0 B11R2.15 C=Cc1cc2sccc2s1 271570a_100011290941_200010191111 [0,0,0,0,0,0|3,1,0]=4 1 B11R2.15 C=Cc1cn2c(n1)CCC2 271570a_100011290941_100015205953 [0,0,0,0,0,0|2,0,2]=4 2 B11R2.15 C=Cc1nn2ccnc2s1 271570a_100011290941_100011333511 [0,0,0,0,0,0|2,0,0]=2 3 B11R2.15 CNc1nn2ccnc2s1 27a_100102657272_100011333511 [0,0,0,0,0,0|3,0,1]=4 4 B11R2.15 CSc1nn2ccnc2s1 62a_200000210301_100011333511 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.15 [13CH3]Sc1nn2ccnc2s1 62a_200025704644_100011333511 [0,0,0,0,0,0|3,0,1]=4 6 B10R2.2 Oc1nn2ccnc2s1 271570a_203496583355_100011333511 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.39 C=C=Cc1nn2ccnc2s1 271570a_100015277604_100011333511 [0,1,0,0,0,0|2,0,0]=3 8 B12R2.39 CC=Cc1nn2ccnc2s1 271570a_100016259895_100011333511 [0,1,0,0,0,0|2,0,0]=3 9 B12R2.252 C=C(C)c1nn2ccnc2s1 271570a_100000694244_100011333511 [0,1,0,0,0,0|2,0,0]=3 10 B10R1.27 C=CC(=O)Cc1ncco1 1458a_100000185746_103436540062 [0,0,1,0,0,0|2,0,1]=4 11 B10R1.35 C=Cc1nc(n(n1)C)NN 271570a_100011290941_100009820849 [0,0,1,0,0,0|2,0,1]=4 12 B10R1.96 C=Cc1ccn(n1)CCO 271570a_100011290941_200010732121 [0,0,1,0,0,0|1,0,2]=4 13 B10R1.96 C=Cc1ncn(n1)COC 271570a_100011290941_100010981097 [0,0,1,0,0,0|2,0,1]=4 14 B12R2.32 C=Cc1cn2ccccc2n1 271570a_100011290941_100009819586 [0,0,0,0,0,1|2,0,0]=3 15 B12R2.32 C=Cc1cn2ncccc2n1 271570a_100011290941_200010296001 [0,0,0,0,0,1|2,0,0]=3 16 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,0,0,0,0,1|2,0,1]=4 17 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,0,0,0,0,1|3,0,0]=4 18 B12R2.32 C=Cc1nc2cccnc2s1 271570a_100011290941_100010188088 [0,0,0,0,0,1|3,0,0]=4 19 B12R2.32 C=Cc1nc2cnccn2n1 271570a_100011290941_100010748104 [0,0,0,0,0,1|1,0,0]=2 20 B12R2.32 CNc1nc2cnccn2n1 27a_100102657272_100010748104 [0,0,0,0,0,1|2,0,1]=4 21 B12R2.32 CSc1nc2cnccn2n1 62a_100010748104_200000210301 [0,0,0,0,0,1|2,0,1]=4 22 B12R2.32 CSc1nc2cnccn2n1 62a_200000210301_100010748104 [0,0,0,0,0,1|2,0,1]=4 23 B12R2.32 [13CH3]Sc1nc2cnccn2n1 62a_100010748104_200025704644 [0,0,0,0,0,1|2,0,1]=4 24 B12R2.32 [13CH3]Sc1nc2cnccn2n1 62a_200025704644_100010748104 [0,0,0,0,0,1|2,0,1]=4 25 B12R2.44 C=Cc1cc2[nH]ccc2cn1 271570a_100011290941_100000089685 [0,0,0,0,0,1|3,0,0]=4 26 B12R2.44 C=Cc1cc2cc[nH]c2cn1 271570a_100011290941_100009864809 [0,0,0,0,0,1|3,0,0]=4 27 B12R2.44 C=Cc1cc2cc[nH]c2nn1 271570a_100011290941_100009855299 [0,0,0,0,0,1|3,0,0]=4 28 B12R2.44 C=Cc1cc2nccn2cn1 271570a_100011290941_100000052551 [0,0,0,0,0,1|2,0,0]=3 29 B12R2.44 C=Cc1cc2ncnn2cn1 271570a_100011290941_100000101099 [0,0,0,0,0,1|3,0,0]=4 30 B12R2.44 C=Cc1cc2sccc2cn1 271570a_100011290941_200016184645 [0,0,0,0,0,1|2,1,0]=4 31 B12R2.44 C=Cc1ccc2[nH]ccc2n1 271570a_100011290941_100000087148 [0,0,0,0,0,1|3,0,0]=4 32 B12R2.44 C=Cc1ccc2cc[nH]c2n1 271570a_100011290941_100009814870 [0,0,0,0,0,1|3,0,0]=4 33 B12R2.44 C=Cc1ccc2ccoc2c1 271570a_100011290941_100000759542 [0,0,0,0,0,1|3,0,0]=4 34 B12R2.44 C=Cc1ccc2nccn2c1 271570a_100011290941_100000746083 [0,0,0,0,0,1|3,0,0]=4 35 B12R2.44 C=Cc1ccc2nccn2n1 271570a_100011290941_100009883166 [0,0,0,0,0,1|2,0,0]=3 36 B12R2.44 C=Cc1ccc2nncn2n1 271570a_100011290941_100000185652 [0,0,0,0,0,1|3,0,0]=4 37 B12R2.44 C=Cc1ccc2occc2c1 271570a_100011290941_100012343831 [0,0,0,0,0,1|3,0,0]=4 38 B12R2.44 C=Cc1ccc2occc2n1 271570a_100011290941_100009851292 [0,0,0,0,0,1|2,0,0]=3 39 B12R2.44 C=Cc1ccc2sccc2n1 271570a_100011290941_100012000956 [0,0,0,0,0,1|2,1,0]=4 40 B12R2.44 C=Cc1ccn2ccnc2c1 271570a_100011290941_100009816855 [0,0,0,0,0,1|3,0,0]=4 41 B12R2.44 C=Cc1ccn2nccc2n1 271570a_100011290941_100000691470 [0,0,0,0,0,1|3,0,0]=4 42 B12R2.44 C=Cc1ccn2ncnc2n1 271570a_100011290941_100000054300 [0,0,0,0,0,1|3,0,0]=4 43 B12R2.44 C=Cc1cn2ccnc2cn1 271570a_100011290941_102495339940 [0,0,0,0,0,1|2,0,0]=3 44 B12R2.44 C=Cc1cn2cnnc2cn1 271570a_100011290941_100015552654 [0,0,0,0,0,1|3,0,0]=4 45 B12R2.44 C=Cc1cn2ncnc2cn1 271570a_100011290941_100009847490 [0,0,0,0,0,1|3,0,0]=4 46 B12R2.44 C=Cc1cnc2[nH]ccc2c1 271570a_100011290941_100000760471 [0,0,0,0,0,1|3,0,0]=4 47 B12R2.44 C=Cc1cnc2[nH]ccc2n1 271570a_100011290941_100009819590 [0,0,0,0,0,1|2,0,0]=3 48 B12R2.44 C=Cc1cnc2[nH]ncc2n1 271570a_100011290941_100009856409 [0,0,0,0,0,1|3,0,0]=4 49 B12R2.44 C=Cc1cnc2cc[nH]c2c1 271570a_100011290941_100009818992 [0,0,0,0,0,1|3,0,0]=4 50 B12R2.44 C=Cc1cnc2ccnn2c1 271570a_100011290941_100011349234 [0,0,0,0,0,1|3,0,0]=4 51 B12R2.44 C=Cc1cnc2nccn2c1 271570a_100011290941_100000764708 [0,0,0,0,0,1|2,0,0]=3 52 B12R2.44 C=Cc1cnc2ncnn2c1 271570a_100011290941_100000737005 [0,0,0,0,0,1|3,0,0]=4 53 B12R2.44 C=Cc1cnc2ncoc2c1 271570a_100011290941_100000721906 [0,0,0,0,0,1|3,0,0]=4 54 B12R2.44 C=Cc1cnc2nncn2c1 271570a_100011290941_100009814486 [0,0,0,0,0,1|3,0,0]=4 55 B12R2.44 C=Cc1cnc2sccc2c1 271570a_100011290941_100010135160 [0,0,0,0,0,1|2,1,0]=4 56 B12R2.44 C=Cc1ncc2[nH]ncc2n1 271570a_100011290941_100009843425 [0,0,0,0,0,1|3,0,0]=4 57 B12R2.44 C=Cc1ncc2ccsc2n1 271570a_100011290941_100009840870 [0,0,0,0,0,1|1,1,0]=3 58 B12R2.44 C=Cc1ncc2sccc2n1 271570a_100011290941_100000117912 [0,0,0,0,0,1|1,1,0]=3 59 B9R1.21 C=Cc1nc(n[nH]1)C#N 271570a_100011290941_200010752602 [1,0,1,0,0,0|1,0,1]=4 60 B9R1.23 C=Cc1nc(n(n1)C)N 271570a_100011290941_200010296169 [1,0,1,0,0,0|1,0,1]=4 61 B13R2.26 C=C=Cc1cn2ccccc2n1 271570a_100015277604_100009819586 [0,1,0,0,0,1|2,0,0]=4 62 B13R2.26 C=C=Cc1cn2ncccc2n1 271570a_100015277604_200010296001 [0,1,0,0,0,1|2,0,0]=4 63 B13R2.26 C=C=Cc1nc2cnccn2n1 271570a_100015277604_100010748104 [0,1,0,0,0,1|1,0,0]=3 64 B13R2.26 CC=Cc1cn2ccccc2n1 271570a_100016259895_100009819586 [0,1,0,0,0,1|2,0,0]=4 65 B13R2.26 CC=Cc1cn2ncccc2n1 271570a_100016259895_200010296001 [0,1,0,0,0,1|2,0,0]=4 66 B13R2.26 CC=Cc1nc2cnccn2n1 271570a_100016259895_100010748104 [0,1,0,0,0,1|1,0,0]=3 67 B13R2.43 C=Cc1cc2[nH]c(=O)ccn2n1 271570a_100011290941_100134615181 [0,1,0,0,0,1|2,0,0]=4 68 B13R2.43 C=Cc1cn2cc(ccc2n1)F 271570a_100011290941_100010231931 [0,1,0,0,0,1|2,0,0]=4 69 B13R2.435 C=C(C)c1cn2ccccc2n1 271570a_100000694244_100009819586 [0,1,0,0,0,1|2,0,0]=4 70 B13R2.435 C=C(C)c1cn2ncccc2n1 271570a_100000694244_200010296001 [0,1,0,0,0,1|2,0,0]=4 71 B13R2.435 C=C(C)c1nc2cnccn2n1 271570a_100000694244_100010748104 [0,1,0,0,0,1|1,0,0]=3 72 B13R2.430 C=C(C)c1cc2nccn2cn1 271570a_100000694244_100000052551 [0,1,0,0,0,1|2,0,0]=4 73 B13R2.430 C=C(C)c1ccc2nccn2n1 271570a_100000694244_100009883166 [0,1,0,0,0,1|2,0,0]=4 74 B13R2.430 C=C(C)c1ccc2occc2n1 271570a_100000694244_100009851292 [0,1,0,0,0,1|2,0,0]=4 75 B13R2.430 C=C(C)c1cn2ccnc2cn1 271570a_100000694244_102495339940 [0,1,0,0,0,1|2,0,0]=4 76 B13R2.430 C=C(C)c1cnc2[nH]ccc2n1 271570a_100000694244_100009819590 [0,1,0,0,0,1|2,0,0]=4 77 B13R2.430 C=C(C)c1cnc2nccn2c1 271570a_100000694244_100000764708 [0,1,0,0,0,1|2,0,0]=4 78 B13R2.430 C=C(C)c1ncc2ccsc2n1 271570a_100000694244_100009840870 [0,1,0,0,0,1|1,1,0]=4 79 B13R2.430 C=C(C)c1ncc2sccc2n1 271570a_100000694244_100000117912 [0,1,0,0,0,1|1,1,0]=4 80 B13R2.449 C=C=Cc1cc2nccn2cn1 271570a_100015277604_100000052551 [0,1,0,0,0,1|2,0,0]=4 81 B13R2.449 C=C=Cc1ccc2nccn2n1 271570a_100015277604_100009883166 [0,1,0,0,0,1|2,0,0]=4 82 B13R2.449 C=C=Cc1ccc2occc2n1 271570a_100015277604_100009851292 [0,1,0,0,0,1|2,0,0]=4 83 B13R2.449 C=C=Cc1cn2ccnc2cn1 271570a_100015277604_102495339940 [0,1,0,0,0,1|2,0,0]=4 84 B13R2.449 C=C=Cc1cnc2[nH]ccc2n1 271570a_100015277604_100009819590 [0,1,0,0,0,1|2,0,0]=4 85 B13R2.449 C=C=Cc1cnc2nccn2c1 271570a_100015277604_100000764708 [0,1,0,0,0,1|2,0,0]=4 86 B13R2.449 C=C=Cc1ncc2ccsc2n1 271570a_100015277604_100009840870 [0,1,0,0,0,1|1,1,0]=4 87 B13R2.449 C=C=Cc1ncc2sccc2n1 271570a_100015277604_100000117912 [0,1,0,0,0,1|1,1,0]=4 88 B13R2.449 CC=Cc1cc2nccn2cn1 271570a_100016259895_100000052551 [0,1,0,0,0,1|2,0,0]=4 89 B13R2.449 CC=Cc1ccc2nccn2n1 271570a_100016259895_100009883166 [0,1,0,0,0,1|2,0,0]=4 90 B13R2.449 CC=Cc1ccc2occc2n1 271570a_100016259895_100009851292 [0,1,0,0,0,1|2,0,0]=4 91 B13R2.449 CC=Cc1cn2ccnc2cn1 271570a_100016259895_102495339940 [0,1,0,0,0,1|2,0,0]=4 92 B13R2.449 CC=Cc1cnc2[nH]ccc2n1 271570a_100016259895_100009819590 [0,1,0,0,0,1|2,0,0]=4 93 B13R2.449 CC=Cc1cnc2nccn2c1 271570a_100016259895_100000764708 [0,1,0,0,0,1|2,0,0]=4 94 B13R2.449 CC=Cc1ncc2ccsc2n1 271570a_100016259895_100009840870 [0,1,0,0,0,1|1,1,0]=4 95 B13R2.449 CC=Cc1ncc2sccc2n1 271570a_100016259895_100000117912 [0,1,0,0,0,1|1,1,0]=4 96 B13R2.599 C=Cc1nc2cc[nH]c2nc1C 271570a_100011290941_200010174982 [0,1,0,0,0,1|2,0,0]=4 97 B13R2.654 C=Cc1cc(=O)n2cc[nH]c2n1 271570a_100011290941_100009861764 [0,1,0,0,0,1|2,0,0]=4 98 B13R2.654 C=Cc1cc2nccn2c(n1)O 271570a_100011290941_100015273213 [0,1,0,0,0,1|2,0,0]=4 99 B13R2.654 C=Cc1cn2ccnc2c(n1)C 271570a_100011290941_100010255711 [0,1,0,0,0,1|2,0,0]=4 100 B13R2.654 C=Cc1cn2ccnc2c(n1)N 271570a_100011290941_100000685232 [0,1,0,0,0,1|2,0,0]=4 101 B13R2.654 C=Cc1nc(c2sccc2n1)N 271570a_100011290941_100012002325 [0,1,0,0,0,1|1,1,0]=4 102 B13R2.669 C=Cc1ccc2ncc(n2n1)C 271570a_100011290941_200000097527 [0,1,0,0,0,1|2,0,0]=4 103 B13R2.669 C=Cc1ccc2ncc(n2n1)N 271570a_100011290941_100000095202 [0,1,0,0,0,1|2,0,0]=4 104 B13R2.669 C=Cc1ncc2ccn(c2n1)C 271570a_100011290941_100009859872 [0,1,0,0,0,1|2,0,0]=4 105 B13R2.2121 C=Cc1ccc2nc(cn2n1)C 271570a_100011290941_100000086295 [0,1,0,0,0,1|2,0,0]=4 106 B13R2.2121 C=Cc1ccc2nc(cn2n1)N 271570a_100011290941_100009877543 [0,1,0,0,0,1|2,0,0]=4 107 B13R2.2121 C=Cc1cn2cc(nc2cn1)C 271570a_100011290941_100010063712 [0,1,0,0,0,1|2,0,0]=4 108 B13R2.2121 C=Cc1cn2cc(nc2cn1)N 271570a_100011290941_100000703926 [0,1,0,0,0,1|2,0,0]=4 109 B13R2.2121 C=Cc1cnc2nc(cn2c1)C 271570a_100011290941_200012362479 [0,1,0,0,0,1|2,0,0]=4 110 B13R2.2130 C=Cc1cnc2c(n1)ccn2C 271570a_100011290941_100010168881 [0,1,0,0,0,1|2,0,0]=4 111 B13R2.2130 C=Cc1ncc2c(n1)ccn2C 271570a_100011290941_100010385126 [0,1,0,0,0,1|2,0,0]=4 112 B13R2.164 C=CCNc1nn2ccnc2s1 27a_100020586998_100011333511 [0,2,0,0,0,0|2,0,0]=4 113 B13R2.164 C=CCSc1nn2ccnc2s1 62a_100000210623_100011333511 [0,2,0,0,0,0|2,0,0]=4 114 B13R2.543 CC(=Cc1nn2ccnc2s1)C 271570a_100102525489_100011333511 [0,2,0,0,0,0|2,0,0]=4 115 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [0,0,1,1,0,0|2,0,0]=4 116 B11R2.36 Oc1ccc2nccn2n1 271570a_203496583355_100009883166 [0,0,1,1,0,0|2,0,0]=4 117 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [0,0,1,1,0,0|2,0,0]=4 118 B11R2.10 Oc1nc2cnccn2n1 271570a_203496583355_100010748104 [1,0,0,0,0,1|2,0,0]=4 119 B13R2.57 C=Cc1cnc2ccccc2n1 271570a_100011290941_100000756483 [0,0,0,0,0,2|2,0,0]=4 120 B13R2.57 C=Cc1cnc2ncccc2n1 271570a_100011290941_100000084304 [0,0,0,0,0,2|2,0,0]=4 121 B13R2.57 C=Cc1ncc2ccccc2n1 271570a_100011290941_100000097389 [0,0,0,0,0,2|2,0,0]=4