0 B11R1.266 C=C(C)c1cc(ccn1)CC 271570a_100000694244_100009817561 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.266 C=C(C)c1cc(ncn1)CC 271570a_100000694244_100000744278 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.266 C=C(C)c1cc(ncn1)CO 271570a_100000694244_100000731546 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.266 C=C(C)c1cc(ncn1)NC 271570a_100000694244_100000756605 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.266 C=C(C)c1cc(ncn1)OC 271570a_100000694244_100012187182 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.266 C=C(C)c1cc(ncn1)SC 271570a_100000694244_100011443430 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.266 C=C(C)c1cccc(c1)CC 271570a_100000694244_100000684523 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.266 C=C(C)c1cccc(c1)CF 271570a_100000694244_100010878472 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.266 C=C(C)c1cccc(c1)CN 271570a_100000694244_100000106179 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.266 C=C(C)c1cccc(c1)CO 271570a_100000694244_100000687537 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.266 C=C(C)c1cccc(c1)NC 271570a_100000694244_100000219648 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.266 C=C(C)c1cccc(c1)OC 271570a_100000694244_100000170001 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.266 C=C(C)c1cccc(c1)SC 271570a_100000694244_100011215954 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.266 C=C(C)c1cccc(c1)SC 62a_100012123953_200000210301 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.266 C=C(C)c1cccc(c1)SC 62a_200000210301_100012123953 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_100012123953_200025704644 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.266 C=C(C)c1cccc(c1)S[13CH3] 62a_200025704644_100012123953 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.266 C=C(C)c1cccc(n1)CC 271570a_100000694244_100009856026 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.266 C=C(C)c1ccnc(c1)C#N 271570a_100000694244_100000685610 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.266 C=C(C)c1ccnc(c1)C=O 271570a_100000694244_100011998288 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.266 C=C(C)c1ccnc(c1)CC 271570a_100000694244_100009820011 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.266 C=C(C)c1ccnc(c1)CN 271570a_100000694244_100000085674 [0,0,0,0,0,0|3,0,0]=3 22 B11R1.266 C=C(C)c1ccnc(c1)CO 271570a_100000694244_100009819072 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.266 C=C(C)c1ccnc(c1)NC 271570a_100000694244_100009819592 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.266 C=C(C)c1ccnc(c1)NN 271570a_100000694244_100000764631 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.266 C=C(C)c1ccnc(c1)OC 271570a_100000694244_100000117307 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.266 C=C(C)c1ccnc(n1)NC 271570a_100000694244_100012000420 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.266 C=C(C)c1ccnc(n1)OC 271570a_100000694244_100000069072 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.266 C=C(C)c1ccnc(n1)SC 271570a_100000694244_100000032126 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.266 C=C(C)c1cncc(c1)CC 271570a_100000694244_200009819073 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.266 C=Cc1cc(ccn1)C(=O)C 271570a_100011290941_100000685609 [0,0,0,0,0,0|1,1,2]=4 31 B11R1.266 C=Cc1cc(ccn1)C(=O)N 271570a_100011290941_100000229836 [0,0,0,0,0,0|0,1,2]=3 32 B11R1.266 C=Cc1cc(cnn1)C(=O)N 271570a_100011290941_100015785749 [0,0,0,0,0,0|1,1,2]=4 33 B11R1.266 C=Cc1cc(ncn1)C(=O)N 271570a_100011290941_100000725265 [0,0,0,0,0,0|1,1,2]=4 34 B11R1.266 C=Cc1cccc(c1)C(=O)N 271570a_100011290941_100000162208 [0,0,0,0,0,0|1,1,2]=4 35 B11R1.266 C=Cc1nccc(n1)C(=O)N 271570a_100011290941_100000066158 [0,0,0,0,0,0|1,1,2]=4 36 B11R1.266 CC(=O)c1cccc(c1)CO 1458a_100000746274_200000210301 [0,0,0,0,0,0|3,1,0]=4 37 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 34a_100000211620_200025704644 [0,0,0,0,0,0|3,1,0]=4 38 B11R1.266 CC(=O)c1cccc(c1)O[13CH3] 7a_100000211620_200025704644 [0,0,0,0,0,0|3,1,0]=4 39 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_100000210093_200025704644 [0,0,0,0,0,0|3,1,0]=4 40 B11R1.266 CC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000210093 [0,0,0,0,0,0|3,1,0]=4 41 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_100000685609_200025704644 [0,0,0,0,0,0|2,1,0]=3 42 B11R1.266 CC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000685609 [0,0,0,0,0,0|2,1,0]=3 43 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_100010643186_200025704644 [0,0,0,0,0,0|3,1,0]=4 44 B11R1.266 CC(=O)c1ccnc(n1)S[13CH3] 62a_200025704644_100010643186 [0,0,0,0,0,0|3,1,0]=4 45 B11R1.266 CC(C)c1ccnc(c1)S[13CH3] 62a_100010237925_200025704644 [0,0,0,0,0,0|3,0,1]=4 46 B11R1.266 CC(C)c1ccnc(c1)S[13CH3] 62a_200025704644_100010237925 [0,0,0,0,0,0|3,0,1]=4 47 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 34a_100000740644_200025704644 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.266 CC(N)c1cccc(c1)O[13CH3] 7a_100000740644_200025704644 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_100020642005_200025704644 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.266 CC(N)c1cccc(c1)S[13CH3] 62a_200025704644_100020642005 [0,0,0,0,0,0|3,0,1]=4 51 B11R1.266 CCc1cc(ccn1)N(C)C 27a_100102631434_100009820011 [0,0,0,0,0,0|3,0,0]=3 52 B11R1.266 CCc1cc(ncn1)N(C)C 27a_100102631434_100000744278 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.266 CCc1cccc(c1)C(=O)C 1458a_100011933908_200000210301 [0,0,0,0,0,0|2,1,0]=3 54 B11R1.266 CCc1cccc(c1)C(=O)[13CH3] 1458a_100011933908_200025704644 [0,0,0,0,0,0|2,1,0]=3 55 B11R1.266 CN(C)c1ccnc(c1)CO 27a_100102631434_100000748867 [0,0,0,0,0,0|4,0,0]=4 56 B11R1.266 CN(C)c1ccnc(c1)S[13CH3] 62a_100000766659_200025704644 [0,0,0,0,0,0|4,0,0]=4 57 B11R1.266 CN(C)c1ccnc(c1)S[13CH3] 62a_200025704644_100000766659 [0,0,0,0,0,0|4,0,0]=4 58 B11R1.266 CNc1cc(ccn1)C(C)C 27a_100102657272_100010237925 [0,0,0,0,0,0|3,0,1]=4 59 B11R1.266 CNc1cc(ccn1)C(F)F 27a_100102657272_100009884414 [0,0,0,0,0,0|3,0,1]=4 60 B11R1.266 CNc1cc(cnn1)C(=O)N 27a_100102657272_100015785749 [0,0,0,0,0,0|2,1,0]=3 61 B11R1.266 CNc1cc(ncn1)C(=O)N 27a_100102657272_100000725265 [0,0,0,0,0,0|2,1,0]=3 62 B11R1.266 CNc1cccc(c1)C(=O)N 34a_100000217337_200000210301 [0,0,0,0,0,0|2,1,0]=3 63 B11R1.266 CNc1cccc(n1)C(=O)N 27a_100102657272_100011834053 [0,0,0,0,0,0|3,1,0]=4 64 B11R1.266 CNc1ccnc(c1)C(=O)N 27a_100102657272_100000229564 [0,0,0,0,0,0|3,1,0]=4 65 B11R1.266 CNc1nccc(n1)C(=O)C 27a_100102657272_100010643186 [0,0,0,0,0,0|3,1,0]=4 66 B11R1.266 CNc1nccc(n1)C(=O)N 27a_100102657272_100000066158 [0,0,0,0,0,0|2,1,0]=3 67 B11R1.266 COc1cccc(c1)C(=O)C 1458a_100000188888_200000210301 [0,0,0,0,0,0|3,1,0]=4 68 B11R1.266 COc1cccc(c1)C(=O)C 34a_100000211620_200000210301 [0,0,0,0,0,0|3,1,0]=4 69 B11R1.266 COc1cccc(c1)C(=O)C 7a_100000211620_200000210301 [0,0,0,0,0,0|3,1,0]=4 70 B11R1.266 COc1cccc(c1)C(=O)N 34a_100000162170_200000210301 [0,0,0,0,0,0|2,1,0]=3 71 B11R1.266 COc1cccc(c1)C(=O)N 7a_100000162170_200000210301 [0,0,0,0,0,0|2,1,0]=3 72 B11R1.266 COc1cccc(c1)C(=O)[13CH3] 1458a_100000188888_200025704644 [0,0,0,0,0,0|3,1,0]=4 73 B11R1.266 COc1cccc(c1)C(=S)N 7a_100000738086_200000210301 [0,0,0,0,0,0|2,0,0]=2 74 B11R1.266 COc1cccc(c1)C(C)N 34a_100000740644_200000210301 [0,0,0,0,0,0|3,0,1]=4 75 B11R1.266 COc1cccc(c1)C(C)N 7a_100000740644_200000210301 [0,0,0,0,0,0|3,0,1]=4 76 B11R1.266 COc1cncc(c1)C(=O)N 7a_100000698036_200000210301 [0,0,0,0,0,0|3,1,0]=4 77 B11R1.266 CSc1cc(ccn1)B(O)O 62a_100000049459_200000210301 [0,0,0,0,0,0|3,1,0]=4 78 B11R1.266 CSc1cc(ccn1)B(O)O 62a_200000210301_100000049459 [0,0,0,0,0,0|3,1,0]=4 79 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_100000685609_200000210301 [0,0,0,0,0,0|2,1,0]=3 80 B11R1.266 CSc1cc(ccn1)C(=O)C 62a_200000210301_100000685609 [0,0,0,0,0,0|2,1,0]=3 81 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_100000229836_200000210301 [0,0,0,0,0,0|1,1,0]=2 82 B11R1.266 CSc1cc(ccn1)C(=O)N 62a_200000210301_100000229836 [0,0,0,0,0,0|1,1,0]=2 83 B11R1.266 CSc1cc(ccn1)C(C)C 62a_100010237925_200000210301 [0,0,0,0,0,0|3,0,1]=4 84 B11R1.266 CSc1cc(ccn1)C(C)C 62a_200000210301_100010237925 [0,0,0,0,0,0|3,0,1]=4 85 B11R1.266 CSc1cc(ccn1)C(F)F 62a_100009884414_200000210301 [0,0,0,0,0,0|3,0,1]=4 86 B11R1.266 CSc1cc(ccn1)C(F)F 62a_200000210301_100009884414 [0,0,0,0,0,0|3,0,1]=4 87 B11R1.266 CSc1cc(ccn1)N(C)C 62a_100000766659_200000210301 [0,0,0,0,0,0|4,0,0]=4 88 B11R1.266 CSc1cc(ccn1)N(C)C 62a_200000210301_100000766659 [0,0,0,0,0,0|4,0,0]=4 89 B11R1.266 CSc1cc(cnn1)C(=O)N 62a_100015785749_200000210301 [0,0,0,0,0,0|2,1,0]=3 90 B11R1.266 CSc1cc(cnn1)C(=O)N 62a_200000210301_100015785749 [0,0,0,0,0,0|2,1,0]=3 91 B11R1.266 CSc1cc(ncn1)C(=O)N 62a_100000725265_200000210301 [0,0,0,0,0,0|2,1,0]=3 92 B11R1.266 CSc1cc(ncn1)C(=O)N 62a_200000210301_100000725265 [0,0,0,0,0,0|2,1,0]=3 93 B11R1.266 CSc1cccc(c1)C(=O)C 1458a_100011217804_200000210301 [0,0,0,0,0,0|3,1,0]=4 94 B11R1.266 CSc1cccc(c1)C(=O)C 62a_100000210093_200000210301 [0,0,0,0,0,0|3,1,0]=4 95 B11R1.266 CSc1cccc(c1)C(=O)C 62a_200000210301_100000210093 [0,0,0,0,0,0|3,1,0]=4 96 B11R1.266 CSc1cccc(c1)C(=O)N 62a_100000162208_200000210301 [0,0,0,0,0,0|2,1,0]=3 97 B11R1.266 CSc1cccc(c1)C(=O)N 62a_200000210301_100000162208 [0,0,0,0,0,0|2,1,0]=3 98 B11R1.266 CSc1cccc(c1)C(=O)[13CH3] 1458a_100011217804_200025704644 [0,0,0,0,0,0|3,1,0]=4 99 B11R1.266 CSc1cccc(c1)C(C)N 62a_100020642005_200000210301 [0,0,0,0,0,0|3,0,1]=4 100 B11R1.266 CSc1cccc(c1)C(C)N 62a_200000210301_100020642005 [0,0,0,0,0,0|3,0,1]=4 101 B11R1.266 CSc1cccc(n1)C(=O)N 62a_100011834053_200000210301 [0,0,0,0,0,0|3,1,0]=4 102 B11R1.266 CSc1cccc(n1)C(=O)N 62a_200000210301_100011834053 [0,0,0,0,0,0|3,1,0]=4 103 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_100000229564_200000210301 [0,0,0,0,0,0|3,1,0]=4 104 B11R1.266 CSc1ccnc(c1)C(=O)N 62a_200000210301_100000229564 [0,0,0,0,0,0|3,1,0]=4 105 B11R1.266 CSc1cncc(c1)C(=O)N 62a_100000162242_200000210301 [0,0,0,0,0,0|3,1,0]=4 106 B11R1.266 CSc1cncc(c1)C(=O)N 62a_200000210301_100000162242 [0,0,0,0,0,0|3,1,0]=4 107 B11R1.266 CSc1nccc(n1)C(=O)C 62a_100010643186_200000210301 [0,0,0,0,0,0|3,1,0]=4 108 B11R1.266 CSc1nccc(n1)C(=O)C 62a_200000210301_100010643186 [0,0,0,0,0,0|3,1,0]=4 109 B11R1.266 CSc1nccc(n1)C(=O)N 62a_100000066158_200000210301 [0,0,0,0,0,0|2,1,0]=3 110 B11R1.266 CSc1nccc(n1)C(=O)N 62a_200000210301_100000066158 [0,0,0,0,0,0|2,1,0]=3 111 B11R1.266 [13CH3]C(=O)c1cccc(c1)CO 1458a_100000746274_200025704644 [0,0,0,0,0,0|3,1,0]=4 112 B11R1.266 [13CH3]Nc1cccc(c1)C(=O)N 34a_100000217337_200025704644 [0,0,0,0,0,0|2,1,0]=3 113 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 34a_100000162170_200025704644 [0,0,0,0,0,0|2,1,0]=3 114 B11R1.266 [13CH3]Oc1cccc(c1)C(=O)N 7a_100000162170_200025704644 [0,0,0,0,0,0|2,1,0]=3 115 B11R1.266 [13CH3]Oc1cccc(c1)C(=S)N 7a_100000738086_200025704644 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.266 [13CH3]Oc1cncc(c1)C(=O)N 7a_100000698036_200025704644 [0,0,0,0,0,0|3,1,0]=4 117 B11R1.266 [13CH3]Sc1cc(ccn1)B(O)O 62a_100000049459_200025704644 [0,0,0,0,0,0|3,1,0]=4 118 B11R1.266 [13CH3]Sc1cc(ccn1)B(O)O 62a_200025704644_100000049459 [0,0,0,0,0,0|3,1,0]=4 119 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_100000229836_200025704644 [0,0,0,0,0,0|1,1,0]=2 120 B11R1.266 [13CH3]Sc1cc(ccn1)C(=O)N 62a_200025704644_100000229836 [0,0,0,0,0,0|1,1,0]=2 121 B11R1.266 [13CH3]Sc1cc(ccn1)C(F)F 62a_100009884414_200025704644 [0,0,0,0,0,0|3,0,1]=4 122 B11R1.266 [13CH3]Sc1cc(ccn1)C(F)F 62a_200025704644_100009884414 [0,0,0,0,0,0|3,0,1]=4 123 B11R1.266 [13CH3]Sc1cc(cnn1)C(=O)N 62a_100015785749_200025704644 [0,0,0,0,0,0|2,1,0]=3 124 B11R1.266 [13CH3]Sc1cc(cnn1)C(=O)N 62a_200025704644_100015785749 [0,0,0,0,0,0|2,1,0]=3 125 B11R1.266 [13CH3]Sc1cc(ncn1)C(=O)N 62a_100000725265_200025704644 [0,0,0,0,0,0|2,1,0]=3 126 B11R1.266 [13CH3]Sc1cc(ncn1)C(=O)N 62a_200025704644_100000725265 [0,0,0,0,0,0|2,1,0]=3 127 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_100000162208_200025704644 [0,0,0,0,0,0|2,1,0]=3 128 B11R1.266 [13CH3]Sc1cccc(c1)C(=O)N 62a_200025704644_100000162208 [0,0,0,0,0,0|2,1,0]=3 129 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_100011834053_200025704644 [0,0,0,0,0,0|3,1,0]=4 130 B11R1.266 [13CH3]Sc1cccc(n1)C(=O)N 62a_200025704644_100011834053 [0,0,0,0,0,0|3,1,0]=4 131 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_100000229564_200025704644 [0,0,0,0,0,0|3,1,0]=4 132 B11R1.266 [13CH3]Sc1ccnc(c1)C(=O)N 62a_200025704644_100000229564 [0,0,0,0,0,0|3,1,0]=4 133 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_100000162242_200025704644 [0,0,0,0,0,0|3,1,0]=4 134 B11R1.266 [13CH3]Sc1cncc(c1)C(=O)N 62a_200025704644_100000162242 [0,0,0,0,0,0|3,1,0]=4 135 B11R1.266 [13CH3]Sc1nccc(n1)C(=O)N 62a_100000066158_200025704644 [0,0,0,0,0,0|2,1,0]=3 136 B11R1.266 [13CH3]Sc1nccc(n1)C(=O)N 62a_200025704644_100000066158 [0,0,0,0,0,0|2,1,0]=3 137 B10R1.113 C=C(C)c1cc(ncn1)C 271570a_100000694244_100000744208 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.113 C=C(C)c1cccc(c1)C 271570a_100000694244_100011215228 [1,0,0,0,0,0|3,0,0]=4 139 B10R1.113 C=C(C)c1ccnc(c1)Br 271570a_100000694244_100009814637 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.113 C=C(C)c1ccnc(c1)C 271570a_100000694244_100000758586 [1,0,0,0,0,0|2,0,0]=3 141 B10R1.113 C=C(C)c1ccnc(c1)Cl 271570a_100000694244_100000035001 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.113 C=C(C)c1ccnc(c1)F 271570a_100000694244_100009816116 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.113 C=C(C)c1ccnc(c1)N 271570a_100000694244_100000744379 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.113 C=C(C)c1ccnc(n1)C 271570a_100000694244_100000749937 [1,0,0,0,0,0|3,0,0]=4 145 B10R1.113 CC(=O)c1cccc(c1)C 1458a_100000189346_200000210301 [1,0,0,0,0,0|2,1,0]=4 146 B10R1.113 CC(=O)c1ccnc(c1)O 271570a_203496583355_100000685609 [1,0,0,0,0,0|2,1,0]=4 147 B10R1.113 Cc1cc(ccn1)N(C)C 27a_100102631434_100000758586 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.113 Cc1cccc(c1)C(=O)[13CH3] 1458a_100000189346_200025704644 [1,0,0,0,0,0|2,1,0]=4 149 B10R1.113 NC(=O)c1cc(ncn1)O 271570a_203496583355_100000725265 [1,0,0,0,0,0|2,1,0]=4 150 B10R1.113 NC(=O)c1cccc(c1)O 271570a_203496583355_100000162208 [1,0,0,0,0,0|2,1,0]=4 151 B10R1.113 NC(=O)c1ccnc(c1)O 271570a_203496583355_100000229836 [1,0,0,0,0,0|1,1,0]=3 152 B10R1.113 NC(=O)c1ccnc(n1)O 271570a_203496583355_100000066158 [1,0,0,0,0,0|2,1,0]=4 153 B10R1.113 NC(=O)c1cnnc(c1)O 271570a_203496583355_100015785749 [1,0,0,0,0,0|2,1,0]=4 154 B10R1.172 C=Cc1cc(ccn1)C=O 271570a_100011290941_100011290808 [1,0,0,0,0,0|0,1,2]=4 155 B10R1.172 C=Cc1cc(ccn1)CC 271570a_100011290941_100009817561 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.172 C=Cc1cc(ncn1)CC 271570a_100011290941_100000744278 [1,0,0,0,0,0|2,0,0]=3 157 B10R1.172 C=Cc1cc(ncn1)CO 271570a_100011290941_100000731546 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.172 C=Cc1cc(ncn1)NC 271570a_100011290941_100000756605 [1,0,0,0,0,0|3,0,0]=4 159 B10R1.172 C=Cc1cc(ncn1)OC 271570a_100011290941_100012187182 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.172 C=Cc1cc(ncn1)SC 271570a_100011290941_100011443430 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [1,0,0,0,0,0|2,0,0]=3 162 B10R1.172 C=Cc1cccc(c1)CF 271570a_100011290941_100010878472 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.172 C=Cc1cccc(c1)CN 271570a_100011290941_100000106179 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.172 C=Cc1cccc(c1)CO 271570a_100011290941_100000687537 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.172 C=Cc1cccc(c1)NC 271570a_100011290941_100000219648 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.172 C=Cc1cccc(c1)NC 34a_100011827668_200000210301 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.172 C=Cc1cccc(c1)N[13CH3] 34a_100011827668_200025704644 [1,0,0,0,0,0|3,0,0]=4 168 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [1,0,0,0,0,0|3,0,0]=4 169 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [1,0,0,0,0,0|3,0,0]=4 170 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.172 C=Cc1cccc(c1)SC 271570a_100011290941_100011215954 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.172 C=Cc1cccc(c1)SC 62a_100011215241_200000210301 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.172 C=Cc1cccc(c1)SC 62a_200000210301_100011215241 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_100011215241_200025704644 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.172 C=Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215241 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.172 C=Cc1cccc(n1)CC 271570a_100011290941_100009856026 [1,0,0,0,0,0|3,0,0]=4 179 B10R1.172 C=Cc1ccnc(c1)C#N 271570a_100011290941_100000685610 [1,0,0,0,0,0|2,0,1]=4 180 B10R1.172 C=Cc1ccnc(c1)C=O 271570a_100011290941_100011998288 [1,0,0,0,0,0|2,0,1]=4 181 B10R1.172 C=Cc1ccnc(c1)CC 271570a_100011290941_100009820011 [1,0,0,0,0,0|1,0,0]=2 182 B10R1.172 C=Cc1ccnc(c1)CN 271570a_100011290941_100000085674 [1,0,0,0,0,0|2,0,0]=3 183 B10R1.172 C=Cc1ccnc(c1)CO 271570a_100011290941_100009819072 [1,0,0,0,0,0|2,0,0]=3 184 B10R1.172 C=Cc1ccnc(c1)NC 271570a_100011290941_100009819592 [1,0,0,0,0,0|2,0,0]=3 185 B10R1.172 C=Cc1ccnc(c1)NN 271570a_100011290941_100000764631 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.172 C=Cc1ccnc(c1)OC 271570a_100011290941_100000117307 [1,0,0,0,0,0|2,0,0]=3 187 B10R1.172 C=Cc1ccnc(n1)NC 271570a_100011290941_100012000420 [1,0,0,0,0,0|3,0,0]=4 188 B10R1.172 C=Cc1ccnc(n1)OC 271570a_100011290941_100000069072 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.172 C=Cc1ccnc(n1)SC 271570a_100011290941_100000032126 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.172 C=Cc1cncc(c1)CC 271570a_100011290941_200009819073 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.172 CCc1cc(ccn1)NC 27a_100102657272_100009820011 [1,0,0,0,0,0|2,0,0]=3 192 B10R1.172 CCc1cc(ccn1)SC 62a_100009820011_200000210301 [1,0,0,0,0,0|2,0,0]=3 193 B10R1.172 CCc1cc(ccn1)SC 62a_200000210301_100009820011 [1,0,0,0,0,0|2,0,0]=3 194 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_100009820011_200025704644 [1,0,0,0,0,0|2,0,0]=3 195 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_200025704644_100009820011 [1,0,0,0,0,0|2,0,0]=3 196 B10R1.172 CCc1cc(ncn1)NC 27a_100102657272_100000744278 [1,0,0,0,0,0|3,0,0]=4 197 B10R1.172 CCc1cc(ncn1)SC 62a_100000744278_200000210301 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.172 CCc1cc(ncn1)SC 62a_200000210301_100000744278 [1,0,0,0,0,0|3,0,0]=4 199 B10R1.172 CCc1cc(ncn1)S[13CH3] 62a_100000744278_200025704644 [1,0,0,0,0,0|3,0,0]=4 200 B10R1.172 CCc1cc(ncn1)S[13CH3] 62a_200025704644_100000744278 [1,0,0,0,0,0|3,0,0]=4 201 B10R1.172 CCc1cccc(c1)NC 2230a_100000211250_200000210301 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.172 CCc1cccc(c1)NC 34a_100000211250_200000210301 [1,0,0,0,0,0|3,0,0]=4 203 B10R1.172 CCc1cccc(c1)NC 7a_100000211250_200000210301 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.172 CCc1cccc(c1)N[13CH3] 2230a_100000211250_200025704644 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.172 CCc1cccc(c1)N[13CH3] 34a_100000211250_200025704644 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.172 CCc1cccc(c1)N[13CH3] 7a_100000211250_200025704644 [1,0,0,0,0,0|3,0,0]=4 207 B10R1.172 CCc1cccc(c1)OC 34a_100000211550_200000210301 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.172 CCc1cccc(c1)OC 7a_100000211550_200000210301 [1,0,0,0,0,0|3,0,0]=4 209 B10R1.172 CCc1cccc(c1)O[13CH3] 34a_100000211550_200025704644 [1,0,0,0,0,0|3,0,0]=4 210 B10R1.172 CCc1cccc(c1)O[13CH3] 7a_100000211550_200025704644 [1,0,0,0,0,0|3,0,0]=4 211 B10R1.172 CCc1cccc(c1)SC 62a_100011263222_200000210301 [1,0,0,0,0,0|3,0,0]=4 212 B10R1.172 CCc1cccc(c1)SC 62a_200000210301_100011263222 [1,0,0,0,0,0|3,0,0]=4 213 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_100011263222_200025704644 [1,0,0,0,0,0|3,0,0]=4 214 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_200025704644_100011263222 [1,0,0,0,0,0|3,0,0]=4 215 B10R1.172 CCc1ccnc(c1)NC 27a_100102657272_100009817561 [1,0,0,0,0,0|2,0,1]=4 216 B10R1.172 CCc1ccnc(c1)SC 62a_100009817561_200000210301 [1,0,0,0,0,0|2,0,1]=4 217 B10R1.172 CCc1ccnc(c1)SC 62a_200000210301_100009817561 [1,0,0,0,0,0|2,0,1]=4 218 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_100009817561_200025704644 [1,0,0,0,0,0|2,0,1]=4 219 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_200025704644_100009817561 [1,0,0,0,0,0|2,0,1]=4 220 B10R1.172 CNc1cc(ccn1)C#N 27a_100102657272_100011291639 [1,0,0,0,0,0|1,0,2]=4 221 B10R1.172 CNc1cc(ccn1)SC 62a_100009819592_200000210301 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.172 CNc1cc(ccn1)SC 62a_200000210301_100009819592 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.172 CNc1cc(ccn1)S[13CH3] 62a_100009819592_200025704644 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.172 CNc1cc(ccn1)S[13CH3] 62a_200025704644_100009819592 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.172 CNc1cc(ncn1)NN 27a_100102657272_100000242035 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.172 CNc1ccnc(c1)CO 27a_100102657272_100000748867 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.172 CNc1ccnc(c1)SC 62a_100009869472_200000210301 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.172 CNc1ccnc(c1)SC 62a_200000210301_100009869472 [1,0,0,0,0,0|3,0,0]=4 229 B10R1.172 CNc1ccnc(c1)S[13CH3] 62a_100009869472_200025704644 [1,0,0,0,0,0|3,0,0]=4 230 B10R1.172 CNc1ccnc(c1)S[13CH3] 62a_200025704644_100009869472 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.172 COc1cc(ccn1)CN 34a_100000748557_200000210301 [1,0,0,0,0,0|1,0,1]=3 232 B10R1.172 COc1cc(ccn1)O[13CH3] 34a_100012181050_200025704644 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.172 COc1cc(ccn1)SC 62a_100000117307_200000210301 [1,0,0,0,0,0|3,0,0]=4 234 B10R1.172 COc1cc(ccn1)SC 62a_200000210301_100000117307 [1,0,0,0,0,0|3,0,0]=4 235 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_100000117307_200025704644 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_200025704644_100000117307 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.172 COc1cccc(c1)CN 34a_100000743036_200000210301 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.172 COc1ccnc(c1)OC 34a_100012181050_200000210301 [1,0,0,0,0,0|3,0,0]=4 239 B10R1.172 COc1ccnc(c1)SC 62a_100009817693_200000210301 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.172 COc1ccnc(c1)SC 62a_200000210301_100011216251 [1,0,0,0,0,0|3,0,0]=4 241 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_100009817693_200025704644 [1,0,0,0,0,0|3,0,0]=4 242 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_200025704644_100011216251 [1,0,0,0,0,0|3,0,0]=4 243 B10R1.172 CSc1cc(ccn1)C#N 62a_200000210301_100011291639 [1,0,0,0,0,0|1,0,2]=4 244 B10R1.172 CSc1cc(ccn1)C=O 62a_100011290808_200000210301 [1,0,0,0,0,0|1,1,0]=3 245 B10R1.172 CSc1cc(ccn1)C=O 62a_200000210301_100011290808 [1,0,0,0,0,0|1,1,0]=3 246 B10R1.172 CSc1cc(ccn1)CN 62a_100025757509_200000210301 [1,0,0,0,0,0|1,0,1]=3 247 B10R1.172 CSc1cc(ccn1)CN 62a_200000210301_100025757509 [1,0,0,0,0,0|1,0,1]=3 248 B10R1.172 CSc1cc(ccn1)CO 62a_100009814636_200000210301 [1,0,0,0,0,0|1,1,1]=4 249 B10R1.172 CSc1cc(ccn1)CO 62a_200000210301_100009814636 [1,0,0,0,0,0|1,1,1]=4 250 B10R1.172 CSc1cc(ccn1)NN 62a_100000089018_200000210301 [1,0,0,0,0,0|2,0,0]=3 251 B10R1.172 CSc1cc(ccn1)NN 62a_200000210301_100000089018 [1,0,0,0,0,0|2,0,0]=3 252 B10R1.172 CSc1cc(ncn1)NN 62a_100000242035_200000210301 [1,0,0,0,0,0|3,0,0]=4 253 B10R1.172 CSc1cc(ncn1)NN 62a_200000210301_100000242035 [1,0,0,0,0,0|3,0,0]=4 254 B10R1.172 CSc1cccc(c1)C=O 62a_100000014684_200000210301 [1,0,0,0,0,0|2,1,0]=4 255 B10R1.172 CSc1cccc(c1)C=O 62a_200000210301_100000014684 [1,0,0,0,0,0|2,1,0]=4 256 B10R1.172 CSc1cccc(c1)CN 62a_100000106179_200000210301 [1,0,0,0,0,0|2,0,1]=4 257 B10R1.172 CSc1cccc(c1)CN 62a_200000210301_100000106179 [1,0,0,0,0,0|2,0,1]=4 258 B10R1.172 CSc1cccc(c1)NN 62a_100000217339_200000210301 [1,0,0,0,0,0|3,0,0]=4 259 B10R1.172 CSc1cccc(c1)NN 62a_200000210301_100000217339 [1,0,0,0,0,0|3,0,0]=4 260 B10R1.172 CSc1ccnc(c1)CN 62a_100000085674_200000210301 [1,0,0,0,0,0|3,0,0]=4 261 B10R1.172 CSc1ccnc(c1)CN 62a_200000210301_100000085674 [1,0,0,0,0,0|3,0,0]=4 262 B10R1.172 CSc1ccnc(c1)CO 62a_100000748867_200000210301 [1,0,0,0,0,0|3,0,0]=4 263 B10R1.172 CSc1ccnc(c1)CO 62a_200000210301_100000748867 [1,0,0,0,0,0|3,0,0]=4 264 B10R1.172 CSc1ccnc(c1)SC 62a_100010883326_200000210301 [1,0,0,0,0,0|3,0,0]=4 265 B10R1.172 CSc1ccnc(c1)SC 62a_200000210301_100010883326 [1,0,0,0,0,0|3,0,0]=4 266 B10R1.172 CSc1ccnc(c1)S[13CH3] 62a_100010883326_200025704644 [1,0,0,0,0,0|3,0,0]=4 267 B10R1.172 CSc1ccnc(c1)S[13CH3] 62a_200025704644_100010883326 [1,0,0,0,0,0|3,0,0]=4 268 B10R1.172 [13CH3]Oc1cc(ccn1)CN 34a_100000748557_200025704644 [1,0,0,0,0,0|1,0,1]=3 269 B10R1.172 [13CH3]Oc1cccc(c1)CN 34a_100000743036_200025704644 [1,0,0,0,0,0|2,0,1]=4 270 B10R1.172 [13CH3]Sc1cc(ccn1)C#N 62a_200025704644_100011291639 [1,0,0,0,0,0|1,0,2]=4 271 B10R1.172 [13CH3]Sc1cc(ccn1)C=O 62a_100011290808_200025704644 [1,0,0,0,0,0|1,1,0]=3 272 B10R1.172 [13CH3]Sc1cc(ccn1)C=O 62a_200025704644_100011290808 [1,0,0,0,0,0|1,1,0]=3 273 B10R1.172 [13CH3]Sc1cc(ccn1)CN 62a_100025757509_200025704644 [1,0,0,0,0,0|1,0,1]=3 274 B10R1.172 [13CH3]Sc1cc(ccn1)CN 62a_200025704644_100025757509 [1,0,0,0,0,0|1,0,1]=3 275 B10R1.172 [13CH3]Sc1cc(ccn1)CO 62a_100009814636_200025704644 [1,0,0,0,0,0|1,1,1]=4 276 B10R1.172 [13CH3]Sc1cc(ccn1)CO 62a_200025704644_100009814636 [1,0,0,0,0,0|1,1,1]=4 277 B10R1.172 [13CH3]Sc1cc(ccn1)NN 62a_100000089018_200025704644 [1,0,0,0,0,0|2,0,0]=3 278 B10R1.172 [13CH3]Sc1cc(ccn1)NN 62a_200025704644_100000089018 [1,0,0,0,0,0|2,0,0]=3 279 B10R1.172 [13CH3]Sc1cc(ncn1)NN 62a_100000242035_200025704644 [1,0,0,0,0,0|3,0,0]=4 280 B10R1.172 [13CH3]Sc1cc(ncn1)NN 62a_200025704644_100000242035 [1,0,0,0,0,0|3,0,0]=4 281 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_100000014684_200025704644 [1,0,0,0,0,0|2,1,0]=4 282 B10R1.172 [13CH3]Sc1cccc(c1)C=O 62a_200025704644_100000014684 [1,0,0,0,0,0|2,1,0]=4 283 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_100000106179_200025704644 [1,0,0,0,0,0|2,0,1]=4 284 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_200025704644_100000106179 [1,0,0,0,0,0|2,0,1]=4 285 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_100000217339_200025704644 [1,0,0,0,0,0|3,0,0]=4 286 B10R1.172 [13CH3]Sc1cccc(c1)NN 62a_200025704644_100000217339 [1,0,0,0,0,0|3,0,0]=4 287 B10R1.172 [13CH3]Sc1ccnc(c1)CN 62a_100000085674_200025704644 [1,0,0,0,0,0|3,0,0]=4 288 B10R1.172 [13CH3]Sc1ccnc(c1)CN 62a_200025704644_100000085674 [1,0,0,0,0,0|3,0,0]=4 289 B10R1.172 [13CH3]Sc1ccnc(c1)CO 62a_100000748867_200025704644 [1,0,0,0,0,0|3,0,0]=4 290 B10R1.172 [13CH3]Sc1ccnc(c1)CO 62a_200025704644_100000748867 [1,0,0,0,0,0|3,0,0]=4 291 B12R1.11 C=C(C)c1cc(cc(c1)CC)N 271570a_100000694244_100010074814 [0,1,0,0,0,0|3,0,0]=4 292 B12R1.11 C=C(C)c1cc(nc(c1)CN)C 271570a_100000694244_100010178683 [0,1,0,0,0,0|3,0,0]=4 293 B12R1.11 C=C(C)c1cc(nc(c1)CO)C 271570a_100000694244_100010178681 [0,1,0,0,0,0|3,0,0]=4 294 B12R1.11 C=C(C)c1cc(nc(c1)OC)C 271570a_100000694244_100010067692 [0,1,0,0,0,0|3,0,0]=4 295 B12R1.11 C=C(C)c1cc(nc(c1)OC)N 271570a_100000694244_100010136845 [0,1,0,0,0,0|3,0,0]=4 296 B12R1.11 C=C(C)c1cc(nc(n1)C)CC 271570a_100000694244_100000761995 [0,1,0,0,0,0|3,0,0]=4 297 B12R1.11 C=C(C)c1cc(nc(n1)CC)C 271570a_100000694244_100000687827 [0,1,0,0,0,0|3,0,0]=4 298 B12R1.11 C=C(C)c1cc(nc(n1)N)CC 271570a_100000694244_100000069509 [0,1,0,0,0,0|3,0,0]=4 299 B12R1.11 CC(=O)c1cc(nc(c1)S[13CH3])C 62a_100009884196_200025704644 [0,1,0,0,0,0|2,1,0]=4 300 B12R1.11 CC(=O)c1cc(nc(c1)S[13CH3])C 62a_200025704644_100009884196 [0,1,0,0,0,0|2,1,0]=4 301 B12R1.11 CNc1cc(cc(c1)C(=O)N)F 34a_200011998915_200000210301 [0,1,0,0,0,0|2,1,0]=4 302 B12R1.11 CNc1cc(cc(c1)C(=O)N)F 7a_200011998915_200000210301 [0,1,0,0,0,0|2,1,0]=4 303 B12R1.11 COc1cc(cc(c1)C(=O)N)Br 34a_100010084318_200000210301 [0,1,0,0,0,0|2,1,0]=4 304 B12R1.11 COc1cc(cc(c1)C(=O)N)Br 7a_100010084318_200000210301 [0,1,0,0,0,0|2,1,0]=4 305 B12R1.11 COc1cc(cc(c1)C(=O)N)O 271570a_203496583355_100010146780 [0,1,0,0,0,0|2,1,0]=4 306 B12R1.11 CSc1cc(cc(c1)C(=O)N)C 62a_200000210301_200012348365 [0,1,0,0,0,0|2,1,0]=4 307 B12R1.11 CSc1cc(cc(c1)C(=O)N)C 62a_200012348365_200000210301 [0,1,0,0,0,0|2,1,0]=4 308 B12R1.11 CSc1cc(cc(c1)C(=O)N)F 62a_200000210301_200011280034 [0,1,0,0,0,0|2,1,0]=4 309 B12R1.11 CSc1cc(cc(c1)C(=O)N)F 62a_200011280034_200000210301 [0,1,0,0,0,0|2,1,0]=4 310 B12R1.11 CSc1cc(cc(c1)C(=O)N)O 62a_100010084318_200000210301 [0,1,0,0,0,0|2,1,0]=4 311 B12R1.11 CSc1cc(cc(c1)C(=O)N)O 62a_200000210301_100010084318 [0,1,0,0,0,0|2,1,0]=4 312 B12R1.11 CSc1cc(cc(n1)C)C(=O)C 62a_100009884196_200000210301 [0,1,0,0,0,0|2,1,0]=4 313 B12R1.11 CSc1cc(cc(n1)C)C(=O)C 62a_200000210301_100009884196 [0,1,0,0,0,0|2,1,0]=4 314 B12R1.11 Cc1cc(cc(c1)C(=O)N)S[13CH3] 62a_200012348365_200025704644 [0,1,0,0,0,0|2,1,0]=4 315 B12R1.11 Cc1cc(cc(c1)C(=O)N)S[13CH3] 62a_200025704644_200012348365 [0,1,0,0,0,0|2,1,0]=4 316 B12R1.11 [13CH3]Nc1cc(cc(c1)C(=O)N)F 34a_200011998915_200025704644 [0,1,0,0,0,0|2,1,0]=4 317 B12R1.11 [13CH3]Nc1cc(cc(c1)C(=O)N)F 7a_200011998915_200025704644 [0,1,0,0,0,0|2,1,0]=4 318 B12R1.11 [13CH3]Oc1cc(cc(c1)C(=O)N)Br 34a_100010084318_200025704644 [0,1,0,0,0,0|2,1,0]=4 319 B12R1.11 [13CH3]Oc1cc(cc(c1)C(=O)N)Br 7a_100010084318_200025704644 [0,1,0,0,0,0|2,1,0]=4 320 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)F 62a_200011280034_200025704644 [0,1,0,0,0,0|2,1,0]=4 321 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)F 62a_200025704644_200011280034 [0,1,0,0,0,0|2,1,0]=4 322 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)O 62a_100010084318_200025704644 [0,1,0,0,0,0|2,1,0]=4 323 B12R1.11 [13CH3]Sc1cc(cc(c1)C(=O)N)O 62a_200025704644_100010084318 [0,1,0,0,0,0|2,1,0]=4 324 B12R1.56 C=C(C)c1ccc(c(c1)CC)Br 271570a_100000694244_100010244631 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.56 C=C(C)c1ccc(c(c1)CC)F 271570a_100000694244_100010244625 [0,1,0,0,0,0|3,0,0]=4 326 B12R1.56 C=C(C)c1ccc(c(c1)CC)N 271570a_100000694244_100000686106 [0,1,0,0,0,0|3,0,0]=4 327 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [0,1,0,0,0,0|3,0,0]=4 328 B12R1.56 CCc1cc(ccc1Br)C(=O)C 1458a_100010152358_200000210301 [0,1,0,0,0,0|2,1,0]=4 329 B12R1.56 CCc1cc(ccc1Br)C(=O)[13CH3] 1458a_100010152358_200025704644 [0,1,0,0,0,0|2,1,0]=4 330 B12R1.56 CCc1cc(ccc1Cl)C(=O)C 1458a_100000102533_200000210301 [0,1,0,0,0,0|2,1,0]=4 331 B12R1.56 CCc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000102533_200025704644 [0,1,0,0,0,0|2,1,0]=4 332 B12R1.56 CCc1cc(ccc1F)C(=O)C 1458a_100009883079_200000210301 [0,1,0,0,0,0|2,1,0]=4 333 B12R1.56 CCc1cc(ccc1F)C(=O)[13CH3] 1458a_100009883079_200025704644 [0,1,0,0,0,0|2,1,0]=4 334 B12R1.56 CNc1cc(ccc1C)C(=O)N 34a_100000188646_200000210301 [0,1,0,0,0,0|2,1,0]=4 335 B12R1.56 CNc1cc(ccc1C)C(=O)N 7a_100000188646_200000210301 [0,1,0,0,0,0|2,1,0]=4 336 B12R1.56 CNc1cc(ccc1Cl)C(=O)N 34a_100000736751_200000210301 [0,1,0,0,0,0|2,1,0]=4 337 B12R1.56 CNc1cc(ccc1F)C(=O)N 34a_100000740466_200000210301 [0,1,0,0,0,0|2,1,0]=4 338 B12R1.56 COc1cc(ccc1Br)C(=O)N 34a_100012344895_200000210301 [0,1,0,0,0,0|2,1,0]=4 339 B12R1.56 COc1cc(ccc1Br)C(=O)N 7a_100012344895_200000210301 [0,1,0,0,0,0|2,1,0]=4 340 B12R1.56 COc1cc(ccc1N)C(=O)N 34a_100011850428_200000210301 [0,1,0,0,0,0|2,1,0]=4 341 B12R1.56 COc1cc(ccc1N)C(=O)N 7a_100011850428_200000210301 [0,1,0,0,0,0|2,1,0]=4 342 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,1,0,0,0,0|2,1,0]=4 343 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_100000186401_200000210301 [0,1,0,0,0,0|2,1,0]=4 344 B12R1.56 CSc1cc(ccc1C)C(=O)N 62a_200000210301_100000186401 [0,1,0,0,0,0|2,1,0]=4 345 B12R1.56 CSc1cc(ccc1F)C(=O)N 62a_100011202321_200000210301 [0,1,0,0,0,0|2,1,0]=4 346 B12R1.56 CSc1cc(ccc1F)C(=O)N 62a_200000210301_100011202321 [0,1,0,0,0,0|2,1,0]=4 347 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 34a_100000188646_200025704644 [0,1,0,0,0,0|2,1,0]=4 348 B12R1.56 Cc1ccc(cc1N[13CH3])C(=O)N 7a_100000188646_200025704644 [0,1,0,0,0,0|2,1,0]=4 349 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_100000186401_200025704644 [0,1,0,0,0,0|2,1,0]=4 350 B12R1.56 Cc1ccc(cc1S[13CH3])C(=O)N 62a_200025704644_100000186401 [0,1,0,0,0,0|2,1,0]=4 351 B12R1.56 [13CH3]Nc1cc(ccc1Cl)C(=O)N 34a_100000736751_200025704644 [0,1,0,0,0,0|2,1,0]=4 352 B12R1.56 [13CH3]Nc1cc(ccc1F)C(=O)N 34a_100000740466_200025704644 [0,1,0,0,0,0|2,1,0]=4 353 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 34a_100012344895_200025704644 [0,1,0,0,0,0|2,1,0]=4 354 B12R1.56 [13CH3]Oc1cc(ccc1Br)C(=O)N 7a_100012344895_200025704644 [0,1,0,0,0,0|2,1,0]=4 355 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 34a_100011850428_200025704644 [0,1,0,0,0,0|2,1,0]=4 356 B12R1.56 [13CH3]Oc1cc(ccc1N)C(=O)N 7a_100011850428_200025704644 [0,1,0,0,0,0|2,1,0]=4 357 B12R1.56 [13CH3]Sc1cc(ccc1F)C(=O)N 62a_100011202321_200025704644 [0,1,0,0,0,0|2,1,0]=4 358 B12R1.56 [13CH3]Sc1cc(ccc1F)C(=O)N 62a_200025704644_100011202321 [0,1,0,0,0,0|2,1,0]=4 359 B12R1.258 C=C(C)c1cc(ccn1)C(=O)C 271570a_100000694244_100000685609 [0,1,0,0,0,0|1,1,1]=4 360 B12R1.258 C=C(C)c1cc(ccn1)C(=O)N 271570a_100000694244_100000229836 [0,1,0,0,0,0|0,1,1]=3 361 B12R1.258 C=C(C)c1cc(cnn1)C(=O)N 271570a_100000694244_100015785749 [0,1,0,0,0,0|1,1,1]=4 362 B12R1.258 C=C(C)c1cc(ncn1)C(=O)N 271570a_100000694244_100000725265 [0,1,0,0,0,0|1,1,1]=4 363 B12R1.258 C=C(C)c1cccc(c1)C(=O)N 271570a_100000694244_100000162208 [0,1,0,0,0,0|1,1,1]=4 364 B12R1.258 C=C(C)c1cccc(c1)C(C)C 271570a_100000694244_100011214899 [0,1,0,0,0,0|3,0,0]=4 365 B12R1.258 C=C(C)c1cccc(c1)C(C)N 271570a_100000694244_100020642005 [0,1,0,0,0,0|3,0,0]=4 366 B12R1.258 C=C(C)c1cccc(c1)C(C)O 271570a_100000694244_100000246457 [0,1,0,0,0,0|3,0,0]=4 367 B12R1.258 C=C(C)c1ccnc(c1)C(=O)C 271570a_100000694244_100000709912 [0,1,0,0,0,0|2,0,1]=4 368 B12R1.258 C=C(C)c1ccnc(c1)C(C)C 271570a_100000694244_100010237922 [0,1,0,0,0,0|2,0,0]=3 369 B12R1.258 C=C(C)c1ccnc(c1)C(C)O 271570a_100000694244_100000144657 [0,1,0,0,0,0|2,0,0]=3 370 B12R1.258 C=C(C)c1ccnc(c1)C(F)F 271570a_100000694244_100010136062 [0,1,0,0,0,0|3,0,0]=4 371 B12R1.258 C=C(C)c1ccnc(c1)N(C)C 271570a_100000694244_100012361627 [0,1,0,0,0,0|3,0,0]=4 372 B12R1.258 C=C(C)c1ccnc(n1)C(C)C 271570a_100000694244_100000752938 [0,1,0,0,0,0|3,0,0]=4 373 B12R1.258 C=C(C)c1nccc(n1)C(=O)N 271570a_100000694244_100000066158 [0,1,0,0,0,0|1,1,1]=4 374 B12R1.258 CC(=O)c1cccc(c1)C(=O)N 1458a_100000736676_200000210301 [0,1,0,0,0,0|1,1,1]=4 375 B12R1.258 CC(=O)c1cccc(c1)C(C)C 1458a_100011934808_200000210301 [0,1,0,0,0,0|2,1,0]=4 376 B12R1.258 CC(=O)c1cccc(c1)C(C)O 1458a_100000090953_200000210301 [0,1,0,0,0,0|2,1,0]=4 377 B12R1.258 CC(C)c1cc(ccn1)N(C)C 27a_100102631434_100010237922 [0,1,0,0,0,0|3,0,0]=4 378 B12R1.258 CC(C)c1cccc(c1)C(=O)[13CH3] 1458a_100011934808_200025704644 [0,1,0,0,0,0|2,1,0]=4 379 B12R1.258 CC(O)c1cc(ccn1)N(C)C 27a_100102631434_100000144657 [0,1,0,0,0,0|3,0,0]=4 380 B12R1.258 CC(O)c1cccc(c1)C(=O)[13CH3] 1458a_100000090953_200025704644 [0,1,0,0,0,0|2,1,0]=4 381 B12R1.258 CN(C)c1cc(cnn1)C(=O)N 27a_100102631434_100015785749 [0,1,0,0,0,0|2,1,0]=4 382 B12R1.258 CN(C)c1cc(ncn1)C(=O)N 27a_100102631434_100000725265 [0,1,0,0,0,0|2,1,0]=4 383 B12R1.258 CN(C)c1nccc(n1)C(=O)N 27a_100102631434_100000066158 [0,1,0,0,0,0|2,1,0]=4 384 B12R1.258 [13CH3]C(=O)c1cccc(c1)C(=O)N 1458a_100000736676_200025704644 [0,1,0,0,0,0|1,1,1]=4 385 B12R1.279 C=C(C)c1cc(ncn1)COC 271570a_100000694244_100000688101 [0,1,0,0,0,0|3,0,0]=4 386 B12R1.279 C=C(C)c1cc(ncn1)NCC 271570a_100000694244_200000242512 [0,1,0,0,0,0|3,0,0]=4 387 B12R1.279 C=C(C)c1cc(ncn1)OCC 271570a_100000694244_100000765465 [0,1,0,0,0,0|3,0,0]=4 388 B12R1.279 C=C(C)c1cccc(c1)CCC 271570a_100000694244_100000694964 [0,1,0,0,0,0|3,0,0]=4 389 B12R1.279 C=C(C)c1cccc(c1)CCN 271570a_100000694244_100011207229 [0,1,0,0,0,0|3,0,0]=4 390 B12R1.279 C=C(C)c1cccc(c1)CCO 271570a_100000694244_100011217444 [0,1,0,0,0,0|3,0,0]=4 391 B12R1.279 C=C(C)c1cccc(c1)CNC 271570a_100000694244_100000187585 [0,1,0,0,0,0|3,0,0]=4 392 B12R1.279 C=C(C)c1cccc(c1)COC 271570a_100000694244_100011493687 [0,1,0,0,0,0|3,0,0]=4 393 B12R1.279 C=C(C)c1cccc(c1)NCC 271570a_100000694244_100000738899 [0,1,0,0,0,0|3,0,0]=4 394 B12R1.279 C=C(C)c1cccc(c1)OCC 271570a_100000694244_100000170002 [0,1,0,0,0,0|3,0,0]=4 395 B12R1.279 C=C(C)c1cccc(c1)SCC 271570a_100000694244_100000703699 [0,1,0,0,0,0|3,0,0]=4 396 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100000210202_100012123953 [0,1,0,0,0,0|3,0,0]=4 397 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100012123953_100000210202 [0,1,0,0,0,0|3,0,0]=4 398 B12R1.279 C=C(C)c1ccnc(c1)CC#N 271570a_100000694244_100009875060 [0,1,0,0,0,0|2,0,1]=4 399 B12R1.279 C=C(C)c1ccnc(c1)CNC 271570a_100000694244_100102954512 [0,1,0,0,0,0|2,0,0]=3 400 B12R1.279 C=C(C)c1ccnc(c1)OCC 271570a_100000694244_100009995528 [0,1,0,0,0,0|2,0,0]=3 401 B12R1.279 C=C(C)c1ccnc(n1)NCC 271570a_100000694244_100012002086 [0,1,0,0,0,0|3,0,0]=4 402 B12R1.279 C=C=Cc1cc(ccn1)C(=O)N 271570a_100015277604_100000229836 [0,1,0,0,0,0|0,1,2]=4 403 B12R1.279 CC(=O)c1cccc(c1)CCO 1458a_100009869812_200000210301 [0,1,0,0,0,0|2,1,0]=4 404 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_100000084091_200025704644 [0,1,0,0,0,0|2,1,0]=4 405 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000084091 [0,1,0,0,0,0|2,1,0]=4 406 B12R1.279 CC(=O)c1ccnc(c1)SCF 62a_100000685609_100015361967 [0,1,0,0,0,0|2,1,0]=4 407 B12R1.279 CC(=O)c1ccnc(c1)SCF 62a_100015361967_100000685609 [0,1,0,0,0,0|2,1,0]=4 408 B12R1.279 CC=Cc1cc(ccn1)C(=O)C 271570a_100016259895_100000685609 [0,1,0,0,0,0|1,1,1]=4 409 B12R1.279 CC=Cc1cc(ccn1)C(=O)N 271570a_100016259895_100000229836 [0,1,0,0,0,0|0,1,1]=3 410 B12R1.279 CC=Cc1cc(cnn1)C(=O)N 271570a_100016259895_100015785749 [0,1,0,0,0,0|1,1,1]=4 411 B12R1.279 CC=Cc1cc(ncn1)C(=O)N 271570a_100016259895_100000725265 [0,1,0,0,0,0|1,1,1]=4 412 B12R1.279 CC=Cc1cccc(c1)C(=O)N 271570a_100016259895_100000162208 [0,1,0,0,0,0|1,1,1]=4 413 B12R1.279 CC=Cc1nccc(n1)C(=O)N 271570a_100016259895_100000066158 [0,1,0,0,0,0|1,1,1]=4 414 B12R1.279 CCNc1cc(ccn1)C(C)C 27a_100015525214_100010237925 [0,1,0,0,0,0|2,0,1]=4 415 B12R1.279 CCNc1cc(ccn1)C(F)F 27a_100015525214_100009884414 [0,1,0,0,0,0|2,0,1]=4 416 B12R1.279 CCNc1cc(cnn1)C(=O)N 27a_100015525214_100015785749 [0,1,0,0,0,0|1,1,0]=3 417 B12R1.279 CCNc1cc(ncn1)C(=O)N 27a_100015525214_100000725265 [0,1,0,0,0,0|1,1,0]=3 418 B12R1.279 CCNc1cccc(c1)C(=O)N 34a_100000217337_100000210202 [0,1,0,0,0,0|1,1,0]=3 419 B12R1.279 CCNc1cccc(n1)C(=O)N 27a_100015525214_100011834053 [0,1,0,0,0,0|2,1,0]=4 420 B12R1.279 CCNc1ccnc(c1)C(=O)N 27a_100015525214_100000229564 [0,1,0,0,0,0|2,1,0]=4 421 B12R1.279 CCNc1nccc(n1)C(=O)C 27a_100015525214_100010643186 [0,1,0,0,0,0|2,1,0]=4 422 B12R1.279 CCNc1nccc(n1)C(=O)N 27a_100015525214_100000066158 [0,1,0,0,0,0|1,1,0]=3 423 B12R1.279 CCOc1cccc(c1)C(=O)C 1458a_100000216331_200000210301 [0,1,0,0,0,0|2,1,0]=4 424 B12R1.279 CCOc1cccc(c1)C(=O)C 34a_100000211620_100000210202 [0,1,0,0,0,0|2,1,0]=4 425 B12R1.279 CCOc1cccc(c1)C(=O)C 7a_100000211620_100000210202 [0,1,0,0,0,0|2,1,0]=4 426 B12R1.279 CCOc1cccc(c1)C(=O)N 34a_100000162170_100000210202 [0,1,0,0,0,0|1,1,0]=3 427 B12R1.279 CCOc1cccc(c1)C(=O)N 7a_100000162170_100000210202 [0,1,0,0,0,0|1,1,0]=3 428 B12R1.279 CCOc1cccc(c1)C(=O)[13CH3] 1458a_100000216331_200025704644 [0,1,0,0,0,0|2,1,0]=4 429 B12R1.279 CCOc1cccc(c1)C(=S)N 7a_100000738086_100000210202 [0,1,0,0,0,0|1,0,0]=2 430 B12R1.279 CCOc1cccc(c1)C(C)N 34a_100000740644_100000210202 [0,1,0,0,0,0|2,0,1]=4 431 B12R1.279 CCOc1cccc(c1)C(C)N 7a_100000740644_100000210202 [0,1,0,0,0,0|2,0,1]=4 432 B12R1.279 CCOc1cncc(c1)C(=O)N 7a_100000698036_100000210202 [0,1,0,0,0,0|2,1,0]=4 433 B12R1.279 CCSc1cc(ccn1)B(O)O 62a_100000049459_100000210202 [0,1,0,0,0,0|2,1,0]=4 434 B12R1.279 CCSc1cc(ccn1)B(O)O 62a_100000210202_100000049459 [0,1,0,0,0,0|2,1,0]=4 435 B12R1.279 CCSc1cc(ccn1)C(=O)C 62a_100000210202_100000685609 [0,1,0,0,0,0|1,1,0]=3 436 B12R1.279 CCSc1cc(ccn1)C(=O)C 62a_100000685609_100000210202 [0,1,0,0,0,0|1,1,0]=3 437 B12R1.279 CCSc1cc(ccn1)C(=O)N 62a_100000210202_100000229836 [0,1,0,0,0,0|0,1,0]=2 438 B12R1.279 CCSc1cc(ccn1)C(=O)N 62a_100000229836_100000210202 [0,1,0,0,0,0|0,1,0]=2 439 B12R1.279 CCSc1cc(ccn1)C(C)C 62a_100000210202_100010237925 [0,1,0,0,0,0|2,0,1]=4 440 B12R1.279 CCSc1cc(ccn1)C(C)C 62a_100010237925_100000210202 [0,1,0,0,0,0|2,0,1]=4 441 B12R1.279 CCSc1cc(ccn1)C(F)F 62a_100000210202_100009884414 [0,1,0,0,0,0|2,0,1]=4 442 B12R1.279 CCSc1cc(ccn1)C(F)F 62a_100009884414_100000210202 [0,1,0,0,0,0|2,0,1]=4 443 B12R1.279 CCSc1cc(ccn1)N(C)C 62a_100000210202_100000766659 [0,1,0,0,0,0|3,0,0]=4 444 B12R1.279 CCSc1cc(ccn1)N(C)C 62a_100000766659_100000210202 [0,1,0,0,0,0|3,0,0]=4 445 B12R1.279 CCSc1cc(cnn1)C(=O)N 62a_100000210202_100015785749 [0,1,0,0,0,0|1,1,0]=3 446 B12R1.279 CCSc1cc(cnn1)C(=O)N 62a_100015785749_100000210202 [0,1,0,0,0,0|1,1,0]=3 447 B12R1.279 CCSc1cc(ncn1)C(=O)N 62a_100000210202_100000725265 [0,1,0,0,0,0|1,1,0]=3 448 B12R1.279 CCSc1cc(ncn1)C(=O)N 62a_100000725265_100000210202 [0,1,0,0,0,0|1,1,0]=3 449 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210093_100000210202 [0,1,0,0,0,0|2,1,0]=4 450 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210202_100000210093 [0,1,0,0,0,0|2,1,0]=4 451 B12R1.279 CCSc1cccc(c1)C(=O)N 62a_100000162208_100000210202 [0,1,0,0,0,0|1,1,0]=3 452 B12R1.279 CCSc1cccc(c1)C(=O)N 62a_100000210202_100000162208 [0,1,0,0,0,0|1,1,0]=3 453 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100000210202_100020642005 [0,1,0,0,0,0|2,0,1]=4 454 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100020642005_100000210202 [0,1,0,0,0,0|2,0,1]=4 455 B12R1.279 CCSc1cccc(n1)C(=O)N 62a_100000210202_100011834053 [0,1,0,0,0,0|2,1,0]=4 456 B12R1.279 CCSc1cccc(n1)C(=O)N 62a_100011834053_100000210202 [0,1,0,0,0,0|2,1,0]=4 457 B12R1.279 CCSc1ccnc(c1)C(=O)N 62a_100000210202_100000229564 [0,1,0,0,0,0|2,1,0]=4 458 B12R1.279 CCSc1ccnc(c1)C(=O)N 62a_100000229564_100000210202 [0,1,0,0,0,0|2,1,0]=4 459 B12R1.279 CCSc1cncc(c1)C(=O)N 62a_100000162242_100000210202 [0,1,0,0,0,0|2,1,0]=4 460 B12R1.279 CCSc1cncc(c1)C(=O)N 62a_100000210202_100000162242 [0,1,0,0,0,0|2,1,0]=4 461 B12R1.279 CCSc1nccc(n1)C(=O)C 62a_100000210202_100010643186 [0,1,0,0,0,0|2,1,0]=4 462 B12R1.279 CCSc1nccc(n1)C(=O)C 62a_100010643186_100000210202 [0,1,0,0,0,0|2,1,0]=4 463 B12R1.279 CCSc1nccc(n1)C(=O)N 62a_100000066158_100000210202 [0,1,0,0,0,0|1,1,0]=3 464 B12R1.279 CCSc1nccc(n1)C(=O)N 62a_100000210202_100000066158 [0,1,0,0,0,0|1,1,0]=3 465 B12R1.279 CNCc1cc(ccn1)N(C)C 207a_100102657272_100009864371 [0,1,0,0,0,0|3,0,0]=4 466 B12R1.279 CNCc1cc(ccn1)N(C)C 270004a_106832991635_100009864371 [0,1,0,0,0,0|3,0,0]=4 467 B12R1.279 CNCc1cc(ccn1)[N+](=O)[O-] 2230a_106832991635_100010177786 [0,1,0,0,0,0|2,1,0]=4 468 B12R1.279 CNCc1cc(ccn1)[N+](=O)[O-] 270004a_106832991635_200000085670 [0,1,0,0,0,0|2,1,0]=4 469 B12R1.279 CNCc1cc(ccn1)[N+](=O)[O-] 34a_100102657272_100010177786 [0,1,0,0,0,0|2,1,0]=4 470 B12R1.279 CNCc1cc(ccn1)[N+](=O)[O-] 7a_106832991635_100010177786 [0,1,0,0,0,0|2,1,0]=4 471 B12R1.279 CNCc1cccc(c1)C(=O)C 2230a_106832991635_100000084091 [0,1,0,0,0,0|2,1,0]=4 472 B12R1.279 CNCc1cccc(c1)C(=O)C 26a_100102657272_100000211620 [0,1,0,0,0,0|2,1,0]=4 473 B12R1.279 CNCc1cccc(c1)C(=O)C 34a_100102657272_100000084091 [0,1,0,0,0,0|2,1,0]=4 474 B12R1.279 CNCc1cccc(c1)C(=O)C 7a_106832991635_100000084091 [0,1,0,0,0,0|2,1,0]=4 475 B12R1.279 CNCc1cccc(c1)C(=O)N 207a_100102657272_100000059704 [0,1,0,0,0,0|1,1,0]=3 476 B12R1.279 CNCc1cccc(c1)C(=O)N 2230a_100000746036_200000210301 [0,1,0,0,0,0|1,1,0]=3 477 B12R1.279 CNCc1cccc(c1)C(=O)N 2230a_106832991635_100000738444 [0,1,0,0,0,0|1,1,0]=3 478 B12R1.279 CNCc1cccc(c1)C(=O)N 270004a_106832991635_100000059704 [0,1,0,0,0,0|1,1,0]=3 479 B12R1.279 CNCc1cccc(c1)C(=O)N 34a_100102657272_100000738444 [0,1,0,0,0,0|1,1,0]=3 480 B12R1.279 CNCc1cccc(c1)C(=O)N 7a_106832991635_100000738444 [0,1,0,0,0,0|1,1,0]=3 481 B12R1.279 CNCc1cccc(c1)C(=O)O 269956a_100000752609_200000210301 [0,1,0,0,0,0|2,1,0]=4 482 B12R1.279 CNCc1cccc(c1)C(=O)[O-] 26a_100102657272_200020627138 [0,1,0,0,0,0|2,1,0]=4 483 B12R1.279 CNCc1cncc(c1)C(=O)N 2230a_106832991635_200010162415 [0,1,0,0,0,0|2,1,0]=4 484 B12R1.279 CNCc1cncc(c1)C(=O)N 34a_100102657272_200010162415 [0,1,0,0,0,0|2,1,0]=4 485 B12R1.279 CNCc1cncc(c1)C(=O)N 7a_106832991635_200010162415 [0,1,0,0,0,0|2,1,0]=4 486 B12R1.279 COCc1cc(ccn1)[N+](=O)[O-] 34a_100138415774_100010177786 [0,1,0,0,0,0|2,1,0]=4 487 B12R1.279 COCc1cccc(c1)C(=O)C 1458a_100000199024_200000210301 [0,1,0,0,0,0|2,1,0]=4 488 B12R1.279 COCc1cccc(c1)C(=O)C 34a_100138415774_100000084091 [0,1,0,0,0,0|2,1,0]=4 489 B12R1.279 COCc1cccc(c1)C(=O)N 34a_100138415774_100000738444 [0,1,0,0,0,0|1,1,0]=3 490 B12R1.279 COCc1cccc(c1)C(=O)[13CH3] 1458a_100000199024_200025704644 [0,1,0,0,0,0|2,1,0]=4 491 B12R1.279 COCc1cncc(c1)C(=O)N 34a_100138415774_200010162415 [0,1,0,0,0,0|2,1,0]=4 492 B12R1.279 CSCc1cc(ccn1)[N+](=O)[O-] 62a_100010177786_200000210301 [0,1,0,0,0,0|2,1,0]=4 493 B12R1.279 CSCc1cc(ccn1)[N+](=O)[O-] 62a_200000210301_100010177786 [0,1,0,0,0,0|2,1,0]=4 494 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_100000084091_200000210301 [0,1,0,0,0,0|2,1,0]=4 495 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_200000210301_100000084091 [0,1,0,0,0,0|2,1,0]=4 496 B12R1.279 CSCc1cccc(c1)C(=O)N 62a_100000738444_200000210301 [0,1,0,0,0,0|1,1,0]=3 497 B12R1.279 CSCc1cccc(c1)C(=O)N 62a_200000210301_100000738444 [0,1,0,0,0,0|1,1,0]=3 498 B12R1.279 CSCc1cncc(c1)C(=O)N 62a_200000210301_200010162415 [0,1,0,0,0,0|2,1,0]=4 499 B12R1.279 CSCc1cncc(c1)C(=O)N 62a_200010162415_200000210301 [0,1,0,0,0,0|2,1,0]=4 500 B12R1.279 NC(=O)c1cc(ncn1)SCF 62a_100000725265_100015361967 [0,1,0,0,0,0|2,1,0]=4 501 B12R1.279 NC(=O)c1cc(ncn1)SCF 62a_100015361967_100000725265 [0,1,0,0,0,0|2,1,0]=4 502 B12R1.279 NC(=O)c1cccc(c1)NCF 34a_100000217337_100015361967 [0,1,0,0,0,0|2,1,0]=4 503 B12R1.279 NC(=O)c1cccc(c1)OCF 34a_100000162170_100015361967 [0,1,0,0,0,0|2,1,0]=4 504 B12R1.279 NC(=O)c1cccc(c1)OCF 7a_100000162170_100015361967 [0,1,0,0,0,0|2,1,0]=4 505 B12R1.279 NC(=O)c1cccc(c1)SCF 62a_100000162208_100015361967 [0,1,0,0,0,0|2,1,0]=4 506 B12R1.279 NC(=O)c1cccc(c1)SCF 62a_100015361967_100000162208 [0,1,0,0,0,0|2,1,0]=4 507 B12R1.279 NC(=O)c1ccnc(c1)SCF 62a_100000229836_100015361967 [0,1,0,0,0,0|1,1,0]=3 508 B12R1.279 NC(=O)c1ccnc(c1)SCF 62a_100015361967_100000229836 [0,1,0,0,0,0|1,1,0]=3 509 B12R1.279 NC(=O)c1ccnc(n1)SCF 62a_100000066158_100015361967 [0,1,0,0,0,0|2,1,0]=4 510 B12R1.279 NC(=O)c1ccnc(n1)SCF 62a_100015361967_100000066158 [0,1,0,0,0,0|2,1,0]=4 511 B12R1.279 NC(=O)c1cnnc(c1)SCF 62a_100015361967_100015785749 [0,1,0,0,0,0|2,1,0]=4 512 B12R1.279 NC(=O)c1cnnc(c1)SCF 62a_100015785749_100015361967 [0,1,0,0,0,0|2,1,0]=4 513 B12R1.279 NC(=S)c1cccc(c1)OCF 7a_100000738086_100015361967 [0,1,0,0,0,0|2,0,0]=3 514 B12R1.279 [13CH3]C(=O)c1cccc(c1)CCO 1458a_100009869812_200025704644 [0,1,0,0,0,0|2,1,0]=4 515 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)N 2230a_100000746036_200025704644 [0,1,0,0,0,0|1,1,0]=3 516 B12R1.279 [13CH3]NCc1cccc(c1)C(=O)O 269956a_100000752609_200025704644 [0,1,0,0,0,0|2,1,0]=4 517 B12R1.279 [13CH3]SCc1cc(ccn1)[N+](=O)[O-] 62a_100010177786_200025704644 [0,1,0,0,0,0|2,1,0]=4 518 B12R1.279 [13CH3]SCc1cc(ccn1)[N+](=O)[O-] 62a_200025704644_100010177786 [0,1,0,0,0,0|2,1,0]=4 519 B12R1.279 [13CH3]SCc1cccc(c1)C(=O)N 62a_100000738444_200025704644 [0,1,0,0,0,0|1,1,0]=3 520 B12R1.279 [13CH3]SCc1cccc(c1)C(=O)N 62a_200025704644_100000738444 [0,1,0,0,0,0|1,1,0]=3 521 B12R1.279 [13CH3]SCc1cncc(c1)C(=O)N 62a_200010162415_200025704644 [0,1,0,0,0,0|2,1,0]=4 522 B12R1.279 [13CH3]SCc1cncc(c1)C(=O)N 62a_200025704644_200010162415 [0,1,0,0,0,0|2,1,0]=4 523 B12R1.435 C=Cc1cc(ccn1)C(=O)NC 271570a_100011290941_100011196506 [0,1,0,0,0,0|0,1,2]=4 524 B12R1.435 C=Cc1cc(ccn1)C(=O)NN 271570a_100011290941_100000021280 [0,1,0,0,0,0|0,1,2]=4 525 B12R1.435 CC(=NN)c1cccc(c1)O[13CH3] 34a_100000689795_200025704644 [0,1,0,0,0,0|3,0,0]=4 526 B12R1.435 CCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210202 [0,1,0,0,0,0|2,1,0]=4 527 B12R1.435 CCc1cccc(c1)C(=O)CF 1458a_100011933908_100015361967 [0,1,0,0,0,0|2,1,0]=4 528 B12R1.435 CCc1cccc(c1)C(=O)NC 11a_106832991635_100011933908 [0,1,0,0,0,0|1,1,0]=3 529 B12R1.435 CCc1cccc(c1)C(=O)NC 1626a_100102657272_100011933908 [0,1,0,0,0,0|1,1,0]=3 530 B12R1.435 CCc1cccc(c1)C(=O)NC 240690a_100102657272_100011933908 [0,1,0,0,0,0|1,1,0]=3 531 B12R1.435 CCc1cccc(c1)C(=O)NC 527a_100102657272_100011933908 [0,1,0,0,0,0|1,1,0]=3 532 B12R1.435 CCc1cccc(c1)C(C)NC 269862a_106832991636_100011220055 [0,1,0,0,0,0|2,0,1]=4 533 B12R1.435 CNC(=O)c1cccc(c1)CO 240690a_100102657272_100000746274 [0,1,0,0,0,0|2,1,0]=4 534 B12R1.435 CNC(=O)c1cccc(c1)NC 34a_100000185133_200000210301 [0,1,0,0,0,0|2,1,0]=4 535 B12R1.435 CNC(=O)c1cccc(c1)N[13CH3] 34a_100000185133_200025704644 [0,1,0,0,0,0|2,1,0]=4 536 B12R1.435 CNC(=O)c1cccc(c1)OC 11a_106832991635_100000188888 [0,1,0,0,0,0|2,1,0]=4 537 B12R1.435 CNC(=O)c1cccc(c1)OC 1626a_100102657272_100000188888 [0,1,0,0,0,0|2,1,0]=4 538 B12R1.435 CNC(=O)c1cccc(c1)OC 240690a_100102657272_100000188888 [0,1,0,0,0,0|2,1,0]=4 539 B12R1.435 CNC(=O)c1cccc(c1)OC 34a_100000159807_200000210301 [0,1,0,0,0,0|2,1,0]=4 540 B12R1.435 CNC(=O)c1cccc(c1)OC 527a_100102657272_100000188888 [0,1,0,0,0,0|2,1,0]=4 541 B12R1.435 CNC(=O)c1cccc(c1)OC 7a_100000159807_200000210301 [0,1,0,0,0,0|2,1,0]=4 542 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 34a_100000159807_200025704644 [0,1,0,0,0,0|2,1,0]=4 543 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 7a_100000159807_200025704644 [0,1,0,0,0,0|2,1,0]=4 544 B12R1.435 CNC(=O)c1cccc(c1)SC 11a_106832991635_100011217804 [0,1,0,0,0,0|2,1,0]=4 545 B12R1.435 CNC(=O)c1cccc(c1)SC 1626a_100102657272_100011217804 [0,1,0,0,0,0|2,1,0]=4 546 B12R1.435 CNC(=O)c1cccc(c1)SC 240690a_100102657272_100011217804 [0,1,0,0,0,0|2,1,0]=4 547 B12R1.435 CNC(=O)c1cccc(c1)SC 527a_100102657272_100011217804 [0,1,0,0,0,0|2,1,0]=4 548 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_100000155082_200000210301 [0,1,0,0,0,0|2,1,0]=4 549 B12R1.435 CNC(=O)c1cccc(c1)SC 62a_200000210301_100000155082 [0,1,0,0,0,0|2,1,0]=4 550 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_100000155082_200025704644 [0,1,0,0,0,0|2,1,0]=4 551 B12R1.435 CNC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000155082 [0,1,0,0,0,0|2,1,0]=4 552 B12R1.435 CNC(=O)c1ccnc(c1)SC 62a_100011196506_200000210301 [0,1,0,0,0,0|1,1,0]=3 553 B12R1.435 CNC(=O)c1ccnc(c1)SC 62a_200000210301_100011196506 [0,1,0,0,0,0|1,1,0]=3 554 B12R1.435 CNC(=O)c1ccnc(c1)S[13CH3] 62a_100011196506_200025704644 [0,1,0,0,0,0|1,1,0]=3 555 B12R1.435 CNC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011196506 [0,1,0,0,0,0|1,1,0]=3 556 B12R1.435 CNC(C)c1ccnc(c1)OC 269862a_106832991636_100000708580 [0,1,0,0,0,0|2,0,1]=4 557 B12R1.435 CN[C@@H](C)c1ccnc(c1)OC 2230a_100012186823_200000210301 [0,1,0,0,0,0|2,0,1]=4 558 B12R1.435 COC(=O)c1ccnc(c1)OC 34a_100138552365_200000210301 [0,1,0,0,0,0|2,1,0]=4 559 B12R1.435 COC(=O)c1ccnc(c1)O[13CH3] 34a_100138552365_200025704644 [0,1,0,0,0,0|2,1,0]=4 560 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_100011934382_200000210301 [0,1,0,0,0,0|2,1,0]=4 561 B12R1.435 COC(=O)c1ccnc(c1)SC 62a_200000210301_100011934382 [0,1,0,0,0,0|2,1,0]=4 562 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_100011934382_200025704644 [0,1,0,0,0,0|2,1,0]=4 563 B12R1.435 COC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100011934382 [0,1,0,0,0,0|2,1,0]=4 564 B12R1.435 COc1cc(ccn1)[C@H](C)N[13CH3] 2230a_100012186823_200025704644 [0,1,0,0,0,0|2,0,1]=4 565 B12R1.435 COc1cccc(c1)C(=NN)C 34a_100000689795_200000210301 [0,1,0,0,0,0|3,0,0]=4 566 B12R1.435 COc1cccc(c1)C(=NO)N 34a_100000738085_200000210301 [0,1,0,0,0,0|2,1,0]=4 567 B12R1.435 COc1cccc(c1)C(=O)NN 34a_100000184184_200000210301 [0,1,0,0,0,0|2,1,0]=4 568 B12R1.435 CSc1cc(ccn1)C(=O)NN 62a_100000021280_200000210301 [0,1,0,0,0,0|1,1,0]=3 569 B12R1.435 CSc1cc(ccn1)C(=O)NN 62a_200000210301_100000021280 [0,1,0,0,0,0|1,1,0]=3 570 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_100020587001_200000210301 [0,1,0,0,0,0|2,1,0]=4 571 B12R1.435 CSc1cccc(c1)C(=O)CN 62a_200000210301_100020587001 [0,1,0,0,0,0|2,1,0]=4 572 B12R1.435 CSc1cccc(c1)C(=O)NN 62a_100000189783_200000210301 [0,1,0,0,0,0|2,1,0]=4 573 B12R1.435 CSc1cccc(c1)C(=O)NN 62a_200000210301_100000189783 [0,1,0,0,0,0|2,1,0]=4 574 B12R1.435 [13CH3]Oc1cccc(c1)C(=NO)N 34a_100000738085_200025704644 [0,1,0,0,0,0|2,1,0]=4 575 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)NN 34a_100000184184_200025704644 [0,1,0,0,0,0|2,1,0]=4 576 B12R1.435 [13CH3]Sc1cc(ccn1)C(=O)NN 62a_100000021280_200025704644 [0,1,0,0,0,0|1,1,0]=3 577 B12R1.435 [13CH3]Sc1cc(ccn1)C(=O)NN 62a_200025704644_100000021280 [0,1,0,0,0,0|1,1,0]=3 578 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_100020587001_200025704644 [0,1,0,0,0,0|2,1,0]=4 579 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)CN 62a_200025704644_100020587001 [0,1,0,0,0,0|2,1,0]=4 580 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)NN 62a_100000189783_200025704644 [0,1,0,0,0,0|2,1,0]=4 581 B12R1.435 [13CH3]Sc1cccc(c1)C(=O)NN 62a_200025704644_100000189783 [0,1,0,0,0,0|2,1,0]=4 582 B12R1.440 C=C(C)c1cccc(c1O)CC 271570a_100000694244_200010001580 [0,1,0,0,0,0|3,0,0]=4 583 B12R1.440 C=C(C)c1ccnc(c1C)OC 271570a_100000694244_100010068544 [0,1,0,0,0,0|3,0,0]=4 584 B12R1.440 C=C(C)c1ccnc(c1F)OC 271570a_100000694244_100009885657 [0,1,0,0,0,0|3,0,0]=4 585 B12R1.440 C=C(C)c1ncnc(c1F)CC 271570a_100000694244_100000685531 [0,1,0,0,0,0|3,0,0]=4 586 B12R1.440 C=Cc1nccc(c1N)C(=O)N 271570a_100011290941_100000080204 [0,1,0,0,0,0|0,1,2]=4 587 B12R1.440 CC(=O)c1ccnc(c1N)S[13CH3] 62a_200000063496_200025704644 [0,1,0,0,0,0|2,1,0]=4 588 B12R1.440 CC(=O)c1ccnc(c1N)S[13CH3] 62a_200025704644_200000063496 [0,1,0,0,0,0|2,1,0]=4 589 B12R1.440 CNc1cccc(c1C)C(=O)N 34a_100000738810_200000210301 [0,1,0,0,0,0|2,1,0]=4 590 B12R1.440 CNc1cccc(c1C)C(=O)N 7a_100000738810_200000210301 [0,1,0,0,0,0|2,1,0]=4 591 B12R1.440 CNc1cccc(c1F)C(=O)N 34a_100014075672_200000210301 [0,1,0,0,0,0|2,1,0]=4 592 B12R1.440 COc1cccc(c1F)C(=O)N 34a_100009841371_200000210301 [0,1,0,0,0,0|2,1,0]=4 593 B12R1.440 COc1cccc(c1F)C(=O)N 7a_100009841371_200000210301 [0,1,0,0,0,0|2,1,0]=4 594 B12R1.440 CSc1cccc(c1C)C(=O)N 62a_200000210301_200012298201 [0,1,0,0,0,0|2,1,0]=4 595 B12R1.440 CSc1cccc(c1C)C(=O)N 62a_200012298201_200000210301 [0,1,0,0,0,0|2,1,0]=4 596 B12R1.440 CSc1cccc(c1F)C(=O)N 62a_100012351131_200000210301 [0,1,0,0,0,0|2,1,0]=4 597 B12R1.440 CSc1cccc(c1F)C(=O)N 62a_200000210301_100012351131 [0,1,0,0,0,0|2,1,0]=4 598 B12R1.440 CSc1cccc(c1N)C(=O)N 62a_100010144993_200000210301 [0,1,0,0,0,0|2,1,0]=4 599 B12R1.440 CSc1nccc(c1N)C(=O)C 62a_200000063496_200000210301 [0,1,0,0,0,0|2,1,0]=4 600 B12R1.440 CSc1nccc(c1N)C(=O)C 62a_200000210301_200000063496 [0,1,0,0,0,0|2,1,0]=4 601 B12R1.440 CSc1nccc(c1N)C(=O)N 62a_100000080204_200000210301 [0,1,0,0,0,0|1,1,0]=3 602 B12R1.440 CSc1nccc(c1N)C(=O)N 62a_200000210301_100000080204 [0,1,0,0,0,0|1,1,0]=3 603 B12R1.440 Cc1c(cccc1C(=O)N)N[13CH3] 34a_100000738810_200025704644 [0,1,0,0,0,0|2,1,0]=4 604 B12R1.440 Cc1c(cccc1C(=O)N)N[13CH3] 7a_100000738810_200025704644 [0,1,0,0,0,0|2,1,0]=4 605 B12R1.440 Cc1c(cccc1C(=O)N)S[13CH3] 62a_200012298201_200025704644 [0,1,0,0,0,0|2,1,0]=4 606 B12R1.440 Cc1c(cccc1C(=O)N)S[13CH3] 62a_200025704644_200012298201 [0,1,0,0,0,0|2,1,0]=4 607 B12R1.440 [13CH3]Nc1cccc(c1F)C(=O)N 34a_100014075672_200025704644 [0,1,0,0,0,0|2,1,0]=4 608 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 34a_100009841371_200025704644 [0,1,0,0,0,0|2,1,0]=4 609 B12R1.440 [13CH3]Oc1cccc(c1F)C(=O)N 7a_100009841371_200025704644 [0,1,0,0,0,0|2,1,0]=4 610 B12R1.440 [13CH3]Sc1cccc(c1F)C(=O)N 62a_100012351131_200025704644 [0,1,0,0,0,0|2,1,0]=4 611 B12R1.440 [13CH3]Sc1cccc(c1F)C(=O)N 62a_200025704644_100012351131 [0,1,0,0,0,0|2,1,0]=4 612 B12R1.440 [13CH3]Sc1cccc(c1N)C(=O)N 62a_100010144993_200025704644 [0,1,0,0,0,0|2,1,0]=4 613 B12R1.440 [13CH3]Sc1nccc(c1N)C(=O)N 62a_100000080204_200025704644 [0,1,0,0,0,0|1,1,0]=3 614 B12R1.440 [13CH3]Sc1nccc(c1N)C(=O)N 62a_200025704644_100000080204 [0,1,0,0,0,0|1,1,0]=3 615 B12R1.453 C=C(C)c1cc(ccc1F)CC 271570a_100000694244_200010244628 [0,1,0,0,0,0|3,0,0]=4 616 B12R1.453 C=C(C)c1cc(ccc1N)CC 271570a_100000694244_100012339725 [0,1,0,0,0,0|3,0,0]=4 617 B12R1.453 C=C(C)c1cc(ccc1O)CC 271570a_100000694244_100012339963 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.453 C=C(C)c1cc(ncc1C)CO 271570a_100000694244_100010113723 [0,1,0,0,0,0|3,0,0]=4 619 B12R1.453 C=C(C)c1cc(ncc1C)OC 271570a_100000694244_100010068546 [0,1,0,0,0,0|3,0,0]=4 620 B12R1.453 C=C(C)c1cc(ncc1Cl)OC 271570a_100000694244_100010068019 [0,1,0,0,0,0|3,0,0]=4 621 B12R1.453 C=C(C)c1cc(ncc1F)OC 271570a_100000694244_100010160775 [0,1,0,0,0,0|3,0,0]=4 622 B12R1.453 C=Cc1cc(c(cn1)F)C(=O)N 271570a_100011290941_100015943597 [0,1,0,0,0,0|0,1,2]=4 623 B12R1.453 C=Cc1cc(c(cn1)N)C(=O)N 271570a_100011290941_100012003536 [0,1,0,0,0,0|0,1,2]=4 624 B12R1.453 CC(=O)c1cc(ncc1F)S[13CH3] 62a_100000697832_200025704644 [0,1,0,0,0,0|2,1,0]=4 625 B12R1.453 CC(=O)c1cc(ncc1F)S[13CH3] 62a_200025704644_100000697832 [0,1,0,0,0,0|2,1,0]=4 626 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1458a_200000748397_200000210301 [0,1,0,0,0,0|2,1,0]=4 627 B12R1.453 CCc1ccc(c(c1)C(=O)[13CH3])O 1458a_200000748397_200025704644 [0,1,0,0,0,0|2,1,0]=4 628 B12R1.453 CNc1ccc(c(c1)C(=O)N)Br 34a_100015186447_200000210301 [0,1,0,0,0,0|2,1,0]=4 629 B12R1.453 CNc1ccc(c(c1)C(=O)N)Br 7a_100015186447_200000210301 [0,1,0,0,0,0|2,1,0]=4 630 B12R1.453 CNc1ccc(c(c1)C(=O)N)C 34a_100000750465_200000210301 [0,1,0,0,0,0|2,1,0]=4 631 B12R1.453 CNc1ccc(c(c1)C(=O)N)C 7a_100000750465_200000210301 [0,1,0,0,0,0|2,1,0]=4 632 B12R1.453 CNc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_200000210301 [0,1,0,0,0,0|2,1,0]=4 633 B12R1.453 CNc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_200000210301 [0,1,0,0,0,0|2,1,0]=4 634 B12R1.453 CNc1ccc(c(c1)C(=O)N)F 34a_100000738046_200000210301 [0,1,0,0,0,0|2,1,0]=4 635 B12R1.453 CNc1ccc(c(c1)C(=O)N)F 7a_100000738046_200000210301 [0,1,0,0,0,0|2,1,0]=4 636 B12R1.453 COc1ccc(c(c1)C(=O)N)O 271570a_203496583355_100000162014 [0,1,0,0,0,0|2,1,0]=4 637 B12R1.453 CSc1cc(c(cn1)F)C(=O)C 62a_100000697832_200000210301 [0,1,0,0,0,0|2,1,0]=4 638 B12R1.453 CSc1cc(c(cn1)F)C(=O)C 62a_200000210301_100000697832 [0,1,0,0,0,0|2,1,0]=4 639 B12R1.453 CSc1cc(c(cn1)F)C(=O)N 62a_100015943597_200000210301 [0,1,0,0,0,0|1,1,0]=3 640 B12R1.453 CSc1cc(c(cn1)F)C(=O)N 62a_200000210301_100015943597 [0,1,0,0,0,0|1,1,0]=3 641 B12R1.453 CSc1cc(c(cn1)N)C(=O)N 62a_100012003536_200000210301 [0,1,0,0,0,0|1,1,0]=3 642 B12R1.453 CSc1cc(c(cn1)N)C(=O)N 62a_200000210301_100012003536 [0,1,0,0,0,0|1,1,0]=3 643 B12R1.453 CSc1ccc(c(c1)C(=O)N)C 62a_100012257281_200000210301 [0,1,0,0,0,0|2,1,0]=4 644 B12R1.453 CSc1ccc(c(c1)C(=O)N)C 62a_200000210301_100012257281 [0,1,0,0,0,0|2,1,0]=4 645 B12R1.453 CSc1ccc(c(c1)C(=O)N)F 62a_100000162119_200000210301 [0,1,0,0,0,0|2,1,0]=4 646 B12R1.453 CSc1ccc(c(c1)C(=O)N)N 62a_100000740421_200000210301 [0,1,0,0,0,0|2,1,0]=4 647 B12R1.453 CSc1ccc(c(c1)C(=O)N)O 62a_100000192807_200000210301 [0,1,0,0,0,0|2,1,0]=4 648 B12R1.453 Cc1ccc(cc1C(=O)N)N[13CH3] 34a_100000750465_200025704644 [0,1,0,0,0,0|2,1,0]=4 649 B12R1.453 Cc1ccc(cc1C(=O)N)N[13CH3] 7a_100000750465_200025704644 [0,1,0,0,0,0|2,1,0]=4 650 B12R1.453 Cc1ccc(cc1C(=O)N)S[13CH3] 62a_100012257281_200025704644 [0,1,0,0,0,0|2,1,0]=4 651 B12R1.453 Cc1ccc(cc1C(=O)N)S[13CH3] 62a_200025704644_100012257281 [0,1,0,0,0,0|2,1,0]=4 652 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Br 34a_100015186447_200025704644 [0,1,0,0,0,0|2,1,0]=4 653 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Br 7a_100015186447_200025704644 [0,1,0,0,0,0|2,1,0]=4 654 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_200025704644 [0,1,0,0,0,0|2,1,0]=4 655 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_200025704644 [0,1,0,0,0,0|2,1,0]=4 656 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)F 34a_100000738046_200025704644 [0,1,0,0,0,0|2,1,0]=4 657 B12R1.453 [13CH3]Nc1ccc(c(c1)C(=O)N)F 7a_100000738046_200025704644 [0,1,0,0,0,0|2,1,0]=4 658 B12R1.453 [13CH3]Sc1cc(c(cn1)F)C(=O)N 62a_100015943597_200025704644 [0,1,0,0,0,0|1,1,0]=3 659 B12R1.453 [13CH3]Sc1cc(c(cn1)F)C(=O)N 62a_200025704644_100015943597 [0,1,0,0,0,0|1,1,0]=3 660 B12R1.453 [13CH3]Sc1cc(c(cn1)N)C(=O)N 62a_100012003536_200025704644 [0,1,0,0,0,0|1,1,0]=3 661 B12R1.453 [13CH3]Sc1cc(c(cn1)N)C(=O)N 62a_200025704644_100012003536 [0,1,0,0,0,0|1,1,0]=3 662 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)F 62a_100000162119_200025704644 [0,1,0,0,0,0|2,1,0]=4 663 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)N 62a_100000740421_200025704644 [0,1,0,0,0,0|2,1,0]=4 664 B12R1.453 [13CH3]Sc1ccc(c(c1)C(=O)N)O 62a_100000192807_200025704644 [0,1,0,0,0,0|2,1,0]=4 665 B12R2.43 CCc1cc(ccn1)C2CC2 271570a_100011220607_100009820011 [0,0,0,1,0,0|2,0,1]=4 666 B12R2.1384 C=C(C)c1ccc2c(c1)CC2 271570a_100000694244_100009818592 [0,0,0,1,0,0|3,0,0]=4 667 B12R2.1384 CC(=O)c1ccc2c(c1)CC2 1458a_100000137882_200000210301 [0,0,0,1,0,0|2,1,0]=4 668 B12R2.1384 [13CH3]C(=O)c1ccc2c(c1)CC2 1458a_100000137882_200025704644 [0,0,0,1,0,0|2,1,0]=4 669 B10R1.31 C=C(C)c1ccc(s1)CC 271570a_100000694244_100009844052 [0,0,0,0,1,0|3,0,0]=4 670 B10R1.31 C=C(C)c1cnn(c1)CC 271570a_100000694244_100011400201 [0,0,0,0,1,0|3,0,0]=4 671 B10R1.31 C=C(C)c1csc(c1)CC 271570a_100000694244_100009846239 [0,0,0,0,1,0|3,0,0]=4 672 B10R1.31 CCc1noc(n1)C(=O)N 270196a_200000212204_100011215815 [0,0,0,0,1,0|2,1,0]=4 673 B10R1.31 CCn1cc(nn1)C(=O)N 274090a_100000204670_100011470575 [0,0,0,0,1,0|2,1,0]=4 674 B10R1.31 CNc1ncc(s1)C(=O)N 27a_100102657272_100010220624 [0,0,0,0,1,0|2,1,0]=4 675 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_100000229580_200000210301 [0,0,0,0,1,0|2,1,0]=4 676 B10R1.31 CSc1c[nH]c(c1)C(=O)N 62a_200000210301_100000229580 [0,0,0,0,1,0|2,1,0]=4 677 B10R1.31 CSc1cc(cs1)C(=O)N 62a_100000747962_200000210301 [0,0,0,0,1,0|2,1,0]=4 678 B10R1.31 CSc1cc(cs1)C(=O)N 62a_200000210301_100000747962 [0,0,0,0,1,0|2,1,0]=4 679 B10R1.31 CSc1cc(on1)C(=O)N 62a_100010589868_200000210301 [0,0,0,0,1,0|2,1,0]=4 680 B10R1.31 CSc1cc(on1)C(=O)N 62a_200000210301_100010589868 [0,0,0,0,1,0|2,1,0]=4 681 B10R1.31 CSc1ccc(s1)C(=O)N 62a_100000162267_200000210301 [0,0,0,0,1,0|2,1,0]=4 682 B10R1.31 CSc1coc(c1)C(=O)N 62a_200000210301_200009817131 [0,0,0,0,1,0|2,1,0]=4 683 B10R1.31 CSc1coc(c1)C(=O)N 62a_200009817131_200000210301 [0,0,0,0,1,0|2,1,0]=4 684 B10R1.31 CSc1csc(c1)C(=O)N 62a_100009812991_200000210301 [0,0,0,0,1,0|2,1,0]=4 685 B10R1.31 CSc1csc(c1)C(=O)N 62a_200000210301_100009812991 [0,0,0,0,1,0|2,1,0]=4 686 B10R1.31 CSc1ncc(s1)C(=O)N 62a_100010220624_200000210301 [0,0,0,0,1,0|2,1,0]=4 687 B10R1.31 CSc1ncc(s1)C(=O)N 62a_200000210301_100010220624 [0,0,0,0,1,0|2,1,0]=4 688 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_100000229580_200025704644 [0,0,0,0,1,0|2,1,0]=4 689 B10R1.31 [13CH3]Sc1c[nH]c(c1)C(=O)N 62a_200025704644_100000229580 [0,0,0,0,1,0|2,1,0]=4 690 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_100000747962_200025704644 [0,0,0,0,1,0|2,1,0]=4 691 B10R1.31 [13CH3]Sc1cc(cs1)C(=O)N 62a_200025704644_100000747962 [0,0,0,0,1,0|2,1,0]=4 692 B10R1.31 [13CH3]Sc1cc(on1)C(=O)N 62a_100010589868_200025704644 [0,0,0,0,1,0|2,1,0]=4 693 B10R1.31 [13CH3]Sc1cc(on1)C(=O)N 62a_200025704644_100010589868 [0,0,0,0,1,0|2,1,0]=4 694 B10R1.31 [13CH3]Sc1ccc(s1)C(=O)N 62a_100000162267_200025704644 [0,0,0,0,1,0|2,1,0]=4 695 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200009817131_200025704644 [0,0,0,0,1,0|2,1,0]=4 696 B10R1.31 [13CH3]Sc1coc(c1)C(=O)N 62a_200025704644_200009817131 [0,0,0,0,1,0|2,1,0]=4 697 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_100009812991_200025704644 [0,0,0,0,1,0|2,1,0]=4 698 B10R1.31 [13CH3]Sc1csc(c1)C(=O)N 62a_200025704644_100009812991 [0,0,0,0,1,0|2,1,0]=4 699 B10R1.31 [13CH3]Sc1ncc(s1)C(=O)N 62a_100010220624_200025704644 [0,0,0,0,1,0|2,1,0]=4 700 B10R1.31 [13CH3]Sc1ncc(s1)C(=O)N 62a_200025704644_100010220624 [0,0,0,0,1,0|2,1,0]=4 701 B10R1.39 C=C(C)c1ccnn1CC 271570a_100000694244_100000728327 [0,0,0,0,1,0|3,0,0]=4 702 B12R1.438 CC(=Cc1ccnc(c1)CN)C 271570a_100102525489_100000085674 [0,0,0,0,0,1|3,0,0]=4 703 B12R1.438 CC(=Cc1ccnc(c1)CO)C 271570a_100102525489_100009819072 [0,0,0,0,0,1|3,0,0]=4 704 B12R1.438 CC(=O)Nc1ccnc(c1)S[13CH3] 62a_200025704644_100000238608 [0,0,0,0,0,1|2,1,0]=4 705 B12R1.438 CCc1cc(ccn1)C=C(C)C 271570a_100102525489_100009820011 [0,0,0,0,0,1|2,0,0]=3 706 B12R1.438 CCc1cc(ccn1)NC(C)C 27a_100138425928_100009820011 [0,0,0,0,0,1|2,0,1]=4 707 B12R1.438 CCc1cc(ccn1)SC(C)C 62a_100000210206_100009820011 [0,0,0,0,0,1|2,0,1]=4 708 B12R1.438 CCc1cc(ccn1)SC(C)C 62a_100009820011_100000210206 [0,0,0,0,0,1|2,0,1]=4 709 B12R1.438 CCc1cc(ncn1)C=C(C)C 271570a_100102525489_100000744278 [0,0,0,0,0,1|3,0,0]=4 710 B12R1.438 CCc1cccc(c1)C=C(C)C 271570a_100102525489_100000684523 [0,0,0,0,0,1|3,0,0]=4 711 B12R1.438 CCc1cccc(c1)NC(=O)C 11a_100000211250_100015343762 [0,0,0,0,0,1|2,1,0]=4 712 B12R1.438 CCc1cccc(c1)NC(=O)C 1626a_100000211250_100015343762 [0,0,0,0,0,1|2,1,0]=4 713 B12R1.438 CCc1cccc(c1)NC(=O)C 22a_100000211250_100000070787 [0,0,0,0,0,1|2,1,0]=4 714 B12R1.438 CCc1cccc(c1)NC(=O)C 527a_100000211250_100103153847 [0,0,0,0,0,1|2,1,0]=4 715 B12R1.438 CNc1cc(ccn1)C=C(C)C 271570a_100102525489_100009819592 [0,0,0,0,0,1|3,0,0]=4 716 B12R1.438 CNc1cccc(c1)CC(=O)N 2230a_200011690101_200000210301 [0,0,0,0,0,1|2,1,0]=4 717 B12R1.438 CNc1cccc(c1)CC(=O)N 34a_200011690101_200000210301 [0,0,0,0,0,1|2,1,0]=4 718 B12R1.438 CNc1cccc(c1)NC(=O)N 34a_100000736001_200000210301 [0,0,0,0,0,1|2,1,0]=4 719 B12R1.438 COc1cc(ccn1)C=C(C)C 271570a_100102525489_100000117307 [0,0,0,0,0,1|3,0,0]=4 720 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [0,0,0,0,0,1|2,1,0]=4 721 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [0,0,0,0,0,1|2,1,0]=4 722 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [0,0,0,0,0,1|2,1,0]=4 723 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [0,0,0,0,0,1|2,1,0]=4 724 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [0,0,0,0,0,1|2,1,0]=4 725 B12R1.438 COc1cccc(c1)NC(=O)N 34a_100011219624_200000210301 [0,0,0,0,0,1|2,1,0]=4 726 B12R1.438 COc1cccc(c1)NC(=O)N 7a_100011219624_200000210301 [0,0,0,0,0,1|2,1,0]=4 727 B12R1.438 COc1cccc(c1)NC(=S)N 7a_100000023991_200000210301 [0,0,0,0,0,1|2,0,0]=3 728 B12R1.438 CSc1cc(ccn1)NC(=O)C 62a_200000210301_100000238608 [0,0,0,0,0,1|2,1,0]=4 729 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_100011586816_200000210301 [0,0,0,0,0,1|2,1,0]=4 730 B12R1.438 CSc1cccc(c1)CC(=O)N 62a_200000210301_100011586816 [0,0,0,0,0,1|2,1,0]=4 731 B12R1.438 CSc1cccc(c1)NC(=O)N 62a_200000210301_100000238923 [0,0,0,0,0,1|2,1,0]=4 732 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 2230a_200011690101_200025704644 [0,0,0,0,0,1|2,1,0]=4 733 B12R1.438 [13CH3]Nc1cccc(c1)CC(=O)N 34a_200011690101_200025704644 [0,0,0,0,0,1|2,1,0]=4 734 B12R1.438 [13CH3]Nc1cccc(c1)NC(=O)N 34a_100000736001_200025704644 [0,0,0,0,0,1|2,1,0]=4 735 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [0,0,0,0,0,1|2,1,0]=4 736 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [0,0,0,0,0,1|2,1,0]=4 737 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 34a_100011219624_200025704644 [0,0,0,0,0,1|2,1,0]=4 738 B12R1.438 [13CH3]Oc1cccc(c1)NC(=O)N 7a_100011219624_200025704644 [0,0,0,0,0,1|2,1,0]=4 739 B12R1.438 [13CH3]Oc1cccc(c1)NC(=S)N 7a_100000023991_200025704644 [0,0,0,0,0,1|2,0,0]=3 740 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_100011586816_200025704644 [0,0,0,0,0,1|2,1,0]=4 741 B12R1.438 [13CH3]Sc1cccc(c1)CC(=O)N 62a_200025704644_100011586816 [0,0,0,0,0,1|2,1,0]=4 742 B12R1.438 [13CH3]Sc1cccc(c1)NC(=O)N 62a_200025704644_100000238923 [0,0,0,0,0,1|2,1,0]=4 743 B9R1.2 C=Cc1cc(ccn1)N 271570a_100011290941_100009814236 [2,0,0,0,0,0|0,0,2]=4 744 B9R1.2 C=Cc1cc(ncn1)C 271570a_100011290941_100000744208 [2,0,0,0,0,0|2,0,0]=4 745 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,0,0,0,0,0|2,0,0]=4 746 B9R1.2 C=Cc1ccnc(c1)Br 271570a_100011290941_100009814637 [2,0,0,0,0,0|2,0,0]=4 747 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [2,0,0,0,0,0|1,0,0]=3 748 B9R1.2 C=Cc1ccnc(c1)Cl 271570a_100011290941_100000035001 [2,0,0,0,0,0|2,0,0]=4 749 B9R1.2 C=Cc1ccnc(c1)F 271570a_100011290941_100009816116 [2,0,0,0,0,0|2,0,0]=4 750 B9R1.2 C=Cc1ccnc(c1)N 271570a_100011290941_100000744379 [2,0,0,0,0,0|2,0,0]=4 751 B9R1.2 C=Cc1ccnc(n1)C 271570a_100011290941_100000749937 [2,0,0,0,0,0|2,0,0]=4 752 B9R1.2 CCc1cc(ccn1)O 271570a_203496583355_100009820011 [2,0,0,0,0,0|0,1,0]=3 753 B9R1.2 CCc1cc(ncn1)O 271570a_203496583355_100000744278 [2,0,0,0,0,0|1,1,0]=4 754 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|1,1,0]=4 755 B9R1.2 CNc1cc(ccn1)F 27a_100102657272_100000764206 [2,0,0,0,0,0|2,0,0]=4 756 B9R1.2 CNc1cc(ccn1)O 271570a_203496583355_100009819592 [2,0,0,0,0,0|1,1,0]=4 757 B9R1.2 CNc1cc(ncn1)N 27a_100102657272_100000701291 [2,0,0,0,0,0|2,0,0]=4 758 B9R1.2 CNc1ccnc(c1)C 27a_100102657272_100000758586 [2,0,0,0,0,0|2,0,0]=4 759 B9R1.2 CNc1nccc(n1)N 27a_100102657272_100000757536 [2,0,0,0,0,0|2,0,0]=4 760 B9R1.2 COc1cc(ccn1)O 271570a_203496583355_100000117307 [2,0,0,0,0,0|1,1,0]=4 761 B9R1.2 COc1cccc(c1)N 34a_100000210217_200000210301 [2,0,0,0,0,0|2,0,0]=4 762 B9R1.2 COc1ccnc(c1)C 34a_100000688365_200000210301 [2,0,0,0,0,0|2,0,0]=4 763 B9R1.2 CSc1cc(ccn1)C 62a_100000750283_200000210301 [2,0,0,0,0,0|1,0,1]=4 764 B9R1.2 CSc1cc(ccn1)C 62a_200000210301_100000750283 [2,0,0,0,0,0|1,0,1]=4 765 B9R1.2 CSc1cc(ccn1)Cl 62a_100010167805_200000210301 [2,0,0,0,0,0|2,0,0]=4 766 B9R1.2 CSc1cc(ccn1)Cl 62a_200000210301_100010167805 [2,0,0,0,0,0|2,0,0]=4 767 B9R1.2 CSc1cc(ccn1)F 62a_100000764206_200000210301 [2,0,0,0,0,0|2,0,0]=4 768 B9R1.2 CSc1cc(ccn1)F 62a_200000210301_100000764206 [2,0,0,0,0,0|2,0,0]=4 769 B9R1.2 CSc1cc(ccn1)N 62a_100009814236_200000210301 [2,0,0,0,0,0|1,0,0]=3 770 B9R1.2 CSc1cc(ccn1)N 62a_200000210301_100009814236 [2,0,0,0,0,0|1,0,0]=3 771 B9R1.2 CSc1cc(ccn1)O 62a_200000210301_100000762945 [2,0,0,0,0,0|1,1,0]=4 772 B9R1.2 CSc1cc(cnn1)N 62a_100011996757_200000210301 [2,0,0,0,0,0|2,0,0]=4 773 B9R1.2 CSc1cc(cnn1)N 62a_200000210301_100011996757 [2,0,0,0,0,0|2,0,0]=4 774 B9R1.2 CSc1cc(ncn1)N 62a_100000701291_200000210301 [2,0,0,0,0,0|2,0,0]=4 775 B9R1.2 CSc1cc(ncn1)N 62a_200000210301_100000701291 [2,0,0,0,0,0|2,0,0]=4 776 B9R1.2 CSc1cccc(c1)N 62a_100000210019_200000210301 [2,0,0,0,0,0|2,0,0]=4 777 B9R1.2 CSc1cccc(c1)N 62a_200000210301_100000210019 [2,0,0,0,0,0|2,0,0]=4 778 B9R1.2 CSc1ccnc(c1)C 62a_100000758586_200000210301 [2,0,0,0,0,0|2,0,0]=4 779 B9R1.2 CSc1ccnc(c1)C 62a_200000210301_100000758586 [2,0,0,0,0,0|2,0,0]=4 780 B9R1.2 CSc1nccc(n1)N 62a_100000757536_200000210301 [2,0,0,0,0,0|2,0,0]=4 781 B9R1.2 CSc1nccc(n1)N 62a_200000210301_100000757536 [2,0,0,0,0,0|2,0,0]=4 782 B9R1.2 Cc1cc(ccn1)O[13CH3] 34a_100000688365_200025704644 [2,0,0,0,0,0|2,0,0]=4 783 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_100000758586_200025704644 [2,0,0,0,0,0|2,0,0]=4 784 B9R1.2 Cc1cc(ccn1)S[13CH3] 62a_200025704644_100000758586 [2,0,0,0,0,0|2,0,0]=4 785 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_100000750283_200025704644 [2,0,0,0,0,0|1,0,1]=4 786 B9R1.2 Cc1ccnc(c1)S[13CH3] 62a_200025704644_100000750283 [2,0,0,0,0,0|1,0,1]=4 787 B9R1.2 NCc1cc(ccn1)O 271570a_203496583355_100000085674 [2,0,0,0,0,0|1,1,0]=4 788 B9R1.2 O=Cc1ccnc(c1)O 271570a_203496583355_100011290808 [2,0,0,0,0,0|1,1,0]=4 789 B9R1.2 OCc1cc(ccn1)O 271570a_203496583355_100009819072 [2,0,0,0,0,0|1,1,0]=4 790 B9R1.2 [13CH3]Oc1cccc(c1)N 34a_100000210217_200025704644 [2,0,0,0,0,0|2,0,0]=4 791 B9R1.2 [13CH3]Sc1cc(ccn1)Cl 62a_100010167805_200025704644 [2,0,0,0,0,0|2,0,0]=4 792 B9R1.2 [13CH3]Sc1cc(ccn1)Cl 62a_200025704644_100010167805 [2,0,0,0,0,0|2,0,0]=4 793 B9R1.2 [13CH3]Sc1cc(ccn1)F 62a_100000764206_200025704644 [2,0,0,0,0,0|2,0,0]=4 794 B9R1.2 [13CH3]Sc1cc(ccn1)F 62a_200025704644_100000764206 [2,0,0,0,0,0|2,0,0]=4 795 B9R1.2 [13CH3]Sc1cc(ccn1)N 62a_100009814236_200025704644 [2,0,0,0,0,0|1,0,0]=3 796 B9R1.2 [13CH3]Sc1cc(ccn1)N 62a_200025704644_100009814236 [2,0,0,0,0,0|1,0,0]=3 797 B9R1.2 [13CH3]Sc1cc(ccn1)O 62a_200025704644_100000762945 [2,0,0,0,0,0|1,1,0]=4 798 B9R1.2 [13CH3]Sc1cc(cnn1)N 62a_100011996757_200025704644 [2,0,0,0,0,0|2,0,0]=4 799 B9R1.2 [13CH3]Sc1cc(cnn1)N 62a_200025704644_100011996757 [2,0,0,0,0,0|2,0,0]=4 800 B9R1.2 [13CH3]Sc1cc(ncn1)N 62a_100000701291_200025704644 [2,0,0,0,0,0|2,0,0]=4 801 B9R1.2 [13CH3]Sc1cc(ncn1)N 62a_200025704644_100000701291 [2,0,0,0,0,0|2,0,0]=4 802 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_100000210019_200025704644 [2,0,0,0,0,0|2,0,0]=4 803 B9R1.2 [13CH3]Sc1cccc(c1)N 62a_200025704644_100000210019 [2,0,0,0,0,0|2,0,0]=4 804 B9R1.2 [13CH3]Sc1nccc(n1)N 62a_100000757536_200025704644 [2,0,0,0,0,0|2,0,0]=4 805 B9R1.2 [13CH3]Sc1nccc(n1)N 62a_200025704644_100000757536 [2,0,0,0,0,0|2,0,0]=4 806 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [2,0,0,0,0,0|2,0,0]=4 807 B11R1.21 Cc1cc(ccc1O)C(=O)N 271570a_203496583355_100011218126 [1,1,0,0,0,0|1,1,0]=4 808 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [1,1,0,0,0,0|1,1,0]=4 809 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [1,1,0,0,0,0|1,1,0]=4 810 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [1,1,0,0,0,0|1,1,0]=4 811 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [1,1,0,0,0,0|1,1,0]=4 812 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [1,1,0,0,0,0|1,1,0]=4 813 B11R1.23 CNC(C)c1ccnc(c1)C 269862a_106832991636_100011998260 [1,1,0,0,0,0|1,0,1]=4 814 B11R1.23 NNC(=O)c1ccnc(c1)O 271570a_203496583355_100000021280 [1,1,0,0,0,0|1,1,0]=4 815 B11R1.74 C=C(C)c1cc(nc(c1)C)C 271570a_100000694244_100009816552 [1,1,0,0,0,0|2,0,0]=4 816 B11R1.74 C=C(C)c1cc(nc(c1)F)C 271570a_100000694244_100010006595 [1,1,0,0,0,0|2,0,0]=4 817 B11R1.74 C=C(C)c1cc(nc(c1)N)C 271570a_100000694244_100000076705 [1,1,0,0,0,0|2,0,0]=4 818 B11R1.74 CC(=O)c1cc(nc(c1)O)C 271570a_203496583355_100009884196 [1,1,0,0,0,0|1,1,0]=4 819 B11R1.74 Cc1cc(cc(c1)C(=O)N)O 271570a_203496583355_200012348365 [1,1,0,0,0,0|1,1,0]=4 820 B11R1.159 C=C(C)c1ccnc(c1C)C 271570a_100000694244_100009846815 [1,1,0,0,0,0|2,0,0]=4 821 B11R1.159 C=C(C)c1ccnc(c1Cl)C 271570a_100000694244_100000698670 [1,1,0,0,0,0|2,0,0]=4 822 B11R1.159 C=C(C)c1ccnc(c1F)C 271570a_100000694244_100009849794 [1,1,0,0,0,0|2,0,0]=4 823 B11R1.159 C=C(C)c1ccnc(c1N)C 271570a_100000694244_100009885578 [1,1,0,0,0,0|2,0,0]=4 824 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,1,0,0,0,0|1,1,0]=4 825 B11R1.159 NC(=O)c1ccnc(c1N)O 271570a_203496583355_100000080204 [1,1,0,0,0,0|1,1,0]=4 826 B11R1.167 C=C(C)c1cc(ncc1C)C 271570a_100000694244_100009862788 [1,1,0,0,0,0|2,0,0]=4 827 B11R1.167 C=C(C)c1cc(ncc1F)C 271570a_100000694244_100009867690 [1,1,0,0,0,0|2,0,0]=4 828 B11R1.167 C=C(C)c1cc(ncc1O)C 271570a_100000694244_100009843476 [1,1,0,0,0,0|2,0,0]=4 829 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [1,1,0,0,0,0|1,1,0]=4 830 B11R1.167 NC(=O)c1cc(ncc1F)O 271570a_203496583355_100015943597 [1,1,0,0,0,0|1,1,0]=4 831 B11R1.167 NC(=O)c1cc(ncc1N)O 271570a_203496583355_100012003536 [1,1,0,0,0,0|1,1,0]=4 832 B11R1.9 C=Cc1cc(cc(c1)CC)N 271570a_100011290941_100010074814 [1,1,0,0,0,0|2,0,0]=4 833 B11R1.9 C=Cc1cc(nc(c1)CN)C 271570a_100011290941_100010178683 [1,1,0,0,0,0|2,0,0]=4 834 B11R1.9 C=Cc1cc(nc(c1)CO)C 271570a_100011290941_100010178681 [1,1,0,0,0,0|2,0,0]=4 835 B11R1.9 C=Cc1cc(nc(c1)OC)C 271570a_100011290941_100010067692 [1,1,0,0,0,0|2,0,0]=4 836 B11R1.9 C=Cc1cc(nc(c1)OC)N 271570a_100011290941_100010136845 [1,1,0,0,0,0|2,0,0]=4 837 B11R1.9 C=Cc1cc(nc(n1)C)CC 271570a_100011290941_100000761995 [1,1,0,0,0,0|2,0,0]=4 838 B11R1.9 C=Cc1cc(nc(n1)CC)C 271570a_100011290941_100000687827 [1,1,0,0,0,0|2,0,0]=4 839 B11R1.9 C=Cc1cc(nc(n1)N)CC 271570a_100011290941_100000069509 [1,1,0,0,0,0|2,0,0]=4 840 B11R1.9 COc1cc(cc(n1)O)CN 271570a_203496583355_100009841630 [1,1,0,0,0,0|1,0,1]=4 841 B11R1.189 C=C=Cc1cc(ncn1)CC 271570a_100015277604_100000744278 [1,1,0,0,0,0|2,0,0]=4 842 B11R1.189 C=C=Cc1cccc(c1)CC 271570a_100015277604_100000684523 [1,1,0,0,0,0|2,0,0]=4 843 B11R1.189 C=C=Cc1ccnc(c1)CC 271570a_100015277604_100009820011 [1,1,0,0,0,0|1,0,0]=3 844 B11R1.189 C=C=Cc1ccnc(c1)CN 271570a_100015277604_100000085674 [1,1,0,0,0,0|2,0,0]=4 845 B11R1.189 C=C=Cc1ccnc(c1)CO 271570a_100015277604_100009819072 [1,1,0,0,0,0|2,0,0]=4 846 B11R1.189 C=C=Cc1ccnc(c1)NC 271570a_100015277604_100009819592 [1,1,0,0,0,0|2,0,0]=4 847 B11R1.189 C=C=Cc1ccnc(c1)OC 271570a_100015277604_100000117307 [1,1,0,0,0,0|2,0,0]=4 848 B11R1.189 C=Cc1cc(ncn1)COC 271570a_100011290941_100000688101 [1,1,0,0,0,0|2,0,0]=4 849 B11R1.189 C=Cc1cc(ncn1)NCC 271570a_100011290941_200000242512 [1,1,0,0,0,0|2,0,0]=4 850 B11R1.189 C=Cc1cc(ncn1)OCC 271570a_100011290941_100000765465 [1,1,0,0,0,0|2,0,0]=4 851 B11R1.189 C=Cc1cccc(c1)CCC 271570a_100011290941_100000694964 [1,1,0,0,0,0|2,0,0]=4 852 B11R1.189 C=Cc1cccc(c1)CCN 271570a_100011290941_100011207229 [1,1,0,0,0,0|2,0,0]=4 853 B11R1.189 C=Cc1cccc(c1)CCO 271570a_100011290941_100011217444 [1,1,0,0,0,0|2,0,0]=4 854 B11R1.189 C=Cc1cccc(c1)CNC 26a_100102657272_100011309434 [1,1,0,0,0,0|2,0,0]=4 855 B11R1.189 C=Cc1cccc(c1)CNC 270004a_106832991635_100011218069 [1,1,0,0,0,0|2,0,0]=4 856 B11R1.189 C=Cc1cccc(c1)CNC 271570a_100011290941_100000187585 [1,1,0,0,0,0|2,0,0]=4 857 B11R1.189 C=Cc1cccc(c1)COC 271570a_100011290941_100011493687 [1,1,0,0,0,0|2,0,0]=4 858 B11R1.189 C=Cc1cccc(c1)NCC 271570a_100011290941_100000738899 [1,1,0,0,0,0|2,0,0]=4 859 B11R1.189 C=Cc1cccc(c1)NCC 34a_100011827668_100000210202 [1,1,0,0,0,0|2,0,0]=4 860 B11R1.189 C=Cc1cccc(c1)OCC 271570a_100011290941_100000170002 [1,1,0,0,0,0|2,0,0]=4 861 B11R1.189 C=Cc1cccc(c1)OCC 34a_100011309434_100000210202 [1,1,0,0,0,0|2,0,0]=4 862 B11R1.189 C=Cc1cccc(c1)OCC 7a_100011309434_100000210202 [1,1,0,0,0,0|2,0,0]=4 863 B11R1.189 C=Cc1cccc(c1)SCC 271570a_100011290941_100000703699 [1,1,0,0,0,0|2,0,0]=4 864 B11R1.189 C=Cc1cccc(c1)SCC 62a_100000210202_100011215241 [1,1,0,0,0,0|2,0,0]=4 865 B11R1.189 C=Cc1cccc(c1)SCC 62a_100011215241_100000210202 [1,1,0,0,0,0|2,0,0]=4 866 B11R1.189 C=Cc1ccnc(c1)CC#N 271570a_100011290941_100009875060 [1,1,0,0,0,0|1,0,1]=4 867 B11R1.189 C=Cc1ccnc(c1)CNC 271570a_100011290941_100102954512 [1,1,0,0,0,0|1,0,0]=3 868 B11R1.189 C=Cc1ccnc(c1)OCC 271570a_100011290941_100009995528 [1,1,0,0,0,0|1,0,0]=3 869 B11R1.189 C=Cc1ccnc(n1)NCC 271570a_100011290941_100012002086 [1,1,0,0,0,0|2,0,0]=4 870 B11R1.189 CC=Cc1cc(ccn1)C=O 271570a_100016259895_100011290808 [1,1,0,0,0,0|0,1,1]=4 871 B11R1.189 CC=Cc1cc(ncn1)CC 271570a_100016259895_100000744278 [1,1,0,0,0,0|2,0,0]=4 872 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,1,0,0,0,0|2,0,0]=4 873 B11R1.189 CC=Cc1ccnc(c1)CC 271570a_100016259895_100009820011 [1,1,0,0,0,0|1,0,0]=3 874 B11R1.189 CC=Cc1ccnc(c1)CN 271570a_100016259895_100000085674 [1,1,0,0,0,0|2,0,0]=4 875 B11R1.189 CC=Cc1ccnc(c1)CO 271570a_100016259895_100009819072 [1,1,0,0,0,0|2,0,0]=4 876 B11R1.189 CC=Cc1ccnc(c1)NC 271570a_100016259895_100009819592 [1,1,0,0,0,0|2,0,0]=4 877 B11R1.189 CC=Cc1ccnc(c1)OC 271570a_100016259895_100000117307 [1,1,0,0,0,0|2,0,0]=4 878 B11R1.189 CCNc1cc(ccn1)C#N 27a_100015525214_100011291639 [1,1,0,0,0,0|0,0,2]=4 879 B11R1.189 CCNc1cc(ccn1)CC 27a_100015525214_100009817561 [1,1,0,0,0,0|1,0,1]=4 880 B11R1.189 CCNc1cc(ncn1)NN 27a_100015525214_100000242035 [1,1,0,0,0,0|2,0,0]=4 881 B11R1.189 CCNc1ccnc(c1)CC 27a_100015525214_100009820011 [1,1,0,0,0,0|1,0,1]=4 882 B11R1.189 CCOc1cc(ccn1)CN 34a_100000748557_100000210202 [1,1,0,0,0,0|0,0,1]=3 883 B11R1.189 CCOc1cc(ccn1)SC 62a_100009995528_200000210301 [1,1,0,0,0,0|2,0,0]=4 884 B11R1.189 CCOc1cc(ccn1)SC 62a_200000210301_100009995528 [1,1,0,0,0,0|2,0,0]=4 885 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_100009995528_200025704644 [1,1,0,0,0,0|2,0,0]=4 886 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_200025704644_100009995528 [1,1,0,0,0,0|2,0,0]=4 887 B11R1.189 CCOc1cccc(c1)CN 34a_100000743036_100000210202 [1,1,0,0,0,0|1,0,1]=4 888 B11R1.189 CCSc1cc(ccn1)C#N 62a_100000210202_100011291639 [1,1,0,0,0,0|0,0,2]=4 889 B11R1.189 CCSc1cc(ccn1)C=O 62a_100000210202_100011290808 [1,1,0,0,0,0|0,1,0]=3 890 B11R1.189 CCSc1cc(ccn1)C=O 62a_100011290808_100000210202 [1,1,0,0,0,0|0,1,0]=3 891 B11R1.189 CCSc1cc(ccn1)CC 62a_100000210202_100009817561 [1,1,0,0,0,0|1,0,1]=4 892 B11R1.189 CCSc1cc(ccn1)CC 62a_100009817561_100000210202 [1,1,0,0,0,0|1,0,1]=4 893 B11R1.189 CCSc1cc(ccn1)CN 62a_100000210202_100025757509 [1,1,0,0,0,0|0,0,1]=3 894 B11R1.189 CCSc1cc(ccn1)CN 62a_100025757509_100000210202 [1,1,0,0,0,0|0,0,1]=3 895 B11R1.189 CCSc1cc(ccn1)CO 62a_100000210202_100009814636 [1,1,0,0,0,0|0,1,1]=4 896 B11R1.189 CCSc1cc(ccn1)CO 62a_100009814636_100000210202 [1,1,0,0,0,0|0,1,1]=4 897 B11R1.189 CCSc1cc(ccn1)NC 62a_100000210202_100009869472 [1,1,0,0,0,0|2,0,0]=4 898 B11R1.189 CCSc1cc(ccn1)NC 62a_100009869472_100000210202 [1,1,0,0,0,0|2,0,0]=4 899 B11R1.189 CCSc1cc(ccn1)NN 62a_100000089018_100000210202 [1,1,0,0,0,0|1,0,0]=3 900 B11R1.189 CCSc1cc(ccn1)NN 62a_100000210202_100000089018 [1,1,0,0,0,0|1,0,0]=3 901 B11R1.189 CCSc1cc(ccn1)OC 62a_100000210202_100011216251 [1,1,0,0,0,0|2,0,0]=4 902 B11R1.189 CCSc1cc(ccn1)OC 62a_100009817693_100000210202 [1,1,0,0,0,0|2,0,0]=4 903 B11R1.189 CCSc1cc(ccn1)SC 62a_100000210202_100010883326 [1,1,0,0,0,0|2,0,0]=4 904 B11R1.189 CCSc1cc(ccn1)SC 62a_100010883326_100000210202 [1,1,0,0,0,0|2,0,0]=4 905 B11R1.189 CCSc1cc(ncn1)NN 62a_100000210202_100000242035 [1,1,0,0,0,0|2,0,0]=4 906 B11R1.189 CCSc1cc(ncn1)NN 62a_100000242035_100000210202 [1,1,0,0,0,0|2,0,0]=4 907 B11R1.189 CCSc1cccc(c1)C=O 62a_100000014684_100000210202 [1,1,0,0,0,0|1,1,0]=4 908 B11R1.189 CCSc1cccc(c1)C=O 62a_100000210202_100000014684 [1,1,0,0,0,0|1,1,0]=4 909 B11R1.189 CCSc1cccc(c1)CN 62a_100000106179_100000210202 [1,1,0,0,0,0|1,0,1]=4 910 B11R1.189 CCSc1cccc(c1)CN 62a_100000210202_100000106179 [1,1,0,0,0,0|1,0,1]=4 911 B11R1.189 CCSc1cccc(c1)NN 62a_100000210202_100000217339 [1,1,0,0,0,0|2,0,0]=4 912 B11R1.189 CCSc1cccc(c1)NN 62a_100000217339_100000210202 [1,1,0,0,0,0|2,0,0]=4 913 B11R1.189 CCSc1ccnc(c1)CC 62a_100000210202_100009820011 [1,1,0,0,0,0|1,0,1]=4 914 B11R1.189 CCSc1ccnc(c1)CC 62a_100009820011_100000210202 [1,1,0,0,0,0|1,0,1]=4 915 B11R1.189 CCc1cc(ccn1)SCF 62a_100009820011_100015361967 [1,1,0,0,0,0|1,0,1]=4 916 B11R1.189 CCc1cc(ccn1)SCF 62a_100015361967_100009820011 [1,1,0,0,0,0|1,0,1]=4 917 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [1,1,0,0,0,0|1,0,1]=4 918 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [1,1,0,0,0,0|1,0,1]=4 919 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [1,1,0,0,0,0|1,0,1]=4 920 B11R1.189 CNCc1cc(ccn1)C#N 270004a_106832991635_100009883299 [1,1,0,0,0,0|0,0,2]=4 921 B11R1.189 CNCc1cc(ccn1)OC 207a_100102657272_100000087537 [1,1,0,0,0,0|2,0,0]=4 922 B11R1.189 CNCc1cc(ccn1)OC 2230a_106832991635_100000752681 [1,1,0,0,0,0|2,0,0]=4 923 B11R1.189 CNCc1cc(ccn1)OC 270004a_106832991635_100000087537 [1,1,0,0,0,0|2,0,0]=4 924 B11R1.189 CNCc1cc(ccn1)OC 34a_100102657272_100000752681 [1,1,0,0,0,0|2,0,0]=4 925 B11R1.189 CNCc1cc(ccn1)OC 7a_106832991635_100000752681 [1,1,0,0,0,0|2,0,0]=4 926 B11R1.189 CNCc1cc(ccn1)SC 62a_100102954512_200000210301 [1,1,0,0,0,0|2,0,0]=4 927 B11R1.189 CNCc1cc(ccn1)SC 62a_200000210301_100102954512 [1,1,0,0,0,0|2,0,0]=4 928 B11R1.189 CNCc1cc(ccn1)S[13CH3] 62a_100102954512_200025704644 [1,1,0,0,0,0|2,0,0]=4 929 B11R1.189 CNCc1cc(ccn1)S[13CH3] 62a_200025704644_100102954512 [1,1,0,0,0,0|2,0,0]=4 930 B11R1.189 CNCc1cccc(c1)C=O 2230a_106832991635_100009816774 [1,1,0,0,0,0|1,1,0]=4 931 B11R1.189 CNCc1cccc(c1)C=O 34a_100102657272_100009816774 [1,1,0,0,0,0|1,1,0]=4 932 B11R1.189 CNCc1cccc(c1)C=O 7a_106832991635_100009816774 [1,1,0,0,0,0|1,1,0]=4 933 B11R1.189 CNCc1ccnc(c1)OC 207a_100102657272_100000050969 [1,1,0,0,0,0|1,0,1]=4 934 B11R1.189 CNCc1ccnc(c1)OC 2230a_106832991635_100103152439 [1,1,0,0,0,0|1,0,1]=4 935 B11R1.189 CNCc1ccnc(c1)OC 270004a_106832991635_100000050969 [1,1,0,0,0,0|1,0,1]=4 936 B11R1.189 CNCc1ccnc(c1)OC 34a_100102657272_100103152439 [1,1,0,0,0,0|1,0,1]=4 937 B11R1.189 CNCc1ccnc(c1)OC 7a_106832991635_100103152439 [1,1,0,0,0,0|1,0,1]=4 938 B11R1.189 COCc1cc(ccn1)CN 34a_100020589248_200000210301 [1,1,0,0,0,0|0,0,1]=3 939 B11R1.189 COCc1cc(ccn1)OC 34a_100000749536_200000210301 [1,1,0,0,0,0|2,0,0]=4 940 B11R1.189 COCc1cc(ccn1)OC 34a_100138415774_100000752681 [1,1,0,0,0,0|2,0,0]=4 941 B11R1.189 COCc1cccc(c1)C=O 34a_100138415774_100009816774 [1,1,0,0,0,0|1,1,0]=4 942 B11R1.189 COCc1cccc(c1)CN 34a_100011269909_200000210301 [1,1,0,0,0,0|1,0,1]=4 943 B11R1.189 COc1ccnc(c1)CO[13CH3] 34a_100000749536_200025704644 [1,1,0,0,0,0|2,0,0]=4 944 B11R1.189 COc1ccnc(c1)CSC 62a_100000752681_200000210301 [1,1,0,0,0,0|2,0,0]=4 945 B11R1.189 COc1ccnc(c1)CSC 62a_200000210301_100000752681 [1,1,0,0,0,0|2,0,0]=4 946 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_100000752681_200025704644 [1,1,0,0,0,0|2,0,0]=4 947 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_200025704644_100000752681 [1,1,0,0,0,0|2,0,0]=4 948 B11R1.189 CSCc1cccc(c1)C=O 62a_100009816774_200000210301 [1,1,0,0,0,0|1,1,0]=4 949 B11R1.189 CSCc1cccc(c1)C=O 62a_200000210301_100009816774 [1,1,0,0,0,0|1,1,0]=4 950 B11R1.189 NCc1ccnc(c1)OCF 34a_100000748557_100015361967 [1,1,0,0,0,0|1,0,1]=4 951 B11R1.189 NCc1ccnc(c1)SCF 62a_100015361967_100025757509 [1,1,0,0,0,0|1,0,1]=4 952 B11R1.189 NCc1ccnc(c1)SCF 62a_100025757509_100015361967 [1,1,0,0,0,0|1,0,1]=4 953 B11R1.189 NNc1ccnc(c1)SCF 62a_100000089018_100015361967 [1,1,0,0,0,0|2,0,0]=4 954 B11R1.189 NNc1ccnc(c1)SCF 62a_100015361967_100000089018 [1,1,0,0,0,0|2,0,0]=4 955 B11R1.189 O=Cc1ccnc(c1)SCF 62a_100011290808_100015361967 [1,1,0,0,0,0|1,1,0]=4 956 B11R1.189 O=Cc1ccnc(c1)SCF 62a_100015361967_100011290808 [1,1,0,0,0,0|1,1,0]=4 957 B11R1.189 [13CH3]OCc1cc(ccn1)CN 34a_100020589248_200025704644 [1,1,0,0,0,0|0,0,1]=3 958 B11R1.189 [13CH3]OCc1cccc(c1)CN 34a_100011269909_200025704644 [1,1,0,0,0,0|1,0,1]=4 959 B11R1.189 [13CH3]SCc1cccc(c1)C=O 62a_100009816774_200025704644 [1,1,0,0,0,0|1,1,0]=4 960 B11R1.189 [13CH3]SCc1cccc(c1)C=O 62a_200025704644_100009816774 [1,1,0,0,0,0|1,1,0]=4 961 B11R1.267 C=Cc1cccc(c1O)CC 271570a_100011290941_200010001580 [1,1,0,0,0,0|2,0,0]=4 962 B11R1.267 C=Cc1ccnc(c1C)OC 271570a_100011290941_100010068544 [1,1,0,0,0,0|2,0,0]=4 963 B11R1.267 C=Cc1ccnc(c1F)OC 271570a_100011290941_100009885657 [1,1,0,0,0,0|2,0,0]=4 964 B11R1.267 C=Cc1ncnc(c1F)CC 271570a_100011290941_100000685531 [1,1,0,0,0,0|2,0,0]=4 965 B11R1.267 CSc1nccc(c1C)C=O 62a_100000096011_200000210301 [1,1,0,0,0,0|1,1,0]=4 966 B11R1.267 CSc1nccc(c1C)C=O 62a_200000210301_100000096011 [1,1,0,0,0,0|1,1,0]=4 967 B11R1.267 CSc1nccc(c1F)C=O 62a_100000050688_200000210301 [1,1,0,0,0,0|1,1,0]=4 968 B11R1.267 CSc1nccc(c1F)C=O 62a_200000210301_100000050688 [1,1,0,0,0,0|1,1,0]=4 969 B11R1.267 Cc1c(ccnc1S[13CH3])C=O 62a_100000096011_200025704644 [1,1,0,0,0,0|1,1,0]=4 970 B11R1.267 Cc1c(ccnc1S[13CH3])C=O 62a_200025704644_100000096011 [1,1,0,0,0,0|1,1,0]=4 971 B11R1.267 [13CH3]Sc1nccc(c1F)C=O 62a_100000050688_200025704644 [1,1,0,0,0,0|1,1,0]=4 972 B11R1.267 [13CH3]Sc1nccc(c1F)C=O 62a_200025704644_100000050688 [1,1,0,0,0,0|1,1,0]=4 973 B11R1.280 C=Cc1cc(ccc1F)CC 271570a_100011290941_200010244628 [1,1,0,0,0,0|2,0,0]=4 974 B11R1.280 C=Cc1cc(ccc1N)CC 271570a_100011290941_100012339725 [1,1,0,0,0,0|2,0,0]=4 975 B11R1.280 C=Cc1cc(ccc1O)CC 271570a_100011290941_100012339963 [1,1,0,0,0,0|2,0,0]=4 976 B11R1.280 C=Cc1cc(ncc1C)CO 271570a_100011290941_100010113723 [1,1,0,0,0,0|2,0,0]=4 977 B11R1.280 C=Cc1cc(ncc1C)OC 271570a_100011290941_100010068546 [1,1,0,0,0,0|2,0,0]=4 978 B11R1.280 C=Cc1cc(ncc1Cl)OC 271570a_100011290941_100010068019 [1,1,0,0,0,0|2,0,0]=4 979 B11R1.280 C=Cc1cc(ncc1F)OC 271570a_100011290941_100010160775 [1,1,0,0,0,0|2,0,0]=4 980 B11R1.280 C=Cc1ccc(c(c1)CC)Br 271570a_100011290941_100010244631 [1,1,0,0,0,0|2,0,0]=4 981 B11R1.280 C=Cc1ccc(c(c1)CC)F 271570a_100011290941_100010244625 [1,1,0,0,0,0|2,0,0]=4 982 B11R1.280 C=Cc1ccc(c(c1)CC)N 271570a_100011290941_100000686106 [1,1,0,0,0,0|2,0,0]=4 983 B11R1.280 C=Cc1ccc(c(c1)CC)O 271570a_100011290941_100012338938 [1,1,0,0,0,0|2,0,0]=4 984 B11R1.280 COc1cc(c(cn1)O)C=O 271570a_203496583355_100010171658 [1,1,0,0,0,0|1,1,0]=4 985 B11R1.280 CSc1cc(c(cn1)Br)C=O 62a_200000210301_200135154921 [1,1,0,0,0,0|1,1,0]=4 986 B11R1.280 CSc1cc(c(cn1)Br)C=O 62a_200135154921_200000210301 [1,1,0,0,0,0|1,1,0]=4 987 B11R1.280 CSc1cc(c(cn1)F)C=O 62a_100000707870_200000210301 [1,1,0,0,0,0|1,1,0]=4 988 B11R1.280 CSc1cc(c(cn1)F)C=O 62a_200000210301_100000707870 [1,1,0,0,0,0|1,1,0]=4 989 B11R1.280 CSc1cc(c(cn1)O)C=O 62a_200000210301_100000048449 [1,1,0,0,0,0|1,1,0]=4 990 B11R1.280 [13CH3]Sc1cc(c(cn1)Br)C=O 62a_200025704644_200135154921 [1,1,0,0,0,0|1,1,0]=4 991 B11R1.280 [13CH3]Sc1cc(c(cn1)Br)C=O 62a_200135154921_200025704644 [1,1,0,0,0,0|1,1,0]=4 992 B11R1.280 [13CH3]Sc1cc(c(cn1)F)C=O 62a_100000707870_200025704644 [1,1,0,0,0,0|1,1,0]=4 993 B11R1.280 [13CH3]Sc1cc(c(cn1)F)C=O 62a_200025704644_100000707870 [1,1,0,0,0,0|1,1,0]=4 994 B11R1.280 [13CH3]Sc1cc(c(cn1)O)C=O 62a_200025704644_100000048449 [1,1,0,0,0,0|1,1,0]=4 995 B11R1.124 CCNc1ncc(s1)C(=O)N 27a_100015525214_100010220624 [0,1,0,0,1,0|1,1,0]=4 996 B11R1.124 CCSc1c[nH]c(c1)C(=O)N 62a_100000210202_100000229580 [0,1,0,0,1,0|1,1,0]=4 997 B11R1.124 CCSc1c[nH]c(c1)C(=O)N 62a_100000229580_100000210202 [0,1,0,0,1,0|1,1,0]=4 998 B11R1.124 CCSc1cc(cs1)C(=O)N 62a_100000210202_100000747962 [0,1,0,0,1,0|1,1,0]=4 999 B11R1.124 CCSc1cc(cs1)C(=O)N 62a_100000747962_100000210202 [0,1,0,0,1,0|1,1,0]=4 1000 B11R1.124 CCSc1cc(on1)C(=O)N 62a_100000210202_100010589868 [0,1,0,0,1,0|1,1,0]=4 1001 B11R1.124 CCSc1cc(on1)C(=O)N 62a_100010589868_100000210202 [0,1,0,0,1,0|1,1,0]=4 1002 B11R1.124 CCSc1ccc(s1)C(=O)N 62a_100000162267_100000210202 [0,1,0,0,1,0|1,1,0]=4 1003 B11R1.124 CCSc1coc(c1)C(=O)N 62a_100000210202_200009817131 [0,1,0,0,1,0|1,1,0]=4 1004 B11R1.124 CCSc1coc(c1)C(=O)N 62a_200009817131_100000210202 [0,1,0,0,1,0|1,1,0]=4 1005 B11R1.124 CCSc1csc(c1)C(=O)N 62a_100000210202_100009812991 [0,1,0,0,1,0|1,1,0]=4 1006 B11R1.124 CCSc1csc(c1)C(=O)N 62a_100009812991_100000210202 [0,1,0,0,1,0|1,1,0]=4 1007 B11R1.124 CCSc1ncc(s1)C(=O)N 62a_100000210202_100010220624 [0,1,0,0,1,0|1,1,0]=4 1008 B11R1.124 CCSc1ncc(s1)C(=O)N 62a_100010220624_100000210202 [0,1,0,0,1,0|1,1,0]=4 1009 B13R1.81 CCc1cccc(c1)NC(=O)NC 2430a_100000211250_100102657272 [0,1,0,0,0,1|1,1,0]=4 1010 B13R1.81 CCc1cccc(c1)NC(=O)NC 512a_100000211250_100102657272 [0,1,0,0,0,1|1,1,0]=4 1011 B13R1.81 CNC(=O)Cc1ccnc(c1)OC 11a_106832991635_100000718155 [0,1,0,0,0,1|1,1,0]=4 1012 B13R1.81 CNC(=O)Cc1ccnc(c1)OC 240690a_100102657272_100000718155 [0,1,0,0,0,1|1,1,0]=4 1013 B13R1.373 CCNc1cccc(c1)CC(=O)N 2230a_200011690101_100000210202 [0,1,0,0,0,1|1,1,0]=4 1014 B13R1.373 CCNc1cccc(c1)CC(=O)N 34a_200011690101_100000210202 [0,1,0,0,0,1|1,1,0]=4 1015 B13R1.373 CCNc1cccc(c1)NC(=O)N 34a_100000736001_100000210202 [0,1,0,0,0,1|1,1,0]=4 1016 B13R1.373 CCOc1cc(ccn1)C=C(C)C 271570a_100102525489_100009995528 [0,1,0,0,0,1|2,0,0]=4 1017 B13R1.373 CCOc1cccc(c1)CC(=O)N 34a_200000747573_100000210202 [0,1,0,0,0,1|1,1,0]=4 1018 B13R1.373 CCOc1cccc(c1)CC(=O)N 7a_200000747573_100000210202 [0,1,0,0,0,1|1,1,0]=4 1019 B13R1.373 CCOc1cccc(c1)NC(=O)N 34a_100011219624_100000210202 [0,1,0,0,0,1|1,1,0]=4 1020 B13R1.373 CCOc1cccc(c1)NC(=O)N 7a_100011219624_100000210202 [0,1,0,0,0,1|1,1,0]=4 1021 B13R1.373 CCOc1cccc(c1)NC(=S)N 7a_100000023991_100000210202 [0,1,0,0,0,1|1,0,0]=3 1022 B13R1.373 CCSc1cc(ccn1)NC(=O)C 62a_100000210202_100000238608 [0,1,0,0,0,1|1,1,0]=4 1023 B13R1.373 CCSc1cccc(c1)CC(=O)N 62a_100000210202_100011586816 [0,1,0,0,0,1|1,1,0]=4 1024 B13R1.373 CCSc1cccc(c1)CC(=O)N 62a_100011586816_100000210202 [0,1,0,0,0,1|1,1,0]=4 1025 B13R1.373 CCSc1cccc(c1)NC(=O)N 62a_100000210202_100000238923 [0,1,0,0,0,1|1,1,0]=4 1026 B13R1.373 CNCc1cc(ccn1)C=C(C)C 271570a_100102525489_100102954512 [0,1,0,0,0,1|2,0,0]=4 1027 B13R1.373 NC(=S)Nc1cccc(c1)OCF 7a_100000023991_100015361967 [0,1,0,0,0,1|2,0,0]=4 1028 B13R1.587 CC(=Cc1ccnc(c1)C(C)C)C 271570a_100102525489_100010237922 [0,1,0,0,0,1|2,0,0]=4 1029 B13R1.587 CC(=Cc1ccnc(c1)C(C)O)C 271570a_100102525489_100000144657 [0,1,0,0,0,1|2,0,0]=4 1030 B13R1.587 CC(=O)c1cccc(c1)NC(=S)N 1458a_100000020317_200000210301 [0,1,0,0,0,1|1,0,1]=4 1031 B13R1.587 [13CH3]C(=O)c1cccc(c1)NC(=S)N 1458a_100000020317_200025704644 [0,1,0,0,0,1|1,0,1]=4 1032 B13R1.642 CCc1cc(ccn1)C(=C(C)C)C 271570a_200000049429_100009820011 [0,1,0,0,0,1|2,0,0]=4 1033 B13R1.31 CCNc1cc(cc(c1)C(=O)N)F 34a_200011998915_100000210202 [0,2,0,0,0,0|1,1,0]=4 1034 B13R1.31 CCNc1cc(cc(c1)C(=O)N)F 7a_200011998915_100000210202 [0,2,0,0,0,0|1,1,0]=4 1035 B13R1.31 CCOc1cc(cc(c1)C(=O)N)Br 34a_100010084318_100000210202 [0,2,0,0,0,0|1,1,0]=4 1036 B13R1.31 CCOc1cc(cc(c1)C(=O)N)Br 7a_100010084318_100000210202 [0,2,0,0,0,0|1,1,0]=4 1037 B13R1.31 CCSc1cc(cc(c1)C(=O)N)C 62a_100000210202_200012348365 [0,2,0,0,0,0|1,1,0]=4 1038 B13R1.31 CCSc1cc(cc(c1)C(=O)N)C 62a_200012348365_100000210202 [0,2,0,0,0,0|1,1,0]=4 1039 B13R1.31 CCSc1cc(cc(c1)C(=O)N)F 62a_100000210202_200011280034 [0,2,0,0,0,0|1,1,0]=4 1040 B13R1.31 CCSc1cc(cc(c1)C(=O)N)F 62a_200011280034_100000210202 [0,2,0,0,0,0|1,1,0]=4 1041 B13R1.31 CCSc1cc(cc(c1)C(=O)N)O 62a_100000210202_100010084318 [0,2,0,0,0,0|1,1,0]=4 1042 B13R1.31 CCSc1cc(cc(c1)C(=O)N)O 62a_100010084318_100000210202 [0,2,0,0,0,0|1,1,0]=4 1043 B13R1.31 CCSc1cc(cc(n1)C)C(=O)C 62a_100000210202_100009884196 [0,2,0,0,0,0|1,1,0]=4 1044 B13R1.31 CCSc1cc(cc(n1)C)C(=O)C 62a_100009884196_100000210202 [0,2,0,0,0,0|1,1,0]=4 1045 B13R1.31 CNCc1cc(cc(c1)C(=O)N)Br 26a_100102657272_100010084318 [0,2,0,0,0,0|1,1,0]=4 1046 B13R1.313 C=C(C)c1cc(nc(c1)CC)CC 271570a_100000694244_100010074970 [0,2,0,0,0,0|2,0,0]=4 1047 B13R1.13 C=C(C)c1cc(c(cn1)F)C(=O)N 271570a_100000694244_100015943597 [0,2,0,0,0,0|0,1,1]=4 1048 B13R1.13 C=C(C)c1cc(c(cn1)N)C(=O)N 271570a_100000694244_100012003536 [0,2,0,0,0,0|0,1,1]=4 1049 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 11a_106832991635_100010152358 [0,2,0,0,0,0|1,1,0]=4 1050 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 1626a_100102657272_100010152358 [0,2,0,0,0,0|1,1,0]=4 1051 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 240690a_100102657272_100010152358 [0,2,0,0,0,0|1,1,0]=4 1052 B13R1.49 CCc1cc(ccc1Br)C(=O)NC 527a_100102657272_100010152358 [0,2,0,0,0,0|1,1,0]=4 1053 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 11a_106832991635_100000102533 [0,2,0,0,0,0|1,1,0]=4 1054 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 1626a_100102657272_100000102533 [0,2,0,0,0,0|1,1,0]=4 1055 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 240690a_100102657272_100000102533 [0,2,0,0,0,0|1,1,0]=4 1056 B13R1.49 CCc1cc(ccc1Cl)C(=O)NC 527a_100102657272_100000102533 [0,2,0,0,0,0|1,1,0]=4 1057 B13R1.49 CCc1cc(ccc1F)C(=O)NC 11a_106832991635_100009883079 [0,2,0,0,0,0|1,1,0]=4 1058 B13R1.49 CCc1cc(ccc1F)C(=O)NC 1626a_100102657272_100009883079 [0,2,0,0,0,0|1,1,0]=4 1059 B13R1.49 CCc1cc(ccc1F)C(=O)NC 240690a_100102657272_100009883079 [0,2,0,0,0,0|1,1,0]=4 1060 B13R1.49 CCc1cc(ccc1F)C(=O)NC 527a_100102657272_100009883079 [0,2,0,0,0,0|1,1,0]=4 1061 B13R1.354 CCNc1cc(ccc1C)C(=O)N 34a_100000188646_100000210202 [0,2,0,0,0,0|1,1,0]=4 1062 B13R1.354 CCNc1cc(ccc1C)C(=O)N 7a_100000188646_100000210202 [0,2,0,0,0,0|1,1,0]=4 1063 B13R1.354 CCNc1cc(ccc1Cl)C(=O)N 34a_100000736751_100000210202 [0,2,0,0,0,0|1,1,0]=4 1064 B13R1.354 CCNc1cc(ccc1F)C(=O)N 34a_100000740466_100000210202 [0,2,0,0,0,0|1,1,0]=4 1065 B13R1.354 CCOc1cc(ccc1Br)C(=O)N 34a_100012344895_100000210202 [0,2,0,0,0,0|1,1,0]=4 1066 B13R1.354 CCOc1cc(ccc1Br)C(=O)N 7a_100012344895_100000210202 [0,2,0,0,0,0|1,1,0]=4 1067 B13R1.354 CCOc1cc(ccc1N)C(=O)N 34a_100011850428_100000210202 [0,2,0,0,0,0|1,1,0]=4 1068 B13R1.354 CCOc1cc(ccc1N)C(=O)N 7a_100011850428_100000210202 [0,2,0,0,0,0|1,1,0]=4 1069 B13R1.354 CCSc1cc(ccc1C)C(=O)N 62a_100000186401_100000210202 [0,2,0,0,0,0|1,1,0]=4 1070 B13R1.354 CCSc1cc(ccc1C)C(=O)N 62a_100000210202_100000186401 [0,2,0,0,0,0|1,1,0]=4 1071 B13R1.354 CCSc1cc(ccc1F)C(=O)N 62a_100000210202_100011202321 [0,2,0,0,0,0|1,1,0]=4 1072 B13R1.354 CCSc1cc(ccc1F)C(=O)N 62a_100011202321_100000210202 [0,2,0,0,0,0|1,1,0]=4 1073 B13R1.354 CNCc1cc(ccc1Br)C(=O)N 26a_100102657272_100012344895 [0,2,0,0,0,0|1,1,0]=4 1074 B13R1.345 C=C(C)c1ccnc(c1)C(C)(C)C 271570a_100000694244_100010237918 [0,2,0,0,0,0|2,0,0]=4 1075 B13R1.345 C=C(C)c1ccnc(c1)C(C)(C)F 271570a_100000694244_100015973028 [0,2,0,0,0,0|2,0,0]=4 1076 B13R1.345 C=C(C)c1ccnc(c1)C(C)(C)O 271570a_100000694244_100010174121 [0,2,0,0,0,0|2,0,0]=4 1077 B13R1.543 C=C(C)c1cc(ccn1)C(=O)NC 271570a_100000694244_100011196506 [0,2,0,0,0,0|0,1,1]=4 1078 B13R1.543 C=C(C)c1cc(ccn1)C(=O)NN 271570a_100000694244_100000021280 [0,2,0,0,0,0|0,1,1]=4 1079 B13R1.543 C=C(C)c1ccnc(c1)C(=O)CC 271570a_100000694244_200000094848 [0,2,0,0,0,0|2,0,0]=4 1080 B13R1.543 CCC(=O)c1cccc(c1)C(=O)N 1458a_100000736676_100000210202 [0,2,0,0,0,0|1,1,0]=4 1081 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 11a_106832991635_100011934808 [0,2,0,0,0,0|1,1,0]=4 1082 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 1626a_100102657272_100011934808 [0,2,0,0,0,0|1,1,0]=4 1083 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 240690a_100102657272_100011934808 [0,2,0,0,0,0|1,1,0]=4 1084 B13R1.543 CNC(=O)c1cccc(c1)C(C)C 527a_100102657272_100011934808 [0,2,0,0,0,0|1,1,0]=4 1085 B13R1.543 CNC(=O)c1cccc(c1)C(C)O 240690a_100102657272_100000090953 [0,2,0,0,0,0|1,1,0]=4 1086 B13R1.543 CNC(C)c1ccnc(c1)C(C)C 269862a_106832991636_200009850310 [0,2,0,0,0,0|1,0,1]=4 1087 B13R1.3801 C=C(C)c1nccc(c1N)C(=O)N 271570a_100000694244_100000080204 [0,2,0,0,0,0|0,1,1]=4 1088 B13R1.374 CC=Cc1cc(ccn1)C(=O)NC 271570a_100016259895_100011196506 [0,2,0,0,0,0|0,1,1]=4 1089 B13R1.374 CC=Cc1cc(ccn1)C(=O)NN 271570a_100016259895_100000021280 [0,2,0,0,0,0|0,1,1]=4 1090 B13R1.374 CCNc1cccc(c1)C(=O)NC 34a_100000185133_100000210202 [0,2,0,0,0,0|1,1,0]=4 1091 B13R1.374 CCOc1cc(ccn1)C(=O)OC 34a_100138552365_100000210202 [0,2,0,0,0,0|1,1,0]=4 1092 B13R1.374 CCOc1cccc(c1)C(=NN)C 34a_100000689795_100000210202 [0,2,0,0,0,0|2,0,0]=4 1093 B13R1.374 CCOc1cccc(c1)C(=NO)N 34a_100000738085_100000210202 [0,2,0,0,0,0|1,1,0]=4 1094 B13R1.374 CCOc1cccc(c1)C(=O)NC 11a_106832991635_100000216331 [0,2,0,0,0,0|1,1,0]=4 1095 B13R1.374 CCOc1cccc(c1)C(=O)NC 1626a_100102657272_100000216331 [0,2,0,0,0,0|1,1,0]=4 1096 B13R1.374 CCOc1cccc(c1)C(=O)NC 240690a_100102657272_100000216331 [0,2,0,0,0,0|1,1,0]=4 1097 B13R1.374 CCOc1cccc(c1)C(=O)NC 34a_100000159807_100000210202 [0,2,0,0,0,0|1,1,0]=4 1098 B13R1.374 CCOc1cccc(c1)C(=O)NC 527a_100102657272_100000216331 [0,2,0,0,0,0|1,1,0]=4 1099 B13R1.374 CCOc1cccc(c1)C(=O)NC 7a_100000159807_100000210202 [0,2,0,0,0,0|1,1,0]=4 1100 B13R1.374 CCOc1cccc(c1)C(=O)NN 34a_100000184184_100000210202 [0,2,0,0,0,0|1,1,0]=4 1101 B13R1.374 CCSc1cc(ccn1)C(=O)NC 62a_100000210202_100011196506 [0,2,0,0,0,0|0,1,0]=3 1102 B13R1.374 CCSc1cc(ccn1)C(=O)NC 62a_100011196506_100000210202 [0,2,0,0,0,0|0,1,0]=3 1103 B13R1.374 CCSc1cc(ccn1)C(=O)NN 62a_100000021280_100000210202 [0,2,0,0,0,0|0,1,0]=3 1104 B13R1.374 CCSc1cc(ccn1)C(=O)NN 62a_100000210202_100000021280 [0,2,0,0,0,0|0,1,0]=3 1105 B13R1.374 CCSc1cc(ccn1)C(=O)OC 62a_100000210202_100011934382 [0,2,0,0,0,0|1,1,0]=4 1106 B13R1.374 CCSc1cc(ccn1)C(=O)OC 62a_100011934382_100000210202 [0,2,0,0,0,0|1,1,0]=4 1107 B13R1.374 CCSc1cccc(c1)C(=O)CN 62a_100000210202_100020587001 [0,2,0,0,0,0|1,1,0]=4 1108 B13R1.374 CCSc1cccc(c1)C(=O)CN 62a_100020587001_100000210202 [0,2,0,0,0,0|1,1,0]=4 1109 B13R1.374 CCSc1cccc(c1)C(=O)NC 62a_100000155082_100000210202 [0,2,0,0,0,0|1,1,0]=4 1110 B13R1.374 CCSc1cccc(c1)C(=O)NC 62a_100000210202_100000155082 [0,2,0,0,0,0|1,1,0]=4 1111 B13R1.374 CCSc1cccc(c1)C(=O)NN 62a_100000189783_100000210202 [0,2,0,0,0,0|1,1,0]=4 1112 B13R1.374 CCSc1cccc(c1)C(=O)NN 62a_100000210202_100000189783 [0,2,0,0,0,0|1,1,0]=4 1113 B13R1.374 CNC(=O)c1cccc(c1)CCO 1626a_100102657272_100009869812 [0,2,0,0,0,0|1,1,0]=4 1114 B13R1.374 CNC(=O)c1cccc(c1)CCO 240690a_100102657272_100009869812 [0,2,0,0,0,0|1,1,0]=4 1115 B13R1.374 CNC(=O)c1cccc(c1)COC 11a_106832991635_100000199024 [0,2,0,0,0,0|1,1,0]=4 1116 B13R1.374 CNC(=O)c1cccc(c1)COC 1626a_100102657272_100000199024 [0,2,0,0,0,0|1,1,0]=4 1117 B13R1.374 CNC(=O)c1cccc(c1)COC 240690a_100102657272_100000199024 [0,2,0,0,0,0|1,1,0]=4 1118 B13R1.374 CNC(=O)c1cccc(c1)COC 34a_100138415774_100000755619 [0,2,0,0,0,0|1,1,0]=4 1119 B13R1.374 CNC(=O)c1cccc(c1)COC 527a_100102657272_100000199024 [0,2,0,0,0,0|1,1,0]=4 1120 B13R1.374 CNC(=O)c1cccc(c1)CSC 62a_100000755619_200000210301 [0,2,0,0,0,0|1,1,0]=4 1121 B13R1.374 CNC(=O)c1cccc(c1)CSC 62a_200000210301_100000755619 [0,2,0,0,0,0|1,1,0]=4 1122 B13R1.374 CNC(=O)c1cccc(c1)CS[13CH3] 62a_100000755619_200025704644 [0,2,0,0,0,0|1,1,0]=4 1123 B13R1.374 CNC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000755619 [0,2,0,0,0,0|1,1,0]=4 1124 B13R1.374 CNC(=O)c1ccnc(c1)SCF 62a_100011196506_100015361967 [0,2,0,0,0,0|1,1,0]=4 1125 B13R1.374 CNC(=O)c1ccnc(c1)SCF 62a_100015361967_100011196506 [0,2,0,0,0,0|1,1,0]=4 1126 B13R1.374 CNCc1cc(ccn1)C(=O)OC 2230a_106832991635_100020667620 [0,2,0,0,0,0|1,1,0]=4 1127 B13R1.374 CNCc1cc(ccn1)C(=O)OC 270004a_106832991635_100009884558 [0,2,0,0,0,0|1,1,0]=4 1128 B13R1.374 CNCc1cc(ccn1)C(=O)OC 7a_106832991635_100020667620 [0,2,0,0,0,0|1,1,0]=4 1129 B13R1.374 CNCc1cccc(c1)C(=O)NC 2230a_106832991635_100000755619 [0,2,0,0,0,0|1,1,0]=4 1130 B13R1.374 CNCc1cccc(c1)C(=O)NC 34a_100102657272_100000755619 [0,2,0,0,0,0|1,1,0]=4 1131 B13R1.374 CNCc1cccc(c1)C(=O)NC 7a_106832991635_100000755619 [0,2,0,0,0,0|1,1,0]=4 1132 B13R1.374 COC(=O)c1ccnc(c1)CSC 62a_100020667620_200000210301 [0,2,0,0,0,0|1,1,0]=4 1133 B13R1.374 COC(=O)c1ccnc(c1)CSC 62a_200000210301_100020667620 [0,2,0,0,0,0|1,1,0]=4 1134 B13R1.374 COC(=O)c1ccnc(c1)CS[13CH3] 62a_100020667620_200025704644 [0,2,0,0,0,0|1,1,0]=4 1135 B13R1.374 COC(=O)c1ccnc(c1)CS[13CH3] 62a_200025704644_100020667620 [0,2,0,0,0,0|1,1,0]=4 1136 B13R1.374 COCc1cccc(c1)C(=NO)N 34a_100011269994_200000210301 [0,2,0,0,0,0|1,1,0]=4 1137 B13R1.374 NNC(=O)c1ccnc(c1)SCF 62a_100000021280_100015361967 [0,2,0,0,0,0|1,1,0]=4 1138 B13R1.374 NNC(=O)c1ccnc(c1)SCF 62a_100015361967_100000021280 [0,2,0,0,0,0|1,1,0]=4 1139 B13R1.374 [13CH3]OCc1cccc(c1)C(=NO)N 34a_100011269994_200025704644 [0,2,0,0,0,0|1,1,0]=4 1140 B13R1.377 CC=Cc1nccc(c1N)C(=O)N 271570a_100016259895_100000080204 [0,2,0,0,0,0|0,1,1]=4 1141 B13R1.377 CCNc1cccc(c1C)C(=O)N 34a_100000738810_100000210202 [0,2,0,0,0,0|1,1,0]=4 1142 B13R1.377 CCNc1cccc(c1C)C(=O)N 7a_100000738810_100000210202 [0,2,0,0,0,0|1,1,0]=4 1143 B13R1.377 CCNc1cccc(c1F)C(=O)N 34a_100014075672_100000210202 [0,2,0,0,0,0|1,1,0]=4 1144 B13R1.377 CCOc1cccc(c1F)C(=O)N 34a_100009841371_100000210202 [0,2,0,0,0,0|1,1,0]=4 1145 B13R1.377 CCOc1cccc(c1F)C(=O)N 7a_100009841371_100000210202 [0,2,0,0,0,0|1,1,0]=4 1146 B13R1.377 CCSc1cccc(c1C)C(=O)N 62a_100000210202_200012298201 [0,2,0,0,0,0|1,1,0]=4 1147 B13R1.377 CCSc1cccc(c1C)C(=O)N 62a_200012298201_100000210202 [0,2,0,0,0,0|1,1,0]=4 1148 B13R1.377 CCSc1cccc(c1F)C(=O)N 62a_100000210202_100012351131 [0,2,0,0,0,0|1,1,0]=4 1149 B13R1.377 CCSc1cccc(c1F)C(=O)N 62a_100012351131_100000210202 [0,2,0,0,0,0|1,1,0]=4 1150 B13R1.377 CCSc1cccc(c1N)C(=O)N 62a_100010144993_100000210202 [0,2,0,0,0,0|1,1,0]=4 1151 B13R1.377 CCSc1nccc(c1N)C(=O)C 62a_100000210202_200000063496 [0,2,0,0,0,0|1,1,0]=4 1152 B13R1.377 CCSc1nccc(c1N)C(=O)C 62a_200000063496_100000210202 [0,2,0,0,0,0|1,1,0]=4 1153 B13R1.377 CCSc1nccc(c1N)C(=O)N 62a_100000080204_100000210202 [0,2,0,0,0,0|0,1,0]=3 1154 B13R1.377 CCSc1nccc(c1N)C(=O)N 62a_100000210202_100000080204 [0,2,0,0,0,0|0,1,0]=3 1155 B13R1.377 NC(=O)c1ccnc(c1N)SCF 62a_100000080204_100015361967 [0,2,0,0,0,0|1,1,0]=4 1156 B13R1.377 NC(=O)c1ccnc(c1N)SCF 62a_100015361967_100000080204 [0,2,0,0,0,0|1,1,0]=4 1157 B13R1.387 CC=Cc1cc(c(cn1)F)C(=O)N 271570a_100016259895_100015943597 [0,2,0,0,0,0|0,1,1]=4 1158 B13R1.387 CC=Cc1cc(c(cn1)N)C(=O)N 271570a_100016259895_100012003536 [0,2,0,0,0,0|0,1,1]=4 1159 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Br 34a_100015186447_100000210202 [0,2,0,0,0,0|1,1,0]=4 1160 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Br 7a_100015186447_100000210202 [0,2,0,0,0,0|1,1,0]=4 1161 B13R1.387 CCNc1ccc(c(c1)C(=O)N)C 34a_100000750465_100000210202 [0,2,0,0,0,0|1,1,0]=4 1162 B13R1.387 CCNc1ccc(c(c1)C(=O)N)C 7a_100000750465_100000210202 [0,2,0,0,0,0|1,1,0]=4 1163 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Cl 34a_100000736848_100000210202 [0,2,0,0,0,0|1,1,0]=4 1164 B13R1.387 CCNc1ccc(c(c1)C(=O)N)Cl 7a_100000736848_100000210202 [0,2,0,0,0,0|1,1,0]=4 1165 B13R1.387 CCNc1ccc(c(c1)C(=O)N)F 34a_100000738046_100000210202 [0,2,0,0,0,0|1,1,0]=4 1166 B13R1.387 CCNc1ccc(c(c1)C(=O)N)F 7a_100000738046_100000210202 [0,2,0,0,0,0|1,1,0]=4 1167 B13R1.387 CCSc1cc(c(cn1)F)C(=O)C 62a_100000210202_100000697832 [0,2,0,0,0,0|1,1,0]=4 1168 B13R1.387 CCSc1cc(c(cn1)F)C(=O)C 62a_100000697832_100000210202 [0,2,0,0,0,0|1,1,0]=4 1169 B13R1.387 CCSc1cc(c(cn1)F)C(=O)N 62a_100000210202_100015943597 [0,2,0,0,0,0|0,1,0]=3 1170 B13R1.387 CCSc1cc(c(cn1)F)C(=O)N 62a_100015943597_100000210202 [0,2,0,0,0,0|0,1,0]=3 1171 B13R1.387 CCSc1cc(c(cn1)N)C(=O)N 62a_100000210202_100012003536 [0,2,0,0,0,0|0,1,0]=3 1172 B13R1.387 CCSc1cc(c(cn1)N)C(=O)N 62a_100012003536_100000210202 [0,2,0,0,0,0|0,1,0]=3 1173 B13R1.387 CCSc1ccc(c(c1)C(=O)N)C 62a_100000210202_100012257281 [0,2,0,0,0,0|1,1,0]=4 1174 B13R1.387 CCSc1ccc(c(c1)C(=O)N)C 62a_100012257281_100000210202 [0,2,0,0,0,0|1,1,0]=4 1175 B13R1.387 CCSc1ccc(c(c1)C(=O)N)F 62a_100000162119_100000210202 [0,2,0,0,0,0|1,1,0]=4 1176 B13R1.387 CCSc1ccc(c(c1)C(=O)N)N 62a_100000740421_100000210202 [0,2,0,0,0,0|1,1,0]=4 1177 B13R1.387 CCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000210202 [0,2,0,0,0,0|1,1,0]=4 1178 B13R1.387 NC(=O)c1cc(ncc1F)SCF 62a_100015361967_100015943597 [0,2,0,0,0,0|1,1,0]=4 1179 B13R1.387 NC(=O)c1cc(ncc1F)SCF 62a_100015943597_100015361967 [0,2,0,0,0,0|1,1,0]=4 1180 B13R1.387 NC(=O)c1cc(ncc1N)SCF 62a_100012003536_100015361967 [0,2,0,0,0,0|1,1,0]=4 1181 B13R1.387 NC(=O)c1cc(ncc1N)SCF 62a_100015361967_100012003536 [0,2,0,0,0,0|1,1,0]=4 1182 B13R1.568 C#CCOc1cccc(c1)C(=S)N 7a_100000738086_100000038162 [0,2,0,0,0,0|1,0,1]=4 1183 B13R1.568 C#CCSc1cc(ccn1)C(=O)N 62a_100000038162_100000229836 [0,2,0,0,0,0|0,1,1]=4 1184 B13R1.568 C=CCOc1cccc(c1)C(=S)N 7a_100000738086_100015514636 [0,2,0,0,0,0|1,0,1]=4 1185 B13R1.568 C=CCSc1cc(ccn1)C(=O)N 62a_100000210623_100000229836 [0,2,0,0,0,0|0,1,1]=4 1186 B13R1.568 C=CCSc1cc(ccn1)C(=O)N 62a_100000229836_100000210623 [0,2,0,0,0,0|0,1,1]=4 1187 B13R1.568 CC(=O)c1ccnc(c1)SCCF 62a_100000685609_100011217306 [0,2,0,0,0,0|1,1,0]=4 1188 B13R1.568 CC(=O)c1ccnc(c1)SCCF 62a_100011217306_100000685609 [0,2,0,0,0,0|1,1,0]=4 1189 B13R1.568 CC(=O)c1ccnc(c1)SCCO 62a_100000211926_100000685609 [0,2,0,0,0,0|1,1,0]=4 1190 B13R1.568 CC(=O)c1ccnc(c1)SCCO 62a_100000685609_100000211926 [0,2,0,0,0,0|1,1,0]=4 1191 B13R1.568 CCCCc1cc(ccn1)C(=O)C 271570a_100020621405_100000685609 [0,2,0,0,0,0|1,1,0]=4 1192 B13R1.568 CCCCc1cc(ccn1)C(=O)N 271570a_100020621405_100000229836 [0,2,0,0,0,0|0,1,0]=3 1193 B13R1.568 CCCCc1cc(cnn1)C(=O)N 271570a_100020621405_100015785749 [0,2,0,0,0,0|1,1,0]=4 1194 B13R1.568 CCCCc1cc(ncn1)C(=O)N 271570a_100020621405_100000725265 [0,2,0,0,0,0|1,1,0]=4 1195 B13R1.568 CCCCc1cccc(c1)C(=O)N 271570a_100020621405_100000162208 [0,2,0,0,0,0|1,1,0]=4 1196 B13R1.568 CCCCc1nccc(n1)C(=O)N 271570a_100020621405_100000066158 [0,2,0,0,0,0|1,1,0]=4 1197 B13R1.568 CCCNc1cccc(c1)C(=O)N 34a_100000217337_100000210303 [0,2,0,0,0,0|1,1,0]=4 1198 B13R1.568 CCCOc1cccc(c1)C(=O)N 34a_100000162170_100000210303 [0,2,0,0,0,0|1,1,0]=4 1199 B13R1.568 CCCOc1cccc(c1)C(=O)N 7a_100000162170_100000210303 [0,2,0,0,0,0|1,1,0]=4 1200 B13R1.568 CCCOc1cccc(c1)C(=S)N 7a_100000738086_100000210303 [0,2,0,0,0,0|1,0,0]=3 1201 B13R1.568 CCCSc1cc(ccn1)C(=O)C 62a_100000210303_100000685609 [0,2,0,0,0,0|1,1,0]=4 1202 B13R1.568 CCCSc1cc(ccn1)C(=O)C 62a_100000685609_100000210303 [0,2,0,0,0,0|1,1,0]=4 1203 B13R1.568 CCCSc1cc(ccn1)C(=O)N 62a_100000210303_100000229836 [0,2,0,0,0,0|0,1,0]=3 1204 B13R1.568 CCCSc1cc(ccn1)C(=O)N 62a_100000229836_100000210303 [0,2,0,0,0,0|0,1,0]=3 1205 B13R1.568 CCCSc1cc(cnn1)C(=O)N 62a_100000210303_100015785749 [0,2,0,0,0,0|1,1,0]=4 1206 B13R1.568 CCCSc1cc(cnn1)C(=O)N 62a_100015785749_100000210303 [0,2,0,0,0,0|1,1,0]=4 1207 B13R1.568 CCCSc1cc(ncn1)C(=O)N 62a_100000210303_100000725265 [0,2,0,0,0,0|1,1,0]=4 1208 B13R1.568 CCCSc1cc(ncn1)C(=O)N 62a_100000725265_100000210303 [0,2,0,0,0,0|1,1,0]=4 1209 B13R1.568 CCCSc1cccc(c1)C(=O)N 62a_100000162208_100000210303 [0,2,0,0,0,0|1,1,0]=4 1210 B13R1.568 CCCSc1cccc(c1)C(=O)N 62a_100000210303_100000162208 [0,2,0,0,0,0|1,1,0]=4 1211 B13R1.568 CCCSc1nccc(n1)C(=O)N 62a_100000066158_100000210303 [0,2,0,0,0,0|1,1,0]=4 1212 B13R1.568 CCCSc1nccc(n1)C(=O)N 62a_100000210303_100000066158 [0,2,0,0,0,0|1,1,0]=4 1213 B13R1.568 CCNCc1cccc(c1)C(=O)N 207a_100015525214_100000059704 [0,2,0,0,0,0|1,1,0]=4 1214 B13R1.568 CCNCc1cccc(c1)C(=O)N 2230a_100000746036_100000210202 [0,2,0,0,0,0|1,1,0]=4 1215 B13R1.568 CCNCc1cccc(c1)C(=O)N 2230a_100015525214_100000738444 [0,2,0,0,0,0|1,1,0]=4 1216 B13R1.568 CCNCc1cccc(c1)C(=O)N 270004a_100015525214_100000059704 [0,2,0,0,0,0|1,1,0]=4 1217 B13R1.568 CCOCc1cccc(c1)C(=O)N 34a_100121572206_100000738444 [0,2,0,0,0,0|1,1,0]=4 1218 B13R1.568 CCSCc1cccc(c1)C(=O)N 62a_100000210202_100000738444 [0,2,0,0,0,0|1,1,0]=4 1219 B13R1.568 CCSCc1cccc(c1)C(=O)N 62a_100000738444_100000210202 [0,2,0,0,0,0|1,1,0]=4 1220 B13R1.568 COCSc1cc(ccn1)C(=O)C 62a_100000685609_100000766300 [0,2,0,0,0,0|1,1,0]=4 1221 B13R1.568 COCSc1cc(ccn1)C(=O)C 62a_100000766300_100000685609 [0,2,0,0,0,0|1,1,0]=4 1222 B13R1.568 COCSc1cc(ccn1)C(=O)N 62a_100000229836_100000766300 [0,2,0,0,0,0|0,1,0]=3 1223 B13R1.568 COCSc1cc(ccn1)C(=O)N 62a_100000766300_100000229836 [0,2,0,0,0,0|0,1,0]=3 1224 B13R1.568 COCSc1cc(cnn1)C(=O)N 62a_100000766300_100015785749 [0,2,0,0,0,0|1,1,0]=4 1225 B13R1.568 COCSc1cc(cnn1)C(=O)N 62a_100015785749_100000766300 [0,2,0,0,0,0|1,1,0]=4 1226 B13R1.568 COCSc1cc(ncn1)C(=O)N 62a_100000725265_100000766300 [0,2,0,0,0,0|1,1,0]=4 1227 B13R1.568 COCSc1cc(ncn1)C(=O)N 62a_100000766300_100000725265 [0,2,0,0,0,0|1,1,0]=4 1228 B13R1.568 COCSc1cccc(c1)C(=O)N 62a_100000162208_100000766300 [0,2,0,0,0,0|1,1,0]=4 1229 B13R1.568 COCSc1cccc(c1)C(=O)N 62a_100000766300_100000162208 [0,2,0,0,0,0|1,1,0]=4 1230 B13R1.568 COCSc1nccc(n1)C(=O)N 62a_100000066158_100000766300 [0,2,0,0,0,0|1,1,0]=4 1231 B13R1.568 COCSc1nccc(n1)C(=O)N 62a_100000766300_100000066158 [0,2,0,0,0,0|1,1,0]=4 1232 B13R1.568 CSCNc1cccc(c1)C(=O)N 34a_100000217337_100011218213 [0,2,0,0,0,0|1,1,0]=4 1233 B13R1.568 CSCOc1cccc(c1)C(=O)N 34a_100000162170_100011218213 [0,2,0,0,0,0|1,1,0]=4 1234 B13R1.568 CSCSc1cc(ccn1)C(=O)C 62a_100000685609_100011218213 [0,2,0,0,0,0|1,1,0]=4 1235 B13R1.568 CSCSc1cc(ccn1)C(=O)C 62a_100011218213_100000685609 [0,2,0,0,0,0|1,1,0]=4 1236 B13R1.568 CSCSc1cc(ccn1)C(=O)N 62a_100000229836_100011218213 [0,2,0,0,0,0|0,1,0]=3 1237 B13R1.568 CSCSc1cc(ccn1)C(=O)N 62a_100011218213_100000229836 [0,2,0,0,0,0|0,1,0]=3 1238 B13R1.568 CSCSc1cc(cnn1)C(=O)N 62a_100011218213_100015785749 [0,2,0,0,0,0|1,1,0]=4 1239 B13R1.568 CSCSc1cc(cnn1)C(=O)N 62a_100015785749_100011218213 [0,2,0,0,0,0|1,1,0]=4 1240 B13R1.568 CSCSc1cc(ncn1)C(=O)N 62a_100000725265_100011218213 [0,2,0,0,0,0|1,1,0]=4 1241 B13R1.568 CSCSc1cc(ncn1)C(=O)N 62a_100011218213_100000725265 [0,2,0,0,0,0|1,1,0]=4 1242 B13R1.568 CSCSc1cccc(c1)C(=O)N 62a_100000162208_100011218213 [0,2,0,0,0,0|1,1,0]=4 1243 B13R1.568 CSCSc1cccc(c1)C(=O)N 62a_100011218213_100000162208 [0,2,0,0,0,0|1,1,0]=4 1244 B13R1.568 CSCSc1nccc(n1)C(=O)N 62a_100000066158_100011218213 [0,2,0,0,0,0|1,1,0]=4 1245 B13R1.568 CSCSc1nccc(n1)C(=O)N 62a_100011218213_100000066158 [0,2,0,0,0,0|1,1,0]=4 1246 B13R1.568 N#CCOc1cccc(c1)C(=S)N 7a_100000738086_100011215382 [0,2,0,0,0,0|1,0,1]=4 1247 B13R1.568 N#CCSc1cc(ccn1)C(=O)N 62a_100000229836_100011215382 [0,2,0,0,0,0|0,1,1]=4 1248 B13R1.568 N#CCSc1cc(ccn1)C(=O)N 62a_100011215382_100000229836 [0,2,0,0,0,0|0,1,1]=4 1249 B13R1.568 NC(=O)c1cc(ncn1)NCCO 27a_100000210304_100000725265 [0,2,0,0,0,0|1,1,0]=4 1250 B13R1.568 NC(=O)c1cc(ncn1)SCCF 62a_100000725265_100011217306 [0,2,0,0,0,0|1,1,0]=4 1251 B13R1.568 NC(=O)c1cc(ncn1)SCCF 62a_100011217306_100000725265 [0,2,0,0,0,0|1,1,0]=4 1252 B13R1.568 NC(=O)c1cc(ncn1)SCCO 62a_100000211926_100000725265 [0,2,0,0,0,0|1,1,0]=4 1253 B13R1.568 NC(=O)c1cc(ncn1)SCCO 62a_100000725265_100000211926 [0,2,0,0,0,0|1,1,0]=4 1254 B13R1.568 NC(=O)c1cccc(c1)CSCF 62a_100000738444_100015361967 [0,2,0,0,0,0|1,1,0]=4 1255 B13R1.568 NC(=O)c1cccc(c1)CSCF 62a_100015361967_100000738444 [0,2,0,0,0,0|1,1,0]=4 1256 B13R1.568 NC(=O)c1cccc(c1)NCCF 34a_100000217337_100011217306 [0,2,0,0,0,0|1,1,0]=4 1257 B13R1.568 NC(=O)c1cccc(c1)NCCO 34a_100000217337_100000211926 [0,2,0,0,0,0|1,1,0]=4 1258 B13R1.568 NC(=O)c1cccc(c1)OCCF 34a_100000162170_100011217306 [0,2,0,0,0,0|1,1,0]=4 1259 B13R1.568 NC(=O)c1cccc(c1)OCCF 7a_100000162170_100011217306 [0,2,0,0,0,0|1,1,0]=4 1260 B13R1.568 NC(=O)c1cccc(c1)OCCO 34a_100000162170_100000211926 [0,2,0,0,0,0|1,1,0]=4 1261 B13R1.568 NC(=O)c1cccc(c1)OCCO 7a_100000162170_100000211926 [0,2,0,0,0,0|1,1,0]=4 1262 B13R1.568 NC(=O)c1cccc(c1)SCCF 62a_100000162208_100011217306 [0,2,0,0,0,0|1,1,0]=4 1263 B13R1.568 NC(=O)c1cccc(c1)SCCF 62a_100011217306_100000162208 [0,2,0,0,0,0|1,1,0]=4 1264 B13R1.568 NC(=O)c1cccc(c1)SCCO 62a_100000162208_100000211926 [0,2,0,0,0,0|1,1,0]=4 1265 B13R1.568 NC(=O)c1cccc(c1)SCCO 62a_100000211926_100000162208 [0,2,0,0,0,0|1,1,0]=4 1266 B13R1.568 NC(=O)c1ccnc(c1)SCC=O 62a_100000229836_200015260668 [0,2,0,0,0,0|0,1,1]=4 1267 B13R1.568 NC(=O)c1ccnc(c1)SCC=O 62a_200015260668_100000229836 [0,2,0,0,0,0|0,1,1]=4 1268 B13R1.568 NC(=O)c1ccnc(c1)SCCF 62a_100000229836_100011217306 [0,2,0,0,0,0|0,1,0]=3 1269 B13R1.568 NC(=O)c1ccnc(c1)SCCF 62a_100011217306_100000229836 [0,2,0,0,0,0|0,1,0]=3 1270 B13R1.568 NC(=O)c1ccnc(c1)SCCO 62a_100000211926_100000229836 [0,2,0,0,0,0|0,1,0]=3 1271 B13R1.568 NC(=O)c1ccnc(c1)SCCO 62a_100000229836_100000211926 [0,2,0,0,0,0|0,1,0]=3 1272 B13R1.568 NC(=O)c1ccnc(n1)NCCO 27a_100000210304_100000066158 [0,2,0,0,0,0|1,1,0]=4 1273 B13R1.568 NC(=O)c1ccnc(n1)SCCF 62a_100000066158_100011217306 [0,2,0,0,0,0|1,1,0]=4 1274 B13R1.568 NC(=O)c1ccnc(n1)SCCF 62a_100011217306_100000066158 [0,2,0,0,0,0|1,1,0]=4 1275 B13R1.568 NC(=O)c1ccnc(n1)SCCO 62a_100000066158_100000211926 [0,2,0,0,0,0|1,1,0]=4 1276 B13R1.568 NC(=O)c1ccnc(n1)SCCO 62a_100000211926_100000066158 [0,2,0,0,0,0|1,1,0]=4 1277 B13R1.568 NC(=O)c1cnnc(c1)NCCO 27a_100000210304_100015785749 [0,2,0,0,0,0|1,1,0]=4 1278 B13R1.568 NC(=O)c1cnnc(c1)SCCF 62a_100011217306_100015785749 [0,2,0,0,0,0|1,1,0]=4 1279 B13R1.568 NC(=O)c1cnnc(c1)SCCF 62a_100015785749_100011217306 [0,2,0,0,0,0|1,1,0]=4 1280 B13R1.568 NC(=O)c1cnnc(c1)SCCO 62a_100000211926_100015785749 [0,2,0,0,0,0|1,1,0]=4 1281 B13R1.568 NC(=O)c1cnnc(c1)SCCO 62a_100015785749_100000211926 [0,2,0,0,0,0|1,1,0]=4 1282 B13R1.568 NC(=S)c1cccc(c1)OCC=O 7a_100000738086_200015260668 [0,2,0,0,0,0|1,0,1]=4 1283 B13R1.568 NC(=S)c1cccc(c1)OCCF 7a_100000738086_100011217306 [0,2,0,0,0,0|1,0,0]=3 1284 B13R1.568 NC(=S)c1cccc(c1)OCCO 7a_100000738086_100000211926 [0,2,0,0,0,0|1,0,0]=3 1285 B13R1.460 CCNC(=O)c1cccc(c1)CC 11a_100015525214_100011933908 [0,2,0,0,0,0|1,1,0]=4 1286 B13R1.460 CCNC(=O)c1cccc(c1)CC 240690a_100015525214_100011933908 [0,2,0,0,0,0|1,1,0]=4 1287 B13R1.460 CCNC(=O)c1cccc(c1)CC 527a_100015525214_100011933908 [0,2,0,0,0,0|1,1,0]=4 1288 B13R1.460 CCNC(=O)c1ccnc(c1)NC 27a_100102657272_100000229823 [0,2,0,0,0,0|1,1,0]=4 1289 B13R1.460 CCNC(=O)c1ccnc(c1)SC 62a_100000229823_200000210301 [0,2,0,0,0,0|1,1,0]=4 1290 B13R1.460 CCNC(=O)c1ccnc(c1)SC 62a_200000210301_100000229823 [0,2,0,0,0,0|1,1,0]=4 1291 B13R1.460 CCNC(=O)c1ccnc(c1)S[13CH3] 62a_100000229823_200025704644 [0,2,0,0,0,0|1,1,0]=4 1292 B13R1.460 CCNC(=O)c1ccnc(c1)S[13CH3] 62a_200025704644_100000229823 [0,2,0,0,0,0|1,1,0]=4 1293 B13R1.460 CCc1cccc(c1)C(=O)NNC 22a_100016993582_100011933908 [0,2,0,0,0,0|1,1,0]=4 1294 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 240690a_100102657272_200000748397 [0,2,0,0,0,0|1,1,0]=4 1295 B13R1.2431 CCc1ccc(c(c1)C(=O)NC)O 527a_100102657272_200000748397 [0,2,0,0,0,0|1,1,0]=4 1296 B13R1.2430 CCc1ccc(c(c1)C(=O)N)NC 34a_100014932089_200000210301 [0,2,0,0,0,0|1,1,0]=4 1297 B13R1.2430 CCc1ccc(c(c1)C(=O)N)NC 7a_100014932089_200000210301 [0,2,0,0,0,0|1,1,0]=4 1298 B13R1.2430 CCc1ccc(c(c1)C(=O)N)N[13CH3] 34a_100014932089_200025704644 [0,2,0,0,0,0|1,1,0]=4 1299 B13R1.2430 CCc1ccc(c(c1)C(=O)N)N[13CH3] 7a_100014932089_200025704644 [0,2,0,0,0,0|1,1,0]=4 1300 B11R2.190 C=Cc1ccc2c(c1)CC2 271570a_100011290941_100009818592 [1,0,0,1,0,0|2,0,0]=4 1301 B13R2.2121 CSc1cc2c(cn1)NC(=O)C2 62a_200000210301_100000104063 [0,0,0,1,0,1|1,1,0]=4 1302 B13R2.2121 CSc1cc2nc(sc2cn1)N 62a_100009884557_200000210301 [0,0,0,1,0,1|1,0,1]=4 1303 B13R2.2121 CSc1cc2nc(sc2cn1)N 62a_200000210301_100009884557 [0,0,0,1,0,1|1,0,1]=4 1304 B13R2.2121 [13CH3]Sc1cc2c(cn1)NC(=O)C2 62a_200025704644_100000104063 [0,0,0,1,0,1|1,1,0]=4 1305 B13R2.2121 [13CH3]Sc1cc2nc(sc2cn1)N 62a_100009884557_200025704644 [0,0,0,1,0,1|1,0,1]=4 1306 B13R2.2121 [13CH3]Sc1cc2nc(sc2cn1)N 62a_200025704644_100009884557 [0,0,0,1,0,1|1,0,1]=4 1307 B13R2.429 C=C(C)c1ccnc(c1)C2CC2 271570a_100000694244_100009820009 [0,1,0,1,0,0|2,0,0]=4 1308 B13R2.429 CC(=O)c1ccnc(c1)C2CC2 271570a_100011220607_100000685609 [0,1,0,1,0,0|1,1,0]=4 1309 B13R2.429 NC(=O)c1cc(ncn1)C2CC2 271570a_100011220607_100000725265 [0,1,0,1,0,0|1,1,0]=4 1310 B13R2.429 NC(=O)c1cccc(c1)C2CC2 271570a_100011220607_100000162208 [0,1,0,1,0,0|1,1,0]=4 1311 B13R2.429 NC(=O)c1ccnc(c1)C2CC2 271570a_100011220607_100000229836 [0,1,0,1,0,0|0,1,0]=3 1312 B13R2.429 NC(=O)c1ccnc(n1)C2CC2 271570a_100011220607_100000066158 [0,1,0,1,0,0|1,1,0]=4 1313 B13R2.429 NC(=O)c1cnnc(c1)C2CC2 271570a_100011220607_100015785749 [0,1,0,1,0,0|1,1,0]=4 1314 B13R2.5569 C=C(C)c1ccnc2c1CCC2 271570a_100000694244_100000102697 [0,1,0,1,0,0|2,0,0]=4 1315 B13R2.573 COc1nccc2c1[nH]cc2O 271570a_203496583355_100010168644 [0,1,0,1,0,0|1,1,0]=4 1316 B13R2.669 COc1cc2c(c[nH]c2cn1)O 271570a_203496583355_200010163580 [0,1,0,1,0,0|1,1,0]=4 1317 B13R2.669 CSc1cc2c(n[nH]c2cn1)C 62a_200000210301_100102524920 [0,1,0,1,0,0|2,0,0]=4 1318 B13R2.669 Cc1n[nH]c2c1cc(nc2)S[13CH3] 62a_200025704644_100102524920 [0,1,0,1,0,0|2,0,0]=4 1319 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 11a_106832991635_100000137882 [0,1,0,1,0,0|1,1,0]=4 1320 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 1626a_100102657272_100000137882 [0,1,0,1,0,0|1,1,0]=4 1321 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 240690a_100102657272_100000137882 [0,1,0,1,0,0|1,1,0]=4 1322 B13R2.1139 CNC(=O)c1ccc2c(c1)CC2 527a_100102657272_100000137882 [0,1,0,1,0,0|1,1,0]=4 1323 B9R1.14 C=Cc1ccnn1CC 271570a_100011290941_100000728327 [1,0,0,0,1,0|2,0,0]=4 1324 B9R1.21 C=Cc1ccc(s1)CC 271570a_100011290941_100009844052 [1,0,0,0,1,0|2,0,0]=4 1325 B9R1.21 C=Cc1cnn(c1)CC 271570a_100011290941_100011400201 [1,0,0,0,1,0|2,0,0]=4 1326 B9R1.21 C=Cc1csc(c1)CC 271570a_100011290941_100009846239 [1,0,0,0,1,0|2,0,0]=4 1327 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [1,0,0,0,0,1|2,0,0]=4 1328 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [1,0,0,0,0,1|1,1,0]=4 1329 B11R1.3 C=C(C)c1ccc(cc1)CC 271570a_100000694244_100011215824 [0,0,0,0,1,1|2,0,0]=4 1330 B11R1.3 C=C(C)c1ccc(cn1)CC 271570a_100000694244_100009843584 [0,0,0,0,1,1|2,0,0]=4 1331 B11R1.3 C=C(C)c1ccc(nc1)CC 271570a_100000694244_100009820025 [0,0,0,0,1,1|2,0,0]=4 1332 B11R1.3 CCc1ccc(cc1)C(=O)C 1458a_100000211226_200000210301 [0,0,0,0,1,1|1,1,0]=4 1333 B11R1.3 CCc1ccc(cc1)C(=O)[13CH3] 1458a_100000211226_200025704644 [0,0,0,0,1,1|1,1,0]=4 1334 B11R1.3 CNc1ccc(cc1)C(=O)N 27a_100102657272_100000162191 [0,0,0,0,1,1|1,1,0]=4 1335 B11R1.3 CNc1ccc(cc1)C(=O)N 34a_100000210537_200000210301 [0,0,0,0,1,1|1,1,0]=4 1336 B11R1.3 CNc1ccc(cn1)C(=O)N 27a_100102657272_100000162237 [0,0,0,0,1,1|1,1,0]=4 1337 B11R1.3 CNc1cnc(cn1)C(=O)N 27a_100102657272_100000738300 [0,0,0,0,1,1|1,1,0]=4 1338 B11R1.3 COc1ccc(cc1)C(=O)N 34a_100000746352_200000210301 [0,0,0,0,1,1|1,1,0]=4 1339 B11R1.3 COc1ccc(cc1)C(=O)N 7a_100000746352_200000210301 [0,0,0,0,1,1|1,1,0]=4 1340 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_100000162191_200000210301 [0,0,0,0,1,1|1,1,0]=4 1341 B11R1.3 CSc1ccc(cc1)C(=O)N 62a_200000210301_100000162191 [0,0,0,0,1,1|1,1,0]=4 1342 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_100000162237_200000210301 [0,0,0,0,1,1|1,1,0]=4 1343 B11R1.3 CSc1ccc(cn1)C(=O)N 62a_200000210301_100000162237 [0,0,0,0,1,1|1,1,0]=4 1344 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_100011219284_200000210301 [0,0,0,0,1,1|1,1,0]=4 1345 B11R1.3 CSc1ccc(nc1)C(=O)N 62a_200000210301_100011219284 [0,0,0,0,1,1|1,1,0]=4 1346 B11R1.3 CSc1cnc(cn1)C(=O)N 62a_100000738300_200000210301 [0,0,0,0,1,1|1,1,0]=4 1347 B11R1.3 CSc1cnc(cn1)C(=O)N 62a_200000210301_100000738300 [0,0,0,0,1,1|1,1,0]=4 1348 B11R1.3 [13CH3]Nc1ccc(cc1)C(=O)N 34a_100000210537_200025704644 [0,0,0,0,1,1|1,1,0]=4 1349 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 34a_100000746352_200025704644 [0,0,0,0,1,1|1,1,0]=4 1350 B11R1.3 [13CH3]Oc1ccc(cc1)C(=O)N 7a_100000746352_200025704644 [0,0,0,0,1,1|1,1,0]=4 1351 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_100000162191_200025704644 [0,0,0,0,1,1|1,1,0]=4 1352 B11R1.3 [13CH3]Sc1ccc(cc1)C(=O)N 62a_200025704644_100000162191 [0,0,0,0,1,1|1,1,0]=4 1353 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_100000162237_200025704644 [0,0,0,0,1,1|1,1,0]=4 1354 B11R1.3 [13CH3]Sc1ccc(cn1)C(=O)N 62a_200025704644_100000162237 [0,0,0,0,1,1|1,1,0]=4 1355 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_100011219284_200025704644 [0,0,0,0,1,1|1,1,0]=4 1356 B11R1.3 [13CH3]Sc1ccc(nc1)C(=O)N 62a_200025704644_100011219284 [0,0,0,0,1,1|1,1,0]=4 1357 B11R1.3 [13CH3]Sc1cnc(cn1)C(=O)N 62a_100000738300_200025704644 [0,0,0,0,1,1|1,1,0]=4 1358 B11R1.3 [13CH3]Sc1cnc(cn1)C(=O)N 62a_200025704644_100000738300 [0,0,0,0,1,1|1,1,0]=4 1359 B13R1.643 C=C(C)CNc1ccnc(c1)CC 27a_100000765925_100009820011 [0,0,0,0,0,2|2,0,0]=4 1360 B13R1.643 C=C(C)CSc1ccnc(c1)CC 62a_100000748629_100009820011 [0,0,0,0,0,2|2,0,0]=4 1361 B13R1.643 C=C(C)CSc1ccnc(c1)CC 62a_100009820011_100000211660 [0,0,0,0,0,2|2,0,0]=4 1362 B13R1.643 C=C(F)CSc1ccnc(c1)CC 62a_100000042424_100009820011 [0,0,0,0,0,2|2,0,0]=4 1363 B13R1.643 C=C(F)CSc1ccnc(c1)CC 62a_100009820011_100000042424 [0,0,0,0,0,2|2,0,0]=4 1364 B13R1.643 CCc1cc(ccn1)SCC(=O)N 62a_100000747473_100009820011 [0,0,0,0,0,2|0,1,0]=3 1365 B13R1.643 CCc1cc(ccn1)SCC(=O)N 62a_100009820011_100000747473 [0,0,0,0,0,2|0,1,0]=3 1366 B13R1.643 CCc1cc(ccn1)SCC(=O)[O-] 62a_100009820011_100020667443 [0,0,0,0,0,2|1,1,0]=4 1367 B13R1.643 CCc1cc(ccn1)SCC(=O)[O-] 62a_100020667443_100009820011 [0,0,0,0,0,2|1,1,0]=4 1368 B13R1.643 CCc1cc(ncn1)SCC(=O)N 62a_100000744278_100000747473 [0,0,0,0,0,2|1,1,0]=4 1369 B13R1.643 CCc1cc(ncn1)SCC(=O)N 62a_100000747473_100000744278 [0,0,0,0,0,2|1,1,0]=4 1370 B13R1.643 CCc1cccc(c1)NCC(=O)N 2230a_100000211250_100000747473 [0,0,0,0,0,2|1,1,0]=4 1371 B13R1.643 CCc1cccc(c1)NCC(=O)N 34a_100000211250_100000187820 [0,0,0,0,0,2|1,1,0]=4 1372 B13R1.643 CCc1cccc(c1)NCC(=O)N 7a_100000211250_100000187820 [0,0,0,0,0,2|1,1,0]=4 1373 B13R1.643 CCc1cccc(c1)OCC(=O)N 34a_100000211550_100000187820 [0,0,0,0,0,2|1,1,0]=4 1374 B13R1.643 CCc1cccc(c1)OCC(=O)N 7a_100000211550_100000187820 [0,0,0,0,0,2|1,1,0]=4 1375 B13R1.643 CCc1cccc(c1)SCC(=O)N 62a_100000747473_100011263222 [0,0,0,0,0,2|1,1,0]=4 1376 B13R1.643 CCc1cccc(c1)SCC(=O)N 62a_100011263222_100000747473 [0,0,0,0,0,2|1,1,0]=4 1377 B13R1.643 CNc1cc(ccn1)SCC(=O)N 62a_100000747473_100009819592 [0,0,0,0,0,2|1,1,0]=4 1378 B13R1.643 CNc1cc(ccn1)SCC(=O)N 62a_100009819592_100000747473 [0,0,0,0,0,2|1,1,0]=4 1379 B13R1.643 COc1cc(ccn1)OCC(=O)N 34a_100012181050_100000187820 [0,0,0,0,0,2|1,1,0]=4 1380 B13R1.643 COc1cc(ccn1)SCC(=O)N 62a_100000117307_100000747473 [0,0,0,0,0,2|1,1,0]=4 1381 B13R1.643 COc1cc(ccn1)SCC(=O)N 62a_100000747473_100000117307 [0,0,0,0,0,2|1,1,0]=4 1382 B13R1.643 NC(=O)CSc1ccnc(c1)CO 62a_100000747473_100000748867 [0,0,0,0,0,2|1,1,0]=4 1383 B13R1.643 NC(=O)CSc1ccnc(c1)CO 62a_100000748867_100000747473 [0,0,0,0,0,2|1,1,0]=4 1384 B13R1.643 NCc1cc(ccn1)SCC(=O)N 62a_100000085674_100000747473 [0,0,0,0,0,2|1,1,0]=4 1385 B13R1.643 NCc1cc(ccn1)SCC(=O)N 62a_100000747473_100000085674 [0,0,0,0,0,2|1,1,0]=4