0 B13R2.328 Cc1nc(c2c(n1)CCCC2)O 271570a_203496583355_100011467566 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.24 Oc1ccc2c(n1)CCCC2 271570a_203496583355_100000046135 [1,0,0,0,0,0|3,0,0]=4 2 B12R2.24 Oc1ccc2c(n1)CCNC2 271570a_203496583355_100015190003 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.24 Oc1ncc2c(n1)CCNC2 271570a_203496583355_100020629273 [1,0,0,0,0,0|2,0,0]=3 4 B12R2.1081 Oc1ncnc2c1CCCC2 271570a_203496583355_100011467579 [1,0,0,0,0,0|2,0,0]=3 5 B14R2.1019 CSc1nc(c2c(n1)CCCC2)O 271570a_203496583355_100010000299 [0,1,0,0,0,0|3,0,0]=4 6 B14R2.1146 C=Cc1nc(nc2c1CCCC2)C 271570a_100011290941_100011467566 [0,1,0,0,0,0|2,0,1]=4 7 B14R2.1146 CNc1nc(nc2c1CCCC2)C 27a_100102657272_100011467566 [0,1,0,0,0,0|2,0,0]=3 8 B14R2.1146 CSc1nc(nc2c1CCCC2)C 62a_100011467566_200000210301 [0,1,0,0,0,0|2,0,0]=3 9 B14R2.1146 CSc1nc(nc2c1CCCC2)C 62a_200000210301_100011467566 [0,1,0,0,0,0|2,0,0]=3 10 B14R2.1146 Cc1nc2c(c(n1)S[13CH3])CCCC2 62a_100011467566_200025704644 [0,1,0,0,0,0|2,0,0]=3 11 B14R2.1146 Cc1nc2c(c(n1)S[13CH3])CCCC2 62a_200025704644_100011467566 [0,1,0,0,0,0|2,0,0]=3 12 B14R2.8235 CN1CCc2nc(nc(c2C1)Cl)Cl 2230a_100016987465_200000210301 [0,1,0,0,0,0|3,0,0]=4 13 B14R2.8235 CN1CCc2nc(nc(c2C1)Cl)Cl 269982a_100016987465_200000210301 [0,1,0,0,0,0|3,0,0]=4 14 B14R2.8235 [13CH3]N1CCc2nc(nc(c2C1)Cl)Cl 2230a_100016987465_200025704644 [0,1,0,0,0,0|3,0,0]=4 15 B14R2.8235 [13CH3]N1CCc2nc(nc(c2C1)Cl)Cl 269982a_100016987465_200025704644 [0,1,0,0,0,0|3,0,0]=4 16 B12R1.40 C=C=Cc1nc(nc(c1C)C)N 271570a_100015277604_100000076065 [0,0,1,0,0,0|1,0,2]=4 17 B12R1.40 CC=Cc1nc(nc(c1C)C)N 271570a_100016259895_100000076065 [0,0,1,0,0,0|1,0,2]=4 18 B12R1.40 CCNc1nc(nc(c1C)C)N 27a_100015525214_100000076065 [0,0,1,0,0,0|2,0,0]=3 19 B12R1.40 CCOc1nc(nc(c1C)C)C 34a_100000762955_100000210202 [0,0,1,0,0,0|3,0,0]=4 20 B12R1.40 CCSc1nc(nc(c1C)C)N 62a_100000076065_100000210202 [0,0,1,0,0,0|2,0,0]=3 21 B12R1.40 CCSc1nc(nc(c1C)C)N 62a_100000210202_100000076065 [0,0,1,0,0,0|2,0,0]=3 22 B12R1.40 Cc1nc(c(c(n1)OCF)C)C 34a_100000762955_100015361967 [0,0,1,0,0,0|3,0,0]=4 23 B12R1.40 Cc1nc(nc(c1C)SCF)N 62a_100000076065_100015361967 [0,0,1,0,0,0|2,0,0]=3 24 B12R1.40 Cc1nc(nc(c1C)SCF)N 62a_100015361967_100000076065 [0,0,1,0,0,0|2,0,0]=3 25 B12R1.69 CCCCc1ccc(cc1C)N 271570a_100020621405_100000210723 [0,0,1,0,0,0|3,0,0]=4 26 B12R1.69 CCCCc1ccc(nc1Br)N 271570a_100020621405_100010734177 [0,0,1,0,0,0|3,0,0]=4 27 B12R1.69 CCCCc1ccc(nc1C)C 271570a_100020621405_100009813853 [0,0,1,0,0,0|3,0,0]=4 28 B12R1.69 CCCCc1ccc(nc1C)Cl 271570a_100020621405_100000062408 [0,0,1,0,0,0|3,0,0]=4 29 B12R1.69 CCCCc1ccc(nc1C)F 271570a_100020621405_100000688911 [0,0,1,0,0,0|3,0,0]=4 30 B12R1.69 CCCCc1ccc(nc1C)N 271570a_100020621405_100000013003 [0,0,1,0,0,0|2,0,0]=3 31 B12R1.69 CCCCc1ccc(nc1C)O 271570a_100020621405_100000691680 [0,0,1,0,0,0|3,0,0]=4 32 B12R1.69 CCCCc1ccc(nc1Cl)N 271570a_100020621405_100010270343 [0,0,1,0,0,0|3,0,0]=4 33 B12R1.69 CCCCc1ccc(nc1F)N 271570a_100020621405_100009882772 [0,0,1,0,0,0|3,0,0]=4 34 B12R1.69 CCCCc1ccc(nc1N)N 271570a_100020621405_100011356871 [0,0,1,0,0,0|3,0,0]=4 35 B12R1.69 CCCCc1cnc([nH]c1=O)N 271570a_100020621405_100012456729 [0,0,1,0,0,0|2,0,1]=4 36 B12R1.69 CCCCc1cnc(cc1Br)N 271570a_100020621405_100010074611 [0,0,1,0,0,0|3,0,0]=4 37 B12R1.69 CCCCc1cnc(cc1C)Br 271570a_100020621405_100009816104 [0,0,1,0,0,0|3,0,0]=4 38 B12R1.69 CCCCc1cnc(cc1C)C 271570a_100020621405_100009819613 [0,0,1,0,0,0|3,0,0]=4 39 B12R1.69 CCCCc1cnc(cc1C)Cl 271570a_100020621405_100010172789 [0,0,1,0,0,0|3,0,0]=4 40 B12R1.69 CCCCc1cnc(cc1C)F 271570a_100020621405_100009820716 [0,0,1,0,0,0|3,0,0]=4 41 B12R1.69 CCCCc1cnc(cc1C)N 271570a_100020621405_100000050067 [0,0,1,0,0,0|2,0,0]=3 42 B12R1.69 CCCCc1cnc(cc1C)O 271570a_100020621405_100010114363 [0,0,1,0,0,0|3,0,0]=4 43 B12R1.69 CCCCc1cnc(cc1Cl)N 271570a_100020621405_100000694920 [0,0,1,0,0,0|3,0,0]=4 44 B12R1.69 CCCCc1cnc(cc1F)N 271570a_100020621405_100009844730 [0,0,1,0,0,0|3,0,0]=4 45 B12R1.69 CCCCc1cnc(cc1N)N 271570a_100020621405_200009857908 [0,0,1,0,0,0|3,0,0]=4 46 B12R1.69 CCCCc1cnc(nc1C)N 271570a_100020621405_100000725598 [0,0,1,0,0,0|1,0,0]=2 47 B12R1.69 CCCCc1cnc(nc1F)F 271570a_100020621405_100009820707 [0,0,1,0,0,0|3,0,0]=4 48 B12R1.69 CCCCc1cnc(nc1N)C 271570a_100020621405_100000684960 [0,0,1,0,0,0|3,0,0]=4 49 B12R1.69 CCCCc1cnc(nc1N)N 271570a_100020621405_200010734216 [0,0,1,0,0,0|2,0,0]=3 50 B12R1.69 CCCCc1ncc(nc1C)N 271570a_100020621405_100009818570 [0,0,1,0,0,0|3,0,0]=4 51 B12R1.69 CCCCc1nnc(cc1C)N 271570a_100020621405_100000123434 [0,0,1,0,0,0|3,0,0]=4 52 B12R1.69 CCCOc1cnc(nc1C)C 34a_100009864123_100000210303 [0,0,1,0,0,0|3,0,0]=4 53 B12R1.69 CCCOc1cnc(nc1C)C 7a_100009864123_100000210303 [0,0,1,0,0,0|3,0,0]=4 54 B12R1.69 CCCOc1cnc(nc1N)N 7a_100025726691_100000210303 [0,0,1,0,0,0|3,0,0]=4 55 B12R1.69 CCCSc1ccc(nc1C)N 62a_100000187202_100000210303 [0,0,1,0,0,0|3,0,0]=4 56 B12R1.69 CCCSc1ccc(nc1C)N 62a_100000210303_100000187202 [0,0,1,0,0,0|3,0,0]=4 57 B12R1.69 CCCSc1cnc(cc1C)N 62a_100000050067_100000210303 [0,0,1,0,0,0|3,0,0]=4 58 B12R1.69 CCCSc1cnc(cc1C)N 62a_100000210303_100000050067 [0,0,1,0,0,0|3,0,0]=4 59 B12R1.69 CCCSc1cnc(nc1C)N 62a_100000210303_100000725598 [0,0,1,0,0,0|2,0,0]=3 60 B12R1.69 CCCSc1cnc(nc1C)N 62a_100000725598_100000210303 [0,0,1,0,0,0|2,0,0]=3 61 B12R1.69 CCCSc1cnc(nc1N)N 62a_100000210303_200010734216 [0,0,1,0,0,0|3,0,0]=4 62 B12R1.69 CCCSc1cnc(nc1N)N 62a_200010734216_100000210303 [0,0,1,0,0,0|3,0,0]=4 63 B12R1.69 CCNCc1ccc(nc1C)C 207a_100015525214_100011794427 [0,0,1,0,0,0|3,0,0]=4 64 B12R1.69 CCNCc1ccc(nc1C)C 270004a_100015525214_100011794427 [0,0,1,0,0,0|3,0,0]=4 65 B12R1.69 CCNCc1cnc(cc1C)C 207a_100015525214_200009869383 [0,0,1,0,0,0|3,0,0]=4 66 B12R1.69 CCNCc1cnc(cc1C)C 270004a_100015525214_200009869383 [0,0,1,0,0,0|3,0,0]=4 67 B12R1.69 CCNCc1cnc(cc1C)F 2230a_100015525214_100010382440 [0,0,1,0,0,0|3,0,0]=4 68 B12R1.69 CCNCc1cnc(nc1Cl)Cl 2230a_100015525214_100000071240 [0,0,1,0,0,0|3,0,0]=4 69 B12R1.69 CCOCc1ccc(cc1C)N 34a_100000102464_100000210202 [0,0,1,0,0,0|2,1,0]=4 70 B12R1.69 CCOCc1ccc(cc1C)N 7a_100000102464_100000210202 [0,0,1,0,0,0|2,1,0]=4 71 B12R1.69 CCOCc1ccc(nc1C)C 34a_100011756430_100000210202 [0,0,1,0,0,0|2,1,0]=4 72 B12R1.69 CCOCc1ccc(nc1C)C 7a_100011756430_100000210202 [0,0,1,0,0,0|2,1,0]=4 73 B12R1.69 CCOCc1ccc(nc1C)F 34a_100000081978_100000210202 [0,0,1,0,0,0|2,1,0]=4 74 B12R1.69 CCOCc1ccc(nc1C)F 7a_100000081978_100000210202 [0,0,1,0,0,0|2,1,0]=4 75 B12R1.69 CCOCc1cnc(cc1C)Cl 34a_100010277336_100000210202 [0,0,1,0,0,0|2,1,0]=4 76 B12R1.69 CCOCc1cnc(cc1C)Cl 7a_100010277336_100000210202 [0,0,1,0,0,0|2,1,0]=4 77 B12R1.69 CCOCc1cnc(cc1C)F 34a_100121572206_100010382440 [0,0,1,0,0,0|2,1,0]=4 78 B12R1.69 CCOCc1cnc(nc1C)C 34a_100000699490_100000210202 [0,0,1,0,0,0|1,1,0]=3 79 B12R1.69 CCOCc1cnc(nc1C)C 7a_100000699490_100000210202 [0,0,1,0,0,0|1,1,0]=3 80 B12R1.69 CCOCc1cnc(nc1Cl)Cl 34a_100121572206_100000071240 [0,0,1,0,0,0|2,1,0]=4 81 B12R1.69 CCOCc1cnc(nc1Cl)Cl 34a_200009828795_100000210202 [0,0,1,0,0,0|2,1,0]=4 82 B12R1.69 CCOCc1cnc(nc1Cl)Cl 7a_200009828795_100000210202 [0,0,1,0,0,0|2,1,0]=4 83 B12R1.69 CCOCc1cnc(nc1N)C 7a_100000701481_100000210202 [0,0,1,0,0,0|2,1,0]=4 84 B12R1.69 CCOCc1cnc(nc1N)Cl 7a_200009965464_100000210202 [0,0,1,0,0,0|2,1,0]=4 85 B12R1.69 CCOCc1cnc(nc1N)N 7a_100000083744_100000210202 [0,0,1,0,0,0|1,1,0]=3 86 B12R1.69 CCSCc1ccc(cc1C)Br 62a_100000210202_100000708836 [0,0,1,0,0,0|3,0,0]=4 87 B12R1.69 CCSCc1ccc(cc1C)Br 62a_100000708836_100000210202 [0,0,1,0,0,0|3,0,0]=4 88 B12R1.69 CCSCc1ccc(cc1C)C 62a_100000210202_100011219618 [0,0,1,0,0,0|3,0,0]=4 89 B12R1.69 CCSCc1ccc(cc1C)C 62a_100011219618_100000210202 [0,0,1,0,0,0|3,0,0]=4 90 B12R1.69 CCSCc1ccc(cc1C)Cl 62a_100000210202_100012361307 [0,0,1,0,0,0|3,0,0]=4 91 B12R1.69 CCSCc1ccc(cc1C)Cl 62a_100012361307_100000210202 [0,0,1,0,0,0|3,0,0]=4 92 B12R1.69 CCSCc1ccc(cc1C)F 62a_100000210202_100000700533 [0,0,1,0,0,0|3,0,0]=4 93 B12R1.69 CCSCc1ccc(cc1C)F 62a_100000700533_100000210202 [0,0,1,0,0,0|3,0,0]=4 94 B12R1.69 CCSCc1ccc(nc1Br)C 62a_100000210202_200010064658 [0,0,1,0,0,0|3,0,0]=4 95 B12R1.69 CCSCc1ccc(nc1Br)C 62a_200010064658_100000210202 [0,0,1,0,0,0|3,0,0]=4 96 B12R1.69 CCSCc1ccc(nc1Cl)Cl 62a_100000210202_100000722033 [0,0,1,0,0,0|3,0,0]=4 97 B12R1.69 CCSCc1ccc(nc1Cl)Cl 62a_100000722033_100000210202 [0,0,1,0,0,0|3,0,0]=4 98 B12R1.69 CCSCc1cnc(cc1C)F 62a_100000210202_100010382440 [0,0,1,0,0,0|2,0,0]=3 99 B12R1.69 CCSCc1cnc(cc1C)F 62a_100010382440_100000210202 [0,0,1,0,0,0|2,0,0]=3 100 B12R1.69 CCSCc1cnc(cc1Cl)Cl 62a_100000210202_100011997056 [0,0,1,0,0,0|3,0,0]=4 101 B12R1.69 CCSCc1cnc(cc1Cl)Cl 62a_100011997056_100000210202 [0,0,1,0,0,0|3,0,0]=4 102 B12R1.69 CCSCc1cnc(nc1Cl)Cl 62a_100000071240_100000210202 [0,0,1,0,0,0|2,0,0]=3 103 B12R1.69 CCSCc1cnc(nc1Cl)Cl 62a_100000210202_100000071240 [0,0,1,0,0,0|2,0,0]=3 104 B12R1.69 COCSc1cnc(nc1C)N 62a_100000725598_100000766300 [0,0,1,0,0,0|3,0,0]=4 105 B12R1.69 COCSc1cnc(nc1C)N 62a_100000766300_100000725598 [0,0,1,0,0,0|3,0,0]=4 106 B12R1.69 CSCSc1cnc(nc1C)N 62a_100000725598_100011218213 [0,0,1,0,0,0|3,0,0]=4 107 B12R1.69 CSCSc1cnc(nc1C)N 62a_100011218213_100000725598 [0,0,1,0,0,0|3,0,0]=4 108 B12R1.69 Cc1cc(ncc1CSCF)F 62a_100010382440_100015361967 [0,0,1,0,0,0|3,0,0]=4 109 B12R1.69 Cc1cc(ncc1CSCF)F 62a_100015361967_100010382440 [0,0,1,0,0,0|3,0,0]=4 110 B12R1.69 Cc1nc(ncc1SCCF)N 62a_100000725598_100011217306 [0,0,1,0,0,0|3,0,0]=4 111 B12R1.69 Cc1nc(ncc1SCCF)N 62a_100011217306_100000725598 [0,0,1,0,0,0|3,0,0]=4 112 B12R1.69 Cc1nc(ncc1SCCO)N 62a_100000211926_100000725598 [0,0,1,0,0,0|3,0,0]=4 113 B12R1.69 Cc1nc(ncc1SCCO)N 62a_100000725598_100000211926 [0,0,1,0,0,0|3,0,0]=4 114 B12R1.69 Cc1ncc(c(n1)C)COCF 34a_100000699490_100015361967 [0,0,1,0,0,0|2,1,0]=4 115 B12R1.69 Cc1ncc(c(n1)C)COCF 7a_100000699490_100015361967 [0,0,1,0,0,0|2,1,0]=4 116 B12R1.69 FCSCc1cnc(nc1Cl)Cl 62a_100000071240_100015361967 [0,0,1,0,0,0|3,0,0]=4 117 B12R1.69 FCSCc1cnc(nc1Cl)Cl 62a_100015361967_100000071240 [0,0,1,0,0,0|3,0,0]=4 118 B12R1.69 Nc1ncc(c(n1)N)COCF 7a_100000083744_100015361967 [0,0,1,0,0,0|2,1,0]=4 119 B12R1.100 C#CCNc1cc(nc(n1)N)C 27a_100000212058_100000183061 [0,0,1,0,0,0|2,0,1]=4 120 B12R1.100 C#CCSc1cc(nc(n1)N)C 62a_100000038162_100000183061 [0,0,1,0,0,0|2,0,1]=4 121 B12R1.100 C=CCNc1cc(nc(n1)N)C 27a_100020586998_100000183061 [0,0,1,0,0,0|2,0,1]=4 122 B12R1.100 C=CCSc1cc(nc(n1)N)C 62a_100000183061_100000210623 [0,0,1,0,0,0|2,0,1]=4 123 B12R1.100 C=CCSc1cc(nc(n1)N)C 62a_100000210623_100000183061 [0,0,1,0,0,0|2,0,1]=4 124 B12R1.100 CCCCc1cc(cc(c1)N)C 271570a_100020621405_100000695972 [0,0,1,0,0,0|3,0,0]=4 125 B12R1.100 CCCCc1cc(cc(n1)C)C 271570a_100020621405_100000069240 [0,0,1,0,0,0|3,0,0]=4 126 B12R1.100 CCCCc1cc(cc(n1)F)C 271570a_100020621405_100009819601 [0,0,1,0,0,0|3,0,0]=4 127 B12R1.100 CCCCc1cc(cc(n1)N)C 271570a_100020621405_100009819863 [0,0,1,0,0,0|2,0,0]=3 128 B12R1.100 CCCCc1cc(nc(c1)C)C 271570a_100020621405_100009816552 [0,0,1,0,0,0|3,0,0]=4 129 B12R1.100 CCCCc1cc(nc(c1)F)C 271570a_100020621405_100010006595 [0,0,1,0,0,0|3,0,0]=4 130 B12R1.100 CCCCc1cc(nc(c1)N)C 271570a_100020621405_100000076705 [0,0,1,0,0,0|2,0,0]=3 131 B12R1.100 CCCCc1cc(nc(c1)N)N 271570a_100020621405_100009816676 [0,0,1,0,0,0|3,0,0]=4 132 B12R1.100 CCCCc1cc(nc(n1)C)C 271570a_100020621405_100000736142 [0,0,1,0,0,0|2,0,0]=3 133 B12R1.100 CCCCc1cc(nc(n1)C)N 271570a_100020621405_100012178882 [0,0,1,0,0,0|3,0,0]=4 134 B12R1.100 CCCCc1cc(nc(n1)C)O 271570a_100020621405_106741647437 [0,0,1,0,0,0|3,0,0]=4 135 B12R1.100 CCCCc1cc(nc(n1)N)C 271570a_100020621405_100000183061 [0,0,1,0,0,0|1,0,0]=2 136 B12R1.100 CCCCc1cc(nc(n1)N)N 271570a_100020621405_100011177858 [0,0,1,0,0,0|2,0,0]=3 137 B12R1.100 CCCCc1cc(nc(n1)N)O 271570a_100020621405_100000694715 [0,0,1,0,0,0|2,0,0]=3 138 B12R1.100 CCCCc1nc(cc(n1)N)C 271570a_100020621405_100000687285 [0,0,1,0,0,0|3,0,0]=4 139 B12R1.100 CCCCc1nc(nc(n1)C)C 271570a_100020621405_100015468570 [0,0,1,0,0,0|3,0,0]=4 140 B12R1.100 CCCCc1nc(nc(n1)N)C 271570a_100020621405_200012022553 [0,0,1,0,0,0|2,0,0]=3 141 B12R1.100 CCCSc1cc(cc(n1)N)C 62a_100000210303_100009819863 [0,0,1,0,0,0|3,0,0]=4 142 B12R1.100 CCCSc1cc(cc(n1)N)C 62a_100009819863_100000210303 [0,0,1,0,0,0|3,0,0]=4 143 B12R1.100 CCCSc1cc(nc(c1)N)C 62a_100000076705_100000210303 [0,0,1,0,0,0|3,0,0]=4 144 B12R1.100 CCCSc1cc(nc(c1)N)C 62a_100000210303_100000076705 [0,0,1,0,0,0|3,0,0]=4 145 B12R1.100 CCCSc1cc(nc(n1)C)C 62a_100000210303_100000736142 [0,0,1,0,0,0|3,0,0]=4 146 B12R1.100 CCCSc1cc(nc(n1)C)C 62a_100000736142_100000210303 [0,0,1,0,0,0|3,0,0]=4 147 B12R1.100 CCCSc1cc(nc(n1)N)C 62a_100000183061_100000210303 [0,0,1,0,0,0|2,0,0]=3 148 B12R1.100 CCCSc1cc(nc(n1)N)C 62a_100000210303_100000183061 [0,0,1,0,0,0|2,0,0]=3 149 B12R1.100 CCCSc1cc(nc(n1)N)N 62a_100000212091_100000210303 [0,0,1,0,0,0|3,0,0]=4 150 B12R1.100 CCCSc1cc(nc(n1)N)O 62a_100000694715_100000210303 [0,0,1,0,0,0|3,0,0]=4 151 B12R1.100 CCCSc1nc(nc(n1)N)C 62a_100000210303_200012022553 [0,0,1,0,0,0|3,0,0]=4 152 B12R1.100 CCCSc1nc(nc(n1)N)C 62a_200012022553_100000210303 [0,0,1,0,0,0|3,0,0]=4 153 B12R1.100 COCSc1cc(cc(n1)N)C 62a_100000766300_100009819863 [0,0,1,0,0,0|2,1,0]=4 154 B12R1.100 COCSc1cc(cc(n1)N)C 62a_100009819863_100000766300 [0,0,1,0,0,0|2,1,0]=4 155 B12R1.100 COCSc1cc(nc(c1)N)C 62a_100000076705_100000766300 [0,0,1,0,0,0|2,1,0]=4 156 B12R1.100 COCSc1cc(nc(c1)N)C 62a_100000766300_100000076705 [0,0,1,0,0,0|2,1,0]=4 157 B12R1.100 COCSc1cc(nc(n1)C)C 62a_100000736142_100000766300 [0,0,1,0,0,0|2,1,0]=4 158 B12R1.100 COCSc1cc(nc(n1)C)C 62a_100000766300_100000736142 [0,0,1,0,0,0|2,1,0]=4 159 B12R1.100 COCSc1cc(nc(n1)N)C 62a_100000183061_100000766300 [0,0,1,0,0,0|1,1,0]=3 160 B12R1.100 COCSc1cc(nc(n1)N)C 62a_100000766300_100000183061 [0,0,1,0,0,0|1,1,0]=3 161 B12R1.100 COCSc1cc(nc(n1)N)N 62a_100000212091_100000766300 [0,0,1,0,0,0|2,1,0]=4 162 B12R1.100 COCSc1cc(nc(n1)N)O 62a_100000694715_100000766300 [0,0,1,0,0,0|2,1,0]=4 163 B12R1.100 COCSc1nc(nc(n1)N)C 62a_100000766300_200012022553 [0,0,1,0,0,0|2,1,0]=4 164 B12R1.100 COCSc1nc(nc(n1)N)C 62a_200012022553_100000766300 [0,0,1,0,0,0|2,1,0]=4 165 B12R1.100 CSCOc1cc(cc(c1)N)C 34a_100011995906_100011218213 [0,0,1,0,0,0|3,0,0]=4 166 B12R1.100 CSCSc1cc(cc(c1)N)C 62a_100000695972_100011218213 [0,0,1,0,0,0|3,0,0]=4 167 B12R1.100 CSCSc1cc(cc(c1)N)C 62a_100011218213_100000695972 [0,0,1,0,0,0|3,0,0]=4 168 B12R1.100 CSCSc1cc(cc(n1)C)C 62a_100000069240_100011218213 [0,0,1,0,0,0|3,0,0]=4 169 B12R1.100 CSCSc1cc(cc(n1)C)C 62a_100011218213_100000069240 [0,0,1,0,0,0|3,0,0]=4 170 B12R1.100 CSCSc1cc(cc(n1)F)C 62a_100009819601_100011218213 [0,0,1,0,0,0|3,0,0]=4 171 B12R1.100 CSCSc1cc(cc(n1)F)C 62a_100011218213_100009819601 [0,0,1,0,0,0|3,0,0]=4 172 B12R1.100 CSCSc1cc(cc(n1)N)C 62a_100009819863_100011218213 [0,0,1,0,0,0|2,0,0]=3 173 B12R1.100 CSCSc1cc(cc(n1)N)C 62a_100011218213_100009819863 [0,0,1,0,0,0|2,0,0]=3 174 B12R1.100 CSCSc1cc(nc(c1)C)C 62a_100000066820_100011218213 [0,0,1,0,0,0|3,0,0]=4 175 B12R1.100 CSCSc1cc(nc(c1)C)C 62a_100011218213_100000066820 [0,0,1,0,0,0|3,0,0]=4 176 B12R1.100 CSCSc1cc(nc(c1)Cl)C 62a_100010068023_100011218213 [0,0,1,0,0,0|3,0,0]=4 177 B12R1.100 CSCSc1cc(nc(c1)Cl)C 62a_100011218213_100010068023 [0,0,1,0,0,0|3,0,0]=4 178 B12R1.100 CSCSc1cc(nc(c1)Cl)N 62a_100011218213_200011084131 [0,0,1,0,0,0|3,0,0]=4 179 B12R1.100 CSCSc1cc(nc(c1)Cl)N 62a_200011084131_100011218213 [0,0,1,0,0,0|3,0,0]=4 180 B12R1.100 CSCSc1cc(nc(c1)F)C 62a_100010006595_100011218213 [0,0,1,0,0,0|3,0,0]=4 181 B12R1.100 CSCSc1cc(nc(c1)F)C 62a_100011218213_100010006595 [0,0,1,0,0,0|3,0,0]=4 182 B12R1.100 CSCSc1cc(nc(c1)N)C 62a_100000076705_100011218213 [0,0,1,0,0,0|2,0,0]=3 183 B12R1.100 CSCSc1cc(nc(c1)N)C 62a_100011218213_100000076705 [0,0,1,0,0,0|2,0,0]=3 184 B12R1.100 CSCSc1cc(nc(c1)N)N 62a_100009816676_100011218213 [0,0,1,0,0,0|3,0,0]=4 185 B12R1.100 CSCSc1cc(nc(n1)C)C 62a_100000736142_100011218213 [0,0,1,0,0,0|2,0,0]=3 186 B12R1.100 CSCSc1cc(nc(n1)C)C 62a_100011218213_100000736142 [0,0,1,0,0,0|2,0,0]=3 187 B12R1.100 CSCSc1cc(nc(n1)C)N 62a_100000761517_100011218213 [0,0,1,0,0,0|3,0,0]=4 188 B12R1.100 CSCSc1cc(nc(n1)C)N 62a_100011218213_100000761517 [0,0,1,0,0,0|3,0,0]=4 189 B12R1.100 CSCSc1cc(nc(n1)C)O 62a_100011218213_106741647437 [0,0,1,0,0,0|3,0,0]=4 190 B12R1.100 CSCSc1cc(nc(n1)N)C 62a_100000183061_100011218213 [0,0,1,0,0,0|1,0,0]=2 191 B12R1.100 CSCSc1cc(nc(n1)N)C 62a_100011218213_100000183061 [0,0,1,0,0,0|1,0,0]=2 192 B12R1.100 CSCSc1cc(nc(n1)N)N 62a_100000212091_100011218213 [0,0,1,0,0,0|2,0,0]=3 193 B12R1.100 CSCSc1cc(nc(n1)N)O 62a_100000694715_100011218213 [0,0,1,0,0,0|2,0,0]=3 194 B12R1.100 CSCSc1nc(cc(n1)N)C 62a_100000687285_100011218213 [0,0,1,0,0,0|3,0,0]=4 195 B12R1.100 CSCSc1nc(cc(n1)N)C 62a_100011218213_100000687285 [0,0,1,0,0,0|3,0,0]=4 196 B12R1.100 CSCSc1nc(nc(n1)C)C 62a_100011218213_100015468570 [0,0,1,0,0,0|3,0,0]=4 197 B12R1.100 CSCSc1nc(nc(n1)C)C 62a_100015468570_100011218213 [0,0,1,0,0,0|3,0,0]=4 198 B12R1.100 CSCSc1nc(nc(n1)N)C 62a_100011218213_200012022553 [0,0,1,0,0,0|2,0,0]=3 199 B12R1.100 CSCSc1nc(nc(n1)N)C 62a_200012022553_100011218213 [0,0,1,0,0,0|2,0,0]=3 200 B12R1.100 CSCSc1nc(nc(n1)N)N 62a_100000188858_100011218213 [0,0,1,0,0,0|3,0,0]=4 201 B12R1.100 Cc1cc(nc(n1)N)NCCO 27a_100000210304_100000183061 [0,0,1,0,0,0|3,0,0]=4 202 B12R1.100 Cc1cc(nc(n1)N)SCC#N 62a_100000183061_100011215382 [0,0,1,0,0,0|3,0,0]=4 203 B12R1.100 Cc1cc(nc(n1)N)SCC#N 62a_100011215382_100000183061 [0,0,1,0,0,0|3,0,0]=4 204 B12R1.100 Cc1cc(nc(n1)N)SCC=O 62a_100000183061_200015260668 [0,0,1,0,0,0|3,0,0]=4 205 B12R1.100 Cc1cc(nc(n1)N)SCC=O 62a_200015260668_100000183061 [0,0,1,0,0,0|3,0,0]=4 206 B12R1.100 Cc1cc(nc(n1)N)SCCF 62a_100000183061_100011217306 [0,0,1,0,0,0|3,0,0]=4 207 B12R1.100 Cc1cc(nc(n1)N)SCCF 62a_100011217306_100000183061 [0,0,1,0,0,0|3,0,0]=4 208 B12R1.100 Cc1cc(nc(n1)N)SCCO 62a_100000183061_100000211926 [0,0,1,0,0,0|3,0,0]=4 209 B12R1.100 Cc1cc(nc(n1)N)SCCO 62a_100000211926_100000183061 [0,0,1,0,0,0|3,0,0]=4 210 B12R1.234 C=Cc1c(nc(nc1CC)N)N 271570a_100011290941_200010243779 [0,0,1,0,0,0|2,0,1]=4 211 B12R1.234 C=Cc1c(nc(nc1OC)N)C 271570a_100011290941_200011180307 [0,0,1,0,0,0|2,0,1]=4 212 B12R1.234 CCc1nc(nc(c1SC)N)N 62a_200010243779_200000210301 [0,0,1,0,0,0|3,0,0]=4 213 B12R1.234 CCc1nc(nc(c1S[13CH3])N)N 62a_200010243779_200025704644 [0,0,1,0,0,0|3,0,0]=4 214 B12R1.234 CNc1nc(nc(c1C#N)C)N 27a_100102657272_100009965792 [0,0,1,0,0,0|2,0,1]=4 215 B12R1.234 COc1nc(nc(c1SC)C)N 62a_200000210301_200011180307 [0,0,1,0,0,0|3,0,0]=4 216 B12R1.234 COc1nc(nc(c1SC)C)N 62a_200011180307_200000210301 [0,0,1,0,0,0|3,0,0]=4 217 B12R1.234 COc1nc(nc(c1S[13CH3])C)N 62a_200011180307_200025704644 [0,0,1,0,0,0|3,0,0]=4 218 B12R1.234 COc1nc(nc(c1S[13CH3])C)N 62a_200025704644_200011180307 [0,0,1,0,0,0|3,0,0]=4 219 B12R1.234 CSc1nc(nc(c1C#N)C)N 62a_200000210301_100009965792 [0,0,1,0,0,0|2,0,1]=4 220 B12R1.234 Cc1nc(nc(c1C#N)S[13CH3])N 62a_200025704644_100009965792 [0,0,1,0,0,0|2,0,1]=4 221 B12R1.1095 C=C=Cc1c(nc(nc1C)N)C 271570a_100015277604_100009814254 [0,0,1,0,0,0|1,0,2]=4 222 B12R1.1095 CC=Cc1c(cc(nc1C)N)C 271570a_100016259895_100000699364 [0,0,1,0,0,0|2,0,1]=4 223 B12R1.1095 CC=Cc1c(nc(nc1C)N)C 271570a_100016259895_100009814254 [0,0,1,0,0,0|1,0,1]=3 224 B12R1.1095 CC=Cc1c(nc(nc1O)N)C 271570a_100016259895_200000008613 [0,0,1,0,0,0|2,0,1]=4 225 B12R1.1095 CCSc1c(cc(nc1C)N)C 62a_100000210202_100000699364 [0,0,1,0,0,0|3,0,0]=4 226 B12R1.1095 CCSc1c(cc(nc1C)N)C 62a_100000699364_100000210202 [0,0,1,0,0,0|3,0,0]=4 227 B12R1.1095 CCSc1c(nc(nc1C)N)C 62a_100000210202_100009814254 [0,0,1,0,0,0|2,0,0]=3 228 B12R1.1095 CCSc1c(nc(nc1C)N)C 62a_100009814254_100000210202 [0,0,1,0,0,0|2,0,0]=3 229 B12R1.1095 CCSc1c(nc(nc1Cl)N)C 62a_100000210202_100010254241 [0,0,1,0,0,0|3,0,0]=4 230 B12R1.1095 CCSc1c(nc(nc1Cl)N)C 62a_100010254241_100000210202 [0,0,1,0,0,0|3,0,0]=4 231 B12R1.1095 CCSc1c(nc(nc1O)N)C 62a_100000210202_200000008613 [0,0,1,0,0,0|3,0,0]=4 232 B12R1.1095 CCSc1c(nc(nc1O)N)C 62a_200000008613_100000210202 [0,0,1,0,0,0|3,0,0]=4 233 B12R1.1095 CSCc1c(cc(cc1C)C)C 62a_100000749405_200000210301 [0,0,1,0,0,0|3,0,0]=4 234 B12R1.1095 CSCc1c(cc(cc1C)C)C 62a_200000210301_100000749405 [0,0,1,0,0,0|3,0,0]=4 235 B12R1.1095 Cc1cc(c(c(c1)C)CS[13CH3])C 62a_100000749405_200025704644 [0,0,1,0,0,0|3,0,0]=4 236 B12R1.1095 Cc1cc(c(c(c1)C)CS[13CH3])C 62a_200025704644_100000749405 [0,0,1,0,0,0|3,0,0]=4 237 B12R1.1095 Cc1nc(nc(c1SCF)C)N 62a_100009814254_100015361967 [0,0,1,0,0,0|3,0,0]=4 238 B12R1.1095 Cc1nc(nc(c1SCF)C)N 62a_100015361967_100009814254 [0,0,1,0,0,0|3,0,0]=4 239 B12R2.246 Cc1nc(c2c(n1)CCC2)O 271570a_203496583355_100011240833 [0,0,0,0,1,0|2,0,0]=3 240 B12R2.246 Nc1nc(nc2c1CCC2)O 271570a_203496583355_100000107085 [0,0,0,0,1,0|2,0,0]=3 241 B11R1.8 C=Cc1nc(nc(c1C)C)N 271570a_100011290941_100000076065 [1,0,1,0,0,0|0,0,2]=4 242 B11R1.8 CCc1nc(nc(c1O)N)N 271570a_203496583355_200010243779 [1,0,1,0,0,0|1,1,0]=4 243 B11R1.8 CNc1nc(nc(c1C)C)N 27a_100102657272_100000076065 [1,0,1,0,0,0|1,0,0]=3 244 B11R1.8 COc1nc(nc(c1C)C)C 34a_100000762955_200000210301 [1,0,1,0,0,0|2,0,0]=4 245 B11R1.8 COc1nc(nc(c1O)C)N 271570a_203496583355_200011180307 [1,0,1,0,0,0|1,1,0]=4 246 B11R1.8 CSc1nc(nc(c1C)C)N 62a_100000076065_200000210301 [1,0,1,0,0,0|1,0,0]=3 247 B11R1.8 CSc1nc(nc(c1C)C)N 62a_200000210301_100000076065 [1,0,1,0,0,0|1,0,0]=3 248 B11R1.8 Cc1nc(c(c(n1)O[13CH3])C)C 34a_100000762955_200025704644 [1,0,1,0,0,0|2,0,0]=4 249 B11R1.8 Cc1nc(nc(c1C)S[13CH3])N 62a_100000076065_200025704644 [1,0,1,0,0,0|1,0,0]=3 250 B11R1.8 Cc1nc(nc(c1C)S[13CH3])N 62a_200025704644_100000076065 [1,0,1,0,0,0|1,0,0]=3 251 B11R1.13 CCNc1ncnc(c1C)C 27a_100015525214_100011438038 [1,0,1,0,0,0|2,0,0]=4 252 B11R1.13 CCOc1ncnc(c1C)C 34a_100000697798_100000210202 [1,0,1,0,0,0|2,0,0]=4 253 B11R1.13 CCSc1ncnc(c1C)C 62a_100000210202_100011438038 [1,0,1,0,0,0|2,0,0]=4 254 B11R1.13 CCSc1ncnc(c1C)C 62a_100011438038_100000210202 [1,0,1,0,0,0|2,0,0]=4 255 B11R1.13 Cc1ncnc(c1C)OCF 34a_100000697798_100015361967 [1,0,1,0,0,0|2,0,0]=4 256 B11R1.13 Cc1ncnc(c1C)SCF 62a_100011438038_100015361967 [1,0,1,0,0,0|2,0,0]=4 257 B11R1.13 Cc1ncnc(c1C)SCF 62a_100015361967_100011438038 [1,0,1,0,0,0|2,0,0]=4 258 B11R1.34 CC=Cc1cc(nc(n1)N)C 271570a_100016259895_100000183061 [1,0,1,0,0,0|0,0,2]=4 259 B11R1.34 CCNc1cc(nc(n1)C)C 27a_100015525214_100000736142 [1,0,1,0,0,0|2,0,0]=4 260 B11R1.34 CCNc1cc(nc(n1)N)C 27a_100015525214_100000183061 [1,0,1,0,0,0|1,0,0]=3 261 B11R1.34 CCNc1cc(nc(n1)N)O 271570a_203496583355_100011228705 [1,0,1,0,0,0|2,0,0]=4 262 B11R1.34 CCNc1cc(nc(n1)N)O 27a_100015525214_100000694715 [1,0,1,0,0,0|2,0,0]=4 263 B11R1.34 CCNc1nc(nc(n1)N)C 27a_100015525214_200012022553 [1,0,1,0,0,0|2,0,0]=4 264 B11R1.34 CCOc1cc(nc(n1)N)O 271570a_203496583355_100011996124 [1,0,1,0,0,0|2,0,0]=4 265 B11R1.34 CCOc1cc(nc(n1)O)C 271570a_203496583355_100011684413 [1,0,1,0,0,0|2,0,0]=4 266 B11R1.34 CCSc1cc(cc(n1)N)C 62a_100000210202_100009819863 [1,0,1,0,0,0|2,0,0]=4 267 B11R1.34 CCSc1cc(cc(n1)N)C 62a_100009819863_100000210202 [1,0,1,0,0,0|2,0,0]=4 268 B11R1.34 CCSc1cc(nc(c1)N)C 62a_100000076705_100000210202 [1,0,1,0,0,0|2,0,0]=4 269 B11R1.34 CCSc1cc(nc(c1)N)C 62a_100000210202_100000076705 [1,0,1,0,0,0|2,0,0]=4 270 B11R1.34 CCSc1cc(nc(n1)C)C 62a_100000210202_100000736142 [1,0,1,0,0,0|2,0,0]=4 271 B11R1.34 CCSc1cc(nc(n1)C)C 62a_100000736142_100000210202 [1,0,1,0,0,0|2,0,0]=4 272 B11R1.34 CCSc1cc(nc(n1)N)C 62a_100000183061_100000210202 [1,0,1,0,0,0|1,0,0]=3 273 B11R1.34 CCSc1cc(nc(n1)N)C 62a_100000210202_100000183061 [1,0,1,0,0,0|1,0,0]=3 274 B11R1.34 CCSc1cc(nc(n1)N)N 62a_100000212091_100000210202 [1,0,1,0,0,0|2,0,0]=4 275 B11R1.34 CCSc1cc(nc(n1)N)O 62a_100000694715_100000210202 [1,0,1,0,0,0|2,0,0]=4 276 B11R1.34 CCSc1nc(nc(n1)N)C 62a_100000210202_200012022553 [1,0,1,0,0,0|2,0,0]=4 277 B11R1.34 CCSc1nc(nc(n1)N)C 62a_200012022553_100000210202 [1,0,1,0,0,0|2,0,0]=4 278 B11R1.34 CSCc1cc(cc(n1)C)C 62a_100012357514_200000210301 [1,0,1,0,0,0|2,0,0]=4 279 B11R1.34 CSCc1cc(cc(n1)C)C 62a_200000210301_100012357514 [1,0,1,0,0,0|2,0,0]=4 280 B11R1.34 CSCc1cc(nc(c1)C)C 62a_200000139866_200000210301 [1,0,1,0,0,0|2,0,0]=4 281 B11R1.34 CSCc1cc(nc(c1)C)C 62a_200000210301_200000139866 [1,0,1,0,0,0|2,0,0]=4 282 B11R1.34 Cc1cc(cc(n1)C)CS[13CH3] 62a_200000139866_200025704644 [1,0,1,0,0,0|2,0,0]=4 283 B11R1.34 Cc1cc(cc(n1)C)CS[13CH3] 62a_200025704644_200000139866 [1,0,1,0,0,0|2,0,0]=4 284 B11R1.34 Cc1cc(nc(c1)CS[13CH3])C 62a_100012357514_200025704644 [1,0,1,0,0,0|2,0,0]=4 285 B11R1.34 Cc1cc(nc(c1)CS[13CH3])C 62a_200025704644_100012357514 [1,0,1,0,0,0|2,0,0]=4 286 B11R1.34 Cc1cc(nc(n1)N)SCF 62a_100000183061_100015361967 [1,0,1,0,0,0|2,0,0]=4 287 B11R1.34 Cc1cc(nc(n1)N)SCF 62a_100015361967_100000183061 [1,0,1,0,0,0|2,0,0]=4 288 B11R1.182 CCNc1nc(ncc1C)N 27a_100015525214_100000016107 [1,0,1,0,0,0|2,0,0]=4 289 B11R1.182 CCSc1nc(ncc1C)N 62a_100000016107_100000210202 [1,0,1,0,0,0|2,0,0]=4 290 B11R1.182 CCSc1nc(ncc1C)N 62a_100000210202_100000016107 [1,0,1,0,0,0|2,0,0]=4 291 B11R1.182 Cc1cnc(nc1SCF)N 62a_100000016107_100015361967 [1,0,1,0,0,0|2,0,0]=4 292 B11R1.182 Cc1cnc(nc1SCF)N 62a_100015361967_100000016107 [1,0,1,0,0,0|2,0,0]=4 293 B11R1.1 CCCCc1ccc(nc1)N 271570a_100020621405_100000187370 [1,0,1,0,0,0|2,0,0]=4 294 B11R1.1 CCCCc1cnc(nc1)Br 271570a_100020621405_200012349914 [1,0,1,0,0,0|2,0,0]=4 295 B11R1.1 CCCCc1cnc(nc1)C 271570a_100020621405_100000686985 [1,0,1,0,0,0|2,0,0]=4 296 B11R1.1 CCCCc1cnc(nc1)F 271570a_100020621405_100000685262 [1,0,1,0,0,0|2,0,0]=4 297 B11R1.1 CCCCc1cnc(nc1)N 271570a_100020621405_100000760574 [1,0,1,0,0,0|1,0,0]=3 298 B11R1.1 CCCCc1cnc(nn1)N 271570a_100020621405_100000691435 [1,0,1,0,0,0|2,0,0]=4 299 B11R1.1 CCCOc1cnc(nc1)N 34a_100000087137_100000210303 [1,0,1,0,0,0|2,0,0]=4 300 B11R1.1 CCCOc1cnc(nc1)N 7a_100000087137_100000210303 [1,0,1,0,0,0|2,0,0]=4 301 B11R1.1 CCCSc1cnc(nc1)N 62a_100000210303_100000766020 [1,0,1,0,0,0|2,0,0]=4 302 B11R1.1 CCCSc1cnc(nc1)N 62a_100000766020_100000210303 [1,0,1,0,0,0|2,0,0]=4 303 B11R1.1 CCNCc1cnc(nc1)C 270004a_100015525214_100011202771 [1,0,1,0,0,0|2,0,0]=4 304 B11R1.1 CCOCc1ccc(nc1)N 34a_100000704267_100000210202 [1,0,1,0,0,0|1,1,0]=4 305 B11R1.1 CCOCc1cnc(nc1)C 34a_100011746891_100000210202 [1,0,1,0,0,0|1,1,0]=4 306 B11R1.1 CCOCc1cnc(nc1)Cl 34a_100009855073_100000210202 [1,0,1,0,0,0|1,1,0]=4 307 B11R1.1 CCOCc1cnc(nc1)Cl 7a_100009855073_100000210202 [1,0,1,0,0,0|1,1,0]=4 308 B11R1.1 CCSCc1ccc(nc1)Br 62a_100000210202_100009831999 [1,0,1,0,0,0|2,0,0]=4 309 B11R1.1 CCSCc1ccc(nc1)Br 62a_100009831999_100000210202 [1,0,1,0,0,0|2,0,0]=4 310 B11R1.1 CCSCc1ccc(nc1)C 62a_100000210202_100016987292 [1,0,1,0,0,0|2,0,0]=4 311 B11R1.1 CCSCc1ccc(nc1)C 62a_100016987292_100000210202 [1,0,1,0,0,0|2,0,0]=4 312 B11R1.1 CCSCc1ccc(nc1)Cl 62a_100000210202_100000735431 [1,0,1,0,0,0|2,0,0]=4 313 B11R1.1 CCSCc1ccc(nc1)Cl 62a_100000735431_100000210202 [1,0,1,0,0,0|2,0,0]=4 314 B11R1.1 CCSCc1ccc(nc1)F 62a_100000210202_100000099788 [1,0,1,0,0,0|2,0,0]=4 315 B11R1.1 CCSCc1ccc(nc1)F 62a_100009820150_100000210202 [1,0,1,0,0,0|2,0,0]=4 316 B11R1.17 CCCCc1cccnc1C 271570a_100020621405_100000751574 [1,0,1,0,0,0|2,0,0]=4 317 B11R1.17 CCCCc1cnccc1C 271570a_100020621405_100000761580 [1,0,1,0,0,0|2,0,0]=4 318 B11R1.17 CCCCc1cncnc1Br 271570a_100020621405_200012461658 [1,0,1,0,0,0|2,0,0]=4 319 B11R1.17 CCCCc1cncnc1C 271570a_100020621405_100009819671 [1,0,1,0,0,0|1,0,0]=3 320 B11R1.17 CCCCc1cncnc1Cl 271570a_100020621405_100000758962 [1,0,1,0,0,0|2,0,0]=4 321 B11R1.17 CCCCc1cncnc1N 271570a_100020621405_100011996079 [1,0,1,0,0,0|2,0,0]=4 322 B11R1.17 CCCCc1cncnc1O 271570a_100020621405_100000751107 [1,0,1,0,0,0|2,0,0]=4 323 B11R1.17 CCCSc1cncnc1C 62a_100000210303_100009819671 [1,0,1,0,0,0|2,0,0]=4 324 B11R1.17 CCCSc1cncnc1C 62a_100009819671_100000210303 [1,0,1,0,0,0|2,0,0]=4 325 B11R1.17 CCNCc1cccnc1C 207a_100015525214_100000751968 [1,0,1,0,0,0|2,0,0]=4 326 B11R1.17 CCNCc1cccnc1C 2230a_100015525214_100000732876 [1,0,1,0,0,0|2,0,0]=4 327 B11R1.17 CCNCc1cccnc1C 270004a_100015525214_100000751968 [1,0,1,0,0,0|2,0,0]=4 328 B11R1.17 CCNCc1cnccc1C 207a_100015525214_100000685662 [1,0,1,0,0,0|2,0,0]=4 329 B11R1.17 CCNCc1cnccc1C 2230a_100015525214_100000690890 [1,0,1,0,0,0|2,0,0]=4 330 B11R1.17 CCNCc1cnccc1C 270004a_100015525214_100000685662 [1,0,1,0,0,0|2,0,0]=4 331 B11R1.17 CCOCc1cccnc1C 34a_100000729262_100000210202 [1,0,1,0,0,0|1,1,0]=4 332 B11R1.17 CCOCc1cccnc1C 34a_100121572206_100000732876 [1,0,1,0,0,0|1,1,0]=4 333 B11R1.17 CCOCc1cccnc1C 7a_100000729262_100000210202 [1,0,1,0,0,0|1,1,0]=4 334 B11R1.17 CCOCc1cnccc1C 34a_100011996381_100000210202 [1,0,1,0,0,0|1,1,0]=4 335 B11R1.17 CCOCc1cnccc1C 34a_100121572206_100000690890 [1,0,1,0,0,0|1,1,0]=4 336 B11R1.17 CCSCc1ccccc1C 62a_100000210202_100000211839 [1,0,1,0,0,0|2,0,0]=4 337 B11R1.17 CCSCc1ccccc1C 62a_100000211839_100000210202 [1,0,1,0,0,0|2,0,0]=4 338 B11R1.17 CCSCc1cccnc1Br 62a_100000210202_100010140945 [1,0,1,0,0,0|2,0,0]=4 339 B11R1.17 CCSCc1cccnc1Br 62a_100010140945_100000210202 [1,0,1,0,0,0|2,0,0]=4 340 B11R1.17 CCSCc1cccnc1C 62a_100000210202_100000732876 [1,0,1,0,0,0|1,0,0]=3 341 B11R1.17 CCSCc1cccnc1C 62a_100000732876_100000210202 [1,0,1,0,0,0|1,0,0]=3 342 B11R1.17 CCSCc1cccnc1Cl 62a_100000045678_100000210202 [1,0,1,0,0,0|2,0,0]=4 343 B11R1.17 CCSCc1cccnc1Cl 62a_100000210202_100000045678 [1,0,1,0,0,0|2,0,0]=4 344 B11R1.17 CCSCc1cccnc1F 62a_100000099810_100000210202 [1,0,1,0,0,0|2,0,0]=4 345 B11R1.17 CCSCc1cccnc1F 62a_100000210202_100000099810 [1,0,1,0,0,0|2,0,0]=4 346 B11R1.17 CCSCc1cnccc1C 62a_100000210202_100000690890 [1,0,1,0,0,0|1,0,0]=3 347 B11R1.17 CCSCc1cnccc1C 62a_100000690890_100000210202 [1,0,1,0,0,0|1,0,0]=3 348 B11R1.17 Cc1ccncc1CSCF 62a_100000690890_100015361967 [1,0,1,0,0,0|2,0,0]=4 349 B11R1.17 Cc1ccncc1CSCF 62a_100015361967_100000690890 [1,0,1,0,0,0|2,0,0]=4 350 B11R1.17 Cc1ncccc1CSCF 62a_100000732876_100015361967 [1,0,1,0,0,0|2,0,0]=4 351 B11R1.17 Cc1ncccc1CSCF 62a_100015361967_100000732876 [1,0,1,0,0,0|2,0,0]=4 352 B11R1.81 CC=Cc1cnc(nc1C)N 271570a_100016259895_100000725598 [1,0,1,0,0,0|0,0,2]=4 353 B11R1.81 CCCc1cnc(nc1O)C 271570a_203496583355_200000069602 [1,0,1,0,0,0|2,0,0]=4 354 B11R1.81 CCOc1cnc(nc1C)C 34a_100009864123_100000210202 [1,0,1,0,0,0|1,1,0]=4 355 B11R1.81 CCOc1cnc(nc1C)C 7a_100009864123_100000210202 [1,0,1,0,0,0|1,1,0]=4 356 B11R1.81 CCOc1cnc(nc1N)N 7a_100025726691_100000210202 [1,0,1,0,0,0|1,1,0]=4 357 B11R1.81 CCSc1ccc(cc1C)N 62a_100000210202_100000210723 [1,0,1,0,0,0|2,0,0]=4 358 B11R1.81 CCSc1ccc(cc1C)N 62a_100000210723_100000210202 [1,0,1,0,0,0|2,0,0]=4 359 B11R1.81 CCSc1ccc(nc1Br)N 62a_100000210202_100010734177 [1,0,1,0,0,0|2,0,0]=4 360 B11R1.81 CCSc1ccc(nc1Br)N 62a_100010734177_100000210202 [1,0,1,0,0,0|2,0,0]=4 361 B11R1.81 CCSc1ccc(nc1C)C 62a_100000210202_100009813853 [1,0,1,0,0,0|2,0,0]=4 362 B11R1.81 CCSc1ccc(nc1C)C 62a_100009813853_100000210202 [1,0,1,0,0,0|2,0,0]=4 363 B11R1.81 CCSc1ccc(nc1C)Cl 62a_100000062408_100000210202 [1,0,1,0,0,0|2,0,0]=4 364 B11R1.81 CCSc1ccc(nc1C)Cl 62a_100000210202_100000062408 [1,0,1,0,0,0|2,0,0]=4 365 B11R1.81 CCSc1ccc(nc1C)F 62a_100000210202_100000688911 [1,0,1,0,0,0|2,0,0]=4 366 B11R1.81 CCSc1ccc(nc1C)F 62a_100000688911_100000210202 [1,0,1,0,0,0|2,0,0]=4 367 B11R1.81 CCSc1ccc(nc1C)N 62a_100000187202_100000210202 [1,0,1,0,0,0|1,0,0]=3 368 B11R1.81 CCSc1ccc(nc1C)N 62a_100000210202_100000187202 [1,0,1,0,0,0|1,0,0]=3 369 B11R1.81 CCSc1ccc(nc1C)O 62a_100000210202_100000691680 [1,0,1,0,0,0|2,0,0]=4 370 B11R1.81 CCSc1ccc(nc1C)O 62a_100000691680_100000210202 [1,0,1,0,0,0|2,0,0]=4 371 B11R1.81 CCSc1ccc(nc1Cl)N 62a_100000210202_100010270343 [1,0,1,0,0,0|2,0,0]=4 372 B11R1.81 CCSc1ccc(nc1Cl)N 62a_100010270343_100000210202 [1,0,1,0,0,0|2,0,0]=4 373 B11R1.81 CCSc1ccc(nc1F)N 62a_100000210202_100009882772 [1,0,1,0,0,0|2,0,0]=4 374 B11R1.81 CCSc1ccc(nc1F)N 62a_100009882772_100000210202 [1,0,1,0,0,0|2,0,0]=4 375 B11R1.81 CCSc1ccc(nc1N)N 62a_100011356871_100000210202 [1,0,1,0,0,0|2,0,0]=4 376 B11R1.81 CCSc1cnc([nH]c1=O)N 62a_100012456729_100000210202 [1,0,1,0,0,0|1,0,1]=4 377 B11R1.81 CCSc1cnc(cc1Br)N 62a_100000210202_100010074611 [1,0,1,0,0,0|2,0,0]=4 378 B11R1.81 CCSc1cnc(cc1Br)N 62a_100010074611_100000210202 [1,0,1,0,0,0|2,0,0]=4 379 B11R1.81 CCSc1cnc(cc1C)Br 62a_100000210202_100009816104 [1,0,1,0,0,0|2,0,0]=4 380 B11R1.81 CCSc1cnc(cc1C)Br 62a_100009816104_100000210202 [1,0,1,0,0,0|2,0,0]=4 381 B11R1.81 CCSc1cnc(cc1C)C 62a_100000210202_100009819613 [1,0,1,0,0,0|2,0,0]=4 382 B11R1.81 CCSc1cnc(cc1C)C 62a_100009819613_100000210202 [1,0,1,0,0,0|2,0,0]=4 383 B11R1.81 CCSc1cnc(cc1C)Cl 62a_100000210202_100010172789 [1,0,1,0,0,0|2,0,0]=4 384 B11R1.81 CCSc1cnc(cc1C)Cl 62a_100010172789_100000210202 [1,0,1,0,0,0|2,0,0]=4 385 B11R1.81 CCSc1cnc(cc1C)F 62a_100000210202_100009820716 [1,0,1,0,0,0|2,0,0]=4 386 B11R1.81 CCSc1cnc(cc1C)F 62a_100009820716_100000210202 [1,0,1,0,0,0|2,0,0]=4 387 B11R1.81 CCSc1cnc(cc1C)N 62a_100000050067_100000210202 [1,0,1,0,0,0|1,0,0]=3 388 B11R1.81 CCSc1cnc(cc1C)N 62a_100000210202_100000050067 [1,0,1,0,0,0|1,0,0]=3 389 B11R1.81 CCSc1cnc(cc1C)O 62a_100000210202_100000766222 [1,0,1,0,0,0|2,0,0]=4 390 B11R1.81 CCSc1cnc(cc1C)O 62a_100000766222_100000210202 [1,0,1,0,0,0|2,0,0]=4 391 B11R1.81 CCSc1cnc(cc1Cl)N 62a_100000210202_100000694920 [1,0,1,0,0,0|2,0,0]=4 392 B11R1.81 CCSc1cnc(cc1Cl)N 62a_100000694920_100000210202 [1,0,1,0,0,0|2,0,0]=4 393 B11R1.81 CCSc1cnc(cc1F)N 62a_100000210202_100009844730 [1,0,1,0,0,0|2,0,0]=4 394 B11R1.81 CCSc1cnc(cc1F)N 62a_100009844730_100000210202 [1,0,1,0,0,0|2,0,0]=4 395 B11R1.81 CCSc1cnc(cc1N)N 62a_100000210202_200009857908 [1,0,1,0,0,0|2,0,0]=4 396 B11R1.81 CCSc1cnc(cc1N)N 62a_200009857908_100000210202 [1,0,1,0,0,0|2,0,0]=4 397 B11R1.81 CCSc1cnc(nc1C)N 62a_100000210202_100000725598 [1,0,1,0,0,0|0,0,0]=2 398 B11R1.81 CCSc1cnc(nc1C)N 62a_100000725598_100000210202 [1,0,1,0,0,0|0,0,0]=2 399 B11R1.81 CCSc1cnc(nc1Cl)Cl 62a_100000210202_100000049956 [1,0,1,0,0,0|2,0,0]=4 400 B11R1.81 CCSc1cnc(nc1F)F 62a_100000210202_100009820707 [1,0,1,0,0,0|2,0,0]=4 401 B11R1.81 CCSc1cnc(nc1F)F 62a_100009820707_100000210202 [1,0,1,0,0,0|2,0,0]=4 402 B11R1.81 CCSc1cnc(nc1N)C 62a_100000210202_100000684960 [1,0,1,0,0,0|2,0,0]=4 403 B11R1.81 CCSc1cnc(nc1N)C 62a_100000684960_100000210202 [1,0,1,0,0,0|2,0,0]=4 404 B11R1.81 CCSc1cnc(nc1N)Cl 62a_100000210202_100010196077 [1,0,1,0,0,0|2,0,0]=4 405 B11R1.81 CCSc1cnc(nc1N)Cl 62a_100010196077_100000210202 [1,0,1,0,0,0|2,0,0]=4 406 B11R1.81 CCSc1cnc(nc1N)N 62a_100000210202_200010734216 [1,0,1,0,0,0|1,0,0]=3 407 B11R1.81 CCSc1cnc(nc1N)N 62a_200010734216_100000210202 [1,0,1,0,0,0|1,0,0]=3 408 B11R1.81 CCSc1ncc(nc1C)N 62a_100000210202_100009818570 [1,0,1,0,0,0|2,0,0]=4 409 B11R1.81 CCSc1ncc(nc1C)N 62a_100009818570_100000210202 [1,0,1,0,0,0|2,0,0]=4 410 B11R1.81 CCSc1nnc(cc1C)N 62a_100000123434_100000210202 [1,0,1,0,0,0|2,0,0]=4 411 B11R1.81 CCSc1nnc(cc1C)N 62a_100000210202_100000123434 [1,0,1,0,0,0|2,0,0]=4 412 B11R1.81 COCc1cnc(nc1C)C 34a_100000699490_200000210301 [1,0,1,0,0,0|1,1,0]=4 413 B11R1.81 COCc1cnc(nc1C)C 7a_100000699490_200000210301 [1,0,1,0,0,0|1,1,0]=4 414 B11R1.81 COCc1cnc(nc1N)N 7a_100000083744_200000210301 [1,0,1,0,0,0|1,1,0]=4 415 B11R1.81 CSCc1cnc(cc1C)F 62a_100010382440_200000210301 [1,0,1,0,0,0|2,0,0]=4 416 B11R1.81 CSCc1cnc(cc1C)F 62a_200000210301_100010382440 [1,0,1,0,0,0|2,0,0]=4 417 B11R1.81 CSCc1cnc(nc1Cl)Cl 62a_100000071240_200000210301 [1,0,1,0,0,0|2,0,0]=4 418 B11R1.81 CSCc1cnc(nc1Cl)Cl 62a_200000210301_100000071240 [1,0,1,0,0,0|2,0,0]=4 419 B11R1.81 Cc1cc(ncc1CS[13CH3])F 62a_100010382440_200025704644 [1,0,1,0,0,0|2,0,0]=4 420 B11R1.81 Cc1cc(ncc1CS[13CH3])F 62a_200025704644_100010382440 [1,0,1,0,0,0|2,0,0]=4 421 B11R1.81 Cc1cc(ncc1SCF)N 62a_100000050067_100015361967 [1,0,1,0,0,0|2,0,0]=4 422 B11R1.81 Cc1cc(ncc1SCF)N 62a_100015361967_100000050067 [1,0,1,0,0,0|2,0,0]=4 423 B11R1.81 Cc1nc(ccc1SCF)N 62a_100000187202_100015361967 [1,0,1,0,0,0|2,0,0]=4 424 B11R1.81 Cc1nc(ccc1SCF)N 62a_100015361967_100000187202 [1,0,1,0,0,0|2,0,0]=4 425 B11R1.81 Cc1nc(ncc1SCF)N 62a_100000725598_100015361967 [1,0,1,0,0,0|1,0,0]=3 426 B11R1.81 Cc1nc(ncc1SCF)N 62a_100015361967_100000725598 [1,0,1,0,0,0|1,0,0]=3 427 B11R1.81 Cc1ncc(c(n1)C)CO[13CH3] 34a_100000699490_200025704644 [1,0,1,0,0,0|1,1,0]=4 428 B11R1.81 Cc1ncc(c(n1)C)CO[13CH3] 7a_100000699490_200025704644 [1,0,1,0,0,0|1,1,0]=4 429 B11R1.81 Nc1ncc(c(n1)N)SCF 62a_100015361967_200010734216 [1,0,1,0,0,0|2,0,0]=4 430 B11R1.81 Nc1ncc(c(n1)N)SCF 62a_200010734216_100015361967 [1,0,1,0,0,0|2,0,0]=4 431 B11R1.81 [13CH3]OCc1cnc(nc1N)N 7a_100000083744_200025704644 [1,0,1,0,0,0|1,1,0]=4 432 B11R1.81 [13CH3]SCc1cnc(nc1Cl)Cl 62a_100000071240_200025704644 [1,0,1,0,0,0|2,0,0]=4 433 B11R1.81 [13CH3]SCc1cnc(nc1Cl)Cl 62a_200025704644_100000071240 [1,0,1,0,0,0|2,0,0]=4 434 B11R1.24 CCCCc1cc(ccn1)C 271570a_100020621405_100000750283 [1,0,1,0,0,0|2,0,0]=4 435 B11R1.24 CCCCc1cc(ncn1)C 271570a_100020621405_100000744208 [1,0,1,0,0,0|1,0,0]=3 436 B11R1.24 CCCCc1cc(ncn1)F 271570a_100020621405_200009880791 [1,0,1,0,0,0|2,0,0]=4 437 B11R1.24 CCCCc1cc(ncn1)N 271570a_100020621405_100000701291 [1,0,1,0,0,0|2,0,0]=4 438 B11R1.24 CCCCc1cc(ncn1)O 271570a_100020621405_100000765262 [1,0,1,0,0,0|2,0,0]=4 439 B11R1.24 CCCCc1cccc(n1)N 271570a_100020621405_100000740741 [1,0,1,0,0,0|2,0,0]=4 440 B11R1.24 CCCCc1ccnc(c1)C 271570a_100020621405_100000758586 [1,0,1,0,0,0|2,0,0]=4 441 B11R1.24 CCCCc1ccnc(c1)N 271570a_100020621405_100000744379 [1,0,1,0,0,0|2,0,0]=4 442 B11R1.24 CCCCc1ccnc(n1)C 271570a_100020621405_100000749937 [1,0,1,0,0,0|2,0,0]=4 443 B11R1.24 CCCCc1ccnc(n1)N 271570a_100020621405_100009820717 [1,0,1,0,0,0|1,0,0]=3 444 B11R1.24 CCCCc1ncnc(n1)N 271570a_100020621405_100000123831 [1,0,1,0,0,0|2,0,0]=4 445 B11R1.24 CCCSc1cc(ncn1)C 62a_100000210303_100000744208 [1,0,1,0,0,0|2,0,0]=4 446 B11R1.24 CCCSc1cc(ncn1)C 62a_100000744208_100000210303 [1,0,1,0,0,0|2,0,0]=4 447 B11R1.24 CCCSc1ccnc(n1)N 62a_100000055538_100000210303 [1,0,1,0,0,0|2,0,0]=4 448 B11R1.24 CCCSc1ccnc(n1)N 62a_100000210303_100000055538 [1,0,1,0,0,0|2,0,0]=4 449 B11R1.24 COCSc1cc(ncn1)C 62a_100000744208_100000766300 [1,0,1,0,0,0|1,1,0]=4 450 B11R1.24 COCSc1cc(ncn1)C 62a_100000766300_100000744208 [1,0,1,0,0,0|1,1,0]=4 451 B11R1.24 COCSc1ccnc(n1)N 62a_100000055538_100000766300 [1,0,1,0,0,0|1,1,0]=4 452 B11R1.24 COCSc1ccnc(n1)N 62a_100000766300_100000055538 [1,0,1,0,0,0|1,1,0]=4 453 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [1,0,1,0,0,0|2,0,0]=4 454 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [1,0,1,0,0,0|2,0,0]=4 455 B11R1.24 CSCOc1ccnc(c1)C 34a_100000688365_100011218213 [1,0,1,0,0,0|2,0,0]=4 456 B11R1.24 CSCOc1ccnc(c1)N 34a_100011834064_100011218213 [1,0,1,0,0,0|2,0,0]=4 457 B11R1.24 CSCSc1cc(ccn1)C 62a_100000750283_100011218213 [1,0,1,0,0,0|2,0,0]=4 458 B11R1.24 CSCSc1cc(ccn1)C 62a_100011218213_100000750283 [1,0,1,0,0,0|2,0,0]=4 459 B11R1.24 CSCSc1cc(ncn1)C 62a_100000744208_100011218213 [1,0,1,0,0,0|1,0,0]=3 460 B11R1.24 CSCSc1cc(ncn1)C 62a_100011218213_100000744208 [1,0,1,0,0,0|1,0,0]=3 461 B11R1.24 CSCSc1cc(ncn1)Cl 62a_100010161198_100011218213 [1,0,1,0,0,0|2,0,0]=4 462 B11R1.24 CSCSc1cc(ncn1)Cl 62a_100011218213_100010161198 [1,0,1,0,0,0|2,0,0]=4 463 B11R1.24 CSCSc1cc(ncn1)F 62a_100011218213_200009880791 [1,0,1,0,0,0|2,0,0]=4 464 B11R1.24 CSCSc1cc(ncn1)F 62a_200009880791_100011218213 [1,0,1,0,0,0|2,0,0]=4 465 B11R1.24 CSCSc1cc(ncn1)N 62a_100000701291_100011218213 [1,0,1,0,0,0|2,0,0]=4 466 B11R1.24 CSCSc1cc(ncn1)N 62a_100011218213_100000701291 [1,0,1,0,0,0|2,0,0]=4 467 B11R1.24 CSCSc1cc(ncn1)O 62a_100011218213_100000765262 [1,0,1,0,0,0|2,0,0]=4 468 B11R1.24 CSCSc1cccc(n1)N 62a_100000740741_100011218213 [1,0,1,0,0,0|2,0,0]=4 469 B11R1.24 CSCSc1cccc(n1)N 62a_100011218213_100000740741 [1,0,1,0,0,0|2,0,0]=4 470 B11R1.24 CSCSc1ccnc(c1)C 62a_100000758586_100011218213 [1,0,1,0,0,0|2,0,0]=4 471 B11R1.24 CSCSc1ccnc(c1)C 62a_100011218213_100000758586 [1,0,1,0,0,0|2,0,0]=4 472 B11R1.24 CSCSc1ccnc(c1)N 62a_100000049665_100011218213 [1,0,1,0,0,0|2,0,0]=4 473 B11R1.24 CSCSc1ccnc(c1)N 62a_100011218213_100000049665 [1,0,1,0,0,0|2,0,0]=4 474 B11R1.24 CSCSc1ccnc(n1)C 62a_100000749937_100011218213 [1,0,1,0,0,0|2,0,0]=4 475 B11R1.24 CSCSc1ccnc(n1)C 62a_100011218213_100000749937 [1,0,1,0,0,0|2,0,0]=4 476 B11R1.24 CSCSc1ccnc(n1)Cl 62a_100010154678_100011218213 [1,0,1,0,0,0|2,0,0]=4 477 B11R1.24 CSCSc1ccnc(n1)Cl 62a_100011218213_100010154678 [1,0,1,0,0,0|2,0,0]=4 478 B11R1.24 CSCSc1ccnc(n1)N 62a_100000055538_100011218213 [1,0,1,0,0,0|1,0,0]=3 479 B11R1.24 CSCSc1ccnc(n1)N 62a_100011218213_100000055538 [1,0,1,0,0,0|1,0,0]=3 480 B11R1.24 CSCSc1ncnc(n1)N 62a_100000123831_100011218213 [1,0,1,0,0,0|2,0,0]=4 481 B11R1.24 CSCSc1ncnc(n1)N 62a_100011218213_100000123831 [1,0,1,0,0,0|2,0,0]=4 482 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [1,0,1,0,0,0|2,0,0]=4 483 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [1,0,1,0,0,0|2,0,0]=4 484 B11R1.464 C=Cc1c(nc(nc1C)N)C 271570a_100011290941_100009814254 [1,0,1,0,0,0|0,0,2]=4 485 B11R1.464 CSc1c(cc(cc1C)N)C 62a_100000215964_200000210301 [1,0,1,0,0,0|2,0,0]=4 486 B11R1.464 CSc1c(cc(cc1C)N)C 62a_200000210301_100000215964 [1,0,1,0,0,0|2,0,0]=4 487 B11R1.464 CSc1c(cc(nc1C)N)C 62a_100000699364_200000210301 [1,0,1,0,0,0|1,0,0]=3 488 B11R1.464 CSc1c(cc(nc1C)N)C 62a_200000210301_100000699364 [1,0,1,0,0,0|1,0,0]=3 489 B11R1.464 CSc1c(nc(nc1C)N)C 62a_100009814254_200000210301 [1,0,1,0,0,0|0,0,0]=2 490 B11R1.464 CSc1c(nc(nc1C)N)C 62a_200000210301_100009814254 [1,0,1,0,0,0|0,0,0]=2 491 B11R1.464 CSc1c(nc(nc1Cl)C)C 62a_200000210301_200011356833 [1,0,1,0,0,0|2,0,0]=4 492 B11R1.464 CSc1c(nc(nc1Cl)C)C 62a_200011356833_200000210301 [1,0,1,0,0,0|2,0,0]=4 493 B11R1.464 CSc1c(nc(nc1Cl)N)C 62a_100010254241_200000210301 [1,0,1,0,0,0|1,0,0]=3 494 B11R1.464 CSc1c(nc(nc1Cl)N)C 62a_200000210301_100010254241 [1,0,1,0,0,0|1,0,0]=3 495 B11R1.464 CSc1c(nc(nc1O)N)C 62a_200000008613_200000210301 [1,0,1,0,0,0|1,0,0]=3 496 B11R1.464 CSc1c(nc(nc1O)N)C 62a_200000210301_200000008613 [1,0,1,0,0,0|1,0,0]=3 497 B11R1.464 CSc1c(nc(nc1O)N)N 62a_200009812812_200000210301 [1,0,1,0,0,0|2,0,0]=4 498 B11R1.464 Cc1cc(cc(c1S[13CH3])C)N 62a_100000215964_200025704644 [1,0,1,0,0,0|2,0,0]=4 499 B11R1.464 Cc1cc(cc(c1S[13CH3])C)N 62a_200025704644_100000215964 [1,0,1,0,0,0|2,0,0]=4 500 B11R1.464 Cc1cc(nc(c1S[13CH3])C)N 62a_100000699364_200025704644 [1,0,1,0,0,0|1,0,0]=3 501 B11R1.464 Cc1cc(nc(c1S[13CH3])C)N 62a_200025704644_100000699364 [1,0,1,0,0,0|1,0,0]=3 502 B11R1.464 Cc1nc(c(c(n1)Cl)S[13CH3])C 62a_200011356833_200025704644 [1,0,1,0,0,0|2,0,0]=4 503 B11R1.464 Cc1nc(c(c(n1)Cl)S[13CH3])C 62a_200025704644_200011356833 [1,0,1,0,0,0|2,0,0]=4 504 B11R1.464 Cc1nc(nc(c1S[13CH3])C)N 62a_100009814254_200025704644 [1,0,1,0,0,0|0,0,0]=2 505 B11R1.464 Cc1nc(nc(c1S[13CH3])C)N 62a_200025704644_100009814254 [1,0,1,0,0,0|0,0,0]=2 506 B11R1.464 Cc1nc(nc(c1S[13CH3])Cl)N 62a_100010254241_200025704644 [1,0,1,0,0,0|1,0,0]=3 507 B11R1.464 Cc1nc(nc(c1S[13CH3])Cl)N 62a_200025704644_100010254241 [1,0,1,0,0,0|1,0,0]=3 508 B11R1.464 Cc1nc(nc(c1S[13CH3])O)N 62a_200000008613_200025704644 [1,0,1,0,0,0|1,0,0]=3 509 B11R1.464 Cc1nc(nc(c1S[13CH3])O)N 62a_200025704644_200000008613 [1,0,1,0,0,0|1,0,0]=3 510 B11R1.464 [13CH3]Sc1c(nc(nc1O)N)N 62a_200009812812_200025704644 [1,0,1,0,0,0|2,0,0]=4 511 B11R1.605 CC=Cc1c(ncnc1C)C 271570a_100016259895_100009820708 [1,0,1,0,0,0|1,0,1]=4 512 B11R1.605 CCNc1c(ncnc1C)C 27a_100015525214_100009820708 [1,0,1,0,0,0|2,0,0]=4 513 B11R1.605 CCOc1c(ncnc1C)C 34a_100009878406_100000210202 [1,0,1,0,0,0|2,0,0]=4 514 B11R1.605 CCOc1c(ncnc1C)C 7a_100009878406_100000210202 [1,0,1,0,0,0|2,0,0]=4 515 B11R1.605 CCSc1c(ncnc1C)C 62a_100000210202_100009820708 [1,0,1,0,0,0|2,0,0]=4 516 B11R1.605 CCSc1c(ncnc1C)C 62a_100009820708_100000210202 [1,0,1,0,0,0|2,0,0]=4 517 B11R1.605 CSCc1c(cccc1C)C 62a_100000758300_200000210301 [1,0,1,0,0,0|2,0,0]=4 518 B11R1.605 CSCc1c(cccc1C)C 62a_200000210301_100000758300 [1,0,1,0,0,0|2,0,0]=4 519 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_100000758300_200025704644 [1,0,1,0,0,0|2,0,0]=4 520 B11R1.605 Cc1cccc(c1CS[13CH3])C 62a_200025704644_100000758300 [1,0,1,0,0,0|2,0,0]=4 521 B13R1.123 C#CCNc1nc(nc(c1C)C)N 27a_100000212058_100000076065 [0,1,1,0,0,0|1,0,1]=4 522 B13R1.123 C#CCSc1nc(nc(c1C)C)N 62a_100000038162_100000076065 [0,1,1,0,0,0|1,0,1]=4 523 B13R1.123 C=CCNc1nc(nc(c1C)C)N 27a_100020586998_100000076065 [0,1,1,0,0,0|1,0,1]=4 524 B13R1.123 C=CCSc1nc(nc(c1C)C)N 62a_100000076065_100000210623 [0,1,1,0,0,0|1,0,1]=4 525 B13R1.123 C=CCSc1nc(nc(c1C)C)N 62a_100000210623_100000076065 [0,1,1,0,0,0|1,0,1]=4 526 B13R1.123 CCCCc1nc(nc(c1C)C)N 271570a_100020621405_100000076065 [0,1,1,0,0,0|1,0,0]=3 527 B13R1.123 CCCOc1nc(nc(c1C)C)C 34a_100000762955_100000210303 [0,1,1,0,0,0|2,0,0]=4 528 B13R1.123 CCCSc1nc(nc(c1C)C)N 62a_100000076065_100000210303 [0,1,1,0,0,0|1,0,0]=3 529 B13R1.123 CCCSc1nc(nc(c1C)C)N 62a_100000210303_100000076065 [0,1,1,0,0,0|1,0,0]=3 530 B13R1.123 COCSc1nc(nc(c1C)C)N 62a_100000076065_100000766300 [0,1,1,0,0,0|1,1,0]=4 531 B13R1.123 COCSc1nc(nc(c1C)C)N 62a_100000766300_100000076065 [0,1,1,0,0,0|1,1,0]=4 532 B13R1.123 CSCOc1nc(nc(c1C)C)C 34a_100000762955_100011218213 [0,1,1,0,0,0|2,0,0]=4 533 B13R1.123 CSCSc1nc(nc(c1C)C)N 62a_100000076065_100011218213 [0,1,1,0,0,0|1,0,0]=3 534 B13R1.123 CSCSc1nc(nc(c1C)C)N 62a_100011218213_100000076065 [0,1,1,0,0,0|1,0,0]=3 535 B13R1.123 Cc1nc(c(c(n1)OCCF)C)C 34a_100000762955_100011217306 [0,1,1,0,0,0|2,0,0]=4 536 B13R1.123 Cc1nc(c(c(n1)OCCO)C)C 34a_100000762955_100000211926 [0,1,1,0,0,0|1,1,0]=4 537 B13R1.123 Cc1nc(nc(c1C)NCCO)N 27a_100000210304_100000076065 [0,1,1,0,0,0|0,1,0]=3 538 B13R1.123 Cc1nc(nc(c1C)SCC#N)N 62a_100000076065_100011215382 [0,1,1,0,0,0|1,0,1]=4 539 B13R1.123 Cc1nc(nc(c1C)SCC#N)N 62a_100011215382_100000076065 [0,1,1,0,0,0|1,0,1]=4 540 B13R1.123 Cc1nc(nc(c1C)SCC=O)N 62a_100000076065_200015260668 [0,1,1,0,0,0|0,1,1]=4 541 B13R1.123 Cc1nc(nc(c1C)SCC=O)N 62a_200015260668_100000076065 [0,1,1,0,0,0|0,1,1]=4 542 B13R1.123 Cc1nc(nc(c1C)SCCF)N 62a_100000076065_100011217306 [0,1,1,0,0,0|1,0,0]=3 543 B13R1.123 Cc1nc(nc(c1C)SCCF)N 62a_100011217306_100000076065 [0,1,1,0,0,0|1,0,0]=3 544 B13R1.123 Cc1nc(nc(c1C)SCCO)N 62a_100000076065_100000211926 [0,1,1,0,0,0|0,1,0]=3 545 B13R1.123 Cc1nc(nc(c1C)SCCO)N 62a_100000211926_100000076065 [0,1,1,0,0,0|0,1,0]=3 546 B13R1.2816 Cc1nc(nc(c1C)NC(C)C)N 27a_100138425928_100000076065 [0,1,1,0,0,0|2,0,0]=4 547 B13R1.2816 Cc1nc(nc(c1C)SC(C)C)N 62a_100000076065_100000210206 [0,1,1,0,0,0|2,0,0]=4 548 B13R1.2816 Cc1nc(nc(c1C)SC(C)C)N 62a_100000210206_100000076065 [0,1,1,0,0,0|2,0,0]=4 549 B13R1.73 CCCCc1ccc(nc1OC)N 271570a_100020621405_100010187630 [0,1,1,0,0,0|2,0,0]=4 550 B13R1.73 CCCCc1cnc(cc1OC)N 271570a_100020621405_100015506990 [0,1,1,0,0,0|2,0,0]=4 551 B13R1.73 CCCCc1cnc(nc1OC)N 271570a_100020621405_100010240410 [0,1,1,0,0,0|1,0,0]=3 552 B13R1.73 CCCSc1cnc(nc1OC)N 62a_100000210303_100010240410 [0,1,1,0,0,0|2,0,0]=4 553 B13R1.73 CCCSc1cnc(nc1OC)N 62a_100010240410_100000210303 [0,1,1,0,0,0|2,0,0]=4 554 B13R1.73 CCOCc1cnc(nc1OC)Cl 34a_200011024631_100000210202 [0,1,1,0,0,0|1,1,0]=4 555 B13R1.73 CCSCc1ccc(nc1OC)Br 62a_100000210202_100016029037 [0,1,1,0,0,0|2,0,0]=4 556 B13R1.73 CCSCc1ccc(nc1OC)Br 62a_100016029037_100000210202 [0,1,1,0,0,0|2,0,0]=4 557 B13R1.75 CCCCc1cnc(cc1C)NC 271570a_100020621405_100012352278 [0,1,1,0,0,0|2,0,0]=4 558 B13R1.75 CCCCc1cnc(cc1C)NN 271570a_100020621405_100012357568 [0,1,1,0,0,0|2,0,0]=4 559 B13R1.75 CCCCc1cnc(nc1C)OC 271570a_100020621405_100010152497 [0,1,1,0,0,0|2,0,0]=4 560 B13R1.75 CCCCc1cnc(nc1C)SC 271570a_100020621405_100015672207 [0,1,1,0,0,0|2,0,0]=4 561 B13R1.75 CCNCc1cnc(nc1C)SC 207a_100015525214_200010621462 [0,1,1,0,0,0|2,0,0]=4 562 B13R1.164 CC(C)OCc1cnc(nc1N)N 7a_100000083744_100000210206 [0,1,1,0,0,0|1,1,0]=4 563 B13R1.164 CC(C)SCc1cnc(nc1Cl)Cl 62a_100000071240_100000210206 [0,1,1,0,0,0|2,0,0]=4 564 B13R1.164 CC(C)SCc1cnc(nc1Cl)Cl 62a_100000210206_100000071240 [0,1,1,0,0,0|2,0,0]=4 565 B13R1.164 Cc1cc(ncc1CSC(C)C)F 62a_100000210206_100010382440 [0,1,1,0,0,0|2,0,0]=4 566 B13R1.164 Cc1cc(ncc1CSC(C)C)F 62a_100010382440_100000210206 [0,1,1,0,0,0|2,0,0]=4 567 B13R1.164 Cc1nc(ncc1C=CC(C)C)N 271570a_100016257149_100000725598 [0,1,1,0,0,0|1,0,1]=4 568 B13R1.164 Cc1nc(ncc1C=CC(C)O)N 271570a_200011019289_100000725598 [0,1,1,0,0,0|1,0,1]=4 569 B13R1.164 Cc1nc(ncc1SCC(C)C)N 62a_100000210624_100000725598 [0,1,1,0,0,0|2,0,0]=4 570 B13R1.164 Cc1nc(ncc1SCC(C)C)N 62a_100000725598_100000210760 [0,1,1,0,0,0|2,0,0]=4 571 B13R1.164 Cc1nc(ncc1SCC(C)O)N 62a_100000725598_100011218427 [0,1,1,0,0,0|2,0,0]=4 572 B13R1.164 Cc1nc(ncc1SCC(C)O)N 62a_100011218427_100000725598 [0,1,1,0,0,0|2,0,0]=4 573 B13R1.164 Cc1nc(ncc1SC[C@@H](C)O)N 62a_100000725598_100009817552 [0,1,1,0,0,0|2,0,0]=4 574 B13R1.164 Cc1nc(ncc1SC[C@@H](C)O)N 62a_100009817552_100000725598 [0,1,1,0,0,0|2,0,0]=4 575 B13R1.164 Cc1ncc(c(n1)C)COC(C)C 34a_100000699490_100000210206 [0,1,1,0,0,0|1,1,0]=4 576 B13R1.164 Cc1ncc(c(n1)C)COC(C)C 7a_100000699490_100000210206 [0,1,1,0,0,0|1,1,0]=4 577 B13R1.369 C/C=C/CSc1cnc(nc1C)N 62a_100000725598_100102629194 [0,1,1,0,0,0|1,0,1]=4 578 B13R1.369 C/C=C/CSc1cnc(nc1C)N 62a_100102629194_100000725598 [0,1,1,0,0,0|1,0,1]=4 579 B13R1.369 CC#CCSc1cnc(nc1C)N 62a_100000725598_100000748600 [0,1,1,0,0,0|1,0,1]=4 580 B13R1.369 CC#CCSc1cnc(nc1C)N 62a_100000748600_100000725598 [0,1,1,0,0,0|1,0,1]=4 581 B13R1.369 CC=CCSc1cnc(nc1C)N 62a_100000070051_100000725598 [0,1,1,0,0,0|1,0,1]=4 582 B13R1.369 CC=CCSc1cnc(nc1C)N 62a_100000725598_100000070051 [0,1,1,0,0,0|1,0,1]=4 583 B13R1.369 CCCC=Cc1cnc(nc1C)N 271570a_100016258520_100000725598 [0,1,1,0,0,0|1,0,1]=4 584 B13R1.369 CCCCOc1cnc(nc1C)C 34a_100009864123_100000210210 [0,1,1,0,0,0|2,0,0]=4 585 B13R1.369 CCCCOc1cnc(nc1C)C 7a_100009864123_100000210211 [0,1,1,0,0,0|2,0,0]=4 586 B13R1.369 CCCCOc1cnc(nc1N)N 7a_100025726691_100000210211 [0,1,1,0,0,0|2,0,0]=4 587 B13R1.369 CCCCSc1ccc(nc1C)N 62a_100000187202_100000210210 [0,1,1,0,0,0|2,0,0]=4 588 B13R1.369 CCCCSc1ccc(nc1C)N 62a_100000210211_100000187202 [0,1,1,0,0,0|2,0,0]=4 589 B13R1.369 CCCCSc1cnc(cc1C)N 62a_100000050067_100000210210 [0,1,1,0,0,0|2,0,0]=4 590 B13R1.369 CCCCSc1cnc(cc1C)N 62a_100000210211_100000050067 [0,1,1,0,0,0|2,0,0]=4 591 B13R1.369 CCCCSc1cnc(nc1C)N 62a_100000210211_100000725598 [0,1,1,0,0,0|1,0,0]=3 592 B13R1.369 CCCCSc1cnc(nc1C)N 62a_100000725598_100000210210 [0,1,1,0,0,0|1,0,0]=3 593 B13R1.369 CCCCSc1cnc(nc1N)N 62a_100000210211_200010734216 [0,1,1,0,0,0|2,0,0]=4 594 B13R1.369 CCCCSc1cnc(nc1N)N 62a_200010734216_100000210210 [0,1,1,0,0,0|2,0,0]=4 595 B13R1.369 CCCOCc1cnc(nc1C)C 34a_100000699490_100000210303 [0,1,1,0,0,0|1,1,0]=4 596 B13R1.369 CCCOCc1cnc(nc1C)C 7a_100000699490_100000210303 [0,1,1,0,0,0|1,1,0]=4 597 B13R1.369 CCCOCc1cnc(nc1N)N 7a_100000083744_100000210303 [0,1,1,0,0,0|1,1,0]=4 598 B13R1.369 CCCSCc1cnc(cc1C)F 62a_100000210303_100010382440 [0,1,1,0,0,0|2,0,0]=4 599 B13R1.369 CCCSCc1cnc(cc1C)F 62a_100010382440_100000210303 [0,1,1,0,0,0|2,0,0]=4 600 B13R1.369 CCCSCc1cnc(nc1Cl)Cl 62a_100000071240_100000210303 [0,1,1,0,0,0|2,0,0]=4 601 B13R1.369 CCCSCc1cnc(nc1Cl)Cl 62a_100000210303_100000071240 [0,1,1,0,0,0|2,0,0]=4 602 B13R1.369 CCOC=Cc1cnc(nc1C)N 271570a_100016256518_100000725598 [0,1,1,0,0,0|0,1,1]=4 603 B13R1.369 CCOCSc1ccc(nc1C)N 62a_100000187202_100000739092 [0,1,1,0,0,0|1,1,0]=4 604 B13R1.369 CCOCSc1ccc(nc1C)N 62a_100000739092_100000187202 [0,1,1,0,0,0|1,1,0]=4 605 B13R1.369 CCOCSc1cnc(cc1C)N 62a_100000050067_100000739092 [0,1,1,0,0,0|1,1,0]=4 606 B13R1.369 CCOCSc1cnc(cc1C)N 62a_100000739092_100000050067 [0,1,1,0,0,0|1,1,0]=4 607 B13R1.369 CCOCSc1cnc(nc1C)N 62a_100000725598_100000739092 [0,1,1,0,0,0|0,1,0]=3 608 B13R1.369 CCOCSc1cnc(nc1C)N 62a_100000739092_100000725598 [0,1,1,0,0,0|0,1,0]=3 609 B13R1.369 CCOCSc1cnc(nc1N)N 62a_100000739092_200010734216 [0,1,1,0,0,0|1,1,0]=4 610 B13R1.369 CCOCSc1cnc(nc1N)N 62a_200010734216_100000739092 [0,1,1,0,0,0|1,1,0]=4 611 B13R1.369 COCC=Cc1cnc(nc1C)N 271570a_100016286323_100000725598 [0,1,1,0,0,0|1,0,1]=4 612 B13R1.369 COCCSc1cnc(nc1C)N 62a_100000233755_100000725598 [0,1,1,0,0,0|2,0,0]=4 613 B13R1.369 COCCSc1cnc(nc1C)N 62a_100000725598_100000233755 [0,1,1,0,0,0|2,0,0]=4 614 B13R1.369 COCSCc1cnc(cc1C)F 62a_100000766300_100010382440 [0,1,1,0,0,0|2,0,0]=4 615 B13R1.369 COCSCc1cnc(cc1C)F 62a_100010382440_100000766300 [0,1,1,0,0,0|2,0,0]=4 616 B13R1.369 COCSCc1cnc(nc1Cl)Cl 62a_100000071240_100000766300 [0,1,1,0,0,0|2,0,0]=4 617 B13R1.369 COCSCc1cnc(nc1Cl)Cl 62a_100000766300_100000071240 [0,1,1,0,0,0|2,0,0]=4 618 B13R1.369 CSCCSc1cnc(nc1C)N 62a_100000212216_100000725598 [0,1,1,0,0,0|2,0,0]=4 619 B13R1.369 CSCCSc1cnc(nc1C)N 62a_100000725598_100000751147 [0,1,1,0,0,0|2,0,0]=4 620 B13R1.369 CSCOCc1cnc(nc1C)C 34a_100000699490_100011218213 [0,1,1,0,0,0|1,1,0]=4 621 B13R1.369 CSCSCc1cnc(cc1C)F 62a_100010382440_100011218213 [0,1,1,0,0,0|2,0,0]=4 622 B13R1.369 CSCSCc1cnc(cc1C)F 62a_100011218213_100010382440 [0,1,1,0,0,0|2,0,0]=4 623 B13R1.369 CSCSCc1cnc(nc1Cl)Cl 62a_100000071240_100011218213 [0,1,1,0,0,0|2,0,0]=4 624 B13R1.369 CSCSCc1cnc(nc1Cl)Cl 62a_100011218213_100000071240 [0,1,1,0,0,0|2,0,0]=4 625 B13R1.369 Cc1cc(ncc1CSCCF)F 62a_100010382440_100011217306 [0,1,1,0,0,0|2,0,0]=4 626 B13R1.369 Cc1cc(ncc1CSCCF)F 62a_100011217306_100010382440 [0,1,1,0,0,0|2,0,0]=4 627 B13R1.369 Cc1cc(ncc1CSCCO)F 62a_100000211926_100010382440 [0,1,1,0,0,0|2,0,0]=4 628 B13R1.369 Cc1cc(ncc1CSCCO)F 62a_100010382440_100000211926 [0,1,1,0,0,0|2,0,0]=4 629 B13R1.369 Cc1nc(ncc1SCCCF)N 62a_100000725598_100011934791 [0,1,1,0,0,0|2,0,0]=4 630 B13R1.369 Cc1nc(ncc1SCCCF)N 62a_100011934791_100000725598 [0,1,1,0,0,0|2,0,0]=4 631 B13R1.369 Cc1nc(ncc1SCCCO)N 62a_100000725598_100011215043 [0,1,1,0,0,0|2,0,0]=4 632 B13R1.369 Cc1nc(ncc1SCCCO)N 62a_100011215043_100000725598 [0,1,1,0,0,0|2,0,0]=4 633 B13R1.369 Cc1nc(ncc1SCSC#N)N 62a_100000211825_100000725598 [0,1,1,0,0,0|1,0,1]=4 634 B13R1.369 Cc1nc(ncc1SCSC#N)N 62a_100000725598_100000211825 [0,1,1,0,0,0|1,0,1]=4 635 B13R1.369 Cc1ncc(c(n1)C)COCCF 34a_100000699490_100011217306 [0,1,1,0,0,0|1,1,0]=4 636 B13R1.369 Cc1ncc(c(n1)C)COCCF 7a_100000699490_100011217306 [0,1,1,0,0,0|1,1,0]=4 637 B13R1.369 Cc1ncc(c(n1)C)COCCO 34a_100000699490_100000211926 [0,1,1,0,0,0|1,1,0]=4 638 B13R1.369 Cc1ncc(c(n1)C)COCCO 7a_100000699490_100000211926 [0,1,1,0,0,0|1,1,0]=4 639 B13R1.369 FCCSCc1cnc(nc1Cl)Cl 62a_100000071240_100011217306 [0,1,1,0,0,0|2,0,0]=4 640 B13R1.369 FCCSCc1cnc(nc1Cl)Cl 62a_100011217306_100000071240 [0,1,1,0,0,0|2,0,0]=4 641 B13R1.369 Nc1ncc(c(n1)N)COCCF 7a_100000083744_100011217306 [0,1,1,0,0,0|1,1,0]=4 642 B13R1.369 Nc1ncc(c(n1)N)COCCO 7a_100000083744_100000211926 [0,1,1,0,0,0|1,1,0]=4 643 B13R1.369 OCCSCc1cnc(nc1Cl)Cl 62a_100000071240_100000211926 [0,1,1,0,0,0|2,0,0]=4 644 B13R1.369 OCCSCc1cnc(nc1Cl)Cl 62a_100000211926_100000071240 [0,1,1,0,0,0|2,0,0]=4 645 B13R1.1601 CCCCc1c(cc(nc1C)N)C 271570a_100020621405_100000699364 [0,1,1,0,0,0|2,0,0]=4 646 B13R1.1601 CCCCc1c(nc(nc1C)N)C 271570a_100020621405_100009814254 [0,1,1,0,0,0|1,0,0]=3 647 B13R1.1601 CCCCc1c(nc(nc1Cl)C)C 271570a_100020621405_200011356833 [0,1,1,0,0,0|2,0,0]=4 648 B13R1.1601 CCCCc1c(nc(nc1O)N)C 271570a_100020621405_200000008613 [0,1,1,0,0,0|1,0,0]=3 649 B13R1.1601 CCCSc1c(nc(nc1C)N)C 62a_100000210303_100009814254 [0,1,1,0,0,0|2,0,0]=4 650 B13R1.1601 CCCSc1c(nc(nc1C)N)C 62a_100009814254_100000210303 [0,1,1,0,0,0|2,0,0]=4 651 B13R1.1601 CCCSc1c(nc(nc1Cl)N)C 62a_100000210303_100010254241 [0,1,1,0,0,0|2,0,0]=4 652 B13R1.1601 CCCSc1c(nc(nc1Cl)N)C 62a_100010254241_100000210303 [0,1,1,0,0,0|2,0,0]=4 653 B13R1.1601 CCCSc1c(nc(nc1O)N)C 62a_100000210303_200000008613 [0,1,1,0,0,0|2,0,0]=4 654 B13R1.1601 CCCSc1c(nc(nc1O)N)C 62a_200000008613_100000210303 [0,1,1,0,0,0|2,0,0]=4 655 B13R1.1630 CCCCc1cc(c(nc1C)N)N 271570a_100020621405_100000688597 [0,1,1,0,0,0|2,0,0]=4 656 B13R1.2679 CCC(C)Sc1cnc(nc1C)N 62a_100000725598_100000758301 [0,1,1,0,0,0|2,0,0]=4 657 B13R1.2679 CCC(C)Sc1cnc(nc1C)N 62a_100000758301_100000725598 [0,1,1,0,0,0|2,0,0]=4 658 B13R1.3518 CCCCc1cnc(c(c1C)C)N 271570a_100020621405_100009813837 [0,1,1,0,0,0|2,0,0]=4 659 B13R1.3518 CCCCc1cnc(c(c1C)N)N 271570a_100020621405_100010187632 [0,1,1,0,0,0|2,0,0]=4 660 B13R1.55 C#CCCNc1cc(nc(n1)N)C 27a_100000755551_100000183061 [0,1,1,0,0,0|1,0,1]=4 661 B13R1.55 C#CCCSc1cc(nc(n1)N)C 62a_100000183061_100000688953 [0,1,1,0,0,0|1,0,1]=4 662 B13R1.55 C#CCCSc1cc(nc(n1)N)C 62a_100000688953_100000183061 [0,1,1,0,0,0|1,0,1]=4 663 B13R1.55 C/C=C/CSc1cc(nc(n1)N)C 62a_100000183061_100102629194 [0,1,1,0,0,0|1,0,1]=4 664 B13R1.55 C/C=C/CSc1cc(nc(n1)N)C 62a_100102629194_100000183061 [0,1,1,0,0,0|1,0,1]=4 665 B13R1.55 C=CCCNc1cc(nc(n1)N)C 27a_100015191253_100000183061 [0,1,1,0,0,0|1,0,1]=4 666 B13R1.55 C=CCCSc1cc(nc(n1)N)C 62a_100000183061_100000754431 [0,1,1,0,0,0|1,0,1]=4 667 B13R1.55 C=CCCSc1cc(nc(n1)N)C 62a_100000754431_100000183061 [0,1,1,0,0,0|1,0,1]=4 668 B13R1.55 CC#CCNc1cc(nc(n1)N)C 27a_100000685387_100000183061 [0,1,1,0,0,0|1,0,1]=4 669 B13R1.55 CC#CCSc1cc(nc(n1)N)C 62a_100000183061_100000748600 [0,1,1,0,0,0|1,0,1]=4 670 B13R1.55 CC#CCSc1cc(nc(n1)N)C 62a_100000748600_100000183061 [0,1,1,0,0,0|1,0,1]=4 671 B13R1.55 CC=CCSc1cc(nc(n1)N)C 62a_100000070051_100000183061 [0,1,1,0,0,0|1,0,1]=4 672 B13R1.55 CC=CCSc1cc(nc(n1)N)C 62a_100000183061_100000070051 [0,1,1,0,0,0|1,0,1]=4 673 B13R1.55 CCCC=Cc1cc(nc(n1)N)C 271570a_100016258520_100000183061 [0,1,1,0,0,0|1,0,1]=4 674 B13R1.55 CCCCNc1cc(nc(n1)C)C 27a_100000102301_100000736142 [0,1,1,0,0,0|2,0,0]=4 675 B13R1.55 CCCCNc1cc(nc(n1)N)C 27a_100000102301_100000183061 [0,1,1,0,0,0|1,0,0]=3 676 B13R1.55 CCCCNc1cc(nc(n1)N)O 27a_100000102301_100000694715 [0,1,1,0,0,0|2,0,0]=4 677 B13R1.55 CCCCNc1nc(nc(n1)N)C 27a_100000102301_200012022553 [0,1,1,0,0,0|2,0,0]=4 678 B13R1.55 CCCCSc1cc(cc(n1)N)C 62a_100000210211_100009819863 [0,1,1,0,0,0|2,0,0]=4 679 B13R1.55 CCCCSc1cc(cc(n1)N)C 62a_100009819863_100000210210 [0,1,1,0,0,0|2,0,0]=4 680 B13R1.55 CCCCSc1cc(nc(c1)N)C 62a_100000076705_100000210210 [0,1,1,0,0,0|2,0,0]=4 681 B13R1.55 CCCCSc1cc(nc(c1)N)C 62a_100000210211_100000076705 [0,1,1,0,0,0|2,0,0]=4 682 B13R1.55 CCCCSc1cc(nc(n1)C)C 62a_100000210211_100000736142 [0,1,1,0,0,0|2,0,0]=4 683 B13R1.55 CCCCSc1cc(nc(n1)C)C 62a_100000736142_100000210210 [0,1,1,0,0,0|2,0,0]=4 684 B13R1.55 CCCCSc1cc(nc(n1)N)C 62a_100000183061_100000210210 [0,1,1,0,0,0|1,0,0]=3 685 B13R1.55 CCCCSc1cc(nc(n1)N)C 62a_100000210211_100000183061 [0,1,1,0,0,0|1,0,0]=3 686 B13R1.55 CCCCSc1cc(nc(n1)N)N 62a_100000212091_100000210210 [0,1,1,0,0,0|2,0,0]=4 687 B13R1.55 CCCCSc1cc(nc(n1)N)O 62a_100000694715_100000210210 [0,1,1,0,0,0|2,0,0]=4 688 B13R1.55 CCCCSc1nc(nc(n1)N)C 62a_100000210211_200012022553 [0,1,1,0,0,0|2,0,0]=4 689 B13R1.55 CCCCSc1nc(nc(n1)N)C 62a_200012022553_100000210210 [0,1,1,0,0,0|2,0,0]=4 690 B13R1.55 CCOCSc1cc(nc(n1)N)C 62a_100000183061_100000739092 [0,1,1,0,0,0|1,1,0]=4 691 B13R1.55 CCOCSc1cc(nc(n1)N)C 62a_100000739092_100000183061 [0,1,1,0,0,0|1,1,0]=4 692 B13R1.55 COCC=Cc1cc(nc(n1)N)C 271570a_100016286323_100000183061 [0,1,1,0,0,0|0,1,1]=4 693 B13R1.55 COCCNc1cc(nc(n1)C)C 27a_100000209980_100000736142 [0,1,1,0,0,0|1,1,0]=4 694 B13R1.55 COCCNc1cc(nc(n1)N)C 27a_100000209980_100000183061 [0,1,1,0,0,0|0,1,0]=3 695 B13R1.55 COCCNc1cc(nc(n1)N)O 27a_100000209980_100000694715 [0,1,1,0,0,0|1,1,0]=4 696 B13R1.55 COCCNc1nc(nc(n1)N)C 27a_100000209980_200012022553 [0,1,1,0,0,0|1,1,0]=4 697 B13R1.55 COCCSc1cc(cc(n1)N)C 62a_100000233755_100009819863 [0,1,1,0,0,0|1,1,0]=4 698 B13R1.55 COCCSc1cc(cc(n1)N)C 62a_100009819863_100000233755 [0,1,1,0,0,0|1,1,0]=4 699 B13R1.55 COCCSc1cc(nc(c1)N)C 62a_100000076705_100000233755 [0,1,1,0,0,0|1,1,0]=4 700 B13R1.55 COCCSc1cc(nc(c1)N)C 62a_100000233755_100000076705 [0,1,1,0,0,0|1,1,0]=4 701 B13R1.55 COCCSc1cc(nc(n1)C)C 62a_100000233755_100000736142 [0,1,1,0,0,0|1,1,0]=4 702 B13R1.55 COCCSc1cc(nc(n1)C)C 62a_100000736142_100000233755 [0,1,1,0,0,0|1,1,0]=4 703 B13R1.55 COCCSc1cc(nc(n1)N)C 62a_100000183061_100000233755 [0,1,1,0,0,0|0,1,0]=3 704 B13R1.55 COCCSc1cc(nc(n1)N)C 62a_100000233755_100000183061 [0,1,1,0,0,0|0,1,0]=3 705 B13R1.55 COCCSc1cc(nc(n1)N)N 62a_100000212091_100000233755 [0,1,1,0,0,0|1,1,0]=4 706 B13R1.55 COCCSc1cc(nc(n1)N)O 62a_100000694715_100000233755 [0,1,1,0,0,0|1,1,0]=4 707 B13R1.55 COCCSc1nc(nc(n1)N)C 62a_100000233755_200012022553 [0,1,1,0,0,0|1,1,0]=4 708 B13R1.55 COCCSc1nc(nc(n1)N)C 62a_200012022553_100000233755 [0,1,1,0,0,0|1,1,0]=4 709 B13R1.55 CSCCNc1cc(cc(n1)C)C 27a_100020590264_100000069240 [0,1,1,0,0,0|2,0,0]=4 710 B13R1.55 CSCCNc1cc(cc(n1)F)C 27a_100020590264_100009819601 [0,1,1,0,0,0|2,0,0]=4 711 B13R1.55 CSCCNc1cc(nc(c1)C)C 27a_100020590264_100000066820 [0,1,1,0,0,0|2,0,0]=4 712 B13R1.55 CSCCNc1cc(nc(c1)Cl)C 27a_100020590264_100010068023 [0,1,1,0,0,0|2,0,0]=4 713 B13R1.55 CSCCNc1cc(nc(c1)F)C 27a_100020590264_100010006595 [0,1,1,0,0,0|2,0,0]=4 714 B13R1.55 CSCCNc1cc(nc(n1)C)C 27a_100020590264_100000736142 [0,1,1,0,0,0|1,0,0]=3 715 B13R1.55 CSCCNc1cc(nc(n1)C)N 27a_100020590264_100000761517 [0,1,1,0,0,0|2,0,0]=4 716 B13R1.55 CSCCNc1cc(nc(n1)C)O 27a_100020590264_106741647437 [0,1,1,0,0,0|2,0,0]=4 717 B13R1.55 CSCCNc1cc(nc(n1)N)C 27a_100020590264_100000183061 [0,1,1,0,0,0|0,0,0]=2 718 B13R1.55 CSCCNc1cc(nc(n1)N)O 27a_100020590264_100000694715 [0,1,1,0,0,0|1,0,0]=3 719 B13R1.55 CSCCNc1nc(cc(n1)N)C 27a_100020590264_100000687285 [0,1,1,0,0,0|2,0,0]=4 720 B13R1.55 CSCCNc1nc(nc(n1)C)C 27a_100020590264_100015468570 [0,1,1,0,0,0|2,0,0]=4 721 B13R1.55 CSCCNc1nc(nc(n1)N)C 27a_100020590264_200012022553 [0,1,1,0,0,0|1,0,0]=3 722 B13R1.55 CSCCNc1nc(nc(n1)N)N 27a_100020590264_100000188858 [0,1,1,0,0,0|2,0,0]=4 723 B13R1.55 CSCCOc1cc(cc(c1)N)C 34a_100011995906_100000212216 [0,1,1,0,0,0|2,0,0]=4 724 B13R1.55 CSCCOc1cc(cc(c1)N)C 7a_100011995906_100000212216 [0,1,1,0,0,0|2,0,0]=4 725 B13R1.55 CSCCSc1cc(cc(c1)N)C 62a_100000212216_100000695972 [0,1,1,0,0,0|2,0,0]=4 726 B13R1.55 CSCCSc1cc(cc(c1)N)C 62a_100000695972_100000751147 [0,1,1,0,0,0|2,0,0]=4 727 B13R1.55 CSCCSc1cc(cc(n1)C)C 62a_100000069240_100000751147 [0,1,1,0,0,0|2,0,0]=4 728 B13R1.55 CSCCSc1cc(cc(n1)C)C 62a_100000212216_100000069240 [0,1,1,0,0,0|2,0,0]=4 729 B13R1.55 CSCCSc1cc(cc(n1)F)C 62a_100000212216_100009819601 [0,1,1,0,0,0|2,0,0]=4 730 B13R1.55 CSCCSc1cc(cc(n1)F)C 62a_100009819601_100000751147 [0,1,1,0,0,0|2,0,0]=4 731 B13R1.55 CSCCSc1cc(cc(n1)N)C 62a_100000212216_100009819863 [0,1,1,0,0,0|1,0,0]=3 732 B13R1.55 CSCCSc1cc(cc(n1)N)C 62a_100009819863_100000751147 [0,1,1,0,0,0|1,0,0]=3 733 B13R1.55 CSCCSc1cc(nc(c1)C)C 62a_100000066820_100000751147 [0,1,1,0,0,0|2,0,0]=4 734 B13R1.55 CSCCSc1cc(nc(c1)C)C 62a_100000212216_100000066820 [0,1,1,0,0,0|2,0,0]=4 735 B13R1.55 CSCCSc1cc(nc(c1)Cl)C 62a_100000212216_100010068023 [0,1,1,0,0,0|2,0,0]=4 736 B13R1.55 CSCCSc1cc(nc(c1)Cl)C 62a_100010068023_100000751147 [0,1,1,0,0,0|2,0,0]=4 737 B13R1.55 CSCCSc1cc(nc(c1)Cl)N 62a_100000212216_200011084131 [0,1,1,0,0,0|2,0,0]=4 738 B13R1.55 CSCCSc1cc(nc(c1)Cl)N 62a_200011084131_100000751147 [0,1,1,0,0,0|2,0,0]=4 739 B13R1.55 CSCCSc1cc(nc(c1)F)C 62a_100000212216_100010006595 [0,1,1,0,0,0|2,0,0]=4 740 B13R1.55 CSCCSc1cc(nc(c1)F)C 62a_100010006595_100000751147 [0,1,1,0,0,0|2,0,0]=4 741 B13R1.55 CSCCSc1cc(nc(c1)N)C 62a_100000076705_100000751147 [0,1,1,0,0,0|1,0,0]=3 742 B13R1.55 CSCCSc1cc(nc(c1)N)C 62a_100000212216_100000076705 [0,1,1,0,0,0|1,0,0]=3 743 B13R1.55 CSCCSc1cc(nc(c1)N)N 62a_100009816676_100000751147 [0,1,1,0,0,0|2,0,0]=4 744 B13R1.55 CSCCSc1cc(nc(n1)C)C 62a_100000212216_100000736142 [0,1,1,0,0,0|1,0,0]=3 745 B13R1.55 CSCCSc1cc(nc(n1)C)C 62a_100000736142_100000751147 [0,1,1,0,0,0|1,0,0]=3 746 B13R1.55 CSCCSc1cc(nc(n1)C)N 62a_100000212216_100000761517 [0,1,1,0,0,0|2,0,0]=4 747 B13R1.55 CSCCSc1cc(nc(n1)C)N 62a_100000761517_100000751147 [0,1,1,0,0,0|2,0,0]=4 748 B13R1.55 CSCCSc1cc(nc(n1)C)O 62a_100000212216_106741647437 [0,1,1,0,0,0|2,0,0]=4 749 B13R1.55 CSCCSc1cc(nc(n1)N)C 62a_100000183061_100000751147 [0,1,1,0,0,0|0,0,0]=2 750 B13R1.55 CSCCSc1cc(nc(n1)N)C 62a_100000212216_100000183061 [0,1,1,0,0,0|0,0,0]=2 751 B13R1.55 CSCCSc1cc(nc(n1)N)N 62a_100000212091_100000751147 [0,1,1,0,0,0|1,0,0]=3 752 B13R1.55 CSCCSc1cc(nc(n1)N)O 62a_100000694715_100000751147 [0,1,1,0,0,0|1,0,0]=3 753 B13R1.55 CSCCSc1nc(cc(n1)N)C 62a_100000212216_100000687285 [0,1,1,0,0,0|2,0,0]=4 754 B13R1.55 CSCCSc1nc(cc(n1)N)C 62a_100000687285_100000751147 [0,1,1,0,0,0|2,0,0]=4 755 B13R1.55 CSCCSc1nc(nc(n1)C)C 62a_100000212216_100015468570 [0,1,1,0,0,0|2,0,0]=4 756 B13R1.55 CSCCSc1nc(nc(n1)C)C 62a_100015468570_100000751147 [0,1,1,0,0,0|2,0,0]=4 757 B13R1.55 CSCCSc1nc(nc(n1)N)C 62a_100000212216_200012022553 [0,1,1,0,0,0|1,0,0]=3 758 B13R1.55 CSCCSc1nc(nc(n1)N)C 62a_200012022553_100000751147 [0,1,1,0,0,0|1,0,0]=3 759 B13R1.55 CSCCSc1nc(nc(n1)N)N 62a_100000188858_100000751147 [0,1,1,0,0,0|2,0,0]=4 760 B13R1.55 CSCOCc1cc(cc(n1)C)C 34a_100012182918_100011218213 [0,1,1,0,0,0|2,0,0]=4 761 B13R1.55 CSCOCc1cc(nc(c1)C)C 34a_100012017140_100011218213 [0,1,1,0,0,0|2,0,0]=4 762 B13R1.55 CSCSCc1cc(cc(n1)C)C 62a_100011218213_100012357514 [0,1,1,0,0,0|2,0,0]=4 763 B13R1.55 CSCSCc1cc(cc(n1)C)C 62a_100012357514_100011218213 [0,1,1,0,0,0|2,0,0]=4 764 B13R1.55 CSCSCc1cc(nc(c1)C)C 62a_100011218213_200000139866 [0,1,1,0,0,0|2,0,0]=4 765 B13R1.55 CSCSCc1cc(nc(c1)C)C 62a_200000139866_100011218213 [0,1,1,0,0,0|2,0,0]=4 766 B13R1.55 Cc1cc(nc(n1)N)NCCC#N 27a_100000720768_100000183061 [0,1,1,0,0,0|2,0,0]=4 767 B13R1.55 Cc1cc(nc(n1)N)NCCCF 27a_100015189416_100000183061 [0,1,1,0,0,0|2,0,0]=4 768 B13R1.55 Cc1cc(nc(n1)N)NCCCO 27a_100000182051_100000183061 [0,1,1,0,0,0|2,0,0]=4 769 B13R1.55 Cc1cc(nc(n1)N)SCCC#N 62a_100000183061_100011215226 [0,1,1,0,0,0|2,0,0]=4 770 B13R1.55 Cc1cc(nc(n1)N)SCCC#N 62a_100011215226_100000183061 [0,1,1,0,0,0|2,0,0]=4 771 B13R1.55 Cc1cc(nc(n1)N)SCCCF 62a_100000183061_100011934791 [0,1,1,0,0,0|2,0,0]=4 772 B13R1.55 Cc1cc(nc(n1)N)SCCCF 62a_100011934791_100000183061 [0,1,1,0,0,0|2,0,0]=4 773 B13R1.55 Cc1cc(nc(n1)N)SCCCO 62a_100000183061_100011215043 [0,1,1,0,0,0|2,0,0]=4 774 B13R1.55 Cc1cc(nc(n1)N)SCCCO 62a_100011215043_100000183061 [0,1,1,0,0,0|2,0,0]=4 775 B13R1.55 Cc1cc(nc(n1)N)SCSC#N 62a_100000183061_100000211825 [0,1,1,0,0,0|1,0,1]=4 776 B13R1.55 Cc1cc(nc(n1)N)SCSC#N 62a_100000211825_100000183061 [0,1,1,0,0,0|1,0,1]=4 777 B13R1.124 CCCCc1cc(cc(n1)N)OC 271570a_100020621405_100010257270 [0,1,1,0,0,0|2,0,0]=4 778 B13R1.124 CCCCc1cc(nc(c1)CN)C 271570a_100020621405_100010178683 [0,1,1,0,0,0|2,0,0]=4 779 B13R1.124 CCCCc1cc(nc(c1)OC)N 271570a_100020621405_100010136845 [0,1,1,0,0,0|2,0,0]=4 780 B13R1.124 CCCCc1cc(nc(n1)C)CC 271570a_100020621405_100000761995 [0,1,1,0,0,0|2,0,0]=4 781 B13R1.124 CCCCc1cc(nc(n1)C)NC 271570a_100020621405_100000758931 [0,1,1,0,0,0|2,0,0]=4 782 B13R1.124 CCCCc1cc(nc(n1)C)OC 271570a_100020621405_100011686313 [0,1,1,0,0,0|2,0,0]=4 783 B13R1.124 CCCCc1cc(nc(n1)C)SC 271570a_100020621405_100011686690 [0,1,1,0,0,0|2,0,0]=4 784 B13R1.124 CCCCc1cc(nc(n1)CC)C 271570a_100020621405_100000687827 [0,1,1,0,0,0|2,0,0]=4 785 B13R1.124 CCCCc1cc(nc(n1)N)CC 271570a_100020621405_100000069509 [0,1,1,0,0,0|1,0,0]=3 786 B13R1.124 CCCCc1cc(nc(n1)N)NC 271570a_100020621405_100011228701 [0,1,1,0,0,0|1,0,0]=3 787 B13R1.124 CCCCc1cc(nc(n1)N)NN 271570a_100020621405_100000696133 [0,1,1,0,0,0|2,0,0]=4 788 B13R1.124 CCCCc1cc(nc(n1)N)OC 271570a_100020621405_100000686185 [0,1,1,0,0,0|1,0,0]=3 789 B13R1.124 CCCCc1cc(nc(n1)NC)C 271570a_100020621405_100011202761 [0,1,1,0,0,0|1,0,0]=3 790 B13R1.124 CCCCc1cc(nc(n1)SC)C 271570a_100020621405_100000073727 [0,1,1,0,0,0|2,0,0]=4 791 B13R1.124 CCCSc1cc(nc(n1)N)CC 62a_100000069509_100000210303 [0,1,1,0,0,0|2,0,0]=4 792 B13R1.124 CCCSc1cc(nc(n1)N)CC 62a_100000210303_100000069509 [0,1,1,0,0,0|2,0,0]=4 793 B13R1.124 CCCSc1cc(nc(n1)N)NC 62a_100011228701_100000210303 [0,1,1,0,0,0|2,0,0]=4 794 B13R1.124 CCCSc1cc(nc(n1)N)OC 62a_100000210303_100000686185 [0,1,1,0,0,0|2,0,0]=4 795 B13R1.124 CCCSc1cc(nc(n1)N)OC 62a_100000686185_100000210303 [0,1,1,0,0,0|2,0,0]=4 796 B13R1.124 CCCSc1cc(nc(n1)NC)C 62a_100000210303_100011202761 [0,1,1,0,0,0|2,0,0]=4 797 B13R1.124 CCCSc1cc(nc(n1)NC)C 62a_100011202761_100000210303 [0,1,1,0,0,0|2,0,0]=4 798 B13R1.124 CCc1cc(nc(n1)C)SCSC 62a_100000761995_100011218213 [0,1,1,0,0,0|2,0,0]=4 799 B13R1.124 CCc1cc(nc(n1)C)SCSC 62a_100011218213_100000761995 [0,1,1,0,0,0|2,0,0]=4 800 B13R1.124 CCc1cc(nc(n1)N)SCOC 62a_100000069509_100000766300 [0,1,1,0,0,0|1,1,0]=4 801 B13R1.124 CCc1cc(nc(n1)N)SCOC 62a_100000766300_100000069509 [0,1,1,0,0,0|1,1,0]=4 802 B13R1.124 CCc1cc(nc(n1)N)SCSC 62a_100000069509_100011218213 [0,1,1,0,0,0|1,0,0]=3 803 B13R1.124 CCc1cc(nc(n1)N)SCSC 62a_100011218213_100000069509 [0,1,1,0,0,0|1,0,0]=3 804 B13R1.124 CCc1nc(cc(n1)SCSC)C 62a_100000687827_100011218213 [0,1,1,0,0,0|2,0,0]=4 805 B13R1.124 CCc1nc(cc(n1)SCSC)C 62a_100011218213_100000687827 [0,1,1,0,0,0|2,0,0]=4 806 B13R1.124 CNc1cc(nc(n1)C)SCSC 62a_100000758931_100011218213 [0,1,1,0,0,0|2,0,0]=4 807 B13R1.124 CNc1cc(nc(n1)C)SCSC 62a_100011218213_100000758931 [0,1,1,0,0,0|2,0,0]=4 808 B13R1.124 CNc1cc(nc(n1)N)SCOC 62a_100011228701_100000766300 [0,1,1,0,0,0|1,1,0]=4 809 B13R1.124 CNc1cc(nc(n1)N)SCSC 62a_100011228701_100011218213 [0,1,1,0,0,0|1,0,0]=3 810 B13R1.124 CNc1nc(cc(n1)SCOC)C 62a_100000766300_100011202761 [0,1,1,0,0,0|1,1,0]=4 811 B13R1.124 CNc1nc(cc(n1)SCOC)C 62a_100011202761_100000766300 [0,1,1,0,0,0|1,1,0]=4 812 B13R1.124 CNc1nc(cc(n1)SCSC)C 62a_100011202761_100011218213 [0,1,1,0,0,0|1,0,0]=3 813 B13R1.124 CNc1nc(cc(n1)SCSC)C 62a_100011218213_100011202761 [0,1,1,0,0,0|1,0,0]=3 814 B13R1.124 COCSc1cc(nc(n1)N)OC 62a_100000686185_100000766300 [0,1,1,0,0,0|1,1,0]=4 815 B13R1.124 COCSc1cc(nc(n1)N)OC 62a_100000766300_100000686185 [0,1,1,0,0,0|1,1,0]=4 816 B13R1.124 COc1cc(cc(n1)N)SCSC 62a_100010136845_100011218213 [0,1,1,0,0,0|2,0,0]=4 817 B13R1.124 COc1cc(cc(n1)N)SCSC 62a_100011218213_100010136845 [0,1,1,0,0,0|2,0,0]=4 818 B13R1.124 COc1cc(nc(c1)SCSC)N 62a_100010257270_100011218213 [0,1,1,0,0,0|2,0,0]=4 819 B13R1.124 COc1cc(nc(c1)SCSC)N 62a_100011218213_100010257270 [0,1,1,0,0,0|2,0,0]=4 820 B13R1.124 COc1cc(nc(n1)C)SCSC 62a_100011218213_100011686313 [0,1,1,0,0,0|2,0,0]=4 821 B13R1.124 COc1cc(nc(n1)C)SCSC 62a_100011686313_100011218213 [0,1,1,0,0,0|2,0,0]=4 822 B13R1.124 COc1cc(nc(n1)N)SCSC 62a_100000686185_100011218213 [0,1,1,0,0,0|1,0,0]=3 823 B13R1.124 COc1cc(nc(n1)N)SCSC 62a_100011218213_100000686185 [0,1,1,0,0,0|1,0,0]=3 824 B13R1.124 CSCSc1cc(nc(c1)CN)C 62a_100010178683_100011218213 [0,1,1,0,0,0|2,0,0]=4 825 B13R1.124 CSCSc1cc(nc(c1)CN)C 62a_100011218213_100010178683 [0,1,1,0,0,0|2,0,0]=4 826 B13R1.124 CSCSc1cc(nc(n1)C)SC 62a_100011218213_100011686690 [0,1,1,0,0,0|2,0,0]=4 827 B13R1.124 CSCSc1cc(nc(n1)C)SC 62a_100011686690_100011218213 [0,1,1,0,0,0|2,0,0]=4 828 B13R1.124 CSCSc1cc(nc(n1)N)NN 62a_100000696133_100011218213 [0,1,1,0,0,0|2,0,0]=4 829 B13R1.124 CSCSc1cc(nc(n1)SC)C 62a_100000073727_100011218213 [0,1,1,0,0,0|2,0,0]=4 830 B13R1.124 CSCSc1cc(nc(n1)SC)C 62a_100011218213_100000073727 [0,1,1,0,0,0|2,0,0]=4 831 B13R1.450 CCCN(C)c1cc(nc(n1)N)C 27a_100000747261_100000183061 [0,1,1,0,0,0|2,0,0]=4 832 B13R1.2874 CCC(C)Sc1cc(nc(n1)N)C 62a_100000183061_100000758301 [0,1,1,0,0,0|2,0,0]=4 833 B13R1.2874 CCC(C)Sc1cc(nc(n1)N)C 62a_100000758301_100000183061 [0,1,1,0,0,0|2,0,0]=4 834 B13R1.2874 COC(C)Sc1cc(nc(n1)N)C 62a_100000183061_100009879195 [0,1,1,0,0,0|1,1,0]=4 835 B13R1.2874 COC(C)Sc1cc(nc(n1)N)C 62a_100009879195_100000183061 [0,1,1,0,0,0|1,1,0]=4 836 B13R1.3420 C=C(C)CNc1cc(nc(n1)N)C 27a_100000765925_100000183061 [0,1,1,0,0,0|2,0,0]=4 837 B13R1.3420 C=C(C)CSc1cc(nc(n1)N)C 62a_100000183061_100000211660 [0,1,1,0,0,0|2,0,0]=4 838 B13R1.3420 C=C(C)CSc1cc(nc(n1)N)C 62a_100000748629_100000183061 [0,1,1,0,0,0|2,0,0]=4 839 B13R1.3420 Cc1cc(nc(n1)N)NCC(C)C 27a_100000210953_100000183061 [0,1,1,0,0,0|2,0,0]=4 840 B13R1.3420 Cc1cc(nc(n1)N)NCC(C)O 27a_100000210904_100000183061 [0,1,1,0,0,0|2,0,0]=4 841 B13R1.3420 Cc1cc(nc(n1)N)SCC(C)C 62a_100000183061_100000210760 [0,1,1,0,0,0|2,0,0]=4 842 B13R1.3420 Cc1cc(nc(n1)N)SCC(C)C 62a_100000210624_100000183061 [0,1,1,0,0,0|2,0,0]=4 843 B13R1.3420 Cc1cc(nc(n1)N)SCC(C)O 62a_100000183061_100011218427 [0,1,1,0,0,0|2,0,0]=4 844 B13R1.3420 Cc1cc(nc(n1)N)SCC(C)O 62a_100011218427_100000183061 [0,1,1,0,0,0|2,0,0]=4 845 B13R1.3420 Cc1cc(nc(n1)N)SC[C@@H](C)O 62a_100000183061_100009817552 [0,1,1,0,0,0|2,0,0]=4 846 B13R1.3420 Cc1cc(nc(n1)N)SC[C@@H](C)O 62a_100009817552_100000183061 [0,1,1,0,0,0|2,0,0]=4 847 B13R1.3944 CCSc1c(nc(nc1CC)N)N 62a_200010243779_100000210202 [0,1,1,0,0,0|2,0,0]=4 848 B13R1.3944 CCSc1c(nc(nc1OC)N)C 62a_100000210202_200011180307 [0,1,1,0,0,0|2,0,0]=4 849 B13R1.3944 CCSc1c(nc(nc1OC)N)C 62a_200011180307_100000210202 [0,1,1,0,0,0|2,0,0]=4 850 B13R1.3944 CCc1nc(nc(c1SCF)N)N 62a_200010243779_100015361967 [0,1,1,0,0,0|2,0,0]=4 851 B13R1.3944 COc1nc(nc(c1SCF)C)N 62a_100015361967_200011180307 [0,1,1,0,0,0|2,0,0]=4 852 B13R1.3944 COc1nc(nc(c1SCF)C)N 62a_200011180307_100015361967 [0,1,1,0,0,0|2,0,0]=4 853 B13R1.2808 CC(=Cc1c(nc(nc1C)N)C)C 271570a_100102525489_100009814254 [0,1,1,0,0,0|1,0,1]=4 854 B13R1.2808 Cc1nc(nc(c1SC(C)C)C)N 62a_100000210206_100009814254 [0,1,1,0,0,0|2,0,0]=4 855 B13R1.2808 Cc1nc(nc(c1SC(C)C)C)N 62a_100009814254_100000210206 [0,1,1,0,0,0|2,0,0]=4 856 B13R2.57 C=Cc1ncc2c(n1)CCNC2 271570a_100011290941_100020629273 [1,1,0,0,0,0|2,0,0]=4 857 B13R2.57 CNc1ncc2c(n1)CCNC2 27a_100102657272_100020629273 [1,1,0,0,0,0|1,0,0]=3 858 B13R2.57 CSc1ncc2c(n1)CCNC2 62a_100020629273_200000210301 [1,1,0,0,0,0|2,0,0]=4 859 B13R2.57 CSc1ncc2c(n1)CCNC2 62a_200000210301_100020629273 [1,1,0,0,0,0|2,0,0]=4 860 B13R2.57 [13CH3]Sc1ncc2c(n1)CCNC2 62a_100020629273_200025704644 [1,1,0,0,0,0|2,0,0]=4 861 B13R2.57 [13CH3]Sc1ncc2c(n1)CCNC2 62a_200025704644_100020629273 [1,1,0,0,0,0|2,0,0]=4 862 B13R2.3683 CN1CCc2nc(ncc2C1)Cl 2230a_100020629273_200000210301 [1,1,0,0,0,0|2,0,0]=4 863 B13R2.3683 CN1CCc2nc(ncc2C1)Cl 269982a_100020629273_200000210301 [1,1,0,0,0,0|2,0,0]=4 864 B13R2.3683 CN1CCc2nc(ncc2C1)O 2230a_200025716142_200000210301 [1,1,0,0,0,0|2,0,0]=4 865 B13R2.3683 CN1CCc2nc(ncc2C1)O 269982a_200025716142_200000210301 [1,1,0,0,0,0|2,0,0]=4 866 B13R2.3683 [13CH3]N1CCc2nc(ncc2C1)Cl 2230a_100020629273_200025704644 [1,1,0,0,0,0|2,0,0]=4 867 B13R2.3683 [13CH3]N1CCc2nc(ncc2C1)Cl 269982a_100020629273_200025704644 [1,1,0,0,0,0|2,0,0]=4 868 B13R2.3683 [13CH3]N1CCc2nc(ncc2C1)O 2230a_200025716142_200025704644 [1,1,0,0,0,0|2,0,0]=4 869 B13R2.3683 [13CH3]N1CCc2nc(ncc2C1)O 269982a_200025716142_200025704644 [1,1,0,0,0,0|2,0,0]=4 870 B13R2.1613 C=Cc1ncnc2c1CCCC2 271570a_100011290941_100011467579 [1,1,0,0,0,0|1,0,1]=4 871 B13R2.1613 CNc1ncnc2c1CCCC2 27a_100102657272_100011467579 [1,1,0,0,0,0|1,0,0]=3 872 B13R2.1613 CSc1ncnc2c1CCCC2 62a_100011467579_200000210301 [1,1,0,0,0,0|1,0,0]=3 873 B13R2.1613 CSc1ncnc2c1CCCC2 62a_200000210301_100011467579 [1,1,0,0,0,0|1,0,0]=3 874 B13R2.1613 [13CH3]Sc1ncnc2c1CCCC2 62a_100011467579_200025704644 [1,1,0,0,0,0|1,0,0]=3 875 B13R2.1613 [13CH3]Sc1ncnc2c1CCCC2 62a_200025704644_100011467579 [1,1,0,0,0,0|1,0,0]=3 876 B13R2.623 C=Cc1nc(nc2c1CCC2)C 271570a_100011290941_100011240833 [0,1,0,0,1,0|1,0,1]=4 877 B13R2.623 CNc1nc(nc2c1CCC2)C 27a_100102657272_100011240833 [0,1,0,0,1,0|1,0,0]=3 878 B13R2.623 CSc1nc(nc2c1CCC2)C 62a_100011240833_200000210301 [0,1,0,0,1,0|1,0,0]=3 879 B13R2.623 CSc1nc(nc2c1CCC2)C 62a_200000210301_100011240833 [0,1,0,0,1,0|1,0,0]=3 880 B13R2.623 Cc1nc2c(c(n1)S[13CH3])CCC2 62a_100011240833_200025704644 [0,1,0,0,1,0|1,0,0]=3 881 B13R2.623 Cc1nc2c(c(n1)S[13CH3])CCC2 62a_200025704644_100011240833 [0,1,0,0,1,0|1,0,0]=3 882 B13R2.654 C=Cc1nc(c2c(n1)CCC2)N 271570a_100011290941_100000107085 [0,1,0,0,1,0|2,0,0]=4 883 B13R2.654 CNc1nc(c2c(n1)CCC2)N 27a_100102657272_100000107085 [0,1,0,0,1,0|1,0,0]=3 884 B13R2.654 CSc1nc(c2c(n1)CCC2)N 62a_100000107085_200000210301 [0,1,0,0,1,0|2,0,0]=4 885 B13R2.654 CSc1nc(c2c(n1)CCC2)N 62a_200000210301_100000107085 [0,1,0,0,1,0|2,0,0]=4 886 B13R2.654 [13CH3]Sc1nc(c2c(n1)CCC2)N 62a_100000107085_200025704644 [0,1,0,0,1,0|2,0,0]=4 887 B13R2.654 [13CH3]Sc1nc(c2c(n1)CCC2)N 62a_200025704644_100000107085 [0,1,0,0,1,0|2,0,0]=4 888 B15R2.886 CNCc1nc(c2c(n1)CCCC2)C 2230a_102495366504_200000210301 [0,2,0,0,0,0|1,0,0]=3 889 B15R2.886 Cc1nc(nc2c1CCCC2)CN[13CH3] 2230a_102495366504_200025704644 [0,2,0,0,0,0|1,0,0]=3 890 B15R2.1851 CNc1nc(nc2c1CCCC2)SC 27a_100102657272_100010000299 [0,2,0,0,0,0|2,0,0]=4 891 B15R2.1851 CSc1nc2c(c(n1)SC)CCCC2 62a_100010000299_200000210301 [0,2,0,0,0,0|2,0,0]=4 892 B15R2.1851 CSc1nc2c(c(n1)SC)CCCC2 62a_200000210301_100010000299 [0,2,0,0,0,0|2,0,0]=4 893 B15R2.1851 CSc1nc2c(c(n1)S[13CH3])CCCC2 62a_100010000299_200025704644 [0,2,0,0,0,0|2,0,0]=4 894 B15R2.1851 CSc1nc2c(c(n1)S[13CH3])CCCC2 62a_200025704644_100010000299 [0,2,0,0,0,0|2,0,0]=4 895 B15R2.14951 CN(C)c1nc(c2c(n1)CCCC2)O 271570a_203496583355_200011467578 [0,2,0,0,0,0|2,0,0]=4 896 B15R2.988 C=C(C)c1nc(nc2c1CCCC2)C 271570a_100000694244_100011467566 [0,2,0,0,0,0|2,0,0]=4 897 B15R2.988 Cc1nc2c(c(n1)N(C)C)CCCC2 27a_100102631434_100011467566 [0,2,0,0,0,0|2,0,0]=4 898 B15R2.4392 CC=Cc1nc(nc2c1CCCC2)C 271570a_100016259895_100011467566 [0,2,0,0,0,0|2,0,0]=4 899 B15R2.4392 CCNc1nc(nc2c1CCCC2)C 27a_100015525214_100011467566 [0,2,0,0,0,0|2,0,0]=4 900 B15R2.4392 CCSc1nc(nc2c1CCCC2)C 62a_100000210202_100011467566 [0,2,0,0,0,0|2,0,0]=4 901 B15R2.4392 CCSc1nc(nc2c1CCCC2)C 62a_100011467566_100000210202 [0,2,0,0,0,0|2,0,0]=4 902 B15R2.4392 Cc1nc2c(c(n1)SCF)CCCC2 62a_100011467566_100015361967 [0,2,0,0,0,0|2,0,0]=4 903 B15R2.4392 Cc1nc2c(c(n1)SCF)CCCC2 62a_100015361967_100011467566 [0,2,0,0,0,0|2,0,0]=4 904 B13R2.11035 Cc1nc(nc(c1C)C2CC2)N 271570a_100011220607_100000076065 [0,0,1,1,0,0|1,0,0]=3 905 B13R2.43 CCN1Cc2cnc(nc2C1)C 269982a_100020633798_100000204670 [0,0,1,1,0,0|2,0,0]=4 906 B13R2.5400 Cc1nc(ncc1SC2CC2)N 62a_100000725598_100000211595 [0,0,1,1,0,0|2,0,0]=4 907 B13R2.140 Cc1cc(nc(n1)N)N2CCC2 27a_100000754969_100000183061 [0,0,1,1,0,0|2,0,0]=4 908 B13R2.141 Cc1cc(nc(n1)N)NC2CC2 27a_100000212008_100000183061 [0,0,1,1,0,0|2,0,0]=4 909 B13R2.141 Cc1cc(nc(n1)N)SC2CC2 62a_100000183061_100000211595 [0,0,1,1,0,0|2,0,0]=4 910 B13R2.11034 Cc1cc(nc(c1C2CC2)C)N 271570a_100011220607_100000699364 [0,0,1,1,0,0|2,0,0]=4 911 B13R2.11034 Cc1nc(nc(c1C2CC2)C)N 271570a_100011220607_100009814254 [0,0,1,1,0,0|1,0,0]=3 912 B13R2.11034 Cc1nc(nc(c1C2CC2)O)N 271570a_100011220607_200000008613 [0,0,1,1,0,0|2,0,0]=4 913 B11R1.230 CCCCc1cc(nn1C)N 271570a_100020621405_100116209741 [0,0,1,0,1,0|2,0,0]=4 914 B11R1.230 CCCCc1nc(sc1C)N 271570a_100020621405_100009817509 [0,0,1,0,1,0|2,0,0]=4 915 B11R1.230 CCSCc1cc(nn1C)C 62a_100000210202_100025716357 [0,0,1,0,1,0|2,0,0]=4 916 B11R1.230 CCSCc1cc(nn1C)C 62a_100025716357_100000210202 [0,0,1,0,1,0|2,0,0]=4 917 B11R1.230 CCSCc1cn(nc1C)C 62a_100000210202_100015186178 [0,0,1,0,1,0|2,0,0]=4 918 B11R1.230 CCSCc1cn(nc1C)C 62a_100015186178_100000210202 [0,0,1,0,1,0|2,0,0]=4 919 B11R1.230 CCSCc1sc(nc1C)C 62a_100000210202_100000760948 [0,0,1,0,1,0|2,0,0]=4 920 B11R1.230 CCSCc1sc(nc1C)C 62a_100000760948_100000210202 [0,0,1,0,1,0|2,0,0]=4 921 B11R1.231 CCCCc1cn(c(n1)N)C 271570a_100020621405_100025756272 [0,0,1,0,1,0|2,0,0]=4 922 B11R1.231 CSCSc1cn(c(n1)N)C 62a_100011218213_100025756272 [0,0,1,0,1,0|2,0,0]=4 923 B11R1.231 CSCSc1cn(c(n1)N)C 62a_100025756272_100011218213 [0,0,1,0,1,0|2,0,0]=4 924 B11R2.36 Oc1ccc2c(n1)CCC2 271570a_203496583355_100000046531 [1,0,0,0,1,0|2,0,0]=4 925 B11R2.36 Oc1ncc2c(n1)CCC2 271570a_203496583355_100009881048 [1,0,0,0,1,0|1,0,0]=3 926 B11R2.106 Oc1ccnc2c1CCC2 271570a_203496583355_100000102697 [1,0,0,0,1,0|2,0,0]=4 927 B11R2.106 Oc1ncnc2c1CCC2 271570a_203496583355_100000750143 [1,0,0,0,1,0|1,0,0]=3 928 B11R2.106 Oc1ncnc2c1CCN2 271570a_203496583355_200000104052 [1,0,0,0,1,0|2,0,0]=4