [1,0,0,1,0,0|1,0,0]=3 11205 B12R2.24 Oc1ccc2c(c1)NCCC2 271570a_203496583355_100010196366 [1,0,0,1,0,0|2,0,0]=4 11206 B12R2.24 Oc1ccc2c(c1)OCCC2 271570a_203496583355_100010700467 [1,0,0,1,0,0|2,0,0]=4 11207 B12R2.24 Oc1ccc2c(n1)CCCC2 271570a_203496583355_100000046135 [1,0,0,1,0,0|2,0,0]=4 11208 B12R2.24 Oc1cnc2c(c1)CCCC2 271570a_203496583355_100010236098 [1,0,0,1,0,0|2,0,0]=4 11209 B12R2.79 NC1CC1c2ccc(cc2)O 271570a_203496583355_100000755575 [1,0,0,1,0,0|2,0,0]=4 11210 B12R2.132 Cn1ccc2c1cc(cc2)O 271570a_203496583355_100011934912 [1,0,0,1,0,0|0,0,2]=4 11211 B12R2.132 Cn1cnc2c1cc(cc2)O 271570a_203496583355_100000702186 [1,0,0,1,0,0|1,0,1]=4 11212 B12R2.132 Cn1ncc2c1cc(cc2)O 271570a_203496583355_100009817177 [1,0,0,1,0,0|1,0,1]=4 11213 B12R2.132 Cn1nnc2c1cc(cc2)O 271570a_203496583355_100010241234 [1,0,0,1,0,0|2,0,0]=4 11214 B12R2.132 NC1CCc2c1cc(cc2)O 271570a_203496583355_100011435097 [1,0,0,1,0,0|2,0,0]=4 11215 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [1,0,0,1,0,0|2,0,0]=4 11216 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [1,0,0,1,0,0|2,0,0]=4 11217 B12R2.294 Oc1ccc(cc1)NC2CC2 34a_100000185829_100000211595 [1,0,0,1,0,0|2,0,0]=4 11218 B12R2.294 Oc1ccc(cc1)OC2CC2 271570a_203496583355_100000704264 [1,0,0,1,0,0|2,0,0]=4 11219 B12R2.2302 Oc1ccc(cc1)C2CCC2 271570a_203496583355_200010114027 [1,0,0,1,0,0|1,0,0]=3 11220 B12R2.2302 Oc1ccc(cc1)C2COC2 271570a_203496583355_100010732642 [1,0,0,1,0,0|1,0,0]=3 11221 B12R2.203 Cn1ccc2c1c(ccc2)O 271570a_203496583355_100009817156 [1,0,0,1,0,0|0,0,2]=4 11222 B12R2.203 Cn1cnc2c1c(ccc2)O 271570a_203496583355_100010749505 [1,0,0,1,0,0|1,0,1]=4 11223 B12R2.203 Cn1ncc2c1c(ccc2)O 271570a_203496583355_100009817178 [1,0,0,1,0,0|1,0,1]=4 11224 B12R2.203 NC1CCc2c1c(ccc2)O 271570a_203496583355_100103168669 [1,0,0,1,0,0|2,0,0]=4 11225 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [1,0,0,1,0,0|2,0,0]=4 11226 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [1,0,0,1,0,0|0,0,0]=2 11227 B12R2.612 CN1CCc2c1ncc(c2)O 271570a_203496583355_200010383199 [1,0,0,1,0,0|1,0,0]=3 11228 B12R2.612 Cn1ccc2c1ccc(c2)O 271570a_203496583355_100011202928 [1,0,0,1,0,0|0,0,2]=4 11229 B12R2.612 Cn1cnc2c1ccc(c2)O 271570a_203496583355_100000718706 [1,0,0,1,0,0|1,0,1]=4 11230 B12R2.612 Cn1ncc2c1ccc(c2)O 271570a_203496583355_100009817176 [1,0,0,1,0,0|1,0,1]=4 11231 B12R2.612 Cn1nnc2c1ccc(c2)O 271570a_203496583355_100000724718 [1,0,0,1,0,0|2,0,0]=4 11232 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [1,0,0,1,0,0|2,0,0]=4 11233 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [1,0,0,1,0,0|2,0,0]=4 11234 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [1,0,0,1,0,0|2,0,0]=4 11235 B12R2.1081 Oc1cccc2c1CCCC2 271570a_203496583355_100012354034 [1,0,0,1,0,0|1,0,0]=3 11236 B12R2.1081 Oc1cccc2c1CCCN2 271570a_203496583355_100010196365 [1,0,0,1,0,0|2,0,0]=4 11237 B12R2.1081 Oc1cccc2c1CCCO2 271570a_203496583355_100010188023 [1,0,0,1,0,0|2,0,0]=4 11238 B12R2.1081 Oc1cccc2c1CCNC2 271570a_203496583355_100000756787 [1,0,0,1,0,0|2,0,0]=4 11239 B12R2.1081 Oc1cccc2c1CNCC2 271570a_203496583355_100000687140 [1,0,0,1,0,0|0,0,0]=2 11240 B12R2.1081 Oc1cccc2c1OCCC2 271570a_203496583355_100010204675 [1,0,0,1,0,0|2,0,0]=4 11241 B12R2.1286 Oc1cccc(c1)NC2CC2 34a_100000210217_100000211595 [1,0,0,1,0,0|2,0,0]=4 11242 B12R2.1286 Oc1cccc(c1)OC2CC2 271570a_203496583355_100012344912 [1,0,0,1,0,0|2,0,0]=4 11243 B12R2.1286 Oc1cccc(c1)SC2CC2 271570a_203496583355_200010157562 [1,0,0,1,0,0|2,0,0]=4 11244 B12R2.82 Nc1c(ccc2c1CCC2)O 271570a_203496583355_202495424074 [1,0,0,1,0,0|1,0,0]=3 11245 B12R2.82 Oc1ccc2c(c1F)CCN2 271570a_203496583355_100011013764 [1,0,0,1,0,0|2,0,0]=4 11246 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [1,0,0,1,0,0|0,0,0]=2 11247 B12R2.100 Oc1cc2c(cc1F)NCC2 271570a_203496583355_100012771920 [1,0,0,1,0,0|1,0,0]=3 11248 B12R2.100 Oc1cc2c(cc1O)CCC2 271570a_203496583355_200010659162 [1,0,0,1,0,0|0,0,0]=2 11249 B12R2.100 Oc1cc2c(cc1O)OCO2 271570a_203496583355_100010290809 [1,0,0,1,0,0|2,0,0]=4 11250 B12R2.100 Oc1cc2cn[nH]c2cc1O 271570a_203496583355_100010079831 [1,0,0,1,0,0|1,0,1]=4 11251 B12R2.100 Oc1cc2cn[nH]c2cc1O 271570a_203496583355_100010080172 [1,0,0,1,0,0|1,0,1]=4 11252 B12R2.143 CNCc1ccc2c(c1)CC2 207a_100102657272_100010273998 [1,0,0,1,0,0|2,0,0]=4 11253 B12R2.143 CNCc1ccc2c(c1)CC2 270004a_106832991635_100010273998 [1,0,0,1,0,0|2,0,0]=4 11254 B12R2.291 Brc1ccc(cc1Br)C2CC2 271570a_100011220607_100012356285 [1,0,0,1,0,0|2,0,0]=4 11255 B12R2.291 Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100009813585 [1,0,0,1,0,0|2,0,0]=4 11256 B12R2.291 Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100000049509 [1,0,0,1,0,0|2,0,0]=4 11257 B12R2.291 Cc1cc(ccc1F)C2CC2 271570a_100011220607_100011218330 [1,0,0,1,0,0|2,0,0]=4 11258 B12R2.291 Cc1cc(ccc1N)C2CC2 271570a_100011220607_100000211769 [1,0,0,1,0,0|2,0,0]=4 11259 B12R2.291 Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186361 [1,0,0,1,0,0|1,0,0]=3 11260 B12R2.291 Cc1cc(cnc1O)C2CC2 271570a_100011220607_100000685391 [1,0,0,1,0,0|2,0,0]=4 11261 B12R2.291 Cc1cc(ncc1O)C2CC2 271570a_100011220607_100000692680 [1,0,0,1,0,0|2,0,0]=4 11262 B12R2.291 Cc1ccc(cc1Br)C2CC2 271570a_100011220607_100011847877 [1,0,0,1,0,0|2,0,0]=4 11263 B12R2.291 Cc1ccc(cc1C)C2CC2 271570a_100011220607_100011215607 [1,0,0,1,0,0|2,0,0]=4 11264 B12R2.291 Cc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011216363 [1,0,0,1,0,0|2,0,0]=4 11265 B12R2.291 Cc1ccc(cc1F)C2CC2 271570a_100011220607_100000720648 [1,0,0,1,0,0|2,0,0]=4 11266 B12R2.291 Cc1ccc(cc1N)C2CC2 271570a_100011220607_100000761890 [1,0,0,1,0,0|2,0,0]=4 11267 B12R2.291 Cc1ccc(cc1O)C2CC2 271570a_100011220607_100000766334 [1,0,0,1,0,0|1,0,0]=3 11268 B12R2.291 Cc1cnc(cc1O)C2CC2 271570a_100011220607_100000704368 [1,0,0,1,0,0|2,0,0]=4 11269 B12R2.291 Cc1nc(ccc1O)C2CC2 271570a_100011220607_100010233687 [1,0,0,1,0,0|2,0,0]=4 11270 B12R2.291 Cc1ncc(cc1O)C2CC2 271570a_100011220607_100009864810 [1,0,0,1,0,0|2,0,0]=4 11271 B12R2.291 Clc1cc(ccc1Br)C2CC2 271570a_100011220607_100012047281 [1,0,0,1,0,0|2,0,0]=4 11272 B12R2.291 Clc1ccc(cc1Br)C2CC2 271570a_100011220607_100012353702 [1,0,0,1,0,0|2,0,0]=4 11273 B12R2.291 Clc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011214914 [1,0,0,1,0,0|2,0,0]=4 11274 B12R2.291 Fc1cc(ccc1Br)C2CC2 271570a_100011220607_100000685389 [1,0,0,1,0,0|2,0,0]=4 11275 B12R2.291 Fc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011216805 [1,0,0,1,0,0|2,0,0]=4 11276 B12R2.291 Fc1ccc(cc1Br)C2CC2 271570a_100011220607_100012047266 [1,0,0,1,0,0|2,0,0]=4 11277 B12R2.291 Fc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011215976 [1,0,0,1,0,0|2,0,0]=4 11278 B12R2.291 Fc1ccc(cc1F)C2CC2 271570a_100011220607_100000750028 [1,0,0,1,0,0|2,0,0]=4 11279 B12R2.291 Nc1cc(ccc1Br)C2CC2 271570a_100011220607_100000750456 [1,0,0,1,0,0|2,0,0]=4 11280 B12R2.291 Nc1cc(ccc1Cl)C2CC2 271570a_100011220607_200000761891 [1,0,0,1,0,0|2,0,0]=4 11281 B12R2.291 Nc1cc(ccc1F)C2CC2 271570a_100011220607_100000740924 [1,0,0,1,0,0|2,0,0]=4 11282 B12R2.291 Nc1cc(ccc1O)C2CC2 271570a_100011220607_100000752626 [1,0,0,1,0,0|1,0,0]=3 11283 B12R2.291 Nc1cc(cnc1O)C2CC2 271570a_100011220607_100000743729 [1,0,0,1,0,0|2,0,0]=4 11284 B12R2.291 Nc1cc(ncc1O)C2CC2 271570a_100011220607_100009819941 [1,0,0,1,0,0|2,0,0]=4 11285 B12R2.291 Nc1ccc(cc1Br)C2CC2 271570a_100011220607_100000750455 [1,0,0,1,0,0|2,0,0]=4 11286 B12R2.291 Nc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011218065 [1,0,0,1,0,0|2,0,0]=4 11287 B12R2.291 Nc1ccc(cc1F)C2CC2 271570a_100011220607_100011215594 [1,0,0,1,0,0|2,0,0]=4 11288 B12R2.291 Nc1ccc(cc1N)C2CC2 271570a_100011220607_100000741789 [1,0,0,1,0,0|2,0,0]=4 11289 B12R2.291 Nc1ccc(cc1O)C2CC2 271570a_100011220607_100000739049 [1,0,0,1,0,0|1,0,0]=3 11290 B12R2.291 Nc1ccc(nc1O)C2CC2 271570a_100011220607_100000718904 [1,0,0,1,0,0|2,0,0]=4 11291 B12R2.291 Nc1nc(ccc1O)C2CC2 271570a_100011220607_100000685527 [1,0,0,1,0,0|2,0,0]=4 11292 B12R2.291 Nc1ncc(cc1O)C2CC2 271570a_100011220607_100009819042 [1,0,0,1,0,0|2,0,0]=4 11293 B12R2.291 O=c1[nH]cc(cc1O)C2CC2 271570a_100011220607_100009814561 [1,0,0,1,0,0|1,0,1]=4 11294 B12R2.291 Oc1cc(ccc1Br)C2CC2 271570a_100011220607_100012356990 [1,0,0,1,0,0|1,0,0]=3 11295 B12R2.291 Oc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356854 [1,0,0,1,0,0|1,0,0]=3 11296 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_100011220607_100000686035 [1,0,0,1,0,0|1,0,0]=3 11297 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_203496583355_100010281199 [1,0,0,1,0,0|1,0,0]=3 11298 B12R2.291 Oc1cc(cnc1F)C2CC2 271570a_100011220607_100009819871 [1,0,0,1,0,0|2,0,0]=4 11299 B12R2.291 Oc1cc(ncc1F)C2CC2 271570a_100011220607_100009854642 [1,0,0,1,0,0|2,0,0]=4 11300 B12R2.291 Oc1ccc(cc1Br)C2CC2 271570a_100011220607_100012361655 [1,0,0,1,0,0|1,0,0]=3 11301 B12R2.291 Oc1ccc(cc1Cl)C2CC2 271570a_100011220607_100012360047 [1,0,0,1,0,0|1,0,0]=3 11302 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_100011220607_100000185481 [1,0,0,1,0,0|1,0,0]=3 11303 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_203496583355_100010281179 [1,0,0,1,0,0|1,0,0]=3 11304 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_100011220607_100009813601 [1,0,0,1,0,0|0,0,0]=2 11305 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_203496583355_100135415898 [1,0,0,1,0,0|0,0,0]=2 11306 B12R2.291 Oc1ccc(nc1Br)C2CC2 271570a_100011220607_100000725334 [1,0,0,1,0,0|2,0,0]=4 11307 B12R2.291 Oc1ccc(nc1Cl)C2CC2 271570a_100011220607_100000721234 [1,0,0,1,0,0|2,0,0]=4 11308 B12R2.291 Oc1ccc(nc1F)C2CC2 271570a_100011220607_100009819667 [1,0,0,1,0,0|2,0,0]=4 11309 B12R2.291 Oc1nc(ccc1F)C2CC2 271570a_100011220607_100010729010 [1,0,0,1,0,0|2,0,0]=4 11310 B12R2.291 Oc1ncc(cc1Cl)C2CC2 271570a_100011220607_100010238531 [1,0,0,1,0,0|2,0,0]=4 11311 B14R2.70 Cc1ccc(cc1O)N2CCCC2 271570a_203496583355_200012352868 [0,1,0,1,0,0|2,0,0]=4 11312 B14R2.70 Oc1ccc(cc1O)C2=CCCC2 271570a_100000089523_100009813601 [0,1,0,1,0,0|1,0,1]=4 11313 B14R2.70 Oc1ccc(cc1O)C2=CCOC2 271570a_100009872500_100009813601 [0,1,0,1,0,0|1,0,1]=4 11314 B14R2.70 Oc1ccc(cc1O)C2=COCC2 271570a_100000118173_100009813601 [0,1,0,1,0,0|1,0,1]=4 11315 B14R2.954 C=C(c1ccc(c(c1)O)O)C2CC2 271570a_100010895485_100009813601 [0,1,0,1,0,0|1,0,1]=4 11316 B14R2.4272 CN[C@@H]1C[C@H]1c2ccc(c(c2)F)F 2230a_200009817314_200000210301 [0,1,0,1,0,0|2,0,0]=4 11317 B14R2.4272 CN[C@@H]1C[C@H]1c2ccc(c(c2)F)F 34a_200009817314_200000210301 [0,1,0,1,0,0|2,0,0]=4 11318 B14R2.4272 [13CH3]N[C@@H]1C[C@H]1c2ccc(c(c2)F)F 2230a_200009817314_200025704644 [0,1,0,1,0,0|2,0,0]=4 11319 B14R2.4272 [13CH3]N[C@@H]1C[C@H]1c2ccc(c(c2)F)F 34a_200009817314_200025704644 [0,1,0,1,0,0|2,0,0]=4 11320 B14R2.8239 CN1CCc2cc(c(cc2C1)O)O 34a_200015384465_200000210301 [0,1,0,1,0,0|0,0,0]=2 11321 B14R2.8239 [13CH3]N1CCc2cc(c(cc2C1)O)O 34a_200015384465_200025704644 [0,1,0,1,0,0|0,0,0]=2 11322 B14R2.10591 Cc1cc(ccc1O)NCC2CC2 34a_100011218179_100000742324 [0,1,0,1,0,0|2,0,0]=4 11323 B14R2.10591 Cc1cc(ccc1O)NCC2CC2 7a_100011218179_100000742324 [0,1,0,1,0,0|2,0,0]=4 11324 B14R2.10591 Cc1cc(ccc1O)NCC2CO2 34a_100011218179_102125554688 [0,1,0,1,0,0|2,0,0]=4 11325 B14R2.10591 Cc1cc(ccc1O)NCC2CO2 7a_100011218179_102125554688 [0,1,0,1,0,0|2,0,0]=4 11326 B14R2.10591 Cc1cc(ccc1O)NCC2CS2 7a_100011218179_100000031435 [0,1,0,1,0,0|2,0,0]=4 11327 B14R2.10591 Cc1cc(ccc1O)NC[C@@H]2CO2 7a_100011218179_100000745022 [0,1,0,1,0,0|2,0,0]=4 11328 B14R2.10591 Cc1cc(ccc1O)SCC2CC2 62a_100000756562_100000186361 [0,1,0,1,0,0|2,0,0]=4 11329 B14R2.10591 Cc1cc(ccc1O)SCC2CO2 62a_102125554688_100000186361 [0,1,0,1,0,0|2,0,0]=4 11330 B14R2.10591 Cc1cc(ccc1O)SCC2CS2 62a_100000031435_100000186361 [0,1,0,1,0,0|2,0,0]=4 11331 B14R2.10591 Cc1cc(ccc1O)SC[C@@H]2CO2 62a_100000745022_100000186361 [0,1,0,1,0,0|2,0,0]=4 11332 B14R2.10591 Cc1ccc(cc1O)NCC2CC2 34a_100000759471_100000742324 [0,1,0,1,0,0|2,0,0]=4 11333 B14R2.10591 Cc1ccc(cc1O)NCC2CC2 7a_100000759471_100000742324 [0,1,0,1,0,0|2,0,0]=4 11334 B14R2.10591 Cc1ccc(cc1O)NCC2CO2 34a_100000759471_102125554688 [0,1,0,1,0,0|2,0,0]=4 11335 B14R2.10591 Cc1ccc(cc1O)NCC2CO2 7a_100000759471_102125554688 [0,1,0,1,0,0|2,0,0]=4 11336 B14R2.10591 Cc1ccc(cc1O)NCC2CS2 7a_100000759471_100000031435 [0,1,0,1,0,0|2,0,0]=4 11337 B14R2.10591 Cc1ccc(cc1O)NC[C@@H]2CO2 7a_100000759471_100000745022 [0,1,0,1,0,0|2,0,0]=4 11338 B14R2.10591 Cc1ccc(cc1O)SCC2CC2 62a_100000685420_100000742324 [0,1,0,1,0,0|2,0,0]=4 11339 B14R2.10591 Cc1ccc(cc1O)SCC2CC2 62a_100000756562_100000685420 [0,1,0,1,0,0|2,0,0]=4 11340 B14R2.10591 Cc1ccc(cc1O)SCC2CO2 62a_100000685420_102125554688 [0,1,0,1,0,0|2,0,0]=4 11341 B14R2.10591 Cc1ccc(cc1O)SCC2CO2 62a_102125554688_100000685420 [0,1,0,1,0,0|2,0,0]=4 11342 B14R2.10591 Cc1ccc(cc1O)SCC2CS2 62a_100000031435_100000685420 [0,1,0,1,0,0|2,0,0]=4 11343 B14R2.10591 Cc1ccc(cc1O)SCC2CS2 62a_100000685420_100000031435 [0,1,0,1,0,0|2,0,0]=4 11344 B14R2.10591 Cc1ccc(cc1O)SC[C@@H]2CO2 62a_100000685420_100000745022 [0,1,0,1,0,0|2,0,0]=4 11345 B14R2.10591 Cc1ccc(cc1O)SC[C@@H]2CO2 62a_100000745022_100000685420 [0,1,0,1,0,0|2,0,0]=4 11346 B14R2.10591 Nc1cc(ccc1O)SCC2CC2 62a_100000752626_100000742324 [0,1,0,1,0,0|2,0,0]=4 11347 B14R2.10591 Nc1cc(ccc1O)SCC2CC2 62a_100000756562_100000752626 [0,1,0,1,0,0|2,0,0]=4 11348 B14R2.10591 Nc1cc(ccc1O)SCC2CO2 62a_100000752626_102125554688 [0,1,0,1,0,0|2,0,0]=4 11349 B14R2.10591 Nc1cc(ccc1O)SCC2CO2 62a_102125554688_100000752626 [0,1,0,1,0,0|2,0,0]=4 11350 B14R2.10591 Nc1cc(ccc1O)SCC2CS2 62a_100000031435_100000752626 [0,1,0,1,0,0|2,0,0]=4 11351 B14R2.10591 Nc1cc(ccc1O)SCC2CS2 62a_100000752626_100000031435 [0,1,0,1,0,0|2,0,0]=4 11352 B14R2.10591 Nc1cc(ccc1O)SC[C@@H]2CO2 62a_100000745022_100000752626 [0,1,0,1,0,0|2,0,0]=4 11353 B14R2.10591 Nc1cc(ccc1O)SC[C@@H]2CO2 62a_100000752626_100000745022 [0,1,0,1,0,0|2,0,0]=4 11354 B14R2.10591 Nc1ccc(cc1O)SCC2CC2 62a_100000739049_100000742324 [0,1,0,1,0,0|2,0,0]=4 11355 B14R2.10591 Nc1ccc(cc1O)SCC2CC2 62a_100000756562_100000739049 [0,1,0,1,0,0|2,0,0]=4 11356 B14R2.10591 Nc1ccc(cc1O)SCC2CO2 62a_100000739049_102125554688 [0,1,0,1,0,0|2,0,0]=4 11357 B14R2.10591 Nc1ccc(cc1O)SCC2CO2 62a_102125554688_100000739049 [0,1,0,1,0,0|2,0,0]=4 11358 B14R2.10591 Nc1ccc(cc1O)SCC2CS2 62a_100000031435_100000739049 [0,1,0,1,0,0|2,0,0]=4 11359 B14R2.10591 Nc1ccc(cc1O)SCC2CS2 62a_100000739049_100000031435 [0,1,0,1,0,0|2,0,0]=4 11360 B14R2.10591 Nc1ccc(cc1O)SC[C@@H]2CO2 62a_100000739049_100000745022 [0,1,0,1,0,0|2,0,0]=4 11361 B14R2.10591 Nc1ccc(cc1O)SC[C@@H]2CO2 62a_100000745022_100000739049 [0,1,0,1,0,0|2,0,0]=4 11362 B14R2.10591 Oc1cc(ccc1Br)SCC2CC2 62a_100000756562_100012356990 [0,1,0,1,0,0|2,0,0]=4 11363 B14R2.10591 Oc1cc(ccc1Br)SCC2CC2 62a_100012356990_100000742324 [0,1,0,1,0,0|2,0,0]=4 11364 B14R2.10591 Oc1cc(ccc1Br)SCC2CO2 62a_100012356990_102125554688 [0,1,0,1,0,0|2,0,0]=4 11365 B14R2.10591 Oc1cc(ccc1Br)SCC2CO2 62a_102125554688_100012356990 [0,1,0,1,0,0|2,0,0]=4 11366 B14R2.10591 Oc1cc(ccc1Br)SCC2CS2 62a_100000031435_100012356990 [0,1,0,1,0,0|2,0,0]=4 11367 B14R2.10591 Oc1cc(ccc1Br)SCC2CS2 62a_100012356990_100000031435 [0,1,0,1,0,0|2,0,0]=4 11368 B14R2.10591 Oc1cc(ccc1Br)SC[C@@H]2CO2 62a_100000745022_100012356990 [0,1,0,1,0,0|2,0,0]=4 11369 B14R2.10591 Oc1cc(ccc1Br)SC[C@@H]2CO2 62a_100012356990_100000745022 [0,1,0,1,0,0|2,0,0]=4 11370 B14R2.10591 Oc1cc(ccc1Cl)CNC2CC2 34a_100020636435_100000211595 [0,1,0,1,0,0|2,0,0]=4 11371 B14R2.10591 Oc1cc(ccc1Cl)NCC2CC2 34a_100011934209_100000742324 [0,1,0,1,0,0|2,0,0]=4 11372 B14R2.10591 Oc1cc(ccc1Cl)NCC2CO2 34a_100011934209_102125554688 [0,1,0,1,0,0|2,0,0]=4 11373 B14R2.10591 Oc1cc(ccc1Cl)SCC2CC2 62a_100000756562_100011356854 [0,1,0,1,0,0|2,0,0]=4 11374 B14R2.10591 Oc1cc(ccc1Cl)SCC2CC2 62a_100011356854_100000742324 [0,1,0,1,0,0|2,0,0]=4 11375 B14R2.10591 Oc1cc(ccc1Cl)SCC2CO2 62a_100011356854_102125554688 [0,1,0,1,0,0|2,0,0]=4 11376 B14R2.10591 Oc1cc(ccc1Cl)SCC2CO2 62a_102125554688_100011356854 [0,1,0,1,0,0|2,0,0]=4 11377 B14R2.10591 Oc1cc(ccc1Cl)SCC2CS2 62a_100000031435_100011356854 [0,1,0,1,0,0|2,0,0]=4 11378 B14R2.10591 Oc1cc(ccc1Cl)SCC2CS2 62a_100011356854_100000031435 [0,1,0,1,0,0|2,0,0]=4 11379 B14R2.10591 Oc1cc(ccc1Cl)SC[C@@H]2CO2 62a_100000745022_100011356854 [0,1,0,1,0,0|2,0,0]=4 11380 B14R2.10591 Oc1cc(ccc1Cl)SC[C@@H]2CO2 62a_100011356854_100000745022 [0,1,0,1,0,0|2,0,0]=4 11381 B14R2.10591 Oc1cc(ccc1F)CNC2CC2 34a_100160469508_100000211595 [0,1,0,1,0,0|2,0,0]=4 11382 B14R2.10591 Oc1cc(ccc1F)NCC2CC2 34a_100012017398_100000742324 [0,1,0,1,0,0|2,0,0]=4 11383 B14R2.10591 Oc1cc(ccc1F)NCC2CC2 7a_100012017398_100000742324 [0,1,0,1,0,0|2,0,0]=4 11384 B14R2.10591 Oc1cc(ccc1F)NCC2CO2 34a_100012017398_102125554688 [0,1,0,1,0,0|2,0,0]=4 11385 B14R2.10591 Oc1cc(ccc1F)NCC2CO2 7a_100012017398_102125554688 [0,1,0,1,0,0|2,0,0]=4 11386 B14R2.10591 Oc1cc(ccc1F)NCC2CS2 7a_100012017398_100000031435 [0,1,0,1,0,0|2,0,0]=4 11387 B14R2.10591 Oc1cc(ccc1F)NC[C@@H]2CO2 7a_100012017398_100000745022 [0,1,0,1,0,0|2,0,0]=4 11388 B14R2.10591 Oc1cc(ccc1F)SCC2CC2 62a_100000686035_100000742324 [0,1,0,1,0,0|2,0,0]=4 11389 B14R2.10591 Oc1cc(ccc1F)SCC2CC2 62a_100000756562_100000686035 [0,1,0,1,0,0|2,0,0]=4 11390 B14R2.10591 Oc1cc(ccc1F)SCC2CO2 62a_100000686035_102125554688 [0,1,0,1,0,0|2,0,0]=4 11391 B14R2.10591 Oc1cc(ccc1F)SCC2CO2 62a_102125554688_100000686035 [0,1,0,1,0,0|2,0,0]=4 11392 B14R2.10591 Oc1cc(ccc1F)SCC2CS2 62a_100000031435_100000686035 [0,1,0,1,0,0|2,0,0]=4 11393 B14R2.10591 Oc1cc(ccc1F)SCC2CS2 62a_100000686035_100000031435 [0,1,0,1,0,0|2,0,0]=4 11394 B14R2.10591 Oc1cc(ccc1F)SC[C@@H]2CO2 62a_100000686035_100000745022 [0,1,0,1,0,0|2,0,0]=4 11395 B14R2.10591 Oc1cc(ccc1F)SC[C@@H]2CO2 62a_100000745022_100000686035 [0,1,0,1,0,0|2,0,0]=4 11396 B14R2.10591 Oc1ccc(cc1Br)NCC2CC2 34a_100011534360_100000742324 [0,1,0,1,0,0|2,0,0]=4 11397 B14R2.10591 Oc1ccc(cc1Br)NCC2CO2 34a_100011534360_102125554688 [0,1,0,1,0,0|2,0,0]=4 11398 B14R2.10591 Oc1ccc(cc1Br)SCC2CC2 62a_100000756562_100012361655 [0,1,0,1,0,0|2,0,0]=4 11399 B14R2.10591 Oc1ccc(cc1Br)SCC2CC2 62a_100012361655_100000742324 [0,1,0,1,0,0|2,0,0]=4 11400 B14R2.10591 Oc1ccc(cc1Br)SCC2CO2 62a_100012361655_102125554688 [0,1,0,1,0,0|2,0,0]=4 11401 B14R2.10591 Oc1ccc(cc1Br)SCC2CO2 62a_102125554688_100012361655 [0,1,0,1,0,0|2,0,0]=4 11402 B14R2.10591 Oc1ccc(cc1Br)SCC2CS2 62a_100000031435_100012361655 [0,1,0,1,0,0|2,0,0]=4 11403 B14R2.10591 Oc1ccc(cc1Br)SCC2CS2 62a_100012361655_100000031435 [0,1,0,1,0,0|2,0,0]=4 11404 B14R2.10591 Oc1ccc(cc1Br)SC[C@@H]2CO2 62a_100000745022_100012361655 [0,1,0,1,0,0|2,0,0]=4 11405 B14R2.10591 Oc1ccc(cc1Br)SC[C@@H]2CO2 62a_100012361655_100000745022 [0,1,0,1,0,0|2,0,0]=4 11406 B14R2.10591 Oc1ccc(cc1Cl)NCC2CC2 34a_100000744943_100000742324 [0,1,0,1,0,0|2,0,0]=4 11407 B14R2.10591 Oc1ccc(cc1Cl)NCC2CO2 34a_100000744943_102125554688 [0,1,0,1,0,0|2,0,0]=4 11408 B14R2.10591 Oc1ccc(cc1Cl)SCC2CC2 62a_100000756562_100012360047 [0,1,0,1,0,0|2,0,0]=4 11409 B14R2.10591 Oc1ccc(cc1Cl)SCC2CC2 62a_100012360047_100000742324 [0,1,0,1,0,0|2,0,0]=4 11410 B14R2.10591 Oc1ccc(cc1Cl)SCC2CO2 62a_100012360047_102125554688 [0,1,0,1,0,0|2,0,0]=4 11411 B14R2.10591 Oc1ccc(cc1Cl)SCC2CO2 62a_102125554688_100012360047 [0,1,0,1,0,0|2,0,0]=4 11412 B14R2.10591 Oc1ccc(cc1Cl)SCC2CS2 62a_100000031435_100012360047 [0,1,0,1,0,0|2,0,0]=4 11413 B14R2.10591 Oc1ccc(cc1Cl)SCC2CS2 62a_100012360047_100000031435 [0,1,0,1,0,0|2,0,0]=4 11414 B14R2.10591 Oc1ccc(cc1Cl)SC[C@@H]2CO2 62a_100000745022_100012360047 [0,1,0,1,0,0|2,0,0]=4 11415 B14R2.10591 Oc1ccc(cc1Cl)SC[C@@H]2CO2 62a_100012360047_100000745022 [0,1,0,1,0,0|2,0,0]=4 11416 B14R2.10591 Oc1ccc(cc1F)CNC2CC2 271570a_203496583355_200000715903 [0,1,0,1,0,0|2,0,0]=4 11417 B14R2.10591 Oc1ccc(cc1F)CNC2CC2 34a_100000758358_100000211595 [0,1,0,1,0,0|2,0,0]=4 11418 B14R2.10591 Oc1ccc(cc1F)NCC2CC2 34a_100011220035_100000742324 [0,1,0,1,0,0|2,0,0]=4 11419 B14R2.10591 Oc1ccc(cc1F)NCC2CC2 7a_100011220035_100000742324 [0,1,0,1,0,0|2,0,0]=4 11420 B14R2.10591 Oc1ccc(cc1F)NCC2CO2 34a_100011220035_102125554688 [0,1,0,1,0,0|2,0,0]=4 11421 B14R2.10591 Oc1ccc(cc1F)NCC2CO2 7a_100011220035_102125554688 [0,1,0,1,0,0|2,0,0]=4 11422 B14R2.10591 Oc1ccc(cc1F)NCC2CS2 7a_100011220035_100000031435 [0,1,0,1,0,0|2,0,0]=4 11423 B14R2.10591 Oc1ccc(cc1F)NC[C@@H]2CO2 7a_100011220035_100000745022 [0,1,0,1,0,0|2,0,0]=4 11424 B14R2.10591 Oc1ccc(cc1F)SCC2CC2 62a_100000185481_100000742324 [0,1,0,1,0,0|2,0,0]=4 11425 B14R2.10591 Oc1ccc(cc1F)SCC2CC2 62a_100000756562_100000185481 [0,1,0,1,0,0|2,0,0]=4 11426 B14R2.10591 Oc1ccc(cc1F)SCC2CO2 62a_100000185481_102125554688 [0,1,0,1,0,0|2,0,0]=4 11427 B14R2.10591 Oc1ccc(cc1F)SCC2CO2 62a_102125554688_100000185481 [0,1,0,1,0,0|2,0,0]=4 11428 B14R2.10591 Oc1ccc(cc1F)SCC2CS2 62a_100000031435_100000185481 [0,1,0,1,0,0|2,0,0]=4 11429 B14R2.10591 Oc1ccc(cc1F)SCC2CS2 62a_100000185481_100000031435 [0,1,0,1,0,0|2,0,0]=4 11430 B14R2.10591 Oc1ccc(cc1F)SC[C@@H]2CO2 62a_100000185481_100000745022 [0,1,0,1,0,0|2,0,0]=4 11431 B14R2.10591 Oc1ccc(cc1F)SC[C@@H]2CO2 62a_100000745022_100000185481 [0,1,0,1,0,0|2,0,0]=4 11432 B14R2.10591 Oc1ccc(cc1O)C#CC2CC2 271570a_200009880635_100009813601 [0,1,0,1,0,0|1,0,1]=4 11433 B14R2.10591 Oc1ccc(cc1O)C=CC2CC2 271570a_100102526188_100009813601 [0,1,0,1,0,0|1,0,1]=4 11434 B14R2.10591 Oc1ccc(cc1O)CNC2CC2 34a_100000010075_100000211595 [0,1,0,1,0,0|1,0,0]=3 11435 B14R2.10591 Oc1ccc(cc1O)NCC2CC2 34a_100102946323_100000742324 [0,1,0,1,0,0|1,0,0]=3 11436 B14R2.10591 Oc1ccc(cc1O)NCC2CO2 34a_100102946323_102125554688 [0,1,0,1,0,0|1,0,0]=3 11437 B14R2.10591 Oc1ccc(cc1O)SCC2CC2 62a_100000756562_100009813601 [0,1,0,1,0,0|1,0,0]=3 11438 B14R2.10591 Oc1ccc(cc1O)SCC2CO2 62a_102125554688_100009813601 [0,1,0,1,0,0|1,0,0]=3 11439 B14R2.10591 Oc1ccc(cc1O)SCC2CS2 62a_100000031435_100009813601 [0,1,0,1,0,0|1,0,0]=3 11440 B14R2.10591 Oc1ccc(cc1O)SC[C@@H]2CO2 62a_100000745022_100009813601 [0,1,0,1,0,0|1,0,0]=3 11441 B14R2.203 COc1c(ccc2c1CCCC2)Br 34a_200010391107_200000210301 [0,1,0,1,0,0|2,0,0]=4 11442 B14R2.203 COc1c(ccc2c1CCCC2)Br 7a_200010391107_200000210301 [0,1,0,1,0,0|2,0,0]=4 11443 B14R2.203 [13CH3]Oc1c(ccc2c1CCCC2)Br 34a_200010391107_200025704644 [0,1,0,1,0,0|2,0,0]=4 11444 B14R2.203 [13CH3]Oc1c(ccc2c1CCCC2)Br 7a_200010391107_200025704644 [0,1,0,1,0,0|2,0,0]=4 11445 B14R2.991 CCCCc1ccc2c(c1)CCO2 271570a_100020621405_100000729065 [0,1,0,1,0,0|2,0,0]=4 11446 B14R2.991 CCCCc1ccc2c(c1)COC2 271570a_100020621405_100000698232 [0,1,0,1,0,0|2,0,0]=4 11447 B14R2.991 CCCCc1ccc2c(c1)OCC2 271570a_100020621405_100009818566 [0,1,0,1,0,0|2,0,0]=4 11448 B14R2.991 CCCCc1ccc2c(c1)OCO2 271570a_100020621405_100000688060 [0,1,0,1,0,0|1,0,0]=3 11449 B14R2.991 CCCCc1ccc2ccoc2c1 271570a_100020621405_100000759542 [0,1,0,1,0,0|2,0,0]=4 11450 B14R2.991 CCCCc1ccc2cnoc2c1 271570a_100020621405_100009817722 [0,1,0,1,0,0|2,0,0]=4 11451 B14R2.991 CCCCc1ccc2ncoc2c1 271570a_100020621405_100009817590 [0,1,0,1,0,0|2,0,0]=4 11452 B14R2.991 CCCCc1ccc2nonc2c1 271570a_100020621405_100009814275 [0,1,0,1,0,0|2,0,0]=4 11453 B14R2.991 CCCCc1ccc2occc2c1 271570a_100020621405_100012343831 [0,1,0,1,0,0|2,0,0]=4 11454 B14R2.991 CCCCc1ccc2ocnc2c1 271570a_100020621405_100009816175 [0,1,0,1,0,0|2,0,0]=4 11455 B14R2.991 CCCCc1ccc2oncc2c1 271570a_100020621405_100009817723 [0,1,0,1,0,0|2,0,0]=4 11456 B14R2.991 CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210303 [0,1,0,1,0,0|2,0,0]=4 11457 B14R2.991 CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000210303 [0,1,0,1,0,0|2,0,0]=4 11458 B14R2.991 CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000210303 [0,1,0,1,0,0|2,0,0]=4 11459 B14R2.991 CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210202 [0,1,0,1,0,0|2,0,0]=4 11460 B14R2.991 CCNCc1ccc2c(c1)OCO2 34a_100000210006_100000210202 [0,1,0,1,0,0|2,0,0]=4 11461 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100000210967_100000210202 [0,1,0,1,0,0|2,0,0]=4 11462 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100121572206_100000189651 [0,1,0,1,0,0|2,0,0]=4 11463 B14R2.991 CNCCc1ccc2c(c1)CCO2 2230a_106832991635_100000763274 [0,1,0,1,0,0|1,0,0]=3 11464 B14R2.991 CNCCc1ccc2c(c1)CCO2 34a_100102657272_100000763274 [0,1,0,1,0,0|1,0,0]=3 11465 B14R2.991 CNCCc1ccc2c(c1)CCO2 7a_106832991635_100000763274 [0,1,0,1,0,0|1,0,0]=3 11466 B14R2.991 CNCCc1ccc2c(c1)OCO2 2230a_100000204656_200000210301 [0,1,0,1,0,0|0,0,0]=2 11467 B14R2.991 CNCCc1ccc2c(c1)OCO2 34a_100000204656_200000210301 [0,1,0,1,0,0|0,0,0]=2 11468 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100012161074_200000210301 [0,1,0,1,0,0|2,0,0]=4 11469 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100138415774_100000763274 [0,1,0,1,0,0|2,0,0]=4 11470 B14R2.991 COCCc1ccc2c(c1)CCO2 7a_100012161074_200000210301 [0,1,0,1,0,0|2,0,0]=4 11471 B14R2.991 COCCc1ccc2c(c1)OCO2 34a_100011934097_200000210301 [0,1,0,1,0,0|1,0,0]=3 11472 B14R2.991 COCNc1ccc2c(c1)OCO2 2230a_100000209953_100000766300 [0,1,0,1,0,0|2,0,0]=4 11473 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_100000763274_200000210301 [0,1,0,1,0,0|2,0,0]=4 11474 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_200000210301_100000763274 [0,1,0,1,0,0|2,0,0]=4 11475 B14R2.991 CSCNc1ccc2c(c1)OCO2 2230a_100000209953_100011218213 [0,1,0,1,0,0|2,0,0]=4 11476 B14R2.991 CSCNc1ccc2c(c1)OCO2 34a_100000209953_100011218213 [0,1,0,1,0,0|2,0,0]=4 11477 B14R2.991 CSCOc1ccc2c(c1)OCO2 34a_100000210298_100011218213 [0,1,0,1,0,0|2,0,0]=4 11478 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 2230a_100000204656_200025704644 [0,1,0,1,0,0|0,0,0]=2 11479 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 34a_100000204656_200025704644 [0,1,0,1,0,0|0,0,0]=2 11480 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 34a_100012161074_200025704644 [0,1,0,1,0,0|2,0,0]=4 11481 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 7a_100012161074_200025704644 [0,1,0,1,0,0|2,0,0]=4 11482 B14R2.991 [13CH3]OCCc1ccc2c(c1)OCO2 34a_100011934097_200025704644 [0,1,0,1,0,0|1,0,0]=3 11483 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_100000763274_200025704644 [0,1,0,1,0,0|2,0,0]=4 11484 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_200025704644_100000763274 [0,1,0,1,0,0|2,0,0]=4 11485 B14R2.1416 COc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_200010010916 [0,1,0,1,0,0|2,0,0]=4 11486 B14R2.1416 COc1cc2cnn(c2cc1O)C 271570a_203496583355_200021298667 [0,1,0,1,0,0|1,0,1]=4 11487 B14R2.3168 COc1cc(ccc1O)NC2CC2 34a_100000726020_100000211595 [0,1,0,1,0,0|2,0,0]=4 11488 B14R2.3168 OCc1cc(ccc1O)SC2CC2 62a_100000184703_100000211595 [0,1,0,1,0,0|2,0,0]=4 11489 B14R2.92 C=Cc1ccc2c(c1O)CCCC2 271570a_100011290941_200010391107 [0,1,0,1,0,0|2,0,0]=4 11490 B14R2.92 CSc1ccc2c(c1O)CCCC2 62a_200000210301_200010391107 [0,1,0,1,0,0|1,1,0]=4 11491 B14R2.92 CSc1ccc2c(c1O)CCCC2 62a_200010391107_200000210301 [0,1,0,1,0,0|1,1,0]=4 11492 B14R2.92 [13CH3]Sc1ccc2c(c1O)CCCC2 62a_200010391107_200025704644 [0,1,0,1,0,0|1,1,0]=4 11493 B14R2.92 [13CH3]Sc1ccc2c(c1O)CCCC2 62a_200025704644_200010391107 [0,1,0,1,0,0|1,1,0]=4 11494 B14R2.2167 COc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010233615 [0,1,0,1,0,0|2,0,0]=4 11495 B14R2.2495 COc1ccc2c(c1O)C(=O)CC2 271570a_203496583355_100010009199 [0,1,0,1,0,0|2,0,0]=4 11496 B14R2.3063 COc1ccc(cc1O)NC2CC2 34a_100000211920_100000211595 [0,1,0,1,0,0|2,0,0]=4 11497 B14R2.3063 OCc1ccc(cc1O)SC2CC2 62a_100000071718_100000211595 [0,1,0,1,0,0|2,0,0]=4 11498 B14R2.10607 Cc1cc(ccc1O)NC2CCC2 34a_100011218179_100000749161 [0,1,0,1,0,0|2,0,0]=4 11499 B14R2.10607 Cc1cc(ccc1O)NC2COC2 34a_100011218179_100009818527 [0,1,0,1,0,0|2,0,0]=4 11500 B14R2.10607 Cc1cc(ccc1O)NC2COC2 7a_100011218179_100009818527 [0,1,0,1,0,0|2,0,0]=4 11501 B14R2.10607 Cc1ccc(cc1O)NC2CCC2 34a_100000759471_100000749161 [0,1,0,1,0,0|2,0,0]=4 11502 B14R2.10607 Cc1ccc(cc1O)NC2COC2 34a_100000759471_100009818527 [0,1,0,1,0,0|2,0,0]=4 11503 B14R2.10607 Cc1ccc(cc1O)NC2COC2 7a_100000759471_100009818527 [0,1,0,1,0,0|2,0,0]=4 11504 B14R2.10607 Cc1ccc(cc1O)SC2CCC2 62a_100000685420_100000749161 [0,1,0,1,0,0|2,0,0]=4 11505 B14R2.10607 Cc1ccc(cc1O)SC2COC2 62a_100000685420_100009818527 [0,1,0,1,0,0|2,0,0]=4 11506 B14R2.10607 Nc1cc(ccc1O)SC2CCC2 62a_100000752626_100000749161 [0,1,0,1,0,0|2,0,0]=4 11507 B14R2.10607 Nc1cc(ccc1O)SC2COC2 62a_100000752626_100009818527 [0,1,0,1,0,0|2,0,0]=4 11508 B14R2.10607 Nc1ccc(cc1O)SC2CCC2 62a_100000739049_100000749161 [0,1,0,1,0,0|2,0,0]=4 11509 B14R2.10607 Nc1ccc(cc1O)SC2COC2 62a_100000739049_100009818527 [0,1,0,1,0,0|2,0,0]=4 11510 B14R2.10607 Oc1cc(ccc1Br)SC2CCC2 62a_100012356990_100000749161 [0,1,0,1,0,0|2,0,0]=4 11511 B14R2.10607 Oc1cc(ccc1Br)SC2COC2 62a_100012356990_100009818527 [0,1,0,1,0,0|2,0,0]=4 11512 B14R2.10607 Oc1cc(ccc1Cl)NC2CCC2 34a_100011934209_100000749161 [0,1,0,1,0,0|2,0,0]=4 11513 B14R2.10607 Oc1cc(ccc1Cl)NC2COC2 34a_100011934209_100009818527 [0,1,0,1,0,0|2,0,0]=4 11514 B14R2.10607 Oc1cc(ccc1Cl)SC2CCC2 62a_100011356854_100000749161 [0,1,0,1,0,0|2,0,0]=4 11515 B14R2.10607 Oc1cc(ccc1Cl)SC2COC2 62a_100011356854_100009818527 [0,1,0,1,0,0|2,0,0]=4 11516 B14R2.10607 Oc1cc(ccc1F)NC2CCC2 34a_100012017398_100000749161 [0,1,0,1,0,0|2,0,0]=4 11517 B14R2.10607 Oc1cc(ccc1F)NC2COC2 34a_100012017398_100009818527 [0,1,0,1,0,0|2,0,0]=4 11518 B14R2.10607 Oc1cc(ccc1F)NC2COC2 7a_100012017398_100009818527 [0,1,0,1,0,0|2,0,0]=4 11519 B14R2.10607 Oc1cc(ccc1F)SC2CCC2 62a_100000686035_100000749161 [0,1,0,1,0,0|2,0,0]=4 11520 B14R2.10607 Oc1cc(ccc1F)SC2COC2 62a_100000686035_100009818527 [0,1,0,1,0,0|2,0,0]=4 11521 B14R2.10607 Oc1ccc(cc1Br)NC2CCC2 34a_100011534360_100000749161 [0,1,0,1,0,0|2,0,0]=4 11522 B14R2.10607 Oc1ccc(cc1Br)NC2COC2 34a_100011534360_100009818527 [0,1,0,1,0,0|2,0,0]=4 11523 B14R2.10607 Oc1ccc(cc1Br)SC2CCC2 62a_100012361655_100000749161 [0,1,0,1,0,0|2,0,0]=4 11524 B14R2.10607 Oc1ccc(cc1Br)SC2COC2 62a_100012361655_100009818527 [0,1,0,1,0,0|2,0,0]=4 11525 B14R2.10607 Oc1ccc(cc1Cl)NC2CCC2 34a_100000744943_100000749161 [0,1,0,1,0,0|2,0,0]=4 11526 B14R2.10607 Oc1ccc(cc1Cl)NC2COC2 34a_100000744943_100009818527 [0,1,0,1,0,0|2,0,0]=4 11527 B14R2.10607 Oc1ccc(cc1Cl)SC2CCC2 62a_100012360047_100000749161 [0,1,0,1,0,0|2,0,0]=4 11528 B14R2.10607 Oc1ccc(cc1Cl)SC2COC2 62a_100012360047_100009818527 [0,1,0,1,0,0|2,0,0]=4 11529 B14R2.10607 Oc1ccc(cc1F)NC2CCC2 34a_100011220035_100000749161 [0,1,0,1,0,0|2,0,0]=4 11530 B14R2.10607 Oc1ccc(cc1F)NC2COC2 34a_100011220035_100009818527 [0,1,0,1,0,0|2,0,0]=4 11531 B14R2.10607 Oc1ccc(cc1F)NC2COC2 7a_100011220035_100009818527 [0,1,0,1,0,0|2,0,0]=4 11532 B14R2.10607 Oc1ccc(cc1F)SC2CCC2 62a_100000185481_100000749161 [0,1,0,1,0,0|2,0,0]=4 11533 B14R2.10607 Oc1ccc(cc1F)SC2COC2 62a_100000185481_100009818527 [0,1,0,1,0,0|2,0,0]=4 11534 B14R2.10607 Oc1ccc(cc1O)NC2CCC2 34a_100102946323_100000749161 [0,1,0,1,0,0|1,0,0]=3 11535 B14R2.10607 Oc1ccc(cc1O)NC2COC2 34a_100102946323_100009818527 [0,1,0,1,0,0|1,0,0]=3 11536 B14R2.12145 CNC1CCc2c1cc(c(c2)Br)Br 269862a_106832991636_100010284488 [0,1,0,1,0,0|2,0,0]=4 11537 B14R2.12145 CNC1CCc2c1cc(c(c2)Br)C 269862a_106832991636_100010010902 [0,1,0,1,0,0|2,0,0]=4 11538 B14R2.12145 CNC1CCc2c1cc(c(c2)Br)Cl 269862a_106832991636_100010133453 [0,1,0,1,0,0|2,0,0]=4 11539 B14R2.12145 CNC1CCc2c1cc(c(c2)Br)F 269862a_106832991636_100010010804 [0,1,0,1,0,0|2,0,0]=4 11540 B14R2.12145 CNC1CCc2c1cc(c(c2)C)Br 269862a_106832991636_100010133461 [0,1,0,1,0,0|2,0,0]=4 11541 B14R2.12145 CNC1CCc2c1cc(c(c2)C)C 269862a_106832991636_100000076440 [0,1,0,1,0,0|2,0,0]=4 11542 B14R2.12145 CNC1CCc2c1cc(c(c2)C)Cl 269862a_106832991636_200009856417 [0,1,0,1,0,0|2,0,0]=4 11543 B14R2.12145 CNC1CCc2c1cc(c(c2)Cl)Br 269862a_106832991636_100010133531 [0,1,0,1,0,0|2,0,0]=4 11544 B14R2.12145 CNC1CCc2c1cc(c(c2)Cl)Cl 269862a_106832991636_100010200749 [0,1,0,1,0,0|2,0,0]=4 11545 B14R2.12145 CNC1CCc2c1cc(c(c2)Cl)F 269862a_106832991636_100009884274 [0,1,0,1,0,0|2,0,0]=4 11546 B14R2.12145 CNC1CCc2c1cc(c(c2)F)Br 269862a_106832991636_100010010871 [0,1,0,1,0,0|2,0,0]=4 11547 B14R2.12145 CNC1CCc2c1cc(c(c2)F)C 269862a_106832991636_100000103982 [0,1,0,1,0,0|2,0,0]=4 11548 B14R2.12145 CNC1CCc2c1cc(c(c2)F)Cl 269862a_106832991636_100009840612 [0,1,0,1,0,0|2,0,0]=4 11549 B14R2.12145 CNC1CCc2c1cc(c(c2)F)F 269862a_106832991636_100000086044 [0,1,0,1,0,0|2,0,0]=4 11550 B14R2.12145 CNC1CCc2c1cc(c(c2)F)O 269862a_106832991636_100000092147 [0,1,0,1,0,0|1,0,0]=3 11551 B14R2.12145 CN[C@H]1CCc2c1cc(c(c2)F)F 2230a_100138412301_200000210301 [0,1,0,1,0,0|2,0,0]=4 11552 B14R2.12145 CN[C@H]1CCc2c1cc(c(c2)F)F 34a_100138412301_200000210301 [0,1,0,1,0,0|2,0,0]=4 11553 B14R2.12145 [13CH3]N[C@H]1CCc2c1cc(c(c2)F)F 2230a_100138412301_200025704644 [0,1,0,1,0,0|2,0,0]=4 11554 B14R2.12145 [13CH3]N[C@H]1CCc2c1cc(c(c2)F)F 34a_100138412301_200025704644 [0,1,0,1,0,0|2,0,0]=4 11555 B10R1.16 CNCCc1ccc(o1)C 2230a_100000739271_200000210301 [1,0,0,0,1,0|2,0,0]=4 11556 B10R1.16 CNCCc1ccc(o1)C 34a_100000739271_200000210301 [1,0,0,0,1,0|2,0,0]=4 11557 B10R1.16 CNCCc1ccc(s1)Br 2230a_100000217605_200000210301 [1,0,0,0,1,0|2,0,0]=4 11558 B10R1.16 Cc1ccc(o1)CCN[13CH3] 2230a_100000739271_200025704644 [1,0,0,0,1,0|2,0,0]=4 11559 B10R1.16 Cc1ccc(o1)CCN[13CH3] 34a_100000739271_200025704644 [1,0,0,0,1,0|2,0,0]=4 11560 B10R1.16 [13CH3]NCCc1ccc(s1)Br 2230a_100000217605_200025704644 [1,0,0,0,1,0|2,0,0]=4 11561 B10R1.29 CCCCc1ccsc1O 271570a_203496583355_100010071534 [1,0,0,0,1,0|2,0,0]=4 11562 B10R1.29 CNCCc1cccn1C 2230a_100011251756_200000210301 [1,0,0,0,1,0|2,0,0]=4 11563 B10R1.29 CNCCc1cccn1C 34a_100011251756_200000210301 [1,0,0,0,1,0|2,0,0]=4 11564 B10R1.29 Cn1cccc1CCN[13CH3] 2230a_100011251756_200025704644 [1,0,0,0,1,0|2,0,0]=4 11565 B10R1.29 Cn1cccc1CCN[13CH3] 34a_100011251756_200025704644 [1,0,0,0,1,0|2,0,0]=4