0 B12R2.82 Cc1c(cnc2c1[nH]cn2)O 271570a_203496583355_100010140963 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.82 Cc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097406 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.82 Nc1c(ccc2c1scn2)O 271570a_203496583355_100010998030 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.82 Nc1c(cnc2c1cc[nH]2)O 271570a_203496583355_100010168494 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.82 Oc1c(cnc2c1[nH]cc2)F 271570a_203496583355_100009883597 [0,0,0,0,0,0|4,0,0]=4 6 B11R2.36 Oc1cnc2cc[nH]c2c1 271570a_203496583355_100009818992 [1,0,0,0,0,0|3,0,0]=4 7 B11R2.36 Oc1cnc2nc[nH]c2c1 271570a_203496583355_100000760087 [1,0,0,0,0,0|2,0,0]=3 8 B11R2.36 Oc1cnc2ncoc2c1 271570a_203496583355_100000721906 [1,0,0,0,0,0|3,0,0]=4 9 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [1,0,0,0,0,0|3,0,0]=4 10 B11R2.106 Oc1ncnc2c1[nH]cc2 271570a_203496583355_100000084117 [1,0,0,0,0,0|2,0,1]=4 11 B13R2.84 C=Cc1cnc2nc[nH]c2c1C 271570a_100011290941_100010140963 [0,1,0,0,0,0|2,0,1]=4 12 B13R2.84 CSc1ccc2ncsc2c1N 62a_100010998030_200000210301 [0,1,0,0,0,0|3,0,0]=4 13 B13R2.84 CSc1cnc2[nH]ccc2c1N 62a_200000210301_100010168494 [0,1,0,0,0,0|2,0,1]=4 14 B13R2.84 CSc1cnc2nc[nH]c2c1C 62a_200000210301_100010140963 [0,1,0,0,0,0|2,0,0]=3 15 B13R2.84 Cc1c(cnc2c1[nH]cn2)S[13CH3] 62a_200025704644_100010140963 [0,1,0,0,0,0|2,0,0]=3 16 B13R2.84 [13CH3]Sc1ccc2ncsc2c1N 62a_100010998030_200025704644 [0,1,0,0,0,0|3,0,0]=4 17 B13R2.84 [13CH3]Sc1cnc2[nH]ccc2c1N 62a_200025704644_100010168494 [0,1,0,0,0,0|2,0,1]=4 18 B13R2.4899 Cn1c(nc2cc[nH]c2c1=O)O 271570a_203496583355_100150720343 [0,1,0,0,0,0|2,0,1]=4 19 B11R1.13 CC=Cc1cncc(c1N)C 271570a_100016259895_100009818025 [0,0,1,0,0,0|3,0,0]=4 20 B11R1.59 C=Cc1nc[nH]c1C(=O)OC 271570a_100011290941_100010290838 [0,0,1,0,0,0|3,0,0]=4 21 B11R1.192 CC=Cc1cc(c(cn1)C)N 271570a_100016259895_100000690170 [0,0,1,0,0,0|3,0,0]=4 22 B11R1.278 C=Cc1ncc(c(c1N)N)C 271570a_100011290941_200000097298 [0,0,1,0,0,0|2,0,0]=3 23 B11R1.278 C=Cc1ncc(c(c1N)N)F 271570a_100011290941_200009878142 [0,0,1,0,0,0|3,0,0]=4 24 B11R1.278 CSc1ncc(c(c1N)N)C 62a_200000097298_200000210301 [0,0,1,0,0,0|2,0,1]=4 25 B11R1.278 CSc1ncc(c(c1N)N)C 62a_200000210301_200000097298 [0,0,1,0,0,0|2,0,1]=4 26 B11R1.278 Cc1cnc(c(c1N)N)S[13CH3] 62a_200000097298_200025704644 [0,0,1,0,0,0|2,0,1]=4 27 B11R1.278 Cc1cnc(c(c1N)N)S[13CH3] 62a_200025704644_200000097298 [0,0,1,0,0,0|2,0,1]=4 28 B10R1.2 C=Cc1cncc(c1N)C 271570a_100011290941_100009818025 [1,0,1,0,0,0|2,0,0]=4 29 B10R1.2 C=Cc1nccc(c1N)N 271570a_100011290941_100000085203 [1,0,1,0,0,0|2,0,0]=4 30 B10R1.2 C=Cc1ncnc(c1N)N 271570a_100011290941_100000766367 [1,0,1,0,0,0|1,0,1]=4 31 B10R1.119 Cc1cnc(c(c1N)N)O 271570a_203496583355_200000097298 [1,0,1,0,0,0|2,0,0]=4 32 B10R1.176 C=Cc1cc(c(cn1)C)N 271570a_100011290941_100000690170 [1,0,1,0,0,0|2,0,0]=4 33 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.893 C=C(C)c1ncc(c(c1N)N)C 271570a_100000694244_200000097298 [0,1,1,0,0,0|2,0,0]=4 35 B12R2.44 C=Cc1cnc2nc[nH]c2c1 271570a_100011290941_100000760087 [1,1,0,0,0,0|1,0,1]=4 36 B12R2.44 CSc1cnc2cc[nH]c2c1 62a_200000210301_100009818992 [1,1,0,0,0,0|2,0,0]=4 37 B12R2.44 CSc1cnc2nc[nH]c2c1 62a_200000210301_100000760087 [1,1,0,0,0,0|1,0,0]=3 38 B12R2.44 CSc1cnc2ncoc2c1 62a_100000721906_200000210301 [1,1,0,0,0,0|2,0,0]=4 39 B12R2.44 CSc1cnc2ncoc2c1 62a_200000210301_100000721906 [1,1,0,0,0,0|2,0,0]=4 40 B12R2.44 [13CH3]Sc1cnc2cc[nH]c2c1 62a_200025704644_100009818992 [1,1,0,0,0,0|2,0,0]=4 41 B12R2.44 [13CH3]Sc1cnc2nc[nH]c2c1 62a_200025704644_100000760087 [1,1,0,0,0,0|1,0,0]=3 42 B12R2.44 [13CH3]Sc1cnc2ncoc2c1 62a_100000721906_200025704644 [1,1,0,0,0,0|2,0,0]=4 43 B12R2.44 [13CH3]Sc1cnc2ncoc2c1 62a_200025704644_100000721906 [1,1,0,0,0,0|2,0,0]=4 44 B12R2.606 Cc1nc2ncc(cc2[nH]1)O 271570a_203496583355_100000758206 [1,1,0,0,0,0|2,0,0]=4 45 B12R2.202 Nc1ncnc2c1[nH]c(n2)O 271570a_203496583355_100009817290 [1,1,0,0,0,0|0,0,1]=3 46 B12R2.203 Cn1cnc2c1c(ncn2)O 271570a_203496583355_100000078800 [1,1,0,0,0,0|1,0,1]=4 47 B12R2.315 CNc1ncnc2c1[nH]cc2 27a_100102657272_100000084117 [1,1,0,0,0,0|1,0,1]=4 48 B12R2.315 CNc1ncnc2c1[nH]cn2 27a_100102657272_100011215200 [1,1,0,0,0,0|0,0,1]=3 49 B12R2.315 CSc1ncnc2c1[nH]cn2 62a_200000210301_100011215200 [1,1,0,0,0,0|1,0,1]=4 50 B12R2.315 [13CH3]Sc1ncnc2c1[nH]cn2 62a_200025704644_100011215200 [1,1,0,0,0,0|1,0,1]=4 51 B14R2.808 CC=Cc1cnc2nc[nH]c2c1C 271570a_100016259895_100010140963 [0,2,0,0,0,0|2,0,0]=4 52 B14R2.808 CCSc1cnc2nc[nH]c2c1C 62a_100000210202_100010140963 [0,2,0,0,0,0|2,0,0]=4 53 B14R2.808 Cc1c(cnc2c1[nH]cn2)SCF 62a_100015361967_100010140963 [0,2,0,0,0,0|2,0,0]=4 54 B14R2.5998 C=C(C)c1cnc2nc[nH]c2c1C 271570a_100000694244_100010140963 [0,2,0,0,0,0|2,0,0]=4