0 B19R3.3972 Cc1cc(ccn1)c2csc3c2ncnc3O 271570a_100011830414_100010075196 [1,0,0,0,0,0|3,0,0]=4 1 B19R3.3972 Cc1cccc(c1)c2cnc3n2ncnc3N 271570a_100000749446_100010391501 [1,0,0,0,0,0|3,0,0]=4 2 B19R3.3972 Cc1cccc(c1)c2csc3c2ncnc3N 271570a_100000749446_100010254332 [1,0,0,0,0,0|3,0,0]=4 3 B19R3.3972 Cc1cccc(c1)c2csc3c2ncnc3O 271570a_100000749446_100010075196 [1,0,0,0,0,0|2,0,0]=3 4 B19R3.3972 Cc1cccc(n1)c2csc3c2ncnc3O 271570a_100000046275_100010075196 [1,0,0,0,0,0|3,0,0]=4 5 B19R3.3972 Cc1ccnc(c1)c2csc3c2ncnc3O 271570a_100000049243_100010075196 [1,0,0,0,0,0|3,0,0]=4 6 B19R3.3972 Cc1cncc(c1)c2csc3c2ncnc3O 271570a_100012355712_100010075196 [1,0,0,0,0,0|3,0,0]=4 7 B19R3.3972 Nc1cccc(c1)c2csc3c2ncnc3O 271570a_100000699968_100010075196 [1,0,0,0,0,0|3,0,0]=4 8 B19R3.3972 Oc1cccc(c1)c2csc3c2ncnc3O 271570a_100000693801_100010075196 [1,0,0,0,0,0|3,0,0]=4 9 B19R3.3972 Oc1ncnc2c1scc2c3cccc(c3)Cl 271570a_100011214927_100010075196 [1,0,0,0,0,0|3,0,0]=4 10 B19R3.3972 Oc1ncnc2c1scc2c3cccc(c3)F 271570a_100012349223_100010075196 [1,0,0,0,0,0|3,0,0]=4 11 B19R3.3972 Oc1ncnc2c1scc2c3cccc(c3)I 271570a_100000043368_100010075196 [1,0,0,0,0,0|3,0,0]=4 12 B19R3.54546 Cc1cccc(c1)c2cnc3n2nc(cc3)N 271570a_100000749446_100010240408 [1,0,0,0,0,0|3,0,0]=4 13 B19R2.37530 Cc1cccc(c1)Nc2nc(nc(c2C#N)C)N 27a_100000188690_100009965792 [0,0,1,0,0,0|3,0,0]=4 14 B19R2.37530 Cc1cccc(c1)Nc2nc(nc(c2C#N)N)N 27a_100000188690_100010978646 [0,0,1,0,0,0|3,0,0]=4 15 B19R2.3069348 CCN(c1cccc(c1)C)c2cc(nc(n2)C)O 27a_100000182157_106741647437 [0,0,1,0,0,0|2,0,1]=4 16 B19R2.3069348 CCN(c1cccc(c1)C)c2cc(nc(n2)N)C 27a_100000182157_100000183061 [0,0,1,0,0,0|2,0,1]=4 17 B19R2.3069348 CCN(c1cccc(c1)C)c2cc(nc(n2)N)O 27a_100000182157_100000694715 [0,0,1,0,0,0|1,0,1]=3 18 B19R2.3069348 CCN(c1cccc(c1)O)c2cc(nc(n2)N)O 27a_100000717746_100000694715 [0,0,1,0,0,0|2,0,1]=4 19 B19R2.5828598 Cc1cccc(c1)N(C)c2nc(nc(c2C)C)N 27a_100000219674_100000076065 [0,0,1,0,0,0|2,0,1]=4 20 B21R3.3829277 Cc1cc(ccn1)c2cnc3c(nc(nc3c2)O)O 271570a_100011830414_100020641529 [0,0,0,0,0,1|3,0,0]=4 21 B21R3.3829277 Cc1cccc(c1)c2ccc3c(nc(nc3c2)N)N 271570a_100000749446_100012355061 [0,0,0,0,0,1|3,0,0]=4 22 B21R3.3829277 Cc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100000749446_100020641529 [0,0,0,0,0,1|2,0,0]=3 23 B21R3.3829277 Cc1cccc(n1)c2cnc3c(nc(nc3c2)O)O 271570a_100000046275_100020641529 [0,0,0,0,0,1|3,0,0]=4 24 B21R3.3829277 Cc1ccnc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100000049243_100020641529 [0,0,0,0,0,1|3,0,0]=4 25 B21R3.3829277 Cc1cncc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100012355712_100020641529 [0,0,0,0,0,1|3,0,0]=4 26 B21R3.3829277 Nc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100000699968_100020641529 [0,0,0,0,0,1|3,0,0]=4 27 B21R3.3829277 Oc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100000693801_100020641529 [0,0,0,0,0,1|3,0,0]=4 28 B21R3.3829277 Oc1nc(c2ncc(cc2n1)c3cccc(c3)Cl)O 271570a_100011214927_100020641529 [0,0,0,0,0,1|3,0,0]=4 29 B21R3.3829277 Oc1nc(c2ncc(cc2n1)c3cccc(c3)F)O 271570a_100012349223_100020641529 [0,0,0,0,0,1|3,0,0]=4 30 B21R3.3829277 Oc1nc(c2ncc(cc2n1)c3cccc(c3)I)O 271570a_100000043368_100020641529 [0,0,0,0,0,1|3,0,0]=4 31 B18R2.31074 Cc1cccc(c1)Nc2nc(nc(c2C)C)N 27a_100000188690_100000076065 [1,0,1,0,0,0|1,0,1]=4 32 B18R2.2303 CCN(c1cccc(c1)C)c2cc(ncn2)O 27a_100000182157_100000765262 [1,0,1,0,0,0|1,0,1]=4 33 B18R2.2303 CCN(c1cccc(c1)C)c2ccnc(n2)N 27a_100000182157_100000055538 [1,0,1,0,0,0|1,0,1]=4 34 B18R2.914105 CCN(c1ccccc1)c2cc(nc(n2)N)O 27a_100000210013_100000694715 [1,0,1,0,0,0|1,0,1]=4 35 B18R2.1288316 CN(c1cccc(c1)Br)c2cc(nc(n2)N)O 27a_100000219648_100000694715 [1,0,1,0,0,0|1,0,1]=4 36 B18R2.1288316 CN(c1cccc(c1)Cl)c2cc(nc(n2)N)O 27a_100000220044_100000694715 [1,0,1,0,0,0|1,0,1]=4 37 B18R2.1288316 CN(c1cccc(c1)F)c2cc(nc(n2)N)O 27a_100020633736_100000694715 [1,0,1,0,0,0|1,0,1]=4 38 B18R2.1288316 CN(c1cccc(c1)I)c2cc(nc(n2)N)O 27a_100000221217_100000694715 [1,0,1,0,0,0|1,0,1]=4 39 B18R2.1288316 CN(c1cccc(c1)O)c2cc(nc(n2)N)O 27a_100000756613_100000694715 [1,0,1,0,0,0|1,0,1]=4 40 B18R2.1288316 Cc1cccc(c1)N(C)c2cc(nc(n2)C)O 27a_100000219674_106741647437 [1,0,1,0,0,0|1,0,1]=4 41 B18R2.1288316 Cc1cccc(c1)N(C)c2cc(nc(n2)N)C 27a_100000219674_100000183061 [1,0,1,0,0,0|1,0,1]=4 42 B18R2.1288316 Cc1cccc(c1)N(C)c2cc(nc(n2)N)O 27a_100000219674_100000694715 [1,0,1,0,0,0|0,0,1]=3 43 B18R2.65646 Cc1cccc(c1)N(C)c2nc(ncc2C)N 27a_100000219674_100000016107 [1,0,1,0,0,0|1,0,1]=4 44 B18R2.65646 Cc1cccc(c1)N(C)c2nc(ncc2F)N 27a_100000219674_200000093006 [1,0,1,0,0,0|1,0,1]=4 45 B18R2.65656 Cc1cccc(c1)N(C)c2ncnc(c2C)O 27a_100000219674_100011912821 [1,0,1,0,0,0|1,0,1]=4 46 B18R3.5867 Oc1ncnc2c1ncn2c3ccccc3 271570a_203496583355_100000734175 [2,0,0,0,0,0|0,0,0]=2 47 B18R3.5867 Oc1ncnc2c1scc2c3ccccc3 271570a_100011218836_100010075196 [2,0,0,0,0,0|2,0,0]=4 48 B20R2.31535 CCN(c1cccc(c1)C)c2cc(nc(n2)N)OC 27a_100000182157_100010270236 [0,1,1,0,0,0|1,0,1]=4 49 B20R2.332017 CCN(c1cc(nc(n1)N)O)c2cc(ccc2C)C 27a_100000743043_100000694715 [0,1,1,0,0,0|1,0,1]=4 50 B20R2.4300813 CCN(c1cc(cc(c1)C)C)c2cc(nc(n2)N)O 27a_100000743038_100000694715 [0,1,1,0,0,0|1,0,1]=4 51 B20R2.4393881 CCN(c1cc(nc(n1)N)O)c2cccc(c2C)C 27a_100000219776_100000694715 [0,1,1,0,0,0|1,0,1]=4 52 B20R2.4456473 CCN(c1ccc(c(c1)C)Br)c2cc(nc(n2)N)O 27a_100015183089_100000694715 [0,1,1,0,0,0|1,0,1]=4 53 B20R2.4456473 CCN(c1ccc(c(c1)C)C)c2cc(nc(n2)N)O 27a_106256033975_100000694715 [0,1,1,0,0,0|1,0,1]=4 54 B20R2.5578743 CCN(c1cccc(c1)OC)c2cc(nc(n2)N)O 27a_100000219733_100000694715 [0,1,1,0,0,0|1,0,1]=4 55 B20R3.3283 CCc1cccc(c1)c2csc3c2ncnc3O 271570a_100012343334_100010075196 [1,1,0,0,0,0|2,0,0]=4 56 B20R3.3283 COc1cccc(c1)c2csc3c2ncnc3O 271570a_100000751105_100010075196 [1,1,0,0,0,0|2,0,0]=4 57 B20R3.3283 CSc1cccc(c1)c2csc3c2ncnc3O 271570a_100011218859_100010075196 [1,1,0,0,0,0|2,0,0]=4 58 B20R3.3283 OCc1cccc(c1)c2csc3c2ncnc3O 271570a_100011830409_100010075196 [1,1,0,0,0,0|2,0,0]=4 59 B20R3.5547 Cc1cccc(c1Br)c2csc3c2ncnc3O 271570a_100046285795_100010075196 [1,1,0,0,0,0|2,0,0]=4 60 B20R3.5547 Cc1cccc(c1C)c2csc3c2ncnc3O 271570a_100000760475_100010075196 [1,1,0,0,0,0|2,0,0]=4 61 B20R3.5547 Cc1cccc(c1Cl)c2csc3c2ncnc3O 271570a_100012343306_100010075196 [1,1,0,0,0,0|2,0,0]=4 62 B20R3.5547 Cc1cccc(c1F)c2csc3c2ncnc3O 271570a_100011934588_100010075196 [1,1,0,0,0,0|2,0,0]=4 63 B20R3.5547 Cc1cccc(c1O)c2csc3c2ncnc3O 271570a_100000089634_100010075196 [1,1,0,0,0,0|2,0,0]=4 64 B20R3.6060 Cc1ccc(c(c1)c2csc3c2ncnc3O)C 271570a_100000695611_100010075196 [1,1,0,0,0,0|2,0,0]=4 65 B20R3.6060 Cc1ccc(c(c1)c2csc3c2ncnc3O)Cl 271570a_100011356805_100010075196 [1,1,0,0,0,0|2,0,0]=4 66 B20R3.6060 Cc1ccc(c(c1)c2csc3c2ncnc3O)F 271570a_100011263228_100010075196 [1,1,0,0,0,0|2,0,0]=4 67 B20R3.6060 Cc1ccc(c(c1)c2csc3c2ncnc3O)N 271570a_100000068086_100010075196 [1,1,0,0,0,0|2,0,0]=4 68 B20R3.6060 Cc1ccc(c(c1)c2csc3c2ncnc3O)O 271570a_100009873282_100010075196 [1,1,0,0,0,0|2,0,0]=4 69 B20R3.248022 Cc1cc(ccc1Cl)c2csc3c2ncnc3O 271570a_100000035345_100010075196 [1,1,0,0,0,0|2,0,0]=4 70 B20R3.248022 Cc1cc(ccc1F)c2csc3c2ncnc3O 271570a_100011217506_100010075196 [1,1,0,0,0,0|2,0,0]=4 71 B20R3.248022 Cc1cc(ccc1N)c2csc3c2ncnc3O 271570a_100010200941_100010075196 [1,1,0,0,0,0|2,0,0]=4 72 B20R3.248022 Cc1cc(ccc1O)c2csc3c2ncnc3O 271570a_100010081521_100010075196 [1,1,0,0,0,0|2,0,0]=4 73 B20R3.248022 Cc1ccc(cc1C)c2csc3c2ncnc3O 271570a_100011217131_100010075196 [1,1,0,0,0,0|2,0,0]=4 74 B20R3.250591 Cc1cc(cc(c1)c2csc3c2ncnc3O)Br 271570a_100009814731_100010075196 [1,1,0,0,0,0|2,0,0]=4 75 B20R3.250591 Cc1cc(cc(c1)c2csc3c2ncnc3O)C 271570a_100000693139_100010075196 [1,1,0,0,0,0|2,0,0]=4 76 B20R3.250591 Cc1cc(cc(c1)c2csc3c2ncnc3O)Cl 271570a_100000049244_100010075196 [1,1,0,0,0,0|2,0,0]=4 77 B20R3.250591 Cc1cc(cc(c1)c2csc3c2ncnc3O)F 271570a_100011356783_100010075196 [1,1,0,0,0,0|2,0,0]=4 78 B20R3.250591 Cc1cc(cc(c1)c2csc3c2ncnc3O)O 271570a_100010141081_100010075196 [1,1,0,0,0,0|2,0,0]=4 79 B20R3.250591 Cc1cc(cc(c1)n2ncc3c2ncnc3O)C 271570a_203496583355_100000501232 [1,1,0,0,0,0|2,0,0]=4 80 B22R3.3549019 CCc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100012343334_100020641529 [0,1,0,0,0,1|2,0,0]=4 81 B22R3.3549019 COc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100000751105_100020641529 [0,1,0,0,0,1|2,0,0]=4 82 B22R3.3549019 CSc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100011218859_100020641529 [0,1,0,0,0,1|2,0,0]=4 83 B22R3.3549019 OCc1cccc(c1)c2cnc3c(nc(nc3c2)O)O 271570a_100011830409_100020641529 [0,1,0,0,0,1|2,0,0]=4 84 B22R3.5272768 Cc1cc(cc(c1)c2cnc3c(nc(nc3c2)O)O)Br 271570a_100009814731_100020641529 [0,1,0,0,0,1|2,0,0]=4 85 B22R3.5272768 Cc1cc(cc(c1)c2cnc3c(nc(nc3c2)O)O)C 271570a_100000693139_100020641529 [0,1,0,0,0,1|2,0,0]=4 86 B22R3.5272768 Cc1cc(cc(c1)c2cnc3c(nc(nc3c2)O)O)Cl 271570a_100000049244_100020641529 [0,1,0,0,0,1|2,0,0]=4 87 B22R3.5272768 Cc1cc(cc(c1)c2cnc3c(nc(nc3c2)O)O)F 271570a_100011356783_100020641529 [0,1,0,0,0,1|2,0,0]=4 88 B22R3.5272768 Cc1cc(cc(c1)c2cnc3c(nc(nc3c2)O)O)O 271570a_100010141081_100020641529 [0,1,0,0,0,1|2,0,0]=4 89 B22R3.5469616 Cc1cccc(c1Br)c2cnc3c(nc(nc3c2)O)O 271570a_100046285795_100020641529 [0,1,0,0,0,1|2,0,0]=4 90 B22R3.5469616 Cc1cccc(c1C)c2cnc3c(nc(nc3c2)O)O 271570a_100000760475_100020641529 [0,1,0,0,0,1|2,0,0]=4 91 B22R3.5469616 Cc1cccc(c1Cl)c2cnc3c(nc(nc3c2)O)O 271570a_100012343306_100020641529 [0,1,0,0,0,1|2,0,0]=4 92 B22R3.5469616 Cc1cccc(c1F)c2cnc3c(nc(nc3c2)O)O 271570a_100011934588_100020641529 [0,1,0,0,0,1|2,0,0]=4 93 B22R3.5469616 Cc1cccc(c1O)c2cnc3c(nc(nc3c2)O)O 271570a_100000089634_100020641529 [0,1,0,0,0,1|2,0,0]=4 94 B22R3.5742172 Cc1ccc(c(c1)c2cnc3c(nc(nc3c2)O)O)C 271570a_100000695611_100020641529 [0,1,0,0,0,1|2,0,0]=4 95 B22R3.5742172 Cc1ccc(c(c1)c2cnc3c(nc(nc3c2)O)O)Cl 271570a_100011356805_100020641529 [0,1,0,0,0,1|2,0,0]=4 96 B22R3.5742172 Cc1ccc(c(c1)c2cnc3c(nc(nc3c2)O)O)F 271570a_100011263228_100020641529 [0,1,0,0,0,1|2,0,0]=4 97 B22R3.5742172 Cc1ccc(c(c1)c2cnc3c(nc(nc3c2)O)O)N 271570a_100000068086_100020641529 [0,1,0,0,0,1|2,0,0]=4 98 B22R3.5742172 Cc1ccc(c(c1)c2cnc3c(nc(nc3c2)O)O)O 271570a_100009873282_100020641529 [0,1,0,0,0,1|2,0,0]=4 99 B22R3.15280887 Cc1cc(ccc1Cl)c2cnc3c(nc(nc3c2)O)O 271570a_100000035345_100020641529 [0,1,0,0,0,1|2,0,0]=4 100 B22R3.15280887 Cc1cc(ccc1F)c2cnc3c(nc(nc3c2)O)O 271570a_100011217506_100020641529 [0,1,0,0,0,1|2,0,0]=4 101 B22R3.15280887 Cc1cc(ccc1N)c2cnc3c(nc(nc3c2)O)O 271570a_100010200941_100020641529 [0,1,0,0,0,1|2,0,0]=4 102 B22R3.15280887 Cc1cc(ccc1O)c2cnc3c(nc(nc3c2)O)O 271570a_100010081521_100020641529 [0,1,0,0,0,1|2,0,0]=4 103 B22R3.15280887 Cc1ccc(cc1C)c2cnc3c(nc(nc3c2)O)O 271570a_100011217131_100020641529 [0,1,0,0,0,1|2,0,0]=4 104 B20R3.2789705 Cc1cccc(c1)Nc2nc(nc3c2[nH]cn3)N 27a_100000188690_100000764887 [0,0,1,1,0,0|1,0,1]=4 105 B20R3.2789705 Cc1cccc(c1)Nc2nc(nc3c2nc[nH]3)F 27a_100000188690_100000061921 [0,0,1,1,0,0|2,0,0]=4 106 B18R2.65901 Cc1cccc(c1)C=Cc2cnc(nc2C)N 271570a_200135466880_100000725598 [0,0,1,0,1,0|2,0,0]=4 107 B18R2.65901 Cc1cccc(c1)C=Cc2cnc(nc2N)N 271570a_200135466880_200010734216 [0,0,1,0,1,0|2,0,0]=4 108 B20R2.12045422 CCN(Cc1cccc(c1)C)c2cc(nc(n2)N)O 27a_102516607250_100000694715 [0,0,1,0,0,1|1,0,1]=4 109 B20R3.92245 Cc1cccc(c1)c2ccc3c(ncnc3n2)O 271570a_100000749446_100000092995 [1,0,0,0,0,1|2,0,0]=4 110 B20R3.92245 Cc1cccc(c1)c2cnc3c(nccc3c2)O 271570a_100000749446_100010117065 [1,0,0,0,0,1|2,0,0]=4 111 B20R3.298127 Cc1cccc(c1)c2cccc3c2ncnc3O 271570a_100000749446_100010201916 [1,0,0,0,0,1|2,0,0]=4 112 B20R3.298913 Cc1cccc(c1)Sc2csc3c2ncnc3O 62a_100011215228_100010075196 [1,0,0,0,0,1|2,0,0]=4 113 B20R3.14623 Oc1nc(c2ncc(cc2n1)c3ccccc3)O 271570a_100011218836_100020641529 [1,0,0,0,0,1|2,0,0]=4 114 B20R3.2785862 Cc1cccc(c1)c2cccc3c2nc(nc3)N 271570a_100000749446_200010988910 [1,0,0,0,0,1|2,0,0]=4 115 B22R3.77552271 Cc1cccc(c1)Nc2cnc3c(nc(nc3c2)O)O 27a_100000188690_100020641529 [0,0,0,0,0,2|2,0,0]=4 116 B22R3.77552271 Cc1cccc(c1)Sc2cnc3c(nc(nc3c2)O)O 62a_100011215228_100020641529 [0,0,0,0,0,2|2,0,0]=4