0 B9R1.22 C=Cc1cc(nn1C)C 271570a_100011290941_100009818511 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.22 C=Cc1cc(nn1C)N 271570a_100011290941_100116209741 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.22 C=Cc1cc(sc1C)C 271570a_100011290941_100000688054 [0,0,0,0,0,0|2,0,0]=2 3 B9R1.22 C=Cc1cc(sc1Cl)Cl 271570a_100011290941_100010244177 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.22 C=Cc1cn(nc1C)C 271570a_100011290941_100011996311 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.22 C=Cc1cn(nc1N)C 271570a_100011290941_100010776223 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.22 C=Cc1nc(cn1C)C 271570a_100011290941_100009816808 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.22 C=Cc1nc(sc1C)C 271570a_100011290941_100010270876 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.22 C=Cc1nc(sc1C)N 271570a_100011290941_100009817509 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.22 C=Cc1nn(cc1C)C 271570a_100011290941_100012644376 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.22 C=Cc1nn(nc1C)C 271570a_100011290941_200009884731 [0,0,0,0,0,0|2,0,0]=2 11 B9R1.22 C=Cc1sc(cc1C)C 271570a_100011290941_100000689295 [0,0,0,0,0,0|1,0,0]=1 12 B9R1.22 C=Cc1sc(nc1C)C 271570a_100011290941_100009814099 [0,0,0,0,0,0|0,0,0]=0 13 B9R1.22 COc1cc(nn1C)C 34a_100000738638_200000210301 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.22 CSc1cc(nn1C)C 62a_100009818511_200000210301 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.22 CSc1cc(nn1C)C 62a_200000210301_100009818511 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.22 CSc1cc(sc1C)C 62a_100000688054_200000210301 [0,0,0,0,0,0|3,0,1]=4 17 B9R1.22 CSc1cc(sc1C)C 62a_200000210301_100000688054 [0,0,0,0,0,0|3,0,1]=4 18 B9R1.22 CSc1cn(nc1C)C 62a_100011996311_200000210301 [0,0,0,0,0,0|3,0,1]=4 19 B9R1.22 CSc1cn(nc1C)C 62a_200000210301_100011996311 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.22 CSc1nc([nH]c1C)C 62a_200000210301_200009820778 [0,0,0,0,0,0|2,0,2]=4 21 B9R1.22 CSc1nc([nH]c1C)C 62a_200009820778_200000210301 [0,0,0,0,0,0|2,0,2]=4 22 B9R1.22 CSc1nc(sc1C)C 62a_100010270876_200000210301 [0,0,0,0,0,0|3,0,1]=4 23 B9R1.22 CSc1nc(sc1C)C 62a_200000210301_100010270876 [0,0,0,0,0,0|3,0,1]=4 24 B9R1.22 CSc1nn(nc1C)C 62a_200000210301_200009884731 [0,0,0,0,0,0|3,0,1]=4 25 B9R1.22 CSc1nn(nc1C)C 62a_200009884731_200000210301 [0,0,0,0,0,0|3,0,1]=4 26 B9R1.22 CSc1sc(cc1C)C 62a_100000689295_200000210301 [0,0,0,0,0,0|2,0,1]=3 27 B9R1.22 CSc1sc(cc1C)C 62a_200000210301_100000689295 [0,0,0,0,0,0|2,0,1]=3 28 B9R1.22 CSc1sc(nc1C)C 62a_100009814099_200000210301 [0,0,0,0,0,0|1,0,1]=2 29 B9R1.22 CSc1sc(nc1C)C 62a_200000210301_100009814099 [0,0,0,0,0,0|1,0,1]=2 30 B9R1.22 CSc1sc(nc1C)N 62a_100159269596_200000210301 [0,0,0,0,0,0|2,0,1]=3 31 B9R1.22 CSc1sc(nc1C)N 62a_200000210301_100159269596 [0,0,0,0,0,0|2,0,1]=3 32 B9R1.22 Cc1cc(c(s1)C)S[13CH3] 62a_100000688054_200025704644 [0,0,0,0,0,0|3,0,1]=4 33 B9R1.22 Cc1cc(c(s1)C)S[13CH3] 62a_200025704644_100000688054 [0,0,0,0,0,0|3,0,1]=4 34 B9R1.22 Cc1cc(c(s1)C=O)O 271570a_203496583355_100011361552 [0,0,0,0,0,0|3,0,0]=3 35 B9R1.22 Cc1cc(c(s1)S[13CH3])C 62a_100000689295_200025704644 [0,0,0,0,0,0|2,0,1]=3 36 B9R1.22 Cc1cc(c(s1)S[13CH3])C 62a_200025704644_100000689295 [0,0,0,0,0,0|2,0,1]=3 37 B9R1.22 Cc1cc(n(n1)C)O[13CH3] 34a_100000738638_200025704644 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.22 Cc1cc(n(n1)C)S[13CH3] 62a_100009818511_200025704644 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.22 Cc1cc(n(n1)C)S[13CH3] 62a_200025704644_100009818511 [0,0,0,0,0,0|3,0,1]=4 40 B9R1.22 Cc1cc(sc1C=O)O 271570a_203496583355_100010221198 [0,0,0,0,0,0|3,0,0]=3 41 B9R1.22 Cc1nc(c([nH]1)C)S[13CH3] 62a_200009820778_200025704644 [0,0,0,0,0,0|2,0,2]=4 42 B9R1.22 Cc1nc(c([nH]1)C)S[13CH3] 62a_200025704644_200009820778 [0,0,0,0,0,0|2,0,2]=4 43 B9R1.22 Cc1nc(c(s1)C)S[13CH3] 62a_100010270876_200025704644 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.22 Cc1nc(c(s1)C)S[13CH3] 62a_200025704644_100010270876 [0,0,0,0,0,0|3,0,1]=4 45 B9R1.22 Cc1nc(c(s1)S[13CH3])C 62a_100009814099_200025704644 [0,0,0,0,0,0|1,0,1]=2 46 B9R1.22 Cc1nc(c(s1)S[13CH3])C 62a_200025704644_100009814099 [0,0,0,0,0,0|1,0,1]=2 47 B9R1.22 Cc1nc(sc1C=O)O 271570a_203496583355_100010339034 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.22 Cc1nc(sc1CO)O 271570a_203496583355_100010264302 [0,0,0,0,0,0|2,0,1]=3 49 B9R1.22 Cc1nc(sc1S[13CH3])N 62a_100159269596_200025704644 [0,0,0,0,0,0|2,0,1]=3 50 B9R1.22 Cc1nc(sc1S[13CH3])N 62a_200025704644_100159269596 [0,0,0,0,0,0|2,0,1]=3 51 B9R1.22 Cc1nn(cc1S[13CH3])C 62a_100011996311_200025704644 [0,0,0,0,0,0|3,0,1]=4 52 B9R1.22 Cc1nn(cc1S[13CH3])C 62a_200025704644_100011996311 [0,0,0,0,0,0|3,0,1]=4 53 B9R1.22 Cc1nn(nc1S[13CH3])C 62a_200009884731_200025704644 [0,0,0,0,0,0|3,0,1]=4 54 B9R1.22 Cc1nn(nc1S[13CH3])C 62a_200025704644_200009884731 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.22 Cc1oc(nc1C=O)O 271570a_203496583355_200010262729 [0,0,0,0,0,0|4,0,0]=4 56 B8R1.1 C=Cc1c[nH]c(n1)C 271570a_100011290941_100009814057 [1,0,0,0,0,0|1,0,1]=3 57 B8R1.1 C=Cc1cc([nH]n1)C 271570a_100011290941_100015199547 [1,0,0,0,0,0|2,0,1]=4 58 B8R1.1 C=Cc1cc(cs1)C 271570a_100011290941_100009876951 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.1 C=Cc1cc(n[nH]1)Br 271570a_100011290941_100160470719 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.1 C=Cc1cc(ns1)C 271570a_100011290941_100009815735 [1,0,0,0,0,0|2,0,0]=3 61 B8R1.1 C=Cc1ccc(s1)Br 271570a_100011290941_100010197418 [1,0,0,0,0,0|2,0,0]=3 62 B8R1.1 C=Cc1ccc(s1)C 271570a_100011290941_100000761539 [1,0,0,0,0,0|1,0,0]=2 63 B8R1.1 C=Cc1ccn(n1)C 271570a_100011290941_100000752436 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.1 C=Cc1cn(nn1)C 271570a_100011290941_100000760339 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.1 C=Cc1cnc(s1)C 271570a_100011290941_100000764884 [1,0,0,0,0,0|0,0,0]=1 66 B8R1.1 C=Cc1cnn(c1)C 271570a_100011290941_100000748075 [1,0,0,0,0,0|2,0,0]=3 67 B8R1.1 C=Cc1cnn(n1)C 271570a_100011290941_100000733932 [1,0,0,0,0,0|2,0,0]=3 68 B8R1.1 C=Cc1csc(c1)C 271570a_100011290941_100000759034 [1,0,0,0,0,0|2,0,0]=3 69 B8R1.1 C=Cc1csc(n1)C 271570a_100011290941_100011934587 [1,0,0,0,0,0|2,0,0]=3 70 B8R1.1 C=Cc1csc(n1)N 271570a_100011290941_100011998049 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.1 C=Cc1n[nH]c(n1)C 271570a_100011290941_100000732540 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.1 C=Cc1nc(c[nH]1)C 271570a_100011290941_100161115468 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.1 C=Cc1nc(cs1)C 271570a_100011290941_100011291629 [1,0,0,0,0,0|3,0,0]=4 74 B8R1.1 C=Cc1nc(ns1)C 271570a_100011290941_100000709739 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.1 C=Cc1ncc(s1)C 271570a_100011290941_100000690809 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.1 C=Cc1nnc(o1)C 271570a_100011290941_100000708914 [1,0,0,0,0,0|1,1,0]=3 77 B8R1.1 C=Cc1nnc(s1)C 271570a_100011290941_100000686958 [1,0,0,0,0,0|1,0,0]=2 78 B8R1.1 C=Cc1nnc(s1)N 271570a_100011290941_100000738278 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.1 C=Cc1nnn(n1)C 271570a_100011290941_200009870515 [1,0,0,0,0,0|3,0,0]=4 80 B8R1.1 C=Cc1noc(n1)C 271570a_100011290941_100012003639 [1,0,0,0,0,0|3,0,0]=4 81 B8R1.1 CNc1nnc(s1)C 27a_100102657272_100000686958 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.1 CSc1ccc(s1)C 62a_100000031368_200000210301 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.1 CSc1ccc(s1)C 62a_200000210301_100000031368 [1,0,0,0,0,0|2,0,1]=4 84 B8R1.1 CSc1cnc(s1)Br 62a_100012357534_200000210301 [1,0,0,0,0,0|2,0,1]=4 85 B8R1.1 CSc1cnc(s1)Br 62a_200000210301_100012357534 [1,0,0,0,0,0|2,0,1]=4 86 B8R1.1 CSc1cnc(s1)C 62a_100000764884_200000210301 [1,0,0,0,0,0|1,0,1]=3 87 B8R1.1 CSc1cnc(s1)C 62a_200000210301_100000764884 [1,0,0,0,0,0|1,0,1]=3 88 B8R1.1 CSc1cnc(s1)N 62a_100000718969_200000210301 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.1 CSc1cnc(s1)N 62a_200000210301_100000718969 [1,0,0,0,0,0|2,0,1]=4 90 B8R1.1 CSc1nnc(s1)C 62a_100000686958_200000210301 [1,0,0,0,0,0|2,0,1]=4 91 B8R1.1 CSc1nnc(s1)C 62a_200000210301_100000686958 [1,0,0,0,0,0|2,0,1]=4 92 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_100000031368_200025704644 [1,0,0,0,0,0|2,0,1]=4 93 B8R1.1 Cc1ccc(s1)S[13CH3] 62a_200025704644_100000031368 [1,0,0,0,0,0|2,0,1]=4 94 B8R1.1 Cc1ncc(s1)S[13CH3] 62a_100000764884_200025704644 [1,0,0,0,0,0|1,0,1]=3 95 B8R1.1 Cc1ncc(s1)S[13CH3] 62a_200025704644_100000764884 [1,0,0,0,0,0|1,0,1]=3 96 B8R1.1 Cc1nnc(s1)S[13CH3] 62a_100000686958_200025704644 [1,0,0,0,0,0|2,0,1]=4 97 B8R1.1 Cc1nnc(s1)S[13CH3] 62a_200025704644_100000686958 [1,0,0,0,0,0|2,0,1]=4 98 B8R1.1 N#Cc1cnc(s1)O 271570a_203496583355_100009819632 [1,0,0,0,0,0|2,0,1]=4 99 B8R1.1 NCc1cnc(s1)O 271570a_203496583355_100000726991 [1,0,0,0,0,0|2,0,1]=4 100 B8R1.1 O=Cc1ccc(s1)O 271570a_203496583355_100000179771 [1,0,0,0,0,0|3,0,0]=4 101 B8R1.1 O=Cc1cnc(s1)O 271570a_203496583355_100009814069 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.1 OCc1cnc(s1)O 271570a_203496583355_100009816753 [1,0,0,0,0,0|2,0,1]=4 103 B8R1.1 [13CH3]Sc1cnc(s1)Br 62a_100012357534_200025704644 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.1 [13CH3]Sc1cnc(s1)Br 62a_200025704644_100012357534 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.1 [13CH3]Sc1cnc(s1)N 62a_100000718969_200025704644 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.1 [13CH3]Sc1cnc(s1)N 62a_200025704644_100000718969 [1,0,0,0,0,0|2,0,1]=4 107 B8R1.11 C=Cc1[nH]cnc1Cl 271570a_100011290941_100010200774 [1,0,0,0,0,0|2,0,0]=3 108 B8R1.11 C=Cc1c[nH]nc1Br 271570a_100011290941_100011012988 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.11 C=Cc1c[nH]nc1C 271570a_100011290941_100011912673 [1,0,0,0,0,0|2,0,0]=3 110 B8R1.11 C=Cc1c[nH]nc1F 271570a_100011290941_100015597042 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.11 C=Cc1c[nH]nc1N 271570a_100011290941_100000717100 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.11 C=Cc1ccnn1C 271570a_100011290941_100000688441 [1,0,0,0,0,0|2,0,0]=3 113 B8R1.11 C=Cc1ccsc1C 271570a_100011290941_100000684487 [1,0,0,0,0,0|2,0,0]=3 114 B8R1.11 C=Cc1cnoc1C 271570a_100011290941_100009872056 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.11 C=Cc1conc1N 271570a_100011290941_100012597345 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.11 C=Cc1cscc1C 271570a_100011290941_100000759966 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.11 C=Cc1n[nH]cc1C 271570a_100011290941_100009871783 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.11 C=Cc1nc[nH]c1C 271570a_100011290941_100009816806 [1,0,0,0,0,0|1,0,1]=3 119 B8R1.11 C=Cc1nccn1C 271570a_100011290941_100000707724 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.11 C=Cc1ncnn1C 271570a_100011290941_100000732653 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.11 C=Cc1ncsc1C 271570a_100011290941_100000732656 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.11 C=Cc1sccc1Br 271570a_100011290941_100012361411 [1,0,0,0,0,0|2,0,0]=3 123 B8R1.11 C=Cc1sccc1C 271570a_100011290941_100000742657 [1,0,0,0,0,0|1,0,0]=2 124 B8R1.11 C=Cc1scnc1C 271570a_100011290941_100009817116 [1,0,0,0,0,0|0,0,0]=1 125 B8R1.11 CSc1sccc1C 62a_100010247149_200000210301 [1,0,0,0,0,0|2,0,1]=4 126 B8R1.11 CSc1sccc1C 62a_200000210301_100010247149 [1,0,0,0,0,0|2,0,1]=4 127 B8R1.11 CSc1scnc1C 62a_100009817116_200000210301 [1,0,0,0,0,0|1,0,1]=3 128 B8R1.11 CSc1scnc1C 62a_200000210301_100009817116 [1,0,0,0,0,0|1,0,1]=3 129 B8R1.11 Cc1ccsc1S[13CH3] 62a_100010247149_200025704644 [1,0,0,0,0,0|2,0,1]=4 130 B8R1.11 Cc1ccsc1S[13CH3] 62a_200025704644_100010247149 [1,0,0,0,0,0|2,0,1]=4 131 B8R1.11 Cc1ncsc1S[13CH3] 62a_100009817116_200025704644 [1,0,0,0,0,0|1,0,1]=3 132 B8R1.11 Cc1ncsc1S[13CH3] 62a_200025704644_100009817116 [1,0,0,0,0,0|1,0,1]=3 133 B8R1.11 O=Cc1sccc1O 271570a_203496583355_100000766043 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.11 OCc1scnc1O 271570a_203496583355_100012000948 [1,0,0,0,0,0|2,0,1]=4 135 B8R1.18 Cc1cc(c(s1)C)O 271570a_203496583355_100000688054 [1,0,0,0,0,0|2,0,1]=4 136 B8R1.18 Cc1cc(c(s1)O)C 271570a_203496583355_100000689295 [1,0,0,0,0,0|2,0,0]=3 137 B8R1.18 Cc1cc(n(n1)C)O 271570a_203496583355_100009818511 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.18 Cc1cc(sc1C)O 271570a_203496583355_100009850898 [1,0,0,0,0,0|2,0,1]=4 139 B8R1.18 Cc1nc(c(s1)C)O 271570a_203496583355_100010270876 [1,0,0,0,0,0|1,0,1]=3 140 B8R1.18 Cc1nc(c(s1)O)C 271570a_203496583355_100009814099 [1,0,0,0,0,0|1,0,0]=2 141 B8R1.18 Cc1nc(sc1C)O 271570a_203496583355_100000765934 [1,0,0,0,0,0|1,0,1]=3 142 B8R1.18 Cc1nn(cc1O)C 271570a_203496583355_100011996311 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.18 Cc1nn(nc1O)C 271570a_203496583355_200009884731 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.18 Cc1sc(nc1O)N 271570a_203496583355_100009817509 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.32 C=Cc1cc(sc1C=O)C 271570a_100011290941_100011361552 [0,1,0,0,0,0|2,0,1]=4 146 B10R1.32 C=Cc1cn(nc1C#N)C 271570a_100011290941_100009817404 [0,1,0,0,0,0|2,0,1]=4 147 B10R1.32 C=Cc1cn(nc1CC)C 271570a_100011290941_100012396458 [0,1,0,0,0,0|2,0,0]=3 148 B10R1.32 C=Cc1cn(nc1CO)C 271570a_100011290941_100009816719 [0,1,0,0,0,0|2,0,0]=3 149 B10R1.32 C=Cc1cn(nc1OC)C 271570a_100011290941_100015475556 [0,1,0,0,0,0|2,0,0]=3 150 B10R1.32 C=Cc1sc(nc1CO)C 271570a_100011290941_100011103066 [0,1,0,0,0,0|0,0,0]=1 151 B10R1.32 CSc1cc(sc1C=O)C 62a_100011361552_200000210301 [0,1,0,0,0,0|2,0,0]=3 152 B10R1.32 CSc1cc(sc1C=O)C 62a_200000210301_100011361552 [0,1,0,0,0,0|2,0,0]=3 153 B10R1.32 CSc1sc(nc1CO)C 62a_100011103066_200000210301 [0,1,0,0,0,0|1,0,1]=3 154 B10R1.32 CSc1sc(nc1CO)C 62a_200000210301_100011103066 [0,1,0,0,0,0|1,0,1]=3 155 B10R1.32 Cc1cc(c(s1)C=O)S[13CH3] 62a_100011361552_200025704644 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.32 Cc1cc(c(s1)C=O)S[13CH3] 62a_200025704644_100011361552 [0,1,0,0,0,0|2,0,0]=3 157 B10R1.32 Cc1nc(c(s1)S[13CH3])CO 62a_100011103066_200025704644 [0,1,0,0,0,0|1,0,1]=3 158 B10R1.32 Cc1nc(c(s1)S[13CH3])CO 62a_200025704644_100011103066 [0,1,0,0,0,0|1,0,1]=3 159 B10R1.35 C=Cc1cc(c(s1)C=O)C 271570a_100011290941_100010221198 [0,1,0,0,0,0|2,0,1]=4 160 B10R1.35 C=Cc1cc(sc1C)C=O 271570a_100011290941_100000708457 [0,1,0,0,0,0|2,0,1]=4 161 B10R1.35 C=Cc1cc(sc1C)CO 271570a_100011290941_100013897464 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.35 C=Cc1nc(c(s1)C=O)C 271570a_100011290941_100010339034 [0,1,0,0,0,0|1,0,1]=3 163 B10R1.35 C=Cc1nc(c(s1)CO)C 271570a_100011290941_100010264302 [0,1,0,0,0,0|1,0,2]=4 164 B10R1.35 C=Cc1sc(cc1C)C=O 271570a_100011290941_100000761930 [0,1,0,0,0,0|1,0,1]=3 165 B10R1.35 C=Cc1sc(nc1C)CC 271570a_100011290941_100010138847 [0,1,0,0,0,0|0,0,0]=1 166 B10R1.35 CCc1nc(c(s1)SC)C 62a_100010138847_200000210301 [0,1,0,0,0,0|1,0,1]=3 167 B10R1.35 CCc1nc(c(s1)SC)C 62a_200000210301_100010138847 [0,1,0,0,0,0|1,0,1]=3 168 B10R1.35 CCc1nc(c(s1)S[13CH3])C 62a_100010138847_200025704644 [0,1,0,0,0,0|1,0,1]=3 169 B10R1.35 CCc1nc(c(s1)S[13CH3])C 62a_200025704644_100010138847 [0,1,0,0,0,0|1,0,1]=3 170 B10R1.35 CNc1nc(c(s1)C=O)C 27a_100102657272_100010339034 [0,1,0,0,0,0|1,0,0]=2 171 B10R1.35 CSc1cc(c(s1)C=O)C 62a_100010221198_200000210301 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.35 CSc1cc(c(s1)C=O)C 62a_200000210301_100010221198 [0,1,0,0,0,0|2,0,0]=3 173 B10R1.35 CSc1nc(c(o1)C)C=O 62a_200000210301_200010262729 [0,1,0,0,0,0|3,0,0]=4 174 B10R1.35 CSc1nc(c(o1)C)C=O 62a_200010262729_200000210301 [0,1,0,0,0,0|3,0,0]=4 175 B10R1.35 CSc1nc(c(s1)C=O)C 62a_100010339034_200000210301 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.35 CSc1nc(c(s1)C=O)C 62a_200000210301_100010339034 [0,1,0,0,0,0|1,0,0]=2 177 B10R1.35 CSc1nc(c(s1)CO)C 62a_100010264302_200000210301 [0,1,0,0,0,0|1,0,1]=3 178 B10R1.35 CSc1nc(c(s1)CO)C 62a_200000210301_100010264302 [0,1,0,0,0,0|1,0,1]=3 179 B10R1.35 Cc1cc(sc1C=O)S[13CH3] 62a_100010221198_200025704644 [0,1,0,0,0,0|2,0,0]=3 180 B10R1.35 Cc1cc(sc1C=O)S[13CH3] 62a_200025704644_100010221198 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.35 Cc1nc(sc1C=O)S[13CH3] 62a_100010339034_200025704644 [0,1,0,0,0,0|1,0,0]=2 182 B10R1.35 Cc1nc(sc1C=O)S[13CH3] 62a_200025704644_100010339034 [0,1,0,0,0,0|1,0,0]=2 183 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_100010264302_200025704644 [0,1,0,0,0,0|1,0,1]=3 184 B10R1.35 Cc1nc(sc1CO)S[13CH3] 62a_200025704644_100010264302 [0,1,0,0,0,0|1,0,1]=3 185 B10R1.35 Cc1oc(nc1C=O)S[13CH3] 62a_200010262729_200025704644 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.35 Cc1oc(nc1C=O)S[13CH3] 62a_200025704644_200010262729 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.59 C=C(C)c1cc(nn1C)C 271570a_100000694244_100009818511 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.59 C=C(C)c1cc(nn1C)N 271570a_100000694244_100116209741 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.59 C=C(C)c1cc(sc1C)C 271570a_100000694244_100000688054 [0,1,0,0,0,0|2,0,0]=3 190 B10R1.59 C=C(C)c1cn(nc1C)C 271570a_100000694244_100011996311 [0,1,0,0,0,0|2,0,0]=3 191 B10R1.59 C=C(C)c1cn(nc1N)C 271570a_100000694244_100010776223 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.59 C=C(C)c1nc(cn1C)C 271570a_100000694244_100009816808 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.59 C=C(C)c1nc(sc1C)C 271570a_100000694244_100010270876 [0,1,0,0,0,0|2,0,0]=3 194 B10R1.59 C=C(C)c1nc(sc1C)N 271570a_100000694244_100009817509 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.59 C=C(C)c1nn(cc1C)C 271570a_100000694244_100012644376 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.59 C=C(C)c1nn(nc1C)C 271570a_100000694244_200009884731 [0,1,0,0,0,0|2,0,0]=3 197 B10R1.59 C=C(C)c1sc(cc1C)C 271570a_100000694244_100000689295 [0,1,0,0,0,0|1,0,0]=2 198 B10R1.59 C=C(C)c1sc(nc1C)C 271570a_100000694244_100009814099 [0,1,0,0,0,0|0,0,0]=1 199 B10R1.59 CC(=O)c1sc(nc1C)O 271570a_203496583355_100010106820 [0,1,0,0,0,0|1,0,1]=3 200 B10R1.130 C=C=Cc1cc(nn1C)C 271570a_100015277604_100009818511 [0,1,0,0,0,0|2,0,0]=3 201 B10R1.130 C=C=Cc1cc(nn1C)N 271570a_100015277604_100116209741 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.130 C=C=Cc1cc(sc1C)C 271570a_100015277604_100000688054 [0,1,0,0,0,0|2,0,0]=3 203 B10R1.130 C=C=Cc1cn(nc1C)C 271570a_100015277604_100011996311 [0,1,0,0,0,0|2,0,0]=3 204 B10R1.130 C=C=Cc1cn(nc1N)C 271570a_100015277604_100010776223 [0,1,0,0,0,0|3,0,0]=4 205 B10R1.130 C=C=Cc1nc(cn1C)C 271570a_100015277604_100009816808 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.130 C=C=Cc1nc(sc1C)C 271570a_100015277604_100010270876 [0,1,0,0,0,0|2,0,0]=3 207 B10R1.130 C=C=Cc1nc(sc1C)N 271570a_100015277604_100009817509 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.130 C=C=Cc1nn(cc1C)C 271570a_100015277604_100012644376 [0,1,0,0,0,0|3,0,0]=4 209 B10R1.130 C=C=Cc1nn(nc1C)C 271570a_100015277604_200009884731 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.130 C=C=Cc1sc(cc1C)C 271570a_100015277604_100000689295 [0,1,0,0,0,0|1,0,0]=2 211 B10R1.130 C=C=Cc1sc(nc1C)C 271570a_100015277604_100009814099 [0,1,0,0,0,0|0,0,0]=1 212 B10R1.130 CC=Cc1cc(nn1C)C 271570a_100016259895_100009818511 [0,1,0,0,0,0|2,0,0]=3 213 B10R1.130 CC=Cc1cc(nn1C)N 271570a_100016259895_100116209741 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.130 CC=Cc1cc(sc1C)C 271570a_100016259895_100000688054 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.130 CC=Cc1cn(nc1C)C 271570a_100016259895_100011996311 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.130 CC=Cc1cn(nc1N)C 271570a_100016259895_100010776223 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.130 CC=Cc1nc(cn1C)C 271570a_100016259895_100009816808 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.130 CC=Cc1nc(sc1C)C 271570a_100016259895_100010270876 [0,1,0,0,0,0|2,0,0]=3 219 B10R1.130 CC=Cc1nc(sc1C)N 271570a_100016259895_100009817509 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.130 CC=Cc1nn(cc1C)C 271570a_100016259895_100012644376 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.130 CC=Cc1nn(nc1C)C 271570a_100016259895_200009884731 [0,1,0,0,0,0|2,0,0]=3 222 B10R1.130 CC=Cc1sc(cc1C)C 271570a_100016259895_100000689295 [0,1,0,0,0,0|1,0,0]=2 223 B10R1.130 CC=Cc1sc(nc1C)C 271570a_100016259895_100009814099 [0,1,0,0,0,0|0,0,0]=1 224 B10R1.130 CCSc1sc(cc1C)C 62a_100000210202_100000689295 [0,1,0,0,0,0|1,0,2]=4 225 B10R1.130 CCSc1sc(cc1C)C 62a_100000689295_100000210202 [0,1,0,0,0,0|1,0,2]=4 226 B10R1.130 CCSc1sc(nc1C)C 62a_100000210202_100009814099 [0,1,0,0,0,0|0,0,2]=3 227 B10R1.130 CCSc1sc(nc1C)C 62a_100009814099_100000210202 [0,1,0,0,0,0|0,0,2]=3 228 B10R1.130 CCSc1sc(nc1C)N 62a_100000210202_100159269596 [0,1,0,0,0,0|1,0,2]=4 229 B10R1.130 CCSc1sc(nc1C)N 62a_100159269596_100000210202 [0,1,0,0,0,0|1,0,2]=4 230 B10R1.130 CNCc1oc(nc1C)C 207a_100102657272_100000734261 [0,1,0,0,0,0|0,1,2]=4 231 B10R1.130 CNCc1sc(nc1Br)C 2230a_106832991635_100015664652 [0,1,0,0,0,0|1,0,2]=4 232 B10R1.130 CNCc1sc(nc1Br)C 34a_100102657272_100015664652 [0,1,0,0,0,0|1,0,2]=4 233 B10R1.130 CNCc1sc(nc1Br)C 7a_106832991635_100015664652 [0,1,0,0,0,0|1,0,2]=4 234 B10R1.130 CNCc1sc(nc1C)C 207a_100102657272_100000757988 [0,1,0,0,0,0|0,0,2]=3 235 B10R1.130 CNCc1sc(nc1C)C 2230a_100000761763_200000210301 [0,1,0,0,0,0|0,0,2]=3 236 B10R1.130 CNCc1sc(nc1C)C 2230a_106832991635_100000760948 [0,1,0,0,0,0|0,0,2]=3 237 B10R1.130 CNCc1sc(nc1C)C 34a_100102657272_100000760948 [0,1,0,0,0,0|0,0,2]=3 238 B10R1.130 CNCc1sc(nc1C)C 7a_106832991635_100000760948 [0,1,0,0,0,0|0,0,2]=3 239 B10R1.130 COCc1sc(nc1Br)C 34a_100138415774_100015664652 [0,1,0,0,0,0|1,0,2]=4 240 B10R1.130 COCc1sc(nc1C)Br 7a_100010264302_200000210301 [0,1,0,0,0,0|1,0,2]=4 241 B10R1.130 COCc1sc(nc1C)C 34a_100000750043_200000210301 [0,1,0,0,0,0|0,0,2]=3 242 B10R1.130 COCc1sc(nc1C)C 34a_100138415774_100000760948 [0,1,0,0,0,0|0,0,2]=3 243 B10R1.130 COCc1sc(nc1C)C 7a_100000750043_200000210301 [0,1,0,0,0,0|0,0,2]=3 244 B10R1.130 CSCc1sc(nc1Br)C 62a_100015664652_200000210301 [0,1,0,0,0,0|1,0,2]=4 245 B10R1.130 CSCc1sc(nc1Br)C 62a_200000210301_100015664652 [0,1,0,0,0,0|1,0,2]=4 246 B10R1.130 CSCc1sc(nc1C)C 62a_100000760948_200000210301 [0,1,0,0,0,0|0,0,2]=3 247 B10R1.130 CSCc1sc(nc1C)C 62a_200000210301_100000760948 [0,1,0,0,0,0|0,0,2]=3 248 B10R1.130 Cc1cc(c(s1)SCF)C 62a_100000689295_100015361967 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.130 Cc1cc(c(s1)SCF)C 62a_100015361967_100000689295 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.130 Cc1nc(c(s1)CN[13CH3])C 2230a_100000761763_200025704644 [0,1,0,0,0,0|0,0,2]=3 251 B10R1.130 Cc1nc(c(s1)CO[13CH3])C 34a_100000750043_200025704644 [0,1,0,0,0,0|0,0,2]=3 252 B10R1.130 Cc1nc(c(s1)CO[13CH3])C 7a_100000750043_200025704644 [0,1,0,0,0,0|0,0,2]=3 253 B10R1.130 Cc1nc(c(s1)CS[13CH3])Br 62a_100015664652_200025704644 [0,1,0,0,0,0|1,0,2]=4 254 B10R1.130 Cc1nc(c(s1)CS[13CH3])Br 62a_200025704644_100015664652 [0,1,0,0,0,0|1,0,2]=4 255 B10R1.130 Cc1nc(c(s1)CS[13CH3])C 62a_100000760948_200025704644 [0,1,0,0,0,0|0,0,2]=3 256 B10R1.130 Cc1nc(c(s1)CS[13CH3])C 62a_200025704644_100000760948 [0,1,0,0,0,0|0,0,2]=3 257 B10R1.130 Cc1nc(c(s1)SCF)C 62a_100009814099_100015361967 [0,1,0,0,0,0|1,0,1]=3 258 B10R1.130 Cc1nc(c(s1)SCF)C 62a_100015361967_100009814099 [0,1,0,0,0,0|1,0,1]=3 259 B10R1.130 Cc1nc(sc1CO[13CH3])Br 7a_100010264302_200025704644 [0,1,0,0,0,0|1,0,2]=4 260 B10R1.130 Cc1nc(sc1SCF)N 62a_100015361967_100159269596 [0,1,0,0,0,0|2,0,1]=4 261 B10R1.130 Cc1nc(sc1SCF)N 62a_100159269596_100015361967 [0,1,0,0,0,0|2,0,1]=4 262 B10R1.256 C=Cc1c(nn(c1C)C)C 271570a_100011290941_100000239273 [0,1,0,0,0,0|2,0,0]=3 263 B10R2.2 Oc1cc2sccc2s1 271570a_203496583355_200010191111 [0,0,0,1,0,0|3,0,0]=4 264 B10R1.8 C=Cc1cc([nH]c(=O)c1)C 271570a_100011290941_100009861981 [0,0,0,0,0,1|2,0,1]=4 265 B10R1.8 C=Cc1cc(cc(c1)C)C 271570a_100011290941_100011215608 [0,0,0,0,0,1|2,0,0]=3 266 B10R1.8 C=Cc1cc(cc(c1)Cl)C 271570a_100011290941_100010172791 [0,0,0,0,0,1|3,0,0]=4 267 B10R1.8 C=Cc1cc(cc(c1)F)C 271570a_100011290941_100011356977 [0,0,0,0,0,1|3,0,0]=4 268 B10R1.8 C=Cc1cc(cc(c1)N)C 271570a_100011290941_100000695972 [0,0,0,0,0,1|3,0,0]=4 269 B10R1.8 C=Cc1cc(cc(c1)O)C 271570a_100011290941_100011999630 [0,0,0,0,0,1|3,0,0]=4 270 B10R1.8 C=Cc1cc(cc(n1)C)C 271570a_100011290941_100000069240 [0,0,0,0,0,1|2,0,0]=3 271 B10R1.8 C=Cc1cc(cc(n1)F)C 271570a_100011290941_100009819601 [0,0,0,0,0,1|3,0,0]=4 272 B10R1.8 C=Cc1cc(cc(n1)N)C 271570a_100011290941_100009819863 [0,0,0,0,0,1|3,0,0]=4 273 B10R1.8 C=Cc1cc(nc(c1)C)C 271570a_100011290941_100009816552 [0,0,0,0,0,1|1,0,0]=2 274 B10R1.8 C=Cc1cc(nc(c1)F)C 271570a_100011290941_100010006595 [0,0,0,0,0,1|2,0,0]=3 275 B10R1.8 C=Cc1cc(nc(c1)F)F 271570a_100011290941_100000049587 [0,0,0,0,0,1|3,0,0]=4 276 B10R1.8 C=Cc1cc(nc(c1)N)C 271570a_100011290941_100000076705 [0,0,0,0,0,1|2,0,0]=3 277 B10R1.8 C=Cc1cc(nc(c1)N)N 271570a_100011290941_100009816676 [0,0,0,0,0,1|3,0,0]=4 278 B10R1.8 C=Cc1cc(nc(n1)C)C 271570a_100011290941_100000736142 [0,0,0,0,0,1|1,0,0]=2 279 B10R1.8 C=Cc1cc(nc(n1)C)N 271570a_100011290941_100012178882 [0,0,0,0,0,1|2,0,0]=3 280 B10R1.8 C=Cc1cc(nc(n1)C)O 271570a_100011290941_106741647437 [0,0,0,0,0,1|2,0,0]=3 281 B10R1.8 C=Cc1cc(nc(n1)N)C 271570a_100011290941_100000183061 [0,0,0,0,0,1|2,0,0]=3 282 B10R1.8 C=Cc1cc(nc(n1)N)N 271570a_100011290941_100011177858 [0,0,0,0,0,1|3,0,0]=4 283 B10R1.8 C=Cc1cc(nc(n1)N)O 271570a_100011290941_100000694715 [0,0,0,0,0,1|3,0,0]=4 284 B10R1.8 C=Cc1nc(cc(n1)C)C 271570a_100011290941_100000736147 [0,0,0,0,0,1|2,0,0]=3 285 B10R1.8 C=Cc1nc(cc(n1)N)C 271570a_100011290941_100000687285 [0,0,0,0,0,1|3,0,0]=4 286 B10R1.8 C=Cc1nc(nc(n1)C)C 271570a_100011290941_100015468570 [0,0,0,0,0,1|1,0,0]=2 287 B10R1.8 C=Cc1nc(nc(n1)N)C 271570a_100011290941_200012022553 [0,0,0,0,0,1|2,0,0]=3 288 B10R1.8 CNc1cc(nc(c1)C)C 27a_100102657272_100000066820 [0,0,0,0,0,1|2,0,1]=4 289 B10R1.8 CNc1cc(nc(n1)C)C 27a_100102657272_100000736142 [0,0,0,0,0,1|2,0,1]=4 290 B10R1.8 CNc1nc(nc(n1)C)C 27a_100102657272_100015468570 [0,0,0,0,0,1|2,0,1]=4 291 B10R1.8 CSc1cc(nc(c1)C)C 62a_100000066820_200000210301 [0,0,0,0,0,1|2,0,1]=4 292 B10R1.8 CSc1cc(nc(c1)C)C 62a_200000210301_100000066820 [0,0,0,0,0,1|2,0,1]=4 293 B10R1.8 CSc1cc(nc(n1)C)C 62a_100000736142_200000210301 [0,0,0,0,0,1|2,0,1]=4 294 B10R1.8 CSc1cc(nc(n1)C)C 62a_200000210301_100000736142 [0,0,0,0,0,1|2,0,1]=4 295 B10R1.8 CSc1nc(nc(n1)C)C 62a_100015468570_200000210301 [0,0,0,0,0,1|2,0,1]=4 296 B10R1.8 CSc1nc(nc(n1)C)C 62a_200000210301_100015468570 [0,0,0,0,0,1|2,0,1]=4 297 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_100000066820_200025704644 [0,0,0,0,0,1|2,0,1]=4 298 B10R1.8 Cc1cc(cc(n1)C)S[13CH3] 62a_200025704644_100000066820 [0,0,0,0,0,1|2,0,1]=4 299 B10R1.8 Cc1cc(nc(n1)C)S[13CH3] 62a_100000736142_200025704644 [0,0,0,0,0,1|2,0,1]=4 300 B10R1.8 Cc1cc(nc(n1)C)S[13CH3] 62a_200025704644_100000736142 [0,0,0,0,0,1|2,0,1]=4 301 B10R1.8 Cc1nc(nc(n1)S[13CH3])C 62a_100015468570_200025704644 [0,0,0,0,0,1|2,0,1]=4 302 B10R1.8 Cc1nc(nc(n1)S[13CH3])C 62a_200025704644_100015468570 [0,0,0,0,0,1|2,0,1]=4 303 B10R1.25 C=Cc1c[nH]c(=O)nc1N 271570a_100011290941_100000050048 [0,0,0,0,0,1|3,0,0]=4 304 B10R1.25 C=Cc1ccc(cc1Br)C 271570a_100011290941_100009813563 [0,0,0,0,0,1|3,0,0]=4 305 B10R1.25 C=Cc1ccc(cc1C)Br 271570a_100011290941_100000701812 [0,0,0,0,0,1|3,0,0]=4 306 B10R1.25 C=Cc1ccc(cc1C)C 271570a_100011290941_100011217332 [0,0,0,0,0,1|2,0,0]=3 307 B10R1.25 C=Cc1ccc(cc1C)Cl 271570a_100011290941_100011219607 [0,0,0,0,0,1|3,0,0]=4 308 B10R1.25 C=Cc1ccc(cc1C)F 271570a_100011290941_100011205405 [0,0,0,0,0,1|3,0,0]=4 309 B10R1.25 C=Cc1ccc(cc1C)N 271570a_100011290941_100000210723 [0,0,0,0,0,1|3,0,0]=4 310 B10R1.25 C=Cc1ccc(cc1C)O 271570a_100011290941_100000729255 [0,0,0,0,0,1|3,0,0]=4 311 B10R1.25 C=Cc1ccc(cc1Cl)C 271570a_100011290941_100011263221 [0,0,0,0,0,1|3,0,0]=4 312 B10R1.25 C=Cc1ccc(cc1F)C 271570a_100011290941_100011216119 [0,0,0,0,0,1|3,0,0]=4 313 B10R1.25 C=Cc1ccc(cc1N)C 271570a_100011290941_100011216686 [0,0,0,0,0,1|3,0,0]=4 314 B10R1.25 C=Cc1ccc(cc1O)C 271570a_100011290941_100012002257 [0,0,0,0,0,1|3,0,0]=4 315 B10R1.25 C=Cc1ccc(nc1Br)N 271570a_100011290941_100010734177 [0,0,0,0,0,1|3,0,0]=4 316 B10R1.25 C=Cc1ccc(nc1C)C 271570a_100011290941_100009813853 [0,0,0,0,0,1|1,0,0]=2 317 B10R1.25 C=Cc1ccc(nc1C)Cl 271570a_100011290941_100000062408 [0,0,0,0,0,1|2,0,0]=3 318 B10R1.25 C=Cc1ccc(nc1C)F 271570a_100011290941_100000688911 [0,0,0,0,0,1|2,0,0]=3 319 B10R1.25 C=Cc1ccc(nc1C)N 271570a_100011290941_100000013003 [0,0,0,0,0,1|2,0,0]=3 320 B10R1.25 C=Cc1ccc(nc1C)O 271570a_100011290941_100000691680 [0,0,0,0,0,1|2,0,0]=3 321 B10R1.25 C=Cc1ccc(nc1Cl)Br 271570a_100011290941_100010246183 [0,0,0,0,0,1|3,0,0]=4 322 B10R1.25 C=Cc1ccc(nc1Cl)N 271570a_100011290941_100010270343 [0,0,0,0,0,1|3,0,0]=4 323 B10R1.25 C=Cc1ccc(nc1F)C 271570a_100011290941_100010006597 [0,0,0,0,0,1|2,0,0]=3 324 B10R1.25 C=Cc1ccc(nc1F)Cl 271570a_100011290941_100010168078 [0,0,0,0,0,1|3,0,0]=4 325 B10R1.25 C=Cc1ccc(nc1F)F 271570a_100011290941_100000070099 [0,0,0,0,0,1|3,0,0]=4 326 B10R1.25 C=Cc1ccc(nc1F)N 271570a_100011290941_100009882772 [0,0,0,0,0,1|3,0,0]=4 327 B10R1.25 C=Cc1ccc(nc1F)O 271570a_100011290941_100009879308 [0,0,0,0,0,1|3,0,0]=4 328 B10R1.25 C=Cc1ccc(nc1N)C 271570a_100011290941_100009816662 [0,0,0,0,0,1|2,0,0]=3 329 B10R1.25 C=Cc1ccc(nc1N)Cl 271570a_100011290941_100010171640 [0,0,0,0,0,1|3,0,0]=4 330 B10R1.25 C=Cc1ccc(nc1N)F 271570a_100011290941_100009854977 [0,0,0,0,0,1|3,0,0]=4 331 B10R1.25 C=Cc1ccc(nc1N)N 271570a_100011290941_100011356871 [0,0,0,0,0,1|3,0,0]=4 332 B10R1.25 C=Cc1ccc(nc1O)C 271570a_100011290941_100009817604 [0,0,0,0,0,1|2,0,0]=3 333 B10R1.25 C=Cc1cnc([nH]c1=O)C 271570a_100011290941_100011999157 [0,0,0,0,0,1|2,0,1]=4 334 B10R1.25 C=Cc1cnc(cc1C)Br 271570a_100011290941_100009816104 [0,0,0,0,0,1|3,0,0]=4 335 B10R1.25 C=Cc1cnc(cc1C)C 271570a_100011290941_100009819613 [0,0,0,0,0,1|2,0,0]=3 336 B10R1.25 C=Cc1cnc(cc1C)Cl 271570a_100011290941_100010172789 [0,0,0,0,0,1|3,0,0]=4 337 B10R1.25 C=Cc1cnc(cc1C)F 271570a_100011290941_100009820716 [0,0,0,0,0,1|3,0,0]=4 338 B10R1.25 C=Cc1cnc(cc1C)N 271570a_100011290941_100000050067 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.25 C=Cc1cnc(cc1C)O 271570a_100011290941_100010114363 [0,0,0,0,0,1|3,0,0]=4 340 B10R1.25 C=Cc1cnc(cc1N)C 271570a_100011290941_100009817891 [0,0,0,0,0,1|3,0,0]=4 341 B10R1.25 C=Cc1cnc(cc1O)C 271570a_100011290941_100011016184 [0,0,0,0,0,1|3,0,0]=4 342 B10R1.25 C=Cc1cnc(nc1C)N 271570a_100011290941_100000725598 [0,0,0,0,0,1|2,0,0]=3 343 B10R1.25 C=Cc1cnc(nc1F)F 271570a_100011290941_100009820707 [0,0,0,0,0,1|3,0,0]=4 344 B10R1.25 C=Cc1cnc(nc1N)C 271570a_100011290941_100000684960 [0,0,0,0,0,1|2,0,0]=3 345 B10R1.25 C=Cc1cnc(nc1N)N 271570a_100011290941_200010734216 [0,0,0,0,0,1|3,0,0]=4 346 B10R1.25 C=Cc1n[nH]c(=O)cc1C 271570a_100011290941_100000081757 [0,0,0,0,0,1|3,0,0]=4 347 B10R1.25 C=Cc1ncc(cc1C)Br 271570a_100011290941_100012353652 [0,0,0,0,0,1|3,0,0]=4 348 B10R1.25 C=Cc1ncc(cc1C)C 271570a_100011290941_100009864548 [0,0,0,0,0,1|2,0,0]=3 349 B10R1.25 C=Cc1ncc(cc1C)F 271570a_100011290941_100009817009 [0,0,0,0,0,1|3,0,0]=4 350 B10R1.25 C=Cc1ncc(cc1C)N 271570a_100011290941_100000761747 [0,0,0,0,0,1|3,0,0]=4 351 B10R1.25 C=Cc1ncc(cc1C)O 271570a_100011290941_100012000486 [0,0,0,0,0,1|3,0,0]=4 352 B10R1.25 C=Cc1ncc(cc1F)C 271570a_100011290941_100009819633 [0,0,0,0,0,1|3,0,0]=4 353 B10R1.25 C=Cc1ncc(cc1N)C 271570a_100011290941_100000733613 [0,0,0,0,0,1|3,0,0]=4 354 B10R1.25 C=Cc1ncc(cc1O)C 271570a_100011290941_100012000487 [0,0,0,0,0,1|3,0,0]=4 355 B10R1.25 C=Cc1ncc(nc1C)C 271570a_100011290941_100000065684 [0,0,0,0,0,1|1,0,0]=2 356 B10R1.25 C=Cc1ncc(nc1C)N 271570a_100011290941_100009818570 [0,0,0,0,0,1|2,0,0]=3 357 B10R1.25 C=Cc1nnc(cc1C)N 271570a_100011290941_100000123434 [0,0,0,0,0,1|3,0,0]=4 358 B10R1.25 COc1ccc(nc1C)C 34a_100011218912_200000210301 [0,0,0,0,0,1|2,0,1]=4 359 B10R1.25 COc1ccc(nc1C)C 7a_100011218912_200000210301 [0,0,0,0,0,1|2,0,1]=4 360 B10R1.25 COc1cnc(nc1C)C 34a_100009864123_200000210301 [0,0,0,0,0,1|2,0,1]=4 361 B10R1.25 COc1cnc(nc1C)C 7a_100009864123_200000210301 [0,0,0,0,0,1|2,0,1]=4 362 B10R1.25 CSc1ccc(nc1C)C 62a_100009813853_200000210301 [0,0,0,0,0,1|2,0,1]=4 363 B10R1.25 CSc1ccc(nc1C)C 62a_200000210301_100009813853 [0,0,0,0,0,1|2,0,1]=4 364 B10R1.25 CSc1ncc(nc1C)C 62a_100000065684_200000210301 [0,0,0,0,0,1|2,0,1]=4 365 B10R1.25 CSc1ncc(nc1C)C 62a_200000210301_100000065684 [0,0,0,0,0,1|2,0,1]=4 366 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 34a_100011218912_200025704644 [0,0,0,0,0,1|2,0,1]=4 367 B10R1.25 Cc1ccc(c(n1)C)O[13CH3] 7a_100011218912_200025704644 [0,0,0,0,0,1|2,0,1]=4 368 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_100009813853_200025704644 [0,0,0,0,0,1|2,0,1]=4 369 B10R1.25 Cc1ccc(c(n1)C)S[13CH3] 62a_200025704644_100009813853 [0,0,0,0,0,1|2,0,1]=4 370 B10R1.25 Cc1ccc(c(n1)O)C=O 271570a_203496583355_100000085379 [0,0,0,0,0,1|3,0,0]=4 371 B10R1.25 Cc1cnc(c(n1)C)S[13CH3] 62a_100000065684_200025704644 [0,0,0,0,0,1|2,0,1]=4 372 B10R1.25 Cc1cnc(c(n1)C)S[13CH3] 62a_200025704644_100000065684 [0,0,0,0,0,1|2,0,1]=4 373 B10R1.25 Cc1nc(ccc1C=O)O 271570a_203496583355_100000050599 [0,0,0,0,0,1|3,0,0]=4 374 B10R1.25 Cc1ncc(c(n1)C)O[13CH3] 34a_100009864123_200025704644 [0,0,0,0,0,1|2,0,1]=4 375 B10R1.25 Cc1ncc(c(n1)C)O[13CH3] 7a_100009864123_200025704644 [0,0,0,0,0,1|2,0,1]=4 376 B10R1.30 C=Cc1cc(ccc1Br)C 271570a_100011290941_100012353751 [0,0,0,0,0,1|3,0,0]=4 377 B10R1.30 C=Cc1cc(ccc1C)Br 271570a_100011290941_100011344865 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.30 C=Cc1cc(ccc1C)C 271570a_100011290941_100000210833 [0,0,0,0,0,1|2,0,0]=3 379 B10R1.30 C=Cc1cc(ccc1C)Cl 271570a_100011290941_100011263213 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.30 C=Cc1cc(ccc1C)F 271570a_100011290941_100011218078 [0,0,0,0,0,1|3,0,0]=4 381 B10R1.30 C=Cc1cc(ccc1C)N 271570a_100011290941_100000736455 [0,0,0,0,0,1|3,0,0]=4 382 B10R1.30 C=Cc1cc(ccc1C)O 271570a_100011290941_100011380479 [0,0,0,0,0,1|3,0,0]=4 383 B10R1.30 C=Cc1cc(ccc1Cl)C 271570a_100011290941_100012356289 [0,0,0,0,0,1|3,0,0]=4 384 B10R1.30 C=Cc1cc(ccc1F)C 271570a_100011290941_100000736223 [0,0,0,0,0,1|3,0,0]=4 385 B10R1.30 C=Cc1cc(ccc1N)C 271570a_100011290941_100000210942 [0,0,0,0,0,1|3,0,0]=4 386 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [0,0,0,0,0,1|3,0,0]=4 387 B10R1.30 C=Cc1cc(cnc1Br)N 271570a_100011290941_100010201102 [0,0,0,0,0,1|3,0,0]=4 388 B10R1.30 C=Cc1cc(cnc1C)Br 271570a_100011290941_200010090566 [0,0,0,0,0,1|2,0,0]=3 389 B10R1.30 C=Cc1cc(cnc1C)C 271570a_100011290941_100009817436 [0,0,0,0,0,1|1,0,0]=2 390 B10R1.30 C=Cc1cc(cnc1C)F 271570a_100011290941_100009860710 [0,0,0,0,0,1|2,0,0]=3 391 B10R1.30 C=Cc1cc(cnc1C)N 271570a_100011290941_100011998591 [0,0,0,0,0,1|2,0,0]=3 392 B10R1.30 C=Cc1cc(cnc1C)O 271570a_100011290941_100009819603 [0,0,0,0,0,1|2,0,0]=3 393 B10R1.30 C=Cc1cc(cnc1Cl)Br 271570a_100011290941_100009814771 [0,0,0,0,0,1|3,0,0]=4 394 B10R1.30 C=Cc1cc(cnc1Cl)C 271570a_100011290941_100010210167 [0,0,0,0,0,1|2,0,0]=3 395 B10R1.30 C=Cc1cc(cnc1Cl)Cl 271570a_100011290941_200000062399 [0,0,0,0,0,1|3,0,0]=4 396 B10R1.30 C=Cc1cc(cnc1Cl)N 271570a_100011290941_100010253917 [0,0,0,0,0,1|3,0,0]=4 397 B10R1.30 C=Cc1cc(cnc1F)Br 271570a_100011290941_100010172738 [0,0,0,0,0,1|3,0,0]=4 398 B10R1.30 C=Cc1cc(cnc1F)C 271570a_100011290941_100000049784 [0,0,0,0,0,1|2,0,0]=3 399 B10R1.30 C=Cc1cc(cnc1F)Cl 271570a_100011290941_100010188783 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.30 C=Cc1cc(cnc1F)F 271570a_100011290941_100009820768 [0,0,0,0,0,1|3,0,0]=4 401 B10R1.30 C=Cc1cc(cnc1F)N 271570a_100011290941_100009840397 [0,0,0,0,0,1|3,0,0]=4 402 B10R1.30 C=Cc1cc(cnc1F)O 271570a_100011290941_100009817267 [0,0,0,0,0,1|3,0,0]=4 403 B10R1.30 C=Cc1cc(cnc1N)Br 271570a_100011290941_100000760472 [0,0,0,0,0,1|3,0,0]=4 404 B10R1.30 C=Cc1cc(cnc1N)C 271570a_100011290941_100000049664 [0,0,0,0,0,1|2,0,0]=3 405 B10R1.30 C=Cc1cc(cnc1N)Cl 271570a_100011290941_100000050159 [0,0,0,0,0,1|3,0,0]=4 406 B10R1.30 C=Cc1cc(cnc1N)F 271570a_100011290941_100009814671 [0,0,0,0,0,1|3,0,0]=4 407 B10R1.30 C=Cc1cc(cnc1N)N 271570a_100011290941_200011934315 [0,0,0,0,0,1|3,0,0]=4 408 B10R1.30 C=Cc1cc(cnc1O)Br 271570a_100011290941_100010197142 [0,0,0,0,0,1|3,0,0]=4 409 B10R1.30 C=Cc1cc(cnc1O)C 271570a_100011290941_100000049931 [0,0,0,0,0,1|2,0,0]=3 410 B10R1.30 C=Cc1cc(cnc1O)Cl 271570a_100011290941_100010188700 [0,0,0,0,0,1|3,0,0]=4 411 B10R1.30 C=Cc1cc(n[nH]c1=O)C 271570a_100011290941_100009819039 [0,0,0,0,0,1|2,0,0]=3 412 B10R1.30 C=Cc1cc(ncc1Br)Br 271570a_100011290941_100010171693 [0,0,0,0,0,1|3,0,0]=4 413 B10R1.30 C=Cc1cc(ncc1Br)Cl 271570a_100011290941_100009815598 [0,0,0,0,0,1|3,0,0]=4 414 B10R1.30 C=Cc1cc(ncc1C)Br 271570a_100011290941_100010067628 [0,0,0,0,0,1|2,0,0]=3 415 B10R1.30 C=Cc1cc(ncc1C)C 271570a_100011290941_100009862788 [0,0,0,0,0,1|1,0,0]=2 416 B10R1.30 C=Cc1cc(ncc1C)Cl 271570a_100011290941_100010068021 [0,0,0,0,0,1|2,0,0]=3 417 B10R1.30 C=Cc1cc(ncc1C)F 271570a_100011290941_100000049870 [0,0,0,0,0,1|2,0,0]=3 418 B10R1.30 C=Cc1cc(ncc1C)N 271570a_100011290941_100009819938 [0,0,0,0,0,1|2,0,0]=3 419 B10R1.30 C=Cc1cc(ncc1C)O 271570a_100011290941_100009831917 [0,0,0,0,0,1|2,0,0]=3 420 B10R1.30 C=Cc1cc(ncc1Cl)Br 271570a_100011290941_100010223331 [0,0,0,0,0,1|3,0,0]=4 421 B10R1.30 C=Cc1cc(ncc1Cl)Cl 271570a_100011290941_100010172835 [0,0,0,0,0,1|3,0,0]=4 422 B10R1.30 C=Cc1cc(ncc1Cl)F 271570a_100011290941_100009892587 [0,0,0,0,0,1|3,0,0]=4 423 B10R1.30 C=Cc1cc(ncc1Cl)N 271570a_100011290941_100010134119 [0,0,0,0,0,1|3,0,0]=4 424 B10R1.30 C=Cc1cc(ncc1F)Br 271570a_100011290941_100010193852 [0,0,0,0,0,1|3,0,0]=4 425 B10R1.30 C=Cc1cc(ncc1F)C 271570a_100011290941_100009867690 [0,0,0,0,0,1|2,0,0]=3 426 B10R1.30 C=Cc1cc(ncc1F)Cl 271570a_100011290941_100000708277 [0,0,0,0,0,1|3,0,0]=4 427 B10R1.30 C=Cc1cc(ncc1F)F 271570a_100011290941_100010233071 [0,0,0,0,0,1|3,0,0]=4 428 B10R1.30 C=Cc1cc(ncc1F)N 271570a_100011290941_100015713587 [0,0,0,0,0,1|3,0,0]=4 429 B10R1.30 C=Cc1cc(ncc1N)Cl 271570a_100011290941_100000050123 [0,0,0,0,0,1|3,0,0]=4 430 B10R1.30 C=Cc1cc(ncc1O)C 271570a_100011290941_100009843476 [0,0,0,0,0,1|2,0,0]=3 431 B10R1.30 C=Cc1cc(ncc1O)Cl 271570a_100011290941_100000698892 [0,0,0,0,0,1|3,0,0]=4 432 B10R1.30 C=Cc1cc(nnc1O)O 271570a_100011290941_100000759565 [0,0,0,0,0,1|3,0,0]=4 433 B10R1.30 C=Cc1nc(c[nH]c1=O)C 271570a_100011290941_100009858157 [0,0,0,0,0,1|2,0,1]=4 434 B10R1.30 C=Cc1nc(ccc1C)C 271570a_100011290941_100009854376 [0,0,0,0,0,1|2,0,0]=3 435 B10R1.30 C=Cc1nc(ccc1C)N 271570a_100011290941_100000126722 [0,0,0,0,0,1|3,0,0]=4 436 B10R1.30 C=Cc1nc(ccc1F)C 271570a_100011290941_100009817602 [0,0,0,0,0,1|3,0,0]=4 437 B10R1.30 C=Cc1nc(ccc1N)C 271570a_100011290941_100000685570 [0,0,0,0,0,1|3,0,0]=4 438 B10R1.30 C=Cc1nc(ccc1O)C 271570a_100011290941_100000702858 [0,0,0,0,0,1|3,0,0]=4 439 B10R1.30 C=Cc1nc(cnc1C)C 271570a_100011290941_100000211308 [0,0,0,0,0,1|1,0,0]=2 440 B10R1.30 C=Cc1nc(cnc1C)N 271570a_100011290941_100009877824 [0,0,0,0,0,1|2,0,0]=3 441 B10R1.30 C=Cc1nc(cnc1N)Br 271570a_100011290941_100010988662 [0,0,0,0,0,1|3,0,0]=4 442 B10R1.30 C=Cc1nc(cnc1N)C 271570a_100011290941_100009819049 [0,0,0,0,0,1|2,0,0]=3 443 B10R1.30 C=Cc1nc(ncc1C)N 271570a_100011290941_100000016107 [0,0,0,0,0,1|2,0,0]=3 444 B10R1.30 C=Cc1nc(ncc1F)C 271570a_100011290941_100000059819 [0,0,0,0,0,1|2,0,0]=3 445 B10R1.30 C=Cc1nc(ncc1F)N 271570a_100011290941_200000093006 [0,0,0,0,0,1|3,0,0]=4 446 B10R1.30 C=Cc1nc(ncc1N)C 271570a_100011290941_100009873743 [0,0,0,0,0,1|2,0,0]=3 447 B10R1.30 CNc1nc(cnc1C)C 27a_100102657272_100000211308 [0,0,0,0,0,1|2,0,1]=4 448 B10R1.30 CSc1cc(cnc1C)C 62a_100009817436_200000210301 [0,0,0,0,0,1|2,0,1]=4 449 B10R1.30 CSc1cc(cnc1C)C 62a_200000210301_100009817436 [0,0,0,0,0,1|2,0,1]=4 450 B10R1.30 CSc1cc(ncc1C)C 62a_100009862788_200000210301 [0,0,0,0,0,1|2,0,1]=4 451 B10R1.30 CSc1cc(ncc1C)C 62a_200000210301_100009862788 [0,0,0,0,0,1|2,0,1]=4 452 B10R1.30 CSc1nc(cnc1C)C 62a_100000211308_200000210301 [0,0,0,0,0,1|2,0,1]=4 453 B10R1.30 CSc1nc(cnc1C)C 62a_200000210301_100000211308 [0,0,0,0,0,1|2,0,1]=4 454 B10R1.30 Cc1cc(c(cn1)C)S[13CH3] 62a_100009862788_200025704644 [0,0,0,0,0,1|2,0,1]=4 455 B10R1.30 Cc1cc(c(cn1)C)S[13CH3] 62a_200025704644_100009862788 [0,0,0,0,0,1|2,0,1]=4 456 B10R1.30 Cc1cnc(c(c1)C=O)O 271570a_203496583355_100000050350 [0,0,0,0,0,1|3,0,0]=4 457 B10R1.30 Cc1cnc(c(c1)S[13CH3])C 62a_100009817436_200025704644 [0,0,0,0,0,1|2,0,1]=4 458 B10R1.30 Cc1cnc(c(c1)S[13CH3])C 62a_200025704644_100009817436 [0,0,0,0,0,1|2,0,1]=4 459 B10R1.30 Cc1cnc(c(n1)S[13CH3])C 62a_100000211308_200025704644 [0,0,0,0,0,1|2,0,1]=4 460 B10R1.30 Cc1cnc(c(n1)S[13CH3])C 62a_200025704644_100000211308 [0,0,0,0,0,1|2,0,1]=4 461 B7R1.1 C=Cc1c[nH]cn1 271570a_100011290941_100000756875 [2,0,0,0,0,0|1,0,1]=4 462 B7R1.1 C=Cc1ccco1 271570a_100011290941_100009814098 [2,0,0,0,0,0|1,1,0]=4 463 B7R1.1 C=Cc1cccs1 271570a_100011290941_100011215356 [2,0,0,0,0,0|1,0,0]=3 464 B7R1.1 C=Cc1ccoc1 271570a_100011290941_100011215275 [2,0,0,0,0,0|2,0,0]=4 465 B7R1.1 C=Cc1ccsc1 271570a_100011290941_100000738268 [2,0,0,0,0,0|2,0,0]=4 466 B7R1.1 C=Cc1cn[nH]c1 271570a_100011290941_100000238712 [2,0,0,0,0,0|2,0,0]=4 467 B7R1.1 C=Cc1cnco1 271570a_100011290941_100020591547 [2,0,0,0,0,0|0,1,0]=3 468 B7R1.1 C=Cc1cncs1 271570a_100011290941_100011934649 [2,0,0,0,0,0|0,0,0]=2 469 B7R1.1 C=Cc1cnoc1 271570a_100011290941_100009815712 [2,0,0,0,0,0|2,0,0]=4 470 B7R1.1 C=Cc1cnsc1 271570a_100011290941_100009815736 [2,0,0,0,0,0|2,0,0]=4 471 B7R1.1 C=Cc1cscn1 271570a_100011290941_100000751502 [2,0,0,0,0,0|2,0,0]=4 472 B7R1.1 C=Cc1nccs1 271570a_100011290941_100000211983 [2,0,0,0,0,0|2,0,0]=4 473 B7R1.1 C=Cc1ncns1 271570a_100011290941_100000693119 [2,0,0,0,0,0|2,0,0]=4 474 B7R1.1 C=Cc1nncs1 271570a_100011290941_100000739804 [2,0,0,0,0,0|1,0,0]=3 475 B7R1.1 CSc1cncs1 62a_100011934649_200000210301 [2,0,0,0,0,0|1,0,1]=4 476 B7R1.1 CSc1cncs1 62a_200000210301_100011934649 [2,0,0,0,0,0|1,0,1]=4 477 B7R1.1 [13CH3]Sc1cncs1 62a_100011934649_200025704644 [2,0,0,0,0,0|1,0,1]=4 478 B7R1.1 [13CH3]Sc1cncs1 62a_200025704644_100011934649 [2,0,0,0,0,0|1,0,1]=4 479 B7R1.2 Cc1c[nH]c(n1)O 271570a_203496583355_100161115468 [2,0,0,0,0,0|2,0,0]=4 480 B7R1.2 Cc1cc(cs1)O 271570a_203496583355_100000759034 [2,0,0,0,0,0|2,0,0]=4 481 B7R1.2 Cc1ccc(s1)O 271570a_203496583355_100000761539 [2,0,0,0,0,0|2,0,0]=4 482 B7R1.2 Cc1cnc(s1)O 271570a_203496583355_100000690809 [2,0,0,0,0,0|1,0,1]=4 483 B7R1.2 Cc1csc(c1)O 271570a_203496583355_100009876951 [2,0,0,0,0,0|2,0,0]=4 484 B7R1.2 Cc1csc(n1)O 271570a_203496583355_100011291629 [2,0,0,0,0,0|1,0,0]=3 485 B7R1.2 Cc1nc(c[nH]1)O 271570a_203496583355_100009814057 [2,0,0,0,0,0|2,0,0]=4 486 B7R1.2 Cc1nc(cs1)O 271570a_203496583355_100011934587 [2,0,0,0,0,0|1,0,0]=3 487 B7R1.2 Cc1ncc(s1)O 271570a_203496583355_100000764884 [2,0,0,0,0,0|1,0,0]=3 488 B7R1.2 Cc1nnc(s1)O 271570a_203496583355_100000686958 [2,0,0,0,0,0|2,0,0]=4 489 B7R1.2 Cc1noc(n1)C 270196a_100000212224_100000070787 [2,0,0,0,0,0|1,1,0]=4 490 B7R1.2 Cc1nsc(n1)O 271570a_203496583355_100000709739 [2,0,0,0,0,0|2,0,0]=4 491 B7R1.2 Nc1csc(n1)O 271570a_203496583355_200015188442 [2,0,0,0,0,0|2,0,0]=4 492 B7R1.2 Nc1nc(cs1)O 271570a_203496583355_100011998049 [2,0,0,0,0,0|2,0,0]=4 493 B7R1.2 Oc1nc(cs1)Br 271570a_203496583355_200016082925 [2,0,0,0,0,0|2,0,0]=4 494 B7R1.4 Cc1ccsc1O 271570a_203496583355_100000742657 [2,0,0,0,0,0|2,0,0]=4 495 B7R1.4 Cc1ncsc1O 271570a_203496583355_100009817116 [2,0,0,0,0,0|1,0,0]=3 496 B7R1.4 Cc1scnc1O 271570a_203496583355_100000732656 [2,0,0,0,0,0|1,0,1]=4 497 B9R1.7 C=C=Cc1c[nH]c(n1)C 271570a_100015277604_100009814057 [1,1,0,0,0,0|1,0,1]=4 498 B9R1.7 C=C=Cc1cc(ns1)C 271570a_100015277604_100009815735 [1,1,0,0,0,0|2,0,0]=4 499 B9R1.7 C=C=Cc1ccc(s1)Br 271570a_100015277604_100010197418 [1,1,0,0,0,0|2,0,0]=4 500 B9R1.7 C=C=Cc1ccc(s1)C 271570a_100015277604_100000761539 [1,1,0,0,0,0|1,0,0]=3 501 B9R1.7 C=C=Cc1cnc(s1)C 271570a_100015277604_100000764884 [1,1,0,0,0,0|0,0,0]=2 502 B9R1.7 C=C=Cc1cnn(c1)C 271570a_100015277604_100000748075 [1,1,0,0,0,0|2,0,0]=4 503 B9R1.7 C=C=Cc1cnn(n1)C 271570a_100015277604_100000733932 [1,1,0,0,0,0|2,0,0]=4 504 B9R1.7 C=C=Cc1csc(c1)C 271570a_100015277604_100000759034 [1,1,0,0,0,0|2,0,0]=4 505 B9R1.7 C=C=Cc1csc(n1)C 271570a_100015277604_100011934587 [1,1,0,0,0,0|2,0,0]=4 506 B9R1.7 C=C=Cc1nc(ns1)C 271570a_100015277604_100000709739 [1,1,0,0,0,0|2,0,0]=4 507 B9R1.7 C=C=Cc1ncc(s1)C 271570a_100015277604_100000690809 [1,1,0,0,0,0|2,0,0]=4 508 B9R1.7 C=C=Cc1nnc(o1)C 271570a_100015277604_100000708914 [1,1,0,0,0,0|1,1,0]=4 509 B9R1.7 C=C=Cc1nnc(s1)C 271570a_100015277604_100000686958 [1,1,0,0,0,0|1,0,0]=3 510 B9R1.7 C=C=Cc1nnc(s1)N 271570a_100015277604_100000738278 [1,1,0,0,0,0|2,0,0]=4 511 B9R1.7 CC=Cc1c[nH]c(n1)C 271570a_100016259895_100009814057 [1,1,0,0,0,0|1,0,1]=4 512 B9R1.7 CC=Cc1cc(ns1)C 271570a_100016259895_100009815735 [1,1,0,0,0,0|2,0,0]=4 513 B9R1.7 CC=Cc1ccc(s1)Br 271570a_100016259895_100010197418 [1,1,0,0,0,0|2,0,0]=4 514 B9R1.7 CC=Cc1ccc(s1)C 271570a_100016259895_100000761539 [1,1,0,0,0,0|1,0,0]=3 515 B9R1.7 CC=Cc1cnc(s1)C 271570a_100016259895_100000764884 [1,1,0,0,0,0|0,0,0]=2 516 B9R1.7 CC=Cc1cnn(c1)C 271570a_100016259895_100000748075 [1,1,0,0,0,0|2,0,0]=4 517 B9R1.7 CC=Cc1cnn(n1)C 271570a_100016259895_100000733932 [1,1,0,0,0,0|2,0,0]=4 518 B9R1.7 CC=Cc1csc(c1)C 271570a_100016259895_100000759034 [1,1,0,0,0,0|2,0,0]=4 519 B9R1.7 CC=Cc1csc(n1)C 271570a_100016259895_100011934587 [1,1,0,0,0,0|2,0,0]=4 520 B9R1.7 CC=Cc1nc(no1)C 270196a_100000212224_100000210699 [1,1,0,0,0,0|2,0,0]=4 521 B9R1.7 CC=Cc1nc(ns1)C 271570a_100016259895_100000709739 [1,1,0,0,0,0|2,0,0]=4 522 B9R1.7 CC=Cc1ncc(s1)C 271570a_100016259895_100000690809 [1,1,0,0,0,0|2,0,0]=4 523 B9R1.7 CC=Cc1nnc(o1)C 271570a_100016259895_100000708914 [1,1,0,0,0,0|1,1,0]=4 524 B9R1.7 CC=Cc1nnc(s1)C 271570a_100016259895_100000686958 [1,1,0,0,0,0|1,0,0]=3 525 B9R1.7 CC=Cc1nnc(s1)N 271570a_100016259895_100000738278 [1,1,0,0,0,0|2,0,0]=4 526 B9R1.7 CCSc1cnc(s1)C 62a_100000210202_100000764884 [1,1,0,0,0,0|0,0,2]=4 527 B9R1.7 CCSc1cnc(s1)C 62a_100000764884_100000210202 [1,1,0,0,0,0|0,0,2]=4 528 B9R1.7 CNCc1cnc(s1)C 207a_100102657272_100000740557 [1,1,0,0,0,0|0,0,2]=4 529 B9R1.7 CNCc1cnc(s1)C 2230a_106832991635_100020635045 [1,1,0,0,0,0|0,0,2]=4 530 B9R1.7 CNCc1cnc(s1)C 2230a_200000743601_200000210301 [1,1,0,0,0,0|0,0,2]=4 531 B9R1.7 CNCc1cnc(s1)C 270004a_106832991635_100000740557 [1,1,0,0,0,0|0,0,2]=4 532 B9R1.7 CNCc1cnc(s1)C 34a_100102657272_100020635045 [1,1,0,0,0,0|0,0,2]=4 533 B9R1.7 CNCc1cnc(s1)C 7a_106832991635_100020635045 [1,1,0,0,0,0|0,0,2]=4 534 B9R1.7 COCc1cnc(s1)C 34a_100138415774_100020635045 [1,1,0,0,0,0|0,0,2]=4 535 B9R1.7 COCc1cnc(s1)C 7a_100000743366_200000210301 [1,1,0,0,0,0|0,0,2]=4 536 B9R1.7 CSCc1cnc(s1)C 62a_100020635045_200000210301 [1,1,0,0,0,0|0,0,2]=4 537 B9R1.7 CSCc1cnc(s1)C 62a_200000210301_100020635045 [1,1,0,0,0,0|0,0,2]=4 538 B9R1.7 Cc1ncc(s1)CN[13CH3] 2230a_200000743601_200025704644 [1,1,0,0,0,0|0,0,2]=4 539 B9R1.7 Cc1ncc(s1)CO[13CH3] 7a_100000743366_200025704644 [1,1,0,0,0,0|0,0,2]=4 540 B9R1.7 Cc1ncc(s1)CS[13CH3] 62a_100020635045_200025704644 [1,1,0,0,0,0|0,0,2]=4 541 B9R1.7 Cc1ncc(s1)CS[13CH3] 62a_200025704644_100020635045 [1,1,0,0,0,0|0,0,2]=4 542 B9R1.7 Cc1ncc(s1)SCF 62a_100000764884_100015361967 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.7 Cc1ncc(s1)SCF 62a_100015361967_100000764884 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.21 C=Cc1ccc(o1)CN 271570a_100011290941_100000708654 [1,1,0,0,0,0|1,1,0]=4 545 B9R1.21 C=Cc1ccc(o1)CO 271570a_100011290941_100000246276 [1,1,0,0,0,0|1,1,0]=4 546 B9R1.21 C=Cc1ccc(s1)C#N 271570a_100011290941_100000737243 [1,1,0,0,0,0|1,0,1]=4 547 B9R1.21 C=Cc1ccc(s1)C=O 271570a_100011290941_100000179771 [1,1,0,0,0,0|1,0,1]=4 548 B9R1.21 C=Cc1ccc(s1)CC 271570a_100011290941_100009844052 [1,1,0,0,0,0|1,0,0]=3 549 B9R1.21 C=Cc1ccc(s1)CN 271570a_100011290941_100000737305 [1,1,0,0,0,0|1,0,0]=3 550 B9R1.21 C=Cc1ccc(s1)CO 271570a_100011290941_100000246291 [1,1,0,0,0,0|1,0,0]=3 551 B9R1.21 C=Cc1cnc(s1)C=O 271570a_100011290941_100000699580 [1,1,0,0,0,0|0,0,1]=3 552 B9R1.21 C=Cc1cnc(s1)CN 271570a_100011290941_100016991807 [1,1,0,0,0,0|0,0,0]=2 553 B9R1.21 C=Cc1cnc(s1)CO 271570a_100011290941_100000696694 [1,1,0,0,0,0|0,0,0]=2 554 B9R1.21 C=Cc1cnc(s1)OC 271570a_100011290941_100000729428 [1,1,0,0,0,0|0,0,0]=2 555 B9R1.21 C=Cc1cnn(c1)CC 271570a_100011290941_100011400201 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.21 C=Cc1csc(c1)CC 271570a_100011290941_100009846239 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.21 C=Cc1csc(c1)CO 271570a_100011290941_100000238369 [1,1,0,0,0,0|2,0,0]=4 558 B9R1.21 C=Cc1csc(c1)SC 271570a_100011290941_200010256830 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.21 C=Cc1csc(n1)CO 271570a_100011290941_100012000107 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.21 C=Cc1csc(n1)OC 271570a_100011290941_100000727839 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.21 C=Cc1csc(n1)SC 271570a_100011290941_100000732701 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.21 C=Cc1ncc(s1)C=O 271570a_100011290941_100009814069 [1,1,0,0,0,0|1,0,1]=4 563 B9R1.21 C=Cc1ncc(s1)CN 271570a_100011290941_100000726991 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.21 C=Cc1ncc(s1)CO 271570a_100011290941_100009816753 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.21 C=Cc1nnc(s1)NC 271570a_100011290941_200012111945 [1,1,0,0,0,0|1,0,0]=3 566 B9R1.21 CNc1ncc(s1)C#N 27a_100102657272_100009819632 [1,1,0,0,0,0|1,0,1]=4 567 B9R1.21 CNc1ncc(s1)C=O 27a_100102657272_100009814069 [1,1,0,0,0,0|1,0,0]=3 568 B9R1.21 COc1ncc(s1)SC 62a_100000729428_200000210301 [1,1,0,0,0,0|1,0,1]=4 569 B9R1.21 COc1ncc(s1)SC 62a_200000210301_100000729428 [1,1,0,0,0,0|1,0,1]=4 570 B9R1.21 COc1ncc(s1)S[13CH3] 62a_100000729428_200025704644 [1,1,0,0,0,0|1,0,1]=4 571 B9R1.21 COc1ncc(s1)S[13CH3] 62a_200025704644_100000729428 [1,1,0,0,0,0|1,0,1]=4 572 B9R1.21 CSc1ccc(s1)C=O 62a_100000179771_200000210301 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.21 CSc1ccc(s1)C=O 62a_200000210301_100000179771 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.21 CSc1cnc(s1)CN 62a_100016991807_200000210301 [1,1,0,0,0,0|1,0,1]=4 575 B9R1.21 CSc1cnc(s1)CN 62a_200000210301_100016991807 [1,1,0,0,0,0|1,0,1]=4 576 B9R1.21 CSc1cnc(s1)CO 62a_100000696694_200000210301 [1,1,0,0,0,0|1,0,1]=4 577 B9R1.21 CSc1cnc(s1)CO 62a_200000210301_100000696694 [1,1,0,0,0,0|1,0,1]=4 578 B9R1.21 CSc1ncc(s1)C#N 62a_200000210301_100009819632 [1,1,0,0,0,0|1,0,1]=4 579 B9R1.21 CSc1ncc(s1)C=O 62a_100009814069_200000210301 [1,1,0,0,0,0|1,0,0]=3 580 B9R1.21 CSc1ncc(s1)C=O 62a_200000210301_100009814069 [1,1,0,0,0,0|1,0,0]=3 581 B9R1.21 CSc1ncc(s1)CN 62a_100000726991_200000210301 [1,1,0,0,0,0|1,0,1]=4 582 B9R1.21 CSc1ncc(s1)CN 62a_200000210301_100000726991 [1,1,0,0,0,0|1,0,1]=4 583 B9R1.21 CSc1ncc(s1)CO 62a_100009816753_200000210301 [1,1,0,0,0,0|1,0,1]=4 584 B9R1.21 CSc1ncc(s1)CO 62a_200000210301_100009816753 [1,1,0,0,0,0|1,0,1]=4 585 B9R1.21 [13CH3]Sc1ccc(s1)C=O 62a_100000179771_200025704644 [1,1,0,0,0,0|2,0,0]=4 586 B9R1.21 [13CH3]Sc1ccc(s1)C=O 62a_200025704644_100000179771 [1,1,0,0,0,0|2,0,0]=4 587 B9R1.21 [13CH3]Sc1cnc(s1)CN 62a_100016991807_200025704644 [1,1,0,0,0,0|1,0,1]=4 588 B9R1.21 [13CH3]Sc1cnc(s1)CN 62a_200025704644_100016991807 [1,1,0,0,0,0|1,0,1]=4 589 B9R1.21 [13CH3]Sc1cnc(s1)CO 62a_100000696694_200025704644 [1,1,0,0,0,0|1,0,1]=4 590 B9R1.21 [13CH3]Sc1cnc(s1)CO 62a_200025704644_100000696694 [1,1,0,0,0,0|1,0,1]=4 591 B9R1.21 [13CH3]Sc1ncc(s1)C#N 62a_200025704644_100009819632 [1,1,0,0,0,0|1,0,1]=4 592 B9R1.21 [13CH3]Sc1ncc(s1)C=O 62a_100009814069_200025704644 [1,1,0,0,0,0|1,0,0]=3 593 B9R1.21 [13CH3]Sc1ncc(s1)C=O 62a_200025704644_100009814069 [1,1,0,0,0,0|1,0,0]=3 594 B9R1.21 [13CH3]Sc1ncc(s1)CN 62a_100000726991_200025704644 [1,1,0,0,0,0|1,0,1]=4 595 B9R1.21 [13CH3]Sc1ncc(s1)CN 62a_200025704644_100000726991 [1,1,0,0,0,0|1,0,1]=4 596 B9R1.21 [13CH3]Sc1ncc(s1)CO 62a_100009816753_200025704644 [1,1,0,0,0,0|1,0,1]=4 597 B9R1.21 [13CH3]Sc1ncc(s1)CO 62a_200025704644_100009816753 [1,1,0,0,0,0|1,0,1]=4 598 B9R1.23 C=Cc1cc(c(s1)C)C 271570a_100011290941_100009850898 [1,1,0,0,0,0|1,0,0]=3 599 B9R1.23 C=Cc1cn(c(n1)C)C 271570a_100011290941_100000684932 [1,1,0,0,0,0|1,0,1]=4 600 B9R1.23 C=Cc1nc(c(s1)C)C 271570a_100011290941_100000765934 [1,1,0,0,0,0|2,0,0]=4 601 B9R1.23 Cc1sc(cc1O)C=O 271570a_203496583355_100000708457 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.35 C=C(C)c1c[nH]c(n1)C 271570a_100000694244_100009814057 [1,1,0,0,0,0|1,0,1]=4 603 B9R1.35 C=C(C)c1cc(ns1)C 271570a_100000694244_100009815735 [1,1,0,0,0,0|2,0,0]=4 604 B9R1.35 C=C(C)c1ccc(s1)Br 271570a_100000694244_100010197418 [1,1,0,0,0,0|2,0,0]=4 605 B9R1.35 C=C(C)c1ccc(s1)C 271570a_100000694244_100000761539 [1,1,0,0,0,0|1,0,0]=3 606 B9R1.35 C=C(C)c1cnc(s1)C 271570a_100000694244_100000764884 [1,1,0,0,0,0|0,0,0]=2 607 B9R1.35 C=C(C)c1cnn(c1)C 271570a_100000694244_100000748075 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.35 C=C(C)c1cnn(n1)C 271570a_100000694244_100000733932 [1,1,0,0,0,0|2,0,0]=4 609 B9R1.35 C=C(C)c1csc(c1)C 271570a_100000694244_100000759034 [1,1,0,0,0,0|2,0,0]=4 610 B9R1.35 C=C(C)c1csc(n1)C 271570a_100000694244_100011934587 [1,1,0,0,0,0|2,0,0]=4 611 B9R1.35 C=C(C)c1nc(ns1)C 271570a_100000694244_100000709739 [1,1,0,0,0,0|2,0,0]=4 612 B9R1.35 C=C(C)c1ncc(s1)C 271570a_100000694244_100000690809 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.35 C=C(C)c1nnc(o1)C 271570a_100000694244_100000708914 [1,1,0,0,0,0|1,1,0]=4 614 B9R1.35 C=C(C)c1nnc(s1)C 271570a_100000694244_100000686958 [1,1,0,0,0,0|1,0,0]=3 615 B9R1.35 C=C(C)c1nnc(s1)N 271570a_100000694244_100000738278 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.35 CC(=O)c1cnc(s1)O 271570a_203496583355_200010173910 [1,1,0,0,0,0|1,0,1]=4 617 B9R1.35 NC(=O)c1cnc(s1)O 271570a_203496583355_100010220624 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.132 C=Cc1cnc(n1C)C 271570a_100011290941_100000762843 [1,1,0,0,0,0|1,0,0]=3 619 B9R1.132 C=Cc1cnn(c1C)C 271570a_100011290941_100000722751 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.132 C=Cc1cnn(c1F)C 271570a_100011290941_200011161937 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.132 C=Cc1csc(c1C)C 271570a_100011290941_100009820295 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.14 C=Cc1c[nH]nc1OC 271570a_100011290941_100010982843 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.14 C=Cc1ccnn1CC 271570a_100011290941_100000728327 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.14 C=Cc1ccsc1CO 271570a_100011290941_100000702026 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.14 C=Cc1ccsc1SC 271570a_100011290941_200010341309 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.14 C=Cc1ncnn1CC 271570a_100011290941_100009879425 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.14 C=Cc1ncsc1CO 271570a_100011290941_100012000948 [1,1,0,0,0,0|2,0,0]=4 628 B9R1.14 C=Cc1sccc1C#N 271570a_100011290941_100009817073 [1,1,0,0,0,0|1,0,1]=4 629 B9R1.14 C=Cc1sccc1C=O 271570a_100011290941_100009816921 [1,1,0,0,0,0|1,0,1]=4 630 B9R1.14 C=Cc1sccc1CC 271570a_100011290941_200009875468 [1,1,0,0,0,0|1,0,0]=3 631 B9R1.14 C=Cc1sccc1CN 271570a_100011290941_100000727803 [1,1,0,0,0,0|1,0,0]=3 632 B9R1.14 C=Cc1sccc1CO 271570a_100011290941_100009816922 [1,1,0,0,0,0|1,0,0]=3 633 B9R1.14 CSc1ccsc1C=O 62a_100000766043_200000210301 [1,1,0,0,0,0|2,0,0]=4 634 B9R1.14 CSc1ccsc1C=O 62a_200000210301_100000766043 [1,1,0,0,0,0|2,0,0]=4 635 B9R1.14 CSc1ncsc1CO 62a_100012000948_200000210301 [1,1,0,0,0,0|1,0,1]=4 636 B9R1.14 CSc1ncsc1CO 62a_200000210301_100012000948 [1,1,0,0,0,0|1,0,1]=4 637 B9R1.14 [13CH3]Sc1ccsc1C=O 62a_100000766043_200025704644 [1,1,0,0,0,0|2,0,0]=4 638 B9R1.14 [13CH3]Sc1ccsc1C=O 62a_200025704644_100000766043 [1,1,0,0,0,0|2,0,0]=4 639 B9R1.14 [13CH3]Sc1ncsc1CO 62a_100012000948_200025704644 [1,1,0,0,0,0|1,0,1]=4 640 B9R1.14 [13CH3]Sc1ncsc1CO 62a_200025704644_100012000948 [1,1,0,0,0,0|1,0,1]=4 641 B9R1.27 C=Cc1c(n[nH]c1C)C 271570a_100011290941_100000238710 [1,1,0,0,0,0|2,0,0]=4 642 B9R1.27 C=Cc1c(n[nH]c1N)C 271570a_100011290941_100000182022 [1,1,0,0,0,0|2,0,0]=4 643 B9R1.27 C=Cc1c(nnn1C)C 271570a_100011290941_100016037793 [1,1,0,0,0,0|2,0,0]=4 644 B9R1.27 C=Cc1c(noc1C)C 271570a_100011290941_100000694658 [1,1,0,0,0,0|2,0,0]=4 645 B9R1.27 C=Cc1c(noc1N)C 271570a_100011290941_100000754107 [1,1,0,0,0,0|2,0,0]=4 646 B9R1.27 C=Cc1c(nsc1N)C 271570a_100011290941_100000701153 [1,1,0,0,0,0|2,0,0]=4 647 B9R1.33 C=C=Cc1[nH]cnc1Cl 271570a_100015277604_100010200774 [1,1,0,0,0,0|2,0,0]=4 648 B9R1.33 C=C=Cc1c[nH]nc1C 271570a_100015277604_100011912673 [1,1,0,0,0,0|2,0,0]=4 649 B9R1.33 C=C=Cc1ccnn1C 271570a_100015277604_100000688441 [1,1,0,0,0,0|2,0,0]=4 650 B9R1.33 C=C=Cc1ccsc1C 271570a_100015277604_100000684487 [1,1,0,0,0,0|2,0,0]=4 651 B9R1.33 C=C=Cc1nc[nH]c1C 271570a_100015277604_100009816806 [1,1,0,0,0,0|1,0,1]=4 652 B9R1.33 C=C=Cc1ncnn1C 271570a_100015277604_100000732653 [1,1,0,0,0,0|2,0,0]=4 653 B9R1.33 C=C=Cc1ncsc1C 271570a_100015277604_100000732656 [1,1,0,0,0,0|2,0,0]=4 654 B9R1.33 C=C=Cc1sccc1Br 271570a_100015277604_100012361411 [1,1,0,0,0,0|2,0,0]=4 655 B9R1.33 C=C=Cc1sccc1C 271570a_100015277604_100000742657 [1,1,0,0,0,0|1,0,0]=3 656 B9R1.33 C=C=Cc1scnc1C 271570a_100015277604_100009817116 [1,1,0,0,0,0|0,0,0]=2 657 B9R1.33 CC=Cc1[nH]cnc1Cl 271570a_100016259895_100010200774 [1,1,0,0,0,0|2,0,0]=4 658 B9R1.33 CC=Cc1c[nH]nc1C 271570a_100016259895_100011912673 [1,1,0,0,0,0|2,0,0]=4 659 B9R1.33 CC=Cc1ccnn1C 271570a_100016259895_100000688441 [1,1,0,0,0,0|2,0,0]=4 660 B9R1.33 CC=Cc1ccsc1C 271570a_100016259895_100000684487 [1,1,0,0,0,0|2,0,0]=4 661 B9R1.33 CC=Cc1nc[nH]c1C 271570a_100016259895_100009816806 [1,1,0,0,0,0|1,0,1]=4 662 B9R1.33 CC=Cc1ncnn1C 271570a_100016259895_100000732653 [1,1,0,0,0,0|2,0,0]=4 663 B9R1.33 CC=Cc1ncsc1C 271570a_100016259895_100000732656 [1,1,0,0,0,0|2,0,0]=4 664 B9R1.33 CC=Cc1sccc1Br 271570a_100016259895_100012361411 [1,1,0,0,0,0|2,0,0]=4 665 B9R1.33 CC=Cc1sccc1C 271570a_100016259895_100000742657 [1,1,0,0,0,0|1,0,0]=3 666 B9R1.33 CC=Cc1scnc1C 271570a_100016259895_100009817116 [1,1,0,0,0,0|0,0,0]=2 667 B9R1.33 CCSc1scnc1C 62a_100000210202_100009817116 [1,1,0,0,0,0|0,0,2]=4 668 B9R1.33 CCSc1scnc1C 62a_100009817116_100000210202 [1,1,0,0,0,0|0,0,2]=4 669 B9R1.33 CNCc1scnc1C 207a_100102657272_100000764165 [1,1,0,0,0,0|0,0,2]=4 670 B9R1.33 CNCc1scnc1C 2230a_100000752186_200000210301 [1,1,0,0,0,0|0,0,2]=4 671 B9R1.33 COCc1scnc1C 34a_100000750112_200000210301 [1,1,0,0,0,0|0,0,2]=4 672 B9R1.33 COCc1scnc1C 7a_100000750112_200000210301 [1,1,0,0,0,0|0,0,2]=4 673 B9R1.33 Cc1ncsc1CN[13CH3] 2230a_100000752186_200025704644 [1,1,0,0,0,0|0,0,2]=4 674 B9R1.33 Cc1ncsc1CO[13CH3] 34a_100000750112_200025704644 [1,1,0,0,0,0|0,0,2]=4 675 B9R1.33 Cc1ncsc1CO[13CH3] 7a_100000750112_200025704644 [1,1,0,0,0,0|0,0,2]=4 676 B9R1.33 Cc1ncsc1SCF 62a_100009817116_100015361967 [1,1,0,0,0,0|1,0,1]=4 677 B9R1.33 Cc1ncsc1SCF 62a_100015361967_100009817116 [1,1,0,0,0,0|1,0,1]=4 678 B9R1.41 C=C(C)c1[nH]cnc1Cl 271570a_100000694244_100010200774 [1,1,0,0,0,0|2,0,0]=4 679 B9R1.41 C=C(C)c1c[nH]nc1C 271570a_100000694244_100011912673 [1,1,0,0,0,0|2,0,0]=4 680 B9R1.41 C=C(C)c1ccnn1C 271570a_100000694244_100000688441 [1,1,0,0,0,0|2,0,0]=4 681 B9R1.41 C=C(C)c1ccsc1C 271570a_100000694244_100000684487 [1,1,0,0,0,0|2,0,0]=4 682 B9R1.41 C=C(C)c1nc[nH]c1C 271570a_100000694244_100009816806 [1,1,0,0,0,0|1,0,1]=4 683 B9R1.41 C=C(C)c1ncnn1C 271570a_100000694244_100000732653 [1,1,0,0,0,0|2,0,0]=4 684 B9R1.41 C=C(C)c1ncsc1C 271570a_100000694244_100000732656 [1,1,0,0,0,0|2,0,0]=4 685 B9R1.41 C=C(C)c1sccc1Br 271570a_100000694244_100012361411 [1,1,0,0,0,0|2,0,0]=4 686 B9R1.41 C=C(C)c1sccc1C 271570a_100000694244_100000742657 [1,1,0,0,0,0|1,0,0]=3 687 B9R1.41 C=C(C)c1scnc1C 271570a_100000694244_100009817116 [1,1,0,0,0,0|0,0,0]=2 688 B9R1.41 CC(=O)c1scnc1O 271570a_203496583355_200010339033 [1,1,0,0,0,0|1,0,1]=4 689 B11R1.8 C=Cc1[nH]c(nc(=O)c1F)C 271570a_100011290941_100010274585 [0,1,0,0,0,1|2,0,0]=4 690 B11R1.8 C=Cc1cc(cc(c1F)C)C 271570a_100011290941_200010204574 [0,1,0,0,0,1|2,0,0]=4 691 B11R1.8 C=Cc1cc(cc(c1N)C)C 271570a_100011290941_100000688863 [0,1,0,0,0,1|2,0,0]=4 692 B11R1.8 C=Cc1cc(cc(c1O)C)C 271570a_100011290941_100011934984 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.8 C=Cc1nc(cc(c1N)C)C 271570a_100011290941_100009816701 [0,1,0,0,0,1|2,0,0]=4 694 B11R1.8 C=Cc1nc(nc(c1C)C)N 271570a_100011290941_100000076065 [0,1,0,0,0,1|2,0,0]=4 695 B11R1.8 C=Cc1nc(nc(c1C)N)C 271570a_100011290941_200000700166 [0,1,0,0,0,1|2,0,0]=4 696 B11R1.8 C=Cc1nc(nc(c1F)N)C 271570a_100011290941_100000117604 [0,1,0,0,0,1|2,0,0]=4 697 B11R1.8 C=Cc1nc(nc(c1N)N)C 271570a_100011290941_100009882007 [0,1,0,0,0,1|2,0,0]=4 698 B11R1.9 C=Cc1cc(cc(c1)CO)C 271570a_100011290941_100000720511 [0,1,0,0,0,1|2,0,0]=4 699 B11R1.9 C=Cc1cc(cc(c1)OC)C 271570a_100011290941_100010187550 [0,1,0,0,0,1|2,0,0]=4 700 B11R1.9 C=Cc1cc(cc(c1)SC)C 271570a_100011290941_200010709730 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.9 C=Cc1cc(cc(n1)C)OC 271570a_100011290941_200009849800 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.9 C=Cc1cc(cc(n1)CO)C 271570a_100011290941_100000725198 [0,1,0,0,0,1|2,0,0]=4 703 B11R1.9 C=Cc1cc(cc(n1)OC)C 271570a_100011290941_100009856763 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.9 C=Cc1cc(nc(c1)C#N)C 271570a_100011290941_100000730222 [0,1,0,0,0,1|1,0,1]=4 705 B11R1.9 C=Cc1cc(nc(c1)C=O)C 271570a_100011290941_100009814795 [0,1,0,0,0,1|1,0,1]=4 706 B11R1.9 C=Cc1cc(nc(c1)CN)C 271570a_100011290941_100010178683 [0,1,0,0,0,1|1,0,0]=3 707 B11R1.9 C=Cc1cc(nc(c1)CO)C 271570a_100011290941_100010178681 [0,1,0,0,0,1|1,0,0]=3 708 B11R1.9 C=Cc1cc(nc(c1)OC)C 271570a_100011290941_100010067692 [0,1,0,0,0,1|1,0,0]=3 709 B11R1.9 C=Cc1cc(nc(c1)OC)N 271570a_100011290941_100010136845 [0,1,0,0,0,1|2,0,0]=4 710 B11R1.9 C=Cc1cc(nc(n1)C)CC 271570a_100011290941_100000761995 [0,1,0,0,0,1|1,0,0]=3 711 B11R1.9 C=Cc1cc(nc(n1)C)NC 271570a_100011290941_100000758931 [0,1,0,0,0,1|1,0,0]=3 712 B11R1.9 C=Cc1cc(nc(n1)C)OC 271570a_100011290941_100011686313 [0,1,0,0,0,1|1,0,0]=3 713 B11R1.9 C=Cc1cc(nc(n1)C)SC 271570a_100011290941_100011686690 [0,1,0,0,0,1|1,0,0]=3 714 B11R1.9 C=Cc1cc(nc(n1)CC)C 271570a_100011290941_100000687827 [0,1,0,0,0,1|1,0,0]=3 715 B11R1.9 C=Cc1cc(nc(n1)N)CC 271570a_100011290941_100000069509 [0,1,0,0,0,1|2,0,0]=4 716 B11R1.9 C=Cc1cc(nc(n1)N)NC 271570a_100011290941_100011228701 [0,1,0,0,0,1|2,0,0]=4 717 B11R1.9 C=Cc1cc(nc(n1)N)OC 271570a_100011290941_100000686185 [0,1,0,0,0,1|2,0,0]=4 718 B11R1.9 C=Cc1cc(nc(n1)NC)C 271570a_100011290941_100011202761 [0,1,0,0,0,1|1,0,0]=3 719 B11R1.9 C=Cc1cc(nc(n1)OC)N 271570a_100011290941_100000101663 [0,1,0,0,0,1|2,0,0]=4 720 B11R1.9 C=Cc1cc(nc(n1)SC)C 271570a_100011290941_100000073727 [0,1,0,0,0,1|1,0,0]=3 721 B11R1.9 C=Cc1cc(nc(n1)SC)N 271570a_100011290941_100000685733 [0,1,0,0,0,1|2,0,0]=4 722 B11R1.9 C=Cc1cc(nc(n1)SC)O 271570a_100011290941_100012106143 [0,1,0,0,0,1|2,0,0]=4 723 B11R1.9 C=Cc1nc(cc(n1)NC)C 271570a_100011290941_100011684537 [0,1,0,0,0,1|2,0,0]=4 724 B11R1.9 C=Cc1nc(cc(n1)OC)C 271570a_100011290941_100000755725 [0,1,0,0,0,1|2,0,0]=4 725 B11R1.9 C=Cc1nc(cc(n1)SC)C 271570a_100011290941_200011684794 [0,1,0,0,0,1|2,0,0]=4 726 B11R1.14 C=Cc1cc(c(c(c1)C)C)C 271570a_100011290941_200011015895 [0,1,0,0,0,1|2,0,0]=4 727 B11R1.14 C=Cc1cc(c(c(c1)C)F)C 271570a_100011290941_100009814169 [0,1,0,0,0,1|2,0,0]=4 728 B11R1.14 C=Cc1cc(c(c(c1)C)N)C 271570a_100011290941_100000737279 [0,1,0,0,0,1|2,0,0]=4 729 B11R1.14 C=Cc1cc(c(c(c1)C)O)C 271570a_100011290941_100000187306 [0,1,0,0,0,1|2,0,0]=4 730 B11R1.14 C=Cc1cc(c(c(n1)C)N)C 271570a_100011290941_100009817025 [0,1,0,0,0,1|2,0,0]=4 731 B11R1.34 C=C=Cc1cc(cc(c1)C)C 271570a_100015277604_100011215608 [0,1,0,0,0,1|2,0,0]=4 732 B11R1.34 C=C=Cc1cc(cc(n1)C)C 271570a_100015277604_100000069240 [0,1,0,0,0,1|2,0,0]=4 733 B11R1.34 C=C=Cc1cc(nc(c1)C)C 271570a_100015277604_100009816552 [0,1,0,0,0,1|1,0,0]=3 734 B11R1.34 C=C=Cc1cc(nc(c1)F)C 271570a_100015277604_100010006595 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.34 C=C=Cc1cc(nc(c1)N)C 271570a_100015277604_100000076705 [0,1,0,0,0,1|2,0,0]=4 736 B11R1.34 C=C=Cc1cc(nc(n1)C)C 271570a_100015277604_100000736142 [0,1,0,0,0,1|1,0,0]=3 737 B11R1.34 C=C=Cc1cc(nc(n1)C)N 271570a_100015277604_100012178882 [0,1,0,0,0,1|2,0,0]=4 738 B11R1.34 C=C=Cc1cc(nc(n1)C)O 271570a_100015277604_106741647437 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.34 C=C=Cc1cc(nc(n1)N)C 271570a_100015277604_100000183061 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.34 C=C=Cc1nc(cc(n1)C)C 271570a_100015277604_100000736147 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.34 C=C=Cc1nc(nc(n1)C)C 271570a_100015277604_100015468570 [0,1,0,0,0,1|1,0,0]=3 742 B11R1.34 C=C=Cc1nc(nc(n1)N)C 271570a_100015277604_200012022553 [0,1,0,0,0,1|2,0,0]=4 743 B11R1.34 CC=Cc1cc(cc(c1)C)C 271570a_100016259895_100011215608 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.34 CC=Cc1cc(cc(n1)C)C 271570a_100016259895_100000069240 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.34 CC=Cc1cc(nc(c1)C)C 271570a_100016259895_100009816552 [0,1,0,0,0,1|1,0,0]=3 746 B11R1.34 CC=Cc1cc(nc(c1)F)C 271570a_100016259895_100010006595 [0,1,0,0,0,1|2,0,0]=4 747 B11R1.34 CC=Cc1cc(nc(c1)N)C 271570a_100016259895_100000076705 [0,1,0,0,0,1|2,0,0]=4 748 B11R1.34 CC=Cc1cc(nc(n1)C)C 271570a_100016259895_100000736142 [0,1,0,0,0,1|1,0,0]=3 749 B11R1.34 CC=Cc1cc(nc(n1)C)N 271570a_100016259895_100012178882 [0,1,0,0,0,1|2,0,0]=4 750 B11R1.34 CC=Cc1cc(nc(n1)C)O 271570a_100016259895_106741647437 [0,1,0,0,0,1|2,0,0]=4 751 B11R1.34 CC=Cc1cc(nc(n1)N)C 271570a_100016259895_100000183061 [0,1,0,0,0,1|2,0,0]=4 752 B11R1.34 CC=Cc1nc(cc(n1)C)C 271570a_100016259895_100000736147 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.34 CC=Cc1nc(nc(n1)C)C 271570a_100016259895_100015468570 [0,1,0,0,0,1|1,0,0]=3 754 B11R1.34 CC=Cc1nc(nc(n1)N)C 271570a_100016259895_200012022553 [0,1,0,0,0,1|2,0,0]=4 755 B11R1.74 C=C(C)c1cc(cc(c1)C)C 271570a_100000694244_100011215608 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.74 C=C(C)c1cc(cc(n1)C)C 271570a_100000694244_100000069240 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.74 C=C(C)c1cc(nc(c1)C)C 271570a_100000694244_100009816552 [0,1,0,0,0,1|1,0,0]=3 758 B11R1.74 C=C(C)c1cc(nc(c1)F)C 271570a_100000694244_100010006595 [0,1,0,0,0,1|2,0,0]=4 759 B11R1.74 C=C(C)c1cc(nc(c1)N)C 271570a_100000694244_100000076705 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.74 C=C(C)c1cc(nc(n1)C)C 271570a_100000694244_100000736142 [0,1,0,0,0,1|1,0,0]=3 761 B11R1.74 C=C(C)c1cc(nc(n1)C)N 271570a_100000694244_100012178882 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.74 C=C(C)c1cc(nc(n1)C)O 271570a_100000694244_106741647437 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.74 C=C(C)c1cc(nc(n1)N)C 271570a_100000694244_100000183061 [0,1,0,0,0,1|2,0,0]=4 764 B11R1.74 C=C(C)c1nc(cc(n1)C)C 271570a_100000694244_100000736147 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.74 C=C(C)c1nc(nc(n1)C)C 271570a_100000694244_100015468570 [0,1,0,0,0,1|1,0,0]=3 766 B11R1.74 C=C(C)c1nc(nc(n1)N)C 271570a_100000694244_200012022553 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.37 C=Cc1ccc(cc1CO)C 271570a_100011290941_100012361352 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.37 C=Cc1ccc(cc1OC)C 271570a_100011290941_100010200004 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.37 C=Cc1ccc(cc1SC)C 271570a_100011290941_200010709736 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.37 C=Cc1ccc(nc1C#N)C 271570a_100011290941_100009878477 [0,1,0,0,0,1|1,0,1]=4 771 B11R1.37 C=Cc1ccc(nc1C=O)C 271570a_100011290941_100010173661 [0,1,0,0,0,1|1,0,1]=4 772 B11R1.37 C=Cc1ccc(nc1CO)C 271570a_100011290941_100010074375 [0,1,0,0,0,1|1,0,0]=3 773 B11R1.37 C=Cc1ccc(nc1CO)F 271570a_100011290941_100000701195 [0,1,0,0,0,1|2,0,0]=4 774 B11R1.37 C=Cc1ccc(nc1OC)C 271570a_100011290941_100010138632 [0,1,0,0,0,1|1,0,0]=3 775 B11R1.37 C=Cc1ccc(nc1OC)N 271570a_100011290941_100010187630 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.37 C=Cc1cnc(cc1CO)C 271570a_100011290941_100015579599 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.37 C=Cc1cnc(cc1OC)C 271570a_100011290941_100000717771 [0,1,0,0,0,1|2,0,0]=4 778 B11R1.37 C=Cc1cnc(nc1OC)N 271570a_100011290941_100010240410 [0,1,0,0,0,1|2,0,0]=4 779 B11R1.37 C=Cc1ncc(cc1CO)C 271570a_100011290941_100000118064 [0,1,0,0,0,1|2,0,0]=4 780 B11R1.37 C=Cc1ncc(cc1OC)C 271570a_100011290941_200000118316 [0,1,0,0,0,1|2,0,0]=4 781 B11R1.37 C=Cc1ncc(cc1SC)C 271570a_100011290941_100010884634 [0,1,0,0,0,1|2,0,0]=4 782 B11R1.37 C=Cc1ncc(nc1OC)Br 271570a_100011290941_100010214903 [0,1,0,0,0,1|2,0,0]=4 783 B11R1.37 C=Cc1ncc(nc1OC)N 271570a_100011290941_100010128448 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.37 CSc1nc(ccc1C=O)C 62a_100000085379_200000210301 [0,1,0,0,0,1|2,0,0]=4 785 B11R1.37 CSc1nc(ccc1C=O)C 62a_200000210301_100000085379 [0,1,0,0,0,1|2,0,0]=4 786 B11R1.37 Cc1ccc(c(n1)S[13CH3])C=O 62a_100000085379_200025704644 [0,1,0,0,0,1|2,0,0]=4 787 B11R1.37 Cc1ccc(c(n1)S[13CH3])C=O 62a_200025704644_100000085379 [0,1,0,0,0,1|2,0,0]=4 788 B11R1.81 C=C=Cc1ccc(cc1C)C 271570a_100015277604_100011217332 [0,1,0,0,0,1|2,0,0]=4 789 B11R1.81 C=C=Cc1ccc(nc1C)C 271570a_100015277604_100009813853 [0,1,0,0,0,1|1,0,0]=3 790 B11R1.81 C=C=Cc1ccc(nc1C)Cl 271570a_100015277604_100000062408 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.81 C=C=Cc1ccc(nc1C)F 271570a_100015277604_100000688911 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.81 C=C=Cc1ccc(nc1C)N 271570a_100015277604_100000013003 [0,1,0,0,0,1|2,0,0]=4 793 B11R1.81 C=C=Cc1ccc(nc1C)O 271570a_100015277604_100000691680 [0,1,0,0,0,1|2,0,0]=4 794 B11R1.81 C=C=Cc1ccc(nc1F)C 271570a_100015277604_100010006597 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.81 C=C=Cc1ccc(nc1N)C 271570a_100015277604_100009816662 [0,1,0,0,0,1|2,0,0]=4 796 B11R1.81 C=C=Cc1ccc(nc1O)C 271570a_100015277604_100009817604 [0,1,0,0,0,1|2,0,0]=4 797 B11R1.81 C=C=Cc1cnc(cc1C)C 271570a_100015277604_100009819613 [0,1,0,0,0,1|2,0,0]=4 798 B11R1.81 C=C=Cc1cnc(nc1C)N 271570a_100015277604_100000725598 [0,1,0,0,0,1|2,0,0]=4 799 B11R1.81 C=C=Cc1cnc(nc1N)C 271570a_100015277604_100000684960 [0,1,0,0,0,1|2,0,0]=4 800 B11R1.81 C=C=Cc1ncc(cc1C)C 271570a_100015277604_100009864548 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.81 C=C=Cc1ncc(nc1C)C 271570a_100015277604_100000065684 [0,1,0,0,0,1|1,0,0]=3 802 B11R1.81 C=C=Cc1ncc(nc1C)N 271570a_100015277604_100009818570 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.81 CC=Cc1ccc(nc1C)C 271570a_100016259895_100009813853 [0,1,0,0,0,1|1,0,0]=3 805 B11R1.81 CC=Cc1ccc(nc1C)Cl 271570a_100016259895_100000062408 [0,1,0,0,0,1|2,0,0]=4 806 B11R1.81 CC=Cc1ccc(nc1C)F 271570a_100016259895_100000688911 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.81 CC=Cc1ccc(nc1C)N 271570a_100016259895_100000013003 [0,1,0,0,0,1|2,0,0]=4 808 B11R1.81 CC=Cc1ccc(nc1C)O 271570a_100016259895_100000691680 [0,1,0,0,0,1|2,0,0]=4 809 B11R1.81 CC=Cc1ccc(nc1F)C 271570a_100016259895_100010006597 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.81 CC=Cc1ccc(nc1N)C 271570a_100016259895_100009816662 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.81 CC=Cc1ccc(nc1O)C 271570a_100016259895_100009817604 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.81 CC=Cc1cnc(cc1C)C 271570a_100016259895_100009819613 [0,1,0,0,0,1|2,0,0]=4 813 B11R1.81 CC=Cc1cnc(nc1C)N 271570a_100016259895_100000725598 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.81 CC=Cc1cnc(nc1N)C 271570a_100016259895_100000684960 [0,1,0,0,0,1|2,0,0]=4 815 B11R1.81 CC=Cc1ncc(cc1C)C 271570a_100016259895_100009864548 [0,1,0,0,0,1|2,0,0]=4 816 B11R1.81 CC=Cc1ncc(nc1C)C 271570a_100016259895_100000065684 [0,1,0,0,0,1|1,0,0]=3 817 B11R1.81 CC=Cc1ncc(nc1C)N 271570a_100016259895_100009818570 [0,1,0,0,0,1|2,0,0]=4 818 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,1,0,0,0,1|2,0,0]=4 819 B11R1.166 C=C(C)c1ccc(nc1C)C 271570a_100000694244_100009813853 [0,1,0,0,0,1|1,0,0]=3 820 B11R1.166 C=C(C)c1ccc(nc1C)Cl 271570a_100000694244_100000062408 [0,1,0,0,0,1|2,0,0]=4 821 B11R1.166 C=C(C)c1ccc(nc1C)F 271570a_100000694244_100000688911 [0,1,0,0,0,1|2,0,0]=4 822 B11R1.166 C=C(C)c1ccc(nc1C)N 271570a_100000694244_100000013003 [0,1,0,0,0,1|2,0,0]=4 823 B11R1.166 C=C(C)c1ccc(nc1C)O 271570a_100000694244_100000691680 [0,1,0,0,0,1|2,0,0]=4 824 B11R1.166 C=C(C)c1ccc(nc1F)C 271570a_100000694244_100010006597 [0,1,0,0,0,1|2,0,0]=4 825 B11R1.166 C=C(C)c1ccc(nc1N)C 271570a_100000694244_100009816662 [0,1,0,0,0,1|2,0,0]=4 826 B11R1.166 C=C(C)c1ccc(nc1O)C 271570a_100000694244_100009817604 [0,1,0,0,0,1|2,0,0]=4 827 B11R1.166 C=C(C)c1cnc(cc1C)C 271570a_100000694244_100009819613 [0,1,0,0,0,1|2,0,0]=4 828 B11R1.166 C=C(C)c1cnc(nc1C)N 271570a_100000694244_100000725598 [0,1,0,0,0,1|2,0,0]=4 829 B11R1.166 C=C(C)c1cnc(nc1N)C 271570a_100000694244_100000684960 [0,1,0,0,0,1|2,0,0]=4 830 B11R1.166 C=C(C)c1ncc(cc1C)C 271570a_100000694244_100009864548 [0,1,0,0,0,1|2,0,0]=4 831 B11R1.166 C=C(C)c1ncc(nc1C)C 271570a_100000694244_100000065684 [0,1,0,0,0,1|1,0,0]=3 832 B11R1.166 C=C(C)c1ncc(nc1C)N 271570a_100000694244_100009818570 [0,1,0,0,0,1|2,0,0]=4 833 B11R1.277 C=Cc1cc(c(cc1C)C)C 271570a_100011290941_100000759388 [0,1,0,0,0,1|2,0,0]=4 834 B11R1.277 C=Cc1cc(c(cc1C)C)N 271570a_100011290941_100000703630 [0,1,0,0,0,1|2,0,0]=4 835 B11R1.277 C=Cc1cc(c(nc1C)N)N 271570a_100011290941_100000688597 [0,1,0,0,0,1|2,0,0]=4 836 B11R1.277 C=Cc1cc(c(nc1N)C)Br 271570a_100011290941_100000684678 [0,1,0,0,0,1|2,0,0]=4 837 B11R1.277 C=Cc1cc(c(nc1N)C)C 271570a_100011290941_100009990238 [0,1,0,0,0,1|2,0,0]=4 838 B11R1.277 C=Cc1nc(c(nc1N)C)C 271570a_100011290941_100012282008 [0,1,0,0,0,1|2,0,0]=4 839 B11R1.277 C=Cc1nc(c(nc1O)C)C 271570a_100011290941_100000717854 [0,1,0,0,0,1|2,0,0]=4 840 B11R1.278 C=Cc1ccc(c(c1C)N)C 271570a_100011290941_200010074581 [0,1,0,0,0,1|2,0,0]=4 841 B11R1.279 C=Cc1ccc(cc1C)CN 271570a_100011290941_100015205234 [0,1,0,0,0,1|2,0,0]=4 842 B11R1.279 C=Cc1ccc(cc1C)CO 271570a_100011290941_100000718852 [0,1,0,0,0,1|2,0,0]=4 843 B11R1.279 C=Cc1ccc(cc1C)NC 271570a_100011290941_100102888905 [0,1,0,0,0,1|2,0,0]=4 844 B11R1.279 C=Cc1ccc(cc1C)OC 271570a_100011290941_100000759875 [0,1,0,0,0,1|2,0,0]=4 845 B11R1.279 C=Cc1ccc(nc1C)C#N 271570a_100011290941_100009884075 [0,1,0,0,0,1|1,0,1]=4 846 B11R1.279 C=Cc1ccc(nc1C)C=O 271570a_100011290941_100010238520 [0,1,0,0,0,1|1,0,1]=4 847 B11R1.279 C=Cc1ccc(nc1C)CO 271570a_100011290941_100010114280 [0,1,0,0,0,1|1,0,0]=3 848 B11R1.279 C=Cc1ccc(nc1C)OC 271570a_100011290941_100000766551 [0,1,0,0,0,1|1,0,0]=3 849 B11R1.279 C=Cc1ccc(nc1F)OC 271570a_100011290941_100010067559 [0,1,0,0,0,1|2,0,0]=4 850 B11R1.279 C=Cc1ccc(nc1N)OC 271570a_100011290941_100010187629 [0,1,0,0,0,1|2,0,0]=4 851 B11R1.279 C=Cc1cnc(cc1C)CO 271570a_100011290941_200010713146 [0,1,0,0,0,1|2,0,0]=4 852 B11R1.279 C=Cc1cnc(cc1C)NC 271570a_100011290941_100012352278 [0,1,0,0,0,1|2,0,0]=4 853 B11R1.279 C=Cc1cnc(cc1C)OC 271570a_100011290941_100011934368 [0,1,0,0,0,1|2,0,0]=4 854 B11R1.279 C=Cc1cnc(nc1C)OC 271570a_100011290941_100010152497 [0,1,0,0,0,1|1,0,0]=3 855 B11R1.279 C=Cc1cnc(nc1C)SC 271570a_100011290941_100015672207 [0,1,0,0,0,1|1,0,0]=3 856 B11R1.279 C=Cc1cnc(nc1Cl)SC 271570a_100011290941_100010271306 [0,1,0,0,0,1|2,0,0]=4 857 B11R1.279 C=Cc1cnc(nc1N)OC 271570a_100011290941_100010218985 [0,1,0,0,0,1|2,0,0]=4 858 B11R1.279 C=Cc1cnc(nc1O)SC 271570a_100011290941_100010221251 [0,1,0,0,0,1|2,0,0]=4 859 B11R1.279 C=Cc1ncc(cc1C)CO 271570a_100011290941_200000092119 [0,1,0,0,0,1|2,0,0]=4 860 B11R1.279 C=Cc1ncc(cc1C)OC 271570a_100011290941_200009851512 [0,1,0,0,0,1|2,0,0]=4 861 B11R1.279 C=Cc1ncc(cc1C)SC 271570a_100011290941_203440288091 [0,1,0,0,0,1|2,0,0]=4 862 B11R1.279 C=Cc1ncc(nc1C)OC 271570a_100011290941_200010730098 [0,1,0,0,0,1|1,0,0]=3 863 B11R1.279 C=Cc1ncc(nc1N)OC 271570a_100011290941_100009955223 [0,1,0,0,0,1|2,0,0]=4 864 B11R1.279 CSc1ccc(c(n1)C)C=O 62a_100000050599_200000210301 [0,1,0,0,0,1|2,0,0]=4 865 B11R1.279 CSc1ccc(c(n1)C)C=O 62a_200000210301_100000050599 [0,1,0,0,0,1|2,0,0]=4 866 B11R1.279 Cc1nc(ccc1C=O)S[13CH3] 62a_100000050599_200025704644 [0,1,0,0,0,1|2,0,0]=4 867 B11R1.279 Cc1nc(ccc1C=O)S[13CH3] 62a_200025704644_100000050599 [0,1,0,0,0,1|2,0,0]=4 868 B11R1.464 C=Cc1c(cc(cc1Br)C)C 271570a_100011290941_200012353697 [0,1,0,0,0,1|2,0,0]=4 869 B11R1.464 C=Cc1c(cc(cc1C)C)C 271570a_100011290941_100011204320 [0,1,0,0,0,1|2,0,0]=4 870 B11R1.464 C=Cc1c(cc(cc1O)C)C 271570a_100011290941_100010342985 [0,1,0,0,0,1|2,0,0]=4 871 B11R1.464 C=Cc1c(cc(nc1C)C)N 271570a_100011290941_100010261885 [0,1,0,0,0,1|1,0,0]=3 872 B11R1.464 C=Cc1c(cc(nc1C)N)C 271570a_100011290941_100000699364 [0,1,0,0,0,1|2,0,0]=4 873 B11R1.464 C=Cc1c(nc([nH]c1=O)O)C 271570a_100011290941_100000187651 [0,1,0,0,0,1|2,0,0]=4 874 B11R1.464 C=Cc1c(nc(nc1C)N)C 271570a_100011290941_100009814254 [0,1,0,0,0,1|2,0,0]=4 875 B11R1.464 C=Cc1c(nc(nc1Cl)C)C 271570a_100011290941_200011356833 [0,1,0,0,0,1|1,0,0]=3 876 B11R1.464 C=Cc1c(nc(nc1O)N)C 271570a_100011290941_200000008613 [0,1,0,0,0,1|2,0,0]=4 877 B11R1.72 C=Cc1c(cnc(c1C)F)C 271570a_100011290941_100011016222 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.72 C=Cc1c(ncc(c1C)N)C 271570a_100011290941_100012352430 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,1,0,0,0,1|2,0,0]=4 880 B11R1.167 C=C(C)c1cc(cnc1C)Br 271570a_100000694244_200010090566 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.167 C=C(C)c1cc(cnc1C)C 271570a_100000694244_100009817436 [0,1,0,0,0,1|1,0,0]=3 882 B11R1.167 C=C(C)c1cc(cnc1C)F 271570a_100000694244_100009860710 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.167 C=C(C)c1cc(cnc1C)N 271570a_100000694244_100011998591 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.167 C=C(C)c1cc(cnc1C)O 271570a_100000694244_100009819603 [0,1,0,0,0,1|2,0,0]=4 885 B11R1.167 C=C(C)c1cc(cnc1Cl)C 271570a_100000694244_100010210167 [0,1,0,0,0,1|2,0,0]=4 886 B11R1.167 C=C(C)c1cc(cnc1F)C 271570a_100000694244_100000049784 [0,1,0,0,0,1|2,0,0]=4 887 B11R1.167 C=C(C)c1cc(cnc1N)C 271570a_100000694244_100000049664 [0,1,0,0,0,1|2,0,0]=4 888 B11R1.167 C=C(C)c1cc(cnc1O)C 271570a_100000694244_100000049931 [0,1,0,0,0,1|2,0,0]=4 889 B11R1.167 C=C(C)c1cc(n[nH]c1=O)C 271570a_100000694244_100009819039 [0,1,0,0,0,1|2,0,0]=4 890 B11R1.167 C=C(C)c1cc(ncc1C)Br 271570a_100000694244_100010067628 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.167 C=C(C)c1cc(ncc1C)C 271570a_100000694244_100009862788 [0,1,0,0,0,1|1,0,0]=3 892 B11R1.167 C=C(C)c1cc(ncc1C)Cl 271570a_100000694244_100010068021 [0,1,0,0,0,1|2,0,0]=4 893 B11R1.167 C=C(C)c1cc(ncc1C)F 271570a_100000694244_100000049870 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.167 C=C(C)c1cc(ncc1C)N 271570a_100000694244_100009819938 [0,1,0,0,0,1|2,0,0]=4 895 B11R1.167 C=C(C)c1cc(ncc1C)O 271570a_100000694244_100009831917 [0,1,0,0,0,1|2,0,0]=4 896 B11R1.167 C=C(C)c1cc(ncc1F)C 271570a_100000694244_100009867690 [0,1,0,0,0,1|2,0,0]=4 897 B11R1.167 C=C(C)c1cc(ncc1O)C 271570a_100000694244_100009843476 [0,1,0,0,0,1|2,0,0]=4 898 B11R1.167 C=C(C)c1nc(ccc1C)C 271570a_100000694244_100009854376 [0,1,0,0,0,1|2,0,0]=4 899 B11R1.167 C=C(C)c1nc(cnc1C)C 271570a_100000694244_100000211308 [0,1,0,0,0,1|1,0,0]=3 900 B11R1.167 C=C(C)c1nc(cnc1C)N 271570a_100000694244_100009877824 [0,1,0,0,0,1|2,0,0]=4 901 B11R1.167 C=C(C)c1nc(cnc1N)C 271570a_100000694244_100009819049 [0,1,0,0,0,1|2,0,0]=4 902 B11R1.167 C=C(C)c1nc(ncc1C)N 271570a_100000694244_100000016107 [0,1,0,0,0,1|2,0,0]=4 903 B11R1.167 C=C(C)c1nc(ncc1F)C 271570a_100000694244_100000059819 [0,1,0,0,0,1|2,0,0]=4 904 B11R1.167 C=C(C)c1nc(ncc1N)C 271570a_100000694244_100009873743 [0,1,0,0,0,1|2,0,0]=4 905 B11R1.182 C=C=Cc1cc(ccc1C)C 271570a_100015277604_100000210833 [0,1,0,0,0,1|2,0,0]=4 906 B11R1.182 C=C=Cc1cc(cnc1C)Br 271570a_100015277604_200010090566 [0,1,0,0,0,1|2,0,0]=4 907 B11R1.182 C=C=Cc1cc(cnc1C)C 271570a_100015277604_100009817436 [0,1,0,0,0,1|1,0,0]=3 908 B11R1.182 C=C=Cc1cc(cnc1C)F 271570a_100015277604_100009860710 [0,1,0,0,0,1|2,0,0]=4 909 B11R1.182 C=C=Cc1cc(cnc1C)N 271570a_100015277604_100011998591 [0,1,0,0,0,1|2,0,0]=4 910 B11R1.182 C=C=Cc1cc(cnc1C)O 271570a_100015277604_100009819603 [0,1,0,0,0,1|2,0,0]=4 911 B11R1.182 C=C=Cc1cc(cnc1Cl)C 271570a_100015277604_100010210167 [0,1,0,0,0,1|2,0,0]=4 912 B11R1.182 C=C=Cc1cc(cnc1F)C 271570a_100015277604_100000049784 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.182 C=C=Cc1cc(cnc1N)C 271570a_100015277604_100000049664 [0,1,0,0,0,1|2,0,0]=4 914 B11R1.182 C=C=Cc1cc(cnc1O)C 271570a_100015277604_100000049931 [0,1,0,0,0,1|2,0,0]=4 915 B11R1.182 C=C=Cc1cc(n[nH]c1=O)C 271570a_100015277604_100009819039 [0,1,0,0,0,1|2,0,0]=4 916 B11R1.182 C=C=Cc1cc(ncc1C)Br 271570a_100015277604_100010067628 [0,1,0,0,0,1|2,0,0]=4 917 B11R1.182 C=C=Cc1cc(ncc1C)C 271570a_100015277604_100009862788 [0,1,0,0,0,1|1,0,0]=3 918 B11R1.182 C=C=Cc1cc(ncc1C)Cl 271570a_100015277604_100010068021 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.182 C=C=Cc1cc(ncc1C)F 271570a_100015277604_100000049870 [0,1,0,0,0,1|2,0,0]=4 920 B11R1.182 C=C=Cc1cc(ncc1C)N 271570a_100015277604_100009819938 [0,1,0,0,0,1|2,0,0]=4 921 B11R1.182 C=C=Cc1cc(ncc1C)O 271570a_100015277604_100009831917 [0,1,0,0,0,1|2,0,0]=4 922 B11R1.182 C=C=Cc1cc(ncc1F)C 271570a_100015277604_100009867690 [0,1,0,0,0,1|2,0,0]=4 923 B11R1.182 C=C=Cc1cc(ncc1O)C 271570a_100015277604_100009843476 [0,1,0,0,0,1|2,0,0]=4 924 B11R1.182 C=C=Cc1nc(ccc1C)C 271570a_100015277604_100009854376 [0,1,0,0,0,1|2,0,0]=4 925 B11R1.182 C=C=Cc1nc(cnc1C)C 271570a_100015277604_100000211308 [0,1,0,0,0,1|1,0,0]=3 926 B11R1.182 C=C=Cc1nc(cnc1C)N 271570a_100015277604_100009877824 [0,1,0,0,0,1|2,0,0]=4 927 B11R1.182 C=C=Cc1nc(cnc1N)C 271570a_100015277604_100009819049 [0,1,0,0,0,1|2,0,0]=4 928 B11R1.182 C=C=Cc1nc(ncc1C)N 271570a_100015277604_100000016107 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.182 C=C=Cc1nc(ncc1F)C 271570a_100015277604_100000059819 [0,1,0,0,0,1|2,0,0]=4 930 B11R1.182 C=C=Cc1nc(ncc1N)C 271570a_100015277604_100009873743 [0,1,0,0,0,1|2,0,0]=4 931 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [0,1,0,0,0,1|2,0,0]=4 932 B11R1.182 CC=Cc1cc(cnc1C)Br 271570a_100016259895_200010090566 [0,1,0,0,0,1|2,0,0]=4 933 B11R1.182 CC=Cc1cc(cnc1C)C 271570a_100016259895_100009817436 [0,1,0,0,0,1|1,0,0]=3 934 B11R1.182 CC=Cc1cc(cnc1C)F 271570a_100016259895_100009860710 [0,1,0,0,0,1|2,0,0]=4 935 B11R1.182 CC=Cc1cc(cnc1C)N 271570a_100016259895_100011998591 [0,1,0,0,0,1|2,0,0]=4 936 B11R1.182 CC=Cc1cc(cnc1C)O 271570a_100016259895_100009819603 [0,1,0,0,0,1|2,0,0]=4 937 B11R1.182 CC=Cc1cc(cnc1Cl)C 271570a_100016259895_100010210167 [0,1,0,0,0,1|2,0,0]=4 938 B11R1.182 CC=Cc1cc(cnc1F)C 271570a_100016259895_100000049784 [0,1,0,0,0,1|2,0,0]=4 939 B11R1.182 CC=Cc1cc(cnc1N)C 271570a_100016259895_100000049664 [0,1,0,0,0,1|2,0,0]=4 940 B11R1.182 CC=Cc1cc(cnc1O)C 271570a_100016259895_100000049931 [0,1,0,0,0,1|2,0,0]=4 941 B11R1.182 CC=Cc1cc(n[nH]c1=O)C 271570a_100016259895_100009819039 [0,1,0,0,0,1|2,0,0]=4 942 B11R1.182 CC=Cc1cc(ncc1C)Br 271570a_100016259895_100010067628 [0,1,0,0,0,1|2,0,0]=4 943 B11R1.182 CC=Cc1cc(ncc1C)C 271570a_100016259895_100009862788 [0,1,0,0,0,1|1,0,0]=3 944 B11R1.182 CC=Cc1cc(ncc1C)Cl 271570a_100016259895_100010068021 [0,1,0,0,0,1|2,0,0]=4 945 B11R1.182 CC=Cc1cc(ncc1C)F 271570a_100016259895_100000049870 [0,1,0,0,0,1|2,0,0]=4 946 B11R1.182 CC=Cc1cc(ncc1C)N 271570a_100016259895_100009819938 [0,1,0,0,0,1|2,0,0]=4 947 B11R1.182 CC=Cc1cc(ncc1C)O 271570a_100016259895_100009831917 [0,1,0,0,0,1|2,0,0]=4 948 B11R1.182 CC=Cc1cc(ncc1F)C 271570a_100016259895_100009867690 [0,1,0,0,0,1|2,0,0]=4 949 B11R1.182 CC=Cc1cc(ncc1O)C 271570a_100016259895_100009843476 [0,1,0,0,0,1|2,0,0]=4 950 B11R1.182 CC=Cc1nc(ccc1C)C 271570a_100016259895_100009854376 [0,1,0,0,0,1|2,0,0]=4 951 B11R1.182 CC=Cc1nc(cnc1C)C 271570a_100016259895_100000211308 [0,1,0,0,0,1|1,0,0]=3 952 B11R1.182 CC=Cc1nc(cnc1C)N 271570a_100016259895_100009877824 [0,1,0,0,0,1|2,0,0]=4 953 B11R1.182 CC=Cc1nc(cnc1N)C 271570a_100016259895_100009819049 [0,1,0,0,0,1|2,0,0]=4 954 B11R1.182 CC=Cc1nc(ncc1C)N 271570a_100016259895_100000016107 [0,1,0,0,0,1|2,0,0]=4 955 B11R1.182 CC=Cc1nc(ncc1F)C 271570a_100016259895_100000059819 [0,1,0,0,0,1|2,0,0]=4 956 B11R1.182 CC=Cc1nc(ncc1N)C 271570a_100016259895_100009873743 [0,1,0,0,0,1|2,0,0]=4 957 B11R1.280 C=Cc1cc(ccc1C)CO 271570a_100011290941_100000050133 [0,1,0,0,0,1|2,0,0]=4 958 B11R1.280 C=Cc1cc(ccc1C)NC 271570a_100011290941_100000707694 [0,1,0,0,0,1|2,0,0]=4 959 B11R1.280 C=Cc1cc(ccc1C)OC 271570a_100011290941_100012349166 [0,1,0,0,0,1|2,0,0]=4 960 B11R1.280 C=Cc1cc(cnc1Cl)CO 271570a_100011290941_200015217190 [0,1,0,0,0,1|2,0,0]=4 961 B11R1.280 C=Cc1cc(cnc1F)OC 271570a_100011290941_100010068374 [0,1,0,0,0,1|2,0,0]=4 962 B11R1.280 C=Cc1cc(cnc1N)CO 271570a_100011290941_100012343677 [0,1,0,0,0,1|2,0,0]=4 963 B11R1.280 C=Cc1cc(ncc1C)C#N 271570a_100011290941_100010281125 [0,1,0,0,0,1|1,0,1]=4 964 B11R1.280 C=Cc1cc(ncc1C)C=O 271570a_100011290941_100010174032 [0,1,0,0,0,1|1,0,1]=4 965 B11R1.280 C=Cc1cc(ncc1C)CO 271570a_100011290941_100010113723 [0,1,0,0,0,1|1,0,0]=3 966 B11R1.280 C=Cc1cc(ncc1C)OC 271570a_100011290941_100010068546 [0,1,0,0,0,1|1,0,0]=3 967 B11R1.280 C=Cc1cc(ncc1Cl)OC 271570a_100011290941_100010068019 [0,1,0,0,0,1|2,0,0]=4 968 B11R1.280 C=Cc1cc(ncc1F)OC 271570a_100011290941_100010160775 [0,1,0,0,0,1|2,0,0]=4 969 B11R1.280 C=Cc1nc(ncc1C)SC 271570a_100011290941_100000097195 [0,1,0,0,0,1|1,0,0]=3 970 B11R1.280 C=Cc1nc(ncc1F)OC 271570a_100011290941_100000094299 [0,1,0,0,0,1|2,0,0]=4 971 B11R1.49 C=C(C)c1cc(sc1C=O)C 271570a_100000694244_100011361552 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.49 C=C(C)c1cn(nc1CC)C 271570a_100000694244_100012396458 [0,2,0,0,0,0|2,0,0]=4 973 B11R1.49 C=C(C)c1cn(nc1CO)C 271570a_100000694244_100009816719 [0,2,0,0,0,0|2,0,0]=4 974 B11R1.49 C=C(C)c1cn(nc1OC)C 271570a_100000694244_100015475556 [0,2,0,0,0,0|2,0,0]=4 975 B11R1.49 C=C(C)c1sc(nc1CO)C 271570a_100000694244_100011103066 [0,2,0,0,0,0|0,0,0]=2 976 B11R1.49 C=Cc1cn(nc1C(F)F)C 271570a_100011290941_100010761293 [0,2,0,0,0,0|2,0,0]=4 977 B11R1.49 C=Cc1sc(nc1C(C)C)N 271570a_100011290941_100010209577 [0,2,0,0,0,0|1,0,0]=3 978 B11R1.183 C=C=Cc1cn(nc1CC)C 271570a_100015277604_100012396458 [0,2,0,0,0,0|2,0,0]=4 979 B11R1.183 C=C=Cc1cn(nc1CO)C 271570a_100015277604_100009816719 [0,2,0,0,0,0|2,0,0]=4 980 B11R1.183 C=C=Cc1cn(nc1OC)C 271570a_100015277604_100015475556 [0,2,0,0,0,0|2,0,0]=4 981 B11R1.183 C=C=Cc1sc(nc1CO)C 271570a_100015277604_100011103066 [0,2,0,0,0,0|0,0,0]=2 982 B11R1.183 CC=Cc1cc(sc1C=O)C 271570a_100016259895_100011361552 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.183 CC=Cc1cn(nc1CC)C 271570a_100016259895_100012396458 [0,2,0,0,0,0|2,0,0]=4 984 B11R1.183 CC=Cc1cn(nc1CO)C 271570a_100016259895_100009816719 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.183 CC=Cc1cn(nc1OC)C 271570a_100016259895_100015475556 [0,2,0,0,0,0|2,0,0]=4 986 B11R1.183 CC=Cc1sc(nc1CO)C 271570a_100016259895_100011103066 [0,2,0,0,0,0|0,0,0]=2 987 B11R1.183 CCSc1cc(sc1C=O)C 62a_100000210202_100011361552 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.183 CCSc1cc(sc1C=O)C 62a_100011361552_100000210202 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.183 CCSc1sc(nc1CO)C 62a_100000210202_100011103066 [0,2,0,0,0,0|0,0,2]=4 990 B11R1.183 CCSc1sc(nc1CO)C 62a_100011103066_100000210202 [0,2,0,0,0,0|0,0,2]=4 991 B11R1.183 CCc1nc(sc1COC)C 7a_200000117834_200000210301 [0,2,0,0,0,0|0,0,2]=4 992 B11R1.183 CCc1nc(sc1CO[13CH3])C 7a_200000117834_200025704644 [0,2,0,0,0,0|0,0,2]=4 993 B11R1.183 Cc1cc(c(s1)C=O)SCF 62a_100011361552_100015361967 [0,2,0,0,0,0|2,0,0]=4 994 B11R1.183 Cc1cc(c(s1)C=O)SCF 62a_100015361967_100011361552 [0,2,0,0,0,0|2,0,0]=4 995 B11R1.183 Cc1nc(c(s1)SCF)CO 62a_100011103066_100015361967 [0,2,0,0,0,0|1,0,1]=4 996 B11R1.183 Cc1nc(c(s1)SCF)CO 62a_100015361967_100011103066 [0,2,0,0,0,0|1,0,1]=4 997 B11R1.978 C=Cc1c(nn(c1C)CC)C 271570a_100011290941_100000755104 [0,2,0,0,0,0|2,0,0]=4 998 B11R1.978 C=Cc1c(nn(c1C)CO)C 271570a_100011290941_100009992181 [0,2,0,0,0,0|2,0,0]=4 999 B11R1.48 C=C(C)c1cc(c(s1)C=O)C 271570a_100000694244_100010221198 [0,2,0,0,0,0|2,0,0]=4 1000 B11R1.48 C=C(C)c1nc(c(s1)C=O)C 271570a_100000694244_100010339034 [0,2,0,0,0,0|1,0,0]=3 1001 B11R1.48 C=C(C)c1nc(c(s1)CO)C 271570a_100000694244_100010264302 [0,2,0,0,0,0|1,0,1]=4 1002 B11R1.48 C=Cc1cn(nc1C)C(C)C 271570a_100011290941_100012354293 [0,2,0,0,0,0|2,0,0]=4 1003 B11R1.48 C=Cc1cn(nc1C)C(F)F 271570a_100011290941_100010195271 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.48 C=Cc1sc(cc1C)B(O)O 271570a_100011290941_200010167820 [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.48 C=Cc1sc(cc1C)C(=O)C 271570a_100011290941_100000729792 [0,2,0,0,0,0|1,0,0]=3 1006 B11R1.48 Cc1nc(sc1C=O)N(C)C 27a_100102631434_100010339034 [0,2,0,0,0,0|1,0,0]=3 1007 B11R1.50 C=C(C)c1cc(sc1C)CO 271570a_100000694244_100013897464 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.50 C=C(C)c1sc(cc1C)C=O 271570a_100000694244_100000761930 [0,2,0,0,0,0|1,0,1]=4 1009 B11R1.50 C=C(C)c1sc(nc1C)CC 271570a_100000694244_100010138847 [0,2,0,0,0,0|0,0,0]=2 1010 B11R1.50 C=Cc1nc(c(s1)C(=O)C)C 271570a_100011290941_100010106820 [0,2,0,0,0,0|0,0,2]=4 1011 B11R1.50 CC(=O)c1sc(nc1C)S[13CH3] 62a_100010106820_200025704644 [0,2,0,0,0,0|0,0,1]=3 1012 B11R1.50 CC(=O)c1sc(nc1C)S[13CH3] 62a_200025704644_100010106820 [0,2,0,0,0,0|0,0,1]=3 1013 B11R1.50 CNc1nc(c(s1)C(=O)C)C 27a_100102657272_100010106820 [0,2,0,0,0,0|0,0,1]=3 1014 B11R1.50 CSc1nc(c(s1)C(=O)C)C 62a_100010106820_200000210301 [0,2,0,0,0,0|0,0,1]=3 1015 B11R1.50 CSc1nc(c(s1)C(=O)C)C 62a_200000210301_100010106820 [0,2,0,0,0,0|0,0,1]=3 1016 B11R1.185 C=C=Cc1cc(sc1C)CO 271570a_100015277604_100013897464 [0,2,0,0,0,0|2,0,0]=4 1017 B11R1.185 C=C=Cc1sc(cc1C)C=O 271570a_100015277604_100000761930 [0,2,0,0,0,0|1,0,1]=4 1018 B11R1.185 C=C=Cc1sc(nc1C)CC 271570a_100015277604_100010138847 [0,2,0,0,0,0|0,0,0]=2 1019 B11R1.185 CC=Cc1cc(sc1C)CO 271570a_100016259895_100013897464 [0,2,0,0,0,0|2,0,0]=4 1020 B11R1.185 CC=Cc1sc(cc1C)C=O 271570a_100016259895_100000761930 [0,2,0,0,0,0|1,0,1]=4 1021 B11R1.185 CC=Cc1sc(nc1C)CC 271570a_100016259895_100010138847 [0,2,0,0,0,0|0,0,0]=2 1022 B11R1.185 CCSc1sc(nc1C)CC 62a_100000210202_100010138847 [0,2,0,0,0,0|0,0,2]=4 1023 B11R1.185 CCSc1sc(nc1C)CC 62a_100010138847_100000210202 [0,2,0,0,0,0|0,0,2]=4 1024 B11R1.185 CCc1nc(c(s1)CNC)C 2230a_100015186448_200000210301 [0,2,0,0,0,0|0,0,2]=4 1025 B11R1.185 CCc1nc(c(s1)CN[13CH3])C 2230a_100015186448_200025704644 [0,2,0,0,0,0|0,0,2]=4 1026 B11R1.185 CCc1nc(c(s1)SCF)C 62a_100010138847_100015361967 [0,2,0,0,0,0|1,0,1]=4 1027 B11R1.185 CCc1nc(c(s1)SCF)C 62a_100015361967_100010138847 [0,2,0,0,0,0|1,0,1]=4 1028 B11R1.187 C=C=Cc1nc(c(s1)C=O)C 271570a_100015277604_100010339034 [0,2,0,0,0,0|1,0,1]=4 1029 B11R1.187 C=Cc1cn(nc1C)CCF 271570a_100011290941_100010872355 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.187 CC=Cc1cc(c(s1)C=O)C 271570a_100016259895_100010221198 [0,2,0,0,0,0|2,0,0]=4 1031 B11R1.187 CC=Cc1nc(c(s1)C=O)C 271570a_100016259895_100010339034 [0,2,0,0,0,0|1,0,0]=3 1032 B11R1.187 CC=Cc1nc(c(s1)CO)C 271570a_100016259895_100010264302 [0,2,0,0,0,0|1,0,1]=4 1033 B11R1.187 CCNc1nc(c(s1)C=O)C 27a_100015525214_100010339034 [0,2,0,0,0,0|1,0,0]=3 1034 B11R1.187 CCSc1cc(c(s1)C=O)C 62a_100000210202_100010221198 [0,2,0,0,0,0|2,0,0]=4 1035 B11R1.187 CCSc1cc(c(s1)C=O)C 62a_100010221198_100000210202 [0,2,0,0,0,0|2,0,0]=4 1036 B11R1.187 CCSc1nc(c(s1)C=O)C 62a_100000210202_100010339034 [0,2,0,0,0,0|1,0,0]=3 1037 B11R1.187 CCSc1nc(c(s1)C=O)C 62a_100010339034_100000210202 [0,2,0,0,0,0|1,0,0]=3 1038 B11R1.187 CCSc1nc(c(s1)CO)C 62a_100000210202_100010264302 [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.187 CCSc1nc(c(s1)CO)C 62a_100010264302_100000210202 [0,2,0,0,0,0|1,0,1]=4 1040 B11R1.187 Cc1cc(sc1C=O)SCF 62a_100010221198_100015361967 [0,2,0,0,0,0|2,0,0]=4 1041 B11R1.187 Cc1cc(sc1C=O)SCF 62a_100015361967_100010221198 [0,2,0,0,0,0|2,0,0]=4 1042 B11R1.187 Cc1nc(sc1C=O)SCF 62a_100010339034_100015361967 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.187 Cc1nc(sc1C=O)SCF 62a_100015361967_100010339034 [0,2,0,0,0,0|1,0,0]=3 1044 B11R1.187 Cc1nc(sc1CO)SCF 62a_100010264302_100015361967 [0,2,0,0,0,0|1,0,1]=4 1045 B11R1.187 Cc1nc(sc1CO)SCF 62a_100015361967_100010264302 [0,2,0,0,0,0|1,0,1]=4 1046 B11R1.225 COC(=O)c1sc(nc1C)O 271570a_203496583355_100010220626 [0,2,0,0,0,0|1,0,1]=4 1047 B11R1.673 C=C(C)c1c(nn(c1C)C)C 271570a_100000694244_100000239273 [0,2,0,0,0,0|2,0,0]=4 1048 B11R1.230 C#CCSc1sc(nc1C)C 62a_100000038162_100009814099 [0,2,0,0,0,0|0,0,2]=4 1049 B11R1.230 C=CCOc1cc(nn1C)C 34a_100000738638_100015514636 [0,2,0,0,0,0|2,0,0]=4 1050 B11R1.230 C=CCSc1cc(nn1C)C 62a_100000210623_100009818511 [0,2,0,0,0,0|2,0,0]=4 1051 B11R1.230 C=CCSc1cc(nn1C)C 62a_100009818511_100000210623 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.230 C=CCSc1cc(sc1C)C 62a_100000210623_100000688054 [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.230 C=CCSc1cc(sc1C)C 62a_100000688054_100000210623 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.230 C=CCSc1cn(nc1C)C 62a_100000210623_100011996311 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.230 C=CCSc1cn(nc1C)C 62a_100011996311_100000210623 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.230 C=CCSc1nc([nH]c1C)C 62a_100000210623_200009820778 [0,2,0,0,0,0|1,0,1]=4 1057 B11R1.230 C=CCSc1nc([nH]c1C)C 62a_200009820778_100000210623 [0,2,0,0,0,0|1,0,1]=4 1058 B11R1.230 C=CCSc1nc(sc1C)C 62a_100000210623_100010270876 [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.230 C=CCSc1nc(sc1C)C 62a_100010270876_100000210623 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.230 C=CCSc1nn(nc1C)C 62a_100000210623_200009884731 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.230 C=CCSc1nn(nc1C)C 62a_200009884731_100000210623 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.230 C=CCSc1sc(cc1C)C 62a_100000210623_100000689295 [0,2,0,0,0,0|1,0,0]=3 1063 B11R1.230 C=CCSc1sc(cc1C)C 62a_100000689295_100000210623 [0,2,0,0,0,0|1,0,0]=3 1064 B11R1.230 C=CCSc1sc(nc1C)C 62a_100000210623_100009814099 [0,2,0,0,0,0|0,0,0]=2 1065 B11R1.230 C=CCSc1sc(nc1C)C 62a_100009814099_100000210623 [0,2,0,0,0,0|0,0,0]=2 1066 B11R1.230 C=CCSc1sc(nc1C)N 62a_100000210623_100159269596 [0,2,0,0,0,0|1,0,0]=3 1067 B11R1.230 C=CCSc1sc(nc1C)N 62a_100159269596_100000210623 [0,2,0,0,0,0|1,0,0]=3 1068 B11R1.230 CCCCc1sc(nc1C)C 271570a_100020621405_100009814099 [0,2,0,0,0,0|0,0,2]=4 1069 B11R1.230 CCCSc1sc(nc1C)C 62a_100000210303_100009814099 [0,2,0,0,0,0|0,0,2]=4 1070 B11R1.230 CCCSc1sc(nc1C)C 62a_100009814099_100000210303 [0,2,0,0,0,0|0,0,2]=4 1071 B11R1.230 CCNCc1sc(nc1C)C 207a_100015525214_100000757988 [0,2,0,0,0,0|0,0,2]=4 1072 B11R1.230 CCNCc1sc(nc1C)C 2230a_100000761763_100000210202 [0,2,0,0,0,0|0,0,2]=4 1073 B11R1.230 CCNCc1sc(nc1C)C 2230a_100015525214_100000760948 [0,2,0,0,0,0|0,0,2]=4 1074 B11R1.230 CCOCc1sc(nc1C)C 34a_100000750043_100000210202 [0,2,0,0,0,0|0,0,2]=4 1075 B11R1.230 CCOCc1sc(nc1C)C 34a_100121572206_100000760948 [0,2,0,0,0,0|0,0,2]=4 1076 B11R1.230 CCOCc1sc(nc1C)C 7a_100000750043_100000210202 [0,2,0,0,0,0|0,0,2]=4 1077 B11R1.230 CCSCc1sc(nc1C)C 62a_100000210202_100000760948 [0,2,0,0,0,0|0,0,2]=4 1078 B11R1.230 CCSCc1sc(nc1C)C 62a_100000760948_100000210202 [0,2,0,0,0,0|0,0,2]=4 1079 B11R1.230 COCSc1sc(nc1C)C 62a_100000766300_100009814099 [0,2,0,0,0,0|0,0,2]=4 1080 B11R1.230 COCSc1sc(nc1C)C 62a_100009814099_100000766300 [0,2,0,0,0,0|0,0,2]=4 1081 B11R1.230 CSCSc1sc(nc1C)C 62a_100009814099_100011218213 [0,2,0,0,0,0|0,0,2]=4 1082 B11R1.230 CSCSc1sc(nc1C)C 62a_100011218213_100009814099 [0,2,0,0,0,0|0,0,2]=4 1083 B11R1.230 Cc1cc(c(s1)SCC=O)C 62a_100000689295_200015260668 [0,2,0,0,0,0|1,0,1]=4 1084 B11R1.230 Cc1cc(c(s1)SCC=O)C 62a_200015260668_100000689295 [0,2,0,0,0,0|1,0,1]=4 1085 B11R1.230 Cc1nc(c(s1)COCF)C 34a_100000750043_100015361967 [0,2,0,0,0,0|0,0,2]=4 1086 B11R1.230 Cc1nc(c(s1)COCF)C 7a_100000750043_100015361967 [0,2,0,0,0,0|0,0,2]=4 1087 B11R1.230 Cc1nc(c(s1)CSCF)C 62a_100000760948_100015361967 [0,2,0,0,0,0|0,0,2]=4 1088 B11R1.230 Cc1nc(c(s1)CSCF)C 62a_100015361967_100000760948 [0,2,0,0,0,0|0,0,2]=4 1089 B11R1.230 Cc1nc(c(s1)SCC#N)C 62a_100009814099_100011215382 [0,2,0,0,0,0|0,0,2]=4 1090 B11R1.230 Cc1nc(c(s1)SCC#N)C 62a_100011215382_100009814099 [0,2,0,0,0,0|0,0,2]=4 1091 B11R1.230 Cc1nc(c(s1)SCC=O)C 62a_100009814099_200015260668 [0,2,0,0,0,0|0,0,1]=3 1092 B11R1.230 Cc1nc(c(s1)SCC=O)C 62a_200015260668_100009814099 [0,2,0,0,0,0|0,0,1]=3 1093 B11R1.230 Cc1nc(c(s1)SCCF)C 62a_100009814099_100011217306 [0,2,0,0,0,0|0,0,2]=4 1094 B11R1.230 Cc1nc(c(s1)SCCF)C 62a_100011217306_100009814099 [0,2,0,0,0,0|0,0,2]=4 1095 B11R1.230 Cc1nc(c(s1)SCCO)C 62a_100000211926_100009814099 [0,2,0,0,0,0|0,0,2]=4 1096 B11R1.230 Cc1nc(c(s1)SCCO)C 62a_100009814099_100000211926 [0,2,0,0,0,0|0,0,2]=4 1097 B11R1.230 Cc1nc(sc1SCC=O)N 62a_100159269596_200015260668 [0,2,0,0,0,0|1,0,1]=4 1098 B11R1.230 Cc1nc(sc1SCC=O)N 62a_200015260668_100159269596 [0,2,0,0,0,0|1,0,1]=4 1099 B11R1.598 C=C=Cc1c(nn(c1C)C)C 271570a_100015277604_100000239273 [0,2,0,0,0,0|2,0,0]=4 1100 B11R1.598 CC=Cc1c(nn(c1C)C)C 271570a_100016259895_100000239273 [0,2,0,0,0,0|2,0,0]=4 1101 B11R1.645 CC(=Cc1cc(nn1C)C)C 271570a_100102525489_100009818511 [0,2,0,0,0,0|2,0,0]=4 1102 B11R1.645 CC(=Cc1cc(sc1C)C)C 271570a_100102525489_100000688054 [0,2,0,0,0,0|2,0,0]=4 1103 B11R1.645 CC(=Cc1cn(nc1C)C)C 271570a_100102525489_100011996311 [0,2,0,0,0,0|2,0,0]=4 1104 B11R1.645 CC(=Cc1nc(sc1C)C)C 271570a_100102525489_100010270876 [0,2,0,0,0,0|2,0,0]=4 1105 B11R1.645 CC(=Cc1nn(nc1C)C)C 271570a_100102525489_200009884731 [0,2,0,0,0,0|2,0,0]=4 1106 B11R1.645 CC(=Cc1sc(cc1C)C)C 271570a_100102525489_100000689295 [0,2,0,0,0,0|1,0,0]=3 1107 B11R1.645 CC(=Cc1sc(nc1C)C)C 271570a_100102525489_100009814099 [0,2,0,0,0,0|0,0,0]=2 1108 B11R1.645 CC(=O)Cc1sc(nc1Br)C 1458a_100000070787_100015664652 [0,2,0,0,0,0|1,0,1]=4 1109 B11R1.645 CC(=O)Cc1sc(nc1C)C 1458a_100000070787_100000760948 [0,2,0,0,0,0|0,0,1]=3 1110 B11R1.645 CC(=O)Cc1sc(nc1C)C 1458a_100025788167_200000210301 [0,2,0,0,0,0|0,0,1]=3 1111 B11R1.645 Cc1nc(c(s1)CC(=O)[13CH3])C 1458a_100025788167_200025704644 [0,2,0,0,0,0|0,0,1]=3 1112 B11R1.645 Cc1nc(c(s1)CN(C)C)C 2230a_100102631434_100000760948 [0,2,0,0,0,0|0,0,2]=4 1113 B11R1.645 Cc1nc(c(s1)CN(C)C)C 269982a_100102631434_100000760948 [0,2,0,0,0,0|0,0,2]=4 1114 B11R1.645 Cc1nc(c(s1)SC(C)C)C 62a_100000210206_100009814099 [0,2,0,0,0,0|0,0,2]=4 1115 B11R1.645 Cc1nc(c(s1)SC(C)C)C 62a_100009814099_100000210206 [0,2,0,0,0,0|0,0,2]=4 1116 B11R1.425 C=Cc1c(nn(c1C#N)C)C 271570a_100011290941_100028628391 [0,2,0,0,0,0|2,0,0]=4 1117 B9R1.2 C=Cc1cc(ncn1)C 271570a_100011290941_100000744208 [0,0,1,1,0,0|2,0,0]=4 1118 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [0,0,1,1,0,0|1,0,1]=4 1119 B9R1.2 C=Cc1ccnc(n1)C 271570a_100011290941_100000749937 [0,0,1,1,0,0|1,0,1]=4 1120 B9R1.69 Cc1ccc(c(n1)C)O 271570a_203496583355_100009813853 [0,0,1,1,0,0|2,0,0]=4 1121 B9R1.34 Cc1cc(cc(n1)C)O 271570a_203496583355_100009816552 [0,0,1,1,0,0|2,0,0]=4 1122 B9R1.34 Cc1cc(nc(n1)C)O 271570a_203496583355_100000736142 [0,0,1,1,0,0|2,0,0]=4 1123 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [0,1,0,1,0,0|1,0,1]=4 1124 B11R2.10 Oc1nc2cccnc2s1 271570a_203496583355_100010188088 [0,1,0,1,0,0|1,0,1]=4 1125 B11R2.15 CSc1cc2sccc2s1 62a_200000210301_200010191111 [0,1,0,1,0,0|2,0,0]=4 1126 B11R2.15 [13CH3]Sc1cc2sccc2s1 62a_200025704644_200010191111 [0,1,0,1,0,0|2,0,0]=4 1127 B11R2.356 Cc1nc(c(s1)C2CC2)C 271570a_100011220607_100009814099 [0,1,0,1,0,0|0,0,2]=4 1128 B9R1.1 C=Cc1ccc(cc1)C 271570a_100011290941_100000186775 [1,0,0,0,0,1|2,0,0]=4 1129 B9R1.1 C=Cc1ccc(cn1)C 271570a_100011290941_100000754016 [1,0,0,0,0,1|2,0,0]=4 1130 B9R1.1 C=Cc1ccc(nc1)Br 271570a_100011290941_100009814638 [1,0,0,0,0,1|2,0,0]=4 1131 B9R1.1 C=Cc1ccc(nc1)C 271570a_100011290941_100000751577 [1,0,0,0,0,1|1,0,0]=3 1132 B9R1.1 C=Cc1ccc(nc1)Cl 271570a_100011290941_100000034144 [1,0,0,0,0,1|2,0,0]=4 1133 B9R1.1 C=Cc1ccc(nc1)F 271570a_100011290941_100000748661 [1,0,0,0,0,1|2,0,0]=4 1134 B9R1.1 C=Cc1ccc(nc1)N 271570a_100011290941_100000187370 [1,0,0,0,0,1|2,0,0]=4 1135 B9R1.1 C=Cc1ccc(nn1)C 271570a_100011290941_100011450037 [1,0,0,0,0,1|2,0,0]=4 1136 B9R1.1 C=Cc1cnc(=O)[nH]c1 271570a_100011290941_102495366499 [1,0,0,0,0,1|2,0,0]=4 1137 B9R1.1 C=Cc1cnc(cn1)C 271570a_100011290941_100011999403 [1,0,0,0,0,1|1,0,0]=3 1138 B9R1.1 C=Cc1cnc(cn1)F 271570a_100011290941_100009856528 [1,0,0,0,0,1|2,0,0]=4 1139 B9R1.1 C=Cc1cnc(cn1)N 271570a_100011290941_100000761932 [1,0,0,0,0,1|2,0,0]=4 1140 B9R1.1 C=Cc1cnc(nc1)Br 271570a_100011290941_200012349914 [1,0,0,0,0,1|2,0,0]=4 1141 B9R1.1 C=Cc1cnc(nc1)C 271570a_100011290941_100000686985 [1,0,0,0,0,1|1,0,0]=3 1142 B9R1.1 C=Cc1cnc(nc1)F 271570a_100011290941_100000685262 [1,0,0,0,0,1|2,0,0]=4 1143 B9R1.1 C=Cc1cnc(nc1)N 271570a_100011290941_100000760574 [1,0,0,0,0,1|2,0,0]=4 1144 B9R1.1 C=Cc1cnc(nn1)N 271570a_100011290941_100000691435 [1,0,0,0,0,1|2,0,0]=4