0 B12R1.286 C#Cc1cc(ccc1C)NCC 2230a_200012017271_100000210202 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.286 C#Cc1cc(ccc1C)NCC 34a_200012017271_100000210202 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.286 C#Cc1cc(ccc1Cl)NCC 2230a_103624766972_100000210202 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.286 C#Cc1cc(ccc1Cl)NCC 34a_103624766972_100000210202 [0,0,0,0,0,0|3,0,1]=4 4 B12R1.286 C#Cc1cc(ccc1F)NCC 2230a_200011999510_100000210202 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.286 C#Cc1cc(ccc1F)NCC 34a_200011999510_100000210202 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.286 C=C=Cc1ccc(c(c1)CC)O 271570a_100015277604_100012338938 [0,0,0,0,0,0|1,0,3]=4 7 B12R1.286 C=C=Cc1ccc(c(c1)OC)Br 271570a_100015277604_100012353699 [0,0,0,0,0,0|1,0,3]=4 8 B12R1.286 C=C=Cc1ccc(c(c1)OC)C 271570a_100015277604_100011830276 [0,0,0,0,0,0|1,0,3]=4 9 B12R1.286 C=C=Cc1ccc(c(c1)OC)Cl 271570a_100015277604_100011356853 [0,0,0,0,0,0|1,0,3]=4 10 B12R1.286 C=C=Cc1ccc(c(c1)OC)F 271570a_100015277604_100011934186 [0,0,0,0,0,0|1,0,3]=4 11 B12R1.286 C=C=Cc1ccc(c(c1)OC)N 271570a_100015277604_100011279103 [0,0,0,0,0,0|1,0,3]=4 12 B12R1.286 C=C=Cc1ccc(c(c1)OC)O 271570a_100015277604_100000694246 [0,0,0,0,0,0|0,0,3]=3 13 B12R1.286 C=C=Cc1ccc(c(n1)OC)O 271570a_100015277604_100010893133 [0,0,0,0,0,0|1,0,3]=4 14 B12R1.286 C=Cc1cc(ccc1C)COC 271570a_100011290941_200015395492 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.286 C=Cc1cc(ccc1C)OCC 271570a_100011290941_100011099959 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.286 C=Cc1cc(ccc1F)COC 271570a_100011290941_200011493689 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.286 C=Cc1cc(ccc1F)SCC 62a_100000210202_100000688377 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.286 C=Cc1cc(ccc1F)SCC 62a_100000688377_100000210202 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.286 CC=Cc1c[nH]c(=O)c(c1)OC 271570a_100016259895_100010125397 [0,0,0,0,0,0|1,0,3]=4 20 B12R1.286 CC=Cc1cc(c(cn1)C)OC 271570a_100016259895_100010067687 [0,0,0,0,0,0|2,0,2]=4 21 B12R1.286 CC=Cc1cc(c(cn1)F)OC 271570a_100016259895_200010136270 [0,0,0,0,0,0|2,0,2]=4 22 B12R1.286 CC=Cc1cc(c(cn1)N)OC 271570a_100016259895_100009887741 [0,0,0,0,0,0|2,0,2]=4 23 B12R1.286 CC=Cc1ccc(c(c1)C#N)O 271570a_100016259895_100000687585 [0,0,0,0,0,0|2,0,2]=4 24 B12R1.286 CC=Cc1ccc(c(c1)C=O)O 271570a_100016259895_100000186750 [0,0,0,0,0,0|2,0,2]=4 25 B12R1.286 CC=Cc1ccc(c(c1)CC)Br 271570a_100016259895_100010244631 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.286 CC=Cc1ccc(c(c1)CC)F 271570a_100016259895_100010244625 [0,0,0,0,0,0|2,0,2]=4 27 B12R1.286 CC=Cc1ccc(c(c1)CC)N 271570a_100016259895_100000686106 [0,0,0,0,0,0|2,0,2]=4 28 B12R1.286 CC=Cc1ccc(c(c1)CC)O 271570a_100016259895_100012338938 [0,0,0,0,0,0|1,0,2]=3 29 B12R1.286 CC=Cc1ccc(c(c1)CN)O 271570a_100016259895_100000730032 [0,0,0,0,0,0|2,0,2]=4 30 B12R1.286 CC=Cc1ccc(c(c1)CO)O 271570a_100016259895_100000184703 [0,0,0,0,0,0|2,0,2]=4 31 B12R1.286 CC=Cc1ccc(c(c1)NC)C 271570a_100016259895_100020629602 [0,0,0,0,0,0|2,0,2]=4 32 B12R1.286 CC=Cc1ccc(c(c1)NC)F 271570a_100016259895_100011314990 [0,0,0,0,0,0|2,0,2]=4 33 B12R1.286 CC=Cc1ccc(c(c1)NC)N 271570a_100016259895_100000694363 [0,0,0,0,0,0|2,0,2]=4 34 B12R1.286 CC=Cc1ccc(c(c1)OC)Br 271570a_100016259895_100012353699 [0,0,0,0,0,0|1,0,2]=3 35 B12R1.286 CC=Cc1ccc(c(c1)OC)C 271570a_100016259895_100011830276 [0,0,0,0,0,0|1,0,2]=3 36 B12R1.286 CC=Cc1ccc(c(c1)OC)Cl 271570a_100016259895_100011356853 [0,0,0,0,0,0|1,0,2]=3 37 B12R1.286 CC=Cc1ccc(c(c1)OC)F 271570a_100016259895_100011934186 [0,0,0,0,0,0|1,0,2]=3 38 B12R1.286 CC=Cc1ccc(c(c1)OC)N 271570a_100016259895_100011279103 [0,0,0,0,0,0|1,0,2]=3 39 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [0,0,0,0,0,0|0,0,2]=2 40 B12R1.286 CC=Cc1ccc(c(c1)SC)F 271570a_100016259895_100010341305 [0,0,0,0,0,0|1,1,2]=4 41 B12R1.286 CC=Cc1ccc(c(n1)OC)N 271570a_100016259895_100000687816 [0,0,0,0,0,0|2,0,2]=4 42 B12R1.286 CC=Cc1ccc(c(n1)OC)O 271570a_100016259895_100010893133 [0,0,0,0,0,0|1,0,2]=3 43 B12R1.286 CC=Cc1cnc(c(c1)OC)C 271570a_100016259895_100010254219 [0,0,0,0,0,0|2,0,2]=4 44 B12R1.286 CC=Cc1cnc(c(c1)OC)F 271570a_100016259895_100010214931 [0,0,0,0,0,0|2,0,2]=4 45 B12R1.286 CC=Cc1cnc(c(c1)OC)N 271570a_100016259895_106354213024 [0,0,0,0,0,0|2,0,2]=4 46 B12R1.286 CC=Cc1cnc(c(n1)OC)O 271570a_100016259895_200010365344 [0,0,0,0,0,0|2,0,2]=4 47 B12R1.286 CCNc1ccc(c(c1)C#N)Br 34a_100011934039_100000210202 [0,0,0,0,0,0|4,0,0]=4 48 B12R1.286 CCNc1ccc(c(c1)C#N)Br 7a_100011934039_100000210202 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.286 CCNc1ccc(c(c1)C#N)C 34a_100011216687_100000210202 [0,0,0,0,0,0|4,0,0]=4 50 B12R1.286 CCNc1ccc(c(c1)C#N)C 7a_100011216687_100000210202 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.286 CCNc1ccc(c(c1)C#N)Cl 34a_100000239497_100000210202 [0,0,0,0,0,0|4,0,0]=4 52 B12R1.286 CCNc1ccc(c(c1)C#N)Cl 7a_100000239497_100000210202 [0,0,0,0,0,0|4,0,0]=4 53 B12R1.286 CCNc1ccc(c(c1)C#N)F 34a_100000748589_100000210202 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.286 CCNc1ccc(c(c1)C#N)F 7a_100000748589_100000210202 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.286 CCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210202 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.286 CCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000210202 [0,0,0,0,0,0|3,0,0]=3 57 B12R1.286 CCNc1ccc(c(c1)CC)Br 34a_100010109747_100000210202 [0,0,0,0,0,0|3,0,0]=3 58 B12R1.286 CCNc1ccc(c(c1)CC)Br 7a_100010109747_100000210202 [0,0,0,0,0,0|3,0,0]=3 59 B12R1.286 CCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000210202 [0,0,0,0,0,0|4,0,0]=4 60 B12R1.286 CCNc1ccc(c(c1)CO)Br 34a_100012347228_100000210202 [0,0,0,0,0,0|4,0,0]=4 61 B12R1.286 CCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000210202 [0,0,0,0,0,0|4,0,0]=4 62 B12R1.286 CCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000210202 [0,0,0,0,0,0|4,0,0]=4 63 B12R1.286 CCNc1ccc(c(c1)CO)F 34a_100011218011_100000210202 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [0,0,0,0,0,0|2,0,0]=2 65 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [0,0,0,0,0,0|2,0,0]=2 66 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [0,0,0,0,0,0|2,0,0]=2 67 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [0,0,0,0,0,0|2,0,0]=2 68 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [0,0,0,0,0,0|2,0,0]=2 69 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [0,0,0,0,0,0|2,0,0]=2 70 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [0,0,0,0,0,0|2,0,0]=2 71 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [0,0,0,0,0,0|2,0,0]=2 72 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [0,0,0,0,0,0|2,0,0]=2 73 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [0,0,0,0,0,0|1,0,0]=1 74 B12R1.286 CCNc1ncc(c(n1)OC)C 27a_100015525214_100012500371 [0,0,0,0,0,0|4,0,0]=4 75 B12R1.286 CCNc1ncc(c(n1)OC)N 27a_100015525214_100012122185 [0,0,0,0,0,0|4,0,0]=4 76 B12R1.286 CCOc1cc(c(cn1)O)C=O 271570a_203496583355_200010223332 [0,0,0,0,0,0|4,0,0]=4 77 B12R1.286 CCOc1ccc(c(c1)C#N)Br 34a_100009818209_100000210202 [0,0,0,0,0,0|4,0,0]=4 78 B12R1.286 CCOc1ccc(c(c1)C#N)Br 7a_100009818209_100000210202 [0,0,0,0,0,0|4,0,0]=4 79 B12R1.286 CCOc1ccc(c(c1)C#N)Cl 34a_100000092820_100000210202 [0,0,0,0,0,0|4,0,0]=4 80 B12R1.286 CCOc1ccc(c(c1)C#N)Cl 7a_100000092820_100000210202 [0,0,0,0,0,0|4,0,0]=4 81 B12R1.286 CCOc1ccc(c(c1)C#N)F 34a_100000070142_100000210202 [0,0,0,0,0,0|4,0,0]=4 82 B12R1.286 CCOc1ccc(c(c1)C#N)F 7a_100000070142_100000210202 [0,0,0,0,0,0|4,0,0]=4 83 B12R1.286 CCOc1ccc(c(c1)C#N)N 34a_200011997737_100000210202 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.286 CCOc1ccc(c(c1)C#N)N 7a_200011997737_100000210202 [0,0,0,0,0,0|4,0,0]=4 85 B12R1.286 CCOc1ccc(c(c1)C=O)O 271570a_203496583355_100012345016 [0,0,0,0,0,0|3,0,0]=3 86 B12R1.286 CCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000210202 [0,0,0,0,0,0|3,0,0]=3 87 B12R1.286 CCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000210202 [0,0,0,0,0,0|3,0,0]=3 88 B12R1.286 CCOc1ccc(c(c1)CN)C 34a_200009844824_100000210202 [0,0,0,0,0,0|4,0,0]=4 89 B12R1.286 CCOc1ccc(c(c1)CO)Br 34a_100012351483_100000210202 [0,0,0,0,0,0|4,0,0]=4 90 B12R1.286 CCOc1ccc(c(c1)CO)Br 7a_100012351483_100000210202 [0,0,0,0,0,0|4,0,0]=4 91 B12R1.286 CCOc1ccc(c(c1)CO)C 34a_100009878257_100000210202 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.286 CCOc1ccc(c(c1)CO)C 7a_100009878257_100000210202 [0,0,0,0,0,0|4,0,0]=4 93 B12R1.286 CCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000210202 [0,0,0,0,0,0|4,0,0]=4 94 B12R1.286 CCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000210202 [0,0,0,0,0,0|4,0,0]=4 95 B12R1.286 CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210202 [0,0,0,0,0,0|2,0,0]=2 96 B12R1.286 CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210202 [0,0,0,0,0,0|2,0,0]=2 97 B12R1.286 CCOc1ccc(c(c1)OC)C 34a_100009865632_100000210202 [0,0,0,0,0,0|2,0,0]=2 98 B12R1.286 CCOc1ccc(c(c1)OC)C 7a_100009865632_100000210202 [0,0,0,0,0,0|2,0,0]=2 99 B12R1.286 CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210202 [0,0,0,0,0,0|2,0,0]=2 100 B12R1.286 CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210202 [0,0,0,0,0,0|2,0,0]=2 101 B12R1.286 CCOc1ccc(c(c1)OC)F 34a_100012001760_100000210202 [0,0,0,0,0,0|2,0,0]=2 102 B12R1.286 CCOc1ccc(c(c1)OC)F 7a_100012001760_100000210202 [0,0,0,0,0,0|2,0,0]=2 103 B12R1.286 CCOc1ccc(c(c1)OC)N 34a_100015326901_100000210202 [0,0,0,0,0,0|2,0,0]=2 104 B12R1.286 CCOc1ccc(c(c1)OC)N 7a_100015326901_100000210202 [0,0,0,0,0,0|2,0,0]=2 105 B12R1.286 CCOc1ccc(c(c1)SC)C 62a_200000210301_100011099959 [0,0,0,0,0,0|2,1,0]=3 106 B12R1.286 CCOc1ccc(c(c1)S[13CH3])C 62a_200025704644_100011099959 [0,0,0,0,0,0|2,1,0]=3 107 B12R1.286 CCSc1c[nH]c(=O)c(c1)OC 62a_100000210202_100010125397 [0,0,0,0,0,0|2,0,1]=3 108 B12R1.286 CCSc1cc(c(cn1)C)OC 62a_100000210202_100010067687 [0,0,0,0,0,0|3,0,0]=3 109 B12R1.286 CCSc1cc(c(cn1)C)OC 62a_100010067687_100000210202 [0,0,0,0,0,0|3,0,0]=3 110 B12R1.286 CCSc1cc(c(cn1)F)OC 62a_100000210202_200010136270 [0,0,0,0,0,0|3,0,0]=3 111 B12R1.286 CCSc1cc(c(cn1)F)OC 62a_200010136270_100000210202 [0,0,0,0,0,0|3,0,0]=3 112 B12R1.286 CCSc1cc(c(cn1)N)OC 62a_100000210202_100009887741 [0,0,0,0,0,0|3,0,0]=3 113 B12R1.286 CCSc1cc(c(cn1)N)OC 62a_100009887741_100000210202 [0,0,0,0,0,0|3,0,0]=3 114 B12R1.286 CCSc1cc(c(cn1)O)C=O 62a_100000210202_100000048449 [0,0,0,0,0,0|4,0,0]=4 115 B12R1.286 CCSc1cc(c(nn1)N)OC 62a_100000210202_100000688033 [0,0,0,0,0,0|4,0,0]=4 116 B12R1.286 CCSc1cc(c(nn1)N)OC 62a_100000688033_100000210202 [0,0,0,0,0,0|4,0,0]=4 117 B12R1.286 CCSc1ccc(=O)n(c1)CC 62a_100000210202_100000231005 [0,0,0,0,0,0|3,0,1]=4 118 B12R1.286 CCSc1ccc(=O)n(c1)CC 62a_100000231005_100000210202 [0,0,0,0,0,0|3,0,1]=4 119 B12R1.286 CCSc1ccc(c(c1)C#N)Br 62a_100000210202_100012355174 [0,0,0,0,0,0|4,0,0]=4 120 B12R1.286 CCSc1ccc(c(c1)C#N)Br 62a_100012355174_100000210202 [0,0,0,0,0,0|4,0,0]=4 121 B12R1.286 CCSc1ccc(c(c1)C#N)C 62a_100000210202_100011356939 [0,0,0,0,0,0|4,0,0]=4 122 B12R1.286 CCSc1ccc(c(c1)C#N)Cl 62a_100000210202_100011356831 [0,0,0,0,0,0|4,0,0]=4 123 B12R1.286 CCSc1ccc(c(c1)C#N)F 62a_100000210202_100000037165 [0,0,0,0,0,0|4,0,0]=4 124 B12R1.286 CCSc1ccc(c(c1)C#N)N 62a_100000210202_100000688460 [0,0,0,0,0,0|4,0,0]=4 125 B12R1.286 CCSc1ccc(c(c1)C#N)O 62a_100000210202_100000687585 [0,0,0,0,0,0|3,0,0]=3 126 B12R1.286 CCSc1ccc(c(c1)C=O)Br 62a_100000210202_100010185652 [0,0,0,0,0,0|4,0,0]=4 127 B12R1.286 CCSc1ccc(c(c1)C=O)Br 62a_100010185652_100000210202 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.286 CCSc1ccc(c(c1)C=O)C 62a_100000210202_100011361606 [0,0,0,0,0,0|4,0,0]=4 129 B12R1.286 CCSc1ccc(c(c1)C=O)C 62a_100011361606_100000210202 [0,0,0,0,0,0|4,0,0]=4 130 B12R1.286 CCSc1ccc(c(c1)C=O)Cl 62a_100000210202_100010254384 [0,0,0,0,0,0|4,0,0]=4 131 B12R1.286 CCSc1ccc(c(c1)C=O)Cl 62a_100010254384_100000210202 [0,0,0,0,0,0|4,0,0]=4 132 B12R1.286 CCSc1ccc(c(c1)C=O)F 62a_100000050626_100000210202 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.286 CCSc1ccc(c(c1)C=O)F 62a_100000210202_100000050626 [0,0,0,0,0,0|4,0,0]=4 134 B12R1.286 CCSc1ccc(c(c1)C=O)N 62a_100011935258_100000210202 [0,0,0,0,0,0|4,0,0]=4 135 B12R1.286 CCSc1ccc(c(c1)C=O)O 62a_100000210202_100000186750 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.286 CCSc1ccc(c(c1)CC)Br 62a_100000210202_100010244631 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.286 CCSc1ccc(c(c1)CC)Br 62a_100010244631_100000210202 [0,0,0,0,0,0|3,0,0]=3 138 B12R1.286 CCSc1ccc(c(c1)CC)F 62a_100000210202_100010244625 [0,0,0,0,0,0|3,0,0]=3 139 B12R1.286 CCSc1ccc(c(c1)CC)F 62a_100010244625_100000210202 [0,0,0,0,0,0|3,0,0]=3 140 B12R1.286 CCSc1ccc(c(c1)CC)N 62a_100000210202_100000686106 [0,0,0,0,0,0|3,0,0]=3 141 B12R1.286 CCSc1ccc(c(c1)CC)N 62a_100000686106_100000210202 [0,0,0,0,0,0|3,0,0]=3 142 B12R1.286 CCSc1ccc(c(c1)CC)O 62a_100000210202_100012338938 [0,0,0,0,0,0|2,0,0]=2 143 B12R1.286 CCSc1ccc(c(c1)CN)F 62a_100000210202_100009815772 [0,0,0,0,0,0|4,0,0]=4 144 B12R1.286 CCSc1ccc(c(c1)CN)F 62a_100009815772_100000210202 [0,0,0,0,0,0|4,0,0]=4 145 B12R1.286 CCSc1ccc(c(c1)CN)N 62a_100000210202_100012349119 [0,0,0,0,0,0|4,0,0]=4 146 B12R1.286 CCSc1ccc(c(c1)CN)N 62a_100012349119_100000210202 [0,0,0,0,0,0|4,0,0]=4 147 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000210202_100000730032 [0,0,0,0,0,0|3,0,0]=3 148 B12R1.286 CCSc1ccc(c(c1)CN)O 62a_100000730032_100000210202 [0,0,0,0,0,0|3,0,0]=3 149 B12R1.286 CCSc1ccc(c(c1)CO)Br 62a_100000210202_100012359683 [0,0,0,0,0,0|4,0,0]=4 150 B12R1.286 CCSc1ccc(c(c1)CO)Br 62a_100012359683_100000210202 [0,0,0,0,0,0|4,0,0]=4 151 B12R1.286 CCSc1ccc(c(c1)CO)C 62a_100000210202_100000700630 [0,0,0,0,0,0|4,0,0]=4 152 B12R1.286 CCSc1ccc(c(c1)CO)C 62a_100000700630_100000210202 [0,0,0,0,0,0|4,0,0]=4 153 B12R1.286 CCSc1ccc(c(c1)CO)Cl 62a_100000210202_100010128486 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.286 CCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000210202 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.286 CCSc1ccc(c(c1)CO)F 62a_100000210202_100000246282 [0,0,0,0,0,0|4,0,0]=4 156 B12R1.286 CCSc1ccc(c(c1)CO)F 62a_100000246282_100000210202 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.286 CCSc1ccc(c(c1)CO)N 62a_100000210202_100012353972 [0,0,0,0,0,0|4,0,0]=4 158 B12R1.286 CCSc1ccc(c(c1)CO)N 62a_100012353972_100000210202 [0,0,0,0,0,0|4,0,0]=4 159 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000184703_100000210202 [0,0,0,0,0,0|3,0,0]=3 160 B12R1.286 CCSc1ccc(c(c1)CO)O 62a_100000210202_100000184703 [0,0,0,0,0,0|3,0,0]=3 161 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100000210202_100020629602 [0,0,0,0,0,0|3,0,0]=3 162 B12R1.286 CCSc1ccc(c(c1)NC)C 62a_100020629602_100000210202 [0,0,0,0,0,0|3,0,0]=3 163 B12R1.286 CCSc1ccc(c(c1)NC)F 62a_100000210202_100011314990 [0,0,0,0,0,0|3,0,0]=3 164 B12R1.286 CCSc1ccc(c(c1)NC)F 62a_100011314990_100000210202 [0,0,0,0,0,0|3,0,0]=3 165 B12R1.286 CCSc1ccc(c(c1)NC)N 62a_100000694363_100000210202 [0,0,0,0,0,0|3,0,0]=3 166 B12R1.286 CCSc1ccc(c(c1)NN)F 62a_100000210202_100020610843 [0,0,0,0,0,0|4,0,0]=4 167 B12R1.286 CCSc1ccc(c(c1)NN)F 62a_100020610843_100000210202 [0,0,0,0,0,0|4,0,0]=4 168 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100000210202_100012353699 [0,0,0,0,0,0|2,0,0]=2 169 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210202 [0,0,0,0,0,0|2,0,0]=2 170 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100000210202_100011830276 [0,0,0,0,0,0|2,0,0]=2 171 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210202 [0,0,0,0,0,0|2,0,0]=2 172 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100000210202_100011356853 [0,0,0,0,0,0|2,0,0]=2 173 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210202 [0,0,0,0,0,0|2,0,0]=2 174 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100000210202_100011934186 [0,0,0,0,0,0|2,0,0]=2 175 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210202 [0,0,0,0,0,0|2,0,0]=2 176 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100000210202_100015196925 [0,0,0,0,0,0|2,0,0]=2 177 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210202 [0,0,0,0,0,0|2,0,0]=2 178 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [0,0,0,0,0,0|1,0,0]=1 179 B12R1.286 CCSc1ccc(c(c1)SC)F 62a_100000210202_100010341305 [0,0,0,0,0,0|2,1,0]=3 180 B12R1.286 CCSc1ccc(c(c1)SC)F 62a_100010341305_100000210202 [0,0,0,0,0,0|2,1,0]=3 181 B12R1.286 CCSc1ccc(c(n1)CC)N 62a_100000210202_100009871203 [0,0,0,0,0,0|4,0,0]=4 182 B12R1.286 CCSc1ccc(c(n1)CC)N 62a_100009871203_100000210202 [0,0,0,0,0,0|4,0,0]=4 183 B12R1.286 CCSc1ccc(c(n1)OC)N 62a_100000210202_100000687816 [0,0,0,0,0,0|3,0,0]=3 184 B12R1.286 CCSc1ccc(c(n1)OC)N 62a_100000687816_100000210202 [0,0,0,0,0,0|3,0,0]=3 185 B12R1.286 CCSc1ccc(c(n1)OC)O 62a_100000210202_100010893133 [0,0,0,0,0,0|2,0,0]=2 186 B12R1.286 CCSc1cnc(c(c1)C#N)O 62a_100000210202_100000697733 [0,0,0,0,0,0|4,0,0]=4 187 B12R1.286 CCSc1cnc(c(c1)C=O)O 62a_100000210202_100010064889 [0,0,0,0,0,0|4,0,0]=4 188 B12R1.286 CCSc1cnc(c(c1)C=O)O 62a_100010064889_100000210202 [0,0,0,0,0,0|4,0,0]=4 189 B12R1.286 CCSc1cnc(c(c1)CO)O 62a_100000210202_100010065268 [0,0,0,0,0,0|4,0,0]=4 190 B12R1.286 CCSc1cnc(c(c1)CO)O 62a_100010065268_100000210202 [0,0,0,0,0,0|4,0,0]=4 191 B12R1.286 CCSc1cnc(c(c1)NC)N 62a_100000210202_100010506235 [0,0,0,0,0,0|4,0,0]=4 192 B12R1.286 CCSc1cnc(c(c1)NC)N 62a_100010506235_100000210202 [0,0,0,0,0,0|4,0,0]=4 193 B12R1.286 CCSc1cnc(c(c1)OC)C 62a_100000210202_100010254219 [0,0,0,0,0,0|3,0,0]=3 194 B12R1.286 CCSc1cnc(c(c1)OC)C 62a_100010254219_100000210202 [0,0,0,0,0,0|3,0,0]=3 195 B12R1.286 CCSc1cnc(c(c1)OC)F 62a_100000210202_100010214931 [0,0,0,0,0,0|3,0,0]=3 196 B12R1.286 CCSc1cnc(c(c1)OC)F 62a_100010214931_100000210202 [0,0,0,0,0,0|3,0,0]=3 197 B12R1.286 CCSc1cnc(c(c1)OC)N 62a_100000210202_106354213024 [0,0,0,0,0,0|3,0,0]=3 198 B12R1.286 CCSc1cnc(c(c1)OC)N 62a_106354213024_100000210202 [0,0,0,0,0,0|3,0,0]=3 199 B12R1.286 CCSc1cnc(c(n1)OC)N 62a_100000210202_100009816943 [0,0,0,0,0,0|4,0,0]=4 200 B12R1.286 CCSc1cnc(c(n1)OC)N 62a_100009816943_100000210202 [0,0,0,0,0,0|4,0,0]=4 201 B12R1.286 CCSc1cnc(c(n1)OC)O 62a_100000210202_200010365344 [0,0,0,0,0,0|3,0,0]=3 202 B12R1.286 CCSc1cnc(c(n1)OC)O 62a_200010365344_100000210202 [0,0,0,0,0,0|3,0,0]=3 203 B12R1.286 CCSc1ncc(c(n1)OC)C 62a_100000210202_100012500371 [0,0,0,0,0,0|4,0,0]=4 204 B12R1.286 CCSc1ncc(c(n1)OC)C 62a_100012500371_100000210202 [0,0,0,0,0,0|4,0,0]=4 205 B12R1.286 CCSc1ncc(c(n1)OC)F 62a_100000210202_100012183945 [0,0,0,0,0,0|4,0,0]=4 206 B12R1.286 CCSc1ncc(c(n1)OC)F 62a_100012183945_100000210202 [0,0,0,0,0,0|4,0,0]=4 207 B12R1.286 CCSc1ncc(c(n1)OC)N 62a_100000210202_100012122185 [0,0,0,0,0,0|4,0,0]=4 208 B12R1.286 CCSc1ncc(c(n1)OC)N 62a_100012122185_100000210202 [0,0,0,0,0,0|4,0,0]=4 209 B12R1.286 CCc1cc(ccc1Br)NCF 34a_100010109747_100015361967 [0,0,0,0,0,0|4,0,0]=4 210 B12R1.286 CCc1cc(ccc1Br)NCF 7a_100010109747_100015361967 [0,0,0,0,0,0|4,0,0]=4 211 B12R1.286 CCc1cc(ccc1Br)SCF 62a_100010244631_100015361967 [0,0,0,0,0,0|4,0,0]=4 212 B12R1.286 CCc1cc(ccc1Br)SCF 62a_100015361967_100010244631 [0,0,0,0,0,0|4,0,0]=4 213 B12R1.286 CCc1cc(ccc1Cl)CNC 26a_100102657272_100000212063 [0,0,0,0,0,0|3,0,0]=3 214 B12R1.286 CCc1cc(ccc1Cl)OCF 34a_100000212063_100015361967 [0,0,0,0,0,0|4,0,0]=4 215 B12R1.286 CCc1cc(ccc1Cl)OCF 7a_100000212063_100015361967 [0,0,0,0,0,0|4,0,0]=4 216 B12R1.286 CCc1cc(ccc1F)CNC 207a_100102657272_100009840867 [0,0,0,0,0,0|3,0,0]=3 217 B12R1.286 CCc1cc(ccc1F)CNC 2230a_114873767189_200000210301 [0,0,0,0,0,0|3,0,0]=3 218 B12R1.286 CCc1cc(ccc1F)CNC 269862a_106832991636_100009840867 [0,0,0,0,0,0|3,0,0]=3 219 B12R1.286 CCc1cc(ccc1F)CNC 270004a_106832991635_100009840867 [0,0,0,0,0,0|3,0,0]=3 220 B12R1.286 CCc1cc(ccc1F)CNC 34a_114873767189_200000210301 [0,0,0,0,0,0|3,0,0]=3 221 B12R1.286 CCc1cc(ccc1F)CN[13CH3] 2230a_114873767189_200025704644 [0,0,0,0,0,0|3,0,0]=3 222 B12R1.286 CCc1cc(ccc1F)CN[13CH3] 34a_114873767189_200025704644 [0,0,0,0,0,0|3,0,0]=3 223 B12R1.286 CCc1cc(ccc1F)SCF 62a_100010244625_100015361967 [0,0,0,0,0,0|4,0,0]=4 224 B12R1.286 CCc1cc(ccc1F)SCF 62a_100015361967_100010244625 [0,0,0,0,0,0|4,0,0]=4 225 B12R1.286 CCc1cc(ccc1N)SCF 62a_100000686106_100015361967 [0,0,0,0,0,0|4,0,0]=4 226 B12R1.286 CCc1cc(ccc1N)SCF 62a_100015361967_100000686106 [0,0,0,0,0,0|4,0,0]=4 227 B12R1.286 CCc1cc(ccc1O)SCF 62a_100015361967_100012338938 [0,0,0,0,0,0|3,0,0]=3 228 B12R1.286 CNCc1ccc(c(c1)C#N)Br 2230a_106832991635_100010128727 [0,0,0,0,0,0|4,0,0]=4 229 B12R1.286 CNCc1ccc(c(c1)C#N)Br 26a_100102657272_100009818209 [0,0,0,0,0,0|4,0,0]=4 230 B12R1.286 CNCc1ccc(c(c1)C#N)Br 7a_106832991635_100010128727 [0,0,0,0,0,0|4,0,0]=4 231 B12R1.286 CNCc1ccc(c(c1)C#N)C 207a_100102657272_100012017333 [0,0,0,0,0,0|4,0,0]=4 232 B12R1.286 CNCc1ccc(c(c1)C#N)C 270004a_106832991635_100012017333 [0,0,0,0,0,0|4,0,0]=4 233 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 2230a_106832991635_100010147165 [0,0,0,0,0,0|4,0,0]=4 234 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 26a_100102657272_100000092820 [0,0,0,0,0,0|4,0,0]=4 235 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 34a_100009846983_200000210301 [0,0,0,0,0,0|4,0,0]=4 236 B12R1.286 CNCc1ccc(c(c1)C#N)Cl 7a_106832991635_100010147165 [0,0,0,0,0,0|4,0,0]=4 237 B12R1.286 CNCc1ccc(c(c1)C#N)F 2230a_106832991635_100000687583 [0,0,0,0,0,0|4,0,0]=4 238 B12R1.286 CNCc1ccc(c(c1)C#N)F 34a_100016992121_200000210301 [0,0,0,0,0,0|4,0,0]=4 239 B12R1.286 CNCc1ccc(c(c1)C#N)F 7a_106832991635_100000687583 [0,0,0,0,0,0|4,0,0]=4 240 B12R1.286 CNCc1ccc(c(c1)C=O)O 7a_106832991635_100000008128 [0,0,0,0,0,0|3,0,0]=3 241 B12R1.286 CNCc1ccc(c(c1)CO)Br 207a_100102657272_100015639582 [0,0,0,0,0,0|4,0,0]=4 242 B12R1.286 CNCc1ccc(c(c1)CO)Br 26a_100102657272_100012351483 [0,0,0,0,0,0|4,0,0]=4 243 B12R1.286 CNCc1ccc(c(c1)CO)Br 270004a_106832991635_100015639582 [0,0,0,0,0,0|4,0,0]=4 244 B12R1.286 CNCc1ccc(c(c1)CO)Cl 26a_100102657272_100000091669 [0,0,0,0,0,0|4,0,0]=4 245 B12R1.286 CNCc1ccc(c(c1)OC)Br 207a_100102657272_100010244714 [0,0,0,0,0,0|2,0,0]=2 246 B12R1.286 CNCc1ccc(c(c1)OC)Br 2230a_106832991635_100010110085 [0,0,0,0,0,0|2,0,0]=2 247 B12R1.286 CNCc1ccc(c(c1)OC)Br 26a_100102657272_100011827694 [0,0,0,0,0,0|2,0,0]=2 248 B12R1.286 CNCc1ccc(c(c1)OC)Br 270004a_106832991635_100010244714 [0,0,0,0,0,0|2,0,0]=2 249 B12R1.286 CNCc1ccc(c(c1)OC)Br 34a_100102657272_100010110085 [0,0,0,0,0,0|2,0,0]=2 250 B12R1.286 CNCc1ccc(c(c1)OC)Br 7a_106832991635_100010110085 [0,0,0,0,0,0|2,0,0]=2 251 B12R1.286 CNCc1ccc(c(c1)OC)C 207a_100102657272_100000719150 [0,0,0,0,0,0|2,0,0]=2 252 B12R1.286 CNCc1ccc(c(c1)OC)C 270004a_106832991635_100000719150 [0,0,0,0,0,0|2,0,0]=2 253 B12R1.286 CNCc1ccc(c(c1)OC)Cl 207a_100102657272_100011998524 [0,0,0,0,0,0|2,0,0]=2 254 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_200000210301 [0,0,0,0,0,0|2,0,0]=2 255 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_106832991635_200010214485 [0,0,0,0,0,0|2,0,0]=2 256 B12R1.286 CNCc1ccc(c(c1)OC)Cl 26a_100102657272_100012186310 [0,0,0,0,0,0|2,0,0]=2 257 B12R1.286 CNCc1ccc(c(c1)OC)Cl 270004a_106832991635_100011998524 [0,0,0,0,0,0|2,0,0]=2 258 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100015204853_200000210301 [0,0,0,0,0,0|2,0,0]=2 259 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100102657272_200010214485 [0,0,0,0,0,0|2,0,0]=2 260 B12R1.286 CNCc1ccc(c(c1)OC)Cl 7a_106832991635_200010214485 [0,0,0,0,0,0|2,0,0]=2 261 B12R1.286 CNCc1ccc(c(c1)OC)F 207a_100102657272_100000692873 [0,0,0,0,0,0|2,0,0]=2 262 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_100020626639_200000210301 [0,0,0,0,0,0|2,0,0]=2 263 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_106832991635_100012349856 [0,0,0,0,0,0|2,0,0]=2 264 B12R1.286 CNCc1ccc(c(c1)OC)F 270004a_106832991635_100000692873 [0,0,0,0,0,0|2,0,0]=2 265 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100020626639_200000210301 [0,0,0,0,0,0|2,0,0]=2 266 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100102657272_100012349856 [0,0,0,0,0,0|2,0,0]=2 267 B12R1.286 CNCc1ccc(c(c1)OC)F 7a_106832991635_100012349856 [0,0,0,0,0,0|2,0,0]=2 268 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [0,0,0,0,0,0|1,0,0]=1 269 B12R1.286 CNCc1ccc(c(n1)OC)Br 2230a_106832991635_200010066506 [0,0,0,0,0,0|3,0,0]=3 270 B12R1.286 CNCc1ccc(c(n1)OC)Br 34a_100102657272_200010066506 [0,0,0,0,0,0|3,0,0]=3 271 B12R1.286 CNCc1ccc(c(n1)OC)Br 7a_106832991635_200010066506 [0,0,0,0,0,0|3,0,0]=3 272 B12R1.286 CNc1cc(ccc1Br)COC 34a_200013033220_200000210301 [0,0,0,0,0,0|3,0,0]=3 273 B12R1.286 CNc1cc(ccc1C)SCF 62a_100015361967_100020629602 [0,0,0,0,0,0|4,0,0]=4 274 B12R1.286 CNc1cc(ccc1C)SCF 62a_100020629602_100015361967 [0,0,0,0,0,0|4,0,0]=4 275 B12R1.286 CNc1cc(ccc1F)SCF 62a_100011314990_100015361967 [0,0,0,0,0,0|4,0,0]=4 276 B12R1.286 CNc1cc(ccc1F)SCF 62a_100015361967_100011314990 [0,0,0,0,0,0|4,0,0]=4 277 B12R1.286 CNc1cc(ccc1N)SCF 62a_100000694363_100015361967 [0,0,0,0,0,0|4,0,0]=4 278 B12R1.286 COCc1cc(c(cn1)Br)OC 34a_100010999569_200000210301 [0,0,0,0,0,0|3,0,0]=3 279 B12R1.286 COCc1ccc(c(c1)C#N)Br 34a_100010145894_200000210301 [0,0,0,0,0,0|4,0,0]=4 280 B12R1.286 COCc1ccc(c(c1)C#N)Br 7a_100010145894_200000210301 [0,0,0,0,0,0|4,0,0]=4 281 B12R1.286 COCc1ccc(c(c1)C#N)F 34a_100011220027_200000210301 [0,0,0,0,0,0|4,0,0]=4 282 B12R1.286 COCc1ccc(c(c1)C#N)F 7a_100011220027_200000210301 [0,0,0,0,0,0|4,0,0]=4 283 B12R1.286 COCc1ccc(c(c1)N[13CH3])Br 34a_200013033220_200025704644 [0,0,0,0,0,0|3,0,0]=3 284 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100010234685_200000210301 [0,0,0,0,0,0|2,0,0]=2 285 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100138415774_100010110085 [0,0,0,0,0,0|2,0,0]=2 286 B12R1.286 COCc1ccc(c(c1)OC)Br 7a_100010234685_200000210301 [0,0,0,0,0,0|2,0,0]=2 287 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [0,0,0,0,0,0|2,0,0]=2 288 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [0,0,0,0,0,0|2,0,0]=2 289 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100012179228_200000210301 [0,0,0,0,0,0|2,0,0]=2 290 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100138415774_200010214485 [0,0,0,0,0,0|2,0,0]=2 291 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100000692429_200000210301 [0,0,0,0,0,0|2,0,0]=2 292 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100138415774_100012349856 [0,0,0,0,0,0|2,0,0]=2 293 B12R1.286 COCc1ccc(c(c1)OC)F 7a_100000692429_200000210301 [0,0,0,0,0,0|2,0,0]=2 294 B12R1.286 COCc1ccc(c(c1)OC)N 34a_100000087641_200000210301 [0,0,0,0,0,0|2,0,0]=2 295 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200000210301_200015395492 [0,0,0,0,0,0|2,1,0]=3 296 B12R1.286 COCc1ccc(c(c1)SC)C 62a_200015395492_200000210301 [0,0,0,0,0,0|2,1,0]=3 297 B12R1.286 COCc1ccc(c(c1)SC)F 62a_200000210301_200011493689 [0,0,0,0,0,0|2,1,0]=3 298 B12R1.286 COCc1ccc(c(c1)SC)F 62a_200011493689_200000210301 [0,0,0,0,0,0|2,1,0]=3 299 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200015395492_200025704644 [0,0,0,0,0,0|2,1,0]=3 300 B12R1.286 COCc1ccc(c(c1)S[13CH3])C 62a_200025704644_200015395492 [0,0,0,0,0,0|2,1,0]=3 301 B12R1.286 COCc1ccc(c(c1)S[13CH3])F 62a_200011493689_200025704644 [0,0,0,0,0,0|2,1,0]=3 302 B12R1.286 COCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200011493689 [0,0,0,0,0,0|2,1,0]=3 303 B12R1.286 COCc1ccc(c(n1)OC)Br 34a_100138415774_200010066506 [0,0,0,0,0,0|3,0,0]=3 304 B12R1.286 COc1cc(c[nH]c1=O)SCF 62a_100015361967_100010125397 [0,0,0,0,0,0|3,0,1]=4 305 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 34a_100010234685_200025704644 [0,0,0,0,0,0|2,0,0]=2 306 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 7a_100010234685_200025704644 [0,0,0,0,0,0|2,0,0]=2 307 B12R1.286 COc1cc(ccc1Br)CSC 62a_100010110085_200000210301 [0,0,0,0,0,0|2,0,0]=2 308 B12R1.286 COc1cc(ccc1Br)CSC 62a_200000210301_100010110085 [0,0,0,0,0,0|2,0,0]=2 309 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_100010110085_200025704644 [0,0,0,0,0,0|2,0,0]=2 310 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100010110085 [0,0,0,0,0,0|2,0,0]=2 311 B12R1.286 COc1cc(ccc1Br)NCF 34a_100000765947_100015361967 [0,0,0,0,0,0|3,0,0]=3 312 B12R1.286 COc1cc(ccc1Br)OCF 34a_100011827694_100015361967 [0,0,0,0,0,0|3,0,0]=3 313 B12R1.286 COc1cc(ccc1Br)OCF 7a_100011827694_100015361967 [0,0,0,0,0,0|3,0,0]=3 314 B12R1.286 COc1cc(ccc1Br)SCF 62a_100012353699_100015361967 [0,0,0,0,0,0|3,0,0]=3 315 B12R1.286 COc1cc(ccc1Br)SCF 62a_100015361967_100012353699 [0,0,0,0,0,0|3,0,0]=3 316 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [0,0,0,0,0,0|2,0,0]=2 317 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [0,0,0,0,0,0|2,0,0]=2 318 B12R1.286 COc1cc(ccc1C)NCF 34a_100011279678_100015361967 [0,0,0,0,0,0|3,0,0]=3 319 B12R1.286 COc1cc(ccc1C)OCF 34a_100009865632_100015361967 [0,0,0,0,0,0|3,0,0]=3 320 B12R1.286 COc1cc(ccc1C)OCF 7a_100009865632_100015361967 [0,0,0,0,0,0|3,0,0]=3 321 B12R1.286 COc1cc(ccc1C)SCF 62a_100011830276_100015361967 [0,0,0,0,0,0|3,0,0]=3 322 B12R1.286 COc1cc(ccc1C)SCF 62a_100015361967_100011830276 [0,0,0,0,0,0|3,0,0]=3 323 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 2230a_100015204853_200025704644 [0,0,0,0,0,0|2,0,0]=2 324 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 34a_100015204853_200025704644 [0,0,0,0,0,0|2,0,0]=2 325 B12R1.286 COc1cc(ccc1Cl)CO[13CH3] 34a_100012179228_200025704644 [0,0,0,0,0,0|2,0,0]=2 326 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200000210301_200010214485 [0,0,0,0,0,0|2,0,0]=2 327 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200010214485_200000210301 [0,0,0,0,0,0|2,0,0]=2 328 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200010214485_200025704644 [0,0,0,0,0,0|2,0,0]=2 329 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_200010214485 [0,0,0,0,0,0|2,0,0]=2 330 B12R1.286 COc1cc(ccc1Cl)NCF 34a_100000742311_100015361967 [0,0,0,0,0,0|3,0,0]=3 331 B12R1.286 COc1cc(ccc1Cl)OCF 34a_100012186310_100015361967 [0,0,0,0,0,0|3,0,0]=3 332 B12R1.286 COc1cc(ccc1Cl)OCF 7a_100012186310_100015361967 [0,0,0,0,0,0|3,0,0]=3 333 B12R1.286 COc1cc(ccc1Cl)SCF 62a_100011356853_100015361967 [0,0,0,0,0,0|3,0,0]=3 334 B12R1.286 COc1cc(ccc1Cl)SCF 62a_100015361967_100011356853 [0,0,0,0,0,0|3,0,0]=3 335 B12R1.286 COc1cc(ccc1F)CN[13CH3] 2230a_100020626639_200025704644 [0,0,0,0,0,0|2,0,0]=2 336 B12R1.286 COc1cc(ccc1F)CN[13CH3] 34a_100020626639_200025704644 [0,0,0,0,0,0|2,0,0]=2 337 B12R1.286 COc1cc(ccc1F)CO[13CH3] 34a_100000692429_200025704644 [0,0,0,0,0,0|2,0,0]=2 338 B12R1.286 COc1cc(ccc1F)CO[13CH3] 7a_100000692429_200025704644 [0,0,0,0,0,0|2,0,0]=2 339 B12R1.286 COc1cc(ccc1F)CSC 62a_100012349856_200000210301 [0,0,0,0,0,0|2,0,0]=2 340 B12R1.286 COc1cc(ccc1F)CSC 62a_200000210301_100012349856 [0,0,0,0,0,0|2,0,0]=2 341 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_100012349856_200025704644 [0,0,0,0,0,0|2,0,0]=2 342 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_200025704644_100012349856 [0,0,0,0,0,0|2,0,0]=2 343 B12R1.286 COc1cc(ccc1F)NCF 34a_100000701188_100015361967 [0,0,0,0,0,0|3,0,0]=3 344 B12R1.286 COc1cc(ccc1F)OCF 34a_100012001760_100015361967 [0,0,0,0,0,0|3,0,0]=3 345 B12R1.286 COc1cc(ccc1F)OCF 7a_100012001760_100015361967 [0,0,0,0,0,0|3,0,0]=3 346 B12R1.286 COc1cc(ccc1F)SCF 62a_100011934186_100015361967 [0,0,0,0,0,0|3,0,0]=3 347 B12R1.286 COc1cc(ccc1F)SCF 62a_100015361967_100011934186 [0,0,0,0,0,0|3,0,0]=3 348 B12R1.286 COc1cc(ccc1I)NCF 34a_100000746945_100015361967 [0,0,0,0,0,0|3,0,0]=3 349 B12R1.286 COc1cc(ccc1N)CO[13CH3] 34a_100000087641_200025704644 [0,0,0,0,0,0|2,0,0]=2 350 B12R1.286 COc1cc(ccc1N)OCF 34a_100015326901_100015361967 [0,0,0,0,0,0|3,0,0]=3 351 B12R1.286 COc1cc(ccc1N)OCF 7a_100015326901_100015361967 [0,0,0,0,0,0|3,0,0]=3 352 B12R1.286 COc1cc(ccc1N)SCF 62a_100011279103_100015361967 [0,0,0,0,0,0|3,0,0]=3 353 B12R1.286 COc1cc(ccc1N)SCF 62a_100015361967_100015196925 [0,0,0,0,0,0|3,0,0]=3 354 B12R1.286 COc1cc(ccc1O)CC#N 271570a_203496583355_100010176002 [0,0,0,0,0,0|1,0,1]=2 355 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [0,0,0,0,0,0|1,0,0]=1 356 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [0,0,0,0,0,0|2,0,0]=2 357 B12R1.286 COc1cc(ccc1O)SCF 62a_100015361967_100000694246 [0,0,0,0,0,0|2,0,0]=2 358 B12R1.286 COc1cc(cnc1C)SCF 62a_100010254219_100015361967 [0,0,0,0,0,0|4,0,0]=4 359 B12R1.286 COc1cc(cnc1C)SCF 62a_100015361967_100010254219 [0,0,0,0,0,0|4,0,0]=4 360 B12R1.286 COc1cc(cnc1F)SCF 62a_100010214931_100015361967 [0,0,0,0,0,0|4,0,0]=4 361 B12R1.286 COc1cc(cnc1F)SCF 62a_100015361967_100010214931 [0,0,0,0,0,0|4,0,0]=4 362 B12R1.286 COc1cc(cnc1N)SCF 62a_100015361967_106354213024 [0,0,0,0,0,0|4,0,0]=4 363 B12R1.286 COc1cc(cnc1N)SCF 62a_106354213024_100015361967 [0,0,0,0,0,0|4,0,0]=4 364 B12R1.286 COc1cc(ncc1Br)CO[13CH3] 34a_100010999569_200025704644 [0,0,0,0,0,0|3,0,0]=3 365 B12R1.286 COc1cc(ncc1C)SCF 62a_100010067687_100015361967 [0,0,0,0,0,0|4,0,0]=4 366 B12R1.286 COc1cc(ncc1C)SCF 62a_100015361967_100010067687 [0,0,0,0,0,0|4,0,0]=4 367 B12R1.286 COc1cc(ncc1F)SCF 62a_100015361967_200010136270 [0,0,0,0,0,0|4,0,0]=4 368 B12R1.286 COc1cc(ncc1F)SCF 62a_200010136270_100015361967 [0,0,0,0,0,0|4,0,0]=4 369 B12R1.286 COc1cc(ncc1N)SCF 62a_100009887741_100015361967 [0,0,0,0,0,0|4,0,0]=4 370 B12R1.286 COc1cc(ncc1N)SCF 62a_100015361967_100009887741 [0,0,0,0,0,0|4,0,0]=4 371 B12R1.286 COc1nc(ccc1Br)CSC 62a_200000210301_200010066506 [0,0,0,0,0,0|3,0,0]=3 372 B12R1.286 COc1nc(ccc1Br)CSC 62a_200010066506_200000210301 [0,0,0,0,0,0|3,0,0]=3 373 B12R1.286 COc1nc(ccc1Br)CS[13CH3] 62a_200010066506_200025704644 [0,0,0,0,0,0|3,0,0]=3 374 B12R1.286 COc1nc(ccc1Br)CS[13CH3] 62a_200025704644_200010066506 [0,0,0,0,0,0|3,0,0]=3 375 B12R1.286 COc1nc(ccc1N)SCF 62a_100000687816_100015361967 [0,0,0,0,0,0|4,0,0]=4 376 B12R1.286 COc1nc(ccc1N)SCF 62a_100015361967_100000687816 [0,0,0,0,0,0|4,0,0]=4 377 B12R1.286 COc1nc(ccc1O)SCF 62a_100015361967_100010893133 [0,0,0,0,0,0|3,0,0]=3 378 B12R1.286 COc1nc(cnc1O)SCF 62a_100015361967_200010365344 [0,0,0,0,0,0|4,0,0]=4 379 B12R1.286 COc1nc(cnc1O)SCF 62a_200010365344_100015361967 [0,0,0,0,0,0|4,0,0]=4 380 B12R1.286 CSCc1ccc(c(c1)C#N)Br 62a_100010128727_200000210301 [0,0,0,0,0,0|4,0,0]=4 381 B12R1.286 CSCc1ccc(c(c1)C#N)Br 62a_200000210301_100010128727 [0,0,0,0,0,0|4,0,0]=4 382 B12R1.286 CSCc1ccc(c(c1)C#N)Cl 62a_200000210301_100010147165 [0,0,0,0,0,0|4,0,0]=4 383 B12R1.286 CSCc1ccc(c(c1)C#N)F 62a_100000687583_200000210301 [0,0,0,0,0,0|4,0,0]=4 384 B12R1.286 CSCc1ccc(c(c1)C#N)F 62a_200000210301_100000687583 [0,0,0,0,0,0|4,0,0]=4 385 B12R1.286 CSCc1ccc(c(c1)C=O)O 62a_200000210301_100000008128 [0,0,0,0,0,0|3,0,0]=3 386 B12R1.286 CSc1cc(ccc1F)CC#N 62a_100000742998_200000210301 [0,0,0,0,0,0|2,1,1]=4 387 B12R1.286 CSc1cc(ccc1F)CC#N 62a_200000210301_100000742998 [0,0,0,0,0,0|2,1,1]=4 388 B12R1.286 CSc1cc(ccc1F)SCF 62a_100010341305_100015361967 [0,0,0,0,0,0|3,1,0]=4 389 B12R1.286 CSc1cc(ccc1F)SCF 62a_100015361967_100010341305 [0,0,0,0,0,0|3,1,0]=4 390 B12R1.286 CSc1cc(ccc1N)CC#N 62a_100010188563_200000210301 [0,0,0,0,0,0|2,1,1]=4 391 B12R1.286 CSc1cc(ccc1N)CC#N 62a_200000210301_100010188563 [0,0,0,0,0,0|2,1,1]=4 392 B12R1.286 N#Cc1cc(ccc1O)NCF 34a_100011249283_100015361967 [0,0,0,0,0,0|4,0,0]=4 393 B12R1.286 N#Cc1cc(ccc1O)SCF 62a_100015361967_100000687585 [0,0,0,0,0,0|4,0,0]=4 394 B12R1.286 NCc1cc(ccc1O)SCF 62a_100000730032_100015361967 [0,0,0,0,0,0|4,0,0]=4 395 B12R1.286 NCc1cc(ccc1O)SCF 62a_100015361967_100000730032 [0,0,0,0,0,0|4,0,0]=4 396 B12R1.286 O=Cc1cc(ccc1O)SCF 62a_100015361967_100000186750 [0,0,0,0,0,0|4,0,0]=4 397 B12R1.286 OCc1cc(ccc1O)SCF 62a_100000184703_100015361967 [0,0,0,0,0,0|4,0,0]=4 398 B12R1.286 OCc1cc(ccc1O)SCF 62a_100015361967_100000184703 [0,0,0,0,0,0|4,0,0]=4 399 B12R1.286 [13CH3]NCc1ccc(c(c1)C#N)Cl 34a_100009846983_200025704644 [0,0,0,0,0,0|4,0,0]=4 400 B12R1.286 [13CH3]NCc1ccc(c(c1)C#N)F 34a_100016992121_200025704644 [0,0,0,0,0,0|4,0,0]=4 401 B12R1.286 [13CH3]OCc1ccc(c(c1)C#N)Br 34a_100010145894_200025704644 [0,0,0,0,0,0|4,0,0]=4 402 B12R1.286 [13CH3]OCc1ccc(c(c1)C#N)Br 7a_100010145894_200025704644 [0,0,0,0,0,0|4,0,0]=4 403 B12R1.286 [13CH3]OCc1ccc(c(c1)C#N)F 34a_100011220027_200025704644 [0,0,0,0,0,0|4,0,0]=4 404 B12R1.286 [13CH3]OCc1ccc(c(c1)C#N)F 7a_100011220027_200025704644 [0,0,0,0,0,0|4,0,0]=4 405 B12R1.286 [13CH3]SCc1ccc(c(c1)C#N)Br 62a_100010128727_200025704644 [0,0,0,0,0,0|4,0,0]=4 406 B12R1.286 [13CH3]SCc1ccc(c(c1)C#N)Br 62a_200025704644_100010128727 [0,0,0,0,0,0|4,0,0]=4 407 B12R1.286 [13CH3]SCc1ccc(c(c1)C#N)Cl 62a_200025704644_100010147165 [0,0,0,0,0,0|4,0,0]=4 408 B12R1.286 [13CH3]SCc1ccc(c(c1)C#N)F 62a_100000687583_200025704644 [0,0,0,0,0,0|4,0,0]=4 409 B12R1.286 [13CH3]SCc1ccc(c(c1)C#N)F 62a_200025704644_100000687583 [0,0,0,0,0,0|4,0,0]=4 410 B12R1.286 [13CH3]SCc1ccc(c(c1)C=O)O 62a_200025704644_100000008128 [0,0,0,0,0,0|3,0,0]=3 411 B12R1.286 [13CH3]Sc1cc(ccc1F)CC#N 62a_100000742998_200025704644 [0,0,0,0,0,0|2,1,1]=4 412 B12R1.286 [13CH3]Sc1cc(ccc1F)CC#N 62a_200025704644_100000742998 [0,0,0,0,0,0|2,1,1]=4 413 B12R1.286 [13CH3]Sc1cc(ccc1N)CC#N 62a_100010188563_200025704644 [0,0,0,0,0,0|2,1,1]=4 414 B12R1.286 [13CH3]Sc1cc(ccc1N)CC#N 62a_200025704644_100010188563 [0,0,0,0,0,0|2,1,1]=4 415 B11R1.189 C#Cc1cccc(c1)CNC 207a_100102657272_100011361529 [1,0,0,0,0,0|2,0,1]=4 416 B11R1.189 C#Cc1cccc(c1)COC 34a_100010272118_200000210301 [1,0,0,0,0,0|2,0,1]=4 417 B11R1.189 C#Cc1cccc(c1)COC 7a_100010272118_200000210301 [1,0,0,0,0,0|2,0,1]=4 418 B11R1.189 C#Cc1cccc(c1)CO[13CH3] 34a_100010272118_200025704644 [1,0,0,0,0,0|2,0,1]=4 419 B11R1.189 C#Cc1cccc(c1)CO[13CH3] 7a_100010272118_200025704644 [1,0,0,0,0,0|2,0,1]=4 420 B11R1.189 C#Cc1cccc(c1)NCC 2230a_100000735509_100000210202 [1,0,0,0,0,0|2,0,1]=4 421 B11R1.189 C#Cc1cccc(c1)NCC 34a_100000735509_100000210202 [1,0,0,0,0,0|2,0,1]=4 422 B11R1.189 C#Cc1cccc(c1)OCC 34a_100011216014_100000210202 [1,0,0,0,0,0|2,0,1]=4 423 B11R1.189 C#Cc1cccc(c1)OCC 7a_100011216014_100000210202 [1,0,0,0,0,0|2,0,1]=4 424 B11R1.189 C=C=Cc1cccc(c1)OC 271570a_100015277604_100000170001 [1,0,0,0,0,0|0,0,3]=4 425 B11R1.189 C=CCc1cccc(c1)SC 62a_100009816576_200000210301 [1,0,0,0,0,0|0,1,2]=4 426 B11R1.189 C=CCc1cccc(c1)SC 62a_200000210301_100009816576 [1,0,0,0,0,0|0,1,2]=4 427 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_100009816576_200025704644 [1,0,0,0,0,0|0,1,2]=4 428 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_200025704644_100009816576 [1,0,0,0,0,0|0,1,2]=4 429 B11R1.189 C=Cc1cccc(c1)CCC 271570a_100011290941_100000694964 [1,0,0,0,0,0|1,0,1]=3 430 B11R1.189 C=Cc1cccc(c1)CCN 271570a_100011290941_100011207229 [1,0,0,0,0,0|2,0,1]=4 431 B11R1.189 C=Cc1cccc(c1)CCO 271570a_100011290941_100011217444 [1,0,0,0,0,0|2,0,1]=4 432 B11R1.189 C=Cc1cccc(c1)CNC 26a_100102657272_100011309434 [1,0,0,0,0,0|2,0,1]=4 433 B11R1.189 C=Cc1cccc(c1)CNC 270004a_106832991635_100011218069 [1,0,0,0,0,0|2,0,1]=4 434 B11R1.189 C=Cc1cccc(c1)CNC 271570a_100011290941_100000187585 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.189 C=Cc1cccc(c1)COC 271570a_100011290941_100011493687 [1,0,0,0,0,0|2,0,1]=4 436 B11R1.189 C=Cc1cccc(c1)NCC 271570a_100011290941_100000738899 [1,0,0,0,0,0|2,0,1]=4 437 B11R1.189 C=Cc1cccc(c1)NCC 34a_100011827668_100000210202 [1,0,0,0,0,0|2,0,1]=4 438 B11R1.189 C=Cc1cccc(c1)OCC 271570a_100011290941_100000170002 [1,0,0,0,0,0|2,0,1]=4 439 B11R1.189 C=Cc1cccc(c1)OCC 34a_100011309434_100000210202 [1,0,0,0,0,0|2,0,1]=4 440 B11R1.189 C=Cc1cccc(c1)OCC 7a_100011309434_100000210202 [1,0,0,0,0,0|2,0,1]=4 441 B11R1.189 C=Cc1cccc(c1)SCC 271570a_100011290941_100000703699 [1,0,0,0,0,0|2,0,1]=4 442 B11R1.189 C=Cc1cccc(c1)SCC 62a_100000210202_100011215241 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.189 C=Cc1cccc(c1)SCC 62a_100011215241_100000210202 [1,0,0,0,0,0|2,0,1]=4 444 B11R1.189 CC#Cc1cccc(c1)SC 62a_200000210301_200009843338 [1,0,0,0,0,0|0,1,2]=4 445 B11R1.189 CC#Cc1cccc(c1)S[13CH3] 62a_200025704644_200009843338 [1,0,0,0,0,0|0,1,2]=4 446 B11R1.189 CC=Cc1cc(ccn1)OC 271570a_100016259895_100011216251 [1,0,0,0,0,0|1,0,2]=4 447 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,0,0,0,0,0|1,0,2]=4 448 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [1,0,0,0,0,0|1,0,2]=4 449 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [1,0,0,0,0,0|0,0,2]=3 450 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [1,0,0,0,0,0|0,1,2]=4 451 B11R1.189 CC=Cc1cccc(n1)OC 271570a_100016259895_100000760917 [1,0,0,0,0,0|1,0,2]=4 452 B11R1.189 CC=Cc1ccnc(c1)OC 271570a_100016259895_100000117307 [1,0,0,0,0,0|1,0,2]=4 453 B11R1.189 CC=Cc1cncc(c1)OC 271570a_100016259895_100000684773 [1,0,0,0,0,0|1,0,2]=4 454 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [1,0,0,0,0,0|0,0,0]=1 455 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [1,0,0,0,0,0|0,0,0]=1 456 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [1,0,0,0,0,0|0,0,0]=1 457 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [1,0,0,0,0,0|0,0,0]=1 458 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [1,0,0,0,0,0|0,1,0]=2 459 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [1,0,0,0,0,0|0,1,0]=2 460 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [1,0,0,0,0,0|0,1,0]=2 461 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [1,0,0,0,0,0|0,1,0]=2 462 B11R1.189 CCNc1cc(ccn1)CC 27a_100015525214_100009817561 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.189 CCNc1cc(ncn1)OC 27a_100015525214_100000049997 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.189 CCNc1cccc(c1)C#N 34a_100000210922_100000210202 [1,0,0,0,0,0|3,0,0]=4 465 B11R1.189 CCNc1cccc(c1)C#N 7a_100000210922_100000210202 [1,0,0,0,0,0|3,0,0]=4 466 B11R1.189 CCNc1cccc(c1)CC 2230a_100000211250_100000210202 [1,0,0,0,0,0|2,0,0]=3 467 B11R1.189 CCNc1cccc(c1)CC 34a_100000211250_100000210202 [1,0,0,0,0,0|2,0,0]=3 468 B11R1.189 CCNc1cccc(c1)CC 7a_100000211250_100000210202 [1,0,0,0,0,0|2,0,0]=3 469 B11R1.189 CCNc1cccc(c1)CF 2230a_100000126320_100000210202 [1,0,0,0,0,0|3,0,0]=4 470 B11R1.189 CCNc1cccc(c1)CF 34a_100000126320_100000210202 [1,0,0,0,0,0|3,0,0]=4 471 B11R1.189 CCNc1cccc(c1)CF 7a_100000126320_100000210202 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.189 CCNc1cccc(c1)CO 2230a_100000211919_100000210202 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.189 CCNc1cccc(c1)CO 34a_100000211919_100000210202 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.189 CCNc1cccc(c1)OC 34a_100000210024_100000210202 [1,0,0,0,0,0|1,0,0]=2 475 B11R1.189 CCNc1cccc(c1)OC 34a_100000717746_200000210301 [1,0,0,0,0,0|1,0,0]=2 476 B11R1.189 CCNc1cccc(c1)OC 7a_100000717746_200000210301 [1,0,0,0,0,0|1,0,0]=2 477 B11R1.189 CCNc1cccc(c1)O[13CH3] 34a_100000717746_200025704644 [1,0,0,0,0,0|1,0,0]=2 478 B11R1.189 CCNc1cccc(c1)O[13CH3] 7a_100000717746_200025704644 [1,0,0,0,0,0|1,0,0]=2 479 B11R1.189 CCNc1cccc(c1)SC 2230a_100000210049_100000210202 [1,0,0,0,0,0|1,1,0]=3 480 B11R1.189 CCNc1cccc(c1)SC 34a_100000210049_100000210202 [1,0,0,0,0,0|1,1,0]=3 481 B11R1.189 CCNc1cccc(c1)SC 62a_200000210301_100000738899 [1,0,0,0,0,0|1,1,0]=3 482 B11R1.189 CCNc1cccc(c1)S[13CH3] 62a_200025704644_100000738899 [1,0,0,0,0,0|1,1,0]=3 483 B11R1.189 CCNc1cccc(n1)SC 62a_200000210301_200020678610 [1,0,0,0,0,0|2,1,0]=4 484 B11R1.189 CCNc1cccc(n1)SC 62a_200020678610_200000210301 [1,0,0,0,0,0|2,1,0]=4 485 B11R1.189 CCNc1cccc(n1)S[13CH3] 62a_200020678610_200025704644 [1,0,0,0,0,0|2,1,0]=4 486 B11R1.189 CCNc1cccc(n1)S[13CH3] 62a_200025704644_200020678610 [1,0,0,0,0,0|2,1,0]=4 487 B11R1.189 CCNc1ccnc(c1)CC 27a_100015525214_100009820011 [1,0,0,0,0,0|3,0,0]=4 488 B11R1.189 CCNc1ccnc(n1)OC 27a_100015525214_100000069072 [1,0,0,0,0,0|3,0,0]=4 489 B11R1.189 CCNc1cncc(n1)OC 27a_100015525214_100009819700 [1,0,0,0,0,0|3,0,0]=4 490 B11R1.189 CCNc1nccc(n1)OC 27a_100015525214_100000182009 [1,0,0,0,0,0|3,0,0]=4 491 B11R1.189 CCOc1cc(ccn1)SC 62a_100009995528_200000210301 [1,0,0,0,0,0|2,1,0]=4 492 B11R1.189 CCOc1cc(ccn1)SC 62a_200000210301_100009995528 [1,0,0,0,0,0|2,1,0]=4 493 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_100009995528_200025704644 [1,0,0,0,0,0|2,1,0]=4 494 B11R1.189 CCOc1cc(ccn1)S[13CH3] 62a_200025704644_100009995528 [1,0,0,0,0,0|2,1,0]=4 495 B11R1.189 CCOc1ccc[n+](c1)CC 34a_100000731997_100000210202 [1,0,0,0,0,0|3,0,0]=4 496 B11R1.189 CCOc1ccc[n+](c1)CC 7a_100000731997_100000210202 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.189 CCOc1cccc(c1)C#N 34a_100000184713_100000210202 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.189 CCOc1cccc(c1)C#N 7a_100000184713_100000210202 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.189 CCOc1cccc(c1)CBr 34a_100011660834_100000210202 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.189 CCOc1cccc(c1)CBr 7a_100011660834_100000210202 [1,0,0,0,0,0|3,0,0]=4 501 B11R1.189 CCOc1cccc(c1)CC 34a_100000211550_100000210202 [1,0,0,0,0,0|2,0,0]=3 502 B11R1.189 CCOc1cccc(c1)CC 7a_100000211550_100000210202 [1,0,0,0,0,0|2,0,0]=3 503 B11R1.189 CCOc1cccc(c1)CCl 34a_100000084143_100000210202 [1,0,0,0,0,0|3,0,0]=4 504 B11R1.189 CCOc1cccc(c1)CCl 7a_100000084143_100000210202 [1,0,0,0,0,0|3,0,0]=4 505 B11R1.189 CCOc1cccc(c1)CN 34a_100000743036_100000210202 [1,0,0,0,0,0|3,0,0]=4 506 B11R1.189 CCOc1cccc(c1)CO 34a_100011214949_100000210202 [1,0,0,0,0,0|3,0,0]=4 507 B11R1.189 CCOc1cccc(c1)CO 7a_100011214949_100000210202 [1,0,0,0,0,0|3,0,0]=4 508 B11R1.189 CCOc1cccc(c1)NC 2230a_100000742568_200000210301 [1,0,0,0,0,0|2,0,0]=3 509 B11R1.189 CCOc1cccc(c1)NC 34a_100000742568_200000210301 [1,0,0,0,0,0|2,0,0]=3 510 B11R1.189 CCOc1cccc(c1)NC 34a_100000756613_100000210202 [1,0,0,0,0,0|2,0,0]=3 511 B11R1.189 CCOc1cccc(c1)NC 7a_100000756613_100000210202 [1,0,0,0,0,0|2,0,0]=3 512 B11R1.189 CCOc1cccc(c1)N[13CH3] 2230a_100000742568_200025704644 [1,0,0,0,0,0|2,0,0]=3 513 B11R1.189 CCOc1cccc(c1)N[13CH3] 34a_100000742568_200025704644 [1,0,0,0,0,0|2,0,0]=3 514 B11R1.189 CCOc1cccc(c1)OC 34a_100000211255_100000210202 [1,0,0,0,0,0|1,0,0]=2 515 B11R1.189 CCOc1cccc(c1)OC 34a_100011215941_200000210301 [1,0,0,0,0,0|1,0,0]=2 516 B11R1.189 CCOc1cccc(c1)OC 7a_100000211255_100000210202 [1,0,0,0,0,0|1,0,0]=2 517 B11R1.189 CCOc1cccc(c1)OC 7a_100011215941_200000210301 [1,0,0,0,0,0|1,0,0]=2 518 B11R1.189 CCOc1cccc(c1)O[13CH3] 34a_100011215941_200025704644 [1,0,0,0,0,0|1,0,0]=2 519 B11R1.189 CCOc1cccc(c1)O[13CH3] 7a_100011215941_200025704644 [1,0,0,0,0,0|1,0,0]=2 520 B11R1.189 CCOc1cccc(c1)SC 34a_100011265683_100000210202 [1,0,0,0,0,0|1,1,0]=3 521 B11R1.189 CCOc1cccc(c1)SC 62a_200000210301_100000170002 [1,0,0,0,0,0|1,1,0]=3 522 B11R1.189 CCOc1cccc(c1)SC 7a_100011265683_100000210202 [1,0,0,0,0,0|1,1,0]=3 523 B11R1.189 CCOc1cccc(c1)S[13CH3] 62a_200025704644_100000170002 [1,0,0,0,0,0|1,1,0]=3 524 B11R1.189 CCOc1cccc(n1)SC 62a_100000752924_200000210301 [1,0,0,0,0,0|2,1,0]=4 525 B11R1.189 CCOc1cccc(n1)SC 62a_200000210301_100000752924 [1,0,0,0,0,0|2,1,0]=4 526 B11R1.189 CCOc1cccc(n1)S[13CH3] 62a_100000752924_200025704644 [1,0,0,0,0,0|2,1,0]=4 527 B11R1.189 CCOc1cccc(n1)S[13CH3] 62a_200025704644_100000752924 [1,0,0,0,0,0|2,1,0]=4 528 B11R1.189 CCOc1ccnc(c1)NC 27a_100102657272_100009995529 [1,0,0,0,0,0|3,0,0]=4 529 B11R1.189 CCOc1ccnc(c1)OC 34a_100012181050_100000210202 [1,0,0,0,0,0|2,0,0]=3 530 B11R1.189 CCOc1ccnc(c1)SC 62a_100009995529_200000210301 [1,0,0,0,0,0|2,1,0]=4 531 B11R1.189 CCOc1ccnc(c1)SC 62a_200000210301_100011922638 [1,0,0,0,0,0|2,1,0]=4 532 B11R1.189 CCOc1ccnc(c1)S[13CH3] 62a_100009995529_200025704644 [1,0,0,0,0,0|2,1,0]=4 533 B11R1.189 CCOc1ccnc(c1)S[13CH3] 62a_200025704644_100011922638 [1,0,0,0,0,0|2,1,0]=4 534 B11R1.189 CCOc1cncc(c1)CC 34a_200009861530_100000210202 [1,0,0,0,0,0|3,0,0]=4 535 B11R1.189 CCOc1cncc(c1)CC 7a_200009861530_100000210202 [1,0,0,0,0,0|3,0,0]=4 536 B11R1.189 CCOc1cncc(c1)OC 34a_100000084572_100000210202 [1,0,0,0,0,0|2,0,0]=3 537 B11R1.189 CCOc1cncc(c1)OC 7a_100000084572_100000210202 [1,0,0,0,0,0|2,0,0]=3 538 B11R1.189 CCOc1cncc(c1)SC 62a_100012029586_200000210301 [1,0,0,0,0,0|2,1,0]=4 539 B11R1.189 CCOc1cncc(c1)SC 62a_200000210301_100012029586 [1,0,0,0,0,0|2,1,0]=4 540 B11R1.189 CCOc1cncc(c1)S[13CH3] 62a_100012029586_200025704644 [1,0,0,0,0,0|2,1,0]=4 541 B11R1.189 CCOc1cncc(c1)S[13CH3] 62a_200025704644_100012029586 [1,0,0,0,0,0|2,1,0]=4 542 B11R1.189 CCSc1cc(ccn1)CC 62a_100000210202_100009817561 [1,0,0,0,0,0|3,0,0]=4 543 B11R1.189 CCSc1cc(ccn1)CC 62a_100009817561_100000210202 [1,0,0,0,0,0|3,0,0]=4 544 B11R1.189 CCSc1cc(ccn1)NC 62a_100000210202_100009869472 [1,0,0,0,0,0|3,0,0]=4 545 B11R1.189 CCSc1cc(ccn1)NC 62a_100009869472_100000210202 [1,0,0,0,0,0|3,0,0]=4 546 B11R1.189 CCSc1cc(ccn1)OC 62a_100000210202_100011216251 [1,0,0,0,0,0|2,0,0]=3 547 B11R1.189 CCSc1cc(ccn1)OC 62a_100009817693_100000210202 [1,0,0,0,0,0|2,0,0]=3 548 B11R1.189 CCSc1cc(ccn1)SC 62a_100000210202_100010883326 [1,0,0,0,0,0|2,1,0]=4 549 B11R1.189 CCSc1cc(ccn1)SC 62a_100010883326_100000210202 [1,0,0,0,0,0|2,1,0]=4 550 B11R1.189 CCSc1cc(cnn1)OC 62a_100000210202_100000087634 [1,0,0,0,0,0|3,0,0]=4 551 B11R1.189 CCSc1cc(ncn1)OC 62a_100000049997_100000210202 [1,0,0,0,0,0|3,0,0]=4 552 B11R1.189 CCSc1cc(ncn1)OC 62a_100000210202_100000049997 [1,0,0,0,0,0|3,0,0]=4 553 B11R1.189 CCSc1cccc(c1)C#N 62a_100000210202_100000189340 [1,0,0,0,0,0|3,0,0]=4 554 B11R1.189 CCSc1cccc(c1)C=O 62a_100000014684_100000210202 [1,0,0,0,0,0|3,0,0]=4 555 B11R1.189 CCSc1cccc(c1)C=O 62a_100000210202_100000014684 [1,0,0,0,0,0|3,0,0]=4 556 B11R1.189 CCSc1cccc(c1)CC 62a_100000210202_100011263222 [1,0,0,0,0,0|2,0,0]=3 557 B11R1.189 CCSc1cccc(c1)CC 62a_100011263222_100000210202 [1,0,0,0,0,0|2,0,0]=3 558 B11R1.189 CCSc1cccc(c1)CF 62a_100000210202_100010878472 [1,0,0,0,0,0|3,0,0]=4 559 B11R1.189 CCSc1cccc(c1)CF 62a_100010878472_100000210202 [1,0,0,0,0,0|3,0,0]=4 560 B11R1.189 CCSc1cccc(c1)CN 62a_100000106179_100000210202 [1,0,0,0,0,0|3,0,0]=4 561 B11R1.189 CCSc1cccc(c1)CN 62a_100000210202_100000106179 [1,0,0,0,0,0|3,0,0]=4 562 B11R1.189 CCSc1cccc(c1)CO 62a_100000210202_100000687537 [1,0,0,0,0,0|3,0,0]=4 563 B11R1.189 CCSc1cccc(c1)CO 62a_100000687537_100000210202 [1,0,0,0,0,0|3,0,0]=4 564 B11R1.189 CCSc1cccc(c1)NC 62a_100000210202_100000219648 [1,0,0,0,0,0|2,0,0]=3 565 B11R1.189 CCSc1cccc(c1)NC 62a_100000219648_100000210202 [1,0,0,0,0,0|2,0,0]=3 566 B11R1.189 CCSc1cccc(c1)NN 62a_100000210202_100000217339 [1,0,0,0,0,0|3,0,0]=4 567 B11R1.189 CCSc1cccc(c1)NN 62a_100000217339_100000210202 [1,0,0,0,0,0|3,0,0]=4 568 B11R1.189 CCSc1cccc(c1)OC 62a_100000210202_100000170001 [1,0,0,0,0,0|1,0,0]=2 569 B11R1.189 CCSc1cccc(c1)SC 62a_100000210202_100011215954 [1,0,0,0,0,0|1,1,0]=3 570 B11R1.189 CCSc1cccc(c1)SC 62a_100000703699_200000210301 [1,0,0,0,0,0|1,1,0]=3 571 B11R1.189 CCSc1cccc(c1)SC 62a_100011215954_100000210202 [1,0,0,0,0,0|1,1,0]=3 572 B11R1.189 CCSc1cccc(c1)SC 62a_200000210301_100000703699 [1,0,0,0,0,0|1,1,0]=3 573 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_100000703699_200025704644 [1,0,0,0,0,0|1,1,0]=3 574 B11R1.189 CCSc1cccc(c1)S[13CH3] 62a_200025704644_100000703699 [1,0,0,0,0,0|1,1,0]=3 575 B11R1.189 CCSc1cccc(n1)CC 62a_100000210202_100009856026 [1,0,0,0,0,0|3,0,0]=4 576 B11R1.189 CCSc1cccc(n1)CC 62a_100009856026_100000210202 [1,0,0,0,0,0|3,0,0]=4 577 B11R1.189 CCSc1cccc(n1)NC 62a_100000210202_100000703281 [1,0,0,0,0,0|3,0,0]=4 578 B11R1.189 CCSc1cccc(n1)NC 62a_100000703281_100000210202 [1,0,0,0,0,0|3,0,0]=4 579 B11R1.189 CCSc1cccc(n1)OC 62a_100000210202_100000760917 [1,0,0,0,0,0|2,0,0]=3 580 B11R1.189 CCSc1cccc(n1)OC 62a_100000760917_100000210202 [1,0,0,0,0,0|2,0,0]=3 581 B11R1.189 CCSc1cccc(n1)SC 62a_100000210202_100011960944 [1,0,0,0,0,0|2,1,0]=4 582 B11R1.189 CCSc1cccc(n1)SC 62a_100011960944_100000210202 [1,0,0,0,0,0|2,1,0]=4 583 B11R1.189 CCSc1ccnc(c1)CC 62a_100000210202_100009820011 [1,0,0,0,0,0|3,0,0]=4 584 B11R1.189 CCSc1ccnc(c1)CC 62a_100009820011_100000210202 [1,0,0,0,0,0|3,0,0]=4 585 B11R1.189 CCSc1ccnc(c1)NC 62a_100000210202_100009819592 [1,0,0,0,0,0|3,0,0]=4 586 B11R1.189 CCSc1ccnc(c1)NC 62a_100009819592_100000210202 [1,0,0,0,0,0|3,0,0]=4 587 B11R1.189 CCSc1ccnc(c1)OC 62a_100000117307_100000210202 [1,0,0,0,0,0|2,0,0]=3 588 B11R1.189 CCSc1ccnc(c1)OC 62a_100000210202_100000117307 [1,0,0,0,0,0|2,0,0]=3 589 B11R1.189 CCSc1ccnc(n1)OC 62a_100000069072_100000210202 [1,0,0,0,0,0|3,0,0]=4 590 B11R1.189 CCSc1ccnc(n1)OC 62a_100000210202_100000069072 [1,0,0,0,0,0|3,0,0]=4 591 B11R1.189 CCSc1cncc(c1)CC 62a_100000210202_200009819073 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.189 CCSc1cncc(c1)CC 62a_200009819073_100000210202 [1,0,0,0,0,0|3,0,0]=4 593 B11R1.189 CCSc1cncc(c1)NC 62a_100000210202_100012184536 [1,0,0,0,0,0|3,0,0]=4 594 B11R1.189 CCSc1cncc(c1)NC 62a_100012184536_100000210202 [1,0,0,0,0,0|3,0,0]=4 595 B11R1.189 CCSc1cncc(c1)OC 62a_100000050176_100000210202 [1,0,0,0,0,0|2,0,0]=3 596 B11R1.189 CCSc1cncc(c1)OC 62a_100000210202_100000050176 [1,0,0,0,0,0|2,0,0]=3 597 B11R1.189 CCSc1cncc(c1)SC 62a_100000210202_100009816972 [1,0,0,0,0,0|2,1,0]=4 598 B11R1.189 CCSc1cncc(c1)SC 62a_100009816972_100000210202 [1,0,0,0,0,0|2,1,0]=4 599 B11R1.189 CCSc1cncc(n1)OC 62a_100000210202_100000756030 [1,0,0,0,0,0|3,0,0]=4 600 B11R1.189 CCSc1cncc(n1)OC 62a_100000756030_100000210202 [1,0,0,0,0,0|3,0,0]=4 601 B11R1.189 CCSc1nccc(n1)OC 62a_100000182009_100000210202 [1,0,0,0,0,0|3,0,0]=4 602 B11R1.189 CCSc1nccc(n1)OC 62a_100000210202_100000182009 [1,0,0,0,0,0|3,0,0]=4 603 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [1,0,0,0,0,0|2,0,0]=3 604 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [1,0,0,0,0,0|2,0,0]=3 605 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [1,0,0,0,0,0|2,0,0]=3 606 B11R1.189 CCc1cccc(c1)NCF 34a_100000211250_100015361967 [1,0,0,0,0,0|3,0,0]=4 607 B11R1.189 CCc1cccc(c1)NCF 7a_100000211250_100015361967 [1,0,0,0,0,0|3,0,0]=4 608 B11R1.189 CCc1cccc(c1)OCF 34a_100000211550_100015361967 [1,0,0,0,0,0|3,0,0]=4 609 B11R1.189 CCc1cccc(c1)OCF 7a_100000211550_100015361967 [1,0,0,0,0,0|3,0,0]=4 610 B11R1.189 CCc1cccc(c1)SCF 62a_100011263222_100015361967 [1,0,0,0,0,0|3,0,0]=4 611 B11R1.189 CCc1cccc(c1)SCF 62a_100015361967_100011263222 [1,0,0,0,0,0|3,0,0]=4 612 B11R1.189 CNCc1cc(ccn1)OC 207a_100102657272_100000087537 [1,0,0,0,0,0|2,0,0]=3 613 B11R1.189 CNCc1cc(ccn1)OC 2230a_106832991635_100000752681 [1,0,0,0,0,0|2,0,0]=3 614 B11R1.189 CNCc1cc(ccn1)OC 270004a_106832991635_100000087537 [1,0,0,0,0,0|2,0,0]=3 615 B11R1.189 CNCc1cc(ccn1)OC 34a_100102657272_100000752681 [1,0,0,0,0,0|2,0,0]=3 616 B11R1.189 CNCc1cc(ccn1)OC 7a_106832991635_100000752681 [1,0,0,0,0,0|2,0,0]=3 617 B11R1.189 CNCc1cc(ccn1)SC 62a_100102954512_200000210301 [1,0,0,0,0,0|2,1,0]=4 618 B11R1.189 CNCc1cc(ccn1)SC 62a_200000210301_100102954512 [1,0,0,0,0,0|2,1,0]=4 619 B11R1.189 CNCc1cc(ccn1)S[13CH3] 62a_100102954512_200025704644 [1,0,0,0,0,0|2,1,0]=4 620 B11R1.189 CNCc1cc(ccn1)S[13CH3] 62a_200025704644_100102954512 [1,0,0,0,0,0|2,1,0]=4 621 B11R1.189 CNCc1cccc(c1)C#N 207a_100102657272_100000241001 [1,0,0,0,0,0|3,0,0]=4 622 B11R1.189 CNCc1cccc(c1)C#N 2230a_106832991635_100000233786 [1,0,0,0,0,0|3,0,0]=4 623 B11R1.189 CNCc1cccc(c1)C#N 26a_100102657272_100000184713 [1,0,0,0,0,0|3,0,0]=4 624 B11R1.189 CNCc1cccc(c1)C#N 270004a_106832991635_100000241001 [1,0,0,0,0,0|3,0,0]=4 625 B11R1.189 CNCc1cccc(c1)C#N 34a_100000755147_200000210301 [1,0,0,0,0,0|3,0,0]=4 626 B11R1.189 CNCc1cccc(c1)C#N 34a_100102657272_100000233786 [1,0,0,0,0,0|3,0,0]=4 627 B11R1.189 CNCc1cccc(c1)C#N 7a_106832991635_100000233786 [1,0,0,0,0,0|3,0,0]=4 628 B11R1.189 CNCc1cccc(c1)C=O 2230a_106832991635_100009816774 [1,0,0,0,0,0|3,0,0]=4 629 B11R1.189 CNCc1cccc(c1)C=O 34a_100102657272_100009816774 [1,0,0,0,0,0|3,0,0]=4 630 B11R1.189 CNCc1cccc(c1)C=O 7a_106832991635_100009816774 [1,0,0,0,0,0|3,0,0]=4 631 B11R1.189 CNCc1cccc(c1)CBr 26a_100102657272_100011660834 [1,0,0,0,0,0|3,0,0]=4 632 B11R1.189 CNCc1cccc(c1)CCl 26a_100102657272_100000084143 [1,0,0,0,0,0|3,0,0]=4 633 B11R1.189 CNCc1cccc(c1)CO 207a_100102657272_200000050894 [1,0,0,0,0,0|3,0,0]=4 634 B11R1.189 CNCc1cccc(c1)CO 2230a_100011269909_200000210301 [1,0,0,0,0,0|3,0,0]=4 635 B11R1.189 CNCc1cccc(c1)CO 2230a_106832991635_100010188025 [1,0,0,0,0,0|3,0,0]=4 636 B11R1.189 CNCc1cccc(c1)CO 26a_100102657272_100011214949 [1,0,0,0,0,0|3,0,0]=4 637 B11R1.189 CNCc1cccc(c1)CO 270004a_106832991635_200000050894 [1,0,0,0,0,0|3,0,0]=4 638 B11R1.189 CNCc1cccc(c1)CO 34a_100011269909_200000210301 [1,0,0,0,0,0|3,0,0]=4 639 B11R1.189 CNCc1cccc(c1)CO 34a_100102657272_100010188025 [1,0,0,0,0,0|3,0,0]=4 640 B11R1.189 CNCc1cccc(c1)CO 7a_106832991635_100010188025 [1,0,0,0,0,0|3,0,0]=4 641 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,0,0,0,0,0|1,0,0]=2 642 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,0,0,0,0,0|1,0,0]=2 643 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,0,0,0,0,0|1,0,0]=2 644 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,0,0,0,0,0|1,0,0]=2 645 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,0,0,0,0,0|1,0,0]=2 646 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,0,0,0,0,0|1,0,0]=2 647 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,0,0,0,0,0|1,0,0]=2 648 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,0,0,0,0,0|1,0,0]=2 649 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,0,0,0,0,0|1,0,0]=2 650 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,0,0,0,0,0|1,0,0]=2 651 B11R1.189 CNCc1cccc(c1)SC 207a_100102657272_100011935093 [1,0,0,0,0,0|1,1,0]=3 652 B11R1.189 CNCc1cccc(c1)SC 26a_100102657272_100011265683 [1,0,0,0,0,0|1,1,0]=3 653 B11R1.189 CNCc1cccc(c1)SC 270004a_106832991635_100011935093 [1,0,0,0,0,0|1,1,0]=3 654 B11R1.189 CNCc1cccc(c1)SC 62a_100000187585_200000210301 [1,0,0,0,0,0|1,1,0]=3 655 B11R1.189 CNCc1cccc(c1)SC 62a_200000210301_100000187585 [1,0,0,0,0,0|1,1,0]=3 656 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_100000187585_200025704644 [1,0,0,0,0,0|1,1,0]=3 657 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187585 [1,0,0,0,0,0|1,1,0]=3 658 B11R1.189 CNCc1cccc(n1)OC 207a_100102657272_100000694346 [1,0,0,0,0,0|2,0,0]=3 659 B11R1.189 CNCc1cccc(n1)OC 2230a_100000746380_200000210301 [1,0,0,0,0,0|2,0,0]=3 660 B11R1.189 CNCc1cccc(n1)OC 2230a_106832991635_100000755263 [1,0,0,0,0,0|2,0,0]=3 661 B11R1.189 CNCc1cccc(n1)OC 270004a_106832991635_100000694346 [1,0,0,0,0,0|2,0,0]=3 662 B11R1.189 CNCc1cccc(n1)OC 34a_100102657272_100000755263 [1,0,0,0,0,0|2,0,0]=3 663 B11R1.189 CNCc1cccc(n1)OC 7a_106832991635_100000755263 [1,0,0,0,0,0|2,0,0]=3 664 B11R1.189 CNCc1cccc(n1)SC 62a_106354212997_200000210301 [1,0,0,0,0,0|2,1,0]=4 665 B11R1.189 CNCc1cccc(n1)SC 62a_200000210301_106354212997 [1,0,0,0,0,0|2,1,0]=4 666 B11R1.189 CNCc1cccc(n1)S[13CH3] 62a_106354212997_200025704644 [1,0,0,0,0,0|2,1,0]=4 667 B11R1.189 CNCc1cccc(n1)S[13CH3] 62a_200025704644_106354212997 [1,0,0,0,0,0|2,1,0]=4 668 B11R1.189 CNCc1ccnc(c1)OC 207a_100102657272_100000050969 [1,0,0,0,0,0|2,0,0]=3 669 B11R1.189 CNCc1ccnc(c1)OC 2230a_106832991635_100103152439 [1,0,0,0,0,0|2,0,0]=3 670 B11R1.189 CNCc1ccnc(c1)OC 270004a_106832991635_100000050969 [1,0,0,0,0,0|2,0,0]=3 671 B11R1.189 CNCc1ccnc(c1)OC 34a_100102657272_100103152439 [1,0,0,0,0,0|2,0,0]=3 672 B11R1.189 CNCc1ccnc(c1)OC 7a_106832991635_100103152439 [1,0,0,0,0,0|2,0,0]=3 673 B11R1.189 CNCc1cncc(c1)OC 207a_100102657272_100011361638 [1,0,0,0,0,0|2,0,0]=3 674 B11R1.189 CNCc1cncc(c1)OC 2230a_100020589029_200000210301 [1,0,0,0,0,0|2,0,0]=3 675 B11R1.189 CNCc1cncc(c1)OC 270004a_106832991635_100011361638 [1,0,0,0,0,0|2,0,0]=3 676 B11R1.189 CNCc1cncc(c1)OC 34a_100020589029_200000210301 [1,0,0,0,0,0|2,0,0]=3 677 B11R1.189 CNCc1cncc(c1)SC 62a_103549770560_200000210301 [1,0,0,0,0,0|2,1,0]=4 678 B11R1.189 CNCc1cncc(c1)SC 62a_200000210301_103549770560 [1,0,0,0,0,0|2,1,0]=4 679 B11R1.189 CNCc1cncc(c1)S[13CH3] 62a_103549770560_200025704644 [1,0,0,0,0,0|2,1,0]=4 680 B11R1.189 CNCc1cncc(c1)S[13CH3] 62a_200025704644_103549770560 [1,0,0,0,0,0|2,1,0]=4 681 B11R1.189 CNc1cccc(c1)CC#N 2230a_100000017804_200000210301 [1,0,0,0,0,0|2,0,1]=4 682 B11R1.189 CNc1cccc(c1)CC#N 34a_100000017804_200000210301 [1,0,0,0,0,0|2,0,1]=4 683 B11R1.189 CNc1cccc(c1)CCO 2230a_100011996697_200000210301 [1,0,0,0,0,0|2,0,0]=3 684 B11R1.189 CNc1cccc(c1)CCO 34a_100011996697_200000210301 [1,0,0,0,0,0|2,0,0]=3 685 B11R1.189 CNc1cccc(c1)COC 2230a_100000737370_200000210301 [1,0,0,0,0,0|2,0,0]=3 686 B11R1.189 CNc1cccc(c1)COC 34a_100000737370_200000210301 [1,0,0,0,0,0|2,0,0]=3 687 B11R1.189 CNc1cccc(c1)OCF 34a_100000756613_100015361967 [1,0,0,0,0,0|3,0,0]=4 688 B11R1.189 CNc1cccc(c1)OCF 7a_100000756613_100015361967 [1,0,0,0,0,0|3,0,0]=4 689 B11R1.189 CNc1cccc(c1)SCF 62a_100000219648_100015361967 [1,0,0,0,0,0|3,0,0]=4 690 B11R1.189 CNc1cccc(c1)SCF 62a_100015361967_100000219648 [1,0,0,0,0,0|3,0,0]=4 691 B11R1.189 COCc1cc(ccn1)OC 34a_100000749536_200000210301 [1,0,0,0,0,0|2,0,0]=3 692 B11R1.189 COCc1cc(ccn1)OC 34a_100138415774_100000752681 [1,0,0,0,0,0|2,0,0]=3 693 B11R1.189 COCc1cccc(c1)C#N 34a_100000753308_200000210301 [1,0,0,0,0,0|3,0,0]=4 694 B11R1.189 COCc1cccc(c1)C#N 34a_100138415774_100000233786 [1,0,0,0,0,0|3,0,0]=4 695 B11R1.189 COCc1cccc(c1)C#N 7a_100000753308_200000210301 [1,0,0,0,0,0|3,0,0]=4 696 B11R1.189 COCc1cccc(c1)C=O 34a_100138415774_100009816774 [1,0,0,0,0,0|3,0,0]=4 697 B11R1.189 COCc1cccc(c1)CBr 34a_100010188025_200000210301 [1,0,0,0,0,0|3,0,0]=4 698 B11R1.189 COCc1cccc(c1)CBr 7a_100010188025_200000210301 [1,0,0,0,0,0|3,0,0]=4 699 B11R1.189 COCc1cccc(c1)CCl 34a_200000090956_200000210301 [1,0,0,0,0,0|3,0,0]=4 700 B11R1.189 COCc1cccc(c1)CCl 7a_200000090956_200000210301 [1,0,0,0,0,0|3,0,0]=4 701 B11R1.189 COCc1cccc(c1)CN 34a_100011269909_200000210301 [1,0,0,0,0,0|3,0,0]=4 702 B11R1.189 COCc1cccc(c1)CO 34a_100138415774_100010188025 [1,0,0,0,0,0|3,0,0]=4 703 B11R1.189 COCc1cccc(c1)N[13CH3] 2230a_100000737370_200025704644 [1,0,0,0,0,0|2,0,0]=3 704 B11R1.189 COCc1cccc(c1)N[13CH3] 34a_100000737370_200025704644 [1,0,0,0,0,0|2,0,0]=3 705 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [1,0,0,0,0,0|1,0,0]=2 706 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [1,0,0,0,0,0|1,0,0]=2 707 B11R1.189 COCc1cccc(c1)SC 62a_100011493687_200000210301 [1,0,0,0,0,0|1,1,0]=3 708 B11R1.189 COCc1cccc(c1)SC 62a_200000210301_100011493687 [1,0,0,0,0,0|1,1,0]=3 709 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_100011493687_200025704644 [1,0,0,0,0,0|1,1,0]=3 710 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_200025704644_100011493687 [1,0,0,0,0,0|1,1,0]=3 711 B11R1.189 COCc1cccc(n1)OC 34a_100138415774_100000755263 [1,0,0,0,0,0|2,0,0]=3 712 B11R1.189 COCc1ccnc(c1)OC 34a_100138415774_100103152439 [1,0,0,0,0,0|2,0,0]=3 713 B11R1.189 COCc1cncc(c1)OC 34a_100000732071_200000210301 [1,0,0,0,0,0|2,0,0]=3 714 B11R1.189 COc1cc(ccn1)CSC 62a_100103152439_200000210301 [1,0,0,0,0,0|2,0,0]=3 715 B11R1.189 COc1cc(ccn1)CSC 62a_200000210301_100103152439 [1,0,0,0,0,0|2,0,0]=3 716 B11R1.189 COc1cc(ccn1)CS[13CH3] 62a_100103152439_200025704644 [1,0,0,0,0,0|2,0,0]=3 717 B11R1.189 COc1cc(ccn1)CS[13CH3] 62a_200025704644_100103152439 [1,0,0,0,0,0|2,0,0]=3 718 B11R1.189 COc1cc(ccn1)OCF 34a_100012181050_100015361967 [1,0,0,0,0,0|3,0,0]=4 719 B11R1.189 COc1cc(ccn1)SCF 62a_100000117307_100015361967 [1,0,0,0,0,0|3,0,0]=4 720 B11R1.189 COc1cc(ccn1)SCF 62a_100015361967_100000117307 [1,0,0,0,0,0|3,0,0]=4 721 B11R1.189 COc1cccc(c1)CC#N 7a_100000696680_200000210301 [1,0,0,0,0,0|1,0,1]=3 722 B11R1.189 COc1cccc(c1)CCN 34a_100000747277_200000210301 [1,0,0,0,0,0|1,0,0]=2 723 B11R1.189 COc1cccc(c1)CCO 34a_100011215281_200000210301 [1,0,0,0,0,0|1,0,0]=2 724 B11R1.189 COc1cccc(c1)CCO 7a_100011215281_200000210301 [1,0,0,0,0,0|1,0,0]=2 725 B11R1.189 COc1cccc(c1)CNN 34a_100000008902_200000210301 [1,0,0,0,0,0|2,0,0]=3 726 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,0,0,0,0,0|1,0,0]=2 727 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,0,0,0,0,0|1,0,0]=2 728 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [1,0,0,0,0,0|1,0,0]=2 729 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [1,0,0,0,0,0|1,0,0]=2 730 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [1,0,0,0,0,0|1,0,0]=2 731 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [1,0,0,0,0,0|1,0,0]=2 732 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [1,0,0,0,0,0|1,0,0]=2 733 B11R1.189 COc1cccc(c1)NCF 34a_100000210024_100015361967 [1,0,0,0,0,0|2,0,0]=3 734 B11R1.189 COc1cccc(c1)OCF 34a_100000211255_100015361967 [1,0,0,0,0,0|2,0,0]=3 735 B11R1.189 COc1cccc(c1)OCF 7a_100000211255_100015361967 [1,0,0,0,0,0|2,0,0]=3 736 B11R1.189 COc1cccc(c1)SCF 62a_100015361967_100000170001 [1,0,0,0,0,0|2,0,0]=3 737 B11R1.189 COc1cccc(n1)CN[13CH3] 2230a_100000746380_200025704644 [1,0,0,0,0,0|2,0,0]=3 738 B11R1.189 COc1cccc(n1)CSC 62a_100000755263_200000210301 [1,0,0,0,0,0|2,0,0]=3 739 B11R1.189 COc1cccc(n1)CSC 62a_200000210301_100000755263 [1,0,0,0,0,0|2,0,0]=3 740 B11R1.189 COc1cccc(n1)CS[13CH3] 62a_100000755263_200025704644 [1,0,0,0,0,0|2,0,0]=3 741 B11R1.189 COc1cccc(n1)CS[13CH3] 62a_200025704644_100000755263 [1,0,0,0,0,0|2,0,0]=3 742 B11R1.189 COc1cccc(n1)SCF 62a_100000760917_100015361967 [1,0,0,0,0,0|3,0,0]=4 743 B11R1.189 COc1cccc(n1)SCF 62a_100015361967_100000760917 [1,0,0,0,0,0|3,0,0]=4 744 B11R1.189 COc1ccnc(c1)CO[13CH3] 34a_100000749536_200025704644 [1,0,0,0,0,0|2,0,0]=3 745 B11R1.189 COc1ccnc(c1)CSC 62a_100000752681_200000210301 [1,0,0,0,0,0|2,0,0]=3 746 B11R1.189 COc1ccnc(c1)CSC 62a_200000210301_100000752681 [1,0,0,0,0,0|2,0,0]=3 747 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_100000752681_200025704644 [1,0,0,0,0,0|2,0,0]=3 748 B11R1.189 COc1ccnc(c1)CS[13CH3] 62a_200025704644_100000752681 [1,0,0,0,0,0|2,0,0]=3 749 B11R1.189 COc1ccnc(c1)SCF 62a_100009817693_100015361967 [1,0,0,0,0,0|3,0,0]=4 750 B11R1.189 COc1ccnc(c1)SCF 62a_100015361967_100011216251 [1,0,0,0,0,0|3,0,0]=4 751 B11R1.189 COc1cncc(c1)CN[13CH3] 2230a_100020589029_200025704644 [1,0,0,0,0,0|2,0,0]=3 752 B11R1.189 COc1cncc(c1)CN[13CH3] 34a_100020589029_200025704644 [1,0,0,0,0,0|2,0,0]=3 753 B11R1.189 COc1cncc(c1)CO[13CH3] 34a_100000732071_200025704644 [1,0,0,0,0,0|2,0,0]=3 754 B11R1.189 COc1cncc(c1)OCF 34a_100000084572_100015361967 [1,0,0,0,0,0|3,0,0]=4 755 B11R1.189 COc1cncc(c1)OCF 7a_100000084572_100015361967 [1,0,0,0,0,0|3,0,0]=4 756 B11R1.189 COc1cncc(c1)SCF 62a_100000050176_100015361967 [1,0,0,0,0,0|3,0,0]=4 757 B11R1.189 COc1cncc(c1)SCF 62a_100015361967_100000050176 [1,0,0,0,0,0|3,0,0]=4 758 B11R1.189 CSCc1cccc(c1)C#N 62a_200000210301_100000233786 [1,0,0,0,0,0|3,0,0]=4 759 B11R1.189 CSCc1cccc(c1)C=O 62a_100009816774_200000210301 [1,0,0,0,0,0|3,0,0]=4 760 B11R1.189 CSCc1cccc(c1)C=O 62a_200000210301_100009816774 [1,0,0,0,0,0|3,0,0]=4 761 B11R1.189 CSCc1cccc(c1)CO 62a_100010188025_200000210301 [1,0,0,0,0,0|3,0,0]=4 762 B11R1.189 CSCc1cccc(c1)CO 62a_200000210301_100010188025 [1,0,0,0,0,0|3,0,0]=4 763 B11R1.189 CSc1cccc(c1)CC#N 62a_100000034040_200000210301 [1,0,0,0,0,0|1,1,1]=4 764 B11R1.189 CSc1cccc(c1)CC#N 62a_200000210301_100000034040 [1,0,0,0,0,0|1,1,1]=4 765 B11R1.189 CSc1cccc(c1)CC=O 62a_200000210301_200000698211 [1,0,0,0,0,0|1,1,1]=4 766 B11R1.189 CSc1cccc(c1)CC=O 62a_200000698211_200000210301 [1,0,0,0,0,0|1,1,1]=4 767 B11R1.189 CSc1cccc(c1)CCN 62a_100011207229_200000210301 [1,0,0,0,0,0|1,1,0]=3 768 B11R1.189 CSc1cccc(c1)CCN 62a_200000210301_100011207229 [1,0,0,0,0,0|1,1,0]=3 769 B11R1.189 CSc1cccc(c1)CCO 62a_100011217444_200000210301 [1,0,0,0,0,0|1,1,0]=3 770 B11R1.189 CSc1cccc(c1)CCO 62a_200000210301_100011217444 [1,0,0,0,0,0|1,1,0]=3 771 B11R1.189 CSc1cccc(c1)CNN 62a_100000686200_200000210301 [1,0,0,0,0,0|2,1,0]=4 772 B11R1.189 CSc1cccc(c1)CNN 62a_200000210301_100000686200 [1,0,0,0,0,0|2,1,0]=4 773 B11R1.189 CSc1cccc(c1)NCF 34a_100000210049_100015361967 [1,0,0,0,0,0|2,1,0]=4 774 B11R1.189 CSc1cccc(c1)OCF 34a_100011265683_100015361967 [1,0,0,0,0,0|2,1,0]=4 775 B11R1.189 CSc1cccc(c1)OCF 7a_100011265683_100015361967 [1,0,0,0,0,0|2,1,0]=4 776 B11R1.189 CSc1cccc(c1)SCF 62a_100011215954_100015361967 [1,0,0,0,0,0|2,1,0]=4 777 B11R1.189 CSc1cccc(c1)SCF 62a_100015361967_100011215954 [1,0,0,0,0,0|2,1,0]=4 778 B11R1.189 CSc1cccc(n1)CCO 62a_100010221043_200000210301 [1,0,0,0,0,0|2,1,0]=4 779 B11R1.189 CSc1cccc(n1)CCO 62a_200000210301_100010221043 [1,0,0,0,0,0|2,1,0]=4 780 B11R1.189 [13CH3]NCc1cccc(c1)C#N 34a_100000755147_200025704644 [1,0,0,0,0,0|3,0,0]=4 781 B11R1.189 [13CH3]NCc1cccc(c1)CO 2230a_100011269909_200025704644 [1,0,0,0,0,0|3,0,0]=4 782 B11R1.189 [13CH3]NCc1cccc(c1)CO 34a_100011269909_200025704644 [1,0,0,0,0,0|3,0,0]=4 783 B11R1.189 [13CH3]Nc1cccc(c1)CC#N 2230a_100000017804_200025704644 [1,0,0,0,0,0|2,0,1]=4 784 B11R1.189 [13CH3]Nc1cccc(c1)CC#N 34a_100000017804_200025704644 [1,0,0,0,0,0|2,0,1]=4 785 B11R1.189 [13CH3]Nc1cccc(c1)CCO 2230a_100011996697_200025704644 [1,0,0,0,0,0|2,0,0]=3 786 B11R1.189 [13CH3]Nc1cccc(c1)CCO 34a_100011996697_200025704644 [1,0,0,0,0,0|2,0,0]=3 787 B11R1.189 [13CH3]OCc1cccc(c1)C#N 34a_100000753308_200025704644 [1,0,0,0,0,0|3,0,0]=4 788 B11R1.189 [13CH3]OCc1cccc(c1)C#N 7a_100000753308_200025704644 [1,0,0,0,0,0|3,0,0]=4 789 B11R1.189 [13CH3]OCc1cccc(c1)CBr 34a_100010188025_200025704644 [1,0,0,0,0,0|3,0,0]=4 790 B11R1.189 [13CH3]OCc1cccc(c1)CBr 7a_100010188025_200025704644 [1,0,0,0,0,0|3,0,0]=4 791 B11R1.189 [13CH3]OCc1cccc(c1)CCl 34a_200000090956_200025704644 [1,0,0,0,0,0|3,0,0]=4 792 B11R1.189 [13CH3]OCc1cccc(c1)CCl 7a_200000090956_200025704644 [1,0,0,0,0,0|3,0,0]=4 793 B11R1.189 [13CH3]OCc1cccc(c1)CN 34a_100011269909_200025704644 [1,0,0,0,0,0|3,0,0]=4 794 B11R1.189 [13CH3]Oc1cccc(c1)CC#N 7a_100000696680_200025704644 [1,0,0,0,0,0|1,0,1]=3 795 B11R1.189 [13CH3]Oc1cccc(c1)CCN 34a_100000747277_200025704644 [1,0,0,0,0,0|1,0,0]=2 796 B11R1.189 [13CH3]Oc1cccc(c1)CCO 34a_100011215281_200025704644 [1,0,0,0,0,0|1,0,0]=2 797 B11R1.189 [13CH3]Oc1cccc(c1)CCO 7a_100011215281_200025704644 [1,0,0,0,0,0|1,0,0]=2 798 B11R1.189 [13CH3]Oc1cccc(c1)CNN 34a_100000008902_200025704644 [1,0,0,0,0,0|2,0,0]=3 799 B11R1.189 [13CH3]SCc1cccc(c1)C#N 62a_200025704644_100000233786 [1,0,0,0,0,0|3,0,0]=4 800 B11R1.189 [13CH3]SCc1cccc(c1)C=O 62a_100009816774_200025704644 [1,0,0,0,0,0|3,0,0]=4 801 B11R1.189 [13CH3]SCc1cccc(c1)C=O 62a_200025704644_100009816774 [1,0,0,0,0,0|3,0,0]=4 802 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_100010188025_200025704644 [1,0,0,0,0,0|3,0,0]=4 803 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_200025704644_100010188025 [1,0,0,0,0,0|3,0,0]=4 804 B11R1.189 [13CH3]Sc1cccc(c1)CC#N 62a_100000034040_200025704644 [1,0,0,0,0,0|1,1,1]=4 805 B11R1.189 [13CH3]Sc1cccc(c1)CC#N 62a_200025704644_100000034040 [1,0,0,0,0,0|1,1,1]=4 806 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200000698211_200025704644 [1,0,0,0,0,0|1,1,1]=4 807 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200025704644_200000698211 [1,0,0,0,0,0|1,1,1]=4 808 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_100011207229_200025704644 [1,0,0,0,0,0|1,1,0]=3 809 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_200025704644_100011207229 [1,0,0,0,0,0|1,1,0]=3 810 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_100011217444_200025704644 [1,0,0,0,0,0|1,1,0]=3 811 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_200025704644_100011217444 [1,0,0,0,0,0|1,1,0]=3 812 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_100000686200_200025704644 [1,0,0,0,0,0|2,1,0]=4 813 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_200025704644_100000686200 [1,0,0,0,0,0|2,1,0]=4 814 B11R1.189 [13CH3]Sc1cccc(n1)CCO 62a_100010221043_200025704644 [1,0,0,0,0,0|2,1,0]=4 815 B11R1.189 [13CH3]Sc1cccc(n1)CCO 62a_200025704644_100010221043 [1,0,0,0,0,0|2,1,0]=4 816 B11R1.192 C=C=Cc1ccc(c(c1)C)O 271570a_100015277604_100000186361 [1,0,0,0,0,0|0,0,3]=4 817 B11R1.192 C=C=Cc1ccc(c(c1)O)O 271570a_100015277604_100009813601 [1,0,0,0,0,0|0,0,3]=4 818 B11R1.192 CC=Cc1cc(c(cn1)O)C 271570a_100016259895_100000692680 [1,0,0,0,0,0|1,0,2]=4 819 B11R1.192 CC=Cc1ccc(c(c1)Br)O 271570a_100016259895_100012361655 [1,0,0,0,0,0|1,0,2]=4 820 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [1,0,0,0,0,0|1,0,2]=4 821 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [1,0,0,0,0,0|1,0,2]=4 822 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [1,0,0,0,0,0|1,0,2]=4 823 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [1,0,0,0,0,0|1,0,2]=4 824 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [1,0,0,0,0,0|1,0,2]=4 825 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,0,0,0,0,0|0,0,2]=3 826 B11R1.192 CC=Cc1ccc(c(c1)Cl)O 271570a_100016259895_100012360047 [1,0,0,0,0,0|1,0,2]=4 827 B11R1.192 CC=Cc1ccc(c(c1)F)O 271570a_100016259895_100000185481 [1,0,0,0,0,0|1,0,2]=4 828 B11R1.192 CC=Cc1ccc(c(c1)N)O 271570a_100016259895_100000752626 [1,0,0,0,0,0|1,0,2]=4 829 B11R1.192 CC=Cc1ccc(c(c1)O)Br 271570a_100016259895_100012356990 [1,0,0,0,0,0|1,0,2]=4 830 B11R1.192 CC=Cc1ccc(c(c1)O)C 271570a_100016259895_100000766334 [1,0,0,0,0,0|1,0,2]=4 831 B11R1.192 CC=Cc1ccc(c(c1)O)Cl 271570a_100016259895_100011356854 [1,0,0,0,0,0|1,0,2]=4 832 B11R1.192 CC=Cc1ccc(c(c1)O)F 271570a_100016259895_100000686035 [1,0,0,0,0,0|1,0,2]=4 833 B11R1.192 CC=Cc1ccc(c(c1)O)N 271570a_100016259895_100000739049 [1,0,0,0,0,0|1,0,2]=4 834 B11R1.192 CC=Cc1ccc(c(c1)O)O 271570a_100016259895_100009813601 [1,0,0,0,0,0|0,0,2]=3 835 B11R1.192 CC=Cc1ccc(c(n1)C)O 271570a_100016259895_100010233687 [1,0,0,0,0,0|1,0,2]=4 836 B11R1.192 CC=Cc1cnc(c(c1)C)O 271570a_100016259895_100000685391 [1,0,0,0,0,0|1,0,2]=4 837 B11R1.192 CCCc1ccc(c(c1)F)O 271570a_203496583355_200010686677 [1,0,0,0,0,0|1,0,0]=2 838 B11R1.192 CCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210202 [1,0,0,0,0,0|3,0,0]=4 839 B11R1.192 CCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210202 [1,0,0,0,0,0|3,0,0]=4 840 B11R1.192 CCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210202 [1,0,0,0,0,0|3,0,0]=4 841 B11R1.192 CCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210202 [1,0,0,0,0,0|3,0,0]=4 842 B11R1.192 CCNc1ccc(c(c1)Br)C 34a_100000736455_100000210202 [1,0,0,0,0,0|3,0,0]=4 843 B11R1.192 CCNc1ccc(c(c1)Br)C 7a_100000736455_100000210202 [1,0,0,0,0,0|3,0,0]=4 844 B11R1.192 CCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210202 [1,0,0,0,0,0|3,0,0]=4 845 B11R1.192 CCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210202 [1,0,0,0,0,0|3,0,0]=4 846 B11R1.192 CCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210202 [1,0,0,0,0,0|3,0,0]=4 847 B11R1.192 CCNc1ccc(c(c1)Br)F 34a_100000760356_100000210202 [1,0,0,0,0,0|3,0,0]=4 848 B11R1.192 CCNc1ccc(c(c1)Br)F 7a_100000760356_100000210202 [1,0,0,0,0,0|3,0,0]=4 849 B11R1.192 CCNc1ccc(c(c1)Br)I 34a_100000750458_100000210202 [1,0,0,0,0,0|3,0,0]=4 850 B11R1.192 CCNc1ccc(c(c1)Br)O 34a_100011534360_100000210202 [1,0,0,0,0,0|2,0,0]=3 851 B11R1.192 CCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210202 [1,0,0,0,0,0|2,0,0]=3 852 B11R1.192 CCNc1ccc(c(c1)C)Br 34a_100000210723_100000210202 [1,0,0,0,0,0|2,0,0]=3 853 B11R1.192 CCNc1ccc(c(c1)C)Br 7a_100000210723_100000210202 [1,0,0,0,0,0|2,0,0]=3 854 B11R1.192 CCNc1ccc(c(c1)C)C 2230a_100000724040_100000210202 [1,0,0,0,0,0|2,0,0]=3 855 B11R1.192 CCNc1ccc(c(c1)C)C 34a_100000724040_100000210202 [1,0,0,0,0,0|2,0,0]=3 856 B11R1.192 CCNc1ccc(c(c1)C)C 7a_100000724040_100000210202 [1,0,0,0,0,0|2,0,0]=3 857 B11R1.192 CCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210202 [1,0,0,0,0,0|2,0,0]=3 858 B11R1.192 CCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210202 [1,0,0,0,0,0|2,0,0]=3 859 B11R1.192 CCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210202 [1,0,0,0,0,0|2,0,0]=3 860 B11R1.192 CCNc1ccc(c(c1)C)F 2230a_100000750164_100000210202 [1,0,0,0,0,0|2,0,0]=3 861 B11R1.192 CCNc1ccc(c(c1)C)F 34a_100000750164_100000210202 [1,0,0,0,0,0|2,0,0]=3 862 B11R1.192 CCNc1ccc(c(c1)C)F 7a_100000750164_100000210202 [1,0,0,0,0,0|2,0,0]=3 863 B11R1.192 CCNc1ccc(c(c1)C)I 34a_100000198070_100000210202 [1,0,0,0,0,0|2,0,0]=3 864 B11R1.192 CCNc1ccc(c(c1)C)I 7a_100000198070_100000210202 [1,0,0,0,0,0|2,0,0]=3 865 B11R1.192 CCNc1ccc(c(c1)C)O 271570a_203496583355_100015183089 [1,0,0,0,0,0|1,0,0]=2 866 B11R1.192 CCNc1ccc(c(c1)C)O 34a_100011218179_100000210202 [1,0,0,0,0,0|1,0,0]=2 867 B11R1.192 CCNc1ccc(c(c1)C)O 7a_100011218179_100000210202 [1,0,0,0,0,0|1,0,0]=2 868 B11R1.192 CCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210202 [1,0,0,0,0,0|3,0,0]=4 869 B11R1.192 CCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210202 [1,0,0,0,0,0|3,0,0]=4 870 B11R1.192 CCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210202 [1,0,0,0,0,0|3,0,0]=4 871 B11R1.192 CCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210202 [1,0,0,0,0,0|3,0,0]=4 872 B11R1.192 CCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210202 [1,0,0,0,0,0|3,0,0]=4 873 B11R1.192 CCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210202 [1,0,0,0,0,0|3,0,0]=4 874 B11R1.192 CCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210202 [1,0,0,0,0,0|3,0,0]=4 875 B11R1.192 CCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210202 [1,0,0,0,0,0|3,0,0]=4 876 B11R1.192 CCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210202 [1,0,0,0,0,0|3,0,0]=4 877 B11R1.192 CCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210202 [1,0,0,0,0,0|3,0,0]=4 878 B11R1.192 CCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210202 [1,0,0,0,0,0|3,0,0]=4 879 B11R1.192 CCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210202 [1,0,0,0,0,0|3,0,0]=4 880 B11R1.192 CCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210202 [1,0,0,0,0,0|2,0,0]=3 881 B11R1.192 CCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210202 [1,0,0,0,0,0|3,0,0]=4 882 B11R1.192 CCNc1ccc(c(c1)F)Br 34a_100000759894_100000210202 [1,0,0,0,0,0|3,0,0]=4 883 B11R1.192 CCNc1ccc(c(c1)F)Br 7a_100000759894_100000210202 [1,0,0,0,0,0|3,0,0]=4 884 B11R1.192 CCNc1ccc(c(c1)F)C 2230a_100000210958_100000210202 [1,0,0,0,0,0|3,0,0]=4 885 B11R1.192 CCNc1ccc(c(c1)F)C 34a_100000210958_100000210202 [1,0,0,0,0,0|3,0,0]=4 886 B11R1.192 CCNc1ccc(c(c1)F)C 7a_100000210958_100000210202 [1,0,0,0,0,0|3,0,0]=4 887 B11R1.192 CCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210202 [1,0,0,0,0,0|3,0,0]=4 888 B11R1.192 CCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210202 [1,0,0,0,0,0|3,0,0]=4 889 B11R1.192 CCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210202 [1,0,0,0,0,0|3,0,0]=4 890 B11R1.192 CCNc1ccc(c(c1)F)F 2230a_100000210724_100000210202 [1,0,0,0,0,0|3,0,0]=4 891 B11R1.192 CCNc1ccc(c(c1)F)F 34a_100000210724_100000210202 [1,0,0,0,0,0|3,0,0]=4 892 B11R1.192 CCNc1ccc(c(c1)F)F 7a_100000210724_100000210202 [1,0,0,0,0,0|3,0,0]=4 893 B11R1.192 CCNc1ccc(c(c1)F)I 34a_100011356925_100000210202 [1,0,0,0,0,0|3,0,0]=4 894 B11R1.192 CCNc1ccc(c(c1)F)I 7a_100011356925_100000210202 [1,0,0,0,0,0|3,0,0]=4 895 B11R1.192 CCNc1ccc(c(c1)F)O 34a_100011220035_100000210202 [1,0,0,0,0,0|2,0,0]=3 896 B11R1.192 CCNc1ccc(c(c1)F)O 7a_100011220035_100000210202 [1,0,0,0,0,0|2,0,0]=3 897 B11R1.192 CCNc1ccc(c(c1)I)Br 34a_100000750459_100000210202 [1,0,0,0,0,0|3,0,0]=4 898 B11R1.192 CCNc1ccc(c(c1)I)C 34a_100000184131_100000210202 [1,0,0,0,0,0|3,0,0]=4 899 B11R1.192 CCNc1ccc(c(c1)I)C 7a_100000184131_100000210202 [1,0,0,0,0,0|3,0,0]=4 900 B11R1.192 CCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210202 [1,0,0,0,0,0|3,0,0]=4 901 B11R1.192 CCNc1ccc(c(c1)I)F 34a_114828291077_100000210202 [1,0,0,0,0,0|3,0,0]=4 902 B11R1.192 CCNc1ccc(c(c1)I)F 7a_114828291077_100000210202 [1,0,0,0,0,0|3,0,0]=4 903 B11R1.192 CCNc1ccc(c(c1)O)C 34a_100000759471_100000210202 [1,0,0,0,0,0|2,0,0]=3 904 B11R1.192 CCNc1ccc(c(c1)O)C 7a_100000759471_100000210202 [1,0,0,0,0,0|2,0,0]=3 905 B11R1.192 CCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210202 [1,0,0,0,0,0|2,0,0]=3 906 B11R1.192 CCNc1ccc(c(c1)O)F 34a_100012017398_100000210202 [1,0,0,0,0,0|2,0,0]=3 907 B11R1.192 CCNc1ccc(c(c1)O)F 7a_100012017398_100000210202 [1,0,0,0,0,0|2,0,0]=3 908 B11R1.192 CCNc1ccc(c(c1)O)O 34a_100102946323_100000210202 [1,0,0,0,0,0|1,0,0]=2 909 B11R1.192 CCOc1cc(c(cn1)Br)C 34a_100000766222_100000210202 [1,0,0,0,0,0|3,0,0]=4 910 B11R1.192 CCOc1cc(c(cn1)Cl)C 34a_200000085746_100000210202 [1,0,0,0,0,0|3,0,0]=4 911 B11R1.192 CCOc1cc(c(cn1)O)C 271570a_203496583355_200012351029 [1,0,0,0,0,0|2,0,0]=3 912 B11R1.192 CCOc1ccc(c(c1)Br)C 34a_100011380479_100000210202 [1,0,0,0,0,0|3,0,0]=4 913 B11R1.192 CCOc1ccc(c(c1)Br)C 7a_100011380479_100000210202 [1,0,0,0,0,0|3,0,0]=4 914 B11R1.192 CCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210202 [1,0,0,0,0,0|3,0,0]=4 915 B11R1.192 CCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210202 [1,0,0,0,0,0|3,0,0]=4 916 B11R1.192 CCOc1ccc(c(c1)Br)F 34a_100000693481_100000210202 [1,0,0,0,0,0|3,0,0]=4 917 B11R1.192 CCOc1ccc(c(c1)Br)F 7a_100000693481_100000210202 [1,0,0,0,0,0|3,0,0]=4 918 B11R1.192 CCOc1ccc(c(c1)Br)I 34a_100000701344_100000210202 [1,0,0,0,0,0|3,0,0]=4 919 B11R1.192 CCOc1ccc(c(c1)Br)I 7a_100000701344_100000210202 [1,0,0,0,0,0|3,0,0]=4 920 B11R1.192 CCOc1ccc(c(c1)Br)N 34a_100012001276_100000210202 [1,0,0,0,0,0|3,0,0]=4 921 B11R1.192 CCOc1ccc(c(c1)Br)N 7a_100012001276_100000210202 [1,0,0,0,0,0|3,0,0]=4 922 B11R1.192 CCOc1ccc(c(c1)C)Br 34a_100000690111_100000210202 [1,0,0,0,0,0|2,0,0]=3 923 B11R1.192 CCOc1ccc(c(c1)C)Br 7a_100000690111_100000210202 [1,0,0,0,0,0|2,0,0]=3 924 B11R1.192 CCOc1ccc(c(c1)C)C 34a_100000210932_100000210202 [1,0,0,0,0,0|2,0,0]=3 925 B11R1.192 CCOc1ccc(c(c1)C)C 7a_100000210932_100000210202 [1,0,0,0,0,0|2,0,0]=3 926 B11R1.192 CCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210202 [1,0,0,0,0,0|2,0,0]=3 927 B11R1.192 CCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210202 [1,0,0,0,0,0|2,0,0]=3 928 B11R1.192 CCOc1ccc(c(c1)C)F 34a_100000751312_100000210202 [1,0,0,0,0,0|2,0,0]=3 929 B11R1.192 CCOc1ccc(c(c1)C)F 7a_100000751312_100000210202 [1,0,0,0,0,0|2,0,0]=3 930 B11R1.192 CCOc1ccc(c(c1)C)I 34a_100000729255_100000210202 [1,0,0,0,0,0|2,0,0]=3 931 B11R1.192 CCOc1ccc(c(c1)C)I 7a_100000729255_100000210202 [1,0,0,0,0,0|2,0,0]=3 932 B11R1.192 CCOc1ccc(c(c1)C)N 34a_100000756630_100000210202 [1,0,0,0,0,0|2,0,0]=3 933 B11R1.192 CCOc1ccc(c(c1)C)N 7a_100000756630_100000210202 [1,0,0,0,0,0|2,0,0]=3 934 B11R1.192 CCOc1ccc(c(c1)C)O 271570a_203496583355_100012344538 [1,0,0,0,0,0|1,0,0]=2 935 B11R1.192 CCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210202 [1,0,0,0,0,0|3,0,0]=4 936 B11R1.192 CCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210202 [1,0,0,0,0,0|3,0,0]=4 937 B11R1.192 CCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210202 [1,0,0,0,0,0|3,0,0]=4 938 B11R1.192 CCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210202 [1,0,0,0,0,0|3,0,0]=4 939 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210202 [1,0,0,0,0,0|3,0,0]=4 940 B11R1.192 CCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210202 [1,0,0,0,0,0|3,0,0]=4 941 B11R1.192 CCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210202 [1,0,0,0,0,0|3,0,0]=4 942 B11R1.192 CCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210202 [1,0,0,0,0,0|3,0,0]=4 943 B11R1.192 CCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210202 [1,0,0,0,0,0|3,0,0]=4 944 B11R1.192 CCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210202 [1,0,0,0,0,0|3,0,0]=4 945 B11R1.192 CCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210202 [1,0,0,0,0,0|3,0,0]=4 946 B11R1.192 CCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210202 [1,0,0,0,0,0|3,0,0]=4 947 B11R1.192 CCOc1ccc(c(c1)F)Br 34a_100000755031_100000210202 [1,0,0,0,0,0|3,0,0]=4 948 B11R1.192 CCOc1ccc(c(c1)F)Br 7a_100000755031_100000210202 [1,0,0,0,0,0|3,0,0]=4 949 B11R1.192 CCOc1ccc(c(c1)F)C 34a_100000722560_100000210202 [1,0,0,0,0,0|3,0,0]=4 950 B11R1.192 CCOc1ccc(c(c1)F)C 7a_100000722560_100000210202 [1,0,0,0,0,0|3,0,0]=4 951 B11R1.192 CCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210202 [1,0,0,0,0,0|3,0,0]=4 952 B11R1.192 CCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210202 [1,0,0,0,0,0|3,0,0]=4 953 B11R1.192 CCOc1ccc(c(c1)F)F 34a_100000181275_100000210202 [1,0,0,0,0,0|3,0,0]=4 954 B11R1.192 CCOc1ccc(c(c1)F)F 7a_100000181275_100000210202 [1,0,0,0,0,0|3,0,0]=4 955 B11R1.192 CCOc1ccc(c(c1)F)I 34a_100009990212_100000210202 [1,0,0,0,0,0|3,0,0]=4 956 B11R1.192 CCOc1ccc(c(c1)F)I 7a_100009990212_100000210202 [1,0,0,0,0,0|3,0,0]=4 957 B11R1.192 CCOc1ccc(c(c1)F)N 34a_100000759473_100000210202 [1,0,0,0,0,0|3,0,0]=4 958 B11R1.192 CCOc1ccc(c(c1)F)N 7a_100000759473_100000210202 [1,0,0,0,0,0|3,0,0]=4 959 B11R1.192 CCOc1ccc(c(c1)F)O 271570a_203496583355_100000692347 [1,0,0,0,0,0|2,0,0]=3 960 B11R1.192 CCOc1ccc(c(c1)I)Br 34a_100012339312_100000210202 [1,0,0,0,0,0|3,0,0]=4 961 B11R1.192 CCOc1ccc(c(c1)I)Br 7a_100012339312_100000210202 [1,0,0,0,0,0|3,0,0]=4 962 B11R1.192 CCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210202 [1,0,0,0,0,0|3,0,0]=4 963 B11R1.192 CCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210202 [1,0,0,0,0,0|3,0,0]=4 964 B11R1.192 CCOc1ccc(c(c1)I)N 34a_100010084370_100000210202 [1,0,0,0,0,0|3,0,0]=4 965 B11R1.192 CCOc1ccc(c(c1)I)N 7a_100010084370_100000210202 [1,0,0,0,0,0|3,0,0]=4 966 B11R1.192 CCOc1ccc(c(c1)N)Br 34a_100011999798_100000210202 [1,0,0,0,0,0|3,0,0]=4 967 B11R1.192 CCOc1ccc(c(c1)N)Br 7a_100011999798_100000210202 [1,0,0,0,0,0|3,0,0]=4 968 B11R1.192 CCOc1ccc(c(c1)N)C 34a_100011216113_100000210202 [1,0,0,0,0,0|3,0,0]=4 969 B11R1.192 CCOc1ccc(c(c1)N)C 7a_100011216113_100000210202 [1,0,0,0,0,0|3,0,0]=4 970 B11R1.192 CCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210202 [1,0,0,0,0,0|3,0,0]=4 971 B11R1.192 CCOc1ccc(c(c1)N)F 34a_100012017239_100000210202 [1,0,0,0,0,0|3,0,0]=4 972 B11R1.192 CCOc1ccc(c(c1)N)F 7a_100012017239_100000210202 [1,0,0,0,0,0|3,0,0]=4 973 B11R1.192 CCOc1ccc(c(c1)N)N 34a_100025771000_100000210202 [1,0,0,0,0,0|3,0,0]=4 974 B11R1.192 CCOc1ccc(c(c1)O)C 271570a_203496583355_100011099959 [1,0,0,0,0,0|2,0,0]=3 975 B11R1.192 CCOc1ccc(c(n1)C)Br 34a_100000691680_100000210202 [1,0,0,0,0,0|3,0,0]=4 976 B11R1.192 CCOc1ccc(c(n1)C)Cl 34a_200009863735_100000210202 [1,0,0,0,0,0|3,0,0]=4 977 B11R1.192 CCOc1cnc(c(c1)C)Br 34a_100012000486_100000210202 [1,0,0,0,0,0|3,0,0]=4 978 B11R1.192 CCOc1cnc(c(c1)C)Br 7a_100012000486_100000210202 [1,0,0,0,0,0|3,0,0]=4 979 B11R1.192 CCOc1cnc(c(c1)C)C 34a_100009854398_100000210202 [1,0,0,0,0,0|3,0,0]=4 980 B11R1.192 CCOc1cnc(c(c1)C)C 7a_100009854398_100000210202 [1,0,0,0,0,0|3,0,0]=4 981 B11R1.192 CCOc1cnc(c(c1)C)Cl 34a_100012002680_100000210202 [1,0,0,0,0,0|3,0,0]=4 982 B11R1.192 CCOc1cnc(c(c1)C)Cl 7a_100012002680_100000210202 [1,0,0,0,0,0|3,0,0]=4 983 B11R1.192 CCOc1cnc(c(c1)C)F 34a_100000094615_100000210202 [1,0,0,0,0,0|3,0,0]=4 984 B11R1.192 CCOc1cnc(c(c1)C)F 7a_100000094615_100000210202 [1,0,0,0,0,0|3,0,0]=4 985 B11R1.192 CCSc1c[nH]c(=O)c(c1)O 62a_100000210202_100009814561 [1,0,0,0,0,0|2,0,1]=4 986 B11R1.192 CCSc1cc(c(cn1)Br)C 62a_100000210202_100012356354 [1,0,0,0,0,0|3,0,0]=4 987 B11R1.192 CCSc1cc(c(cn1)Br)C 62a_100012356354_100000210202 [1,0,0,0,0,0|3,0,0]=4 988 B11R1.192 CCSc1cc(c(cn1)C)C 62a_100000210202_100009850809 [1,0,0,0,0,0|3,0,0]=4 989 B11R1.192 CCSc1cc(c(cn1)C)C 62a_100009850809_100000210202 [1,0,0,0,0,0|3,0,0]=4 990 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000210202_100000704368 [1,0,0,0,0,0|3,0,0]=4 991 B11R1.192 CCSc1cc(c(cn1)C)O 62a_100000704368_100000210202 [1,0,0,0,0,0|3,0,0]=4 992 B11R1.192 CCSc1cc(c(cn1)F)C 62a_100000210202_100009818257 [1,0,0,0,0,0|3,0,0]=4 993 B11R1.192 CCSc1cc(c(cn1)F)C 62a_100009818257_100000210202 [1,0,0,0,0,0|3,0,0]=4 994 B11R1.192 CCSc1cc(c(cn1)F)O 62a_100000210202_100009854642 [1,0,0,0,0,0|3,0,0]=4 995 B11R1.192 CCSc1cc(c(cn1)F)O 62a_100009854642_100000210202 [1,0,0,0,0,0|3,0,0]=4 996 B11R1.192 CCSc1cc(c(cn1)N)C 62a_100000067204_100000210202 [1,0,0,0,0,0|3,0,0]=4 997 B11R1.192 CCSc1cc(c(cn1)N)C 62a_100000210202_100000067204 [1,0,0,0,0,0|3,0,0]=4 998 B11R1.192 CCSc1cc(c(cn1)O)C 62a_100000210202_100000692680 [1,0,0,0,0,0|2,0,0]=3 999 B11R1.192 CCSc1cc(c(cn1)O)N 62a_100000210202_100009819941 [1,0,0,0,0,0|3,0,0]=4 1000 B11R1.192 CCSc1cc(c(cn1)O)N 62a_100009819941_100000210202 [1,0,0,0,0,0|3,0,0]=4 1001 B11R1.192 CCSc1ccc(=O)n(c1)C 62a_100000210202_100011245003 [1,0,0,0,0,0|2,0,1]=4 1002 B11R1.192 CCSc1ccc(=O)n(c1)C 62a_100011245003_100000210202 [1,0,0,0,0,0|2,0,1]=4 1003 B11R1.192 CCSc1ccc(c(c1)Br)Br 62a_100000210202_100012356285 [1,0,0,0,0,0|3,0,0]=4 1004 B11R1.192 CCSc1ccc(c(c1)Br)Br 62a_100012356285_100000210202 [1,0,0,0,0,0|3,0,0]=4 1005 B11R1.192 CCSc1ccc(c(c1)Br)C 62a_100000210202_100011847877 [1,0,0,0,0,0|3,0,0]=4 1006 B11R1.192 CCSc1ccc(c(c1)Br)C 62a_100011847877_100000210202 [1,0,0,0,0,0|3,0,0]=4 1007 B11R1.192 CCSc1ccc(c(c1)Br)Cl 62a_100000210202_100012353702 [1,0,0,0,0,0|3,0,0]=4 1008 B11R1.192 CCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210202 [1,0,0,0,0,0|3,0,0]=4 1009 B11R1.192 CCSc1ccc(c(c1)Br)F 62a_100000210202_100012047266 [1,0,0,0,0,0|3,0,0]=4 1010 B11R1.192 CCSc1ccc(c(c1)Br)F 62a_100012047266_100000210202 [1,0,0,0,0,0|3,0,0]=4 1011 B11R1.192 CCSc1ccc(c(c1)Br)N 62a_100000210202_100000750455 [1,0,0,0,0,0|3,0,0]=4 1012 B11R1.192 CCSc1ccc(c(c1)Br)N 62a_100000750455_100000210202 [1,0,0,0,0,0|3,0,0]=4 1013 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100000210202_100012361655 [1,0,0,0,0,0|2,0,0]=3 1014 B11R1.192 CCSc1ccc(c(c1)Br)O 62a_100012361655_100000210202 [1,0,0,0,0,0|2,0,0]=3 1015 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100000210202_100009813585 [1,0,0,0,0,0|2,0,0]=3 1016 B11R1.192 CCSc1ccc(c(c1)C)Br 62a_100009813585_100000210202 [1,0,0,0,0,0|2,0,0]=3 1017 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100000210202_100011215607 [1,0,0,0,0,0|2,0,0]=3 1018 B11R1.192 CCSc1ccc(c(c1)C)C 62a_100011215607_100000210202 [1,0,0,0,0,0|2,0,0]=3 1019 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210202 [1,0,0,0,0,0|2,0,0]=3 1020 B11R1.192 CCSc1ccc(c(c1)C)Cl 62a_100000210202_100000049509 [1,0,0,0,0,0|2,0,0]=3 1021 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100000210202_100011218330 [1,0,0,0,0,0|2,0,0]=3 1022 B11R1.192 CCSc1ccc(c(c1)C)F 62a_100011218330_100000210202 [1,0,0,0,0,0|2,0,0]=3 1023 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000210202_100000211769 [1,0,0,0,0,0|2,0,0]=3 1024 B11R1.192 CCSc1ccc(c(c1)C)N 62a_100000211769_100000210202 [1,0,0,0,0,0|2,0,0]=3 1025 B11R1.192 CCSc1ccc(c(c1)C)O 62a_100000210202_100000186361 [1,0,0,0,0,0|1,0,0]=2 1026 B11R1.192 CCSc1ccc(c(c1)Cl)Br 62a_100000210202_100012047281 [1,0,0,0,0,0|3,0,0]=4 1027 B11R1.192 CCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210202 [1,0,0,0,0,0|3,0,0]=4 1028 B11R1.192 CCSc1ccc(c(c1)Cl)C 62a_100000210202_100011216363 [1,0,0,0,0,0|3,0,0]=4 1029 B11R1.192 CCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210202 [1,0,0,0,0,0|3,0,0]=4 1030 B11R1.192 CCSc1ccc(c(c1)Cl)Cl 62a_100000210202_100011214914 [1,0,0,0,0,0|3,0,0]=4 1031 B11R1.192 CCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210202 [1,0,0,0,0,0|3,0,0]=4 1032 B11R1.192 CCSc1ccc(c(c1)Cl)F 62a_100000210202_100011215976 [1,0,0,0,0,0|3,0,0]=4 1033 B11R1.192 CCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210202 [1,0,0,0,0,0|3,0,0]=4 1034 B11R1.192 CCSc1ccc(c(c1)Cl)N 62a_100000210202_100011218065 [1,0,0,0,0,0|3,0,0]=4 1035 B11R1.192 CCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210202 [1,0,0,0,0,0|3,0,0]=4 1036 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100000210202_100012360047 [1,0,0,0,0,0|2,0,0]=3 1037 B11R1.192 CCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210202 [1,0,0,0,0,0|2,0,0]=3 1038 B11R1.192 CCSc1ccc(c(c1)F)Br 62a_100000210202_100000685389 [1,0,0,0,0,0|3,0,0]=4 1039 B11R1.192 CCSc1ccc(c(c1)F)Br 62a_100000685389_100000210202 [1,0,0,0,0,0|3,0,0]=4 1040 B11R1.192 CCSc1ccc(c(c1)F)C 62a_100000210202_100000720648 [1,0,0,0,0,0|3,0,0]=4 1041 B11R1.192 CCSc1ccc(c(c1)F)C 62a_100000720648_100000210202 [1,0,0,0,0,0|3,0,0]=4 1042 B11R1.192 CCSc1ccc(c(c1)F)Cl 62a_100000210202_100011216805 [1,0,0,0,0,0|3,0,0]=4 1043 B11R1.192 CCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210202 [1,0,0,0,0,0|3,0,0]=4 1044 B11R1.192 CCSc1ccc(c(c1)F)F 62a_100000210202_100000703953 [1,0,0,0,0,0|3,0,0]=4 1045 B11R1.192 CCSc1ccc(c(c1)F)F 62a_100000703953_100000210202 [1,0,0,0,0,0|3,0,0]=4 1046 B11R1.192 CCSc1ccc(c(c1)F)N 62a_100000210202_100011215594 [1,0,0,0,0,0|3,0,0]=4 1047 B11R1.192 CCSc1ccc(c(c1)F)N 62a_100011215594_100000210202 [1,0,0,0,0,0|3,0,0]=4 1048 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000185481_100000210202 [1,0,0,0,0,0|2,0,0]=3 1049 B11R1.192 CCSc1ccc(c(c1)F)O 62a_100000210202_100000185481 [1,0,0,0,0,0|2,0,0]=3 1050 B11R1.192 CCSc1ccc(c(c1)N)Br 62a_100000210202_100000750456 [1,0,0,0,0,0|3,0,0]=4 1051 B11R1.192 CCSc1ccc(c(c1)N)Br 62a_100000750456_100000210202 [1,0,0,0,0,0|3,0,0]=4 1052 B11R1.192 CCSc1ccc(c(c1)N)C 62a_100000210202_100000761890 [1,0,0,0,0,0|3,0,0]=4 1053 B11R1.192 CCSc1ccc(c(c1)N)C 62a_100000761890_100000210202 [1,0,0,0,0,0|3,0,0]=4 1054 B11R1.192 CCSc1ccc(c(c1)N)Cl 62a_100000210202_200000761891 [1,0,0,0,0,0|3,0,0]=4 1055 B11R1.192 CCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210202 [1,0,0,0,0,0|3,0,0]=4 1056 B11R1.192 CCSc1ccc(c(c1)N)F 62a_100000210202_100000740924 [1,0,0,0,0,0|3,0,0]=4 1057 B11R1.192 CCSc1ccc(c(c1)N)F 62a_100000740924_100000210202 [1,0,0,0,0,0|3,0,0]=4 1058 B11R1.192 CCSc1ccc(c(c1)N)N 62a_100000210202_100011534411 [1,0,0,0,0,0|3,0,0]=4 1059 B11R1.192 CCSc1ccc(c(c1)N)N 62a_100000741789_100000210202 [1,0,0,0,0,0|3,0,0]=4 1060 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000210202_100000752626 [1,0,0,0,0,0|2,0,0]=3 1061 B11R1.192 CCSc1ccc(c(c1)N)O 62a_100000752626_100000210202 [1,0,0,0,0,0|2,0,0]=3 1062 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100000210202_100012356990 [1,0,0,0,0,0|2,0,0]=3 1063 B11R1.192 CCSc1ccc(c(c1)O)Br 62a_100012356990_100000210202 [1,0,0,0,0,0|2,0,0]=3 1064 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000210202_100000685420 [1,0,0,0,0,0|2,0,0]=3 1065 B11R1.192 CCSc1ccc(c(c1)O)C 62a_100000685420_100000210202 [1,0,0,0,0,0|2,0,0]=3 1066 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100000210202_100011356854 [1,0,0,0,0,0|2,0,0]=3 1067 B11R1.192 CCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210202 [1,0,0,0,0,0|2,0,0]=3 1068 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000210202_100000686035 [1,0,0,0,0,0|2,0,0]=3 1069 B11R1.192 CCSc1ccc(c(c1)O)F 62a_100000686035_100000210202 [1,0,0,0,0,0|2,0,0]=3 1070 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000210202_100000739049 [1,0,0,0,0,0|2,0,0]=3 1071 B11R1.192 CCSc1ccc(c(c1)O)N 62a_100000739049_100000210202 [1,0,0,0,0,0|2,0,0]=3 1072 B11R1.192 CCSc1ccc(c(c1)O)O 62a_100000210202_100009813601 [1,0,0,0,0,0|1,0,0]=2 1073 B11R1.192 CCSc1ccc(c(n1)Br)O 62a_100000210202_100000725334 [1,0,0,0,0,0|3,0,0]=4 1074 B11R1.192 CCSc1ccc(c(n1)Br)O 62a_100000725334_100000210202 [1,0,0,0,0,0|3,0,0]=4 1075 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100000210202_100012360386 [1,0,0,0,0,0|3,0,0]=4 1076 B11R1.192 CCSc1ccc(c(n1)C)Br 62a_100012360386_100000210202 [1,0,0,0,0,0|3,0,0]=4 1077 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000103781_100000210202 [1,0,0,0,0,0|3,0,0]=4 1078 B11R1.192 CCSc1ccc(c(n1)C)C 62a_100000210202_100000103781 [1,0,0,0,0,0|3,0,0]=4 1079 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100000210202_100009814307 [1,0,0,0,0,0|3,0,0]=4 1080 B11R1.192 CCSc1ccc(c(n1)C)F 62a_100009814307_100000210202 [1,0,0,0,0,0|3,0,0]=4 1081 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000210202_100000720120 [1,0,0,0,0,0|3,0,0]=4 1082 B11R1.192 CCSc1ccc(c(n1)C)N 62a_100000720120_100000210202 [1,0,0,0,0,0|3,0,0]=4 1083 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100000210202_100010233687 [1,0,0,0,0,0|2,0,0]=3 1084 B11R1.192 CCSc1ccc(c(n1)C)O 62a_100010233687_100000210202 [1,0,0,0,0,0|2,0,0]=3 1085 B11R1.192 CCSc1ccc(c(n1)Cl)O 62a_100000210202_100000721234 [1,0,0,0,0,0|3,0,0]=4 1086 B11R1.192 CCSc1ccc(c(n1)F)O 62a_100000210202_100009819667 [1,0,0,0,0,0|3,0,0]=4 1087 B11R1.192 CCSc1ccc(c(n1)F)O 62a_100009819667_100000210202 [1,0,0,0,0,0|3,0,0]=4 1088 B11R1.192 CCSc1ccc(c(n1)N)O 62a_100000210202_100000685527 [1,0,0,0,0,0|3,0,0]=4 1089 B11R1.192 CCSc1ccc(c(n1)N)O 62a_100000685527_100000210202 [1,0,0,0,0,0|3,0,0]=4 1090 B11R1.192 CCSc1ccc(c(n1)O)F 62a_100000210202_100010729010 [1,0,0,0,0,0|3,0,0]=4 1091 B11R1.192 CCSc1ccc(c(n1)O)N 62a_100000718904_100000210202 [1,0,0,0,0,0|3,0,0]=4 1092 B11R1.192 CCSc1cnc(c(c1)C)Br 62a_100000210202_100009816107 [1,0,0,0,0,0|3,0,0]=4 1093 B11R1.192 CCSc1cnc(c(c1)C)Br 62a_100009816107_100000210202 [1,0,0,0,0,0|3,0,0]=4 1094 B11R1.192 CCSc1cnc(c(c1)C)C 62a_100000210202_100000697892 [1,0,0,0,0,0|3,0,0]=4 1095 B11R1.192 CCSc1cnc(c(c1)C)C 62a_100000697892_100000210202 [1,0,0,0,0,0|3,0,0]=4 1096 B11R1.192 CCSc1cnc(c(c1)C)Cl 62a_100000210202_100009922867 [1,0,0,0,0,0|3,0,0]=4 1097 B11R1.192 CCSc1cnc(c(c1)C)Cl 62a_100009922867_100000210202 [1,0,0,0,0,0|3,0,0]=4 1098 B11R1.192 CCSc1cnc(c(c1)C)F 62a_100000210202_100000709442 [1,0,0,0,0,0|3,0,0]=4 1099 B11R1.192 CCSc1cnc(c(c1)C)F 62a_100000709442_100000210202 [1,0,0,0,0,0|3,0,0]=4 1100 B11R1.192 CCSc1cnc(c(c1)C)N 62a_100000210202_100000684428 [1,0,0,0,0,0|3,0,0]=4 1101 B11R1.192 CCSc1cnc(c(c1)C)N 62a_100000684428_100000210202 [1,0,0,0,0,0|3,0,0]=4 1102 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000210202_100000685391 [1,0,0,0,0,0|2,0,0]=3 1103 B11R1.192 CCSc1cnc(c(c1)C)O 62a_100000685391_100000210202 [1,0,0,0,0,0|2,0,0]=3 1104 B11R1.192 CCSc1cnc(c(c1)Cl)O 62a_100000210202_100010238531 [1,0,0,0,0,0|3,0,0]=4 1105 B11R1.192 CCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210202 [1,0,0,0,0,0|3,0,0]=4 1106 B11R1.192 CCSc1cnc(c(c1)N)O 62a_100000210202_100000743729 [1,0,0,0,0,0|3,0,0]=4 1107 B11R1.192 CCSc1cnc(c(c1)N)O 62a_100000743729_100000210202 [1,0,0,0,0,0|3,0,0]=4 1108 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100000210202_100009864810 [1,0,0,0,0,0|3,0,0]=4 1109 B11R1.192 CCSc1cnc(c(c1)O)C 62a_100009864810_100000210202 [1,0,0,0,0,0|3,0,0]=4 1110 B11R1.192 CCSc1cnc(c(c1)O)F 62a_100000210202_100009819871 [1,0,0,0,0,0|3,0,0]=4 1111 B11R1.192 CCSc1cnc(c(c1)O)F 62a_100009819871_100000210202 [1,0,0,0,0,0|3,0,0]=4 1112 B11R1.192 CCSc1cnc(c(c1)O)N 62a_100000210202_100009819042 [1,0,0,0,0,0|3,0,0]=4 1113 B11R1.192 CCSc1cnc(c(c1)O)N 62a_100009819042_100000210202 [1,0,0,0,0,0|3,0,0]=4 1114 B11R1.192 CNCc1cc(=O)c(co1)O 2230a_106832991635_100000010605 [1,0,0,0,0,0|2,0,1]=4 1115 B11R1.192 CNCc1cc(=O)c(co1)O 7a_106832991635_100000010605 [1,0,0,0,0,0|2,0,1]=4 1116 B11R1.192 CNCc1cc(c(cn1)Br)C 207a_100102657272_100009814806 [1,0,0,0,0,0|3,0,0]=4 1117 B11R1.192 CNCc1cc(c(cn1)Br)C 270004a_106832991635_100009814806 [1,0,0,0,0,0|3,0,0]=4 1118 B11R1.192 CNCc1ccc(=O)n(c1)C 207a_100102657272_100010620449 [1,0,0,0,0,0|2,0,1]=4 1119 B11R1.192 CNCc1ccc(=O)n(c1)C 270004a_106832991635_100010620449 [1,0,0,0,0,0|2,0,1]=4 1120 B11R1.192 CNCc1ccc(c(c1)Br)Br 207a_100102657272_100011215943 [1,0,0,0,0,0|3,0,0]=4 1121 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_100012351559_200000210301 [1,0,0,0,0,0|3,0,0]=4 1122 B11R1.192 CNCc1ccc(c(c1)Br)Br 2230a_106832991635_100012353900 [1,0,0,0,0,0|3,0,0]=4 1123 B11R1.192 CNCc1ccc(c(c1)Br)Br 270004a_106832991635_100011215943 [1,0,0,0,0,0|3,0,0]=4 1124 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100012351559_200000210301 [1,0,0,0,0,0|3,0,0]=4 1125 B11R1.192 CNCc1ccc(c(c1)Br)Br 34a_100102657272_100012353900 [1,0,0,0,0,0|3,0,0]=4 1126 B11R1.192 CNCc1ccc(c(c1)Br)Br 7a_106832991635_100012353900 [1,0,0,0,0,0|3,0,0]=4 1127 B11R1.192 CNCc1ccc(c(c1)Br)C 207a_100102657272_100000695567 [1,0,0,0,0,0|3,0,0]=4 1128 B11R1.192 CNCc1ccc(c(c1)Br)C 2230a_106832991635_100012232412 [1,0,0,0,0,0|3,0,0]=4 1129 B11R1.192 CNCc1ccc(c(c1)Br)C 26a_100102657272_100011380479 [1,0,0,0,0,0|3,0,0]=4 1130 B11R1.192 CNCc1ccc(c(c1)Br)C 270004a_106832991635_100000695567 [1,0,0,0,0,0|3,0,0]=4 1131 B11R1.192 CNCc1ccc(c(c1)Br)C 34a_100102657272_100012232412 [1,0,0,0,0,0|3,0,0]=4 1132 B11R1.192 CNCc1ccc(c(c1)Br)C 7a_106832991635_100012232412 [1,0,0,0,0,0|3,0,0]=4 1133 B11R1.192 CNCc1ccc(c(c1)Br)Cl 207a_100102657272_100000693810 [1,0,0,0,0,0|3,0,0]=4 1134 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_100012349490_200000210301 [1,0,0,0,0,0|3,0,0]=4 1135 B11R1.192 CNCc1ccc(c(c1)Br)Cl 2230a_106832991635_100012353894 [1,0,0,0,0,0|3,0,0]=4 1136 B11R1.192 CNCc1ccc(c(c1)Br)Cl 26a_100102657272_100011933957 [1,0,0,0,0,0|3,0,0]=4 1137 B11R1.192 CNCc1ccc(c(c1)Br)Cl 270004a_106832991635_100000693810 [1,0,0,0,0,0|3,0,0]=4 1138 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100012349490_200000210301 [1,0,0,0,0,0|3,0,0]=4 1139 B11R1.192 CNCc1ccc(c(c1)Br)Cl 34a_100102657272_100012353894 [1,0,0,0,0,0|3,0,0]=4 1140 B11R1.192 CNCc1ccc(c(c1)Br)Cl 7a_106832991635_100012353894 [1,0,0,0,0,0|3,0,0]=4 1141 B11R1.192 CNCc1ccc(c(c1)Br)F 207a_100102657272_100000211747 [1,0,0,0,0,0|3,0,0]=4 1142 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_100015193890_200000210301 [1,0,0,0,0,0|3,0,0]=4 1143 B11R1.192 CNCc1ccc(c(c1)Br)F 2230a_106832991635_100011206884 [1,0,0,0,0,0|3,0,0]=4 1144 B11R1.192 CNCc1ccc(c(c1)Br)F 26a_100102657272_100000693481 [1,0,0,0,0,0|3,0,0]=4 1145 B11R1.192 CNCc1ccc(c(c1)Br)F 270004a_106832991635_100000211747 [1,0,0,0,0,0|3,0,0]=4 1146 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100015193890_200000210301 [1,0,0,0,0,0|3,0,0]=4 1147 B11R1.192 CNCc1ccc(c(c1)Br)F 34a_100102657272_100011206884 [1,0,0,0,0,0|3,0,0]=4 1148 B11R1.192 CNCc1ccc(c(c1)Br)F 7a_106832991635_100011206884 [1,0,0,0,0,0|3,0,0]=4 1149 B11R1.192 CNCc1ccc(c(c1)Br)I 26a_100102657272_100000701344 [1,0,0,0,0,0|3,0,0]=4 1150 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [1,0,0,0,0,0|2,0,0]=3 1151 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [1,0,0,0,0,0|2,0,0]=3 1152 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [1,0,0,0,0,0|2,0,0]=3 1153 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [1,0,0,0,0,0|2,0,0]=3 1154 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [1,0,0,0,0,0|2,0,0]=3 1155 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [1,0,0,0,0,0|2,0,0]=3 1156 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [1,0,0,0,0,0|2,0,0]=3 1157 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [1,0,0,0,0,0|2,0,0]=3 1158 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [1,0,0,0,0,0|2,0,0]=3 1159 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [1,0,0,0,0,0|2,0,0]=3 1160 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [1,0,0,0,0,0|2,0,0]=3 1161 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [1,0,0,0,0,0|2,0,0]=3 1162 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [1,0,0,0,0,0|2,0,0]=3 1163 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [1,0,0,0,0,0|2,0,0]=3 1164 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [1,0,0,0,0,0|2,0,0]=3 1165 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [1,0,0,0,0,0|2,0,0]=3 1166 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [1,0,0,0,0,0|2,0,0]=3 1167 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [1,0,0,0,0,0|2,0,0]=3 1168 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [1,0,0,0,0,0|2,0,0]=3 1169 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [1,0,0,0,0,0|2,0,0]=3 1170 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [1,0,0,0,0,0|2,0,0]=3 1171 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [1,0,0,0,0,0|2,0,0]=3 1172 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [1,0,0,0,0,0|2,0,0]=3 1173 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [1,0,0,0,0,0|2,0,0]=3 1174 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [1,0,0,0,0,0|2,0,0]=3 1175 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [1,0,0,0,0,0|2,0,0]=3 1176 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [1,0,0,0,0,0|2,0,0]=3 1177 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [1,0,0,0,0,0|2,0,0]=3 1178 B11R1.192 CNCc1ccc(c(c1)Cl)Br 207a_100102657272_100000690054 [1,0,0,0,0,0|3,0,0]=4 1179 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_100012362553_200000210301 [1,0,0,0,0,0|3,0,0]=4 1180 B11R1.192 CNCc1ccc(c(c1)Cl)Br 2230a_106832991635_100012353895 [1,0,0,0,0,0|3,0,0]=4 1181 B11R1.192 CNCc1ccc(c(c1)Cl)Br 26a_100102657272_100011215161 [1,0,0,0,0,0|3,0,0]=4 1182 B11R1.192 CNCc1ccc(c(c1)Cl)Br 270004a_106832991635_100000690054 [1,0,0,0,0,0|3,0,0]=4 1183 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100012362553_200000210301 [1,0,0,0,0,0|3,0,0]=4 1184 B11R1.192 CNCc1ccc(c(c1)Cl)Br 34a_100102657272_100012353895 [1,0,0,0,0,0|3,0,0]=4 1185 B11R1.192 CNCc1ccc(c(c1)Cl)Br 7a_106832991635_100012353895 [1,0,0,0,0,0|3,0,0]=4 1186 B11R1.192 CNCc1ccc(c(c1)Cl)C 207a_100102657272_100000760539 [1,0,0,0,0,0|3,0,0]=4 1187 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_102495364989_200000210301 [1,0,0,0,0,0|3,0,0]=4 1188 B11R1.192 CNCc1ccc(c(c1)Cl)C 2230a_106832991635_100011823929 [1,0,0,0,0,0|3,0,0]=4 1189 B11R1.192 CNCc1ccc(c(c1)Cl)C 26a_100102657272_100011265682 [1,0,0,0,0,0|3,0,0]=4 1190 B11R1.192 CNCc1ccc(c(c1)Cl)C 270004a_106832991635_100000760539 [1,0,0,0,0,0|3,0,0]=4 1191 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_100102657272_100011823929 [1,0,0,0,0,0|3,0,0]=4 1192 B11R1.192 CNCc1ccc(c(c1)Cl)C 34a_102495364989_200000210301 [1,0,0,0,0,0|3,0,0]=4 1193 B11R1.192 CNCc1ccc(c(c1)Cl)C 7a_106832991635_100011823929 [1,0,0,0,0,0|3,0,0]=4 1194 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 207a_100102657272_100000188533 [1,0,0,0,0,0|3,0,0]=4 1195 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200000210301 [1,0,0,0,0,0|3,0,0]=4 1196 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100000184707 [1,0,0,0,0,0|3,0,0]=4 1197 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 26a_100102657272_100000211054 [1,0,0,0,0,0|3,0,0]=4 1198 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 270004a_106832991635_100000188533 [1,0,0,0,0,0|3,0,0]=4 1199 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100000174881_200000210301 [1,0,0,0,0,0|3,0,0]=4 1200 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 34a_100102657272_100000184707 [1,0,0,0,0,0|3,0,0]=4 1201 B11R1.192 CNCc1ccc(c(c1)Cl)Cl 7a_106832991635_100000184707 [1,0,0,0,0,0|3,0,0]=4 1202 B11R1.192 CNCc1ccc(c(c1)Cl)F 207a_100102657272_100000742290 [1,0,0,0,0,0|3,0,0]=4 1203 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_100000749334_200000210301 [1,0,0,0,0,0|3,0,0]=4 1204 B11R1.192 CNCc1ccc(c(c1)Cl)F 2230a_106832991635_100000717365 [1,0,0,0,0,0|3,0,0]=4 1205 B11R1.192 CNCc1ccc(c(c1)Cl)F 26a_100102657272_100000211030 [1,0,0,0,0,0|3,0,0]=4 1206 B11R1.192 CNCc1ccc(c(c1)Cl)F 270004a_106832991635_100000742290 [1,0,0,0,0,0|3,0,0]=4 1207 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100000749334_200000210301 [1,0,0,0,0,0|3,0,0]=4 1208 B11R1.192 CNCc1ccc(c(c1)Cl)F 34a_100102657272_100011934319 [1,0,0,0,0,0|3,0,0]=4 1209 B11R1.192 CNCc1ccc(c(c1)Cl)F 7a_106832991635_100000717365 [1,0,0,0,0,0|3,0,0]=4 1210 B11R1.192 CNCc1ccc(c(c1)Cl)I 2230a_106832991635_100012349665 [1,0,0,0,0,0|3,0,0]=4 1211 B11R1.192 CNCc1ccc(c(c1)Cl)I 26a_100102657272_100000047559 [1,0,0,0,0,0|3,0,0]=4 1212 B11R1.192 CNCc1ccc(c(c1)Cl)I 34a_100102657272_100012349665 [1,0,0,0,0,0|3,0,0]=4 1213 B11R1.192 CNCc1ccc(c(c1)Cl)I 7a_106832991635_100012349665 [1,0,0,0,0,0|3,0,0]=4 1214 B11R1.192 CNCc1ccc(c(c1)F)Br 207a_100102657272_100000686674 [1,0,0,0,0,0|3,0,0]=4 1215 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_100000755036_200000210301 [1,0,0,0,0,0|3,0,0]=4 1216 B11R1.192 CNCc1ccc(c(c1)F)Br 2230a_106832991635_100000767054 [1,0,0,0,0,0|3,0,0]=4 1217 B11R1.192 CNCc1ccc(c(c1)F)Br 26a_100102657272_100000755031 [1,0,0,0,0,0|3,0,0]=4 1218 B11R1.192 CNCc1ccc(c(c1)F)Br 270004a_106832991635_100000686674 [1,0,0,0,0,0|3,0,0]=4 1219 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100000755036_200000210301 [1,0,0,0,0,0|3,0,0]=4 1220 B11R1.192 CNCc1ccc(c(c1)F)Br 34a_100102657272_100000767054 [1,0,0,0,0,0|3,0,0]=4 1221 B11R1.192 CNCc1ccc(c(c1)F)Br 7a_106832991635_100000767054 [1,0,0,0,0,0|3,0,0]=4 1222 B11R1.192 CNCc1ccc(c(c1)F)C 207a_100102657272_100000753222 [1,0,0,0,0,0|3,0,0]=4 1223 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_100102708794_200000210301 [1,0,0,0,0,0|3,0,0]=4 1224 B11R1.192 CNCc1ccc(c(c1)F)C 2230a_106832991635_100011217369 [1,0,0,0,0,0|3,0,0]=4 1225 B11R1.192 CNCc1ccc(c(c1)F)C 270004a_106832991635_100000753222 [1,0,0,0,0,0|3,0,0]=4 1226 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102657272_100011217369 [1,0,0,0,0,0|3,0,0]=4 1227 B11R1.192 CNCc1ccc(c(c1)F)C 34a_100102708794_200000210301 [1,0,0,0,0,0|3,0,0]=4 1228 B11R1.192 CNCc1ccc(c(c1)F)C 7a_106832991635_100011217369 [1,0,0,0,0,0|3,0,0]=4 1229 B11R1.192 CNCc1ccc(c(c1)F)Cl 207a_100102657272_100000745630 [1,0,0,0,0,0|3,0,0]=4 1230 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_100011219866_200000210301 [1,0,0,0,0,0|3,0,0]=4 1231 B11R1.192 CNCc1ccc(c(c1)F)Cl 2230a_106832991635_100000716492 [1,0,0,0,0,0|3,0,0]=4 1232 B11R1.192 CNCc1ccc(c(c1)F)Cl 26a_100102657272_100000691581 [1,0,0,0,0,0|3,0,0]=4 1233 B11R1.192 CNCc1ccc(c(c1)F)Cl 270004a_106832991635_100000745630 [1,0,0,0,0,0|3,0,0]=4 1234 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100011219866_200000210301 [1,0,0,0,0,0|3,0,0]=4 1235 B11R1.192 CNCc1ccc(c(c1)F)Cl 34a_100102657272_100011519011 [1,0,0,0,0,0|3,0,0]=4 1236 B11R1.192 CNCc1ccc(c(c1)F)Cl 7a_106832991635_100000716492 [1,0,0,0,0,0|3,0,0]=4 1237 B11R1.192 CNCc1ccc(c(c1)F)F 207a_100102657272_100000211062 [1,0,0,0,0,0|3,0,0]=4 1238 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_100000737897_200000210301 [1,0,0,0,0,0|3,0,0]=4 1239 B11R1.192 CNCc1ccc(c(c1)F)F 2230a_106832991635_100000757363 [1,0,0,0,0,0|3,0,0]=4 1240 B11R1.192 CNCc1ccc(c(c1)F)F 270004a_106832991635_100000211062 [1,0,0,0,0,0|3,0,0]=4 1241 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100000737897_200000210301 [1,0,0,0,0,0|3,0,0]=4 1242 B11R1.192 CNCc1ccc(c(c1)F)F 34a_100102657272_100000757363 [1,0,0,0,0,0|3,0,0]=4 1243 B11R1.192 CNCc1ccc(c(c1)F)F 7a_106832991635_100000757363 [1,0,0,0,0,0|3,0,0]=4 1244 B11R1.192 CNCc1ccc(c(c1)F)I 207a_100102657272_100000050832 [1,0,0,0,0,0|3,0,0]=4 1245 B11R1.192 CNCc1ccc(c(c1)F)I 2230a_106832991635_100010149604 [1,0,0,0,0,0|3,0,0]=4 1246 B11R1.192 CNCc1ccc(c(c1)F)I 270004a_106832991635_100000050832 [1,0,0,0,0,0|3,0,0]=4 1247 B11R1.192 CNCc1ccc(c(c1)F)I 34a_100102657272_100010149604 [1,0,0,0,0,0|3,0,0]=4 1248 B11R1.192 CNCc1ccc(c(c1)F)I 7a_106832991635_100010149604 [1,0,0,0,0,0|3,0,0]=4 1249 B11R1.192 CNCc1ccc(c(c1)F)O 34a_100000758358_200000210301 [1,0,0,0,0,0|2,0,0]=3 1250 B11R1.192 CNCc1ccc(c(c1)I)Br 207a_100102657272_100010146563 [1,0,0,0,0,0|3,0,0]=4 1251 B11R1.192 CNCc1ccc(c(c1)I)Br 2230a_106832991635_100010146616 [1,0,0,0,0,0|3,0,0]=4 1252 B11R1.192 CNCc1ccc(c(c1)I)Br 26a_100102657272_100012339312 [1,0,0,0,0,0|3,0,0]=4 1253 B11R1.192 CNCc1ccc(c(c1)I)Br 270004a_106832991635_100010146563 [1,0,0,0,0,0|3,0,0]=4 1254 B11R1.192 CNCc1ccc(c(c1)I)Br 34a_100102657272_100010146616 [1,0,0,0,0,0|3,0,0]=4 1255 B11R1.192 CNCc1ccc(c(c1)I)Br 7a_106832991635_100010146616 [1,0,0,0,0,0|3,0,0]=4 1256 B11R1.192 CNCc1ccc(c(c1)I)C 207a_100102657272_100010197721 [1,0,0,0,0,0|3,0,0]=4 1257 B11R1.192 CNCc1ccc(c(c1)I)C 2230a_106832991635_100010206137 [1,0,0,0,0,0|3,0,0]=4 1258 B11R1.192 CNCc1ccc(c(c1)I)C 270004a_106832991635_100010197721 [1,0,0,0,0,0|3,0,0]=4 1259 B11R1.192 CNCc1ccc(c(c1)I)C 34a_100102657272_100010206137 [1,0,0,0,0,0|3,0,0]=4 1260 B11R1.192 CNCc1ccc(c(c1)I)C 7a_106832991635_100010206137 [1,0,0,0,0,0|3,0,0]=4 1261 B11R1.192 CNCc1ccc(c(c1)I)Cl 207a_100102657272_100010209939 [1,0,0,0,0,0|3,0,0]=4 1262 B11R1.192 CNCc1ccc(c(c1)I)Cl 26a_100102657272_100000049588 [1,0,0,0,0,0|3,0,0]=4 1263 B11R1.192 CNCc1ccc(c(c1)I)Cl 270004a_106832991635_100010209939 [1,0,0,0,0,0|3,0,0]=4 1264 B11R1.192 CNCc1ccc(c(c1)I)F 207a_100102657272_100010188209 [1,0,0,0,0,0|3,0,0]=4 1265 B11R1.192 CNCc1ccc(c(c1)I)F 2230a_106832991635_100010188208 [1,0,0,0,0,0|3,0,0]=4 1266 B11R1.192 CNCc1ccc(c(c1)I)F 270004a_106832991635_100010188209 [1,0,0,0,0,0|3,0,0]=4 1267 B11R1.192 CNCc1ccc(c(c1)I)F 34a_100102657272_100010188208 [1,0,0,0,0,0|3,0,0]=4 1268 B11R1.192 CNCc1ccc(c(c1)I)F 7a_106832991635_100010188208 [1,0,0,0,0,0|3,0,0]=4 1269 B11R1.192 CNCc1ccc(c(c1)O)Cl 34a_100020636435_200000210301 [1,0,0,0,0,0|2,0,0]=3 1270 B11R1.192 CNCc1ccc(c(c1)O)F 34a_100160469508_200000210301 [1,0,0,0,0,0|2,0,0]=3 1271 B11R1.192 CNCc1ccc(c(c1)O)O 34a_100000010075_200000210301 [1,0,0,0,0,0|1,0,0]=2 1272 B11R1.192 CNCc1ccc(c(n1)C)Br 207a_100102657272_100010238520 [1,0,0,0,0,0|3,0,0]=4 1273 B11R1.192 CNCc1ccc(c(n1)C)Br 270004a_106832991635_100010238520 [1,0,0,0,0,0|3,0,0]=4 1274 B11R1.192 CNCc1ccc(c(n1)C)C 2230a_202515432893_200000210301 [1,0,0,0,0,0|3,0,0]=4 1275 B11R1.192 CNCc1ccc(c(n1)C)C 34a_202515432893_200000210301 [1,0,0,0,0,0|3,0,0]=4 1276 B11R1.192 CNCc1cnc(c(c1)Br)O 207a_100102657272_100010064886 [1,0,0,0,0,0|3,0,0]=4 1277 B11R1.192 CNCc1cnc(c(c1)Br)O 270004a_106832991635_100010064886 [1,0,0,0,0,0|3,0,0]=4 1278 B11R1.192 CNCc1cnc(c(c1)C)Br 270004a_106832991635_100009814818 [1,0,0,0,0,0|3,0,0]=4 1279 B11R1.192 CNCc1cnc(c(c1)C)Cl 207a_100102657272_100000070293 [1,0,0,0,0,0|3,0,0]=4 1280 B11R1.192 CNCc1cnc(c(c1)C)Cl 270004a_106832991635_100000070293 [1,0,0,0,0,0|3,0,0]=4 1281 B11R1.192 CNCc1cnc(c(c1)C)F 270004a_106832991635_100000050577 [1,0,0,0,0,0|3,0,0]=4 1282 B11R1.192 COCc1cc(c(cn1)Br)C 34a_200010713146_200000210301 [1,0,0,0,0,0|3,0,0]=4 1283 B11R1.192 COCc1ccc(c(c1)Br)Br 34a_100138415774_100012353900 [1,0,0,0,0,0|3,0,0]=4 1284 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100000708995_200000210301 [1,0,0,0,0,0|3,0,0]=4 1285 B11R1.192 COCc1ccc(c(c1)Br)C 34a_100138415774_100012232412 [1,0,0,0,0,0|3,0,0]=4 1286 B11R1.192 COCc1ccc(c(c1)Br)C 7a_100000708995_200000210301 [1,0,0,0,0,0|3,0,0]=4 1287 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100012353893_200000210301 [1,0,0,0,0,0|3,0,0]=4 1288 B11R1.192 COCc1ccc(c(c1)Br)Cl 34a_100138415774_100012353894 [1,0,0,0,0,0|3,0,0]=4 1289 B11R1.192 COCc1ccc(c(c1)Br)Cl 7a_100012353893_200000210301 [1,0,0,0,0,0|3,0,0]=4 1290 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100000246287_200000210301 [1,0,0,0,0,0|3,0,0]=4 1291 B11R1.192 COCc1ccc(c(c1)Br)F 34a_100138415774_100011206884 [1,0,0,0,0,0|3,0,0]=4 1292 B11R1.192 COCc1ccc(c(c1)Br)F 7a_100000246287_200000210301 [1,0,0,0,0,0|3,0,0]=4 1293 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [1,0,0,0,0,0|2,0,0]=3 1294 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [1,0,0,0,0,0|2,0,0]=3 1295 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [1,0,0,0,0,0|2,0,0]=3 1296 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [1,0,0,0,0,0|2,0,0]=3 1297 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [1,0,0,0,0,0|2,0,0]=3 1298 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [1,0,0,0,0,0|2,0,0]=3 1299 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [1,0,0,0,0,0|2,0,0]=3 1300 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [1,0,0,0,0,0|2,0,0]=3 1301 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [1,0,0,0,0,0|2,0,0]=3 1302 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [1,0,0,0,0,0|2,0,0]=3 1303 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [1,0,0,0,0,0|2,0,0]=3 1304 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100000709168_200000210301 [1,0,0,0,0,0|3,0,0]=4 1305 B11R1.192 COCc1ccc(c(c1)Cl)Br 34a_100138415774_100012353895 [1,0,0,0,0,0|3,0,0]=4 1306 B11R1.192 COCc1ccc(c(c1)Cl)Br 7a_100000709168_200000210301 [1,0,0,0,0,0|3,0,0]=4 1307 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100011290783_200000210301 [1,0,0,0,0,0|3,0,0]=4 1308 B11R1.192 COCc1ccc(c(c1)Cl)C 34a_100138415774_100011823929 [1,0,0,0,0,0|3,0,0]=4 1309 B11R1.192 COCc1ccc(c(c1)Cl)C 7a_100011290783_200000210301 [1,0,0,0,0,0|3,0,0]=4 1310 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100000211588_200000210301 [1,0,0,0,0,0|3,0,0]=4 1311 B11R1.192 COCc1ccc(c(c1)Cl)Cl 34a_100138415774_100000184707 [1,0,0,0,0,0|3,0,0]=4 1312 B11R1.192 COCc1ccc(c(c1)Cl)Cl 7a_100000211588_200000210301 [1,0,0,0,0,0|3,0,0]=4 1313 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100011217911_200000210301 [1,0,0,0,0,0|3,0,0]=4 1314 B11R1.192 COCc1ccc(c(c1)Cl)F 34a_100138415774_100011934319 [1,0,0,0,0,0|3,0,0]=4 1315 B11R1.192 COCc1ccc(c(c1)Cl)F 7a_100011217911_200000210301 [1,0,0,0,0,0|3,0,0]=4 1316 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100000718186_200000210301 [1,0,0,0,0,0|3,0,0]=4 1317 B11R1.192 COCc1ccc(c(c1)Cl)I 34a_100138415774_100012349665 [1,0,0,0,0,0|3,0,0]=4 1318 B11R1.192 COCc1ccc(c(c1)Cl)I 7a_100000718186_200000210301 [1,0,0,0,0,0|3,0,0]=4 1319 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100011533735_200000210301 [1,0,0,0,0,0|3,0,0]=4 1320 B11R1.192 COCc1ccc(c(c1)F)Br 34a_100138415774_100000767054 [1,0,0,0,0,0|3,0,0]=4 1321 B11R1.192 COCc1ccc(c(c1)F)Br 7a_100011533735_200000210301 [1,0,0,0,0,0|3,0,0]=4 1322 B11R1.192 COCc1ccc(c(c1)F)C 34a_100000702247_200000210301 [1,0,0,0,0,0|3,0,0]=4 1323 B11R1.192 COCc1ccc(c(c1)F)C 34a_100138415774_100011217369 [1,0,0,0,0,0|3,0,0]=4 1324 B11R1.192 COCc1ccc(c(c1)F)C 7a_100000702247_200000210301 [1,0,0,0,0,0|3,0,0]=4 1325 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100011218299_200000210301 [1,0,0,0,0,0|3,0,0]=4 1326 B11R1.192 COCc1ccc(c(c1)F)Cl 34a_100138415774_100011519011 [1,0,0,0,0,0|3,0,0]=4 1327 B11R1.192 COCc1ccc(c(c1)F)Cl 7a_100011218299_200000210301 [1,0,0,0,0,0|3,0,0]=4 1328 B11R1.192 COCc1ccc(c(c1)F)F 34a_100011215442_200000210301 [1,0,0,0,0,0|3,0,0]=4 1329 B11R1.192 COCc1ccc(c(c1)F)F 34a_100138415774_100000757363 [1,0,0,0,0,0|3,0,0]=4 1330 B11R1.192 COCc1ccc(c(c1)F)F 7a_100011215442_200000210301 [1,0,0,0,0,0|3,0,0]=4 1331 B11R1.192 COCc1ccc(c(c1)F)I 34a_100010149597_200000210301 [1,0,0,0,0,0|3,0,0]=4 1332 B11R1.192 COCc1ccc(c(c1)F)I 34a_100138415774_100010149604 [1,0,0,0,0,0|3,0,0]=4 1333 B11R1.192 COCc1ccc(c(c1)F)I 7a_100010149597_200000210301 [1,0,0,0,0,0|3,0,0]=4 1334 B11R1.192 COCc1ccc(c(c1)F)N 34a_100011217239_200000210301 [1,0,0,0,0,0|3,0,0]=4 1335 B11R1.192 COCc1ccc(c(c1)F)O 271570a_203496583355_100010177442 [1,0,0,0,0,0|2,0,0]=3 1336 B11R1.192 COCc1ccc(c(c1)I)Br 34a_100138415774_100010146616 [1,0,0,0,0,0|3,0,0]=4 1337 B11R1.192 COCc1ccc(c(c1)I)C 34a_100000050133_200000210301 [1,0,0,0,0,0|3,0,0]=4 1338 B11R1.192 COCc1ccc(c(c1)I)C 34a_100138415774_100010206137 [1,0,0,0,0,0|3,0,0]=4 1339 B11R1.192 COCc1ccc(c(c1)I)C 7a_100000050133_200000210301 [1,0,0,0,0,0|3,0,0]=4 1340 B11R1.192 COCc1ccc(c(c1)I)F 34a_100000049585_200000210301 [1,0,0,0,0,0|3,0,0]=4 1341 B11R1.192 COCc1ccc(c(c1)I)F 34a_100138415774_100010188208 [1,0,0,0,0,0|3,0,0]=4 1342 B11R1.192 COCc1ccc(c(c1)I)F 7a_100000049585_200000210301 [1,0,0,0,0,0|3,0,0]=4 1343 B11R1.192 COCc1ccc(c(c1)N)Br 34a_100012347568_200000210301 [1,0,0,0,0,0|3,0,0]=4 1344 B11R1.192 COCc1ccc(c(c1)N)C 34a_100000758420_200000210301 [1,0,0,0,0,0|3,0,0]=4 1345 B11R1.192 COCc1ccc(c(c1)N)Cl 34a_106256033963_200000210301 [1,0,0,0,0,0|3,0,0]=4 1346 B11R1.192 COCc1ccc(c(c1)N)F 34a_102125399562_200000210301 [1,0,0,0,0,0|3,0,0]=4 1347 B11R1.192 COCc1ccc(c(c1)N)O 271570a_203496583355_200013033220 [1,0,0,0,0,0|2,0,0]=3 1348 B11R1.192 COCc1ccc(c(c1)O)C 271570a_203496583355_200015395492 [1,0,0,0,0,0|2,0,0]=3 1349 B11R1.192 COCc1ccc(c(c1)O)F 271570a_203496583355_200011493689 [1,0,0,0,0,0|2,0,0]=3 1350 B11R1.192 COCc1ccc(c(n1)C)Br 34a_100010114280_200000210301 [1,0,0,0,0,0|3,0,0]=4 1351 B11R1.192 COCc1ccc(c(n1)C)F 34a_200009884719_200000210301 [1,0,0,0,0,0|3,0,0]=4 1352 B11R1.192 COCc1cnc(c(c1)C)Cl 34a_200000092119_200000210301 [1,0,0,0,0,0|3,0,0]=4 1353 B11R1.192 COCc1cnc(c(c1)C)Cl 7a_200000092119_200000210301 [1,0,0,0,0,0|3,0,0]=4 1354 B11R1.192 CSCc1cc(=O)c(co1)O 62a_200000210301_100000010605 [1,0,0,0,0,0|2,0,1]=4 1355 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_100012353900_200000210301 [1,0,0,0,0,0|3,0,0]=4 1356 B11R1.192 CSCc1ccc(c(c1)Br)Br 62a_200000210301_100012353900 [1,0,0,0,0,0|3,0,0]=4 1357 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_100012232412_200000210301 [1,0,0,0,0,0|3,0,0]=4 1358 B11R1.192 CSCc1ccc(c(c1)Br)C 62a_200000210301_100012232412 [1,0,0,0,0,0|3,0,0]=4 1359 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_100012353894_200000210301 [1,0,0,0,0,0|3,0,0]=4 1360 B11R1.192 CSCc1ccc(c(c1)Br)Cl 62a_200000210301_100012353894 [1,0,0,0,0,0|3,0,0]=4 1361 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_100011206884_200000210301 [1,0,0,0,0,0|3,0,0]=4 1362 B11R1.192 CSCc1ccc(c(c1)Br)F 62a_200000210301_100011206884 [1,0,0,0,0,0|3,0,0]=4 1363 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_100000727479_200000210301 [1,0,0,0,0,0|2,0,0]=3 1364 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_200000210301_100000727479 [1,0,0,0,0,0|2,0,0]=3 1365 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [1,0,0,0,0,0|2,0,0]=3 1366 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [1,0,0,0,0,0|2,0,0]=3 1367 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_100012184735_200000210301 [1,0,0,0,0,0|2,0,0]=3 1368 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_200000210301_100012184735 [1,0,0,0,0,0|2,0,0]=3 1369 B11R1.192 CSCc1ccc(c(c1)C)F 62a_100011216667_200000210301 [1,0,0,0,0,0|2,0,0]=3 1370 B11R1.192 CSCc1ccc(c(c1)C)F 62a_200000210301_100011216667 [1,0,0,0,0,0|2,0,0]=3 1371 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_100012353895_200000210301 [1,0,0,0,0,0|3,0,0]=4 1372 B11R1.192 CSCc1ccc(c(c1)Cl)Br 62a_200000210301_100012353895 [1,0,0,0,0,0|3,0,0]=4 1373 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_100011823929_200000210301 [1,0,0,0,0,0|3,0,0]=4 1374 B11R1.192 CSCc1ccc(c(c1)Cl)C 62a_200000210301_100011823929 [1,0,0,0,0,0|3,0,0]=4 1375 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_100000184707_200000210301 [1,0,0,0,0,0|3,0,0]=4 1376 B11R1.192 CSCc1ccc(c(c1)Cl)Cl 62a_200000210301_100000184707 [1,0,0,0,0,0|3,0,0]=4 1377 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_100000717365_200000210301 [1,0,0,0,0,0|3,0,0]=4 1378 B11R1.192 CSCc1ccc(c(c1)Cl)F 62a_200000210301_100011934319 [1,0,0,0,0,0|3,0,0]=4 1379 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_100012349665_200000210301 [1,0,0,0,0,0|3,0,0]=4 1380 B11R1.192 CSCc1ccc(c(c1)Cl)I 62a_200000210301_100012349665 [1,0,0,0,0,0|3,0,0]=4 1381 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_100000767054_200000210301 [1,0,0,0,0,0|3,0,0]=4 1382 B11R1.192 CSCc1ccc(c(c1)F)Br 62a_200000210301_100000767054 [1,0,0,0,0,0|3,0,0]=4 1383 B11R1.192 CSCc1ccc(c(c1)F)C 62a_100011217369_200000210301 [1,0,0,0,0,0|3,0,0]=4 1384 B11R1.192 CSCc1ccc(c(c1)F)C 62a_200000210301_100011217369 [1,0,0,0,0,0|3,0,0]=4 1385 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_100000716492_200000210301 [1,0,0,0,0,0|3,0,0]=4 1386 B11R1.192 CSCc1ccc(c(c1)F)Cl 62a_200000210301_100000716492 [1,0,0,0,0,0|3,0,0]=4 1387 B11R1.192 CSCc1ccc(c(c1)F)F 62a_100000757363_200000210301 [1,0,0,0,0,0|3,0,0]=4 1388 B11R1.192 CSCc1ccc(c(c1)F)F 62a_200000210301_100000757363 [1,0,0,0,0,0|3,0,0]=4 1389 B11R1.192 CSCc1ccc(c(c1)F)I 62a_100010149604_200000210301 [1,0,0,0,0,0|3,0,0]=4 1390 B11R1.192 CSCc1ccc(c(c1)F)I 62a_200000210301_100010149604 [1,0,0,0,0,0|3,0,0]=4 1391 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_100010146616_200000210301 [1,0,0,0,0,0|3,0,0]=4 1392 B11R1.192 CSCc1ccc(c(c1)I)Br 62a_200000210301_100010146616 [1,0,0,0,0,0|3,0,0]=4 1393 B11R1.192 CSCc1ccc(c(c1)I)C 62a_100010206137_200000210301 [1,0,0,0,0,0|3,0,0]=4 1394 B11R1.192 CSCc1ccc(c(c1)I)C 62a_200000210301_100010206137 [1,0,0,0,0,0|3,0,0]=4 1395 B11R1.192 CSCc1ccc(c(c1)I)F 62a_100010188208_200000210301 [1,0,0,0,0,0|3,0,0]=4 1396 B11R1.192 CSCc1ccc(c(c1)I)F 62a_200000210301_100010188208 [1,0,0,0,0,0|3,0,0]=4 1397 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [1,0,0,0,0,0|2,0,0]=3 1398 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [1,0,0,0,0,0|2,0,0]=3 1399 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [1,0,0,0,0,0|2,0,0]=3 1400 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [1,0,0,0,0,0|2,0,0]=3 1401 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_100000727479_200025704644 [1,0,0,0,0,0|2,0,0]=3 1402 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100000727479 [1,0,0,0,0,0|2,0,0]=3 1403 B11R1.192 Cc1cc(ccc1Br)NCF 34a_100000210723_100015361967 [1,0,0,0,0,0|3,0,0]=4 1404 B11R1.192 Cc1cc(ccc1Br)NCF 7a_100000210723_100015361967 [1,0,0,0,0,0|3,0,0]=4 1405 B11R1.192 Cc1cc(ccc1Br)OCF 34a_100000690111_100015361967 [1,0,0,0,0,0|3,0,0]=4 1406 B11R1.192 Cc1cc(ccc1Br)OCF 7a_100000690111_100015361967 [1,0,0,0,0,0|3,0,0]=4 1407 B11R1.192 Cc1cc(ccc1Br)SCF 62a_100009813585_100015361967 [1,0,0,0,0,0|3,0,0]=4 1408 B11R1.192 Cc1cc(ccc1Br)SCF 62a_100015361967_100009813585 [1,0,0,0,0,0|3,0,0]=4 1409 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_100012184735_200025704644 [1,0,0,0,0,0|2,0,0]=3 1410 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100012184735 [1,0,0,0,0,0|2,0,0]=3 1411 B11R1.192 Cc1cc(ccc1Cl)NCF 34a_100000187808_100015361967 [1,0,0,0,0,0|3,0,0]=4 1412 B11R1.192 Cc1cc(ccc1Cl)NCF 7a_100000187808_100015361967 [1,0,0,0,0,0|3,0,0]=4 1413 B11R1.192 Cc1cc(ccc1Cl)OCF 34a_100000211092_100015361967 [1,0,0,0,0,0|3,0,0]=4 1414 B11R1.192 Cc1cc(ccc1Cl)OCF 7a_100000211092_100015361967 [1,0,0,0,0,0|3,0,0]=4 1415 B11R1.192 Cc1cc(ccc1Cl)SCF 62a_100000049509_100015361967 [1,0,0,0,0,0|3,0,0]=4 1416 B11R1.192 Cc1cc(ccc1Cl)SCF 62a_100015361967_100000049509 [1,0,0,0,0,0|3,0,0]=4 1417 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [1,0,0,0,0,0|2,0,0]=3 1418 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [1,0,0,0,0,0|2,0,0]=3 1419 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [1,0,0,0,0,0|2,0,0]=3 1420 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [1,0,0,0,0,0|2,0,0]=3 1421 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_100011216667_200025704644 [1,0,0,0,0,0|2,0,0]=3 1422 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_200025704644_100011216667 [1,0,0,0,0,0|2,0,0]=3 1423 B11R1.192 Cc1cc(ccc1F)NCF 34a_100000750164_100015361967 [1,0,0,0,0,0|3,0,0]=4 1424 B11R1.192 Cc1cc(ccc1F)NCF 7a_100000750164_100015361967 [1,0,0,0,0,0|3,0,0]=4 1425 B11R1.192 Cc1cc(ccc1F)OCF 34a_100000751312_100015361967 [1,0,0,0,0,0|3,0,0]=4 1426 B11R1.192 Cc1cc(ccc1F)OCF 7a_100000751312_100015361967 [1,0,0,0,0,0|3,0,0]=4 1427 B11R1.192 Cc1cc(ccc1F)SCF 62a_100011218330_100015361967 [1,0,0,0,0,0|3,0,0]=4 1428 B11R1.192 Cc1cc(ccc1F)SCF 62a_100015361967_100011218330 [1,0,0,0,0,0|3,0,0]=4 1429 B11R1.192 Cc1cc(ccc1I)NCF 34a_100000198070_100015361967 [1,0,0,0,0,0|3,0,0]=4 1430 B11R1.192 Cc1cc(ccc1I)NCF 7a_100000198070_100015361967 [1,0,0,0,0,0|3,0,0]=4 1431 B11R1.192 Cc1cc(ccc1I)OCF 34a_100000729255_100015361967 [1,0,0,0,0,0|3,0,0]=4 1432 B11R1.192 Cc1cc(ccc1I)OCF 7a_100000729255_100015361967 [1,0,0,0,0,0|3,0,0]=4 1433 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [1,0,0,0,0,0|2,0,0]=3 1434 B11R1.192 Cc1cc(ccc1N)OCF 34a_100000756630_100015361967 [1,0,0,0,0,0|3,0,0]=4 1435 B11R1.192 Cc1cc(ccc1N)OCF 7a_100000756630_100015361967 [1,0,0,0,0,0|3,0,0]=4 1436 B11R1.192 Cc1cc(ccc1N)SCF 62a_100000211769_100015361967 [1,0,0,0,0,0|3,0,0]=4 1437 B11R1.192 Cc1cc(ccc1N)SCF 62a_100015361967_100000211769 [1,0,0,0,0,0|3,0,0]=4 1438 B11R1.192 Cc1cc(ccc1O)CC#N 271570a_203496583355_100000726167 [1,0,0,0,0,0|1,0,1]=3 1439 B11R1.192 Cc1cc(ccc1O)NCF 34a_100011218179_100015361967 [1,0,0,0,0,0|2,0,0]=3 1440 B11R1.192 Cc1cc(ccc1O)NCF 7a_100011218179_100015361967 [1,0,0,0,0,0|2,0,0]=3 1441 B11R1.192 Cc1cc(ccc1O)SCF 62a_100015361967_100000186361 [1,0,0,0,0,0|2,0,0]=3 1442 B11R1.192 Cc1cc(cnc1Cl)CO[13CH3] 34a_200000092119_200025704644 [1,0,0,0,0,0|3,0,0]=4 1443 B11R1.192 Cc1cc(cnc1Cl)CO[13CH3] 7a_200000092119_200025704644 [1,0,0,0,0,0|3,0,0]=4 1444 B11R1.192 Cc1cc(cnc1O)SCF 62a_100000685391_100015361967 [1,0,0,0,0,0|3,0,0]=4 1445 B11R1.192 Cc1cc(cnc1O)SCF 62a_100015361967_100000685391 [1,0,0,0,0,0|3,0,0]=4 1446 B11R1.192 Cc1cc(ncc1Br)CO[13CH3] 34a_200010713146_200025704644 [1,0,0,0,0,0|3,0,0]=4 1447 B11R1.192 Cc1cc(ncc1O)SCF 62a_100015361967_100000692680 [1,0,0,0,0,0|3,0,0]=4 1448 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 34a_100000708995_200025704644 [1,0,0,0,0,0|3,0,0]=4 1449 B11R1.192 Cc1ccc(cc1Br)CO[13CH3] 7a_100000708995_200025704644 [1,0,0,0,0,0|3,0,0]=4 1450 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_100012232412_200025704644 [1,0,0,0,0,0|3,0,0]=4 1451 B11R1.192 Cc1ccc(cc1Br)CS[13CH3] 62a_200025704644_100012232412 [1,0,0,0,0,0|3,0,0]=4 1452 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [1,0,0,0,0,0|2,0,0]=3 1453 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [1,0,0,0,0,0|2,0,0]=3 1454 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [1,0,0,0,0,0|2,0,0]=3 1455 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [1,0,0,0,0,0|2,0,0]=3 1456 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [1,0,0,0,0,0|2,0,0]=3 1457 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [1,0,0,0,0,0|2,0,0]=3 1458 B11R1.192 Cc1ccc(cc1C)NCF 34a_100000724040_100015361967 [1,0,0,0,0,0|3,0,0]=4 1459 B11R1.192 Cc1ccc(cc1C)NCF 7a_100000724040_100015361967 [1,0,0,0,0,0|3,0,0]=4 1460 B11R1.192 Cc1ccc(cc1C)OCF 34a_100000210932_100015361967 [1,0,0,0,0,0|3,0,0]=4 1461 B11R1.192 Cc1ccc(cc1C)OCF 7a_100000210932_100015361967 [1,0,0,0,0,0|3,0,0]=4 1462 B11R1.192 Cc1ccc(cc1C)SCF 62a_100011215607_100015361967 [1,0,0,0,0,0|3,0,0]=4 1463 B11R1.192 Cc1ccc(cc1C)SCF 62a_100015361967_100011215607 [1,0,0,0,0,0|3,0,0]=4 1464 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 2230a_102495364989_200025704644 [1,0,0,0,0,0|3,0,0]=4 1465 B11R1.192 Cc1ccc(cc1Cl)CN[13CH3] 34a_102495364989_200025704644 [1,0,0,0,0,0|3,0,0]=4 1466 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 34a_100011290783_200025704644 [1,0,0,0,0,0|3,0,0]=4 1467 B11R1.192 Cc1ccc(cc1Cl)CO[13CH3] 7a_100011290783_200025704644 [1,0,0,0,0,0|3,0,0]=4 1468 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_100011823929_200025704644 [1,0,0,0,0,0|3,0,0]=4 1469 B11R1.192 Cc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100011823929 [1,0,0,0,0,0|3,0,0]=4 1470 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 2230a_100102708794_200025704644 [1,0,0,0,0,0|3,0,0]=4 1471 B11R1.192 Cc1ccc(cc1F)CN[13CH3] 34a_100102708794_200025704644 [1,0,0,0,0,0|3,0,0]=4 1472 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 34a_100000702247_200025704644 [1,0,0,0,0,0|3,0,0]=4 1473 B11R1.192 Cc1ccc(cc1F)CO[13CH3] 7a_100000702247_200025704644 [1,0,0,0,0,0|3,0,0]=4 1474 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_100011217369_200025704644 [1,0,0,0,0,0|3,0,0]=4 1475 B11R1.192 Cc1ccc(cc1F)CS[13CH3] 62a_200025704644_100011217369 [1,0,0,0,0,0|3,0,0]=4 1476 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 34a_100000050133_200025704644 [1,0,0,0,0,0|3,0,0]=4 1477 B11R1.192 Cc1ccc(cc1I)CO[13CH3] 7a_100000050133_200025704644 [1,0,0,0,0,0|3,0,0]=4 1478 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_100010206137_200025704644 [1,0,0,0,0,0|3,0,0]=4 1479 B11R1.192 Cc1ccc(cc1I)CS[13CH3] 62a_200025704644_100010206137 [1,0,0,0,0,0|3,0,0]=4 1480 B11R1.192 Cc1ccc(cc1N)CO[13CH3] 34a_100000758420_200025704644 [1,0,0,0,0,0|3,0,0]=4 1481 B11R1.192 Cc1ccc(cc1O)NCF 34a_100000759471_100015361967 [1,0,0,0,0,0|3,0,0]=4 1482 B11R1.192 Cc1ccc(cc1O)NCF 7a_100000759471_100015361967 [1,0,0,0,0,0|3,0,0]=4 1483 B11R1.192 Cc1ccc(cc1O)SCF 62a_100000685420_100015361967 [1,0,0,0,0,0|3,0,0]=4 1484 B11R1.192 Cc1ccc(cc1O)SCF 62a_100015361967_100000685420 [1,0,0,0,0,0|3,0,0]=4 1485 B11R1.192 Cc1ccc(nc1C)CN[13CH3] 2230a_202515432893_200025704644 [1,0,0,0,0,0|3,0,0]=4 1486 B11R1.192 Cc1ccc(nc1C)CN[13CH3] 34a_202515432893_200025704644 [1,0,0,0,0,0|3,0,0]=4 1487 B11R1.192 Cc1nc(ccc1Br)CO[13CH3] 34a_100010114280_200025704644 [1,0,0,0,0,0|3,0,0]=4 1488 B11R1.192 Cc1nc(ccc1F)CO[13CH3] 34a_200009884719_200025704644 [1,0,0,0,0,0|3,0,0]=4 1489 B11R1.192 Cc1nc(ccc1O)SCF 62a_100010233687_100015361967 [1,0,0,0,0,0|3,0,0]=4 1490 B11R1.192 Cc1nc(ccc1O)SCF 62a_100015361967_100010233687 [1,0,0,0,0,0|3,0,0]=4 1491 B11R1.192 N#CCc1ccc(c(c1)F)O 271570a_203496583355_100000691973 [1,0,0,0,0,0|2,0,1]=4 1492 B11R1.192 N#CCc1ccc(c(c1)O)F 271570a_203496583355_100000742998 [1,0,0,0,0,0|2,0,1]=4 1493 B11R1.192 N#CCc1ccc(c(c1)O)N 271570a_203496583355_100010188563 [1,0,0,0,0,0|2,0,1]=4 1494 B11R1.192 Nc1cc(ccc1O)SCF 62a_100000752626_100015361967 [1,0,0,0,0,0|3,0,0]=4 1495 B11R1.192 Nc1cc(ccc1O)SCF 62a_100015361967_100000752626 [1,0,0,0,0,0|3,0,0]=4 1496 B11R1.192 Nc1ccc(cc1O)SCF 62a_100000739049_100015361967 [1,0,0,0,0,0|3,0,0]=4 1497 B11R1.192 Nc1ccc(cc1O)SCF 62a_100015361967_100000739049 [1,0,0,0,0,0|3,0,0]=4 1498 B11R1.192 OCCc1ccc(c(c1)F)O 271570a_203496583355_100012921202 [1,0,0,0,0,0|2,0,0]=3 1499 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100012356990_100015361967 [1,0,0,0,0,0|3,0,0]=4 1500 B11R1.192 Oc1cc(ccc1Br)SCF 62a_100015361967_100012356990 [1,0,0,0,0,0|3,0,0]=4 1501 B11R1.192 Oc1cc(ccc1Cl)NCF 34a_100011934209_100015361967 [1,0,0,0,0,0|3,0,0]=4 1502 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100011356854_100015361967 [1,0,0,0,0,0|3,0,0]=4 1503 B11R1.192 Oc1cc(ccc1Cl)SCF 62a_100015361967_100011356854 [1,0,0,0,0,0|3,0,0]=4 1504 B11R1.192 Oc1cc(ccc1F)NCF 34a_100012017398_100015361967 [1,0,0,0,0,0|3,0,0]=4 1505 B11R1.192 Oc1cc(ccc1F)NCF 7a_100012017398_100015361967 [1,0,0,0,0,0|3,0,0]=4 1506 B11R1.192 Oc1cc(ccc1F)SCF 62a_100000686035_100015361967 [1,0,0,0,0,0|3,0,0]=4 1507 B11R1.192 Oc1cc(ccc1F)SCF 62a_100015361967_100000686035 [1,0,0,0,0,0|3,0,0]=4 1508 B11R1.192 Oc1ccc(cc1Br)NCF 34a_100011534360_100015361967 [1,0,0,0,0,0|3,0,0]=4 1509 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100012361655_100015361967 [1,0,0,0,0,0|3,0,0]=4 1510 B11R1.192 Oc1ccc(cc1Br)SCF 62a_100015361967_100012361655 [1,0,0,0,0,0|3,0,0]=4 1511 B11R1.192 Oc1ccc(cc1Cl)NCF 34a_100000744943_100015361967 [1,0,0,0,0,0|3,0,0]=4 1512 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100012360047_100015361967 [1,0,0,0,0,0|3,0,0]=4 1513 B11R1.192 Oc1ccc(cc1Cl)SCF 62a_100015361967_100012360047 [1,0,0,0,0,0|3,0,0]=4 1514 B11R1.192 Oc1ccc(cc1F)NCF 34a_100011220035_100015361967 [1,0,0,0,0,0|3,0,0]=4 1515 B11R1.192 Oc1ccc(cc1F)NCF 7a_100011220035_100015361967 [1,0,0,0,0,0|3,0,0]=4 1516 B11R1.192 Oc1ccc(cc1F)SCF 62a_100000185481_100015361967 [1,0,0,0,0,0|3,0,0]=4 1517 B11R1.192 Oc1ccc(cc1F)SCF 62a_100015361967_100000185481 [1,0,0,0,0,0|3,0,0]=4 1518 B11R1.192 Oc1ccc(cc1O)NCF 34a_100102946323_100015361967 [1,0,0,0,0,0|2,0,0]=3 1519 B11R1.192 Oc1ccc(cc1O)SCF 62a_100015361967_100009813601 [1,0,0,0,0,0|2,0,0]=3 1520 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 2230a_100012351559_200025704644 [1,0,0,0,0,0|3,0,0]=4 1521 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Br 34a_100012351559_200025704644 [1,0,0,0,0,0|3,0,0]=4 1522 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 2230a_100012349490_200025704644 [1,0,0,0,0,0|3,0,0]=4 1523 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)Cl 34a_100012349490_200025704644 [1,0,0,0,0,0|3,0,0]=4 1524 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 2230a_100015193890_200025704644 [1,0,0,0,0,0|3,0,0]=4 1525 B11R1.192 [13CH3]NCc1ccc(c(c1)Br)F 34a_100015193890_200025704644 [1,0,0,0,0,0|3,0,0]=4 1526 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 2230a_100012362553_200025704644 [1,0,0,0,0,0|3,0,0]=4 1527 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Br 34a_100012362553_200025704644 [1,0,0,0,0,0|3,0,0]=4 1528 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 2230a_100000174881_200025704644 [1,0,0,0,0,0|3,0,0]=4 1529 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)Cl 34a_100000174881_200025704644 [1,0,0,0,0,0|3,0,0]=4 1530 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 2230a_100000749334_200025704644 [1,0,0,0,0,0|3,0,0]=4 1531 B11R1.192 [13CH3]NCc1ccc(c(c1)Cl)F 34a_100000749334_200025704644 [1,0,0,0,0,0|3,0,0]=4 1532 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 2230a_100000755036_200025704644 [1,0,0,0,0,0|3,0,0]=4 1533 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Br 34a_100000755036_200025704644 [1,0,0,0,0,0|3,0,0]=4 1534 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 2230a_100011219866_200025704644 [1,0,0,0,0,0|3,0,0]=4 1535 B11R1.192 [13CH3]NCc1ccc(c(c1)F)Cl 34a_100011219866_200025704644 [1,0,0,0,0,0|3,0,0]=4 1536 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 2230a_100000737897_200025704644 [1,0,0,0,0,0|3,0,0]=4 1537 B11R1.192 [13CH3]NCc1ccc(c(c1)F)F 34a_100000737897_200025704644 [1,0,0,0,0,0|3,0,0]=4 1538 B11R1.192 [13CH3]NCc1ccc(c(c1)F)O 34a_100000758358_200025704644 [1,0,0,0,0,0|2,0,0]=3 1539 B11R1.192 [13CH3]NCc1ccc(c(c1)O)Cl 34a_100020636435_200025704644 [1,0,0,0,0,0|2,0,0]=3 1540 B11R1.192 [13CH3]NCc1ccc(c(c1)O)F 34a_100160469508_200025704644 [1,0,0,0,0,0|2,0,0]=3 1541 B11R1.192 [13CH3]NCc1ccc(c(c1)O)O 34a_100000010075_200025704644 [1,0,0,0,0,0|1,0,0]=2 1542 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 34a_100012353893_200025704644 [1,0,0,0,0,0|3,0,0]=4 1543 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)Cl 7a_100012353893_200025704644 [1,0,0,0,0,0|3,0,0]=4 1544 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 34a_100000246287_200025704644 [1,0,0,0,0,0|3,0,0]=4 1545 B11R1.192 [13CH3]OCc1ccc(c(c1)Br)F 7a_100000246287_200025704644 [1,0,0,0,0,0|3,0,0]=4 1546 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 34a_100000709168_200025704644 [1,0,0,0,0,0|3,0,0]=4 1547 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Br 7a_100000709168_200025704644 [1,0,0,0,0,0|3,0,0]=4 1548 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 34a_100000211588_200025704644 [1,0,0,0,0,0|3,0,0]=4 1549 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)Cl 7a_100000211588_200025704644 [1,0,0,0,0,0|3,0,0]=4 1550 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 34a_100011217911_200025704644 [1,0,0,0,0,0|3,0,0]=4 1551 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)F 7a_100011217911_200025704644 [1,0,0,0,0,0|3,0,0]=4 1552 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 34a_100000718186_200025704644 [1,0,0,0,0,0|3,0,0]=4 1553 B11R1.192 [13CH3]OCc1ccc(c(c1)Cl)I 7a_100000718186_200025704644 [1,0,0,0,0,0|3,0,0]=4 1554 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 34a_100011533735_200025704644 [1,0,0,0,0,0|3,0,0]=4 1555 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Br 7a_100011533735_200025704644 [1,0,0,0,0,0|3,0,0]=4 1556 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 34a_100011218299_200025704644 [1,0,0,0,0,0|3,0,0]=4 1557 B11R1.192 [13CH3]OCc1ccc(c(c1)F)Cl 7a_100011218299_200025704644 [1,0,0,0,0,0|3,0,0]=4 1558 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 34a_100011215442_200025704644 [1,0,0,0,0,0|3,0,0]=4 1559 B11R1.192 [13CH3]OCc1ccc(c(c1)F)F 7a_100011215442_200025704644 [1,0,0,0,0,0|3,0,0]=4 1560 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 34a_100010149597_200025704644 [1,0,0,0,0,0|3,0,0]=4 1561 B11R1.192 [13CH3]OCc1ccc(c(c1)F)I 7a_100010149597_200025704644 [1,0,0,0,0,0|3,0,0]=4 1562 B11R1.192 [13CH3]OCc1ccc(c(c1)F)N 34a_100011217239_200025704644 [1,0,0,0,0,0|3,0,0]=4 1563 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 34a_100000049585_200025704644 [1,0,0,0,0,0|3,0,0]=4 1564 B11R1.192 [13CH3]OCc1ccc(c(c1)I)F 7a_100000049585_200025704644 [1,0,0,0,0,0|3,0,0]=4 1565 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Br 34a_100012347568_200025704644 [1,0,0,0,0,0|3,0,0]=4 1566 B11R1.192 [13CH3]OCc1ccc(c(c1)N)Cl 34a_106256033963_200025704644 [1,0,0,0,0,0|3,0,0]=4 1567 B11R1.192 [13CH3]OCc1ccc(c(c1)N)F 34a_102125399562_200025704644 [1,0,0,0,0,0|3,0,0]=4 1568 B11R1.192 [13CH3]SCc1cc(=O)c(co1)O 62a_200025704644_100000010605 [1,0,0,0,0,0|2,0,1]=4 1569 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_100012353900_200025704644 [1,0,0,0,0,0|3,0,0]=4 1570 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Br 62a_200025704644_100012353900 [1,0,0,0,0,0|3,0,0]=4 1571 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_100012353894_200025704644 [1,0,0,0,0,0|3,0,0]=4 1572 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)Cl 62a_200025704644_100012353894 [1,0,0,0,0,0|3,0,0]=4 1573 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_100011206884_200025704644 [1,0,0,0,0,0|3,0,0]=4 1574 B11R1.192 [13CH3]SCc1ccc(c(c1)Br)F 62a_200025704644_100011206884 [1,0,0,0,0,0|3,0,0]=4 1575 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_100012353895_200025704644 [1,0,0,0,0,0|3,0,0]=4 1576 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Br 62a_200025704644_100012353895 [1,0,0,0,0,0|3,0,0]=4 1577 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_100000184707_200025704644 [1,0,0,0,0,0|3,0,0]=4 1578 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)Cl 62a_200025704644_100000184707 [1,0,0,0,0,0|3,0,0]=4 1579 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_100000717365_200025704644 [1,0,0,0,0,0|3,0,0]=4 1580 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)F 62a_200025704644_100011934319 [1,0,0,0,0,0|3,0,0]=4 1581 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_100012349665_200025704644 [1,0,0,0,0,0|3,0,0]=4 1582 B11R1.192 [13CH3]SCc1ccc(c(c1)Cl)I 62a_200025704644_100012349665 [1,0,0,0,0,0|3,0,0]=4 1583 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_100000767054_200025704644 [1,0,0,0,0,0|3,0,0]=4 1584 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Br 62a_200025704644_100000767054 [1,0,0,0,0,0|3,0,0]=4 1585 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_100000716492_200025704644 [1,0,0,0,0,0|3,0,0]=4 1586 B11R1.192 [13CH3]SCc1ccc(c(c1)F)Cl 62a_200025704644_100000716492 [1,0,0,0,0,0|3,0,0]=4 1587 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_100000757363_200025704644 [1,0,0,0,0,0|3,0,0]=4 1588 B11R1.192 [13CH3]SCc1ccc(c(c1)F)F 62a_200025704644_100000757363 [1,0,0,0,0,0|3,0,0]=4 1589 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_100010149604_200025704644 [1,0,0,0,0,0|3,0,0]=4 1590 B11R1.192 [13CH3]SCc1ccc(c(c1)F)I 62a_200025704644_100010149604 [1,0,0,0,0,0|3,0,0]=4 1591 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_100010146616_200025704644 [1,0,0,0,0,0|3,0,0]=4 1592 B11R1.192 [13CH3]SCc1ccc(c(c1)I)Br 62a_200025704644_100010146616 [1,0,0,0,0,0|3,0,0]=4 1593 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_100010188208_200025704644 [1,0,0,0,0,0|3,0,0]=4 1594 B11R1.192 [13CH3]SCc1ccc(c(c1)I)F 62a_200025704644_100010188208 [1,0,0,0,0,0|3,0,0]=4 1595 B11R1.280 C=Cc1cc(ccc1F)CC 271570a_100011290941_200010244628 [1,0,0,0,0,0|2,0,1]=4 1596 B11R1.280 C=Cc1cc(ccc1N)CC 271570a_100011290941_100012339725 [1,0,0,0,0,0|2,0,1]=4 1597 B11R1.280 C=Cc1cc(ccc1O)CC 271570a_100011290941_100012339963 [1,0,0,0,0,0|1,0,1]=3 1598 B11R1.280 C=Cc1cc(ccc1O)CO 271570a_100011290941_100011191544 [1,0,0,0,0,0|2,0,1]=4 1599 B11R1.280 C=Cc1cc(ccc1O)OC 271570a_100011290941_100000685887 [1,0,0,0,0,0|2,0,1]=4 1600 B11R1.280 C=Cc1ccc(c(c1)CC)O 271570a_100011290941_100012338938 [1,0,0,0,0,0|1,0,2]=4 1601 B11R1.280 C=Cc1ccc(c(c1)OC)Br 271570a_100011290941_100012353699 [1,0,0,0,0,0|1,0,2]=4 1602 B11R1.280 C=Cc1ccc(c(c1)OC)C 271570a_100011290941_100011830276 [1,0,0,0,0,0|1,0,2]=4 1603 B11R1.280 C=Cc1ccc(c(c1)OC)Cl 271570a_100011290941_100011356853 [1,0,0,0,0,0|1,0,2]=4 1604 B11R1.280 C=Cc1ccc(c(c1)OC)F 271570a_100011290941_100011934186 [1,0,0,0,0,0|1,0,2]=4 1605 B11R1.280 C=Cc1ccc(c(c1)OC)N 271570a_100011290941_100011279103 [1,0,0,0,0,0|1,0,2]=4 1606 B11R1.280 C=Cc1ccc(c(c1)OC)O 271570a_100011290941_100000694246 [1,0,0,0,0,0|0,0,2]=3 1607 B11R1.280 C=Cc1ccc(c(n1)OC)O 271570a_100011290941_100010893133 [1,0,0,0,0,0|1,0,2]=4 1608 B11R1.280 CCc1cc(ccc1Br)NC 2230a_100010109747_200000210301 [1,0,0,0,0,0|3,0,0]=4 1609 B11R1.280 CCc1cc(ccc1Br)NC 34a_100010109747_200000210301 [1,0,0,0,0,0|3,0,0]=4 1610 B11R1.280 CCc1cc(ccc1Br)NC 7a_100010109747_200000210301 [1,0,0,0,0,0|3,0,0]=4 1611 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 2230a_100010109747_200025704644 [1,0,0,0,0,0|3,0,0]=4 1612 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 34a_100010109747_200025704644 [1,0,0,0,0,0|3,0,0]=4 1613 B11R1.280 CCc1cc(ccc1Br)N[13CH3] 7a_100010109747_200025704644 [1,0,0,0,0,0|3,0,0]=4 1614 B11R1.280 CCc1cc(ccc1Br)SC 62a_100010244631_200000210301 [1,0,0,0,0,0|3,0,0]=4 1615 B11R1.280 CCc1cc(ccc1Br)SC 62a_200000210301_100010244631 [1,0,0,0,0,0|3,0,0]=4 1616 B11R1.280 CCc1cc(ccc1Br)S[13CH3] 62a_100010244631_200025704644 [1,0,0,0,0,0|3,0,0]=4 1617 B11R1.280 CCc1cc(ccc1Br)S[13CH3] 62a_200025704644_100010244631 [1,0,0,0,0,0|3,0,0]=4 1618 B11R1.280 CCc1cc(ccc1Cl)OC 34a_100000212063_200000210301 [1,0,0,0,0,0|3,0,0]=4 1619 B11R1.280 CCc1cc(ccc1Cl)OC 7a_100000212063_200000210301 [1,0,0,0,0,0|3,0,0]=4 1620 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 34a_100000212063_200025704644 [1,0,0,0,0,0|3,0,0]=4 1621 B11R1.280 CCc1cc(ccc1Cl)O[13CH3] 7a_100000212063_200025704644 [1,0,0,0,0,0|3,0,0]=4 1622 B11R1.280 CCc1cc(ccc1F)SC 62a_100010244625_200000210301 [1,0,0,0,0,0|3,0,0]=4 1623 B11R1.280 CCc1cc(ccc1F)SC 62a_200000210301_100010244625 [1,0,0,0,0,0|3,0,0]=4 1624 B11R1.280 CCc1cc(ccc1F)S[13CH3] 62a_100010244625_200025704644 [1,0,0,0,0,0|3,0,0]=4 1625 B11R1.280 CCc1cc(ccc1F)S[13CH3] 62a_200025704644_100010244625 [1,0,0,0,0,0|3,0,0]=4 1626 B11R1.280 CCc1cc(ccc1N)SC 62a_100000686106_200000210301 [1,0,0,0,0,0|3,0,0]=4 1627 B11R1.280 CCc1cc(ccc1N)SC 62a_200000210301_100000686106 [1,0,0,0,0,0|3,0,0]=4 1628 B11R1.280 CCc1cc(ccc1N)S[13CH3] 62a_100000686106_200025704644 [1,0,0,0,0,0|3,0,0]=4 1629 B11R1.280 CCc1cc(ccc1N)S[13CH3] 62a_200025704644_100000686106 [1,0,0,0,0,0|3,0,0]=4 1630 B11R1.280 CCc1cc(ccc1O)C#N 271570a_203496583355_100010115944 [1,0,0,0,0,0|2,0,1]=4 1631 B11R1.280 CCc1cc(ccc1O)OC 271570a_203496583355_100000720562 [1,0,0,0,0,0|2,0,0]=3 1632 B11R1.280 CCc1cc(ccc1O)SC 62a_200000210301_100012338938 [1,0,0,0,0,0|2,0,0]=3 1633 B11R1.280 CCc1cc(ccc1O)S[13CH3] 62a_200025704644_100012338938 [1,0,0,0,0,0|2,0,0]=3 1634 B11R1.280 CCc1ccc(c(c1)NC)C 2230a_200012022522_200000210301 [1,0,0,0,0,0|2,0,0]=3 1635 B11R1.280 CCc1ccc(c(c1)NC)C 34a_200012022522_200000210301 [1,0,0,0,0,0|2,0,0]=3 1636 B11R1.280 CCc1ccc(c(c1)NC)C 7a_200012022522_200000210301 [1,0,0,0,0,0|2,0,0]=3 1637 B11R1.280 CCc1ccc(c(c1)NC)O 34a_100000765835_200000210301 [1,0,0,0,0,0|1,0,0]=2 1638 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 2230a_200012022522_200025704644 [1,0,0,0,0,0|2,0,0]=3 1639 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 34a_200012022522_200025704644 [1,0,0,0,0,0|2,0,0]=3 1640 B11R1.280 CCc1ccc(c(c1)N[13CH3])C 7a_200012022522_200025704644 [1,0,0,0,0,0|2,0,0]=3 1641 B11R1.280 CCc1ccc(c(c1)N[13CH3])O 34a_100000765835_200025704644 [1,0,0,0,0,0|1,0,0]=2 1642 B11R1.280 CCc1ccc(c(c1)OC)N 34a_100000124328_200000210301 [1,0,0,0,0,0|1,0,0]=2 1643 B11R1.280 CCc1ccc(c(c1)OC)N 7a_100000124328_200000210301 [1,0,0,0,0,0|1,0,0]=2 1644 B11R1.280 CCc1ccc(c(c1)OC)O 271570a_203496583355_200010710389 [1,0,0,0,0,0|0,0,0]=1 1645 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 34a_100000124328_200025704644 [1,0,0,0,0,0|1,0,0]=2 1646 B11R1.280 CCc1ccc(c(c1)O[13CH3])N 7a_100000124328_200025704644 [1,0,0,0,0,0|1,0,0]=2 1647 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200000210301_200010244628 [1,0,0,0,0,0|1,1,0]=3 1648 B11R1.280 CCc1ccc(c(c1)SC)F 62a_200010244628_200000210301 [1,0,0,0,0,0|1,1,0]=3 1649 B11R1.280 CCc1ccc(c(c1)SC)N 62a_100012339725_200000210301 [1,0,0,0,0,0|1,1,0]=3 1650 B11R1.280 CCc1ccc(c(c1)SC)N 62a_200000210301_100012339725 [1,0,0,0,0,0|1,1,0]=3 1651 B11R1.280 CCc1ccc(c(c1)SC)O 62a_100012339963_200000210301 [1,0,0,0,0,0|0,1,0]=2 1652 B11R1.280 CCc1ccc(c(c1)SC)O 62a_200000210301_100012339963 [1,0,0,0,0,0|0,1,0]=2 1653 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200010244628_200025704644 [1,0,0,0,0,0|1,1,0]=3 1654 B11R1.280 CCc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010244628 [1,0,0,0,0,0|1,1,0]=3 1655 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_100012339725_200025704644 [1,0,0,0,0,0|1,1,0]=3 1656 B11R1.280 CCc1ccc(c(c1)S[13CH3])N 62a_200025704644_100012339725 [1,0,0,0,0,0|1,1,0]=3 1657 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_100012339963_200025704644 [1,0,0,0,0,0|0,1,0]=2 1658 B11R1.280 CCc1ccc(c(c1)S[13CH3])O 62a_200025704644_100012339963 [1,0,0,0,0,0|0,1,0]=2 1659 B11R1.280 CNc1cc(ccc1Br)CO 34a_100012347568_200000210301 [1,0,0,0,0,0|3,0,0]=4 1660 B11R1.280 CNc1cc(ccc1Br)OC 34a_100000748603_200000210301 [1,0,0,0,0,0|3,0,0]=4 1661 B11R1.280 CNc1cc(ccc1C)CO 2230a_100000758420_200000210301 [1,0,0,0,0,0|3,0,0]=4 1662 B11R1.280 CNc1cc(ccc1C)CO 34a_100000758420_200000210301 [1,0,0,0,0,0|3,0,0]=4 1663 B11R1.280 CNc1cc(ccc1C)OC 2230a_100000760359_200000210301 [1,0,0,0,0,0|3,0,0]=4 1664 B11R1.280 CNc1cc(ccc1C)OC 34a_100000760359_200000210301 [1,0,0,0,0,0|3,0,0]=4 1665 B11R1.280 CNc1cc(ccc1C)SC 62a_100020629602_200000210301 [1,0,0,0,0,0|3,0,0]=4 1666 B11R1.280 CNc1cc(ccc1C)SC 62a_200000210301_100020629602 [1,0,0,0,0,0|3,0,0]=4 1667 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_100020629602_200025704644 [1,0,0,0,0,0|3,0,0]=4 1668 B11R1.280 CNc1cc(ccc1C)S[13CH3] 62a_200025704644_100020629602 [1,0,0,0,0,0|3,0,0]=4 1669 B11R1.280 CNc1cc(ccc1Cl)CO 34a_106256033963_200000210301 [1,0,0,0,0,0|3,0,0]=4 1670 B11R1.280 CNc1cc(ccc1Cl)OC 34a_100000745576_200000210301 [1,0,0,0,0,0|3,0,0]=4 1671 B11R1.280 CNc1cc(ccc1F)CO 2230a_102125399562_200000210301 [1,0,0,0,0,0|3,0,0]=4 1672 B11R1.280 CNc1cc(ccc1F)CO 34a_102125399562_200000210301 [1,0,0,0,0,0|3,0,0]=4 1673 B11R1.280 CNc1cc(ccc1F)OC 34a_100000764331_200000210301 [1,0,0,0,0,0|3,0,0]=4 1674 B11R1.280 CNc1cc(ccc1F)SC 62a_100011314990_200000210301 [1,0,0,0,0,0|3,0,0]=4 1675 B11R1.280 CNc1cc(ccc1F)SC 62a_200000210301_100011314990 [1,0,0,0,0,0|3,0,0]=4 1676 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_100011314990_200025704644 [1,0,0,0,0,0|3,0,0]=4 1677 B11R1.280 CNc1cc(ccc1F)S[13CH3] 62a_200025704644_100011314990 [1,0,0,0,0,0|3,0,0]=4 1678 B11R1.280 CNc1cc(ccc1I)OC 34a_100000748021_200000210301 [1,0,0,0,0,0|3,0,0]=4 1679 B11R1.280 CNc1cc(ccc1N)SC 62a_100000694363_200000210301 [1,0,0,0,0,0|3,0,0]=4 1680 B11R1.280 CNc1cc(ccc1N)S[13CH3] 62a_100000694363_200025704644 [1,0,0,0,0,0|3,0,0]=4 1681 B11R1.280 CNc1cc(ccc1O)C#N 34a_100000766272_200000210301 [1,0,0,0,0,0|2,0,1]=4 1682 B11R1.280 CNc1cc(ccc1O)C#N 7a_100000766272_200000210301 [1,0,0,0,0,0|2,0,1]=4 1683 B11R1.280 CNc1cc(ccc1O)CO 34a_100000123545_200000210301 [1,0,0,0,0,0|2,0,0]=3 1684 B11R1.280 CNc1cc(ccc1O)OC 34a_100000188146_200000210301 [1,0,0,0,0,0|2,0,0]=3 1685 B11R1.280 CNc1ccc(c(c1)C#N)O 34a_100011249283_200000210301 [1,0,0,0,0,0|3,0,0]=4 1686 B11R1.280 CNc1ccc(c(c1)OC)Br 2230a_100000765947_200000210301 [1,0,0,0,0,0|2,0,0]=3 1687 B11R1.280 CNc1ccc(c(c1)OC)Br 34a_100000765947_200000210301 [1,0,0,0,0,0|2,0,0]=3 1688 B11R1.280 CNc1ccc(c(c1)OC)C 2230a_100011279678_200000210301 [1,0,0,0,0,0|2,0,0]=3 1689 B11R1.280 CNc1ccc(c(c1)OC)C 34a_100011279678_200000210301 [1,0,0,0,0,0|2,0,0]=3 1690 B11R1.280 CNc1ccc(c(c1)OC)Cl 2230a_100000742311_200000210301 [1,0,0,0,0,0|2,0,0]=3 1691 B11R1.280 CNc1ccc(c(c1)OC)Cl 34a_100000742311_200000210301 [1,0,0,0,0,0|2,0,0]=3 1692 B11R1.280 CNc1ccc(c(c1)OC)F 2230a_100000701188_200000210301 [1,0,0,0,0,0|2,0,0]=3 1693 B11R1.280 CNc1ccc(c(c1)OC)F 34a_100000701188_200000210301 [1,0,0,0,0,0|2,0,0]=3 1694 B11R1.280 CNc1ccc(c(c1)OC)I 34a_100000746945_200000210301 [1,0,0,0,0,0|2,0,0]=3 1695 B11R1.280 CNc1ccc(c(c1)OC)O 34a_100000726020_200000210301 [1,0,0,0,0,0|1,0,0]=2 1696 B11R1.280 CNc1ccc(c(c1)SC)C 62a_100000707694_200000210301 [1,0,0,0,0,0|2,1,0]=4 1697 B11R1.280 CNc1ccc(c(c1)SC)C 62a_200000210301_100000707694 [1,0,0,0,0,0|2,1,0]=4 1698 B11R1.280 CNc1ccc(c(c1)S[13CH3])C 62a_100000707694_200025704644 [1,0,0,0,0,0|2,1,0]=4 1699 B11R1.280 CNc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000707694 [1,0,0,0,0,0|2,1,0]=4 1700 B11R1.280 COc1cc(c(cn1)Br)OC 34a_100010738159_200000210301 [1,0,0,0,0,0|3,0,0]=4 1701 B11R1.280 COc1cc(c(cn1)Br)O[13CH3] 34a_100010738159_200025704644 [1,0,0,0,0,0|3,0,0]=4 1702 B11R1.280 COc1cc(c(cn1)O)OC 271570a_203496583355_100010191559 [1,0,0,0,0,0|2,0,0]=3 1703 B11R1.280 COc1cc(c[nH]c1=O)SC 62a_200000210301_100010125397 [1,0,0,0,0,0|2,0,1]=4 1704 B11R1.280 COc1cc(c[nH]c1=O)S[13CH3] 62a_200025704644_100010125397 [1,0,0,0,0,0|2,0,1]=4 1705 B11R1.280 COc1cc(ccc1Br)C#N 34a_100009877741_200000210301 [1,0,0,0,0,0|2,0,1]=4 1706 B11R1.280 COc1cc(ccc1Br)C#N 7a_100009877741_200000210301 [1,0,0,0,0,0|2,0,1]=4 1707 B11R1.280 COc1cc(ccc1Br)CO 34a_100010191536_200000210301 [1,0,0,0,0,0|2,0,0]=3 1708 B11R1.280 COc1cc(ccc1Br)CO 7a_100010191536_200000210301 [1,0,0,0,0,0|2,0,0]=3 1709 B11R1.280 COc1cc(ccc1Br)N[13CH3] 2230a_100000765947_200025704644 [1,0,0,0,0,0|2,0,0]=3 1710 B11R1.280 COc1cc(ccc1Br)N[13CH3] 34a_100000765947_200025704644 [1,0,0,0,0,0|2,0,0]=3 1711 B11R1.280 COc1cc(ccc1Br)O[13CH3] 34a_100011827694_200025704644 [1,0,0,0,0,0|2,0,0]=3 1712 B11R1.280 COc1cc(ccc1Br)O[13CH3] 7a_100011827694_200025704644 [1,0,0,0,0,0|2,0,0]=3 1713 B11R1.280 COc1cc(ccc1Br)SC 62a_100012353699_200000210301 [1,0,0,0,0,0|2,0,0]=3 1714 B11R1.280 COc1cc(ccc1Br)SC 62a_200000210301_100012353699 [1,0,0,0,0,0|2,0,0]=3 1715 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_100012353699_200025704644 [1,0,0,0,0,0|2,0,0]=3 1716 B11R1.280 COc1cc(ccc1Br)S[13CH3] 62a_200025704644_100012353699 [1,0,0,0,0,0|2,0,0]=3 1717 B11R1.280 COc1cc(ccc1C)C#N 34a_100000765541_200000210301 [1,0,0,0,0,0|2,0,1]=4 1718 B11R1.280 COc1cc(ccc1C)C#N 7a_100000765541_200000210301 [1,0,0,0,0,0|2,0,1]=4 1719 B11R1.280 COc1cc(ccc1C)N[13CH3] 2230a_100011279678_200025704644 [1,0,0,0,0,0|2,0,0]=3 1720 B11R1.280 COc1cc(ccc1C)N[13CH3] 34a_100011279678_200025704644 [1,0,0,0,0,0|2,0,0]=3 1721 B11R1.280 COc1cc(ccc1C)O[13CH3] 34a_100009865632_200025704644 [1,0,0,0,0,0|2,0,0]=3 1722 B11R1.280 COc1cc(ccc1C)O[13CH3] 7a_100009865632_200025704644 [1,0,0,0,0,0|2,0,0]=3 1723 B11R1.280 COc1cc(ccc1C)SC 62a_100011830276_200000210301 [1,0,0,0,0,0|2,0,0]=3 1724 B11R1.280 COc1cc(ccc1C)SC 62a_200000210301_100011830276 [1,0,0,0,0,0|2,0,0]=3 1725 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_100011830276_200025704644 [1,0,0,0,0,0|2,0,0]=3 1726 B11R1.280 COc1cc(ccc1C)S[13CH3] 62a_200025704644_100011830276 [1,0,0,0,0,0|2,0,0]=3 1727 B11R1.280 COc1cc(ccc1Cl)C#N 34a_100012186312_200000210301 [1,0,0,0,0,0|2,0,1]=4 1728 B11R1.280 COc1cc(ccc1Cl)C#N 7a_100012186312_200000210301 [1,0,0,0,0,0|2,0,1]=4 1729 B11R1.280 COc1cc(ccc1Cl)CN 34a_100020636435_200000210301 [1,0,0,0,0,0|2,0,0]=3 1730 B11R1.280 COc1cc(ccc1Cl)CO 34a_100009876509_200000210301 [1,0,0,0,0,0|2,0,0]=3 1731 B11R1.280 COc1cc(ccc1Cl)CO 7a_100009876509_200000210301 [1,0,0,0,0,0|2,0,0]=3 1732 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 2230a_100000742311_200025704644 [1,0,0,0,0,0|2,0,0]=3 1733 B11R1.280 COc1cc(ccc1Cl)N[13CH3] 34a_100000742311_200025704644 [1,0,0,0,0,0|2,0,0]=3 1734 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 34a_100012186310_200025704644 [1,0,0,0,0,0|2,0,0]=3 1735 B11R1.280 COc1cc(ccc1Cl)O[13CH3] 7a_100012186310_200025704644 [1,0,0,0,0,0|2,0,0]=3 1736 B11R1.280 COc1cc(ccc1Cl)SC 62a_100011356853_200000210301 [1,0,0,0,0,0|2,0,0]=3 1737 B11R1.280 COc1cc(ccc1Cl)SC 62a_200000210301_100011356853 [1,0,0,0,0,0|2,0,0]=3 1738 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_100011356853_200025704644 [1,0,0,0,0,0|2,0,0]=3 1739 B11R1.280 COc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100011356853 [1,0,0,0,0,0|2,0,0]=3 1740 B11R1.280 COc1cc(ccc1F)C#N 34a_100000069402_200000210301 [1,0,0,0,0,0|2,0,1]=4 1741 B11R1.280 COc1cc(ccc1F)C#N 7a_100000069402_200000210301 [1,0,0,0,0,0|2,0,1]=4 1742 B11R1.280 COc1cc(ccc1F)CN 34a_100160469508_200000210301 [1,0,0,0,0,0|2,0,0]=3 1743 B11R1.280 COc1cc(ccc1F)CO 34a_100009842347_200000210301 [1,0,0,0,0,0|2,0,0]=3 1744 B11R1.280 COc1cc(ccc1F)CO 7a_100009842347_200000210301 [1,0,0,0,0,0|2,0,0]=3 1745 B11R1.280 COc1cc(ccc1F)N[13CH3] 2230a_100000701188_200025704644 [1,0,0,0,0,0|2,0,0]=3 1746 B11R1.280 COc1cc(ccc1F)N[13CH3] 34a_100000701188_200025704644 [1,0,0,0,0,0|2,0,0]=3 1747 B11R1.280 COc1cc(ccc1F)O[13CH3] 34a_100012001760_200025704644 [1,0,0,0,0,0|2,0,0]=3 1748 B11R1.280 COc1cc(ccc1F)O[13CH3] 7a_100012001760_200025704644 [1,0,0,0,0,0|2,0,0]=3 1749 B11R1.280 COc1cc(ccc1F)SC 62a_100011934186_200000210301 [1,0,0,0,0,0|2,0,0]=3 1750 B11R1.280 COc1cc(ccc1F)SC 62a_200000210301_100011934186 [1,0,0,0,0,0|2,0,0]=3 1751 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_100011934186_200025704644 [1,0,0,0,0,0|2,0,0]=3 1752 B11R1.280 COc1cc(ccc1F)S[13CH3] 62a_200025704644_100011934186 [1,0,0,0,0,0|2,0,0]=3 1753 B11R1.280 COc1cc(ccc1I)C#N 34a_100000724445_200000210301 [1,0,0,0,0,0|2,0,1]=4 1754 B11R1.280 COc1cc(ccc1I)C#N 7a_100000724445_200000210301 [1,0,0,0,0,0|2,0,1]=4 1755 B11R1.280 COc1cc(ccc1I)CO 34a_100000049605_200000210301 [1,0,0,0,0,0|2,0,0]=3 1756 B11R1.280 COc1cc(ccc1I)CO 7a_100000049605_200000210301 [1,0,0,0,0,0|2,0,0]=3 1757 B11R1.280 COc1cc(ccc1I)N[13CH3] 34a_100000746945_200025704644 [1,0,0,0,0,0|2,0,0]=3 1758 B11R1.280 COc1cc(ccc1N)C#N 34a_100011997735_200000210301 [1,0,0,0,0,0|2,0,1]=4 1759 B11R1.280 COc1cc(ccc1N)C#N 7a_100011997735_200000210301 [1,0,0,0,0,0|2,0,1]=4 1760 B11R1.280 COc1cc(ccc1N)O[13CH3] 34a_100015326901_200025704644 [1,0,0,0,0,0|2,0,0]=3 1761 B11R1.280 COc1cc(ccc1N)O[13CH3] 7a_100015326901_200025704644 [1,0,0,0,0,0|2,0,0]=3 1762 B11R1.280 COc1cc(ccc1N)SC 62a_100011279103_200000210301 [1,0,0,0,0,0|2,0,0]=3 1763 B11R1.280 COc1cc(ccc1N)SC 62a_200000210301_100015196925 [1,0,0,0,0,0|2,0,0]=3 1764 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_100011279103_200025704644 [1,0,0,0,0,0|2,0,0]=3 1765 B11R1.280 COc1cc(ccc1N)S[13CH3] 62a_200025704644_100015196925 [1,0,0,0,0,0|2,0,0]=3 1766 B11R1.280 COc1cc(ccc1O)C#N 271570a_203496583355_100012356288 [1,0,0,0,0,0|1,0,1]=3 1767 B11R1.280 COc1cc(ccc1O)C=O 271570a_203496583355_100010244714 [1,0,0,0,0,0|1,0,1]=3 1768 B11R1.280 COc1cc(ccc1O)CO 271570a_203496583355_100010234685 [1,0,0,0,0,0|1,0,0]=2 1769 B11R1.280 COc1cc(ccc1O)N[13CH3] 34a_100000726020_200025704644 [1,0,0,0,0,0|1,0,0]=2 1770 B11R1.280 COc1cc(ccc1O)SC 62a_200000210301_100000694246 [1,0,0,0,0,0|1,0,0]=2 1771 B11R1.280 COc1cc(ccc1O)S[13CH3] 62a_200025704644_100000694246 [1,0,0,0,0,0|1,0,0]=2 1772 B11R1.280 COc1cc(cnc1C)SC 62a_100010254219_200000210301 [1,0,0,0,0,0|3,0,0]=4 1773 B11R1.280 COc1cc(cnc1C)SC 62a_200000210301_100010254219 [1,0,0,0,0,0|3,0,0]=4 1774 B11R1.280 COc1cc(cnc1C)S[13CH3] 62a_100010254219_200025704644 [1,0,0,0,0,0|3,0,0]=4 1775 B11R1.280 COc1cc(cnc1C)S[13CH3] 62a_200025704644_100010254219 [1,0,0,0,0,0|3,0,0]=4 1776 B11R1.280 COc1cc(cnc1F)SC 62a_100010214931_200000210301 [1,0,0,0,0,0|3,0,0]=4 1777 B11R1.280 COc1cc(cnc1F)SC 62a_200000210301_100010214931 [1,0,0,0,0,0|3,0,0]=4 1778 B11R1.280 COc1cc(cnc1F)S[13CH3] 62a_100010214931_200025704644 [1,0,0,0,0,0|3,0,0]=4 1779 B11R1.280 COc1cc(cnc1F)S[13CH3] 62a_200025704644_100010214931 [1,0,0,0,0,0|3,0,0]=4 1780 B11R1.280 COc1cc(cnc1N)SC 62a_106354213024_200000210301 [1,0,0,0,0,0|3,0,0]=4 1781 B11R1.280 COc1cc(cnc1N)SC 62a_200000210301_106354213024 [1,0,0,0,0,0|3,0,0]=4 1782 B11R1.280 COc1cc(cnc1N)S[13CH3] 62a_106354213024_200025704644 [1,0,0,0,0,0|3,0,0]=4 1783 B11R1.280 COc1cc(cnc1N)S[13CH3] 62a_200025704644_106354213024 [1,0,0,0,0,0|3,0,0]=4 1784 B11R1.280 COc1cc(cnc1O)C#N 271570a_203496583355_200009864118 [1,0,0,0,0,0|2,0,1]=4 1785 B11R1.280 COc1cc(ncc1C)SC 62a_100010067687_200000210301 [1,0,0,0,0,0|3,0,0]=4 1786 B11R1.280 COc1cc(ncc1C)SC 62a_200000210301_100010067687 [1,0,0,0,0,0|3,0,0]=4 1787 B11R1.280 COc1cc(ncc1C)S[13CH3] 62a_100010067687_200025704644 [1,0,0,0,0,0|3,0,0]=4 1788 B11R1.280 COc1cc(ncc1C)S[13CH3] 62a_200025704644_100010067687 [1,0,0,0,0,0|3,0,0]=4 1789 B11R1.280 COc1cc(ncc1F)SC 62a_200000210301_200010136270 [1,0,0,0,0,0|3,0,0]=4 1790 B11R1.280 COc1cc(ncc1F)SC 62a_200010136270_200000210301 [1,0,0,0,0,0|3,0,0]=4 1791 B11R1.280 COc1cc(ncc1F)S[13CH3] 62a_200010136270_200025704644 [1,0,0,0,0,0|3,0,0]=4 1792 B11R1.280 COc1cc(ncc1F)S[13CH3] 62a_200025704644_200010136270 [1,0,0,0,0,0|3,0,0]=4 1793 B11R1.280 COc1cc(ncc1N)SC 62a_100009887741_200000210301 [1,0,0,0,0,0|3,0,0]=4 1794 B11R1.280 COc1cc(ncc1N)SC 62a_200000210301_100009887741 [1,0,0,0,0,0|3,0,0]=4 1795 B11R1.280 COc1cc(ncc1N)S[13CH3] 62a_100009887741_200025704644 [1,0,0,0,0,0|3,0,0]=4 1796 B11R1.280 COc1cc(ncc1N)S[13CH3] 62a_200025704644_100009887741 [1,0,0,0,0,0|3,0,0]=4 1797 B11R1.280 COc1cc(ncc1O)C#N 271570a_203496583355_100010136804 [1,0,0,0,0,0|2,0,1]=4 1798 B11R1.280 COc1cc(ncc1O)CO 271570a_203496583355_100010999569 [1,0,0,0,0,0|2,0,0]=3 1799 B11R1.280 COc1ccc(c(c1)C#N)O 271570a_203496583355_100000748272 [1,0,0,0,0,0|3,0,0]=4 1800 B11R1.280 COc1ccc(c(c1)C=O)O 271570a_203496583355_100000691568 [1,0,0,0,0,0|3,0,0]=4 1801 B11R1.280 COc1ccc(c(c1)CN)O 271570a_203496583355_100000741592 [1,0,0,0,0,0|3,0,0]=4 1802 B11R1.280 COc1ccc(c(c1)CO)O 271570a_203496583355_200011273942 [1,0,0,0,0,0|3,0,0]=4 1803 B11R1.280 COc1ccc(c(c1)N[13CH3])Br 34a_100000748603_200025704644 [1,0,0,0,0,0|3,0,0]=4 1804 B11R1.280 COc1ccc(c(c1)N[13CH3])C 2230a_100000760359_200025704644 [1,0,0,0,0,0|3,0,0]=4 1805 B11R1.280 COc1ccc(c(c1)N[13CH3])C 34a_100000760359_200025704644 [1,0,0,0,0,0|3,0,0]=4 1806 B11R1.280 COc1ccc(c(c1)N[13CH3])Cl 34a_100000745576_200025704644 [1,0,0,0,0,0|3,0,0]=4 1807 B11R1.280 COc1ccc(c(c1)N[13CH3])F 34a_100000764331_200025704644 [1,0,0,0,0,0|3,0,0]=4 1808 B11R1.280 COc1ccc(c(c1)N[13CH3])I 34a_100000748021_200025704644 [1,0,0,0,0,0|3,0,0]=4 1809 B11R1.280 COc1ccc(c(c1)N[13CH3])O 34a_100000188146_200025704644 [1,0,0,0,0,0|2,0,0]=3 1810 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100000719091_200000210301 [1,0,0,0,0,0|2,0,0]=3 1811 B11R1.280 COc1ccc(c(c1)OC)Br 34a_100011827694_200000210301 [1,0,0,0,0,0|2,0,0]=3 1812 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100000719091_200000210301 [1,0,0,0,0,0|2,0,0]=3 1813 B11R1.280 COc1ccc(c(c1)OC)Br 7a_100011827694_200000210301 [1,0,0,0,0,0|2,0,0]=3 1814 B11R1.280 COc1ccc(c(c1)OC)C 34a_100009865632_200000210301 [1,0,0,0,0,0|2,0,0]=3 1815 B11R1.280 COc1ccc(c(c1)OC)C 34a_100012179981_200000210301 [1,0,0,0,0,0|2,0,0]=3 1816 B11R1.280 COc1ccc(c(c1)OC)C 7a_100009865632_200000210301 [1,0,0,0,0,0|2,0,0]=3 1817 B11R1.280 COc1ccc(c(c1)OC)C 7a_100012179981_200000210301 [1,0,0,0,0,0|2,0,0]=3 1818 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100011516019_200000210301 [1,0,0,0,0,0|2,0,0]=3 1819 B11R1.280 COc1ccc(c(c1)OC)Cl 34a_100012186310_200000210301 [1,0,0,0,0,0|2,0,0]=3 1820 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100011516019_200000210301 [1,0,0,0,0,0|2,0,0]=3 1821 B11R1.280 COc1ccc(c(c1)OC)Cl 7a_100012186310_200000210301 [1,0,0,0,0,0|2,0,0]=3 1822 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012001760_200000210301 [1,0,0,0,0,0|2,0,0]=3 1823 B11R1.280 COc1ccc(c(c1)OC)F 34a_100012178750_200000210301 [1,0,0,0,0,0|2,0,0]=3 1824 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012001760_200000210301 [1,0,0,0,0,0|2,0,0]=3 1825 B11R1.280 COc1ccc(c(c1)OC)F 7a_100012178750_200000210301 [1,0,0,0,0,0|2,0,0]=3 1826 B11R1.280 COc1ccc(c(c1)OC)I 34a_100010168831_200000210301 [1,0,0,0,0,0|2,0,0]=3 1827 B11R1.280 COc1ccc(c(c1)OC)I 7a_100010168831_200000210301 [1,0,0,0,0,0|2,0,0]=3 1828 B11R1.280 COc1ccc(c(c1)OC)N 34a_100015326901_200000210301 [1,0,0,0,0,0|2,0,0]=3 1829 B11R1.280 COc1ccc(c(c1)OC)N 34a_100016989039_200000210301 [1,0,0,0,0,0|2,0,0]=3 1830 B11R1.280 COc1ccc(c(c1)OC)N 7a_100015326901_200000210301 [1,0,0,0,0,0|2,0,0]=3 1831 B11R1.280 COc1ccc(c(c1)OC)N 7a_100016989039_200000210301 [1,0,0,0,0,0|2,0,0]=3 1832 B11R1.280 COc1ccc(c(c1)OC)O 271570a_203496583355_100000750026 [1,0,0,0,0,0|1,0,0]=2 1833 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 34a_100000719091_200025704644 [1,0,0,0,0,0|2,0,0]=3 1834 B11R1.280 COc1ccc(c(c1)O[13CH3])Br 7a_100000719091_200025704644 [1,0,0,0,0,0|2,0,0]=3 1835 B11R1.280 COc1ccc(c(c1)O[13CH3])C 34a_100012179981_200025704644 [1,0,0,0,0,0|2,0,0]=3 1836 B11R1.280 COc1ccc(c(c1)O[13CH3])C 7a_100012179981_200025704644 [1,0,0,0,0,0|2,0,0]=3 1837 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 34a_100011516019_200025704644 [1,0,0,0,0,0|2,0,0]=3 1838 B11R1.280 COc1ccc(c(c1)O[13CH3])Cl 7a_100011516019_200025704644 [1,0,0,0,0,0|2,0,0]=3 1839 B11R1.280 COc1ccc(c(c1)O[13CH3])F 34a_100012178750_200025704644 [1,0,0,0,0,0|2,0,0]=3 1840 B11R1.280 COc1ccc(c(c1)O[13CH3])F 7a_100012178750_200025704644 [1,0,0,0,0,0|2,0,0]=3 1841 B11R1.280 COc1ccc(c(c1)O[13CH3])I 34a_100010168831_200025704644 [1,0,0,0,0,0|2,0,0]=3 1842 B11R1.280 COc1ccc(c(c1)O[13CH3])I 7a_100010168831_200025704644 [1,0,0,0,0,0|2,0,0]=3 1843 B11R1.280 COc1ccc(c(c1)O[13CH3])N 34a_100016989039_200025704644 [1,0,0,0,0,0|2,0,0]=3 1844 B11R1.280 COc1ccc(c(c1)O[13CH3])N 7a_100016989039_200025704644 [1,0,0,0,0,0|2,0,0]=3 1845 B11R1.280 COc1ccc(c(c1)SC)Br 62a_100009992028_200000210301 [1,0,0,0,0,0|2,1,0]=4 1846 B11R1.280 COc1ccc(c(c1)SC)Br 62a_200000210301_100009992028 [1,0,0,0,0,0|2,1,0]=4 1847 B11R1.280 COc1ccc(c(c1)SC)C 62a_100012349166_200000210301 [1,0,0,0,0,0|2,1,0]=4 1848 B11R1.280 COc1ccc(c(c1)SC)C 62a_200000210301_100012349166 [1,0,0,0,0,0|2,1,0]=4 1849 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_100011356938_200000210301 [1,0,0,0,0,0|2,1,0]=4 1850 B11R1.280 COc1ccc(c(c1)SC)Cl 62a_200000210301_100011356938 [1,0,0,0,0,0|2,1,0]=4 1851 B11R1.280 COc1ccc(c(c1)SC)F 62a_100000699733_200000210301 [1,0,0,0,0,0|2,1,0]=4 1852 B11R1.280 COc1ccc(c(c1)SC)F 62a_200000210301_100000699733 [1,0,0,0,0,0|2,1,0]=4 1853 B11R1.280 COc1ccc(c(c1)SC)N 62a_100015195136_200000210301 [1,0,0,0,0,0|2,1,0]=4 1854 B11R1.280 COc1ccc(c(c1)SC)N 62a_200000210301_100015195136 [1,0,0,0,0,0|2,1,0]=4 1855 B11R1.280 COc1ccc(c(c1)SC)O 62a_200000210301_100000685887 [1,0,0,0,0,0|1,1,0]=3 1856 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_100009992028_200025704644 [1,0,0,0,0,0|2,1,0]=4 1857 B11R1.280 COc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100009992028 [1,0,0,0,0,0|2,1,0]=4 1858 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_100012349166_200025704644 [1,0,0,0,0,0|2,1,0]=4 1859 B11R1.280 COc1ccc(c(c1)S[13CH3])C 62a_200025704644_100012349166 [1,0,0,0,0,0|2,1,0]=4 1860 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_100011356938_200025704644 [1,0,0,0,0,0|2,1,0]=4 1861 B11R1.280 COc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100011356938 [1,0,0,0,0,0|2,1,0]=4 1862 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_100000699733_200025704644 [1,0,0,0,0,0|2,1,0]=4 1863 B11R1.280 COc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000699733 [1,0,0,0,0,0|2,1,0]=4 1864 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_100015195136_200025704644 [1,0,0,0,0,0|2,1,0]=4 1865 B11R1.280 COc1ccc(c(c1)S[13CH3])N 62a_200025704644_100015195136 [1,0,0,0,0,0|2,1,0]=4 1866 B11R1.280 COc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000685887 [1,0,0,0,0,0|1,1,0]=3 1867 B11R1.280 COc1ccc(c(n1)OC)O 271570a_203496583355_100009816055 [1,0,0,0,0,0|2,0,0]=3 1868 B11R1.280 COc1nc(ccc1N)SC 62a_100000687816_200000210301 [1,0,0,0,0,0|3,0,0]=4 1869 B11R1.280 COc1nc(ccc1N)SC 62a_200000210301_100000687816 [1,0,0,0,0,0|3,0,0]=4 1870 B11R1.280 COc1nc(ccc1N)S[13CH3] 62a_100000687816_200025704644 [1,0,0,0,0,0|3,0,0]=4 1871 B11R1.280 COc1nc(ccc1N)S[13CH3] 62a_200025704644_100000687816 [1,0,0,0,0,0|3,0,0]=4 1872 B11R1.280 COc1nc(ccc1O)SC 62a_200000210301_100010893133 [1,0,0,0,0,0|2,0,0]=3 1873 B11R1.280 COc1nc(ccc1O)S[13CH3] 62a_200025704644_100010893133 [1,0,0,0,0,0|2,0,0]=3 1874 B11R1.280 COc1nc(cnc1O)SC 62a_200000210301_200010365344 [1,0,0,0,0,0|3,0,0]=4 1875 B11R1.280 COc1nc(cnc1O)SC 62a_200010365344_200000210301 [1,0,0,0,0,0|3,0,0]=4 1876 B11R1.280 COc1nc(cnc1O)S[13CH3] 62a_200010365344_200025704644 [1,0,0,0,0,0|3,0,0]=4 1877 B11R1.280 COc1nc(cnc1O)S[13CH3] 62a_200025704644_200010365344 [1,0,0,0,0,0|3,0,0]=4 1878 B11R1.280 COc1nc(ncc1O)SC 271570a_203496583355_200011934731 [1,0,0,0,0,0|3,0,0]=4 1879 B11R1.280 COc1ncc(c(n1)OC)O 271570a_203496583355_100011215025 [1,0,0,0,0,0|3,0,0]=4 1880 B11R1.280 CSc1cc(ccc1C)CO 62a_100000708995_200000210301 [1,0,0,0,0,0|2,1,0]=4 1881 B11R1.280 CSc1cc(ccc1C)CO 62a_200000210301_100000708995 [1,0,0,0,0,0|2,1,0]=4 1882 B11R1.280 CSc1cc(ccc1F)CN 62a_100015193890_200000210301 [1,0,0,0,0,0|2,1,0]=4 1883 B11R1.280 CSc1cc(ccc1F)CN 62a_200000210301_100015193890 [1,0,0,0,0,0|2,1,0]=4 1884 B11R1.280 CSc1cc(ccc1F)CO 62a_100000246287_200000210301 [1,0,0,0,0,0|2,1,0]=4 1885 B11R1.280 CSc1cc(ccc1F)CO 62a_200000210301_100000246287 [1,0,0,0,0,0|2,1,0]=4 1886 B11R1.280 CSc1cc(ccc1F)S[13CH3] 62a_100010341305_200025704644 [1,0,0,0,0,0|2,1,0]=4 1887 B11R1.280 CSc1cc(ccc1F)S[13CH3] 62a_200025704644_100010341305 [1,0,0,0,0,0|2,1,0]=4 1888 B11R1.280 CSc1cc(ccc1O)C#N 62a_200000210301_100000725478 [1,0,0,0,0,0|1,1,1]=4 1889 B11R1.280 CSc1cc(ccc1O)C=O 62a_100000184552_200000210301 [1,0,0,0,0,0|1,1,1]=4 1890 B11R1.280 CSc1cc(ccc1O)C=O 62a_200000210301_100000184552 [1,0,0,0,0,0|1,1,1]=4 1891 B11R1.280 CSc1cc(ccc1O)CO 62a_100011191544_200000210301 [1,0,0,0,0,0|1,1,0]=3 1892 B11R1.280 CSc1cc(ccc1O)CO 62a_200000210301_100011191544 [1,0,0,0,0,0|1,1,0]=3 1893 B11R1.280 CSc1ccc(c(c1)C#N)O 62a_200000210301_100000687585 [1,0,0,0,0,0|3,0,0]=4 1894 B11R1.280 CSc1ccc(c(c1)C=O)O 62a_200000210301_100000186750 [1,0,0,0,0,0|3,0,0]=4 1895 B11R1.280 CSc1ccc(c(c1)CN)O 62a_100000730032_200000210301 [1,0,0,0,0,0|3,0,0]=4 1896 B11R1.280 CSc1ccc(c(c1)CN)O 62a_200000210301_100000730032 [1,0,0,0,0,0|3,0,0]=4 1897 B11R1.280 CSc1ccc(c(c1)CO)O 62a_100000184703_200000210301 [1,0,0,0,0,0|3,0,0]=4 1898 B11R1.280 CSc1ccc(c(c1)CO)O 62a_200000210301_100000184703 [1,0,0,0,0,0|3,0,0]=4 1899 B11R1.280 CSc1ccc(c(c1)SC)F 62a_100010341305_200000210301 [1,0,0,0,0,0|2,1,0]=4 1900 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200000210301_100010341305 [1,0,0,0,0,0|2,1,0]=4 1901 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200000210301_200010708804 [1,0,0,0,0,0|2,1,0]=4 1902 B11R1.280 CSc1ccc(c(c1)SC)F 62a_200010708804_200000210301 [1,0,0,0,0,0|2,1,0]=4 1903 B11R1.280 CSc1ccc(c(c1)S[13CH3])F 62a_200010708804_200025704644 [1,0,0,0,0,0|2,1,0]=4 1904 B11R1.280 CSc1ccc(c(c1)S[13CH3])F 62a_200025704644_200010708804 [1,0,0,0,0,0|2,1,0]=4 1905 B11R1.280 CSc1nc(ccc1O)CO 62a_200000210301_200000118097 [1,0,0,0,0,0|2,1,0]=4 1906 B11R1.280 CSc1nc(ccc1O)CO 62a_200009817064_200000210301 [1,0,0,0,0,0|2,1,0]=4 1907 B11R1.280 Cc1ccc(cc1N[13CH3])CO 2230a_100000758420_200025704644 [1,0,0,0,0,0|3,0,0]=4 1908 B11R1.280 Cc1ccc(cc1N[13CH3])CO 34a_100000758420_200025704644 [1,0,0,0,0,0|3,0,0]=4 1909 B11R1.280 Cc1ccc(cc1O[13CH3])C#N 34a_100000765541_200025704644 [1,0,0,0,0,0|2,0,1]=4 1910 B11R1.280 Cc1ccc(cc1O[13CH3])C#N 7a_100000765541_200025704644 [1,0,0,0,0,0|2,0,1]=4 1911 B11R1.280 Cc1ccc(cc1S[13CH3])CO 62a_100000708995_200025704644 [1,0,0,0,0,0|2,1,0]=4 1912 B11R1.280 Cc1ccc(cc1S[13CH3])CO 62a_200025704644_100000708995 [1,0,0,0,0,0|2,1,0]=4 1913 B11R1.280 N#Cc1cc(ccc1O)CN 271570a_203496583355_100009846983 [1,0,0,0,0,0|3,0,0]=4 1914 B11R1.280 N#Cc1cc(ccc1O)CO 271570a_203496583355_100010145894 [1,0,0,0,0,0|3,0,0]=4 1915 B11R1.280 [13CH3]Nc1cc(ccc1Br)CO 34a_100012347568_200025704644 [1,0,0,0,0,0|3,0,0]=4 1916 B11R1.280 [13CH3]Nc1cc(ccc1Cl)CO 34a_106256033963_200025704644 [1,0,0,0,0,0|3,0,0]=4 1917 B11R1.280 [13CH3]Nc1cc(ccc1F)CO 2230a_102125399562_200025704644 [1,0,0,0,0,0|3,0,0]=4 1918 B11R1.280 [13CH3]Nc1cc(ccc1F)CO 34a_102125399562_200025704644 [1,0,0,0,0,0|3,0,0]=4 1919 B11R1.280 [13CH3]Nc1cc(ccc1O)C#N 34a_100000766272_200025704644 [1,0,0,0,0,0|2,0,1]=4 1920 B11R1.280 [13CH3]Nc1cc(ccc1O)C#N 7a_100000766272_200025704644 [1,0,0,0,0,0|2,0,1]=4 1921 B11R1.280 [13CH3]Nc1cc(ccc1O)CO 34a_100000123545_200025704644 [1,0,0,0,0,0|2,0,0]=3 1922 B11R1.280 [13CH3]Nc1ccc(c(c1)C#N)O 34a_100011249283_200025704644 [1,0,0,0,0,0|3,0,0]=4 1923 B11R1.280 [13CH3]Oc1cc(ccc1Br)C#N 34a_100009877741_200025704644 [1,0,0,0,0,0|2,0,1]=4 1924 B11R1.280 [13CH3]Oc1cc(ccc1Br)C#N 7a_100009877741_200025704644 [1,0,0,0,0,0|2,0,1]=4 1925 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 34a_100010191536_200025704644 [1,0,0,0,0,0|2,0,0]=3 1926 B11R1.280 [13CH3]Oc1cc(ccc1Br)CO 7a_100010191536_200025704644 [1,0,0,0,0,0|2,0,0]=3 1927 B11R1.280 [13CH3]Oc1cc(ccc1Cl)C#N 34a_100012186312_200025704644 [1,0,0,0,0,0|2,0,1]=4 1928 B11R1.280 [13CH3]Oc1cc(ccc1Cl)C#N 7a_100012186312_200025704644 [1,0,0,0,0,0|2,0,1]=4 1929 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CN 34a_100020636435_200025704644 [1,0,0,0,0,0|2,0,0]=3 1930 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 34a_100009876509_200025704644 [1,0,0,0,0,0|2,0,0]=3 1931 B11R1.280 [13CH3]Oc1cc(ccc1Cl)CO 7a_100009876509_200025704644 [1,0,0,0,0,0|2,0,0]=3 1932 B11R1.280 [13CH3]Oc1cc(ccc1F)C#N 34a_100000069402_200025704644 [1,0,0,0,0,0|2,0,1]=4 1933 B11R1.280 [13CH3]Oc1cc(ccc1F)C#N 7a_100000069402_200025704644 [1,0,0,0,0,0|2,0,1]=4 1934 B11R1.280 [13CH3]Oc1cc(ccc1F)CN 34a_100160469508_200025704644 [1,0,0,0,0,0|2,0,0]=3 1935 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 34a_100009842347_200025704644 [1,0,0,0,0,0|2,0,0]=3 1936 B11R1.280 [13CH3]Oc1cc(ccc1F)CO 7a_100009842347_200025704644 [1,0,0,0,0,0|2,0,0]=3 1937 B11R1.280 [13CH3]Oc1cc(ccc1I)C#N 34a_100000724445_200025704644 [1,0,0,0,0,0|2,0,1]=4 1938 B11R1.280 [13CH3]Oc1cc(ccc1I)C#N 7a_100000724445_200025704644 [1,0,0,0,0,0|2,0,1]=4 1939 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 34a_100000049605_200025704644 [1,0,0,0,0,0|2,0,0]=3 1940 B11R1.280 [13CH3]Oc1cc(ccc1I)CO 7a_100000049605_200025704644 [1,0,0,0,0,0|2,0,0]=3 1941 B11R1.280 [13CH3]Oc1cc(ccc1N)C#N 34a_100011997735_200025704644 [1,0,0,0,0,0|2,0,1]=4 1942 B11R1.280 [13CH3]Oc1cc(ccc1N)C#N 7a_100011997735_200025704644 [1,0,0,0,0,0|2,0,1]=4 1943 B11R1.280 [13CH3]Sc1cc(ccc1F)CN 62a_100015193890_200025704644 [1,0,0,0,0,0|2,1,0]=4 1944 B11R1.280 [13CH3]Sc1cc(ccc1F)CN 62a_200025704644_100015193890 [1,0,0,0,0,0|2,1,0]=4 1945 B11R1.280 [13CH3]Sc1cc(ccc1F)CO 62a_100000246287_200025704644 [1,0,0,0,0,0|2,1,0]=4 1946 B11R1.280 [13CH3]Sc1cc(ccc1F)CO 62a_200025704644_100000246287 [1,0,0,0,0,0|2,1,0]=4 1947 B11R1.280 [13CH3]Sc1cc(ccc1O)C#N 62a_200025704644_100000725478 [1,0,0,0,0,0|1,1,1]=4 1948 B11R1.280 [13CH3]Sc1cc(ccc1O)C=O 62a_100000184552_200025704644 [1,0,0,0,0,0|1,1,1]=4 1949 B11R1.280 [13CH3]Sc1cc(ccc1O)C=O 62a_200025704644_100000184552 [1,0,0,0,0,0|1,1,1]=4 1950 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_100011191544_200025704644 [1,0,0,0,0,0|1,1,0]=3 1951 B11R1.280 [13CH3]Sc1cc(ccc1O)CO 62a_200025704644_100011191544 [1,0,0,0,0,0|1,1,0]=3 1952 B11R1.280 [13CH3]Sc1ccc(c(c1)C#N)O 62a_200025704644_100000687585 [1,0,0,0,0,0|3,0,0]=4 1953 B11R1.280 [13CH3]Sc1ccc(c(c1)C=O)O 62a_200025704644_100000186750 [1,0,0,0,0,0|3,0,0]=4 1954 B11R1.280 [13CH3]Sc1ccc(c(c1)CN)O 62a_100000730032_200025704644 [1,0,0,0,0,0|3,0,0]=4 1955 B11R1.280 [13CH3]Sc1ccc(c(c1)CN)O 62a_200025704644_100000730032 [1,0,0,0,0,0|3,0,0]=4 1956 B11R1.280 [13CH3]Sc1ccc(c(c1)CO)O 62a_100000184703_200025704644 [1,0,0,0,0,0|3,0,0]=4 1957 B11R1.280 [13CH3]Sc1ccc(c(c1)CO)O 62a_200025704644_100000184703 [1,0,0,0,0,0|3,0,0]=4 1958 B11R1.280 [13CH3]Sc1nc(ccc1O)CO 62a_200009817064_200025704644 [1,0,0,0,0,0|2,1,0]=4 1959 B11R1.280 [13CH3]Sc1nc(ccc1O)CO 62a_200025704644_200000118097 [1,0,0,0,0,0|2,1,0]=4 1960 B13R1.49 CCC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_100000210202 [0,1,0,0,0,0|2,0,1]=4 1961 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Br 1458a_100010152358_100000210202 [0,1,0,0,0,0|2,0,1]=4 1962 B13R1.49 CCC(=O)c1ccc(c(c1)CC)Cl 1458a_100000102533_100000210202 [0,1,0,0,0,0|2,0,1]=4 1963 B13R1.49 CCC(=O)c1ccc(c(c1)CC)F 1458a_100009883079_100000210202 [0,1,0,0,0,0|2,0,1]=4 1964 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210202 [0,1,0,0,0,0|1,0,1]=3 1965 B13R1.49 CCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210202 [0,1,0,0,0,0|1,0,1]=3 1966 B13R1.49 CCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210202 [0,1,0,0,0,0|1,0,1]=3 1967 B13R1.49 CCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210202 [0,1,0,0,0,0|1,0,1]=3 1968 B13R1.49 CCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210202 [0,1,0,0,0,0|1,0,1]=3 1969 B13R1.49 CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210202 [0,1,0,0,0,0|0,0,1]=2 1970 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_100011216493_200000210301 [0,1,0,0,0,0|1,1,1]=4 1971 B13R1.49 CCC(=O)c1ccc(c(c1)SC)F 62a_200000210301_100011216493 [0,1,0,0,0,0|1,1,1]=4 1972 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_100011216493_200025704644 [0,1,0,0,0,0|1,1,1]=4 1973 B13R1.49 CCC(=O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011216493 [0,1,0,0,0,0|1,1,1]=4 1974 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000210202 [0,1,0,0,0,0|2,0,0]=3 1975 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000204670 [0,1,0,0,0,0|2,0,0]=3 1976 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000210202 [0,1,0,0,0,0|2,0,0]=3 1977 B13R1.49 CCN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000204670 [0,1,0,0,0,0|2,0,0]=3 1978 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 11a_106832991635_100011934951 [0,1,0,0,0,0|2,0,1]=4 1979 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 1626a_100102657272_100011934951 [0,1,0,0,0,0|2,0,1]=4 1980 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 240690a_100102657272_100011934951 [0,1,0,0,0,0|2,0,1]=4 1981 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Br 527a_100102657272_100011934951 [0,1,0,0,0,0|2,0,1]=4 1982 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 11a_106832991635_100000212341 [0,1,0,0,0,0|2,0,1]=4 1983 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 1626a_100102657272_100000212341 [0,1,0,0,0,0|2,0,1]=4 1984 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 240690a_100102657272_100000212341 [0,1,0,0,0,0|2,0,1]=4 1985 B13R1.49 CNC(=O)c1ccc(c(c1)OC)C 527a_100102657272_100000212341 [0,1,0,0,0,0|2,0,1]=4 1986 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 11a_106832991635_100000181799 [0,1,0,0,0,0|2,0,1]=4 1987 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 1626a_100102657272_100000181799 [0,1,0,0,0,0|2,0,1]=4 1988 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 240690a_100102657272_100000181799 [0,1,0,0,0,0|2,0,1]=4 1989 B13R1.49 CNC(=O)c1ccc(c(c1)OC)Cl 527a_100102657272_100000181799 [0,1,0,0,0,0|2,0,1]=4 1990 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 11a_106832991635_100000757635 [0,1,0,0,0,0|2,0,1]=4 1991 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 1626a_100102657272_100000757635 [0,1,0,0,0,0|2,0,1]=4 1992 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 240690a_100102657272_100000757635 [0,1,0,0,0,0|2,0,1]=4 1993 B13R1.49 CNC(=O)c1ccc(c(c1)OC)F 527a_100102657272_100000757635 [0,1,0,0,0,0|2,0,1]=4 1994 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 11a_106832991635_100012356290 [0,1,0,0,0,0|2,0,1]=4 1995 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 1626a_100102657272_100012356290 [0,1,0,0,0,0|2,0,1]=4 1996 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 240690a_100102657272_100012356290 [0,1,0,0,0,0|2,0,1]=4 1997 B13R1.49 CNC(=O)c1ccc(c(c1)OC)I 527a_100102657272_100012356290 [0,1,0,0,0,0|2,0,1]=4 1998 B13R1.49 CNC(=O)c1ccc(c(c1)OC)O 240690a_100102657272_100000687070 [0,1,0,0,0,0|1,0,1]=3 1999 B13R1.49 CNC(C)c1ccc(c(c1)OC)Br 269862a_106832991636_100010110075 [0,1,0,0,0,0|2,0,0]=3 2000 B13R1.49 CNC(C)c1ccc(c(c1)OC)C 269862a_106832991636_100012706825 [0,1,0,0,0,0|2,0,0]=3 2001 B13R1.49 CNC(C)c1ccc(c(c1)OC)Cl 269862a_106832991636_100012002813 [0,1,0,0,0,0|2,0,0]=3 2002 B13R1.49 CNC(C)c1ccc(c(c1)OC)F 269862a_106832991636_100000694624 [0,1,0,0,0,0|2,0,0]=3 2003 B13R1.49 CN[C@@H](C)c1ccc(c(c1)OC)F 2230a_100025717271_200000210301 [0,1,0,0,0,0|2,0,0]=3 2004 B13R1.49 CN[C@@H](C)c1ccc(c(c1)OC)F 34a_100025717271_200000210301 [0,1,0,0,0,0|2,0,0]=3 2005 B13R1.49 COC(=O)c1cc(c(cn1)O)OC 271570a_203496583355_100010136178 [0,1,0,0,0,0|2,0,1]=4 2006 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 34a_100011934688_200000210301 [0,1,0,0,0,0|2,0,1]=4 2007 B13R1.49 COC(=O)c1ccc(c(c1)OC)Br 7a_100011934688_200000210301 [0,1,0,0,0,0|2,0,1]=4 2008 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 34a_100000736511_200000210301 [0,1,0,0,0,0|2,0,1]=4 2009 B13R1.49 COC(=O)c1ccc(c(c1)OC)C 7a_100000736511_200000210301 [0,1,0,0,0,0|2,0,1]=4 2010 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 34a_100000103815_200000210301 [0,1,0,0,0,0|2,0,1]=4 2011 B13R1.49 COC(=O)c1ccc(c(c1)OC)Cl 7a_100000103815_200000210301 [0,1,0,0,0,0|2,0,1]=4 2012 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 34a_100000062259_200000210301 [0,1,0,0,0,0|2,0,1]=4 2013 B13R1.49 COC(=O)c1ccc(c(c1)OC)F 7a_100000062259_200000210301 [0,1,0,0,0,0|2,0,1]=4 2014 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 34a_100012350776_200000210301 [0,1,0,0,0,0|2,0,1]=4 2015 B13R1.49 COC(=O)c1ccc(c(c1)OC)I 7a_100012350776_200000210301 [0,1,0,0,0,0|2,0,1]=4 2016 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 34a_100000757247_200000210301 [0,1,0,0,0,0|2,0,1]=4 2017 B13R1.49 COC(=O)c1ccc(c(c1)OC)N 7a_100000757247_200000210301 [0,1,0,0,0,0|2,0,1]=4 2018 B13R1.49 COC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100009816954 [0,1,0,0,0,0|1,0,1]=3 2019 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 34a_100011934688_200025704644 [0,1,0,0,0,0|2,0,1]=4 2020 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100011934688_200025704644 [0,1,0,0,0,0|2,0,1]=4 2021 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000736511_200025704644 [0,1,0,0,0,0|2,0,1]=4 2022 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000736511_200025704644 [0,1,0,0,0,0|2,0,1]=4 2023 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 34a_100000103815_200025704644 [0,1,0,0,0,0|2,0,1]=4 2024 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])Cl 7a_100000103815_200025704644 [0,1,0,0,0,0|2,0,1]=4 2025 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000062259_200025704644 [0,1,0,0,0,0|2,0,1]=4 2026 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000062259_200025704644 [0,1,0,0,0,0|2,0,1]=4 2027 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 34a_100012350776_200025704644 [0,1,0,0,0,0|2,0,1]=4 2028 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])I 7a_100012350776_200025704644 [0,1,0,0,0,0|2,0,1]=4 2029 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 34a_100000757247_200025704644 [0,1,0,0,0,0|2,0,1]=4 2030 B13R1.49 COC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000757247_200025704644 [0,1,0,0,0,0|2,0,1]=4 2031 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_100000216328_200000210301 [0,1,0,0,0,0|1,1,1]=4 2032 B13R1.49 COC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100000216328 [0,1,0,0,0,0|1,1,1]=4 2033 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_100000216328_200025704644 [0,1,0,0,0,0|1,1,1]=4 2034 B13R1.49 COC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100000216328 [0,1,0,0,0,0|1,1,1]=4 2035 B13R1.49 COC(=O)c1ccc(c(n1)OC)O 271570a_203496583355_100010189641 [0,1,0,0,0,0|2,0,1]=4 2036 B13R1.49 COC(=O)c1cnc(c(c1)OC)O 271570a_203496583355_100010074909 [0,1,0,0,0,0|2,0,1]=4 2037 B13R1.49 COc1cc(ccc1Br)C(=O)CF 1458a_100011934951_100015361967 [0,1,0,0,0,0|2,0,1]=4 2038 B13R1.49 COc1cc(ccc1C)C(=O)CF 1458a_100000212341_100015361967 [0,1,0,0,0,0|2,0,1]=4 2039 B13R1.49 COc1cc(ccc1Cl)C(=O)CF 1458a_100000181799_100015361967 [0,1,0,0,0,0|2,0,1]=4 2040 B13R1.49 COc1cc(ccc1F)C(=O)CF 1458a_100000757635_100015361967 [0,1,0,0,0,0|2,0,1]=4 2041 B13R1.49 COc1cc(ccc1F)N(C)CF 269982a_200012002703_100015361967 [0,1,0,0,0,0|3,0,0]=4 2042 B13R1.49 COc1cc(ccc1F)N(C)CF 34a_200012002703_100015361967 [0,1,0,0,0,0|3,0,0]=4 2043 B13R1.49 COc1cc(ccc1F)N(C)CF 38a_200012002703_100015361967 [0,1,0,0,0,0|3,0,0]=4 2044 B13R1.49 COc1cc(ccc1F)[C@H](C)N[13CH3] 2230a_100025717271_200025704644 [0,1,0,0,0,0|2,0,0]=3 2045 B13R1.49 COc1cc(ccc1F)[C@H](C)N[13CH3] 34a_100025717271_200025704644 [0,1,0,0,0,0|2,0,0]=3 2046 B13R1.49 COc1cc(ccc1I)C(=O)CF 1458a_100012356290_100015361967 [0,1,0,0,0,0|2,0,1]=4 2047 B13R1.49 COc1cc(ccc1O)C(=O)CF 1458a_100000687070_100015361967 [0,1,0,0,0,0|1,0,1]=3 2048 B13R1.52 C=Cc1cc(ccc1O)CC(=O)C 271570a_100011290941_100010141077 [0,1,0,0,0,0|1,0,2]=4 2049 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,1,0,0,0,0|0,1,1]=3 2050 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,1,0,0,0,0|0,1,1]=3 2051 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 34a_100011935283_200025704644 [0,1,0,0,0,0|2,0,1]=4 2052 B13R1.52 CC(=O)Nc1ccc(c(c1)O[13CH3])Cl 7a_100011935283_200025704644 [0,1,0,0,0,0|2,0,1]=4 2053 B13R1.52 CC(C)Nc1ccc(c(c1)C#N)O 34a_100011249283_100000210206 [0,1,0,0,0,0|3,0,0]=4 2054 B13R1.52 CC(C)Oc1ccc(c(c1)C=O)O 271570a_203496583355_200012936200 [0,1,0,0,0,0|3,0,0]=4 2055 B13R1.52 CC(C)Sc1ccc(c(c1)C#N)O 62a_100000210206_100000687585 [0,1,0,0,0,0|3,0,0]=4 2056 B13R1.52 CC(C)Sc1ccc(c(c1)C=O)O 62a_100000210206_100000186750 [0,1,0,0,0,0|3,0,0]=4 2057 B13R1.52 CC(C)Sc1ccc(c(c1)CN)O 62a_100000210206_100000730032 [0,1,0,0,0,0|3,0,0]=4 2058 B13R1.52 CC(C)Sc1ccc(c(c1)CN)O 62a_100000730032_100000210206 [0,1,0,0,0,0|3,0,0]=4 2059 B13R1.52 CC(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100000210206 [0,1,0,0,0,0|3,0,0]=4 2060 B13R1.52 CC(C)Sc1ccc(c(c1)CO)O 62a_100000210206_100000184703 [0,1,0,0,0,0|3,0,0]=4 2061 B13R1.52 CCc1cc(ccc1Br)NC(C)C 2230a_100010109747_100000210206 [0,1,0,0,0,0|3,0,0]=4 2062 B13R1.52 CCc1cc(ccc1Br)NC(C)C 34a_100010109747_100000210206 [0,1,0,0,0,0|3,0,0]=4 2063 B13R1.52 CCc1cc(ccc1Br)NC(C)C 7a_100010109747_100000210206 [0,1,0,0,0,0|3,0,0]=4 2064 B13R1.52 CCc1cc(ccc1Br)SC(C)C 62a_100000210206_100010244631 [0,1,0,0,0,0|3,0,0]=4 2065 B13R1.52 CCc1cc(ccc1Br)SC(C)C 62a_100010244631_100000210206 [0,1,0,0,0,0|3,0,0]=4 2066 B13R1.52 CCc1cc(ccc1Cl)OC(C)C 34a_100000212063_100000210206 [0,1,0,0,0,0|3,0,0]=4 2067 B13R1.52 CCc1cc(ccc1Cl)OC(C)C 7a_100000212063_100000210206 [0,1,0,0,0,0|3,0,0]=4 2068 B13R1.52 CCc1cc(ccc1F)CN(C)C 270004a_100102631434_100009840867 [0,1,0,0,0,0|3,0,0]=4 2069 B13R1.52 CCc1cc(ccc1F)SC(C)C 62a_100000210206_100010244625 [0,1,0,0,0,0|3,0,0]=4 2070 B13R1.52 CCc1cc(ccc1F)SC(C)C 62a_100010244625_100000210206 [0,1,0,0,0,0|3,0,0]=4 2071 B13R1.52 CCc1cc(ccc1N)SC(C)C 62a_100000210206_100000686106 [0,1,0,0,0,0|3,0,0]=4 2072 B13R1.52 CCc1cc(ccc1N)SC(C)C 62a_100000686106_100000210206 [0,1,0,0,0,0|3,0,0]=4 2073 B13R1.52 CCc1cc(ccc1O)C=C(C)C 271570a_100102525489_100012338938 [0,1,0,0,0,0|1,0,2]=4 2074 B13R1.52 CCc1cc(ccc1O)SC(C)C 62a_100000210206_100012338938 [0,1,0,0,0,0|2,0,0]=3 2075 B13R1.52 CN(C)Cc1ccc(c(c1)C=O)O 269982a_100102631434_100000008128 [0,1,0,0,0,0|3,0,0]=4 2076 B13R1.52 CNc1cc(ccc1C)SC(C)C 62a_100000210206_100020629602 [0,1,0,0,0,0|3,0,0]=4 2077 B13R1.52 CNc1cc(ccc1C)SC(C)C 62a_100020629602_100000210206 [0,1,0,0,0,0|3,0,0]=4 2078 B13R1.52 CNc1cc(ccc1F)SC(C)C 62a_100000210206_100011314990 [0,1,0,0,0,0|3,0,0]=4 2079 B13R1.52 CNc1cc(ccc1F)SC(C)C 62a_100011314990_100000210206 [0,1,0,0,0,0|3,0,0]=4 2080 B13R1.52 CNc1cc(ccc1N)SC(C)C 62a_100000694363_100000210206 [0,1,0,0,0,0|3,0,0]=4 2081 B13R1.52 COc1cc(c[nH]c1=O)SC(C)C 62a_100000210206_100010125397 [0,1,0,0,0,0|2,0,1]=4 2082 B13R1.52 COc1cc(ccc1Br)C=C(C)C 271570a_100102525489_100012353699 [0,1,0,0,0,0|1,0,2]=4 2083 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,1,0,0,0,0|1,0,1]=3 2084 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,1,0,0,0,0|1,0,1]=3 2085 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,1,0,0,0,0|1,0,1]=3 2086 B13R1.52 COc1cc(ccc1Br)CN(C)C 2230a_100102631434_100010110085 [0,1,0,0,0,0|2,0,0]=3 2087 B13R1.52 COc1cc(ccc1Br)CN(C)C 269982a_100102631434_100010110085 [0,1,0,0,0,0|2,0,0]=3 2088 B13R1.52 COc1cc(ccc1Br)CN(C)C 270004a_100102631434_100010244714 [0,1,0,0,0,0|2,0,0]=3 2089 B13R1.52 COc1cc(ccc1Br)NC(=O)C 11a_100000765947_100015343762 [0,1,0,0,0,0|2,0,1]=4 2090 B13R1.52 COc1cc(ccc1Br)NC(=O)C 1626a_100000765947_100015343762 [0,1,0,0,0,0|2,0,1]=4 2091 B13R1.52 COc1cc(ccc1Br)NC(=O)C 22a_100000765947_100000070787 [0,1,0,0,0,0|2,0,1]=4 2092 B13R1.52 COc1cc(ccc1Br)NC(=O)C 527a_100000765947_100103153847 [0,1,0,0,0,0|2,0,1]=4 2093 B13R1.52 COc1cc(ccc1Br)NC(C)C 2230a_100000765947_100000210206 [0,1,0,0,0,0|2,0,0]=3 2094 B13R1.52 COc1cc(ccc1Br)NC(C)C 34a_100000765947_100000210206 [0,1,0,0,0,0|2,0,0]=3 2095 B13R1.52 COc1cc(ccc1Br)OC(C)C 34a_100011827694_100000210206 [0,1,0,0,0,0|2,0,0]=3 2096 B13R1.52 COc1cc(ccc1Br)OC(C)C 7a_100011827694_100000210206 [0,1,0,0,0,0|2,0,0]=3 2097 B13R1.52 COc1cc(ccc1Br)SC(C)C 62a_100000210206_100012353699 [0,1,0,0,0,0|2,0,0]=3 2098 B13R1.52 COc1cc(ccc1Br)SC(C)C 62a_100012353699_100000210206 [0,1,0,0,0,0|2,0,0]=3 2099 B13R1.52 COc1cc(ccc1C)C=C(C)C 271570a_100102525489_100011830276 [0,1,0,0,0,0|1,0,2]=4 2100 B13R1.52 COc1cc(ccc1C)CN(C)C 270004a_100102631434_100000719150 [0,1,0,0,0,0|2,0,0]=3 2101 B13R1.52 COc1cc(ccc1C)NC(=O)C 11a_100011279678_100015343762 [0,1,0,0,0,0|2,0,1]=4 2102 B13R1.52 COc1cc(ccc1C)NC(=O)C 1626a_100011279678_100015343762 [0,1,0,0,0,0|2,0,1]=4 2103 B13R1.52 COc1cc(ccc1C)NC(=O)C 22a_100011279678_100000070787 [0,1,0,0,0,0|2,0,1]=4 2104 B13R1.52 COc1cc(ccc1C)NC(=O)C 527a_100011279678_100103153847 [0,1,0,0,0,0|2,0,1]=4 2105 B13R1.52 COc1cc(ccc1C)NC(C)C 2230a_100011279678_100000210206 [0,1,0,0,0,0|2,0,0]=3 2106 B13R1.52 COc1cc(ccc1C)NC(C)C 34a_100011279678_100000210206 [0,1,0,0,0,0|2,0,0]=3 2107 B13R1.52 COc1cc(ccc1C)OC(C)C 34a_100009865632_100000210206 [0,1,0,0,0,0|2,0,0]=3 2108 B13R1.52 COc1cc(ccc1C)OC(C)C 7a_100009865632_100000210206 [0,1,0,0,0,0|2,0,0]=3 2109 B13R1.52 COc1cc(ccc1C)SC(C)C 62a_100000210206_100011830276 [0,1,0,0,0,0|2,0,0]=3 2110 B13R1.52 COc1cc(ccc1C)SC(C)C 62a_100011830276_100000210206 [0,1,0,0,0,0|2,0,0]=3 2111 B13R1.52 COc1cc(ccc1Cl)C=C(C)C 271570a_100102525489_100011356853 [0,1,0,0,0,0|1,0,2]=4 2112 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,1,0,0,0,0|1,0,1]=3 2113 B13R1.52 COc1cc(ccc1Cl)CN(C)C 2230a_100102631434_200010214485 [0,1,0,0,0,0|2,0,0]=3 2114 B13R1.52 COc1cc(ccc1Cl)CN(C)C 269982a_100102631434_200010214485 [0,1,0,0,0,0|2,0,0]=3 2115 B13R1.52 COc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100011998524 [0,1,0,0,0,0|2,0,0]=3 2116 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 11a_100000742311_100015343762 [0,1,0,0,0,0|2,0,1]=4 2117 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 1626a_100000742311_100015343762 [0,1,0,0,0,0|2,0,1]=4 2118 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 22a_100000742311_100000070787 [0,1,0,0,0,0|2,0,1]=4 2119 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 34a_100011935283_200000210301 [0,1,0,0,0,0|2,0,1]=4 2120 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 527a_100000742311_100103153847 [0,1,0,0,0,0|2,0,1]=4 2121 B13R1.52 COc1cc(ccc1Cl)NC(=O)C 7a_100011935283_200000210301 [0,1,0,0,0,0|2,0,1]=4 2122 B13R1.52 COc1cc(ccc1Cl)NC(C)C 2230a_100000742311_100000210206 [0,1,0,0,0,0|2,0,0]=3 2123 B13R1.52 COc1cc(ccc1Cl)NC(C)C 34a_100000742311_100000210206 [0,1,0,0,0,0|2,0,0]=3 2124 B13R1.52 COc1cc(ccc1Cl)OC(C)C 34a_100012186310_100000210206 [0,1,0,0,0,0|2,0,0]=3 2125 B13R1.52 COc1cc(ccc1Cl)OC(C)C 7a_100012186310_100000210206 [0,1,0,0,0,0|2,0,0]=3 2126 B13R1.52 COc1cc(ccc1Cl)SC(C)C 62a_100000210206_100011356853 [0,1,0,0,0,0|2,0,0]=3 2127 B13R1.52 COc1cc(ccc1Cl)SC(C)C 62a_100011356853_100000210206 [0,1,0,0,0,0|2,0,0]=3 2128 B13R1.52 COc1cc(ccc1F)C=C(C)C 271570a_100102525489_100011934186 [0,1,0,0,0,0|1,0,2]=4 2129 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,1,0,0,0,0|1,0,1]=3 2130 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,1,0,0,0,0|1,0,1]=3 2131 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,1,0,0,0,0|1,0,1]=3 2132 B13R1.52 COc1cc(ccc1F)CN(C)C 2230a_100102631434_100012349856 [0,1,0,0,0,0|2,0,0]=3 2133 B13R1.52 COc1cc(ccc1F)CN(C)C 269982a_100102631434_100012349856 [0,1,0,0,0,0|2,0,0]=3 2134 B13R1.52 COc1cc(ccc1F)CN(C)C 270004a_100102631434_100000692873 [0,1,0,0,0,0|2,0,0]=3 2135 B13R1.52 COc1cc(ccc1F)NC(=O)C 11a_100000701188_100015343762 [0,1,0,0,0,0|2,0,1]=4 2136 B13R1.52 COc1cc(ccc1F)NC(=O)C 1626a_100000701188_100015343762 [0,1,0,0,0,0|2,0,1]=4 2137 B13R1.52 COc1cc(ccc1F)NC(=O)C 22a_100000701188_100000070787 [0,1,0,0,0,0|2,0,1]=4 2138 B13R1.52 COc1cc(ccc1F)NC(=O)C 527a_100000701188_100103153847 [0,1,0,0,0,0|2,0,1]=4 2139 B13R1.52 COc1cc(ccc1F)NC(C)C 2230a_100000701188_100000210206 [0,1,0,0,0,0|2,0,0]=3 2140 B13R1.52 COc1cc(ccc1F)NC(C)C 34a_100000701188_100000210206 [0,1,0,0,0,0|2,0,0]=3 2141 B13R1.52 COc1cc(ccc1F)OC(C)C 34a_100012001760_100000210206 [0,1,0,0,0,0|2,0,0]=3 2142 B13R1.52 COc1cc(ccc1F)OC(C)C 7a_100012001760_100000210206 [0,1,0,0,0,0|2,0,0]=3 2143 B13R1.52 COc1cc(ccc1F)SC(C)C 62a_100000210206_100011934186 [0,1,0,0,0,0|2,0,0]=3 2144 B13R1.52 COc1cc(ccc1F)SC(C)C 62a_100011934186_100000210206 [0,1,0,0,0,0|2,0,0]=3 2145 B13R1.52 COc1cc(ccc1I)NC(=O)C 11a_100000746945_100015343762 [0,1,0,0,0,0|2,0,1]=4 2146 B13R1.52 COc1cc(ccc1I)NC(=O)C 1626a_100000746945_100015343762 [0,1,0,0,0,0|2,0,1]=4 2147 B13R1.52 COc1cc(ccc1I)NC(=O)C 22a_100000746945_100000070787 [0,1,0,0,0,0|2,0,1]=4 2148 B13R1.52 COc1cc(ccc1I)NC(=O)C 527a_100000746945_100103153847 [0,1,0,0,0,0|2,0,1]=4 2149 B13R1.52 COc1cc(ccc1I)NC(C)C 34a_100000746945_100000210206 [0,1,0,0,0,0|2,0,0]=3 2150 B13R1.52 COc1cc(ccc1N)C=C(C)C 271570a_100102525489_100011279103 [0,1,0,0,0,0|1,0,2]=4 2151 B13R1.52 COc1cc(ccc1N)OC(C)C 34a_100015326901_100000210206 [0,1,0,0,0,0|2,0,0]=3 2152 B13R1.52 COc1cc(ccc1N)OC(C)C 7a_100015326901_100000210206 [0,1,0,0,0,0|2,0,0]=3 2153 B13R1.52 COc1cc(ccc1N)SC(C)C 62a_100000210206_100015196925 [0,1,0,0,0,0|2,0,0]=3 2154 B13R1.52 COc1cc(ccc1N)SC(C)C 62a_100011279103_100000210206 [0,1,0,0,0,0|2,0,0]=3 2155 B13R1.52 COc1cc(ccc1O)C=C(C)C 271570a_100102525489_100000694246 [0,1,0,0,0,0|0,0,2]=3 2156 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,1,0,0,0,0|0,0,1]=2 2157 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,1,0,0,0,0|0,0,1]=2 2158 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [0,1,0,0,0,0|1,0,1]=3 2159 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [0,1,0,0,0,0|1,0,1]=3 2160 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [0,1,0,0,0,0|1,0,0]=2 2161 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [0,1,0,0,0,0|1,0,0]=2 2162 B13R1.52 COc1cc(cnc1C)SC(C)C 62a_100000210206_100010254219 [0,1,0,0,0,0|3,0,0]=4 2163 B13R1.52 COc1cc(cnc1C)SC(C)C 62a_100010254219_100000210206 [0,1,0,0,0,0|3,0,0]=4 2164 B13R1.52 COc1cc(cnc1F)SC(C)C 62a_100000210206_100010214931 [0,1,0,0,0,0|3,0,0]=4 2165 B13R1.52 COc1cc(cnc1F)SC(C)C 62a_100010214931_100000210206 [0,1,0,0,0,0|3,0,0]=4 2166 B13R1.52 COc1cc(cnc1N)SC(C)C 62a_100000210206_106354213024 [0,1,0,0,0,0|3,0,0]=4 2167 B13R1.52 COc1cc(cnc1N)SC(C)C 62a_106354213024_100000210206 [0,1,0,0,0,0|3,0,0]=4 2168 B13R1.52 COc1cc(ncc1C)SC(C)C 62a_100000210206_100010067687 [0,1,0,0,0,0|3,0,0]=4 2169 B13R1.52 COc1cc(ncc1C)SC(C)C 62a_100010067687_100000210206 [0,1,0,0,0,0|3,0,0]=4 2170 B13R1.52 COc1cc(ncc1F)SC(C)C 62a_100000210206_200010136270 [0,1,0,0,0,0|3,0,0]=4 2171 B13R1.52 COc1cc(ncc1F)SC(C)C 62a_200010136270_100000210206 [0,1,0,0,0,0|3,0,0]=4 2172 B13R1.52 COc1cc(ncc1N)SC(C)C 62a_100000210206_100009887741 [0,1,0,0,0,0|3,0,0]=4 2173 B13R1.52 COc1cc(ncc1N)SC(C)C 62a_100009887741_100000210206 [0,1,0,0,0,0|3,0,0]=4 2174 B13R1.52 COc1nc(ccc1Br)CC(=O)C 1458a_100000070787_200010066506 [0,1,0,0,0,0|2,0,1]=4 2175 B13R1.52 COc1nc(ccc1Br)CN(C)C 2230a_100102631434_200010066506 [0,1,0,0,0,0|3,0,0]=4 2176 B13R1.52 COc1nc(ccc1N)SC(C)C 62a_100000210206_100000687816 [0,1,0,0,0,0|3,0,0]=4 2177 B13R1.52 COc1nc(ccc1N)SC(C)C 62a_100000687816_100000210206 [0,1,0,0,0,0|3,0,0]=4 2178 B13R1.52 COc1nc(ccc1O)C=C(C)C 271570a_100102525489_100010893133 [0,1,0,0,0,0|1,0,2]=4 2179 B13R1.52 COc1nc(ccc1O)SC(C)C 62a_100000210206_100010893133 [0,1,0,0,0,0|2,0,0]=3 2180 B13R1.52 COc1nc(cnc1O)SC(C)C 62a_100000210206_200010365344 [0,1,0,0,0,0|3,0,0]=4 2181 B13R1.52 COc1nc(cnc1O)SC(C)C 62a_200010365344_100000210206 [0,1,0,0,0,0|3,0,0]=4 2182 B13R1.52 CSc1cc(ccc1C)OC(C)C 62a_200000210301_200010081138 [0,1,0,0,0,0|2,1,0]=4 2183 B13R1.52 CSc1cc(ccc1C)OC(C)C 62a_200010081138_200000210301 [0,1,0,0,0,0|2,1,0]=4 2184 B13R1.52 CSc1cc(ccc1F)SC(C)C 62a_100000210206_100010341305 [0,1,0,0,0,0|2,1,0]=4 2185 B13R1.52 CSc1cc(ccc1F)SC(C)C 62a_100010341305_100000210206 [0,1,0,0,0,0|2,1,0]=4 2186 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,1,0,0,0,0|0,1,1]=3 2187 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,1,0,0,0,0|0,1,1]=3 2188 B13R1.52 Cc1ccc(cc1S[13CH3])OC(C)C 62a_200010081138_200025704644 [0,1,0,0,0,0|2,1,0]=4 2189 B13R1.52 Cc1ccc(cc1S[13CH3])OC(C)C 62a_200025704644_200010081138 [0,1,0,0,0,0|2,1,0]=4 2190 B13R1.384 CC=Cc1cc(ccc1C)COC 271570a_100016259895_200015395492 [0,1,0,0,0,0|3,0,0]=4 2191 B13R1.384 CC=Cc1cc(ccc1C)OCC 271570a_100016259895_100011099959 [0,1,0,0,0,0|3,0,0]=4 2192 B13R1.384 CC=Cc1cc(ccc1F)COC 271570a_100016259895_200011493689 [0,1,0,0,0,0|3,0,0]=4 2193 B13R1.384 CC=Cc1ccc(c(c1)CNC)O 271570a_100016259895_100011602694 [0,1,0,0,0,0|1,0,2]=4 2194 B13R1.384 CC=Cc1ccc(c(c1)COC)Br 271570a_100016259895_202125822959 [0,1,0,0,0,0|1,0,2]=4 2195 B13R1.384 CC=Cc1ccc(c(c1)COC)F 271570a_100016259895_100010140362 [0,1,0,0,0,0|1,0,2]=4 2196 B13R1.384 CC=Cc1ccc(c(c1)OCC)C 271570a_100016259895_100012361169 [0,1,0,0,0,0|1,0,2]=4 2197 B13R1.384 CC=Cc1ccc(c(c1)OCC)F 271570a_100016259895_200012344967 [0,1,0,0,0,0|1,0,2]=4 2198 B13R1.384 CC=Cc1ccc(c(c1)OCC)N 271570a_100016259895_100000688918 [0,1,0,0,0,0|1,0,2]=4 2199 B13R1.384 CCNc1cc(ccc1Br)COC 34a_200013033220_100000210202 [0,1,0,0,0,0|3,0,0]=4 2200 B13R1.384 CCNc1cc(ccc1C)OCC 34a_100000211784_100000210202 [0,1,0,0,0,0|3,0,0]=4 2201 B13R1.384 CCNc1cc(ccc1C)OCC 7a_100000211784_100000210202 [0,1,0,0,0,0|3,0,0]=4 2202 B13R1.384 CCNc1cc(ccc1N)SCC 62a_100000210202_100000696630 [0,1,0,0,0,0|3,0,0]=4 2203 B13R1.384 CCNc1cc(ccc1N)SCC 62a_100000696630_100000210202 [0,1,0,0,0,0|3,0,0]=4 2204 B13R1.384 CCNc1ccc(c(c1)OCC)Br 2230a_200016990551_100000210202 [0,1,0,0,0,0|2,0,0]=3 2205 B13R1.384 CCNc1ccc(c(c1)OCC)Br 34a_200016990551_100000210202 [0,1,0,0,0,0|2,0,0]=3 2206 B13R1.384 CCNc1ccc(c(c1)OCC)Br 7a_200016990551_100000210202 [0,1,0,0,0,0|2,0,0]=3 2207 B13R1.384 CCNc1ccc(c(c1)OCC)Cl 2230a_100011964961_100000210202 [0,1,0,0,0,0|2,0,0]=3 2208 B13R1.384 CCNc1ccc(c(c1)OCC)Cl 34a_100011964961_100000210202 [0,1,0,0,0,0|2,0,0]=3 2209 B13R1.384 CCOc1cc(ccc1Br)CNC 207a_100102657272_200010381951 [0,1,0,0,0,0|2,0,0]=3 2210 B13R1.384 CCOc1cc(ccc1Br)CNC 270004a_106832991635_200010381951 [0,1,0,0,0,0|2,0,0]=3 2211 B13R1.384 CCOc1cc(ccc1Br)NCF 34a_200016990551_100015361967 [0,1,0,0,0,0|3,0,0]=4 2212 B13R1.384 CCOc1cc(ccc1Br)NCF 7a_200016990551_100015361967 [0,1,0,0,0,0|3,0,0]=4 2213 B13R1.384 CCOc1cc(ccc1C)SCC 62a_100000210202_100012361169 [0,1,0,0,0,0|2,0,0]=3 2214 B13R1.384 CCOc1cc(ccc1C)SCC 62a_100012361169_100000210202 [0,1,0,0,0,0|2,0,0]=3 2215 B13R1.384 CCOc1cc(ccc1C)SCF 62a_100012361169_100015361967 [0,1,0,0,0,0|3,0,0]=4 2216 B13R1.384 CCOc1cc(ccc1C)SCF 62a_100015361967_100012361169 [0,1,0,0,0,0|3,0,0]=4 2217 B13R1.384 CCOc1cc(ccc1Cl)NCF 34a_100011964961_100015361967 [0,1,0,0,0,0|3,0,0]=4 2218 B13R1.384 CCOc1cc(ccc1F)CNC 207a_100102657272_200000106648 [0,1,0,0,0,0|2,0,0]=3 2219 B13R1.384 CCOc1cc(ccc1F)CNC 270004a_106832991635_200000106648 [0,1,0,0,0,0|2,0,0]=3 2220 B13R1.384 CCOc1cc(ccc1F)SCC 62a_100000210202_200012344967 [0,1,0,0,0,0|2,0,0]=3 2221 B13R1.384 CCOc1cc(ccc1F)SCC 62a_200012344967_100000210202 [0,1,0,0,0,0|2,0,0]=3 2222 B13R1.384 CCOc1cc(ccc1F)SCF 62a_100015361967_200012344967 [0,1,0,0,0,0|3,0,0]=4 2223 B13R1.384 CCOc1cc(ccc1F)SCF 62a_200012344967_100015361967 [0,1,0,0,0,0|3,0,0]=4 2224 B13R1.384 CCOc1cc(ccc1N)SCC 62a_100000688918_100000210202 [0,1,0,0,0,0|2,0,0]=3 2225 B13R1.384 CCOc1cc(ccc1N)SCF 62a_100000688918_100015361967 [0,1,0,0,0,0|3,0,0]=4 2226 B13R1.384 CCOc1cc(ccc1O)CNC 34a_200000751567_200000210301 [0,1,0,0,0,0|1,0,0]=2 2227 B13R1.384 CCOc1cc(ccc1O)CN[13CH3] 34a_200000751567_200025704644 [0,1,0,0,0,0|1,0,0]=2 2228 B13R1.384 CCOc1cc(cnc1F)SCC 62a_100000210202_100010732568 [0,1,0,0,0,0|3,0,0]=4 2229 B13R1.384 CCOc1cc(cnc1F)SCC 62a_100010732568_100000210202 [0,1,0,0,0,0|3,0,0]=4 2230 B13R1.384 CCOc1cc(ncc1N)SCC 62a_100000210202_100015764953 [0,1,0,0,0,0|3,0,0]=4 2231 B13R1.384 CCOc1cc(ncc1N)SCC 62a_100015764953_100000210202 [0,1,0,0,0,0|3,0,0]=4 2232 B13R1.384 CCOc1ccc(c(c1)CNC)Br 207a_100102657272_100012345016 [0,1,0,0,0,0|3,0,0]=4 2233 B13R1.384 CCOc1ccc(c(c1)CNC)Br 270004a_106832991635_100012345016 [0,1,0,0,0,0|3,0,0]=4 2234 B13R1.384 CCOc1ccc(c(c1)CNC)F 207a_100102657272_200010630724 [0,1,0,0,0,0|3,0,0]=4 2235 B13R1.384 CCOc1ccc(c(c1)CNC)F 270004a_106832991635_200010630724 [0,1,0,0,0,0|3,0,0]=4 2236 B13R1.384 CCOc1ccc(c(c1)SCC)C 62a_100000210202_100011099959 [0,1,0,0,0,0|2,1,0]=4 2237 B13R1.384 CCOc1ccc(c(c1)SCF)C 62a_100015361967_100011099959 [0,1,0,0,0,0|2,1,0]=4 2238 B13R1.384 CCOc1ccc(c(n1)OCC)O 271570a_203496583355_200010081131 [0,1,0,0,0,0|2,0,0]=3 2239 B13R1.384 CCSc1cc(ccc1C)COC 62a_100000210202_200015395492 [0,1,0,0,0,0|2,1,0]=4 2240 B13R1.384 CCSc1cc(ccc1C)COC 62a_200015395492_100000210202 [0,1,0,0,0,0|2,1,0]=4 2241 B13R1.384 CCSc1cc(ccc1F)COC 62a_100000210202_200011493689 [0,1,0,0,0,0|2,1,0]=4 2242 B13R1.384 CCSc1cc(ccc1F)COC 62a_200011493689_100000210202 [0,1,0,0,0,0|2,1,0]=4 2243 B13R1.384 CCSc1ccc(c(c1)CNC)C 62a_100000210202_106744473289 [0,1,0,0,0,0|3,0,0]=4 2244 B13R1.384 CCSc1ccc(c(c1)CNC)C 62a_106744473289_100000210202 [0,1,0,0,0,0|3,0,0]=4 2245 B13R1.384 CCSc1ccc(c(c1)CNC)F 62a_100000210202_100000748472 [0,1,0,0,0,0|3,0,0]=4 2246 B13R1.384 CCSc1ccc(c(c1)CNC)F 62a_100000748472_100000210202 [0,1,0,0,0,0|3,0,0]=4 2247 B13R1.384 CCSc1ccc(c(c1)CNC)O 62a_100000210202_100011602694 [0,1,0,0,0,0|2,0,0]=3 2248 B13R1.384 CCSc1ccc(c(c1)CNC)O 62a_100011602694_100000210202 [0,1,0,0,0,0|2,0,0]=3 2249 B13R1.384 CCSc1ccc(c(c1)COC)Br 62a_100000210202_202125822959 [0,1,0,0,0,0|2,0,0]=3 2250 B13R1.384 CCSc1ccc(c(c1)COC)Br 62a_202125822959_100000210202 [0,1,0,0,0,0|2,0,0]=3 2251 B13R1.384 CCSc1ccc(c(c1)COC)F 62a_100000210202_100010140362 [0,1,0,0,0,0|2,0,0]=3 2252 B13R1.384 CCSc1ccc(c(c1)COC)F 62a_100010140362_100000210202 [0,1,0,0,0,0|2,0,0]=3 2253 B13R1.384 CNCc1cc(ccc1O)SCF 62a_100011602694_100015361967 [0,1,0,0,0,0|3,0,0]=4 2254 B13R1.384 CNCc1cc(ccc1O)SCF 62a_100015361967_100011602694 [0,1,0,0,0,0|3,0,0]=4 2255 B13R1.384 COCc1cc(ccc1Br)SCF 62a_100015361967_202125822959 [0,1,0,0,0,0|3,0,0]=4 2256 B13R1.384 COCc1cc(ccc1Br)SCF 62a_202125822959_100015361967 [0,1,0,0,0,0|3,0,0]=4 2257 B13R1.384 COCc1cc(ccc1F)SCF 62a_100010140362_100015361967 [0,1,0,0,0,0|3,0,0]=4 2258 B13R1.384 COCc1cc(ccc1F)SCF 62a_100015361967_100010140362 [0,1,0,0,0,0|3,0,0]=4 2259 B13R1.384 COCc1ccc(c(c1)NCF)Br 34a_200013033220_100015361967 [0,1,0,0,0,0|3,0,0]=4 2260 B13R1.384 COCc1ccc(c(c1)SCF)C 62a_100015361967_200015395492 [0,1,0,0,0,0|2,1,0]=4 2261 B13R1.384 COCc1ccc(c(c1)SCF)C 62a_200015395492_100015361967 [0,1,0,0,0,0|2,1,0]=4 2262 B13R1.384 COCc1ccc(c(c1)SCF)F 62a_100015361967_200011493689 [0,1,0,0,0,0|2,1,0]=4 2263 B13R1.384 COCc1ccc(c(c1)SCF)F 62a_200011493689_100015361967 [0,1,0,0,0,0|2,1,0]=4 2264 B13R1.386 C=C=Cc1ccc(c(c1)OC)CO 271570a_100015277604_100011277633 [0,1,0,0,0,0|0,0,3]=4 2265 B13R1.386 C=C=Cc1ccc(c(c1)OC)OC 271570a_100015277604_100000187503 [0,1,0,0,0,0|0,0,3]=4 2266 B13R1.386 C=CCc1ccc(c(c1)OC)OC 34a_100000181329_200000210301 [0,1,0,0,0,0|0,0,2]=3 2267 B13R1.386 C=CCc1ccc(c(c1)OC)O[13CH3] 34a_100000181329_200025704644 [0,1,0,0,0,0|0,0,2]=3 2268 B13R1.386 C=Cc1cc(ccc1OC)CCN 271570a_100011290941_103549771065 [0,1,0,0,0,0|2,0,1]=4 2269 B13R1.386 C=Cc1cc(ccc1OC)CCO 271570a_100011290941_100011962876 [0,1,0,0,0,0|2,0,1]=4 2270 B13R1.386 C=Cc1ccc(cc1OC)CC#N 271570a_100011290941_100010176002 [0,1,0,0,0,0|2,0,1]=4 2271 B13R1.386 CC=Cc1cc(c(cn1)CO)OC 271570a_100016259895_100010714672 [0,1,0,0,0,0|1,0,2]=4 2272 B13R1.386 CC=Cc1ccc(c(c1)CC)OC 271570a_100016259895_200010179862 [0,1,0,0,0,0|1,0,2]=4 2273 B13R1.386 CC=Cc1ccc(c(c1)OC)C#N 271570a_100016259895_100000694671 [0,1,0,0,0,0|1,0,2]=4 2274 B13R1.386 CC=Cc1ccc(c(c1)OC)C=O 271570a_100016259895_100000697075 [0,1,0,0,0,0|0,0,3]=4 2275 B13R1.386 CC=Cc1ccc(c(c1)OC)CC 271570a_100016259895_200010710398 [0,1,0,0,0,0|1,0,2]=4 2276 B13R1.386 CC=Cc1ccc(c(c1)OC)CO 271570a_100016259895_100011277633 [0,1,0,0,0,0|0,0,2]=3 2277 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 271570a_100016259895_100000187503 [0,1,0,0,0,0|0,0,2]=3 2278 B13R1.386 CC=Cc1ccc(c(c1)OC)OC 34a_100015195088_200000210301 [0,1,0,0,0,0|0,0,2]=3 2279 B13R1.386 CC=Cc1ccc(c(c1)OC)O[13CH3] 34a_100015195088_200025704644 [0,1,0,0,0,0|0,0,2]=3 2280 B13R1.386 CC=Cc1ccc(c(c1)OC)SC 271570a_100016259895_200011001119 [0,1,0,0,0,0|0,1,2]=4 2281 B13R1.386 CC=Cc1ccc(c(c1)SC)OC 271570a_100016259895_200009892704 [0,1,0,0,0,0|0,1,2]=4 2282 B13R1.386 CC=Cc1ccc(c(n1)OC)CO 271570a_100016259895_100010988397 [0,1,0,0,0,0|1,0,2]=4 2283 B13R1.386 CC=Cc1ccc(c(n1)OC)OC 271570a_100016259895_100010214848 [0,1,0,0,0,0|1,0,2]=4 2284 B13R1.386 CC=Cc1cnc(c(c1)OC)CO 271570a_100016259895_200010246159 [0,1,0,0,0,0|1,0,2]=4 2285 B13R1.386 CC=Cc1cnc(c(c1)OC)OC 271570a_100016259895_100010234541 [0,1,0,0,0,0|1,0,2]=4 2286 B13R1.386 CCCc1ccc(c(c1)OC)OC 34a_100000012292_200000210301 [0,1,0,0,0,0|0,0,0]=1 2287 B13R1.386 CCCc1ccc(c(c1)OC)OC 7a_100000012292_200000210301 [0,1,0,0,0,0|0,0,0]=1 2288 B13R1.386 CCCc1ccc(c(c1)OC)O[13CH3] 34a_100000012292_200025704644 [0,1,0,0,0,0|0,0,0]=1 2289 B13R1.386 CCCc1ccc(c(c1)OC)O[13CH3] 7a_100000012292_200025704644 [0,1,0,0,0,0|0,0,0]=1 2290 B13R1.386 CCNc1cc(c(cn1)C#N)OC 27a_100015525214_100009830018 [0,1,0,0,0,0|3,0,0]=4 2291 B13R1.386 CCNc1ccc(c(c1)C#N)OC 34a_100011204338_100000210202 [0,1,0,0,0,0|3,0,0]=4 2292 B13R1.386 CCNc1ccc(c(c1)C#N)OC 7a_100011204338_100000210202 [0,1,0,0,0,0|3,0,0]=4 2293 B13R1.386 CCNc1ccc(c(c1)OC)C#N 34a_100011999456_100000210202 [0,1,0,0,0,0|2,0,0]=3 2294 B13R1.386 CCNc1ccc(c(c1)OC)CO 34a_100012183141_100000210202 [0,1,0,0,0,0|1,0,0]=2 2295 B13R1.386 CCNc1ccc(c(c1)OC)OC 34a_100000187404_100000210202 [0,1,0,0,0,0|1,0,0]=2 2296 B13R1.386 CCNc1ccc(c(n1)OC)C#N 27a_100015525214_100010136633 [0,1,0,0,0,0|3,0,0]=4 2297 B13R1.386 CCNc1ncc(c(n1)OC)CO 27a_100015525214_200011024631 [0,1,0,0,0,0|3,0,0]=4 2298 B13R1.386 CCOc1ccc(c(c1)OC)CO 34a_200000116926_100000210202 [0,1,0,0,0,0|1,0,0]=2 2299 B13R1.386 CCOc1ccc(c(c1)OC)OC 34a_100000039706_100000210202 [0,1,0,0,0,0|1,0,0]=2 2300 B13R1.386 CCOc1ccc(c(c1)SC)C=O 62a_200000210301_200012721597 [0,1,0,0,0,0|1,1,1]=4 2301 B13R1.386 CCOc1ccc(c(c1)SC)C=O 62a_200012721597_200000210301 [0,1,0,0,0,0|1,1,1]=4 2302 B13R1.386 CCOc1ccc(c(c1)S[13CH3])C=O 62a_200012721597_200025704644 [0,1,0,0,0,0|1,1,1]=4 2303 B13R1.386 CCOc1ccc(c(c1)S[13CH3])C=O 62a_200025704644_200012721597 [0,1,0,0,0,0|1,1,1]=4 2304 B13R1.386 CCSc1cc(c(cn1)C#N)OC 62a_100000210202_100009830018 [0,1,0,0,0,0|3,0,0]=4 2305 B13R1.386 CCSc1cc(c(cn1)C=O)OC 62a_100000210202_100009846838 [0,1,0,0,0,0|2,0,1]=4 2306 B13R1.386 CCSc1cc(c(cn1)C=O)OC 62a_100009846838_100000210202 [0,1,0,0,0,0|2,0,1]=4 2307 B13R1.386 CCSc1cc(c(cn1)CO)OC 62a_100000210202_100010714672 [0,1,0,0,0,0|2,0,0]=3 2308 B13R1.386 CCSc1cc(c(cn1)CO)OC 62a_100010714672_100000210202 [0,1,0,0,0,0|2,0,0]=3 2309 B13R1.386 CCSc1cc(c(nn1)OC)OC 62a_100000210202_200000095610 [0,1,0,0,0,0|3,0,0]=4 2310 B13R1.386 CCSc1ccc(c(c1)C#N)OC 62a_100000210202_100000188252 [0,1,0,0,0,0|3,0,0]=4 2311 B13R1.386 CCSc1ccc(c(c1)C=O)OC 62a_100000170026_100000210202 [0,1,0,0,0,0|3,0,0]=4 2312 B13R1.386 CCSc1ccc(c(c1)C=O)OC 62a_100000210202_100000170026 [0,1,0,0,0,0|3,0,0]=4 2313 B13R1.386 CCSc1ccc(c(c1)CC)C=O 62a_100000210202_100010209654 [0,1,0,0,0,0|2,0,1]=4 2314 B13R1.386 CCSc1ccc(c(c1)CC)C=O 62a_100010209654_100000210202 [0,1,0,0,0,0|2,0,1]=4 2315 B13R1.386 CCSc1ccc(c(c1)CC)NN 62a_100000210202_100000700371 [0,1,0,0,0,0|3,0,0]=4 2316 B13R1.386 CCSc1ccc(c(c1)CC)NN 62a_100000700371_100000210202 [0,1,0,0,0,0|3,0,0]=4 2317 B13R1.386 CCSc1ccc(c(c1)CC)OC 62a_100000210202_200010179862 [0,1,0,0,0,0|2,0,0]=3 2318 B13R1.386 CCSc1ccc(c(c1)CC)OC 62a_200010179862_100000210202 [0,1,0,0,0,0|2,0,0]=3 2319 B13R1.386 CCSc1ccc(c(c1)CN)OC 62a_100000210202_100000690498 [0,1,0,0,0,0|3,0,0]=4 2320 B13R1.386 CCSc1ccc(c(c1)CN)OC 62a_100000690498_100000210202 [0,1,0,0,0,0|3,0,0]=4 2321 B13R1.386 CCSc1ccc(c(c1)CO)CO 62a_100000210202_100000719600 [0,1,0,0,0,0|3,0,0]=4 2322 B13R1.386 CCSc1ccc(c(c1)CO)CO 62a_100000719600_100000210202 [0,1,0,0,0,0|3,0,0]=4 2323 B13R1.386 CCSc1ccc(c(c1)CO)OC 62a_100000204679_100000210202 [0,1,0,0,0,0|3,0,0]=4 2324 B13R1.386 CCSc1ccc(c(c1)CO)OC 62a_100000210202_100000204679 [0,1,0,0,0,0|3,0,0]=4 2325 B13R1.386 CCSc1ccc(c(c1)NC)C#N 62a_100000210202_200012356631 [0,1,0,0,0,0|3,0,0]=4 2326 B13R1.386 CCSc1ccc(c(c1)OC)C#N 62a_100000210202_100000694671 [0,1,0,0,0,0|2,0,0]=3 2327 B13R1.386 CCSc1ccc(c(c1)OC)C=O 62a_100000210202_100010290300 [0,1,0,0,0,0|1,0,1]=3 2328 B13R1.386 CCSc1ccc(c(c1)OC)C=O 62a_100000697075_100000210202 [0,1,0,0,0,0|1,0,1]=3 2329 B13R1.386 CCSc1ccc(c(c1)OC)CC 62a_100000210202_200010710398 [0,1,0,0,0,0|2,0,0]=3 2330 B13R1.386 CCSc1ccc(c(c1)OC)CC 62a_200010710398_100000210202 [0,1,0,0,0,0|2,0,0]=3 2331 B13R1.386 CCSc1ccc(c(c1)OC)CO 62a_100000210202_100011277633 [0,1,0,0,0,0|1,0,0]=2 2332 B13R1.386 CCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210202 [0,1,0,0,0,0|1,0,0]=2 2333 B13R1.386 CCSc1ccc(c(c1)OC)OC 62a_100000210202_100011356967 [0,1,0,0,0,0|1,0,0]=2 2334 B13R1.386 CCSc1ccc(c(c1)OC)SC 62a_200011001119_100000210202 [0,1,0,0,0,0|1,1,0]=3 2335 B13R1.386 CCSc1ccc(c(c1)SC)OC 62a_200009892704_100000210202 [0,1,0,0,0,0|1,1,0]=3 2336 B13R1.386 CCSc1ccc(c(n1)OC)C#N 62a_100000210202_100000708423 [0,1,0,0,0,0|3,0,0]=4 2337 B13R1.386 CCSc1ccc(c(n1)OC)C=O 62a_100000210202_100009864722 [0,1,0,0,0,0|2,0,1]=4 2338 B13R1.386 CCSc1ccc(c(n1)OC)C=O 62a_100009864722_100000210202 [0,1,0,0,0,0|2,0,1]=4 2339 B13R1.386 CCSc1ccc(c(n1)OC)CN 62a_100000210202_100015687481 [0,1,0,0,0,0|3,0,0]=4 2340 B13R1.386 CCSc1ccc(c(n1)OC)CN 62a_100015687481_100000210202 [0,1,0,0,0,0|3,0,0]=4 2341 B13R1.386 CCSc1ccc(c(n1)OC)CO 62a_100000210202_100010988397 [0,1,0,0,0,0|2,0,0]=3 2342 B13R1.386 CCSc1ccc(c(n1)OC)CO 62a_100010988397_100000210202 [0,1,0,0,0,0|2,0,0]=3 2343 B13R1.386 CCSc1ccc(c(n1)OC)OC 62a_100000210202_100010214848 [0,1,0,0,0,0|2,0,0]=3 2344 B13R1.386 CCSc1cnc(c(c1)OC)C#N 62a_100000210202_100000719880 [0,1,0,0,0,0|3,0,0]=4 2345 B13R1.386 CCSc1cnc(c(c1)OC)C=O 62a_100000210202_100010246152 [0,1,0,0,0,0|2,0,1]=4 2346 B13R1.386 CCSc1cnc(c(c1)OC)C=O 62a_100010246152_100000210202 [0,1,0,0,0,0|2,0,1]=4 2347 B13R1.386 CCSc1cnc(c(c1)OC)CO 62a_100000210202_200010246159 [0,1,0,0,0,0|2,0,0]=3 2348 B13R1.386 CCSc1cnc(c(c1)OC)CO 62a_200010246159_100000210202 [0,1,0,0,0,0|2,0,0]=3 2349 B13R1.386 CCSc1cnc(c(c1)OC)OC 62a_100000210202_100010234541 [0,1,0,0,0,0|2,0,0]=3 2350 B13R1.386 CCSc1cnc(c(n1)OC)OC 62a_100000210202_100010132954 [0,1,0,0,0,0|3,0,0]=4 2351 B13R1.386 CCSc1cnc(c(n1)OC)OC 62a_100010132954_100000210202 [0,1,0,0,0,0|3,0,0]=4 2352 B13R1.386 CCSc1ncc(c(n1)OC)CO 62a_100000210202_200011024631 [0,1,0,0,0,0|3,0,0]=4 2353 B13R1.386 CCSc1ncc(c(n1)OC)CO 62a_200011024631_100000210202 [0,1,0,0,0,0|3,0,0]=4 2354 B13R1.386 CCSc1ncc(c(n1)OC)OC 62a_100000210202_100010280452 [0,1,0,0,0,0|3,0,0]=4 2355 B13R1.386 CCc1cc(ccc1OC)SCF 62a_100015361967_200010179862 [0,1,0,0,0,0|3,0,0]=4 2356 B13R1.386 CCc1cc(ccc1OC)SCF 62a_200010179862_100015361967 [0,1,0,0,0,0|3,0,0]=4 2357 B13R1.386 CCc1ccc(cc1OC)SCF 62a_100015361967_200010710398 [0,1,0,0,0,0|3,0,0]=4 2358 B13R1.386 CCc1ccc(cc1OC)SCF 62a_200010710398_100015361967 [0,1,0,0,0,0|3,0,0]=4 2359 B13R1.386 CNCc1ccc(c(c1)CO)OC 207a_100102657272_100011361677 [0,1,0,0,0,0|3,0,0]=4 2360 B13R1.386 CNCc1ccc(c(c1)CO)OC 270004a_106832991635_100011361677 [0,1,0,0,0,0|3,0,0]=4 2361 B13R1.386 CNCc1ccc(c(c1)OC)C#N 207a_100102657272_100000726430 [0,1,0,0,0,0|2,0,0]=3 2362 B13R1.386 CNCc1ccc(c(c1)OC)C#N 270004a_106832991635_100000726430 [0,1,0,0,0,0|2,0,0]=3 2363 B13R1.386 CNCc1ccc(c(c1)OC)OC 207a_100102657272_100000170513 [0,1,0,0,0,0|1,0,0]=2 2364 B13R1.386 CNCc1ccc(c(c1)OC)OC 2230a_106832991635_100011233839 [0,1,0,0,0,0|1,0,0]=2 2365 B13R1.386 CNCc1ccc(c(c1)OC)OC 270004a_106832991635_100000170513 [0,1,0,0,0,0|1,0,0]=2 2366 B13R1.386 CNCc1ccc(c(c1)OC)OC 34a_100000185555_200000210301 [0,1,0,0,0,0|1,0,0]=2 2367 B13R1.386 CNCc1ccc(c(c1)OC)OC 34a_100000188468_200000210301 [0,1,0,0,0,0|1,0,0]=2 2368 B13R1.386 CNCc1ccc(c(c1)OC)SC 207a_100102657272_100000050949 [0,1,0,0,0,0|1,1,0]=3 2369 B13R1.386 CNCc1ccc(c(c1)OC)SC 270004a_106832991635_100000050949 [0,1,0,0,0,0|1,1,0]=3 2370 B13R1.386 CNCc1ccc(c(c1)O[13CH3])OC 34a_100000188468_200025704644 [0,1,0,0,0,0|1,0,0]=2 2371 B13R1.386 CNCc1cnc(c(c1)OC)OC 207a_100102657272_100000117638 [0,1,0,0,0,0|2,0,0]=3 2372 B13R1.386 CNCc1cnc(c(c1)OC)OC 270004a_106832991635_100000117638 [0,1,0,0,0,0|2,0,0]=3 2373 B13R1.386 COCc1ccc(c(c1)OC)OC 34a_100000210929_200000210301 [0,1,0,0,0,0|1,0,0]=2 2374 B13R1.386 COc1cc(ccc1C#N)NCF 34a_100011999456_100015361967 [0,1,0,0,0,0|3,0,0]=4 2375 B13R1.386 COc1cc(ccc1C#N)SCF 62a_100015361967_100000694671 [0,1,0,0,0,0|3,0,0]=4 2376 B13R1.386 COc1cc(ccc1C=O)SCF 62a_100000697075_100015361967 [0,1,0,0,0,0|2,0,1]=4 2377 B13R1.386 COc1cc(ccc1C=O)SCF 62a_100015361967_100010290300 [0,1,0,0,0,0|2,0,1]=4 2378 B13R1.386 COc1cc(ccc1CO)NCF 34a_100012183141_100015361967 [0,1,0,0,0,0|2,0,0]=3 2379 B13R1.386 COc1cc(ccc1CO)OCF 34a_200000116926_100015361967 [0,1,0,0,0,0|2,0,0]=3 2380 B13R1.386 COc1cc(ccc1CO)SCF 62a_100011277633_100015361967 [0,1,0,0,0,0|2,0,0]=3 2381 B13R1.386 COc1cc(ccc1CO)SCF 62a_100015361967_100011277633 [0,1,0,0,0,0|2,0,0]=3 2382 B13R1.386 COc1cc(ccc1O[13CH3])CC#N 34a_100000032377_200025704644 [0,1,0,0,0,0|1,0,1]=3 2383 B13R1.386 COc1cc(ccc1O[13CH3])CCBr 34a_100010741665_200025704644 [0,1,0,0,0,0|1,0,0]=2 2384 B13R1.386 COc1cc(ccc1O[13CH3])CCBr 7a_100010741665_200025704644 [0,1,0,0,0,0|1,0,0]=2 2385 B13R1.386 COc1cc(ccc1O[13CH3])CCN 34a_100000756042_200025704644 [0,1,0,0,0,0|1,0,0]=2 2386 B13R1.386 COc1cc(ccc1O[13CH3])CCO 34a_100011215244_200025704644 [0,1,0,0,0,0|1,0,0]=2 2387 B13R1.386 COc1cc(ccc1SC)CC#N 62a_100010176002_200000210301 [0,1,0,0,0,0|1,1,1]=4 2388 B13R1.386 COc1cc(ccc1SC)CC#N 62a_200000210301_100010176002 [0,1,0,0,0,0|1,1,1]=4 2389 B13R1.386 COc1cc(ccc1SC)SCF 62a_200011001119_100015361967 [0,1,0,0,0,0|2,1,0]=4 2390 B13R1.386 COc1cc(ccc1S[13CH3])CC#N 62a_100010176002_200025704644 [0,1,0,0,0,0|1,1,1]=4 2391 B13R1.386 COc1cc(ccc1S[13CH3])CC#N 62a_200025704644_100010176002 [0,1,0,0,0,0|1,1,1]=4 2392 B13R1.386 COc1cc(cnc1CO)SCF 62a_100015361967_200010246159 [0,1,0,0,0,0|3,0,0]=4 2393 B13R1.386 COc1cc(cnc1CO)SCF 62a_200010246159_100015361967 [0,1,0,0,0,0|3,0,0]=4 2394 B13R1.386 COc1cc(cnc1OC)SCF 62a_100015361967_100010234541 [0,1,0,0,0,0|3,0,0]=4 2395 B13R1.386 COc1cc(ncc1CO)SCF 62a_100010714672_100015361967 [0,1,0,0,0,0|3,0,0]=4 2396 B13R1.386 COc1cc(ncc1CO)SCF 62a_100015361967_100010714672 [0,1,0,0,0,0|3,0,0]=4 2397 B13R1.386 COc1ccc(cc1OC)CC#N 34a_100000032377_200000210301 [0,1,0,0,0,0|1,0,1]=3 2398 B13R1.386 COc1ccc(cc1OC)CCBr 34a_100010741665_200000210301 [0,1,0,0,0,0|1,0,0]=2 2399 B13R1.386 COc1ccc(cc1OC)CCBr 7a_100010741665_200000210301 [0,1,0,0,0,0|1,0,0]=2 2400 B13R1.386 COc1ccc(cc1OC)CCN 34a_100000756042_200000210301 [0,1,0,0,0,0|1,0,0]=2 2401 B13R1.386 COc1ccc(cc1OC)CCN 34a_100011207234_200000210301 [0,1,0,0,0,0|1,0,0]=2 2402 B13R1.386 COc1ccc(cc1OC)CCO 34a_100011215244_200000210301 [0,1,0,0,0,0|1,0,0]=2 2403 B13R1.386 COc1ccc(cc1OC)CN[13CH3] 34a_100000185555_200025704644 [0,1,0,0,0,0|1,0,0]=2 2404 B13R1.386 COc1ccc(cc1OC)CO[13CH3] 34a_100000210929_200025704644 [0,1,0,0,0,0|1,0,0]=2 2405 B13R1.386 COc1ccc(cc1OC)CSC 62a_200000210301_100011233839 [0,1,0,0,0,0|1,0,0]=2 2406 B13R1.386 COc1ccc(cc1OC)CS[13CH3] 62a_200025704644_100011233839 [0,1,0,0,0,0|1,0,0]=2 2407 B13R1.386 COc1ccc(cc1OC)NCF 34a_100000187404_100015361967 [0,1,0,0,0,0|2,0,0]=3 2408 B13R1.386 COc1ccc(cc1OC)OCF 34a_100000039706_100015361967 [0,1,0,0,0,0|2,0,0]=3 2409 B13R1.386 COc1ccc(cc1OC)SCF 62a_100015361967_100011356967 [0,1,0,0,0,0|2,0,0]=3 2410 B13R1.386 COc1ccc(cc1O[13CH3])CCN 34a_100011207234_200025704644 [0,1,0,0,0,0|1,0,0]=2 2411 B13R1.386 COc1ccc(cc1SC)CC#N 62a_100011215974_200000210301 [0,1,0,0,0,0|1,1,1]=4 2412 B13R1.386 COc1ccc(cc1SC)CC#N 62a_200000210301_100011215974 [0,1,0,0,0,0|1,1,1]=4 2413 B13R1.386 COc1ccc(cc1SC)CCN 62a_103549771065_200000210301 [0,1,0,0,0,0|1,1,0]=3 2414 B13R1.386 COc1ccc(cc1SC)CCN 62a_200000210301_103549771065 [0,1,0,0,0,0|1,1,0]=3 2415 B13R1.386 COc1ccc(cc1SC)CCO 62a_100011962876_200000210301 [0,1,0,0,0,0|1,1,0]=3 2416 B13R1.386 COc1ccc(cc1SC)CCO 62a_200000210301_100011962876 [0,1,0,0,0,0|1,1,0]=3 2417 B13R1.386 COc1ccc(cc1SC)SCF 62a_200009892704_100015361967 [0,1,0,0,0,0|2,1,0]=4 2418 B13R1.386 COc1ccc(cc1S[13CH3])CC#N 62a_100011215974_200025704644 [0,1,0,0,0,0|1,1,1]=4 2419 B13R1.386 COc1ccc(cc1S[13CH3])CC#N 62a_200025704644_100011215974 [0,1,0,0,0,0|1,1,1]=4 2420 B13R1.386 COc1ccc(cc1S[13CH3])CCN 62a_103549771065_200025704644 [0,1,0,0,0,0|1,1,0]=3 2421 B13R1.386 COc1ccc(cc1S[13CH3])CCN 62a_200025704644_103549771065 [0,1,0,0,0,0|1,1,0]=3 2422 B13R1.386 COc1ccc(cc1S[13CH3])CCO 62a_100011962876_200025704644 [0,1,0,0,0,0|1,1,0]=3 2423 B13R1.386 COc1ccc(cc1S[13CH3])CCO 62a_200025704644_100011962876 [0,1,0,0,0,0|1,1,0]=3 2424 B13R1.386 COc1ccc(nc1OC)SCF 62a_100015361967_100010214848 [0,1,0,0,0,0|3,0,0]=4 2425 B13R1.386 COc1nc(ccc1CO)SCF 62a_100010988397_100015361967 [0,1,0,0,0,0|3,0,0]=4 2426 B13R1.386 COc1nc(ccc1CO)SCF 62a_100015361967_100010988397 [0,1,0,0,0,0|3,0,0]=4 2427 B13R1.387 C=C(C)c1cc(ccc1C)COC 271570a_100000694244_200015395492 [0,1,0,0,0,0|3,0,0]=4 2428 B13R1.387 C=C(C)c1cc(ccc1C)OCC 271570a_100000694244_100011099959 [0,1,0,0,0,0|3,0,0]=4 2429 B13R1.387 C=C(C)c1cc(ccc1F)COC 271570a_100000694244_200011493689 [0,1,0,0,0,0|3,0,0]=4 2430 B13R1.387 CC(C)c1cc(ccc1O)SCF 62a_100000691460_100015361967 [0,1,0,0,0,0|3,0,0]=4 2431 B13R1.387 CC(C)c1cc(ccc1O)SCF 62a_100015361967_100000691460 [0,1,0,0,0,0|3,0,0]=4 2432 B13R1.387 CC=Cc1ccc(c(c1)C(=O)C)O 271570a_100016259895_100000212127 [0,1,0,0,0,0|1,0,2]=4 2433 B13R1.387 CC=Cc1ccc(c(c1)C(C)C)O 271570a_100016259895_100000691460 [0,1,0,0,0,0|1,0,2]=4 2434 B13R1.387 CCNc1ccc(c(c1)N(C)C)C 34a_100011708272_100000210202 [0,1,0,0,0,0|3,0,0]=4 2435 B13R1.387 CCOc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_100000210202 [0,1,0,0,0,0|3,0,0]=4 2436 B13R1.387 CCOc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_100000210202 [0,1,0,0,0,0|3,0,0]=4 2437 B13R1.387 CCOc1ccc(c(c1)C(=O)C)F 34a_100000091700_100000210202 [0,1,0,0,0,0|3,0,0]=4 2438 B13R1.387 CCOc1ccc(c(c1)C(=O)C)F 7a_100000091700_100000210202 [0,1,0,0,0,0|3,0,0]=4 2439 B13R1.387 CCOc1ccc(c(c1)C(=O)C)O 1458a_200011255221_200000210301 [0,1,0,0,0,0|2,0,0]=3 2440 B13R1.387 CCOc1ccc(c(c1)C(=O)[13CH3])O 1458a_200011255221_200025704644 [0,1,0,0,0,0|2,0,0]=3 2441 B13R1.387 CCOc1ccc(c(c1)N(C)C)C 34a_200000087912_100000210202 [0,1,0,0,0,0|3,0,0]=4 2442 B13R1.387 CCOc1ccc(c(c1)N(C)C)I 34a_200010083878_100000210202 [0,1,0,0,0,0|3,0,0]=4 2443 B13R1.387 CCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000210202 [0,1,0,0,0,0|3,0,0]=4 2444 B13R1.387 CCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000210202 [0,1,0,0,0,0|3,0,0]=4 2445 B13R1.387 CCSc1ccc(c(c1)C(=O)C)F 62a_100000210202_100010254839 [0,1,0,0,0,0|3,0,0]=4 2446 B13R1.387 CCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000210202 [0,1,0,0,0,0|3,0,0]=4 2447 B13R1.387 CCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000210202 [0,1,0,0,0,0|3,0,0]=4 2448 B13R1.387 CCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000210202 [0,1,0,0,0,0|3,0,0]=4 2449 B13R1.387 CCSc1ccc(c(c1)C(C)C)F 62a_100000210202_200053017515 [0,1,0,0,0,0|3,0,0]=4 2450 B13R1.387 CCSc1ccc(c(c1)C(C)C)F 62a_200053017515_100000210202 [0,1,0,0,0,0|3,0,0]=4 2451 B13R1.387 CCSc1ccc(c(c1)C(C)C)N 62a_100000210202_100000694223 [0,1,0,0,0,0|3,0,0]=4 2452 B13R1.387 CCSc1ccc(c(c1)C(C)C)N 62a_100000694223_100000210202 [0,1,0,0,0,0|3,0,0]=4 2453 B13R1.387 CCSc1ccc(c(c1)C(C)C)O 62a_100000210202_100000691460 [0,1,0,0,0,0|2,0,0]=3 2454 B13R1.387 CCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210202 [0,1,0,0,0,0|2,0,0]=3 2455 B13R1.387 CCSc1ccc(c(c1)C(C)O)F 62a_100000210202_100011943926 [0,1,0,0,0,0|3,0,0]=4 2456 B13R1.387 CCSc1ccc(c(c1)C(C)O)F 62a_100011943926_100000210202 [0,1,0,0,0,0|3,0,0]=4 2457 B13R1.387 CCSc1ccc(c(c1)N(C)C)F 62a_100000210202_100010288836 [0,1,0,0,0,0|3,0,0]=4 2458 B13R1.387 CCSc1ccc(c(c1)N(C)C)F 62a_100010288836_100000210202 [0,1,0,0,0,0|3,0,0]=4 2459 B13R1.387 CNCc1ccc(c(c1)C(=O)C)Cl 26a_100102657272_100009867868 [0,1,0,0,0,0|3,0,0]=4 2460 B13R1.387 CNCc1ccc(c(c1)[N+](=O)[O-])O 2230a_106832991635_100010149780 [0,1,0,0,0,0|3,0,0]=4 2461 B13R1.387 CNCc1ccc(c(c1)[N+](=O)[O-])O 7a_106832991635_100010149780 [0,1,0,0,0,0|3,0,0]=4 2462 B13R1.575 C#CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000038162 [0,1,0,0,0,0|1,0,2]=4 2463 B13R1.575 C#CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000184674 [0,1,0,0,0,0|1,0,2]=4 2464 B13R1.575 C#CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000038162 [0,1,0,0,0,0|1,0,2]=4 2465 B13R1.575 C#CCNc1ccc(c(c1)OC)C 34a_100011279678_100000184674 [0,1,0,0,0,0|1,0,2]=4 2466 B13R1.575 C#CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000038162 [0,1,0,0,0,0|1,0,2]=4 2467 B13R1.575 C#CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000184674 [0,1,0,0,0,0|1,0,2]=4 2468 B13R1.575 C#CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000038162 [0,1,0,0,0,0|1,0,2]=4 2469 B13R1.575 C#CCNc1ccc(c(c1)OC)F 34a_100000701188_100000184674 [0,1,0,0,0,0|1,0,2]=4 2470 B13R1.575 C#CCNc1ccc(c(c1)OC)I 34a_100000746945_100000184674 [0,1,0,0,0,0|1,0,2]=4 2471 B13R1.575 C#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000184674 [0,1,0,0,0,0|0,0,2]=3 2472 B13R1.575 C#CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000184674 [0,1,0,0,0,0|1,0,2]=4 2473 B13R1.575 C#CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000038162 [0,1,0,0,0,0|1,0,2]=4 2474 B13R1.575 C#CCOc1ccc(c(c1)OC)C 34a_100009865632_100000184674 [0,1,0,0,0,0|1,0,2]=4 2475 B13R1.575 C#CCOc1ccc(c(c1)OC)C 7a_100009865632_100000038162 [0,1,0,0,0,0|1,0,2]=4 2476 B13R1.575 C#CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000184674 [0,1,0,0,0,0|1,0,2]=4 2477 B13R1.575 C#CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000038162 [0,1,0,0,0,0|1,0,2]=4 2478 B13R1.575 C#CCOc1ccc(c(c1)OC)F 34a_100012001760_100000184674 [0,1,0,0,0,0|1,0,2]=4 2479 B13R1.575 C#CCOc1ccc(c(c1)OC)F 7a_100012001760_100000038162 [0,1,0,0,0,0|1,0,2]=4 2480 B13R1.575 C#CCOc1ccc(c(c1)OC)N 34a_100015326901_100000184674 [0,1,0,0,0,0|1,0,2]=4 2481 B13R1.575 C#CCOc1ccc(c(c1)OC)N 7a_100015326901_100000038162 [0,1,0,0,0,0|1,0,2]=4 2482 B13R1.575 C#CCSc1ccc(c(c1)CC)O 62a_100000038162_100012338938 [0,1,0,0,0,0|1,0,2]=4 2483 B13R1.575 C#CCSc1ccc(c(c1)OC)Br 62a_100000038162_100012353699 [0,1,0,0,0,0|1,0,2]=4 2484 B13R1.575 C#CCSc1ccc(c(c1)OC)C 62a_100000038162_100011830276 [0,1,0,0,0,0|1,0,2]=4 2485 B13R1.575 C#CCSc1ccc(c(c1)OC)Cl 62a_100000038162_100011356853 [0,1,0,0,0,0|1,0,2]=4 2486 B13R1.575 C#CCSc1ccc(c(c1)OC)F 62a_100000038162_100011934186 [0,1,0,0,0,0|1,0,2]=4 2487 B13R1.575 C#CCSc1ccc(c(c1)OC)N 62a_100000038162_100015196925 [0,1,0,0,0,0|1,0,2]=4 2488 B13R1.575 C#CCSc1ccc(c(c1)OC)O 62a_100000038162_100000694246 [0,1,0,0,0,0|0,0,2]=3 2489 B13R1.575 C#CCSc1ccc(c(n1)OC)O 62a_100000038162_100010893133 [0,1,0,0,0,0|1,0,2]=4 2490 B13R1.575 C#Cc1cc(ccc1C)NCCC 2230a_200012017271_100000210303 [0,1,0,0,0,0|2,0,1]=4 2491 B13R1.575 C#Cc1cc(ccc1C)NCCC 34a_200012017271_100000210303 [0,1,0,0,0,0|2,0,1]=4 2492 B13R1.575 C#Cc1cc(ccc1Cl)NCCC 2230a_103624766972_100000210303 [0,1,0,0,0,0|2,0,1]=4 2493 B13R1.575 C#Cc1cc(ccc1Cl)NCCC 34a_103624766972_100000210303 [0,1,0,0,0,0|2,0,1]=4 2494 B13R1.575 C#Cc1cc(ccc1F)NCCC 2230a_200011999510_100000210303 [0,1,0,0,0,0|2,0,1]=4 2495 B13R1.575 C#Cc1cc(ccc1F)NCCC 34a_200011999510_100000210303 [0,1,0,0,0,0|2,0,1]=4 2496 B13R1.575 C=CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210623 [0,1,0,0,0,0|1,0,2]=4 2497 B13R1.575 C=CCNc1ccc(c(c1)OC)Br 34a_100000765947_100015514636 [0,1,0,0,0,0|1,0,2]=4 2498 B13R1.575 C=CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210623 [0,1,0,0,0,0|1,0,2]=4 2499 B13R1.575 C=CCNc1ccc(c(c1)OC)C 34a_100011279678_100015514636 [0,1,0,0,0,0|1,0,2]=4 2500 B13R1.575 C=CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210623 [0,1,0,0,0,0|1,0,2]=4 2501 B13R1.575 C=CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100015514636 [0,1,0,0,0,0|1,0,2]=4 2502 B13R1.575 C=CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210623 [0,1,0,0,0,0|1,0,2]=4 2503 B13R1.575 C=CCNc1ccc(c(c1)OC)F 34a_100000701188_100015514636 [0,1,0,0,0,0|1,0,2]=4 2504 B13R1.575 C=CCNc1ccc(c(c1)OC)I 34a_100000746945_100015514636 [0,1,0,0,0,0|1,0,2]=4 2505 B13R1.575 C=CCNc1ccc(c(c1)OC)O 34a_100000726020_100015514636 [0,1,0,0,0,0|0,0,2]=3 2506 B13R1.575 C=CCOc1ccc(c(c1)OC)Br 34a_100011827694_100015514636 [0,1,0,0,0,0|1,0,2]=4 2507 B13R1.575 C=CCOc1ccc(c(c1)OC)Br 7a_100011827694_100015514636 [0,1,0,0,0,0|1,0,2]=4 2508 B13R1.575 C=CCOc1ccc(c(c1)OC)C 34a_100009865632_100015514636 [0,1,0,0,0,0|1,0,2]=4 2509 B13R1.575 C=CCOc1ccc(c(c1)OC)C 7a_100009865632_100015514636 [0,1,0,0,0,0|1,0,2]=4 2510 B13R1.575 C=CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100015514636 [0,1,0,0,0,0|1,0,2]=4 2511 B13R1.575 C=CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100015514636 [0,1,0,0,0,0|1,0,2]=4 2512 B13R1.575 C=CCOc1ccc(c(c1)OC)F 34a_100012001760_100015514636 [0,1,0,0,0,0|1,0,2]=4 2513 B13R1.575 C=CCOc1ccc(c(c1)OC)F 7a_100012001760_100015514636 [0,1,0,0,0,0|1,0,2]=4 2514 B13R1.575 C=CCOc1ccc(c(c1)OC)N 34a_100015326901_100015514636 [0,1,0,0,0,0|1,0,2]=4 2515 B13R1.575 C=CCOc1ccc(c(c1)OC)N 7a_100015326901_100015514636 [0,1,0,0,0,0|1,0,2]=4 2516 B13R1.575 C=CCSc1ccc(c(c1)CC)O 62a_100000210623_100012338938 [0,1,0,0,0,0|1,0,2]=4 2517 B13R1.575 C=CCSc1ccc(c(c1)OC)Br 62a_100000210623_100012353699 [0,1,0,0,0,0|1,0,2]=4 2518 B13R1.575 C=CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210623 [0,1,0,0,0,0|1,0,2]=4 2519 B13R1.575 C=CCSc1ccc(c(c1)OC)C 62a_100000210623_100011830276 [0,1,0,0,0,0|1,0,2]=4 2520 B13R1.575 C=CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210623 [0,1,0,0,0,0|1,0,2]=4 2521 B13R1.575 C=CCSc1ccc(c(c1)OC)Cl 62a_100000210623_100011356853 [0,1,0,0,0,0|1,0,2]=4 2522 B13R1.575 C=CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210623 [0,1,0,0,0,0|1,0,2]=4 2523 B13R1.575 C=CCSc1ccc(c(c1)OC)F 62a_100000210623_100011934186 [0,1,0,0,0,0|1,0,2]=4 2524 B13R1.575 C=CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210623 [0,1,0,0,0,0|1,0,2]=4 2525 B13R1.575 C=CCSc1ccc(c(c1)OC)N 62a_100000210623_100015196925 [0,1,0,0,0,0|1,0,2]=4 2526 B13R1.575 C=CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210623 [0,1,0,0,0,0|1,0,2]=4 2527 B13R1.575 C=CCSc1ccc(c(c1)OC)O 62a_100000210623_100000694246 [0,1,0,0,0,0|0,0,2]=3 2528 B13R1.575 C=CCSc1ccc(c(n1)OC)O 62a_100000210623_100010893133 [0,1,0,0,0,0|1,0,2]=4 2529 B13R1.575 C=Cc1cc(ccc1F)SCCC 62a_100000210303_100000688377 [0,1,0,0,0,0|2,0,1]=4 2530 B13R1.575 C=Cc1cc(ccc1F)SCCC 62a_100000688377_100000210303 [0,1,0,0,0,0|2,0,1]=4 2531 B13R1.575 CC=NNc1ccc(c(c1)OC)F 4a_102515433066_200000210099 [0,1,0,0,0,0|2,0,1]=4 2532 B13R1.575 CCCCc1c[nH]c(=O)c(c1)OC 271570a_100020621405_100010125397 [0,1,0,0,0,0|1,0,1]=3 2533 B13R1.575 CCCCc1cc(c(cn1)C)OC 271570a_100020621405_100010067687 [0,1,0,0,0,0|2,0,0]=3 2534 B13R1.575 CCCCc1cc(c(cn1)F)OC 271570a_100020621405_200010136270 [0,1,0,0,0,0|2,0,0]=3 2535 B13R1.575 CCCCc1cc(c(cn1)N)OC 271570a_100020621405_100009887741 [0,1,0,0,0,0|2,0,0]=3 2536 B13R1.575 CCCCc1cc(c(nn1)N)OC 271570a_100020621405_100000688033 [0,1,0,0,0,0|3,0,0]=4 2537 B13R1.575 CCCCc1ccc(=O)n(c1)CC 271570a_100020621405_100000231005 [0,1,0,0,0,0|2,0,1]=4 2538 B13R1.575 CCCCc1ccc(c(c1)C#N)Br 271570a_100020621405_100012355174 [0,1,0,0,0,0|3,0,0]=4 2539 B13R1.575 CCCCc1ccc(c(c1)C#N)C 271570a_100020621405_100000698047 [0,1,0,0,0,0|3,0,0]=4 2540 B13R1.575 CCCCc1ccc(c(c1)C#N)Cl 271570a_100020621405_100011356831 [0,1,0,0,0,0|3,0,0]=4 2541 B13R1.575 CCCCc1ccc(c(c1)C#N)F 271570a_100020621405_100000037165 [0,1,0,0,0,0|3,0,0]=4 2542 B13R1.575 CCCCc1ccc(c(c1)C#N)N 271570a_100020621405_100000688460 [0,1,0,0,0,0|3,0,0]=4 2543 B13R1.575 CCCCc1ccc(c(c1)C#N)O 271570a_100020621405_100000687585 [0,1,0,0,0,0|2,0,0]=3 2544 B13R1.575 CCCCc1ccc(c(c1)C=O)Br 271570a_100020621405_100010185652 [0,1,0,0,0,0|3,0,0]=4 2545 B13R1.575 CCCCc1ccc(c(c1)C=O)C 271570a_100020621405_100011361606 [0,1,0,0,0,0|3,0,0]=4 2546 B13R1.575 CCCCc1ccc(c(c1)C=O)Cl 271570a_100020621405_100010254384 [0,1,0,0,0,0|3,0,0]=4 2547 B13R1.575 CCCCc1ccc(c(c1)C=O)F 271570a_100020621405_100000211465 [0,1,0,0,0,0|3,0,0]=4 2548 B13R1.575 CCCCc1ccc(c(c1)C=O)N 271570a_100020621405_100011935258 [0,1,0,0,0,0|3,0,0]=4 2549 B13R1.575 CCCCc1ccc(c(c1)C=O)O 271570a_100020621405_100000186750 [0,1,0,0,0,0|2,0,0]=3 2550 B13R1.575 CCCCc1ccc(c(c1)CC)Br 271570a_100020621405_100010244631 [0,1,0,0,0,0|2,0,0]=3 2551 B13R1.575 CCCCc1ccc(c(c1)CC)F 271570a_100020621405_100010244625 [0,1,0,0,0,0|2,0,0]=3 2552 B13R1.575 CCCCc1ccc(c(c1)CC)N 271570a_100020621405_100000686106 [0,1,0,0,0,0|2,0,0]=3 2553 B13R1.575 CCCCc1ccc(c(c1)CC)O 271570a_100020621405_100012338938 [0,1,0,0,0,0|1,0,0]=2 2554 B13R1.575 CCCCc1ccc(c(c1)CN)F 271570a_100020621405_100009815772 [0,1,0,0,0,0|3,0,0]=4 2555 B13R1.575 CCCCc1ccc(c(c1)CN)N 271570a_100020621405_100012349119 [0,1,0,0,0,0|3,0,0]=4 2556 B13R1.575 CCCCc1ccc(c(c1)CN)O 271570a_100020621405_100000730032 [0,1,0,0,0,0|2,0,0]=3 2557 B13R1.575 CCCCc1ccc(c(c1)CO)Br 271570a_100020621405_100012359683 [0,1,0,0,0,0|3,0,0]=4 2558 B13R1.575 CCCCc1ccc(c(c1)CO)C 271570a_100020621405_100000700630 [0,1,0,0,0,0|3,0,0]=4 2559 B13R1.575 CCCCc1ccc(c(c1)CO)Cl 271570a_100020621405_100010128486 [0,1,0,0,0,0|3,0,0]=4 2560 B13R1.575 CCCCc1ccc(c(c1)CO)F 271570a_100020621405_100000049604 [0,1,0,0,0,0|3,0,0]=4 2561 B13R1.575 CCCCc1ccc(c(c1)CO)N 271570a_100020621405_100012353972 [0,1,0,0,0,0|3,0,0]=4 2562 B13R1.575 CCCCc1ccc(c(c1)CO)O 271570a_100020621405_100000184703 [0,1,0,0,0,0|2,0,0]=3 2563 B13R1.575 CCCCc1ccc(c(c1)NC)C 271570a_100020621405_100020629602 [0,1,0,0,0,0|2,0,0]=3 2564 B13R1.575 CCCCc1ccc(c(c1)NC)F 271570a_100020621405_100011314990 [0,1,0,0,0,0|2,0,0]=3 2565 B13R1.575 CCCCc1ccc(c(c1)NC)N 271570a_100020621405_100000694363 [0,1,0,0,0,0|2,0,0]=3 2566 B13R1.575 CCCCc1ccc(c(c1)NN)F 271570a_100020621405_100020610843 [0,1,0,0,0,0|3,0,0]=4 2567 B13R1.575 CCCCc1ccc(c(c1)OC)Br 271570a_100020621405_100012353699 [0,1,0,0,0,0|1,0,0]=2 2568 B13R1.575 CCCCc1ccc(c(c1)OC)C 271570a_100020621405_100011830276 [0,1,0,0,0,0|1,0,0]=2 2569 B13R1.575 CCCCc1ccc(c(c1)OC)Cl 271570a_100020621405_100011356853 [0,1,0,0,0,0|1,0,0]=2 2570 B13R1.575 CCCCc1ccc(c(c1)OC)F 271570a_100020621405_100011934186 [0,1,0,0,0,0|1,0,0]=2 2571 B13R1.575 CCCCc1ccc(c(c1)OC)N 271570a_100020621405_100011279103 [0,1,0,0,0,0|1,0,0]=2 2572 B13R1.575 CCCCc1ccc(c(c1)OC)O 271570a_100020621405_100000694246 [0,1,0,0,0,0|0,0,0]=1 2573 B13R1.575 CCCCc1ccc(c(c1)SC)F 271570a_100020621405_100010341305 [0,1,0,0,0,0|1,1,0]=3 2574 B13R1.575 CCCCc1ccc(c(n1)CC)N 271570a_100020621405_100009871203 [0,1,0,0,0,0|3,0,0]=4 2575 B13R1.575 CCCCc1ccc(c(n1)OC)N 271570a_100020621405_100000687816 [0,1,0,0,0,0|2,0,0]=3 2576 B13R1.575 CCCCc1ccc(c(n1)OC)O 271570a_100020621405_100010893133 [0,1,0,0,0,0|1,0,0]=2 2577 B13R1.575 CCCCc1cnc(c(c1)C#N)O 271570a_100020621405_100000697733 [0,1,0,0,0,0|3,0,0]=4 2578 B13R1.575 CCCCc1cnc(c(c1)CO)O 271570a_100020621405_100010065268 [0,1,0,0,0,0|3,0,0]=4 2579 B13R1.575 CCCCc1cnc(c(c1)NC)N 271570a_100020621405_100010506235 [0,1,0,0,0,0|3,0,0]=4 2580 B13R1.575 CCCCc1cnc(c(c1)OC)C 271570a_100020621405_100010254219 [0,1,0,0,0,0|2,0,0]=3 2581 B13R1.575 CCCCc1cnc(c(c1)OC)F 271570a_100020621405_100010214931 [0,1,0,0,0,0|2,0,0]=3 2582 B13R1.575 CCCCc1cnc(c(c1)OC)N 271570a_100020621405_106354213024 [0,1,0,0,0,0|2,0,0]=3 2583 B13R1.575 CCCCc1cnc(c(n1)OC)N 271570a_100020621405_100009816943 [0,1,0,0,0,0|3,0,0]=4 2584 B13R1.575 CCCCc1cnc(c(n1)OC)O 271570a_100020621405_200010365344 [0,1,0,0,0,0|2,0,0]=3 2585 B13R1.575 CCCCc1ncc(c(n1)OC)C 271570a_100020621405_100012500371 [0,1,0,0,0,0|3,0,0]=4 2586 B13R1.575 CCCCc1ncc(c(n1)OC)F 271570a_100020621405_100012183945 [0,1,0,0,0,0|3,0,0]=4 2587 B13R1.575 CCCCc1ncc(c(n1)OC)N 271570a_100020621405_100012122185 [0,1,0,0,0,0|3,0,0]=4 2588 B13R1.575 CCCNc1ccc(c(c1)C#N)Br 34a_100011934039_100000210303 [0,1,0,0,0,0|3,0,0]=4 2589 B13R1.575 CCCNc1ccc(c(c1)C#N)Br 7a_100011934039_100000210303 [0,1,0,0,0,0|3,0,0]=4 2590 B13R1.575 CCCNc1ccc(c(c1)C#N)C 34a_100011216687_100000210303 [0,1,0,0,0,0|3,0,0]=4 2591 B13R1.575 CCCNc1ccc(c(c1)C#N)C 7a_100011216687_100000210303 [0,1,0,0,0,0|3,0,0]=4 2592 B13R1.575 CCCNc1ccc(c(c1)C#N)Cl 34a_100000239497_100000210303 [0,1,0,0,0,0|3,0,0]=4 2593 B13R1.575 CCCNc1ccc(c(c1)C#N)Cl 7a_100000239497_100000210303 [0,1,0,0,0,0|3,0,0]=4 2594 B13R1.575 CCCNc1ccc(c(c1)C#N)F 34a_100000748589_100000210303 [0,1,0,0,0,0|3,0,0]=4 2595 B13R1.575 CCCNc1ccc(c(c1)C#N)F 7a_100000748589_100000210303 [0,1,0,0,0,0|3,0,0]=4 2596 B13R1.575 CCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210303 [0,1,0,0,0,0|2,0,0]=3 2597 B13R1.575 CCCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000210303 [0,1,0,0,0,0|2,0,0]=3 2598 B13R1.575 CCCNc1ccc(c(c1)CC)Br 34a_100010109747_100000210303 [0,1,0,0,0,0|2,0,0]=3 2599 B13R1.575 CCCNc1ccc(c(c1)CC)Br 7a_100010109747_100000210303 [0,1,0,0,0,0|2,0,0]=3 2600 B13R1.575 CCCNc1ccc(c(c1)CO)Br 2230a_100012347228_100000210303 [0,1,0,0,0,0|3,0,0]=4 2601 B13R1.575 CCCNc1ccc(c(c1)CO)Br 34a_100012347228_100000210303 [0,1,0,0,0,0|3,0,0]=4 2602 B13R1.575 CCCNc1ccc(c(c1)CO)Cl 2230a_100011273577_100000210303 [0,1,0,0,0,0|3,0,0]=4 2603 B13R1.575 CCCNc1ccc(c(c1)CO)Cl 34a_100011273577_100000210303 [0,1,0,0,0,0|3,0,0]=4 2604 B13R1.575 CCCNc1ccc(c(c1)CO)F 34a_100011218011_100000210303 [0,1,0,0,0,0|3,0,0]=4 2605 B13R1.575 CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210303 [0,1,0,0,0,0|1,0,0]=2 2606 B13R1.575 CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210303 [0,1,0,0,0,0|1,0,0]=2 2607 B13R1.575 CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210303 [0,1,0,0,0,0|1,0,0]=2 2608 B13R1.575 CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210303 [0,1,0,0,0,0|1,0,0]=2 2609 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210303 [0,1,0,0,0,0|1,0,0]=2 2610 B13R1.575 CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210303 [0,1,0,0,0,0|1,0,0]=2 2611 B13R1.575 CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210303 [0,1,0,0,0,0|1,0,0]=2 2612 B13R1.575 CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210303 [0,1,0,0,0,0|1,0,0]=2 2613 B13R1.575 CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210303 [0,1,0,0,0,0|1,0,0]=2 2614 B13R1.575 CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210303 [0,1,0,0,0,0|0,0,0]=1 2615 B13R1.575 CCCOc1ccc(c(c1)C#N)Br 34a_100009818209_100000210303 [0,1,0,0,0,0|3,0,0]=4 2616 B13R1.575 CCCOc1ccc(c(c1)C#N)Br 7a_100009818209_100000210303 [0,1,0,0,0,0|3,0,0]=4 2617 B13R1.575 CCCOc1ccc(c(c1)C#N)Cl 34a_100000092820_100000210303 [0,1,0,0,0,0|3,0,0]=4 2618 B13R1.575 CCCOc1ccc(c(c1)C#N)Cl 7a_100000092820_100000210303 [0,1,0,0,0,0|3,0,0]=4 2619 B13R1.575 CCCOc1ccc(c(c1)C#N)F 34a_100000070142_100000210303 [0,1,0,0,0,0|3,0,0]=4 2620 B13R1.575 CCCOc1ccc(c(c1)C#N)F 7a_100000070142_100000210303 [0,1,0,0,0,0|3,0,0]=4 2621 B13R1.575 CCCOc1ccc(c(c1)C#N)N 34a_200011997737_100000210303 [0,1,0,0,0,0|3,0,0]=4 2622 B13R1.575 CCCOc1ccc(c(c1)C#N)N 7a_200011997737_100000210303 [0,1,0,0,0,0|3,0,0]=4 2623 B13R1.575 CCCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000210303 [0,1,0,0,0,0|2,0,0]=3 2624 B13R1.575 CCCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000210303 [0,1,0,0,0,0|2,0,0]=3 2625 B13R1.575 CCCOc1ccc(c(c1)CN)C 34a_200009844824_100000210303 [0,1,0,0,0,0|3,0,0]=4 2626 B13R1.575 CCCOc1ccc(c(c1)CO)Br 34a_100012351483_100000210303 [0,1,0,0,0,0|3,0,0]=4 2627 B13R1.575 CCCOc1ccc(c(c1)CO)Br 7a_100012351483_100000210303 [0,1,0,0,0,0|3,0,0]=4 2628 B13R1.575 CCCOc1ccc(c(c1)CO)C 34a_100009878257_100000210303 [0,1,0,0,0,0|3,0,0]=4 2629 B13R1.575 CCCOc1ccc(c(c1)CO)C 7a_100009878257_100000210303 [0,1,0,0,0,0|3,0,0]=4 2630 B13R1.575 CCCOc1ccc(c(c1)CO)Cl 34a_100000091669_100000210303 [0,1,0,0,0,0|3,0,0]=4 2631 B13R1.575 CCCOc1ccc(c(c1)CO)Cl 7a_100000091669_100000210303 [0,1,0,0,0,0|3,0,0]=4 2632 B13R1.575 CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210303 [0,1,0,0,0,0|1,0,0]=2 2633 B13R1.575 CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210303 [0,1,0,0,0,0|1,0,0]=2 2634 B13R1.575 CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210303 [0,1,0,0,0,0|1,0,0]=2 2635 B13R1.575 CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210303 [0,1,0,0,0,0|1,0,0]=2 2636 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210303 [0,1,0,0,0,0|1,0,0]=2 2637 B13R1.575 CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210303 [0,1,0,0,0,0|1,0,0]=2 2638 B13R1.575 CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210303 [0,1,0,0,0,0|1,0,0]=2 2639 B13R1.575 CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210303 [0,1,0,0,0,0|1,0,0]=2 2640 B13R1.575 CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210303 [0,1,0,0,0,0|1,0,0]=2 2641 B13R1.575 CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210303 [0,1,0,0,0,0|1,0,0]=2 2642 B13R1.575 CCCSc1c[nH]c(=O)c(c1)OC 62a_100000210303_100010125397 [0,1,0,0,0,0|1,0,1]=3 2643 B13R1.575 CCCSc1cc(c(cn1)C)OC 62a_100000210303_100010067687 [0,1,0,0,0,0|2,0,0]=3 2644 B13R1.575 CCCSc1cc(c(cn1)C)OC 62a_100010067687_100000210303 [0,1,0,0,0,0|2,0,0]=3 2645 B13R1.575 CCCSc1cc(c(cn1)F)OC 62a_100000210303_200010136270 [0,1,0,0,0,0|2,0,0]=3 2646 B13R1.575 CCCSc1cc(c(cn1)F)OC 62a_200010136270_100000210303 [0,1,0,0,0,0|2,0,0]=3 2647 B13R1.575 CCCSc1cc(c(cn1)N)OC 62a_100000210303_100009887741 [0,1,0,0,0,0|2,0,0]=3 2648 B13R1.575 CCCSc1cc(c(cn1)N)OC 62a_100009887741_100000210303 [0,1,0,0,0,0|2,0,0]=3 2649 B13R1.575 CCCSc1cc(c(cn1)O)C=O 62a_100000210303_100000048449 [0,1,0,0,0,0|3,0,0]=4 2650 B13R1.575 CCCSc1cc(c(nn1)N)OC 62a_100000210303_100000688033 [0,1,0,0,0,0|3,0,0]=4 2651 B13R1.575 CCCSc1cc(c(nn1)N)OC 62a_100000688033_100000210303 [0,1,0,0,0,0|3,0,0]=4 2652 B13R1.575 CCCSc1ccc(=O)n(c1)CC 62a_100000210303_100000231005 [0,1,0,0,0,0|2,0,1]=4 2653 B13R1.575 CCCSc1ccc(=O)n(c1)CC 62a_100000231005_100000210303 [0,1,0,0,0,0|2,0,1]=4 2654 B13R1.575 CCCSc1ccc(c(c1)C#N)Br 62a_100000210303_100012355174 [0,1,0,0,0,0|3,0,0]=4 2655 B13R1.575 CCCSc1ccc(c(c1)C#N)Br 62a_100012355174_100000210303 [0,1,0,0,0,0|3,0,0]=4 2656 B13R1.575 CCCSc1ccc(c(c1)C#N)C 62a_100000210303_100011356939 [0,1,0,0,0,0|3,0,0]=4 2657 B13R1.575 CCCSc1ccc(c(c1)C#N)Cl 62a_100000210303_100011356831 [0,1,0,0,0,0|3,0,0]=4 2658 B13R1.575 CCCSc1ccc(c(c1)C#N)F 62a_100000210303_100000037165 [0,1,0,0,0,0|3,0,0]=4 2659 B13R1.575 CCCSc1ccc(c(c1)C#N)N 62a_100000210303_100000688460 [0,1,0,0,0,0|3,0,0]=4 2660 B13R1.575 CCCSc1ccc(c(c1)C#N)O 62a_100000210303_100000687585 [0,1,0,0,0,0|2,0,0]=3 2661 B13R1.575 CCCSc1ccc(c(c1)C=O)Br 62a_100000210303_100010185652 [0,1,0,0,0,0|3,0,0]=4 2662 B13R1.575 CCCSc1ccc(c(c1)C=O)Br 62a_100010185652_100000210303 [0,1,0,0,0,0|3,0,0]=4 2663 B13R1.575 CCCSc1ccc(c(c1)C=O)C 62a_100000210303_100011361606 [0,1,0,0,0,0|3,0,0]=4 2664 B13R1.575 CCCSc1ccc(c(c1)C=O)C 62a_100011361606_100000210303 [0,1,0,0,0,0|3,0,0]=4 2665 B13R1.575 CCCSc1ccc(c(c1)C=O)Cl 62a_100000210303_100010254384 [0,1,0,0,0,0|3,0,0]=4 2666 B13R1.575 CCCSc1ccc(c(c1)C=O)Cl 62a_100010254384_100000210303 [0,1,0,0,0,0|3,0,0]=4 2667 B13R1.575 CCCSc1ccc(c(c1)C=O)F 62a_100000050626_100000210303 [0,1,0,0,0,0|3,0,0]=4 2668 B13R1.575 CCCSc1ccc(c(c1)C=O)F 62a_100000210303_100000050626 [0,1,0,0,0,0|3,0,0]=4 2669 B13R1.575 CCCSc1ccc(c(c1)C=O)N 62a_100011935258_100000210303 [0,1,0,0,0,0|3,0,0]=4 2670 B13R1.575 CCCSc1ccc(c(c1)C=O)O 62a_100000210303_100000186750 [0,1,0,0,0,0|2,0,0]=3 2671 B13R1.575 CCCSc1ccc(c(c1)CC)Br 62a_100000210303_100010244631 [0,1,0,0,0,0|2,0,0]=3 2672 B13R1.575 CCCSc1ccc(c(c1)CC)Br 62a_100010244631_100000210303 [0,1,0,0,0,0|2,0,0]=3 2673 B13R1.575 CCCSc1ccc(c(c1)CC)F 62a_100000210303_100010244625 [0,1,0,0,0,0|2,0,0]=3 2674 B13R1.575 CCCSc1ccc(c(c1)CC)F 62a_100010244625_100000210303 [0,1,0,0,0,0|2,0,0]=3 2675 B13R1.575 CCCSc1ccc(c(c1)CC)N 62a_100000210303_100000686106 [0,1,0,0,0,0|2,0,0]=3 2676 B13R1.575 CCCSc1ccc(c(c1)CC)N 62a_100000686106_100000210303 [0,1,0,0,0,0|2,0,0]=3 2677 B13R1.575 CCCSc1ccc(c(c1)CC)O 62a_100000210303_100012338938 [0,1,0,0,0,0|1,0,0]=2 2678 B13R1.575 CCCSc1ccc(c(c1)CN)F 62a_100000210303_100009815772 [0,1,0,0,0,0|3,0,0]=4 2679 B13R1.575 CCCSc1ccc(c(c1)CN)F 62a_100009815772_100000210303 [0,1,0,0,0,0|3,0,0]=4 2680 B13R1.575 CCCSc1ccc(c(c1)CN)N 62a_100000210303_100012349119 [0,1,0,0,0,0|3,0,0]=4 2681 B13R1.575 CCCSc1ccc(c(c1)CN)N 62a_100012349119_100000210303 [0,1,0,0,0,0|3,0,0]=4 2682 B13R1.575 CCCSc1ccc(c(c1)CN)O 62a_100000210303_100000730032 [0,1,0,0,0,0|2,0,0]=3 2683 B13R1.575 CCCSc1ccc(c(c1)CN)O 62a_100000730032_100000210303 [0,1,0,0,0,0|2,0,0]=3 2684 B13R1.575 CCCSc1ccc(c(c1)CO)Br 62a_100000210303_100012359683 [0,1,0,0,0,0|3,0,0]=4 2685 B13R1.575 CCCSc1ccc(c(c1)CO)Br 62a_100012359683_100000210303 [0,1,0,0,0,0|3,0,0]=4 2686 B13R1.575 CCCSc1ccc(c(c1)CO)C 62a_100000210303_100000700630 [0,1,0,0,0,0|3,0,0]=4 2687 B13R1.575 CCCSc1ccc(c(c1)CO)C 62a_100000700630_100000210303 [0,1,0,0,0,0|3,0,0]=4 2688 B13R1.575 CCCSc1ccc(c(c1)CO)Cl 62a_100000210303_100010128486 [0,1,0,0,0,0|3,0,0]=4 2689 B13R1.575 CCCSc1ccc(c(c1)CO)Cl 62a_100010128486_100000210303 [0,1,0,0,0,0|3,0,0]=4 2690 B13R1.575 CCCSc1ccc(c(c1)CO)F 62a_100000210303_100000246282 [0,1,0,0,0,0|3,0,0]=4 2691 B13R1.575 CCCSc1ccc(c(c1)CO)F 62a_100000246282_100000210303 [0,1,0,0,0,0|3,0,0]=4 2692 B13R1.575 CCCSc1ccc(c(c1)CO)N 62a_100000210303_100012353972 [0,1,0,0,0,0|3,0,0]=4 2693 B13R1.575 CCCSc1ccc(c(c1)CO)N 62a_100012353972_100000210303 [0,1,0,0,0,0|3,0,0]=4 2694 B13R1.575 CCCSc1ccc(c(c1)CO)O 62a_100000184703_100000210303 [0,1,0,0,0,0|2,0,0]=3 2695 B13R1.575 CCCSc1ccc(c(c1)CO)O 62a_100000210303_100000184703 [0,1,0,0,0,0|2,0,0]=3 2696 B13R1.575 CCCSc1ccc(c(c1)NC)C 62a_100000210303_100020629602 [0,1,0,0,0,0|2,0,0]=3 2697 B13R1.575 CCCSc1ccc(c(c1)NC)C 62a_100020629602_100000210303 [0,1,0,0,0,0|2,0,0]=3 2698 B13R1.575 CCCSc1ccc(c(c1)NC)F 62a_100000210303_100011314990 [0,1,0,0,0,0|2,0,0]=3 2699 B13R1.575 CCCSc1ccc(c(c1)NC)F 62a_100011314990_100000210303 [0,1,0,0,0,0|2,0,0]=3 2700 B13R1.575 CCCSc1ccc(c(c1)NC)N 62a_100000694363_100000210303 [0,1,0,0,0,0|2,0,0]=3 2701 B13R1.575 CCCSc1ccc(c(c1)NN)F 62a_100000210303_100020610843 [0,1,0,0,0,0|3,0,0]=4 2702 B13R1.575 CCCSc1ccc(c(c1)NN)F 62a_100020610843_100000210303 [0,1,0,0,0,0|3,0,0]=4 2703 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100000210303_100012353699 [0,1,0,0,0,0|1,0,0]=2 2704 B13R1.575 CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210303 [0,1,0,0,0,0|1,0,0]=2 2705 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100000210303_100011830276 [0,1,0,0,0,0|1,0,0]=2 2706 B13R1.575 CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210303 [0,1,0,0,0,0|1,0,0]=2 2707 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100000210303_100011356853 [0,1,0,0,0,0|1,0,0]=2 2708 B13R1.575 CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210303 [0,1,0,0,0,0|1,0,0]=2 2709 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100000210303_100011934186 [0,1,0,0,0,0|1,0,0]=2 2710 B13R1.575 CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210303 [0,1,0,0,0,0|1,0,0]=2 2711 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100000210303_100015196925 [0,1,0,0,0,0|1,0,0]=2 2712 B13R1.575 CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210303 [0,1,0,0,0,0|1,0,0]=2 2713 B13R1.575 CCCSc1ccc(c(c1)OC)O 62a_100000210303_100000694246 [0,1,0,0,0,0|0,0,0]=1 2714 B13R1.575 CCCSc1ccc(c(c1)SC)F 62a_100000210303_100010341305 [0,1,0,0,0,0|1,1,0]=3 2715 B13R1.575 CCCSc1ccc(c(c1)SC)F 62a_100010341305_100000210303 [0,1,0,0,0,0|1,1,0]=3 2716 B13R1.575 CCCSc1ccc(c(n1)CC)N 62a_100000210303_100009871203 [0,1,0,0,0,0|3,0,0]=4 2717 B13R1.575 CCCSc1ccc(c(n1)CC)N 62a_100009871203_100000210303 [0,1,0,0,0,0|3,0,0]=4 2718 B13R1.575 CCCSc1ccc(c(n1)OC)N 62a_100000210303_100000687816 [0,1,0,0,0,0|2,0,0]=3 2719 B13R1.575 CCCSc1ccc(c(n1)OC)N 62a_100000687816_100000210303 [0,1,0,0,0,0|2,0,0]=3 2720 B13R1.575 CCCSc1ccc(c(n1)OC)O 62a_100000210303_100010893133 [0,1,0,0,0,0|1,0,0]=2 2721 B13R1.575 CCCSc1cnc(c(c1)C#N)O 62a_100000210303_100000697733 [0,1,0,0,0,0|3,0,0]=4 2722 B13R1.575 CCCSc1cnc(c(c1)C=O)O 62a_100000210303_100010064889 [0,1,0,0,0,0|3,0,0]=4 2723 B13R1.575 CCCSc1cnc(c(c1)C=O)O 62a_100010064889_100000210303 [0,1,0,0,0,0|3,0,0]=4 2724 B13R1.575 CCCSc1cnc(c(c1)CO)O 62a_100000210303_100010065268 [0,1,0,0,0,0|3,0,0]=4 2725 B13R1.575 CCCSc1cnc(c(c1)CO)O 62a_100010065268_100000210303 [0,1,0,0,0,0|3,0,0]=4 2726 B13R1.575 CCCSc1cnc(c(c1)NC)N 62a_100000210303_100010506235 [0,1,0,0,0,0|3,0,0]=4 2727 B13R1.575 CCCSc1cnc(c(c1)NC)N 62a_100010506235_100000210303 [0,1,0,0,0,0|3,0,0]=4 2728 B13R1.575 CCCSc1cnc(c(c1)OC)C 62a_100000210303_100010254219 [0,1,0,0,0,0|2,0,0]=3 2729 B13R1.575 CCCSc1cnc(c(c1)OC)C 62a_100010254219_100000210303 [0,1,0,0,0,0|2,0,0]=3 2730 B13R1.575 CCCSc1cnc(c(c1)OC)F 62a_100000210303_100010214931 [0,1,0,0,0,0|2,0,0]=3 2731 B13R1.575 CCCSc1cnc(c(c1)OC)F 62a_100010214931_100000210303 [0,1,0,0,0,0|2,0,0]=3 2732 B13R1.575 CCCSc1cnc(c(c1)OC)N 62a_100000210303_106354213024 [0,1,0,0,0,0|2,0,0]=3 2733 B13R1.575 CCCSc1cnc(c(c1)OC)N 62a_106354213024_100000210303 [0,1,0,0,0,0|2,0,0]=3 2734 B13R1.575 CCCSc1cnc(c(n1)OC)N 62a_100000210303_100009816943 [0,1,0,0,0,0|3,0,0]=4 2735 B13R1.575 CCCSc1cnc(c(n1)OC)N 62a_100009816943_100000210303 [0,1,0,0,0,0|3,0,0]=4 2736 B13R1.575 CCCSc1cnc(c(n1)OC)O 62a_100000210303_200010365344 [0,1,0,0,0,0|2,0,0]=3 2737 B13R1.575 CCCSc1cnc(c(n1)OC)O 62a_200010365344_100000210303 [0,1,0,0,0,0|2,0,0]=3 2738 B13R1.575 CCCSc1ncc(c(n1)OC)C 62a_100000210303_100012500371 [0,1,0,0,0,0|3,0,0]=4 2739 B13R1.575 CCCSc1ncc(c(n1)OC)C 62a_100012500371_100000210303 [0,1,0,0,0,0|3,0,0]=4 2740 B13R1.575 CCCSc1ncc(c(n1)OC)F 62a_100000210303_100012183945 [0,1,0,0,0,0|3,0,0]=4 2741 B13R1.575 CCCSc1ncc(c(n1)OC)F 62a_100012183945_100000210303 [0,1,0,0,0,0|3,0,0]=4 2742 B13R1.575 CCCSc1ncc(c(n1)OC)N 62a_100000210303_100012122185 [0,1,0,0,0,0|3,0,0]=4 2743 B13R1.575 CCCSc1ncc(c(n1)OC)N 62a_100012122185_100000210303 [0,1,0,0,0,0|3,0,0]=4 2744 B13R1.575 CCNCc1ccc(c(c1)C#N)Br 2230a_100015525214_100010128727 [0,1,0,0,0,0|3,0,0]=4 2745 B13R1.575 CCNCc1ccc(c(c1)C#N)C 207a_100015525214_100012017333 [0,1,0,0,0,0|3,0,0]=4 2746 B13R1.575 CCNCc1ccc(c(c1)C#N)C 270004a_100015525214_100012017333 [0,1,0,0,0,0|3,0,0]=4 2747 B13R1.575 CCNCc1ccc(c(c1)C#N)Cl 2230a_100015525214_100010147165 [0,1,0,0,0,0|3,0,0]=4 2748 B13R1.575 CCNCc1ccc(c(c1)C#N)Cl 34a_100009846983_100000210202 [0,1,0,0,0,0|3,0,0]=4 2749 B13R1.575 CCNCc1ccc(c(c1)C#N)F 2230a_100015525214_100000687583 [0,1,0,0,0,0|3,0,0]=4 2750 B13R1.575 CCNCc1ccc(c(c1)C#N)F 34a_100016992121_100000210202 [0,1,0,0,0,0|3,0,0]=4 2751 B13R1.575 CCNCc1ccc(c(c1)CC)F 207a_100015525214_100009840867 [0,1,0,0,0,0|2,0,0]=3 2752 B13R1.575 CCNCc1ccc(c(c1)CC)F 2230a_114873767189_100000210202 [0,1,0,0,0,0|2,0,0]=3 2753 B13R1.575 CCNCc1ccc(c(c1)CC)F 269862a_100015525214_100009840867 [0,1,0,0,0,0|2,0,0]=3 2754 B13R1.575 CCNCc1ccc(c(c1)CC)F 270004a_100015525214_100009840867 [0,1,0,0,0,0|2,0,0]=3 2755 B13R1.575 CCNCc1ccc(c(c1)CC)F 34a_114873767189_100000210202 [0,1,0,0,0,0|2,0,0]=3 2756 B13R1.575 CCNCc1ccc(c(c1)CO)Br 207a_100015525214_100015639582 [0,1,0,0,0,0|3,0,0]=4 2757 B13R1.575 CCNCc1ccc(c(c1)CO)Br 270004a_100015525214_100015639582 [0,1,0,0,0,0|3,0,0]=4 2758 B13R1.575 CCNCc1ccc(c(c1)OC)Br 207a_100015525214_100010244714 [0,1,0,0,0,0|1,0,0]=2 2759 B13R1.575 CCNCc1ccc(c(c1)OC)Br 2230a_100015525214_100010110085 [0,1,0,0,0,0|1,0,0]=2 2760 B13R1.575 CCNCc1ccc(c(c1)OC)Br 270004a_100015525214_100010244714 [0,1,0,0,0,0|1,0,0]=2 2761 B13R1.575 CCNCc1ccc(c(c1)OC)C 207a_100015525214_100000719150 [0,1,0,0,0,0|1,0,0]=2 2762 B13R1.575 CCNCc1ccc(c(c1)OC)C 270004a_100015525214_100000719150 [0,1,0,0,0,0|1,0,0]=2 2763 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 207a_100015525214_100011998524 [0,1,0,0,0,0|1,0,0]=2 2764 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210202 [0,1,0,0,0,0|1,0,0]=2 2765 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 2230a_100015525214_200010214485 [0,1,0,0,0,0|1,0,0]=2 2766 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 270004a_100015525214_100011998524 [0,1,0,0,0,0|1,0,0]=2 2767 B13R1.575 CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210202 [0,1,0,0,0,0|1,0,0]=2 2768 B13R1.575 CCNCc1ccc(c(c1)OC)F 207a_100015525214_100000692873 [0,1,0,0,0,0|1,0,0]=2 2769 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100015525214_100012349856 [0,1,0,0,0,0|1,0,0]=2 2770 B13R1.575 CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210202 [0,1,0,0,0,0|1,0,0]=2 2771 B13R1.575 CCNCc1ccc(c(c1)OC)F 270004a_100015525214_100000692873 [0,1,0,0,0,0|1,0,0]=2 2772 B13R1.575 CCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210202 [0,1,0,0,0,0|1,0,0]=2 2773 B13R1.575 CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210202 [0,1,0,0,0,0|0,0,0]=1 2774 B13R1.575 CCNCc1ccc(c(n1)OC)Br 2230a_100015525214_200010066506 [0,1,0,0,0,0|2,0,0]=3 2775 B13R1.575 CCOCc1cc(c(cn1)Br)OC 34a_100010999569_100000210202 [0,1,0,0,0,0|2,0,0]=3 2776 B13R1.575 CCOCc1ccc(c(c1)C#N)Br 34a_100010145894_100000210202 [0,1,0,0,0,0|3,0,0]=4 2777 B13R1.575 CCOCc1ccc(c(c1)C#N)Br 7a_100010145894_100000210202 [0,1,0,0,0,0|3,0,0]=4 2778 B13R1.575 CCOCc1ccc(c(c1)C#N)F 34a_100011220027_100000210202 [0,1,0,0,0,0|3,0,0]=4 2779 B13R1.575 CCOCc1ccc(c(c1)C#N)F 7a_100011220027_100000210202 [0,1,0,0,0,0|3,0,0]=4 2780 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210202 [0,1,0,0,0,0|1,0,0]=2 2781 B13R1.575 CCOCc1ccc(c(c1)OC)Br 34a_100121572206_100010110085 [0,1,0,0,0,0|1,0,0]=2 2782 B13R1.575 CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210202 [0,1,0,0,0,0|1,0,0]=2 2783 B13R1.575 CCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210202 [0,1,0,0,0,0|1,0,0]=2 2784 B13R1.575 CCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210202 [0,1,0,0,0,0|1,0,0]=2 2785 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210202 [0,1,0,0,0,0|1,0,0]=2 2786 B13R1.575 CCOCc1ccc(c(c1)OC)Cl 34a_100121572206_200010214485 [0,1,0,0,0,0|1,0,0]=2 2787 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210202 [0,1,0,0,0,0|1,0,0]=2 2788 B13R1.575 CCOCc1ccc(c(c1)OC)F 34a_100121572206_100012349856 [0,1,0,0,0,0|1,0,0]=2 2789 B13R1.575 CCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210202 [0,1,0,0,0,0|1,0,0]=2 2790 B13R1.575 CCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210202 [0,1,0,0,0,0|1,0,0]=2 2791 B13R1.575 CCOCc1ccc(c(n1)OC)Br 34a_100121572206_200010066506 [0,1,0,0,0,0|2,0,0]=3 2792 B13R1.575 CCSCc1ccc(c(c1)C#N)Br 62a_100000210202_100010128727 [0,1,0,0,0,0|3,0,0]=4 2793 B13R1.575 CCSCc1ccc(c(c1)C#N)Br 62a_100010128727_100000210202 [0,1,0,0,0,0|3,0,0]=4 2794 B13R1.575 CCSCc1ccc(c(c1)C#N)Cl 62a_100000210202_100010147165 [0,1,0,0,0,0|3,0,0]=4 2795 B13R1.575 CCSCc1ccc(c(c1)C#N)F 62a_100000210202_100000687583 [0,1,0,0,0,0|3,0,0]=4 2796 B13R1.575 CCSCc1ccc(c(c1)C#N)F 62a_100000687583_100000210202 [0,1,0,0,0,0|3,0,0]=4 2797 B13R1.575 CCSCc1ccc(c(c1)C=O)O 62a_100000210202_100000008128 [0,1,0,0,0,0|2,0,0]=3 2798 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100000210202_100010110085 [0,1,0,0,0,0|1,0,0]=2 2799 B13R1.575 CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210202 [0,1,0,0,0,0|1,0,0]=2 2800 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_100000210202_200010214485 [0,1,0,0,0,0|1,0,0]=2 2801 B13R1.575 CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210202 [0,1,0,0,0,0|1,0,0]=2 2802 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100000210202_100012349856 [0,1,0,0,0,0|1,0,0]=2 2803 B13R1.575 CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210202 [0,1,0,0,0,0|1,0,0]=2 2804 B13R1.575 CCSCc1ccc(c(n1)OC)Br 62a_100000210202_200010066506 [0,1,0,0,0,0|2,0,0]=3 2805 B13R1.575 CCSCc1ccc(c(n1)OC)Br 62a_200010066506_100000210202 [0,1,0,0,0,0|2,0,0]=3 2806 B13R1.575 CCc1cc(ccc1Br)NCCF 2230a_100010109747_100011217306 [0,1,0,0,0,0|3,0,0]=4 2807 B13R1.575 CCc1cc(ccc1Br)NCCF 34a_100010109747_100011217306 [0,1,0,0,0,0|3,0,0]=4 2808 B13R1.575 CCc1cc(ccc1Br)NCCF 7a_100010109747_100011217306 [0,1,0,0,0,0|3,0,0]=4 2809 B13R1.575 CCc1cc(ccc1Br)NCCO 2230a_100010109747_100000211926 [0,1,0,0,0,0|3,0,0]=4 2810 B13R1.575 CCc1cc(ccc1Br)NCCO 34a_100010109747_100000211926 [0,1,0,0,0,0|3,0,0]=4 2811 B13R1.575 CCc1cc(ccc1Br)NCCO 7a_100010109747_100000211926 [0,1,0,0,0,0|3,0,0]=4 2812 B13R1.575 CCc1cc(ccc1Br)NCOC 2230a_100010109747_100000766300 [0,1,0,0,0,0|3,0,0]=4 2813 B13R1.575 CCc1cc(ccc1Br)NCSC 2230a_100010109747_100011218213 [0,1,0,0,0,0|3,0,0]=4 2814 B13R1.575 CCc1cc(ccc1Br)NCSC 34a_100010109747_100011218213 [0,1,0,0,0,0|3,0,0]=4 2815 B13R1.575 CCc1cc(ccc1Br)SCCF 62a_100010244631_100011217306 [0,1,0,0,0,0|3,0,0]=4 2816 B13R1.575 CCc1cc(ccc1Br)SCCF 62a_100011217306_100010244631 [0,1,0,0,0,0|3,0,0]=4 2817 B13R1.575 CCc1cc(ccc1Br)SCCO 62a_100000211926_100010244631 [0,1,0,0,0,0|3,0,0]=4 2818 B13R1.575 CCc1cc(ccc1Br)SCCO 62a_100010244631_100000211926 [0,1,0,0,0,0|3,0,0]=4 2819 B13R1.575 CCc1cc(ccc1Br)SCOC 62a_100000766300_100010244631 [0,1,0,0,0,0|3,0,0]=4 2820 B13R1.575 CCc1cc(ccc1Br)SCOC 62a_100010244631_100000766300 [0,1,0,0,0,0|3,0,0]=4 2821 B13R1.575 CCc1cc(ccc1Br)SCSC 62a_100010244631_100011218213 [0,1,0,0,0,0|3,0,0]=4 2822 B13R1.575 CCc1cc(ccc1Br)SCSC 62a_100011218213_100010244631 [0,1,0,0,0,0|3,0,0]=4 2823 B13R1.575 CCc1cc(ccc1Cl)OCCF 34a_100000212063_100011217306 [0,1,0,0,0,0|3,0,0]=4 2824 B13R1.575 CCc1cc(ccc1Cl)OCCF 7a_100000212063_100011217306 [0,1,0,0,0,0|3,0,0]=4 2825 B13R1.575 CCc1cc(ccc1Cl)OCCO 34a_100000212063_100000211926 [0,1,0,0,0,0|3,0,0]=4 2826 B13R1.575 CCc1cc(ccc1Cl)OCCO 7a_100000212063_100000211926 [0,1,0,0,0,0|3,0,0]=4 2827 B13R1.575 CCc1cc(ccc1Cl)OCSC 34a_100000212063_100011218213 [0,1,0,0,0,0|3,0,0]=4 2828 B13R1.575 CCc1cc(ccc1F)CNCF 34a_114873767189_100015361967 [0,1,0,0,0,0|3,0,0]=4 2829 B13R1.575 CCc1cc(ccc1F)SCCF 62a_100010244625_100011217306 [0,1,0,0,0,0|3,0,0]=4 2830 B13R1.575 CCc1cc(ccc1F)SCCF 62a_100011217306_100010244625 [0,1,0,0,0,0|3,0,0]=4 2831 B13R1.575 CCc1cc(ccc1F)SCCO 62a_100000211926_100010244625 [0,1,0,0,0,0|3,0,0]=4 2832 B13R1.575 CCc1cc(ccc1F)SCCO 62a_100010244625_100000211926 [0,1,0,0,0,0|3,0,0]=4 2833 B13R1.575 CCc1cc(ccc1F)SCOC 62a_100000766300_100010244625 [0,1,0,0,0,0|3,0,0]=4 2834 B13R1.575 CCc1cc(ccc1F)SCOC 62a_100010244625_100000766300 [0,1,0,0,0,0|3,0,0]=4 2835 B13R1.575 CCc1cc(ccc1F)SCSC 62a_100010244625_100011218213 [0,1,0,0,0,0|3,0,0]=4 2836 B13R1.575 CCc1cc(ccc1F)SCSC 62a_100011218213_100010244625 [0,1,0,0,0,0|3,0,0]=4 2837 B13R1.575 CCc1cc(ccc1N)SCCF 62a_100000686106_100011217306 [0,1,0,0,0,0|3,0,0]=4 2838 B13R1.575 CCc1cc(ccc1N)SCCF 62a_100011217306_100000686106 [0,1,0,0,0,0|3,0,0]=4 2839 B13R1.575 CCc1cc(ccc1N)SCCO 62a_100000211926_100000686106 [0,1,0,0,0,0|3,0,0]=4 2840 B13R1.575 CCc1cc(ccc1N)SCCO 62a_100000686106_100000211926 [0,1,0,0,0,0|3,0,0]=4 2841 B13R1.575 CCc1cc(ccc1N)SCOC 62a_100000686106_100000766300 [0,1,0,0,0,0|3,0,0]=4 2842 B13R1.575 CCc1cc(ccc1N)SCOC 62a_100000766300_100000686106 [0,1,0,0,0,0|3,0,0]=4 2843 B13R1.575 CCc1cc(ccc1N)SCSC 62a_100000686106_100011218213 [0,1,0,0,0,0|3,0,0]=4 2844 B13R1.575 CCc1cc(ccc1N)SCSC 62a_100011218213_100000686106 [0,1,0,0,0,0|3,0,0]=4 2845 B13R1.575 CCc1cc(ccc1O)SCC#N 62a_100011215382_100012338938 [0,1,0,0,0,0|2,0,1]=4 2846 B13R1.575 CCc1cc(ccc1O)SCC=O 62a_200015260668_100012338938 [0,1,0,0,0,0|2,0,1]=4 2847 B13R1.575 CCc1cc(ccc1O)SCCF 62a_100011217306_100012338938 [0,1,0,0,0,0|2,0,0]=3 2848 B13R1.575 CCc1cc(ccc1O)SCCO 62a_100000211926_100012338938 [0,1,0,0,0,0|2,0,0]=3 2849 B13R1.575 CCc1cc(ccc1O)SCOC 62a_100000766300_100012338938 [0,1,0,0,0,0|2,0,0]=3 2850 B13R1.575 CCc1cc(ccc1O)SCSC 62a_100011218213_100012338938 [0,1,0,0,0,0|2,0,0]=3 2851 B13R1.575 CNCCc1ccc(c(c1)OC)O 2230a_106832991635_100010741665 [0,1,0,0,0,0|0,0,0]=1 2852 B13R1.575 CNCCc1ccc(c(c1)OC)O 34a_100000756042_200000210301 [0,1,0,0,0,0|0,0,0]=1 2853 B13R1.575 CNCCc1ccc(c(c1)OC)O 7a_106832991635_100010741665 [0,1,0,0,0,0|0,0,0]=1 2854 B13R1.575 CNc1cc(ccc1C)OCCO 2230a_100012283766_200000210301 [0,1,0,0,0,0|3,0,0]=4 2855 B13R1.575 CNc1cc(ccc1C)OCCO 34a_100012283766_200000210301 [0,1,0,0,0,0|3,0,0]=4 2856 B13R1.575 CNc1cc(ccc1C)OCCO 7a_100012283766_200000210301 [0,1,0,0,0,0|3,0,0]=4 2857 B13R1.575 CNc1cc(ccc1C)SCCF 62a_100011217306_100020629602 [0,1,0,0,0,0|3,0,0]=4 2858 B13R1.575 CNc1cc(ccc1C)SCCF 62a_100020629602_100011217306 [0,1,0,0,0,0|3,0,0]=4 2859 B13R1.575 CNc1cc(ccc1C)SCCO 62a_100000211926_100020629602 [0,1,0,0,0,0|3,0,0]=4 2860 B13R1.575 CNc1cc(ccc1C)SCCO 62a_100020629602_100000211926 [0,1,0,0,0,0|3,0,0]=4 2861 B13R1.575 CNc1cc(ccc1C)SCOC 62a_100000766300_100020629602 [0,1,0,0,0,0|3,0,0]=4 2862 B13R1.575 CNc1cc(ccc1C)SCOC 62a_100020629602_100000766300 [0,1,0,0,0,0|3,0,0]=4 2863 B13R1.575 CNc1cc(ccc1C)SCSC 62a_100011218213_100020629602 [0,1,0,0,0,0|3,0,0]=4 2864 B13R1.575 CNc1cc(ccc1C)SCSC 62a_100020629602_100011218213 [0,1,0,0,0,0|3,0,0]=4 2865 B13R1.575 CNc1cc(ccc1F)SCCF 62a_100011217306_100011314990 [0,1,0,0,0,0|3,0,0]=4 2866 B13R1.575 CNc1cc(ccc1F)SCCF 62a_100011314990_100011217306 [0,1,0,0,0,0|3,0,0]=4 2867 B13R1.575 CNc1cc(ccc1F)SCCO 62a_100000211926_100011314990 [0,1,0,0,0,0|3,0,0]=4 2868 B13R1.575 CNc1cc(ccc1F)SCCO 62a_100011314990_100000211926 [0,1,0,0,0,0|3,0,0]=4 2869 B13R1.575 CNc1cc(ccc1F)SCOC 62a_100000766300_100011314990 [0,1,0,0,0,0|3,0,0]=4 2870 B13R1.575 CNc1cc(ccc1F)SCOC 62a_100011314990_100000766300 [0,1,0,0,0,0|3,0,0]=4 2871 B13R1.575 CNc1cc(ccc1F)SCSC 62a_100011218213_100011314990 [0,1,0,0,0,0|3,0,0]=4 2872 B13R1.575 CNc1cc(ccc1F)SCSC 62a_100011314990_100011218213 [0,1,0,0,0,0|3,0,0]=4 2873 B13R1.575 CNc1cc(ccc1N)SCCF 62a_100000694363_100011217306 [0,1,0,0,0,0|3,0,0]=4 2874 B13R1.575 CNc1cc(ccc1N)SCCO 62a_100000694363_100000211926 [0,1,0,0,0,0|3,0,0]=4 2875 B13R1.575 CNc1cc(ccc1N)SCOC 62a_100000694363_100000766300 [0,1,0,0,0,0|3,0,0]=4 2876 B13R1.575 CNc1cc(ccc1N)SCSC 62a_100000694363_100011218213 [0,1,0,0,0,0|3,0,0]=4 2877 B13R1.575 COCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000766300 [0,1,0,0,0,0|2,0,0]=3 2878 B13R1.575 COCNc1ccc(c(c1)OC)C 2230a_100011279678_100000766300 [0,1,0,0,0,0|2,0,0]=3 2879 B13R1.575 COCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000766300 [0,1,0,0,0,0|2,0,0]=3 2880 B13R1.575 COCNc1ccc(c(c1)OC)F 2230a_100000701188_100000766300 [0,1,0,0,0,0|2,0,0]=3 2881 B13R1.575 COCOc1ccc(c(c1)SC)C 62a_200000210301_200015918306 [0,1,0,0,0,0|2,1,0]=4 2882 B13R1.575 COCOc1ccc(c(c1)SC)C 62a_200015918306_200000210301 [0,1,0,0,0,0|2,1,0]=4 2883 B13R1.575 COCOc1ccc(c(c1)S[13CH3])C 62a_200015918306_200025704644 [0,1,0,0,0,0|2,1,0]=4 2884 B13R1.575 COCOc1ccc(c(c1)S[13CH3])C 62a_200025704644_200015918306 [0,1,0,0,0,0|2,1,0]=4 2885 B13R1.575 COCSc1c[nH]c(=O)c(c1)OC 62a_100000766300_100010125397 [0,1,0,0,0,0|2,0,1]=4 2886 B13R1.575 COCSc1cc(c(cn1)C)OC 62a_100000766300_100010067687 [0,1,0,0,0,0|3,0,0]=4 2887 B13R1.575 COCSc1cc(c(cn1)C)OC 62a_100010067687_100000766300 [0,1,0,0,0,0|3,0,0]=4 2888 B13R1.575 COCSc1cc(c(cn1)F)OC 62a_100000766300_200010136270 [0,1,0,0,0,0|3,0,0]=4 2889 B13R1.575 COCSc1cc(c(cn1)F)OC 62a_200010136270_100000766300 [0,1,0,0,0,0|3,0,0]=4 2890 B13R1.575 COCSc1cc(c(cn1)N)OC 62a_100000766300_100009887741 [0,1,0,0,0,0|3,0,0]=4 2891 B13R1.575 COCSc1cc(c(cn1)N)OC 62a_100009887741_100000766300 [0,1,0,0,0,0|3,0,0]=4 2892 B13R1.575 COCSc1ccc(c(c1)C#N)O 62a_100000766300_100000687585 [0,1,0,0,0,0|3,0,0]=4 2893 B13R1.575 COCSc1ccc(c(c1)C=O)O 62a_100000766300_100000186750 [0,1,0,0,0,0|3,0,0]=4 2894 B13R1.575 COCSc1ccc(c(c1)CN)O 62a_100000730032_100000766300 [0,1,0,0,0,0|3,0,0]=4 2895 B13R1.575 COCSc1ccc(c(c1)CN)O 62a_100000766300_100000730032 [0,1,0,0,0,0|3,0,0]=4 2896 B13R1.575 COCSc1ccc(c(c1)CO)O 62a_100000184703_100000766300 [0,1,0,0,0,0|3,0,0]=4 2897 B13R1.575 COCSc1ccc(c(c1)CO)O 62a_100000766300_100000184703 [0,1,0,0,0,0|3,0,0]=4 2898 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100000766300_100012353699 [0,1,0,0,0,0|2,0,0]=3 2899 B13R1.575 COCSc1ccc(c(c1)OC)Br 62a_100012353699_100000766300 [0,1,0,0,0,0|2,0,0]=3 2900 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100000766300_100011830276 [0,1,0,0,0,0|2,0,0]=3 2901 B13R1.575 COCSc1ccc(c(c1)OC)C 62a_100011830276_100000766300 [0,1,0,0,0,0|2,0,0]=3 2902 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100000766300_100011356853 [0,1,0,0,0,0|2,0,0]=3 2903 B13R1.575 COCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000766300 [0,1,0,0,0,0|2,0,0]=3 2904 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100000766300_100011934186 [0,1,0,0,0,0|2,0,0]=3 2905 B13R1.575 COCSc1ccc(c(c1)OC)F 62a_100011934186_100000766300 [0,1,0,0,0,0|2,0,0]=3 2906 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100000766300_100015196925 [0,1,0,0,0,0|2,0,0]=3 2907 B13R1.575 COCSc1ccc(c(c1)OC)N 62a_100011279103_100000766300 [0,1,0,0,0,0|2,0,0]=3 2908 B13R1.575 COCSc1ccc(c(c1)OC)O 62a_100000766300_100000694246 [0,1,0,0,0,0|1,0,0]=2 2909 B13R1.575 COCSc1ccc(c(c1)SC)F 62a_100000766300_100010341305 [0,1,0,0,0,0|2,1,0]=4 2910 B13R1.575 COCSc1ccc(c(c1)SC)F 62a_100010341305_100000766300 [0,1,0,0,0,0|2,1,0]=4 2911 B13R1.575 COCSc1ccc(c(n1)OC)N 62a_100000687816_100000766300 [0,1,0,0,0,0|3,0,0]=4 2912 B13R1.575 COCSc1ccc(c(n1)OC)N 62a_100000766300_100000687816 [0,1,0,0,0,0|3,0,0]=4 2913 B13R1.575 COCSc1ccc(c(n1)OC)O 62a_100000766300_100010893133 [0,1,0,0,0,0|2,0,0]=3 2914 B13R1.575 COCSc1cnc(c(c1)OC)C 62a_100000766300_100010254219 [0,1,0,0,0,0|3,0,0]=4 2915 B13R1.575 COCSc1cnc(c(c1)OC)C 62a_100010254219_100000766300 [0,1,0,0,0,0|3,0,0]=4 2916 B13R1.575 COCSc1cnc(c(c1)OC)F 62a_100000766300_100010214931 [0,1,0,0,0,0|3,0,0]=4 2917 B13R1.575 COCSc1cnc(c(c1)OC)F 62a_100010214931_100000766300 [0,1,0,0,0,0|3,0,0]=4 2918 B13R1.575 COCSc1cnc(c(c1)OC)N 62a_100000766300_106354213024 [0,1,0,0,0,0|3,0,0]=4 2919 B13R1.575 COCSc1cnc(c(c1)OC)N 62a_106354213024_100000766300 [0,1,0,0,0,0|3,0,0]=4 2920 B13R1.575 COCSc1cnc(c(n1)OC)O 62a_100000766300_200010365344 [0,1,0,0,0,0|3,0,0]=4 2921 B13R1.575 COCSc1cnc(c(n1)OC)O 62a_200010365344_100000766300 [0,1,0,0,0,0|3,0,0]=4 2922 B13R1.575 COc1cc(c[nH]c1=O)SCCF 62a_100011217306_100010125397 [0,1,0,0,0,0|2,0,1]=4 2923 B13R1.575 COc1cc(c[nH]c1=O)SCCO 62a_100000211926_100010125397 [0,1,0,0,0,0|2,0,1]=4 2924 B13R1.575 COc1cc(c[nH]c1=O)SCSC 62a_100011218213_100010125397 [0,1,0,0,0,0|2,0,1]=4 2925 B13R1.575 COc1cc(ccc1Br)COCF 34a_100010234685_100015361967 [0,1,0,0,0,0|2,0,0]=3 2926 B13R1.575 COc1cc(ccc1Br)COCF 7a_100010234685_100015361967 [0,1,0,0,0,0|2,0,0]=3 2927 B13R1.575 COc1cc(ccc1Br)CSCF 62a_100010110085_100015361967 [0,1,0,0,0,0|2,0,0]=3 2928 B13R1.575 COc1cc(ccc1Br)CSCF 62a_100015361967_100010110085 [0,1,0,0,0,0|2,0,0]=3 2929 B13R1.575 COc1cc(ccc1Br)NCC#N 2230a_100000765947_100011215382 [0,1,0,0,0,0|2,0,1]=4 2930 B13R1.575 COc1cc(ccc1Br)NCC=O 2230a_100000765947_200015260668 [0,1,0,0,0,0|2,0,1]=4 2931 B13R1.575 COc1cc(ccc1Br)NCC=O 34a_100000765947_200009817547 [0,1,0,0,0,0|2,0,1]=4 2932 B13R1.575 COc1cc(ccc1Br)NCCF 2230a_100000765947_100011217306 [0,1,0,0,0,0|2,0,0]=3 2933 B13R1.575 COc1cc(ccc1Br)NCCF 34a_100000765947_100011217306 [0,1,0,0,0,0|2,0,0]=3 2934 B13R1.575 COc1cc(ccc1Br)NCCO 2230a_100000765947_100000211926 [0,1,0,0,0,0|2,0,0]=3 2935 B13R1.575 COc1cc(ccc1Br)NCCO 34a_100000765947_100000211926 [0,1,0,0,0,0|2,0,0]=3 2936 B13R1.575 COc1cc(ccc1Br)NCSC 2230a_100000765947_100011218213 [0,1,0,0,0,0|2,0,0]=3 2937 B13R1.575 COc1cc(ccc1Br)NCSC 34a_100000765947_100011218213 [0,1,0,0,0,0|2,0,0]=3 2938 B13R1.575 COc1cc(ccc1Br)OCC#N 7a_100011827694_100011215382 [0,1,0,0,0,0|2,0,1]=4 2939 B13R1.575 COc1cc(ccc1Br)OCC=O 34a_100011827694_200009817547 [0,1,0,0,0,0|2,0,1]=4 2940 B13R1.575 COc1cc(ccc1Br)OCC=O 7a_100011827694_200015260668 [0,1,0,0,0,0|2,0,1]=4 2941 B13R1.575 COc1cc(ccc1Br)OCCF 34a_100011827694_100011217306 [0,1,0,0,0,0|2,0,0]=3 2942 B13R1.575 COc1cc(ccc1Br)OCCF 7a_100011827694_100011217306 [0,1,0,0,0,0|2,0,0]=3 2943 B13R1.575 COc1cc(ccc1Br)OCCO 34a_100011827694_100000211926 [0,1,0,0,0,0|2,0,0]=3 2944 B13R1.575 COc1cc(ccc1Br)OCCO 7a_100011827694_100000211926 [0,1,0,0,0,0|2,0,0]=3 2945 B13R1.575 COc1cc(ccc1Br)OCSC 34a_100011827694_100011218213 [0,1,0,0,0,0|2,0,0]=3 2946 B13R1.575 COc1cc(ccc1Br)SCC#N 62a_100011215382_100012353699 [0,1,0,0,0,0|2,0,1]=4 2947 B13R1.575 COc1cc(ccc1Br)SCC#N 62a_100012353699_100011215382 [0,1,0,0,0,0|2,0,1]=4 2948 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_100012353699_200015260668 [0,1,0,0,0,0|2,0,1]=4 2949 B13R1.575 COc1cc(ccc1Br)SCC=O 62a_200015260668_100012353699 [0,1,0,0,0,0|2,0,1]=4 2950 B13R1.575 COc1cc(ccc1Br)SCCF 62a_100011217306_100012353699 [0,1,0,0,0,0|2,0,0]=3 2951 B13R1.575 COc1cc(ccc1Br)SCCF 62a_100012353699_100011217306 [0,1,0,0,0,0|2,0,0]=3 2952 B13R1.575 COc1cc(ccc1Br)SCCO 62a_100000211926_100012353699 [0,1,0,0,0,0|2,0,0]=3 2953 B13R1.575 COc1cc(ccc1Br)SCCO 62a_100012353699_100000211926 [0,1,0,0,0,0|2,0,0]=3 2954 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100011218213_100012353699 [0,1,0,0,0,0|2,0,0]=3 2955 B13R1.575 COc1cc(ccc1Br)SCSC 62a_100012353699_100011218213 [0,1,0,0,0,0|2,0,0]=3 2956 B13R1.575 COc1cc(ccc1C)COCF 34a_100000752651_100015361967 [0,1,0,0,0,0|2,0,0]=3 2957 B13R1.575 COc1cc(ccc1C)COCF 7a_100000752651_100015361967 [0,1,0,0,0,0|2,0,0]=3 2958 B13R1.575 COc1cc(ccc1C)NCC#N 2230a_100011279678_100011215382 [0,1,0,0,0,0|2,0,1]=4 2959 B13R1.575 COc1cc(ccc1C)NCC=O 2230a_100011279678_200015260668 [0,1,0,0,0,0|2,0,1]=4 2960 B13R1.575 COc1cc(ccc1C)NCC=O 34a_100011279678_200009817547 [0,1,0,0,0,0|2,0,1]=4 2961 B13R1.575 COc1cc(ccc1C)NCCF 2230a_100011279678_100011217306 [0,1,0,0,0,0|2,0,0]=3 2962 B13R1.575 COc1cc(ccc1C)NCCF 34a_100011279678_100011217306 [0,1,0,0,0,0|2,0,0]=3 2963 B13R1.575 COc1cc(ccc1C)NCCO 2230a_100011279678_100000211926 [0,1,0,0,0,0|2,0,0]=3 2964 B13R1.575 COc1cc(ccc1C)NCCO 34a_100000057592_200000210301 [0,1,0,0,0,0|2,0,0]=3 2965 B13R1.575 COc1cc(ccc1C)NCCO 34a_100011279678_100000211926 [0,1,0,0,0,0|2,0,0]=3 2966 B13R1.575 COc1cc(ccc1C)NCCO 7a_100000057592_200000210301 [0,1,0,0,0,0|2,0,0]=3 2967 B13R1.575 COc1cc(ccc1C)NCSC 2230a_100011279678_100011218213 [0,1,0,0,0,0|2,0,0]=3 2968 B13R1.575 COc1cc(ccc1C)NCSC 34a_100011279678_100011218213 [0,1,0,0,0,0|2,0,0]=3 2969 B13R1.575 COc1cc(ccc1C)OCC#N 7a_100009865632_100011215382 [0,1,0,0,0,0|2,0,1]=4 2970 B13R1.575 COc1cc(ccc1C)OCC=O 34a_100009865632_200009817547 [0,1,0,0,0,0|2,0,1]=4 2971 B13R1.575 COc1cc(ccc1C)OCC=O 7a_100009865632_200015260668 [0,1,0,0,0,0|2,0,1]=4 2972 B13R1.575 COc1cc(ccc1C)OCCF 34a_100009865632_100011217306 [0,1,0,0,0,0|2,0,0]=3 2973 B13R1.575 COc1cc(ccc1C)OCCF 7a_100009865632_100011217306 [0,1,0,0,0,0|2,0,0]=3 2974 B13R1.575 COc1cc(ccc1C)OCCO 34a_100009865632_100000211926 [0,1,0,0,0,0|2,0,0]=3 2975 B13R1.575 COc1cc(ccc1C)OCCO 7a_100009865632_100000211926 [0,1,0,0,0,0|2,0,0]=3 2976 B13R1.575 COc1cc(ccc1C)OCSC 34a_100009865632_100011218213 [0,1,0,0,0,0|2,0,0]=3 2977 B13R1.575 COc1cc(ccc1C)SCC#N 62a_100011215382_100011830276 [0,1,0,0,0,0|2,0,1]=4 2978 B13R1.575 COc1cc(ccc1C)SCC#N 62a_100011830276_100011215382 [0,1,0,0,0,0|2,0,1]=4 2979 B13R1.575 COc1cc(ccc1C)SCC=O 62a_100011830276_200015260668 [0,1,0,0,0,0|2,0,1]=4 2980 B13R1.575 COc1cc(ccc1C)SCC=O 62a_200015260668_100011830276 [0,1,0,0,0,0|2,0,1]=4 2981 B13R1.575 COc1cc(ccc1C)SCCF 62a_100011217306_100011830276 [0,1,0,0,0,0|2,0,0]=3 2982 B13R1.575 COc1cc(ccc1C)SCCF 62a_100011830276_100011217306 [0,1,0,0,0,0|2,0,0]=3 2983 B13R1.575 COc1cc(ccc1C)SCCO 62a_100000211926_100011830276 [0,1,0,0,0,0|2,0,0]=3 2984 B13R1.575 COc1cc(ccc1C)SCCO 62a_100011830276_100000211926 [0,1,0,0,0,0|2,0,0]=3 2985 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011218213_100011830276 [0,1,0,0,0,0|2,0,0]=3 2986 B13R1.575 COc1cc(ccc1C)SCSC 62a_100011830276_100011218213 [0,1,0,0,0,0|2,0,0]=3 2987 B13R1.575 COc1cc(ccc1Cl)CNCF 34a_100015204853_100015361967 [0,1,0,0,0,0|2,0,0]=3 2988 B13R1.575 COc1cc(ccc1Cl)COCF 34a_100012179228_100015361967 [0,1,0,0,0,0|2,0,0]=3 2989 B13R1.575 COc1cc(ccc1Cl)CSCF 62a_100015361967_200010214485 [0,1,0,0,0,0|2,0,0]=3 2990 B13R1.575 COc1cc(ccc1Cl)CSCF 62a_200010214485_100015361967 [0,1,0,0,0,0|2,0,0]=3 2991 B13R1.575 COc1cc(ccc1Cl)NCC#N 2230a_100000742311_100011215382 [0,1,0,0,0,0|2,0,1]=4 2992 B13R1.575 COc1cc(ccc1Cl)NCC=O 2230a_100000742311_200015260668 [0,1,0,0,0,0|2,0,1]=4 2993 B13R1.575 COc1cc(ccc1Cl)NCC=O 34a_100000742311_200009817547 [0,1,0,0,0,0|2,0,1]=4 2994 B13R1.575 COc1cc(ccc1Cl)NCCF 2230a_100000742311_100011217306 [0,1,0,0,0,0|2,0,0]=3 2995 B13R1.575 COc1cc(ccc1Cl)NCCF 34a_100000742311_100011217306 [0,1,0,0,0,0|2,0,0]=3 2996 B13R1.575 COc1cc(ccc1Cl)NCCO 2230a_100000742311_100000211926 [0,1,0,0,0,0|2,0,0]=3 2997 B13R1.575 COc1cc(ccc1Cl)NCCO 34a_100000742311_100000211926 [0,1,0,0,0,0|2,0,0]=3 2998 B13R1.575 COc1cc(ccc1Cl)NCSC 2230a_100000742311_100011218213 [0,1,0,0,0,0|2,0,0]=3 2999 B13R1.575 COc1cc(ccc1Cl)NCSC 34a_100000742311_100011218213 [0,1,0,0,0,0|2,0,0]=3 3000 B13R1.575 COc1cc(ccc1Cl)OCC#N 7a_100012186310_100011215382 [0,1,0,0,0,0|2,0,1]=4 3001 B13R1.575 COc1cc(ccc1Cl)OCC=O 34a_100012186310_200009817547 [0,1,0,0,0,0|2,0,1]=4 3002 B13R1.575 COc1cc(ccc1Cl)OCC=O 7a_100012186310_200015260668 [0,1,0,0,0,0|2,0,1]=4 3003 B13R1.575 COc1cc(ccc1Cl)OCCF 34a_100012186310_100011217306 [0,1,0,0,0,0|2,0,0]=3 3004 B13R1.575 COc1cc(ccc1Cl)OCCF 7a_100012186310_100011217306 [0,1,0,0,0,0|2,0,0]=3 3005 B13R1.575 COc1cc(ccc1Cl)OCCO 34a_100012186310_100000211926 [0,1,0,0,0,0|2,0,0]=3 3006 B13R1.575 COc1cc(ccc1Cl)OCCO 7a_100012186310_100000211926 [0,1,0,0,0,0|2,0,0]=3 3007 B13R1.575 COc1cc(ccc1Cl)OCSC 34a_100012186310_100011218213 [0,1,0,0,0,0|2,0,0]=3 3008 B13R1.575 COc1cc(ccc1Cl)SCC#N 62a_100011215382_100011356853 [0,1,0,0,0,0|2,0,1]=4 3009 B13R1.575 COc1cc(ccc1Cl)SCC#N 62a_100011356853_100011215382 [0,1,0,0,0,0|2,0,1]=4 3010 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_100011356853_200015260668 [0,1,0,0,0,0|2,0,1]=4 3011 B13R1.575 COc1cc(ccc1Cl)SCC=O 62a_200015260668_100011356853 [0,1,0,0,0,0|2,0,1]=4 3012 B13R1.575 COc1cc(ccc1Cl)SCCF 62a_100011217306_100011356853 [0,1,0,0,0,0|2,0,0]=3 3013 B13R1.575 COc1cc(ccc1Cl)SCCF 62a_100011356853_100011217306 [0,1,0,0,0,0|2,0,0]=3 3014 B13R1.575 COc1cc(ccc1Cl)SCCO 62a_100000211926_100011356853 [0,1,0,0,0,0|2,0,0]=3 3015 B13R1.575 COc1cc(ccc1Cl)SCCO 62a_100011356853_100000211926 [0,1,0,0,0,0|2,0,0]=3 3016 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011218213_100011356853 [0,1,0,0,0,0|2,0,0]=3 3017 B13R1.575 COc1cc(ccc1Cl)SCSC 62a_100011356853_100011218213 [0,1,0,0,0,0|2,0,0]=3 3018 B13R1.575 COc1cc(ccc1F)CNCF 34a_100020626639_100015361967 [0,1,0,0,0,0|2,0,0]=3 3019 B13R1.575 COc1cc(ccc1F)COCF 34a_100000692429_100015361967 [0,1,0,0,0,0|2,0,0]=3 3020 B13R1.575 COc1cc(ccc1F)COCF 7a_100000692429_100015361967 [0,1,0,0,0,0|2,0,0]=3 3021 B13R1.575 COc1cc(ccc1F)CSCF 62a_100012349856_100015361967 [0,1,0,0,0,0|2,0,0]=3 3022 B13R1.575 COc1cc(ccc1F)CSCF 62a_100015361967_100012349856 [0,1,0,0,0,0|2,0,0]=3 3023 B13R1.575 COc1cc(ccc1F)NCC#N 2230a_100000701188_100011215382 [0,1,0,0,0,0|2,0,1]=4 3024 B13R1.575 COc1cc(ccc1F)NCC=O 2230a_100000701188_200015260668 [0,1,0,0,0,0|2,0,1]=4 3025 B13R1.575 COc1cc(ccc1F)NCC=O 34a_100000701188_200009817547 [0,1,0,0,0,0|2,0,1]=4 3026 B13R1.575 COc1cc(ccc1F)NCCF 2230a_100000701188_100011217306 [0,1,0,0,0,0|2,0,0]=3 3027 B13R1.575 COc1cc(ccc1F)NCCF 34a_100000701188_100011217306 [0,1,0,0,0,0|2,0,0]=3 3028 B13R1.575 COc1cc(ccc1F)NCCO 2230a_100000701188_100000211926 [0,1,0,0,0,0|2,0,0]=3 3029 B13R1.575 COc1cc(ccc1F)NCCO 34a_100000701188_100000211926 [0,1,0,0,0,0|2,0,0]=3 3030 B13R1.575 COc1cc(ccc1F)NCSC 2230a_100000701188_100011218213 [0,1,0,0,0,0|2,0,0]=3 3031 B13R1.575 COc1cc(ccc1F)NCSC 34a_100000701188_100011218213 [0,1,0,0,0,0|2,0,0]=3 3032 B13R1.575 COc1cc(ccc1F)OCC#N 7a_100012001760_100011215382 [0,1,0,0,0,0|2,0,1]=4 3033 B13R1.575 COc1cc(ccc1F)OCC=O 34a_100012001760_200009817547 [0,1,0,0,0,0|2,0,1]=4 3034 B13R1.575 COc1cc(ccc1F)OCC=O 7a_100012001760_200015260668 [0,1,0,0,0,0|2,0,1]=4 3035 B13R1.575 COc1cc(ccc1F)OCCF 34a_100012001760_100011217306 [0,1,0,0,0,0|2,0,0]=3 3036 B13R1.575 COc1cc(ccc1F)OCCF 7a_100012001760_100011217306 [0,1,0,0,0,0|2,0,0]=3 3037 B13R1.575 COc1cc(ccc1F)OCCO 34a_100012001760_100000211926 [0,1,0,0,0,0|2,0,0]=3 3038 B13R1.575 COc1cc(ccc1F)OCCO 7a_100012001760_100000211926 [0,1,0,0,0,0|2,0,0]=3 3039 B13R1.575 COc1cc(ccc1F)OCSC 34a_100012001760_100011218213 [0,1,0,0,0,0|2,0,0]=3 3040 B13R1.575 COc1cc(ccc1F)SCC#N 62a_100011215382_100011934186 [0,1,0,0,0,0|2,0,1]=4 3041 B13R1.575 COc1cc(ccc1F)SCC#N 62a_100011934186_100011215382 [0,1,0,0,0,0|2,0,1]=4 3042 B13R1.575 COc1cc(ccc1F)SCC=O 62a_100011934186_200015260668 [0,1,0,0,0,0|2,0,1]=4 3043 B13R1.575 COc1cc(ccc1F)SCC=O 62a_200015260668_100011934186 [0,1,0,0,0,0|2,0,1]=4 3044 B13R1.575 COc1cc(ccc1F)SCCF 62a_100011217306_100011934186 [0,1,0,0,0,0|2,0,0]=3 3045 B13R1.575 COc1cc(ccc1F)SCCF 62a_100011934186_100011217306 [0,1,0,0,0,0|2,0,0]=3 3046 B13R1.575 COc1cc(ccc1F)SCCO 62a_100000211926_100011934186 [0,1,0,0,0,0|2,0,0]=3 3047 B13R1.575 COc1cc(ccc1F)SCCO 62a_100011934186_100000211926 [0,1,0,0,0,0|2,0,0]=3 3048 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011218213_100011934186 [0,1,0,0,0,0|2,0,0]=3 3049 B13R1.575 COc1cc(ccc1F)SCSC 62a_100011934186_100011218213 [0,1,0,0,0,0|2,0,0]=3 3050 B13R1.575 COc1cc(ccc1I)NCC=O 34a_100000746945_200009817547 [0,1,0,0,0,0|2,0,1]=4 3051 B13R1.575 COc1cc(ccc1I)NCCF 34a_100000746945_100011217306 [0,1,0,0,0,0|2,0,0]=3 3052 B13R1.575 COc1cc(ccc1I)NCCO 34a_100000746945_100000211926 [0,1,0,0,0,0|2,0,0]=3 3053 B13R1.575 COc1cc(ccc1I)NCSC 34a_100000746945_100011218213 [0,1,0,0,0,0|2,0,0]=3 3054 B13R1.575 COc1cc(ccc1N)COCF 34a_100000087641_100015361967 [0,1,0,0,0,0|2,0,0]=3 3055 B13R1.575 COc1cc(ccc1N)OCC#N 7a_100015326901_100011215382 [0,1,0,0,0,0|2,0,1]=4 3056 B13R1.575 COc1cc(ccc1N)OCC=O 34a_100015326901_200009817547 [0,1,0,0,0,0|2,0,1]=4 3057 B13R1.575 COc1cc(ccc1N)OCC=O 7a_100015326901_200015260668 [0,1,0,0,0,0|2,0,1]=4 3058 B13R1.575 COc1cc(ccc1N)OCCF 34a_100015326901_100011217306 [0,1,0,0,0,0|2,0,0]=3 3059 B13R1.575 COc1cc(ccc1N)OCCF 7a_100015326901_100011217306 [0,1,0,0,0,0|2,0,0]=3 3060 B13R1.575 COc1cc(ccc1N)OCCO 34a_100015326901_100000211926 [0,1,0,0,0,0|2,0,0]=3 3061 B13R1.575 COc1cc(ccc1N)OCCO 7a_100015326901_100000211926 [0,1,0,0,0,0|2,0,0]=3 3062 B13R1.575 COc1cc(ccc1N)OCSC 34a_100015326901_100011218213 [0,1,0,0,0,0|2,0,0]=3 3063 B13R1.575 COc1cc(ccc1N)SCC#N 62a_100011215382_100015196925 [0,1,0,0,0,0|2,0,1]=4 3064 B13R1.575 COc1cc(ccc1N)SCC#N 62a_100011279103_100011215382 [0,1,0,0,0,0|2,0,1]=4 3065 B13R1.575 COc1cc(ccc1N)SCC=O 62a_100011279103_200015260668 [0,1,0,0,0,0|2,0,1]=4 3066 B13R1.575 COc1cc(ccc1N)SCC=O 62a_200015260668_100015196925 [0,1,0,0,0,0|2,0,1]=4 3067 B13R1.575 COc1cc(ccc1N)SCCF 62a_100011217306_100015196925 [0,1,0,0,0,0|2,0,0]=3 3068 B13R1.575 COc1cc(ccc1N)SCCF 62a_100011279103_100011217306 [0,1,0,0,0,0|2,0,0]=3 3069 B13R1.575 COc1cc(ccc1N)SCCO 62a_100000211926_100015196925 [0,1,0,0,0,0|2,0,0]=3 3070 B13R1.575 COc1cc(ccc1N)SCCO 62a_100011279103_100000211926 [0,1,0,0,0,0|2,0,0]=3 3071 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011218213_100015196925 [0,1,0,0,0,0|2,0,0]=3 3072 B13R1.575 COc1cc(ccc1N)SCSC 62a_100011279103_100011218213 [0,1,0,0,0,0|2,0,0]=3 3073 B13R1.575 COc1cc(ccc1O)CCN[13CH3] 34a_100000756042_200025704644 [0,1,0,0,0,0|0,0,0]=1 3074 B13R1.575 COc1cc(ccc1O)CCSC 62a_200000210301_100010741665 [0,1,0,0,0,0|0,0,0]=1 3075 B13R1.575 COc1cc(ccc1O)CCS[13CH3] 62a_200025704644_100010741665 [0,1,0,0,0,0|0,0,0]=1 3076 B13R1.575 COc1cc(ccc1O)CNCF 34a_100000185554_100015361967 [0,1,0,0,0,0|1,0,0]=2 3077 B13R1.575 COc1cc(ccc1O)NCC=O 34a_100000726020_200009817547 [0,1,0,0,0,0|1,0,1]=3 3078 B13R1.575 COc1cc(ccc1O)NCCF 34a_100000726020_100011217306 [0,1,0,0,0,0|1,0,0]=2 3079 B13R1.575 COc1cc(ccc1O)NCCO 34a_100000726020_100000211926 [0,1,0,0,0,0|1,0,0]=2 3080 B13R1.575 COc1cc(ccc1O)NCSC 34a_100000726020_100011218213 [0,1,0,0,0,0|1,0,0]=2 3081 B13R1.575 COc1cc(ccc1O)SCC#N 62a_100011215382_100000694246 [0,1,0,0,0,0|1,0,1]=3 3082 B13R1.575 COc1cc(ccc1O)SCC=O 62a_200015260668_100000694246 [0,1,0,0,0,0|1,0,1]=3 3083 B13R1.575 COc1cc(ccc1O)SCCF 62a_100011217306_100000694246 [0,1,0,0,0,0|1,0,0]=2 3084 B13R1.575 COc1cc(ccc1O)SCCO 62a_100000211926_100000694246 [0,1,0,0,0,0|1,0,0]=2 3085 B13R1.575 COc1cc(ccc1O)SCSC 62a_100011218213_100000694246 [0,1,0,0,0,0|1,0,0]=2 3086 B13R1.575 COc1cc(cnc1C)SCCF 62a_100010254219_100011217306 [0,1,0,0,0,0|3,0,0]=4 3087 B13R1.575 COc1cc(cnc1C)SCCF 62a_100011217306_100010254219 [0,1,0,0,0,0|3,0,0]=4 3088 B13R1.575 COc1cc(cnc1C)SCCO 62a_100000211926_100010254219 [0,1,0,0,0,0|3,0,0]=4 3089 B13R1.575 COc1cc(cnc1C)SCCO 62a_100010254219_100000211926 [0,1,0,0,0,0|3,0,0]=4 3090 B13R1.575 COc1cc(cnc1C)SCSC 62a_100010254219_100011218213 [0,1,0,0,0,0|3,0,0]=4 3091 B13R1.575 COc1cc(cnc1C)SCSC 62a_100011218213_100010254219 [0,1,0,0,0,0|3,0,0]=4 3092 B13R1.575 COc1cc(cnc1F)SCCF 62a_100010214931_100011217306 [0,1,0,0,0,0|3,0,0]=4 3093 B13R1.575 COc1cc(cnc1F)SCCF 62a_100011217306_100010214931 [0,1,0,0,0,0|3,0,0]=4 3094 B13R1.575 COc1cc(cnc1F)SCCO 62a_100000211926_100010214931 [0,1,0,0,0,0|3,0,0]=4 3095 B13R1.575 COc1cc(cnc1F)SCCO 62a_100010214931_100000211926 [0,1,0,0,0,0|3,0,0]=4 3096 B13R1.575 COc1cc(cnc1F)SCSC 62a_100010214931_100011218213 [0,1,0,0,0,0|3,0,0]=4 3097 B13R1.575 COc1cc(cnc1F)SCSC 62a_100011218213_100010214931 [0,1,0,0,0,0|3,0,0]=4 3098 B13R1.575 COc1cc(cnc1N)SCCF 62a_100011217306_106354213024 [0,1,0,0,0,0|3,0,0]=4 3099 B13R1.575 COc1cc(cnc1N)SCCF 62a_106354213024_100011217306 [0,1,0,0,0,0|3,0,0]=4 3100 B13R1.575 COc1cc(cnc1N)SCCO 62a_100000211926_106354213024 [0,1,0,0,0,0|3,0,0]=4 3101 B13R1.575 COc1cc(cnc1N)SCCO 62a_106354213024_100000211926 [0,1,0,0,0,0|3,0,0]=4 3102 B13R1.575 COc1cc(cnc1N)SCSC 62a_100011218213_106354213024 [0,1,0,0,0,0|3,0,0]=4 3103 B13R1.575 COc1cc(cnc1N)SCSC 62a_106354213024_100011218213 [0,1,0,0,0,0|3,0,0]=4 3104 B13R1.575 COc1cc(ncc1Br)COCF 34a_100010999569_100015361967 [0,1,0,0,0,0|3,0,0]=4 3105 B13R1.575 COc1cc(ncc1C)SCCF 62a_100010067687_100011217306 [0,1,0,0,0,0|3,0,0]=4 3106 B13R1.575 COc1cc(ncc1C)SCCF 62a_100011217306_100010067687 [0,1,0,0,0,0|3,0,0]=4 3107 B13R1.575 COc1cc(ncc1C)SCCO 62a_100000211926_100010067687 [0,1,0,0,0,0|3,0,0]=4 3108 B13R1.575 COc1cc(ncc1C)SCCO 62a_100010067687_100000211926 [0,1,0,0,0,0|3,0,0]=4 3109 B13R1.575 COc1cc(ncc1C)SCSC 62a_100010067687_100011218213 [0,1,0,0,0,0|3,0,0]=4 3110 B13R1.575 COc1cc(ncc1C)SCSC 62a_100011218213_100010067687 [0,1,0,0,0,0|3,0,0]=4 3111 B13R1.575 COc1cc(ncc1F)SCCF 62a_100011217306_200010136270 [0,1,0,0,0,0|3,0,0]=4 3112 B13R1.575 COc1cc(ncc1F)SCCF 62a_200010136270_100011217306 [0,1,0,0,0,0|3,0,0]=4 3113 B13R1.575 COc1cc(ncc1F)SCCO 62a_100000211926_200010136270 [0,1,0,0,0,0|3,0,0]=4 3114 B13R1.575 COc1cc(ncc1F)SCCO 62a_200010136270_100000211926 [0,1,0,0,0,0|3,0,0]=4 3115 B13R1.575 COc1cc(ncc1F)SCSC 62a_100011218213_200010136270 [0,1,0,0,0,0|3,0,0]=4 3116 B13R1.575 COc1cc(ncc1F)SCSC 62a_200010136270_100011218213 [0,1,0,0,0,0|3,0,0]=4 3117 B13R1.575 COc1cc(ncc1N)SCCF 62a_100009887741_100011217306 [0,1,0,0,0,0|3,0,0]=4 3118 B13R1.575 COc1cc(ncc1N)SCCF 62a_100011217306_100009887741 [0,1,0,0,0,0|3,0,0]=4 3119 B13R1.575 COc1cc(ncc1N)SCCO 62a_100000211926_100009887741 [0,1,0,0,0,0|3,0,0]=4 3120 B13R1.575 COc1cc(ncc1N)SCCO 62a_100009887741_100000211926 [0,1,0,0,0,0|3,0,0]=4 3121 B13R1.575 COc1cc(ncc1N)SCSC 62a_100009887741_100011218213 [0,1,0,0,0,0|3,0,0]=4 3122 B13R1.575 COc1cc(ncc1N)SCSC 62a_100011218213_100009887741 [0,1,0,0,0,0|3,0,0]=4 3123 B13R1.575 COc1nc(ccc1Br)CSCF 62a_100015361967_200010066506 [0,1,0,0,0,0|3,0,0]=4 3124 B13R1.575 COc1nc(ccc1Br)CSCF 62a_200010066506_100015361967 [0,1,0,0,0,0|3,0,0]=4 3125 B13R1.575 COc1nc(ccc1N)SCCF 62a_100000687816_100011217306 [0,1,0,0,0,0|3,0,0]=4 3126 B13R1.575 COc1nc(ccc1N)SCCF 62a_100011217306_100000687816 [0,1,0,0,0,0|3,0,0]=4 3127 B13R1.575 COc1nc(ccc1N)SCCO 62a_100000211926_100000687816 [0,1,0,0,0,0|3,0,0]=4 3128 B13R1.575 COc1nc(ccc1N)SCCO 62a_100000687816_100000211926 [0,1,0,0,0,0|3,0,0]=4 3129 B13R1.575 COc1nc(ccc1N)SCSC 62a_100000687816_100011218213 [0,1,0,0,0,0|3,0,0]=4 3130 B13R1.575 COc1nc(ccc1N)SCSC 62a_100011218213_100000687816 [0,1,0,0,0,0|3,0,0]=4 3131 B13R1.575 COc1nc(ccc1O)SCC#N 62a_100011215382_100010893133 [0,1,0,0,0,0|2,0,1]=4 3132 B13R1.575 COc1nc(ccc1O)SCC=O 62a_200015260668_100010893133 [0,1,0,0,0,0|2,0,1]=4 3133 B13R1.575 COc1nc(ccc1O)SCCF 62a_100011217306_100010893133 [0,1,0,0,0,0|2,0,0]=3 3134 B13R1.575 COc1nc(ccc1O)SCCO 62a_100000211926_100010893133 [0,1,0,0,0,0|2,0,0]=3 3135 B13R1.575 COc1nc(ccc1O)SCSC 62a_100011218213_100010893133 [0,1,0,0,0,0|2,0,0]=3 3136 B13R1.575 COc1nc(cnc1O)SCCF 62a_100011217306_200010365344 [0,1,0,0,0,0|3,0,0]=4 3137 B13R1.575 COc1nc(cnc1O)SCCF 62a_200010365344_100011217306 [0,1,0,0,0,0|3,0,0]=4 3138 B13R1.575 COc1nc(cnc1O)SCCO 62a_100000211926_200010365344 [0,1,0,0,0,0|3,0,0]=4 3139 B13R1.575 COc1nc(cnc1O)SCCO 62a_200010365344_100000211926 [0,1,0,0,0,0|3,0,0]=4 3140 B13R1.575 COc1nc(cnc1O)SCSC 62a_100011218213_200010365344 [0,1,0,0,0,0|3,0,0]=4 3141 B13R1.575 COc1nc(cnc1O)SCSC 62a_200010365344_100011218213 [0,1,0,0,0,0|3,0,0]=4 3142 B13R1.575 CSCNc1ccc(c(c1)C#N)O 34a_100011249283_100011218213 [0,1,0,0,0,0|3,0,0]=4 3143 B13R1.575 CSCSc1ccc(c(c1)C#N)O 62a_100011218213_100000687585 [0,1,0,0,0,0|3,0,0]=4 3144 B13R1.575 CSCSc1ccc(c(c1)C=O)O 62a_100011218213_100000186750 [0,1,0,0,0,0|3,0,0]=4 3145 B13R1.575 CSCSc1ccc(c(c1)CN)O 62a_100000730032_100011218213 [0,1,0,0,0,0|3,0,0]=4 3146 B13R1.575 CSCSc1ccc(c(c1)CN)O 62a_100011218213_100000730032 [0,1,0,0,0,0|3,0,0]=4 3147 B13R1.575 CSCSc1ccc(c(c1)CO)O 62a_100000184703_100011218213 [0,1,0,0,0,0|3,0,0]=4 3148 B13R1.575 CSCSc1ccc(c(c1)CO)O 62a_100011218213_100000184703 [0,1,0,0,0,0|3,0,0]=4 3149 B13R1.575 CSCSc1ccc(c(c1)SC)F 62a_100010341305_100011218213 [0,1,0,0,0,0|2,1,0]=4 3150 B13R1.575 CSCSc1ccc(c(c1)SC)F 62a_100011218213_100010341305 [0,1,0,0,0,0|2,1,0]=4 3151 B13R1.575 CSc1cc(ccc1C)SCCO 62a_100010989109_200000210301 [0,1,0,0,0,0|2,1,0]=4 3152 B13R1.575 CSc1cc(ccc1C)SCCO 62a_200000210301_100010989109 [0,1,0,0,0,0|2,1,0]=4 3153 B13R1.575 CSc1cc(ccc1F)SCCF 62a_100010341305_100011217306 [0,1,0,0,0,0|2,1,0]=4 3154 B13R1.575 CSc1cc(ccc1F)SCCF 62a_100011217306_100010341305 [0,1,0,0,0,0|2,1,0]=4 3155 B13R1.575 CSc1cc(ccc1F)SCCO 62a_100000211926_100010341305 [0,1,0,0,0,0|2,1,0]=4 3156 B13R1.575 CSc1cc(ccc1F)SCCO 62a_100010341305_100000211926 [0,1,0,0,0,0|2,1,0]=4 3157 B13R1.575 Cc1ccc(cc1N[13CH3])OCCO 2230a_100012283766_200025704644 [0,1,0,0,0,0|3,0,0]=4 3158 B13R1.575 Cc1ccc(cc1N[13CH3])OCCO 34a_100012283766_200025704644 [0,1,0,0,0,0|3,0,0]=4 3159 B13R1.575 Cc1ccc(cc1N[13CH3])OCCO 7a_100012283766_200025704644 [0,1,0,0,0,0|3,0,0]=4 3160 B13R1.575 Cc1ccc(cc1O[13CH3])NCCO 34a_100000057592_200025704644 [0,1,0,0,0,0|2,0,0]=3 3161 B13R1.575 Cc1ccc(cc1O[13CH3])NCCO 7a_100000057592_200025704644 [0,1,0,0,0,0|2,0,0]=3 3162 B13R1.575 Cc1ccc(cc1S[13CH3])SCCO 62a_100010989109_200025704644 [0,1,0,0,0,0|2,1,0]=4 3163 B13R1.575 Cc1ccc(cc1S[13CH3])SCCO 62a_200025704644_100010989109 [0,1,0,0,0,0|2,1,0]=4 3164 B13R1.575 N#Cc1cc(ccc1O)NCCF 34a_100011249283_100011217306 [0,1,0,0,0,0|3,0,0]=4 3165 B13R1.575 N#Cc1cc(ccc1O)NCCO 34a_100011249283_100000211926 [0,1,0,0,0,0|3,0,0]=4 3166 B13R1.575 N#Cc1cc(ccc1O)SCCF 62a_100011217306_100000687585 [0,1,0,0,0,0|3,0,0]=4 3167 B13R1.575 N#Cc1cc(ccc1O)SCCO 62a_100000211926_100000687585 [0,1,0,0,0,0|3,0,0]=4 3168 B13R1.575 NCc1cc(ccc1O)SCCF 62a_100000730032_100011217306 [0,1,0,0,0,0|3,0,0]=4 3169 B13R1.575 NCc1cc(ccc1O)SCCF 62a_100011217306_100000730032 [0,1,0,0,0,0|3,0,0]=4 3170 B13R1.575 NCc1cc(ccc1O)SCCO 62a_100000211926_100000730032 [0,1,0,0,0,0|3,0,0]=4 3171 B13R1.575 NCc1cc(ccc1O)SCCO 62a_100000730032_100000211926 [0,1,0,0,0,0|3,0,0]=4 3172 B13R1.575 O=Cc1cc(ccc1O)CSCF 62a_100015361967_100000008128 [0,1,0,0,0,0|3,0,0]=4 3173 B13R1.575 O=Cc1cc(ccc1O)SCCF 62a_100011217306_100000186750 [0,1,0,0,0,0|3,0,0]=4 3174 B13R1.575 O=Cc1cc(ccc1O)SCCO 62a_100000211926_100000186750 [0,1,0,0,0,0|3,0,0]=4 3175 B13R1.575 OCCSc1ccc(c(c1)CO)O 62a_100000184703_100000211926 [0,1,0,0,0,0|3,0,0]=4 3176 B13R1.575 OCCSc1ccc(c(c1)CO)O 62a_100000211926_100000184703 [0,1,0,0,0,0|3,0,0]=4 3177 B13R1.575 OCc1cc(ccc1O)SCCF 62a_100000184703_100011217306 [0,1,0,0,0,0|3,0,0]=4 3178 B13R1.575 OCc1cc(ccc1O)SCCF 62a_100011217306_100000184703 [0,1,0,0,0,0|3,0,0]=4 3179 B13R1.1255 CC=Cc1ccc(c(c1F)OC)Cl 271570a_100016259895_200135222481 [0,1,0,0,0,0|1,0,2]=4 3180 B13R1.1255 CC=Cc1ccc(c(c1F)OC)N 271570a_100016259895_100010734149 [0,1,0,0,0,0|1,0,2]=4 3181 B13R1.1255 CCNc1ccc(c(c1F)OC)F 34a_100137314619_100000210202 [0,1,0,0,0,0|2,0,0]=3 3182 B13R1.1255 CCOc1ccc(c(c1F)NC)F 34a_100000061554_200000210301 [0,1,0,0,0,0|3,0,0]=4 3183 B13R1.1255 CCOc1ccc(c(c1F)N[13CH3])F 34a_100000061554_200025704644 [0,1,0,0,0,0|3,0,0]=4 3184 B13R1.1255 CCOc1ccc(c(c1F)OC)F 34a_100000062073_100000210202 [0,1,0,0,0,0|2,0,0]=3 3185 B13R1.1255 CCOc1ccc(c(c1F)OC)F 7a_100000062073_100000210202 [0,1,0,0,0,0|2,0,0]=3 3186 B13R1.1255 CCSc1ccc(c(c1F)OC)Cl 62a_100000210202_200135222481 [0,1,0,0,0,0|2,0,0]=3 3187 B13R1.1255 CCSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000210202 [0,1,0,0,0,0|2,0,0]=3 3188 B13R1.1255 CCSc1ccc(c(c1F)OC)N 62a_100000210202_100010734149 [0,1,0,0,0,0|2,0,0]=3 3189 B13R1.1255 CCSc1ccc(c(c1F)OC)N 62a_100010734149_100000210202 [0,1,0,0,0,0|2,0,0]=3 3190 B13R1.1255 CCSc1ccc(c(c1F)SC)F 62a_100000210202_202125771753 [0,1,0,0,0,0|2,1,0]=4 3191 B13R1.1255 CCSc1ccc(c(c1F)SC)F 62a_202125771753_100000210202 [0,1,0,0,0,0|2,1,0]=4 3192 B13R1.1255 CNCc1ccc(c(c1F)OC)Br 207a_100102657272_200010981996 [0,1,0,0,0,0|2,0,0]=3 3193 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 207a_100102657272_100009889114 [0,1,0,0,0,0|2,0,0]=3 3194 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 2230a_106832991635_100010116237 [0,1,0,0,0,0|2,0,0]=3 3195 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 270004a_106832991635_100009889114 [0,1,0,0,0,0|2,0,0]=3 3196 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 34a_100102657272_100010116237 [0,1,0,0,0,0|2,0,0]=3 3197 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 34a_200009889119_200000210301 [0,1,0,0,0,0|2,0,0]=3 3198 B13R1.1255 CNCc1ccc(c(c1F)OC)Cl 7a_106832991635_100010116237 [0,1,0,0,0,0|2,0,0]=3 3199 B13R1.1255 CNCc1ccc(c(c1F)OC)F 207a_100102657272_100000050928 [0,1,0,0,0,0|2,0,0]=3 3200 B13R1.1255 CNCc1ccc(c(c1F)OC)F 2230a_106832991635_100009814548 [0,1,0,0,0,0|2,0,0]=3 3201 B13R1.1255 CNCc1ccc(c(c1F)OC)F 270004a_106832991635_100000050928 [0,1,0,0,0,0|2,0,0]=3 3202 B13R1.1255 CNCc1ccc(c(c1F)OC)F 34a_100102657272_100009814548 [0,1,0,0,0,0|2,0,0]=3 3203 B13R1.1255 CNCc1ccc(c(c1F)OC)F 34a_115082355467_200000210301 [0,1,0,0,0,0|2,0,0]=3 3204 B13R1.1255 CNCc1ccc(c(c1F)OC)F 7a_106832991635_100009814548 [0,1,0,0,0,0|2,0,0]=3 3205 B13R1.1255 CNCc1ncc(c(c1C)OC)C 2230a_106832991635_100000737168 [0,1,0,0,0,0|3,0,0]=4 3206 B13R1.1255 CNCc1ncc(c(c1C)OC)C 34a_100102657272_100000737168 [0,1,0,0,0,0|3,0,0]=4 3207 B13R1.1255 CNCc1ncc(c(c1C)OC)C 34a_200015187236_200000210301 [0,1,0,0,0,0|3,0,0]=4 3208 B13R1.1255 CNCc1ncc(c(c1C)OC)C 7a_106832991635_100000737168 [0,1,0,0,0,0|3,0,0]=4 3209 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 34a_100009889115_200000210301 [0,1,0,0,0,0|2,0,0]=3 3210 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 34a_100138415774_100010116237 [0,1,0,0,0,0|2,0,0]=3 3211 B13R1.1255 COCc1ccc(c(c1F)OC)Cl 7a_100009889115_200000210301 [0,1,0,0,0,0|2,0,0]=3 3212 B13R1.1255 COCc1ccc(c(c1F)OC)F 34a_100000081355_200000210301 [0,1,0,0,0,0|2,0,0]=3 3213 B13R1.1255 COCc1ccc(c(c1F)OC)F 34a_100138415774_100009814548 [0,1,0,0,0,0|2,0,0]=3 3214 B13R1.1255 COCc1ccc(c(c1F)OC)F 7a_100000081355_200000210301 [0,1,0,0,0,0|2,0,0]=3 3215 B13R1.1255 COCc1ncc(c(c1C)OC)C 34a_100011217710_200000210301 [0,1,0,0,0,0|3,0,0]=4 3216 B13R1.1255 COCc1ncc(c(c1C)OC)C 34a_100138415774_100000737168 [0,1,0,0,0,0|3,0,0]=4 3217 B13R1.1255 COc1c(ccc(c1F)CN[13CH3])Cl 34a_200009889119_200025704644 [0,1,0,0,0,0|2,0,0]=3 3218 B13R1.1255 COc1c(ccc(c1F)CN[13CH3])F 34a_115082355467_200025704644 [0,1,0,0,0,0|2,0,0]=3 3219 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])Cl 34a_100009889115_200025704644 [0,1,0,0,0,0|2,0,0]=3 3220 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])Cl 7a_100009889115_200025704644 [0,1,0,0,0,0|2,0,0]=3 3221 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])F 34a_100000081355_200025704644 [0,1,0,0,0,0|2,0,0]=3 3222 B13R1.1255 COc1c(ccc(c1F)CO[13CH3])F 7a_100000081355_200025704644 [0,1,0,0,0,0|2,0,0]=3 3223 B13R1.1255 COc1c(ccc(c1F)CSC)Cl 62a_100010116237_200000210301 [0,1,0,0,0,0|2,0,0]=3 3224 B13R1.1255 COc1c(ccc(c1F)CSC)Cl 62a_200000210301_100010116237 [0,1,0,0,0,0|2,0,0]=3 3225 B13R1.1255 COc1c(ccc(c1F)CSC)F 62a_100009814548_200000210301 [0,1,0,0,0,0|2,0,0]=3 3226 B13R1.1255 COc1c(ccc(c1F)CSC)F 62a_200000210301_100009814548 [0,1,0,0,0,0|2,0,0]=3 3227 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])Cl 62a_100010116237_200025704644 [0,1,0,0,0,0|2,0,0]=3 3228 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])Cl 62a_200025704644_100010116237 [0,1,0,0,0,0|2,0,0]=3 3229 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])F 62a_100009814548_200025704644 [0,1,0,0,0,0|2,0,0]=3 3230 B13R1.1255 COc1c(ccc(c1F)CS[13CH3])F 62a_200025704644_100009814548 [0,1,0,0,0,0|2,0,0]=3 3231 B13R1.1255 COc1c(ccc(c1F)NCF)F 34a_100137314619_100015361967 [0,1,0,0,0,0|3,0,0]=4 3232 B13R1.1255 COc1c(ccc(c1F)OCF)F 34a_100000062073_100015361967 [0,1,0,0,0,0|3,0,0]=4 3233 B13R1.1255 COc1c(ccc(c1F)OCF)F 7a_100000062073_100015361967 [0,1,0,0,0,0|3,0,0]=4 3234 B13R1.1255 COc1c(ccc(c1F)SCF)Cl 62a_100015361967_200135222481 [0,1,0,0,0,0|3,0,0]=4 3235 B13R1.1255 COc1c(ccc(c1F)SCF)Cl 62a_200135222481_100015361967 [0,1,0,0,0,0|3,0,0]=4 3236 B13R1.1255 COc1c(ccc(c1F)SCF)N 62a_100010734149_100015361967 [0,1,0,0,0,0|3,0,0]=4 3237 B13R1.1255 COc1c(ccc(c1F)SCF)N 62a_100015361967_100010734149 [0,1,0,0,0,0|3,0,0]=4 3238 B13R1.1255 COc1c(cnc(c1C)CN[13CH3])C 34a_200015187236_200025704644 [0,1,0,0,0,0|3,0,0]=4 3239 B13R1.1255 COc1c(cnc(c1C)CO[13CH3])C 34a_100011217710_200025704644 [0,1,0,0,0,0|3,0,0]=4 3240 B13R1.1255 COc1c(cnc(c1C)CSC)C 62a_100000737168_200000210301 [0,1,0,0,0,0|3,0,0]=4 3241 B13R1.1255 COc1c(cnc(c1C)CSC)C 62a_200000210301_100000737168 [0,1,0,0,0,0|3,0,0]=4 3242 B13R1.1255 COc1c(cnc(c1C)CS[13CH3])C 62a_100000737168_200025704644 [0,1,0,0,0,0|3,0,0]=4 3243 B13R1.1255 COc1c(cnc(c1C)CS[13CH3])C 62a_200025704644_100000737168 [0,1,0,0,0,0|3,0,0]=4 3244 B13R1.2900 C=C=Cc1cc(c(cc1F)O)OC 271570a_100015277604_100010189133 [0,1,0,0,0,0|0,0,3]=4 3245 B13R1.2900 CC=Cc1cc(c(cc1Br)Br)OC 271570a_100016259895_200014006352 [0,1,0,0,0,0|1,0,2]=4 3246 B13R1.2900 CC=Cc1cc(c(cc1C)F)OC 271570a_100016259895_100011009880 [0,1,0,0,0,0|1,0,2]=4 3247 B13R1.2900 CC=Cc1cc(c(cc1C)N)OC 271570a_100016259895_100010141321 [0,1,0,0,0,0|1,0,2]=4 3248 B13R1.2900 CC=Cc1cc(c(cc1F)Cl)OC 271570a_100016259895_100010739614 [0,1,0,0,0,0|1,0,2]=4 3249 B13R1.2900 CC=Cc1cc(c(cc1F)F)OC 271570a_100016259895_200015541288 [0,1,0,0,0,0|1,0,2]=4 3250 B13R1.2900 CC=Cc1cc(c(cc1F)N)OC 271570a_100016259895_100012766639 [0,1,0,0,0,0|1,0,2]=4 3251 B13R1.2900 CC=Cc1cc(c(cc1F)O)OC 271570a_100016259895_100010189133 [0,1,0,0,0,0|0,0,2]=3 3252 B13R1.2900 CC=Cc1cc(c(cc1N)C)OC 271570a_100016259895_200010584344 [0,1,0,0,0,0|1,0,2]=4 3253 B13R1.2900 CC=Cc1cc(c(cc1N)F)OC 271570a_100016259895_100010365326 [0,1,0,0,0,0|1,0,2]=4 3254 B13R1.2900 CCNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000210202 [0,1,0,0,0,0|2,0,0]=3 3255 B13R1.2900 CCNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000210202 [0,1,0,0,0,0|2,0,0]=3 3256 B13R1.2900 CCNc1cc(c(cc1Br)C)OC 34a_100010244135_100000210202 [0,1,0,0,0,0|2,0,0]=3 3257 B13R1.2900 CCNc1cc(c(cc1Br)C)OC 7a_100010244135_100000210202 [0,1,0,0,0,0|2,0,0]=3 3258 B13R1.2900 CCNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000210202 [0,1,0,0,0,0|2,0,0]=3 3259 B13R1.2900 CCNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000210202 [0,1,0,0,0,0|2,0,0]=3 3260 B13R1.2900 CCNc1cc(c(cc1Br)F)OC 34a_100010208193_100000210202 [0,1,0,0,0,0|2,0,0]=3 3261 B13R1.2900 CCNc1cc(c(cc1Br)F)OC 7a_100010208193_100000210202 [0,1,0,0,0,0|2,0,0]=3 3262 B13R1.2900 CCNc1cc(c(cc1C)Br)OC 34a_100010232211_100000210202 [0,1,0,0,0,0|2,0,0]=3 3263 B13R1.2900 CCNc1cc(c(cc1C)Br)OC 7a_100010232211_100000210202 [0,1,0,0,0,0|2,0,0]=3 3264 B13R1.2900 CCNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000210202 [0,1,0,0,0,0|2,0,0]=3 3265 B13R1.2900 CCNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000210202 [0,1,0,0,0,0|2,0,0]=3 3266 B13R1.2900 CCNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000210202 [0,1,0,0,0,0|2,0,0]=3 3267 B13R1.2900 CCNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000210202 [0,1,0,0,0,0|2,0,0]=3 3268 B13R1.2900 CCNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000210202 [0,1,0,0,0,0|2,0,0]=3 3269 B13R1.2900 CCNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000210202 [0,1,0,0,0,0|2,0,0]=3 3270 B13R1.2900 CCNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000210202 [0,1,0,0,0,0|2,0,0]=3 3271 B13R1.2900 CCNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000210202 [0,1,0,0,0,0|2,0,0]=3 3272 B13R1.2900 CCNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000210202 [0,1,0,0,0,0|2,0,0]=3 3273 B13R1.2900 CCNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000210202 [0,1,0,0,0,0|2,0,0]=3 3274 B13R1.2900 CCOc1cc(c(cc1F)Br)CC 34a_100011156610_100000210202 [0,1,0,0,0,0|3,0,0]=4 3275 B13R1.2900 CCOc1cc(c(cc1F)Br)CC 7a_100011156610_100000210202 [0,1,0,0,0,0|3,0,0]=4 3276 B13R1.2900 CCOc1cc(c(cc1O)O)C#N 271570a_203496583355_100009814618 [0,1,0,0,0,0|3,0,0]=4 3277 B13R1.2900 CCOc1cc(c(cc1O)O)C=O 271570a_203496583355_100009812231 [0,1,0,0,0,0|3,0,0]=4 3278 B13R1.2900 CCSc1cc(c(cc1Br)Br)OC 62a_100000210202_200014006352 [0,1,0,0,0,0|2,0,0]=3 3279 B13R1.2900 CCSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000210202 [0,1,0,0,0,0|2,0,0]=3 3280 B13R1.2900 CCSc1cc(c(cc1C)F)OC 62a_100000210202_100011009880 [0,1,0,0,0,0|2,0,0]=3 3281 B13R1.2900 CCSc1cc(c(cc1C)F)OC 62a_100011009880_100000210202 [0,1,0,0,0,0|2,0,0]=3 3282 B13R1.2900 CCSc1cc(c(cc1C)N)OC 62a_100000210202_100010141321 [0,1,0,0,0,0|2,0,0]=3 3283 B13R1.2900 CCSc1cc(c(cc1C)N)OC 62a_100010141321_100000210202 [0,1,0,0,0,0|2,0,0]=3 3284 B13R1.2900 CCSc1cc(c(cc1F)Cl)OC 62a_100000210202_100010739614 [0,1,0,0,0,0|2,0,0]=3 3285 B13R1.2900 CCSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000210202 [0,1,0,0,0,0|2,0,0]=3 3286 B13R1.2900 CCSc1cc(c(cc1F)F)OC 62a_100000210202_200015541288 [0,1,0,0,0,0|2,0,0]=3 3287 B13R1.2900 CCSc1cc(c(cc1F)F)OC 62a_200015541288_100000210202 [0,1,0,0,0,0|2,0,0]=3 3288 B13R1.2900 CCSc1cc(c(cc1F)N)NC 62a_100000210202_100013631271 [0,1,0,0,0,0|3,0,0]=4 3289 B13R1.2900 CCSc1cc(c(cc1F)N)NC 62a_100013631271_100000210202 [0,1,0,0,0,0|3,0,0]=4 3290 B13R1.2900 CCSc1cc(c(cc1F)N)OC 62a_100000210202_100012766639 [0,1,0,0,0,0|2,0,0]=3 3291 B13R1.2900 CCSc1cc(c(cc1F)N)OC 62a_100012766639_100000210202 [0,1,0,0,0,0|2,0,0]=3 3292 B13R1.2900 CCSc1cc(c(cc1F)O)C=O 62a_100000210202_100010175118 [0,1,0,0,0,0|3,0,0]=4 3293 B13R1.2900 CCSc1cc(c(cc1F)O)C=O 62a_100010175118_100000210202 [0,1,0,0,0,0|3,0,0]=4 3294 B13R1.2900 CCSc1cc(c(cc1F)O)OC 62a_100000210202_100010189133 [0,1,0,0,0,0|1,0,0]=2 3295 B13R1.2900 CCSc1cc(c(cc1N)C)OC 62a_100000210202_200010584344 [0,1,0,0,0,0|2,0,0]=3 3296 B13R1.2900 CCSc1cc(c(cc1N)C)OC 62a_200010584344_100000210202 [0,1,0,0,0,0|2,0,0]=3 3297 B13R1.2900 CCSc1cc(c(cc1N)F)OC 62a_100000210202_100010365326 [0,1,0,0,0,0|2,0,0]=3 3298 B13R1.2900 CCSc1cc(c(cc1N)F)OC 62a_100010365326_100000210202 [0,1,0,0,0,0|2,0,0]=3 3299 B13R1.2900 CCSc1cc(c(cc1O)O)C=O 62a_100000210202_200010132312 [0,1,0,0,0,0|3,0,0]=4 3300 B13R1.2900 CCSc1cc(c(nc1C)N)OC 62a_100000210202_200010892190 [0,1,0,0,0,0|3,0,0]=4 3301 B13R1.2900 CCSc1cc(c(nc1C)N)OC 62a_200010892190_100000210202 [0,1,0,0,0,0|3,0,0]=4 3302 B13R1.2900 CCc1cc(c(cc1Br)F)CNC 26a_100102657272_100011156610 [0,1,0,0,0,0|3,0,0]=4 3303 B13R1.2900 CNCc1cc(c(cc1Br)Br)OC 207a_100102657272_100010996155 [0,1,0,0,0,0|2,0,0]=3 3304 B13R1.2900 CNCc1cc(c(cc1Br)Br)OC 270004a_106832991635_100010996155 [0,1,0,0,0,0|2,0,0]=3 3305 B13R1.2900 CNCc1cc(c(cc1Br)F)OC 207a_100102657272_100010366953 [0,1,0,0,0,0|2,0,0]=3 3306 B13R1.2900 CNCc1cc(c(cc1Br)F)OC 270004a_106832991635_100010366953 [0,1,0,0,0,0|2,0,0]=3 3307 B13R1.2900 CNCc1cc(c(cc1F)Br)OC 207a_100102657272_100000695681 [0,1,0,0,0,0|2,0,0]=3 3308 B13R1.2900 CNCc1cc(c(cc1F)Br)OC 270004a_106832991635_100000695681 [0,1,0,0,0,0|2,0,0]=3 3309 B13R1.2900 CNCc1cc(c(cc1F)Cl)OC 207a_100102657272_100000050388 [0,1,0,0,0,0|2,0,0]=3 3310 B13R1.2900 CNCc1cc(c(cc1F)Cl)OC 270004a_106832991635_100000050388 [0,1,0,0,0,0|2,0,0]=3 3311 B13R1.2900 CNCc1cc(c(cc1F)F)OC 207a_100102657272_100010630602 [0,1,0,0,0,0|2,0,0]=3 3312 B13R1.2900 CNCc1cc(c(cc1F)F)OC 270004a_106832991635_100010630602 [0,1,0,0,0,0|2,0,0]=3 3313 B13R1.2900 COc1cc(c(cc1Br)Br)NCF 34a_100000718616_100015361967 [0,1,0,0,0,0|3,0,0]=4 3314 B13R1.2900 COc1cc(c(cc1Br)Br)NCF 7a_100000718616_100015361967 [0,1,0,0,0,0|3,0,0]=4 3315 B13R1.2900 COc1cc(c(cc1Br)Br)SCF 62a_100015361967_200014006352 [0,1,0,0,0,0|3,0,0]=4 3316 B13R1.2900 COc1cc(c(cc1Br)Br)SCF 62a_200014006352_100015361967 [0,1,0,0,0,0|3,0,0]=4 3317 B13R1.2900 COc1cc(c(cc1Br)C)NCF 34a_100010232211_100015361967 [0,1,0,0,0,0|3,0,0]=4 3318 B13R1.2900 COc1cc(c(cc1Br)C)NCF 7a_100010232211_100015361967 [0,1,0,0,0,0|3,0,0]=4 3319 B13R1.2900 COc1cc(c(cc1Br)Cl)NCF 34a_100012361290_100015361967 [0,1,0,0,0,0|3,0,0]=4 3320 B13R1.2900 COc1cc(c(cc1Br)Cl)NCF 7a_100012361290_100015361967 [0,1,0,0,0,0|3,0,0]=4 3321 B13R1.2900 COc1cc(c(cc1C)Br)NCF 34a_100010244135_100015361967 [0,1,0,0,0,0|3,0,0]=4 3322 B13R1.2900 COc1cc(c(cc1C)Br)NCF 7a_100010244135_100015361967 [0,1,0,0,0,0|3,0,0]=4 3323 B13R1.2900 COc1cc(c(cc1C)N)SCF 62a_100015361967_200010584344 [0,1,0,0,0,0|3,0,0]=4 3324 B13R1.2900 COc1cc(c(cc1C)N)SCF 62a_200010584344_100015361967 [0,1,0,0,0,0|3,0,0]=4 3325 B13R1.2900 COc1cc(c(cc1Cl)Br)NCF 34a_100013022580_100015361967 [0,1,0,0,0,0|3,0,0]=4 3326 B13R1.2900 COc1cc(c(cc1Cl)Br)NCF 7a_100013022580_100015361967 [0,1,0,0,0,0|3,0,0]=4 3327 B13R1.2900 COc1cc(c(cc1Cl)C)NCF 34a_100009858536_100015361967 [0,1,0,0,0,0|3,0,0]=4 3328 B13R1.2900 COc1cc(c(cc1Cl)C)NCF 7a_100009858536_100015361967 [0,1,0,0,0,0|3,0,0]=4 3329 B13R1.2900 COc1cc(c(cc1Cl)Cl)NCF 34a_100011830341_100015361967 [0,1,0,0,0,0|3,0,0]=4 3330 B13R1.2900 COc1cc(c(cc1Cl)F)NCF 34a_100009872666_100015361967 [0,1,0,0,0,0|3,0,0]=4 3331 B13R1.2900 COc1cc(c(cc1Cl)F)NCF 7a_100009872666_100015361967 [0,1,0,0,0,0|3,0,0]=4 3332 B13R1.2900 COc1cc(c(cc1Cl)F)SCF 62a_100010739614_100015361967 [0,1,0,0,0,0|3,0,0]=4 3333 B13R1.2900 COc1cc(c(cc1Cl)F)SCF 62a_100015361967_100010739614 [0,1,0,0,0,0|3,0,0]=4 3334 B13R1.2900 COc1cc(c(cc1F)Br)NCF 34a_100010208193_100015361967 [0,1,0,0,0,0|3,0,0]=4 3335 B13R1.2900 COc1cc(c(cc1F)Br)NCF 7a_100010208193_100015361967 [0,1,0,0,0,0|3,0,0]=4 3336 B13R1.2900 COc1cc(c(cc1F)C)SCF 62a_100011009880_100015361967 [0,1,0,0,0,0|3,0,0]=4 3337 B13R1.2900 COc1cc(c(cc1F)C)SCF 62a_100015361967_100011009880 [0,1,0,0,0,0|3,0,0]=4 3338 B13R1.2900 COc1cc(c(cc1F)Cl)NCF 34a_100009958774_100015361967 [0,1,0,0,0,0|3,0,0]=4 3339 B13R1.2900 COc1cc(c(cc1F)Cl)NCF 7a_100009958774_100015361967 [0,1,0,0,0,0|3,0,0]=4 3340 B13R1.2900 COc1cc(c(cc1F)F)SCF 62a_100015361967_200015541288 [0,1,0,0,0,0|3,0,0]=4 3341 B13R1.2900 COc1cc(c(cc1F)F)SCF 62a_200015541288_100015361967 [0,1,0,0,0,0|3,0,0]=4 3342 B13R1.2900 COc1cc(c(cc1F)N)SCF 62a_100010365326_100015361967 [0,1,0,0,0,0|3,0,0]=4 3343 B13R1.2900 COc1cc(c(cc1F)N)SCF 62a_100015361967_100010365326 [0,1,0,0,0,0|3,0,0]=4 3344 B13R1.2900 COc1cc(c(cc1N)C)SCF 62a_100010141321_100015361967 [0,1,0,0,0,0|3,0,0]=4 3345 B13R1.2900 COc1cc(c(cc1N)C)SCF 62a_100015361967_100010141321 [0,1,0,0,0,0|3,0,0]=4 3346 B13R1.2900 COc1cc(c(cc1N)F)SCF 62a_100012766639_100015361967 [0,1,0,0,0,0|3,0,0]=4 3347 B13R1.2900 COc1cc(c(cc1N)F)SCF 62a_100015361967_100012766639 [0,1,0,0,0,0|3,0,0]=4 3348 B13R1.2900 COc1cc(c(cc1O)F)SCF 62a_100015361967_100010189133 [0,1,0,0,0,0|2,0,0]=3 3349 B13R1.4030 CC=Cc1cc(c(c(c1)CC)O)C 271570a_100016259895_100010659108 [0,1,0,0,0,0|1,0,2]=4 3350 B13R1.4030 CC=Cc1cc(c(c(c1)OC)F)C 271570a_100016259895_100010271686 [0,1,0,0,0,0|1,0,2]=4 3351 B13R1.4030 CC=Cc1cc(c(c(c1)OC)F)F 271570a_100016259895_100011218012 [0,1,0,0,0,0|1,0,2]=4 3352 B13R1.4030 CC=Cc1cc(c(c(c1)OC)F)O 271570a_100016259895_200015524394 [0,1,0,0,0,0|1,0,2]=4 3353 B13R1.4030 CC=Cc1cc(c(c(c1)OC)N)C 271570a_100016259895_100000741850 [0,1,0,0,0,0|1,0,2]=4 3354 B13R1.4030 CCNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000210202 [0,1,0,0,0,0|2,0,0]=3 3355 B13R1.4030 CCNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000210202 [0,1,0,0,0,0|2,0,0]=3 3356 B13R1.4030 CCNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000210202 [0,1,0,0,0,0|2,0,0]=3 3357 B13R1.4030 CCSc1cc(c(c(c1)C#N)O)C 62a_100000210202_100010195408 [0,1,0,0,0,0|3,0,0]=4 3358 B13R1.4030 CCSc1cc(c(c(c1)C=O)O)C 62a_100000210202_100000696164 [0,1,0,0,0,0|3,0,0]=4 3359 B13R1.4030 CCSc1cc(c(c(c1)C=O)O)F 62a_100000210202_100011217654 [0,1,0,0,0,0|3,0,0]=4 3360 B13R1.4030 CCSc1cc(c(c(c1)C=O)O)F 62a_100011217654_100000210202 [0,1,0,0,0,0|3,0,0]=4 3361 B13R1.4030 CCSc1cc(c(c(c1)C=O)O)O 62a_100000210202_100010235811 [0,1,0,0,0,0|3,0,0]=4 3362 B13R1.4030 CCSc1cc(c(c(c1)CC)N)C 62a_100000210202_200000186424 [0,1,0,0,0,0|3,0,0]=4 3363 B13R1.4030 CCSc1cc(c(c(c1)CC)N)C 62a_200000186424_100000210202 [0,1,0,0,0,0|3,0,0]=4 3364 B13R1.4030 CCSc1cc(c(c(c1)CC)O)C 62a_100000210202_100010659108 [0,1,0,0,0,0|2,0,0]=3 3365 B13R1.4030 CCSc1cc(c(c(c1)OC)F)C 62a_100000210202_100010271686 [0,1,0,0,0,0|2,0,0]=3 3366 B13R1.4030 CCSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000210202 [0,1,0,0,0,0|2,0,0]=3 3367 B13R1.4030 CCSc1cc(c(c(c1)OC)F)F 62a_100000210202_100011218012 [0,1,0,0,0,0|2,0,0]=3 3368 B13R1.4030 CCSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000210202 [0,1,0,0,0,0|2,0,0]=3 3369 B13R1.4030 CCSc1cc(c(c(c1)OC)F)O 62a_100000210202_200015524394 [0,1,0,0,0,0|2,0,0]=3 3370 B13R1.4030 CCSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000210202 [0,1,0,0,0,0|2,0,0]=3 3371 B13R1.4030 CCSc1cc(c(c(c1)OC)N)C 62a_100000210202_100000741850 [0,1,0,0,0,0|2,0,0]=3 3372 B13R1.4030 CCSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000210202 [0,1,0,0,0,0|2,0,0]=3 3373 B13R1.4030 CCSc1cc(c(c(c1)OC)O)O 62a_100000210202_200159242197 [0,1,0,0,0,0|1,0,0]=2 3374 B13R1.4030 CCc1cc(cc(c1O)C)SCF 62a_100015361967_100010659108 [0,1,0,0,0,0|3,0,0]=4 3375 B13R1.4030 CNCc1cc(c(c(c1)OC)F)F 207a_100102657272_100000050682 [0,1,0,0,0,0|2,0,0]=3 3376 B13R1.4030 CNCc1cc(c(c(c1)OC)F)F 270004a_106832991635_100000050682 [0,1,0,0,0,0|2,0,0]=3 3377 B13R1.4030 COc1cc(cc(c1Cl)Br)NCF 34a_100010131419_100015361967 [0,1,0,0,0,0|3,0,0]=4 3378 B13R1.4030 COc1cc(cc(c1Cl)Br)NCF 7a_100010131419_100015361967 [0,1,0,0,0,0|3,0,0]=4 3379 B13R1.4030 COc1cc(cc(c1F)C)SCF 62a_100010271686_100015361967 [0,1,0,0,0,0|3,0,0]=4 3380 B13R1.4030 COc1cc(cc(c1F)C)SCF 62a_100015361967_100010271686 [0,1,0,0,0,0|3,0,0]=4 3381 B13R1.4030 COc1cc(cc(c1F)F)SCF 62a_100011218012_100015361967 [0,1,0,0,0,0|3,0,0]=4 3382 B13R1.4030 COc1cc(cc(c1F)F)SCF 62a_100015361967_100011218012 [0,1,0,0,0,0|3,0,0]=4 3383 B13R1.4030 COc1cc(cc(c1F)O)SCF 62a_100015361967_200015524394 [0,1,0,0,0,0|3,0,0]=4 3384 B13R1.4030 COc1cc(cc(c1F)O)SCF 62a_200015524394_100015361967 [0,1,0,0,0,0|3,0,0]=4 3385 B13R1.4030 COc1cc(cc(c1N)C)SCF 62a_100000741850_100015361967 [0,1,0,0,0,0|3,0,0]=4 3386 B13R1.4030 COc1cc(cc(c1N)C)SCF 62a_100015361967_100000741850 [0,1,0,0,0,0|3,0,0]=4 3387 B13R1.4030 COc1cc(cc(c1O)O)SCF 62a_100015361967_200159242197 [0,1,0,0,0,0|2,0,0]=3 3388 B13R2.121 CNc1c(ccc2c1CCC2)Br 2230a_202495424074_200000210301 [0,0,0,1,0,0|2,0,0]=3 3389 B13R2.121 CNc1c(ccc2c1CCC2)Br 34a_202495424074_200000210301 [0,0,0,1,0,0|2,0,0]=3 3390 B13R2.121 CNc1c(ccc2c1CCC2)C 2230a_202495413831_200000210301 [0,0,0,1,0,0|2,0,0]=3 3391 B13R2.121 CNc1c(ccc2c1CCC2)C 34a_202495413831_200000210301 [0,0,0,1,0,0|2,0,0]=3 3392 B13R2.121 COc1c(ccc2c1CCC2)Br 34a_100010662108_200000210301 [0,0,0,1,0,0|1,0,0]=2 3393 B13R2.121 COc1c(ccc2c1CCC2)Br 7a_100010662108_200000210301 [0,0,0,1,0,0|1,0,0]=2 3394 B13R2.121 COc1c(ccc2c1cn[nH]2)O 271570a_203496583355_100009817061 [0,0,0,1,0,0|2,0,1]=4 3395 B13R2.121 Cc1ccc2c(c1N[13CH3])CCC2 2230a_202495413831_200025704644 [0,0,0,1,0,0|2,0,0]=3 3396 B13R2.121 Cc1ccc2c(c1N[13CH3])CCC2 34a_202495413831_200025704644 [0,0,0,1,0,0|2,0,0]=3 3397 B13R2.121 [13CH3]Nc1c(ccc2c1CCC2)Br 2230a_202495424074_200025704644 [0,0,0,1,0,0|2,0,0]=3 3398 B13R2.121 [13CH3]Nc1c(ccc2c1CCC2)Br 34a_202495424074_200025704644 [0,0,0,1,0,0|2,0,0]=3 3399 B13R2.121 [13CH3]Oc1c(ccc2c1CCC2)Br 34a_100010662108_200025704644 [0,0,0,1,0,0|1,0,0]=2 3400 B13R2.121 [13CH3]Oc1c(ccc2c1CCC2)Br 7a_100010662108_200025704644 [0,0,0,1,0,0|1,0,0]=2 3401 B13R2.449 C=C=Cc1ccc2c(c1)OCO2 271570a_100015277604_100000688060 [0,0,0,1,0,0|0,0,3]=4 3402 B13R2.449 CC=Cc1ccc2c(c1)CCO2 271570a_100016259895_100000729065 [0,0,0,1,0,0|1,0,2]=4 3403 B13R2.449 CC=Cc1ccc2c(c1)OCC2 271570a_100016259895_100009818566 [0,0,0,1,0,0|1,0,2]=4 3404 B13R2.449 CC=Cc1ccc2c(c1)OCO2 271570a_100016259895_100000688060 [0,0,0,1,0,0|0,0,2]=3 3405 B13R2.449 CCNc1ccc2c(c1)CCC2 2230a_100000211504_100000210202 [0,0,0,1,0,0|3,0,0]=4 3406 B13R2.449 CCNc1ccc2c(c1)CCC2 34a_100000211504_100000210202 [0,0,0,1,0,0|3,0,0]=4 3407 B13R2.449 CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210202 [0,0,0,1,0,0|2,0,0]=3 3408 B13R2.449 CCNc1ccc2c(c1)CCO2 34a_100000736984_100000210202 [0,0,0,1,0,0|2,0,0]=3 3409 B13R2.449 CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210202 [0,0,0,1,0,0|1,0,0]=2 3410 B13R2.449 CCNc1ccc2c(c1)OCO2 34a_100000209953_100000210202 [0,0,0,1,0,0|1,0,0]=2 3411 B13R2.449 CCNc1ccc2ccoc2c1 34a_100000102395_100000210202 [0,0,0,1,0,0|2,0,1]=4 3412 B13R2.449 CCNc1ccc2cnoc2c1 34a_100000084182_100000210202 [0,0,0,1,0,0|3,0,0]=4 3413 B13R2.449 CCNc1ccc2ncoc2c1 34a_100011248239_100000210202 [0,0,0,1,0,0|2,0,1]=4 3414 B13R2.449 CCNc1ccc2occc2c1 34a_106430523501_100000210202 [0,0,0,1,0,0|2,0,1]=4 3415 B13R2.449 CCNc1ccc2ocnc2c1 34a_100011219863_100000210202 [0,0,0,1,0,0|2,0,1]=4 3416 B13R2.449 CCNc1ccc2oncc2c1 34a_100000037595_100000210202 [0,0,0,1,0,0|3,0,0]=4 3417 B13R2.449 CCOc1ccc2c(c1)CCC2 34a_100000209987_100000210202 [0,0,0,1,0,0|3,0,0]=4 3418 B13R2.449 CCOc1ccc2c(c1)CCC2 7a_100000209987_100000210202 [0,0,0,1,0,0|3,0,0]=4 3419 B13R2.449 CCOc1ccc2c(c1)CCN2 34a_100020636429_100000210202 [0,0,0,1,0,0|3,0,0]=4 3420 B13R2.449 CCOc1ccc2c(c1)NCC2 34a_100020636427_100000210202 [0,0,0,1,0,0|3,0,0]=4 3421 B13R2.449 CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210202 [0,0,0,1,0,0|1,0,0]=2 3422 B13R2.449 CCOc1ccc2ccoc2c1 34a_100000089557_100000210202 [0,0,0,1,0,0|2,0,1]=4 3423 B13R2.449 CCOc1ccc2ccoc2c1 7a_100000089557_100000210202 [0,0,0,1,0,0|2,0,1]=4 3424 B13R2.449 CCOc1ccc2cnoc2c1 34a_100000098417_100000210202 [0,0,0,1,0,0|3,0,0]=4 3425 B13R2.449 CCOc1ccc2cnoc2c1 7a_100000098417_100000210202 [0,0,0,1,0,0|3,0,0]=4 3426 B13R2.449 CCOc1ccc2occc2c1 34a_100000070125_100000210202 [0,0,0,1,0,0|2,0,1]=4 3427 B13R2.449 CCOc1ccc2occc2c1 7a_100000070125_100000210202 [0,0,0,1,0,0|2,0,1]=4 3428 B13R2.449 CCSc1cc2c(cn1)OCC2 62a_100000210202_102495363667 [0,0,0,1,0,0|3,0,0]=4 3429 B13R2.449 CCSc1cc2c(cn1)OCC2 62a_102495363667_100000210202 [0,0,0,1,0,0|3,0,0]=4 3430 B13R2.449 CCSc1ccc2c(c1)CCC2 62a_100000210202_100000745594 [0,0,0,1,0,0|3,0,0]=4 3431 B13R2.449 CCSc1ccc2c(c1)CCC2 62a_100000745594_100000210202 [0,0,0,1,0,0|3,0,0]=4 3432 B13R2.449 CCSc1ccc2c(c1)CCN2 62a_100000210202_100000691068 [0,0,0,1,0,0|3,0,0]=4 3433 B13R2.449 CCSc1ccc2c(c1)CCN2 62a_100000691068_100000210202 [0,0,0,1,0,0|3,0,0]=4 3434 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000210202_100000729065 [0,0,0,1,0,0|2,0,0]=3 3435 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000729065_100000210202 [0,0,0,1,0,0|2,0,0]=3 3436 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000210202_100000754641 [0,0,0,1,0,0|3,0,0]=4 3437 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000754641_100000210202 [0,0,0,1,0,0|3,0,0]=4 3438 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100000210202_100009818566 [0,0,0,1,0,0|2,0,0]=3 3439 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210202 [0,0,0,1,0,0|2,0,0]=3 3440 B13R2.449 CCSc1ccc2ccoc2c1 62a_100000210202_100000759542 [0,0,0,1,0,0|2,0,1]=4 3441 B13R2.449 CCSc1ccc2cnoc2c1 62a_100000210202_100009817722 [0,0,0,1,0,0|3,0,0]=4 3442 B13R2.449 CCSc1ccc2ncoc2c1 62a_100000210202_100009817590 [0,0,0,1,0,0|2,0,1]=4 3443 B13R2.449 CCSc1ccc2occc2c1 62a_100000210202_100000691453 [0,0,0,1,0,0|2,0,1]=4 3444 B13R2.449 CCSc1ccc2ocnc2c1 62a_100000210202_100009816175 [0,0,0,1,0,0|2,0,1]=4 3445 B13R2.449 CCSc1ccc2oncc2c1 62a_100000210202_100009817723 [0,0,0,1,0,0|3,0,0]=4 3446 B13R2.449 CNCc1ccc2c(c1)CCC2 207a_100102657272_100000765347 [0,0,0,1,0,0|3,0,0]=4 3447 B13R2.449 CNCc1ccc2c(c1)CCC2 26a_100102657272_100000209987 [0,0,0,1,0,0|3,0,0]=4 3448 B13R2.449 CNCc1ccc2c(c1)CCC2 270004a_106832991635_100000765347 [0,0,0,1,0,0|3,0,0]=4 3449 B13R2.449 CNCc1ccc2c(c1)CCO2 207a_100102657272_100011218456 [0,0,0,1,0,0|2,0,0]=3 3450 B13R2.449 CNCc1ccc2c(c1)CCO2 2230a_100011219410_200000210301 [0,0,0,1,0,0|2,0,0]=3 3451 B13R2.449 CNCc1ccc2c(c1)CCO2 270004a_106832991635_100011218456 [0,0,0,1,0,0|2,0,0]=3 3452 B13R2.449 CNCc1ccc2c(c1)CCO2 34a_100011219410_200000210301 [0,0,0,1,0,0|2,0,0]=3 3453 B13R2.449 CNCc1ccc2c(c1)OCO2 2230a_100000210006_200000210301 [0,0,0,1,0,0|1,0,0]=2 3454 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100000210006_200000210301 [0,0,0,1,0,0|1,0,0]=2 3455 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100102657272_100000189651 [0,0,0,1,0,0|1,0,0]=2 3456 B13R2.449 CNCc1ccc2c(c1)OCO2 7a_106832991635_100000189651 [0,0,0,1,0,0|1,0,0]=2 3457 B13R2.449 CNCc1ccc2cnoc2c1 26a_100102657272_100000098417 [0,0,0,1,0,0|3,0,0]=4 3458 B13R2.449 CNCc1ccc2ncoc2c1 207a_100102657272_100000059852 [0,0,0,1,0,0|2,0,1]=4 3459 B13R2.449 CNCc1ccc2ncoc2c1 2230a_106832991635_106359897996 [0,0,0,1,0,0|2,0,1]=4 3460 B13R2.449 CNCc1ccc2ncoc2c1 270004a_106832991635_100000059852 [0,0,0,1,0,0|2,0,1]=4 3461 B13R2.449 CNCc1ccc2ncoc2c1 34a_100102657272_106359897996 [0,0,0,1,0,0|2,0,1]=4 3462 B13R2.449 CNCc1ccc2ncoc2c1 7a_106832991635_106359897996 [0,0,0,1,0,0|2,0,1]=4 3463 B13R2.449 CNCc1ccc2occc2c1 207a_100102657272_100000040644 [0,0,0,1,0,0|2,0,1]=4 3464 B13R2.449 CNCc1ccc2occc2c1 2230a_100020591328_200000210301 [0,0,0,1,0,0|2,0,1]=4 3465 B13R2.449 CNCc1ccc2occc2c1 26a_100102657272_100000070125 [0,0,0,1,0,0|2,0,1]=4 3466 B13R2.449 CNCc1ccc2occc2c1 270004a_106832991635_100000040644 [0,0,0,1,0,0|2,0,1]=4 3467 B13R2.449 CNCc1ccc2occc2c1 34a_100020591328_200000210301 [0,0,0,1,0,0|2,0,1]=4 3468 B13R2.449 CNCc1ccc2ocnc2c1 207a_100102657272_100010271902 [0,0,0,1,0,0|2,0,1]=4 3469 B13R2.449 CNCc1ccc2ocnc2c1 2230a_106832991635_200010203175 [0,0,0,1,0,0|2,0,1]=4 3470 B13R2.449 CNCc1ccc2ocnc2c1 270004a_106832991635_100010271902 [0,0,0,1,0,0|2,0,1]=4 3471 B13R2.449 CNCc1ccc2ocnc2c1 34a_100102657272_200010203175 [0,0,0,1,0,0|2,0,1]=4 3472 B13R2.449 CNCc1ccc2ocnc2c1 7a_106832991635_200010203175 [0,0,0,1,0,0|2,0,1]=4 3473 B13R2.449 COCc1ccc2c(c1)CCC2 34a_200000765175_200000210301 [0,0,0,1,0,0|3,0,0]=4 3474 B13R2.449 COCc1ccc2c(c1)CCC2 7a_200000765175_200000210301 [0,0,0,1,0,0|3,0,0]=4 3475 B13R2.449 COCc1ccc2c(c1)CCO2 34a_100011219353_200000210301 [0,0,0,1,0,0|2,0,0]=3 3476 B13R2.449 COCc1ccc2c(c1)CCO2 7a_100011219353_200000210301 [0,0,0,1,0,0|2,0,0]=3 3477 B13R2.449 COCc1ccc2c(c1)NCC2 34a_100000694088_200000210301 [0,0,0,1,0,0|3,0,0]=4 3478 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100000210967_200000210301 [0,0,0,1,0,0|1,0,0]=2 3479 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100138415774_100000189651 [0,0,0,1,0,0|1,0,0]=2 3480 B13R2.449 COCc1ccc2ccoc2c1 34a_200009859634_200000210301 [0,0,0,1,0,0|2,0,1]=4 3481 B13R2.449 COCc1ccc2ccoc2c1 7a_200009859634_200000210301 [0,0,0,1,0,0|2,0,1]=4 3482 B13R2.449 COCc1ccc2ncoc2c1 34a_100138415774_106359897996 [0,0,0,1,0,0|2,0,1]=4 3483 B13R2.449 COCc1ccc2occc2c1 34a_100000067418_200000210301 [0,0,0,1,0,0|2,0,1]=4 3484 B13R2.449 COCc1ccc2occc2c1 7a_100000067418_200000210301 [0,0,0,1,0,0|2,0,1]=4 3485 B13R2.449 COCc1ccc2ocnc2c1 34a_100138415774_200010203175 [0,0,0,1,0,0|2,0,1]=4 3486 B13R2.449 CSCc1ccc2ncoc2c1 62a_106359897996_200000210301 [0,0,0,1,0,0|2,0,1]=4 3487 B13R2.449 CSCc1ccc2ncoc2c1 62a_200000210301_106359897996 [0,0,0,1,0,0|2,0,1]=4 3488 B13R2.449 CSCc1ccc2ocnc2c1 62a_200000210301_200010203175 [0,0,0,1,0,0|2,0,1]=4 3489 B13R2.449 FCNc1ccc2c(c1)CCO2 34a_100000736984_100015361967 [0,0,0,1,0,0|3,0,0]=4 3490 B13R2.449 FCNc1ccc2c(c1)OCO2 34a_100000209953_100015361967 [0,0,0,1,0,0|2,0,0]=3 3491 B13R2.449 FCOc1ccc2c(c1)OCO2 34a_100000210298_100015361967 [0,0,0,1,0,0|2,0,0]=3 3492 B13R2.449 FCSc1ccc2c(c1)CCO2 62a_100000729065_100015361967 [0,0,0,1,0,0|3,0,0]=4 3493 B13R2.449 FCSc1ccc2c(c1)CCO2 62a_100015361967_100000729065 [0,0,0,1,0,0|3,0,0]=4 3494 B13R2.449 FCSc1ccc2c(c1)OCC2 62a_100009818566_100015361967 [0,0,0,1,0,0|3,0,0]=4 3495 B13R2.449 FCSc1ccc2c(c1)OCC2 62a_100015361967_100009818566 [0,0,0,1,0,0|3,0,0]=4 3496 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 2230a_100011219410_200025704644 [0,0,0,1,0,0|2,0,0]=3 3497 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 34a_100011219410_200025704644 [0,0,0,1,0,0|2,0,0]=3 3498 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 2230a_100000210006_200025704644 [0,0,0,1,0,0|1,0,0]=2 3499 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 34a_100000210006_200025704644 [0,0,0,1,0,0|1,0,0]=2 3500 B13R2.449 [13CH3]NCc1ccc2occc2c1 2230a_100020591328_200025704644 [0,0,0,1,0,0|2,0,1]=4 3501 B13R2.449 [13CH3]NCc1ccc2occc2c1 34a_100020591328_200025704644 [0,0,0,1,0,0|2,0,1]=4 3502 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 34a_200000765175_200025704644 [0,0,0,1,0,0|3,0,0]=4 3503 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 7a_200000765175_200025704644 [0,0,0,1,0,0|3,0,0]=4 3504 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 34a_100011219353_200025704644 [0,0,0,1,0,0|2,0,0]=3 3505 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 7a_100011219353_200025704644 [0,0,0,1,0,0|2,0,0]=3 3506 B13R2.449 [13CH3]OCc1ccc2c(c1)NCC2 34a_100000694088_200025704644 [0,0,0,1,0,0|3,0,0]=4 3507 B13R2.449 [13CH3]OCc1ccc2c(c1)OCO2 34a_100000210967_200025704644 [0,0,0,1,0,0|1,0,0]=2 3508 B13R2.449 [13CH3]OCc1ccc2ccoc2c1 34a_200009859634_200025704644 [0,0,0,1,0,0|2,0,1]=4 3509 B13R2.449 [13CH3]OCc1ccc2ccoc2c1 7a_200009859634_200025704644 [0,0,0,1,0,0|2,0,1]=4 3510 B13R2.449 [13CH3]OCc1ccc2occc2c1 34a_100000067418_200025704644 [0,0,0,1,0,0|2,0,1]=4 3511 B13R2.449 [13CH3]OCc1ccc2occc2c1 7a_100000067418_200025704644 [0,0,0,1,0,0|2,0,1]=4 3512 B13R2.449 [13CH3]SCc1ccc2ncoc2c1 62a_106359897996_200025704644 [0,0,0,1,0,0|2,0,1]=4 3513 B13R2.449 [13CH3]SCc1ccc2ncoc2c1 62a_200025704644_106359897996 [0,0,0,1,0,0|2,0,1]=4 3514 B13R2.449 [13CH3]SCc1ccc2ocnc2c1 62a_200025704644_200010203175 [0,0,0,1,0,0|2,0,1]=4 3515 B13R2.599 C=Cc1cc2c(cc1O)CCC2 271570a_100011290941_200010659162 [0,0,0,1,0,0|1,0,1]=3 3516 B13R2.599 COc1cc2[nH]ccc2cc1O 271570a_203496583355_100010245498 [0,0,0,1,0,0|1,0,2]=4 3517 B13R2.599 COc1cc2[nH]cnc2cc1O 271570a_203496583355_100010062394 [0,0,0,1,0,0|2,0,1]=4 3518 B13R2.599 COc1cc2c(cc1Br)CCC2 34a_200010659162_200000210301 [0,0,0,1,0,0|1,0,0]=2 3519 B13R2.599 COc1cc2c(cc1Br)CCC2 7a_200010659162_200000210301 [0,0,0,1,0,0|1,0,0]=2 3520 B13R2.599 COc1cc2c(cc1Br)OCO2 34a_100010290809_200000210301 [0,0,0,1,0,0|3,0,0]=4 3521 B13R2.599 COc1cc2c(cc1Br)OCO2 7a_100010290809_200000210301 [0,0,0,1,0,0|3,0,0]=4 3522 B13R2.599 COc1cc2c(cc1C)OCO2 34a_100000145572_200000210301 [0,0,0,1,0,0|3,0,0]=4 3523 B13R2.599 COc1cc2c(cc1C)OCO2 7a_100000145572_200000210301 [0,0,0,1,0,0|3,0,0]=4 3524 B13R2.599 COc1cc2c(cc1F)CCC2 34a_200000146645_200000210301 [0,0,0,1,0,0|1,0,0]=2 3525 B13R2.599 COc1cc2c(cc1F)CCC2 7a_200000146645_200000210301 [0,0,0,1,0,0|1,0,0]=2 3526 B13R2.599 COc1cc2cc[nH]c2cc1O 271570a_203496583355_100010245486 [0,0,0,1,0,0|1,0,2]=4 3527 B13R2.599 COc1cc2cn[nH]c2cc1O 271570a_203496583355_100010074698 [0,0,0,1,0,0|2,0,1]=4 3528 B13R2.599 COc1cc2n[nH]cc2cc1O 271570a_203496583355_100020876381 [0,0,0,1,0,0|2,0,1]=4 3529 B13R2.599 CSc1cc2c(cc1F)NCC2 62a_100012771920_200000210301 [0,0,0,1,0,0|2,1,0]=4 3530 B13R2.599 CSc1cc2c(cc1F)NCC2 62a_200000210301_100012771920 [0,0,0,1,0,0|2,1,0]=4 3531 B13R2.599 CSc1cc2c(cc1O)CCC2 62a_200000210301_200010659162 [0,0,0,1,0,0|0,1,0]=2 3532 B13R2.599 CSc1cc2c(cc1O)CCC2 62a_200010659162_200000210301 [0,0,0,1,0,0|0,1,0]=2 3533 B13R2.599 Cc1cc2c(cc1O[13CH3])OCO2 34a_100000145572_200025704644 [0,0,0,1,0,0|3,0,0]=4 3534 B13R2.599 Cc1cc2c(cc1O[13CH3])OCO2 7a_100000145572_200025704644 [0,0,0,1,0,0|3,0,0]=4 3535 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 34a_200010659162_200025704644 [0,0,0,1,0,0|1,0,0]=2 3536 B13R2.599 [13CH3]Oc1cc2c(cc1Br)CCC2 7a_200010659162_200025704644 [0,0,0,1,0,0|1,0,0]=2 3537 B13R2.599 [13CH3]Oc1cc2c(cc1Br)OCO2 34a_100010290809_200025704644 [0,0,0,1,0,0|3,0,0]=4 3538 B13R2.599 [13CH3]Oc1cc2c(cc1Br)OCO2 7a_100010290809_200025704644 [0,0,0,1,0,0|3,0,0]=4 3539 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 34a_200000146645_200025704644 [0,0,0,1,0,0|1,0,0]=2 3540 B13R2.599 [13CH3]Oc1cc2c(cc1F)CCC2 7a_200000146645_200025704644 [0,0,0,1,0,0|1,0,0]=2 3541 B13R2.599 [13CH3]Sc1cc2c(cc1F)NCC2 62a_100012771920_200025704644 [0,0,0,1,0,0|2,1,0]=4 3542 B13R2.599 [13CH3]Sc1cc2c(cc1F)NCC2 62a_200025704644_100012771920 [0,0,0,1,0,0|2,1,0]=4 3543 B13R2.599 [13CH3]Sc1cc2c(cc1O)CCC2 62a_200010659162_200025704644 [0,0,0,1,0,0|0,1,0]=2 3544 B13R2.599 [13CH3]Sc1cc2c(cc1O)CCC2 62a_200025704644_200010659162 [0,0,0,1,0,0|0,1,0]=2 3545 B13R2.2461 C=Cc1cc(ccc1F)C2CC2 271570a_100011290941_100010281199 [0,0,0,1,0,0|2,0,1]=4 3546 B13R2.2461 C=Cc1cc(ccc1O)C2CC2 271570a_100011290941_100135415898 [0,0,0,1,0,0|1,0,1]=3 3547 B13R2.2461 CCc1cc(ccc1Br)C2CC2 271570a_100011220607_100010244631 [0,0,0,1,0,0|2,0,0]=3 3548 B13R2.2461 CCc1cc(ccc1F)C2CC2 271570a_100011220607_100010244625 [0,0,0,1,0,0|2,0,0]=3 3549 B13R2.2461 CCc1cc(ccc1N)C2CC2 271570a_100011220607_100000686106 [0,0,0,1,0,0|2,0,0]=3 3550 B13R2.2461 CCc1cc(ccc1O)C2CC2 271570a_100011220607_100012338938 [0,0,0,1,0,0|1,0,0]=2 3551 B13R2.2461 CCc1nc(ccc1N)C2CC2 271570a_100011220607_100009871203 [0,0,0,1,0,0|3,0,0]=4 3552 B13R2.2461 CCn1cc(ccc1=O)C2CC2 271570a_100011220607_100000231005 [0,0,0,1,0,0|2,0,1]=4 3553 B13R2.2461 CNc1cc(ccc1C)C2CC2 271570a_100011220607_100020629602 [0,0,0,1,0,0|2,0,0]=3 3554 B13R2.2461 CNc1cc(ccc1F)C2CC2 271570a_100011220607_100011314990 [0,0,0,1,0,0|2,0,0]=3 3555 B13R2.2461 CNc1cc(ccc1F)C2CC2 34a_102516457221_200000210301 [0,0,0,1,0,0|2,0,0]=3 3556 B13R2.2461 CNc1cc(ccc1F)C2CC2 7a_102516457221_200000210301 [0,0,0,1,0,0|2,0,0]=3 3557 B13R2.2461 CNc1cc(ccc1N)C2CC2 271570a_100011220607_100000694363 [0,0,0,1,0,0|2,0,0]=3 3558 B13R2.2461 CNc1cc(cnc1N)C2CC2 271570a_100011220607_100010506235 [0,0,0,1,0,0|3,0,0]=4 3559 B13R2.2461 COc1cc(c[nH]c1=O)C2CC2 271570a_100011220607_100010125397 [0,0,0,1,0,0|1,0,1]=3 3560 B13R2.2461 COc1cc(ccc1Br)C2CC2 271570a_100011220607_100012353699 [0,0,0,1,0,0|1,0,0]=2 3561 B13R2.2461 COc1cc(ccc1C)C2CC2 271570a_100011220607_100011830276 [0,0,0,1,0,0|1,0,0]=2 3562 B13R2.2461 COc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356853 [0,0,0,1,0,0|1,0,0]=2 3563 B13R2.2461 COc1cc(ccc1F)C2CC2 271570a_100011220607_100011934186 [0,0,0,1,0,0|1,0,0]=2 3564 B13R2.2461 COc1cc(ccc1F)C2CC2 34a_100118380312_200000210301 [0,0,0,1,0,0|1,0,0]=2 3565 B13R2.2461 COc1cc(ccc1F)C2CC2 7a_100118380312_200000210301 [0,0,0,1,0,0|1,0,0]=2 3566 B13R2.2461 COc1cc(ccc1N)C2CC2 271570a_100011220607_100011279103 [0,0,0,1,0,0|1,0,0]=2 3567 B13R2.2461 COc1cc(ccc1O)C2CC2 271570a_100011220607_100000694246 [0,0,0,1,0,0|0,0,0]=1 3568 B13R2.2461 COc1cc(cnc1C)C2CC2 271570a_100011220607_100010254219 [0,0,0,1,0,0|2,0,0]=3 3569 B13R2.2461 COc1cc(cnc1F)C2CC2 271570a_100011220607_100010214931 [0,0,0,1,0,0|2,0,0]=3 3570 B13R2.2461 COc1cc(cnc1N)C2CC2 271570a_100011220607_106354213024 [0,0,0,1,0,0|2,0,0]=3 3571 B13R2.2461 COc1cc(ncc1C)C2CC2 271570a_100011220607_100010067687 [0,0,0,1,0,0|2,0,0]=3 3572 B13R2.2461 COc1cc(ncc1F)C2CC2 271570a_100011220607_200010136270 [0,0,0,1,0,0|2,0,0]=3 3573 B13R2.2461 COc1cc(ncc1N)C2CC2 271570a_100011220607_100009887741 [0,0,0,1,0,0|2,0,0]=3 3574 B13R2.2461 COc1cc(nnc1N)C2CC2 271570a_100011220607_100000688033 [0,0,0,1,0,0|3,0,0]=4 3575 B13R2.2461 COc1nc(ccc1N)C2CC2 271570a_100011220607_100000687816 [0,0,0,1,0,0|2,0,0]=3 3576 B13R2.2461 COc1nc(ccc1O)C2CC2 271570a_100011220607_100010893133 [0,0,0,1,0,0|1,0,0]=2 3577 B13R2.2461 COc1nc(cnc1N)C2CC2 271570a_100011220607_100009816943 [0,0,0,1,0,0|3,0,0]=4 3578 B13R2.2461 COc1nc(cnc1O)C2CC2 271570a_100011220607_200010365344 [0,0,0,1,0,0|2,0,0]=3 3579 B13R2.2461 COc1nc(ncc1C)C2CC2 271570a_100011220607_100012500371 [0,0,0,1,0,0|3,0,0]=4 3580 B13R2.2461 COc1nc(ncc1F)C2CC2 271570a_100011220607_100012183945 [0,0,0,1,0,0|3,0,0]=4 3581 B13R2.2461 COc1nc(ncc1N)C2CC2 271570a_100011220607_100012122185 [0,0,0,1,0,0|3,0,0]=4 3582 B13R2.2461 CSc1cc(ccc1F)C2CC2 271570a_100011220607_100010341305 [0,0,0,1,0,0|1,1,0]=3 3583 B13R2.2461 CSc1cc(ccc1F)C2CC2 62a_100010281199_200000210301 [0,0,0,1,0,0|1,1,0]=3 3584 B13R2.2461 CSc1cc(ccc1F)C2CC2 62a_200000210301_100010281199 [0,0,0,1,0,0|1,1,0]=3 3585 B13R2.2461 CSc1cc(ccc1O)C2CC2 62a_200000210301_100135415898 [0,0,0,1,0,0|0,1,0]=2 3586 B13R2.2461 Cc1ccc(cc1C#N)C2CC2 271570a_100011220607_100000698047 [0,0,0,1,0,0|3,0,0]=4 3587 B13R2.2461 Cc1ccc(cc1C=O)C2CC2 271570a_100011220607_100011361606 [0,0,0,1,0,0|3,0,0]=4 3588 B13R2.2461 Cc1ccc(cc1CO)C2CC2 271570a_100011220607_100000700630 [0,0,0,1,0,0|3,0,0]=4 3589 B13R2.2461 N#Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100012355174 [0,0,0,1,0,0|3,0,0]=4 3590 B13R2.2461 N#Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356831 [0,0,0,1,0,0|3,0,0]=4 3591 B13R2.2461 N#Cc1cc(ccc1F)C2CC2 271570a_100011220607_100000037165 [0,0,0,1,0,0|3,0,0]=4 3592 B13R2.2461 N#Cc1cc(ccc1N)C2CC2 271570a_100011220607_100000688460 [0,0,0,1,0,0|3,0,0]=4 3593 B13R2.2461 N#Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000687585 [0,0,0,1,0,0|2,0,0]=3 3594 B13R2.2461 N#Cc1cc(cnc1O)C2CC2 271570a_100011220607_100000697733 [0,0,0,1,0,0|3,0,0]=4 3595 B13R2.2461 NCc1cc(ccc1F)C2CC2 271570a_100011220607_100009815772 [0,0,0,1,0,0|3,0,0]=4 3596 B13R2.2461 NCc1cc(ccc1N)C2CC2 271570a_100011220607_100012349119 [0,0,0,1,0,0|3,0,0]=4 3597 B13R2.2461 NCc1cc(ccc1O)C2CC2 271570a_100011220607_100000730032 [0,0,0,1,0,0|2,0,0]=3 3598 B13R2.2461 NNc1cc(ccc1F)C2CC2 271570a_100011220607_100020610843 [0,0,0,1,0,0|3,0,0]=4 3599 B13R2.2461 Nc1ccc(cc1C=O)C2CC2 271570a_100011220607_100011935258 [0,0,0,1,0,0|3,0,0]=4 3600 B13R2.2461 Nc1ccc(cc1CO)C2CC2 271570a_100011220607_100012353972 [0,0,0,1,0,0|3,0,0]=4 3601 B13R2.2461 O=Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100010185652 [0,0,0,1,0,0|3,0,0]=4 3602 B13R2.2461 O=Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100010254384 [0,0,0,1,0,0|3,0,0]=4 3603 B13R2.2461 O=Cc1cc(ccc1F)C2CC2 271570a_100011220607_100000211465 [0,0,0,1,0,0|3,0,0]=4 3604 B13R2.2461 O=Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186750 [0,0,0,1,0,0|2,0,0]=3 3605 B13R2.2461 OCc1cc(ccc1Br)C2CC2 271570a_100011220607_100012359683 [0,0,0,1,0,0|3,0,0]=4 3606 B13R2.2461 OCc1cc(ccc1Cl)C2CC2 271570a_100011220607_100010128486 [0,0,0,1,0,0|3,0,0]=4 3607 B13R2.2461 OCc1cc(ccc1F)C2CC2 271570a_100011220607_100000049604 [0,0,0,1,0,0|3,0,0]=4 3608 B13R2.2461 OCc1cc(ccc1O)C2CC2 271570a_100011220607_100000184703 [0,0,0,1,0,0|2,0,0]=3 3609 B13R2.2461 OCc1cc(cnc1O)C2CC2 271570a_100011220607_100010065268 [0,0,0,1,0,0|3,0,0]=4 3610 B13R2.2461 [13CH3]Nc1cc(ccc1F)C2CC2 34a_102516457221_200025704644 [0,0,0,1,0,0|2,0,0]=3 3611 B13R2.2461 [13CH3]Nc1cc(ccc1F)C2CC2 7a_102516457221_200025704644 [0,0,0,1,0,0|2,0,0]=3 3612 B13R2.2461 [13CH3]Oc1cc(ccc1F)C2CC2 34a_100118380312_200025704644 [0,0,0,1,0,0|1,0,0]=2 3613 B13R2.2461 [13CH3]Oc1cc(ccc1F)C2CC2 7a_100118380312_200025704644 [0,0,0,1,0,0|1,0,0]=2 3614 B13R2.2461 [13CH3]Sc1cc(ccc1F)C2CC2 62a_100010281199_200025704644 [0,0,0,1,0,0|1,1,0]=3 3615 B13R2.2461 [13CH3]Sc1cc(ccc1F)C2CC2 62a_200025704644_100010281199 [0,0,0,1,0,0|1,1,0]=3 3616 B13R2.2461 [13CH3]Sc1cc(ccc1O)C2CC2 62a_200025704644_100135415898 [0,0,0,1,0,0|0,1,0]=2 3617 B11R1.187 CCCc1cc(n(n1)C)OC 34a_200012396517_200000210301 [0,0,0,0,1,0|3,0,0]=4 3618 B11R1.187 CCCc1cc(n(n1)C)O[13CH3] 34a_200012396517_200025704644 [0,0,0,0,1,0|3,0,0]=4 3619 B10R0.108 CC=C(C)C=CC(=O)CCC 1458a_100000692105_100000210303 [1,0,1,0,0,0|2,0,0]=4 3620 B10R0.74 CCC/C=C/C=CC(=O)CC 1458a_200016258893_100000210202 [1,0,1,0,0,0|2,0,0]=4 3621 B10R0.74 CCC/C=C/C=CC(=O)NC 11a_106832991635_200016258893 [1,0,1,0,0,0|2,0,0]=4 3622 B10R0.74 CCC/C=C/C=CC(=O)NC 1626a_100102657272_200016258893 [1,0,1,0,0,0|2,0,0]=4 3623 B10R0.74 CCC/C=C/C=CC(=O)NC 240690a_100102657272_200016258893 [1,0,1,0,0,0|2,0,0]=4 3624 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [2,0,0,0,0,0|0,0,2]=4 3625 B10R1.10 CC#Cc1cccc(c1)O 271570a_203496583355_200009843338 [2,0,0,0,0,0|0,0,2]=4 3626 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [2,0,0,0,0,0|0,0,2]=4 3627 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [2,0,0,0,0,0|0,0,2]=4 3628 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [2,0,0,0,0,0|0,0,0]=2 3629 B10R1.10 CCNc1cccc(c1)Br 34a_100000210019_100000210202 [2,0,0,0,0,0|2,0,0]=4 3630 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [2,0,0,0,0,0|1,0,0]=3 3631 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [2,0,0,0,0,0|1,0,0]=3 3632 B10R1.10 CCNc1cccc(c1)Cl 34a_100000185859_100000210202 [2,0,0,0,0,0|2,0,0]=4 3633 B10R1.10 CCNc1cccc(c1)F 34a_100000210047_100000210202 [2,0,0,0,0,0|2,0,0]=4 3634 B10R1.10 CCNc1cccc(c1)I 34a_100000211102_100000210202 [2,0,0,0,0,0|2,0,0]=4 3635 B10R1.10 CCNc1cccc(c1)O 271570a_203496583355_100000738899 [2,0,0,0,0,0|1,0,0]=3 3636 B10R1.10 CCNc1cccc(c1)O 34a_100000210217_100000210202 [2,0,0,0,0,0|1,0,0]=3 3637 B10R1.10 CCNc1cccc(n1)O 271570a_203496583355_200020678610 [2,0,0,0,0,0|2,0,0]=4 3638 B10R1.10 CCNc1ccnc(c1)C 27a_100015525214_100000758586 [2,0,0,0,0,0|2,0,0]=4 3639 B10R1.10 CCOc1cc(ccn1)O 271570a_203496583355_100009995528 [2,0,0,0,0,0|2,0,0]=4 3640 B10R1.10 CCOc1cccc(c1)Br 34a_100000210342_100000210202 [2,0,0,0,0,0|2,0,0]=4 3641 B10R1.10 CCOc1cccc(c1)Br 7a_100000210342_100000210202 [2,0,0,0,0,0|2,0,0]=4 3642 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [2,0,0,0,0,0|1,0,0]=3 3643 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [2,0,0,0,0,0|1,0,0]=3 3644 B10R1.10 CCOc1cccc(c1)Cl 34a_100000210295_100000210202 [2,0,0,0,0,0|2,0,0]=4 3645 B10R1.10 CCOc1cccc(c1)Cl 7a_100000210295_100000210202 [2,0,0,0,0,0|2,0,0]=4 3646 B10R1.10 CCOc1cccc(c1)F 34a_100000210426_100000210202 [2,0,0,0,0,0|2,0,0]=4 3647 B10R1.10 CCOc1cccc(c1)F 7a_100000210426_100000210202 [2,0,0,0,0,0|2,0,0]=4 3648 B10R1.10 CCOc1cccc(c1)I 34a_100000211634_100000210202 [2,0,0,0,0,0|2,0,0]=4 3649 B10R1.10 CCOc1cccc(c1)I 7a_100000211634_100000210202 [2,0,0,0,0,0|2,0,0]=4 3650 B10R1.10 CCOc1cccc(c1)N 34a_100000210217_100000210202 [2,0,0,0,0,0|2,0,0]=4 3651 B10R1.10 CCOc1cccc(c1)O 271570a_203496583355_100000170002 [2,0,0,0,0,0|1,0,0]=3 3652 B10R1.10 CCOc1cccc(n1)O 271570a_203496583355_100000752924 [2,0,0,0,0,0|2,0,0]=4 3653 B10R1.10 CCOc1ccnc(c1)C 34a_100000688365_100000210202 [2,0,0,0,0,0|2,0,0]=4 3654 B10R1.10 CCOc1ccnc(c1)O 271570a_203496583355_100011922638 [2,0,0,0,0,0|2,0,0]=4 3655 B10R1.10 CCOc1cncc(c1)C 34a_100011830280_100000210202 [2,0,0,0,0,0|2,0,0]=4 3656 B10R1.10 CCOc1cncc(c1)C 7a_100011830280_100000210202 [2,0,0,0,0,0|2,0,0]=4 3657 B10R1.10 CCOc1cncc(c1)O 271570a_203496583355_100012029586 [2,0,0,0,0,0|2,0,0]=4 3658 B10R1.10 CCSc1cc(ccn1)C 62a_100000210202_100000750283 [2,0,0,0,0,0|2,0,0]=4 3659 B10R1.10 CCSc1cc(ccn1)C 62a_100000750283_100000210202 [2,0,0,0,0,0|2,0,0]=4 3660 B10R1.10 CCSc1cc(ccn1)O 62a_100000210202_100000762945 [2,0,0,0,0,0|2,0,0]=4 3661 B10R1.10 CCSc1ccc[n+](c1)C 62a_100000210202_100009996589 [2,0,0,0,0,0|2,0,0]=4 3662 B10R1.10 CCSc1ccc[n+](c1)C 62a_100009996589_100000210202 [2,0,0,0,0,0|2,0,0]=4 3663 B10R1.10 CCSc1cccc(c1)Br 62a_100000210202_100000691529 [2,0,0,0,0,0|2,0,0]=4 3664 B10R1.10 CCSc1cccc(c1)Br 62a_100000691529_100000210202 [2,0,0,0,0,0|2,0,0]=4 3665 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [2,0,0,0,0,0|1,0,0]=3 3666 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [2,0,0,0,0,0|1,0,0]=3 3667 B10R1.10 CCSc1cccc(c1)Cl 62a_100000210202_100000699651 [2,0,0,0,0,0|2,0,0]=4 3668 B10R1.10 CCSc1cccc(c1)Cl 62a_100000699651_100000210202 [2,0,0,0,0,0|2,0,0]=4 3669 B10R1.10 CCSc1cccc(c1)F 62a_100000210202_100000685547 [2,0,0,0,0,0|2,0,0]=4 3670 B10R1.10 CCSc1cccc(c1)F 62a_100000685547_100000210202 [2,0,0,0,0,0|2,0,0]=4 3671 B10R1.10 CCSc1cccc(c1)N 62a_100000210019_100000210202 [2,0,0,0,0,0|2,0,0]=4 3672 B10R1.10 CCSc1cccc(c1)N 62a_100000210202_100000210019 [2,0,0,0,0,0|2,0,0]=4 3673 B10R1.10 CCSc1cccc(c1)O 271570a_203496583355_100000703699 [2,0,0,0,0,0|1,0,0]=3 3674 B10R1.10 CCSc1cccc(c1)O 62a_100000210202_100000211634 [2,0,0,0,0,0|1,0,0]=3 3675 B10R1.10 CCSc1cccc(c1)[S] 62a_100000210202_114929384022 [2,0,0,0,0,0|1,1,0]=4 3676 B10R1.10 CCSc1cccc(c1)[S] 62a_114929384022_100000210202 [2,0,0,0,0,0|1,1,0]=4 3677 B10R1.10 CCSc1cccc(n1)C 62a_100000210202_100000742759 [2,0,0,0,0,0|2,0,0]=4 3678 B10R1.10 CCSc1cccc(n1)C 62a_100000742759_100000210202 [2,0,0,0,0,0|2,0,0]=4 3679 B10R1.10 CCSc1ccnc(c1)C 62a_100000210202_100000758586 [2,0,0,0,0,0|2,0,0]=4 3680 B10R1.10 CCSc1ccnc(c1)C 62a_100000758586_100000210202 [2,0,0,0,0,0|2,0,0]=4 3681 B10R1.10 CCSc1cncc(c1)C 62a_100000210202_100000760492 [2,0,0,0,0,0|2,0,0]=4 3682 B10R1.10 CCSc1cncc(c1)C 62a_100000760492_100000210202 [2,0,0,0,0,0|2,0,0]=4 3683 B10R1.10 CCSc1cncc(c1)O 62a_100000210202_100000754920 [2,0,0,0,0,0|2,0,0]=4 3684 B10R1.10 CCSc1cncc(c1)O 62a_100000754920_100000210202 [2,0,0,0,0,0|2,0,0]=4 3685 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [2,0,0,0,0,0|2,0,0]=4 3686 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [2,0,0,0,0,0|2,0,0]=4 3687 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [2,0,0,0,0,0|2,0,0]=4 3688 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [2,0,0,0,0,0|2,0,0]=4 3689 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [2,0,0,0,0,0|2,0,0]=4 3690 B10R1.10 CNCc1cc(ccn1)O 271570a_203496583355_100102954512 [2,0,0,0,0,0|2,0,0]=4 3691 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [2,0,0,0,0,0|2,0,0]=4 3692 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [2,0,0,0,0,0|2,0,0]=4 3693 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [2,0,0,0,0,0|2,0,0]=4 3694 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [2,0,0,0,0,0|2,0,0]=4 3695 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [2,0,0,0,0,0|2,0,0]=4 3696 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [2,0,0,0,0,0|2,0,0]=4 3697 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [2,0,0,0,0,0|2,0,0]=4 3698 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [2,0,0,0,0,0|2,0,0]=4 3699 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [2,0,0,0,0,0|1,0,0]=3 3700 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [2,0,0,0,0,0|1,0,0]=3 3701 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [2,0,0,0,0,0|1,0,0]=3 3702 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [2,0,0,0,0,0|1,0,0]=3 3703 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [2,0,0,0,0,0|1,0,0]=3 3704 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [2,0,0,0,0,0|1,0,0]=3 3705 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [2,0,0,0,0,0|1,0,0]=3 3706 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [2,0,0,0,0,0|2,0,0]=4 3707 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [2,0,0,0,0,0|2,0,0]=4 3708 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [2,0,0,0,0,0|2,0,0]=4 3709 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [2,0,0,0,0,0|2,0,0]=4 3710 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [2,0,0,0,0,0|2,0,0]=4 3711 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [2,0,0,0,0,0|2,0,0]=4 3712 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [2,0,0,0,0,0|2,0,0]=4 3713 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [2,0,0,0,0,0|2,0,0]=4 3714 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [2,0,0,0,0,0|2,0,0]=4 3715 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [2,0,0,0,0,0|2,0,0]=4 3716 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [2,0,0,0,0,0|2,0,0]=4 3717 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [2,0,0,0,0,0|2,0,0]=4 3718 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [2,0,0,0,0,0|2,0,0]=4 3719 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [2,0,0,0,0,0|2,0,0]=4 3720 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [2,0,0,0,0,0|2,0,0]=4 3721 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [2,0,0,0,0,0|2,0,0]=4 3722 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [2,0,0,0,0,0|2,0,0]=4 3723 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [2,0,0,0,0,0|2,0,0]=4 3724 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [2,0,0,0,0,0|2,0,0]=4 3725 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [2,0,0,0,0,0|2,0,0]=4 3726 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [2,0,0,0,0,0|2,0,0]=4 3727 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [2,0,0,0,0,0|1,0,0]=3 3728 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [2,0,0,0,0,0|1,0,0]=3 3729 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [2,0,0,0,0,0|1,0,0]=3 3730 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [2,0,0,0,0,0|1,0,0]=3 3731 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [2,0,0,0,0,0|1,0,0]=3 3732 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [2,0,0,0,0,0|1,0,0]=3 3733 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [2,0,0,0,0,0|1,0,0]=3 3734 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [2,0,0,0,0,0|1,0,0]=3 3735 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [2,0,0,0,0,0|2,0,0]=4 3736 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [2,0,0,0,0,0|2,0,0]=4 3737 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [2,0,0,0,0,0|2,0,0]=4 3738 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [2,0,0,0,0,0|2,0,0]=4 3739 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [2,0,0,0,0,0|2,0,0]=4 3740 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [2,0,0,0,0,0|2,0,0]=4 3741 B10R1.10 CNCc1cccc(n1)O 271570a_203496583355_106354212997 [2,0,0,0,0,0|2,0,0]=4 3742 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [2,0,0,0,0,0|2,0,0]=4 3743 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [2,0,0,0,0,0|2,0,0]=4 3744 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [2,0,0,0,0,0|2,0,0]=4 3745 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [2,0,0,0,0,0|2,0,0]=4 3746 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [2,0,0,0,0,0|2,0,0]=4 3747 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [2,0,0,0,0,0|2,0,0]=4 3748 B10R1.10 CNCc1ccnc(c1)O 207a_100102657272_100000688113 [2,0,0,0,0,0|2,0,0]=4 3749 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [2,0,0,0,0,0|2,0,0]=4 3750 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [2,0,0,0,0,0|2,0,0]=4 3751 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [2,0,0,0,0,0|2,0,0]=4 3752 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [2,0,0,0,0,0|2,0,0]=4 3753 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [2,0,0,0,0,0|2,0,0]=4 3754 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [2,0,0,0,0,0|2,0,0]=4 3755 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [2,0,0,0,0,0|2,0,0]=4 3756 B10R1.10 CNCc1cncc(c1)O 207a_100102657272_100012187055 [2,0,0,0,0,0|2,0,0]=4 3757 B10R1.10 CNCc1cncc(c1)O 270004a_106832991635_100012187055 [2,0,0,0,0,0|2,0,0]=4 3758 B10R1.10 CNCc1cncc(c1)O 271570a_203496583355_103549770560 [2,0,0,0,0,0|2,0,0]=4 3759 B10R1.10 COCc1cc(ccn1)C 34a_100011998357_200000210301 [2,0,0,0,0,0|2,0,0]=4 3760 B10R1.10 COCc1cc(ccn1)C 34a_100138415774_100000718516 [2,0,0,0,0,0|2,0,0]=4 3761 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [2,0,0,0,0,0|2,0,0]=4 3762 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [2,0,0,0,0,0|2,0,0]=4 3763 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [2,0,0,0,0,0|2,0,0]=4 3764 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [2,0,0,0,0,0|1,0,0]=3 3765 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [2,0,0,0,0,0|1,0,0]=3 3766 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [2,0,0,0,0,0|1,0,0]=3 3767 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [2,0,0,0,0,0|2,0,0]=4 3768 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [2,0,0,0,0,0|2,0,0]=4 3769 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [2,0,0,0,0,0|2,0,0]=4 3770 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [2,0,0,0,0,0|2,0,0]=4 3771 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [2,0,0,0,0,0|2,0,0]=4 3772 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [2,0,0,0,0,0|2,0,0]=4 3773 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [2,0,0,0,0,0|2,0,0]=4 3774 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [2,0,0,0,0,0|2,0,0]=4 3775 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [2,0,0,0,0,0|2,0,0]=4 3776 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [2,0,0,0,0,0|2,0,0]=4 3777 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [2,0,0,0,0,0|1,0,0]=3 3778 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [2,0,0,0,0,0|1,0,0]=3 3779 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [2,0,0,0,0,0|2,0,0]=4 3780 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [2,0,0,0,0,0|2,0,0]=4 3781 B10R1.10 COCc1ccnc(c1)C 34a_100011998630_200000210301 [2,0,0,0,0,0|2,0,0]=4 3782 B10R1.10 COCc1ccnc(c1)C 34a_100138415774_200020672517 [2,0,0,0,0,0|2,0,0]=4 3783 B10R1.10 COCc1cncc(c1)C 34a_100011998709_200000210301 [2,0,0,0,0,0|2,0,0]=4 3784 B10R1.10 COCc1cncc(c1)C 34a_100138415774_100000716715 [2,0,0,0,0,0|2,0,0]=4 3785 B10R1.10 COCc1cncc(c1)C 7a_100011998709_200000210301 [2,0,0,0,0,0|2,0,0]=4 3786 B10R1.10 CSCc1cc(ccn1)C 62a_100000718516_200000210301 [2,0,0,0,0,0|2,0,0]=4 3787 B10R1.10 CSCc1cc(ccn1)C 62a_200000210301_100000718516 [2,0,0,0,0,0|2,0,0]=4 3788 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [2,0,0,0,0,0|2,0,0]=4 3789 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [2,0,0,0,0,0|2,0,0]=4 3790 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [2,0,0,0,0,0|1,0,0]=3 3791 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [2,0,0,0,0,0|1,0,0]=3 3792 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [2,0,0,0,0,0|2,0,0]=4 3793 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [2,0,0,0,0,0|2,0,0]=4 3794 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [2,0,0,0,0,0|2,0,0]=4 3795 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [2,0,0,0,0,0|2,0,0]=4 3796 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [2,0,0,0,0,0|2,0,0]=4 3797 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [2,0,0,0,0,0|2,0,0]=4 3798 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [2,0,0,0,0,0|1,0,0]=3 3799 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [2,0,0,0,0,0|1,0,0]=3 3800 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [2,0,0,0,0,0|2,0,0]=4 3801 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [2,0,0,0,0,0|2,0,0]=4 3802 B10R1.10 CSCc1ccnc(c1)C 62a_200000210301_200020672517 [2,0,0,0,0,0|2,0,0]=4 3803 B10R1.10 CSCc1ccnc(c1)C 62a_200020672517_200000210301 [2,0,0,0,0,0|2,0,0]=4 3804 B10R1.10 CSCc1cncc(c1)C 62a_100000716715_200000210301 [2,0,0,0,0,0|2,0,0]=4 3805 B10R1.10 CSCc1cncc(c1)C 62a_200000210301_100000716715 [2,0,0,0,0,0|2,0,0]=4 3806 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [2,0,0,0,0,0|2,0,0]=4 3807 B10R1.10 Cc1cc(ccn1)CO[13CH3] 34a_100011998630_200025704644 [2,0,0,0,0,0|2,0,0]=4 3808 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200020672517_200025704644 [2,0,0,0,0,0|2,0,0]=4 3809 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200025704644_200020672517 [2,0,0,0,0,0|2,0,0]=4 3810 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [2,0,0,0,0,0|1,0,0]=3 3811 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [2,0,0,0,0,0|1,0,0]=3 3812 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [2,0,0,0,0,0|1,0,0]=3 3813 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [2,0,0,0,0,0|1,0,0]=3 3814 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [2,0,0,0,0,0|1,0,0]=3 3815 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [2,0,0,0,0,0|1,0,0]=3 3816 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [2,0,0,0,0,0|2,0,0]=4 3817 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [2,0,0,0,0,0|2,0,0]=4 3818 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [2,0,0,0,0,0|2,0,0]=4 3819 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [2,0,0,0,0,0|2,0,0]=4 3820 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [2,0,0,0,0,0|2,0,0]=4 3821 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [2,0,0,0,0,0|2,0,0]=4 3822 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [2,0,0,0,0,0|2,0,0]=4 3823 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [2,0,0,0,0,0|2,0,0]=4 3824 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [2,0,0,0,0,0|2,0,0]=4 3825 B10R1.10 Cc1ccnc(c1)CO[13CH3] 34a_100011998357_200025704644 [2,0,0,0,0,0|2,0,0]=4 3826 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_100000718516_200025704644 [2,0,0,0,0,0|2,0,0]=4 3827 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_200025704644_100000718516 [2,0,0,0,0,0|2,0,0]=4 3828 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [2,0,0,0,0,0|2,0,0]=4 3829 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [2,0,0,0,0,0|2,0,0]=4 3830 B10R1.10 Cc1cncc(c1)CO[13CH3] 34a_100011998709_200025704644 [2,0,0,0,0,0|2,0,0]=4 3831 B10R1.10 Cc1cncc(c1)CO[13CH3] 7a_100011998709_200025704644 [2,0,0,0,0,0|2,0,0]=4 3832 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_100000716715_200025704644 [2,0,0,0,0,0|2,0,0]=4 3833 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_200025704644_100000716715 [2,0,0,0,0,0|2,0,0]=4 3834 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [2,0,0,0,0,0|1,0,1]=4 3835 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [2,0,0,0,0,0|1,0,0]=3 3836 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [2,0,0,0,0,0|2,0,0]=4 3837 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [2,0,0,0,0,0|1,0,1]=4 3838 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [2,0,0,0,0,0|1,0,0]=3 3839 B10R1.10 OCCc1cccc(n1)O 271570a_203496583355_100010221043 [2,0,0,0,0,0|2,0,0]=4 3840 B10R1.10 Oc1cccc(c1)NCF 34a_100000210217_100015361967 [2,0,0,0,0,0|2,0,0]=4 3841 B10R1.10 Oc1cccc(c1)SCF 62a_100015361967_100000211634 [2,0,0,0,0,0|2,0,0]=4 3842 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [2,0,0,0,0,0|2,0,0]=4 3843 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [2,0,0,0,0,0|2,0,0]=4 3844 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [2,0,0,0,0,0|2,0,0]=4 3845 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [2,0,0,0,0,0|2,0,0]=4 3846 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [2,0,0,0,0,0|2,0,0]=4 3847 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [2,0,0,0,0,0|2,0,0]=4 3848 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [2,0,0,0,0,0|2,0,0]=4 3849 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [2,0,0,0,0,0|2,0,0]=4 3850 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [2,0,0,0,0,0|1,0,0]=3 3851 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [2,0,0,0,0,0|1,0,0]=3 3852 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [2,0,0,0,0,0|2,0,0]=4 3853 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [2,0,0,0,0,0|2,0,0]=4 3854 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [2,0,0,0,0,0|2,0,0]=4 3855 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [2,0,0,0,0,0|2,0,0]=4 3856 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [2,0,0,0,0,0|2,0,0]=4 3857 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [2,0,0,0,0,0|2,0,0]=4 3858 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [2,0,0,0,0,0|2,0,0]=4 3859 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [2,0,0,0,0,0|2,0,0]=4 3860 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [2,0,0,0,0,0|2,0,0]=4 3861 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [2,0,0,0,0,0|2,0,0]=4 3862 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [2,0,0,0,0,0|2,0,0]=4 3863 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [2,0,0,0,0,0|2,0,0]=4 3864 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [2,0,0,0,0,0|2,0,0]=4 3865 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [2,0,0,0,0,0|2,0,0]=4 3866 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [2,0,0,0,0,0|2,0,0]=4 3867 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [2,0,0,0,0,0|2,0,0]=4 3868 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [2,0,0,0,0,0|2,0,0]=4 3869 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [2,0,0,0,0,0|1,0,0]=3 3870 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [2,0,0,0,0,0|1,0,0]=3 3871 B10R1.172 C#Cc1cccc(c1)OC 34a_100011216014_200000210301 [2,0,0,0,0,0|0,0,2]=4 3872 B10R1.172 C#Cc1cccc(c1)OC 7a_100011216014_200000210301 [2,0,0,0,0,0|0,0,2]=4 3873 B10R1.172 C#Cc1cccc(c1)O[13CH3] 34a_100011216014_200025704644 [2,0,0,0,0,0|0,0,2]=4 3874 B10R1.172 C#Cc1cccc(c1)O[13CH3] 7a_100011216014_200025704644 [2,0,0,0,0,0|0,0,2]=4 3875 B10R1.172 C=Cc1cccc(c1)CC 271570a_100011290941_100000684523 [2,0,0,0,0,0|1,0,1]=4 3876 B10R1.172 C=Cc1cccc(c1)OC 271570a_100011290941_100000170001 [2,0,0,0,0,0|0,0,2]=4 3877 B10R1.172 C=Cc1cccc(c1)OC 34a_100011309434_200000210301 [2,0,0,0,0,0|0,0,2]=4 3878 B10R1.172 C=Cc1cccc(c1)OC 7a_100011309434_200000210301 [2,0,0,0,0,0|0,0,2]=4 3879 B10R1.172 C=Cc1cccc(c1)O[13CH3] 34a_100011309434_200025704644 [2,0,0,0,0,0|0,0,2]=4 3880 B10R1.172 C=Cc1cccc(c1)O[13CH3] 7a_100011309434_200025704644 [2,0,0,0,0,0|0,0,2]=4 3881 B10R1.172 CC[n+]1cccc(c1)OC 34a_100000731997_200000210301 [2,0,0,0,0,0|1,0,0]=3 3882 B10R1.172 CC[n+]1cccc(c1)OC 7a_100000731997_200000210301 [2,0,0,0,0,0|1,0,0]=3 3883 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 34a_100000731997_200025704644 [2,0,0,0,0,0|1,0,0]=3 3884 B10R1.172 CC[n+]1cccc(c1)O[13CH3] 7a_100000731997_200025704644 [2,0,0,0,0,0|1,0,0]=3 3885 B10R1.172 CCc1cc(ccn1)NC 27a_100102657272_100009820011 [2,0,0,0,0,0|2,0,0]=4 3886 B10R1.172 CCc1cc(ccn1)SC 62a_100009820011_200000210301 [2,0,0,0,0,0|1,1,0]=4 3887 B10R1.172 CCc1cc(ccn1)SC 62a_200000210301_100009820011 [2,0,0,0,0,0|1,1,0]=4 3888 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_100009820011_200025704644 [2,0,0,0,0,0|1,1,0]=4 3889 B10R1.172 CCc1cc(ccn1)S[13CH3] 62a_200025704644_100009820011 [2,0,0,0,0,0|1,1,0]=4 3890 B10R1.172 CCc1cccc(c1)NC 2230a_100000211250_200000210301 [2,0,0,0,0,0|1,0,0]=3 3891 B10R1.172 CCc1cccc(c1)NC 34a_100000211250_200000210301 [2,0,0,0,0,0|1,0,0]=3 3892 B10R1.172 CCc1cccc(c1)NC 7a_100000211250_200000210301 [2,0,0,0,0,0|1,0,0]=3 3893 B10R1.172 CCc1cccc(c1)N[13CH3] 2230a_100000211250_200025704644 [2,0,0,0,0,0|1,0,0]=3 3894 B10R1.172 CCc1cccc(c1)N[13CH3] 34a_100000211250_200025704644 [2,0,0,0,0,0|1,0,0]=3 3895 B10R1.172 CCc1cccc(c1)N[13CH3] 7a_100000211250_200025704644 [2,0,0,0,0,0|1,0,0]=3 3896 B10R1.172 CCc1cccc(c1)OC 34a_100000211550_200000210301 [2,0,0,0,0,0|0,0,0]=2 3897 B10R1.172 CCc1cccc(c1)OC 7a_100000211550_200000210301 [2,0,0,0,0,0|0,0,0]=2 3898 B10R1.172 CCc1cccc(c1)O[13CH3] 34a_100000211550_200025704644 [2,0,0,0,0,0|0,0,0]=2 3899 B10R1.172 CCc1cccc(c1)O[13CH3] 7a_100000211550_200025704644 [2,0,0,0,0,0|0,0,0]=2 3900 B10R1.172 CCc1cccc(c1)SC 62a_100011263222_200000210301 [2,0,0,0,0,0|0,1,0]=3 3901 B10R1.172 CCc1cccc(c1)SC 62a_200000210301_100011263222 [2,0,0,0,0,0|0,1,0]=3 3902 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_100011263222_200025704644 [2,0,0,0,0,0|0,1,0]=3 3903 B10R1.172 CCc1cccc(c1)S[13CH3] 62a_200025704644_100011263222 [2,0,0,0,0,0|0,1,0]=3 3904 B10R1.172 CCc1cccc(n1)SC 62a_100009856026_200000210301 [2,0,0,0,0,0|1,1,0]=4 3905 B10R1.172 CCc1cccc(n1)SC 62a_200000210301_100009856026 [2,0,0,0,0,0|1,1,0]=4 3906 B10R1.172 CCc1cccc(n1)S[13CH3] 62a_100009856026_200025704644 [2,0,0,0,0,0|1,1,0]=4 3907 B10R1.172 CCc1cccc(n1)S[13CH3] 62a_200025704644_100009856026 [2,0,0,0,0,0|1,1,0]=4 3908 B10R1.172 CCc1ccnc(c1)NC 27a_100102657272_100009817561 [2,0,0,0,0,0|2,0,0]=4 3909 B10R1.172 CCc1ccnc(c1)SC 62a_100009817561_200000210301 [2,0,0,0,0,0|1,1,0]=4 3910 B10R1.172 CCc1ccnc(c1)SC 62a_200000210301_100009817561 [2,0,0,0,0,0|1,1,0]=4 3911 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_100009817561_200025704644 [2,0,0,0,0,0|1,1,0]=4 3912 B10R1.172 CCc1ccnc(c1)S[13CH3] 62a_200025704644_100009817561 [2,0,0,0,0,0|1,1,0]=4 3913 B10R1.172 CCc1cncc(c1)OC 34a_200009861530_200000210301 [2,0,0,0,0,0|1,0,0]=3 3914 B10R1.172 CCc1cncc(c1)OC 7a_200009861530_200000210301 [2,0,0,0,0,0|1,0,0]=3 3915 B10R1.172 CCc1cncc(c1)O[13CH3] 34a_200009861530_200025704644 [2,0,0,0,0,0|1,0,0]=3 3916 B10R1.172 CCc1cncc(c1)O[13CH3] 7a_200009861530_200025704644 [2,0,0,0,0,0|1,0,0]=3 3917 B10R1.172 CCc1cncc(c1)SC 62a_200000210301_200009819073 [2,0,0,0,0,0|1,1,0]=4 3918 B10R1.172 CCc1cncc(c1)SC 62a_200009819073_200000210301 [2,0,0,0,0,0|1,1,0]=4 3919 B10R1.172 CCc1cncc(c1)S[13CH3] 62a_200009819073_200025704644 [2,0,0,0,0,0|1,1,0]=4 3920 B10R1.172 CCc1cncc(c1)S[13CH3] 62a_200025704644_200009819073 [2,0,0,0,0,0|1,1,0]=4 3921 B10R1.172 CNc1cccc(c1)CF 2230a_100000126320_200000210301 [2,0,0,0,0,0|2,0,0]=4 3922 B10R1.172 CNc1cccc(c1)CF 34a_100000126320_200000210301 [2,0,0,0,0,0|2,0,0]=4 3923 B10R1.172 CNc1cccc(c1)CF 7a_100000126320_200000210301 [2,0,0,0,0,0|2,0,0]=4 3924 B10R1.172 CNc1cccc(c1)CO 2230a_100000211919_200000210301 [2,0,0,0,0,0|2,0,0]=4 3925 B10R1.172 CNc1cccc(c1)CO 34a_100000211919_200000210301 [2,0,0,0,0,0|2,0,0]=4 3926 B10R1.172 CNc1cccc(c1)OC 34a_100000210024_200000210301 [2,0,0,0,0,0|1,0,0]=3 3927 B10R1.172 CNc1cccc(c1)OC 34a_100000756613_200000210301 [2,0,0,0,0,0|1,0,0]=3 3928 B10R1.172 CNc1cccc(c1)OC 7a_100000756613_200000210301 [2,0,0,0,0,0|1,0,0]=3 3929 B10R1.172 CNc1cccc(c1)O[13CH3] 34a_100000756613_200025704644 [2,0,0,0,0,0|1,0,0]=3 3930 B10R1.172 CNc1cccc(c1)O[13CH3] 7a_100000756613_200025704644 [2,0,0,0,0,0|1,0,0]=3 3931 B10R1.172 CNc1cccc(c1)SC 2230a_100000210049_200000210301 [2,0,0,0,0,0|1,1,0]=4 3932 B10R1.172 CNc1cccc(c1)SC 34a_100000210049_200000210301 [2,0,0,0,0,0|1,1,0]=4 3933 B10R1.172 CNc1cccc(c1)SC 62a_100000219648_200000210301 [2,0,0,0,0,0|1,1,0]=4 3934 B10R1.172 CNc1cccc(c1)SC 62a_200000210301_100000219648 [2,0,0,0,0,0|1,1,0]=4 3935 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_100000219648_200025704644 [2,0,0,0,0,0|1,1,0]=4 3936 B10R1.172 CNc1cccc(c1)S[13CH3] 62a_200025704644_100000219648 [2,0,0,0,0,0|1,1,0]=4 3937 B10R1.172 COc1cc(ccn1)CN 34a_100000748557_200000210301 [2,0,0,0,0,0|2,0,0]=4 3938 B10R1.172 COc1cc(ccn1)O[13CH3] 34a_100012181050_200025704644 [2,0,0,0,0,0|2,0,0]=4 3939 B10R1.172 COc1cc(ccn1)SC 62a_100000117307_200000210301 [2,0,0,0,0,0|2,0,0]=4 3940 B10R1.172 COc1cc(ccn1)SC 62a_200000210301_100000117307 [2,0,0,0,0,0|2,0,0]=4 3941 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_100000117307_200025704644 [2,0,0,0,0,0|2,0,0]=4 3942 B10R1.172 COc1cc(ccn1)S[13CH3] 62a_200025704644_100000117307 [2,0,0,0,0,0|2,0,0]=4 3943 B10R1.172 COc1cccc(c1)C#N 34a_100000184713_200000210301 [2,0,0,0,0,0|1,0,1]=4 3944 B10R1.172 COc1cccc(c1)C#N 7a_100000184713_200000210301 [2,0,0,0,0,0|1,0,1]=4 3945 B10R1.172 COc1cccc(c1)CBr 34a_100011660834_200000210301 [2,0,0,0,0,0|1,0,0]=3 3946 B10R1.172 COc1cccc(c1)CBr 7a_100011660834_200000210301 [2,0,0,0,0,0|1,0,0]=3 3947 B10R1.172 COc1cccc(c1)CCl 34a_100000084143_200000210301 [2,0,0,0,0,0|1,0,0]=3 3948 B10R1.172 COc1cccc(c1)CCl 7a_100000084143_200000210301 [2,0,0,0,0,0|1,0,0]=3 3949 B10R1.172 COc1cccc(c1)CN 34a_100000743036_200000210301 [2,0,0,0,0,0|1,0,0]=3 3950 B10R1.172 COc1cccc(c1)CO 34a_100011214949_200000210301 [2,0,0,0,0,0|1,0,0]=3 3951 B10R1.172 COc1cccc(c1)CO 7a_100011214949_200000210301 [2,0,0,0,0,0|1,0,0]=3 3952 B10R1.172 COc1cccc(c1)N[13CH3] 34a_100000210024_200025704644 [2,0,0,0,0,0|1,0,0]=3 3953 B10R1.172 COc1cccc(c1)OC 34a_100000211255_200000210301 [2,0,0,0,0,0|1,0,0]=3 3954 B10R1.172 COc1cccc(c1)OC 7a_100000211255_200000210301 [2,0,0,0,0,0|1,0,0]=3 3955 B10R1.172 COc1cccc(c1)O[13CH3] 34a_100000211255_200025704644 [2,0,0,0,0,0|1,0,0]=3 3956 B10R1.172 COc1cccc(c1)O[13CH3] 7a_100000211255_200025704644 [2,0,0,0,0,0|1,0,0]=3 3957 B10R1.172 COc1cccc(c1)SC 34a_100011265683_200000210301 [2,0,0,0,0,0|1,0,0]=3 3958 B10R1.172 COc1cccc(c1)SC 62a_200000210301_100000170001 [2,0,0,0,0,0|1,0,0]=3 3959 B10R1.172 COc1cccc(c1)SC 7a_100011265683_200000210301 [2,0,0,0,0,0|1,0,0]=3 3960 B10R1.172 COc1cccc(c1)S[13CH3] 62a_200025704644_100000170001 [2,0,0,0,0,0|1,0,0]=3 3961 B10R1.172 COc1cccc(n1)SC 62a_100000760917_200000210301 [2,0,0,0,0,0|2,0,0]=4 3962 B10R1.172 COc1cccc(n1)SC 62a_200000210301_100000760917 [2,0,0,0,0,0|2,0,0]=4 3963 B10R1.172 COc1cccc(n1)S[13CH3] 62a_100000760917_200025704644 [2,0,0,0,0,0|2,0,0]=4 3964 B10R1.172 COc1cccc(n1)S[13CH3] 62a_200025704644_100000760917 [2,0,0,0,0,0|2,0,0]=4 3965 B10R1.172 COc1ccnc(c1)OC 34a_100012181050_200000210301 [2,0,0,0,0,0|2,0,0]=4 3966 B10R1.172 COc1ccnc(c1)SC 62a_100009817693_200000210301 [2,0,0,0,0,0|2,0,0]=4 3967 B10R1.172 COc1ccnc(c1)SC 62a_200000210301_100011216251 [2,0,0,0,0,0|2,0,0]=4 3968 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_100009817693_200025704644 [2,0,0,0,0,0|2,0,0]=4 3969 B10R1.172 COc1ccnc(c1)S[13CH3] 62a_200025704644_100011216251 [2,0,0,0,0,0|2,0,0]=4 3970 B10R1.172 COc1cncc(c1)OC 34a_100000084572_200000210301 [2,0,0,0,0,0|2,0,0]=4 3971 B10R1.172 COc1cncc(c1)OC 7a_100000084572_200000210301 [2,0,0,0,0,0|2,0,0]=4 3972 B10R1.172 COc1cncc(c1)O[13CH3] 34a_100000084572_200025704644 [2,0,0,0,0,0|2,0,0]=4 3973 B10R1.172 COc1cncc(c1)O[13CH3] 7a_100000084572_200025704644 [2,0,0,0,0,0|2,0,0]=4 3974 B10R1.172 COc1cncc(c1)SC 62a_100000050176_200000210301 [2,0,0,0,0,0|2,0,0]=4 3975 B10R1.172 COc1cncc(c1)SC 62a_200000210301_100000050176 [2,0,0,0,0,0|2,0,0]=4 3976 B10R1.172 COc1cncc(c1)S[13CH3] 62a_100000050176_200025704644 [2,0,0,0,0,0|2,0,0]=4 3977 B10R1.172 COc1cncc(c1)S[13CH3] 62a_200025704644_100000050176 [2,0,0,0,0,0|2,0,0]=4 3978 B10R1.172 CSc1cccc(c1)CF 62a_100010878472_200000210301 [2,0,0,0,0,0|1,1,0]=4 3979 B10R1.172 CSc1cccc(c1)CF 62a_200000210301_100010878472 [2,0,0,0,0,0|1,1,0]=4 3980 B10R1.172 CSc1cccc(c1)CN 62a_100000106179_200000210301 [2,0,0,0,0,0|1,1,0]=4 3981 B10R1.172 CSc1cccc(c1)CN 62a_200000210301_100000106179 [2,0,0,0,0,0|1,1,0]=4 3982 B10R1.172 CSc1cccc(c1)CO 62a_100000687537_200000210301 [2,0,0,0,0,0|1,1,0]=4 3983 B10R1.172 CSc1cccc(c1)CO 62a_200000210301_100000687537 [2,0,0,0,0,0|1,1,0]=4 3984 B10R1.172 CSc1cccc(c1)N[13CH3] 2230a_100000210049_200025704644 [2,0,0,0,0,0|1,1,0]=4 3985 B10R1.172 CSc1cccc(c1)N[13CH3] 34a_100000210049_200025704644 [2,0,0,0,0,0|1,1,0]=4 3986 B10R1.172 CSc1cccc(c1)O[13CH3] 34a_100011265683_200025704644 [2,0,0,0,0,0|1,0,0]=3 3987 B10R1.172 CSc1cccc(c1)O[13CH3] 7a_100011265683_200025704644 [2,0,0,0,0,0|1,0,0]=3 3988 B10R1.172 CSc1cccc(c1)SC 62a_100011215954_200000210301 [2,0,0,0,0,0|1,1,0]=4 3989 B10R1.172 CSc1cccc(c1)SC 62a_200000210301_100011215954 [2,0,0,0,0,0|1,1,0]=4 3990 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_100011215954_200025704644 [2,0,0,0,0,0|1,1,0]=4 3991 B10R1.172 CSc1cccc(c1)S[13CH3] 62a_200025704644_100011215954 [2,0,0,0,0,0|1,1,0]=4 3992 B10R1.172 [13CH3]Nc1cccc(c1)CF 2230a_100000126320_200025704644 [2,0,0,0,0,0|2,0,0]=4 3993 B10R1.172 [13CH3]Nc1cccc(c1)CF 34a_100000126320_200025704644 [2,0,0,0,0,0|2,0,0]=4 3994 B10R1.172 [13CH3]Nc1cccc(c1)CF 7a_100000126320_200025704644 [2,0,0,0,0,0|2,0,0]=4 3995 B10R1.172 [13CH3]Nc1cccc(c1)CO 2230a_100000211919_200025704644 [2,0,0,0,0,0|2,0,0]=4 3996 B10R1.172 [13CH3]Nc1cccc(c1)CO 34a_100000211919_200025704644 [2,0,0,0,0,0|2,0,0]=4 3997 B10R1.172 [13CH3]Oc1cc(ccn1)CN 34a_100000748557_200025704644 [2,0,0,0,0,0|2,0,0]=4 3998 B10R1.172 [13CH3]Oc1cccc(c1)C#N 34a_100000184713_200025704644 [2,0,0,0,0,0|1,0,1]=4 3999 B10R1.172 [13CH3]Oc1cccc(c1)C#N 7a_100000184713_200025704644 [2,0,0,0,0,0|1,0,1]=4 4000 B10R1.172 [13CH3]Oc1cccc(c1)CBr 34a_100011660834_200025704644 [2,0,0,0,0,0|1,0,0]=3 4001 B10R1.172 [13CH3]Oc1cccc(c1)CBr 7a_100011660834_200025704644 [2,0,0,0,0,0|1,0,0]=3 4002 B10R1.172 [13CH3]Oc1cccc(c1)CCl 34a_100000084143_200025704644 [2,0,0,0,0,0|1,0,0]=3 4003 B10R1.172 [13CH3]Oc1cccc(c1)CCl 7a_100000084143_200025704644 [2,0,0,0,0,0|1,0,0]=3 4004 B10R1.172 [13CH3]Oc1cccc(c1)CN 34a_100000743036_200025704644 [2,0,0,0,0,0|1,0,0]=3 4005 B10R1.172 [13CH3]Oc1cccc(c1)CO 34a_100011214949_200025704644 [2,0,0,0,0,0|1,0,0]=3 4006 B10R1.172 [13CH3]Oc1cccc(c1)CO 7a_100011214949_200025704644 [2,0,0,0,0,0|1,0,0]=3 4007 B10R1.172 [13CH3]Sc1cccc(c1)CF 62a_100010878472_200025704644 [2,0,0,0,0,0|1,1,0]=4 4008 B10R1.172 [13CH3]Sc1cccc(c1)CF 62a_200025704644_100010878472 [2,0,0,0,0,0|1,1,0]=4 4009 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_100000106179_200025704644 [2,0,0,0,0,0|1,1,0]=4 4010 B10R1.172 [13CH3]Sc1cccc(c1)CN 62a_200025704644_100000106179 [2,0,0,0,0,0|1,1,0]=4 4011 B10R1.172 [13CH3]Sc1cccc(c1)CO 62a_100000687537_200025704644 [2,0,0,0,0,0|1,1,0]=4 4012 B10R1.172 [13CH3]Sc1cccc(c1)CO 62a_200025704644_100000687537 [2,0,0,0,0,0|1,1,0]=4 4013 B10R1.1 C/C=C/c1ccc(cc1)O 271570a_203496583355_100016259036 [2,0,0,0,0,0|0,0,2]=4 4014 B10R1.1 CC=Cc1ccc(cc1)O 271570a_100016259895_100000185759 [2,0,0,0,0,0|0,0,2]=4 4015 B10R1.1 CCCc1ccc(cc1)O 271570a_203496583355_100000750032 [2,0,0,0,0,0|0,0,0]=2 4016 B10R1.1 CCCc1cnc(nc1)O 271570a_203496583355_100000039067 [2,0,0,0,0,0|2,0,0]=4 4017 B10R1.1 CCNc1ccc(cc1)Br 2230a_100000210018_100000210202 [2,0,0,0,0,0|2,0,0]=4 4018 B10R1.1 CCNc1ccc(cc1)Br 34a_100000210018_100000210202 [2,0,0,0,0,0|2,0,0]=4 4019 B10R1.1 CCNc1ccc(cc1)C 34a_100000124888_100000210202 [2,0,0,0,0,0|2,0,0]=4 4020 B10R1.1 CCNc1ccc(cc1)Cl 2230a_100000210052_100000210202 [2,0,0,0,0,0|2,0,0]=4 4021 B10R1.1 CCNc1ccc(cc1)Cl 34a_100000210052_100000210202 [2,0,0,0,0,0|2,0,0]=4 4022 B10R1.1 CCNc1ccc(cc1)F 34a_100000185862_100000210202 [2,0,0,0,0,0|2,0,0]=4 4023 B10R1.1 CCNc1ccc(cc1)I 34a_100000185761_100000210202 [2,0,0,0,0,0|2,0,0]=4 4024 B10R1.1 CCNc1ccc(cc1)O 271570a_203496583355_100000219632 [2,0,0,0,0,0|1,0,0]=3 4025 B10R1.1 CCNc1ccc(cc1)O 34a_100000185829_100000210202 [2,0,0,0,0,0|1,0,0]=3 4026 B10R1.1 CCNc1ccc(cn1)O 271570a_203496583355_100000741496 [2,0,0,0,0,0|2,0,0]=4 4027 B10R1.1 CCOc1ccc(cc1)Br 34a_100000185759_100000210202 [2,0,0,0,0,0|2,0,0]=4 4028 B10R1.1 CCOc1ccc(cc1)Br 7a_100000185759_100000210202 [2,0,0,0,0,0|2,0,0]=4 4029 B10R1.1 CCOc1ccc(cc1)C 34a_100000210336_100000210202 [2,0,0,0,0,0|2,0,0]=4 4030 B10R1.1 CCOc1ccc(cc1)C 7a_100000210336_100000210202 [2,0,0,0,0,0|2,0,0]=4 4031 B10R1.1 CCOc1ccc(cc1)Cl 34a_100000210216_100000210202 [2,0,0,0,0,0|2,0,0]=4 4032 B10R1.1 CCOc1ccc(cc1)Cl 7a_100000210216_100000210202 [2,0,0,0,0,0|2,0,0]=4 4033 B10R1.1 CCOc1ccc(cc1)F 34a_100000210339_100000210202 [2,0,0,0,0,0|2,0,0]=4 4034 B10R1.1 CCOc1ccc(cc1)I 34a_100000212066_100000210202 [2,0,0,0,0,0|2,0,0]=4 4035 B10R1.1 CCOc1ccc(cc1)I 7a_100000212066_100000210202 [2,0,0,0,0,0|2,0,0]=4 4036 B10R1.1 CCOc1ccc(cc1)N 34a_100000185829_100000210202 [2,0,0,0,0,0|2,0,0]=4 4037 B10R1.1 CCOc1ccc(cc1)O 271570a_203496583355_100000169946 [2,0,0,0,0,0|1,0,0]=3 4038 B10R1.1 CCOc1ccc(cn1)O 271570a_203496583355_100011219444 [2,0,0,0,0,0|2,0,0]=4 4039 B10R1.1 CCOc1ccc(nc1)O 271570a_203496583355_100000753957 [2,0,0,0,0,0|2,0,0]=4 4040 B10R1.1 CCSc1ccc(cc1)Br 62a_100000210202_100000752885 [2,0,0,0,0,0|2,0,0]=4 4041 B10R1.1 CCSc1ccc(cc1)Br 62a_100000752885_100000210202 [2,0,0,0,0,0|2,0,0]=4 4042 B10R1.1 CCSc1ccc(cc1)C 62a_100000186775_100000210202 [2,0,0,0,0,0|2,0,0]=4 4043 B10R1.1 CCSc1ccc(cc1)C 62a_100000210202_100000186775 [2,0,0,0,0,0|2,0,0]=4 4044 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000210202_100000755918 [2,0,0,0,0,0|2,0,0]=4 4045 B10R1.1 CCSc1ccc(cc1)Cl 62a_100000755918_100000210202 [2,0,0,0,0,0|2,0,0]=4 4046 B10R1.1 CCSc1ccc(cc1)F 62a_100000210202_100000211213 [2,0,0,0,0,0|2,0,0]=4 4047 B10R1.1 CCSc1ccc(cc1)F 62a_100000211213_100000210202 [2,0,0,0,0,0|2,0,0]=4 4048 B10R1.1 CCSc1ccc(cc1)N 62a_100000185761_100000210202 [2,0,0,0,0,0|2,0,0]=4 4049 B10R1.1 CCSc1ccc(cc1)N 62a_100000210202_100000185761 [2,0,0,0,0,0|2,0,0]=4 4050 B10R1.1 CCSc1ccc(cc1)O 271570a_203496583355_200009811893 [2,0,0,0,0,0|1,0,0]=3 4051 B10R1.1 CCSc1ccc(cc1)O 62a_100000210202_100000185759 [2,0,0,0,0,0|1,0,0]=3 4052 B10R1.1 CCSc1ccc(cn1)O 271570a_203496583355_100000690189 [2,0,0,0,0,0|2,0,0]=4 4053 B10R1.1 CCSc1ccc(cn1)O 62a_100000210202_100000744096 [2,0,0,0,0,0|2,0,0]=4 4054 B10R1.1 CCSc1ccc(cn1)O 62a_100000685995_100000210202 [2,0,0,0,0,0|2,0,0]=4 4055 B10R1.1 CNCc1ccc(cc1)Br 207a_100102657272_100000186029 [2,0,0,0,0,0|2,0,0]=4 4056 B10R1.1 CNCc1ccc(cc1)Br 2230a_100000174875_200000210301 [2,0,0,0,0,0|2,0,0]=4 4057 B10R1.1 CNCc1ccc(cc1)Br 2230a_106832991635_100011217064 [2,0,0,0,0,0|2,0,0]=4 4058 B10R1.1 CNCc1ccc(cc1)Br 26a_100102657272_100000185759 [2,0,0,0,0,0|2,0,0]=4 4059 B10R1.1 CNCc1ccc(cc1)Br 270004a_106832991635_100000186029 [2,0,0,0,0,0|2,0,0]=4 4060 B10R1.1 CNCc1ccc(cc1)Br 34a_100000174875_200000210301 [2,0,0,0,0,0|2,0,0]=4 4061 B10R1.1 CNCc1ccc(cc1)Br 34a_100102657272_100000189115 [2,0,0,0,0,0|2,0,0]=4 4062 B10R1.1 CNCc1ccc(cc1)Br 7a_106832991635_100011217064 [2,0,0,0,0,0|2,0,0]=4 4063 B10R1.1 CNCc1ccc(cc1)C 207a_100102657272_100000211033 [2,0,0,0,0,0|2,0,0]=4 4064 B10R1.1 CNCc1ccc(cc1)C 2230a_100000174908_200000210301 [2,0,0,0,0,0|2,0,0]=4 4065 B10R1.1 CNCc1ccc(cc1)C 2230a_106832991635_100000210814 [2,0,0,0,0,0|2,0,0]=4 4066 B10R1.1 CNCc1ccc(cc1)C 26a_100102657272_200020625495 [2,0,0,0,0,0|2,0,0]=4 4067 B10R1.1 CNCc1ccc(cc1)C 270004a_106832991635_100000211033 [2,0,0,0,0,0|2,0,0]=4 4068 B10R1.1 CNCc1ccc(cc1)C 34a_100000174908_200000210301 [2,0,0,0,0,0|2,0,0]=4 4069 B10R1.1 CNCc1ccc(cc1)C 34a_100102657272_100000210814 [2,0,0,0,0,0|2,0,0]=4 4070 B10R1.1 CNCc1ccc(cc1)C 7a_106832991635_100000210814 [2,0,0,0,0,0|2,0,0]=4 4071 B10R1.1 CNCc1ccc(cc1)Cl 207a_100102657272_100000189385 [2,0,0,0,0,0|2,0,0]=4 4072 B10R1.1 CNCc1ccc(cc1)Cl 2230a_100000174871_200000210301 [2,0,0,0,0,0|2,0,0]=4 4073 B10R1.1 CNCc1ccc(cc1)Cl 2230a_106832991635_100000694040 [2,0,0,0,0,0|2,0,0]=4 4074 B10R1.1 CNCc1ccc(cc1)Cl 270004a_106832991635_100000189385 [2,0,0,0,0,0|2,0,0]=4 4075 B10R1.1 CNCc1ccc(cc1)Cl 34a_100000174871_200000210301 [2,0,0,0,0,0|2,0,0]=4 4076 B10R1.1 CNCc1ccc(cc1)Cl 34a_100102657272_100000694040 [2,0,0,0,0,0|2,0,0]=4 4077 B10R1.1 CNCc1ccc(cc1)Cl 7a_106832991635_100000187161 [2,0,0,0,0,0|2,0,0]=4 4078 B10R1.1 CNCc1ccc(cc1)F 207a_100102657272_100000210084 [2,0,0,0,0,0|2,0,0]=4 4079 B10R1.1 CNCc1ccc(cc1)F 2230a_100000174882_200000210301 [2,0,0,0,0,0|2,0,0]=4 4080 B10R1.1 CNCc1ccc(cc1)F 2230a_106832991635_100000198546 [2,0,0,0,0,0|2,0,0]=4 4081 B10R1.1 CNCc1ccc(cc1)F 270004a_106832991635_100000210084 [2,0,0,0,0,0|2,0,0]=4 4082 B10R1.1 CNCc1ccc(cc1)F 34a_100000174882_200000210301 [2,0,0,0,0,0|2,0,0]=4 4083 B10R1.1 CNCc1ccc(cc1)F 34a_100102657272_100000198546 [2,0,0,0,0,0|2,0,0]=4 4084 B10R1.1 CNCc1ccc(cc1)F 7a_106832991635_100000198546 [2,0,0,0,0,0|2,0,0]=4 4085 B10R1.1 CNCc1ccc(cc1)I 207a_100102657272_100000188517 [2,0,0,0,0,0|2,0,0]=4 4086 B10R1.1 CNCc1ccc(cc1)I 2230a_100016989417_200000210301 [2,0,0,0,0,0|2,0,0]=4 4087 B10R1.1 CNCc1ccc(cc1)I 2230a_106832991635_100000189116 [2,0,0,0,0,0|2,0,0]=4 4088 B10R1.1 CNCc1ccc(cc1)I 34a_100016989417_200000210301 [2,0,0,0,0,0|2,0,0]=4 4089 B10R1.1 CNCc1ccc(cc1)I 34a_100102657272_100000189116 [2,0,0,0,0,0|2,0,0]=4 4090 B10R1.1 CNCc1ccc(cc1)I 7a_106832991635_100000189116 [2,0,0,0,0,0|2,0,0]=4 4091 B10R1.1 CNCc1ccc(cc1)O 271570a_203496583355_100000180866 [2,0,0,0,0,0|1,0,0]=3 4092 B10R1.1 CNCc1ccc(cc1)O 34a_100000185549_200000210301 [2,0,0,0,0,0|1,0,0]=3 4093 B10R1.1 CNCc1ccc(nc1)O 207a_100102657272_100011361521 [2,0,0,0,0,0|2,0,0]=4 4094 B10R1.1 CNCc1ccc(nc1)O 2230a_100000757128_200000210301 [2,0,0,0,0,0|2,0,0]=4 4095 B10R1.1 CNCc1ccc(nc1)O 271570a_203496583355_100000026953 [2,0,0,0,0,0|2,0,0]=4 4096 B10R1.1 COCc1ccc(cc1)Br 34a_100000695286_200000210301 [2,0,0,0,0,0|2,0,0]=4 4097 B10R1.1 COCc1ccc(cc1)Br 34a_100138415774_100000189115 [2,0,0,0,0,0|2,0,0]=4 4098 B10R1.1 COCc1ccc(cc1)C 34a_100011215236_200000210301 [2,0,0,0,0,0|2,0,0]=4 4099 B10R1.1 COCc1ccc(cc1)C 34a_100138415774_100000210814 [2,0,0,0,0,0|2,0,0]=4 4100 B10R1.1 COCc1ccc(cc1)C 7a_100011215236_200000210301 [2,0,0,0,0,0|2,0,0]=4 4101 B10R1.1 COCc1ccc(cc1)Cl 34a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 4102 B10R1.1 COCc1ccc(cc1)Cl 34a_100138415774_100000694040 [2,0,0,0,0,0|2,0,0]=4 4103 B10R1.1 COCc1ccc(cc1)Cl 7a_100000211118_200000210301 [2,0,0,0,0,0|2,0,0]=4 4104 B10R1.1 COCc1ccc(cc1)F 34a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 4105 B10R1.1 COCc1ccc(cc1)F 34a_100138415774_100000198546 [2,0,0,0,0,0|2,0,0]=4 4106 B10R1.1 COCc1ccc(cc1)F 7a_100000210977_200000210301 [2,0,0,0,0,0|2,0,0]=4 4107 B10R1.1 COCc1ccc(cc1)I 34a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 4108 B10R1.1 COCc1ccc(cc1)I 34a_100138415774_100000189116 [2,0,0,0,0,0|2,0,0]=4 4109 B10R1.1 COCc1ccc(cc1)I 7a_100000690907_200000210301 [2,0,0,0,0,0|2,0,0]=4 4110 B10R1.1 COCc1ccc(cc1)N 34a_100011215238_200000210301 [2,0,0,0,0,0|2,0,0]=4 4111 B10R1.1 COCc1ccc(cc1)O 271570a_203496583355_100011493685 [2,0,0,0,0,0|1,0,0]=3 4112 B10R1.1 CSCc1ccc(cc1)Br 62a_100000189115_200000210301 [2,0,0,0,0,0|2,0,0]=4 4113 B10R1.1 CSCc1ccc(cc1)Br 62a_200000210301_100000189115 [2,0,0,0,0,0|2,0,0]=4 4114 B10R1.1 CSCc1ccc(cc1)C 62a_100000210814_200000210301 [2,0,0,0,0,0|2,0,0]=4 4115 B10R1.1 CSCc1ccc(cc1)C 62a_200000210301_100000210814 [2,0,0,0,0,0|2,0,0]=4 4116 B10R1.1 CSCc1ccc(cc1)Cl 62a_100000187161_200000210301 [2,0,0,0,0,0|2,0,0]=4 4117 B10R1.1 CSCc1ccc(cc1)Cl 62a_200000210301_100000187161 [2,0,0,0,0,0|2,0,0]=4 4118 B10R1.1 CSCc1ccc(cc1)F 62a_100000198546_200000210301 [2,0,0,0,0,0|2,0,0]=4 4119 B10R1.1 CSCc1ccc(cc1)F 62a_200000210301_100000187164 [2,0,0,0,0,0|2,0,0]=4 4120 B10R1.1 CSCc1ccc(cc1)I 62a_100000189116_200000210301 [2,0,0,0,0,0|2,0,0]=4 4121 B10R1.1 CSCc1ccc(cc1)I 62a_200000210301_100000189116 [2,0,0,0,0,0|2,0,0]=4 4122 B10R1.1 CSCc1ccc(nc1)O 271570a_203496583355_100000753673 [2,0,0,0,0,0|2,0,0]=4 4123 B10R1.1 Cc1ccc(cc1)CN[13CH3] 2230a_100000174908_200025704644 [2,0,0,0,0,0|2,0,0]=4 4124 B10R1.1 Cc1ccc(cc1)CN[13CH3] 34a_100000174908_200025704644 [2,0,0,0,0,0|2,0,0]=4 4125 B10R1.1 Cc1ccc(cc1)CO[13CH3] 34a_100011215236_200025704644 [2,0,0,0,0,0|2,0,0]=4 4126 B10R1.1 Cc1ccc(cc1)CO[13CH3] 7a_100011215236_200025704644 [2,0,0,0,0,0|2,0,0]=4 4127 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_100000210814_200025704644 [2,0,0,0,0,0|2,0,0]=4 4128 B10R1.1 Cc1ccc(cc1)CS[13CH3] 62a_200025704644_100000210814 [2,0,0,0,0,0|2,0,0]=4 4129 B10R1.1 N#CCc1ccc(cc1)O 271570a_203496583355_100011217881 [2,0,0,0,0,0|1,0,1]=4 4130 B10R1.1 NCCc1ccc(cc1)O 271570a_203496583355_100000755846 [2,0,0,0,0,0|1,0,0]=3 4131 B10R1.1 NNCc1ccc(cc1)O 271570a_203496583355_100016993955 [2,0,0,0,0,0|2,0,0]=4 4132 B10R1.1 O=CCc1ccc(cc1)O 271570a_203496583355_100011361690 [2,0,0,0,0,0|1,0,1]=4 4133 B10R1.1 OCCc1ccc(cc1)O 271570a_203496583355_100000766406 [2,0,0,0,0,0|1,0,0]=3 4134 B10R1.1 OCCc1ccc(cn1)O 271570a_203496583355_100012357577 [2,0,0,0,0,0|2,0,0]=4 4135 B10R1.1 OCCc1ccc(nc1)O 271570a_203496583355_100009880866 [2,0,0,0,0,0|2,0,0]=4 4136 B10R1.1 Oc1ccc(cc1)NCF 34a_100000185829_100015361967 [2,0,0,0,0,0|2,0,0]=4 4137 B10R1.1 Oc1ccc(cc1)SCF 62a_100015361967_100000185759 [2,0,0,0,0,0|2,0,0]=4 4138 B10R1.1 [13CH3]NCc1ccc(cc1)Br 2230a_100000174875_200025704644 [2,0,0,0,0,0|2,0,0]=4 4139 B10R1.1 [13CH3]NCc1ccc(cc1)Br 34a_100000174875_200025704644 [2,0,0,0,0,0|2,0,0]=4 4140 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 2230a_100000174871_200025704644 [2,0,0,0,0,0|2,0,0]=4 4141 B10R1.1 [13CH3]NCc1ccc(cc1)Cl 34a_100000174871_200025704644 [2,0,0,0,0,0|2,0,0]=4 4142 B10R1.1 [13CH3]NCc1ccc(cc1)F 2230a_100000174882_200025704644 [2,0,0,0,0,0|2,0,0]=4 4143 B10R1.1 [13CH3]NCc1ccc(cc1)F 34a_100000174882_200025704644 [2,0,0,0,0,0|2,0,0]=4 4144 B10R1.1 [13CH3]NCc1ccc(cc1)I 2230a_100016989417_200025704644 [2,0,0,0,0,0|2,0,0]=4 4145 B10R1.1 [13CH3]NCc1ccc(cc1)I 34a_100016989417_200025704644 [2,0,0,0,0,0|2,0,0]=4 4146 B10R1.1 [13CH3]NCc1ccc(cc1)O 34a_100000185549_200025704644 [2,0,0,0,0,0|1,0,0]=3 4147 B10R1.1 [13CH3]NCc1ccc(nc1)O 2230a_100000757128_200025704644 [2,0,0,0,0,0|2,0,0]=4 4148 B10R1.1 [13CH3]OCc1ccc(cc1)Br 34a_100000695286_200025704644 [2,0,0,0,0,0|2,0,0]=4 4149 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 34a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 4150 B10R1.1 [13CH3]OCc1ccc(cc1)Cl 7a_100000211118_200025704644 [2,0,0,0,0,0|2,0,0]=4 4151 B10R1.1 [13CH3]OCc1ccc(cc1)F 34a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 4152 B10R1.1 [13CH3]OCc1ccc(cc1)F 7a_100000210977_200025704644 [2,0,0,0,0,0|2,0,0]=4 4153 B10R1.1 [13CH3]OCc1ccc(cc1)I 34a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 4154 B10R1.1 [13CH3]OCc1ccc(cc1)I 7a_100000690907_200025704644 [2,0,0,0,0,0|2,0,0]=4 4155 B10R1.1 [13CH3]OCc1ccc(cc1)N 34a_100011215238_200025704644 [2,0,0,0,0,0|2,0,0]=4 4156 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_100000189115_200025704644 [2,0,0,0,0,0|2,0,0]=4 4157 B10R1.1 [13CH3]SCc1ccc(cc1)Br 62a_200025704644_100000189115 [2,0,0,0,0,0|2,0,0]=4 4158 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_100000187161_200025704644 [2,0,0,0,0,0|2,0,0]=4 4159 B10R1.1 [13CH3]SCc1ccc(cc1)Cl 62a_200025704644_100000187161 [2,0,0,0,0,0|2,0,0]=4 4160 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_100000198546_200025704644 [2,0,0,0,0,0|2,0,0]=4 4161 B10R1.1 [13CH3]SCc1ccc(cc1)F 62a_200025704644_100000187164 [2,0,0,0,0,0|2,0,0]=4 4162 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_100000189116_200025704644 [2,0,0,0,0,0|2,0,0]=4 4163 B10R1.1 [13CH3]SCc1ccc(cc1)I 62a_200025704644_100000189116 [2,0,0,0,0,0|2,0,0]=4 4164 B10R1.176 C=Cc1ccc(c(c1)C)O 271570a_100011290941_100000186361 [2,0,0,0,0,0|0,0,2]=4 4165 B10R1.176 C=Cc1ccc(c(c1)O)O 271570a_100011290941_100009813601 [2,0,0,0,0,0|0,0,2]=4 4166 B10R1.176 CCc1ccc(c(c1)Br)O 271570a_203496583355_200009997437 [2,0,0,0,0,0|1,0,0]=3 4167 B10R1.176 CCc1ccc(c(c1)F)O 271570a_203496583355_200010339503 [2,0,0,0,0,0|1,0,0]=3 4168 B10R1.176 CCc1ccc(c(c1)O)F 271570a_203496583355_200010244628 [2,0,0,0,0,0|1,0,0]=3 4169 B10R1.176 CCc1ccc(c(c1)O)N 271570a_203496583355_100012339725 [2,0,0,0,0,0|1,0,0]=3 4170 B10R1.176 CCc1ccc(c(c1)O)O 271570a_203496583355_100012339963 [2,0,0,0,0,0|0,0,0]=2 4171 B10R1.176 CNc1cc(c(cn1)O)C 271570a_203496583355_100012352278 [2,0,0,0,0,0|2,0,0]=4 4172 B10R1.176 CNc1ccc(c(c1)Br)O 34a_100011534360_200000210301 [2,0,0,0,0,0|2,0,0]=4 4173 B10R1.176 CNc1ccc(c(c1)C)Br 2230a_100000210723_200000210301 [2,0,0,0,0,0|2,0,0]=4 4174 B10R1.176 CNc1ccc(c(c1)C)Br 34a_100000210723_200000210301 [2,0,0,0,0,0|2,0,0]=4 4175 B10R1.176 CNc1ccc(c(c1)C)Br 7a_100000210723_200000210301 [2,0,0,0,0,0|2,0,0]=4 4176 B10R1.176 CNc1ccc(c(c1)C)C 2230a_100000724040_200000210301 [2,0,0,0,0,0|2,0,0]=4 4177 B10R1.176 CNc1ccc(c(c1)C)C 34a_100000724040_200000210301 [2,0,0,0,0,0|2,0,0]=4 4178 B10R1.176 CNc1ccc(c(c1)C)C 7a_100000724040_200000210301 [2,0,0,0,0,0|2,0,0]=4 4179 B10R1.176 CNc1ccc(c(c1)C)Cl 2230a_100000187808_200000210301 [2,0,0,0,0,0|2,0,0]=4 4180 B10R1.176 CNc1ccc(c(c1)C)Cl 34a_100000187808_200000210301 [2,0,0,0,0,0|2,0,0]=4 4181 B10R1.176 CNc1ccc(c(c1)C)Cl 7a_100000187808_200000210301 [2,0,0,0,0,0|2,0,0]=4 4182 B10R1.176 CNc1ccc(c(c1)C)F 2230a_100000750164_200000210301 [2,0,0,0,0,0|2,0,0]=4 4183 B10R1.176 CNc1ccc(c(c1)C)F 34a_100000750164_200000210301 [2,0,0,0,0,0|2,0,0]=4 4184 B10R1.176 CNc1ccc(c(c1)C)F 7a_100000750164_200000210301 [2,0,0,0,0,0|2,0,0]=4 4185 B10R1.176 CNc1ccc(c(c1)C)I 34a_100000198070_200000210301 [2,0,0,0,0,0|2,0,0]=4 4186 B10R1.176 CNc1ccc(c(c1)C)I 7a_100000198070_200000210301 [2,0,0,0,0,0|2,0,0]=4 4187 B10R1.176 CNc1ccc(c(c1)C)O 271570a_203496583355_100102888905 [2,0,0,0,0,0|1,0,0]=3 4188 B10R1.176 CNc1ccc(c(c1)C)O 34a_100011218179_200000210301 [2,0,0,0,0,0|1,0,0]=3 4189 B10R1.176 CNc1ccc(c(c1)C)O 7a_100011218179_200000210301 [2,0,0,0,0,0|1,0,0]=3 4190 B10R1.176 CNc1ccc(c(c1)Cl)O 34a_100000744943_200000210301 [2,0,0,0,0,0|2,0,0]=4 4191 B10R1.176 CNc1ccc(c(c1)F)O 271570a_203496583355_100012285320 [2,0,0,0,0,0|2,0,0]=4 4192 B10R1.176 CNc1ccc(c(c1)F)O 34a_100011220035_200000210301 [2,0,0,0,0,0|2,0,0]=4 4193 B10R1.176 CNc1ccc(c(c1)F)O 7a_100011220035_200000210301 [2,0,0,0,0,0|2,0,0]=4 4194 B10R1.176 CNc1ccc(c(c1)O)C 271570a_203496583355_100000707694 [2,0,0,0,0,0|2,0,0]=4 4195 B10R1.176 CNc1ccc(c(c1)O)C 34a_100000759471_200000210301 [2,0,0,0,0,0|2,0,0]=4 4196 B10R1.176 CNc1ccc(c(c1)O)C 7a_100000759471_200000210301 [2,0,0,0,0,0|2,0,0]=4 4197 B10R1.176 CNc1ccc(c(c1)O)Cl 34a_100011934209_200000210301 [2,0,0,0,0,0|2,0,0]=4 4198 B10R1.176 CNc1ccc(c(c1)O)F 34a_100012017398_200000210301 [2,0,0,0,0,0|2,0,0]=4 4199 B10R1.176 CNc1ccc(c(c1)O)F 7a_100012017398_200000210301 [2,0,0,0,0,0|2,0,0]=4 4200 B10R1.176 CNc1ccc(c(c1)O)O 34a_100102946323_200000210301 [2,0,0,0,0,0|1,0,0]=3 4201 B10R1.176 COc1cc(c(cn1)O)C 271570a_203496583355_100011934368 [2,0,0,0,0,0|2,0,0]=4 4202 B10R1.176 COc1cc(c(cn1)O)O 271570a_203496583355_100010738159 [2,0,0,0,0,0|2,0,0]=4 4203 B10R1.176 COc1ccc(c(c1)Br)O 271570a_203496583355_100012349170 [2,0,0,0,0,0|2,0,0]=4 4204 B10R1.176 COc1ccc(c(c1)C)Br 34a_100000690111_200000210301 [2,0,0,0,0,0|2,0,0]=4 4205 B10R1.176 COc1ccc(c(c1)C)Br 7a_100000690111_200000210301 [2,0,0,0,0,0|2,0,0]=4 4206 B10R1.176 COc1ccc(c(c1)C)C 34a_100000210932_200000210301 [2,0,0,0,0,0|2,0,0]=4 4207 B10R1.176 COc1ccc(c(c1)C)C 7a_100000210932_200000210301 [2,0,0,0,0,0|2,0,0]=4 4208 B10R1.176 COc1ccc(c(c1)C)Cl 34a_100000211092_200000210301 [2,0,0,0,0,0|2,0,0]=4 4209 B10R1.176 COc1ccc(c(c1)C)Cl 7a_100000211092_200000210301 [2,0,0,0,0,0|2,0,0]=4 4210 B10R1.176 COc1ccc(c(c1)C)F 34a_100000751312_200000210301 [2,0,0,0,0,0|2,0,0]=4 4211 B10R1.176 COc1ccc(c(c1)C)F 7a_100000751312_200000210301 [2,0,0,0,0,0|2,0,0]=4 4212 B10R1.176 COc1ccc(c(c1)C)I 34a_100000729255_200000210301 [2,0,0,0,0,0|2,0,0]=4 4213 B10R1.176 COc1ccc(c(c1)C)I 7a_100000729255_200000210301 [2,0,0,0,0,0|2,0,0]=4 4214 B10R1.176 COc1ccc(c(c1)C)N 34a_100000756630_200000210301 [2,0,0,0,0,0|2,0,0]=4 4215 B10R1.176 COc1ccc(c(c1)C)N 7a_100000756630_200000210301 [2,0,0,0,0,0|2,0,0]=4 4216 B10R1.176 COc1ccc(c(c1)C)O 271570a_203496583355_100000759875 [2,0,0,0,0,0|1,0,0]=3 4217 B10R1.176 COc1ccc(c(c1)F)O 271570a_203496583355_100000753793 [2,0,0,0,0,0|2,0,0]=4 4218 B10R1.176 COc1ccc(c(c1)N)O 271570a_203496583355_100000748021 [2,0,0,0,0,0|2,0,0]=4 4219 B10R1.176 COc1ccc(c(c1)O)Br 271570a_203496583355_100009992028 [2,0,0,0,0,0|2,0,0]=4 4220 B10R1.176 COc1ccc(c(c1)O)C 271570a_203496583355_100012349166 [2,0,0,0,0,0|2,0,0]=4 4221 B10R1.176 COc1ccc(c(c1)O)Cl 271570a_203496583355_100011356938 [2,0,0,0,0,0|2,0,0]=4 4222 B10R1.176 COc1ccc(c(c1)O)F 271570a_203496583355_100000699733 [2,0,0,0,0,0|2,0,0]=4 4223 B10R1.176 COc1ccc(c(c1)O)N 271570a_203496583355_100015195136 [2,0,0,0,0,0|2,0,0]=4 4224 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000685887 [2,0,0,0,0,0|1,0,0]=3 4225 B10R1.176 COc1ccc(c(c1)O)O 271570a_203496583355_100000719091 [2,0,0,0,0,0|1,0,0]=3 4226 B10R1.176 COc1ccc(c(n1)C)O 271570a_203496583355_100000766551 [2,0,0,0,0,0|2,0,0]=4 4227 B10R1.176 COc1cnc(c(c1)C)O 271570a_203496583355_200009851512 [2,0,0,0,0,0|2,0,0]=4 4228 B10R1.176 CSc1cc(c(cn1)O)C 62a_200000210301_100000692680 [2,0,0,0,0,0|2,0,0]=4 4229 B10R1.176 CSc1ccc(c(c1)Br)O 62a_100012361655_200000210301 [2,0,0,0,0,0|2,0,0]=4 4230 B10R1.176 CSc1ccc(c(c1)Br)O 62a_200000210301_100012361655 [2,0,0,0,0,0|2,0,0]=4 4231 B10R1.176 CSc1ccc(c(c1)C)Br 62a_100009813585_200000210301 [2,0,0,0,0,0|2,0,0]=4 4232 B10R1.176 CSc1ccc(c(c1)C)Br 62a_200000210301_100009813585 [2,0,0,0,0,0|2,0,0]=4 4233 B10R1.176 CSc1ccc(c(c1)C)C 62a_100011215607_200000210301 [2,0,0,0,0,0|2,0,0]=4 4234 B10R1.176 CSc1ccc(c(c1)C)C 62a_200000210301_100011215607 [2,0,0,0,0,0|2,0,0]=4 4235 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_100000049509_200000210301 [2,0,0,0,0,0|2,0,0]=4 4236 B10R1.176 CSc1ccc(c(c1)C)Cl 62a_200000210301_100000049509 [2,0,0,0,0,0|2,0,0]=4 4237 B10R1.176 CSc1ccc(c(c1)C)F 62a_100011218330_200000210301 [2,0,0,0,0,0|2,0,0]=4 4238 B10R1.176 CSc1ccc(c(c1)C)F 62a_200000210301_100011218330 [2,0,0,0,0,0|2,0,0]=4 4239 B10R1.176 CSc1ccc(c(c1)C)N 62a_100000211769_200000210301 [2,0,0,0,0,0|2,0,0]=4 4240 B10R1.176 CSc1ccc(c(c1)C)N 62a_200000210301_100000211769 [2,0,0,0,0,0|2,0,0]=4 4241 B10R1.176 CSc1ccc(c(c1)C)O 62a_200000210301_100000186361 [2,0,0,0,0,0|1,0,0]=3 4242 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_100012360047_200000210301 [2,0,0,0,0,0|2,0,0]=4 4243 B10R1.176 CSc1ccc(c(c1)Cl)O 62a_200000210301_100012360047 [2,0,0,0,0,0|2,0,0]=4 4244 B10R1.176 CSc1ccc(c(c1)F)O 271570a_203496583355_100009816902 [2,0,0,0,0,0|2,0,0]=4 4245 B10R1.176 CSc1ccc(c(c1)F)O 62a_100000185481_200000210301 [2,0,0,0,0,0|2,0,0]=4 4246 B10R1.176 CSc1ccc(c(c1)F)O 62a_200000210301_100000185481 [2,0,0,0,0,0|2,0,0]=4 4247 B10R1.176 CSc1ccc(c(c1)N)O 62a_100000752626_200000210301 [2,0,0,0,0,0|2,0,0]=4 4248 B10R1.176 CSc1ccc(c(c1)N)O 62a_200000210301_100000752626 [2,0,0,0,0,0|2,0,0]=4 4249 B10R1.176 CSc1ccc(c(c1)O)Br 62a_100012356990_200000210301 [2,0,0,0,0,0|2,0,0]=4 4250 B10R1.176 CSc1ccc(c(c1)O)Br 62a_200000210301_100012356990 [2,0,0,0,0,0|2,0,0]=4 4251 B10R1.176 CSc1ccc(c(c1)O)C 62a_100000685420_200000210301 [2,0,0,0,0,0|2,0,0]=4 4252 B10R1.176 CSc1ccc(c(c1)O)C 62a_200000210301_100000685420 [2,0,0,0,0,0|2,0,0]=4 4253 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_100011356854_200000210301 [2,0,0,0,0,0|2,0,0]=4 4254 B10R1.176 CSc1ccc(c(c1)O)Cl 62a_200000210301_100011356854 [2,0,0,0,0,0|2,0,0]=4 4255 B10R1.176 CSc1ccc(c(c1)O)F 271570a_203496583355_200010708804 [2,0,0,0,0,0|2,0,0]=4 4256 B10R1.176 CSc1ccc(c(c1)O)F 62a_100000686035_200000210301 [2,0,0,0,0,0|2,0,0]=4 4257 B10R1.176 CSc1ccc(c(c1)O)F 62a_200000210301_100000686035 [2,0,0,0,0,0|2,0,0]=4 4258 B10R1.176 CSc1ccc(c(c1)O)N 62a_100000739049_200000210301 [2,0,0,0,0,0|2,0,0]=4 4259 B10R1.176 CSc1ccc(c(c1)O)N 62a_200000210301_100000739049 [2,0,0,0,0,0|2,0,0]=4 4260 B10R1.176 CSc1ccc(c(c1)O)O 62a_200000210301_100009813601 [2,0,0,0,0,0|1,0,0]=3 4261 B10R1.176 CSc1ccc(c(n1)C)O 62a_100010233687_200000210301 [2,0,0,0,0,0|2,0,0]=4 4262 B10R1.176 CSc1ccc(c(n1)C)O 62a_200000210301_100010233687 [2,0,0,0,0,0|2,0,0]=4 4263 B10R1.176 CSc1cnc(c(c1)C)O 271570a_203496583355_203440288091 [2,0,0,0,0,0|2,0,0]=4 4264 B10R1.176 CSc1cnc(c(c1)C)O 62a_100000685391_200000210301 [2,0,0,0,0,0|2,0,0]=4 4265 B10R1.176 CSc1cnc(c(c1)C)O 62a_200000210301_100000685391 [2,0,0,0,0,0|2,0,0]=4 4266 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 2230a_100000210723_200025704644 [2,0,0,0,0,0|2,0,0]=4 4267 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 34a_100000210723_200025704644 [2,0,0,0,0,0|2,0,0]=4 4268 B10R1.176 Cc1cc(ccc1Br)N[13CH3] 7a_100000210723_200025704644 [2,0,0,0,0,0|2,0,0]=4 4269 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 34a_100000690111_200025704644 [2,0,0,0,0,0|2,0,0]=4 4270 B10R1.176 Cc1cc(ccc1Br)O[13CH3] 7a_100000690111_200025704644 [2,0,0,0,0,0|2,0,0]=4 4271 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_100009813585_200025704644 [2,0,0,0,0,0|2,0,0]=4 4272 B10R1.176 Cc1cc(ccc1Br)S[13CH3] 62a_200025704644_100009813585 [2,0,0,0,0,0|2,0,0]=4 4273 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 2230a_100000187808_200025704644 [2,0,0,0,0,0|2,0,0]=4 4274 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 34a_100000187808_200025704644 [2,0,0,0,0,0|2,0,0]=4 4275 B10R1.176 Cc1cc(ccc1Cl)N[13CH3] 7a_100000187808_200025704644 [2,0,0,0,0,0|2,0,0]=4 4276 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 34a_100000211092_200025704644 [2,0,0,0,0,0|2,0,0]=4 4277 B10R1.176 Cc1cc(ccc1Cl)O[13CH3] 7a_100000211092_200025704644 [2,0,0,0,0,0|2,0,0]=4 4278 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_100000049509_200025704644 [2,0,0,0,0,0|2,0,0]=4 4279 B10R1.176 Cc1cc(ccc1Cl)S[13CH3] 62a_200025704644_100000049509 [2,0,0,0,0,0|2,0,0]=4 4280 B10R1.176 Cc1cc(ccc1F)N[13CH3] 2230a_100000750164_200025704644 [2,0,0,0,0,0|2,0,0]=4 4281 B10R1.176 Cc1cc(ccc1F)N[13CH3] 34a_100000750164_200025704644 [2,0,0,0,0,0|2,0,0]=4 4282 B10R1.176 Cc1cc(ccc1F)N[13CH3] 7a_100000750164_200025704644 [2,0,0,0,0,0|2,0,0]=4 4283 B10R1.176 Cc1cc(ccc1F)O[13CH3] 34a_100000751312_200025704644 [2,0,0,0,0,0|2,0,0]=4 4284 B10R1.176 Cc1cc(ccc1F)O[13CH3] 7a_100000751312_200025704644 [2,0,0,0,0,0|2,0,0]=4 4285 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_100011218330_200025704644 [2,0,0,0,0,0|2,0,0]=4 4286 B10R1.176 Cc1cc(ccc1F)S[13CH3] 62a_200025704644_100011218330 [2,0,0,0,0,0|2,0,0]=4 4287 B10R1.176 Cc1cc(ccc1I)N[13CH3] 34a_100000198070_200025704644 [2,0,0,0,0,0|2,0,0]=4 4288 B10R1.176 Cc1cc(ccc1I)N[13CH3] 7a_100000198070_200025704644 [2,0,0,0,0,0|2,0,0]=4 4289 B10R1.176 Cc1cc(ccc1I)O[13CH3] 34a_100000729255_200025704644 [2,0,0,0,0,0|2,0,0]=4 4290 B10R1.176 Cc1cc(ccc1I)O[13CH3] 7a_100000729255_200025704644 [2,0,0,0,0,0|2,0,0]=4 4291 B10R1.176 Cc1cc(ccc1N)O[13CH3] 34a_100000756630_200025704644 [2,0,0,0,0,0|2,0,0]=4 4292 B10R1.176 Cc1cc(ccc1N)O[13CH3] 7a_100000756630_200025704644 [2,0,0,0,0,0|2,0,0]=4 4293 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_100000211769_200025704644 [2,0,0,0,0,0|2,0,0]=4 4294 B10R1.176 Cc1cc(ccc1N)S[13CH3] 62a_200025704644_100000211769 [2,0,0,0,0,0|2,0,0]=4 4295 B10R1.176 Cc1cc(ccc1O)C#N 271570a_203496583355_100000212329 [2,0,0,0,0,0|1,0,1]=4 4296 B10R1.176 Cc1cc(ccc1O)C=O 271570a_203496583355_100000765772 [2,0,0,0,0,0|1,0,1]=4 4297 B10R1.176 Cc1cc(ccc1O)CN 271570a_203496583355_100015205234 [2,0,0,0,0,0|1,0,0]=3 4298 B10R1.176 Cc1cc(ccc1O)CO 271570a_203496583355_100000718852 [2,0,0,0,0,0|1,0,0]=3 4299 B10R1.176 Cc1cc(ccc1O)NN 271570a_203496583355_100000745493 [2,0,0,0,0,0|2,0,0]=4 4300 B10R1.176 Cc1cc(ccc1O)N[13CH3] 34a_100011218179_200025704644 [2,0,0,0,0,0|1,0,0]=3 4301 B10R1.176 Cc1cc(ccc1O)N[13CH3] 7a_100011218179_200025704644 [2,0,0,0,0,0|1,0,0]=3 4302 B10R1.176 Cc1cc(ccc1O)S[13CH3] 62a_200025704644_100000186361 [2,0,0,0,0,0|1,0,0]=3 4303 B10R1.176 Cc1cc(cnc1O)CO 271570a_203496583355_200000092119 [2,0,0,0,0,0|2,0,0]=4 4304 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_100000685391_200025704644 [2,0,0,0,0,0|2,0,0]=4 4305 B10R1.176 Cc1cc(cnc1O)S[13CH3] 62a_200025704644_100000685391 [2,0,0,0,0,0|2,0,0]=4 4306 B10R1.176 Cc1cc(ncc1O)CO 271570a_203496583355_200010713146 [2,0,0,0,0,0|2,0,0]=4 4307 B10R1.176 Cc1cc(ncc1O)S[13CH3] 62a_200025704644_100000692680 [2,0,0,0,0,0|2,0,0]=4 4308 B10R1.176 Cc1ccc(cc1C)N[13CH3] 2230a_100000724040_200025704644 [2,0,0,0,0,0|2,0,0]=4 4309 B10R1.176 Cc1ccc(cc1C)N[13CH3] 34a_100000724040_200025704644 [2,0,0,0,0,0|2,0,0]=4 4310 B10R1.176 Cc1ccc(cc1C)N[13CH3] 7a_100000724040_200025704644 [2,0,0,0,0,0|2,0,0]=4 4311 B10R1.176 Cc1ccc(cc1C)O[13CH3] 34a_100000210932_200025704644 [2,0,0,0,0,0|2,0,0]=4 4312 B10R1.176 Cc1ccc(cc1C)O[13CH3] 7a_100000210932_200025704644 [2,0,0,0,0,0|2,0,0]=4 4313 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_100011215607_200025704644 [2,0,0,0,0,0|2,0,0]=4 4314 B10R1.176 Cc1ccc(cc1C)S[13CH3] 62a_200025704644_100011215607 [2,0,0,0,0,0|2,0,0]=4 4315 B10R1.176 Cc1ccc(cc1O)CO 271570a_203496583355_100000050133 [2,0,0,0,0,0|2,0,0]=4 4316 B10R1.176 Cc1ccc(cc1O)N[13CH3] 34a_100000759471_200025704644 [2,0,0,0,0,0|2,0,0]=4 4317 B10R1.176 Cc1ccc(cc1O)N[13CH3] 7a_100000759471_200025704644 [2,0,0,0,0,0|2,0,0]=4 4318 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_100000685420_200025704644 [2,0,0,0,0,0|2,0,0]=4 4319 B10R1.176 Cc1ccc(cc1O)S[13CH3] 62a_200025704644_100000685420 [2,0,0,0,0,0|2,0,0]=4 4320 B10R1.176 Cc1nc(ccc1O)CO 271570a_203496583355_100010114280 [2,0,0,0,0,0|2,0,0]=4 4321 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_100010233687_200025704644 [2,0,0,0,0,0|2,0,0]=4 4322 B10R1.176 Cc1nc(ccc1O)S[13CH3] 62a_200025704644_100010233687 [2,0,0,0,0,0|2,0,0]=4 4323 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000724445 [2,0,0,0,0,0|1,0,1]=4 4324 B10R1.176 N#Cc1ccc(c(c1)O)O 271570a_203496583355_100000725478 [2,0,0,0,0,0|1,0,1]=4 4325 B10R1.176 NCc1ccc(c(c1)F)O 271570a_203496583355_100000755036 [2,0,0,0,0,0|2,0,0]=4 4326 B10R1.176 NCc1ccc(c(c1)O)F 271570a_203496583355_100015193890 [2,0,0,0,0,0|2,0,0]=4 4327 B10R1.176 Nc1cc(ccc1O)CO 271570a_203496583355_100012347568 [2,0,0,0,0,0|2,0,0]=4 4328 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000041418 [2,0,0,0,0,0|1,0,1]=4 4329 B10R1.176 O=Cc1ccc(c(c1)O)O 271570a_203496583355_100000184552 [2,0,0,0,0,0|1,0,1]=4 4330 B10R1.176 OCc1ccc(c(c1)Cl)O 271570a_203496583355_100000718186 [2,0,0,0,0,0|2,0,0]=4 4331 B10R1.176 OCc1ccc(c(c1)F)O 271570a_203496583355_100011533735 [2,0,0,0,0,0|2,0,0]=4 4332 B10R1.176 OCc1ccc(c(c1)O)F 271570a_203496583355_100000246287 [2,0,0,0,0,0|2,0,0]=4 4333 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100000049605 [2,0,0,0,0,0|1,0,0]=3 4334 B10R1.176 OCc1ccc(c(c1)O)O 271570a_203496583355_100011191544 [2,0,0,0,0,0|1,0,0]=3 4335 B10R1.176 OCc1ccc(c(n1)O)O 271570a_203496583355_200000118097 [2,0,0,0,0,0|2,0,0]=4 4336 B10R1.176 [13CH3]Nc1ccc(c(c1)Br)O 34a_100011534360_200025704644 [2,0,0,0,0,0|2,0,0]=4 4337 B10R1.176 [13CH3]Nc1ccc(c(c1)Cl)O 34a_100000744943_200025704644 [2,0,0,0,0,0|2,0,0]=4 4338 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 34a_100011220035_200025704644 [2,0,0,0,0,0|2,0,0]=4 4339 B10R1.176 [13CH3]Nc1ccc(c(c1)F)O 7a_100011220035_200025704644 [2,0,0,0,0,0|2,0,0]=4 4340 B10R1.176 [13CH3]Nc1ccc(c(c1)O)Cl 34a_100011934209_200025704644 [2,0,0,0,0,0|2,0,0]=4 4341 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 34a_100012017398_200025704644 [2,0,0,0,0,0|2,0,0]=4 4342 B10R1.176 [13CH3]Nc1ccc(c(c1)O)F 7a_100012017398_200025704644 [2,0,0,0,0,0|2,0,0]=4 4343 B10R1.176 [13CH3]Nc1ccc(c(c1)O)O 34a_100102946323_200025704644 [2,0,0,0,0,0|1,0,0]=3 4344 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_100012361655_200025704644 [2,0,0,0,0,0|2,0,0]=4 4345 B10R1.176 [13CH3]Sc1ccc(c(c1)Br)O 62a_200025704644_100012361655 [2,0,0,0,0,0|2,0,0]=4 4346 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_100012360047_200025704644 [2,0,0,0,0,0|2,0,0]=4 4347 B10R1.176 [13CH3]Sc1ccc(c(c1)Cl)O 62a_200025704644_100012360047 [2,0,0,0,0,0|2,0,0]=4 4348 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_100000185481_200025704644 [2,0,0,0,0,0|2,0,0]=4 4349 B10R1.176 [13CH3]Sc1ccc(c(c1)F)O 62a_200025704644_100000185481 [2,0,0,0,0,0|2,0,0]=4 4350 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_100000752626_200025704644 [2,0,0,0,0,0|2,0,0]=4 4351 B10R1.176 [13CH3]Sc1ccc(c(c1)N)O 62a_200025704644_100000752626 [2,0,0,0,0,0|2,0,0]=4 4352 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_100012356990_200025704644 [2,0,0,0,0,0|2,0,0]=4 4353 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Br 62a_200025704644_100012356990 [2,0,0,0,0,0|2,0,0]=4 4354 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_100011356854_200025704644 [2,0,0,0,0,0|2,0,0]=4 4355 B10R1.176 [13CH3]Sc1ccc(c(c1)O)Cl 62a_200025704644_100011356854 [2,0,0,0,0,0|2,0,0]=4 4356 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_100000686035_200025704644 [2,0,0,0,0,0|2,0,0]=4 4357 B10R1.176 [13CH3]Sc1ccc(c(c1)O)F 62a_200025704644_100000686035 [2,0,0,0,0,0|2,0,0]=4 4358 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_100000739049_200025704644 [2,0,0,0,0,0|2,0,0]=4 4359 B10R1.176 [13CH3]Sc1ccc(c(c1)O)N 62a_200025704644_100000739049 [2,0,0,0,0,0|2,0,0]=4 4360 B10R1.176 [13CH3]Sc1ccc(c(c1)O)O 62a_200025704644_100009813601 [2,0,0,0,0,0|1,0,0]=3 4361 B10R1.30 C=Cc1cc(ccc1O)C 271570a_100011290941_100000765521 [2,0,0,0,0,0|1,0,1]=4 4362 B10R1.30 CCc1cc(ccc1O)Br 271570a_203496583355_100011216195 [2,0,0,0,0,0|2,0,0]=4 4363 B10R1.30 CCc1cc(ccc1O)N 271570a_203496583355_100010109747 [2,0,0,0,0,0|2,0,0]=4 4364 B10R1.30 CCc1cc(ccc1O)O 271570a_203496583355_100012338938 [2,0,0,0,0,0|2,0,0]=4 4365 B10R1.30 CNc1cc(ccc1Br)C 34a_100000745044_200000210301 [2,0,0,0,0,0|2,0,0]=4 4366 B10R1.30 CNc1cc(ccc1C)C 2230a_100000185781_200000210301 [2,0,0,0,0,0|2,0,0]=4 4367 B10R1.30 CNc1cc(ccc1C)C 34a_100000185781_200000210301 [2,0,0,0,0,0|2,0,0]=4 4368 B10R1.30 CNc1cc(ccc1C)C 7a_100000185781_200000210301 [2,0,0,0,0,0|2,0,0]=4 4369 B10R1.30 CNc1cc(ccc1Cl)C 34a_100011215360_200000210301 [2,0,0,0,0,0|2,0,0]=4 4370 B10R1.30 CNc1cc(ccc1F)C 34a_100000211285_200000210301 [2,0,0,0,0,0|2,0,0]=4 4371 B10R1.30 CNc1cc(ccc1I)C 34a_100011216686_200000210301 [2,0,0,0,0,0|2,0,0]=4 4372 B10R1.30 CNc1cc(ccc1O)Br 34a_100000752626_200000210301 [2,0,0,0,0,0|2,0,0]=4 4373 B10R1.30 CNc1cc(ccc1O)C 34a_100011215204_200000210301 [2,0,0,0,0,0|1,0,0]=3 4374 B10R1.30 CNc1cc(ccc1O)Cl 34a_100000210500_200000210301 [2,0,0,0,0,0|2,0,0]=4 4375 B10R1.30 CNc1cc(ccc1O)F 271570a_203496583355_100020633008 [2,0,0,0,0,0|2,0,0]=4 4376 B10R1.30 CNc1cc(ccc1O)F 34a_100000759472_200000210301 [2,0,0,0,0,0|2,0,0]=4 4377 B10R1.30 COc1cc(ccc1Br)Br 34a_100011220040_200000210301 [2,0,0,0,0,0|2,0,0]=4 4378 B10R1.30 COc1cc(ccc1Br)Br 7a_100011220040_200000210301 [2,0,0,0,0,0|2,0,0]=4 4379 B10R1.30 COc1cc(ccc1Br)C 34a_100012002257_200000210301 [2,0,0,0,0,0|1,0,0]=3 4380 B10R1.30 COc1cc(ccc1Br)C 7a_100012002257_200000210301 [2,0,0,0,0,0|1,0,0]=3 4381 B10R1.30 COc1cc(ccc1Br)Cl 34a_100012339455_200000210301 [2,0,0,0,0,0|2,0,0]=4 4382 B10R1.30 COc1cc(ccc1Br)Cl 7a_100012339455_200000210301 [2,0,0,0,0,0|2,0,0]=4 4383 B10R1.30 COc1cc(ccc1Br)F 34a_100000690578_200000210301 [2,0,0,0,0,0|2,0,0]=4 4384 B10R1.30 COc1cc(ccc1Br)F 7a_100000690578_200000210301 [2,0,0,0,0,0|2,0,0]=4 4385 B10R1.30 COc1cc(ccc1Br)I 34a_100012356990_200000210301 [2,0,0,0,0,0|2,0,0]=4 4386 B10R1.30 COc1cc(ccc1Br)I 7a_100012356990_200000210301 [2,0,0,0,0,0|2,0,0]=4 4387 B10R1.30 COc1cc(ccc1Br)O 271570a_203496583355_100012353699 [2,0,0,0,0,0|2,0,0]=4 4388 B10R1.30 COc1cc(ccc1C)Br 34a_100000685420_200000210301 [2,0,0,0,0,0|2,0,0]=4 4389 B10R1.30 COc1cc(ccc1C)Br 7a_100000685420_200000210301 [2,0,0,0,0,0|2,0,0]=4 4390 B10R1.30 COc1cc(ccc1C)C 34a_100000210931_200000210301 [2,0,0,0,0,0|1,0,0]=3 4391 B10R1.30 COc1cc(ccc1C)C 7a_100000210931_200000210301 [2,0,0,0,0,0|1,0,0]=3 4392 B10R1.30 COc1cc(ccc1C)Cl 34a_100000756515_200000210301 [2,0,0,0,0,0|2,0,0]=4 4393 B10R1.30 COc1cc(ccc1C)Cl 7a_100000756515_200000210301 [2,0,0,0,0,0|2,0,0]=4 4394 B10R1.30 COc1cc(ccc1C)F 34a_100000690566_200000210301 [2,0,0,0,0,0|2,0,0]=4 4395 B10R1.30 COc1cc(ccc1C)F 7a_100000690566_200000210301 [2,0,0,0,0,0|2,0,0]=4 4396 B10R1.30 COc1cc(ccc1C)I 7a_100000766334_200000210301 [2,0,0,0,0,0|2,0,0]=4 4397 B10R1.30 COc1cc(ccc1C)N 34a_100000759471_200000210301 [2,0,0,0,0,0|2,0,0]=4 4398 B10R1.30 COc1cc(ccc1C)N 7a_100000759471_200000210301 [2,0,0,0,0,0|2,0,0]=4 4399 B10R1.30 COc1cc(ccc1C)O 271570a_203496583355_100011830276 [2,0,0,0,0,0|2,0,0]=4 4400 B10R1.30 COc1cc(ccc1Cl)Br 34a_100000738945_200000210301 [2,0,0,0,0,0|2,0,0]=4 4401 B10R1.30 COc1cc(ccc1Cl)Br 7a_100000738945_200000210301 [2,0,0,0,0,0|2,0,0]=4 4402 B10R1.30 COc1cc(ccc1Cl)C 34a_100000211493_200000210301 [2,0,0,0,0,0|1,0,0]=3 4403 B10R1.30 COc1cc(ccc1Cl)C 7a_100000211493_200000210301 [2,0,0,0,0,0|1,0,0]=3 4404 B10R1.30 COc1cc(ccc1Cl)Cl 34a_100000211422_200000210301 [2,0,0,0,0,0|2,0,0]=4 4405 B10R1.30 COc1cc(ccc1Cl)Cl 7a_100000211422_200000210301 [2,0,0,0,0,0|2,0,0]=4 4406 B10R1.30 COc1cc(ccc1Cl)F 34a_100000692107_200000210301 [2,0,0,0,0,0|2,0,0]=4 4407 B10R1.30 COc1cc(ccc1Cl)F 7a_100000692107_200000210301 [2,0,0,0,0,0|2,0,0]=4 4408 B10R1.30 COc1cc(ccc1Cl)I 34a_100011356854_200000210301 [2,0,0,0,0,0|2,0,0]=4 4409 B10R1.30 COc1cc(ccc1Cl)I 7a_100011356854_200000210301 [2,0,0,0,0,0|2,0,0]=4 4410 B10R1.30 COc1cc(ccc1Cl)N 34a_100011934209_200000210301 [2,0,0,0,0,0|2,0,0]=4 4411 B10R1.30 COc1cc(ccc1Cl)O 271570a_203496583355_100011356853 [2,0,0,0,0,0|2,0,0]=4 4412 B10R1.30 COc1cc(ccc1F)Br 34a_100000686035_200000210301 [2,0,0,0,0,0|2,0,0]=4 4413 B10R1.30 COc1cc(ccc1F)Br 7a_100000686035_200000210301 [2,0,0,0,0,0|2,0,0]=4 4414 B10R1.30 COc1cc(ccc1F)C 34a_100000759540_200000210301 [2,0,0,0,0,0|1,0,0]=3 4415 B10R1.30 COc1cc(ccc1F)C 7a_100000759540_200000210301 [2,0,0,0,0,0|1,0,0]=3 4416 B10R1.30 COc1cc(ccc1F)Cl 34a_100000757397_200000210301 [2,0,0,0,0,0|2,0,0]=4 4417 B10R1.30 COc1cc(ccc1F)Cl 7a_100000757397_200000210301 [2,0,0,0,0,0|2,0,0]=4 4418 B10R1.30 COc1cc(ccc1F)F 34a_100000752141_200000210301 [2,0,0,0,0,0|2,0,0]=4 4419 B10R1.30 COc1cc(ccc1F)F 7a_100000752141_200000210301 [2,0,0,0,0,0|2,0,0]=4 4420 B10R1.30 COc1cc(ccc1F)I 34a_100009958187_200000210301 [2,0,0,0,0,0|2,0,0]=4 4421 B10R1.30 COc1cc(ccc1F)I 7a_100009958187_200000210301 [2,0,0,0,0,0|2,0,0]=4 4422 B10R1.30 COc1cc(ccc1F)N 34a_100012017398_200000210301 [2,0,0,0,0,0|2,0,0]=4 4423 B10R1.30 COc1cc(ccc1F)N 7a_100012017398_200000210301 [2,0,0,0,0,0|2,0,0]=4 4424 B10R1.30 COc1cc(ccc1F)O 271570a_203496583355_100011934186 [2,0,0,0,0,0|2,0,0]=4 4425 B10R1.30 COc1cc(ccc1I)Br 34a_100012344904_200000210301 [2,0,0,0,0,0|2,0,0]=4 4426 B10R1.30 COc1cc(ccc1I)Br 7a_100012344904_200000210301 [2,0,0,0,0,0|2,0,0]=4 4427 B10R1.30 COc1cc(ccc1I)Cl 34a_100000050036_200000210301 [2,0,0,0,0,0|2,0,0]=4 4428 B10R1.30 COc1cc(ccc1I)Cl 7a_100000050036_200000210301 [2,0,0,0,0,0|2,0,0]=4 4429 B10R1.30 COc1cc(ccc1I)F 34a_100010084537_200000210301 [2,0,0,0,0,0|2,0,0]=4 4430 B10R1.30 COc1cc(ccc1I)F 7a_100010084537_200000210301 [2,0,0,0,0,0|2,0,0]=4 4431 B10R1.30 COc1cc(ccc1N)Br 34a_100000739049_200000210301 [2,0,0,0,0,0|2,0,0]=4 4432 B10R1.30 COc1cc(ccc1N)Br 7a_100000739049_200000210301 [2,0,0,0,0,0|2,0,0]=4 4433 B10R1.30 COc1cc(ccc1N)C 34a_100000211527_200000210301 [2,0,0,0,0,0|1,0,0]=3 4434 B10R1.30 COc1cc(ccc1N)C 7a_100000211527_200000210301 [2,0,0,0,0,0|1,0,0]=3 4435 B10R1.30 COc1cc(ccc1N)Cl 34a_100000185728_200000210301 [2,0,0,0,0,0|2,0,0]=4 4436 B10R1.30 COc1cc(ccc1N)Cl 7a_100000185728_200000210301 [2,0,0,0,0,0|2,0,0]=4 4437 B10R1.30 COc1cc(ccc1N)F 34a_100000753323_200000210301 [2,0,0,0,0,0|2,0,0]=4 4438 B10R1.30 COc1cc(ccc1N)F 7a_100000753323_200000210301 [2,0,0,0,0,0|2,0,0]=4 4439 B10R1.30 COc1cc(ccc1N)I 34a_100000057187_200000210301 [2,0,0,0,0,0|2,0,0]=4 4440 B10R1.30 COc1cc(ccc1N)I 7a_100000057187_200000210301 [2,0,0,0,0,0|2,0,0]=4 4441 B10R1.30 COc1cc(ccc1N)N 34a_100025717382_200000210301 [2,0,0,0,0,0|2,0,0]=4 4442 B10R1.30 COc1cc(ccc1N)O 271570a_203496583355_100011279103 [2,0,0,0,0,0|2,0,0]=4 4443 B10R1.30 COc1cc(ccc1O)Br 271570a_203496583355_100010245111 [2,0,0,0,0,0|1,0,0]=3 4444 B10R1.30 COc1cc(ccc1O)C 271570a_203496583355_100010200004 [2,0,0,0,0,0|0,0,0]=2 4445 B10R1.30 COc1cc(ccc1O)Cl 271570a_203496583355_100000050115 [2,0,0,0,0,0|1,0,0]=3 4446 B10R1.30 COc1cc(ccc1O)F 271570a_203496583355_100000757151 [2,0,0,0,0,0|1,0,0]=3 4447 B10R1.30 COc1cc(ccc1O)N 271570a_203496583355_100000765947 [2,0,0,0,0,0|1,0,0]=3 4448 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100000694246 [2,0,0,0,0,0|1,0,0]=3 4449 B10R1.30 COc1cc(ccc1O)O 271570a_203496583355_100011827694 [2,0,0,0,0,0|1,0,0]=3 4450 B10R1.30 COc1cc(cnc1Cl)C 34a_100012000487_200000210301 [2,0,0,0,0,0|2,0,0]=4 4451 B10R1.30 COc1cc(cnc1Cl)C 7a_100012000487_200000210301 [2,0,0,0,0,0|2,0,0]=4 4452 B10R1.30 COc1cc(cnc1F)C 34a_100009849810_200000210301 [2,0,0,0,0,0|2,0,0]=4 4453 B10R1.30 COc1cc(cnc1F)C 7a_100009849810_200000210301 [2,0,0,0,0,0|2,0,0]=4 4454 B10R1.30 COc1cc(cnc1O)C 271570a_203496583355_200000118316 [2,0,0,0,0,0|1,0,0]=3 4455 B10R1.30 COc1cc(cnc1O)F 271570a_203496583355_100009867738 [2,0,0,0,0,0|2,0,0]=4 4456 B10R1.30 COc1cc(cnc1O)N 271570a_203496583355_100000097218 [2,0,0,0,0,0|2,0,0]=4 4457 B10R1.30 COc1cc(ncc1Br)C 34a_100011016184_200000210301 [2,0,0,0,0,0|2,0,0]=4 4458 B10R1.30 COc1cc(ncc1O)C 271570a_203496583355_100000717771 [2,0,0,0,0,0|1,0,0]=3 4459 B10R1.30 COc1cc(ncc1O)Cl 271570a_203496583355_100010154656 [2,0,0,0,0,0|2,0,0]=4 4460 B10R1.30 COc1cc(ncc1O)F 271570a_203496583355_100010135560 [2,0,0,0,0,0|2,0,0]=4 4461 B10R1.30 COc1cc(ncc1O)N 271570a_203496583355_100015506990 [2,0,0,0,0,0|2,0,0]=4 4462 B10R1.30 COc1nc(ccc1Br)C 34a_100009817604_200000210301 [2,0,0,0,0,0|2,0,0]=4 4463 B10R1.30 COc1nc(ccc1N)C 34a_100000687486_200000210301 [2,0,0,0,0,0|2,0,0]=4 4464 B10R1.30 COc1nc(ccc1O)C 271570a_203496583355_100010138632 [2,0,0,0,0,0|1,0,0]=3 4465 B10R1.30 COc1nc(ccc1O)N 271570a_203496583355_100010187630 [2,0,0,0,0,0|2,0,0]=4 4466 B10R1.30 COc1nc(ccc1O)O 271570a_203496583355_100010893133 [2,0,0,0,0,0|2,0,0]=4 4467 B10R1.30 CSc1cc(ccc1Br)C 62a_100012353751_200000210301 [2,0,0,0,0,0|1,1,0]=4 4468 B10R1.30 CSc1cc(ccc1Br)C 62a_200000210301_100012353751 [2,0,0,0,0,0|1,1,0]=4 4469 B10R1.30 CSc1cc(ccc1C)C 62a_100000210833_200000210301 [2,0,0,0,0,0|1,1,0]=4 4470 B10R1.30 CSc1cc(ccc1C)C 62a_200000210301_100000210833 [2,0,0,0,0,0|1,1,0]=4 4471 B10R1.30 CSc1cc(ccc1Cl)C 62a_100012356289_200000210301 [2,0,0,0,0,0|1,1,0]=4 4472 B10R1.30 CSc1cc(ccc1Cl)C 62a_200000210301_100012356289 [2,0,0,0,0,0|1,1,0]=4 4473 B10R1.30 CSc1cc(ccc1F)C 62a_100000736223_200000210301 [2,0,0,0,0,0|1,1,0]=4 4474 B10R1.30 CSc1cc(ccc1F)C 62a_200000210301_100000736223 [2,0,0,0,0,0|1,1,0]=4 4475 B10R1.30 CSc1cc(ccc1N)C 62a_100011356834_200000210301 [2,0,0,0,0,0|1,1,0]=4 4476 B10R1.30 CSc1cc(ccc1N)C 62a_200000210301_100011356834 [2,0,0,0,0,0|1,1,0]=4 4477 B10R1.30 CSc1cc(ccc1O)Br 62a_100012355227_200000210301 [2,0,0,0,0,0|1,1,0]=4 4478 B10R1.30 CSc1cc(ccc1O)Br 62a_200000210301_100012355227 [2,0,0,0,0,0|1,1,0]=4 4479 B10R1.30 CSc1cc(ccc1O)C 271570a_203496583355_200010709736 [2,0,0,0,0,0|0,1,0]=3 4480 B10R1.30 CSc1cc(ccc1O)C 62a_100000765521_200000210301 [2,0,0,0,0,0|0,1,0]=3 4481 B10R1.30 CSc1cc(ccc1O)C 62a_200000210301_100000765521 [2,0,0,0,0,0|0,1,0]=3 4482 B10R1.30 CSc1cc(ccc1O)Cl 62a_100011356953_200000210301 [2,0,0,0,0,0|1,1,0]=4 4483 B10R1.30 CSc1cc(ccc1O)Cl 62a_200000210301_100011356953 [2,0,0,0,0,0|1,1,0]=4 4484 B10R1.30 CSc1cc(ccc1O)F 62a_100000211999_200000210301 [2,0,0,0,0,0|1,1,0]=4 4485 B10R1.30 CSc1cc(ccc1O)F 62a_200000210301_100000211999 [2,0,0,0,0,0|1,1,0]=4 4486 B10R1.30 CSc1cc(ccc1O)N 62a_100011534360_200000210301 [2,0,0,0,0,0|1,1,0]=4 4487 B10R1.30 CSc1cc(ccc1O)N 62a_200000210301_100011534360 [2,0,0,0,0,0|1,1,0]=4 4488 B10R1.30 CSc1cc(ccc1O)O 62a_200000210301_100009813629 [2,0,0,0,0,0|1,1,0]=4 4489 B10R1.30 CSc1cc(cnc1O)C 271570a_203496583355_100010884634 [2,0,0,0,0,0|1,1,0]=4 4490 B10R1.30 CSc1cc(cnc1O)C 62a_100000719714_200000210301 [2,0,0,0,0,0|1,1,0]=4 4491 B10R1.30 CSc1cc(cnc1O)C 62a_200000210301_100000719714 [2,0,0,0,0,0|1,1,0]=4 4492 B10R1.30 CSc1cc(ncc1O)C 62a_100009843476_200000210301 [2,0,0,0,0,0|1,1,0]=4 4493 B10R1.30 CSc1cc(ncc1O)C 62a_200000210301_100009843476 [2,0,0,0,0,0|1,1,0]=4 4494 B10R1.30 CSc1nc(ccc1O)C 62a_100000702858_200000210301 [2,0,0,0,0,0|1,1,0]=4 4495 B10R1.30 CSc1nc(ccc1O)C 62a_200000210301_100000702858 [2,0,0,0,0,0|1,1,0]=4 4496 B10R1.30 Cc1cc(c(cn1)Br)O[13CH3] 34a_100011016184_200025704644 [2,0,0,0,0,0|2,0,0]=4 4497 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_100009843476_200025704644 [2,0,0,0,0,0|1,1,0]=4 4498 B10R1.30 Cc1cc(c(cn1)O)S[13CH3] 62a_200025704644_100009843476 [2,0,0,0,0,0|1,1,0]=4 4499 B10R1.30 Cc1ccc(c(c1)C#N)O 271570a_203496583355_100011935190 [2,0,0,0,0,0|2,0,0]=4 4500 B10R1.30 Cc1ccc(c(c1)C=O)O 271570a_203496583355_100011551863 [2,0,0,0,0,0|2,0,0]=4 4501 B10R1.30 Cc1ccc(c(c1)CO)O 271570a_203496583355_100012361352 [2,0,0,0,0,0|2,0,0]=4 4502 B10R1.30 Cc1ccc(c(c1)N[13CH3])Br 34a_100000745044_200025704644 [2,0,0,0,0,0|2,0,0]=4 4503 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 2230a_100000185781_200025704644 [2,0,0,0,0,0|2,0,0]=4 4504 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 34a_100000185781_200025704644 [2,0,0,0,0,0|2,0,0]=4 4505 B10R1.30 Cc1ccc(c(c1)N[13CH3])C 7a_100000185781_200025704644 [2,0,0,0,0,0|2,0,0]=4 4506 B10R1.30 Cc1ccc(c(c1)N[13CH3])Cl 34a_100011215360_200025704644 [2,0,0,0,0,0|2,0,0]=4 4507 B10R1.30 Cc1ccc(c(c1)N[13CH3])F 34a_100000211285_200025704644 [2,0,0,0,0,0|2,0,0]=4 4508 B10R1.30 Cc1ccc(c(c1)N[13CH3])I 34a_100011216686_200025704644 [2,0,0,0,0,0|2,0,0]=4 4509 B10R1.30 Cc1ccc(c(c1)N[13CH3])O 34a_100011215204_200025704644 [2,0,0,0,0,0|1,0,0]=3 4510 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 34a_100012002257_200025704644 [2,0,0,0,0,0|1,0,0]=3 4511 B10R1.30 Cc1ccc(c(c1)O[13CH3])Br 7a_100012002257_200025704644 [2,0,0,0,0,0|1,0,0]=3 4512 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 34a_100000210931_200025704644 [2,0,0,0,0,0|1,0,0]=3 4513 B10R1.30 Cc1ccc(c(c1)O[13CH3])C 7a_100000210931_200025704644 [2,0,0,0,0,0|1,0,0]=3 4514 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 34a_100000211493_200025704644 [2,0,0,0,0,0|1,0,0]=3 4515 B10R1.30 Cc1ccc(c(c1)O[13CH3])Cl 7a_100000211493_200025704644 [2,0,0,0,0,0|1,0,0]=3 4516 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 34a_100000759540_200025704644 [2,0,0,0,0,0|1,0,0]=3 4517 B10R1.30 Cc1ccc(c(c1)O[13CH3])F 7a_100000759540_200025704644 [2,0,0,0,0,0|1,0,0]=3 4518 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 34a_100000211527_200025704644 [2,0,0,0,0,0|1,0,0]=3 4519 B10R1.30 Cc1ccc(c(c1)O[13CH3])N 7a_100000211527_200025704644 [2,0,0,0,0,0|1,0,0]=3 4520 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_100012353751_200025704644 [2,0,0,0,0,0|1,1,0]=4 4521 B10R1.30 Cc1ccc(c(c1)S[13CH3])Br 62a_200025704644_100012353751 [2,0,0,0,0,0|1,1,0]=4 4522 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_100000210833_200025704644 [2,0,0,0,0,0|1,1,0]=4 4523 B10R1.30 Cc1ccc(c(c1)S[13CH3])C 62a_200025704644_100000210833 [2,0,0,0,0,0|1,1,0]=4 4524 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_100012356289_200025704644 [2,0,0,0,0,0|1,1,0]=4 4525 B10R1.30 Cc1ccc(c(c1)S[13CH3])Cl 62a_200025704644_100012356289 [2,0,0,0,0,0|1,1,0]=4 4526 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_100000736223_200025704644 [2,0,0,0,0,0|1,1,0]=4 4527 B10R1.30 Cc1ccc(c(c1)S[13CH3])F 62a_200025704644_100000736223 [2,0,0,0,0,0|1,1,0]=4 4528 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_100011356834_200025704644 [2,0,0,0,0,0|1,1,0]=4 4529 B10R1.30 Cc1ccc(c(c1)S[13CH3])N 62a_200025704644_100011356834 [2,0,0,0,0,0|1,1,0]=4 4530 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_100000765521_200025704644 [2,0,0,0,0,0|0,1,0]=3 4531 B10R1.30 Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100000765521 [2,0,0,0,0,0|0,1,0]=3 4532 B10R1.30 Cc1ccc(c(n1)O[13CH3])Br 34a_100009817604_200025704644 [2,0,0,0,0,0|2,0,0]=4 4533 B10R1.30 Cc1ccc(c(n1)O[13CH3])N 34a_100000687486_200025704644 [2,0,0,0,0,0|2,0,0]=4 4534 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_100000702858_200025704644 [2,0,0,0,0,0|1,1,0]=4 4535 B10R1.30 Cc1ccc(c(n1)S[13CH3])O 62a_200025704644_100000702858 [2,0,0,0,0,0|1,1,0]=4 4536 B10R1.30 Cc1ccc(cc1O[13CH3])Br 34a_100000685420_200025704644 [2,0,0,0,0,0|2,0,0]=4 4537 B10R1.30 Cc1ccc(cc1O[13CH3])Br 7a_100000685420_200025704644 [2,0,0,0,0,0|2,0,0]=4 4538 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 34a_100000756515_200025704644 [2,0,0,0,0,0|2,0,0]=4 4539 B10R1.30 Cc1ccc(cc1O[13CH3])Cl 7a_100000756515_200025704644 [2,0,0,0,0,0|2,0,0]=4 4540 B10R1.30 Cc1ccc(cc1O[13CH3])F 34a_100000690566_200025704644 [2,0,0,0,0,0|2,0,0]=4 4541 B10R1.30 Cc1ccc(cc1O[13CH3])F 7a_100000690566_200025704644 [2,0,0,0,0,0|2,0,0]=4 4542 B10R1.30 Cc1ccc(cc1O[13CH3])I 7a_100000766334_200025704644 [2,0,0,0,0,0|2,0,0]=4 4543 B10R1.30 Cc1ccc(cc1O[13CH3])N 34a_100000759471_200025704644 [2,0,0,0,0,0|2,0,0]=4 4544 B10R1.30 Cc1ccc(cc1O[13CH3])N 7a_100000759471_200025704644 [2,0,0,0,0,0|2,0,0]=4 4545 B10R1.30 Cc1cnc(c(c1)O[13CH3])Cl 34a_100012000487_200025704644 [2,0,0,0,0,0|2,0,0]=4 4546 B10R1.30 Cc1cnc(c(c1)O[13CH3])Cl 7a_100012000487_200025704644 [2,0,0,0,0,0|2,0,0]=4 4547 B10R1.30 Cc1cnc(c(c1)O[13CH3])F 34a_100009849810_200025704644 [2,0,0,0,0,0|2,0,0]=4 4548 B10R1.30 Cc1cnc(c(c1)O[13CH3])F 7a_100009849810_200025704644 [2,0,0,0,0,0|2,0,0]=4 4549 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_100000719714_200025704644 [2,0,0,0,0,0|1,1,0]=4 4550 B10R1.30 Cc1cnc(c(c1)S[13CH3])O 62a_200025704644_100000719714 [2,0,0,0,0,0|1,1,0]=4 4551 B10R1.30 [13CH3]Nc1cc(ccc1O)Br 34a_100000752626_200025704644 [2,0,0,0,0,0|2,0,0]=4 4552 B10R1.30 [13CH3]Nc1cc(ccc1O)Cl 34a_100000210500_200025704644 [2,0,0,0,0,0|2,0,0]=4 4553 B10R1.30 [13CH3]Nc1cc(ccc1O)F 34a_100000759472_200025704644 [2,0,0,0,0,0|2,0,0]=4 4554 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 34a_100011220040_200025704644 [2,0,0,0,0,0|2,0,0]=4 4555 B10R1.30 [13CH3]Oc1cc(ccc1Br)Br 7a_100011220040_200025704644 [2,0,0,0,0,0|2,0,0]=4 4556 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 34a_100012339455_200025704644 [2,0,0,0,0,0|2,0,0]=4 4557 B10R1.30 [13CH3]Oc1cc(ccc1Br)Cl 7a_100012339455_200025704644 [2,0,0,0,0,0|2,0,0]=4 4558 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 34a_100000690578_200025704644 [2,0,0,0,0,0|2,0,0]=4 4559 B10R1.30 [13CH3]Oc1cc(ccc1Br)F 7a_100000690578_200025704644 [2,0,0,0,0,0|2,0,0]=4 4560 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 34a_100012356990_200025704644 [2,0,0,0,0,0|2,0,0]=4 4561 B10R1.30 [13CH3]Oc1cc(ccc1Br)I 7a_100012356990_200025704644 [2,0,0,0,0,0|2,0,0]=4 4562 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 34a_100000738945_200025704644 [2,0,0,0,0,0|2,0,0]=4 4563 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Br 7a_100000738945_200025704644 [2,0,0,0,0,0|2,0,0]=4 4564 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 34a_100000211422_200025704644 [2,0,0,0,0,0|2,0,0]=4 4565 B10R1.30 [13CH3]Oc1cc(ccc1Cl)Cl 7a_100000211422_200025704644 [2,0,0,0,0,0|2,0,0]=4 4566 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 34a_100000692107_200025704644 [2,0,0,0,0,0|2,0,0]=4 4567 B10R1.30 [13CH3]Oc1cc(ccc1Cl)F 7a_100000692107_200025704644 [2,0,0,0,0,0|2,0,0]=4 4568 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 34a_100011356854_200025704644 [2,0,0,0,0,0|2,0,0]=4 4569 B10R1.30 [13CH3]Oc1cc(ccc1Cl)I 7a_100011356854_200025704644 [2,0,0,0,0,0|2,0,0]=4 4570 B10R1.30 [13CH3]Oc1cc(ccc1Cl)N 34a_100011934209_200025704644 [2,0,0,0,0,0|2,0,0]=4 4571 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 34a_100000686035_200025704644 [2,0,0,0,0,0|2,0,0]=4 4572 B10R1.30 [13CH3]Oc1cc(ccc1F)Br 7a_100000686035_200025704644 [2,0,0,0,0,0|2,0,0]=4 4573 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 34a_100000757397_200025704644 [2,0,0,0,0,0|2,0,0]=4 4574 B10R1.30 [13CH3]Oc1cc(ccc1F)Cl 7a_100000757397_200025704644 [2,0,0,0,0,0|2,0,0]=4 4575 B10R1.30 [13CH3]Oc1cc(ccc1F)F 34a_100000752141_200025704644 [2,0,0,0,0,0|2,0,0]=4 4576 B10R1.30 [13CH3]Oc1cc(ccc1F)F 7a_100000752141_200025704644 [2,0,0,0,0,0|2,0,0]=4 4577 B10R1.30 [13CH3]Oc1cc(ccc1F)I 34a_100009958187_200025704644 [2,0,0,0,0,0|2,0,0]=4 4578 B10R1.30 [13CH3]Oc1cc(ccc1F)I 7a_100009958187_200025704644 [2,0,0,0,0,0|2,0,0]=4 4579 B10R1.30 [13CH3]Oc1cc(ccc1F)N 34a_100012017398_200025704644 [2,0,0,0,0,0|2,0,0]=4 4580 B10R1.30 [13CH3]Oc1cc(ccc1F)N 7a_100012017398_200025704644 [2,0,0,0,0,0|2,0,0]=4 4581 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 34a_100012344904_200025704644 [2,0,0,0,0,0|2,0,0]=4 4582 B10R1.30 [13CH3]Oc1cc(ccc1I)Br 7a_100012344904_200025704644 [2,0,0,0,0,0|2,0,0]=4 4583 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 34a_100000050036_200025704644 [2,0,0,0,0,0|2,0,0]=4 4584 B10R1.30 [13CH3]Oc1cc(ccc1I)Cl 7a_100000050036_200025704644 [2,0,0,0,0,0|2,0,0]=4 4585 B10R1.30 [13CH3]Oc1cc(ccc1I)F 34a_100010084537_200025704644 [2,0,0,0,0,0|2,0,0]=4 4586 B10R1.30 [13CH3]Oc1cc(ccc1I)F 7a_100010084537_200025704644 [2,0,0,0,0,0|2,0,0]=4 4587 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 34a_100000739049_200025704644 [2,0,0,0,0,0|2,0,0]=4 4588 B10R1.30 [13CH3]Oc1cc(ccc1N)Br 7a_100000739049_200025704644 [2,0,0,0,0,0|2,0,0]=4 4589 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 34a_100000185728_200025704644 [2,0,0,0,0,0|2,0,0]=4 4590 B10R1.30 [13CH3]Oc1cc(ccc1N)Cl 7a_100000185728_200025704644 [2,0,0,0,0,0|2,0,0]=4 4591 B10R1.30 [13CH3]Oc1cc(ccc1N)F 34a_100000753323_200025704644 [2,0,0,0,0,0|2,0,0]=4 4592 B10R1.30 [13CH3]Oc1cc(ccc1N)F 7a_100000753323_200025704644 [2,0,0,0,0,0|2,0,0]=4 4593 B10R1.30 [13CH3]Oc1cc(ccc1N)I 34a_100000057187_200025704644 [2,0,0,0,0,0|2,0,0]=4 4594 B10R1.30 [13CH3]Oc1cc(ccc1N)I 7a_100000057187_200025704644 [2,0,0,0,0,0|2,0,0]=4 4595 B10R1.30 [13CH3]Oc1cc(ccc1N)N 34a_100025717382_200025704644 [2,0,0,0,0,0|2,0,0]=4 4596 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_100012355227_200025704644 [2,0,0,0,0,0|1,1,0]=4 4597 B10R1.30 [13CH3]Sc1cc(ccc1O)Br 62a_200025704644_100012355227 [2,0,0,0,0,0|1,1,0]=4 4598 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_100011356953_200025704644 [2,0,0,0,0,0|1,1,0]=4 4599 B10R1.30 [13CH3]Sc1cc(ccc1O)Cl 62a_200025704644_100011356953 [2,0,0,0,0,0|1,1,0]=4 4600 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_100000211999_200025704644 [2,0,0,0,0,0|1,1,0]=4 4601 B10R1.30 [13CH3]Sc1cc(ccc1O)F 62a_200025704644_100000211999 [2,0,0,0,0,0|1,1,0]=4 4602 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_100011534360_200025704644 [2,0,0,0,0,0|1,1,0]=4 4603 B10R1.30 [13CH3]Sc1cc(ccc1O)N 62a_200025704644_100011534360 [2,0,0,0,0,0|1,1,0]=4 4604 B10R1.30 [13CH3]Sc1cc(ccc1O)O 62a_200025704644_100009813629 [2,0,0,0,0,0|1,1,0]=4 4605 B12R1.41 CC=Cc1cc(cc(c1)OC)Br 271570a_100016259895_100010141301 [1,1,0,0,0,0|0,0,2]=4 4606 B12R1.41 CC=Cc1cc(cc(c1)OC)C 271570a_100016259895_100010187550 [1,1,0,0,0,0|0,0,2]=4 4607 B12R1.41 CC=Cc1cc(cc(c1)OC)Cl 271570a_100016259895_100010147680 [1,1,0,0,0,0|0,0,2]=4 4608 B12R1.41 CC=Cc1cc(cc(c1)OC)F 271570a_100016259895_100011934182 [1,1,0,0,0,0|0,0,2]=4 4609 B12R1.41 CC=Cc1cc(cc(c1)OC)N 271570a_100016259895_100000750983 [1,1,0,0,0,0|0,0,2]=4 4610 B12R1.41 CC=Cc1cc(cc(c1)OC)O 271570a_100016259895_100010068927 [1,1,0,0,0,0|0,0,2]=4 4611 B12R1.41 CCNc1cc(cc(c1)CC)Br 2230a_100010074814_100000210202 [1,1,0,0,0,0|2,0,0]=4 4612 B12R1.41 CCNc1cc(cc(c1)CC)Br 34a_100010074814_100000210202 [1,1,0,0,0,0|2,0,0]=4 4613 B12R1.41 CCNc1cc(cc(c1)CC)Br 7a_100010074814_100000210202 [1,1,0,0,0,0|2,0,0]=4 4614 B12R1.41 CCNc1cc(cc(c1)CC)C 2230a_100012022893_100000210202 [1,1,0,0,0,0|2,0,0]=4 4615 B12R1.41 CCNc1cc(cc(c1)CC)C 34a_100012022893_100000210202 [1,1,0,0,0,0|2,0,0]=4 4616 B12R1.41 CCNc1cc(cc(c1)CC)C 7a_100012022893_100000210202 [1,1,0,0,0,0|2,0,0]=4 4617 B12R1.41 CCNc1cc(cc(c1)OC)Br 34a_100000750983_100000210202 [1,1,0,0,0,0|1,0,0]=3 4618 B12R1.41 CCNc1cc(cc(c1)OC)Br 7a_100000750983_100000210202 [1,1,0,0,0,0|1,0,0]=3 4619 B12R1.41 CCNc1cc(cc(c1)OC)C 2230a_100012001870_100000210202 [1,1,0,0,0,0|1,0,0]=3 4620 B12R1.41 CCNc1cc(cc(c1)OC)C 34a_100012001870_100000210202 [1,1,0,0,0,0|1,0,0]=3 4621 B12R1.41 CCNc1cc(cc(c1)OC)C 7a_100012001870_100000210202 [1,1,0,0,0,0|1,0,0]=3 4622 B12R1.41 CCNc1cc(cc(c1)OC)Cl 2230a_100000051436_100000210202 [1,1,0,0,0,0|1,0,0]=3 4623 B12R1.41 CCNc1cc(cc(c1)OC)Cl 34a_100000051436_100000210202 [1,1,0,0,0,0|1,0,0]=3 4624 B12R1.41 CCNc1cc(cc(c1)OC)Cl 7a_100000051436_100000210202 [1,1,0,0,0,0|1,0,0]=3 4625 B12R1.41 CCNc1cc(cc(c1)OC)F 2230a_100000687699_100000210202 [1,1,0,0,0,0|1,0,0]=3 4626 B12R1.41 CCNc1cc(cc(c1)OC)F 34a_100000687699_100000210202 [1,1,0,0,0,0|1,0,0]=3 4627 B12R1.41 CCNc1cc(cc(c1)OC)F 7a_100000687699_100000210202 [1,1,0,0,0,0|1,0,0]=3 4628 B12R1.41 CCNc1cc(cc(c1)OC)O 34a_200000692186_100000210202 [1,1,0,0,0,0|1,0,0]=3 4629 B12R1.41 CCOc1cc(cc(c1)OC)Br 34a_100010068927_100000210202 [1,1,0,0,0,0|1,0,0]=3 4630 B12R1.41 CCOc1cc(cc(c1)OC)Br 7a_100010068927_100000210202 [1,1,0,0,0,0|1,0,0]=3 4631 B12R1.41 CCOc1cc(cc(c1)OC)C 34a_100011216608_100000210202 [1,1,0,0,0,0|1,0,0]=3 4632 B12R1.41 CCOc1cc(cc(c1)OC)C 7a_100011216608_100000210202 [1,1,0,0,0,0|1,0,0]=3 4633 B12R1.41 CCOc1cc(cc(c1)OC)Cl 34a_100000051430_100000210202 [1,1,0,0,0,0|1,0,0]=3 4634 B12R1.41 CCOc1cc(cc(c1)OC)Cl 7a_100000051430_100000210202 [1,1,0,0,0,0|1,0,0]=3 4635 B12R1.41 CCOc1cc(cc(c1)OC)F 34a_100011369910_100000210202 [1,1,0,0,0,0|1,0,0]=3 4636 B12R1.41 CCOc1cc(cc(c1)OC)F 7a_100011369910_100000210202 [1,1,0,0,0,0|1,0,0]=3 4637 B12R1.41 CCOc1cc(cc(c1)OC)N 34a_200000692186_100000210202 [1,1,0,0,0,0|1,0,0]=3 4638 B12R1.41 CCOc1cc(cc(c1)OC)N 7a_200000692186_100000210202 [1,1,0,0,0,0|1,0,0]=3 4639 B12R1.41 CCOc1cc(cc(c1)SC)F 62a_100012343907_200000210301 [1,1,0,0,0,0|1,1,0]=4 4640 B12R1.41 CCOc1cc(cc(c1)SC)F 62a_200000210301_100012343907 [1,1,0,0,0,0|1,1,0]=4 4641 B12R1.41 CCOc1cc(cc(c1)S[13CH3])F 62a_100012343907_200025704644 [1,1,0,0,0,0|1,1,0]=4 4642 B12R1.41 CCOc1cc(cc(c1)S[13CH3])F 62a_200025704644_100012343907 [1,1,0,0,0,0|1,1,0]=4 4643 B12R1.41 CCSc1cc(cc(c1)CC)N 62a_100000210202_100010074814 [1,1,0,0,0,0|2,0,0]=4 4644 B12R1.41 CCSc1cc(cc(c1)CC)N 62a_100010074814_100000210202 [1,1,0,0,0,0|2,0,0]=4 4645 B12R1.41 CCSc1cc(cc(c1)NC)F 62a_100000210202_106741647397 [1,1,0,0,0,0|2,0,0]=4 4646 B12R1.41 CCSc1cc(cc(c1)NC)F 62a_106741647397_100000210202 [1,1,0,0,0,0|2,0,0]=4 4647 B12R1.41 CCSc1cc(cc(c1)OC)Br 62a_100000210202_100010141301 [1,1,0,0,0,0|1,0,0]=3 4648 B12R1.41 CCSc1cc(cc(c1)OC)Br 62a_100010141301_100000210202 [1,1,0,0,0,0|1,0,0]=3 4649 B12R1.41 CCSc1cc(cc(c1)OC)C 62a_100000210202_100010187550 [1,1,0,0,0,0|1,0,0]=3 4650 B12R1.41 CCSc1cc(cc(c1)OC)Cl 62a_100000210202_100010147680 [1,1,0,0,0,0|1,0,0]=3 4651 B12R1.41 CCSc1cc(cc(c1)OC)Cl 62a_100010147680_100000210202 [1,1,0,0,0,0|1,0,0]=3 4652 B12R1.41 CCSc1cc(cc(c1)OC)F 62a_100000210202_100011934182 [1,1,0,0,0,0|1,0,0]=3 4653 B12R1.41 CCSc1cc(cc(c1)OC)F 62a_100011934182_100000210202 [1,1,0,0,0,0|1,0,0]=3 4654 B12R1.41 CCSc1cc(cc(c1)OC)N 62a_100000210202_100000750983 [1,1,0,0,0,0|1,0,0]=3 4655 B12R1.41 CCSc1cc(cc(c1)OC)N 62a_100000750983_100000210202 [1,1,0,0,0,0|1,0,0]=3 4656 B12R1.41 CCSc1cc(cc(c1)OC)O 62a_100000210202_100010068927 [1,1,0,0,0,0|1,0,0]=3 4657 B12R1.41 CCSc1cc(cc(c1)SC)C 62a_100000210202_200010709730 [1,1,0,0,0,0|1,1,0]=4 4658 B12R1.41 CCSc1cc(cc(c1)SC)C 62a_200010709730_100000210202 [1,1,0,0,0,0|1,1,0]=4 4659 B12R1.41 CCSc1cc(cc(c1)SC)F 62a_100000210202_200010245467 [1,1,0,0,0,0|1,1,0]=4 4660 B12R1.41 CCSc1cc(cc(c1)SC)F 62a_200010245467_100000210202 [1,1,0,0,0,0|1,1,0]=4 4661 B12R1.41 CCSc1cc(cc(n1)C)OC 62a_100000210202_200009849800 [1,1,0,0,0,0|2,0,0]=4 4662 B12R1.41 CCSc1cc(cc(n1)C)OC 62a_200009849800_100000210202 [1,1,0,0,0,0|2,0,0]=4 4663 B12R1.41 CCSc1cc(cc(n1)N)OC 62a_100000210202_100010257270 [1,1,0,0,0,0|2,0,0]=4 4664 B12R1.41 CCSc1cc(cc(n1)N)OC 62a_100010257270_100000210202 [1,1,0,0,0,0|2,0,0]=4 4665 B12R1.41 CCSc1cc(cc(n1)OC)C 62a_100000210202_100009856763 [1,1,0,0,0,0|2,0,0]=4 4666 B12R1.41 CCSc1cc(cc(n1)OC)C 62a_100009856763_100000210202 [1,1,0,0,0,0|2,0,0]=4 4667 B12R1.41 CCSc1cc(cc(n1)OC)N 62a_100000210202_100012187057 [1,1,0,0,0,0|2,0,0]=4 4668 B12R1.41 CCSc1cc(cc(n1)OC)N 62a_100012187057_100000210202 [1,1,0,0,0,0|2,0,0]=4 4669 B12R1.41 CCSc1cc(nc(c1)OC)C 62a_100000210202_100010067692 [1,1,0,0,0,0|2,0,0]=4 4670 B12R1.41 CCSc1cc(nc(c1)OC)C 62a_100010067692_100000210202 [1,1,0,0,0,0|2,0,0]=4 4671 B12R1.41 CCSc1cc(nc(c1)OC)N 62a_100000210202_100010136845 [1,1,0,0,0,0|2,0,0]=4 4672 B12R1.41 CCSc1cc(nc(c1)OC)N 62a_100010136845_100000210202 [1,1,0,0,0,0|2,0,0]=4 4673 B12R1.41 CNCc1cc(cc(c1)OC)Br 207a_100102657272_100009816777 [1,1,0,0,0,0|1,0,0]=3 4674 B12R1.41 CNCc1cc(cc(c1)OC)Br 2230a_106832991635_100010162483 [1,1,0,0,0,0|1,0,0]=3 4675 B12R1.41 CNCc1cc(cc(c1)OC)Br 269862a_106832991636_100009816777 [1,1,0,0,0,0|1,0,0]=3 4676 B12R1.41 CNCc1cc(cc(c1)OC)Br 26a_100102657272_100010068927 [1,1,0,0,0,0|1,0,0]=3 4677 B12R1.41 CNCc1cc(cc(c1)OC)Br 270004a_106832991635_100009816777 [1,1,0,0,0,0|1,0,0]=3 4678 B12R1.41 CNCc1cc(cc(c1)OC)Br 34a_100102657272_100010162483 [1,1,0,0,0,0|1,0,0]=3 4679 B12R1.41 CNCc1cc(cc(c1)OC)Br 7a_106832991635_100010162483 [1,1,0,0,0,0|1,0,0]=3 4680 B12R1.41 CNCc1cc(cc(c1)OC)C 207a_100102657272_100000101404 [1,1,0,0,0,0|1,0,0]=3 4681 B12R1.41 CNCc1cc(cc(c1)OC)C 270004a_106832991635_100000101404 [1,1,0,0,0,0|1,0,0]=3 4682 B12R1.41 CNCc1cc(cc(c1)OC)Cl 207a_100102657272_100000087488 [1,1,0,0,0,0|1,0,0]=3 4683 B12R1.41 CNCc1cc(cc(c1)OC)Cl 2230a_106744500063_200000210301 [1,1,0,0,0,0|1,0,0]=3 4684 B12R1.41 CNCc1cc(cc(c1)OC)Cl 2230a_106832991635_100010188059 [1,1,0,0,0,0|1,0,0]=3 4685 B12R1.41 CNCc1cc(cc(c1)OC)Cl 26a_100102657272_100000051430 [1,1,0,0,0,0|1,0,0]=3 4686 B12R1.41 CNCc1cc(cc(c1)OC)Cl 270004a_106832991635_100000087488 [1,1,0,0,0,0|1,0,0]=3 4687 B12R1.41 CNCc1cc(cc(c1)OC)Cl 34a_100102657272_100010188059 [1,1,0,0,0,0|1,0,0]=3 4688 B12R1.41 CNCc1cc(cc(c1)OC)Cl 34a_106744500063_200000210301 [1,1,0,0,0,0|1,0,0]=3 4689 B12R1.41 CNCc1cc(cc(c1)OC)Cl 7a_106832991635_100010188059 [1,1,0,0,0,0|1,0,0]=3 4690 B12R1.41 CNCc1cc(cc(c1)OC)F 207a_100102657272_100011934815 [1,1,0,0,0,0|1,0,0]=3 4691 B12R1.41 CNCc1cc(cc(c1)OC)F 2230a_100000696013_200000210301 [1,1,0,0,0,0|1,0,0]=3 4692 B12R1.41 CNCc1cc(cc(c1)OC)F 2230a_106832991635_100011934817 [1,1,0,0,0,0|1,0,0]=3 4693 B12R1.41 CNCc1cc(cc(c1)OC)F 270004a_106832991635_100011934815 [1,1,0,0,0,0|1,0,0]=3 4694 B12R1.41 CNCc1cc(cc(c1)OC)F 34a_100000696013_200000210301 [1,1,0,0,0,0|1,0,0]=3 4695 B12R1.41 CNCc1cc(cc(c1)OC)F 34a_100102657272_100011934817 [1,1,0,0,0,0|1,0,0]=3 4696 B12R1.41 CNCc1cc(cc(c1)OC)F 7a_106832991635_100011934817 [1,1,0,0,0,0|1,0,0]=3 4697 B12R1.41 CNCc1cc(cc(c1)OC)O 207a_100102657272_100009856911 [1,1,0,0,0,0|1,0,0]=3 4698 B12R1.41 CNCc1cc(cc(c1)OC)O 270004a_106832991635_100009856911 [1,1,0,0,0,0|1,0,0]=3 4699 B12R1.41 CNCc1cc(cc(c1)SC)C 207a_100102657272_200010986840 [1,1,0,0,0,0|1,1,0]=4 4700 B12R1.41 CNCc1cc(cc(c1)SC)C 269862a_106832991636_200010986840 [1,1,0,0,0,0|1,1,0]=4 4701 B12R1.41 CNCc1cc(cc(c1)SC)C 270004a_106832991635_200010986840 [1,1,0,0,0,0|1,1,0]=4 4702 B12R1.41 CNCc1cc(cc(n1)Cl)OC 270004a_106832991635_200009844316 [1,1,0,0,0,0|2,0,0]=4 4703 B12R1.41 CNCc1cc(nc(c1)OC)C 2230a_106832991635_200012183585 [1,1,0,0,0,0|2,0,0]=4 4704 B12R1.41 CNCc1cc(nc(c1)OC)C 34a_100102657272_200012183585 [1,1,0,0,0,0|2,0,0]=4 4705 B12R1.41 CNCc1cc(nc(c1)OC)C 7a_106832991635_200012183585 [1,1,0,0,0,0|2,0,0]=4 4706 B12R1.41 CNCc1cc(nc(c1)OC)Cl 2230a_100009841630_200000210301 [1,1,0,0,0,0|2,0,0]=4 4707 B12R1.41 COCc1cc(cc(c1)OC)Br 34a_100009995317_200000210301 [1,1,0,0,0,0|1,0,0]=3 4708 B12R1.41 COCc1cc(cc(c1)OC)Br 34a_100138415774_100010162483 [1,1,0,0,0,0|1,0,0]=3 4709 B12R1.41 COCc1cc(cc(c1)OC)Br 7a_100009995317_200000210301 [1,1,0,0,0,0|1,0,0]=3 4710 B12R1.41 COCc1cc(cc(c1)OC)C 34a_100009863105_200000210301 [1,1,0,0,0,0|1,0,0]=3 4711 B12R1.41 COCc1cc(cc(c1)OC)C 7a_100009863105_200000210301 [1,1,0,0,0,0|1,0,0]=3 4712 B12R1.41 COCc1cc(cc(c1)OC)Cl 34a_100000087487_200000210301 [1,1,0,0,0,0|1,0,0]=3 4713 B12R1.41 COCc1cc(cc(c1)OC)Cl 34a_100138415774_100010188059 [1,1,0,0,0,0|1,0,0]=3 4714 B12R1.41 COCc1cc(cc(c1)OC)Cl 7a_100000087487_200000210301 [1,1,0,0,0,0|1,0,0]=3 4715 B12R1.41 COCc1cc(cc(c1)OC)F 34a_100011934816_200000210301 [1,1,0,0,0,0|1,0,0]=3 4716 B12R1.41 COCc1cc(cc(c1)OC)F 34a_100138415774_100011934817 [1,1,0,0,0,0|1,0,0]=3 4717 B12R1.41 COCc1cc(cc(c1)OC)F 7a_100011934816_200000210301 [1,1,0,0,0,0|1,0,0]=3 4718 B12R1.41 COCc1cc(cc(c1)OC)N 34a_100012182899_200000210301 [1,1,0,0,0,0|1,0,0]=3 4719 B12R1.41 COCc1cc(cc(c1)SC)F 62a_100012630430_200000210301 [1,1,0,0,0,0|1,1,0]=4 4720 B12R1.41 COCc1cc(cc(c1)SC)F 62a_200000210301_100012630430 [1,1,0,0,0,0|1,1,0]=4 4721 B12R1.41 COCc1cc(cc(c1)S[13CH3])F 62a_100012630430_200025704644 [1,1,0,0,0,0|1,1,0]=4 4722 B12R1.41 COCc1cc(cc(c1)S[13CH3])F 62a_200025704644_100012630430 [1,1,0,0,0,0|1,1,0]=4 4723 B12R1.41 COCc1cc(nc(c1)OC)C 34a_100138415774_200012183585 [1,1,0,0,0,0|2,0,0]=4 4724 B12R1.41 COc1cc(cc(c1)CC#N)O 271570a_203496583355_100010146821 [1,1,0,0,0,0|1,0,1]=4 4725 B12R1.41 COc1cc(cc(c1)CN[13CH3])Cl 2230a_106744500063_200025704644 [1,1,0,0,0,0|1,0,0]=3 4726 B12R1.41 COc1cc(cc(c1)CN[13CH3])Cl 34a_106744500063_200025704644 [1,1,0,0,0,0|1,0,0]=3 4727 B12R1.41 COc1cc(cc(c1)CN[13CH3])F 2230a_100000696013_200025704644 [1,1,0,0,0,0|1,0,0]=3 4728 B12R1.41 COc1cc(cc(c1)CN[13CH3])F 34a_100000696013_200025704644 [1,1,0,0,0,0|1,0,0]=3 4729 B12R1.41 COc1cc(cc(c1)CO[13CH3])Br 34a_100009995317_200025704644 [1,1,0,0,0,0|1,0,0]=3 4730 B12R1.41 COc1cc(cc(c1)CO[13CH3])Br 7a_100009995317_200025704644 [1,1,0,0,0,0|1,0,0]=3 4731 B12R1.41 COc1cc(cc(c1)CO[13CH3])C 34a_100009863105_200025704644 [1,1,0,0,0,0|1,0,0]=3 4732 B12R1.41 COc1cc(cc(c1)CO[13CH3])C 7a_100009863105_200025704644 [1,1,0,0,0,0|1,0,0]=3 4733 B12R1.41 COc1cc(cc(c1)CO[13CH3])Cl 34a_100000087487_200025704644 [1,1,0,0,0,0|1,0,0]=3 4734 B12R1.41 COc1cc(cc(c1)CO[13CH3])Cl 7a_100000087487_200025704644 [1,1,0,0,0,0|1,0,0]=3 4735 B12R1.41 COc1cc(cc(c1)CO[13CH3])F 34a_100011934816_200025704644 [1,1,0,0,0,0|1,0,0]=3 4736 B12R1.41 COc1cc(cc(c1)CO[13CH3])F 7a_100011934816_200025704644 [1,1,0,0,0,0|1,0,0]=3 4737 B12R1.41 COc1cc(cc(c1)CO[13CH3])N 34a_100012182899_200025704644 [1,1,0,0,0,0|1,0,0]=3 4738 B12R1.41 COc1cc(cc(c1)CSC)Br 62a_100010162483_200000210301 [1,1,0,0,0,0|1,0,0]=3 4739 B12R1.41 COc1cc(cc(c1)CSC)Br 62a_200000210301_100010162483 [1,1,0,0,0,0|1,0,0]=3 4740 B12R1.41 COc1cc(cc(c1)CSC)Cl 62a_100010188059_200000210301 [1,1,0,0,0,0|1,0,0]=3 4741 B12R1.41 COc1cc(cc(c1)CSC)Cl 62a_200000210301_100010188059 [1,1,0,0,0,0|1,0,0]=3 4742 B12R1.41 COc1cc(cc(c1)CSC)F 62a_100011934817_200000210301 [1,1,0,0,0,0|1,0,0]=3 4743 B12R1.41 COc1cc(cc(c1)CSC)F 62a_200000210301_100011934817 [1,1,0,0,0,0|1,0,0]=3 4744 B12R1.41 COc1cc(cc(c1)CS[13CH3])Br 62a_100010162483_200025704644 [1,1,0,0,0,0|1,0,0]=3 4745 B12R1.41 COc1cc(cc(c1)CS[13CH3])Br 62a_200025704644_100010162483 [1,1,0,0,0,0|1,0,0]=3 4746 B12R1.41 COc1cc(cc(c1)CS[13CH3])Cl 62a_100010188059_200025704644 [1,1,0,0,0,0|1,0,0]=3 4747 B12R1.41 COc1cc(cc(c1)CS[13CH3])Cl 62a_200025704644_100010188059 [1,1,0,0,0,0|1,0,0]=3 4748 B12R1.41 COc1cc(cc(c1)CS[13CH3])F 62a_100011934817_200025704644 [1,1,0,0,0,0|1,0,0]=3 4749 B12R1.41 COc1cc(cc(c1)CS[13CH3])F 62a_200025704644_100011934817 [1,1,0,0,0,0|1,0,0]=3 4750 B12R1.41 COc1cc(cc(c1)NCF)Br 34a_100000750983_100015361967 [1,1,0,0,0,0|2,0,0]=4 4751 B12R1.41 COc1cc(cc(c1)NCF)Br 7a_100000750983_100015361967 [1,1,0,0,0,0|2,0,0]=4 4752 B12R1.41 COc1cc(cc(c1)NCF)C 34a_100012001870_100015361967 [1,1,0,0,0,0|2,0,0]=4 4753 B12R1.41 COc1cc(cc(c1)NCF)C 7a_100012001870_100015361967 [1,1,0,0,0,0|2,0,0]=4 4754 B12R1.41 COc1cc(cc(c1)NCF)Cl 34a_100000051436_100015361967 [1,1,0,0,0,0|2,0,0]=4 4755 B12R1.41 COc1cc(cc(c1)NCF)Cl 7a_100000051436_100015361967 [1,1,0,0,0,0|2,0,0]=4 4756 B12R1.41 COc1cc(cc(c1)NCF)F 34a_100000687699_100015361967 [1,1,0,0,0,0|2,0,0]=4 4757 B12R1.41 COc1cc(cc(c1)NCF)F 7a_100000687699_100015361967 [1,1,0,0,0,0|2,0,0]=4 4758 B12R1.41 COc1cc(cc(c1)NCF)O 34a_200000692186_100015361967 [1,1,0,0,0,0|2,0,0]=4 4759 B12R1.41 COc1cc(cc(c1)OCF)Br 34a_100010068927_100015361967 [1,1,0,0,0,0|2,0,0]=4 4760 B12R1.41 COc1cc(cc(c1)OCF)Br 7a_100010068927_100015361967 [1,1,0,0,0,0|2,0,0]=4 4761 B12R1.41 COc1cc(cc(c1)OCF)C 34a_100011216608_100015361967 [1,1,0,0,0,0|2,0,0]=4 4762 B12R1.41 COc1cc(cc(c1)OCF)C 7a_100011216608_100015361967 [1,1,0,0,0,0|2,0,0]=4 4763 B12R1.41 COc1cc(cc(c1)OCF)Cl 34a_100000051430_100015361967 [1,1,0,0,0,0|2,0,0]=4 4764 B12R1.41 COc1cc(cc(c1)OCF)Cl 7a_100000051430_100015361967 [1,1,0,0,0,0|2,0,0]=4 4765 B12R1.41 COc1cc(cc(c1)OCF)F 34a_100011369910_100015361967 [1,1,0,0,0,0|2,0,0]=4 4766 B12R1.41 COc1cc(cc(c1)OCF)F 7a_100011369910_100015361967 [1,1,0,0,0,0|2,0,0]=4 4767 B12R1.41 COc1cc(cc(c1)OCF)N 34a_200000692186_100015361967 [1,1,0,0,0,0|2,0,0]=4 4768 B12R1.41 COc1cc(cc(c1)OCF)N 7a_200000692186_100015361967 [1,1,0,0,0,0|2,0,0]=4 4769 B12R1.41 COc1cc(cc(c1)SCF)Br 62a_100010141301_100015361967 [1,1,0,0,0,0|2,0,0]=4 4770 B12R1.41 COc1cc(cc(c1)SCF)Br 62a_100015361967_100010141301 [1,1,0,0,0,0|2,0,0]=4 4771 B12R1.41 COc1cc(cc(c1)SCF)C 62a_100015361967_100010187550 [1,1,0,0,0,0|2,0,0]=4 4772 B12R1.41 COc1cc(cc(c1)SCF)Cl 62a_100010147680_100015361967 [1,1,0,0,0,0|2,0,0]=4 4773 B12R1.41 COc1cc(cc(c1)SCF)Cl 62a_100015361967_100010147680 [1,1,0,0,0,0|2,0,0]=4 4774 B12R1.41 COc1cc(cc(c1)SCF)F 62a_100011934182_100015361967 [1,1,0,0,0,0|2,0,0]=4 4775 B12R1.41 COc1cc(cc(c1)SCF)F 62a_100015361967_100011934182 [1,1,0,0,0,0|2,0,0]=4 4776 B12R1.41 COc1cc(cc(c1)SCF)N 62a_100000750983_100015361967 [1,1,0,0,0,0|2,0,0]=4 4777 B12R1.41 COc1cc(cc(c1)SCF)N 62a_100015361967_100000750983 [1,1,0,0,0,0|2,0,0]=4 4778 B12R1.41 COc1cc(cc(c1)SCF)O 62a_100015361967_100010068927 [1,1,0,0,0,0|2,0,0]=4 4779 B12R1.41 COc1cc(cc(n1)C)CSC 62a_200000210301_200012183585 [1,1,0,0,0,0|2,0,0]=4 4780 B12R1.41 COc1cc(cc(n1)C)CSC 62a_200012183585_200000210301 [1,1,0,0,0,0|2,0,0]=4 4781 B12R1.41 COc1cc(cc(n1)C)CS[13CH3] 62a_200012183585_200025704644 [1,1,0,0,0,0|2,0,0]=4 4782 B12R1.41 COc1cc(cc(n1)C)CS[13CH3] 62a_200025704644_200012183585 [1,1,0,0,0,0|2,0,0]=4 4783 B12R1.41 COc1cc(cc(n1)Cl)CN[13CH3] 2230a_100009841630_200025704644 [1,1,0,0,0,0|2,0,0]=4 4784 B12R1.41 CSc1cc(cc(c1)CCO)F 62a_100012630564_200000210301 [1,1,0,0,0,0|1,1,0]=4 4785 B12R1.41 CSc1cc(cc(c1)CCO)F 62a_200000210301_100012630564 [1,1,0,0,0,0|1,1,0]=4 4786 B12R1.41 [13CH3]Sc1cc(cc(c1)CCO)F 62a_100012630564_200025704644 [1,1,0,0,0,0|1,1,0]=4 4787 B12R1.41 [13CH3]Sc1cc(cc(c1)CCO)F 62a_200025704644_100012630564 [1,1,0,0,0,0|1,1,0]=4 4788 B12R1.270 CC=Cc1cc(ccc1Br)OC 271570a_100016259895_100009992028 [1,1,0,0,0,0|0,0,2]=4 4789 B12R1.270 CC=Cc1cc(ccc1C)OC 271570a_100016259895_100012349166 [1,1,0,0,0,0|0,0,2]=4 4790 B12R1.270 CC=Cc1cc(ccc1Cl)OC 271570a_100016259895_100011356938 [1,1,0,0,0,0|0,0,2]=4 4791 B12R1.270 CC=Cc1cc(ccc1F)OC 271570a_100016259895_100000699733 [1,1,0,0,0,0|0,0,2]=4 4792 B12R1.270 CC=Cc1cc(ccc1N)OC 271570a_100016259895_100015195136 [1,1,0,0,0,0|0,0,2]=4 4793 B12R1.270 CC=Cc1cc(ccc1O)OC 271570a_100016259895_100000685887 [1,1,0,0,0,0|0,0,2]=4 4794 B12R1.270 CCNc1cc(ccc1Br)OC 34a_100000748603_100000210202 [1,1,0,0,0,0|1,0,0]=3 4795 B12R1.270 CCNc1cc(ccc1C)CC 2230a_200012022522_100000210202 [1,1,0,0,0,0|2,0,0]=4 4796 B12R1.270 CCNc1cc(ccc1C)CC 34a_200012022522_100000210202 [1,1,0,0,0,0|2,0,0]=4 4797 B12R1.270 CCNc1cc(ccc1C)CC 7a_200012022522_100000210202 [1,1,0,0,0,0|2,0,0]=4 4798 B12R1.270 CCNc1cc(ccc1C)OC 2230a_100000760359_100000210202 [1,1,0,0,0,0|1,0,0]=3 4799 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000211784_200000210301 [1,1,0,0,0,0|1,0,0]=3 4800 B12R1.270 CCNc1cc(ccc1C)OC 34a_100000760359_100000210202 [1,1,0,0,0,0|1,0,0]=3 4801 B12R1.270 CCNc1cc(ccc1C)OC 7a_100000211784_200000210301 [1,1,0,0,0,0|1,0,0]=3 4802 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 34a_100000211784_200025704644 [1,1,0,0,0,0|1,0,0]=3 4803 B12R1.270 CCNc1cc(ccc1C)O[13CH3] 7a_100000211784_200025704644 [1,1,0,0,0,0|1,0,0]=3 4804 B12R1.270 CCNc1cc(ccc1Cl)OC 34a_100000745576_100000210202 [1,1,0,0,0,0|1,0,0]=3 4805 B12R1.270 CCNc1cc(ccc1F)OC 34a_100000764331_100000210202 [1,1,0,0,0,0|1,0,0]=3 4806 B12R1.270 CCNc1cc(ccc1I)OC 34a_100000748021_100000210202 [1,1,0,0,0,0|1,0,0]=3 4807 B12R1.270 CCNc1cc(ccc1N)SC 62a_100000696630_200000210301 [1,1,0,0,0,0|1,1,0]=4 4808 B12R1.270 CCNc1cc(ccc1N)SC 62a_200000210301_100000696630 [1,1,0,0,0,0|1,1,0]=4 4809 B12R1.270 CCNc1cc(ccc1N)S[13CH3] 62a_100000696630_200025704644 [1,1,0,0,0,0|1,1,0]=4 4810 B12R1.270 CCNc1cc(ccc1N)S[13CH3] 62a_200025704644_100000696630 [1,1,0,0,0,0|1,1,0]=4 4811 B12R1.270 CCNc1cc(ccc1O)CC 34a_100000765835_100000210202 [1,1,0,0,0,0|2,0,0]=4 4812 B12R1.270 CCNc1cc(ccc1O)OC 34a_100000188146_100000210202 [1,1,0,0,0,0|1,0,0]=3 4813 B12R1.270 CCOc1cc(ccc1Br)NC 2230a_200016990551_200000210301 [1,1,0,0,0,0|2,0,0]=4 4814 B12R1.270 CCOc1cc(ccc1Br)NC 34a_200016990551_200000210301 [1,1,0,0,0,0|2,0,0]=4 4815 B12R1.270 CCOc1cc(ccc1Br)NC 7a_200016990551_200000210301 [1,1,0,0,0,0|2,0,0]=4 4816 B12R1.270 CCOc1cc(ccc1Br)N[13CH3] 2230a_200016990551_200025704644 [1,1,0,0,0,0|2,0,0]=4 4817 B12R1.270 CCOc1cc(ccc1Br)N[13CH3] 34a_200016990551_200025704644 [1,1,0,0,0,0|2,0,0]=4 4818 B12R1.270 CCOc1cc(ccc1Br)N[13CH3] 7a_200016990551_200025704644 [1,1,0,0,0,0|2,0,0]=4 4819 B12R1.270 CCOc1cc(ccc1Br)OC 34a_100000719091_100000210202 [1,1,0,0,0,0|1,0,0]=3 4820 B12R1.270 CCOc1cc(ccc1Br)OC 7a_100000719091_100000210202 [1,1,0,0,0,0|1,0,0]=3 4821 B12R1.270 CCOc1cc(ccc1C)OC 34a_100012179981_100000210202 [1,1,0,0,0,0|1,0,0]=3 4822 B12R1.270 CCOc1cc(ccc1C)OC 7a_100012179981_100000210202 [1,1,0,0,0,0|1,0,0]=3 4823 B12R1.270 CCOc1cc(ccc1C)SC 62a_100012361169_200000210301 [1,1,0,0,0,0|1,1,0]=4 4824 B12R1.270 CCOc1cc(ccc1C)SC 62a_200000210301_100012361169 [1,1,0,0,0,0|1,1,0]=4 4825 B12R1.270 CCOc1cc(ccc1C)S[13CH3] 62a_100012361169_200025704644 [1,1,0,0,0,0|1,1,0]=4 4826 B12R1.270 CCOc1cc(ccc1C)S[13CH3] 62a_200025704644_100012361169 [1,1,0,0,0,0|1,1,0]=4 4827 B12R1.270 CCOc1cc(ccc1Cl)NC 2230a_100011964961_200000210301 [1,1,0,0,0,0|2,0,0]=4 4828 B12R1.270 CCOc1cc(ccc1Cl)NC 34a_100011964961_200000210301 [1,1,0,0,0,0|2,0,0]=4 4829 B12R1.270 CCOc1cc(ccc1Cl)N[13CH3] 2230a_100011964961_200025704644 [1,1,0,0,0,0|2,0,0]=4 4830 B12R1.270 CCOc1cc(ccc1Cl)N[13CH3] 34a_100011964961_200025704644 [1,1,0,0,0,0|2,0,0]=4 4831 B12R1.270 CCOc1cc(ccc1Cl)OC 34a_100011516019_100000210202 [1,1,0,0,0,0|1,0,0]=3 4832 B12R1.270 CCOc1cc(ccc1Cl)OC 7a_100011516019_100000210202 [1,1,0,0,0,0|1,0,0]=3 4833 B12R1.270 CCOc1cc(ccc1F)OC 34a_100012178750_100000210202 [1,1,0,0,0,0|1,0,0]=3 4834 B12R1.270 CCOc1cc(ccc1F)OC 7a_100012178750_100000210202 [1,1,0,0,0,0|1,0,0]=3 4835 B12R1.270 CCOc1cc(ccc1F)SC 62a_200000210301_200012344967 [1,1,0,0,0,0|1,1,0]=4 4836 B12R1.270 CCOc1cc(ccc1F)SC 62a_200012344967_200000210301 [1,1,0,0,0,0|1,1,0]=4 4837 B12R1.270 CCOc1cc(ccc1F)S[13CH3] 62a_200012344967_200025704644 [1,1,0,0,0,0|1,1,0]=4 4838 B12R1.270 CCOc1cc(ccc1F)S[13CH3] 62a_200025704644_200012344967 [1,1,0,0,0,0|1,1,0]=4 4839 B12R1.270 CCOc1cc(ccc1I)OC 34a_100010168831_100000210202 [1,1,0,0,0,0|1,0,0]=3 4840 B12R1.270 CCOc1cc(ccc1I)OC 7a_100010168831_100000210202 [1,1,0,0,0,0|1,0,0]=3 4841 B12R1.270 CCOc1cc(ccc1N)CC 34a_100000124328_100000210202 [1,1,0,0,0,0|2,0,0]=4 4842 B12R1.270 CCOc1cc(ccc1N)CC 7a_100000124328_100000210202 [1,1,0,0,0,0|2,0,0]=4 4843 B12R1.270 CCOc1cc(ccc1N)OC 34a_100016989039_100000210202 [1,1,0,0,0,0|1,0,0]=3 4844 B12R1.270 CCOc1cc(ccc1N)OC 7a_100016989039_100000210202 [1,1,0,0,0,0|1,0,0]=3 4845 B12R1.270 CCOc1cc(ccc1N)SC 62a_100000688918_200000210301 [1,1,0,0,0,0|1,1,0]=4 4846 B12R1.270 CCOc1cc(ccc1N)S[13CH3] 62a_100000688918_200025704644 [1,1,0,0,0,0|1,1,0]=4 4847 B12R1.270 CCOc1cc(ncc1Br)OC 34a_100010738159_100000210202 [1,1,0,0,0,0|2,0,0]=4 4848 B12R1.270 CCSc1cc(ccc1Br)OC 62a_100000210202_100009992028 [1,1,0,0,0,0|1,0,0]=3 4849 B12R1.270 CCSc1cc(ccc1Br)OC 62a_100009992028_100000210202 [1,1,0,0,0,0|1,0,0]=3 4850 B12R1.270 CCSc1cc(ccc1C)NC 62a_100000210202_100000707694 [1,1,0,0,0,0|2,0,0]=4 4851 B12R1.270 CCSc1cc(ccc1C)NC 62a_100000707694_100000210202 [1,1,0,0,0,0|2,0,0]=4 4852 B12R1.270 CCSc1cc(ccc1C)OC 62a_100000210202_100012349166 [1,1,0,0,0,0|1,0,0]=3 4853 B12R1.270 CCSc1cc(ccc1C)OC 62a_100012349166_100000210202 [1,1,0,0,0,0|1,0,0]=3 4854 B12R1.270 CCSc1cc(ccc1Cl)OC 62a_100000210202_100011356938 [1,1,0,0,0,0|1,0,0]=3 4855 B12R1.270 CCSc1cc(ccc1Cl)OC 62a_100011356938_100000210202 [1,1,0,0,0,0|1,0,0]=3 4856 B12R1.270 CCSc1cc(ccc1F)CC 62a_100000210202_200010244628 [1,1,0,0,0,0|2,0,0]=4 4857 B12R1.270 CCSc1cc(ccc1F)CC 62a_200010244628_100000210202 [1,1,0,0,0,0|2,0,0]=4 4858 B12R1.270 CCSc1cc(ccc1F)OC 62a_100000210202_100000699733 [1,1,0,0,0,0|1,0,0]=3 4859 B12R1.270 CCSc1cc(ccc1F)OC 62a_100000699733_100000210202 [1,1,0,0,0,0|1,0,0]=3 4860 B12R1.270 CCSc1cc(ccc1F)SC 62a_100000210202_200010708804 [1,1,0,0,0,0|1,1,0]=4 4861 B12R1.270 CCSc1cc(ccc1F)SC 62a_200010708804_100000210202 [1,1,0,0,0,0|1,1,0]=4 4862 B12R1.270 CCSc1cc(ccc1N)CC 62a_100000210202_100012339725 [1,1,0,0,0,0|2,0,0]=4 4863 B12R1.270 CCSc1cc(ccc1N)CC 62a_100012339725_100000210202 [1,1,0,0,0,0|2,0,0]=4 4864 B12R1.270 CCSc1cc(ccc1N)OC 62a_100000210202_100015195136 [1,1,0,0,0,0|1,0,0]=3 4865 B12R1.270 CCSc1cc(ccc1N)OC 62a_100015195136_100000210202 [1,1,0,0,0,0|1,0,0]=3 4866 B12R1.270 CCSc1cc(ccc1O)CC 62a_100000210202_100012339963 [1,1,0,0,0,0|2,0,0]=4 4867 B12R1.270 CCSc1cc(ccc1O)CC 62a_100012339963_100000210202 [1,1,0,0,0,0|2,0,0]=4 4868 B12R1.270 CCSc1cc(ccc1O)OC 62a_100000210202_100000685887 [1,1,0,0,0,0|1,0,0]=3 4869 B12R1.270 CCSc1cc(cnc1F)OC 62a_100000210202_100010068374 [1,1,0,0,0,0|2,0,0]=4 4870 B12R1.270 CCSc1cc(cnc1F)OC 62a_100010068374_100000210202 [1,1,0,0,0,0|2,0,0]=4 4871 B12R1.270 CCSc1cc(ncc1C)OC 62a_100000210202_100010068546 [1,1,0,0,0,0|2,0,0]=4 4872 B12R1.270 CCSc1cc(ncc1C)OC 62a_100010068546_100000210202 [1,1,0,0,0,0|2,0,0]=4 4873 B12R1.270 CCSc1cc(ncc1Cl)OC 62a_100000210202_100010068019 [1,1,0,0,0,0|2,0,0]=4 4874 B12R1.270 CCSc1cc(ncc1Cl)OC 62a_100010068019_100000210202 [1,1,0,0,0,0|2,0,0]=4 4875 B12R1.270 CCSc1cc(ncc1F)OC 62a_100000210202_100010160775 [1,1,0,0,0,0|2,0,0]=4 4876 B12R1.270 CCSc1cc(ncc1F)OC 62a_100010160775_100000210202 [1,1,0,0,0,0|2,0,0]=4 4877 B12R1.270 CCSc1nc(ccc1N)OC 62a_100000069805_100000210202 [1,1,0,0,0,0|2,0,0]=4 4878 B12R1.270 CCSc1nc(ccc1N)OC 62a_100000210202_100000069805 [1,1,0,0,0,0|2,0,0]=4 4879 B12R1.270 CNCc1cc(ccc1Br)OC 207a_100102657272_100000691568 [1,1,0,0,0,0|1,0,0]=3 4880 B12R1.270 CNCc1cc(ccc1Br)OC 2230a_100000741592_200000210301 [1,1,0,0,0,0|1,0,0]=3 4881 B12R1.270 CNCc1cc(ccc1Br)OC 2230a_106832991635_100000761528 [1,1,0,0,0,0|1,0,0]=3 4882 B12R1.270 CNCc1cc(ccc1Br)OC 26a_100102657272_100000719091 [1,1,0,0,0,0|1,0,0]=3 4883 B12R1.270 CNCc1cc(ccc1Br)OC 270004a_106832991635_100000691568 [1,1,0,0,0,0|1,0,0]=3 4884 B12R1.270 CNCc1cc(ccc1Br)OC 34a_100000741592_200000210301 [1,1,0,0,0,0|1,0,0]=3 4885 B12R1.270 CNCc1cc(ccc1Br)OC 34a_100102657272_100000761528 [1,1,0,0,0,0|1,0,0]=3 4886 B12R1.270 CNCc1cc(ccc1Br)OC 7a_106832991635_100000761528 [1,1,0,0,0,0|1,0,0]=3 4887 B12R1.270 CNCc1cc(ccc1C)OC 207a_100102657272_100012017359 [1,1,0,0,0,0|1,0,0]=3 4888 B12R1.270 CNCc1cc(ccc1C)OC 270004a_106832991635_100012017359 [1,1,0,0,0,0|1,0,0]=3 4889 B12R1.270 CNCc1cc(ccc1C)OC 34a_100012180165_200000210301 [1,1,0,0,0,0|1,0,0]=3 4890 B12R1.270 CNCc1cc(ccc1C)SC 62a_106744473289_200000210301 [1,1,0,0,0,0|1,1,0]=4 4891 B12R1.270 CNCc1cc(ccc1C)SC 62a_200000210301_106744473289 [1,1,0,0,0,0|1,1,0]=4 4892 B12R1.270 CNCc1cc(ccc1C)S[13CH3] 62a_106744473289_200025704644 [1,1,0,0,0,0|1,1,0]=4 4893 B12R1.270 CNCc1cc(ccc1C)S[13CH3] 62a_200025704644_106744473289 [1,1,0,0,0,0|1,1,0]=4 4894 B12R1.270 CNCc1cc(ccc1Cl)OC 207a_100102657272_100000117592 [1,1,0,0,0,0|1,0,0]=3 4895 B12R1.270 CNCc1cc(ccc1Cl)OC 2230a_106832991635_100000718613 [1,1,0,0,0,0|1,0,0]=3 4896 B12R1.270 CNCc1cc(ccc1Cl)OC 26a_100102657272_100011516019 [1,1,0,0,0,0|1,0,0]=3 4897 B12R1.270 CNCc1cc(ccc1Cl)OC 270004a_106832991635_100000117592 [1,1,0,0,0,0|1,0,0]=3 4898 B12R1.270 CNCc1cc(ccc1Cl)OC 34a_100102657272_100000718613 [1,1,0,0,0,0|1,0,0]=3 4899 B12R1.270 CNCc1cc(ccc1Cl)OC 7a_106832991635_100000718613 [1,1,0,0,0,0|1,0,0]=3 4900 B12R1.270 CNCc1cc(ccc1F)OC 207a_100102657272_100000034340 [1,1,0,0,0,0|1,0,0]=3 4901 B12R1.270 CNCc1cc(ccc1F)OC 2230a_106832991635_100010243555 [1,1,0,0,0,0|1,0,0]=3 4902 B12R1.270 CNCc1cc(ccc1F)OC 270004a_106832991635_100000034340 [1,1,0,0,0,0|1,0,0]=3 4903 B12R1.270 CNCc1cc(ccc1F)OC 34a_100016995475_200000210301 [1,1,0,0,0,0|1,0,0]=3 4904 B12R1.270 CNCc1cc(ccc1F)OC 34a_100102657272_100010243555 [1,1,0,0,0,0|1,0,0]=3 4905 B12R1.270 CNCc1cc(ccc1F)OC 7a_106832991635_100010243555 [1,1,0,0,0,0|1,0,0]=3 4906 B12R1.270 CNCc1cc(ccc1F)SC 207a_100102657272_200010946432 [1,1,0,0,0,0|1,1,0]=4 4907 B12R1.270 CNCc1cc(ccc1F)SC 270004a_106832991635_200010946432 [1,1,0,0,0,0|1,1,0]=4 4908 B12R1.270 CNCc1cc(ccc1F)SC 62a_100000748472_200000210301 [1,1,0,0,0,0|1,1,0]=4 4909 B12R1.270 CNCc1cc(ccc1F)SC 62a_200000210301_100000748472 [1,1,0,0,0,0|1,1,0]=4 4910 B12R1.270 CNCc1cc(ccc1F)S[13CH3] 62a_100000748472_200025704644 [1,1,0,0,0,0|1,1,0]=4 4911 B12R1.270 CNCc1cc(ccc1F)S[13CH3] 62a_200025704644_100000748472 [1,1,0,0,0,0|1,1,0]=4 4912 B12R1.270 CNCc1cc(ccc1I)OC 207a_100102657272_100010075557 [1,1,0,0,0,0|1,0,0]=3 4913 B12R1.270 CNCc1cc(ccc1I)OC 270004a_106832991635_100010075557 [1,1,0,0,0,0|1,0,0]=3 4914 B12R1.270 CNCc1cc(ccc1O)SC 62a_100011602694_200000210301 [1,1,0,0,0,0|1,1,0]=4 4915 B12R1.270 CNCc1cc(ccc1O)SC 62a_200000210301_100011602694 [1,1,0,0,0,0|1,1,0]=4 4916 B12R1.270 CNCc1cc(ccc1O)S[13CH3] 62a_100011602694_200025704644 [1,1,0,0,0,0|1,1,0]=4 4917 B12R1.270 CNCc1cc(ccc1O)S[13CH3] 62a_200025704644_100011602694 [1,1,0,0,0,0|1,1,0]=4 4918 B12R1.270 CNCc1cc(ncc1Br)OC 207a_100102657272_100010171658 [1,1,0,0,0,0|2,0,0]=4 4919 B12R1.270 CNCc1cc(ncc1Br)OC 270004a_106832991635_100010171658 [1,1,0,0,0,0|2,0,0]=4 4920 B12R1.270 CNCc1cc(ncc1Cl)OC 207a_100102657272_100009859511 [1,1,0,0,0,0|2,0,0]=4 4921 B12R1.270 CNCc1cc(ncc1Cl)OC 270004a_106832991635_100009859511 [1,1,0,0,0,0|2,0,0]=4 4922 B12R1.270 CNCc1cc(ncc1F)OC 207a_100102657272_100011998751 [1,1,0,0,0,0|2,0,0]=4 4923 B12R1.270 CNCc1cc(ncc1F)OC 270004a_106832991635_100011998751 [1,1,0,0,0,0|2,0,0]=4 4924 B12R1.270 CNCc1nc(ccc1Br)OC 207a_100102657272_200010173843 [1,1,0,0,0,0|2,0,0]=4 4925 B12R1.270 CNCc1nc(ccc1Br)OC 270004a_106832991635_200010173843 [1,1,0,0,0,0|2,0,0]=4 4926 B12R1.270 CNCc1nc(ccc1Cl)OC 207a_100102657272_100000070420 [1,1,0,0,0,0|2,0,0]=4 4927 B12R1.270 CNCc1nc(ccc1Cl)OC 2230a_100011639525_200000210301 [1,1,0,0,0,0|2,0,0]=4 4928 B12R1.270 CNCc1nc(ccc1Cl)OC 270004a_106832991635_100000070420 [1,1,0,0,0,0|2,0,0]=4 4929 B12R1.270 COCc1cc(ccc1Br)OC 34a_100138415774_100000761528 [1,1,0,0,0,0|1,0,0]=3 4930 B12R1.270 COCc1cc(ccc1Br)OC 34a_200011273942_200000210301 [1,1,0,0,0,0|1,0,0]=3 4931 B12R1.270 COCc1cc(ccc1Br)OC 7a_200011273942_200000210301 [1,1,0,0,0,0|1,0,0]=3 4932 B12R1.270 COCc1cc(ccc1Br)SC 62a_200000210301_202125822959 [1,1,0,0,0,0|1,1,0]=4 4933 B12R1.270 COCc1cc(ccc1Br)SC 62a_202125822959_200000210301 [1,1,0,0,0,0|1,1,0]=4 4934 B12R1.270 COCc1cc(ccc1Br)S[13CH3] 62a_200025704644_202125822959 [1,1,0,0,0,0|1,1,0]=4 4935 B12R1.270 COCc1cc(ccc1Br)S[13CH3] 62a_202125822959_200025704644 [1,1,0,0,0,0|1,1,0]=4 4936 B12R1.270 COCc1cc(ccc1C)OC 34a_100009841904_200000210301 [1,1,0,0,0,0|1,0,0]=3 4937 B12R1.270 COCc1cc(ccc1C)OC 7a_100009841904_200000210301 [1,1,0,0,0,0|1,0,0]=3 4938 B12R1.270 COCc1cc(ccc1Cl)OC 34a_100138415774_100000718613 [1,1,0,0,0,0|1,0,0]=3 4939 B12R1.270 COCc1cc(ccc1F)OC 34a_100000067870_200000210301 [1,1,0,0,0,0|1,0,0]=3 4940 B12R1.270 COCc1cc(ccc1F)OC 34a_100138415774_100010243555 [1,1,0,0,0,0|1,0,0]=3 4941 B12R1.270 COCc1cc(ccc1F)OC 7a_100000067870_200000210301 [1,1,0,0,0,0|1,0,0]=3 4942 B12R1.270 COCc1cc(ccc1F)SC 62a_100010140362_200000210301 [1,1,0,0,0,0|1,1,0]=4 4943 B12R1.270 COCc1cc(ccc1F)SC 62a_200000210301_100010140362 [1,1,0,0,0,0|1,1,0]=4 4944 B12R1.270 COCc1cc(ccc1F)S[13CH3] 62a_100010140362_200025704644 [1,1,0,0,0,0|1,1,0]=4 4945 B12R1.270 COCc1cc(ccc1F)S[13CH3] 62a_200025704644_100010140362 [1,1,0,0,0,0|1,1,0]=4 4946 B12R1.270 COCc1cc(ccc1N)OC 34a_100012001277_200000210301 [1,1,0,0,0,0|1,0,0]=3 4947 B12R1.270 COCc1nc(ccc1Cl)OC 34a_100011438736_200000210301 [1,1,0,0,0,0|2,0,0]=4 4948 B12R1.270 COc1ccc(c(c1)CC#N)O 271570a_203496583355_100012259381 [1,1,0,0,0,0|1,0,1]=4 4949 B12R1.270 COc1ccc(c(c1)CCO)O 271570a_203496583355_100012259501 [1,1,0,0,0,0|1,0,0]=3 4950 B12R1.270 COc1ccc(c(c1)CN[13CH3])Br 2230a_100000741592_200025704644 [1,1,0,0,0,0|1,0,0]=3 4951 B12R1.270 COc1ccc(c(c1)CN[13CH3])Br 34a_100000741592_200025704644 [1,1,0,0,0,0|1,0,0]=3 4952 B12R1.270 COc1ccc(c(c1)CN[13CH3])C 34a_100012180165_200025704644 [1,1,0,0,0,0|1,0,0]=3 4953 B12R1.270 COc1ccc(c(c1)CN[13CH3])F 34a_100016995475_200025704644 [1,1,0,0,0,0|1,0,0]=3 4954 B12R1.270 COc1ccc(c(c1)CO[13CH3])Br 34a_200011273942_200025704644 [1,1,0,0,0,0|1,0,0]=3 4955 B12R1.270 COc1ccc(c(c1)CO[13CH3])Br 7a_200011273942_200025704644 [1,1,0,0,0,0|1,0,0]=3 4956 B12R1.270 COc1ccc(c(c1)CO[13CH3])C 34a_100009841904_200025704644 [1,1,0,0,0,0|1,0,0]=3 4957 B12R1.270 COc1ccc(c(c1)CO[13CH3])C 7a_100009841904_200025704644 [1,1,0,0,0,0|1,0,0]=3 4958 B12R1.270 COc1ccc(c(c1)CO[13CH3])F 34a_100000067870_200025704644 [1,1,0,0,0,0|1,0,0]=3 4959 B12R1.270 COc1ccc(c(c1)CO[13CH3])F 7a_100000067870_200025704644 [1,1,0,0,0,0|1,0,0]=3 4960 B12R1.270 COc1ccc(c(c1)CO[13CH3])N 34a_100012001277_200025704644 [1,1,0,0,0,0|1,0,0]=3 4961 B12R1.270 COc1ccc(c(c1)CSC)Br 62a_100000761528_200000210301 [1,1,0,0,0,0|1,0,0]=3 4962 B12R1.270 COc1ccc(c(c1)CSC)Br 62a_200000210301_100000761528 [1,1,0,0,0,0|1,0,0]=3 4963 B12R1.270 COc1ccc(c(c1)CSC)Cl 62a_100000718613_200000210301 [1,1,0,0,0,0|1,0,0]=3 4964 B12R1.270 COc1ccc(c(c1)CSC)Cl 62a_200000210301_100000718613 [1,1,0,0,0,0|1,0,0]=3 4965 B12R1.270 COc1ccc(c(c1)CSC)F 62a_100010243555_200000210301 [1,1,0,0,0,0|1,0,0]=3 4966 B12R1.270 COc1ccc(c(c1)CSC)F 62a_200000210301_100010243555 [1,1,0,0,0,0|1,0,0]=3 4967 B12R1.270 COc1ccc(c(c1)CS[13CH3])Br 62a_100000761528_200025704644 [1,1,0,0,0,0|1,0,0]=3 4968 B12R1.270 COc1ccc(c(c1)CS[13CH3])Br 62a_200025704644_100000761528 [1,1,0,0,0,0|1,0,0]=3 4969 B12R1.270 COc1ccc(c(c1)CS[13CH3])Cl 62a_100000718613_200025704644 [1,1,0,0,0,0|1,0,0]=3 4970 B12R1.270 COc1ccc(c(c1)CS[13CH3])Cl 62a_200025704644_100000718613 [1,1,0,0,0,0|1,0,0]=3 4971 B12R1.270 COc1ccc(c(c1)CS[13CH3])F 62a_100010243555_200025704644 [1,1,0,0,0,0|1,0,0]=3 4972 B12R1.270 COc1ccc(c(c1)CS[13CH3])F 62a_200025704644_100010243555 [1,1,0,0,0,0|1,0,0]=3 4973 B12R1.270 COc1ccc(c(c1)NCF)Br 34a_100000748603_100015361967 [1,1,0,0,0,0|2,0,0]=4 4974 B12R1.270 COc1ccc(c(c1)NCF)C 34a_100000760359_100015361967 [1,1,0,0,0,0|2,0,0]=4 4975 B12R1.270 COc1ccc(c(c1)NCF)Cl 34a_100000745576_100015361967 [1,1,0,0,0,0|2,0,0]=4 4976 B12R1.270 COc1ccc(c(c1)NCF)F 34a_100000764331_100015361967 [1,1,0,0,0,0|2,0,0]=4 4977 B12R1.270 COc1ccc(c(c1)NCF)I 34a_100000748021_100015361967 [1,1,0,0,0,0|2,0,0]=4 4978 B12R1.270 COc1ccc(c(c1)NCF)O 34a_100000188146_100015361967 [1,1,0,0,0,0|2,0,0]=4 4979 B12R1.270 COc1ccc(c(c1)OCF)Br 34a_100000719091_100015361967 [1,1,0,0,0,0|2,0,0]=4 4980 B12R1.270 COc1ccc(c(c1)OCF)Br 7a_100000719091_100015361967 [1,1,0,0,0,0|2,0,0]=4 4981 B12R1.270 COc1ccc(c(c1)OCF)C 34a_100012179981_100015361967 [1,1,0,0,0,0|2,0,0]=4 4982 B12R1.270 COc1ccc(c(c1)OCF)C 7a_100012179981_100015361967 [1,1,0,0,0,0|2,0,0]=4 4983 B12R1.270 COc1ccc(c(c1)OCF)Cl 34a_100011516019_100015361967 [1,1,0,0,0,0|2,0,0]=4 4984 B12R1.270 COc1ccc(c(c1)OCF)Cl 7a_100011516019_100015361967 [1,1,0,0,0,0|2,0,0]=4 4985 B12R1.270 COc1ccc(c(c1)OCF)F 34a_100012178750_100015361967 [1,1,0,0,0,0|2,0,0]=4 4986 B12R1.270 COc1ccc(c(c1)OCF)F 7a_100012178750_100015361967 [1,1,0,0,0,0|2,0,0]=4 4987 B12R1.270 COc1ccc(c(c1)OCF)I 34a_100010168831_100015361967 [1,1,0,0,0,0|2,0,0]=4 4988 B12R1.270 COc1ccc(c(c1)OCF)I 7a_100010168831_100015361967 [1,1,0,0,0,0|2,0,0]=4 4989 B12R1.270 COc1ccc(c(c1)OCF)N 34a_100016989039_100015361967 [1,1,0,0,0,0|2,0,0]=4 4990 B12R1.270 COc1ccc(c(c1)OCF)N 7a_100016989039_100015361967 [1,1,0,0,0,0|2,0,0]=4 4991 B12R1.270 COc1ccc(c(c1)SCF)Br 62a_100009992028_100015361967 [1,1,0,0,0,0|2,0,0]=4 4992 B12R1.270 COc1ccc(c(c1)SCF)Br 62a_100015361967_100009992028 [1,1,0,0,0,0|2,0,0]=4 4993 B12R1.270 COc1ccc(c(c1)SCF)C 62a_100012349166_100015361967 [1,1,0,0,0,0|2,0,0]=4 4994 B12R1.270 COc1ccc(c(c1)SCF)C 62a_100015361967_100012349166 [1,1,0,0,0,0|2,0,0]=4 4995 B12R1.270 COc1ccc(c(c1)SCF)Cl 62a_100011356938_100015361967 [1,1,0,0,0,0|2,0,0]=4 4996 B12R1.270 COc1ccc(c(c1)SCF)Cl 62a_100015361967_100011356938 [1,1,0,0,0,0|2,0,0]=4 4997 B12R1.270 COc1ccc(c(c1)SCF)F 62a_100000699733_100015361967 [1,1,0,0,0,0|2,0,0]=4 4998 B12R1.270 COc1ccc(c(c1)SCF)F 62a_100015361967_100000699733 [1,1,0,0,0,0|2,0,0]=4 4999 B12R1.270 COc1ccc(c(c1)SCF)N 62a_100015195136_100015361967 [1,1,0,0,0,0|2,0,0]=4 5000 B12R1.270 COc1ccc(c(c1)SCF)N 62a_100015361967_100015195136 [1,1,0,0,0,0|2,0,0]=4 5001 B12R1.270 COc1ccc(c(c1)SCF)O 62a_100015361967_100000685887 [1,1,0,0,0,0|2,0,0]=4 5002 B12R1.270 COc1ccc(c(n1)CN[13CH3])Cl 2230a_100011639525_200025704644 [1,1,0,0,0,0|2,0,0]=4 5003 B12R1.270 COc1ccc(c(n1)CO[13CH3])Cl 34a_100011438736_200025704644 [1,1,0,0,0,0|2,0,0]=4 5004 B12R1.278 C=C=Cc1cccc(c1)CCC 271570a_100015277604_100000694964 [1,1,0,0,0,0|1,0,1]=4 5005 B12R1.278 CC#Cc1cccc(c1)SCC 62a_100000210202_200009843338 [1,1,0,0,0,0|2,0,0]=4 5006 B12R1.278 CC=Cc1cccc(c1)CCC 271570a_100016259895_100000694964 [1,1,0,0,0,0|1,0,0]=3 5007 B12R1.278 CC=Cc1cccc(c1)CCN 271570a_100016259895_100011207229 [1,1,0,0,0,0|2,0,0]=4 5008 B12R1.278 CC=Cc1cccc(c1)CCO 271570a_100016259895_100011217444 [1,1,0,0,0,0|2,0,0]=4 5009 B12R1.278 CC=Cc1cccc(c1)CNC 271570a_100016259895_100000187585 [1,1,0,0,0,0|2,0,0]=4 5010 B12R1.278 CC=Cc1cccc(c1)COC 271570a_100016259895_100011493687 [1,1,0,0,0,0|0,0,2]=4 5011 B12R1.278 CC=Cc1cccc(c1)NCC 271570a_100016259895_100000738899 [1,1,0,0,0,0|2,0,0]=4 5012 B12R1.278 CC=Cc1cccc(c1)OCC 271570a_100016259895_100000170002 [1,1,0,0,0,0|0,0,2]=4 5013 B12R1.278 CC=Cc1cccc(c1)SCC 271570a_100016259895_100000703699 [1,1,0,0,0,0|2,0,0]=4 5014 B12R1.278 CCCc1cccc(c1)CNC 26a_100102657272_100000039106 [1,1,0,0,0,0|1,0,0]=3 5015 B12R1.278 CCCc1cccc(c1)OCC 34a_100000039106_100000210202 [1,1,0,0,0,0|0,0,0]=2 5016 B12R1.278 CCCc1cccc(c1)OCC 7a_100000039106_100000210202 [1,1,0,0,0,0|0,0,0]=2 5017 B12R1.278 CCCc1cccc(c1)OCF 34a_100000039106_100015361967 [1,1,0,0,0,0|0,0,0]=2 5018 B12R1.278 CCCc1cccc(c1)OCF 7a_100000039106_100015361967 [1,1,0,0,0,0|0,0,0]=2 5019 B12R1.278 CCCc1cccc(c1)SCC 62a_100000210202_100000694964 [1,1,0,0,0,0|0,1,0]=3 5020 B12R1.278 CCCc1cccc(c1)SCC 62a_100000694964_100000210202 [1,1,0,0,0,0|0,1,0]=3 5021 B12R1.278 CCCc1cccc(c1)SCF 62a_100000694964_100015361967 [1,1,0,0,0,0|0,1,0]=3 5022 B12R1.278 CCCc1cccc(c1)SCF 62a_100015361967_100000694964 [1,1,0,0,0,0|0,1,0]=3 5023 B12R1.278 CCNc1cc(ccn1)OCC 27a_100015525214_100009995529 [1,1,0,0,0,0|2,0,0]=4 5024 B12R1.278 CCNc1cccc(c1)CCO 2230a_100011996697_100000210202 [1,1,0,0,0,0|2,0,0]=4 5025 B12R1.278 CCNc1cccc(c1)CCO 34a_100011996697_100000210202 [1,1,0,0,0,0|2,0,0]=4 5026 B12R1.278 CCNc1cccc(c1)COC 2230a_100000737370_100000210202 [1,1,0,0,0,0|1,0,0]=3 5027 B12R1.278 CCNc1cccc(c1)COC 34a_100000737370_100000210202 [1,1,0,0,0,0|1,0,0]=3 5028 B12R1.278 CCNc1cccc(c1)OCC 2230a_100000742568_100000210202 [1,1,0,0,0,0|1,0,0]=3 5029 B12R1.278 CCNc1cccc(c1)OCC 34a_100000717746_100000210202 [1,1,0,0,0,0|1,0,0]=3 5030 B12R1.278 CCNc1cccc(c1)OCC 34a_100000742568_100000210202 [1,1,0,0,0,0|1,0,0]=3 5031 B12R1.278 CCNc1cccc(c1)OCC 7a_100000717746_100000210202 [1,1,0,0,0,0|1,0,0]=3 5032 B12R1.278 CCNc1cccc(c1)OCF 34a_100000717746_100015361967 [1,1,0,0,0,0|1,0,0]=3 5033 B12R1.278 CCNc1cccc(c1)OCF 7a_100000717746_100015361967 [1,1,0,0,0,0|1,0,0]=3 5034 B12R1.278 CCNc1cccc(c1)SCC 62a_100000210202_100000738899 [1,1,0,0,0,0|1,1,0]=4 5035 B12R1.278 CCNc1cccc(c1)SCF 62a_100015361967_100000738899 [1,1,0,0,0,0|1,1,0]=4 5036 B12R1.278 CCOc1cc(ccn1)CNC 2230a_100160572661_200000210301 [1,1,0,0,0,0|2,0,0]=4 5037 B12R1.278 CCOc1cc(ccn1)CN[13CH3] 2230a_100160572661_200025704644 [1,1,0,0,0,0|2,0,0]=4 5038 B12R1.278 CCOc1cc(ccn1)SCC 62a_100000210202_100009995528 [1,1,0,0,0,0|2,0,0]=4 5039 B12R1.278 CCOc1cc(ccn1)SCC 62a_100009995528_100000210202 [1,1,0,0,0,0|2,0,0]=4 5040 B12R1.278 CCOc1cccc(c1)CC#N 7a_100000696680_100000210202 [1,1,0,0,0,0|1,0,1]=4 5041 B12R1.278 CCOc1cccc(c1)CCN 34a_100000747277_100000210202 [1,1,0,0,0,0|1,0,0]=3 5042 B12R1.278 CCOc1cccc(c1)CCO 34a_100011215281_100000210202 [1,1,0,0,0,0|1,0,0]=3 5043 B12R1.278 CCOc1cccc(c1)CCO 7a_100011215281_100000210202 [1,1,0,0,0,0|1,0,0]=3 5044 B12R1.278 CCOc1cccc(c1)CNC 207a_100102657272_100000170239 [1,1,0,0,0,0|1,0,0]=3 5045 B12R1.278 CCOc1cccc(c1)CNC 2230a_106359896916_200000210301 [1,1,0,0,0,0|1,0,0]=3 5046 B12R1.278 CCOc1cccc(c1)CNC 270004a_106832991635_100000170239 [1,1,0,0,0,0|1,0,0]=3 5047 B12R1.278 CCOc1cccc(c1)CNC 34a_100000207540_100000210202 [1,1,0,0,0,0|1,0,0]=3 5048 B12R1.278 CCOc1cccc(c1)CNC 34a_106359896916_200000210301 [1,1,0,0,0,0|1,0,0]=3 5049 B12R1.278 CCOc1cccc(c1)CNN 34a_100000008902_100000210202 [1,1,0,0,0,0|2,0,0]=4 5050 B12R1.278 CCOc1cccc(c1)CN[13CH3] 2230a_106359896916_200025704644 [1,1,0,0,0,0|1,0,0]=3 5051 B12R1.278 CCOc1cccc(c1)CN[13CH3] 34a_106359896916_200025704644 [1,1,0,0,0,0|1,0,0]=3 5052 B12R1.278 CCOc1cccc(c1)COC 34a_200011232711_200000210301 [1,1,0,0,0,0|1,0,0]=3 5053 B12R1.278 CCOc1cccc(c1)COC 7a_200011232711_200000210301 [1,1,0,0,0,0|1,0,0]=3 5054 B12R1.278 CCOc1cccc(c1)CO[13CH3] 34a_200011232711_200025704644 [1,1,0,0,0,0|1,0,0]=3 5055 B12R1.278 CCOc1cccc(c1)CO[13CH3] 7a_200011232711_200025704644 [1,1,0,0,0,0|1,0,0]=3 5056 B12R1.278 CCOc1cccc(c1)NCF 34a_100000742568_100015361967 [1,1,0,0,0,0|2,0,0]=4 5057 B12R1.278 CCOc1cccc(c1)OCC 34a_100011215941_100000210202 [1,1,0,0,0,0|1,0,0]=3 5058 B12R1.278 CCOc1cccc(c1)OCC 7a_100011215941_100000210202 [1,1,0,0,0,0|1,0,0]=3 5059 B12R1.278 CCOc1cccc(c1)OCF 34a_100011215941_100015361967 [1,1,0,0,0,0|1,0,0]=3 5060 B12R1.278 CCOc1cccc(c1)OCF 7a_100011215941_100015361967 [1,1,0,0,0,0|1,0,0]=3 5061 B12R1.278 CCOc1cccc(c1)SCC 62a_100000210202_100000170002 [1,1,0,0,0,0|1,0,0]=3 5062 B12R1.278 CCOc1cccc(c1)SCF 62a_100015361967_100000170002 [1,1,0,0,0,0|1,1,0]=4 5063 B12R1.278 CCOc1cccc(n1)SCC 62a_100000210202_100000752924 [1,1,0,0,0,0|2,0,0]=4 5064 B12R1.278 CCOc1cccc(n1)SCC 62a_100000752924_100000210202 [1,1,0,0,0,0|2,0,0]=4 5065 B12R1.278 CCOc1ccnc(c1)SCC 62a_100000210202_100011922638 [1,1,0,0,0,0|2,0,0]=4 5066 B12R1.278 CCOc1ccnc(c1)SCC 62a_100009995529_100000210202 [1,1,0,0,0,0|2,0,0]=4 5067 B12R1.278 CCOc1cncc(c1)SCC 62a_100000210202_100012029586 [1,1,0,0,0,0|2,0,0]=4 5068 B12R1.278 CCOc1cncc(c1)SCC 62a_100012029586_100000210202 [1,1,0,0,0,0|2,0,0]=4 5069 B12R1.278 CCSc1cccc(c1)CCN 62a_100000210202_100011207229 [1,1,0,0,0,0|1,1,0]=4 5070 B12R1.278 CCSc1cccc(c1)CCN 62a_100011207229_100000210202 [1,1,0,0,0,0|1,1,0]=4 5071 B12R1.278 CCSc1cccc(c1)CCO 62a_100000210202_100011217444 [1,1,0,0,0,0|1,1,0]=4 5072 B12R1.278 CCSc1cccc(c1)CCO 62a_100011217444_100000210202 [1,1,0,0,0,0|1,1,0]=4 5073 B12R1.278 CCSc1cccc(c1)CNC 62a_100000187585_100000210202 [1,1,0,0,0,0|1,1,0]=4 5074 B12R1.278 CCSc1cccc(c1)CNC 62a_100000210202_100000187585 [1,1,0,0,0,0|1,1,0]=4 5075 B12R1.278 CCSc1cccc(c1)COC 62a_100000210202_100011493687 [1,1,0,0,0,0|1,0,0]=3 5076 B12R1.278 CCSc1cccc(c1)COC 62a_100011493687_100000210202 [1,1,0,0,0,0|1,0,0]=3 5077 B12R1.278 CCSc1cccc(c1)SCC 62a_100000210202_100000703699 [1,1,0,0,0,0|1,1,0]=4 5078 B12R1.278 CCSc1cccc(c1)SCC 62a_100000703699_100000210202 [1,1,0,0,0,0|1,1,0]=4 5079 B12R1.278 CCSc1cccc(c1)SCF 62a_100000703699_100015361967 [1,1,0,0,0,0|1,1,0]=4 5080 B12R1.278 CCSc1cccc(c1)SCF 62a_100015361967_100000703699 [1,1,0,0,0,0|1,1,0]=4 5081 B12R1.278 CNCc1cccc(c1)CCO 26a_100102657272_100011215281 [1,1,0,0,0,0|2,0,0]=4 5082 B12R1.278 CNCc1cccc(c1)OCF 34a_100000207540_100015361967 [1,1,0,0,0,0|1,0,0]=3 5083 B12R1.278 CNCc1cccc(c1)SCF 62a_100000187585_100015361967 [1,1,0,0,0,0|1,1,0]=4 5084 B12R1.278 CNCc1cccc(c1)SCF 62a_100015361967_100000187585 [1,1,0,0,0,0|1,1,0]=4 5085 B12R1.278 COCc1cccc(c1)NCF 34a_100000737370_100015361967 [1,1,0,0,0,0|2,0,0]=4 5086 B12R1.278 COCc1cccc(c1)SCF 62a_100011493687_100015361967 [1,1,0,0,0,0|1,1,0]=4 5087 B12R1.278 COCc1cccc(c1)SCF 62a_100015361967_100011493687 [1,1,0,0,0,0|1,1,0]=4 5088 B12R1.278 N#CCc1cccc(c1)OCF 7a_100000696680_100015361967 [1,1,0,0,0,0|1,0,1]=4 5089 B12R1.278 NCCc1cccc(c1)OCF 34a_100000747277_100015361967 [1,1,0,0,0,0|1,0,0]=3 5090 B12R1.278 NCCc1cccc(c1)SCF 62a_100011207229_100015361967 [1,1,0,0,0,0|1,1,0]=4 5091 B12R1.278 NCCc1cccc(c1)SCF 62a_100015361967_100011207229 [1,1,0,0,0,0|1,1,0]=4 5092 B12R1.278 NNCc1cccc(c1)OCF 34a_100000008902_100015361967 [1,1,0,0,0,0|2,0,0]=4 5093 B12R1.278 OCCc1cccc(c1)NCF 34a_100011996697_100015361967 [1,1,0,0,0,0|2,0,0]=4 5094 B12R1.278 OCCc1cccc(c1)OCF 34a_100011215281_100015361967 [1,1,0,0,0,0|1,0,0]=3 5095 B12R1.278 OCCc1cccc(c1)OCF 7a_100011215281_100015361967 [1,1,0,0,0,0|1,0,0]=3 5096 B12R1.278 OCCc1cccc(c1)SCF 62a_100011217444_100015361967 [1,1,0,0,0,0|1,1,0]=4 5097 B12R1.278 OCCc1cccc(c1)SCF 62a_100015361967_100011217444 [1,1,0,0,0,0|1,1,0]=4 5098 B12R1.279 C=C(C)c1cccc(c1)CCC 271570a_100000694244_100000694964 [1,1,0,0,0,0|1,0,0]=3 5099 B12R1.279 C=C(C)c1cccc(c1)CCN 271570a_100000694244_100011207229 [1,1,0,0,0,0|2,0,0]=4 5100 B12R1.279 C=C(C)c1cccc(c1)CCO 271570a_100000694244_100011217444 [1,1,0,0,0,0|2,0,0]=4 5101 B12R1.279 C=C(C)c1cccc(c1)CNC 271570a_100000694244_100000187585 [1,1,0,0,0,0|2,0,0]=4 5102 B12R1.279 C=C(C)c1cccc(c1)COC 271570a_100000694244_100011493687 [1,1,0,0,0,0|2,0,0]=4 5103 B12R1.279 C=C(C)c1cccc(c1)NCC 271570a_100000694244_100000738899 [1,1,0,0,0,0|2,0,0]=4 5104 B12R1.279 C=C(C)c1cccc(c1)OCC 271570a_100000694244_100000170002 [1,1,0,0,0,0|2,0,0]=4 5105 B12R1.279 C=C(C)c1cccc(c1)SCC 271570a_100000694244_100000703699 [1,1,0,0,0,0|2,0,0]=4 5106 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100000210202_100012123953 [1,1,0,0,0,0|2,0,0]=4 5107 B12R1.279 C=C(C)c1cccc(c1)SCC 62a_100012123953_100000210202 [1,1,0,0,0,0|2,0,0]=4 5108 B12R1.279 CC(=O)c1cccc(c1)CCO 1458a_100009869812_200000210301 [1,1,0,0,0,0|2,0,0]=4 5109 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_100000084091_200025704644 [1,1,0,0,0,0|2,0,0]=4 5110 B12R1.279 CC(=O)c1cccc(c1)CS[13CH3] 62a_200025704644_100000084091 [1,1,0,0,0,0|2,0,0]=4 5111 B12R1.279 CCNc1cccc(c1)C(C)C 2230a_100000211879_100000210202 [1,1,0,0,0,0|2,0,0]=4 5112 B12R1.279 CCNc1cccc(c1)C(C)C 34a_100000211879_100000210202 [1,1,0,0,0,0|2,0,0]=4 5113 B12R1.279 CCNc1cccc(c1)C(C)C 7a_100000211879_100000210202 [1,1,0,0,0,0|2,0,0]=4 5114 B12R1.279 CCNc1cccc(c1)C(C)O 2230a_100011217120_100000210202 [1,1,0,0,0,0|2,0,0]=4 5115 B12R1.279 CCNc1cccc(c1)C(C)O 34a_100011217120_100000210202 [1,1,0,0,0,0|2,0,0]=4 5116 B12R1.279 CCNc1cccc(c1)N(C)C 34a_100000209982_100000210202 [1,1,0,0,0,0|2,0,0]=4 5117 B12R1.279 CCOc1cccc(c1)C(=O)C 1458a_100000216331_200000210301 [1,1,0,0,0,0|2,0,0]=4 5118 B12R1.279 CCOc1cccc(c1)C(=O)C 34a_100000211620_100000210202 [1,1,0,0,0,0|2,0,0]=4 5119 B12R1.279 CCOc1cccc(c1)C(=O)C 7a_100000211620_100000210202 [1,1,0,0,0,0|2,0,0]=4 5120 B12R1.279 CCOc1cccc(c1)C(=O)[13CH3] 1458a_100000216331_200025704644 [1,1,0,0,0,0|2,0,0]=4 5121 B12R1.279 CCOc1cccc(c1)C(C)C 34a_100000211816_100000210202 [1,1,0,0,0,0|2,0,0]=4 5122 B12R1.279 CCOc1cccc(c1)C(C)C 7a_100000211816_100000210202 [1,1,0,0,0,0|2,0,0]=4 5123 B12R1.279 CCOc1cccc(c1)C(C)N 34a_100000740644_100000210202 [1,1,0,0,0,0|2,0,0]=4 5124 B12R1.279 CCOc1cccc(c1)C(C)N 7a_100000740644_100000210202 [1,1,0,0,0,0|2,0,0]=4 5125 B12R1.279 CCOc1cccc(c1)C(C)O 34a_100000748013_100000210202 [1,1,0,0,0,0|2,0,0]=4 5126 B12R1.279 CCOc1cccc(c1)C(C)O 7a_100000748013_100000210202 [1,1,0,0,0,0|2,0,0]=4 5127 B12R1.279 CCOc1cccc(c1)N(C)C 34a_100000738785_100000210202 [1,1,0,0,0,0|2,0,0]=4 5128 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210093_100000210202 [1,1,0,0,0,0|2,0,0]=4 5129 B12R1.279 CCSc1cccc(c1)C(=O)C 62a_100000210202_100000210093 [1,1,0,0,0,0|2,0,0]=4 5130 B12R1.279 CCSc1cccc(c1)C(C)C 62a_100000210202_100011214899 [1,1,0,0,0,0|2,0,0]=4 5131 B12R1.279 CCSc1cccc(c1)C(C)C 62a_100011214899_100000210202 [1,1,0,0,0,0|2,0,0]=4 5132 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100000210202_100020642005 [1,1,0,0,0,0|2,0,0]=4 5133 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100020642005_100000210202 [1,1,0,0,0,0|2,0,0]=4 5134 B12R1.279 CCSc1cccc(c1)C(C)O 62a_100000210202_100000246457 [1,1,0,0,0,0|2,0,0]=4 5135 B12R1.279 CCSc1cccc(c1)C(C)O 62a_100000246457_100000210202 [1,1,0,0,0,0|2,0,0]=4 5136 B12R1.279 CCSc1cccc(c1)N(C)C 62a_100000210202_100011215952 [1,1,0,0,0,0|2,0,0]=4 5137 B12R1.279 CCSc1cccc(c1)N(C)C 62a_100011215952_100000210202 [1,1,0,0,0,0|2,0,0]=4 5138 B12R1.279 CCSc1cccc(c1)S(=O)C 62a_100000210202_100009816267 [1,1,0,0,0,0|1,1,0]=4 5139 B12R1.279 CCSc1cccc(c1)S(=O)C 62a_100009816267_100000210202 [1,1,0,0,0,0|1,1,0]=4 5140 B12R1.279 CN(C)c1cccc(c1)CO[13CH3] 34a_100000759682_200025704644 [1,1,0,0,0,0|2,0,0]=4 5141 B12R1.279 CNCc1cccc(c1)C(=O)C 2230a_106832991635_100000084091 [1,1,0,0,0,0|2,0,0]=4 5142 B12R1.279 CNCc1cccc(c1)C(=O)C 26a_100102657272_100000211620 [1,1,0,0,0,0|2,0,0]=4 5143 B12R1.279 CNCc1cccc(c1)C(=O)C 34a_100102657272_100000084091 [1,1,0,0,0,0|2,0,0]=4 5144 B12R1.279 CNCc1cccc(c1)C(=O)C 7a_106832991635_100000084091 [1,1,0,0,0,0|2,0,0]=4 5145 B12R1.279 CNCc1cccc(c1)C(C)C 207a_100102657272_100011935327 [1,1,0,0,0,0|2,0,0]=4 5146 B12R1.279 CNCc1cccc(c1)C(C)C 26a_100102657272_100000211816 [1,1,0,0,0,0|2,0,0]=4 5147 B12R1.279 CNCc1cccc(c1)C(C)C 270004a_106832991635_100011935327 [1,1,0,0,0,0|2,0,0]=4 5148 B12R1.279 CNCc1cccc(c1)C(C)O 26a_100102657272_100000748013 [1,1,0,0,0,0|2,0,0]=4 5149 B12R1.279 CNCc1cccc(c1)N(C)C 207a_100102657272_100011794417 [1,1,0,0,0,0|2,0,0]=4 5150 B12R1.279 CNCc1cccc(c1)N(C)C 270004a_106832991635_100011794417 [1,1,0,0,0,0|2,0,0]=4 5151 B12R1.279 COCc1cccc(c1)C(=O)C 1458a_100000199024_200000210301 [1,1,0,0,0,0|2,0,0]=4 5152 B12R1.279 COCc1cccc(c1)C(=O)C 34a_100138415774_100000084091 [1,1,0,0,0,0|2,0,0]=4 5153 B12R1.279 COCc1cccc(c1)C(=O)[13CH3] 1458a_100000199024_200025704644 [1,1,0,0,0,0|2,0,0]=4 5154 B12R1.279 COCc1cccc(c1)N(C)C 34a_100000759682_200000210301 [1,1,0,0,0,0|2,0,0]=4 5155 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_100000084091_200000210301 [1,1,0,0,0,0|2,0,0]=4 5156 B12R1.279 CSCc1cccc(c1)C(=O)C 62a_200000210301_100000084091 [1,1,0,0,0,0|2,0,0]=4 5157 B12R1.279 [13CH3]C(=O)c1cccc(c1)CCO 1458a_100009869812_200025704644 [1,1,0,0,0,0|2,0,0]=4 5158 B12R1.280 CC=Cc1cccc(c1C)OC 271570a_100016259895_100010002647 [1,1,0,0,0,0|0,0,2]=4 5159 B12R1.280 CC=Cc1cccc(c1Cl)OC 271570a_100016259895_100010147677 [1,1,0,0,0,0|0,0,2]=4 5160 B12R1.280 CC=Cc1cccc(c1F)OC 271570a_100016259895_100010185846 [1,1,0,0,0,0|0,0,2]=4 5161 B12R1.280 CC=Cc1cccc(c1N)OC 271570a_100016259895_100000708083 [1,1,0,0,0,0|0,0,2]=4 5162 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [1,1,0,0,0,0|0,0,2]=4 5163 B12R1.280 CCNc1cccc(c1Br)OC 34a_100000703447_100000210202 [1,1,0,0,0,0|1,0,0]=3 5164 B12R1.280 CCNc1cccc(c1C)OC 34a_100011244893_100000210202 [1,1,0,0,0,0|1,0,0]=3 5165 B12R1.280 CCNc1cccc(c1C)OC 7a_100011244893_100000210202 [1,1,0,0,0,0|1,0,0]=3 5166 B12R1.280 CCNc1cccc(c1Cl)OC 34a_100000089720_100000210202 [1,1,0,0,0,0|1,0,0]=3 5167 B12R1.280 CCNc1cccc(c1F)OC 34a_100000100910_100000210202 [1,1,0,0,0,0|1,0,0]=3 5168 B12R1.280 CCNc1cccc(c1I)OC 34a_100010245509_100000210202 [1,1,0,0,0,0|1,0,0]=3 5169 B12R1.280 CCNc1cccc(c1O)OC 34a_100000123586_100000210202 [1,1,0,0,0,0|1,0,0]=3 5170 B12R1.280 CCOc1cccc(c1Br)OC 34a_100010202623_100000210202 [1,1,0,0,0,0|1,0,0]=3 5171 B12R1.280 CCOc1cccc(c1Br)OC 7a_100010202623_100000210202 [1,1,0,0,0,0|1,0,0]=3 5172 B12R1.280 CCOc1cccc(c1Cl)OC 34a_100000087810_100000210202 [1,1,0,0,0,0|1,0,0]=3 5173 B12R1.280 CCOc1cccc(c1Cl)OC 7a_100000087810_100000210202 [1,1,0,0,0,0|1,0,0]=3 5174 B12R1.280 CCOc1cccc(c1F)OC 34a_100000102366_100000210202 [1,1,0,0,0,0|1,0,0]=3 5175 B12R1.280 CCOc1cccc(c1F)OC 7a_100000102366_100000210202 [1,1,0,0,0,0|1,0,0]=3 5176 B12R1.280 CCOc1cccc(c1I)OC 34a_200010201982_100000210202 [1,1,0,0,0,0|1,0,0]=3 5177 B12R1.280 CCOc1cccc(c1I)OC 7a_200010201982_100000210202 [1,1,0,0,0,0|1,0,0]=3 5178 B12R1.280 CCOc1cccc(c1N)OC 34a_100012022766_100000210202 [1,1,0,0,0,0|1,0,0]=3 5179 B12R1.280 CCOc1cccc(c1N)OC 7a_100012022766_100000210202 [1,1,0,0,0,0|1,0,0]=3 5180 B12R1.280 CCOc1cccc(c1N)SC 62a_200103155331_200000210301 [1,1,0,0,0,0|1,1,0]=4 5181 B12R1.280 CCOc1cccc(c1N)S[13CH3] 62a_200103155331_200025704644 [1,1,0,0,0,0|1,1,0]=4 5182 B12R1.280 CCSc1cccc(c1Br)OC 62a_100000210202_100010146559 [1,1,0,0,0,0|1,0,0]=3 5183 B12R1.280 CCSc1cccc(c1Br)OC 62a_100010146559_100000210202 [1,1,0,0,0,0|1,0,0]=3 5184 B12R1.280 CCSc1cccc(c1C)OC 62a_100000210202_100010002647 [1,1,0,0,0,0|1,0,0]=3 5185 B12R1.280 CCSc1cccc(c1C)OC 62a_100010002647_100000210202 [1,1,0,0,0,0|1,0,0]=3 5186 B12R1.280 CCSc1cccc(c1Cl)OC 62a_100000210202_100010147677 [1,1,0,0,0,0|1,0,0]=3 5187 B12R1.280 CCSc1cccc(c1Cl)OC 62a_100010147677_100000210202 [1,1,0,0,0,0|1,0,0]=3 5188 B12R1.280 CCSc1cccc(c1F)OC 62a_100000210202_100010185846 [1,1,0,0,0,0|1,0,0]=3 5189 B12R1.280 CCSc1cccc(c1F)OC 62a_100010185846_100000210202 [1,1,0,0,0,0|1,0,0]=3 5190 B12R1.280 CCSc1cccc(c1N)NC 62a_100000695761_100000210202 [1,1,0,0,0,0|2,0,0]=4 5191 B12R1.280 CCSc1cccc(c1N)OC 62a_100000708083_100000210202 [1,1,0,0,0,0|1,0,0]=3 5192 B12R1.280 CCSc1cccc(c1O)CC 62a_100000210202_200010001580 [1,1,0,0,0,0|2,0,0]=4 5193 B12R1.280 CCSc1cccc(c1O)CC 62a_200010001580_100000210202 [1,1,0,0,0,0|2,0,0]=4 5194 B12R1.280 CCSc1cccc(c1O)OC 62a_100000210202_100000686866 [1,1,0,0,0,0|1,0,0]=3 5195 B12R1.280 CCSc1ccnc(c1C)OC 62a_100000210202_100010068544 [1,1,0,0,0,0|2,0,0]=4 5196 B12R1.280 CCSc1ccnc(c1C)OC 62a_100010068544_100000210202 [1,1,0,0,0,0|2,0,0]=4 5197 B12R1.280 CCSc1ccnc(c1F)OC 62a_100000210202_100009885657 [1,1,0,0,0,0|2,0,0]=4 5198 B12R1.280 CCSc1ccnc(c1F)OC 62a_100009885657_100000210202 [1,1,0,0,0,0|2,0,0]=4 5199 B12R1.280 CCSc1cncc(c1C)OC 62a_100000210202_100010136163 [1,1,0,0,0,0|2,0,0]=4 5200 B12R1.280 CCSc1cncc(c1C)OC 62a_100010136163_100000210202 [1,1,0,0,0,0|2,0,0]=4 5201 B12R1.280 CCSc1nccc(c1C)OC 62a_100000210202_100010067686 [1,1,0,0,0,0|2,0,0]=4 5202 B12R1.280 CCSc1nccc(c1C)OC 62a_100010067686_100000210202 [1,1,0,0,0,0|2,0,0]=4 5203 B12R1.280 CCSc1nccc(c1F)OC 62a_100000210202_200010136267 [1,1,0,0,0,0|2,0,0]=4 5204 B12R1.280 CCSc1nccc(c1F)OC 62a_200010136267_100000210202 [1,1,0,0,0,0|2,0,0]=4 5205 B12R1.280 CCSc1nccc(c1N)OC 62a_100000210202_100000100113 [1,1,0,0,0,0|2,0,0]=4 5206 B12R1.280 CCSc1nccc(c1N)OC 62a_100010233645_100000210202 [1,1,0,0,0,0|2,0,0]=4 5207 B12R1.280 CNCc1cccc(c1Br)OC 207a_100102657272_100010209554 [1,1,0,0,0,0|1,0,0]=3 5208 B12R1.280 CNCc1cccc(c1Br)OC 26a_100102657272_100010202623 [1,1,0,0,0,0|1,0,0]=3 5209 B12R1.280 CNCc1cccc(c1Br)OC 270004a_106832991635_100010209554 [1,1,0,0,0,0|1,0,0]=3 5210 B12R1.280 CNCc1cccc(c1C)OC 207a_100102657272_100000101217 [1,1,0,0,0,0|1,0,0]=3 5211 B12R1.280 CNCc1cccc(c1C)OC 2230a_106832991635_100009876938 [1,1,0,0,0,0|1,0,0]=3 5212 B12R1.280 CNCc1cccc(c1C)OC 270004a_106832991635_100000101217 [1,1,0,0,0,0|1,0,0]=3 5213 B12R1.280 CNCc1cccc(c1C)OC 34a_100102657272_100009876938 [1,1,0,0,0,0|1,0,0]=3 5214 B12R1.280 CNCc1cccc(c1C)OC 7a_106832991635_100009876938 [1,1,0,0,0,0|1,0,0]=3 5215 B12R1.280 CNCc1cccc(c1Cl)OC 207a_100102657272_100000068750 [1,1,0,0,0,0|1,0,0]=3 5216 B12R1.280 CNCc1cccc(c1Cl)OC 2230a_106832991635_200010147866 [1,1,0,0,0,0|1,0,0]=3 5217 B12R1.280 CNCc1cccc(c1Cl)OC 26a_100102657272_100000087810 [1,1,0,0,0,0|1,0,0]=3 5218 B12R1.280 CNCc1cccc(c1Cl)OC 270004a_106832991635_100000068750 [1,1,0,0,0,0|1,0,0]=3 5219 B12R1.280 CNCc1cccc(c1Cl)OC 34a_100102657272_200010147866 [1,1,0,0,0,0|1,0,0]=3 5220 B12R1.280 CNCc1cccc(c1Cl)OC 7a_106832991635_200010147866 [1,1,0,0,0,0|1,0,0]=3 5221 B12R1.280 CNCc1cccc(c1F)OC 207a_100102657272_100000692048 [1,1,0,0,0,0|1,0,0]=3 5222 B12R1.280 CNCc1cccc(c1F)OC 2230a_106832991635_100011260763 [1,1,0,0,0,0|1,0,0]=3 5223 B12R1.280 CNCc1cccc(c1F)OC 270004a_106832991635_100000692048 [1,1,0,0,0,0|1,0,0]=3 5224 B12R1.280 CNCc1cccc(c1F)OC 34a_100102657272_100011260763 [1,1,0,0,0,0|1,0,0]=3 5225 B12R1.280 CNCc1cccc(c1F)OC 34a_100137345169_200000210301 [1,1,0,0,0,0|1,0,0]=3 5226 B12R1.280 CNCc1cccc(c1F)OC 7a_106832991635_100011260763 [1,1,0,0,0,0|1,0,0]=3 5227 B12R1.280 CNCc1cccc(c1F)SC 62a_114873767014_200000210301 [1,1,0,0,0,0|1,1,0]=4 5228 B12R1.280 CNCc1cccc(c1F)SC 62a_200000210301_114873767014 [1,1,0,0,0,0|1,1,0]=4 5229 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_114873767014_200025704644 [1,1,0,0,0,0|1,1,0]=4 5230 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_200025704644_114873767014 [1,1,0,0,0,0|1,1,0]=4 5231 B12R1.280 CNCc1ccnc(c1Cl)OC 207a_100102657272_200000087872 [1,1,0,0,0,0|2,0,0]=4 5232 B12R1.280 CNCc1ccnc(c1Cl)OC 270004a_106832991635_200000087872 [1,1,0,0,0,0|2,0,0]=4 5233 B12R1.280 CNCc1nccc(c1C)OC 2230a_106832991635_100016994983 [1,1,0,0,0,0|2,0,0]=4 5234 B12R1.280 CNCc1nccc(c1C)OC 34a_100102657272_100016994983 [1,1,0,0,0,0|2,0,0]=4 5235 B12R1.280 CNCc1nccc(c1C)OC 7a_106832991635_100016994983 [1,1,0,0,0,0|2,0,0]=4 5236 B12R1.280 COCc1cccc(c1Br)OC 34a_100010146792_200000210301 [1,1,0,0,0,0|1,0,0]=3 5237 B12R1.280 COCc1cccc(c1Br)OC 7a_100010146792_200000210301 [1,1,0,0,0,0|1,0,0]=3 5238 B12R1.280 COCc1cccc(c1C)OC 34a_100009871736_200000210301 [1,1,0,0,0,0|1,0,0]=3 5239 B12R1.280 COCc1cccc(c1C)OC 34a_100138415774_100009876938 [1,1,0,0,0,0|1,0,0]=3 5240 B12R1.280 COCc1cccc(c1C)OC 7a_100009871736_200000210301 [1,1,0,0,0,0|1,0,0]=3 5241 B12R1.280 COCc1cccc(c1C)SC 62a_100102485947_200000210301 [1,1,0,0,0,0|1,1,0]=4 5242 B12R1.280 COCc1cccc(c1C)SC 62a_200000210301_100102485947 [1,1,0,0,0,0|1,1,0]=4 5243 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_100102485947_200025704644 [1,1,0,0,0,0|1,1,0]=4 5244 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_200025704644_100102485947 [1,1,0,0,0,0|1,1,0]=4 5245 B12R1.280 COCc1cccc(c1Cl)OC 34a_100138415774_200010147866 [1,1,0,0,0,0|1,0,0]=3 5246 B12R1.280 COCc1cccc(c1F)OC 34a_100011935170_200000210301 [1,1,0,0,0,0|1,0,0]=3 5247 B12R1.280 COCc1cccc(c1F)OC 34a_100138415774_100011260763 [1,1,0,0,0,0|1,0,0]=3 5248 B12R1.280 COCc1cccc(c1F)OC 7a_100011935170_200000210301 [1,1,0,0,0,0|1,0,0]=3 5249 B12R1.280 COCc1cccc(c1I)OC 34a_100010236476_200000210301 [1,1,0,0,0,0|1,0,0]=3 5250 B12R1.280 COCc1cccc(c1I)OC 7a_100010236476_200000210301 [1,1,0,0,0,0|1,0,0]=3 5251 B12R1.280 COCc1cccc(c1N)OC 34a_100011999522_200000210301 [1,1,0,0,0,0|1,0,0]=3 5252 B12R1.280 COCc1ccnc(c1Cl)OC 34a_100009844655_200000210301 [1,1,0,0,0,0|2,0,0]=4 5253 B12R1.280 COCc1nccc(c1C)OC 34a_100000087669_200000210301 [1,1,0,0,0,0|2,0,0]=4 5254 B12R1.280 COCc1nccc(c1C)OC 34a_100138415774_100016994983 [1,1,0,0,0,0|2,0,0]=4 5255 B12R1.280 COc1cccc(c1Br)CO[13CH3] 34a_100010146792_200025704644 [1,1,0,0,0,0|1,0,0]=3 5256 B12R1.280 COc1cccc(c1Br)CO[13CH3] 7a_100010146792_200025704644 [1,1,0,0,0,0|1,0,0]=3 5257 B12R1.280 COc1cccc(c1Br)NCF 34a_100000703447_100015361967 [1,1,0,0,0,0|2,0,0]=4 5258 B12R1.280 COc1cccc(c1Br)OCF 34a_100010202623_100015361967 [1,1,0,0,0,0|2,0,0]=4 5259 B12R1.280 COc1cccc(c1Br)OCF 7a_100010202623_100015361967 [1,1,0,0,0,0|2,0,0]=4 5260 B12R1.280 COc1cccc(c1Br)SCF 62a_100010146559_100015361967 [1,1,0,0,0,0|2,0,0]=4 5261 B12R1.280 COc1cccc(c1Br)SCF 62a_100015361967_100010146559 [1,1,0,0,0,0|2,0,0]=4 5262 B12R1.280 COc1cccc(c1C)CO[13CH3] 34a_100009871736_200025704644 [1,1,0,0,0,0|1,0,0]=3 5263 B12R1.280 COc1cccc(c1C)CO[13CH3] 7a_100009871736_200025704644 [1,1,0,0,0,0|1,0,0]=3 5264 B12R1.280 COc1cccc(c1C)CSC 62a_100009876938_200000210301 [1,1,0,0,0,0|1,0,0]=3 5265 B12R1.280 COc1cccc(c1C)CSC 62a_200000210301_100009876938 [1,1,0,0,0,0|1,0,0]=3 5266 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_100009876938_200025704644 [1,1,0,0,0,0|1,0,0]=3 5267 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_200025704644_100009876938 [1,1,0,0,0,0|1,0,0]=3 5268 B12R1.280 COc1cccc(c1C)NCF 34a_100011244893_100015361967 [1,1,0,0,0,0|2,0,0]=4 5269 B12R1.280 COc1cccc(c1C)NCF 7a_100011244893_100015361967 [1,1,0,0,0,0|2,0,0]=4 5270 B12R1.280 COc1cccc(c1C)SCF 62a_100010002647_100015361967 [1,1,0,0,0,0|2,0,0]=4 5271 B12R1.280 COc1cccc(c1C)SCF 62a_100015361967_100010002647 [1,1,0,0,0,0|2,0,0]=4 5272 B12R1.280 COc1cccc(c1Cl)CSC 62a_200000210301_200010147866 [1,1,0,0,0,0|1,0,0]=3 5273 B12R1.280 COc1cccc(c1Cl)CSC 62a_200010147866_200000210301 [1,1,0,0,0,0|1,0,0]=3 5274 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200010147866_200025704644 [1,1,0,0,0,0|1,0,0]=3 5275 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200025704644_200010147866 [1,1,0,0,0,0|1,0,0]=3 5276 B12R1.280 COc1cccc(c1Cl)NCF 34a_100000089720_100015361967 [1,1,0,0,0,0|2,0,0]=4 5277 B12R1.280 COc1cccc(c1Cl)OCF 34a_100000087810_100015361967 [1,1,0,0,0,0|2,0,0]=4 5278 B12R1.280 COc1cccc(c1Cl)OCF 7a_100000087810_100015361967 [1,1,0,0,0,0|2,0,0]=4 5279 B12R1.280 COc1cccc(c1Cl)SCF 62a_100010147677_100015361967 [1,1,0,0,0,0|2,0,0]=4 5280 B12R1.280 COc1cccc(c1Cl)SCF 62a_100015361967_100010147677 [1,1,0,0,0,0|2,0,0]=4 5281 B12R1.280 COc1cccc(c1F)CN[13CH3] 34a_100137345169_200025704644 [1,1,0,0,0,0|1,0,0]=3 5282 B12R1.280 COc1cccc(c1F)CO[13CH3] 34a_100011935170_200025704644 [1,1,0,0,0,0|1,0,0]=3 5283 B12R1.280 COc1cccc(c1F)CO[13CH3] 7a_100011935170_200025704644 [1,1,0,0,0,0|1,0,0]=3 5284 B12R1.280 COc1cccc(c1F)CSC 62a_100011260763_200000210301 [1,1,0,0,0,0|1,0,0]=3 5285 B12R1.280 COc1cccc(c1F)CSC 62a_200000210301_100011260763 [1,1,0,0,0,0|1,0,0]=3 5286 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_100011260763_200025704644 [1,1,0,0,0,0|1,0,0]=3 5287 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_200025704644_100011260763 [1,1,0,0,0,0|1,0,0]=3 5288 B12R1.280 COc1cccc(c1F)NCF 34a_100000100910_100015361967 [1,1,0,0,0,0|2,0,0]=4 5289 B12R1.280 COc1cccc(c1F)OCF 34a_100000102366_100015361967 [1,1,0,0,0,0|2,0,0]=4 5290 B12R1.280 COc1cccc(c1F)OCF 7a_100000102366_100015361967 [1,1,0,0,0,0|2,0,0]=4 5291 B12R1.280 COc1cccc(c1F)SCF 62a_100010185846_100015361967 [1,1,0,0,0,0|2,0,0]=4 5292 B12R1.280 COc1cccc(c1F)SCF 62a_100015361967_100010185846 [1,1,0,0,0,0|2,0,0]=4 5293 B12R1.280 COc1cccc(c1I)CO[13CH3] 34a_100010236476_200025704644 [1,1,0,0,0,0|1,0,0]=3 5294 B12R1.280 COc1cccc(c1I)CO[13CH3] 7a_100010236476_200025704644 [1,1,0,0,0,0|1,0,0]=3 5295 B12R1.280 COc1cccc(c1I)NCF 34a_100010245509_100015361967 [1,1,0,0,0,0|2,0,0]=4 5296 B12R1.280 COc1cccc(c1I)OCF 34a_200010201982_100015361967 [1,1,0,0,0,0|2,0,0]=4 5297 B12R1.280 COc1cccc(c1I)OCF 7a_200010201982_100015361967 [1,1,0,0,0,0|2,0,0]=4 5298 B12R1.280 COc1cccc(c1N)CO[13CH3] 34a_100011999522_200025704644 [1,1,0,0,0,0|1,0,0]=3 5299 B12R1.280 COc1cccc(c1N)OCF 34a_100012022766_100015361967 [1,1,0,0,0,0|2,0,0]=4 5300 B12R1.280 COc1cccc(c1N)OCF 7a_100012022766_100015361967 [1,1,0,0,0,0|2,0,0]=4 5301 B12R1.280 COc1cccc(c1N)SCF 62a_100000708083_100015361967 [1,1,0,0,0,0|2,0,0]=4 5302 B12R1.280 COc1cccc(c1O)NCF 34a_100000123586_100015361967 [1,1,0,0,0,0|2,0,0]=4 5303 B12R1.280 COc1cccc(c1O)SCF 62a_100015361967_100000686866 [1,1,0,0,0,0|2,0,0]=4 5304 B12R1.280 COc1ccnc(c1C)CO[13CH3] 34a_100000087669_200025704644 [1,1,0,0,0,0|2,0,0]=4 5305 B12R1.280 COc1ccnc(c1C)CSC 62a_100016994983_200000210301 [1,1,0,0,0,0|2,0,0]=4 5306 B12R1.280 COc1ccnc(c1C)CSC 62a_200000210301_100016994983 [1,1,0,0,0,0|2,0,0]=4 5307 B12R1.280 COc1ccnc(c1C)CS[13CH3] 62a_100016994983_200025704644 [1,1,0,0,0,0|2,0,0]=4 5308 B12R1.280 COc1ccnc(c1C)CS[13CH3] 62a_200025704644_100016994983 [1,1,0,0,0,0|2,0,0]=4 5309 B12R1.280 COc1nccc(c1Cl)CO[13CH3] 34a_100009844655_200025704644 [1,1,0,0,0,0|2,0,0]=4 5310 B12R1.280 CSc1cccc(c1C)CCN 62a_100161000114_200000210301 [1,1,0,0,0,0|1,1,0]=4 5311 B12R1.280 CSc1cccc(c1C)CCN 62a_200000210301_100161000114 [1,1,0,0,0,0|1,1,0]=4 5312 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_100161000114_200025704644 [1,1,0,0,0,0|1,1,0]=4 5313 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_200025704644_100161000114 [1,1,0,0,0,0|1,1,0]=4 5314 B12R1.382 C#CCNc1cccc(c1)OC 34a_100000210024_100000184674 [1,1,0,0,0,0|0,0,2]=4 5315 B12R1.382 C#CCOc1cccc(c1)OC 34a_100000211255_100000184674 [1,1,0,0,0,0|0,0,2]=4 5316 B12R1.382 C#CCOc1cccc(c1)OC 7a_100000211255_100000038162 [1,1,0,0,0,0|0,0,2]=4 5317 B12R1.382 C#CCSc1cccc(c1)OC 62a_100000038162_100000170001 [1,1,0,0,0,0|0,0,2]=4 5318 B12R1.382 C#Cc1cccc(c1)CNCC 207a_100015525214_100011361529 [1,1,0,0,0,0|1,0,1]=4 5319 B12R1.382 C#Cc1cccc(c1)COCC 34a_100010272118_100000210202 [1,1,0,0,0,0|1,0,1]=4 5320 B12R1.382 C#Cc1cccc(c1)COCC 7a_100010272118_100000210202 [1,1,0,0,0,0|1,0,1]=4 5321 B12R1.382 C#Cc1cccc(c1)NCCC 2230a_100000735509_100000210303 [1,1,0,0,0,0|1,0,1]=4 5322 B12R1.382 C#Cc1cccc(c1)NCCC 34a_100000735509_100000210303 [1,1,0,0,0,0|1,0,1]=4 5323 B12R1.382 C#Cc1cccc(c1)OCCC 34a_100011216014_100000210303 [1,1,0,0,0,0|1,0,1]=4 5324 B12R1.382 C#Cc1cccc(c1)OCCC 7a_100011216014_100000210303 [1,1,0,0,0,0|1,0,1]=4 5325 B12R1.382 C=CCNc1cccc(c1)OC 34a_100000210024_100015514636 [1,1,0,0,0,0|0,0,2]=4 5326 B12R1.382 C=CCOc1cccc(c1)OC 34a_100000211255_100015514636 [1,1,0,0,0,0|0,0,2]=4 5327 B12R1.382 C=CCOc1cccc(c1)OC 7a_100000211255_100015514636 [1,1,0,0,0,0|0,0,2]=4 5328 B12R1.382 C=CCSc1cccc(c1)OC 62a_100000210623_100000170001 [1,1,0,0,0,0|0,0,2]=4 5329 B12R1.382 C=Cc1cccc(c1)CCCC 271570a_100011290941_200010244551 [1,1,0,0,0,0|1,0,1]=4 5330 B12R1.382 C=Cc1cccc(c1)CCCN 271570a_100011290941_100000753791 [1,1,0,0,0,0|1,0,1]=4 5331 B12R1.382 C=Cc1cccc(c1)CCCO 271570a_100011290941_100011709248 [1,1,0,0,0,0|1,0,1]=4 5332 B12R1.382 C=Cc1cccc(c1)CNCC 270004a_100015525214_100011218069 [1,1,0,0,0,0|1,0,1]=4 5333 B12R1.382 C=Cc1cccc(c1)CNCC 271570a_100011290941_100000187426 [1,1,0,0,0,0|1,0,1]=4 5334 B12R1.382 C=Cc1cccc(c1)COCC 271570a_100011290941_100011493694 [1,1,0,0,0,0|1,0,1]=4 5335 B12R1.382 C=Cc1cccc(c1)NCCC 34a_100011827668_100000210303 [1,1,0,0,0,0|1,0,1]=4 5336 B12R1.382 C=Cc1cccc(c1)OCCC 271570a_100011290941_100000170004 [1,1,0,0,0,0|1,0,1]=4 5337 B12R1.382 C=Cc1cccc(c1)OCCC 34a_100011309434_100000210303 [1,1,0,0,0,0|1,0,1]=4 5338 B12R1.382 C=Cc1cccc(c1)OCCC 7a_100011309434_100000210303 [1,1,0,0,0,0|1,0,1]=4 5339 B12R1.382 C=Cc1cccc(c1)SCCC 271570a_100011290941_200009815762 [1,1,0,0,0,0|1,0,1]=4 5340 B12R1.382 C=Cc1cccc(c1)SCCC 62a_100000210303_100011215241 [1,1,0,0,0,0|1,0,1]=4 5341 B12R1.382 C=Cc1cccc(c1)SCCC 62a_100011215241_100000210303 [1,1,0,0,0,0|1,0,1]=4 5342 B12R1.382 CC=NNc1cccc(c1)OC 4a_100000722927_200000210099 [1,1,0,0,0,0|1,0,1]=4 5343 B12R1.382 CCCCc1cc(ccn1)CC 271570a_100020621405_100009817561 [1,1,0,0,0,0|2,0,0]=4 5344 B12R1.382 CCCCc1cc(ccn1)NC 271570a_100020621405_100009869472 [1,1,0,0,0,0|2,0,0]=4 5345 B12R1.382 CCCCc1cc(ccn1)OC 271570a_100020621405_100011216251 [1,1,0,0,0,0|1,0,0]=3 5346 B12R1.382 CCCCc1cc(ccn1)SC 271570a_100020621405_100010883326 [1,1,0,0,0,0|1,1,0]=4 5347 B12R1.382 CCCCc1cc(cnn1)OC 271570a_100020621405_100000087634 [1,1,0,0,0,0|2,0,0]=4 5348 B12R1.382 CCCCc1cc(ncn1)OC 271570a_100020621405_100012187182 [1,1,0,0,0,0|2,0,0]=4 5349 B12R1.382 CCCCc1cccc(c1)C#N 271570a_100020621405_100000189340 [1,1,0,0,0,0|2,0,0]=4 5350 B12R1.382 CCCCc1cccc(c1)C=O 271570a_100020621405_100000014684 [1,1,0,0,0,0|2,0,0]=4 5351 B12R1.382 CCCCc1cccc(c1)CC 271570a_100020621405_100000684523 [1,1,0,0,0,0|1,0,0]=3 5352 B12R1.382 CCCCc1cccc(c1)CF 271570a_100020621405_100010878472 [1,1,0,0,0,0|2,0,0]=4 5353 B12R1.382 CCCCc1cccc(c1)CN 271570a_100020621405_100000106179 [1,1,0,0,0,0|2,0,0]=4 5354 B12R1.382 CCCCc1cccc(c1)CO 271570a_100020621405_100000687537 [1,1,0,0,0,0|2,0,0]=4 5355 B12R1.382 CCCCc1cccc(c1)NC 2230a_200012017287_200000210301 [1,1,0,0,0,0|1,0,0]=3 5356 B12R1.382 CCCCc1cccc(c1)NC 271570a_100020621405_100000219648 [1,1,0,0,0,0|1,0,0]=3 5357 B12R1.382 CCCCc1cccc(c1)NC 34a_200012017287_200000210301 [1,1,0,0,0,0|1,0,0]=3 5358 B12R1.382 CCCCc1cccc(c1)NC 7a_200012017287_200000210301 [1,1,0,0,0,0|1,0,0]=3 5359 B12R1.382 CCCCc1cccc(c1)NN 271570a_100020621405_100000217339 [1,1,0,0,0,0|2,0,0]=4 5360 B12R1.382 CCCCc1cccc(c1)N[13CH3] 2230a_200012017287_200025704644 [1,1,0,0,0,0|1,0,0]=3 5361 B12R1.382 CCCCc1cccc(c1)N[13CH3] 34a_200012017287_200025704644 [1,1,0,0,0,0|1,0,0]=3 5362 B12R1.382 CCCCc1cccc(c1)N[13CH3] 7a_200012017287_200025704644 [1,1,0,0,0,0|1,0,0]=3 5363 B12R1.382 CCCCc1cccc(c1)OC 271570a_100020621405_100000170001 [1,1,0,0,0,0|0,0,0]=2 5364 B12R1.382 CCCCc1cccc(c1)SC 271570a_100020621405_100011215954 [1,1,0,0,0,0|0,1,0]=3 5365 B12R1.382 CCCCc1cccc(c1)SC 62a_200000210301_200010244551 [1,1,0,0,0,0|0,1,0]=3 5366 B12R1.382 CCCCc1cccc(c1)SC 62a_200010244551_200000210301 [1,1,0,0,0,0|0,1,0]=3 5367 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200010244551_200025704644 [1,1,0,0,0,0|0,1,0]=3 5368 B12R1.382 CCCCc1cccc(c1)S[13CH3] 62a_200025704644_200010244551 [1,1,0,0,0,0|0,1,0]=3 5369 B12R1.382 CCCCc1cccc(n1)CC 271570a_100020621405_100009856026 [1,1,0,0,0,0|2,0,0]=4 5370 B12R1.382 CCCCc1cccc(n1)NC 271570a_100020621405_100000703281 [1,1,0,0,0,0|2,0,0]=4 5371 B12R1.382 CCCCc1cccc(n1)OC 271570a_100020621405_100000760917 [1,1,0,0,0,0|1,0,0]=3 5372 B12R1.382 CCCCc1cccc(n1)SC 271570a_100020621405_100011960944 [1,1,0,0,0,0|1,1,0]=4 5373 B12R1.382 CCCCc1ccnc(c1)CC 271570a_100020621405_100009820011 [1,1,0,0,0,0|2,0,0]=4 5374 B12R1.382 CCCCc1ccnc(c1)NC 271570a_100020621405_100009819592 [1,1,0,0,0,0|2,0,0]=4 5375 B12R1.382 CCCCc1ccnc(c1)OC 271570a_100020621405_100000117307 [1,1,0,0,0,0|1,0,0]=3 5376 B12R1.382 CCCCc1ccnc(n1)OC 271570a_100020621405_100000069072 [1,1,0,0,0,0|2,0,0]=4 5377 B12R1.382 CCCCc1cncc(c1)CC 271570a_100020621405_200009819073 [1,1,0,0,0,0|2,0,0]=4 5378 B12R1.382 CCCCc1cncc(c1)NC 271570a_100020621405_100012184536 [1,1,0,0,0,0|2,0,0]=4 5379 B12R1.382 CCCCc1cncc(c1)OC 271570a_100020621405_100000684773 [1,1,0,0,0,0|1,0,0]=3 5380 B12R1.382 CCCCc1cncc(c1)SC 271570a_100020621405_100009816972 [1,1,0,0,0,0|1,1,0]=4 5381 B12R1.382 CCCCc1cncc(n1)OC 271570a_100020621405_100000756030 [1,1,0,0,0,0|2,0,0]=4 5382 B12R1.382 CCCCc1nccc(n1)OC 271570a_100020621405_100000182009 [1,1,0,0,0,0|2,0,0]=4 5383 B12R1.382 CCCNc1cccc(c1)C#N 34a_100000210922_100000210303 [1,1,0,0,0,0|2,0,0]=4 5384 B12R1.382 CCCNc1cccc(c1)C#N 7a_100000210922_100000210303 [1,1,0,0,0,0|2,0,0]=4 5385 B12R1.382 CCCNc1cccc(c1)CC 2230a_100000211250_100000210303 [1,1,0,0,0,0|1,0,0]=3 5386 B12R1.382 CCCNc1cccc(c1)CC 34a_100000211250_100000210303 [1,1,0,0,0,0|1,0,0]=3 5387 B12R1.382 CCCNc1cccc(c1)CC 7a_100000211250_100000210303 [1,1,0,0,0,0|1,0,0]=3 5388 B12R1.382 CCCNc1cccc(c1)CF 2230a_100000126320_100000210303 [1,1,0,0,0,0|2,0,0]=4 5389 B12R1.382 CCCNc1cccc(c1)CF 34a_100000126320_100000210303 [1,1,0,0,0,0|2,0,0]=4 5390 B12R1.382 CCCNc1cccc(c1)CF 7a_100000126320_100000210303 [1,1,0,0,0,0|2,0,0]=4 5391 B12R1.382 CCCNc1cccc(c1)CO 2230a_100000211919_100000210303 [1,1,0,0,0,0|2,0,0]=4 5392 B12R1.382 CCCNc1cccc(c1)CO 34a_100000211919_100000210303 [1,1,0,0,0,0|2,0,0]=4 5393 B12R1.382 CCCNc1cccc(c1)OC 34a_100000210024_100000210303 [1,1,0,0,0,0|0,0,0]=2 5394 B12R1.382 CCCNc1cccc(c1)SC 2230a_100000210049_100000210303 [1,1,0,0,0,0|0,1,0]=3 5395 B12R1.382 CCCNc1cccc(c1)SC 34a_100000210049_100000210303 [1,1,0,0,0,0|0,1,0]=3 5396 B12R1.382 CCCNc1cccc(n1)SC 62a_200000210301_200025756634 [1,1,0,0,0,0|1,1,0]=4 5397 B12R1.382 CCCNc1cccc(n1)SC 62a_200025756634_200000210301 [1,1,0,0,0,0|1,1,0]=4 5398 B12R1.382 CCCNc1cccc(n1)S[13CH3] 62a_200025704644_200025756634 [1,1,0,0,0,0|1,1,0]=4 5399 B12R1.382 CCCNc1cccc(n1)S[13CH3] 62a_200025756634_200025704644 [1,1,0,0,0,0|1,1,0]=4 5400 B12R1.382 CCCOc1ccc[n+](c1)CC 34a_100000731997_100000210303 [1,1,0,0,0,0|2,0,0]=4 5401 B12R1.382 CCCOc1ccc[n+](c1)CC 7a_100000731997_100000210303 [1,1,0,0,0,0|2,0,0]=4 5402 B12R1.382 CCCOc1cccc(c1)C#N 34a_100000184713_100000210303 [1,1,0,0,0,0|2,0,0]=4 5403 B12R1.382 CCCOc1cccc(c1)C#N 7a_100000184713_100000210303 [1,1,0,0,0,0|2,0,0]=4 5404 B12R1.382 CCCOc1cccc(c1)CBr 34a_100011660834_100000210303 [1,1,0,0,0,0|2,0,0]=4 5405 B12R1.382 CCCOc1cccc(c1)CBr 7a_100011660834_100000210303 [1,1,0,0,0,0|2,0,0]=4 5406 B12R1.382 CCCOc1cccc(c1)CC 34a_100000211550_100000210303 [1,1,0,0,0,0|1,0,0]=3 5407 B12R1.382 CCCOc1cccc(c1)CC 7a_100000211550_100000210303 [1,1,0,0,0,0|1,0,0]=3 5408 B12R1.382 CCCOc1cccc(c1)CCl 34a_100000084143_100000210303 [1,1,0,0,0,0|2,0,0]=4 5409 B12R1.382 CCCOc1cccc(c1)CCl 7a_100000084143_100000210303 [1,1,0,0,0,0|2,0,0]=4 5410 B12R1.382 CCCOc1cccc(c1)CN 34a_100000743036_100000210303 [1,1,0,0,0,0|2,0,0]=4 5411 B12R1.382 CCCOc1cccc(c1)CO 34a_100011214949_100000210303 [1,1,0,0,0,0|2,0,0]=4 5412 B12R1.382 CCCOc1cccc(c1)CO 7a_100011214949_100000210303 [1,1,0,0,0,0|2,0,0]=4 5413 B12R1.382 CCCOc1cccc(c1)NC 34a_100000756613_100000210303 [1,1,0,0,0,0|1,0,0]=3 5414 B12R1.382 CCCOc1cccc(c1)NC 7a_100000756613_100000210303 [1,1,0,0,0,0|1,0,0]=3 5415 B12R1.382 CCCOc1cccc(c1)OC 34a_100000211255_100000210303 [1,1,0,0,0,0|0,0,0]=2 5416 B12R1.382 CCCOc1cccc(c1)OC 34a_100000748497_200000210301 [1,1,0,0,0,0|0,0,0]=2 5417 B12R1.382 CCCOc1cccc(c1)OC 7a_100000211255_100000210303 [1,1,0,0,0,0|0,0,0]=2 5418 B12R1.382 CCCOc1cccc(c1)OC 7a_100000748497_200000210301 [1,1,0,0,0,0|0,0,0]=2 5419 B12R1.382 CCCOc1cccc(c1)O[13CH3] 34a_100000748497_200025704644 [1,1,0,0,0,0|0,0,0]=2 5420 B12R1.382 CCCOc1cccc(c1)O[13CH3] 7a_100000748497_200025704644 [1,1,0,0,0,0|0,0,0]=2 5421 B12R1.382 CCCOc1cccc(c1)SC 34a_100011265683_100000210303 [1,1,0,0,0,0|0,1,0]=3 5422 B12R1.382 CCCOc1cccc(c1)SC 62a_100000170004_200000210301 [1,1,0,0,0,0|0,1,0]=3 5423 B12R1.382 CCCOc1cccc(c1)SC 62a_200000210301_100000170004 [1,1,0,0,0,0|0,1,0]=3 5424 B12R1.382 CCCOc1cccc(c1)SC 7a_100011265683_100000210303 [1,1,0,0,0,0|0,1,0]=3 5425 B12R1.382 CCCOc1cccc(c1)S[13CH3] 62a_100000170004_200025704644 [1,1,0,0,0,0|0,1,0]=3 5426 B12R1.382 CCCOc1cccc(c1)S[13CH3] 62a_200025704644_100000170004 [1,1,0,0,0,0|0,1,0]=3 5427 B12R1.382 CCCOc1cccc(n1)NC 27a_100102657272_200011960250 [1,1,0,0,0,0|2,0,0]=4 5428 B12R1.382 CCCOc1cccc(n1)SC 62a_200000210301_200011960250 [1,1,0,0,0,0|1,1,0]=4 5429 B12R1.382 CCCOc1cccc(n1)SC 62a_200011960250_200000210301 [1,1,0,0,0,0|1,1,0]=4 5430 B12R1.382 CCCOc1cccc(n1)S[13CH3] 62a_200011960250_200025704644 [1,1,0,0,0,0|1,1,0]=4 5431 B12R1.382 CCCOc1cccc(n1)S[13CH3] 62a_200025704644_200011960250 [1,1,0,0,0,0|1,1,0]=4 5432 B12R1.382 CCCOc1ccnc(c1)OC 34a_100012181050_100000210303 [1,1,0,0,0,0|1,0,0]=3 5433 B12R1.382 CCCOc1cncc(c1)CC 34a_200009861530_100000210303 [1,1,0,0,0,0|2,0,0]=4 5434 B12R1.382 CCCOc1cncc(c1)CC 7a_200009861530_100000210303 [1,1,0,0,0,0|2,0,0]=4 5435 B12R1.382 CCCOc1cncc(c1)OC 34a_100000084572_100000210303 [1,1,0,0,0,0|1,0,0]=3 5436 B12R1.382 CCCOc1cncc(c1)OC 7a_100000084572_100000210303 [1,1,0,0,0,0|1,0,0]=3 5437 B12R1.382 CCCOc1cncc(c1)SC 62a_200000210301_200012029621 [1,1,0,0,0,0|1,1,0]=4 5438 B12R1.382 CCCOc1cncc(c1)SC 62a_200012029621_200000210301 [1,1,0,0,0,0|1,1,0]=4 5439 B12R1.382 CCCOc1cncc(c1)S[13CH3] 62a_200012029621_200025704644 [1,1,0,0,0,0|1,1,0]=4 5440 B12R1.382 CCCOc1cncc(c1)S[13CH3] 62a_200025704644_200012029621 [1,1,0,0,0,0|1,1,0]=4 5441 B12R1.382 CCCSc1cc(ccn1)CC 62a_100000210303_100009817561 [1,1,0,0,0,0|2,0,0]=4 5442 B12R1.382 CCCSc1cc(ccn1)CC 62a_100009817561_100000210303 [1,1,0,0,0,0|2,0,0]=4 5443 B12R1.382 CCCSc1cc(ccn1)NC 62a_100000210303_100009869472 [1,1,0,0,0,0|2,0,0]=4 5444 B12R1.382 CCCSc1cc(ccn1)NC 62a_100009869472_100000210303 [1,1,0,0,0,0|2,0,0]=4 5445 B12R1.382 CCCSc1cc(ccn1)OC 62a_100000210303_100011216251 [1,1,0,0,0,0|1,0,0]=3 5446 B12R1.382 CCCSc1cc(ccn1)OC 62a_100009817693_100000210303 [1,1,0,0,0,0|1,0,0]=3 5447 B12R1.382 CCCSc1cc(ccn1)SC 62a_100000210303_100010883326 [1,1,0,0,0,0|1,1,0]=4 5448 B12R1.382 CCCSc1cc(ccn1)SC 62a_100010883326_100000210303 [1,1,0,0,0,0|1,1,0]=4 5449 B12R1.382 CCCSc1cc(cnn1)OC 62a_100000210303_100000087634 [1,1,0,0,0,0|2,0,0]=4 5450 B12R1.382 CCCSc1cc(ncn1)OC 62a_100000049997_100000210303 [1,1,0,0,0,0|2,0,0]=4 5451 B12R1.382 CCCSc1cc(ncn1)OC 62a_100000210303_100000049997 [1,1,0,0,0,0|2,0,0]=4 5452 B12R1.382 CCCSc1cccc(c1)C#N 62a_100000210303_100000189340 [1,1,0,0,0,0|2,0,0]=4 5453 B12R1.382 CCCSc1cccc(c1)C=O 62a_100000014684_100000210303 [1,1,0,0,0,0|2,0,0]=4 5454 B12R1.382 CCCSc1cccc(c1)C=O 62a_100000210303_100000014684 [1,1,0,0,0,0|2,0,0]=4 5455 B12R1.382 CCCSc1cccc(c1)CC 62a_100000210303_100011263222 [1,1,0,0,0,0|1,0,0]=3 5456 B12R1.382 CCCSc1cccc(c1)CC 62a_100011263222_100000210303 [1,1,0,0,0,0|1,0,0]=3 5457 B12R1.382 CCCSc1cccc(c1)CF 62a_100000210303_100010878472 [1,1,0,0,0,0|2,0,0]=4 5458 B12R1.382 CCCSc1cccc(c1)CF 62a_100010878472_100000210303 [1,1,0,0,0,0|2,0,0]=4 5459 B12R1.382 CCCSc1cccc(c1)CN 62a_100000106179_100000210303 [1,1,0,0,0,0|2,0,0]=4 5460 B12R1.382 CCCSc1cccc(c1)CN 62a_100000210303_100000106179 [1,1,0,0,0,0|2,0,0]=4 5461 B12R1.382 CCCSc1cccc(c1)CO 62a_100000210303_100000687537 [1,1,0,0,0,0|2,0,0]=4 5462 B12R1.382 CCCSc1cccc(c1)CO 62a_100000687537_100000210303 [1,1,0,0,0,0|2,0,0]=4 5463 B12R1.382 CCCSc1cccc(c1)NC 62a_100000210303_100000219648 [1,1,0,0,0,0|1,0,0]=3 5464 B12R1.382 CCCSc1cccc(c1)NC 62a_100000219648_100000210303 [1,1,0,0,0,0|1,0,0]=3 5465 B12R1.382 CCCSc1cccc(c1)NN 62a_100000210303_100000217339 [1,1,0,0,0,0|2,0,0]=4 5466 B12R1.382 CCCSc1cccc(c1)NN 62a_100000217339_100000210303 [1,1,0,0,0,0|2,0,0]=4 5467 B12R1.382 CCCSc1cccc(c1)OC 62a_100000210303_100000170001 [1,1,0,0,0,0|0,0,0]=2 5468 B12R1.382 CCCSc1cccc(c1)SC 62a_100000210303_100011215954 [1,1,0,0,0,0|0,1,0]=3 5469 B12R1.382 CCCSc1cccc(c1)SC 62a_100011215954_100000210303 [1,1,0,0,0,0|0,1,0]=3 5470 B12R1.382 CCCSc1cccc(c1)SC 62a_200000210301_200009815762 [1,1,0,0,0,0|0,1,0]=3 5471 B12R1.382 CCCSc1cccc(c1)SC 62a_200009815762_200000210301 [1,1,0,0,0,0|0,1,0]=3 5472 B12R1.382 CCCSc1cccc(c1)S[13CH3] 62a_200009815762_200025704644 [1,1,0,0,0,0|0,1,0]=3 5473 B12R1.382 CCCSc1cccc(c1)S[13CH3] 62a_200025704644_200009815762 [1,1,0,0,0,0|0,1,0]=3 5474 B12R1.382 CCCSc1cccc(n1)CC 62a_100000210303_100009856026 [1,1,0,0,0,0|2,0,0]=4 5475 B12R1.382 CCCSc1cccc(n1)CC 62a_100009856026_100000210303 [1,1,0,0,0,0|2,0,0]=4 5476 B12R1.382 CCCSc1cccc(n1)NC 62a_100000210303_100000703281 [1,1,0,0,0,0|2,0,0]=4 5477 B12R1.382 CCCSc1cccc(n1)NC 62a_100000703281_100000210303 [1,1,0,0,0,0|2,0,0]=4 5478 B12R1.382 CCCSc1cccc(n1)OC 62a_100000210303_100000760917 [1,1,0,0,0,0|1,0,0]=3 5479 B12R1.382 CCCSc1cccc(n1)OC 62a_100000760917_100000210303 [1,1,0,0,0,0|1,0,0]=3 5480 B12R1.382 CCCSc1cccc(n1)SC 62a_100000210303_100011960944 [1,1,0,0,0,0|1,1,0]=4 5481 B12R1.382 CCCSc1cccc(n1)SC 62a_100011960944_100000210303 [1,1,0,0,0,0|1,1,0]=4 5482 B12R1.382 CCCSc1ccnc(c1)CC 62a_100000210303_100009820011 [1,1,0,0,0,0|2,0,0]=4 5483 B12R1.382 CCCSc1ccnc(c1)CC 62a_100009820011_100000210303 [1,1,0,0,0,0|2,0,0]=4 5484 B12R1.382 CCCSc1ccnc(c1)NC 62a_100000210303_100009819592 [1,1,0,0,0,0|2,0,0]=4 5485 B12R1.382 CCCSc1ccnc(c1)NC 62a_100009819592_100000210303 [1,1,0,0,0,0|2,0,0]=4 5486 B12R1.382 CCCSc1ccnc(c1)OC 62a_100000117307_100000210303 [1,1,0,0,0,0|1,0,0]=3 5487 B12R1.382 CCCSc1ccnc(c1)OC 62a_100000210303_100000117307 [1,1,0,0,0,0|1,0,0]=3 5488 B12R1.382 CCCSc1ccnc(n1)OC 62a_100000069072_100000210303 [1,1,0,0,0,0|2,0,0]=4 5489 B12R1.382 CCCSc1ccnc(n1)OC 62a_100000210303_100000069072 [1,1,0,0,0,0|2,0,0]=4 5490 B12R1.382 CCCSc1cncc(c1)CC 62a_100000210303_200009819073 [1,1,0,0,0,0|2,0,0]=4 5491 B12R1.382 CCCSc1cncc(c1)CC 62a_200009819073_100000210303 [1,1,0,0,0,0|2,0,0]=4 5492 B12R1.382 CCCSc1cncc(c1)NC 62a_100000210303_100012184536 [1,1,0,0,0,0|2,0,0]=4 5493 B12R1.382 CCCSc1cncc(c1)NC 62a_100012184536_100000210303 [1,1,0,0,0,0|2,0,0]=4 5494 B12R1.382 CCCSc1cncc(c1)OC 62a_100000050176_100000210303 [1,1,0,0,0,0|1,0,0]=3 5495 B12R1.382 CCCSc1cncc(c1)OC 62a_100000210303_100000050176 [1,1,0,0,0,0|1,0,0]=3 5496 B12R1.382 CCCSc1cncc(c1)SC 62a_100000210303_100009816972 [1,1,0,0,0,0|1,1,0]=4 5497 B12R1.382 CCCSc1cncc(c1)SC 62a_100009816972_100000210303 [1,1,0,0,0,0|1,1,0]=4 5498 B12R1.382 CCCSc1cncc(n1)OC 62a_100000210303_100000756030 [1,1,0,0,0,0|2,0,0]=4 5499 B12R1.382 CCCSc1cncc(n1)OC 62a_100000756030_100000210303 [1,1,0,0,0,0|2,0,0]=4 5500 B12R1.382 CCCSc1nccc(n1)OC 62a_100000182009_100000210303 [1,1,0,0,0,0|2,0,0]=4 5501 B12R1.382 CCCSc1nccc(n1)OC 62a_100000210303_100000182009 [1,1,0,0,0,0|2,0,0]=4 5502 B12R1.382 CCNCc1cc(ccn1)OC 207a_100015525214_100000087537 [1,1,0,0,0,0|1,0,0]=3 5503 B12R1.382 CCNCc1cc(ccn1)OC 2230a_100015525214_100000752681 [1,1,0,0,0,0|1,0,0]=3 5504 B12R1.382 CCNCc1cc(ccn1)OC 270004a_100015525214_100000087537 [1,1,0,0,0,0|1,0,0]=3 5505 B12R1.382 CCNCc1cccc(c1)C#N 207a_100015525214_100000241001 [1,1,0,0,0,0|2,0,0]=4 5506 B12R1.382 CCNCc1cccc(c1)C#N 2230a_100015525214_100000233786 [1,1,0,0,0,0|2,0,0]=4 5507 B12R1.382 CCNCc1cccc(c1)C#N 270004a_100015525214_100000241001 [1,1,0,0,0,0|2,0,0]=4 5508 B12R1.382 CCNCc1cccc(c1)C#N 34a_100000755147_100000210202 [1,1,0,0,0,0|2,0,0]=4 5509 B12R1.382 CCNCc1cccc(c1)C=O 2230a_100015525214_100009816774 [1,1,0,0,0,0|2,0,0]=4 5510 B12R1.382 CCNCc1cccc(c1)CC 207a_100015525214_100011999841 [1,1,0,0,0,0|1,0,0]=3 5511 B12R1.382 CCNCc1cccc(c1)CC 270004a_100015525214_100011999841 [1,1,0,0,0,0|1,0,0]=3 5512 B12R1.382 CCNCc1cccc(c1)CO 207a_100015525214_200000050894 [1,1,0,0,0,0|2,0,0]=4 5513 B12R1.382 CCNCc1cccc(c1)CO 2230a_100011269909_100000210202 [1,1,0,0,0,0|2,0,0]=4 5514 B12R1.382 CCNCc1cccc(c1)CO 2230a_100015525214_100010188025 [1,1,0,0,0,0|2,0,0]=4 5515 B12R1.382 CCNCc1cccc(c1)CO 270004a_100015525214_200000050894 [1,1,0,0,0,0|2,0,0]=4 5516 B12R1.382 CCNCc1cccc(c1)CO 34a_100011269909_100000210202 [1,1,0,0,0,0|2,0,0]=4 5517 B12R1.382 CCNCc1cccc(c1)OC 207a_100015525214_100000170238 [1,1,0,0,0,0|0,0,0]=2 5518 B12R1.382 CCNCc1cccc(c1)OC 2230a_100000174954_100000210202 [1,1,0,0,0,0|0,0,0]=2 5519 B12R1.382 CCNCc1cccc(c1)OC 2230a_100015525214_100000211672 [1,1,0,0,0,0|0,0,0]=2 5520 B12R1.382 CCNCc1cccc(c1)OC 270004a_100015525214_100000170238 [1,1,0,0,0,0|0,0,0]=2 5521 B12R1.382 CCNCc1cccc(c1)OC 34a_100000174954_100000210202 [1,1,0,0,0,0|0,0,0]=2 5522 B12R1.382 CCNCc1cccc(c1)OC 34a_100000201218_200000210301 [1,1,0,0,0,0|0,0,0]=2 5523 B12R1.382 CCNCc1cccc(c1)O[13CH3] 34a_100000201218_200025704644 [1,1,0,0,0,0|0,0,0]=2 5524 B12R1.382 CCNCc1cccc(c1)SC 207a_100015525214_100011935093 [1,1,0,0,0,0|0,1,0]=3 5525 B12R1.382 CCNCc1cccc(c1)SC 270004a_100015525214_100011935093 [1,1,0,0,0,0|0,1,0]=3 5526 B12R1.382 CCNCc1cccc(c1)SC 62a_100000187426_200000210301 [1,1,0,0,0,0|0,1,0]=3 5527 B12R1.382 CCNCc1cccc(c1)SC 62a_200000210301_100000187426 [1,1,0,0,0,0|0,1,0]=3 5528 B12R1.382 CCNCc1cccc(c1)S[13CH3] 62a_100000187426_200025704644 [1,1,0,0,0,0|0,1,0]=3 5529 B12R1.382 CCNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187426 [1,1,0,0,0,0|0,1,0]=3 5530 B12R1.382 CCNCc1cccc(n1)OC 207a_100015525214_100000694346 [1,1,0,0,0,0|1,0,0]=3 5531 B12R1.382 CCNCc1cccc(n1)OC 2230a_100000746380_100000210202 [1,1,0,0,0,0|1,0,0]=3 5532 B12R1.382 CCNCc1cccc(n1)OC 2230a_100015525214_100000755263 [1,1,0,0,0,0|1,0,0]=3 5533 B12R1.382 CCNCc1cccc(n1)OC 270004a_100015525214_100000694346 [1,1,0,0,0,0|1,0,0]=3 5534 B12R1.382 CCNCc1ccnc(c1)OC 207a_100015525214_100000050969 [1,1,0,0,0,0|1,0,0]=3 5535 B12R1.382 CCNCc1ccnc(c1)OC 2230a_100015525214_100103152439 [1,1,0,0,0,0|1,0,0]=3 5536 B12R1.382 CCNCc1ccnc(c1)OC 270004a_100015525214_100000050969 [1,1,0,0,0,0|1,0,0]=3 5537 B12R1.382 CCNCc1cncc(c1)OC 207a_100015525214_100011361638 [1,1,0,0,0,0|1,0,0]=3 5538 B12R1.382 CCNCc1cncc(c1)OC 2230a_100020589029_100000210202 [1,1,0,0,0,0|1,0,0]=3 5539 B12R1.382 CCNCc1cncc(c1)OC 270004a_100015525214_100011361638 [1,1,0,0,0,0|1,0,0]=3 5540 B12R1.382 CCNCc1cncc(c1)OC 34a_100020589029_100000210202 [1,1,0,0,0,0|1,0,0]=3 5541 B12R1.382 CCOCc1cc(ccn1)OC 34a_100000749536_100000210202 [1,1,0,0,0,0|1,0,0]=3 5542 B12R1.382 CCOCc1cc(ccn1)OC 34a_100121572206_100000752681 [1,1,0,0,0,0|1,0,0]=3 5543 B12R1.382 CCOCc1cccc(c1)C#N 34a_100000753308_100000210202 [1,1,0,0,0,0|2,0,0]=4 5544 B12R1.382 CCOCc1cccc(c1)C#N 34a_100121572206_100000233786 [1,1,0,0,0,0|2,0,0]=4 5545 B12R1.382 CCOCc1cccc(c1)C#N 7a_100000753308_100000210202 [1,1,0,0,0,0|2,0,0]=4 5546 B12R1.382 CCOCc1cccc(c1)C=O 34a_100121572206_100009816774 [1,1,0,0,0,0|2,0,0]=4 5547 B12R1.382 CCOCc1cccc(c1)CBr 34a_100010188025_100000210202 [1,1,0,0,0,0|2,0,0]=4 5548 B12R1.382 CCOCc1cccc(c1)CBr 7a_100010188025_100000210202 [1,1,0,0,0,0|2,0,0]=4 5549 B12R1.382 CCOCc1cccc(c1)CCl 34a_200000090956_100000210202 [1,1,0,0,0,0|2,0,0]=4 5550 B12R1.382 CCOCc1cccc(c1)CCl 7a_200000090956_100000210202 [1,1,0,0,0,0|2,0,0]=4 5551 B12R1.382 CCOCc1cccc(c1)CN 34a_100011269909_100000210202 [1,1,0,0,0,0|2,0,0]=4 5552 B12R1.382 CCOCc1cccc(c1)CO 34a_100121572206_100010188025 [1,1,0,0,0,0|2,0,0]=4 5553 B12R1.382 CCOCc1cccc(c1)OC 34a_100000198976_100000210202 [1,1,0,0,0,0|0,0,0]=2 5554 B12R1.382 CCOCc1cccc(c1)OC 34a_100121572206_100000688526 [1,1,0,0,0,0|0,0,0]=2 5555 B12R1.382 CCOCc1cccc(c1)SC 62a_100011493694_200000210301 [1,1,0,0,0,0|0,1,0]=3 5556 B12R1.382 CCOCc1cccc(c1)SC 62a_200000210301_100011493694 [1,1,0,0,0,0|0,1,0]=3 5557 B12R1.382 CCOCc1cccc(c1)S[13CH3] 62a_100011493694_200025704644 [1,1,0,0,0,0|0,1,0]=3 5558 B12R1.382 CCOCc1cccc(c1)S[13CH3] 62a_200025704644_100011493694 [1,1,0,0,0,0|0,1,0]=3 5559 B12R1.382 CCOCc1cccc(n1)OC 34a_100121572206_100000755263 [1,1,0,0,0,0|1,0,0]=3 5560 B12R1.382 CCOCc1ccnc(c1)OC 34a_100121572206_100103152439 [1,1,0,0,0,0|1,0,0]=3 5561 B12R1.382 CCOCc1cncc(c1)OC 34a_100000732071_100000210202 [1,1,0,0,0,0|1,0,0]=3 5562 B12R1.382 CCSCc1cc(ccn1)OC 62a_100000210202_100000752681 [1,1,0,0,0,0|1,0,0]=3 5563 B12R1.382 CCSCc1cc(ccn1)OC 62a_100000752681_100000210202 [1,1,0,0,0,0|1,0,0]=3 5564 B12R1.382 CCSCc1cccc(c1)C#N 62a_100000210202_100000233786 [1,1,0,0,0,0|2,0,0]=4 5565 B12R1.382 CCSCc1cccc(c1)C=O 62a_100000210202_100009816774 [1,1,0,0,0,0|2,0,0]=4 5566 B12R1.382 CCSCc1cccc(c1)C=O 62a_100009816774_100000210202 [1,1,0,0,0,0|2,0,0]=4 5567 B12R1.382 CCSCc1cccc(c1)CO 62a_100000210202_100010188025 [1,1,0,0,0,0|2,0,0]=4 5568 B12R1.382 CCSCc1cccc(c1)CO 62a_100010188025_100000210202 [1,1,0,0,0,0|2,0,0]=4 5569 B12R1.382 CCSCc1cccc(c1)OC 62a_100000210202_100000211672 [1,1,0,0,0,0|0,0,0]=2 5570 B12R1.382 CCSCc1cccc(c1)OC 62a_100000688526_100000210202 [1,1,0,0,0,0|0,0,0]=2 5571 B12R1.382 CCSCc1cccc(n1)OC 62a_100000210202_100000755263 [1,1,0,0,0,0|1,0,0]=3 5572 B12R1.382 CCSCc1cccc(n1)OC 62a_100000755263_100000210202 [1,1,0,0,0,0|1,0,0]=3 5573 B12R1.382 CCSCc1ccnc(c1)OC 62a_100000210202_100103152439 [1,1,0,0,0,0|1,0,0]=3 5574 B12R1.382 CCSCc1ccnc(c1)OC 62a_100103152439_100000210202 [1,1,0,0,0,0|1,0,0]=3 5575 B12R1.382 CCc1cccc(c1)NCCF 2230a_100000211250_100011217306 [1,1,0,0,0,0|2,0,0]=4 5576 B12R1.382 CCc1cccc(c1)NCCF 34a_100000211250_100011217306 [1,1,0,0,0,0|2,0,0]=4 5577 B12R1.382 CCc1cccc(c1)NCCF 7a_100000211250_100011217306 [1,1,0,0,0,0|2,0,0]=4 5578 B12R1.382 CCc1cccc(c1)NCCO 2230a_100000211250_100000211926 [1,1,0,0,0,0|2,0,0]=4 5579 B12R1.382 CCc1cccc(c1)NCCO 34a_100000211250_100000211926 [1,1,0,0,0,0|2,0,0]=4 5580 B12R1.382 CCc1cccc(c1)NCCO 7a_100000211250_100000211926 [1,1,0,0,0,0|2,0,0]=4 5581 B12R1.382 CCc1cccc(c1)NCOC 2230a_100000211250_100000766300 [1,1,0,0,0,0|2,0,0]=4 5582 B12R1.382 CCc1cccc(c1)NCSC 2230a_100000211250_100011218213 [1,1,0,0,0,0|2,0,0]=4 5583 B12R1.382 CCc1cccc(c1)NCSC 34a_100000211250_100011218213 [1,1,0,0,0,0|2,0,0]=4 5584 B12R1.382 CCc1cccc(c1)OCCF 34a_100000211550_100011217306 [1,1,0,0,0,0|2,0,0]=4 5585 B12R1.382 CCc1cccc(c1)OCCF 7a_100000211550_100011217306 [1,1,0,0,0,0|2,0,0]=4 5586 B12R1.382 CCc1cccc(c1)OCCO 34a_100000211550_100000211926 [1,1,0,0,0,0|2,0,0]=4 5587 B12R1.382 CCc1cccc(c1)OCCO 7a_100000211550_100000211926 [1,1,0,0,0,0|2,0,0]=4 5588 B12R1.382 CCc1cccc(c1)OCSC 34a_100000211550_100011218213 [1,1,0,0,0,0|2,0,0]=4 5589 B12R1.382 CCc1cccc(c1)SCCF 62a_100011217306_100011263222 [1,1,0,0,0,0|2,0,0]=4 5590 B12R1.382 CCc1cccc(c1)SCCF 62a_100011263222_100011217306 [1,1,0,0,0,0|2,0,0]=4 5591 B12R1.382 CCc1cccc(c1)SCCO 62a_100000211926_100011263222 [1,1,0,0,0,0|2,0,0]=4 5592 B12R1.382 CCc1cccc(c1)SCCO 62a_100011263222_100000211926 [1,1,0,0,0,0|2,0,0]=4 5593 B12R1.382 CCc1cccc(c1)SCOC 62a_100000766300_100011263222 [1,1,0,0,0,0|2,0,0]=4 5594 B12R1.382 CCc1cccc(c1)SCOC 62a_100011263222_100000766300 [1,1,0,0,0,0|2,0,0]=4 5595 B12R1.382 CCc1cccc(c1)SCSC 62a_100011218213_100011263222 [1,1,0,0,0,0|2,0,0]=4 5596 B12R1.382 CCc1cccc(c1)SCSC 62a_100011263222_100011218213 [1,1,0,0,0,0|2,0,0]=4 5597 B12R1.382 CNCCc1cccc(c1)OC 2230a_100000740386_200000210301 [1,1,0,0,0,0|0,0,0]=2 5598 B12R1.382 CNCCc1cccc(c1)OC 2230a_106832991635_100011713679 [1,1,0,0,0,0|0,0,0]=2 5599 B12R1.382 CNCCc1cccc(c1)OC 34a_100000740386_200000210301 [1,1,0,0,0,0|0,0,0]=2 5600 B12R1.382 CNCCc1cccc(c1)OC 34a_100102657272_100011713679 [1,1,0,0,0,0|0,0,0]=2 5601 B12R1.382 CNCCc1cccc(c1)OC 7a_106832991635_100011713679 [1,1,0,0,0,0|0,0,0]=2 5602 B12R1.382 CNc1cccc(c1)CCCO 2230a_200000698965_200000210301 [1,1,0,0,0,0|1,0,0]=3 5603 B12R1.382 CNc1cccc(c1)CCCO 34a_200000698965_200000210301 [1,1,0,0,0,0|1,0,0]=3 5604 B12R1.382 CNc1cccc(c1)CCCO 7a_200000698965_200000210301 [1,1,0,0,0,0|1,0,0]=3 5605 B12R1.382 CNc1cccc(c1)OCCF 34a_100000756613_100011217306 [1,1,0,0,0,0|2,0,0]=4 5606 B12R1.382 CNc1cccc(c1)OCCF 7a_100000756613_100011217306 [1,1,0,0,0,0|2,0,0]=4 5607 B12R1.382 CNc1cccc(c1)OCCO 2230a_100011232151_200000210301 [1,1,0,0,0,0|2,0,0]=4 5608 B12R1.382 CNc1cccc(c1)OCCO 34a_100000756613_100000211926 [1,1,0,0,0,0|2,0,0]=4 5609 B12R1.382 CNc1cccc(c1)OCCO 34a_100011232151_200000210301 [1,1,0,0,0,0|2,0,0]=4 5610 B12R1.382 CNc1cccc(c1)OCCO 7a_100000756613_100000211926 [1,1,0,0,0,0|2,0,0]=4 5611 B12R1.382 CNc1cccc(c1)OCOC 34a_100012265470_200000210301 [1,1,0,0,0,0|2,0,0]=4 5612 B12R1.382 CNc1cccc(c1)OCSC 34a_100000756613_100011218213 [1,1,0,0,0,0|2,0,0]=4 5613 B12R1.382 CNc1cccc(c1)SCCF 62a_100000219648_100011217306 [1,1,0,0,0,0|2,0,0]=4 5614 B12R1.382 CNc1cccc(c1)SCCF 62a_100011217306_100000219648 [1,1,0,0,0,0|2,0,0]=4 5615 B12R1.382 CNc1cccc(c1)SCCO 62a_100000211926_100000219648 [1,1,0,0,0,0|2,0,0]=4 5616 B12R1.382 CNc1cccc(c1)SCCO 62a_100000219648_100000211926 [1,1,0,0,0,0|2,0,0]=4 5617 B12R1.382 CNc1cccc(c1)SCOC 62a_100000219648_100000766300 [1,1,0,0,0,0|2,0,0]=4 5618 B12R1.382 CNc1cccc(c1)SCOC 62a_100000766300_100000219648 [1,1,0,0,0,0|2,0,0]=4 5619 B12R1.382 CNc1cccc(c1)SCSC 62a_100000219648_100011218213 [1,1,0,0,0,0|2,0,0]=4 5620 B12R1.382 CNc1cccc(c1)SCSC 62a_100011218213_100000219648 [1,1,0,0,0,0|2,0,0]=4 5621 B12R1.382 COCCc1cccc(c1)C#N 34a_100012001419_200000210301 [1,1,0,0,0,0|2,0,0]=4 5622 B12R1.382 COCCc1cccc(c1)C#N 7a_100012001419_200000210301 [1,1,0,0,0,0|2,0,0]=4 5623 B12R1.382 COCCc1cccc(c1)OC 34a_100011215300_200000210301 [1,1,0,0,0,0|0,0,0]=2 5624 B12R1.382 COCCc1cccc(c1)OC 34a_100138415774_100011713679 [1,1,0,0,0,0|0,0,0]=2 5625 B12R1.382 COCCc1cccc(c1)OC 7a_100011215300_200000210301 [1,1,0,0,0,0|0,0,0]=2 5626 B12R1.382 COCNc1cccc(c1)SC 2230a_100000210049_100000766300 [1,1,0,0,0,0|1,1,0]=4 5627 B12R1.382 COCOc1cccc(c1)N[13CH3] 34a_100012265470_200025704644 [1,1,0,0,0,0|2,0,0]=4 5628 B12R1.382 COCOc1cccc(c1)SC 62a_100012265688_200000210301 [1,1,0,0,0,0|1,1,0]=4 5629 B12R1.382 COCOc1cccc(c1)SC 62a_200000210301_100012265688 [1,1,0,0,0,0|1,1,0]=4 5630 B12R1.382 COCOc1cccc(c1)S[13CH3] 62a_100012265688_200025704644 [1,1,0,0,0,0|1,1,0]=4 5631 B12R1.382 COCOc1cccc(c1)S[13CH3] 62a_200025704644_100012265688 [1,1,0,0,0,0|1,1,0]=4 5632 B12R1.382 COCSc1cc(ccn1)OC 62a_100000766300_100011216251 [1,1,0,0,0,0|2,0,0]=4 5633 B12R1.382 COCSc1cc(ccn1)OC 62a_100009817693_100000766300 [1,1,0,0,0,0|2,0,0]=4 5634 B12R1.382 COCSc1cccc(c1)OC 62a_100000766300_100000170001 [1,1,0,0,0,0|1,0,0]=3 5635 B12R1.382 COCSc1cccc(c1)SC 62a_100000766300_100011215954 [1,1,0,0,0,0|1,1,0]=4 5636 B12R1.382 COCSc1cccc(c1)SC 62a_100011215954_100000766300 [1,1,0,0,0,0|1,1,0]=4 5637 B12R1.382 COCSc1cccc(n1)OC 62a_100000760917_100000766300 [1,1,0,0,0,0|2,0,0]=4 5638 B12R1.382 COCSc1cccc(n1)OC 62a_100000766300_100000760917 [1,1,0,0,0,0|2,0,0]=4 5639 B12R1.382 COCSc1ccnc(c1)OC 62a_100000117307_100000766300 [1,1,0,0,0,0|2,0,0]=4 5640 B12R1.382 COCSc1ccnc(c1)OC 62a_100000766300_100000117307 [1,1,0,0,0,0|2,0,0]=4 5641 B12R1.382 COCSc1cncc(c1)OC 62a_100000050176_100000766300 [1,1,0,0,0,0|2,0,0]=4 5642 B12R1.382 COCSc1cncc(c1)OC 62a_100000766300_100000050176 [1,1,0,0,0,0|2,0,0]=4 5643 B12R1.382 COc1cc(ccn1)CSCF 62a_100015361967_100103152439 [1,1,0,0,0,0|2,0,0]=4 5644 B12R1.382 COc1cc(ccn1)CSCF 62a_100103152439_100015361967 [1,1,0,0,0,0|2,0,0]=4 5645 B12R1.382 COc1cc(ccn1)OCCF 34a_100012181050_100011217306 [1,1,0,0,0,0|2,0,0]=4 5646 B12R1.382 COc1cc(ccn1)OCCO 34a_100012181050_100000211926 [1,1,0,0,0,0|2,0,0]=4 5647 B12R1.382 COc1cc(ccn1)OCSC 34a_100012181050_100011218213 [1,1,0,0,0,0|2,0,0]=4 5648 B12R1.382 COc1cc(ccn1)SCCF 62a_100000117307_100011217306 [1,1,0,0,0,0|2,0,0]=4 5649 B12R1.382 COc1cc(ccn1)SCCF 62a_100011217306_100000117307 [1,1,0,0,0,0|2,0,0]=4 5650 B12R1.382 COc1cc(ccn1)SCCO 62a_100000117307_100000211926 [1,1,0,0,0,0|2,0,0]=4 5651 B12R1.382 COc1cc(ccn1)SCCO 62a_100000211926_100000117307 [1,1,0,0,0,0|2,0,0]=4 5652 B12R1.382 COc1cc(ccn1)SCSC 62a_100000117307_100011218213 [1,1,0,0,0,0|2,0,0]=4 5653 B12R1.382 COc1cc(ccn1)SCSC 62a_100011218213_100000117307 [1,1,0,0,0,0|2,0,0]=4 5654 B12R1.382 COc1cccc(c1)CCCO 34a_200011999501_200000210301 [1,1,0,0,0,0|0,0,0]=2 5655 B12R1.382 COc1cccc(c1)CCCO 7a_200011999501_200000210301 [1,1,0,0,0,0|0,0,0]=2 5656 B12R1.382 COc1cccc(c1)CCN[13CH3] 2230a_100000740386_200025704644 [1,1,0,0,0,0|0,0,0]=2 5657 B12R1.382 COc1cccc(c1)CCN[13CH3] 34a_100000740386_200025704644 [1,1,0,0,0,0|0,0,0]=2 5658 B12R1.382 COc1cccc(c1)CCO[13CH3] 34a_100011215300_200025704644 [1,1,0,0,0,0|0,0,0]=2 5659 B12R1.382 COc1cccc(c1)CCO[13CH3] 7a_100011215300_200025704644 [1,1,0,0,0,0|0,0,0]=2 5660 B12R1.382 COc1cccc(c1)CCSC 62a_100011713679_200000210301 [1,1,0,0,0,0|0,0,0]=2 5661 B12R1.382 COc1cccc(c1)CCSC 62a_200000210301_100011713679 [1,1,0,0,0,0|0,0,0]=2 5662 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_100011713679_200025704644 [1,1,0,0,0,0|0,0,0]=2 5663 B12R1.382 COc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713679 [1,1,0,0,0,0|0,0,0]=2 5664 B12R1.382 COc1cccc(c1)CNCF 34a_100000174954_100015361967 [1,1,0,0,0,0|1,0,0]=3 5665 B12R1.382 COc1cccc(c1)COCF 34a_100000198976_100015361967 [1,1,0,0,0,0|1,0,0]=3 5666 B12R1.382 COc1cccc(c1)CSCF 62a_100000688526_100015361967 [1,1,0,0,0,0|1,0,0]=3 5667 B12R1.382 COc1cccc(c1)CSCF 62a_100015361967_100000211672 [1,1,0,0,0,0|1,0,0]=3 5668 B12R1.382 COc1cccc(c1)NCC=O 34a_100000210024_200009817547 [1,1,0,0,0,0|1,0,1]=4 5669 B12R1.382 COc1cccc(c1)NCCF 34a_100000210024_100011217306 [1,1,0,0,0,0|1,0,0]=3 5670 B12R1.382 COc1cccc(c1)NCCO 34a_100000210024_100000211926 [1,1,0,0,0,0|1,0,0]=3 5671 B12R1.382 COc1cccc(c1)NCSC 34a_100000210024_100011218213 [1,1,0,0,0,0|1,0,0]=3 5672 B12R1.382 COc1cccc(c1)OCC#N 7a_100000211255_100011215382 [1,1,0,0,0,0|1,0,1]=4 5673 B12R1.382 COc1cccc(c1)OCC=O 34a_100000211255_200009817547 [1,1,0,0,0,0|1,0,1]=4 5674 B12R1.382 COc1cccc(c1)OCC=O 7a_100000211255_200015260668 [1,1,0,0,0,0|1,0,1]=4 5675 B12R1.382 COc1cccc(c1)OCCF 34a_100000211255_100011217306 [1,1,0,0,0,0|1,0,0]=3 5676 B12R1.382 COc1cccc(c1)OCCF 7a_100000211255_100011217306 [1,1,0,0,0,0|1,0,0]=3 5677 B12R1.382 COc1cccc(c1)OCCO 34a_100000211255_100000211926 [1,1,0,0,0,0|1,0,0]=3 5678 B12R1.382 COc1cccc(c1)OCCO 7a_100000211255_100000211926 [1,1,0,0,0,0|1,0,0]=3 5679 B12R1.382 COc1cccc(c1)OCSC 34a_100000211255_100011218213 [1,1,0,0,0,0|1,0,0]=3 5680 B12R1.382 COc1cccc(c1)SCC#N 62a_100011215382_100000170001 [1,1,0,0,0,0|1,0,1]=4 5681 B12R1.382 COc1cccc(c1)SCC=O 62a_200015260668_100000170001 [1,1,0,0,0,0|1,0,1]=4 5682 B12R1.382 COc1cccc(c1)SCCF 62a_100011217306_100000170001 [1,1,0,0,0,0|1,0,0]=3 5683 B12R1.382 COc1cccc(c1)SCCO 62a_100000211926_100000170001 [1,1,0,0,0,0|1,0,0]=3 5684 B12R1.382 COc1cccc(c1)SCSC 62a_100011218213_100000170001 [1,1,0,0,0,0|1,0,0]=3 5685 B12R1.382 COc1cccc(n1)CSCF 62a_100000755263_100015361967 [1,1,0,0,0,0|2,0,0]=4 5686 B12R1.382 COc1cccc(n1)CSCF 62a_100015361967_100000755263 [1,1,0,0,0,0|2,0,0]=4 5687 B12R1.382 COc1cccc(n1)SCCF 62a_100000760917_100011217306 [1,1,0,0,0,0|2,0,0]=4 5688 B12R1.382 COc1cccc(n1)SCCF 62a_100011217306_100000760917 [1,1,0,0,0,0|2,0,0]=4 5689 B12R1.382 COc1cccc(n1)SCCO 62a_100000211926_100000760917 [1,1,0,0,0,0|2,0,0]=4 5690 B12R1.382 COc1cccc(n1)SCCO 62a_100000760917_100000211926 [1,1,0,0,0,0|2,0,0]=4 5691 B12R1.382 COc1cccc(n1)SCSC 62a_100000760917_100011218213 [1,1,0,0,0,0|2,0,0]=4 5692 B12R1.382 COc1cccc(n1)SCSC 62a_100011218213_100000760917 [1,1,0,0,0,0|2,0,0]=4 5693 B12R1.382 COc1ccnc(c1)COCF 34a_100000749536_100015361967 [1,1,0,0,0,0|2,0,0]=4 5694 B12R1.382 COc1ccnc(c1)CSCF 62a_100000752681_100015361967 [1,1,0,0,0,0|2,0,0]=4 5695 B12R1.382 COc1ccnc(c1)CSCF 62a_100015361967_100000752681 [1,1,0,0,0,0|2,0,0]=4 5696 B12R1.382 COc1ccnc(c1)SCCF 62a_100009817693_100011217306 [1,1,0,0,0,0|2,0,0]=4 5697 B12R1.382 COc1ccnc(c1)SCCF 62a_100011217306_100011216251 [1,1,0,0,0,0|2,0,0]=4 5698 B12R1.382 COc1ccnc(c1)SCCO 62a_100000211926_100011216251 [1,1,0,0,0,0|2,0,0]=4 5699 B12R1.382 COc1ccnc(c1)SCCO 62a_100009817693_100000211926 [1,1,0,0,0,0|2,0,0]=4 5700 B12R1.382 COc1ccnc(c1)SCSC 62a_100009817693_100011218213 [1,1,0,0,0,0|2,0,0]=4 5701 B12R1.382 COc1ccnc(c1)SCSC 62a_100011218213_100011216251 [1,1,0,0,0,0|2,0,0]=4 5702 B12R1.382 COc1cncc(c1)CNCF 34a_100020589029_100015361967 [1,1,0,0,0,0|2,0,0]=4 5703 B12R1.382 COc1cncc(c1)COCF 34a_100000732071_100015361967 [1,1,0,0,0,0|2,0,0]=4 5704 B12R1.382 COc1cncc(c1)OCCF 34a_100000084572_100011217306 [1,1,0,0,0,0|2,0,0]=4 5705 B12R1.382 COc1cncc(c1)OCCF 7a_100000084572_100011217306 [1,1,0,0,0,0|2,0,0]=4 5706 B12R1.382 COc1cncc(c1)OCCO 34a_100000084572_100000211926 [1,1,0,0,0,0|2,0,0]=4 5707 B12R1.382 COc1cncc(c1)OCCO 7a_100000084572_100000211926 [1,1,0,0,0,0|2,0,0]=4 5708 B12R1.382 COc1cncc(c1)OCSC 34a_100000084572_100011218213 [1,1,0,0,0,0|2,0,0]=4 5709 B12R1.382 COc1cncc(c1)SCCF 62a_100000050176_100011217306 [1,1,0,0,0,0|2,0,0]=4 5710 B12R1.382 COc1cncc(c1)SCCF 62a_100011217306_100000050176 [1,1,0,0,0,0|2,0,0]=4 5711 B12R1.382 COc1cncc(c1)SCCO 62a_100000050176_100000211926 [1,1,0,0,0,0|2,0,0]=4 5712 B12R1.382 COc1cncc(c1)SCCO 62a_100000211926_100000050176 [1,1,0,0,0,0|2,0,0]=4 5713 B12R1.382 COc1cncc(c1)SCSC 62a_100000050176_100011218213 [1,1,0,0,0,0|2,0,0]=4 5714 B12R1.382 COc1cncc(c1)SCSC 62a_100011218213_100000050176 [1,1,0,0,0,0|2,0,0]=4 5715 B12R1.382 CSCNc1cccc(c1)SC 2230a_100000210049_100011218213 [1,1,0,0,0,0|1,1,0]=4 5716 B12R1.382 CSCNc1cccc(c1)SC 34a_100000210049_100011218213 [1,1,0,0,0,0|1,1,0]=4 5717 B12R1.382 CSCOc1cccc(c1)SC 34a_100011265683_100011218213 [1,1,0,0,0,0|1,1,0]=4 5718 B12R1.382 CSCSc1cccc(c1)SC 62a_100011215954_100011218213 [1,1,0,0,0,0|1,1,0]=4 5719 B12R1.382 CSCSc1cccc(c1)SC 62a_100011218213_100011215954 [1,1,0,0,0,0|1,1,0]=4 5720 B12R1.382 CSc1cccc(c1)CCC#N 62a_100011219771_200000210301 [1,1,0,0,0,0|0,1,1]=4 5721 B12R1.382 CSc1cccc(c1)CCC#N 62a_200000210301_100011219771 [1,1,0,0,0,0|0,1,1]=4 5722 B12R1.382 CSc1cccc(c1)CCCN 62a_100000753791_200000210301 [1,1,0,0,0,0|0,1,0]=3 5723 B12R1.382 CSc1cccc(c1)CCCN 62a_200000210301_100000753791 [1,1,0,0,0,0|0,1,0]=3 5724 B12R1.382 CSc1cccc(c1)CCCO 62a_100011709248_200000210301 [1,1,0,0,0,0|0,1,0]=3 5725 B12R1.382 CSc1cccc(c1)CCCO 62a_200000210301_100011709248 [1,1,0,0,0,0|0,1,0]=3 5726 B12R1.382 CSc1cccc(c1)NCCF 2230a_100000210049_100011217306 [1,1,0,0,0,0|1,1,0]=4 5727 B12R1.382 CSc1cccc(c1)NCCF 34a_100000210049_100011217306 [1,1,0,0,0,0|1,1,0]=4 5728 B12R1.382 CSc1cccc(c1)NCCO 2230a_100000210049_100000211926 [1,1,0,0,0,0|1,1,0]=4 5729 B12R1.382 CSc1cccc(c1)NCCO 34a_100000210049_100000211926 [1,1,0,0,0,0|1,1,0]=4 5730 B12R1.382 CSc1cccc(c1)OCCF 34a_100011265683_100011217306 [1,1,0,0,0,0|1,1,0]=4 5731 B12R1.382 CSc1cccc(c1)OCCF 7a_100011265683_100011217306 [1,1,0,0,0,0|1,1,0]=4 5732 B12R1.382 CSc1cccc(c1)OCCN 62a_100000743521_200000210301 [1,1,0,0,0,0|1,1,0]=4 5733 B12R1.382 CSc1cccc(c1)OCCN 62a_200000210301_100000743521 [1,1,0,0,0,0|1,1,0]=4 5734 B12R1.382 CSc1cccc(c1)OCCO 34a_100011265683_100000211926 [1,1,0,0,0,0|1,1,0]=4 5735 B12R1.382 CSc1cccc(c1)OCCO 62a_100000757546_200000210301 [1,1,0,0,0,0|1,1,0]=4 5736 B12R1.382 CSc1cccc(c1)OCCO 62a_200000210301_100000757546 [1,1,0,0,0,0|1,1,0]=4 5737 B12R1.382 CSc1cccc(c1)OCCO 7a_100011265683_100000211926 [1,1,0,0,0,0|1,1,0]=4 5738 B12R1.382 CSc1cccc(c1)SCCF 62a_100011215954_100011217306 [1,1,0,0,0,0|1,1,0]=4 5739 B12R1.382 CSc1cccc(c1)SCCF 62a_100011217306_100011215954 [1,1,0,0,0,0|1,1,0]=4 5740 B12R1.382 CSc1cccc(c1)SCCO 62a_100000211926_100011215954 [1,1,0,0,0,0|1,1,0]=4 5741 B12R1.382 CSc1cccc(c1)SCCO 62a_100011215954_100000211926 [1,1,0,0,0,0|1,1,0]=4 5742 B12R1.382 CSc1cccc(c1)SCCO 62a_200000210301_200011756134 [1,1,0,0,0,0|1,1,0]=4 5743 B12R1.382 CSc1cccc(c1)SCCO 62a_200011756134_200000210301 [1,1,0,0,0,0|1,1,0]=4 5744 B12R1.382 [13CH3]Nc1cccc(c1)CCCO 2230a_200000698965_200025704644 [1,1,0,0,0,0|1,0,0]=3 5745 B12R1.382 [13CH3]Nc1cccc(c1)CCCO 34a_200000698965_200025704644 [1,1,0,0,0,0|1,0,0]=3 5746 B12R1.382 [13CH3]Nc1cccc(c1)CCCO 7a_200000698965_200025704644 [1,1,0,0,0,0|1,0,0]=3 5747 B12R1.382 [13CH3]Nc1cccc(c1)OCCO 2230a_100011232151_200025704644 [1,1,0,0,0,0|2,0,0]=4 5748 B12R1.382 [13CH3]Nc1cccc(c1)OCCO 34a_100011232151_200025704644 [1,1,0,0,0,0|2,0,0]=4 5749 B12R1.382 [13CH3]OCCc1cccc(c1)C#N 34a_100012001419_200025704644 [1,1,0,0,0,0|2,0,0]=4 5750 B12R1.382 [13CH3]OCCc1cccc(c1)C#N 7a_100012001419_200025704644 [1,1,0,0,0,0|2,0,0]=4 5751 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 34a_200011999501_200025704644 [1,1,0,0,0,0|0,0,0]=2 5752 B12R1.382 [13CH3]Oc1cccc(c1)CCCO 7a_200011999501_200025704644 [1,1,0,0,0,0|0,0,0]=2 5753 B12R1.382 [13CH3]Sc1cccc(c1)CCC#N 62a_100011219771_200025704644 [1,1,0,0,0,0|0,1,1]=4 5754 B12R1.382 [13CH3]Sc1cccc(c1)CCC#N 62a_200025704644_100011219771 [1,1,0,0,0,0|0,1,1]=4 5755 B12R1.382 [13CH3]Sc1cccc(c1)CCCN 62a_100000753791_200025704644 [1,1,0,0,0,0|0,1,0]=3 5756 B12R1.382 [13CH3]Sc1cccc(c1)CCCN 62a_200025704644_100000753791 [1,1,0,0,0,0|0,1,0]=3 5757 B12R1.382 [13CH3]Sc1cccc(c1)CCCO 62a_100011709248_200025704644 [1,1,0,0,0,0|0,1,0]=3 5758 B12R1.382 [13CH3]Sc1cccc(c1)CCCO 62a_200025704644_100011709248 [1,1,0,0,0,0|0,1,0]=3 5759 B12R1.382 [13CH3]Sc1cccc(c1)OCCN 62a_100000743521_200025704644 [1,1,0,0,0,0|1,1,0]=4 5760 B12R1.382 [13CH3]Sc1cccc(c1)OCCN 62a_200025704644_100000743521 [1,1,0,0,0,0|1,1,0]=4 5761 B12R1.382 [13CH3]Sc1cccc(c1)OCCO 62a_100000757546_200025704644 [1,1,0,0,0,0|1,1,0]=4 5762 B12R1.382 [13CH3]Sc1cccc(c1)OCCO 62a_200025704644_100000757546 [1,1,0,0,0,0|1,1,0]=4 5763 B12R1.382 [13CH3]Sc1cccc(c1)SCCO 62a_200011756134_200025704644 [1,1,0,0,0,0|1,1,0]=4 5764 B12R1.382 [13CH3]Sc1cccc(c1)SCCO 62a_200025704644_200011756134 [1,1,0,0,0,0|1,1,0]=4 5765 B12R1.435 C=Cc1cccc(c1)C(O)CC 271570a_100011290941_200013212081 [1,1,0,0,0,0|1,0,1]=4 5766 B12R1.435 C=Cc1cccc(c1)[C@@H](N)CC 271570a_100011290941_100102422761 [1,1,0,0,0,0|1,0,1]=4 5767 B12R1.435 CCC(=O)c1cccc(c1)CC 1458a_100011933908_100000210202 [1,1,0,0,0,0|1,0,1]=4 5768 B12R1.435 CCC(=O)c1cccc(c1)OC 1458a_100000188888_100000210202 [1,1,0,0,0,0|0,0,1]=3 5769 B12R1.435 CCC(=O)c1cccc(c1)OC 34a_100011996911_200000210301 [1,1,0,0,0,0|0,0,1]=3 5770 B12R1.435 CCC(=O)c1cccc(c1)OC 7a_100011996911_200000210301 [1,1,0,0,0,0|0,0,1]=3 5771 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 34a_100011996911_200025704644 [1,1,0,0,0,0|0,0,1]=3 5772 B12R1.435 CCC(=O)c1cccc(c1)O[13CH3] 7a_100011996911_200025704644 [1,1,0,0,0,0|0,0,1]=3 5773 B12R1.435 CCC(=O)c1cccc(c1)SC 1458a_100011217804_100000210202 [1,1,0,0,0,0|0,1,1]=4 5774 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_100000211677_200000210301 [1,1,0,0,0,0|0,1,1]=4 5775 B12R1.435 CCC(=O)c1cccc(c1)SC 62a_200000210301_100000211677 [1,1,0,0,0,0|0,1,1]=4 5776 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_100000211677_200025704644 [1,1,0,0,0,0|0,1,1]=4 5777 B12R1.435 CCC(=O)c1cccc(c1)S[13CH3] 62a_200025704644_100000211677 [1,1,0,0,0,0|0,1,1]=4 5778 B12R1.435 CCC(N)c1cccc(c1)OC 34a_100159312145_200000210301 [1,1,0,0,0,0|0,0,0]=2 5779 B12R1.435 CCC(N)c1cccc(c1)O[13CH3] 34a_100159312145_200025704644 [1,1,0,0,0,0|0,0,0]=2 5780 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200000210301_200013212081 [1,1,0,0,0,0|0,1,0]=3 5781 B12R1.435 CCC(O)c1cccc(c1)SC 62a_200013212081_200000210301 [1,1,0,0,0,0|0,1,0]=3 5782 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200013212081_200025704644 [1,1,0,0,0,0|0,1,0]=3 5783 B12R1.435 CCC(O)c1cccc(c1)S[13CH3] 62a_200025704644_200013212081 [1,1,0,0,0,0|0,1,0]=3 5784 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219725_100000210202 [1,1,0,0,0,0|1,0,0]=3 5785 B12R1.435 CCN(C)c1cccc(c1)OC 2230a_100000219733_200000210301 [1,1,0,0,0,0|1,0,0]=3 5786 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219725_100000204670 [1,1,0,0,0,0|1,0,0]=3 5787 B12R1.435 CCN(C)c1cccc(c1)OC 269982a_100000219733_200000210301 [1,1,0,0,0,0|1,0,0]=3 5788 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219725_100000210202 [1,1,0,0,0,0|1,0,0]=3 5789 B12R1.435 CCN(C)c1cccc(c1)OC 34a_100000219733_200000210301 [1,1,0,0,0,0|1,0,0]=3 5790 B12R1.435 CCN(C)c1cccc(c1)SC 2230a_100020672454_100000210202 [1,1,0,0,0,0|1,1,0]=4 5791 B12R1.435 CCN(C)c1cccc(c1)SC 269982a_100020672454_100000204670 [1,1,0,0,0,0|1,1,0]=4 5792 B12R1.435 CCN(C)c1cccc(c1)SC 34a_100020672454_100000210202 [1,1,0,0,0,0|1,1,0]=4 5793 B12R1.435 CCN([13CH3])c1cccc(c1)OC 2230a_100000219733_200025704644 [1,1,0,0,0,0|1,0,0]=3 5794 B12R1.435 CCN([13CH3])c1cccc(c1)OC 269982a_100000219733_200025704644 [1,1,0,0,0,0|1,0,0]=3 5795 B12R1.435 CCN([13CH3])c1cccc(c1)OC 34a_100000219733_200025704644 [1,1,0,0,0,0|1,0,0]=3 5796 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_100102422761_200000210301 [1,1,0,0,0,0|0,1,0]=3 5797 B12R1.435 CC[C@H](N)c1cccc(c1)SC 62a_200000210301_100102422761 [1,1,0,0,0,0|0,1,0]=3 5798 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_100102422761_200025704644 [1,1,0,0,0,0|0,1,0]=3 5799 B12R1.435 CC[C@H](N)c1cccc(c1)S[13CH3] 62a_200025704644_100102422761 [1,1,0,0,0,0|0,1,0]=3 5800 B12R1.435 CCc1cccc(c1)C(C)NC 269862a_106832991636_100011220055 [1,1,0,0,0,0|2,0,0]=4 5801 B12R1.435 CNC(=O)c1cccc(c1)OC 11a_106832991635_100000188888 [1,1,0,0,0,0|1,0,1]=4 5802 B12R1.435 CNC(=O)c1cccc(c1)OC 1626a_100102657272_100000188888 [1,1,0,0,0,0|1,0,1]=4 5803 B12R1.435 CNC(=O)c1cccc(c1)OC 240690a_100102657272_100000188888 [1,1,0,0,0,0|1,0,1]=4 5804 B12R1.435 CNC(=O)c1cccc(c1)OC 34a_100000159807_200000210301 [1,1,0,0,0,0|1,0,1]=4 5805 B12R1.435 CNC(=O)c1cccc(c1)OC 527a_100102657272_100000188888 [1,1,0,0,0,0|1,0,1]=4 5806 B12R1.435 CNC(=O)c1cccc(c1)OC 7a_100000159807_200000210301 [1,1,0,0,0,0|1,0,1]=4 5807 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 34a_100000159807_200025704644 [1,1,0,0,0,0|1,0,1]=4 5808 B12R1.435 CNC(=O)c1cccc(c1)O[13CH3] 7a_100000159807_200025704644 [1,1,0,0,0,0|1,0,1]=4 5809 B12R1.435 CNC(C)c1cc(ccn1)OC 2230a_100009966388_200000210301 [1,1,0,0,0,0|2,0,0]=4 5810 B12R1.435 CNC(C)c1cc(ccn1)OC 269862a_106832991636_100000099827 [1,1,0,0,0,0|2,0,0]=4 5811 B12R1.435 CNC(C)c1cc(ccn1)OC 270004a_106832991635_100000099827 [1,1,0,0,0,0|2,0,0]=4 5812 B12R1.435 CNC(C)c1cccc(c1)OC 2230a_100000737859_200000210301 [1,1,0,0,0,0|1,0,0]=3 5813 B12R1.435 CNC(C)c1cccc(c1)OC 269862a_106832991636_100000171656 [1,1,0,0,0,0|1,0,0]=3 5814 B12R1.435 CNC(C)c1cccc(c1)SC 62a_100025717457_200000210301 [1,1,0,0,0,0|1,1,0]=4 5815 B12R1.435 CNC(C)c1cccc(c1)SC 62a_200000210301_100025717457 [1,1,0,0,0,0|1,1,0]=4 5816 B12R1.435 CNC(C)c1cccc(c1)S[13CH3] 62a_100025717457_200025704644 [1,1,0,0,0,0|1,1,0]=4 5817 B12R1.435 CNC(C)c1cccc(c1)S[13CH3] 62a_200025704644_100025717457 [1,1,0,0,0,0|1,1,0]=4 5818 B12R1.435 CNC(C)c1cccc(n1)OC 269862a_106832991636_100000069440 [1,1,0,0,0,0|2,0,0]=4 5819 B12R1.435 CNC(C)c1ccnc(c1)OC 269862a_106832991636_100000708580 [1,1,0,0,0,0|2,0,0]=4 5820 B12R1.435 CNC(C)c1cncc(c1)OC 269862a_106832991636_200011998261 [1,1,0,0,0,0|2,0,0]=4 5821 B12R1.435 CN[C@@H](C)c1ccnc(c1)OC 2230a_100012186823_200000210301 [1,1,0,0,0,0|2,0,0]=4 5822 B12R1.435 CN[C@H](C)c1cccc(n1)OC 2230a_100016223015_200000210301 [1,1,0,0,0,0|2,0,0]=4 5823 B12R1.435 COC(=O)c1cccc(c1)OC 34a_100000150331_200000210301 [1,1,0,0,0,0|1,0,1]=4 5824 B12R1.435 COC(=O)c1cccc(c1)OC 7a_100000150331_200000210301 [1,1,0,0,0,0|1,0,1]=4 5825 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 34a_100000150331_200025704644 [1,1,0,0,0,0|1,0,1]=4 5826 B12R1.435 COC(=O)c1cccc(c1)O[13CH3] 7a_100000150331_200025704644 [1,1,0,0,0,0|1,0,1]=4 5827 B12R1.435 COc1cc(ccn1)[C@H](C)N[13CH3] 2230a_100012186823_200025704644 [1,1,0,0,0,0|2,0,0]=4 5828 B12R1.435 COc1cccc(c1)C(=O)CBr 7a_100009813753_200000210301 [1,1,0,0,0,0|1,0,1]=4 5829 B12R1.435 COc1cccc(c1)C(=O)CF 1458a_100000188888_100015361967 [1,1,0,0,0,0|1,0,1]=4 5830 B12R1.435 COc1cccc(c1)C(C)N[13CH3] 2230a_100000737859_200025704644 [1,1,0,0,0,0|1,0,0]=3 5831 B12R1.435 COc1cccc(c1)C(C)OC 34a_100000246466_200000210301 [1,1,0,0,0,0|1,0,0]=3 5832 B12R1.435 COc1cccc(c1)C(C)OC 7a_100000246466_200000210301 [1,1,0,0,0,0|1,0,0]=3 5833 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 34a_100000246466_200025704644 [1,1,0,0,0,0|1,0,0]=3 5834 B12R1.435 COc1cccc(c1)C(C)O[13CH3] 7a_100000246466_200025704644 [1,1,0,0,0,0|1,0,0]=3 5835 B12R1.435 COc1cccc(c1)C(N)CO 34a_100025717460_200000210301 [1,1,0,0,0,0|1,0,0]=3 5836 B12R1.435 COc1cccc(c1)C(O)CN 34a_100020657549_200000210301 [1,1,0,0,0,0|1,0,0]=3 5837 B12R1.435 COc1cccc(c1)N(C)CF 269982a_100000219725_100015361967 [1,1,0,0,0,0|2,0,0]=4 5838 B12R1.435 COc1cccc(c1)N(C)CF 34a_100000219725_100015361967 [1,1,0,0,0,0|2,0,0]=4 5839 B12R1.435 COc1cccc(n1)[C@@H](C)N[13CH3] 2230a_100016223015_200025704644 [1,1,0,0,0,0|2,0,0]=4 5840 B12R1.435 COc1ccnc(c1)C(C)N[13CH3] 2230a_100009966388_200025704644 [1,1,0,0,0,0|2,0,0]=4 5841 B12R1.435 CSc1cccc(c1)C(N)CO 62a_100000690078_200000210301 [1,1,0,0,0,0|1,1,0]=4 5842 B12R1.435 CSc1cccc(c1)C(N)CO 62a_200000210301_100000690078 [1,1,0,0,0,0|1,1,0]=4 5843 B12R1.435 [13CH3]Oc1cccc(c1)C(=O)CBr 7a_100009813753_200025704644 [1,1,0,0,0,0|1,0,1]=4 5844 B12R1.435 [13CH3]Oc1cccc(c1)C(N)CO 34a_100025717460_200025704644 [1,1,0,0,0,0|1,0,0]=3 5845 B12R1.435 [13CH3]Oc1cccc(c1)C(O)CN 34a_100020657549_200025704644 [1,1,0,0,0,0|1,0,0]=3 5846 B12R1.435 [13CH3]Sc1cccc(c1)C(N)CO 62a_100000690078_200025704644 [1,1,0,0,0,0|1,1,0]=4 5847 B12R1.435 [13CH3]Sc1cccc(c1)C(N)CO 62a_200025704644_100000690078 [1,1,0,0,0,0|1,1,0]=4 5848 B12R1.438 C=Cc1cccc(c1)CC(C)C 271570a_100011290941_100010883412 [1,1,0,0,0,0|1,0,1]=4 5849 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_100000689217_200025704644 [1,1,0,0,0,0|0,1,1]=4 5850 B12R1.438 CC(=O)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000689217 [1,1,0,0,0,0|0,1,1]=4 5851 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 34a_100000158604_200025704644 [1,1,0,0,0,0|1,0,1]=4 5852 B12R1.438 CC(=O)Nc1cccc(c1)O[13CH3] 7a_100000158604_200025704644 [1,1,0,0,0,0|1,0,1]=4 5853 B12R1.438 CC(=O)Oc1cccc(c1)O[13CH3] 7a_100011218754_200025704644 [1,1,0,0,0,0|1,0,1]=4 5854 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_100010883412_200025704644 [1,1,0,0,0,0|0,1,0]=3 5855 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100010883412 [1,1,0,0,0,0|0,1,0]=3 5856 B12R1.438 CC(C)Nc1cccc(c1)S[13CH3] 62a_100000219649_200025704644 [1,1,0,0,0,0|1,1,0]=4 5857 B12R1.438 CC(C)Nc1cccc(c1)S[13CH3] 62a_200025704644_100000219649 [1,1,0,0,0,0|1,1,0]=4 5858 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 2230a_100011194262_200025704644 [1,1,0,0,0,0|2,0,0]=4 5859 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 34a_100011194262_200025704644 [1,1,0,0,0,0|2,0,0]=4 5860 B12R1.438 CC(C)Oc1cccc(c1)N[13CH3] 7a_100011194262_200025704644 [1,1,0,0,0,0|2,0,0]=4 5861 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 34a_100000753242_200025704644 [1,1,0,0,0,0|1,0,0]=3 5862 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 7a_100000753242_200025704644 [1,1,0,0,0,0|1,0,0]=3 5863 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_100000170003_200025704644 [1,1,0,0,0,0|1,1,0]=4 5864 B12R1.438 CC(C)Oc1cccc(c1)S[13CH3] 62a_200025704644_100000170003 [1,1,0,0,0,0|1,1,0]=4 5865 B12R1.438 CC(C)Sc1cccc(c1)S[13CH3] 62a_100009815759_200025704644 [1,1,0,0,0,0|1,1,0]=4 5866 B12R1.438 CC(C)Sc1cccc(c1)S[13CH3] 62a_200025704644_100009815759 [1,1,0,0,0,0|1,1,0]=4 5867 B12R1.438 CCc1cccc(c1)CN(C)C 270004a_100102631434_100011999841 [1,1,0,0,0,0|2,0,0]=4 5868 B12R1.438 CCc1cccc(c1)NC(C)C 2230a_100000211250_100000210206 [1,1,0,0,0,0|2,0,0]=4 5869 B12R1.438 CCc1cccc(c1)NC(C)C 34a_100000211250_100000210206 [1,1,0,0,0,0|2,0,0]=4 5870 B12R1.438 CCc1cccc(c1)NC(C)C 7a_100000211250_100000210206 [1,1,0,0,0,0|2,0,0]=4 5871 B12R1.438 CCc1cccc(c1)OC(C)C 34a_100000211550_100000210206 [1,1,0,0,0,0|2,0,0]=4 5872 B12R1.438 CCc1cccc(c1)OC(C)C 7a_100000211550_100000210206 [1,1,0,0,0,0|2,0,0]=4 5873 B12R1.438 CCc1cccc(c1)SC(C)C 62a_100000210206_100011263222 [1,1,0,0,0,0|2,0,0]=4 5874 B12R1.438 CCc1cccc(c1)SC(C)C 62a_100011263222_100000210206 [1,1,0,0,0,0|2,0,0]=4 5875 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_100000174759_200025704644 [1,1,0,0,0,0|1,1,0]=4 5876 B12R1.438 CN(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100000174759 [1,1,0,0,0,0|1,1,0]=4 5877 B12R1.438 CNc1cccc(c1)OC(C)C 2230a_100011194262_200000210301 [1,1,0,0,0,0|2,0,0]=4 5878 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100000756613_100000210206 [1,1,0,0,0,0|2,0,0]=4 5879 B12R1.438 CNc1cccc(c1)OC(C)C 34a_100011194262_200000210301 [1,1,0,0,0,0|2,0,0]=4 5880 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100000756613_100000210206 [1,1,0,0,0,0|2,0,0]=4 5881 B12R1.438 CNc1cccc(c1)OC(C)C 7a_100011194262_200000210301 [1,1,0,0,0,0|2,0,0]=4 5882 B12R1.438 CNc1cccc(c1)SC(C)C 62a_100000210206_100000219648 [1,1,0,0,0,0|2,0,0]=4 5883 B12R1.438 CNc1cccc(c1)SC(C)C 62a_100000219648_100000210206 [1,1,0,0,0,0|2,0,0]=4 5884 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000070787_100103152439 [1,1,0,0,0,0|1,0,1]=4 5885 B12R1.438 COc1cc(ccn1)CC(=O)C 1458a_100000718155_200000210301 [1,1,0,0,0,0|1,0,1]=4 5886 B12R1.438 COc1cc(ccn1)CC(=O)[13CH3] 1458a_100000718155_200025704644 [1,1,0,0,0,0|1,0,1]=4 5887 B12R1.438 COc1cc(ccn1)CN(C)C 2230a_100102631434_100103152439 [1,1,0,0,0,0|2,0,0]=4 5888 B12R1.438 COc1cc(ccn1)CN(C)C 269982a_100102631434_100103152439 [1,1,0,0,0,0|2,0,0]=4 5889 B12R1.438 COc1cc(ccn1)CN(C)C 270004a_100102631434_100000050969 [1,1,0,0,0,0|2,0,0]=4 5890 B12R1.438 COc1cc(ccn1)OC(C)C 34a_100012181050_100000210206 [1,1,0,0,0,0|2,0,0]=4 5891 B12R1.438 COc1cc(ccn1)SC(C)C 62a_100000117307_100000210206 [1,1,0,0,0,0|2,0,0]=4 5892 B12R1.438 COc1cc(ccn1)SC(C)C 62a_100000210206_100000117307 [1,1,0,0,0,0|2,0,0]=4 5893 B12R1.438 COc1cccc(c1)C=C(C)C 271570a_100102525489_100000170001 [1,1,0,0,0,0|0,0,2]=4 5894 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [1,1,0,0,0,0|0,0,1]=3 5895 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [1,1,0,0,0,0|0,0,1]=3 5896 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [1,1,0,0,0,0|1,0,1]=4 5897 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [1,1,0,0,0,0|1,0,1]=4 5898 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [1,1,0,0,0,0|0,0,1]=3 5899 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [1,1,0,0,0,0|1,0,0]=3 5900 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [1,1,0,0,0,0|1,0,0]=3 5901 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [1,1,0,0,0,0|1,0,0]=3 5902 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [1,1,0,0,0,0|1,0,0]=3 5903 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [1,1,0,0,0,0|1,0,0]=3 5904 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [1,1,0,0,0,0|1,0,0]=3 5905 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [1,1,0,0,0,0|1,0,0]=3 5906 B12R1.438 COc1cccc(c1)NC(=O)C 11a_100000210024_100015343762 [1,1,0,0,0,0|1,0,1]=4 5907 B12R1.438 COc1cccc(c1)NC(=O)C 1626a_100000210024_100015343762 [1,1,0,0,0,0|1,0,1]=4 5908 B12R1.438 COc1cccc(c1)NC(=O)C 22a_100000210024_100000070787 [1,1,0,0,0,0|1,0,1]=4 5909 B12R1.438 COc1cccc(c1)NC(=O)C 34a_100000158604_200000210301 [1,1,0,0,0,0|1,0,1]=4 5910 B12R1.438 COc1cccc(c1)NC(=O)C 527a_100000210024_100103153847 [1,1,0,0,0,0|1,0,1]=4 5911 B12R1.438 COc1cccc(c1)NC(=O)C 7a_100000158604_200000210301 [1,1,0,0,0,0|1,0,1]=4 5912 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [1,1,0,0,0,0|1,0,0]=3 5913 B12R1.438 COc1cccc(c1)OC(=O)C 7a_100011218754_200000210301 [1,1,0,0,0,0|1,0,1]=4 5914 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000211255_100000210206 [1,1,0,0,0,0|1,0,0]=3 5915 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000753242_200000210301 [1,1,0,0,0,0|1,0,0]=3 5916 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000211255_100000210206 [1,1,0,0,0,0|1,0,0]=3 5917 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000753242_200000210301 [1,1,0,0,0,0|1,0,0]=3 5918 B12R1.438 COc1cccc(c1)OC(F)F 34a_100000703596_200000210301 [1,1,0,0,0,0|2,0,0]=4 5919 B12R1.438 COc1cccc(c1)OC(F)F 7a_100000703596_200000210301 [1,1,0,0,0,0|2,0,0]=4 5920 B12R1.438 COc1cccc(c1)SC(C)C 62a_100000210206_100000170001 [1,1,0,0,0,0|1,0,0]=3 5921 B12R1.438 COc1cccc(n1)CC(=O)C 1458a_100000070787_100000755263 [1,1,0,0,0,0|1,0,1]=4 5922 B12R1.438 COc1cccc(n1)CN(C)C 2230a_100102631434_100000755263 [1,1,0,0,0,0|2,0,0]=4 5923 B12R1.438 COc1cccc(n1)CN(C)C 269982a_100102631434_100000755263 [1,1,0,0,0,0|2,0,0]=4 5924 B12R1.438 COc1cccc(n1)CN(C)C 270004a_100102631434_100000694346 [1,1,0,0,0,0|2,0,0]=4 5925 B12R1.438 COc1cccc(n1)SC(C)C 62a_100000210206_100000760917 [1,1,0,0,0,0|2,0,0]=4 5926 B12R1.438 COc1cccc(n1)SC(C)C 62a_100000760917_100000210206 [1,1,0,0,0,0|2,0,0]=4 5927 B12R1.438 COc1ccnc(c1)CC(=O)C 1458a_100000070787_100000752681 [1,1,0,0,0,0|1,0,1]=4 5928 B12R1.438 COc1ccnc(c1)CN(C)C 2230a_100102631434_100000752681 [1,1,0,0,0,0|2,0,0]=4 5929 B12R1.438 COc1ccnc(c1)CN(C)C 269982a_100102631434_100000752681 [1,1,0,0,0,0|2,0,0]=4 5930 B12R1.438 COc1ccnc(c1)CN(C)C 270004a_100102631434_100000087537 [1,1,0,0,0,0|2,0,0]=4 5931 B12R1.438 COc1ccnc(c1)SC(C)C 62a_100000210206_100011216251 [1,1,0,0,0,0|2,0,0]=4 5932 B12R1.438 COc1ccnc(c1)SC(C)C 62a_100009817693_100000210206 [1,1,0,0,0,0|2,0,0]=4 5933 B12R1.438 COc1cncc(c1)CN(C)C 270004a_100102631434_100011361638 [1,1,0,0,0,0|2,0,0]=4 5934 B12R1.438 COc1cncc(c1)OC(C)C 34a_100000084572_100000210206 [1,1,0,0,0,0|2,0,0]=4 5935 B12R1.438 COc1cncc(c1)OC(C)C 7a_100000084572_100000210206 [1,1,0,0,0,0|2,0,0]=4 5936 B12R1.438 COc1cncc(c1)SC(C)C 62a_100000050176_100000210206 [1,1,0,0,0,0|2,0,0]=4 5937 B12R1.438 COc1cncc(c1)SC(C)C 62a_100000210206_100000050176 [1,1,0,0,0,0|2,0,0]=4 5938 B12R1.438 CSc1cccc(c1)CC(=O)C 1458a_100000035702_200000210301 [1,1,0,0,0,0|0,1,1]=4 5939 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_100000689217_200000210301 [1,1,0,0,0,0|0,1,1]=4 5940 B12R1.438 CSc1cccc(c1)CC(=O)C 62a_200000210301_100000689217 [1,1,0,0,0,0|0,1,1]=4 5941 B12R1.438 CSc1cccc(c1)CC(=O)[13CH3] 1458a_100000035702_200025704644 [1,1,0,0,0,0|0,1,1]=4 5942 B12R1.438 CSc1cccc(c1)CC(C)C 62a_100010883412_200000210301 [1,1,0,0,0,0|0,1,0]=3 5943 B12R1.438 CSc1cccc(c1)CC(C)C 62a_200000210301_100010883412 [1,1,0,0,0,0|0,1,0]=3 5944 B12R1.438 CSc1cccc(c1)CN(C)C 2230a_100011934695_200000210301 [1,1,0,0,0,0|1,1,0]=4 5945 B12R1.438 CSc1cccc(c1)CN(C)C 269982a_100011934695_200000210301 [1,1,0,0,0,0|1,1,0]=4 5946 B12R1.438 CSc1cccc(c1)CN(C)C 270004a_100102631434_100011935093 [1,1,0,0,0,0|1,1,0]=4 5947 B12R1.438 CSc1cccc(c1)CN(C)C 62a_100000174759_200000210301 [1,1,0,0,0,0|1,1,0]=4 5948 B12R1.438 CSc1cccc(c1)CN(C)C 62a_200000210301_100000174759 [1,1,0,0,0,0|1,1,0]=4 5949 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 2230a_100011934695_200025704644 [1,1,0,0,0,0|1,1,0]=4 5950 B12R1.438 CSc1cccc(c1)CN(C)[13CH3] 269982a_100011934695_200025704644 [1,1,0,0,0,0|1,1,0]=4 5951 B12R1.438 CSc1cccc(c1)NC(C)C 2230a_100000210049_100000210206 [1,1,0,0,0,0|1,1,0]=4 5952 B12R1.438 CSc1cccc(c1)NC(C)C 34a_100000210049_100000210206 [1,1,0,0,0,0|1,1,0]=4 5953 B12R1.438 CSc1cccc(c1)NC(C)C 62a_100000219649_200000210301 [1,1,0,0,0,0|1,1,0]=4 5954 B12R1.438 CSc1cccc(c1)NC(C)C 62a_200000210301_100000219649 [1,1,0,0,0,0|1,1,0]=4 5955 B12R1.438 CSc1cccc(c1)OC(C)C 34a_100011265683_100000210206 [1,1,0,0,0,0|1,1,0]=4 5956 B12R1.438 CSc1cccc(c1)OC(C)C 62a_100000170003_200000210301 [1,1,0,0,0,0|1,1,0]=4 5957 B12R1.438 CSc1cccc(c1)OC(C)C 62a_200000210301_100000170003 [1,1,0,0,0,0|1,1,0]=4 5958 B12R1.438 CSc1cccc(c1)OC(C)C 7a_100011265683_100000210206 [1,1,0,0,0,0|1,1,0]=4 5959 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100000210206_100011215954 [1,1,0,0,0,0|1,1,0]=4 5960 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100009815759_200000210301 [1,1,0,0,0,0|1,1,0]=4 5961 B12R1.438 CSc1cccc(c1)SC(C)C 62a_100011215954_100000210206 [1,1,0,0,0,0|1,1,0]=4 5962 B12R1.438 CSc1cccc(c1)SC(C)C 62a_200000210301_100009815759 [1,1,0,0,0,0|1,1,0]=4 5963 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [1,1,0,0,0,0|1,0,1]=4 5964 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [1,1,0,0,0,0|1,0,1]=4 5965 B12R1.438 [13CH3]Oc1cccc(c1)OC(F)F 34a_100000703596_200025704644 [1,1,0,0,0,0|2,0,0]=4 5966 B12R1.438 [13CH3]Oc1cccc(c1)OC(F)F 7a_100000703596_200025704644 [1,1,0,0,0,0|2,0,0]=4 5967 B12R1.19 CC(=Cc1ccc(c(c1)C)O)C 271570a_100102525489_100000186361 [1,1,0,0,0,0|0,0,2]=4 5968 B12R1.19 CC(=Cc1ccc(c(c1)O)O)C 271570a_100102525489_100009813601 [1,1,0,0,0,0|0,0,2]=4 5969 B12R1.19 CC(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200000210301 [1,1,0,0,0,0|1,0,1]=4 5970 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100000070787_100000727479 [1,1,0,0,0,0|1,0,1]=4 5971 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Br 1458a_100012340274_200000210301 [1,1,0,0,0,0|1,0,1]=4 5972 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000070787_100000742320 [1,1,0,0,0,0|1,0,1]=4 5973 B12R1.19 CC(=O)Cc1ccc(c(c1)C)C 1458a_100000184070_200000210301 [1,1,0,0,0,0|1,0,1]=4 5974 B12R1.19 CC(=O)Cc1ccc(c(c1)C)Cl 1458a_100000070787_100012184735 [1,1,0,0,0,0|1,0,1]=4 5975 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100000070787_100011216667 [1,1,0,0,0,0|1,0,1]=4 5976 B12R1.19 CC(=O)Cc1ccc(c(c1)C)F 1458a_100011667458_200000210301 [1,1,0,0,0,0|1,0,1]=4 5977 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,1,0,0,0,0|0,0,1]=3 5978 B12R1.19 CC(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200000210301 [1,1,0,0,0,0|1,0,1]=4 5979 B12R1.19 CC(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200000210301 [1,1,0,0,0,0|1,0,1]=4 5980 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,1,0,0,0,0|1,0,1]=4 5981 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,1,0,0,0,0|0,0,1]=3 5982 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,1,0,0,0,0|0,0,1]=3 5983 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 11a_100011218179_100015343762 [1,1,0,0,0,0|1,0,1]=4 5984 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 22a_100011218179_100000070787 [1,1,0,0,0,0|1,0,1]=4 5985 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 271570a_203496583355_100000155607 [1,1,0,0,0,0|1,0,1]=4 5986 B12R1.19 CC(=O)Nc1ccc(c(c1)C)O 527a_100011218179_100103153847 [1,1,0,0,0,0|1,0,1]=4 5987 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000070787 [1,1,0,0,0,0|1,0,1]=4 5988 B12R1.19 CC(=O)Nc1ccc(c(c1)O)O 527a_100102946323_100103153847 [1,1,0,0,0,0|1,0,1]=4 5989 B12R1.19 CC(C)Nc1ccc(c(c1)Br)O 34a_100011534360_100000210206 [1,1,0,0,0,0|2,0,0]=4 5990 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)O 34a_100000744943_100000210206 [1,1,0,0,0,0|2,0,0]=4 5991 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 34a_100011220035_100000210206 [1,1,0,0,0,0|2,0,0]=4 5992 B12R1.19 CC(C)Nc1ccc(c(c1)F)O 7a_100011220035_100000210206 [1,1,0,0,0,0|2,0,0]=4 5993 B12R1.19 CC(C)Nc1ccc(c(c1)O)Cl 34a_100011934209_100000210206 [1,1,0,0,0,0|2,0,0]=4 5994 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 34a_100012017398_100000210206 [1,1,0,0,0,0|2,0,0]=4 5995 B12R1.19 CC(C)Nc1ccc(c(c1)O)F 7a_100012017398_100000210206 [1,1,0,0,0,0|2,0,0]=4 5996 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,1,0,0,0,0|1,0,0]=3 5997 B12R1.19 CC(C)Oc1ccc(c(c1)F)O 271570a_203496583355_200012236954 [1,1,0,0,0,0|2,0,0]=4 5998 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100000210206_100012361655 [1,1,0,0,0,0|2,0,0]=4 5999 B12R1.19 CC(C)Sc1ccc(c(c1)Br)O 62a_100012361655_100000210206 [1,1,0,0,0,0|2,0,0]=4 6000 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100000210206_100012360047 [1,1,0,0,0,0|2,0,0]=4 6001 B12R1.19 CC(C)Sc1ccc(c(c1)Cl)O 62a_100012360047_100000210206 [1,1,0,0,0,0|2,0,0]=4 6002 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000185481_100000210206 [1,1,0,0,0,0|2,0,0]=4 6003 B12R1.19 CC(C)Sc1ccc(c(c1)F)O 62a_100000210206_100000185481 [1,1,0,0,0,0|2,0,0]=4 6004 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000210206_100000752626 [1,1,0,0,0,0|2,0,0]=4 6005 B12R1.19 CC(C)Sc1ccc(c(c1)N)O 62a_100000752626_100000210206 [1,1,0,0,0,0|2,0,0]=4 6006 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100000210206_100012356990 [1,1,0,0,0,0|2,0,0]=4 6007 B12R1.19 CC(C)Sc1ccc(c(c1)O)Br 62a_100012356990_100000210206 [1,1,0,0,0,0|2,0,0]=4 6008 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100000210206_100011356854 [1,1,0,0,0,0|2,0,0]=4 6009 B12R1.19 CC(C)Sc1ccc(c(c1)O)Cl 62a_100011356854_100000210206 [1,1,0,0,0,0|2,0,0]=4 6010 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000210206_100000686035 [1,1,0,0,0,0|2,0,0]=4 6011 B12R1.19 CC(C)Sc1ccc(c(c1)O)F 62a_100000686035_100000210206 [1,1,0,0,0,0|2,0,0]=4 6012 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000210206_100000739049 [1,1,0,0,0,0|2,0,0]=4 6013 B12R1.19 CC(C)Sc1ccc(c(c1)O)N 62a_100000739049_100000210206 [1,1,0,0,0,0|2,0,0]=4 6014 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,1,0,0,0,0|1,0,0]=3 6015 B12R1.19 Cc1cc(ccc1Br)CC(=O)[13CH3] 1458a_100012340274_200025704644 [1,1,0,0,0,0|1,0,1]=4 6016 B12R1.19 Cc1cc(ccc1Br)CN(C)C 2230a_100102631434_100000727479 [1,1,0,0,0,0|2,0,0]=4 6017 B12R1.19 Cc1cc(ccc1Br)CN(C)C 269982a_100102631434_100000727479 [1,1,0,0,0,0|2,0,0]=4 6018 B12R1.19 Cc1cc(ccc1Br)CN(C)C 270004a_100102631434_100000765772 [1,1,0,0,0,0|2,0,0]=4 6019 B12R1.19 Cc1cc(ccc1Br)NC(C)C 2230a_100000210723_100000210206 [1,1,0,0,0,0|2,0,0]=4 6020 B12R1.19 Cc1cc(ccc1Br)NC(C)C 34a_100000210723_100000210206 [1,1,0,0,0,0|2,0,0]=4 6021 B12R1.19 Cc1cc(ccc1Br)NC(C)C 7a_100000210723_100000210206 [1,1,0,0,0,0|2,0,0]=4 6022 B12R1.19 Cc1cc(ccc1Br)OC(C)C 34a_100000690111_100000210206 [1,1,0,0,0,0|2,0,0]=4 6023 B12R1.19 Cc1cc(ccc1Br)OC(C)C 7a_100000690111_100000210206 [1,1,0,0,0,0|2,0,0]=4 6024 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100000210206_100009813585 [1,1,0,0,0,0|2,0,0]=4 6025 B12R1.19 Cc1cc(ccc1Br)SC(C)C 62a_100009813585_100000210206 [1,1,0,0,0,0|2,0,0]=4 6026 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 2230a_100102631434_100012184735 [1,1,0,0,0,0|2,0,0]=4 6027 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 269982a_100102631434_100012184735 [1,1,0,0,0,0|2,0,0]=4 6028 B12R1.19 Cc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100000698814 [1,1,0,0,0,0|2,0,0]=4 6029 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 2230a_100000187808_100000210206 [1,1,0,0,0,0|2,0,0]=4 6030 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 34a_100000187808_100000210206 [1,1,0,0,0,0|2,0,0]=4 6031 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 7a_100000187808_100000210206 [1,1,0,0,0,0|2,0,0]=4 6032 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 34a_100000211092_100000210206 [1,1,0,0,0,0|2,0,0]=4 6033 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 7a_100000211092_100000210206 [1,1,0,0,0,0|2,0,0]=4 6034 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000049509_100000210206 [1,1,0,0,0,0|2,0,0]=4 6035 B12R1.19 Cc1cc(ccc1Cl)SC(C)C 62a_100000210206_100000049509 [1,1,0,0,0,0|2,0,0]=4 6036 B12R1.19 Cc1cc(ccc1F)CC(=O)[13CH3] 1458a_100011667458_200025704644 [1,1,0,0,0,0|1,0,1]=4 6037 B12R1.19 Cc1cc(ccc1F)CN(C)C 2230a_100102631434_100011216667 [1,1,0,0,0,0|2,0,0]=4 6038 B12R1.19 Cc1cc(ccc1F)CN(C)C 269982a_100102631434_100011216667 [1,1,0,0,0,0|2,0,0]=4 6039 B12R1.19 Cc1cc(ccc1F)CN(C)C 270004a_100102631434_100000748208 [1,1,0,0,0,0|2,0,0]=4 6040 B12R1.19 Cc1cc(ccc1F)NC(C)C 2230a_100000750164_100000210206 [1,1,0,0,0,0|2,0,0]=4 6041 B12R1.19 Cc1cc(ccc1F)NC(C)C 34a_100000750164_100000210206 [1,1,0,0,0,0|2,0,0]=4 6042 B12R1.19 Cc1cc(ccc1F)NC(C)C 7a_100000750164_100000210206 [1,1,0,0,0,0|2,0,0]=4 6043 B12R1.19 Cc1cc(ccc1F)OC(C)C 34a_100000751312_100000210206 [1,1,0,0,0,0|2,0,0]=4 6044 B12R1.19 Cc1cc(ccc1F)OC(C)C 7a_100000751312_100000210206 [1,1,0,0,0,0|2,0,0]=4 6045 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100000210206_100011218330 [1,1,0,0,0,0|2,0,0]=4 6046 B12R1.19 Cc1cc(ccc1F)SC(C)C 62a_100011218330_100000210206 [1,1,0,0,0,0|2,0,0]=4 6047 B12R1.19 Cc1cc(ccc1I)NC(C)C 34a_100000198070_100000210206 [1,1,0,0,0,0|2,0,0]=4 6048 B12R1.19 Cc1cc(ccc1I)NC(C)C 7a_100000198070_100000210206 [1,1,0,0,0,0|2,0,0]=4 6049 B12R1.19 Cc1cc(ccc1I)OC(C)C 34a_100000729255_100000210206 [1,1,0,0,0,0|2,0,0]=4 6050 B12R1.19 Cc1cc(ccc1I)OC(C)C 7a_100000729255_100000210206 [1,1,0,0,0,0|2,0,0]=4 6051 B12R1.19 Cc1cc(ccc1N)OC(C)C 34a_100000756630_100000210206 [1,1,0,0,0,0|2,0,0]=4 6052 B12R1.19 Cc1cc(ccc1N)OC(C)C 7a_100000756630_100000210206 [1,1,0,0,0,0|2,0,0]=4 6053 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000210206_100000211769 [1,1,0,0,0,0|2,0,0]=4 6054 B12R1.19 Cc1cc(ccc1N)SC(C)C 62a_100000211769_100000210206 [1,1,0,0,0,0|2,0,0]=4 6055 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,1,0,0,0,0|0,0,1]=3 6056 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [1,1,0,0,0,0|1,0,0]=3 6057 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [1,1,0,0,0,0|1,0,0]=3 6058 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [1,1,0,0,0,0|1,0,0]=3 6059 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000210206_100000685391 [1,1,0,0,0,0|2,0,0]=4 6060 B12R1.19 Cc1cc(cnc1O)SC(C)C 62a_100000685391_100000210206 [1,1,0,0,0,0|2,0,0]=4 6061 B12R1.19 Cc1cc(ncc1O)SC(C)C 62a_100000210206_100000692680 [1,1,0,0,0,0|2,0,0]=4 6062 B12R1.19 Cc1ccc(cc1C)CC(=O)[13CH3] 1458a_100000184070_200025704644 [1,1,0,0,0,0|1,0,1]=4 6063 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 6064 B12R1.19 Cc1ccc(cc1C)CN(C)C 2230a_100102631434_100000742320 [1,1,0,0,0,0|2,0,0]=4 6065 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 6066 B12R1.19 Cc1ccc(cc1C)CN(C)C 269982a_100102631434_100000742320 [1,1,0,0,0,0|2,0,0]=4 6067 B12R1.19 Cc1ccc(cc1C)CN(C)C 270004a_100102631434_100000229942 [1,1,0,0,0,0|2,0,0]=4 6068 B12R1.19 Cc1ccc(cc1C)CN(C)C 34a_100015204808_200000210301 [1,1,0,0,0,0|2,0,0]=4 6069 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 2230a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 6070 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 269982a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 6071 B12R1.19 Cc1ccc(cc1C)CN(C)[13CH3] 34a_100015204808_200025704644 [1,1,0,0,0,0|2,0,0]=4 6072 B12R1.19 Cc1ccc(cc1C)NC(C)C 2230a_100000724040_100000210206 [1,1,0,0,0,0|2,0,0]=4 6073 B12R1.19 Cc1ccc(cc1C)NC(C)C 34a_100000724040_100000210206 [1,1,0,0,0,0|2,0,0]=4 6074 B12R1.19 Cc1ccc(cc1C)NC(C)C 7a_100000724040_100000210206 [1,1,0,0,0,0|2,0,0]=4 6075 B12R1.19 Cc1ccc(cc1C)OC(C)C 34a_100000210932_100000210206 [1,1,0,0,0,0|2,0,0]=4 6076 B12R1.19 Cc1ccc(cc1C)OC(C)C 7a_100000210932_100000210206 [1,1,0,0,0,0|2,0,0]=4 6077 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100000210206_100011215607 [1,1,0,0,0,0|2,0,0]=4 6078 B12R1.19 Cc1ccc(cc1C)SC(C)C 62a_100011215607_100000210206 [1,1,0,0,0,0|2,0,0]=4 6079 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,1,0,0,0,0|1,0,1]=4 6080 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [1,1,0,0,0,0|2,0,0]=4 6081 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [1,1,0,0,0,0|2,0,0]=4 6082 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [1,1,0,0,0,0|2,0,0]=4 6083 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [1,1,0,0,0,0|2,0,0]=4 6084 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [1,1,0,0,0,0|2,0,0]=4 6085 B12R1.19 Cc1nc(ccc1O)OC(C)C 271570a_203496583355_200012350186 [1,1,0,0,0,0|2,0,0]=4 6086 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100000210206_100010233687 [1,1,0,0,0,0|2,0,0]=4 6087 B12R1.19 Cc1nc(ccc1O)SC(C)C 62a_100010233687_100000210206 [1,1,0,0,0,0|2,0,0]=4 6088 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Br)O 1458a_100009990404_200025704644 [1,1,0,0,0,0|1,0,1]=4 6089 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)Cl)O 1458a_100000035197_200025704644 [1,1,0,0,0,0|1,0,1]=4 6090 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)F)O 1458a_100000039761_200025704644 [1,1,0,0,0,0|1,0,1]=4 6091 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,1,0,0,0,0|0,0,1]=3 6092 B12R1.44 CC=Cc1cc(c(c(c1)Br)O)C 271570a_100016259895_100010982682 [1,1,0,0,0,0|0,0,2]=4 6093 B12R1.44 CC=Cc1cc(c(c(c1)C)O)C 271570a_100016259895_100000187306 [1,1,0,0,0,0|0,0,2]=4 6094 B12R1.44 CC=Cc1cc(c(c(c1)Cl)O)C 271570a_100016259895_200015900153 [1,1,0,0,0,0|0,0,2]=4 6095 B12R1.44 CC=Cc1cc(c(c(c1)N)O)C 271570a_100016259895_100011825904 [1,1,0,0,0,0|0,0,2]=4 6096 B12R1.44 CCNc1cc(c(c(c1)Br)C)C 2230a_100010368239_100000210202 [1,1,0,0,0,0|2,0,0]=4 6097 B12R1.44 CCNc1cc(c(c(c1)Br)C)C 34a_100010368239_100000210202 [1,1,0,0,0,0|2,0,0]=4 6098 B12R1.44 CCNc1cc(c(c(c1)Br)C)C 7a_100010368239_100000210202 [1,1,0,0,0,0|2,0,0]=4 6099 B12R1.44 CCNc1cc(c(c(c1)Br)O)Br 34a_200000186426_100000210202 [1,1,0,0,0,0|2,0,0]=4 6100 B12R1.44 CCNc1cc(c(c(c1)Br)O)C 34a_100010064301_100000210202 [1,1,0,0,0,0|1,0,0]=3 6101 B12R1.44 CCNc1cc(c(c(c1)Br)O)C 7a_100010064301_100000210202 [1,1,0,0,0,0|1,0,0]=3 6102 B12R1.44 CCNc1cc(c(c(c1)C)Br)C 2230a_100000684802_100000210202 [1,1,0,0,0,0|2,0,0]=4 6103 B12R1.44 CCNc1cc(c(c(c1)C)Br)C 34a_100000684802_100000210202 [1,1,0,0,0,0|2,0,0]=4 6104 B12R1.44 CCNc1cc(c(c(c1)C)Br)C 7a_100000684802_100000210202 [1,1,0,0,0,0|2,0,0]=4 6105 B12R1.44 CCNc1cc(c(c(c1)C)C)C 2230a_100000074974_100000210202 [1,1,0,0,0,0|2,0,0]=4 6106 B12R1.44 CCNc1cc(c(c(c1)C)C)C 34a_100000074974_100000210202 [1,1,0,0,0,0|2,0,0]=4 6107 B12R1.44 CCNc1cc(c(c(c1)C)C)C 7a_100000074974_100000210202 [1,1,0,0,0,0|2,0,0]=4 6108 B12R1.44 CCNc1cc(c(c(c1)C)F)C 2230a_100000061604_100000210202 [1,1,0,0,0,0|2,0,0]=4 6109 B12R1.44 CCNc1cc(c(c(c1)C)F)C 34a_100000061604_100000210202 [1,1,0,0,0,0|2,0,0]=4 6110 B12R1.44 CCNc1cc(c(c(c1)C)F)C 7a_100000061604_100000210202 [1,1,0,0,0,0|2,0,0]=4 6111 B12R1.44 CCNc1cc(c(c(c1)C)I)C 34a_100000215964_100000210202 [1,1,0,0,0,0|2,0,0]=4 6112 B12R1.44 CCNc1cc(c(c(c1)C)I)C 7a_100000215964_100000210202 [1,1,0,0,0,0|2,0,0]=4 6113 B12R1.44 CCNc1cc(c(c(c1)C)O)C 34a_100000703291_100000210202 [1,1,0,0,0,0|1,0,0]=3 6114 B12R1.44 CCNc1cc(c(c(c1)C)O)C 7a_100000703291_100000210202 [1,1,0,0,0,0|1,0,0]=3 6115 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)C 2230a_100009830880_100000210202 [1,1,0,0,0,0|2,0,0]=4 6116 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)C 34a_100009830880_100000210202 [1,1,0,0,0,0|2,0,0]=4 6117 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)C 7a_100009830880_100000210202 [1,1,0,0,0,0|2,0,0]=4 6118 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)O 34a_100015839415_100000210202 [1,1,0,0,0,0|2,0,0]=4 6119 B12R1.44 CCNc1cc(c(c(c1)Cl)Cl)O 7a_100015839415_100000210202 [1,1,0,0,0,0|2,0,0]=4 6120 B12R1.44 CCNc1cc(c(c(c1)Cl)O)Cl 34a_100000695418_100000210202 [1,1,0,0,0,0|2,0,0]=4 6121 B12R1.44 CCNc1cc(c(c(c1)Cl)O)Cl 7a_100000695418_100000210202 [1,1,0,0,0,0|2,0,0]=4 6122 B12R1.44 CCNc1cc(c(c(c1)F)Br)C 2230a_100010115923_100000210202 [1,1,0,0,0,0|2,0,0]=4 6123 B12R1.44 CCNc1cc(c(c(c1)F)Br)C 34a_100010115923_100000210202 [1,1,0,0,0,0|2,0,0]=4 6124 B12R1.44 CCNc1cc(c(c(c1)F)Br)C 7a_100010115923_100000210202 [1,1,0,0,0,0|2,0,0]=4 6125 B12R1.44 CCNc1cc(c(c(c1)F)F)C 2230a_100010704045_100000210202 [1,1,0,0,0,0|2,0,0]=4 6126 B12R1.44 CCNc1cc(c(c(c1)F)F)C 34a_100010704045_100000210202 [1,1,0,0,0,0|2,0,0]=4 6127 B12R1.44 CCNc1cc(c(c(c1)F)F)C 7a_100010704045_100000210202 [1,1,0,0,0,0|2,0,0]=4 6128 B12R1.44 CCNc1cc(c(c(c1)F)O)F 34a_100016987357_100000210202 [1,1,0,0,0,0|2,0,0]=4 6129 B12R1.44 CCNc1cc(c(c(c1)F)O)F 7a_100016987357_100000210202 [1,1,0,0,0,0|2,0,0]=4 6130 B12R1.44 CCOc1cc(c(c(c1)Br)C)C 34a_100010068915_100000210202 [1,1,0,0,0,0|2,0,0]=4 6131 B12R1.44 CCOc1cc(c(c(c1)Br)C)C 7a_100010068915_100000210202 [1,1,0,0,0,0|2,0,0]=4 6132 B12R1.44 CCOc1cc(c(c(c1)C)Br)C 34a_100000243743_100000210202 [1,1,0,0,0,0|2,0,0]=4 6133 B12R1.44 CCOc1cc(c(c(c1)C)Br)C 7a_100000243743_100000210202 [1,1,0,0,0,0|2,0,0]=4 6134 B12R1.44 CCOc1cc(c(c(c1)C)C)C 34a_200000042890_100000210202 [1,1,0,0,0,0|2,0,0]=4 6135 B12R1.44 CCOc1cc(c(c(c1)C)C)C 7a_200000042890_100000210202 [1,1,0,0,0,0|2,0,0]=4 6136 B12R1.44 CCOc1cc(c(c(c1)C)Cl)C 34a_100000739557_100000210202 [1,1,0,0,0,0|2,0,0]=4 6137 B12R1.44 CCOc1cc(c(c(c1)C)Cl)C 7a_100000739557_100000210202 [1,1,0,0,0,0|2,0,0]=4 6138 B12R1.44 CCOc1cc(c(c(c1)C)I)C 34a_100011216239_100000210202 [1,1,0,0,0,0|2,0,0]=4 6139 B12R1.44 CCOc1cc(c(c(c1)C)I)C 7a_100011216239_100000210202 [1,1,0,0,0,0|2,0,0]=4 6140 B12R1.44 CCOc1cc(c(c(c1)C)N)C 34a_100011934200_100000210202 [1,1,0,0,0,0|2,0,0]=4 6141 B12R1.44 CCOc1cc(c(c(c1)C)N)C 7a_100011934200_100000210202 [1,1,0,0,0,0|2,0,0]=4 6142 B12R1.44 CCSc1cc(c(c(c1)Br)O)C 62a_100000210202_100010982682 [1,1,0,0,0,0|1,0,0]=3 6143 B12R1.44 CCSc1cc(c(c(c1)Br)O)C 62a_100010982682_100000210202 [1,1,0,0,0,0|1,0,0]=3 6144 B12R1.44 CCSc1cc(c(c(c1)C)Br)C 62a_100000210202_100012353698 [1,1,0,0,0,0|2,0,0]=4 6145 B12R1.44 CCSc1cc(c(c(c1)C)Br)C 62a_100012353698_100000210202 [1,1,0,0,0,0|2,0,0]=4 6146 B12R1.44 CCSc1cc(c(c(c1)C)C)C 62a_100000210202_200011015895 [1,1,0,0,0,0|2,0,0]=4 6147 B12R1.44 CCSc1cc(c(c(c1)C)C)C 62a_200011015895_100000210202 [1,1,0,0,0,0|2,0,0]=4 6148 B12R1.44 CCSc1cc(c(c(c1)C)F)C 62a_100000210202_100009814169 [1,1,0,0,0,0|2,0,0]=4 6149 B12R1.44 CCSc1cc(c(c(c1)C)F)C 62a_100009814169_100000210202 [1,1,0,0,0,0|2,0,0]=4 6150 B12R1.44 CCSc1cc(c(c(c1)C)N)C 62a_100000210202_100000737279 [1,1,0,0,0,0|2,0,0]=4 6151 B12R1.44 CCSc1cc(c(c(c1)C)N)C 62a_100000737279_100000210202 [1,1,0,0,0,0|2,0,0]=4 6152 B12R1.44 CCSc1cc(c(c(c1)C)O)C 62a_100000210202_100011216129 [1,1,0,0,0,0|1,0,0]=3 6153 B12R1.44 CCSc1cc(c(c(c1)C)O)C 62a_100011216129_100000210202 [1,1,0,0,0,0|1,0,0]=3 6154 B12R1.44 CCSc1cc(c(c(c1)Cl)O)C 62a_100000210202_200015900153 [1,1,0,0,0,0|1,0,0]=3 6155 B12R1.44 CCSc1cc(c(c(c1)Cl)O)C 62a_200015900153_100000210202 [1,1,0,0,0,0|1,0,0]=3 6156 B12R1.44 CCSc1cc(c(c(c1)Cl)O)Cl 62a_100000210202_100012339652 [1,1,0,0,0,0|2,0,0]=4 6157 B12R1.44 CCSc1cc(c(c(c1)Cl)O)Cl 62a_100012339652_100000210202 [1,1,0,0,0,0|2,0,0]=4 6158 B12R1.44 CCSc1cc(c(c(c1)F)F)C 62a_100000210202_200011068660 [1,1,0,0,0,0|2,0,0]=4 6159 B12R1.44 CCSc1cc(c(c(c1)F)F)C 62a_200011068660_100000210202 [1,1,0,0,0,0|2,0,0]=4 6160 B12R1.44 CCSc1cc(c(c(c1)F)F)O 62a_100000210202_100000709865 [1,1,0,0,0,0|2,0,0]=4 6161 B12R1.44 CCSc1cc(c(c(c1)F)F)O 62a_100000709865_100000210202 [1,1,0,0,0,0|2,0,0]=4 6162 B12R1.44 CCSc1cc(c(c(c1)F)N)C 62a_100000210202_100000709789 [1,1,0,0,0,0|2,0,0]=4 6163 B12R1.44 CCSc1cc(c(c(c1)F)N)C 62a_100000709789_100000210202 [1,1,0,0,0,0|2,0,0]=4 6164 B12R1.44 CCSc1cc(c(c(c1)F)N)O 62a_100000210202_100015475841 [1,1,0,0,0,0|2,0,0]=4 6165 B12R1.44 CCSc1cc(c(c(c1)F)N)O 62a_100015475841_100000210202 [1,1,0,0,0,0|2,0,0]=4 6166 B12R1.44 CCSc1cc(c(c(c1)F)O)F 62a_100000210202_100011216917 [1,1,0,0,0,0|2,0,0]=4 6167 B12R1.44 CCSc1cc(c(c(c1)F)O)F 62a_100011216917_100000210202 [1,1,0,0,0,0|2,0,0]=4 6168 B12R1.44 CCSc1cc(c(c(c1)F)O)N 62a_100000210202_100011217383 [1,1,0,0,0,0|2,0,0]=4 6169 B12R1.44 CCSc1cc(c(c(c1)F)O)N 62a_100011217383_100000210202 [1,1,0,0,0,0|2,0,0]=4 6170 B12R1.44 CCSc1cc(c(c(c1)F)O)O 62a_100000210202_100010114375 [1,1,0,0,0,0|1,0,0]=3 6171 B12R1.44 CCSc1cc(c(c(c1)N)F)C 62a_100000210202_100010381932 [1,1,0,0,0,0|2,0,0]=4 6172 B12R1.44 CCSc1cc(c(c(c1)N)F)C 62a_100010381932_100000210202 [1,1,0,0,0,0|2,0,0]=4 6173 B12R1.44 CCSc1cc(c(c(c1)N)N)C 62a_100000210202_100000688557 [1,1,0,0,0,0|2,0,0]=4 6174 B12R1.44 CCSc1cc(c(c(c1)N)N)C 62a_100000688557_100000210202 [1,1,0,0,0,0|2,0,0]=4 6175 B12R1.44 CCSc1cc(c(c(c1)N)O)C 62a_100000210202_100011825904 [1,1,0,0,0,0|1,0,0]=3 6176 B12R1.44 CCSc1cc(c(c(c1)N)O)C 62a_100011825904_100000210202 [1,1,0,0,0,0|1,0,0]=3 6177 B12R1.44 CCSc1cc(c(c(c1)O)N)C 62a_100000210202_100010371313 [1,1,0,0,0,0|2,0,0]=4 6178 B12R1.44 CCSc1cc(c(c(c1)O)N)C 62a_100010371313_100000210202 [1,1,0,0,0,0|2,0,0]=4 6179 B12R1.44 CCSc1cc(c(c(c1)O)O)O 62a_100000210202_100010658518 [1,1,0,0,0,0|1,0,0]=3 6180 B12R1.44 CNCc1cc(c(c(c1)Br)C)C 26a_100102657272_100010068915 [1,1,0,0,0,0|2,0,0]=4 6181 B12R1.44 CNCc1cc(c(c(c1)C)Br)C 207a_100102657272_100012353953 [1,1,0,0,0,0|2,0,0]=4 6182 B12R1.44 CNCc1cc(c(c(c1)C)Br)C 26a_100102657272_100000243743 [1,1,0,0,0,0|2,0,0]=4 6183 B12R1.44 CNCc1cc(c(c(c1)C)Br)C 270004a_106832991635_100012353953 [1,1,0,0,0,0|2,0,0]=4 6184 B12R1.44 CNCc1cc(c(c(c1)C)Cl)C 207a_100102657272_100000102522 [1,1,0,0,0,0|2,0,0]=4 6185 B12R1.44 CNCc1cc(c(c(c1)C)Cl)C 26a_100102657272_100000739557 [1,1,0,0,0,0|2,0,0]=4 6186 B12R1.44 CNCc1cc(c(c(c1)C)Cl)C 270004a_106832991635_100000102522 [1,1,0,0,0,0|2,0,0]=4 6187 B12R1.44 CNCc1cc(c(c(c1)C)F)C 207a_100102657272_100011352458 [1,1,0,0,0,0|2,0,0]=4 6188 B12R1.44 CNCc1cc(c(c(c1)C)F)C 2230a_106832991635_100011352456 [1,1,0,0,0,0|2,0,0]=4 6189 B12R1.44 CNCc1cc(c(c(c1)C)F)C 270004a_106832991635_100011352458 [1,1,0,0,0,0|2,0,0]=4 6190 B12R1.44 CNCc1cc(c(c(c1)C)F)C 34a_100102657272_100011352456 [1,1,0,0,0,0|2,0,0]=4 6191 B12R1.44 CNCc1cc(c(c(c1)C)F)C 7a_106832991635_100011352456 [1,1,0,0,0,0|2,0,0]=4 6192 B12R1.44 CNCc1cc(c(c(c1)F)F)C 207a_100102657272_100000051022 [1,1,0,0,0,0|2,0,0]=4 6193 B12R1.44 CNCc1cc(c(c(c1)F)F)C 270004a_106832991635_100000051022 [1,1,0,0,0,0|2,0,0]=4 6194 B12R1.44 COCc1cc(c(c(c1)C)Br)C 34a_100012339607_200000210301 [1,1,0,0,0,0|2,0,0]=4 6195 B12R1.44 COCc1cc(c(c(c1)C)Br)C 7a_100012339607_200000210301 [1,1,0,0,0,0|2,0,0]=4 6196 B12R1.44 COCc1cc(c(c(c1)C)F)C 34a_100011352455_200000210301 [1,1,0,0,0,0|2,0,0]=4 6197 B12R1.44 COCc1cc(c(c(c1)C)F)C 34a_100138415774_100011352456 [1,1,0,0,0,0|2,0,0]=4 6198 B12R1.44 COCc1cc(c(c(c1)C)F)C 7a_100011352455_200000210301 [1,1,0,0,0,0|2,0,0]=4 6199 B12R1.44 CSCc1cc(c(c(c1)C)F)C 62a_100011352456_200000210301 [1,1,0,0,0,0|2,0,0]=4 6200 B12R1.44 CSCc1cc(c(c(c1)C)F)C 62a_200000210301_100011352456 [1,1,0,0,0,0|2,0,0]=4 6201 B12R1.44 Cc1cc(cc(c1Br)C)CO[13CH3] 34a_100012339607_200025704644 [1,1,0,0,0,0|2,0,0]=4 6202 B12R1.44 Cc1cc(cc(c1Br)C)CO[13CH3] 7a_100012339607_200025704644 [1,1,0,0,0,0|2,0,0]=4 6203 B12R1.44 Cc1cc(cc(c1F)C)CO[13CH3] 34a_100011352455_200025704644 [1,1,0,0,0,0|2,0,0]=4 6204 B12R1.44 Cc1cc(cc(c1F)C)CO[13CH3] 7a_100011352455_200025704644 [1,1,0,0,0,0|2,0,0]=4 6205 B12R1.44 Cc1cc(cc(c1F)C)CS[13CH3] 62a_100011352456_200025704644 [1,1,0,0,0,0|2,0,0]=4 6206 B12R1.44 Cc1cc(cc(c1F)C)CS[13CH3] 62a_200025704644_100011352456 [1,1,0,0,0,0|2,0,0]=4 6207 B12R1.44 Cc1cc(cc(c1O)Br)NCF 34a_100010064301_100015361967 [1,1,0,0,0,0|2,0,0]=4 6208 B12R1.44 Cc1cc(cc(c1O)Br)NCF 7a_100010064301_100015361967 [1,1,0,0,0,0|2,0,0]=4 6209 B12R1.44 Cc1cc(cc(c1O)Br)SCF 62a_100010982682_100015361967 [1,1,0,0,0,0|2,0,0]=4 6210 B12R1.44 Cc1cc(cc(c1O)Br)SCF 62a_100015361967_100010982682 [1,1,0,0,0,0|2,0,0]=4 6211 B12R1.44 Cc1cc(cc(c1O)C)NCF 34a_100000703291_100015361967 [1,1,0,0,0,0|2,0,0]=4 6212 B12R1.44 Cc1cc(cc(c1O)C)NCF 7a_100000703291_100015361967 [1,1,0,0,0,0|2,0,0]=4 6213 B12R1.44 Cc1cc(cc(c1O)C)SCF 62a_100011216129_100015361967 [1,1,0,0,0,0|2,0,0]=4 6214 B12R1.44 Cc1cc(cc(c1O)C)SCF 62a_100015361967_100011216129 [1,1,0,0,0,0|2,0,0]=4 6215 B12R1.44 Cc1cc(cc(c1O)Cl)SCF 62a_100015361967_200015900153 [1,1,0,0,0,0|2,0,0]=4 6216 B12R1.44 Cc1cc(cc(c1O)Cl)SCF 62a_200015900153_100015361967 [1,1,0,0,0,0|2,0,0]=4 6217 B12R1.44 Cc1cc(cc(c1O)N)SCF 62a_100011825904_100015361967 [1,1,0,0,0,0|2,0,0]=4 6218 B12R1.44 Cc1cc(cc(c1O)N)SCF 62a_100015361967_100011825904 [1,1,0,0,0,0|2,0,0]=4 6219 B12R1.44 Oc1cc(cc(c1O)F)SCF 62a_100015361967_100010114375 [1,1,0,0,0,0|2,0,0]=4 6220 B12R1.44 Oc1cc(cc(c1O)O)SCF 62a_100015361967_100010658518 [1,1,0,0,0,0|2,0,0]=4 6221 B12R1.288 C=Cc1ccc(cc1C)NCC 271570a_100011290941_100015183089 [1,1,0,0,0,0|2,0,0]=4 6222 B12R1.288 C=Cc1ccc(cc1C)OCC 271570a_100011290941_100012344538 [1,1,0,0,0,0|2,0,0]=4 6223 B12R1.288 C=Cc1ccc(cc1F)CCC 271570a_100011290941_200010686677 [1,1,0,0,0,0|2,0,0]=4 6224 B12R1.288 CC=Cc1ccc(c(c1)C)CO 271570a_100016259895_100000748258 [1,1,0,0,0,0|0,0,2]=4 6225 B12R1.288 CC=Cc1ccc(c(c1)C)OC 271570a_100016259895_100011219705 [1,1,0,0,0,0|0,0,2]=4 6226 B12R1.288 CC=Cc1ccc(c(c1)O)CO 271570a_100016259895_100000071718 [1,1,0,0,0,0|0,0,2]=4 6227 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [1,1,0,0,0,0|0,0,2]=4 6228 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200000210301_200010686677 [1,1,0,0,0,0|1,1,0]=4 6229 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200010686677_200000210301 [1,1,0,0,0,0|1,1,0]=4 6230 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200010686677_200025704644 [1,1,0,0,0,0|1,1,0]=4 6231 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_200010686677 [1,1,0,0,0,0|1,1,0]=4 6232 B12R1.288 CCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210202 [1,1,0,0,0,0|2,0,0]=4 6233 B12R1.288 CCNc1ccc(c(c1)C)C#N 34a_100011999795_100000210202 [1,1,0,0,0,0|2,0,0]=4 6234 B12R1.288 CCNc1ccc(c(c1)C)C#N 7a_100011999795_100000210202 [1,1,0,0,0,0|2,0,0]=4 6235 B12R1.288 CCNc1ccc(c(c1)C)CO 34a_100000102464_100000210202 [1,1,0,0,0,0|1,0,0]=3 6236 B12R1.288 CCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210202 [1,1,0,0,0,0|1,0,0]=3 6237 B12R1.288 CCNc1ccc(c(c1)C)OC 34a_100000743268_100000210202 [1,1,0,0,0,0|1,0,0]=3 6238 B12R1.288 CCNc1ccc(c(c1)C)OC 7a_100000743268_100000210202 [1,1,0,0,0,0|1,0,0]=3 6239 B12R1.288 CCNc1ccc(c(c1)C)SC 62a_100015183089_200000210301 [1,1,0,0,0,0|1,1,0]=4 6240 B12R1.288 CCNc1ccc(c(c1)C)SC 62a_200000210301_100015183089 [1,1,0,0,0,0|1,1,0]=4 6241 B12R1.288 CCNc1ccc(c(c1)C)S[13CH3] 62a_100015183089_200025704644 [1,1,0,0,0,0|1,1,0]=4 6242 B12R1.288 CCNc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100015183089 [1,1,0,0,0,0|1,1,0]=4 6243 B12R1.288 CCNc1ccc(c(c1)Cl)CO 34a_100000689119_100000210202 [1,1,0,0,0,0|2,0,0]=4 6244 B12R1.288 CCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210202 [1,1,0,0,0,0|2,0,0]=4 6245 B12R1.288 CCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210202 [1,1,0,0,0,0|2,0,0]=4 6246 B12R1.288 CCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210202 [1,1,0,0,0,0|2,0,0]=4 6247 B12R1.288 CCNc1ccc(c(c1)F)OC 34a_100000740183_100000210202 [1,1,0,0,0,0|2,0,0]=4 6248 B12R1.288 CCNc1ccc(c(c1)I)OC 34a_100011356947_100000210202 [1,1,0,0,0,0|2,0,0]=4 6249 B12R1.288 CCNc1ccc(c(c1)O)C#N 34a_100000094571_100000210202 [1,1,0,0,0,0|2,0,0]=4 6250 B12R1.288 CCNc1ccc(c(c1)O)C#N 7a_100000094571_100000210202 [1,1,0,0,0,0|2,0,0]=4 6251 B12R1.288 CCNc1ccc(c(c1)O)OC 34a_100000211920_100000210202 [1,1,0,0,0,0|1,0,0]=3 6252 B12R1.288 CCOc1ccc(c(c1)Br)CO 34a_100010146404_100000210202 [1,1,0,0,0,0|2,0,0]=4 6253 B12R1.288 CCOc1ccc(c(c1)Br)CO 7a_100010146404_100000210202 [1,1,0,0,0,0|2,0,0]=4 6254 B12R1.288 CCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210202 [1,1,0,0,0,0|2,0,0]=4 6255 B12R1.288 CCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210202 [1,1,0,0,0,0|2,0,0]=4 6256 B12R1.288 CCOc1ccc(c(c1)C)C#N 34a_100000720286_100000210202 [1,1,0,0,0,0|2,0,0]=4 6257 B12R1.288 CCOc1ccc(c(c1)C)C#N 7a_100000720286_100000210202 [1,1,0,0,0,0|2,0,0]=4 6258 B12R1.288 CCOc1ccc(c(c1)C)NC 2230a_100000742753_200000210301 [1,1,0,0,0,0|2,0,0]=4 6259 B12R1.288 CCOc1ccc(c(c1)C)NC 34a_100000742753_200000210301 [1,1,0,0,0,0|2,0,0]=4 6260 B12R1.288 CCOc1ccc(c(c1)C)NC 34a_100161107805_100000210202 [1,1,0,0,0,0|2,0,0]=4 6261 B12R1.288 CCOc1ccc(c(c1)C)NC 7a_100161107805_100000210202 [1,1,0,0,0,0|2,0,0]=4 6262 B12R1.288 CCOc1ccc(c(c1)C)N[13CH3] 2230a_100000742753_200025704644 [1,1,0,0,0,0|2,0,0]=4 6263 B12R1.288 CCOc1ccc(c(c1)C)N[13CH3] 34a_100000742753_200025704644 [1,1,0,0,0,0|2,0,0]=4 6264 B12R1.288 CCOc1ccc(c(c1)C)OC 34a_100000759738_100000210202 [1,1,0,0,0,0|1,0,0]=3 6265 B12R1.288 CCOc1ccc(c(c1)C)OC 7a_100000759738_100000210202 [1,1,0,0,0,0|1,0,0]=3 6266 B12R1.288 CCOc1ccc(c(c1)C)SC 34a_100000030144_100000210202 [1,1,0,0,0,0|1,1,0]=4 6267 B12R1.288 CCOc1ccc(c(c1)C)SC 62a_200000210301_100012344538 [1,1,0,0,0,0|1,1,0]=4 6268 B12R1.288 CCOc1ccc(c(c1)C)S[13CH3] 62a_200025704644_100012344538 [1,1,0,0,0,0|1,1,0]=4 6269 B12R1.288 CCOc1ccc(c(c1)Cl)CO 34a_200000075811_100000210202 [1,1,0,0,0,0|2,0,0]=4 6270 B12R1.288 CCOc1ccc(c(c1)Cl)CO 7a_200000075811_100000210202 [1,1,0,0,0,0|2,0,0]=4 6271 B12R1.288 CCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210202 [1,1,0,0,0,0|2,0,0]=4 6272 B12R1.288 CCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210202 [1,1,0,0,0,0|2,0,0]=4 6273 B12R1.288 CCOc1ccc(c(c1)F)CO 34a_100000084598_100000210202 [1,1,0,0,0,0|2,0,0]=4 6274 B12R1.288 CCOc1ccc(c(c1)F)CO 7a_100000084598_100000210202 [1,1,0,0,0,0|2,0,0]=4 6275 B12R1.288 CCOc1ccc(c(c1)F)OC 34a_100000746305_100000210202 [1,1,0,0,0,0|2,0,0]=4 6276 B12R1.288 CCOc1ccc(c(c1)F)OC 7a_100000746305_100000210202 [1,1,0,0,0,0|2,0,0]=4 6277 B12R1.288 CCOc1ccc(c(c1)I)OC 34a_100010084122_100000210202 [1,1,0,0,0,0|2,0,0]=4 6278 B12R1.288 CCOc1ccc(c(c1)I)OC 7a_100010084122_100000210202 [1,1,0,0,0,0|2,0,0]=4 6279 B12R1.288 CCOc1ccc(c(c1)O)C=O 271570a_203496583355_200012721597 [1,1,0,0,0,0|1,0,1]=4 6280 B12R1.288 CCSc1cc(c(cn1)CO)C 62a_100000210202_100010277336 [1,1,0,0,0,0|2,0,0]=4 6281 B12R1.288 CCSc1cc(c(cn1)CO)C 62a_100010277336_100000210202 [1,1,0,0,0,0|2,0,0]=4 6282 B12R1.288 CCSc1cc(c(cn1)OC)O 62a_100000210202_100010264082 [1,1,0,0,0,0|2,0,0]=4 6283 B12R1.288 CCSc1ccc(c(c1)Br)CO 62a_100000210202_100010240206 [1,1,0,0,0,0|2,0,0]=4 6284 B12R1.288 CCSc1ccc(c(c1)Br)CO 62a_100010240206_100000210202 [1,1,0,0,0,0|2,0,0]=4 6285 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100000210202_100011249507 [1,1,0,0,0,0|2,0,0]=4 6286 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210202 [1,1,0,0,0,0|2,0,0]=4 6287 B12R1.288 CCSc1ccc(c(c1)C)C#N 62a_100000210202_100000687762 [1,1,0,0,0,0|2,0,0]=4 6288 B12R1.288 CCSc1ccc(c(c1)C)C=O 62a_100000210202_100000766358 [1,1,0,0,0,0|1,0,1]=4 6289 B12R1.288 CCSc1ccc(c(c1)C)C=O 62a_100000766358_100000210202 [1,1,0,0,0,0|1,0,1]=4 6290 B12R1.288 CCSc1ccc(c(c1)C)CF 62a_100000210202_200010711859 [1,1,0,0,0,0|2,0,0]=4 6291 B12R1.288 CCSc1ccc(c(c1)C)CF 62a_200010711859_100000210202 [1,1,0,0,0,0|2,0,0]=4 6292 B12R1.288 CCSc1ccc(c(c1)C)CN 62a_100000210202_100000753881 [1,1,0,0,0,0|2,0,0]=4 6293 B12R1.288 CCSc1ccc(c(c1)C)CN 62a_100000753881_100000210202 [1,1,0,0,0,0|2,0,0]=4 6294 B12R1.288 CCSc1ccc(c(c1)C)CO 62a_100000210202_100000748258 [1,1,0,0,0,0|1,0,0]=3 6295 B12R1.288 CCSc1ccc(c(c1)C)CO 62a_100000748258_100000210202 [1,1,0,0,0,0|1,0,0]=3 6296 B12R1.288 CCSc1ccc(c(c1)C)NC 62a_100000210202_100000221803 [1,1,0,0,0,0|2,0,0]=4 6297 B12R1.288 CCSc1ccc(c(c1)C)NC 62a_100000221803_100000210202 [1,1,0,0,0,0|2,0,0]=4 6298 B12R1.288 CCSc1ccc(c(c1)C)NN 62a_100000210202_100000751375 [1,1,0,0,0,0|2,0,0]=4 6299 B12R1.288 CCSc1ccc(c(c1)C)NN 62a_100000751375_100000210202 [1,1,0,0,0,0|2,0,0]=4 6300 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100000210202_100011219705 [1,1,0,0,0,0|1,0,0]=3 6301 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100011219705_100000210202 [1,1,0,0,0,0|1,0,0]=3 6302 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100000210202_100012355395 [1,1,0,0,0,0|2,0,0]=4 6303 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210202 [1,1,0,0,0,0|2,0,0]=4 6304 B12R1.288 CCSc1ccc(c(c1)F)CO 62a_100000210202_100011191541 [1,1,0,0,0,0|2,0,0]=4 6305 B12R1.288 CCSc1ccc(c(c1)F)CO 62a_100011191541_100000210202 [1,1,0,0,0,0|2,0,0]=4 6306 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000171752_100000210202 [1,1,0,0,0,0|2,0,0]=4 6307 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000210202_100000171752 [1,1,0,0,0,0|2,0,0]=4 6308 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000210202_100000718831 [1,1,0,0,0,0|2,0,0]=4 6309 B12R1.288 CCSc1ccc(c(c1)N)CO 62a_100000718831_100000210202 [1,1,0,0,0,0|2,0,0]=4 6310 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100000210202_100011249504 [1,1,0,0,0,0|2,0,0]=4 6311 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100011249504_100000210202 [1,1,0,0,0,0|2,0,0]=4 6312 B12R1.288 CCSc1ccc(c(c1)O)C#N 62a_100000210202_100011934713 [1,1,0,0,0,0|2,0,0]=4 6313 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100000210202_100011277552 [1,1,0,0,0,0|1,0,1]=4 6314 B12R1.288 CCSc1ccc(c(c1)O)C=O 62a_100011277552_100000210202 [1,1,0,0,0,0|1,0,1]=4 6315 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000071718_100000210202 [1,1,0,0,0,0|1,0,0]=3 6316 B12R1.288 CCSc1ccc(c(c1)O)CO 62a_100000210202_100000071718 [1,1,0,0,0,0|1,0,0]=3 6317 B12R1.288 CCSc1ccc(c(c1)O)OC 62a_100000210202_100009816560 [1,1,0,0,0,0|1,0,0]=3 6318 B12R1.288 CCSc1ccc(c(n1)C)OC 62a_100000210202_100010244750 [1,1,0,0,0,0|2,0,0]=4 6319 B12R1.288 CCSc1ccc(c(n1)C)OC 62a_100010244750_100000210202 [1,1,0,0,0,0|2,0,0]=4 6320 B12R1.288 CCSc1cnc(c(c1)C)CO 62a_100000210202_100010116297 [1,1,0,0,0,0|2,0,0]=4 6321 B12R1.288 CCSc1cnc(c(c1)C)CO 62a_100010116297_100000210202 [1,1,0,0,0,0|2,0,0]=4 6322 B12R1.288 CCSc1cnc(c(c1)C)OC 62a_100000210202_100011290809 [1,1,0,0,0,0|2,0,0]=4 6323 B12R1.288 CCSc1cnc(c(c1)C)OC 62a_100011290809_100000210202 [1,1,0,0,0,0|2,0,0]=4 6324 B12R1.288 CCSc1cnc(c(c1)O)OC 62a_100000210202_100010135713 [1,1,0,0,0,0|2,0,0]=4 6325 B12R1.288 CNCc1ccc(c(c1)Br)CO 26a_100102657272_100010146404 [1,1,0,0,0,0|2,0,0]=4 6326 B12R1.288 CNCc1ccc(c(c1)Br)OC 207a_100102657272_100000173361 [1,1,0,0,0,0|2,0,0]=4 6327 B12R1.288 CNCc1ccc(c(c1)Br)OC 2230a_106832991635_200011397701 [1,1,0,0,0,0|2,0,0]=4 6328 B12R1.288 CNCc1ccc(c(c1)Br)OC 26a_100102657272_100010234764 [1,1,0,0,0,0|2,0,0]=4 6329 B12R1.288 CNCc1ccc(c(c1)Br)OC 270004a_106832991635_100000173361 [1,1,0,0,0,0|2,0,0]=4 6330 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100102657272_200011397701 [1,1,0,0,0,0|2,0,0]=4 6331 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100159240714_200000210301 [1,1,0,0,0,0|2,0,0]=4 6332 B12R1.288 CNCc1ccc(c(c1)Br)OC 7a_106832991635_200011397701 [1,1,0,0,0,0|2,0,0]=4 6333 B12R1.288 CNCc1ccc(c(c1)C)C#N 207a_100102657272_100000720088 [1,1,0,0,0,0|2,0,0]=4 6334 B12R1.288 CNCc1ccc(c(c1)C)C#N 270004a_106832991635_100000720088 [1,1,0,0,0,0|2,0,0]=4 6335 B12R1.288 CNCc1ccc(c(c1)C)OC 207a_100102657272_100000239718 [1,1,0,0,0,0|1,0,0]=3 6336 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_100102679029_200000210301 [1,1,0,0,0,0|1,0,0]=3 6337 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_106832991635_200011290836 [1,1,0,0,0,0|1,0,0]=3 6338 B12R1.288 CNCc1ccc(c(c1)C)OC 270004a_106832991635_100000239718 [1,1,0,0,0,0|1,0,0]=3 6339 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102657272_200011290836 [1,1,0,0,0,0|1,0,0]=3 6340 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102679029_200000210301 [1,1,0,0,0,0|1,0,0]=3 6341 B12R1.288 CNCc1ccc(c(c1)C)OC 7a_106832991635_200011290836 [1,1,0,0,0,0|1,0,0]=3 6342 B12R1.288 CNCc1ccc(c(c1)Cl)CO 26a_100102657272_200000075811 [1,1,0,0,0,0|2,0,0]=4 6343 B12R1.288 CNCc1ccc(c(c1)Cl)OC 207a_100102657272_100000186747 [1,1,0,0,0,0|2,0,0]=4 6344 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_100000008799_200000210301 [1,1,0,0,0,0|2,0,0]=4 6345 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_106832991635_100000693707 [1,1,0,0,0,0|2,0,0]=4 6346 B12R1.288 CNCc1ccc(c(c1)Cl)OC 26a_100102657272_200009861682 [1,1,0,0,0,0|2,0,0]=4 6347 B12R1.288 CNCc1ccc(c(c1)Cl)OC 270004a_106832991635_100000186747 [1,1,0,0,0,0|2,0,0]=4 6348 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100000008799_200000210301 [1,1,0,0,0,0|2,0,0]=4 6349 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100102657272_100000693707 [1,1,0,0,0,0|2,0,0]=4 6350 B12R1.288 CNCc1ccc(c(c1)Cl)OC 7a_106832991635_100000693707 [1,1,0,0,0,0|2,0,0]=4 6351 B12R1.288 CNCc1ccc(c(c1)F)OC 207a_100102657272_100000204617 [1,1,0,0,0,0|2,0,0]=4 6352 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_100000737316_200000210301 [1,1,0,0,0,0|2,0,0]=4 6353 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_106832991635_100000189595 [1,1,0,0,0,0|2,0,0]=4 6354 B12R1.288 CNCc1ccc(c(c1)F)OC 270004a_106832991635_100000204617 [1,1,0,0,0,0|2,0,0]=4 6355 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100000737316_200000210301 [1,1,0,0,0,0|2,0,0]=4 6356 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100102657272_100000189595 [1,1,0,0,0,0|2,0,0]=4 6357 B12R1.288 CNCc1ccc(c(c1)F)OC 7a_106832991635_100000189595 [1,1,0,0,0,0|2,0,0]=4 6358 B12R1.288 CNCc1ccc(c(c1)I)OC 207a_100102657272_100009827998 [1,1,0,0,0,0|2,0,0]=4 6359 B12R1.288 CNCc1ccc(c(c1)I)OC 270004a_106832991635_100009827998 [1,1,0,0,0,0|2,0,0]=4 6360 B12R1.288 CNCc1ccc(c(c1)O)OC 34a_100000740000_200000210301 [1,1,0,0,0,0|1,0,0]=3 6361 B12R1.288 CNCc1cnc(c(c1)C)OC 207a_100102657272_100012183433 [1,1,0,0,0,0|2,0,0]=4 6362 B12R1.288 CNCc1cnc(c(c1)C)OC 270004a_106832991635_100012183433 [1,1,0,0,0,0|2,0,0]=4 6363 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100000246451_200000210301 [1,1,0,0,0,0|2,0,0]=4 6364 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100138415774_200011397701 [1,1,0,0,0,0|2,0,0]=4 6365 B12R1.288 COCc1ccc(c(c1)Br)OC 7a_100000246451_200000210301 [1,1,0,0,0,0|2,0,0]=4 6366 B12R1.288 COCc1ccc(c(c1)C)OC 34a_100138415774_200011290836 [1,1,0,0,0,0|1,0,0]=3 6367 B12R1.288 COCc1ccc(c(c1)C)OC 34a_200011290855_200000210301 [1,1,0,0,0,0|1,0,0]=3 6368 B12R1.288 COCc1ccc(c(c1)C)OC 7a_200011290855_200000210301 [1,1,0,0,0,0|1,0,0]=3 6369 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100000694469_200000210301 [1,1,0,0,0,0|2,0,0]=4 6370 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100138415774_100000693707 [1,1,0,0,0,0|2,0,0]=4 6371 B12R1.288 COCc1ccc(c(c1)Cl)OC 7a_100000694469_200000210301 [1,1,0,0,0,0|2,0,0]=4 6372 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100000246395_200000210301 [1,1,0,0,0,0|2,0,0]=4 6373 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100138415774_100000189595 [1,1,0,0,0,0|2,0,0]=4 6374 B12R1.288 COCc1ccc(c(c1)F)OC 7a_100000246395_200000210301 [1,1,0,0,0,0|2,0,0]=4 6375 B12R1.288 COCc1ccc(c(c1)I)OC 34a_200000013966_200000210301 [1,1,0,0,0,0|2,0,0]=4 6376 B12R1.288 COCc1ccc(c(c1)I)OC 7a_200000013966_200000210301 [1,1,0,0,0,0|2,0,0]=4 6377 B12R1.288 COCc1ccc(c(c1)N)OC 34a_100011269841_200000210301 [1,1,0,0,0,0|2,0,0]=4 6378 B12R1.288 COc1ccc(cc1Br)CN[13CH3] 34a_100159240714_200025704644 [1,1,0,0,0,0|2,0,0]=4 6379 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 34a_100000246451_200025704644 [1,1,0,0,0,0|2,0,0]=4 6380 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 7a_100000246451_200025704644 [1,1,0,0,0,0|2,0,0]=4 6381 B12R1.288 COc1ccc(cc1Br)CSC 62a_200000210301_200011397701 [1,1,0,0,0,0|2,0,0]=4 6382 B12R1.288 COc1ccc(cc1Br)CSC 62a_200011397701_200000210301 [1,1,0,0,0,0|2,0,0]=4 6383 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200011397701_200025704644 [1,1,0,0,0,0|2,0,0]=4 6384 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200025704644_200011397701 [1,1,0,0,0,0|2,0,0]=4 6385 B12R1.288 COc1ccc(cc1C)CN[13CH3] 2230a_100102679029_200025704644 [1,1,0,0,0,0|1,0,0]=3 6386 B12R1.288 COc1ccc(cc1C)CN[13CH3] 34a_100102679029_200025704644 [1,1,0,0,0,0|1,0,0]=3 6387 B12R1.288 COc1ccc(cc1C)CO[13CH3] 34a_200011290855_200025704644 [1,1,0,0,0,0|1,0,0]=3 6388 B12R1.288 COc1ccc(cc1C)CO[13CH3] 7a_200011290855_200025704644 [1,1,0,0,0,0|1,0,0]=3 6389 B12R1.288 COc1ccc(cc1C)CSC 62a_200000210301_200011290836 [1,1,0,0,0,0|1,0,0]=3 6390 B12R1.288 COc1ccc(cc1C)CSC 62a_200011290836_200000210301 [1,1,0,0,0,0|1,0,0]=3 6391 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200011290836_200025704644 [1,1,0,0,0,0|1,0,0]=3 6392 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200025704644_200011290836 [1,1,0,0,0,0|1,0,0]=3 6393 B12R1.288 COc1ccc(cc1C)NCF 34a_100000743268_100015361967 [1,1,0,0,0,0|2,0,0]=4 6394 B12R1.288 COc1ccc(cc1C)NCF 7a_100000743268_100015361967 [1,1,0,0,0,0|2,0,0]=4 6395 B12R1.288 COc1ccc(cc1C)OCF 34a_100000759738_100015361967 [1,1,0,0,0,0|2,0,0]=4 6396 B12R1.288 COc1ccc(cc1C)OCF 7a_100000759738_100015361967 [1,1,0,0,0,0|2,0,0]=4 6397 B12R1.288 COc1ccc(cc1C)SCF 62a_100011219705_100015361967 [1,1,0,0,0,0|2,0,0]=4 6398 B12R1.288 COc1ccc(cc1C)SCF 62a_100015361967_100011219705 [1,1,0,0,0,0|2,0,0]=4 6399 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 2230a_100000008799_200025704644 [1,1,0,0,0,0|2,0,0]=4 6400 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 34a_100000008799_200025704644 [1,1,0,0,0,0|2,0,0]=4 6401 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 34a_100000694469_200025704644 [1,1,0,0,0,0|2,0,0]=4 6402 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 7a_100000694469_200025704644 [1,1,0,0,0,0|2,0,0]=4 6403 B12R1.288 COc1ccc(cc1Cl)CSC 62a_100000693707_200000210301 [1,1,0,0,0,0|2,0,0]=4 6404 B12R1.288 COc1ccc(cc1Cl)CSC 62a_200000210301_100000693707 [1,1,0,0,0,0|2,0,0]=4 6405 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_100000693707_200025704644 [1,1,0,0,0,0|2,0,0]=4 6406 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100000693707 [1,1,0,0,0,0|2,0,0]=4 6407 B12R1.288 COc1ccc(cc1F)CN[13CH3] 2230a_100000737316_200025704644 [1,1,0,0,0,0|2,0,0]=4 6408 B12R1.288 COc1ccc(cc1F)CN[13CH3] 34a_100000737316_200025704644 [1,1,0,0,0,0|2,0,0]=4 6409 B12R1.288 COc1ccc(cc1F)CO[13CH3] 34a_100000246395_200025704644 [1,1,0,0,0,0|2,0,0]=4 6410 B12R1.288 COc1ccc(cc1F)CO[13CH3] 7a_100000246395_200025704644 [1,1,0,0,0,0|2,0,0]=4 6411 B12R1.288 COc1ccc(cc1F)CSC 62a_100000189595_200000210301 [1,1,0,0,0,0|2,0,0]=4 6412 B12R1.288 COc1ccc(cc1F)CSC 62a_200000210301_100000189595 [1,1,0,0,0,0|2,0,0]=4 6413 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_100000189595_200025704644 [1,1,0,0,0,0|2,0,0]=4 6414 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_200025704644_100000189595 [1,1,0,0,0,0|2,0,0]=4 6415 B12R1.288 COc1ccc(cc1I)CO[13CH3] 34a_200000013966_200025704644 [1,1,0,0,0,0|2,0,0]=4 6416 B12R1.288 COc1ccc(cc1I)CO[13CH3] 7a_200000013966_200025704644 [1,1,0,0,0,0|2,0,0]=4 6417 B12R1.288 COc1ccc(cc1N)CO[13CH3] 34a_100011269841_200025704644 [1,1,0,0,0,0|2,0,0]=4 6418 B12R1.288 COc1ccc(cc1O)CC#N 271570a_203496583355_100011215974 [1,1,0,0,0,0|1,0,1]=4 6419 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [1,1,0,0,0,0|1,0,0]=3 6420 B12R1.288 COc1ccc(cc1O)CCO 271570a_203496583355_100011962876 [1,1,0,0,0,0|1,0,0]=3 6421 B12R1.288 COc1ccc(cc1O)CN[13CH3] 34a_100000740000_200025704644 [1,1,0,0,0,0|1,0,0]=3 6422 B12R1.288 COc1ccc(cc1O)NCF 34a_100000211920_100015361967 [1,1,0,0,0,0|2,0,0]=4 6423 B12R1.288 COc1ccc(cc1O)SCF 62a_100015361967_100009816560 [1,1,0,0,0,0|2,0,0]=4 6424 B12R1.288 Cc1cc(ccc1CO)NCF 34a_100000102464_100015361967 [1,1,0,0,0,0|2,0,0]=4 6425 B12R1.288 Cc1cc(ccc1CO)SCF 62a_100000748258_100015361967 [1,1,0,0,0,0|2,0,0]=4 6426 B12R1.288 Cc1cc(ccc1CO)SCF 62a_100015361967_100000748258 [1,1,0,0,0,0|2,0,0]=4 6427 B12R1.288 OCc1ccc(cc1O)SCF 62a_100000071718_100015361967 [1,1,0,0,0,0|2,0,0]=4 6428 B12R1.288 OCc1ccc(cc1O)SCF 62a_100015361967_100000071718 [1,1,0,0,0,0|2,0,0]=4 6429 B12R1.367 CCC(=O)c1ccc(c(c1)Br)O 1458a_100000189672_100000210202 [1,1,0,0,0,0|1,0,1]=4 6430 B12R1.367 CCC(=O)c1ccc(c(c1)C)Br 1458a_100000692631_100000210202 [1,1,0,0,0,0|1,0,1]=4 6431 B12R1.367 CCC(=O)c1ccc(c(c1)C)C 1458a_100000210898_100000210202 [1,1,0,0,0,0|1,0,1]=4 6432 B12R1.367 CCC(=O)c1ccc(c(c1)C)Cl 1458a_100000686306_100000210202 [1,1,0,0,0,0|1,0,1]=4 6433 B12R1.367 CCC(=O)c1ccc(c(c1)C)F 1458a_100000751819_100000210202 [1,1,0,0,0,0|1,0,1]=4 6434 B12R1.367 CCC(=O)c1ccc(c(c1)C)I 1458a_100000751300_100000210202 [1,1,0,0,0,0|1,0,1]=4 6435 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 1458a_100000685612_100000210202 [1,1,0,0,0,0|0,0,1]=3 6436 B12R1.367 CCC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200012349626 [1,1,0,0,0,0|0,0,1]=3 6437 B12R1.367 CCC(=O)c1ccc(c(c1)Cl)O 1458a_100000212196_100000210202 [1,1,0,0,0,0|1,0,1]=4 6438 B12R1.367 CCC(=O)c1ccc(c(c1)F)O 1458a_100000185466_100000210202 [1,1,0,0,0,0|1,0,1]=4 6439 B12R1.367 CCC(=O)c1ccc(c(c1)I)O 1458a_100000037485_100000210202 [1,1,0,0,0,0|1,0,1]=4 6440 B12R1.367 CCC(=O)c1ccc(c(c1)O)Br 1458a_100000689001_100000210202 [1,1,0,0,0,0|1,0,1]=4 6441 B12R1.367 CCC(=O)c1ccc(c(c1)O)C 1458a_100000233767_100000210202 [1,1,0,0,0,0|1,0,1]=4 6442 B12R1.367 CCC(=O)c1ccc(c(c1)O)Cl 1458a_100011933997_100000210202 [1,1,0,0,0,0|1,0,1]=4 6443 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 1458a_100000035894_100000210202 [1,1,0,0,0,0|1,0,1]=4 6444 B12R1.367 CCC(=O)c1ccc(c(c1)O)F 271570a_203496583355_100011216493 [1,1,0,0,0,0|1,0,1]=4 6445 B12R1.367 CCC(=O)c1ccc(c(c1)O)I 1458a_100000239334_100000210202 [1,1,0,0,0,0|1,0,1]=4 6446 B12R1.367 CCC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000210202 [1,1,0,0,0,0|0,0,1]=3 6447 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100015183089_200000210301 [1,1,0,0,0,0|2,0,0]=4 6448 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 2230a_100102888905_100000210202 [1,1,0,0,0,0|2,0,0]=4 6449 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100015183089_200000210301 [1,1,0,0,0,0|2,0,0]=4 6450 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 269982a_100102888905_100000204670 [1,1,0,0,0,0|2,0,0]=4 6451 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100015183089_200000210301 [1,1,0,0,0,0|2,0,0]=4 6452 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 34a_100102888905_100000210202 [1,1,0,0,0,0|2,0,0]=4 6453 B12R1.367 CCN(C)c1ccc(c(c1)C)Br 7a_100015183089_200000210301 [1,1,0,0,0,0|2,0,0]=4 6454 B12R1.367 CCN(C)c1ccc(c(c1)C)C 2230a_106256033975_200000210301 [1,1,0,0,0,0|2,0,0]=4 6455 B12R1.367 CCN(C)c1ccc(c(c1)C)C 269982a_106256033975_200000210301 [1,1,0,0,0,0|2,0,0]=4 6456 B12R1.367 CCN(C)c1ccc(c(c1)C)C 34a_106256033975_200000210301 [1,1,0,0,0,0|2,0,0]=4 6457 B12R1.367 CCN(C)c1ccc(c(c1)C)C 7a_106256033975_200000210301 [1,1,0,0,0,0|2,0,0]=4 6458 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 2230a_114849113799_100000210202 [1,1,0,0,0,0|2,0,0]=4 6459 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 269982a_114849113799_100000204670 [1,1,0,0,0,0|2,0,0]=4 6460 B12R1.367 CCN(C)c1ccc(c(c1)C)Cl 34a_114849113799_100000210202 [1,1,0,0,0,0|2,0,0]=4 6461 B12R1.367 CCN(C)c1ccc(c(c1)C)F 2230a_100011756966_100000210202 [1,1,0,0,0,0|2,0,0]=4 6462 B12R1.367 CCN(C)c1ccc(c(c1)C)F 269982a_100011756966_100000204670 [1,1,0,0,0,0|2,0,0]=4 6463 B12R1.367 CCN(C)c1ccc(c(c1)C)F 34a_100011756966_100000210202 [1,1,0,0,0,0|2,0,0]=4 6464 B12R1.367 CCN(C)c1ccc(c(c1)C)F 38a_100011756966_100000204670 [1,1,0,0,0,0|2,0,0]=4 6465 B12R1.367 CCN(C)c1ccc(c(c1)C)F 7a_100011756966_100000210202 [1,1,0,0,0,0|2,0,0]=4 6466 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 2230a_100015183089_200025704644 [1,1,0,0,0,0|2,0,0]=4 6467 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 269982a_100015183089_200025704644 [1,1,0,0,0,0|2,0,0]=4 6468 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 34a_100015183089_200025704644 [1,1,0,0,0,0|2,0,0]=4 6469 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)Br 7a_100015183089_200025704644 [1,1,0,0,0,0|2,0,0]=4 6470 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 2230a_106256033975_200025704644 [1,1,0,0,0,0|2,0,0]=4 6471 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 269982a_106256033975_200025704644 [1,1,0,0,0,0|2,0,0]=4 6472 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 34a_106256033975_200025704644 [1,1,0,0,0,0|2,0,0]=4 6473 B12R1.367 CCN([13CH3])c1ccc(c(c1)C)C 7a_106256033975_200025704644 [1,1,0,0,0,0|2,0,0]=4 6474 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 240690a_100102657272_100000685612 [1,1,0,0,0,0|1,0,1]=4 6475 B12R1.367 CNC(=O)c1ccc(c(c1)C)O 271570a_203496583355_200013065384 [1,1,0,0,0,0|1,0,1]=4 6476 B12R1.367 CNC(C)c1ccc(c(c1)Br)O 269862a_106832991636_100011772453 [1,1,0,0,0,0|2,0,0]=4 6477 B12R1.367 CNC(C)c1ccc(c(c1)C)Br 269862a_106832991636_100000697869 [1,1,0,0,0,0|2,0,0]=4 6478 B12R1.367 CNC(C)c1ccc(c(c1)C)C 269862a_106832991636_100000210971 [1,1,0,0,0,0|2,0,0]=4 6479 B12R1.367 CNC(C)c1ccc(c(c1)C)Cl 269862a_106832991636_100011216000 [1,1,0,0,0,0|2,0,0]=4 6480 B12R1.367 CNC(C)c1ccc(c(c1)C)F 2230a_100000705826_200000210301 [1,1,0,0,0,0|2,0,0]=4 6481 B12R1.367 CNC(C)c1ccc(c(c1)C)F 269862a_106832991636_100000754758 [1,1,0,0,0,0|2,0,0]=4 6482 B12R1.367 CNC(C)c1ccc(c(c1)C)F 34a_100000705826_200000210301 [1,1,0,0,0,0|2,0,0]=4 6483 B12R1.367 CNC(C)c1ccc(c(c1)C)O 269862a_106832991636_100000188726 [1,1,0,0,0,0|1,0,0]=3 6484 B12R1.367 CNC(C)c1ccc(c(c1)Cl)O 269862a_106832991636_100000188625 [1,1,0,0,0,0|2,0,0]=4 6485 B12R1.367 CNC(C)c1ccc(c(c1)F)O 269862a_106832991636_100000751691 [1,1,0,0,0,0|2,0,0]=4 6486 B12R1.367 CNC(C)c1ccc(c(c1)O)C 269862a_106832991636_100000084092 [1,1,0,0,0,0|2,0,0]=4 6487 B12R1.367 CNC(C)c1ccc(c(c1)O)F 269862a_106832991636_100000117923 [1,1,0,0,0,0|2,0,0]=4 6488 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 2230a_100015184928_200000210301 [1,1,0,0,0,0|2,0,0]=4 6489 B12R1.367 CN[C@H](C)c1ccc(c(c1)C)C 34a_100015184928_200000210301 [1,1,0,0,0,0|2,0,0]=4 6490 B12R1.367 COC(=O)c1ccc(c(c1)C)O 271570a_203496583355_100011215878 [1,1,0,0,0,0|1,0,1]=4 6491 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100000216328 [1,1,0,0,0,0|1,0,1]=4 6492 B12R1.367 COC(=O)c1ccc(c(c1)O)O 271570a_203496583355_100012350776 [1,1,0,0,0,0|1,0,1]=4 6493 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 2230a_100000705826_200025704644 [1,1,0,0,0,0|2,0,0]=4 6494 B12R1.367 Cc1cc(ccc1F)C(C)N[13CH3] 34a_100000705826_200025704644 [1,1,0,0,0,0|2,0,0]=4 6495 B12R1.367 Cc1cc(ccc1O)C(=O)CF 1458a_100000685612_100015361967 [1,1,0,0,0,0|1,0,1]=4 6496 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 2230a_100015184928_200025704644 [1,1,0,0,0,0|2,0,0]=4 6497 B12R1.367 Cc1ccc(cc1C)[C@@H](C)N[13CH3] 34a_100015184928_200025704644 [1,1,0,0,0,0|2,0,0]=4 6498 B12R1.367 O=C(CF)c1ccc(c(c1)O)O 1458a_100000212155_100015361967 [1,1,0,0,0,0|1,0,1]=4 6499 B12R1.385 C#CCNc1ccc(c(c1)C)O 34a_100011218179_100000184674 [1,1,0,0,0,0|0,0,2]=4 6500 B12R1.385 C#CCNc1ccc(c(c1)C)O 7a_100011218179_100000038162 [1,1,0,0,0,0|0,0,2]=4 6501 B12R1.385 C#CCNc1ccc(c(c1)O)O 34a_100102946323_100000184674 [1,1,0,0,0,0|0,0,2]=4 6502 B12R1.385 C#CCSc1ccc(c(c1)C)O 62a_100000038162_100000186361 [1,1,0,0,0,0|0,0,2]=4 6503 B12R1.385 C#CCSc1ccc(c(c1)O)O 62a_100000038162_100009813601 [1,1,0,0,0,0|0,0,2]=4 6504 B12R1.385 C=CCNc1ccc(c(c1)C)O 34a_100011218179_100015514636 [1,1,0,0,0,0|0,0,2]=4 6505 B12R1.385 C=CCNc1ccc(c(c1)C)O 7a_100011218179_100015514636 [1,1,0,0,0,0|0,0,2]=4 6506 B12R1.385 C=CCNc1ccc(c(c1)O)O 34a_100102946323_100015514636 [1,1,0,0,0,0|0,0,2]=4 6507 B12R1.385 C=CCSc1ccc(c(c1)C)O 62a_100000210623_100000186361 [1,1,0,0,0,0|0,0,2]=4 6508 B12R1.385 C=CCSc1ccc(c(c1)O)O 62a_100000210623_100009813601 [1,1,0,0,0,0|0,0,2]=4 6509 B12R1.385 CCCCc1c[nH]c(=O)c(c1)O 271570a_100020621405_100009814561 [1,1,0,0,0,0|1,0,1]=4 6510 B12R1.385 CCCCc1cc(c(cn1)Br)C 271570a_100020621405_100012356354 [1,1,0,0,0,0|2,0,0]=4 6511 B12R1.385 CCCCc1cc(c(cn1)C)C 271570a_100020621405_100009850809 [1,1,0,0,0,0|2,0,0]=4 6512 B12R1.385 CCCCc1cc(c(cn1)C)O 271570a_100020621405_100000704368 [1,1,0,0,0,0|2,0,0]=4 6513 B12R1.385 CCCCc1cc(c(cn1)F)C 271570a_100020621405_100009818257 [1,1,0,0,0,0|2,0,0]=4 6514 B12R1.385 CCCCc1cc(c(cn1)F)O 271570a_100020621405_100009854642 [1,1,0,0,0,0|2,0,0]=4 6515 B12R1.385 CCCCc1cc(c(cn1)N)C 271570a_100020621405_100000765520 [1,1,0,0,0,0|2,0,0]=4 6516 B12R1.385 CCCCc1cc(c(cn1)O)C 271570a_100020621405_100000692680 [1,1,0,0,0,0|1,0,0]=3 6517 B12R1.385 CCCCc1cc(c(cn1)O)N 271570a_100020621405_100009819941 [1,1,0,0,0,0|2,0,0]=4 6518 B12R1.385 CCCCc1ccc(=O)n(c1)C 271570a_100020621405_100011245003 [1,1,0,0,0,0|1,0,1]=4 6519 B12R1.385 CCCCc1ccc(c(c1)Br)Br 271570a_100020621405_100012356285 [1,1,0,0,0,0|2,0,0]=4 6520 B12R1.385 CCCCc1ccc(c(c1)Br)C 271570a_100020621405_100011847877 [1,1,0,0,0,0|2,0,0]=4 6521 B12R1.385 CCCCc1ccc(c(c1)Br)Cl 271570a_100020621405_100012353702 [1,1,0,0,0,0|2,0,0]=4 6522 B12R1.385 CCCCc1ccc(c(c1)Br)F 271570a_100020621405_100012047266 [1,1,0,0,0,0|2,0,0]=4 6523 B12R1.385 CCCCc1ccc(c(c1)Br)N 271570a_100020621405_100000750455 [1,1,0,0,0,0|2,0,0]=4 6524 B12R1.385 CCCCc1ccc(c(c1)Br)O 271570a_100020621405_100012361655 [1,1,0,0,0,0|1,0,0]=3 6525 B12R1.385 CCCCc1ccc(c(c1)C)Br 271570a_100020621405_100009813585 [1,1,0,0,0,0|1,0,0]=3 6526 B12R1.385 CCCCc1ccc(c(c1)C)C 271570a_100020621405_100011215607 [1,1,0,0,0,0|1,0,0]=3 6527 B12R1.385 CCCCc1ccc(c(c1)C)Cl 271570a_100020621405_100000049509 [1,1,0,0,0,0|1,0,0]=3 6528 B12R1.385 CCCCc1ccc(c(c1)C)F 271570a_100020621405_100011218330 [1,1,0,0,0,0|1,0,0]=3 6529 B12R1.385 CCCCc1ccc(c(c1)C)N 271570a_100020621405_100000211769 [1,1,0,0,0,0|1,0,0]=3 6530 B12R1.385 CCCCc1ccc(c(c1)C)O 271570a_100020621405_100000186361 [1,1,0,0,0,0|0,0,0]=2 6531 B12R1.385 CCCCc1ccc(c(c1)Cl)Br 271570a_100020621405_100012047281 [1,1,0,0,0,0|2,0,0]=4 6532 B12R1.385 CCCCc1ccc(c(c1)Cl)C 271570a_100020621405_100011216363 [1,1,0,0,0,0|2,0,0]=4 6533 B12R1.385 CCCCc1ccc(c(c1)Cl)Cl 271570a_100020621405_100011214914 [1,1,0,0,0,0|2,0,0]=4 6534 B12R1.385 CCCCc1ccc(c(c1)Cl)F 271570a_100020621405_100011215976 [1,1,0,0,0,0|2,0,0]=4 6535 B12R1.385 CCCCc1ccc(c(c1)Cl)N 271570a_100020621405_100011218065 [1,1,0,0,0,0|2,0,0]=4 6536 B12R1.385 CCCCc1ccc(c(c1)Cl)O 271570a_100020621405_100012360047 [1,1,0,0,0,0|1,0,0]=3 6537 B12R1.385 CCCCc1ccc(c(c1)F)Br 271570a_100020621405_100000685389 [1,1,0,0,0,0|2,0,0]=4 6538 B12R1.385 CCCCc1ccc(c(c1)F)C 271570a_100020621405_100000720648 [1,1,0,0,0,0|2,0,0]=4 6539 B12R1.385 CCCCc1ccc(c(c1)F)Cl 271570a_100020621405_100011216805 [1,1,0,0,0,0|2,0,0]=4 6540 B12R1.385 CCCCc1ccc(c(c1)F)F 271570a_100020621405_100000750028 [1,1,0,0,0,0|2,0,0]=4 6541 B12R1.385 CCCCc1ccc(c(c1)F)N 271570a_100020621405_100011215594 [1,1,0,0,0,0|2,0,0]=4 6542 B12R1.385 CCCCc1ccc(c(c1)F)O 271570a_100020621405_100000185481 [1,1,0,0,0,0|1,0,0]=3 6543 B12R1.385 CCCCc1ccc(c(c1)N)Br 271570a_100020621405_100000750456 [1,1,0,0,0,0|2,0,0]=4 6544 B12R1.385 CCCCc1ccc(c(c1)N)C 271570a_100020621405_100000761890 [1,1,0,0,0,0|2,0,0]=4 6545 B12R1.385 CCCCc1ccc(c(c1)N)Cl 271570a_100020621405_200000761891 [1,1,0,0,0,0|2,0,0]=4 6546 B12R1.385 CCCCc1ccc(c(c1)N)F 271570a_100020621405_100000740924 [1,1,0,0,0,0|2,0,0]=4 6547 B12R1.385 CCCCc1ccc(c(c1)N)N 271570a_100020621405_100000741789 [1,1,0,0,0,0|2,0,0]=4 6548 B12R1.385 CCCCc1ccc(c(c1)N)O 271570a_100020621405_100000752626 [1,1,0,0,0,0|1,0,0]=3 6549 B12R1.385 CCCCc1ccc(c(c1)O)Br 271570a_100020621405_100012356990 [1,1,0,0,0,0|1,0,0]=3 6550 B12R1.385 CCCCc1ccc(c(c1)O)C 271570a_100020621405_100000766334 [1,1,0,0,0,0|1,0,0]=3 6551 B12R1.385 CCCCc1ccc(c(c1)O)Cl 271570a_100020621405_100011356854 [1,1,0,0,0,0|1,0,0]=3 6552 B12R1.385 CCCCc1ccc(c(c1)O)F 271570a_100020621405_100000686035 [1,1,0,0,0,0|1,0,0]=3 6553 B12R1.385 CCCCc1ccc(c(c1)O)N 271570a_100020621405_100000739049 [1,1,0,0,0,0|1,0,0]=3 6554 B12R1.385 CCCCc1ccc(c(c1)O)O 271570a_100020621405_100009813601 [1,1,0,0,0,0|0,0,0]=2 6555 B12R1.385 CCCCc1ccc(c(n1)Br)O 271570a_100020621405_100000725334 [1,1,0,0,0,0|2,0,0]=4 6556 B12R1.385 CCCCc1ccc(c(n1)C)Br 271570a_100020621405_100012360386 [1,1,0,0,0,0|2,0,0]=4 6557 B12R1.385 CCCCc1ccc(c(n1)C)C 271570a_100020621405_100000103781 [1,1,0,0,0,0|2,0,0]=4 6558 B12R1.385 CCCCc1ccc(c(n1)C)F 271570a_100020621405_100009814307 [1,1,0,0,0,0|2,0,0]=4 6559 B12R1.385 CCCCc1ccc(c(n1)C)N 271570a_100020621405_100000760127 [1,1,0,0,0,0|2,0,0]=4 6560 B12R1.385 CCCCc1ccc(c(n1)C)O 271570a_100020621405_100010233687 [1,1,0,0,0,0|1,0,0]=3 6561 B12R1.385 CCCCc1ccc(c(n1)Cl)O 271570a_100020621405_100000721234 [1,1,0,0,0,0|2,0,0]=4 6562 B12R1.385 CCCCc1ccc(c(n1)F)O 271570a_100020621405_100009819667 [1,1,0,0,0,0|2,0,0]=4 6563 B12R1.385 CCCCc1ccc(c(n1)N)O 271570a_100020621405_100000685527 [1,1,0,0,0,0|2,0,0]=4 6564 B12R1.385 CCCCc1ccc(c(n1)O)F 271570a_100020621405_100010729010 [1,1,0,0,0,0|2,0,0]=4 6565 B12R1.385 CCCCc1ccc(c(n1)O)N 271570a_100020621405_100000718904 [1,1,0,0,0,0|2,0,0]=4 6566 B12R1.385 CCCCc1cnc(c(c1)C)Br 271570a_100020621405_100009816107 [1,1,0,0,0,0|2,0,0]=4 6567 B12R1.385 CCCCc1cnc(c(c1)C)C 271570a_100020621405_100000697892 [1,1,0,0,0,0|2,0,0]=4 6568 B12R1.385 CCCCc1cnc(c(c1)C)Cl 271570a_100020621405_100009922867 [1,1,0,0,0,0|2,0,0]=4 6569 B12R1.385 CCCCc1cnc(c(c1)C)F 271570a_100020621405_100000709442 [1,1,0,0,0,0|2,0,0]=4 6570 B12R1.385 CCCCc1cnc(c(c1)C)N 271570a_100020621405_100000186686 [1,1,0,0,0,0|2,0,0]=4 6571 B12R1.385 CCCCc1cnc(c(c1)C)O 271570a_100020621405_100000685391 [1,1,0,0,0,0|1,0,0]=3 6572 B12R1.385 CCCCc1cnc(c(c1)Cl)O 271570a_100020621405_100010238531 [1,1,0,0,0,0|2,0,0]=4 6573 B12R1.385 CCCCc1cnc(c(c1)N)O 271570a_100020621405_100000743729 [1,1,0,0,0,0|2,0,0]=4 6574 B12R1.385 CCCCc1cnc(c(c1)O)C 271570a_100020621405_100009864810 [1,1,0,0,0,0|2,0,0]=4 6575 B12R1.385 CCCCc1cnc(c(c1)O)F 271570a_100020621405_100009819871 [1,1,0,0,0,0|2,0,0]=4 6576 B12R1.385 CCCCc1cnc(c(c1)O)N 271570a_100020621405_100009819042 [1,1,0,0,0,0|2,0,0]=4 6577 B12R1.385 CCCNc1ccc(c(c1)Br)Br 2230a_100011306057_100000210303 [1,1,0,0,0,0|2,0,0]=4 6578 B12R1.385 CCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000210303 [1,1,0,0,0,0|2,0,0]=4 6579 B12R1.385 CCCNc1ccc(c(c1)Br)Br 7a_100011306057_100000210303 [1,1,0,0,0,0|2,0,0]=4 6580 B12R1.385 CCCNc1ccc(c(c1)Br)C 2230a_100000736455_100000210303 [1,1,0,0,0,0|2,0,0]=4 6581 B12R1.385 CCCNc1ccc(c(c1)Br)C 34a_100000736455_100000210303 [1,1,0,0,0,0|2,0,0]=4 6582 B12R1.385 CCCNc1ccc(c(c1)Br)C 7a_100000736455_100000210303 [1,1,0,0,0,0|2,0,0]=4 6583 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 2230a_100000686031_100000210303 [1,1,0,0,0,0|2,0,0]=4 6584 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000210303 [1,1,0,0,0,0|2,0,0]=4 6585 B12R1.385 CCCNc1ccc(c(c1)Br)F 2230a_100000760356_100000210303 [1,1,0,0,0,0|2,0,0]=4 6586 B12R1.385 CCCNc1ccc(c(c1)Br)F 34a_100000760356_100000210303 [1,1,0,0,0,0|2,0,0]=4 6587 B12R1.385 CCCNc1ccc(c(c1)Br)F 7a_100000760356_100000210303 [1,1,0,0,0,0|2,0,0]=4 6588 B12R1.385 CCCNc1ccc(c(c1)Br)I 34a_100000750458_100000210303 [1,1,0,0,0,0|2,0,0]=4 6589 B12R1.385 CCCNc1ccc(c(c1)Br)O 34a_100011534360_100000210303 [1,1,0,0,0,0|1,0,0]=3 6590 B12R1.385 CCCNc1ccc(c(c1)C)Br 2230a_100000210723_100000210303 [1,1,0,0,0,0|1,0,0]=3 6591 B12R1.385 CCCNc1ccc(c(c1)C)Br 34a_100000210723_100000210303 [1,1,0,0,0,0|1,0,0]=3 6592 B12R1.385 CCCNc1ccc(c(c1)C)Br 7a_100000210723_100000210303 [1,1,0,0,0,0|1,0,0]=3 6593 B12R1.385 CCCNc1ccc(c(c1)C)C 2230a_100000724040_100000210303 [1,1,0,0,0,0|1,0,0]=3 6594 B12R1.385 CCCNc1ccc(c(c1)C)C 34a_100000724040_100000210303 [1,1,0,0,0,0|1,0,0]=3 6595 B12R1.385 CCCNc1ccc(c(c1)C)C 7a_100000724040_100000210303 [1,1,0,0,0,0|1,0,0]=3 6596 B12R1.385 CCCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000210303 [1,1,0,0,0,0|1,0,0]=3 6597 B12R1.385 CCCNc1ccc(c(c1)C)Cl 34a_100000187808_100000210303 [1,1,0,0,0,0|1,0,0]=3 6598 B12R1.385 CCCNc1ccc(c(c1)C)Cl 7a_100000187808_100000210303 [1,1,0,0,0,0|1,0,0]=3 6599 B12R1.385 CCCNc1ccc(c(c1)C)F 2230a_100000750164_100000210303 [1,1,0,0,0,0|1,0,0]=3 6600 B12R1.385 CCCNc1ccc(c(c1)C)F 34a_100000750164_100000210303 [1,1,0,0,0,0|1,0,0]=3 6601 B12R1.385 CCCNc1ccc(c(c1)C)F 7a_100000750164_100000210303 [1,1,0,0,0,0|1,0,0]=3 6602 B12R1.385 CCCNc1ccc(c(c1)C)I 34a_100000198070_100000210303 [1,1,0,0,0,0|1,0,0]=3 6603 B12R1.385 CCCNc1ccc(c(c1)C)I 7a_100000198070_100000210303 [1,1,0,0,0,0|1,0,0]=3 6604 B12R1.385 CCCNc1ccc(c(c1)C)O 34a_100011218179_100000210303 [1,1,0,0,0,0|0,0,0]=2 6605 B12R1.385 CCCNc1ccc(c(c1)C)O 7a_100011218179_100000210303 [1,1,0,0,0,0|0,0,0]=2 6606 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 2230a_100000687081_100000210303 [1,1,0,0,0,0|2,0,0]=4 6607 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000210303 [1,1,0,0,0,0|2,0,0]=4 6608 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100000210303 [1,1,0,0,0,0|2,0,0]=4 6609 B12R1.385 CCCNc1ccc(c(c1)Cl)C 2230a_100000188892_100000210303 [1,1,0,0,0,0|2,0,0]=4 6610 B12R1.385 CCCNc1ccc(c(c1)Cl)C 34a_100000188892_100000210303 [1,1,0,0,0,0|2,0,0]=4 6611 B12R1.385 CCCNc1ccc(c(c1)Cl)C 7a_100000188892_100000210303 [1,1,0,0,0,0|2,0,0]=4 6612 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl 2230a_100000184108_100000210303 [1,1,0,0,0,0|2,0,0]=4 6613 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000210303 [1,1,0,0,0,0|2,0,0]=4 6614 B12R1.385 CCCNc1ccc(c(c1)Cl)F 2230a_100000211060_100000210303 [1,1,0,0,0,0|2,0,0]=4 6615 B12R1.385 CCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000210303 [1,1,0,0,0,0|2,0,0]=4 6616 B12R1.385 CCCNc1ccc(c(c1)Cl)F 7a_100000211060_100000210303 [1,1,0,0,0,0|2,0,0]=4 6617 B12R1.385 CCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000210303 [1,1,0,0,0,0|2,0,0]=4 6618 B12R1.385 CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000210303 [1,1,0,0,0,0|1,0,0]=3 6619 B12R1.385 CCCNc1ccc(c(c1)F)Br 2230a_100000759894_100000210303 [1,1,0,0,0,0|2,0,0]=4 6620 B12R1.385 CCCNc1ccc(c(c1)F)Br 34a_100000759894_100000210303 [1,1,0,0,0,0|2,0,0]=4 6621 B12R1.385 CCCNc1ccc(c(c1)F)Br 7a_100000759894_100000210303 [1,1,0,0,0,0|2,0,0]=4 6622 B12R1.385 CCCNc1ccc(c(c1)F)C 2230a_100000210958_100000210303 [1,1,0,0,0,0|2,0,0]=4 6623 B12R1.385 CCCNc1ccc(c(c1)F)C 34a_100000210958_100000210303 [1,1,0,0,0,0|2,0,0]=4 6624 B12R1.385 CCCNc1ccc(c(c1)F)C 7a_100000210958_100000210303 [1,1,0,0,0,0|2,0,0]=4 6625 B12R1.385 CCCNc1ccc(c(c1)F)Cl 2230a_100000739366_100000210303 [1,1,0,0,0,0|2,0,0]=4 6626 B12R1.385 CCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000210303 [1,1,0,0,0,0|2,0,0]=4 6627 B12R1.385 CCCNc1ccc(c(c1)F)Cl 7a_100000739366_100000210303 [1,1,0,0,0,0|2,0,0]=4 6628 B12R1.385 CCCNc1ccc(c(c1)F)F 2230a_100000210724_100000210303 [1,1,0,0,0,0|2,0,0]=4 6629 B12R1.385 CCCNc1ccc(c(c1)F)F 34a_100000210724_100000210303 [1,1,0,0,0,0|2,0,0]=4 6630 B12R1.385 CCCNc1ccc(c(c1)F)F 7a_100000210724_100000210303 [1,1,0,0,0,0|2,0,0]=4 6631 B12R1.385 CCCNc1ccc(c(c1)F)I 34a_100011356925_100000210303 [1,1,0,0,0,0|2,0,0]=4 6632 B12R1.385 CCCNc1ccc(c(c1)F)I 7a_100011356925_100000210303 [1,1,0,0,0,0|2,0,0]=4 6633 B12R1.385 CCCNc1ccc(c(c1)F)O 34a_100011220035_100000210303 [1,1,0,0,0,0|1,0,0]=3 6634 B12R1.385 CCCNc1ccc(c(c1)F)O 7a_100011220035_100000210303 [1,1,0,0,0,0|1,0,0]=3 6635 B12R1.385 CCCNc1ccc(c(c1)I)Br 34a_100000750459_100000210303 [1,1,0,0,0,0|2,0,0]=4 6636 B12R1.385 CCCNc1ccc(c(c1)I)C 34a_100000184131_100000210303 [1,1,0,0,0,0|2,0,0]=4 6637 B12R1.385 CCCNc1ccc(c(c1)I)C 7a_100000184131_100000210303 [1,1,0,0,0,0|2,0,0]=4 6638 B12R1.385 CCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000210303 [1,1,0,0,0,0|2,0,0]=4 6639 B12R1.385 CCCNc1ccc(c(c1)I)F 34a_114828291077_100000210303 [1,1,0,0,0,0|2,0,0]=4 6640 B12R1.385 CCCNc1ccc(c(c1)I)F 7a_114828291077_100000210303 [1,1,0,0,0,0|2,0,0]=4 6641 B12R1.385 CCCNc1ccc(c(c1)O)C 34a_100000759471_100000210303 [1,1,0,0,0,0|1,0,0]=3 6642 B12R1.385 CCCNc1ccc(c(c1)O)C 7a_100000759471_100000210303 [1,1,0,0,0,0|1,0,0]=3 6643 B12R1.385 CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000210303 [1,1,0,0,0,0|1,0,0]=3 6644 B12R1.385 CCCNc1ccc(c(c1)O)F 34a_100012017398_100000210303 [1,1,0,0,0,0|1,0,0]=3 6645 B12R1.385 CCCNc1ccc(c(c1)O)F 7a_100012017398_100000210303 [1,1,0,0,0,0|1,0,0]=3 6646 B12R1.385 CCCNc1ccc(c(c1)O)O 34a_100102946323_100000210303 [1,1,0,0,0,0|0,0,0]=2 6647 B12R1.385 CCCOc1cc(c(cn1)Br)C 34a_100000766222_100000210303 [1,1,0,0,0,0|2,0,0]=4 6648 B12R1.385 CCCOc1cc(c(cn1)Cl)C 34a_200000085746_100000210303 [1,1,0,0,0,0|2,0,0]=4 6649 B12R1.385 CCCOc1ccc(c(c1)Br)C 34a_100011380479_100000210303 [1,1,0,0,0,0|2,0,0]=4 6650 B12R1.385 CCCOc1ccc(c(c1)Br)C 7a_100011380479_100000210303 [1,1,0,0,0,0|2,0,0]=4 6651 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000210303 [1,1,0,0,0,0|2,0,0]=4 6652 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100000210303 [1,1,0,0,0,0|2,0,0]=4 6653 B12R1.385 CCCOc1ccc(c(c1)Br)F 34a_100000693481_100000210303 [1,1,0,0,0,0|2,0,0]=4 6654 B12R1.385 CCCOc1ccc(c(c1)Br)F 7a_100000693481_100000210303 [1,1,0,0,0,0|2,0,0]=4 6655 B12R1.385 CCCOc1ccc(c(c1)Br)I 34a_100000701344_100000210303 [1,1,0,0,0,0|2,0,0]=4 6656 B12R1.385 CCCOc1ccc(c(c1)Br)I 7a_100000701344_100000210303 [1,1,0,0,0,0|2,0,0]=4 6657 B12R1.385 CCCOc1ccc(c(c1)Br)N 34a_100012001276_100000210303 [1,1,0,0,0,0|2,0,0]=4 6658 B12R1.385 CCCOc1ccc(c(c1)Br)N 7a_100012001276_100000210303 [1,1,0,0,0,0|2,0,0]=4 6659 B12R1.385 CCCOc1ccc(c(c1)C)Br 34a_100000690111_100000210303 [1,1,0,0,0,0|1,0,0]=3 6660 B12R1.385 CCCOc1ccc(c(c1)C)Br 7a_100000690111_100000210303 [1,1,0,0,0,0|1,0,0]=3 6661 B12R1.385 CCCOc1ccc(c(c1)C)C 34a_100000210932_100000210303 [1,1,0,0,0,0|1,0,0]=3 6662 B12R1.385 CCCOc1ccc(c(c1)C)C 7a_100000210932_100000210303 [1,1,0,0,0,0|1,0,0]=3 6663 B12R1.385 CCCOc1ccc(c(c1)C)Cl 34a_100000211092_100000210303 [1,1,0,0,0,0|1,0,0]=3 6664 B12R1.385 CCCOc1ccc(c(c1)C)Cl 7a_100000211092_100000210303 [1,1,0,0,0,0|1,0,0]=3 6665 B12R1.385 CCCOc1ccc(c(c1)C)F 34a_100000751312_100000210303 [1,1,0,0,0,0|1,0,0]=3 6666 B12R1.385 CCCOc1ccc(c(c1)C)F 7a_100000751312_100000210303 [1,1,0,0,0,0|1,0,0]=3 6667 B12R1.385 CCCOc1ccc(c(c1)C)I 34a_100000729255_100000210303 [1,1,0,0,0,0|1,0,0]=3 6668 B12R1.385 CCCOc1ccc(c(c1)C)I 7a_100000729255_100000210303 [1,1,0,0,0,0|1,0,0]=3 6669 B12R1.385 CCCOc1ccc(c(c1)C)N 34a_100000756630_100000210303 [1,1,0,0,0,0|1,0,0]=3 6670 B12R1.385 CCCOc1ccc(c(c1)C)N 7a_100000756630_100000210303 [1,1,0,0,0,0|1,0,0]=3 6671 B12R1.385 CCCOc1ccc(c(c1)C)O 271570a_203496583355_200012361509 [1,1,0,0,0,0|0,0,0]=2 6672 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000210303 [1,1,0,0,0,0|2,0,0]=4 6673 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100000210303 [1,1,0,0,0,0|2,0,0]=4 6674 B12R1.385 CCCOc1ccc(c(c1)Cl)C 34a_100011265682_100000210303 [1,1,0,0,0,0|2,0,0]=4 6675 B12R1.385 CCCOc1ccc(c(c1)Cl)C 7a_100011265682_100000210303 [1,1,0,0,0,0|2,0,0]=4 6676 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000210303 [1,1,0,0,0,0|2,0,0]=4 6677 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100000210303 [1,1,0,0,0,0|2,0,0]=4 6678 B12R1.385 CCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000210303 [1,1,0,0,0,0|2,0,0]=4 6679 B12R1.385 CCCOc1ccc(c(c1)Cl)F 7a_100000211030_100000210303 [1,1,0,0,0,0|2,0,0]=4 6680 B12R1.385 CCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000210303 [1,1,0,0,0,0|2,0,0]=4 6681 B12R1.385 CCCOc1ccc(c(c1)Cl)I 7a_100000047559_100000210303 [1,1,0,0,0,0|2,0,0]=4 6682 B12R1.385 CCCOc1ccc(c(c1)Cl)N 34a_100011215599_100000210303 [1,1,0,0,0,0|2,0,0]=4 6683 B12R1.385 CCCOc1ccc(c(c1)Cl)N 7a_100011215599_100000210303 [1,1,0,0,0,0|2,0,0]=4 6684 B12R1.385 CCCOc1ccc(c(c1)F)Br 34a_100000755031_100000210303 [1,1,0,0,0,0|2,0,0]=4 6685 B12R1.385 CCCOc1ccc(c(c1)F)Br 7a_100000755031_100000210303 [1,1,0,0,0,0|2,0,0]=4 6686 B12R1.385 CCCOc1ccc(c(c1)F)C 34a_100000722560_100000210303 [1,1,0,0,0,0|2,0,0]=4 6687 B12R1.385 CCCOc1ccc(c(c1)F)C 7a_100000722560_100000210303 [1,1,0,0,0,0|2,0,0]=4 6688 B12R1.385 CCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000210303 [1,1,0,0,0,0|2,0,0]=4 6689 B12R1.385 CCCOc1ccc(c(c1)F)Cl 7a_100000691581_100000210303 [1,1,0,0,0,0|2,0,0]=4 6690 B12R1.385 CCCOc1ccc(c(c1)F)F 34a_100000181275_100000210303 [1,1,0,0,0,0|2,0,0]=4 6691 B12R1.385 CCCOc1ccc(c(c1)F)F 7a_100000181275_100000210303 [1,1,0,0,0,0|2,0,0]=4 6692 B12R1.385 CCCOc1ccc(c(c1)F)I 34a_100009990212_100000210303 [1,1,0,0,0,0|2,0,0]=4 6693 B12R1.385 CCCOc1ccc(c(c1)F)I 7a_100009990212_100000210303 [1,1,0,0,0,0|2,0,0]=4 6694 B12R1.385 CCCOc1ccc(c(c1)F)N 34a_100000759473_100000210303 [1,1,0,0,0,0|2,0,0]=4 6695 B12R1.385 CCCOc1ccc(c(c1)F)N 7a_100000759473_100000210303 [1,1,0,0,0,0|2,0,0]=4 6696 B12R1.385 CCCOc1ccc(c(c1)F)O 271570a_203496583355_200012236930 [1,1,0,0,0,0|1,0,0]=3 6697 B12R1.385 CCCOc1ccc(c(c1)I)Br 34a_100012339312_100000210303 [1,1,0,0,0,0|2,0,0]=4 6698 B12R1.385 CCCOc1ccc(c(c1)I)Br 7a_100012339312_100000210303 [1,1,0,0,0,0|2,0,0]=4 6699 B12R1.385 CCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000210303 [1,1,0,0,0,0|2,0,0]=4 6700 B12R1.385 CCCOc1ccc(c(c1)I)Cl 7a_100000049588_100000210303 [1,1,0,0,0,0|2,0,0]=4 6701 B12R1.385 CCCOc1ccc(c(c1)I)N 34a_100010084370_100000210303 [1,1,0,0,0,0|2,0,0]=4 6702 B12R1.385 CCCOc1ccc(c(c1)I)N 7a_100010084370_100000210303 [1,1,0,0,0,0|2,0,0]=4 6703 B12R1.385 CCCOc1ccc(c(c1)N)Br 34a_100011999798_100000210303 [1,1,0,0,0,0|2,0,0]=4 6704 B12R1.385 CCCOc1ccc(c(c1)N)Br 7a_100011999798_100000210303 [1,1,0,0,0,0|2,0,0]=4 6705 B12R1.385 CCCOc1ccc(c(c1)N)C 34a_100011216113_100000210303 [1,1,0,0,0,0|2,0,0]=4 6706 B12R1.385 CCCOc1ccc(c(c1)N)C 7a_100011216113_100000210303 [1,1,0,0,0,0|2,0,0]=4 6707 B12R1.385 CCCOc1ccc(c(c1)N)Cl 34a_100011934297_100000210303 [1,1,0,0,0,0|2,0,0]=4 6708 B12R1.385 CCCOc1ccc(c(c1)N)F 34a_100012017239_100000210303 [1,1,0,0,0,0|2,0,0]=4 6709 B12R1.385 CCCOc1ccc(c(c1)N)F 7a_100012017239_100000210303 [1,1,0,0,0,0|2,0,0]=4 6710 B12R1.385 CCCOc1ccc(c(c1)N)N 34a_100025771000_100000210303 [1,1,0,0,0,0|2,0,0]=4 6711 B12R1.385 CCCOc1ccc(c(n1)C)Br 34a_100000691680_100000210303 [1,1,0,0,0,0|2,0,0]=4 6712 B12R1.385 CCCOc1ccc(c(n1)C)Cl 34a_200009863735_100000210303 [1,1,0,0,0,0|2,0,0]=4 6713 B12R1.385 CCCOc1ccc(c(n1)C)O 271570a_203496583355_200012343549 [1,1,0,0,0,0|1,0,0]=3 6714 B12R1.385 CCCOc1cnc(c(c1)C)Br 34a_100012000486_100000210303 [1,1,0,0,0,0|2,0,0]=4 6715 B12R1.385 CCCOc1cnc(c(c1)C)Br 7a_100012000486_100000210303 [1,1,0,0,0,0|2,0,0]=4 6716 B12R1.385 CCCOc1cnc(c(c1)C)C 34a_100009854398_100000210303 [1,1,0,0,0,0|2,0,0]=4 6717 B12R1.385 CCCOc1cnc(c(c1)C)C 7a_100009854398_100000210303 [1,1,0,0,0,0|2,0,0]=4 6718 B12R1.385 CCCOc1cnc(c(c1)C)Cl 34a_100012002680_100000210303 [1,1,0,0,0,0|2,0,0]=4 6719 B12R1.385 CCCOc1cnc(c(c1)C)Cl 7a_100012002680_100000210303 [1,1,0,0,0,0|2,0,0]=4 6720 B12R1.385 CCCOc1cnc(c(c1)C)F 34a_100000094615_100000210303 [1,1,0,0,0,0|2,0,0]=4 6721 B12R1.385 CCCOc1cnc(c(c1)C)F 7a_100000094615_100000210303 [1,1,0,0,0,0|2,0,0]=4 6722 B12R1.385 CCCSc1c[nH]c(=O)c(c1)O 62a_100000210303_100009814561 [1,1,0,0,0,0|1,0,1]=4 6723 B12R1.385 CCCSc1cc(c(cn1)Br)C 62a_100000210303_100012356354 [1,1,0,0,0,0|2,0,0]=4 6724 B12R1.385 CCCSc1cc(c(cn1)Br)C 62a_100012356354_100000210303 [1,1,0,0,0,0|2,0,0]=4 6725 B12R1.385 CCCSc1cc(c(cn1)C)C 62a_100000210303_100009850809 [1,1,0,0,0,0|2,0,0]=4 6726 B12R1.385 CCCSc1cc(c(cn1)C)C 62a_100009850809_100000210303 [1,1,0,0,0,0|2,0,0]=4 6727 B12R1.385 CCCSc1cc(c(cn1)C)O 62a_100000210303_100000704368 [1,1,0,0,0,0|2,0,0]=4 6728 B12R1.385 CCCSc1cc(c(cn1)C)O 62a_100000704368_100000210303 [1,1,0,0,0,0|2,0,0]=4 6729 B12R1.385 CCCSc1cc(c(cn1)F)C 62a_100000210303_100009818257 [1,1,0,0,0,0|2,0,0]=4 6730 B12R1.385 CCCSc1cc(c(cn1)F)C 62a_100009818257_100000210303 [1,1,0,0,0,0|2,0,0]=4 6731 B12R1.385 CCCSc1cc(c(cn1)F)O 62a_100000210303_100009854642 [1,1,0,0,0,0|2,0,0]=4 6732 B12R1.385 CCCSc1cc(c(cn1)F)O 62a_100009854642_100000210303 [1,1,0,0,0,0|2,0,0]=4 6733 B12R1.385 CCCSc1cc(c(cn1)N)C 62a_100000067204_100000210303 [1,1,0,0,0,0|2,0,0]=4 6734 B12R1.385 CCCSc1cc(c(cn1)N)C 62a_100000210303_100000067204 [1,1,0,0,0,0|2,0,0]=4 6735 B12R1.385 CCCSc1cc(c(cn1)O)C 62a_100000210303_100000692680 [1,1,0,0,0,0|1,0,0]=3 6736 B12R1.385 CCCSc1cc(c(cn1)O)N 62a_100000210303_100009819941 [1,1,0,0,0,0|2,0,0]=4 6737 B12R1.385 CCCSc1cc(c(cn1)O)N 62a_100009819941_100000210303 [1,1,0,0,0,0|2,0,0]=4 6738 B12R1.385 CCCSc1ccc(=O)n(c1)C 62a_100000210303_100011245003 [1,1,0,0,0,0|1,0,1]=4 6739 B12R1.385 CCCSc1ccc(=O)n(c1)C 62a_100011245003_100000210303 [1,1,0,0,0,0|1,0,1]=4 6740 B12R1.385 CCCSc1ccc(c(c1)Br)Br 62a_100000210303_100012356285 [1,1,0,0,0,0|2,0,0]=4 6741 B12R1.385 CCCSc1ccc(c(c1)Br)Br 62a_100012356285_100000210303 [1,1,0,0,0,0|2,0,0]=4 6742 B12R1.385 CCCSc1ccc(c(c1)Br)C 62a_100000210303_100011847877 [1,1,0,0,0,0|2,0,0]=4 6743 B12R1.385 CCCSc1ccc(c(c1)Br)C 62a_100011847877_100000210303 [1,1,0,0,0,0|2,0,0]=4 6744 B12R1.385 CCCSc1ccc(c(c1)Br)Cl 62a_100000210303_100012353702 [1,1,0,0,0,0|2,0,0]=4 6745 B12R1.385 CCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100000210303 [1,1,0,0,0,0|2,0,0]=4 6746 B12R1.385 CCCSc1ccc(c(c1)Br)F 62a_100000210303_100012047266 [1,1,0,0,0,0|2,0,0]=4 6747 B12R1.385 CCCSc1ccc(c(c1)Br)F 62a_100012047266_100000210303 [1,1,0,0,0,0|2,0,0]=4 6748 B12R1.385 CCCSc1ccc(c(c1)Br)N 62a_100000210303_100000750455 [1,1,0,0,0,0|2,0,0]=4 6749 B12R1.385 CCCSc1ccc(c(c1)Br)N 62a_100000750455_100000210303 [1,1,0,0,0,0|2,0,0]=4 6750 B12R1.385 CCCSc1ccc(c(c1)Br)O 62a_100000210303_100012361655 [1,1,0,0,0,0|1,0,0]=3 6751 B12R1.385 CCCSc1ccc(c(c1)Br)O 62a_100012361655_100000210303 [1,1,0,0,0,0|1,0,0]=3 6752 B12R1.385 CCCSc1ccc(c(c1)C)Br 62a_100000210303_100009813585 [1,1,0,0,0,0|1,0,0]=3 6753 B12R1.385 CCCSc1ccc(c(c1)C)Br 62a_100009813585_100000210303 [1,1,0,0,0,0|1,0,0]=3 6754 B12R1.385 CCCSc1ccc(c(c1)C)C 62a_100000210303_100011215607 [1,1,0,0,0,0|1,0,0]=3 6755 B12R1.385 CCCSc1ccc(c(c1)C)C 62a_100011215607_100000210303 [1,1,0,0,0,0|1,0,0]=3 6756 B12R1.385 CCCSc1ccc(c(c1)C)Cl 62a_100000049509_100000210303 [1,1,0,0,0,0|1,0,0]=3 6757 B12R1.385 CCCSc1ccc(c(c1)C)Cl 62a_100000210303_100000049509 [1,1,0,0,0,0|1,0,0]=3 6758 B12R1.385 CCCSc1ccc(c(c1)C)F 62a_100000210303_100011218330 [1,1,0,0,0,0|1,0,0]=3 6759 B12R1.385 CCCSc1ccc(c(c1)C)F 62a_100011218330_100000210303 [1,1,0,0,0,0|1,0,0]=3 6760 B12R1.385 CCCSc1ccc(c(c1)C)N 62a_100000210303_100000211769 [1,1,0,0,0,0|1,0,0]=3 6761 B12R1.385 CCCSc1ccc(c(c1)C)N 62a_100000211769_100000210303 [1,1,0,0,0,0|1,0,0]=3 6762 B12R1.385 CCCSc1ccc(c(c1)C)O 62a_100000210303_100000186361 [1,1,0,0,0,0|0,0,0]=2 6763 B12R1.385 CCCSc1ccc(c(c1)Cl)Br 62a_100000210303_100012047281 [1,1,0,0,0,0|2,0,0]=4 6764 B12R1.385 CCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100000210303 [1,1,0,0,0,0|2,0,0]=4 6765 B12R1.385 CCCSc1ccc(c(c1)Cl)C 62a_100000210303_100011216363 [1,1,0,0,0,0|2,0,0]=4 6766 B12R1.385 CCCSc1ccc(c(c1)Cl)C 62a_100011216363_100000210303 [1,1,0,0,0,0|2,0,0]=4 6767 B12R1.385 CCCSc1ccc(c(c1)Cl)Cl 62a_100000210303_100011214914 [1,1,0,0,0,0|2,0,0]=4 6768 B12R1.385 CCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100000210303 [1,1,0,0,0,0|2,0,0]=4 6769 B12R1.385 CCCSc1ccc(c(c1)Cl)F 62a_100000210303_100011215976 [1,1,0,0,0,0|2,0,0]=4 6770 B12R1.385 CCCSc1ccc(c(c1)Cl)F 62a_100011215976_100000210303 [1,1,0,0,0,0|2,0,0]=4 6771 B12R1.385 CCCSc1ccc(c(c1)Cl)N 62a_100000210303_100011218065 [1,1,0,0,0,0|2,0,0]=4 6772 B12R1.385 CCCSc1ccc(c(c1)Cl)N 62a_100011218065_100000210303 [1,1,0,0,0,0|2,0,0]=4 6773 B12R1.385 CCCSc1ccc(c(c1)Cl)O 62a_100000210303_100012360047 [1,1,0,0,0,0|1,0,0]=3 6774 B12R1.385 CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000210303 [1,1,0,0,0,0|1,0,0]=3 6775 B12R1.385 CCCSc1ccc(c(c1)F)Br 62a_100000210303_100000685389 [1,1,0,0,0,0|2,0,0]=4 6776 B12R1.385 CCCSc1ccc(c(c1)F)Br 62a_100000685389_100000210303 [1,1,0,0,0,0|2,0,0]=4 6777 B12R1.385 CCCSc1ccc(c(c1)F)C 62a_100000210303_100000720648 [1,1,0,0,0,0|2,0,0]=4 6778 B12R1.385 CCCSc1ccc(c(c1)F)C 62a_100000720648_100000210303 [1,1,0,0,0,0|2,0,0]=4 6779 B12R1.385 CCCSc1ccc(c(c1)F)Cl 62a_100000210303_100011216805 [1,1,0,0,0,0|2,0,0]=4 6780 B12R1.385 CCCSc1ccc(c(c1)F)Cl 62a_100011216805_100000210303 [1,1,0,0,0,0|2,0,0]=4 6781 B12R1.385 CCCSc1ccc(c(c1)F)F 62a_100000210303_100000703953 [1,1,0,0,0,0|2,0,0]=4 6782 B12R1.385 CCCSc1ccc(c(c1)F)F 62a_100000703953_100000210303 [1,1,0,0,0,0|2,0,0]=4 6783 B12R1.385 CCCSc1ccc(c(c1)F)N 62a_100000210303_100011215594 [1,1,0,0,0,0|2,0,0]=4 6784 B12R1.385 CCCSc1ccc(c(c1)F)N 62a_100011215594_100000210303 [1,1,0,0,0,0|2,0,0]=4 6785 B12R1.385 CCCSc1ccc(c(c1)F)O 62a_100000185481_100000210303 [1,1,0,0,0,0|1,0,0]=3 6786 B12R1.385 CCCSc1ccc(c(c1)F)O 62a_100000210303_100000185481 [1,1,0,0,0,0|1,0,0]=3 6787 B12R1.385 CCCSc1ccc(c(c1)N)Br 62a_100000210303_100000750456 [1,1,0,0,0,0|2,0,0]=4 6788 B12R1.385 CCCSc1ccc(c(c1)N)Br 62a_100000750456_100000210303 [1,1,0,0,0,0|2,0,0]=4 6789 B12R1.385 CCCSc1ccc(c(c1)N)C 62a_100000210303_100000761890 [1,1,0,0,0,0|2,0,0]=4 6790 B12R1.385 CCCSc1ccc(c(c1)N)C 62a_100000761890_100000210303 [1,1,0,0,0,0|2,0,0]=4 6791 B12R1.385 CCCSc1ccc(c(c1)N)Cl 62a_100000210303_200000761891 [1,1,0,0,0,0|2,0,0]=4 6792 B12R1.385 CCCSc1ccc(c(c1)N)Cl 62a_200000761891_100000210303 [1,1,0,0,0,0|2,0,0]=4 6793 B12R1.385 CCCSc1ccc(c(c1)N)F 62a_100000210303_100000740924 [1,1,0,0,0,0|2,0,0]=4 6794 B12R1.385 CCCSc1ccc(c(c1)N)F 62a_100000740924_100000210303 [1,1,0,0,0,0|2,0,0]=4 6795 B12R1.385 CCCSc1ccc(c(c1)N)N 62a_100000210303_100011534411 [1,1,0,0,0,0|2,0,0]=4 6796 B12R1.385 CCCSc1ccc(c(c1)N)N 62a_100000741789_100000210303 [1,1,0,0,0,0|2,0,0]=4 6797 B12R1.385 CCCSc1ccc(c(c1)N)O 62a_100000210303_100000752626 [1,1,0,0,0,0|1,0,0]=3 6798 B12R1.385 CCCSc1ccc(c(c1)N)O 62a_100000752626_100000210303 [1,1,0,0,0,0|1,0,0]=3 6799 B12R1.385 CCCSc1ccc(c(c1)O)Br 62a_100000210303_100012356990 [1,1,0,0,0,0|1,0,0]=3 6800 B12R1.385 CCCSc1ccc(c(c1)O)Br 62a_100012356990_100000210303 [1,1,0,0,0,0|1,0,0]=3 6801 B12R1.385 CCCSc1ccc(c(c1)O)C 62a_100000210303_100000685420 [1,1,0,0,0,0|1,0,0]=3 6802 B12R1.385 CCCSc1ccc(c(c1)O)C 62a_100000685420_100000210303 [1,1,0,0,0,0|1,0,0]=3 6803 B12R1.385 CCCSc1ccc(c(c1)O)Cl 62a_100000210303_100011356854 [1,1,0,0,0,0|1,0,0]=3 6804 B12R1.385 CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000210303 [1,1,0,0,0,0|1,0,0]=3 6805 B12R1.385 CCCSc1ccc(c(c1)O)F 62a_100000210303_100000686035 [1,1,0,0,0,0|1,0,0]=3 6806 B12R1.385 CCCSc1ccc(c(c1)O)F 62a_100000686035_100000210303 [1,1,0,0,0,0|1,0,0]=3 6807 B12R1.385 CCCSc1ccc(c(c1)O)N 62a_100000210303_100000739049 [1,1,0,0,0,0|1,0,0]=3 6808 B12R1.385 CCCSc1ccc(c(c1)O)N 62a_100000739049_100000210303 [1,1,0,0,0,0|1,0,0]=3 6809 B12R1.385 CCCSc1ccc(c(c1)O)O 62a_100000210303_100009813601 [1,1,0,0,0,0|0,0,0]=2 6810 B12R1.385 CCCSc1ccc(c(n1)Br)O 62a_100000210303_100000725334 [1,1,0,0,0,0|2,0,0]=4 6811 B12R1.385 CCCSc1ccc(c(n1)Br)O 62a_100000725334_100000210303 [1,1,0,0,0,0|2,0,0]=4 6812 B12R1.385 CCCSc1ccc(c(n1)C)Br 62a_100000210303_100012360386 [1,1,0,0,0,0|2,0,0]=4 6813 B12R1.385 CCCSc1ccc(c(n1)C)Br 62a_100012360386_100000210303 [1,1,0,0,0,0|2,0,0]=4 6814 B12R1.385 CCCSc1ccc(c(n1)C)C 62a_100000103781_100000210303 [1,1,0,0,0,0|2,0,0]=4 6815 B12R1.385 CCCSc1ccc(c(n1)C)C 62a_100000210303_100000103781 [1,1,0,0,0,0|2,0,0]=4 6816 B12R1.385 CCCSc1ccc(c(n1)C)F 62a_100000210303_100009814307 [1,1,0,0,0,0|2,0,0]=4 6817 B12R1.385 CCCSc1ccc(c(n1)C)F 62a_100009814307_100000210303 [1,1,0,0,0,0|2,0,0]=4 6818 B12R1.385 CCCSc1ccc(c(n1)C)N 62a_100000210303_100000720120 [1,1,0,0,0,0|2,0,0]=4 6819 B12R1.385 CCCSc1ccc(c(n1)C)N 62a_100000720120_100000210303 [1,1,0,0,0,0|2,0,0]=4 6820 B12R1.385 CCCSc1ccc(c(n1)C)O 62a_100000210303_100010233687 [1,1,0,0,0,0|1,0,0]=3 6821 B12R1.385 CCCSc1ccc(c(n1)C)O 62a_100010233687_100000210303 [1,1,0,0,0,0|1,0,0]=3 6822 B12R1.385 CCCSc1ccc(c(n1)Cl)O 62a_100000210303_100000721234 [1,1,0,0,0,0|2,0,0]=4 6823 B12R1.385 CCCSc1ccc(c(n1)F)O 62a_100000210303_100009819667 [1,1,0,0,0,0|2,0,0]=4 6824 B12R1.385 CCCSc1ccc(c(n1)F)O 62a_100009819667_100000210303 [1,1,0,0,0,0|2,0,0]=4 6825 B12R1.385 CCCSc1ccc(c(n1)N)O 62a_100000210303_100000685527 [1,1,0,0,0,0|2,0,0]=4 6826 B12R1.385 CCCSc1ccc(c(n1)N)O 62a_100000685527_100000210303 [1,1,0,0,0,0|2,0,0]=4 6827 B12R1.385 CCCSc1ccc(c(n1)O)F 62a_100000210303_100010729010 [1,1,0,0,0,0|2,0,0]=4 6828 B12R1.385 CCCSc1ccc(c(n1)O)N 62a_100000718904_100000210303 [1,1,0,0,0,0|2,0,0]=4 6829 B12R1.385 CCCSc1cnc(c(c1)C)Br 62a_100000210303_100009816107 [1,1,0,0,0,0|2,0,0]=4 6830 B12R1.385 CCCSc1cnc(c(c1)C)Br 62a_100009816107_100000210303 [1,1,0,0,0,0|2,0,0]=4 6831 B12R1.385 CCCSc1cnc(c(c1)C)C 62a_100000210303_100000697892 [1,1,0,0,0,0|2,0,0]=4 6832 B12R1.385 CCCSc1cnc(c(c1)C)C 62a_100000697892_100000210303 [1,1,0,0,0,0|2,0,0]=4 6833 B12R1.385 CCCSc1cnc(c(c1)C)Cl 62a_100000210303_100009922867 [1,1,0,0,0,0|2,0,0]=4 6834 B12R1.385 CCCSc1cnc(c(c1)C)Cl 62a_100009922867_100000210303 [1,1,0,0,0,0|2,0,0]=4 6835 B12R1.385 CCCSc1cnc(c(c1)C)F 62a_100000210303_100000709442 [1,1,0,0,0,0|2,0,0]=4 6836 B12R1.385 CCCSc1cnc(c(c1)C)F 62a_100000709442_100000210303 [1,1,0,0,0,0|2,0,0]=4 6837 B12R1.385 CCCSc1cnc(c(c1)C)N 62a_100000210303_100000684428 [1,1,0,0,0,0|2,0,0]=4 6838 B12R1.385 CCCSc1cnc(c(c1)C)N 62a_100000684428_100000210303 [1,1,0,0,0,0|2,0,0]=4 6839 B12R1.385 CCCSc1cnc(c(c1)C)O 62a_100000210303_100000685391 [1,1,0,0,0,0|1,0,0]=3 6840 B12R1.385 CCCSc1cnc(c(c1)C)O 62a_100000685391_100000210303 [1,1,0,0,0,0|1,0,0]=3 6841 B12R1.385 CCCSc1cnc(c(c1)Cl)O 62a_100000210303_100010238531 [1,1,0,0,0,0|2,0,0]=4 6842 B12R1.385 CCCSc1cnc(c(c1)Cl)O 62a_100010238531_100000210303 [1,1,0,0,0,0|2,0,0]=4 6843 B12R1.385 CCCSc1cnc(c(c1)N)O 62a_100000210303_100000743729 [1,1,0,0,0,0|2,0,0]=4 6844 B12R1.385 CCCSc1cnc(c(c1)N)O 62a_100000743729_100000210303 [1,1,0,0,0,0|2,0,0]=4 6845 B12R1.385 CCCSc1cnc(c(c1)O)C 62a_100000210303_100009864810 [1,1,0,0,0,0|2,0,0]=4 6846 B12R1.385 CCCSc1cnc(c(c1)O)C 62a_100009864810_100000210303 [1,1,0,0,0,0|2,0,0]=4 6847 B12R1.385 CCCSc1cnc(c(c1)O)F 62a_100000210303_100009819871 [1,1,0,0,0,0|2,0,0]=4 6848 B12R1.385 CCCSc1cnc(c(c1)O)F 62a_100009819871_100000210303 [1,1,0,0,0,0|2,0,0]=4 6849 B12R1.385 CCCSc1cnc(c(c1)O)N 62a_100000210303_100009819042 [1,1,0,0,0,0|2,0,0]=4 6850 B12R1.385 CCCSc1cnc(c(c1)O)N 62a_100009819042_100000210303 [1,1,0,0,0,0|2,0,0]=4 6851 B12R1.385 CCNCc1cc(=O)c(co1)O 2230a_100015525214_100000010605 [1,1,0,0,0,0|1,0,1]=4 6852 B12R1.385 CCNCc1cc(c(cn1)Br)C 207a_100015525214_100009814806 [1,1,0,0,0,0|2,0,0]=4 6853 B12R1.385 CCNCc1cc(c(cn1)Br)C 270004a_100015525214_100009814806 [1,1,0,0,0,0|2,0,0]=4 6854 B12R1.385 CCNCc1ccc(=O)n(c1)C 207a_100015525214_100010620449 [1,1,0,0,0,0|1,0,1]=4 6855 B12R1.385 CCNCc1ccc(=O)n(c1)C 270004a_100015525214_100010620449 [1,1,0,0,0,0|1,0,1]=4 6856 B12R1.385 CCNCc1ccc(c(c1)Br)Br 207a_100015525214_100011215943 [1,1,0,0,0,0|2,0,0]=4 6857 B12R1.385 CCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000210202 [1,1,0,0,0,0|2,0,0]=4 6858 B12R1.385 CCNCc1ccc(c(c1)Br)Br 2230a_100015525214_100012353900 [1,1,0,0,0,0|2,0,0]=4 6859 B12R1.385 CCNCc1ccc(c(c1)Br)Br 270004a_100015525214_100011215943 [1,1,0,0,0,0|2,0,0]=4 6860 B12R1.385 CCNCc1ccc(c(c1)Br)Br 34a_100012351559_100000210202 [1,1,0,0,0,0|2,0,0]=4 6861 B12R1.385 CCNCc1ccc(c(c1)Br)C 207a_100015525214_100000695567 [1,1,0,0,0,0|2,0,0]=4 6862 B12R1.385 CCNCc1ccc(c(c1)Br)C 2230a_100015525214_100012232412 [1,1,0,0,0,0|2,0,0]=4 6863 B12R1.385 CCNCc1ccc(c(c1)Br)C 270004a_100015525214_100000695567 [1,1,0,0,0,0|2,0,0]=4 6864 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 207a_100015525214_100000693810 [1,1,0,0,0,0|2,0,0]=4 6865 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000210202 [1,1,0,0,0,0|2,0,0]=4 6866 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 2230a_100015525214_100012353894 [1,1,0,0,0,0|2,0,0]=4 6867 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 270004a_100015525214_100000693810 [1,1,0,0,0,0|2,0,0]=4 6868 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000210202 [1,1,0,0,0,0|2,0,0]=4 6869 B12R1.385 CCNCc1ccc(c(c1)Br)F 207a_100015525214_100000211747 [1,1,0,0,0,0|2,0,0]=4 6870 B12R1.385 CCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000210202 [1,1,0,0,0,0|2,0,0]=4 6871 B12R1.385 CCNCc1ccc(c(c1)Br)F 2230a_100015525214_100011206884 [1,1,0,0,0,0|2,0,0]=4 6872 B12R1.385 CCNCc1ccc(c(c1)Br)F 270004a_100015525214_100000211747 [1,1,0,0,0,0|2,0,0]=4 6873 B12R1.385 CCNCc1ccc(c(c1)Br)F 34a_100015193890_100000210202 [1,1,0,0,0,0|2,0,0]=4 6874 B12R1.385 CCNCc1ccc(c(c1)C)Br 207a_100015525214_100000765772 [1,1,0,0,0,0|1,0,0]=3 6875 B12R1.385 CCNCc1ccc(c(c1)C)Br 2230a_100015205234_100000210202 [1,1,0,0,0,0|1,0,0]=3 6876 B12R1.385 CCNCc1ccc(c(c1)C)Br 2230a_100015525214_100000727479 [1,1,0,0,0,0|1,0,0]=3 6877 B12R1.385 CCNCc1ccc(c(c1)C)Br 270004a_100015525214_100000765772 [1,1,0,0,0,0|1,0,0]=3 6878 B12R1.385 CCNCc1ccc(c(c1)C)Br 34a_100015205234_100000210202 [1,1,0,0,0,0|1,0,0]=3 6879 B12R1.385 CCNCc1ccc(c(c1)C)C 207a_100015525214_100000229942 [1,1,0,0,0,0|1,0,0]=3 6880 B12R1.385 CCNCc1ccc(c(c1)C)C 2230a_100015525214_100000742320 [1,1,0,0,0,0|1,0,0]=3 6881 B12R1.385 CCNCc1ccc(c(c1)C)C 2230a_100025706692_100000210202 [1,1,0,0,0,0|1,0,0]=3 6882 B12R1.385 CCNCc1ccc(c(c1)C)C 270004a_100015525214_100000229942 [1,1,0,0,0,0|1,0,0]=3 6883 B12R1.385 CCNCc1ccc(c(c1)C)C 34a_100025706692_100000210202 [1,1,0,0,0,0|1,0,0]=3 6884 B12R1.385 CCNCc1ccc(c(c1)C)Cl 207a_100015525214_100000698814 [1,1,0,0,0,0|1,0,0]=3 6885 B12R1.385 CCNCc1ccc(c(c1)C)Cl 2230a_100015525214_100012184735 [1,1,0,0,0,0|1,0,0]=3 6886 B12R1.385 CCNCc1ccc(c(c1)C)Cl 270004a_100015525214_100000698814 [1,1,0,0,0,0|1,0,0]=3 6887 B12R1.385 CCNCc1ccc(c(c1)C)F 207a_100015525214_100000748208 [1,1,0,0,0,0|1,0,0]=3 6888 B12R1.385 CCNCc1ccc(c(c1)C)F 2230a_100000239911_100000210202 [1,1,0,0,0,0|1,0,0]=3 6889 B12R1.385 CCNCc1ccc(c(c1)C)F 2230a_100015525214_100011216667 [1,1,0,0,0,0|1,0,0]=3 6890 B12R1.385 CCNCc1ccc(c(c1)C)F 270004a_100015525214_100000748208 [1,1,0,0,0,0|1,0,0]=3 6891 B12R1.385 CCNCc1ccc(c(c1)C)F 34a_100000239911_100000210202 [1,1,0,0,0,0|1,0,0]=3 6892 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 207a_100015525214_100000690054 [1,1,0,0,0,0|2,0,0]=4 6893 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000210202 [1,1,0,0,0,0|2,0,0]=4 6894 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 2230a_100015525214_100012353895 [1,1,0,0,0,0|2,0,0]=4 6895 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 270004a_100015525214_100000690054 [1,1,0,0,0,0|2,0,0]=4 6896 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100000210202 [1,1,0,0,0,0|2,0,0]=4 6897 B12R1.385 CCNCc1ccc(c(c1)Cl)C 207a_100015525214_100000760539 [1,1,0,0,0,0|2,0,0]=4 6898 B12R1.385 CCNCc1ccc(c(c1)Cl)C 2230a_100015525214_100011823929 [1,1,0,0,0,0|2,0,0]=4 6899 B12R1.385 CCNCc1ccc(c(c1)Cl)C 2230a_102495364989_100000210202 [1,1,0,0,0,0|2,0,0]=4 6900 B12R1.385 CCNCc1ccc(c(c1)Cl)C 270004a_100015525214_100000760539 [1,1,0,0,0,0|2,0,0]=4 6901 B12R1.385 CCNCc1ccc(c(c1)Cl)C 34a_102495364989_100000210202 [1,1,0,0,0,0|2,0,0]=4 6902 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 207a_100015525214_100000188533 [1,1,0,0,0,0|2,0,0]=4 6903 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000210202 [1,1,0,0,0,0|2,0,0]=4 6904 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 2230a_100015525214_100000184707 [1,1,0,0,0,0|2,0,0]=4 6905 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 270004a_100015525214_100000188533 [1,1,0,0,0,0|2,0,0]=4 6906 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000210202 [1,1,0,0,0,0|2,0,0]=4 6907 B12R1.385 CCNCc1ccc(c(c1)Cl)F 207a_100015525214_100000742290 [1,1,0,0,0,0|2,0,0]=4 6908 B12R1.385 CCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000210202 [1,1,0,0,0,0|2,0,0]=4 6909 B12R1.385 CCNCc1ccc(c(c1)Cl)F 2230a_100015525214_100000717365 [1,1,0,0,0,0|2,0,0]=4 6910 B12R1.385 CCNCc1ccc(c(c1)Cl)F 270004a_100015525214_100000742290 [1,1,0,0,0,0|2,0,0]=4 6911 B12R1.385 CCNCc1ccc(c(c1)Cl)F 34a_100000749334_100000210202 [1,1,0,0,0,0|2,0,0]=4 6912 B12R1.385 CCNCc1ccc(c(c1)Cl)I 2230a_100015525214_100012349665 [1,1,0,0,0,0|2,0,0]=4 6913 B12R1.385 CCNCc1ccc(c(c1)F)Br 207a_100015525214_100000686674 [1,1,0,0,0,0|2,0,0]=4 6914 B12R1.385 CCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000210202 [1,1,0,0,0,0|2,0,0]=4 6915 B12R1.385 CCNCc1ccc(c(c1)F)Br 2230a_100015525214_100000767054 [1,1,0,0,0,0|2,0,0]=4 6916 B12R1.385 CCNCc1ccc(c(c1)F)Br 270004a_100015525214_100000686674 [1,1,0,0,0,0|2,0,0]=4 6917 B12R1.385 CCNCc1ccc(c(c1)F)Br 34a_100000755036_100000210202 [1,1,0,0,0,0|2,0,0]=4 6918 B12R1.385 CCNCc1ccc(c(c1)F)C 207a_100015525214_100000753222 [1,1,0,0,0,0|2,0,0]=4 6919 B12R1.385 CCNCc1ccc(c(c1)F)C 2230a_100015525214_100011217369 [1,1,0,0,0,0|2,0,0]=4 6920 B12R1.385 CCNCc1ccc(c(c1)F)C 2230a_100102708794_100000210202 [1,1,0,0,0,0|2,0,0]=4 6921 B12R1.385 CCNCc1ccc(c(c1)F)C 270004a_100015525214_100000753222 [1,1,0,0,0,0|2,0,0]=4 6922 B12R1.385 CCNCc1ccc(c(c1)F)C 34a_100102708794_100000210202 [1,1,0,0,0,0|2,0,0]=4 6923 B12R1.385 CCNCc1ccc(c(c1)F)Cl 207a_100015525214_100000745630 [1,1,0,0,0,0|2,0,0]=4 6924 B12R1.385 CCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000210202 [1,1,0,0,0,0|2,0,0]=4 6925 B12R1.385 CCNCc1ccc(c(c1)F)Cl 2230a_100015525214_100000716492 [1,1,0,0,0,0|2,0,0]=4 6926 B12R1.385 CCNCc1ccc(c(c1)F)Cl 270004a_100015525214_100000745630 [1,1,0,0,0,0|2,0,0]=4 6927 B12R1.385 CCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000210202 [1,1,0,0,0,0|2,0,0]=4 6928 B12R1.385 CCNCc1ccc(c(c1)F)F 207a_100015525214_100000211062 [1,1,0,0,0,0|2,0,0]=4 6929 B12R1.385 CCNCc1ccc(c(c1)F)F 2230a_100000737897_100000210202 [1,1,0,0,0,0|2,0,0]=4 6930 B12R1.385 CCNCc1ccc(c(c1)F)F 2230a_100015525214_100000757363 [1,1,0,0,0,0|2,0,0]=4 6931 B12R1.385 CCNCc1ccc(c(c1)F)F 270004a_100015525214_100000211062 [1,1,0,0,0,0|2,0,0]=4 6932 B12R1.385 CCNCc1ccc(c(c1)F)F 34a_100000737897_100000210202 [1,1,0,0,0,0|2,0,0]=4 6933 B12R1.385 CCNCc1ccc(c(c1)F)I 207a_100015525214_100000050832 [1,1,0,0,0,0|2,0,0]=4 6934 B12R1.385 CCNCc1ccc(c(c1)F)I 2230a_100015525214_100010149604 [1,1,0,0,0,0|2,0,0]=4 6935 B12R1.385 CCNCc1ccc(c(c1)F)I 270004a_100015525214_100000050832 [1,1,0,0,0,0|2,0,0]=4 6936 B12R1.385 CCNCc1ccc(c(c1)F)O 34a_100000758358_100000210202 [1,1,0,0,0,0|1,0,0]=3 6937 B12R1.385 CCNCc1ccc(c(c1)I)Br 207a_100015525214_100010146563 [1,1,0,0,0,0|2,0,0]=4 6938 B12R1.385 CCNCc1ccc(c(c1)I)Br 2230a_100015525214_100010146616 [1,1,0,0,0,0|2,0,0]=4 6939 B12R1.385 CCNCc1ccc(c(c1)I)Br 270004a_100015525214_100010146563 [1,1,0,0,0,0|2,0,0]=4 6940 B12R1.385 CCNCc1ccc(c(c1)I)C 207a_100015525214_100010197721 [1,1,0,0,0,0|2,0,0]=4 6941 B12R1.385 CCNCc1ccc(c(c1)I)C 2230a_100015525214_100010206137 [1,1,0,0,0,0|2,0,0]=4 6942 B12R1.385 CCNCc1ccc(c(c1)I)C 270004a_100015525214_100010197721 [1,1,0,0,0,0|2,0,0]=4 6943 B12R1.385 CCNCc1ccc(c(c1)I)Cl 207a_100015525214_100010209939 [1,1,0,0,0,0|2,0,0]=4 6944 B12R1.385 CCNCc1ccc(c(c1)I)Cl 270004a_100015525214_100010209939 [1,1,0,0,0,0|2,0,0]=4 6945 B12R1.385 CCNCc1ccc(c(c1)I)F 207a_100015525214_100010188209 [1,1,0,0,0,0|2,0,0]=4 6946 B12R1.385 CCNCc1ccc(c(c1)I)F 2230a_100015525214_100010188208 [1,1,0,0,0,0|2,0,0]=4 6947 B12R1.385 CCNCc1ccc(c(c1)I)F 270004a_100015525214_100010188209 [1,1,0,0,0,0|2,0,0]=4 6948 B12R1.385 CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000210202 [1,1,0,0,0,0|1,0,0]=3 6949 B12R1.385 CCNCc1ccc(c(c1)O)F 34a_100160469508_100000210202 [1,1,0,0,0,0|1,0,0]=3 6950 B12R1.385 CCNCc1ccc(c(c1)O)O 34a_100000010075_100000210202 [1,1,0,0,0,0|0,0,0]=2 6951 B12R1.385 CCNCc1ccc(c(n1)C)Br 207a_100015525214_100010238520 [1,1,0,0,0,0|2,0,0]=4 6952 B12R1.385 CCNCc1ccc(c(n1)C)Br 270004a_100015525214_100010238520 [1,1,0,0,0,0|2,0,0]=4 6953 B12R1.385 CCNCc1ccc(c(n1)C)C 2230a_202515432893_100000210202 [1,1,0,0,0,0|2,0,0]=4 6954 B12R1.385 CCNCc1ccc(c(n1)C)C 34a_202515432893_100000210202 [1,1,0,0,0,0|2,0,0]=4 6955 B12R1.385 CCNCc1cnc(c(c1)Br)O 207a_100015525214_100010064886 [1,1,0,0,0,0|2,0,0]=4 6956 B12R1.385 CCNCc1cnc(c(c1)Br)O 270004a_100015525214_100010064886 [1,1,0,0,0,0|2,0,0]=4 6957 B12R1.385 CCNCc1cnc(c(c1)C)Br 270004a_100015525214_100009814818 [1,1,0,0,0,0|2,0,0]=4 6958 B12R1.385 CCNCc1cnc(c(c1)C)Cl 207a_100015525214_100000070293 [1,1,0,0,0,0|2,0,0]=4 6959 B12R1.385 CCNCc1cnc(c(c1)C)Cl 270004a_100015525214_100000070293 [1,1,0,0,0,0|2,0,0]=4 6960 B12R1.385 CCNCc1cnc(c(c1)C)F 270004a_100015525214_100000050577 [1,1,0,0,0,0|2,0,0]=4 6961 B12R1.385 CCOCc1cc(c(cn1)Br)C 34a_200010713146_100000210202 [1,1,0,0,0,0|2,0,0]=4 6962 B12R1.385 CCOCc1ccc(c(c1)Br)Br 34a_100121572206_100012353900 [1,1,0,0,0,0|2,0,0]=4 6963 B12R1.385 CCOCc1ccc(c(c1)Br)C 34a_100000708995_100000210202 [1,1,0,0,0,0|2,0,0]=4 6964 B12R1.385 CCOCc1ccc(c(c1)Br)C 34a_100121572206_100012232412 [1,1,0,0,0,0|2,0,0]=4 6965 B12R1.385 CCOCc1ccc(c(c1)Br)C 7a_100000708995_100000210202 [1,1,0,0,0,0|2,0,0]=4 6966 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100000210202 [1,1,0,0,0,0|2,0,0]=4 6967 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 34a_100121572206_100012353894 [1,1,0,0,0,0|2,0,0]=4 6968 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000210202 [1,1,0,0,0,0|2,0,0]=4 6969 B12R1.385 CCOCc1ccc(c(c1)Br)F 34a_100000246287_100000210202 [1,1,0,0,0,0|2,0,0]=4 6970 B12R1.385 CCOCc1ccc(c(c1)Br)F 34a_100121572206_100011206884 [1,1,0,0,0,0|2,0,0]=4 6971 B12R1.385 CCOCc1ccc(c(c1)Br)F 7a_100000246287_100000210202 [1,1,0,0,0,0|2,0,0]=4 6972 B12R1.385 CCOCc1ccc(c(c1)C)Br 34a_100000718852_100000210202 [1,1,0,0,0,0|1,0,0]=3 6973 B12R1.385 CCOCc1ccc(c(c1)C)Br 34a_100121572206_100000727479 [1,1,0,0,0,0|1,0,0]=3 6974 B12R1.385 CCOCc1ccc(c(c1)C)Br 7a_100000718852_100000210202 [1,1,0,0,0,0|1,0,0]=3 6975 B12R1.385 CCOCc1ccc(c(c1)C)C 34a_100011215342_100000210202 [1,1,0,0,0,0|1,0,0]=3 6976 B12R1.385 CCOCc1ccc(c(c1)C)C 34a_100121572206_100000742320 [1,1,0,0,0,0|1,0,0]=3 6977 B12R1.385 CCOCc1ccc(c(c1)C)C 7a_100011215342_100000210202 [1,1,0,0,0,0|1,0,0]=3 6978 B12R1.385 CCOCc1ccc(c(c1)C)Cl 34a_100121572206_100012184735 [1,1,0,0,0,0|1,0,0]=3 6979 B12R1.385 CCOCc1ccc(c(c1)C)F 34a_100011219793_100000210202 [1,1,0,0,0,0|1,0,0]=3 6980 B12R1.385 CCOCc1ccc(c(c1)C)F 34a_100121572206_100011216667 [1,1,0,0,0,0|1,0,0]=3 6981 B12R1.385 CCOCc1ccc(c(c1)C)F 7a_100011219793_100000210202 [1,1,0,0,0,0|1,0,0]=3 6982 B12R1.385 CCOCc1ccc(c(c1)C)N 34a_200011997030_100000210202 [1,1,0,0,0,0|1,0,0]=3 6983 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100000210202 [1,1,0,0,0,0|2,0,0]=4 6984 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 34a_100121572206_100012353895 [1,1,0,0,0,0|2,0,0]=4 6985 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100000210202 [1,1,0,0,0,0|2,0,0]=4 6986 B12R1.385 CCOCc1ccc(c(c1)Cl)C 34a_100011290783_100000210202 [1,1,0,0,0,0|2,0,0]=4 6987 B12R1.385 CCOCc1ccc(c(c1)Cl)C 34a_100121572206_100011823929 [1,1,0,0,0,0|2,0,0]=4 6988 B12R1.385 CCOCc1ccc(c(c1)Cl)C 7a_100011290783_100000210202 [1,1,0,0,0,0|2,0,0]=4 6989 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100000210202 [1,1,0,0,0,0|2,0,0]=4 6990 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 34a_100121572206_100000184707 [1,1,0,0,0,0|2,0,0]=4 6991 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000210202 [1,1,0,0,0,0|2,0,0]=4 6992 B12R1.385 CCOCc1ccc(c(c1)Cl)F 34a_100011217911_100000210202 [1,1,0,0,0,0|2,0,0]=4 6993 B12R1.385 CCOCc1ccc(c(c1)Cl)F 34a_100121572206_100011934319 [1,1,0,0,0,0|2,0,0]=4 6994 B12R1.385 CCOCc1ccc(c(c1)Cl)F 7a_100011217911_100000210202 [1,1,0,0,0,0|2,0,0]=4 6995 B12R1.385 CCOCc1ccc(c(c1)Cl)I 34a_100000718186_100000210202 [1,1,0,0,0,0|2,0,0]=4 6996 B12R1.385 CCOCc1ccc(c(c1)Cl)I 34a_100121572206_100012349665 [1,1,0,0,0,0|2,0,0]=4 6997 B12R1.385 CCOCc1ccc(c(c1)Cl)I 7a_100000718186_100000210202 [1,1,0,0,0,0|2,0,0]=4 6998 B12R1.385 CCOCc1ccc(c(c1)F)Br 34a_100011533735_100000210202 [1,1,0,0,0,0|2,0,0]=4 6999 B12R1.385 CCOCc1ccc(c(c1)F)Br 34a_100121572206_100000767054 [1,1,0,0,0,0|2,0,0]=4 7000 B12R1.385 CCOCc1ccc(c(c1)F)Br 7a_100011533735_100000210202 [1,1,0,0,0,0|2,0,0]=4 7001 B12R1.385 CCOCc1ccc(c(c1)F)C 34a_100000702247_100000210202 [1,1,0,0,0,0|2,0,0]=4 7002 B12R1.385 CCOCc1ccc(c(c1)F)C 34a_100121572206_100011217369 [1,1,0,0,0,0|2,0,0]=4 7003 B12R1.385 CCOCc1ccc(c(c1)F)C 7a_100000702247_100000210202 [1,1,0,0,0,0|2,0,0]=4 7004 B12R1.385 CCOCc1ccc(c(c1)F)Cl 34a_100011218299_100000210202 [1,1,0,0,0,0|2,0,0]=4 7005 B12R1.385 CCOCc1ccc(c(c1)F)Cl 34a_100121572206_100011519011 [1,1,0,0,0,0|2,0,0]=4 7006 B12R1.385 CCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000210202 [1,1,0,0,0,0|2,0,0]=4 7007 B12R1.385 CCOCc1ccc(c(c1)F)F 34a_100011215442_100000210202 [1,1,0,0,0,0|2,0,0]=4 7008 B12R1.385 CCOCc1ccc(c(c1)F)F 34a_100121572206_100000757363 [1,1,0,0,0,0|2,0,0]=4 7009 B12R1.385 CCOCc1ccc(c(c1)F)F 7a_100011215442_100000210202 [1,1,0,0,0,0|2,0,0]=4 7010 B12R1.385 CCOCc1ccc(c(c1)F)I 34a_100010149597_100000210202 [1,1,0,0,0,0|2,0,0]=4 7011 B12R1.385 CCOCc1ccc(c(c1)F)I 34a_100121572206_100010149604 [1,1,0,0,0,0|2,0,0]=4 7012 B12R1.385 CCOCc1ccc(c(c1)F)I 7a_100010149597_100000210202 [1,1,0,0,0,0|2,0,0]=4 7013 B12R1.385 CCOCc1ccc(c(c1)F)N 34a_100011217239_100000210202 [1,1,0,0,0,0|2,0,0]=4 7014 B12R1.385 CCOCc1ccc(c(c1)I)Br 34a_100121572206_100010146616 [1,1,0,0,0,0|2,0,0]=4 7015 B12R1.385 CCOCc1ccc(c(c1)I)C 34a_100000050133_100000210202 [1,1,0,0,0,0|2,0,0]=4 7016 B12R1.385 CCOCc1ccc(c(c1)I)C 34a_100121572206_100010206137 [1,1,0,0,0,0|2,0,0]=4 7017 B12R1.385 CCOCc1ccc(c(c1)I)C 7a_100000050133_100000210202 [1,1,0,0,0,0|2,0,0]=4 7018 B12R1.385 CCOCc1ccc(c(c1)I)F 34a_100000049585_100000210202 [1,1,0,0,0,0|2,0,0]=4 7019 B12R1.385 CCOCc1ccc(c(c1)I)F 34a_100121572206_100010188208 [1,1,0,0,0,0|2,0,0]=4 7020 B12R1.385 CCOCc1ccc(c(c1)I)F 7a_100000049585_100000210202 [1,1,0,0,0,0|2,0,0]=4 7021 B12R1.385 CCOCc1ccc(c(c1)N)Br 34a_100012347568_100000210202 [1,1,0,0,0,0|2,0,0]=4 7022 B12R1.385 CCOCc1ccc(c(c1)N)C 34a_100000758420_100000210202 [1,1,0,0,0,0|2,0,0]=4 7023 B12R1.385 CCOCc1ccc(c(c1)N)Cl 34a_106256033963_100000210202 [1,1,0,0,0,0|2,0,0]=4 7024 B12R1.385 CCOCc1ccc(c(c1)N)F 34a_102125399562_100000210202 [1,1,0,0,0,0|2,0,0]=4 7025 B12R1.385 CCOCc1ccc(c(n1)C)Br 34a_100010114280_100000210202 [1,1,0,0,0,0|2,0,0]=4 7026 B12R1.385 CCOCc1ccc(c(n1)C)F 34a_200009884719_100000210202 [1,1,0,0,0,0|2,0,0]=4 7027 B12R1.385 CCOCc1cnc(c(c1)C)Cl 34a_200000092119_100000210202 [1,1,0,0,0,0|2,0,0]=4 7028 B12R1.385 CCOCc1cnc(c(c1)C)Cl 7a_200000092119_100000210202 [1,1,0,0,0,0|2,0,0]=4 7029 B12R1.385 CCSCc1cc(=O)c(co1)O 62a_100000210202_100000010605 [1,1,0,0,0,0|1,0,1]=4 7030 B12R1.385 CCSCc1ccc(c(c1)Br)Br 62a_100000210202_100012353900 [1,1,0,0,0,0|2,0,0]=4 7031 B12R1.385 CCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000210202 [1,1,0,0,0,0|2,0,0]=4 7032 B12R1.385 CCSCc1ccc(c(c1)Br)C 62a_100000210202_100012232412 [1,1,0,0,0,0|2,0,0]=4 7033 B12R1.385 CCSCc1ccc(c(c1)Br)C 62a_100012232412_100000210202 [1,1,0,0,0,0|2,0,0]=4 7034 B12R1.385 CCSCc1ccc(c(c1)Br)Cl 62a_100000210202_100012353894 [1,1,0,0,0,0|2,0,0]=4 7035 B12R1.385 CCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000210202 [1,1,0,0,0,0|2,0,0]=4 7036 B12R1.385 CCSCc1ccc(c(c1)Br)F 62a_100000210202_100011206884 [1,1,0,0,0,0|2,0,0]=4 7037 B12R1.385 CCSCc1ccc(c(c1)Br)F 62a_100011206884_100000210202 [1,1,0,0,0,0|2,0,0]=4 7038 B12R1.385 CCSCc1ccc(c(c1)C)Br 62a_100000210202_100000727479 [1,1,0,0,0,0|1,0,0]=3 7039 B12R1.385 CCSCc1ccc(c(c1)C)Br 62a_100000727479_100000210202 [1,1,0,0,0,0|1,0,0]=3 7040 B12R1.385 CCSCc1ccc(c(c1)C)C 62a_100000210202_100000742320 [1,1,0,0,0,0|1,0,0]=3 7041 B12R1.385 CCSCc1ccc(c(c1)C)C 62a_100000742320_100000210202 [1,1,0,0,0,0|1,0,0]=3 7042 B12R1.385 CCSCc1ccc(c(c1)C)Cl 62a_100000210202_100012184735 [1,1,0,0,0,0|1,0,0]=3 7043 B12R1.385 CCSCc1ccc(c(c1)C)Cl 62a_100012184735_100000210202 [1,1,0,0,0,0|1,0,0]=3 7044 B12R1.385 CCSCc1ccc(c(c1)C)F 62a_100000210202_100011216667 [1,1,0,0,0,0|1,0,0]=3 7045 B12R1.385 CCSCc1ccc(c(c1)C)F 62a_100011216667_100000210202 [1,1,0,0,0,0|1,0,0]=3 7046 B12R1.385 CCSCc1ccc(c(c1)Cl)Br 62a_100000210202_100012353895 [1,1,0,0,0,0|2,0,0]=4 7047 B12R1.385 CCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000210202 [1,1,0,0,0,0|2,0,0]=4 7048 B12R1.385 CCSCc1ccc(c(c1)Cl)C 62a_100000210202_100011823929 [1,1,0,0,0,0|2,0,0]=4 7049 B12R1.385 CCSCc1ccc(c(c1)Cl)C 62a_100011823929_100000210202 [1,1,0,0,0,0|2,0,0]=4 7050 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000210202 [1,1,0,0,0,0|2,0,0]=4 7051 B12R1.385 CCSCc1ccc(c(c1)Cl)Cl 62a_100000210202_100000184707 [1,1,0,0,0,0|2,0,0]=4 7052 B12R1.385 CCSCc1ccc(c(c1)Cl)F 62a_100000210202_100011934319 [1,1,0,0,0,0|2,0,0]=4 7053 B12R1.385 CCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000210202 [1,1,0,0,0,0|2,0,0]=4 7054 B12R1.385 CCSCc1ccc(c(c1)Cl)I 62a_100000210202_100012349665 [1,1,0,0,0,0|2,0,0]=4 7055 B12R1.385 CCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000210202 [1,1,0,0,0,0|2,0,0]=4 7056 B12R1.385 CCSCc1ccc(c(c1)F)Br 62a_100000210202_100000767054 [1,1,0,0,0,0|2,0,0]=4 7057 B12R1.385 CCSCc1ccc(c(c1)F)Br 62a_100000767054_100000210202 [1,1,0,0,0,0|2,0,0]=4 7058 B12R1.385 CCSCc1ccc(c(c1)F)C 62a_100000210202_100011217369 [1,1,0,0,0,0|2,0,0]=4 7059 B12R1.385 CCSCc1ccc(c(c1)F)C 62a_100011217369_100000210202 [1,1,0,0,0,0|2,0,0]=4 7060 B12R1.385 CCSCc1ccc(c(c1)F)Cl 62a_100000210202_100000716492 [1,1,0,0,0,0|2,0,0]=4 7061 B12R1.385 CCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000210202 [1,1,0,0,0,0|2,0,0]=4 7062 B12R1.385 CCSCc1ccc(c(c1)F)F 62a_100000210202_100000757363 [1,1,0,0,0,0|2,0,0]=4 7063 B12R1.385 CCSCc1ccc(c(c1)F)F 62a_100000757363_100000210202 [1,1,0,0,0,0|2,0,0]=4 7064 B12R1.385 CCSCc1ccc(c(c1)F)I 62a_100000210202_100010149604 [1,1,0,0,0,0|2,0,0]=4 7065 B12R1.385 CCSCc1ccc(c(c1)F)I 62a_100010149604_100000210202 [1,1,0,0,0,0|2,0,0]=4 7066 B12R1.385 CCSCc1ccc(c(c1)I)Br 62a_100000210202_100010146616 [1,1,0,0,0,0|2,0,0]=4 7067 B12R1.385 CCSCc1ccc(c(c1)I)Br 62a_100010146616_100000210202 [1,1,0,0,0,0|2,0,0]=4 7068 B12R1.385 CCSCc1ccc(c(c1)I)C 62a_100000210202_100010206137 [1,1,0,0,0,0|2,0,0]=4 7069 B12R1.385 CCSCc1ccc(c(c1)I)C 62a_100010206137_100000210202 [1,1,0,0,0,0|2,0,0]=4 7070 B12R1.385 CCSCc1ccc(c(c1)I)F 62a_100000210202_100010188208 [1,1,0,0,0,0|2,0,0]=4 7071 B12R1.385 CCSCc1ccc(c(c1)I)F 62a_100010188208_100000210202 [1,1,0,0,0,0|2,0,0]=4 7072 B12R1.385 CNCCc1ccc(c(c1)C)C 2230a_100020591374_200000210301 [1,1,0,0,0,0|1,0,0]=3 7073 B12R1.385 CNCCc1ccc(c(c1)C)C 34a_100020591374_200000210301 [1,1,0,0,0,0|1,0,0]=3 7074 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200000210301 [1,1,0,0,0,0|2,0,0]=4 7075 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 2230a_106832991635_100011713676 [1,1,0,0,0,0|2,0,0]=4 7076 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200000210301 [1,1,0,0,0,0|2,0,0]=4 7077 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 34a_100102657272_100011713676 [1,1,0,0,0,0|2,0,0]=4 7078 B12R1.385 CNCCc1ccc(c(c1)Cl)Cl 7a_106832991635_100011713676 [1,1,0,0,0,0|2,0,0]=4 7079 B12R1.385 CNCCc1ccc(c(c1)Cl)F 2230a_106832991635_100012361305 [1,1,0,0,0,0|2,0,0]=4 7080 B12R1.385 CNCCc1ccc(c(c1)Cl)F 2230a_200011997520_200000210301 [1,1,0,0,0,0|2,0,0]=4 7081 B12R1.385 CNCCc1ccc(c(c1)Cl)F 34a_100102657272_100012361305 [1,1,0,0,0,0|2,0,0]=4 7082 B12R1.385 CNCCc1ccc(c(c1)Cl)F 34a_200011997520_200000210301 [1,1,0,0,0,0|2,0,0]=4 7083 B12R1.385 CNCCc1ccc(c(c1)Cl)F 7a_106832991635_100012361305 [1,1,0,0,0,0|2,0,0]=4 7084 B12R1.385 CNCCc1ccc(c(c1)F)F 2230a_106832991635_100000690553 [1,1,0,0,0,0|2,0,0]=4 7085 B12R1.385 CNCCc1ccc(c(c1)F)F 2230a_200000706328_200000210301 [1,1,0,0,0,0|2,0,0]=4 7086 B12R1.385 CNCCc1ccc(c(c1)F)F 34a_100102657272_100000690553 [1,1,0,0,0,0|2,0,0]=4 7087 B12R1.385 CNCCc1ccc(c(c1)F)F 34a_200000706328_200000210301 [1,1,0,0,0,0|2,0,0]=4 7088 B12R1.385 CNCCc1ccc(c(c1)F)F 7a_106832991635_100000690553 [1,1,0,0,0,0|2,0,0]=4 7089 B12R1.385 CNCCc1ccc(c(c1)O)O 34a_100000210387_200000210301 [1,1,0,0,0,0|0,0,0]=2 7090 B12R1.385 CNCCc1ccc(c(c1)O)O 7a_106832991635_200010393615 [1,1,0,0,0,0|0,0,0]=2 7091 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 34a_100011709245_200000210301 [1,1,0,0,0,0|2,0,0]=4 7092 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 34a_100138415774_100011713676 [1,1,0,0,0,0|2,0,0]=4 7093 B12R1.385 COCCc1ccc(c(c1)Cl)Cl 7a_100011709245_200000210301 [1,1,0,0,0,0|2,0,0]=4 7094 B12R1.385 COCCc1ccc(c(c1)Cl)F 34a_100011830478_200000210301 [1,1,0,0,0,0|2,0,0]=4 7095 B12R1.385 COCCc1ccc(c(c1)Cl)F 34a_100138415774_100012361305 [1,1,0,0,0,0|2,0,0]=4 7096 B12R1.385 COCCc1ccc(c(c1)Cl)F 7a_100011830478_200000210301 [1,1,0,0,0,0|2,0,0]=4 7097 B12R1.385 COCCc1ccc(c(c1)F)Br 34a_100012921202_200000210301 [1,1,0,0,0,0|2,0,0]=4 7098 B12R1.385 COCCc1ccc(c(c1)F)Br 7a_100012921202_200000210301 [1,1,0,0,0,0|2,0,0]=4 7099 B12R1.385 COCCc1ccc(c(c1)F)Cl 34a_100011934464_200000210301 [1,1,0,0,0,0|2,0,0]=4 7100 B12R1.385 COCCc1ccc(c(c1)F)Cl 7a_100011934464_200000210301 [1,1,0,0,0,0|2,0,0]=4 7101 B12R1.385 COCCc1ccc(c(c1)F)F 34a_100000690376_200000210301 [1,1,0,0,0,0|2,0,0]=4 7102 B12R1.385 COCCc1ccc(c(c1)F)F 34a_100138415774_100000690553 [1,1,0,0,0,0|2,0,0]=4 7103 B12R1.385 COCCc1ccc(c(c1)F)F 7a_100000690376_200000210301 [1,1,0,0,0,0|2,0,0]=4 7104 B12R1.385 COCNc1ccc(c(c1)C)Br 2230a_100000210723_100000766300 [1,1,0,0,0,0|2,0,0]=4 7105 B12R1.385 COCNc1ccc(c(c1)C)C 2230a_100000724040_100000766300 [1,1,0,0,0,0|2,0,0]=4 7106 B12R1.385 COCNc1ccc(c(c1)C)Cl 2230a_100000187808_100000766300 [1,1,0,0,0,0|2,0,0]=4 7107 B12R1.385 COCNc1ccc(c(c1)C)F 2230a_100000750164_100000766300 [1,1,0,0,0,0|2,0,0]=4 7108 B12R1.385 COCOc1ccc(c(c1)F)O 271570a_203496583355_100012265695 [1,1,0,0,0,0|2,0,0]=4 7109 B12R1.385 COCOc1ccc(c(c1)O)C 271570a_203496583355_200015918306 [1,1,0,0,0,0|2,0,0]=4 7110 B12R1.385 COCSc1cc(c(cn1)O)C 62a_100000766300_100000692680 [1,1,0,0,0,0|2,0,0]=4 7111 B12R1.385 COCSc1ccc(c(c1)Br)O 62a_100000766300_100012361655 [1,1,0,0,0,0|2,0,0]=4 7112 B12R1.385 COCSc1ccc(c(c1)Br)O 62a_100012361655_100000766300 [1,1,0,0,0,0|2,0,0]=4 7113 B12R1.385 COCSc1ccc(c(c1)C)Br 62a_100000766300_100009813585 [1,1,0,0,0,0|2,0,0]=4 7114 B12R1.385 COCSc1ccc(c(c1)C)Br 62a_100009813585_100000766300 [1,1,0,0,0,0|2,0,0]=4 7115 B12R1.385 COCSc1ccc(c(c1)C)C 62a_100000766300_100011215607 [1,1,0,0,0,0|2,0,0]=4 7116 B12R1.385 COCSc1ccc(c(c1)C)C 62a_100011215607_100000766300 [1,1,0,0,0,0|2,0,0]=4 7117 B12R1.385 COCSc1ccc(c(c1)C)Cl 62a_100000049509_100000766300 [1,1,0,0,0,0|2,0,0]=4 7118 B12R1.385 COCSc1ccc(c(c1)C)Cl 62a_100000766300_100000049509 [1,1,0,0,0,0|2,0,0]=4 7119 B12R1.385 COCSc1ccc(c(c1)C)F 62a_100000766300_100011218330 [1,1,0,0,0,0|2,0,0]=4 7120 B12R1.385 COCSc1ccc(c(c1)C)F 62a_100011218330_100000766300 [1,1,0,0,0,0|2,0,0]=4 7121 B12R1.385 COCSc1ccc(c(c1)C)N 62a_100000211769_100000766300 [1,1,0,0,0,0|2,0,0]=4 7122 B12R1.385 COCSc1ccc(c(c1)C)N 62a_100000766300_100000211769 [1,1,0,0,0,0|2,0,0]=4 7123 B12R1.385 COCSc1ccc(c(c1)C)O 62a_100000766300_100000186361 [1,1,0,0,0,0|1,0,0]=3 7124 B12R1.385 COCSc1ccc(c(c1)Cl)O 62a_100000766300_100012360047 [1,1,0,0,0,0|2,0,0]=4 7125 B12R1.385 COCSc1ccc(c(c1)Cl)O 62a_100012360047_100000766300 [1,1,0,0,0,0|2,0,0]=4 7126 B12R1.385 COCSc1ccc(c(c1)F)O 62a_100000185481_100000766300 [1,1,0,0,0,0|2,0,0]=4 7127 B12R1.385 COCSc1ccc(c(c1)F)O 62a_100000766300_100000185481 [1,1,0,0,0,0|2,0,0]=4 7128 B12R1.385 COCSc1ccc(c(c1)N)O 62a_100000752626_100000766300 [1,1,0,0,0,0|2,0,0]=4 7129 B12R1.385 COCSc1ccc(c(c1)N)O 62a_100000766300_100000752626 [1,1,0,0,0,0|2,0,0]=4 7130 B12R1.385 COCSc1ccc(c(c1)O)Br 62a_100000766300_100012356990 [1,1,0,0,0,0|2,0,0]=4 7131 B12R1.385 COCSc1ccc(c(c1)O)Br 62a_100012356990_100000766300 [1,1,0,0,0,0|2,0,0]=4 7132 B12R1.385 COCSc1ccc(c(c1)O)C 62a_100000685420_100000766300 [1,1,0,0,0,0|2,0,0]=4 7133 B12R1.385 COCSc1ccc(c(c1)O)C 62a_100000766300_100000685420 [1,1,0,0,0,0|2,0,0]=4 7134 B12R1.385 COCSc1ccc(c(c1)O)Cl 62a_100000766300_100011356854 [1,1,0,0,0,0|2,0,0]=4 7135 B12R1.385 COCSc1ccc(c(c1)O)Cl 62a_100011356854_100000766300 [1,1,0,0,0,0|2,0,0]=4 7136 B12R1.385 COCSc1ccc(c(c1)O)F 62a_100000686035_100000766300 [1,1,0,0,0,0|2,0,0]=4 7137 B12R1.385 COCSc1ccc(c(c1)O)F 62a_100000766300_100000686035 [1,1,0,0,0,0|2,0,0]=4 7138 B12R1.385 COCSc1ccc(c(c1)O)N 62a_100000739049_100000766300 [1,1,0,0,0,0|2,0,0]=4 7139 B12R1.385 COCSc1ccc(c(c1)O)N 62a_100000766300_100000739049 [1,1,0,0,0,0|2,0,0]=4 7140 B12R1.385 COCSc1ccc(c(c1)O)O 62a_100000766300_100009813601 [1,1,0,0,0,0|1,0,0]=3 7141 B12R1.385 COCSc1ccc(c(n1)C)O 62a_100000766300_100010233687 [1,1,0,0,0,0|2,0,0]=4 7142 B12R1.385 COCSc1ccc(c(n1)C)O 62a_100010233687_100000766300 [1,1,0,0,0,0|2,0,0]=4 7143 B12R1.385 COCSc1cnc(c(c1)C)O 62a_100000685391_100000766300 [1,1,0,0,0,0|2,0,0]=4 7144 B12R1.385 COCSc1cnc(c(c1)C)O 62a_100000766300_100000685391 [1,1,0,0,0,0|2,0,0]=4 7145 B12R1.385 CSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_200000210301 [1,1,0,0,0,0|2,0,0]=4 7146 B12R1.385 CSCCc1ccc(c(c1)Cl)Cl 62a_200000210301_100011713676 [1,1,0,0,0,0|2,0,0]=4 7147 B12R1.385 CSCCc1ccc(c(c1)Cl)F 62a_100012361305_200000210301 [1,1,0,0,0,0|2,0,0]=4 7148 B12R1.385 CSCCc1ccc(c(c1)Cl)F 62a_200000210301_100012361305 [1,1,0,0,0,0|2,0,0]=4 7149 B12R1.385 CSCCc1ccc(c(c1)F)F 62a_100000690553_200000210301 [1,1,0,0,0,0|2,0,0]=4 7150 B12R1.385 CSCCc1ccc(c(c1)F)F 62a_200000210301_100000690553 [1,1,0,0,0,0|2,0,0]=4 7151 B12R1.385 CSCCc1ccc(c(c1)O)O 62a_200000210301_200010393615 [1,1,0,0,0,0|0,0,0]=2 7152 B12R1.385 CSCNc1ccc(c(c1)Br)O 34a_100011534360_100011218213 [1,1,0,0,0,0|2,0,0]=4 7153 B12R1.385 CSCNc1ccc(c(c1)C)Br 2230a_100000210723_100011218213 [1,1,0,0,0,0|2,0,0]=4 7154 B12R1.385 CSCNc1ccc(c(c1)C)Br 34a_100000210723_100011218213 [1,1,0,0,0,0|2,0,0]=4 7155 B12R1.385 CSCNc1ccc(c(c1)C)C 2230a_100000724040_100011218213 [1,1,0,0,0,0|2,0,0]=4 7156 B12R1.385 CSCNc1ccc(c(c1)C)C 34a_100000724040_100011218213 [1,1,0,0,0,0|2,0,0]=4 7157 B12R1.385 CSCNc1ccc(c(c1)C)Cl 2230a_100000187808_100011218213 [1,1,0,0,0,0|2,0,0]=4 7158 B12R1.385 CSCNc1ccc(c(c1)C)Cl 34a_100000187808_100011218213 [1,1,0,0,0,0|2,0,0]=4 7159 B12R1.385 CSCNc1ccc(c(c1)C)F 2230a_100000750164_100011218213 [1,1,0,0,0,0|2,0,0]=4 7160 B12R1.385 CSCNc1ccc(c(c1)C)F 34a_100000750164_100011218213 [1,1,0,0,0,0|2,0,0]=4 7161 B12R1.385 CSCNc1ccc(c(c1)C)I 34a_100000198070_100011218213 [1,1,0,0,0,0|2,0,0]=4 7162 B12R1.385 CSCNc1ccc(c(c1)C)O 34a_100011218179_100011218213 [1,1,0,0,0,0|1,0,0]=3 7163 B12R1.385 CSCNc1ccc(c(c1)Cl)O 34a_100000744943_100011218213 [1,1,0,0,0,0|2,0,0]=4 7164 B12R1.385 CSCNc1ccc(c(c1)F)O 34a_100011220035_100011218213 [1,1,0,0,0,0|2,0,0]=4 7165 B12R1.385 CSCNc1ccc(c(c1)O)C 34a_100000759471_100011218213 [1,1,0,0,0,0|2,0,0]=4 7166 B12R1.385 CSCNc1ccc(c(c1)O)Cl 34a_100011934209_100011218213 [1,1,0,0,0,0|2,0,0]=4 7167 B12R1.385 CSCNc1ccc(c(c1)O)F 34a_100012017398_100011218213 [1,1,0,0,0,0|2,0,0]=4 7168 B12R1.385 CSCNc1ccc(c(c1)O)O 34a_100102946323_100011218213 [1,1,0,0,0,0|1,0,0]=3 7169 B12R1.385 CSCOc1ccc(c(c1)C)Br 34a_100000690111_100011218213 [1,1,0,0,0,0|2,0,0]=4 7170 B12R1.385 CSCOc1ccc(c(c1)C)C 34a_100000210932_100011218213 [1,1,0,0,0,0|2,0,0]=4 7171 B12R1.385 CSCOc1ccc(c(c1)C)Cl 34a_100000211092_100011218213 [1,1,0,0,0,0|2,0,0]=4 7172 B12R1.385 CSCOc1ccc(c(c1)C)F 34a_100000751312_100011218213 [1,1,0,0,0,0|2,0,0]=4 7173 B12R1.385 CSCOc1ccc(c(c1)C)I 34a_100000729255_100011218213 [1,1,0,0,0,0|2,0,0]=4 7174 B12R1.385 CSCOc1ccc(c(c1)C)N 34a_100000756630_100011218213 [1,1,0,0,0,0|2,0,0]=4 7175 B12R1.385 CSCSc1cc(c(cn1)O)C 62a_100011218213_100000692680 [1,1,0,0,0,0|2,0,0]=4 7176 B12R1.385 CSCSc1ccc(c(c1)Br)O 62a_100011218213_100012361655 [1,1,0,0,0,0|2,0,0]=4 7177 B12R1.385 CSCSc1ccc(c(c1)Br)O 62a_100012361655_100011218213 [1,1,0,0,0,0|2,0,0]=4 7178 B12R1.385 CSCSc1ccc(c(c1)C)Br 62a_100009813585_100011218213 [1,1,0,0,0,0|2,0,0]=4 7179 B12R1.385 CSCSc1ccc(c(c1)C)Br 62a_100011218213_100009813585 [1,1,0,0,0,0|2,0,0]=4 7180 B12R1.385 CSCSc1ccc(c(c1)C)C 62a_100011215607_100011218213 [1,1,0,0,0,0|2,0,0]=4 7181 B12R1.385 CSCSc1ccc(c(c1)C)C 62a_100011218213_100011215607 [1,1,0,0,0,0|2,0,0]=4 7182 B12R1.385 CSCSc1ccc(c(c1)C)Cl 62a_100000049509_100011218213 [1,1,0,0,0,0|2,0,0]=4 7183 B12R1.385 CSCSc1ccc(c(c1)C)Cl 62a_100011218213_100000049509 [1,1,0,0,0,0|2,0,0]=4 7184 B12R1.385 CSCSc1ccc(c(c1)C)F 62a_100011218213_100011218330 [1,1,0,0,0,0|2,0,0]=4 7185 B12R1.385 CSCSc1ccc(c(c1)C)F 62a_100011218330_100011218213 [1,1,0,0,0,0|2,0,0]=4 7186 B12R1.385 CSCSc1ccc(c(c1)C)N 62a_100000211769_100011218213 [1,1,0,0,0,0|2,0,0]=4 7187 B12R1.385 CSCSc1ccc(c(c1)C)N 62a_100011218213_100000211769 [1,1,0,0,0,0|2,0,0]=4 7188 B12R1.385 CSCSc1ccc(c(c1)C)O 62a_100011218213_100000186361 [1,1,0,0,0,0|1,0,0]=3 7189 B12R1.385 CSCSc1ccc(c(c1)Cl)O 62a_100011218213_100012360047 [1,1,0,0,0,0|2,0,0]=4 7190 B12R1.385 CSCSc1ccc(c(c1)Cl)O 62a_100012360047_100011218213 [1,1,0,0,0,0|2,0,0]=4 7191 B12R1.385 CSCSc1ccc(c(c1)F)O 62a_100000185481_100011218213 [1,1,0,0,0,0|2,0,0]=4 7192 B12R1.385 CSCSc1ccc(c(c1)F)O 62a_100011218213_100000185481 [1,1,0,0,0,0|2,0,0]=4 7193 B12R1.385 CSCSc1ccc(c(c1)N)O 62a_100000752626_100011218213 [1,1,0,0,0,0|2,0,0]=4 7194 B12R1.385 CSCSc1ccc(c(c1)N)O 62a_100011218213_100000752626 [1,1,0,0,0,0|2,0,0]=4 7195 B12R1.385 CSCSc1ccc(c(c1)O)Br 62a_100011218213_100012356990 [1,1,0,0,0,0|2,0,0]=4 7196 B12R1.385 CSCSc1ccc(c(c1)O)Br 62a_100012356990_100011218213 [1,1,0,0,0,0|2,0,0]=4 7197 B12R1.385 CSCSc1ccc(c(c1)O)C 62a_100000685420_100011218213 [1,1,0,0,0,0|2,0,0]=4 7198 B12R1.385 CSCSc1ccc(c(c1)O)C 62a_100011218213_100000685420 [1,1,0,0,0,0|2,0,0]=4 7199 B12R1.385 CSCSc1ccc(c(c1)O)Cl 62a_100011218213_100011356854 [1,1,0,0,0,0|2,0,0]=4 7200 B12R1.385 CSCSc1ccc(c(c1)O)Cl 62a_100011356854_100011218213 [1,1,0,0,0,0|2,0,0]=4 7201 B12R1.385 CSCSc1ccc(c(c1)O)F 62a_100000686035_100011218213 [1,1,0,0,0,0|2,0,0]=4 7202 B12R1.385 CSCSc1ccc(c(c1)O)F 62a_100011218213_100000686035 [1,1,0,0,0,0|2,0,0]=4 7203 B12R1.385 CSCSc1ccc(c(c1)O)N 62a_100000739049_100011218213 [1,1,0,0,0,0|2,0,0]=4 7204 B12R1.385 CSCSc1ccc(c(c1)O)N 62a_100011218213_100000739049 [1,1,0,0,0,0|2,0,0]=4 7205 B12R1.385 CSCSc1ccc(c(c1)O)O 62a_100011218213_100009813601 [1,1,0,0,0,0|1,0,0]=3 7206 B12R1.385 CSCSc1ccc(c(n1)C)O 62a_100010233687_100011218213 [1,1,0,0,0,0|2,0,0]=4 7207 B12R1.385 CSCSc1ccc(c(n1)C)O 62a_100011218213_100010233687 [1,1,0,0,0,0|2,0,0]=4 7208 B12R1.385 CSCSc1cnc(c(c1)C)O 62a_100000685391_100011218213 [1,1,0,0,0,0|2,0,0]=4 7209 B12R1.385 CSCSc1cnc(c(c1)C)O 62a_100011218213_100000685391 [1,1,0,0,0,0|2,0,0]=4 7210 B12R1.385 Cc1cc(ccc1Br)CNCF 34a_100015205234_100015361967 [1,1,0,0,0,0|2,0,0]=4 7211 B12R1.385 Cc1cc(ccc1Br)COCF 34a_100000718852_100015361967 [1,1,0,0,0,0|2,0,0]=4 7212 B12R1.385 Cc1cc(ccc1Br)COCF 7a_100000718852_100015361967 [1,1,0,0,0,0|2,0,0]=4 7213 B12R1.385 Cc1cc(ccc1Br)CSCF 62a_100000727479_100015361967 [1,1,0,0,0,0|2,0,0]=4 7214 B12R1.385 Cc1cc(ccc1Br)CSCF 62a_100015361967_100000727479 [1,1,0,0,0,0|2,0,0]=4 7215 B12R1.385 Cc1cc(ccc1Br)NCCF 2230a_100000210723_100011217306 [1,1,0,0,0,0|2,0,0]=4 7216 B12R1.385 Cc1cc(ccc1Br)NCCF 34a_100000210723_100011217306 [1,1,0,0,0,0|2,0,0]=4 7217 B12R1.385 Cc1cc(ccc1Br)NCCF 7a_100000210723_100011217306 [1,1,0,0,0,0|2,0,0]=4 7218 B12R1.385 Cc1cc(ccc1Br)NCCO 2230a_100000210723_100000211926 [1,1,0,0,0,0|2,0,0]=4 7219 B12R1.385 Cc1cc(ccc1Br)NCCO 34a_100000210723_100000211926 [1,1,0,0,0,0|2,0,0]=4 7220 B12R1.385 Cc1cc(ccc1Br)NCCO 7a_100000210723_100000211926 [1,1,0,0,0,0|2,0,0]=4 7221 B12R1.385 Cc1cc(ccc1Br)OCCF 34a_100000690111_100011217306 [1,1,0,0,0,0|2,0,0]=4 7222 B12R1.385 Cc1cc(ccc1Br)OCCF 7a_100000690111_100011217306 [1,1,0,0,0,0|2,0,0]=4 7223 B12R1.385 Cc1cc(ccc1Br)OCCO 34a_100000690111_100000211926 [1,1,0,0,0,0|2,0,0]=4 7224 B12R1.385 Cc1cc(ccc1Br)OCCO 7a_100000690111_100000211926 [1,1,0,0,0,0|2,0,0]=4 7225 B12R1.385 Cc1cc(ccc1Br)SCCF 62a_100009813585_100011217306 [1,1,0,0,0,0|2,0,0]=4 7226 B12R1.385 Cc1cc(ccc1Br)SCCF 62a_100011217306_100009813585 [1,1,0,0,0,0|2,0,0]=4 7227 B12R1.385 Cc1cc(ccc1Br)SCCO 62a_100000211926_100009813585 [1,1,0,0,0,0|2,0,0]=4 7228 B12R1.385 Cc1cc(ccc1Br)SCCO 62a_100009813585_100000211926 [1,1,0,0,0,0|2,0,0]=4 7229 B12R1.385 Cc1cc(ccc1Cl)CSCF 62a_100012184735_100015361967 [1,1,0,0,0,0|2,0,0]=4 7230 B12R1.385 Cc1cc(ccc1Cl)CSCF 62a_100015361967_100012184735 [1,1,0,0,0,0|2,0,0]=4 7231 B12R1.385 Cc1cc(ccc1Cl)NCCF 2230a_100000187808_100011217306 [1,1,0,0,0,0|2,0,0]=4 7232 B12R1.385 Cc1cc(ccc1Cl)NCCF 34a_100000187808_100011217306 [1,1,0,0,0,0|2,0,0]=4 7233 B12R1.385 Cc1cc(ccc1Cl)NCCF 7a_100000187808_100011217306 [1,1,0,0,0,0|2,0,0]=4 7234 B12R1.385 Cc1cc(ccc1Cl)NCCO 2230a_100000187808_100000211926 [1,1,0,0,0,0|2,0,0]=4 7235 B12R1.385 Cc1cc(ccc1Cl)NCCO 34a_100000187808_100000211926 [1,1,0,0,0,0|2,0,0]=4 7236 B12R1.385 Cc1cc(ccc1Cl)NCCO 7a_100000187808_100000211926 [1,1,0,0,0,0|2,0,0]=4 7237 B12R1.385 Cc1cc(ccc1Cl)OCCF 34a_100000211092_100011217306 [1,1,0,0,0,0|2,0,0]=4 7238 B12R1.385 Cc1cc(ccc1Cl)OCCF 7a_100000211092_100011217306 [1,1,0,0,0,0|2,0,0]=4 7239 B12R1.385 Cc1cc(ccc1Cl)OCCO 34a_100000211092_100000211926 [1,1,0,0,0,0|2,0,0]=4 7240 B12R1.385 Cc1cc(ccc1Cl)OCCO 7a_100000211092_100000211926 [1,1,0,0,0,0|2,0,0]=4 7241 B12R1.385 Cc1cc(ccc1Cl)SCCF 62a_100000049509_100011217306 [1,1,0,0,0,0|2,0,0]=4 7242 B12R1.385 Cc1cc(ccc1Cl)SCCF 62a_100011217306_100000049509 [1,1,0,0,0,0|2,0,0]=4 7243 B12R1.385 Cc1cc(ccc1Cl)SCCO 62a_100000049509_100000211926 [1,1,0,0,0,0|2,0,0]=4 7244 B12R1.385 Cc1cc(ccc1Cl)SCCO 62a_100000211926_100000049509 [1,1,0,0,0,0|2,0,0]=4 7245 B12R1.385 Cc1cc(ccc1F)CNCF 34a_100000239911_100015361967 [1,1,0,0,0,0|2,0,0]=4 7246 B12R1.385 Cc1cc(ccc1F)COCF 34a_100011219793_100015361967 [1,1,0,0,0,0|2,0,0]=4 7247 B12R1.385 Cc1cc(ccc1F)COCF 7a_100011219793_100015361967 [1,1,0,0,0,0|2,0,0]=4 7248 B12R1.385 Cc1cc(ccc1F)CSCF 62a_100011216667_100015361967 [1,1,0,0,0,0|2,0,0]=4 7249 B12R1.385 Cc1cc(ccc1F)CSCF 62a_100015361967_100011216667 [1,1,0,0,0,0|2,0,0]=4 7250 B12R1.385 Cc1cc(ccc1F)NCCF 2230a_100000750164_100011217306 [1,1,0,0,0,0|2,0,0]=4 7251 B12R1.385 Cc1cc(ccc1F)NCCF 34a_100000750164_100011217306 [1,1,0,0,0,0|2,0,0]=4 7252 B12R1.385 Cc1cc(ccc1F)NCCF 7a_100000750164_100011217306 [1,1,0,0,0,0|2,0,0]=4 7253 B12R1.385 Cc1cc(ccc1F)NCCO 2230a_100000750164_100000211926 [1,1,0,0,0,0|2,0,0]=4 7254 B12R1.385 Cc1cc(ccc1F)NCCO 34a_100000750164_100000211926 [1,1,0,0,0,0|2,0,0]=4 7255 B12R1.385 Cc1cc(ccc1F)NCCO 7a_100000750164_100000211926 [1,1,0,0,0,0|2,0,0]=4 7256 B12R1.385 Cc1cc(ccc1F)OCCF 34a_100000751312_100011217306 [1,1,0,0,0,0|2,0,0]=4 7257 B12R1.385 Cc1cc(ccc1F)OCCF 7a_100000751312_100011217306 [1,1,0,0,0,0|2,0,0]=4 7258 B12R1.385 Cc1cc(ccc1F)OCCO 34a_100000751312_100000211926 [1,1,0,0,0,0|2,0,0]=4 7259 B12R1.385 Cc1cc(ccc1F)OCCO 7a_100000751312_100000211926 [1,1,0,0,0,0|2,0,0]=4 7260 B12R1.385 Cc1cc(ccc1F)SCCF 62a_100011217306_100011218330 [1,1,0,0,0,0|2,0,0]=4 7261 B12R1.385 Cc1cc(ccc1F)SCCF 62a_100011218330_100011217306 [1,1,0,0,0,0|2,0,0]=4 7262 B12R1.385 Cc1cc(ccc1F)SCCO 62a_100000211926_100011218330 [1,1,0,0,0,0|2,0,0]=4 7263 B12R1.385 Cc1cc(ccc1F)SCCO 62a_100011218330_100000211926 [1,1,0,0,0,0|2,0,0]=4 7264 B12R1.385 Cc1cc(ccc1I)NCCF 34a_100000198070_100011217306 [1,1,0,0,0,0|2,0,0]=4 7265 B12R1.385 Cc1cc(ccc1I)NCCF 7a_100000198070_100011217306 [1,1,0,0,0,0|2,0,0]=4 7266 B12R1.385 Cc1cc(ccc1I)NCCO 34a_100000198070_100000211926 [1,1,0,0,0,0|2,0,0]=4 7267 B12R1.385 Cc1cc(ccc1I)NCCO 7a_100000198070_100000211926 [1,1,0,0,0,0|2,0,0]=4 7268 B12R1.385 Cc1cc(ccc1I)OCCF 34a_100000729255_100011217306 [1,1,0,0,0,0|2,0,0]=4 7269 B12R1.385 Cc1cc(ccc1I)OCCF 7a_100000729255_100011217306 [1,1,0,0,0,0|2,0,0]=4 7270 B12R1.385 Cc1cc(ccc1I)OCCO 34a_100000729255_100000211926 [1,1,0,0,0,0|2,0,0]=4 7271 B12R1.385 Cc1cc(ccc1I)OCCO 7a_100000729255_100000211926 [1,1,0,0,0,0|2,0,0]=4 7272 B12R1.385 Cc1cc(ccc1N)COCF 34a_200011997030_100015361967 [1,1,0,0,0,0|2,0,0]=4 7273 B12R1.385 Cc1cc(ccc1N)OCCF 34a_100000756630_100011217306 [1,1,0,0,0,0|2,0,0]=4 7274 B12R1.385 Cc1cc(ccc1N)OCCF 7a_100000756630_100011217306 [1,1,0,0,0,0|2,0,0]=4 7275 B12R1.385 Cc1cc(ccc1N)OCCO 34a_100000756630_100000211926 [1,1,0,0,0,0|2,0,0]=4 7276 B12R1.385 Cc1cc(ccc1N)OCCO 7a_100000756630_100000211926 [1,1,0,0,0,0|2,0,0]=4 7277 B12R1.385 Cc1cc(ccc1N)SCCF 62a_100000211769_100011217306 [1,1,0,0,0,0|2,0,0]=4 7278 B12R1.385 Cc1cc(ccc1N)SCCF 62a_100011217306_100000211769 [1,1,0,0,0,0|2,0,0]=4 7279 B12R1.385 Cc1cc(ccc1N)SCCO 62a_100000211769_100000211926 [1,1,0,0,0,0|2,0,0]=4 7280 B12R1.385 Cc1cc(ccc1N)SCCO 62a_100000211926_100000211769 [1,1,0,0,0,0|2,0,0]=4 7281 B12R1.385 Cc1cc(ccc1O)NCC#N 7a_100011218179_100011215382 [1,1,0,0,0,0|1,0,1]=4 7282 B12R1.385 Cc1cc(ccc1O)NCC=O 34a_100011218179_200009817547 [1,1,0,0,0,0|1,0,1]=4 7283 B12R1.385 Cc1cc(ccc1O)NCC=O 7a_100011218179_200015260668 [1,1,0,0,0,0|1,0,1]=4 7284 B12R1.385 Cc1cc(ccc1O)NCCF 34a_100011218179_100011217306 [1,1,0,0,0,0|1,0,0]=3 7285 B12R1.385 Cc1cc(ccc1O)NCCF 7a_100011218179_100011217306 [1,1,0,0,0,0|1,0,0]=3 7286 B12R1.385 Cc1cc(ccc1O)NCCO 34a_100011218179_100000211926 [1,1,0,0,0,0|1,0,0]=3 7287 B12R1.385 Cc1cc(ccc1O)NCCO 7a_100011218179_100000211926 [1,1,0,0,0,0|1,0,0]=3 7288 B12R1.385 Cc1cc(ccc1O)SCC#N 62a_100011215382_100000186361 [1,1,0,0,0,0|1,0,1]=4 7289 B12R1.385 Cc1cc(ccc1O)SCC=O 62a_200015260668_100000186361 [1,1,0,0,0,0|1,0,1]=4 7290 B12R1.385 Cc1cc(ccc1O)SCCF 62a_100011217306_100000186361 [1,1,0,0,0,0|1,0,0]=3 7291 B12R1.385 Cc1cc(ccc1O)SCCO 62a_100000211926_100000186361 [1,1,0,0,0,0|1,0,0]=3 7292 B12R1.385 Cc1cc(cnc1O)SCCF 62a_100000685391_100011217306 [1,1,0,0,0,0|2,0,0]=4 7293 B12R1.385 Cc1cc(cnc1O)SCCF 62a_100011217306_100000685391 [1,1,0,0,0,0|2,0,0]=4 7294 B12R1.385 Cc1cc(cnc1O)SCCO 62a_100000211926_100000685391 [1,1,0,0,0,0|2,0,0]=4 7295 B12R1.385 Cc1cc(cnc1O)SCCO 62a_100000685391_100000211926 [1,1,0,0,0,0|2,0,0]=4 7296 B12R1.385 Cc1cc(ncc1O)NCCO 271570a_203496583355_100012352624 [1,1,0,0,0,0|2,0,0]=4 7297 B12R1.385 Cc1cc(ncc1O)SCCF 62a_100011217306_100000692680 [1,1,0,0,0,0|2,0,0]=4 7298 B12R1.385 Cc1cc(ncc1O)SCCO 62a_100000211926_100000692680 [1,1,0,0,0,0|2,0,0]=4 7299 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 2230a_100020591374_200025704644 [1,1,0,0,0,0|1,0,0]=3 7300 B12R1.385 Cc1ccc(cc1C)CCN[13CH3] 34a_100020591374_200025704644 [1,1,0,0,0,0|1,0,0]=3 7301 B12R1.385 Cc1ccc(cc1C)CNCF 34a_100025706692_100015361967 [1,1,0,0,0,0|2,0,0]=4 7302 B12R1.385 Cc1ccc(cc1C)COCF 34a_100011215342_100015361967 [1,1,0,0,0,0|2,0,0]=4 7303 B12R1.385 Cc1ccc(cc1C)COCF 7a_100011215342_100015361967 [1,1,0,0,0,0|2,0,0]=4 7304 B12R1.385 Cc1ccc(cc1C)CSCF 62a_100000742320_100015361967 [1,1,0,0,0,0|2,0,0]=4 7305 B12R1.385 Cc1ccc(cc1C)CSCF 62a_100015361967_100000742320 [1,1,0,0,0,0|2,0,0]=4 7306 B12R1.385 Cc1ccc(cc1C)NCCF 2230a_100000724040_100011217306 [1,1,0,0,0,0|2,0,0]=4 7307 B12R1.385 Cc1ccc(cc1C)NCCF 34a_100000724040_100011217306 [1,1,0,0,0,0|2,0,0]=4 7308 B12R1.385 Cc1ccc(cc1C)NCCF 7a_100000724040_100011217306 [1,1,0,0,0,0|2,0,0]=4 7309 B12R1.385 Cc1ccc(cc1C)NCCO 2230a_100000724040_100000211926 [1,1,0,0,0,0|2,0,0]=4 7310 B12R1.385 Cc1ccc(cc1C)NCCO 34a_100000724040_100000211926 [1,1,0,0,0,0|2,0,0]=4 7311 B12R1.385 Cc1ccc(cc1C)NCCO 7a_100000724040_100000211926 [1,1,0,0,0,0|2,0,0]=4 7312 B12R1.385 Cc1ccc(cc1C)OCCF 34a_100000210932_100011217306 [1,1,0,0,0,0|2,0,0]=4 7313 B12R1.385 Cc1ccc(cc1C)OCCF 7a_100000210932_100011217306 [1,1,0,0,0,0|2,0,0]=4 7314 B12R1.385 Cc1ccc(cc1C)OCCO 34a_100000210932_100000211926 [1,1,0,0,0,0|2,0,0]=4 7315 B12R1.385 Cc1ccc(cc1C)OCCO 7a_100000210932_100000211926 [1,1,0,0,0,0|2,0,0]=4 7316 B12R1.385 Cc1ccc(cc1C)SCCF 62a_100011215607_100011217306 [1,1,0,0,0,0|2,0,0]=4 7317 B12R1.385 Cc1ccc(cc1C)SCCF 62a_100011217306_100011215607 [1,1,0,0,0,0|2,0,0]=4 7318 B12R1.385 Cc1ccc(cc1C)SCCO 62a_100000211926_100011215607 [1,1,0,0,0,0|2,0,0]=4 7319 B12R1.385 Cc1ccc(cc1C)SCCO 62a_100011215607_100000211926 [1,1,0,0,0,0|2,0,0]=4 7320 B12R1.385 Cc1ccc(cc1O)NCCF 34a_100000759471_100011217306 [1,1,0,0,0,0|2,0,0]=4 7321 B12R1.385 Cc1ccc(cc1O)NCCF 7a_100000759471_100011217306 [1,1,0,0,0,0|2,0,0]=4 7322 B12R1.385 Cc1ccc(cc1O)NCCO 34a_100000759471_100000211926 [1,1,0,0,0,0|2,0,0]=4 7323 B12R1.385 Cc1ccc(cc1O)NCCO 7a_100000759471_100000211926 [1,1,0,0,0,0|2,0,0]=4 7324 B12R1.385 Cc1ccc(cc1O)SCCF 62a_100000685420_100011217306 [1,1,0,0,0,0|2,0,0]=4 7325 B12R1.385 Cc1ccc(cc1O)SCCF 62a_100011217306_100000685420 [1,1,0,0,0,0|2,0,0]=4 7326 B12R1.385 Cc1ccc(cc1O)SCCO 271570a_203496583355_100010989109 [1,1,0,0,0,0|2,0,0]=4 7327 B12R1.385 Cc1ccc(cc1O)SCCO 62a_100000211926_100000685420 [1,1,0,0,0,0|2,0,0]=4 7328 B12R1.385 Cc1ccc(cc1O)SCCO 62a_100000685420_100000211926 [1,1,0,0,0,0|2,0,0]=4 7329 B12R1.385 Cc1nc(ccc1O)SCCF 62a_100010233687_100011217306 [1,1,0,0,0,0|2,0,0]=4 7330 B12R1.385 Cc1nc(ccc1O)SCCF 62a_100011217306_100010233687 [1,1,0,0,0,0|2,0,0]=4 7331 B12R1.385 Cc1nc(ccc1O)SCCO 62a_100000211926_100010233687 [1,1,0,0,0,0|2,0,0]=4 7332 B12R1.385 Cc1nc(ccc1O)SCCO 62a_100010233687_100000211926 [1,1,0,0,0,0|2,0,0]=4 7333 B12R1.385 N#CCSc1ccc(c(c1)O)O 62a_100011215382_100009813601 [1,1,0,0,0,0|1,0,1]=4 7334 B12R1.385 Nc1cc(ccc1O)SCCF 62a_100000752626_100011217306 [1,1,0,0,0,0|2,0,0]=4 7335 B12R1.385 Nc1cc(ccc1O)SCCF 62a_100011217306_100000752626 [1,1,0,0,0,0|2,0,0]=4 7336 B12R1.385 Nc1cc(ccc1O)SCCO 62a_100000211926_100000752626 [1,1,0,0,0,0|2,0,0]=4 7337 B12R1.385 Nc1cc(ccc1O)SCCO 62a_100000752626_100000211926 [1,1,0,0,0,0|2,0,0]=4 7338 B12R1.385 Nc1ccc(cc1O)SCCF 62a_100000739049_100011217306 [1,1,0,0,0,0|2,0,0]=4 7339 B12R1.385 Nc1ccc(cc1O)SCCF 62a_100011217306_100000739049 [1,1,0,0,0,0|2,0,0]=4 7340 B12R1.385 Nc1ccc(cc1O)SCCO 62a_100000211926_100000739049 [1,1,0,0,0,0|2,0,0]=4 7341 B12R1.385 Nc1ccc(cc1O)SCCO 62a_100000739049_100000211926 [1,1,0,0,0,0|2,0,0]=4 7342 B12R1.385 O=CCNc1ccc(c(c1)O)O 34a_100102946323_200009817547 [1,1,0,0,0,0|1,0,1]=4 7343 B12R1.385 O=CCSc1ccc(c(c1)O)O 62a_200015260668_100009813601 [1,1,0,0,0,0|1,0,1]=4 7344 B12R1.385 OCCNc1ccc(c(c1)Br)O 34a_100011534360_100000211926 [1,1,0,0,0,0|2,0,0]=4 7345 B12R1.385 OCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000211926 [1,1,0,0,0,0|2,0,0]=4 7346 B12R1.385 OCCNc1ccc(c(c1)F)O 34a_100011220035_100000211926 [1,1,0,0,0,0|2,0,0]=4 7347 B12R1.385 OCCNc1ccc(c(c1)F)O 7a_100011220035_100000211926 [1,1,0,0,0,0|2,0,0]=4 7348 B12R1.385 OCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000211926 [1,1,0,0,0,0|2,0,0]=4 7349 B12R1.385 OCCNc1ccc(c(c1)O)F 34a_100012017398_100000211926 [1,1,0,0,0,0|2,0,0]=4 7350 B12R1.385 OCCNc1ccc(c(c1)O)F 7a_100012017398_100000211926 [1,1,0,0,0,0|2,0,0]=4 7351 B12R1.385 OCCNc1ccc(c(c1)O)O 34a_100102946323_100000211926 [1,1,0,0,0,0|1,0,0]=3 7352 B12R1.385 OCCSc1ccc(c(c1)Br)O 62a_100000211926_100012361655 [1,1,0,0,0,0|2,0,0]=4 7353 B12R1.385 OCCSc1ccc(c(c1)Br)O 62a_100012361655_100000211926 [1,1,0,0,0,0|2,0,0]=4 7354 B12R1.385 OCCSc1ccc(c(c1)Cl)O 62a_100000211926_100012360047 [1,1,0,0,0,0|2,0,0]=4 7355 B12R1.385 OCCSc1ccc(c(c1)Cl)O 62a_100012360047_100000211926 [1,1,0,0,0,0|2,0,0]=4 7356 B12R1.385 OCCSc1ccc(c(c1)F)O 62a_100000185481_100000211926 [1,1,0,0,0,0|2,0,0]=4 7357 B12R1.385 OCCSc1ccc(c(c1)F)O 62a_100000211926_100000185481 [1,1,0,0,0,0|2,0,0]=4 7358 B12R1.385 OCCSc1ccc(c(c1)O)Br 62a_100000211926_100012356990 [1,1,0,0,0,0|2,0,0]=4 7359 B12R1.385 OCCSc1ccc(c(c1)O)Br 62a_100012356990_100000211926 [1,1,0,0,0,0|2,0,0]=4 7360 B12R1.385 OCCSc1ccc(c(c1)O)Cl 62a_100000211926_100011356854 [1,1,0,0,0,0|2,0,0]=4 7361 B12R1.385 OCCSc1ccc(c(c1)O)Cl 62a_100011356854_100000211926 [1,1,0,0,0,0|2,0,0]=4 7362 B12R1.385 OCCSc1ccc(c(c1)O)F 62a_100000211926_100000686035 [1,1,0,0,0,0|2,0,0]=4 7363 B12R1.385 OCCSc1ccc(c(c1)O)F 62a_100000686035_100000211926 [1,1,0,0,0,0|2,0,0]=4 7364 B12R1.385 OCCSc1ccc(c(c1)O)O 62a_100000211926_100009813601 [1,1,0,0,0,0|1,0,0]=3 7365 B12R1.385 Oc1cc(ccc1Br)SCCF 62a_100011217306_100012356990 [1,1,0,0,0,0|2,0,0]=4 7366 B12R1.385 Oc1cc(ccc1Br)SCCF 62a_100012356990_100011217306 [1,1,0,0,0,0|2,0,0]=4 7367 B12R1.385 Oc1cc(ccc1Cl)CNCF 34a_100020636435_100015361967 [1,1,0,0,0,0|2,0,0]=4 7368 B12R1.385 Oc1cc(ccc1Cl)NCCF 34a_100011934209_100011217306 [1,1,0,0,0,0|2,0,0]=4 7369 B12R1.385 Oc1cc(ccc1Cl)SCCF 62a_100011217306_100011356854 [1,1,0,0,0,0|2,0,0]=4 7370 B12R1.385 Oc1cc(ccc1Cl)SCCF 62a_100011356854_100011217306 [1,1,0,0,0,0|2,0,0]=4 7371 B12R1.385 Oc1cc(ccc1F)CNCF 34a_100160469508_100015361967 [1,1,0,0,0,0|2,0,0]=4 7372 B12R1.385 Oc1cc(ccc1F)NCCF 34a_100012017398_100011217306 [1,1,0,0,0,0|2,0,0]=4 7373 B12R1.385 Oc1cc(ccc1F)NCCF 7a_100012017398_100011217306 [1,1,0,0,0,0|2,0,0]=4 7374 B12R1.385 Oc1cc(ccc1F)SCCF 62a_100000686035_100011217306 [1,1,0,0,0,0|2,0,0]=4 7375 B12R1.385 Oc1cc(ccc1F)SCCF 62a_100011217306_100000686035 [1,1,0,0,0,0|2,0,0]=4 7376 B12R1.385 Oc1ccc(cc1Br)NCCF 34a_100011534360_100011217306 [1,1,0,0,0,0|2,0,0]=4 7377 B12R1.385 Oc1ccc(cc1Br)SCCF 62a_100011217306_100012361655 [1,1,0,0,0,0|2,0,0]=4 7378 B12R1.385 Oc1ccc(cc1Br)SCCF 62a_100012361655_100011217306 [1,1,0,0,0,0|2,0,0]=4 7379 B12R1.385 Oc1ccc(cc1Cl)NCCF 34a_100000744943_100011217306 [1,1,0,0,0,0|2,0,0]=4 7380 B12R1.385 Oc1ccc(cc1Cl)SCCF 62a_100011217306_100012360047 [1,1,0,0,0,0|2,0,0]=4 7381 B12R1.385 Oc1ccc(cc1Cl)SCCF 62a_100012360047_100011217306 [1,1,0,0,0,0|2,0,0]=4 7382 B12R1.385 Oc1ccc(cc1F)CNCF 34a_100000758358_100015361967 [1,1,0,0,0,0|2,0,0]=4 7383 B12R1.385 Oc1ccc(cc1F)NCCF 34a_100011220035_100011217306 [1,1,0,0,0,0|2,0,0]=4 7384 B12R1.385 Oc1ccc(cc1F)NCCF 7a_100011220035_100011217306 [1,1,0,0,0,0|2,0,0]=4 7385 B12R1.385 Oc1ccc(cc1F)SCCF 62a_100000185481_100011217306 [1,1,0,0,0,0|2,0,0]=4 7386 B12R1.385 Oc1ccc(cc1F)SCCF 62a_100011217306_100000185481 [1,1,0,0,0,0|2,0,0]=4 7387 B12R1.385 Oc1ccc(cc1O)CNCF 34a_100000010075_100015361967 [1,1,0,0,0,0|1,0,0]=3 7388 B12R1.385 Oc1ccc(cc1O)NCCF 34a_100102946323_100011217306 [1,1,0,0,0,0|1,0,0]=3 7389 B12R1.385 Oc1ccc(cc1O)SCCF 62a_100011217306_100009813601 [1,1,0,0,0,0|1,0,0]=3 7390 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_200025704644 [1,1,0,0,0,0|2,0,0]=4 7391 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)Cl 34a_100011207230_200025704644 [1,1,0,0,0,0|2,0,0]=4 7392 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)F 2230a_200011997520_200025704644 [1,1,0,0,0,0|2,0,0]=4 7393 B12R1.385 [13CH3]NCCc1ccc(c(c1)Cl)F 34a_200011997520_200025704644 [1,1,0,0,0,0|2,0,0]=4 7394 B12R1.385 [13CH3]NCCc1ccc(c(c1)F)F 2230a_200000706328_200025704644 [1,1,0,0,0,0|2,0,0]=4 7395 B12R1.385 [13CH3]NCCc1ccc(c(c1)F)F 34a_200000706328_200025704644 [1,1,0,0,0,0|2,0,0]=4 7396 B12R1.385 [13CH3]NCCc1ccc(c(c1)O)O 34a_100000210387_200025704644 [1,1,0,0,0,0|0,0,0]=2 7397 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)Cl 34a_100011709245_200025704644 [1,1,0,0,0,0|2,0,0]=4 7398 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)Cl 7a_100011709245_200025704644 [1,1,0,0,0,0|2,0,0]=4 7399 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)F 34a_100011830478_200025704644 [1,1,0,0,0,0|2,0,0]=4 7400 B12R1.385 [13CH3]OCCc1ccc(c(c1)Cl)F 7a_100011830478_200025704644 [1,1,0,0,0,0|2,0,0]=4 7401 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Br 34a_100012921202_200025704644 [1,1,0,0,0,0|2,0,0]=4 7402 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Br 7a_100012921202_200025704644 [1,1,0,0,0,0|2,0,0]=4 7403 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Cl 34a_100011934464_200025704644 [1,1,0,0,0,0|2,0,0]=4 7404 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)Cl 7a_100011934464_200025704644 [1,1,0,0,0,0|2,0,0]=4 7405 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)F 34a_100000690376_200025704644 [1,1,0,0,0,0|2,0,0]=4 7406 B12R1.385 [13CH3]OCCc1ccc(c(c1)F)F 7a_100000690376_200025704644 [1,1,0,0,0,0|2,0,0]=4 7407 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)Cl 62a_100011713676_200025704644 [1,1,0,0,0,0|2,0,0]=4 7408 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)Cl 62a_200025704644_100011713676 [1,1,0,0,0,0|2,0,0]=4 7409 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)F 62a_100012361305_200025704644 [1,1,0,0,0,0|2,0,0]=4 7410 B12R1.385 [13CH3]SCCc1ccc(c(c1)Cl)F 62a_200025704644_100012361305 [1,1,0,0,0,0|2,0,0]=4 7411 B12R1.385 [13CH3]SCCc1ccc(c(c1)F)F 62a_100000690553_200025704644 [1,1,0,0,0,0|2,0,0]=4 7412 B12R1.385 [13CH3]SCCc1ccc(c(c1)F)F 62a_200025704644_100000690553 [1,1,0,0,0,0|2,0,0]=4 7413 B12R1.385 [13CH3]SCCc1ccc(c(c1)O)O 62a_200025704644_200010393615 [1,1,0,0,0,0|0,0,0]=2 7414 B12R1.544 CC=Cc1ccc(c(c1C)C)O 271570a_100016259895_100012353674 [1,1,0,0,0,0|0,0,2]=4 7415 B12R1.544 CC=Cc1ccc(c(c1F)C)O 271570a_100016259895_100010390934 [1,1,0,0,0,0|0,0,2]=4 7416 B12R1.544 CCNc1ccc(c(c1C)C)Br 2230a_100009816967_100000210202 [1,1,0,0,0,0|2,0,0]=4 7417 B12R1.544 CCNc1ccc(c(c1C)C)Br 34a_100009816967_100000210202 [1,1,0,0,0,0|2,0,0]=4 7418 B12R1.544 CCNc1ccc(c(c1C)C)Br 7a_100009816967_100000210202 [1,1,0,0,0,0|2,0,0]=4 7419 B12R1.544 CCNc1ccc(c(c1C)C)C 2230a_100000116900_100000210202 [1,1,0,0,0,0|2,0,0]=4 7420 B12R1.544 CCNc1ccc(c(c1C)C)C 34a_100000116900_100000210202 [1,1,0,0,0,0|2,0,0]=4 7421 B12R1.544 CCNc1ccc(c(c1C)C)C 7a_100000116900_100000210202 [1,1,0,0,0,0|2,0,0]=4 7422 B12R1.544 CCNc1ccc(c(c1C)C)F 2230a_100000062172_100000210202 [1,1,0,0,0,0|2,0,0]=4 7423 B12R1.544 CCNc1ccc(c(c1C)C)F 34a_100000062172_100000210202 [1,1,0,0,0,0|2,0,0]=4 7424 B12R1.544 CCNc1ccc(c(c1C)C)F 7a_100000062172_100000210202 [1,1,0,0,0,0|2,0,0]=4 7425 B12R1.544 CCNc1ccc(c(c1C)C)O 34a_200011216674_100000210202 [1,1,0,0,0,0|1,0,0]=3 7426 B12R1.544 CCNc1ccc(c(c1C)C)O 7a_200011216674_100000210202 [1,1,0,0,0,0|1,0,0]=3 7427 B12R1.544 CCNc1ccc(c(c1Cl)C)Cl 34a_100011935240_100000210202 [1,1,0,0,0,0|2,0,0]=4 7428 B12R1.544 CCNc1ccc(c(c1Cl)C)Cl 7a_100011935240_100000210202 [1,1,0,0,0,0|2,0,0]=4 7429 B12R1.544 CCNc1ccc(c(c1Cl)C)F 2230a_100009863382_100000210202 [1,1,0,0,0,0|2,0,0]=4 7430 B12R1.544 CCNc1ccc(c(c1Cl)C)F 34a_100009863382_100000210202 [1,1,0,0,0,0|2,0,0]=4 7431 B12R1.544 CCNc1ccc(c(c1Cl)C)F 7a_100009863382_100000210202 [1,1,0,0,0,0|2,0,0]=4 7432 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100000210202 [1,1,0,0,0,0|2,0,0]=4 7433 B12R1.544 CCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100000210202 [1,1,0,0,0,0|2,0,0]=4 7434 B12R1.544 CCNc1ccc(c(c1Cl)O)C 34a_100000036876_100000210202 [1,1,0,0,0,0|2,0,0]=4 7435 B12R1.544 CCNc1ccc(c(c1Cl)O)C 7a_100000036876_100000210202 [1,1,0,0,0,0|2,0,0]=4 7436 B12R1.544 CCNc1ccc(c(c1F)C)Br 2230a_100000722916_100000210202 [1,1,0,0,0,0|2,0,0]=4 7437 B12R1.544 CCNc1ccc(c(c1F)C)Br 34a_100000722916_100000210202 [1,1,0,0,0,0|2,0,0]=4 7438 B12R1.544 CCNc1ccc(c(c1F)C)Br 7a_100000722916_100000210202 [1,1,0,0,0,0|2,0,0]=4 7439 B12R1.544 CCNc1ccc(c(c1F)C)F 2230a_102495366501_100000210202 [1,1,0,0,0,0|2,0,0]=4 7440 B12R1.544 CCNc1ccc(c(c1F)C)F 34a_102495366501_100000210202 [1,1,0,0,0,0|2,0,0]=4 7441 B12R1.544 CCNc1ccc(c(c1F)C)F 7a_102495366501_100000210202 [1,1,0,0,0,0|2,0,0]=4 7442 B12R1.544 CCNc1ccc(c(c1F)C)O 34a_200000126710_100000210202 [1,1,0,0,0,0|1,0,0]=3 7443 B12R1.544 CCNc1ccc(c(c1F)C)O 7a_200000126710_100000210202 [1,1,0,0,0,0|1,0,0]=3 7444 B12R1.544 CCNc1ccc(c(c1F)Cl)O 34a_200000098347_100000210202 [1,1,0,0,0,0|2,0,0]=4 7445 B12R1.544 CCNc1ccc(c(c1F)Cl)O 7a_200000098347_100000210202 [1,1,0,0,0,0|2,0,0]=4 7446 B12R1.544 CCNc1ccc(c(c1F)F)O 34a_100015204651_100000210202 [1,1,0,0,0,0|2,0,0]=4 7447 B12R1.544 CCNc1ccc(c(c1F)F)O 7a_100015204651_100000210202 [1,1,0,0,0,0|2,0,0]=4 7448 B12R1.544 CCOc1ccc(c(c1C)C)Br 34a_100012353674_100000210202 [1,1,0,0,0,0|2,0,0]=4 7449 B12R1.544 CCOc1ccc(c(c1C)C)Br 7a_100012353674_100000210202 [1,1,0,0,0,0|2,0,0]=4 7450 B12R1.544 CCOc1ccc(c(c1C)C)F 34a_100009847123_100000210202 [1,1,0,0,0,0|2,0,0]=4 7451 B12R1.544 CCOc1ccc(c(c1C)C)F 7a_100009847123_100000210202 [1,1,0,0,0,0|2,0,0]=4 7452 B12R1.544 CCOc1ccc(c(c1C)C)I 34a_100011356951_100000210202 [1,1,0,0,0,0|2,0,0]=4 7453 B12R1.544 CCOc1ccc(c(c1C)C)I 7a_100011356951_100000210202 [1,1,0,0,0,0|2,0,0]=4 7454 B12R1.544 CCOc1ccc(c(c1C)C)N 34a_200011216674_100000210202 [1,1,0,0,0,0|2,0,0]=4 7455 B12R1.544 CCOc1ccc(c(c1C)C)N 7a_200011216674_100000210202 [1,1,0,0,0,0|2,0,0]=4 7456 B12R1.544 CCOc1ccc(c(c1Cl)C)Br 34a_100021574527_100000210202 [1,1,0,0,0,0|2,0,0]=4 7457 B12R1.544 CCOc1ccc(c(c1Cl)C)Br 7a_100021574527_100000210202 [1,1,0,0,0,0|2,0,0]=4 7458 B12R1.544 CCOc1ccc(c(c1F)F)O 271570a_203496583355_100010177744 [1,1,0,0,0,0|2,0,0]=4 7459 B12R1.544 CCOc1ccc(c(c1N)C)Br 34a_100013039247_100000210202 [1,1,0,0,0,0|2,0,0]=4 7460 B12R1.544 CCOc1ccc(c(c1N)C)Br 7a_100013039247_100000210202 [1,1,0,0,0,0|2,0,0]=4 7461 B12R1.544 CCSc1ccc(c(c1C)C)Br 62a_100000210202_200010185626 [1,1,0,0,0,0|2,0,0]=4 7462 B12R1.544 CCSc1ccc(c(c1C)C)Br 62a_200010185626_100000210202 [1,1,0,0,0,0|2,0,0]=4 7463 B12R1.544 CCSc1ccc(c(c1C)C)F 62a_100000210202_100009816033 [1,1,0,0,0,0|2,0,0]=4 7464 B12R1.544 CCSc1ccc(c(c1C)C)F 62a_100009816033_100000210202 [1,1,0,0,0,0|2,0,0]=4 7465 B12R1.544 CCSc1ccc(c(c1C)C)N 62a_100000210202_100009816967 [1,1,0,0,0,0|2,0,0]=4 7466 B12R1.544 CCSc1ccc(c(c1C)C)N 62a_100009816967_100000210202 [1,1,0,0,0,0|2,0,0]=4 7467 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100000210202_100012353674 [1,1,0,0,0,0|1,0,0]=3 7468 B12R1.544 CCSc1ccc(c(c1C)C)O 62a_100012353674_100000210202 [1,1,0,0,0,0|1,0,0]=3 7469 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100000210202_100013039247 [1,1,0,0,0,0|2,0,0]=4 7470 B12R1.544 CCSc1ccc(c(c1C)N)O 62a_100013039247_100000210202 [1,1,0,0,0,0|2,0,0]=4 7471 B12R1.544 CCSc1ccc(c(c1Cl)C)Br 62a_100000210202_100055076181 [1,1,0,0,0,0|2,0,0]=4 7472 B12R1.544 CCSc1ccc(c(c1Cl)C)Br 62a_100055076181_100000210202 [1,1,0,0,0,0|2,0,0]=4 7473 B12R1.544 CCSc1ccc(c(c1Cl)C)Cl 62a_100000210202_100010730154 [1,1,0,0,0,0|2,0,0]=4 7474 B12R1.544 CCSc1ccc(c(c1Cl)C)Cl 62a_100010730154_100000210202 [1,1,0,0,0,0|2,0,0]=4 7475 B12R1.544 CCSc1ccc(c(c1F)C)C 62a_100000210202_200015555822 [1,1,0,0,0,0|2,0,0]=4 7476 B12R1.544 CCSc1ccc(c(c1F)C)C 62a_200015555822_100000210202 [1,1,0,0,0,0|2,0,0]=4 7477 B12R1.544 CCSc1ccc(c(c1F)C)F 62a_100000210202_100009815987 [1,1,0,0,0,0|2,0,0]=4 7478 B12R1.544 CCSc1ccc(c(c1F)C)F 62a_100009815987_100000210202 [1,1,0,0,0,0|2,0,0]=4 7479 B12R1.544 CCSc1ccc(c(c1F)C)N 62a_100000210202_100010208198 [1,1,0,0,0,0|2,0,0]=4 7480 B12R1.544 CCSc1ccc(c(c1F)C)N 62a_100010208198_100000210202 [1,1,0,0,0,0|2,0,0]=4 7481 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100000210202_100010390934 [1,1,0,0,0,0|1,0,0]=3 7482 B12R1.544 CCSc1ccc(c(c1F)C)O 62a_100010390934_100000210202 [1,1,0,0,0,0|1,0,0]=3 7483 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100000210202_100011830415 [1,1,0,0,0,0|2,0,0]=4 7484 B12R1.544 CCSc1ccc(c(c1F)F)O 62a_100011830415_100000210202 [1,1,0,0,0,0|2,0,0]=4 7485 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_100000210202_200010782288 [1,1,0,0,0,0|2,0,0]=4 7486 B12R1.544 CCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210202 [1,1,0,0,0,0|2,0,0]=4 7487 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100000210202_100010167067 [1,1,0,0,0,0|2,0,0]=4 7488 B12R1.544 CCSc1ccc(c(c1F)O)F 62a_100010167067_100000210202 [1,1,0,0,0,0|2,0,0]=4 7489 B12R1.544 CCSc1ccc(c(c1N)C)F 62a_100000210202_100011009917 [1,1,0,0,0,0|2,0,0]=4 7490 B12R1.544 CCSc1ccc(c(c1N)C)F 62a_100011009917_100000210202 [1,1,0,0,0,0|2,0,0]=4 7491 B12R1.544 CCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210202 [1,1,0,0,0,0|2,0,0]=4 7492 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_100000210202_200010391124 [1,1,0,0,0,0|2,0,0]=4 7493 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_200010391124_100000210202 [1,1,0,0,0,0|2,0,0]=4 7494 B12R1.544 CCSc1cnc(c(c1C)C)O 62a_100000210202_200011099879 [1,1,0,0,0,0|2,0,0]=4 7495 B12R1.544 CCSc1cnc(c(c1C)C)O 62a_200011099879_100000210202 [1,1,0,0,0,0|2,0,0]=4 7496 B12R1.544 CNCc1ccc(c(c1Cl)C)Br 26a_100102657272_100021574527 [1,1,0,0,0,0|2,0,0]=4 7497 B12R1.544 CNCc1ccc(c(c1Cl)C)F 207a_100102657272_100009872231 [1,1,0,0,0,0|2,0,0]=4 7498 B12R1.544 CNCc1ccc(c(c1Cl)C)F 270004a_106832991635_100009872231 [1,1,0,0,0,0|2,0,0]=4 7499 B12R1.544 CNCc1ccc(c(c1F)C)Br 207a_100102657272_100015546853 [1,1,0,0,0,0|2,0,0]=4 7500 B12R1.544 CNCc1ccc(c(c1F)C)Br 270004a_106832991635_100015546853 [1,1,0,0,0,0|2,0,0]=4 7501 B12R1.544 CNCc1ccc(c(c1F)C)F 207a_100102657272_100000068945 [1,1,0,0,0,0|2,0,0]=4 7502 B12R1.544 CNCc1ccc(c(c1F)C)F 2230a_200000062210_200000210301 [1,1,0,0,0,0|2,0,0]=4 7503 B12R1.544 CNCc1ccc(c(c1F)C)F 270004a_106832991635_100000068945 [1,1,0,0,0,0|2,0,0]=4 7504 B12R1.544 CNCc1ccc(c(c1F)C)F 34a_200000062210_200000210301 [1,1,0,0,0,0|2,0,0]=4 7505 B12R1.544 Cc1c(ccc(c1C)NCF)O 34a_200011216674_100015361967 [1,1,0,0,0,0|2,0,0]=4 7506 B12R1.544 Cc1c(ccc(c1C)NCF)O 7a_200011216674_100015361967 [1,1,0,0,0,0|2,0,0]=4 7507 B12R1.544 Cc1c(ccc(c1C)SCF)O 62a_100012353674_100015361967 [1,1,0,0,0,0|2,0,0]=4 7508 B12R1.544 Cc1c(ccc(c1C)SCF)O 62a_100015361967_100012353674 [1,1,0,0,0,0|2,0,0]=4 7509 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 2230a_200000062210_200025704644 [1,1,0,0,0,0|2,0,0]=4 7510 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 34a_200000062210_200025704644 [1,1,0,0,0,0|2,0,0]=4 7511 B12R1.544 Cc1c(ccc(c1F)NCF)O 34a_200000126710_100015361967 [1,1,0,0,0,0|2,0,0]=4 7512 B12R1.544 Cc1c(ccc(c1F)NCF)O 7a_200000126710_100015361967 [1,1,0,0,0,0|2,0,0]=4 7513 B12R1.544 Cc1c(ccc(c1F)SCF)O 62a_100010390934_100015361967 [1,1,0,0,0,0|2,0,0]=4 7514 B12R1.544 Cc1c(ccc(c1F)SCF)O 62a_100015361967_100010390934 [1,1,0,0,0,0|2,0,0]=4 7515 B12R1.1123 CC=Cc1cc(c(cc1C)O)C 271570a_100016259895_100000698207 [1,1,0,0,0,0|0,0,2]=4 7516 B12R1.1123 CCNc1cc(c(cc1Br)Br)C 34a_100009995518_100000210202 [1,1,0,0,0,0|2,0,0]=4 7517 B12R1.1123 CCNc1cc(c(cc1Br)Br)C 7a_100009995518_100000210202 [1,1,0,0,0,0|2,0,0]=4 7518 B12R1.1123 CCNc1cc(c(cc1Br)C)C 34a_100012337760_100000210202 [1,1,0,0,0,0|2,0,0]=4 7519 B12R1.1123 CCNc1cc(c(cc1Br)C)C 7a_100012337760_100000210202 [1,1,0,0,0,0|2,0,0]=4 7520 B12R1.1123 CCNc1cc(c(cc1Br)F)C 34a_100010233353_100000210202 [1,1,0,0,0,0|2,0,0]=4 7521 B12R1.1123 CCNc1cc(c(cc1Br)F)C 7a_100010233353_100000210202 [1,1,0,0,0,0|2,0,0]=4 7522 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 34a_100011080774_100000210202 [1,1,0,0,0,0|2,0,0]=4 7523 B12R1.1123 CCNc1cc(c(cc1Br)O)Br 7a_100011080774_100000210202 [1,1,0,0,0,0|2,0,0]=4 7524 B12R1.1123 CCNc1cc(c(cc1C)Br)C 2230a_100011934712_100000210202 [1,1,0,0,0,0|2,0,0]=4 7525 B12R1.1123 CCNc1cc(c(cc1C)Br)C 34a_100011934712_100000210202 [1,1,0,0,0,0|2,0,0]=4 7526 B12R1.1123 CCNc1cc(c(cc1C)Br)C 7a_100011934712_100000210202 [1,1,0,0,0,0|2,0,0]=4 7527 B12R1.1123 CCNc1cc(c(cc1C)C)C 2230a_100011217141_100000210202 [1,1,0,0,0,0|2,0,0]=4 7528 B12R1.1123 CCNc1cc(c(cc1C)C)C 34a_100011217141_100000210202 [1,1,0,0,0,0|2,0,0]=4 7529 B12R1.1123 CCNc1cc(c(cc1C)C)C 7a_100011217141_100000210202 [1,1,0,0,0,0|2,0,0]=4 7530 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 2230a_100011830454_100000210202 [1,1,0,0,0,0|2,0,0]=4 7531 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 34a_100011830454_100000210202 [1,1,0,0,0,0|2,0,0]=4 7532 B12R1.1123 CCNc1cc(c(cc1C)Cl)C 7a_100011830454_100000210202 [1,1,0,0,0,0|2,0,0]=4 7533 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 34a_100009961766_100000210202 [1,1,0,0,0,0|2,0,0]=4 7534 B12R1.1123 CCNc1cc(c(cc1C)Cl)O 7a_100009961766_100000210202 [1,1,0,0,0,0|2,0,0]=4 7535 B12R1.1123 CCNc1cc(c(cc1C)O)C 34a_100000720036_100000210202 [1,1,0,0,0,0|1,0,0]=3 7536 B12R1.1123 CCNc1cc(c(cc1C)O)C 7a_100000720036_100000210202 [1,1,0,0,0,0|1,0,0]=3 7537 B12R1.1123 CCNc1cc(c(cc1Cl)C)C 34a_100012183282_100000210202 [1,1,0,0,0,0|2,0,0]=4 7538 B12R1.1123 CCNc1cc(c(cc1Cl)C)C 7a_100012183282_100000210202 [1,1,0,0,0,0|2,0,0]=4 7539 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 34a_100000092876_100000210202 [1,1,0,0,0,0|2,0,0]=4 7540 B12R1.1123 CCNc1cc(c(cc1Cl)C)O 7a_100000092876_100000210202 [1,1,0,0,0,0|2,0,0]=4 7541 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)C 34a_100012000392_100000210202 [1,1,0,0,0,0|2,0,0]=4 7542 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)C 7a_100012000392_100000210202 [1,1,0,0,0,0|2,0,0]=4 7543 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 34a_100000037174_100000210202 [1,1,0,0,0,0|2,0,0]=4 7544 B12R1.1123 CCNc1cc(c(cc1Cl)Cl)O 7a_100000037174_100000210202 [1,1,0,0,0,0|2,0,0]=4 7545 B12R1.1123 CCNc1cc(c(cc1Cl)F)C 34a_100000729549_100000210202 [1,1,0,0,0,0|2,0,0]=4 7546 B12R1.1123 CCNc1cc(c(cc1Cl)F)C 7a_100000729549_100000210202 [1,1,0,0,0,0|2,0,0]=4 7547 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 34a_100012000071_100000210202 [1,1,0,0,0,0|2,0,0]=4 7548 B12R1.1123 CCNc1cc(c(cc1Cl)O)Cl 7a_100012000071_100000210202 [1,1,0,0,0,0|2,0,0]=4 7549 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 34a_100009886023_100000210202 [1,1,0,0,0,0|2,0,0]=4 7550 B12R1.1123 CCNc1cc(c(cc1Cl)O)F 7a_100009886023_100000210202 [1,1,0,0,0,0|2,0,0]=4 7551 B12R1.1123 CCNc1cc(c(cc1F)Br)C 2230a_100000691575_100000210202 [1,1,0,0,0,0|2,0,0]=4 7552 B12R1.1123 CCNc1cc(c(cc1F)Br)C 34a_100000691575_100000210202 [1,1,0,0,0,0|2,0,0]=4 7553 B12R1.1123 CCNc1cc(c(cc1F)Br)C 7a_100000691575_100000210202 [1,1,0,0,0,0|2,0,0]=4 7554 B12R1.1123 CCNc1cc(c(cc1F)C)O 34a_100000117193_100000210202 [1,1,0,0,0,0|2,0,0]=4 7555 B12R1.1123 CCNc1cc(c(cc1F)C)O 7a_100000117193_100000210202 [1,1,0,0,0,0|2,0,0]=4 7556 B12R1.1123 CCNc1cc(c(cc1F)Cl)C 34a_100000091823_100000210202 [1,1,0,0,0,0|2,0,0]=4 7557 B12R1.1123 CCNc1cc(c(cc1F)Cl)C 7a_100000091823_100000210202 [1,1,0,0,0,0|2,0,0]=4 7558 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 34a_100000042052_100000210202 [1,1,0,0,0,0|2,0,0]=4 7559 B12R1.1123 CCNc1cc(c(cc1F)Cl)O 7a_100000042052_100000210202 [1,1,0,0,0,0|2,0,0]=4 7560 B12R1.1123 CCNc1cc(c(cc1F)F)O 34a_100011219470_100000210202 [1,1,0,0,0,0|2,0,0]=4 7561 B12R1.1123 CCNc1cc(c(cc1F)F)O 7a_100011219470_100000210202 [1,1,0,0,0,0|2,0,0]=4 7562 B12R1.1123 CCNc1cc(c(cc1F)O)F 34a_100020635945_100000210202 [1,1,0,0,0,0|2,0,0]=4 7563 B12R1.1123 CCNc1cc(c(cc1F)O)F 7a_100020635945_100000210202 [1,1,0,0,0,0|2,0,0]=4 7564 B12R1.1123 CCNc1cc(c(cc1I)C)C 34a_100012353678_100000210202 [1,1,0,0,0,0|2,0,0]=4 7565 B12R1.1123 CCNc1cc(c(cc1I)C)C 7a_100012353678_100000210202 [1,1,0,0,0,0|2,0,0]=4 7566 B12R1.1123 CCNc1cc(c(cc1I)F)C 34a_100010238302_100000210202 [1,1,0,0,0,0|2,0,0]=4 7567 B12R1.1123 CCNc1cc(c(cc1I)F)C 7a_100010238302_100000210202 [1,1,0,0,0,0|2,0,0]=4 7568 B12R1.1123 CCNc1cc(c(cc1O)Br)C 34a_200010107346_100000210202 [1,1,0,0,0,0|2,0,0]=4 7569 B12R1.1123 CCNc1cc(c(cc1O)C)C 34a_100133014134_100000210202 [1,1,0,0,0,0|2,0,0]=4 7570 B12R1.1123 CCNc1cc(c(cc1O)C)C 7a_100133014134_100000210202 [1,1,0,0,0,0|2,0,0]=4 7571 B12R1.1123 CCNc1cc(c(cc1O)F)C 34a_100012022779_100000210202 [1,1,0,0,0,0|2,0,0]=4 7572 B12R1.1123 CCNc1cc(c(cc1O)F)C 7a_100012022779_100000210202 [1,1,0,0,0,0|2,0,0]=4 7573 B12R1.1123 CCOc1cc(c(cc1Br)C)C 34a_100009814663_100000210202 [1,1,0,0,0,0|2,0,0]=4 7574 B12R1.1123 CCOc1cc(c(cc1Br)C)C 7a_100009814663_100000210202 [1,1,0,0,0,0|2,0,0]=4 7575 B12R1.1123 CCOc1cc(c(cc1Br)Cl)C 34a_100022700756_100000210202 [1,1,0,0,0,0|2,0,0]=4 7576 B12R1.1123 CCOc1cc(c(cc1Br)Cl)C 7a_100022700756_100000210202 [1,1,0,0,0,0|2,0,0]=4 7577 B12R1.1123 CCOc1cc(c(cc1C)Br)C 34a_100000698207_100000210202 [1,1,0,0,0,0|2,0,0]=4 7578 B12R1.1123 CCOc1cc(c(cc1C)Br)C 7a_100000698207_100000210202 [1,1,0,0,0,0|2,0,0]=4 7579 B12R1.1123 CCOc1cc(c(cc1C)C)C 34a_200000047129_100000210202 [1,1,0,0,0,0|2,0,0]=4 7580 B12R1.1123 CCOc1cc(c(cc1C)C)C 7a_200000047129_100000210202 [1,1,0,0,0,0|2,0,0]=4 7581 B12R1.1123 CCOc1cc(c(cc1C)F)C 34a_100010674473_100000210202 [1,1,0,0,0,0|2,0,0]=4 7582 B12R1.1123 CCOc1cc(c(cc1C)F)C 7a_100010674473_100000210202 [1,1,0,0,0,0|2,0,0]=4 7583 B12R1.1123 CCOc1cc(c(cc1C)I)C 34a_200011215153_100000210202 [1,1,0,0,0,0|2,0,0]=4 7584 B12R1.1123 CCOc1cc(c(cc1C)I)C 7a_200011215153_100000210202 [1,1,0,0,0,0|2,0,0]=4 7585 B12R1.1123 CCOc1cc(c(cc1C)N)C 34a_100000720036_100000210202 [1,1,0,0,0,0|2,0,0]=4 7586 B12R1.1123 CCOc1cc(c(cc1C)N)C 7a_100000720036_100000210202 [1,1,0,0,0,0|2,0,0]=4 7587 B12R1.1123 CCOc1cc(c(cc1Cl)Br)C 34a_200012350488_100000210202 [1,1,0,0,0,0|2,0,0]=4 7588 B12R1.1123 CCOc1cc(c(cc1Cl)Br)C 7a_200012350488_100000210202 [1,1,0,0,0,0|2,0,0]=4 7589 B12R1.1123 CCOc1cc(c(cc1Cl)C)C 34a_100000031796_100000210202 [1,1,0,0,0,0|2,0,0]=4 7590 B12R1.1123 CCOc1cc(c(cc1Cl)C)C 7a_100000031796_100000210202 [1,1,0,0,0,0|2,0,0]=4 7591 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)C 34a_100012002691_100000210202 [1,1,0,0,0,0|2,0,0]=4 7592 B12R1.1123 CCOc1cc(c(cc1Cl)Cl)C 7a_100012002691_100000210202 [1,1,0,0,0,0|2,0,0]=4 7593 B12R1.1123 CCOc1cc(c(cc1F)Br)C 34a_100012355673_100000210202 [1,1,0,0,0,0|2,0,0]=4 7594 B12R1.1123 CCOc1cc(c(cc1F)Br)C 7a_100012355673_100000210202 [1,1,0,0,0,0|2,0,0]=4 7595 B12R1.1123 CCOc1cc(c(cc1N)Br)C 34a_200010235796_100000210202 [1,1,0,0,0,0|2,0,0]=4 7596 B12R1.1123 CCOc1cc(c(cc1N)Br)C 7a_200010235796_100000210202 [1,1,0,0,0,0|2,0,0]=4 7597 B12R1.1123 CCOc1cc(c(cc1N)C)C 34a_100133014134_100000210202 [1,1,0,0,0,0|2,0,0]=4 7598 B12R1.1123 CCOc1cc(c(cc1N)C)C 7a_100133014134_100000210202 [1,1,0,0,0,0|2,0,0]=4 7599 B12R1.1123 CCOc1cc(c(cc1N)Cl)C 34a_100000091707_100000210202 [1,1,0,0,0,0|2,0,0]=4 7600 B12R1.1123 CCOc1cc(c(cc1N)Cl)C 7a_100000091707_100000210202 [1,1,0,0,0,0|2,0,0]=4 7601 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100000210202_100021297947 [1,1,0,0,0,0|2,0,0]=4 7602 B12R1.1123 CCSc1cc(c(cc1Br)Cl)O 62a_100021297947_100000210202 [1,1,0,0,0,0|2,0,0]=4 7603 B12R1.1123 CCSc1cc(c(cc1Br)F)C 62a_100000210202_200009814773 [1,1,0,0,0,0|2,0,0]=4 7604 B12R1.1123 CCSc1cc(c(cc1Br)F)C 62a_200009814773_100000210202 [1,1,0,0,0,0|2,0,0]=4 7605 B12R1.1123 CCSc1cc(c(cc1C)Br)C 62a_100000210202_100011356911 [1,1,0,0,0,0|2,0,0]=4 7606 B12R1.1123 CCSc1cc(c(cc1C)Br)C 62a_100011356911_100000210202 [1,1,0,0,0,0|2,0,0]=4 7607 B12R1.1123 CCSc1cc(c(cc1C)C)C 62a_100000210202_100000759388 [1,1,0,0,0,0|2,0,0]=4 7608 B12R1.1123 CCSc1cc(c(cc1C)C)C 62a_100000759388_100000210202 [1,1,0,0,0,0|2,0,0]=4 7609 B12R1.1123 CCSc1cc(c(cc1C)Cl)C 62a_100000210202_100012357408 [1,1,0,0,0,0|2,0,0]=4 7610 B12R1.1123 CCSc1cc(c(cc1C)Cl)C 62a_100012357408_100000210202 [1,1,0,0,0,0|2,0,0]=4 7611 B12R1.1123 CCSc1cc(c(cc1C)F)C 62a_100000210202_100010212296 [1,1,0,0,0,0|2,0,0]=4 7612 B12R1.1123 CCSc1cc(c(cc1C)F)C 62a_100010212296_100000210202 [1,1,0,0,0,0|2,0,0]=4 7613 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100000210202_100010068922 [1,1,0,0,0,0|2,0,0]=4 7614 B12R1.1123 CCSc1cc(c(cc1C)F)O 62a_100010068922_100000210202 [1,1,0,0,0,0|2,0,0]=4 7615 B12R1.1123 CCSc1cc(c(cc1C)N)C 62a_100000210202_100011934712 [1,1,0,0,0,0|2,0,0]=4 7616 B12R1.1123 CCSc1cc(c(cc1C)N)C 62a_100011934712_100000210202 [1,1,0,0,0,0|2,0,0]=4 7617 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_100000210202_200010107346 [1,1,0,0,0,0|2,0,0]=4 7618 B12R1.1123 CCSc1cc(c(cc1C)N)O 62a_200010107346_100000210202 [1,1,0,0,0,0|2,0,0]=4 7619 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000210202_100000698207 [1,1,0,0,0,0|1,0,0]=3 7620 B12R1.1123 CCSc1cc(c(cc1C)O)C 62a_100000698207_100000210202 [1,1,0,0,0,0|1,0,0]=3 7621 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100000210202_100012355673 [1,1,0,0,0,0|2,0,0]=4 7622 B12R1.1123 CCSc1cc(c(cc1C)O)F 62a_100012355673_100000210202 [1,1,0,0,0,0|2,0,0]=4 7623 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_100000210202_200010235796 [1,1,0,0,0,0|2,0,0]=4 7624 B12R1.1123 CCSc1cc(c(cc1C)O)N 62a_200010235796_100000210202 [1,1,0,0,0,0|2,0,0]=4 7625 B12R1.1123 CCSc1cc(c(cc1Cl)Br)C 62a_100000210202_100010259621 [1,1,0,0,0,0|2,0,0]=4 7626 B12R1.1123 CCSc1cc(c(cc1Cl)Br)C 62a_100010259621_100000210202 [1,1,0,0,0,0|2,0,0]=4 7627 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100000210202_100011011175 [1,1,0,0,0,0|2,0,0]=4 7628 B12R1.1123 CCSc1cc(c(cc1Cl)O)N 62a_100011011175_100000210202 [1,1,0,0,0,0|2,0,0]=4 7629 B12R1.1123 CCSc1cc(c(cc1F)Br)C 62a_100000210202_200009814772 [1,1,0,0,0,0|2,0,0]=4 7630 B12R1.1123 CCSc1cc(c(cc1F)Br)C 62a_200009814772_100000210202 [1,1,0,0,0,0|2,0,0]=4 7631 B12R1.1123 CCSc1cc(c(cc1F)C)C 62a_100000210202_100010197417 [1,1,0,0,0,0|2,0,0]=4 7632 B12R1.1123 CCSc1cc(c(cc1F)C)C 62a_100010197417_100000210202 [1,1,0,0,0,0|2,0,0]=4 7633 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100000210202_100014242602 [1,1,0,0,0,0|2,0,0]=4 7634 B12R1.1123 CCSc1cc(c(cc1F)C)O 62a_100014242602_100000210202 [1,1,0,0,0,0|2,0,0]=4 7635 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100000210202_100010735246 [1,1,0,0,0,0|2,0,0]=4 7636 B12R1.1123 CCSc1cc(c(cc1F)Cl)O 62a_100010735246_100000210202 [1,1,0,0,0,0|2,0,0]=4 7637 B12R1.1123 CCSc1cc(c(cc1F)F)C 62a_100000210202_100000692463 [1,1,0,0,0,0|2,0,0]=4 7638 B12R1.1123 CCSc1cc(c(cc1F)F)C 62a_100000692463_100000210202 [1,1,0,0,0,0|2,0,0]=4 7639 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100000210202_100012457948 [1,1,0,0,0,0|2,0,0]=4 7640 B12R1.1123 CCSc1cc(c(cc1F)F)O 62a_100012457948_100000210202 [1,1,0,0,0,0|2,0,0]=4 7641 B12R1.1123 CCSc1cc(c(cc1F)N)C 62a_100000210202_100000695870 [1,1,0,0,0,0|2,0,0]=4 7642 B12R1.1123 CCSc1cc(c(cc1F)N)C 62a_100000695870_100000210202 [1,1,0,0,0,0|2,0,0]=4 7643 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100000210202_100013038943 [1,1,0,0,0,0|2,0,0]=4 7644 B12R1.1123 CCSc1cc(c(cc1F)N)O 62a_100013038943_100000210202 [1,1,0,0,0,0|2,0,0]=4 7645 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100000210202_100011830439 [1,1,0,0,0,0|2,0,0]=4 7646 B12R1.1123 CCSc1cc(c(cc1F)O)F 62a_100011830439_100000210202 [1,1,0,0,0,0|2,0,0]=4 7647 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100000210202_100012359894 [1,1,0,0,0,0|2,0,0]=4 7648 B12R1.1123 CCSc1cc(c(cc1F)O)N 62a_100012359894_100000210202 [1,1,0,0,0,0|2,0,0]=4 7649 B12R1.1123 CCSc1cc(c(cc1N)Br)C 62a_100000210202_200015600912 [1,1,0,0,0,0|2,0,0]=4 7650 B12R1.1123 CCSc1cc(c(cc1N)Br)C 62a_200015600912_100000210202 [1,1,0,0,0,0|2,0,0]=4 7651 B12R1.1123 CCSc1cc(c(cc1N)C)C 62a_100000210202_100012337760 [1,1,0,0,0,0|2,0,0]=4 7652 B12R1.1123 CCSc1cc(c(cc1N)C)C 62a_100012337760_100000210202 [1,1,0,0,0,0|2,0,0]=4 7653 B12R1.1123 CCSc1cc(c(cc1N)F)C 62a_100000210202_100011218008 [1,1,0,0,0,0|2,0,0]=4 7654 B12R1.1123 CCSc1cc(c(cc1N)F)C 62a_100011218008_100000210202 [1,1,0,0,0,0|2,0,0]=4 7655 B12R1.1123 CCSc1cc(c(cc1N)N)C 62a_100000210202_200013038441 [1,1,0,0,0,0|2,0,0]=4 7656 B12R1.1123 CCSc1cc(c(cc1N)N)C 62a_200013038441_100000210202 [1,1,0,0,0,0|2,0,0]=4 7657 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100000210202_100009814663 [1,1,0,0,0,0|2,0,0]=4 7658 B12R1.1123 CCSc1cc(c(cc1O)C)C 62a_100009814663_100000210202 [1,1,0,0,0,0|2,0,0]=4 7659 B12R1.1123 CNCc1cc(c(cc1Br)C)C 26a_100102657272_100009814663 [1,1,0,0,0,0|2,0,0]=4 7660 B12R1.1123 CNCc1cc(c(cc1Br)Cl)C 26a_100102657272_100022700756 [1,1,0,0,0,0|2,0,0]=4 7661 B12R1.1123 CNCc1cc(c(cc1Br)F)C 207a_100102657272_100009814814 [1,1,0,0,0,0|2,0,0]=4 7662 B12R1.1123 CNCc1cc(c(cc1Br)F)C 270004a_106832991635_100009814814 [1,1,0,0,0,0|2,0,0]=4 7663 B12R1.1123 CNCc1cc(c(cc1C)Br)C 207a_100102657272_100012024176 [1,1,0,0,0,0|2,0,0]=4 7664 B12R1.1123 CNCc1cc(c(cc1C)Br)C 26a_100102657272_100000698207 [1,1,0,0,0,0|2,0,0]=4 7665 B12R1.1123 CNCc1cc(c(cc1C)Br)C 270004a_106832991635_100012024176 [1,1,0,0,0,0|2,0,0]=4 7666 B12R1.1123 CNCc1cc(c(cc1C)C)C 207a_100102657272_100000211818 [1,1,0,0,0,0|2,0,0]=4 7667 B12R1.1123 CNCc1cc(c(cc1C)C)C 270004a_106832991635_100000211818 [1,1,0,0,0,0|2,0,0]=4 7668 B12R1.1123 CNCc1cc(c(cc1Cl)Br)C 26a_100102657272_200012350488 [1,1,0,0,0,0|2,0,0]=4 7669 B12R1.1123 CNCc1cc(c(cc1Cl)Cl)C 26a_100102657272_100012002691 [1,1,0,0,0,0|2,0,0]=4 7670 B12R1.1123 CNCc1cc(c(cc1F)Br)C 207a_100102657272_100010186291 [1,1,0,0,0,0|2,0,0]=4 7671 B12R1.1123 CNCc1cc(c(cc1F)Br)C 26a_100102657272_100012355673 [1,1,0,0,0,0|2,0,0]=4 7672 B12R1.1123 CNCc1cc(c(cc1F)Br)C 270004a_106832991635_100010186291 [1,1,0,0,0,0|2,0,0]=4 7673 B12R1.1123 CNCc1cc(c(cc1F)Cl)C 207a_100102657272_100015641705 [1,1,0,0,0,0|2,0,0]=4 7674 B12R1.1123 CNCc1cc(c(cc1F)Cl)C 270004a_106832991635_100015641705 [1,1,0,0,0,0|2,0,0]=4 7675 B12R1.1123 CNCc1cc(c(cc1F)F)C 207a_100102657272_100012017330 [1,1,0,0,0,0|2,0,0]=4 7676 B12R1.1123 CNCc1cc(c(cc1F)F)C 2230a_106832991635_100012347589 [1,1,0,0,0,0|2,0,0]=4 7677 B12R1.1123 CNCc1cc(c(cc1F)F)C 270004a_106832991635_100012017330 [1,1,0,0,0,0|2,0,0]=4 7678 B12R1.1123 CNCc1cc(c(cc1F)F)C 34a_100102657272_100012347589 [1,1,0,0,0,0|2,0,0]=4 7679 B12R1.1123 CNCc1cc(c(cc1F)F)C 7a_106832991635_100012347589 [1,1,0,0,0,0|2,0,0]=4 7680 B12R1.1123 CNCc1cc(c(cc1I)C)C 207a_100102657272_100010184403 [1,1,0,0,0,0|2,0,0]=4 7681 B12R1.1123 CNCc1cc(c(cc1I)C)C 270004a_106832991635_100010184403 [1,1,0,0,0,0|2,0,0]=4 7682 B12R1.1123 COCc1cc(c(cc1C)C)C 34a_200000246302_200000210301 [1,1,0,0,0,0|2,0,0]=4 7683 B12R1.1123 COCc1cc(c(cc1C)C)C 7a_200000246302_200000210301 [1,1,0,0,0,0|2,0,0]=4 7684 B12R1.1123 COCc1cc(c(cc1F)F)C 34a_100012186966_200000210301 [1,1,0,0,0,0|2,0,0]=4 7685 B12R1.1123 COCc1cc(c(cc1F)F)C 34a_100138415774_100012347589 [1,1,0,0,0,0|2,0,0]=4 7686 B12R1.1123 COCc1cc(c(cc1F)F)C 7a_100012186966_200000210301 [1,1,0,0,0,0|2,0,0]=4 7687 B12R1.1123 COCc1cc(c(cc1I)C)C 34a_100010184405_200000210301 [1,1,0,0,0,0|2,0,0]=4 7688 B12R1.1123 COCc1cc(c(cc1I)C)C 7a_100010184405_200000210301 [1,1,0,0,0,0|2,0,0]=4 7689 B12R1.1123 CSCc1cc(c(cc1F)F)C 62a_100012347589_200000210301 [1,1,0,0,0,0|2,0,0]=4 7690 B12R1.1123 CSCc1cc(c(cc1F)F)C 62a_200000210301_100012347589 [1,1,0,0,0,0|2,0,0]=4 7691 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])C 34a_200000246302_200025704644 [1,1,0,0,0,0|2,0,0]=4 7692 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])C 7a_200000246302_200025704644 [1,1,0,0,0,0|2,0,0]=4 7693 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])I 34a_100010184405_200025704644 [1,1,0,0,0,0|2,0,0]=4 7694 B12R1.1123 Cc1cc(c(cc1C)CO[13CH3])I 7a_100010184405_200025704644 [1,1,0,0,0,0|2,0,0]=4 7695 B12R1.1123 Cc1cc(c(cc1F)F)CO[13CH3] 34a_100012186966_200025704644 [1,1,0,0,0,0|2,0,0]=4 7696 B12R1.1123 Cc1cc(c(cc1F)F)CO[13CH3] 7a_100012186966_200025704644 [1,1,0,0,0,0|2,0,0]=4 7697 B12R1.1123 Cc1cc(c(cc1F)F)CS[13CH3] 62a_100012347589_200025704644 [1,1,0,0,0,0|2,0,0]=4 7698 B12R1.1123 Cc1cc(c(cc1F)F)CS[13CH3] 62a_200025704644_100012347589 [1,1,0,0,0,0|2,0,0]=4 7699 B12R1.1123 Cc1cc(c(cc1O)C)NCF 34a_100000720036_100015361967 [1,1,0,0,0,0|2,0,0]=4 7700 B12R1.1123 Cc1cc(c(cc1O)C)NCF 7a_100000720036_100015361967 [1,1,0,0,0,0|2,0,0]=4 7701 B12R1.1123 Cc1cc(c(cc1O)C)SCF 62a_100000698207_100015361967 [1,1,0,0,0,0|2,0,0]=4 7702 B12R1.1123 Cc1cc(c(cc1O)C)SCF 62a_100015361967_100000698207 [1,1,0,0,0,0|2,0,0]=4 7703 B12R1.56 C=C(C)c1ccc(c(c1)CC)O 271570a_100000694244_100012338938 [1,1,0,0,0,0|1,0,1]=4 7704 B12R1.56 C=C(C)c1ccc(c(c1)OC)Br 271570a_100000694244_100012353699 [1,1,0,0,0,0|1,0,1]=4 7705 B12R1.56 C=C(C)c1ccc(c(c1)OC)C 271570a_100000694244_100011830276 [1,1,0,0,0,0|1,0,1]=4 7706 B12R1.56 C=C(C)c1ccc(c(c1)OC)Cl 271570a_100000694244_100011356853 [1,1,0,0,0,0|1,0,1]=4 7707 B12R1.56 C=C(C)c1ccc(c(c1)OC)F 271570a_100000694244_100011934186 [1,1,0,0,0,0|1,0,1]=4 7708 B12R1.56 C=C(C)c1ccc(c(c1)OC)N 271570a_100000694244_100011279103 [1,1,0,0,0,0|1,0,1]=4 7709 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [1,1,0,0,0,0|0,0,1]=3 7710 B12R1.56 C=C(C)c1ccc(c(n1)OC)O 271570a_100000694244_100010893133 [1,1,0,0,0,0|1,0,1]=4 7711 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 34a_100000084092_200025704644 [1,1,0,0,0,0|1,0,1]=4 7712 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])C 7a_100000084092_200025704644 [1,1,0,0,0,0|1,0,1]=4 7713 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 34a_100000117923_200025704644 [1,1,0,0,0,0|1,0,1]=4 7714 B12R1.56 CC(=O)c1ccc(c(c1)O[13CH3])F 7a_100000117923_200025704644 [1,1,0,0,0,0|1,0,1]=4 7715 B12R1.56 CC(=O)c1ccc(c(c1)S[13CH3])O 62a_100011772453_200025704644 [1,1,0,0,0,0|0,1,1]=4 7716 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 34a_200000187366_200025704644 [1,1,0,0,0,0|1,0,0]=3 7717 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 7a_200000187366_200025704644 [1,1,0,0,0,0|1,0,0]=3 7718 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_100011218581_200025704644 [1,1,0,0,0,0|1,1,0]=4 7719 B12R1.56 CC(C)c1ccc(c(c1)S[13CH3])N 62a_200025704644_100011218581 [1,1,0,0,0,0|1,1,0]=4 7720 B12R1.56 CC(O)c1ccc(c(c1)S[13CH3])F 62a_100011191524_200025704644 [1,1,0,0,0,0|1,1,0]=4 7721 B12R1.56 CC(O)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100011191524 [1,1,0,0,0,0|1,1,0]=4 7722 B12R1.56 CNc1cc(ccc1C)C(C)C 2230a_100011216979_200000210301 [1,1,0,0,0,0|2,0,0]=4 7723 B12R1.56 CNc1cc(ccc1C)C(C)C 34a_100011216979_200000210301 [1,1,0,0,0,0|2,0,0]=4 7724 B12R1.56 CNc1cc(ccc1C)C(C)C 7a_100011216979_200000210301 [1,1,0,0,0,0|2,0,0]=4 7725 B12R1.56 CNc1cc(ccc1O)C(C)C 34a_200000187366_200000210301 [1,1,0,0,0,0|1,0,0]=3 7726 B12R1.56 CNc1cc(ccc1O)C(C)C 7a_200000187366_200000210301 [1,1,0,0,0,0|1,0,0]=3 7727 B12R1.56 COc1cc(ccc1Br)C(=O)C 1458a_100011934951_200000210301 [1,1,0,0,0,0|1,0,1]=4 7728 B12R1.56 COc1cc(ccc1Br)C(=O)[13CH3] 1458a_100011934951_200025704644 [1,1,0,0,0,0|1,0,1]=4 7729 B12R1.56 COc1cc(ccc1C)C(=O)C 1458a_100000212341_200000210301 [1,1,0,0,0,0|1,0,1]=4 7730 B12R1.56 COc1cc(ccc1C)C(=O)C 34a_100000084092_200000210301 [1,1,0,0,0,0|1,0,1]=4 7731 B12R1.56 COc1cc(ccc1C)C(=O)C 7a_100000084092_200000210301 [1,1,0,0,0,0|1,0,1]=4 7732 B12R1.56 COc1cc(ccc1C)C(=O)[13CH3] 1458a_100000212341_200025704644 [1,1,0,0,0,0|1,0,1]=4 7733 B12R1.56 COc1cc(ccc1C)C(C)C 34a_100000212073_200000210301 [1,1,0,0,0,0|1,0,0]=3 7734 B12R1.56 COc1cc(ccc1C)C(C)C 7a_100000212073_200000210301 [1,1,0,0,0,0|1,0,0]=3 7735 B12R1.56 COc1cc(ccc1Cl)C(=O)C 1458a_100000181799_200000210301 [1,1,0,0,0,0|1,0,1]=4 7736 B12R1.56 COc1cc(ccc1Cl)C(=O)[13CH3] 1458a_100000181799_200025704644 [1,1,0,0,0,0|1,0,1]=4 7737 B12R1.56 COc1cc(ccc1F)C(=O)C 1458a_100000757635_200000210301 [1,1,0,0,0,0|1,0,1]=4 7738 B12R1.56 COc1cc(ccc1F)C(=O)C 34a_100000117923_200000210301 [1,1,0,0,0,0|1,0,1]=4 7739 B12R1.56 COc1cc(ccc1F)C(=O)C 7a_100000117923_200000210301 [1,1,0,0,0,0|1,0,1]=4 7740 B12R1.56 COc1cc(ccc1F)C(=O)[13CH3] 1458a_100000757635_200025704644 [1,1,0,0,0,0|1,0,1]=4 7741 B12R1.56 COc1cc(ccc1F)N(C)C 2230a_200012002703_200000210301 [1,1,0,0,0,0|2,0,0]=4 7742 B12R1.56 COc1cc(ccc1F)N(C)C 269982a_200012002703_200000210301 [1,1,0,0,0,0|2,0,0]=4 7743 B12R1.56 COc1cc(ccc1F)N(C)C 34a_200012002703_200000210301 [1,1,0,0,0,0|2,0,0]=4 7744 B12R1.56 COc1cc(ccc1F)N(C)C 38a_200012002703_200000210301 [1,1,0,0,0,0|2,0,0]=4 7745 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 2230a_200012002703_200025704644 [1,1,0,0,0,0|2,0,0]=4 7746 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 269982a_200012002703_200025704644 [1,1,0,0,0,0|2,0,0]=4 7747 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 34a_200012002703_200025704644 [1,1,0,0,0,0|2,0,0]=4 7748 B12R1.56 COc1cc(ccc1F)N(C)[13CH3] 38a_200012002703_200025704644 [1,1,0,0,0,0|2,0,0]=4 7749 B12R1.56 COc1cc(ccc1I)C(=O)C 1458a_100012356290_200000210301 [1,1,0,0,0,0|1,0,1]=4 7750 B12R1.56 COc1cc(ccc1I)C(=O)[13CH3] 1458a_100012356290_200025704644 [1,1,0,0,0,0|1,0,1]=4 7751 B12R1.56 COc1cc(ccc1O)B(O)O 271570a_203496583355_100012355544 [1,1,0,0,0,0|2,0,0]=4 7752 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [1,1,0,0,0,0|0,0,1]=3 7753 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [1,1,0,0,0,0|0,0,1]=3 7754 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [1,1,0,0,0,0|1,0,1]=4 7755 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [1,1,0,0,0,0|0,0,1]=3 7756 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [1,1,0,0,0,0|0,0,0]=2 7757 B12R1.56 CSc1cc(ccc1F)C(C)O 62a_100011191524_200000210301 [1,1,0,0,0,0|1,1,0]=4 7758 B12R1.56 CSc1cc(ccc1F)C(C)O 62a_200000210301_100011191524 [1,1,0,0,0,0|1,1,0]=4 7759 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_100000753309_200000210301 [1,1,0,0,0,0|1,1,0]=4 7760 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_200000210301_100000753309 [1,1,0,0,0,0|1,1,0]=4 7761 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_100011218581_200000210301 [1,1,0,0,0,0|1,1,0]=4 7762 B12R1.56 CSc1cc(ccc1N)C(C)C 62a_200000210301_100011218581 [1,1,0,0,0,0|1,1,0]=4 7763 B12R1.56 CSc1cc(ccc1O)C(=O)C 62a_100011772453_200000210301 [1,1,0,0,0,0|0,1,1]=4 7764 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_100000753309_200025704644 [1,1,0,0,0,0|1,1,0]=4 7765 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000753309 [1,1,0,0,0,0|1,1,0]=4 7766 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 2230a_100011216979_200025704644 [1,1,0,0,0,0|2,0,0]=4 7767 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 34a_100011216979_200025704644 [1,1,0,0,0,0|2,0,0]=4 7768 B12R1.56 Cc1ccc(cc1N[13CH3])C(C)C 7a_100011216979_200025704644 [1,1,0,0,0,0|2,0,0]=4 7769 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 34a_100000212073_200025704644 [1,1,0,0,0,0|1,0,0]=3 7770 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 7a_100000212073_200025704644 [1,1,0,0,0,0|1,0,0]=3 7771 B12R1.78 C=Cc1cc(ccc1OC)CC 271570a_100011290941_100010062400 [1,1,0,0,0,0|1,0,1]=4 7772 B12R1.78 C=Cc1ccc(c(c1)OC)CO 271570a_100011290941_100011277633 [1,1,0,0,0,0|0,0,2]=4 7773 B12R1.78 C=Cc1ccc(c(c1)OC)OC 271570a_100011290941_100000187503 [1,1,0,0,0,0|0,0,2]=4 7774 B12R1.78 C=Cc1ccc(c(c1)OC)OC 34a_100011217988_200000210301 [1,1,0,0,0,0|0,0,2]=4 7775 B12R1.78 C=Cc1ccc(c(c1)OC)O[13CH3] 34a_100011217988_200025704644 [1,1,0,0,0,0|0,0,2]=4 7776 B12R1.78 C=Cc1ccc(cc1OC)CC 271570a_100011290941_200010710389 [1,1,0,0,0,0|1,0,0]=3 7777 B12R1.78 C=Cc1ccc(cc1OC)CO 271570a_100011290941_100010234685 [1,1,0,0,0,0|2,0,0]=4 7778 B12R1.78 C=Cc1ccc(cc1OC)OC 271570a_100011290941_100000750026 [1,1,0,0,0,0|2,0,0]=4 7779 B12R1.78 CCc1cc(ccc1OC)SC 62a_200000210301_200010179862 [1,1,0,0,0,0|2,0,0]=4 7780 B12R1.78 CCc1cc(ccc1OC)SC 62a_200010179862_200000210301 [1,1,0,0,0,0|2,0,0]=4 7781 B12R1.78 CCc1cc(ccc1OC)S[13CH3] 62a_200010179862_200025704644 [1,1,0,0,0,0|2,0,0]=4 7782 B12R1.78 CCc1cc(ccc1OC)S[13CH3] 62a_200025704644_200010179862 [1,1,0,0,0,0|2,0,0]=4 7783 B12R1.78 CCc1ccc(c(c1)NC)OC 2230a_100012035449_200000210301 [1,1,0,0,0,0|1,0,0]=3 7784 B12R1.78 CCc1ccc(c(c1)NC)OC 34a_100012035449_200000210301 [1,1,0,0,0,0|1,0,0]=3 7785 B12R1.78 CCc1ccc(c(c1)N[13CH3])OC 2230a_100012035449_200025704644 [1,1,0,0,0,0|1,0,0]=3 7786 B12R1.78 CCc1ccc(c(c1)N[13CH3])OC 34a_100012035449_200025704644 [1,1,0,0,0,0|1,0,0]=3 7787 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100000186467_200000210301 [1,1,0,0,0,0|0,0,0]=2 7788 B12R1.78 CCc1ccc(c(c1)OC)OC 34a_100009844796_200000210301 [1,1,0,0,0,0|0,0,0]=2 7789 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100000186467_200000210301 [1,1,0,0,0,0|0,0,0]=2 7790 B12R1.78 CCc1ccc(c(c1)OC)OC 7a_100009844796_200000210301 [1,1,0,0,0,0|0,0,0]=2 7791 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 34a_100000186467_200025704644 [1,1,0,0,0,0|0,0,0]=2 7792 B12R1.78 CCc1ccc(c(c1)OC)O[13CH3] 7a_100000186467_200025704644 [1,1,0,0,0,0|0,0,0]=2 7793 B12R1.78 CCc1ccc(c(c1)OC)SC 62a_200000210301_200010710389 [1,1,0,0,0,0|0,1,0]=3 7794 B12R1.78 CCc1ccc(c(c1)OC)SC 62a_200010710389_200000210301 [1,1,0,0,0,0|0,1,0]=3 7795 B12R1.78 CCc1ccc(c(c1)OC)S[13CH3] 62a_200010710389_200025704644 [1,1,0,0,0,0|0,1,0]=3 7796 B12R1.78 CCc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_200010710389 [1,1,0,0,0,0|0,1,0]=3 7797 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 34a_100009844796_200025704644 [1,1,0,0,0,0|0,0,0]=2 7798 B12R1.78 CCc1ccc(c(c1)O[13CH3])OC 7a_100009844796_200025704644 [1,1,0,0,0,0|0,0,0]=2 7799 B12R1.78 CCc1ccc(c(c1)SC)C#N 62a_200000210301_100010295696 [1,1,0,0,0,0|1,1,0]=4 7800 B12R1.78 CCc1ccc(c(c1)SC)OC 62a_100010062400_200000210301 [1,1,0,0,0,0|0,1,0]=3 7801 B12R1.78 CCc1ccc(c(c1)SC)OC 62a_200000210301_100010062400 [1,1,0,0,0,0|0,1,0]=3 7802 B12R1.78 CCc1ccc(c(c1)S[13CH3])C#N 62a_200025704644_100010295696 [1,1,0,0,0,0|1,1,0]=4 7803 B12R1.78 CCc1ccc(c(c1)S[13CH3])OC 62a_100010062400_200025704644 [1,1,0,0,0,0|0,1,0]=3 7804 B12R1.78 CCc1ccc(c(c1)S[13CH3])OC 62a_200025704644_100010062400 [1,1,0,0,0,0|0,1,0]=3 7805 B12R1.78 CCc1ccc(cc1OC)SC 62a_200000210301_200010710398 [1,1,0,0,0,0|2,0,0]=4 7806 B12R1.78 CCc1ccc(cc1OC)SC 62a_200010710398_200000210301 [1,1,0,0,0,0|2,0,0]=4 7807 B12R1.78 CCc1ccc(cc1OC)S[13CH3] 62a_200010710398_200025704644 [1,1,0,0,0,0|2,0,0]=4 7808 B12R1.78 CCc1ccc(cc1OC)S[13CH3] 62a_200025704644_200010710398 [1,1,0,0,0,0|2,0,0]=4 7809 B12R1.78 CNc1cc(ccc1CO)OC 34a_100011998734_200000210301 [1,1,0,0,0,0|2,0,0]=4 7810 B12R1.78 CNc1cc(ccc1OC)CO 2230a_100011269841_200000210301 [1,1,0,0,0,0|2,0,0]=4 7811 B12R1.78 CNc1cc(ccc1OC)CO 34a_100011269841_200000210301 [1,1,0,0,0,0|2,0,0]=4 7812 B12R1.78 CNc1cc(ccc1OC)OC 2230a_100000184736_200000210301 [1,1,0,0,0,0|2,0,0]=4 7813 B12R1.78 CNc1cc(ccc1OC)OC 34a_100000184736_200000210301 [1,1,0,0,0,0|2,0,0]=4 7814 B12R1.78 CNc1ccc(c(c1)OC)C#N 34a_100011999456_200000210301 [1,1,0,0,0,0|2,0,0]=4 7815 B12R1.78 CNc1ccc(c(c1)OC)CO 34a_100012183141_200000210301 [1,1,0,0,0,0|1,0,0]=3 7816 B12R1.78 CNc1ccc(c(c1)OC)OC 34a_100000187404_200000210301 [1,1,0,0,0,0|1,0,0]=3 7817 B12R1.78 CNc1ccc(c(c1)SC)OC 62a_114948341033_200000210301 [1,1,0,0,0,0|1,1,0]=4 7818 B12R1.78 CNc1ccc(c(c1)SC)OC 62a_200000210301_114948341033 [1,1,0,0,0,0|1,1,0]=4 7819 B12R1.78 CNc1ccc(c(c1)S[13CH3])OC 62a_114948341033_200025704644 [1,1,0,0,0,0|1,1,0]=4 7820 B12R1.78 CNc1ccc(c(c1)S[13CH3])OC 62a_200025704644_114948341033 [1,1,0,0,0,0|1,1,0]=4 7821 B12R1.78 CNc1ccc(cc1OC)CO 2230a_100000087641_200000210301 [1,1,0,0,0,0|2,0,0]=4 7822 B12R1.78 CNc1ccc(cc1OC)CO 34a_100000087641_200000210301 [1,1,0,0,0,0|2,0,0]=4 7823 B12R1.78 CNc1ccc(cc1OC)OC 2230a_100000211191_200000210301 [1,1,0,0,0,0|2,0,0]=4 7824 B12R1.78 CNc1ccc(cc1OC)OC 34a_100000211191_200000210301 [1,1,0,0,0,0|2,0,0]=4 7825 B12R1.78 CNc1ccc(cc1OC)SC 2230a_100000766855_200000210301 [1,1,0,0,0,0|2,0,0]=4 7826 B12R1.78 CNc1ccc(cc1OC)SC 34a_100000766855_200000210301 [1,1,0,0,0,0|2,0,0]=4 7827 B12R1.78 COc1cc(ccc1C#N)N[13CH3] 34a_100011999456_200025704644 [1,1,0,0,0,0|2,0,0]=4 7828 B12R1.78 COc1cc(ccc1C#N)SC 62a_200000210301_100000694671 [1,1,0,0,0,0|2,0,0]=4 7829 B12R1.78 COc1cc(ccc1C#N)S[13CH3] 62a_200025704644_100000694671 [1,1,0,0,0,0|2,0,0]=4 7830 B12R1.78 COc1cc(ccc1C=O)SC 62a_100000697075_200000210301 [1,1,0,0,0,0|1,0,1]=4 7831 B12R1.78 COc1cc(ccc1C=O)SC 62a_200000210301_100010290300 [1,1,0,0,0,0|1,0,1]=4 7832 B12R1.78 COc1cc(ccc1C=O)S[13CH3] 62a_100000697075_200025704644 [1,1,0,0,0,0|1,0,1]=4 7833 B12R1.78 COc1cc(ccc1C=O)S[13CH3] 62a_200025704644_100010290300 [1,1,0,0,0,0|1,0,1]=4 7834 B12R1.78 COc1cc(ccc1CO)CO 34a_200010669990_200000210301 [1,1,0,0,0,0|1,0,0]=3 7835 B12R1.78 COc1cc(ccc1CO)N[13CH3] 34a_100012183141_200025704644 [1,1,0,0,0,0|1,0,0]=3 7836 B12R1.78 COc1cc(ccc1CO)O[13CH3] 34a_200000116926_200025704644 [1,1,0,0,0,0|1,0,0]=3 7837 B12R1.78 COc1cc(ccc1CO)SC 62a_100011277633_200000210301 [1,1,0,0,0,0|1,0,0]=3 7838 B12R1.78 COc1cc(ccc1CO)SC 62a_200000210301_100011277633 [1,1,0,0,0,0|1,0,0]=3 7839 B12R1.78 COc1cc(ccc1CO)S[13CH3] 62a_100011277633_200025704644 [1,1,0,0,0,0|1,0,0]=3 7840 B12R1.78 COc1cc(ccc1CO)S[13CH3] 62a_200025704644_100011277633 [1,1,0,0,0,0|1,0,0]=3 7841 B12R1.78 COc1cc(ccc1N[13CH3])CO 2230a_100000087641_200025704644 [1,1,0,0,0,0|2,0,0]=4 7842 B12R1.78 COc1cc(ccc1N[13CH3])CO 34a_100000087641_200025704644 [1,1,0,0,0,0|2,0,0]=4 7843 B12R1.78 COc1cc(ccc1N[13CH3])SC 2230a_100000766855_200025704644 [1,1,0,0,0,0|2,0,0]=4 7844 B12R1.78 COc1cc(ccc1N[13CH3])SC 34a_100000766855_200025704644 [1,1,0,0,0,0|2,0,0]=4 7845 B12R1.78 COc1cc(ccc1O[13CH3])C#N 34a_100000184589_200025704644 [1,1,0,0,0,0|1,0,1]=4 7846 B12R1.78 COc1cc(ccc1O[13CH3])C#N 7a_100000184589_200025704644 [1,1,0,0,0,0|1,0,1]=4 7847 B12R1.78 COc1cc(ccc1O[13CH3])CN 34a_100000185554_200025704644 [1,1,0,0,0,0|1,0,0]=3 7848 B12R1.78 COc1cc(ccc1SC)CO 62a_100010234685_200000210301 [1,1,0,0,0,0|1,1,0]=4 7849 B12R1.78 COc1cc(ccc1SC)CO 62a_200000210301_100010234685 [1,1,0,0,0,0|1,1,0]=4 7850 B12R1.78 COc1cc(ccc1SC)SC 62a_200011001119_200000210301 [1,1,0,0,0,0|1,1,0]=4 7851 B12R1.78 COc1cc(ccc1SC)S[13CH3] 62a_200011001119_200025704644 [1,1,0,0,0,0|1,1,0]=4 7852 B12R1.78 COc1cc(ccc1S[13CH3])CO 62a_100010234685_200025704644 [1,1,0,0,0,0|1,1,0]=4 7853 B12R1.78 COc1cc(ccc1S[13CH3])CO 62a_200025704644_100010234685 [1,1,0,0,0,0|1,1,0]=4 7854 B12R1.78 COc1cc(cnc1CO)SC 62a_200000210301_200010246159 [1,1,0,0,0,0|2,0,0]=4 7855 B12R1.78 COc1cc(cnc1CO)SC 62a_200010246159_200000210301 [1,1,0,0,0,0|2,0,0]=4 7856 B12R1.78 COc1cc(cnc1CO)S[13CH3] 62a_200010246159_200025704644 [1,1,0,0,0,0|2,0,0]=4 7857 B12R1.78 COc1cc(cnc1CO)S[13CH3] 62a_200025704644_200010246159 [1,1,0,0,0,0|2,0,0]=4 7858 B12R1.78 COc1cc(cnc1OC)SC 62a_200000210301_100010234541 [1,1,0,0,0,0|2,0,0]=4 7859 B12R1.78 COc1cc(cnc1OC)S[13CH3] 62a_200025704644_100010234541 [1,1,0,0,0,0|2,0,0]=4 7860 B12R1.78 COc1cc(ncc1CO)SC 62a_100010714672_200000210301 [1,1,0,0,0,0|2,0,0]=4 7861 B12R1.78 COc1cc(ncc1CO)SC 62a_200000210301_100010714672 [1,1,0,0,0,0|2,0,0]=4 7862 B12R1.78 COc1cc(ncc1CO)S[13CH3] 62a_100010714672_200025704644 [1,1,0,0,0,0|2,0,0]=4 7863 B12R1.78 COc1cc(ncc1CO)S[13CH3] 62a_200025704644_100010714672 [1,1,0,0,0,0|2,0,0]=4 7864 B12R1.78 COc1ccc(c(c1)N[13CH3])CO 34a_100011998734_200025704644 [1,1,0,0,0,0|2,0,0]=4 7865 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 2230a_100000184736_200025704644 [1,1,0,0,0,0|2,0,0]=4 7866 B12R1.78 COc1ccc(c(c1)N[13CH3])OC 34a_100000184736_200025704644 [1,1,0,0,0,0|2,0,0]=4 7867 B12R1.78 COc1ccc(c(c1)OC)C#N 34a_100011999188_200000210301 [1,1,0,0,0,0|2,0,0]=4 7868 B12R1.78 COc1ccc(c(c1)OC)C#N 7a_100011999188_200000210301 [1,1,0,0,0,0|2,0,0]=4 7869 B12R1.78 COc1ccc(c(c1)OC)CO 34a_200000116926_200000210301 [1,1,0,0,0,0|1,0,0]=3 7870 B12R1.78 COc1ccc(c(c1)OC)N=O 34a_200010658452_200000210301 [1,1,0,0,0,0|1,0,1]=4 7871 B12R1.78 COc1ccc(c(c1)OC)N=O 7a_200010658452_200000210301 [1,1,0,0,0,0|1,0,1]=4 7872 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 2230a_100000211191_200025704644 [1,1,0,0,0,0|2,0,0]=4 7873 B12R1.78 COc1ccc(c(c1)OC)N[13CH3] 34a_100000211191_200025704644 [1,1,0,0,0,0|2,0,0]=4 7874 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000039706_200000210301 [1,1,0,0,0,0|1,0,0]=3 7875 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100000074795_200000210301 [1,1,0,0,0,0|1,0,0]=3 7876 B12R1.78 COc1ccc(c(c1)OC)OC 34a_100009840267_200000210301 [1,1,0,0,0,0|1,0,0]=3 7877 B12R1.78 COc1ccc(c(c1)OC)O[13CH3] 34a_100009840267_200025704644 [1,1,0,0,0,0|1,0,0]=3 7878 B12R1.78 COc1ccc(c(c1)OC)SC 62a_100000750026_200000210301 [1,1,0,0,0,0|1,1,0]=4 7879 B12R1.78 COc1ccc(c(c1)OC)SC 62a_200000210301_100000750026 [1,1,0,0,0,0|1,1,0]=4 7880 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_100000750026_200025704644 [1,1,0,0,0,0|1,1,0]=4 7881 B12R1.78 COc1ccc(c(c1)OC)S[13CH3] 62a_200025704644_100000750026 [1,1,0,0,0,0|1,1,0]=4 7882 B12R1.78 COc1ccc(c(c1)O[13CH3])C#N 34a_100011999188_200025704644 [1,1,0,0,0,0|2,0,0]=4 7883 B12R1.78 COc1ccc(c(c1)O[13CH3])C#N 7a_100011999188_200025704644 [1,1,0,0,0,0|2,0,0]=4 7884 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 34a_200010658452_200025704644 [1,1,0,0,0,0|1,0,1]=4 7885 B12R1.78 COc1ccc(c(c1)O[13CH3])N=O 7a_200010658452_200025704644 [1,1,0,0,0,0|1,0,1]=4 7886 B12R1.78 COc1ccc(c(c1)O[13CH3])OC 34a_100000074795_200025704644 [1,1,0,0,0,0|1,0,0]=3 7887 B12R1.78 COc1ccc(c(c1)SC)CO 62a_100011982768_200000210301 [1,1,0,0,0,0|1,1,0]=4 7888 B12R1.78 COc1ccc(c(c1)SC)CO 62a_200000210301_100011982768 [1,1,0,0,0,0|1,1,0]=4 7889 B12R1.78 COc1ccc(c(c1)SC)OC 62a_100011215452_200000210301 [1,1,0,0,0,0|1,1,0]=4 7890 B12R1.78 COc1ccc(c(c1)SC)OC 62a_200000210301_100011215452 [1,1,0,0,0,0|1,1,0]=4 7891 B12R1.78 COc1ccc(c(c1)S[13CH3])CO 62a_100011982768_200025704644 [1,1,0,0,0,0|1,1,0]=4 7892 B12R1.78 COc1ccc(c(c1)S[13CH3])CO 62a_200025704644_100011982768 [1,1,0,0,0,0|1,1,0]=4 7893 B12R1.78 COc1ccc(c(c1)S[13CH3])OC 62a_100011215452_200025704644 [1,1,0,0,0,0|1,1,0]=4 7894 B12R1.78 COc1ccc(c(c1)S[13CH3])OC 62a_200025704644_100011215452 [1,1,0,0,0,0|1,1,0]=4 7895 B12R1.78 COc1ccc(c(n1)OC)OC 34a_100000085135_200000210301 [1,1,0,0,0,0|2,0,0]=4 7896 B12R1.78 COc1ccc(c(n1)OC)O[13CH3] 34a_100000085135_200025704644 [1,1,0,0,0,0|2,0,0]=4 7897 B12R1.78 COc1ccc(cc1N[13CH3])CO 2230a_100011269841_200025704644 [1,1,0,0,0,0|2,0,0]=4 7898 B12R1.78 COc1ccc(cc1N[13CH3])CO 34a_100011269841_200025704644 [1,1,0,0,0,0|2,0,0]=4 7899 B12R1.78 COc1ccc(cc1OC)C#N 34a_100000184589_200000210301 [1,1,0,0,0,0|1,0,1]=4 7900 B12R1.78 COc1ccc(cc1OC)C#N 34a_100000188611_200000210301 [1,1,0,0,0,0|1,0,1]=4 7901 B12R1.78 COc1ccc(cc1OC)C#N 7a_100000184589_200000210301 [1,1,0,0,0,0|1,0,1]=4 7902 B12R1.78 COc1ccc(cc1OC)C#N 7a_100000188611_200000210301 [1,1,0,0,0,0|1,0,1]=4 7903 B12R1.78 COc1ccc(cc1OC)CN 34a_100000185554_200000210301 [1,1,0,0,0,0|1,0,0]=3 7904 B12R1.78 COc1ccc(cc1OC)CN 34a_100000740000_200000210301 [1,1,0,0,0,0|1,0,0]=3 7905 B12R1.78 COc1ccc(cc1OC)CO 34a_100011215239_200000210301 [1,1,0,0,0,0|1,0,0]=3 7906 B12R1.78 COc1ccc(cc1OC)N[13CH3] 34a_100000187404_200025704644 [1,1,0,0,0,0|1,0,0]=3 7907 B12R1.78 COc1ccc(cc1OC)O[13CH3] 34a_100000039706_200025704644 [1,1,0,0,0,0|1,0,0]=3 7908 B12R1.78 COc1ccc(cc1OC)SC 62a_200000210301_100011356967 [1,1,0,0,0,0|1,0,0]=3 7909 B12R1.78 COc1ccc(cc1OC)S[13CH3] 62a_200025704644_100011356967 [1,1,0,0,0,0|1,0,0]=3 7910 B12R1.78 COc1ccc(cc1O[13CH3])C#N 34a_100000188611_200025704644 [1,1,0,0,0,0|1,0,1]=4 7911 B12R1.78 COc1ccc(cc1O[13CH3])C#N 7a_100000188611_200025704644 [1,1,0,0,0,0|1,0,1]=4 7912 B12R1.78 COc1ccc(cc1O[13CH3])CN 34a_100000740000_200025704644 [1,1,0,0,0,0|1,0,0]=3 7913 B12R1.78 COc1ccc(cc1O[13CH3])CO 34a_100011215239_200025704644 [1,1,0,0,0,0|1,0,0]=3 7914 B12R1.78 COc1ccc(cc1SC)CN 62a_100159240714_200000210301 [1,1,0,0,0,0|1,1,0]=4 7915 B12R1.78 COc1ccc(cc1SC)CN 62a_200000210301_100159240714 [1,1,0,0,0,0|1,1,0]=4 7916 B12R1.78 COc1ccc(cc1SC)CO 62a_100000246451_200000210301 [1,1,0,0,0,0|1,1,0]=4 7917 B12R1.78 COc1ccc(cc1SC)CO 62a_200000210301_100000246451 [1,1,0,0,0,0|1,1,0]=4 7918 B12R1.78 COc1ccc(cc1SC)SC 62a_200009892704_200000210301 [1,1,0,0,0,0|1,1,0]=4 7919 B12R1.78 COc1ccc(cc1SC)S[13CH3] 62a_200009892704_200025704644 [1,1,0,0,0,0|1,1,0]=4 7920 B12R1.78 COc1ccc(cc1S[13CH3])CN 62a_100159240714_200025704644 [1,1,0,0,0,0|1,1,0]=4 7921 B12R1.78 COc1ccc(cc1S[13CH3])CN 62a_200025704644_100159240714 [1,1,0,0,0,0|1,1,0]=4 7922 B12R1.78 COc1ccc(cc1S[13CH3])CO 62a_100000246451_200025704644 [1,1,0,0,0,0|1,1,0]=4 7923 B12R1.78 COc1ccc(cc1S[13CH3])CO 62a_200025704644_100000246451 [1,1,0,0,0,0|1,1,0]=4 7924 B12R1.78 COc1ccc(nc1OC)SC 62a_200000210301_100010214848 [1,1,0,0,0,0|2,0,0]=4 7925 B12R1.78 COc1ccc(nc1OC)S[13CH3] 62a_200025704644_100010214848 [1,1,0,0,0,0|2,0,0]=4 7926 B12R1.78 COc1nc(ccc1CO)SC 62a_100010988397_200000210301 [1,1,0,0,0,0|2,0,0]=4 7927 B12R1.78 COc1nc(ccc1CO)SC 62a_200000210301_100010988397 [1,1,0,0,0,0|2,0,0]=4 7928 B12R1.78 COc1nc(ccc1CO)S[13CH3] 62a_100010988397_200025704644 [1,1,0,0,0,0|2,0,0]=4 7929 B12R1.78 COc1nc(ccc1CO)S[13CH3] 62a_200025704644_100010988397 [1,1,0,0,0,0|2,0,0]=4 7930 B12R1.78 CSc1cc(ccc1CO)CO 62a_100010881536_200000210301 [1,1,0,0,0,0|1,1,0]=4 7931 B12R1.78 CSc1cc(ccc1CO)CO 62a_200000210301_100010881536 [1,1,0,0,0,0|1,1,0]=4 7932 B12R1.78 [13CH3]Oc1cc(ccc1CO)CO 34a_200010669990_200025704644 [1,1,0,0,0,0|1,0,0]=3 7933 B12R1.78 [13CH3]Sc1cc(ccc1CO)CO 62a_100010881536_200025704644 [1,1,0,0,0,0|1,1,0]=4 7934 B12R1.78 [13CH3]Sc1cc(ccc1CO)CO 62a_200025704644_100010881536 [1,1,0,0,0,0|1,1,0]=4 7935 B12R1.300 CCc1cc(cc(c1O)C)SC 62a_200000210301_100010659108 [1,1,0,0,0,0|2,0,0]=4 7936 B12R1.300 CCc1cc(cc(c1O)C)S[13CH3] 62a_200025704644_100010659108 [1,1,0,0,0,0|2,0,0]=4 7937 B12R1.300 CNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_200000210301 [1,1,0,0,0,0|2,0,0]=4 7938 B12R1.300 CNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_200000210301 [1,1,0,0,0,0|2,0,0]=4 7939 B12R1.300 CNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_200000210301 [1,1,0,0,0,0|2,0,0]=4 7940 B12R1.300 CNc1cc(cc(c1O)Br)OC 34a_200010008348_200000210301 [1,1,0,0,0,0|2,0,0]=4 7941 B12R1.300 COc1cc(c(c(c1)N[13CH3])O)Br 34a_200010008348_200025704644 [1,1,0,0,0,0|2,0,0]=4 7942 B12R1.300 COc1cc(c(c(c1)OC)O)F 271570a_203496583355_200009812871 [1,1,0,0,0,0|1,0,0]=3 7943 B12R1.300 COc1cc(c(c(c1)SC)O)N 62a_200000210301_200010008348 [1,1,0,0,0,0|1,1,0]=4 7944 B12R1.300 COc1cc(c(c(c1)S[13CH3])O)N 62a_200025704644_200010008348 [1,1,0,0,0,0|1,1,0]=4 7945 B12R1.300 COc1cc(cc(c1Cl)Br)N[13CH3] 2230a_100010131419_200025704644 [1,1,0,0,0,0|2,0,0]=4 7946 B12R1.300 COc1cc(cc(c1Cl)Br)N[13CH3] 34a_100010131419_200025704644 [1,1,0,0,0,0|2,0,0]=4 7947 B12R1.300 COc1cc(cc(c1Cl)Br)N[13CH3] 7a_100010131419_200025704644 [1,1,0,0,0,0|2,0,0]=4 7948 B12R1.300 COc1cc(cc(c1F)C)SC 62a_100010271686_200000210301 [1,1,0,0,0,0|2,0,0]=4 7949 B12R1.300 COc1cc(cc(c1F)C)SC 62a_200000210301_100010271686 [1,1,0,0,0,0|2,0,0]=4 7950 B12R1.300 COc1cc(cc(c1F)C)S[13CH3] 62a_100010271686_200025704644 [1,1,0,0,0,0|2,0,0]=4 7951 B12R1.300 COc1cc(cc(c1F)C)S[13CH3] 62a_200025704644_100010271686 [1,1,0,0,0,0|2,0,0]=4 7952 B12R1.300 COc1cc(cc(c1F)F)SC 62a_100011218012_200000210301 [1,1,0,0,0,0|2,0,0]=4 7953 B12R1.300 COc1cc(cc(c1F)F)SC 62a_200000210301_100011218012 [1,1,0,0,0,0|2,0,0]=4 7954 B12R1.300 COc1cc(cc(c1F)F)S[13CH3] 62a_100011218012_200025704644 [1,1,0,0,0,0|2,0,0]=4 7955 B12R1.300 COc1cc(cc(c1F)F)S[13CH3] 62a_200025704644_100011218012 [1,1,0,0,0,0|2,0,0]=4 7956 B12R1.300 COc1cc(cc(c1F)O)SC 62a_200000210301_200015524394 [1,1,0,0,0,0|2,0,0]=4 7957 B12R1.300 COc1cc(cc(c1F)O)SC 62a_200015524394_200000210301 [1,1,0,0,0,0|2,0,0]=4 7958 B12R1.300 COc1cc(cc(c1F)O)S[13CH3] 62a_200015524394_200025704644 [1,1,0,0,0,0|2,0,0]=4 7959 B12R1.300 COc1cc(cc(c1F)O)S[13CH3] 62a_200025704644_200015524394 [1,1,0,0,0,0|2,0,0]=4 7960 B12R1.300 COc1cc(cc(c1N)C)SC 62a_100000741850_200000210301 [1,1,0,0,0,0|2,0,0]=4 7961 B12R1.300 COc1cc(cc(c1N)C)SC 62a_200000210301_100000741850 [1,1,0,0,0,0|2,0,0]=4 7962 B12R1.300 COc1cc(cc(c1N)C)S[13CH3] 62a_100000741850_200025704644 [1,1,0,0,0,0|2,0,0]=4 7963 B12R1.300 COc1cc(cc(c1N)C)S[13CH3] 62a_200025704644_100000741850 [1,1,0,0,0,0|2,0,0]=4 7964 B12R1.300 COc1cc(cc(c1O)O)C#N 271570a_203496583355_100000188612 [1,1,0,0,0,0|1,0,1]=4 7965 B12R1.300 COc1cc(cc(c1O)O)C=O 271570a_203496583355_100000184534 [1,1,0,0,0,0|1,0,1]=4 7966 B12R1.300 COc1cc(cc(c1O)O)CO 271570a_203496583355_200000022573 [1,1,0,0,0,0|1,0,0]=3 7967 B12R1.300 COc1cc(cc(c1O)O)SC 62a_200000210301_200159242197 [1,1,0,0,0,0|1,0,0]=3 7968 B12R1.300 COc1cc(cc(c1O)O)S[13CH3] 62a_200025704644_200159242197 [1,1,0,0,0,0|1,0,0]=3 7969 B12R1.449 C=Cc1cc(c(cc1F)O)OC 271570a_100011290941_100010189133 [1,1,0,0,0,0|0,0,2]=4 7970 B12R1.449 CCc1cc(c(cc1Br)F)OC 34a_100011156610_200000210301 [1,1,0,0,0,0|1,0,0]=3 7971 B12R1.449 CCc1cc(c(cc1Br)F)OC 7a_100011156610_200000210301 [1,1,0,0,0,0|1,0,0]=3 7972 B12R1.449 CCc1cc(c(cc1Br)F)O[13CH3] 34a_100011156610_200025704644 [1,1,0,0,0,0|1,0,0]=3 7973 B12R1.449 CCc1cc(c(cc1Br)F)O[13CH3] 7a_100011156610_200025704644 [1,1,0,0,0,0|1,0,0]=3 7974 B12R1.449 CNc1cc(c(cc1Br)Br)OC 34a_100000718616_200000210301 [1,1,0,0,0,0|2,0,0]=4 7975 B12R1.449 CNc1cc(c(cc1Br)Br)OC 7a_100000718616_200000210301 [1,1,0,0,0,0|2,0,0]=4 7976 B12R1.449 CNc1cc(c(cc1Br)C)OC 34a_100010244135_200000210301 [1,1,0,0,0,0|2,0,0]=4 7977 B12R1.449 CNc1cc(c(cc1Br)C)OC 7a_100010244135_200000210301 [1,1,0,0,0,0|2,0,0]=4 7978 B12R1.449 CNc1cc(c(cc1Br)Cl)OC 34a_100013022580_200000210301 [1,1,0,0,0,0|2,0,0]=4 7979 B12R1.449 CNc1cc(c(cc1Br)Cl)OC 7a_100013022580_200000210301 [1,1,0,0,0,0|2,0,0]=4 7980 B12R1.449 CNc1cc(c(cc1Br)F)OC 34a_100010208193_200000210301 [1,1,0,0,0,0|2,0,0]=4 7981 B12R1.449 CNc1cc(c(cc1Br)F)OC 7a_100010208193_200000210301 [1,1,0,0,0,0|2,0,0]=4 7982 B12R1.449 CNc1cc(c(cc1C)Br)OC 34a_100010232211_200000210301 [1,1,0,0,0,0|2,0,0]=4 7983 B12R1.449 CNc1cc(c(cc1C)Br)OC 7a_100010232211_200000210301 [1,1,0,0,0,0|2,0,0]=4 7984 B12R1.449 CNc1cc(c(cc1C)Cl)OC 2230a_100009858536_200000210301 [1,1,0,0,0,0|2,0,0]=4 7985 B12R1.449 CNc1cc(c(cc1C)Cl)OC 34a_100009858536_200000210301 [1,1,0,0,0,0|2,0,0]=4 7986 B12R1.449 CNc1cc(c(cc1C)Cl)OC 7a_100009858536_200000210301 [1,1,0,0,0,0|2,0,0]=4 7987 B12R1.449 CNc1cc(c(cc1Cl)Br)OC 34a_100012361290_200000210301 [1,1,0,0,0,0|2,0,0]=4 7988 B12R1.449 CNc1cc(c(cc1Cl)Br)OC 7a_100012361290_200000210301 [1,1,0,0,0,0|2,0,0]=4 7989 B12R1.449 CNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_200000210301 [1,1,0,0,0,0|2,0,0]=4 7990 B12R1.449 CNc1cc(c(cc1Cl)F)OC 34a_100009958774_200000210301 [1,1,0,0,0,0|2,0,0]=4 7991 B12R1.449 CNc1cc(c(cc1Cl)F)OC 7a_100009958774_200000210301 [1,1,0,0,0,0|2,0,0]=4 7992 B12R1.449 CNc1cc(c(cc1F)Cl)OC 34a_100009872666_200000210301 [1,1,0,0,0,0|2,0,0]=4 7993 B12R1.449 CNc1cc(c(cc1F)Cl)OC 7a_100009872666_200000210301 [1,1,0,0,0,0|2,0,0]=4 7994 B12R1.449 COc1cc(c(cc1Br)Br)N[13CH3] 34a_100000718616_200025704644 [1,1,0,0,0,0|2,0,0]=4 7995 B12R1.449 COc1cc(c(cc1Br)Br)N[13CH3] 7a_100000718616_200025704644 [1,1,0,0,0,0|2,0,0]=4 7996 B12R1.449 COc1cc(c(cc1Br)Br)SC 62a_200000210301_200014006352 [1,1,0,0,0,0|2,0,0]=4 7997 B12R1.449 COc1cc(c(cc1Br)Br)SC 62a_200014006352_200000210301 [1,1,0,0,0,0|2,0,0]=4 7998 B12R1.449 COc1cc(c(cc1Br)Br)S[13CH3] 62a_200014006352_200025704644 [1,1,0,0,0,0|2,0,0]=4 7999 B12R1.449 COc1cc(c(cc1Br)Br)S[13CH3] 62a_200025704644_200014006352 [1,1,0,0,0,0|2,0,0]=4 8000 B12R1.449 COc1cc(c(cc1Br)C)N[13CH3] 34a_100010232211_200025704644 [1,1,0,0,0,0|2,0,0]=4 8001 B12R1.449 COc1cc(c(cc1Br)C)N[13CH3] 7a_100010232211_200025704644 [1,1,0,0,0,0|2,0,0]=4 8002 B12R1.449 COc1cc(c(cc1Br)Cl)N[13CH3] 34a_100012361290_200025704644 [1,1,0,0,0,0|2,0,0]=4 8003 B12R1.449 COc1cc(c(cc1Br)Cl)N[13CH3] 7a_100012361290_200025704644 [1,1,0,0,0,0|2,0,0]=4 8004 B12R1.449 COc1cc(c(cc1C)Br)N[13CH3] 34a_100010244135_200025704644 [1,1,0,0,0,0|2,0,0]=4 8005 B12R1.449 COc1cc(c(cc1C)Br)N[13CH3] 7a_100010244135_200025704644 [1,1,0,0,0,0|2,0,0]=4 8006 B12R1.449 COc1cc(c(cc1C)N)SC 62a_200000210301_200010584344 [1,1,0,0,0,0|2,0,0]=4 8007 B12R1.449 COc1cc(c(cc1C)N)SC 62a_200010584344_200000210301 [1,1,0,0,0,0|2,0,0]=4 8008 B12R1.449 COc1cc(c(cc1C)N)S[13CH3] 62a_200010584344_200025704644 [1,1,0,0,0,0|2,0,0]=4 8009 B12R1.449 COc1cc(c(cc1C)N)S[13CH3] 62a_200025704644_200010584344 [1,1,0,0,0,0|2,0,0]=4 8010 B12R1.449 COc1cc(c(cc1Cl)Br)N[13CH3] 34a_100013022580_200025704644 [1,1,0,0,0,0|2,0,0]=4 8011 B12R1.449 COc1cc(c(cc1Cl)Br)N[13CH3] 7a_100013022580_200025704644 [1,1,0,0,0,0|2,0,0]=4 8012 B12R1.449 COc1cc(c(cc1Cl)C)N[13CH3] 2230a_100009858536_200025704644 [1,1,0,0,0,0|2,0,0]=4 8013 B12R1.449 COc1cc(c(cc1Cl)C)N[13CH3] 34a_100009858536_200025704644 [1,1,0,0,0,0|2,0,0]=4 8014 B12R1.449 COc1cc(c(cc1Cl)C)N[13CH3] 7a_100009858536_200025704644 [1,1,0,0,0,0|2,0,0]=4 8015 B12R1.449 COc1cc(c(cc1Cl)Cl)N[13CH3] 34a_100011830341_200025704644 [1,1,0,0,0,0|2,0,0]=4 8016 B12R1.449 COc1cc(c(cc1Cl)F)N[13CH3] 34a_100009872666_200025704644 [1,1,0,0,0,0|2,0,0]=4 8017 B12R1.449 COc1cc(c(cc1Cl)F)N[13CH3] 7a_100009872666_200025704644 [1,1,0,0,0,0|2,0,0]=4 8018 B12R1.449 COc1cc(c(cc1Cl)F)SC 62a_100010739614_200000210301 [1,1,0,0,0,0|2,0,0]=4 8019 B12R1.449 COc1cc(c(cc1Cl)F)SC 62a_200000210301_100010739614 [1,1,0,0,0,0|2,0,0]=4 8020 B12R1.449 COc1cc(c(cc1Cl)F)S[13CH3] 62a_100010739614_200025704644 [1,1,0,0,0,0|2,0,0]=4 8021 B12R1.449 COc1cc(c(cc1Cl)F)S[13CH3] 62a_200025704644_100010739614 [1,1,0,0,0,0|2,0,0]=4 8022 B12R1.449 COc1cc(c(cc1F)Br)N[13CH3] 34a_100010208193_200025704644 [1,1,0,0,0,0|2,0,0]=4 8023 B12R1.449 COc1cc(c(cc1F)Br)N[13CH3] 7a_100010208193_200025704644 [1,1,0,0,0,0|2,0,0]=4 8024 B12R1.449 COc1cc(c(cc1F)C)SC 62a_100011009880_200000210301 [1,1,0,0,0,0|2,0,0]=4 8025 B12R1.449 COc1cc(c(cc1F)C)SC 62a_200000210301_100011009880 [1,1,0,0,0,0|2,0,0]=4 8026 B12R1.449 COc1cc(c(cc1F)C)S[13CH3] 62a_100011009880_200025704644 [1,1,0,0,0,0|2,0,0]=4 8027 B12R1.449 COc1cc(c(cc1F)C)S[13CH3] 62a_200025704644_100011009880 [1,1,0,0,0,0|2,0,0]=4 8028 B12R1.449 COc1cc(c(cc1F)Cl)N[13CH3] 34a_100009958774_200025704644 [1,1,0,0,0,0|2,0,0]=4 8029 B12R1.449 COc1cc(c(cc1F)Cl)N[13CH3] 7a_100009958774_200025704644 [1,1,0,0,0,0|2,0,0]=4 8030 B12R1.449 COc1cc(c(cc1F)F)SC 62a_200000210301_200015541288 [1,1,0,0,0,0|2,0,0]=4 8031 B12R1.449 COc1cc(c(cc1F)F)SC 62a_200015541288_200000210301 [1,1,0,0,0,0|2,0,0]=4 8032 B12R1.449 COc1cc(c(cc1F)F)S[13CH3] 62a_200015541288_200025704644 [1,1,0,0,0,0|2,0,0]=4 8033 B12R1.449 COc1cc(c(cc1F)F)S[13CH3] 62a_200025704644_200015541288 [1,1,0,0,0,0|2,0,0]=4 8034 B12R1.449 COc1cc(c(cc1F)N)SC 62a_100010365326_200000210301 [1,1,0,0,0,0|2,0,0]=4 8035 B12R1.449 COc1cc(c(cc1F)N)SC 62a_200000210301_100010365326 [1,1,0,0,0,0|2,0,0]=4 8036 B12R1.449 COc1cc(c(cc1F)N)S[13CH3] 62a_100010365326_200025704644 [1,1,0,0,0,0|2,0,0]=4 8037 B12R1.449 COc1cc(c(cc1F)N)S[13CH3] 62a_200025704644_100010365326 [1,1,0,0,0,0|2,0,0]=4 8038 B12R1.449 COc1cc(c(cc1N)C)SC 62a_100010141321_200000210301 [1,1,0,0,0,0|2,0,0]=4 8039 B12R1.449 COc1cc(c(cc1N)C)SC 62a_200000210301_100010141321 [1,1,0,0,0,0|2,0,0]=4 8040 B12R1.449 COc1cc(c(cc1N)C)S[13CH3] 62a_100010141321_200025704644 [1,1,0,0,0,0|2,0,0]=4 8041 B12R1.449 COc1cc(c(cc1N)C)S[13CH3] 62a_200025704644_100010141321 [1,1,0,0,0,0|2,0,0]=4 8042 B12R1.449 COc1cc(c(cc1N)F)SC 62a_100012766639_200000210301 [1,1,0,0,0,0|2,0,0]=4 8043 B12R1.449 COc1cc(c(cc1N)F)SC 62a_200000210301_100012766639 [1,1,0,0,0,0|2,0,0]=4 8044 B12R1.449 COc1cc(c(cc1N)F)S[13CH3] 62a_100012766639_200025704644 [1,1,0,0,0,0|2,0,0]=4 8045 B12R1.449 COc1cc(c(cc1N)F)S[13CH3] 62a_200025704644_100012766639 [1,1,0,0,0,0|2,0,0]=4 8046 B12R1.449 COc1cc(c(cc1O)F)C=O 271570a_203496583355_100000695681 [1,1,0,0,0,0|1,0,1]=4 8047 B12R1.449 COc1cc(c(cc1O)F)OC 271570a_203496583355_100010141368 [1,1,0,0,0,0|1,0,0]=3 8048 B12R1.449 COc1cc(c(cc1O)F)SC 62a_200000210301_100010189133 [1,1,0,0,0,0|1,0,0]=3 8049 B12R1.449 COc1cc(c(cc1O)F)S[13CH3] 62a_200025704644_100010189133 [1,1,0,0,0,0|1,0,0]=3 8050 B12R1.449 COc1cc(c(cc1O)O)C=O 271570a_203496583355_100000741691 [1,1,0,0,0,0|1,0,1]=4 8051 B12R1.449 COc1cc(c(cc1O)O)C=O 271570a_203496583355_100010762608 [1,1,0,0,0,0|1,0,1]=4 8052 B12R1.449 COc1nc(c(cc1C)O)OC 271570a_203496583355_100021123867 [1,1,0,0,0,0|2,0,0]=4 8053 B12R1.449 COc1nc(c(cc1O)Br)OC 271570a_203496583355_100025726379 [1,1,0,0,0,0|2,0,0]=4 8054 B12R1.453 C=C(C)c1cc(ccc1F)CC 271570a_100000694244_200010244628 [1,1,0,0,0,0|2,0,0]=4 8055 B12R1.453 C=C(C)c1cc(ccc1N)CC 271570a_100000694244_100012339725 [1,1,0,0,0,0|2,0,0]=4 8056 B12R1.453 C=C(C)c1cc(ccc1O)CC 271570a_100000694244_100012339963 [1,1,0,0,0,0|1,0,0]=3 8057 B12R1.453 C=C(C)c1cc(ccc1O)CO 271570a_100000694244_100011191544 [1,1,0,0,0,0|2,0,0]=4 8058 B12R1.453 C=C(C)c1cc(ccc1O)OC 271570a_100000694244_100000685887 [1,1,0,0,0,0|2,0,0]=4 8059 B12R1.453 CC(=O)c1cc(ccc1O)CO 1458a_200000045694_200000210301 [1,1,0,0,0,0|2,0,0]=4 8060 B12R1.453 CC(C)c1cc(ccc1O)S[13CH3] 62a_100000691460_200025704644 [1,1,0,0,0,0|2,0,0]=4 8061 B12R1.453 CC(C)c1cc(ccc1O)S[13CH3] 62a_200025704644_100000691460 [1,1,0,0,0,0|2,0,0]=4 8062 B12R1.453 CCc1ccc(c(c1)C(=O)C)O 1458a_200000748397_200000210301 [1,1,0,0,0,0|1,0,0]=3 8063 B12R1.453 CCc1ccc(c(c1)C(=O)[13CH3])O 1458a_200000748397_200025704644 [1,1,0,0,0,0|1,0,0]=3 8064 B12R1.453 COc1ccc(c(c1)C(=O)C)O 1458a_100000211986_200000210301 [1,1,0,0,0,0|2,0,0]=4 8065 B12R1.453 COc1ccc(c(c1)C(=O)C)O 271570a_203496583355_100011360761 [1,1,0,0,0,0|2,0,0]=4 8066 B12R1.453 COc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000211986_200025704644 [1,1,0,0,0,0|2,0,0]=4 8067 B12R1.453 COc1ccc(c(c1)[C@H](C)N)O 271570a_203496583355_200015425320 [1,1,0,0,0,0|2,0,0]=4 8068 B12R1.453 CSc1ccc(c(c1)C(C)C)O 62a_100000691460_200000210301 [1,1,0,0,0,0|2,0,0]=4 8069 B12R1.453 CSc1ccc(c(c1)C(C)C)O 62a_200000210301_100000691460 [1,1,0,0,0,0|2,0,0]=4 8070 B12R1.453 [13CH3]C(=O)c1cc(ccc1O)CO 1458a_200000045694_200025704644 [1,1,0,0,0,0|2,0,0]=4 8071 B12R1.654 CNc1ccc(c(c1F)OC)F 34a_100137314619_200000210301 [1,1,0,0,0,0|2,0,0]=4 8072 B12R1.654 COc1c(ccc(c1F)C#N)O 271570a_203496583355_200010764284 [1,1,0,0,0,0|1,0,1]=4 8073 B12R1.654 COc1c(ccc(c1F)C=O)O 271570a_203496583355_200010981996 [1,1,0,0,0,0|1,0,1]=4 8074 B12R1.654 COc1c(ccc(c1F)N[13CH3])F 34a_100137314619_200025704644 [1,1,0,0,0,0|2,0,0]=4 8075 B12R1.654 COc1c(ccc(c1F)O[13CH3])F 34a_100000062073_200025704644 [1,1,0,0,0,0|2,0,0]=4 8076 B12R1.654 COc1c(ccc(c1F)O[13CH3])F 7a_100000062073_200025704644 [1,1,0,0,0,0|2,0,0]=4 8077 B12R1.654 COc1c(ccc(c1F)SC)Cl 62a_200000210301_200135222481 [1,1,0,0,0,0|2,0,0]=4 8078 B12R1.654 COc1c(ccc(c1F)SC)Cl 62a_200135222481_200000210301 [1,1,0,0,0,0|2,0,0]=4 8079 B12R1.654 COc1c(ccc(c1F)SC)N 62a_100010734149_200000210301 [1,1,0,0,0,0|2,0,0]=4 8080 B12R1.654 COc1c(ccc(c1F)SC)N 62a_200000210301_100010734149 [1,1,0,0,0,0|2,0,0]=4 8081 B12R1.654 COc1c(ccc(c1F)S[13CH3])Cl 62a_200025704644_200135222481 [1,1,0,0,0,0|2,0,0]=4 8082 B12R1.654 COc1c(ccc(c1F)S[13CH3])Cl 62a_200135222481_200025704644 [1,1,0,0,0,0|2,0,0]=4 8083 B12R1.654 COc1c(ccc(c1F)S[13CH3])N 62a_100010734149_200025704644 [1,1,0,0,0,0|2,0,0]=4 8084 B12R1.654 COc1c(ccc(c1F)S[13CH3])N 62a_200025704644_100010734149 [1,1,0,0,0,0|2,0,0]=4 8085 B12R1.654 COc1ccc(c(c1Br)OC)Cl 34a_200020794976_200000210301 [1,1,0,0,0,0|2,0,0]=4 8086 B12R1.654 COc1ccc(c(c1Br)OC)Cl 7a_200020794976_200000210301 [1,1,0,0,0,0|2,0,0]=4 8087 B12R1.654 COc1ccc(c(c1Br)O[13CH3])Cl 34a_200020794976_200025704644 [1,1,0,0,0,0|2,0,0]=4 8088 B12R1.654 COc1ccc(c(c1Br)O[13CH3])Cl 7a_200020794976_200025704644 [1,1,0,0,0,0|2,0,0]=4 8089 B12R1.654 COc1ccc(c(c1C)OC)O 271570a_203496583355_100010234078 [1,1,0,0,0,0|1,0,0]=3 8090 B12R1.654 COc1ccc(c(c1Cl)OC)F 34a_200000061507_200000210301 [1,1,0,0,0,0|2,0,0]=4 8091 B12R1.654 COc1ccc(c(c1Cl)OC)F 7a_200000061507_200000210301 [1,1,0,0,0,0|2,0,0]=4 8092 B12R1.654 COc1ccc(c(c1Cl)O[13CH3])F 34a_200000061507_200025704644 [1,1,0,0,0,0|2,0,0]=4 8093 B12R1.654 COc1ccc(c(c1Cl)O[13CH3])F 7a_200000061507_200025704644 [1,1,0,0,0,0|2,0,0]=4 8094 B12R1.654 COc1ccc(c(c1F)OC)F 34a_100000062056_200000210301 [1,1,0,0,0,0|2,0,0]=4 8095 B12R1.654 COc1ccc(c(c1F)OC)F 34a_100000062073_200000210301 [1,1,0,0,0,0|2,0,0]=4 8096 B12R1.654 COc1ccc(c(c1F)OC)F 7a_100000062056_200000210301 [1,1,0,0,0,0|2,0,0]=4 8097 B12R1.654 COc1ccc(c(c1F)OC)F 7a_100000062073_200000210301 [1,1,0,0,0,0|2,0,0]=4 8098 B12R1.654 COc1ccc(c(c1F)OC)O 271570a_203496583355_200010341284 [1,1,0,0,0,0|1,0,0]=3 8099 B12R1.654 COc1ccc(c(c1F)O[13CH3])F 34a_100000062056_200025704644 [1,1,0,0,0,0|2,0,0]=4 8100 B12R1.654 COc1ccc(c(c1F)O[13CH3])F 7a_100000062056_200025704644 [1,1,0,0,0,0|2,0,0]=4 8101 B12R1.654 COc1ccc(c(c1F)SC)O 271570a_203496583355_200011099385 [1,1,0,0,0,0|1,1,0]=4 8102 B14R1.41 COc1cc(ccc1Br)C(=O)C(C)C 1458a_100011934951_100000210206 [0,2,0,0,0,0|1,0,1]=4 8103 B14R1.41 COc1cc(ccc1C)C(=O)C(C)C 1458a_100000212341_100000210206 [0,2,0,0,0,0|1,0,1]=4 8104 B14R1.41 COc1cc(ccc1Cl)C(=O)C(C)C 1458a_100000181799_100000210206 [0,2,0,0,0,0|1,0,1]=4 8105 B14R1.41 COc1cc(ccc1F)C(=O)C(C)C 1458a_100000757635_100000210206 [0,2,0,0,0,0|1,0,1]=4 8106 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 2230a_200012002703_100000210206 [0,2,0,0,0,0|2,0,0]=4 8107 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 269982a_200012002703_100000210206 [0,2,0,0,0,0|2,0,0]=4 8108 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 34a_200012002703_100000210206 [0,2,0,0,0,0|2,0,0]=4 8109 B14R1.41 COc1cc(ccc1F)N(C)C(C)C 38a_200012002703_100000210206 [0,2,0,0,0,0|2,0,0]=4 8110 B14R1.41 COc1cc(ccc1I)C(=O)C(C)C 1458a_100012356290_100000210206 [0,2,0,0,0,0|1,0,1]=4 8111 B14R1.41 COc1cc(ccc1O)C(=C(C)C)C 271570a_200000049429_100000694246 [0,2,0,0,0,0|0,0,2]=4 8112 B14R1.41 COc1cc(ccc1O)C(=O)C(C)C 1458a_100000687070_100000210206 [0,2,0,0,0,0|0,0,1]=3 8113 B14R1.41 COc1cc(ccc1O)C(=O)N(C)C 240690a_100102631434_100000687070 [0,2,0,0,0,0|1,0,1]=4 8114 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,2,0,0,0,0|0,0,1]=3 8115 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,2,0,0,0,0|0,0,1]=3 8116 B14R1.44 CN[C@H](CO)c1ccc(c(c1)OC)F 2230a_100138412295_200000210301 [0,2,0,0,0,0|2,0,0]=4 8117 B14R1.44 CN[C@H](CO)c1ccc(c(c1)OC)F 34a_100138412295_200000210301 [0,2,0,0,0,0|2,0,0]=4 8118 B14R1.44 COc1cc(ccc1F)[C@@H](CO)N[13CH3] 2230a_100138412295_200025704644 [0,2,0,0,0,0|2,0,0]=4 8119 B14R1.44 COc1cc(ccc1F)[C@@H](CO)N[13CH3] 34a_100138412295_200025704644 [0,2,0,0,0,0|2,0,0]=4 8120 B14R1.358 CCC(=O)c1cc(c(c(c1)OC)Cl)Br 1458a_100020639751_100000210202 [0,2,0,0,0,0|1,0,1]=4 8121 B14R1.358 CCC(=O)c1cc(c(c(c1)OC)F)F 1458a_100000081826_100000210202 [0,2,0,0,0,0|1,0,1]=4 8122 B14R1.358 CCC(=O)c1cc(c(c(c1)OC)O)Cl 1458a_100000209947_100000210202 [0,2,0,0,0,0|0,0,1]=3 8123 B14R1.358 CCC(=O)c1cc(c(c(c1)OC)O)O 1458a_100000061230_100000210202 [0,2,0,0,0,0|0,0,1]=3 8124 B14R1.358 CNC(=O)c1cc(c(c(c1)OC)O)Cl 240690a_100102657272_100000209947 [0,2,0,0,0,0|1,0,1]=4 8125 B14R1.358 COC(=O)c1cc(c(c(c1)OC)O)O 271570a_203496583355_200009811556 [0,2,0,0,0,0|1,0,1]=4 8126 B14R1.358 COc1cc(cc(c1O)Cl)C(=O)CF 1458a_100000209947_100015361967 [0,2,0,0,0,0|1,0,1]=4 8127 B14R1.358 COc1cc(cc(c1O)O)C(=O)CF 1458a_100000061230_100015361967 [0,2,0,0,0,0|1,0,1]=4 8128 B14R1.436 CCOc1cc(ccc1C)C(=O)CC 1458a_100000238212_100000210202 [0,2,0,0,0,0|1,0,1]=4 8129 B14R1.436 CCOc1cc(ccc1Cl)C(=O)CC 1458a_200010207389_100000210202 [0,2,0,0,0,0|1,0,1]=4 8130 B14R1.436 CCOc1cc(ccc1F)C(C)NC 269862a_106832991636_200009852100 [0,2,0,0,0,0|2,0,0]=4 8131 B14R1.436 CCOc1cc(ccc1O)C(=O)CC 1458a_100011260950_100000210202 [0,2,0,0,0,0|0,0,1]=3 8132 B14R1.436 CCOc1cc(ccc1O)C(=O)CF 1458a_100011260950_100015361967 [0,2,0,0,0,0|1,0,1]=4 8133 B14R1.436 CCOc1cc(ccc1O)C(=O)NC 240690a_100102657272_100011260950 [0,2,0,0,0,0|1,0,1]=4 8134 B14R1.436 COCc1cc(ccc1O)C(=O)OC 271570a_203496583355_200010890493 [0,2,0,0,0,0|1,0,1]=4 8135 B14R1.626 C#CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000184674 [0,2,0,0,0,0|0,0,2]=4 8136 B14R1.626 C=CCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210623 [0,2,0,0,0,0|0,0,2]=4 8137 B14R1.626 CCCC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_100000210303 [0,2,0,0,0,0|2,0,0]=4 8138 B14R1.626 CCCC(=O)c1ccc(c(c1)CC)Br 1458a_100010152358_100000210303 [0,2,0,0,0,0|2,0,0]=4 8139 B14R1.626 CCCC(=O)c1ccc(c(c1)CC)Cl 1458a_100000102533_100000210303 [0,2,0,0,0,0|2,0,0]=4 8140 B14R1.626 CCCC(=O)c1ccc(c(c1)CC)F 1458a_100009883079_100000210303 [0,2,0,0,0,0|2,0,0]=4 8141 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)Br 1458a_100011934951_100000210303 [0,2,0,0,0,0|1,0,0]=3 8142 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)C 1458a_100000212341_100000210303 [0,2,0,0,0,0|1,0,0]=3 8143 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)Cl 1458a_100000181799_100000210303 [0,2,0,0,0,0|1,0,0]=3 8144 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)F 1458a_100000757635_100000210303 [0,2,0,0,0,0|1,0,0]=3 8145 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)I 1458a_100012356290_100000210303 [0,2,0,0,0,0|1,0,0]=3 8146 B14R1.626 CCCC(=O)c1ccc(c(c1)OC)O 1458a_100000687070_100000210303 [0,2,0,0,0,0|0,0,0]=2 8147 B14R1.626 CCCN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000210303 [0,2,0,0,0,0|1,0,0]=3 8148 B14R1.626 CCCN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000210303 [0,2,0,0,0,0|1,0,0]=3 8149 B14R1.626 CCCN(C)c1ccc(c(c1)OC)F 34a_200012002703_100000210303 [0,2,0,0,0,0|1,0,0]=3 8150 B14R1.626 CCCN(C)c1ccc(c(c1)OC)F 38a_200012002703_100000210303 [0,2,0,0,0,0|1,0,0]=3 8151 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)Br 11a_100015525214_100011934951 [0,2,0,0,0,0|1,0,1]=4 8152 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)Br 240690a_100015525214_100011934951 [0,2,0,0,0,0|1,0,1]=4 8153 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)Br 527a_100015525214_100011934951 [0,2,0,0,0,0|1,0,1]=4 8154 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 11a_100015525214_100000212341 [0,2,0,0,0,0|1,0,1]=4 8155 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 240690a_100015525214_100000212341 [0,2,0,0,0,0|1,0,1]=4 8156 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)C 527a_100015525214_100000212341 [0,2,0,0,0,0|1,0,1]=4 8157 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)Cl 11a_100015525214_100000181799 [0,2,0,0,0,0|1,0,1]=4 8158 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)Cl 240690a_100015525214_100000181799 [0,2,0,0,0,0|1,0,1]=4 8159 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)Cl 527a_100015525214_100000181799 [0,2,0,0,0,0|1,0,1]=4 8160 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)F 11a_100015525214_100000757635 [0,2,0,0,0,0|1,0,1]=4 8161 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)F 240690a_100015525214_100000757635 [0,2,0,0,0,0|1,0,1]=4 8162 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)F 527a_100015525214_100000757635 [0,2,0,0,0,0|1,0,1]=4 8163 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)I 11a_100015525214_100012356290 [0,2,0,0,0,0|1,0,1]=4 8164 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)I 240690a_100015525214_100012356290 [0,2,0,0,0,0|1,0,1]=4 8165 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)I 527a_100015525214_100012356290 [0,2,0,0,0,0|1,0,1]=4 8166 B14R1.626 CCNC(=O)c1ccc(c(c1)OC)O 240690a_100015525214_100000687070 [0,2,0,0,0,0|0,0,1]=3 8167 B14R1.626 CCNC(C)c1ccc(c(c1)OC)Br 269862a_100015525214_100010110075 [0,2,0,0,0,0|1,0,0]=3 8168 B14R1.626 CCNC(C)c1ccc(c(c1)OC)C 269862a_100015525214_100012706825 [0,2,0,0,0,0|1,0,0]=3 8169 B14R1.626 CCNC(C)c1ccc(c(c1)OC)Cl 269862a_100015525214_100012002813 [0,2,0,0,0,0|1,0,0]=3 8170 B14R1.626 CCNC(C)c1ccc(c(c1)OC)F 269862a_100015525214_100000694624 [0,2,0,0,0,0|1,0,0]=3 8171 B14R1.626 CCN[C@@H](C)c1ccc(c(c1)OC)F 2230a_100025717271_100000210202 [0,2,0,0,0,0|1,0,0]=3 8172 B14R1.626 CCN[C@@H](C)c1ccc(c(c1)OC)F 34a_100025717271_100000210202 [0,2,0,0,0,0|1,0,0]=3 8173 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)Br 7a_100012355281_200000210301 [0,2,0,0,0,0|1,0,1]=4 8174 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F 34a_200009842343_200000210301 [0,2,0,0,0,0|1,0,1]=4 8175 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)F 7a_200009842343_200000210301 [0,2,0,0,0,0|1,0,1]=4 8176 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)N 7a_100000756704_200000210301 [0,2,0,0,0,0|1,0,1]=4 8177 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)O 271570a_203496583355_100010189661 [0,2,0,0,0,0|0,0,1]=3 8178 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])Br 7a_100012355281_200025704644 [0,2,0,0,0,0|1,0,1]=4 8179 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])F 34a_200009842343_200025704644 [0,2,0,0,0,0|1,0,1]=4 8180 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])F 7a_200009842343_200025704644 [0,2,0,0,0,0|1,0,1]=4 8181 B14R1.626 CCOC(=O)c1ccc(c(c1)O[13CH3])N 7a_100000756704_200025704644 [0,2,0,0,0,0|1,0,1]=4 8182 B14R1.626 CCOC(=O)c1ccc(c(c1)SC)O 62a_200000210301_100009812659 [0,2,0,0,0,0|0,1,1]=4 8183 B14R1.626 CCOC(=O)c1ccc(c(c1)S[13CH3])O 62a_200025704644_100009812659 [0,2,0,0,0,0|0,1,1]=4 8184 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)Br 2230a_106832991635_200010710740 [0,2,0,0,0,0|1,0,1]=4 8185 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)Br 34a_100102657272_200010710740 [0,2,0,0,0,0|1,0,1]=4 8186 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)F 2230a_106832991635_200012348595 [0,2,0,0,0,0|1,0,1]=4 8187 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)F 34a_100102657272_200012348595 [0,2,0,0,0,0|1,0,1]=4 8188 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)F 7a_106832991635_200012348595 [0,2,0,0,0,0|1,0,1]=4 8189 B14R1.626 CNCC(=O)c1ccc(c(c1)OC)O 7a_106832991635_100010206313 [0,2,0,0,0,0|0,0,1]=3 8190 B14R1.626 CNNC(=O)c1ccc(c(c1)OC)O 22a_100016993582_100000687070 [0,2,0,0,0,0|1,0,1]=4 8191 B14R1.626 COCC(=O)c1ccc(c(c1)OC)Br 34a_100138415774_200010710740 [0,2,0,0,0,0|1,0,1]=4 8192 B14R1.626 COCC(=O)c1ccc(c(c1)OC)F 34a_100138415774_200012348595 [0,2,0,0,0,0|1,0,1]=4 8193 B14R1.626 COCN(C)c1ccc(c(c1)OC)F 2230a_200012002703_100000766300 [0,2,0,0,0,0|2,0,0]=4 8194 B14R1.626 COCN(C)c1ccc(c(c1)OC)F 269982a_200012002703_100000766300 [0,2,0,0,0,0|2,0,0]=4 8195 B14R1.626 COC[C@@H](N)c1ccc(c(c1)OC)F 34a_100138412295_200000210301 [0,2,0,0,0,0|1,0,0]=3 8196 B14R1.626 COc1cc(ccc1Br)C(=O)CCF 1458a_100011934951_100011217306 [0,2,0,0,0,0|1,0,1]=4 8197 B14R1.626 COc1cc(ccc1Br)C(=O)CCO 1458a_100011934951_100000211926 [0,2,0,0,0,0|1,0,1]=4 8198 B14R1.626 COc1cc(ccc1Br)C(=O)CSC 62a_200010710740_200000210301 [0,2,0,0,0,0|1,0,1]=4 8199 B14R1.626 COc1cc(ccc1Br)C(=O)CS[13CH3] 62a_200010710740_200025704644 [0,2,0,0,0,0|1,0,1]=4 8200 B14R1.626 COc1cc(ccc1C)C(=O)CCF 1458a_100000212341_100011217306 [0,2,0,0,0,0|1,0,1]=4 8201 B14R1.626 COc1cc(ccc1C)C(=O)CCO 1458a_100000212341_100000211926 [0,2,0,0,0,0|1,0,1]=4 8202 B14R1.626 COc1cc(ccc1Cl)C(=O)CCF 1458a_100000181799_100011217306 [0,2,0,0,0,0|1,0,1]=4 8203 B14R1.626 COc1cc(ccc1Cl)C(=O)CCO 1458a_100000181799_100000211926 [0,2,0,0,0,0|1,0,1]=4 8204 B14R1.626 COc1cc(ccc1F)C(=O)CCF 1458a_100000757635_100011217306 [0,2,0,0,0,0|1,0,1]=4 8205 B14R1.626 COc1cc(ccc1F)C(=O)CCO 1458a_100000757635_100000211926 [0,2,0,0,0,0|1,0,1]=4 8206 B14R1.626 COc1cc(ccc1F)C(=O)CSC 62a_200000210301_200012348595 [0,2,0,0,0,0|1,0,1]=4 8207 B14R1.626 COc1cc(ccc1F)C(=O)CSC 62a_200012348595_200000210301 [0,2,0,0,0,0|1,0,1]=4 8208 B14R1.626 COc1cc(ccc1F)C(=O)CS[13CH3] 62a_200012348595_200025704644 [0,2,0,0,0,0|1,0,1]=4 8209 B14R1.626 COc1cc(ccc1F)C(=O)CS[13CH3] 62a_200025704644_200012348595 [0,2,0,0,0,0|1,0,1]=4 8210 B14R1.626 COc1cc(ccc1F)N(C)CCF 2230a_200012002703_100011217306 [0,2,0,0,0,0|2,0,0]=4 8211 B14R1.626 COc1cc(ccc1F)N(C)CCF 269982a_200012002703_100011217306 [0,2,0,0,0,0|2,0,0]=4 8212 B14R1.626 COc1cc(ccc1F)N(C)CCF 34a_200012002703_100011217306 [0,2,0,0,0,0|2,0,0]=4 8213 B14R1.626 COc1cc(ccc1F)N(C)CCF 38a_200012002703_100011217306 [0,2,0,0,0,0|2,0,0]=4 8214 B14R1.626 COc1cc(ccc1F)N(C)CCO 2230a_200012002703_100000211926 [0,2,0,0,0,0|2,0,0]=4 8215 B14R1.626 COc1cc(ccc1F)N(C)CCO 269982a_200012002703_100000211926 [0,2,0,0,0,0|2,0,0]=4 8216 B14R1.626 COc1cc(ccc1F)N(C)CCO 34a_200012002703_100000211926 [0,2,0,0,0,0|2,0,0]=4 8217 B14R1.626 COc1cc(ccc1F)N(C)CCO 38a_200012002703_100000211926 [0,2,0,0,0,0|2,0,0]=4 8218 B14R1.626 COc1cc(ccc1F)N(C)CSC 2230a_200012002703_100011218213 [0,2,0,0,0,0|2,0,0]=4 8219 B14R1.626 COc1cc(ccc1F)N(C)CSC 269982a_200012002703_100011218213 [0,2,0,0,0,0|2,0,0]=4 8220 B14R1.626 COc1cc(ccc1F)N(C)CSC 34a_200012002703_100011218213 [0,2,0,0,0,0|2,0,0]=4 8221 B14R1.626 COc1cc(ccc1F)[C@H](C)NCF 34a_100025717271_100015361967 [0,2,0,0,0,0|2,0,0]=4 8222 B14R1.626 COc1cc(ccc1F)[C@H](N)CO[13CH3] 34a_100138412295_200025704644 [0,2,0,0,0,0|1,0,0]=3 8223 B14R1.626 COc1cc(ccc1I)C(=O)CCF 1458a_100012356290_100011217306 [0,2,0,0,0,0|1,0,1]=4 8224 B14R1.626 COc1cc(ccc1I)C(=O)CCO 1458a_100012356290_100000211926 [0,2,0,0,0,0|1,0,1]=4 8225 B14R1.626 COc1cc(ccc1O)C(=O)CC#N 1458a_100000687070_100011214920 [0,2,0,0,0,0|0,0,2]=4 8226 B14R1.626 COc1cc(ccc1O)C(=O)CCF 1458a_100000687070_100011217306 [0,2,0,0,0,0|0,0,1]=3 8227 B14R1.626 COc1cc(ccc1O)C(=O)CCO 1458a_100000687070_100000211926 [0,2,0,0,0,0|0,0,1]=3 8228 B14R1.626 COc1cc(ccc1O)C(=O)CSC 62a_100010206313_200000210301 [0,2,0,0,0,0|0,0,1]=3 8229 B14R1.626 COc1cc(ccc1O)C(=O)CS[13CH3] 62a_100010206313_200025704644 [0,2,0,0,0,0|0,0,1]=3 8230 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)C#N 1458a_100009879710_100000210202 [0,2,0,0,0,0|1,0,1]=4 8231 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 1458a_100000211223_100000210202 [0,2,0,0,0,0|0,0,1]=3 8232 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 34a_100000012293_200000210301 [0,2,0,0,0,0|0,0,1]=3 8233 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)OC 7a_100000012293_200000210301 [0,2,0,0,0,0|0,0,1]=3 8234 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_100000012293_200025704644 [0,2,0,0,0,0|0,0,1]=3 8235 B14R1.1864 CCC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000012293_200025704644 [0,2,0,0,0,0|0,0,1]=3 8236 B14R1.1864 CCC(O)c1ccc(c(c1)OC)OC 34a_200000015950_200000210301 [0,2,0,0,0,0|0,0,0]=2 8237 B14R1.1864 CCC(O)c1ccc(c(c1)OC)OC 7a_200000015950_200000210301 [0,2,0,0,0,0|0,0,0]=2 8238 B14R1.1864 CCC(O)c1ccc(c(c1)OC)O[13CH3] 34a_200000015950_200025704644 [0,2,0,0,0,0|0,0,0]=2 8239 B14R1.1864 CCC(O)c1ccc(c(c1)OC)O[13CH3] 7a_200000015950_200025704644 [0,2,0,0,0,0|0,0,0]=2 8240 B14R1.1864 CCN(C)c1ccc(c(c1)OC)OC 2230a_100000221037_200000210301 [0,2,0,0,0,0|1,0,0]=3 8241 B14R1.1864 CCN(C)c1ccc(c(c1)OC)OC 269982a_100000221037_200000210301 [0,2,0,0,0,0|1,0,0]=3 8242 B14R1.1864 CCN(C)c1ccc(c(c1)OC)OC 34a_100000221037_200000210301 [0,2,0,0,0,0|1,0,0]=3 8243 B14R1.1864 CCN([13CH3])c1ccc(c(c1)OC)OC 2230a_100000221037_200025704644 [0,2,0,0,0,0|1,0,0]=3 8244 B14R1.1864 CCN([13CH3])c1ccc(c(c1)OC)OC 269982a_100000221037_200025704644 [0,2,0,0,0,0|1,0,0]=3 8245 B14R1.1864 CCN([13CH3])c1ccc(c(c1)OC)OC 34a_100000221037_200025704644 [0,2,0,0,0,0|1,0,0]=3 8246 B14R1.1864 CCc1cc(ccc1CO)C(C)NC 269862a_106832991636_100009829543 [0,2,0,0,0,0|2,0,0]=4 8247 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 11a_106832991635_100000211223 [0,2,0,0,0,0|1,0,1]=4 8248 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 1626a_100102657272_100000211223 [0,2,0,0,0,0|1,0,1]=4 8249 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 240690a_100102657272_100000211223 [0,2,0,0,0,0|1,0,1]=4 8250 B14R1.1864 CNC(=O)c1ccc(c(c1)OC)OC 527a_100102657272_100000211223 [0,2,0,0,0,0|1,0,1]=4 8251 B14R1.1864 CNC(C)c1ccc(c(c1)OC)OC 269862a_106832991636_100000171757 [0,2,0,0,0,0|1,0,0]=3 8252 B14R1.1864 CN[C@H](C)c1ccc(c(c1)OC)OC 2230a_100025717294_200000210301 [0,2,0,0,0,0|1,0,0]=3 8253 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 34a_100000212147_200000210301 [0,2,0,0,0,0|1,0,1]=4 8254 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 34a_100011215032_200000210301 [0,2,0,0,0,0|1,0,1]=4 8255 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 7a_100000212147_200000210301 [0,2,0,0,0,0|1,0,1]=4 8256 B14R1.1864 COC(=O)c1ccc(c(c1)OC)OC 7a_100011215032_200000210301 [0,2,0,0,0,0|1,0,1]=4 8257 B14R1.1864 COC(=O)c1ccc(c(c1)OC)O[13CH3] 34a_100000212147_200025704644 [0,2,0,0,0,0|1,0,1]=4 8258 B14R1.1864 COC(=O)c1ccc(c(c1)OC)O[13CH3] 7a_100000212147_200025704644 [0,2,0,0,0,0|1,0,1]=4 8259 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])OC 34a_100011215032_200025704644 [0,2,0,0,0,0|1,0,1]=4 8260 B14R1.1864 COC(=O)c1ccc(c(c1)O[13CH3])OC 7a_100011215032_200025704644 [0,2,0,0,0,0|1,0,1]=4 8261 B14R1.1864 COc1ccc(cc1OC)C(=O)CF 1458a_100000211223_100015361967 [0,2,0,0,0,0|1,0,1]=4 8262 B14R1.1864 COc1ccc(cc1OC)C(C)OC 34a_100000246476_200000210301 [0,2,0,0,0,0|1,0,0]=3 8263 B14R1.1864 COc1ccc(cc1OC)C(C)OC 7a_100000246476_200000210301 [0,2,0,0,0,0|1,0,0]=3 8264 B14R1.1864 COc1ccc(cc1OC)C(C)O[13CH3] 34a_100000246476_200025704644 [0,2,0,0,0,0|1,0,0]=3 8265 B14R1.1864 COc1ccc(cc1OC)C(C)O[13CH3] 7a_100000246476_200025704644 [0,2,0,0,0,0|1,0,0]=3 8266 B14R1.1864 COc1ccc(cc1OC)[C@@H](C)N[13CH3] 2230a_100025717294_200025704644 [0,2,0,0,0,0|1,0,0]=3 8267 B14R1.2283 CCC(=O)c1cc(c(cc1Br)C)OC 1458a_100010289115_100000210202 [0,2,0,0,0,0|1,0,1]=4 8268 B14R1.2283 CCC(=O)c1cc(c(cc1Br)F)OC 1458a_100010174800_100000210202 [0,2,0,0,0,0|1,0,1]=4 8269 B14R1.2283 CCN(C)c1cc(c(cc1Cl)Cl)OC 269982a_200010239562_100000204670 [0,2,0,0,0,0|2,0,0]=4 8270 B14R1.2283 CCN(C)c1cc(c(cc1Cl)Cl)OC 34a_200010239562_100000210202 [0,2,0,0,0,0|2,0,0]=4 8271 B14R1.2283 COC(=O)c1cc(c(cc1N)O)OC 271570a_203496583355_100014686525 [0,2,0,0,0,0|1,0,1]=4 8272 B14R1.3413 CCC(C)(C)c1ccc(c(c1)NC)O 2230a_100011217233_200000210301 [0,2,0,0,0,0|1,0,0]=3 8273 B14R1.3413 CCC(C)(C)c1ccc(c(c1)NC)O 7a_100011217233_200000210301 [0,2,0,0,0,0|1,0,0]=3 8274 B14R1.3413 CCC(C)(C)c1ccc(c(c1)N[13CH3])O 2230a_100011217233_200025704644 [0,2,0,0,0,0|1,0,0]=3 8275 B14R1.3413 CCC(C)(C)c1ccc(c(c1)N[13CH3])O 7a_100011217233_200025704644 [0,2,0,0,0,0|1,0,0]=3 8276 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)NC)O 34a_100000210498_200000210301 [0,2,0,0,0,0|2,0,0]=4 8277 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)NC)O 7a_100000210498_200000210301 [0,2,0,0,0,0|2,0,0]=4 8278 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)N[13CH3])O 34a_100000210498_200025704644 [0,2,0,0,0,0|2,0,0]=4 8279 B14R1.3413 CCS(=O)(=O)c1ccc(c(c1)N[13CH3])O 7a_100000210498_200025704644 [0,2,0,0,0,0|2,0,0]=4 8280 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)Br 1458a_100009816242_100000210202 [0,2,0,0,0,0|1,0,1]=4 8281 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)Cl 1458a_100010116254_100000210202 [0,2,0,0,0,0|1,0,1]=4 8282 B14R1.4114 CCC(=O)c1ccc(c(c1F)OC)F 1458a_100000061937_100000210202 [0,2,0,0,0,0|1,0,1]=4 8283 B14R1.4114 CNC(C)c1ccc(c(c1F)OC)F 269862a_106832991636_100000061938 [0,2,0,0,0,0|2,0,0]=4 8284 B14R1.343 CCc1cc(cc(c1O)C)SC(C)C 62a_100000210206_100010659108 [0,2,0,0,0,0|2,0,0]=4 8285 B14R1.343 COc1cc(cc(c1Cl)Br)NC(C)C 2230a_100010131419_100000210206 [0,2,0,0,0,0|2,0,0]=4 8286 B14R1.343 COc1cc(cc(c1Cl)Br)NC(C)C 34a_100010131419_100000210206 [0,2,0,0,0,0|2,0,0]=4 8287 B14R1.343 COc1cc(cc(c1Cl)Br)NC(C)C 7a_100010131419_100000210206 [0,2,0,0,0,0|2,0,0]=4 8288 B14R1.343 COc1cc(cc(c1F)C)SC(C)C 62a_100000210206_100010271686 [0,2,0,0,0,0|2,0,0]=4 8289 B14R1.343 COc1cc(cc(c1F)C)SC(C)C 62a_100010271686_100000210206 [0,2,0,0,0,0|2,0,0]=4 8290 B14R1.343 COc1cc(cc(c1F)F)CN(C)C 270004a_100102631434_100000050682 [0,2,0,0,0,0|2,0,0]=4 8291 B14R1.343 COc1cc(cc(c1F)F)SC(C)C 62a_100000210206_100011218012 [0,2,0,0,0,0|2,0,0]=4 8292 B14R1.343 COc1cc(cc(c1F)F)SC(C)C 62a_100011218012_100000210206 [0,2,0,0,0,0|2,0,0]=4 8293 B14R1.343 COc1cc(cc(c1F)O)SC(C)C 62a_100000210206_200015524394 [0,2,0,0,0,0|2,0,0]=4 8294 B14R1.343 COc1cc(cc(c1F)O)SC(C)C 62a_200015524394_100000210206 [0,2,0,0,0,0|2,0,0]=4 8295 B14R1.343 COc1cc(cc(c1N)C)SC(C)C 62a_100000210206_100000741850 [0,2,0,0,0,0|2,0,0]=4 8296 B14R1.343 COc1cc(cc(c1N)C)SC(C)C 62a_100000741850_100000210206 [0,2,0,0,0,0|2,0,0]=4 8297 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)C 1458a_100009814412_200000210301 [0,2,0,0,0,0|0,0,1]=3 8298 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)[13CH3] 1458a_100009814412_200025704644 [0,2,0,0,0,0|0,0,1]=3 8299 B14R1.343 COc1cc(cc(c1O)O)SC(C)C 62a_100000210206_200159242197 [0,2,0,0,0,0|1,0,0]=3 8300 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100010141077_100015361967 [0,2,0,0,0,0|0,1,1]=4 8301 B14R1.439 CC(=O)Cc1ccc(c(c1)SCF)O 62a_100015361967_100010141077 [0,2,0,0,0,0|0,1,1]=4 8302 B14R1.439 CC=Cc1cc(ccc1O)CC(=O)C 271570a_100016259895_100010141077 [0,2,0,0,0,0|1,0,1]=4 8303 B14R1.439 CCOc1cc(ccc1Br)CN(C)C 270004a_100102631434_200010381951 [0,2,0,0,0,0|2,0,0]=4 8304 B14R1.439 CCOc1cc(ccc1Br)NC(C)C 2230a_200016990551_100000210206 [0,2,0,0,0,0|2,0,0]=4 8305 B14R1.439 CCOc1cc(ccc1Br)NC(C)C 34a_200016990551_100000210206 [0,2,0,0,0,0|2,0,0]=4 8306 B14R1.439 CCOc1cc(ccc1Br)NC(C)C 7a_200016990551_100000210206 [0,2,0,0,0,0|2,0,0]=4 8307 B14R1.439 CCOc1cc(ccc1C)SC(C)C 62a_100000210206_100012361169 [0,2,0,0,0,0|2,0,0]=4 8308 B14R1.439 CCOc1cc(ccc1C)SC(C)C 62a_100012361169_100000210206 [0,2,0,0,0,0|2,0,0]=4 8309 B14R1.439 CCOc1cc(ccc1Cl)NC(C)C 2230a_100011964961_100000210206 [0,2,0,0,0,0|2,0,0]=4 8310 B14R1.439 CCOc1cc(ccc1Cl)NC(C)C 34a_100011964961_100000210206 [0,2,0,0,0,0|2,0,0]=4 8311 B14R1.439 CCOc1cc(ccc1F)CN(C)C 270004a_100102631434_200000106648 [0,2,0,0,0,0|2,0,0]=4 8312 B14R1.439 CCOc1cc(ccc1F)SC(C)C 62a_100000210206_200012344967 [0,2,0,0,0,0|2,0,0]=4 8313 B14R1.439 CCOc1cc(ccc1F)SC(C)C 62a_200012344967_100000210206 [0,2,0,0,0,0|2,0,0]=4 8314 B14R1.439 CCOc1cc(ccc1N)SC(C)C 62a_100000688918_100000210206 [0,2,0,0,0,0|2,0,0]=4 8315 B14R1.439 CCOc1cc(ccc1O)CC(=O)C 1458a_200000048972_200000210301 [0,2,0,0,0,0|0,0,1]=3 8316 B14R1.439 CCOc1cc(ccc1O)CC(=O)[13CH3] 1458a_200000048972_200025704644 [0,2,0,0,0,0|0,0,1]=3 8317 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100000210202_100010141077 [0,2,0,0,0,0|0,1,1]=4 8318 B14R1.439 CCSc1cc(ccc1O)CC(=O)C 62a_100010141077_100000210202 [0,2,0,0,0,0|0,1,1]=4 8319 B14R1.439 CNCc1cc(ccc1O)SC(C)C 62a_100000210206_100011602694 [0,2,0,0,0,0|2,0,0]=4 8320 B14R1.439 CNCc1cc(ccc1O)SC(C)C 62a_100011602694_100000210206 [0,2,0,0,0,0|2,0,0]=4 8321 B14R1.439 COCc1cc(ccc1Br)SC(C)C 62a_100000210206_202125822959 [0,2,0,0,0,0|2,0,0]=4 8322 B14R1.439 COCc1cc(ccc1Br)SC(C)C 62a_202125822959_100000210206 [0,2,0,0,0,0|2,0,0]=4 8323 B14R1.439 COCc1cc(ccc1F)SC(C)C 62a_100000210206_100010140362 [0,2,0,0,0,0|2,0,0]=4 8324 B14R1.439 COCc1cc(ccc1F)SC(C)C 62a_100010140362_100000210206 [0,2,0,0,0,0|2,0,0]=4 8325 B14R1.705 C=C(C)c1cc(ccc1O)CC(=O)C 271570a_100000694244_100010141077 [0,2,0,0,0,0|1,0,1]=4 8326 B14R1.705 CC(C)Sc1ccc(c(c1)C(C)C)O 62a_100000210206_100000691460 [0,2,0,0,0,0|2,0,0]=4 8327 B14R1.705 CC(C)Sc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210206 [0,2,0,0,0,0|2,0,0]=4 8328 B14R1.881 COc1cc(c(cc1Br)Br)CN(C)C 270004a_100102631434_100010996155 [0,2,0,0,0,0|2,0,0]=4 8329 B14R1.881 COc1cc(c(cc1Br)Br)NC(C)C 34a_100000718616_100000210206 [0,2,0,0,0,0|2,0,0]=4 8330 B14R1.881 COc1cc(c(cc1Br)Br)NC(C)C 7a_100000718616_100000210206 [0,2,0,0,0,0|2,0,0]=4 8331 B14R1.881 COc1cc(c(cc1Br)Br)SC(C)C 62a_100000210206_200014006352 [0,2,0,0,0,0|2,0,0]=4 8332 B14R1.881 COc1cc(c(cc1Br)Br)SC(C)C 62a_200014006352_100000210206 [0,2,0,0,0,0|2,0,0]=4 8333 B14R1.881 COc1cc(c(cc1Br)C)NC(C)C 34a_100010232211_100000210206 [0,2,0,0,0,0|2,0,0]=4 8334 B14R1.881 COc1cc(c(cc1Br)C)NC(C)C 7a_100010232211_100000210206 [0,2,0,0,0,0|2,0,0]=4 8335 B14R1.881 COc1cc(c(cc1Br)Cl)NC(C)C 34a_100012361290_100000210206 [0,2,0,0,0,0|2,0,0]=4 8336 B14R1.881 COc1cc(c(cc1Br)Cl)NC(C)C 7a_100012361290_100000210206 [0,2,0,0,0,0|2,0,0]=4 8337 B14R1.881 COc1cc(c(cc1Br)F)CN(C)C 270004a_100102631434_100000695681 [0,2,0,0,0,0|2,0,0]=4 8338 B14R1.881 COc1cc(c(cc1C)Br)NC(C)C 34a_100010244135_100000210206 [0,2,0,0,0,0|2,0,0]=4 8339 B14R1.881 COc1cc(c(cc1C)Br)NC(C)C 7a_100010244135_100000210206 [0,2,0,0,0,0|2,0,0]=4 8340 B14R1.881 COc1cc(c(cc1C)N)SC(C)C 62a_100000210206_200010584344 [0,2,0,0,0,0|2,0,0]=4 8341 B14R1.881 COc1cc(c(cc1C)N)SC(C)C 62a_200010584344_100000210206 [0,2,0,0,0,0|2,0,0]=4 8342 B14R1.881 COc1cc(c(cc1Cl)Br)NC(C)C 34a_100013022580_100000210206 [0,2,0,0,0,0|2,0,0]=4 8343 B14R1.881 COc1cc(c(cc1Cl)Br)NC(C)C 7a_100013022580_100000210206 [0,2,0,0,0,0|2,0,0]=4 8344 B14R1.881 COc1cc(c(cc1Cl)C)NC(C)C 2230a_100009858536_100000210206 [0,2,0,0,0,0|2,0,0]=4 8345 B14R1.881 COc1cc(c(cc1Cl)C)NC(C)C 34a_100009858536_100000210206 [0,2,0,0,0,0|2,0,0]=4 8346 B14R1.881 COc1cc(c(cc1Cl)C)NC(C)C 7a_100009858536_100000210206 [0,2,0,0,0,0|2,0,0]=4 8347 B14R1.881 COc1cc(c(cc1Cl)Cl)NC(C)C 34a_100011830341_100000210206 [0,2,0,0,0,0|2,0,0]=4 8348 B14R1.881 COc1cc(c(cc1Cl)F)CN(C)C 270004a_100102631434_100000050388 [0,2,0,0,0,0|2,0,0]=4 8349 B14R1.881 COc1cc(c(cc1Cl)F)NC(C)C 34a_100009872666_100000210206 [0,2,0,0,0,0|2,0,0]=4 8350 B14R1.881 COc1cc(c(cc1Cl)F)NC(C)C 7a_100009872666_100000210206 [0,2,0,0,0,0|2,0,0]=4 8351 B14R1.881 COc1cc(c(cc1Cl)F)SC(C)C 62a_100000210206_100010739614 [0,2,0,0,0,0|2,0,0]=4 8352 B14R1.881 COc1cc(c(cc1Cl)F)SC(C)C 62a_100010739614_100000210206 [0,2,0,0,0,0|2,0,0]=4 8353 B14R1.881 COc1cc(c(cc1F)Br)CN(C)C 270004a_100102631434_100010366953 [0,2,0,0,0,0|2,0,0]=4 8354 B14R1.881 COc1cc(c(cc1F)Br)NC(C)C 34a_100010208193_100000210206 [0,2,0,0,0,0|2,0,0]=4 8355 B14R1.881 COc1cc(c(cc1F)Br)NC(C)C 7a_100010208193_100000210206 [0,2,0,0,0,0|2,0,0]=4 8356 B14R1.881 COc1cc(c(cc1F)C)SC(C)C 62a_100000210206_100011009880 [0,2,0,0,0,0|2,0,0]=4 8357 B14R1.881 COc1cc(c(cc1F)C)SC(C)C 62a_100011009880_100000210206 [0,2,0,0,0,0|2,0,0]=4 8358 B14R1.881 COc1cc(c(cc1F)Cl)NC(C)C 34a_100009958774_100000210206 [0,2,0,0,0,0|2,0,0]=4 8359 B14R1.881 COc1cc(c(cc1F)Cl)NC(C)C 7a_100009958774_100000210206 [0,2,0,0,0,0|2,0,0]=4 8360 B14R1.881 COc1cc(c(cc1F)F)CN(C)C 270004a_100102631434_100010630602 [0,2,0,0,0,0|2,0,0]=4 8361 B14R1.881 COc1cc(c(cc1F)F)SC(C)C 62a_100000210206_200015541288 [0,2,0,0,0,0|2,0,0]=4 8362 B14R1.881 COc1cc(c(cc1F)F)SC(C)C 62a_200015541288_100000210206 [0,2,0,0,0,0|2,0,0]=4 8363 B14R1.881 COc1cc(c(cc1F)N)SC(C)C 62a_100000210206_100010365326 [0,2,0,0,0,0|2,0,0]=4 8364 B14R1.881 COc1cc(c(cc1F)N)SC(C)C 62a_100010365326_100000210206 [0,2,0,0,0,0|2,0,0]=4 8365 B14R1.881 COc1cc(c(cc1N)C)SC(C)C 62a_100000210206_100010141321 [0,2,0,0,0,0|2,0,0]=4 8366 B14R1.881 COc1cc(c(cc1N)C)SC(C)C 62a_100010141321_100000210206 [0,2,0,0,0,0|2,0,0]=4 8367 B14R1.881 COc1cc(c(cc1N)F)SC(C)C 62a_100000210206_100012766639 [0,2,0,0,0,0|2,0,0]=4 8368 B14R1.881 COc1cc(c(cc1N)F)SC(C)C 62a_100012766639_100000210206 [0,2,0,0,0,0|2,0,0]=4 8369 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)C 1458a_100009814189_200000210301 [0,2,0,0,0,0|0,0,1]=3 8370 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)[13CH3] 1458a_100009814189_200025704644 [0,2,0,0,0,0|0,0,1]=3 8371 B14R1.881 COc1cc(c(cc1O)F)C=C(C)C 271570a_100102525489_100010189133 [0,2,0,0,0,0|0,0,2]=4 8372 B14R1.881 COc1cc(c(cc1O)F)SC(C)C 62a_100000210206_100010189133 [0,2,0,0,0,0|1,0,0]=3 8373 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)Br 34a_100000765947_200000035995 [0,2,0,0,0,0|2,0,0]=4 8374 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)C 34a_100011279678_200000035995 [0,2,0,0,0,0|2,0,0]=4 8375 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)Cl 34a_100000742311_200000035995 [0,2,0,0,0,0|2,0,0]=4 8376 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)F 34a_100000701188_200000035995 [0,2,0,0,0,0|2,0,0]=4 8377 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)I 34a_100000746945_200000035995 [0,2,0,0,0,0|2,0,0]=4 8378 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_200000035995 [0,2,0,0,0,0|1,0,0]=3 8379 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)Br 34a_100011827694_200000035995 [0,2,0,0,0,0|2,0,0]=4 8380 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)C 34a_100009865632_200000035995 [0,2,0,0,0,0|2,0,0]=4 8381 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)Cl 34a_100012186310_200000035995 [0,2,0,0,0,0|2,0,0]=4 8382 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)F 34a_100012001760_200000035995 [0,2,0,0,0,0|2,0,0]=4 8383 B14R1.3405 C#CC(C)Oc1ccc(c(c1)OC)N 34a_100015326901_200000035995 [0,2,0,0,0,0|2,0,0]=4 8384 B14R1.3405 C#CC(C)Sc1ccc(c(c1)CC)O 62a_200000035995_100012338938 [0,2,0,0,0,0|2,0,0]=4 8385 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)Br 62a_200000035995_100012353699 [0,2,0,0,0,0|2,0,0]=4 8386 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)C 62a_200000035995_100011830276 [0,2,0,0,0,0|2,0,0]=4 8387 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)Cl 62a_200000035995_100011356853 [0,2,0,0,0,0|2,0,0]=4 8388 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)F 62a_200000035995_100011934186 [0,2,0,0,0,0|2,0,0]=4 8389 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)N 62a_200000035995_100015196925 [0,2,0,0,0,0|2,0,0]=4 8390 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)O 62a_200000035995_100000694246 [0,2,0,0,0,0|1,0,0]=3 8391 B14R1.3405 C#CC(C)Sc1ccc(c(n1)OC)O 62a_200000035995_100010893133 [0,2,0,0,0,0|2,0,0]=4 8392 B14R1.3405 C=CC(C)Sc1ccc(c(c1)CC)O 62a_100011215867_100012338938 [0,2,0,0,0,0|2,0,0]=4 8393 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)Br 62a_100011215867_100012353699 [0,2,0,0,0,0|2,0,0]=4 8394 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)C 62a_100011215867_100011830276 [0,2,0,0,0,0|2,0,0]=4 8395 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)Cl 62a_100011215867_100011356853 [0,2,0,0,0,0|2,0,0]=4 8396 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)F 62a_100011215867_100011934186 [0,2,0,0,0,0|2,0,0]=4 8397 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)N 62a_100011215867_100015196925 [0,2,0,0,0,0|2,0,0]=4 8398 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)O 62a_100011215867_100000694246 [0,2,0,0,0,0|1,0,0]=3 8399 B14R1.3405 C=CC(C)Sc1ccc(c(n1)OC)O 62a_100011215867_100010893133 [0,2,0,0,0,0|2,0,0]=4 8400 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)Br 1458a_100000210414_100010110085 [0,2,0,0,0,0|1,0,0]=3 8401 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)Br 1458a_200010002685_100000210202 [0,2,0,0,0,0|1,0,0]=3 8402 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)Cl 1458a_100000210414_200010214485 [0,2,0,0,0,0|1,0,0]=3 8403 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)F 1458a_100000117344_100000210202 [0,2,0,0,0,0|1,0,0]=3 8404 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)F 1458a_100000210414_100012349856 [0,2,0,0,0,0|1,0,0]=3 8405 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210202 [0,2,0,0,0,0|0,0,0]=2 8406 B14R1.3405 CCC(=O)Cc1ccc(c(n1)OC)Br 1458a_100000210414_200010066506 [0,2,0,0,0,0|2,0,0]=4 8407 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Br 11a_100000765947_100000210414 [0,2,0,0,0,0|1,0,1]=4 8408 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Br 1626a_100000765947_100000210414 [0,2,0,0,0,0|1,0,1]=4 8409 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Br 22a_100000765947_100000210414 [0,2,0,0,0,0|1,0,1]=4 8410 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Br 527a_100000765947_100000210414 [0,2,0,0,0,0|1,0,1]=4 8411 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 11a_100011279678_100000210414 [0,2,0,0,0,0|1,0,1]=4 8412 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 1626a_100011279678_100000210414 [0,2,0,0,0,0|1,0,1]=4 8413 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 22a_100011279678_100000210414 [0,2,0,0,0,0|1,0,1]=4 8414 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)C 527a_100011279678_100000210414 [0,2,0,0,0,0|1,0,1]=4 8415 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Cl 11a_100000742311_100000210414 [0,2,0,0,0,0|1,0,1]=4 8416 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Cl 1626a_100000742311_100000210414 [0,2,0,0,0,0|1,0,1]=4 8417 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Cl 22a_100000742311_100000210414 [0,2,0,0,0,0|1,0,1]=4 8418 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)Cl 527a_100000742311_100000210414 [0,2,0,0,0,0|1,0,1]=4 8419 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)F 11a_100000701188_100000210414 [0,2,0,0,0,0|1,0,1]=4 8420 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)F 1626a_100000701188_100000210414 [0,2,0,0,0,0|1,0,1]=4 8421 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)F 22a_100000701188_100000210414 [0,2,0,0,0,0|1,0,1]=4 8422 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)F 527a_100000701188_100000210414 [0,2,0,0,0,0|1,0,1]=4 8423 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)I 11a_100000746945_100000210414 [0,2,0,0,0,0|1,0,1]=4 8424 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)I 1626a_100000746945_100000210414 [0,2,0,0,0,0|1,0,1]=4 8425 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)I 22a_100000746945_100000210414 [0,2,0,0,0,0|1,0,1]=4 8426 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)I 527a_100000746945_100000210414 [0,2,0,0,0,0|1,0,1]=4 8427 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)O 22a_100000726020_100000210414 [0,2,0,0,0,0|0,0,1]=3 8428 B14R1.3405 CCC(=O)Nc1ccc(c(c1)OC)O 527a_100000726020_100000210414 [0,2,0,0,0,0|0,0,1]=3 8429 B14R1.3405 CCC(C)Nc1ccc(c(c1)C#N)O 34a_100011249283_100011215416 [0,2,0,0,0,0|2,0,0]=4 8430 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Br 2230a_100000765947_100000758301 [0,2,0,0,0,0|1,0,0]=3 8431 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Br 34a_100000765947_100011215416 [0,2,0,0,0,0|1,0,0]=3 8432 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)C 2230a_100011279678_100000758301 [0,2,0,0,0,0|1,0,0]=3 8433 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)C 34a_100011279678_100011215416 [0,2,0,0,0,0|1,0,0]=3 8434 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Cl 2230a_100000742311_100000758301 [0,2,0,0,0,0|1,0,0]=3 8435 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)Cl 34a_100000742311_100011215416 [0,2,0,0,0,0|1,0,0]=3 8436 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)F 2230a_100000701188_100000758301 [0,2,0,0,0,0|1,0,0]=3 8437 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)F 34a_100000701188_100011215416 [0,2,0,0,0,0|1,0,0]=3 8438 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)I 34a_100000746945_100011215416 [0,2,0,0,0,0|1,0,0]=3 8439 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100011215416 [0,2,0,0,0,0|0,0,0]=2 8440 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Br 34a_100011827694_100011215416 [0,2,0,0,0,0|1,0,0]=3 8441 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Br 7a_100011827694_100000758301 [0,2,0,0,0,0|1,0,0]=3 8442 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)C 34a_100009865632_100011215416 [0,2,0,0,0,0|1,0,0]=3 8443 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)C 7a_100009865632_100000758301 [0,2,0,0,0,0|1,0,0]=3 8444 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Cl 34a_100012186310_100011215416 [0,2,0,0,0,0|1,0,0]=3 8445 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)Cl 7a_100012186310_100000758301 [0,2,0,0,0,0|1,0,0]=3 8446 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)F 34a_100012001760_100011215416 [0,2,0,0,0,0|1,0,0]=3 8447 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)F 7a_100012001760_100000758301 [0,2,0,0,0,0|1,0,0]=3 8448 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)N 34a_100015326901_100011215416 [0,2,0,0,0,0|1,0,0]=3 8449 B14R1.3405 CCC(C)Oc1ccc(c(c1)OC)N 7a_100015326901_100000758301 [0,2,0,0,0,0|1,0,0]=3 8450 B14R1.3405 CCC(C)Sc1c[nH]c(=O)c(c1)OC 62a_100000758301_100010125397 [0,2,0,0,0,0|1,0,1]=4 8451 B14R1.3405 CCC(C)Sc1cc(c(cn1)C)OC 62a_100000758301_100010067687 [0,2,0,0,0,0|2,0,0]=4 8452 B14R1.3405 CCC(C)Sc1cc(c(cn1)C)OC 62a_100010067687_100000758301 [0,2,0,0,0,0|2,0,0]=4 8453 B14R1.3405 CCC(C)Sc1cc(c(cn1)F)OC 62a_100000758301_200010136270 [0,2,0,0,0,0|2,0,0]=4 8454 B14R1.3405 CCC(C)Sc1cc(c(cn1)F)OC 62a_200010136270_100000758301 [0,2,0,0,0,0|2,0,0]=4 8455 B14R1.3405 CCC(C)Sc1cc(c(cn1)N)OC 62a_100000758301_100009887741 [0,2,0,0,0,0|2,0,0]=4 8456 B14R1.3405 CCC(C)Sc1cc(c(cn1)N)OC 62a_100009887741_100000758301 [0,2,0,0,0,0|2,0,0]=4 8457 B14R1.3405 CCC(C)Sc1ccc(c(c1)C#N)O 62a_100000758301_100000687585 [0,2,0,0,0,0|2,0,0]=4 8458 B14R1.3405 CCC(C)Sc1ccc(c(c1)C=O)O 62a_100000758301_100000186750 [0,2,0,0,0,0|2,0,0]=4 8459 B14R1.3405 CCC(C)Sc1ccc(c(c1)CN)O 62a_100000730032_100000758301 [0,2,0,0,0,0|2,0,0]=4 8460 B14R1.3405 CCC(C)Sc1ccc(c(c1)CN)O 62a_100000758301_100000730032 [0,2,0,0,0,0|2,0,0]=4 8461 B14R1.3405 CCC(C)Sc1ccc(c(c1)CO)O 62a_100000184703_100000758301 [0,2,0,0,0,0|2,0,0]=4 8462 B14R1.3405 CCC(C)Sc1ccc(c(c1)CO)O 62a_100000758301_100000184703 [0,2,0,0,0,0|2,0,0]=4 8463 B14R1.3405 CCC(C)Sc1ccc(c(c1)NC)C 62a_100000758301_100020629602 [0,2,0,0,0,0|2,0,0]=4 8464 B14R1.3405 CCC(C)Sc1ccc(c(c1)NC)C 62a_100020629602_100000758301 [0,2,0,0,0,0|2,0,0]=4 8465 B14R1.3405 CCC(C)Sc1ccc(c(c1)NC)F 62a_100000758301_100011314990 [0,2,0,0,0,0|2,0,0]=4 8466 B14R1.3405 CCC(C)Sc1ccc(c(c1)NC)F 62a_100011314990_100000758301 [0,2,0,0,0,0|2,0,0]=4 8467 B14R1.3405 CCC(C)Sc1ccc(c(c1)NC)N 62a_100000694363_100000758301 [0,2,0,0,0,0|2,0,0]=4 8468 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Br 62a_100000758301_100012353699 [0,2,0,0,0,0|1,0,0]=3 8469 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Br 62a_100012353699_100000758301 [0,2,0,0,0,0|1,0,0]=3 8470 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)C 62a_100000758301_100011830276 [0,2,0,0,0,0|1,0,0]=3 8471 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)C 62a_100011830276_100000758301 [0,2,0,0,0,0|1,0,0]=3 8472 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Cl 62a_100000758301_100011356853 [0,2,0,0,0,0|1,0,0]=3 8473 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)Cl 62a_100011356853_100000758301 [0,2,0,0,0,0|1,0,0]=3 8474 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)F 62a_100000758301_100011934186 [0,2,0,0,0,0|1,0,0]=3 8475 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)F 62a_100011934186_100000758301 [0,2,0,0,0,0|1,0,0]=3 8476 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)N 62a_100000758301_100015196925 [0,2,0,0,0,0|1,0,0]=3 8477 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)N 62a_100011279103_100000758301 [0,2,0,0,0,0|1,0,0]=3 8478 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)O 62a_100000758301_100000694246 [0,2,0,0,0,0|0,0,0]=2 8479 B14R1.3405 CCC(C)Sc1ccc(c(c1)SC)F 62a_100000758301_100010341305 [0,2,0,0,0,0|1,1,0]=4 8480 B14R1.3405 CCC(C)Sc1ccc(c(c1)SC)F 62a_100010341305_100000758301 [0,2,0,0,0,0|1,1,0]=4 8481 B14R1.3405 CCC(C)Sc1ccc(c(n1)OC)N 62a_100000687816_100000758301 [0,2,0,0,0,0|2,0,0]=4 8482 B14R1.3405 CCC(C)Sc1ccc(c(n1)OC)N 62a_100000758301_100000687816 [0,2,0,0,0,0|2,0,0]=4 8483 B14R1.3405 CCC(C)Sc1ccc(c(n1)OC)O 62a_100000758301_100010893133 [0,2,0,0,0,0|1,0,0]=3 8484 B14R1.3405 CCC(C)Sc1cnc(c(c1)OC)C 62a_100000758301_100010254219 [0,2,0,0,0,0|2,0,0]=4 8485 B14R1.3405 CCC(C)Sc1cnc(c(c1)OC)C 62a_100010254219_100000758301 [0,2,0,0,0,0|2,0,0]=4 8486 B14R1.3405 CCC(C)Sc1cnc(c(c1)OC)F 62a_100000758301_100010214931 [0,2,0,0,0,0|2,0,0]=4 8487 B14R1.3405 CCC(C)Sc1cnc(c(c1)OC)F 62a_100010214931_100000758301 [0,2,0,0,0,0|2,0,0]=4 8488 B14R1.3405 CCC(C)Sc1cnc(c(c1)OC)N 62a_100000758301_106354213024 [0,2,0,0,0,0|2,0,0]=4 8489 B14R1.3405 CCC(C)Sc1cnc(c(c1)OC)N 62a_106354213024_100000758301 [0,2,0,0,0,0|2,0,0]=4 8490 B14R1.3405 CCC(C)Sc1cnc(c(n1)OC)O 62a_100000758301_200010365344 [0,2,0,0,0,0|2,0,0]=4 8491 B14R1.3405 CCC(C)Sc1cnc(c(n1)OC)O 62a_200010365344_100000758301 [0,2,0,0,0,0|2,0,0]=4 8492 B14R1.3405 CCN(C)Cc1ccc(c(c1)C=O)O 269982a_100000225621_100000008128 [0,2,0,0,0,0|2,0,0]=4 8493 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Br 2230a_100000225621_100010110085 [0,2,0,0,0,0|1,0,0]=3 8494 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Br 269982a_100000225621_100010110085 [0,2,0,0,0,0|1,0,0]=3 8495 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Br 26a_100000225621_100011827694 [0,2,0,0,0,0|1,0,0]=3 8496 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Cl 2230a_100000225621_200010214485 [0,2,0,0,0,0|1,0,0]=3 8497 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Cl 269982a_100000225621_200010214485 [0,2,0,0,0,0|1,0,0]=3 8498 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)Cl 26a_100000225621_100012186310 [0,2,0,0,0,0|1,0,0]=3 8499 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)F 2230a_100000225621_100012349856 [0,2,0,0,0,0|1,0,0]=3 8500 B14R1.3405 CCN(C)Cc1ccc(c(c1)OC)F 269982a_100000225621_100012349856 [0,2,0,0,0,0|1,0,0]=3 8501 B14R1.3405 CCN(C)Cc1ccc(c(n1)OC)Br 2230a_100000225621_200010066506 [0,2,0,0,0,0|2,0,0]=4 8502 B14R1.3405 CCc1cc(ccc1Br)NC(C)CC 2230a_100010109747_100000758301 [0,2,0,0,0,0|2,0,0]=4 8503 B14R1.3405 CCc1cc(ccc1Br)NC(C)CC 34a_100010109747_100011215416 [0,2,0,0,0,0|2,0,0]=4 8504 B14R1.3405 CCc1cc(ccc1Br)NC(C)CC 7a_100010109747_100000758301 [0,2,0,0,0,0|2,0,0]=4 8505 B14R1.3405 CCc1cc(ccc1Br)SC(C)CC 62a_100000758301_100010244631 [0,2,0,0,0,0|2,0,0]=4 8506 B14R1.3405 CCc1cc(ccc1Br)SC(C)CC 62a_100010244631_100000758301 [0,2,0,0,0,0|2,0,0]=4 8507 B14R1.3405 CCc1cc(ccc1Cl)CN(C)CC 26a_100000225621_100000212063 [0,2,0,0,0,0|2,0,0]=4 8508 B14R1.3405 CCc1cc(ccc1Cl)OC(C)CC 34a_100000212063_100011215416 [0,2,0,0,0,0|2,0,0]=4 8509 B14R1.3405 CCc1cc(ccc1Cl)OC(C)CC 7a_100000212063_100000758301 [0,2,0,0,0,0|2,0,0]=4 8510 B14R1.3405 CCc1cc(ccc1F)SC(C)CC 62a_100000758301_100010244625 [0,2,0,0,0,0|2,0,0]=4 8511 B14R1.3405 CCc1cc(ccc1F)SC(C)CC 62a_100010244625_100000758301 [0,2,0,0,0,0|2,0,0]=4 8512 B14R1.3405 CCc1cc(ccc1N)SC(C)CC 62a_100000686106_100000758301 [0,2,0,0,0,0|2,0,0]=4 8513 B14R1.3405 CCc1cc(ccc1N)SC(C)CC 62a_100000758301_100000686106 [0,2,0,0,0,0|2,0,0]=4 8514 B14R1.3405 CCc1cc(ccc1O)SC(C)C#N 62a_100000703298_100012338938 [0,2,0,0,0,0|2,0,0]=4 8515 B14R1.3405 CCc1cc(ccc1O)SC(C)CC 62a_100000758301_100012338938 [0,2,0,0,0,0|1,0,0]=3 8516 B14R1.3405 CCc1cc(ccc1O)SC(C)CO 62a_100012180447_100012338938 [0,2,0,0,0,0|2,0,0]=4 8517 B14R1.3405 CCc1cc(ccc1O)SC(C)OC 62a_100009879195_100012338938 [0,2,0,0,0,0|2,0,0]=4 8518 B14R1.3405 CCc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100012338938 [0,2,0,0,0,0|2,0,0]=4 8519 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 11a_106832991635_200010002685 [0,2,0,0,0,0|1,0,1]=4 8520 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 240690a_100102657272_200010002685 [0,2,0,0,0,0|1,0,1]=4 8521 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)Br 527a_100102657272_200010002685 [0,2,0,0,0,0|1,0,1]=4 8522 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 11a_106832991635_100000117344 [0,2,0,0,0,0|1,0,1]=4 8523 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 1626a_100102657272_100000117344 [0,2,0,0,0,0|1,0,1]=4 8524 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 240690a_100102657272_100000117344 [0,2,0,0,0,0|1,0,1]=4 8525 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)F 527a_100102657272_100000117344 [0,2,0,0,0,0|1,0,1]=4 8526 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 240690a_100102657272_100000032101 [0,2,0,0,0,0|0,0,1]=3 8527 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 527a_100102657272_100000032101 [0,2,0,0,0,0|0,0,1]=3 8528 B14R1.3405 CNC(=O)Nc1ccc(c(c1)OC)O 2430a_100000726020_100102657272 [0,2,0,0,0,0|1,0,1]=4 8529 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)C 270004a_106832991635_200000081148 [0,2,0,0,0,0|1,0,0]=3 8530 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)F 270004a_106832991635_200000078651 [0,2,0,0,0,0|1,0,0]=3 8531 B14R1.3405 COC(=O)Cc1ccc(c(c1)OC)N 34a_200009957001_200000210301 [0,2,0,0,0,0|1,0,1]=4 8532 B14R1.3405 COC(=O)Cc1ccc(c(c1)O[13CH3])N 34a_200009957001_200025704644 [0,2,0,0,0,0|1,0,1]=4 8533 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)O 62a_100010222482_200000210301 [0,2,0,0,0,0|0,1,1]=4 8534 B14R1.3405 COC(=O)Cc1ccc(c(c1)SC)O 62a_200000210301_100010222482 [0,2,0,0,0,0|0,1,1]=4 8535 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010222482_200025704644 [0,2,0,0,0,0|0,1,1]=4 8536 B14R1.3405 COC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010222482 [0,2,0,0,0,0|0,1,1]=4 8537 B14R1.3405 COc1cc(ccc1Br)CC(=O)CF 1458a_200010002685_100015361967 [0,2,0,0,0,0|1,0,1]=4 8538 B14R1.3405 COc1cc(ccc1Br)CC(=O)CO 1458a_100000210174_100010110085 [0,2,0,0,0,0|1,0,1]=4 8539 B14R1.3405 COc1cc(ccc1Br)NC(C)C#N 2230a_100000765947_100000184139 [0,2,0,0,0,0|2,0,0]=4 8540 B14R1.3405 COc1cc(ccc1Br)NC(C)CO 2230a_100000765947_100012180447 [0,2,0,0,0,0|2,0,0]=4 8541 B14R1.3405 COc1cc(ccc1Br)NC(C)CO 34a_100000765947_100012180447 [0,2,0,0,0,0|2,0,0]=4 8542 B14R1.3405 COc1cc(ccc1Br)OC(C)C#N 7a_100011827694_100000703298 [0,2,0,0,0,0|2,0,0]=4 8543 B14R1.3405 COc1cc(ccc1Br)OC(C)CO 34a_100011827694_100012180447 [0,2,0,0,0,0|2,0,0]=4 8544 B14R1.3405 COc1cc(ccc1Br)OC(C)CO 7a_100011827694_100012180447 [0,2,0,0,0,0|2,0,0]=4 8545 B14R1.3405 COc1cc(ccc1Br)SC(C)C#N 62a_100000703298_100012353699 [0,2,0,0,0,0|2,0,0]=4 8546 B14R1.3405 COc1cc(ccc1Br)SC(C)C#N 62a_100012353699_100000703298 [0,2,0,0,0,0|2,0,0]=4 8547 B14R1.3405 COc1cc(ccc1Br)SC(C)CO 62a_100012180447_100012353699 [0,2,0,0,0,0|2,0,0]=4 8548 B14R1.3405 COc1cc(ccc1Br)SC(C)OC 62a_100009879195_100012353699 [0,2,0,0,0,0|2,0,0]=4 8549 B14R1.3405 COc1cc(ccc1Br)SC(C)OC 62a_100012353699_100009879195 [0,2,0,0,0,0|2,0,0]=4 8550 B14R1.3405 COc1cc(ccc1Br)S[C@H](C)CO 62a_100012353699_100016084084 [0,2,0,0,0,0|2,0,0]=4 8551 B14R1.3405 COc1cc(ccc1Br)S[C@H](C)CO 62a_100016084084_100012353699 [0,2,0,0,0,0|2,0,0]=4 8552 B14R1.3405 COc1cc(ccc1C)NC(C)C#N 2230a_100011279678_100000184139 [0,2,0,0,0,0|2,0,0]=4 8553 B14R1.3405 COc1cc(ccc1C)NC(C)CO 2230a_100011279678_100012180447 [0,2,0,0,0,0|2,0,0]=4 8554 B14R1.3405 COc1cc(ccc1C)NC(C)CO 34a_100011279678_100012180447 [0,2,0,0,0,0|2,0,0]=4 8555 B14R1.3405 COc1cc(ccc1C)OC(C)C#N 7a_100009865632_100000703298 [0,2,0,0,0,0|2,0,0]=4 8556 B14R1.3405 COc1cc(ccc1C)OC(C)CO 34a_100009865632_100012180447 [0,2,0,0,0,0|2,0,0]=4 8557 B14R1.3405 COc1cc(ccc1C)OC(C)CO 7a_100009865632_100012180447 [0,2,0,0,0,0|2,0,0]=4 8558 B14R1.3405 COc1cc(ccc1C)SC(C)C#N 62a_100000703298_100011830276 [0,2,0,0,0,0|2,0,0]=4 8559 B14R1.3405 COc1cc(ccc1C)SC(C)C#N 62a_100011830276_100000703298 [0,2,0,0,0,0|2,0,0]=4 8560 B14R1.3405 COc1cc(ccc1C)SC(C)CO 62a_100012180447_100011830276 [0,2,0,0,0,0|2,0,0]=4 8561 B14R1.3405 COc1cc(ccc1C)SC(C)OC 62a_100009879195_100011830276 [0,2,0,0,0,0|2,0,0]=4 8562 B14R1.3405 COc1cc(ccc1C)SC(C)OC 62a_100011830276_100009879195 [0,2,0,0,0,0|2,0,0]=4 8563 B14R1.3405 COc1cc(ccc1C)S[C@H](C)CO 62a_100011830276_100016084084 [0,2,0,0,0,0|2,0,0]=4 8564 B14R1.3405 COc1cc(ccc1C)S[C@H](C)CO 62a_100016084084_100011830276 [0,2,0,0,0,0|2,0,0]=4 8565 B14R1.3405 COc1cc(ccc1Cl)CC(=O)CO 1458a_100000210174_200010214485 [0,2,0,0,0,0|1,0,1]=4 8566 B14R1.3405 COc1cc(ccc1Cl)NC(C)C#N 2230a_100000742311_100000184139 [0,2,0,0,0,0|2,0,0]=4 8567 B14R1.3405 COc1cc(ccc1Cl)NC(C)CO 2230a_100000742311_100012180447 [0,2,0,0,0,0|2,0,0]=4 8568 B14R1.3405 COc1cc(ccc1Cl)NC(C)CO 34a_100000742311_100012180447 [0,2,0,0,0,0|2,0,0]=4 8569 B14R1.3405 COc1cc(ccc1Cl)OC(C)C#N 7a_100012186310_100000703298 [0,2,0,0,0,0|2,0,0]=4 8570 B14R1.3405 COc1cc(ccc1Cl)OC(C)CO 34a_100012186310_100012180447 [0,2,0,0,0,0|2,0,0]=4 8571 B14R1.3405 COc1cc(ccc1Cl)OC(C)CO 7a_100012186310_100012180447 [0,2,0,0,0,0|2,0,0]=4 8572 B14R1.3405 COc1cc(ccc1Cl)SC(C)C#N 62a_100000703298_100011356853 [0,2,0,0,0,0|2,0,0]=4 8573 B14R1.3405 COc1cc(ccc1Cl)SC(C)C#N 62a_100011356853_100000703298 [0,2,0,0,0,0|2,0,0]=4 8574 B14R1.3405 COc1cc(ccc1Cl)SC(C)CO 62a_100012180447_100011356853 [0,2,0,0,0,0|2,0,0]=4 8575 B14R1.3405 COc1cc(ccc1Cl)SC(C)OC 62a_100009879195_100011356853 [0,2,0,0,0,0|2,0,0]=4 8576 B14R1.3405 COc1cc(ccc1Cl)SC(C)OC 62a_100011356853_100009879195 [0,2,0,0,0,0|2,0,0]=4 8577 B14R1.3405 COc1cc(ccc1Cl)S[C@H](C)CO 62a_100011356853_100016084084 [0,2,0,0,0,0|2,0,0]=4 8578 B14R1.3405 COc1cc(ccc1Cl)S[C@H](C)CO 62a_100016084084_100011356853 [0,2,0,0,0,0|2,0,0]=4 8579 B14R1.3405 COc1cc(ccc1F)CC(=O)CF 1458a_100000117344_100015361967 [0,2,0,0,0,0|1,0,1]=4 8580 B14R1.3405 COc1cc(ccc1F)CC(=O)CO 1458a_100000210174_100012349856 [0,2,0,0,0,0|1,0,1]=4 8581 B14R1.3405 COc1cc(ccc1F)NC(C)C#N 2230a_100000701188_100000184139 [0,2,0,0,0,0|2,0,0]=4 8582 B14R1.3405 COc1cc(ccc1F)NC(C)CO 2230a_100000701188_100012180447 [0,2,0,0,0,0|2,0,0]=4 8583 B14R1.3405 COc1cc(ccc1F)NC(C)CO 34a_100000701188_100012180447 [0,2,0,0,0,0|2,0,0]=4 8584 B14R1.3405 COc1cc(ccc1F)OC(C)C#N 7a_100012001760_100000703298 [0,2,0,0,0,0|2,0,0]=4 8585 B14R1.3405 COc1cc(ccc1F)OC(C)CO 34a_100012001760_100012180447 [0,2,0,0,0,0|2,0,0]=4 8586 B14R1.3405 COc1cc(ccc1F)OC(C)CO 7a_100012001760_100012180447 [0,2,0,0,0,0|2,0,0]=4 8587 B14R1.3405 COc1cc(ccc1F)SC(C)C#N 62a_100000703298_100011934186 [0,2,0,0,0,0|2,0,0]=4 8588 B14R1.3405 COc1cc(ccc1F)SC(C)C#N 62a_100011934186_100000703298 [0,2,0,0,0,0|2,0,0]=4 8589 B14R1.3405 COc1cc(ccc1F)SC(C)CO 62a_100012180447_100011934186 [0,2,0,0,0,0|2,0,0]=4 8590 B14R1.3405 COc1cc(ccc1F)SC(C)OC 62a_100009879195_100011934186 [0,2,0,0,0,0|2,0,0]=4 8591 B14R1.3405 COc1cc(ccc1F)SC(C)OC 62a_100011934186_100009879195 [0,2,0,0,0,0|2,0,0]=4 8592 B14R1.3405 COc1cc(ccc1F)S[C@H](C)CO 62a_100011934186_100016084084 [0,2,0,0,0,0|2,0,0]=4 8593 B14R1.3405 COc1cc(ccc1F)S[C@H](C)CO 62a_100016084084_100011934186 [0,2,0,0,0,0|2,0,0]=4 8594 B14R1.3405 COc1cc(ccc1I)NC(C)CO 34a_100000746945_100012180447 [0,2,0,0,0,0|2,0,0]=4 8595 B14R1.3405 COc1cc(ccc1N)OC(C)C#N 7a_100015326901_100000703298 [0,2,0,0,0,0|2,0,0]=4 8596 B14R1.3405 COc1cc(ccc1N)OC(C)CO 34a_100015326901_100012180447 [0,2,0,0,0,0|2,0,0]=4 8597 B14R1.3405 COc1cc(ccc1N)OC(C)CO 7a_100015326901_100012180447 [0,2,0,0,0,0|2,0,0]=4 8598 B14R1.3405 COc1cc(ccc1N)SC(C)C#N 62a_100000703298_100015196925 [0,2,0,0,0,0|2,0,0]=4 8599 B14R1.3405 COc1cc(ccc1N)SC(C)C#N 62a_100011279103_100000703298 [0,2,0,0,0,0|2,0,0]=4 8600 B14R1.3405 COc1cc(ccc1N)SC(C)CO 62a_100012180447_100015196925 [0,2,0,0,0,0|2,0,0]=4 8601 B14R1.3405 COc1cc(ccc1N)SC(C)OC 62a_100009879195_100015196925 [0,2,0,0,0,0|2,0,0]=4 8602 B14R1.3405 COc1cc(ccc1N)SC(C)OC 62a_100011279103_100009879195 [0,2,0,0,0,0|2,0,0]=4 8603 B14R1.3405 COc1cc(ccc1N)S[C@H](C)CO 62a_100011279103_100016084084 [0,2,0,0,0,0|2,0,0]=4 8604 B14R1.3405 COc1cc(ccc1N)S[C@H](C)CO 62a_100016084084_100015196925 [0,2,0,0,0,0|2,0,0]=4 8605 B14R1.3405 COc1cc(ccc1O)CC(=O)CF 1458a_100000032101_100015361967 [0,2,0,0,0,0|0,0,1]=3 8606 B14R1.3405 COc1cc(ccc1O)NC(=O)CO 22a_100000726020_100000210174 [0,2,0,0,0,0|1,0,1]=4 8607 B14R1.3405 COc1cc(ccc1O)NC(=O)CO 527a_100000726020_100000210174 [0,2,0,0,0,0|1,0,1]=4 8608 B14R1.3405 COc1cc(ccc1O)NC(C)CO 34a_100000726020_100012180447 [0,2,0,0,0,0|1,0,0]=3 8609 B14R1.3405 COc1cc(ccc1O)SC(C)C#N 62a_100000703298_100000694246 [0,2,0,0,0,0|1,0,0]=3 8610 B14R1.3405 COc1cc(ccc1O)SC(C)CO 62a_100012180447_100000694246 [0,2,0,0,0,0|1,0,0]=3 8611 B14R1.3405 COc1cc(ccc1O)SC(C)OC 62a_100009879195_100000694246 [0,2,0,0,0,0|1,0,0]=3 8612 B14R1.3405 COc1cc(ccc1O)SC(F)C#N 62a_200000117898_100000694246 [0,2,0,0,0,0|1,0,1]=4 8613 B14R1.3405 COc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100000694246 [0,2,0,0,0,0|1,0,0]=3 8614 B14R1.3405 COc1nc(ccc1O)SC(C)C#N 62a_100000703298_100010893133 [0,2,0,0,0,0|2,0,0]=4 8615 B14R1.3405 COc1nc(ccc1O)SC(C)CO 62a_100012180447_100010893133 [0,2,0,0,0,0|2,0,0]=4 8616 B14R1.3405 COc1nc(ccc1O)SC(C)OC 62a_100009879195_100010893133 [0,2,0,0,0,0|2,0,0]=4 8617 B14R1.3405 COc1nc(ccc1O)S[C@H](C)CO 62a_100016084084_100010893133 [0,2,0,0,0,0|2,0,0]=4 8618 B14R1.3412 CCc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100012338938 [0,2,0,0,0,0|2,0,0]=4 8619 B14R1.3412 COc1cc(ccc1Br)NC(C)(C)C 34a_100000765947_100000210625 [0,2,0,0,0,0|2,0,0]=4 8620 B14R1.3412 COc1cc(ccc1Br)OC(C)(C)C 34a_100011827694_100000210625 [0,2,0,0,0,0|2,0,0]=4 8621 B14R1.3412 COc1cc(ccc1Br)SC(C)(C)C 62a_100000211941_100012353699 [0,2,0,0,0,0|2,0,0]=4 8622 B14R1.3412 COc1cc(ccc1Br)SC(C)(C)C 62a_100012353699_100000211941 [0,2,0,0,0,0|2,0,0]=4 8623 B14R1.3412 COc1cc(ccc1C)NC(C)(C)C 34a_100011279678_100000210625 [0,2,0,0,0,0|2,0,0]=4 8624 B14R1.3412 COc1cc(ccc1C)OC(C)(C)C 34a_100009865632_100000210625 [0,2,0,0,0,0|2,0,0]=4 8625 B14R1.3412 COc1cc(ccc1C)SC(C)(C)C 62a_100000211941_100011830276 [0,2,0,0,0,0|2,0,0]=4 8626 B14R1.3412 COc1cc(ccc1C)SC(C)(C)C 62a_100011830276_100000211941 [0,2,0,0,0,0|2,0,0]=4 8627 B14R1.3412 COc1cc(ccc1Cl)NC(C)(C)C 34a_100000742311_100000210625 [0,2,0,0,0,0|2,0,0]=4 8628 B14R1.3412 COc1cc(ccc1Cl)OC(C)(C)C 34a_100012186310_100000210625 [0,2,0,0,0,0|2,0,0]=4 8629 B14R1.3412 COc1cc(ccc1Cl)SC(C)(C)C 62a_100000211941_100011356853 [0,2,0,0,0,0|2,0,0]=4 8630 B14R1.3412 COc1cc(ccc1Cl)SC(C)(C)C 62a_100011356853_100000211941 [0,2,0,0,0,0|2,0,0]=4 8631 B14R1.3412 COc1cc(ccc1F)NC(C)(C)C 34a_100000701188_100000210625 [0,2,0,0,0,0|2,0,0]=4 8632 B14R1.3412 COc1cc(ccc1F)OC(C)(C)C 34a_100012001760_100000210625 [0,2,0,0,0,0|2,0,0]=4 8633 B14R1.3412 COc1cc(ccc1F)SC(C)(C)C 62a_100000211941_100011934186 [0,2,0,0,0,0|2,0,0]=4 8634 B14R1.3412 COc1cc(ccc1F)SC(C)(C)C 62a_100011934186_100000211941 [0,2,0,0,0,0|2,0,0]=4 8635 B14R1.3412 COc1cc(ccc1I)NC(C)(C)C 34a_100000746945_100000210625 [0,2,0,0,0,0|2,0,0]=4 8636 B14R1.3412 COc1cc(ccc1N)OC(C)(C)C 34a_100015326901_100000210625 [0,2,0,0,0,0|2,0,0]=4 8637 B14R1.3412 COc1cc(ccc1N)SC(C)(C)C 62a_100000211941_100015196925 [0,2,0,0,0,0|2,0,0]=4 8638 B14R1.3412 COc1cc(ccc1N)SC(C)(C)C 62a_100011279103_100000211941 [0,2,0,0,0,0|2,0,0]=4 8639 B14R1.3412 COc1cc(ccc1O)NC(C)(C)C 34a_100000726020_100000210625 [0,2,0,0,0,0|1,0,0]=3 8640 B14R1.3412 COc1cc(ccc1O)NC(F)(F)F 34a_100000726020_200103152311 [0,2,0,0,0,0|2,0,0]=4 8641 B14R1.3412 COc1cc(ccc1O)NS(=O)(=O)C 40a_100000726020_100000738038 [0,2,0,0,0,0|2,0,0]=4 8642 B14R1.3412 COc1cc(ccc1O)OC(F)(F)F 271570a_203496583355_100010195628 [0,2,0,0,0,0|2,0,0]=4 8643 B14R1.3412 COc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100000694246 [0,2,0,0,0,0|1,0,0]=3 8644 B14R1.3412 COc1cc(ccc1O)SC(F)(F)F 62a_200000243211_100000694246 [0,2,0,0,0,0|2,0,0]=4 8645 B14R1.3412 COc1nc(ccc1O)SC(C)(C)C 62a_100000211941_100010893133 [0,2,0,0,0,0|2,0,0]=4 8646 B14R1.3651 CCc1cc(ccc1OC)SC(C)C 62a_100000210206_200010179862 [0,2,0,0,0,0|2,0,0]=4 8647 B14R1.3651 CCc1cc(ccc1OC)SC(C)C 62a_200010179862_100000210206 [0,2,0,0,0,0|2,0,0]=4 8648 B14R1.3651 CCc1ccc(cc1OC)SC(C)C 62a_100000210206_200010710398 [0,2,0,0,0,0|2,0,0]=4 8649 B14R1.3651 CCc1ccc(cc1OC)SC(C)C 62a_200010710398_100000210206 [0,2,0,0,0,0|2,0,0]=4 8650 B14R1.3651 COc1cc(ccc1C#N)CN(C)C 270004a_100102631434_100000726430 [0,2,0,0,0,0|2,0,0]=4 8651 B14R1.3651 COc1cc(ccc1C#N)NC(C)C 34a_100011999456_100000210206 [0,2,0,0,0,0|2,0,0]=4 8652 B14R1.3651 COc1cc(ccc1C#N)SC(C)C 62a_100000210206_100000694671 [0,2,0,0,0,0|2,0,0]=4 8653 B14R1.3651 COc1cc(ccc1C=O)SC(C)C 62a_100000210206_100010290300 [0,2,0,0,0,0|1,0,1]=4 8654 B14R1.3651 COc1cc(ccc1C=O)SC(C)C 62a_100000697075_100000210206 [0,2,0,0,0,0|1,0,1]=4 8655 B14R1.3651 COc1cc(ccc1CO)C=C(C)C 271570a_100102525489_100011277633 [0,2,0,0,0,0|0,0,2]=4 8656 B14R1.3651 COc1cc(ccc1CO)NC(=O)C 22a_100012183141_100000070787 [0,2,0,0,0,0|1,0,1]=4 8657 B14R1.3651 COc1cc(ccc1CO)NC(C)C 34a_100012183141_100000210206 [0,2,0,0,0,0|1,0,0]=3 8658 B14R1.3651 COc1cc(ccc1CO)OC(C)C 34a_200000116926_100000210206 [0,2,0,0,0,0|1,0,0]=3 8659 B14R1.3651 COc1cc(ccc1CO)SC(C)C 62a_100000210206_100011277633 [0,2,0,0,0,0|1,0,0]=3 8660 B14R1.3651 COc1cc(ccc1CO)SC(C)C 62a_100011277633_100000210206 [0,2,0,0,0,0|1,0,0]=3 8661 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [0,2,0,0,0,0|0,0,1]=3 8662 B14R1.3651 COc1cc(ccc1SC)CN(C)C 270004a_100102631434_100000050949 [0,2,0,0,0,0|1,1,0]=4 8663 B14R1.3651 COc1cc(ccc1SC)SC(C)C 62a_200011001119_100000210206 [0,2,0,0,0,0|1,1,0]=4 8664 B14R1.3651 COc1cc(cnc1CO)SC(C)C 62a_100000210206_200010246159 [0,2,0,0,0,0|2,0,0]=4 8665 B14R1.3651 COc1cc(cnc1CO)SC(C)C 62a_200010246159_100000210206 [0,2,0,0,0,0|2,0,0]=4 8666 B14R1.3651 COc1cc(cnc1OC)CN(C)C 270004a_100102631434_100000117638 [0,2,0,0,0,0|2,0,0]=4 8667 B14R1.3651 COc1cc(cnc1OC)SC(C)C 62a_100000210206_100010234541 [0,2,0,0,0,0|2,0,0]=4 8668 B14R1.3651 COc1cc(ncc1CO)SC(C)C 62a_100000210206_100010714672 [0,2,0,0,0,0|2,0,0]=4 8669 B14R1.3651 COc1cc(ncc1CO)SC(C)C 62a_100010714672_100000210206 [0,2,0,0,0,0|2,0,0]=4 8670 B14R1.3651 COc1ccc(cc1OC)C=C(C)C 271570a_100102525489_100000187503 [0,2,0,0,0,0|0,0,2]=4 8671 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [0,2,0,0,0,0|0,0,1]=3 8672 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [0,2,0,0,0,0|0,0,1]=3 8673 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [0,2,0,0,0,0|0,0,1]=3 8674 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100000180827_200000210301 [0,2,0,0,0,0|1,0,0]=3 8675 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100102631434_100011233839 [0,2,0,0,0,0|1,0,0]=3 8676 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100000180827_200000210301 [0,2,0,0,0,0|1,0,0]=3 8677 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100102631434_100011233839 [0,2,0,0,0,0|1,0,0]=3 8678 B14R1.3651 COc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000170513 [0,2,0,0,0,0|1,0,0]=3 8679 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 2230a_100000180827_200025704644 [0,2,0,0,0,0|1,0,0]=3 8680 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 269982a_100000180827_200025704644 [0,2,0,0,0,0|1,0,0]=3 8681 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 11a_100000187404_100015343762 [0,2,0,0,0,0|1,0,1]=4 8682 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 1626a_100000187404_100015343762 [0,2,0,0,0,0|1,0,1]=4 8683 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 22a_100000187404_100000070787 [0,2,0,0,0,0|1,0,1]=4 8684 B14R1.3651 COc1ccc(cc1OC)NC(=O)C 527a_100000187404_100103153847 [0,2,0,0,0,0|1,0,1]=4 8685 B14R1.3651 COc1ccc(cc1OC)NC(C)C 34a_100000187404_100000210206 [0,2,0,0,0,0|1,0,0]=3 8686 B14R1.3651 COc1ccc(cc1OC)OC(C)C 34a_100000039706_100000210206 [0,2,0,0,0,0|1,0,0]=3 8687 B14R1.3651 COc1ccc(cc1OC)SC(C)C 62a_100000210206_100011356967 [0,2,0,0,0,0|1,0,0]=3 8688 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_100011493462_200000210301 [0,2,0,0,0,0|0,1,1]=4 8689 B14R1.3651 COc1ccc(cc1SC)CC(=O)C 62a_200000210301_100011493462 [0,2,0,0,0,0|0,1,1]=4 8690 B14R1.3651 COc1ccc(cc1SC)SC(C)C 62a_200009892704_100000210206 [0,2,0,0,0,0|1,1,0]=4 8691 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_100011493462_200025704644 [0,2,0,0,0,0|0,1,1]=4 8692 B14R1.3651 COc1ccc(cc1S[13CH3])CC(=O)C 62a_200025704644_100011493462 [0,2,0,0,0,0|0,1,1]=4 8693 B14R1.3651 COc1ccc(nc1OC)SC(C)C 62a_100000210206_100010214848 [0,2,0,0,0,0|2,0,0]=4 8694 B14R1.3651 COc1nc(ccc1CO)SC(C)C 62a_100000210206_100010988397 [0,2,0,0,0,0|2,0,0]=4 8695 B14R1.3651 COc1nc(ccc1CO)SC(C)C 62a_100010988397_100000210206 [0,2,0,0,0,0|2,0,0]=4 8696 B14R1.4106 CC(C)Oc1ccc(c(c1F)O[13CH3])Br 34a_202127810487_200025704644 [0,2,0,0,0,0|2,0,0]=4 8697 B14R1.4106 CC(C)Oc1ccc(c(c1F)O[13CH3])Br 7a_202127810487_200025704644 [0,2,0,0,0,0|2,0,0]=4 8698 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)Cl 1458a_100000070787_100010116237 [0,2,0,0,0,0|1,0,1]=4 8699 B14R1.4106 COc1c(ccc(c1F)CC(=O)C)F 1458a_100000070787_100009814548 [0,2,0,0,0,0|1,0,1]=4 8700 B14R1.4106 COc1c(ccc(c1F)CN(C)C)Cl 2230a_100102631434_100010116237 [0,2,0,0,0,0|2,0,0]=4 8701 B14R1.4106 COc1c(ccc(c1F)CN(C)C)Cl 269982a_100102631434_100010116237 [0,2,0,0,0,0|2,0,0]=4 8702 B14R1.4106 COc1c(ccc(c1F)CN(C)C)Cl 270004a_100102631434_100009889114 [0,2,0,0,0,0|2,0,0]=4 8703 B14R1.4106 COc1c(ccc(c1F)CN(C)C)F 2230a_100102631434_100009814548 [0,2,0,0,0,0|2,0,0]=4 8704 B14R1.4106 COc1c(ccc(c1F)CN(C)C)F 269982a_100102631434_100009814548 [0,2,0,0,0,0|2,0,0]=4 8705 B14R1.4106 COc1c(ccc(c1F)CN(C)C)F 270004a_100102631434_100000050928 [0,2,0,0,0,0|2,0,0]=4 8706 B14R1.4106 COc1c(ccc(c1F)NC(C)C)F 34a_100137314619_100000210206 [0,2,0,0,0,0|2,0,0]=4 8707 B14R1.4106 COc1c(ccc(c1F)OC(C)C)Br 34a_202127810487_200000210301 [0,2,0,0,0,0|2,0,0]=4 8708 B14R1.4106 COc1c(ccc(c1F)OC(C)C)Br 7a_202127810487_200000210301 [0,2,0,0,0,0|2,0,0]=4 8709 B14R1.4106 COc1c(ccc(c1F)OC(C)C)F 34a_100000062073_100000210206 [0,2,0,0,0,0|2,0,0]=4 8710 B14R1.4106 COc1c(ccc(c1F)OC(C)C)F 7a_100000062073_100000210206 [0,2,0,0,0,0|2,0,0]=4 8711 B14R1.4106 COc1c(ccc(c1F)SC(C)C)Cl 62a_100000210206_200135222481 [0,2,0,0,0,0|2,0,0]=4 8712 B14R1.4106 COc1c(ccc(c1F)SC(C)C)Cl 62a_200135222481_100000210206 [0,2,0,0,0,0|2,0,0]=4 8713 B14R1.4106 COc1c(ccc(c1F)SC(C)C)N 62a_100000210206_100010734149 [0,2,0,0,0,0|2,0,0]=4 8714 B14R1.4106 COc1c(ccc(c1F)SC(C)C)N 62a_100010734149_100000210206 [0,2,0,0,0,0|2,0,0]=4 8715 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)O 34a_100000070259_100000210202 [0,2,0,0,0,0|2,0,0]=4 8716 B14R1.489 CCNc1ccc(c(c1)NC(=O)C)O 7a_100000070259_100000210202 [0,2,0,0,0,0|2,0,0]=4 8717 B14R1.489 CCNc1ccc(c(c1)OC(F)F)C 2230a_100000756118_100000210202 [0,2,0,0,0,0|2,0,0]=4 8718 B14R1.489 CCNc1ccc(c(c1)OC(F)F)C 34a_100000756118_100000210202 [0,2,0,0,0,0|2,0,0]=4 8719 B14R1.489 CCNc1ccc(c(c1)OC(F)F)C 7a_100000756118_100000210202 [0,2,0,0,0,0|2,0,0]=4 8720 B14R1.489 CCNc1ccc(c(c1)OC(F)F)F 2230a_100009853020_100000210202 [0,2,0,0,0,0|2,0,0]=4 8721 B14R1.489 CCNc1ccc(c(c1)OC(F)F)F 34a_100009853020_100000210202 [0,2,0,0,0,0|2,0,0]=4 8722 B14R1.489 CCNc1ccc(c(c1)OC(F)F)F 7a_100009853020_100000210202 [0,2,0,0,0,0|2,0,0]=4 8723 B14R1.489 CCSc1ccc(c(c1)CC(=O)C)O 62a_100000210202_200010006938 [0,2,0,0,0,0|2,0,0]=4 8724 B14R1.489 CCSc1ccc(c(c1)CC(=O)C)O 62a_200010006938_100000210202 [0,2,0,0,0,0|2,0,0]=4 8725 B14R1.489 CCSc1ccc(c(c1)OC(=O)C)C 62a_100000210202_100103282185 [0,2,0,0,0,0|2,0,0]=4 8726 B14R1.489 CCSc1ccc(c(c1)OC(=O)C)C 62a_100103282185_100000210202 [0,2,0,0,0,0|2,0,0]=4 8727 B14R1.489 CCSc1ccc(c(c1)OC(C)C)C 62a_100000210202_200012359587 [0,2,0,0,0,0|2,0,0]=4 8728 B14R1.489 CCSc1ccc(c(c1)OC(C)C)C 62a_200012359587_100000210202 [0,2,0,0,0,0|2,0,0]=4 8729 B14R1.489 CCSc1ccc(c(c1)OC(C)C)F 62a_100000210202_200012350295 [0,2,0,0,0,0|2,0,0]=4 8730 B14R1.489 CCSc1ccc(c(c1)OC(C)C)F 62a_200012350295_100000210202 [0,2,0,0,0,0|2,0,0]=4 8731 B14R1.489 CCSc1ccc(c(c1)OC(F)F)F 62a_100000210202_100012359426 [0,2,0,0,0,0|2,0,0]=4 8732 B14R1.489 CCSc1ccc(c(c1)OC(F)F)F 62a_100012359426_100000210202 [0,2,0,0,0,0|2,0,0]=4 8733 B14R1.489 CCSc1ccc(c(c1)OC(F)F)N 62a_100010212277_100000210202 [0,2,0,0,0,0|2,0,0]=4 8734 B14R1.489 CNCc1ccc(c(c1)OC(C)C)F 207a_100102657272_200000111908 [0,2,0,0,0,0|2,0,0]=4 8735 B14R1.489 CNCc1ccc(c(c1)OC(C)C)F 270004a_106832991635_200000111908 [0,2,0,0,0,0|2,0,0]=4 8736 B14R1.489 CNCc1ccc(c(c1)OC(F)F)F 207a_100102657272_100009840957 [0,2,0,0,0,0|2,0,0]=4 8737 B14R1.489 CNCc1ccc(c(c1)OC(F)F)F 270004a_106832991635_100009840957 [0,2,0,0,0,0|2,0,0]=4 8738 B14R1.761 CCNCc1cc(ccc1O)SCC 62a_100000210202_100000765307 [0,2,0,0,0,0|2,0,0]=4 8739 B14R1.761 CCNCc1cc(ccc1O)SCC 62a_100000765307_100000210202 [0,2,0,0,0,0|2,0,0]=4 8740 B14R1.761 CCNc1ccc(c(c1)OCCF)Cl 34a_200012813738_100000210202 [0,2,0,0,0,0|2,0,0]=4 8741 B14R1.761 CCNc1ccc(c(c1)OCCF)Cl 7a_200012813738_100000210202 [0,2,0,0,0,0|2,0,0]=4 8742 B14R1.761 CCOc1ccc(c(c1)SCOC)C 62a_100000766300_100011099959 [0,2,0,0,0,0|2,0,0]=4 8743 B14R1.761 CCSc1ccc(c(c1)/C=N/OC)F 62a_100000210202_200009812721 [0,2,0,0,0,0|2,0,0]=4 8744 B14R1.761 CCSc1ccc(c(c1)/C=N/OC)F 62a_200009812721_100000210202 [0,2,0,0,0,0|2,0,0]=4 8745 B14R1.761 COCSc1cc(ccc1C)COC 62a_100000766300_200015395492 [0,2,0,0,0,0|2,0,0]=4 8746 B14R1.761 COCSc1cc(ccc1C)COC 62a_200015395492_100000766300 [0,2,0,0,0,0|2,0,0]=4 8747 B14R1.761 COCSc1cc(ccc1F)COC 62a_100000766300_200011493689 [0,2,0,0,0,0|2,0,0]=4 8748 B14R1.761 COCSc1cc(ccc1F)COC 62a_200011493689_100000766300 [0,2,0,0,0,0|2,0,0]=4 8749 B14R1.791 CCCCc1cc(c(cn1)N)OCC 271570a_100020621405_100015764953 [0,2,0,0,0,0|2,0,0]=4 8750 B14R1.791 CCCCc1ccc(c(c1)CNC)C 271570a_100020621405_106744473289 [0,2,0,0,0,0|2,0,0]=4 8751 B14R1.791 CCCCc1ccc(c(c1)CNC)F 271570a_100020621405_100000748472 [0,2,0,0,0,0|2,0,0]=4 8752 B14R1.791 CCCCc1ccc(c(c1)CNC)O 271570a_100020621405_100011602694 [0,2,0,0,0,0|1,0,0]=3 8753 B14R1.791 CCCCc1ccc(c(c1)COC)Br 271570a_100020621405_202125822959 [0,2,0,0,0,0|1,0,0]=3 8754 B14R1.791 CCCCc1ccc(c(c1)COC)F 271570a_100020621405_100010140362 [0,2,0,0,0,0|1,0,0]=3 8755 B14R1.791 CCCCc1ccc(c(c1)NCC)N 271570a_100020621405_100000696630 [0,2,0,0,0,0|2,0,0]=4 8756 B14R1.791 CCCCc1ccc(c(c1)OCC)C 271570a_100020621405_100012361169 [0,2,0,0,0,0|1,0,0]=3 8757 B14R1.791 CCCCc1ccc(c(c1)OCC)F 271570a_100020621405_200012344967 [0,2,0,0,0,0|1,0,0]=3 8758 B14R1.791 CCCCc1ccc(c(c1)OCC)N 271570a_100020621405_100000688918 [0,2,0,0,0,0|1,0,0]=3 8759 B14R1.791 CCCCc1cnc(c(c1)OCC)F 271570a_100020621405_100010732568 [0,2,0,0,0,0|2,0,0]=4 8760 B14R1.791 CCCNc1ccc(c(c1)OCC)Br 2230a_200016990551_100000210303 [0,2,0,0,0,0|1,0,0]=3 8761 B14R1.791 CCCNc1ccc(c(c1)OCC)Br 34a_200016990551_100000210303 [0,2,0,0,0,0|1,0,0]=3 8762 B14R1.791 CCCNc1ccc(c(c1)OCC)Br 7a_200016990551_100000210303 [0,2,0,0,0,0|1,0,0]=3 8763 B14R1.791 CCCNc1ccc(c(c1)OCC)Cl 2230a_100011964961_100000210303 [0,2,0,0,0,0|1,0,0]=3 8764 B14R1.791 CCCNc1ccc(c(c1)OCC)Cl 34a_100011964961_100000210303 [0,2,0,0,0,0|1,0,0]=3 8765 B14R1.791 CCCOc1ccc(c(c1)NCC)C 34a_100000211784_100000210303 [0,2,0,0,0,0|2,0,0]=4 8766 B14R1.791 CCCOc1ccc(c(c1)NCC)C 7a_100000211784_100000210303 [0,2,0,0,0,0|2,0,0]=4 8767 B14R1.791 CCCSc1cc(c(cn1)N)OCC 62a_100000210303_100015764953 [0,2,0,0,0,0|2,0,0]=4 8768 B14R1.791 CCCSc1cc(c(cn1)N)OCC 62a_100015764953_100000210303 [0,2,0,0,0,0|2,0,0]=4 8769 B14R1.791 CCCSc1ccc(c(c1)CNC)C 62a_100000210303_106744473289 [0,2,0,0,0,0|2,0,0]=4 8770 B14R1.791 CCCSc1ccc(c(c1)CNC)C 62a_106744473289_100000210303 [0,2,0,0,0,0|2,0,0]=4 8771 B14R1.791 CCCSc1ccc(c(c1)CNC)F 62a_100000210303_100000748472 [0,2,0,0,0,0|2,0,0]=4 8772 B14R1.791 CCCSc1ccc(c(c1)CNC)F 62a_100000748472_100000210303 [0,2,0,0,0,0|2,0,0]=4 8773 B14R1.791 CCCSc1ccc(c(c1)CNC)O 62a_100000210303_100011602694 [0,2,0,0,0,0|1,0,0]=3 8774 B14R1.791 CCCSc1ccc(c(c1)CNC)O 62a_100011602694_100000210303 [0,2,0,0,0,0|1,0,0]=3 8775 B14R1.791 CCCSc1ccc(c(c1)COC)Br 62a_100000210303_202125822959 [0,2,0,0,0,0|1,0,0]=3 8776 B14R1.791 CCCSc1ccc(c(c1)COC)Br 62a_202125822959_100000210303 [0,2,0,0,0,0|1,0,0]=3 8777 B14R1.791 CCCSc1ccc(c(c1)COC)F 62a_100000210303_100010140362 [0,2,0,0,0,0|1,0,0]=3 8778 B14R1.791 CCCSc1ccc(c(c1)COC)F 62a_100010140362_100000210303 [0,2,0,0,0,0|1,0,0]=3 8779 B14R1.791 CCCSc1ccc(c(c1)NCC)N 62a_100000210303_100000696630 [0,2,0,0,0,0|2,0,0]=4 8780 B14R1.791 CCCSc1ccc(c(c1)NCC)N 62a_100000696630_100000210303 [0,2,0,0,0,0|2,0,0]=4 8781 B14R1.791 CCCSc1ccc(c(c1)OCC)C 62a_100000210303_100012361169 [0,2,0,0,0,0|1,0,0]=3 8782 B14R1.791 CCCSc1ccc(c(c1)OCC)C 62a_100012361169_100000210303 [0,2,0,0,0,0|1,0,0]=3 8783 B14R1.791 CCCSc1ccc(c(c1)OCC)F 62a_100000210303_200012344967 [0,2,0,0,0,0|1,0,0]=3 8784 B14R1.791 CCCSc1ccc(c(c1)OCC)F 62a_200012344967_100000210303 [0,2,0,0,0,0|1,0,0]=3 8785 B14R1.791 CCCSc1ccc(c(c1)OCC)N 62a_100000688918_100000210303 [0,2,0,0,0,0|1,0,0]=3 8786 B14R1.791 CCCSc1cnc(c(c1)OCC)F 62a_100000210303_100010732568 [0,2,0,0,0,0|2,0,0]=4 8787 B14R1.791 CCCSc1cnc(c(c1)OCC)F 62a_100010732568_100000210303 [0,2,0,0,0,0|2,0,0]=4 8788 B14R1.791 CCNCc1ccc(c(c1)OCC)Br 207a_100015525214_200010381951 [0,2,0,0,0,0|1,0,0]=3 8789 B14R1.791 CCNCc1ccc(c(c1)OCC)Br 270004a_100015525214_200010381951 [0,2,0,0,0,0|1,0,0]=3 8790 B14R1.791 CCNCc1ccc(c(c1)OCC)F 207a_100015525214_200000106648 [0,2,0,0,0,0|1,0,0]=3 8791 B14R1.791 CCNCc1ccc(c(c1)OCC)F 270004a_100015525214_200000106648 [0,2,0,0,0,0|1,0,0]=3 8792 B14R1.791 CCNCc1ccc(c(c1)OCC)O 34a_200000751567_100000210202 [0,2,0,0,0,0|0,0,0]=2 8793 B14R1.791 CCOc1cc(ccc1Br)NCCF 2230a_200016990551_100011217306 [0,2,0,0,0,0|2,0,0]=4 8794 B14R1.791 CCOc1cc(ccc1Br)NCCF 34a_200016990551_100011217306 [0,2,0,0,0,0|2,0,0]=4 8795 B14R1.791 CCOc1cc(ccc1Br)NCCF 7a_200016990551_100011217306 [0,2,0,0,0,0|2,0,0]=4 8796 B14R1.791 CCOc1cc(ccc1Br)NCCO 2230a_200016990551_100000211926 [0,2,0,0,0,0|2,0,0]=4 8797 B14R1.791 CCOc1cc(ccc1Br)NCCO 34a_200016990551_100000211926 [0,2,0,0,0,0|2,0,0]=4 8798 B14R1.791 CCOc1cc(ccc1Br)NCCO 7a_200016990551_100000211926 [0,2,0,0,0,0|2,0,0]=4 8799 B14R1.791 CCOc1cc(ccc1Br)NCOC 2230a_200016990551_100000766300 [0,2,0,0,0,0|2,0,0]=4 8800 B14R1.791 CCOc1cc(ccc1Br)NCSC 2230a_200016990551_100011218213 [0,2,0,0,0,0|2,0,0]=4 8801 B14R1.791 CCOc1cc(ccc1Br)NCSC 34a_200016990551_100011218213 [0,2,0,0,0,0|2,0,0]=4 8802 B14R1.791 CCOc1cc(ccc1C)NCCO 34a_100000057592_100000210202 [0,2,0,0,0,0|2,0,0]=4 8803 B14R1.791 CCOc1cc(ccc1C)NCCO 7a_100000057592_100000210202 [0,2,0,0,0,0|2,0,0]=4 8804 B14R1.791 CCOc1cc(ccc1C)SCCF 62a_100011217306_100012361169 [0,2,0,0,0,0|2,0,0]=4 8805 B14R1.791 CCOc1cc(ccc1C)SCCF 62a_100012361169_100011217306 [0,2,0,0,0,0|2,0,0]=4 8806 B14R1.791 CCOc1cc(ccc1C)SCCO 62a_100000211926_100012361169 [0,2,0,0,0,0|2,0,0]=4 8807 B14R1.791 CCOc1cc(ccc1C)SCCO 62a_100012361169_100000211926 [0,2,0,0,0,0|2,0,0]=4 8808 B14R1.791 CCOc1cc(ccc1C)SCOC 62a_100000766300_100012361169 [0,2,0,0,0,0|2,0,0]=4 8809 B14R1.791 CCOc1cc(ccc1C)SCOC 62a_100012361169_100000766300 [0,2,0,0,0,0|2,0,0]=4 8810 B14R1.791 CCOc1cc(ccc1C)SCSC 62a_100011218213_100012361169 [0,2,0,0,0,0|2,0,0]=4 8811 B14R1.791 CCOc1cc(ccc1C)SCSC 62a_100012361169_100011218213 [0,2,0,0,0,0|2,0,0]=4 8812 B14R1.791 CCOc1cc(ccc1Cl)NCCF 2230a_100011964961_100011217306 [0,2,0,0,0,0|2,0,0]=4 8813 B14R1.791 CCOc1cc(ccc1Cl)NCCF 34a_100011964961_100011217306 [0,2,0,0,0,0|2,0,0]=4 8814 B14R1.791 CCOc1cc(ccc1Cl)NCCO 2230a_100011964961_100000211926 [0,2,0,0,0,0|2,0,0]=4 8815 B14R1.791 CCOc1cc(ccc1Cl)NCCO 34a_100011964961_100000211926 [0,2,0,0,0,0|2,0,0]=4 8816 B14R1.791 CCOc1cc(ccc1Cl)NCOC 2230a_100011964961_100000766300 [0,2,0,0,0,0|2,0,0]=4 8817 B14R1.791 CCOc1cc(ccc1Cl)NCSC 2230a_100011964961_100011218213 [0,2,0,0,0,0|2,0,0]=4 8818 B14R1.791 CCOc1cc(ccc1Cl)NCSC 34a_100011964961_100011218213 [0,2,0,0,0,0|2,0,0]=4 8819 B14R1.791 CCOc1cc(ccc1F)SCCF 62a_100011217306_200012344967 [0,2,0,0,0,0|2,0,0]=4 8820 B14R1.791 CCOc1cc(ccc1F)SCCF 62a_200012344967_100011217306 [0,2,0,0,0,0|2,0,0]=4 8821 B14R1.791 CCOc1cc(ccc1F)SCCO 62a_100000211926_200012344967 [0,2,0,0,0,0|2,0,0]=4 8822 B14R1.791 CCOc1cc(ccc1F)SCCO 62a_200012344967_100000211926 [0,2,0,0,0,0|2,0,0]=4 8823 B14R1.791 CCOc1cc(ccc1F)SCOC 62a_100000766300_200012344967 [0,2,0,0,0,0|2,0,0]=4 8824 B14R1.791 CCOc1cc(ccc1F)SCOC 62a_200012344967_100000766300 [0,2,0,0,0,0|2,0,0]=4 8825 B14R1.791 CCOc1cc(ccc1F)SCSC 62a_100011218213_200012344967 [0,2,0,0,0,0|2,0,0]=4 8826 B14R1.791 CCOc1cc(ccc1F)SCSC 62a_200012344967_100011218213 [0,2,0,0,0,0|2,0,0]=4 8827 B14R1.791 CCOc1cc(ccc1N)SCCF 62a_100000688918_100011217306 [0,2,0,0,0,0|2,0,0]=4 8828 B14R1.791 CCOc1cc(ccc1N)SCCO 62a_100000688918_100000211926 [0,2,0,0,0,0|2,0,0]=4 8829 B14R1.791 CCOc1cc(ccc1N)SCOC 62a_100000688918_100000766300 [0,2,0,0,0,0|2,0,0]=4 8830 B14R1.791 CCOc1cc(ccc1N)SCSC 62a_100000688918_100011218213 [0,2,0,0,0,0|2,0,0]=4 8831 B14R1.791 CCOc1cc(ccc1O)CNCF 34a_200000751567_100015361967 [0,2,0,0,0,0|1,0,0]=3 8832 B14R1.791 CNCc1cc(ccc1O)SCCF 62a_100011217306_100011602694 [0,2,0,0,0,0|2,0,0]=4 8833 B14R1.791 CNCc1cc(ccc1O)SCCF 62a_100011602694_100011217306 [0,2,0,0,0,0|2,0,0]=4 8834 B14R1.791 CNCc1cc(ccc1O)SCCO 62a_100000211926_100011602694 [0,2,0,0,0,0|2,0,0]=4 8835 B14R1.791 CNCc1cc(ccc1O)SCCO 62a_100011602694_100000211926 [0,2,0,0,0,0|2,0,0]=4 8836 B14R1.791 CNCc1cc(ccc1O)SCOC 62a_100000766300_100011602694 [0,2,0,0,0,0|2,0,0]=4 8837 B14R1.791 CNCc1cc(ccc1O)SCOC 62a_100011602694_100000766300 [0,2,0,0,0,0|2,0,0]=4 8838 B14R1.791 CNCc1cc(ccc1O)SCSC 62a_100011218213_100011602694 [0,2,0,0,0,0|2,0,0]=4 8839 B14R1.791 CNCc1cc(ccc1O)SCSC 62a_100011602694_100011218213 [0,2,0,0,0,0|2,0,0]=4 8840 B14R1.791 COCSc1ccc(c(c1)COC)Br 62a_100000766300_202125822959 [0,2,0,0,0,0|2,0,0]=4 8841 B14R1.791 COCSc1ccc(c(c1)COC)Br 62a_202125822959_100000766300 [0,2,0,0,0,0|2,0,0]=4 8842 B14R1.791 COCSc1ccc(c(c1)COC)F 62a_100000766300_100010140362 [0,2,0,0,0,0|2,0,0]=4 8843 B14R1.791 COCSc1ccc(c(c1)COC)F 62a_100010140362_100000766300 [0,2,0,0,0,0|2,0,0]=4 8844 B14R1.791 COCc1cc(ccc1Br)SCCF 62a_100011217306_202125822959 [0,2,0,0,0,0|2,0,0]=4 8845 B14R1.791 COCc1cc(ccc1Br)SCCF 62a_202125822959_100011217306 [0,2,0,0,0,0|2,0,0]=4 8846 B14R1.791 COCc1cc(ccc1Br)SCCO 62a_100000211926_202125822959 [0,2,0,0,0,0|2,0,0]=4 8847 B14R1.791 COCc1cc(ccc1Br)SCCO 62a_202125822959_100000211926 [0,2,0,0,0,0|2,0,0]=4 8848 B14R1.791 COCc1cc(ccc1Br)SCSC 62a_100011218213_202125822959 [0,2,0,0,0,0|2,0,0]=4 8849 B14R1.791 COCc1cc(ccc1Br)SCSC 62a_202125822959_100011218213 [0,2,0,0,0,0|2,0,0]=4 8850 B14R1.791 COCc1cc(ccc1F)SCCF 62a_100010140362_100011217306 [0,2,0,0,0,0|2,0,0]=4 8851 B14R1.791 COCc1cc(ccc1F)SCCF 62a_100011217306_100010140362 [0,2,0,0,0,0|2,0,0]=4 8852 B14R1.791 COCc1cc(ccc1F)SCCO 62a_100000211926_100010140362 [0,2,0,0,0,0|2,0,0]=4 8853 B14R1.791 COCc1cc(ccc1F)SCCO 62a_100010140362_100000211926 [0,2,0,0,0,0|2,0,0]=4 8854 B14R1.791 COCc1cc(ccc1F)SCSC 62a_100010140362_100011218213 [0,2,0,0,0,0|2,0,0]=4 8855 B14R1.791 COCc1cc(ccc1F)SCSC 62a_100011218213_100010140362 [0,2,0,0,0,0|2,0,0]=4 8856 B14R1.791 Cc1ccc(cc1OCF)NCCO 34a_100000057592_100015361967 [0,2,0,0,0,0|2,0,0]=4 8857 B14R1.791 Cc1ccc(cc1OCF)NCCO 7a_100000057592_100015361967 [0,2,0,0,0,0|2,0,0]=4 8858 B14R1.3235 CCOc1cc(cc(c1F)F)SCC 62a_100000210202_200012359421 [0,2,0,0,0,0|2,0,0]=4 8859 B14R1.3235 CCOc1cc(cc(c1F)F)SCC 62a_200012359421_100000210202 [0,2,0,0,0,0|2,0,0]=4 8860 B14R1.6787 CC=Cc1cc(ccc1OC)CCN 271570a_100016259895_103549771065 [0,2,0,0,0,0|2,0,0]=4 8861 B14R1.6787 CC=Cc1cc(ccc1OC)CCO 271570a_100016259895_100011962876 [0,2,0,0,0,0|2,0,0]=4 8862 B14R1.6787 CC=Cc1ccc(c(c1)COC)OC 271570a_100016259895_200011493686 [0,2,0,0,0,0|0,0,2]=4 8863 B14R1.6787 CC=Cc1ccc(c(c1)OCC)OC 271570a_100016259895_200010219349 [0,2,0,0,0,0|0,0,2]=4 8864 B14R1.6787 CCOc1cc(ccc1C#N)SCC 62a_100000210202_100013120067 [0,2,0,0,0,0|2,0,0]=4 8865 B14R1.6787 CCOc1cc(ccc1OC)CC#N 7a_200000061240_200000210301 [0,2,0,0,0,0|1,0,1]=4 8866 B14R1.6787 CCOc1cc(ccc1OC)CCN 34a_100011207234_100000210202 [0,2,0,0,0,0|1,0,0]=3 8867 B14R1.6787 CCOc1cc(ccc1OC)CNC 207a_100102657272_100000170514 [0,2,0,0,0,0|1,0,0]=3 8868 B14R1.6787 CCOc1cc(ccc1OC)CNC 2230a_100000755831_200000210301 [0,2,0,0,0,0|1,0,0]=3 8869 B14R1.6787 CCOc1cc(ccc1OC)CNC 270004a_106832991635_100000170514 [0,2,0,0,0,0|1,0,0]=3 8870 B14R1.6787 CCOc1cc(ccc1OC)CNC 34a_100000188468_100000210202 [0,2,0,0,0,0|1,0,0]=3 8871 B14R1.6787 CCOc1cc(ccc1OC)CNC 34a_100000755831_200000210301 [0,2,0,0,0,0|1,0,0]=3 8872 B14R1.6787 CCOc1cc(ccc1OC)CN[13CH3] 2230a_100000755831_200025704644 [0,2,0,0,0,0|1,0,0]=3 8873 B14R1.6787 CCOc1cc(ccc1OC)CN[13CH3] 34a_100000755831_200025704644 [0,2,0,0,0,0|1,0,0]=3 8874 B14R1.6787 CCOc1cc(ccc1O[13CH3])CC#N 7a_200000061240_200025704644 [0,2,0,0,0,0|1,0,1]=4 8875 B14R1.6787 CCSc1cc(ccc1OC)CCN 62a_100000210202_103549771065 [0,2,0,0,0,0|1,1,0]=4 8876 B14R1.6787 CCSc1cc(ccc1OC)CCN 62a_103549771065_100000210202 [0,2,0,0,0,0|1,1,0]=4 8877 B14R1.6787 CCSc1cc(ccc1OC)CCO 62a_100000210202_100011962876 [0,2,0,0,0,0|1,1,0]=4 8878 B14R1.6787 CCSc1cc(ccc1OC)CCO 62a_100011962876_100000210202 [0,2,0,0,0,0|1,1,0]=4 8879 B14R1.6787 CCSc1ccc(c(c1)CCN)OC 62a_100000210202_100000763266 [0,2,0,0,0,0|2,0,0]=4 8880 B14R1.6787 CCSc1ccc(c(c1)CCN)OC 62a_100000763266_100000210202 [0,2,0,0,0,0|2,0,0]=4 8881 B14R1.6787 CCSc1ccc(c(c1)CNC)OC 62a_100000210202_100000690607 [0,2,0,0,0,0|2,0,0]=4 8882 B14R1.6787 CCSc1ccc(c(c1)CNC)OC 62a_100000690607_100000210202 [0,2,0,0,0,0|2,0,0]=4 8883 B14R1.6787 CCSc1ccc(c(c1)COC)OC 62a_100000210202_200011493686 [0,2,0,0,0,0|1,0,0]=3 8884 B14R1.6787 CCSc1ccc(c(c1)COC)OC 62a_200011493686_100000210202 [0,2,0,0,0,0|1,0,0]=3 8885 B14R1.6787 CNCc1ccc(c(c1)COC)OC 207a_100102657272_100000708483 [0,2,0,0,0,0|1,0,0]=3 8886 B14R1.6787 CNCc1ccc(c(c1)COC)OC 270004a_106832991635_100000708483 [0,2,0,0,0,0|1,0,0]=3 8887 B14R1.6787 CNCc1ccc(c(c1)OCF)OC 34a_100000188468_100015361967 [0,2,0,0,0,0|1,0,0]=3 8888 B14R1.6787 COCc1cc(ccc1OC)SCF 62a_100015361967_200011493686 [0,2,0,0,0,0|2,0,0]=4 8889 B14R1.6787 COCc1cc(ccc1OC)SCF 62a_200011493686_100015361967 [0,2,0,0,0,0|2,0,0]=4 8890 B14R1.6787 COc1ccc(cc1OCF)CCN 34a_100011207234_100015361967 [0,2,0,0,0,0|1,0,0]=3 8891 B14R1.6787 COc1ccc(cc1SCF)CCN 62a_100015361967_103549771065 [0,2,0,0,0,0|1,1,0]=4 8892 B14R1.6787 COc1ccc(cc1SCF)CCN 62a_103549771065_100015361967 [0,2,0,0,0,0|1,1,0]=4 8893 B14R1.6787 COc1ccc(cc1SCF)CCO 62a_100011962876_100015361967 [0,2,0,0,0,0|1,1,0]=4 8894 B14R1.6787 COc1ccc(cc1SCF)CCO 62a_100015361967_100011962876 [0,2,0,0,0,0|1,1,0]=4 8895 B14R1.6795 CC=Cc1ccc(c(c1)C(=O)OC)O 271570a_100016259895_100000149868 [0,2,0,0,0,0|0,0,2]=4 8896 B14R1.6795 CCCc1ccc(c(c1)C(C)NC)O 269862a_106832991636_200011698639 [0,2,0,0,0,0|1,0,0]=3 8897 B14R1.6795 CCOc1ccc(c(c1)C(=O)CC)O 1458a_200011255221_100000210202 [0,2,0,0,0,0|2,0,0]=4 8898 B14R1.6795 CCOc1ccc(c(c1)C(=O)CF)O 1458a_200011255221_100015361967 [0,2,0,0,0,0|2,0,0]=4 8899 B14R1.6795 CCOc1ccc(c(c1)C(=O)NC)O 240690a_100102657272_200011255221 [0,2,0,0,0,0|2,0,0]=4 8900 B14R1.6795 CCOc1ccc(c(c1)C(=O)NC)O 527a_100102657272_200011255221 [0,2,0,0,0,0|2,0,0]=4 8901 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Br 34a_100010230369_100000210202 [0,2,0,0,0,0|2,0,0]=4 8902 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Br 7a_100010230369_100000210202 [0,2,0,0,0,0|2,0,0]=4 8903 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)C 34a_100012002527_100000210202 [0,2,0,0,0,0|2,0,0]=4 8904 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)C 7a_100012002527_100000210202 [0,2,0,0,0,0|2,0,0]=4 8905 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Cl 34a_100012001761_100000210202 [0,2,0,0,0,0|2,0,0]=4 8906 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)Cl 7a_100012001761_100000210202 [0,2,0,0,0,0|2,0,0]=4 8907 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)F 34a_100009856154_100000210202 [0,2,0,0,0,0|2,0,0]=4 8908 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)F 7a_100009856154_100000210202 [0,2,0,0,0,0|2,0,0]=4 8909 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)I 34a_200009888904_100000210202 [0,2,0,0,0,0|2,0,0]=4 8910 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)I 7a_200009888904_100000210202 [0,2,0,0,0,0|2,0,0]=4 8911 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)N 34a_100000694981_100000210202 [0,2,0,0,0,0|2,0,0]=4 8912 B14R1.6795 CCOc1ccc(c(c1)C(=O)OC)N 7a_100000694981_100000210202 [0,2,0,0,0,0|2,0,0]=4 8913 B14R1.6795 CCSc1cc(c(cn1)O)C(=O)OC 62a_100000210202_100010136202 [0,2,0,0,0,0|2,0,0]=4 8914 B14R1.6795 CCSc1cc(c(cn1)O)C(=O)OC 62a_100010136202_100000210202 [0,2,0,0,0,0|2,0,0]=4 8915 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Br 62a_100000210202_100012340073 [0,2,0,0,0,0|2,0,0]=4 8916 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Br 62a_100012340073_100000210202 [0,2,0,0,0,0|2,0,0]=4 8917 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)C 62a_100000210202_100012360116 [0,2,0,0,0,0|2,0,0]=4 8918 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)C 62a_100012360116_100000210202 [0,2,0,0,0,0|2,0,0]=4 8919 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Cl 62a_100000210202_100012353682 [0,2,0,0,0,0|2,0,0]=4 8920 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)Cl 62a_100012353682_100000210202 [0,2,0,0,0,0|2,0,0]=4 8921 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)F 62a_100000210202_100000216675 [0,2,0,0,0,0|2,0,0]=4 8922 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)F 62a_100000216675_100000210202 [0,2,0,0,0,0|2,0,0]=4 8923 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)N 62a_100000212070_100000210202 [0,2,0,0,0,0|2,0,0]=4 8924 B14R1.6795 CCSc1ccc(c(c1)C(=O)OC)O 62a_100000210202_100000149868 [0,2,0,0,0,0|1,0,0]=3 8925 B14R1.6795 CCSc1ccc(c(n1)C(=O)OC)O 62a_100000210202_100000697862 [0,2,0,0,0,0|2,0,0]=4 8926 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 2230a_106832991635_200012349814 [0,2,0,0,0,0|2,0,0]=4 8927 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 26a_100102657272_100010230369 [0,2,0,0,0,0|2,0,0]=4 8928 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 270004a_106832991635_100013328361 [0,2,0,0,0,0|2,0,0]=4 8929 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 34a_100102657272_200012349814 [0,2,0,0,0,0|2,0,0]=4 8930 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Br 7a_106832991635_200012349814 [0,2,0,0,0,0|2,0,0]=4 8931 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)C 270004a_106832991635_100010280812 [0,2,0,0,0,0|2,0,0]=4 8932 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 2230a_106832991635_100010269346 [0,2,0,0,0,0|2,0,0]=4 8933 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 270004a_106832991635_200010632534 [0,2,0,0,0,0|2,0,0]=4 8934 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 34a_100102657272_100010269346 [0,2,0,0,0,0|2,0,0]=4 8935 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)Cl 7a_106832991635_100010269346 [0,2,0,0,0,0|2,0,0]=4 8936 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 2230a_106832991635_200013328350 [0,2,0,0,0,0|2,0,0]=4 8937 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 270004a_106832991635_100012056738 [0,2,0,0,0,0|2,0,0]=4 8938 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 34a_100102657272_200013328350 [0,2,0,0,0,0|2,0,0]=4 8939 B14R1.6795 CNCc1ccc(c(c1)C(=O)OC)F 7a_106832991635_200013328350 [0,2,0,0,0,0|2,0,0]=4 8940 B14R1.6795 COC(=O)c1cc(ccc1Br)CSC 62a_200000210301_200012349814 [0,2,0,0,0,0|2,0,0]=4 8941 B14R1.6795 COC(=O)c1cc(ccc1Br)CSC 62a_200012349814_200000210301 [0,2,0,0,0,0|2,0,0]=4 8942 B14R1.6795 COC(=O)c1cc(ccc1Br)CS[13CH3] 62a_200012349814_200025704644 [0,2,0,0,0,0|2,0,0]=4 8943 B14R1.6795 COC(=O)c1cc(ccc1Br)CS[13CH3] 62a_200025704644_200012349814 [0,2,0,0,0,0|2,0,0]=4 8944 B14R1.6795 COC(=O)c1cc(ccc1Cl)CSC 62a_100010269346_200000210301 [0,2,0,0,0,0|2,0,0]=4 8945 B14R1.6795 COC(=O)c1cc(ccc1Cl)CSC 62a_200000210301_100010269346 [0,2,0,0,0,0|2,0,0]=4 8946 B14R1.6795 COC(=O)c1cc(ccc1Cl)CS[13CH3] 62a_100010269346_200025704644 [0,2,0,0,0,0|2,0,0]=4 8947 B14R1.6795 COC(=O)c1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100010269346 [0,2,0,0,0,0|2,0,0]=4 8948 B14R1.6795 COC(=O)c1cc(ccc1F)CO[13CH3] 34a_100009832128_200025704644 [0,2,0,0,0,0|2,0,0]=4 8949 B14R1.6795 COC(=O)c1cc(ccc1F)CO[13CH3] 7a_100009832128_200025704644 [0,2,0,0,0,0|2,0,0]=4 8950 B14R1.6795 COC(=O)c1cc(ccc1F)CSC 62a_200000210301_200013328350 [0,2,0,0,0,0|2,0,0]=4 8951 B14R1.6795 COC(=O)c1cc(ccc1F)CSC 62a_200013328350_200000210301 [0,2,0,0,0,0|2,0,0]=4 8952 B14R1.6795 COC(=O)c1cc(ccc1F)CS[13CH3] 62a_200013328350_200025704644 [0,2,0,0,0,0|2,0,0]=4 8953 B14R1.6795 COC(=O)c1cc(ccc1F)CS[13CH3] 62a_200025704644_200013328350 [0,2,0,0,0,0|2,0,0]=4 8954 B14R1.6795 COC(=O)c1cc(ccc1O)SCF 62a_100015361967_100000149868 [0,2,0,0,0,0|2,0,0]=4 8955 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)Br 34a_100138415774_200012349814 [0,2,0,0,0,0|2,0,0]=4 8956 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)Cl 34a_100138415774_100010269346 [0,2,0,0,0,0|2,0,0]=4 8957 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)F 34a_100009832128_200000210301 [0,2,0,0,0,0|2,0,0]=4 8958 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)F 34a_100138415774_200013328350 [0,2,0,0,0,0|2,0,0]=4 8959 B14R1.6795 COCc1ccc(c(c1)C(=O)OC)F 7a_100009832128_200000210301 [0,2,0,0,0,0|2,0,0]=4 8960 B14R1.10284 CCNc1ccc(c(c1F)OCC)F 34a_100000061556_100000210202 [0,2,0,0,0,0|2,0,0]=4 8961 B14R1.10284 CCOc1c(ccc(c1F)CNC)Cl 207a_100102657272_200010116236 [0,2,0,0,0,0|2,0,0]=4 8962 B14R1.10284 CCOc1c(ccc(c1F)CNC)Cl 270004a_106832991635_200010116236 [0,2,0,0,0,0|2,0,0]=4 8963 B14R1.10284 CCOc1c(ccc(c1F)CNC)F 207a_100102657272_100000061586 [0,2,0,0,0,0|2,0,0]=4 8964 B14R1.10284 CCOc1c(ccc(c1F)CNC)F 2230a_106832991635_200009814558 [0,2,0,0,0,0|2,0,0]=4 8965 B14R1.10284 CCOc1c(ccc(c1F)CNC)F 270004a_106832991635_100000061586 [0,2,0,0,0,0|2,0,0]=4 8966 B14R1.10284 CCOc1c(ccc(c1F)CNC)F 34a_100102657272_200009814558 [0,2,0,0,0,0|2,0,0]=4 8967 B14R1.10284 CCOc1c(ccc(c1F)CNC)F 7a_106832991635_200009814558 [0,2,0,0,0,0|2,0,0]=4 8968 B14R1.10284 CCOc1c(ccc(c1F)COC)Cl 34a_200010116239_200000210301 [0,2,0,0,0,0|2,0,0]=4 8969 B14R1.10284 CCOc1c(ccc(c1F)COC)Cl 7a_200010116239_200000210301 [0,2,0,0,0,0|2,0,0]=4 8970 B14R1.10284 CCOc1c(ccc(c1F)COC)F 34a_100138415774_200009814558 [0,2,0,0,0,0|2,0,0]=4 8971 B14R1.10284 CCOc1c(ccc(c1F)CO[13CH3])Cl 34a_200010116239_200025704644 [0,2,0,0,0,0|2,0,0]=4 8972 B14R1.10284 CCOc1c(ccc(c1F)CO[13CH3])Cl 7a_200010116239_200025704644 [0,2,0,0,0,0|2,0,0]=4 8973 B14R1.10284 CCOc1c(ccc(c1F)CSC)F 62a_200000210301_200009814558 [0,2,0,0,0,0|2,0,0]=4 8974 B14R1.10284 CCOc1c(ccc(c1F)CSC)F 62a_200009814558_200000210301 [0,2,0,0,0,0|2,0,0]=4 8975 B14R1.10284 CCOc1c(ccc(c1F)CS[13CH3])F 62a_200009814558_200025704644 [0,2,0,0,0,0|2,0,0]=4 8976 B14R1.10284 CCOc1c(ccc(c1F)CS[13CH3])F 62a_200025704644_200009814558 [0,2,0,0,0,0|2,0,0]=4 8977 B14R1.10284 CCOc1ccc(c(c1F)COC)F 34a_100000070290_200000210301 [0,2,0,0,0,0|2,0,0]=4 8978 B14R1.10284 CCOc1ccc(c(c1F)COC)F 34a_100138415774_100010240091 [0,2,0,0,0,0|2,0,0]=4 8979 B14R1.10284 CCOc1ccc(c(c1F)COC)F 7a_100000070290_200000210301 [0,2,0,0,0,0|2,0,0]=4 8980 B14R1.10284 CCOc1ccc(c(c1F)CO[13CH3])F 34a_100000070290_200025704644 [0,2,0,0,0,0|2,0,0]=4 8981 B14R1.10284 CCOc1ccc(c(c1F)CO[13CH3])F 7a_100000070290_200025704644 [0,2,0,0,0,0|2,0,0]=4 8982 B14R1.492 CC=Cc1ccc(c(c1)OC)B(O)O 271570a_100016259895_100010245881 [0,2,0,0,0,0|0,0,2]=4 8983 B14R1.492 CCNc1ccc(c(c1)OC)[N+](=O)[O-] 2230a_102125277084_100000210202 [0,2,0,0,0,0|1,0,1]=4 8984 B14R1.492 CCNc1ccc(c(c1)OC)[N+](=O)[O-] 34a_102125277084_100000210202 [0,2,0,0,0,0|1,0,1]=4 8985 B14R1.492 CCOc1ccc(c(c1)OC)C(=O)C 34a_100000116857_100000210202 [0,2,0,0,0,0|1,0,1]=4 8986 B14R1.492 CCOc1ccc(c(c1)OC)C(=O)C 7a_100000040345_200000210301 [0,2,0,0,0,0|1,0,1]=4 8987 B14R1.492 CCOc1ccc(c(c1)OC)C(=O)C 7a_100000116857_100000210202 [0,2,0,0,0,0|1,0,1]=4 8988 B14R1.492 CCOc1ccc(c(c1)OC)[N+](=O)[O-] 34a_100000723347_100000210202 [0,2,0,0,0,0|1,0,1]=4 8989 B14R1.492 CCOc1ccc(c(c1)OC)[N+](=O)[O-] 7a_100000723347_100000210202 [0,2,0,0,0,0|1,0,1]=4 8990 B14R1.492 CCOc1ccc(c(c1)O[13CH3])C(=O)C 7a_100000040345_200025704644 [0,2,0,0,0,0|1,0,1]=4 8991 B14R1.492 CCSc1ccc(c(c1)CC)B(O)O 62a_100000210202_200010732553 [0,2,0,0,0,0|2,0,0]=4 8992 B14R1.492 CCSc1ccc(c(c1)CC)B(O)O 62a_200010732553_100000210202 [0,2,0,0,0,0|2,0,0]=4 8993 B14R1.492 CCSc1ccc(c(c1)OC)B(O)O 62a_100010245881_100000210202 [0,2,0,0,0,0|1,0,0]=3 8994 B14R1.492 CCSc1ccc(c(c1)OC)C(=O)C 62a_100000709911_100000210202 [0,2,0,0,0,0|1,0,1]=4 8995 B14R1.492 CCSc1ccc(c(c1)OC)C(=O)N 62a_100000748320_100000210202 [0,2,0,0,0,0|1,0,1]=4 8996 B14R1.492 CCSc1ccc(c(c1)OC)C(F)F 62a_100000210202_100010146106 [0,2,0,0,0,0|2,0,0]=4 8997 B14R1.492 CCSc1ccc(c(c1)OC)C(F)F 62a_100010146106_100000210202 [0,2,0,0,0,0|2,0,0]=4 8998 B14R1.492 CCSc1ccc(c(n1)OC)B(O)O 62a_100000101703_100000210202 [0,2,0,0,0,0|2,0,0]=4 8999 B14R1.492 CCSc1ccc(c(n1)OC)B(O)O 62a_100000210202_100000101703 [0,2,0,0,0,0|2,0,0]=4 9000 B14R1.492 CNCc1ccc(c(c1)OC)C(F)F 207a_100102657272_100000050712 [0,2,0,0,0,0|2,0,0]=4 9001 B14R1.492 CNCc1ccc(c(c1)OC)[N+](=O)[O-] 207a_100102657272_100000696106 [0,2,0,0,0,0|1,0,1]=4 9002 B14R1.492 CNCc1ccc(c(c1)OC)[N+](=O)[O-] 270004a_106832991635_100000696106 [0,2,0,0,0,0|1,0,1]=4 9003 B14R1.492 COCc1ccc(c(c1)OC)[N+](=O)[O-] 34a_100000708744_200000210301 [0,2,0,0,0,0|1,0,1]=4 9004 B14R1.492 COCc1ccc(c(c1)OC)[N+](=O)[O-] 7a_100000708744_200000210301 [0,2,0,0,0,0|1,0,1]=4 9005 B14R1.492 COc1cc(ccc1B(O)O)SCF 62a_100010245881_100015361967 [0,2,0,0,0,0|2,0,0]=4 9006 B14R1.492 COc1cc(ccc1[N+](=O)[O-])CO[13CH3] 34a_100000708744_200025704644 [0,2,0,0,0,0|1,0,1]=4 9007 B14R1.492 COc1cc(ccc1[N+](=O)[O-])CO[13CH3] 7a_100000708744_200025704644 [0,2,0,0,0,0|1,0,1]=4 9008 B14R1.793 C#CCNc1ccc(c(c1)OC)CO 34a_100012183141_100000184674 [0,2,0,0,0,0|0,0,2]=4 9009 B14R1.793 C#CCNc1ccc(c(c1)OC)OC 34a_100000187404_100000184674 [0,2,0,0,0,0|0,0,2]=4 9010 B14R1.793 C#CCOc1ccc(c(c1)OC)CO 34a_200000116926_100000184674 [0,2,0,0,0,0|0,0,2]=4 9011 B14R1.793 C#CCOc1ccc(c(c1)OC)OC 34a_100000039706_100000184674 [0,2,0,0,0,0|0,0,2]=4 9012 B14R1.793 C#CCSc1ccc(c(c1)OC)CO 62a_100000038162_100011277633 [0,2,0,0,0,0|0,0,2]=4 9013 B14R1.793 C#CCSc1ccc(c(c1)OC)OC 62a_100000038162_100011356967 [0,2,0,0,0,0|0,0,2]=4 9014 B14R1.793 C=CCNc1ccc(c(c1)OC)CO 34a_100012183141_100015514636 [0,2,0,0,0,0|0,0,2]=4 9015 B14R1.793 C=CCNc1ccc(c(c1)OC)OC 34a_100000187404_100015514636 [0,2,0,0,0,0|0,0,2]=4 9016 B14R1.793 C=CCOc1ccc(c(c1)OC)CO 34a_200000116926_100015514636 [0,2,0,0,0,0|0,0,2]=4 9017 B14R1.793 C=CCOc1ccc(c(c1)OC)OC 34a_100000039706_100015514636 [0,2,0,0,0,0|0,0,2]=4 9018 B14R1.793 C=CCSc1ccc(c(c1)OC)CO 62a_100000210623_100011277633 [0,2,0,0,0,0|0,0,2]=4 9019 B14R1.793 C=CCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210623 [0,2,0,0,0,0|0,0,2]=4 9020 B14R1.793 C=CCSc1ccc(c(c1)OC)OC 62a_100000210623_100011356967 [0,2,0,0,0,0|0,0,2]=4 9021 B14R1.793 CC=NNc1ccc(c(c1)OC)OC 4a_100000071703_200000210099 [0,2,0,0,0,0|1,0,1]=4 9022 B14R1.793 CCCCc1cc(c(cn1)C#N)OC 271570a_100020621405_100009830018 [0,2,0,0,0,0|2,0,0]=4 9023 B14R1.793 CCCCc1cc(c(cn1)CO)OC 271570a_100020621405_100010714672 [0,2,0,0,0,0|1,0,0]=3 9024 B14R1.793 CCCCc1cc(c(nn1)OC)OC 271570a_100020621405_200000095610 [0,2,0,0,0,0|2,0,0]=4 9025 B14R1.793 CCCCc1ccc(c(c1)C#N)OC 271570a_100020621405_100000188252 [0,2,0,0,0,0|2,0,0]=4 9026 B14R1.793 CCCCc1ccc(c(c1)C=O)OC 271570a_100020621405_100000170026 [0,2,0,0,0,0|2,0,0]=4 9027 B14R1.793 CCCCc1ccc(c(c1)CC)C=O 271570a_100020621405_100010209654 [0,2,0,0,0,0|1,0,1]=4 9028 B14R1.793 CCCCc1ccc(c(c1)CC)NN 271570a_100020621405_100000700371 [0,2,0,0,0,0|2,0,0]=4 9029 B14R1.793 CCCCc1ccc(c(c1)CC)OC 271570a_100020621405_200010179862 [0,2,0,0,0,0|1,0,0]=3 9030 B14R1.793 CCCCc1ccc(c(c1)CN)OC 271570a_100020621405_100000690498 [0,2,0,0,0,0|2,0,0]=4 9031 B14R1.793 CCCCc1ccc(c(c1)CO)CO 271570a_100020621405_100000719600 [0,2,0,0,0,0|2,0,0]=4 9032 B14R1.793 CCCCc1ccc(c(c1)CO)OC 271570a_100020621405_100000204679 [0,2,0,0,0,0|2,0,0]=4 9033 B14R1.793 CCCCc1ccc(c(c1)NC)C#N 271570a_100020621405_200012356631 [0,2,0,0,0,0|2,0,0]=4 9034 B14R1.793 CCCCc1ccc(c(c1)OC)C#N 271570a_100020621405_100000694671 [0,2,0,0,0,0|1,0,0]=3 9035 B14R1.793 CCCCc1ccc(c(c1)OC)C=O 271570a_100020621405_100000697075 [0,2,0,0,0,0|0,0,1]=3 9036 B14R1.793 CCCCc1ccc(c(c1)OC)CC 271570a_100020621405_200010710398 [0,2,0,0,0,0|1,0,0]=3 9037 B14R1.793 CCCCc1ccc(c(c1)OC)CO 271570a_100020621405_100011277633 [0,2,0,0,0,0|0,0,0]=2 9038 B14R1.793 CCCCc1ccc(c(c1)OC)OC 271570a_100020621405_100000187503 [0,2,0,0,0,0|0,0,0]=2 9039 B14R1.793 CCCCc1ccc(c(c1)OC)SC 271570a_100020621405_200011001119 [0,2,0,0,0,0|0,1,0]=3 9040 B14R1.793 CCCCc1ccc(c(c1)SC)OC 271570a_100020621405_200009892704 [0,2,0,0,0,0|0,1,0]=3 9041 B14R1.793 CCCCc1ccc(c(n1)OC)C#N 271570a_100020621405_100000708423 [0,2,0,0,0,0|2,0,0]=4 9042 B14R1.793 CCCCc1ccc(c(n1)OC)C=O 271570a_100020621405_100009864722 [0,2,0,0,0,0|1,0,1]=4 9043 B14R1.793 CCCCc1ccc(c(n1)OC)CN 271570a_100020621405_100015687481 [0,2,0,0,0,0|2,0,0]=4 9044 B14R1.793 CCCCc1ccc(c(n1)OC)CO 271570a_100020621405_100010988397 [0,2,0,0,0,0|1,0,0]=3 9045 B14R1.793 CCCCc1ccc(c(n1)OC)OC 271570a_100020621405_100010214848 [0,2,0,0,0,0|1,0,0]=3 9046 B14R1.793 CCCCc1cnc(c(c1)OC)C#N 271570a_100020621405_100000719880 [0,2,0,0,0,0|2,0,0]=4 9047 B14R1.793 CCCCc1cnc(c(c1)OC)C=O 271570a_100020621405_100010246152 [0,2,0,0,0,0|1,0,1]=4 9048 B14R1.793 CCCCc1cnc(c(c1)OC)CO 271570a_100020621405_200010246159 [0,2,0,0,0,0|1,0,0]=3 9049 B14R1.793 CCCCc1cnc(c(c1)OC)OC 271570a_100020621405_100010234541 [0,2,0,0,0,0|1,0,0]=3 9050 B14R1.793 CCCCc1cnc(c(n1)OC)OC 271570a_100020621405_100010132954 [0,2,0,0,0,0|2,0,0]=4 9051 B14R1.793 CCCCc1ncc(c(n1)OC)CO 271570a_100020621405_200011024631 [0,2,0,0,0,0|2,0,0]=4 9052 B14R1.793 CCCCc1ncc(c(n1)OC)OC 271570a_100020621405_100010280452 [0,2,0,0,0,0|2,0,0]=4 9053 B14R1.793 CCCNc1ccc(c(c1)C#N)OC 34a_100011204338_100000210303 [0,2,0,0,0,0|2,0,0]=4 9054 B14R1.793 CCCNc1ccc(c(c1)C#N)OC 7a_100011204338_100000210303 [0,2,0,0,0,0|2,0,0]=4 9055 B14R1.793 CCCNc1ccc(c(c1)OC)C#N 34a_100011999456_100000210303 [0,2,0,0,0,0|1,0,0]=3 9056 B14R1.793 CCCNc1ccc(c(c1)OC)CO 34a_100012183141_100000210303 [0,2,0,0,0,0|0,0,0]=2 9057 B14R1.793 CCCNc1ccc(c(c1)OC)OC 34a_100000187404_100000210303 [0,2,0,0,0,0|0,0,0]=2 9058 B14R1.793 CCCOc1ccc(c(c1)OC)CO 34a_200000116926_100000210303 [0,2,0,0,0,0|0,0,0]=2 9059 B14R1.793 CCCOc1ccc(c(c1)OC)OC 34a_100000039706_100000210303 [0,2,0,0,0,0|0,0,0]=2 9060 B14R1.793 CCCSc1cc(c(cn1)C#N)OC 62a_100000210303_100009830018 [0,2,0,0,0,0|2,0,0]=4 9061 B14R1.793 CCCSc1cc(c(cn1)C=O)OC 62a_100000210303_100009846838 [0,2,0,0,0,0|1,0,1]=4 9062 B14R1.793 CCCSc1cc(c(cn1)C=O)OC 62a_100009846838_100000210303 [0,2,0,0,0,0|1,0,1]=4 9063 B14R1.793 CCCSc1cc(c(cn1)CO)OC 62a_100000210303_100010714672 [0,2,0,0,0,0|1,0,0]=3 9064 B14R1.793 CCCSc1cc(c(cn1)CO)OC 62a_100010714672_100000210303 [0,2,0,0,0,0|1,0,0]=3 9065 B14R1.793 CCCSc1cc(c(nn1)OC)OC 62a_100000210303_200000095610 [0,2,0,0,0,0|2,0,0]=4 9066 B14R1.793 CCCSc1ccc(c(c1)C#N)OC 62a_100000210303_100000188252 [0,2,0,0,0,0|2,0,0]=4 9067 B14R1.793 CCCSc1ccc(c(c1)C=O)OC 62a_100000170026_100000210303 [0,2,0,0,0,0|2,0,0]=4 9068 B14R1.793 CCCSc1ccc(c(c1)C=O)OC 62a_100000210303_100000170026 [0,2,0,0,0,0|2,0,0]=4 9069 B14R1.793 CCCSc1ccc(c(c1)CC)C=O 62a_100000210303_100010209654 [0,2,0,0,0,0|1,0,1]=4 9070 B14R1.793 CCCSc1ccc(c(c1)CC)C=O 62a_100010209654_100000210303 [0,2,0,0,0,0|1,0,1]=4 9071 B14R1.793 CCCSc1ccc(c(c1)CC)NN 62a_100000210303_100000700371 [0,2,0,0,0,0|2,0,0]=4 9072 B14R1.793 CCCSc1ccc(c(c1)CC)NN 62a_100000700371_100000210303 [0,2,0,0,0,0|2,0,0]=4 9073 B14R1.793 CCCSc1ccc(c(c1)CC)OC 62a_100000210303_200010179862 [0,2,0,0,0,0|1,0,0]=3 9074 B14R1.793 CCCSc1ccc(c(c1)CC)OC 62a_200010179862_100000210303 [0,2,0,0,0,0|1,0,0]=3 9075 B14R1.793 CCCSc1ccc(c(c1)CN)OC 62a_100000210303_100000690498 [0,2,0,0,0,0|2,0,0]=4 9076 B14R1.793 CCCSc1ccc(c(c1)CN)OC 62a_100000690498_100000210303 [0,2,0,0,0,0|2,0,0]=4 9077 B14R1.793 CCCSc1ccc(c(c1)CO)CO 62a_100000210303_100000719600 [0,2,0,0,0,0|2,0,0]=4 9078 B14R1.793 CCCSc1ccc(c(c1)CO)CO 62a_100000719600_100000210303 [0,2,0,0,0,0|2,0,0]=4 9079 B14R1.793 CCCSc1ccc(c(c1)CO)OC 62a_100000204679_100000210303 [0,2,0,0,0,0|2,0,0]=4 9080 B14R1.793 CCCSc1ccc(c(c1)CO)OC 62a_100000210303_100000204679 [0,2,0,0,0,0|2,0,0]=4 9081 B14R1.793 CCCSc1ccc(c(c1)NC)C#N 62a_100000210303_200012356631 [0,2,0,0,0,0|2,0,0]=4 9082 B14R1.793 CCCSc1ccc(c(c1)OC)C#N 62a_100000210303_100000694671 [0,2,0,0,0,0|1,0,0]=3 9083 B14R1.793 CCCSc1ccc(c(c1)OC)C=O 62a_100000210303_100010290300 [0,2,0,0,0,0|0,0,1]=3 9084 B14R1.793 CCCSc1ccc(c(c1)OC)C=O 62a_100000697075_100000210303 [0,2,0,0,0,0|0,0,1]=3 9085 B14R1.793 CCCSc1ccc(c(c1)OC)CC 62a_100000210303_200010710398 [0,2,0,0,0,0|1,0,0]=3 9086 B14R1.793 CCCSc1ccc(c(c1)OC)CC 62a_200010710398_100000210303 [0,2,0,0,0,0|1,0,0]=3 9087 B14R1.793 CCCSc1ccc(c(c1)OC)CO 62a_100000210303_100011277633 [0,2,0,0,0,0|0,0,0]=2 9088 B14R1.793 CCCSc1ccc(c(c1)OC)CO 62a_100011277633_100000210303 [0,2,0,0,0,0|0,0,0]=2 9089 B14R1.793 CCCSc1ccc(c(c1)OC)OC 62a_100000210303_100011356967 [0,2,0,0,0,0|0,0,0]=2 9090 B14R1.793 CCCSc1ccc(c(c1)OC)SC 62a_200011001119_100000210303 [0,2,0,0,0,0|0,1,0]=3 9091 B14R1.793 CCCSc1ccc(c(c1)SC)OC 62a_200009892704_100000210303 [0,2,0,0,0,0|0,1,0]=3 9092 B14R1.793 CCCSc1ccc(c(n1)OC)C#N 62a_100000210303_100000708423 [0,2,0,0,0,0|2,0,0]=4 9093 B14R1.793 CCCSc1ccc(c(n1)OC)C=O 62a_100000210303_100009864722 [0,2,0,0,0,0|1,0,1]=4 9094 B14R1.793 CCCSc1ccc(c(n1)OC)C=O 62a_100009864722_100000210303 [0,2,0,0,0,0|1,0,1]=4 9095 B14R1.793 CCCSc1ccc(c(n1)OC)CN 62a_100000210303_100015687481 [0,2,0,0,0,0|2,0,0]=4 9096 B14R1.793 CCCSc1ccc(c(n1)OC)CN 62a_100015687481_100000210303 [0,2,0,0,0,0|2,0,0]=4 9097 B14R1.793 CCCSc1ccc(c(n1)OC)CO 62a_100000210303_100010988397 [0,2,0,0,0,0|1,0,0]=3 9098 B14R1.793 CCCSc1ccc(c(n1)OC)CO 62a_100010988397_100000210303 [0,2,0,0,0,0|1,0,0]=3 9099 B14R1.793 CCCSc1ccc(c(n1)OC)OC 62a_100000210303_100010214848 [0,2,0,0,0,0|1,0,0]=3 9100 B14R1.793 CCCSc1cnc(c(c1)OC)C#N 62a_100000210303_100000719880 [0,2,0,0,0,0|2,0,0]=4 9101 B14R1.793 CCCSc1cnc(c(c1)OC)C=O 62a_100000210303_100010246152 [0,2,0,0,0,0|1,0,1]=4 9102 B14R1.793 CCCSc1cnc(c(c1)OC)C=O 62a_100010246152_100000210303 [0,2,0,0,0,0|1,0,1]=4 9103 B14R1.793 CCCSc1cnc(c(c1)OC)CO 62a_100000210303_200010246159 [0,2,0,0,0,0|1,0,0]=3 9104 B14R1.793 CCCSc1cnc(c(c1)OC)CO 62a_200010246159_100000210303 [0,2,0,0,0,0|1,0,0]=3 9105 B14R1.793 CCCSc1cnc(c(c1)OC)OC 62a_100000210303_100010234541 [0,2,0,0,0,0|1,0,0]=3 9106 B14R1.793 CCCSc1cnc(c(n1)OC)OC 62a_100000210303_100010132954 [0,2,0,0,0,0|2,0,0]=4 9107 B14R1.793 CCCSc1cnc(c(n1)OC)OC 62a_100010132954_100000210303 [0,2,0,0,0,0|2,0,0]=4 9108 B14R1.793 CCCSc1ncc(c(n1)OC)CO 62a_100000210303_200011024631 [0,2,0,0,0,0|2,0,0]=4 9109 B14R1.793 CCCSc1ncc(c(n1)OC)CO 62a_200011024631_100000210303 [0,2,0,0,0,0|2,0,0]=4 9110 B14R1.793 CCCSc1ncc(c(n1)OC)OC 62a_100000210303_100010280452 [0,2,0,0,0,0|2,0,0]=4 9111 B14R1.793 CCNCc1ccc(c(c1)CO)OC 207a_100015525214_100011361677 [0,2,0,0,0,0|2,0,0]=4 9112 B14R1.793 CCNCc1ccc(c(c1)CO)OC 270004a_100015525214_100011361677 [0,2,0,0,0,0|2,0,0]=4 9113 B14R1.793 CCNCc1ccc(c(c1)OC)C#N 207a_100015525214_100000726430 [0,2,0,0,0,0|1,0,0]=3 9114 B14R1.793 CCNCc1ccc(c(c1)OC)C#N 270004a_100015525214_100000726430 [0,2,0,0,0,0|1,0,0]=3 9115 B14R1.793 CCNCc1ccc(c(c1)OC)OC 207a_100015525214_100000170513 [0,2,0,0,0,0|0,0,0]=2 9116 B14R1.793 CCNCc1ccc(c(c1)OC)OC 2230a_100015525214_100011233839 [0,2,0,0,0,0|0,0,0]=2 9117 B14R1.793 CCNCc1ccc(c(c1)OC)OC 270004a_100015525214_100000170513 [0,2,0,0,0,0|0,0,0]=2 9118 B14R1.793 CCNCc1ccc(c(c1)OC)OC 34a_100000185555_100000210202 [0,2,0,0,0,0|0,0,0]=2 9119 B14R1.793 CCNCc1ccc(c(c1)OC)SC 207a_100015525214_100000050949 [0,2,0,0,0,0|0,1,0]=3 9120 B14R1.793 CCNCc1ccc(c(c1)OC)SC 270004a_100015525214_100000050949 [0,2,0,0,0,0|0,1,0]=3 9121 B14R1.793 CCNCc1cnc(c(c1)OC)OC 207a_100015525214_100000117638 [0,2,0,0,0,0|1,0,0]=3 9122 B14R1.793 CCNCc1cnc(c(c1)OC)OC 270004a_100015525214_100000117638 [0,2,0,0,0,0|1,0,0]=3 9123 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000083705_200000210301 [0,2,0,0,0,0|0,0,0]=2 9124 B14R1.793 CCOCc1ccc(c(c1)OC)OC 34a_100000210929_100000210202 [0,2,0,0,0,0|0,0,0]=2 9125 B14R1.793 CCOCc1ccc(c(c1)OC)OC 7a_100000083705_200000210301 [0,2,0,0,0,0|0,0,0]=2 9126 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 34a_100000083705_200025704644 [0,2,0,0,0,0|0,0,0]=2 9127 B14R1.793 CCOCc1ccc(c(c1)OC)O[13CH3] 7a_100000083705_200025704644 [0,2,0,0,0,0|0,0,0]=2 9128 B14R1.793 CCSCc1ccc(c(c1)OC)OC 62a_100000210202_100011233839 [0,2,0,0,0,0|0,0,0]=2 9129 B14R1.793 CCc1cc(ccc1OC)SCCF 62a_100011217306_200010179862 [0,2,0,0,0,0|2,0,0]=4 9130 B14R1.793 CCc1cc(ccc1OC)SCCF 62a_200010179862_100011217306 [0,2,0,0,0,0|2,0,0]=4 9131 B14R1.793 CCc1cc(ccc1OC)SCCO 62a_100000211926_200010179862 [0,2,0,0,0,0|2,0,0]=4 9132 B14R1.793 CCc1cc(ccc1OC)SCCO 62a_200010179862_100000211926 [0,2,0,0,0,0|2,0,0]=4 9133 B14R1.793 CCc1cc(ccc1OC)SCOC 62a_100000766300_200010179862 [0,2,0,0,0,0|2,0,0]=4 9134 B14R1.793 CCc1cc(ccc1OC)SCOC 62a_200010179862_100000766300 [0,2,0,0,0,0|2,0,0]=4 9135 B14R1.793 CCc1cc(ccc1OC)SCSC 62a_100011218213_200010179862 [0,2,0,0,0,0|2,0,0]=4 9136 B14R1.793 CCc1cc(ccc1OC)SCSC 62a_200010179862_100011218213 [0,2,0,0,0,0|2,0,0]=4 9137 B14R1.793 CCc1ccc(cc1OC)SCCF 62a_100011217306_200010710398 [0,2,0,0,0,0|2,0,0]=4 9138 B14R1.793 CCc1ccc(cc1OC)SCCF 62a_200010710398_100011217306 [0,2,0,0,0,0|2,0,0]=4 9139 B14R1.793 CCc1ccc(cc1OC)SCCO 62a_100000211926_200010710398 [0,2,0,0,0,0|2,0,0]=4 9140 B14R1.793 CCc1ccc(cc1OC)SCCO 62a_200010710398_100000211926 [0,2,0,0,0,0|2,0,0]=4 9141 B14R1.793 CCc1ccc(cc1OC)SCOC 62a_100000766300_200010710398 [0,2,0,0,0,0|2,0,0]=4 9142 B14R1.793 CCc1ccc(cc1OC)SCOC 62a_200010710398_100000766300 [0,2,0,0,0,0|2,0,0]=4 9143 B14R1.793 CCc1ccc(cc1OC)SCSC 62a_100011218213_200010710398 [0,2,0,0,0,0|2,0,0]=4 9144 B14R1.793 CCc1ccc(cc1OC)SCSC 62a_200010710398_100011218213 [0,2,0,0,0,0|2,0,0]=4 9145 B14R1.793 CNCCc1ccc(c(c1)OC)OC 2230a_100000210947_200000210301 [0,2,0,0,0,0|0,0,0]=2 9146 B14R1.793 CNCCc1ccc(c(c1)OC)OC 2230a_106832991635_100011273988 [0,2,0,0,0,0|0,0,0]=2 9147 B14R1.793 CNCCc1ccc(c(c1)OC)OC 270004a_106832991635_100011754369 [0,2,0,0,0,0|0,0,0]=2 9148 B14R1.793 CNCCc1ccc(c(c1)OC)OC 34a_100000210947_200000210301 [0,2,0,0,0,0|0,0,0]=2 9149 B14R1.793 CNCCc1ccc(c(c1)OC)OC 34a_100102657272_100011273988 [0,2,0,0,0,0|0,0,0]=2 9150 B14R1.793 CNCCc1ccc(c(c1)OC)OC 7a_106832991635_100011740610 [0,2,0,0,0,0|0,0,0]=2 9151 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100011215274_200000210301 [0,2,0,0,0,0|0,0,0]=2 9152 B14R1.793 COCCc1ccc(c(c1)OC)OC 34a_100138415774_100011273988 [0,2,0,0,0,0|0,0,0]=2 9153 B14R1.793 COCOc1ccc(c(c1)SC)OC 62a_200000210301_200161107199 [0,2,0,0,0,0|1,1,0]=4 9154 B14R1.793 COCOc1ccc(c(c1)SC)OC 62a_200161107199_200000210301 [0,2,0,0,0,0|1,1,0]=4 9155 B14R1.793 COCOc1ccc(c(c1)S[13CH3])OC 62a_200025704644_200161107199 [0,2,0,0,0,0|1,1,0]=4 9156 B14R1.793 COCOc1ccc(c(c1)S[13CH3])OC 62a_200161107199_200025704644 [0,2,0,0,0,0|1,1,0]=4 9157 B14R1.793 COCSc1cc(c(cn1)CO)OC 62a_100000766300_100010714672 [0,2,0,0,0,0|2,0,0]=4 9158 B14R1.793 COCSc1cc(c(cn1)CO)OC 62a_100010714672_100000766300 [0,2,0,0,0,0|2,0,0]=4 9159 B14R1.793 COCSc1ccc(c(c1)OC)C#N 62a_100000766300_100000694671 [0,2,0,0,0,0|2,0,0]=4 9160 B14R1.793 COCSc1ccc(c(c1)OC)C=O 62a_100000697075_100000766300 [0,2,0,0,0,0|1,0,1]=4 9161 B14R1.793 COCSc1ccc(c(c1)OC)C=O 62a_100000766300_100010290300 [0,2,0,0,0,0|1,0,1]=4 9162 B14R1.793 COCSc1ccc(c(c1)OC)CO 62a_100000766300_100011277633 [0,2,0,0,0,0|1,0,0]=3 9163 B14R1.793 COCSc1ccc(c(c1)OC)CO 62a_100011277633_100000766300 [0,2,0,0,0,0|1,0,0]=3 9164 B14R1.793 COCSc1ccc(c(c1)OC)OC 62a_100000766300_100011356967 [0,2,0,0,0,0|1,0,0]=3 9165 B14R1.793 COCSc1ccc(c(c1)OC)SC 62a_200011001119_100000766300 [0,2,0,0,0,0|1,1,0]=4 9166 B14R1.793 COCSc1ccc(c(c1)SC)OC 62a_200009892704_100000766300 [0,2,0,0,0,0|1,1,0]=4 9167 B14R1.793 COCSc1ccc(c(n1)OC)CO 62a_100000766300_100010988397 [0,2,0,0,0,0|2,0,0]=4 9168 B14R1.793 COCSc1ccc(c(n1)OC)CO 62a_100010988397_100000766300 [0,2,0,0,0,0|2,0,0]=4 9169 B14R1.793 COCSc1ccc(c(n1)OC)OC 62a_100000766300_100010214848 [0,2,0,0,0,0|2,0,0]=4 9170 B14R1.793 COCSc1cnc(c(c1)OC)CO 62a_100000766300_200010246159 [0,2,0,0,0,0|2,0,0]=4 9171 B14R1.793 COCSc1cnc(c(c1)OC)CO 62a_200010246159_100000766300 [0,2,0,0,0,0|2,0,0]=4 9172 B14R1.793 COCSc1cnc(c(c1)OC)OC 62a_100000766300_100010234541 [0,2,0,0,0,0|2,0,0]=4 9173 B14R1.793 COc1cc(ccc1C#N)NCCF 34a_100011999456_100011217306 [0,2,0,0,0,0|2,0,0]=4 9174 B14R1.793 COc1cc(ccc1C#N)NCCO 34a_100011999456_100000211926 [0,2,0,0,0,0|2,0,0]=4 9175 B14R1.793 COc1cc(ccc1C#N)NCSC 34a_100011999456_100011218213 [0,2,0,0,0,0|2,0,0]=4 9176 B14R1.793 COc1cc(ccc1C#N)SCCF 62a_100011217306_100000694671 [0,2,0,0,0,0|2,0,0]=4 9177 B14R1.793 COc1cc(ccc1C#N)SCCO 62a_100000211926_100000694671 [0,2,0,0,0,0|2,0,0]=4 9178 B14R1.793 COc1cc(ccc1C#N)SCSC 62a_100011218213_100000694671 [0,2,0,0,0,0|2,0,0]=4 9179 B14R1.793 COc1cc(ccc1C=O)SCCF 62a_100000697075_100011217306 [0,2,0,0,0,0|1,0,1]=4 9180 B14R1.793 COc1cc(ccc1C=O)SCCF 62a_100011217306_100010290300 [0,2,0,0,0,0|1,0,1]=4 9181 B14R1.793 COc1cc(ccc1C=O)SCCO 62a_100000211926_100010290300 [0,2,0,0,0,0|1,0,1]=4 9182 B14R1.793 COc1cc(ccc1C=O)SCCO 62a_100000697075_100000211926 [0,2,0,0,0,0|1,0,1]=4 9183 B14R1.793 COc1cc(ccc1C=O)SCSC 62a_100000697075_100011218213 [0,2,0,0,0,0|1,0,1]=4 9184 B14R1.793 COc1cc(ccc1C=O)SCSC 62a_100011218213_100010290300 [0,2,0,0,0,0|1,0,1]=4 9185 B14R1.793 COc1cc(ccc1CO)NCC=O 34a_100012183141_200009817547 [0,2,0,0,0,0|1,0,1]=4 9186 B14R1.793 COc1cc(ccc1CO)NCCF 34a_100012183141_100011217306 [0,2,0,0,0,0|1,0,0]=3 9187 B14R1.793 COc1cc(ccc1CO)NCCO 34a_100012183141_100000211926 [0,2,0,0,0,0|1,0,0]=3 9188 B14R1.793 COc1cc(ccc1CO)NCSC 34a_100012183141_100011218213 [0,2,0,0,0,0|1,0,0]=3 9189 B14R1.793 COc1cc(ccc1CO)OCC=O 34a_200000116926_200009817547 [0,2,0,0,0,0|1,0,1]=4 9190 B14R1.793 COc1cc(ccc1CO)OCCF 34a_200000116926_100011217306 [0,2,0,0,0,0|1,0,0]=3 9191 B14R1.793 COc1cc(ccc1CO)OCCO 34a_200000116926_100000211926 [0,2,0,0,0,0|1,0,0]=3 9192 B14R1.793 COc1cc(ccc1CO)OCSC 34a_200000116926_100011218213 [0,2,0,0,0,0|1,0,0]=3 9193 B14R1.793 COc1cc(ccc1CO)SCC#N 62a_100011215382_100011277633 [0,2,0,0,0,0|1,0,1]=4 9194 B14R1.793 COc1cc(ccc1CO)SCC#N 62a_100011277633_100011215382 [0,2,0,0,0,0|1,0,1]=4 9195 B14R1.793 COc1cc(ccc1CO)SCC=O 62a_100011277633_200015260668 [0,2,0,0,0,0|1,0,1]=4 9196 B14R1.793 COc1cc(ccc1CO)SCC=O 62a_200015260668_100011277633 [0,2,0,0,0,0|1,0,1]=4 9197 B14R1.793 COc1cc(ccc1CO)SCCF 62a_100011217306_100011277633 [0,2,0,0,0,0|1,0,0]=3 9198 B14R1.793 COc1cc(ccc1CO)SCCF 62a_100011277633_100011217306 [0,2,0,0,0,0|1,0,0]=3 9199 B14R1.793 COc1cc(ccc1CO)SCCO 62a_100000211926_100011277633 [0,2,0,0,0,0|1,0,0]=3 9200 B14R1.793 COc1cc(ccc1CO)SCCO 62a_100011277633_100000211926 [0,2,0,0,0,0|1,0,0]=3 9201 B14R1.793 COc1cc(ccc1CO)SCSC 62a_100011218213_100011277633 [0,2,0,0,0,0|1,0,0]=3 9202 B14R1.793 COc1cc(ccc1CO)SCSC 62a_100011277633_100011218213 [0,2,0,0,0,0|1,0,0]=3 9203 B14R1.793 COc1cc(ccc1O[13CH3])/C=C\CO 34a_100016294963_200025704644 [0,2,0,0,0,0|0,0,2]=4 9204 B14R1.793 COc1cc(ccc1O[13CH3])CCCO 34a_100000060467_200025704644 [0,2,0,0,0,0|0,0,0]=2 9205 B14R1.793 COc1cc(ccc1O[13CH3])CCCO 7a_100000060467_200025704644 [0,2,0,0,0,0|0,0,0]=2 9206 B14R1.793 COc1cc(ccc1SC)SCCF 62a_200011001119_100011217306 [0,2,0,0,0,0|1,1,0]=4 9207 B14R1.793 COc1cc(ccc1SC)SCCO 62a_200011001119_100000211926 [0,2,0,0,0,0|1,1,0]=4 9208 B14R1.793 COc1cc(ccc1SC)SCSC 62a_200011001119_100011218213 [0,2,0,0,0,0|1,1,0]=4 9209 B14R1.793 COc1cc(cnc1CO)SCCF 62a_100011217306_200010246159 [0,2,0,0,0,0|2,0,0]=4 9210 B14R1.793 COc1cc(cnc1CO)SCCF 62a_200010246159_100011217306 [0,2,0,0,0,0|2,0,0]=4 9211 B14R1.793 COc1cc(cnc1CO)SCCO 62a_100000211926_200010246159 [0,2,0,0,0,0|2,0,0]=4 9212 B14R1.793 COc1cc(cnc1CO)SCCO 62a_200010246159_100000211926 [0,2,0,0,0,0|2,0,0]=4 9213 B14R1.793 COc1cc(cnc1CO)SCSC 62a_100011218213_200010246159 [0,2,0,0,0,0|2,0,0]=4 9214 B14R1.793 COc1cc(cnc1CO)SCSC 62a_200010246159_100011218213 [0,2,0,0,0,0|2,0,0]=4 9215 B14R1.793 COc1cc(cnc1OC)SCCF 62a_100011217306_100010234541 [0,2,0,0,0,0|2,0,0]=4 9216 B14R1.793 COc1cc(cnc1OC)SCCO 62a_100000211926_100010234541 [0,2,0,0,0,0|2,0,0]=4 9217 B14R1.793 COc1cc(cnc1OC)SCSC 62a_100011218213_100010234541 [0,2,0,0,0,0|2,0,0]=4 9218 B14R1.793 COc1cc(ncc1CO)SCCF 62a_100010714672_100011217306 [0,2,0,0,0,0|2,0,0]=4 9219 B14R1.793 COc1cc(ncc1CO)SCCF 62a_100011217306_100010714672 [0,2,0,0,0,0|2,0,0]=4 9220 B14R1.793 COc1cc(ncc1CO)SCCO 62a_100000211926_100010714672 [0,2,0,0,0,0|2,0,0]=4 9221 B14R1.793 COc1cc(ncc1CO)SCCO 62a_100010714672_100000211926 [0,2,0,0,0,0|2,0,0]=4 9222 B14R1.793 COc1cc(ncc1CO)SCSC 62a_100010714672_100011218213 [0,2,0,0,0,0|2,0,0]=4 9223 B14R1.793 COc1cc(ncc1CO)SCSC 62a_100011218213_100010714672 [0,2,0,0,0,0|2,0,0]=4 9224 B14R1.793 COc1ccc(cc1OC)/C=C/CO 34a_100102524974_200000210301 [0,2,0,0,0,0|0,0,2]=4 9225 B14R1.793 COc1ccc(cc1OC)/C=C\CO 34a_100016294963_200000210301 [0,2,0,0,0,0|0,0,2]=4 9226 B14R1.793 COc1ccc(cc1OC)CCCO 34a_100000060467_200000210301 [0,2,0,0,0,0|0,0,0]=2 9227 B14R1.793 COc1ccc(cc1OC)CCCO 7a_100000060467_200000210301 [0,2,0,0,0,0|0,0,0]=2 9228 B14R1.793 COc1ccc(cc1OC)CCN[13CH3] 2230a_100000210947_200025704644 [0,2,0,0,0,0|0,0,0]=2 9229 B14R1.793 COc1ccc(cc1OC)CCN[13CH3] 34a_100000210947_200025704644 [0,2,0,0,0,0|0,0,0]=2 9230 B14R1.793 COc1ccc(cc1OC)CCO[13CH3] 34a_100011215274_200025704644 [0,2,0,0,0,0|0,0,0]=2 9231 B14R1.793 COc1ccc(cc1OC)CCSC 62a_200000210301_100011740610 [0,2,0,0,0,0|0,0,0]=2 9232 B14R1.793 COc1ccc(cc1OC)CCS[13CH3] 62a_200025704644_100011740610 [0,2,0,0,0,0|0,0,0]=2 9233 B14R1.793 COc1ccc(cc1OC)CNCF 34a_100000185555_100015361967 [0,2,0,0,0,0|1,0,0]=3 9234 B14R1.793 COc1ccc(cc1OC)COCF 34a_100000210929_100015361967 [0,2,0,0,0,0|1,0,0]=3 9235 B14R1.793 COc1ccc(cc1OC)CSCF 62a_100015361967_100011233839 [0,2,0,0,0,0|1,0,0]=3 9236 B14R1.793 COc1ccc(cc1OC)NCC=O 34a_100000187404_200009817547 [0,2,0,0,0,0|1,0,1]=4 9237 B14R1.793 COc1ccc(cc1OC)NCCF 34a_100000187404_100011217306 [0,2,0,0,0,0|1,0,0]=3 9238 B14R1.793 COc1ccc(cc1OC)NCCO 34a_100000187404_100000211926 [0,2,0,0,0,0|1,0,0]=3 9239 B14R1.793 COc1ccc(cc1OC)NCSC 34a_100000187404_100011218213 [0,2,0,0,0,0|1,0,0]=3 9240 B14R1.793 COc1ccc(cc1OC)OCC=O 34a_100000039706_200009817547 [0,2,0,0,0,0|1,0,1]=4 9241 B14R1.793 COc1ccc(cc1OC)OCCF 34a_100000039706_100011217306 [0,2,0,0,0,0|1,0,0]=3 9242 B14R1.793 COc1ccc(cc1OC)OCCO 34a_100000039706_100000211926 [0,2,0,0,0,0|1,0,0]=3 9243 B14R1.793 COc1ccc(cc1OC)OCSC 34a_100000039706_100011218213 [0,2,0,0,0,0|1,0,0]=3 9244 B14R1.793 COc1ccc(cc1OC)SCC#N 62a_100011215382_100011356967 [0,2,0,0,0,0|1,0,1]=4 9245 B14R1.793 COc1ccc(cc1OC)SCC=O 62a_200015260668_100011356967 [0,2,0,0,0,0|1,0,1]=4 9246 B14R1.793 COc1ccc(cc1OC)SCCF 62a_100011217306_100011356967 [0,2,0,0,0,0|1,0,0]=3 9247 B14R1.793 COc1ccc(cc1OC)SCCO 62a_100000211926_100011356967 [0,2,0,0,0,0|1,0,0]=3 9248 B14R1.793 COc1ccc(cc1OC)SCSC 62a_100011218213_100011356967 [0,2,0,0,0,0|1,0,0]=3 9249 B14R1.793 COc1ccc(cc1O[13CH3])/C=C/CO 34a_100102524974_200025704644 [0,2,0,0,0,0|0,0,2]=4 9250 B14R1.793 COc1ccc(cc1SC)SCCF 62a_200009892704_100011217306 [0,2,0,0,0,0|1,1,0]=4 9251 B14R1.793 COc1ccc(cc1SC)SCCO 62a_200009892704_100000211926 [0,2,0,0,0,0|1,1,0]=4 9252 B14R1.793 COc1ccc(cc1SC)SCSC 62a_200009892704_100011218213 [0,2,0,0,0,0|1,1,0]=4 9253 B14R1.793 COc1ccc(nc1OC)SCCF 62a_100011217306_100010214848 [0,2,0,0,0,0|2,0,0]=4 9254 B14R1.793 COc1ccc(nc1OC)SCCO 62a_100000211926_100010214848 [0,2,0,0,0,0|2,0,0]=4 9255 B14R1.793 COc1ccc(nc1OC)SCSC 62a_100011218213_100010214848 [0,2,0,0,0,0|2,0,0]=4 9256 B14R1.793 COc1nc(ccc1CO)SCCF 62a_100010988397_100011217306 [0,2,0,0,0,0|2,0,0]=4 9257 B14R1.793 COc1nc(ccc1CO)SCCF 62a_100011217306_100010988397 [0,2,0,0,0,0|2,0,0]=4 9258 B14R1.793 COc1nc(ccc1CO)SCCO 62a_100000211926_100010988397 [0,2,0,0,0,0|2,0,0]=4 9259 B14R1.793 COc1nc(ccc1CO)SCCO 62a_100010988397_100000211926 [0,2,0,0,0,0|2,0,0]=4 9260 B14R1.793 COc1nc(ccc1CO)SCSC 62a_100010988397_100011218213 [0,2,0,0,0,0|2,0,0]=4 9261 B14R1.793 COc1nc(ccc1CO)SCSC 62a_100011218213_100010988397 [0,2,0,0,0,0|2,0,0]=4 9262 B14R1.3237 CCSc1cc(c(c(c1)OC)C#N)F 62a_100000210202_100000697026 [0,2,0,0,0,0|2,0,0]=4 9263 B14R1.3237 CCSc1cc(c(c(c1)OC)C=O)F 62a_100010363811_100000210202 [0,2,0,0,0,0|1,0,1]=4 9264 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Br 207a_100102657272_100000183470 [0,2,0,0,0,0|1,0,0]=3 9265 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Br 270004a_106832991635_100000183470 [0,2,0,0,0,0|1,0,0]=3 9266 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Br 34a_100000748475_200000210301 [0,2,0,0,0,0|1,0,0]=3 9267 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Cl 207a_100102657272_100000184546 [0,2,0,0,0,0|1,0,0]=3 9268 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)Cl 270004a_106832991635_100000184546 [0,2,0,0,0,0|1,0,0]=3 9269 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)I 207a_100102657272_100000188315 [0,2,0,0,0,0|1,0,0]=3 9270 B14R1.3237 CNCc1cc(c(c(c1)OC)OC)I 270004a_106832991635_100000188315 [0,2,0,0,0,0|1,0,0]=3 9271 B14R1.3237 COCc1cc(c(c(c1)OC)OC)Br 34a_200000215730_200000210301 [0,2,0,0,0,0|1,0,0]=3 9272 B14R1.3237 COc1cc(cc(c1OC)Br)CN[13CH3] 34a_100000748475_200025704644 [0,2,0,0,0,0|1,0,0]=3 9273 B14R1.3237 COc1cc(cc(c1OC)Br)CO[13CH3] 34a_200000215730_200025704644 [0,2,0,0,0,0|1,0,0]=3 9274 B14R1.6788 C=CCc1ccc(c(c1)OC)OCC 34a_100000181329_100000210202 [0,2,0,0,0,0|0,0,2]=4 9275 B14R1.6788 C=CCc1ccc(c(c1)OC)OCF 34a_100000181329_100015361967 [0,2,0,0,0,0|0,0,2]=4 9276 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 271570a_100016259895_200012344064 [0,2,0,0,0,0|0,0,2]=4 9277 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 34a_100000057189_200000210301 [0,2,0,0,0,0|0,0,2]=4 9278 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 34a_100015195088_100000210202 [0,2,0,0,0,0|0,0,2]=4 9279 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCC 7a_100000057189_200000210301 [0,2,0,0,0,0|0,0,2]=4 9280 B14R1.6788 CC=Cc1ccc(c(c1)OC)OCF 34a_100015195088_100015361967 [0,2,0,0,0,0|0,0,2]=4 9281 B14R1.6788 CC=Cc1ccc(c(c1)O[13CH3])OCC 34a_100000057189_200025704644 [0,2,0,0,0,0|0,0,2]=4 9282 B14R1.6788 CC=Cc1ccc(c(c1)O[13CH3])OCC 7a_100000057189_200025704644 [0,2,0,0,0,0|0,0,2]=4 9283 B14R1.6788 CCCc1ccc(c(c1)OC)CNC 26a_100102657272_100000012292 [0,2,0,0,0,0|1,0,0]=3 9284 B14R1.6788 CCCc1ccc(c(c1)OC)OCC 34a_100000012292_100000210202 [0,2,0,0,0,0|0,0,0]=2 9285 B14R1.6788 CCCc1ccc(c(c1)OC)OCC 7a_100000012292_100000210202 [0,2,0,0,0,0|0,0,0]=2 9286 B14R1.6788 CCCc1ccc(c(c1)OC)OCF 34a_100000012292_100015361967 [0,2,0,0,0,0|0,0,0]=2 9287 B14R1.6788 CCCc1ccc(c(c1)OC)OCF 7a_100000012292_100015361967 [0,2,0,0,0,0|0,0,0]=2 9288 B14R1.6788 CCNc1ccc(c(c1)OC)OCC 2230a_100000184985_100000210202 [0,2,0,0,0,0|1,0,0]=3 9289 B14R1.6788 CCNc1ccc(c(c1)OC)OCC 34a_100000184985_100000210202 [0,2,0,0,0,0|1,0,0]=3 9290 B14R1.6788 CCOc1ccc(c(c1)NC)OCC 2230a_100000211849_200000210301 [0,2,0,0,0,0|2,0,0]=4 9291 B14R1.6788 CCOc1ccc(c(c1)NC)OCC 34a_100000211849_200000210301 [0,2,0,0,0,0|2,0,0]=4 9292 B14R1.6788 CCOc1ccc(c(c1)N[13CH3])OCC 2230a_100000211849_200025704644 [0,2,0,0,0,0|2,0,0]=4 9293 B14R1.6788 CCOc1ccc(c(c1)N[13CH3])OCC 34a_100000211849_200025704644 [0,2,0,0,0,0|2,0,0]=4 9294 B14R1.6788 CCOc1ccc(cc1CC)SCC 62a_100000210202_200010070707 [0,2,0,0,0,0|2,0,0]=4 9295 B14R1.6788 CCOc1ccc(cc1CC)SCC 62a_200010070707_100000210202 [0,2,0,0,0,0|2,0,0]=4 9296 B14R1.6788 CCOc1ccc(cc1OC)CC#N 34a_100000032377_100000210202 [0,2,0,0,0,0|1,0,1]=4 9297 B14R1.6788 CCOc1ccc(cc1OC)CCBr 34a_100010741665_100000210202 [0,2,0,0,0,0|1,0,0]=3 9298 B14R1.6788 CCOc1ccc(cc1OC)CCBr 7a_100010741665_100000210202 [0,2,0,0,0,0|1,0,0]=3 9299 B14R1.6788 CCOc1ccc(cc1OC)CCN 34a_100000756042_100000210202 [0,2,0,0,0,0|1,0,0]=3 9300 B14R1.6788 CCOc1ccc(cc1OC)CCO 34a_100011215244_100000210202 [0,2,0,0,0,0|1,0,0]=3 9301 B14R1.6788 CCOc1ccc(cc1OC)CNC 207a_100102657272_100000169853 [0,2,0,0,0,0|1,0,0]=3 9302 B14R1.6788 CCOc1ccc(cc1OC)CNC 2230a_200000739100_200000210301 [0,2,0,0,0,0|1,0,0]=3 9303 B14R1.6788 CCOc1ccc(cc1OC)CNC 270004a_106832991635_100000169853 [0,2,0,0,0,0|1,0,0]=3 9304 B14R1.6788 CCOc1ccc(cc1OC)CNC 34a_200000739100_200000210301 [0,2,0,0,0,0|1,0,0]=3 9305 B14R1.6788 CCOc1ccc(cc1OC)CN[13CH3] 2230a_200000739100_200025704644 [0,2,0,0,0,0|1,0,0]=3 9306 B14R1.6788 CCOc1ccc(cc1OC)CN[13CH3] 34a_200000739100_200025704644 [0,2,0,0,0,0|1,0,0]=3 9307 B14R1.6788 CCOc1ccc(cc1OC)COC 34a_100000184821_200000210301 [0,2,0,0,0,0|1,0,0]=3 9308 B14R1.6788 CCOc1ccc(cc1OC)CO[13CH3] 34a_100000184821_200025704644 [0,2,0,0,0,0|1,0,0]=3 9309 B14R1.6788 CCOc1ccc(cc1OC)NCF 34a_100000184985_100015361967 [0,2,0,0,0,0|2,0,0]=4 9310 B14R1.6788 CCOc1ncc(cc1OC)SCC 62a_100000210202_200010116856 [0,2,0,0,0,0|2,0,0]=4 9311 B14R1.6788 CCSc1ccc(c(c1)OC)CC#N 62a_100000210202_100010245117 [0,2,0,0,0,0|2,0,0]=4 9312 B14R1.6788 CCSc1ccc(c(c1)OC)CC#N 62a_100010245117_100000210202 [0,2,0,0,0,0|2,0,0]=4 9313 B14R1.6788 CNCc1ccc(cc1OC)CCBr 26a_100102657272_100010741665 [0,2,0,0,0,0|2,0,0]=4 9314 B14R1.6788 CNCc1ccc(cc1OC)CCO 26a_100102657272_100011215244 [0,2,0,0,0,0|2,0,0]=4 9315 B14R1.6788 COc1cc(ccc1OCF)CC#N 34a_100000032377_100015361967 [0,2,0,0,0,0|1,0,1]=4 9316 B14R1.6788 COc1cc(ccc1OCF)CCBr 34a_100010741665_100015361967 [0,2,0,0,0,0|1,0,0]=3 9317 B14R1.6788 COc1cc(ccc1OCF)CCBr 7a_100010741665_100015361967 [0,2,0,0,0,0|1,0,0]=3 9318 B14R1.6788 COc1cc(ccc1OCF)CCN 34a_100000756042_100015361967 [0,2,0,0,0,0|1,0,0]=3 9319 B14R1.6788 COc1cc(ccc1OCF)CCO 34a_100011215244_100015361967 [0,2,0,0,0,0|1,0,0]=3 9320 B14R1.6794 C=C(C)c1cc(ccc1OC)CCN 271570a_100000694244_103549771065 [0,2,0,0,0,0|2,0,0]=4 9321 B14R1.6794 C=C(C)c1cc(ccc1OC)CCO 271570a_100000694244_100011962876 [0,2,0,0,0,0|2,0,0]=4 9322 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)OC 34a_200011698639_200000210301 [0,2,0,0,0,0|1,0,0]=3 9323 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)OC 7a_200011698639_200000210301 [0,2,0,0,0,0|1,0,0]=3 9324 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)O[13CH3] 34a_200011698639_200025704644 [0,2,0,0,0,0|1,0,0]=3 9325 B14R1.6794 CCCc1ccc(c(c1)C(=O)C)O[13CH3] 7a_200011698639_200025704644 [0,2,0,0,0,0|1,0,0]=3 9326 B14R1.6794 CCNc1ccc(c(c1)C(C)C)OC 2230a_100025764739_100000210202 [0,2,0,0,0,0|2,0,0]=4 9327 B14R1.6794 CCNc1ccc(c(c1)C(C)C)OC 34a_100025764739_100000210202 [0,2,0,0,0,0|2,0,0]=4 9328 B14R1.6794 CCOc1ccc(c(c1)C(=O)C)OC 34a_100000081070_100000210202 [0,2,0,0,0,0|2,0,0]=4 9329 B14R1.6794 CCOc1ccc(c(c1)C(=O)C)OC 7a_100000081070_100000210202 [0,2,0,0,0,0|2,0,0]=4 9330 B14R1.6794 CCSc1ccc(c(c1)C(=O)C)OC 62a_100000173343_100000210202 [0,2,0,0,0,0|2,0,0]=4 9331 B14R1.6794 CNCc1ccc(c(c1)C(C)C)OC 207a_100102657272_100000083594 [0,2,0,0,0,0|2,0,0]=4 9332 B14R1.6794 CNCc1ccc(c(c1)C(C)C)OC 270004a_106832991635_100000083594 [0,2,0,0,0,0|2,0,0]=4 9333 B14R1.10285 CC=Cc1ccc(c(c1C)OC)OC 271570a_100016259895_100010000156 [0,2,0,0,0,0|0,0,2]=4 9334 B14R1.10285 CCSc1ccc(c(c1C)OC)OC 62a_100000210202_100010000156 [0,2,0,0,0,0|1,0,0]=3 9335 B14R1.10285 CCSc1ccc(c(c1F)OC)C#N 62a_100000210202_200010764283 [0,2,0,0,0,0|2,0,0]=4 9336 B14R1.10285 CNCc1ccc(c(c1Br)OC)OC 207a_100102657272_100009814707 [0,2,0,0,0,0|1,0,0]=3 9337 B14R1.10285 CNCc1ccc(c(c1Br)OC)OC 270004a_106832991635_100009814707 [0,2,0,0,0,0|1,0,0]=3 9338 B14R1.10285 CNCc1ccc(c(c1C)OC)OC 207a_100102657272_100000050322 [0,2,0,0,0,0|1,0,0]=3 9339 B14R1.10285 CNCc1ccc(c(c1C)OC)OC 270004a_106832991635_100000050322 [0,2,0,0,0,0|1,0,0]=3 9340 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 207a_100102657272_100000033805 [0,2,0,0,0,0|1,0,0]=3 9341 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 2230a_106832991635_100011890039 [0,2,0,0,0,0|1,0,0]=3 9342 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 270004a_106832991635_100000033805 [0,2,0,0,0,0|1,0,0]=3 9343 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 34a_102515433231_200000210301 [0,2,0,0,0,0|1,0,0]=3 9344 B14R1.10285 CNCc1ccc(c(c1Cl)OC)OC 7a_106832991635_100011890039 [0,2,0,0,0,0|1,0,0]=3 9345 B14R1.10285 CNCc1ccc(c(c1F)OC)OC 207a_100102657272_100009852382 [0,2,0,0,0,0|1,0,0]=3 9346 B14R1.10285 CNCc1ccc(c(c1F)OC)OC 270004a_106832991635_100009852382 [0,2,0,0,0,0|1,0,0]=3 9347 B14R1.10285 CNCc1ccc(c(c1I)OC)OC 207a_100102657272_100010191550 [0,2,0,0,0,0|1,0,0]=3 9348 B14R1.10285 CNCc1ccc(c(c1I)OC)OC 270004a_106832991635_100010191550 [0,2,0,0,0,0|1,0,0]=3 9349 B14R1.10285 COCc1ccc(c(c1Cl)OC)OC 34a_100011218542_200000210301 [0,2,0,0,0,0|1,0,0]=3 9350 B14R1.10285 COCc1ccc(c(c1Cl)OC)OC 7a_100011218542_200000210301 [0,2,0,0,0,0|1,0,0]=3 9351 B14R1.10285 COc1ccc(c(c1OC)C)SCF 62a_100015361967_100010000156 [0,2,0,0,0,0|2,0,0]=4 9352 B14R1.10285 COc1ccc(c(c1OC)Cl)CN[13CH3] 34a_102515433231_200025704644 [0,2,0,0,0,0|1,0,0]=3 9353 B14R1.10285 COc1ccc(c(c1OC)Cl)CO[13CH3] 34a_100011218542_200025704644 [0,2,0,0,0,0|1,0,0]=3 9354 B14R1.10285 COc1ccc(c(c1OC)Cl)CO[13CH3] 7a_100011218542_200025704644 [0,2,0,0,0,0|1,0,0]=3 9355 B14R1.10285 COc1ccc(c(c1OC)Cl)CSC 62a_200000210301_100011890039 [0,2,0,0,0,0|1,0,0]=3 9356 B14R1.10285 COc1ccc(c(c1OC)Cl)CS[13CH3] 62a_200025704644_100011890039 [0,2,0,0,0,0|1,0,0]=3 9357 B14R1.14946 CC=Cc1cc(c(cc1F)OC)OC 271570a_100016259895_200011765842 [0,2,0,0,0,0|0,0,2]=4 9358 B14R1.14946 CCNc1cc(c(cc1C)OC)OC 34a_100000183460_100000210202 [0,2,0,0,0,0|1,0,0]=3 9359 B14R1.14946 CCNc1cc(c(cc1F)OC)OC 34a_100000753170_100000210202 [0,2,0,0,0,0|1,0,0]=3 9360 B14R1.14946 CCSc1cc(c(cc1F)OC)OC 62a_200011765842_100000210202 [0,2,0,0,0,0|1,0,0]=3 9361 B14R1.14946 CCSc1nc(c(cc1C)OC)OC 62a_100000210202_200011016175 [0,2,0,0,0,0|2,0,0]=4 9362 B14R1.14946 CNCc1cc(c(cc1Br)OC)OC 207a_100102657272_100000170863 [0,2,0,0,0,0|1,0,0]=3 9363 B14R1.14946 CNCc1cc(c(cc1Br)OC)OC 270004a_106832991635_100000170863 [0,2,0,0,0,0|1,0,0]=3 9364 B14R1.14946 CNCc1cc(c(cc1Br)OC)OC 34a_100102657272_100011375086 [0,2,0,0,0,0|1,0,0]=3 9365 B14R1.14946 CNCc1cc(c(cc1Br)OC)OC 7a_106832991635_100011375086 [0,2,0,0,0,0|1,0,0]=3 9366 B14R1.14946 CNCc1cc(c(cc1C)OC)OC 207a_100102657272_100000685059 [0,2,0,0,0,0|1,0,0]=3 9367 B14R1.14946 CNCc1cc(c(cc1C)OC)OC 270004a_106832991635_100000685059 [0,2,0,0,0,0|1,0,0]=3 9368 B14R1.14946 CNCc1cc(c(cc1Cl)OC)OC 207a_100102657272_100000186741 [0,2,0,0,0,0|1,0,0]=3 9369 B14R1.14946 CNCc1cc(c(cc1Cl)OC)OC 270004a_106832991635_100000186741 [0,2,0,0,0,0|1,0,0]=3 9370 B14R1.14946 CNCc1cc(c(cc1F)OC)OC 207a_100102657272_100011218750 [0,2,0,0,0,0|1,0,0]=3 9371 B14R1.14946 CNCc1cc(c(cc1F)OC)OC 270004a_106832991635_100011218750 [0,2,0,0,0,0|1,0,0]=3 9372 B14R1.14946 CNCc1cc(c(cc1F)OC)OC 34a_100132302102_200000210301 [0,2,0,0,0,0|1,0,0]=3 9373 B14R1.14946 CNCc1cc(c(cc1I)OC)OC 207a_100102657272_100010174930 [0,2,0,0,0,0|1,0,0]=3 9374 B14R1.14946 CNCc1cc(c(cc1I)OC)OC 270004a_106832991635_100010174930 [0,2,0,0,0,0|1,0,0]=3 9375 B14R1.14946 COCc1cc(c(cc1Br)OC)OC 34a_100138415774_100011375086 [0,2,0,0,0,0|1,0,0]=3 9376 B14R1.14946 COCc1cc(c(cc1Br)OC)OC 34a_200000246283_200000210301 [0,2,0,0,0,0|1,0,0]=3 9377 B14R1.14946 COCc1cc(c(cc1Br)OC)OC 7a_200000246283_200000210301 [0,2,0,0,0,0|1,0,0]=3 9378 B14R1.14946 COc1cc(c(cc1OC)CC#N)O 271570a_203496583355_100000199111 [0,2,0,0,0,0|1,0,1]=4 9379 B14R1.14946 COc1cc(c(cc1OC)CCN)O 271570a_203496583355_200000215632 [0,2,0,0,0,0|1,0,0]=3 9380 B14R1.14946 COc1cc(c(cc1OC)CN[13CH3])F 34a_100132302102_200025704644 [0,2,0,0,0,0|1,0,0]=3 9381 B14R1.14946 COc1cc(c(cc1OC)CO[13CH3])Br 34a_200000246283_200025704644 [0,2,0,0,0,0|1,0,0]=3 9382 B14R1.14946 COc1cc(c(cc1OC)CO[13CH3])Br 7a_200000246283_200025704644 [0,2,0,0,0,0|1,0,0]=3 9383 B14R1.14946 COc1cc(c(cc1OC)CSC)Br 62a_100011375086_200000210301 [0,2,0,0,0,0|1,0,0]=3 9384 B14R1.14946 COc1cc(c(cc1OC)CS[13CH3])Br 62a_100011375086_200025704644 [0,2,0,0,0,0|1,0,0]=3 9385 B14R1.14946 COc1cc(c(cc1OC)NCF)C 34a_100000183460_100015361967 [0,2,0,0,0,0|2,0,0]=4 9386 B14R1.14946 COc1cc(c(cc1OC)NCF)F 34a_100000753170_100015361967 [0,2,0,0,0,0|2,0,0]=4 9387 B14R1.14946 COc1cc(c(cc1OC)SCF)F 62a_200011765842_100015361967 [0,2,0,0,0,0|2,0,0]=4 9388 B14R1.491 CCSc1ccc(c(c1)C(C)(C)C)O 62a_100000210202_100000704011 [0,2,0,0,0,0|2,0,0]=4 9389 B14R1.491 CCSc1ccc(c(c1)C(C)(C)C)O 62a_100000704011_100000210202 [0,2,0,0,0,0|2,0,0]=4 9390 B14R1.491 CCSc1ccc(c(c1)S(=O)(=O)C)O 62a_200015712519_100000210202 [0,2,0,0,0,0|1,1,0]=4 9391 B14R1.794 CC(C)c1cc(ccc1O)SCCF 62a_100000691460_100011217306 [0,2,0,0,0,0|2,0,0]=4 9392 B14R1.794 CC(C)c1cc(ccc1O)SCCF 62a_100011217306_100000691460 [0,2,0,0,0,0|2,0,0]=4 9393 B14R1.794 CC(C)c1cc(ccc1O)SCCO 62a_100000211926_100000691460 [0,2,0,0,0,0|2,0,0]=4 9394 B14R1.794 CC(C)c1cc(ccc1O)SCCO 62a_100000691460_100000211926 [0,2,0,0,0,0|2,0,0]=4 9395 B14R1.794 CCCCc1ccc(c(c1)B(O)O)O 271570a_100020621405_200009814749 [0,2,0,0,0,0|2,0,0]=4 9396 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)C 271570a_100020621405_100012706819 [0,2,0,0,0,0|2,0,0]=4 9397 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)Cl 271570a_100020621405_100010712560 [0,2,0,0,0,0|2,0,0]=4 9398 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)F 271570a_100020621405_100000689017 [0,2,0,0,0,0|2,0,0]=4 9399 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)N 271570a_100020621405_100000695420 [0,2,0,0,0,0|2,0,0]=4 9400 B14R1.794 CCCCc1ccc(c(c1)C(=O)C)O 271570a_100020621405_100000212127 [0,2,0,0,0,0|1,0,0]=3 9401 B14R1.794 CCCCc1ccc(c(c1)C(=O)N)O 271570a_100020621405_100000192807 [0,2,0,0,0,0|2,0,0]=4 9402 B14R1.794 CCCCc1ccc(c(c1)C(C)C)F 271570a_100020621405_200053017515 [0,2,0,0,0,0|2,0,0]=4 9403 B14R1.794 CCCCc1ccc(c(c1)C(C)C)N 271570a_100020621405_100000694223 [0,2,0,0,0,0|2,0,0]=4 9404 B14R1.794 CCCCc1ccc(c(c1)C(C)C)O 271570a_100020621405_100000691460 [0,2,0,0,0,0|1,0,0]=3 9405 B14R1.794 CCCCc1ccc(c(c1)C(C)O)F 271570a_100020621405_100011943926 [0,2,0,0,0,0|2,0,0]=4 9406 B14R1.794 CCCCc1ccc(c(c1)N(C)C)F 271570a_100020621405_100010288836 [0,2,0,0,0,0|2,0,0]=4 9407 B14R1.794 CCCNc1ccc(c(c1)N(C)C)C 34a_100011708272_100000210303 [0,2,0,0,0,0|2,0,0]=4 9408 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)Cl 34a_100009867868_100000210303 [0,2,0,0,0,0|2,0,0]=4 9409 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)Cl 7a_100009867868_100000210303 [0,2,0,0,0,0|2,0,0]=4 9410 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)F 34a_100000091700_100000210303 [0,2,0,0,0,0|2,0,0]=4 9411 B14R1.794 CCCOc1ccc(c(c1)C(=O)C)F 7a_100000091700_100000210303 [0,2,0,0,0,0|2,0,0]=4 9412 B14R1.794 CCCOc1ccc(c(c1)N(C)C)C 34a_200000087912_100000210303 [0,2,0,0,0,0|2,0,0]=4 9413 B14R1.794 CCCOc1ccc(c(c1)N(C)C)I 34a_200010083878_100000210303 [0,2,0,0,0,0|2,0,0]=4 9414 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)C 62a_100012706819_100000210303 [0,2,0,0,0,0|2,0,0]=4 9415 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)Cl 62a_100010712560_100000210303 [0,2,0,0,0,0|2,0,0]=4 9416 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)F 62a_100000210303_100010254839 [0,2,0,0,0,0|2,0,0]=4 9417 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)F 62a_100000689017_100000210303 [0,2,0,0,0,0|2,0,0]=4 9418 B14R1.794 CCCSc1ccc(c(c1)C(=O)C)N 62a_100000695420_100000210303 [0,2,0,0,0,0|2,0,0]=4 9419 B14R1.794 CCCSc1ccc(c(c1)C(=O)N)O 62a_100000192807_100000210303 [0,2,0,0,0,0|2,0,0]=4 9420 B14R1.794 CCCSc1ccc(c(c1)C(C)C)F 62a_100000210303_200053017515 [0,2,0,0,0,0|2,0,0]=4 9421 B14R1.794 CCCSc1ccc(c(c1)C(C)C)F 62a_200053017515_100000210303 [0,2,0,0,0,0|2,0,0]=4 9422 B14R1.794 CCCSc1ccc(c(c1)C(C)C)N 62a_100000210303_100000694223 [0,2,0,0,0,0|2,0,0]=4 9423 B14R1.794 CCCSc1ccc(c(c1)C(C)C)N 62a_100000694223_100000210303 [0,2,0,0,0,0|2,0,0]=4 9424 B14R1.794 CCCSc1ccc(c(c1)C(C)C)O 62a_100000210303_100000691460 [0,2,0,0,0,0|1,0,0]=3 9425 B14R1.794 CCCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000210303 [0,2,0,0,0,0|1,0,0]=3 9426 B14R1.794 CCCSc1ccc(c(c1)C(C)O)F 62a_100000210303_100011943926 [0,2,0,0,0,0|2,0,0]=4 9427 B14R1.794 CCCSc1ccc(c(c1)C(C)O)F 62a_100011943926_100000210303 [0,2,0,0,0,0|2,0,0]=4 9428 B14R1.794 CCCSc1ccc(c(c1)N(C)C)F 62a_100000210303_100010288836 [0,2,0,0,0,0|2,0,0]=4 9429 B14R1.794 CCCSc1ccc(c(c1)N(C)C)F 62a_100010288836_100000210303 [0,2,0,0,0,0|2,0,0]=4 9430 B14R1.794 CCNCc1ccc(c(c1)[N+](=O)[O-])O 2230a_100015525214_100010149780 [0,2,0,0,0,0|2,0,0]=4 9431 B14R1.794 CNCCc1ccc(c(c1)[N+](=O)[O-])O 2230a_100000075816_200000210301 [0,2,0,0,0,0|2,0,0]=4 9432 B14R1.794 COCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100000766300 [0,2,0,0,0,0|2,0,0]=4 9433 B14R1.794 COCSc1ccc(c(c1)C(C)C)O 62a_100000766300_100000691460 [0,2,0,0,0,0|2,0,0]=4 9434 B14R1.794 CSCSc1ccc(c(c1)C(C)C)O 62a_100000691460_100011218213 [0,2,0,0,0,0|2,0,0]=4 9435 B14R1.794 CSCSc1ccc(c(c1)C(C)C)O 62a_100011218213_100000691460 [0,2,0,0,0,0|2,0,0]=4 9436 B14R1.794 [13CH3]NCCc1ccc(c(c1)[N+](=O)[O-])O 2230a_100000075816_200025704644 [0,2,0,0,0,0|2,0,0]=4 9437 B14R1.3329 CCNc1cc(c(cc1C)O)C(C)C 34a_100000686282_100000210202 [0,2,0,0,0,0|2,0,0]=4 9438 B14R1.3329 CCNc1cc(c(cc1C)O)C(C)C 7a_100000686282_100000210202 [0,2,0,0,0,0|2,0,0]=4 9439 B14R1.3329 CCSc1cc(c(cc1C)O)C(=O)C 62a_200010233951_100000210202 [0,2,0,0,0,0|2,0,0]=4 9440 B14R1.3329 CCSc1cc(c(cc1F)O)C(=O)C 62a_100000691652_100000210202 [0,2,0,0,0,0|2,0,0]=4 9441 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 2230a_100000765947_100000748629 [0,2,0,0,0,0|1,0,1]=4 9442 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Br 34a_100000765947_100000748629 [0,2,0,0,0,0|1,0,1]=4 9443 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 2230a_100011279678_100000748629 [0,2,0,0,0,0|1,0,1]=4 9444 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)C 34a_100011279678_100000748629 [0,2,0,0,0,0|1,0,1]=4 9445 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000748629 [0,2,0,0,0,0|1,0,1]=4 9446 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)Cl 34a_100000742311_100000748629 [0,2,0,0,0,0|1,0,1]=4 9447 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 2230a_100000701188_100000748629 [0,2,0,0,0,0|1,0,1]=4 9448 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)F 34a_100000701188_100000748629 [0,2,0,0,0,0|1,0,1]=4 9449 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)I 34a_100000746945_100000748629 [0,2,0,0,0,0|1,0,1]=4 9450 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748629 [0,2,0,0,0,0|0,0,1]=3 9451 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 34a_100011827694_100000748629 [0,2,0,0,0,0|1,0,1]=4 9452 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Br 7a_100011827694_100000748629 [0,2,0,0,0,0|1,0,1]=4 9453 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 34a_100009865632_100000748629 [0,2,0,0,0,0|1,0,1]=4 9454 B14R1.42 C=C(C)COc1ccc(c(c1)OC)C 7a_100009865632_100000748629 [0,2,0,0,0,0|1,0,1]=4 9455 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 34a_100012186310_100000748629 [0,2,0,0,0,0|1,0,1]=4 9456 B14R1.42 C=C(C)COc1ccc(c(c1)OC)Cl 7a_100012186310_100000748629 [0,2,0,0,0,0|1,0,1]=4 9457 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 34a_100012001760_100000748629 [0,2,0,0,0,0|1,0,1]=4 9458 B14R1.42 C=C(C)COc1ccc(c(c1)OC)F 7a_100012001760_100000748629 [0,2,0,0,0,0|1,0,1]=4 9459 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 34a_100015326901_100000748629 [0,2,0,0,0,0|1,0,1]=4 9460 B14R1.42 C=C(C)COc1ccc(c(c1)OC)N 7a_100015326901_100000748629 [0,2,0,0,0,0|1,0,1]=4 9461 B14R1.42 C=C(C)CSc1ccc(c(c1)CC)O 62a_100000748629_100012338938 [0,2,0,0,0,0|1,0,1]=4 9462 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100000748629_100012353699 [0,2,0,0,0,0|1,0,1]=4 9463 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Br 62a_100012353699_100000211660 [0,2,0,0,0,0|1,0,1]=4 9464 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100000748629_100011830276 [0,2,0,0,0,0|1,0,1]=4 9465 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)C 62a_100011830276_100000211660 [0,2,0,0,0,0|1,0,1]=4 9466 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100000748629_100011356853 [0,2,0,0,0,0|1,0,1]=4 9467 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)Cl 62a_100011356853_100000211660 [0,2,0,0,0,0|1,0,1]=4 9468 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100000748629_100011934186 [0,2,0,0,0,0|1,0,1]=4 9469 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)F 62a_100011934186_100000211660 [0,2,0,0,0,0|1,0,1]=4 9470 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100000748629_100015196925 [0,2,0,0,0,0|1,0,1]=4 9471 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)N 62a_100011279103_100000211660 [0,2,0,0,0,0|1,0,1]=4 9472 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)O 62a_100000748629_100000694246 [0,2,0,0,0,0|0,0,1]=3 9473 B14R1.42 C=C(C)CSc1ccc(c(n1)OC)O 62a_100000748629_100010893133 [0,2,0,0,0,0|1,0,1]=4 9474 B14R1.42 C=C(F)CNc1ccc(c(c1)OC)O 34a_100000726020_100009893438 [0,2,0,0,0,0|0,0,2]=4 9475 B14R1.42 C=C(F)CSc1ccc(c(c1)OC)O 62a_100000042424_100000694246 [0,2,0,0,0,0|0,0,2]=4 9476 B14R1.42 CC(C)CNc1ccc(c(c1)C#N)O 34a_100011249283_100000210624 [0,2,0,0,0,0|2,0,0]=4 9477 B14R1.42 CC(C)CSc1ccc(c(c1)C#N)O 62a_100000210624_100000687585 [0,2,0,0,0,0|2,0,0]=4 9478 B14R1.42 CC(C)CSc1ccc(c(c1)C=O)O 62a_100000210624_100000186750 [0,2,0,0,0,0|2,0,0]=4 9479 B14R1.42 CC(C)CSc1ccc(c(c1)CN)O 62a_100000210624_100000730032 [0,2,0,0,0,0|2,0,0]=4 9480 B14R1.42 CC(C)CSc1ccc(c(c1)CN)O 62a_100000730032_100000210760 [0,2,0,0,0,0|2,0,0]=4 9481 B14R1.42 CC(C)CSc1ccc(c(c1)CO)O 62a_100000184703_100000210760 [0,2,0,0,0,0|2,0,0]=4 9482 B14R1.42 CC(C)CSc1ccc(c(c1)CO)O 62a_100000210624_100000184703 [0,2,0,0,0,0|2,0,0]=4 9483 B14R1.42 CC(C)SCc1ccc(c(c1)C=O)O 62a_100000210206_100000008128 [0,2,0,0,0,0|2,0,0]=4 9484 B14R1.42 CC(O)CNc1ccc(c(c1)C#N)O 34a_100011249283_100011218427 [0,2,0,0,0,0|2,0,0]=4 9485 B14R1.42 CC(O)CSc1ccc(c(c1)C#N)O 62a_100011218427_100000687585 [0,2,0,0,0,0|2,0,0]=4 9486 B14R1.42 CC(O)CSc1ccc(c(c1)C=O)O 62a_100011218427_100000186750 [0,2,0,0,0,0|2,0,0]=4 9487 B14R1.42 CC(O)CSc1ccc(c(c1)CN)O 62a_100000730032_100011218427 [0,2,0,0,0,0|2,0,0]=4 9488 B14R1.42 CC(O)CSc1ccc(c(c1)CN)O 62a_100011218427_100000730032 [0,2,0,0,0,0|2,0,0]=4 9489 B14R1.42 CC(O)CSc1ccc(c(c1)CO)O 62a_100000184703_100011218427 [0,2,0,0,0,0|2,0,0]=4 9490 B14R1.42 CC(O)CSc1ccc(c(c1)CO)O 62a_100011218427_100000184703 [0,2,0,0,0,0|2,0,0]=4 9491 B14R1.42 CCc1cc(ccc1Br)NCC(C)C 2230a_100010109747_100000210760 [0,2,0,0,0,0|2,0,0]=4 9492 B14R1.42 CCc1cc(ccc1Br)NCC(C)C 34a_100010109747_100000210624 [0,2,0,0,0,0|2,0,0]=4 9493 B14R1.42 CCc1cc(ccc1Br)NCC(C)C 7a_100010109747_100000210760 [0,2,0,0,0,0|2,0,0]=4 9494 B14R1.42 CCc1cc(ccc1Br)NCC(C)O 2230a_100010109747_100011218427 [0,2,0,0,0,0|2,0,0]=4 9495 B14R1.42 CCc1cc(ccc1Br)NCC(C)O 34a_100010109747_100011218427 [0,2,0,0,0,0|2,0,0]=4 9496 B14R1.42 CCc1cc(ccc1Br)NCC(C)O 7a_100010109747_100011218427 [0,2,0,0,0,0|2,0,0]=4 9497 B14R1.42 CCc1cc(ccc1Br)NC[C@@H](C)O 2230a_100010109747_100009817552 [0,2,0,0,0,0|2,0,0]=4 9498 B14R1.42 CCc1cc(ccc1Br)NC[C@@H](C)O 34a_100010109747_100009817552 [0,2,0,0,0,0|2,0,0]=4 9499 B14R1.42 CCc1cc(ccc1Br)NC[C@@H](C)O 7a_100010109747_100009817552 [0,2,0,0,0,0|2,0,0]=4 9500 B14R1.42 CCc1cc(ccc1Br)SCC(C)C 62a_100000210624_100010244631 [0,2,0,0,0,0|2,0,0]=4 9501 B14R1.42 CCc1cc(ccc1Br)SCC(C)C 62a_100010244631_100000210760 [0,2,0,0,0,0|2,0,0]=4 9502 B14R1.42 CCc1cc(ccc1Br)SCC(C)O 62a_100010244631_100011218427 [0,2,0,0,0,0|2,0,0]=4 9503 B14R1.42 CCc1cc(ccc1Br)SCC(C)O 62a_100011218427_100010244631 [0,2,0,0,0,0|2,0,0]=4 9504 B14R1.42 CCc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_100010244631 [0,2,0,0,0,0|2,0,0]=4 9505 B14R1.42 CCc1cc(ccc1Br)SC[C@@H](C)O 62a_100010244631_100009817552 [0,2,0,0,0,0|2,0,0]=4 9506 B14R1.42 CCc1cc(ccc1Cl)OCC(C)C 34a_100000212063_100000210624 [0,2,0,0,0,0|2,0,0]=4 9507 B14R1.42 CCc1cc(ccc1Cl)OCC(C)C 7a_100000212063_100000210760 [0,2,0,0,0,0|2,0,0]=4 9508 B14R1.42 CCc1cc(ccc1Cl)OCC(C)O 34a_100000212063_100011218427 [0,2,0,0,0,0|2,0,0]=4 9509 B14R1.42 CCc1cc(ccc1Cl)OCC(C)O 7a_100000212063_100011218427 [0,2,0,0,0,0|2,0,0]=4 9510 B14R1.42 CCc1cc(ccc1Cl)OC[C@@H](C)O 34a_100000212063_100009817552 [0,2,0,0,0,0|2,0,0]=4 9511 B14R1.42 CCc1cc(ccc1Cl)OC[C@@H](C)O 7a_100000212063_100009817552 [0,2,0,0,0,0|2,0,0]=4 9512 B14R1.42 CCc1cc(ccc1F)CNC(C)C 207a_100138425928_100009840867 [0,2,0,0,0,0|2,0,0]=4 9513 B14R1.42 CCc1cc(ccc1F)CNC(C)C 2230a_114873767189_100000210206 [0,2,0,0,0,0|2,0,0]=4 9514 B14R1.42 CCc1cc(ccc1F)CNC(C)C 34a_114873767189_100000210206 [0,2,0,0,0,0|2,0,0]=4 9515 B14R1.42 CCc1cc(ccc1F)SCC(C)C 62a_100000210624_100010244625 [0,2,0,0,0,0|2,0,0]=4 9516 B14R1.42 CCc1cc(ccc1F)SCC(C)C 62a_100010244625_100000210760 [0,2,0,0,0,0|2,0,0]=4 9517 B14R1.42 CCc1cc(ccc1F)SCC(C)O 62a_100010244625_100011218427 [0,2,0,0,0,0|2,0,0]=4 9518 B14R1.42 CCc1cc(ccc1F)SCC(C)O 62a_100011218427_100010244625 [0,2,0,0,0,0|2,0,0]=4 9519 B14R1.42 CCc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100010244625 [0,2,0,0,0,0|2,0,0]=4 9520 B14R1.42 CCc1cc(ccc1F)SC[C@@H](C)O 62a_100010244625_100009817552 [0,2,0,0,0,0|2,0,0]=4 9521 B14R1.42 CCc1cc(ccc1N)SCC(C)C 62a_100000210624_100000686106 [0,2,0,0,0,0|2,0,0]=4 9522 B14R1.42 CCc1cc(ccc1N)SCC(C)C 62a_100000686106_100000210760 [0,2,0,0,0,0|2,0,0]=4 9523 B14R1.42 CCc1cc(ccc1N)SCC(C)O 62a_100000686106_100011218427 [0,2,0,0,0,0|2,0,0]=4 9524 B14R1.42 CCc1cc(ccc1N)SCC(C)O 62a_100011218427_100000686106 [0,2,0,0,0,0|2,0,0]=4 9525 B14R1.42 CCc1cc(ccc1N)SC[C@@H](C)O 62a_100000686106_100009817552 [0,2,0,0,0,0|2,0,0]=4 9526 B14R1.42 CCc1cc(ccc1N)SC[C@@H](C)O 62a_100009817552_100000686106 [0,2,0,0,0,0|2,0,0]=4 9527 B14R1.42 CCc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100012338938 [0,2,0,0,0,0|1,0,1]=4 9528 B14R1.42 CCc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100012338938 [0,2,0,0,0,0|1,0,1]=4 9529 B14R1.42 CCc1cc(ccc1O)SCC(C)C 62a_100000210624_100012338938 [0,2,0,0,0,0|1,0,0]=3 9530 B14R1.42 CCc1cc(ccc1O)SCC(C)O 62a_100011218427_100012338938 [0,2,0,0,0,0|1,0,0]=3 9531 B14R1.42 CCc1cc(ccc1O)SCC(F)F 62a_100011934356_100012338938 [0,2,0,0,0,0|2,0,0]=4 9532 B14R1.42 CCc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100012338938 [0,2,0,0,0,0|1,0,0]=3 9533 B14R1.42 CNc1cc(ccc1C)SCC(C)C 62a_100000210624_100020629602 [0,2,0,0,0,0|2,0,0]=4 9534 B14R1.42 CNc1cc(ccc1C)SCC(C)C 62a_100020629602_100000210760 [0,2,0,0,0,0|2,0,0]=4 9535 B14R1.42 CNc1cc(ccc1C)SCC(C)O 62a_100011218427_100020629602 [0,2,0,0,0,0|2,0,0]=4 9536 B14R1.42 CNc1cc(ccc1C)SCC(C)O 62a_100020629602_100011218427 [0,2,0,0,0,0|2,0,0]=4 9537 B14R1.42 CNc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100020629602 [0,2,0,0,0,0|2,0,0]=4 9538 B14R1.42 CNc1cc(ccc1C)SC[C@@H](C)O 62a_100020629602_100009817552 [0,2,0,0,0,0|2,0,0]=4 9539 B14R1.42 CNc1cc(ccc1F)SCC(C)C 62a_100000210624_100011314990 [0,2,0,0,0,0|2,0,0]=4 9540 B14R1.42 CNc1cc(ccc1F)SCC(C)C 62a_100011314990_100000210760 [0,2,0,0,0,0|2,0,0]=4 9541 B14R1.42 CNc1cc(ccc1F)SCC(C)O 62a_100011218427_100011314990 [0,2,0,0,0,0|2,0,0]=4 9542 B14R1.42 CNc1cc(ccc1F)SCC(C)O 62a_100011314990_100011218427 [0,2,0,0,0,0|2,0,0]=4 9543 B14R1.42 CNc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100011314990 [0,2,0,0,0,0|2,0,0]=4 9544 B14R1.42 CNc1cc(ccc1F)SC[C@@H](C)O 62a_100011314990_100009817552 [0,2,0,0,0,0|2,0,0]=4 9545 B14R1.42 CNc1cc(ccc1N)SCC(C)C 62a_100000694363_100000210760 [0,2,0,0,0,0|2,0,0]=4 9546 B14R1.42 CNc1cc(ccc1N)SCC(C)O 62a_100000694363_100011218427 [0,2,0,0,0,0|2,0,0]=4 9547 B14R1.42 CNc1cc(ccc1N)SC[C@@H](C)O 62a_100000694363_100009817552 [0,2,0,0,0,0|2,0,0]=4 9548 B14R1.42 COc1cc(c[nH]c1=O)SCC(C)C 62a_100000210624_100010125397 [0,2,0,0,0,0|1,0,1]=4 9549 B14R1.42 COc1cc(c[nH]c1=O)SCC(C)O 62a_100011218427_100010125397 [0,2,0,0,0,0|1,0,1]=4 9550 B14R1.42 COc1cc(c[nH]c1=O)SC[C@@H](C)O 62a_100009817552_100010125397 [0,2,0,0,0,0|1,0,1]=4 9551 B14R1.42 COc1cc(ccc1Br)C=CC(C)C 271570a_100016257149_100012353699 [0,2,0,0,0,0|1,0,1]=4 9552 B14R1.42 COc1cc(ccc1Br)C=CC(C)O 271570a_200011019289_100012353699 [0,2,0,0,0,0|1,0,1]=4 9553 B14R1.42 COc1cc(ccc1Br)CNC(C)C 207a_100138425928_100010244714 [0,2,0,0,0,0|1,0,0]=3 9554 B14R1.42 COc1cc(ccc1Br)CNC(C)C 2230a_100138425928_100010110085 [0,2,0,0,0,0|1,0,0]=3 9555 B14R1.42 COc1cc(ccc1Br)CNC(C)C 34a_100138425928_100010110085 [0,2,0,0,0,0|1,0,0]=3 9556 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100000212225_100010110085 [0,2,0,0,0,0|1,0,0]=3 9557 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100010234685_100000210206 [0,2,0,0,0,0|1,0,0]=3 9558 B14R1.42 COc1cc(ccc1Br)COC(C)C 7a_100010234685_100000210206 [0,2,0,0,0,0|1,0,0]=3 9559 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100000210206_100010110085 [0,2,0,0,0,0|1,0,0]=3 9560 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100010110085_100000210206 [0,2,0,0,0,0|1,0,0]=3 9561 B14R1.42 COc1cc(ccc1Br)NCC(C)C 2230a_100000765947_100000210760 [0,2,0,0,0,0|1,0,0]=3 9562 B14R1.42 COc1cc(ccc1Br)NCC(C)C 34a_100000765947_100000210624 [0,2,0,0,0,0|1,0,0]=3 9563 B14R1.42 COc1cc(ccc1Br)NCC(C)O 2230a_100000765947_100011218427 [0,2,0,0,0,0|1,0,0]=3 9564 B14R1.42 COc1cc(ccc1Br)NCC(C)O 34a_100000765947_100011218427 [0,2,0,0,0,0|1,0,0]=3 9565 B14R1.42 COc1cc(ccc1Br)NCC(F)F 2230a_100000765947_100011934356 [0,2,0,0,0,0|2,0,0]=4 9566 B14R1.42 COc1cc(ccc1Br)NCC(F)F 34a_100000765947_100011934356 [0,2,0,0,0,0|2,0,0]=4 9567 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 2230a_100000765947_100009817552 [0,2,0,0,0,0|1,0,0]=3 9568 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 34a_100000765947_100009817552 [0,2,0,0,0,0|1,0,0]=3 9569 B14R1.42 COc1cc(ccc1Br)OCC(C)C 34a_100011827694_100000210624 [0,2,0,0,0,0|1,0,0]=3 9570 B14R1.42 COc1cc(ccc1Br)OCC(C)C 7a_100011827694_100000210760 [0,2,0,0,0,0|1,0,0]=3 9571 B14R1.42 COc1cc(ccc1Br)OCC(C)O 34a_100011827694_100011218427 [0,2,0,0,0,0|1,0,0]=3 9572 B14R1.42 COc1cc(ccc1Br)OCC(C)O 7a_100011827694_100011218427 [0,2,0,0,0,0|1,0,0]=3 9573 B14R1.42 COc1cc(ccc1Br)OCC(F)F 34a_100011827694_100011934356 [0,2,0,0,0,0|2,0,0]=4 9574 B14R1.42 COc1cc(ccc1Br)OCC(F)F 7a_100011827694_100011934356 [0,2,0,0,0,0|2,0,0]=4 9575 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 34a_100011827694_100009817552 [0,2,0,0,0,0|1,0,0]=3 9576 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 7a_100011827694_100009817552 [0,2,0,0,0,0|1,0,0]=3 9577 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100000210624_100012353699 [0,2,0,0,0,0|1,0,0]=3 9578 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100012353699_100000210760 [0,2,0,0,0,0|1,0,0]=3 9579 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100011218427_100012353699 [0,2,0,0,0,0|1,0,0]=3 9580 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100012353699_100011218427 [0,2,0,0,0,0|1,0,0]=3 9581 B14R1.42 COc1cc(ccc1Br)SCC(F)F 62a_100011934356_100012353699 [0,2,0,0,0,0|2,0,0]=4 9582 B14R1.42 COc1cc(ccc1Br)SCC(F)F 62a_100012353699_100011934356 [0,2,0,0,0,0|2,0,0]=4 9583 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_100012353699 [0,2,0,0,0,0|1,0,0]=3 9584 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100012353699_100009817552 [0,2,0,0,0,0|1,0,0]=3 9585 B14R1.42 COc1cc(ccc1C)C=CC(C)C 271570a_100016257149_100011830276 [0,2,0,0,0,0|1,0,1]=4 9586 B14R1.42 COc1cc(ccc1C)C=CC(C)O 271570a_200011019289_100011830276 [0,2,0,0,0,0|1,0,1]=4 9587 B14R1.42 COc1cc(ccc1C)CCC(=O)C 1458a_200000066385_200000210301 [0,2,0,0,0,0|1,0,0]=3 9588 B14R1.42 COc1cc(ccc1C)CCC(=O)[13CH3] 1458a_200000066385_200025704644 [0,2,0,0,0,0|1,0,0]=3 9589 B14R1.42 COc1cc(ccc1C)CNC(C)C 207a_100138425928_100000719150 [0,2,0,0,0,0|1,0,0]=3 9590 B14R1.42 COc1cc(ccc1C)COC(C)C 34a_100000752651_100000210206 [0,2,0,0,0,0|1,0,0]=3 9591 B14R1.42 COc1cc(ccc1C)COC(C)C 7a_100000752651_100000210206 [0,2,0,0,0,0|1,0,0]=3 9592 B14R1.42 COc1cc(ccc1C)NCC(C)C 2230a_100011279678_100000210760 [0,2,0,0,0,0|1,0,0]=3 9593 B14R1.42 COc1cc(ccc1C)NCC(C)C 34a_100011279678_100000210624 [0,2,0,0,0,0|1,0,0]=3 9594 B14R1.42 COc1cc(ccc1C)NCC(C)O 2230a_100011279678_100011218427 [0,2,0,0,0,0|1,0,0]=3 9595 B14R1.42 COc1cc(ccc1C)NCC(C)O 34a_100011279678_100011218427 [0,2,0,0,0,0|1,0,0]=3 9596 B14R1.42 COc1cc(ccc1C)NCC(F)F 2230a_100011279678_100011934356 [0,2,0,0,0,0|2,0,0]=4 9597 B14R1.42 COc1cc(ccc1C)NCC(F)F 34a_100011279678_100011934356 [0,2,0,0,0,0|2,0,0]=4 9598 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 2230a_100011279678_100009817552 [0,2,0,0,0,0|1,0,0]=3 9599 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 34a_100011279678_100009817552 [0,2,0,0,0,0|1,0,0]=3 9600 B14R1.42 COc1cc(ccc1C)OCC(C)C 34a_100009865632_100000210624 [0,2,0,0,0,0|1,0,0]=3 9601 B14R1.42 COc1cc(ccc1C)OCC(C)C 7a_100009865632_100000210760 [0,2,0,0,0,0|1,0,0]=3 9602 B14R1.42 COc1cc(ccc1C)OCC(C)O 34a_100009865632_100011218427 [0,2,0,0,0,0|1,0,0]=3 9603 B14R1.42 COc1cc(ccc1C)OCC(C)O 7a_100009865632_100011218427 [0,2,0,0,0,0|1,0,0]=3 9604 B14R1.42 COc1cc(ccc1C)OCC(F)F 34a_100009865632_100011934356 [0,2,0,0,0,0|2,0,0]=4 9605 B14R1.42 COc1cc(ccc1C)OCC(F)F 7a_100009865632_100011934356 [0,2,0,0,0,0|2,0,0]=4 9606 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 34a_100009865632_100009817552 [0,2,0,0,0,0|1,0,0]=3 9607 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 7a_100009865632_100009817552 [0,2,0,0,0,0|1,0,0]=3 9608 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100000210624_100011830276 [0,2,0,0,0,0|1,0,0]=3 9609 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100011830276_100000210760 [0,2,0,0,0,0|1,0,0]=3 9610 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011218427_100011830276 [0,2,0,0,0,0|1,0,0]=3 9611 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011830276_100011218427 [0,2,0,0,0,0|1,0,0]=3 9612 B14R1.42 COc1cc(ccc1C)SCC(F)F 62a_100011830276_100011934356 [0,2,0,0,0,0|2,0,0]=4 9613 B14R1.42 COc1cc(ccc1C)SCC(F)F 62a_100011934356_100011830276 [0,2,0,0,0,0|2,0,0]=4 9614 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100011830276 [0,2,0,0,0,0|1,0,0]=3 9615 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100011830276_100009817552 [0,2,0,0,0,0|1,0,0]=3 9616 B14R1.42 COc1cc(ccc1Cl)C=CC(C)C 271570a_100016257149_100011356853 [0,2,0,0,0,0|1,0,1]=4 9617 B14R1.42 COc1cc(ccc1Cl)C=CC(C)O 271570a_200011019289_100011356853 [0,2,0,0,0,0|1,0,1]=4 9618 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 11a_100015204853_100015343762 [0,2,0,0,0,0|1,0,1]=4 9619 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 1626a_100015204853_100015343762 [0,2,0,0,0,0|1,0,1]=4 9620 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 240690a_100015204853_100015343762 [0,2,0,0,0,0|1,0,1]=4 9621 B14R1.42 COc1cc(ccc1Cl)CNC(=O)C 527a_100015204853_100103153847 [0,2,0,0,0,0|1,0,1]=4 9622 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 207a_100138425928_100011998524 [0,2,0,0,0,0|1,0,0]=3 9623 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100015204853_100000210206 [0,2,0,0,0,0|1,0,0]=3 9624 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100138425928_200010214485 [0,2,0,0,0,0|1,0,0]=3 9625 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100015204853_100000210206 [0,2,0,0,0,0|1,0,0]=3 9626 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100138425928_200010214485 [0,2,0,0,0,0|1,0,0]=3 9627 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100000212225_200010214485 [0,2,0,0,0,0|1,0,0]=3 9628 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100012179228_100000210206 [0,2,0,0,0,0|1,0,0]=3 9629 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_100000210206_200010214485 [0,2,0,0,0,0|1,0,0]=3 9630 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_200010214485_100000210206 [0,2,0,0,0,0|1,0,0]=3 9631 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 2230a_100000742311_100000210760 [0,2,0,0,0,0|1,0,0]=3 9632 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 34a_100000742311_100000210624 [0,2,0,0,0,0|1,0,0]=3 9633 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 2230a_100000742311_100011218427 [0,2,0,0,0,0|1,0,0]=3 9634 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 34a_100000742311_100011218427 [0,2,0,0,0,0|1,0,0]=3 9635 B14R1.42 COc1cc(ccc1Cl)NCC(F)F 2230a_100000742311_100011934356 [0,2,0,0,0,0|2,0,0]=4 9636 B14R1.42 COc1cc(ccc1Cl)NCC(F)F 34a_100000742311_100011934356 [0,2,0,0,0,0|2,0,0]=4 9637 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 2230a_100000742311_100009817552 [0,2,0,0,0,0|1,0,0]=3 9638 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 34a_100000742311_100009817552 [0,2,0,0,0,0|1,0,0]=3 9639 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 34a_100012186310_100000210624 [0,2,0,0,0,0|1,0,0]=3 9640 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 7a_100012186310_100000210760 [0,2,0,0,0,0|1,0,0]=3 9641 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 34a_100012186310_100011218427 [0,2,0,0,0,0|1,0,0]=3 9642 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 7a_100012186310_100011218427 [0,2,0,0,0,0|1,0,0]=3 9643 B14R1.42 COc1cc(ccc1Cl)OCC(F)F 34a_100012186310_100011934356 [0,2,0,0,0,0|2,0,0]=4 9644 B14R1.42 COc1cc(ccc1Cl)OCC(F)F 7a_100012186310_100011934356 [0,2,0,0,0,0|2,0,0]=4 9645 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 34a_100012186310_100009817552 [0,2,0,0,0,0|1,0,0]=3 9646 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 7a_100012186310_100009817552 [0,2,0,0,0,0|1,0,0]=3 9647 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100000210624_100011356853 [0,2,0,0,0,0|1,0,0]=3 9648 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100011356853_100000210760 [0,2,0,0,0,0|1,0,0]=3 9649 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011218427_100011356853 [0,2,0,0,0,0|1,0,0]=3 9650 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011356853_100011218427 [0,2,0,0,0,0|1,0,0]=3 9651 B14R1.42 COc1cc(ccc1Cl)SCC(F)F 62a_100011356853_100011934356 [0,2,0,0,0,0|2,0,0]=4 9652 B14R1.42 COc1cc(ccc1Cl)SCC(F)F 62a_100011934356_100011356853 [0,2,0,0,0,0|2,0,0]=4 9653 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100009817552_100011356853 [0,2,0,0,0,0|1,0,0]=3 9654 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100011356853_100009817552 [0,2,0,0,0,0|1,0,0]=3 9655 B14R1.42 COc1cc(ccc1F)C=CC(C)C 271570a_100016257149_100011934186 [0,2,0,0,0,0|1,0,1]=4 9656 B14R1.42 COc1cc(ccc1F)C=CC(C)O 271570a_200011019289_100011934186 [0,2,0,0,0,0|1,0,1]=4 9657 B14R1.42 COc1cc(ccc1F)CCC(=O)C 1458a_100009849056_200000210301 [0,2,0,0,0,0|1,0,0]=3 9658 B14R1.42 COc1cc(ccc1F)CCC(=O)[13CH3] 1458a_100009849056_200025704644 [0,2,0,0,0,0|1,0,0]=3 9659 B14R1.42 COc1cc(ccc1F)CNC(=O)C 11a_100020626639_100015343762 [0,2,0,0,0,0|1,0,1]=4 9660 B14R1.42 COc1cc(ccc1F)CNC(=O)C 1626a_100020626639_100015343762 [0,2,0,0,0,0|1,0,1]=4 9661 B14R1.42 COc1cc(ccc1F)CNC(=O)C 240690a_100020626639_100015343762 [0,2,0,0,0,0|1,0,1]=4 9662 B14R1.42 COc1cc(ccc1F)CNC(=O)C 527a_100020626639_100103153847 [0,2,0,0,0,0|1,0,1]=4 9663 B14R1.42 COc1cc(ccc1F)CNC(C)C 207a_100138425928_100000692873 [0,2,0,0,0,0|1,0,0]=3 9664 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100020626639_100000210206 [0,2,0,0,0,0|1,0,0]=3 9665 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100138425928_100012349856 [0,2,0,0,0,0|1,0,0]=3 9666 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100020626639_100000210206 [0,2,0,0,0,0|1,0,0]=3 9667 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100138425928_100012349856 [0,2,0,0,0,0|1,0,0]=3 9668 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000212225_100012349856 [0,2,0,0,0,0|1,0,0]=3 9669 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000692429_100000210206 [0,2,0,0,0,0|1,0,0]=3 9670 B14R1.42 COc1cc(ccc1F)COC(C)C 7a_100000692429_100000210206 [0,2,0,0,0,0|1,0,0]=3 9671 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100000210206_100012349856 [0,2,0,0,0,0|1,0,0]=3 9672 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100012349856_100000210206 [0,2,0,0,0,0|1,0,0]=3 9673 B14R1.42 COc1cc(ccc1F)NCC(C)C 2230a_100000701188_100000210760 [0,2,0,0,0,0|1,0,0]=3 9674 B14R1.42 COc1cc(ccc1F)NCC(C)C 34a_100000701188_100000210624 [0,2,0,0,0,0|1,0,0]=3 9675 B14R1.42 COc1cc(ccc1F)NCC(C)O 2230a_100000701188_100011218427 [0,2,0,0,0,0|1,0,0]=3 9676 B14R1.42 COc1cc(ccc1F)NCC(C)O 34a_100000701188_100011218427 [0,2,0,0,0,0|1,0,0]=3 9677 B14R1.42 COc1cc(ccc1F)NCC(F)F 2230a_100000701188_100011934356 [0,2,0,0,0,0|2,0,0]=4 9678 B14R1.42 COc1cc(ccc1F)NCC(F)F 34a_100000701188_100011934356 [0,2,0,0,0,0|2,0,0]=4 9679 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 2230a_100000701188_100009817552 [0,2,0,0,0,0|1,0,0]=3 9680 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 34a_100000701188_100009817552 [0,2,0,0,0,0|1,0,0]=3 9681 B14R1.42 COc1cc(ccc1F)OCC(C)C 34a_100012001760_100000210624 [0,2,0,0,0,0|1,0,0]=3 9682 B14R1.42 COc1cc(ccc1F)OCC(C)C 7a_100012001760_100000210760 [0,2,0,0,0,0|1,0,0]=3 9683 B14R1.42 COc1cc(ccc1F)OCC(C)O 34a_100012001760_100011218427 [0,2,0,0,0,0|1,0,0]=3 9684 B14R1.42 COc1cc(ccc1F)OCC(C)O 7a_100012001760_100011218427 [0,2,0,0,0,0|1,0,0]=3 9685 B14R1.42 COc1cc(ccc1F)OCC(F)F 34a_100012001760_100011934356 [0,2,0,0,0,0|2,0,0]=4 9686 B14R1.42 COc1cc(ccc1F)OCC(F)F 7a_100012001760_100011934356 [0,2,0,0,0,0|2,0,0]=4 9687 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 34a_100012001760_100009817552 [0,2,0,0,0,0|1,0,0]=3 9688 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 7a_100012001760_100009817552 [0,2,0,0,0,0|1,0,0]=3 9689 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100000210624_100011934186 [0,2,0,0,0,0|1,0,0]=3 9690 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100011934186_100000210760 [0,2,0,0,0,0|1,0,0]=3 9691 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011218427_100011934186 [0,2,0,0,0,0|1,0,0]=3 9692 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011934186_100011218427 [0,2,0,0,0,0|1,0,0]=3 9693 B14R1.42 COc1cc(ccc1F)SCC(F)F 62a_100011934186_100011934356 [0,2,0,0,0,0|2,0,0]=4 9694 B14R1.42 COc1cc(ccc1F)SCC(F)F 62a_100011934356_100011934186 [0,2,0,0,0,0|2,0,0]=4 9695 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100011934186 [0,2,0,0,0,0|1,0,0]=3 9696 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100011934186_100009817552 [0,2,0,0,0,0|1,0,0]=3 9697 B14R1.42 COc1cc(ccc1I)NCC(C)C 34a_100000746945_100000210624 [0,2,0,0,0,0|1,0,0]=3 9698 B14R1.42 COc1cc(ccc1I)NCC(C)O 34a_100000746945_100011218427 [0,2,0,0,0,0|1,0,0]=3 9699 B14R1.42 COc1cc(ccc1I)NCC(F)F 34a_100000746945_100011934356 [0,2,0,0,0,0|2,0,0]=4 9700 B14R1.42 COc1cc(ccc1I)NC[C@@H](C)O 34a_100000746945_100009817552 [0,2,0,0,0,0|1,0,0]=3 9701 B14R1.42 COc1cc(ccc1N)C=CC(C)C 271570a_100016257149_100011279103 [0,2,0,0,0,0|1,0,1]=4 9702 B14R1.42 COc1cc(ccc1N)C=CC(C)O 271570a_200011019289_100011279103 [0,2,0,0,0,0|1,0,1]=4 9703 B14R1.42 COc1cc(ccc1N)COC(C)C 34a_100000087641_100000210206 [0,2,0,0,0,0|1,0,0]=3 9704 B14R1.42 COc1cc(ccc1N)OCC(C)C 34a_100015326901_100000210624 [0,2,0,0,0,0|1,0,0]=3 9705 B14R1.42 COc1cc(ccc1N)OCC(C)C 7a_100015326901_100000210760 [0,2,0,0,0,0|1,0,0]=3 9706 B14R1.42 COc1cc(ccc1N)OCC(C)O 34a_100015326901_100011218427 [0,2,0,0,0,0|1,0,0]=3 9707 B14R1.42 COc1cc(ccc1N)OCC(C)O 7a_100015326901_100011218427 [0,2,0,0,0,0|1,0,0]=3 9708 B14R1.42 COc1cc(ccc1N)OCC(F)F 34a_100015326901_100011934356 [0,2,0,0,0,0|2,0,0]=4 9709 B14R1.42 COc1cc(ccc1N)OCC(F)F 7a_100015326901_100011934356 [0,2,0,0,0,0|2,0,0]=4 9710 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 34a_100015326901_100009817552 [0,2,0,0,0,0|1,0,0]=3 9711 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 7a_100015326901_100009817552 [0,2,0,0,0,0|1,0,0]=3 9712 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100000210624_100015196925 [0,2,0,0,0,0|1,0,0]=3 9713 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100011279103_100000210760 [0,2,0,0,0,0|1,0,0]=3 9714 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011218427_100015196925 [0,2,0,0,0,0|1,0,0]=3 9715 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011279103_100011218427 [0,2,0,0,0,0|1,0,0]=3 9716 B14R1.42 COc1cc(ccc1N)SCC(F)F 62a_100011279103_100011934356 [0,2,0,0,0,0|2,0,0]=4 9717 B14R1.42 COc1cc(ccc1N)SCC(F)F 62a_100011934356_100015196925 [0,2,0,0,0,0|2,0,0]=4 9718 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100009817552_100015196925 [0,2,0,0,0,0|1,0,0]=3 9719 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100011279103_100009817552 [0,2,0,0,0,0|1,0,0]=3 9720 B14R1.42 COc1cc(ccc1O)C=CC(=O)C 1458a_100000182119_200000210301 [0,2,0,0,0,0|0,0,2]=4 9721 B14R1.42 COc1cc(ccc1O)C=CC(=O)[13CH3] 1458a_100000182119_200025704644 [0,2,0,0,0,0|0,0,2]=4 9722 B14R1.42 COc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000694246 [0,2,0,0,0,0|0,0,1]=3 9723 B14R1.42 COc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000694246 [0,2,0,0,0,0|0,0,1]=3 9724 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [0,2,0,0,0,0|0,0,0]=2 9725 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [0,2,0,0,0,0|0,0,0]=2 9726 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [0,2,0,0,0,0|0,0,0]=2 9727 B14R1.42 COc1cc(ccc1O)CCN(C)C 2230a_100102631434_100010741665 [0,2,0,0,0,0|0,0,0]=2 9728 B14R1.42 COc1cc(ccc1O)CCN(C)C 269982a_100102631434_100010741665 [0,2,0,0,0,0|0,0,0]=2 9729 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [0,2,0,0,0,0|0,0,1]=3 9730 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [0,2,0,0,0,0|0,0,1]=3 9731 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [0,2,0,0,0,0|0,0,1]=3 9732 B14R1.42 COc1cc(ccc1O)CNC(C)C 34a_100000185554_100000210206 [0,2,0,0,0,0|0,0,0]=2 9733 B14R1.42 COc1cc(ccc1O)NCC(=O)N 34a_100000726020_100000187820 [0,2,0,0,0,0|1,0,1]=4 9734 B14R1.42 COc1cc(ccc1O)NCC(=O)[O-] 34a_100000726020_100020667443 [0,2,0,0,0,0|1,0,1]=4 9735 B14R1.42 COc1cc(ccc1O)NCC(C)C 34a_100000726020_100000210624 [0,2,0,0,0,0|0,0,0]=2 9736 B14R1.42 COc1cc(ccc1O)NCC(C)O 34a_100000726020_100011218427 [0,2,0,0,0,0|0,0,0]=2 9737 B14R1.42 COc1cc(ccc1O)NCC(F)F 34a_100000726020_100011934356 [0,2,0,0,0,0|1,0,0]=3 9738 B14R1.42 COc1cc(ccc1O)NC[C@@H](C)O 34a_100000726020_100009817552 [0,2,0,0,0,0|0,0,0]=2 9739 B14R1.42 COc1cc(ccc1O)NC[N+](=O)[O-] 34a_100000726020_100000761209 [0,2,0,0,0,0|2,0,0]=4 9740 B14R1.42 COc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000694246 [0,2,0,0,0,0|1,0,1]=4 9741 B14R1.42 COc1cc(ccc1O)SCC(=O)[O-] 62a_100020667443_100000694246 [0,2,0,0,0,0|1,0,1]=4 9742 B14R1.42 COc1cc(ccc1O)SCC(C)C 62a_100000210624_100000694246 [0,2,0,0,0,0|0,0,0]=2 9743 B14R1.42 COc1cc(ccc1O)SCC(C)O 62a_100011218427_100000694246 [0,2,0,0,0,0|0,0,0]=2 9744 B14R1.42 COc1cc(ccc1O)SCC(F)F 62a_100011934356_100000694246 [0,2,0,0,0,0|1,0,0]=3 9745 B14R1.42 COc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000694246 [0,2,0,0,0,0|0,0,0]=2 9746 B14R1.42 COc1cc(cnc1C)SCC(C)C 62a_100000210624_100010254219 [0,2,0,0,0,0|2,0,0]=4 9747 B14R1.42 COc1cc(cnc1C)SCC(C)C 62a_100010254219_100000210760 [0,2,0,0,0,0|2,0,0]=4 9748 B14R1.42 COc1cc(cnc1C)SCC(C)O 62a_100010254219_100011218427 [0,2,0,0,0,0|2,0,0]=4 9749 B14R1.42 COc1cc(cnc1C)SCC(C)O 62a_100011218427_100010254219 [0,2,0,0,0,0|2,0,0]=4 9750 B14R1.42 COc1cc(cnc1C)SC[C@@H](C)O 62a_100009817552_100010254219 [0,2,0,0,0,0|2,0,0]=4 9751 B14R1.42 COc1cc(cnc1C)SC[C@@H](C)O 62a_100010254219_100009817552 [0,2,0,0,0,0|2,0,0]=4 9752 B14R1.42 COc1cc(cnc1F)SCC(C)C 62a_100000210624_100010214931 [0,2,0,0,0,0|2,0,0]=4 9753 B14R1.42 COc1cc(cnc1F)SCC(C)C 62a_100010214931_100000210760 [0,2,0,0,0,0|2,0,0]=4 9754 B14R1.42 COc1cc(cnc1F)SCC(C)O 62a_100010214931_100011218427 [0,2,0,0,0,0|2,0,0]=4 9755 B14R1.42 COc1cc(cnc1F)SCC(C)O 62a_100011218427_100010214931 [0,2,0,0,0,0|2,0,0]=4 9756 B14R1.42 COc1cc(cnc1F)SC[C@@H](C)O 62a_100009817552_100010214931 [0,2,0,0,0,0|2,0,0]=4 9757 B14R1.42 COc1cc(cnc1F)SC[C@@H](C)O 62a_100010214931_100009817552 [0,2,0,0,0,0|2,0,0]=4 9758 B14R1.42 COc1cc(cnc1N)SCC(C)C 62a_100000210624_106354213024 [0,2,0,0,0,0|2,0,0]=4 9759 B14R1.42 COc1cc(cnc1N)SCC(C)C 62a_106354213024_100000210760 [0,2,0,0,0,0|2,0,0]=4 9760 B14R1.42 COc1cc(cnc1N)SCC(C)O 62a_100011218427_106354213024 [0,2,0,0,0,0|2,0,0]=4 9761 B14R1.42 COc1cc(cnc1N)SCC(C)O 62a_106354213024_100011218427 [0,2,0,0,0,0|2,0,0]=4 9762 B14R1.42 COc1cc(cnc1N)SC[C@@H](C)O 62a_100009817552_106354213024 [0,2,0,0,0,0|2,0,0]=4 9763 B14R1.42 COc1cc(cnc1N)SC[C@@H](C)O 62a_106354213024_100009817552 [0,2,0,0,0,0|2,0,0]=4 9764 B14R1.42 COc1cc(ncc1Br)COC(C)C 34a_100010999569_100000210206 [0,2,0,0,0,0|2,0,0]=4 9765 B14R1.42 COc1cc(ncc1C)SCC(C)C 62a_100000210624_100010067687 [0,2,0,0,0,0|2,0,0]=4 9766 B14R1.42 COc1cc(ncc1C)SCC(C)C 62a_100010067687_100000210760 [0,2,0,0,0,0|2,0,0]=4 9767 B14R1.42 COc1cc(ncc1C)SCC(C)O 62a_100010067687_100011218427 [0,2,0,0,0,0|2,0,0]=4 9768 B14R1.42 COc1cc(ncc1C)SCC(C)O 62a_100011218427_100010067687 [0,2,0,0,0,0|2,0,0]=4 9769 B14R1.42 COc1cc(ncc1C)SC[C@@H](C)O 62a_100009817552_100010067687 [0,2,0,0,0,0|2,0,0]=4 9770 B14R1.42 COc1cc(ncc1C)SC[C@@H](C)O 62a_100010067687_100009817552 [0,2,0,0,0,0|2,0,0]=4 9771 B14R1.42 COc1cc(ncc1F)SCC(C)C 62a_100000210624_200010136270 [0,2,0,0,0,0|2,0,0]=4 9772 B14R1.42 COc1cc(ncc1F)SCC(C)C 62a_200010136270_100000210760 [0,2,0,0,0,0|2,0,0]=4 9773 B14R1.42 COc1cc(ncc1F)SCC(C)O 62a_100011218427_200010136270 [0,2,0,0,0,0|2,0,0]=4 9774 B14R1.42 COc1cc(ncc1F)SCC(C)O 62a_200010136270_100011218427 [0,2,0,0,0,0|2,0,0]=4 9775 B14R1.42 COc1cc(ncc1F)SC[C@@H](C)O 62a_100009817552_200010136270 [0,2,0,0,0,0|2,0,0]=4 9776 B14R1.42 COc1cc(ncc1F)SC[C@@H](C)O 62a_200010136270_100009817552 [0,2,0,0,0,0|2,0,0]=4 9777 B14R1.42 COc1cc(ncc1N)SCC(C)C 62a_100000210624_100009887741 [0,2,0,0,0,0|2,0,0]=4 9778 B14R1.42 COc1cc(ncc1N)SCC(C)C 62a_100009887741_100000210760 [0,2,0,0,0,0|2,0,0]=4 9779 B14R1.42 COc1cc(ncc1N)SCC(C)O 62a_100009887741_100011218427 [0,2,0,0,0,0|2,0,0]=4 9780 B14R1.42 COc1cc(ncc1N)SCC(C)O 62a_100011218427_100009887741 [0,2,0,0,0,0|2,0,0]=4 9781 B14R1.42 COc1cc(ncc1N)SC[C@@H](C)O 62a_100009817552_100009887741 [0,2,0,0,0,0|2,0,0]=4 9782 B14R1.42 COc1cc(ncc1N)SC[C@@H](C)O 62a_100009887741_100009817552 [0,2,0,0,0,0|2,0,0]=4 9783 B14R1.42 COc1nc(ccc1Br)CNC(C)C 2230a_100138425928_200010066506 [0,2,0,0,0,0|2,0,0]=4 9784 B14R1.42 COc1nc(ccc1Br)CNC(C)C 34a_100138425928_200010066506 [0,2,0,0,0,0|2,0,0]=4 9785 B14R1.42 COc1nc(ccc1Br)COC(C)C 34a_100000212225_200010066506 [0,2,0,0,0,0|2,0,0]=4 9786 B14R1.42 COc1nc(ccc1Br)CSC(C)C 62a_100000210206_200010066506 [0,2,0,0,0,0|2,0,0]=4 9787 B14R1.42 COc1nc(ccc1Br)CSC(C)C 62a_200010066506_100000210206 [0,2,0,0,0,0|2,0,0]=4 9788 B14R1.42 COc1nc(ccc1N)SCC(C)C 62a_100000210624_100000687816 [0,2,0,0,0,0|2,0,0]=4 9789 B14R1.42 COc1nc(ccc1N)SCC(C)C 62a_100000687816_100000210760 [0,2,0,0,0,0|2,0,0]=4 9790 B14R1.42 COc1nc(ccc1N)SCC(C)O 62a_100000687816_100011218427 [0,2,0,0,0,0|2,0,0]=4 9791 B14R1.42 COc1nc(ccc1N)SCC(C)O 62a_100011218427_100000687816 [0,2,0,0,0,0|2,0,0]=4 9792 B14R1.42 COc1nc(ccc1N)SC[C@@H](C)O 62a_100000687816_100009817552 [0,2,0,0,0,0|2,0,0]=4 9793 B14R1.42 COc1nc(ccc1N)SC[C@@H](C)O 62a_100009817552_100000687816 [0,2,0,0,0,0|2,0,0]=4 9794 B14R1.42 COc1nc(ccc1O)C=CC(C)C 271570a_100016257149_100010893133 [0,2,0,0,0,0|1,0,1]=4 9795 B14R1.42 COc1nc(ccc1O)C=CC(C)O 271570a_200011019289_100010893133 [0,2,0,0,0,0|1,0,1]=4 9796 B14R1.42 COc1nc(ccc1O)SCC(C)C 62a_100000210624_100010893133 [0,2,0,0,0,0|1,0,0]=3 9797 B14R1.42 COc1nc(ccc1O)SCC(C)O 62a_100011218427_100010893133 [0,2,0,0,0,0|1,0,0]=3 9798 B14R1.42 COc1nc(ccc1O)SCC(F)F 62a_100011934356_100010893133 [0,2,0,0,0,0|2,0,0]=4 9799 B14R1.42 COc1nc(ccc1O)SC[C@@H](C)O 62a_100009817552_100010893133 [0,2,0,0,0,0|1,0,0]=3 9800 B14R1.42 COc1nc(cnc1O)SCC(C)C 62a_100000210624_200010365344 [0,2,0,0,0,0|2,0,0]=4 9801 B14R1.42 COc1nc(cnc1O)SCC(C)C 62a_200010365344_100000210760 [0,2,0,0,0,0|2,0,0]=4 9802 B14R1.42 COc1nc(cnc1O)SCC(C)O 62a_100011218427_200010365344 [0,2,0,0,0,0|2,0,0]=4 9803 B14R1.42 COc1nc(cnc1O)SCC(C)O 62a_200010365344_100011218427 [0,2,0,0,0,0|2,0,0]=4 9804 B14R1.42 COc1nc(cnc1O)SC[C@@H](C)O 62a_100009817552_200010365344 [0,2,0,0,0,0|2,0,0]=4 9805 B14R1.42 COc1nc(cnc1O)SC[C@@H](C)O 62a_200010365344_100009817552 [0,2,0,0,0,0|2,0,0]=4 9806 B14R1.42 CSc1cc(ccc1F)SCC(C)C 62a_100000210624_100010341305 [0,2,0,0,0,0|1,1,0]=4 9807 B14R1.42 CSc1cc(ccc1F)SCC(C)C 62a_100010341305_100000210760 [0,2,0,0,0,0|1,1,0]=4 9808 B14R1.42 CSc1cc(ccc1F)SCC(C)O 62a_100010341305_100011218427 [0,2,0,0,0,0|1,1,0]=4 9809 B14R1.42 CSc1cc(ccc1F)SCC(C)O 62a_100011218427_100010341305 [0,2,0,0,0,0|1,1,0]=4 9810 B14R1.42 CSc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100010341305 [0,2,0,0,0,0|1,1,0]=4 9811 B14R1.42 CSc1cc(ccc1F)SC[C@@H](C)O 62a_100010341305_100009817552 [0,2,0,0,0,0|1,1,0]=4 9812 B14R1.42 C[C@@H](O)CNc1ccc(c(c1)C#N)O 34a_100011249283_100009817552 [0,2,0,0,0,0|2,0,0]=4 9813 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)C#N)O 62a_100009817552_100000687585 [0,2,0,0,0,0|2,0,0]=4 9814 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)C=O)O 62a_100009817552_100000186750 [0,2,0,0,0,0|2,0,0]=4 9815 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CN)O 62a_100000730032_100009817552 [0,2,0,0,0,0|2,0,0]=4 9816 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CN)O 62a_100009817552_100000730032 [0,2,0,0,0,0|2,0,0]=4 9817 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CO)O 62a_100000184703_100009817552 [0,2,0,0,0,0|2,0,0]=4 9818 B14R1.42 C[C@@H](O)CSc1ccc(c(c1)CO)O 62a_100009817552_100000184703 [0,2,0,0,0,0|2,0,0]=4 9819 B14R1.907 C#CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000688953 [0,2,0,0,0,0|1,0,1]=4 9820 B14R1.907 C#CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000688953 [0,2,0,0,0,0|1,0,1]=4 9821 B14R1.907 C#CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000688953 [0,2,0,0,0,0|1,0,1]=4 9822 B14R1.907 C#CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000688953 [0,2,0,0,0,0|1,0,1]=4 9823 B14R1.907 C#CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000688953 [0,2,0,0,0,0|1,0,1]=4 9824 B14R1.907 C#CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000688953 [0,2,0,0,0,0|1,0,1]=4 9825 B14R1.907 C#CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000688953 [0,2,0,0,0,0|1,0,1]=4 9826 B14R1.907 C#CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000688953 [0,2,0,0,0,0|1,0,1]=4 9827 B14R1.907 C#CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000688953 [0,2,0,0,0,0|1,0,1]=4 9828 B14R1.907 C#CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000688953 [0,2,0,0,0,0|0,0,1]=3 9829 B14R1.907 C#CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000688953 [0,2,0,0,0,0|1,0,1]=4 9830 B14R1.907 C#CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000688953 [0,2,0,0,0,0|1,0,1]=4 9831 B14R1.907 C#CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000688953 [0,2,0,0,0,0|1,0,1]=4 9832 B14R1.907 C#CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000688953 [0,2,0,0,0,0|1,0,1]=4 9833 B14R1.907 C#CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000688953 [0,2,0,0,0,0|1,0,1]=4 9834 B14R1.907 C#CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000688953 [0,2,0,0,0,0|1,0,1]=4 9835 B14R1.907 C#CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000688953 [0,2,0,0,0,0|1,0,1]=4 9836 B14R1.907 C#CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000688953 [0,2,0,0,0,0|1,0,1]=4 9837 B14R1.907 C#CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000688953 [0,2,0,0,0,0|1,0,1]=4 9838 B14R1.907 C#CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000688953 [0,2,0,0,0,0|1,0,1]=4 9839 B14R1.907 C#CCCSc1ccc(c(c1)CC)O 62a_100000688953_100012338938 [0,2,0,0,0,0|1,0,1]=4 9840 B14R1.907 C#CCCSc1ccc(c(c1)OC)Br 62a_100000688953_100012353699 [0,2,0,0,0,0|1,0,1]=4 9841 B14R1.907 C#CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000688953 [0,2,0,0,0,0|1,0,1]=4 9842 B14R1.907 C#CCCSc1ccc(c(c1)OC)C 62a_100000688953_100011830276 [0,2,0,0,0,0|1,0,1]=4 9843 B14R1.907 C#CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000688953 [0,2,0,0,0,0|1,0,1]=4 9844 B14R1.907 C#CCCSc1ccc(c(c1)OC)Cl 62a_100000688953_100011356853 [0,2,0,0,0,0|1,0,1]=4 9845 B14R1.907 C#CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000688953 [0,2,0,0,0,0|1,0,1]=4 9846 B14R1.907 C#CCCSc1ccc(c(c1)OC)F 62a_100000688953_100011934186 [0,2,0,0,0,0|1,0,1]=4 9847 B14R1.907 C#CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000688953 [0,2,0,0,0,0|1,0,1]=4 9848 B14R1.907 C#CCCSc1ccc(c(c1)OC)N 62a_100000688953_100015196925 [0,2,0,0,0,0|1,0,1]=4 9849 B14R1.907 C#CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000688953 [0,2,0,0,0,0|1,0,1]=4 9850 B14R1.907 C#CCCSc1ccc(c(c1)OC)O 62a_100000688953_100000694246 [0,2,0,0,0,0|0,0,1]=3 9851 B14R1.907 C#CCCSc1ccc(c(n1)OC)O 62a_100000688953_100010893133 [0,2,0,0,0,0|1,0,1]=4 9852 B14R1.907 C#CCNCc1ccc(c(c1)OC)Br 34a_100000212058_100010110085 [0,2,0,0,0,0|1,0,1]=4 9853 B14R1.907 C#CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000038162 [0,2,0,0,0,0|1,0,1]=4 9854 B14R1.907 C#CCNCc1ccc(c(c1)OC)Cl 34a_100000212058_200010214485 [0,2,0,0,0,0|1,0,1]=4 9855 B14R1.907 C#CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000184674 [0,2,0,0,0,0|1,0,1]=4 9856 B14R1.907 C#CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000038162 [0,2,0,0,0,0|1,0,1]=4 9857 B14R1.907 C#CCNCc1ccc(c(c1)OC)F 34a_100000212058_100012349856 [0,2,0,0,0,0|1,0,1]=4 9858 B14R1.907 C#CCNCc1ccc(c(c1)OC)F 34a_100020626639_100000184674 [0,2,0,0,0,0|1,0,1]=4 9859 B14R1.907 C#CCNCc1ccc(c(c1)OC)O 34a_100000185554_100000184674 [0,2,0,0,0,0|0,0,1]=3 9860 B14R1.907 C#CCOCc1ccc(c(c1)OC)Br 34a_100000210247_100010110085 [0,2,0,0,0,0|1,0,1]=4 9861 B14R1.907 C#CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000184674 [0,2,0,0,0,0|1,0,1]=4 9862 B14R1.907 C#CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000038162 [0,2,0,0,0,0|1,0,1]=4 9863 B14R1.907 C#CCOCc1ccc(c(c1)OC)C 34a_100000752651_100000184674 [0,2,0,0,0,0|1,0,1]=4 9864 B14R1.907 C#CCOCc1ccc(c(c1)OC)C 7a_100000752651_100000038162 [0,2,0,0,0,0|1,0,1]=4 9865 B14R1.907 C#CCOCc1ccc(c(c1)OC)Cl 34a_100000210247_200010214485 [0,2,0,0,0,0|1,0,1]=4 9866 B14R1.907 C#CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000184674 [0,2,0,0,0,0|1,0,1]=4 9867 B14R1.907 C#CCOCc1ccc(c(c1)OC)F 34a_100000210247_100012349856 [0,2,0,0,0,0|1,0,1]=4 9868 B14R1.907 C#CCOCc1ccc(c(c1)OC)F 34a_100000692429_100000184674 [0,2,0,0,0,0|1,0,1]=4 9869 B14R1.907 C#CCOCc1ccc(c(c1)OC)F 7a_100000692429_100000038162 [0,2,0,0,0,0|1,0,1]=4 9870 B14R1.907 C#CCOCc1ccc(c(c1)OC)N 34a_100000087641_100000184674 [0,2,0,0,0,0|1,0,1]=4 9871 B14R1.907 C#CCSCc1ccc(c(c1)OC)Br 62a_100000038162_100010110085 [0,2,0,0,0,0|1,0,1]=4 9872 B14R1.907 C#CCSCc1ccc(c(c1)OC)Cl 62a_100000038162_200010214485 [0,2,0,0,0,0|1,0,1]=4 9873 B14R1.907 C#CCSCc1ccc(c(c1)OC)F 62a_100000038162_100012349856 [0,2,0,0,0,0|1,0,1]=4 9874 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)Br 34a_100000765947_100102629194 [0,2,0,0,0,0|1,0,1]=4 9875 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)C 34a_100011279678_100102629194 [0,2,0,0,0,0|1,0,1]=4 9876 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)Cl 34a_100000742311_100102629194 [0,2,0,0,0,0|1,0,1]=4 9877 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)F 34a_100000701188_100102629194 [0,2,0,0,0,0|1,0,1]=4 9878 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)I 34a_100000746945_100102629194 [0,2,0,0,0,0|1,0,1]=4 9879 B14R1.907 C/C=C/CNc1ccc(c(c1)OC)O 34a_100000726020_100102629194 [0,2,0,0,0,0|0,0,1]=3 9880 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Br 34a_100011827694_100102629194 [0,2,0,0,0,0|1,0,1]=4 9881 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Br 7a_100011827694_100102629194 [0,2,0,0,0,0|1,0,1]=4 9882 B14R1.907 C/C=C/COc1ccc(c(c1)OC)C 34a_100009865632_100102629194 [0,2,0,0,0,0|1,0,1]=4 9883 B14R1.907 C/C=C/COc1ccc(c(c1)OC)C 7a_100009865632_100102629194 [0,2,0,0,0,0|1,0,1]=4 9884 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Cl 34a_100012186310_100102629194 [0,2,0,0,0,0|1,0,1]=4 9885 B14R1.907 C/C=C/COc1ccc(c(c1)OC)Cl 7a_100012186310_100102629194 [0,2,0,0,0,0|1,0,1]=4 9886 B14R1.907 C/C=C/COc1ccc(c(c1)OC)F 34a_100012001760_100102629194 [0,2,0,0,0,0|1,0,1]=4 9887 B14R1.907 C/C=C/COc1ccc(c(c1)OC)F 7a_100012001760_100102629194 [0,2,0,0,0,0|1,0,1]=4 9888 B14R1.907 C/C=C/COc1ccc(c(c1)OC)N 34a_100015326901_100102629194 [0,2,0,0,0,0|1,0,1]=4 9889 B14R1.907 C/C=C/COc1ccc(c(c1)OC)N 7a_100015326901_100102629194 [0,2,0,0,0,0|1,0,1]=4 9890 B14R1.907 C/C=C/CSc1ccc(c(c1)CC)O 62a_100102629194_100012338938 [0,2,0,0,0,0|1,0,1]=4 9891 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Br 62a_100012353699_100102629194 [0,2,0,0,0,0|1,0,1]=4 9892 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Br 62a_100102629194_100012353699 [0,2,0,0,0,0|1,0,1]=4 9893 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)C 62a_100011830276_100102629194 [0,2,0,0,0,0|1,0,1]=4 9894 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)C 62a_100102629194_100011830276 [0,2,0,0,0,0|1,0,1]=4 9895 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Cl 62a_100011356853_100102629194 [0,2,0,0,0,0|1,0,1]=4 9896 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)Cl 62a_100102629194_100011356853 [0,2,0,0,0,0|1,0,1]=4 9897 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)F 62a_100011934186_100102629194 [0,2,0,0,0,0|1,0,1]=4 9898 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)F 62a_100102629194_100011934186 [0,2,0,0,0,0|1,0,1]=4 9899 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)N 62a_100011279103_100102629194 [0,2,0,0,0,0|1,0,1]=4 9900 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)N 62a_100102629194_100015196925 [0,2,0,0,0,0|1,0,1]=4 9901 B14R1.907 C/C=C/CSc1ccc(c(c1)OC)O 62a_100102629194_100000694246 [0,2,0,0,0,0|0,0,1]=3 9902 B14R1.907 C/C=C/CSc1ccc(c(n1)OC)O 62a_100102629194_100010893133 [0,2,0,0,0,0|1,0,1]=4 9903 B14R1.907 C=CCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000754431 [0,2,0,0,0,0|1,0,1]=4 9904 B14R1.907 C=CCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000754431 [0,2,0,0,0,0|1,0,1]=4 9905 B14R1.907 C=CCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000754431 [0,2,0,0,0,0|1,0,1]=4 9906 B14R1.907 C=CCCNc1ccc(c(c1)OC)C 34a_100011279678_100000754431 [0,2,0,0,0,0|1,0,1]=4 9907 B14R1.907 C=CCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000754431 [0,2,0,0,0,0|1,0,1]=4 9908 B14R1.907 C=CCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000754431 [0,2,0,0,0,0|1,0,1]=4 9909 B14R1.907 C=CCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000754431 [0,2,0,0,0,0|1,0,1]=4 9910 B14R1.907 C=CCCNc1ccc(c(c1)OC)F 34a_100000701188_100000754431 [0,2,0,0,0,0|1,0,1]=4 9911 B14R1.907 C=CCCNc1ccc(c(c1)OC)I 34a_100000746945_100000754431 [0,2,0,0,0,0|1,0,1]=4 9912 B14R1.907 C=CCCNc1ccc(c(c1)OC)O 34a_100000726020_100000754431 [0,2,0,0,0,0|0,0,1]=3 9913 B14R1.907 C=CCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000754431 [0,2,0,0,0,0|1,0,1]=4 9914 B14R1.907 C=CCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000754431 [0,2,0,0,0,0|1,0,1]=4 9915 B14R1.907 C=CCCOc1ccc(c(c1)OC)C 34a_100009865632_100000754431 [0,2,0,0,0,0|1,0,1]=4 9916 B14R1.907 C=CCCOc1ccc(c(c1)OC)C 7a_100009865632_100000754431 [0,2,0,0,0,0|1,0,1]=4 9917 B14R1.907 C=CCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000754431 [0,2,0,0,0,0|1,0,1]=4 9918 B14R1.907 C=CCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000754431 [0,2,0,0,0,0|1,0,1]=4 9919 B14R1.907 C=CCCOc1ccc(c(c1)OC)F 34a_100012001760_100000754431 [0,2,0,0,0,0|1,0,1]=4 9920 B14R1.907 C=CCCOc1ccc(c(c1)OC)F 7a_100012001760_100000754431 [0,2,0,0,0,0|1,0,1]=4 9921 B14R1.907 C=CCCOc1ccc(c(c1)OC)N 34a_100015326901_100000754431 [0,2,0,0,0,0|1,0,1]=4 9922 B14R1.907 C=CCCOc1ccc(c(c1)OC)N 7a_100015326901_100000754431 [0,2,0,0,0,0|1,0,1]=4 9923 B14R1.907 C=CCCSc1ccc(c(c1)CC)O 62a_100000754431_100012338938 [0,2,0,0,0,0|1,0,1]=4 9924 B14R1.907 C=CCCSc1ccc(c(c1)OC)Br 62a_100000754431_100012353699 [0,2,0,0,0,0|1,0,1]=4 9925 B14R1.907 C=CCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000754431 [0,2,0,0,0,0|1,0,1]=4 9926 B14R1.907 C=CCCSc1ccc(c(c1)OC)C 62a_100000754431_100011830276 [0,2,0,0,0,0|1,0,1]=4 9927 B14R1.907 C=CCCSc1ccc(c(c1)OC)C 62a_100011830276_100000754431 [0,2,0,0,0,0|1,0,1]=4 9928 B14R1.907 C=CCCSc1ccc(c(c1)OC)Cl 62a_100000754431_100011356853 [0,2,0,0,0,0|1,0,1]=4 9929 B14R1.907 C=CCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000754431 [0,2,0,0,0,0|1,0,1]=4 9930 B14R1.907 C=CCCSc1ccc(c(c1)OC)F 62a_100000754431_100011934186 [0,2,0,0,0,0|1,0,1]=4 9931 B14R1.907 C=CCCSc1ccc(c(c1)OC)F 62a_100011934186_100000754431 [0,2,0,0,0,0|1,0,1]=4 9932 B14R1.907 C=CCCSc1ccc(c(c1)OC)N 62a_100000754431_100015196925 [0,2,0,0,0,0|1,0,1]=4 9933 B14R1.907 C=CCCSc1ccc(c(c1)OC)N 62a_100011279103_100000754431 [0,2,0,0,0,0|1,0,1]=4 9934 B14R1.907 C=CCCSc1ccc(c(c1)OC)O 62a_100000754431_100000694246 [0,2,0,0,0,0|0,0,1]=3 9935 B14R1.907 C=CCCSc1ccc(c(n1)OC)O 62a_100000754431_100010893133 [0,2,0,0,0,0|1,0,1]=4 9936 B14R1.907 C=CCNCc1ccc(c(c1)OC)Br 2230a_100020586998_100010110085 [0,2,0,0,0,0|1,0,1]=4 9937 B14R1.907 C=CCNCc1ccc(c(c1)OC)Br 270004a_100020586998_100010244714 [0,2,0,0,0,0|1,0,1]=4 9938 B14R1.907 C=CCNCc1ccc(c(c1)OC)C 270004a_100020586998_100000719150 [0,2,0,0,0,0|1,0,1]=4 9939 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210623 [0,2,0,0,0,0|1,0,1]=4 9940 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 2230a_100020586998_200010214485 [0,2,0,0,0,0|1,0,1]=4 9941 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 270004a_100020586998_100011998524 [0,2,0,0,0,0|1,0,1]=4 9942 B14R1.907 C=CCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100015514636 [0,2,0,0,0,0|1,0,1]=4 9943 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 2230a_100020586998_100012349856 [0,2,0,0,0,0|1,0,1]=4 9944 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210623 [0,2,0,0,0,0|1,0,1]=4 9945 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 270004a_100020586998_100000692873 [0,2,0,0,0,0|1,0,1]=4 9946 B14R1.907 C=CCNCc1ccc(c(c1)OC)F 34a_100020626639_100015514636 [0,2,0,0,0,0|1,0,1]=4 9947 B14R1.907 C=CCNCc1ccc(c(c1)OC)O 34a_100000185554_100015514636 [0,2,0,0,0,0|0,0,1]=3 9948 B14R1.907 C=CCOCc1ccc(c(c1)OC)Br 34a_100010234685_100015514636 [0,2,0,0,0,0|1,0,1]=4 9949 B14R1.907 C=CCOCc1ccc(c(c1)OC)Br 34a_200000210373_100010110085 [0,2,0,0,0,0|1,0,1]=4 9950 B14R1.907 C=CCOCc1ccc(c(c1)OC)Br 7a_100010234685_100015514636 [0,2,0,0,0,0|1,0,1]=4 9951 B14R1.907 C=CCOCc1ccc(c(c1)OC)C 34a_100000752651_100015514636 [0,2,0,0,0,0|1,0,1]=4 9952 B14R1.907 C=CCOCc1ccc(c(c1)OC)C 7a_100000752651_100015514636 [0,2,0,0,0,0|1,0,1]=4 9953 B14R1.907 C=CCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100015514636 [0,2,0,0,0,0|1,0,1]=4 9954 B14R1.907 C=CCOCc1ccc(c(c1)OC)Cl 34a_200000210373_200010214485 [0,2,0,0,0,0|1,0,1]=4 9955 B14R1.907 C=CCOCc1ccc(c(c1)OC)F 34a_100000692429_100015514636 [0,2,0,0,0,0|1,0,1]=4 9956 B14R1.907 C=CCOCc1ccc(c(c1)OC)F 34a_200000210373_100012349856 [0,2,0,0,0,0|1,0,1]=4 9957 B14R1.907 C=CCOCc1ccc(c(c1)OC)F 7a_100000692429_100015514636 [0,2,0,0,0,0|1,0,1]=4 9958 B14R1.907 C=CCOCc1ccc(c(c1)OC)N 34a_100000087641_100015514636 [0,2,0,0,0,0|1,0,1]=4 9959 B14R1.907 C=CCSCc1ccc(c(c1)OC)Br 62a_100000210623_100010110085 [0,2,0,0,0,0|1,0,1]=4 9960 B14R1.907 C=CCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210623 [0,2,0,0,0,0|1,0,1]=4 9961 B14R1.907 C=CCSCc1ccc(c(c1)OC)Cl 62a_100000210623_200010214485 [0,2,0,0,0,0|1,0,1]=4 9962 B14R1.907 C=CCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210623 [0,2,0,0,0,0|1,0,1]=4 9963 B14R1.907 C=CCSCc1ccc(c(c1)OC)F 62a_100000210623_100012349856 [0,2,0,0,0,0|1,0,1]=4 9964 B14R1.907 C=CCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210623 [0,2,0,0,0,0|1,0,1]=4 9965 B14R1.907 CC#CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000748600 [0,2,0,0,0,0|1,0,1]=4 9966 B14R1.907 CC#CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000748600 [0,2,0,0,0,0|1,0,1]=4 9967 B14R1.907 CC#CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000748600 [0,2,0,0,0,0|1,0,1]=4 9968 B14R1.907 CC#CCNc1ccc(c(c1)OC)C 34a_100011279678_100000748600 [0,2,0,0,0,0|1,0,1]=4 9969 B14R1.907 CC#CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000748600 [0,2,0,0,0,0|1,0,1]=4 9970 B14R1.907 CC#CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000748600 [0,2,0,0,0,0|1,0,1]=4 9971 B14R1.907 CC#CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000748600 [0,2,0,0,0,0|1,0,1]=4 9972 B14R1.907 CC#CCNc1ccc(c(c1)OC)F 34a_100000701188_100000748600 [0,2,0,0,0,0|1,0,1]=4 9973 B14R1.907 CC#CCNc1ccc(c(c1)OC)I 34a_100000746945_100000748600 [0,2,0,0,0,0|1,0,1]=4 9974 B14R1.907 CC#CCNc1ccc(c(c1)OC)O 34a_100000726020_100000748600 [0,2,0,0,0,0|0,0,1]=3 9975 B14R1.907 CC#CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000748600 [0,2,0,0,0,0|1,0,1]=4 9976 B14R1.907 CC#CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000748600 [0,2,0,0,0,0|1,0,1]=4 9977 B14R1.907 CC#CCOc1ccc(c(c1)OC)C 34a_100009865632_100000748600 [0,2,0,0,0,0|1,0,1]=4 9978 B14R1.907 CC#CCOc1ccc(c(c1)OC)C 7a_100009865632_100000748600 [0,2,0,0,0,0|1,0,1]=4 9979 B14R1.907 CC#CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000748600 [0,2,0,0,0,0|1,0,1]=4 9980 B14R1.907 CC#CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000748600 [0,2,0,0,0,0|1,0,1]=4 9981 B14R1.907 CC#CCOc1ccc(c(c1)OC)F 34a_100012001760_100000748600 [0,2,0,0,0,0|1,0,1]=4 9982 B14R1.907 CC#CCOc1ccc(c(c1)OC)F 7a_100012001760_100000748600 [0,2,0,0,0,0|1,0,1]=4 9983 B14R1.907 CC#CCOc1ccc(c(c1)OC)N 34a_100015326901_100000748600 [0,2,0,0,0,0|1,0,1]=4 9984 B14R1.907 CC#CCOc1ccc(c(c1)OC)N 7a_100015326901_100000748600 [0,2,0,0,0,0|1,0,1]=4 9985 B14R1.907 CC#CCSc1ccc(c(c1)CC)O 62a_100000748600_100012338938 [0,2,0,0,0,0|1,0,1]=4 9986 B14R1.907 CC#CCSc1ccc(c(c1)OC)Br 62a_100000748600_100012353699 [0,2,0,0,0,0|1,0,1]=4 9987 B14R1.907 CC#CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000748600 [0,2,0,0,0,0|1,0,1]=4 9988 B14R1.907 CC#CCSc1ccc(c(c1)OC)C 62a_100000748600_100011830276 [0,2,0,0,0,0|1,0,1]=4 9989 B14R1.907 CC#CCSc1ccc(c(c1)OC)C 62a_100011830276_100000748600 [0,2,0,0,0,0|1,0,1]=4 9990 B14R1.907 CC#CCSc1ccc(c(c1)OC)Cl 62a_100000748600_100011356853 [0,2,0,0,0,0|1,0,1]=4 9991 B14R1.907 CC#CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000748600 [0,2,0,0,0,0|1,0,1]=4 9992 B14R1.907 CC#CCSc1ccc(c(c1)OC)F 62a_100000748600_100011934186 [0,2,0,0,0,0|1,0,1]=4 9993 B14R1.907 CC#CCSc1ccc(c(c1)OC)F 62a_100011934186_100000748600 [0,2,0,0,0,0|1,0,1]=4 9994 B14R1.907 CC#CCSc1ccc(c(c1)OC)N 62a_100000748600_100015196925 [0,2,0,0,0,0|1,0,1]=4 9995 B14R1.907 CC#CCSc1ccc(c(c1)OC)N 62a_100011279103_100000748600 [0,2,0,0,0,0|1,0,1]=4 9996 B14R1.907 CC#CCSc1ccc(c(c1)OC)O 62a_100000748600_100000694246 [0,2,0,0,0,0|0,0,1]=3 9997 B14R1.907 CC#CCSc1ccc(c(n1)OC)O 62a_100000748600_100010893133 [0,2,0,0,0,0|1,0,1]=4 9998 B14R1.907 CC=CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000070051 [0,2,0,0,0,0|1,0,1]=4 9999 B14R1.907 CC=CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000070051 [0,2,0,0,0,0|1,0,1]=4 10000 B14R1.907 CC=CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000070051 [0,2,0,0,0,0|1,0,1]=4 10001 B14R1.907 CC=CCNc1ccc(c(c1)OC)C 34a_100011279678_100000070051 [0,2,0,0,0,0|1,0,1]=4 10002 B14R1.907 CC=CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000070051 [0,2,0,0,0,0|1,0,1]=4 10003 B14R1.907 CC=CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000070051 [0,2,0,0,0,0|1,0,1]=4 10004 B14R1.907 CC=CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000070051 [0,2,0,0,0,0|1,0,1]=4 10005 B14R1.907 CC=CCNc1ccc(c(c1)OC)F 34a_100000701188_100000070051 [0,2,0,0,0,0|1,0,1]=4 10006 B14R1.907 CC=CCNc1ccc(c(c1)OC)I 34a_100000746945_100000070051 [0,2,0,0,0,0|1,0,1]=4 10007 B14R1.907 CC=CCNc1ccc(c(c1)OC)O 34a_100000726020_100000070051 [0,2,0,0,0,0|0,0,1]=3 10008 B14R1.907 CC=CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000070051 [0,2,0,0,0,0|1,0,1]=4 10009 B14R1.907 CC=CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000070051 [0,2,0,0,0,0|1,0,1]=4 10010 B14R1.907 CC=CCOc1ccc(c(c1)OC)C 34a_100009865632_100000070051 [0,2,0,0,0,0|1,0,1]=4 10011 B14R1.907 CC=CCOc1ccc(c(c1)OC)C 7a_100009865632_100000070051 [0,2,0,0,0,0|1,0,1]=4 10012 B14R1.907 CC=CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000070051 [0,2,0,0,0,0|1,0,1]=4 10013 B14R1.907 CC=CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000070051 [0,2,0,0,0,0|1,0,1]=4 10014 B14R1.907 CC=CCOc1ccc(c(c1)OC)F 34a_100012001760_100000070051 [0,2,0,0,0,0|1,0,1]=4 10015 B14R1.907 CC=CCOc1ccc(c(c1)OC)F 7a_100012001760_100000070051 [0,2,0,0,0,0|1,0,1]=4 10016 B14R1.907 CC=CCOc1ccc(c(c1)OC)N 34a_100015326901_100000070051 [0,2,0,0,0,0|1,0,1]=4 10017 B14R1.907 CC=CCOc1ccc(c(c1)OC)N 7a_100015326901_100000070051 [0,2,0,0,0,0|1,0,1]=4 10018 B14R1.907 CC=CCSc1ccc(c(c1)CC)O 62a_100000070051_100012338938 [0,2,0,0,0,0|1,0,1]=4 10019 B14R1.907 CC=CCSc1ccc(c(c1)OC)Br 62a_100000070051_100012353699 [0,2,0,0,0,0|1,0,1]=4 10020 B14R1.907 CC=CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000070051 [0,2,0,0,0,0|1,0,1]=4 10021 B14R1.907 CC=CCSc1ccc(c(c1)OC)C 62a_100000070051_100011830276 [0,2,0,0,0,0|1,0,1]=4 10022 B14R1.907 CC=CCSc1ccc(c(c1)OC)C 62a_100011830276_100000070051 [0,2,0,0,0,0|1,0,1]=4 10023 B14R1.907 CC=CCSc1ccc(c(c1)OC)Cl 62a_100000070051_100011356853 [0,2,0,0,0,0|1,0,1]=4 10024 B14R1.907 CC=CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000070051 [0,2,0,0,0,0|1,0,1]=4 10025 B14R1.907 CC=CCSc1ccc(c(c1)OC)F 62a_100000070051_100011934186 [0,2,0,0,0,0|1,0,1]=4 10026 B14R1.907 CC=CCSc1ccc(c(c1)OC)F 62a_100011934186_100000070051 [0,2,0,0,0,0|1,0,1]=4 10027 B14R1.907 CC=CCSc1ccc(c(c1)OC)N 62a_100000070051_100015196925 [0,2,0,0,0,0|1,0,1]=4 10028 B14R1.907 CC=CCSc1ccc(c(c1)OC)N 62a_100011279103_100000070051 [0,2,0,0,0,0|1,0,1]=4 10029 B14R1.907 CC=CCSc1ccc(c(c1)OC)O 62a_100000070051_100000694246 [0,2,0,0,0,0|0,0,1]=3 10030 B14R1.907 CC=CCSc1ccc(c(n1)OC)O 62a_100000070051_100010893133 [0,2,0,0,0,0|1,0,1]=4 10031 B14R1.907 CCC=NNc1ccc(c(c1)OC)F 4a_102515433066_100000210100 [0,2,0,0,0,0|1,0,1]=4 10032 B14R1.907 CCCC=Cc1c[nH]c(=O)c(c1)OC 271570a_100016258520_100010125397 [0,2,0,0,0,0|1,0,1]=4 10033 B14R1.907 CCCC=Cc1cc(c(cn1)C)OC 271570a_100016258520_100010067687 [0,2,0,0,0,0|2,0,0]=4 10034 B14R1.907 CCCC=Cc1cc(c(cn1)F)OC 271570a_100016258520_200010136270 [0,2,0,0,0,0|2,0,0]=4 10035 B14R1.907 CCCC=Cc1cc(c(cn1)N)OC 271570a_100016258520_100009887741 [0,2,0,0,0,0|2,0,0]=4 10036 B14R1.907 CCCC=Cc1ccc(c(c1)C#N)O 271570a_100016258520_100000687585 [0,2,0,0,0,0|2,0,0]=4 10037 B14R1.907 CCCC=Cc1ccc(c(c1)C=O)O 271570a_100016258520_100000186750 [0,2,0,0,0,0|2,0,0]=4 10038 B14R1.907 CCCC=Cc1ccc(c(c1)CC)Br 271570a_100016258520_100010244631 [0,2,0,0,0,0|2,0,0]=4 10039 B14R1.907 CCCC=Cc1ccc(c(c1)CC)F 271570a_100016258520_100010244625 [0,2,0,0,0,0|2,0,0]=4 10040 B14R1.907 CCCC=Cc1ccc(c(c1)CC)N 271570a_100016258520_100000686106 [0,2,0,0,0,0|2,0,0]=4 10041 B14R1.907 CCCC=Cc1ccc(c(c1)CC)O 271570a_100016258520_100012338938 [0,2,0,0,0,0|1,0,0]=3 10042 B14R1.907 CCCC=Cc1ccc(c(c1)CN)O 271570a_100016258520_100000730032 [0,2,0,0,0,0|2,0,0]=4 10043 B14R1.907 CCCC=Cc1ccc(c(c1)CO)O 271570a_100016258520_100000184703 [0,2,0,0,0,0|2,0,0]=4 10044 B14R1.907 CCCC=Cc1ccc(c(c1)NC)C 271570a_100016258520_100020629602 [0,2,0,0,0,0|2,0,0]=4 10045 B14R1.907 CCCC=Cc1ccc(c(c1)NC)F 271570a_100016258520_100011314990 [0,2,0,0,0,0|2,0,0]=4 10046 B14R1.907 CCCC=Cc1ccc(c(c1)NC)N 271570a_100016258520_100000694363 [0,2,0,0,0,0|2,0,0]=4 10047 B14R1.907 CCCC=Cc1ccc(c(c1)OC)Br 271570a_100016258520_100012353699 [0,2,0,0,0,0|1,0,0]=3 10048 B14R1.907 CCCC=Cc1ccc(c(c1)OC)C 271570a_100016258520_100011830276 [0,2,0,0,0,0|1,0,0]=3 10049 B14R1.907 CCCC=Cc1ccc(c(c1)OC)Cl 271570a_100016258520_100011356853 [0,2,0,0,0,0|1,0,0]=3 10050 B14R1.907 CCCC=Cc1ccc(c(c1)OC)F 271570a_100016258520_100011934186 [0,2,0,0,0,0|1,0,0]=3 10051 B14R1.907 CCCC=Cc1ccc(c(c1)OC)N 271570a_100016258520_100011279103 [0,2,0,0,0,0|1,0,0]=3 10052 B14R1.907 CCCC=Cc1ccc(c(c1)OC)O 271570a_100016258520_100000694246 [0,2,0,0,0,0|0,0,0]=2 10053 B14R1.907 CCCC=Cc1ccc(c(c1)SC)F 271570a_100016258520_100010341305 [0,2,0,0,0,0|1,1,0]=4 10054 B14R1.907 CCCC=Cc1ccc(c(n1)OC)N 271570a_100016258520_100000687816 [0,2,0,0,0,0|2,0,0]=4 10055 B14R1.907 CCCC=Cc1ccc(c(n1)OC)O 271570a_100016258520_100010893133 [0,2,0,0,0,0|1,0,0]=3 10056 B14R1.907 CCCC=Cc1cnc(c(c1)OC)C 271570a_100016258520_100010254219 [0,2,0,0,0,0|2,0,0]=4 10057 B14R1.907 CCCC=Cc1cnc(c(c1)OC)F 271570a_100016258520_100010214931 [0,2,0,0,0,0|2,0,0]=4 10058 B14R1.907 CCCC=Cc1cnc(c(c1)OC)N 271570a_100016258520_106354213024 [0,2,0,0,0,0|2,0,0]=4 10059 B14R1.907 CCCC=Cc1cnc(c(n1)OC)O 271570a_100016258520_200010365344 [0,2,0,0,0,0|2,0,0]=4 10060 B14R1.907 CCCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000210210 [0,2,0,0,0,0|2,0,0]=4 10061 B14R1.907 CCCCNc1ccc(c(c1)CC)Br 2230a_100010109747_100000210211 [0,2,0,0,0,0|2,0,0]=4 10062 B14R1.907 CCCCNc1ccc(c(c1)CC)Br 34a_100010109747_100000210210 [0,2,0,0,0,0|2,0,0]=4 10063 B14R1.907 CCCCNc1ccc(c(c1)CC)Br 7a_100010109747_100000210211 [0,2,0,0,0,0|2,0,0]=4 10064 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210211 [0,2,0,0,0,0|1,0,0]=3 10065 B14R1.907 CCCCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210210 [0,2,0,0,0,0|1,0,0]=3 10066 B14R1.907 CCCCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210211 [0,2,0,0,0,0|1,0,0]=3 10067 B14R1.907 CCCCNc1ccc(c(c1)OC)C 34a_100011279678_100000210210 [0,2,0,0,0,0|1,0,0]=3 10068 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210211 [0,2,0,0,0,0|1,0,0]=3 10069 B14R1.907 CCCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210210 [0,2,0,0,0,0|1,0,0]=3 10070 B14R1.907 CCCCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210211 [0,2,0,0,0,0|1,0,0]=3 10071 B14R1.907 CCCCNc1ccc(c(c1)OC)F 34a_100000701188_100000210210 [0,2,0,0,0,0|1,0,0]=3 10072 B14R1.907 CCCCNc1ccc(c(c1)OC)I 34a_100000746945_100000210210 [0,2,0,0,0,0|1,0,0]=3 10073 B14R1.907 CCCCNc1ccc(c(c1)OC)O 34a_100000726020_100000210210 [0,2,0,0,0,0|0,0,0]=2 10074 B14R1.907 CCCCOc1ccc(c(c1)CC)Cl 34a_100000212063_100000210210 [0,2,0,0,0,0|2,0,0]=4 10075 B14R1.907 CCCCOc1ccc(c(c1)CC)Cl 7a_100000212063_100000210211 [0,2,0,0,0,0|2,0,0]=4 10076 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210210 [0,2,0,0,0,0|1,0,0]=3 10077 B14R1.907 CCCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210211 [0,2,0,0,0,0|1,0,0]=3 10078 B14R1.907 CCCCOc1ccc(c(c1)OC)C 34a_100009865632_100000210210 [0,2,0,0,0,0|1,0,0]=3 10079 B14R1.907 CCCCOc1ccc(c(c1)OC)C 7a_100009865632_100000210211 [0,2,0,0,0,0|1,0,0]=3 10080 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210210 [0,2,0,0,0,0|1,0,0]=3 10081 B14R1.907 CCCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210211 [0,2,0,0,0,0|1,0,0]=3 10082 B14R1.907 CCCCOc1ccc(c(c1)OC)F 34a_100012001760_100000210210 [0,2,0,0,0,0|1,0,0]=3 10083 B14R1.907 CCCCOc1ccc(c(c1)OC)F 7a_100012001760_100000210211 [0,2,0,0,0,0|1,0,0]=3 10084 B14R1.907 CCCCOc1ccc(c(c1)OC)N 34a_100015326901_100000210210 [0,2,0,0,0,0|1,0,0]=3 10085 B14R1.907 CCCCOc1ccc(c(c1)OC)N 7a_100015326901_100000210211 [0,2,0,0,0,0|1,0,0]=3 10086 B14R1.907 CCCCSc1c[nH]c(=O)c(c1)OC 62a_100000210211_100010125397 [0,2,0,0,0,0|1,0,1]=4 10087 B14R1.907 CCCCSc1cc(c(cn1)C)OC 62a_100000210211_100010067687 [0,2,0,0,0,0|2,0,0]=4 10088 B14R1.907 CCCCSc1cc(c(cn1)C)OC 62a_100010067687_100000210210 [0,2,0,0,0,0|2,0,0]=4 10089 B14R1.907 CCCCSc1cc(c(cn1)F)OC 62a_100000210211_200010136270 [0,2,0,0,0,0|2,0,0]=4 10090 B14R1.907 CCCCSc1cc(c(cn1)F)OC 62a_200010136270_100000210210 [0,2,0,0,0,0|2,0,0]=4 10091 B14R1.907 CCCCSc1cc(c(cn1)N)OC 62a_100000210211_100009887741 [0,2,0,0,0,0|2,0,0]=4 10092 B14R1.907 CCCCSc1cc(c(cn1)N)OC 62a_100009887741_100000210210 [0,2,0,0,0,0|2,0,0]=4 10093 B14R1.907 CCCCSc1ccc(c(c1)C#N)O 62a_100000210211_100000687585 [0,2,0,0,0,0|2,0,0]=4 10094 B14R1.907 CCCCSc1ccc(c(c1)C=O)O 62a_100000210211_100000186750 [0,2,0,0,0,0|2,0,0]=4 10095 B14R1.907 CCCCSc1ccc(c(c1)CC)Br 62a_100000210211_100010244631 [0,2,0,0,0,0|2,0,0]=4 10096 B14R1.907 CCCCSc1ccc(c(c1)CC)Br 62a_100010244631_100000210210 [0,2,0,0,0,0|2,0,0]=4 10097 B14R1.907 CCCCSc1ccc(c(c1)CC)F 62a_100000210211_100010244625 [0,2,0,0,0,0|2,0,0]=4 10098 B14R1.907 CCCCSc1ccc(c(c1)CC)F 62a_100010244625_100000210210 [0,2,0,0,0,0|2,0,0]=4 10099 B14R1.907 CCCCSc1ccc(c(c1)CC)N 62a_100000210211_100000686106 [0,2,0,0,0,0|2,0,0]=4 10100 B14R1.907 CCCCSc1ccc(c(c1)CC)N 62a_100000686106_100000210210 [0,2,0,0,0,0|2,0,0]=4 10101 B14R1.907 CCCCSc1ccc(c(c1)CC)O 62a_100000210211_100012338938 [0,2,0,0,0,0|1,0,0]=3 10102 B14R1.907 CCCCSc1ccc(c(c1)CN)O 62a_100000210211_100000730032 [0,2,0,0,0,0|2,0,0]=4 10103 B14R1.907 CCCCSc1ccc(c(c1)CN)O 62a_100000730032_100000210210 [0,2,0,0,0,0|2,0,0]=4 10104 B14R1.907 CCCCSc1ccc(c(c1)CO)O 62a_100000184703_100000210210 [0,2,0,0,0,0|2,0,0]=4 10105 B14R1.907 CCCCSc1ccc(c(c1)CO)O 62a_100000210211_100000184703 [0,2,0,0,0,0|2,0,0]=4 10106 B14R1.907 CCCCSc1ccc(c(c1)NC)C 62a_100000210211_100020629602 [0,2,0,0,0,0|2,0,0]=4 10107 B14R1.907 CCCCSc1ccc(c(c1)NC)C 62a_100020629602_100000210210 [0,2,0,0,0,0|2,0,0]=4 10108 B14R1.907 CCCCSc1ccc(c(c1)NC)F 62a_100000210211_100011314990 [0,2,0,0,0,0|2,0,0]=4 10109 B14R1.907 CCCCSc1ccc(c(c1)NC)F 62a_100011314990_100000210210 [0,2,0,0,0,0|2,0,0]=4 10110 B14R1.907 CCCCSc1ccc(c(c1)NC)N 62a_100000694363_100000210210 [0,2,0,0,0,0|2,0,0]=4 10111 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100000210211_100012353699 [0,2,0,0,0,0|1,0,0]=3 10112 B14R1.907 CCCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210210 [0,2,0,0,0,0|1,0,0]=3 10113 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100000210211_100011830276 [0,2,0,0,0,0|1,0,0]=3 10114 B14R1.907 CCCCSc1ccc(c(c1)OC)C 62a_100011830276_100000210210 [0,2,0,0,0,0|1,0,0]=3 10115 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100000210211_100011356853 [0,2,0,0,0,0|1,0,0]=3 10116 B14R1.907 CCCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210210 [0,2,0,0,0,0|1,0,0]=3 10117 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100000210211_100011934186 [0,2,0,0,0,0|1,0,0]=3 10118 B14R1.907 CCCCSc1ccc(c(c1)OC)F 62a_100011934186_100000210210 [0,2,0,0,0,0|1,0,0]=3 10119 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100000210211_100015196925 [0,2,0,0,0,0|1,0,0]=3 10120 B14R1.907 CCCCSc1ccc(c(c1)OC)N 62a_100011279103_100000210210 [0,2,0,0,0,0|1,0,0]=3 10121 B14R1.907 CCCCSc1ccc(c(c1)OC)O 62a_100000210211_100000694246 [0,2,0,0,0,0|0,0,0]=2 10122 B14R1.907 CCCCSc1ccc(c(c1)SC)F 62a_100000210211_100010341305 [0,2,0,0,0,0|1,1,0]=4 10123 B14R1.907 CCCCSc1ccc(c(c1)SC)F 62a_100010341305_100000210210 [0,2,0,0,0,0|1,1,0]=4 10124 B14R1.907 CCCCSc1ccc(c(n1)OC)N 62a_100000210211_100000687816 [0,2,0,0,0,0|2,0,0]=4 10125 B14R1.907 CCCCSc1ccc(c(n1)OC)N 62a_100000687816_100000210210 [0,2,0,0,0,0|2,0,0]=4 10126 B14R1.907 CCCCSc1ccc(c(n1)OC)O 62a_100000210211_100010893133 [0,2,0,0,0,0|1,0,0]=3 10127 B14R1.907 CCCCSc1cnc(c(c1)OC)C 62a_100000210211_100010254219 [0,2,0,0,0,0|2,0,0]=4 10128 B14R1.907 CCCCSc1cnc(c(c1)OC)C 62a_100010254219_100000210210 [0,2,0,0,0,0|2,0,0]=4 10129 B14R1.907 CCCCSc1cnc(c(c1)OC)F 62a_100000210211_100010214931 [0,2,0,0,0,0|2,0,0]=4 10130 B14R1.907 CCCCSc1cnc(c(c1)OC)F 62a_100010214931_100000210210 [0,2,0,0,0,0|2,0,0]=4 10131 B14R1.907 CCCCSc1cnc(c(c1)OC)N 62a_100000210211_106354213024 [0,2,0,0,0,0|2,0,0]=4 10132 B14R1.907 CCCCSc1cnc(c(c1)OC)N 62a_106354213024_100000210210 [0,2,0,0,0,0|2,0,0]=4 10133 B14R1.907 CCCCSc1cnc(c(n1)OC)O 62a_100000210211_200010365344 [0,2,0,0,0,0|2,0,0]=4 10134 B14R1.907 CCCCSc1cnc(c(n1)OC)O 62a_200010365344_100000210210 [0,2,0,0,0,0|2,0,0]=4 10135 B14R1.907 CCCNCc1ccc(c(c1)CC)F 207a_100020643023_100009840867 [0,2,0,0,0,0|2,0,0]=4 10136 B14R1.907 CCCNCc1ccc(c(c1)CC)F 2230a_114873767189_100000210303 [0,2,0,0,0,0|2,0,0]=4 10137 B14R1.907 CCCNCc1ccc(c(c1)CC)F 269862a_100020643023_100009840867 [0,2,0,0,0,0|2,0,0]=4 10138 B14R1.907 CCCNCc1ccc(c(c1)CC)F 270004a_100020643023_100009840867 [0,2,0,0,0,0|2,0,0]=4 10139 B14R1.907 CCCNCc1ccc(c(c1)CC)F 34a_114873767189_100000210303 [0,2,0,0,0,0|2,0,0]=4 10140 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 207a_100020643023_100010244714 [0,2,0,0,0,0|1,0,0]=3 10141 B14R1.907 CCCNCc1ccc(c(c1)OC)Br 270004a_100020643023_100010244714 [0,2,0,0,0,0|1,0,0]=3 10142 B14R1.907 CCCNCc1ccc(c(c1)OC)C 207a_100020643023_100000719150 [0,2,0,0,0,0|1,0,0]=3 10143 B14R1.907 CCCNCc1ccc(c(c1)OC)C 270004a_100020643023_100000719150 [0,2,0,0,0,0|1,0,0]=3 10144 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 207a_100020643023_100011998524 [0,2,0,0,0,0|1,0,0]=3 10145 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000210303 [0,2,0,0,0,0|1,0,0]=3 10146 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 270004a_100020643023_100011998524 [0,2,0,0,0,0|1,0,0]=3 10147 B14R1.907 CCCNCc1ccc(c(c1)OC)Cl 34a_100015204853_100000210303 [0,2,0,0,0,0|1,0,0]=3 10148 B14R1.907 CCCNCc1ccc(c(c1)OC)F 207a_100020643023_100000692873 [0,2,0,0,0,0|1,0,0]=3 10149 B14R1.907 CCCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000210303 [0,2,0,0,0,0|1,0,0]=3 10150 B14R1.907 CCCNCc1ccc(c(c1)OC)F 270004a_100020643023_100000692873 [0,2,0,0,0,0|1,0,0]=3 10151 B14R1.907 CCCNCc1ccc(c(c1)OC)F 34a_100020626639_100000210303 [0,2,0,0,0,0|1,0,0]=3 10152 B14R1.907 CCCNCc1ccc(c(c1)OC)O 34a_100000185554_100000210303 [0,2,0,0,0,0|0,0,0]=2 10153 B14R1.907 CCCOCc1cc(c(cn1)Br)OC 34a_100010999569_100000210303 [0,2,0,0,0,0|2,0,0]=4 10154 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100000210258_100010110085 [0,2,0,0,0,0|1,0,0]=3 10155 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 34a_100010234685_100000210303 [0,2,0,0,0,0|1,0,0]=3 10156 B14R1.907 CCCOCc1ccc(c(c1)OC)Br 7a_100010234685_100000210303 [0,2,0,0,0,0|1,0,0]=3 10157 B14R1.907 CCCOCc1ccc(c(c1)OC)C 34a_100000752651_100000210303 [0,2,0,0,0,0|1,0,0]=3 10158 B14R1.907 CCCOCc1ccc(c(c1)OC)C 7a_100000752651_100000210303 [0,2,0,0,0,0|1,0,0]=3 10159 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100000210258_200010214485 [0,2,0,0,0,0|1,0,0]=3 10160 B14R1.907 CCCOCc1ccc(c(c1)OC)Cl 34a_100012179228_100000210303 [0,2,0,0,0,0|1,0,0]=3 10161 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000210258_100012349856 [0,2,0,0,0,0|1,0,0]=3 10162 B14R1.907 CCCOCc1ccc(c(c1)OC)F 34a_100000692429_100000210303 [0,2,0,0,0,0|1,0,0]=3 10163 B14R1.907 CCCOCc1ccc(c(c1)OC)F 7a_100000692429_100000210303 [0,2,0,0,0,0|1,0,0]=3 10164 B14R1.907 CCCOCc1ccc(c(c1)OC)N 34a_100000087641_100000210303 [0,2,0,0,0,0|1,0,0]=3 10165 B14R1.907 CCCOCc1ccc(c(n1)OC)Br 34a_100000210258_200010066506 [0,2,0,0,0,0|2,0,0]=4 10166 B14R1.907 CCCSCc1ccc(c(c1)C=O)O 62a_100000210303_100000008128 [0,2,0,0,0,0|2,0,0]=4 10167 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100000210303_100010110085 [0,2,0,0,0,0|1,0,0]=3 10168 B14R1.907 CCCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000210303 [0,2,0,0,0,0|1,0,0]=3 10169 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_100000210303_200010214485 [0,2,0,0,0,0|1,0,0]=3 10170 B14R1.907 CCCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000210303 [0,2,0,0,0,0|1,0,0]=3 10171 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100000210303_100012349856 [0,2,0,0,0,0|1,0,0]=3 10172 B14R1.907 CCCSCc1ccc(c(c1)OC)F 62a_100012349856_100000210303 [0,2,0,0,0,0|1,0,0]=3 10173 B14R1.907 CCCSCc1ccc(c(n1)OC)Br 62a_100000210303_200010066506 [0,2,0,0,0,0|2,0,0]=4 10174 B14R1.907 CCCSCc1ccc(c(n1)OC)Br 62a_200010066506_100000210303 [0,2,0,0,0,0|2,0,0]=4 10175 B14R1.907 CCNCCc1ccc(c(c1)OC)O 2230a_100015525214_100010741665 [0,2,0,0,0,0|0,0,0]=2 10176 B14R1.907 CCNCCc1ccc(c(c1)OC)O 34a_100000756042_100000210202 [0,2,0,0,0,0|0,0,0]=2 10177 B14R1.907 CCNN=Cc1ccc(c(c1)OC)Br 4a_100000756455_100010244714 [0,2,0,0,0,0|1,0,1]=4 10178 B14R1.907 CCNN=Cc1ccc(c(c1)OC)C 4a_100000756455_100000719150 [0,2,0,0,0,0|1,0,1]=4 10179 B14R1.907 CCNN=Cc1ccc(c(c1)OC)Cl 4a_100000756455_100011998524 [0,2,0,0,0,0|1,0,1]=4 10180 B14R1.907 CCNN=Cc1ccc(c(c1)OC)F 4a_100000756455_100000692873 [0,2,0,0,0,0|1,0,1]=4 10181 B14R1.907 CCNN=Cc1ccc(c(c1)OC)O 4a_100000756455_100000188322 [0,2,0,0,0,0|0,0,1]=3 10182 B14R1.907 CCOC=Cc1ccc(c(c1)CC)O 271570a_100016256518_100012338938 [0,2,0,0,0,0|1,0,1]=4 10183 B14R1.907 CCOC=Cc1ccc(c(c1)OC)Br 271570a_100016256518_100012353699 [0,2,0,0,0,0|1,0,1]=4 10184 B14R1.907 CCOC=Cc1ccc(c(c1)OC)C 271570a_100016256518_100011830276 [0,2,0,0,0,0|1,0,1]=4 10185 B14R1.907 CCOC=Cc1ccc(c(c1)OC)Cl 271570a_100016256518_100011356853 [0,2,0,0,0,0|1,0,1]=4 10186 B14R1.907 CCOC=Cc1ccc(c(c1)OC)F 271570a_100016256518_100011934186 [0,2,0,0,0,0|1,0,1]=4 10187 B14R1.907 CCOC=Cc1ccc(c(c1)OC)N 271570a_100016256518_100011279103 [0,2,0,0,0,0|1,0,1]=4 10188 B14R1.907 CCOC=Cc1ccc(c(c1)OC)O 271570a_100016256518_100000694246 [0,2,0,0,0,0|0,0,1]=3 10189 B14R1.907 CCOC=Cc1ccc(c(n1)OC)O 271570a_100016256518_100010893133 [0,2,0,0,0,0|1,0,1]=4 10190 B14R1.907 CCOCSc1c[nH]c(=O)c(c1)OC 62a_100000739092_100010125397 [0,2,0,0,0,0|1,0,1]=4 10191 B14R1.907 CCOCSc1cc(c(cn1)C)OC 62a_100000739092_100010067687 [0,2,0,0,0,0|2,0,0]=4 10192 B14R1.907 CCOCSc1cc(c(cn1)C)OC 62a_100010067687_100000739092 [0,2,0,0,0,0|2,0,0]=4 10193 B14R1.907 CCOCSc1cc(c(cn1)F)OC 62a_100000739092_200010136270 [0,2,0,0,0,0|2,0,0]=4 10194 B14R1.907 CCOCSc1cc(c(cn1)F)OC 62a_200010136270_100000739092 [0,2,0,0,0,0|2,0,0]=4 10195 B14R1.907 CCOCSc1cc(c(cn1)N)OC 62a_100000739092_100009887741 [0,2,0,0,0,0|2,0,0]=4 10196 B14R1.907 CCOCSc1cc(c(cn1)N)OC 62a_100009887741_100000739092 [0,2,0,0,0,0|2,0,0]=4 10197 B14R1.907 CCOCSc1ccc(c(c1)C#N)O 62a_100000739092_100000687585 [0,2,0,0,0,0|2,0,0]=4 10198 B14R1.907 CCOCSc1ccc(c(c1)C=O)O 62a_100000739092_100000186750 [0,2,0,0,0,0|2,0,0]=4 10199 B14R1.907 CCOCSc1ccc(c(c1)CC)Br 62a_100000739092_100010244631 [0,2,0,0,0,0|2,0,0]=4 10200 B14R1.907 CCOCSc1ccc(c(c1)CC)Br 62a_100010244631_100000739092 [0,2,0,0,0,0|2,0,0]=4 10201 B14R1.907 CCOCSc1ccc(c(c1)CC)F 62a_100000739092_100010244625 [0,2,0,0,0,0|2,0,0]=4 10202 B14R1.907 CCOCSc1ccc(c(c1)CC)F 62a_100010244625_100000739092 [0,2,0,0,0,0|2,0,0]=4 10203 B14R1.907 CCOCSc1ccc(c(c1)CC)N 62a_100000686106_100000739092 [0,2,0,0,0,0|2,0,0]=4 10204 B14R1.907 CCOCSc1ccc(c(c1)CC)N 62a_100000739092_100000686106 [0,2,0,0,0,0|2,0,0]=4 10205 B14R1.907 CCOCSc1ccc(c(c1)CC)O 62a_100000739092_100012338938 [0,2,0,0,0,0|1,0,0]=3 10206 B14R1.907 CCOCSc1ccc(c(c1)CN)O 62a_100000730032_100000739092 [0,2,0,0,0,0|2,0,0]=4 10207 B14R1.907 CCOCSc1ccc(c(c1)CN)O 62a_100000739092_100000730032 [0,2,0,0,0,0|2,0,0]=4 10208 B14R1.907 CCOCSc1ccc(c(c1)CO)O 62a_100000184703_100000739092 [0,2,0,0,0,0|2,0,0]=4 10209 B14R1.907 CCOCSc1ccc(c(c1)CO)O 62a_100000739092_100000184703 [0,2,0,0,0,0|2,0,0]=4 10210 B14R1.907 CCOCSc1ccc(c(c1)NC)C 62a_100000739092_100020629602 [0,2,0,0,0,0|2,0,0]=4 10211 B14R1.907 CCOCSc1ccc(c(c1)NC)C 62a_100020629602_100000739092 [0,2,0,0,0,0|2,0,0]=4 10212 B14R1.907 CCOCSc1ccc(c(c1)NC)F 62a_100000739092_100011314990 [0,2,0,0,0,0|2,0,0]=4 10213 B14R1.907 CCOCSc1ccc(c(c1)NC)F 62a_100011314990_100000739092 [0,2,0,0,0,0|2,0,0]=4 10214 B14R1.907 CCOCSc1ccc(c(c1)NC)N 62a_100000694363_100000739092 [0,2,0,0,0,0|2,0,0]=4 10215 B14R1.907 CCOCSc1ccc(c(c1)OC)Br 62a_100000739092_100012353699 [0,2,0,0,0,0|1,0,0]=3 10216 B14R1.907 CCOCSc1ccc(c(c1)OC)Br 62a_100012353699_100000739092 [0,2,0,0,0,0|1,0,0]=3 10217 B14R1.907 CCOCSc1ccc(c(c1)OC)C 62a_100000739092_100011830276 [0,2,0,0,0,0|1,0,0]=3 10218 B14R1.907 CCOCSc1ccc(c(c1)OC)C 62a_100011830276_100000739092 [0,2,0,0,0,0|1,0,0]=3 10219 B14R1.907 CCOCSc1ccc(c(c1)OC)Cl 62a_100000739092_100011356853 [0,2,0,0,0,0|1,0,0]=3 10220 B14R1.907 CCOCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000739092 [0,2,0,0,0,0|1,0,0]=3 10221 B14R1.907 CCOCSc1ccc(c(c1)OC)F 62a_100000739092_100011934186 [0,2,0,0,0,0|1,0,0]=3 10222 B14R1.907 CCOCSc1ccc(c(c1)OC)F 62a_100011934186_100000739092 [0,2,0,0,0,0|1,0,0]=3 10223 B14R1.907 CCOCSc1ccc(c(c1)OC)N 62a_100000739092_100015196925 [0,2,0,0,0,0|1,0,0]=3 10224 B14R1.907 CCOCSc1ccc(c(c1)OC)N 62a_100011279103_100000739092 [0,2,0,0,0,0|1,0,0]=3 10225 B14R1.907 CCOCSc1ccc(c(c1)OC)O 62a_100000739092_100000694246 [0,2,0,0,0,0|0,0,0]=2 10226 B14R1.907 CCOCSc1ccc(c(c1)SC)F 62a_100000739092_100010341305 [0,2,0,0,0,0|1,1,0]=4 10227 B14R1.907 CCOCSc1ccc(c(c1)SC)F 62a_100010341305_100000739092 [0,2,0,0,0,0|1,1,0]=4 10228 B14R1.907 CCOCSc1ccc(c(n1)OC)N 62a_100000687816_100000739092 [0,2,0,0,0,0|2,0,0]=4 10229 B14R1.907 CCOCSc1ccc(c(n1)OC)N 62a_100000739092_100000687816 [0,2,0,0,0,0|2,0,0]=4 10230 B14R1.907 CCOCSc1ccc(c(n1)OC)O 62a_100000739092_100010893133 [0,2,0,0,0,0|1,0,0]=3 10231 B14R1.907 CCOCSc1cnc(c(c1)OC)C 62a_100000739092_100010254219 [0,2,0,0,0,0|2,0,0]=4 10232 B14R1.907 CCOCSc1cnc(c(c1)OC)C 62a_100010254219_100000739092 [0,2,0,0,0,0|2,0,0]=4 10233 B14R1.907 CCOCSc1cnc(c(c1)OC)F 62a_100000739092_100010214931 [0,2,0,0,0,0|2,0,0]=4 10234 B14R1.907 CCOCSc1cnc(c(c1)OC)F 62a_100010214931_100000739092 [0,2,0,0,0,0|2,0,0]=4 10235 B14R1.907 CCOCSc1cnc(c(c1)OC)N 62a_100000739092_106354213024 [0,2,0,0,0,0|2,0,0]=4 10236 B14R1.907 CCOCSc1cnc(c(c1)OC)N 62a_106354213024_100000739092 [0,2,0,0,0,0|2,0,0]=4 10237 B14R1.907 CCOCSc1cnc(c(n1)OC)O 62a_100000739092_200010365344 [0,2,0,0,0,0|2,0,0]=4 10238 B14R1.907 CCOCSc1cnc(c(n1)OC)O 62a_200010365344_100000739092 [0,2,0,0,0,0|2,0,0]=4 10239 B14R1.907 CCSCCc1ccc(c(c1)OC)O 62a_100000210202_100010741665 [0,2,0,0,0,0|0,0,0]=2 10240 B14R1.907 CCc1cc(ccc1Br)NCCCF 2230a_100010109747_100011934791 [0,2,0,0,0,0|2,0,0]=4 10241 B14R1.907 CCc1cc(ccc1Br)NCCCF 34a_100010109747_100011934791 [0,2,0,0,0,0|2,0,0]=4 10242 B14R1.907 CCc1cc(ccc1Br)NCCCF 7a_100010109747_100011934791 [0,2,0,0,0,0|2,0,0]=4 10243 B14R1.907 CCc1cc(ccc1Br)NCCCO 2230a_100010109747_100000230001 [0,2,0,0,0,0|2,0,0]=4 10244 B14R1.907 CCc1cc(ccc1Br)NCCCO 34a_100010109747_100000230001 [0,2,0,0,0,0|2,0,0]=4 10245 B14R1.907 CCc1cc(ccc1Br)NCCCO 7a_100010109747_100011215043 [0,2,0,0,0,0|2,0,0]=4 10246 B14R1.907 CCc1cc(ccc1Br)NCCOC 2230a_100010109747_100011201679 [0,2,0,0,0,0|2,0,0]=4 10247 B14R1.907 CCc1cc(ccc1Br)NCCOC 34a_100010109747_100011201679 [0,2,0,0,0,0|2,0,0]=4 10248 B14R1.907 CCc1cc(ccc1Br)NCCOC 7a_100010109747_100000233755 [0,2,0,0,0,0|2,0,0]=4 10249 B14R1.907 CCc1cc(ccc1Br)NCCSC 2230a_100010109747_100000751147 [0,2,0,0,0,0|2,0,0]=4 10250 B14R1.907 CCc1cc(ccc1Br)NCCSC 34a_100010109747_100000212216 [0,2,0,0,0,0|2,0,0]=4 10251 B14R1.907 CCc1cc(ccc1Br)NCCSC 7a_100010109747_100000212216 [0,2,0,0,0,0|2,0,0]=4 10252 B14R1.907 CCc1cc(ccc1Br)SCCCF 62a_100010244631_100011934791 [0,2,0,0,0,0|2,0,0]=4 10253 B14R1.907 CCc1cc(ccc1Br)SCCCF 62a_100011934791_100010244631 [0,2,0,0,0,0|2,0,0]=4 10254 B14R1.907 CCc1cc(ccc1Br)SCCCO 62a_100010244631_100011215043 [0,2,0,0,0,0|2,0,0]=4 10255 B14R1.907 CCc1cc(ccc1Br)SCCCO 62a_100011215043_100010244631 [0,2,0,0,0,0|2,0,0]=4 10256 B14R1.907 CCc1cc(ccc1Br)SCCOC 62a_100000233755_100010244631 [0,2,0,0,0,0|2,0,0]=4 10257 B14R1.907 CCc1cc(ccc1Br)SCCOC 62a_100010244631_100000233755 [0,2,0,0,0,0|2,0,0]=4 10258 B14R1.907 CCc1cc(ccc1Br)SCCSC 62a_100000212216_100010244631 [0,2,0,0,0,0|2,0,0]=4 10259 B14R1.907 CCc1cc(ccc1Br)SCCSC 62a_100010244631_100000751147 [0,2,0,0,0,0|2,0,0]=4 10260 B14R1.907 CCc1cc(ccc1Cl)OCCCF 34a_100000212063_100011934791 [0,2,0,0,0,0|2,0,0]=4 10261 B14R1.907 CCc1cc(ccc1Cl)OCCCF 7a_100000212063_100011934791 [0,2,0,0,0,0|2,0,0]=4 10262 B14R1.907 CCc1cc(ccc1Cl)OCCCO 34a_100000212063_100000230001 [0,2,0,0,0,0|2,0,0]=4 10263 B14R1.907 CCc1cc(ccc1Cl)OCCCO 7a_100000212063_100011215043 [0,2,0,0,0,0|2,0,0]=4 10264 B14R1.907 CCc1cc(ccc1Cl)OCCOC 34a_100000212063_100011201679 [0,2,0,0,0,0|2,0,0]=4 10265 B14R1.907 CCc1cc(ccc1Cl)OCCOC 7a_100000212063_100000233755 [0,2,0,0,0,0|2,0,0]=4 10266 B14R1.907 CCc1cc(ccc1Cl)OCCSC 34a_100000212063_100000212216 [0,2,0,0,0,0|2,0,0]=4 10267 B14R1.907 CCc1cc(ccc1Cl)OCCSC 7a_100000212063_100000212216 [0,2,0,0,0,0|2,0,0]=4 10268 B14R1.907 CCc1cc(ccc1F)CNCCF 2230a_114873767189_100011217306 [0,2,0,0,0,0|2,0,0]=4 10269 B14R1.907 CCc1cc(ccc1F)CNCCF 269862a_100000724931_100009840867 [0,2,0,0,0,0|2,0,0]=4 10270 B14R1.907 CCc1cc(ccc1F)CNCCF 34a_114873767189_100011217306 [0,2,0,0,0,0|2,0,0]=4 10271 B14R1.907 CCc1cc(ccc1F)CNCCO 207a_100000210304_100009840867 [0,2,0,0,0,0|2,0,0]=4 10272 B14R1.907 CCc1cc(ccc1F)CNCCO 2230a_114873767189_100000211926 [0,2,0,0,0,0|2,0,0]=4 10273 B14R1.907 CCc1cc(ccc1F)CNCCO 269862a_100000210304_100009840867 [0,2,0,0,0,0|2,0,0]=4 10274 B14R1.907 CCc1cc(ccc1F)CNCCO 270004a_100000210304_100009840867 [0,2,0,0,0,0|2,0,0]=4 10275 B14R1.907 CCc1cc(ccc1F)CNCCO 34a_114873767189_100000211926 [0,2,0,0,0,0|2,0,0]=4 10276 B14R1.907 CCc1cc(ccc1F)CNCOC 2230a_114873767189_100000766300 [0,2,0,0,0,0|2,0,0]=4 10277 B14R1.907 CCc1cc(ccc1F)CNCSC 2230a_114873767189_100011218213 [0,2,0,0,0,0|2,0,0]=4 10278 B14R1.907 CCc1cc(ccc1F)CNCSC 34a_114873767189_100011218213 [0,2,0,0,0,0|2,0,0]=4 10279 B14R1.907 CCc1cc(ccc1F)SCCCF 62a_100010244625_100011934791 [0,2,0,0,0,0|2,0,0]=4 10280 B14R1.907 CCc1cc(ccc1F)SCCCF 62a_100011934791_100010244625 [0,2,0,0,0,0|2,0,0]=4 10281 B14R1.907 CCc1cc(ccc1F)SCCCO 62a_100010244625_100011215043 [0,2,0,0,0,0|2,0,0]=4 10282 B14R1.907 CCc1cc(ccc1F)SCCCO 62a_100011215043_100010244625 [0,2,0,0,0,0|2,0,0]=4 10283 B14R1.907 CCc1cc(ccc1F)SCCOC 62a_100000233755_100010244625 [0,2,0,0,0,0|2,0,0]=4 10284 B14R1.907 CCc1cc(ccc1F)SCCOC 62a_100010244625_100000233755 [0,2,0,0,0,0|2,0,0]=4 10285 B14R1.907 CCc1cc(ccc1F)SCCSC 62a_100000212216_100010244625 [0,2,0,0,0,0|2,0,0]=4 10286 B14R1.907 CCc1cc(ccc1F)SCCSC 62a_100010244625_100000751147 [0,2,0,0,0,0|2,0,0]=4 10287 B14R1.907 CCc1cc(ccc1N)SCCCF 62a_100000686106_100011934791 [0,2,0,0,0,0|2,0,0]=4 10288 B14R1.907 CCc1cc(ccc1N)SCCCF 62a_100011934791_100000686106 [0,2,0,0,0,0|2,0,0]=4 10289 B14R1.907 CCc1cc(ccc1N)SCCCO 62a_100000686106_100011215043 [0,2,0,0,0,0|2,0,0]=4 10290 B14R1.907 CCc1cc(ccc1N)SCCCO 62a_100011215043_100000686106 [0,2,0,0,0,0|2,0,0]=4 10291 B14R1.907 CCc1cc(ccc1N)SCCOC 62a_100000233755_100000686106 [0,2,0,0,0,0|2,0,0]=4 10292 B14R1.907 CCc1cc(ccc1N)SCCOC 62a_100000686106_100000233755 [0,2,0,0,0,0|2,0,0]=4 10293 B14R1.907 CCc1cc(ccc1N)SCCSC 62a_100000212216_100000686106 [0,2,0,0,0,0|2,0,0]=4 10294 B14R1.907 CCc1cc(ccc1N)SCCSC 62a_100000686106_100000751147 [0,2,0,0,0,0|2,0,0]=4 10295 B14R1.907 CCc1cc(ccc1O)C=CCOC 271570a_100016286323_100012338938 [0,2,0,0,0,0|1,0,1]=4 10296 B14R1.907 CCc1cc(ccc1O)SCCC#N 62a_100011215226_100012338938 [0,2,0,0,0,0|1,0,1]=4 10297 B14R1.907 CCc1cc(ccc1O)SCCCF 62a_100011934791_100012338938 [0,2,0,0,0,0|1,0,0]=3 10298 B14R1.907 CCc1cc(ccc1O)SCCCO 62a_100011215043_100012338938 [0,2,0,0,0,0|1,0,0]=3 10299 B14R1.907 CCc1cc(ccc1O)SCCOC 62a_100000233755_100012338938 [0,2,0,0,0,0|1,0,0]=3 10300 B14R1.907 CCc1cc(ccc1O)SCCSC 62a_100000212216_100012338938 [0,2,0,0,0,0|1,0,0]=3 10301 B14R1.907 CNc1cc(ccc1C)SCCCF 62a_100011934791_100020629602 [0,2,0,0,0,0|2,0,0]=4 10302 B14R1.907 CNc1cc(ccc1C)SCCCF 62a_100020629602_100011934791 [0,2,0,0,0,0|2,0,0]=4 10303 B14R1.907 CNc1cc(ccc1C)SCCCO 62a_100011215043_100020629602 [0,2,0,0,0,0|2,0,0]=4 10304 B14R1.907 CNc1cc(ccc1C)SCCCO 62a_100020629602_100011215043 [0,2,0,0,0,0|2,0,0]=4 10305 B14R1.907 CNc1cc(ccc1C)SCCOC 62a_100000233755_100020629602 [0,2,0,0,0,0|2,0,0]=4 10306 B14R1.907 CNc1cc(ccc1C)SCCOC 62a_100020629602_100000233755 [0,2,0,0,0,0|2,0,0]=4 10307 B14R1.907 CNc1cc(ccc1C)SCCSC 62a_100000212216_100020629602 [0,2,0,0,0,0|2,0,0]=4 10308 B14R1.907 CNc1cc(ccc1C)SCCSC 62a_100020629602_100000751147 [0,2,0,0,0,0|2,0,0]=4 10309 B14R1.907 CNc1cc(ccc1F)SCCCF 62a_100011314990_100011934791 [0,2,0,0,0,0|2,0,0]=4 10310 B14R1.907 CNc1cc(ccc1F)SCCCF 62a_100011934791_100011314990 [0,2,0,0,0,0|2,0,0]=4 10311 B14R1.907 CNc1cc(ccc1F)SCCCO 62a_100011215043_100011314990 [0,2,0,0,0,0|2,0,0]=4 10312 B14R1.907 CNc1cc(ccc1F)SCCCO 62a_100011314990_100011215043 [0,2,0,0,0,0|2,0,0]=4 10313 B14R1.907 CNc1cc(ccc1F)SCCOC 62a_100000233755_100011314990 [0,2,0,0,0,0|2,0,0]=4 10314 B14R1.907 CNc1cc(ccc1F)SCCOC 62a_100011314990_100000233755 [0,2,0,0,0,0|2,0,0]=4 10315 B14R1.907 CNc1cc(ccc1F)SCCSC 62a_100000212216_100011314990 [0,2,0,0,0,0|2,0,0]=4 10316 B14R1.907 CNc1cc(ccc1F)SCCSC 62a_100011314990_100000751147 [0,2,0,0,0,0|2,0,0]=4 10317 B14R1.907 CNc1cc(ccc1N)SCCCF 62a_100000694363_100011934791 [0,2,0,0,0,0|2,0,0]=4 10318 B14R1.907 CNc1cc(ccc1N)SCCCO 62a_100000694363_100011215043 [0,2,0,0,0,0|2,0,0]=4 10319 B14R1.907 CNc1cc(ccc1N)SCCOC 62a_100000694363_100000233755 [0,2,0,0,0,0|2,0,0]=4 10320 B14R1.907 CNc1cc(ccc1N)SCCSC 62a_100000694363_100000751147 [0,2,0,0,0,0|2,0,0]=4 10321 B14R1.907 COCC=Cc1ccc(c(c1)OC)Br 271570a_100016286323_100012353699 [0,2,0,0,0,0|1,0,1]=4 10322 B14R1.907 COCC=Cc1ccc(c(c1)OC)C 271570a_100016286323_100011830276 [0,2,0,0,0,0|1,0,1]=4 10323 B14R1.907 COCC=Cc1ccc(c(c1)OC)Cl 271570a_100016286323_100011356853 [0,2,0,0,0,0|1,0,1]=4 10324 B14R1.907 COCC=Cc1ccc(c(c1)OC)F 271570a_100016286323_100011934186 [0,2,0,0,0,0|1,0,1]=4 10325 B14R1.907 COCC=Cc1ccc(c(c1)OC)N 271570a_100016286323_100011279103 [0,2,0,0,0,0|1,0,1]=4 10326 B14R1.907 COCC=Cc1ccc(c(c1)OC)O 271570a_100016286323_100000694246 [0,2,0,0,0,0|0,0,1]=3 10327 B14R1.907 COCC=Cc1ccc(c(n1)OC)O 271570a_100016286323_100010893133 [0,2,0,0,0,0|1,0,1]=4 10328 B14R1.907 COCCNc1ccc(c(c1)C#N)O 34a_100011249283_100011201679 [0,2,0,0,0,0|2,0,0]=4 10329 B14R1.907 COCCNc1ccc(c(c1)OC)Br 2230a_100000765947_100011201679 [0,2,0,0,0,0|1,0,0]=3 10330 B14R1.907 COCCNc1ccc(c(c1)OC)Br 34a_100000765947_100011201679 [0,2,0,0,0,0|1,0,0]=3 10331 B14R1.907 COCCNc1ccc(c(c1)OC)C 2230a_100011279678_100011201679 [0,2,0,0,0,0|1,0,0]=3 10332 B14R1.907 COCCNc1ccc(c(c1)OC)C 34a_100011279678_100011201679 [0,2,0,0,0,0|1,0,0]=3 10333 B14R1.907 COCCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100011201679 [0,2,0,0,0,0|1,0,0]=3 10334 B14R1.907 COCCNc1ccc(c(c1)OC)Cl 34a_100000742311_100011201679 [0,2,0,0,0,0|1,0,0]=3 10335 B14R1.907 COCCNc1ccc(c(c1)OC)F 2230a_100000701188_100011201679 [0,2,0,0,0,0|1,0,0]=3 10336 B14R1.907 COCCNc1ccc(c(c1)OC)F 34a_100000701188_100011201679 [0,2,0,0,0,0|1,0,0]=3 10337 B14R1.907 COCCNc1ccc(c(c1)OC)I 34a_100000746945_100011201679 [0,2,0,0,0,0|1,0,0]=3 10338 B14R1.907 COCCNc1ccc(c(c1)OC)O 34a_100000726020_100011201679 [0,2,0,0,0,0|0,0,0]=2 10339 B14R1.907 COCCOc1ccc(c(c1)OC)Br 34a_100011827694_100011201679 [0,2,0,0,0,0|1,0,0]=3 10340 B14R1.907 COCCOc1ccc(c(c1)OC)Br 7a_100011827694_100000233755 [0,2,0,0,0,0|1,0,0]=3 10341 B14R1.907 COCCOc1ccc(c(c1)OC)C 34a_100009865632_100011201679 [0,2,0,0,0,0|1,0,0]=3 10342 B14R1.907 COCCOc1ccc(c(c1)OC)C 7a_100009865632_100000233755 [0,2,0,0,0,0|1,0,0]=3 10343 B14R1.907 COCCOc1ccc(c(c1)OC)Cl 34a_100012186310_100011201679 [0,2,0,0,0,0|1,0,0]=3 10344 B14R1.907 COCCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000233755 [0,2,0,0,0,0|1,0,0]=3 10345 B14R1.907 COCCOc1ccc(c(c1)OC)F 34a_100012001760_100011201679 [0,2,0,0,0,0|1,0,0]=3 10346 B14R1.907 COCCOc1ccc(c(c1)OC)F 7a_100012001760_100000233755 [0,2,0,0,0,0|1,0,0]=3 10347 B14R1.907 COCCOc1ccc(c(c1)OC)N 34a_100015326901_100011201679 [0,2,0,0,0,0|1,0,0]=3 10348 B14R1.907 COCCOc1ccc(c(c1)OC)N 7a_100015326901_100000233755 [0,2,0,0,0,0|1,0,0]=3 10349 B14R1.907 COCCSc1c[nH]c(=O)c(c1)OC 62a_100000233755_100010125397 [0,2,0,0,0,0|1,0,1]=4 10350 B14R1.907 COCCSc1cc(c(cn1)C)OC 62a_100000233755_100010067687 [0,2,0,0,0,0|2,0,0]=4 10351 B14R1.907 COCCSc1cc(c(cn1)C)OC 62a_100010067687_100000233755 [0,2,0,0,0,0|2,0,0]=4 10352 B14R1.907 COCCSc1cc(c(cn1)F)OC 62a_100000233755_200010136270 [0,2,0,0,0,0|2,0,0]=4 10353 B14R1.907 COCCSc1cc(c(cn1)F)OC 62a_200010136270_100000233755 [0,2,0,0,0,0|2,0,0]=4 10354 B14R1.907 COCCSc1cc(c(cn1)N)OC 62a_100000233755_100009887741 [0,2,0,0,0,0|2,0,0]=4 10355 B14R1.907 COCCSc1cc(c(cn1)N)OC 62a_100009887741_100000233755 [0,2,0,0,0,0|2,0,0]=4 10356 B14R1.907 COCCSc1ccc(c(c1)C#N)O 62a_100000233755_100000687585 [0,2,0,0,0,0|2,0,0]=4 10357 B14R1.907 COCCSc1ccc(c(c1)C=O)O 62a_100000233755_100000186750 [0,2,0,0,0,0|2,0,0]=4 10358 B14R1.907 COCCSc1ccc(c(c1)CN)O 62a_100000233755_100000730032 [0,2,0,0,0,0|2,0,0]=4 10359 B14R1.907 COCCSc1ccc(c(c1)CN)O 62a_100000730032_100000233755 [0,2,0,0,0,0|2,0,0]=4 10360 B14R1.907 COCCSc1ccc(c(c1)CO)O 62a_100000184703_100000233755 [0,2,0,0,0,0|2,0,0]=4 10361 B14R1.907 COCCSc1ccc(c(c1)CO)O 62a_100000233755_100000184703 [0,2,0,0,0,0|2,0,0]=4 10362 B14R1.907 COCCSc1ccc(c(c1)OC)Br 62a_100000233755_100012353699 [0,2,0,0,0,0|1,0,0]=3 10363 B14R1.907 COCCSc1ccc(c(c1)OC)Br 62a_100012353699_100000233755 [0,2,0,0,0,0|1,0,0]=3 10364 B14R1.907 COCCSc1ccc(c(c1)OC)C 62a_100000233755_100011830276 [0,2,0,0,0,0|1,0,0]=3 10365 B14R1.907 COCCSc1ccc(c(c1)OC)C 62a_100011830276_100000233755 [0,2,0,0,0,0|1,0,0]=3 10366 B14R1.907 COCCSc1ccc(c(c1)OC)Cl 62a_100000233755_100011356853 [0,2,0,0,0,0|1,0,0]=3 10367 B14R1.907 COCCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000233755 [0,2,0,0,0,0|1,0,0]=3 10368 B14R1.907 COCCSc1ccc(c(c1)OC)F 62a_100000233755_100011934186 [0,2,0,0,0,0|1,0,0]=3 10369 B14R1.907 COCCSc1ccc(c(c1)OC)F 62a_100011934186_100000233755 [0,2,0,0,0,0|1,0,0]=3 10370 B14R1.907 COCCSc1ccc(c(c1)OC)N 62a_100000233755_100015196925 [0,2,0,0,0,0|1,0,0]=3 10371 B14R1.907 COCCSc1ccc(c(c1)OC)N 62a_100011279103_100000233755 [0,2,0,0,0,0|1,0,0]=3 10372 B14R1.907 COCCSc1ccc(c(c1)OC)O 62a_100000233755_100000694246 [0,2,0,0,0,0|0,0,0]=2 10373 B14R1.907 COCCSc1ccc(c(c1)SC)F 62a_100000233755_100010341305 [0,2,0,0,0,0|1,1,0]=4 10374 B14R1.907 COCCSc1ccc(c(c1)SC)F 62a_100010341305_100000233755 [0,2,0,0,0,0|1,1,0]=4 10375 B14R1.907 COCCSc1ccc(c(n1)OC)N 62a_100000233755_100000687816 [0,2,0,0,0,0|2,0,0]=4 10376 B14R1.907 COCCSc1ccc(c(n1)OC)N 62a_100000687816_100000233755 [0,2,0,0,0,0|2,0,0]=4 10377 B14R1.907 COCCSc1ccc(c(n1)OC)O 62a_100000233755_100010893133 [0,2,0,0,0,0|1,0,0]=3 10378 B14R1.907 COCCSc1cnc(c(c1)OC)C 62a_100000233755_100010254219 [0,2,0,0,0,0|2,0,0]=4 10379 B14R1.907 COCCSc1cnc(c(c1)OC)C 62a_100010254219_100000233755 [0,2,0,0,0,0|2,0,0]=4 10380 B14R1.907 COCCSc1cnc(c(c1)OC)F 62a_100000233755_100010214931 [0,2,0,0,0,0|2,0,0]=4 10381 B14R1.907 COCCSc1cnc(c(c1)OC)F 62a_100010214931_100000233755 [0,2,0,0,0,0|2,0,0]=4 10382 B14R1.907 COCCSc1cnc(c(c1)OC)N 62a_100000233755_106354213024 [0,2,0,0,0,0|2,0,0]=4 10383 B14R1.907 COCCSc1cnc(c(c1)OC)N 62a_106354213024_100000233755 [0,2,0,0,0,0|2,0,0]=4 10384 B14R1.907 COCCSc1cnc(c(n1)OC)O 62a_100000233755_200010365344 [0,2,0,0,0,0|2,0,0]=4 10385 B14R1.907 COCCSc1cnc(c(n1)OC)O 62a_200010365344_100000233755 [0,2,0,0,0,0|2,0,0]=4 10386 B14R1.907 COCNCc1ccc(c(c1)OC)Cl 2230a_100015204853_100000766300 [0,2,0,0,0,0|1,0,0]=3 10387 B14R1.907 COCNCc1ccc(c(c1)OC)F 2230a_100020626639_100000766300 [0,2,0,0,0,0|1,0,0]=3 10388 B14R1.907 COCSCc1ccc(c(c1)C=O)O 62a_100000766300_100000008128 [0,2,0,0,0,0|2,0,0]=4 10389 B14R1.907 COCSCc1ccc(c(c1)OC)Br 62a_100000766300_100010110085 [0,2,0,0,0,0|1,0,0]=3 10390 B14R1.907 COCSCc1ccc(c(c1)OC)Br 62a_100010110085_100000766300 [0,2,0,0,0,0|1,0,0]=3 10391 B14R1.907 COCSCc1ccc(c(c1)OC)Cl 62a_100000766300_200010214485 [0,2,0,0,0,0|1,0,0]=3 10392 B14R1.907 COCSCc1ccc(c(c1)OC)Cl 62a_200010214485_100000766300 [0,2,0,0,0,0|1,0,0]=3 10393 B14R1.907 COCSCc1ccc(c(c1)OC)F 62a_100000766300_100012349856 [0,2,0,0,0,0|1,0,0]=3 10394 B14R1.907 COCSCc1ccc(c(c1)OC)F 62a_100012349856_100000766300 [0,2,0,0,0,0|1,0,0]=3 10395 B14R1.907 COCSCc1ccc(c(n1)OC)Br 62a_100000766300_200010066506 [0,2,0,0,0,0|2,0,0]=4 10396 B14R1.907 COCSCc1ccc(c(n1)OC)Br 62a_200010066506_100000766300 [0,2,0,0,0,0|2,0,0]=4 10397 B14R1.907 COc1cc(c[nH]c1=O)SCCCF 62a_100011934791_100010125397 [0,2,0,0,0,0|1,0,1]=4 10398 B14R1.907 COc1cc(c[nH]c1=O)SCCCO 62a_100011215043_100010125397 [0,2,0,0,0,0|1,0,1]=4 10399 B14R1.907 COc1cc(c[nH]c1=O)SCCSC 62a_100000212216_100010125397 [0,2,0,0,0,0|1,0,1]=4 10400 B14R1.907 COc1cc(ccc1Br)CNCCF 34a_100000724931_100010110085 [0,2,0,0,0,0|1,0,0]=3 10401 B14R1.907 COc1cc(ccc1Br)CNCCO 207a_100000210304_100010244714 [0,2,0,0,0,0|1,0,0]=3 10402 B14R1.907 COc1cc(ccc1Br)CNCCO 2230a_100016997473_100010110085 [0,2,0,0,0,0|1,0,0]=3 10403 B14R1.907 COc1cc(ccc1Br)CNCCO 270004a_100000210304_100010244714 [0,2,0,0,0,0|1,0,0]=3 10404 B14R1.907 COc1cc(ccc1Br)CNCCO 34a_100016990907_100010110085 [0,2,0,0,0,0|1,0,0]=3 10405 B14R1.907 COc1cc(ccc1Br)COCC#N 7a_100010234685_100011215382 [0,2,0,0,0,0|1,0,1]=4 10406 B14R1.907 COc1cc(ccc1Br)COCC=O 34a_100010234685_200009817547 [0,2,0,0,0,0|1,0,1]=4 10407 B14R1.907 COc1cc(ccc1Br)COCC=O 7a_100010234685_200015260668 [0,2,0,0,0,0|1,0,1]=4 10408 B14R1.907 COc1cc(ccc1Br)COCCBr 34a_100000211926_100010110085 [0,2,0,0,0,0|1,0,0]=3 10409 B14R1.907 COc1cc(ccc1Br)COCCF 34a_100010234685_100011217306 [0,2,0,0,0,0|1,0,0]=3 10410 B14R1.907 COc1cc(ccc1Br)COCCF 7a_100010234685_100011217306 [0,2,0,0,0,0|1,0,0]=3 10411 B14R1.907 COc1cc(ccc1Br)COCCN 34a_100000210304_100010110085 [0,2,0,0,0,0|1,0,0]=3 10412 B14R1.907 COc1cc(ccc1Br)COCCO 34a_100010234685_100000211926 [0,2,0,0,0,0|1,0,0]=3 10413 B14R1.907 COc1cc(ccc1Br)COCCO 7a_100010234685_100000211926 [0,2,0,0,0,0|1,0,0]=3 10414 B14R1.907 COc1cc(ccc1Br)COCSC 34a_100010234685_100011218213 [0,2,0,0,0,0|1,0,0]=3 10415 B14R1.907 COc1cc(ccc1Br)CSCC#N 62a_100010110085_100011215382 [0,2,0,0,0,0|1,0,1]=4 10416 B14R1.907 COc1cc(ccc1Br)CSCC#N 62a_100011215382_100010110085 [0,2,0,0,0,0|1,0,1]=4 10417 B14R1.907 COc1cc(ccc1Br)CSCC=O 62a_100010110085_200015260668 [0,2,0,0,0,0|1,0,1]=4 10418 B14R1.907 COc1cc(ccc1Br)CSCC=O 62a_200015260668_100010110085 [0,2,0,0,0,0|1,0,1]=4 10419 B14R1.907 COc1cc(ccc1Br)CSCCF 62a_100010110085_100011217306 [0,2,0,0,0,0|1,0,0]=3 10420 B14R1.907 COc1cc(ccc1Br)CSCCF 62a_100011217306_100010110085 [0,2,0,0,0,0|1,0,0]=3 10421 B14R1.907 COc1cc(ccc1Br)CSCCO 62a_100000211926_100010110085 [0,2,0,0,0,0|1,0,0]=3 10422 B14R1.907 COc1cc(ccc1Br)CSCCO 62a_100010110085_100000211926 [0,2,0,0,0,0|1,0,0]=3 10423 B14R1.907 COc1cc(ccc1Br)CSCSC 62a_100010110085_100011218213 [0,2,0,0,0,0|1,0,0]=3 10424 B14R1.907 COc1cc(ccc1Br)CSCSC 62a_100011218213_100010110085 [0,2,0,0,0,0|1,0,0]=3 10425 B14R1.907 COc1cc(ccc1Br)NCCC#N 2230a_100000765947_100011215226 [0,2,0,0,0,0|1,0,1]=4 10426 B14R1.907 COc1cc(ccc1Br)NCCCF 2230a_100000765947_100011934791 [0,2,0,0,0,0|1,0,0]=3 10427 B14R1.907 COc1cc(ccc1Br)NCCCF 34a_100000765947_100011934791 [0,2,0,0,0,0|1,0,0]=3 10428 B14R1.907 COc1cc(ccc1Br)NCCCO 2230a_100000765947_100000230001 [0,2,0,0,0,0|1,0,0]=3 10429 B14R1.907 COc1cc(ccc1Br)NCCCO 34a_100000765947_100000230001 [0,2,0,0,0,0|1,0,0]=3 10430 B14R1.907 COc1cc(ccc1Br)NCCSC 2230a_100000765947_100000751147 [0,2,0,0,0,0|1,0,0]=3 10431 B14R1.907 COc1cc(ccc1Br)NCCSC 34a_100000765947_100000212216 [0,2,0,0,0,0|1,0,0]=3 10432 B14R1.907 COc1cc(ccc1Br)OCCC#N 7a_100011827694_100000184422 [0,2,0,0,0,0|1,0,1]=4 10433 B14R1.907 COc1cc(ccc1Br)OCCCF 34a_100011827694_100011934791 [0,2,0,0,0,0|1,0,0]=3 10434 B14R1.907 COc1cc(ccc1Br)OCCCF 7a_100011827694_100011934791 [0,2,0,0,0,0|1,0,0]=3 10435 B14R1.907 COc1cc(ccc1Br)OCCCO 34a_100011827694_100000230001 [0,2,0,0,0,0|1,0,0]=3 10436 B14R1.907 COc1cc(ccc1Br)OCCCO 7a_100011827694_100011215043 [0,2,0,0,0,0|1,0,0]=3 10437 B14R1.907 COc1cc(ccc1Br)OCCSC 34a_100011827694_100000212216 [0,2,0,0,0,0|1,0,0]=3 10438 B14R1.907 COc1cc(ccc1Br)OCCSC 7a_100011827694_100000212216 [0,2,0,0,0,0|1,0,0]=3 10439 B14R1.907 COc1cc(ccc1Br)SCCC#N 62a_100011215226_100012353699 [0,2,0,0,0,0|1,0,1]=4 10440 B14R1.907 COc1cc(ccc1Br)SCCC#N 62a_100012353699_100011215226 [0,2,0,0,0,0|1,0,1]=4 10441 B14R1.907 COc1cc(ccc1Br)SCCCF 62a_100011934791_100012353699 [0,2,0,0,0,0|1,0,0]=3 10442 B14R1.907 COc1cc(ccc1Br)SCCCF 62a_100012353699_100011934791 [0,2,0,0,0,0|1,0,0]=3 10443 B14R1.907 COc1cc(ccc1Br)SCCCO 62a_100011215043_100012353699 [0,2,0,0,0,0|1,0,0]=3 10444 B14R1.907 COc1cc(ccc1Br)SCCCO 62a_100012353699_100011215043 [0,2,0,0,0,0|1,0,0]=3 10445 B14R1.907 COc1cc(ccc1Br)SCCSC 62a_100000212216_100012353699 [0,2,0,0,0,0|1,0,0]=3 10446 B14R1.907 COc1cc(ccc1Br)SCCSC 62a_100012353699_100000751147 [0,2,0,0,0,0|1,0,0]=3 10447 B14R1.907 COc1cc(ccc1C)CNCCO 207a_100000210304_100000719150 [0,2,0,0,0,0|1,0,0]=3 10448 B14R1.907 COc1cc(ccc1C)CNCCO 270004a_100000210304_100000719150 [0,2,0,0,0,0|1,0,0]=3 10449 B14R1.907 COc1cc(ccc1C)COCC#N 7a_100000752651_100011215382 [0,2,0,0,0,0|1,0,1]=4 10450 B14R1.907 COc1cc(ccc1C)COCC=O 34a_100000752651_200009817547 [0,2,0,0,0,0|1,0,1]=4 10451 B14R1.907 COc1cc(ccc1C)COCC=O 7a_100000752651_200015260668 [0,2,0,0,0,0|1,0,1]=4 10452 B14R1.907 COc1cc(ccc1C)COCCF 34a_100000752651_100011217306 [0,2,0,0,0,0|1,0,0]=3 10453 B14R1.907 COc1cc(ccc1C)COCCF 7a_100000752651_100011217306 [0,2,0,0,0,0|1,0,0]=3 10454 B14R1.907 COc1cc(ccc1C)COCCO 34a_100000752651_100000211926 [0,2,0,0,0,0|1,0,0]=3 10455 B14R1.907 COc1cc(ccc1C)COCCO 7a_100000752651_100000211926 [0,2,0,0,0,0|1,0,0]=3 10456 B14R1.907 COc1cc(ccc1C)COCSC 34a_100000752651_100011218213 [0,2,0,0,0,0|1,0,0]=3 10457 B14R1.907 COc1cc(ccc1C)NCCC#N 2230a_100011279678_100011215226 [0,2,0,0,0,0|1,0,1]=4 10458 B14R1.907 COc1cc(ccc1C)NCCCF 2230a_100011279678_100011934791 [0,2,0,0,0,0|1,0,0]=3 10459 B14R1.907 COc1cc(ccc1C)NCCCF 34a_100011279678_100011934791 [0,2,0,0,0,0|1,0,0]=3 10460 B14R1.907 COc1cc(ccc1C)NCCCO 2230a_100011279678_100000230001 [0,2,0,0,0,0|1,0,0]=3 10461 B14R1.907 COc1cc(ccc1C)NCCCO 34a_100011279678_100000230001 [0,2,0,0,0,0|1,0,0]=3 10462 B14R1.907 COc1cc(ccc1C)NCCSC 2230a_100011279678_100000751147 [0,2,0,0,0,0|1,0,0]=3 10463 B14R1.907 COc1cc(ccc1C)NCCSC 34a_100011279678_100000212216 [0,2,0,0,0,0|1,0,0]=3 10464 B14R1.907 COc1cc(ccc1C)OCCC#N 7a_100009865632_100000184422 [0,2,0,0,0,0|1,0,1]=4 10465 B14R1.907 COc1cc(ccc1C)OCCCF 34a_100009865632_100011934791 [0,2,0,0,0,0|1,0,0]=3 10466 B14R1.907 COc1cc(ccc1C)OCCCF 7a_100009865632_100011934791 [0,2,0,0,0,0|1,0,0]=3 10467 B14R1.907 COc1cc(ccc1C)OCCCO 34a_100009865632_100000230001 [0,2,0,0,0,0|1,0,0]=3 10468 B14R1.907 COc1cc(ccc1C)OCCCO 7a_100009865632_100011215043 [0,2,0,0,0,0|1,0,0]=3 10469 B14R1.907 COc1cc(ccc1C)OCCSC 34a_100009865632_100000212216 [0,2,0,0,0,0|1,0,0]=3 10470 B14R1.907 COc1cc(ccc1C)OCCSC 7a_100009865632_100000212216 [0,2,0,0,0,0|1,0,0]=3 10471 B14R1.907 COc1cc(ccc1C)SCCC#N 62a_100011215226_100011830276 [0,2,0,0,0,0|1,0,1]=4 10472 B14R1.907 COc1cc(ccc1C)SCCC#N 62a_100011830276_100011215226 [0,2,0,0,0,0|1,0,1]=4 10473 B14R1.907 COc1cc(ccc1C)SCCCF 62a_100011830276_100011934791 [0,2,0,0,0,0|1,0,0]=3 10474 B14R1.907 COc1cc(ccc1C)SCCCF 62a_100011934791_100011830276 [0,2,0,0,0,0|1,0,0]=3 10475 B14R1.907 COc1cc(ccc1C)SCCCO 62a_100011215043_100011830276 [0,2,0,0,0,0|1,0,0]=3 10476 B14R1.907 COc1cc(ccc1C)SCCCO 62a_100011830276_100011215043 [0,2,0,0,0,0|1,0,0]=3 10477 B14R1.907 COc1cc(ccc1C)SCCSC 62a_100000212216_100011830276 [0,2,0,0,0,0|1,0,0]=3 10478 B14R1.907 COc1cc(ccc1C)SCCSC 62a_100011830276_100000751147 [0,2,0,0,0,0|1,0,0]=3 10479 B14R1.907 COc1cc(ccc1Cl)CNCC#N 2230a_100015204853_100011215382 [0,2,0,0,0,0|1,0,1]=4 10480 B14R1.907 COc1cc(ccc1Cl)CNCC=O 2230a_100015204853_200015260668 [0,2,0,0,0,0|1,0,1]=4 10481 B14R1.907 COc1cc(ccc1Cl)CNCC=O 34a_100015204853_200009817547 [0,2,0,0,0,0|1,0,1]=4 10482 B14R1.907 COc1cc(ccc1Cl)CNCCF 2230a_100015204853_100011217306 [0,2,0,0,0,0|1,0,0]=3 10483 B14R1.907 COc1cc(ccc1Cl)CNCCF 34a_100000724931_200010214485 [0,2,0,0,0,0|1,0,0]=3 10484 B14R1.907 COc1cc(ccc1Cl)CNCCF 34a_100015204853_100011217306 [0,2,0,0,0,0|1,0,0]=3 10485 B14R1.907 COc1cc(ccc1Cl)CNCCO 207a_100000210304_100011998524 [0,2,0,0,0,0|1,0,0]=3 10486 B14R1.907 COc1cc(ccc1Cl)CNCCO 2230a_100015204853_100000211926 [0,2,0,0,0,0|1,0,0]=3 10487 B14R1.907 COc1cc(ccc1Cl)CNCCO 2230a_100016997473_200010214485 [0,2,0,0,0,0|1,0,0]=3 10488 B14R1.907 COc1cc(ccc1Cl)CNCCO 270004a_100000210304_100011998524 [0,2,0,0,0,0|1,0,0]=3 10489 B14R1.907 COc1cc(ccc1Cl)CNCCO 34a_100015204853_100000211926 [0,2,0,0,0,0|1,0,0]=3 10490 B14R1.907 COc1cc(ccc1Cl)CNCCO 34a_100016990907_200010214485 [0,2,0,0,0,0|1,0,0]=3 10491 B14R1.907 COc1cc(ccc1Cl)CNCSC 2230a_100015204853_100011218213 [0,2,0,0,0,0|1,0,0]=3 10492 B14R1.907 COc1cc(ccc1Cl)CNCSC 34a_100015204853_100011218213 [0,2,0,0,0,0|1,0,0]=3 10493 B14R1.907 COc1cc(ccc1Cl)COCC=O 34a_100012179228_200009817547 [0,2,0,0,0,0|1,0,1]=4 10494 B14R1.907 COc1cc(ccc1Cl)COCCBr 34a_100000211926_200010214485 [0,2,0,0,0,0|1,0,0]=3 10495 B14R1.907 COc1cc(ccc1Cl)COCCF 34a_100012179228_100011217306 [0,2,0,0,0,0|1,0,0]=3 10496 B14R1.907 COc1cc(ccc1Cl)COCCN 34a_100000210304_200010214485 [0,2,0,0,0,0|1,0,0]=3 10497 B14R1.907 COc1cc(ccc1Cl)COCCO 34a_100012179228_100000211926 [0,2,0,0,0,0|1,0,0]=3 10498 B14R1.907 COc1cc(ccc1Cl)COCSC 34a_100012179228_100011218213 [0,2,0,0,0,0|1,0,0]=3 10499 B14R1.907 COc1cc(ccc1Cl)CSCC#N 62a_100011215382_200010214485 [0,2,0,0,0,0|1,0,1]=4 10500 B14R1.907 COc1cc(ccc1Cl)CSCC#N 62a_200010214485_100011215382 [0,2,0,0,0,0|1,0,1]=4 10501 B14R1.907 COc1cc(ccc1Cl)CSCC=O 62a_200010214485_200015260668 [0,2,0,0,0,0|1,0,1]=4 10502 B14R1.907 COc1cc(ccc1Cl)CSCC=O 62a_200015260668_200010214485 [0,2,0,0,0,0|1,0,1]=4 10503 B14R1.907 COc1cc(ccc1Cl)CSCCF 62a_100011217306_200010214485 [0,2,0,0,0,0|1,0,0]=3 10504 B14R1.907 COc1cc(ccc1Cl)CSCCF 62a_200010214485_100011217306 [0,2,0,0,0,0|1,0,0]=3 10505 B14R1.907 COc1cc(ccc1Cl)CSCCO 62a_100000211926_200010214485 [0,2,0,0,0,0|1,0,0]=3 10506 B14R1.907 COc1cc(ccc1Cl)CSCCO 62a_200010214485_100000211926 [0,2,0,0,0,0|1,0,0]=3 10507 B14R1.907 COc1cc(ccc1Cl)CSCSC 62a_100011218213_200010214485 [0,2,0,0,0,0|1,0,0]=3 10508 B14R1.907 COc1cc(ccc1Cl)CSCSC 62a_200010214485_100011218213 [0,2,0,0,0,0|1,0,0]=3 10509 B14R1.907 COc1cc(ccc1Cl)NCCC#N 2230a_100000742311_100011215226 [0,2,0,0,0,0|1,0,1]=4 10510 B14R1.907 COc1cc(ccc1Cl)NCCCF 2230a_100000742311_100011934791 [0,2,0,0,0,0|1,0,0]=3 10511 B14R1.907 COc1cc(ccc1Cl)NCCCF 34a_100000742311_100011934791 [0,2,0,0,0,0|1,0,0]=3 10512 B14R1.907 COc1cc(ccc1Cl)NCCCO 2230a_100000742311_100000230001 [0,2,0,0,0,0|1,0,0]=3 10513 B14R1.907 COc1cc(ccc1Cl)NCCCO 34a_100000742311_100000230001 [0,2,0,0,0,0|1,0,0]=3 10514 B14R1.907 COc1cc(ccc1Cl)NCCSC 2230a_100000742311_100000751147 [0,2,0,0,0,0|1,0,0]=3 10515 B14R1.907 COc1cc(ccc1Cl)NCCSC 34a_100000742311_100000212216 [0,2,0,0,0,0|1,0,0]=3 10516 B14R1.907 COc1cc(ccc1Cl)OCCC#N 7a_100012186310_100000184422 [0,2,0,0,0,0|1,0,1]=4 10517 B14R1.907 COc1cc(ccc1Cl)OCCCF 34a_100012186310_100011934791 [0,2,0,0,0,0|1,0,0]=3 10518 B14R1.907 COc1cc(ccc1Cl)OCCCF 7a_100012186310_100011934791 [0,2,0,0,0,0|1,0,0]=3 10519 B14R1.907 COc1cc(ccc1Cl)OCCCO 34a_100012186310_100000230001 [0,2,0,0,0,0|1,0,0]=3 10520 B14R1.907 COc1cc(ccc1Cl)OCCCO 7a_100012186310_100011215043 [0,2,0,0,0,0|1,0,0]=3 10521 B14R1.907 COc1cc(ccc1Cl)OCCSC 34a_100012186310_100000212216 [0,2,0,0,0,0|1,0,0]=3 10522 B14R1.907 COc1cc(ccc1Cl)OCCSC 7a_100012186310_100000212216 [0,2,0,0,0,0|1,0,0]=3 10523 B14R1.907 COc1cc(ccc1Cl)SCCC#N 62a_100011215226_100011356853 [0,2,0,0,0,0|1,0,1]=4 10524 B14R1.907 COc1cc(ccc1Cl)SCCC#N 62a_100011356853_100011215226 [0,2,0,0,0,0|1,0,1]=4 10525 B14R1.907 COc1cc(ccc1Cl)SCCCF 62a_100011356853_100011934791 [0,2,0,0,0,0|1,0,0]=3 10526 B14R1.907 COc1cc(ccc1Cl)SCCCF 62a_100011934791_100011356853 [0,2,0,0,0,0|1,0,0]=3 10527 B14R1.907 COc1cc(ccc1Cl)SCCCO 62a_100011215043_100011356853 [0,2,0,0,0,0|1,0,0]=3 10528 B14R1.907 COc1cc(ccc1Cl)SCCCO 62a_100011356853_100011215043 [0,2,0,0,0,0|1,0,0]=3 10529 B14R1.907 COc1cc(ccc1Cl)SCCSC 62a_100000212216_100011356853 [0,2,0,0,0,0|1,0,0]=3 10530 B14R1.907 COc1cc(ccc1Cl)SCCSC 62a_100011356853_100000751147 [0,2,0,0,0,0|1,0,0]=3 10531 B14R1.907 COc1cc(ccc1F)CNCC#N 2230a_100020626639_100011215382 [0,2,0,0,0,0|1,0,1]=4 10532 B14R1.907 COc1cc(ccc1F)CNCC=O 2230a_100020626639_200015260668 [0,2,0,0,0,0|1,0,1]=4 10533 B14R1.907 COc1cc(ccc1F)CNCC=O 34a_100020626639_200009817547 [0,2,0,0,0,0|1,0,1]=4 10534 B14R1.907 COc1cc(ccc1F)CNCCF 2230a_100020626639_100011217306 [0,2,0,0,0,0|1,0,0]=3 10535 B14R1.907 COc1cc(ccc1F)CNCCF 34a_100000724931_100012349856 [0,2,0,0,0,0|1,0,0]=3 10536 B14R1.907 COc1cc(ccc1F)CNCCF 34a_100020626639_100011217306 [0,2,0,0,0,0|1,0,0]=3 10537 B14R1.907 COc1cc(ccc1F)CNCCO 207a_100000210304_100000692873 [0,2,0,0,0,0|1,0,0]=3 10538 B14R1.907 COc1cc(ccc1F)CNCCO 2230a_100016997473_100012349856 [0,2,0,0,0,0|1,0,0]=3 10539 B14R1.907 COc1cc(ccc1F)CNCCO 2230a_100020626639_100000211926 [0,2,0,0,0,0|1,0,0]=3 10540 B14R1.907 COc1cc(ccc1F)CNCCO 270004a_100000210304_100000692873 [0,2,0,0,0,0|1,0,0]=3 10541 B14R1.907 COc1cc(ccc1F)CNCCO 34a_100016990907_100012349856 [0,2,0,0,0,0|1,0,0]=3 10542 B14R1.907 COc1cc(ccc1F)CNCCO 34a_100020626639_100000211926 [0,2,0,0,0,0|1,0,0]=3 10543 B14R1.907 COc1cc(ccc1F)CNCSC 2230a_100020626639_100011218213 [0,2,0,0,0,0|1,0,0]=3 10544 B14R1.907 COc1cc(ccc1F)CNCSC 34a_100020626639_100011218213 [0,2,0,0,0,0|1,0,0]=3 10545 B14R1.907 COc1cc(ccc1F)COCC#N 7a_100000692429_100011215382 [0,2,0,0,0,0|1,0,1]=4 10546 B14R1.907 COc1cc(ccc1F)COCC=O 34a_100000692429_200009817547 [0,2,0,0,0,0|1,0,1]=4 10547 B14R1.907 COc1cc(ccc1F)COCC=O 7a_100000692429_200015260668 [0,2,0,0,0,0|1,0,1]=4 10548 B14R1.907 COc1cc(ccc1F)COCCBr 34a_100000211926_100012349856 [0,2,0,0,0,0|1,0,0]=3 10549 B14R1.907 COc1cc(ccc1F)COCCF 34a_100000692429_100011217306 [0,2,0,0,0,0|1,0,0]=3 10550 B14R1.907 COc1cc(ccc1F)COCCF 7a_100000692429_100011217306 [0,2,0,0,0,0|1,0,0]=3 10551 B14R1.907 COc1cc(ccc1F)COCCN 34a_100000210304_100012349856 [0,2,0,0,0,0|1,0,0]=3 10552 B14R1.907 COc1cc(ccc1F)COCCO 34a_100000692429_100000211926 [0,2,0,0,0,0|1,0,0]=3 10553 B14R1.907 COc1cc(ccc1F)COCCO 7a_100000692429_100000211926 [0,2,0,0,0,0|1,0,0]=3 10554 B14R1.907 COc1cc(ccc1F)COCSC 34a_100000692429_100011218213 [0,2,0,0,0,0|1,0,0]=3 10555 B14R1.907 COc1cc(ccc1F)CSCC#N 62a_100011215382_100012349856 [0,2,0,0,0,0|1,0,1]=4 10556 B14R1.907 COc1cc(ccc1F)CSCC#N 62a_100012349856_100011215382 [0,2,0,0,0,0|1,0,1]=4 10557 B14R1.907 COc1cc(ccc1F)CSCC=O 62a_100012349856_200015260668 [0,2,0,0,0,0|1,0,1]=4 10558 B14R1.907 COc1cc(ccc1F)CSCC=O 62a_200015260668_100012349856 [0,2,0,0,0,0|1,0,1]=4 10559 B14R1.907 COc1cc(ccc1F)CSCCF 62a_100011217306_100012349856 [0,2,0,0,0,0|1,0,0]=3 10560 B14R1.907 COc1cc(ccc1F)CSCCF 62a_100012349856_100011217306 [0,2,0,0,0,0|1,0,0]=3 10561 B14R1.907 COc1cc(ccc1F)CSCCO 62a_100000211926_100012349856 [0,2,0,0,0,0|1,0,0]=3 10562 B14R1.907 COc1cc(ccc1F)CSCCO 62a_100012349856_100000211926 [0,2,0,0,0,0|1,0,0]=3 10563 B14R1.907 COc1cc(ccc1F)CSCSC 62a_100011218213_100012349856 [0,2,0,0,0,0|1,0,0]=3 10564 B14R1.907 COc1cc(ccc1F)CSCSC 62a_100012349856_100011218213 [0,2,0,0,0,0|1,0,0]=3 10565 B14R1.907 COc1cc(ccc1F)NCCC#N 2230a_100000701188_100011215226 [0,2,0,0,0,0|1,0,1]=4 10566 B14R1.907 COc1cc(ccc1F)NCCCF 2230a_100000701188_100011934791 [0,2,0,0,0,0|1,0,0]=3 10567 B14R1.907 COc1cc(ccc1F)NCCCF 34a_100000701188_100011934791 [0,2,0,0,0,0|1,0,0]=3 10568 B14R1.907 COc1cc(ccc1F)NCCCO 2230a_100000701188_100000230001 [0,2,0,0,0,0|1,0,0]=3 10569 B14R1.907 COc1cc(ccc1F)NCCCO 34a_100000701188_100000230001 [0,2,0,0,0,0|1,0,0]=3 10570 B14R1.907 COc1cc(ccc1F)NCCSC 2230a_100000701188_100000751147 [0,2,0,0,0,0|1,0,0]=3 10571 B14R1.907 COc1cc(ccc1F)NCCSC 34a_100000701188_100000212216 [0,2,0,0,0,0|1,0,0]=3 10572 B14R1.907 COc1cc(ccc1F)OCCC#N 7a_100012001760_100000184422 [0,2,0,0,0,0|1,0,1]=4 10573 B14R1.907 COc1cc(ccc1F)OCCCF 34a_100012001760_100011934791 [0,2,0,0,0,0|1,0,0]=3 10574 B14R1.907 COc1cc(ccc1F)OCCCF 7a_100012001760_100011934791 [0,2,0,0,0,0|1,0,0]=3 10575 B14R1.907 COc1cc(ccc1F)OCCCO 34a_100012001760_100000230001 [0,2,0,0,0,0|1,0,0]=3 10576 B14R1.907 COc1cc(ccc1F)OCCCO 7a_100012001760_100011215043 [0,2,0,0,0,0|1,0,0]=3 10577 B14R1.907 COc1cc(ccc1F)OCCSC 34a_100012001760_100000212216 [0,2,0,0,0,0|1,0,0]=3 10578 B14R1.907 COc1cc(ccc1F)OCCSC 7a_100012001760_100000212216 [0,2,0,0,0,0|1,0,0]=3 10579 B14R1.907 COc1cc(ccc1F)SCCC#N 62a_100011215226_100011934186 [0,2,0,0,0,0|1,0,1]=4 10580 B14R1.907 COc1cc(ccc1F)SCCC#N 62a_100011934186_100011215226 [0,2,0,0,0,0|1,0,1]=4 10581 B14R1.907 COc1cc(ccc1F)SCCCF 62a_100011934186_100011934791 [0,2,0,0,0,0|1,0,0]=3 10582 B14R1.907 COc1cc(ccc1F)SCCCF 62a_100011934791_100011934186 [0,2,0,0,0,0|1,0,0]=3 10583 B14R1.907 COc1cc(ccc1F)SCCCO 62a_100011215043_100011934186 [0,2,0,0,0,0|1,0,0]=3 10584 B14R1.907 COc1cc(ccc1F)SCCCO 62a_100011934186_100011215043 [0,2,0,0,0,0|1,0,0]=3 10585 B14R1.907 COc1cc(ccc1F)SCCSC 62a_100000212216_100011934186 [0,2,0,0,0,0|1,0,0]=3 10586 B14R1.907 COc1cc(ccc1F)SCCSC 62a_100011934186_100000751147 [0,2,0,0,0,0|1,0,0]=3 10587 B14R1.907 COc1cc(ccc1I)NCCCF 34a_100000746945_100011934791 [0,2,0,0,0,0|1,0,0]=3 10588 B14R1.907 COc1cc(ccc1I)NCCCO 34a_100000746945_100000230001 [0,2,0,0,0,0|1,0,0]=3 10589 B14R1.907 COc1cc(ccc1I)NCCSC 34a_100000746945_100000212216 [0,2,0,0,0,0|1,0,0]=3 10590 B14R1.907 COc1cc(ccc1N)COCC=O 34a_100000087641_200009817547 [0,2,0,0,0,0|1,0,1]=4 10591 B14R1.907 COc1cc(ccc1N)COCCF 34a_100000087641_100011217306 [0,2,0,0,0,0|1,0,0]=3 10592 B14R1.907 COc1cc(ccc1N)COCCO 34a_100000087641_100000211926 [0,2,0,0,0,0|1,0,0]=3 10593 B14R1.907 COc1cc(ccc1N)COCSC 34a_100000087641_100011218213 [0,2,0,0,0,0|1,0,0]=3 10594 B14R1.907 COc1cc(ccc1N)OCCC#N 7a_100015326901_100000184422 [0,2,0,0,0,0|1,0,1]=4 10595 B14R1.907 COc1cc(ccc1N)OCCCF 34a_100015326901_100011934791 [0,2,0,0,0,0|1,0,0]=3 10596 B14R1.907 COc1cc(ccc1N)OCCCF 7a_100015326901_100011934791 [0,2,0,0,0,0|1,0,0]=3 10597 B14R1.907 COc1cc(ccc1N)OCCCO 34a_100015326901_100000230001 [0,2,0,0,0,0|1,0,0]=3 10598 B14R1.907 COc1cc(ccc1N)OCCCO 7a_100015326901_100011215043 [0,2,0,0,0,0|1,0,0]=3 10599 B14R1.907 COc1cc(ccc1N)OCCSC 34a_100015326901_100000212216 [0,2,0,0,0,0|1,0,0]=3 10600 B14R1.907 COc1cc(ccc1N)OCCSC 7a_100015326901_100000212216 [0,2,0,0,0,0|1,0,0]=3 10601 B14R1.907 COc1cc(ccc1N)SCCC#N 62a_100011215226_100015196925 [0,2,0,0,0,0|1,0,1]=4 10602 B14R1.907 COc1cc(ccc1N)SCCC#N 62a_100011279103_100011215226 [0,2,0,0,0,0|1,0,1]=4 10603 B14R1.907 COc1cc(ccc1N)SCCCF 62a_100011279103_100011934791 [0,2,0,0,0,0|1,0,0]=3 10604 B14R1.907 COc1cc(ccc1N)SCCCF 62a_100011934791_100015196925 [0,2,0,0,0,0|1,0,0]=3 10605 B14R1.907 COc1cc(ccc1N)SCCCO 62a_100011215043_100015196925 [0,2,0,0,0,0|1,0,0]=3 10606 B14R1.907 COc1cc(ccc1N)SCCCO 62a_100011279103_100011215043 [0,2,0,0,0,0|1,0,0]=3 10607 B14R1.907 COc1cc(ccc1N)SCCSC 62a_100000212216_100015196925 [0,2,0,0,0,0|1,0,0]=3 10608 B14R1.907 COc1cc(ccc1N)SCCSC 62a_100011279103_100000751147 [0,2,0,0,0,0|1,0,0]=3 10609 B14R1.907 COc1cc(ccc1O)CCNCF 34a_100000756042_100015361967 [0,2,0,0,0,0|0,0,0]=2 10610 B14R1.907 COc1cc(ccc1O)CCSCF 62a_100015361967_100010741665 [0,2,0,0,0,0|0,0,0]=2 10611 B14R1.907 COc1cc(ccc1O)CNCC=O 34a_100000185554_200009817547 [0,2,0,0,0,0|0,0,1]=3 10612 B14R1.907 COc1cc(ccc1O)CNCCF 34a_100000185554_100011217306 [0,2,0,0,0,0|0,0,0]=2 10613 B14R1.907 COc1cc(ccc1O)CNCCO 34a_100000185554_100000211926 [0,2,0,0,0,0|0,0,0]=2 10614 B14R1.907 COc1cc(ccc1O)CNCSC 34a_100000185554_100011218213 [0,2,0,0,0,0|0,0,0]=2 10615 B14R1.907 COc1cc(ccc1O)NCCCF 34a_100000726020_100011934791 [0,2,0,0,0,0|0,0,0]=2 10616 B14R1.907 COc1cc(ccc1O)NCCCO 34a_100000726020_100000230001 [0,2,0,0,0,0|0,0,0]=2 10617 B14R1.907 COc1cc(ccc1O)NCCSC 34a_100000726020_100000212216 [0,2,0,0,0,0|0,0,0]=2 10618 B14R1.907 COc1cc(ccc1O)SCCC#N 62a_100011215226_100000694246 [0,2,0,0,0,0|0,0,1]=3 10619 B14R1.907 COc1cc(ccc1O)SCCCF 62a_100011934791_100000694246 [0,2,0,0,0,0|0,0,0]=2 10620 B14R1.907 COc1cc(ccc1O)SCCCO 62a_100011215043_100000694246 [0,2,0,0,0,0|0,0,0]=2 10621 B14R1.907 COc1cc(ccc1O)SCCSC 62a_100000212216_100000694246 [0,2,0,0,0,0|0,0,0]=2 10622 B14R1.907 COc1cc(ccc1O)SCSC#N 62a_100000211825_100000694246 [0,2,0,0,0,0|1,0,1]=4 10623 B14R1.907 COc1cc(cnc1C)SCCCF 62a_100010254219_100011934791 [0,2,0,0,0,0|2,0,0]=4 10624 B14R1.907 COc1cc(cnc1C)SCCCF 62a_100011934791_100010254219 [0,2,0,0,0,0|2,0,0]=4 10625 B14R1.907 COc1cc(cnc1C)SCCCO 62a_100010254219_100011215043 [0,2,0,0,0,0|2,0,0]=4 10626 B14R1.907 COc1cc(cnc1C)SCCCO 62a_100011215043_100010254219 [0,2,0,0,0,0|2,0,0]=4 10627 B14R1.907 COc1cc(cnc1C)SCCSC 62a_100000212216_100010254219 [0,2,0,0,0,0|2,0,0]=4 10628 B14R1.907 COc1cc(cnc1C)SCCSC 62a_100010254219_100000751147 [0,2,0,0,0,0|2,0,0]=4 10629 B14R1.907 COc1cc(cnc1F)SCCCF 62a_100010214931_100011934791 [0,2,0,0,0,0|2,0,0]=4 10630 B14R1.907 COc1cc(cnc1F)SCCCF 62a_100011934791_100010214931 [0,2,0,0,0,0|2,0,0]=4 10631 B14R1.907 COc1cc(cnc1F)SCCCO 62a_100010214931_100011215043 [0,2,0,0,0,0|2,0,0]=4 10632 B14R1.907 COc1cc(cnc1F)SCCCO 62a_100011215043_100010214931 [0,2,0,0,0,0|2,0,0]=4 10633 B14R1.907 COc1cc(cnc1F)SCCSC 62a_100000212216_100010214931 [0,2,0,0,0,0|2,0,0]=4 10634 B14R1.907 COc1cc(cnc1F)SCCSC 62a_100010214931_100000751147 [0,2,0,0,0,0|2,0,0]=4 10635 B14R1.907 COc1cc(cnc1N)SCCCF 62a_100011934791_106354213024 [0,2,0,0,0,0|2,0,0]=4 10636 B14R1.907 COc1cc(cnc1N)SCCCF 62a_106354213024_100011934791 [0,2,0,0,0,0|2,0,0]=4 10637 B14R1.907 COc1cc(cnc1N)SCCCO 62a_100011215043_106354213024 [0,2,0,0,0,0|2,0,0]=4 10638 B14R1.907 COc1cc(cnc1N)SCCCO 62a_106354213024_100011215043 [0,2,0,0,0,0|2,0,0]=4 10639 B14R1.907 COc1cc(cnc1N)SCCSC 62a_100000212216_106354213024 [0,2,0,0,0,0|2,0,0]=4 10640 B14R1.907 COc1cc(cnc1N)SCCSC 62a_106354213024_100000751147 [0,2,0,0,0,0|2,0,0]=4 10641 B14R1.907 COc1cc(ncc1Br)COCCF 34a_100010999569_100011217306 [0,2,0,0,0,0|2,0,0]=4 10642 B14R1.907 COc1cc(ncc1Br)COCCO 34a_100010999569_100000211926 [0,2,0,0,0,0|2,0,0]=4 10643 B14R1.907 COc1cc(ncc1Br)COCSC 34a_100010999569_100011218213 [0,2,0,0,0,0|2,0,0]=4 10644 B14R1.907 COc1cc(ncc1C)SCCCF 62a_100010067687_100011934791 [0,2,0,0,0,0|2,0,0]=4 10645 B14R1.907 COc1cc(ncc1C)SCCCF 62a_100011934791_100010067687 [0,2,0,0,0,0|2,0,0]=4 10646 B14R1.907 COc1cc(ncc1C)SCCCO 62a_100010067687_100011215043 [0,2,0,0,0,0|2,0,0]=4 10647 B14R1.907 COc1cc(ncc1C)SCCCO 62a_100011215043_100010067687 [0,2,0,0,0,0|2,0,0]=4 10648 B14R1.907 COc1cc(ncc1C)SCCSC 62a_100000212216_100010067687 [0,2,0,0,0,0|2,0,0]=4 10649 B14R1.907 COc1cc(ncc1C)SCCSC 62a_100010067687_100000751147 [0,2,0,0,0,0|2,0,0]=4 10650 B14R1.907 COc1cc(ncc1F)SCCCF 62a_100011934791_200010136270 [0,2,0,0,0,0|2,0,0]=4 10651 B14R1.907 COc1cc(ncc1F)SCCCF 62a_200010136270_100011934791 [0,2,0,0,0,0|2,0,0]=4 10652 B14R1.907 COc1cc(ncc1F)SCCCO 62a_100011215043_200010136270 [0,2,0,0,0,0|2,0,0]=4 10653 B14R1.907 COc1cc(ncc1F)SCCCO 62a_200010136270_100011215043 [0,2,0,0,0,0|2,0,0]=4 10654 B14R1.907 COc1cc(ncc1F)SCCSC 62a_100000212216_200010136270 [0,2,0,0,0,0|2,0,0]=4 10655 B14R1.907 COc1cc(ncc1F)SCCSC 62a_200010136270_100000751147 [0,2,0,0,0,0|2,0,0]=4 10656 B14R1.907 COc1cc(ncc1N)SCCCF 62a_100009887741_100011934791 [0,2,0,0,0,0|2,0,0]=4 10657 B14R1.907 COc1cc(ncc1N)SCCCF 62a_100011934791_100009887741 [0,2,0,0,0,0|2,0,0]=4 10658 B14R1.907 COc1cc(ncc1N)SCCCO 62a_100009887741_100011215043 [0,2,0,0,0,0|2,0,0]=4 10659 B14R1.907 COc1cc(ncc1N)SCCCO 62a_100011215043_100009887741 [0,2,0,0,0,0|2,0,0]=4 10660 B14R1.907 COc1cc(ncc1N)SCCSC 62a_100000212216_100009887741 [0,2,0,0,0,0|2,0,0]=4 10661 B14R1.907 COc1cc(ncc1N)SCCSC 62a_100009887741_100000751147 [0,2,0,0,0,0|2,0,0]=4 10662 B14R1.907 COc1nc(ccc1Br)CNCCF 34a_100000724931_200010066506 [0,2,0,0,0,0|2,0,0]=4 10663 B14R1.907 COc1nc(ccc1Br)CNCCO 2230a_100016997473_200010066506 [0,2,0,0,0,0|2,0,0]=4 10664 B14R1.907 COc1nc(ccc1Br)CNCCO 34a_100016990907_200010066506 [0,2,0,0,0,0|2,0,0]=4 10665 B14R1.907 COc1nc(ccc1Br)COCCBr 34a_100000211926_200010066506 [0,2,0,0,0,0|2,0,0]=4 10666 B14R1.907 COc1nc(ccc1Br)COCCN 34a_100000210304_200010066506 [0,2,0,0,0,0|2,0,0]=4 10667 B14R1.907 COc1nc(ccc1Br)CSCCF 62a_100011217306_200010066506 [0,2,0,0,0,0|2,0,0]=4 10668 B14R1.907 COc1nc(ccc1Br)CSCCF 62a_200010066506_100011217306 [0,2,0,0,0,0|2,0,0]=4 10669 B14R1.907 COc1nc(ccc1Br)CSCCO 62a_100000211926_200010066506 [0,2,0,0,0,0|2,0,0]=4 10670 B14R1.907 COc1nc(ccc1Br)CSCCO 62a_200010066506_100000211926 [0,2,0,0,0,0|2,0,0]=4 10671 B14R1.907 COc1nc(ccc1Br)CSCSC 62a_100011218213_200010066506 [0,2,0,0,0,0|2,0,0]=4 10672 B14R1.907 COc1nc(ccc1Br)CSCSC 62a_200010066506_100011218213 [0,2,0,0,0,0|2,0,0]=4 10673 B14R1.907 COc1nc(ccc1N)SCCCF 62a_100000687816_100011934791 [0,2,0,0,0,0|2,0,0]=4 10674 B14R1.907 COc1nc(ccc1N)SCCCF 62a_100011934791_100000687816 [0,2,0,0,0,0|2,0,0]=4 10675 B14R1.907 COc1nc(ccc1N)SCCCO 62a_100000687816_100011215043 [0,2,0,0,0,0|2,0,0]=4 10676 B14R1.907 COc1nc(ccc1N)SCCCO 62a_100011215043_100000687816 [0,2,0,0,0,0|2,0,0]=4 10677 B14R1.907 COc1nc(ccc1N)SCCSC 62a_100000212216_100000687816 [0,2,0,0,0,0|2,0,0]=4 10678 B14R1.907 COc1nc(ccc1N)SCCSC 62a_100000687816_100000751147 [0,2,0,0,0,0|2,0,0]=4 10679 B14R1.907 COc1nc(ccc1O)SCCC#N 62a_100011215226_100010893133 [0,2,0,0,0,0|1,0,1]=4 10680 B14R1.907 COc1nc(ccc1O)SCCCF 62a_100011934791_100010893133 [0,2,0,0,0,0|1,0,0]=3 10681 B14R1.907 COc1nc(ccc1O)SCCCO 62a_100011215043_100010893133 [0,2,0,0,0,0|1,0,0]=3 10682 B14R1.907 COc1nc(ccc1O)SCCSC 62a_100000212216_100010893133 [0,2,0,0,0,0|1,0,0]=3 10683 B14R1.907 COc1nc(cnc1O)SCCCF 62a_100011934791_200010365344 [0,2,0,0,0,0|2,0,0]=4 10684 B14R1.907 COc1nc(cnc1O)SCCCF 62a_200010365344_100011934791 [0,2,0,0,0,0|2,0,0]=4 10685 B14R1.907 COc1nc(cnc1O)SCCCO 62a_100011215043_200010365344 [0,2,0,0,0,0|2,0,0]=4 10686 B14R1.907 COc1nc(cnc1O)SCCCO 62a_200010365344_100011215043 [0,2,0,0,0,0|2,0,0]=4 10687 B14R1.907 COc1nc(cnc1O)SCCSC 62a_100000212216_200010365344 [0,2,0,0,0,0|2,0,0]=4 10688 B14R1.907 COc1nc(cnc1O)SCCSC 62a_200010365344_100000751147 [0,2,0,0,0,0|2,0,0]=4 10689 B14R1.907 CSCCNc1ccc(c(c1)C#N)O 34a_100011249283_100000212216 [0,2,0,0,0,0|2,0,0]=4 10690 B14R1.907 CSCCSc1ccc(c(c1)C#N)O 62a_100000212216_100000687585 [0,2,0,0,0,0|2,0,0]=4 10691 B14R1.907 CSCCSc1ccc(c(c1)C=O)O 62a_100000212216_100000186750 [0,2,0,0,0,0|2,0,0]=4 10692 B14R1.907 CSCCSc1ccc(c(c1)CN)O 62a_100000212216_100000730032 [0,2,0,0,0,0|2,0,0]=4 10693 B14R1.907 CSCCSc1ccc(c(c1)CN)O 62a_100000730032_100000751147 [0,2,0,0,0,0|2,0,0]=4 10694 B14R1.907 CSCCSc1ccc(c(c1)CO)O 62a_100000184703_100000751147 [0,2,0,0,0,0|2,0,0]=4 10695 B14R1.907 CSCCSc1ccc(c(c1)CO)O 62a_100000212216_100000184703 [0,2,0,0,0,0|2,0,0]=4 10696 B14R1.907 CSCCSc1ccc(c(c1)SC)F 62a_100000212216_100010341305 [0,2,0,0,0,0|1,1,0]=4 10697 B14R1.907 CSCCSc1ccc(c(c1)SC)F 62a_100010341305_100000751147 [0,2,0,0,0,0|1,1,0]=4 10698 B14R1.907 CSCSCc1ccc(c(c1)C=O)O 62a_100011218213_100000008128 [0,2,0,0,0,0|2,0,0]=4 10699 B14R1.907 CSc1cc(ccc1F)SCCCF 62a_100010341305_100011934791 [0,2,0,0,0,0|1,1,0]=4 10700 B14R1.907 CSc1cc(ccc1F)SCCCF 62a_100011934791_100010341305 [0,2,0,0,0,0|1,1,0]=4 10701 B14R1.907 CSc1cc(ccc1F)SCCCO 62a_100010341305_100011215043 [0,2,0,0,0,0|1,1,0]=4 10702 B14R1.907 CSc1cc(ccc1F)SCCCO 62a_100011215043_100010341305 [0,2,0,0,0,0|1,1,0]=4 10703 B14R1.907 N#Cc1cc(ccc1O)NCCCF 34a_100011249283_100011934791 [0,2,0,0,0,0|2,0,0]=4 10704 B14R1.907 N#Cc1cc(ccc1O)NCCCO 34a_100011249283_100000230001 [0,2,0,0,0,0|2,0,0]=4 10705 B14R1.907 N#Cc1cc(ccc1O)SCCCF 62a_100011934791_100000687585 [0,2,0,0,0,0|2,0,0]=4 10706 B14R1.907 N#Cc1cc(ccc1O)SCCCO 62a_100011215043_100000687585 [0,2,0,0,0,0|2,0,0]=4 10707 B14R1.907 NCc1cc(ccc1O)SCCCF 62a_100000730032_100011934791 [0,2,0,0,0,0|2,0,0]=4 10708 B14R1.907 NCc1cc(ccc1O)SCCCF 62a_100011934791_100000730032 [0,2,0,0,0,0|2,0,0]=4 10709 B14R1.907 NCc1cc(ccc1O)SCCCO 62a_100000730032_100011215043 [0,2,0,0,0,0|2,0,0]=4 10710 B14R1.907 NCc1cc(ccc1O)SCCCO 62a_100011215043_100000730032 [0,2,0,0,0,0|2,0,0]=4 10711 B14R1.907 O=Cc1cc(ccc1O)CSCCF 62a_100011217306_100000008128 [0,2,0,0,0,0|2,0,0]=4 10712 B14R1.907 O=Cc1cc(ccc1O)CSCCO 62a_100000211926_100000008128 [0,2,0,0,0,0|2,0,0]=4 10713 B14R1.907 O=Cc1cc(ccc1O)SCCCF 62a_100011934791_100000186750 [0,2,0,0,0,0|2,0,0]=4 10714 B14R1.907 O=Cc1cc(ccc1O)SCCCO 62a_100011215043_100000186750 [0,2,0,0,0,0|2,0,0]=4 10715 B14R1.907 OCCCSc1ccc(c(c1)CO)O 62a_100000184703_100011215043 [0,2,0,0,0,0|2,0,0]=4 10716 B14R1.907 OCCCSc1ccc(c(c1)CO)O 62a_100011215043_100000184703 [0,2,0,0,0,0|2,0,0]=4 10717 B14R1.907 OCc1cc(ccc1O)SCCCF 62a_100000184703_100011934791 [0,2,0,0,0,0|2,0,0]=4 10718 B14R1.907 OCc1cc(ccc1O)SCCCF 62a_100011934791_100000184703 [0,2,0,0,0,0|2,0,0]=4 10719 B14R1.1362 CCCCc1ccc(c(c1F)OC)Cl 271570a_100020621405_200135222481 [0,2,0,0,0,0|1,0,0]=3 10720 B14R1.1362 CCCCc1ccc(c(c1F)OC)N 271570a_100020621405_100010734149 [0,2,0,0,0,0|1,0,0]=3 10721 B14R1.1362 CCCCc1ccc(c(c1F)SC)F 271570a_100020621405_202125771753 [0,2,0,0,0,0|1,1,0]=4 10722 B14R1.1362 CCCNc1ccc(c(c1F)OC)F 34a_100137314619_100000210303 [0,2,0,0,0,0|1,0,0]=3 10723 B14R1.1362 CCCOc1ccc(c(c1F)C=O)O 271570a_203496583355_200010235755 [0,2,0,0,0,0|2,0,0]=4 10724 B14R1.1362 CCCOc1ccc(c(c1F)OC)F 34a_100000062073_100000210303 [0,2,0,0,0,0|1,0,0]=3 10725 B14R1.1362 CCCOc1ccc(c(c1F)OC)F 7a_100000062073_100000210303 [0,2,0,0,0,0|1,0,0]=3 10726 B14R1.1362 CCCSc1ccc(c(c1F)OC)Cl 62a_100000210303_200135222481 [0,2,0,0,0,0|1,0,0]=3 10727 B14R1.1362 CCCSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000210303 [0,2,0,0,0,0|1,0,0]=3 10728 B14R1.1362 CCCSc1ccc(c(c1F)OC)N 62a_100000210303_100010734149 [0,2,0,0,0,0|1,0,0]=3 10729 B14R1.1362 CCCSc1ccc(c(c1F)OC)N 62a_100010734149_100000210303 [0,2,0,0,0,0|1,0,0]=3 10730 B14R1.1362 CCCSc1ccc(c(c1F)SC)F 62a_100000210303_202125771753 [0,2,0,0,0,0|1,1,0]=4 10731 B14R1.1362 CCCSc1ccc(c(c1F)SC)F 62a_202125771753_100000210303 [0,2,0,0,0,0|1,1,0]=4 10732 B14R1.1362 CCNCc1ccc(c(c1F)OC)Br 207a_100015525214_200010981996 [0,2,0,0,0,0|1,0,0]=3 10733 B14R1.1362 CCNCc1ccc(c(c1F)OC)Cl 207a_100015525214_100009889114 [0,2,0,0,0,0|1,0,0]=3 10734 B14R1.1362 CCNCc1ccc(c(c1F)OC)Cl 2230a_100015525214_100010116237 [0,2,0,0,0,0|1,0,0]=3 10735 B14R1.1362 CCNCc1ccc(c(c1F)OC)Cl 270004a_100015525214_100009889114 [0,2,0,0,0,0|1,0,0]=3 10736 B14R1.1362 CCNCc1ccc(c(c1F)OC)Cl 34a_200009889119_100000210202 [0,2,0,0,0,0|1,0,0]=3 10737 B14R1.1362 CCNCc1ccc(c(c1F)OC)F 207a_100015525214_100000050928 [0,2,0,0,0,0|1,0,0]=3 10738 B14R1.1362 CCNCc1ccc(c(c1F)OC)F 2230a_100015525214_100009814548 [0,2,0,0,0,0|1,0,0]=3 10739 B14R1.1362 CCNCc1ccc(c(c1F)OC)F 270004a_100015525214_100000050928 [0,2,0,0,0,0|1,0,0]=3 10740 B14R1.1362 CCNCc1ccc(c(c1F)OC)F 34a_115082355467_100000210202 [0,2,0,0,0,0|1,0,0]=3 10741 B14R1.1362 CCNCc1ncc(c(c1C)OC)C 2230a_100015525214_100000737168 [0,2,0,0,0,0|2,0,0]=4 10742 B14R1.1362 CCNCc1ncc(c(c1C)OC)C 34a_200015187236_100000210202 [0,2,0,0,0,0|2,0,0]=4 10743 B14R1.1362 CCOCc1ccc(c(c1F)OC)Cl 34a_100009889115_100000210202 [0,2,0,0,0,0|1,0,0]=3 10744 B14R1.1362 CCOCc1ccc(c(c1F)OC)Cl 34a_100121572206_100010116237 [0,2,0,0,0,0|1,0,0]=3 10745 B14R1.1362 CCOCc1ccc(c(c1F)OC)Cl 7a_100009889115_100000210202 [0,2,0,0,0,0|1,0,0]=3 10746 B14R1.1362 CCOCc1ccc(c(c1F)OC)F 34a_100000081355_100000210202 [0,2,0,0,0,0|1,0,0]=3 10747 B14R1.1362 CCOCc1ccc(c(c1F)OC)F 34a_100121572206_100009814548 [0,2,0,0,0,0|1,0,0]=3 10748 B14R1.1362 CCOCc1ccc(c(c1F)OC)F 7a_100000081355_100000210202 [0,2,0,0,0,0|1,0,0]=3 10749 B14R1.1362 CCOCc1ncc(c(c1C)OC)C 34a_100011217710_100000210202 [0,2,0,0,0,0|2,0,0]=4 10750 B14R1.1362 CCOCc1ncc(c(c1C)OC)C 34a_100121572206_100000737168 [0,2,0,0,0,0|2,0,0]=4 10751 B14R1.1362 CCSCc1ccc(c(c1F)OC)Cl 62a_100000210202_100010116237 [0,2,0,0,0,0|1,0,0]=3 10752 B14R1.1362 CCSCc1ccc(c(c1F)OC)Cl 62a_100010116237_100000210202 [0,2,0,0,0,0|1,0,0]=3 10753 B14R1.1362 CCSCc1ccc(c(c1F)OC)F 62a_100000210202_100009814548 [0,2,0,0,0,0|1,0,0]=3 10754 B14R1.1362 CCSCc1ccc(c(c1F)OC)F 62a_100009814548_100000210202 [0,2,0,0,0,0|1,0,0]=3 10755 B14R1.1362 CCSCc1ncc(c(c1C)OC)C 62a_100000210202_100000737168 [0,2,0,0,0,0|2,0,0]=4 10756 B14R1.1362 CCSCc1ncc(c(c1C)OC)C 62a_100000737168_100000210202 [0,2,0,0,0,0|2,0,0]=4 10757 B14R1.1362 COCSc1ccc(c(c1F)OC)Cl 62a_100000766300_200135222481 [0,2,0,0,0,0|2,0,0]=4 10758 B14R1.1362 COCSc1ccc(c(c1F)OC)Cl 62a_200135222481_100000766300 [0,2,0,0,0,0|2,0,0]=4 10759 B14R1.1362 COCSc1ccc(c(c1F)OC)N 62a_100000766300_100010734149 [0,2,0,0,0,0|2,0,0]=4 10760 B14R1.1362 COCSc1ccc(c(c1F)OC)N 62a_100010734149_100000766300 [0,2,0,0,0,0|2,0,0]=4 10761 B14R1.1362 COc1c(ccc(c1F)CNCF)Cl 34a_200009889119_100015361967 [0,2,0,0,0,0|2,0,0]=4 10762 B14R1.1362 COc1c(ccc(c1F)CNCF)F 34a_115082355467_100015361967 [0,2,0,0,0,0|2,0,0]=4 10763 B14R1.1362 COc1c(ccc(c1F)COCF)Cl 34a_100009889115_100015361967 [0,2,0,0,0,0|2,0,0]=4 10764 B14R1.1362 COc1c(ccc(c1F)COCF)Cl 7a_100009889115_100015361967 [0,2,0,0,0,0|2,0,0]=4 10765 B14R1.1362 COc1c(ccc(c1F)COCF)F 34a_100000081355_100015361967 [0,2,0,0,0,0|2,0,0]=4 10766 B14R1.1362 COc1c(ccc(c1F)COCF)F 7a_100000081355_100015361967 [0,2,0,0,0,0|2,0,0]=4 10767 B14R1.1362 COc1c(ccc(c1F)CSCF)Cl 62a_100010116237_100015361967 [0,2,0,0,0,0|2,0,0]=4 10768 B14R1.1362 COc1c(ccc(c1F)CSCF)Cl 62a_100015361967_100010116237 [0,2,0,0,0,0|2,0,0]=4 10769 B14R1.1362 COc1c(ccc(c1F)CSCF)F 62a_100009814548_100015361967 [0,2,0,0,0,0|2,0,0]=4 10770 B14R1.1362 COc1c(ccc(c1F)CSCF)F 62a_100015361967_100009814548 [0,2,0,0,0,0|2,0,0]=4 10771 B14R1.1362 COc1c(ccc(c1F)NCCF)F 34a_100137314619_100011217306 [0,2,0,0,0,0|2,0,0]=4 10772 B14R1.1362 COc1c(ccc(c1F)NCCO)F 34a_100137314619_100000211926 [0,2,0,0,0,0|2,0,0]=4 10773 B14R1.1362 COc1c(ccc(c1F)NCSC)F 34a_100137314619_100011218213 [0,2,0,0,0,0|2,0,0]=4 10774 B14R1.1362 COc1c(ccc(c1F)OCCF)F 34a_100000062073_100011217306 [0,2,0,0,0,0|2,0,0]=4 10775 B14R1.1362 COc1c(ccc(c1F)OCCF)F 7a_100000062073_100011217306 [0,2,0,0,0,0|2,0,0]=4 10776 B14R1.1362 COc1c(ccc(c1F)OCCO)F 34a_100000062073_100000211926 [0,2,0,0,0,0|2,0,0]=4 10777 B14R1.1362 COc1c(ccc(c1F)OCCO)F 7a_100000062073_100000211926 [0,2,0,0,0,0|2,0,0]=4 10778 B14R1.1362 COc1c(ccc(c1F)OCSC)F 34a_100000062073_100011218213 [0,2,0,0,0,0|2,0,0]=4 10779 B14R1.1362 COc1c(ccc(c1F)SCCF)Cl 62a_100011217306_200135222481 [0,2,0,0,0,0|2,0,0]=4 10780 B14R1.1362 COc1c(ccc(c1F)SCCF)Cl 62a_200135222481_100011217306 [0,2,0,0,0,0|2,0,0]=4 10781 B14R1.1362 COc1c(ccc(c1F)SCCF)N 62a_100010734149_100011217306 [0,2,0,0,0,0|2,0,0]=4 10782 B14R1.1362 COc1c(ccc(c1F)SCCF)N 62a_100011217306_100010734149 [0,2,0,0,0,0|2,0,0]=4 10783 B14R1.1362 COc1c(ccc(c1F)SCCO)Cl 62a_100000211926_200135222481 [0,2,0,0,0,0|2,0,0]=4 10784 B14R1.1362 COc1c(ccc(c1F)SCCO)Cl 62a_200135222481_100000211926 [0,2,0,0,0,0|2,0,0]=4 10785 B14R1.1362 COc1c(ccc(c1F)SCCO)N 62a_100000211926_100010734149 [0,2,0,0,0,0|2,0,0]=4 10786 B14R1.1362 COc1c(ccc(c1F)SCCO)N 62a_100010734149_100000211926 [0,2,0,0,0,0|2,0,0]=4 10787 B14R1.1362 COc1c(ccc(c1F)SCSC)Cl 62a_100011218213_200135222481 [0,2,0,0,0,0|2,0,0]=4 10788 B14R1.1362 COc1c(ccc(c1F)SCSC)Cl 62a_200135222481_100011218213 [0,2,0,0,0,0|2,0,0]=4 10789 B14R1.1362 COc1c(ccc(c1F)SCSC)N 62a_100010734149_100011218213 [0,2,0,0,0,0|2,0,0]=4 10790 B14R1.1362 COc1c(ccc(c1F)SCSC)N 62a_100011218213_100010734149 [0,2,0,0,0,0|2,0,0]=4 10791 B14R1.4435 C#CCSc1cc(c(cc1F)O)OC 62a_100000038162_100010189133 [0,2,0,0,0,0|0,0,2]=4 10792 B14R1.4435 C=CCSc1cc(c(cc1F)O)OC 62a_100000210623_100010189133 [0,2,0,0,0,0|0,0,2]=4 10793 B14R1.4435 CCCCc1cc(c(cc1Br)Br)OC 271570a_100020621405_200014006352 [0,2,0,0,0,0|1,0,0]=3 10794 B14R1.4435 CCCCc1cc(c(cc1C)F)OC 271570a_100020621405_100011009880 [0,2,0,0,0,0|1,0,0]=3 10795 B14R1.4435 CCCCc1cc(c(cc1C)N)OC 271570a_100020621405_100010141321 [0,2,0,0,0,0|1,0,0]=3 10796 B14R1.4435 CCCCc1cc(c(cc1F)Cl)OC 271570a_100020621405_100010739614 [0,2,0,0,0,0|1,0,0]=3 10797 B14R1.4435 CCCCc1cc(c(cc1F)F)OC 271570a_100020621405_200015541288 [0,2,0,0,0,0|1,0,0]=3 10798 B14R1.4435 CCCCc1cc(c(cc1F)N)NC 271570a_100020621405_100013631271 [0,2,0,0,0,0|2,0,0]=4 10799 B14R1.4435 CCCCc1cc(c(cc1F)N)OC 271570a_100020621405_100012766639 [0,2,0,0,0,0|1,0,0]=3 10800 B14R1.4435 CCCCc1cc(c(cc1F)O)C=O 271570a_100020621405_100010175118 [0,2,0,0,0,0|2,0,0]=4 10801 B14R1.4435 CCCCc1cc(c(cc1F)O)OC 271570a_100020621405_100010189133 [0,2,0,0,0,0|0,0,0]=2 10802 B14R1.4435 CCCCc1cc(c(cc1N)C)OC 271570a_100020621405_200010584344 [0,2,0,0,0,0|1,0,0]=3 10803 B14R1.4435 CCCCc1cc(c(cc1N)F)OC 271570a_100020621405_100010365326 [0,2,0,0,0,0|1,0,0]=3 10804 B14R1.4435 CCCCc1cc(c(cc1O)O)C=O 271570a_100020621405_200010132312 [0,2,0,0,0,0|2,0,0]=4 10805 B14R1.4435 CCCCc1cc(c(nc1C)N)OC 271570a_100020621405_200010892190 [0,2,0,0,0,0|2,0,0]=4 10806 B14R1.4435 CCCNc1cc(c(cc1Br)Br)OC 34a_100000718616_100000210303 [0,2,0,0,0,0|1,0,0]=3 10807 B14R1.4435 CCCNc1cc(c(cc1Br)Br)OC 7a_100000718616_100000210303 [0,2,0,0,0,0|1,0,0]=3 10808 B14R1.4435 CCCNc1cc(c(cc1Br)C)OC 34a_100010244135_100000210303 [0,2,0,0,0,0|1,0,0]=3 10809 B14R1.4435 CCCNc1cc(c(cc1Br)C)OC 7a_100010244135_100000210303 [0,2,0,0,0,0|1,0,0]=3 10810 B14R1.4435 CCCNc1cc(c(cc1Br)Cl)OC 34a_100013022580_100000210303 [0,2,0,0,0,0|1,0,0]=3 10811 B14R1.4435 CCCNc1cc(c(cc1Br)Cl)OC 7a_100013022580_100000210303 [0,2,0,0,0,0|1,0,0]=3 10812 B14R1.4435 CCCNc1cc(c(cc1Br)F)OC 34a_100010208193_100000210303 [0,2,0,0,0,0|1,0,0]=3 10813 B14R1.4435 CCCNc1cc(c(cc1Br)F)OC 7a_100010208193_100000210303 [0,2,0,0,0,0|1,0,0]=3 10814 B14R1.4435 CCCNc1cc(c(cc1C)Br)OC 34a_100010232211_100000210303 [0,2,0,0,0,0|1,0,0]=3 10815 B14R1.4435 CCCNc1cc(c(cc1C)Br)OC 7a_100010232211_100000210303 [0,2,0,0,0,0|1,0,0]=3 10816 B14R1.4435 CCCNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000210303 [0,2,0,0,0,0|1,0,0]=3 10817 B14R1.4435 CCCNc1cc(c(cc1C)Cl)OC 34a_100009858536_100000210303 [0,2,0,0,0,0|1,0,0]=3 10818 B14R1.4435 CCCNc1cc(c(cc1C)Cl)OC 7a_100009858536_100000210303 [0,2,0,0,0,0|1,0,0]=3 10819 B14R1.4435 CCCNc1cc(c(cc1Cl)Br)OC 34a_100012361290_100000210303 [0,2,0,0,0,0|1,0,0]=3 10820 B14R1.4435 CCCNc1cc(c(cc1Cl)Br)OC 7a_100012361290_100000210303 [0,2,0,0,0,0|1,0,0]=3 10821 B14R1.4435 CCCNc1cc(c(cc1Cl)Cl)OC 34a_100011830341_100000210303 [0,2,0,0,0,0|1,0,0]=3 10822 B14R1.4435 CCCNc1cc(c(cc1Cl)F)OC 34a_100009958774_100000210303 [0,2,0,0,0,0|1,0,0]=3 10823 B14R1.4435 CCCNc1cc(c(cc1Cl)F)OC 7a_100009958774_100000210303 [0,2,0,0,0,0|1,0,0]=3 10824 B14R1.4435 CCCNc1cc(c(cc1F)Cl)OC 34a_100009872666_100000210303 [0,2,0,0,0,0|1,0,0]=3 10825 B14R1.4435 CCCNc1cc(c(cc1F)Cl)OC 7a_100009872666_100000210303 [0,2,0,0,0,0|1,0,0]=3 10826 B14R1.4435 CCCOc1cc(c(cc1Br)F)NC 34a_100021428089_200000210301 [0,2,0,0,0,0|2,0,0]=4 10827 B14R1.4435 CCCOc1cc(c(cc1Br)F)NC 7a_100021428089_200000210301 [0,2,0,0,0,0|2,0,0]=4 10828 B14R1.4435 CCCOc1cc(c(cc1Br)F)N[13CH3] 34a_100021428089_200025704644 [0,2,0,0,0,0|2,0,0]=4 10829 B14R1.4435 CCCOc1cc(c(cc1Br)F)N[13CH3] 7a_100021428089_200025704644 [0,2,0,0,0,0|2,0,0]=4 10830 B14R1.4435 CCCOc1cc(c(cc1F)Br)CC 34a_100011156610_100000210303 [0,2,0,0,0,0|2,0,0]=4 10831 B14R1.4435 CCCOc1cc(c(cc1F)Br)CC 7a_100011156610_100000210303 [0,2,0,0,0,0|2,0,0]=4 10832 B14R1.4435 CCCSc1cc(c(cc1Br)Br)OC 62a_100000210303_200014006352 [0,2,0,0,0,0|1,0,0]=3 10833 B14R1.4435 CCCSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000210303 [0,2,0,0,0,0|1,0,0]=3 10834 B14R1.4435 CCCSc1cc(c(cc1C)F)OC 62a_100000210303_100011009880 [0,2,0,0,0,0|1,0,0]=3 10835 B14R1.4435 CCCSc1cc(c(cc1C)F)OC 62a_100011009880_100000210303 [0,2,0,0,0,0|1,0,0]=3 10836 B14R1.4435 CCCSc1cc(c(cc1C)N)OC 62a_100000210303_100010141321 [0,2,0,0,0,0|1,0,0]=3 10837 B14R1.4435 CCCSc1cc(c(cc1C)N)OC 62a_100010141321_100000210303 [0,2,0,0,0,0|1,0,0]=3 10838 B14R1.4435 CCCSc1cc(c(cc1F)Cl)OC 62a_100000210303_100010739614 [0,2,0,0,0,0|1,0,0]=3 10839 B14R1.4435 CCCSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000210303 [0,2,0,0,0,0|1,0,0]=3 10840 B14R1.4435 CCCSc1cc(c(cc1F)F)OC 62a_100000210303_200015541288 [0,2,0,0,0,0|1,0,0]=3 10841 B14R1.4435 CCCSc1cc(c(cc1F)F)OC 62a_200015541288_100000210303 [0,2,0,0,0,0|1,0,0]=3 10842 B14R1.4435 CCCSc1cc(c(cc1F)N)NC 62a_100000210303_100013631271 [0,2,0,0,0,0|2,0,0]=4 10843 B14R1.4435 CCCSc1cc(c(cc1F)N)NC 62a_100013631271_100000210303 [0,2,0,0,0,0|2,0,0]=4 10844 B14R1.4435 CCCSc1cc(c(cc1F)N)OC 62a_100000210303_100012766639 [0,2,0,0,0,0|1,0,0]=3 10845 B14R1.4435 CCCSc1cc(c(cc1F)N)OC 62a_100012766639_100000210303 [0,2,0,0,0,0|1,0,0]=3 10846 B14R1.4435 CCCSc1cc(c(cc1F)O)C=O 62a_100000210303_100010175118 [0,2,0,0,0,0|2,0,0]=4 10847 B14R1.4435 CCCSc1cc(c(cc1F)O)C=O 62a_100010175118_100000210303 [0,2,0,0,0,0|2,0,0]=4 10848 B14R1.4435 CCCSc1cc(c(cc1F)O)OC 62a_100000210303_100010189133 [0,2,0,0,0,0|0,0,0]=2 10849 B14R1.4435 CCCSc1cc(c(cc1N)C)OC 62a_100000210303_200010584344 [0,2,0,0,0,0|1,0,0]=3 10850 B14R1.4435 CCCSc1cc(c(cc1N)C)OC 62a_200010584344_100000210303 [0,2,0,0,0,0|1,0,0]=3 10851 B14R1.4435 CCCSc1cc(c(cc1N)F)OC 62a_100000210303_100010365326 [0,2,0,0,0,0|1,0,0]=3 10852 B14R1.4435 CCCSc1cc(c(cc1N)F)OC 62a_100010365326_100000210303 [0,2,0,0,0,0|1,0,0]=3 10853 B14R1.4435 CCCSc1cc(c(cc1O)O)C=O 62a_100000210303_200010132312 [0,2,0,0,0,0|2,0,0]=4 10854 B14R1.4435 CCCSc1cc(c(nc1C)N)OC 62a_100000210303_200010892190 [0,2,0,0,0,0|2,0,0]=4 10855 B14R1.4435 CCCSc1cc(c(nc1C)N)OC 62a_200010892190_100000210303 [0,2,0,0,0,0|2,0,0]=4 10856 B14R1.4435 CCNCc1cc(c(cc1Br)Br)OC 207a_100015525214_100010996155 [0,2,0,0,0,0|1,0,0]=3 10857 B14R1.4435 CCNCc1cc(c(cc1Br)Br)OC 270004a_100015525214_100010996155 [0,2,0,0,0,0|1,0,0]=3 10858 B14R1.4435 CCNCc1cc(c(cc1Br)F)OC 207a_100015525214_100010366953 [0,2,0,0,0,0|1,0,0]=3 10859 B14R1.4435 CCNCc1cc(c(cc1Br)F)OC 270004a_100015525214_100010366953 [0,2,0,0,0,0|1,0,0]=3 10860 B14R1.4435 CCNCc1cc(c(cc1F)Br)OC 207a_100015525214_100000695681 [0,2,0,0,0,0|1,0,0]=3 10861 B14R1.4435 CCNCc1cc(c(cc1F)Br)OC 270004a_100015525214_100000695681 [0,2,0,0,0,0|1,0,0]=3 10862 B14R1.4435 CCNCc1cc(c(cc1F)Cl)OC 207a_100015525214_100000050388 [0,2,0,0,0,0|1,0,0]=3 10863 B14R1.4435 CCNCc1cc(c(cc1F)Cl)OC 270004a_100015525214_100000050388 [0,2,0,0,0,0|1,0,0]=3 10864 B14R1.4435 CCNCc1cc(c(cc1F)F)OC 207a_100015525214_100010630602 [0,2,0,0,0,0|1,0,0]=3 10865 B14R1.4435 CCNCc1cc(c(cc1F)F)OC 270004a_100015525214_100010630602 [0,2,0,0,0,0|1,0,0]=3 10866 B14R1.4435 COCNc1cc(c(cc1C)Cl)OC 2230a_100009858536_100000766300 [0,2,0,0,0,0|2,0,0]=4 10867 B14R1.4435 COCSc1cc(c(cc1Br)Br)OC 62a_100000766300_200014006352 [0,2,0,0,0,0|2,0,0]=4 10868 B14R1.4435 COCSc1cc(c(cc1Br)Br)OC 62a_200014006352_100000766300 [0,2,0,0,0,0|2,0,0]=4 10869 B14R1.4435 COCSc1cc(c(cc1C)F)OC 62a_100000766300_100011009880 [0,2,0,0,0,0|2,0,0]=4 10870 B14R1.4435 COCSc1cc(c(cc1C)F)OC 62a_100011009880_100000766300 [0,2,0,0,0,0|2,0,0]=4 10871 B14R1.4435 COCSc1cc(c(cc1C)N)OC 62a_100000766300_100010141321 [0,2,0,0,0,0|2,0,0]=4 10872 B14R1.4435 COCSc1cc(c(cc1C)N)OC 62a_100010141321_100000766300 [0,2,0,0,0,0|2,0,0]=4 10873 B14R1.4435 COCSc1cc(c(cc1F)Cl)OC 62a_100000766300_100010739614 [0,2,0,0,0,0|2,0,0]=4 10874 B14R1.4435 COCSc1cc(c(cc1F)Cl)OC 62a_100010739614_100000766300 [0,2,0,0,0,0|2,0,0]=4 10875 B14R1.4435 COCSc1cc(c(cc1F)F)OC 62a_100000766300_200015541288 [0,2,0,0,0,0|2,0,0]=4 10876 B14R1.4435 COCSc1cc(c(cc1F)F)OC 62a_200015541288_100000766300 [0,2,0,0,0,0|2,0,0]=4 10877 B14R1.4435 COCSc1cc(c(cc1F)N)OC 62a_100000766300_100012766639 [0,2,0,0,0,0|2,0,0]=4 10878 B14R1.4435 COCSc1cc(c(cc1F)N)OC 62a_100012766639_100000766300 [0,2,0,0,0,0|2,0,0]=4 10879 B14R1.4435 COCSc1cc(c(cc1F)O)OC 62a_100000766300_100010189133 [0,2,0,0,0,0|1,0,0]=3 10880 B14R1.4435 COCSc1cc(c(cc1N)C)OC 62a_100000766300_200010584344 [0,2,0,0,0,0|2,0,0]=4 10881 B14R1.4435 COCSc1cc(c(cc1N)C)OC 62a_200010584344_100000766300 [0,2,0,0,0,0|2,0,0]=4 10882 B14R1.4435 COCSc1cc(c(cc1N)F)OC 62a_100000766300_100010365326 [0,2,0,0,0,0|2,0,0]=4 10883 B14R1.4435 COCSc1cc(c(cc1N)F)OC 62a_100010365326_100000766300 [0,2,0,0,0,0|2,0,0]=4 10884 B14R1.4435 COc1cc(c(cc1Br)Br)NCCF 34a_100000718616_100011217306 [0,2,0,0,0,0|2,0,0]=4 10885 B14R1.4435 COc1cc(c(cc1Br)Br)NCCF 7a_100000718616_100011217306 [0,2,0,0,0,0|2,0,0]=4 10886 B14R1.4435 COc1cc(c(cc1Br)Br)NCCO 34a_100000718616_100000211926 [0,2,0,0,0,0|2,0,0]=4 10887 B14R1.4435 COc1cc(c(cc1Br)Br)NCCO 7a_100000718616_100000211926 [0,2,0,0,0,0|2,0,0]=4 10888 B14R1.4435 COc1cc(c(cc1Br)Br)NCSC 34a_100000718616_100011218213 [0,2,0,0,0,0|2,0,0]=4 10889 B14R1.4435 COc1cc(c(cc1Br)Br)SCCF 62a_100011217306_200014006352 [0,2,0,0,0,0|2,0,0]=4 10890 B14R1.4435 COc1cc(c(cc1Br)Br)SCCF 62a_200014006352_100011217306 [0,2,0,0,0,0|2,0,0]=4 10891 B14R1.4435 COc1cc(c(cc1Br)Br)SCCO 62a_100000211926_200014006352 [0,2,0,0,0,0|2,0,0]=4 10892 B14R1.4435 COc1cc(c(cc1Br)Br)SCCO 62a_200014006352_100000211926 [0,2,0,0,0,0|2,0,0]=4 10893 B14R1.4435 COc1cc(c(cc1Br)Br)SCSC 62a_100011218213_200014006352 [0,2,0,0,0,0|2,0,0]=4 10894 B14R1.4435 COc1cc(c(cc1Br)Br)SCSC 62a_200014006352_100011218213 [0,2,0,0,0,0|2,0,0]=4 10895 B14R1.4435 COc1cc(c(cc1Br)C)NCCF 34a_100010232211_100011217306 [0,2,0,0,0,0|2,0,0]=4 10896 B14R1.4435 COc1cc(c(cc1Br)C)NCCF 7a_100010232211_100011217306 [0,2,0,0,0,0|2,0,0]=4 10897 B14R1.4435 COc1cc(c(cc1Br)C)NCCO 34a_100010232211_100000211926 [0,2,0,0,0,0|2,0,0]=4 10898 B14R1.4435 COc1cc(c(cc1Br)C)NCCO 7a_100010232211_100000211926 [0,2,0,0,0,0|2,0,0]=4 10899 B14R1.4435 COc1cc(c(cc1Br)C)NCSC 34a_100010232211_100011218213 [0,2,0,0,0,0|2,0,0]=4 10900 B14R1.4435 COc1cc(c(cc1Br)Cl)NCCF 34a_100012361290_100011217306 [0,2,0,0,0,0|2,0,0]=4 10901 B14R1.4435 COc1cc(c(cc1Br)Cl)NCCF 7a_100012361290_100011217306 [0,2,0,0,0,0|2,0,0]=4 10902 B14R1.4435 COc1cc(c(cc1Br)Cl)NCCO 34a_100012361290_100000211926 [0,2,0,0,0,0|2,0,0]=4 10903 B14R1.4435 COc1cc(c(cc1Br)Cl)NCCO 7a_100012361290_100000211926 [0,2,0,0,0,0|2,0,0]=4 10904 B14R1.4435 COc1cc(c(cc1Br)Cl)NCSC 34a_100012361290_100011218213 [0,2,0,0,0,0|2,0,0]=4 10905 B14R1.4435 COc1cc(c(cc1C)Br)NCCF 34a_100010244135_100011217306 [0,2,0,0,0,0|2,0,0]=4 10906 B14R1.4435 COc1cc(c(cc1C)Br)NCCF 7a_100010244135_100011217306 [0,2,0,0,0,0|2,0,0]=4 10907 B14R1.4435 COc1cc(c(cc1C)Br)NCCO 34a_100010244135_100000211926 [0,2,0,0,0,0|2,0,0]=4 10908 B14R1.4435 COc1cc(c(cc1C)Br)NCCO 7a_100010244135_100000211926 [0,2,0,0,0,0|2,0,0]=4 10909 B14R1.4435 COc1cc(c(cc1C)Br)NCSC 34a_100010244135_100011218213 [0,2,0,0,0,0|2,0,0]=4 10910 B14R1.4435 COc1cc(c(cc1C)N)SCCF 62a_100011217306_200010584344 [0,2,0,0,0,0|2,0,0]=4 10911 B14R1.4435 COc1cc(c(cc1C)N)SCCF 62a_200010584344_100011217306 [0,2,0,0,0,0|2,0,0]=4 10912 B14R1.4435 COc1cc(c(cc1C)N)SCCO 62a_100000211926_200010584344 [0,2,0,0,0,0|2,0,0]=4 10913 B14R1.4435 COc1cc(c(cc1C)N)SCCO 62a_200010584344_100000211926 [0,2,0,0,0,0|2,0,0]=4 10914 B14R1.4435 COc1cc(c(cc1C)N)SCSC 62a_100011218213_200010584344 [0,2,0,0,0,0|2,0,0]=4 10915 B14R1.4435 COc1cc(c(cc1C)N)SCSC 62a_200010584344_100011218213 [0,2,0,0,0,0|2,0,0]=4 10916 B14R1.4435 COc1cc(c(cc1Cl)Br)NCCF 34a_100013022580_100011217306 [0,2,0,0,0,0|2,0,0]=4 10917 B14R1.4435 COc1cc(c(cc1Cl)Br)NCCF 7a_100013022580_100011217306 [0,2,0,0,0,0|2,0,0]=4 10918 B14R1.4435 COc1cc(c(cc1Cl)Br)NCCO 34a_100013022580_100000211926 [0,2,0,0,0,0|2,0,0]=4 10919 B14R1.4435 COc1cc(c(cc1Cl)Br)NCCO 7a_100013022580_100000211926 [0,2,0,0,0,0|2,0,0]=4 10920 B14R1.4435 COc1cc(c(cc1Cl)Br)NCSC 34a_100013022580_100011218213 [0,2,0,0,0,0|2,0,0]=4 10921 B14R1.4435 COc1cc(c(cc1Cl)C)NCCF 2230a_100009858536_100011217306 [0,2,0,0,0,0|2,0,0]=4 10922 B14R1.4435 COc1cc(c(cc1Cl)C)NCCF 34a_100009858536_100011217306 [0,2,0,0,0,0|2,0,0]=4 10923 B14R1.4435 COc1cc(c(cc1Cl)C)NCCF 7a_100009858536_100011217306 [0,2,0,0,0,0|2,0,0]=4 10924 B14R1.4435 COc1cc(c(cc1Cl)C)NCCO 2230a_100009858536_100000211926 [0,2,0,0,0,0|2,0,0]=4 10925 B14R1.4435 COc1cc(c(cc1Cl)C)NCCO 34a_100009858536_100000211926 [0,2,0,0,0,0|2,0,0]=4 10926 B14R1.4435 COc1cc(c(cc1Cl)C)NCCO 7a_100009858536_100000211926 [0,2,0,0,0,0|2,0,0]=4 10927 B14R1.4435 COc1cc(c(cc1Cl)C)NCSC 2230a_100009858536_100011218213 [0,2,0,0,0,0|2,0,0]=4 10928 B14R1.4435 COc1cc(c(cc1Cl)C)NCSC 34a_100009858536_100011218213 [0,2,0,0,0,0|2,0,0]=4 10929 B14R1.4435 COc1cc(c(cc1Cl)Cl)NCCF 34a_100011830341_100011217306 [0,2,0,0,0,0|2,0,0]=4 10930 B14R1.4435 COc1cc(c(cc1Cl)Cl)NCCO 34a_100011830341_100000211926 [0,2,0,0,0,0|2,0,0]=4 10931 B14R1.4435 COc1cc(c(cc1Cl)Cl)NCSC 34a_100011830341_100011218213 [0,2,0,0,0,0|2,0,0]=4 10932 B14R1.4435 COc1cc(c(cc1Cl)F)NCCF 34a_100009872666_100011217306 [0,2,0,0,0,0|2,0,0]=4 10933 B14R1.4435 COc1cc(c(cc1Cl)F)NCCF 7a_100009872666_100011217306 [0,2,0,0,0,0|2,0,0]=4 10934 B14R1.4435 COc1cc(c(cc1Cl)F)NCCO 34a_100009872666_100000211926 [0,2,0,0,0,0|2,0,0]=4 10935 B14R1.4435 COc1cc(c(cc1Cl)F)NCCO 7a_100009872666_100000211926 [0,2,0,0,0,0|2,0,0]=4 10936 B14R1.4435 COc1cc(c(cc1Cl)F)NCSC 34a_100009872666_100011218213 [0,2,0,0,0,0|2,0,0]=4 10937 B14R1.4435 COc1cc(c(cc1Cl)F)SCCF 62a_100010739614_100011217306 [0,2,0,0,0,0|2,0,0]=4 10938 B14R1.4435 COc1cc(c(cc1Cl)F)SCCF 62a_100011217306_100010739614 [0,2,0,0,0,0|2,0,0]=4 10939 B14R1.4435 COc1cc(c(cc1Cl)F)SCCO 62a_100000211926_100010739614 [0,2,0,0,0,0|2,0,0]=4 10940 B14R1.4435 COc1cc(c(cc1Cl)F)SCCO 62a_100010739614_100000211926 [0,2,0,0,0,0|2,0,0]=4 10941 B14R1.4435 COc1cc(c(cc1Cl)F)SCSC 62a_100010739614_100011218213 [0,2,0,0,0,0|2,0,0]=4 10942 B14R1.4435 COc1cc(c(cc1Cl)F)SCSC 62a_100011218213_100010739614 [0,2,0,0,0,0|2,0,0]=4 10943 B14R1.4435 COc1cc(c(cc1F)Br)NCCF 34a_100010208193_100011217306 [0,2,0,0,0,0|2,0,0]=4 10944 B14R1.4435 COc1cc(c(cc1F)Br)NCCF 7a_100010208193_100011217306 [0,2,0,0,0,0|2,0,0]=4 10945 B14R1.4435 COc1cc(c(cc1F)Br)NCCO 34a_100010208193_100000211926 [0,2,0,0,0,0|2,0,0]=4 10946 B14R1.4435 COc1cc(c(cc1F)Br)NCCO 7a_100010208193_100000211926 [0,2,0,0,0,0|2,0,0]=4 10947 B14R1.4435 COc1cc(c(cc1F)Br)NCSC 34a_100010208193_100011218213 [0,2,0,0,0,0|2,0,0]=4 10948 B14R1.4435 COc1cc(c(cc1F)C)SCCF 62a_100011009880_100011217306 [0,2,0,0,0,0|2,0,0]=4 10949 B14R1.4435 COc1cc(c(cc1F)C)SCCF 62a_100011217306_100011009880 [0,2,0,0,0,0|2,0,0]=4 10950 B14R1.4435 COc1cc(c(cc1F)C)SCCO 62a_100000211926_100011009880 [0,2,0,0,0,0|2,0,0]=4 10951 B14R1.4435 COc1cc(c(cc1F)C)SCCO 62a_100011009880_100000211926 [0,2,0,0,0,0|2,0,0]=4 10952 B14R1.4435 COc1cc(c(cc1F)C)SCSC 62a_100011009880_100011218213 [0,2,0,0,0,0|2,0,0]=4 10953 B14R1.4435 COc1cc(c(cc1F)C)SCSC 62a_100011218213_100011009880 [0,2,0,0,0,0|2,0,0]=4 10954 B14R1.4435 COc1cc(c(cc1F)Cl)NCCF 34a_100009958774_100011217306 [0,2,0,0,0,0|2,0,0]=4 10955 B14R1.4435 COc1cc(c(cc1F)Cl)NCCF 7a_100009958774_100011217306 [0,2,0,0,0,0|2,0,0]=4 10956 B14R1.4435 COc1cc(c(cc1F)Cl)NCCO 34a_100009958774_100000211926 [0,2,0,0,0,0|2,0,0]=4 10957 B14R1.4435 COc1cc(c(cc1F)Cl)NCCO 7a_100009958774_100000211926 [0,2,0,0,0,0|2,0,0]=4 10958 B14R1.4435 COc1cc(c(cc1F)Cl)NCSC 34a_100009958774_100011218213 [0,2,0,0,0,0|2,0,0]=4 10959 B14R1.4435 COc1cc(c(cc1F)F)SCCF 62a_100011217306_200015541288 [0,2,0,0,0,0|2,0,0]=4 10960 B14R1.4435 COc1cc(c(cc1F)F)SCCF 62a_200015541288_100011217306 [0,2,0,0,0,0|2,0,0]=4 10961 B14R1.4435 COc1cc(c(cc1F)F)SCCO 62a_100000211926_200015541288 [0,2,0,0,0,0|2,0,0]=4 10962 B14R1.4435 COc1cc(c(cc1F)F)SCCO 62a_200015541288_100000211926 [0,2,0,0,0,0|2,0,0]=4 10963 B14R1.4435 COc1cc(c(cc1F)F)SCSC 62a_100011218213_200015541288 [0,2,0,0,0,0|2,0,0]=4 10964 B14R1.4435 COc1cc(c(cc1F)F)SCSC 62a_200015541288_100011218213 [0,2,0,0,0,0|2,0,0]=4 10965 B14R1.4435 COc1cc(c(cc1F)N)SCCF 62a_100010365326_100011217306 [0,2,0,0,0,0|2,0,0]=4 10966 B14R1.4435 COc1cc(c(cc1F)N)SCCF 62a_100011217306_100010365326 [0,2,0,0,0,0|2,0,0]=4 10967 B14R1.4435 COc1cc(c(cc1F)N)SCCO 62a_100000211926_100010365326 [0,2,0,0,0,0|2,0,0]=4 10968 B14R1.4435 COc1cc(c(cc1F)N)SCCO 62a_100010365326_100000211926 [0,2,0,0,0,0|2,0,0]=4 10969 B14R1.4435 COc1cc(c(cc1F)N)SCSC 62a_100010365326_100011218213 [0,2,0,0,0,0|2,0,0]=4 10970 B14R1.4435 COc1cc(c(cc1F)N)SCSC 62a_100011218213_100010365326 [0,2,0,0,0,0|2,0,0]=4 10971 B14R1.4435 COc1cc(c(cc1N)C)SCCF 62a_100010141321_100011217306 [0,2,0,0,0,0|2,0,0]=4 10972 B14R1.4435 COc1cc(c(cc1N)C)SCCF 62a_100011217306_100010141321 [0,2,0,0,0,0|2,0,0]=4 10973 B14R1.4435 COc1cc(c(cc1N)C)SCCO 62a_100000211926_100010141321 [0,2,0,0,0,0|2,0,0]=4 10974 B14R1.4435 COc1cc(c(cc1N)C)SCCO 62a_100010141321_100000211926 [0,2,0,0,0,0|2,0,0]=4 10975 B14R1.4435 COc1cc(c(cc1N)C)SCSC 62a_100010141321_100011218213 [0,2,0,0,0,0|2,0,0]=4 10976 B14R1.4435 COc1cc(c(cc1N)C)SCSC 62a_100011218213_100010141321 [0,2,0,0,0,0|2,0,0]=4 10977 B14R1.4435 COc1cc(c(cc1N)F)SCCF 62a_100011217306_100012766639 [0,2,0,0,0,0|2,0,0]=4 10978 B14R1.4435 COc1cc(c(cc1N)F)SCCF 62a_100012766639_100011217306 [0,2,0,0,0,0|2,0,0]=4 10979 B14R1.4435 COc1cc(c(cc1N)F)SCCO 62a_100000211926_100012766639 [0,2,0,0,0,0|2,0,0]=4 10980 B14R1.4435 COc1cc(c(cc1N)F)SCCO 62a_100012766639_100000211926 [0,2,0,0,0,0|2,0,0]=4 10981 B14R1.4435 COc1cc(c(cc1N)F)SCSC 62a_100011218213_100012766639 [0,2,0,0,0,0|2,0,0]=4 10982 B14R1.4435 COc1cc(c(cc1N)F)SCSC 62a_100012766639_100011218213 [0,2,0,0,0,0|2,0,0]=4 10983 B14R1.4435 COc1cc(c(cc1O)F)SCC#N 62a_100011215382_100010189133 [0,2,0,0,0,0|1,0,1]=4 10984 B14R1.4435 COc1cc(c(cc1O)F)SCC=O 62a_200015260668_100010189133 [0,2,0,0,0,0|1,0,1]=4 10985 B14R1.4435 COc1cc(c(cc1O)F)SCCF 62a_100011217306_100010189133 [0,2,0,0,0,0|1,0,0]=3 10986 B14R1.4435 COc1cc(c(cc1O)F)SCCO 62a_100000211926_100010189133 [0,2,0,0,0,0|1,0,0]=3 10987 B14R1.4435 COc1cc(c(cc1O)F)SCSC 62a_100011218213_100010189133 [0,2,0,0,0,0|1,0,0]=3 10988 B14R1.7499 C#CCSc1cc(c(c(c1)OC)O)O 62a_100000038162_200159242197 [0,2,0,0,0,0|0,0,2]=4 10989 B14R1.7499 C=CCSc1cc(c(c(c1)OC)O)O 62a_100000210623_200159242197 [0,2,0,0,0,0|0,0,2]=4 10990 B14R1.7499 CCCCc1cc(c(c(c1)C#N)O)C 271570a_100020621405_100010195408 [0,2,0,0,0,0|2,0,0]=4 10991 B14R1.7499 CCCCc1cc(c(c(c1)C=O)O)F 271570a_100020621405_100011217654 [0,2,0,0,0,0|2,0,0]=4 10992 B14R1.7499 CCCCc1cc(c(c(c1)CC)N)C 271570a_100020621405_200000186424 [0,2,0,0,0,0|2,0,0]=4 10993 B14R1.7499 CCCCc1cc(c(c(c1)CC)O)C 271570a_100020621405_100010659108 [0,2,0,0,0,0|1,0,0]=3 10994 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)C 271570a_100020621405_100010271686 [0,2,0,0,0,0|1,0,0]=3 10995 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)F 271570a_100020621405_100011218012 [0,2,0,0,0,0|1,0,0]=3 10996 B14R1.7499 CCCCc1cc(c(c(c1)OC)F)O 271570a_100020621405_200015524394 [0,2,0,0,0,0|1,0,0]=3 10997 B14R1.7499 CCCCc1cc(c(c(c1)OC)N)C 271570a_100020621405_100000741850 [0,2,0,0,0,0|1,0,0]=3 10998 B14R1.7499 CCCNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000210303 [0,2,0,0,0,0|1,0,0]=3 10999 B14R1.7499 CCCNc1cc(c(c(c1)OC)Cl)Br 34a_100010131419_100000210303 [0,2,0,0,0,0|1,0,0]=3 11000 B14R1.7499 CCCNc1cc(c(c(c1)OC)Cl)Br 7a_100010131419_100000210303 [0,2,0,0,0,0|1,0,0]=3 11001 B14R1.7499 CCCSc1cc(c(c(c1)C#N)O)C 62a_100000210303_100010195408 [0,2,0,0,0,0|2,0,0]=4 11002 B14R1.7499 CCCSc1cc(c(c(c1)C=O)O)C 62a_100000210303_100000696164 [0,2,0,0,0,0|2,0,0]=4 11003 B14R1.7499 CCCSc1cc(c(c(c1)C=O)O)F 62a_100000210303_100011217654 [0,2,0,0,0,0|2,0,0]=4 11004 B14R1.7499 CCCSc1cc(c(c(c1)C=O)O)F 62a_100011217654_100000210303 [0,2,0,0,0,0|2,0,0]=4 11005 B14R1.7499 CCCSc1cc(c(c(c1)C=O)O)O 62a_100000210303_100010235811 [0,2,0,0,0,0|2,0,0]=4 11006 B14R1.7499 CCCSc1cc(c(c(c1)CC)N)C 62a_100000210303_200000186424 [0,2,0,0,0,0|2,0,0]=4 11007 B14R1.7499 CCCSc1cc(c(c(c1)CC)N)C 62a_200000186424_100000210303 [0,2,0,0,0,0|2,0,0]=4 11008 B14R1.7499 CCCSc1cc(c(c(c1)CC)O)C 62a_100000210303_100010659108 [0,2,0,0,0,0|1,0,0]=3 11009 B14R1.7499 CCCSc1cc(c(c(c1)OC)F)C 62a_100000210303_100010271686 [0,2,0,0,0,0|1,0,0]=3 11010 B14R1.7499 CCCSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000210303 [0,2,0,0,0,0|1,0,0]=3 11011 B14R1.7499 CCCSc1cc(c(c(c1)OC)F)F 62a_100000210303_100011218012 [0,2,0,0,0,0|1,0,0]=3 11012 B14R1.7499 CCCSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000210303 [0,2,0,0,0,0|1,0,0]=3 11013 B14R1.7499 CCCSc1cc(c(c(c1)OC)F)O 62a_100000210303_200015524394 [0,2,0,0,0,0|1,0,0]=3 11014 B14R1.7499 CCCSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000210303 [0,2,0,0,0,0|1,0,0]=3 11015 B14R1.7499 CCCSc1cc(c(c(c1)OC)N)C 62a_100000210303_100000741850 [0,2,0,0,0,0|1,0,0]=3 11016 B14R1.7499 CCCSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000210303 [0,2,0,0,0,0|1,0,0]=3 11017 B14R1.7499 CCCSc1cc(c(c(c1)OC)O)O 62a_100000210303_200159242197 [0,2,0,0,0,0|0,0,0]=2 11018 B14R1.7499 CCNCc1cc(c(c(c1)OC)F)F 207a_100015525214_100000050682 [0,2,0,0,0,0|1,0,0]=3 11019 B14R1.7499 CCNCc1cc(c(c(c1)OC)F)F 270004a_100015525214_100000050682 [0,2,0,0,0,0|1,0,0]=3 11020 B14R1.7499 CCc1cc(cc(c1O)C)SCCF 62a_100011217306_100010659108 [0,2,0,0,0,0|2,0,0]=4 11021 B14R1.7499 CCc1cc(cc(c1O)C)SCCO 62a_100000211926_100010659108 [0,2,0,0,0,0|2,0,0]=4 11022 B14R1.7499 CCc1cc(cc(c1O)C)SCOC 62a_100000766300_100010659108 [0,2,0,0,0,0|2,0,0]=4 11023 B14R1.7499 CCc1cc(cc(c1O)C)SCSC 62a_100011218213_100010659108 [0,2,0,0,0,0|2,0,0]=4 11024 B14R1.7499 COCNc1cc(c(c(c1)OC)Cl)Br 2230a_100010131419_100000766300 [0,2,0,0,0,0|2,0,0]=4 11025 B14R1.7499 COCSc1cc(c(c(c1)OC)F)C 62a_100000766300_100010271686 [0,2,0,0,0,0|2,0,0]=4 11026 B14R1.7499 COCSc1cc(c(c(c1)OC)F)C 62a_100010271686_100000766300 [0,2,0,0,0,0|2,0,0]=4 11027 B14R1.7499 COCSc1cc(c(c(c1)OC)F)F 62a_100000766300_100011218012 [0,2,0,0,0,0|2,0,0]=4 11028 B14R1.7499 COCSc1cc(c(c(c1)OC)F)F 62a_100011218012_100000766300 [0,2,0,0,0,0|2,0,0]=4 11029 B14R1.7499 COCSc1cc(c(c(c1)OC)F)O 62a_100000766300_200015524394 [0,2,0,0,0,0|2,0,0]=4 11030 B14R1.7499 COCSc1cc(c(c(c1)OC)F)O 62a_200015524394_100000766300 [0,2,0,0,0,0|2,0,0]=4 11031 B14R1.7499 COCSc1cc(c(c(c1)OC)N)C 62a_100000741850_100000766300 [0,2,0,0,0,0|2,0,0]=4 11032 B14R1.7499 COCSc1cc(c(c(c1)OC)N)C 62a_100000766300_100000741850 [0,2,0,0,0,0|2,0,0]=4 11033 B14R1.7499 COCSc1cc(c(c(c1)OC)O)O 62a_100000766300_200159242197 [0,2,0,0,0,0|1,0,0]=3 11034 B14R1.7499 COc1cc(cc(c1Cl)Br)NCCF 2230a_100010131419_100011217306 [0,2,0,0,0,0|2,0,0]=4 11035 B14R1.7499 COc1cc(cc(c1Cl)Br)NCCF 34a_100010131419_100011217306 [0,2,0,0,0,0|2,0,0]=4 11036 B14R1.7499 COc1cc(cc(c1Cl)Br)NCCF 7a_100010131419_100011217306 [0,2,0,0,0,0|2,0,0]=4 11037 B14R1.7499 COc1cc(cc(c1Cl)Br)NCCO 2230a_100010131419_100000211926 [0,2,0,0,0,0|2,0,0]=4 11038 B14R1.7499 COc1cc(cc(c1Cl)Br)NCCO 34a_100010131419_100000211926 [0,2,0,0,0,0|2,0,0]=4 11039 B14R1.7499 COc1cc(cc(c1Cl)Br)NCCO 7a_100010131419_100000211926 [0,2,0,0,0,0|2,0,0]=4 11040 B14R1.7499 COc1cc(cc(c1Cl)Br)NCSC 2230a_100010131419_100011218213 [0,2,0,0,0,0|2,0,0]=4 11041 B14R1.7499 COc1cc(cc(c1Cl)Br)NCSC 34a_100010131419_100011218213 [0,2,0,0,0,0|2,0,0]=4 11042 B14R1.7499 COc1cc(cc(c1F)C)SCCF 62a_100010271686_100011217306 [0,2,0,0,0,0|2,0,0]=4 11043 B14R1.7499 COc1cc(cc(c1F)C)SCCF 62a_100011217306_100010271686 [0,2,0,0,0,0|2,0,0]=4 11044 B14R1.7499 COc1cc(cc(c1F)C)SCCO 62a_100000211926_100010271686 [0,2,0,0,0,0|2,0,0]=4 11045 B14R1.7499 COc1cc(cc(c1F)C)SCCO 62a_100010271686_100000211926 [0,2,0,0,0,0|2,0,0]=4 11046 B14R1.7499 COc1cc(cc(c1F)C)SCSC 62a_100010271686_100011218213 [0,2,0,0,0,0|2,0,0]=4 11047 B14R1.7499 COc1cc(cc(c1F)C)SCSC 62a_100011218213_100010271686 [0,2,0,0,0,0|2,0,0]=4 11048 B14R1.7499 COc1cc(cc(c1F)F)SCCF 62a_100011217306_100011218012 [0,2,0,0,0,0|2,0,0]=4 11049 B14R1.7499 COc1cc(cc(c1F)F)SCCF 62a_100011218012_100011217306 [0,2,0,0,0,0|2,0,0]=4 11050 B14R1.7499 COc1cc(cc(c1F)F)SCCO 62a_100000211926_100011218012 [0,2,0,0,0,0|2,0,0]=4 11051 B14R1.7499 COc1cc(cc(c1F)F)SCCO 62a_100011218012_100000211926 [0,2,0,0,0,0|2,0,0]=4 11052 B14R1.7499 COc1cc(cc(c1F)F)SCSC 62a_100011218012_100011218213 [0,2,0,0,0,0|2,0,0]=4 11053 B14R1.7499 COc1cc(cc(c1F)F)SCSC 62a_100011218213_100011218012 [0,2,0,0,0,0|2,0,0]=4 11054 B14R1.7499 COc1cc(cc(c1F)O)SCCF 62a_100011217306_200015524394 [0,2,0,0,0,0|2,0,0]=4 11055 B14R1.7499 COc1cc(cc(c1F)O)SCCF 62a_200015524394_100011217306 [0,2,0,0,0,0|2,0,0]=4 11056 B14R1.7499 COc1cc(cc(c1F)O)SCCO 62a_100000211926_200015524394 [0,2,0,0,0,0|2,0,0]=4 11057 B14R1.7499 COc1cc(cc(c1F)O)SCCO 62a_200015524394_100000211926 [0,2,0,0,0,0|2,0,0]=4 11058 B14R1.7499 COc1cc(cc(c1F)O)SCSC 62a_100011218213_200015524394 [0,2,0,0,0,0|2,0,0]=4 11059 B14R1.7499 COc1cc(cc(c1F)O)SCSC 62a_200015524394_100011218213 [0,2,0,0,0,0|2,0,0]=4 11060 B14R1.7499 COc1cc(cc(c1N)C)SCCF 62a_100000741850_100011217306 [0,2,0,0,0,0|2,0,0]=4 11061 B14R1.7499 COc1cc(cc(c1N)C)SCCF 62a_100011217306_100000741850 [0,2,0,0,0,0|2,0,0]=4 11062 B14R1.7499 COc1cc(cc(c1N)C)SCCO 62a_100000211926_100000741850 [0,2,0,0,0,0|2,0,0]=4 11063 B14R1.7499 COc1cc(cc(c1N)C)SCCO 62a_100000741850_100000211926 [0,2,0,0,0,0|2,0,0]=4 11064 B14R1.7499 COc1cc(cc(c1N)C)SCSC 62a_100000741850_100011218213 [0,2,0,0,0,0|2,0,0]=4 11065 B14R1.7499 COc1cc(cc(c1N)C)SCSC 62a_100011218213_100000741850 [0,2,0,0,0,0|2,0,0]=4 11066 B14R1.7499 COc1cc(cc(c1O)O)SCC#N 62a_100011215382_200159242197 [0,2,0,0,0,0|1,0,1]=4 11067 B14R1.7499 COc1cc(cc(c1O)O)SCC=O 62a_200015260668_200159242197 [0,2,0,0,0,0|1,0,1]=4 11068 B14R1.7499 COc1cc(cc(c1O)O)SCCF 62a_100011217306_200159242197 [0,2,0,0,0,0|1,0,0]=3 11069 B14R1.7499 COc1cc(cc(c1O)O)SCCO 62a_100000211926_200159242197 [0,2,0,0,0,0|1,0,0]=3 11070 B14R1.7499 COc1cc(cc(c1O)O)SCSC 62a_100011218213_200159242197 [0,2,0,0,0,0|1,0,0]=3 11071 B14R1.9480 CNCc1c(cc(c(c1Cl)OC)Cl)Cl 207a_100102657272_203439809851 [0,2,0,0,0,0|2,0,0]=4 11072 B14R1.9480 CNCc1c(cc(c(c1Cl)OC)Cl)Cl 270004a_106832991635_203439809851 [0,2,0,0,0,0|2,0,0]=4 11073 B14R1.9480 CNCc1c(cc(c(c1F)OC)F)F 207a_100102657272_100000084228 [0,2,0,0,0,0|2,0,0]=4 11074 B14R1.9480 CNCc1c(cc(c(c1F)OC)F)F 270004a_106832991635_100000084228 [0,2,0,0,0,0|2,0,0]=4 11075 B14R1.15069 CC=Cc1cc(c(cc1C=O)O)OC 271570a_100016259895_100000183646 [0,2,0,0,0,0|0,0,2]=4 11076 B14R1.15069 CC=Cc1cc(c(cc1OC)O)OC 271570a_100016259895_100009816818 [0,2,0,0,0,0|0,0,2]=4 11077 B14R1.15069 CCNc1cc(c(cc1OC)Cl)OC 2230a_100000179761_100000210202 [0,2,0,0,0,0|2,0,0]=4 11078 B14R1.15069 CCNc1cc(c(cc1OC)Cl)OC 34a_100000179761_100000210202 [0,2,0,0,0,0|2,0,0]=4 11079 B14R1.15069 CCOc1cc(c(cc1OC)Br)OC 34a_100009816818_100000210202 [0,2,0,0,0,0|2,0,0]=4 11080 B14R1.15069 CCOc1cc(c(cc1OC)Br)OC 7a_100009816818_100000210202 [0,2,0,0,0,0|2,0,0]=4 11081 B14R1.15069 CCSc1cc(c(cc1C=O)O)OC 62a_100000210202_100000183646 [0,2,0,0,0,0|1,0,0]=3 11082 B14R1.15069 CCSc1cc(c(cc1OC)Br)OC 62a_100000210202_100013799044 [0,2,0,0,0,0|2,0,0]=4 11083 B14R1.15069 CCSc1cc(c(cc1OC)Br)OC 62a_100013799044_100000210202 [0,2,0,0,0,0|2,0,0]=4 11084 B14R1.15069 CCSc1cc(c(cc1OC)C)OC 62a_100000039368_100000210202 [0,2,0,0,0,0|2,0,0]=4 11085 B14R1.15069 CCSc1cc(c(cc1OC)C)OC 62a_100000210202_100000039368 [0,2,0,0,0,0|2,0,0]=4 11086 B14R1.15069 CCSc1cc(c(cc1OC)Cl)OC 62a_100000023288_100000210202 [0,2,0,0,0,0|2,0,0]=4 11087 B14R1.15069 CCSc1cc(c(cc1OC)Cl)OC 62a_100000210202_100000023288 [0,2,0,0,0,0|2,0,0]=4 11088 B14R1.15069 CNCc1cc(c(cc1OC)Br)OC 207a_100102657272_100000188581 [0,2,0,0,0,0|2,0,0]=4 11089 B14R1.15069 CNCc1cc(c(cc1OC)Br)OC 26a_100102657272_100009816818 [0,2,0,0,0,0|2,0,0]=4 11090 B14R1.15069 CNCc1cc(c(cc1OC)Br)OC 270004a_106832991635_100000188581 [0,2,0,0,0,0|2,0,0]=4 11091 B14R1.15069 CNCc1cc(c(cc1OC)C)OC 207a_100102657272_100000079178 [0,2,0,0,0,0|2,0,0]=4 11092 B14R1.15069 CNCc1cc(c(cc1OC)C)OC 270004a_106832991635_100000079178 [0,2,0,0,0,0|2,0,0]=4 11093 B14R1.15069 CNCc1cc(c(cc1OC)Cl)OC 207a_100102657272_100010168916 [0,2,0,0,0,0|2,0,0]=4 11094 B14R1.15069 CNCc1cc(c(cc1OC)Cl)OC 270004a_106832991635_100010168916 [0,2,0,0,0,0|2,0,0]=4 11095 B14R1.15069 CNCc1cc(c(cc1OC)I)OC 207a_100102657272_200010262236 [0,2,0,0,0,0|2,0,0]=4 11096 B14R1.15069 CNCc1cc(c(cc1OC)I)OC 270004a_106832991635_200010262236 [0,2,0,0,0,0|2,0,0]=4 11097 B14R1.15069 COCc1cc(c(cc1OC)C)OC 34a_200010309539_200000210301 [0,2,0,0,0,0|2,0,0]=4 11098 B14R1.15069 COCc1cc(c(cc1OC)C)OC 7a_200010309539_200000210301 [0,2,0,0,0,0|2,0,0]=4 11099 B14R1.15069 COc1cc(c(cc1C)OC)CO[13CH3] 34a_200010309539_200025704644 [0,2,0,0,0,0|2,0,0]=4 11100 B14R1.15069 COc1cc(c(cc1C)OC)CO[13CH3] 7a_200010309539_200025704644 [0,2,0,0,0,0|2,0,0]=4 11101 B14R1.15069 COc1cc(c(cc1O)C=O)SCF 62a_100015361967_100000183646 [0,2,0,0,0,0|2,0,0]=4 11102 B14R1.3236 CC=Cc1cc(c(c(c1)OC)O)CO 271570a_100016259895_100000185604 [0,2,0,0,0,0|0,0,2]=4 11103 B14R1.3236 CC=Cc1cc(c(c(c1)OC)O)OC 271570a_100016259895_100000691893 [0,2,0,0,0,0|0,0,2]=4 11104 B14R1.3236 CCNc1cc(c(c(c1)OC)Cl)OC 34a_100009986809_100000210202 [0,2,0,0,0,0|2,0,0]=4 11105 B14R1.3236 CCSc1cc(c(c(c1)OC)F)OC 62a_100000210202_100015304952 [0,2,0,0,0,0|2,0,0]=4 11106 B14R1.3236 CCSc1cc(c(c(c1)OC)F)OC 62a_100015304952_100000210202 [0,2,0,0,0,0|2,0,0]=4 11107 B14R1.3236 CCSc1cc(c(c(c1)OC)N)C#N 62a_100000210202_200010734157 [0,2,0,0,0,0|2,0,0]=4 11108 B14R1.3236 CCSc1cc(c(c(c1)OC)N)CO 62a_100000210202_100010235085 [0,2,0,0,0,0|2,0,0]=4 11109 B14R1.3236 CCSc1cc(c(c(c1)OC)N)CO 62a_100010235085_100000210202 [0,2,0,0,0,0|2,0,0]=4 11110 B14R1.3236 CCSc1cc(c(c(c1)OC)O)C=O 62a_100000210202_100000047136 [0,2,0,0,0,0|1,0,0]=3 11111 B14R1.3236 CCSc1cc(c(c(c1)OC)O)CO 62a_100000210202_100000185604 [0,2,0,0,0,0|1,0,0]=3 11112 B14R1.3236 CCc1cc(cc(c1O)CC)CNC 269862a_106832991636_100009863218 [0,2,0,0,0,0|2,0,0]=4 11113 B14R1.3236 CNCc1cc(c(c(c1)OC)Br)OC 207a_100102657272_100009814401 [0,2,0,0,0,0|2,0,0]=4 11114 B14R1.3236 CNCc1cc(c(c(c1)OC)C)OC 207a_100102657272_200012186444 [0,2,0,0,0,0|2,0,0]=4 11115 B14R1.3236 CNCc1cc(c(c(c1)OC)C)OC 270004a_106832991635_200012186444 [0,2,0,0,0,0|2,0,0]=4 11116 B14R1.3236 CNCc1cc(c(c(c1)OC)F)OC 207a_100102657272_200009839898 [0,2,0,0,0,0|2,0,0]=4 11117 B14R1.3236 CNCc1cc(c(c(c1)OC)F)OC 270004a_106832991635_200009839898 [0,2,0,0,0,0|2,0,0]=4 11118 B14R1.3236 COCc1cc(c(c(c1)OC)Br)OC 34a_100010169844_200000210301 [0,2,0,0,0,0|2,0,0]=4 11119 B14R1.3236 COCc1cc(c(c(c1)OC)Br)OC 7a_100010169844_200000210301 [0,2,0,0,0,0|2,0,0]=4 11120 B14R1.3236 COc1cc(cc(c1Br)OC)CO[13CH3] 34a_100010169844_200025704644 [0,2,0,0,0,0|2,0,0]=4 11121 B14R1.3236 COc1cc(cc(c1Br)OC)CO[13CH3] 7a_100010169844_200025704644 [0,2,0,0,0,0|2,0,0]=4 11122 B14R1.3236 COc1cc(cc(c1O)C=O)SCF 62a_100015361967_100000047136 [0,2,0,0,0,0|2,0,0]=4 11123 B14R1.3236 COc1cc(cc(c1O)CO)SCF 62a_100015361967_100000185604 [0,2,0,0,0,0|2,0,0]=4 11124 B12R1.116 CC=Cc1ccc(cc1)CCC 271570a_100016259895_100000750032 [0,0,1,1,0,0|2,0,0]=4 11125 B12R1.116 CCCc1ccc(cc1)COC 34a_100138415774_100011982809 [0,0,1,1,0,0|1,0,1]=4 11126 B12R1.267 CCCC=Cc1ccccc1O 271570a_100016258520_100000739446 [0,0,1,1,0,0|1,0,1]=4 11127 B12R1.267 CCCC=Cc1ncccc1O 271570a_100016258520_100000034122 [0,0,1,1,0,0|1,0,1]=4 11128 B12R2.43 C=Cc1cccc(c1)C2CC2 271570a_100011290941_100009816567 [1,0,0,1,0,0|1,0,1]=4 11129 B12R2.43 CCc1cc(ccn1)C2CC2 271570a_100011220607_100009820011 [1,0,0,1,0,0|2,0,0]=4 11130 B12R2.43 CCc1cccc(c1)C2CC2 271570a_100011220607_100000684523 [1,0,0,1,0,0|1,0,0]=3 11131 B12R2.43 CCc1cccc(n1)C2CC2 271570a_100011220607_100009856026 [1,0,0,1,0,0|2,0,0]=4 11132 B12R2.43 CCc1ccnc(c1)C2CC2 271570a_100011220607_100009817561 [1,0,0,1,0,0|2,0,0]=4 11133 B12R2.43 CCc1cncc(c1)C2CC2 271570a_100011220607_200009819073 [1,0,0,1,0,0|2,0,0]=4 11134 B12R2.43 CNc1cc(ccn1)C2CC2 271570a_100011220607_100009819592 [1,0,0,1,0,0|2,0,0]=4 11135 B12R2.43 CNc1cccc(c1)C2CC2 271570a_100011220607_100000219648 [1,0,0,1,0,0|1,0,0]=3 11136 B12R2.43 CNc1cccc(c1)C2CC2 34a_100025755985_200000210301 [1,0,0,1,0,0|1,0,0]=3 11137 B12R2.43 CNc1cccc(c1)C2CC2 7a_100025755985_200000210301 [1,0,0,1,0,0|1,0,0]=3 11138 B12R2.43 CNc1cccc(n1)C2CC2 271570a_100011220607_100000703281 [1,0,0,1,0,0|2,0,0]=4 11139 B12R2.43 CNc1ccnc(c1)C2CC2 271570a_100011220607_100009869472 [1,0,0,1,0,0|2,0,0]=4 11140 B12R2.43 CNc1ccnc(c1)C2CC2 27a_100102657272_100009820009 [1,0,0,1,0,0|2,0,0]=4 11141 B12R2.43 CNc1cncc(c1)C2CC2 271570a_100011220607_100012184536 [1,0,0,1,0,0|2,0,0]=4 11142 B12R2.43 COc1cc(ccn1)C2CC2 271570a_100011220607_100000117307 [1,0,0,1,0,0|1,0,0]=3 11143 B12R2.43 COc1cc(ncn1)C2CC2 271570a_100011220607_100012187182 [1,0,0,1,0,0|2,0,0]=4 11144 B12R2.43 COc1cccc(c1)C2CC2 271570a_100011220607_100000170001 [1,0,0,1,0,0|0,0,0]=2 11145 B12R2.43 COc1cccc(c1)C2CC2 34a_100011787725_200000210301 [1,0,0,1,0,0|0,0,0]=2 11146 B12R2.43 COc1cccc(c1)C2CC2 7a_100011787725_200000210301 [1,0,0,1,0,0|0,0,0]=2 11147 B12R2.43 COc1cccc(n1)C2CC2 271570a_100011220607_100000760917 [1,0,0,1,0,0|1,0,0]=3 11148 B12R2.43 COc1ccnc(c1)C2CC2 271570a_100011220607_100011216251 [1,0,0,1,0,0|1,0,0]=3 11149 B12R2.43 COc1ccnc(n1)C2CC2 271570a_100011220607_100000182009 [1,0,0,1,0,0|2,0,0]=4 11150 B12R2.43 COc1cncc(c1)C2CC2 271570a_100011220607_100000684773 [1,0,0,1,0,0|1,0,0]=3 11151 B12R2.43 COc1cncc(n1)C2CC2 271570a_100011220607_100000756030 [1,0,0,1,0,0|2,0,0]=4 11152 B12R2.43 COc1cnnc(c1)C2CC2 271570a_100011220607_100000087634 [1,0,0,1,0,0|2,0,0]=4 11153 B12R2.43 COc1nccc(n1)C2CC2 271570a_100011220607_100000069072 [1,0,0,1,0,0|2,0,0]=4 11154 B12R2.43 CSc1cc(ccn1)C2CC2 62a_200000210301_100009863080 [1,0,0,1,0,0|1,1,0]=4 11155 B12R2.43 CSc1cccc(c1)C2CC2 271570a_100011220607_100011215954 [1,0,0,1,0,0|0,1,0]=3 11156 B12R2.43 CSc1cccc(c1)C2CC2 62a_200000210301_100009816567 [1,0,0,1,0,0|0,1,0]=3 11157 B12R2.43 CSc1cccc(n1)C2CC2 271570a_100011220607_100011960944 [1,0,0,1,0,0|1,1,0]=4 11158 B12R2.43 CSc1ccnc(c1)C2CC2 271570a_100011220607_100010883326 [1,0,0,1,0,0|1,1,0]=4 11159 B12R2.43 CSc1ccnc(c1)C2CC2 62a_100009820009_200000210301 [1,0,0,1,0,0|1,1,0]=4 11160 B12R2.43 CSc1ccnc(c1)C2CC2 62a_200000210301_100009820009 [1,0,0,1,0,0|1,1,0]=4 11161 B12R2.43 CSc1cncc(c1)C2CC2 271570a_100011220607_100009816972 [1,0,0,1,0,0|1,1,0]=4 11162 B12R2.43 CSc1cncc(c1)C2CC2 62a_200000210301_200009866503 [1,0,0,1,0,0|1,1,0]=4 11163 B12R2.43 CSc1cncc(c1)C2CC2 62a_200009866503_200000210301 [1,0,0,1,0,0|1,1,0]=4 11164 B12R2.43 FCc1cccc(c1)C2CC2 271570a_100011220607_100010878472 [1,0,0,1,0,0|2,0,0]=4 11165 B12R2.43 N#Cc1cccc(c1)C2CC2 271570a_100011220607_100000189340 [1,0,0,1,0,0|2,0,0]=4 11166 B12R2.43 NCc1cccc(c1)C2CC2 271570a_100011220607_100000106179 [1,0,0,1,0,0|2,0,0]=4 11167 B12R2.43 NNc1cccc(c1)C2CC2 271570a_100011220607_100000217339 [1,0,0,1,0,0|2,0,0]=4 11168 B12R2.43 O=Cc1cccc(c1)C2CC2 271570a_100011220607_100000014684 [1,0,0,1,0,0|2,0,0]=4 11169 B12R2.43 OCc1cccc(c1)C2CC2 271570a_100011220607_100000687537 [1,0,0,1,0,0|2,0,0]=4 11170 B12R2.43 [13CH3]Nc1cccc(c1)C2CC2 34a_100025755985_200025704644 [1,0,0,1,0,0|1,0,0]=3 11171 B12R2.43 [13CH3]Nc1cccc(c1)C2CC2 7a_100025755985_200025704644 [1,0,0,1,0,0|1,0,0]=3 11172 B12R2.43 [13CH3]Oc1cccc(c1)C2CC2 34a_100011787725_200025704644 [1,0,0,1,0,0|0,0,0]=2 11173 B12R2.43 [13CH3]Oc1cccc(c1)C2CC2 7a_100011787725_200025704644 [1,0,0,1,0,0|0,0,0]=2 11174 B12R2.43 [13CH3]Sc1cc(ccn1)C2CC2 62a_200025704644_100009863080 [1,0,0,1,0,0|1,1,0]=4 11175 B12R2.43 [13CH3]Sc1cccc(c1)C2CC2 62a_200025704644_100009816567 [1,0,0,1,0,0|0,1,0]=3 11176 B12R2.43 [13CH3]Sc1ccnc(c1)C2CC2 62a_100009820009_200025704644 [1,0,0,1,0,0|1,1,0]=4 11177 B12R2.43 [13CH3]Sc1ccnc(c1)C2CC2 62a_200025704644_100009820009 [1,0,0,1,0,0|1,1,0]=4 11178 B12R2.43 [13CH3]Sc1cncc(c1)C2CC2 62a_200009866503_200025704644 [1,0,0,1,0,0|1,1,0]=4 11179 B12R2.43 [13CH3]Sc1cncc(c1)C2CC2 62a_200025704644_200009866503 [1,0,0,1,0,0|1,1,0]=4 11180 B12R2.44 C=Cc1ccc2c(c1)CCC2 271570a_100011290941_100000745594 [1,0,0,1,0,0|1,0,1]=4 11181 B12R2.44 CNc1ccc2c(c1)CCC2 2230a_100000211504_200000210301 [1,0,0,1,0,0|1,0,0]=3 11182 B12R2.44 CNc1ccc2c(c1)CCC2 34a_100000211504_200000210301 [1,0,0,1,0,0|1,0,0]=3 11183 B12R2.44 CNc1ccc2c(c1)CCO2 2230a_100000736984_200000210301 [1,0,0,1,0,0|2,0,0]=4 11184 B12R2.44 CNc1ccc2c(c1)CCO2 34a_100000736984_200000210301 [1,0,0,1,0,0|2,0,0]=4 11185 B12R2.44 CNc1ccc2c(c1)COC2 2230a_100011728444_200000210301 [1,0,0,1,0,0|2,0,0]=4 11186 B12R2.44 CNc1ccc2c(c1)COC2 34a_100011728444_200000210301 [1,0,0,1,0,0|2,0,0]=4 11187 B12R2.44 COc1ccc2c(c1)CCC2 34a_100000209987_200000210301 [1,0,0,1,0,0|0,0,0]=2 11188 B12R2.44 COc1ccc2c(c1)CCC2 7a_100000209987_200000210301 [1,0,0,1,0,0|0,0,0]=2 11189 B12R2.44 COc1ccc2c(c1)CCN2 34a_100020636429_200000210301 [1,0,0,1,0,0|1,0,0]=3 11190 B12R2.44 COc1ccc2c(c1)CNC2 34a_100015195982_200000210301 [1,0,0,1,0,0|1,0,0]=3 11191 B12R2.44 COc1ccc2c(c1)NCC2 34a_100020636427_200000210301 [1,0,0,1,0,0|1,0,0]=3 11192 B12R2.44 COc1ccc2c(c1)OCO2 34a_100000210298_200000210301 [1,0,0,1,0,0|2,0,0]=4 11193 B12R2.44 CSc1ccc2c(c1)CCC2 62a_100000745594_200000210301 [1,0,0,1,0,0|0,1,0]=3 11194 B12R2.44 CSc1ccc2c(c1)CCC2 62a_200000210301_100000745594 [1,0,0,1,0,0|0,1,0]=3 11195 B12R2.44 CSc1ccc2c(c1)CCN2 62a_100000691068_200000210301 [1,0,0,1,0,0|1,1,0]=4 11196 B12R2.44 CSc1ccc2c(c1)CCN2 62a_200000210301_100000691068 [1,0,0,1,0,0|1,1,0]=4 11197 B12R2.44 CSc1ccc2c(c1)CCO2 62a_100000729065_200000210301 [1,0,0,1,0,0|1,1,0]=4 11198 B12R2.44 CSc1ccc2c(c1)CCO2 62a_200000210301_100000729065 [1,0,0,1,0,0|1,1,0]=4 11199 B12R2.44 CSc1ccc2c(c1)CNC2 62a_100000702344_200000210301 [1,0,0,1,0,0|1,1,0]=4 11200 B12R2.44 CSc1ccc2c(c1)CNC2 62a_200000210301_100000702344 [1,0,0,1,0,0|1,1,0]=4 11201 B12R2.44 CSc1ccc2c(c1)COC2 62a_100000698232_200000210301 [1,0,0,1,0,0|1,1,0]=4 11202 B12R2.44 CSc1ccc2c(c1)COC2 62a_200000210301_100000698232 [1,0,0,1,0,0|1,1,0]=4 11203 B12R2.44 CSc1ccc2c(c1)NCC2 62a_100000754641_200000210301 [1,0,0,1,0,0|1,1,0]=4 11204 B12R2.44 CSc1ccc2c(c1)NCC2 62a_200000210301_100000754641 [1,0,0,1,0,0|1,1,0]=4 11205 B12R2.44 CSc1ccc2c(c1)OCC2 62a_100009818566_200000210301 [1,0,0,1,0,0|1,1,0]=4 11206 B12R2.44 CSc1ccc2c(c1)OCC2 62a_200000210301_100009818566 [1,0,0,1,0,0|1,1,0]=4 11207 B12R2.44 CSc1ccc2c(n1)CCC2 62a_100000046531_200000210301 [1,0,0,1,0,0|1,1,0]=4 11208 B12R2.44 CSc1ccc2c(n1)CCC2 62a_200000210301_100000046531 [1,0,0,1,0,0|1,1,0]=4 11209 B12R2.44 CSc1cnc2c(c1)CCC2 62a_100000693888_200000210301 [1,0,0,1,0,0|1,1,0]=4 11210 B12R2.44 CSc1cnc2c(c1)CCC2 62a_200000210301_100000693888 [1,0,0,1,0,0|1,1,0]=4 11211 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 2230a_100000211504_200025704644 [1,0,0,1,0,0|1,0,0]=3 11212 B12R2.44 [13CH3]Nc1ccc2c(c1)CCC2 34a_100000211504_200025704644 [1,0,0,1,0,0|1,0,0]=3 11213 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 2230a_100000736984_200025704644 [1,0,0,1,0,0|2,0,0]=4 11214 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 34a_100000736984_200025704644 [1,0,0,1,0,0|2,0,0]=4 11215 B12R2.44 [13CH3]Nc1ccc2c(c1)COC2 2230a_100011728444_200025704644 [1,0,0,1,0,0|2,0,0]=4 11216 B12R2.44 [13CH3]Nc1ccc2c(c1)COC2 34a_100011728444_200025704644 [1,0,0,1,0,0|2,0,0]=4 11217 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 34a_100000209987_200025704644 [1,0,0,1,0,0|0,0,0]=2 11218 B12R2.44 [13CH3]Oc1ccc2c(c1)CCC2 7a_100000209987_200025704644 [1,0,0,1,0,0|0,0,0]=2 11219 B12R2.44 [13CH3]Oc1ccc2c(c1)CCN2 34a_100020636429_200025704644 [1,0,0,1,0,0|1,0,0]=3 11220 B12R2.44 [13CH3]Oc1ccc2c(c1)CNC2 34a_100015195982_200025704644 [1,0,0,1,0,0|1,0,0]=3 11221 B12R2.44 [13CH3]Oc1ccc2c(c1)NCC2 34a_100020636427_200025704644 [1,0,0,1,0,0|1,0,0]=3 11222 B12R2.44 [13CH3]Oc1ccc2c(c1)OCO2 34a_100000210298_200025704644 [1,0,0,1,0,0|2,0,0]=4 11223 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_100000745594_200025704644 [1,0,0,1,0,0|0,1,0]=3 11224 B12R2.44 [13CH3]Sc1ccc2c(c1)CCC2 62a_200025704644_100000745594 [1,0,0,1,0,0|0,1,0]=3 11225 B12R2.44 [13CH3]Sc1ccc2c(c1)CCN2 62a_100000691068_200025704644 [1,0,0,1,0,0|1,1,0]=4 11226 B12R2.44 [13CH3]Sc1ccc2c(c1)CCN2 62a_200025704644_100000691068 [1,0,0,1,0,0|1,1,0]=4 11227 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_100000729065_200025704644 [1,0,0,1,0,0|1,1,0]=4 11228 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_200025704644_100000729065 [1,0,0,1,0,0|1,1,0]=4 11229 B12R2.44 [13CH3]Sc1ccc2c(c1)CNC2 62a_100000702344_200025704644 [1,0,0,1,0,0|1,1,0]=4 11230 B12R2.44 [13CH3]Sc1ccc2c(c1)CNC2 62a_200025704644_100000702344 [1,0,0,1,0,0|1,1,0]=4 11231 B12R2.44 [13CH3]Sc1ccc2c(c1)COC2 62a_100000698232_200025704644 [1,0,0,1,0,0|1,1,0]=4 11232 B12R2.44 [13CH3]Sc1ccc2c(c1)COC2 62a_200025704644_100000698232 [1,0,0,1,0,0|1,1,0]=4 11233 B12R2.44 [13CH3]Sc1ccc2c(c1)NCC2 62a_100000754641_200025704644 [1,0,0,1,0,0|1,1,0]=4 11234 B12R2.44 [13CH3]Sc1ccc2c(c1)NCC2 62a_200025704644_100000754641 [1,0,0,1,0,0|1,1,0]=4 11235 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_100009818566_200025704644 [1,0,0,1,0,0|1,1,0]=4 11236 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_200025704644_100009818566 [1,0,0,1,0,0|1,1,0]=4 11237 B12R2.44 [13CH3]Sc1ccc2c(n1)CCC2 62a_100000046531_200025704644 [1,0,0,1,0,0|1,1,0]=4 11238 B12R2.44 [13CH3]Sc1ccc2c(n1)CCC2 62a_200025704644_100000046531 [1,0,0,1,0,0|1,1,0]=4 11239 B12R2.44 [13CH3]Sc1cnc2c(c1)CCC2 62a_100000693888_200025704644 [1,0,0,1,0,0|1,1,0]=4 11240 B12R2.44 [13CH3]Sc1cnc2c(c1)CCC2 62a_200025704644_100000693888 [1,0,0,1,0,0|1,1,0]=4 11241 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100000210202_100009818592 [1,0,0,1,0,0|2,0,0]=4 11242 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100009818592_100000210202 [1,0,0,1,0,0|2,0,0]=4 11243 B12R2.143 CNCc1ccc2c(c1)CC2 207a_100102657272_100010273998 [1,0,0,1,0,0|2,0,0]=4 11244 B12R2.143 CNCc1ccc2c(c1)CC2 270004a_106832991635_100010273998 [1,0,0,1,0,0|2,0,0]=4 11245 B12R2.143 COCc1ccc2c(c1)CC2 34a_100010733339_200000210301 [1,0,0,1,0,0|2,0,0]=4 11246 B12R2.143 COCc1ccc2c(c1)CC2 7a_100010733339_200000210301 [1,0,0,1,0,0|2,0,0]=4 11247 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 34a_100010733339_200025704644 [1,0,0,1,0,0|2,0,0]=4 11248 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 7a_100010733339_200025704644 [1,0,0,1,0,0|2,0,0]=4 11249 B12R2.315 C=Cc1cccc2c1CCC2 271570a_100011290941_100010343934 [1,0,0,1,0,0|1,0,1]=4 11250 B12R2.315 CNc1cccc2c1CCC2 2230a_100000043548_200000210301 [1,0,0,1,0,0|1,0,0]=3 11251 B12R2.315 CNc1cccc2c1CCC2 34a_100000043548_200000210301 [1,0,0,1,0,0|1,0,0]=3 11252 B12R2.315 CNc1cccc2c1CCO2 2230a_100000084147_200000210301 [1,0,0,1,0,0|2,0,0]=4 11253 B12R2.315 CNc1cccc2c1CCO2 34a_100000084147_200000210301 [1,0,0,1,0,0|2,0,0]=4 11254 B12R2.315 CNc1cccc2c1COC2 2230a_100000125316_200000210301 [1,0,0,1,0,0|2,0,0]=4 11255 B12R2.315 CNc1cccc2c1COC2 34a_100000125316_200000210301 [1,0,0,1,0,0|2,0,0]=4 11256 B12R2.315 CNc1cccc2c1OCC2 2230a_100000102157_200000210301 [1,0,0,1,0,0|2,0,0]=4 11257 B12R2.315 CNc1cccc2c1OCC2 34a_100000102157_200000210301 [1,0,0,1,0,0|2,0,0]=4 11258 B12R2.315 CNc1ccnc2c1CCC2 27a_100102657272_100000102697 [1,0,0,1,0,0|2,0,0]=4 11259 B12R2.315 COc1cccc2c1CCC2 34a_100000074356_200000210301 [1,0,0,1,0,0|0,0,0]=2 11260 B12R2.315 COc1cccc2c1CCC2 7a_100000074356_200000210301 [1,0,0,1,0,0|0,0,0]=2 11261 B12R2.315 COc1cccc2c1CCN2 34a_100000703684_200000210301 [1,0,0,1,0,0|1,0,0]=3 11262 B12R2.315 COc1cccc2c1CCO2 34a_100000090053_200000210301 [1,0,0,1,0,0|1,0,0]=3 11263 B12R2.315 COc1cccc2c1CCO2 7a_100000090053_200000210301 [1,0,0,1,0,0|1,0,0]=3 11264 B12R2.315 COc1cccc2c1CNC2 34a_100015191671_200000210301 [1,0,0,1,0,0|1,0,0]=3 11265 B12R2.315 COc1cccc2c1OCO2 34a_100000046630_200000210301 [1,0,0,1,0,0|2,0,0]=4 11266 B12R2.315 COc1cccc2c1OCO2 7a_100000046630_200000210301 [1,0,0,1,0,0|2,0,0]=4 11267 B12R2.315 CSc1cccc2c1CCC2 62a_100010343934_200000210301 [1,0,0,1,0,0|0,1,0]=3 11268 B12R2.315 CSc1cccc2c1CCC2 62a_200000210301_100010343934 [1,0,0,1,0,0|0,1,0]=3 11269 B12R2.315 CSc1cccc2c1CCN2 62a_100009817896_200000210301 [1,0,0,1,0,0|1,1,0]=4 11270 B12R2.315 CSc1cccc2c1CCN2 62a_200000210301_100009817896 [1,0,0,1,0,0|1,1,0]=4 11271 B12R2.315 CSc1cccc2c1CCO2 62a_100009819624_200000210301 [1,0,0,1,0,0|1,1,0]=4 11272 B12R2.315 CSc1cccc2c1CCO2 62a_200000210301_100009819624 [1,0,0,1,0,0|1,1,0]=4 11273 B12R2.315 CSc1cccc2c1CNC2 62a_100000703859_200000210301 [1,0,0,1,0,0|1,1,0]=4 11274 B12R2.315 CSc1cccc2c1CNC2 62a_200000210301_100000703859 [1,0,0,1,0,0|1,1,0]=4 11275 B12R2.315 CSc1cccc2c1COC2 62a_100010384907_200000210301 [1,0,0,1,0,0|1,1,0]=4 11276 B12R2.315 CSc1cccc2c1COC2 62a_200000210301_100010384907 [1,0,0,1,0,0|1,1,0]=4 11277 B12R2.315 CSc1cccc2c1NCC2 62a_100016995435_200000210301 [1,0,0,1,0,0|1,1,0]=4 11278 B12R2.315 CSc1cccc2c1NCC2 62a_200000210301_100016995435 [1,0,0,1,0,0|1,1,0]=4 11279 B12R2.315 CSc1cccc2c1OCC2 62a_100009818991_200000210301 [1,0,0,1,0,0|1,1,0]=4 11280 B12R2.315 CSc1cccc2c1OCC2 62a_200000210301_100009818991 [1,0,0,1,0,0|1,1,0]=4 11281 B12R2.315 CSc1ccnc2c1CCC2 62a_100000102697_200000210301 [1,0,0,1,0,0|1,1,0]=4 11282 B12R2.315 CSc1ccnc2c1CCC2 62a_200000210301_100000102697 [1,0,0,1,0,0|1,1,0]=4 11283 B12R2.315 [13CH3]Nc1cccc2c1CCC2 2230a_100000043548_200025704644 [1,0,0,1,0,0|1,0,0]=3 11284 B12R2.315 [13CH3]Nc1cccc2c1CCC2 34a_100000043548_200025704644 [1,0,0,1,0,0|1,0,0]=3 11285 B12R2.315 [13CH3]Nc1cccc2c1CCO2 2230a_100000084147_200025704644 [1,0,0,1,0,0|2,0,0]=4 11286 B12R2.315 [13CH3]Nc1cccc2c1CCO2 34a_100000084147_200025704644 [1,0,0,1,0,0|2,0,0]=4 11287 B12R2.315 [13CH3]Nc1cccc2c1COC2 2230a_100000125316_200025704644 [1,0,0,1,0,0|2,0,0]=4 11288 B12R2.315 [13CH3]Nc1cccc2c1COC2 34a_100000125316_200025704644 [1,0,0,1,0,0|2,0,0]=4 11289 B12R2.315 [13CH3]Nc1cccc2c1OCC2 2230a_100000102157_200025704644 [1,0,0,1,0,0|2,0,0]=4 11290 B12R2.315 [13CH3]Nc1cccc2c1OCC2 34a_100000102157_200025704644 [1,0,0,1,0,0|2,0,0]=4 11291 B12R2.315 [13CH3]Oc1cccc2c1CCC2 34a_100000074356_200025704644 [1,0,0,1,0,0|0,0,0]=2 11292 B12R2.315 [13CH3]Oc1cccc2c1CCC2 7a_100000074356_200025704644 [1,0,0,1,0,0|0,0,0]=2 11293 B12R2.315 [13CH3]Oc1cccc2c1CCN2 34a_100000703684_200025704644 [1,0,0,1,0,0|1,0,0]=3 11294 B12R2.315 [13CH3]Oc1cccc2c1CCO2 34a_100000090053_200025704644 [1,0,0,1,0,0|1,0,0]=3 11295 B12R2.315 [13CH3]Oc1cccc2c1CCO2 7a_100000090053_200025704644 [1,0,0,1,0,0|1,0,0]=3 11296 B12R2.315 [13CH3]Oc1cccc2c1CNC2 34a_100015191671_200025704644 [1,0,0,1,0,0|1,0,0]=3 11297 B12R2.315 [13CH3]Oc1cccc2c1OCO2 34a_100000046630_200025704644 [1,0,0,1,0,0|2,0,0]=4 11298 B12R2.315 [13CH3]Oc1cccc2c1OCO2 7a_100000046630_200025704644 [1,0,0,1,0,0|2,0,0]=4 11299 B12R2.315 [13CH3]Sc1cccc2c1CCC2 62a_100010343934_200025704644 [1,0,0,1,0,0|0,1,0]=3 11300 B12R2.315 [13CH3]Sc1cccc2c1CCC2 62a_200025704644_100010343934 [1,0,0,1,0,0|0,1,0]=3 11301 B12R2.315 [13CH3]Sc1cccc2c1CCN2 62a_100009817896_200025704644 [1,0,0,1,0,0|1,1,0]=4 11302 B12R2.315 [13CH3]Sc1cccc2c1CCN2 62a_200025704644_100009817896 [1,0,0,1,0,0|1,1,0]=4 11303 B12R2.315 [13CH3]Sc1cccc2c1CCO2 62a_100009819624_200025704644 [1,0,0,1,0,0|1,1,0]=4 11304 B12R2.315 [13CH3]Sc1cccc2c1CCO2 62a_200025704644_100009819624 [1,0,0,1,0,0|1,1,0]=4 11305 B12R2.315 [13CH3]Sc1cccc2c1CNC2 62a_100000703859_200025704644 [1,0,0,1,0,0|1,1,0]=4 11306 B12R2.315 [13CH3]Sc1cccc2c1CNC2 62a_200025704644_100000703859 [1,0,0,1,0,0|1,1,0]=4 11307 B12R2.315 [13CH3]Sc1cccc2c1COC2 62a_100010384907_200025704644 [1,0,0,1,0,0|1,1,0]=4 11308 B12R2.315 [13CH3]Sc1cccc2c1COC2 62a_200025704644_100010384907 [1,0,0,1,0,0|1,1,0]=4 11309 B12R2.315 [13CH3]Sc1cccc2c1NCC2 62a_100016995435_200025704644 [1,0,0,1,0,0|1,1,0]=4 11310 B12R2.315 [13CH3]Sc1cccc2c1NCC2 62a_200025704644_100016995435 [1,0,0,1,0,0|1,1,0]=4 11311 B12R2.315 [13CH3]Sc1cccc2c1OCC2 62a_100009818991_200025704644 [1,0,0,1,0,0|1,1,0]=4 11312 B12R2.315 [13CH3]Sc1cccc2c1OCC2 62a_200025704644_100009818991 [1,0,0,1,0,0|1,1,0]=4 11313 B12R2.315 [13CH3]Sc1ccnc2c1CCC2 62a_100000102697_200025704644 [1,0,0,1,0,0|1,1,0]=4 11314 B12R2.315 [13CH3]Sc1ccnc2c1CCC2 62a_200025704644_100000102697 [1,0,0,1,0,0|1,1,0]=4 11315 B12R2.82 Cc1c(ccc2c1OCO2)O 271570a_203496583355_100010335860 [1,0,0,1,0,0|2,0,0]=4 11316 B12R2.82 Nc1c(ccc2c1CCC2)O 271570a_203496583355_202495424074 [1,0,0,1,0,0|1,0,0]=3 11317 B12R2.82 Oc1ccc2c(c1F)CCN2 271570a_203496583355_100011013764 [1,0,0,1,0,0|2,0,0]=4 11318 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [1,0,0,1,0,0|0,0,0]=2 11319 B12R2.100 Oc1cc2c(cc1F)NCC2 271570a_203496583355_100012771920 [1,0,0,1,0,0|2,0,0]=4 11320 B12R2.100 Oc1cc2c(cc1O)CCC2 271570a_203496583355_200010659162 [1,0,0,1,0,0|0,0,0]=2 11321 B12R2.100 Oc1cc2c(cc1O)OCO2 271570a_203496583355_100010290809 [1,0,0,1,0,0|2,0,0]=4 11322 B12R2.291 Brc1ccc(cc1Br)C2CC2 271570a_100011220607_100012356285 [1,0,0,1,0,0|2,0,0]=4 11323 B12R2.291 Cc1cc(ccc1Br)C2CC2 271570a_100011220607_100009813585 [1,0,0,1,0,0|1,0,0]=3 11324 B12R2.291 Cc1cc(ccc1Cl)C2CC2 271570a_100011220607_100000049509 [1,0,0,1,0,0|1,0,0]=3 11325 B12R2.291 Cc1cc(ccc1F)C2CC2 271570a_100011220607_100011218330 [1,0,0,1,0,0|1,0,0]=3 11326 B12R2.291 Cc1cc(ccc1N)C2CC2 271570a_100011220607_100000211769 [1,0,0,1,0,0|1,0,0]=3 11327 B12R2.291 Cc1cc(ccc1O)C2CC2 271570a_100011220607_100000186361 [1,0,0,1,0,0|0,0,0]=2 11328 B12R2.291 Cc1cc(cnc1Br)C2CC2 271570a_100011220607_100009816107 [1,0,0,1,0,0|2,0,0]=4 11329 B12R2.291 Cc1cc(cnc1C)C2CC2 271570a_100011220607_100000697892 [1,0,0,1,0,0|2,0,0]=4 11330 B12R2.291 Cc1cc(cnc1Cl)C2CC2 271570a_100011220607_100009922867 [1,0,0,1,0,0|2,0,0]=4 11331 B12R2.291 Cc1cc(cnc1F)C2CC2 271570a_100011220607_100000709442 [1,0,0,1,0,0|2,0,0]=4 11332 B12R2.291 Cc1cc(cnc1N)C2CC2 271570a_100011220607_100000186686 [1,0,0,1,0,0|2,0,0]=4 11333 B12R2.291 Cc1cc(cnc1O)C2CC2 271570a_100011220607_100000685391 [1,0,0,1,0,0|1,0,0]=3 11334 B12R2.291 Cc1cc(ncc1Br)C2CC2 271570a_100011220607_100012356354 [1,0,0,1,0,0|2,0,0]=4 11335 B12R2.291 Cc1cc(ncc1F)C2CC2 271570a_100011220607_100009818257 [1,0,0,1,0,0|2,0,0]=4 11336 B12R2.291 Cc1cc(ncc1N)C2CC2 271570a_100011220607_100000765520 [1,0,0,1,0,0|2,0,0]=4 11337 B12R2.291 Cc1cc(ncc1O)C2CC2 271570a_100011220607_100000692680 [1,0,0,1,0,0|1,0,0]=3 11338 B12R2.291 Cc1ccc(cc1Br)C2CC2 271570a_100011220607_100011847877 [1,0,0,1,0,0|2,0,0]=4 11339 B12R2.291 Cc1ccc(cc1C)C2CC2 271570a_100011220607_100011215607 [1,0,0,1,0,0|1,0,0]=3 11340 B12R2.291 Cc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011216363 [1,0,0,1,0,0|2,0,0]=4 11341 B12R2.291 Cc1ccc(cc1F)C2CC2 271570a_100011220607_100000720648 [1,0,0,1,0,0|2,0,0]=4 11342 B12R2.291 Cc1ccc(cc1N)C2CC2 271570a_100011220607_100000761890 [1,0,0,1,0,0|2,0,0]=4 11343 B12R2.291 Cc1ccc(cc1O)C2CC2 271570a_100011220607_100000766334 [1,0,0,1,0,0|1,0,0]=3 11344 B12R2.291 Cc1ccc(nc1C)C2CC2 271570a_100011220607_100000103781 [1,0,0,1,0,0|2,0,0]=4 11345 B12R2.291 Cc1cnc(cc1C)C2CC2 271570a_100011220607_100009850809 [1,0,0,1,0,0|2,0,0]=4 11346 B12R2.291 Cc1cnc(cc1O)C2CC2 271570a_100011220607_100000704368 [1,0,0,1,0,0|2,0,0]=4 11347 B12R2.291 Cc1nc(ccc1Br)C2CC2 271570a_100011220607_100012360386 [1,0,0,1,0,0|2,0,0]=4 11348 B12R2.291 Cc1nc(ccc1F)C2CC2 271570a_100011220607_100009814307 [1,0,0,1,0,0|2,0,0]=4 11349 B12R2.291 Cc1nc(ccc1N)C2CC2 271570a_100011220607_100000760127 [1,0,0,1,0,0|2,0,0]=4 11350 B12R2.291 Cc1nc(ccc1O)C2CC2 271570a_100011220607_100010233687 [1,0,0,1,0,0|1,0,0]=3 11351 B12R2.291 Cc1ncc(cc1O)C2CC2 271570a_100011220607_100009864810 [1,0,0,1,0,0|2,0,0]=4 11352 B12R2.291 Clc1cc(ccc1Br)C2CC2 271570a_100011220607_100012047281 [1,0,0,1,0,0|2,0,0]=4 11353 B12R2.291 Clc1ccc(cc1Br)C2CC2 271570a_100011220607_100012353702 [1,0,0,1,0,0|2,0,0]=4 11354 B12R2.291 Clc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011214914 [1,0,0,1,0,0|2,0,0]=4 11355 B12R2.291 Cn1cc(ccc1=O)C2CC2 271570a_100011220607_100011245003 [1,0,0,1,0,0|1,0,1]=4 11356 B12R2.291 Fc1cc(ccc1Br)C2CC2 271570a_100011220607_100000685389 [1,0,0,1,0,0|2,0,0]=4 11357 B12R2.291 Fc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011216805 [1,0,0,1,0,0|2,0,0]=4 11358 B12R2.291 Fc1ccc(cc1Br)C2CC2 271570a_100011220607_100012047266 [1,0,0,1,0,0|2,0,0]=4 11359 B12R2.291 Fc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011215976 [1,0,0,1,0,0|2,0,0]=4 11360 B12R2.291 Fc1ccc(cc1F)C2CC2 271570a_100011220607_100000750028 [1,0,0,1,0,0|2,0,0]=4 11361 B12R2.291 Nc1cc(ccc1Br)C2CC2 271570a_100011220607_100000750456 [1,0,0,1,0,0|2,0,0]=4 11362 B12R2.291 Nc1cc(ccc1Cl)C2CC2 271570a_100011220607_200000761891 [1,0,0,1,0,0|2,0,0]=4 11363 B12R2.291 Nc1cc(ccc1F)C2CC2 271570a_100011220607_100000740924 [1,0,0,1,0,0|2,0,0]=4 11364 B12R2.291 Nc1cc(ccc1O)C2CC2 271570a_100011220607_100000752626 [1,0,0,1,0,0|1,0,0]=3 11365 B12R2.291 Nc1cc(cnc1O)C2CC2 271570a_100011220607_100000743729 [1,0,0,1,0,0|2,0,0]=4 11366 B12R2.291 Nc1cc(ncc1O)C2CC2 271570a_100011220607_100009819941 [1,0,0,1,0,0|2,0,0]=4 11367 B12R2.291 Nc1ccc(cc1Br)C2CC2 271570a_100011220607_100000750455 [1,0,0,1,0,0|2,0,0]=4 11368 B12R2.291 Nc1ccc(cc1Cl)C2CC2 271570a_100011220607_100011218065 [1,0,0,1,0,0|2,0,0]=4 11369 B12R2.291 Nc1ccc(cc1F)C2CC2 271570a_100011220607_100011215594 [1,0,0,1,0,0|2,0,0]=4 11370 B12R2.291 Nc1ccc(cc1N)C2CC2 271570a_100011220607_100000741789 [1,0,0,1,0,0|2,0,0]=4 11371 B12R2.291 Nc1ccc(cc1O)C2CC2 271570a_100011220607_100000739049 [1,0,0,1,0,0|1,0,0]=3 11372 B12R2.291 Nc1ccc(nc1O)C2CC2 271570a_100011220607_100000718904 [1,0,0,1,0,0|2,0,0]=4 11373 B12R2.291 Nc1nc(ccc1O)C2CC2 271570a_100011220607_100000685527 [1,0,0,1,0,0|2,0,0]=4 11374 B12R2.291 Nc1ncc(cc1O)C2CC2 271570a_100011220607_100009819042 [1,0,0,1,0,0|2,0,0]=4 11375 B12R2.291 O=c1[nH]cc(cc1O)C2CC2 271570a_100011220607_100009814561 [1,0,0,1,0,0|1,0,1]=4 11376 B12R2.291 Oc1cc(ccc1Br)C2CC2 271570a_100011220607_100012356990 [1,0,0,1,0,0|1,0,0]=3 11377 B12R2.291 Oc1cc(ccc1Cl)C2CC2 271570a_100011220607_100011356854 [1,0,0,1,0,0|1,0,0]=3 11378 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_100011220607_100000686035 [1,0,0,1,0,0|1,0,0]=3 11379 B12R2.291 Oc1cc(ccc1F)C2CC2 271570a_203496583355_100010281199 [1,0,0,1,0,0|1,0,0]=3 11380 B12R2.291 Oc1cc(cnc1F)C2CC2 271570a_100011220607_100009819871 [1,0,0,1,0,0|2,0,0]=4 11381 B12R2.291 Oc1cc(ncc1F)C2CC2 271570a_100011220607_100009854642 [1,0,0,1,0,0|2,0,0]=4 11382 B12R2.291 Oc1ccc(cc1Br)C2CC2 271570a_100011220607_100012361655 [1,0,0,1,0,0|1,0,0]=3 11383 B12R2.291 Oc1ccc(cc1Cl)C2CC2 271570a_100011220607_100012360047 [1,0,0,1,0,0|1,0,0]=3 11384 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_100011220607_100000185481 [1,0,0,1,0,0|1,0,0]=3 11385 B12R2.291 Oc1ccc(cc1F)C2CC2 271570a_203496583355_100010281179 [1,0,0,1,0,0|1,0,0]=3 11386 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_100011220607_100009813601 [1,0,0,1,0,0|0,0,0]=2 11387 B12R2.291 Oc1ccc(cc1O)C2CC2 271570a_203496583355_100135415898 [1,0,0,1,0,0|0,0,0]=2 11388 B12R2.291 Oc1ccc(nc1Br)C2CC2 271570a_100011220607_100000725334 [1,0,0,1,0,0|2,0,0]=4 11389 B12R2.291 Oc1ccc(nc1Cl)C2CC2 271570a_100011220607_100000721234 [1,0,0,1,0,0|2,0,0]=4 11390 B12R2.291 Oc1ccc(nc1F)C2CC2 271570a_100011220607_100009819667 [1,0,0,1,0,0|2,0,0]=4 11391 B12R2.291 Oc1nc(ccc1F)C2CC2 271570a_100011220607_100010729010 [1,0,0,1,0,0|2,0,0]=4 11392 B12R2.291 Oc1ncc(cc1Cl)C2CC2 271570a_100011220607_100010238531 [1,0,0,1,0,0|2,0,0]=4 11393 B14R2.966 CC(N[13CH3])c1ccc2c(c1)CCO2 2230a_100159266031_200025704644 [0,1,0,1,0,0|2,0,0]=4 11394 B14R2.966 CC(N[13CH3])c1ccc2c(c1)CCO2 34a_100159266031_200025704644 [0,1,0,1,0,0|2,0,0]=4 11395 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 34a_100000741967_200025704644 [0,1,0,1,0,0|1,0,0]=3 11396 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 7a_100000741967_200025704644 [0,1,0,1,0,0|1,0,0]=3 11397 B14R2.966 CCC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210202 [0,1,0,1,0,0|1,0,1]=4 11398 B14R2.966 CCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210202 [0,1,0,1,0,0|0,0,1]=3 11399 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 2230a_200000219546_200000210301 [0,1,0,1,0,0|1,0,0]=3 11400 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 269982a_200000219546_200000210301 [0,1,0,1,0,0|1,0,0]=3 11401 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 34a_200000219546_200000210301 [0,1,0,1,0,0|1,0,0]=3 11402 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 2230a_200000219546_200025704644 [0,1,0,1,0,0|1,0,0]=3 11403 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 269982a_200000219546_200025704644 [0,1,0,1,0,0|1,0,0]=3 11404 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 34a_200000219546_200025704644 [0,1,0,1,0,0|1,0,0]=3 11405 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 11a_106832991635_100000210863 [0,1,0,1,0,0|1,0,1]=4 11406 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 1626a_100102657272_100000210863 [0,1,0,1,0,0|1,0,1]=4 11407 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 240690a_100102657272_100000210863 [0,1,0,1,0,0|1,0,1]=4 11408 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 527a_100102657272_100000210863 [0,1,0,1,0,0|1,0,1]=4 11409 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 2230a_100159266031_200000210301 [0,1,0,1,0,0|2,0,0]=4 11410 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 269862a_106832991636_100000241315 [0,1,0,1,0,0|2,0,0]=4 11411 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 34a_100159266031_200000210301 [0,1,0,1,0,0|2,0,0]=4 11412 B14R2.966 CNC(C)c1ccc2c(c1)OCC2 269862a_106832991636_100000143635 [0,1,0,1,0,0|2,0,0]=4 11413 B14R2.966 CNC(C)c1ccc2c(c1)OCO2 269862a_106832991636_100000211065 [0,1,0,1,0,0|1,0,0]=3 11414 B14R2.966 CN[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_200000210301 [0,1,0,1,0,0|1,0,0]=3 11415 B14R2.966 COC(C)c1ccc2c(c1)OCO2 34a_100000741967_200000210301 [0,1,0,1,0,0|1,0,0]=3 11416 B14R2.966 COC(C)c1ccc2c(c1)OCO2 7a_100000741967_200000210301 [0,1,0,1,0,0|1,0,0]=3 11417 B14R2.966 C[C@@H](N[13CH3])c1ccc2c(c1)OCO2 2230a_100000744171_200025704644 [0,1,0,1,0,0|1,0,0]=3 11418 B14R2.966 O=C(CF)c1ccc2c(c1)OCO2 1458a_100000210863_100015361967 [0,1,0,1,0,0|1,0,1]=4 11419 B14R2.2167 COc1cc2c(cc1F)CCC2=O 34a_100000092147_200000210301 [0,1,0,1,0,0|1,0,1]=4 11420 B14R2.2167 COc1cc2c(cc1F)CCC2=O 7a_100000092147_200000210301 [0,1,0,1,0,0|1,0,1]=4 11421 B14R2.2167 COc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010233615 [0,1,0,1,0,0|0,0,1]=3 11422 B14R2.2167 [13CH3]Oc1cc2c(cc1F)CCC2=O 34a_100000092147_200025704644 [0,1,0,1,0,0|1,0,1]=4 11423 B14R2.2167 [13CH3]Oc1cc2c(cc1F)CCC2=O 7a_100000092147_200025704644 [0,1,0,1,0,0|1,0,1]=4 11424 B14R2.3818 COc1c(ccc2c1CCC2=O)C 34a_100009867297_200000210301 [0,1,0,1,0,0|1,0,1]=4 11425 B14R2.3818 COc1c(ccc2c1CCC2=O)C 7a_100009867297_200000210301 [0,1,0,1,0,0|1,0,1]=4 11426 B14R2.3818 Cc1ccc2c(c1O[13CH3])CCC2=O 34a_100009867297_200025704644 [0,1,0,1,0,0|1,0,1]=4 11427 B14R2.3818 Cc1ccc2c(c1O[13CH3])CCC2=O 7a_100009867297_200025704644 [0,1,0,1,0,0|1,0,1]=4 11428 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [0,1,0,1,0,0|0,0,2]=4 11429 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [0,1,0,1,0,0|1,0,1]=4 11430 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [0,1,0,1,0,0|0,0,1]=3 11431 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [0,1,0,1,0,0|1,0,1]=4 11432 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [0,1,0,1,0,0|1,0,1]=4 11433 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [0,1,0,1,0,0|1,0,1]=4 11434 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [0,1,0,1,0,0|1,0,1]=4 11435 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000210206 [0,1,0,1,0,0|2,0,0]=4 11436 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100000210206 [0,1,0,1,0,0|2,0,0]=4 11437 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000210206 [0,1,0,1,0,0|1,0,0]=3 11438 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210206 [0,1,0,1,0,0|1,0,0]=3 11439 B14R2.1008 CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210206 [0,1,0,1,0,0|1,0,0]=3 11440 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000210206_100000729065 [0,1,0,1,0,0|2,0,0]=4 11441 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000210206 [0,1,0,1,0,0|2,0,0]=4 11442 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100000210206_100009818566 [0,1,0,1,0,0|2,0,0]=4 11443 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000210206 [0,1,0,1,0,0|2,0,0]=4 11444 B14R2.1008 CN(C)Cc1ccc2c(c1)CCO2 270004a_100102631434_100011218456 [0,1,0,1,0,0|2,0,0]=4 11445 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [0,1,0,1,0,0|1,0,0]=3 11446 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [0,1,0,1,0,0|1,0,0]=3 11447 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [0,1,0,1,0,0|1,0,0]=3 11448 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [0,1,0,1,0,0|1,0,0]=3 11449 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [0,1,0,1,0,0|1,0,0]=3 11450 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [0,1,0,1,0,0|1,0,1]=4 11451 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [0,1,0,1,0,0|0,0,1]=3 11452 B14R2.3168 CCc1cc(ccc1Br)NC2CC2 34a_100010109747_100000211595 [0,1,0,1,0,0|2,0,0]=4 11453 B14R2.3168 CCc1cc(ccc1Br)SC2CC2 62a_100010244631_100000211595 [0,1,0,1,0,0|2,0,0]=4 11454 B14R2.3168 CCc1cc(ccc1Cl)OC2CC2 34a_100000212063_100000211595 [0,1,0,1,0,0|2,0,0]=4 11455 B14R2.3168 CCc1cc(ccc1F)SC2CC2 62a_100010244625_100000211595 [0,1,0,1,0,0|2,0,0]=4 11456 B14R2.3168 CCc1cc(ccc1N)SC2CC2 62a_100000686106_100000211595 [0,1,0,1,0,0|2,0,0]=4 11457 B14R2.3168 CNc1cc(ccc1C)SC2CC2 62a_100020629602_100000211595 [0,1,0,1,0,0|2,0,0]=4 11458 B14R2.3168 CNc1cc(ccc1F)SC2CC2 62a_100011314990_100000211595 [0,1,0,1,0,0|2,0,0]=4 11459 B14R2.3168 CNc1cc(ccc1N)SC2CC2 62a_100000694363_100000211595 [0,1,0,1,0,0|2,0,0]=4 11460 B14R2.3168 COc1cc(ccc1Br)NC2CC2 34a_100000765947_100000211595 [0,1,0,1,0,0|1,0,0]=3 11461 B14R2.3168 COc1cc(ccc1Br)OC2CC2 34a_100011827694_100000211595 [0,1,0,1,0,0|1,0,0]=3 11462 B14R2.3168 COc1cc(ccc1Br)SC2CC2 62a_100012353699_100000211595 [0,1,0,1,0,0|1,0,0]=3 11463 B14R2.3168 COc1cc(ccc1C)NC2CC2 34a_100011279678_100000211595 [0,1,0,1,0,0|1,0,0]=3 11464 B14R2.3168 COc1cc(ccc1C)OC2CC2 34a_100009865632_100000211595 [0,1,0,1,0,0|1,0,0]=3 11465 B14R2.3168 COc1cc(ccc1C)SC2CC2 62a_100011830276_100000211595 [0,1,0,1,0,0|1,0,0]=3 11466 B14R2.3168 COc1cc(ccc1Cl)NC2CC2 34a_100000742311_100000211595 [0,1,0,1,0,0|1,0,0]=3 11467 B14R2.3168 COc1cc(ccc1Cl)OC2CC2 34a_100012186310_100000211595 [0,1,0,1,0,0|1,0,0]=3 11468 B14R2.3168 COc1cc(ccc1Cl)SC2CC2 62a_100011356853_100000211595 [0,1,0,1,0,0|1,0,0]=3 11469 B14R2.3168 COc1cc(ccc1F)NC2CC2 34a_100000701188_100000211595 [0,1,0,1,0,0|1,0,0]=3 11470 B14R2.3168 COc1cc(ccc1F)OC2CC2 34a_100012001760_100000211595 [0,1,0,1,0,0|1,0,0]=3 11471 B14R2.3168 COc1cc(ccc1F)SC2CC2 62a_100011934186_100000211595 [0,1,0,1,0,0|1,0,0]=3 11472 B14R2.3168 COc1cc(ccc1I)NC2CC2 34a_100000746945_100000211595 [0,1,0,1,0,0|1,0,0]=3 11473 B14R2.3168 COc1cc(ccc1N)OC2CC2 34a_100015326901_100000211595 [0,1,0,1,0,0|1,0,0]=3 11474 B14R2.3168 COc1cc(ccc1N)SC2CC2 62a_100011279103_100000211595 [0,1,0,1,0,0|1,0,0]=3 11475 B14R2.3168 COc1cc(ccc1O)NC2CC2 34a_100000726020_100000211595 [0,1,0,1,0,0|0,0,0]=2 11476 B14R2.3168 COc1cc(cnc1C)SC2CC2 62a_100010254219_100000211595 [0,1,0,1,0,0|2,0,0]=4 11477 B14R2.3168 COc1cc(cnc1F)SC2CC2 62a_100010214931_100000211595 [0,1,0,1,0,0|2,0,0]=4 11478 B14R2.3168 COc1cc(cnc1N)SC2CC2 62a_106354213024_100000211595 [0,1,0,1,0,0|2,0,0]=4 11479 B14R2.3168 COc1cc(ncc1C)SC2CC2 62a_100010067687_100000211595 [0,1,0,1,0,0|2,0,0]=4 11480 B14R2.3168 COc1cc(ncc1F)SC2CC2 62a_200010136270_100000211595 [0,1,0,1,0,0|2,0,0]=4 11481 B14R2.3168 COc1cc(ncc1N)SC2CC2 62a_100009887741_100000211595 [0,1,0,1,0,0|2,0,0]=4 11482 B14R2.3168 COc1nc(ccc1N)SC2CC2 62a_100000687816_100000211595 [0,1,0,1,0,0|2,0,0]=4 11483 B14R2.3168 COc1nc(cnc1O)SC2CC2 62a_200010365344_100000211595 [0,1,0,1,0,0|2,0,0]=4 11484 B14R2.3168 CSc1cc(ccc1F)SC2CC2 62a_100010341305_100000211595 [0,1,0,1,0,0|1,1,0]=4 11485 B14R2.3168 N#Cc1cc(ccc1O)NC2CC2 34a_100011249283_100000211595 [0,1,0,1,0,0|2,0,0]=4 11486 B14R2.3168 NCc1cc(ccc1O)SC2CC2 62a_100000730032_100000211595 [0,1,0,1,0,0|2,0,0]=4 11487 B14R2.3168 OCc1cc(ccc1O)SC2CC2 62a_100000184703_100000211595 [0,1,0,1,0,0|2,0,0]=4 11488 B14R2.112 CC=Cc1ccc2c(c1)OCCO2 271570a_100016259895_100000184379 [0,1,0,1,0,0|0,0,2]=4 11489 B14R2.112 CCNc1ccc2c(c1)CCCO2 2230a_100138412508_100000210202 [0,1,0,1,0,0|2,0,0]=4 11490 B14R2.112 CCNc1ccc2c(c1)CCCO2 34a_100138412508_100000210202 [0,1,0,1,0,0|2,0,0]=4 11491 B14R2.112 CCNc1ccc2c(c1)OCCO2 2230a_100020630400_100000210202 [0,1,0,1,0,0|1,0,0]=3 11492 B14R2.112 CCNc1ccc2c(c1)OCCO2 34a_100020630400_100000210202 [0,1,0,1,0,0|1,0,0]=3 11493 B14R2.112 CCOc1ccc2c(c1)CCOC2 34a_100009841951_100000210202 [0,1,0,1,0,0|2,0,0]=4 11494 B14R2.112 CCOc1ccc2c(c1)CCOC2 7a_100009841951_100000210202 [0,1,0,1,0,0|2,0,0]=4 11495 B14R2.112 CCOc1ccc2c(c1)NCCO2 34a_100020636358_100000210202 [0,1,0,1,0,0|2,0,0]=4 11496 B14R2.112 CCOc1ccc2c(c1)OCCO2 34a_100000234341_100000210202 [0,1,0,1,0,0|1,0,0]=3 11497 B14R2.112 CCSc1ccc2c(c1)CCCO2 62a_100000210202_100011393166 [0,1,0,1,0,0|2,0,0]=4 11498 B14R2.112 CCSc1ccc2c(c1)CCCO2 62a_100011393166_100000210202 [0,1,0,1,0,0|2,0,0]=4 11499 B14R2.112 CCSc1ccc2c(c1)COCC2 62a_100000210202_100010128096 [0,1,0,1,0,0|2,0,0]=4 11500 B14R2.112 CCSc1ccc2c(c1)COCC2 62a_100010128096_100000210202 [0,1,0,1,0,0|2,0,0]=4 11501 B14R2.112 CCSc1ccc2c(c1)NCCO2 62a_100000210202_100000708519 [0,1,0,1,0,0|2,0,0]=4 11502 B14R2.112 CCSc1ccc2c(c1)OCCC2 62a_100000210202_100010700467 [0,1,0,1,0,0|2,0,0]=4 11503 B14R2.112 CCSc1ccc2c(c1)OCCC2 62a_100010700467_100000210202 [0,1,0,1,0,0|2,0,0]=4 11504 B14R2.112 CCSc1ccc2c(c1)OCCN2 62a_100000210202_100012355470 [0,1,0,1,0,0|2,0,0]=4 11505 B14R2.112 CCSc1ccc2c(c1)OCCO2 62a_100000210202_100011216881 [0,1,0,1,0,0|1,0,0]=3 11506 B14R2.112 CCSc1ccc2c(c1)OCCO2 62a_100011216881_100000210202 [0,1,0,1,0,0|1,0,0]=3 11507 B14R2.112 CNCc1ccc2c(c1)CCCO2 207a_100102657272_100011934692 [0,1,0,1,0,0|2,0,0]=4 11508 B14R2.112 CNCc1ccc2c(c1)CCCO2 270004a_106832991635_100011934692 [0,1,0,1,0,0|2,0,0]=4 11509 B14R2.112 CNCc1ccc2c(c1)CCOC2 26a_100102657272_100009841951 [0,1,0,1,0,0|2,0,0]=4 11510 B14R2.112 CNCc1ccc2c(c1)OCCO2 207a_100102657272_100000184955 [0,1,0,1,0,0|1,0,0]=3 11511 B14R2.112 CNCc1ccc2c(c1)OCCO2 2230a_100000684186_200000210301 [0,1,0,1,0,0|1,0,0]=3 11512 B14R2.112 CNCc1ccc2c(c1)OCCO2 270004a_106832991635_100000184955 [0,1,0,1,0,0|1,0,0]=3 11513 B14R2.112 CNCc1ccc2c(c1)OCCO2 34a_100000684186_200000210301 [0,1,0,1,0,0|1,0,0]=3 11514 B14R2.112 CNCc1ccc2c(n1)OCCO2 207a_100102657272_100009856165 [0,1,0,1,0,0|2,0,0]=4 11515 B14R2.112 CNCc1ccc2c(n1)OCCO2 270004a_106832991635_100009856165 [0,1,0,1,0,0|2,0,0]=4 11516 B14R2.112 COCc1ccc2c(c1)OCCO2 34a_100000745213_200000210301 [0,1,0,1,0,0|1,0,0]=3 11517 B14R2.112 FCNc1ccc2c(c1)OCCO2 34a_100020630400_100015361967 [0,1,0,1,0,0|2,0,0]=4 11518 B14R2.112 FCOc1ccc2c(c1)OCCO2 34a_100000234341_100015361967 [0,1,0,1,0,0|2,0,0]=4 11519 B14R2.112 FCSc1ccc2c(c1)OCCO2 62a_100011216881_100015361967 [0,1,0,1,0,0|2,0,0]=4 11520 B14R2.112 FCSc1ccc2c(c1)OCCO2 62a_100015361967_100011216881 [0,1,0,1,0,0|2,0,0]=4 11521 B14R2.112 [13CH3]NCc1ccc2c(c1)OCCO2 2230a_100000684186_200025704644 [0,1,0,1,0,0|1,0,0]=3 11522 B14R2.112 [13CH3]NCc1ccc2c(c1)OCCO2 34a_100000684186_200025704644 [0,1,0,1,0,0|1,0,0]=3 11523 B14R2.112 [13CH3]OCc1ccc2c(c1)OCCO2 34a_100000745213_200025704644 [0,1,0,1,0,0|1,0,0]=3 11524 B14R2.583 C=C=Cc1cc2c(cc1O)CCC2 271570a_100015277604_200010659162 [0,1,0,1,0,0|1,0,1]=4 11525 B14R2.583 CC=Cc1cc2c(cc1N)OCO2 271570a_100016259895_100012557033 [0,1,0,1,0,0|0,0,2]=4 11526 B14R2.583 CC=Cc1cc2c(cc1O)CCC2 271570a_100016259895_200010659162 [0,1,0,1,0,0|1,0,0]=3 11527 B14R2.583 CC=Cc1cc2c(cc1O)OCO2 271570a_100016259895_100010290809 [0,1,0,1,0,0|0,0,2]=4 11528 B14R2.583 CCNc1cc2c(cc1C)OCO2 2230a_100000066439_100000210202 [0,1,0,1,0,0|1,0,0]=3 11529 B14R2.583 CCNc1cc2c(cc1C)OCO2 34a_100000066439_100000210202 [0,1,0,1,0,0|1,0,0]=3 11530 B14R2.583 CCNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210202 [0,1,0,1,0,0|1,0,0]=3 11531 B14R2.583 CCOc1cc2c(cc1Br)CCC2 34a_200010659162_100000210202 [0,1,0,1,0,0|1,0,0]=3 11532 B14R2.583 CCOc1cc2c(cc1Br)CCC2 7a_200010659162_100000210202 [0,1,0,1,0,0|1,0,0]=3 11533 B14R2.583 CCOc1cc2c(cc1Br)OCO2 34a_100010290809_100000210202 [0,1,0,1,0,0|1,0,0]=3 11534 B14R2.583 CCOc1cc2c(cc1Br)OCO2 7a_100010290809_100000210202 [0,1,0,1,0,0|1,0,0]=3 11535 B14R2.583 CCOc1cc2c(cc1C)OCO2 34a_100000145572_100000210202 [0,1,0,1,0,0|1,0,0]=3 11536 B14R2.583 CCOc1cc2c(cc1C)OCO2 7a_100000145572_100000210202 [0,1,0,1,0,0|1,0,0]=3 11537 B14R2.583 CCOc1cc2c(cc1F)CCC2 34a_200000146645_100000210202 [0,1,0,1,0,0|1,0,0]=3 11538 B14R2.583 CCOc1cc2c(cc1F)CCC2 7a_200000146645_100000210202 [0,1,0,1,0,0|1,0,0]=3 11539 B14R2.583 CCSc1cc2c(cc1N)OCO2 62a_100012557033_100000210202 [0,1,0,1,0,0|1,0,0]=3 11540 B14R2.583 CCSc1cc2c(cc1O)CCC2 62a_100000210202_200010659162 [0,1,0,1,0,0|0,1,0]=3 11541 B14R2.583 CCSc1cc2c(cc1O)CCC2 62a_200010659162_100000210202 [0,1,0,1,0,0|0,1,0]=3 11542 B14R2.583 CNCc1cc2c(cc1Br)CCC2 26a_100102657272_200010659162 [0,1,0,1,0,0|2,0,0]=4 11543 B14R2.583 CNCc1cc2c(cc1Br)OCO2 2230a_106832991635_100009995336 [0,1,0,1,0,0|1,0,0]=3 11544 B14R2.583 CNCc1cc2c(cc1Br)OCO2 2230a_200011199097_200000210301 [0,1,0,1,0,0|1,0,0]=3 11545 B14R2.583 CNCc1cc2c(cc1Br)OCO2 26a_100102657272_100010290809 [0,1,0,1,0,0|1,0,0]=3 11546 B14R2.583 CNCc1cc2c(cc1Br)OCO2 270004a_106832991635_100000186749 [0,1,0,1,0,0|1,0,0]=3 11547 B14R2.583 CNCc1cc2c(cc1Br)OCO2 34a_100102657272_100009995336 [0,1,0,1,0,0|1,0,0]=3 11548 B14R2.583 CNCc1cc2c(cc1Br)OCO2 7a_106832991635_100009995336 [0,1,0,1,0,0|1,0,0]=3 11549 B14R2.583 CNCc1cc2c(cc1C)OCO2 7a_106832991635_200000112958 [0,1,0,1,0,0|1,0,0]=3 11550 B14R2.583 CNCc1cc2c(cc1Cl)OCO2 207a_100102657272_100000015535 [0,1,0,1,0,0|1,0,0]=3 11551 B14R2.583 CNCc1cc2c(cc1Cl)OCO2 270004a_106832991635_100000015535 [0,1,0,1,0,0|1,0,0]=3 11552 B14R2.583 CNCc1cc2c(cc1Cl)OCO2 7a_106832991635_100000043460 [0,1,0,1,0,0|1,0,0]=3 11553 B14R2.583 CNCc1cc2c(cc1F)CCC2 26a_100102657272_200000146645 [0,1,0,1,0,0|2,0,0]=4 11554 B14R2.583 COCc1cc2c(cc1Br)OCO2 34a_100000187691_200000210301 [0,1,0,1,0,0|1,0,0]=3 11555 B14R2.583 COCc1cc2c(cc1Br)OCO2 34a_100138415774_100009995336 [0,1,0,1,0,0|1,0,0]=3 11556 B14R2.583 COCc1cc2c(cc1Br)OCO2 7a_100000187691_200000210301 [0,1,0,1,0,0|1,0,0]=3 11557 B14R2.583 COCc1cc2c(cc1Cl)OCO2 34a_200000238738_200000210301 [0,1,0,1,0,0|1,0,0]=3 11558 B14R2.583 COCc1cc2c(cc1Cl)OCO2 7a_200000238738_200000210301 [0,1,0,1,0,0|1,0,0]=3 11559 B14R2.583 CSCc1cc2c(cc1Br)OCO2 62a_100009995336_200000210301 [0,1,0,1,0,0|1,0,0]=3 11560 B14R2.583 CSCc1cc2c(cc1Cl)OCO2 62a_100000043460_200000210301 [0,1,0,1,0,0|1,0,0]=3 11561 B14R2.583 Cc1cc2c(cc1NCF)OCO2 34a_100000066439_100015361967 [0,1,0,1,0,0|2,0,0]=4 11562 B14R2.583 Cc1cc2c(cc1OCF)OCO2 34a_100000145572_100015361967 [0,1,0,1,0,0|2,0,0]=4 11563 B14R2.583 Cc1cc2c(cc1OCF)OCO2 7a_100000145572_100015361967 [0,1,0,1,0,0|2,0,0]=4 11564 B14R2.583 FCNc1cc2c(cc1Cl)OCO2 34a_100000234339_100015361967 [0,1,0,1,0,0|2,0,0]=4 11565 B14R2.583 FCOc1cc2c(cc1Br)CCC2 34a_200010659162_100015361967 [0,1,0,1,0,0|1,0,0]=3 11566 B14R2.583 FCOc1cc2c(cc1Br)CCC2 7a_200010659162_100015361967 [0,1,0,1,0,0|1,0,0]=3 11567 B14R2.583 FCOc1cc2c(cc1Br)OCO2 34a_100010290809_100015361967 [0,1,0,1,0,0|2,0,0]=4 11568 B14R2.583 FCOc1cc2c(cc1Br)OCO2 7a_100010290809_100015361967 [0,1,0,1,0,0|2,0,0]=4 11569 B14R2.583 FCOc1cc2c(cc1F)CCC2 34a_200000146645_100015361967 [0,1,0,1,0,0|1,0,0]=3 11570 B14R2.583 FCOc1cc2c(cc1F)CCC2 7a_200000146645_100015361967 [0,1,0,1,0,0|1,0,0]=3 11571 B14R2.583 Nc1cc2c(cc1SCF)OCO2 62a_100012557033_100015361967 [0,1,0,1,0,0|2,0,0]=4 11572 B14R2.583 Oc1cc2c(cc1SCF)CCC2 62a_100015361967_200010659162 [0,1,0,1,0,0|0,1,0]=3 11573 B14R2.583 Oc1cc2c(cc1SCF)CCC2 62a_200010659162_100015361967 [0,1,0,1,0,0|0,1,0]=3 11574 B14R2.583 [13CH3]NCc1cc2c(cc1Br)OCO2 2230a_200011199097_200025704644 [0,1,0,1,0,0|1,0,0]=3 11575 B14R2.583 [13CH3]OCc1cc2c(cc1Br)OCO2 34a_100000187691_200025704644 [0,1,0,1,0,0|1,0,0]=3 11576 B14R2.583 [13CH3]OCc1cc2c(cc1Br)OCO2 7a_100000187691_200025704644 [0,1,0,1,0,0|1,0,0]=3 11577 B14R2.583 [13CH3]OCc1cc2c(cc1Cl)OCO2 34a_200000238738_200025704644 [0,1,0,1,0,0|1,0,0]=3 11578 B14R2.583 [13CH3]OCc1cc2c(cc1Cl)OCO2 7a_200000238738_200025704644 [0,1,0,1,0,0|1,0,0]=3 11579 B14R2.583 [13CH3]SCc1cc2c(cc1Br)OCO2 62a_100009995336_200025704644 [0,1,0,1,0,0|1,0,0]=3 11580 B14R2.583 [13CH3]SCc1cc2c(cc1Cl)OCO2 62a_100000043460_200025704644 [0,1,0,1,0,0|1,0,0]=3 11581 B14R2.3096 CCSc1ccc(c2c1cco2)O 62a_100000210202_200020711608 [0,1,0,1,0,0|1,0,1]=4 11582 B14R2.6188 CCNc1c(ccc2c1CCC2)Br 2230a_202495424074_100000210202 [0,1,0,1,0,0|2,0,0]=4 11583 B14R2.6188 CCNc1c(ccc2c1CCC2)Br 34a_202495424074_100000210202 [0,1,0,1,0,0|2,0,0]=4 11584 B14R2.6188 CCNc1c(ccc2c1CCC2)C 2230a_202495413831_100000210202 [0,1,0,1,0,0|2,0,0]=4 11585 B14R2.6188 CCNc1c(ccc2c1CCC2)C 34a_202495413831_100000210202 [0,1,0,1,0,0|2,0,0]=4 11586 B14R2.6188 CCOc1c(ccc2c1CCC2)Br 34a_100010662108_100000210202 [0,1,0,1,0,0|1,0,0]=3 11587 B14R2.6188 CCOc1c(ccc2c1CCC2)Br 7a_100010662108_100000210202 [0,1,0,1,0,0|1,0,0]=3 11588 B14R2.6188 CNCc1c(ccc2c1CCC2)Br 26a_100102657272_100010662108 [0,1,0,1,0,0|2,0,0]=4 11589 B14R2.6188 Cc1ccc2c(c1NCF)CCC2 34a_202495413831_100015361967 [0,1,0,1,0,0|2,0,0]=4 11590 B14R2.6188 FCNc1c(ccc2c1CCC2)Br 34a_202495424074_100015361967 [0,1,0,1,0,0|2,0,0]=4 11591 B14R2.6188 FCOc1c(ccc2c1CCC2)Br 34a_100010662108_100015361967 [0,1,0,1,0,0|1,0,0]=3 11592 B14R2.6188 FCOc1c(ccc2c1CCC2)Br 7a_100010662108_100015361967 [0,1,0,1,0,0|1,0,0]=3 11593 B14R2.6400 CCNc1ccc2c(c1)CC(O2)C 2230a_100102713350_100000210202 [0,1,0,1,0,0|2,0,0]=4 11594 B14R2.6400 CCNc1ccc2c(c1)CC(O2)C 34a_100102713350_100000210202 [0,1,0,1,0,0|2,0,0]=4 11595 B14R2.6400 CCNc1ccc2nc(oc2c1)C 34a_100000736495_100000210202 [0,1,0,1,0,0|2,0,0]=4 11596 B14R2.6400 CCNc1ccc2oc(nc2c1)C 34a_100000195416_100000210202 [0,1,0,1,0,0|2,0,0]=4 11597 B14R2.6400 CCOc1ccc2cc(oc2c1)C 34a_100000095638_100000210202 [0,1,0,1,0,0|2,0,0]=4 11598 B14R2.6400 CCOc1ccc2cc(oc2c1)C 7a_100000095638_100000210202 [0,1,0,1,0,0|2,0,0]=4 11599 B14R2.6400 CCOc1ccc2nc(oc2c1)C 34a_100000116946_100000210202 [0,1,0,1,0,0|2,0,0]=4 11600 B14R2.6400 CCOc1ccc2nc(oc2c1)C 7a_100000116946_100000210202 [0,1,0,1,0,0|2,0,0]=4 11601 B14R2.6400 CCOc1ccc2oc(nc2c1)C 34a_100000102623_100000210202 [0,1,0,1,0,0|2,0,0]=4 11602 B14R2.6400 CCOc1ccc2oc(nc2c1)C 7a_100000102623_100000210202 [0,1,0,1,0,0|2,0,0]=4 11603 B14R2.6400 CCSc1ccc2nc(oc2c1)C 62a_100000210202_100010171164 [0,1,0,1,0,0|2,0,0]=4 11604 B14R2.6400 CCSc1ccc2oc(nc2c1)C 62a_100000210202_100009816932 [0,1,0,1,0,0|2,0,0]=4 11605 B14R2.6400 CNCc1ccc2cc(oc2c1)C 26a_100102657272_100000095638 [0,1,0,1,0,0|2,0,0]=4 11606 B14R2.6400 CNCc1ccc2nc(oc2c1)C 207a_100102657272_100010272349 [0,1,0,1,0,0|2,0,0]=4 11607 B14R2.6400 CNCc1ccc2nc(oc2c1)C 270004a_106832991635_100010272349 [0,1,0,1,0,0|2,0,0]=4 11608 B14R2.6400 COCc1ccc2nc(oc2c1)C 34a_100010326561_200000210301 [0,1,0,1,0,0|2,0,0]=4 11609 B14R2.6400 COCc1ccc2nc(oc2c1)C 7a_100010326561_200000210301 [0,1,0,1,0,0|2,0,0]=4 11610 B14R2.6400 COCc1ccc2oc(nc2c1)C 34a_200009878806_200000210301 [0,1,0,1,0,0|2,0,0]=4 11611 B14R2.6400 COCc1ccc2oc(nc2c1)C 7a_200009878806_200000210301 [0,1,0,1,0,0|2,0,0]=4 11612 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 34a_200009878806_200025704644 [0,1,0,1,0,0|2,0,0]=4 11613 B14R2.6400 Cc1nc2cc(ccc2o1)CO[13CH3] 7a_200009878806_200025704644 [0,1,0,1,0,0|2,0,0]=4 11614 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 34a_100010326561_200025704644 [0,1,0,1,0,0|2,0,0]=4 11615 B14R2.6400 Cc1nc2ccc(cc2o1)CO[13CH3] 7a_100010326561_200025704644 [0,1,0,1,0,0|2,0,0]=4 11616 B14R2.9645 C=C=Cc1cc(ccc1O)C2CC2 271570a_100015277604_100135415898 [0,1,0,1,0,0|1,0,1]=4 11617 B14R2.9645 CC=Cc1cc(ccc1F)C2CC2 271570a_100016259895_100010281199 [0,1,0,1,0,0|2,0,0]=4 11618 B14R2.9645 CC=Cc1cc(ccc1O)C2CC2 271570a_100016259895_100135415898 [0,1,0,1,0,0|1,0,0]=3 11619 B14R2.9645 CCNc1cc(ccc1F)C2CC2 34a_102516457221_100000210202 [0,1,0,1,0,0|2,0,0]=4 11620 B14R2.9645 CCNc1cc(ccc1F)C2CC2 7a_102516457221_100000210202 [0,1,0,1,0,0|2,0,0]=4 11621 B14R2.9645 CCNc1cc(ccc1N)C2CC2 271570a_100011220607_100000696630 [0,1,0,1,0,0|2,0,0]=4 11622 B14R2.9645 CCOc1cc(ccc1C)C2CC2 271570a_100011220607_100012361169 [0,1,0,1,0,0|1,0,0]=3 11623 B14R2.9645 CCOc1cc(ccc1F)C2CC2 271570a_100011220607_200012344967 [0,1,0,1,0,0|1,0,0]=3 11624 B14R2.9645 CCOc1cc(ccc1F)C2CC2 34a_100118380312_100000210202 [0,1,0,1,0,0|1,0,0]=3 11625 B14R2.9645 CCOc1cc(ccc1F)C2CC2 7a_100118380312_100000210202 [0,1,0,1,0,0|1,0,0]=3 11626 B14R2.9645 CCOc1cc(ccc1N)C2CC2 271570a_100011220607_100000688918 [0,1,0,1,0,0|1,0,0]=3 11627 B14R2.9645 CCOc1cc(cnc1F)C2CC2 271570a_100011220607_100010732568 [0,1,0,1,0,0|2,0,0]=4 11628 B14R2.9645 CCOc1cc(ncc1N)C2CC2 271570a_100011220607_100015764953 [0,1,0,1,0,0|2,0,0]=4 11629 B14R2.9645 CCSc1cc(ccc1F)C2CC2 62a_100000210202_100010281199 [0,1,0,1,0,0|1,1,0]=4 11630 B14R2.9645 CCSc1cc(ccc1F)C2CC2 62a_100010281199_100000210202 [0,1,0,1,0,0|1,1,0]=4 11631 B14R2.9645 CCSc1cc(ccc1O)C2CC2 62a_100000210202_100135415898 [0,1,0,1,0,0|0,1,0]=3 11632 B14R2.9645 CNCc1cc(ccc1C)C2CC2 271570a_100011220607_106744473289 [0,1,0,1,0,0|2,0,0]=4 11633 B14R2.9645 CNCc1cc(ccc1F)C2CC2 26a_100102657272_100118380312 [0,1,0,1,0,0|2,0,0]=4 11634 B14R2.9645 CNCc1cc(ccc1F)C2CC2 271570a_100011220607_100000748472 [0,1,0,1,0,0|2,0,0]=4 11635 B14R2.9645 CNCc1cc(ccc1O)C2CC2 271570a_100011220607_100011602694 [0,1,0,1,0,0|1,0,0]=3 11636 B14R2.9645 COCc1cc(ccc1Br)C2CC2 271570a_100011220607_202125822959 [0,1,0,1,0,0|1,0,0]=3 11637 B14R2.9645 COCc1cc(ccc1F)C2CC2 271570a_100011220607_100010140362 [0,1,0,1,0,0|1,0,0]=3 11638 B14R2.9645 FCNc1cc(ccc1F)C2CC2 34a_102516457221_100015361967 [0,1,0,1,0,0|2,0,0]=4 11639 B14R2.9645 FCNc1cc(ccc1F)C2CC2 7a_102516457221_100015361967 [0,1,0,1,0,0|2,0,0]=4 11640 B14R2.9645 FCOc1cc(ccc1F)C2CC2 34a_100118380312_100015361967 [0,1,0,1,0,0|1,0,0]=3 11641 B14R2.9645 FCOc1cc(ccc1F)C2CC2 7a_100118380312_100015361967 [0,1,0,1,0,0|1,0,0]=3 11642 B14R2.9645 FCSc1cc(ccc1F)C2CC2 62a_100010281199_100015361967 [0,1,0,1,0,0|1,1,0]=4 11643 B14R2.9645 FCSc1cc(ccc1F)C2CC2 62a_100015361967_100010281199 [0,1,0,1,0,0|1,1,0]=4 11644 B14R2.9645 Oc1ccc(cc1SCF)C2CC2 62a_100015361967_100135415898 [0,1,0,1,0,0|0,1,0]=3 11645 B14R2.475 CCNc1ccc2onc(c2c1)C 34a_200000044492_100000210202 [0,1,0,1,0,0|2,0,0]=4 11646 B14R2.475 CCSc1ccc2c(c1)C(=O)CO2 62a_100000210202_100000752586 [0,1,0,1,0,0|2,0,0]=4 11647 B14R2.475 CCSc1ccc2occ(c2c1)C 62a_100000210202_100000728893 [0,1,0,1,0,0|2,0,0]=4 11648 B14R2.475 CCSc1ccc2onc(c2c1)C 62a_100000210202_100010196875 [0,1,0,1,0,0|2,0,0]=4 11649 B14R2.475 CCSc1ccc2onc(c2c1)C 62a_100010196875_100000210202 [0,1,0,1,0,0|2,0,0]=4 11650 B14R2.3062 CCc1cc(ccc1C=O)C2CC2 271570a_100011220607_100010209654 [0,1,0,1,0,0|1,0,1]=4 11651 B14R2.3062 CCc1cc(ccc1NN)C2CC2 271570a_100011220607_100000700371 [0,1,0,1,0,0|2,0,0]=4 11652 B14R2.3062 CCc1cc(ccc1OC)C2CC2 271570a_100011220607_200010179862 [0,1,0,1,0,0|1,0,0]=3 11653 B14R2.3062 CCc1ccc(cc1OC)C2CC2 271570a_100011220607_200010710398 [0,1,0,1,0,0|1,0,0]=3 11654 B14R2.3062 CNc1cc(ccc1C#N)C2CC2 271570a_100011220607_200012356631 [0,1,0,1,0,0|2,0,0]=4 11655 B14R2.3062 COc1cc(ccc1C#N)C2CC2 271570a_100011220607_100000694671 [0,1,0,1,0,0|1,0,0]=3 11656 B14R2.3062 COc1cc(ccc1C=O)C2CC2 271570a_100011220607_100000697075 [0,1,0,1,0,0|0,0,1]=3 11657 B14R2.3062 COc1cc(ccc1CO)C2CC2 271570a_100011220607_100011277633 [0,1,0,1,0,0|0,0,0]=2 11658 B14R2.3062 COc1cc(ccc1SC)C2CC2 271570a_100011220607_200011001119 [0,1,0,1,0,0|0,1,0]=3 11659 B14R2.3062 COc1cc(cnc1C#N)C2CC2 271570a_100011220607_100000719880 [0,1,0,1,0,0|2,0,0]=4 11660 B14R2.3062 COc1cc(cnc1C=O)C2CC2 271570a_100011220607_100010246152 [0,1,0,1,0,0|1,0,1]=4 11661 B14R2.3062 COc1cc(cnc1CO)C2CC2 271570a_100011220607_200010246159 [0,1,0,1,0,0|1,0,0]=3 11662 B14R2.3062 COc1cc(cnc1OC)C2CC2 271570a_100011220607_100010234541 [0,1,0,1,0,0|1,0,0]=3 11663 B14R2.3062 COc1cc(ncc1C#N)C2CC2 271570a_100011220607_100009830018 [0,1,0,1,0,0|2,0,0]=4 11664 B14R2.3062 COc1cc(ncc1CO)C2CC2 271570a_100011220607_100010714672 [0,1,0,1,0,0|1,0,0]=3 11665 B14R2.3062 COc1cc(nnc1OC)C2CC2 271570a_100011220607_200000095610 [0,1,0,1,0,0|2,0,0]=4 11666 B14R2.3062 COc1ccc(cc1C#N)C2CC2 271570a_100011220607_100000188252 [0,1,0,1,0,0|2,0,0]=4 11667 B14R2.3062 COc1ccc(cc1C=O)C2CC2 271570a_100011220607_100000170026 [0,1,0,1,0,0|2,0,0]=4 11668 B14R2.3062 COc1ccc(cc1CN)C2CC2 271570a_100011220607_100000690498 [0,1,0,1,0,0|2,0,0]=4 11669 B14R2.3062 COc1ccc(cc1CO)C2CC2 271570a_100011220607_100000204679 [0,1,0,1,0,0|2,0,0]=4 11670 B14R2.3062 COc1ccc(cc1OC)C2CC2 271570a_100011220607_100000187503 [0,1,0,1,0,0|0,0,0]=2 11671 B14R2.3062 COc1ccc(cc1SC)C2CC2 271570a_100011220607_200009892704 [0,1,0,1,0,0|0,1,0]=3 11672 B14R2.3062 COc1ccc(nc1OC)C2CC2 271570a_100011220607_100010214848 [0,1,0,1,0,0|1,0,0]=3 11673 B14R2.3062 COc1cnc(nc1OC)C2CC2 271570a_100011220607_100010280452 [0,1,0,1,0,0|2,0,0]=4 11674 B14R2.3062 COc1nc(ccc1C#N)C2CC2 271570a_100011220607_100000708423 [0,1,0,1,0,0|2,0,0]=4 11675 B14R2.3062 COc1nc(ccc1C=O)C2CC2 271570a_100011220607_100009864722 [0,1,0,1,0,0|1,0,1]=4 11676 B14R2.3062 COc1nc(ccc1CN)C2CC2 271570a_100011220607_100015687481 [0,1,0,1,0,0|2,0,0]=4 11677 B14R2.3062 COc1nc(ccc1CO)C2CC2 271570a_100011220607_100010988397 [0,1,0,1,0,0|1,0,0]=3 11678 B14R2.3062 COc1nc(ncc1CO)C2CC2 271570a_100011220607_200011024631 [0,1,0,1,0,0|2,0,0]=4 11679 B14R2.3062 COc1ncc(nc1OC)C2CC2 271570a_100011220607_100010132954 [0,1,0,1,0,0|2,0,0]=4 11680 B14R2.3062 OCc1ccc(cc1CO)C2CC2 271570a_100011220607_100000719600 [0,1,0,1,0,0|2,0,0]=4 11681 B14R2.6412 CCSc1ccc2c(c1)CCC2O 62a_100000210202_100000747877 [0,1,0,1,0,0|2,0,0]=4 11682 B14R2.6412 CCSc1ccc2c(c1)CCC2O 62a_100000747877_100000210202 [0,1,0,1,0,0|2,0,0]=4 11683 B14R2.6412 CCSc1ccc2c(c1)OCC2=O 62a_100000210202_100000686717 [0,1,0,1,0,0|1,0,1]=4 11684 B14R2.6412 CCSc1ccc2c(c1)OCC2N 62a_100000210202_100020628175 [0,1,0,1,0,0|2,0,0]=4 11685 B14R2.6412 CCSc1ccc2c(c1)OCC2N 62a_100020628175_100000210202 [0,1,0,1,0,0|2,0,0]=4 11686 B14R2.6412 CNCc1ccc2c(c1)OCC2=O 26a_100102657272_100000216533 [0,1,0,1,0,0|1,0,1]=4 11687 B14R2.624 C=C(C)c1cc2c(cc1O)CCC2 271570a_100000694244_200010659162 [0,1,0,1,0,0|1,0,0]=3 11688 B14R2.945 C=C(C)c1cc(ccc1F)C2CC2 271570a_100000694244_100010281199 [0,1,0,1,0,0|2,0,0]=4 11689 B14R2.945 C=C(C)c1cc(ccc1O)C2CC2 271570a_100000694244_100135415898 [0,1,0,1,0,0|1,0,0]=3 11690 B14R2.945 CC(=O)c1cc(ccc1C)C2CC2 271570a_100011220607_100012706819 [0,1,0,1,0,0|2,0,0]=4 11691 B14R2.945 CC(=O)c1cc(ccc1Cl)C2CC2 271570a_100011220607_100010712560 [0,1,0,1,0,0|2,0,0]=4 11692 B14R2.945 CC(=O)c1cc(ccc1F)C2CC2 271570a_100011220607_100000689017 [0,1,0,1,0,0|2,0,0]=4 11693 B14R2.945 CC(=O)c1cc(ccc1N)C2CC2 271570a_100011220607_100000695420 [0,1,0,1,0,0|2,0,0]=4 11694 B14R2.945 CC(=O)c1cc(ccc1O)C2CC2 271570a_100011220607_100000212127 [0,1,0,1,0,0|1,0,0]=3 11695 B14R2.945 CC(C)c1cc(ccc1F)C2CC2 271570a_100011220607_200053017515 [0,1,0,1,0,0|2,0,0]=4 11696 B14R2.945 CC(C)c1cc(ccc1N)C2CC2 271570a_100011220607_100000694223 [0,1,0,1,0,0|2,0,0]=4 11697 B14R2.945 CC(C)c1cc(ccc1O)C2CC2 271570a_100011220607_100000691460 [0,1,0,1,0,0|1,0,0]=3 11698 B14R2.945 CC(O)c1cc(ccc1F)C2CC2 271570a_100011220607_100011943926 [0,1,0,1,0,0|2,0,0]=4 11699 B14R2.945 CN(C)c1cc(ccc1F)C2CC2 271570a_100011220607_100010288836 [0,1,0,1,0,0|2,0,0]=4 11700 B14R2.945 NC(=O)c1cc(ccc1O)C2CC2 271570a_100011220607_100000192807 [0,1,0,1,0,0|2,0,0]=4 11701 B14R2.945 OB(O)c1cc(ccc1O)C2CC2 271570a_100011220607_200009814749 [0,1,0,1,0,0|2,0,0]=4 11702 B14R2.203 COc1c(ccc2c1CCCC2)Br 34a_200010391107_200000210301 [0,1,0,1,0,0|1,0,0]=3 11703 B14R2.203 COc1c(ccc2c1CCCC2)Br 7a_200010391107_200000210301 [0,1,0,1,0,0|1,0,0]=3 11704 B14R2.203 [13CH3]Oc1c(ccc2c1CCCC2)Br 34a_200010391107_200025704644 [0,1,0,1,0,0|1,0,0]=3 11705 B14R2.203 [13CH3]Oc1c(ccc2c1CCCC2)Br 7a_200010391107_200025704644 [0,1,0,1,0,0|1,0,0]=3 11706 B14R2.991 C#CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000038162 [0,1,0,1,0,0|0,0,2]=4 11707 B14R2.991 C#CCNc1ccc2c(c1)OCO2 34a_100000209953_100000184674 [0,1,0,1,0,0|0,0,2]=4 11708 B14R2.991 C#CCOc1ccc2c(c1)OCO2 34a_100000210298_100000184674 [0,1,0,1,0,0|0,0,2]=4 11709 B14R2.991 C=CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210623 [0,1,0,1,0,0|0,0,2]=4 11710 B14R2.991 C=CCNc1ccc2c(c1)OCO2 34a_100000209953_100015514636 [0,1,0,1,0,0|0,0,2]=4 11711 B14R2.991 C=CCOc1ccc2c(c1)OCO2 34a_100000210298_100015514636 [0,1,0,1,0,0|0,0,2]=4 11712 B14R2.991 CCCCc1cc2c(cn1)OCC2 271570a_100020621405_102495363667 [0,1,0,1,0,0|2,0,0]=4 11713 B14R2.991 CCCCc1ccc2c(c1)CCC2 271570a_100020621405_100000745594 [0,1,0,1,0,0|2,0,0]=4 11714 B14R2.991 CCCCc1ccc2c(c1)CCN2 271570a_100020621405_100000026929 [0,1,0,1,0,0|2,0,0]=4 11715 B14R2.991 CCCCc1ccc2c(c1)CCO2 271570a_100020621405_100000729065 [0,1,0,1,0,0|1,0,0]=3 11716 B14R2.991 CCCCc1ccc2c(c1)NCC2 271570a_100020621405_100000754641 [0,1,0,1,0,0|2,0,0]=4 11717 B14R2.991 CCCCc1ccc2c(c1)OCC2 271570a_100020621405_100009818566 [0,1,0,1,0,0|1,0,0]=3 11718 B14R2.991 CCCCc1ccc2c(c1)OCO2 271570a_100020621405_100000688060 [0,1,0,1,0,0|0,0,0]=2 11719 B14R2.991 CCCCc1ccc2ccoc2c1 271570a_100020621405_100000759542 [0,1,0,1,0,0|1,0,1]=4 11720 B14R2.991 CCCCc1ccc2cnoc2c1 271570a_100020621405_100009817722 [0,1,0,1,0,0|2,0,0]=4 11721 B14R2.991 CCCCc1ccc2ncoc2c1 271570a_100020621405_100009817590 [0,1,0,1,0,0|1,0,1]=4 11722 B14R2.991 CCCCc1ccc2occc2c1 271570a_100020621405_100012343831 [0,1,0,1,0,0|1,0,1]=4 11723 B14R2.991 CCCCc1ccc2ocnc2c1 271570a_100020621405_100009816175 [0,1,0,1,0,0|1,0,1]=4 11724 B14R2.991 CCCCc1ccc2oncc2c1 271570a_100020621405_100009817723 [0,1,0,1,0,0|2,0,0]=4 11725 B14R2.991 CCCNc1ccc2c(c1)CCC2 2230a_100000211504_100000210303 [0,1,0,1,0,0|2,0,0]=4 11726 B14R2.991 CCCNc1ccc2c(c1)CCC2 34a_100000211504_100000210303 [0,1,0,1,0,0|2,0,0]=4 11727 B14R2.991 CCCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210303 [0,1,0,1,0,0|1,0,0]=3 11728 B14R2.991 CCCNc1ccc2c(c1)CCO2 34a_100000736984_100000210303 [0,1,0,1,0,0|1,0,0]=3 11729 B14R2.991 CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210303 [0,1,0,1,0,0|0,0,0]=2 11730 B14R2.991 CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000210303 [0,1,0,1,0,0|0,0,0]=2 11731 B14R2.991 CCCNc1ccc2ccoc2c1 34a_100000102395_100000210303 [0,1,0,1,0,0|1,0,1]=4 11732 B14R2.991 CCCNc1ccc2cnoc2c1 34a_100000084182_100000210303 [0,1,0,1,0,0|2,0,0]=4 11733 B14R2.991 CCCNc1ccc2ncoc2c1 34a_100011248239_100000210303 [0,1,0,1,0,0|1,0,1]=4 11734 B14R2.991 CCCNc1ccc2occc2c1 34a_106430523501_100000210303 [0,1,0,1,0,0|1,0,1]=4 11735 B14R2.991 CCCNc1ccc2ocnc2c1 34a_100011219863_100000210303 [0,1,0,1,0,0|1,0,1]=4 11736 B14R2.991 CCCNc1ccc2oncc2c1 34a_100000037595_100000210303 [0,1,0,1,0,0|2,0,0]=4 11737 B14R2.991 CCCOc1ccc2c(c1)CCC2 34a_100000209987_100000210303 [0,1,0,1,0,0|2,0,0]=4 11738 B14R2.991 CCCOc1ccc2c(c1)CCC2 7a_100000209987_100000210303 [0,1,0,1,0,0|2,0,0]=4 11739 B14R2.991 CCCOc1ccc2c(c1)CCN2 34a_100020636429_100000210303 [0,1,0,1,0,0|2,0,0]=4 11740 B14R2.991 CCCOc1ccc2c(c1)NCC2 34a_100020636427_100000210303 [0,1,0,1,0,0|2,0,0]=4 11741 B14R2.991 CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000210303 [0,1,0,1,0,0|0,0,0]=2 11742 B14R2.991 CCCOc1ccc2ccoc2c1 34a_100000089557_100000210303 [0,1,0,1,0,0|1,0,1]=4 11743 B14R2.991 CCCOc1ccc2ccoc2c1 7a_100000089557_100000210303 [0,1,0,1,0,0|1,0,1]=4 11744 B14R2.991 CCCOc1ccc2cnoc2c1 34a_100000098417_100000210303 [0,1,0,1,0,0|2,0,0]=4 11745 B14R2.991 CCCOc1ccc2cnoc2c1 7a_100000098417_100000210303 [0,1,0,1,0,0|2,0,0]=4 11746 B14R2.991 CCCOc1ccc2occc2c1 34a_100000070125_100000210303 [0,1,0,1,0,0|1,0,1]=4 11747 B14R2.991 CCCOc1ccc2occc2c1 7a_100000070125_100000210303 [0,1,0,1,0,0|1,0,1]=4 11748 B14R2.991 CCCSc1cc2c(cn1)OCC2 62a_100000210303_102495363667 [0,1,0,1,0,0|2,0,0]=4 11749 B14R2.991 CCCSc1cc2c(cn1)OCC2 62a_102495363667_100000210303 [0,1,0,1,0,0|2,0,0]=4 11750 B14R2.991 CCCSc1ccc2c(c1)CCC2 62a_100000210303_100000745594 [0,1,0,1,0,0|2,0,0]=4 11751 B14R2.991 CCCSc1ccc2c(c1)CCC2 62a_100000745594_100000210303 [0,1,0,1,0,0|2,0,0]=4 11752 B14R2.991 CCCSc1ccc2c(c1)CCN2 62a_100000210303_100000691068 [0,1,0,1,0,0|2,0,0]=4 11753 B14R2.991 CCCSc1ccc2c(c1)CCN2 62a_100000691068_100000210303 [0,1,0,1,0,0|2,0,0]=4 11754 B14R2.991 CCCSc1ccc2c(c1)CCO2 62a_100000210303_100000729065 [0,1,0,1,0,0|1,0,0]=3 11755 B14R2.991 CCCSc1ccc2c(c1)CCO2 62a_100000729065_100000210303 [0,1,0,1,0,0|1,0,0]=3 11756 B14R2.991 CCCSc1ccc2c(c1)NCC2 62a_100000210303_100000754641 [0,1,0,1,0,0|2,0,0]=4 11757 B14R2.991 CCCSc1ccc2c(c1)NCC2 62a_100000754641_100000210303 [0,1,0,1,0,0|2,0,0]=4 11758 B14R2.991 CCCSc1ccc2c(c1)OCC2 62a_100000210303_100009818566 [0,1,0,1,0,0|1,0,0]=3 11759 B14R2.991 CCCSc1ccc2c(c1)OCC2 62a_100009818566_100000210303 [0,1,0,1,0,0|1,0,0]=3 11760 B14R2.991 CCCSc1ccc2ccoc2c1 62a_100000210303_100000759542 [0,1,0,1,0,0|1,0,1]=4 11761 B14R2.991 CCCSc1ccc2cnoc2c1 62a_100000210303_100009817722 [0,1,0,1,0,0|2,0,0]=4 11762 B14R2.991 CCCSc1ccc2ncoc2c1 62a_100000210303_100009817590 [0,1,0,1,0,0|1,0,1]=4 11763 B14R2.991 CCCSc1ccc2occc2c1 62a_100000210303_100000691453 [0,1,0,1,0,0|1,0,1]=4 11764 B14R2.991 CCCSc1ccc2ocnc2c1 62a_100000210303_100009816175 [0,1,0,1,0,0|1,0,1]=4 11765 B14R2.991 CCCSc1ccc2oncc2c1 62a_100000210303_100009817723 [0,1,0,1,0,0|2,0,0]=4 11766 B14R2.991 CCNCc1ccc2c(c1)CCC2 207a_100015525214_100000765347 [0,1,0,1,0,0|2,0,0]=4 11767 B14R2.991 CCNCc1ccc2c(c1)CCC2 270004a_100015525214_100000765347 [0,1,0,1,0,0|2,0,0]=4 11768 B14R2.991 CCNCc1ccc2c(c1)CCO2 207a_100015525214_100011218456 [0,1,0,1,0,0|1,0,0]=3 11769 B14R2.991 CCNCc1ccc2c(c1)CCO2 2230a_100011219410_100000210202 [0,1,0,1,0,0|1,0,0]=3 11770 B14R2.991 CCNCc1ccc2c(c1)CCO2 270004a_100015525214_100011218456 [0,1,0,1,0,0|1,0,0]=3 11771 B14R2.991 CCNCc1ccc2c(c1)CCO2 34a_100011219410_100000210202 [0,1,0,1,0,0|1,0,0]=3 11772 B14R2.991 CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210202 [0,1,0,1,0,0|0,0,0]=2 11773 B14R2.991 CCNCc1ccc2c(c1)OCO2 34a_100000210006_100000210202 [0,1,0,1,0,0|0,0,0]=2 11774 B14R2.991 CCNCc1ccc2ncoc2c1 207a_100015525214_100000059852 [0,1,0,1,0,0|1,0,1]=4 11775 B14R2.991 CCNCc1ccc2ncoc2c1 2230a_100015525214_106359897996 [0,1,0,1,0,0|1,0,1]=4 11776 B14R2.991 CCNCc1ccc2ncoc2c1 270004a_100015525214_100000059852 [0,1,0,1,0,0|1,0,1]=4 11777 B14R2.991 CCNCc1ccc2occc2c1 207a_100015525214_100000040644 [0,1,0,1,0,0|1,0,1]=4 11778 B14R2.991 CCNCc1ccc2occc2c1 2230a_100020591328_100000210202 [0,1,0,1,0,0|1,0,1]=4 11779 B14R2.991 CCNCc1ccc2occc2c1 270004a_100015525214_100000040644 [0,1,0,1,0,0|1,0,1]=4 11780 B14R2.991 CCNCc1ccc2occc2c1 34a_100020591328_100000210202 [0,1,0,1,0,0|1,0,1]=4 11781 B14R2.991 CCNCc1ccc2ocnc2c1 207a_100015525214_100010271902 [0,1,0,1,0,0|1,0,1]=4 11782 B14R2.991 CCNCc1ccc2ocnc2c1 2230a_100015525214_200010203175 [0,1,0,1,0,0|1,0,1]=4 11783 B14R2.991 CCNCc1ccc2ocnc2c1 270004a_100015525214_100010271902 [0,1,0,1,0,0|1,0,1]=4 11784 B14R2.991 CCOCc1ccc2c(c1)CCC2 34a_200000765175_100000210202 [0,1,0,1,0,0|2,0,0]=4 11785 B14R2.991 CCOCc1ccc2c(c1)CCC2 7a_200000765175_100000210202 [0,1,0,1,0,0|2,0,0]=4 11786 B14R2.991 CCOCc1ccc2c(c1)CCO2 34a_100011219353_100000210202 [0,1,0,1,0,0|1,0,0]=3 11787 B14R2.991 CCOCc1ccc2c(c1)CCO2 7a_100011219353_100000210202 [0,1,0,1,0,0|1,0,0]=3 11788 B14R2.991 CCOCc1ccc2c(c1)NCC2 34a_100000694088_100000210202 [0,1,0,1,0,0|2,0,0]=4 11789 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100000210967_100000210202 [0,1,0,1,0,0|0,0,0]=2 11790 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100121572206_100000189651 [0,1,0,1,0,0|0,0,0]=2 11791 B14R2.991 CCOCc1ccc2ccoc2c1 34a_200009859634_100000210202 [0,1,0,1,0,0|1,0,1]=4 11792 B14R2.991 CCOCc1ccc2ccoc2c1 7a_200009859634_100000210202 [0,1,0,1,0,0|1,0,1]=4 11793 B14R2.991 CCOCc1ccc2ncoc2c1 34a_100121572206_106359897996 [0,1,0,1,0,0|1,0,1]=4 11794 B14R2.991 CCOCc1ccc2occc2c1 34a_100000067418_100000210202 [0,1,0,1,0,0|1,0,1]=4 11795 B14R2.991 CCOCc1ccc2occc2c1 7a_100000067418_100000210202 [0,1,0,1,0,0|1,0,1]=4 11796 B14R2.991 CCOCc1ccc2ocnc2c1 34a_100121572206_200010203175 [0,1,0,1,0,0|1,0,1]=4 11797 B14R2.991 CCSCc1ccc2ncoc2c1 62a_100000210202_106359897996 [0,1,0,1,0,0|1,0,1]=4 11798 B14R2.991 CCSCc1ccc2ncoc2c1 62a_106359897996_100000210202 [0,1,0,1,0,0|1,0,1]=4 11799 B14R2.991 CCSCc1ccc2ocnc2c1 62a_100000210202_200010203175 [0,1,0,1,0,0|1,0,1]=4 11800 B14R2.991 CNCCc1ccc2c(c1)CCO2 2230a_106832991635_100000763274 [0,1,0,1,0,0|1,0,0]=3 11801 B14R2.991 CNCCc1ccc2c(c1)CCO2 34a_100102657272_100000763274 [0,1,0,1,0,0|1,0,0]=3 11802 B14R2.991 CNCCc1ccc2c(c1)CCO2 7a_106832991635_100000763274 [0,1,0,1,0,0|1,0,0]=3 11803 B14R2.991 CNCCc1ccc2c(c1)OCO2 2230a_100000204656_200000210301 [0,1,0,1,0,0|0,0,0]=2 11804 B14R2.991 CNCCc1ccc2c(c1)OCO2 34a_100000204656_200000210301 [0,1,0,1,0,0|0,0,0]=2 11805 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100012161074_200000210301 [0,1,0,1,0,0|1,0,0]=3 11806 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100138415774_100000763274 [0,1,0,1,0,0|1,0,0]=3 11807 B14R2.991 COCCc1ccc2c(c1)CCO2 7a_100012161074_200000210301 [0,1,0,1,0,0|1,0,0]=3 11808 B14R2.991 COCCc1ccc2c(c1)OCO2 34a_100011934097_200000210301 [0,1,0,1,0,0|0,0,0]=2 11809 B14R2.991 COCNc1ccc2c(c1)CCO2 2230a_100000736984_100000766300 [0,1,0,1,0,0|2,0,0]=4 11810 B14R2.991 COCNc1ccc2c(c1)OCO2 2230a_100000209953_100000766300 [0,1,0,1,0,0|1,0,0]=3 11811 B14R2.991 COCSc1ccc2c(c1)CCO2 62a_100000729065_100000766300 [0,1,0,1,0,0|2,0,0]=4 11812 B14R2.991 COCSc1ccc2c(c1)CCO2 62a_100000766300_100000729065 [0,1,0,1,0,0|2,0,0]=4 11813 B14R2.991 COCSc1ccc2c(c1)OCC2 62a_100000766300_100009818566 [0,1,0,1,0,0|2,0,0]=4 11814 B14R2.991 COCSc1ccc2c(c1)OCC2 62a_100009818566_100000766300 [0,1,0,1,0,0|2,0,0]=4 11815 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_100000763274_200000210301 [0,1,0,1,0,0|1,0,0]=3 11816 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_200000210301_100000763274 [0,1,0,1,0,0|1,0,0]=3 11817 B14R2.991 CSCNc1ccc2c(c1)CCO2 2230a_100000736984_100011218213 [0,1,0,1,0,0|2,0,0]=4 11818 B14R2.991 CSCNc1ccc2c(c1)CCO2 34a_100000736984_100011218213 [0,1,0,1,0,0|2,0,0]=4 11819 B14R2.991 CSCNc1ccc2c(c1)OCO2 2230a_100000209953_100011218213 [0,1,0,1,0,0|1,0,0]=3 11820 B14R2.991 CSCNc1ccc2c(c1)OCO2 34a_100000209953_100011218213 [0,1,0,1,0,0|1,0,0]=3 11821 B14R2.991 CSCOc1ccc2c(c1)OCO2 34a_100000210298_100011218213 [0,1,0,1,0,0|1,0,0]=3 11822 B14R2.991 CSCSc1ccc2c(c1)CCO2 62a_100000729065_100011218213 [0,1,0,1,0,0|2,0,0]=4 11823 B14R2.991 CSCSc1ccc2c(c1)CCO2 62a_100011218213_100000729065 [0,1,0,1,0,0|2,0,0]=4 11824 B14R2.991 CSCSc1ccc2c(c1)OCC2 62a_100009818566_100011218213 [0,1,0,1,0,0|2,0,0]=4 11825 B14R2.991 CSCSc1ccc2c(c1)OCC2 62a_100011218213_100009818566 [0,1,0,1,0,0|2,0,0]=4 11826 B14R2.991 FCCNc1ccc2c(c1)CCO2 2230a_100000736984_100011217306 [0,1,0,1,0,0|2,0,0]=4 11827 B14R2.991 FCCNc1ccc2c(c1)CCO2 34a_100000736984_100011217306 [0,1,0,1,0,0|2,0,0]=4 11828 B14R2.991 FCCNc1ccc2c(c1)OCO2 2230a_100000209953_100011217306 [0,1,0,1,0,0|1,0,0]=3 11829 B14R2.991 FCCNc1ccc2c(c1)OCO2 34a_100000209953_100011217306 [0,1,0,1,0,0|1,0,0]=3 11830 B14R2.991 FCCOc1ccc2c(c1)OCO2 34a_100000210298_100011217306 [0,1,0,1,0,0|1,0,0]=3 11831 B14R2.991 FCCSc1ccc2c(c1)CCO2 62a_100000729065_100011217306 [0,1,0,1,0,0|2,0,0]=4 11832 B14R2.991 FCCSc1ccc2c(c1)CCO2 62a_100011217306_100000729065 [0,1,0,1,0,0|2,0,0]=4 11833 B14R2.991 FCCSc1ccc2c(c1)OCC2 62a_100009818566_100011217306 [0,1,0,1,0,0|2,0,0]=4 11834 B14R2.991 FCCSc1ccc2c(c1)OCC2 62a_100011217306_100009818566 [0,1,0,1,0,0|2,0,0]=4 11835 B14R2.991 FCNCc1ccc2c(c1)CCO2 34a_100011219410_100015361967 [0,1,0,1,0,0|2,0,0]=4 11836 B14R2.991 FCNCc1ccc2c(c1)OCO2 34a_100000210006_100015361967 [0,1,0,1,0,0|1,0,0]=3 11837 B14R2.991 FCOCc1ccc2c(c1)CCO2 34a_100011219353_100015361967 [0,1,0,1,0,0|2,0,0]=4 11838 B14R2.991 FCOCc1ccc2c(c1)CCO2 7a_100011219353_100015361967 [0,1,0,1,0,0|2,0,0]=4 11839 B14R2.991 FCOCc1ccc2c(c1)OCO2 34a_100000210967_100015361967 [0,1,0,1,0,0|1,0,0]=3 11840 B14R2.991 N#CCNc1ccc2c(c1)OCO2 2230a_100000209953_100011215382 [0,1,0,1,0,0|1,0,1]=4 11841 B14R2.991 O=CCNc1ccc2c(c1)OCO2 2230a_100000209953_200015260668 [0,1,0,1,0,0|1,0,1]=4 11842 B14R2.991 O=CCNc1ccc2c(c1)OCO2 34a_100000209953_200009817547 [0,1,0,1,0,0|1,0,1]=4 11843 B14R2.991 O=CCOc1ccc2c(c1)OCO2 34a_100000210298_200009817547 [0,1,0,1,0,0|1,0,1]=4 11844 B14R2.991 OCCNc1ccc2c(c1)CCO2 2230a_100000736984_100000211926 [0,1,0,1,0,0|2,0,0]=4 11845 B14R2.991 OCCNc1ccc2c(c1)CCO2 34a_100000736984_100000211926 [0,1,0,1,0,0|2,0,0]=4 11846 B14R2.991 OCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000211926 [0,1,0,1,0,0|1,0,0]=3 11847 B14R2.991 OCCNc1ccc2c(c1)OCO2 34a_100000209953_100000211926 [0,1,0,1,0,0|1,0,0]=3 11848 B14R2.991 OCCOc1ccc2c(c1)OCO2 34a_100000210298_100000211926 [0,1,0,1,0,0|1,0,0]=3 11849 B14R2.991 OCCSc1ccc2c(c1)CCO2 62a_100000211926_100000729065 [0,1,0,1,0,0|2,0,0]=4 11850 B14R2.991 OCCSc1ccc2c(c1)CCO2 62a_100000729065_100000211926 [0,1,0,1,0,0|2,0,0]=4 11851 B14R2.991 OCCSc1ccc2c(c1)OCC2 62a_100000211926_100009818566 [0,1,0,1,0,0|2,0,0]=4 11852 B14R2.991 OCCSc1ccc2c(c1)OCC2 62a_100009818566_100000211926 [0,1,0,1,0,0|2,0,0]=4 11853 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 2230a_100000204656_200025704644 [0,1,0,1,0,0|0,0,0]=2 11854 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 34a_100000204656_200025704644 [0,1,0,1,0,0|0,0,0]=2 11855 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 34a_100012161074_200025704644 [0,1,0,1,0,0|1,0,0]=3 11856 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 7a_100012161074_200025704644 [0,1,0,1,0,0|1,0,0]=3 11857 B14R2.991 [13CH3]OCCc1ccc2c(c1)OCO2 34a_100011934097_200025704644 [0,1,0,1,0,0|0,0,0]=2 11858 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_100000763274_200025704644 [0,1,0,1,0,0|1,0,0]=3 11859 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_200025704644_100000763274 [0,1,0,1,0,0|1,0,0]=3 11860 B14R2.1128 CSc1cc2c(cc1F)NCCC2 62a_100000762356_200000210301 [0,1,0,1,0,0|1,1,0]=4 11861 B14R2.1128 CSc1cc2c(cc1F)NCCC2 62a_200000210301_100000762356 [0,1,0,1,0,0|1,1,0]=4 11862 B14R2.1128 [13CH3]Sc1cc2c(cc1F)NCCC2 62a_100000762356_200025704644 [0,1,0,1,0,0|1,1,0]=4 11863 B14R2.1128 [13CH3]Sc1cc2c(cc1F)NCCC2 62a_200025704644_100000762356 [0,1,0,1,0,0|1,1,0]=4 11864 B14R2.1416 COc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_200010010916 [0,1,0,1,0,0|0,0,1]=3 11865 B14R2.1416 COc1cc2cnn(c2cc1O)C 271570a_203496583355_200021298667 [0,1,0,1,0,0|1,0,1]=4 11866 B14R2.808 CC=Cc1ccc2c(c1C)OCO2 271570a_100016259895_100010335860 [0,1,0,1,0,0|0,0,2]=4 11867 B14R2.808 CC=Cc1ccc2c(c1F)OCO2 271570a_100016259895_100010223184 [0,1,0,1,0,0|0,0,2]=4 11868 B14R2.808 CCSc1ccc2c(c1C)OCO2 62a_100010335860_100000210202 [0,1,0,1,0,0|1,0,0]=3 11869 B14R2.808 CCSc1ccc2c(c1F)OCO2 62a_100010223184_100000210202 [0,1,0,1,0,0|1,0,0]=3 11870 B14R2.808 Cc1c(ccc2c1OCO2)SCF 62a_100010335860_100015361967 [0,1,0,1,0,0|2,0,0]=4 11871 B14R2.808 FCSc1ccc2c(c1F)OCO2 62a_100010223184_100015361967 [0,1,0,1,0,0|2,0,0]=4 11872 B14R2.18625 COc1c(ccc(c1F)C2CC2)Cl 271570a_100011220607_200135222481 [0,1,0,1,0,0|1,0,0]=3 11873 B14R2.18625 COc1c(ccc(c1F)C2CC2)N 271570a_100011220607_100010734149 [0,1,0,1,0,0|1,0,0]=3 11874 B14R2.18625 CSc1c(ccc(c1F)C2CC2)F 271570a_100011220607_202125771753 [0,1,0,1,0,0|1,1,0]=4 11875 B14R2.2292 CNc1cc(c(cc1N)F)C2CC2 271570a_100011220607_100013631271 [0,1,0,1,0,0|2,0,0]=4 11876 B14R2.2292 COc1cc(c(cc1Br)Br)C2CC2 271570a_100011220607_200014006352 [0,1,0,1,0,0|1,0,0]=3 11877 B14R2.2292 COc1cc(c(cc1C)N)C2CC2 271570a_100011220607_200010584344 [0,1,0,1,0,0|1,0,0]=3 11878 B14R2.2292 COc1cc(c(cc1Cl)F)C2CC2 271570a_100011220607_100010739614 [0,1,0,1,0,0|1,0,0]=3 11879 B14R2.2292 COc1cc(c(cc1F)C)C2CC2 271570a_100011220607_100011009880 [0,1,0,1,0,0|1,0,0]=3 11880 B14R2.2292 COc1cc(c(cc1F)F)C2CC2 271570a_100011220607_200015541288 [0,1,0,1,0,0|1,0,0]=3 11881 B14R2.2292 COc1cc(c(cc1F)N)C2CC2 271570a_100011220607_100010365326 [0,1,0,1,0,0|1,0,0]=3 11882 B14R2.2292 COc1cc(c(cc1N)C)C2CC2 271570a_100011220607_100010141321 [0,1,0,1,0,0|1,0,0]=3 11883 B14R2.2292 COc1cc(c(cc1N)F)C2CC2 271570a_100011220607_100012766639 [0,1,0,1,0,0|1,0,0]=3 11884 B14R2.2292 COc1cc(c(cc1O)F)C2CC2 271570a_100011220607_100010189133 [0,1,0,1,0,0|0,0,0]=2 11885 B14R2.2292 COc1cc(c(nc1N)C)C2CC2 271570a_100011220607_200010892190 [0,1,0,1,0,0|2,0,0]=4 11886 B14R2.2292 O=Cc1cc(c(cc1O)F)C2CC2 271570a_100011220607_100010175118 [0,1,0,1,0,0|2,0,0]=4 11887 B14R2.2292 O=Cc1cc(c(cc1O)O)C2CC2 271570a_100011220607_200010132312 [0,1,0,1,0,0|2,0,0]=4 11888 B14R2.587 CNCc1cc(c2c(c1)CCO2)Br 207a_100102657272_100009816904 [0,1,0,1,0,0|2,0,0]=4 11889 B14R2.587 CNCc1cc(c2c(c1)CCO2)Br 270004a_106832991635_100009816904 [0,1,0,1,0,0|2,0,0]=4 11890 B14R2.587 CNCc1cc(c2c(c1)OCO2)Br 207a_100102657272_100000682445 [0,1,0,1,0,0|1,0,0]=3 11891 B14R2.587 CNCc1cc(c2c(c1)OCO2)Br 270004a_106832991635_100000682445 [0,1,0,1,0,0|1,0,0]=3 11892 B14R2.587 CNCc1cc(c2c(c1)OCO2)Cl 207a_100102657272_100000016197 [0,1,0,1,0,0|1,0,0]=3 11893 B14R2.587 CNCc1cc(c2c(c1)OCO2)Cl 270004a_106832991635_100000016197 [0,1,0,1,0,0|1,0,0]=3 11894 B14R2.587 COCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200000210301 [0,1,0,1,0,0|1,0,0]=3 11895 B14R2.587 COCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_200000210301 [0,1,0,1,0,0|1,0,0]=3 11896 B14R2.587 [13CH3]OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200025704644 [0,1,0,1,0,0|1,0,0]=3 11897 B14R2.587 [13CH3]OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_200025704644 [0,1,0,1,0,0|1,0,0]=3 11898 B14R2.746 CCc1cc(cc(c1N)C)C2CC2 271570a_100011220607_200000186424 [0,1,0,1,0,0|2,0,0]=4 11899 B14R2.746 CCc1cc(cc(c1O)C)C2CC2 271570a_100011220607_100010659108 [0,1,0,1,0,0|1,0,0]=3 11900 B14R2.746 COc1cc(cc(c1F)C)C2CC2 271570a_100011220607_100010271686 [0,1,0,1,0,0|1,0,0]=3 11901 B14R2.746 COc1cc(cc(c1F)F)C2CC2 271570a_100011220607_100011218012 [0,1,0,1,0,0|1,0,0]=3 11902 B14R2.746 COc1cc(cc(c1F)O)C2CC2 271570a_100011220607_200015524394 [0,1,0,1,0,0|1,0,0]=3 11903 B14R2.746 COc1cc(cc(c1N)C)C2CC2 271570a_100011220607_100000741850 [0,1,0,1,0,0|1,0,0]=3 11904 B14R2.746 Cc1cc(cc(c1O)C#N)C2CC2 271570a_100011220607_100010195408 [0,1,0,1,0,0|2,0,0]=4 11905 B14R2.746 O=Cc1cc(cc(c1O)F)C2CC2 271570a_100011220607_100011217654 [0,1,0,1,0,0|2,0,0]=4 11906 B14R3.3015 c1c(ncc2c1CCO2)C3CC3 271570a_100011220607_102495363667 [0,0,0,2,0,0|2,0,0]=4 11907 B14R3.3015 c1cc2c(cc1C3CC3)CCC2 271570a_100011220607_100000745594 [0,0,0,2,0,0|2,0,0]=4 11908 B14R3.3015 c1cc2c(cc1C3CC3)CCN2 271570a_100011220607_100000026929 [0,0,0,2,0,0|2,0,0]=4 11909 B14R3.3015 c1cc2c(cc1C3CC3)CCO2 271570a_100011220607_100000729065 [0,0,0,2,0,0|1,0,0]=3 11910 B14R3.3015 c1cc2c(cc1C3CC3)NCC2 271570a_100011220607_100000754641 [0,0,0,2,0,0|2,0,0]=4 11911 B14R3.3015 c1cc2c(cc1C3CC3)OCC2 271570a_100011220607_100009818566 [0,0,0,2,0,0|1,0,0]=3 11912 B14R3.3015 c1cc2c(cc1C3CC3)OCO2 271570a_100011220607_100000688060 [0,0,0,2,0,0|0,0,0]=2 11913 B14R3.3015 c1cc2cc(ccc2o1)C3CC3 271570a_100011220607_100012343831 [0,0,0,2,0,0|1,0,1]=4 11914 B14R3.3015 c1cc2ccc(cc2o1)C3CC3 271570a_100011220607_100000759542 [0,0,0,2,0,0|1,0,1]=4 11915 B14R3.3015 c1cc2cnoc2cc1C3CC3 271570a_100011220607_100009817722 [0,0,0,2,0,0|2,0,0]=4 11916 B14R3.3015 c1cc2oncc2cc1C3CC3 271570a_100011220607_100009817723 [0,0,0,2,0,0|2,0,0]=4 11917 B14R3.3015 c1nc2cc(ccc2o1)C3CC3 271570a_100011220607_100009816175 [0,0,0,2,0,0|1,0,1]=4 11918 B14R3.3015 c1nc2ccc(cc2o1)C3CC3 271570a_100011220607_100009817590 [0,0,0,2,0,0|1,0,1]=4 11919 B10R1.5 CNCc1occc1OC 207a_100102657272_200009856553 [1,0,0,0,1,0|2,0,0]=4 11920 B10R1.5 CNCc1occc1OC 270004a_106832991635_200009856553 [1,0,0,0,1,0|2,0,0]=4 11921 B10R1.5 CNCc1sccc1OC 207a_100102657272_100000689126 [1,0,0,0,1,0|2,0,0]=4 11922 B10R1.5 CNCc1sccc1OC 270004a_106832991635_100000689126 [1,0,0,0,1,0|2,0,0]=4 11923 B10R1.96 CCCc1ccc(s1)SC 62a_100010157708_200000210301 [1,0,0,0,1,0|1,1,0]=4 11924 B10R1.96 CCCc1ccc(s1)SC 62a_200000210301_100010157708 [1,0,0,0,1,0|1,1,0]=4 11925 B10R1.96 CCCc1ccc(s1)S[13CH3] 62a_100010157708_200025704644 [1,0,0,0,1,0|1,1,0]=4 11926 B10R1.96 CCCc1ccc(s1)S[13CH3] 62a_200025704644_100010157708 [1,0,0,0,1,0|1,1,0]=4 11927 B12R1.112 CC=Cc1ccc(cc1OC)O 271570a_100016259895_100011827694 [0,0,0,0,1,1|0,0,2]=4 11928 B12R1.112 CCNc1ccc(cc1OC)Br 34a_100011279103_100000210202 [0,0,0,0,1,1|2,0,0]=4 11929 B12R1.112 CCNc1ccc(cc1OC)C 2230a_100000746441_100000210202 [0,0,0,0,1,1|2,0,0]=4 11930 B12R1.112 CCNc1ccc(cc1OC)C 34a_100000746441_100000210202 [0,0,0,0,1,1|2,0,0]=4 11931 B12R1.112 CCNc1ccc(cc1OC)Cl 34a_100000707585_100000210202 [0,0,0,0,1,1|2,0,0]=4 11932 B12R1.112 CCNc1ccc(cc1OC)F 34a_100000737216_100000210202 [0,0,0,0,1,1|2,0,0]=4 11933 B12R1.112 CCNc1ccc(cc1OC)I 34a_100015196925_100000210202 [0,0,0,0,1,1|2,0,0]=4 11934 B12R1.112 CCNc1ccc(cc1OC)O 34a_100015326901_100000210202 [0,0,0,0,1,1|1,0,0]=3 11935 B12R1.112 CCOc1ccc(cc1CC)O 271570a_203496583355_200010070707 [0,0,0,0,1,1|2,0,0]=4 11936 B12R1.112 CCOc1ccc(cc1OC)Br 34a_100000694246_100000210202 [0,0,0,0,1,1|2,0,0]=4 11937 B12R1.112 CCOc1ccc(cc1OC)Br 7a_100000694246_100000210202 [0,0,0,0,1,1|2,0,0]=4 11938 B12R1.112 CCOc1ccc(cc1OC)C 34a_100000186466_100000210202 [0,0,0,0,1,1|2,0,0]=4 11939 B12R1.112 CCOc1ccc(cc1OC)Cl 34a_100000033002_100000210202 [0,0,0,0,1,1|2,0,0]=4 11940 B12R1.112 CCOc1ccc(cc1OC)F 34a_100000036057_100000210202 [0,0,0,0,1,1|2,0,0]=4 11941 B12R1.112 CCOc1ccc(cc1OC)F 7a_100000036057_100000210202 [0,0,0,0,1,1|2,0,0]=4 11942 B12R1.112 CCOc1ccc(cc1OC)I 34a_100000049635_100000210202 [0,0,0,0,1,1|2,0,0]=4 11943 B12R1.112 CCOc1ccc(cc1OC)N 34a_100000726020_100000210202 [0,0,0,0,1,1|2,0,0]=4 11944 B12R1.112 CCOc1ccc(cc1OC)O 271570a_203496583355_200012344064 [0,0,0,0,1,1|1,0,0]=3 11945 B12R1.112 CCOc1ccc(nc1OC)Br 34a_100010893133_100000210202 [0,0,0,0,1,1|2,0,0]=4 11946 B12R1.112 CCOc1ncc(cc1OC)O 271570a_203496583355_200010116856 [0,0,0,0,1,1|2,0,0]=4 11947 B12R1.112 CCSc1ccc(cc1OC)Br 62a_100000210202_100010245111 [0,0,0,0,1,1|2,0,0]=4 11948 B12R1.112 CCSc1ccc(cc1OC)Br 62a_100010245111_100000210202 [0,0,0,0,1,1|2,0,0]=4 11949 B12R1.112 CCSc1ccc(cc1OC)C 62a_100000210202_100010200004 [0,0,0,0,1,1|2,0,0]=4 11950 B12R1.112 CCSc1ccc(cc1OC)C 62a_100010200004_100000210202 [0,0,0,0,1,1|2,0,0]=4 11951 B12R1.112 CCSc1ccc(cc1OC)Cl 62a_100000050115_100000210202 [0,0,0,0,1,1|2,0,0]=4 11952 B12R1.112 CCSc1ccc(cc1OC)Cl 62a_100000210202_100000050115 [0,0,0,0,1,1|2,0,0]=4 11953 B12R1.112 CCSc1ccc(cc1OC)F 62a_100000210202_100000757151 [0,0,0,0,1,1|2,0,0]=4 11954 B12R1.112 CCSc1ccc(cc1OC)F 62a_100000757151_100000210202 [0,0,0,0,1,1|2,0,0]=4 11955 B12R1.112 CCSc1ccc(cc1OC)N 62a_100000210202_100000765947 [0,0,0,0,1,1|2,0,0]=4 11956 B12R1.112 CCSc1ccc(cc1OC)N 62a_100000765947_100000210202 [0,0,0,0,1,1|2,0,0]=4 11957 B12R1.112 CCSc1ccc(cc1OC)O 62a_100000210202_100011827694 [0,0,0,0,1,1|1,0,0]=3 11958 B12R1.112 CCSc1ccc(nc1OC)C 62a_100000210202_100010138632 [0,0,0,0,1,1|2,0,0]=4 11959 B12R1.112 CCSc1ccc(nc1OC)C 62a_100010138632_100000210202 [0,0,0,0,1,1|2,0,0]=4 11960 B12R1.112 CCSc1ccc(nc1OC)N 62a_100000210202_100010187630 [0,0,0,0,1,1|2,0,0]=4 11961 B12R1.112 CCSc1ccc(nc1OC)N 62a_100010187630_100000210202 [0,0,0,0,1,1|2,0,0]=4 11962 B12R1.112 CNCc1ccc(cc1OC)Br 207a_100102657272_100000697075 [0,0,0,0,1,1|2,0,0]=4 11963 B12R1.112 CNCc1ccc(cc1OC)Br 2230a_106832991635_100012359436 [0,0,0,0,1,1|2,0,0]=4 11964 B12R1.112 CNCc1ccc(cc1OC)Br 26a_100102657272_100000694246 [0,0,0,0,1,1|2,0,0]=4 11965 B12R1.112 CNCc1ccc(cc1OC)Br 270004a_106832991635_100000697075 [0,0,0,0,1,1|2,0,0]=4 11966 B12R1.112 CNCc1ccc(cc1OC)Br 34a_100102657272_100012359436 [0,0,0,0,1,1|2,0,0]=4 11967 B12R1.112 CNCc1ccc(cc1OC)Br 7a_106832991635_100012359436 [0,0,0,0,1,1|2,0,0]=4 11968 B12R1.112 CNCc1ccc(cc1OC)C 207a_100102657272_100000689369 [0,0,0,0,1,1|2,0,0]=4 11969 B12R1.112 CNCc1ccc(cc1OC)C 270004a_106832991635_100000689369 [0,0,0,0,1,1|2,0,0]=4 11970 B12R1.112 CNCc1ccc(cc1OC)Cl 207a_100102657272_100000235374 [0,0,0,0,1,1|2,0,0]=4 11971 B12R1.112 CNCc1ccc(cc1OC)Cl 270004a_106832991635_100000235374 [0,0,0,0,1,1|2,0,0]=4 11972 B12R1.112 CNCc1ccc(cc1OC)F 207a_100102657272_100000042785 [0,0,0,0,1,1|2,0,0]=4 11973 B12R1.112 CNCc1ccc(cc1OC)F 2230a_106832991635_200010171551 [0,0,0,0,1,1|2,0,0]=4 11974 B12R1.112 CNCc1ccc(cc1OC)F 270004a_106832991635_100000042785 [0,0,0,0,1,1|2,0,0]=4 11975 B12R1.112 CNCc1ccc(cc1OC)F 34a_100000062129_200000210301 [0,0,0,0,1,1|2,0,0]=4 11976 B12R1.112 CNCc1ccc(cc1OC)F 34a_100102657272_200010171551 [0,0,0,0,1,1|2,0,0]=4 11977 B12R1.112 CNCc1ccc(cc1OC)F 7a_106832991635_200010171551 [0,0,0,0,1,1|2,0,0]=4 11978 B12R1.112 CNCc1ccc(cc1OC)I 207a_100102657272_100010290300 [0,0,0,0,1,1|2,0,0]=4 11979 B12R1.112 CNCc1ccc(nc1OC)Br 2230a_106832991635_100016029037 [0,0,0,0,1,1|2,0,0]=4 11980 B12R1.112 CNCc1ccc(nc1OC)Br 34a_100102657272_100016029037 [0,0,0,0,1,1|2,0,0]=4 11981 B12R1.112 CNCc1ccc(nc1OC)Br 7a_106832991635_100016029037 [0,0,0,0,1,1|2,0,0]=4 11982 B12R1.112 CNCc1ccc(nc1OC)Cl 2230a_100015687481_200000210301 [0,0,0,0,1,1|2,0,0]=4 11983 B12R1.112 CNCc1ccc(nc1OC)Cl 34a_100015687481_200000210301 [0,0,0,0,1,1|2,0,0]=4 11984 B12R1.112 COCc1ccc(cc1OC)Br 34a_100011277633_200000210301 [0,0,0,0,1,1|2,0,0]=4 11985 B12R1.112 COCc1ccc(cc1OC)Br 34a_100138415774_100012359436 [0,0,0,0,1,1|2,0,0]=4 11986 B12R1.112 COCc1ccc(cc1OC)Br 7a_100011277633_200000210301 [0,0,0,0,1,1|2,0,0]=4 11987 B12R1.112 COCc1ccc(cc1OC)C 34a_200012017176_200000210301 [0,0,0,0,1,1|2,0,0]=4 11988 B12R1.112 COCc1ccc(cc1OC)C 7a_200012017176_200000210301 [0,0,0,0,1,1|2,0,0]=4 11989 B12R1.112 COCc1ccc(cc1OC)Cl 34a_200011215853_200000210301 [0,0,0,0,1,1|2,0,0]=4 11990 B12R1.112 COCc1ccc(cc1OC)Cl 7a_200011215853_200000210301 [0,0,0,0,1,1|2,0,0]=4 11991 B12R1.112 COCc1ccc(cc1OC)F 34a_100000117171_200000210301 [0,0,0,0,1,1|2,0,0]=4 11992 B12R1.112 COCc1ccc(cc1OC)F 34a_100138415774_200010171551 [0,0,0,0,1,1|2,0,0]=4 11993 B12R1.112 COCc1ccc(cc1OC)F 7a_100000117171_200000210301 [0,0,0,0,1,1|2,0,0]=4 11994 B12R1.112 COCc1ccc(cc1OC)I 34a_100010233823_200000210301 [0,0,0,0,1,1|2,0,0]=4 11995 B12R1.112 COCc1ccc(cc1OC)I 7a_100010233823_200000210301 [0,0,0,0,1,1|2,0,0]=4 11996 B12R1.112 COCc1ccc(cc1OC)N 34a_100012183141_200000210301 [0,0,0,0,1,1|2,0,0]=4 11997 B12R1.112 COCc1ccc(nc1OC)Br 34a_100010988397_200000210301 [0,0,0,0,1,1|2,0,0]=4 11998 B12R1.112 COCc1ccc(nc1OC)Br 34a_100138415774_100016029037 [0,0,0,0,1,1|2,0,0]=4 11999 B12R1.112 COCc1ccc(nc1OC)Cl 34a_200009869906_200000210301 [0,0,0,0,1,1|2,0,0]=4 12000 B12R1.112 COc1cc(ccc1CC#N)O 271570a_203496583355_100010245117 [0,0,0,0,1,1|1,0,1]=4 12001 B12R1.112 COc1cc(ccc1CN[13CH3])F 34a_100000062129_200025704644 [0,0,0,0,1,1|2,0,0]=4 12002 B12R1.112 COc1cc(ccc1CO[13CH3])Br 34a_100011277633_200025704644 [0,0,0,0,1,1|2,0,0]=4 12003 B12R1.112 COc1cc(ccc1CO[13CH3])Br 7a_100011277633_200025704644 [0,0,0,0,1,1|2,0,0]=4 12004 B12R1.112 COc1cc(ccc1CO[13CH3])C 34a_200012017176_200025704644 [0,0,0,0,1,1|2,0,0]=4 12005 B12R1.112 COc1cc(ccc1CO[13CH3])C 7a_200012017176_200025704644 [0,0,0,0,1,1|2,0,0]=4 12006 B12R1.112 COc1cc(ccc1CO[13CH3])Cl 34a_200011215853_200025704644 [0,0,0,0,1,1|2,0,0]=4 12007 B12R1.112 COc1cc(ccc1CO[13CH3])Cl 7a_200011215853_200025704644 [0,0,0,0,1,1|2,0,0]=4 12008 B12R1.112 COc1cc(ccc1CO[13CH3])F 34a_100000117171_200025704644 [0,0,0,0,1,1|2,0,0]=4 12009 B12R1.112 COc1cc(ccc1CO[13CH3])F 7a_100000117171_200025704644 [0,0,0,0,1,1|2,0,0]=4 12010 B12R1.112 COc1cc(ccc1CO[13CH3])I 34a_100010233823_200025704644 [0,0,0,0,1,1|2,0,0]=4 12011 B12R1.112 COc1cc(ccc1CO[13CH3])I 7a_100010233823_200025704644 [0,0,0,0,1,1|2,0,0]=4 12012 B12R1.112 COc1cc(ccc1CO[13CH3])N 34a_100012183141_200025704644 [0,0,0,0,1,1|2,0,0]=4 12013 B12R1.112 COc1cc(ccc1CSC)Br 62a_100012359436_200000210301 [0,0,0,0,1,1|2,0,0]=4 12014 B12R1.112 COc1cc(ccc1CSC)Br 62a_200000210301_100012359436 [0,0,0,0,1,1|2,0,0]=4 12015 B12R1.112 COc1cc(ccc1CSC)F 62a_200000210301_200010171551 [0,0,0,0,1,1|2,0,0]=4 12016 B12R1.112 COc1cc(ccc1CSC)F 62a_200010171551_200000210301 [0,0,0,0,1,1|2,0,0]=4 12017 B12R1.112 COc1cc(ccc1CS[13CH3])Br 62a_100012359436_200025704644 [0,0,0,0,1,1|2,0,0]=4 12018 B12R1.112 COc1cc(ccc1CS[13CH3])Br 62a_200025704644_100012359436 [0,0,0,0,1,1|2,0,0]=4 12019 B12R1.112 COc1cc(ccc1CS[13CH3])F 62a_200010171551_200025704644 [0,0,0,0,1,1|2,0,0]=4 12020 B12R1.112 COc1cc(ccc1CS[13CH3])F 62a_200025704644_200010171551 [0,0,0,0,1,1|2,0,0]=4 12021 B12R1.112 COc1cc(ccc1NCF)O 34a_100015326901_100015361967 [0,0,0,0,1,1|2,0,0]=4 12022 B12R1.112 COc1cc(ccc1SCF)O 62a_100015361967_100011827694 [0,0,0,0,1,1|2,0,0]=4 12023 B12R1.112 COc1nc(ccc1CN[13CH3])Cl 2230a_100015687481_200025704644 [0,0,0,0,1,1|2,0,0]=4 12024 B12R1.112 COc1nc(ccc1CN[13CH3])Cl 34a_100015687481_200025704644 [0,0,0,0,1,1|2,0,0]=4 12025 B12R1.112 COc1nc(ccc1CO[13CH3])Br 34a_100010988397_200025704644 [0,0,0,0,1,1|2,0,0]=4 12026 B12R1.112 COc1nc(ccc1CO[13CH3])Cl 34a_200009869906_200025704644 [0,0,0,0,1,1|2,0,0]=4 12027 B12R1.112 COc1nc(ccc1CSC)Br 62a_100016029037_200000210301 [0,0,0,0,1,1|2,0,0]=4 12028 B12R1.112 COc1nc(ccc1CSC)Br 62a_200000210301_100016029037 [0,0,0,0,1,1|2,0,0]=4 12029 B12R1.112 COc1nc(ccc1CS[13CH3])Br 62a_100016029037_200025704644 [0,0,0,0,1,1|2,0,0]=4 12030 B12R1.112 COc1nc(ccc1CS[13CH3])Br 62a_200025704644_100016029037 [0,0,0,0,1,1|2,0,0]=4 12031 B12R1.542 CC=Cc1cccc(c1OC)O 271570a_100016259895_100010234590 [0,0,0,0,1,1|0,0,2]=4 12032 B12R1.542 CC=Cc1nccc(c1OC)O 271570a_100016259895_100000104430 [0,0,0,0,1,1|0,0,2]=4 12033 B12R1.542 CCNc1cccc(c1OC)Br 34a_100011935253_100000210202 [0,0,0,0,1,1|2,0,0]=4 12034 B12R1.542 CCNc1cccc(c1OC)C 34a_100012017360_100000210202 [0,0,0,0,1,1|2,0,0]=4 12035 B12R1.542 CCNc1cccc(c1OC)Cl 2230a_100000743799_100000210202 [0,0,0,0,1,1|2,0,0]=4 12036 B12R1.542 CCNc1cccc(c1OC)Cl 34a_100000743799_100000210202 [0,0,0,0,1,1|2,0,0]=4 12037 B12R1.542 CCNc1cccc(c1OC)F 34a_100011215007_100000210202 [0,0,0,0,1,1|2,0,0]=4 12038 B12R1.542 CCOc1cccc(c1OC)Br 34a_100010234590_100000210202 [0,0,0,0,1,1|2,0,0]=4 12039 B12R1.542 CCOc1cccc(c1OC)Cl 34a_200009886253_100000210202 [0,0,0,0,1,1|2,0,0]=4 12040 B12R1.542 CCOc1cccc(c1OC)Cl 7a_200009886253_100000210202 [0,0,0,0,1,1|2,0,0]=4 12041 B12R1.542 CCOc1ccnc(c1OC)Cl 34a_100000104430_100000210202 [0,0,0,0,1,1|2,0,0]=4 12042 B12R1.542 CCSc1cccc(c1OC)Br 62a_100000210202_100010146560 [0,0,0,0,1,1|2,0,0]=4 12043 B12R1.542 CCSc1cccc(c1OC)Br 62a_100010146560_100000210202 [0,0,0,0,1,1|2,0,0]=4 12044 B12R1.542 CCSc1cccc(c1OC)C 62a_100000210202_100010141385 [0,0,0,0,1,1|2,0,0]=4 12045 B12R1.542 CCSc1cccc(c1OC)C 62a_100010141385_100000210202 [0,0,0,0,1,1|2,0,0]=4 12046 B12R1.542 CCSc1cccc(c1OC)Cl 62a_100000210202_100010147678 [0,0,0,0,1,1|2,0,0]=4 12047 B12R1.542 CCSc1cccc(c1OC)Cl 62a_100010147678_100000210202 [0,0,0,0,1,1|2,0,0]=4 12048 B12R1.542 CCSc1cccc(c1OC)F 62a_100000210202_100009816759 [0,0,0,0,1,1|2,0,0]=4 12049 B12R1.542 CCSc1cccc(c1OC)F 62a_100009816759_100000210202 [0,0,0,0,1,1|2,0,0]=4 12050 B12R1.542 CCSc1cccc(c1OC)N 62a_100011935253_100000210202 [0,0,0,0,1,1|2,0,0]=4 12051 B12R1.542 CCSc1cccc(c1OC)O 62a_100000210202_100010234590 [0,0,0,0,1,1|1,0,0]=3 12052 B12R1.542 CCSc1ccnc(c1OC)C 62a_100000210202_100000685116 [0,0,0,0,1,1|2,0,0]=4 12053 B12R1.542 CCSc1ccnc(c1OC)C 62a_100000685116_100000210202 [0,0,0,0,1,1|2,0,0]=4 12054 B12R1.542 CCSc1ccnc(c1OC)Cl 62a_100000210202_100010068014 [0,0,0,0,1,1|2,0,0]=4 12055 B12R1.542 CCSc1ccnc(c1OC)Cl 62a_100010068014_100000210202 [0,0,0,0,1,1|2,0,0]=4 12056 B12R1.542 CCSc1ccnc(c1OC)N 62a_100000210202_100009880012 [0,0,0,0,1,1|2,0,0]=4 12057 B12R1.542 CCSc1ccnc(c1OC)N 62a_100009880012_100000210202 [0,0,0,0,1,1|2,0,0]=4 12058 B12R1.542 CCSc1cncc(c1OC)N 62a_100000210202_100012359933 [0,0,0,0,1,1|2,0,0]=4 12059 B12R1.542 CCSc1cncc(c1OC)N 62a_100012359933_100000210202 [0,0,0,0,1,1|2,0,0]=4 12060 B12R1.542 CCSc1nccc(c1OC)N 62a_100000104429_100000210202 [0,0,0,0,1,1|2,0,0]=4 12061 B12R1.542 CCSc1nccc(c1OC)N 62a_100000210202_100000104429 [0,0,0,0,1,1|2,0,0]=4 12062 B12R1.542 CCSc1nccc(c1OC)O 62a_100000210202_100000104430 [0,0,0,0,1,1|1,0,0]=3 12063 B12R1.542 CNCc1cccc(c1OC)Br 207a_100102657272_100000692592 [0,0,0,0,1,1|2,0,0]=4 12064 B12R1.542 CNCc1cccc(c1OC)Br 2230a_106832991635_100011470457 [0,0,0,0,1,1|2,0,0]=4 12065 B12R1.542 CNCc1cccc(c1OC)Br 26a_100102657272_100010234590 [0,0,0,0,1,1|2,0,0]=4 12066 B12R1.542 CNCc1cccc(c1OC)Br 270004a_106832991635_100000692592 [0,0,0,0,1,1|2,0,0]=4 12067 B12R1.542 CNCc1cccc(c1OC)Br 34a_100102657272_100011470457 [0,0,0,0,1,1|2,0,0]=4 12068 B12R1.542 CNCc1cccc(c1OC)Br 7a_106832991635_100011470457 [0,0,0,0,1,1|2,0,0]=4 12069 B12R1.542 CNCc1cccc(c1OC)C 207a_100102657272_100011361485 [0,0,0,0,1,1|2,0,0]=4 12070 B12R1.542 CNCc1cccc(c1OC)C 2230a_106832991635_100012349798 [0,0,0,0,1,1|2,0,0]=4 12071 B12R1.542 CNCc1cccc(c1OC)C 270004a_106832991635_100011361485 [0,0,0,0,1,1|2,0,0]=4 12072 B12R1.542 CNCc1cccc(c1OC)C 34a_100102657272_100012349798 [0,0,0,0,1,1|2,0,0]=4 12073 B12R1.542 CNCc1cccc(c1OC)C 7a_106832991635_100012349798 [0,0,0,0,1,1|2,0,0]=4 12074 B12R1.542 CNCc1cccc(c1OC)Cl 207a_100102657272_100011466644 [0,0,0,0,1,1|2,0,0]=4 12075 B12R1.542 CNCc1cccc(c1OC)Cl 26a_100102657272_200009886253 [0,0,0,0,1,1|2,0,0]=4 12076 B12R1.542 CNCc1cccc(c1OC)Cl 270004a_106832991635_100011466644 [0,0,0,0,1,1|2,0,0]=4 12077 B12R1.542 CNCc1cccc(c1OC)F 207a_100102657272_100011830294 [0,0,0,0,1,1|2,0,0]=4 12078 B12R1.542 CNCc1cccc(c1OC)F 270004a_106832991635_100011830294 [0,0,0,0,1,1|2,0,0]=4 12079 B12R1.542 CNCc1cccc(c1OC)F 34a_100137345168_200000210301 [0,0,0,0,1,1|2,0,0]=4 12080 B12R1.542 CNCc1ccnc(c1OC)Br 270004a_106832991635_200009814792 [0,0,0,0,1,1|2,0,0]=4 12081 B12R1.542 CNCc1ccnc(c1OC)Cl 207a_100102657272_100009863717 [0,0,0,0,1,1|2,0,0]=4 12082 B12R1.542 CNCc1ccnc(c1OC)Cl 270004a_106832991635_100009863717 [0,0,0,0,1,1|2,0,0]=4 12083 B12R1.542 CNCc1cncc(c1OC)Br 207a_100102657272_100015834815 [0,0,0,0,1,1|2,0,0]=4 12084 B12R1.542 CNCc1cncc(c1OC)Br 270004a_106832991635_100015834815 [0,0,0,0,1,1|2,0,0]=4 12085 B12R1.542 CNCc1nccc(c1OC)Cl 2230a_106832991635_100015371371 [0,0,0,0,1,1|2,0,0]=4 12086 B12R1.542 CNCc1nccc(c1OC)Cl 34a_100102657272_100015371371 [0,0,0,0,1,1|2,0,0]=4 12087 B12R1.542 CNCc1nccc(c1OC)Cl 7a_106832991635_100015371371 [0,0,0,0,1,1|2,0,0]=4 12088 B12R1.542 COCc1cccc(c1OC)Br 34a_100000704359_200000210301 [0,0,0,0,1,1|2,0,0]=4 12089 B12R1.542 COCc1cccc(c1OC)Br 34a_100138415774_100011470457 [0,0,0,0,1,1|2,0,0]=4 12090 B12R1.542 COCc1cccc(c1OC)Br 7a_100000704359_200000210301 [0,0,0,0,1,1|2,0,0]=4 12091 B12R1.542 COCc1cccc(c1OC)C 34a_100012184769_200000210301 [0,0,0,0,1,1|2,0,0]=4 12092 B12R1.542 COCc1cccc(c1OC)C 34a_100138415774_100012349798 [0,0,0,0,1,1|2,0,0]=4 12093 B12R1.542 COCc1cccc(c1OC)C 7a_100012184769_200000210301 [0,0,0,0,1,1|2,0,0]=4 12094 B12R1.542 COCc1cccc(c1OC)F 34a_100011830279_200000210301 [0,0,0,0,1,1|2,0,0]=4 12095 B12R1.542 COCc1cccc(c1OC)F 7a_100011830279_200000210301 [0,0,0,0,1,1|2,0,0]=4 12096 B12R1.542 COCc1nccc(c1OC)Cl 34a_100009869429_200000210301 [0,0,0,0,1,1|2,0,0]=4 12097 B12R1.542 COCc1nccc(c1OC)Cl 34a_100138415774_100015371371 [0,0,0,0,1,1|2,0,0]=4 12098 B12R1.542 COc1c(cccc1CC#N)O 271570a_203496583355_100010146820 [0,0,0,0,1,1|1,0,1]=4 12099 B12R1.542 COc1c(cccc1CN[13CH3])F 34a_100137345168_200025704644 [0,0,0,0,1,1|2,0,0]=4 12100 B12R1.542 COc1c(cccc1CO[13CH3])Br 34a_100000704359_200025704644 [0,0,0,0,1,1|2,0,0]=4 12101 B12R1.542 COc1c(cccc1CO[13CH3])Br 7a_100000704359_200025704644 [0,0,0,0,1,1|2,0,0]=4 12102 B12R1.542 COc1c(cccc1CO[13CH3])C 34a_100012184769_200025704644 [0,0,0,0,1,1|2,0,0]=4 12103 B12R1.542 COc1c(cccc1CO[13CH3])C 7a_100012184769_200025704644 [0,0,0,0,1,1|2,0,0]=4 12104 B12R1.542 COc1c(cccc1CO[13CH3])F 34a_100011830279_200025704644 [0,0,0,0,1,1|2,0,0]=4 12105 B12R1.542 COc1c(cccc1CO[13CH3])F 7a_100011830279_200025704644 [0,0,0,0,1,1|2,0,0]=4 12106 B12R1.542 COc1c(cccc1CSC)Br 62a_100011470457_200000210301 [0,0,0,0,1,1|2,0,0]=4 12107 B12R1.542 COc1c(cccc1CSC)Br 62a_200000210301_100011470457 [0,0,0,0,1,1|2,0,0]=4 12108 B12R1.542 COc1c(cccc1CSC)C 62a_100012349798_200000210301 [0,0,0,0,1,1|2,0,0]=4 12109 B12R1.542 COc1c(cccc1CSC)C 62a_200000210301_100012349798 [0,0,0,0,1,1|2,0,0]=4 12110 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_100011470457_200025704644 [0,0,0,0,1,1|2,0,0]=4 12111 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_200025704644_100011470457 [0,0,0,0,1,1|2,0,0]=4 12112 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_100012349798_200025704644 [0,0,0,0,1,1|2,0,0]=4 12113 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_200025704644_100012349798 [0,0,0,0,1,1|2,0,0]=4 12114 B12R1.542 COc1c(cccc1SCF)O 62a_100015361967_100010234590 [0,0,0,0,1,1|2,0,0]=4 12115 B12R1.542 COc1c(ccnc1CO[13CH3])Cl 34a_100009869429_200025704644 [0,0,0,0,1,1|2,0,0]=4 12116 B12R1.542 COc1c(ccnc1CSC)Cl 62a_100015371371_200000210301 [0,0,0,0,1,1|2,0,0]=4 12117 B12R1.542 COc1c(ccnc1CSC)Cl 62a_200000210301_100015371371 [0,0,0,0,1,1|2,0,0]=4 12118 B12R1.542 COc1c(ccnc1CS[13CH3])Cl 62a_100015371371_200025704644 [0,0,0,0,1,1|2,0,0]=4 12119 B12R1.542 COc1c(ccnc1CS[13CH3])Cl 62a_200025704644_100015371371 [0,0,0,0,1,1|2,0,0]=4 12120 B12R1.542 COc1c(ccnc1SCF)O 62a_100015361967_100000104430 [0,0,0,0,1,1|2,0,0]=4