0 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)N3Cc4ccc(cc4C3)Br 27a_100000702344_100010062264 [0,0,0,0,0,0|3,0,1]=4 1 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)N3Cc4ccc(cc4C3)Cl 27a_100015205306_100010062264 [0,0,0,0,0,0|3,0,1]=4 2 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)N3Cc4ccc(cc4C3)F 27a_100000766377_100010062264 [0,0,0,0,0,0|3,0,1]=4 3 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)N3Cc4ccc(cc4C3)O 27a_100015195982_100010062264 [0,0,0,0,0,0|2,0,1]=3 4 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4[nH]3)Cl 271570a_100010246260_100010062264 [0,0,0,0,0,0|1,0,0]=1 5 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4[nH]3)F 271570a_100010246264_100010062264 [0,0,0,0,0,0|1,0,0]=1 6 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)Br 271570a_100010176198_100010062264 [0,0,0,0,0,0|2,0,0]=2 7 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)Cl 271570a_100012186365_100010062264 [0,0,0,0,0,0|2,0,0]=2 8 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)F 271570a_100012185221_100010062264 [0,0,0,0,0,0|2,0,0]=2 9 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4ccc(cc4[nH]3)Br 271570a_200010246288_100010062264 [0,0,0,0,0,0|3,0,0]=3 10 B26R4.688721486 CC(C)n1nc(c2c1ncnc2N)c3cc4ccc(cc4s3)Br 271570a_100015653926_100010062264 [0,0,0,0,0,0|3,0,0]=3 11 B26R4.688721486 Cc1ccc2cc([nH]c2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100010246276_100010062264 [0,0,0,0,0,0|3,0,0]=3 12 B26R4.688721486 Cc1ccc2oc(cc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_200013722915_100010062264 [0,0,0,0,0,0|2,0,0]=2 13 B26R4.688721486 Cc1ccc2sc(cc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100000057607_100010062264 [0,0,0,0,0,0|2,0,0]=2 14 B25R4.372267365 CC(C)n1nc(c2c1ncnc2N)C3=Cc4ccccc4C3 271570a_100010239756_100010062264 [1,0,0,0,0,0|1,0,0]=2 15 B25R4.372267365 CC(C)n1nc(c2c1ncnc2N)N3Cc4ccccc4C3 27a_100000752595_100010062264 [1,0,0,0,0,0|2,0,1]=4 16 B25R4.372267365 CC(C)n1nc(c2c1ncnc2N)c3cc4ccccc4[nH]3 271570a_100010206980_100010062264 [1,0,0,0,0,0|0,0,0]=1 17 B25R4.372267365 CC(C)n1nc(c2c1ncnc2N)c3cc4ccccc4o3 271570a_100011328764_100010062264 [1,0,0,0,0,0|1,0,0]=2 18 B25R4.372267365 CC(C)n1nc(c2c1ncnc2N)c3cc4ccccc4s3 271570a_100000034353_100010062264 [1,0,0,0,0,0|1,0,0]=2 19 B25R4.372267365 CC(C)n1nc(c2c1ncnc2N)c3nc4ccccc4s3 271570a_200000082171_100010062264 [1,0,0,0,0,0|1,0,1]=3 20 B27R4.613053475 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)C#N 271570a_100009878197_100010062264 [0,1,0,0,0,0|2,0,0]=3 21 B27R4.613053475 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4s3)C#N 271570a_200010193479_100010062264 [0,1,0,0,0,0|2,0,0]=3 22 B27R4.613053475 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4s3)C=O 271570a_200010177800_100010062264 [0,1,0,0,0,0|1,0,1]=3 23 B27R4.613053475 COc1ccc2[nH]c(cc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100010246265_100010062264 [0,1,0,0,0,0|0,0,0]=1 24 B27R4.613053475 COc1ccc2c(c1)CN(C2)c3nn(c4c3c(ncn4)N)C(C)C 27a_100000051402_100010062264 [0,1,0,0,0,0|2,0,1]=4 25 B27R4.613053475 COc1ccc2cc([nH]c2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_200010223215_100010062264 [0,1,0,0,0,0|2,0,0]=3 26 B27R4.613053475 COc1ccc2cc(oc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_200009860666_100010062264 [0,1,0,0,0,0|2,0,0]=3 27 B27R4.613053475 COc1ccc2oc(cc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100000045403_100010062264 [0,1,0,0,0,0|1,0,0]=2 28 B27R4.689408770 CC(C)n1nc(c2c1ncnc2N)c3cc4ccc(cc4n3C)Cl 271570a_100000070589_100010062264 [0,1,0,0,0,0|3,0,0]=4 29 B27R4.1157128197 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4cc(ccc4[nH]3)Cl 271570a_100010246260_100021194821 [0,1,0,0,0,0|2,0,0]=3 30 B27R4.1157128197 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4cc(ccc4[nH]3)F 271570a_100010246264_100021194821 [0,1,0,0,0,0|2,0,0]=3 31 B27R4.1157128197 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4cc(ccc4o3)Br 271570a_100010176198_100021194821 [0,1,0,0,0,0|3,0,0]=4 32 B27R4.1157128197 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4cc(ccc4o3)Cl 271570a_100012186365_100021194821 [0,1,0,0,0,0|3,0,0]=4 33 B27R4.1157128197 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4cc(ccc4o3)F 271570a_100012185221_100021194821 [0,1,0,0,0,0|3,0,0]=4 34 B27R4.1157128197 Cc1ccc2oc(cc2c1)c3nn(c4c3c(ncn4)O)C(C)(C)C 271570a_200013722915_100021194821 [0,1,0,0,0,0|3,0,0]=4 35 B27R4.1157128197 Cc1ccc2sc(cc2c1)c3nn(c4c3c(ncn4)O)C(C)(C)C 271570a_100000057607_100021194821 [0,1,0,0,0,0|3,0,0]=4 36 B27R4.1234719895 CC(C)n1nc(c2c1ncnc2N)c3cc4cc(ccc4n3C)Br 271570a_200010168143_100010062264 [0,1,0,0,0,0|1,0,0]=2 37 B25R3.43383710 CC(C)n1nc(c2c1ncnc2N)N(C)Cc3ccc(cc3)O 27a_100000207500_100010062264 [0,0,1,0,0,0|2,0,1]=4 38 B25R3.129483371 CC(C)n1nc(c2c1ncnc2N)C=Cc3ccc(cc3F)F 271570a_100102527928_100010062264 [0,0,1,0,0,0|3,0,0]=4 39 B25R3.129483371 CC(C)n1nc(c2c1ncnc2N)NCc3ccc(cc3Cl)O 27a_200161156549_100010062264 [0,0,1,0,0,0|3,0,0]=4 40 B25R3.218204849 C/C(=C\c1cc(ccn1)Cl)/c2nn(c3c2c(ncn3)N)C(C)C 271570a_106741698533_100010062264 [0,0,1,0,0,0|3,0,0]=4 41 B25R3.218204849 CC(C)n1nc(c2c1ncnc2N)N(C)Cc3cccc(c3)O 27a_100000207540_100010062264 [0,0,1,0,0,0|2,0,1]=4 42 B25R3.220387634 Cc1ccc(cc1CNc2nn(c3c2c(ncn3)N)C(C)C)O 27a_200009844824_100010062264 [0,0,1,0,0,0|2,0,1]=4 43 B27R4.322126117 CC(C)n1nc(c2c1ncnc2N)N3CCc4ccc(cc4C3)O 27a_100015185785_100010062264 [0,0,0,0,0,1|2,0,1]=4 44 B27R4.322126117 CC(C)n1nc(c2c1ncnc2N)c3ccc4ccc(=O)oc4c3 271570a_100010741648_100010062264 [0,0,0,0,0,1|2,0,1]=4 45 B27R4.322126117 Cc1ccc2ncc(cc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_200010887317_100010062264 [0,0,0,0,0,1|1,0,1]=3 46 B27R4.689150685 CC(C)n1nc(c2c1ncnc2N)N3CCc4cc(ccc4C3)O 27a_100000077532_100010062264 [0,0,0,0,0,1|2,0,1]=4 47 B27R4.689150685 CC(C)n1nc(c2c1ncnc2N)c3ccc4[nH]c(=O)ccc4c3 271570a_100010156512_100010062264 [0,0,0,0,0,1|2,0,1]=4 48 B27R4.689150685 CC(C)n1nc(c2c1ncnc2N)c3ccc4cc(ccc4c3)Br 271570a_100010152634_100010062264 [0,0,0,0,0,1|2,0,0]=3 49 B27R4.689150685 CC(C)n1nc(c2c1ncnc2N)c3ccc4cc(ccc4c3)F 271570a_100009866154_100010062264 [0,0,0,0,0,1|2,0,0]=3 50 B27R4.689150685 CC(C)n1nc(c2c1ncnc2N)c3ccc4cc(ccc4c3)O 271570a_100000041922_100010062264 [0,0,0,0,0,1|1,0,0]=2 51 B27R4.689150685 CC(C)n1nc(c2c1ncnc2N)c3ccc4oc(=O)ccc4c3 271570a_100010996838_100010062264 [0,0,0,0,0,1|2,0,1]=4 52 B27R4.689150685 Cc1ccc2cc(ccc2n1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100012351509_100010062264 [0,0,0,0,0,1|3,0,0]=4 53 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cc(ccc4[nH]3)Br 62a_100010062264_100011012855 [0,0,0,0,0,1|1,0,0]=2 54 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cc(ccc4[nH]3)Br 62a_100011012855_100010062264 [0,0,0,0,0,1|1,0,0]=2 55 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cc(ccc4s3)Br 62a_100010062264_200010198765 [0,0,0,0,0,1|2,0,0]=3 56 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cc(ccc4s3)Br 62a_200010198765_100010062264 [0,0,0,0,0,1|2,0,0]=3 57 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3cn4cc(ccc4n3)F 62a_100010062264_100010231931 [0,0,0,0,0,1|2,0,1]=4 58 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3cn4cc(ccc4n3)F 62a_100010231931_100010062264 [0,0,0,0,0,1|2,0,1]=4 59 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4cc(ccc4s3)F 62a_100010062264_200010206605 [0,0,0,0,0,1|3,0,0]=4 60 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4cc(ccc4s3)F 62a_200010206605_100010062264 [0,0,0,0,0,1|3,0,0]=4 61 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4cc(ccc4s3)N 62a_100010062264_100010329861 [0,0,0,0,0,1|3,0,0]=4 62 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4cc(ccc4s3)N 62a_100010329861_100010062264 [0,0,0,0,0,1|3,0,0]=4 63 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccc(cc4s3)F 62a_100000751617_100010062264 [0,0,0,0,0,1|2,0,1]=4 64 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccc(cc4s3)F 62a_100010062264_100000751617 [0,0,0,0,0,1|2,0,1]=4 65 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccc(cc4s3)N 62a_100010062264_100010253933 [0,0,0,0,0,1|2,0,1]=4 66 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccc(cc4s3)N 62a_100010253933_100010062264 [0,0,0,0,0,1|2,0,1]=4 67 B27R4.738188309 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccc(cc4s3)O 62a_100010062264_100010063415 [0,0,0,0,0,1|1,0,1]=3 68 B27R4.738188309 Cc1ccc2nc(sc2c1)Sc3nn(c4c3c(ncn4)N)C(C)C 62a_100010062264_100010186437 [0,0,0,0,0,1|2,0,1]=4 69 B24R3.37765928 CC(C)n1nc(c2c1ncnc2N)C=Cc3ccc(cc3)Br 271570a_100102527914_100010062264 [1,0,1,0,0,0|2,0,0]=4 70 B24R3.37765928 CC(C)n1nc(c2c1ncnc2N)C=Cc3ccc(cc3)Cl 271570a_100102527930_100010062264 [1,0,1,0,0,0|2,0,0]=4 71 B24R3.37765928 CC(C)n1nc(c2c1ncnc2N)C=Cc3ccc(cc3)F 271570a_100102525539_100010062264 [1,0,1,0,0,0|2,0,0]=4 72 B24R3.37765928 CC(C)n1nc(c2c1ncnc2N)NCc3ccc(cc3)O 27a_100000185549_100010062264 [1,0,1,0,0,0|2,0,0]=4 73 B24R3.37765928 Cc1ccc(cc1)C=Cc2nn(c3c2c(ncn3)N)C(C)C 271570a_100102527916_100010062264 [1,0,1,0,0,0|2,0,0]=4 74 B24R3.25542050 CC(C)n1nc(c2c1ncnc2N)C=Cc3ccccc3F 271570a_200102527919_100010062264 [1,0,1,0,0,0|1,0,0]=3 75 B24R3.232784891 CC(C)n1nc(c2c1ncnc2N)C=Cc3cccc(c3)Cl 271570a_100102525933_100010062264 [1,0,1,0,0,0|1,0,0]=3 76 B24R3.232784891 CC(C)n1nc(c2c1ncnc2N)C=Cc3cccc(c3)F 271570a_100102525537_100010062264 [1,0,1,0,0,0|1,0,0]=3 77 B24R3.232784891 CC(C)n1nc(c2c1ncnc2N)NCc3cccc(c3)O 27a_100000743036_100010062264 [1,0,1,0,0,0|1,0,1]=4 78 B24R3.232784891 CC(C)n1nc(c2c1ncnc2N)SCc3cccc(c3)O 62a_100010062264_100011660834 [1,0,1,0,0,0|1,0,1]=4 79 B24R3.232784891 CC(C)n1nc(c2c1ncnc2N)SCc3cccc(c3)O 62a_100011660834_100010062264 [1,0,1,0,0,0|1,0,1]=4 80 B24R3.232784891 Cc1cccc(c1)C=Cc2nn(c3c2c(ncn3)N)C(C)C 271570a_200135466880_100010062264 [1,0,1,0,0,0|1,0,0]=3 81 B24R4.3565672643 Cc1ccc2oc(cc2c1)c3nn(c4c3c(ncn4)N)C 271570a_200013722915_100010724691 [2,0,0,0,0,0|2,0,0]=4 82 B24R4.3565672643 Cc1ccc2sc(cc2c1)c3nn(c4c3c(ncn4)N)C 271570a_100000057607_100010724691 [2,0,0,0,0,0|2,0,0]=4 83 B24R4.3565672643 Cn1cc(c2c1ncnc2N)c3cc4cc(ccc4[nH]3)Cl 271570a_100010246260_100010393490 [2,0,0,0,0,0|2,0,0]=4 84 B24R4.3565672643 Cn1cc(c2c1ncnc2N)c3cc4cc(ccc4[nH]3)F 271570a_100010246264_100010393490 [2,0,0,0,0,0|2,0,0]=4 85 B24R4.3565672643 Cn1nc(c2c1ncnc2N)c3cc4cc(ccc4[nH]3)Cl 271570a_100010246260_100010724691 [2,0,0,0,0,0|1,0,0]=3 86 B24R4.3565672643 Cn1nc(c2c1ncnc2N)c3cc4cc(ccc4[nH]3)F 271570a_100010246264_100010724691 [2,0,0,0,0,0|1,0,0]=3 87 B24R4.3565672643 Cn1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)Br 271570a_100010176198_100010724691 [2,0,0,0,0,0|2,0,0]=4 88 B24R4.3565672643 Cn1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)Cl 271570a_100012186365_100010724691 [2,0,0,0,0,0|2,0,0]=4 89 B24R4.3565672643 Cn1nc(c2c1ncnc2N)c3cc4cc(ccc4o3)F 271570a_100012185221_100010724691 [2,0,0,0,0,0|2,0,0]=4 90 B26R4.133707425 CC(C)(C)n1nc(c2c1ncnc2O)C3=Cc4ccccc4C3 271570a_100010239756_100021194821 [1,1,0,0,0,0|2,0,0]=4 91 B26R4.133707425 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4ccccc4[nH]3 271570a_100010206980_100021194821 [1,1,0,0,0,0|1,0,0]=3 92 B26R4.133707425 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4ccccc4o3 271570a_100011328764_100021194821 [1,1,0,0,0,0|2,0,0]=4 93 B26R4.133707425 CC(C)(C)n1nc(c2c1ncnc2O)c3cc4ccccc4s3 271570a_100000034353_100021194821 [1,1,0,0,0,0|2,0,0]=4 94 B26R4.438002933 CC(C)n1nc(c2c1ncnc2N)c3cc4c(cccc4[nH]3)Cl 271570a_100010246266_100010062264 [1,1,0,0,0,0|0,0,0]=2 95 B26R4.438002933 CC(C)n1nc(c2c1ncnc2N)c3cc4c(cccc4[nH]3)F 271570a_100010071326_100010062264 [1,1,0,0,0,0|0,0,0]=2 96 B26R4.438002933 CC(C)n1nc(c2c1ncnc2N)c3cc4c(cccc4o3)F 271570a_200011102740_100010062264 [1,1,0,0,0,0|1,0,0]=3 97 B26R4.438002933 CC(C)n1nc(c2c1ncnc2N)c3cc4cccc(c4[nH]3)Br 271570a_200010246277_100010062264 [1,1,0,0,0,0|0,0,0]=2 98 B26R4.438002933 CC(C)n1nc(c2c1ncnc2N)c3cc4cccc(c4[nH]3)Cl 271570a_100015811879_100010062264 [1,1,0,0,0,0|0,0,0]=2 99 B26R4.438002933 CC(C)n1nc(c2c1ncnc2N)c3cc4cccc(c4[nH]3)F 271570a_100010082618_100010062264 [1,1,0,0,0,0|0,0,0]=2 100 B26R4.438002933 Cc1cccc2c1[nH]c(c2)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100010246273_100010062264 [1,1,0,0,0,0|0,0,0]=2 101 B26R4.438404864 CC(C)n1nc(c2c1ncnc2N)c3cc4ccccc4n3C 271570a_100010171889_100010062264 [1,1,0,0,0,0|0,0,0]=2 102 B26R4.438404864 Cc1c(oc2c1cccc2)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100009874717_100010062264 [1,1,0,0,0,0|1,0,0]=3 103 B28R4.380694289 COc1ccc2ccc(cc2n1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100010382904_100010062264 [0,1,0,0,0,1|2,0,0]=4 104 B28R4.1372237253 CC(C)n1nc(c2c1ncnc2N)c3ccc4cc(ccc4c3)C#N 271570a_100010144206_100010062264 [0,1,0,0,0,1|2,0,0]=4 105 B28R4.1372237253 COc1ccc2cc(ccc2c1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100011216302_100010062264 [0,1,0,0,0,1|1,0,0]=3 106 B28R4.1372237253 COc1ccc2cc(ccc2n1)c3nn(c4c3c(ncn4)N)C(C)C 271570a_100010144527_100010062264 [0,1,0,0,0,1|2,0,0]=4 107 B28R4.2047735409 CC(C)(C)n1nc(c2c1ncnc2O)c3ccc4cc(ccc4c3)O 271570a_100000041922_100021194821 [0,1,0,0,0,1|2,0,0]=4 108 B28R4.1230074921 COc1ccc2nc(sc2c1)Sc3nn(c4c3c(ncn4)N)C(C)C 62a_100010062264_100010195960 [0,1,0,0,0,1|1,0,1]=4 109 B28R4.1578215883 CC(C)(C)n1nc(c2c1ncnc2O)Sc3cc4cc(ccc4[nH]3)Br 62a_100011012855_100021194821 [0,1,0,0,0,1|2,0,0]=4 110 B28R4.1816203642 COc1ccc2c(c1)cc(n2C)c3nn(c4c3c(ncn4)N)C(C)C 271570a_200010082612_100010062264 [0,2,0,0,0,0|0,0,0]=2 111 B28R4.1954617771 COc1ccc2[nH]c(cc2c1)c3nn(c4c3c(ncn4)O)C(C)(C)C 271570a_100010246265_100021194821 [0,2,0,0,0,0|1,0,0]=3 112 B28R4.1954617771 COc1ccc2oc(cc2c1)c3nn(c4c3c(ncn4)O)C(C)(C)C 271570a_100000045403_100021194821 [0,2,0,0,0,0|2,0,0]=4 113 B28R4.1209849433 COc1cc(cc2c1sc(c2)c3nn(c4c3c(ncn4)N)C(C)C)C 271570a_100010892064_100010062264 [0,2,0,0,0,0|2,0,0]=4 114 B28R4.1644096116 Cn1c(cc2c1ccc(c2)Br)c3nn(c4c3c(ncn4)O)C(C)(C)C 271570a_200010168143_100021194821 [0,2,0,0,0,0|2,0,0]=4 115 B24R3.37487753 C=C(c1ccc(cc1)C)c2nn(c3c2c(ncn3)N)C(C)C 271570a_100010895218_100010062264 [0,0,1,0,1,0|1,0,0]=3 116 B24R3.37487753 C=C(c1ccc(cc1)Cl)c2nn(c3c2c(ncn3)N)C(C)C 271570a_100010171417_100010062264 [0,0,1,0,1,0|1,0,0]=3 117 B24R3.37487753 C=C(c1ccc(cc1)F)c2nn(c3c2c(ncn3)N)C(C)C 271570a_100000068270_100010062264 [0,0,1,0,1,0|1,0,0]=3 118 B24R3.37487753 CC(C)n1nc(c2c1ncnc2N)N(C)c3ccc(cc3)O 27a_100000182112_100010062264 [0,0,1,0,1,0|1,0,1]=4 119 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3Cl)O 27a_100011215599_100010062264 [0,0,1,0,1,0|1,0,0]=3 120 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3F)Br 27a_100000210722_100010062264 [0,0,1,0,1,0|2,0,0]=4 121 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3F)I 27a_100011215594_100010062264 [0,0,1,0,1,0|2,0,0]=4 122 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3F)O 27a_100000759473_100010062264 [0,0,1,0,1,0|1,0,0]=3 123 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3I)O 27a_100010084370_100010062264 [0,0,1,0,1,0|1,0,0]=3 124 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3O)Br 27a_100000739049_100010062264 [0,0,1,0,1,0|2,0,0]=4 125 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3O)Cl 27a_100000185728_100010062264 [0,0,1,0,1,0|2,0,0]=4 126 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3O)F 27a_100000753323_100010062264 [0,0,1,0,1,0|2,0,0]=4 127 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3O)I 27a_100000057187_100010062264 [0,0,1,0,1,0|2,0,0]=4 128 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Nc3ccc(cc3O)O 27a_100000106777_100010062264 [0,0,1,0,1,0|1,0,0]=3 129 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3Br)O 62a_100000701344_100010062264 [0,0,1,0,1,0|2,0,0]=4 130 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3Br)O 62a_100010062264_100000701344 [0,0,1,0,1,0|2,0,0]=4 131 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3Cl)O 62a_100000047559_100010062264 [0,0,1,0,1,0|2,0,0]=4 132 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3Cl)O 62a_100010062264_100000047559 [0,0,1,0,1,0|2,0,0]=4 133 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3F)O 62a_100000755031_100010062264 [0,0,1,0,1,0|2,0,0]=4 134 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3F)O 62a_100010062264_100000755031 [0,0,1,0,1,0|2,0,0]=4 135 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3N)O 62a_100010062264_100011999798 [0,0,1,0,1,0|2,0,0]=4 136 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3N)O 62a_100011999798_100010062264 [0,0,1,0,1,0|2,0,0]=4 137 B24R3.234594624 CC(C)n1nc(c2c1ncnc2N)Sc3ccc(cc3O)O 62a_100010062264_100009813921 [0,0,1,0,1,0|2,0,0]=4 138 B24R3.234594624 Cc1cc(ccc1Nc2nn(c3c2c(ncn3)N)C(C)C)Br 27a_100000211769_100010062264 [0,0,1,0,1,0|1,0,1]=4 139 B24R3.234594624 Cc1cc(ccc1Nc2nn(c3c2c(ncn3)N)C(C)C)Cl 27a_100000210418_100010062264 [0,0,1,0,1,0|1,0,1]=4 140 B24R3.234594624 Cc1cc(ccc1Nc2nn(c3c2c(ncn3)N)C(C)C)F 27a_100000211637_100010062264 [0,0,1,0,1,0|1,0,1]=4 141 B24R3.234594624 Cc1cc(ccc1Nc2nn(c3c2c(ncn3)N)C(C)C)I 27a_100000184554_100010062264 [0,0,1,0,1,0|1,0,1]=4 142 B24R3.234594624 Cc1cc(ccc1Nc2nn(c3c2c(ncn3)N)C(C)C)O 27a_100000756630_100010062264 [0,0,1,0,1,0|0,0,1]=3 143 B24R3.234594624 Cc1cc(ccc1Sc2nn(c3c2c(ncn3)N)C(C)C)O 62a_100010062264_100000690111 [0,0,1,0,1,0|1,0,1]=4 144 B24R3.234594624 Cc1ccc(c(c1)C)Nc2nn(c3c2c(ncn3)N)C(C)C 27a_100000736561_100010062264 [0,0,1,0,1,0|1,0,1]=4 145 B24R3.234594624 Cc1ccc(c(c1)F)Nc2nn(c3c2c(ncn3)N)C(C)C 27a_100000211023_100010062264 [0,0,1,0,1,0|2,0,0]=4 146 B24R3.234594624 Cc1ccc(c(c1)O)Nc2nn(c3c2c(ncn3)N)C(C)C 27a_100000211527_100010062264 [0,0,1,0,1,0|2,0,0]=4 147 B24R3.232494046 CC(C)n1nc(c2c1ncnc2N)N(C)c3cccc(c3)O 27a_100000756613_100010062264 [0,0,1,0,1,0|2,0,0]=4 148 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Nc3cc(ccc3F)O 27a_100012017239_100010062264 [0,0,1,0,1,0|2,0,0]=4 149 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3Br)O 62a_100010062264_100012339312 [0,0,1,0,1,0|2,0,0]=4 150 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3Br)O 62a_100012339312_100010062264 [0,0,1,0,1,0|2,0,0]=4 151 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3Cl)O 62a_100000049588_100010062264 [0,0,1,0,1,0|2,0,0]=4 152 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3Cl)O 62a_100010062264_100000049588 [0,0,1,0,1,0|2,0,0]=4 153 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3F)O 62a_100000693481_100010062264 [0,0,1,0,1,0|2,0,0]=4 154 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3F)O 62a_100010062264_100000693481 [0,0,1,0,1,0|2,0,0]=4 155 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)Br 62a_100000187925_100010062264 [0,0,1,0,1,0|2,0,0]=4 156 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)Br 62a_100010062264_100000187925 [0,0,1,0,1,0|2,0,0]=4 157 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)Cl 62a_100000761889_100010062264 [0,0,1,0,1,0|2,0,0]=4 158 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)Cl 62a_100010062264_100000761889 [0,0,1,0,1,0|2,0,0]=4 159 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)F 62a_100000760547_100010062264 [0,0,1,0,1,0|2,0,0]=4 160 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)F 62a_100010062264_100000760547 [0,0,1,0,1,0|2,0,0]=4 161 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)N 62a_100010062264_100011534242 [0,0,1,0,1,0|2,0,0]=4 162 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)N 62a_100011534242_100010062264 [0,0,1,0,1,0|2,0,0]=4 163 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)O 62a_100010062264_100012001276 [0,0,1,0,1,0|1,0,0]=3 164 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3N)O 62a_100012001276_100010062264 [0,0,1,0,1,0|1,0,0]=3 165 B24R3.12035996 CC(C)n1nc(c2c1ncnc2N)Sc3cc(ccc3O)O 62a_100010062264_100009813629 [0,0,1,0,1,0|2,0,0]=4 166 B24R3.12035996 Cc1ccc(c(c1)Sc2nn(c3c2c(ncn3)N)C(C)C)N 62a_100010062264_100011356834 [0,0,1,0,1,0|2,0,0]=4 167 B24R3.12035996 Cc1ccc(c(c1)Sc2nn(c3c2c(ncn3)N)C(C)C)N 62a_100011356834_100010062264 [0,0,1,0,1,0|2,0,0]=4 168 B24R3.12035996 Cc1ccc(cc1Nc2nn(c3c2c(ncn3)N)C(C)C)O 27a_100011216113_100010062264 [0,0,1,0,1,0|2,0,0]=4 169 B24R3.12035996 Cc1ccc(cc1Sc2nn(c3c2c(ncn3)N)C(C)C)O 62a_100010062264_100011380479 [0,0,1,0,1,0|2,0,0]=4 170 B24R3.12035996 Cc1ccc(cc1Sc2nn(c3c2c(ncn3)N)C(C)C)O 62a_100011380479_100010062264 [0,0,1,0,1,0|2,0,0]=4 171 B24R4.33222613 CC(C)n1nc(c2c1ncnc2N)c3cc4sccc4s3 271570a_100010775590_100010062264 [1,0,0,0,1,0|2,0,0]=4 172 B26R3.33426733 CC(C)n1nc(c2c1ncnc2N)c3ccc(cc3)/C=C/C(=O)O 271570a_100010234720_100010062264 [0,0,1,0,0,1|2,0,0]=4 173 B26R3.33426740 CC(C)n1nc(c2c1ncnc2N)c3cccc(c3)/C=C/C(=O)O 271570a_100016283059_100010062264 [0,0,1,0,0,1|2,0,0]=4 174 B26R4.24233412 CC(C)n1nc(c2c1ncnc2N)c3ccc4ccccc4c3 271570a_100011218693_100010062264 [1,0,0,0,0,1|1,0,0]=3 175 B26R4.24233412 CC(C)n1nc(c2c1ncnc2N)c3ccc4cccnc4c3 271570a_100012353946_100010062264 [1,0,0,0,0,1|2,0,0]=4 176 B26R4.24233412 CC(C)n1nc(c2c1ncnc2N)c3ccc4ccncc4c3 271570a_100000068421_100010062264 [1,0,0,0,0,1|2,0,0]=4 177 B26R4.24233412 CC(C)n1nc(c2c1ncnc2N)c3ccc4cnccc4c3 271570a_100000070448_100010062264 [1,0,0,0,0,1|2,0,0]=4 178 B26R4.24233412 CC(C)n1nc(c2c1ncnc2N)c3ccc4ncccc4c3 271570a_100012351079_100010062264 [1,0,0,0,0,1|2,0,0]=4 179 B26R4.24233412 CC(C)n1nc(c2c1ncnc2N)c3cnc4ccccc4c3 271570a_100012350238_100010062264 [1,0,0,0,0,1|0,0,1]=3 180 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3cc4ccccc4[nH]3 62a_100010062264_100010232065 [1,0,0,0,0,1|0,0,0]=2 181 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3cc4ccccc4o3 62a_100010062264_100010159458 [1,0,0,0,0,1|1,0,0]=3 182 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3cc4ccccc4s3 62a_100010062264_100009816949 [1,0,0,0,0,1|1,0,0]=3 183 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cccnc4[nH]3 62a_100010062264_100010079843 [1,0,0,0,0,1|1,0,0]=3 184 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3cn4ccccc4n3 62a_100010062264_100009819586 [1,0,0,0,0,1|1,0,1]=4 185 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccccc4[nH]3 62a_100010062264_100009814255 [1,0,0,0,0,1|1,0,0]=3 186 B26R4.24233418 CC(C)n1nc(c2c1ncnc2N)Sc3nc4ccccc4s3 62a_100010062264_100000751744 [1,0,0,0,0,1|1,0,1]=4 187 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Nc3ccc4ccc(cc4c3)Br 27a_100010090036_100010062264 [0,0,0,0,0,2|2,0,0]=4 188 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Nc3ccc4ccc(cc4c3)O 27a_100015378740_100010062264 [0,0,0,0,0,2|1,0,0]=3 189 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cc(ccc4cn3)F 62a_100009828686_100010062264 [0,0,0,0,0,2|1,0,1]=4 190 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cc4cc(ccc4cn3)F 62a_100010062264_100009828686 [0,0,0,0,0,2|1,0,1]=4 191 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4ccc(cc4c3)N 62a_100010062264_100010090036 [0,0,0,0,0,2|2,0,0]=4 192 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4ccc(cc4c3)N 62a_100010090036_100010062264 [0,0,0,0,0,2|2,0,0]=4 193 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4ccc(cc4c3)O 62a_100010062264_100009816537 [0,0,0,0,0,2|1,0,0]=3 194 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4ccc(cc4n3)O 62a_100010062264_100000079174 [0,0,0,0,0,2|2,0,0]=4 195 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4ccc(nc4c3)O 62a_100010062264_100000690401 [0,0,0,0,0,2|2,0,0]=4 196 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cnc(cc4c3)O 62a_100010062264_100009817130 [0,0,0,0,0,2|2,0,0]=4 197 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4ncc(cc4c3)O 62a_100010062264_100000703654 [0,0,0,0,0,2|2,0,0]=4 198 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)Br 62a_100010062264_100010740133 [0,0,0,0,0,2|1,0,1]=4 199 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)Br 62a_100010740133_100010062264 [0,0,0,0,0,2|1,0,1]=4 200 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)Cl 62a_100010062264_100015929906 [0,0,0,0,0,2|1,0,1]=4 201 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)Cl 62a_100015929906_100010062264 [0,0,0,0,0,2|1,0,1]=4 202 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)N 62a_100009888932_100010062264 [0,0,0,0,0,2|1,0,1]=4 203 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)N 62a_100010062264_100009888932 [0,0,0,0,0,2|1,0,1]=4 204 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4c3)O 62a_100010062264_100010137430 [0,0,0,0,0,2|0,0,1]=3 205 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(cc4n3)O 62a_100010062264_200020640061 [0,0,0,0,0,2|1,0,1]=4 206 B28R4.465274767 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4ccc(nc4c3)O 62a_100010062264_100010009477 [0,0,0,0,0,2|1,0,1]=4 207 B28R4.465274767 Cc1ccc2ncc(cc2c1)Sc3nn(c4c3c(ncn4)N)C(C)C 62a_100010062264_100015841224 [0,0,0,0,0,2|1,0,1]=4 208 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Nc3ccc4cc(ccc4c3)Br 27a_100000185457_100010062264 [0,0,0,0,0,2|2,0,0]=4 209 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Nc3ccc4nc(ccc4c3)O 27a_100000751528_100010062264 [0,0,0,0,0,2|2,0,0]=4 210 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)Br 62a_100010062264_100012344972 [0,0,0,0,0,2|2,0,0]=4 211 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)Br 62a_100012344972_100010062264 [0,0,0,0,0,2|2,0,0]=4 212 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)F 62a_100009817052_100010062264 [0,0,0,0,0,2|2,0,0]=4 213 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)F 62a_100010062264_100009817052 [0,0,0,0,0,2|2,0,0]=4 214 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)N 62a_100000185457_100010062264 [0,0,0,0,0,2|2,0,0]=4 215 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)N 62a_100010062264_100000185457 [0,0,0,0,0,2|2,0,0]=4 216 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4c3)O 62a_100010062264_100000185455 [0,0,0,0,0,2|1,0,0]=3 217 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4n3)F 62a_100010062264_100011998705 [0,0,0,0,0,2|1,0,1]=4 218 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4n3)F 62a_200012355665_100010062264 [0,0,0,0,0,2|1,0,1]=4 219 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3ccc4cc(ccc4n3)O 62a_100010062264_100009849208 [0,0,0,0,0,2|0,0,1]=3 220 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4c3)Cl 62a_100010062264_100015716233 [0,0,0,0,0,2|2,0,0]=4 221 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4c3)Cl 62a_100015716233_100010062264 [0,0,0,0,0,2|2,0,0]=4 222 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4c3)N 62a_100010062264_200010264087 [0,0,0,0,0,2|2,0,0]=4 223 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4c3)N 62a_200010264087_100010062264 [0,0,0,0,0,2|2,0,0]=4 224 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4c3)O 62a_100010062264_200010153753 [0,0,0,0,0,2|1,0,0]=3 225 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4n3)F 62a_100000098432_100010062264 [0,0,0,0,0,2|1,0,1]=4 226 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4n3)F 62a_100010062264_100000098432 [0,0,0,0,0,2|1,0,1]=4 227 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4n3)N 62a_100010062264_100009885871 [0,0,0,0,0,2|1,0,1]=4 228 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4cc(ccc4n3)O 62a_100010062264_200010664160 [0,0,0,0,0,2|0,0,1]=3 229 B28R4.871900998 CC(C)n1nc(c2c1ncnc2N)Sc3cnc4nc(ccc4c3)O 62a_100010062264_100009814606 [0,0,0,0,0,2|2,0,0]=4 230 B28R4.871900998 Cc1ccc2nc(ccc2c1)Sc3nn(c4c3c(ncn4)N)C(C)C 62a_100010062264_100011865911 [0,0,0,0,0,2|1,0,1]=4 231 B28R4.871900998 Cc1ccc2nc(ccc2c1)Sc3nn(c4c3c(ncn4)N)C(C)C 62a_200000181977_100010062264 [0,0,0,0,0,2|1,0,1]=4 232 B28R4.1490381834 CC(C)n1nc(c2c1ncnc2N)NCc3cc4cc(ccc4[nH]3)Cl 27a_100000217048_100010062264 [0,0,0,0,0,2|1,0,0]=3 233 B28R4.1490381834 CC(C)n1nc(c2c1ncnc2N)NCc3nc4cc(ccc4[nH]3)Cl 27a_100015184008_100010062264 [0,0,0,0,0,2|2,0,0]=4 234 B28R4.1490381834 CC(C)n1nc(c2c1ncnc2N)SCc3nc4cc(ccc4[nH]3)Br 62a_100000701424_100010062264 [0,0,0,0,0,2|2,0,0]=4 235 B28R4.1490381834 Cc1ccc2[nH]c(nc2c1)CNc3nn(c4c3c(ncn4)N)C(C)C 27a_100000754707_100010062264 [0,0,0,0,0,2|2,0,0]=4