0 B10R1.25 C=Cc1c[nH]c(=O)nc1N 271570a_100011290941_100000050048 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.25 C=Cc1ccc(nc1N)Cl 271570a_100011290941_100010171640 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.25 C=Cc1ccc(nc1N)F 271570a_100011290941_100009854977 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.25 C=Cc1ccc(nc1N)N 271570a_100011290941_100011356871 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.25 C=Cc1cnc([nH]c1=O)C 271570a_100011290941_100011999157 [0,0,0,0,0,0|2,0,2]=4 10 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.25 C=Cc1cnc(cc1N)N 271570a_100011290941_200009857908 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.25 C=Cc1cnc(cc1O)C 271570a_100011290941_100011016184 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.25 C=Cc1cnc(nc1C)N 271570a_100011290941_100000725598 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.25 C=Cc1cnc(nc1F)F 271570a_100011290941_100009820707 [0,0,0,0,0,0|3,0,1]=4 16 B10R1.25 C=Cc1cnc(nc1N)C 271570a_100011290941_100000684960 [0,0,0,0,0,0|1,0,1]=2 17 B10R1.25 C=Cc1cnc(nc1N)N 271570a_100011290941_200010734216 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.25 CCc1ccc(cc1N)O 271570a_203496583355_100012354963 [0,0,0,0,0,0|4,0,0]=4 19 B10R1.25 CCc1cnc(cc1O)C 271570a_203496583355_100010291839 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.25 CCc1cnc(nc1O)C 271570a_203496583355_200000069817 [0,0,0,0,0,0|2,0,0]=2 21 B10R1.25 CNc1cnc(cc1N)O 271570a_203496583355_200015721873 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.25 COc1ccc(cc1N)C 34a_100011215204_200000210301 [0,0,0,0,0,0|4,0,0]=4 23 B10R1.25 COc1ccc(cc1N)C 7a_100011215204_200000210301 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.25 COc1ccc(nc1Br)C 34a_100000702858_200000210301 [0,0,0,0,0,0|4,0,0]=4 25 B10R1.25 COc1ccc(nc1Br)C 7a_100000702858_200000210301 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.25 COc1ccc(nc1C)C 34a_100011218912_200000210301 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.25 COc1ccc(nc1C)C 7a_100011218912_200000210301 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.25 COc1ccc(nc1Cl)C 34a_100000086286_200000210301 [0,0,0,0,0,0|4,0,0]=4 29 B10R1.25 COc1ccc(nc1Cl)C 7a_100000086286_200000210301 [0,0,0,0,0,0|4,0,0]=4 30 B10R1.25 COc1ccc(nc1F)C 34a_100000079963_200000210301 [0,0,0,0,0,0|4,0,0]=4 31 B10R1.25 COc1ccc(nc1F)C 7a_100000079963_200000210301 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.25 COc1ccc(nc1I)C 34a_100000023897_200000210301 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.25 COc1ccc(nc1I)C 7a_100000023897_200000210301 [0,0,0,0,0,0|4,0,0]=4 34 B10R1.25 COc1ccc(nc1N)Br 34a_100000685527_200000210301 [0,0,0,0,0,0|4,0,0]=4 35 B10R1.25 COc1ccc(nc1N)Br 7a_100000685527_200000210301 [0,0,0,0,0,0|4,0,0]=4 36 B10R1.25 COc1ccc(nc1N)C 34a_100000694039_200000210301 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.25 COc1ccc(nc1N)C 7a_100000694039_200000210301 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.25 COc1ccc(nc1N)Cl 34a_100000717809_200000210301 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.25 COc1ccc(nc1N)Cl 7a_100000717809_200000210301 [0,0,0,0,0,0|4,0,0]=4 40 B10R1.25 COc1ccc(nc1N)O 271570a_203496583355_100010192976 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.25 COc1ccc(nc1O)C 271570a_203496583355_100009820875 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.25 COc1cnc(cc1Br)C 34a_100009843476_200000210301 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.25 COc1cnc(cc1Br)C 7a_100009843476_200000210301 [0,0,0,0,0,0|4,0,0]=4 44 B10R1.25 COc1cnc(cc1C)C 34a_200000068632_200000210301 [0,0,0,0,0,0|4,0,0]=4 45 B10R1.25 COc1cnc(cc1C)C 7a_200000068632_200000210301 [0,0,0,0,0,0|4,0,0]=4 46 B10R1.25 COc1cnc(cc1N)Br 34a_100009819941_200000210301 [0,0,0,0,0,0|4,0,0]=4 47 B10R1.25 COc1cnc(cc1N)Br 7a_100009819941_200000210301 [0,0,0,0,0,0|4,0,0]=4 48 B10R1.25 COc1cnc(cc1N)O 271570a_203496583355_100010896307 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.25 COc1cnc(cc1O)C 271570a_203496583355_100010109759 [0,0,0,0,0,0|4,0,0]=4 50 B10R1.25 COc1cnc(nc1C)C 34a_100009864123_200000210301 [0,0,0,0,0,0|3,0,0]=3 51 B10R1.25 COc1cnc(nc1C)C 7a_100009864123_200000210301 [0,0,0,0,0,0|3,0,0]=3 52 B10R1.25 COc1cnc(nc1C)O 271570a_203496583355_100010382893 [0,0,0,0,0,0|4,0,0]=4 53 B10R1.25 COc1cnc(nc1Cl)Cl 34a_100010725077_200000210301 [0,0,0,0,0,0|4,0,0]=4 54 B10R1.25 COc1cnc(nc1Cl)Cl 7a_100010725077_200000210301 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.25 COc1cnc(nc1N)N 7a_100025726691_200000210301 [0,0,0,0,0,0|3,0,0]=3 56 B10R1.25 COc1cnc(nc1N)O 271570a_203496583355_100009886850 [0,0,0,0,0,0|3,0,0]=3 57 B10R1.25 CSc1ccc(cc1N)C 62a_100011216686_200000210301 [0,0,0,0,0,0|4,0,0]=4 58 B10R1.25 CSc1ccc(cc1N)C 62a_200000210301_100011216686 [0,0,0,0,0,0|4,0,0]=4 59 B10R1.25 CSc1ccc(nc1C)C 62a_100009813853_200000210301 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.25 CSc1ccc(nc1C)C 62a_200000210301_100009813853 [0,0,0,0,0,0|4,0,0]=4 61 B10R1.25 CSc1ccc(nc1F)C 62a_100010006597_200000210301 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.25 CSc1ccc(nc1F)C 62a_200000210301_100010006597 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.25 CSc1ccc(nc1N)C 62a_100009816662_200000210301 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.25 CSc1ccc(nc1N)C 62a_200000210301_100009816662 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.25 CSc1ccc(nc1N)Cl 62a_100010171640_200000210301 [0,0,0,0,0,0|4,0,0]=4 66 B10R1.25 CSc1ccc(nc1N)Cl 62a_200000210301_100010171640 [0,0,0,0,0,0|4,0,0]=4 67 B10R1.25 CSc1ccc(nc1N)F 62a_100009854977_200000210301 [0,0,0,0,0,0|4,0,0]=4 68 B10R1.25 CSc1ccc(nc1N)F 62a_200000210301_100009854977 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.25 CSc1ccc(nc1N)N 62a_100011356871_200000210301 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.25 CSc1ccc(nc1O)C 62a_100009817604_200000210301 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.25 CSc1ccc(nc1O)C 62a_200000210301_100009817604 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.25 CSc1cnc(=O)[nH]c1N 62a_100000708077_200000210301 [0,0,0,0,0,0|3,0,1]=4 73 B10R1.25 CSc1cnc(=O)[nH]c1N 62a_200000210301_100000708077 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.25 CSc1cnc([nH]c1=O)C 62a_100011999157_200000210301 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.25 CSc1cnc([nH]c1=O)C 62a_200000210301_100011999157 [0,0,0,0,0,0|3,0,1]=4 76 B10R1.25 CSc1cnc(cc1C)C 62a_100009819613_200000210301 [0,0,0,0,0,0|4,0,0]=4 77 B10R1.25 CSc1cnc(cc1C)C 62a_200000210301_100009819613 [0,0,0,0,0,0|4,0,0]=4 78 B10R1.25 CSc1cnc(cc1N)C 62a_100009817891_200000210301 [0,0,0,0,0,0|3,0,0]=3 79 B10R1.25 CSc1cnc(cc1N)C 62a_200000210301_100009817891 [0,0,0,0,0,0|3,0,0]=3 80 B10R1.25 CSc1cnc(cc1N)Cl 62a_100010209552_200000210301 [0,0,0,0,0,0|4,0,0]=4 81 B10R1.25 CSc1cnc(cc1N)Cl 62a_200000210301_100010209552 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.25 CSc1cnc(cc1N)N 62a_200000210301_200009857908 [0,0,0,0,0,0|4,0,0]=4 83 B10R1.25 CSc1cnc(cc1N)N 62a_200009857908_200000210301 [0,0,0,0,0,0|4,0,0]=4 84 B10R1.25 CSc1cnc(cc1O)C 62a_100011016184_200000210301 [0,0,0,0,0,0|4,0,0]=4 85 B10R1.25 CSc1cnc(cc1O)C 62a_200000210301_100011016184 [0,0,0,0,0,0|4,0,0]=4 86 B10R1.25 CSc1cnc(nc1C)N 62a_100000725598_200000210301 [0,0,0,0,0,0|4,0,0]=4 87 B10R1.25 CSc1cnc(nc1C)N 62a_200000210301_100000725598 [0,0,0,0,0,0|4,0,0]=4 88 B10R1.25 CSc1cnc(nc1Cl)Cl 62a_200000210301_100000049956 [0,0,0,0,0,0|4,0,0]=4 89 B10R1.25 CSc1cnc(nc1F)F 62a_100009820707_200000210301 [0,0,0,0,0,0|4,0,0]=4 90 B10R1.25 CSc1cnc(nc1F)F 62a_200000210301_100009820707 [0,0,0,0,0,0|4,0,0]=4 91 B10R1.25 CSc1cnc(nc1N)C 62a_100000684960_200000210301 [0,0,0,0,0,0|2,0,0]=2 92 B10R1.25 CSc1cnc(nc1N)C 62a_200000210301_100000684960 [0,0,0,0,0,0|2,0,0]=2 93 B10R1.25 CSc1cnc(nc1N)Cl 62a_100010196077_200000210301 [0,0,0,0,0,0|3,0,0]=3 94 B10R1.25 CSc1cnc(nc1N)Cl 62a_200000210301_100010196077 [0,0,0,0,0,0|3,0,0]=3 95 B10R1.25 CSc1cnc(nc1N)N 62a_200000210301_200010734216 [0,0,0,0,0,0|3,0,0]=3 96 B10R1.25 CSc1cnc(nc1N)N 62a_200010734216_200000210301 [0,0,0,0,0,0|3,0,0]=3 97 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 34a_100009843476_200025704644 [0,0,0,0,0,0|4,0,0]=4 98 B10R1.25 Cc1cc(c(cn1)O[13CH3])Br 7a_100009843476_200025704644 [0,0,0,0,0,0|4,0,0]=4 99 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 34a_200000068632_200025704644 [0,0,0,0,0,0|4,0,0]=4 100 B10R1.25 Cc1cc(c(cn1)O[13CH3])C 7a_200000068632_200025704644 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.25 Cc1cc(c(cn1)S[13CH3])C 62a_100009819613_200025704644 [0,0,0,0,0,0|4,0,0]=4 102 B10R1.25 Cc1cc(c(cn1)S[13CH3])C 62a_200025704644_100009819613 [0,0,0,0,0,0|4,0,0]=4 103 B10R1.25 Cc1cc(c(cn1)S[13CH3])N 62a_100009817891_200025704644 [0,0,0,0,0,0|3,0,0]=3 104 B10R1.25 Cc1cc(c(cn1)S[13CH3])N 62a_200025704644_100009817891 [0,0,0,0,0,0|3,0,0]=3 105 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_100011016184_200025704644 [0,0,0,0,0,0|4,0,0]=4 106 B10R1.25 Cc1cc(c(cn1)S[13CH3])O 62a_200025704644_100011016184 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.25 Cc1cc(ccc1CO)O 271570a_203496583355_100000748258 [0,0,0,0,0,0|4,0,0]=4 108 B10R1.25 Cc1cc(ncc1CO)O 271570a_203496583355_100010277336 [0,0,0,0,0,0|3,0,0]=3 109 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 34a_100011215204_200025704644 [0,0,0,0,0,0|4,0,0]=4 110 B10R1.25 Cc1ccc(c(c1)N)O[13CH3] 7a_100011215204_200025704644 [0,0,0,0,0,0|4,0,0]=4 111 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_100011216686_200025704644 [0,0,0,0,0,0|4,0,0]=4 112 B10R1.25 Cc1ccc(c(c1)N)S[13CH3] 62a_200025704644_100011216686 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 34a_100000702858_200025704644 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.25 Cc1ccc(c(n1)Br)O[13CH3] 7a_100000702858_200025704644 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 34a_100011218912_200025704644 [0,0,0,0,0,0|4,0,0]=4 116 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 7a_100011218912_200025704644 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_100009813853_200025704644 [0,0,0,0,0,0|4,0,0]=4 118 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100009813853 [0,0,0,0,0,0|4,0,0]=4 119 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 34a_100000086286_200025704644 [0,0,0,0,0,0|4,0,0]=4 120 B10R1.25 Cc1ccc(c(n1)Cl)O[13CH3] 7a_100000086286_200025704644 [0,0,0,0,0,0|4,0,0]=4 121 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 34a_100000079963_200025704644 [0,0,0,0,0,0|4,0,0]=4 122 B10R1.25 Cc1ccc(c(n1)F)O[13CH3] 7a_100000079963_200025704644 [0,0,0,0,0,0|4,0,0]=4 123 B10R1.25 Cc1ccc(c(n1)F)S[13CH3] 62a_100010006597_200025704644 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.25 Cc1ccc(c(n1)F)S[13CH3] 62a_200025704644_100010006597 [0,0,0,0,0,0|4,0,0]=4 125 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 34a_100000023897_200025704644 [0,0,0,0,0,0|4,0,0]=4 126 B10R1.25 Cc1ccc(c(n1)I)O[13CH3] 7a_100000023897_200025704644 [0,0,0,0,0,0|4,0,0]=4 127 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 34a_100000694039_200025704644 [0,0,0,0,0,0|3,0,0]=3 128 B10R1.25 Cc1ccc(c(n1)N)O[13CH3] 7a_100000694039_200025704644 [0,0,0,0,0,0|3,0,0]=3 129 B10R1.25 Cc1ccc(c(n1)N)S[13CH3] 62a_100009816662_200025704644 [0,0,0,0,0,0|3,0,0]=3 130 B10R1.25 Cc1ccc(c(n1)N)S[13CH3] 62a_200025704644_100009816662 [0,0,0,0,0,0|3,0,0]=3 131 B10R1.25 Cc1ccc(c(n1)O)C#N 271570a_203496583355_100000741175 [0,0,0,0,0,0|3,0,1]=4 132 B10R1.25 Cc1ccc(c(n1)O)C=O 271570a_203496583355_100000085379 [0,0,0,0,0,0|2,0,2]=4 133 B10R1.25 Cc1ccc(c(n1)O)CO 271570a_203496583355_102495338573 [0,0,0,0,0,0|2,0,0]=2 134 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_100009817604_200025704644 [0,0,0,0,0,0|4,0,0]=4 135 B10R1.25 Cc1ccc(c(n1)O)S[13CH3] 62a_200025704644_100009817604 [0,0,0,0,0,0|4,0,0]=4 136 B10R1.25 Cc1nc(ncc1S[13CH3])N 62a_100000725598_200025704644 [0,0,0,0,0,0|4,0,0]=4 137 B10R1.25 Cc1nc(ncc1S[13CH3])N 62a_200025704644_100000725598 [0,0,0,0,0,0|4,0,0]=4 138 B10R1.25 Cc1ncc(c(=O)[nH]1)S[13CH3] 62a_100011999157_200025704644 [0,0,0,0,0,0|3,0,1]=4 139 B10R1.25 Cc1ncc(c(=O)[nH]1)S[13CH3] 62a_200025704644_100011999157 [0,0,0,0,0,0|3,0,1]=4 140 B10R1.25 Cc1ncc(c(n1)C)O[13CH3] 34a_100009864123_200025704644 [0,0,0,0,0,0|3,0,0]=3 141 B10R1.25 Cc1ncc(c(n1)C)O[13CH3] 7a_100009864123_200025704644 [0,0,0,0,0,0|3,0,0]=3 142 B10R1.25 Cc1ncc(c(n1)N)S[13CH3] 62a_100000684960_200025704644 [0,0,0,0,0,0|2,0,0]=2 143 B10R1.25 Cc1ncc(c(n1)N)S[13CH3] 62a_200025704644_100000684960 [0,0,0,0,0,0|2,0,0]=2 144 B10R1.25 Cc1ncc(c(n1)O)C#N 271570a_203496583355_200012187075 [0,0,0,0,0,0|2,0,1]=3 145 B10R1.25 N#Cc1ccc(nc1N)O 271570a_203496583355_100000719313 [0,0,0,0,0,0|3,0,1]=4 146 B10R1.25 N#Cc1cnc(nc1N)O 271570a_203496583355_100000041447 [0,0,0,0,0,0|2,0,1]=3 147 B10R1.25 Nc1cc(ccc1CO)O 271570a_203496583355_100000718831 [0,0,0,0,0,0|3,0,0]=3 148 B10R1.25 Nc1cc(ncc1CO)O 271570a_203496583355_100009830438 [0,0,0,0,0,0|2,0,0]=2 149 B10R1.25 Nc1nc(ncc1CO)O 271570a_203496583355_200009965464 [0,0,0,0,0,0|1,0,0]=1 150 B10R1.25 OCc1ccc(cc1Br)O 271570a_203496583355_100010240206 [0,0,0,0,0,0|4,0,0]=4 151 B10R1.25 OCc1ccc(cc1F)O 271570a_203496583355_100011191541 [0,0,0,0,0,0|4,0,0]=4 152 B10R1.25 OCc1ccc(cc1O)Br 271570a_203496583355_100010146605 [0,0,0,0,0,0|4,0,0]=4 153 B10R1.25 OCc1ccc(cc1O)Cl 271570a_203496583355_100000722340 [0,0,0,0,0,0|4,0,0]=4 154 B10R1.25 OCc1ccc(cc1O)F 271570a_203496583355_100000744086 [0,0,0,0,0,0|4,0,0]=4 155 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100000071718 [0,0,0,0,0,0|4,0,0]=4 156 B10R1.25 OCc1ccc(cc1O)O 271570a_203496583355_100010146404 [0,0,0,0,0,0|4,0,0]=4 157 B10R1.25 OCc1ccc(nc1F)O 271570a_203496583355_100009870654 [0,0,0,0,0,0|3,0,0]=3 158 B10R1.25 [13CH3]Oc1ccc(nc1N)Br 34a_100000685527_200025704644 [0,0,0,0,0,0|4,0,0]=4 159 B10R1.25 [13CH3]Oc1ccc(nc1N)Br 7a_100000685527_200025704644 [0,0,0,0,0,0|4,0,0]=4 160 B10R1.25 [13CH3]Oc1ccc(nc1N)Cl 34a_100000717809_200025704644 [0,0,0,0,0,0|4,0,0]=4 161 B10R1.25 [13CH3]Oc1ccc(nc1N)Cl 7a_100000717809_200025704644 [0,0,0,0,0,0|4,0,0]=4 162 B10R1.25 [13CH3]Oc1cnc(cc1N)Br 34a_100009819941_200025704644 [0,0,0,0,0,0|4,0,0]=4 163 B10R1.25 [13CH3]Oc1cnc(cc1N)Br 7a_100009819941_200025704644 [0,0,0,0,0,0|4,0,0]=4 164 B10R1.25 [13CH3]Oc1cnc(nc1Cl)Cl 34a_100010725077_200025704644 [0,0,0,0,0,0|4,0,0]=4 165 B10R1.25 [13CH3]Oc1cnc(nc1Cl)Cl 7a_100010725077_200025704644 [0,0,0,0,0,0|4,0,0]=4 166 B10R1.25 [13CH3]Oc1cnc(nc1N)N 7a_100025726691_200025704644 [0,0,0,0,0,0|3,0,0]=3 167 B10R1.25 [13CH3]Sc1ccc(nc1N)Cl 62a_100010171640_200025704644 [0,0,0,0,0,0|4,0,0]=4 168 B10R1.25 [13CH3]Sc1ccc(nc1N)Cl 62a_200025704644_100010171640 [0,0,0,0,0,0|4,0,0]=4 169 B10R1.25 [13CH3]Sc1ccc(nc1N)F 62a_100009854977_200025704644 [0,0,0,0,0,0|4,0,0]=4 170 B10R1.25 [13CH3]Sc1ccc(nc1N)F 62a_200025704644_100009854977 [0,0,0,0,0,0|4,0,0]=4 171 B10R1.25 [13CH3]Sc1ccc(nc1N)N 62a_100011356871_200025704644 [0,0,0,0,0,0|4,0,0]=4 172 B10R1.25 [13CH3]Sc1cnc(=O)[nH]c1N 62a_100000708077_200025704644 [0,0,0,0,0,0|3,0,1]=4 173 B10R1.25 [13CH3]Sc1cnc(=O)[nH]c1N 62a_200025704644_100000708077 [0,0,0,0,0,0|3,0,1]=4 174 B10R1.25 [13CH3]Sc1cnc(cc1N)Cl 62a_100010209552_200025704644 [0,0,0,0,0,0|4,0,0]=4 175 B10R1.25 [13CH3]Sc1cnc(cc1N)Cl 62a_200025704644_100010209552 [0,0,0,0,0,0|4,0,0]=4 176 B10R1.25 [13CH3]Sc1cnc(cc1N)N 62a_200009857908_200025704644 [0,0,0,0,0,0|4,0,0]=4 177 B10R1.25 [13CH3]Sc1cnc(cc1N)N 62a_200025704644_200009857908 [0,0,0,0,0,0|4,0,0]=4 178 B10R1.25 [13CH3]Sc1cnc(nc1Cl)Cl 62a_200025704644_100000049956 [0,0,0,0,0,0|4,0,0]=4 179 B10R1.25 [13CH3]Sc1cnc(nc1F)F 62a_100009820707_200025704644 [0,0,0,0,0,0|4,0,0]=4 180 B10R1.25 [13CH3]Sc1cnc(nc1F)F 62a_200025704644_100009820707 [0,0,0,0,0,0|4,0,0]=4 181 B10R1.25 [13CH3]Sc1cnc(nc1N)Cl 62a_100010196077_200025704644 [0,0,0,0,0,0|3,0,0]=3 182 B10R1.25 [13CH3]Sc1cnc(nc1N)Cl 62a_200025704644_100010196077 [0,0,0,0,0,0|3,0,0]=3 183 B10R1.25 [13CH3]Sc1cnc(nc1N)N 62a_200010734216_200025704644 [0,0,0,0,0,0|3,0,0]=3 184 B10R1.25 [13CH3]Sc1cnc(nc1N)N 62a_200025704644_200010734216 [0,0,0,0,0,0|3,0,0]=3 185 B9R1.1 C=Cc1ccc(nc1)C 271570a_100011290941_100000751577 [1,0,0,0,0,0|2,0,1]=4 186 B9R1.1 C=Cc1cnc(nc1)Br 271570a_100011290941_200012349914 [1,0,0,0,0,0|2,0,1]=4 187 B9R1.1 C=Cc1cnc(nc1)C 271570a_100011290941_100000686985 [1,0,0,0,0,0|1,0,1]=3 188 B9R1.1 C=Cc1cnc(nc1)F 271570a_100011290941_100000685262 [1,0,0,0,0,0|2,0,1]=4 189 B9R1.1 C=Cc1cnc(nc1)N 271570a_100011290941_100000760574 [1,0,0,0,0,0|2,0,1]=4 190 B9R1.1 CCc1ccc(nc1)O 271570a_203496583355_100009843584 [1,0,0,0,0,0|3,0,0]=4 191 B9R1.1 CCc1cnc(nc1)O 271570a_203496583355_100000033099 [1,0,0,0,0,0|2,0,0]=3 192 B9R1.1 COc1ccc(nc1)C 34a_100000745506_200000210301 [1,0,0,0,0,0|3,0,0]=4 193 B9R1.1 COc1ccc(nc1)C 7a_100000745506_200000210301 [1,0,0,0,0,0|3,0,0]=4 194 B9R1.1 COc1cnc(nc1)Br 34a_100000730009_200000210301 [1,0,0,0,0,0|3,0,0]=4 195 B9R1.1 COc1cnc(nc1)Br 7a_100000730009_200000210301 [1,0,0,0,0,0|3,0,0]=4 196 B9R1.1 COc1cnc(nc1)C 34a_100000062939_200000210301 [1,0,0,0,0,0|2,0,0]=3 197 B9R1.1 COc1cnc(nc1)C 7a_100000062939_200000210301 [1,0,0,0,0,0|2,0,0]=3 198 B9R1.1 COc1cnc(nc1)Cl 34a_100000092845_200000210301 [1,0,0,0,0,0|3,0,0]=4 199 B9R1.1 COc1cnc(nc1)Cl 7a_100000092845_200000210301 [1,0,0,0,0,0|3,0,0]=4 200 B9R1.1 COc1cnc(nc1)F 34a_200009874573_200000210301 [1,0,0,0,0,0|3,0,0]=4 201 B9R1.1 COc1cnc(nc1)F 7a_200009874573_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B9R1.1 COc1cnc(nc1)N 34a_100000087137_200000210301 [1,0,0,0,0,0|3,0,0]=4 203 B9R1.1 COc1cnc(nc1)N 7a_100000087137_200000210301 [1,0,0,0,0,0|3,0,0]=4 204 B9R1.1 COc1cnc(nc1)O 271570a_203496583355_100000069167 [1,0,0,0,0,0|3,0,0]=4 205 B9R1.1 CSc1ccc(nc1)C 62a_100000751577_200000210301 [1,0,0,0,0,0|3,0,0]=4 206 B9R1.1 CSc1ccc(nc1)C 62a_200000210301_100000751577 [1,0,0,0,0,0|3,0,0]=4 207 B9R1.1 CSc1cnc(nc1)Br 62a_200000210301_200012349914 [1,0,0,0,0,0|3,0,0]=4 208 B9R1.1 CSc1cnc(nc1)Br 62a_200012349914_200000210301 [1,0,0,0,0,0|3,0,0]=4 209 B9R1.1 CSc1cnc(nc1)C 62a_100000686985_200000210301 [1,0,0,0,0,0|2,0,0]=3 210 B9R1.1 CSc1cnc(nc1)C 62a_200000210301_100000686985 [1,0,0,0,0,0|2,0,0]=3 211 B9R1.1 CSc1cnc(nc1)Cl 62a_100000059775_200000210301 [1,0,0,0,0,0|3,0,0]=4 212 B9R1.1 CSc1cnc(nc1)Cl 62a_200000210301_100000059775 [1,0,0,0,0,0|3,0,0]=4 213 B9R1.1 CSc1cnc(nc1)F 62a_100000685262_200000210301 [1,0,0,0,0,0|3,0,0]=4 214 B9R1.1 CSc1cnc(nc1)F 62a_200000210301_100000685262 [1,0,0,0,0,0|3,0,0]=4 215 B9R1.1 CSc1cnc(nc1)N 62a_100000766020_200000210301 [1,0,0,0,0,0|3,0,0]=4 216 B9R1.1 CSc1cnc(nc1)N 62a_200000210301_100000766020 [1,0,0,0,0,0|3,0,0]=4 217 B9R1.1 CSc1cnc(nc1)O 271570a_203496583355_100000718988 [1,0,0,0,0,0|3,0,0]=4 218 B9R1.1 Cc1ccc(cn1)O[13CH3] 34a_100000745506_200025704644 [1,0,0,0,0,0|3,0,0]=4 219 B9R1.1 Cc1ccc(cn1)O[13CH3] 7a_100000745506_200025704644 [1,0,0,0,0,0|3,0,0]=4 220 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_100000751577_200025704644 [1,0,0,0,0,0|3,0,0]=4 221 B9R1.1 Cc1ccc(cn1)S[13CH3] 62a_200025704644_100000751577 [1,0,0,0,0,0|3,0,0]=4 222 B9R1.1 Cc1ncc(cn1)O[13CH3] 34a_100000062939_200025704644 [1,0,0,0,0,0|2,0,0]=3 223 B9R1.1 Cc1ncc(cn1)O[13CH3] 7a_100000062939_200025704644 [1,0,0,0,0,0|2,0,0]=3 224 B9R1.1 Cc1ncc(cn1)S[13CH3] 62a_100000686985_200025704644 [1,0,0,0,0,0|2,0,0]=3 225 B9R1.1 Cc1ncc(cn1)S[13CH3] 62a_200025704644_100000686985 [1,0,0,0,0,0|2,0,0]=3 226 B9R1.1 N#Cc1cnc(nc1)O 271570a_203496583355_100000099682 [1,0,0,0,0,0|2,0,1]=4 227 B9R1.1 NCc1ccc(nc1)O 271570a_203496583355_100009817727 [1,0,0,0,0,0|3,0,0]=4 228 B9R1.1 O=Cc1cnc(nc1)O 271570a_203496583355_100000070856 [1,0,0,0,0,0|1,0,2]=4 229 B9R1.1 OCc1ccc(cc1)O 271570a_203496583355_100000690907 [1,0,0,0,0,0|3,0,0]=4 230 B9R1.1 OCc1ccc(nc1)O 271570a_203496583355_100009816760 [1,0,0,0,0,0|2,0,0]=3 231 B9R1.1 OCc1cnc(cn1)O 271570a_203496583355_100012002382 [1,0,0,0,0,0|3,0,0]=4 232 B9R1.1 OCc1cnc(nc1)O 271570a_203496583355_100009855073 [1,0,0,0,0,0|1,0,0]=2 233 B9R1.1 [13CH3]Oc1cnc(nc1)Br 34a_100000730009_200025704644 [1,0,0,0,0,0|3,0,0]=4 234 B9R1.1 [13CH3]Oc1cnc(nc1)Br 7a_100000730009_200025704644 [1,0,0,0,0,0|3,0,0]=4 235 B9R1.1 [13CH3]Oc1cnc(nc1)Cl 34a_100000092845_200025704644 [1,0,0,0,0,0|3,0,0]=4 236 B9R1.1 [13CH3]Oc1cnc(nc1)Cl 7a_100000092845_200025704644 [1,0,0,0,0,0|3,0,0]=4 237 B9R1.1 [13CH3]Oc1cnc(nc1)F 34a_200009874573_200025704644 [1,0,0,0,0,0|3,0,0]=4 238 B9R1.1 [13CH3]Oc1cnc(nc1)F 7a_200009874573_200025704644 [1,0,0,0,0,0|3,0,0]=4 239 B9R1.1 [13CH3]Oc1cnc(nc1)N 34a_100000087137_200025704644 [1,0,0,0,0,0|3,0,0]=4 240 B9R1.1 [13CH3]Oc1cnc(nc1)N 7a_100000087137_200025704644 [1,0,0,0,0,0|3,0,0]=4 241 B9R1.1 [13CH3]Sc1cnc(nc1)Br 62a_200012349914_200025704644 [1,0,0,0,0,0|3,0,0]=4 242 B9R1.1 [13CH3]Sc1cnc(nc1)Br 62a_200025704644_200012349914 [1,0,0,0,0,0|3,0,0]=4 243 B9R1.1 [13CH3]Sc1cnc(nc1)Cl 62a_100000059775_200025704644 [1,0,0,0,0,0|3,0,0]=4 244 B9R1.1 [13CH3]Sc1cnc(nc1)Cl 62a_200025704644_100000059775 [1,0,0,0,0,0|3,0,0]=4 245 B9R1.1 [13CH3]Sc1cnc(nc1)F 62a_100000685262_200025704644 [1,0,0,0,0,0|3,0,0]=4 246 B9R1.1 [13CH3]Sc1cnc(nc1)F 62a_200025704644_100000685262 [1,0,0,0,0,0|3,0,0]=4 247 B9R1.1 [13CH3]Sc1cnc(nc1)N 62a_100000766020_200025704644 [1,0,0,0,0,0|3,0,0]=4 248 B9R1.1 [13CH3]Sc1cnc(nc1)N 62a_200025704644_100000766020 [1,0,0,0,0,0|3,0,0]=4 249 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [1,0,0,0,0,0|2,0,1]=4 250 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [1,0,0,0,0,0|2,0,1]=4 251 B9R1.15 C=Cc1cncnc1Br 271570a_100011290941_200012461658 [1,0,0,0,0,0|2,0,1]=4 252 B9R1.15 C=Cc1cncnc1C 271570a_100011290941_100009819671 [1,0,0,0,0,0|2,0,1]=4 253 B9R1.15 C=Cc1cncnc1Cl 271570a_100011290941_100000758962 [1,0,0,0,0,0|2,0,1]=4 254 B9R1.15 C=Cc1cncnc1N 271570a_100011290941_100011996079 [1,0,0,0,0,0|1,0,1]=3 255 B9R1.15 C=Cc1cncnc1O 271570a_100011290941_100000751107 [1,0,0,0,0,0|2,0,1]=4 256 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [1,0,0,0,0,0|3,0,0]=4 257 B9R1.15 CCc1cncnc1O 271570a_203496583355_200000100055 [1,0,0,0,0,0|2,0,0]=3 258 B9R1.15 COc1cccnc1N 34a_100000211975_200000210301 [1,0,0,0,0,0|3,0,0]=4 259 B9R1.15 COc1cccnc1N 7a_100000211975_200000210301 [1,0,0,0,0,0|3,0,0]=4 260 B9R1.15 COc1cnccc1N 34a_100000753702_200000210301 [1,0,0,0,0,0|3,0,0]=4 261 B9R1.15 COc1cncnc1N 7a_100000112926_200000210301 [1,0,0,0,0,0|2,0,0]=3 262 B9R1.15 COc1cncnc1O 271570a_203496583355_100012001275 [1,0,0,0,0,0|3,0,0]=4 263 B9R1.15 CSc1cccnc1N 62a_100000045569_200000210301 [1,0,0,0,0,0|3,0,0]=4 264 B9R1.15 CSc1cccnc1N 62a_200000210301_100000045569 [1,0,0,0,0,0|3,0,0]=4 265 B9R1.15 CSc1cnccc1N 62a_100000047001_200000210301 [1,0,0,0,0,0|3,0,0]=4 266 B9R1.15 CSc1cnccc1N 62a_200000210301_100000047001 [1,0,0,0,0,0|3,0,0]=4 267 B9R1.15 CSc1cncnc1Br 62a_200000210301_200012461658 [1,0,0,0,0,0|3,0,0]=4 268 B9R1.15 CSc1cncnc1Br 62a_200012461658_200000210301 [1,0,0,0,0,0|3,0,0]=4 269 B9R1.15 CSc1cncnc1C 62a_100009819671_200000210301 [1,0,0,0,0,0|3,0,0]=4 270 B9R1.15 CSc1cncnc1C 62a_200000210301_100009819671 [1,0,0,0,0,0|3,0,0]=4 271 B9R1.15 CSc1cncnc1Cl 62a_100000758962_200000210301 [1,0,0,0,0,0|3,0,0]=4 272 B9R1.15 CSc1cncnc1Cl 62a_200000210301_100000758962 [1,0,0,0,0,0|3,0,0]=4 273 B9R1.15 CSc1cncnc1N 62a_100011996079_200000210301 [1,0,0,0,0,0|2,0,0]=3 274 B9R1.15 CSc1cncnc1N 62a_200000210301_100011996079 [1,0,0,0,0,0|2,0,0]=3 275 B9R1.15 CSc1cncnc1O 62a_100000751107_200000210301 [1,0,0,0,0,0|3,0,0]=4 276 B9R1.15 CSc1cncnc1O 62a_200000210301_100000751107 [1,0,0,0,0,0|3,0,0]=4 277 B9R1.15 Cc1ncncc1S[13CH3] 62a_100009819671_200025704644 [1,0,0,0,0,0|3,0,0]=4 278 B9R1.15 Cc1ncncc1S[13CH3] 62a_200025704644_100009819671 [1,0,0,0,0,0|3,0,0]=4 279 B9R1.15 N#Cc1cncnc1O 271570a_203496583355_100000687955 [1,0,0,0,0,0|2,0,1]=4 280 B9R1.15 NCc1cccnc1O 271570a_203496583355_100015189234 [1,0,0,0,0,0|3,0,0]=4 281 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,0,0,0,0|3,0,0]=4 282 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,0,0,0,0,0|2,0,0]=3 283 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.15 OCc1nccnc1O 271570a_203496583355_100000057004 [1,0,0,0,0,0|3,0,0]=4 285 B9R1.15 [13CH3]Oc1cccnc1N 34a_100000211975_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B9R1.15 [13CH3]Oc1cccnc1N 7a_100000211975_200025704644 [1,0,0,0,0,0|3,0,0]=4 287 B9R1.15 [13CH3]Oc1cnccc1N 34a_100000753702_200025704644 [1,0,0,0,0,0|3,0,0]=4 288 B9R1.15 [13CH3]Oc1cncnc1N 7a_100000112926_200025704644 [1,0,0,0,0,0|2,0,0]=3 289 B9R1.15 [13CH3]Sc1cccnc1N 62a_100000045569_200025704644 [1,0,0,0,0,0|3,0,0]=4 290 B9R1.15 [13CH3]Sc1cccnc1N 62a_200025704644_100000045569 [1,0,0,0,0,0|3,0,0]=4 291 B9R1.15 [13CH3]Sc1cnccc1N 62a_100000047001_200025704644 [1,0,0,0,0,0|3,0,0]=4 292 B9R1.15 [13CH3]Sc1cnccc1N 62a_200025704644_100000047001 [1,0,0,0,0,0|3,0,0]=4 293 B9R1.15 [13CH3]Sc1cncnc1Br 62a_200012461658_200025704644 [1,0,0,0,0,0|3,0,0]=4 294 B9R1.15 [13CH3]Sc1cncnc1Br 62a_200025704644_200012461658 [1,0,0,0,0,0|3,0,0]=4 295 B9R1.15 [13CH3]Sc1cncnc1Cl 62a_100000758962_200025704644 [1,0,0,0,0,0|3,0,0]=4 296 B9R1.15 [13CH3]Sc1cncnc1Cl 62a_200025704644_100000758962 [1,0,0,0,0,0|3,0,0]=4 297 B9R1.15 [13CH3]Sc1cncnc1N 62a_100011996079_200025704644 [1,0,0,0,0,0|2,0,0]=3 298 B9R1.15 [13CH3]Sc1cncnc1N 62a_200025704644_100011996079 [1,0,0,0,0,0|2,0,0]=3 299 B9R1.15 [13CH3]Sc1cncnc1O 62a_100000751107_200025704644 [1,0,0,0,0,0|3,0,0]=4 300 B9R1.15 [13CH3]Sc1cncnc1O 62a_200025704644_100000751107 [1,0,0,0,0,0|3,0,0]=4 301 B9R1.69 Cc1cc(c(cn1)C)O 271570a_203496583355_100009862788 [1,0,0,0,0,0|2,0,0]=3 302 B9R1.69 Cc1cc(c(cn1)F)O 271570a_203496583355_100009867690 [1,0,0,0,0,0|3,0,0]=4 303 B9R1.69 Cc1cc(c(cn1)O)C 271570a_203496583355_100009819613 [1,0,0,0,0,0|2,0,0]=3 304 B9R1.69 Cc1cc(c(cn1)O)N 271570a_203496583355_100009817891 [1,0,0,0,0,0|1,0,0]=2 305 B9R1.69 Cc1cc(c(cn1)O)O 271570a_203496583355_100009843476 [1,0,0,0,0,0|2,0,0]=3 306 B9R1.69 Cc1cc(c(cn1)O)O 271570a_203496583355_100011016184 [1,0,0,0,0,0|2,0,0]=3 307 B9R1.69 Cc1cc(ncc1O)Br 271570a_203496583355_100009816104 [1,0,0,0,0,0|3,0,0]=4 308 B9R1.69 Cc1cc(ncc1O)Cl 271570a_203496583355_100010172789 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.69 Cc1cc(ncc1O)F 271570a_203496583355_100009820716 [1,0,0,0,0,0|3,0,0]=4 310 B9R1.69 Cc1cc(ncc1O)N 271570a_203496583355_100000050067 [1,0,0,0,0,0|3,0,0]=4 311 B9R1.69 Cc1cc(ncc1O)O 271570a_203496583355_100000692680 [1,0,0,0,0,0|3,0,0]=4 312 B9R1.69 Cc1cc(ncc1O)O 271570a_203496583355_100010114363 [1,0,0,0,0,0|3,0,0]=4 313 B9R1.69 Cc1ccc(c(c1)Br)O 271570a_203496583355_100009813563 [1,0,0,0,0,0|3,0,0]=4 314 B9R1.69 Cc1ccc(c(c1)C)O 271570a_203496583355_100011217332 [1,0,0,0,0,0|3,0,0]=4 315 B9R1.69 Cc1ccc(c(c1)Cl)O 271570a_203496583355_100011263221 [1,0,0,0,0,0|3,0,0]=4 316 B9R1.69 Cc1ccc(c(c1)F)O 271570a_203496583355_100011216119 [1,0,0,0,0,0|3,0,0]=4 317 B9R1.69 Cc1ccc(c(c1)N)O 271570a_203496583355_100011216686 [1,0,0,0,0,0|2,0,0]=3 318 B9R1.69 Cc1ccc(c(c1)O)C 271570a_203496583355_100000210833 [1,0,0,0,0,0|3,0,0]=4 319 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100000765521 [1,0,0,0,0,0|3,0,0]=4 320 B9R1.69 Cc1ccc(c(c1)O)O 271570a_203496583355_100012002257 [1,0,0,0,0,0|3,0,0]=4 321 B9R1.69 Cc1ccc(c(n1)C)O 271570a_203496583355_100009813853 [1,0,0,0,0,0|2,0,0]=3 322 B9R1.69 Cc1ccc(c(n1)F)O 271570a_203496583355_100010006597 [1,0,0,0,0,0|2,0,0]=3 323 B9R1.69 Cc1ccc(c(n1)N)O 271570a_203496583355_100009816662 [1,0,0,0,0,0|1,0,0]=2 324 B9R1.69 Cc1ccc(c(n1)O)C 271570a_203496583355_100009854376 [1,0,0,0,0,0|2,0,0]=3 325 B9R1.69 Cc1ccc(c(n1)O)F 271570a_203496583355_100009817602 [1,0,0,0,0,0|3,0,0]=4 326 B9R1.69 Cc1ccc(c(n1)O)N 271570a_203496583355_100000685570 [1,0,0,0,0,0|3,0,0]=4 327 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100000702858 [1,0,0,0,0,0|2,0,0]=3 328 B9R1.69 Cc1ccc(c(n1)O)O 271570a_203496583355_100009817604 [1,0,0,0,0,0|2,0,0]=3 329 B9R1.69 Cc1ccc(cc1N)O 271570a_203496583355_100000761890 [1,0,0,0,0,0|3,0,0]=4 330 B9R1.69 Cc1ccc(nc1C)O 271570a_203496583355_100000103781 [1,0,0,0,0,0|3,0,0]=4 331 B9R1.69 Cc1ccc(nc1N)O 271570a_203496583355_100009857032 [1,0,0,0,0,0|2,0,0]=3 332 B9R1.69 Cc1ccc(nc1O)N 271570a_203496583355_100000126722 [1,0,0,0,0,0|3,0,0]=4 333 B9R1.69 Cc1cnc(c(c1)N)O 271570a_203496583355_100000733613 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.69 Cc1cnc(c(n1)C)O 271570a_203496583355_100000065684 [1,0,0,0,0,0|3,0,0]=4 335 B9R1.69 Cc1cnc(c(n1)O)C 271570a_203496583355_100000211308 [1,0,0,0,0,0|3,0,0]=4 336 B9R1.69 Cc1cnc(cc1C)O 271570a_203496583355_100009850809 [1,0,0,0,0,0|3,0,0]=4 337 B9R1.69 Cc1cnc(cc1F)O 271570a_203496583355_100009841206 [1,0,0,0,0,0|3,0,0]=4 338 B9R1.69 Cc1cnc(cc1N)O 271570a_203496583355_100000690170 [1,0,0,0,0,0|2,0,0]=3 339 B9R1.69 Cc1cnc(cc1O)Br 271570a_203496583355_100010067628 [1,0,0,0,0,0|3,0,0]=4 340 B9R1.69 Cc1cnc(cc1O)Cl 271570a_203496583355_100010068021 [1,0,0,0,0,0|3,0,0]=4 341 B9R1.69 Cc1cnc(cc1O)F 271570a_203496583355_100000049870 [1,0,0,0,0,0|3,0,0]=4 342 B9R1.69 Cc1cnc(cc1O)N 271570a_203496583355_100009819938 [1,0,0,0,0,0|3,0,0]=4 343 B9R1.69 Cc1cnc(cc1O)O 271570a_203496583355_100000704368 [1,0,0,0,0,0|3,0,0]=4 344 B9R1.69 Cc1cnc(cc1O)O 271570a_203496583355_100009831917 [1,0,0,0,0,0|3,0,0]=4 345 B9R1.69 Cc1cnc(nc1N)O 271570a_203496583355_100011996698 [1,0,0,0,0,0|1,0,0]=2 346 B9R1.69 Cc1cnc(nc1O)N 271570a_203496583355_100000016107 [1,0,0,0,0,0|2,0,0]=3 347 B9R1.69 Cc1nc(ccc1O)Cl 271570a_203496583355_100000062408 [1,0,0,0,0,0|3,0,0]=4 348 B9R1.69 Cc1nc(ccc1O)F 271570a_203496583355_100000688911 [1,0,0,0,0,0|3,0,0]=4 349 B9R1.69 Cc1nc(ccc1O)N 271570a_203496583355_100000013003 [1,0,0,0,0,0|3,0,0]=4 350 B9R1.69 Cc1nc(ccc1O)O 271570a_203496583355_100000691680 [1,0,0,0,0,0|3,0,0]=4 351 B9R1.69 Cc1nc(ccc1O)O 271570a_203496583355_100010233687 [1,0,0,0,0,0|3,0,0]=4 352 B9R1.69 Cc1nc(ncc1Cl)O 271570a_203496583355_100010174973 [1,0,0,0,0,0|3,0,0]=4 353 B9R1.69 Cc1nc(ncc1F)O 271570a_203496583355_100015641512 [1,0,0,0,0,0|3,0,0]=4 354 B9R1.69 Cc1nc(ncc1N)O 271570a_203496583355_100000123670 [1,0,0,0,0,0|3,0,0]=4 355 B9R1.69 Cc1nc(ncc1O)N 271570a_203496583355_100000725598 [1,0,0,0,0,0|2,0,0]=3 356 B9R1.69 Cc1ncc(c(=O)[nH]1)O 271570a_203496583355_100011999157 [1,0,0,0,0,0|1,0,1]=3 357 B9R1.69 Cc1ncc(c(n1)N)O 271570a_203496583355_100000684960 [1,0,0,0,0,0|0,0,0]=1 358 B9R1.69 Cc1ncc(c(n1)O)F 271570a_203496583355_100000059819 [1,0,0,0,0,0|2,0,0]=3 359 B9R1.69 Cc1ncc(c(n1)O)N 271570a_203496583355_100009873743 [1,0,0,0,0,0|2,0,0]=3 360 B9R1.69 Nc1[nH]c(=O)ccc1O 271570a_203496583355_100009884077 [1,0,0,0,0,0|2,0,1]=4 361 B9R1.69 Nc1cc(c(cn1)O)Br 271570a_203496583355_100010074611 [1,0,0,0,0,0|3,0,0]=4 362 B9R1.69 Nc1cc(c(cn1)O)Cl 271570a_203496583355_100000694920 [1,0,0,0,0,0|3,0,0]=4 363 B9R1.69 Nc1cc(c(cn1)O)F 271570a_203496583355_100009844730 [1,0,0,0,0,0|3,0,0]=4 364 B9R1.69 Nc1cc(c(cn1)O)N 271570a_203496583355_200009857908 [1,0,0,0,0,0|2,0,0]=3 365 B9R1.69 Nc1cc(ccc1O)Br 271570a_203496583355_100000743836 [1,0,0,0,0,0|3,0,0]=4 366 B9R1.69 Nc1cc(ccc1O)Cl 271570a_203496583355_100000761886 [1,0,0,0,0,0|3,0,0]=4 367 B9R1.69 Nc1cc(ccc1O)F 271570a_203496583355_100011218093 [1,0,0,0,0,0|3,0,0]=4 368 B9R1.69 Nc1cc(ccc1O)O 271570a_203496583355_100000752626 [1,0,0,0,0,0|3,0,0]=4 369 B9R1.69 Nc1cc(ccc1O)O 271570a_203496583355_100011999798 [1,0,0,0,0,0|3,0,0]=4 370 B9R1.69 Nc1cc(ncc1F)O 271570a_203496583355_100000126464 [1,0,0,0,0,0|3,0,0]=4 371 B9R1.69 Nc1cc(ncc1O)O 271570a_203496583355_100009819941 [1,0,0,0,0,0|2,0,0]=3 372 B9R1.69 Nc1ccc(c(c1)N)O 271570a_203496583355_200012175722 [1,0,0,0,0,0|3,0,0]=4 373 B9R1.69 Nc1ccc(c(n1)Br)O 271570a_203496583355_100010734177 [1,0,0,0,0,0|3,0,0]=4 374 B9R1.69 Nc1ccc(c(n1)Cl)O 271570a_203496583355_100010270343 [1,0,0,0,0,0|3,0,0]=4 375 B9R1.69 Nc1ccc(c(n1)F)O 271570a_203496583355_100009882772 [1,0,0,0,0,0|3,0,0]=4 376 B9R1.69 Nc1ccc(c(n1)N)O 271570a_203496583355_100011356871 [1,0,0,0,0,0|2,0,0]=3 377 B9R1.69 Nc1ccc(nc1N)O 271570a_203496583355_100000747239 [1,0,0,0,0,0|3,0,0]=4 378 B9R1.69 Nc1cnc(cc1N)O 271570a_203496583355_100000067514 [1,0,0,0,0,0|3,0,0]=4 379 B9R1.69 Nc1cnc(nc1N)O 271570a_203496583355_100011933915 [1,0,0,0,0,0|2,0,0]=3 380 B9R1.69 Nc1nc(=O)[nH]cc1O 271570a_203496583355_100000050048 [1,0,0,0,0,0|1,0,1]=3 381 B9R1.69 Nc1nc(ccc1F)O 271570a_203496583355_100016091773 [1,0,0,0,0,0|3,0,0]=4 382 B9R1.69 Nc1nc(ccc1O)Cl 271570a_203496583355_100010171640 [1,0,0,0,0,0|2,0,0]=3 383 B9R1.69 Nc1nc(ccc1O)F 271570a_203496583355_100009854977 [1,0,0,0,0,0|2,0,0]=3 384 B9R1.69 Nc1nc(ccc1O)O 271570a_203496583355_100000685527 [1,0,0,0,0,0|2,0,0]=3 385 B9R1.69 Nc1nc(ncc1F)O 271570a_203496583355_100000185498 [1,0,0,0,0,0|2,0,0]=3 386 B9R1.69 Nc1ncc(c(=O)[nH]1)O 271570a_203496583355_100012456729 [1,0,0,0,0,0|2,0,1]=4 387 B9R1.69 Nc1ncc(c(n1)N)O 271570a_203496583355_200010734216 [1,0,0,0,0,0|1,0,0]=2 388 B9R1.69 Nc1ncc(c(n1)O)F 271570a_203496583355_200000093006 [1,0,0,0,0,0|3,0,0]=4 389 B9R1.69 O=c1[nH]c(ncc1O)O 271570a_203496583355_100011215686 [1,0,0,0,0,0|2,0,1]=4 390 B9R1.69 Oc1ccc(c(n1)Br)O 271570a_203496583355_100000725334 [1,0,0,0,0,0|3,0,0]=4 391 B9R1.69 Oc1ccc(c(n1)Cl)O 271570a_203496583355_100000721234 [1,0,0,0,0,0|3,0,0]=4 392 B9R1.69 Oc1ccc(c(n1)F)O 271570a_203496583355_100009819667 [1,0,0,0,0,0|3,0,0]=4 393 B9R1.69 Oc1ccc(c(n1)F)O 271570a_203496583355_100009879308 [1,0,0,0,0,0|3,0,0]=4 394 B9R1.69 Oc1ccc(nc1Cl)Br 271570a_203496583355_100010246183 [1,0,0,0,0,0|3,0,0]=4 395 B9R1.69 Oc1ccc(nc1F)Cl 271570a_203496583355_100010168078 [1,0,0,0,0,0|3,0,0]=4 396 B9R1.69 Oc1ccc(nc1F)F 271570a_203496583355_100000070099 [1,0,0,0,0,0|3,0,0]=4 397 B9R1.69 Oc1ccc(nc1O)Br 271570a_203496583355_100010253912 [1,0,0,0,0,0|3,0,0]=4 398 B9R1.69 Oc1ccc(nc1O)Cl 271570a_203496583355_100000696390 [1,0,0,0,0,0|3,0,0]=4 399 B9R1.69 Oc1ccc(nc1O)F 271570a_203496583355_100010382442 [1,0,0,0,0,0|3,0,0]=4 400 B9R1.69 Oc1cnc(cc1Br)F 271570a_203496583355_100015451857 [1,0,0,0,0,0|3,0,0]=4 401 B9R1.69 Oc1cnc(cc1Cl)Br 271570a_203496583355_100010381092 [1,0,0,0,0,0|3,0,0]=4 402 B9R1.69 Oc1cnc(cc1Cl)Cl 271570a_203496583355_100010200927 [1,0,0,0,0,0|3,0,0]=4 403 B9R1.69 Oc1cnc(cc1F)Cl 271570a_203496583355_100010128100 [1,0,0,0,0,0|3,0,0]=4 404 B9R1.69 Oc1cnc(cc1O)Cl 271570a_203496583355_100000698892 [1,0,0,0,0,0|3,0,0]=4 405 B9R1.69 Oc1cnc(nc1F)F 271570a_203496583355_100009820707 [1,0,0,0,0,0|2,0,0]=3 406 B9R1.69 Oc1ncc(c(n1)O)F 271570a_203496583355_100011995740 [1,0,0,0,0,0|3,0,0]=4 407 B11R1.37 C=Cc1cc(ncc1CC)C 271570a_100011290941_100010291839 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.37 C=Cc1nc(ccc1CO)C 271570a_100011290941_102495338573 [0,1,0,0,0,0|2,0,0]=3 409 B11R1.37 C=Cc1nc(ncc1C#N)C 271570a_100011290941_200012187075 [0,1,0,0,0,0|2,0,1]=4 410 B11R1.37 C=Cc1nc(ncc1CC)C 271570a_100011290941_200000069817 [0,1,0,0,0,0|2,0,0]=3 411 B11R1.37 CCc1cnc(cc1NC)C 27a_100102657272_100010291839 [0,1,0,0,0,0|2,0,0]=3 412 B11R1.37 CCc1cnc(cc1SC)C 62a_100010291839_200000210301 [0,1,0,0,0,0|3,0,0]=4 413 B11R1.37 CCc1cnc(cc1SC)C 62a_200000210301_100010291839 [0,1,0,0,0,0|3,0,0]=4 414 B11R1.37 CCc1cnc(cc1S[13CH3])C 62a_100010291839_200025704644 [0,1,0,0,0,0|3,0,0]=4 415 B11R1.37 CCc1cnc(cc1S[13CH3])C 62a_200025704644_100010291839 [0,1,0,0,0,0|3,0,0]=4 416 B11R1.37 CCc1cnc(nc1NC)C 27a_100102657272_200000069817 [0,1,0,0,0,0|1,0,0]=2 417 B11R1.37 CCc1cnc(nc1SC)C 62a_200000069817_200000210301 [0,1,0,0,0,0|2,0,0]=3 418 B11R1.37 CCc1cnc(nc1SC)C 62a_200000210301_200000069817 [0,1,0,0,0,0|2,0,0]=3 419 B11R1.37 CCc1cnc(nc1S[13CH3])C 62a_200000069817_200025704644 [0,1,0,0,0,0|2,0,0]=3 420 B11R1.37 CCc1cnc(nc1S[13CH3])C 62a_200025704644_200000069817 [0,1,0,0,0,0|2,0,0]=3 421 B11R1.37 CNc1cc(ccc1CO)Br 34a_100000718831_200000210301 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.37 CNc1cc(ccc1CO)C 34a_100000087799_200000210301 [0,1,0,0,0,0|2,0,0]=3 423 B11R1.37 CNc1cc(ccc1CO)Cl 34a_100000238622_200000210301 [0,1,0,0,0,0|3,0,0]=4 424 B11R1.37 CNc1cc(ccc1CO)F 34a_100011996588_200000210301 [0,1,0,0,0,0|3,0,0]=4 425 B11R1.37 CNc1nc(ccc1C#N)C 27a_100102657272_100000741175 [0,1,0,0,0,0|2,0,1]=4 426 B11R1.37 CNc1nc(ncc1C#N)C 27a_100102657272_200012187075 [0,1,0,0,0,0|1,0,1]=3 427 B11R1.37 COc1cc(ncc1CO)O 271570a_203496583355_100010714672 [0,1,0,0,0,0|3,0,0]=4 428 B11R1.37 COc1cnc(nc1NN)O 271570a_203496583355_100000120976 [0,1,0,0,0,0|3,0,0]=4 429 B11R1.37 COc1nc(ccc1CO)O 271570a_203496583355_100010988397 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.37 COc1nc(ncc1CO)O 271570a_203496583355_200011024631 [0,1,0,0,0,0|2,0,0]=3 431 B11R1.37 CSc1nc(ccc1CO)C 62a_102495338573_200000210301 [0,1,0,0,0,0|2,0,0]=3 432 B11R1.37 CSc1nc(ccc1CO)C 62a_200000210301_102495338573 [0,1,0,0,0,0|2,0,0]=3 433 B11R1.37 CSc1nc(ncc1C#N)C 62a_200000210301_200012187075 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.37 Cc1ccc(c(c1)N[13CH3])CO 34a_100000087799_200025704644 [0,1,0,0,0,0|2,0,0]=3 435 B11R1.37 Cc1ccc(c(n1)S[13CH3])CO 62a_102495338573_200025704644 [0,1,0,0,0,0|2,0,0]=3 436 B11R1.37 Cc1ccc(c(n1)S[13CH3])CO 62a_200025704644_102495338573 [0,1,0,0,0,0|2,0,0]=3 437 B11R1.37 Cc1ncc(c(n1)S[13CH3])C#N 62a_200025704644_200012187075 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.37 [13CH3]Nc1cc(ccc1CO)Br 34a_100000718831_200025704644 [0,1,0,0,0,0|3,0,0]=4 439 B11R1.37 [13CH3]Nc1cc(ccc1CO)Cl 34a_100000238622_200025704644 [0,1,0,0,0,0|3,0,0]=4 440 B11R1.37 [13CH3]Nc1cc(ccc1CO)F 34a_100011996588_200025704644 [0,1,0,0,0,0|3,0,0]=4 441 B11R1.81 C=C=Cc1ccc(nc1N)C 271570a_100015277604_100009816662 [0,1,0,0,0,0|2,0,1]=4 442 B11R1.81 C=C=Cc1cnc(cc1N)C 271570a_100015277604_100009817891 [0,1,0,0,0,0|2,0,1]=4 443 B11R1.81 C=C=Cc1cnc(nc1N)C 271570a_100015277604_100000684960 [0,1,0,0,0,0|1,0,1]=3 444 B11R1.81 C=C=Cc1cnc(nc1N)N 271570a_100015277604_200010734216 [0,1,0,0,0,0|2,0,1]=4 445 B11R1.81 CC=Cc1ccc(nc1N)C 271570a_100016259895_100009816662 [0,1,0,0,0,0|2,0,1]=4 446 B11R1.81 CC=Cc1cnc(cc1N)C 271570a_100016259895_100009817891 [0,1,0,0,0,0|2,0,1]=4 447 B11R1.81 CC=Cc1cnc(nc1N)C 271570a_100016259895_100000684960 [0,1,0,0,0,0|1,0,1]=3 448 B11R1.81 CC=Cc1cnc(nc1N)N 271570a_100016259895_200010734216 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.81 CCCc1cnc(nc1O)C 271570a_203496583355_200000069602 [0,1,0,0,0,0|2,0,0]=3 450 B11R1.81 CCOc1ccc(cc1N)C 34a_100011215204_100000210202 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.81 CCOc1ccc(cc1N)C 7a_100011215204_100000210202 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.81 CCOc1ccc(nc1Br)C 34a_100000702858_100000210202 [0,1,0,0,0,0|3,0,0]=4 453 B11R1.81 CCOc1ccc(nc1Br)C 7a_100000702858_100000210202 [0,1,0,0,0,0|3,0,0]=4 454 B11R1.81 CCOc1ccc(nc1C)C 34a_100011218912_100000210202 [0,1,0,0,0,0|3,0,0]=4 455 B11R1.81 CCOc1ccc(nc1C)C 7a_100011218912_100000210202 [0,1,0,0,0,0|3,0,0]=4 456 B11R1.81 CCOc1ccc(nc1Cl)C 34a_100000086286_100000210202 [0,1,0,0,0,0|3,0,0]=4 457 B11R1.81 CCOc1ccc(nc1Cl)C 7a_100000086286_100000210202 [0,1,0,0,0,0|3,0,0]=4 458 B11R1.81 CCOc1ccc(nc1F)C 34a_100000079963_100000210202 [0,1,0,0,0,0|3,0,0]=4 459 B11R1.81 CCOc1ccc(nc1F)C 7a_100000079963_100000210202 [0,1,0,0,0,0|3,0,0]=4 460 B11R1.81 CCOc1ccc(nc1I)C 34a_100000023897_100000210202 [0,1,0,0,0,0|3,0,0]=4 461 B11R1.81 CCOc1ccc(nc1I)C 7a_100000023897_100000210202 [0,1,0,0,0,0|3,0,0]=4 462 B11R1.81 CCOc1ccc(nc1N)Br 34a_100000685527_100000210202 [0,1,0,0,0,0|3,0,0]=4 463 B11R1.81 CCOc1ccc(nc1N)Br 7a_100000685527_100000210202 [0,1,0,0,0,0|3,0,0]=4 464 B11R1.81 CCOc1ccc(nc1N)C 34a_100000694039_100000210202 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.81 CCOc1ccc(nc1N)C 7a_100000694039_100000210202 [0,1,0,0,0,0|2,0,0]=3 466 B11R1.81 CCOc1ccc(nc1N)Cl 34a_100000717809_100000210202 [0,1,0,0,0,0|3,0,0]=4 467 B11R1.81 CCOc1ccc(nc1N)Cl 7a_100000717809_100000210202 [0,1,0,0,0,0|3,0,0]=4 468 B11R1.81 CCOc1cnc(cc1Br)C 34a_100009843476_100000210202 [0,1,0,0,0,0|3,0,0]=4 469 B11R1.81 CCOc1cnc(cc1Br)C 7a_100009843476_100000210202 [0,1,0,0,0,0|3,0,0]=4 470 B11R1.81 CCOc1cnc(cc1C)C 34a_200000068632_100000210202 [0,1,0,0,0,0|3,0,0]=4 471 B11R1.81 CCOc1cnc(cc1C)C 7a_200000068632_100000210202 [0,1,0,0,0,0|3,0,0]=4 472 B11R1.81 CCOc1cnc(cc1N)Br 34a_100009819941_100000210202 [0,1,0,0,0,0|3,0,0]=4 473 B11R1.81 CCOc1cnc(cc1N)Br 7a_100009819941_100000210202 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.81 CCOc1cnc(nc1C)C 34a_100009864123_100000210202 [0,1,0,0,0,0|2,0,0]=3 475 B11R1.81 CCOc1cnc(nc1C)C 7a_100009864123_100000210202 [0,1,0,0,0,0|2,0,0]=3 476 B11R1.81 CCOc1cnc(nc1Cl)Cl 34a_100010725077_100000210202 [0,1,0,0,0,0|3,0,0]=4 477 B11R1.81 CCOc1cnc(nc1Cl)Cl 7a_100010725077_100000210202 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.81 CCOc1cnc(nc1N)N 7a_100025726691_100000210202 [0,1,0,0,0,0|2,0,0]=3 479 B11R1.81 CCSc1ccc(cc1N)C 62a_100000210202_100011216686 [0,1,0,0,0,0|3,0,0]=4 480 B11R1.81 CCSc1ccc(cc1N)C 62a_100011216686_100000210202 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.81 CCSc1ccc(nc1C)C 62a_100000210202_100009813853 [0,1,0,0,0,0|3,0,0]=4 482 B11R1.81 CCSc1ccc(nc1C)C 62a_100009813853_100000210202 [0,1,0,0,0,0|3,0,0]=4 483 B11R1.81 CCSc1ccc(nc1F)C 62a_100000210202_100010006597 [0,1,0,0,0,0|3,0,0]=4 484 B11R1.81 CCSc1ccc(nc1F)C 62a_100010006597_100000210202 [0,1,0,0,0,0|3,0,0]=4 485 B11R1.81 CCSc1ccc(nc1N)C 62a_100000210202_100009816662 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.81 CCSc1ccc(nc1N)C 62a_100009816662_100000210202 [0,1,0,0,0,0|2,0,0]=3 487 B11R1.81 CCSc1ccc(nc1N)Cl 62a_100000210202_100010171640 [0,1,0,0,0,0|3,0,0]=4 488 B11R1.81 CCSc1ccc(nc1N)Cl 62a_100010171640_100000210202 [0,1,0,0,0,0|3,0,0]=4 489 B11R1.81 CCSc1ccc(nc1N)F 62a_100000210202_100009854977 [0,1,0,0,0,0|3,0,0]=4 490 B11R1.81 CCSc1ccc(nc1N)F 62a_100009854977_100000210202 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.81 CCSc1ccc(nc1N)N 62a_100011356871_100000210202 [0,1,0,0,0,0|3,0,0]=4 492 B11R1.81 CCSc1ccc(nc1O)C 62a_100000210202_100009817604 [0,1,0,0,0,0|3,0,0]=4 493 B11R1.81 CCSc1ccc(nc1O)C 62a_100009817604_100000210202 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.81 CCSc1cnc(=O)[nH]c1N 62a_100000210202_100000708077 [0,1,0,0,0,0|2,0,1]=4 495 B11R1.81 CCSc1cnc(=O)[nH]c1N 62a_100000708077_100000210202 [0,1,0,0,0,0|2,0,1]=4 496 B11R1.81 CCSc1cnc([nH]c1=O)C 62a_100000210202_100011999157 [0,1,0,0,0,0|2,0,1]=4 497 B11R1.81 CCSc1cnc([nH]c1=O)C 62a_100011999157_100000210202 [0,1,0,0,0,0|2,0,1]=4 498 B11R1.81 CCSc1cnc(cc1C)C 62a_100000210202_100009819613 [0,1,0,0,0,0|3,0,0]=4 499 B11R1.81 CCSc1cnc(cc1C)C 62a_100009819613_100000210202 [0,1,0,0,0,0|3,0,0]=4 500 B11R1.81 CCSc1cnc(cc1N)C 62a_100000210202_100009817891 [0,1,0,0,0,0|2,0,0]=3 501 B11R1.81 CCSc1cnc(cc1N)C 62a_100009817891_100000210202 [0,1,0,0,0,0|2,0,0]=3 502 B11R1.81 CCSc1cnc(cc1N)Cl 62a_100000210202_100010209552 [0,1,0,0,0,0|3,0,0]=4 503 B11R1.81 CCSc1cnc(cc1N)Cl 62a_100010209552_100000210202 [0,1,0,0,0,0|3,0,0]=4 504 B11R1.81 CCSc1cnc(cc1N)N 62a_100000210202_200009857908 [0,1,0,0,0,0|3,0,0]=4 505 B11R1.81 CCSc1cnc(cc1N)N 62a_200009857908_100000210202 [0,1,0,0,0,0|3,0,0]=4 506 B11R1.81 CCSc1cnc(cc1O)C 62a_100000210202_100011016184 [0,1,0,0,0,0|3,0,0]=4 507 B11R1.81 CCSc1cnc(cc1O)C 62a_100011016184_100000210202 [0,1,0,0,0,0|3,0,0]=4 508 B11R1.81 CCSc1cnc(nc1C)N 62a_100000210202_100000725598 [0,1,0,0,0,0|3,0,0]=4 509 B11R1.81 CCSc1cnc(nc1C)N 62a_100000725598_100000210202 [0,1,0,0,0,0|3,0,0]=4 510 B11R1.81 CCSc1cnc(nc1Cl)Cl 62a_100000210202_100000049956 [0,1,0,0,0,0|3,0,0]=4 511 B11R1.81 CCSc1cnc(nc1F)F 62a_100000210202_100009820707 [0,1,0,0,0,0|3,0,0]=4 512 B11R1.81 CCSc1cnc(nc1F)F 62a_100009820707_100000210202 [0,1,0,0,0,0|3,0,0]=4 513 B11R1.81 CCSc1cnc(nc1N)C 62a_100000210202_100000684960 [0,1,0,0,0,0|1,0,0]=2 514 B11R1.81 CCSc1cnc(nc1N)C 62a_100000684960_100000210202 [0,1,0,0,0,0|1,0,0]=2 515 B11R1.81 CCSc1cnc(nc1N)Cl 62a_100000210202_100010196077 [0,1,0,0,0,0|2,0,0]=3 516 B11R1.81 CCSc1cnc(nc1N)Cl 62a_100010196077_100000210202 [0,1,0,0,0,0|2,0,0]=3 517 B11R1.81 CCSc1cnc(nc1N)N 62a_100000210202_200010734216 [0,1,0,0,0,0|2,0,0]=3 518 B11R1.81 CCSc1cnc(nc1N)N 62a_200010734216_100000210202 [0,1,0,0,0,0|2,0,0]=3 519 B11R1.81 CNCc1ccc(nc1Br)C 2230a_106832991635_200010064658 [0,1,0,0,0,0|3,0,0]=4 520 B11R1.81 CNCc1ccc(nc1Br)C 34a_100102657272_200010064658 [0,1,0,0,0,0|3,0,0]=4 521 B11R1.81 CNCc1ccc(nc1Br)C 7a_106832991635_200010064658 [0,1,0,0,0,0|3,0,0]=4 522 B11R1.81 CNCc1ccc(nc1C)C 207a_100102657272_100011794427 [0,1,0,0,0,0|3,0,0]=4 523 B11R1.81 CNCc1ccc(nc1C)C 270004a_106832991635_100011794427 [0,1,0,0,0,0|3,0,0]=4 524 B11R1.81 CNCc1cnc(cc1C)C 207a_100102657272_200009869383 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.81 CNCc1cnc(cc1C)C 270004a_106832991635_200009869383 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.81 CNCc1cnc(nc1Cl)Cl 2230a_106832991635_100000071240 [0,1,0,0,0,0|3,0,0]=4 527 B11R1.81 CNCc1cnc(nc1Cl)Cl 34a_100102657272_100000071240 [0,1,0,0,0,0|3,0,0]=4 528 B11R1.81 CNCc1cnc(nc1Cl)Cl 7a_106832991635_100010163647 [0,1,0,0,0,0|3,0,0]=4 529 B11R1.81 COCc1ccc(cc1C)C 34a_100011215341_200000210301 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.81 COCc1ccc(cc1C)C 34a_100138415774_100011219618 [0,1,0,0,0,0|3,0,0]=4 531 B11R1.81 COCc1ccc(cc1C)C 7a_100011215341_200000210301 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.81 COCc1ccc(cc1Cl)C 34a_100000720314_200000210301 [0,1,0,0,0,0|3,0,0]=4 533 B11R1.81 COCc1ccc(cc1Cl)C 34a_100138415774_100012349684 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.81 COCc1ccc(cc1Cl)C 7a_100000720314_200000210301 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.81 COCc1ccc(cc1F)C 34a_100011216587_200000210301 [0,1,0,0,0,0|3,0,0]=4 536 B11R1.81 COCc1ccc(cc1F)C 34a_100138415774_100012002367 [0,1,0,0,0,0|3,0,0]=4 537 B11R1.81 COCc1ccc(cc1F)C 7a_100011216587_200000210301 [0,1,0,0,0,0|3,0,0]=4 538 B11R1.81 COCc1ccc(cc1N)Br 34a_100000718831_200000210301 [0,1,0,0,0,0|3,0,0]=4 539 B11R1.81 COCc1ccc(cc1N)Br 7a_100000718831_200000210301 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.81 COCc1ccc(cc1N)C 34a_100000087799_200000210301 [0,1,0,0,0,0|2,0,0]=3 541 B11R1.81 COCc1ccc(cc1N)C 7a_100000087799_200000210301 [0,1,0,0,0,0|2,0,0]=3 542 B11R1.81 COCc1ccc(cc1N)Cl 34a_100000238622_200000210301 [0,1,0,0,0,0|3,0,0]=4 543 B11R1.81 COCc1ccc(cc1N)Cl 7a_100000238622_200000210301 [0,1,0,0,0,0|3,0,0]=4 544 B11R1.81 COCc1ccc(cc1N)F 34a_100011996588_200000210301 [0,1,0,0,0,0|3,0,0]=4 545 B11R1.81 COCc1ccc(cc1N)O 271570a_203496583355_100013084866 [0,1,0,0,0,0|3,0,0]=4 546 B11R1.81 COCc1ccc(nc1Br)Br 34a_200010005763_200000210301 [0,1,0,0,0,0|3,0,0]=4 547 B11R1.81 COCc1ccc(nc1Br)Br 7a_200010005763_200000210301 [0,1,0,0,0,0|3,0,0]=4 548 B11R1.81 COCc1ccc(nc1Br)C 34a_100138415774_200010064658 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.81 COCc1ccc(nc1C)C 34a_100011756430_200000210301 [0,1,0,0,0,0|2,0,0]=3 550 B11R1.81 COCc1ccc(nc1C)C 7a_100011756430_200000210301 [0,1,0,0,0,0|2,0,0]=3 551 B11R1.81 COCc1ccc(nc1C)F 34a_100000081978_200000210301 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.81 COCc1ccc(nc1C)F 7a_100000081978_200000210301 [0,1,0,0,0,0|3,0,0]=4 553 B11R1.81 COCc1ccc(nc1Cl)C 34a_102495338573_200000210301 [0,1,0,0,0,0|2,0,0]=3 554 B11R1.81 COCc1ccc(nc1Cl)C 7a_102495338573_200000210301 [0,1,0,0,0,0|2,0,0]=3 555 B11R1.81 COCc1ccc(nc1Cl)Cl 34a_100000720492_200000210301 [0,1,0,0,0,0|3,0,0]=4 556 B11R1.81 COCc1ccc(nc1Cl)Cl 34a_100138415774_100000722033 [0,1,0,0,0,0|3,0,0]=4 557 B11R1.81 COCc1ccc(nc1Cl)Cl 7a_100000720492_200000210301 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.81 COCc1ccc(nc1F)Br 34a_100010065253_200000210301 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.81 COCc1ccc(nc1F)Br 7a_100010065253_200000210301 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.81 COCc1ccc(nc1F)Cl 34a_100009870654_200000210301 [0,1,0,0,0,0|3,0,0]=4 561 B11R1.81 COCc1ccc(nc1F)Cl 7a_100009870654_200000210301 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.81 COCc1cnc(cc1C)Cl 34a_100010277336_200000210301 [0,1,0,0,0,0|3,0,0]=4 563 B11R1.81 COCc1cnc(cc1C)Cl 7a_100010277336_200000210301 [0,1,0,0,0,0|3,0,0]=4 564 B11R1.81 COCc1cnc(cc1C)F 34a_100138415774_100010382440 [0,1,0,0,0,0|3,0,0]=4 565 B11R1.81 COCc1cnc(cc1Cl)Cl 34a_100000702863_200000210301 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.81 COCc1cnc(cc1Cl)Cl 34a_100138415774_100011997056 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.81 COCc1cnc(cc1Cl)Cl 7a_100000702863_200000210301 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.81 COCc1cnc(cc1N)C 34a_200012022818_200000210301 [0,1,0,0,0,0|1,0,0]=2 569 B11R1.81 COCc1cnc(cc1N)Cl 34a_100009830438_200000210301 [0,1,0,0,0,0|2,0,0]=3 570 B11R1.81 COCc1cnc(nc1C)C 34a_100000699490_200000210301 [0,1,0,0,0,0|1,0,0]=2 571 B11R1.81 COCc1cnc(nc1C)C 7a_100000699490_200000210301 [0,1,0,0,0,0|1,0,0]=2 572 B11R1.81 COCc1cnc(nc1Cl)Cl 34a_100138415774_100000071240 [0,1,0,0,0,0|2,0,0]=3 573 B11R1.81 COCc1cnc(nc1Cl)Cl 34a_200009828795_200000210301 [0,1,0,0,0,0|2,0,0]=3 574 B11R1.81 COCc1cnc(nc1Cl)Cl 7a_200009828795_200000210301 [0,1,0,0,0,0|2,0,0]=3 575 B11R1.81 COCc1cnc(nc1N)C 7a_100000701481_200000210301 [0,1,0,0,0,0|0,0,0]=1 576 B11R1.81 COCc1cnc(nc1N)Cl 7a_200009965464_200000210301 [0,1,0,0,0,0|1,0,0]=2 577 B11R1.81 COCc1cnc(nc1N)N 7a_100000083744_200000210301 [0,1,0,0,0,0|1,0,0]=2 578 B11R1.81 CSCc1ccc(nc1Br)C 62a_200000210301_200010064658 [0,1,0,0,0,0|2,1,0]=4 579 B11R1.81 CSCc1ccc(nc1Br)C 62a_200010064658_200000210301 [0,1,0,0,0,0|2,1,0]=4 580 B11R1.81 CSCc1cnc(nc1Cl)Cl 62a_100000071240_200000210301 [0,1,0,0,0,0|2,1,0]=4 581 B11R1.81 CSCc1cnc(nc1Cl)Cl 62a_200000210301_100000071240 [0,1,0,0,0,0|2,1,0]=4 582 B11R1.81 Cc1cc(c(cn1)CO[13CH3])N 34a_200012022818_200025704644 [0,1,0,0,0,0|1,0,0]=2 583 B11R1.81 Cc1cc(c(cn1)OCF)Br 34a_100009843476_100015361967 [0,1,0,0,0,0|3,0,0]=4 584 B11R1.81 Cc1cc(c(cn1)OCF)Br 7a_100009843476_100015361967 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.81 Cc1cc(c(cn1)OCF)C 34a_200000068632_100015361967 [0,1,0,0,0,0|3,0,0]=4 586 B11R1.81 Cc1cc(c(cn1)OCF)C 7a_200000068632_100015361967 [0,1,0,0,0,0|3,0,0]=4 587 B11R1.81 Cc1cc(c(cn1)SCF)C 62a_100009819613_100015361967 [0,1,0,0,0,0|3,0,0]=4 588 B11R1.81 Cc1cc(c(cn1)SCF)C 62a_100015361967_100009819613 [0,1,0,0,0,0|3,0,0]=4 589 B11R1.81 Cc1cc(c(cn1)SCF)N 62a_100009817891_100015361967 [0,1,0,0,0,0|2,0,0]=3 590 B11R1.81 Cc1cc(c(cn1)SCF)N 62a_100015361967_100009817891 [0,1,0,0,0,0|2,0,0]=3 591 B11R1.81 Cc1cc(c(cn1)SCF)O 62a_100011016184_100015361967 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.81 Cc1cc(c(cn1)SCF)O 62a_100015361967_100011016184 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.81 Cc1cc(ncc1CO[13CH3])Cl 34a_100010277336_200025704644 [0,1,0,0,0,0|3,0,0]=4 594 B11R1.81 Cc1cc(ncc1CO[13CH3])Cl 7a_100010277336_200025704644 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 34a_100011215341_200025704644 [0,1,0,0,0,0|3,0,0]=4 596 B11R1.81 Cc1ccc(c(c1)C)CO[13CH3] 7a_100011215341_200025704644 [0,1,0,0,0,0|3,0,0]=4 597 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 34a_100000720314_200025704644 [0,1,0,0,0,0|3,0,0]=4 598 B11R1.81 Cc1ccc(c(c1)Cl)CO[13CH3] 7a_100000720314_200025704644 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 34a_100011216587_200025704644 [0,1,0,0,0,0|3,0,0]=4 600 B11R1.81 Cc1ccc(c(c1)F)CO[13CH3] 7a_100011216587_200025704644 [0,1,0,0,0,0|3,0,0]=4 601 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 34a_100000087799_200025704644 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.81 Cc1ccc(c(c1)N)CO[13CH3] 7a_100000087799_200025704644 [0,1,0,0,0,0|2,0,0]=3 603 B11R1.81 Cc1ccc(c(c1)N)OCF 34a_100011215204_100015361967 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.81 Cc1ccc(c(c1)N)OCF 7a_100011215204_100015361967 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100011216686_100015361967 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100015361967_100011216686 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.81 Cc1ccc(c(n1)Br)CS[13CH3] 62a_200010064658_200025704644 [0,1,0,0,0,0|2,1,0]=4 608 B11R1.81 Cc1ccc(c(n1)Br)CS[13CH3] 62a_200025704644_200010064658 [0,1,0,0,0,0|2,1,0]=4 609 B11R1.81 Cc1ccc(c(n1)Br)OCF 34a_100000702858_100015361967 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.81 Cc1ccc(c(n1)Br)OCF 7a_100000702858_100015361967 [0,1,0,0,0,0|3,0,0]=4 611 B11R1.81 Cc1ccc(c(n1)C)CO[13CH3] 34a_100011756430_200025704644 [0,1,0,0,0,0|2,0,0]=3 612 B11R1.81 Cc1ccc(c(n1)C)CO[13CH3] 7a_100011756430_200025704644 [0,1,0,0,0,0|2,0,0]=3 613 B11R1.81 Cc1ccc(c(n1)C)OCF 34a_100011218912_100015361967 [0,1,0,0,0,0|3,0,0]=4 614 B11R1.81 Cc1ccc(c(n1)C)OCF 7a_100011218912_100015361967 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.81 Cc1ccc(c(n1)C)SCF 62a_100009813853_100015361967 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.81 Cc1ccc(c(n1)C)SCF 62a_100015361967_100009813853 [0,1,0,0,0,0|3,0,0]=4 617 B11R1.81 Cc1ccc(c(n1)Cl)CO[13CH3] 34a_102495338573_200025704644 [0,1,0,0,0,0|2,0,0]=3 618 B11R1.81 Cc1ccc(c(n1)Cl)CO[13CH3] 7a_102495338573_200025704644 [0,1,0,0,0,0|2,0,0]=3 619 B11R1.81 Cc1ccc(c(n1)Cl)OCF 34a_100000086286_100015361967 [0,1,0,0,0,0|3,0,0]=4 620 B11R1.81 Cc1ccc(c(n1)Cl)OCF 7a_100000086286_100015361967 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.81 Cc1ccc(c(n1)F)OCF 34a_100000079963_100015361967 [0,1,0,0,0,0|3,0,0]=4 622 B11R1.81 Cc1ccc(c(n1)F)OCF 7a_100000079963_100015361967 [0,1,0,0,0,0|3,0,0]=4 623 B11R1.81 Cc1ccc(c(n1)F)SCF 62a_100010006597_100015361967 [0,1,0,0,0,0|3,0,0]=4 624 B11R1.81 Cc1ccc(c(n1)F)SCF 62a_100015361967_100010006597 [0,1,0,0,0,0|3,0,0]=4 625 B11R1.81 Cc1ccc(c(n1)I)OCF 34a_100000023897_100015361967 [0,1,0,0,0,0|3,0,0]=4 626 B11R1.81 Cc1ccc(c(n1)I)OCF 7a_100000023897_100015361967 [0,1,0,0,0,0|3,0,0]=4 627 B11R1.81 Cc1ccc(c(n1)N)OCF 34a_100000694039_100015361967 [0,1,0,0,0,0|2,0,0]=3 628 B11R1.81 Cc1ccc(c(n1)N)OCF 7a_100000694039_100015361967 [0,1,0,0,0,0|2,0,0]=3 629 B11R1.81 Cc1ccc(c(n1)N)SCF 62a_100009816662_100015361967 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.81 Cc1ccc(c(n1)N)SCF 62a_100015361967_100009816662 [0,1,0,0,0,0|2,0,0]=3 631 B11R1.81 Cc1ccc(c(n1)O)SCF 62a_100009817604_100015361967 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.81 Cc1ccc(c(n1)O)SCF 62a_100015361967_100009817604 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.81 Cc1nc(ccc1CO[13CH3])F 34a_100000081978_200025704644 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.81 Cc1nc(ccc1CO[13CH3])F 7a_100000081978_200025704644 [0,1,0,0,0,0|3,0,0]=4 635 B11R1.81 Cc1nc(ncc1SCF)N 62a_100000725598_100015361967 [0,1,0,0,0,0|3,0,0]=4 636 B11R1.81 Cc1nc(ncc1SCF)N 62a_100015361967_100000725598 [0,1,0,0,0,0|3,0,0]=4 637 B11R1.81 Cc1ncc(c(=O)[nH]1)SCF 62a_100011999157_100015361967 [0,1,0,0,0,0|2,0,1]=4 638 B11R1.81 Cc1ncc(c(=O)[nH]1)SCF 62a_100015361967_100011999157 [0,1,0,0,0,0|2,0,1]=4 639 B11R1.81 Cc1ncc(c(n1)C)CO[13CH3] 34a_100000699490_200025704644 [0,1,0,0,0,0|1,0,0]=2 640 B11R1.81 Cc1ncc(c(n1)C)CO[13CH3] 7a_100000699490_200025704644 [0,1,0,0,0,0|1,0,0]=2 641 B11R1.81 Cc1ncc(c(n1)C)OCF 34a_100009864123_100015361967 [0,1,0,0,0,0|2,0,0]=3 642 B11R1.81 Cc1ncc(c(n1)C)OCF 7a_100009864123_100015361967 [0,1,0,0,0,0|2,0,0]=3 643 B11R1.81 Cc1ncc(c(n1)N)CO[13CH3] 7a_100000701481_200025704644 [0,1,0,0,0,0|0,0,0]=1 644 B11R1.81 Cc1ncc(c(n1)N)SCF 62a_100000684960_100015361967 [0,1,0,0,0,0|1,0,0]=2 645 B11R1.81 Cc1ncc(c(n1)N)SCF 62a_100015361967_100000684960 [0,1,0,0,0,0|1,0,0]=2 646 B11R1.81 FCOc1cnc(nc1Cl)Cl 34a_100010725077_100015361967 [0,1,0,0,0,0|3,0,0]=4 647 B11R1.81 FCOc1cnc(nc1Cl)Cl 7a_100010725077_100015361967 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.81 FCSc1cnc(nc1Cl)Cl 62a_100015361967_100000049956 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.81 FCSc1cnc(nc1F)F 62a_100009820707_100015361967 [0,1,0,0,0,0|3,0,0]=4 650 B11R1.81 FCSc1cnc(nc1F)F 62a_100015361967_100009820707 [0,1,0,0,0,0|3,0,0]=4 651 B11R1.81 Nc1[nH]c(=O)ncc1SCF 62a_100000708077_100015361967 [0,1,0,0,0,0|2,0,1]=4 652 B11R1.81 Nc1[nH]c(=O)ncc1SCF 62a_100015361967_100000708077 [0,1,0,0,0,0|2,0,1]=4 653 B11R1.81 Nc1cc(c(cn1)SCF)N 62a_100015361967_200009857908 [0,1,0,0,0,0|3,0,0]=4 654 B11R1.81 Nc1cc(c(cn1)SCF)N 62a_200009857908_100015361967 [0,1,0,0,0,0|3,0,0]=4 655 B11R1.81 Nc1cc(ncc1OCF)Br 34a_100009819941_100015361967 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.81 Nc1cc(ncc1OCF)Br 7a_100009819941_100015361967 [0,1,0,0,0,0|3,0,0]=4 657 B11R1.81 Nc1cc(ncc1SCF)Cl 62a_100010209552_100015361967 [0,1,0,0,0,0|3,0,0]=4 658 B11R1.81 Nc1cc(ncc1SCF)Cl 62a_100015361967_100010209552 [0,1,0,0,0,0|3,0,0]=4 659 B11R1.81 Nc1ccc(c(n1)N)SCF 62a_100011356871_100015361967 [0,1,0,0,0,0|3,0,0]=4 660 B11R1.81 Nc1nc(ccc1OCF)Br 34a_100000685527_100015361967 [0,1,0,0,0,0|3,0,0]=4 661 B11R1.81 Nc1nc(ccc1OCF)Br 7a_100000685527_100015361967 [0,1,0,0,0,0|3,0,0]=4 662 B11R1.81 Nc1nc(ccc1OCF)Cl 34a_100000717809_100015361967 [0,1,0,0,0,0|3,0,0]=4 663 B11R1.81 Nc1nc(ccc1OCF)Cl 7a_100000717809_100015361967 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.81 Nc1nc(ccc1SCF)Cl 62a_100010171640_100015361967 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.81 Nc1nc(ccc1SCF)Cl 62a_100015361967_100010171640 [0,1,0,0,0,0|3,0,0]=4 666 B11R1.81 Nc1nc(ccc1SCF)F 62a_100009854977_100015361967 [0,1,0,0,0,0|3,0,0]=4 667 B11R1.81 Nc1nc(ccc1SCF)F 62a_100015361967_100009854977 [0,1,0,0,0,0|3,0,0]=4 668 B11R1.81 Nc1nc(ncc1SCF)Cl 62a_100010196077_100015361967 [0,1,0,0,0,0|2,0,0]=3 669 B11R1.81 Nc1nc(ncc1SCF)Cl 62a_100015361967_100010196077 [0,1,0,0,0,0|2,0,0]=3 670 B11R1.81 Nc1ncc(c(n1)N)OCF 7a_100025726691_100015361967 [0,1,0,0,0,0|2,0,0]=3 671 B11R1.81 Nc1ncc(c(n1)N)SCF 62a_100015361967_200010734216 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.81 Nc1ncc(c(n1)N)SCF 62a_200010734216_100015361967 [0,1,0,0,0,0|2,0,0]=3 673 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 34a_100000718831_200025704644 [0,1,0,0,0,0|3,0,0]=4 674 B11R1.81 [13CH3]OCc1ccc(cc1N)Br 7a_100000718831_200025704644 [0,1,0,0,0,0|3,0,0]=4 675 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 34a_100000238622_200025704644 [0,1,0,0,0,0|3,0,0]=4 676 B11R1.81 [13CH3]OCc1ccc(cc1N)Cl 7a_100000238622_200025704644 [0,1,0,0,0,0|3,0,0]=4 677 B11R1.81 [13CH3]OCc1ccc(cc1N)F 34a_100011996588_200025704644 [0,1,0,0,0,0|3,0,0]=4 678 B11R1.81 [13CH3]OCc1ccc(nc1Br)Br 34a_200010005763_200025704644 [0,1,0,0,0,0|3,0,0]=4 679 B11R1.81 [13CH3]OCc1ccc(nc1Br)Br 7a_200010005763_200025704644 [0,1,0,0,0,0|3,0,0]=4 680 B11R1.81 [13CH3]OCc1ccc(nc1Cl)Cl 34a_100000720492_200025704644 [0,1,0,0,0,0|3,0,0]=4 681 B11R1.81 [13CH3]OCc1ccc(nc1Cl)Cl 7a_100000720492_200025704644 [0,1,0,0,0,0|3,0,0]=4 682 B11R1.81 [13CH3]OCc1ccc(nc1F)Br 34a_100010065253_200025704644 [0,1,0,0,0,0|3,0,0]=4 683 B11R1.81 [13CH3]OCc1ccc(nc1F)Br 7a_100010065253_200025704644 [0,1,0,0,0,0|3,0,0]=4 684 B11R1.81 [13CH3]OCc1ccc(nc1F)Cl 34a_100009870654_200025704644 [0,1,0,0,0,0|3,0,0]=4 685 B11R1.81 [13CH3]OCc1ccc(nc1F)Cl 7a_100009870654_200025704644 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.81 [13CH3]OCc1cnc(cc1Cl)Cl 34a_100000702863_200025704644 [0,1,0,0,0,0|3,0,0]=4 687 B11R1.81 [13CH3]OCc1cnc(cc1Cl)Cl 7a_100000702863_200025704644 [0,1,0,0,0,0|3,0,0]=4 688 B11R1.81 [13CH3]OCc1cnc(cc1N)Cl 34a_100009830438_200025704644 [0,1,0,0,0,0|2,0,0]=3 689 B11R1.81 [13CH3]OCc1cnc(nc1Cl)Cl 34a_200009828795_200025704644 [0,1,0,0,0,0|2,0,0]=3 690 B11R1.81 [13CH3]OCc1cnc(nc1Cl)Cl 7a_200009828795_200025704644 [0,1,0,0,0,0|2,0,0]=3 691 B11R1.81 [13CH3]OCc1cnc(nc1N)Cl 7a_200009965464_200025704644 [0,1,0,0,0,0|1,0,0]=2 692 B11R1.81 [13CH3]OCc1cnc(nc1N)N 7a_100000083744_200025704644 [0,1,0,0,0,0|1,0,0]=2 693 B11R1.81 [13CH3]SCc1cnc(nc1Cl)Cl 62a_100000071240_200025704644 [0,1,0,0,0,0|2,1,0]=4 694 B11R1.81 [13CH3]SCc1cnc(nc1Cl)Cl 62a_200025704644_100000071240 [0,1,0,0,0,0|2,1,0]=4 695 B11R1.166 C=C(C)c1ccc(nc1N)C 271570a_100000694244_100009816662 [0,1,0,0,0,0|2,0,1]=4 696 B11R1.166 C=C(C)c1cnc(cc1N)C 271570a_100000694244_100009817891 [0,1,0,0,0,0|2,0,1]=4 697 B11R1.166 C=C(C)c1cnc(nc1N)C 271570a_100000694244_100000684960 [0,1,0,0,0,0|1,0,1]=3 698 B11R1.166 C=C(C)c1cnc(nc1N)N 271570a_100000694244_200010734216 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.277 C=Cc1cc(c(nc1N)C)Br 271570a_100011290941_100000684678 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.277 C=Cc1cc(c(nc1N)C)C 271570a_100011290941_100009990238 [0,1,0,0,0,0|2,0,1]=4 701 B11R1.277 COc1cc(c(nc1N)C)O 271570a_203496583355_200010892190 [0,1,0,0,0,0|3,0,0]=4 702 B11R1.277 CSc1cc(c(nc1N)C)Br 62a_100000684678_200000210301 [0,1,0,0,0,0|3,0,0]=4 703 B11R1.277 CSc1cc(c(nc1N)C)Br 62a_200000210301_100000684678 [0,1,0,0,0,0|3,0,0]=4 704 B11R1.277 CSc1cc(c(nc1N)C)C 62a_100009990238_200000210301 [0,1,0,0,0,0|3,0,0]=4 705 B11R1.277 CSc1cc(c(nc1N)C)C 62a_200000210301_100009990238 [0,1,0,0,0,0|3,0,0]=4 706 B11R1.277 Cc1cc(c(cc1C)CO)O 271570a_203496583355_100010184405 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.277 Cc1cc(c(nc1C)N)S[13CH3] 62a_100009990238_200025704644 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.277 Cc1cc(c(nc1C)N)S[13CH3] 62a_200025704644_100009990238 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.277 Cc1nc(c(cc1Br)S[13CH3])N 62a_100000684678_200025704644 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.277 Cc1nc(c(cc1Br)S[13CH3])N 62a_200025704644_100000684678 [0,1,0,0,0,0|3,0,0]=4 711 B11R1.279 C=Cc1cc(c(cn1)CO)C 271570a_100011290941_100010277336 [0,1,0,0,0,0|2,0,1]=4 712 B11R1.279 C=Cc1cc(c(cn1)CO)N 271570a_100011290941_100009830438 [0,1,0,0,0,0|1,0,1]=3 713 B11R1.279 C=Cc1ccc(c(c1)N)CO 271570a_100011290941_100000718831 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.279 C=Cc1ccc(c(n1)F)CO 271570a_100011290941_100009870654 [0,1,0,0,0,0|2,0,1]=4 715 B11R1.279 C=Cc1ccc(nc1N)OC 271570a_100011290941_100010187629 [0,1,0,0,0,0|2,0,1]=4 716 B11R1.279 C=Cc1cnc(cc1N)OC 271570a_100011290941_100010254562 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.279 C=Cc1cnc(nc1C)OC 271570a_100011290941_100010152497 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.279 C=Cc1cnc(nc1C)SC 271570a_100011290941_100015672207 [0,1,0,0,0,0|2,0,1]=4 719 B11R1.279 C=Cc1cnc(nc1Cl)SC 271570a_100011290941_100010271306 [0,1,0,0,0,0|2,0,1]=4 720 B11R1.279 C=Cc1cnc(nc1N)OC 271570a_100011290941_100010218985 [0,1,0,0,0,0|1,0,1]=3 721 B11R1.279 C=Cc1cnc(nc1O)SC 271570a_100011290941_100010221251 [0,1,0,0,0,0|2,0,1]=4 722 B11R1.279 C=Cc1ncc(c(n1)N)C#N 271570a_100011290941_100000041447 [0,1,0,0,0,0|1,0,2]=4 723 B11R1.279 C=Cc1ncc(c(n1)N)CO 271570a_100011290941_200009965464 [0,1,0,0,0,0|0,0,1]=2 724 B11R1.279 C=Cc1ncc(c(n1)N)OC 271570a_100011290941_100009886850 [0,1,0,0,0,0|2,0,1]=4 725 B11R1.279 CCc1ccc(cc1N)SC 62a_100012354963_200000210301 [0,1,0,0,0,0|3,0,0]=4 726 B11R1.279 CCc1ccc(cc1N)SC 62a_200000210301_100012354963 [0,1,0,0,0,0|3,0,0]=4 727 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_100012354963_200025704644 [0,1,0,0,0,0|3,0,0]=4 728 B11R1.279 CCc1ccc(cc1N)S[13CH3] 62a_200025704644_100012354963 [0,1,0,0,0,0|3,0,0]=4 729 B11R1.279 CNc1ccc(c(c1)C)CO 34a_100000102464_200000210301 [0,1,0,0,0,0|3,0,0]=4 730 B11R1.279 CNc1ccc(c(c1)Cl)CO 34a_100000689119_200000210301 [0,1,0,0,0,0|3,0,0]=4 731 B11R1.279 CNc1ccc(c(n1)F)CO 27a_100102657272_100010065253 [0,1,0,0,0,0|2,0,0]=3 732 B11R1.279 CNc1ccc(c(n1)N)C#N 27a_100102657272_100000719313 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.279 CNc1cnc(cc1N)SC 62a_200000210301_200015721873 [0,1,0,0,0,0|3,0,0]=4 734 B11R1.279 CNc1cnc(cc1N)SC 62a_200015721873_200000210301 [0,1,0,0,0,0|3,0,0]=4 735 B11R1.279 CNc1cnc(cc1N)S[13CH3] 62a_200015721873_200025704644 [0,1,0,0,0,0|3,0,0]=4 736 B11R1.279 CNc1cnc(cc1N)S[13CH3] 62a_200025704644_200015721873 [0,1,0,0,0,0|3,0,0]=4 737 B11R1.279 CNc1ncc(c(n1)C)OC 27a_100102657272_100010382893 [0,1,0,0,0,0|3,0,0]=4 738 B11R1.279 CNc1ncc(c(n1)N)C#N 27a_100102657272_100000041447 [0,1,0,0,0,0|1,0,1]=3 739 B11R1.279 CNc1ncc(c(n1)N)CO 27a_100102657272_200009965464 [0,1,0,0,0,0|0,0,0]=1 740 B11R1.279 COc1cc(c(cn1)SC)N 62a_100010254562_200000210301 [0,1,0,0,0,0|3,0,0]=4 741 B11R1.279 COc1cc(c(cn1)SC)N 62a_200000210301_100010254562 [0,1,0,0,0,0|3,0,0]=4 742 B11R1.279 COc1cc(c(cn1)S[13CH3])N 62a_100010254562_200025704644 [0,1,0,0,0,0|3,0,0]=4 743 B11R1.279 COc1cc(c(cn1)S[13CH3])N 62a_200025704644_100010254562 [0,1,0,0,0,0|3,0,0]=4 744 B11R1.279 COc1ccc(c(c1)Br)CO 34a_100010146404_200000210301 [0,1,0,0,0,0|3,0,0]=4 745 B11R1.279 COc1ccc(c(c1)Br)CO 7a_100010146404_200000210301 [0,1,0,0,0,0|3,0,0]=4 746 B11R1.279 COc1ccc(c(c1)Cl)CO 34a_200000075811_200000210301 [0,1,0,0,0,0|3,0,0]=4 747 B11R1.279 COc1ccc(c(c1)Cl)CO 7a_200000075811_200000210301 [0,1,0,0,0,0|3,0,0]=4 748 B11R1.279 COc1ccc(c(c1)F)CO 34a_100000084598_200000210301 [0,1,0,0,0,0|3,0,0]=4 749 B11R1.279 COc1ccc(c(c1)F)CO 7a_100000084598_200000210301 [0,1,0,0,0,0|3,0,0]=4 750 B11R1.279 COc1ccc(c(c1)O)CO 271570a_203496583355_100011982768 [0,1,0,0,0,0|3,0,0]=4 751 B11R1.279 COc1ccc(c(n1)N)SC 62a_100010187629_200000210301 [0,1,0,0,0,0|3,0,0]=4 752 B11R1.279 COc1ccc(c(n1)N)S[13CH3] 62a_100010187629_200025704644 [0,1,0,0,0,0|3,0,0]=4 753 B11R1.279 COc1ccc(c(n1)O)CO 271570a_203496583355_100009885603 [0,1,0,0,0,0|2,0,0]=3 754 B11R1.279 COc1ccc(nc1N)SC 62a_100010192976_200000210301 [0,1,0,0,0,0|3,0,0]=4 755 B11R1.279 COc1ccc(nc1N)S[13CH3] 62a_100010192976_200025704644 [0,1,0,0,0,0|3,0,0]=4 756 B11R1.279 COc1cnc(cc1N)SC 62a_100010896307_200000210301 [0,1,0,0,0,0|3,0,0]=4 757 B11R1.279 COc1cnc(cc1N)SC 62a_200000210301_100010896307 [0,1,0,0,0,0|3,0,0]=4 758 B11R1.279 COc1cnc(cc1N)S[13CH3] 62a_100010896307_200025704644 [0,1,0,0,0,0|3,0,0]=4 759 B11R1.279 COc1cnc(cc1N)S[13CH3] 62a_200025704644_100010896307 [0,1,0,0,0,0|3,0,0]=4 760 B11R1.279 COc1cnc(nc1C)SC 62a_100010382893_200000210301 [0,1,0,0,0,0|3,0,0]=4 761 B11R1.279 COc1cnc(nc1C)SC 62a_200000210301_100010382893 [0,1,0,0,0,0|3,0,0]=4 762 B11R1.279 COc1cnc(nc1C)S[13CH3] 62a_100010382893_200025704644 [0,1,0,0,0,0|3,0,0]=4 763 B11R1.279 COc1cnc(nc1C)S[13CH3] 62a_200025704644_100010382893 [0,1,0,0,0,0|3,0,0]=4 764 B11R1.279 COc1cnc(nc1N)SC 62a_100009886850_200000210301 [0,1,0,0,0,0|2,0,0]=3 765 B11R1.279 COc1cnc(nc1N)SC 62a_200000210301_100009886850 [0,1,0,0,0,0|2,0,0]=3 766 B11R1.279 COc1cnc(nc1N)S[13CH3] 62a_100009886850_200025704644 [0,1,0,0,0,0|2,0,0]=3 767 B11R1.279 COc1cnc(nc1N)S[13CH3] 62a_200025704644_100009886850 [0,1,0,0,0,0|2,0,0]=3 768 B11R1.279 COc1cnc(nc1O)SC 271570a_203496583355_100000075546 [0,1,0,0,0,0|3,0,0]=4 769 B11R1.279 COc1ncc(c(n1)C)SC 62a_100010152497_200000210301 [0,1,0,0,0,0|3,0,0]=4 770 B11R1.279 COc1ncc(c(n1)C)SC 62a_200000210301_100010152497 [0,1,0,0,0,0|3,0,0]=4 771 B11R1.279 COc1ncc(c(n1)C)S[13CH3] 62a_100010152497_200025704644 [0,1,0,0,0,0|3,0,0]=4 772 B11R1.279 COc1ncc(c(n1)C)S[13CH3] 62a_200025704644_100010152497 [0,1,0,0,0,0|3,0,0]=4 773 B11R1.279 COc1ncc(c(n1)N)SC 62a_100010218985_200000210301 [0,1,0,0,0,0|2,0,0]=3 774 B11R1.279 COc1ncc(c(n1)N)SC 62a_200000210301_100010218985 [0,1,0,0,0,0|2,0,0]=3 775 B11R1.279 COc1ncc(c(n1)N)S[13CH3] 62a_100010218985_200025704644 [0,1,0,0,0,0|2,0,0]=3 776 B11R1.279 COc1ncc(c(n1)N)S[13CH3] 62a_200025704644_100010218985 [0,1,0,0,0,0|2,0,0]=3 777 B11R1.279 CSc1cc(c(cn1)C=O)N 62a_100000050503_200000210301 [0,1,0,0,0,0|1,0,2]=4 778 B11R1.279 CSc1cc(c(cn1)C=O)N 62a_200000210301_100000050503 [0,1,0,0,0,0|1,0,2]=4 779 B11R1.279 CSc1cc(c(cn1)CO)C 62a_100010277336_200000210301 [0,1,0,0,0,0|2,0,0]=3 780 B11R1.279 CSc1cc(c(cn1)CO)C 62a_200000210301_100010277336 [0,1,0,0,0,0|2,0,0]=3 781 B11R1.279 CSc1cc(c(cn1)CO)N 62a_100009830438_200000210301 [0,1,0,0,0,0|1,0,0]=2 782 B11R1.279 CSc1cc(c(cn1)CO)N 62a_200000210301_100009830438 [0,1,0,0,0,0|1,0,0]=2 783 B11R1.279 CSc1ccc(c(c1)Br)CO 62a_100010240206_200000210301 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.279 CSc1ccc(c(c1)Br)CO 62a_200000210301_100010240206 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.279 CSc1ccc(c(c1)C)CO 62a_100000748258_200000210301 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.279 CSc1ccc(c(c1)C)CO 62a_200000210301_100000748258 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.279 CSc1ccc(c(c1)F)CO 62a_100011191541_200000210301 [0,1,0,0,0,0|3,0,0]=4 788 B11R1.279 CSc1ccc(c(c1)F)CO 62a_200000210301_100011191541 [0,1,0,0,0,0|3,0,0]=4 789 B11R1.279 CSc1ccc(c(c1)N)CO 62a_100000718831_200000210301 [0,1,0,0,0,0|2,0,0]=3 790 B11R1.279 CSc1ccc(c(c1)N)CO 62a_200000210301_100000718831 [0,1,0,0,0,0|2,0,0]=3 791 B11R1.279 CSc1ccc(c(c1)O)CO 62a_100000071718_200000210301 [0,1,0,0,0,0|3,0,0]=4 792 B11R1.279 CSc1ccc(c(c1)O)CO 62a_200000210301_100000071718 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.279 CSc1ccc(c(n1)F)CO 62a_100009870654_200000210301 [0,1,0,0,0,0|2,0,0]=3 794 B11R1.279 CSc1ccc(c(n1)F)CO 62a_200000210301_100009870654 [0,1,0,0,0,0|2,0,0]=3 795 B11R1.279 CSc1ccc(c(n1)N)C#N 62a_200000210301_100000719313 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.279 CSc1ncc(c(n1)C)SC 62a_100015672207_200000210301 [0,1,0,0,0,0|3,0,0]=4 797 B11R1.279 CSc1ncc(c(n1)C)SC 62a_200000210301_100015672207 [0,1,0,0,0,0|3,0,0]=4 798 B11R1.279 CSc1ncc(c(n1)C)S[13CH3] 62a_100015672207_200025704644 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.279 CSc1ncc(c(n1)C)S[13CH3] 62a_200025704644_100015672207 [0,1,0,0,0,0|3,0,0]=4 800 B11R1.279 CSc1ncc(c(n1)Cl)SC 62a_100010271306_200000210301 [0,1,0,0,0,0|3,0,0]=4 801 B11R1.279 CSc1ncc(c(n1)Cl)SC 62a_200000210301_100010271306 [0,1,0,0,0,0|3,0,0]=4 802 B11R1.279 CSc1ncc(c(n1)Cl)S[13CH3] 62a_100010271306_200025704644 [0,1,0,0,0,0|3,0,0]=4 803 B11R1.279 CSc1ncc(c(n1)Cl)S[13CH3] 62a_200025704644_100010271306 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.279 CSc1ncc(c(n1)N)C#N 62a_100009813519_200000210301 [0,1,0,0,0,0|1,0,1]=3 805 B11R1.279 CSc1ncc(c(n1)N)C#N 62a_200000210301_100000041447 [0,1,0,0,0,0|1,0,1]=3 806 B11R1.279 CSc1ncc(c(n1)N)C=O 62a_100010726233_200000210301 [0,1,0,0,0,0|0,0,2]=3 807 B11R1.279 CSc1ncc(c(n1)N)C=O 62a_200000210301_100010726233 [0,1,0,0,0,0|0,0,2]=3 808 B11R1.279 CSc1ncc(c(n1)N)CO 62a_200000210301_200009965464 [0,1,0,0,0,0|0,0,0]=1 809 B11R1.279 CSc1ncc(c(n1)N)CO 62a_200009965464_200000210301 [0,1,0,0,0,0|0,0,0]=1 810 B11R1.279 CSc1ncc(c(n1)O)C#N 271570a_203496583355_100000076254 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.279 CSc1ncc(c(n1)O)C=O 271570a_203496583355_100009862043 [0,1,0,0,0,0|1,0,2]=4 812 B11R1.279 CSc1ncc(c(n1)O)CO 271570a_203496583355_100009869927 [0,1,0,0,0,0|1,0,0]=2 813 B11R1.279 CSc1ncc(c(n1)O)SC 62a_100009995076_200000210301 [0,1,0,0,0,0|3,0,0]=4 814 B11R1.279 CSc1ncc(c(n1)O)SC 62a_200000210301_100009995076 [0,1,0,0,0,0|3,0,0]=4 815 B11R1.279 CSc1ncc(c(n1)O)S[13CH3] 62a_100009995076_200025704644 [0,1,0,0,0,0|3,0,0]=4 816 B11R1.279 CSc1ncc(c(n1)O)S[13CH3] 62a_200025704644_100009995076 [0,1,0,0,0,0|3,0,0]=4 817 B11R1.279 Cc1cc(ccc1CO)N[13CH3] 34a_100000102464_200025704644 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.279 Cc1cc(ccc1CO)S[13CH3] 62a_100000748258_200025704644 [0,1,0,0,0,0|3,0,0]=4 819 B11R1.279 Cc1cc(ccc1CO)S[13CH3] 62a_200025704644_100000748258 [0,1,0,0,0,0|3,0,0]=4 820 B11R1.279 Cc1cc(ncc1CO)S[13CH3] 62a_100010277336_200025704644 [0,1,0,0,0,0|2,0,0]=3 821 B11R1.279 Cc1cc(ncc1CO)S[13CH3] 62a_200025704644_100010277336 [0,1,0,0,0,0|2,0,0]=3 822 B11R1.279 OCc1ccc(c(c1)O)CO 271570a_203496583355_100010881536 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.279 [13CH3]Nc1ccc(c(c1)Cl)CO 34a_100000689119_200025704644 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)CO 34a_100010146404_200025704644 [0,1,0,0,0,0|3,0,0]=4 825 B11R1.279 [13CH3]Oc1ccc(c(c1)Br)CO 7a_100010146404_200025704644 [0,1,0,0,0,0|3,0,0]=4 826 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CO 34a_200000075811_200025704644 [0,1,0,0,0,0|3,0,0]=4 827 B11R1.279 [13CH3]Oc1ccc(c(c1)Cl)CO 7a_200000075811_200025704644 [0,1,0,0,0,0|3,0,0]=4 828 B11R1.279 [13CH3]Oc1ccc(c(c1)F)CO 34a_100000084598_200025704644 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.279 [13CH3]Oc1ccc(c(c1)F)CO 7a_100000084598_200025704644 [0,1,0,0,0,0|3,0,0]=4 830 B11R1.279 [13CH3]Sc1cc(c(cn1)C=O)N 62a_100000050503_200025704644 [0,1,0,0,0,0|1,0,2]=4 831 B11R1.279 [13CH3]Sc1cc(c(cn1)C=O)N 62a_200025704644_100000050503 [0,1,0,0,0,0|1,0,2]=4 832 B11R1.279 [13CH3]Sc1cc(c(cn1)CO)N 62a_100009830438_200025704644 [0,1,0,0,0,0|1,0,0]=2 833 B11R1.279 [13CH3]Sc1cc(c(cn1)CO)N 62a_200025704644_100009830438 [0,1,0,0,0,0|1,0,0]=2 834 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)CO 62a_100010240206_200025704644 [0,1,0,0,0,0|3,0,0]=4 835 B11R1.279 [13CH3]Sc1ccc(c(c1)Br)CO 62a_200025704644_100010240206 [0,1,0,0,0,0|3,0,0]=4 836 B11R1.279 [13CH3]Sc1ccc(c(c1)F)CO 62a_100011191541_200025704644 [0,1,0,0,0,0|3,0,0]=4 837 B11R1.279 [13CH3]Sc1ccc(c(c1)F)CO 62a_200025704644_100011191541 [0,1,0,0,0,0|3,0,0]=4 838 B11R1.279 [13CH3]Sc1ccc(c(c1)N)CO 62a_100000718831_200025704644 [0,1,0,0,0,0|2,0,0]=3 839 B11R1.279 [13CH3]Sc1ccc(c(c1)N)CO 62a_200025704644_100000718831 [0,1,0,0,0,0|2,0,0]=3 840 B11R1.279 [13CH3]Sc1ccc(c(c1)O)CO 62a_100000071718_200025704644 [0,1,0,0,0,0|3,0,0]=4 841 B11R1.279 [13CH3]Sc1ccc(c(c1)O)CO 62a_200025704644_100000071718 [0,1,0,0,0,0|3,0,0]=4 842 B11R1.279 [13CH3]Sc1ccc(c(n1)F)CO 62a_100009870654_200025704644 [0,1,0,0,0,0|2,0,0]=3 843 B11R1.279 [13CH3]Sc1ccc(c(n1)F)CO 62a_200025704644_100009870654 [0,1,0,0,0,0|2,0,0]=3 844 B11R1.279 [13CH3]Sc1ccc(c(n1)N)C#N 62a_200025704644_100000719313 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.279 [13CH3]Sc1ncc(c(n1)N)C#N 62a_100009813519_200025704644 [0,1,0,0,0,0|1,0,1]=3 846 B11R1.279 [13CH3]Sc1ncc(c(n1)N)C#N 62a_200025704644_100000041447 [0,1,0,0,0,0|1,0,1]=3 847 B11R1.279 [13CH3]Sc1ncc(c(n1)N)C=O 62a_100010726233_200025704644 [0,1,0,0,0,0|0,0,2]=3 848 B11R1.279 [13CH3]Sc1ncc(c(n1)N)C=O 62a_200025704644_100010726233 [0,1,0,0,0,0|0,0,2]=3 849 B11R1.279 [13CH3]Sc1ncc(c(n1)N)CO 62a_200009965464_200025704644 [0,1,0,0,0,0|0,0,0]=1 850 B11R1.279 [13CH3]Sc1ncc(c(n1)N)CO 62a_200025704644_200009965464 [0,1,0,0,0,0|0,0,0]=1 851 B11R1.464 C=Cc1c(cc(nc1C)C)N 271570a_100011290941_100010261885 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.464 C=Cc1c(nc(nc1Cl)C)C 271570a_100011290941_200011356833 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.464 CSc1c(cc(nc1C)C)N 62a_100010261885_200000210301 [0,1,0,0,0,0|3,0,0]=4 854 B11R1.464 CSc1c(cc(nc1C)C)N 62a_200000210301_100010261885 [0,1,0,0,0,0|3,0,0]=4 855 B11R1.464 CSc1c(nc(nc1Cl)C)C 62a_200000210301_200011356833 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.464 CSc1c(nc(nc1Cl)C)C 62a_200011356833_200000210301 [0,1,0,0,0,0|3,0,0]=4 857 B11R1.464 CSc1c(nc(nc1Cl)C)Cl 62a_100012456929_200000210301 [0,1,0,0,0,0|3,0,0]=4 858 B11R1.464 CSc1c(nc(nc1Cl)C)Cl 62a_200000210301_100012456929 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.464 CSc1c(nc(nc1O)N)N 62a_200009812812_200000210301 [0,1,0,0,0,0|3,0,0]=4 860 B11R1.464 Cc1cc(c(c(c1)F)CO)O 271570a_203496583355_100016175008 [0,1,0,0,0,0|3,0,0]=4 861 B11R1.464 Cc1cc(c(c(n1)C)S[13CH3])N 62a_100010261885_200025704644 [0,1,0,0,0,0|3,0,0]=4 862 B11R1.464 Cc1cc(c(c(n1)C)S[13CH3])N 62a_200025704644_100010261885 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.464 Cc1nc(c(c(n1)Cl)S[13CH3])C 62a_200011356833_200025704644 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.464 Cc1nc(c(c(n1)Cl)S[13CH3])C 62a_200025704644_200011356833 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.464 Cc1nc(c(c(n1)Cl)S[13CH3])Cl 62a_100012456929_200025704644 [0,1,0,0,0,0|3,0,0]=4 866 B11R1.464 Cc1nc(c(c(n1)Cl)S[13CH3])Cl 62a_200025704644_100012456929 [0,1,0,0,0,0|3,0,0]=4 867 B11R1.464 N#Cc1c(nc(nc1O)N)N 271570a_203496583355_100010978646 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.464 [13CH3]Sc1c(nc(nc1O)N)N 62a_200009812812_200025704644 [0,1,0,0,0,0|3,0,0]=4 869 B11R2.36 Oc1cc2c(cn1)CCN2 271570a_203496583355_100020639910 [0,0,0,1,0,0|3,0,0]=4 870 B11R2.36 Oc1ncc2c(n1)CCC2 271570a_203496583355_100009881048 [0,0,0,1,0,0|3,0,0]=4 871 B9R1.22 C=Cc1cn(nc1N)C 271570a_100011290941_100010776223 [0,0,0,0,1,0|2,0,1]=4 872 B9R1.22 CSc1cn(nc1N)C 62a_100010776223_200000210301 [0,0,0,0,1,0|3,0,0]=4 873 B9R1.22 CSc1cn(nc1N)C 62a_200000210301_100010776223 [0,0,0,0,1,0|3,0,0]=4 874 B9R1.22 Cc1nc(c(s1)O)CO 271570a_203496583355_100011103066 [0,0,0,0,1,0|2,0,0]=3 875 B9R1.22 Cc1nc(sc1CO)O 271570a_203496583355_100010264302 [0,0,0,0,1,0|3,0,0]=4 876 B9R1.22 Cc1sc(nc1CO)O 271570a_203496583355_100010127906 [0,0,0,0,1,0|3,0,0]=4 877 B9R1.22 Cn1cc(c(n1)CO)O 271570a_203496583355_100009816719 [0,0,0,0,1,0|3,0,0]=4 878 B9R1.22 Cn1cc(c(n1)N)S[13CH3] 62a_100010776223_200025704644 [0,0,0,0,1,0|3,0,0]=4 879 B9R1.22 Cn1cc(c(n1)N)S[13CH3] 62a_200025704644_100010776223 [0,0,0,0,1,0|3,0,0]=4 880 B9R1.132 CSc1cnn(c1N)C 62a_100020588448_200000210301 [0,0,0,0,1,0|3,0,0]=4 881 B9R1.132 CSc1cnn(c1N)C 62a_200000210301_100020588448 [0,0,0,0,1,0|3,0,0]=4 882 B9R1.132 Cc1n[nH]c(c1O)CO 271570a_203496583355_100015664438 [0,0,0,0,1,0|2,0,0]=3 883 B9R1.132 Cn1ncc(c1N)S[13CH3] 62a_100020588448_200025704644 [0,0,0,0,1,0|3,0,0]=4 884 B9R1.132 Cn1ncc(c1N)S[13CH3] 62a_200025704644_100020588448 [0,0,0,0,1,0|3,0,0]=4 885 B9R1.132 Cn1ncc(c1O)CO 271570a_203496583355_100011063722 [0,0,0,0,1,0|2,0,0]=3 886 B8R1.2 C=Cc1cncnc1 271570a_100011290941_100011206942 [2,0,0,0,0,0|1,0,1]=4 887 B8R1.2 COc1cncnc1 7a_100000754086_200000210301 [2,0,0,0,0,0|2,0,0]=4 888 B8R1.2 CSc1cncnc1 62a_100011206942_200000210301 [2,0,0,0,0,0|2,0,0]=4 889 B8R1.2 CSc1cncnc1 62a_200000210301_100011206942 [2,0,0,0,0,0|2,0,0]=4 890 B8R1.2 [13CH3]Oc1cncnc1 7a_100000754086_200025704644 [2,0,0,0,0,0|2,0,0]=4 891 B8R1.2 [13CH3]Sc1cncnc1 62a_100011206942_200025704644 [2,0,0,0,0,0|2,0,0]=4 892 B8R1.2 [13CH3]Sc1cncnc1 62a_200025704644_100011206942 [2,0,0,0,0,0|2,0,0]=4 893 B8R1.3 Cc1ccc(cc1)O 271570a_203496583355_100000186775 [2,0,0,0,0,0|2,0,0]=4 894 B8R1.3 Cc1ccc(cn1)O 271570a_203496583355_100000751577 [2,0,0,0,0,0|1,0,0]=3 895 B8R1.3 Cc1ccc(nc1)O 271570a_203496583355_100000754016 [2,0,0,0,0,0|2,0,0]=4 896 B8R1.3 Cc1ccc(nn1)O 271570a_203496583355_100011450037 [2,0,0,0,0,0|2,0,0]=4 897 B8R1.3 Cc1cnc(cn1)O 271570a_203496583355_100011999403 [2,0,0,0,0,0|2,0,0]=4 898 B8R1.3 Cc1cnc(nc1)O 271570a_203496583355_100011825175 [2,0,0,0,0,0|1,0,0]=3 899 B8R1.3 Cc1ncc(cn1)O 271570a_203496583355_100000686985 [2,0,0,0,0,0|0,0,0]=2 900 B8R1.3 Nc1ccc(cn1)O 271570a_203496583355_100000187370 [2,0,0,0,0,0|2,0,0]=4 901 B8R1.3 Nc1cnc(nc1)O 271570a_203496583355_100000068403 [2,0,0,0,0,0|2,0,0]=4 902 B8R1.3 Nc1ncc(cn1)O 271570a_203496583355_100000760574 [2,0,0,0,0,0|1,0,0]=3 903 B8R1.3 Nc1ncc(nn1)O 271570a_203496583355_100000691435 [2,0,0,0,0,0|2,0,0]=4 904 B8R1.3 O=c1ncc(c[nH]1)O 271570a_203496583355_102495366499 [2,0,0,0,0,0|1,0,1]=4 905 B8R1.3 Oc1ccc(nc1)Br 271570a_203496583355_100009814638 [2,0,0,0,0,0|2,0,0]=4 906 B8R1.3 Oc1ccc(nc1)Cl 271570a_203496583355_100000034144 [2,0,0,0,0,0|2,0,0]=4 907 B8R1.3 Oc1ccc(nc1)F 271570a_203496583355_100000748661 [2,0,0,0,0,0|2,0,0]=4 908 B8R1.3 Oc1ccc(nc1)O 271570a_203496583355_100000685995 [2,0,0,0,0,0|2,0,0]=4 909 B8R1.3 Oc1cnc(nc1)Br 271570a_203496583355_200012349914 [2,0,0,0,0,0|1,0,0]=3 910 B8R1.3 Oc1cnc(nc1)F 271570a_203496583355_100000685262 [2,0,0,0,0,0|1,0,0]=3 911 B8R1.3 Oc1cnc(nc1)O 271570a_203496583355_100000730009 [2,0,0,0,0,0|1,0,0]=3 912 B8R1.3 Oc1ncc(cn1)Br 271570a_203496583355_100000690281 [2,0,0,0,0,0|2,0,0]=4 913 B8R1.3 Oc1ncc(cn1)Cl 271570a_203496583355_100011356929 [2,0,0,0,0,0|2,0,0]=4 914 B8R1.3 Oc1ncc(cn1)F 271570a_203496583355_100000685220 [2,0,0,0,0,0|2,0,0]=4 915 B8R1.5 Cc1cccnc1O 271570a_203496583355_100000751373 [2,0,0,0,0,0|2,0,0]=4 916 B8R1.5 Cc1ccncc1O 271570a_203496583355_100000761580 [2,0,0,0,0,0|2,0,0]=4 917 B8R1.5 Cc1cnccc1O 271570a_203496583355_100015191297 [2,0,0,0,0,0|2,0,0]=4 918 B8R1.5 Cc1cncnc1O 271570a_203496583355_100011998708 [2,0,0,0,0,0|1,0,0]=3 919 B8R1.5 Cc1ncccc1O 271570a_203496583355_100000751574 [2,0,0,0,0,0|2,0,0]=4 920 B8R1.5 Cc1ncncc1O 271570a_203496583355_100009819671 [2,0,0,0,0,0|1,0,0]=3 921 B8R1.5 Nc1ccccc1O 271570a_203496583355_100000210017 [2,0,0,0,0,0|2,0,0]=4 922 B8R1.5 Nc1ccncc1O 271570a_203496583355_100000047001 [2,0,0,0,0,0|1,0,0]=3 923 B8R1.5 Nc1cncnc1O 271570a_203496583355_100000709731 [2,0,0,0,0,0|2,0,0]=4 924 B8R1.5 Nc1cnncc1O 271570a_203496583355_100009829405 [2,0,0,0,0,0|2,0,0]=4 925 B8R1.5 Nc1ncccc1O 271570a_203496583355_100000045569 [2,0,0,0,0,0|1,0,0]=3 926 B8R1.5 Nc1nccnc1O 271570a_203496583355_100000747729 [2,0,0,0,0,0|2,0,0]=4 927 B8R1.5 Nc1ncncc1O 271570a_203496583355_100011996079 [2,0,0,0,0,0|0,0,0]=2 928 B8R1.5 Oc1cccnc1Br 271570a_203496583355_100010202626 [2,0,0,0,0,0|2,0,0]=4 929 B8R1.5 Oc1cccnc1Cl 271570a_203496583355_100000036424 [2,0,0,0,0,0|2,0,0]=4 930 B8R1.5 Oc1cccnc1F 271570a_203496583355_100009816115 [2,0,0,0,0,0|2,0,0]=4 931 B8R1.5 Oc1cccnc1O 271570a_203496583355_100000034122 [2,0,0,0,0,0|2,0,0]=4 932 B8R1.5 Oc1ccncc1O 271570a_203496583355_100009817591 [2,0,0,0,0,0|2,0,0]=4 933 B8R1.5 Oc1cnccc1Br 271570a_203496583355_100010138639 [2,0,0,0,0,0|2,0,0]=4 934 B8R1.5 Oc1cnccc1Cl 271570a_203496583355_100009995489 [2,0,0,0,0,0|2,0,0]=4 935 B8R1.5 Oc1cnccc1F 271570a_203496583355_100009820683 [2,0,0,0,0,0|2,0,0]=4 936 B8R1.5 Oc1cncnc1Br 271570a_203496583355_200012461658 [2,0,0,0,0,0|1,0,0]=3 937 B8R1.5 Oc1cncnc1Cl 271570a_203496583355_100000758962 [2,0,0,0,0,0|1,0,0]=3 938 B8R1.5 Oc1cncnc1O 271570a_203496583355_100000751107 [2,0,0,0,0,0|1,0,0]=3 939 B8R1.5 Oc1ncncc1F 271570a_203496583355_100000069762 [2,0,0,0,0,0|2,0,0]=4 940 B8R1.4 Cc1cc(ccn1)O 271570a_203496583355_100000758586 [2,0,0,0,0,0|2,0,0]=4 941 B8R1.4 Cc1cccc(n1)O 271570a_203496583355_100000742759 [2,0,0,0,0,0|2,0,0]=4 942 B8R1.4 Cc1ccnc(n1)O 271570a_203496583355_100011243806 [2,0,0,0,0,0|2,0,0]=4 943 B8R1.4 Cc1nccc(n1)O 271570a_203496583355_100000749937 [2,0,0,0,0,0|1,0,0]=3 944 B8R1.4 Nc1cccc(n1)O 271570a_203496583355_100000740741 [2,0,0,0,0,0|2,0,0]=4 945 B8R1.4 Nc1ccnc(c1)O 271570a_203496583355_100009814236 [2,0,0,0,0,0|2,0,0]=4 946 B8R1.4 Nc1ccnc(n1)O 271570a_203496583355_100000757536 [2,0,0,0,0,0|1,0,0]=3 947 B8R1.4 Nc1nccc(n1)O 271570a_203496583355_100009820717 [2,0,0,0,0,0|2,0,0]=4 948 B8R1.4 Nc1ncnc(n1)O 271570a_203496583355_100000123831 [2,0,0,0,0,0|2,0,0]=4 949 B8R1.4 Oc1ccnc(n1)O 271570a_203496583355_100011649813 [2,0,0,0,0,0|2,0,0]=4 950 B10R1.1 C=C=Cc1cnc(nc1)C 271570a_100015277604_100000686985 [1,1,0,0,0,0|1,0,1]=4 951 B10R1.1 CC=Cc1cnc(nc1)C 271570a_100016259895_100000686985 [1,1,0,0,0,0|1,0,1]=4 952 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [1,1,0,0,0,0|2,0,0]=4 953 B10R1.1 CCOc1ccc(nc1)C 34a_100000745506_100000210202 [1,1,0,0,0,0|2,0,0]=4 954 B10R1.1 CCOc1ccc(nc1)C 7a_100000745506_100000210202 [1,1,0,0,0,0|2,0,0]=4 955 B10R1.1 CCOc1cnc(nc1)Br 34a_100000730009_100000210202 [1,1,0,0,0,0|2,0,0]=4 956 B10R1.1 CCOc1cnc(nc1)Br 7a_100000730009_100000210202 [1,1,0,0,0,0|2,0,0]=4 957 B10R1.1 CCOc1cnc(nc1)C 34a_100000062939_100000210202 [1,1,0,0,0,0|1,0,0]=3 958 B10R1.1 CCOc1cnc(nc1)C 7a_100000062939_100000210202 [1,1,0,0,0,0|1,0,0]=3 959 B10R1.1 CCOc1cnc(nc1)Cl 34a_100000092845_100000210202 [1,1,0,0,0,0|2,0,0]=4 960 B10R1.1 CCOc1cnc(nc1)Cl 7a_100000092845_100000210202 [1,1,0,0,0,0|2,0,0]=4 961 B10R1.1 CCOc1cnc(nc1)F 34a_200009874573_100000210202 [1,1,0,0,0,0|2,0,0]=4 962 B10R1.1 CCOc1cnc(nc1)F 7a_200009874573_100000210202 [1,1,0,0,0,0|2,0,0]=4 963 B10R1.1 CCOc1cnc(nc1)N 34a_100000087137_100000210202 [1,1,0,0,0,0|2,0,0]=4 964 B10R1.1 CCOc1cnc(nc1)N 7a_100000087137_100000210202 [1,1,0,0,0,0|2,0,0]=4 965 B10R1.1 CCOc1cnc(nc1)O 271570a_203496583355_100000099823 [1,1,0,0,0,0|2,0,0]=4 966 B10R1.1 CCSc1ccc(nc1)C 62a_100000210202_100000751577 [1,1,0,0,0,0|2,0,0]=4 967 B10R1.1 CCSc1ccc(nc1)C 62a_100000751577_100000210202 [1,1,0,0,0,0|2,0,0]=4 968 B10R1.1 CCSc1cnc(nc1)Br 62a_100000210202_200012349914 [1,1,0,0,0,0|2,0,0]=4 969 B10R1.1 CCSc1cnc(nc1)Br 62a_200012349914_100000210202 [1,1,0,0,0,0|2,0,0]=4 970 B10R1.1 CCSc1cnc(nc1)C 62a_100000210202_100000686985 [1,1,0,0,0,0|1,0,0]=3 971 B10R1.1 CCSc1cnc(nc1)C 62a_100000686985_100000210202 [1,1,0,0,0,0|1,0,0]=3 972 B10R1.1 CCSc1cnc(nc1)Cl 62a_100000059775_100000210202 [1,1,0,0,0,0|2,0,0]=4 973 B10R1.1 CCSc1cnc(nc1)Cl 62a_100000210202_100000059775 [1,1,0,0,0,0|2,0,0]=4 974 B10R1.1 CCSc1cnc(nc1)F 62a_100000210202_100000685262 [1,1,0,0,0,0|2,0,0]=4 975 B10R1.1 CCSc1cnc(nc1)F 62a_100000685262_100000210202 [1,1,0,0,0,0|2,0,0]=4 976 B10R1.1 CCSc1cnc(nc1)N 62a_100000210202_100000766020 [1,1,0,0,0,0|2,0,0]=4 977 B10R1.1 CCSc1cnc(nc1)N 62a_100000766020_100000210202 [1,1,0,0,0,0|2,0,0]=4 978 B10R1.1 CNCc1ccc(nc1)C 2230a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 979 B10R1.1 CNCc1ccc(nc1)C 270004a_106832991635_100000743784 [1,1,0,0,0,0|2,0,0]=4 980 B10R1.1 CNCc1ccc(nc1)C 34a_100000740942_200000210301 [1,1,0,0,0,0|2,0,0]=4 981 B10R1.1 CNCc1ccc(nc1)C 34a_100102657272_100016987292 [1,1,0,0,0,0|2,0,0]=4 982 B10R1.1 CNCc1ccc(nc1)C 7a_106832991635_100016987292 [1,1,0,0,0,0|2,0,0]=4 983 B10R1.1 CNCc1cnc(nc1)C 270004a_106832991635_100011202771 [1,1,0,0,0,0|1,0,0]=3 984 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [1,1,0,0,0,0|2,0,0]=4 985 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [1,1,0,0,0,0|2,0,0]=4 986 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [1,1,0,0,0,0|2,0,0]=4 987 B10R1.1 COCc1ccc(nc1)Br 34a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 988 B10R1.1 COCc1ccc(nc1)Br 34a_100138415774_100009831999 [1,1,0,0,0,0|2,0,0]=4 989 B10R1.1 COCc1ccc(nc1)Br 7a_100009816760_200000210301 [1,1,0,0,0,0|2,0,0]=4 990 B10R1.1 COCc1ccc(nc1)C 34a_100011248133_200000210301 [1,1,0,0,0,0|1,0,0]=3 991 B10R1.1 COCc1ccc(nc1)C 34a_100138415774_100016987292 [1,1,0,0,0,0|1,0,0]=3 992 B10R1.1 COCc1ccc(nc1)Cl 34a_100000755211_200000210301 [1,1,0,0,0,0|2,0,0]=4 993 B10R1.1 COCc1ccc(nc1)Cl 34a_100138415774_100000735431 [1,1,0,0,0,0|2,0,0]=4 994 B10R1.1 COCc1ccc(nc1)Cl 7a_100000755211_200000210301 [1,1,0,0,0,0|2,0,0]=4 995 B10R1.1 COCc1ccc(nc1)F 34a_100000079959_200000210301 [1,1,0,0,0,0|2,0,0]=4 996 B10R1.1 COCc1ccc(nc1)F 34a_100138415774_100000099788 [1,1,0,0,0,0|2,0,0]=4 997 B10R1.1 COCc1ccc(nc1)N 34a_100000704267_200000210301 [1,1,0,0,0,0|2,0,0]=4 998 B10R1.1 COCc1cnc(cn1)C 34a_100011273949_200000210301 [1,1,0,0,0,0|2,0,0]=4 999 B10R1.1 COCc1cnc(nc1)C 34a_100011746891_200000210301 [1,1,0,0,0,0|0,0,0]=2 1000 B10R1.1 COCc1cnc(nc1)Cl 34a_100009855073_200000210301 [1,1,0,0,0,0|1,0,0]=3 1001 B10R1.1 COCc1cnc(nc1)Cl 7a_100009855073_200000210301 [1,1,0,0,0,0|1,0,0]=3 1002 B10R1.1 CSCc1ccc(nc1)C 62a_100016987292_200000210301 [1,1,0,0,0,0|1,1,0]=4 1003 B10R1.1 CSCc1ccc(nc1)C 62a_200000210301_100016987292 [1,1,0,0,0,0|1,1,0]=4 1004 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [1,1,0,0,0,0|2,0,0]=4 1005 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [1,1,0,0,0,0|2,0,0]=4 1006 B10R1.1 Cc1ccc(cn1)CN[13CH3] 34a_100000740942_200025704644 [1,1,0,0,0,0|2,0,0]=4 1007 B10R1.1 Cc1ccc(cn1)CO[13CH3] 34a_100011248133_200025704644 [1,1,0,0,0,0|1,0,0]=3 1008 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_100016987292_200025704644 [1,1,0,0,0,0|1,1,0]=4 1009 B10R1.1 Cc1ccc(cn1)CS[13CH3] 62a_200025704644_100016987292 [1,1,0,0,0,0|1,1,0]=4 1010 B10R1.1 Cc1ccc(cn1)OCF 34a_100000745506_100015361967 [1,1,0,0,0,0|2,0,0]=4 1011 B10R1.1 Cc1ccc(cn1)OCF 7a_100000745506_100015361967 [1,1,0,0,0,0|2,0,0]=4 1012 B10R1.1 Cc1ccc(cn1)SCF 62a_100000751577_100015361967 [1,1,0,0,0,0|2,0,0]=4 1013 B10R1.1 Cc1ccc(cn1)SCF 62a_100015361967_100000751577 [1,1,0,0,0,0|2,0,0]=4 1014 B10R1.1 Cc1cnc(cn1)CO[13CH3] 34a_100011273949_200025704644 [1,1,0,0,0,0|2,0,0]=4 1015 B10R1.1 Cc1ncc(cn1)CO[13CH3] 34a_100011746891_200025704644 [1,1,0,0,0,0|0,0,0]=2 1016 B10R1.1 Cc1ncc(cn1)OCF 34a_100000062939_100015361967 [1,1,0,0,0,0|1,0,0]=3 1017 B10R1.1 Cc1ncc(cn1)OCF 7a_100000062939_100015361967 [1,1,0,0,0,0|1,0,0]=3 1018 B10R1.1 Cc1ncc(cn1)SCF 62a_100000686985_100015361967 [1,1,0,0,0,0|1,0,0]=3 1019 B10R1.1 Cc1ncc(cn1)SCF 62a_100015361967_100000686985 [1,1,0,0,0,0|1,0,0]=3 1020 B10R1.1 FCOc1cnc(nc1)Br 34a_100000730009_100015361967 [1,1,0,0,0,0|2,0,0]=4 1021 B10R1.1 FCOc1cnc(nc1)Br 7a_100000730009_100015361967 [1,1,0,0,0,0|2,0,0]=4 1022 B10R1.1 FCOc1cnc(nc1)Cl 34a_100000092845_100015361967 [1,1,0,0,0,0|2,0,0]=4 1023 B10R1.1 FCOc1cnc(nc1)Cl 7a_100000092845_100015361967 [1,1,0,0,0,0|2,0,0]=4 1024 B10R1.1 FCOc1cnc(nc1)F 34a_200009874573_100015361967 [1,1,0,0,0,0|2,0,0]=4 1025 B10R1.1 FCOc1cnc(nc1)F 7a_200009874573_100015361967 [1,1,0,0,0,0|2,0,0]=4 1026 B10R1.1 FCSc1cnc(nc1)Br 62a_100015361967_200012349914 [1,1,0,0,0,0|2,0,0]=4 1027 B10R1.1 FCSc1cnc(nc1)Br 62a_200012349914_100015361967 [1,1,0,0,0,0|2,0,0]=4 1028 B10R1.1 FCSc1cnc(nc1)Cl 62a_100000059775_100015361967 [1,1,0,0,0,0|2,0,0]=4 1029 B10R1.1 FCSc1cnc(nc1)Cl 62a_100015361967_100000059775 [1,1,0,0,0,0|2,0,0]=4 1030 B10R1.1 FCSc1cnc(nc1)F 62a_100000685262_100015361967 [1,1,0,0,0,0|2,0,0]=4 1031 B10R1.1 FCSc1cnc(nc1)F 62a_100015361967_100000685262 [1,1,0,0,0,0|2,0,0]=4 1032 B10R1.1 Nc1ncc(cn1)OCF 34a_100000087137_100015361967 [1,1,0,0,0,0|2,0,0]=4 1033 B10R1.1 Nc1ncc(cn1)OCF 7a_100000087137_100015361967 [1,1,0,0,0,0|2,0,0]=4 1034 B10R1.1 Nc1ncc(cn1)SCF 62a_100000766020_100015361967 [1,1,0,0,0,0|2,0,0]=4 1035 B10R1.1 Nc1ncc(cn1)SCF 62a_100015361967_100000766020 [1,1,0,0,0,0|2,0,0]=4 1036 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [1,1,0,0,0,0|2,0,0]=4 1037 B10R1.1 [13CH3]OCc1ccc(nc1)Br 34a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 1038 B10R1.1 [13CH3]OCc1ccc(nc1)Br 7a_100009816760_200025704644 [1,1,0,0,0,0|2,0,0]=4 1039 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 34a_100000755211_200025704644 [1,1,0,0,0,0|2,0,0]=4 1040 B10R1.1 [13CH3]OCc1ccc(nc1)Cl 7a_100000755211_200025704644 [1,1,0,0,0,0|2,0,0]=4 1041 B10R1.1 [13CH3]OCc1ccc(nc1)F 34a_100000079959_200025704644 [1,1,0,0,0,0|2,0,0]=4 1042 B10R1.1 [13CH3]OCc1ccc(nc1)N 34a_100000704267_200025704644 [1,1,0,0,0,0|2,0,0]=4 1043 B10R1.1 [13CH3]OCc1cnc(nc1)Cl 34a_100009855073_200025704644 [1,1,0,0,0,0|1,0,0]=3 1044 B10R1.1 [13CH3]OCc1cnc(nc1)Cl 7a_100009855073_200025704644 [1,1,0,0,0,0|1,0,0]=3 1045 B10R1.3 C=Cc1ccc(cn1)CO 271570a_100011290941_100009816760 [1,1,0,0,0,0|1,0,1]=4 1046 B10R1.3 C=Cc1cnc(nc1)CN 271570a_100011290941_200016993442 [1,1,0,0,0,0|1,0,1]=4 1047 B10R1.3 C=Cc1cnc(nc1)CO 271570a_100011290941_100009867226 [1,1,0,0,0,0|1,0,1]=4 1048 B10R1.3 C=Cc1cnc(nc1)NC 271570a_100011290941_100000697329 [1,1,0,0,0,0|1,0,1]=4 1049 B10R1.3 C=Cc1cnc(nc1)NC 27a_100102657272_200000143982 [1,1,0,0,0,0|1,0,1]=4 1050 B10R1.3 C=Cc1cnc(nc1)OC 271570a_100011290941_100000686852 [1,1,0,0,0,0|1,0,1]=4 1051 B10R1.3 C=Cc1cnc(nc1)SC 271570a_100011290941_100000722549 [1,1,0,0,0,0|1,0,1]=4 1052 B10R1.3 C=Cc1cnc(nc1)SC 62a_200000143982_200000210301 [1,1,0,0,0,0|1,0,1]=4 1053 B10R1.3 C=Cc1cnc(nc1)SC 62a_200000210301_200000143982 [1,1,0,0,0,0|1,0,1]=4 1054 B10R1.3 C=Cc1cnc(nc1)S[13CH3] 62a_200000143982_200025704644 [1,1,0,0,0,0|1,0,1]=4 1055 B10R1.3 C=Cc1cnc(nc1)S[13CH3] 62a_200025704644_200000143982 [1,1,0,0,0,0|1,0,1]=4 1056 B10R1.3 C=Cc1ncc(cn1)CC 271570a_100011290941_100000033099 [1,1,0,0,0,0|1,0,1]=4 1057 B10R1.3 C=Cc1ncc(cn1)CO 271570a_100011290941_100009855073 [1,1,0,0,0,0|0,0,1]=3 1058 B10R1.3 CCc1ccc(nc1)SC 62a_100009843584_200000210301 [1,1,0,0,0,0|2,0,0]=4 1059 B10R1.3 CCc1ccc(nc1)SC 62a_200000210301_100009843584 [1,1,0,0,0,0|2,0,0]=4 1060 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_100009843584_200025704644 [1,1,0,0,0,0|2,0,0]=4 1061 B10R1.3 CCc1ccc(nc1)S[13CH3] 62a_200025704644_100009843584 [1,1,0,0,0,0|2,0,0]=4 1062 B10R1.3 CCc1cnc(nc1)NC 27a_100102657272_100000033099 [1,1,0,0,0,0|1,0,0]=3 1063 B10R1.3 CCc1cnc(nc1)SC 62a_100000033099_200000210301 [1,1,0,0,0,0|1,0,0]=3 1064 B10R1.3 CCc1cnc(nc1)SC 62a_200000210301_100000033099 [1,1,0,0,0,0|1,0,0]=3 1065 B10R1.3 CCc1cnc(nc1)S[13CH3] 62a_100000033099_200025704644 [1,1,0,0,0,0|1,0,0]=3 1066 B10R1.3 CCc1cnc(nc1)S[13CH3] 62a_200025704644_100000033099 [1,1,0,0,0,0|1,0,0]=3 1067 B10R1.3 CNc1ccc(cc1)CO 2230a_100011215238_200000210301 [1,1,0,0,0,0|2,0,0]=4 1068 B10R1.3 CNc1ccc(cc1)CO 34a_100011215238_200000210301 [1,1,0,0,0,0|2,0,0]=4 1069 B10R1.3 CNc1cnc(cn1)CO 27a_100102657272_100012002382 [1,1,0,0,0,0|2,0,0]=4 1070 B10R1.3 CNc1ncc(cn1)C#N 27a_100102657272_100000099682 [1,1,0,0,0,0|1,0,1]=4 1071 B10R1.3 CNc1ncc(cn1)C=O 27a_100102657272_100000070856 [1,1,0,0,0,0|0,0,2]=4 1072 B10R1.3 CNc1ncc(cn1)CO 27a_100102657272_100009855073 [1,1,0,0,0,0|0,0,0]=2 1073 B10R1.3 CNc1ncc(cn1)OC 27a_100102657272_100000069167 [1,1,0,0,0,0|2,0,0]=4 1074 B10R1.3 CNc1ncc(cn1)SC 27a_100102657272_100000718988 [1,1,0,0,0,0|2,0,0]=4 1075 B10R1.3 CNc1ncc(cn1)SC 62a_100000697329_200000210301 [1,1,0,0,0,0|2,0,0]=4 1076 B10R1.3 CNc1ncc(cn1)SC 62a_200000210301_100000697329 [1,1,0,0,0,0|2,0,0]=4 1077 B10R1.3 CNc1ncc(cn1)S[13CH3] 62a_100000697329_200025704644 [1,1,0,0,0,0|2,0,0]=4 1078 B10R1.3 CNc1ncc(cn1)S[13CH3] 62a_200025704644_100000697329 [1,1,0,0,0,0|2,0,0]=4 1079 B10R1.3 COc1ccc(cc1)CO 34a_100000211755_200000210301 [1,1,0,0,0,0|2,0,0]=4 1080 B10R1.3 COc1ccc(cn1)CN 34a_100000757128_200000210301 [1,1,0,0,0,0|2,0,0]=4 1081 B10R1.3 COc1cnc(nc1)OC 34a_100000099601_200000210301 [1,1,0,0,0,0|2,0,0]=4 1082 B10R1.3 COc1cnc(nc1)OC 7a_100000099601_200000210301 [1,1,0,0,0,0|2,0,0]=4 1083 B10R1.3 COc1cnc(nc1)SC 34a_100000075549_200000210301 [1,1,0,0,0,0|2,0,0]=4 1084 B10R1.3 COc1cnc(nc1)SC 62a_100000069167_200000210301 [1,1,0,0,0,0|2,0,0]=4 1085 B10R1.3 COc1cnc(nc1)SC 62a_200000210301_100000069167 [1,1,0,0,0,0|2,0,0]=4 1086 B10R1.3 COc1cnc(nc1)SC 7a_100000075549_200000210301 [1,1,0,0,0,0|2,0,0]=4 1087 B10R1.3 COc1cnc(nc1)S[13CH3] 62a_100000069167_200025704644 [1,1,0,0,0,0|2,0,0]=4 1088 B10R1.3 COc1cnc(nc1)S[13CH3] 62a_200025704644_100000069167 [1,1,0,0,0,0|2,0,0]=4 1089 B10R1.3 COc1ncc(cn1)O[13CH3] 34a_100000099601_200025704644 [1,1,0,0,0,0|2,0,0]=4 1090 B10R1.3 COc1ncc(cn1)O[13CH3] 7a_100000099601_200025704644 [1,1,0,0,0,0|2,0,0]=4 1091 B10R1.3 COc1ncc(cn1)SC 62a_100000686852_200000210301 [1,1,0,0,0,0|2,0,0]=4 1092 B10R1.3 COc1ncc(cn1)SC 62a_200000210301_100000686852 [1,1,0,0,0,0|2,0,0]=4 1093 B10R1.3 COc1ncc(cn1)S[13CH3] 62a_100000686852_200025704644 [1,1,0,0,0,0|2,0,0]=4 1094 B10R1.3 COc1ncc(cn1)S[13CH3] 62a_200025704644_100000686852 [1,1,0,0,0,0|2,0,0]=4 1095 B10R1.3 CSc1ccc(cc1)CO 62a_100000690907_200000210301 [1,1,0,0,0,0|2,0,0]=4 1096 B10R1.3 CSc1ccc(cc1)CO 62a_200000210301_100000690907 [1,1,0,0,0,0|2,0,0]=4 1097 B10R1.3 CSc1ccc(cn1)CN 62a_100000735879_200000210301 [1,1,0,0,0,0|2,0,0]=4 1098 B10R1.3 CSc1ccc(cn1)CN 62a_200000210301_100000735879 [1,1,0,0,0,0|2,0,0]=4 1099 B10R1.3 CSc1ccc(cn1)CO 62a_100009816760_200000210301 [1,1,0,0,0,0|1,0,0]=3 1100 B10R1.3 CSc1ccc(cn1)CO 62a_200000210301_100009816760 [1,1,0,0,0,0|1,0,0]=3 1101 B10R1.3 CSc1cnc(cn1)CO 62a_100012002382_200000210301 [1,1,0,0,0,0|2,0,0]=4 1102 B10R1.3 CSc1cnc(cn1)CO 62a_200000210301_100012002382 [1,1,0,0,0,0|2,0,0]=4 1103 B10R1.3 CSc1cnc(nc1)CN 62a_200000210301_200016993442 [1,1,0,0,0,0|2,0,0]=4 1104 B10R1.3 CSc1cnc(nc1)CN 62a_200016993442_200000210301 [1,1,0,0,0,0|2,0,0]=4 1105 B10R1.3 CSc1cnc(nc1)CO 62a_100009867226_200000210301 [1,1,0,0,0,0|2,0,0]=4 1106 B10R1.3 CSc1cnc(nc1)CO 62a_200000210301_100009867226 [1,1,0,0,0,0|2,0,0]=4 1107 B10R1.3 CSc1cnc(nc1)SC 62a_100000718988_200000210301 [1,1,0,0,0,0|2,0,0]=4 1108 B10R1.3 CSc1cnc(nc1)SC 62a_100000722549_200000210301 [1,1,0,0,0,0|2,0,0]=4 1109 B10R1.3 CSc1cnc(nc1)SC 62a_200000210301_100000718988 [1,1,0,0,0,0|2,0,0]=4 1110 B10R1.3 CSc1cnc(nc1)SC 62a_200000210301_100000722549 [1,1,0,0,0,0|2,0,0]=4 1111 B10R1.3 CSc1cnc(nc1)S[13CH3] 62a_100000718988_200025704644 [1,1,0,0,0,0|2,0,0]=4 1112 B10R1.3 CSc1cnc(nc1)S[13CH3] 62a_200025704644_100000718988 [1,1,0,0,0,0|2,0,0]=4 1113 B10R1.3 CSc1ncc(cn1)C#N 62a_200000210301_100000099682 [1,1,0,0,0,0|1,0,1]=4 1114 B10R1.3 CSc1ncc(cn1)C=O 62a_100000070856_200000210301 [1,1,0,0,0,0|0,0,2]=4 1115 B10R1.3 CSc1ncc(cn1)C=O 62a_200000210301_100000070856 [1,1,0,0,0,0|0,0,2]=4 1116 B10R1.3 CSc1ncc(cn1)CO 62a_100009855073_200000210301 [1,1,0,0,0,0|0,0,0]=2 1117 B10R1.3 CSc1ncc(cn1)CO 62a_200000210301_100009855073 [1,1,0,0,0,0|0,0,0]=2 1118 B10R1.3 CSc1ncc(cn1)O[13CH3] 34a_100000075549_200025704644 [1,1,0,0,0,0|2,0,0]=4 1119 B10R1.3 CSc1ncc(cn1)O[13CH3] 7a_100000075549_200025704644 [1,1,0,0,0,0|2,0,0]=4 1120 B10R1.3 CSc1ncc(cn1)S[13CH3] 62a_100000722549_200025704644 [1,1,0,0,0,0|2,0,0]=4 1121 B10R1.3 CSc1ncc(cn1)S[13CH3] 62a_200025704644_100000722549 [1,1,0,0,0,0|2,0,0]=4 1122 B10R1.3 [13CH3]Nc1ccc(cc1)CO 2230a_100011215238_200025704644 [1,1,0,0,0,0|2,0,0]=4 1123 B10R1.3 [13CH3]Nc1ccc(cc1)CO 34a_100011215238_200025704644 [1,1,0,0,0,0|2,0,0]=4 1124 B10R1.3 [13CH3]Oc1ccc(cc1)CO 34a_100000211755_200025704644 [1,1,0,0,0,0|2,0,0]=4 1125 B10R1.3 [13CH3]Oc1ccc(cn1)CN 34a_100000757128_200025704644 [1,1,0,0,0,0|2,0,0]=4 1126 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_100000690907_200025704644 [1,1,0,0,0,0|2,0,0]=4 1127 B10R1.3 [13CH3]Sc1ccc(cc1)CO 62a_200025704644_100000690907 [1,1,0,0,0,0|2,0,0]=4 1128 B10R1.3 [13CH3]Sc1ccc(cn1)CN 62a_100000735879_200025704644 [1,1,0,0,0,0|2,0,0]=4 1129 B10R1.3 [13CH3]Sc1ccc(cn1)CN 62a_200025704644_100000735879 [1,1,0,0,0,0|2,0,0]=4 1130 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_100009816760_200025704644 [1,1,0,0,0,0|1,0,0]=3 1131 B10R1.3 [13CH3]Sc1ccc(cn1)CO 62a_200025704644_100009816760 [1,1,0,0,0,0|1,0,0]=3 1132 B10R1.3 [13CH3]Sc1cnc(cn1)CO 62a_100012002382_200025704644 [1,1,0,0,0,0|2,0,0]=4 1133 B10R1.3 [13CH3]Sc1cnc(cn1)CO 62a_200025704644_100012002382 [1,1,0,0,0,0|2,0,0]=4 1134 B10R1.3 [13CH3]Sc1cnc(nc1)CN 62a_200016993442_200025704644 [1,1,0,0,0,0|2,0,0]=4 1135 B10R1.3 [13CH3]Sc1cnc(nc1)CN 62a_200025704644_200016993442 [1,1,0,0,0,0|2,0,0]=4 1136 B10R1.3 [13CH3]Sc1cnc(nc1)CO 62a_100009867226_200025704644 [1,1,0,0,0,0|2,0,0]=4 1137 B10R1.3 [13CH3]Sc1cnc(nc1)CO 62a_200025704644_100009867226 [1,1,0,0,0,0|2,0,0]=4 1138 B10R1.3 [13CH3]Sc1ncc(cn1)C#N 62a_200025704644_100000099682 [1,1,0,0,0,0|1,0,1]=4 1139 B10R1.3 [13CH3]Sc1ncc(cn1)C=O 62a_100000070856_200025704644 [1,1,0,0,0,0|0,0,2]=4 1140 B10R1.3 [13CH3]Sc1ncc(cn1)C=O 62a_200025704644_100000070856 [1,1,0,0,0,0|0,0,2]=4 1141 B10R1.3 [13CH3]Sc1ncc(cn1)CO 62a_100009855073_200025704644 [1,1,0,0,0,0|0,0,0]=2 1142 B10R1.3 [13CH3]Sc1ncc(cn1)CO 62a_200025704644_100009855073 [1,1,0,0,0,0|0,0,0]=2 1143 B10R1.13 C=C(C)c1cnc(nc1)C 271570a_100000694244_100000686985 [1,1,0,0,0,0|1,0,1]=4 1144 B10R1.13 CC(C)c1cnc(nc1)O 271570a_203496583355_100000102307 [1,1,0,0,0,0|2,0,0]=4 1145 B10R1.13 CC(O)c1ccc(nc1)O 271570a_203496583355_200010274204 [1,1,0,0,0,0|2,0,0]=4 1146 B10R1.176 Cc1cc(cnc1O)CO 271570a_203496583355_200000092119 [1,1,0,0,0,0|2,0,0]=4 1147 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [1,1,0,0,0,0|2,0,0]=4 1148 B10R1.176 Nc1ncc(cc1O)CO 271570a_203496583355_100012343677 [1,1,0,0,0,0|2,0,0]=4 1149 B10R1.176 OCc1cnc(c(c1)F)O 271570a_203496583355_100010065243 [1,1,0,0,0,0|2,0,0]=4 1150 B10R1.176 OCc1cnc(c(c1)O)Cl 271570a_203496583355_200015217190 [1,1,0,0,0,0|2,0,0]=4 1151 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [1,1,0,0,0,0|2,0,0]=4 1152 B10R1.2 Nc1c(cncc1CO)O 271570a_203496583355_200010988789 [1,1,0,0,0,0|1,0,0]=3 1153 B10R1.4 C=C=Cc1cncnc1N 271570a_100015277604_100011996079 [1,1,0,0,0,0|1,0,1]=4 1154 B10R1.4 CC=Cc1cncnc1N 271570a_100016259895_100011996079 [1,1,0,0,0,0|1,0,1]=4 1155 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [1,1,0,0,0,0|2,0,0]=4 1156 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [1,1,0,0,0,0|2,0,0]=4 1157 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [1,1,0,0,0,0|2,0,0]=4 1158 B10R1.4 CCOc1cncnc1N 7a_100000112926_100000210202 [1,1,0,0,0,0|1,0,0]=3 1159 B10R1.4 CCSc1cccnc1N 62a_100000045569_100000210202 [1,1,0,0,0,0|2,0,0]=4 1160 B10R1.4 CCSc1cccnc1N 62a_100000210202_100000045569 [1,1,0,0,0,0|2,0,0]=4 1161 B10R1.4 CCSc1cnccc1N 62a_100000047001_100000210202 [1,1,0,0,0,0|2,0,0]=4 1162 B10R1.4 CCSc1cnccc1N 62a_100000210202_100000047001 [1,1,0,0,0,0|2,0,0]=4 1163 B10R1.4 CCSc1cncnc1Br 62a_100000210202_200012461658 [1,1,0,0,0,0|2,0,0]=4 1164 B10R1.4 CCSc1cncnc1Br 62a_200012461658_100000210202 [1,1,0,0,0,0|2,0,0]=4 1165 B10R1.4 CCSc1cncnc1C 62a_100000210202_100009819671 [1,1,0,0,0,0|2,0,0]=4 1166 B10R1.4 CCSc1cncnc1C 62a_100009819671_100000210202 [1,1,0,0,0,0|2,0,0]=4 1167 B10R1.4 CCSc1cncnc1Cl 62a_100000210202_100000758962 [1,1,0,0,0,0|2,0,0]=4 1168 B10R1.4 CCSc1cncnc1Cl 62a_100000758962_100000210202 [1,1,0,0,0,0|2,0,0]=4 1169 B10R1.4 CCSc1cncnc1N 62a_100000210202_100011996079 [1,1,0,0,0,0|1,0,0]=3 1170 B10R1.4 CCSc1cncnc1N 62a_100011996079_100000210202 [1,1,0,0,0,0|1,0,0]=3 1171 B10R1.4 CCSc1cncnc1O 62a_100000210202_100000751107 [1,1,0,0,0,0|2,0,0]=4 1172 B10R1.4 CCSc1cncnc1O 62a_100000751107_100000210202 [1,1,0,0,0,0|2,0,0]=4 1173 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [1,1,0,0,0,0|2,0,0]=4 1174 B10R1.4 COCc1cccnc1Br 34a_100000719692_200000210301 [1,1,0,0,0,0|2,0,0]=4 1175 B10R1.4 COCc1cccnc1Br 34a_100138415774_100010140945 [1,1,0,0,0,0|2,0,0]=4 1176 B10R1.4 COCc1cccnc1Br 7a_100000719692_200000210301 [1,1,0,0,0,0|2,0,0]=4 1177 B10R1.4 COCc1cccnc1C 34a_100000729262_200000210301 [1,1,0,0,0,0|2,0,0]=4 1178 B10R1.4 COCc1cccnc1C 34a_100138415774_100000732876 [1,1,0,0,0,0|2,0,0]=4 1179 B10R1.4 COCc1cccnc1C 7a_100000729262_200000210301 [1,1,0,0,0,0|2,0,0]=4 1180 B10R1.4 COCc1cccnc1Cl 34a_100000748726_200000210301 [1,1,0,0,0,0|2,0,0]=4 1181 B10R1.4 COCc1cccnc1Cl 34a_100138415774_100000045678 [1,1,0,0,0,0|2,0,0]=4 1182 B10R1.4 COCc1cccnc1Cl 7a_100000748726_200000210301 [1,1,0,0,0,0|2,0,0]=4 1183 B10R1.4 COCc1cccnc1F 34a_100000079888_200000210301 [1,1,0,0,0,0|2,0,0]=4 1184 B10R1.4 COCc1cccnc1F 34a_100138415774_100000099810 [1,1,0,0,0,0|2,0,0]=4 1185 B10R1.4 COCc1cccnc1F 7a_100000079888_200000210301 [1,1,0,0,0,0|2,0,0]=4 1186 B10R1.4 COCc1cnccc1C 34a_100011996381_200000210301 [1,1,0,0,0,0|2,0,0]=4 1187 B10R1.4 COCc1cnccc1C 34a_100138415774_100000690890 [1,1,0,0,0,0|2,0,0]=4 1188 B10R1.4 COCc1cnccc1Cl 34a_100000117392_200000210301 [1,1,0,0,0,0|2,0,0]=4 1189 B10R1.4 Cc1ccncc1CO[13CH3] 34a_100011996381_200025704644 [1,1,0,0,0,0|2,0,0]=4 1190 B10R1.4 Cc1ncccc1CO[13CH3] 34a_100000729262_200025704644 [1,1,0,0,0,0|2,0,0]=4 1191 B10R1.4 Cc1ncccc1CO[13CH3] 7a_100000729262_200025704644 [1,1,0,0,0,0|2,0,0]=4 1192 B10R1.4 Cc1ncncc1SCF 62a_100009819671_100015361967 [1,1,0,0,0,0|2,0,0]=4 1193 B10R1.4 Cc1ncncc1SCF 62a_100015361967_100009819671 [1,1,0,0,0,0|2,0,0]=4 1194 B10R1.4 FCSc1cncnc1Br 62a_100015361967_200012461658 [1,1,0,0,0,0|2,0,0]=4 1195 B10R1.4 FCSc1cncnc1Br 62a_200012461658_100015361967 [1,1,0,0,0,0|2,0,0]=4 1196 B10R1.4 FCSc1cncnc1Cl 62a_100000758962_100015361967 [1,1,0,0,0,0|2,0,0]=4 1197 B10R1.4 FCSc1cncnc1Cl 62a_100015361967_100000758962 [1,1,0,0,0,0|2,0,0]=4 1198 B10R1.4 Nc1ccncc1OCF 34a_100000753702_100015361967 [1,1,0,0,0,0|2,0,0]=4 1199 B10R1.4 Nc1ccncc1SCF 62a_100000047001_100015361967 [1,1,0,0,0,0|2,0,0]=4 1200 B10R1.4 Nc1ccncc1SCF 62a_100015361967_100000047001 [1,1,0,0,0,0|2,0,0]=4 1201 B10R1.4 Nc1ncccc1OCF 34a_100000211975_100015361967 [1,1,0,0,0,0|2,0,0]=4 1202 B10R1.4 Nc1ncccc1OCF 7a_100000211975_100015361967 [1,1,0,0,0,0|2,0,0]=4 1203 B10R1.4 Nc1ncccc1SCF 62a_100000045569_100015361967 [1,1,0,0,0,0|2,0,0]=4 1204 B10R1.4 Nc1ncccc1SCF 62a_100015361967_100000045569 [1,1,0,0,0,0|2,0,0]=4 1205 B10R1.4 Nc1ncncc1OCF 7a_100000112926_100015361967 [1,1,0,0,0,0|1,0,0]=3 1206 B10R1.4 Nc1ncncc1SCF 62a_100011996079_100015361967 [1,1,0,0,0,0|1,0,0]=3 1207 B10R1.4 Nc1ncncc1SCF 62a_100015361967_100011996079 [1,1,0,0,0,0|1,0,0]=3 1208 B10R1.4 Oc1ncncc1SCF 62a_100000751107_100015361967 [1,1,0,0,0,0|2,0,0]=4 1209 B10R1.4 Oc1ncncc1SCF 62a_100015361967_100000751107 [1,1,0,0,0,0|2,0,0]=4 1210 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [1,1,0,0,0,0|2,0,0]=4 1211 B10R1.4 [13CH3]OCc1cccnc1Br 34a_100000719692_200025704644 [1,1,0,0,0,0|2,0,0]=4 1212 B10R1.4 [13CH3]OCc1cccnc1Br 7a_100000719692_200025704644 [1,1,0,0,0,0|2,0,0]=4 1213 B10R1.4 [13CH3]OCc1cccnc1Cl 34a_100000748726_200025704644 [1,1,0,0,0,0|2,0,0]=4 1214 B10R1.4 [13CH3]OCc1cccnc1Cl 7a_100000748726_200025704644 [1,1,0,0,0,0|2,0,0]=4 1215 B10R1.4 [13CH3]OCc1cccnc1F 34a_100000079888_200025704644 [1,1,0,0,0,0|2,0,0]=4 1216 B10R1.4 [13CH3]OCc1cccnc1F 7a_100000079888_200025704644 [1,1,0,0,0,0|2,0,0]=4 1217 B10R1.4 [13CH3]OCc1cnccc1Cl 34a_100000117392_200025704644 [1,1,0,0,0,0|2,0,0]=4 1218 B10R1.20 C=Cc1ccncc1CO 271570a_100011290941_100000117392 [1,1,0,0,0,0|2,0,0]=4 1219 B10R1.20 C=Cc1cncnc1NC 271570a_100011290941_200012180720 [1,1,0,0,0,0|1,0,1]=4 1220 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [1,1,0,0,0,0|2,0,0]=4 1221 B10R1.20 C=Cc1ncncc1CC 271570a_100011290941_200000100055 [1,1,0,0,0,0|2,0,0]=4 1222 B10R1.20 CCc1cncnc1NC 27a_100102657272_200000100055 [1,1,0,0,0,0|1,0,0]=3 1223 B10R1.20 CCc1cncnc1SC 62a_200000100055_200000210301 [1,1,0,0,0,0|2,0,0]=4 1224 B10R1.20 CCc1cncnc1SC 62a_200000210301_200000100055 [1,1,0,0,0,0|2,0,0]=4 1225 B10R1.20 CCc1cncnc1S[13CH3] 62a_200000100055_200025704644 [1,1,0,0,0,0|2,0,0]=4 1226 B10R1.20 CCc1cncnc1S[13CH3] 62a_200025704644_200000100055 [1,1,0,0,0,0|2,0,0]=4 1227 B10R1.20 CNc1ccccc1CO 34a_100000212039_200000210301 [1,1,0,0,0,0|2,0,0]=4 1228 B10R1.20 CNc1ccncc1CO 27a_100102657272_100000117392 [1,1,0,0,0,0|1,0,0]=3 1229 B10R1.20 CNc1ncncc1C#N 27a_100102657272_100000687955 [1,1,0,0,0,0|1,0,1]=4 1230 B10R1.20 CNc1ncncc1OC 27a_100102657272_100012001275 [1,1,0,0,0,0|2,0,0]=4 1231 B10R1.20 CNc1ncncc1SC 62a_200000210301_200012180720 [1,1,0,0,0,0|2,0,0]=4 1232 B10R1.20 CNc1ncncc1SC 62a_200012180720_200000210301 [1,1,0,0,0,0|2,0,0]=4 1233 B10R1.20 CNc1ncncc1S[13CH3] 62a_200012180720_200025704644 [1,1,0,0,0,0|2,0,0]=4 1234 B10R1.20 CNc1ncncc1S[13CH3] 62a_200025704644_200012180720 [1,1,0,0,0,0|2,0,0]=4 1235 B10R1.20 CSc1ccncc1CO 62a_100000117392_200000210301 [1,1,0,0,0,0|2,0,0]=4 1236 B10R1.20 CSc1ccncc1CO 62a_200000210301_100000117392 [1,1,0,0,0,0|2,0,0]=4 1237 B10R1.20 CSc1ncccc1CO 62a_100000748726_200000210301 [1,1,0,0,0,0|2,0,0]=4 1238 B10R1.20 CSc1ncccc1CO 62a_200000210301_100000748726 [1,1,0,0,0,0|2,0,0]=4 1239 B10R1.20 [13CH3]Nc1ccccc1CO 34a_100000212039_200025704644 [1,1,0,0,0,0|2,0,0]=4 1240 B10R1.20 [13CH3]Sc1ccncc1CO 62a_100000117392_200025704644 [1,1,0,0,0,0|2,0,0]=4 1241 B10R1.20 [13CH3]Sc1ccncc1CO 62a_200025704644_100000117392 [1,1,0,0,0,0|2,0,0]=4 1242 B10R1.20 [13CH3]Sc1ncccc1CO 62a_100000748726_200025704644 [1,1,0,0,0,0|2,0,0]=4 1243 B10R1.20 [13CH3]Sc1ncccc1CO 62a_200025704644_100000748726 [1,1,0,0,0,0|2,0,0]=4 1244 B10R1.30 Cc1cnc(c(c1)CO)O 271570a_203496583355_100000118064 [1,1,0,0,0,0|2,0,0]=4 1245 B10R1.30 Cc1ncc(cc1CO)O 271570a_203496583355_100010894652 [1,1,0,0,0,0|2,0,0]=4 1246 B10R1.30 Nc1ccc(cc1CO)O 271570a_203496583355_100012353972 [1,1,0,0,0,0|2,0,0]=4 1247 B10R1.30 Nc1ncc(cc1CO)O 271570a_203496583355_100011934449 [1,1,0,0,0,0|1,0,0]=3 1248 B10R1.30 Nc1ncc(nc1CO)O 271570a_203496583355_100010174834 [1,1,0,0,0,0|2,0,0]=4 1249 B10R1.30 OCc1cc(cnc1F)O 271570a_203496583355_100010202234 [1,1,0,0,0,0|2,0,0]=4 1250 B10R1.30 OCc1cc(cnc1O)F 271570a_203496583355_100000079972 [1,1,0,0,0,0|2,0,0]=4 1251 B10R1.30 OCc1cc(cnc1O)O 271570a_203496583355_100010065268 [1,1,0,0,0,0|2,0,0]=4 1252 B10R1.61 C=C(C)c1cncnc1N 271570a_100000694244_100011996079 [1,1,0,0,0,0|1,0,1]=4 1253 B10R1.61 CC(O)c1cccnc1O 271570a_203496583355_100009865335 [1,1,0,0,0,0|2,0,0]=4 1254 B10R1.245 C=Cc1c(ncnc1N)C 271570a_100011290941_100011996190 [1,1,0,0,0,0|1,0,1]=4 1255 B10R1.245 C=Cc1c(ncnc1N)N 271570a_100011290941_100010128106 [1,1,0,0,0,0|1,0,1]=4 1256 B10R1.245 COc1c(ncnc1Cl)N 34a_100000124137_200000210301 [1,1,0,0,0,0|2,0,0]=4 1257 B10R1.245 COc1c(ncnc1Cl)N 7a_100000124137_200000210301 [1,1,0,0,0,0|2,0,0]=4 1258 B10R1.245 COc1c(ncnc1O)N 271570a_203496583355_100011998528 [1,1,0,0,0,0|2,0,0]=4 1259 B10R1.245 CSc1c(ncnc1Cl)N 62a_100010371481_200000210301 [1,1,0,0,0,0|2,0,0]=4 1260 B10R1.245 CSc1c(ncnc1Cl)N 62a_200000210301_100010371481 [1,1,0,0,0,0|2,0,0]=4 1261 B10R1.245 CSc1c(ncnc1N)C 62a_100011996190_200000210301 [1,1,0,0,0,0|2,0,0]=4 1262 B10R1.245 CSc1c(ncnc1N)C 62a_200000210301_100011996190 [1,1,0,0,0,0|2,0,0]=4 1263 B10R1.245 CSc1c(ncnc1N)N 62a_100010128106_200000210301 [1,1,0,0,0,0|2,0,0]=4 1264 B10R1.245 CSc1c(ncnc1N)N 62a_200000210301_100010128106 [1,1,0,0,0,0|2,0,0]=4 1265 B10R1.245 Cc1ncnc(c1S[13CH3])N 62a_100011996190_200025704644 [1,1,0,0,0,0|2,0,0]=4 1266 B10R1.245 Cc1ncnc(c1S[13CH3])N 62a_200025704644_100011996190 [1,1,0,0,0,0|2,0,0]=4 1267 B10R1.245 N#Cc1c(ncnc1O)N 271570a_203496583355_100000086035 [1,1,0,0,0,0|1,0,1]=4 1268 B10R1.245 Nc1cccc(c1CO)O 271570a_203496583355_100000747656 [1,1,0,0,0,0|2,0,0]=4 1269 B10R1.245 Nc1ncnc(c1C=O)O 271570a_203496583355_100000765549 [1,1,0,0,0,0|0,0,2]=4 1270 B10R1.245 OCc1c(ccnc1Cl)O 271570a_203496583355_100000047008 [1,1,0,0,0,0|2,0,0]=4 1271 B10R1.245 OCc1c(ccnc1F)O 271570a_203496583355_100000050056 [1,1,0,0,0,0|2,0,0]=4 1272 B10R1.245 [13CH3]Oc1c(ncnc1Cl)N 34a_100000124137_200025704644 [1,1,0,0,0,0|2,0,0]=4 1273 B10R1.245 [13CH3]Oc1c(ncnc1Cl)N 7a_100000124137_200025704644 [1,1,0,0,0,0|2,0,0]=4 1274 B10R1.245 [13CH3]Sc1c(ncnc1Cl)N 62a_100010371481_200025704644 [1,1,0,0,0,0|2,0,0]=4 1275 B10R1.245 [13CH3]Sc1c(ncnc1Cl)N 62a_200025704644_100010371481 [1,1,0,0,0,0|2,0,0]=4 1276 B10R1.245 [13CH3]Sc1c(ncnc1N)N 62a_100010128106_200025704644 [1,1,0,0,0,0|2,0,0]=4 1277 B10R1.245 [13CH3]Sc1c(ncnc1N)N 62a_200025704644_100010128106 [1,1,0,0,0,0|2,0,0]=4 1278 B10R1.22 Cc1cc(c(c(c1)F)O)N 271570a_203496583355_100021129147 [1,1,0,0,0,0|2,0,0]=4 1279 B10R1.22 Cc1cc(c(c(c1)O)C)N 271570a_203496583355_102495365385 [1,1,0,0,0,0|2,0,0]=4 1280 B10R1.22 Cc1cc(c(c(n1)C)O)N 271570a_203496583355_100010261885 [1,1,0,0,0,0|1,0,0]=3 1281 B10R1.22 Cc1nc(c(c(n1)Cl)O)C 271570a_203496583355_200011356833 [1,1,0,0,0,0|1,0,0]=3 1282 B10R1.22 Cc1nc(c(c(n1)O)C)N 271570a_203496583355_200000700166 [1,1,0,0,0,0|0,0,0]=2 1283 B10R1.22 Cc1nc(c(c(n1)O)F)N 271570a_203496583355_100000117604 [1,1,0,0,0,0|1,0,0]=3 1284 B10R1.22 Cc1nc(c(c(n1)O)N)N 271570a_203496583355_100009882007 [1,1,0,0,0,0|1,0,0]=3 1285 B10R1.22 Cc1nc(nc(c1C)O)N 271570a_203496583355_100000076065 [1,1,0,0,0,0|2,0,0]=4 1286 B10R1.22 Cc1nc(nc(c1N)N)O 271570a_203496583355_100011218874 [1,1,0,0,0,0|2,0,0]=4 1287 B10R1.22 Cc1nc(nc(c1O)C)N 271570a_203496583355_100009814254 [1,1,0,0,0,0|2,0,0]=4 1288 B10R1.22 Cc1nc(nc(c1O)O)N 271570a_203496583355_200000008613 [1,1,0,0,0,0|2,0,0]=4 1289 B10R1.22 Nc1nc(c(c(n1)O)N)N 271570a_203496583355_100000102768 [1,1,0,0,0,0|2,0,0]=4 1290 B10R1.118 Cc1cc(c(cc1C)O)N 271570a_203496583355_100012337760 [1,1,0,0,0,0|2,0,0]=4 1291 B10R1.118 Cc1cc(c(cc1F)O)N 271570a_203496583355_100010233353 [1,1,0,0,0,0|2,0,0]=4 1292 B10R1.118 Cc1cc(c(cc1N)C)O 271570a_203496583355_100011934712 [1,1,0,0,0,0|2,0,0]=4 1293 B10R1.118 Cc1cc(c(cc1O)O)N 271570a_203496583355_200010107346 [1,1,0,0,0,0|2,0,0]=4 1294 B10R1.118 Cc1cc(c(nc1C)N)O 271570a_203496583355_100009990238 [1,1,0,0,0,0|1,0,0]=3 1295 B10R1.118 Cc1nc(c(cc1Br)O)N 271570a_203496583355_100000684678 [1,1,0,0,0,0|1,0,0]=3 1296 B10R1.118 Cc1nc(c(cc1O)N)N 271570a_203496583355_100000688597 [1,1,0,0,0,0|2,0,0]=4 1297 B10R1.118 Cc1nc(c(nc1C)O)N 271570a_203496583355_100012282008 [1,1,0,0,0,0|2,0,0]=4 1298 B10R1.118 Nc1nc(c(cc1O)Br)Cl 271570a_203496583355_100010270345 [1,1,0,0,0,0|2,0,0]=4 1299 B10R1.118 Nc1nc(c(cc1O)Br)F 271570a_203496583355_100135215189 [1,1,0,0,0,0|2,0,0]=4 1300 B10R1.119 Cc1cnc(c(c1N)N)O 271570a_203496583355_200000097298 [1,1,0,0,0,0|2,0,0]=4 1301 B10R1.32 C=Cc1sc(nc1CO)C 271570a_100011290941_100011103066 [0,1,0,0,1,0|2,0,0]=4 1302 B10R1.32 CSc1sc(nc1CO)C 62a_100011103066_200000210301 [0,1,0,0,1,0|2,0,0]=4 1303 B10R1.32 CSc1sc(nc1CO)C 62a_200000210301_100011103066 [0,1,0,0,1,0|2,0,0]=4 1304 B10R1.32 Cc1nc(c(s1)S[13CH3])CO 62a_100011103066_200025704644 [0,1,0,0,1,0|2,0,0]=4 1305 B10R1.32 Cc1nc(c(s1)S[13CH3])CO 62a_200025704644_100011103066 [0,1,0,0,1,0|2,0,0]=4 1306 B10R1.35 CSc1nc(c(s1)C)CO 62a_100010127906_200000210301 [0,1,0,0,1,0|2,0,0]=4 1307 B10R1.35 CSc1nc(c(s1)C)CO 62a_200000210301_100010127906 [0,1,0,0,1,0|2,0,0]=4 1308 B10R1.35 CSc1nc(c(s1)CO)C 62a_100010264302_200000210301 [0,1,0,0,1,0|2,0,0]=4 1309 B10R1.35 CSc1nc(c(s1)CO)C 62a_200000210301_100010264302 [0,1,0,0,1,0|2,0,0]=4 1310 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_100010264302_200025704644 [0,1,0,0,1,0|2,0,0]=4 1311 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_200025704644_100010264302 [0,1,0,0,1,0|2,0,0]=4 1312 B10R1.35 Cc1sc(nc1CO)S[13CH3] 62a_100010127906_200025704644 [0,1,0,0,1,0|2,0,0]=4 1313 B10R1.35 Cc1sc(nc1CO)S[13CH3] 62a_200025704644_100010127906 [0,1,0,0,1,0|2,0,0]=4 1314 B10R1.130 CCSc1cn(nc1N)C 62a_100000210202_100010776223 [0,1,0,0,1,0|2,0,0]=4 1315 B10R1.130 CCSc1cn(nc1N)C 62a_100010776223_100000210202 [0,1,0,0,1,0|2,0,0]=4 1316 B10R1.130 COCc1cc(nn1C)C 34a_100000243219_200000210301 [0,1,0,0,1,0|2,0,0]=4 1317 B10R1.130 COCc1cc(nn1C)C 34a_100138415774_100025716357 [0,1,0,0,1,0|2,0,0]=4 1318 B10R1.130 COCc1cc(oc1C)C 34a_100000688432_200000210301 [0,1,0,0,1,0|2,0,0]=4 1319 B10R1.130 COCc1cc(oc1C)C 7a_100000688432_200000210301 [0,1,0,0,1,0|2,0,0]=4 1320 B10R1.130 COCc1cn(nc1C)C 34a_100138415774_100015186178 [0,1,0,0,1,0|2,0,0]=4 1321 B10R1.130 COCc1nc(oc1C)C 34a_100000068805_200000210301 [0,1,0,0,1,0|2,0,0]=4 1322 B10R1.130 COCc1nc(oc1C)C 7a_100000068805_200000210301 [0,1,0,0,1,0|2,0,0]=4 1323 B10R1.130 COCc1sc(nc1Br)C 34a_100138415774_100015664652 [0,1,0,0,1,0|2,0,0]=4 1324 B10R1.130 COCc1sc(nc1C)C 34a_100000750043_200000210301 [0,1,0,0,1,0|2,0,0]=4 1325 B10R1.130 COCc1sc(nc1C)C 34a_100138415774_100000760948 [0,1,0,0,1,0|2,0,0]=4 1326 B10R1.130 COCc1sc(nc1C)C 7a_100000750043_200000210301 [0,1,0,0,1,0|2,0,0]=4 1327 B10R1.130 COCn1nc(nc1N)O 271570a_203496583355_100021578300 [0,1,0,0,1,0|2,0,0]=4 1328 B10R1.130 Cc1cc(c(o1)C)CO[13CH3] 34a_100000688432_200025704644 [0,1,0,0,1,0|2,0,0]=4 1329 B10R1.130 Cc1cc(c(o1)C)CO[13CH3] 7a_100000688432_200025704644 [0,1,0,0,1,0|2,0,0]=4 1330 B10R1.130 Cc1cc(n(n1)C)CO[13CH3] 34a_100000243219_200025704644 [0,1,0,0,1,0|2,0,0]=4 1331 B10R1.130 Cc1nc(c(o1)C)CO[13CH3] 34a_100000068805_200025704644 [0,1,0,0,1,0|2,0,0]=4 1332 B10R1.130 Cc1nc(c(o1)C)CO[13CH3] 7a_100000068805_200025704644 [0,1,0,0,1,0|2,0,0]=4 1333 B10R1.130 Cc1nc(c(s1)CO[13CH3])C 34a_100000750043_200025704644 [0,1,0,0,1,0|2,0,0]=4 1334 B10R1.130 Cc1nc(c(s1)CO[13CH3])C 7a_100000750043_200025704644 [0,1,0,0,1,0|2,0,0]=4 1335 B10R1.130 Cn1cc(c(n1)N)SCF 62a_100010776223_100015361967 [0,1,0,0,1,0|2,0,0]=4 1336 B10R1.130 Cn1cc(c(n1)N)SCF 62a_100015361967_100010776223 [0,1,0,0,1,0|2,0,0]=4 1337 B10R1.94 CCSc1cnn(c1N)C 62a_100000210202_100020588448 [0,1,0,0,1,0|2,0,0]=4 1338 B10R1.94 CCSc1cnn(c1N)C 62a_100020588448_100000210202 [0,1,0,0,1,0|2,0,0]=4 1339 B10R1.94 COCc1cnn(c1Br)C 34a_100011063722_200000210301 [0,1,0,0,1,0|2,0,0]=4 1340 B10R1.94 COCc1cnn(c1C)C 34a_100011203417_200000210301 [0,1,0,0,1,0|2,0,0]=4 1341 B10R1.94 COCc1cnn(c1C)C 7a_100011203417_200000210301 [0,1,0,0,1,0|2,0,0]=4 1342 B10R1.94 Cc1c(cnn1C)CO[13CH3] 34a_100011203417_200025704644 [0,1,0,0,1,0|2,0,0]=4 1343 B10R1.94 Cc1c(cnn1C)CO[13CH3] 7a_100011203417_200025704644 [0,1,0,0,1,0|2,0,0]=4 1344 B10R1.94 Cn1ncc(c1Br)CO[13CH3] 34a_100011063722_200025704644 [0,1,0,0,1,0|2,0,0]=4 1345 B10R1.94 Cn1ncc(c1N)SCF 62a_100015361967_100020588448 [0,1,0,0,1,0|2,0,0]=4 1346 B10R1.94 Cn1ncc(c1N)SCF 62a_100020588448_100015361967 [0,1,0,0,1,0|2,0,0]=4 1347 B10R1.257 C=Cc1c(cnn1C)CO 271570a_100011290941_100011063722 [0,1,0,0,1,0|2,0,0]=4 1348 B10R1.257 C=Cc1c(n[nH]c1CO)C 271570a_100011290941_100015664438 [0,1,0,0,1,0|2,0,0]=4 1349 B10R1.257 CSc1c(cnn1C)CO 62a_100011063722_200000210301 [0,1,0,0,1,0|2,0,0]=4 1350 B10R1.257 CSc1c(cnn1C)CO 62a_200000210301_100011063722 [0,1,0,0,1,0|2,0,0]=4 1351 B10R1.257 CSc1c(n[nH]c1CO)C 62a_100015664438_200000210301 [0,1,0,0,1,0|2,0,0]=4 1352 B10R1.257 CSc1c(n[nH]c1CO)C 62a_200000210301_100015664438 [0,1,0,0,1,0|2,0,0]=4 1353 B10R1.257 Cc1n[nH]c(c1S[13CH3])CO 62a_100015664438_200025704644 [0,1,0,0,1,0|2,0,0]=4 1354 B10R1.257 Cc1n[nH]c(c1S[13CH3])CO 62a_200025704644_100015664438 [0,1,0,0,1,0|2,0,0]=4 1355 B10R1.257 Cn1ncc(c1S[13CH3])CO 62a_100011063722_200025704644 [0,1,0,0,1,0|2,0,0]=4 1356 B10R1.257 Cn1ncc(c1S[13CH3])CO 62a_200025704644_100011063722 [0,1,0,0,1,0|2,0,0]=4 1357 B12R1.46 C=C(C)c1nc(ccc1CO)C 271570a_100000694244_102495338573 [0,2,0,0,0,0|2,0,0]=4 1358 B12R1.46 C=C(C)c1nc(ncc1CC)C 271570a_100000694244_200000069817 [0,2,0,0,0,0|2,0,0]=4 1359 B12R1.46 CCc1cnc(cc1N(C)C)C 27a_100102631434_100010291839 [0,2,0,0,0,0|2,0,0]=4 1360 B12R1.46 CCc1cnc(nc1N(C)C)C 27a_100102631434_200000069817 [0,2,0,0,0,0|1,0,0]=3 1361 B12R1.46 Cc1ncc(c(n1)N(C)C)C#N 27a_100102631434_200012187075 [0,2,0,0,0,0|1,0,1]=4 1362 B12R1.78 C=Cc1cnc(nc1NN)SC 271570a_100011290941_200132310213 [0,2,0,0,0,0|1,0,1]=4 1363 B12R1.78 C=Cc1nc(ccc1CO)OC 271570a_100011290941_100009885603 [0,2,0,0,0,0|2,0,0]=4 1364 B12R1.78 C=Cc1nc(ncc1CO)SC 271570a_100011290941_100009869927 [0,2,0,0,0,0|1,0,0]=3 1365 B12R1.78 C=Cc1ncc(c(n1)OC)CO 271570a_100011290941_200011024631 [0,2,0,0,0,0|1,0,1]=4 1366 B12R1.78 CNc1cc(ccc1CO)OC 34a_100011998734_200000210301 [0,2,0,0,0,0|2,0,0]=4 1367 B12R1.78 CNc1nc(ncc1C#N)SC 27a_100102657272_100000076254 [0,2,0,0,0,0|1,0,1]=4 1368 B12R1.78 CNc1nc(ncc1CO)SC 27a_100102657272_100009869927 [0,2,0,0,0,0|0,0,0]=2 1369 B12R1.78 CNc1nc(ncc1OC)SC 27a_100102657272_100000075546 [0,2,0,0,0,0|2,0,0]=4 1370 B12R1.78 CNc1ncc(c(n1)OC)CO 27a_100102657272_200011024631 [0,2,0,0,0,0|1,0,0]=3 1371 B12R1.78 COc1cc(ncc1CO)SC 62a_100010714672_200000210301 [0,2,0,0,0,0|2,0,0]=4 1372 B12R1.78 COc1cc(ncc1CO)SC 62a_200000210301_100010714672 [0,2,0,0,0,0|2,0,0]=4 1373 B12R1.78 COc1cc(ncc1CO)S[13CH3] 62a_100010714672_200025704644 [0,2,0,0,0,0|2,0,0]=4 1374 B12R1.78 COc1cc(ncc1CO)S[13CH3] 62a_200025704644_100010714672 [0,2,0,0,0,0|2,0,0]=4 1375 B12R1.78 COc1ccc(c(c1)N[13CH3])CO 34a_100011998734_200025704644 [0,2,0,0,0,0|2,0,0]=4 1376 B12R1.78 COc1ccc(c(n1)SC)CO 62a_100009885603_200000210301 [0,2,0,0,0,0|2,0,0]=4 1377 B12R1.78 COc1ccc(c(n1)SC)CO 62a_200000210301_100009885603 [0,2,0,0,0,0|2,0,0]=4 1378 B12R1.78 COc1ccc(c(n1)S[13CH3])CO 62a_100009885603_200025704644 [0,2,0,0,0,0|2,0,0]=4 1379 B12R1.78 COc1ccc(c(n1)S[13CH3])CO 62a_200025704644_100009885603 [0,2,0,0,0,0|2,0,0]=4 1380 B12R1.78 COc1cnc(nc1NN)SC 62a_200000210301_100000120976 [0,2,0,0,0,0|2,0,0]=4 1381 B12R1.78 COc1cnc(nc1NN)S[13CH3] 62a_200025704644_100000120976 [0,2,0,0,0,0|2,0,0]=4 1382 B12R1.78 COc1nc(ccc1CO)SC 62a_100010988397_200000210301 [0,2,0,0,0,0|2,0,0]=4 1383 B12R1.78 COc1nc(ccc1CO)SC 62a_200000210301_100010988397 [0,2,0,0,0,0|2,0,0]=4 1384 B12R1.78 COc1nc(ccc1CO)S[13CH3] 62a_100010988397_200025704644 [0,2,0,0,0,0|2,0,0]=4 1385 B12R1.78 COc1nc(ccc1CO)S[13CH3] 62a_200025704644_100010988397 [0,2,0,0,0,0|2,0,0]=4 1386 B12R1.78 COc1nc(ncc1CO)SC 62a_200000210301_200011024631 [0,2,0,0,0,0|1,0,0]=3 1387 B12R1.78 COc1nc(ncc1CO)SC 62a_200011024631_200000210301 [0,2,0,0,0,0|1,0,0]=3 1388 B12R1.78 COc1nc(ncc1CO)S[13CH3] 62a_200011024631_200025704644 [0,2,0,0,0,0|1,0,0]=3 1389 B12R1.78 COc1nc(ncc1CO)S[13CH3] 62a_200025704644_200011024631 [0,2,0,0,0,0|1,0,0]=3 1390 B12R1.78 CSc1ncc(c(n1)NN)SC 62a_200000210301_200132310213 [0,2,0,0,0,0|2,0,0]=4 1391 B12R1.78 CSc1ncc(c(n1)NN)SC 62a_200132310213_200000210301 [0,2,0,0,0,0|2,0,0]=4 1392 B12R1.78 CSc1ncc(c(n1)NN)S[13CH3] 62a_200025704644_200132310213 [0,2,0,0,0,0|2,0,0]=4 1393 B12R1.78 CSc1ncc(c(n1)NN)S[13CH3] 62a_200132310213_200025704644 [0,2,0,0,0,0|2,0,0]=4 1394 B12R1.78 CSc1ncc(c(n1)SC)CO 62a_100009869927_200000210301 [0,2,0,0,0,0|1,0,0]=3 1395 B12R1.78 CSc1ncc(c(n1)SC)CO 62a_200000210301_100009869927 [0,2,0,0,0,0|1,0,0]=3 1396 B12R1.78 CSc1ncc(c(n1)S[13CH3])CO 62a_100009869927_200025704644 [0,2,0,0,0,0|1,0,0]=3 1397 B12R1.78 CSc1ncc(c(n1)S[13CH3])CO 62a_200025704644_100009869927 [0,2,0,0,0,0|1,0,0]=3 1398 B12R1.112 C=Cc1nc(ncc1CCC)C 271570a_100011290941_200000069602 [0,2,0,0,0,0|2,0,0]=4 1399 B12R1.112 CCCc1cnc(nc1NC)C 27a_100102657272_200000069602 [0,2,0,0,0,0|1,0,0]=3 1400 B12R1.112 CCCc1cnc(nc1SC)C 62a_200000069602_200000210301 [0,2,0,0,0,0|2,0,0]=4 1401 B12R1.112 CCCc1cnc(nc1SC)C 62a_200000210301_200000069602 [0,2,0,0,0,0|2,0,0]=4 1402 B12R1.112 CCCc1cnc(nc1S[13CH3])C 62a_200000069602_200025704644 [0,2,0,0,0,0|2,0,0]=4 1403 B12R1.112 CCCc1cnc(nc1S[13CH3])C 62a_200025704644_200000069602 [0,2,0,0,0,0|2,0,0]=4 1404 B12R1.112 COCc1cnc(nc1OC)Cl 34a_200011024631_200000210301 [0,2,0,0,0,0|2,0,0]=4 1405 B12R1.112 COc1nc(ncc1CO[13CH3])Cl 34a_200011024631_200025704644 [0,2,0,0,0,0|2,0,0]=4 1406 B12R1.268 C=C=Cc1nc(ccc1CO)C 271570a_100015277604_102495338573 [0,2,0,0,0,0|2,0,0]=4 1407 B12R1.268 C=C=Cc1nc(ncc1CC)C 271570a_100015277604_200000069817 [0,2,0,0,0,0|2,0,0]=4 1408 B12R1.268 CC=Cc1nc(ccc1CO)C 271570a_100016259895_102495338573 [0,2,0,0,0,0|2,0,0]=4 1409 B12R1.268 CC=Cc1nc(ncc1CC)C 271570a_100016259895_200000069817 [0,2,0,0,0,0|2,0,0]=4 1410 B12R1.268 CCNc1cc(ccc1CO)C 34a_100000087799_100000210202 [0,2,0,0,0,0|2,0,0]=4 1411 B12R1.268 CCNc1cc(ncc1CC)C 27a_100015525214_100010291839 [0,2,0,0,0,0|2,0,0]=4 1412 B12R1.268 CCNc1cc(ncc1CO)O 271570a_203496583355_100009950477 [0,2,0,0,0,0|2,0,0]=4 1413 B12R1.268 CCNc1nc(ncc1C#N)C 27a_100015525214_200012187075 [0,2,0,0,0,0|1,0,1]=4 1414 B12R1.268 CCNc1nc(ncc1CC)C 27a_100015525214_200000069817 [0,2,0,0,0,0|1,0,0]=3 1415 B12R1.268 CCSc1nc(ccc1CO)C 62a_100000210202_102495338573 [0,2,0,0,0,0|2,0,0]=4 1416 B12R1.268 CCSc1nc(ccc1CO)C 62a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 1417 B12R1.268 CCSc1nc(ncc1CC)C 62a_100000210202_200000069817 [0,2,0,0,0,0|2,0,0]=4 1418 B12R1.268 CCSc1nc(ncc1CC)C 62a_200000069817_100000210202 [0,2,0,0,0,0|2,0,0]=4 1419 B12R1.268 CCc1cnc(nc1SCF)C 62a_100015361967_200000069817 [0,2,0,0,0,0|2,0,0]=4 1420 B12R1.268 CCc1cnc(nc1SCF)C 62a_200000069817_100015361967 [0,2,0,0,0,0|2,0,0]=4 1421 B12R1.268 Cc1ccc(c(c1)NCF)CO 34a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 1422 B12R1.268 Cc1ccc(c(n1)SCF)CO 62a_100015361967_102495338573 [0,2,0,0,0,0|2,0,0]=4 1423 B12R1.268 Cc1ccc(c(n1)SCF)CO 62a_102495338573_100015361967 [0,2,0,0,0,0|2,0,0]=4 1424 B12R1.69 C#CCOc1ccc(nc1N)C 34a_100000694039_100000184674 [0,2,0,0,0,0|2,0,0]=4 1425 B12R1.69 C#CCOc1ccc(nc1N)C 7a_100000694039_100000038162 [0,2,0,0,0,0|2,0,0]=4 1426 B12R1.69 C#CCOc1cnc(nc1C)C 34a_100009864123_100000184674 [0,2,0,0,0,0|2,0,0]=4 1427 B12R1.69 C#CCOc1cnc(nc1C)C 7a_100009864123_100000038162 [0,2,0,0,0,0|2,0,0]=4 1428 B12R1.69 C#CCOc1cnc(nc1N)N 7a_100025726691_100000038162 [0,2,0,0,0,0|2,0,0]=4 1429 B12R1.69 C#CCSc1ccc(nc1N)C 62a_100000038162_100009816662 [0,2,0,0,0,0|2,0,0]=4 1430 B12R1.69 C#CCSc1cnc(cc1N)C 62a_100000038162_100009817891 [0,2,0,0,0,0|2,0,0]=4 1431 B12R1.69 C#CCSc1cnc(nc1N)C 62a_100000038162_100000684960 [0,2,0,0,0,0|1,0,0]=3 1432 B12R1.69 C#CCSc1cnc(nc1N)Cl 62a_100000038162_100010196077 [0,2,0,0,0,0|2,0,0]=4 1433 B12R1.69 C#CCSc1cnc(nc1N)N 62a_100000038162_200010734216 [0,2,0,0,0,0|2,0,0]=4 1434 B12R1.69 C=CCOc1ccc(nc1N)C 34a_100000694039_100015514636 [0,2,0,0,0,0|2,0,0]=4 1435 B12R1.69 C=CCOc1ccc(nc1N)C 7a_100000694039_100015514636 [0,2,0,0,0,0|2,0,0]=4 1436 B12R1.69 C=CCOc1cnc(nc1C)C 34a_100009864123_100015514636 [0,2,0,0,0,0|2,0,0]=4 1437 B12R1.69 C=CCOc1cnc(nc1C)C 7a_100009864123_100015514636 [0,2,0,0,0,0|2,0,0]=4 1438 B12R1.69 C=CCOc1cnc(nc1N)N 7a_100025726691_100015514636 [0,2,0,0,0,0|2,0,0]=4 1439 B12R1.69 C=CCSc1ccc(nc1N)C 62a_100000210623_100009816662 [0,2,0,0,0,0|2,0,0]=4 1440 B12R1.69 C=CCSc1ccc(nc1N)C 62a_100009816662_100000210623 [0,2,0,0,0,0|2,0,0]=4 1441 B12R1.69 C=CCSc1cnc(cc1N)C 62a_100000210623_100009817891 [0,2,0,0,0,0|2,0,0]=4 1442 B12R1.69 C=CCSc1cnc(cc1N)C 62a_100009817891_100000210623 [0,2,0,0,0,0|2,0,0]=4 1443 B12R1.69 C=CCSc1cnc(nc1N)C 62a_100000210623_100000684960 [0,2,0,0,0,0|1,0,0]=3 1444 B12R1.69 C=CCSc1cnc(nc1N)C 62a_100000684960_100000210623 [0,2,0,0,0,0|1,0,0]=3 1445 B12R1.69 C=CCSc1cnc(nc1N)Cl 62a_100000210623_100010196077 [0,2,0,0,0,0|2,0,0]=4 1446 B12R1.69 C=CCSc1cnc(nc1N)Cl 62a_100010196077_100000210623 [0,2,0,0,0,0|2,0,0]=4 1447 B12R1.69 C=CCSc1cnc(nc1N)N 62a_100000210623_200010734216 [0,2,0,0,0,0|2,0,0]=4 1448 B12R1.69 C=CCSc1cnc(nc1N)N 62a_200010734216_100000210623 [0,2,0,0,0,0|2,0,0]=4 1449 B12R1.69 CCCCc1ccc(nc1N)C 271570a_100020621405_100009816662 [0,2,0,0,0,0|2,0,0]=4 1450 B12R1.69 CCCCc1cnc(cc1N)C 271570a_100020621405_100009817891 [0,2,0,0,0,0|2,0,0]=4 1451 B12R1.69 CCCCc1cnc(nc1N)C 271570a_100020621405_100000684960 [0,2,0,0,0,0|1,0,0]=3 1452 B12R1.69 CCCCc1cnc(nc1N)N 271570a_100020621405_200010734216 [0,2,0,0,0,0|2,0,0]=4 1453 B12R1.69 CCCOc1ccc(nc1N)C 34a_100000694039_100000210303 [0,2,0,0,0,0|2,0,0]=4 1454 B12R1.69 CCCOc1ccc(nc1N)C 7a_100000694039_100000210303 [0,2,0,0,0,0|2,0,0]=4 1455 B12R1.69 CCCOc1cnc(nc1C)C 34a_100009864123_100000210303 [0,2,0,0,0,0|2,0,0]=4 1456 B12R1.69 CCCOc1cnc(nc1C)C 7a_100009864123_100000210303 [0,2,0,0,0,0|2,0,0]=4 1457 B12R1.69 CCCOc1cnc(nc1N)N 7a_100025726691_100000210303 [0,2,0,0,0,0|2,0,0]=4 1458 B12R1.69 CCCSc1ccc(nc1N)C 62a_100000210303_100009816662 [0,2,0,0,0,0|2,0,0]=4 1459 B12R1.69 CCCSc1ccc(nc1N)C 62a_100009816662_100000210303 [0,2,0,0,0,0|2,0,0]=4 1460 B12R1.69 CCCSc1cnc(cc1N)C 62a_100000210303_100009817891 [0,2,0,0,0,0|2,0,0]=4 1461 B12R1.69 CCCSc1cnc(cc1N)C 62a_100009817891_100000210303 [0,2,0,0,0,0|2,0,0]=4 1462 B12R1.69 CCCSc1cnc(nc1N)C 62a_100000210303_100000684960 [0,2,0,0,0,0|1,0,0]=3 1463 B12R1.69 CCCSc1cnc(nc1N)C 62a_100000684960_100000210303 [0,2,0,0,0,0|1,0,0]=3 1464 B12R1.69 CCCSc1cnc(nc1N)Cl 62a_100000210303_100010196077 [0,2,0,0,0,0|2,0,0]=4 1465 B12R1.69 CCCSc1cnc(nc1N)Cl 62a_100010196077_100000210303 [0,2,0,0,0,0|2,0,0]=4 1466 B12R1.69 CCCSc1cnc(nc1N)N 62a_100000210303_200010734216 [0,2,0,0,0,0|2,0,0]=4 1467 B12R1.69 CCCSc1cnc(nc1N)N 62a_200010734216_100000210303 [0,2,0,0,0,0|2,0,0]=4 1468 B12R1.69 CCOCc1ccc(cc1N)C 34a_100000087799_100000210202 [0,2,0,0,0,0|2,0,0]=4 1469 B12R1.69 CCOCc1ccc(cc1N)C 7a_100000087799_100000210202 [0,2,0,0,0,0|2,0,0]=4 1470 B12R1.69 CCOCc1ccc(nc1Br)C 34a_100121572206_200010064658 [0,2,0,0,0,0|2,0,0]=4 1471 B12R1.69 CCOCc1ccc(nc1C)C 34a_100011756430_100000210202 [0,2,0,0,0,0|2,0,0]=4 1472 B12R1.69 CCOCc1ccc(nc1C)C 7a_100011756430_100000210202 [0,2,0,0,0,0|2,0,0]=4 1473 B12R1.69 CCOCc1ccc(nc1Cl)C 34a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 1474 B12R1.69 CCOCc1ccc(nc1Cl)C 7a_102495338573_100000210202 [0,2,0,0,0,0|2,0,0]=4 1475 B12R1.69 CCOCc1cnc(cc1N)C 34a_200012022818_100000210202 [0,2,0,0,0,0|1,0,0]=3 1476 B12R1.69 CCOCc1cnc(cc1N)Cl 34a_100009830438_100000210202 [0,2,0,0,0,0|2,0,0]=4 1477 B12R1.69 CCOCc1cnc(nc1C)C 34a_100000699490_100000210202 [0,2,0,0,0,0|1,0,0]=3 1478 B12R1.69 CCOCc1cnc(nc1C)C 7a_100000699490_100000210202 [0,2,0,0,0,0|1,0,0]=3 1479 B12R1.69 CCOCc1cnc(nc1Cl)Cl 34a_100121572206_100000071240 [0,2,0,0,0,0|2,0,0]=4 1480 B12R1.69 CCOCc1cnc(nc1Cl)Cl 34a_200009828795_100000210202 [0,2,0,0,0,0|2,0,0]=4 1481 B12R1.69 CCOCc1cnc(nc1Cl)Cl 7a_200009828795_100000210202 [0,2,0,0,0,0|2,0,0]=4 1482 B12R1.69 CCOCc1cnc(nc1N)C 7a_100000701481_100000210202 [0,2,0,0,0,0|0,0,0]=2 1483 B12R1.69 CCOCc1cnc(nc1N)Cl 7a_200009965464_100000210202 [0,2,0,0,0,0|1,0,0]=3 1484 B12R1.69 CCOCc1cnc(nc1N)N 7a_100000083744_100000210202 [0,2,0,0,0,0|1,0,0]=3 1485 B12R1.69 COCSc1ccc(cc1N)C 62a_100000766300_100011216686 [0,2,0,0,0,0|2,0,0]=4 1486 B12R1.69 COCSc1ccc(cc1N)C 62a_100011216686_100000766300 [0,2,0,0,0,0|2,0,0]=4 1487 B12R1.69 COCSc1ccc(nc1C)C 62a_100000766300_100009813853 [0,2,0,0,0,0|2,0,0]=4 1488 B12R1.69 COCSc1ccc(nc1C)C 62a_100009813853_100000766300 [0,2,0,0,0,0|2,0,0]=4 1489 B12R1.69 COCSc1ccc(nc1F)C 62a_100000766300_100010006597 [0,2,0,0,0,0|2,0,0]=4 1490 B12R1.69 COCSc1ccc(nc1F)C 62a_100010006597_100000766300 [0,2,0,0,0,0|2,0,0]=4 1491 B12R1.69 COCSc1ccc(nc1N)C 62a_100000766300_100009816662 [0,2,0,0,0,0|1,0,0]=3 1492 B12R1.69 COCSc1ccc(nc1N)C 62a_100009816662_100000766300 [0,2,0,0,0,0|1,0,0]=3 1493 B12R1.69 COCSc1ccc(nc1N)Cl 62a_100000766300_100010171640 [0,2,0,0,0,0|2,0,0]=4 1494 B12R1.69 COCSc1ccc(nc1N)Cl 62a_100010171640_100000766300 [0,2,0,0,0,0|2,0,0]=4 1495 B12R1.69 COCSc1ccc(nc1N)F 62a_100000766300_100009854977 [0,2,0,0,0,0|2,0,0]=4 1496 B12R1.69 COCSc1ccc(nc1N)F 62a_100009854977_100000766300 [0,2,0,0,0,0|2,0,0]=4 1497 B12R1.69 COCSc1ccc(nc1N)N 62a_100011356871_100000766300 [0,2,0,0,0,0|2,0,0]=4 1498 B12R1.69 COCSc1ccc(nc1O)C 62a_100000766300_100009817604 [0,2,0,0,0,0|2,0,0]=4 1499 B12R1.69 COCSc1ccc(nc1O)C 62a_100009817604_100000766300 [0,2,0,0,0,0|2,0,0]=4 1500 B12R1.69 COCSc1cnc(=O)[nH]c1N 62a_100000708077_100000766300 [0,2,0,0,0,0|1,0,1]=4 1501 B12R1.69 COCSc1cnc(=O)[nH]c1N 62a_100000766300_100000708077 [0,2,0,0,0,0|1,0,1]=4 1502 B12R1.69 COCSc1cnc([nH]c1=O)C 62a_100000766300_100011999157 [0,2,0,0,0,0|1,0,1]=4 1503 B12R1.69 COCSc1cnc([nH]c1=O)C 62a_100011999157_100000766300 [0,2,0,0,0,0|1,0,1]=4 1504 B12R1.69 COCSc1cnc(cc1C)C 62a_100000766300_100009819613 [0,2,0,0,0,0|2,0,0]=4 1505 B12R1.69 COCSc1cnc(cc1C)C 62a_100009819613_100000766300 [0,2,0,0,0,0|2,0,0]=4 1506 B12R1.69 COCSc1cnc(cc1N)C 62a_100000766300_100009817891 [0,2,0,0,0,0|1,0,0]=3 1507 B12R1.69 COCSc1cnc(cc1N)C 62a_100009817891_100000766300 [0,2,0,0,0,0|1,0,0]=3 1508 B12R1.69 COCSc1cnc(cc1N)Cl 62a_100000766300_100010209552 [0,2,0,0,0,0|2,0,0]=4 1509 B12R1.69 COCSc1cnc(cc1N)Cl 62a_100010209552_100000766300 [0,2,0,0,0,0|2,0,0]=4 1510 B12R1.69 COCSc1cnc(cc1N)N 62a_100000766300_200009857908 [0,2,0,0,0,0|2,0,0]=4 1511 B12R1.69 COCSc1cnc(cc1N)N 62a_200009857908_100000766300 [0,2,0,0,0,0|2,0,0]=4 1512 B12R1.69 COCSc1cnc(cc1O)C 62a_100000766300_100011016184 [0,2,0,0,0,0|2,0,0]=4 1513 B12R1.69 COCSc1cnc(cc1O)C 62a_100011016184_100000766300 [0,2,0,0,0,0|2,0,0]=4 1514 B12R1.69 COCSc1cnc(nc1C)N 62a_100000725598_100000766300 [0,2,0,0,0,0|2,0,0]=4 1515 B12R1.69 COCSc1cnc(nc1C)N 62a_100000766300_100000725598 [0,2,0,0,0,0|2,0,0]=4 1516 B12R1.69 COCSc1cnc(nc1Cl)Cl 62a_100000766300_100000049956 [0,2,0,0,0,0|2,0,0]=4 1517 B12R1.69 COCSc1cnc(nc1F)F 62a_100000766300_100009820707 [0,2,0,0,0,0|2,0,0]=4 1518 B12R1.69 COCSc1cnc(nc1F)F 62a_100009820707_100000766300 [0,2,0,0,0,0|2,0,0]=4 1519 B12R1.69 COCSc1cnc(nc1N)C 62a_100000684960_100000766300 [0,2,0,0,0,0|0,0,0]=2 1520 B12R1.69 COCSc1cnc(nc1N)C 62a_100000766300_100000684960 [0,2,0,0,0,0|0,0,0]=2 1521 B12R1.69 COCSc1cnc(nc1N)Cl 62a_100000766300_100010196077 [0,2,0,0,0,0|1,0,0]=3 1522 B12R1.69 COCSc1cnc(nc1N)Cl 62a_100010196077_100000766300 [0,2,0,0,0,0|1,0,0]=3 1523 B12R1.69 COCSc1cnc(nc1N)N 62a_100000766300_200010734216 [0,2,0,0,0,0|1,0,0]=3 1524 B12R1.69 COCSc1cnc(nc1N)N 62a_200010734216_100000766300 [0,2,0,0,0,0|1,0,0]=3 1525 B12R1.69 CSCOc1ccc(nc1N)C 34a_100000694039_100011218213 [0,2,0,0,0,0|1,1,0]=4 1526 B12R1.69 CSCOc1cnc(nc1C)C 34a_100009864123_100011218213 [0,2,0,0,0,0|1,1,0]=4 1527 B12R1.69 CSCSc1ccc(nc1N)C 62a_100009816662_100011218213 [0,2,0,0,0,0|1,1,0]=4 1528 B12R1.69 CSCSc1ccc(nc1N)C 62a_100011218213_100009816662 [0,2,0,0,0,0|1,1,0]=4 1529 B12R1.69 CSCSc1cnc(cc1N)C 62a_100009817891_100011218213 [0,2,0,0,0,0|1,1,0]=4 1530 B12R1.69 CSCSc1cnc(cc1N)C 62a_100011218213_100009817891 [0,2,0,0,0,0|1,1,0]=4 1531 B12R1.69 CSCSc1cnc(nc1N)C 62a_100000684960_100011218213 [0,2,0,0,0,0|0,1,0]=3 1532 B12R1.69 CSCSc1cnc(nc1N)C 62a_100011218213_100000684960 [0,2,0,0,0,0|0,1,0]=3 1533 B12R1.69 CSCSc1cnc(nc1N)Cl 62a_100010196077_100011218213 [0,2,0,0,0,0|1,1,0]=4 1534 B12R1.69 CSCSc1cnc(nc1N)Cl 62a_100011218213_100010196077 [0,2,0,0,0,0|1,1,0]=4 1535 B12R1.69 CSCSc1cnc(nc1N)N 62a_100011218213_200010734216 [0,2,0,0,0,0|1,1,0]=4 1536 B12R1.69 CSCSc1cnc(nc1N)N 62a_200010734216_100011218213 [0,2,0,0,0,0|1,1,0]=4 1537 B12R1.69 Cc1cc(c(cn1)COCF)N 34a_200012022818_100015361967 [0,2,0,0,0,0|1,0,0]=3 1538 B12R1.69 Cc1cc(c(cn1)OCCO)Br 34a_100009843476_100000211926 [0,2,0,0,0,0|2,0,0]=4 1539 B12R1.69 Cc1cc(c(cn1)OCCO)Br 7a_100009843476_100000211926 [0,2,0,0,0,0|2,0,0]=4 1540 B12R1.69 Cc1cc(c(cn1)OCCO)C 34a_200000068632_100000211926 [0,2,0,0,0,0|2,0,0]=4 1541 B12R1.69 Cc1cc(c(cn1)OCCO)C 7a_200000068632_100000211926 [0,2,0,0,0,0|2,0,0]=4 1542 B12R1.69 Cc1cc(c(cn1)SCC#N)N 62a_100009817891_100011215382 [0,2,0,0,0,0|2,0,0]=4 1543 B12R1.69 Cc1cc(c(cn1)SCC#N)N 62a_100011215382_100009817891 [0,2,0,0,0,0|2,0,0]=4 1544 B12R1.69 Cc1cc(c(cn1)SCC=O)N 62a_100009817891_200015260668 [0,2,0,0,0,0|1,0,1]=4 1545 B12R1.69 Cc1cc(c(cn1)SCC=O)N 62a_200015260668_100009817891 [0,2,0,0,0,0|1,0,1]=4 1546 B12R1.69 Cc1cc(c(cn1)SCCF)N 62a_100009817891_100011217306 [0,2,0,0,0,0|2,0,0]=4 1547 B12R1.69 Cc1cc(c(cn1)SCCF)N 62a_100011217306_100009817891 [0,2,0,0,0,0|2,0,0]=4 1548 B12R1.69 Cc1cc(c(cn1)SCCO)C 62a_100000211926_100009819613 [0,2,0,0,0,0|2,0,0]=4 1549 B12R1.69 Cc1cc(c(cn1)SCCO)C 62a_100009819613_100000211926 [0,2,0,0,0,0|2,0,0]=4 1550 B12R1.69 Cc1cc(c(cn1)SCCO)N 62a_100000211926_100009817891 [0,2,0,0,0,0|1,0,0]=3 1551 B12R1.69 Cc1cc(c(cn1)SCCO)N 62a_100009817891_100000211926 [0,2,0,0,0,0|1,0,0]=3 1552 B12R1.69 Cc1cc(c(cn1)SCCO)O 62a_100000211926_100011016184 [0,2,0,0,0,0|2,0,0]=4 1553 B12R1.69 Cc1cc(c(cn1)SCCO)O 62a_100011016184_100000211926 [0,2,0,0,0,0|2,0,0]=4 1554 B12R1.69 Cc1ccc(c(c1)N)COCF 34a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 1555 B12R1.69 Cc1ccc(c(c1)N)COCF 7a_100000087799_100015361967 [0,2,0,0,0,0|2,0,0]=4 1556 B12R1.69 Cc1ccc(c(c1)N)OCCO 34a_100011215204_100000211926 [0,2,0,0,0,0|2,0,0]=4 1557 B12R1.69 Cc1ccc(c(c1)N)OCCO 7a_100011215204_100000211926 [0,2,0,0,0,0|2,0,0]=4 1558 B12R1.69 Cc1ccc(c(c1)N)SCCO 62a_100000211926_100011216686 [0,2,0,0,0,0|2,0,0]=4 1559 B12R1.69 Cc1ccc(c(c1)N)SCCO 62a_100011216686_100000211926 [0,2,0,0,0,0|2,0,0]=4 1560 B12R1.69 Cc1ccc(c(n1)Br)OCCO 34a_100000702858_100000211926 [0,2,0,0,0,0|2,0,0]=4 1561 B12R1.69 Cc1ccc(c(n1)Br)OCCO 7a_100000702858_100000211926 [0,2,0,0,0,0|2,0,0]=4 1562 B12R1.69 Cc1ccc(c(n1)C)COCF 34a_100011756430_100015361967 [0,2,0,0,0,0|2,0,0]=4 1563 B12R1.69 Cc1ccc(c(n1)C)COCF 7a_100011756430_100015361967 [0,2,0,0,0,0|2,0,0]=4 1564 B12R1.69 Cc1ccc(c(n1)C)OCCO 34a_100011218912_100000211926 [0,2,0,0,0,0|2,0,0]=4 1565 B12R1.69 Cc1ccc(c(n1)C)OCCO 7a_100011218912_100000211926 [0,2,0,0,0,0|2,0,0]=4 1566 B12R1.69 Cc1ccc(c(n1)C)SCCO 62a_100000211926_100009813853 [0,2,0,0,0,0|2,0,0]=4 1567 B12R1.69 Cc1ccc(c(n1)C)SCCO 62a_100009813853_100000211926 [0,2,0,0,0,0|2,0,0]=4 1568 B12R1.69 Cc1ccc(c(n1)Cl)COCF 34a_102495338573_100015361967 [0,2,0,0,0,0|2,0,0]=4 1569 B12R1.69 Cc1ccc(c(n1)Cl)COCF 7a_102495338573_100015361967 [0,2,0,0,0,0|2,0,0]=4 1570 B12R1.69 Cc1ccc(c(n1)Cl)OCCO 34a_100000086286_100000211926 [0,2,0,0,0,0|2,0,0]=4 1571 B12R1.69 Cc1ccc(c(n1)Cl)OCCO 7a_100000086286_100000211926 [0,2,0,0,0,0|2,0,0]=4 1572 B12R1.69 Cc1ccc(c(n1)F)OCCO 34a_100000079963_100000211926 [0,2,0,0,0,0|2,0,0]=4 1573 B12R1.69 Cc1ccc(c(n1)F)OCCO 7a_100000079963_100000211926 [0,2,0,0,0,0|2,0,0]=4 1574 B12R1.69 Cc1ccc(c(n1)F)SCCO 62a_100000211926_100010006597 [0,2,0,0,0,0|2,0,0]=4 1575 B12R1.69 Cc1ccc(c(n1)F)SCCO 62a_100010006597_100000211926 [0,2,0,0,0,0|2,0,0]=4 1576 B12R1.69 Cc1ccc(c(n1)I)OCCO 34a_100000023897_100000211926 [0,2,0,0,0,0|2,0,0]=4 1577 B12R1.69 Cc1ccc(c(n1)I)OCCO 7a_100000023897_100000211926 [0,2,0,0,0,0|2,0,0]=4 1578 B12R1.69 Cc1ccc(c(n1)N)OCC#N 7a_100000694039_100011215382 [0,2,0,0,0,0|2,0,0]=4 1579 B12R1.69 Cc1ccc(c(n1)N)OCC=O 34a_100000694039_200009817547 [0,2,0,0,0,0|1,0,1]=4 1580 B12R1.69 Cc1ccc(c(n1)N)OCC=O 7a_100000694039_200015260668 [0,2,0,0,0,0|1,0,1]=4 1581 B12R1.69 Cc1ccc(c(n1)N)OCCF 34a_100000694039_100011217306 [0,2,0,0,0,0|2,0,0]=4 1582 B12R1.69 Cc1ccc(c(n1)N)OCCF 7a_100000694039_100011217306 [0,2,0,0,0,0|2,0,0]=4 1583 B12R1.69 Cc1ccc(c(n1)N)OCCO 34a_100000694039_100000211926 [0,2,0,0,0,0|1,0,0]=3 1584 B12R1.69 Cc1ccc(c(n1)N)OCCO 7a_100000694039_100000211926 [0,2,0,0,0,0|1,0,0]=3 1585 B12R1.69 Cc1ccc(c(n1)N)SCC#N 62a_100009816662_100011215382 [0,2,0,0,0,0|2,0,0]=4 1586 B12R1.69 Cc1ccc(c(n1)N)SCC#N 62a_100011215382_100009816662 [0,2,0,0,0,0|2,0,0]=4 1587 B12R1.69 Cc1ccc(c(n1)N)SCC=O 62a_100009816662_200015260668 [0,2,0,0,0,0|1,0,1]=4 1588 B12R1.69 Cc1ccc(c(n1)N)SCC=O 62a_200015260668_100009816662 [0,2,0,0,0,0|1,0,1]=4 1589 B12R1.69 Cc1ccc(c(n1)N)SCCF 62a_100009816662_100011217306 [0,2,0,0,0,0|2,0,0]=4 1590 B12R1.69 Cc1ccc(c(n1)N)SCCF 62a_100011217306_100009816662 [0,2,0,0,0,0|2,0,0]=4 1591 B12R1.69 Cc1ccc(c(n1)N)SCCO 62a_100000211926_100009816662 [0,2,0,0,0,0|1,0,0]=3 1592 B12R1.69 Cc1ccc(c(n1)N)SCCO 62a_100009816662_100000211926 [0,2,0,0,0,0|1,0,0]=3 1593 B12R1.69 Cc1ccc(c(n1)O)SCCO 62a_100000211926_100009817604 [0,2,0,0,0,0|2,0,0]=4 1594 B12R1.69 Cc1ccc(c(n1)O)SCCO 62a_100009817604_100000211926 [0,2,0,0,0,0|2,0,0]=4 1595 B12R1.69 Cc1nc(ncc1SCCO)N 62a_100000211926_100000725598 [0,2,0,0,0,0|2,0,0]=4 1596 B12R1.69 Cc1nc(ncc1SCCO)N 62a_100000725598_100000211926 [0,2,0,0,0,0|2,0,0]=4 1597 B12R1.69 Cc1ncc(c(=O)[nH]1)SCCO 62a_100000211926_100011999157 [0,2,0,0,0,0|1,0,1]=4 1598 B12R1.69 Cc1ncc(c(=O)[nH]1)SCCO 62a_100011999157_100000211926 [0,2,0,0,0,0|1,0,1]=4 1599 B12R1.69 Cc1ncc(c(n1)C)COCF 34a_100000699490_100015361967 [0,2,0,0,0,0|1,0,0]=3 1600 B12R1.69 Cc1ncc(c(n1)C)COCF 7a_100000699490_100015361967 [0,2,0,0,0,0|1,0,0]=3 1601 B12R1.69 Cc1ncc(c(n1)C)OCC#N 7a_100009864123_100011215382 [0,2,0,0,0,0|2,0,0]=4 1602 B12R1.69 Cc1ncc(c(n1)C)OCC=O 34a_100009864123_200009817547 [0,2,0,0,0,0|1,0,1]=4 1603 B12R1.69 Cc1ncc(c(n1)C)OCC=O 7a_100009864123_200015260668 [0,2,0,0,0,0|1,0,1]=4 1604 B12R1.69 Cc1ncc(c(n1)C)OCCF 34a_100009864123_100011217306 [0,2,0,0,0,0|2,0,0]=4 1605 B12R1.69 Cc1ncc(c(n1)C)OCCF 7a_100009864123_100011217306 [0,2,0,0,0,0|2,0,0]=4 1606 B12R1.69 Cc1ncc(c(n1)C)OCCO 34a_100009864123_100000211926 [0,2,0,0,0,0|1,0,0]=3 1607 B12R1.69 Cc1ncc(c(n1)C)OCCO 7a_100009864123_100000211926 [0,2,0,0,0,0|1,0,0]=3 1608 B12R1.69 Cc1ncc(c(n1)N)COCF 7a_100000701481_100015361967 [0,2,0,0,0,0|0,0,0]=2 1609 B12R1.69 Cc1ncc(c(n1)N)SCC#N 62a_100000684960_100011215382 [0,2,0,0,0,0|1,0,0]=3 1610 B12R1.69 Cc1ncc(c(n1)N)SCC#N 62a_100011215382_100000684960 [0,2,0,0,0,0|1,0,0]=3 1611 B12R1.69 Cc1ncc(c(n1)N)SCC=O 62a_100000684960_200015260668 [0,2,0,0,0,0|0,0,1]=3 1612 B12R1.69 Cc1ncc(c(n1)N)SCC=O 62a_200015260668_100000684960 [0,2,0,0,0,0|0,0,1]=3 1613 B12R1.69 Cc1ncc(c(n1)N)SCCF 62a_100000684960_100011217306 [0,2,0,0,0,0|1,0,0]=3 1614 B12R1.69 Cc1ncc(c(n1)N)SCCF 62a_100011217306_100000684960 [0,2,0,0,0,0|1,0,0]=3 1615 B12R1.69 Cc1ncc(c(n1)N)SCCO 62a_100000211926_100000684960 [0,2,0,0,0,0|0,0,0]=2 1616 B12R1.69 Cc1ncc(c(n1)N)SCCO 62a_100000684960_100000211926 [0,2,0,0,0,0|0,0,0]=2 1617 B12R1.69 FCOCc1cnc(nc1Cl)Cl 34a_200009828795_100015361967 [0,2,0,0,0,0|2,0,0]=4 1618 B12R1.69 FCOCc1cnc(nc1Cl)Cl 7a_200009828795_100015361967 [0,2,0,0,0,0|2,0,0]=4 1619 B12R1.69 N#CCOc1cnc(nc1N)N 7a_100025726691_100011215382 [0,2,0,0,0,0|2,0,0]=4 1620 B12R1.69 N#CCSc1cnc(nc1N)Cl 62a_100010196077_100011215382 [0,2,0,0,0,0|2,0,0]=4 1621 B12R1.69 N#CCSc1cnc(nc1N)Cl 62a_100011215382_100010196077 [0,2,0,0,0,0|2,0,0]=4 1622 B12R1.69 N#CCSc1cnc(nc1N)N 62a_100011215382_200010734216 [0,2,0,0,0,0|2,0,0]=4 1623 B12R1.69 N#CCSc1cnc(nc1N)N 62a_200010734216_100011215382 [0,2,0,0,0,0|2,0,0]=4 1624 B12R1.69 Nc1[nH]c(=O)ncc1SCCO 62a_100000211926_100000708077 [0,2,0,0,0,0|1,0,1]=4 1625 B12R1.69 Nc1[nH]c(=O)ncc1SCCO 62a_100000708077_100000211926 [0,2,0,0,0,0|1,0,1]=4 1626 B12R1.69 Nc1cc(c(cn1)SCCO)N 62a_100000211926_200009857908 [0,2,0,0,0,0|2,0,0]=4 1627 B12R1.69 Nc1cc(c(cn1)SCCO)N 62a_200009857908_100000211926 [0,2,0,0,0,0|2,0,0]=4 1628 B12R1.69 Nc1cc(ncc1COCF)Cl 34a_100009830438_100015361967 [0,2,0,0,0,0|2,0,0]=4 1629 B12R1.69 Nc1cc(ncc1OCCO)Br 34a_100009819941_100000211926 [0,2,0,0,0,0|2,0,0]=4 1630 B12R1.69 Nc1cc(ncc1OCCO)Br 7a_100009819941_100000211926 [0,2,0,0,0,0|2,0,0]=4 1631 B12R1.69 Nc1cc(ncc1SCCO)Cl 62a_100000211926_100010209552 [0,2,0,0,0,0|2,0,0]=4 1632 B12R1.69 Nc1cc(ncc1SCCO)Cl 62a_100010209552_100000211926 [0,2,0,0,0,0|2,0,0]=4 1633 B12R1.69 Nc1ccc(c(n1)N)SCCO 62a_100011356871_100000211926 [0,2,0,0,0,0|2,0,0]=4 1634 B12R1.69 Nc1nc(ccc1OCCO)Br 34a_100000685527_100000211926 [0,2,0,0,0,0|2,0,0]=4 1635 B12R1.69 Nc1nc(ccc1OCCO)Br 7a_100000685527_100000211926 [0,2,0,0,0,0|2,0,0]=4 1636 B12R1.69 Nc1nc(ccc1OCCO)Cl 34a_100000717809_100000211926 [0,2,0,0,0,0|2,0,0]=4 1637 B12R1.69 Nc1nc(ccc1OCCO)Cl 7a_100000717809_100000211926 [0,2,0,0,0,0|2,0,0]=4 1638 B12R1.69 Nc1nc(ccc1SCCO)Cl 62a_100000211926_100010171640 [0,2,0,0,0,0|2,0,0]=4 1639 B12R1.69 Nc1nc(ccc1SCCO)Cl 62a_100010171640_100000211926 [0,2,0,0,0,0|2,0,0]=4 1640 B12R1.69 Nc1nc(ccc1SCCO)F 62a_100000211926_100009854977 [0,2,0,0,0,0|2,0,0]=4 1641 B12R1.69 Nc1nc(ccc1SCCO)F 62a_100009854977_100000211926 [0,2,0,0,0,0|2,0,0]=4 1642 B12R1.69 Nc1nc(ncc1COCF)Cl 7a_200009965464_100015361967 [0,2,0,0,0,0|1,0,0]=3 1643 B12R1.69 Nc1nc(ncc1SCC=O)Cl 62a_100010196077_200015260668 [0,2,0,0,0,0|1,0,1]=4 1644 B12R1.69 Nc1nc(ncc1SCC=O)Cl 62a_200015260668_100010196077 [0,2,0,0,0,0|1,0,1]=4 1645 B12R1.69 Nc1nc(ncc1SCCF)Cl 62a_100010196077_100011217306 [0,2,0,0,0,0|2,0,0]=4 1646 B12R1.69 Nc1nc(ncc1SCCF)Cl 62a_100011217306_100010196077 [0,2,0,0,0,0|2,0,0]=4 1647 B12R1.69 Nc1nc(ncc1SCCO)Cl 62a_100000211926_100010196077 [0,2,0,0,0,0|1,0,0]=3 1648 B12R1.69 Nc1nc(ncc1SCCO)Cl 62a_100010196077_100000211926 [0,2,0,0,0,0|1,0,0]=3 1649 B12R1.69 Nc1ncc(c(n1)N)COCF 7a_100000083744_100015361967 [0,2,0,0,0,0|1,0,0]=3 1650 B12R1.69 Nc1ncc(c(n1)N)OCC=O 7a_100025726691_200015260668 [0,2,0,0,0,0|1,0,1]=4 1651 B12R1.69 Nc1ncc(c(n1)N)OCCF 7a_100025726691_100011217306 [0,2,0,0,0,0|2,0,0]=4 1652 B12R1.69 Nc1ncc(c(n1)N)OCCO 7a_100025726691_100000211926 [0,2,0,0,0,0|1,0,0]=3 1653 B12R1.69 Nc1ncc(c(n1)N)SCC=O 62a_200010734216_200015260668 [0,2,0,0,0,0|1,0,1]=4 1654 B12R1.69 Nc1ncc(c(n1)N)SCC=O 62a_200015260668_200010734216 [0,2,0,0,0,0|1,0,1]=4 1655 B12R1.69 Nc1ncc(c(n1)N)SCCF 62a_100011217306_200010734216 [0,2,0,0,0,0|2,0,0]=4 1656 B12R1.69 Nc1ncc(c(n1)N)SCCF 62a_200010734216_100011217306 [0,2,0,0,0,0|2,0,0]=4 1657 B12R1.69 Nc1ncc(c(n1)N)SCCO 62a_100000211926_200010734216 [0,2,0,0,0,0|1,0,0]=3 1658 B12R1.69 Nc1ncc(c(n1)N)SCCO 62a_200010734216_100000211926 [0,2,0,0,0,0|1,0,0]=3 1659 B12R1.69 OCCOc1cnc(nc1Cl)Cl 34a_100010725077_100000211926 [0,2,0,0,0,0|2,0,0]=4 1660 B12R1.69 OCCOc1cnc(nc1Cl)Cl 7a_100010725077_100000211926 [0,2,0,0,0,0|2,0,0]=4 1661 B12R1.69 OCCSc1cnc(nc1Cl)Cl 62a_100000211926_100000049956 [0,2,0,0,0,0|2,0,0]=4 1662 B12R1.69 OCCSc1cnc(nc1F)F 62a_100000211926_100009820707 [0,2,0,0,0,0|2,0,0]=4 1663 B12R1.69 OCCSc1cnc(nc1F)F 62a_100009820707_100000211926 [0,2,0,0,0,0|2,0,0]=4 1664 B12R1.114 C=C=Cc1cnc(nc1N)OC 271570a_100015277604_100010218985 [0,2,0,0,0,0|1,0,1]=4 1665 B12R1.114 CC=Cc1cnc(nc1N)OC 271570a_100016259895_100010218985 [0,2,0,0,0,0|1,0,1]=4 1666 B12R1.114 CCSc1ccc(nc1N)OC 62a_100010187629_100000210202 [0,2,0,0,0,0|2,0,0]=4 1667 B12R1.114 CCSc1cnc(cc1N)OC 62a_100000210202_100010254562 [0,2,0,0,0,0|2,0,0]=4 1668 B12R1.114 CCSc1cnc(cc1N)OC 62a_100010254562_100000210202 [0,2,0,0,0,0|2,0,0]=4 1669 B12R1.114 CCSc1cnc(nc1C)OC 62a_100000210202_100010152497 [0,2,0,0,0,0|2,0,0]=4 1670 B12R1.114 CCSc1cnc(nc1C)OC 62a_100010152497_100000210202 [0,2,0,0,0,0|2,0,0]=4 1671 B12R1.114 CCSc1cnc(nc1C)SC 62a_100000210202_100015672207 [0,2,0,0,0,0|2,0,0]=4 1672 B12R1.114 CCSc1cnc(nc1C)SC 62a_100015672207_100000210202 [0,2,0,0,0,0|2,0,0]=4 1673 B12R1.114 CCSc1cnc(nc1Cl)SC 62a_100000210202_100010271306 [0,2,0,0,0,0|2,0,0]=4 1674 B12R1.114 CCSc1cnc(nc1Cl)SC 62a_100010271306_100000210202 [0,2,0,0,0,0|2,0,0]=4 1675 B12R1.114 CCSc1cnc(nc1N)OC 62a_100000210202_100010218985 [0,2,0,0,0,0|1,0,0]=3 1676 B12R1.114 CCSc1cnc(nc1N)OC 62a_100010218985_100000210202 [0,2,0,0,0,0|1,0,0]=3 1677 B12R1.114 CCSc1cnc(nc1O)SC 62a_100000210202_100009995076 [0,2,0,0,0,0|2,0,0]=4 1678 B12R1.114 CCSc1cnc(nc1O)SC 62a_100009995076_100000210202 [0,2,0,0,0,0|2,0,0]=4 1679 B12R1.114 CCc1ncc(c(n1)N)COC 7a_200009966989_200000210301 [0,2,0,0,0,0|0,0,0]=2 1680 B12R1.114 CCc1ncc(c(n1)N)CO[13CH3] 7a_200009966989_200025704644 [0,2,0,0,0,0|0,0,0]=2 1681 B12R1.114 CNCc1cnc(nc1C)SC 207a_100102657272_200010621462 [0,2,0,0,0,0|2,0,0]=4 1682 B12R1.114 COCc1ccc(cc1N)OC 34a_100011998734_200000210301 [0,2,0,0,0,0|2,0,0]=4 1683 B12R1.114 COCc1ccc(cc1N)SC 62a_100013084866_200000210301 [0,2,0,0,0,0|2,0,0]=4 1684 B12R1.114 COCc1ccc(cc1N)SC 62a_200000210301_100013084866 [0,2,0,0,0,0|2,0,0]=4 1685 B12R1.114 COCc1ccc(cc1N)S[13CH3] 62a_100013084866_200025704644 [0,2,0,0,0,0|2,0,0]=4 1686 B12R1.114 COCc1ccc(cc1N)S[13CH3] 62a_200025704644_100013084866 [0,2,0,0,0,0|2,0,0]=4 1687 B12R1.114 COCc1ccc(nc1Cl)OC 34a_100009885603_200000210301 [0,2,0,0,0,0|2,0,0]=4 1688 B12R1.114 COCc1cnc(nc1Cl)SC 7a_100009869927_200000210301 [0,2,0,0,0,0|1,0,0]=3 1689 B12R1.114 COCc1cnc(nc1N)SC 7a_100000087618_200000210301 [0,2,0,0,0,0|0,0,0]=2 1690 B12R1.114 COc1cc(c(cn1)SCF)N 62a_100010254562_100015361967 [0,2,0,0,0,0|2,0,0]=4 1691 B12R1.114 COc1cc(c(cn1)SCF)N 62a_100015361967_100010254562 [0,2,0,0,0,0|2,0,0]=4 1692 B12R1.114 COc1ccc(c(c1)N)CO[13CH3] 34a_100011998734_200025704644 [0,2,0,0,0,0|2,0,0]=4 1693 B12R1.114 COc1ccc(c(n1)Cl)CO[13CH3] 34a_100009885603_200025704644 [0,2,0,0,0,0|2,0,0]=4 1694 B12R1.114 COc1ccc(c(n1)N)SCF 62a_100010187629_100015361967 [0,2,0,0,0,0|2,0,0]=4 1695 B12R1.114 COc1ncc(c(n1)C)SCF 62a_100010152497_100015361967 [0,2,0,0,0,0|2,0,0]=4 1696 B12R1.114 COc1ncc(c(n1)C)SCF 62a_100015361967_100010152497 [0,2,0,0,0,0|2,0,0]=4 1697 B12R1.114 COc1ncc(c(n1)N)SCF 62a_100010218985_100015361967 [0,2,0,0,0,0|1,0,0]=3 1698 B12R1.114 COc1ncc(c(n1)N)SCF 62a_100015361967_100010218985 [0,2,0,0,0,0|1,0,0]=3 1699 B12R1.114 CSc1ncc(c(n1)C)SCF 62a_100015361967_100015672207 [0,2,0,0,0,0|2,0,0]=4 1700 B12R1.114 CSc1ncc(c(n1)C)SCF 62a_100015672207_100015361967 [0,2,0,0,0,0|2,0,0]=4 1701 B12R1.114 CSc1ncc(c(n1)Cl)CO[13CH3] 7a_100009869927_200025704644 [0,2,0,0,0,0|1,0,0]=3 1702 B12R1.114 CSc1ncc(c(n1)Cl)SCF 62a_100010271306_100015361967 [0,2,0,0,0,0|2,0,0]=4 1703 B12R1.114 CSc1ncc(c(n1)Cl)SCF 62a_100015361967_100010271306 [0,2,0,0,0,0|2,0,0]=4 1704 B12R1.114 CSc1ncc(c(n1)N)CO[13CH3] 7a_100000087618_200025704644 [0,2,0,0,0,0|0,0,0]=2 1705 B12R1.114 CSc1ncc(c(n1)O)SCF 62a_100009995076_100015361967 [0,2,0,0,0,0|2,0,0]=4 1706 B12R1.114 CSc1ncc(c(n1)O)SCF 62a_100015361967_100009995076 [0,2,0,0,0,0|2,0,0]=4 1707 B12R1.233 CC(=Cc1cnc(nc1N)C)C 271570a_100102525489_100000684960 [0,2,0,0,0,0|1,0,1]=4 1708 B12R1.233 CC(C)Oc1cnc(nc1N)N 7a_100025726691_100000210206 [0,2,0,0,0,0|2,0,0]=4 1709 B12R1.233 CC(C)Sc1cnc(nc1N)Cl 62a_100000210206_100010196077 [0,2,0,0,0,0|2,0,0]=4 1710 B12R1.233 CC(C)Sc1cnc(nc1N)Cl 62a_100010196077_100000210206 [0,2,0,0,0,0|2,0,0]=4 1711 B12R1.233 CC(C)Sc1cnc(nc1N)N 62a_100000210206_200010734216 [0,2,0,0,0,0|2,0,0]=4 1712 B12R1.233 CC(C)Sc1cnc(nc1N)N 62a_200010734216_100000210206 [0,2,0,0,0,0|2,0,0]=4 1713 B12R1.233 Cc1cc(c(cn1)SC(C)C)N 62a_100000210206_100009817891 [0,2,0,0,0,0|2,0,0]=4 1714 B12R1.233 Cc1cc(c(cn1)SC(C)C)N 62a_100009817891_100000210206 [0,2,0,0,0,0|2,0,0]=4 1715 B12R1.233 Cc1ccc(c(n1)N)OC(C)C 34a_100000694039_100000210206 [0,2,0,0,0,0|2,0,0]=4 1716 B12R1.233 Cc1ccc(c(n1)N)OC(C)C 7a_100000694039_100000210206 [0,2,0,0,0,0|2,0,0]=4 1717 B12R1.233 Cc1ccc(c(n1)N)SC(C)C 62a_100000210206_100009816662 [0,2,0,0,0,0|2,0,0]=4 1718 B12R1.233 Cc1ccc(c(n1)N)SC(C)C 62a_100009816662_100000210206 [0,2,0,0,0,0|2,0,0]=4 1719 B12R1.233 Cc1ncc(c(n1)C)OC(C)C 34a_100009864123_100000210206 [0,2,0,0,0,0|2,0,0]=4 1720 B12R1.233 Cc1ncc(c(n1)C)OC(C)C 7a_100009864123_100000210206 [0,2,0,0,0,0|2,0,0]=4 1721 B12R1.233 Cc1ncc(c(n1)N)SC(C)C 62a_100000210206_100000684960 [0,2,0,0,0,0|1,0,0]=3 1722 B12R1.233 Cc1ncc(c(n1)N)SC(C)C 62a_100000684960_100000210206 [0,2,0,0,0,0|1,0,0]=3 1723 B12R1.1095 CCSc1c(cc(nc1C)C)N 62a_100000210202_100010261885 [0,2,0,0,0,0|2,0,0]=4 1724 B12R1.1095 CCSc1c(cc(nc1C)C)N 62a_100010261885_100000210202 [0,2,0,0,0,0|2,0,0]=4 1725 B12R1.1095 CCSc1c(nc(nc1Cl)C)C 62a_100000210202_200011356833 [0,2,0,0,0,0|2,0,0]=4 1726 B12R1.1095 CCSc1c(nc(nc1Cl)C)C 62a_200011356833_100000210202 [0,2,0,0,0,0|2,0,0]=4 1727 B12R1.1095 CCSc1c(nc(nc1Cl)C)Cl 62a_100000210202_100012456929 [0,2,0,0,0,0|2,0,0]=4 1728 B12R1.1095 CCSc1c(nc(nc1Cl)C)Cl 62a_100012456929_100000210202 [0,2,0,0,0,0|2,0,0]=4 1729 B12R1.1095 CCSc1c(nc(nc1O)N)N 62a_200009812812_100000210202 [0,2,0,0,0,0|2,0,0]=4 1730 B12R1.1095 COCc1c(nc(nc1Cl)Cl)Cl 7a_200010247266_200000210301 [0,2,0,0,0,0|2,0,0]=4 1731 B12R1.1095 Cc1cc(c(c(n1)C)SCF)N 62a_100010261885_100015361967 [0,2,0,0,0,0|2,0,0]=4 1732 B12R1.1095 Cc1cc(c(c(n1)C)SCF)N 62a_100015361967_100010261885 [0,2,0,0,0,0|2,0,0]=4 1733 B12R1.1095 Cc1nc(c(c(n1)Cl)SCF)C 62a_100015361967_200011356833 [0,2,0,0,0,0|2,0,0]=4 1734 B12R1.1095 Cc1nc(c(c(n1)Cl)SCF)C 62a_200011356833_100015361967 [0,2,0,0,0,0|2,0,0]=4 1735 B12R1.1095 Cc1nc(c(c(n1)Cl)SCF)Cl 62a_100012456929_100015361967 [0,2,0,0,0,0|2,0,0]=4 1736 B12R1.1095 Cc1nc(c(c(n1)Cl)SCF)Cl 62a_100015361967_100012456929 [0,2,0,0,0,0|2,0,0]=4 1737 B12R1.1095 Nc1nc(c(c(n1)O)SCF)N 62a_200009812812_100015361967 [0,2,0,0,0,0|2,0,0]=4 1738 B12R1.1095 [13CH3]OCc1c(nc(nc1Cl)Cl)Cl 7a_200010247266_200025704644 [0,2,0,0,0,0|2,0,0]=4 1739 B12R1.1123 CCSc1cc(c(nc1N)C)Br 62a_100000210202_100000684678 [0,2,0,0,0,0|2,0,0]=4 1740 B12R1.1123 CCSc1cc(c(nc1N)C)Br 62a_100000684678_100000210202 [0,2,0,0,0,0|2,0,0]=4 1741 B12R1.1123 CCSc1cc(c(nc1N)C)C 62a_100000210202_100009990238 [0,2,0,0,0,0|2,0,0]=4 1742 B12R1.1123 CCSc1cc(c(nc1N)C)C 62a_100009990238_100000210202 [0,2,0,0,0,0|2,0,0]=4 1743 B12R1.1123 Cc1cc(c(nc1C)N)SCF 62a_100009990238_100015361967 [0,2,0,0,0,0|2,0,0]=4 1744 B12R1.1123 Cc1cc(c(nc1C)N)SCF 62a_100015361967_100009990238 [0,2,0,0,0,0|2,0,0]=4 1745 B12R1.1123 Cc1nc(c(cc1Br)SCF)N 62a_100000684678_100015361967 [0,2,0,0,0,0|2,0,0]=4 1746 B12R1.1123 Cc1nc(c(cc1Br)SCF)N 62a_100015361967_100000684678 [0,2,0,0,0,0|2,0,0]=4 1747 B12R1.1703 COC(=O)c1cnc(nc1N)O 271570a_203496583355_200009866963 [0,2,0,0,0,0|1,0,1]=4 1748 B12R1.126 Nc1nc(ncc1C(F)(F)F)O 271570a_203496583355_100009956219 [0,2,0,0,0,0|2,0,0]=4 1749 B12R1.452 C=C(C)c1cnc(nc1N)OC 271570a_100000694244_100010218985 [0,2,0,0,0,0|1,0,1]=4 1750 B12R1.654 COc1c(ncc(c1C)CO)C 34a_100000006305_200000210301 [0,2,0,0,0,0|2,0,0]=4 1751 B12R1.654 COc1c(ncc(c1C)CO)C 7a_100000006305_200000210301 [0,2,0,0,0,0|2,0,0]=4 1752 B12R1.654 Cc1ncc(c(c1O[13CH3])C)CO 34a_100000006305_200025704644 [0,2,0,0,0,0|2,0,0]=4 1753 B12R1.654 Cc1ncc(c(c1O[13CH3])C)CO 7a_100000006305_200025704644 [0,2,0,0,0,0|2,0,0]=4 1754 B12R1.48 C=C(C)c1cc(c(cn1)CO)C 271570a_100000694244_100010277336 [0,2,0,0,0,0|2,0,0]=4 1755 B12R1.48 C=C(C)c1cc(c(cn1)CO)N 271570a_100000694244_100009830438 [0,2,0,0,0,0|1,0,0]=3 1756 B12R1.48 C=C(C)c1ccc(c(c1)N)CO 271570a_100000694244_100000718831 [0,2,0,0,0,0|2,0,0]=4 1757 B12R1.48 C=C(C)c1ccc(c(n1)F)CO 271570a_100000694244_100009870654 [0,2,0,0,0,0|2,0,0]=4 1758 B12R1.48 C=C(C)c1ncc(c(n1)N)C#N 271570a_100000694244_100000041447 [0,2,0,0,0,0|1,0,1]=4 1759 B12R1.48 C=C(C)c1ncc(c(n1)N)CO 271570a_100000694244_200009965464 [0,2,0,0,0,0|0,0,0]=2 1760 B12R1.48 C=C(C)c1ncc(c(n1)N)OC 271570a_100000694244_100009886850 [0,2,0,0,0,0|2,0,0]=4 1761 B12R1.48 CN(C)c1ccc(c(n1)F)CO 27a_100102631434_100010065253 [0,2,0,0,0,0|2,0,0]=4 1762 B12R1.48 CN(C)c1ncc(c(n1)N)C#N 27a_100102631434_100000041447 [0,2,0,0,0,0|1,0,1]=4 1763 B12R1.48 CN(C)c1ncc(c(n1)N)CO 27a_100102631434_200009965464 [0,2,0,0,0,0|0,0,0]=2 1764 B12R1.288 C=C=Cc1cc(c(cn1)CO)N 271570a_100015277604_100009830438 [0,2,0,0,0,0|1,0,1]=4 1765 B12R1.288 C=C=Cc1ncc(c(n1)N)CO 271570a_100015277604_200009965464 [0,2,0,0,0,0|0,0,1]=3 1766 B12R1.288 CC=Cc1cc(c(cn1)CO)C 271570a_100016259895_100010277336 [0,2,0,0,0,0|2,0,0]=4 1767 B12R1.288 CC=Cc1cc(c(cn1)CO)N 271570a_100016259895_100009830438 [0,2,0,0,0,0|1,0,0]=3 1768 B12R1.288 CC=Cc1ccc(c(c1)N)CO 271570a_100016259895_100000718831 [0,2,0,0,0,0|2,0,0]=4 1769 B12R1.288 CC=Cc1ccc(c(n1)F)CO 271570a_100016259895_100009870654 [0,2,0,0,0,0|2,0,0]=4 1770 B12R1.288 CC=Cc1ncc(c(n1)N)C#N 271570a_100016259895_100000041447 [0,2,0,0,0,0|1,0,1]=4 1771 B12R1.288 CC=Cc1ncc(c(n1)N)CO 271570a_100016259895_200009965464 [0,2,0,0,0,0|0,0,0]=2 1772 B12R1.288 CC=Cc1ncc(c(n1)N)OC 271570a_100016259895_100009886850 [0,2,0,0,0,0|2,0,0]=4 1773 B12R1.288 CCNc1ccc(c(n1)F)CO 27a_100015525214_100010065253 [0,2,0,0,0,0|2,0,0]=4 1774 B12R1.288 CCNc1ncc(c(n1)N)C#N 27a_100015525214_100000041447 [0,2,0,0,0,0|1,0,1]=4 1775 B12R1.288 CCNc1ncc(c(n1)N)CO 27a_100015525214_200009965464 [0,2,0,0,0,0|0,0,0]=2 1776 B12R1.288 CCSc1cc(c(cn1)CO)C 62a_100000210202_100010277336 [0,2,0,0,0,0|2,0,0]=4 1777 B12R1.288 CCSc1cc(c(cn1)CO)C 62a_100010277336_100000210202 [0,2,0,0,0,0|2,0,0]=4 1778 B12R1.288 CCSc1cc(c(cn1)CO)N 62a_100000210202_100009830438 [0,2,0,0,0,0|1,0,0]=3 1779 B12R1.288 CCSc1cc(c(cn1)CO)N 62a_100009830438_100000210202 [0,2,0,0,0,0|1,0,0]=3 1780 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000210202_100000718831 [0,2,0,0,0,0|2,0,0]=4 1781 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000718831_100000210202 [0,2,0,0,0,0|2,0,0]=4 1782 B12R1.288 CCSc1ccc(c(n1)F)CO 62a_100000210202_100009870654 [0,2,0,0,0,0|2,0,0]=4 1783 B12R1.288 CCSc1ccc(c(n1)F)CO 62a_100009870654_100000210202 [0,2,0,0,0,0|2,0,0]=4 1784 B12R1.288 CCSc1ncc(c(n1)N)C#N 62a_100000210202_100000041447 [0,2,0,0,0,0|1,0,1]=4 1785 B12R1.288 CCSc1ncc(c(n1)N)C#N 62a_100009813519_100000210202 [0,2,0,0,0,0|1,0,1]=4 1786 B12R1.288 CCSc1ncc(c(n1)N)C=O 62a_100000210202_100010726233 [0,2,0,0,0,0|0,0,2]=4 1787 B12R1.288 CCSc1ncc(c(n1)N)C=O 62a_100010726233_100000210202 [0,2,0,0,0,0|0,0,2]=4 1788 B12R1.288 CCSc1ncc(c(n1)N)CO 62a_100000210202_200009965464 [0,2,0,0,0,0|0,0,0]=2 1789 B12R1.288 CCSc1ncc(c(n1)N)CO 62a_200009965464_100000210202 [0,2,0,0,0,0|0,0,0]=2 1790 B12R1.288 CCSc1ncc(c(n1)N)OC 62a_100000210202_100009886850 [0,2,0,0,0,0|2,0,0]=4 1791 B12R1.288 CCSc1ncc(c(n1)N)OC 62a_100009886850_100000210202 [0,2,0,0,0,0|2,0,0]=4 1792 B12R1.288 COc1cnc(nc1N)SCF 62a_100009886850_100015361967 [0,2,0,0,0,0|2,0,0]=4 1793 B12R1.288 COc1cnc(nc1N)SCF 62a_100015361967_100009886850 [0,2,0,0,0,0|2,0,0]=4 1794 B12R1.288 Cc1cc(ncc1CO)SCF 62a_100010277336_100015361967 [0,2,0,0,0,0|2,0,0]=4 1795 B12R1.288 Cc1cc(ncc1CO)SCF 62a_100015361967_100010277336 [0,2,0,0,0,0|2,0,0]=4 1796 B12R1.288 N#Cc1cnc(nc1N)SCF 62a_100009813519_100015361967 [0,2,0,0,0,0|1,0,1]=4 1797 B12R1.288 N#Cc1cnc(nc1N)SCF 62a_100015361967_100000041447 [0,2,0,0,0,0|1,0,1]=4 1798 B12R1.288 Nc1cc(ccc1CO)SCF 62a_100000718831_100015361967 [0,2,0,0,0,0|2,0,0]=4 1799 B12R1.288 Nc1cc(ccc1CO)SCF 62a_100015361967_100000718831 [0,2,0,0,0,0|2,0,0]=4 1800 B12R1.288 Nc1cc(ncc1CO)SCF 62a_100009830438_100015361967 [0,2,0,0,0,0|1,0,0]=3 1801 B12R1.288 Nc1cc(ncc1CO)SCF 62a_100015361967_100009830438 [0,2,0,0,0,0|1,0,0]=3 1802 B12R1.288 Nc1nc(ncc1C=O)SCF 62a_100010726233_100015361967 [0,2,0,0,0,0|0,0,2]=4 1803 B12R1.288 Nc1nc(ncc1C=O)SCF 62a_100015361967_100010726233 [0,2,0,0,0,0|0,0,2]=4 1804 B12R1.288 Nc1nc(ncc1CO)SCF 62a_100015361967_200009965464 [0,2,0,0,0,0|0,0,0]=2 1805 B12R1.288 Nc1nc(ncc1CO)SCF 62a_200009965464_100015361967 [0,2,0,0,0,0|0,0,0]=2 1806 B12R1.288 OCc1ccc(nc1F)SCF 62a_100009870654_100015361967 [0,2,0,0,0,0|2,0,0]=4 1807 B12R1.288 OCc1ccc(nc1F)SCF 62a_100015361967_100009870654 [0,2,0,0,0,0|2,0,0]=4 1808 B12R2.246 Cc1nc(c2c(n1)CCC2)O 271570a_203496583355_100011240833 [0,1,0,1,0,0|2,0,0]=4 1809 B12R2.246 Cc1nc(c2cc[nH]c2n1)O 271570a_203496583355_100000092993 [0,1,0,1,0,0|1,0,1]=4 1810 B12R2.246 Cc1nc(c2cn[nH]c2n1)O 271570a_203496583355_100000745003 [0,1,0,1,0,0|1,0,1]=4 1811 B12R2.246 Nc1nc(nc2c1CCC2)O 271570a_203496583355_100000107085 [0,1,0,1,0,0|2,0,0]=4 1812 B12R2.606 Cc1ncc2c(n1)CN(C2)C 269982a_100020633798_200000210301 [0,1,0,1,0,0|2,0,0]=4 1813 B12R2.606 Cc1ncc2c(n1)CN(C2)[13CH3] 269982a_100020633798_200025704644 [0,1,0,1,0,0|2,0,0]=4 1814 B12R2.606 O=C1Cc2cnc(nc2N1)O 271570a_203496583355_100000086852 [0,1,0,1,0,0|1,0,1]=4 1815 B12R2.1317 Cc1cc(c(cn1)C2CC2)N 271570a_100011220607_100009817891 [0,1,0,1,0,0|2,0,0]=4 1816 B12R2.1317 Cc1ccc(c(n1)N)C2CC2 271570a_100011220607_100009816662 [0,1,0,1,0,0|2,0,0]=4 1817 B12R2.1317 Cc1ncc(c(n1)N)C2CC2 271570a_100011220607_100000684960 [0,1,0,1,0,0|1,0,0]=3 1818 B12R2.1317 Nc1ncc(c(n1)N)C2CC2 271570a_100011220607_200010734216 [0,1,0,1,0,0|2,0,0]=4 1819 B12R2.44 CNc1ncc2c(n1)CCC2 27a_100102657272_100009881048 [0,1,0,1,0,0|2,0,0]=4 1820 B12R2.44 CNc1ncc2cc[nH]c2n1 27a_100102657272_100000059789 [0,1,0,1,0,0|1,0,1]=4 1821 B12R2.44 CNc1ncc2cn[nH]c2n1 27a_100102657272_100000063646 [0,1,0,1,0,0|1,0,1]=4 1822 B12R2.44 CNc1ncc2nc[nH]c2n1 27a_100102657272_100000009038 [0,1,0,1,0,0|2,0,0]=4 1823 B12R2.44 CSc1cc2c(cn1)CCN2 62a_100020639910_200000210301 [0,1,0,1,0,0|2,0,0]=4 1824 B12R2.44 CSc1cc2c(cn1)CCN2 62a_200000210301_100020639910 [0,1,0,1,0,0|2,0,0]=4 1825 B12R2.44 CSc1ncc2c(n1)CCC2 62a_100009881048_200000210301 [0,1,0,1,0,0|2,0,0]=4 1826 B12R2.44 CSc1ncc2c(n1)CCC2 62a_200000210301_100009881048 [0,1,0,1,0,0|2,0,0]=4 1827 B12R2.44 CSc1ncc2cc[nH]c2n1 62a_200000210301_100000059789 [0,1,0,1,0,0|1,0,1]=4 1828 B12R2.44 CSc1ncc2cn[nH]c2n1 62a_200000210301_100000063646 [0,1,0,1,0,0|1,0,1]=4 1829 B12R2.44 CSc1ncc2nc[nH]c2n1 62a_200000210301_100000009038 [0,1,0,1,0,0|2,0,0]=4 1830 B12R2.44 [13CH3]Sc1cc2c(cn1)CCN2 62a_100020639910_200025704644 [0,1,0,1,0,0|2,0,0]=4 1831 B12R2.44 [13CH3]Sc1cc2c(cn1)CCN2 62a_200025704644_100020639910 [0,1,0,1,0,0|2,0,0]=4 1832 B12R2.44 [13CH3]Sc1ncc2c(n1)CCC2 62a_100009881048_200025704644 [0,1,0,1,0,0|2,0,0]=4 1833 B12R2.44 [13CH3]Sc1ncc2c(n1)CCC2 62a_200025704644_100009881048 [0,1,0,1,0,0|2,0,0]=4 1834 B12R2.44 [13CH3]Sc1ncc2cc[nH]c2n1 62a_200025704644_100000059789 [0,1,0,1,0,0|1,0,1]=4 1835 B12R2.44 [13CH3]Sc1ncc2cn[nH]c2n1 62a_200025704644_100000063646 [0,1,0,1,0,0|1,0,1]=4 1836 B12R2.44 [13CH3]Sc1ncc2nc[nH]c2n1 62a_200025704644_100000009038 [0,1,0,1,0,0|2,0,0]=4 1837 B8R1.1 CCc1nc(no1)C 270196a_100000212224_100000210414 [1,0,0,0,1,0|2,0,0]=4 1838 B8R1.1 Cc1noc(n1)CO 270196a_100000212224_100000210174 [1,0,0,0,1,0|1,0,0]=3 1839 B8R1.1 Cn1cc(nn1)CO 274090a_200000210301_100000210247 [1,0,0,0,1,0|2,0,0]=4 1840 B8R1.1 OCc1cnc(s1)O 271570a_203496583355_100009816753 [1,0,0,0,1,0|2,0,0]=4 1841 B8R1.1 OCc1csc(n1)O 271570a_203496583355_100009816749 [1,0,0,0,1,0|2,0,0]=4 1842 B8R1.1 [13CH3]n1cc(nn1)CO 274090a_200025704644_100000210247 [1,0,0,0,1,0|2,0,0]=4 1843 B8R1.11 OCc1ccsc1O 271570a_203496583355_100009816922 [1,0,0,0,1,0|2,0,0]=4 1844 B8R1.11 OCc1cscc1O 271570a_203496583355_100000724555 [1,0,0,0,1,0|2,0,0]=4 1845 B8R1.11 OCc1scnc1O 271570a_203496583355_100012000948 [1,0,0,0,1,0|2,0,0]=4 1846 B8R1.18 Cc1cc(c(s1)C)O 271570a_203496583355_100000688054 [1,0,0,0,1,0|2,0,0]=4 1847 B8R1.18 Cc1cc(c(s1)O)C 271570a_203496583355_100000689295 [1,0,0,0,1,0|2,0,0]=4 1848 B8R1.18 Cc1cc(n(n1)C)O 271570a_203496583355_100009818511 [1,0,0,0,1,0|2,0,0]=4 1849 B8R1.18 Cc1cn(c(n1)O)C 271570a_203496583355_100009816808 [1,0,0,0,1,0|2,0,0]=4 1850 B8R1.18 Cc1cn(nc1O)C 271570a_203496583355_100012644376 [1,0,0,0,1,0|2,0,0]=4 1851 B8R1.18 Cc1nc(c(s1)C)O 271570a_203496583355_100010270876 [1,0,0,0,1,0|2,0,0]=4 1852 B8R1.18 Cc1nc(c(s1)O)C 271570a_203496583355_100009814099 [1,0,0,0,1,0|2,0,0]=4 1853 B8R1.18 Cc1nn(cc1O)C 271570a_203496583355_100011996311 [1,0,0,0,1,0|2,0,0]=4 1854 B8R1.18 Cc1nn(nc1O)C 271570a_203496583355_200009884731 [1,0,0,0,1,0|2,0,0]=4 1855 B8R1.18 Cn1cc(c(n1)N)O 271570a_203496583355_100010776223 [1,0,0,0,1,0|1,0,0]=3 1856 B8R1.18 Cn1cc(nc1N)O 271570a_203496583355_100025756272 [1,0,0,0,1,0|2,0,0]=4 1857 B8R1.18 Cn1nc(nc1N)O 271570a_203496583355_200010296169 [1,0,0,0,1,0|2,0,0]=4 1858 B8R1.50 Cc1c(cnn1C)O 271570a_203496583355_100000722751 [1,0,0,0,1,0|2,0,0]=4 1859 B8R1.50 Cc1n[nH]c(c1O)C 271570a_203496583355_100000238710 [1,0,0,0,1,0|2,0,0]=4 1860 B8R1.50 Cc1ncc(n1C)O 271570a_203496583355_100000762843 [1,0,0,0,1,0|2,0,0]=4 1861 B8R1.50 Cc1noc(c1O)C 271570a_203496583355_100000694658 [1,0,0,0,1,0|2,0,0]=4 1862 B8R1.50 Cc1scc(c1C)O 271570a_203496583355_100009820295 [1,0,0,0,1,0|2,0,0]=4 1863 B8R1.50 Cn1ncc(c1F)O 271570a_203496583355_200011161937 [1,0,0,0,1,0|2,0,0]=4