0 B11R1.13 C=C=Cc1cccc(c1Br)O 271570a_100015277604_100010187914 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.13 C=C=Cc1cccc(c1C)Br 271570a_100015277604_100012353703 [0,0,0,0,0,0|2,0,2]=4 2 B11R1.13 C=C=Cc1cccc(c1C)C 271570a_100015277604_100011214922 [0,0,0,0,0,0|1,0,2]=3 3 B11R1.13 C=C=Cc1cccc(c1C)Cl 271570a_100015277604_100000726075 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.13 C=C=Cc1cccc(c1C)F 271570a_100015277604_100011216893 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.13 C=C=Cc1cccc(c1C)N 271570a_100015277604_100000761887 [0,0,0,0,0,0|2,0,2]=4 6 B11R1.13 C=C=Cc1cccc(c1C)O 271570a_100015277604_100012002258 [0,0,0,0,0,0|2,0,2]=4 7 B11R1.13 C=C=Cc1cccc(c1Cl)Br 271570a_100015277604_100010142854 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.13 C=C=Cc1cccc(c1Cl)C 271570a_100015277604_200012352035 [0,0,0,0,0,0|1,0,2]=3 9 B11R1.13 C=C=Cc1cccc(c1Cl)Cl 271570a_100015277604_100011215384 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.13 C=C=Cc1cccc(c1Cl)F 271570a_100015277604_200010234923 [0,0,0,0,0,0|2,0,2]=4 11 B11R1.13 C=C=Cc1cccc(c1Cl)O 271570a_100015277604_100000049636 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.13 C=C=Cc1cccc(c1F)Br 271570a_100015277604_100000702267 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.13 C=C=Cc1cccc(c1F)C 271570a_100015277604_100000717567 [0,0,0,0,0,0|1,0,2]=3 14 B11R1.13 C=C=Cc1cccc(c1F)Cl 271570a_100015277604_100011217346 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.13 C=C=Cc1cccc(c1F)F 271570a_100015277604_100000694657 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.13 C=C=Cc1cccc(c1F)N 271570a_100015277604_100011935091 [0,0,0,0,0,0|2,0,2]=4 17 B11R1.13 C=C=Cc1cccc(c1F)O 271570a_100015277604_100009817021 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.13 C=C=Cc1cccc(c1N)Br 271570a_100015277604_100010146558 [0,0,0,0,0,0|2,0,2]=4 19 B11R1.13 C=C=Cc1cccc(c1N)C 271570a_100015277604_100011834072 [0,0,0,0,0,0|1,0,2]=3 20 B11R1.13 C=C=Cc1cccc(c1N)Cl 271570a_100015277604_100010190421 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.13 C=C=Cc1cccc(c1N)F 271570a_100015277604_100000042321 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.13 C=C=Cc1cccc(c1N)N 271570a_100015277604_100015191791 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.13 C=C=Cc1cccc(c1N)O 271570a_100015277604_100011934926 [0,0,0,0,0,0|2,0,2]=4 24 B11R1.13 C=C=Cc1cccc(c1O)Br 271570a_100015277604_100010084509 [0,0,0,0,0,0|1,0,2]=3 25 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [0,0,0,0,0,0|0,0,2]=2 26 B11R1.13 C=C=Cc1cccc(c1O)Cl 271570a_100015277604_100010202889 [0,0,0,0,0,0|1,0,2]=3 27 B11R1.13 C=C=Cc1cccc(c1O)F 271570a_100015277604_100009813666 [0,0,0,0,0,0|1,0,2]=3 28 B11R1.13 C=C=Cc1cccc(c1O)N 271570a_100015277604_100011934915 [0,0,0,0,0,0|1,0,2]=3 29 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [0,0,0,0,0,0|1,0,2]=3 30 B11R1.13 C=C=Cc1cccn(c1=O)C 271570a_100015277604_100000687173 [0,0,0,0,0,0|1,0,3]=4 31 B11R1.13 C=C=Cc1ccnc(c1C)C 271570a_100015277604_100009846815 [0,0,0,0,0,0|2,0,2]=4 32 B11R1.13 C=C=Cc1ccnc(c1Cl)C 271570a_100015277604_100000698670 [0,0,0,0,0,0|2,0,2]=4 33 B11R1.13 C=C=Cc1ccnc(c1F)C 271570a_100015277604_100009849794 [0,0,0,0,0,0|2,0,2]=4 34 B11R1.13 C=C=Cc1ccnc(c1N)C 271570a_100015277604_100009885578 [0,0,0,0,0,0|2,0,2]=4 35 B11R1.13 C=C=Cc1cncc(c1C)C 271570a_100015277604_100009864703 [0,0,0,0,0,0|2,0,2]=4 36 B11R1.13 C=C=Cc1cncc(c1N)C 271570a_100015277604_100009818025 [0,0,0,0,0,0|2,0,2]=4 37 B11R1.13 C=C=Cc1nccc(c1C)C 271570a_100015277604_100009847204 [0,0,0,0,0,0|2,0,2]=4 38 B11R1.13 C=C=Cc1nccc(c1F)C 271570a_100015277604_100009817629 [0,0,0,0,0,0|2,0,2]=4 39 B11R1.13 C=C=Cc1nccc(c1N)C 271570a_100015277604_100000763560 [0,0,0,0,0,0|2,0,2]=4 40 B11R1.13 C=C=Cc1nccc(c1O)C 271570a_100015277604_100000696282 [0,0,0,0,0,0|1,0,2]=3 41 B11R1.13 C=C=Cc1nccc(c1O)F 271570a_100015277604_100009867227 [0,0,0,0,0,0|2,0,2]=4 42 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [0,0,0,0,0,0|2,0,2]=4 43 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [0,0,0,0,0,0|2,0,2]=4 44 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [0,0,0,0,0,0|1,0,2]=3 45 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [0,0,0,0,0,0|2,0,2]=4 46 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [0,0,0,0,0,0|2,0,2]=4 47 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [0,0,0,0,0,0|2,0,2]=4 48 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [0,0,0,0,0,0|2,0,2]=4 49 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [0,0,0,0,0,0|2,0,2]=4 50 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [0,0,0,0,0,0|1,0,2]=3 51 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [0,0,0,0,0,0|2,0,2]=4 52 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [0,0,0,0,0,0|2,0,2]=4 53 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [0,0,0,0,0,0|2,0,2]=4 54 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [0,0,0,0,0,0|2,0,2]=4 55 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [0,0,0,0,0,0|1,0,2]=3 56 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [0,0,0,0,0,0|2,0,2]=4 57 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [0,0,0,0,0,0|2,0,2]=4 58 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [0,0,0,0,0,0|2,0,2]=4 59 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [0,0,0,0,0,0|2,0,2]=4 60 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [0,0,0,0,0,0|2,0,2]=4 61 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,0,0,0,0,0|1,0,2]=3 62 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [0,0,0,0,0,0|2,0,2]=4 63 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [0,0,0,0,0,0|2,0,2]=4 64 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [0,0,0,0,0,0|2,0,2]=4 65 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [0,0,0,0,0,0|2,0,2]=4 66 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [0,0,0,0,0,0|1,0,2]=3 67 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [0,0,0,0,0,0|0,0,2]=2 68 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [0,0,0,0,0,0|1,0,2]=3 69 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [0,0,0,0,0,0|1,0,2]=3 70 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [0,0,0,0,0,0|1,0,2]=3 71 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [0,0,0,0,0,0|1,0,2]=3 72 B11R1.13 CC=Cc1cccn(c1=O)C 271570a_100016259895_100000687173 [0,0,0,0,0,0|1,0,3]=4 73 B11R1.13 CC=Cc1ccnc(c1C)C 271570a_100016259895_100009846815 [0,0,0,0,0,0|2,0,2]=4 74 B11R1.13 CC=Cc1ccnc(c1Cl)C 271570a_100016259895_100000698670 [0,0,0,0,0,0|2,0,2]=4 75 B11R1.13 CC=Cc1ccnc(c1F)C 271570a_100016259895_100009849794 [0,0,0,0,0,0|2,0,2]=4 76 B11R1.13 CC=Cc1ccnc(c1N)C 271570a_100016259895_100009885578 [0,0,0,0,0,0|2,0,2]=4 77 B11R1.13 CC=Cc1cncc(c1C)C 271570a_100016259895_100009864703 [0,0,0,0,0,0|2,0,2]=4 78 B11R1.13 CC=Cc1cncc(c1N)C 271570a_100016259895_100009818025 [0,0,0,0,0,0|2,0,2]=4 79 B11R1.13 CC=Cc1nccc(c1C)C 271570a_100016259895_100009847204 [0,0,0,0,0,0|2,0,2]=4 80 B11R1.13 CC=Cc1nccc(c1F)C 271570a_100016259895_100009817629 [0,0,0,0,0,0|2,0,2]=4 81 B11R1.13 CC=Cc1nccc(c1N)C 271570a_100016259895_100000763560 [0,0,0,0,0,0|2,0,2]=4 82 B11R1.13 CC=Cc1nccc(c1O)C 271570a_100016259895_100000696282 [0,0,0,0,0,0|1,0,2]=3 83 B11R1.13 CC=Cc1nccc(c1O)F 271570a_100016259895_100009867227 [0,0,0,0,0,0|2,0,2]=4 84 B11R1.13 CCNc1cccc(c1Br)C 34a_100000684715_100000210202 [0,0,0,0,0,0|2,0,2]=4 85 B11R1.13 CCNc1cccc(c1C)C 2230a_100000210026_100000210202 [0,0,0,0,0,0|2,0,2]=4 86 B11R1.13 CCNc1cccc(c1C)C 34a_100000210026_100000210202 [0,0,0,0,0,0|2,0,2]=4 87 B11R1.13 CCNc1cccc(c1C)C 7a_100000210026_100000210202 [0,0,0,0,0,0|2,0,2]=4 88 B11R1.13 CCNc1cccc(c1Cl)C 34a_100000765562_100000210202 [0,0,0,0,0,0|2,0,2]=4 89 B11R1.13 CCNc1cccc(c1Cl)C 7a_100000765562_100000210202 [0,0,0,0,0,0|2,0,2]=4 90 B11R1.13 CCNc1cccc(c1F)C 2230a_100000697159_100000210202 [0,0,0,0,0,0|2,0,2]=4 91 B11R1.13 CCNc1cccc(c1F)C 34a_100000697159_100000210202 [0,0,0,0,0,0|2,0,2]=4 92 B11R1.13 CCNc1cccc(c1F)C 7a_100000697159_100000210202 [0,0,0,0,0,0|2,0,2]=4 93 B11R1.13 CCNc1cccc(c1I)C 34a_100000761888_100000210202 [0,0,0,0,0,0|2,0,2]=4 94 B11R1.13 CCNc1cccc(c1O)Br 34a_100011934915_100000210202 [0,0,0,0,0,0|2,0,2]=4 95 B11R1.13 CCNc1cccc(c1O)C 34a_100000756359_100000210202 [0,0,0,0,0,0|1,0,2]=3 96 B11R1.13 CCNc1cccc(c1O)Cl 34a_100000754742_100000210202 [0,0,0,0,0,0|2,0,2]=4 97 B11R1.13 CCNc1cccc(c1O)F 34a_100011934987_100000210202 [0,0,0,0,0,0|2,0,2]=4 98 B11R1.13 CCOc1cccc(c1Br)C 34a_100000686692_100000210202 [0,0,0,0,0,0|2,0,2]=4 99 B11R1.13 CCOc1cccc(c1Br)C 7a_100000686692_100000210202 [0,0,0,0,0,0|2,0,2]=4 100 B11R1.13 CCOc1cccc(c1C)C 34a_100000185855_100000210202 [0,0,0,0,0,0|2,0,2]=4 101 B11R1.13 CCOc1cccc(c1C)C 7a_100000185855_100000210202 [0,0,0,0,0,0|2,0,2]=4 102 B11R1.13 CCOc1cccc(c1Cl)C 34a_100000695629_100000210202 [0,0,0,0,0,0|2,0,2]=4 103 B11R1.13 CCOc1cccc(c1Cl)C 7a_100000695629_100000210202 [0,0,0,0,0,0|2,0,2]=4 104 B11R1.13 CCOc1cccc(c1F)C 34a_100000751311_100000210202 [0,0,0,0,0,0|2,0,2]=4 105 B11R1.13 CCOc1cccc(c1F)C 7a_100000751311_100000210202 [0,0,0,0,0,0|2,0,2]=4 106 B11R1.13 CCOc1cccc(c1I)C 34a_100010083724_100000210202 [0,0,0,0,0,0|2,0,2]=4 107 B11R1.13 CCOc1cccc(c1I)C 7a_100010083724_100000210202 [0,0,0,0,0,0|2,0,2]=4 108 B11R1.13 CCOc1cccc(c1N)C 34a_100000743429_100000210202 [0,0,0,0,0,0|2,0,2]=4 109 B11R1.13 CCOc1cccc(c1N)C 7a_100000743429_100000210202 [0,0,0,0,0,0|2,0,2]=4 110 B11R1.13 CCSc1cccc(c1Br)C 62a_100000210202_100012362457 [0,0,0,0,0,0|2,0,2]=4 111 B11R1.13 CCSc1cccc(c1Br)C 62a_100012362457_100000210202 [0,0,0,0,0,0|2,0,2]=4 112 B11R1.13 CCSc1cccc(c1C)C 62a_100000210202_100011214922 [0,0,0,0,0,0|2,0,2]=4 113 B11R1.13 CCSc1cccc(c1C)C 62a_100011214922_100000210202 [0,0,0,0,0,0|2,0,2]=4 114 B11R1.13 CCSc1cccc(c1Cl)C 62a_100000210202_200012352035 [0,0,0,0,0,0|2,0,2]=4 115 B11R1.13 CCSc1cccc(c1Cl)C 62a_200012352035_100000210202 [0,0,0,0,0,0|2,0,2]=4 116 B11R1.13 CCSc1cccc(c1F)C 62a_100000210202_100000717567 [0,0,0,0,0,0|2,0,2]=4 117 B11R1.13 CCSc1cccc(c1F)C 62a_100000717567_100000210202 [0,0,0,0,0,0|2,0,2]=4 118 B11R1.13 CCSc1cccc(c1N)C 62a_100000210202_100011834072 [0,0,0,0,0,0|2,0,2]=4 119 B11R1.13 CCSc1cccc(c1N)C 62a_100011834072_100000210202 [0,0,0,0,0,0|2,0,2]=4 120 B11R1.13 CCSc1cccc(c1O)Br 62a_100000210202_100010084509 [0,0,0,0,0,0|2,0,2]=4 121 B11R1.13 CCSc1cccc(c1O)Br 62a_100010084509_100000210202 [0,0,0,0,0,0|2,0,2]=4 122 B11R1.13 CCSc1cccc(c1O)C 62a_100000210202_100009817157 [0,0,0,0,0,0|1,0,2]=3 123 B11R1.13 CCSc1cccc(c1O)C 62a_100009817157_100000210202 [0,0,0,0,0,0|1,0,2]=3 124 B11R1.13 CCSc1cccc(c1O)Cl 62a_100000210202_100010202889 [0,0,0,0,0,0|2,0,2]=4 125 B11R1.13 CCSc1cccc(c1O)Cl 62a_100010202889_100000210202 [0,0,0,0,0,0|2,0,2]=4 126 B11R1.13 CCSc1cccc(c1O)F 62a_100000210202_100009813666 [0,0,0,0,0,0|2,0,2]=4 127 B11R1.13 CCSc1cccc(c1O)F 62a_100009813666_100000210202 [0,0,0,0,0,0|2,0,2]=4 128 B11R1.13 CCSc1cccc(c1O)N 62a_100000210202_100010084371 [0,0,0,0,0,0|2,0,2]=4 129 B11R1.13 CCSc1cccc(c1O)N 62a_100011934915_100000210202 [0,0,0,0,0,0|2,0,2]=4 130 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [0,0,0,0,0,0|2,0,2]=4 131 B11R1.13 CCSc1nccc(c1O)C 62a_100000210202_100000696282 [0,0,0,0,0,0|2,0,2]=4 132 B11R1.13 CNCc1cccc(c1Br)Br 207a_100102657272_100010240334 [0,0,0,0,0,0|3,0,1]=4 133 B11R1.13 CNCc1cccc(c1Br)Br 26a_100102657272_100010187966 [0,0,0,0,0,0|3,0,1]=4 134 B11R1.13 CNCc1cccc(c1Br)Br 270004a_106832991635_100010240334 [0,0,0,0,0,0|3,0,1]=4 135 B11R1.13 CNCc1cccc(c1Br)C 207a_100102657272_100012186367 [0,0,0,0,0,0|2,0,1]=3 136 B11R1.13 CNCc1cccc(c1Br)C 2230a_106832991635_200012349612 [0,0,0,0,0,0|2,0,1]=3 137 B11R1.13 CNCc1cccc(c1Br)C 26a_100102657272_100000686692 [0,0,0,0,0,0|2,0,1]=3 138 B11R1.13 CNCc1cccc(c1Br)C 270004a_106832991635_100012186367 [0,0,0,0,0,0|2,0,1]=3 139 B11R1.13 CNCc1cccc(c1Br)C 34a_100102657272_200012349612 [0,0,0,0,0,0|2,0,1]=3 140 B11R1.13 CNCc1cccc(c1Br)C 7a_106832991635_200012349612 [0,0,0,0,0,0|2,0,1]=3 141 B11R1.13 CNCc1cccc(c1Br)Cl 207a_100102657272_100010232083 [0,0,0,0,0,0|3,0,1]=4 142 B11R1.13 CNCc1cccc(c1Br)Cl 2230a_106832991635_100010145525 [0,0,0,0,0,0|3,0,1]=4 143 B11R1.13 CNCc1cccc(c1Br)Cl 26a_100102657272_100012348804 [0,0,0,0,0,0|3,0,1]=4 144 B11R1.13 CNCc1cccc(c1Br)Cl 270004a_106832991635_100010232083 [0,0,0,0,0,0|3,0,1]=4 145 B11R1.13 CNCc1cccc(c1Br)Cl 34a_100102657272_100010145525 [0,0,0,0,0,0|3,0,1]=4 146 B11R1.13 CNCc1cccc(c1Br)Cl 7a_106832991635_100010145525 [0,0,0,0,0,0|3,0,1]=4 147 B11R1.13 CNCc1cccc(c1Br)F 207a_100102657272_100011934749 [0,0,0,0,0,0|3,0,1]=4 148 B11R1.13 CNCc1cccc(c1Br)F 2230a_100020638964_200000210301 [0,0,0,0,0,0|3,0,1]=4 149 B11R1.13 CNCc1cccc(c1Br)F 2230a_106832991635_100012351116 [0,0,0,0,0,0|3,0,1]=4 150 B11R1.13 CNCc1cccc(c1Br)F 26a_100102657272_100009820682 [0,0,0,0,0,0|3,0,1]=4 151 B11R1.13 CNCc1cccc(c1Br)F 270004a_106832991635_100011934749 [0,0,0,0,0,0|3,0,1]=4 152 B11R1.13 CNCc1cccc(c1Br)F 34a_100020638964_200000210301 [0,0,0,0,0,0|3,0,1]=4 153 B11R1.13 CNCc1cccc(c1Br)F 34a_100102657272_100012351116 [0,0,0,0,0,0|3,0,1]=4 154 B11R1.13 CNCc1cccc(c1Br)F 7a_106832991635_100012351116 [0,0,0,0,0,0|3,0,1]=4 155 B11R1.13 CNCc1cccc(c1Br)I 2230a_106832991635_100010254545 [0,0,0,0,0,0|3,0,1]=4 156 B11R1.13 CNCc1cccc(c1Br)I 26a_100102657272_100010187914 [0,0,0,0,0,0|3,0,1]=4 157 B11R1.13 CNCc1cccc(c1Br)I 34a_100102657272_100010254545 [0,0,0,0,0,0|3,0,1]=4 158 B11R1.13 CNCc1cccc(c1Br)I 7a_106832991635_100010254545 [0,0,0,0,0,0|3,0,1]=4 159 B11R1.13 CNCc1cccc(c1C)Br 207a_100102657272_100012179384 [0,0,0,0,0,0|3,0,1]=4 160 B11R1.13 CNCc1cccc(c1C)Br 2230a_106832991635_100000694682 [0,0,0,0,0,0|3,0,1]=4 161 B11R1.13 CNCc1cccc(c1C)Br 26a_100102657272_100012002258 [0,0,0,0,0,0|3,0,1]=4 162 B11R1.13 CNCc1cccc(c1C)Br 270004a_106832991635_100012179384 [0,0,0,0,0,0|3,0,1]=4 163 B11R1.13 CNCc1cccc(c1C)Br 34a_100000724210_200000210301 [0,0,0,0,0,0|3,0,1]=4 164 B11R1.13 CNCc1cccc(c1C)Br 34a_100102657272_100000694682 [0,0,0,0,0,0|3,0,1]=4 165 B11R1.13 CNCc1cccc(c1C)Br 7a_106832991635_100000694682 [0,0,0,0,0,0|3,0,1]=4 166 B11R1.13 CNCc1cccc(c1C)C 207a_100102657272_100000229941 [0,0,0,0,0,0|2,0,1]=3 167 B11R1.13 CNCc1cccc(c1C)C 2230a_100011211637_200000210301 [0,0,0,0,0,0|2,0,1]=3 168 B11R1.13 CNCc1cccc(c1C)C 2230a_106832991635_100011515928 [0,0,0,0,0,0|2,0,1]=3 169 B11R1.13 CNCc1cccc(c1C)C 270004a_106832991635_100000229941 [0,0,0,0,0,0|2,0,1]=3 170 B11R1.13 CNCc1cccc(c1C)C 34a_100011211637_200000210301 [0,0,0,0,0,0|2,0,1]=3 171 B11R1.13 CNCc1cccc(c1C)C 34a_100102657272_100011273979 [0,0,0,0,0,0|2,0,1]=3 172 B11R1.13 CNCc1cccc(c1C)C 7a_106832991635_100011515928 [0,0,0,0,0,0|2,0,1]=3 173 B11R1.13 CNCc1cccc(c1C)Cl 207a_100102657272_100012002129 [0,0,0,0,0,0|3,0,1]=4 174 B11R1.13 CNCc1cccc(c1C)Cl 2230a_100020639605_200000210301 [0,0,0,0,0,0|3,0,1]=4 175 B11R1.13 CNCc1cccc(c1C)Cl 2230a_106832991635_100012186920 [0,0,0,0,0,0|3,0,1]=4 176 B11R1.13 CNCc1cccc(c1C)Cl 270004a_106832991635_100012002129 [0,0,0,0,0,0|3,0,1]=4 177 B11R1.13 CNCc1cccc(c1C)Cl 34a_100020639605_200000210301 [0,0,0,0,0,0|3,0,1]=4 178 B11R1.13 CNCc1cccc(c1C)Cl 34a_100102657272_100012186920 [0,0,0,0,0,0|3,0,1]=4 179 B11R1.13 CNCc1cccc(c1C)Cl 7a_106832991635_100012186920 [0,0,0,0,0,0|3,0,1]=4 180 B11R1.13 CNCc1cccc(c1C)F 207a_100102657272_100000037668 [0,0,0,0,0,0|3,0,1]=4 181 B11R1.13 CNCc1cccc(c1C)F 2230a_100132306986_200000210301 [0,0,0,0,0,0|3,0,1]=4 182 B11R1.13 CNCc1cccc(c1C)F 2230a_106832991635_100009813626 [0,0,0,0,0,0|3,0,1]=4 183 B11R1.13 CNCc1cccc(c1C)F 270004a_106832991635_100000037668 [0,0,0,0,0,0|3,0,1]=4 184 B11R1.13 CNCc1cccc(c1C)F 34a_100102657272_100009813626 [0,0,0,0,0,0|3,0,1]=4 185 B11R1.13 CNCc1cccc(c1C)F 34a_100132306986_200000210301 [0,0,0,0,0,0|3,0,1]=4 186 B11R1.13 CNCc1cccc(c1C)F 7a_106832991635_100009813626 [0,0,0,0,0,0|3,0,1]=4 187 B11R1.13 CNCc1cccc(c1C)I 2230a_106832991635_100010150147 [0,0,0,0,0,0|3,0,1]=4 188 B11R1.13 CNCc1cccc(c1C)I 34a_100102657272_100010150147 [0,0,0,0,0,0|3,0,1]=4 189 B11R1.13 CNCc1cccc(c1C)I 7a_106832991635_100010150147 [0,0,0,0,0,0|3,0,1]=4 190 B11R1.13 CNCc1cccc(c1C)O 270004a_106832991635_100009868165 [0,0,0,0,0,0|3,0,1]=4 191 B11R1.13 CNCc1cccc(c1Cl)Br 207a_100102657272_100012362481 [0,0,0,0,0,0|3,0,1]=4 192 B11R1.13 CNCc1cccc(c1Cl)Br 2230a_106832991635_100012349491 [0,0,0,0,0,0|3,0,1]=4 193 B11R1.13 CNCc1cccc(c1Cl)Br 26a_100102657272_100010187913 [0,0,0,0,0,0|3,0,1]=4 194 B11R1.13 CNCc1cccc(c1Cl)Br 270004a_106832991635_100012362481 [0,0,0,0,0,0|3,0,1]=4 195 B11R1.13 CNCc1cccc(c1Cl)Br 34a_100102657272_100012349491 [0,0,0,0,0,0|3,0,1]=4 196 B11R1.13 CNCc1cccc(c1Cl)Br 7a_106832991635_100012349491 [0,0,0,0,0,0|3,0,1]=4 197 B11R1.13 CNCc1cccc(c1Cl)C 207a_100102657272_100012017286 [0,0,0,0,0,0|2,0,1]=3 198 B11R1.13 CNCc1cccc(c1Cl)C 2230a_100025705714_200000210301 [0,0,0,0,0,0|2,0,1]=3 199 B11R1.13 CNCc1cccc(c1Cl)C 26a_100102657272_100000695629 [0,0,0,0,0,0|2,0,1]=3 200 B11R1.13 CNCc1cccc(c1Cl)C 270004a_106832991635_100012017286 [0,0,0,0,0,0|2,0,1]=3 201 B11R1.13 CNCc1cccc(c1Cl)C 34a_100025705714_200000210301 [0,0,0,0,0,0|2,0,1]=3 202 B11R1.13 CNCc1cccc(c1Cl)Cl 207a_100102657272_100000210504 [0,0,0,0,0,0|3,0,1]=4 203 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_100011211633_200000210301 [0,0,0,0,0,0|3,0,1]=4 204 B11R1.13 CNCc1cccc(c1Cl)Cl 2230a_106832991635_100000723366 [0,0,0,0,0,0|3,0,1]=4 205 B11R1.13 CNCc1cccc(c1Cl)Cl 26a_100102657272_100000211076 [0,0,0,0,0,0|3,0,1]=4 206 B11R1.13 CNCc1cccc(c1Cl)Cl 270004a_106832991635_100000210504 [0,0,0,0,0,0|3,0,1]=4 207 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100011211633_200000210301 [0,0,0,0,0,0|3,0,1]=4 208 B11R1.13 CNCc1cccc(c1Cl)Cl 34a_100102657272_100000723366 [0,0,0,0,0,0|3,0,1]=4 209 B11R1.13 CNCc1cccc(c1Cl)Cl 7a_106832991635_100000723366 [0,0,0,0,0,0|3,0,1]=4 210 B11R1.13 CNCc1cccc(c1Cl)F 207a_100102657272_100011998484 [0,0,0,0,0,0|3,0,1]=4 211 B11R1.13 CNCc1cccc(c1Cl)F 2230a_100012001614_200000210301 [0,0,0,0,0,0|3,0,1]=4 212 B11R1.13 CNCc1cccc(c1Cl)F 2230a_106832991635_100000696688 [0,0,0,0,0,0|3,0,1]=4 213 B11R1.13 CNCc1cccc(c1Cl)F 26a_100102657272_100000087408 [0,0,0,0,0,0|3,0,1]=4 214 B11R1.13 CNCc1cccc(c1Cl)F 270004a_106832991635_100011998484 [0,0,0,0,0,0|3,0,1]=4 215 B11R1.13 CNCc1cccc(c1Cl)F 34a_100012001614_200000210301 [0,0,0,0,0,0|3,0,1]=4 216 B11R1.13 CNCc1cccc(c1Cl)F 34a_100102657272_100000696688 [0,0,0,0,0,0|3,0,1]=4 217 B11R1.13 CNCc1cccc(c1Cl)F 7a_106832991635_100000696688 [0,0,0,0,0,0|3,0,1]=4 218 B11R1.13 CNCc1cccc(c1Cl)I 26a_100102657272_100000049636 [0,0,0,0,0,0|3,0,1]=4 219 B11R1.13 CNCc1cccc(c1Cl)O 270004a_106832991635_100000050521 [0,0,0,0,0,0|3,0,1]=4 220 B11R1.13 CNCc1cccc(c1F)Br 207a_100102657272_100011361543 [0,0,0,0,0,0|3,0,1]=4 221 B11R1.13 CNCc1cccc(c1F)Br 2230a_100015189953_200000210301 [0,0,0,0,0,0|3,0,1]=4 222 B11R1.13 CNCc1cccc(c1F)Br 2230a_106832991635_100012356506 [0,0,0,0,0,0|3,0,1]=4 223 B11R1.13 CNCc1cccc(c1F)Br 26a_100102657272_100009817021 [0,0,0,0,0,0|3,0,1]=4 224 B11R1.13 CNCc1cccc(c1F)Br 270004a_106832991635_100011361543 [0,0,0,0,0,0|3,0,1]=4 225 B11R1.13 CNCc1cccc(c1F)Br 34a_100015189953_200000210301 [0,0,0,0,0,0|3,0,1]=4 226 B11R1.13 CNCc1cccc(c1F)Br 34a_100102657272_100012356506 [0,0,0,0,0,0|3,0,1]=4 227 B11R1.13 CNCc1cccc(c1F)Br 7a_106832991635_100012356506 [0,0,0,0,0,0|3,0,1]=4 228 B11R1.13 CNCc1cccc(c1F)C 207a_100102657272_100011219516 [0,0,0,0,0,0|2,0,1]=3 229 B11R1.13 CNCc1cccc(c1F)C 2230a_100012002060_200000210301 [0,0,0,0,0,0|2,0,1]=3 230 B11R1.13 CNCc1cccc(c1F)C 2230a_106832991635_100011216058 [0,0,0,0,0,0|2,0,1]=3 231 B11R1.13 CNCc1cccc(c1F)C 270004a_106832991635_100011219516 [0,0,0,0,0,0|2,0,1]=3 232 B11R1.13 CNCc1cccc(c1F)C 34a_100012002060_200000210301 [0,0,0,0,0,0|2,0,1]=3 233 B11R1.13 CNCc1cccc(c1F)C 34a_100102657272_100011216058 [0,0,0,0,0,0|2,0,1]=3 234 B11R1.13 CNCc1cccc(c1F)C 7a_106832991635_100011216058 [0,0,0,0,0,0|2,0,1]=3 235 B11R1.13 CNCc1cccc(c1F)Cl 207a_100102657272_100000766533 [0,0,0,0,0,0|3,0,1]=4 236 B11R1.13 CNCc1cccc(c1F)Cl 2230a_100000764326_200000210301 [0,0,0,0,0,0|3,0,1]=4 237 B11R1.13 CNCc1cccc(c1F)Cl 2230a_106832991635_100000716733 [0,0,0,0,0,0|3,0,1]=4 238 B11R1.13 CNCc1cccc(c1F)Cl 26a_100102657272_100000687438 [0,0,0,0,0,0|3,0,1]=4 239 B11R1.13 CNCc1cccc(c1F)Cl 270004a_106832991635_100000766533 [0,0,0,0,0,0|3,0,1]=4 240 B11R1.13 CNCc1cccc(c1F)Cl 34a_100000764326_200000210301 [0,0,0,0,0,0|3,0,1]=4 241 B11R1.13 CNCc1cccc(c1F)Cl 34a_100102657272_100000716733 [0,0,0,0,0,0|3,0,1]=4 242 B11R1.13 CNCc1cccc(c1F)Cl 7a_106832991635_100000716733 [0,0,0,0,0,0|3,0,1]=4 243 B11R1.13 CNCc1cccc(c1F)F 207a_100102657272_100000753312 [0,0,0,0,0,0|3,0,1]=4 244 B11R1.13 CNCc1cccc(c1F)F 2230a_100011199105_200000210301 [0,0,0,0,0,0|3,0,1]=4 245 B11R1.13 CNCc1cccc(c1F)F 2230a_106832991635_100000217499 [0,0,0,0,0,0|3,0,1]=4 246 B11R1.13 CNCc1cccc(c1F)F 270004a_106832991635_100000753312 [0,0,0,0,0,0|3,0,1]=4 247 B11R1.13 CNCc1cccc(c1F)F 34a_100011199105_200000210301 [0,0,0,0,0,0|3,0,1]=4 248 B11R1.13 CNCc1cccc(c1F)F 34a_100102657272_100000217499 [0,0,0,0,0,0|3,0,1]=4 249 B11R1.13 CNCc1cccc(c1F)F 7a_106832991635_100000217499 [0,0,0,0,0,0|3,0,1]=4 250 B11R1.13 CNCc1cccc(c1F)I 207a_100102657272_100010202174 [0,0,0,0,0,0|3,0,1]=4 251 B11R1.13 CNCc1cccc(c1F)I 270004a_106832991635_100010202174 [0,0,0,0,0,0|3,0,1]=4 252 B11R1.13 CNCc1cccc(c1F)O 271570a_203496583355_114873767014 [0,0,0,0,0,0|3,0,1]=4 253 B11R1.13 CNCc1cccc(c1F)O 34a_100025773512_200000210301 [0,0,0,0,0,0|3,0,1]=4 254 B11R1.13 CNCc1cccc(c1I)Br 26a_100102657272_100010187912 [0,0,0,0,0,0|3,0,1]=4 255 B11R1.13 CNCc1cccc(c1I)F 207a_100102657272_100010186293 [0,0,0,0,0,0|3,0,1]=4 256 B11R1.13 CNCc1cccc(c1I)F 2230a_106832991635_100010149603 [0,0,0,0,0,0|3,0,1]=4 257 B11R1.13 CNCc1cccc(c1I)F 270004a_106832991635_100010186293 [0,0,0,0,0,0|3,0,1]=4 258 B11R1.13 CNCc1cccc(c1I)F 34a_100102657272_100010149603 [0,0,0,0,0,0|3,0,1]=4 259 B11R1.13 CNCc1cccc(c1I)F 7a_106832991635_100010149603 [0,0,0,0,0,0|3,0,1]=4 260 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [0,0,0,0,0,0|1,0,1]=2 261 B11R1.13 CNCc1cccn(c1=O)C 207a_100102657272_100010354164 [0,0,0,0,0,0|2,0,2]=4 262 B11R1.13 CNCc1cccn(c1=O)C 270004a_106832991635_100010354164 [0,0,0,0,0,0|2,0,2]=4 263 B11R1.13 COCc1cccc(c1Br)C 34a_100011659289_200000210301 [0,0,0,0,0,0|2,0,1]=3 264 B11R1.13 COCc1cccc(c1Br)C 34a_100138415774_200012349612 [0,0,0,0,0,0|2,0,1]=3 265 B11R1.13 COCc1cccc(c1Br)C 7a_100011659289_200000210301 [0,0,0,0,0,0|2,0,1]=3 266 B11R1.13 COCc1cccc(c1Br)Cl 34a_100010168166_200000210301 [0,0,0,0,0,0|3,0,1]=4 267 B11R1.13 COCc1cccc(c1Br)Cl 34a_100138415774_100010145525 [0,0,0,0,0,0|3,0,1]=4 268 B11R1.13 COCc1cccc(c1Br)Cl 7a_100010168166_200000210301 [0,0,0,0,0,0|3,0,1]=4 269 B11R1.13 COCc1cccc(c1Br)F 34a_100012351117_200000210301 [0,0,0,0,0,0|3,0,1]=4 270 B11R1.13 COCc1cccc(c1Br)F 34a_100138415774_100012351116 [0,0,0,0,0,0|3,0,1]=4 271 B11R1.13 COCc1cccc(c1Br)F 7a_100012351117_200000210301 [0,0,0,0,0,0|3,0,1]=4 272 B11R1.13 COCc1cccc(c1Br)I 34a_100010240205_200000210301 [0,0,0,0,0,0|3,0,1]=4 273 B11R1.13 COCc1cccc(c1Br)I 34a_100138415774_100010254545 [0,0,0,0,0,0|3,0,1]=4 274 B11R1.13 COCc1cccc(c1Br)I 7a_100010240205_200000210301 [0,0,0,0,0,0|3,0,1]=4 275 B11R1.13 COCc1cccc(c1C)Br 34a_100000694458_200000210301 [0,0,0,0,0,0|3,0,1]=4 276 B11R1.13 COCc1cccc(c1C)Br 34a_100138415774_100000694682 [0,0,0,0,0,0|3,0,1]=4 277 B11R1.13 COCc1cccc(c1C)Br 7a_100000694458_200000210301 [0,0,0,0,0,0|3,0,1]=4 278 B11R1.13 COCc1cccc(c1C)C 34a_100011219135_200000210301 [0,0,0,0,0,0|2,0,1]=3 279 B11R1.13 COCc1cccc(c1C)C 34a_100138415774_100011273979 [0,0,0,0,0,0|2,0,1]=3 280 B11R1.13 COCc1cccc(c1C)C 7a_100011219135_200000210301 [0,0,0,0,0,0|2,0,1]=3 281 B11R1.13 COCc1cccc(c1C)Cl 34a_100012000165_200000210301 [0,0,0,0,0,0|3,0,1]=4 282 B11R1.13 COCc1cccc(c1C)Cl 34a_100138415774_100012186920 [0,0,0,0,0,0|3,0,1]=4 283 B11R1.13 COCc1cccc(c1C)Cl 7a_100012000165_200000210301 [0,0,0,0,0,0|3,0,1]=4 284 B11R1.13 COCc1cccc(c1C)F 34a_100000042775_200000210301 [0,0,0,0,0,0|3,0,1]=4 285 B11R1.13 COCc1cccc(c1C)F 34a_100138415774_100009813626 [0,0,0,0,0,0|3,0,1]=4 286 B11R1.13 COCc1cccc(c1C)F 7a_100000042775_200000210301 [0,0,0,0,0,0|3,0,1]=4 287 B11R1.13 COCc1cccc(c1C)I 34a_100010150139_200000210301 [0,0,0,0,0,0|3,0,1]=4 288 B11R1.13 COCc1cccc(c1C)I 34a_100138415774_100010150147 [0,0,0,0,0,0|3,0,1]=4 289 B11R1.13 COCc1cccc(c1C)I 7a_100010150139_200000210301 [0,0,0,0,0,0|3,0,1]=4 290 B11R1.13 COCc1cccc(c1C)N 34a_102495339961_200000210301 [0,0,0,0,0,0|3,0,1]=4 291 B11R1.13 COCc1cccc(c1C)N 7a_102495339961_200000210301 [0,0,0,0,0,0|3,0,1]=4 292 B11R1.13 COCc1cccc(c1C)O 271570a_203496583355_100102485947 [0,0,0,0,0,0|3,0,1]=4 293 B11R1.13 COCc1cccc(c1Cl)Br 34a_100012351182_200000210301 [0,0,0,0,0,0|3,0,1]=4 294 B11R1.13 COCc1cccc(c1Cl)Br 34a_100138415774_100012349491 [0,0,0,0,0,0|3,0,1]=4 295 B11R1.13 COCc1cccc(c1Cl)Br 7a_100012351182_200000210301 [0,0,0,0,0,0|3,0,1]=4 296 B11R1.13 COCc1cccc(c1Cl)C 34a_100000710031_200000210301 [0,0,0,0,0,0|2,0,1]=3 297 B11R1.13 COCc1cccc(c1Cl)C 7a_100000710031_200000210301 [0,0,0,0,0,0|2,0,1]=3 298 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100000720469_200000210301 [0,0,0,0,0,0|3,0,1]=4 299 B11R1.13 COCc1cccc(c1Cl)Cl 34a_100138415774_100000723366 [0,0,0,0,0,0|3,0,1]=4 300 B11R1.13 COCc1cccc(c1Cl)Cl 7a_100000720469_200000210301 [0,0,0,0,0,0|3,0,1]=4 301 B11R1.13 COCc1cccc(c1Cl)F 34a_100000696319_200000210301 [0,0,0,0,0,0|3,0,1]=4 302 B11R1.13 COCc1cccc(c1Cl)F 34a_100138415774_100000696688 [0,0,0,0,0,0|3,0,1]=4 303 B11R1.13 COCc1cccc(c1Cl)F 7a_100000696319_200000210301 [0,0,0,0,0,0|3,0,1]=4 304 B11R1.13 COCc1cccc(c1F)Br 34a_100011935076_200000210301 [0,0,0,0,0,0|3,0,1]=4 305 B11R1.13 COCc1cccc(c1F)Br 34a_100138415774_100012356506 [0,0,0,0,0,0|3,0,1]=4 306 B11R1.13 COCc1cccc(c1F)Br 7a_100011935076_200000210301 [0,0,0,0,0,0|3,0,1]=4 307 B11R1.13 COCc1cccc(c1F)C 34a_100138415774_100011216058 [0,0,0,0,0,0|2,0,1]=3 308 B11R1.13 COCc1cccc(c1F)C 34a_200011219517_200000210301 [0,0,0,0,0,0|2,0,1]=3 309 B11R1.13 COCc1cccc(c1F)C 7a_200011219517_200000210301 [0,0,0,0,0,0|2,0,1]=3 310 B11R1.13 COCc1cccc(c1F)Cl 34a_100011216988_200000210301 [0,0,0,0,0,0|3,0,1]=4 311 B11R1.13 COCc1cccc(c1F)Cl 34a_100138415774_100000716733 [0,0,0,0,0,0|3,0,1]=4 312 B11R1.13 COCc1cccc(c1F)Cl 7a_100011216988_200000210301 [0,0,0,0,0,0|3,0,1]=4 313 B11R1.13 COCc1cccc(c1F)F 34a_100011218644_200000210301 [0,0,0,0,0,0|3,0,1]=4 314 B11R1.13 COCc1cccc(c1F)F 34a_100138415774_100000217499 [0,0,0,0,0,0|3,0,1]=4 315 B11R1.13 COCc1cccc(c1F)F 7a_100011218644_200000210301 [0,0,0,0,0,0|3,0,1]=4 316 B11R1.13 COCc1cccc(c1F)I 34a_200010235739_200000210301 [0,0,0,0,0,0|3,0,1]=4 317 B11R1.13 COCc1cccc(c1F)I 7a_200010235739_200000210301 [0,0,0,0,0,0|3,0,1]=4 318 B11R1.13 COCc1cccc(c1F)N 34a_100012023829_200000210301 [0,0,0,0,0,0|3,0,1]=4 319 B11R1.13 COCc1cccc(c1I)Br 34a_100010146604_200000210301 [0,0,0,0,0,0|3,0,1]=4 320 B11R1.13 COCc1cccc(c1I)Br 7a_100010146604_200000210301 [0,0,0,0,0,0|3,0,1]=4 321 B11R1.13 COCc1cccc(c1I)C 34a_100012349780_200000210301 [0,0,0,0,0,0|2,0,1]=3 322 B11R1.13 COCc1cccc(c1I)C 7a_100012349780_200000210301 [0,0,0,0,0,0|2,0,1]=3 323 B11R1.13 COCc1cccc(c1I)F 34a_100000692438_200000210301 [0,0,0,0,0,0|3,0,1]=4 324 B11R1.13 COCc1cccc(c1I)F 34a_100138415774_100010149603 [0,0,0,0,0,0|3,0,1]=4 325 B11R1.13 COCc1cccc(c1I)F 7a_100000692438_200000210301 [0,0,0,0,0,0|3,0,1]=4 326 B11R1.13 COCc1cccc(c1N)Br 34a_100012349457_200000210301 [0,0,0,0,0,0|3,0,1]=4 327 B11R1.13 COCc1cccc(c1N)C 34a_100011215590_200000210301 [0,0,0,0,0,0|2,0,1]=3 328 B11R1.13 COCc1cccc(c1N)Cl 34a_100012182729_200000210301 [0,0,0,0,0,0|3,0,1]=4 329 B11R1.13 COCc1cccc(c1N)F 34a_100000692437_200000210301 [0,0,0,0,0,0|3,0,1]=4 330 B11R1.13 CSCc1cccc(c1Br)C 62a_200000210301_200012349612 [0,0,0,0,0,0|2,0,1]=3 331 B11R1.13 CSCc1cccc(c1Br)C 62a_200012349612_200000210301 [0,0,0,0,0,0|2,0,1]=3 332 B11R1.13 CSCc1cccc(c1Br)Cl 62a_100010145525_200000210301 [0,0,0,0,0,0|3,0,1]=4 333 B11R1.13 CSCc1cccc(c1Br)Cl 62a_200000210301_100010145525 [0,0,0,0,0,0|3,0,1]=4 334 B11R1.13 CSCc1cccc(c1Br)F 62a_100012351116_200000210301 [0,0,0,0,0,0|3,0,1]=4 335 B11R1.13 CSCc1cccc(c1Br)F 62a_200000210301_100012351116 [0,0,0,0,0,0|3,0,1]=4 336 B11R1.13 CSCc1cccc(c1Br)I 62a_100010254545_200000210301 [0,0,0,0,0,0|3,0,1]=4 337 B11R1.13 CSCc1cccc(c1Br)I 62a_200000210301_100010254545 [0,0,0,0,0,0|3,0,1]=4 338 B11R1.13 CSCc1cccc(c1C)Br 62a_100000694682_200000210301 [0,0,0,0,0,0|3,0,1]=4 339 B11R1.13 CSCc1cccc(c1C)Br 62a_200000210301_100000694682 [0,0,0,0,0,0|3,0,1]=4 340 B11R1.13 CSCc1cccc(c1C)C 62a_100011515928_200000210301 [0,0,0,0,0,0|2,0,1]=3 341 B11R1.13 CSCc1cccc(c1C)C 62a_200000210301_100011515928 [0,0,0,0,0,0|2,0,1]=3 342 B11R1.13 CSCc1cccc(c1C)Cl 62a_100012186920_200000210301 [0,0,0,0,0,0|3,0,1]=4 343 B11R1.13 CSCc1cccc(c1C)Cl 62a_200000210301_100012186920 [0,0,0,0,0,0|3,0,1]=4 344 B11R1.13 CSCc1cccc(c1C)F 62a_100009813626_200000210301 [0,0,0,0,0,0|3,0,1]=4 345 B11R1.13 CSCc1cccc(c1C)F 62a_200000210301_100009813626 [0,0,0,0,0,0|3,0,1]=4 346 B11R1.13 CSCc1cccc(c1C)I 62a_100010150147_200000210301 [0,0,0,0,0,0|3,0,1]=4 347 B11R1.13 CSCc1cccc(c1C)I 62a_200000210301_100010150147 [0,0,0,0,0,0|3,0,1]=4 348 B11R1.13 CSCc1cccc(c1Cl)Br 62a_100012349491_200000210301 [0,0,0,0,0,0|3,0,1]=4 349 B11R1.13 CSCc1cccc(c1Cl)Br 62a_200000210301_100012349491 [0,0,0,0,0,0|3,0,1]=4 350 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_100000720918_200000210301 [0,0,0,0,0,0|3,0,1]=4 351 B11R1.13 CSCc1cccc(c1Cl)Cl 62a_200000210301_100000723366 [0,0,0,0,0,0|3,0,1]=4 352 B11R1.13 CSCc1cccc(c1Cl)F 62a_100000696688_200000210301 [0,0,0,0,0,0|3,0,1]=4 353 B11R1.13 CSCc1cccc(c1Cl)F 62a_200000210301_100000696688 [0,0,0,0,0,0|3,0,1]=4 354 B11R1.13 CSCc1cccc(c1F)Br 62a_100012356506_200000210301 [0,0,0,0,0,0|3,0,1]=4 355 B11R1.13 CSCc1cccc(c1F)Br 62a_200000210301_100012356506 [0,0,0,0,0,0|3,0,1]=4 356 B11R1.13 CSCc1cccc(c1F)C 62a_100011216058_200000210301 [0,0,0,0,0,0|2,0,1]=3 357 B11R1.13 CSCc1cccc(c1F)C 62a_200000210301_100011216058 [0,0,0,0,0,0|2,0,1]=3 358 B11R1.13 CSCc1cccc(c1F)Cl 62a_100000716733_200000210301 [0,0,0,0,0,0|3,0,1]=4 359 B11R1.13 CSCc1cccc(c1F)Cl 62a_200000210301_100000716733 [0,0,0,0,0,0|3,0,1]=4 360 B11R1.13 CSCc1cccc(c1F)F 62a_100000217499_200000210301 [0,0,0,0,0,0|3,0,1]=4 361 B11R1.13 CSCc1cccc(c1F)F 62a_200000210301_100000217499 [0,0,0,0,0,0|3,0,1]=4 362 B11R1.13 CSCc1cccc(c1I)F 62a_100010149603_200000210301 [0,0,0,0,0,0|3,0,1]=4 363 B11R1.13 CSCc1cccc(c1I)F 62a_200000210301_100010149603 [0,0,0,0,0,0|3,0,1]=4 364 B11R1.13 Cc1c(cccc1CC#N)O 271570a_203496583355_100010147028 [0,0,0,0,0,0|3,0,1]=4 365 B11R1.13 Cc1c(cccc1CCN)O 271570a_203496583355_100161000114 [0,0,0,0,0,0|3,0,1]=4 366 B11R1.13 Cc1c(cccc1CN[13CH3])Br 34a_100000724210_200025704644 [0,0,0,0,0,0|3,0,1]=4 367 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 2230a_100020639605_200025704644 [0,0,0,0,0,0|3,0,1]=4 368 B11R1.13 Cc1c(cccc1CN[13CH3])Cl 34a_100020639605_200025704644 [0,0,0,0,0,0|3,0,1]=4 369 B11R1.13 Cc1c(cccc1CN[13CH3])F 2230a_100132306986_200025704644 [0,0,0,0,0,0|3,0,1]=4 370 B11R1.13 Cc1c(cccc1CN[13CH3])F 34a_100132306986_200025704644 [0,0,0,0,0,0|3,0,1]=4 371 B11R1.13 Cc1c(cccc1CO[13CH3])Br 34a_100000694458_200025704644 [0,0,0,0,0,0|3,0,1]=4 372 B11R1.13 Cc1c(cccc1CO[13CH3])Br 7a_100000694458_200025704644 [0,0,0,0,0,0|3,0,1]=4 373 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 34a_100012000165_200025704644 [0,0,0,0,0,0|3,0,1]=4 374 B11R1.13 Cc1c(cccc1CO[13CH3])Cl 7a_100012000165_200025704644 [0,0,0,0,0,0|3,0,1]=4 375 B11R1.13 Cc1c(cccc1CO[13CH3])F 34a_100000042775_200025704644 [0,0,0,0,0,0|3,0,1]=4 376 B11R1.13 Cc1c(cccc1CO[13CH3])F 7a_100000042775_200025704644 [0,0,0,0,0,0|3,0,1]=4 377 B11R1.13 Cc1c(cccc1CO[13CH3])I 34a_100010150139_200025704644 [0,0,0,0,0,0|3,0,1]=4 378 B11R1.13 Cc1c(cccc1CO[13CH3])I 7a_100010150139_200025704644 [0,0,0,0,0,0|3,0,1]=4 379 B11R1.13 Cc1c(cccc1CO[13CH3])N 34a_102495339961_200025704644 [0,0,0,0,0,0|3,0,1]=4 380 B11R1.13 Cc1c(cccc1CO[13CH3])N 7a_102495339961_200025704644 [0,0,0,0,0,0|3,0,1]=4 381 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_100000694682_200025704644 [0,0,0,0,0,0|3,0,1]=4 382 B11R1.13 Cc1c(cccc1CS[13CH3])Br 62a_200025704644_100000694682 [0,0,0,0,0,0|3,0,1]=4 383 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_100012186920_200025704644 [0,0,0,0,0,0|3,0,1]=4 384 B11R1.13 Cc1c(cccc1CS[13CH3])Cl 62a_200025704644_100012186920 [0,0,0,0,0,0|3,0,1]=4 385 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_100009813626_200025704644 [0,0,0,0,0,0|3,0,1]=4 386 B11R1.13 Cc1c(cccc1CS[13CH3])F 62a_200025704644_100009813626 [0,0,0,0,0,0|3,0,1]=4 387 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_100010150147_200025704644 [0,0,0,0,0,0|3,0,1]=4 388 B11R1.13 Cc1c(cccc1CS[13CH3])I 62a_200025704644_100010150147 [0,0,0,0,0,0|3,0,1]=4 389 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 34a_100011659289_200025704644 [0,0,0,0,0,0|2,0,1]=3 390 B11R1.13 Cc1cccc(c1Br)CO[13CH3] 7a_100011659289_200025704644 [0,0,0,0,0,0|2,0,1]=3 391 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200012349612_200025704644 [0,0,0,0,0,0|2,0,1]=3 392 B11R1.13 Cc1cccc(c1Br)CS[13CH3] 62a_200025704644_200012349612 [0,0,0,0,0,0|2,0,1]=3 393 B11R1.13 Cc1cccc(c1Br)NCF 34a_100000684715_100015361967 [0,0,0,0,0,0|3,0,1]=4 394 B11R1.13 Cc1cccc(c1Br)OCF 34a_100000686692_100015361967 [0,0,0,0,0,0|3,0,1]=4 395 B11R1.13 Cc1cccc(c1Br)OCF 7a_100000686692_100015361967 [0,0,0,0,0,0|3,0,1]=4 396 B11R1.13 Cc1cccc(c1Br)SCF 62a_100012362457_100015361967 [0,0,0,0,0,0|3,0,1]=4 397 B11R1.13 Cc1cccc(c1Br)SCF 62a_100015361967_100012362457 [0,0,0,0,0,0|3,0,1]=4 398 B11R1.13 Cc1cccc(c1C)CN[13CH3] 2230a_100011211637_200025704644 [0,0,0,0,0,0|2,0,1]=3 399 B11R1.13 Cc1cccc(c1C)CN[13CH3] 34a_100011211637_200025704644 [0,0,0,0,0,0|2,0,1]=3 400 B11R1.13 Cc1cccc(c1C)CO[13CH3] 34a_100011219135_200025704644 [0,0,0,0,0,0|2,0,1]=3 401 B11R1.13 Cc1cccc(c1C)CO[13CH3] 7a_100011219135_200025704644 [0,0,0,0,0,0|2,0,1]=3 402 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_100011515928_200025704644 [0,0,0,0,0,0|2,0,1]=3 403 B11R1.13 Cc1cccc(c1C)CS[13CH3] 62a_200025704644_100011515928 [0,0,0,0,0,0|2,0,1]=3 404 B11R1.13 Cc1cccc(c1C)NCF 34a_100000210026_100015361967 [0,0,0,0,0,0|3,0,1]=4 405 B11R1.13 Cc1cccc(c1C)NCF 7a_100000210026_100015361967 [0,0,0,0,0,0|3,0,1]=4 406 B11R1.13 Cc1cccc(c1C)OCF 34a_100000185855_100015361967 [0,0,0,0,0,0|3,0,1]=4 407 B11R1.13 Cc1cccc(c1C)OCF 7a_100000185855_100015361967 [0,0,0,0,0,0|3,0,1]=4 408 B11R1.13 Cc1cccc(c1C)SCF 62a_100011214922_100015361967 [0,0,0,0,0,0|3,0,1]=4 409 B11R1.13 Cc1cccc(c1C)SCF 62a_100015361967_100011214922 [0,0,0,0,0,0|3,0,1]=4 410 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 2230a_100025705714_200025704644 [0,0,0,0,0,0|2,0,1]=3 411 B11R1.13 Cc1cccc(c1Cl)CN[13CH3] 34a_100025705714_200025704644 [0,0,0,0,0,0|2,0,1]=3 412 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 34a_100000710031_200025704644 [0,0,0,0,0,0|2,0,1]=3 413 B11R1.13 Cc1cccc(c1Cl)CO[13CH3] 7a_100000710031_200025704644 [0,0,0,0,0,0|2,0,1]=3 414 B11R1.13 Cc1cccc(c1Cl)NCF 34a_100000765562_100015361967 [0,0,0,0,0,0|3,0,1]=4 415 B11R1.13 Cc1cccc(c1Cl)NCF 7a_100000765562_100015361967 [0,0,0,0,0,0|3,0,1]=4 416 B11R1.13 Cc1cccc(c1Cl)OCF 34a_100000695629_100015361967 [0,0,0,0,0,0|3,0,1]=4 417 B11R1.13 Cc1cccc(c1Cl)OCF 7a_100000695629_100015361967 [0,0,0,0,0,0|3,0,1]=4 418 B11R1.13 Cc1cccc(c1Cl)SCF 62a_100015361967_200012352035 [0,0,0,0,0,0|3,0,1]=4 419 B11R1.13 Cc1cccc(c1Cl)SCF 62a_200012352035_100015361967 [0,0,0,0,0,0|3,0,1]=4 420 B11R1.13 Cc1cccc(c1F)CN[13CH3] 2230a_100012002060_200025704644 [0,0,0,0,0,0|2,0,1]=3 421 B11R1.13 Cc1cccc(c1F)CN[13CH3] 34a_100012002060_200025704644 [0,0,0,0,0,0|2,0,1]=3 422 B11R1.13 Cc1cccc(c1F)CO[13CH3] 34a_200011219517_200025704644 [0,0,0,0,0,0|2,0,1]=3 423 B11R1.13 Cc1cccc(c1F)CO[13CH3] 7a_200011219517_200025704644 [0,0,0,0,0,0|2,0,1]=3 424 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_100011216058_200025704644 [0,0,0,0,0,0|2,0,1]=3 425 B11R1.13 Cc1cccc(c1F)CS[13CH3] 62a_200025704644_100011216058 [0,0,0,0,0,0|2,0,1]=3 426 B11R1.13 Cc1cccc(c1F)NCF 34a_100000697159_100015361967 [0,0,0,0,0,0|3,0,1]=4 427 B11R1.13 Cc1cccc(c1F)NCF 7a_100000697159_100015361967 [0,0,0,0,0,0|3,0,1]=4 428 B11R1.13 Cc1cccc(c1F)OCF 34a_100000751311_100015361967 [0,0,0,0,0,0|3,0,1]=4 429 B11R1.13 Cc1cccc(c1F)OCF 7a_100000751311_100015361967 [0,0,0,0,0,0|3,0,1]=4 430 B11R1.13 Cc1cccc(c1F)SCF 62a_100000717567_100015361967 [0,0,0,0,0,0|3,0,1]=4 431 B11R1.13 Cc1cccc(c1F)SCF 62a_100015361967_100000717567 [0,0,0,0,0,0|3,0,1]=4 432 B11R1.13 Cc1cccc(c1I)CO[13CH3] 34a_100012349780_200025704644 [0,0,0,0,0,0|2,0,1]=3 433 B11R1.13 Cc1cccc(c1I)CO[13CH3] 7a_100012349780_200025704644 [0,0,0,0,0,0|2,0,1]=3 434 B11R1.13 Cc1cccc(c1I)NCF 34a_100000761888_100015361967 [0,0,0,0,0,0|3,0,1]=4 435 B11R1.13 Cc1cccc(c1I)OCF 34a_100010083724_100015361967 [0,0,0,0,0,0|3,0,1]=4 436 B11R1.13 Cc1cccc(c1I)OCF 7a_100010083724_100015361967 [0,0,0,0,0,0|3,0,1]=4 437 B11R1.13 Cc1cccc(c1N)CO[13CH3] 34a_100011215590_200025704644 [0,0,0,0,0,0|2,0,1]=3 438 B11R1.13 Cc1cccc(c1N)OCF 34a_100000743429_100015361967 [0,0,0,0,0,0|3,0,1]=4 439 B11R1.13 Cc1cccc(c1N)OCF 7a_100000743429_100015361967 [0,0,0,0,0,0|3,0,1]=4 440 B11R1.13 Cc1cccc(c1N)SCF 62a_100011834072_100015361967 [0,0,0,0,0,0|3,0,1]=4 441 B11R1.13 Cc1cccc(c1N)SCF 62a_100015361967_100011834072 [0,0,0,0,0,0|3,0,1]=4 442 B11R1.13 Cc1cccc(c1O)CC#N 271570a_203496583355_100010147024 [0,0,0,0,0,0|1,0,1]=2 443 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [0,0,0,0,0,0|1,0,1]=2 444 B11R1.13 Cc1cccc(c1O)NCF 34a_100000756359_100015361967 [0,0,0,0,0,0|2,0,1]=3 445 B11R1.13 Cc1cccc(c1O)SCF 62a_100009817157_100015361967 [0,0,0,0,0,0|2,0,1]=3 446 B11R1.13 Cc1cccc(c1O)SCF 62a_100015361967_100009817157 [0,0,0,0,0,0|2,0,1]=3 447 B11R1.13 Cc1ccnc(c1O)SCF 62a_100015361967_100000696282 [0,0,0,0,0,0|3,0,1]=4 448 B11R1.13 N#CCc1cccc(c1F)O 271570a_203496583355_100009817020 [0,0,0,0,0,0|3,0,1]=4 449 B11R1.13 Nc1cccc(c1O)SCF 62a_100011934915_100015361967 [0,0,0,0,0,0|3,0,1]=4 450 B11R1.13 Nc1cccc(c1O)SCF 62a_100015361967_100010084371 [0,0,0,0,0,0|3,0,1]=4 451 B11R1.13 Oc1c(cccc1NCF)Br 34a_100011934915_100015361967 [0,0,0,0,0,0|3,0,1]=4 452 B11R1.13 Oc1c(cccc1NCF)Cl 34a_100000754742_100015361967 [0,0,0,0,0,0|3,0,1]=4 453 B11R1.13 Oc1c(cccc1NCF)F 34a_100011934987_100015361967 [0,0,0,0,0,0|3,0,1]=4 454 B11R1.13 Oc1c(cccc1SCF)Br 62a_100010084509_100015361967 [0,0,0,0,0,0|3,0,1]=4 455 B11R1.13 Oc1c(cccc1SCF)Br 62a_100015361967_100010084509 [0,0,0,0,0,0|3,0,1]=4 456 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100010202889_100015361967 [0,0,0,0,0,0|3,0,1]=4 457 B11R1.13 Oc1c(cccc1SCF)Cl 62a_100015361967_100010202889 [0,0,0,0,0,0|3,0,1]=4 458 B11R1.13 Oc1c(cccc1SCF)F 62a_100009813666_100015361967 [0,0,0,0,0,0|3,0,1]=4 459 B11R1.13 Oc1c(cccc1SCF)F 62a_100015361967_100009813666 [0,0,0,0,0,0|3,0,1]=4 460 B11R1.13 Oc1cccc(c1O)SCF 62a_100015361967_100009815950 [0,0,0,0,0,0|3,0,1]=4 461 B11R1.13 [13CH3]NCc1cccc(c1Br)F 2230a_100020638964_200025704644 [0,0,0,0,0,0|3,0,1]=4 462 B11R1.13 [13CH3]NCc1cccc(c1Br)F 34a_100020638964_200025704644 [0,0,0,0,0,0|3,0,1]=4 463 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 2230a_100011211633_200025704644 [0,0,0,0,0,0|3,0,1]=4 464 B11R1.13 [13CH3]NCc1cccc(c1Cl)Cl 34a_100011211633_200025704644 [0,0,0,0,0,0|3,0,1]=4 465 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 2230a_100012001614_200025704644 [0,0,0,0,0,0|3,0,1]=4 466 B11R1.13 [13CH3]NCc1cccc(c1Cl)F 34a_100012001614_200025704644 [0,0,0,0,0,0|3,0,1]=4 467 B11R1.13 [13CH3]NCc1cccc(c1F)Br 2230a_100015189953_200025704644 [0,0,0,0,0,0|3,0,1]=4 468 B11R1.13 [13CH3]NCc1cccc(c1F)Br 34a_100015189953_200025704644 [0,0,0,0,0,0|3,0,1]=4 469 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 2230a_100000764326_200025704644 [0,0,0,0,0,0|3,0,1]=4 470 B11R1.13 [13CH3]NCc1cccc(c1F)Cl 34a_100000764326_200025704644 [0,0,0,0,0,0|3,0,1]=4 471 B11R1.13 [13CH3]NCc1cccc(c1F)F 2230a_100011199105_200025704644 [0,0,0,0,0,0|3,0,1]=4 472 B11R1.13 [13CH3]NCc1cccc(c1F)F 34a_100011199105_200025704644 [0,0,0,0,0,0|3,0,1]=4 473 B11R1.13 [13CH3]NCc1cccc(c1F)O 34a_100025773512_200025704644 [0,0,0,0,0,0|3,0,1]=4 474 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 34a_100010168166_200025704644 [0,0,0,0,0,0|3,0,1]=4 475 B11R1.13 [13CH3]OCc1cccc(c1Br)Cl 7a_100010168166_200025704644 [0,0,0,0,0,0|3,0,1]=4 476 B11R1.13 [13CH3]OCc1cccc(c1Br)F 34a_100012351117_200025704644 [0,0,0,0,0,0|3,0,1]=4 477 B11R1.13 [13CH3]OCc1cccc(c1Br)F 7a_100012351117_200025704644 [0,0,0,0,0,0|3,0,1]=4 478 B11R1.13 [13CH3]OCc1cccc(c1Br)I 34a_100010240205_200025704644 [0,0,0,0,0,0|3,0,1]=4 479 B11R1.13 [13CH3]OCc1cccc(c1Br)I 7a_100010240205_200025704644 [0,0,0,0,0,0|3,0,1]=4 480 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 34a_100012351182_200025704644 [0,0,0,0,0,0|3,0,1]=4 481 B11R1.13 [13CH3]OCc1cccc(c1Cl)Br 7a_100012351182_200025704644 [0,0,0,0,0,0|3,0,1]=4 482 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 34a_100000720469_200025704644 [0,0,0,0,0,0|3,0,1]=4 483 B11R1.13 [13CH3]OCc1cccc(c1Cl)Cl 7a_100000720469_200025704644 [0,0,0,0,0,0|3,0,1]=4 484 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 34a_100000696319_200025704644 [0,0,0,0,0,0|3,0,1]=4 485 B11R1.13 [13CH3]OCc1cccc(c1Cl)F 7a_100000696319_200025704644 [0,0,0,0,0,0|3,0,1]=4 486 B11R1.13 [13CH3]OCc1cccc(c1F)Br 34a_100011935076_200025704644 [0,0,0,0,0,0|3,0,1]=4 487 B11R1.13 [13CH3]OCc1cccc(c1F)Br 7a_100011935076_200025704644 [0,0,0,0,0,0|3,0,1]=4 488 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 34a_100011216988_200025704644 [0,0,0,0,0,0|3,0,1]=4 489 B11R1.13 [13CH3]OCc1cccc(c1F)Cl 7a_100011216988_200025704644 [0,0,0,0,0,0|3,0,1]=4 490 B11R1.13 [13CH3]OCc1cccc(c1F)F 34a_100011218644_200025704644 [0,0,0,0,0,0|3,0,1]=4 491 B11R1.13 [13CH3]OCc1cccc(c1F)F 7a_100011218644_200025704644 [0,0,0,0,0,0|3,0,1]=4 492 B11R1.13 [13CH3]OCc1cccc(c1F)I 34a_200010235739_200025704644 [0,0,0,0,0,0|3,0,1]=4 493 B11R1.13 [13CH3]OCc1cccc(c1F)I 7a_200010235739_200025704644 [0,0,0,0,0,0|3,0,1]=4 494 B11R1.13 [13CH3]OCc1cccc(c1F)N 34a_100012023829_200025704644 [0,0,0,0,0,0|3,0,1]=4 495 B11R1.13 [13CH3]OCc1cccc(c1I)Br 34a_100010146604_200025704644 [0,0,0,0,0,0|3,0,1]=4 496 B11R1.13 [13CH3]OCc1cccc(c1I)Br 7a_100010146604_200025704644 [0,0,0,0,0,0|3,0,1]=4 497 B11R1.13 [13CH3]OCc1cccc(c1I)F 34a_100000692438_200025704644 [0,0,0,0,0,0|3,0,1]=4 498 B11R1.13 [13CH3]OCc1cccc(c1I)F 7a_100000692438_200025704644 [0,0,0,0,0,0|3,0,1]=4 499 B11R1.13 [13CH3]OCc1cccc(c1N)Br 34a_100012349457_200025704644 [0,0,0,0,0,0|3,0,1]=4 500 B11R1.13 [13CH3]OCc1cccc(c1N)Cl 34a_100012182729_200025704644 [0,0,0,0,0,0|3,0,1]=4 501 B11R1.13 [13CH3]OCc1cccc(c1N)F 34a_100000692437_200025704644 [0,0,0,0,0,0|3,0,1]=4 502 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_100010145525_200025704644 [0,0,0,0,0,0|3,0,1]=4 503 B11R1.13 [13CH3]SCc1cccc(c1Br)Cl 62a_200025704644_100010145525 [0,0,0,0,0,0|3,0,1]=4 504 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_100012351116_200025704644 [0,0,0,0,0,0|3,0,1]=4 505 B11R1.13 [13CH3]SCc1cccc(c1Br)F 62a_200025704644_100012351116 [0,0,0,0,0,0|3,0,1]=4 506 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_100010254545_200025704644 [0,0,0,0,0,0|3,0,1]=4 507 B11R1.13 [13CH3]SCc1cccc(c1Br)I 62a_200025704644_100010254545 [0,0,0,0,0,0|3,0,1]=4 508 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_100012349491_200025704644 [0,0,0,0,0,0|3,0,1]=4 509 B11R1.13 [13CH3]SCc1cccc(c1Cl)Br 62a_200025704644_100012349491 [0,0,0,0,0,0|3,0,1]=4 510 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_100000720918_200025704644 [0,0,0,0,0,0|3,0,1]=4 511 B11R1.13 [13CH3]SCc1cccc(c1Cl)Cl 62a_200025704644_100000723366 [0,0,0,0,0,0|3,0,1]=4 512 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_100000696688_200025704644 [0,0,0,0,0,0|3,0,1]=4 513 B11R1.13 [13CH3]SCc1cccc(c1Cl)F 62a_200025704644_100000696688 [0,0,0,0,0,0|3,0,1]=4 514 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_100012356506_200025704644 [0,0,0,0,0,0|3,0,1]=4 515 B11R1.13 [13CH3]SCc1cccc(c1F)Br 62a_200025704644_100012356506 [0,0,0,0,0,0|3,0,1]=4 516 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_100000716733_200025704644 [0,0,0,0,0,0|3,0,1]=4 517 B11R1.13 [13CH3]SCc1cccc(c1F)Cl 62a_200025704644_100000716733 [0,0,0,0,0,0|3,0,1]=4 518 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_100000217499_200025704644 [0,0,0,0,0,0|3,0,1]=4 519 B11R1.13 [13CH3]SCc1cccc(c1F)F 62a_200025704644_100000217499 [0,0,0,0,0,0|3,0,1]=4 520 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_100010149603_200025704644 [0,0,0,0,0,0|3,0,1]=4 521 B11R1.13 [13CH3]SCc1cccc(c1I)F 62a_200025704644_100010149603 [0,0,0,0,0,0|3,0,1]=4 522 B10R1.2 C=Cc1cccc(=O)n1C 271570a_100011290941_100000726605 [1,0,0,0,0,0|3,0,0]=4 523 B10R1.2 C=Cc1cccc(c1Br)O 271570a_100011290941_100010187914 [1,0,0,0,0,0|2,0,0]=3 524 B10R1.2 C=Cc1cccc(c1C)Br 271570a_100011290941_100012353703 [1,0,0,0,0,0|2,0,0]=3 525 B10R1.2 C=Cc1cccc(c1C)C 271570a_100011290941_100011214922 [1,0,0,0,0,0|1,0,0]=2 526 B10R1.2 C=Cc1cccc(c1C)Cl 271570a_100011290941_100000726075 [1,0,0,0,0,0|2,0,0]=3 527 B10R1.2 C=Cc1cccc(c1C)F 271570a_100011290941_100011216893 [1,0,0,0,0,0|2,0,0]=3 528 B10R1.2 C=Cc1cccc(c1C)N 271570a_100011290941_100000761887 [1,0,0,0,0,0|2,0,0]=3 529 B10R1.2 C=Cc1cccc(c1C)O 271570a_100011290941_100012002258 [1,0,0,0,0,0|2,0,0]=3 530 B10R1.2 C=Cc1cccc(c1Cl)Br 271570a_100011290941_100010142854 [1,0,0,0,0,0|2,0,0]=3 531 B10R1.2 C=Cc1cccc(c1Cl)C 271570a_100011290941_200012352035 [1,0,0,0,0,0|1,0,0]=2 532 B10R1.2 C=Cc1cccc(c1Cl)Cl 271570a_100011290941_100011215384 [1,0,0,0,0,0|2,0,0]=3 533 B10R1.2 C=Cc1cccc(c1Cl)F 271570a_100011290941_200010234923 [1,0,0,0,0,0|2,0,0]=3 534 B10R1.2 C=Cc1cccc(c1Cl)O 271570a_100011290941_100000049636 [1,0,0,0,0,0|2,0,0]=3 535 B10R1.2 C=Cc1cccc(c1F)Br 271570a_100011290941_100000702267 [1,0,0,0,0,0|2,0,0]=3 536 B10R1.2 C=Cc1cccc(c1F)C 271570a_100011290941_100000717567 [1,0,0,0,0,0|1,0,0]=2 537 B10R1.2 C=Cc1cccc(c1F)Cl 271570a_100011290941_100011217346 [1,0,0,0,0,0|2,0,0]=3 538 B10R1.2 C=Cc1cccc(c1F)F 271570a_100011290941_100000694657 [1,0,0,0,0,0|2,0,0]=3 539 B10R1.2 C=Cc1cccc(c1F)N 271570a_100011290941_100011935091 [1,0,0,0,0,0|2,0,0]=3 540 B10R1.2 C=Cc1cccc(c1F)O 271570a_100011290941_100009817021 [1,0,0,0,0,0|2,0,0]=3 541 B10R1.2 C=Cc1cccc(c1N)Br 271570a_100011290941_100010146558 [1,0,0,0,0,0|2,0,0]=3 542 B10R1.2 C=Cc1cccc(c1N)C 271570a_100011290941_100011834072 [1,0,0,0,0,0|1,0,0]=2 543 B10R1.2 C=Cc1cccc(c1N)Cl 271570a_100011290941_100010190421 [1,0,0,0,0,0|2,0,0]=3 544 B10R1.2 C=Cc1cccc(c1N)F 271570a_100011290941_100000042321 [1,0,0,0,0,0|2,0,0]=3 545 B10R1.2 C=Cc1cccc(c1N)N 271570a_100011290941_100015191791 [1,0,0,0,0,0|2,0,0]=3 546 B10R1.2 C=Cc1cccc(c1N)O 271570a_100011290941_100011934926 [1,0,0,0,0,0|2,0,0]=3 547 B10R1.2 C=Cc1cccc(c1O)Br 271570a_100011290941_100010084509 [1,0,0,0,0,0|1,0,0]=2 548 B10R1.2 C=Cc1cccc(c1O)C 271570a_100011290941_100009817157 [1,0,0,0,0,0|0,0,0]=1 549 B10R1.2 C=Cc1cccc(c1O)Cl 271570a_100011290941_100010202889 [1,0,0,0,0,0|1,0,0]=2 550 B10R1.2 C=Cc1cccc(c1O)F 271570a_100011290941_100009813666 [1,0,0,0,0,0|1,0,0]=2 551 B10R1.2 C=Cc1cccc(c1O)N 271570a_100011290941_100011934915 [1,0,0,0,0,0|1,0,0]=2 552 B10R1.2 C=Cc1cccc(c1O)O 271570a_100011290941_100009815950 [1,0,0,0,0,0|1,0,0]=2 553 B10R1.2 C=Cc1cccn(c1=O)C 271570a_100011290941_100000687173 [1,0,0,0,0,0|1,0,1]=3 554 B10R1.2 C=Cc1ccnc(c1C)C 271570a_100011290941_100009846815 [1,0,0,0,0,0|2,0,0]=3 555 B10R1.2 C=Cc1ccnc(c1C)Cl 271570a_100011290941_100000047055 [1,0,0,0,0,0|3,0,0]=4 556 B10R1.2 C=Cc1ccnc(c1C)F 271570a_100011290941_100010006593 [1,0,0,0,0,0|3,0,0]=4 557 B10R1.2 C=Cc1ccnc(c1C)N 271570a_100011290941_100009865460 [1,0,0,0,0,0|3,0,0]=4 558 B10R1.2 C=Cc1ccnc(c1C)O 271570a_100011290941_100009858498 [1,0,0,0,0,0|3,0,0]=4 559 B10R1.2 C=Cc1ccnc(c1Cl)C 271570a_100011290941_100000698670 [1,0,0,0,0,0|2,0,0]=3 560 B10R1.2 C=Cc1ccnc(c1Cl)Cl 271570a_100011290941_100010246212 [1,0,0,0,0,0|3,0,0]=4 561 B10R1.2 C=Cc1ccnc(c1Cl)F 271570a_100011290941_100010067886 [1,0,0,0,0,0|3,0,0]=4 562 B10R1.2 C=Cc1ccnc(c1Cl)N 271570a_100011290941_100010735111 [1,0,0,0,0,0|3,0,0]=4 563 B10R1.2 C=Cc1ccnc(c1F)Br 271570a_100011290941_200015269031 [1,0,0,0,0,0|3,0,0]=4 564 B10R1.2 C=Cc1ccnc(c1F)C 271570a_100011290941_100009849794 [1,0,0,0,0,0|2,0,0]=3 565 B10R1.2 C=Cc1ccnc(c1F)Cl 271570a_100011290941_100010150473 [1,0,0,0,0,0|3,0,0]=4 566 B10R1.2 C=Cc1ccnc(c1F)F 271570a_100011290941_100010214882 [1,0,0,0,0,0|3,0,0]=4 567 B10R1.2 C=Cc1ccnc(c1F)N 271570a_100011290941_100010077785 [1,0,0,0,0,0|3,0,0]=4 568 B10R1.2 C=Cc1ccnc(c1N)C 271570a_100011290941_100009885578 [1,0,0,0,0,0|2,0,0]=3 569 B10R1.2 C=Cc1ccnc(c1N)N 271570a_100011290941_100000124095 [1,0,0,0,0,0|3,0,0]=4 570 B10R1.2 C=Cc1cncc(c1C)Br 271570a_100011290941_100010109657 [1,0,0,0,0,0|3,0,0]=4 571 B10R1.2 C=Cc1cncc(c1C)C 271570a_100011290941_100009864703 [1,0,0,0,0,0|2,0,0]=3 572 B10R1.2 C=Cc1cncc(c1C)F 271570a_100011290941_100009881546 [1,0,0,0,0,0|3,0,0]=4 573 B10R1.2 C=Cc1cncc(c1C)N 271570a_100011290941_100011998293 [1,0,0,0,0,0|3,0,0]=4 574 B10R1.2 C=Cc1cncc(c1N)Br 271570a_100011290941_100011290786 [1,0,0,0,0,0|3,0,0]=4 575 B10R1.2 C=Cc1cncc(c1N)C 271570a_100011290941_100009818025 [1,0,0,0,0,0|2,0,0]=3 576 B10R1.2 C=Cc1cncc(c1N)Cl 271570a_100011290941_100000684942 [1,0,0,0,0,0|3,0,0]=4 577 B10R1.2 C=Cc1cncc(c1N)F 271570a_100011290941_100009880649 [1,0,0,0,0,0|3,0,0]=4 578 B10R1.2 C=Cc1cncc(c1N)N 271570a_100011290941_100000694774 [1,0,0,0,0,0|3,0,0]=4 579 B10R1.2 C=Cc1nccc(c1C)C 271570a_100011290941_100009847204 [1,0,0,0,0,0|2,0,0]=3 580 B10R1.2 C=Cc1nccc(c1C)F 271570a_100011290941_100009846374 [1,0,0,0,0,0|3,0,0]=4 581 B10R1.2 C=Cc1nccc(c1C)N 271570a_100011290941_100009980296 [1,0,0,0,0,0|3,0,0]=4 582 B10R1.2 C=Cc1nccc(c1F)C 271570a_100011290941_100009817629 [1,0,0,0,0,0|2,0,0]=3 583 B10R1.2 C=Cc1nccc(c1F)N 271570a_100011290941_100015205195 [1,0,0,0,0,0|3,0,0]=4 584 B10R1.2 C=Cc1nccc(c1F)O 271570a_100011290941_100009876375 [1,0,0,0,0,0|3,0,0]=4 585 B10R1.2 C=Cc1nccc(c1N)C 271570a_100011290941_100000763560 [1,0,0,0,0,0|2,0,0]=3 586 B10R1.2 C=Cc1nccc(c1N)N 271570a_100011290941_100000085203 [1,0,0,0,0,0|3,0,0]=4 587 B10R1.2 C=Cc1nccc(c1N)O 271570a_100011290941_100000128729 [1,0,0,0,0,0|3,0,0]=4 588 B10R1.2 C=Cc1nccc(c1O)C 271570a_100011290941_100000696282 [1,0,0,0,0,0|1,0,0]=2 589 B10R1.2 C=Cc1nccc(c1O)F 271570a_100011290941_100009867227 [1,0,0,0,0,0|2,0,0]=3 590 B10R1.2 C=Cc1ncnc(c1C)C 271570a_100011290941_100011438038 [1,0,0,0,0,0|3,0,0]=4 591 B10R1.2 C=Cc1ncnc(c1F)C 271570a_100011290941_100011671633 [1,0,0,0,0,0|3,0,0]=4 592 B10R1.2 CCc1cccc(c1O)C 271570a_203496583355_100000036235 [1,0,0,0,0,0|0,0,1]=2 593 B10R1.2 CCc1cccc(c1O)O 271570a_203496583355_200010001580 [1,0,0,0,0,0|1,0,1]=3 594 B10R1.2 CNc1cccc(c1Br)C 34a_100000684715_200000210301 [1,0,0,0,0,0|2,0,1]=4 595 B10R1.2 CNc1cccc(c1C)C 2230a_100000210026_200000210301 [1,0,0,0,0,0|2,0,1]=4 596 B10R1.2 CNc1cccc(c1C)C 34a_100000210026_200000210301 [1,0,0,0,0,0|2,0,1]=4 597 B10R1.2 CNc1cccc(c1C)C 7a_100000210026_200000210301 [1,0,0,0,0,0|2,0,1]=4 598 B10R1.2 CNc1cccc(c1Cl)C 34a_100000765562_200000210301 [1,0,0,0,0,0|2,0,1]=4 599 B10R1.2 CNc1cccc(c1Cl)C 7a_100000765562_200000210301 [1,0,0,0,0,0|2,0,1]=4 600 B10R1.2 CNc1cccc(c1F)C 2230a_100000697159_200000210301 [1,0,0,0,0,0|2,0,1]=4 601 B10R1.2 CNc1cccc(c1F)C 34a_100000697159_200000210301 [1,0,0,0,0,0|2,0,1]=4 602 B10R1.2 CNc1cccc(c1F)C 7a_100000697159_200000210301 [1,0,0,0,0,0|2,0,1]=4 603 B10R1.2 CNc1cccc(c1I)C 34a_100000761888_200000210301 [1,0,0,0,0,0|2,0,1]=4 604 B10R1.2 CNc1cccc(c1O)Br 34a_100011934915_200000210301 [1,0,0,0,0,0|2,0,1]=4 605 B10R1.2 CNc1cccc(c1O)C 34a_100000756359_200000210301 [1,0,0,0,0,0|1,0,1]=3 606 B10R1.2 CNc1cccc(c1O)Cl 34a_100000754742_200000210301 [1,0,0,0,0,0|2,0,1]=4 607 B10R1.2 CNc1cccc(c1O)F 34a_100011934987_200000210301 [1,0,0,0,0,0|2,0,1]=4 608 B10R1.2 COc1cccc(c1Br)C 34a_100000686692_200000210301 [1,0,0,0,0,0|2,0,1]=4 609 B10R1.2 COc1cccc(c1Br)C 7a_100000686692_200000210301 [1,0,0,0,0,0|2,0,1]=4 610 B10R1.2 COc1cccc(c1C)C 34a_100000185855_200000210301 [1,0,0,0,0,0|2,0,1]=4 611 B10R1.2 COc1cccc(c1C)C 7a_100000185855_200000210301 [1,0,0,0,0,0|2,0,1]=4 612 B10R1.2 COc1cccc(c1Cl)C 34a_100000695629_200000210301 [1,0,0,0,0,0|2,0,1]=4 613 B10R1.2 COc1cccc(c1Cl)C 7a_100000695629_200000210301 [1,0,0,0,0,0|2,0,1]=4 614 B10R1.2 COc1cccc(c1F)C 34a_100000751311_200000210301 [1,0,0,0,0,0|2,0,1]=4 615 B10R1.2 COc1cccc(c1F)C 7a_100000751311_200000210301 [1,0,0,0,0,0|2,0,1]=4 616 B10R1.2 COc1cccc(c1I)C 34a_100010083724_200000210301 [1,0,0,0,0,0|2,0,1]=4 617 B10R1.2 COc1cccc(c1I)C 7a_100010083724_200000210301 [1,0,0,0,0,0|2,0,1]=4 618 B10R1.2 COc1cccc(c1N)C 34a_100000743429_200000210301 [1,0,0,0,0,0|2,0,1]=4 619 B10R1.2 COc1cccc(c1N)C 7a_100000743429_200000210301 [1,0,0,0,0,0|2,0,1]=4 620 B10R1.2 COc1cccc(c1O)Br 271570a_203496583355_100010131421 [1,0,0,0,0,0|2,0,1]=4 621 B10R1.2 COc1cccc(c1O)F 271570a_203496583355_100000041735 [1,0,0,0,0,0|2,0,1]=4 622 B10R1.2 COc1cccc(c1O)N 271570a_203496583355_100000703447 [1,0,0,0,0,0|2,0,1]=4 623 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100000686866 [1,0,0,0,0,0|2,0,1]=4 624 B10R1.2 COc1cccc(c1O)O 271570a_203496583355_100010202623 [1,0,0,0,0,0|2,0,1]=4 625 B10R1.2 COc1nccc(c1O)C 271570a_203496583355_100012353928 [1,0,0,0,0,0|2,0,1]=4 626 B10R1.2 CSc1cccc(c1Br)C 62a_100012362457_200000210301 [1,0,0,0,0,0|2,0,1]=4 627 B10R1.2 CSc1cccc(c1Br)C 62a_200000210301_100012362457 [1,0,0,0,0,0|2,0,1]=4 628 B10R1.2 CSc1cccc(c1C)C 62a_100011214922_200000210301 [1,0,0,0,0,0|2,0,1]=4 629 B10R1.2 CSc1cccc(c1C)C 62a_200000210301_100011214922 [1,0,0,0,0,0|2,0,1]=4 630 B10R1.2 CSc1cccc(c1Cl)C 62a_200000210301_200012352035 [1,0,0,0,0,0|2,0,1]=4 631 B10R1.2 CSc1cccc(c1Cl)C 62a_200012352035_200000210301 [1,0,0,0,0,0|2,0,1]=4 632 B10R1.2 CSc1cccc(c1F)C 62a_100000717567_200000210301 [1,0,0,0,0,0|2,0,1]=4 633 B10R1.2 CSc1cccc(c1F)C 62a_200000210301_100000717567 [1,0,0,0,0,0|2,0,1]=4 634 B10R1.2 CSc1cccc(c1N)C 62a_100011834072_200000210301 [1,0,0,0,0,0|2,0,1]=4 635 B10R1.2 CSc1cccc(c1N)C 62a_200000210301_100011834072 [1,0,0,0,0,0|2,0,1]=4 636 B10R1.2 CSc1cccc(c1O)Br 62a_100010084509_200000210301 [1,0,0,0,0,0|2,0,1]=4 637 B10R1.2 CSc1cccc(c1O)Br 62a_200000210301_100010084509 [1,0,0,0,0,0|2,0,1]=4 638 B10R1.2 CSc1cccc(c1O)C 62a_100009817157_200000210301 [1,0,0,0,0,0|1,0,1]=3 639 B10R1.2 CSc1cccc(c1O)C 62a_200000210301_100009817157 [1,0,0,0,0,0|1,0,1]=3 640 B10R1.2 CSc1cccc(c1O)Cl 62a_100010202889_200000210301 [1,0,0,0,0,0|2,0,1]=4 641 B10R1.2 CSc1cccc(c1O)Cl 62a_200000210301_100010202889 [1,0,0,0,0,0|2,0,1]=4 642 B10R1.2 CSc1cccc(c1O)F 62a_100009813666_200000210301 [1,0,0,0,0,0|2,0,1]=4 643 B10R1.2 CSc1cccc(c1O)F 62a_200000210301_100009813666 [1,0,0,0,0,0|2,0,1]=4 644 B10R1.2 CSc1cccc(c1O)N 62a_100011934915_200000210301 [1,0,0,0,0,0|2,0,1]=4 645 B10R1.2 CSc1cccc(c1O)N 62a_200000210301_100010084371 [1,0,0,0,0,0|2,0,1]=4 646 B10R1.2 CSc1cccc(c1O)O 62a_200000210301_100009815950 [1,0,0,0,0,0|2,0,1]=4 647 B10R1.2 CSc1nccc(c1O)C 62a_200000210301_100000696282 [1,0,0,0,0,0|2,0,1]=4 648 B10R1.2 Cc1c(cccc1C=O)O 271570a_203496583355_100012179384 [1,0,0,0,0,0|3,0,0]=4 649 B10R1.2 Cc1c(cccc1CN)O 271570a_203496583355_100000724210 [1,0,0,0,0,0|3,0,0]=4 650 B10R1.2 Cc1c(cccc1CO)O 271570a_203496583355_100000694458 [1,0,0,0,0,0|3,0,0]=4 651 B10R1.2 Cc1cccc(c1Br)N[13CH3] 34a_100000684715_200025704644 [1,0,0,0,0,0|2,0,1]=4 652 B10R1.2 Cc1cccc(c1Br)O[13CH3] 34a_100000686692_200025704644 [1,0,0,0,0,0|2,0,1]=4 653 B10R1.2 Cc1cccc(c1Br)O[13CH3] 7a_100000686692_200025704644 [1,0,0,0,0,0|2,0,1]=4 654 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_100012362457_200025704644 [1,0,0,0,0,0|2,0,1]=4 655 B10R1.2 Cc1cccc(c1Br)S[13CH3] 62a_200025704644_100012362457 [1,0,0,0,0,0|2,0,1]=4 656 B10R1.2 Cc1cccc(c1C)N[13CH3] 2230a_100000210026_200025704644 [1,0,0,0,0,0|2,0,1]=4 657 B10R1.2 Cc1cccc(c1C)N[13CH3] 34a_100000210026_200025704644 [1,0,0,0,0,0|2,0,1]=4 658 B10R1.2 Cc1cccc(c1C)N[13CH3] 7a_100000210026_200025704644 [1,0,0,0,0,0|2,0,1]=4 659 B10R1.2 Cc1cccc(c1C)O[13CH3] 34a_100000185855_200025704644 [1,0,0,0,0,0|2,0,1]=4 660 B10R1.2 Cc1cccc(c1C)O[13CH3] 7a_100000185855_200025704644 [1,0,0,0,0,0|2,0,1]=4 661 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_100011214922_200025704644 [1,0,0,0,0,0|2,0,1]=4 662 B10R1.2 Cc1cccc(c1C)S[13CH3] 62a_200025704644_100011214922 [1,0,0,0,0,0|2,0,1]=4 663 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 34a_100000765562_200025704644 [1,0,0,0,0,0|2,0,1]=4 664 B10R1.2 Cc1cccc(c1Cl)N[13CH3] 7a_100000765562_200025704644 [1,0,0,0,0,0|2,0,1]=4 665 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 34a_100000695629_200025704644 [1,0,0,0,0,0|2,0,1]=4 666 B10R1.2 Cc1cccc(c1Cl)O[13CH3] 7a_100000695629_200025704644 [1,0,0,0,0,0|2,0,1]=4 667 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200012352035_200025704644 [1,0,0,0,0,0|2,0,1]=4 668 B10R1.2 Cc1cccc(c1Cl)S[13CH3] 62a_200025704644_200012352035 [1,0,0,0,0,0|2,0,1]=4 669 B10R1.2 Cc1cccc(c1F)N[13CH3] 2230a_100000697159_200025704644 [1,0,0,0,0,0|2,0,1]=4 670 B10R1.2 Cc1cccc(c1F)N[13CH3] 34a_100000697159_200025704644 [1,0,0,0,0,0|2,0,1]=4 671 B10R1.2 Cc1cccc(c1F)N[13CH3] 7a_100000697159_200025704644 [1,0,0,0,0,0|2,0,1]=4 672 B10R1.2 Cc1cccc(c1F)O[13CH3] 34a_100000751311_200025704644 [1,0,0,0,0,0|2,0,1]=4 673 B10R1.2 Cc1cccc(c1F)O[13CH3] 7a_100000751311_200025704644 [1,0,0,0,0,0|2,0,1]=4 674 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_100000717567_200025704644 [1,0,0,0,0,0|2,0,1]=4 675 B10R1.2 Cc1cccc(c1F)S[13CH3] 62a_200025704644_100000717567 [1,0,0,0,0,0|2,0,1]=4 676 B10R1.2 Cc1cccc(c1I)N[13CH3] 34a_100000761888_200025704644 [1,0,0,0,0,0|2,0,1]=4 677 B10R1.2 Cc1cccc(c1I)O[13CH3] 34a_100010083724_200025704644 [1,0,0,0,0,0|2,0,1]=4 678 B10R1.2 Cc1cccc(c1I)O[13CH3] 7a_100010083724_200025704644 [1,0,0,0,0,0|2,0,1]=4 679 B10R1.2 Cc1cccc(c1N)O[13CH3] 34a_100000743429_200025704644 [1,0,0,0,0,0|2,0,1]=4 680 B10R1.2 Cc1cccc(c1N)O[13CH3] 7a_100000743429_200025704644 [1,0,0,0,0,0|2,0,1]=4 681 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_100011834072_200025704644 [1,0,0,0,0,0|2,0,1]=4 682 B10R1.2 Cc1cccc(c1N)S[13CH3] 62a_200025704644_100011834072 [1,0,0,0,0,0|2,0,1]=4 683 B10R1.2 Cc1cccc(c1O)C#N 271570a_203496583355_100011934862 [1,0,0,0,0,0|1,0,1]=3 684 B10R1.2 Cc1cccc(c1O)CO 271570a_203496583355_100011659289 [1,0,0,0,0,0|1,0,0]=2 685 B10R1.2 Cc1cccc(c1O)N[13CH3] 34a_100000756359_200025704644 [1,0,0,0,0,0|1,0,1]=3 686 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_100009817157_200025704644 [1,0,0,0,0,0|1,0,1]=3 687 B10R1.2 Cc1cccc(c1O)S[13CH3] 62a_200025704644_100009817157 [1,0,0,0,0,0|1,0,1]=3 688 B10R1.2 Cc1ccnc(c1O)C#N 271570a_203496583355_100009878727 [1,0,0,0,0,0|2,0,1]=4 689 B10R1.2 Cc1ccnc(c1O)S[13CH3] 62a_200025704644_100000696282 [1,0,0,0,0,0|2,0,1]=4 690 B10R1.2 N#Cc1cccc(c1O)Br 271570a_203496583355_100000703783 [1,0,0,0,0,0|2,0,1]=4 691 B10R1.2 N#Cc1cccc(c1O)Cl 271570a_203496583355_100010134094 [1,0,0,0,0,0|2,0,1]=4 692 B10R1.2 N#Cc1cccc(c1O)F 271570a_203496583355_100011219237 [1,0,0,0,0,0|2,0,1]=4 693 B10R1.2 N#Cc1cccc(c1O)N 271570a_203496583355_100009877206 [1,0,0,0,0,0|2,0,1]=4 694 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009817103 [1,0,0,0,0,0|2,0,1]=4 695 B10R1.2 N#Cc1cccc(c1O)O 271570a_203496583355_100009818990 [1,0,0,0,0,0|2,0,1]=4 696 B10R1.2 NCc1cccc(c1F)O 271570a_203496583355_100015189953 [1,0,0,0,0,0|3,0,0]=4 697 B10R1.2 Nc1c(cccc1C=O)O 271570a_203496583355_100010144990 [1,0,0,0,0,0|3,0,0]=4 698 B10R1.2 Nc1c(cccc1CO)O 271570a_203496583355_100012349457 [1,0,0,0,0,0|3,0,0]=4 699 B10R1.2 O=Cc1cccc(c1F)O 271570a_203496583355_100000766533 [1,0,0,0,0,0|3,0,0]=4 700 B10R1.2 O=Cc1cccc(c1O)F 271570a_203496583355_100011998484 [1,0,0,0,0,0|2,0,0]=3 701 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100000737635 [1,0,0,0,0,0|2,0,0]=3 702 B10R1.2 O=Cc1cccc(c1O)O 271570a_203496583355_100009816417 [1,0,0,0,0,0|2,0,0]=3 703 B10R1.2 O=Cc1ccnc(c1O)F 271570a_203496583355_100009856171 [1,0,0,0,0,0|3,0,0]=4 704 B10R1.2 OCc1cccc(c1Br)O 271570a_203496583355_100010240205 [1,0,0,0,0,0|3,0,0]=4 705 B10R1.2 OCc1cccc(c1F)O 271570a_203496583355_100011935076 [1,0,0,0,0,0|3,0,0]=4 706 B10R1.2 OCc1cccc(c1O)Br 271570a_203496583355_100010146604 [1,0,0,0,0,0|2,0,0]=3 707 B10R1.2 OCc1cccc(c1O)F 271570a_203496583355_100000692438 [1,0,0,0,0,0|2,0,0]=3 708 B10R1.2 [13CH3]Nc1cccc(c1O)Br 34a_100011934915_200025704644 [1,0,0,0,0,0|2,0,1]=4 709 B10R1.2 [13CH3]Nc1cccc(c1O)Cl 34a_100000754742_200025704644 [1,0,0,0,0,0|2,0,1]=4 710 B10R1.2 [13CH3]Nc1cccc(c1O)F 34a_100011934987_200025704644 [1,0,0,0,0,0|2,0,1]=4 711 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_100010084509_200025704644 [1,0,0,0,0,0|2,0,1]=4 712 B10R1.2 [13CH3]Sc1cccc(c1O)Br 62a_200025704644_100010084509 [1,0,0,0,0,0|2,0,1]=4 713 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_100010202889_200025704644 [1,0,0,0,0,0|2,0,1]=4 714 B10R1.2 [13CH3]Sc1cccc(c1O)Cl 62a_200025704644_100010202889 [1,0,0,0,0,0|2,0,1]=4 715 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_100009813666_200025704644 [1,0,0,0,0,0|2,0,1]=4 716 B10R1.2 [13CH3]Sc1cccc(c1O)F 62a_200025704644_100009813666 [1,0,0,0,0,0|2,0,1]=4 717 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_100011934915_200025704644 [1,0,0,0,0,0|2,0,1]=4 718 B10R1.2 [13CH3]Sc1cccc(c1O)N 62a_200025704644_100010084371 [1,0,0,0,0,0|2,0,1]=4 719 B10R1.2 [13CH3]Sc1cccc(c1O)O 62a_200025704644_100009815950 [1,0,0,0,0,0|2,0,1]=4 720 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [1,0,0,0,0,0|1,0,2]=4 721 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [1,0,0,0,0,0|1,0,2]=4 722 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [1,0,0,0,0,0|1,0,2]=4 723 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [1,0,0,0,0,0|1,0,2]=4 724 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [1,0,0,0,0,0|1,0,2]=4 725 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [1,0,0,0,0,0|0,0,2]=3 726 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [1,0,0,0,0,0|1,0,2]=4 727 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [1,0,0,0,0,0|1,0,2]=4 728 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [1,0,0,0,0,0|0,0,0]=1 729 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [1,0,0,0,0,0|1,0,2]=4 730 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [1,0,0,0,0,0|1,0,2]=4 731 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [1,0,0,0,0,0|1,0,2]=4 732 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [1,0,0,0,0,0|1,0,2]=4 733 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [1,0,0,0,0,0|1,0,2]=4 734 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [1,0,0,0,0,0|0,0,2]=3 735 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [1,0,0,0,0,0|1,0,2]=4 736 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [1,0,0,0,0,0|1,0,2]=4 737 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [1,0,0,0,0,0|1,0,2]=4 738 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [1,0,0,0,0,0|1,0,2]=4 739 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [1,0,0,0,0,0|1,0,2]=4 740 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [1,0,0,0,0,0|1,0,2]=4 741 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [1,0,0,0,0,0|1,0,2]=4 742 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [1,0,0,0,0,0|1,0,2]=4 743 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [1,0,0,0,0,0|2,0,1]=4 744 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [1,0,0,0,0,0|2,0,1]=4 745 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [1,0,0,0,0,0|2,0,1]=4 746 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [1,0,0,0,0,0|2,0,1]=4 747 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [1,0,0,0,0,0|2,0,1]=4 748 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [1,0,0,0,0,0|2,0,1]=4 749 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [1,0,0,0,0,0|2,0,1]=4 750 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [1,0,0,0,0,0|2,0,1]=4 751 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [1,0,0,0,0,0|2,0,1]=4 752 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [1,0,0,0,0,0|2,0,1]=4 753 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [1,0,0,0,0,0|2,0,1]=4 754 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [1,0,0,0,0,0|2,0,1]=4 755 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [1,0,0,0,0,0|2,0,1]=4 756 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [1,0,0,0,0,0|2,0,1]=4 757 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [1,0,0,0,0,0|2,0,1]=4 758 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [1,0,0,0,0,0|2,0,1]=4 759 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [1,0,0,0,0,0|2,0,1]=4 760 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [1,0,0,0,0,0|2,0,1]=4 761 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [1,0,0,0,0,0|2,0,1]=4 762 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [1,0,0,0,0,0|2,0,1]=4 763 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [1,0,0,0,0,0|2,0,1]=4 764 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [1,0,0,0,0,0|2,0,1]=4 765 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [1,0,0,0,0,0|2,0,1]=4 766 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [1,0,0,0,0,0|2,0,1]=4 767 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [1,0,0,0,0,0|2,0,1]=4 768 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [1,0,0,0,0,0|2,0,1]=4 769 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [1,0,0,0,0,0|2,0,1]=4 770 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [1,0,0,0,0,0|2,0,1]=4 771 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [1,0,0,0,0,0|2,0,1]=4 772 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [1,0,0,0,0,0|2,0,1]=4 773 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [1,0,0,0,0,0|2,0,1]=4 774 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [1,0,0,0,0,0|2,0,1]=4 775 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [1,0,0,0,0,0|2,0,1]=4 776 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [1,0,0,0,0,0|1,0,1]=3 777 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [1,0,0,0,0,0|1,0,1]=3 778 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [1,0,0,0,0,0|2,0,1]=4 779 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [1,0,0,0,0,0|2,0,1]=4 780 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [1,0,0,0,0,0|2,0,1]=4 781 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [1,0,0,0,0,0|2,0,1]=4 782 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [1,0,0,0,0,0|2,0,1]=4 783 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [1,0,0,0,0,0|2,0,1]=4 784 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [1,0,0,0,0,0|2,0,1]=4 785 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [1,0,0,0,0,0|2,0,1]=4 786 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [1,0,0,0,0,0|2,0,1]=4 787 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [1,0,0,0,0,0|2,0,1]=4 788 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [1,0,0,0,0,0|2,0,1]=4 789 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [1,0,0,0,0,0|2,0,1]=4 790 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [1,0,0,0,0,0|2,0,1]=4 791 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [1,0,0,0,0,0|2,0,1]=4 792 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [1,0,0,0,0,0|2,0,1]=4 793 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [1,0,0,0,0,0|2,0,1]=4 794 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [1,0,0,0,0,0|2,0,1]=4 795 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [1,0,0,0,0,0|2,0,1]=4 796 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [1,0,0,0,0,0|2,0,1]=4 797 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [1,0,0,0,0,0|2,0,1]=4 798 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [1,0,0,0,0,0|2,0,1]=4 799 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [1,0,0,0,0,0|1,0,1]=3 800 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [1,0,0,0,0,0|2,0,1]=4 801 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [1,0,0,0,0,0|2,0,1]=4 802 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [1,0,0,0,0,0|2,0,1]=4 803 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [1,0,0,0,0,0|2,0,1]=4 804 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [1,0,0,0,0,0|2,0,1]=4 805 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [1,0,0,0,0,0|2,0,1]=4 806 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [1,0,0,0,0,0|2,0,1]=4 807 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [1,0,0,0,0,0|2,0,1]=4 808 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [1,0,0,0,0,0|2,0,1]=4 809 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [1,0,0,0,0,0|2,0,1]=4 810 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [1,0,0,0,0,0|2,0,1]=4 811 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [1,0,0,0,0,0|1,0,1]=3 812 B10R1.4 CSCc1ncccc1O 62a_200000210301_200020655725 [1,0,0,0,0,0|2,0,1]=4 813 B10R1.4 CSCc1ncccc1O 62a_200020655725_200000210301 [1,0,0,0,0,0|2,0,1]=4 814 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [1,0,0,0,0,0|2,0,1]=4 815 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [1,0,0,0,0,0|2,0,1]=4 816 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [1,0,0,0,0,0|2,0,1]=4 817 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [1,0,0,0,0,0|2,0,1]=4 818 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [1,0,0,0,0,0|2,0,1]=4 819 B10R1.4 N#CCc1ccccc1O 271570a_203496583355_100000033512 [1,0,0,0,0,0|1,0,1]=3 820 B10R1.4 N#CCc1cccnc1O 271570a_203496583355_100000096391 [1,0,0,0,0,0|2,0,1]=4 821 B10R1.4 N#CCc1ncccc1O 271570a_203496583355_100011824415 [1,0,0,0,0,0|2,0,1]=4 822 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [1,0,0,0,0,0|1,0,1]=3 823 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [1,0,0,0,0,0|2,0,0]=3 824 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [1,0,0,0,0,0|1,0,1]=3 825 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [1,0,0,0,0,0|2,0,1]=4 826 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [1,0,0,0,0,0|2,0,1]=4 827 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [1,0,0,0,0,0|2,0,1]=4 828 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [1,0,0,0,0,0|2,0,1]=4 829 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [1,0,0,0,0,0|2,0,1]=4 830 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [1,0,0,0,0,0|2,0,1]=4 831 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [1,0,0,0,0,0|2,0,1]=4 832 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [1,0,0,0,0,0|2,0,1]=4 833 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [1,0,0,0,0,0|1,0,1]=3 834 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [1,0,0,0,0,0|2,0,1]=4 835 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [1,0,0,0,0,0|2,0,1]=4 836 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [1,0,0,0,0,0|2,0,1]=4 837 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [1,0,0,0,0,0|2,0,1]=4 838 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [1,0,0,0,0,0|2,0,1]=4 839 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [1,0,0,0,0,0|2,0,1]=4 840 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [1,0,0,0,0,0|2,0,1]=4 841 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [1,0,0,0,0,0|2,0,1]=4 842 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [1,0,0,0,0,0|2,0,1]=4 843 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [1,0,0,0,0,0|2,0,1]=4 844 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [1,0,0,0,0,0|2,0,1]=4 845 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [1,0,0,0,0,0|2,0,1]=4 846 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [1,0,0,0,0,0|2,0,1]=4 847 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [1,0,0,0,0,0|2,0,1]=4 848 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [1,0,0,0,0,0|2,0,1]=4 849 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [1,0,0,0,0,0|2,0,1]=4 850 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [1,0,0,0,0,0|2,0,1]=4 851 B10R1.4 [13CH3]SCc1ncccc1O 62a_200020655725_200025704644 [1,0,0,0,0,0|2,0,1]=4 852 B10R1.4 [13CH3]SCc1ncccc1O 62a_200025704644_200020655725 [1,0,0,0,0,0|2,0,1]=4 853 B10R1.4 [N-]=[N+]=Nc1ccccc1O 271570a_203496583355_100000762926 [1,0,0,0,0,0|3,0,0]=4 854 B10R1.10 C=C=Cc1cc(ccn1)C 271570a_100015277604_100000750283 [1,0,0,0,0,0|1,0,2]=4 855 B10R1.10 C=C=Cc1ccc[n+](c1)C 271570a_100015277604_100009996589 [1,0,0,0,0,0|1,0,2]=4 856 B10R1.10 C=C=Cc1cccc(c1)Br 271570a_100015277604_100000691529 [1,0,0,0,0,0|1,0,2]=4 857 B10R1.10 C=C=Cc1cccc(c1)C 271570a_100015277604_100011215228 [1,0,0,0,0,0|0,0,2]=3 858 B10R1.10 C=C=Cc1cccc(c1)Cl 271570a_100015277604_100000699651 [1,0,0,0,0,0|1,0,2]=4 859 B10R1.10 C=C=Cc1cccc(c1)F 271570a_100015277604_100000685547 [1,0,0,0,0,0|1,0,2]=4 860 B10R1.10 C=C=Cc1cccc(c1)N 271570a_100015277604_100000210019 [1,0,0,0,0,0|1,0,2]=4 861 B10R1.10 C=C=Cc1cccc(c1)O 271570a_100015277604_100000211634 [1,0,0,0,0,0|1,0,2]=4 862 B10R1.10 C=C=Cc1cccc(c1)[S] 271570a_100015277604_114929384022 [1,0,0,0,0,0|1,0,2]=4 863 B10R1.10 C=C=Cc1cccc(n1)C 271570a_100015277604_100000742759 [1,0,0,0,0,0|1,0,2]=4 864 B10R1.10 C=C=Cc1ccnc(c1)C 271570a_100015277604_100000758586 [1,0,0,0,0,0|1,0,2]=4 865 B10R1.10 C=C=Cc1cncc(c1)C 271570a_100015277604_100000760492 [1,0,0,0,0,0|1,0,2]=4 866 B10R1.10 C=CCc1cccc(c1)O 271570a_203496583355_100009816576 [1,0,0,0,0,0|1,0,0]=2 867 B10R1.10 CC=Cc1cc(ccn1)C 271570a_100016259895_100000750283 [1,0,0,0,0,0|1,0,2]=4 868 B10R1.10 CC=Cc1ccc[n+](c1)C 271570a_100016259895_100009996589 [1,0,0,0,0,0|1,0,2]=4 869 B10R1.10 CC=Cc1cccc(c1)Br 271570a_100016259895_100000691529 [1,0,0,0,0,0|1,0,2]=4 870 B10R1.10 CC=Cc1cccc(c1)C 271570a_100016259895_100011215228 [1,0,0,0,0,0|0,0,2]=3 871 B10R1.10 CC=Cc1cccc(c1)Cl 271570a_100016259895_100000699651 [1,0,0,0,0,0|1,0,2]=4 872 B10R1.10 CC=Cc1cccc(c1)F 271570a_100016259895_100000685547 [1,0,0,0,0,0|1,0,2]=4 873 B10R1.10 CC=Cc1cccc(c1)N 271570a_100016259895_100000210019 [1,0,0,0,0,0|1,0,2]=4 874 B10R1.10 CC=Cc1cccc(c1)O 271570a_100016259895_100000211634 [1,0,0,0,0,0|1,0,2]=4 875 B10R1.10 CC=Cc1cccc(c1)[S] 271570a_100016259895_114929384022 [1,0,0,0,0,0|1,0,2]=4 876 B10R1.10 CC=Cc1cccc(n1)C 271570a_100016259895_100000742759 [1,0,0,0,0,0|1,0,2]=4 877 B10R1.10 CC=Cc1ccnc(c1)C 271570a_100016259895_100000758586 [1,0,0,0,0,0|1,0,2]=4 878 B10R1.10 CC=Cc1cncc(c1)C 271570a_100016259895_100000760492 [1,0,0,0,0,0|1,0,2]=4 879 B10R1.10 CCCc1cccc(c1)O 271570a_203496583355_100000694964 [1,0,0,0,0,0|1,0,2]=4 880 B10R1.10 CCNc1cccc(c1)C 2230a_100000188690_100000210202 [1,0,0,0,0,0|1,0,2]=4 881 B10R1.10 CCNc1cccc(c1)C 34a_100000188690_100000210202 [1,0,0,0,0,0|1,0,2]=4 882 B10R1.10 CCOc1cccc(c1)C 34a_100000210337_100000210202 [1,0,0,0,0,0|1,0,2]=4 883 B10R1.10 CCOc1cccc(c1)C 7a_100000210337_100000210202 [1,0,0,0,0,0|1,0,2]=4 884 B10R1.10 CCSc1cccc(c1)C 62a_100000210202_100011215228 [1,0,0,0,0,0|1,0,2]=4 885 B10R1.10 CCSc1cccc(c1)C 62a_100011215228_100000210202 [1,0,0,0,0,0|1,0,2]=4 886 B10R1.10 CNCc1cc(ccn1)C 207a_100102657272_100011361488 [1,0,0,0,0,0|2,0,1]=4 887 B10R1.10 CNCc1cc(ccn1)C 2230a_106832991635_100000718516 [1,0,0,0,0,0|2,0,1]=4 888 B10R1.10 CNCc1cc(ccn1)C 270004a_106832991635_100011361488 [1,0,0,0,0,0|2,0,1]=4 889 B10R1.10 CNCc1cc(ccn1)C 34a_100102657272_100000718516 [1,0,0,0,0,0|2,0,1]=4 890 B10R1.10 CNCc1cc(ccn1)C 7a_106832991635_100000718516 [1,0,0,0,0,0|2,0,1]=4 891 B10R1.10 CNCc1cccc(c1)Br 207a_100102657272_100000210085 [1,0,0,0,0,0|2,0,1]=4 892 B10R1.10 CNCc1cccc(c1)Br 2230a_100000174977_200000210301 [1,0,0,0,0,0|2,0,1]=4 893 B10R1.10 CNCc1cccc(c1)Br 2230a_106832991635_100000698116 [1,0,0,0,0,0|2,0,1]=4 894 B10R1.10 CNCc1cccc(c1)Br 26a_100102657272_100000210342 [1,0,0,0,0,0|2,0,1]=4 895 B10R1.10 CNCc1cccc(c1)Br 270004a_106832991635_100000210085 [1,0,0,0,0,0|2,0,1]=4 896 B10R1.10 CNCc1cccc(c1)Br 34a_100000174977_200000210301 [1,0,0,0,0,0|2,0,1]=4 897 B10R1.10 CNCc1cccc(c1)Br 34a_100102657272_100000698116 [1,0,0,0,0,0|2,0,1]=4 898 B10R1.10 CNCc1cccc(c1)Br 7a_106832991635_100000211773 [1,0,0,0,0,0|2,0,1]=4 899 B10R1.10 CNCc1cccc(c1)C 207a_100102657272_100000211157 [1,0,0,0,0,0|1,0,1]=3 900 B10R1.10 CNCc1cccc(c1)C 2230a_100000185548_200000210301 [1,0,0,0,0,0|1,0,1]=3 901 B10R1.10 CNCc1cccc(c1)C 2230a_106832991635_100000211840 [1,0,0,0,0,0|1,0,1]=3 902 B10R1.10 CNCc1cccc(c1)C 270004a_106832991635_100000211157 [1,0,0,0,0,0|1,0,1]=3 903 B10R1.10 CNCc1cccc(c1)C 34a_100000185548_200000210301 [1,0,0,0,0,0|1,0,1]=3 904 B10R1.10 CNCc1cccc(c1)C 34a_100102657272_100000211840 [1,0,0,0,0,0|1,0,1]=3 905 B10R1.10 CNCc1cccc(c1)C 7a_106832991635_100000211840 [1,0,0,0,0,0|1,0,1]=3 906 B10R1.10 CNCc1cccc(c1)Cl 207a_100102657272_100000210801 [1,0,0,0,0,0|2,0,1]=4 907 B10R1.10 CNCc1cccc(c1)Cl 2230a_100000174878_200000210301 [1,0,0,0,0,0|2,0,1]=4 908 B10R1.10 CNCc1cccc(c1)Cl 2230a_106832991635_100000181238 [1,0,0,0,0,0|2,0,1]=4 909 B10R1.10 CNCc1cccc(c1)Cl 270004a_106832991635_100000210801 [1,0,0,0,0,0|2,0,1]=4 910 B10R1.10 CNCc1cccc(c1)Cl 34a_100000174878_200000210301 [1,0,0,0,0,0|2,0,1]=4 911 B10R1.10 CNCc1cccc(c1)Cl 34a_100102657272_100000187163 [1,0,0,0,0,0|2,0,1]=4 912 B10R1.10 CNCc1cccc(c1)Cl 7a_106832991635_100000187163 [1,0,0,0,0,0|2,0,1]=4 913 B10R1.10 CNCc1cccc(c1)F 207a_100102657272_100000210812 [1,0,0,0,0,0|2,0,1]=4 914 B10R1.10 CNCc1cccc(c1)F 2230a_100000174948_200000210301 [1,0,0,0,0,0|2,0,1]=4 915 B10R1.10 CNCc1cccc(c1)F 2230a_106832991635_100000230114 [1,0,0,0,0,0|2,0,1]=4 916 B10R1.10 CNCc1cccc(c1)F 270004a_106832991635_100000210812 [1,0,0,0,0,0|2,0,1]=4 917 B10R1.10 CNCc1cccc(c1)F 34a_100000174948_200000210301 [1,0,0,0,0,0|2,0,1]=4 918 B10R1.10 CNCc1cccc(c1)F 34a_100102657272_100000187166 [1,0,0,0,0,0|2,0,1]=4 919 B10R1.10 CNCc1cccc(c1)F 7a_106832991635_100000230114 [1,0,0,0,0,0|2,0,1]=4 920 B10R1.10 CNCc1cccc(c1)I 207a_100102657272_100000014684 [1,0,0,0,0,0|2,0,1]=4 921 B10R1.10 CNCc1cccc(c1)I 2230a_100000106179_200000210301 [1,0,0,0,0,0|2,0,1]=4 922 B10R1.10 CNCc1cccc(c1)I 2230a_106832991635_100011218688 [1,0,0,0,0,0|2,0,1]=4 923 B10R1.10 CNCc1cccc(c1)I 270004a_106832991635_100000014684 [1,0,0,0,0,0|2,0,1]=4 924 B10R1.10 CNCc1cccc(c1)I 34a_100000106179_200000210301 [1,0,0,0,0,0|2,0,1]=4 925 B10R1.10 CNCc1cccc(c1)I 34a_100102657272_100011218688 [1,0,0,0,0,0|2,0,1]=4 926 B10R1.10 CNCc1cccc(c1)I 7a_106832991635_100011218688 [1,0,0,0,0,0|2,0,1]=4 927 B10R1.10 CNCc1cccc(c1)O 207a_100102657272_100000188321 [1,0,0,0,0,0|2,0,1]=4 928 B10R1.10 CNCc1cccc(c1)O 2230a_100000743036_200000210301 [1,0,0,0,0,0|2,0,1]=4 929 B10R1.10 CNCc1cccc(c1)O 2230a_106832991635_100011660834 [1,0,0,0,0,0|2,0,1]=4 930 B10R1.10 CNCc1cccc(c1)O 270004a_106832991635_100000188321 [1,0,0,0,0,0|2,0,1]=4 931 B10R1.10 CNCc1cccc(c1)O 271570a_203496583355_100000187585 [1,0,0,0,0,0|2,0,1]=4 932 B10R1.10 CNCc1cccc(c1)O 34a_100000743036_200000210301 [1,0,0,0,0,0|2,0,1]=4 933 B10R1.10 CNCc1cccc(c1)O 34a_100102657272_100011660834 [1,0,0,0,0,0|2,0,1]=4 934 B10R1.10 CNCc1cccc(c1)O 7a_106832991635_100000084143 [1,0,0,0,0,0|2,0,1]=4 935 B10R1.10 CNCc1cccc(n1)C 207a_100102657272_100011215050 [1,0,0,0,0,0|2,0,1]=4 936 B10R1.10 CNCc1cccc(n1)C 2230a_106832991635_100000757606 [1,0,0,0,0,0|2,0,1]=4 937 B10R1.10 CNCc1cccc(n1)C 270004a_106832991635_100011215050 [1,0,0,0,0,0|2,0,1]=4 938 B10R1.10 CNCc1cccc(n1)C 34a_100000701342_200000210301 [1,0,0,0,0,0|2,0,1]=4 939 B10R1.10 CNCc1cccc(n1)C 34a_100102657272_100000757606 [1,0,0,0,0,0|2,0,1]=4 940 B10R1.10 CNCc1cccc(n1)C 7a_106832991635_100000757606 [1,0,0,0,0,0|2,0,1]=4 941 B10R1.10 CNCc1ccnc(c1)C 207a_100102657272_100011361630 [1,0,0,0,0,0|2,0,1]=4 942 B10R1.10 CNCc1ccnc(c1)C 2230a_106832991635_200020672517 [1,0,0,0,0,0|2,0,1]=4 943 B10R1.10 CNCc1ccnc(c1)C 270004a_106832991635_100011361630 [1,0,0,0,0,0|2,0,1]=4 944 B10R1.10 CNCc1ccnc(c1)C 34a_100011934566_200000210301 [1,0,0,0,0,0|2,0,1]=4 945 B10R1.10 CNCc1ccnc(c1)C 34a_100102657272_200020672517 [1,0,0,0,0,0|2,0,1]=4 946 B10R1.10 CNCc1ccnc(c1)C 7a_106832991635_200020672517 [1,0,0,0,0,0|2,0,1]=4 947 B10R1.10 CNCc1cncc(c1)C 207a_100102657272_100011998712 [1,0,0,0,0,0|2,0,1]=4 948 B10R1.10 CNCc1cncc(c1)C 2230a_100000692839_200000210301 [1,0,0,0,0,0|2,0,1]=4 949 B10R1.10 CNCc1cncc(c1)C 2230a_106832991635_100000716715 [1,0,0,0,0,0|2,0,1]=4 950 B10R1.10 CNCc1cncc(c1)C 270004a_106832991635_100011998712 [1,0,0,0,0,0|2,0,1]=4 951 B10R1.10 CNCc1cncc(c1)C 34a_100000692839_200000210301 [1,0,0,0,0,0|2,0,1]=4 952 B10R1.10 CNCc1cncc(c1)C 34a_100102657272_100000716715 [1,0,0,0,0,0|2,0,1]=4 953 B10R1.10 CNCc1cncc(c1)C 7a_106832991635_100000716715 [1,0,0,0,0,0|2,0,1]=4 954 B10R1.10 COCc1cc(ccn1)C 34a_100011998357_200000210301 [1,0,0,0,0,0|2,0,1]=4 955 B10R1.10 COCc1cc(ccn1)C 34a_100138415774_100000718516 [1,0,0,0,0,0|2,0,1]=4 956 B10R1.10 COCc1cccc(c1)Br 34a_100000687537_200000210301 [1,0,0,0,0,0|2,0,1]=4 957 B10R1.10 COCc1cccc(c1)Br 34a_100138415774_100000698116 [1,0,0,0,0,0|2,0,1]=4 958 B10R1.10 COCc1cccc(c1)Br 7a_100000687537_200000210301 [1,0,0,0,0,0|2,0,1]=4 959 B10R1.10 COCc1cccc(c1)C 34a_100011217746_200000210301 [1,0,0,0,0,0|1,0,1]=3 960 B10R1.10 COCc1cccc(c1)C 34a_100138415774_100000211840 [1,0,0,0,0,0|1,0,1]=3 961 B10R1.10 COCc1cccc(c1)C 7a_100011217746_200000210301 [1,0,0,0,0,0|1,0,1]=3 962 B10R1.10 COCc1cccc(c1)Cl 34a_100000241301_200000210301 [1,0,0,0,0,0|2,0,1]=4 963 B10R1.10 COCc1cccc(c1)Cl 34a_100138415774_100000187163 [1,0,0,0,0,0|2,0,1]=4 964 B10R1.10 COCc1cccc(c1)Cl 7a_100000241301_200000210301 [1,0,0,0,0,0|2,0,1]=4 965 B10R1.10 COCc1cccc(c1)F 34a_100000210976_200000210301 [1,0,0,0,0,0|2,0,1]=4 966 B10R1.10 COCc1cccc(c1)F 34a_100138415774_100000187166 [1,0,0,0,0,0|2,0,1]=4 967 B10R1.10 COCc1cccc(c1)F 7a_100000210976_200000210301 [1,0,0,0,0,0|2,0,1]=4 968 B10R1.10 COCc1cccc(c1)I 34a_100011215336_200000210301 [1,0,0,0,0,0|2,0,1]=4 969 B10R1.10 COCc1cccc(c1)I 34a_100138415774_100011218688 [1,0,0,0,0,0|2,0,1]=4 970 B10R1.10 COCc1cccc(c1)I 7a_100011215336_200000210301 [1,0,0,0,0,0|2,0,1]=4 971 B10R1.10 COCc1cccc(c1)N 34a_100000211919_200000210301 [1,0,0,0,0,0|2,0,1]=4 972 B10R1.10 COCc1cccc(c1)O 271570a_203496583355_100011493687 [1,0,0,0,0,0|2,0,1]=4 973 B10R1.10 COCc1cccc(c1)O 34a_100138415774_100011660834 [1,0,0,0,0,0|2,0,1]=4 974 B10R1.10 COCc1cccc(n1)C 34a_100000690600_200000210301 [1,0,0,0,0,0|2,0,1]=4 975 B10R1.10 COCc1cccc(n1)C 34a_100138415774_100000757606 [1,0,0,0,0,0|2,0,1]=4 976 B10R1.10 COCc1ccnc(c1)C 34a_100011998630_200000210301 [1,0,0,0,0,0|2,0,1]=4 977 B10R1.10 COCc1ccnc(c1)C 34a_100138415774_200020672517 [1,0,0,0,0,0|2,0,1]=4 978 B10R1.10 COCc1cncc(c1)C 34a_100011998709_200000210301 [1,0,0,0,0,0|2,0,1]=4 979 B10R1.10 COCc1cncc(c1)C 34a_100138415774_100000716715 [1,0,0,0,0,0|2,0,1]=4 980 B10R1.10 COCc1cncc(c1)C 7a_100011998709_200000210301 [1,0,0,0,0,0|2,0,1]=4 981 B10R1.10 CSCc1cc(ccn1)C 62a_100000718516_200000210301 [1,0,0,0,0,0|2,0,1]=4 982 B10R1.10 CSCc1cc(ccn1)C 62a_200000210301_100000718516 [1,0,0,0,0,0|2,0,1]=4 983 B10R1.10 CSCc1cccc(c1)Br 62a_100000211773_200000210301 [1,0,0,0,0,0|2,0,1]=4 984 B10R1.10 CSCc1cccc(c1)Br 62a_200000210301_100000211773 [1,0,0,0,0,0|2,0,1]=4 985 B10R1.10 CSCc1cccc(c1)C 62a_100000211840_200000210301 [1,0,0,0,0,0|1,0,1]=3 986 B10R1.10 CSCc1cccc(c1)C 62a_200000210301_100000211840 [1,0,0,0,0,0|1,0,1]=3 987 B10R1.10 CSCc1cccc(c1)Cl 62a_100000187163_200000210301 [1,0,0,0,0,0|2,0,1]=4 988 B10R1.10 CSCc1cccc(c1)Cl 62a_200000210301_100000187163 [1,0,0,0,0,0|2,0,1]=4 989 B10R1.10 CSCc1cccc(c1)F 62a_100000230114_200000210301 [1,0,0,0,0,0|2,0,1]=4 990 B10R1.10 CSCc1cccc(c1)F 62a_200000210301_100000230114 [1,0,0,0,0,0|2,0,1]=4 991 B10R1.10 CSCc1cccc(c1)I 62a_100011218688_200000210301 [1,0,0,0,0,0|2,0,1]=4 992 B10R1.10 CSCc1cccc(c1)I 62a_200000210301_100011218688 [1,0,0,0,0,0|2,0,1]=4 993 B10R1.10 CSCc1cccc(c1)O 62a_100011660834_200000210301 [1,0,0,0,0,0|2,0,1]=4 994 B10R1.10 CSCc1cccc(c1)O 62a_200000210301_100011660834 [1,0,0,0,0,0|2,0,1]=4 995 B10R1.10 CSCc1cccc(n1)C 62a_100000757606_200000210301 [1,0,0,0,0,0|2,0,1]=4 996 B10R1.10 CSCc1cccc(n1)C 62a_200000210301_100000757606 [1,0,0,0,0,0|2,0,1]=4 997 B10R1.10 CSCc1ccnc(c1)C 62a_200000210301_200020672517 [1,0,0,0,0,0|2,0,1]=4 998 B10R1.10 CSCc1ccnc(c1)C 62a_200020672517_200000210301 [1,0,0,0,0,0|2,0,1]=4 999 B10R1.10 CSCc1cncc(c1)C 62a_100000716715_200000210301 [1,0,0,0,0,0|2,0,1]=4 1000 B10R1.10 CSCc1cncc(c1)C 62a_200000210301_100000716715 [1,0,0,0,0,0|2,0,1]=4 1001 B10R1.10 Cc1cc(ccn1)CN[13CH3] 34a_100011934566_200025704644 [1,0,0,0,0,0|2,0,1]=4 1002 B10R1.10 Cc1cc(ccn1)CO[13CH3] 34a_100011998630_200025704644 [1,0,0,0,0,0|2,0,1]=4 1003 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200020672517_200025704644 [1,0,0,0,0,0|2,0,1]=4 1004 B10R1.10 Cc1cc(ccn1)CS[13CH3] 62a_200025704644_200020672517 [1,0,0,0,0,0|2,0,1]=4 1005 B10R1.10 Cc1cccc(c1)CN[13CH3] 2230a_100000185548_200025704644 [1,0,0,0,0,0|1,0,1]=3 1006 B10R1.10 Cc1cccc(c1)CN[13CH3] 34a_100000185548_200025704644 [1,0,0,0,0,0|1,0,1]=3 1007 B10R1.10 Cc1cccc(c1)CO[13CH3] 34a_100011217746_200025704644 [1,0,0,0,0,0|1,0,1]=3 1008 B10R1.10 Cc1cccc(c1)CO[13CH3] 7a_100011217746_200025704644 [1,0,0,0,0,0|1,0,1]=3 1009 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_100000211840_200025704644 [1,0,0,0,0,0|1,0,1]=3 1010 B10R1.10 Cc1cccc(c1)CS[13CH3] 62a_200025704644_100000211840 [1,0,0,0,0,0|1,0,1]=3 1011 B10R1.10 Cc1cccc(c1)NCF 34a_100000188690_100015361967 [1,0,0,0,0,0|2,0,1]=4 1012 B10R1.10 Cc1cccc(c1)OCF 34a_100000210337_100015361967 [1,0,0,0,0,0|2,0,1]=4 1013 B10R1.10 Cc1cccc(c1)OCF 7a_100000210337_100015361967 [1,0,0,0,0,0|2,0,1]=4 1014 B10R1.10 Cc1cccc(c1)SCF 62a_100011215228_100015361967 [1,0,0,0,0,0|2,0,1]=4 1015 B10R1.10 Cc1cccc(c1)SCF 62a_100015361967_100011215228 [1,0,0,0,0,0|2,0,1]=4 1016 B10R1.10 Cc1cccc(n1)CN[13CH3] 34a_100000701342_200025704644 [1,0,0,0,0,0|2,0,1]=4 1017 B10R1.10 Cc1cccc(n1)CO[13CH3] 34a_100000690600_200025704644 [1,0,0,0,0,0|2,0,1]=4 1018 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_100000757606_200025704644 [1,0,0,0,0,0|2,0,1]=4 1019 B10R1.10 Cc1cccc(n1)CS[13CH3] 62a_200025704644_100000757606 [1,0,0,0,0,0|2,0,1]=4 1020 B10R1.10 Cc1ccnc(c1)CO[13CH3] 34a_100011998357_200025704644 [1,0,0,0,0,0|2,0,1]=4 1021 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_100000718516_200025704644 [1,0,0,0,0,0|2,0,1]=4 1022 B10R1.10 Cc1ccnc(c1)CS[13CH3] 62a_200025704644_100000718516 [1,0,0,0,0,0|2,0,1]=4 1023 B10R1.10 Cc1cncc(c1)CN[13CH3] 2230a_100000692839_200025704644 [1,0,0,0,0,0|2,0,1]=4 1024 B10R1.10 Cc1cncc(c1)CN[13CH3] 34a_100000692839_200025704644 [1,0,0,0,0,0|2,0,1]=4 1025 B10R1.10 Cc1cncc(c1)CO[13CH3] 34a_100011998709_200025704644 [1,0,0,0,0,0|2,0,1]=4 1026 B10R1.10 Cc1cncc(c1)CO[13CH3] 7a_100011998709_200025704644 [1,0,0,0,0,0|2,0,1]=4 1027 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_100000716715_200025704644 [1,0,0,0,0,0|2,0,1]=4 1028 B10R1.10 Cc1cncc(c1)CS[13CH3] 62a_200025704644_100000716715 [1,0,0,0,0,0|2,0,1]=4 1029 B10R1.10 N#CCc1cccc(c1)O 271570a_203496583355_100000034040 [1,0,0,0,0,0|2,0,1]=4 1030 B10R1.10 NCCc1cccc(c1)O 271570a_203496583355_100011207229 [1,0,0,0,0,0|2,0,1]=4 1031 B10R1.10 NNCc1cccc(c1)O 271570a_203496583355_100000686200 [1,0,0,0,0,0|3,0,0]=4 1032 B10R1.10 O=CCc1cccc(c1)O 271570a_203496583355_200000698211 [1,0,0,0,0,0|2,0,0]=3 1033 B10R1.10 OCCc1cccc(c1)O 271570a_203496583355_100011217444 [1,0,0,0,0,0|2,0,1]=4 1034 B10R1.10 [13CH3]NCc1cccc(c1)Br 2230a_100000174977_200025704644 [1,0,0,0,0,0|2,0,1]=4 1035 B10R1.10 [13CH3]NCc1cccc(c1)Br 34a_100000174977_200025704644 [1,0,0,0,0,0|2,0,1]=4 1036 B10R1.10 [13CH3]NCc1cccc(c1)Cl 2230a_100000174878_200025704644 [1,0,0,0,0,0|2,0,1]=4 1037 B10R1.10 [13CH3]NCc1cccc(c1)Cl 34a_100000174878_200025704644 [1,0,0,0,0,0|2,0,1]=4 1038 B10R1.10 [13CH3]NCc1cccc(c1)F 2230a_100000174948_200025704644 [1,0,0,0,0,0|2,0,1]=4 1039 B10R1.10 [13CH3]NCc1cccc(c1)F 34a_100000174948_200025704644 [1,0,0,0,0,0|2,0,1]=4 1040 B10R1.10 [13CH3]NCc1cccc(c1)I 2230a_100000106179_200025704644 [1,0,0,0,0,0|2,0,1]=4 1041 B10R1.10 [13CH3]NCc1cccc(c1)I 34a_100000106179_200025704644 [1,0,0,0,0,0|2,0,1]=4 1042 B10R1.10 [13CH3]NCc1cccc(c1)O 2230a_100000743036_200025704644 [1,0,0,0,0,0|2,0,1]=4 1043 B10R1.10 [13CH3]NCc1cccc(c1)O 34a_100000743036_200025704644 [1,0,0,0,0,0|2,0,1]=4 1044 B10R1.10 [13CH3]OCc1cccc(c1)Br 34a_100000687537_200025704644 [1,0,0,0,0,0|2,0,1]=4 1045 B10R1.10 [13CH3]OCc1cccc(c1)Br 7a_100000687537_200025704644 [1,0,0,0,0,0|2,0,1]=4 1046 B10R1.10 [13CH3]OCc1cccc(c1)Cl 34a_100000241301_200025704644 [1,0,0,0,0,0|2,0,1]=4 1047 B10R1.10 [13CH3]OCc1cccc(c1)Cl 7a_100000241301_200025704644 [1,0,0,0,0,0|2,0,1]=4 1048 B10R1.10 [13CH3]OCc1cccc(c1)F 34a_100000210976_200025704644 [1,0,0,0,0,0|2,0,1]=4 1049 B10R1.10 [13CH3]OCc1cccc(c1)F 7a_100000210976_200025704644 [1,0,0,0,0,0|2,0,1]=4 1050 B10R1.10 [13CH3]OCc1cccc(c1)I 34a_100011215336_200025704644 [1,0,0,0,0,0|2,0,1]=4 1051 B10R1.10 [13CH3]OCc1cccc(c1)I 7a_100011215336_200025704644 [1,0,0,0,0,0|2,0,1]=4 1052 B10R1.10 [13CH3]OCc1cccc(c1)N 34a_100000211919_200025704644 [1,0,0,0,0,0|2,0,1]=4 1053 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_100000211773_200025704644 [1,0,0,0,0,0|2,0,1]=4 1054 B10R1.10 [13CH3]SCc1cccc(c1)Br 62a_200025704644_100000211773 [1,0,0,0,0,0|2,0,1]=4 1055 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_100000187163_200025704644 [1,0,0,0,0,0|2,0,1]=4 1056 B10R1.10 [13CH3]SCc1cccc(c1)Cl 62a_200025704644_100000187163 [1,0,0,0,0,0|2,0,1]=4 1057 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_100000230114_200025704644 [1,0,0,0,0,0|2,0,1]=4 1058 B10R1.10 [13CH3]SCc1cccc(c1)F 62a_200025704644_100000230114 [1,0,0,0,0,0|2,0,1]=4 1059 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_100011218688_200025704644 [1,0,0,0,0,0|2,0,1]=4 1060 B10R1.10 [13CH3]SCc1cccc(c1)I 62a_200025704644_100011218688 [1,0,0,0,0,0|2,0,1]=4 1061 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_100011660834_200025704644 [1,0,0,0,0,0|2,0,1]=4 1062 B10R1.10 [13CH3]SCc1cccc(c1)O 62a_200025704644_100011660834 [1,0,0,0,0,0|2,0,1]=4 1063 B12R1.24 CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210202 [0,1,0,0,0,0|0,0,3]=4 1064 B12R1.24 CNC(=O)c1cccc(c1O)C 240690a_100102657272_100000183896 [0,1,0,0,0,0|1,0,2]=4 1065 B12R1.24 CNC(=O)c1cccc(c1O)C 527a_100102657272_100000183896 [0,1,0,0,0,0|1,0,2]=4 1066 B12R1.24 CNC(C)c1cccc(c1C)C 2230a_106832991635_100012183177 [0,1,0,0,0,0|2,0,1]=4 1067 B12R1.24 CNC(C)c1cccc(c1C)C 269862a_106832991636_100000756305 [0,1,0,0,0,0|2,0,1]=4 1068 B12R1.24 CNC(C)c1cccc(c1C)C 34a_100102657272_100012183177 [0,1,0,0,0,0|2,0,1]=4 1069 B12R1.24 CNC(C)c1cccc(c1C)C 7a_106832991635_100012183177 [0,1,0,0,0,0|2,0,1]=4 1070 B12R1.24 CNC(C)c1cccc(c1F)C 269862a_106832991636_100012182731 [0,1,0,0,0,0|2,0,1]=4 1071 B12R1.24 CNC(C)c1cccc(c1O)Br 269862a_106832991636_100009815558 [0,1,0,0,0,0|2,0,1]=4 1072 B12R1.24 CNC(C)c1cccc(c1O)C 269862a_106832991636_100009847209 [0,1,0,0,0,0|1,0,1]=3 1073 B12R1.24 CNC(C)c1cccc(c1O)Cl 269862a_106832991636_100000043392 [0,1,0,0,0,0|2,0,1]=4 1074 B12R1.24 CNC(C)c1cccc(c1O)F 269862a_106832991636_100011246037 [0,1,0,0,0,0|2,0,1]=4 1075 B12R1.24 COC(=O)c1cccc(c1O)C 271570a_203496583355_100012002529 [0,1,0,0,0,0|1,0,2]=4 1076 B12R1.24 COC(C)c1cccc(c1C)C 34a_100138415774_100012183177 [0,1,0,0,0,0|2,0,1]=4 1077 B12R1.24 CSC(C)c1cccc(c1C)C 62a_100012183177_200000210301 [0,1,0,0,0,0|2,0,1]=4 1078 B12R1.24 CSC(C)c1cccc(c1C)C 62a_200000210301_100012183177 [0,1,0,0,0,0|2,0,1]=4 1079 B12R1.24 Cc1cccc(c1C)C(C)S[13CH3] 62a_100012183177_200025704644 [0,1,0,0,0,0|2,0,1]=4 1080 B12R1.24 Cc1cccc(c1C)C(C)S[13CH3] 62a_200025704644_100012183177 [0,1,0,0,0,0|2,0,1]=4 1081 B12R1.24 Cc1cccc(c1O)C(=O)CF 1458a_100000183896_100015361967 [0,1,0,0,0,0|1,0,2]=4 1082 B12R1.25 C#CCNc1cccc(c1Br)C 34a_100000684715_100000184674 [0,1,0,0,0,0|1,0,2]=4 1083 B12R1.25 C#CCNc1cccc(c1C)C 2230a_100000210026_100000038162 [0,1,0,0,0,0|1,0,2]=4 1084 B12R1.25 C#CCNc1cccc(c1C)C 34a_100000210026_100000184674 [0,1,0,0,0,0|1,0,2]=4 1085 B12R1.25 C#CCNc1cccc(c1C)C 7a_100000210026_100000038162 [0,1,0,0,0,0|1,0,2]=4 1086 B12R1.25 C#CCNc1cccc(c1Cl)C 34a_100000765562_100000184674 [0,1,0,0,0,0|1,0,2]=4 1087 B12R1.25 C#CCNc1cccc(c1Cl)C 7a_100000765562_100000038162 [0,1,0,0,0,0|1,0,2]=4 1088 B12R1.25 C#CCNc1cccc(c1F)C 2230a_100000697159_100000038162 [0,1,0,0,0,0|1,0,2]=4 1089 B12R1.25 C#CCNc1cccc(c1F)C 34a_100000697159_100000184674 [0,1,0,0,0,0|1,0,2]=4 1090 B12R1.25 C#CCNc1cccc(c1F)C 7a_100000697159_100000038162 [0,1,0,0,0,0|1,0,2]=4 1091 B12R1.25 C#CCNc1cccc(c1I)C 34a_100000761888_100000184674 [0,1,0,0,0,0|1,0,2]=4 1092 B12R1.25 C#CCNc1cccc(c1O)Br 34a_100011934915_100000184674 [0,1,0,0,0,0|1,0,2]=4 1093 B12R1.25 C#CCNc1cccc(c1O)C 34a_100000756359_100000184674 [0,1,0,0,0,0|0,0,2]=3 1094 B12R1.25 C#CCNc1cccc(c1O)Cl 34a_100000754742_100000184674 [0,1,0,0,0,0|1,0,2]=4 1095 B12R1.25 C#CCNc1cccc(c1O)F 34a_100011934987_100000184674 [0,1,0,0,0,0|1,0,2]=4 1096 B12R1.25 C#CCOc1cccc(c1Br)C 34a_100000686692_100000184674 [0,1,0,0,0,0|1,0,2]=4 1097 B12R1.25 C#CCOc1cccc(c1Br)C 7a_100000686692_100000038162 [0,1,0,0,0,0|1,0,2]=4 1098 B12R1.25 C#CCOc1cccc(c1C)C 34a_100000185855_100000184674 [0,1,0,0,0,0|1,0,2]=4 1099 B12R1.25 C#CCOc1cccc(c1C)C 7a_100000185855_100000038162 [0,1,0,0,0,0|1,0,2]=4 1100 B12R1.25 C#CCOc1cccc(c1Cl)C 34a_100000695629_100000184674 [0,1,0,0,0,0|1,0,2]=4 1101 B12R1.25 C#CCOc1cccc(c1Cl)C 7a_100000695629_100000038162 [0,1,0,0,0,0|1,0,2]=4 1102 B12R1.25 C#CCOc1cccc(c1F)C 34a_100000751311_100000184674 [0,1,0,0,0,0|1,0,2]=4 1103 B12R1.25 C#CCOc1cccc(c1F)C 7a_100000751311_100000038162 [0,1,0,0,0,0|1,0,2]=4 1104 B12R1.25 C#CCOc1cccc(c1I)C 34a_100010083724_100000184674 [0,1,0,0,0,0|1,0,2]=4 1105 B12R1.25 C#CCOc1cccc(c1I)C 7a_100010083724_100000038162 [0,1,0,0,0,0|1,0,2]=4 1106 B12R1.25 C#CCOc1cccc(c1N)C 34a_100000743429_100000184674 [0,1,0,0,0,0|1,0,2]=4 1107 B12R1.25 C#CCOc1cccc(c1N)C 7a_100000743429_100000038162 [0,1,0,0,0,0|1,0,2]=4 1108 B12R1.25 C#CCSc1cccc(c1Br)C 62a_100000038162_100012362457 [0,1,0,0,0,0|1,0,2]=4 1109 B12R1.25 C#CCSc1cccc(c1C)C 62a_100000038162_100011214922 [0,1,0,0,0,0|1,0,2]=4 1110 B12R1.25 C#CCSc1cccc(c1Cl)C 62a_100000038162_200012352035 [0,1,0,0,0,0|1,0,2]=4 1111 B12R1.25 C#CCSc1cccc(c1F)C 62a_100000038162_100000717567 [0,1,0,0,0,0|1,0,2]=4 1112 B12R1.25 C#CCSc1cccc(c1N)C 62a_100000038162_100011834072 [0,1,0,0,0,0|1,0,2]=4 1113 B12R1.25 C#CCSc1cccc(c1O)Br 62a_100000038162_100010084509 [0,1,0,0,0,0|1,0,2]=4 1114 B12R1.25 C#CCSc1cccc(c1O)C 62a_100000038162_100009817157 [0,1,0,0,0,0|0,0,2]=3 1115 B12R1.25 C#CCSc1cccc(c1O)Cl 62a_100000038162_100010202889 [0,1,0,0,0,0|1,0,2]=4 1116 B12R1.25 C#CCSc1cccc(c1O)F 62a_100000038162_100009813666 [0,1,0,0,0,0|1,0,2]=4 1117 B12R1.25 C#CCSc1cccc(c1O)N 62a_100000038162_100010084371 [0,1,0,0,0,0|1,0,2]=4 1118 B12R1.25 C#CCSc1cccc(c1O)O 62a_100000038162_100009815950 [0,1,0,0,0,0|1,0,2]=4 1119 B12R1.25 C#CCSc1nccc(c1O)C 62a_100000038162_100000696282 [0,1,0,0,0,0|1,0,2]=4 1120 B12R1.25 C=CCNc1cccc(c1Br)C 34a_100000684715_100015514636 [0,1,0,0,0,0|1,0,0]=2 1121 B12R1.25 C=CCNc1cccc(c1Br)Cl 34a_100000687072_100015514636 [0,1,0,0,0,0|2,0,0]=3 1122 B12R1.25 C=CCNc1cccc(c1Br)F 34a_100011934729_100015514636 [0,1,0,0,0,0|2,0,0]=3 1123 B12R1.25 C=CCNc1cccc(c1Br)O 34a_100012183704_100015514636 [0,1,0,0,0,0|2,0,0]=3 1124 B12R1.25 C=CCNc1cccc(c1Br)O 7a_100012183704_100015514636 [0,1,0,0,0,0|2,0,0]=3 1125 B12R1.25 C=CCNc1cccc(c1C)Br 34a_100000750434_100015514636 [0,1,0,0,0,0|2,0,0]=3 1126 B12R1.25 C=CCNc1cccc(c1C)C 2230a_100000210026_100000210623 [0,1,0,0,0,0|1,0,0]=2 1127 B12R1.25 C=CCNc1cccc(c1C)C 34a_100000210026_100015514636 [0,1,0,0,0,0|1,0,0]=2 1128 B12R1.25 C=CCNc1cccc(c1C)C 7a_100000210026_100015514636 [0,1,0,0,0,0|1,0,0]=2 1129 B12R1.25 C=CCNc1cccc(c1C)Cl 2230a_100000210441_100000210623 [0,1,0,0,0,0|2,0,0]=3 1130 B12R1.25 C=CCNc1cccc(c1C)Cl 34a_100000210441_100015514636 [0,1,0,0,0,0|2,0,0]=3 1131 B12R1.25 C=CCNc1cccc(c1C)Cl 7a_100000210441_100015514636 [0,1,0,0,0,0|2,0,0]=3 1132 B12R1.25 C=CCNc1cccc(c1C)F 34a_100000745574_100015514636 [0,1,0,0,0,0|2,0,0]=3 1133 B12R1.25 C=CCNc1cccc(c1C)F 7a_100000745574_100015514636 [0,1,0,0,0,0|2,0,0]=3 1134 B12R1.25 C=CCNc1cccc(c1C)I 34a_100000761887_100015514636 [0,1,0,0,0,0|2,0,0]=3 1135 B12R1.25 C=CCNc1cccc(c1C)O 34a_100011216573_100015514636 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.25 C=CCNc1cccc(c1C)O 7a_100011216573_100015514636 [0,1,0,0,0,0|2,0,0]=3 1137 B12R1.25 C=CCNc1cccc(c1Cl)Br 34a_100000687075_100015514636 [0,1,0,0,0,0|2,0,0]=3 1138 B12R1.25 C=CCNc1cccc(c1Cl)C 34a_100000765562_100015514636 [0,1,0,0,0,0|1,0,0]=2 1139 B12R1.25 C=CCNc1cccc(c1Cl)C 7a_100000765562_100015514636 [0,1,0,0,0,0|1,0,0]=2 1140 B12R1.25 C=CCNc1cccc(c1Cl)Cl 34a_100000185733_100015514636 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.25 C=CCNc1cccc(c1Cl)F 34a_100000692321_100015514636 [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.25 C=CCNc1cccc(c1Cl)O 34a_100012002038_100015514636 [0,1,0,0,0,0|2,0,0]=3 1143 B12R1.25 C=CCNc1cccc(c1Cl)O 7a_100012002038_100015514636 [0,1,0,0,0,0|2,0,0]=3 1144 B12R1.25 C=CCNc1cccc(c1F)Br 2230a_100011935091_100000210623 [0,1,0,0,0,0|2,0,0]=3 1145 B12R1.25 C=CCNc1cccc(c1F)Br 34a_100011935091_100015514636 [0,1,0,0,0,0|2,0,0]=3 1146 B12R1.25 C=CCNc1cccc(c1F)C 2230a_100000697159_100000210623 [0,1,0,0,0,0|1,0,0]=2 1147 B12R1.25 C=CCNc1cccc(c1F)C 34a_100000697159_100015514636 [0,1,0,0,0,0|1,0,0]=2 1148 B12R1.25 C=CCNc1cccc(c1F)C 7a_100000697159_100015514636 [0,1,0,0,0,0|1,0,0]=2 1149 B12R1.25 C=CCNc1cccc(c1F)Cl 2230a_100000199060_100000210623 [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.25 C=CCNc1cccc(c1F)Cl 34a_100000199060_100015514636 [0,1,0,0,0,0|2,0,0]=3 1151 B12R1.25 C=CCNc1cccc(c1F)F 34a_100000743855_100015514636 [0,1,0,0,0,0|2,0,0]=3 1152 B12R1.25 C=CCNc1cccc(c1I)Br 34a_100020590159_100015514636 [0,1,0,0,0,0|2,0,0]=3 1153 B12R1.25 C=CCNc1cccc(c1I)C 34a_100000761888_100015514636 [0,1,0,0,0,0|1,0,0]=2 1154 B12R1.25 C=CCNc1cccc(c1I)Cl 34a_100000049713_100015514636 [0,1,0,0,0,0|2,0,0]=3 1155 B12R1.25 C=CCNc1cccc(c1I)F 34a_100000690935_100015514636 [0,1,0,0,0,0|2,0,0]=3 1156 B12R1.25 C=CCNc1cccc(c1O)Br 34a_100011934915_100015514636 [0,1,0,0,0,0|1,0,0]=2 1157 B12R1.25 C=CCNc1cccc(c1O)C 34a_100000756359_100015514636 [0,1,0,0,0,0|0,0,0]=1 1158 B12R1.25 C=CCNc1cccc(c1O)Cl 34a_100000754742_100015514636 [0,1,0,0,0,0|1,0,0]=2 1159 B12R1.25 C=CCNc1cccc(c1O)F 34a_100011934987_100015514636 [0,1,0,0,0,0|1,0,0]=2 1160 B12R1.25 C=CCNc1ccnc(c1Br)F 27a_100020586998_100010006599 [0,1,0,0,0,0|3,0,0]=4 1161 B12R1.25 C=CCNc1ccnc(c1C)F 27a_100020586998_100010006593 [0,1,0,0,0,0|3,0,0]=4 1162 B12R1.25 C=CCNc1ccnc(c1Cl)C 27a_100020586998_100000698670 [0,1,0,0,0,0|2,0,0]=3 1163 B12R1.25 C=CCNc1ccnc(c1Cl)F 27a_100020586998_100010067886 [0,1,0,0,0,0|3,0,0]=4 1164 B12R1.25 C=CCNc1ccnc(c1F)C 27a_100020586998_100009849794 [0,1,0,0,0,0|2,0,0]=3 1165 B12R1.25 C=CCNc1ccnc(c1F)F 27a_100020586998_100010214882 [0,1,0,0,0,0|3,0,0]=4 1166 B12R1.25 C=CCNc1nccc(c1C)F 27a_100020586998_100009846374 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.25 C=CCNc1ncnc(c1C)C 27a_100020586998_100011438038 [0,1,0,0,0,0|3,0,0]=4 1168 B12R1.25 C=CCNc1ncnc(c1F)C 27a_100020586998_100011671633 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.25 C=CCOc1cccc(c1Br)Br 34a_100010187966_100015514636 [0,1,0,0,0,0|2,0,0]=3 1170 B12R1.25 C=CCOc1cccc(c1Br)Br 7a_100010187966_100015514636 [0,1,0,0,0,0|2,0,0]=3 1171 B12R1.25 C=CCOc1cccc(c1Br)C 34a_100000686692_100015514636 [0,1,0,0,0,0|1,0,0]=2 1172 B12R1.25 C=CCOc1cccc(c1Br)C 7a_100000686692_100015514636 [0,1,0,0,0,0|1,0,0]=2 1173 B12R1.25 C=CCOc1cccc(c1Br)Cl 34a_100012348804_100015514636 [0,1,0,0,0,0|2,0,0]=3 1174 B12R1.25 C=CCOc1cccc(c1Br)Cl 7a_100012348804_100015514636 [0,1,0,0,0,0|2,0,0]=3 1175 B12R1.25 C=CCOc1cccc(c1Br)F 34a_100009820682_100015514636 [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.25 C=CCOc1cccc(c1Br)F 7a_100009820682_100015514636 [0,1,0,0,0,0|2,0,0]=3 1177 B12R1.25 C=CCOc1cccc(c1Br)I 34a_100010187914_100015514636 [0,1,0,0,0,0|2,0,0]=3 1178 B12R1.25 C=CCOc1cccc(c1Br)I 7a_100010187914_100015514636 [0,1,0,0,0,0|2,0,0]=3 1179 B12R1.25 C=CCOc1cccc(c1Br)N 34a_100012183704_100015514636 [0,1,0,0,0,0|2,0,0]=3 1180 B12R1.25 C=CCOc1cccc(c1Br)N 7a_100012183704_100015514636 [0,1,0,0,0,0|2,0,0]=3 1181 B12R1.25 C=CCOc1cccc(c1C)Br 34a_100012002258_100015514636 [0,1,0,0,0,0|2,0,0]=3 1182 B12R1.25 C=CCOc1cccc(c1C)Br 7a_100012002258_100015514636 [0,1,0,0,0,0|2,0,0]=3 1183 B12R1.25 C=CCOc1cccc(c1C)C 34a_100000185855_100015514636 [0,1,0,0,0,0|1,0,0]=2 1184 B12R1.25 C=CCOc1cccc(c1C)C 7a_100000185855_100015514636 [0,1,0,0,0,0|1,0,0]=2 1185 B12R1.25 C=CCOc1cccc(c1C)Cl 34a_100011265684_100015514636 [0,1,0,0,0,0|2,0,0]=3 1186 B12R1.25 C=CCOc1cccc(c1C)Cl 7a_100011265684_100015514636 [0,1,0,0,0,0|2,0,0]=3 1187 B12R1.25 C=CCOc1cccc(c1C)F 34a_100011217231_100015514636 [0,1,0,0,0,0|2,0,0]=3 1188 B12R1.25 C=CCOc1cccc(c1C)F 7a_100011217231_100015514636 [0,1,0,0,0,0|2,0,0]=3 1189 B12R1.25 C=CCOc1cccc(c1C)N 34a_100011216573_100015514636 [0,1,0,0,0,0|2,0,0]=3 1190 B12R1.25 C=CCOc1cccc(c1C)N 7a_100011216573_100015514636 [0,1,0,0,0,0|2,0,0]=3 1191 B12R1.25 C=CCOc1cccc(c1Cl)Br 34a_100010187913_100015514636 [0,1,0,0,0,0|2,0,0]=3 1192 B12R1.25 C=CCOc1cccc(c1Cl)Br 7a_100010187913_100015514636 [0,1,0,0,0,0|2,0,0]=3 1193 B12R1.25 C=CCOc1cccc(c1Cl)C 34a_100000695629_100015514636 [0,1,0,0,0,0|1,0,0]=2 1194 B12R1.25 C=CCOc1cccc(c1Cl)C 7a_100000695629_100015514636 [0,1,0,0,0,0|1,0,0]=2 1195 B12R1.25 C=CCOc1cccc(c1Cl)Cl 34a_100000211076_100015514636 [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.25 C=CCOc1cccc(c1Cl)Cl 7a_100000211076_100015514636 [0,1,0,0,0,0|2,0,0]=3 1197 B12R1.25 C=CCOc1cccc(c1Cl)F 34a_100000087408_100015514636 [0,1,0,0,0,0|2,0,0]=3 1198 B12R1.25 C=CCOc1cccc(c1Cl)F 7a_100000087408_100015514636 [0,1,0,0,0,0|2,0,0]=3 1199 B12R1.25 C=CCOc1cccc(c1Cl)I 34a_100000049636_100015514636 [0,1,0,0,0,0|2,0,0]=3 1200 B12R1.25 C=CCOc1cccc(c1Cl)I 7a_100000049636_100015514636 [0,1,0,0,0,0|2,0,0]=3 1201 B12R1.25 C=CCOc1cccc(c1Cl)N 34a_100012002038_100015514636 [0,1,0,0,0,0|2,0,0]=3 1202 B12R1.25 C=CCOc1cccc(c1Cl)N 7a_100012002038_100015514636 [0,1,0,0,0,0|2,0,0]=3 1203 B12R1.25 C=CCOc1cccc(c1F)Br 34a_100009817021_100015514636 [0,1,0,0,0,0|2,0,0]=3 1204 B12R1.25 C=CCOc1cccc(c1F)Br 7a_100009817021_100015514636 [0,1,0,0,0,0|2,0,0]=3 1205 B12R1.25 C=CCOc1cccc(c1F)C 34a_100000751311_100015514636 [0,1,0,0,0,0|1,0,0]=2 1206 B12R1.25 C=CCOc1cccc(c1F)C 7a_100000751311_100015514636 [0,1,0,0,0,0|1,0,0]=2 1207 B12R1.25 C=CCOc1cccc(c1F)Cl 34a_100000687438_100015514636 [0,1,0,0,0,0|2,0,0]=3 1208 B12R1.25 C=CCOc1cccc(c1F)Cl 7a_100000687438_100015514636 [0,1,0,0,0,0|2,0,0]=3 1209 B12R1.25 C=CCOc1cccc(c1F)F 34a_100000751161_100015514636 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.25 C=CCOc1cccc(c1F)F 7a_100000751161_100015514636 [0,1,0,0,0,0|2,0,0]=3 1211 B12R1.25 C=CCOc1cccc(c1I)Br 34a_100010187912_100015514636 [0,1,0,0,0,0|2,0,0]=3 1212 B12R1.25 C=CCOc1cccc(c1I)Br 7a_100010187912_100015514636 [0,1,0,0,0,0|2,0,0]=3 1213 B12R1.25 C=CCOc1cccc(c1I)C 34a_100010083724_100015514636 [0,1,0,0,0,0|1,0,0]=2 1214 B12R1.25 C=CCOc1cccc(c1I)C 7a_100010083724_100015514636 [0,1,0,0,0,0|1,0,0]=2 1215 B12R1.25 C=CCOc1cccc(c1I)Cl 34a_100000050174_100015514636 [0,1,0,0,0,0|2,0,0]=3 1216 B12R1.25 C=CCOc1cccc(c1I)Cl 7a_100000050174_100015514636 [0,1,0,0,0,0|2,0,0]=3 1217 B12R1.25 C=CCOc1cccc(c1I)F 34a_100000690913_100015514636 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.25 C=CCOc1cccc(c1I)F 7a_100000690913_100015514636 [0,1,0,0,0,0|2,0,0]=3 1219 B12R1.25 C=CCOc1cccc(c1N)Br 34a_100011934926_100015514636 [0,1,0,0,0,0|2,0,0]=3 1220 B12R1.25 C=CCOc1cccc(c1N)Br 7a_100011934926_100015514636 [0,1,0,0,0,0|2,0,0]=3 1221 B12R1.25 C=CCOc1cccc(c1N)C 34a_100000743429_100015514636 [0,1,0,0,0,0|1,0,0]=2 1222 B12R1.25 C=CCOc1cccc(c1N)C 7a_100000743429_100015514636 [0,1,0,0,0,0|1,0,0]=2 1223 B12R1.25 C=CCOc1cccc(c1N)Cl 34a_100012022510_100015514636 [0,1,0,0,0,0|2,0,0]=3 1224 B12R1.25 C=CCOc1cccc(c1N)Cl 7a_100012022510_100015514636 [0,1,0,0,0,0|2,0,0]=3 1225 B12R1.25 C=CCOc1cccc(c1N)F 34a_100020591140_100015514636 [0,1,0,0,0,0|2,0,0]=3 1226 B12R1.25 C=CCOc1cccc(c1N)F 7a_100020591140_100015514636 [0,1,0,0,0,0|2,0,0]=3 1227 B12R1.25 C=CCOc1cccc(c1N)I 34a_200000049512_100015514636 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.25 C=CCOc1cccc(c1N)I 7a_200000049512_100015514636 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.25 C=CCOc1cccc(c1N)N 34a_100000033209_100015514636 [0,1,0,0,0,0|2,0,0]=3 1230 B12R1.25 C=CCOc1cccn(c1=O)C 34a_100000117616_100015514636 [0,1,0,0,0,0|1,0,1]=3 1231 B12R1.25 C=CCOc1cccn(c1=O)C 7a_100000117616_100015514636 [0,1,0,0,0,0|1,0,1]=3 1232 B12R1.25 C=CCOc1ccnc(c1Br)Cl 34a_100010136240_100015514636 [0,1,0,0,0,0|3,0,0]=4 1233 B12R1.25 C=CCOc1ccnc(c1Cl)Cl 34a_100009860235_100015514636 [0,1,0,0,0,0|3,0,0]=4 1234 B12R1.25 C=CCOc1ccnc(c1F)Br 34a_100009876375_100015514636 [0,1,0,0,0,0|3,0,0]=4 1235 B12R1.25 C=CCOc1ccnc(c1F)Cl 34a_100009856406_100015514636 [0,1,0,0,0,0|3,0,0]=4 1236 B12R1.25 C=CCOc1ccnc(c1N)Cl 34a_100000128729_100015514636 [0,1,0,0,0,0|3,0,0]=4 1237 B12R1.25 C=CCOc1nccc(c1Br)C 34a_100012000493_100015514636 [0,1,0,0,0,0|2,0,0]=3 1238 B12R1.25 C=CCOc1nccc(c1C)Br 34a_100009858498_100015514636 [0,1,0,0,0,0|3,0,0]=4 1239 B12R1.25 C=CCOc1nccc(c1Cl)N 34a_200000093555_100015514636 [0,1,0,0,0,0|3,0,0]=4 1240 B12R1.25 C=CCOc1ncnc(c1C)C 34a_100000697798_100015514636 [0,1,0,0,0,0|3,0,0]=4 1241 B12R1.25 C=CCSc1cccc(=O)n1C 62a_100000210623_100000726605 [0,1,0,0,0,0|3,0,0]=4 1242 B12R1.25 C=CCSc1cccc(=O)n1C 62a_100000726605_100000210623 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.25 C=CCSc1cccc(c1Br)Br 62a_100000210623_100010175083 [0,1,0,0,0,0|2,0,0]=3 1244 B12R1.25 C=CCSc1cccc(c1Br)Br 62a_100010175083_100000210623 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.25 C=CCSc1cccc(c1Br)C 62a_100000210623_100012362457 [0,1,0,0,0,0|1,0,0]=2 1246 B12R1.25 C=CCSc1cccc(c1Br)C 62a_100012362457_100000210623 [0,1,0,0,0,0|1,0,0]=2 1247 B12R1.25 C=CCSc1cccc(c1Br)Cl 62a_100000210623_100014021842 [0,1,0,0,0,0|2,0,0]=3 1248 B12R1.25 C=CCSc1cccc(c1Br)Cl 62a_100014021842_100000210623 [0,1,0,0,0,0|2,0,0]=3 1249 B12R1.25 C=CCSc1cccc(c1Br)F 62a_100000210623_100010202630 [0,1,0,0,0,0|2,0,0]=3 1250 B12R1.25 C=CCSc1cccc(c1Br)F 62a_100010202630_100000210623 [0,1,0,0,0,0|2,0,0]=3 1251 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100000210623_100010187914 [0,1,0,0,0,0|2,0,0]=3 1252 B12R1.25 C=CCSc1cccc(c1Br)O 62a_100010187914_100000210623 [0,1,0,0,0,0|2,0,0]=3 1253 B12R1.25 C=CCSc1cccc(c1C)Br 62a_100000210623_100012353703 [0,1,0,0,0,0|2,0,0]=3 1254 B12R1.25 C=CCSc1cccc(c1C)Br 62a_100012353703_100000210623 [0,1,0,0,0,0|2,0,0]=3 1255 B12R1.25 C=CCSc1cccc(c1C)C 62a_100000210623_100011214922 [0,1,0,0,0,0|1,0,0]=2 1256 B12R1.25 C=CCSc1cccc(c1C)C 62a_100011214922_100000210623 [0,1,0,0,0,0|1,0,0]=2 1257 B12R1.25 C=CCSc1cccc(c1C)Cl 62a_100000210623_100000726075 [0,1,0,0,0,0|2,0,0]=3 1258 B12R1.25 C=CCSc1cccc(c1C)Cl 62a_100000726075_100000210623 [0,1,0,0,0,0|2,0,0]=3 1259 B12R1.25 C=CCSc1cccc(c1C)F 62a_100000210623_100011216893 [0,1,0,0,0,0|2,0,0]=3 1260 B12R1.25 C=CCSc1cccc(c1C)F 62a_100011216893_100000210623 [0,1,0,0,0,0|2,0,0]=3 1261 B12R1.25 C=CCSc1cccc(c1C)N 62a_100000210623_100000761887 [0,1,0,0,0,0|2,0,0]=3 1262 B12R1.25 C=CCSc1cccc(c1C)N 62a_100000761887_100000210623 [0,1,0,0,0,0|2,0,0]=3 1263 B12R1.25 C=CCSc1cccc(c1C)O 62a_100000210623_100012002258 [0,1,0,0,0,0|2,0,0]=3 1264 B12R1.25 C=CCSc1cccc(c1C)O 62a_100012002258_100000210623 [0,1,0,0,0,0|2,0,0]=3 1265 B12R1.25 C=CCSc1cccc(c1Cl)Br 62a_100000210623_100010142854 [0,1,0,0,0,0|2,0,0]=3 1266 B12R1.25 C=CCSc1cccc(c1Cl)Br 62a_100010142854_100000210623 [0,1,0,0,0,0|2,0,0]=3 1267 B12R1.25 C=CCSc1cccc(c1Cl)C 62a_100000210623_200012352035 [0,1,0,0,0,0|1,0,0]=2 1268 B12R1.25 C=CCSc1cccc(c1Cl)C 62a_200012352035_100000210623 [0,1,0,0,0,0|1,0,0]=2 1269 B12R1.25 C=CCSc1cccc(c1Cl)Cl 62a_100000210623_100011215384 [0,1,0,0,0,0|2,0,0]=3 1270 B12R1.25 C=CCSc1cccc(c1Cl)Cl 62a_100011215384_100000210623 [0,1,0,0,0,0|2,0,0]=3 1271 B12R1.25 C=CCSc1cccc(c1Cl)F 62a_100000210623_200010234923 [0,1,0,0,0,0|2,0,0]=3 1272 B12R1.25 C=CCSc1cccc(c1Cl)F 62a_200010234923_100000210623 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.25 C=CCSc1cccc(c1Cl)O 62a_100000210623_100000049636 [0,1,0,0,0,0|2,0,0]=3 1274 B12R1.25 C=CCSc1cccc(c1F)Br 62a_100000210623_100000702267 [0,1,0,0,0,0|2,0,0]=3 1275 B12R1.25 C=CCSc1cccc(c1F)Br 62a_100000702267_100000210623 [0,1,0,0,0,0|2,0,0]=3 1276 B12R1.25 C=CCSc1cccc(c1F)C 62a_100000210623_100000717567 [0,1,0,0,0,0|1,0,0]=2 1277 B12R1.25 C=CCSc1cccc(c1F)C 62a_100000717567_100000210623 [0,1,0,0,0,0|1,0,0]=2 1278 B12R1.25 C=CCSc1cccc(c1F)Cl 62a_100000210623_100011217346 [0,1,0,0,0,0|2,0,0]=3 1279 B12R1.25 C=CCSc1cccc(c1F)Cl 62a_100011217346_100000210623 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.25 C=CCSc1cccc(c1F)F 62a_100000210623_100000694657 [0,1,0,0,0,0|2,0,0]=3 1281 B12R1.25 C=CCSc1cccc(c1F)F 62a_100000694657_100000210623 [0,1,0,0,0,0|2,0,0]=3 1282 B12R1.25 C=CCSc1cccc(c1F)N 62a_100000210623_100011935091 [0,1,0,0,0,0|2,0,0]=3 1283 B12R1.25 C=CCSc1cccc(c1F)N 62a_100011935091_100000210623 [0,1,0,0,0,0|2,0,0]=3 1284 B12R1.25 C=CCSc1cccc(c1F)O 62a_100000210623_100009817021 [0,1,0,0,0,0|2,0,0]=3 1285 B12R1.25 C=CCSc1cccc(c1F)O 62a_100009817021_100000210623 [0,1,0,0,0,0|2,0,0]=3 1286 B12R1.25 C=CCSc1cccc(c1N)Br 62a_100000210623_100010146558 [0,1,0,0,0,0|2,0,0]=3 1287 B12R1.25 C=CCSc1cccc(c1N)Br 62a_100010146558_100000210623 [0,1,0,0,0,0|2,0,0]=3 1288 B12R1.25 C=CCSc1cccc(c1N)C 62a_100000210623_100011834072 [0,1,0,0,0,0|1,0,0]=2 1289 B12R1.25 C=CCSc1cccc(c1N)C 62a_100011834072_100000210623 [0,1,0,0,0,0|1,0,0]=2 1290 B12R1.25 C=CCSc1cccc(c1N)Cl 62a_100000210623_100010190421 [0,1,0,0,0,0|2,0,0]=3 1291 B12R1.25 C=CCSc1cccc(c1N)Cl 62a_100010190421_100000210623 [0,1,0,0,0,0|2,0,0]=3 1292 B12R1.25 C=CCSc1cccc(c1N)F 62a_100000042321_100000210623 [0,1,0,0,0,0|2,0,0]=3 1293 B12R1.25 C=CCSc1cccc(c1N)F 62a_100000210623_100000042321 [0,1,0,0,0,0|2,0,0]=3 1294 B12R1.25 C=CCSc1cccc(c1N)N 62a_100015191791_100000210623 [0,1,0,0,0,0|2,0,0]=3 1295 B12R1.25 C=CCSc1cccc(c1N)O 62a_100000210623_100011934926 [0,1,0,0,0,0|2,0,0]=3 1296 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100000210623_100010084509 [0,1,0,0,0,0|1,0,0]=2 1297 B12R1.25 C=CCSc1cccc(c1O)Br 62a_100010084509_100000210623 [0,1,0,0,0,0|1,0,0]=2 1298 B12R1.25 C=CCSc1cccc(c1O)C 62a_100000210623_100009817157 [0,1,0,0,0,0|0,0,0]=1 1299 B12R1.25 C=CCSc1cccc(c1O)C 62a_100009817157_100000210623 [0,1,0,0,0,0|0,0,0]=1 1300 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100000210623_100010202889 [0,1,0,0,0,0|1,0,0]=2 1301 B12R1.25 C=CCSc1cccc(c1O)Cl 62a_100010202889_100000210623 [0,1,0,0,0,0|1,0,0]=2 1302 B12R1.25 C=CCSc1cccc(c1O)F 62a_100000210623_100009813666 [0,1,0,0,0,0|1,0,0]=2 1303 B12R1.25 C=CCSc1cccc(c1O)F 62a_100009813666_100000210623 [0,1,0,0,0,0|1,0,0]=2 1304 B12R1.25 C=CCSc1cccc(c1O)N 62a_100000210623_100010084371 [0,1,0,0,0,0|1,0,0]=2 1305 B12R1.25 C=CCSc1cccc(c1O)N 62a_100011934915_100000210623 [0,1,0,0,0,0|1,0,0]=2 1306 B12R1.25 C=CCSc1cccc(c1O)O 62a_100000210623_100009815950 [0,1,0,0,0,0|1,0,0]=2 1307 B12R1.25 C=CCSc1cccn(c1=O)C 62a_100000210623_100000687173 [0,1,0,0,0,0|1,0,1]=3 1308 B12R1.25 C=CCSc1cccn(c1=O)C 62a_100000687173_100000210623 [0,1,0,0,0,0|1,0,1]=3 1309 B12R1.25 C=CCSc1ccnc(c1Br)F 62a_100000210623_100010006599 [0,1,0,0,0,0|3,0,0]=4 1310 B12R1.25 C=CCSc1ccnc(c1Br)F 62a_100010006599_100000210623 [0,1,0,0,0,0|3,0,0]=4 1311 B12R1.25 C=CCSc1ccnc(c1C)C 62a_100000210623_100009846815 [0,1,0,0,0,0|2,0,0]=3 1312 B12R1.25 C=CCSc1ccnc(c1C)C 62a_100009846815_100000210623 [0,1,0,0,0,0|2,0,0]=3 1313 B12R1.25 C=CCSc1ccnc(c1C)Cl 62a_100000047055_100000210623 [0,1,0,0,0,0|3,0,0]=4 1314 B12R1.25 C=CCSc1ccnc(c1C)Cl 62a_100000210623_100000047055 [0,1,0,0,0,0|3,0,0]=4 1315 B12R1.25 C=CCSc1ccnc(c1C)F 62a_100000210623_100010006593 [0,1,0,0,0,0|3,0,0]=4 1316 B12R1.25 C=CCSc1ccnc(c1C)F 62a_100010006593_100000210623 [0,1,0,0,0,0|3,0,0]=4 1317 B12R1.25 C=CCSc1ccnc(c1C)N 62a_100000210623_100009865460 [0,1,0,0,0,0|3,0,0]=4 1318 B12R1.25 C=CCSc1ccnc(c1C)N 62a_100009865460_100000210623 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.25 C=CCSc1ccnc(c1C)O 62a_100000210623_100009858498 [0,1,0,0,0,0|3,0,0]=4 1320 B12R1.25 C=CCSc1ccnc(c1C)O 62a_100009858498_100000210623 [0,1,0,0,0,0|3,0,0]=4 1321 B12R1.25 C=CCSc1ccnc(c1Cl)C 62a_100000210623_100000698670 [0,1,0,0,0,0|2,0,0]=3 1322 B12R1.25 C=CCSc1ccnc(c1Cl)C 62a_100000698670_100000210623 [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.25 C=CCSc1ccnc(c1Cl)Cl 62a_100000210623_100010246212 [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.25 C=CCSc1ccnc(c1Cl)Cl 62a_100010246212_100000210623 [0,1,0,0,0,0|3,0,0]=4 1325 B12R1.25 C=CCSc1ccnc(c1Cl)F 62a_100000210623_100010067886 [0,1,0,0,0,0|3,0,0]=4 1326 B12R1.25 C=CCSc1ccnc(c1Cl)F 62a_100010067886_100000210623 [0,1,0,0,0,0|3,0,0]=4 1327 B12R1.25 C=CCSc1ccnc(c1Cl)N 62a_100000210623_100010735111 [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.25 C=CCSc1ccnc(c1Cl)N 62a_100010735111_100000210623 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.25 C=CCSc1ccnc(c1F)Br 62a_100000210623_200015269031 [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.25 C=CCSc1ccnc(c1F)Br 62a_200015269031_100000210623 [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.25 C=CCSc1ccnc(c1F)C 62a_100000210623_100009849794 [0,1,0,0,0,0|2,0,0]=3 1332 B12R1.25 C=CCSc1ccnc(c1F)C 62a_100009849794_100000210623 [0,1,0,0,0,0|2,0,0]=3 1333 B12R1.25 C=CCSc1ccnc(c1F)Cl 62a_100000210623_100010150473 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.25 C=CCSc1ccnc(c1F)Cl 62a_100010150473_100000210623 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.25 C=CCSc1ccnc(c1F)F 62a_100000210623_100010214882 [0,1,0,0,0,0|3,0,0]=4 1336 B12R1.25 C=CCSc1ccnc(c1F)F 62a_100010214882_100000210623 [0,1,0,0,0,0|3,0,0]=4 1337 B12R1.25 C=CCSc1ccnc(c1F)N 62a_100000210623_100010077785 [0,1,0,0,0,0|3,0,0]=4 1338 B12R1.25 C=CCSc1ccnc(c1F)N 62a_100010077785_100000210623 [0,1,0,0,0,0|3,0,0]=4 1339 B12R1.25 C=CCSc1ccnc(c1N)C 62a_100000210623_100009885578 [0,1,0,0,0,0|2,0,0]=3 1340 B12R1.25 C=CCSc1ccnc(c1N)C 62a_100009885578_100000210623 [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.25 C=CCSc1ccnc(c1N)N 62a_100000124095_100000210623 [0,1,0,0,0,0|3,0,0]=4 1342 B12R1.25 C=CCSc1ccnc(c1O)Cl 62a_100000210623_100010067911 [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.25 C=CCSc1cncc(c1C)Br 62a_100000210623_100010109657 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.25 C=CCSc1cncc(c1C)Br 62a_100010109657_100000210623 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.25 C=CCSc1cncc(c1C)C 62a_100000210623_100009864703 [0,1,0,0,0,0|2,0,0]=3 1346 B12R1.25 C=CCSc1cncc(c1C)C 62a_100009864703_100000210623 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.25 C=CCSc1cncc(c1C)F 62a_100000210623_100009881546 [0,1,0,0,0,0|3,0,0]=4 1348 B12R1.25 C=CCSc1cncc(c1C)F 62a_100009881546_100000210623 [0,1,0,0,0,0|3,0,0]=4 1349 B12R1.25 C=CCSc1cncc(c1C)N 62a_100000210623_100011998293 [0,1,0,0,0,0|3,0,0]=4 1350 B12R1.25 C=CCSc1cncc(c1C)N 62a_100011998293_100000210623 [0,1,0,0,0,0|3,0,0]=4 1351 B12R1.25 C=CCSc1cncc(c1N)Br 62a_100000210623_100011290786 [0,1,0,0,0,0|3,0,0]=4 1352 B12R1.25 C=CCSc1cncc(c1N)Br 62a_100011290786_100000210623 [0,1,0,0,0,0|3,0,0]=4 1353 B12R1.25 C=CCSc1cncc(c1N)C 62a_100000210623_100009818025 [0,1,0,0,0,0|2,0,0]=3 1354 B12R1.25 C=CCSc1cncc(c1N)C 62a_100009818025_100000210623 [0,1,0,0,0,0|2,0,0]=3 1355 B12R1.25 C=CCSc1cncc(c1N)Cl 62a_100000210623_100000684942 [0,1,0,0,0,0|3,0,0]=4 1356 B12R1.25 C=CCSc1cncc(c1N)Cl 62a_100000684942_100000210623 [0,1,0,0,0,0|3,0,0]=4 1357 B12R1.25 C=CCSc1cncc(c1N)F 62a_100000210623_100009880649 [0,1,0,0,0,0|3,0,0]=4 1358 B12R1.25 C=CCSc1cncc(c1N)F 62a_100009880649_100000210623 [0,1,0,0,0,0|3,0,0]=4 1359 B12R1.25 C=CCSc1cncc(c1N)N 62a_100000210623_100000694774 [0,1,0,0,0,0|3,0,0]=4 1360 B12R1.25 C=CCSc1cncc(c1N)N 62a_100000694774_100000210623 [0,1,0,0,0,0|3,0,0]=4 1361 B12R1.25 C=CCSc1cncc(c1O)N 62a_100000210623_100000694263 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.25 C=CCSc1cncc(c1O)N 62a_100000694263_100000210623 [0,1,0,0,0,0|2,0,0]=3 1363 B12R1.25 C=CCSc1nccc(c1C)C 62a_100000210623_100009847204 [0,1,0,0,0,0|2,0,0]=3 1364 B12R1.25 C=CCSc1nccc(c1C)C 62a_100009847204_100000210623 [0,1,0,0,0,0|2,0,0]=3 1365 B12R1.25 C=CCSc1nccc(c1C)F 62a_100000210623_100009846374 [0,1,0,0,0,0|3,0,0]=4 1366 B12R1.25 C=CCSc1nccc(c1C)F 62a_100009846374_100000210623 [0,1,0,0,0,0|3,0,0]=4 1367 B12R1.25 C=CCSc1nccc(c1C)N 62a_100000210623_100000690622 [0,1,0,0,0,0|3,0,0]=4 1368 B12R1.25 C=CCSc1nccc(c1C)N 62a_100000690622_100000210623 [0,1,0,0,0,0|3,0,0]=4 1369 B12R1.25 C=CCSc1nccc(c1F)C 62a_100000210623_100009817629 [0,1,0,0,0,0|2,0,0]=3 1370 B12R1.25 C=CCSc1nccc(c1F)C 62a_100009817629_100000210623 [0,1,0,0,0,0|2,0,0]=3 1371 B12R1.25 C=CCSc1nccc(c1F)N 62a_100000210623_100015205195 [0,1,0,0,0,0|3,0,0]=4 1372 B12R1.25 C=CCSc1nccc(c1F)N 62a_100015205195_100000210623 [0,1,0,0,0,0|3,0,0]=4 1373 B12R1.25 C=CCSc1nccc(c1F)O 62a_100000210623_100009876375 [0,1,0,0,0,0|3,0,0]=4 1374 B12R1.25 C=CCSc1nccc(c1F)O 62a_100009876375_100000210623 [0,1,0,0,0,0|3,0,0]=4 1375 B12R1.25 C=CCSc1nccc(c1N)C 62a_100000210623_100000763560 [0,1,0,0,0,0|2,0,0]=3 1376 B12R1.25 C=CCSc1nccc(c1N)C 62a_100000763560_100000210623 [0,1,0,0,0,0|2,0,0]=3 1377 B12R1.25 C=CCSc1nccc(c1N)N 62a_100000085203_100000210623 [0,1,0,0,0,0|3,0,0]=4 1378 B12R1.25 C=CCSc1nccc(c1N)N 62a_100000210623_100000085203 [0,1,0,0,0,0|3,0,0]=4 1379 B12R1.25 C=CCSc1nccc(c1O)C 62a_100000210623_100000696282 [0,1,0,0,0,0|1,0,0]=2 1380 B12R1.25 C=CCSc1nccc(c1O)F 62a_100000210623_100009867227 [0,1,0,0,0,0|2,0,0]=3 1381 B12R1.25 C=CCSc1nccc(c1O)N 62a_100000210623_100009844647 [0,1,0,0,0,0|2,0,0]=3 1382 B12R1.25 C=CCSc1ncnc(c1C)C 62a_100000210623_100011438038 [0,1,0,0,0,0|3,0,0]=4 1383 B12R1.25 C=CCSc1ncnc(c1C)C 62a_100011438038_100000210623 [0,1,0,0,0,0|3,0,0]=4 1384 B12R1.25 C=CCSc1ncnc(c1F)C 62a_100000210623_100011671633 [0,1,0,0,0,0|3,0,0]=4 1385 B12R1.25 C=CCSc1ncnc(c1F)C 62a_100011671633_100000210623 [0,1,0,0,0,0|3,0,0]=4 1386 B12R1.25 C=CCSc1ncnc(c1O)N 62a_100000210623_100000124137 [0,1,0,0,0,0|3,0,0]=4 1387 B12R1.25 CC=NNc1cccc(c1C)C 4a_100020604495_200000210099 [0,1,0,0,0,0|2,0,1]=4 1388 B12R1.25 CCCCc1cccc(c1C)C 271570a_100020621405_100011214922 [0,1,0,0,0,0|1,0,2]=4 1389 B12R1.25 CCCCc1cccc(c1Cl)C 271570a_100020621405_200012352035 [0,1,0,0,0,0|1,0,2]=4 1390 B12R1.25 CCCCc1cccc(c1F)C 271570a_100020621405_100000717567 [0,1,0,0,0,0|1,0,2]=4 1391 B12R1.25 CCCCc1cccc(c1N)C 271570a_100020621405_100011834072 [0,1,0,0,0,0|1,0,2]=4 1392 B12R1.25 CCCCc1cccc(c1O)Br 271570a_100020621405_100010084509 [0,1,0,0,0,0|1,0,2]=4 1393 B12R1.25 CCCCc1cccc(c1O)C 271570a_100020621405_100009817157 [0,1,0,0,0,0|0,0,2]=3 1394 B12R1.25 CCCCc1cccc(c1O)Cl 271570a_100020621405_100010202889 [0,1,0,0,0,0|1,0,2]=4 1395 B12R1.25 CCCCc1cccc(c1O)F 271570a_100020621405_100009813666 [0,1,0,0,0,0|1,0,2]=4 1396 B12R1.25 CCCCc1cccc(c1O)N 271570a_100020621405_100011934915 [0,1,0,0,0,0|1,0,2]=4 1397 B12R1.25 CCCCc1cccc(c1O)O 271570a_100020621405_100009815950 [0,1,0,0,0,0|1,0,2]=4 1398 B12R1.25 CCCCc1nccc(c1O)C 271570a_100020621405_100000696282 [0,1,0,0,0,0|1,0,2]=4 1399 B12R1.25 CCCNc1cccc(c1Br)C 34a_100000684715_100000210303 [0,1,0,0,0,0|1,0,2]=4 1400 B12R1.25 CCCNc1cccc(c1C)C 2230a_100000210026_100000210303 [0,1,0,0,0,0|1,0,2]=4 1401 B12R1.25 CCCNc1cccc(c1C)C 34a_100000210026_100000210303 [0,1,0,0,0,0|1,0,2]=4 1402 B12R1.25 CCCNc1cccc(c1C)C 7a_100000210026_100000210303 [0,1,0,0,0,0|1,0,2]=4 1403 B12R1.25 CCCNc1cccc(c1Cl)C 34a_100000765562_100000210303 [0,1,0,0,0,0|1,0,2]=4 1404 B12R1.25 CCCNc1cccc(c1Cl)C 7a_100000765562_100000210303 [0,1,0,0,0,0|1,0,2]=4 1405 B12R1.25 CCCNc1cccc(c1F)C 2230a_100000697159_100000210303 [0,1,0,0,0,0|1,0,2]=4 1406 B12R1.25 CCCNc1cccc(c1F)C 34a_100000697159_100000210303 [0,1,0,0,0,0|1,0,2]=4 1407 B12R1.25 CCCNc1cccc(c1F)C 7a_100000697159_100000210303 [0,1,0,0,0,0|1,0,2]=4 1408 B12R1.25 CCCNc1cccc(c1I)C 34a_100000761888_100000210303 [0,1,0,0,0,0|1,0,2]=4 1409 B12R1.25 CCCNc1cccc(c1O)Br 34a_100011934915_100000210303 [0,1,0,0,0,0|1,0,2]=4 1410 B12R1.25 CCCNc1cccc(c1O)C 34a_100000756359_100000210303 [0,1,0,0,0,0|0,0,2]=3 1411 B12R1.25 CCCNc1cccc(c1O)Cl 34a_100000754742_100000210303 [0,1,0,0,0,0|1,0,2]=4 1412 B12R1.25 CCCNc1cccc(c1O)F 34a_100011934987_100000210303 [0,1,0,0,0,0|1,0,2]=4 1413 B12R1.25 CCCOc1cccc(c1Br)C 34a_100000686692_100000210303 [0,1,0,0,0,0|1,0,2]=4 1414 B12R1.25 CCCOc1cccc(c1Br)C 7a_100000686692_100000210303 [0,1,0,0,0,0|1,0,2]=4 1415 B12R1.25 CCCOc1cccc(c1C)C 34a_100000185855_100000210303 [0,1,0,0,0,0|1,0,2]=4 1416 B12R1.25 CCCOc1cccc(c1C)C 7a_100000185855_100000210303 [0,1,0,0,0,0|1,0,2]=4 1417 B12R1.25 CCCOc1cccc(c1Cl)C 34a_100000695629_100000210303 [0,1,0,0,0,0|1,0,2]=4 1418 B12R1.25 CCCOc1cccc(c1Cl)C 7a_100000695629_100000210303 [0,1,0,0,0,0|1,0,2]=4 1419 B12R1.25 CCCOc1cccc(c1F)C 34a_100000751311_100000210303 [0,1,0,0,0,0|1,0,2]=4 1420 B12R1.25 CCCOc1cccc(c1F)C 7a_100000751311_100000210303 [0,1,0,0,0,0|1,0,2]=4 1421 B12R1.25 CCCOc1cccc(c1I)C 34a_100010083724_100000210303 [0,1,0,0,0,0|1,0,2]=4 1422 B12R1.25 CCCOc1cccc(c1I)C 7a_100010083724_100000210303 [0,1,0,0,0,0|1,0,2]=4 1423 B12R1.25 CCCOc1cccc(c1N)C 34a_100000743429_100000210303 [0,1,0,0,0,0|1,0,2]=4 1424 B12R1.25 CCCOc1cccc(c1N)C 7a_100000743429_100000210303 [0,1,0,0,0,0|1,0,2]=4 1425 B12R1.25 CCCSc1cccc(c1Br)C 62a_100000210303_100012362457 [0,1,0,0,0,0|1,0,2]=4 1426 B12R1.25 CCCSc1cccc(c1Br)C 62a_100012362457_100000210303 [0,1,0,0,0,0|1,0,2]=4 1427 B12R1.25 CCCSc1cccc(c1C)C 62a_100000210303_100011214922 [0,1,0,0,0,0|1,0,2]=4 1428 B12R1.25 CCCSc1cccc(c1C)C 62a_100011214922_100000210303 [0,1,0,0,0,0|1,0,2]=4 1429 B12R1.25 CCCSc1cccc(c1Cl)C 62a_100000210303_200012352035 [0,1,0,0,0,0|1,0,2]=4 1430 B12R1.25 CCCSc1cccc(c1Cl)C 62a_200012352035_100000210303 [0,1,0,0,0,0|1,0,2]=4 1431 B12R1.25 CCCSc1cccc(c1F)C 62a_100000210303_100000717567 [0,1,0,0,0,0|1,0,2]=4 1432 B12R1.25 CCCSc1cccc(c1F)C 62a_100000717567_100000210303 [0,1,0,0,0,0|1,0,2]=4 1433 B12R1.25 CCCSc1cccc(c1N)C 62a_100000210303_100011834072 [0,1,0,0,0,0|1,0,2]=4 1434 B12R1.25 CCCSc1cccc(c1N)C 62a_100011834072_100000210303 [0,1,0,0,0,0|1,0,2]=4 1435 B12R1.25 CCCSc1cccc(c1O)Br 62a_100000210303_100010084509 [0,1,0,0,0,0|1,0,2]=4 1436 B12R1.25 CCCSc1cccc(c1O)Br 62a_100010084509_100000210303 [0,1,0,0,0,0|1,0,2]=4 1437 B12R1.25 CCCSc1cccc(c1O)C 62a_100000210303_100009817157 [0,1,0,0,0,0|0,0,2]=3 1438 B12R1.25 CCCSc1cccc(c1O)C 62a_100009817157_100000210303 [0,1,0,0,0,0|0,0,2]=3 1439 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100000210303_100010202889 [0,1,0,0,0,0|1,0,2]=4 1440 B12R1.25 CCCSc1cccc(c1O)Cl 62a_100010202889_100000210303 [0,1,0,0,0,0|1,0,2]=4 1441 B12R1.25 CCCSc1cccc(c1O)F 62a_100000210303_100009813666 [0,1,0,0,0,0|1,0,2]=4 1442 B12R1.25 CCCSc1cccc(c1O)F 62a_100009813666_100000210303 [0,1,0,0,0,0|1,0,2]=4 1443 B12R1.25 CCCSc1cccc(c1O)N 62a_100000210303_100010084371 [0,1,0,0,0,0|1,0,2]=4 1444 B12R1.25 CCCSc1cccc(c1O)N 62a_100011934915_100000210303 [0,1,0,0,0,0|1,0,2]=4 1445 B12R1.25 CCCSc1cccc(c1O)O 62a_100000210303_100009815950 [0,1,0,0,0,0|1,0,2]=4 1446 B12R1.25 CCCSc1nccc(c1O)C 62a_100000210303_100000696282 [0,1,0,0,0,0|1,0,2]=4 1447 B12R1.25 CCNCc1cccc(c1Br)C 207a_100015525214_100012186367 [0,1,0,0,0,0|1,0,2]=4 1448 B12R1.25 CCNCc1cccc(c1Br)C 2230a_100015525214_200012349612 [0,1,0,0,0,0|1,0,2]=4 1449 B12R1.25 CCNCc1cccc(c1Br)C 270004a_100015525214_100012186367 [0,1,0,0,0,0|1,0,2]=4 1450 B12R1.25 CCNCc1cccc(c1C)C 207a_100015525214_100000229941 [0,1,0,0,0,0|1,0,2]=4 1451 B12R1.25 CCNCc1cccc(c1C)C 2230a_100011211637_100000210202 [0,1,0,0,0,0|1,0,2]=4 1452 B12R1.25 CCNCc1cccc(c1C)C 2230a_100015525214_100011515928 [0,1,0,0,0,0|1,0,2]=4 1453 B12R1.25 CCNCc1cccc(c1C)C 270004a_100015525214_100000229941 [0,1,0,0,0,0|1,0,2]=4 1454 B12R1.25 CCNCc1cccc(c1C)C 34a_100011211637_100000210202 [0,1,0,0,0,0|1,0,2]=4 1455 B12R1.25 CCNCc1cccc(c1Cl)C 207a_100015525214_100012017286 [0,1,0,0,0,0|1,0,2]=4 1456 B12R1.25 CCNCc1cccc(c1Cl)C 2230a_100025705714_100000210202 [0,1,0,0,0,0|1,0,2]=4 1457 B12R1.25 CCNCc1cccc(c1Cl)C 270004a_100015525214_100012017286 [0,1,0,0,0,0|1,0,2]=4 1458 B12R1.25 CCNCc1cccc(c1Cl)C 34a_100025705714_100000210202 [0,1,0,0,0,0|1,0,2]=4 1459 B12R1.25 CCNCc1cccc(c1F)C 207a_100015525214_100011219516 [0,1,0,0,0,0|1,0,2]=4 1460 B12R1.25 CCNCc1cccc(c1F)C 2230a_100012002060_100000210202 [0,1,0,0,0,0|1,0,2]=4 1461 B12R1.25 CCNCc1cccc(c1F)C 2230a_100015525214_100011216058 [0,1,0,0,0,0|1,0,2]=4 1462 B12R1.25 CCNCc1cccc(c1F)C 270004a_100015525214_100011219516 [0,1,0,0,0,0|1,0,2]=4 1463 B12R1.25 CCNCc1cccc(c1F)C 34a_100012002060_100000210202 [0,1,0,0,0,0|1,0,2]=4 1464 B12R1.25 CCNCc1cccc(c1O)C 34a_100020639391_100000210202 [0,1,0,0,0,0|0,0,2]=3 1465 B12R1.25 CCOCc1cccc(c1Br)C 34a_100011659289_100000210202 [0,1,0,0,0,0|1,0,2]=4 1466 B12R1.25 CCOCc1cccc(c1Br)C 34a_100121572206_200012349612 [0,1,0,0,0,0|1,0,2]=4 1467 B12R1.25 CCOCc1cccc(c1Br)C 7a_100011659289_100000210202 [0,1,0,0,0,0|1,0,2]=4 1468 B12R1.25 CCOCc1cccc(c1C)C 34a_100011219135_100000210202 [0,1,0,0,0,0|1,0,2]=4 1469 B12R1.25 CCOCc1cccc(c1C)C 34a_100121572206_100011273979 [0,1,0,0,0,0|1,0,2]=4 1470 B12R1.25 CCOCc1cccc(c1C)C 7a_100011219135_100000210202 [0,1,0,0,0,0|1,0,2]=4 1471 B12R1.25 CCOCc1cccc(c1Cl)C 34a_100000710031_100000210202 [0,1,0,0,0,0|1,0,2]=4 1472 B12R1.25 CCOCc1cccc(c1Cl)C 7a_100000710031_100000210202 [0,1,0,0,0,0|1,0,2]=4 1473 B12R1.25 CCOCc1cccc(c1F)C 34a_100121572206_100011216058 [0,1,0,0,0,0|1,0,2]=4 1474 B12R1.25 CCOCc1cccc(c1F)C 34a_200011219517_100000210202 [0,1,0,0,0,0|1,0,2]=4 1475 B12R1.25 CCOCc1cccc(c1F)C 7a_200011219517_100000210202 [0,1,0,0,0,0|1,0,2]=4 1476 B12R1.25 CCOCc1cccc(c1I)C 34a_100012349780_100000210202 [0,1,0,0,0,0|1,0,2]=4 1477 B12R1.25 CCOCc1cccc(c1I)C 7a_100012349780_100000210202 [0,1,0,0,0,0|1,0,2]=4 1478 B12R1.25 CCOCc1cccc(c1N)C 34a_100011215590_100000210202 [0,1,0,0,0,0|1,0,2]=4 1479 B12R1.25 CCSCc1cccc(c1Br)C 62a_100000210202_200012349612 [0,1,0,0,0,0|1,0,2]=4 1480 B12R1.25 CCSCc1cccc(c1Br)C 62a_200012349612_100000210202 [0,1,0,0,0,0|1,0,2]=4 1481 B12R1.25 CCSCc1cccc(c1C)C 62a_100000210202_100011515928 [0,1,0,0,0,0|1,0,2]=4 1482 B12R1.25 CCSCc1cccc(c1C)C 62a_100011515928_100000210202 [0,1,0,0,0,0|1,0,2]=4 1483 B12R1.25 CCSCc1cccc(c1F)C 62a_100000210202_100011216058 [0,1,0,0,0,0|1,0,2]=4 1484 B12R1.25 CCSCc1cccc(c1F)C 62a_100011216058_100000210202 [0,1,0,0,0,0|1,0,2]=4 1485 B12R1.25 COCNc1cccc(c1C)C 2230a_100000210026_100000766300 [0,1,0,0,0,0|2,0,1]=4 1486 B12R1.25 COCNc1cccc(c1F)C 2230a_100000697159_100000766300 [0,1,0,0,0,0|2,0,1]=4 1487 B12R1.25 COCSc1cccc(c1Br)C 62a_100000766300_100012362457 [0,1,0,0,0,0|2,0,1]=4 1488 B12R1.25 COCSc1cccc(c1Br)C 62a_100012362457_100000766300 [0,1,0,0,0,0|2,0,1]=4 1489 B12R1.25 COCSc1cccc(c1C)C 62a_100000766300_100011214922 [0,1,0,0,0,0|2,0,1]=4 1490 B12R1.25 COCSc1cccc(c1C)C 62a_100011214922_100000766300 [0,1,0,0,0,0|2,0,1]=4 1491 B12R1.25 COCSc1cccc(c1Cl)C 62a_100000766300_200012352035 [0,1,0,0,0,0|2,0,1]=4 1492 B12R1.25 COCSc1cccc(c1Cl)C 62a_200012352035_100000766300 [0,1,0,0,0,0|2,0,1]=4 1493 B12R1.25 COCSc1cccc(c1F)C 62a_100000717567_100000766300 [0,1,0,0,0,0|2,0,1]=4 1494 B12R1.25 COCSc1cccc(c1F)C 62a_100000766300_100000717567 [0,1,0,0,0,0|2,0,1]=4 1495 B12R1.25 COCSc1cccc(c1N)C 62a_100000766300_100011834072 [0,1,0,0,0,0|2,0,1]=4 1496 B12R1.25 COCSc1cccc(c1N)C 62a_100011834072_100000766300 [0,1,0,0,0,0|2,0,1]=4 1497 B12R1.25 COCSc1cccc(c1O)Br 62a_100000766300_100010084509 [0,1,0,0,0,0|2,0,1]=4 1498 B12R1.25 COCSc1cccc(c1O)Br 62a_100010084509_100000766300 [0,1,0,0,0,0|2,0,1]=4 1499 B12R1.25 COCSc1cccc(c1O)C 62a_100000766300_100009817157 [0,1,0,0,0,0|1,0,1]=3 1500 B12R1.25 COCSc1cccc(c1O)C 62a_100009817157_100000766300 [0,1,0,0,0,0|1,0,1]=3 1501 B12R1.25 COCSc1cccc(c1O)Cl 62a_100000766300_100010202889 [0,1,0,0,0,0|2,0,1]=4 1502 B12R1.25 COCSc1cccc(c1O)Cl 62a_100010202889_100000766300 [0,1,0,0,0,0|2,0,1]=4 1503 B12R1.25 COCSc1cccc(c1O)F 62a_100000766300_100009813666 [0,1,0,0,0,0|2,0,1]=4 1504 B12R1.25 COCSc1cccc(c1O)F 62a_100009813666_100000766300 [0,1,0,0,0,0|2,0,1]=4 1505 B12R1.25 COCSc1cccc(c1O)N 62a_100000766300_100010084371 [0,1,0,0,0,0|2,0,1]=4 1506 B12R1.25 COCSc1cccc(c1O)N 62a_100011934915_100000766300 [0,1,0,0,0,0|2,0,1]=4 1507 B12R1.25 COCSc1cccc(c1O)O 62a_100000766300_100009815950 [0,1,0,0,0,0|2,0,1]=4 1508 B12R1.25 COCSc1nccc(c1O)C 62a_100000766300_100000696282 [0,1,0,0,0,0|2,0,1]=4 1509 B12R1.25 CSCNc1cccc(c1Br)C 34a_100000684715_100011218213 [0,1,0,0,0,0|2,0,1]=4 1510 B12R1.25 CSCNc1cccc(c1C)C 2230a_100000210026_100011218213 [0,1,0,0,0,0|2,0,1]=4 1511 B12R1.25 CSCNc1cccc(c1C)C 34a_100000210026_100011218213 [0,1,0,0,0,0|2,0,1]=4 1512 B12R1.25 CSCNc1cccc(c1Cl)C 34a_100000765562_100011218213 [0,1,0,0,0,0|2,0,1]=4 1513 B12R1.25 CSCNc1cccc(c1F)C 2230a_100000697159_100011218213 [0,1,0,0,0,0|2,0,1]=4 1514 B12R1.25 CSCNc1cccc(c1F)C 34a_100000697159_100011218213 [0,1,0,0,0,0|2,0,1]=4 1515 B12R1.25 CSCNc1cccc(c1I)C 34a_100000761888_100011218213 [0,1,0,0,0,0|2,0,1]=4 1516 B12R1.25 CSCNc1cccc(c1O)Br 34a_100011934915_100011218213 [0,1,0,0,0,0|2,0,1]=4 1517 B12R1.25 CSCNc1cccc(c1O)C 34a_100000756359_100011218213 [0,1,0,0,0,0|1,0,1]=3 1518 B12R1.25 CSCNc1cccc(c1O)Cl 34a_100000754742_100011218213 [0,1,0,0,0,0|2,0,1]=4 1519 B12R1.25 CSCNc1cccc(c1O)F 34a_100011934987_100011218213 [0,1,0,0,0,0|2,0,1]=4 1520 B12R1.25 CSCOc1cccc(c1Br)C 34a_100000686692_100011218213 [0,1,0,0,0,0|2,0,1]=4 1521 B12R1.25 CSCOc1cccc(c1C)C 34a_100000185855_100011218213 [0,1,0,0,0,0|2,0,1]=4 1522 B12R1.25 CSCOc1cccc(c1Cl)C 34a_100000695629_100011218213 [0,1,0,0,0,0|2,0,1]=4 1523 B12R1.25 CSCOc1cccc(c1F)C 34a_100000751311_100011218213 [0,1,0,0,0,0|2,0,1]=4 1524 B12R1.25 CSCOc1cccc(c1I)C 34a_100010083724_100011218213 [0,1,0,0,0,0|2,0,1]=4 1525 B12R1.25 CSCOc1cccc(c1N)C 34a_100000743429_100011218213 [0,1,0,0,0,0|2,0,1]=4 1526 B12R1.25 CSCSc1cccc(c1Br)C 62a_100011218213_100012362457 [0,1,0,0,0,0|2,0,1]=4 1527 B12R1.25 CSCSc1cccc(c1Br)C 62a_100012362457_100011218213 [0,1,0,0,0,0|2,0,1]=4 1528 B12R1.25 CSCSc1cccc(c1C)C 62a_100011214922_100011218213 [0,1,0,0,0,0|2,0,1]=4 1529 B12R1.25 CSCSc1cccc(c1C)C 62a_100011218213_100011214922 [0,1,0,0,0,0|2,0,1]=4 1530 B12R1.25 CSCSc1cccc(c1Cl)C 62a_100011218213_200012352035 [0,1,0,0,0,0|2,0,1]=4 1531 B12R1.25 CSCSc1cccc(c1Cl)C 62a_200012352035_100011218213 [0,1,0,0,0,0|2,0,1]=4 1532 B12R1.25 CSCSc1cccc(c1F)C 62a_100000717567_100011218213 [0,1,0,0,0,0|2,0,1]=4 1533 B12R1.25 CSCSc1cccc(c1F)C 62a_100011218213_100000717567 [0,1,0,0,0,0|2,0,1]=4 1534 B12R1.25 CSCSc1cccc(c1N)C 62a_100011218213_100011834072 [0,1,0,0,0,0|2,0,1]=4 1535 B12R1.25 CSCSc1cccc(c1N)C 62a_100011834072_100011218213 [0,1,0,0,0,0|2,0,1]=4 1536 B12R1.25 CSCSc1cccc(c1O)Br 62a_100010084509_100011218213 [0,1,0,0,0,0|2,0,1]=4 1537 B12R1.25 CSCSc1cccc(c1O)Br 62a_100011218213_100010084509 [0,1,0,0,0,0|2,0,1]=4 1538 B12R1.25 CSCSc1cccc(c1O)C 62a_100009817157_100011218213 [0,1,0,0,0,0|1,0,1]=3 1539 B12R1.25 CSCSc1cccc(c1O)C 62a_100011218213_100009817157 [0,1,0,0,0,0|1,0,1]=3 1540 B12R1.25 CSCSc1cccc(c1O)Cl 62a_100010202889_100011218213 [0,1,0,0,0,0|2,0,1]=4 1541 B12R1.25 CSCSc1cccc(c1O)Cl 62a_100011218213_100010202889 [0,1,0,0,0,0|2,0,1]=4 1542 B12R1.25 CSCSc1cccc(c1O)F 62a_100009813666_100011218213 [0,1,0,0,0,0|2,0,1]=4 1543 B12R1.25 CSCSc1cccc(c1O)F 62a_100011218213_100009813666 [0,1,0,0,0,0|2,0,1]=4 1544 B12R1.25 CSCSc1cccc(c1O)N 62a_100011218213_100010084371 [0,1,0,0,0,0|2,0,1]=4 1545 B12R1.25 CSCSc1cccc(c1O)N 62a_100011934915_100011218213 [0,1,0,0,0,0|2,0,1]=4 1546 B12R1.25 CSCSc1cccc(c1O)O 62a_100011218213_100009815950 [0,1,0,0,0,0|2,0,1]=4 1547 B12R1.25 CSCSc1nccc(c1O)C 62a_100011218213_100000696282 [0,1,0,0,0,0|2,0,1]=4 1548 B12R1.25 Cc1c(cccc1NCC=O)Br 34a_100000750434_200009817547 [0,1,0,0,0,0|3,0,0]=4 1549 B12R1.25 Cc1c(cccc1NCC=O)Cl 2230a_100000210441_200015260668 [0,1,0,0,0,0|3,0,0]=4 1550 B12R1.25 Cc1c(cccc1NCC=O)Cl 34a_100000210441_200009817547 [0,1,0,0,0,0|3,0,0]=4 1551 B12R1.25 Cc1c(cccc1NCC=O)Cl 7a_100000210441_200015260668 [0,1,0,0,0,0|3,0,0]=4 1552 B12R1.25 Cc1c(cccc1NCC=O)F 34a_100000745574_200009817547 [0,1,0,0,0,0|3,0,0]=4 1553 B12R1.25 Cc1c(cccc1NCC=O)F 7a_100000745574_200015260668 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.25 Cc1c(cccc1NCC=O)I 34a_100000761887_200009817547 [0,1,0,0,0,0|3,0,0]=4 1555 B12R1.25 Cc1c(cccc1NCC=O)O 34a_100011216573_200009817547 [0,1,0,0,0,0|3,0,0]=4 1556 B12R1.25 Cc1c(cccc1NCC=O)O 7a_100011216573_200015260668 [0,1,0,0,0,0|3,0,0]=4 1557 B12R1.25 Cc1c(cccc1OCC=O)Br 34a_100012002258_200009817547 [0,1,0,0,0,0|3,0,0]=4 1558 B12R1.25 Cc1c(cccc1OCC=O)Br 7a_100012002258_200015260668 [0,1,0,0,0,0|3,0,0]=4 1559 B12R1.25 Cc1c(cccc1OCC=O)Cl 34a_100011265684_200009817547 [0,1,0,0,0,0|3,0,0]=4 1560 B12R1.25 Cc1c(cccc1OCC=O)Cl 7a_100011265684_200015260668 [0,1,0,0,0,0|3,0,0]=4 1561 B12R1.25 Cc1c(cccc1OCC=O)F 34a_100011217231_200009817547 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.25 Cc1c(cccc1OCC=O)F 7a_100011217231_200015260668 [0,1,0,0,0,0|3,0,0]=4 1563 B12R1.25 Cc1c(cccc1OCC=O)N 34a_100011216573_200009817547 [0,1,0,0,0,0|3,0,0]=4 1564 B12R1.25 Cc1c(cccc1OCC=O)N 7a_100011216573_200015260668 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.25 Cc1c(cccc1SCC=O)Br 62a_100012353703_200015260668 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.25 Cc1c(cccc1SCC=O)Br 62a_200015260668_100012353703 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.25 Cc1c(cccc1SCC=O)Cl 62a_100000726075_200015260668 [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.25 Cc1c(cccc1SCC=O)Cl 62a_200015260668_100000726075 [0,1,0,0,0,0|3,0,0]=4 1569 B12R1.25 Cc1c(cccc1SCC=O)F 62a_100011216893_200015260668 [0,1,0,0,0,0|3,0,0]=4 1570 B12R1.25 Cc1c(cccc1SCC=O)F 62a_200015260668_100011216893 [0,1,0,0,0,0|3,0,0]=4 1571 B12R1.25 Cc1c(cccc1SCC=O)N 62a_100000761887_200015260668 [0,1,0,0,0,0|3,0,0]=4 1572 B12R1.25 Cc1c(cccc1SCC=O)N 62a_200015260668_100000761887 [0,1,0,0,0,0|3,0,0]=4 1573 B12R1.25 Cc1c(cccc1SCC=O)O 62a_100012002258_200015260668 [0,1,0,0,0,0|3,0,0]=4 1574 B12R1.25 Cc1c(cccc1SCC=O)O 62a_200015260668_100012002258 [0,1,0,0,0,0|3,0,0]=4 1575 B12R1.25 Cc1cccc(c1Br)COCF 34a_100011659289_100015361967 [0,1,0,0,0,0|2,0,1]=4 1576 B12R1.25 Cc1cccc(c1Br)COCF 7a_100011659289_100015361967 [0,1,0,0,0,0|2,0,1]=4 1577 B12R1.25 Cc1cccc(c1Br)CSCF 62a_100015361967_200012349612 [0,1,0,0,0,0|2,0,1]=4 1578 B12R1.25 Cc1cccc(c1Br)CSCF 62a_200012349612_100015361967 [0,1,0,0,0,0|2,0,1]=4 1579 B12R1.25 Cc1cccc(c1Br)NCC=O 34a_100000684715_200009817547 [0,1,0,0,0,0|2,0,0]=3 1580 B12R1.25 Cc1cccc(c1Br)NCCF 34a_100000684715_100011217306 [0,1,0,0,0,0|2,0,1]=4 1581 B12R1.25 Cc1cccc(c1Br)NCCO 34a_100000684715_100000211926 [0,1,0,0,0,0|2,0,1]=4 1582 B12R1.25 Cc1cccc(c1Br)OCC#N 7a_100000686692_100011215382 [0,1,0,0,0,0|2,0,1]=4 1583 B12R1.25 Cc1cccc(c1Br)OCC=O 34a_100000686692_200009817547 [0,1,0,0,0,0|2,0,0]=3 1584 B12R1.25 Cc1cccc(c1Br)OCC=O 7a_100000686692_200015260668 [0,1,0,0,0,0|2,0,0]=3 1585 B12R1.25 Cc1cccc(c1Br)OCCF 34a_100000686692_100011217306 [0,1,0,0,0,0|2,0,1]=4 1586 B12R1.25 Cc1cccc(c1Br)OCCF 7a_100000686692_100011217306 [0,1,0,0,0,0|2,0,1]=4 1587 B12R1.25 Cc1cccc(c1Br)OCCO 34a_100000686692_100000211926 [0,1,0,0,0,0|2,0,1]=4 1588 B12R1.25 Cc1cccc(c1Br)OCCO 7a_100000686692_100000211926 [0,1,0,0,0,0|2,0,1]=4 1589 B12R1.25 Cc1cccc(c1Br)SCC#N 62a_100011215382_100012362457 [0,1,0,0,0,0|2,0,1]=4 1590 B12R1.25 Cc1cccc(c1Br)SCC#N 62a_100012362457_100011215382 [0,1,0,0,0,0|2,0,1]=4 1591 B12R1.25 Cc1cccc(c1Br)SCC=O 62a_100012362457_200015260668 [0,1,0,0,0,0|2,0,0]=3 1592 B12R1.25 Cc1cccc(c1Br)SCC=O 62a_200015260668_100012362457 [0,1,0,0,0,0|2,0,0]=3 1593 B12R1.25 Cc1cccc(c1Br)SCCF 62a_100011217306_100012362457 [0,1,0,0,0,0|2,0,1]=4 1594 B12R1.25 Cc1cccc(c1Br)SCCF 62a_100012362457_100011217306 [0,1,0,0,0,0|2,0,1]=4 1595 B12R1.25 Cc1cccc(c1Br)SCCO 62a_100000211926_100012362457 [0,1,0,0,0,0|2,0,1]=4 1596 B12R1.25 Cc1cccc(c1Br)SCCO 62a_100012362457_100000211926 [0,1,0,0,0,0|2,0,1]=4 1597 B12R1.25 Cc1cccc(c1C)CNCF 34a_100011211637_100015361967 [0,1,0,0,0,0|2,0,1]=4 1598 B12R1.25 Cc1cccc(c1C)COCF 34a_100011219135_100015361967 [0,1,0,0,0,0|2,0,1]=4 1599 B12R1.25 Cc1cccc(c1C)COCF 7a_100011219135_100015361967 [0,1,0,0,0,0|2,0,1]=4 1600 B12R1.25 Cc1cccc(c1C)CSCF 62a_100011515928_100015361967 [0,1,0,0,0,0|2,0,1]=4 1601 B12R1.25 Cc1cccc(c1C)CSCF 62a_100015361967_100011515928 [0,1,0,0,0,0|2,0,1]=4 1602 B12R1.25 Cc1cccc(c1C)NCC#N 2230a_100000210026_100011215382 [0,1,0,0,0,0|2,0,1]=4 1603 B12R1.25 Cc1cccc(c1C)NCC#N 7a_100000210026_100011215382 [0,1,0,0,0,0|2,0,1]=4 1604 B12R1.25 Cc1cccc(c1C)NCC=O 2230a_100000210026_200015260668 [0,1,0,0,0,0|2,0,0]=3 1605 B12R1.25 Cc1cccc(c1C)NCC=O 34a_100000210026_200009817547 [0,1,0,0,0,0|2,0,0]=3 1606 B12R1.25 Cc1cccc(c1C)NCC=O 7a_100000210026_200015260668 [0,1,0,0,0,0|2,0,0]=3 1607 B12R1.25 Cc1cccc(c1C)NCCF 2230a_100000210026_100011217306 [0,1,0,0,0,0|2,0,1]=4 1608 B12R1.25 Cc1cccc(c1C)NCCF 34a_100000210026_100011217306 [0,1,0,0,0,0|2,0,1]=4 1609 B12R1.25 Cc1cccc(c1C)NCCF 7a_100000210026_100011217306 [0,1,0,0,0,0|2,0,1]=4 1610 B12R1.25 Cc1cccc(c1C)NCCO 2230a_100000210026_100000211926 [0,1,0,0,0,0|2,0,1]=4 1611 B12R1.25 Cc1cccc(c1C)NCCO 34a_100000210026_100000211926 [0,1,0,0,0,0|2,0,1]=4 1612 B12R1.25 Cc1cccc(c1C)NCCO 7a_100000210026_100000211926 [0,1,0,0,0,0|2,0,1]=4 1613 B12R1.25 Cc1cccc(c1C)OCC#N 7a_100000185855_100011215382 [0,1,0,0,0,0|2,0,1]=4 1614 B12R1.25 Cc1cccc(c1C)OCC=O 34a_100000185855_200009817547 [0,1,0,0,0,0|2,0,0]=3 1615 B12R1.25 Cc1cccc(c1C)OCC=O 7a_100000185855_200015260668 [0,1,0,0,0,0|2,0,0]=3 1616 B12R1.25 Cc1cccc(c1C)OCCF 34a_100000185855_100011217306 [0,1,0,0,0,0|2,0,1]=4 1617 B12R1.25 Cc1cccc(c1C)OCCF 7a_100000185855_100011217306 [0,1,0,0,0,0|2,0,1]=4 1618 B12R1.25 Cc1cccc(c1C)OCCO 34a_100000185855_100000211926 [0,1,0,0,0,0|2,0,1]=4 1619 B12R1.25 Cc1cccc(c1C)OCCO 7a_100000185855_100000211926 [0,1,0,0,0,0|2,0,1]=4 1620 B12R1.25 Cc1cccc(c1C)SCC#N 62a_100011214922_100011215382 [0,1,0,0,0,0|2,0,1]=4 1621 B12R1.25 Cc1cccc(c1C)SCC#N 62a_100011215382_100011214922 [0,1,0,0,0,0|2,0,1]=4 1622 B12R1.25 Cc1cccc(c1C)SCC=O 62a_100011214922_200015260668 [0,1,0,0,0,0|2,0,0]=3 1623 B12R1.25 Cc1cccc(c1C)SCC=O 62a_200015260668_100011214922 [0,1,0,0,0,0|2,0,0]=3 1624 B12R1.25 Cc1cccc(c1C)SCCF 62a_100011214922_100011217306 [0,1,0,0,0,0|2,0,1]=4 1625 B12R1.25 Cc1cccc(c1C)SCCF 62a_100011217306_100011214922 [0,1,0,0,0,0|2,0,1]=4 1626 B12R1.25 Cc1cccc(c1C)SCCO 62a_100000211926_100011214922 [0,1,0,0,0,0|2,0,1]=4 1627 B12R1.25 Cc1cccc(c1C)SCCO 62a_100011214922_100000211926 [0,1,0,0,0,0|2,0,1]=4 1628 B12R1.25 Cc1cccc(c1Cl)CNCF 34a_100025705714_100015361967 [0,1,0,0,0,0|2,0,1]=4 1629 B12R1.25 Cc1cccc(c1Cl)COCF 34a_100000710031_100015361967 [0,1,0,0,0,0|2,0,1]=4 1630 B12R1.25 Cc1cccc(c1Cl)COCF 7a_100000710031_100015361967 [0,1,0,0,0,0|2,0,1]=4 1631 B12R1.25 Cc1cccc(c1Cl)NCC#N 7a_100000765562_100011215382 [0,1,0,0,0,0|2,0,1]=4 1632 B12R1.25 Cc1cccc(c1Cl)NCC=O 34a_100000765562_200009817547 [0,1,0,0,0,0|2,0,0]=3 1633 B12R1.25 Cc1cccc(c1Cl)NCC=O 7a_100000765562_200015260668 [0,1,0,0,0,0|2,0,0]=3 1634 B12R1.25 Cc1cccc(c1Cl)NCCF 34a_100000765562_100011217306 [0,1,0,0,0,0|2,0,1]=4 1635 B12R1.25 Cc1cccc(c1Cl)NCCF 7a_100000765562_100011217306 [0,1,0,0,0,0|2,0,1]=4 1636 B12R1.25 Cc1cccc(c1Cl)NCCO 34a_100000765562_100000211926 [0,1,0,0,0,0|2,0,1]=4 1637 B12R1.25 Cc1cccc(c1Cl)NCCO 7a_100000765562_100000211926 [0,1,0,0,0,0|2,0,1]=4 1638 B12R1.25 Cc1cccc(c1Cl)OCC#N 7a_100000695629_100011215382 [0,1,0,0,0,0|2,0,1]=4 1639 B12R1.25 Cc1cccc(c1Cl)OCC=O 34a_100000695629_200009817547 [0,1,0,0,0,0|2,0,0]=3 1640 B12R1.25 Cc1cccc(c1Cl)OCC=O 7a_100000695629_200015260668 [0,1,0,0,0,0|2,0,0]=3 1641 B12R1.25 Cc1cccc(c1Cl)OCCF 34a_100000695629_100011217306 [0,1,0,0,0,0|2,0,1]=4 1642 B12R1.25 Cc1cccc(c1Cl)OCCF 7a_100000695629_100011217306 [0,1,0,0,0,0|2,0,1]=4 1643 B12R1.25 Cc1cccc(c1Cl)OCCO 34a_100000695629_100000211926 [0,1,0,0,0,0|2,0,1]=4 1644 B12R1.25 Cc1cccc(c1Cl)OCCO 7a_100000695629_100000211926 [0,1,0,0,0,0|2,0,1]=4 1645 B12R1.25 Cc1cccc(c1Cl)SCC#N 62a_100011215382_200012352035 [0,1,0,0,0,0|2,0,1]=4 1646 B12R1.25 Cc1cccc(c1Cl)SCC#N 62a_200012352035_100011215382 [0,1,0,0,0,0|2,0,1]=4 1647 B12R1.25 Cc1cccc(c1Cl)SCC=O 62a_200012352035_200015260668 [0,1,0,0,0,0|2,0,0]=3 1648 B12R1.25 Cc1cccc(c1Cl)SCC=O 62a_200015260668_200012352035 [0,1,0,0,0,0|2,0,0]=3 1649 B12R1.25 Cc1cccc(c1Cl)SCCF 62a_100011217306_200012352035 [0,1,0,0,0,0|2,0,1]=4 1650 B12R1.25 Cc1cccc(c1Cl)SCCF 62a_200012352035_100011217306 [0,1,0,0,0,0|2,0,1]=4 1651 B12R1.25 Cc1cccc(c1Cl)SCCO 62a_100000211926_200012352035 [0,1,0,0,0,0|2,0,1]=4 1652 B12R1.25 Cc1cccc(c1Cl)SCCO 62a_200012352035_100000211926 [0,1,0,0,0,0|2,0,1]=4 1653 B12R1.25 Cc1cccc(c1F)CNCF 34a_100012002060_100015361967 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.25 Cc1cccc(c1F)COCF 34a_200011219517_100015361967 [0,1,0,0,0,0|2,0,1]=4 1655 B12R1.25 Cc1cccc(c1F)COCF 7a_200011219517_100015361967 [0,1,0,0,0,0|2,0,1]=4 1656 B12R1.25 Cc1cccc(c1F)CSCF 62a_100011216058_100015361967 [0,1,0,0,0,0|2,0,1]=4 1657 B12R1.25 Cc1cccc(c1F)CSCF 62a_100015361967_100011216058 [0,1,0,0,0,0|2,0,1]=4 1658 B12R1.25 Cc1cccc(c1F)NCC#N 2230a_100000697159_100011215382 [0,1,0,0,0,0|2,0,1]=4 1659 B12R1.25 Cc1cccc(c1F)NCC#N 7a_100000697159_100011215382 [0,1,0,0,0,0|2,0,1]=4 1660 B12R1.25 Cc1cccc(c1F)NCC=O 2230a_100000697159_200015260668 [0,1,0,0,0,0|2,0,0]=3 1661 B12R1.25 Cc1cccc(c1F)NCC=O 34a_100000697159_200009817547 [0,1,0,0,0,0|2,0,0]=3 1662 B12R1.25 Cc1cccc(c1F)NCC=O 7a_100000697159_200015260668 [0,1,0,0,0,0|2,0,0]=3 1663 B12R1.25 Cc1cccc(c1F)NCCF 2230a_100000697159_100011217306 [0,1,0,0,0,0|2,0,1]=4 1664 B12R1.25 Cc1cccc(c1F)NCCF 34a_100000697159_100011217306 [0,1,0,0,0,0|2,0,1]=4 1665 B12R1.25 Cc1cccc(c1F)NCCF 7a_100000697159_100011217306 [0,1,0,0,0,0|2,0,1]=4 1666 B12R1.25 Cc1cccc(c1F)NCCO 2230a_100000697159_100000211926 [0,1,0,0,0,0|2,0,1]=4 1667 B12R1.25 Cc1cccc(c1F)NCCO 34a_100000697159_100000211926 [0,1,0,0,0,0|2,0,1]=4 1668 B12R1.25 Cc1cccc(c1F)NCCO 7a_100000697159_100000211926 [0,1,0,0,0,0|2,0,1]=4 1669 B12R1.25 Cc1cccc(c1F)OCC#N 7a_100000751311_100011215382 [0,1,0,0,0,0|2,0,1]=4 1670 B12R1.25 Cc1cccc(c1F)OCC=O 34a_100000751311_200009817547 [0,1,0,0,0,0|2,0,0]=3 1671 B12R1.25 Cc1cccc(c1F)OCC=O 7a_100000751311_200015260668 [0,1,0,0,0,0|2,0,0]=3 1672 B12R1.25 Cc1cccc(c1F)OCCF 34a_100000751311_100011217306 [0,1,0,0,0,0|2,0,1]=4 1673 B12R1.25 Cc1cccc(c1F)OCCF 7a_100000751311_100011217306 [0,1,0,0,0,0|2,0,1]=4 1674 B12R1.25 Cc1cccc(c1F)OCCO 34a_100000751311_100000211926 [0,1,0,0,0,0|2,0,1]=4 1675 B12R1.25 Cc1cccc(c1F)OCCO 7a_100000751311_100000211926 [0,1,0,0,0,0|2,0,1]=4 1676 B12R1.25 Cc1cccc(c1F)SCC#N 62a_100000717567_100011215382 [0,1,0,0,0,0|2,0,1]=4 1677 B12R1.25 Cc1cccc(c1F)SCC#N 62a_100011215382_100000717567 [0,1,0,0,0,0|2,0,1]=4 1678 B12R1.25 Cc1cccc(c1F)SCC=O 62a_100000717567_200015260668 [0,1,0,0,0,0|2,0,0]=3 1679 B12R1.25 Cc1cccc(c1F)SCC=O 62a_200015260668_100000717567 [0,1,0,0,0,0|2,0,0]=3 1680 B12R1.25 Cc1cccc(c1F)SCCF 62a_100000717567_100011217306 [0,1,0,0,0,0|2,0,1]=4 1681 B12R1.25 Cc1cccc(c1F)SCCF 62a_100011217306_100000717567 [0,1,0,0,0,0|2,0,1]=4 1682 B12R1.25 Cc1cccc(c1F)SCCO 62a_100000211926_100000717567 [0,1,0,0,0,0|2,0,1]=4 1683 B12R1.25 Cc1cccc(c1F)SCCO 62a_100000717567_100000211926 [0,1,0,0,0,0|2,0,1]=4 1684 B12R1.25 Cc1cccc(c1I)COCF 34a_100012349780_100015361967 [0,1,0,0,0,0|2,0,1]=4 1685 B12R1.25 Cc1cccc(c1I)COCF 7a_100012349780_100015361967 [0,1,0,0,0,0|2,0,1]=4 1686 B12R1.25 Cc1cccc(c1I)NCC=O 34a_100000761888_200009817547 [0,1,0,0,0,0|2,0,0]=3 1687 B12R1.25 Cc1cccc(c1I)NCCF 34a_100000761888_100011217306 [0,1,0,0,0,0|2,0,1]=4 1688 B12R1.25 Cc1cccc(c1I)NCCO 34a_100000761888_100000211926 [0,1,0,0,0,0|2,0,1]=4 1689 B12R1.25 Cc1cccc(c1I)OCC#N 7a_100010083724_100011215382 [0,1,0,0,0,0|2,0,1]=4 1690 B12R1.25 Cc1cccc(c1I)OCC=O 34a_100010083724_200009817547 [0,1,0,0,0,0|2,0,0]=3 1691 B12R1.25 Cc1cccc(c1I)OCC=O 7a_100010083724_200015260668 [0,1,0,0,0,0|2,0,0]=3 1692 B12R1.25 Cc1cccc(c1I)OCCF 34a_100010083724_100011217306 [0,1,0,0,0,0|2,0,1]=4 1693 B12R1.25 Cc1cccc(c1I)OCCF 7a_100010083724_100011217306 [0,1,0,0,0,0|2,0,1]=4 1694 B12R1.25 Cc1cccc(c1I)OCCO 34a_100010083724_100000211926 [0,1,0,0,0,0|2,0,1]=4 1695 B12R1.25 Cc1cccc(c1I)OCCO 7a_100010083724_100000211926 [0,1,0,0,0,0|2,0,1]=4 1696 B12R1.25 Cc1cccc(c1N)COCF 34a_100011215590_100015361967 [0,1,0,0,0,0|2,0,1]=4 1697 B12R1.25 Cc1cccc(c1N)OCC#N 7a_100000743429_100011215382 [0,1,0,0,0,0|2,0,1]=4 1698 B12R1.25 Cc1cccc(c1N)OCC=O 34a_100000743429_200009817547 [0,1,0,0,0,0|2,0,0]=3 1699 B12R1.25 Cc1cccc(c1N)OCC=O 7a_100000743429_200015260668 [0,1,0,0,0,0|2,0,0]=3 1700 B12R1.25 Cc1cccc(c1N)OCCF 34a_100000743429_100011217306 [0,1,0,0,0,0|2,0,1]=4 1701 B12R1.25 Cc1cccc(c1N)OCCF 7a_100000743429_100011217306 [0,1,0,0,0,0|2,0,1]=4 1702 B12R1.25 Cc1cccc(c1N)OCCO 34a_100000743429_100000211926 [0,1,0,0,0,0|2,0,1]=4 1703 B12R1.25 Cc1cccc(c1N)OCCO 7a_100000743429_100000211926 [0,1,0,0,0,0|2,0,1]=4 1704 B12R1.25 Cc1cccc(c1N)SCC#N 62a_100011215382_100011834072 [0,1,0,0,0,0|2,0,1]=4 1705 B12R1.25 Cc1cccc(c1N)SCC#N 62a_100011834072_100011215382 [0,1,0,0,0,0|2,0,1]=4 1706 B12R1.25 Cc1cccc(c1N)SCC=O 62a_100011834072_200015260668 [0,1,0,0,0,0|2,0,0]=3 1707 B12R1.25 Cc1cccc(c1N)SCC=O 62a_200015260668_100011834072 [0,1,0,0,0,0|2,0,0]=3 1708 B12R1.25 Cc1cccc(c1N)SCCF 62a_100011217306_100011834072 [0,1,0,0,0,0|2,0,1]=4 1709 B12R1.25 Cc1cccc(c1N)SCCF 62a_100011834072_100011217306 [0,1,0,0,0,0|2,0,1]=4 1710 B12R1.25 Cc1cccc(c1N)SCCO 62a_100000211926_100011834072 [0,1,0,0,0,0|2,0,1]=4 1711 B12R1.25 Cc1cccc(c1N)SCCO 62a_100011834072_100000211926 [0,1,0,0,0,0|2,0,1]=4 1712 B12R1.25 Cc1cccc(c1O)CNCF 34a_100020639391_100015361967 [0,1,0,0,0,0|1,0,1]=3 1713 B12R1.25 Cc1cccc(c1O)NCC=O 34a_100000756359_200009817547 [0,1,0,0,0,0|1,0,0]=2 1714 B12R1.25 Cc1cccc(c1O)NCCF 34a_100000756359_100011217306 [0,1,0,0,0,0|1,0,1]=3 1715 B12R1.25 Cc1cccc(c1O)NCCO 34a_100000756359_100000211926 [0,1,0,0,0,0|1,0,1]=3 1716 B12R1.25 Cc1cccc(c1O)SCC#N 62a_100009817157_100011215382 [0,1,0,0,0,0|1,0,1]=3 1717 B12R1.25 Cc1cccc(c1O)SCC#N 62a_100011215382_100009817157 [0,1,0,0,0,0|1,0,1]=3 1718 B12R1.25 Cc1cccc(c1O)SCC=O 62a_100009817157_200015260668 [0,1,0,0,0,0|1,0,0]=2 1719 B12R1.25 Cc1cccc(c1O)SCC=O 62a_200015260668_100009817157 [0,1,0,0,0,0|1,0,0]=2 1720 B12R1.25 Cc1cccc(c1O)SCCF 62a_100009817157_100011217306 [0,1,0,0,0,0|1,0,1]=3 1721 B12R1.25 Cc1cccc(c1O)SCCF 62a_100011217306_100009817157 [0,1,0,0,0,0|1,0,1]=3 1722 B12R1.25 Cc1cccc(c1O)SCCO 62a_100000211926_100009817157 [0,1,0,0,0,0|1,0,1]=3 1723 B12R1.25 Cc1cccc(c1O)SCCO 62a_100009817157_100000211926 [0,1,0,0,0,0|1,0,1]=3 1724 B12R1.25 Cc1ccnc(c1Br)OCC=O 34a_100012000493_200009817547 [0,1,0,0,0,0|3,0,0]=4 1725 B12R1.25 Cc1ccnc(c1C)SCC=O 62a_100009847204_200015260668 [0,1,0,0,0,0|3,0,0]=4 1726 B12R1.25 Cc1ccnc(c1C)SCC=O 62a_200015260668_100009847204 [0,1,0,0,0,0|3,0,0]=4 1727 B12R1.25 Cc1ccnc(c1F)SCC=O 62a_100009817629_200015260668 [0,1,0,0,0,0|3,0,0]=4 1728 B12R1.25 Cc1ccnc(c1F)SCC=O 62a_200015260668_100009817629 [0,1,0,0,0,0|3,0,0]=4 1729 B12R1.25 Cc1ccnc(c1N)SCC=O 62a_100000763560_200015260668 [0,1,0,0,0,0|3,0,0]=4 1730 B12R1.25 Cc1ccnc(c1N)SCC=O 62a_200015260668_100000763560 [0,1,0,0,0,0|3,0,0]=4 1731 B12R1.25 Cc1ccnc(c1O)SCC#N 62a_100011215382_100000696282 [0,1,0,0,0,0|2,0,1]=4 1732 B12R1.25 Cc1ccnc(c1O)SCC=O 62a_200015260668_100000696282 [0,1,0,0,0,0|2,0,0]=3 1733 B12R1.25 Cc1ccnc(c1O)SCCF 62a_100011217306_100000696282 [0,1,0,0,0,0|2,0,1]=4 1734 B12R1.25 Cc1ccnc(c1O)SCCO 62a_100000211926_100000696282 [0,1,0,0,0,0|2,0,1]=4 1735 B12R1.25 Cc1cncc(c1C)SCC=O 62a_100009864703_200015260668 [0,1,0,0,0,0|3,0,0]=4 1736 B12R1.25 Cc1cncc(c1C)SCC=O 62a_200015260668_100009864703 [0,1,0,0,0,0|3,0,0]=4 1737 B12R1.25 Cc1cncc(c1N)SCC=O 62a_100009818025_200015260668 [0,1,0,0,0,0|3,0,0]=4 1738 B12R1.25 Cc1cncc(c1N)SCC=O 62a_200015260668_100009818025 [0,1,0,0,0,0|3,0,0]=4 1739 B12R1.25 Cc1nccc(c1C)SCC=O 62a_100009846815_200015260668 [0,1,0,0,0,0|3,0,0]=4 1740 B12R1.25 Cc1nccc(c1C)SCC=O 62a_200015260668_100009846815 [0,1,0,0,0,0|3,0,0]=4 1741 B12R1.25 Cc1nccc(c1Cl)SCC=O 62a_100000698670_200015260668 [0,1,0,0,0,0|3,0,0]=4 1742 B12R1.25 Cc1nccc(c1Cl)SCC=O 62a_200015260668_100000698670 [0,1,0,0,0,0|3,0,0]=4 1743 B12R1.25 Cc1nccc(c1F)SCC=O 62a_100009849794_200015260668 [0,1,0,0,0,0|3,0,0]=4 1744 B12R1.25 Cc1nccc(c1F)SCC=O 62a_200015260668_100009849794 [0,1,0,0,0,0|3,0,0]=4 1745 B12R1.25 Cc1nccc(c1N)SCC=O 62a_100009885578_200015260668 [0,1,0,0,0,0|3,0,0]=4 1746 B12R1.25 Cc1nccc(c1N)SCC=O 62a_200015260668_100009885578 [0,1,0,0,0,0|3,0,0]=4 1747 B12R1.25 Cn1cccc(c1=O)OCC=O 34a_100000117616_200009817547 [0,1,0,0,0,0|2,0,1]=4 1748 B12R1.25 Cn1cccc(c1=O)OCC=O 7a_100000117616_200015260668 [0,1,0,0,0,0|2,0,1]=4 1749 B12R1.25 Cn1cccc(c1=O)SCC=O 62a_100000687173_200015260668 [0,1,0,0,0,0|2,0,1]=4 1750 B12R1.25 Cn1cccc(c1=O)SCC=O 62a_200015260668_100000687173 [0,1,0,0,0,0|2,0,1]=4 1751 B12R1.25 N#CCSc1cccc(c1O)Br 62a_100010084509_100011215382 [0,1,0,0,0,0|2,0,1]=4 1752 B12R1.25 N#CCSc1cccc(c1O)Br 62a_100011215382_100010084509 [0,1,0,0,0,0|2,0,1]=4 1753 B12R1.25 N#CCSc1cccc(c1O)Cl 62a_100010202889_100011215382 [0,1,0,0,0,0|2,0,1]=4 1754 B12R1.25 N#CCSc1cccc(c1O)Cl 62a_100011215382_100010202889 [0,1,0,0,0,0|2,0,1]=4 1755 B12R1.25 N#CCSc1cccc(c1O)F 62a_100009813666_100011215382 [0,1,0,0,0,0|2,0,1]=4 1756 B12R1.25 N#CCSc1cccc(c1O)F 62a_100011215382_100009813666 [0,1,0,0,0,0|2,0,1]=4 1757 B12R1.25 N#CCSc1cccc(c1O)N 62a_100011215382_100010084371 [0,1,0,0,0,0|2,0,1]=4 1758 B12R1.25 N#CCSc1cccc(c1O)N 62a_100011934915_100011215382 [0,1,0,0,0,0|2,0,1]=4 1759 B12R1.25 N#CCSc1cccc(c1O)O 62a_100011215382_100009815950 [0,1,0,0,0,0|2,0,1]=4 1760 B12R1.25 Nc1c(cccc1OCC=O)Br 34a_100011934926_200009817547 [0,1,0,0,0,0|3,0,0]=4 1761 B12R1.25 Nc1c(cccc1OCC=O)Br 7a_100011934926_200015260668 [0,1,0,0,0,0|3,0,0]=4 1762 B12R1.25 Nc1c(cccc1OCC=O)Cl 34a_100012022510_200009817547 [0,1,0,0,0,0|3,0,0]=4 1763 B12R1.25 Nc1c(cccc1OCC=O)Cl 7a_100012022510_200015260668 [0,1,0,0,0,0|3,0,0]=4 1764 B12R1.25 Nc1c(cccc1OCC=O)F 34a_100020591140_200009817547 [0,1,0,0,0,0|3,0,0]=4 1765 B12R1.25 Nc1c(cccc1OCC=O)F 7a_100020591140_200015260668 [0,1,0,0,0,0|3,0,0]=4 1766 B12R1.25 Nc1c(cccc1OCC=O)I 34a_200000049512_200009817547 [0,1,0,0,0,0|3,0,0]=4 1767 B12R1.25 Nc1c(cccc1OCC=O)I 7a_200000049512_200015260668 [0,1,0,0,0,0|3,0,0]=4 1768 B12R1.25 Nc1c(cccc1SCC=O)Br 62a_100010146558_200015260668 [0,1,0,0,0,0|3,0,0]=4 1769 B12R1.25 Nc1c(cccc1SCC=O)Br 62a_200015260668_100010146558 [0,1,0,0,0,0|3,0,0]=4 1770 B12R1.25 Nc1c(cccc1SCC=O)Cl 62a_100010190421_200015260668 [0,1,0,0,0,0|3,0,0]=4 1771 B12R1.25 Nc1c(cccc1SCC=O)Cl 62a_200015260668_100010190421 [0,1,0,0,0,0|3,0,0]=4 1772 B12R1.25 Nc1c(cccc1SCC=O)F 62a_100000042321_200015260668 [0,1,0,0,0,0|3,0,0]=4 1773 B12R1.25 Nc1c(cccc1SCC=O)F 62a_200015260668_100000042321 [0,1,0,0,0,0|3,0,0]=4 1774 B12R1.25 Nc1c(cccc1SCC=O)O 62a_200015260668_100011934926 [0,1,0,0,0,0|3,0,0]=4 1775 B12R1.25 Nc1cccc(c1Br)OCC=O 34a_100012183704_200009817547 [0,1,0,0,0,0|3,0,0]=4 1776 B12R1.25 Nc1cccc(c1Br)OCC=O 7a_100012183704_200015260668 [0,1,0,0,0,0|3,0,0]=4 1777 B12R1.25 Nc1cccc(c1Cl)OCC=O 34a_100012002038_200009817547 [0,1,0,0,0,0|3,0,0]=4 1778 B12R1.25 Nc1cccc(c1Cl)OCC=O 7a_100012002038_200015260668 [0,1,0,0,0,0|3,0,0]=4 1779 B12R1.25 Nc1cccc(c1F)SCC=O 62a_100011935091_200015260668 [0,1,0,0,0,0|3,0,0]=4 1780 B12R1.25 Nc1cccc(c1F)SCC=O 62a_200015260668_100011935091 [0,1,0,0,0,0|3,0,0]=4 1781 B12R1.25 Nc1cccc(c1N)OCC=O 34a_100000033209_200009817547 [0,1,0,0,0,0|3,0,0]=4 1782 B12R1.25 Nc1cccc(c1N)SCC=O 62a_100015191791_200015260668 [0,1,0,0,0,0|3,0,0]=4 1783 B12R1.25 Nc1cccc(c1O)SCC=O 62a_100011934915_200015260668 [0,1,0,0,0,0|2,0,0]=3 1784 B12R1.25 Nc1cccc(c1O)SCC=O 62a_200015260668_100010084371 [0,1,0,0,0,0|2,0,0]=3 1785 B12R1.25 Nc1cccc(c1O)SCCF 62a_100011217306_100010084371 [0,1,0,0,0,0|2,0,1]=4 1786 B12R1.25 Nc1cccc(c1O)SCCF 62a_100011934915_100011217306 [0,1,0,0,0,0|2,0,1]=4 1787 B12R1.25 Nc1cccc(c1O)SCCO 62a_100000211926_100010084371 [0,1,0,0,0,0|2,0,1]=4 1788 B12R1.25 Nc1cccc(c1O)SCCO 62a_100011934915_100000211926 [0,1,0,0,0,0|2,0,1]=4 1789 B12R1.25 Nc1ccnc(c1O)SCC=O 62a_200015260668_100009844647 [0,1,0,0,0,0|3,0,0]=4 1790 B12R1.25 Nc1cncc(c1O)SCC=O 62a_100000694263_200015260668 [0,1,0,0,0,0|3,0,0]=4 1791 B12R1.25 Nc1cncc(c1O)SCC=O 62a_200015260668_100000694263 [0,1,0,0,0,0|3,0,0]=4 1792 B12R1.25 O=CCNc1cccc(c1Br)Cl 34a_100000687072_200009817547 [0,1,0,0,0,0|3,0,0]=4 1793 B12R1.25 O=CCNc1cccc(c1Br)F 34a_100011934729_200009817547 [0,1,0,0,0,0|3,0,0]=4 1794 B12R1.25 O=CCNc1cccc(c1Br)O 34a_100012183704_200009817547 [0,1,0,0,0,0|3,0,0]=4 1795 B12R1.25 O=CCNc1cccc(c1Br)O 7a_100012183704_200015260668 [0,1,0,0,0,0|3,0,0]=4 1796 B12R1.25 O=CCNc1cccc(c1Cl)Br 34a_100000687075_200009817547 [0,1,0,0,0,0|3,0,0]=4 1797 B12R1.25 O=CCNc1cccc(c1Cl)Cl 34a_100000185733_200009817547 [0,1,0,0,0,0|3,0,0]=4 1798 B12R1.25 O=CCNc1cccc(c1Cl)F 34a_100000692321_200009817547 [0,1,0,0,0,0|3,0,0]=4 1799 B12R1.25 O=CCNc1cccc(c1Cl)O 34a_100012002038_200009817547 [0,1,0,0,0,0|3,0,0]=4 1800 B12R1.25 O=CCNc1cccc(c1Cl)O 7a_100012002038_200015260668 [0,1,0,0,0,0|3,0,0]=4 1801 B12R1.25 O=CCNc1cccc(c1F)Br 2230a_100011935091_200015260668 [0,1,0,0,0,0|3,0,0]=4 1802 B12R1.25 O=CCNc1cccc(c1F)Br 34a_100011935091_200009817547 [0,1,0,0,0,0|3,0,0]=4 1803 B12R1.25 O=CCNc1cccc(c1F)Cl 2230a_100000199060_200015260668 [0,1,0,0,0,0|3,0,0]=4 1804 B12R1.25 O=CCNc1cccc(c1F)Cl 34a_100000199060_200009817547 [0,1,0,0,0,0|3,0,0]=4 1805 B12R1.25 O=CCNc1cccc(c1F)F 34a_100000743855_200009817547 [0,1,0,0,0,0|3,0,0]=4 1806 B12R1.25 O=CCNc1cccc(c1I)Br 34a_100020590159_200009817547 [0,1,0,0,0,0|3,0,0]=4 1807 B12R1.25 O=CCNc1cccc(c1I)Cl 34a_100000049713_200009817547 [0,1,0,0,0,0|3,0,0]=4 1808 B12R1.25 O=CCNc1cccc(c1I)F 34a_100000690935_200009817547 [0,1,0,0,0,0|3,0,0]=4 1809 B12R1.25 O=CCNc1cccc(c1O)Br 34a_100011934915_200009817547 [0,1,0,0,0,0|2,0,0]=3 1810 B12R1.25 O=CCNc1cccc(c1O)Cl 34a_100000754742_200009817547 [0,1,0,0,0,0|2,0,0]=3 1811 B12R1.25 O=CCNc1cccc(c1O)F 34a_100011934987_200009817547 [0,1,0,0,0,0|2,0,0]=3 1812 B12R1.25 O=CCOc1cccc(c1Br)Br 34a_100010187966_200009817547 [0,1,0,0,0,0|3,0,0]=4 1813 B12R1.25 O=CCOc1cccc(c1Br)Br 7a_100010187966_200015260668 [0,1,0,0,0,0|3,0,0]=4 1814 B12R1.25 O=CCOc1cccc(c1Br)Cl 34a_100012348804_200009817547 [0,1,0,0,0,0|3,0,0]=4 1815 B12R1.25 O=CCOc1cccc(c1Br)Cl 7a_100012348804_200015260668 [0,1,0,0,0,0|3,0,0]=4 1816 B12R1.25 O=CCOc1cccc(c1Br)F 34a_100009820682_200009817547 [0,1,0,0,0,0|3,0,0]=4 1817 B12R1.25 O=CCOc1cccc(c1Br)F 7a_100009820682_200015260668 [0,1,0,0,0,0|3,0,0]=4 1818 B12R1.25 O=CCOc1cccc(c1Br)I 34a_100010187914_200009817547 [0,1,0,0,0,0|3,0,0]=4 1819 B12R1.25 O=CCOc1cccc(c1Br)I 7a_100010187914_200015260668 [0,1,0,0,0,0|3,0,0]=4 1820 B12R1.25 O=CCOc1cccc(c1Cl)Br 34a_100010187913_200009817547 [0,1,0,0,0,0|3,0,0]=4 1821 B12R1.25 O=CCOc1cccc(c1Cl)Br 7a_100010187913_200015260668 [0,1,0,0,0,0|3,0,0]=4 1822 B12R1.25 O=CCOc1cccc(c1Cl)Cl 34a_100000211076_200009817547 [0,1,0,0,0,0|3,0,0]=4 1823 B12R1.25 O=CCOc1cccc(c1Cl)Cl 7a_100000211076_200015260668 [0,1,0,0,0,0|3,0,0]=4 1824 B12R1.25 O=CCOc1cccc(c1Cl)F 34a_100000087408_200009817547 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.25 O=CCOc1cccc(c1Cl)F 7a_100000087408_200015260668 [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.25 O=CCOc1cccc(c1Cl)I 34a_100000049636_200009817547 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.25 O=CCOc1cccc(c1Cl)I 7a_100000049636_200015260668 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.25 O=CCOc1cccc(c1F)Br 34a_100009817021_200009817547 [0,1,0,0,0,0|3,0,0]=4 1829 B12R1.25 O=CCOc1cccc(c1F)Br 7a_100009817021_200015260668 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.25 O=CCOc1cccc(c1F)Cl 34a_100000687438_200009817547 [0,1,0,0,0,0|3,0,0]=4 1831 B12R1.25 O=CCOc1cccc(c1F)Cl 7a_100000687438_200015260668 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.25 O=CCOc1cccc(c1F)F 34a_100000751161_200009817547 [0,1,0,0,0,0|3,0,0]=4 1833 B12R1.25 O=CCOc1cccc(c1F)F 7a_100000751161_200015260668 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.25 O=CCOc1cccc(c1I)Br 34a_100010187912_200009817547 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.25 O=CCOc1cccc(c1I)Br 7a_100010187912_200015260668 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.25 O=CCOc1cccc(c1I)Cl 34a_100000050174_200009817547 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.25 O=CCOc1cccc(c1I)Cl 7a_100000050174_200015260668 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.25 O=CCOc1cccc(c1I)F 34a_100000690913_200009817547 [0,1,0,0,0,0|3,0,0]=4 1839 B12R1.25 O=CCOc1cccc(c1I)F 7a_100000690913_200015260668 [0,1,0,0,0,0|3,0,0]=4 1840 B12R1.25 O=CCSc1cccc(c1Br)Br 62a_100010175083_200015260668 [0,1,0,0,0,0|3,0,0]=4 1841 B12R1.25 O=CCSc1cccc(c1Br)Br 62a_200015260668_100010175083 [0,1,0,0,0,0|3,0,0]=4 1842 B12R1.25 O=CCSc1cccc(c1Br)Cl 62a_100014021842_200015260668 [0,1,0,0,0,0|3,0,0]=4 1843 B12R1.25 O=CCSc1cccc(c1Br)Cl 62a_200015260668_100014021842 [0,1,0,0,0,0|3,0,0]=4 1844 B12R1.25 O=CCSc1cccc(c1Br)F 62a_100010202630_200015260668 [0,1,0,0,0,0|3,0,0]=4 1845 B12R1.25 O=CCSc1cccc(c1Br)F 62a_200015260668_100010202630 [0,1,0,0,0,0|3,0,0]=4 1846 B12R1.25 O=CCSc1cccc(c1Br)O 62a_100010187914_200015260668 [0,1,0,0,0,0|3,0,0]=4 1847 B12R1.25 O=CCSc1cccc(c1Br)O 62a_200015260668_100010187914 [0,1,0,0,0,0|3,0,0]=4 1848 B12R1.25 O=CCSc1cccc(c1Cl)Br 62a_100010142854_200015260668 [0,1,0,0,0,0|3,0,0]=4 1849 B12R1.25 O=CCSc1cccc(c1Cl)Br 62a_200015260668_100010142854 [0,1,0,0,0,0|3,0,0]=4 1850 B12R1.25 O=CCSc1cccc(c1Cl)Cl 62a_100011215384_200015260668 [0,1,0,0,0,0|3,0,0]=4 1851 B12R1.25 O=CCSc1cccc(c1Cl)Cl 62a_200015260668_100011215384 [0,1,0,0,0,0|3,0,0]=4 1852 B12R1.25 O=CCSc1cccc(c1Cl)F 62a_200010234923_200015260668 [0,1,0,0,0,0|3,0,0]=4 1853 B12R1.25 O=CCSc1cccc(c1Cl)F 62a_200015260668_200010234923 [0,1,0,0,0,0|3,0,0]=4 1854 B12R1.25 O=CCSc1cccc(c1Cl)O 62a_200015260668_100000049636 [0,1,0,0,0,0|3,0,0]=4 1855 B12R1.25 O=CCSc1cccc(c1F)Br 62a_100000702267_200015260668 [0,1,0,0,0,0|3,0,0]=4 1856 B12R1.25 O=CCSc1cccc(c1F)Br 62a_200015260668_100000702267 [0,1,0,0,0,0|3,0,0]=4 1857 B12R1.25 O=CCSc1cccc(c1F)Cl 62a_100011217346_200015260668 [0,1,0,0,0,0|3,0,0]=4 1858 B12R1.25 O=CCSc1cccc(c1F)Cl 62a_200015260668_100011217346 [0,1,0,0,0,0|3,0,0]=4 1859 B12R1.25 O=CCSc1cccc(c1F)F 62a_100000694657_200015260668 [0,1,0,0,0,0|3,0,0]=4 1860 B12R1.25 O=CCSc1cccc(c1F)F 62a_200015260668_100000694657 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.25 O=CCSc1cccc(c1F)O 62a_100009817021_200015260668 [0,1,0,0,0,0|3,0,0]=4 1862 B12R1.25 O=CCSc1cccc(c1F)O 62a_200015260668_100009817021 [0,1,0,0,0,0|3,0,0]=4 1863 B12R1.25 O=CCSc1cccc(c1O)Br 62a_100010084509_200015260668 [0,1,0,0,0,0|2,0,0]=3 1864 B12R1.25 O=CCSc1cccc(c1O)Br 62a_200015260668_100010084509 [0,1,0,0,0,0|2,0,0]=3 1865 B12R1.25 O=CCSc1cccc(c1O)Cl 62a_100010202889_200015260668 [0,1,0,0,0,0|2,0,0]=3 1866 B12R1.25 O=CCSc1cccc(c1O)Cl 62a_200015260668_100010202889 [0,1,0,0,0,0|2,0,0]=3 1867 B12R1.25 O=CCSc1cccc(c1O)F 62a_100009813666_200015260668 [0,1,0,0,0,0|2,0,0]=3 1868 B12R1.25 O=CCSc1cccc(c1O)F 62a_200015260668_100009813666 [0,1,0,0,0,0|2,0,0]=3 1869 B12R1.25 O=CCSc1cccc(c1O)O 62a_200015260668_100009815950 [0,1,0,0,0,0|2,0,0]=3 1870 B12R1.25 O=CCSc1ccnc(c1O)Cl 62a_200015260668_100010067911 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.25 O=CCSc1nccc(c1O)F 62a_200015260668_100009867227 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.25 OCCNc1cccc(c1O)Br 34a_100011934915_100000211926 [0,1,0,0,0,0|2,0,1]=4 1873 B12R1.25 OCCNc1cccc(c1O)Cl 34a_100000754742_100000211926 [0,1,0,0,0,0|2,0,1]=4 1874 B12R1.25 OCCNc1cccc(c1O)F 34a_100011934987_100000211926 [0,1,0,0,0,0|2,0,1]=4 1875 B12R1.25 OCCSc1cccc(c1O)Br 62a_100000211926_100010084509 [0,1,0,0,0,0|2,0,1]=4 1876 B12R1.25 OCCSc1cccc(c1O)Br 62a_100010084509_100000211926 [0,1,0,0,0,0|2,0,1]=4 1877 B12R1.25 OCCSc1cccc(c1O)Cl 62a_100000211926_100010202889 [0,1,0,0,0,0|2,0,1]=4 1878 B12R1.25 OCCSc1cccc(c1O)Cl 62a_100010202889_100000211926 [0,1,0,0,0,0|2,0,1]=4 1879 B12R1.25 OCCSc1cccc(c1O)F 62a_100000211926_100009813666 [0,1,0,0,0,0|2,0,1]=4 1880 B12R1.25 OCCSc1cccc(c1O)F 62a_100009813666_100000211926 [0,1,0,0,0,0|2,0,1]=4 1881 B12R1.25 OCCSc1cccc(c1O)O 62a_100000211926_100009815950 [0,1,0,0,0,0|2,0,1]=4 1882 B12R1.25 Oc1c(cccc1NCCF)Br 34a_100011934915_100011217306 [0,1,0,0,0,0|2,0,1]=4 1883 B12R1.25 Oc1c(cccc1NCCF)Cl 34a_100000754742_100011217306 [0,1,0,0,0,0|2,0,1]=4 1884 B12R1.25 Oc1c(cccc1NCCF)F 34a_100011934987_100011217306 [0,1,0,0,0,0|2,0,1]=4 1885 B12R1.25 Oc1c(cccc1SCCF)Br 62a_100010084509_100011217306 [0,1,0,0,0,0|2,0,1]=4 1886 B12R1.25 Oc1c(cccc1SCCF)Br 62a_100011217306_100010084509 [0,1,0,0,0,0|2,0,1]=4 1887 B12R1.25 Oc1c(cccc1SCCF)Cl 62a_100010202889_100011217306 [0,1,0,0,0,0|2,0,1]=4 1888 B12R1.25 Oc1c(cccc1SCCF)Cl 62a_100011217306_100010202889 [0,1,0,0,0,0|2,0,1]=4 1889 B12R1.25 Oc1c(cccc1SCCF)F 62a_100009813666_100011217306 [0,1,0,0,0,0|2,0,1]=4 1890 B12R1.25 Oc1c(cccc1SCCF)F 62a_100011217306_100009813666 [0,1,0,0,0,0|2,0,1]=4 1891 B12R1.25 Oc1cccc(c1O)SCCF 62a_100011217306_100009815950 [0,1,0,0,0,0|2,0,1]=4 1892 B12R1.40 C=C=Cc1cc(cc(c1C)C)N 271570a_100015277604_100010368239 [0,1,0,0,0,0|1,0,2]=4 1893 B12R1.40 C=C=Cc1cc(cc(c1C)C)O 271570a_100015277604_100010068915 [0,1,0,0,0,0|1,0,2]=4 1894 B12R1.40 C=C=Cc1cc(cc(c1F)C)C 271570a_100015277604_200010204574 [0,1,0,0,0,0|1,0,2]=4 1895 B12R1.40 C=C=Cc1cc(cc(c1F)C)F 271570a_100015277604_100010291795 [0,1,0,0,0,0|1,0,2]=4 1896 B12R1.40 C=C=Cc1cc(cc(c1N)C)Br 271570a_100015277604_200000690823 [0,1,0,0,0,0|1,0,2]=4 1897 B12R1.40 C=C=Cc1cc(cc(c1N)C)C 271570a_100015277604_100000688863 [0,1,0,0,0,0|1,0,2]=4 1898 B12R1.40 C=C=Cc1cc(cc(c1N)C)Cl 271570a_100015277604_100012344046 [0,1,0,0,0,0|1,0,2]=4 1899 B12R1.40 C=C=Cc1cc(cc(c1N)C)F 271570a_100015277604_100011216670 [0,1,0,0,0,0|1,0,2]=4 1900 B12R1.40 C=C=Cc1cc(cc(c1O)Br)F 271570a_100015277604_200013085147 [0,1,0,0,0,0|1,0,2]=4 1901 B12R1.40 C=C=Cc1cc(cc(c1O)C)C 271570a_100015277604_100011934984 [0,1,0,0,0,0|0,0,2]=3 1902 B12R1.40 C=C=Cc1cc(cc(c1O)C)Cl 271570a_100015277604_100012343667 [0,1,0,0,0,0|0,0,2]=3 1903 B12R1.40 C=C=Cc1cc(cc(c1O)C)N 271570a_100015277604_100010064301 [0,1,0,0,0,0|0,0,2]=3 1904 B12R1.40 C=C=Cc1cc(cc(c1O)Cl)Cl 271570a_100015277604_200012339341 [0,1,0,0,0,0|1,0,2]=4 1905 B12R1.40 C=C=Cc1cc(cc(c1O)F)Br 271570a_100015277604_100013354677 [0,1,0,0,0,0|1,0,2]=4 1906 B12R1.40 C=C=Cc1cc(cc(c1O)F)C 271570a_100015277604_200135191068 [0,1,0,0,0,0|1,0,2]=4 1907 B12R1.40 C=C=Cc1cc(cc(c1O)F)F 271570a_100015277604_100000688693 [0,1,0,0,0,0|1,0,2]=4 1908 B12R1.40 C=C=Cc1cc(cc(c1O)N)F 271570a_100015277604_200011217456 [0,1,0,0,0,0|1,0,2]=4 1909 B12R1.40 CC=Cc1cc(cc(c1C)C)N 271570a_100016259895_100010368239 [0,1,0,0,0,0|1,0,2]=4 1910 B12R1.40 CC=Cc1cc(cc(c1C)C)O 271570a_100016259895_100010068915 [0,1,0,0,0,0|1,0,2]=4 1911 B12R1.40 CC=Cc1cc(cc(c1F)C)C 271570a_100016259895_200010204574 [0,1,0,0,0,0|1,0,2]=4 1912 B12R1.40 CC=Cc1cc(cc(c1F)C)F 271570a_100016259895_100010291795 [0,1,0,0,0,0|1,0,2]=4 1913 B12R1.40 CC=Cc1cc(cc(c1N)C)Br 271570a_100016259895_200000690823 [0,1,0,0,0,0|1,0,2]=4 1914 B12R1.40 CC=Cc1cc(cc(c1N)C)C 271570a_100016259895_100000688863 [0,1,0,0,0,0|1,0,2]=4 1915 B12R1.40 CC=Cc1cc(cc(c1N)C)Cl 271570a_100016259895_100012344046 [0,1,0,0,0,0|1,0,2]=4 1916 B12R1.40 CC=Cc1cc(cc(c1N)C)F 271570a_100016259895_100011216670 [0,1,0,0,0,0|1,0,2]=4 1917 B12R1.40 CC=Cc1cc(cc(c1O)Br)F 271570a_100016259895_200013085147 [0,1,0,0,0,0|1,0,2]=4 1918 B12R1.40 CC=Cc1cc(cc(c1O)C)C 271570a_100016259895_100011934984 [0,1,0,0,0,0|0,0,2]=3 1919 B12R1.40 CC=Cc1cc(cc(c1O)C)Cl 271570a_100016259895_100012343667 [0,1,0,0,0,0|0,0,2]=3 1920 B12R1.40 CC=Cc1cc(cc(c1O)C)N 271570a_100016259895_100010064301 [0,1,0,0,0,0|0,0,2]=3 1921 B12R1.40 CC=Cc1cc(cc(c1O)Cl)Cl 271570a_100016259895_200012339341 [0,1,0,0,0,0|1,0,2]=4 1922 B12R1.40 CC=Cc1cc(cc(c1O)F)Br 271570a_100016259895_100013354677 [0,1,0,0,0,0|1,0,2]=4 1923 B12R1.40 CC=Cc1cc(cc(c1O)F)C 271570a_100016259895_200135191068 [0,1,0,0,0,0|1,0,2]=4 1924 B12R1.40 CC=Cc1cc(cc(c1O)F)F 271570a_100016259895_100000688693 [0,1,0,0,0,0|1,0,2]=4 1925 B12R1.40 CC=Cc1cc(cc(c1O)N)F 271570a_100016259895_200011217456 [0,1,0,0,0,0|1,0,2]=4 1926 B12R1.40 CCNc1cc(cc(c1O)C)Br 34a_100011825904_100000210202 [0,1,0,0,0,0|1,0,2]=4 1927 B12R1.40 CCNc1cc(cc(c1O)C)Br 7a_100011825904_100000210202 [0,1,0,0,0,0|1,0,2]=4 1928 B12R1.40 CCNc1cc(cc(c1O)C)C 34a_100011216242_100000210202 [0,1,0,0,0,0|1,0,2]=4 1929 B12R1.40 CCNc1cc(cc(c1O)C)C 7a_100011216242_100000210202 [0,1,0,0,0,0|1,0,2]=4 1930 B12R1.40 CCNc1cc(cc(c1O)C)F 34a_100000130126_100000210202 [0,1,0,0,0,0|1,0,2]=4 1931 B12R1.40 CCNc1cc(cc(c1O)C)F 7a_100000130126_100000210202 [0,1,0,0,0,0|1,0,2]=4 1932 B12R1.40 CCSc1cc(cc(c1O)C)C 62a_100000210202_100011934984 [0,1,0,0,0,0|1,0,2]=4 1933 B12R1.40 CCSc1cc(cc(c1O)C)C 62a_100011934984_100000210202 [0,1,0,0,0,0|1,0,2]=4 1934 B12R1.40 CCSc1cc(cc(c1O)C)Cl 62a_100000210202_100012343667 [0,1,0,0,0,0|1,0,2]=4 1935 B12R1.40 CCSc1cc(cc(c1O)C)Cl 62a_100012343667_100000210202 [0,1,0,0,0,0|1,0,2]=4 1936 B12R1.40 CCSc1cc(cc(c1O)C)N 62a_100000210202_100010064301 [0,1,0,0,0,0|1,0,2]=4 1937 B12R1.40 CCSc1cc(cc(c1O)C)N 62a_100010064301_100000210202 [0,1,0,0,0,0|1,0,2]=4 1938 B12R1.40 CNCc1cc(cc(c1Br)C)C 26a_100102657272_100010342985 [0,1,0,0,0,0|2,0,1]=4 1939 B12R1.40 CNCc1cc(cc(c1Cl)C)C 26a_100102657272_100000094344 [0,1,0,0,0,0|2,0,1]=4 1940 B12R1.40 CNCc1cc(cc(c1F)C)Br 207a_100102657272_100010235757 [0,1,0,0,0,0|2,0,1]=4 1941 B12R1.40 CNCc1cc(cc(c1F)C)Br 270004a_106832991635_100010235757 [0,1,0,0,0,0|2,0,1]=4 1942 B12R1.40 CNCc1cc(cc(c1O)Br)Br 2230a_106832991635_200009814416 [0,1,0,0,0,0|2,0,1]=4 1943 B12R1.40 CNCc1cc(cc(c1O)Br)Br 34a_100102657272_200009814416 [0,1,0,0,0,0|2,0,1]=4 1944 B12R1.40 CNCc1cc(cc(c1O)Br)Br 7a_106832991635_200009814416 [0,1,0,0,0,0|2,0,1]=4 1945 B12R1.40 CNCc1cc(cc(c1O)Cl)Cl 270004a_106832991635_100000212163 [0,1,0,0,0,0|2,0,1]=4 1946 B12R1.40 COCc1cc(cc(c1F)C)Br 34a_200010782270_200000210301 [0,1,0,0,0,0|2,0,1]=4 1947 B12R1.40 COCc1cc(cc(c1F)C)Br 7a_200010782270_200000210301 [0,1,0,0,0,0|2,0,1]=4 1948 B12R1.40 COCc1cc(cc(c1O)Br)Br 34a_100138415774_200009814416 [0,1,0,0,0,0|2,0,1]=4 1949 B12R1.40 CSCc1cc(cc(c1O)Br)Br 62a_200000210301_200009814416 [0,1,0,0,0,0|2,0,1]=4 1950 B12R1.40 CSCc1cc(cc(c1O)Br)Br 62a_200009814416_200000210301 [0,1,0,0,0,0|2,0,1]=4 1951 B12R1.40 Cc1cc(c(c(c1)NCF)O)C 34a_100011216242_100015361967 [0,1,0,0,0,0|2,0,1]=4 1952 B12R1.40 Cc1cc(c(c(c1)NCF)O)C 7a_100011216242_100015361967 [0,1,0,0,0,0|2,0,1]=4 1953 B12R1.40 Cc1cc(c(c(c1)SCF)O)C 62a_100011934984_100015361967 [0,1,0,0,0,0|2,0,1]=4 1954 B12R1.40 Cc1cc(c(c(c1)SCF)O)C 62a_100015361967_100011934984 [0,1,0,0,0,0|2,0,1]=4 1955 B12R1.40 Cc1cc(cc(c1F)CO[13CH3])Br 34a_200010782270_200025704644 [0,1,0,0,0,0|2,0,1]=4 1956 B12R1.40 Cc1cc(cc(c1F)CO[13CH3])Br 7a_200010782270_200025704644 [0,1,0,0,0,0|2,0,1]=4 1957 B12R1.40 Cc1cc(cc(c1O)NCF)Br 34a_100011825904_100015361967 [0,1,0,0,0,0|2,0,1]=4 1958 B12R1.40 Cc1cc(cc(c1O)NCF)Br 7a_100011825904_100015361967 [0,1,0,0,0,0|2,0,1]=4 1959 B12R1.40 Cc1cc(cc(c1O)NCF)F 34a_100000130126_100015361967 [0,1,0,0,0,0|2,0,1]=4 1960 B12R1.40 Cc1cc(cc(c1O)NCF)F 7a_100000130126_100015361967 [0,1,0,0,0,0|2,0,1]=4 1961 B12R1.40 Cc1cc(cc(c1O)SCF)Cl 62a_100012343667_100015361967 [0,1,0,0,0,0|2,0,1]=4 1962 B12R1.40 Cc1cc(cc(c1O)SCF)Cl 62a_100015361967_100012343667 [0,1,0,0,0,0|2,0,1]=4 1963 B12R1.40 Cc1cc(cc(c1O)SCF)N 62a_100010064301_100015361967 [0,1,0,0,0,0|2,0,1]=4 1964 B12R1.40 Cc1cc(cc(c1O)SCF)N 62a_100015361967_100010064301 [0,1,0,0,0,0|2,0,1]=4 1965 B12R1.40 [13CH3]SCc1cc(cc(c1O)Br)Br 62a_200009814416_200025704644 [0,1,0,0,0,0|2,0,1]=4 1966 B12R1.40 [13CH3]SCc1cc(cc(c1O)Br)Br 62a_200025704644_200009814416 [0,1,0,0,0,0|2,0,1]=4 1967 B12R1.224 CC(=Cc1cccc(c1C)C)C 271570a_100102525489_100011214922 [0,1,0,0,0,0|1,0,2]=4 1968 B12R1.224 CC(=Cc1cccc(c1Cl)C)C 271570a_100102525489_200012352035 [0,1,0,0,0,0|1,0,2]=4 1969 B12R1.224 CC(=Cc1cccc(c1F)C)C 271570a_100102525489_100000717567 [0,1,0,0,0,0|1,0,2]=4 1970 B12R1.224 CC(=Cc1cccc(c1N)C)C 271570a_100102525489_100011834072 [0,1,0,0,0,0|1,0,2]=4 1971 B12R1.224 CC(=Cc1cccc(c1O)Br)C 271570a_100102525489_100010084509 [0,1,0,0,0,0|1,0,2]=4 1972 B12R1.224 CC(=Cc1cccc(c1O)C)C 271570a_100102525489_100009817157 [0,1,0,0,0,0|0,0,2]=3 1973 B12R1.224 CC(=Cc1cccc(c1O)Cl)C 271570a_100102525489_100010202889 [0,1,0,0,0,0|1,0,2]=4 1974 B12R1.224 CC(=Cc1cccc(c1O)F)C 271570a_100102525489_100009813666 [0,1,0,0,0,0|1,0,2]=4 1975 B12R1.224 CC(=Cc1cccc(c1O)N)C 271570a_100102525489_100011934915 [0,1,0,0,0,0|1,0,2]=4 1976 B12R1.224 CC(=Cc1cccc(c1O)O)C 271570a_100102525489_100009815950 [0,1,0,0,0,0|1,0,2]=4 1977 B12R1.224 CC(=Cc1nccc(c1O)C)C 271570a_100102525489_100000696282 [0,1,0,0,0,0|1,0,2]=4 1978 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100000070787_200012349612 [0,1,0,0,0,0|1,0,1]=3 1979 B12R1.224 CC(=O)Cc1cccc(c1Br)C 1458a_100010147021_200000210301 [0,1,0,0,0,0|1,0,1]=3 1980 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100000070787_100010145525 [0,1,0,0,0,0|2,0,1]=4 1981 B12R1.224 CC(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200000210301 [0,1,0,0,0,0|2,0,1]=4 1982 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100000070787_100012351116 [0,1,0,0,0,0|2,0,1]=4 1983 B12R1.224 CC(=O)Cc1cccc(c1Br)F 1458a_100012356664_200000210301 [0,1,0,0,0,0|2,0,1]=4 1984 B12R1.224 CC(=O)Cc1cccc(c1Br)I 1458a_100000070787_100010254545 [0,1,0,0,0,0|2,0,1]=4 1985 B12R1.224 CC(=O)Cc1cccc(c1C)Br 1458a_100000070787_100000694682 [0,1,0,0,0,0|2,0,1]=4 1986 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100000070787_100011515928 [0,1,0,0,0,0|1,0,1]=3 1987 B12R1.224 CC(=O)Cc1cccc(c1C)C 1458a_100011698479_200000210301 [0,1,0,0,0,0|1,0,1]=3 1988 B12R1.224 CC(=O)Cc1cccc(c1C)Cl 1458a_100000070787_100012186920 [0,1,0,0,0,0|2,0,1]=4 1989 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000035905_200000210301 [0,1,0,0,0,0|2,0,1]=4 1990 B12R1.224 CC(=O)Cc1cccc(c1C)F 1458a_100000070787_100009813626 [0,1,0,0,0,0|2,0,1]=4 1991 B12R1.224 CC(=O)Cc1cccc(c1C)I 1458a_100000070787_100010150147 [0,1,0,0,0,0|2,0,1]=4 1992 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100000070787_100012349491 [0,1,0,0,0,0|2,0,1]=4 1993 B12R1.224 CC(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200000210301 [0,1,0,0,0,0|2,0,1]=4 1994 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000070787_100000720918 [0,1,0,0,0,0|2,0,1]=4 1995 B12R1.224 CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200000210301 [0,1,0,0,0,0|2,0,1]=4 1996 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100000070787_100000696688 [0,1,0,0,0,0|2,0,1]=4 1997 B12R1.224 CC(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200000210301 [0,1,0,0,0,0|2,0,1]=4 1998 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100000070787_100012356507 [0,1,0,0,0,0|2,0,1]=4 1999 B12R1.224 CC(=O)Cc1cccc(c1F)Br 1458a_100011935088_200000210301 [0,1,0,0,0,0|2,0,1]=4 2000 B12R1.224 CC(=O)Cc1cccc(c1F)C 1458a_100000070787_100011216058 [0,1,0,0,0,0|1,0,1]=3 2001 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000070787_100000716733 [0,1,0,0,0,0|2,0,1]=4 2002 B12R1.224 CC(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200000210301 [0,1,0,0,0,0|2,0,1]=4 2003 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000070787_100000217499 [0,1,0,0,0,0|2,0,1]=4 2004 B12R1.224 CC(=O)Cc1cccc(c1F)F 1458a_100000684727_200000210301 [0,1,0,0,0,0|2,0,1]=4 2005 B12R1.224 CC(=O)Cc1cccc(c1I)F 1458a_100000070787_100010149603 [0,1,0,0,0,0|2,0,1]=4 2006 B12R1.224 CC(=O)Cn1cccc(c1=O)C 1458a_100000697016_200000210301 [0,1,0,0,0,0|1,0,2]=4 2007 B12R1.224 CC(=O)Nc1cccc(c1Br)C 11a_100000684715_100015343762 [0,1,0,0,0,0|2,0,1]=4 2008 B12R1.224 CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100015343762 [0,1,0,0,0,0|2,0,1]=4 2009 B12R1.224 CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000070787 [0,1,0,0,0,0|2,0,1]=4 2010 B12R1.224 CC(=O)Nc1cccc(c1C)C 11a_100000210026_100015343762 [0,1,0,0,0,0|2,0,1]=4 2011 B12R1.224 CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100015343762 [0,1,0,0,0,0|2,0,1]=4 2012 B12R1.224 CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000070787 [0,1,0,0,0,0|2,0,1]=4 2013 B12R1.224 CC(=O)Nc1cccc(c1C)C 527a_100000210026_100103153847 [0,1,0,0,0,0|2,0,1]=4 2014 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 11a_100000765562_100015343762 [0,1,0,0,0,0|2,0,1]=4 2015 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100015343762 [0,1,0,0,0,0|2,0,1]=4 2016 B12R1.224 CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000070787 [0,1,0,0,0,0|2,0,1]=4 2017 B12R1.224 CC(=O)Nc1cccc(c1F)C 11a_100000697159_100015343762 [0,1,0,0,0,0|2,0,1]=4 2018 B12R1.224 CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100015343762 [0,1,0,0,0,0|2,0,1]=4 2019 B12R1.224 CC(=O)Nc1cccc(c1F)C 527a_100000697159_100103153847 [0,1,0,0,0,0|2,0,1]=4 2020 B12R1.224 CC(=O)Nc1cccc(c1I)C 11a_100000761888_100015343762 [0,1,0,0,0,0|2,0,1]=4 2021 B12R1.224 CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100015343762 [0,1,0,0,0,0|2,0,1]=4 2022 B12R1.224 CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000070787 [0,1,0,0,0,0|2,0,1]=4 2023 B12R1.224 CC(=O)Nc1cccc(c1O)Br 527a_100011934915_100103153847 [0,1,0,0,0,0|2,0,1]=4 2024 B12R1.224 CC(=O)Nc1cccc(c1O)C 11a_100000756359_100015343762 [0,1,0,0,0,0|1,0,1]=3 2025 B12R1.224 CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100015343762 [0,1,0,0,0,0|1,0,1]=3 2026 B12R1.224 CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000070787 [0,1,0,0,0,0|1,0,1]=3 2027 B12R1.224 CC(=O)Nc1cccc(c1O)C 527a_100000756359_100103153847 [0,1,0,0,0,0|1,0,1]=3 2028 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000070787 [0,1,0,0,0,0|2,0,1]=4 2029 B12R1.224 CC(=O)Nc1cccc(c1O)Cl 527a_100000754742_100103153847 [0,1,0,0,0,0|2,0,1]=4 2030 B12R1.224 CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100015343762 [0,1,0,0,0,0|2,0,1]=4 2031 B12R1.224 CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000070787 [0,1,0,0,0,0|2,0,1]=4 2032 B12R1.224 CC(=O)Nc1cccc(c1O)F 527a_100011934987_100103153847 [0,1,0,0,0,0|2,0,1]=4 2033 B12R1.224 CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100015343762 [0,1,0,0,0,0|2,0,1]=4 2034 B12R1.224 CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000070787 [0,1,0,0,0,0|2,0,1]=4 2035 B12R1.224 CC(=O)Nc1cccc(c1O)I 527a_100010084371_100103153847 [0,1,0,0,0,0|2,0,1]=4 2036 B12R1.224 Cc1c(cccc1CC(=O)[13CH3])F 1458a_100000035905_200025704644 [0,1,0,0,0,0|2,0,1]=4 2037 B12R1.224 Cc1cccc(c1Br)CC(=O)[13CH3] 1458a_100010147021_200025704644 [0,1,0,0,0,0|1,0,1]=3 2038 B12R1.224 Cc1cccc(c1Br)CN(C)C 2230a_100102631434_200012349612 [0,1,0,0,0,0|2,0,1]=4 2039 B12R1.224 Cc1cccc(c1Br)CN(C)C 269982a_100102631434_200012349612 [0,1,0,0,0,0|2,0,1]=4 2040 B12R1.224 Cc1cccc(c1Br)CN(C)C 270004a_100102631434_100012186367 [0,1,0,0,0,0|2,0,1]=4 2041 B12R1.224 Cc1cccc(c1C)CC(=O)[13CH3] 1458a_100011698479_200025704644 [0,1,0,0,0,0|1,0,1]=3 2042 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100000207598_200000210301 [0,1,0,0,0,0|2,0,1]=4 2043 B12R1.224 Cc1cccc(c1C)CN(C)C 2230a_100102631434_100011515928 [0,1,0,0,0,0|2,0,1]=4 2044 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100000207598_200000210301 [0,1,0,0,0,0|2,0,1]=4 2045 B12R1.224 Cc1cccc(c1C)CN(C)C 269982a_100102631434_100011515928 [0,1,0,0,0,0|2,0,1]=4 2046 B12R1.224 Cc1cccc(c1C)CN(C)C 270004a_100102631434_100000229941 [0,1,0,0,0,0|2,0,1]=4 2047 B12R1.224 Cc1cccc(c1C)CN(C)C 34a_100000207598_200000210301 [0,1,0,0,0,0|2,0,1]=4 2048 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 2230a_100000207598_200025704644 [0,1,0,0,0,0|2,0,1]=4 2049 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 269982a_100000207598_200025704644 [0,1,0,0,0,0|2,0,1]=4 2050 B12R1.224 Cc1cccc(c1C)CN(C)[13CH3] 34a_100000207598_200025704644 [0,1,0,0,0,0|2,0,1]=4 2051 B12R1.224 Cc1cccc(c1Cl)CN(C)C 270004a_100102631434_100012017286 [0,1,0,0,0,0|2,0,1]=4 2052 B12R1.224 Cc1cccc(c1F)CN(C)C 2230a_100102631434_100011216058 [0,1,0,0,0,0|2,0,1]=4 2053 B12R1.224 Cc1cccc(c1F)CN(C)C 269982a_100102631434_100011216058 [0,1,0,0,0,0|2,0,1]=4 2054 B12R1.224 Cc1cccc(c1F)CN(C)C 270004a_100102631434_100011219516 [0,1,0,0,0,0|2,0,1]=4 2055 B12R1.224 Cc1cccc(c1O)CC(=O)N 271570a_203496583355_100011096275 [0,1,0,0,0,0|1,0,0]=2 2056 B12R1.224 Cc1cccc(c1O)NC(C)C 34a_100000756359_100000210206 [0,1,0,0,0,0|1,0,2]=4 2057 B12R1.224 Cc1cccc(c1O)SC(C)C 62a_100000210206_100009817157 [0,1,0,0,0,0|1,0,2]=4 2058 B12R1.224 Cc1cccc(c1O)SC(C)C 62a_100009817157_100000210206 [0,1,0,0,0,0|1,0,2]=4 2059 B12R1.224 Cc1cccn(c1=O)CC(=O)[13CH3] 1458a_100000697016_200025704644 [0,1,0,0,0,0|1,0,2]=4 2060 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)Cl 1458a_100010145769_200025704644 [0,1,0,0,0,0|2,0,1]=4 2061 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Br)F 1458a_100012356664_200025704644 [0,1,0,0,0,0|2,0,1]=4 2062 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Br 1458a_100010145770_200025704644 [0,1,0,0,0,0|2,0,1]=4 2063 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)Cl 1458a_100000759314_200025704644 [0,1,0,0,0,0|2,0,1]=4 2064 B12R1.224 [13CH3]C(=O)Cc1cccc(c1Cl)F 1458a_100012001123_200025704644 [0,1,0,0,0,0|2,0,1]=4 2065 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Br 1458a_100011935088_200025704644 [0,1,0,0,0,0|2,0,1]=4 2066 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)Cl 1458a_100000709823_200025704644 [0,1,0,0,0,0|2,0,1]=4 2067 B12R1.224 [13CH3]C(=O)Cc1cccc(c1F)F 1458a_100000684727_200025704644 [0,1,0,0,0,0|2,0,1]=4 2068 B12R1.280 C=C=Cc1cccc(c1Br)CO 271570a_100015277604_100010240205 [0,1,0,0,0,0|1,0,2]=4 2069 B12R1.280 C=C=Cc1cccc(c1C)CN 271570a_100015277604_100000724210 [0,1,0,0,0,0|1,0,2]=4 2070 B12R1.280 C=C=Cc1cccc(c1C)CO 271570a_100015277604_100000694458 [0,1,0,0,0,0|1,0,2]=4 2071 B12R1.280 C=C=Cc1cccc(c1C)OC 271570a_100015277604_100010002647 [0,1,0,0,0,0|1,0,2]=4 2072 B12R1.280 C=C=Cc1cccc(c1Cl)OC 271570a_100015277604_100010147677 [0,1,0,0,0,0|1,0,2]=4 2073 B12R1.280 C=C=Cc1cccc(c1F)CN 271570a_100015277604_100015189953 [0,1,0,0,0,0|1,0,2]=4 2074 B12R1.280 C=C=Cc1cccc(c1F)CO 271570a_100015277604_100011935076 [0,1,0,0,0,0|1,0,2]=4 2075 B12R1.280 C=C=Cc1cccc(c1F)OC 271570a_100015277604_100010185846 [0,1,0,0,0,0|1,0,2]=4 2076 B12R1.280 C=C=Cc1cccc(c1N)CO 271570a_100015277604_100012349457 [0,1,0,0,0,0|1,0,2]=4 2077 B12R1.280 C=C=Cc1cccc(c1N)NC 271570a_100015277604_100000695761 [0,1,0,0,0,0|1,0,2]=4 2078 B12R1.280 C=C=Cc1cccc(c1N)OC 271570a_100015277604_100000708083 [0,1,0,0,0,0|1,0,2]=4 2079 B12R1.280 C=C=Cc1cccc(c1O)C#N 271570a_100015277604_100009817103 [0,1,0,0,0,0|0,0,3]=4 2080 B12R1.280 C=C=Cc1cccc(c1O)C=O 271570a_100015277604_100000737635 [0,1,0,0,0,0|0,0,3]=4 2081 B12R1.280 C=C=Cc1cccc(c1O)CC 271570a_100015277604_200010001580 [0,1,0,0,0,0|0,0,2]=3 2082 B12R1.280 C=C=Cc1cccc(c1O)OC 271570a_100015277604_100000686866 [0,1,0,0,0,0|0,0,2]=3 2083 B12R1.280 CC=Cc1cccc(c1Br)CO 271570a_100016259895_100010240205 [0,1,0,0,0,0|1,0,2]=4 2084 B12R1.280 CC=Cc1cccc(c1C)CN 271570a_100016259895_100000724210 [0,1,0,0,0,0|1,0,2]=4 2085 B12R1.280 CC=Cc1cccc(c1C)CO 271570a_100016259895_100000694458 [0,1,0,0,0,0|1,0,2]=4 2086 B12R1.280 CC=Cc1cccc(c1C)OC 271570a_100016259895_100010002647 [0,1,0,0,0,0|1,0,2]=4 2087 B12R1.280 CC=Cc1cccc(c1Cl)OC 271570a_100016259895_100010147677 [0,1,0,0,0,0|1,0,2]=4 2088 B12R1.280 CC=Cc1cccc(c1F)CN 271570a_100016259895_100015189953 [0,1,0,0,0,0|1,0,2]=4 2089 B12R1.280 CC=Cc1cccc(c1F)CO 271570a_100016259895_100011935076 [0,1,0,0,0,0|1,0,2]=4 2090 B12R1.280 CC=Cc1cccc(c1F)OC 271570a_100016259895_100010185846 [0,1,0,0,0,0|1,0,2]=4 2091 B12R1.280 CC=Cc1cccc(c1N)CO 271570a_100016259895_100012349457 [0,1,0,0,0,0|1,0,2]=4 2092 B12R1.280 CC=Cc1cccc(c1N)NC 271570a_100016259895_100000695761 [0,1,0,0,0,0|1,0,2]=4 2093 B12R1.280 CC=Cc1cccc(c1N)OC 271570a_100016259895_100000708083 [0,1,0,0,0,0|1,0,2]=4 2094 B12R1.280 CC=Cc1cccc(c1O)C#N 271570a_100016259895_100009817103 [0,1,0,0,0,0|0,0,3]=4 2095 B12R1.280 CC=Cc1cccc(c1O)C=O 271570a_100016259895_100000737635 [0,1,0,0,0,0|0,0,3]=4 2096 B12R1.280 CC=Cc1cccc(c1O)CC 271570a_100016259895_200010001580 [0,1,0,0,0,0|0,0,2]=3 2097 B12R1.280 CC=Cc1cccc(c1O)OC 271570a_100016259895_100000686866 [0,1,0,0,0,0|0,0,2]=3 2098 B12R1.280 CCNc1cccc(c1O)OC 34a_100000123586_100000210202 [0,1,0,0,0,0|1,0,2]=4 2099 B12R1.280 CCSc1cccc(c1O)CC 62a_100000210202_200010001580 [0,1,0,0,0,0|1,0,2]=4 2100 B12R1.280 CCSc1cccc(c1O)CC 62a_200010001580_100000210202 [0,1,0,0,0,0|1,0,2]=4 2101 B12R1.280 CCSc1cccc(c1O)OC 62a_100000210202_100000686866 [0,1,0,0,0,0|1,0,2]=4 2102 B12R1.280 CCc1cccc(c1O)SCF 62a_100015361967_200010001580 [0,1,0,0,0,0|2,0,1]=4 2103 B12R1.280 CCc1cccc(c1O)SCF 62a_200010001580_100015361967 [0,1,0,0,0,0|2,0,1]=4 2104 B12R1.280 CNCc1cccc(c1Br)OC 207a_100102657272_100010209554 [0,1,0,0,0,0|2,0,1]=4 2105 B12R1.280 CNCc1cccc(c1Br)OC 26a_100102657272_100010202623 [0,1,0,0,0,0|2,0,1]=4 2106 B12R1.280 CNCc1cccc(c1Br)OC 270004a_106832991635_100010209554 [0,1,0,0,0,0|2,0,1]=4 2107 B12R1.280 CNCc1cccc(c1C)OC 207a_100102657272_100000101217 [0,1,0,0,0,0|2,0,1]=4 2108 B12R1.280 CNCc1cccc(c1C)OC 2230a_106832991635_100009876938 [0,1,0,0,0,0|2,0,1]=4 2109 B12R1.280 CNCc1cccc(c1C)OC 270004a_106832991635_100000101217 [0,1,0,0,0,0|2,0,1]=4 2110 B12R1.280 CNCc1cccc(c1C)OC 34a_100102657272_100009876938 [0,1,0,0,0,0|2,0,1]=4 2111 B12R1.280 CNCc1cccc(c1C)OC 7a_106832991635_100009876938 [0,1,0,0,0,0|2,0,1]=4 2112 B12R1.280 CNCc1cccc(c1Cl)OC 207a_100102657272_100000068750 [0,1,0,0,0,0|2,0,1]=4 2113 B12R1.280 CNCc1cccc(c1Cl)OC 2230a_106832991635_200010147866 [0,1,0,0,0,0|2,0,1]=4 2114 B12R1.280 CNCc1cccc(c1Cl)OC 26a_100102657272_100000087810 [0,1,0,0,0,0|2,0,1]=4 2115 B12R1.280 CNCc1cccc(c1Cl)OC 270004a_106832991635_100000068750 [0,1,0,0,0,0|2,0,1]=4 2116 B12R1.280 CNCc1cccc(c1Cl)OC 34a_100102657272_200010147866 [0,1,0,0,0,0|2,0,1]=4 2117 B12R1.280 CNCc1cccc(c1Cl)OC 7a_106832991635_200010147866 [0,1,0,0,0,0|2,0,1]=4 2118 B12R1.280 CNCc1cccc(c1F)OC 207a_100102657272_100000692048 [0,1,0,0,0,0|2,0,1]=4 2119 B12R1.280 CNCc1cccc(c1F)OC 2230a_106832991635_100011260763 [0,1,0,0,0,0|2,0,1]=4 2120 B12R1.280 CNCc1cccc(c1F)OC 270004a_106832991635_100000692048 [0,1,0,0,0,0|2,0,1]=4 2121 B12R1.280 CNCc1cccc(c1F)OC 34a_100102657272_100011260763 [0,1,0,0,0,0|2,0,1]=4 2122 B12R1.280 CNCc1cccc(c1F)OC 34a_100137345169_200000210301 [0,1,0,0,0,0|2,0,1]=4 2123 B12R1.280 CNCc1cccc(c1F)OC 7a_106832991635_100011260763 [0,1,0,0,0,0|2,0,1]=4 2124 B12R1.280 CNCc1cccc(c1F)SC 62a_114873767014_200000210301 [0,1,0,0,0,0|2,0,1]=4 2125 B12R1.280 CNCc1cccc(c1F)SC 62a_200000210301_114873767014 [0,1,0,0,0,0|2,0,1]=4 2126 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_114873767014_200025704644 [0,1,0,0,0,0|2,0,1]=4 2127 B12R1.280 CNCc1cccc(c1F)S[13CH3] 62a_200025704644_114873767014 [0,1,0,0,0,0|2,0,1]=4 2128 B12R1.280 COCc1cccc(c1Br)OC 34a_100010146792_200000210301 [0,1,0,0,0,0|2,0,1]=4 2129 B12R1.280 COCc1cccc(c1Br)OC 7a_100010146792_200000210301 [0,1,0,0,0,0|2,0,1]=4 2130 B12R1.280 COCc1cccc(c1C)OC 34a_100009871736_200000210301 [0,1,0,0,0,0|2,0,1]=4 2131 B12R1.280 COCc1cccc(c1C)OC 34a_100138415774_100009876938 [0,1,0,0,0,0|2,0,1]=4 2132 B12R1.280 COCc1cccc(c1C)OC 7a_100009871736_200000210301 [0,1,0,0,0,0|2,0,1]=4 2133 B12R1.280 COCc1cccc(c1C)SC 62a_100102485947_200000210301 [0,1,0,0,0,0|2,0,1]=4 2134 B12R1.280 COCc1cccc(c1C)SC 62a_200000210301_100102485947 [0,1,0,0,0,0|2,0,1]=4 2135 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_100102485947_200025704644 [0,1,0,0,0,0|2,0,1]=4 2136 B12R1.280 COCc1cccc(c1C)S[13CH3] 62a_200025704644_100102485947 [0,1,0,0,0,0|2,0,1]=4 2137 B12R1.280 COCc1cccc(c1Cl)OC 34a_100138415774_200010147866 [0,1,0,0,0,0|2,0,1]=4 2138 B12R1.280 COCc1cccc(c1F)OC 34a_100011935170_200000210301 [0,1,0,0,0,0|2,0,1]=4 2139 B12R1.280 COCc1cccc(c1F)OC 34a_100138415774_100011260763 [0,1,0,0,0,0|2,0,1]=4 2140 B12R1.280 COCc1cccc(c1F)OC 7a_100011935170_200000210301 [0,1,0,0,0,0|2,0,1]=4 2141 B12R1.280 COCc1cccc(c1I)OC 34a_100010236476_200000210301 [0,1,0,0,0,0|2,0,1]=4 2142 B12R1.280 COCc1cccc(c1I)OC 7a_100010236476_200000210301 [0,1,0,0,0,0|2,0,1]=4 2143 B12R1.280 COCc1cccc(c1N)OC 34a_100011999522_200000210301 [0,1,0,0,0,0|2,0,1]=4 2144 B12R1.280 COc1cccc(c1Br)CO[13CH3] 34a_100010146792_200025704644 [0,1,0,0,0,0|2,0,1]=4 2145 B12R1.280 COc1cccc(c1Br)CO[13CH3] 7a_100010146792_200025704644 [0,1,0,0,0,0|2,0,1]=4 2146 B12R1.280 COc1cccc(c1C)CO[13CH3] 34a_100009871736_200025704644 [0,1,0,0,0,0|2,0,1]=4 2147 B12R1.280 COc1cccc(c1C)CO[13CH3] 7a_100009871736_200025704644 [0,1,0,0,0,0|2,0,1]=4 2148 B12R1.280 COc1cccc(c1C)CSC 62a_100009876938_200000210301 [0,1,0,0,0,0|2,0,1]=4 2149 B12R1.280 COc1cccc(c1C)CSC 62a_200000210301_100009876938 [0,1,0,0,0,0|2,0,1]=4 2150 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_100009876938_200025704644 [0,1,0,0,0,0|2,0,1]=4 2151 B12R1.280 COc1cccc(c1C)CS[13CH3] 62a_200025704644_100009876938 [0,1,0,0,0,0|2,0,1]=4 2152 B12R1.280 COc1cccc(c1Cl)CSC 62a_200000210301_200010147866 [0,1,0,0,0,0|2,0,1]=4 2153 B12R1.280 COc1cccc(c1Cl)CSC 62a_200010147866_200000210301 [0,1,0,0,0,0|2,0,1]=4 2154 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200010147866_200025704644 [0,1,0,0,0,0|2,0,1]=4 2155 B12R1.280 COc1cccc(c1Cl)CS[13CH3] 62a_200025704644_200010147866 [0,1,0,0,0,0|2,0,1]=4 2156 B12R1.280 COc1cccc(c1F)CN[13CH3] 34a_100137345169_200025704644 [0,1,0,0,0,0|2,0,1]=4 2157 B12R1.280 COc1cccc(c1F)CO[13CH3] 34a_100011935170_200025704644 [0,1,0,0,0,0|2,0,1]=4 2158 B12R1.280 COc1cccc(c1F)CO[13CH3] 7a_100011935170_200025704644 [0,1,0,0,0,0|2,0,1]=4 2159 B12R1.280 COc1cccc(c1F)CSC 62a_100011260763_200000210301 [0,1,0,0,0,0|2,0,1]=4 2160 B12R1.280 COc1cccc(c1F)CSC 62a_200000210301_100011260763 [0,1,0,0,0,0|2,0,1]=4 2161 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_100011260763_200025704644 [0,1,0,0,0,0|2,0,1]=4 2162 B12R1.280 COc1cccc(c1F)CS[13CH3] 62a_200025704644_100011260763 [0,1,0,0,0,0|2,0,1]=4 2163 B12R1.280 COc1cccc(c1I)CO[13CH3] 34a_100010236476_200025704644 [0,1,0,0,0,0|2,0,1]=4 2164 B12R1.280 COc1cccc(c1I)CO[13CH3] 7a_100010236476_200025704644 [0,1,0,0,0,0|2,0,1]=4 2165 B12R1.280 COc1cccc(c1N)CO[13CH3] 34a_100011999522_200025704644 [0,1,0,0,0,0|2,0,1]=4 2166 B12R1.280 COc1cccc(c1O)NCF 34a_100000123586_100015361967 [0,1,0,0,0,0|2,0,1]=4 2167 B12R1.280 COc1cccc(c1O)SCF 62a_100015361967_100000686866 [0,1,0,0,0,0|2,0,1]=4 2168 B12R1.280 CSc1cccc(c1C)CC#N 62a_100010147028_200000210301 [0,1,0,0,0,0|2,0,1]=4 2169 B12R1.280 CSc1cccc(c1C)CC#N 62a_200000210301_100010147028 [0,1,0,0,0,0|2,0,1]=4 2170 B12R1.280 CSc1cccc(c1C)CCN 62a_100161000114_200000210301 [0,1,0,0,0,0|2,0,1]=4 2171 B12R1.280 CSc1cccc(c1C)CCN 62a_200000210301_100161000114 [0,1,0,0,0,0|2,0,1]=4 2172 B12R1.280 CSc1cccc(c1F)CC#N 62a_100009817020_200000210301 [0,1,0,0,0,0|2,0,1]=4 2173 B12R1.280 CSc1cccc(c1F)CC#N 62a_200000210301_100009817020 [0,1,0,0,0,0|2,0,1]=4 2174 B12R1.280 Cc1c(cccc1S[13CH3])CC#N 62a_100010147028_200025704644 [0,1,0,0,0,0|2,0,1]=4 2175 B12R1.280 Cc1c(cccc1S[13CH3])CC#N 62a_200025704644_100010147028 [0,1,0,0,0,0|2,0,1]=4 2176 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_100161000114_200025704644 [0,1,0,0,0,0|2,0,1]=4 2177 B12R1.280 Cc1c(cccc1S[13CH3])CCN 62a_200025704644_100161000114 [0,1,0,0,0,0|2,0,1]=4 2178 B12R1.280 [13CH3]Sc1cccc(c1F)CC#N 62a_100009817020_200025704644 [0,1,0,0,0,0|2,0,1]=4 2179 B12R1.280 [13CH3]Sc1cccc(c1F)CC#N 62a_200025704644_100009817020 [0,1,0,0,0,0|2,0,1]=4 2180 B12R1.497 C=C=Cc1c(ccc(c1O)F)C 271570a_100015277604_200010223207 [0,1,0,0,0,0|1,0,2]=4 2181 B12R1.497 C=C=Cc1c(ccc(c1O)F)F 271570a_100015277604_100010170822 [0,1,0,0,0,0|1,0,2]=4 2182 B12R1.497 CC=Cc1c(ccc(c1O)F)C 271570a_100016259895_200010223207 [0,1,0,0,0,0|1,0,2]=4 2183 B12R1.497 CC=Cc1c(ccc(c1O)F)F 271570a_100016259895_100010170822 [0,1,0,0,0,0|1,0,2]=4 2184 B12R1.497 CNCc1c(ccc(c1Br)C)Cl 207a_100102657272_200010235751 [0,1,0,0,0,0|2,0,1]=4 2185 B12R1.497 CNCc1c(ccc(c1Br)C)Cl 270004a_106832991635_200010235751 [0,1,0,0,0,0|2,0,1]=4 2186 B12R1.497 CNCc1c(ccc(c1Br)C)F 207a_100102657272_100009817119 [0,1,0,0,0,0|2,0,1]=4 2187 B12R1.497 CNCc1c(ccc(c1Br)C)F 26a_100102657272_200010223207 [0,1,0,0,0,0|2,0,1]=4 2188 B12R1.497 CNCc1c(ccc(c1Br)C)F 270004a_106832991635_100009817119 [0,1,0,0,0,0|2,0,1]=4 2189 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 2230a_106832991635_200010220899 [0,1,0,0,0,0|2,0,1]=4 2190 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 26a_100102657272_200000087117 [0,1,0,0,0,0|2,0,1]=4 2191 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 34a_100102657272_200010220899 [0,1,0,0,0,0|2,0,1]=4 2192 B12R1.497 CNCc1c(ccc(c1Cl)C)Cl 7a_106832991635_200010220899 [0,1,0,0,0,0|2,0,1]=4 2193 B12R1.497 CNCc1c(ccc(c1Cl)C)F 207a_100102657272_100000033498 [0,1,0,0,0,0|2,0,1]=4 2194 B12R1.497 CNCc1c(ccc(c1Cl)C)F 2230a_102235353916_200000210301 [0,1,0,0,0,0|2,0,1]=4 2195 B12R1.497 CNCc1c(ccc(c1Cl)C)F 2230a_106832991635_100009813558 [0,1,0,0,0,0|2,0,1]=4 2196 B12R1.497 CNCc1c(ccc(c1Cl)C)F 26a_100102657272_100000035349 [0,1,0,0,0,0|2,0,1]=4 2197 B12R1.497 CNCc1c(ccc(c1Cl)C)F 270004a_106832991635_100000033498 [0,1,0,0,0,0|2,0,1]=4 2198 B12R1.497 CNCc1c(ccc(c1Cl)C)F 34a_100102657272_100009813558 [0,1,0,0,0,0|2,0,1]=4 2199 B12R1.497 CNCc1c(ccc(c1Cl)C)F 34a_102235353916_200000210301 [0,1,0,0,0,0|2,0,1]=4 2200 B12R1.497 CNCc1c(ccc(c1Cl)C)F 7a_106832991635_100009813558 [0,1,0,0,0,0|2,0,1]=4 2201 B12R1.497 CNCc1c(ccc(c1F)C)Br 207a_100102657272_100010240314 [0,1,0,0,0,0|2,0,1]=4 2202 B12R1.497 CNCc1c(ccc(c1F)C)Br 26a_100102657272_100000722096 [0,1,0,0,0,0|2,0,1]=4 2203 B12R1.497 CNCc1c(ccc(c1F)C)Br 270004a_106832991635_100010240314 [0,1,0,0,0,0|2,0,1]=4 2204 B12R1.497 CNCc1c(ccc(c1F)C)Cl 207a_100102657272_100000039034 [0,1,0,0,0,0|2,0,1]=4 2205 B12R1.497 CNCc1c(ccc(c1F)C)Cl 2230a_100000039309_200000210301 [0,1,0,0,0,0|2,0,1]=4 2206 B12R1.497 CNCc1c(ccc(c1F)C)Cl 2230a_106832991635_100009813557 [0,1,0,0,0,0|2,0,1]=4 2207 B12R1.497 CNCc1c(ccc(c1F)C)Cl 270004a_106832991635_100000039034 [0,1,0,0,0,0|2,0,1]=4 2208 B12R1.497 CNCc1c(ccc(c1F)C)Cl 34a_100000039309_200000210301 [0,1,0,0,0,0|2,0,1]=4 2209 B12R1.497 CNCc1c(ccc(c1F)C)Cl 34a_100102657272_100009813557 [0,1,0,0,0,0|2,0,1]=4 2210 B12R1.497 CNCc1c(ccc(c1F)C)Cl 7a_106832991635_100009813557 [0,1,0,0,0,0|2,0,1]=4 2211 B12R1.497 CNCc1c(ccc(c1F)C)F 207a_100102657272_100011217914 [0,1,0,0,0,0|2,0,1]=4 2212 B12R1.497 CNCc1c(ccc(c1F)C)F 2230a_106354213922_200000210301 [0,1,0,0,0,0|2,0,1]=4 2213 B12R1.497 CNCc1c(ccc(c1F)C)F 2230a_106832991635_100011217880 [0,1,0,0,0,0|2,0,1]=4 2214 B12R1.497 CNCc1c(ccc(c1F)C)F 270004a_106832991635_100011217914 [0,1,0,0,0,0|2,0,1]=4 2215 B12R1.497 CNCc1c(ccc(c1F)C)F 34a_100102657272_100011217880 [0,1,0,0,0,0|2,0,1]=4 2216 B12R1.497 CNCc1c(ccc(c1F)C)F 34a_106354213922_200000210301 [0,1,0,0,0,0|2,0,1]=4 2217 B12R1.497 CNCc1c(ccc(c1F)C)F 7a_106832991635_100011217880 [0,1,0,0,0,0|2,0,1]=4 2218 B12R1.497 COCc1c(ccc(c1Br)C)F 34a_100010365568_200000210301 [0,1,0,0,0,0|2,0,1]=4 2219 B12R1.497 COCc1c(ccc(c1Br)C)F 7a_100010365568_200000210301 [0,1,0,0,0,0|2,0,1]=4 2220 B12R1.497 COCc1c(ccc(c1Cl)C)Cl 34a_100009871603_200000210301 [0,1,0,0,0,0|2,0,1]=4 2221 B12R1.497 COCc1c(ccc(c1Cl)C)Cl 34a_100138415774_200010220899 [0,1,0,0,0,0|2,0,1]=4 2222 B12R1.497 COCc1c(ccc(c1Cl)C)Cl 7a_100009871603_200000210301 [0,1,0,0,0,0|2,0,1]=4 2223 B12R1.497 COCc1c(ccc(c1Cl)C)F 34a_100000035582_200000210301 [0,1,0,0,0,0|2,0,1]=4 2224 B12R1.497 COCc1c(ccc(c1Cl)C)F 34a_100138415774_100009813558 [0,1,0,0,0,0|2,0,1]=4 2225 B12R1.497 COCc1c(ccc(c1Cl)C)F 7a_100000035582_200000210301 [0,1,0,0,0,0|2,0,1]=4 2226 B12R1.497 COCc1c(ccc(c1F)C)Cl 34a_100000038635_200000210301 [0,1,0,0,0,0|2,0,1]=4 2227 B12R1.497 COCc1c(ccc(c1F)C)Cl 34a_100138415774_100009813557 [0,1,0,0,0,0|2,0,1]=4 2228 B12R1.497 COCc1c(ccc(c1F)C)Cl 7a_100000038635_200000210301 [0,1,0,0,0,0|2,0,1]=4 2229 B12R1.497 COCc1c(ccc(c1F)C)F 34a_100011216594_200000210301 [0,1,0,0,0,0|2,0,1]=4 2230 B12R1.497 COCc1c(ccc(c1F)C)F 34a_100138415774_100011217880 [0,1,0,0,0,0|2,0,1]=4 2231 B12R1.497 COCc1c(ccc(c1F)C)F 7a_100011216594_200000210301 [0,1,0,0,0,0|2,0,1]=4 2232 B12R1.497 CSCc1c(ccc(c1Cl)C)Cl 62a_200000210301_200010220899 [0,1,0,0,0,0|2,0,1]=4 2233 B12R1.497 CSCc1c(ccc(c1Cl)C)Cl 62a_200010220899_200000210301 [0,1,0,0,0,0|2,0,1]=4 2234 B12R1.497 CSCc1c(ccc(c1Cl)C)F 62a_100009813558_200000210301 [0,1,0,0,0,0|2,0,1]=4 2235 B12R1.497 CSCc1c(ccc(c1Cl)C)F 62a_200000210301_100009813558 [0,1,0,0,0,0|2,0,1]=4 2236 B12R1.497 CSCc1c(ccc(c1F)C)Cl 62a_100009813557_200000210301 [0,1,0,0,0,0|2,0,1]=4 2237 B12R1.497 CSCc1c(ccc(c1F)C)Cl 62a_200000210301_100009813557 [0,1,0,0,0,0|2,0,1]=4 2238 B12R1.497 CSCc1c(ccc(c1F)C)F 62a_100011217880_200000210301 [0,1,0,0,0,0|2,0,1]=4 2239 B12R1.497 CSCc1c(ccc(c1F)C)F 62a_200000210301_100011217880 [0,1,0,0,0,0|2,0,1]=4 2240 B12R1.497 Cc1ccc(c(c1Br)CO[13CH3])F 34a_100010365568_200025704644 [0,1,0,0,0,0|2,0,1]=4 2241 B12R1.497 Cc1ccc(c(c1Br)CO[13CH3])F 7a_100010365568_200025704644 [0,1,0,0,0,0|2,0,1]=4 2242 B12R1.497 Cc1ccc(c(c1Cl)CN[13CH3])F 2230a_102235353916_200025704644 [0,1,0,0,0,0|2,0,1]=4 2243 B12R1.497 Cc1ccc(c(c1Cl)CN[13CH3])F 34a_102235353916_200025704644 [0,1,0,0,0,0|2,0,1]=4 2244 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])Cl 34a_100009871603_200025704644 [0,1,0,0,0,0|2,0,1]=4 2245 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])Cl 7a_100009871603_200025704644 [0,1,0,0,0,0|2,0,1]=4 2246 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])F 34a_100000035582_200025704644 [0,1,0,0,0,0|2,0,1]=4 2247 B12R1.497 Cc1ccc(c(c1Cl)CO[13CH3])F 7a_100000035582_200025704644 [0,1,0,0,0,0|2,0,1]=4 2248 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])Cl 62a_200010220899_200025704644 [0,1,0,0,0,0|2,0,1]=4 2249 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])Cl 62a_200025704644_200010220899 [0,1,0,0,0,0|2,0,1]=4 2250 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])F 62a_100009813558_200025704644 [0,1,0,0,0,0|2,0,1]=4 2251 B12R1.497 Cc1ccc(c(c1Cl)CS[13CH3])F 62a_200025704644_100009813558 [0,1,0,0,0,0|2,0,1]=4 2252 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])Cl 2230a_100000039309_200025704644 [0,1,0,0,0,0|2,0,1]=4 2253 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])Cl 34a_100000039309_200025704644 [0,1,0,0,0,0|2,0,1]=4 2254 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])F 2230a_106354213922_200025704644 [0,1,0,0,0,0|2,0,1]=4 2255 B12R1.497 Cc1ccc(c(c1F)CN[13CH3])F 34a_106354213922_200025704644 [0,1,0,0,0,0|2,0,1]=4 2256 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])Cl 34a_100000038635_200025704644 [0,1,0,0,0,0|2,0,1]=4 2257 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])Cl 7a_100000038635_200025704644 [0,1,0,0,0,0|2,0,1]=4 2258 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])F 34a_100011216594_200025704644 [0,1,0,0,0,0|2,0,1]=4 2259 B12R1.497 Cc1ccc(c(c1F)CO[13CH3])F 7a_100011216594_200025704644 [0,1,0,0,0,0|2,0,1]=4 2260 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])Cl 62a_100009813557_200025704644 [0,1,0,0,0,0|2,0,1]=4 2261 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])Cl 62a_200025704644_100009813557 [0,1,0,0,0,0|2,0,1]=4 2262 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])F 62a_100011217880_200025704644 [0,1,0,0,0,0|2,0,1]=4 2263 B12R1.497 Cc1ccc(c(c1F)CS[13CH3])F 62a_200025704644_100011217880 [0,1,0,0,0,0|2,0,1]=4 2264 B12R1.542 C=C=Cc1cccc(c1C#N)C 271570a_100015277604_100009819585 [0,1,0,0,0,0|1,0,2]=4 2265 B12R1.542 C=C=Cc1cccc(c1C=O)C 271570a_100015277604_100000041122 [0,1,0,0,0,0|0,0,3]=4 2266 B12R1.542 C=C=Cc1cccc(c1CO)F 271570a_100015277604_100012355691 [0,1,0,0,0,0|1,0,2]=4 2267 B12R1.542 C=C=Cc1cccc(c1CO)N 271570a_100015277604_100000747656 [0,1,0,0,0,0|1,0,2]=4 2268 B12R1.542 C=C=Cc1cccc(c1OC)Br 271570a_100015277604_100010146560 [0,1,0,0,0,0|1,0,2]=4 2269 B12R1.542 C=C=Cc1cccc(c1OC)C 271570a_100015277604_100010141385 [0,1,0,0,0,0|0,0,2]=3 2270 B12R1.542 C=C=Cc1cccc(c1OC)Cl 271570a_100015277604_100010147678 [0,1,0,0,0,0|1,0,2]=4 2271 B12R1.542 C=C=Cc1cccc(c1OC)F 271570a_100015277604_100009816759 [0,1,0,0,0,0|1,0,2]=4 2272 B12R1.542 C=C=Cc1cccc(c1OC)N 271570a_100015277604_100011935253 [0,1,0,0,0,0|1,0,2]=4 2273 B12R1.542 C=C=Cc1cccc(c1OC)O 271570a_100015277604_100010234590 [0,1,0,0,0,0|1,0,2]=4 2274 B12R1.542 C=C=Cc1ccnc(c1OC)C 271570a_100015277604_100000685116 [0,1,0,0,0,0|1,0,2]=4 2275 B12R1.542 C=CCc1cccc(c1OC)C 34a_200011218211_200000210301 [0,1,0,0,0,0|0,0,0]=1 2276 B12R1.542 C=CCc1cccc(c1OC)C 7a_200011218211_200000210301 [0,1,0,0,0,0|0,0,0]=1 2277 B12R1.542 C=CCc1cccc(c1O[13CH3])C 34a_200011218211_200025704644 [0,1,0,0,0,0|0,0,0]=1 2278 B12R1.542 C=CCc1cccc(c1O[13CH3])C 7a_200011218211_200025704644 [0,1,0,0,0,0|0,0,0]=1 2279 B12R1.542 C=Cc1c(cccc1CC#N)C 271570a_100011290941_100010147024 [0,1,0,0,0,0|2,0,1]=4 2280 B12R1.542 CC=Cc1cccc(c1C#N)C 271570a_100016259895_100009819585 [0,1,0,0,0,0|1,0,2]=4 2281 B12R1.542 CC=Cc1cccc(c1C=O)C 271570a_100016259895_100000041122 [0,1,0,0,0,0|0,0,3]=4 2282 B12R1.542 CC=Cc1cccc(c1CO)F 271570a_100016259895_100012355691 [0,1,0,0,0,0|1,0,2]=4 2283 B12R1.542 CC=Cc1cccc(c1CO)N 271570a_100016259895_100000747656 [0,1,0,0,0,0|1,0,2]=4 2284 B12R1.542 CC=Cc1cccc(c1OC)Br 271570a_100016259895_100010146560 [0,1,0,0,0,0|1,0,2]=4 2285 B12R1.542 CC=Cc1cccc(c1OC)C 271570a_100016259895_100010141385 [0,1,0,0,0,0|0,0,2]=3 2286 B12R1.542 CC=Cc1cccc(c1OC)Cl 271570a_100016259895_100010147678 [0,1,0,0,0,0|1,0,2]=4 2287 B12R1.542 CC=Cc1cccc(c1OC)F 271570a_100016259895_100009816759 [0,1,0,0,0,0|1,0,2]=4 2288 B12R1.542 CC=Cc1cccc(c1OC)N 271570a_100016259895_100011935253 [0,1,0,0,0,0|1,0,2]=4 2289 B12R1.542 CC=Cc1cccc(c1OC)O 271570a_100016259895_100010234590 [0,1,0,0,0,0|1,0,2]=4 2290 B12R1.542 CC=Cc1ccnc(c1OC)C 271570a_100016259895_100000685116 [0,1,0,0,0,0|1,0,2]=4 2291 B12R1.542 CCNc1cccc(c1OC)C 34a_100012017360_100000210202 [0,1,0,0,0,0|1,0,2]=4 2292 B12R1.542 CCOc1cccc(c1CO)C 34a_200009874777_100000210202 [0,1,0,0,0,0|1,0,2]=4 2293 B12R1.542 CCOc1cccc(c1CO)C 7a_200009874777_100000210202 [0,1,0,0,0,0|1,0,2]=4 2294 B12R1.542 CCSc1cccc(c1OC)C 62a_100000210202_100010141385 [0,1,0,0,0,0|1,0,2]=4 2295 B12R1.542 CCSc1cccc(c1OC)C 62a_100010141385_100000210202 [0,1,0,0,0,0|1,0,2]=4 2296 B12R1.542 CNCc1cccc(c1OC)Br 207a_100102657272_100000692592 [0,1,0,0,0,0|2,0,1]=4 2297 B12R1.542 CNCc1cccc(c1OC)Br 2230a_106832991635_100011470457 [0,1,0,0,0,0|2,0,1]=4 2298 B12R1.542 CNCc1cccc(c1OC)Br 26a_100102657272_100010234590 [0,1,0,0,0,0|2,0,1]=4 2299 B12R1.542 CNCc1cccc(c1OC)Br 270004a_106832991635_100000692592 [0,1,0,0,0,0|2,0,1]=4 2300 B12R1.542 CNCc1cccc(c1OC)Br 34a_100102657272_100011470457 [0,1,0,0,0,0|2,0,1]=4 2301 B12R1.542 CNCc1cccc(c1OC)Br 7a_106832991635_100011470457 [0,1,0,0,0,0|2,0,1]=4 2302 B12R1.542 CNCc1cccc(c1OC)C 207a_100102657272_100011361485 [0,1,0,0,0,0|1,0,1]=3 2303 B12R1.542 CNCc1cccc(c1OC)C 2230a_106832991635_100012349798 [0,1,0,0,0,0|1,0,1]=3 2304 B12R1.542 CNCc1cccc(c1OC)C 270004a_106832991635_100011361485 [0,1,0,0,0,0|1,0,1]=3 2305 B12R1.542 CNCc1cccc(c1OC)C 34a_100102657272_100012349798 [0,1,0,0,0,0|1,0,1]=3 2306 B12R1.542 CNCc1cccc(c1OC)C 7a_106832991635_100012349798 [0,1,0,0,0,0|1,0,1]=3 2307 B12R1.542 CNCc1cccc(c1OC)Cl 207a_100102657272_100011466644 [0,1,0,0,0,0|2,0,1]=4 2308 B12R1.542 CNCc1cccc(c1OC)Cl 26a_100102657272_200009886253 [0,1,0,0,0,0|2,0,1]=4 2309 B12R1.542 CNCc1cccc(c1OC)Cl 270004a_106832991635_100011466644 [0,1,0,0,0,0|2,0,1]=4 2310 B12R1.542 CNCc1cccc(c1OC)F 207a_100102657272_100011830294 [0,1,0,0,0,0|2,0,1]=4 2311 B12R1.542 CNCc1cccc(c1OC)F 270004a_106832991635_100011830294 [0,1,0,0,0,0|2,0,1]=4 2312 B12R1.542 CNCc1cccc(c1OC)F 34a_100137345168_200000210301 [0,1,0,0,0,0|2,0,1]=4 2313 B12R1.542 COCc1cccc(c1OC)Br 34a_100000704359_200000210301 [0,1,0,0,0,0|2,0,1]=4 2314 B12R1.542 COCc1cccc(c1OC)Br 34a_100138415774_100011470457 [0,1,0,0,0,0|2,0,1]=4 2315 B12R1.542 COCc1cccc(c1OC)Br 7a_100000704359_200000210301 [0,1,0,0,0,0|2,0,1]=4 2316 B12R1.542 COCc1cccc(c1OC)C 34a_100012184769_200000210301 [0,1,0,0,0,0|1,0,1]=3 2317 B12R1.542 COCc1cccc(c1OC)C 34a_100138415774_100012349798 [0,1,0,0,0,0|1,0,1]=3 2318 B12R1.542 COCc1cccc(c1OC)C 7a_100012184769_200000210301 [0,1,0,0,0,0|1,0,1]=3 2319 B12R1.542 COCc1cccc(c1OC)F 34a_100011830279_200000210301 [0,1,0,0,0,0|2,0,1]=4 2320 B12R1.542 COCc1cccc(c1OC)F 7a_100011830279_200000210301 [0,1,0,0,0,0|2,0,1]=4 2321 B12R1.542 COc1c(cccc1CC#N)O 271570a_203496583355_100010146820 [0,1,0,0,0,0|2,0,1]=4 2322 B12R1.542 COc1c(cccc1CN[13CH3])F 34a_100137345168_200025704644 [0,1,0,0,0,0|2,0,1]=4 2323 B12R1.542 COc1c(cccc1CO[13CH3])Br 34a_100000704359_200025704644 [0,1,0,0,0,0|2,0,1]=4 2324 B12R1.542 COc1c(cccc1CO[13CH3])Br 7a_100000704359_200025704644 [0,1,0,0,0,0|2,0,1]=4 2325 B12R1.542 COc1c(cccc1CO[13CH3])C 34a_100012184769_200025704644 [0,1,0,0,0,0|1,0,1]=3 2326 B12R1.542 COc1c(cccc1CO[13CH3])C 7a_100012184769_200025704644 [0,1,0,0,0,0|1,0,1]=3 2327 B12R1.542 COc1c(cccc1CO[13CH3])F 34a_100011830279_200025704644 [0,1,0,0,0,0|2,0,1]=4 2328 B12R1.542 COc1c(cccc1CO[13CH3])F 7a_100011830279_200025704644 [0,1,0,0,0,0|2,0,1]=4 2329 B12R1.542 COc1c(cccc1CSC)Br 62a_100011470457_200000210301 [0,1,0,0,0,0|2,0,1]=4 2330 B12R1.542 COc1c(cccc1CSC)Br 62a_200000210301_100011470457 [0,1,0,0,0,0|2,0,1]=4 2331 B12R1.542 COc1c(cccc1CSC)C 62a_100012349798_200000210301 [0,1,0,0,0,0|1,0,1]=3 2332 B12R1.542 COc1c(cccc1CSC)C 62a_200000210301_100012349798 [0,1,0,0,0,0|1,0,1]=3 2333 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_100011470457_200025704644 [0,1,0,0,0,0|2,0,1]=4 2334 B12R1.542 COc1c(cccc1CS[13CH3])Br 62a_200025704644_100011470457 [0,1,0,0,0,0|2,0,1]=4 2335 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_100012349798_200025704644 [0,1,0,0,0,0|1,0,1]=3 2336 B12R1.542 COc1c(cccc1CS[13CH3])C 62a_200025704644_100012349798 [0,1,0,0,0,0|1,0,1]=3 2337 B12R1.542 COc1c(cccc1NCF)C 34a_100012017360_100015361967 [0,1,0,0,0,0|2,0,1]=4 2338 B12R1.542 COc1c(cccc1SCF)C 62a_100010141385_100015361967 [0,1,0,0,0,0|2,0,1]=4 2339 B12R1.542 COc1c(cccc1SCF)C 62a_100015361967_100010141385 [0,1,0,0,0,0|2,0,1]=4 2340 B12R1.542 CSc1c(cccc1CC#N)C 62a_100010147024_200000210301 [0,1,0,0,0,0|1,1,1]=4 2341 B12R1.542 CSc1c(cccc1CC#N)C 62a_200000210301_100010147024 [0,1,0,0,0,0|1,1,1]=4 2342 B12R1.542 Cc1cccc(c1CO)OCF 34a_200009874777_100015361967 [0,1,0,0,0,0|2,0,1]=4 2343 B12R1.542 Cc1cccc(c1CO)OCF 7a_200009874777_100015361967 [0,1,0,0,0,0|2,0,1]=4 2344 B12R1.542 Cc1cccc(c1S[13CH3])CC#N 62a_100010147024_200025704644 [0,1,0,0,0,0|1,1,1]=4 2345 B12R1.542 Cc1cccc(c1S[13CH3])CC#N 62a_200025704644_100010147024 [0,1,0,0,0,0|1,1,1]=4 2346 B12R1.544 C=C=Cc1ccc(c(c1C)C)Br 271570a_100015277604_200010185626 [0,1,0,0,0,0|1,0,2]=4 2347 B12R1.544 C=C=Cc1ccc(c(c1C)C)F 271570a_100015277604_100009816033 [0,1,0,0,0,0|1,0,2]=4 2348 B12R1.544 C=C=Cc1ccc(c(c1C)C)N 271570a_100015277604_100009816967 [0,1,0,0,0,0|1,0,2]=4 2349 B12R1.544 C=C=Cc1ccc(c(c1C)C)O 271570a_100015277604_100012353674 [0,1,0,0,0,0|1,0,2]=4 2350 B12R1.544 C=C=Cc1ccc(c(c1Cl)C)Br 271570a_100015277604_100055076181 [0,1,0,0,0,0|1,0,2]=4 2351 B12R1.544 C=C=Cc1ccc(c(c1Cl)C)Cl 271570a_100015277604_100010730154 [0,1,0,0,0,0|1,0,2]=4 2352 B12R1.544 C=C=Cc1ccc(c(c1F)C)C 271570a_100015277604_200015555822 [0,1,0,0,0,0|1,0,2]=4 2353 B12R1.544 C=C=Cc1ccc(c(c1F)C)F 271570a_100015277604_100009815987 [0,1,0,0,0,0|1,0,2]=4 2354 B12R1.544 C=C=Cc1ccc(c(c1F)C)N 271570a_100015277604_100010208198 [0,1,0,0,0,0|1,0,2]=4 2355 B12R1.544 C=C=Cc1ccc(c(c1F)C)O 271570a_100015277604_100010390934 [0,1,0,0,0,0|1,0,2]=4 2356 B12R1.544 C=C=Cc1ccc(c(c1N)C)F 271570a_100015277604_100011009917 [0,1,0,0,0,0|1,0,2]=4 2357 B12R1.544 C=C=Cc1ccc(c(c1O)C)F 271570a_100015277604_200010391124 [0,1,0,0,0,0|0,0,2]=3 2358 B12R1.544 C=C=Cc1ccc(c(c1O)F)C 271570a_100015277604_100000722096 [0,1,0,0,0,0|1,0,2]=4 2359 B12R1.544 C=C=Cc1ccc(c(c1O)F)F 271570a_100015277604_100010243909 [0,1,0,0,0,0|1,0,2]=4 2360 B12R1.544 CC=Cc1ccc(c(c1C)C)Br 271570a_100016259895_200010185626 [0,1,0,0,0,0|1,0,2]=4 2361 B12R1.544 CC=Cc1ccc(c(c1C)C)F 271570a_100016259895_100009816033 [0,1,0,0,0,0|1,0,2]=4 2362 B12R1.544 CC=Cc1ccc(c(c1C)C)N 271570a_100016259895_100009816967 [0,1,0,0,0,0|1,0,2]=4 2363 B12R1.544 CC=Cc1ccc(c(c1C)C)O 271570a_100016259895_100012353674 [0,1,0,0,0,0|1,0,2]=4 2364 B12R1.544 CC=Cc1ccc(c(c1Cl)C)Br 271570a_100016259895_100055076181 [0,1,0,0,0,0|1,0,2]=4 2365 B12R1.544 CC=Cc1ccc(c(c1Cl)C)Cl 271570a_100016259895_100010730154 [0,1,0,0,0,0|1,0,2]=4 2366 B12R1.544 CC=Cc1ccc(c(c1F)C)C 271570a_100016259895_200015555822 [0,1,0,0,0,0|1,0,2]=4 2367 B12R1.544 CC=Cc1ccc(c(c1F)C)F 271570a_100016259895_100009815987 [0,1,0,0,0,0|1,0,2]=4 2368 B12R1.544 CC=Cc1ccc(c(c1F)C)N 271570a_100016259895_100010208198 [0,1,0,0,0,0|1,0,2]=4 2369 B12R1.544 CC=Cc1ccc(c(c1F)C)O 271570a_100016259895_100010390934 [0,1,0,0,0,0|1,0,2]=4 2370 B12R1.544 CC=Cc1ccc(c(c1N)C)F 271570a_100016259895_100011009917 [0,1,0,0,0,0|1,0,2]=4 2371 B12R1.544 CC=Cc1ccc(c(c1O)C)F 271570a_100016259895_200010391124 [0,1,0,0,0,0|0,0,2]=3 2372 B12R1.544 CC=Cc1ccc(c(c1O)F)C 271570a_100016259895_100000722096 [0,1,0,0,0,0|1,0,2]=4 2373 B12R1.544 CC=Cc1ccc(c(c1O)F)F 271570a_100016259895_100010243909 [0,1,0,0,0,0|1,0,2]=4 2374 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_100000210202_200010391124 [0,1,0,0,0,0|1,0,2]=4 2375 B12R1.544 CCSc1ccc(c(c1O)C)F 62a_200010391124_100000210202 [0,1,0,0,0,0|1,0,2]=4 2376 B12R1.544 CNCc1ccc(c(c1Cl)C)Br 26a_100102657272_100021574527 [0,1,0,0,0,0|2,0,1]=4 2377 B12R1.544 CNCc1ccc(c(c1Cl)C)F 207a_100102657272_100009872231 [0,1,0,0,0,0|2,0,1]=4 2378 B12R1.544 CNCc1ccc(c(c1Cl)C)F 270004a_106832991635_100009872231 [0,1,0,0,0,0|2,0,1]=4 2379 B12R1.544 CNCc1ccc(c(c1F)C)Br 207a_100102657272_100015546853 [0,1,0,0,0,0|2,0,1]=4 2380 B12R1.544 CNCc1ccc(c(c1F)C)Br 270004a_106832991635_100015546853 [0,1,0,0,0,0|2,0,1]=4 2381 B12R1.544 CNCc1ccc(c(c1F)C)F 207a_100102657272_100000068945 [0,1,0,0,0,0|2,0,1]=4 2382 B12R1.544 CNCc1ccc(c(c1F)C)F 2230a_200000062210_200000210301 [0,1,0,0,0,0|2,0,1]=4 2383 B12R1.544 CNCc1ccc(c(c1F)C)F 270004a_106832991635_100000068945 [0,1,0,0,0,0|2,0,1]=4 2384 B12R1.544 CNCc1ccc(c(c1F)C)F 34a_200000062210_200000210301 [0,1,0,0,0,0|2,0,1]=4 2385 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 2230a_200000062210_200025704644 [0,1,0,0,0,0|2,0,1]=4 2386 B12R1.544 Cc1c(ccc(c1F)CN[13CH3])F 34a_200000062210_200025704644 [0,1,0,0,0,0|2,0,1]=4 2387 B12R1.544 Cc1c(ccc(c1O)SCF)F 62a_100015361967_200010391124 [0,1,0,0,0,0|2,0,1]=4 2388 B12R1.544 Cc1c(ccc(c1O)SCF)F 62a_200010391124_100015361967 [0,1,0,0,0,0|2,0,1]=4 2389 B12R2.81 Cc1cccc(c1C)C2CC2 271570a_100011220607_100011214922 [0,0,0,1,0,0|1,0,2]=4 2390 B12R2.81 Cc1cccc(c1Cl)C2CC2 271570a_100011220607_200012352035 [0,0,0,1,0,0|1,0,2]=4 2391 B12R2.81 Cc1cccc(c1F)C2CC2 271570a_100011220607_100000717567 [0,0,0,1,0,0|1,0,2]=4 2392 B12R2.81 Cc1cccc(c1N)C2CC2 271570a_100011220607_100011834072 [0,0,0,1,0,0|1,0,2]=4 2393 B12R2.81 Cc1cccc(c1O)C2CC2 271570a_100011220607_100009817157 [0,0,0,1,0,0|0,0,2]=3 2394 B12R2.81 Cc1ccnc(c1O)C2CC2 271570a_100011220607_100000696282 [0,0,0,1,0,0|1,0,2]=4 2395 B12R2.81 Nc1cccc(c1O)C2CC2 271570a_100011220607_100011934915 [0,0,0,1,0,0|1,0,2]=4 2396 B12R2.81 Oc1c(cccc1C2CC2)Br 271570a_100011220607_100010084509 [0,0,0,1,0,0|1,0,2]=4 2397 B12R2.81 Oc1c(cccc1C2CC2)Cl 271570a_100011220607_100010202889 [0,0,0,1,0,0|1,0,2]=4 2398 B12R2.81 Oc1c(cccc1C2CC2)F 271570a_100011220607_100009813666 [0,0,0,1,0,0|1,0,2]=4 2399 B12R2.81 Oc1cccc(c1O)C2CC2 271570a_100011220607_100009815950 [0,0,0,1,0,0|1,0,2]=4 2400 B12R2.81 Oc1cccc(c1O)C2CC2 271570a_203496583355_100010664954 [0,0,0,1,0,0|1,0,2]=4 2401 B12R2.82 Cc1c(ccc2c1[nH]cc2)O 271570a_203496583355_100009816929 [0,0,0,1,0,0|3,0,0]=4 2402 B12R2.82 Cc1ccc2[nH]ccc2c1O 271570a_203496583355_100010248896 [0,0,0,1,0,0|1,0,1]=3 2403 B12R2.82 Cc1ccc2[nH]ncc2c1O 271570a_203496583355_100009817104 [0,0,0,1,0,0|2,0,1]=4 2404 B12R2.82 Cc1ccc2cc[nH]c2c1O 271570a_203496583355_100010717004 [0,0,0,1,0,0|1,0,0]=2 2405 B12R2.82 Cc1ccc2cn[nH]c2c1O 271570a_203496583355_100009817202 [0,0,0,1,0,0|2,0,0]=3 2406 B12R2.82 Cc1ccc2nccn2c1O 271570a_203496583355_100010765079 [0,0,0,1,0,0|2,0,1]=4 2407 B12R2.82 Cc1cnc2[nH]ccc2c1O 271570a_203496583355_100000097406 [0,0,0,1,0,0|2,0,1]=4 2408 B12R2.82 Cc1ncc2[nH]ccc2c1O 271570a_203496583355_100011015088 [0,0,0,1,0,0|2,0,1]=4 2409 B12R2.82 Nc1ccc2[nH]cnc2c1O 271570a_203496583355_100009816657 [0,0,0,1,0,0|3,0,0]=4 2410 B12R2.82 Nc1ccc2ncsc2c1O 271570a_203496583355_100010007894 [0,0,0,1,0,0|3,0,0]=4 2411 B12R2.82 Nc1ccc2scnc2c1O 271570a_203496583355_100009816736 [0,0,0,1,0,0|3,0,0]=4 2412 B12R2.82 Oc1c(ccc2c1[nH]nc2)F 271570a_203496583355_100010762478 [0,0,0,1,0,0|3,0,0]=4 2413 B12R2.82 Oc1c(ccc2c1cc[nH]2)F 271570a_203496583355_100102525403 [0,0,0,1,0,0|2,0,1]=4 2414 B12R2.82 Oc1c(ccc2c1nc[nH]2)F 271570a_203496583355_200010369618 [0,0,0,1,0,0|3,0,0]=4 2415 B12R2.82 Oc1c(ccc2c1ocn2)F 271570a_203496583355_100010870391 [0,0,0,1,0,0|3,0,0]=4 2416 B12R2.82 Oc1c(cnc2c1[nH]cc2)F 271570a_203496583355_100009883597 [0,0,0,1,0,0|3,0,0]=4 2417 B12R2.82 Oc1ccc2c(c1O)CCC2 271570a_203496583355_100010662108 [0,0,0,1,0,0|1,0,2]=4 2418 B12R2.202 Cc1cccc2c1CN(C2)C 2230a_100020635169_200000210301 [0,0,0,1,0,0|2,0,1]=4 2419 B12R2.202 Cc1cccc2c1CN(C2)C 269982a_100020635169_200000210301 [0,0,0,1,0,0|2,0,1]=4 2420 B12R2.202 Cc1cccc2c1CN(C2)C 34a_100020635169_200000210301 [0,0,0,1,0,0|2,0,1]=4 2421 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 2230a_100020635169_200025704644 [0,0,0,1,0,0|2,0,1]=4 2422 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 269982a_100020635169_200025704644 [0,0,0,1,0,0|2,0,1]=4 2423 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 34a_100020635169_200025704644 [0,0,0,1,0,0|2,0,1]=4 2424 B12R2.202 Cc1cccc2c1nc(s2)O 271570a_203496583355_100010008827 [0,0,0,1,0,0|3,0,0]=4 2425 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,0,0,1,0,0|2,0,1]=4 2426 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,0,0,1,0,0|3,0,0]=4 2427 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,0,0,1,0,0|3,0,0]=4 2428 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,0,0,1,0,0|3,0,0]=4 2429 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,0,0,1,0,0|3,0,0]=4 2430 B12R2.1081 Oc1cccc2c1OCCC2 271570a_203496583355_100010204675 [0,0,0,1,0,0|1,0,2]=4 2431 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [0,0,0,1,0,0|2,0,1]=4 2432 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [0,0,0,1,0,0|3,0,0]=4 2433 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [0,0,0,1,0,0|2,0,1]=4 2434 B12R2.1081 Oc1cccc2c1nccn2 271570a_203496583355_100010003881 [0,0,0,1,0,0|3,0,0]=4 2435 B9R0.5 C=CCC(=O)C=C/C=C/C 1458a_100000185730_100000210623 [1,0,1,0,0,0|0,0,1]=3 2436 B9R0.18 C=CC=CC(=O)CCC=C 1458a_100016291481_100000754431 [1,0,1,0,0,0|0,0,2]=4 2437 B9R0.18 C=CC=CC(=O)NCC=C 1626a_100020586998_100016291481 [1,0,1,0,0,0|1,0,1]=4 2438 B9R1.2 C=Cc1cc(ccn1)C 271570a_100011290941_100000750283 [2,0,0,0,0,0|1,0,0]=3 2439 B9R1.2 C=Cc1cc(ccn1)Cl 271570a_100011290941_100010167805 [2,0,0,0,0,0|2,0,0]=4 2440 B9R1.2 C=Cc1cc(ccn1)F 271570a_100011290941_100009817058 [2,0,0,0,0,0|2,0,0]=4 2441 B9R1.2 C=Cc1cc(ccn1)N 271570a_100011290941_100009814236 [2,0,0,0,0,0|2,0,0]=4 2442 B9R1.2 C=Cc1cc(ccn1)O 271570a_100011290941_100000762945 [2,0,0,0,0,0|2,0,0]=4 2443 B9R1.2 C=Cc1cc(cnn1)C 271570a_100011290941_100000070100 [2,0,0,0,0,0|2,0,0]=4 2444 B9R1.2 C=Cc1cc(ncn1)C 271570a_100011290941_100000744208 [2,0,0,0,0,0|2,0,0]=4 2445 B9R1.2 C=Cc1cc[nH]c(=O)c1 271570a_100011290941_100009816521 [2,0,0,0,0,0|2,0,0]=4 2446 B9R1.2 C=Cc1ccc[n+](c1)C 271570a_100011290941_100009996589 [2,0,0,0,0,0|1,0,0]=3 2447 B9R1.2 C=Cc1ccc[n+](c1)[O-] 271570a_100011290941_100009815978 [2,0,0,0,0,0|2,0,0]=4 2448 B9R1.2 C=Cc1cccc(=O)[nH]1 271570a_100011290941_100000761760 [2,0,0,0,0,0|2,0,0]=4 2449 B9R1.2 C=Cc1cccc(c1)Br 271570a_100011290941_100000691529 [2,0,0,0,0,0|1,0,0]=3 2450 B9R1.2 C=Cc1cccc(c1)C 271570a_100011290941_100011215228 [2,0,0,0,0,0|0,0,0]=2 2451 B9R1.2 C=Cc1cccc(c1)Cl 271570a_100011290941_100000699651 [2,0,0,0,0,0|1,0,0]=3 2452 B9R1.2 C=Cc1cccc(c1)F 271570a_100011290941_100000685547 [2,0,0,0,0,0|1,0,0]=3 2453 B9R1.2 C=Cc1cccc(c1)N 271570a_100011290941_100000210019 [2,0,0,0,0,0|1,0,0]=3 2454 B9R1.2 C=Cc1cccc(c1)O 271570a_100011290941_100000211634 [2,0,0,0,0,0|1,0,0]=3 2455 B9R1.2 C=Cc1cccc(c1)[S] 271570a_100011290941_114929384022 [2,0,0,0,0,0|1,0,0]=3 2456 B9R1.2 C=Cc1cccc(n1)Br 271570a_100011290941_100000684672 [2,0,0,0,0,0|2,0,0]=4 2457 B9R1.2 C=Cc1cccc(n1)C 271570a_100011290941_100000742759 [2,0,0,0,0,0|1,0,0]=3 2458 B9R1.2 C=Cc1cccc(n1)F 271570a_100011290941_100009815982 [2,0,0,0,0,0|2,0,0]=4 2459 B9R1.2 C=Cc1cccc(n1)N 271570a_100011290941_100000740741 [2,0,0,0,0,0|2,0,0]=4 2460 B9R1.2 C=Cc1ccnc(c1)Br 271570a_100011290941_100009814637 [2,0,0,0,0,0|2,0,0]=4 2461 B9R1.2 C=Cc1ccnc(c1)C 271570a_100011290941_100000758586 [2,0,0,0,0,0|1,0,0]=3 2462 B9R1.2 C=Cc1ccnc(c1)Cl 271570a_100011290941_100000035001 [2,0,0,0,0,0|2,0,0]=4 2463 B9R1.2 C=Cc1ccnc(c1)F 271570a_100011290941_100009816116 [2,0,0,0,0,0|2,0,0]=4 2464 B9R1.2 C=Cc1ccnc(c1)N 271570a_100011290941_100000744379 [2,0,0,0,0,0|2,0,0]=4 2465 B9R1.2 C=Cc1ccnc(n1)C 271570a_100011290941_100000749937 [2,0,0,0,0,0|2,0,0]=4 2466 B9R1.2 C=Cc1cncc(c1)Br 271570a_100011290941_100000728054 [2,0,0,0,0,0|2,0,0]=4 2467 B9R1.2 C=Cc1cncc(c1)C 271570a_100011290941_100000760492 [2,0,0,0,0,0|1,0,0]=3 2468 B9R1.2 C=Cc1cncc(c1)Cl 271570a_100011290941_100000049639 [2,0,0,0,0,0|2,0,0]=4 2469 B9R1.2 C=Cc1cncc(c1)F 271570a_100011290941_100000744099 [2,0,0,0,0,0|2,0,0]=4 2470 B9R1.2 C=Cc1cncc(c1)N 271570a_100011290941_100000687067 [2,0,0,0,0,0|2,0,0]=4 2471 B9R1.2 C=Cc1cncc(c1)O 271570a_100011290941_100000754920 [2,0,0,0,0,0|2,0,0]=4 2472 B9R1.2 C=Cc1cncc(n1)C 271570a_100011290941_100009842155 [2,0,0,0,0,0|2,0,0]=4 2473 B9R1.2 C=Cc1nccc(n1)C 271570a_100011290941_100011243806 [2,0,0,0,0,0|2,0,0]=4 2474 B9R1.2 CCc1cccc(c1)O 271570a_203496583355_100000684523 [2,0,0,0,0,0|1,0,1]=4 2475 B9R1.2 CNc1cccc(c1)C 2230a_100000188690_200000210301 [2,0,0,0,0,0|1,0,1]=4 2476 B9R1.2 CNc1cccc(c1)C 34a_100000188690_200000210301 [2,0,0,0,0,0|1,0,1]=4 2477 B9R1.2 COc1cccc(c1)C 34a_100000210337_200000210301 [2,0,0,0,0,0|1,0,1]=4 2478 B9R1.2 COc1cccc(c1)C 7a_100000210337_200000210301 [2,0,0,0,0,0|1,0,1]=4 2479 B9R1.2 CSc1cccc(c1)C 62a_100011215228_200000210301 [2,0,0,0,0,0|1,0,1]=4 2480 B9R1.2 CSc1cccc(c1)C 62a_200000210301_100011215228 [2,0,0,0,0,0|1,0,1]=4 2481 B9R1.2 Cc1cccc(c1)N[13CH3] 2230a_100000188690_200025704644 [2,0,0,0,0,0|1,0,1]=4 2482 B9R1.2 Cc1cccc(c1)N[13CH3] 34a_100000188690_200025704644 [2,0,0,0,0,0|1,0,1]=4 2483 B9R1.2 Cc1cccc(c1)O[13CH3] 34a_100000210337_200025704644 [2,0,0,0,0,0|1,0,1]=4 2484 B9R1.2 Cc1cccc(c1)O[13CH3] 7a_100000210337_200025704644 [2,0,0,0,0,0|1,0,1]=4 2485 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_100011215228_200025704644 [2,0,0,0,0,0|1,0,1]=4 2486 B9R1.2 Cc1cccc(c1)S[13CH3] 62a_200025704644_100011215228 [2,0,0,0,0,0|1,0,1]=4 2487 B9R1.2 NCc1cccc(c1)O 271570a_203496583355_100000106179 [2,0,0,0,0,0|2,0,0]=4 2488 B9R1.2 O=Cc1cccc(c1)O 271570a_203496583355_100000014684 [2,0,0,0,0,0|2,0,0]=4 2489 B9R1.2 OCc1cccc(c1)O 271570a_203496583355_100000687537 [2,0,0,0,0,0|2,0,0]=4 2490 B9R1.2 Oc1cccc(c1)CF 271570a_203496583355_100010878472 [2,0,0,0,0,0|2,0,0]=4 2491 B9R1.3 Cc1ccc[n+](c1O)[O-] 271570a_203496583355_100116209805 [2,0,0,0,0,0|2,0,0]=4 2492 B9R1.3 Cc1cccc(c1C)O 271570a_203496583355_100011214922 [2,0,0,0,0,0|2,0,0]=4 2493 B9R1.3 Cc1cccc(c1Cl)O 271570a_203496583355_200012352035 [2,0,0,0,0,0|2,0,0]=4 2494 B9R1.3 Cc1cccc(c1F)O 271570a_203496583355_100000717567 [2,0,0,0,0,0|2,0,0]=4 2495 B9R1.3 Cc1cccc(c1N)O 271570a_203496583355_100011834072 [2,0,0,0,0,0|2,0,0]=4 2496 B9R1.3 Cc1cccc(c1O)C 271570a_203496583355_100000033847 [2,0,0,0,0,0|0,0,0]=2 2497 B9R1.3 Cc1cccc(c1O)Cl 271570a_203496583355_100000043165 [2,0,0,0,0,0|1,0,0]=3 2498 B9R1.3 Cc1cccc(c1O)F 271570a_203496583355_100012349962 [2,0,0,0,0,0|1,0,0]=3 2499 B9R1.3 Cc1cccc(c1O)N 271570a_203496583355_100000684715 [2,0,0,0,0,0|1,0,0]=3 2500 B9R1.3 Cc1cccc(c1O)O 271570a_203496583355_100000686692 [2,0,0,0,0,0|1,0,0]=3 2501 B9R1.3 Cc1cccc(c1O)O 271570a_203496583355_100009817157 [2,0,0,0,0,0|1,0,0]=3 2502 B9R1.3 Cc1ccnc(c1O)C 271570a_203496583355_100012000501 [2,0,0,0,0,0|1,0,0]=3 2503 B9R1.3 Cc1ccnc(c1O)F 271570a_203496583355_100009818256 [2,0,0,0,0,0|2,0,0]=4 2504 B9R1.3 Cc1ccnc(c1O)N 271570a_203496583355_100011998619 [2,0,0,0,0,0|2,0,0]=4 2505 B9R1.3 Cc1ccnc(c1O)O 271570a_203496583355_100000696282 [2,0,0,0,0,0|2,0,0]=4 2506 B9R1.3 Cc1ccnc(c1O)O 271570a_203496583355_100012000493 [2,0,0,0,0,0|2,0,0]=4 2507 B9R1.3 Cc1cncc(c1O)C 271570a_203496583355_100009817138 [2,0,0,0,0,0|1,0,0]=3 2508 B9R1.3 Cc1nccc(c1O)N 271570a_203496583355_100010243816 [2,0,0,0,0,0|2,0,0]=4 2509 B9R1.3 Cc1ncnc(c1O)C 271570a_203496583355_100009820708 [2,0,0,0,0,0|2,0,0]=4 2510 B9R1.3 Nc1cccc(c1O)Br 271570a_203496583355_100020590159 [2,0,0,0,0,0|2,0,0]=4 2511 B9R1.3 Nc1cccc(c1O)Cl 271570a_203496583355_100000049713 [2,0,0,0,0,0|2,0,0]=4 2512 B9R1.3 Nc1cccc(c1O)F 271570a_203496583355_100011934729 [2,0,0,0,0,0|2,0,0]=4 2513 B9R1.3 Nc1cccc(c1O)O 271570a_203496583355_100011934915 [2,0,0,0,0,0|2,0,0]=4 2514 B9R1.3 Nc1cccc(c1O)O 271570a_203496583355_100012183704 [2,0,0,0,0,0|2,0,0]=4 2515 B9R1.3 Oc1c(cccc1Br)Br 271570a_203496583355_100009994525 [2,0,0,0,0,0|2,0,0]=4 2516 B9R1.3 Oc1c(cccc1Br)Cl 271570a_203496583355_100010214488 [2,0,0,0,0,0|2,0,0]=4 2517 B9R1.3 Oc1c(cccc1Br)F 271570a_203496583355_100011219512 [2,0,0,0,0,0|2,0,0]=4 2518 B9R1.3 Oc1c(cccc1Cl)Cl 271570a_203496583355_100000034237 [2,0,0,0,0,0|2,0,0]=4 2519 B9R1.3 Oc1c(cccc1Cl)F 271570a_203496583355_100000050007 [2,0,0,0,0,0|2,0,0]=4 2520 B9R1.3 Oc1c(cccc1F)F 271570a_203496583355_100000693133 [2,0,0,0,0,0|2,0,0]=4 2521 B9R1.3 Oc1cccc(c1O)Br 271570a_203496583355_100010084509 [2,0,0,0,0,0|2,0,0]=4 2522 B9R1.3 Oc1cccc(c1O)Br 271570a_203496583355_100010187912 [2,0,0,0,0,0|2,0,0]=4 2523 B9R1.3 Oc1cccc(c1O)Cl 271570a_203496583355_100000050174 [2,0,0,0,0,0|2,0,0]=4 2524 B9R1.3 Oc1cccc(c1O)Cl 271570a_203496583355_100010202889 [2,0,0,0,0,0|2,0,0]=4 2525 B9R1.3 Oc1cccc(c1O)F 271570a_203496583355_100009813666 [2,0,0,0,0,0|2,0,0]=4 2526 B9R1.3 Oc1cccc(c1O)F 271570a_203496583355_100009820682 [2,0,0,0,0,0|2,0,0]=4 2527 B9R1.3 Oc1cccc(c1O)O 271570a_203496583355_100009815950 [2,0,0,0,0,0|2,0,0]=4 2528 B9R1.3 Oc1cccc(c1O)O 271570a_203496583355_100010205330 [2,0,0,0,0,0|2,0,0]=4 2529 B9R1.15 C=Cc1c[nH]ccc1=O 271570a_100011290941_100009998708 [2,0,0,0,0,0|1,0,1]=4 2530 B9R1.15 C=Cc1c[nH]ccc1=S 271570a_100011290941_200012280681 [2,0,0,0,0,0|1,1,0]=4 2531 B9R1.15 C=Cc1ccc[nH]c1=O 271570a_100011290941_100000050042 [2,0,0,0,0,0|1,0,1]=4 2532 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [2,0,0,0,0,0|2,0,0]=4 2533 B9R1.15 C=Cc1cccc[n+]1[O-] 271570a_100011290941_200000042595 [2,0,0,0,0,0|1,0,1]=4 2534 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [2,0,0,0,0,0|1,0,0]=3 2535 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [2,0,0,0,0,0|1,0,0]=3 2536 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [2,0,0,0,0,0|1,0,0]=3 2537 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [2,0,0,0,0,0|1,0,0]=3 2538 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [2,0,0,0,0,0|1,0,0]=3 2539 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [2,0,0,0,0,0|0,0,0]=2 2540 B9R1.15 C=Cc1cccnc1Br 271570a_100011290941_100010202626 [2,0,0,0,0,0|2,0,0]=4 2541 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [2,0,0,0,0,0|2,0,0]=4 2542 B9R1.15 C=Cc1cccnc1Cl 271570a_100011290941_100000036424 [2,0,0,0,0,0|2,0,0]=4 2543 B9R1.15 C=Cc1cccnc1F 271570a_100011290941_100009816115 [2,0,0,0,0,0|2,0,0]=4 2544 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [2,0,0,0,0,0|2,0,0]=4 2545 B9R1.15 C=Cc1ccncc1Br 271570a_100011290941_100000726257 [2,0,0,0,0,0|2,0,0]=4 2546 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [2,0,0,0,0,0|2,0,0]=4 2547 B9R1.15 C=Cc1ccncc1Cl 271570a_100011290941_100000708259 [2,0,0,0,0,0|2,0,0]=4 2548 B9R1.15 C=Cc1ccncc1F 271570a_100011290941_100000047030 [2,0,0,0,0,0|2,0,0]=4 2549 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [2,0,0,0,0,0|2,0,0]=4 2550 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [2,0,0,0,0,0|1,0,0]=3 2551 B9R1.15 C=Cc1cnccc1Br 271570a_100011290941_100010138639 [2,0,0,0,0,0|2,0,0]=4 2552 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [2,0,0,0,0,0|2,0,0]=4 2553 B9R1.15 C=Cc1cnccc1Cl 271570a_100011290941_100009995489 [2,0,0,0,0,0|2,0,0]=4 2554 B9R1.15 C=Cc1cnccc1F 271570a_100011290941_100009820683 [2,0,0,0,0,0|2,0,0]=4 2555 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [2,0,0,0,0,0|2,0,0]=4 2556 B9R1.15 C=Cc1cncnc1O 271570a_100011290941_100000751107 [2,0,0,0,0,0|2,0,0]=4 2557 B9R1.15 C=Cc1ncccc1Br 271570a_100011290941_100000696092 [2,0,0,0,0,0|2,0,0]=4 2558 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [2,0,0,0,0,0|2,0,0]=4 2559 B9R1.15 C=Cc1ncccc1Cl 271570a_100011290941_100011356963 [2,0,0,0,0,0|2,0,0]=4 2560 B9R1.15 C=Cc1ncccc1F 271570a_100011290941_100000685392 [2,0,0,0,0,0|2,0,0]=4 2561 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [2,0,0,0,0,0|2,0,0]=4 2562 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [2,0,0,0,0,0|1,0,0]=3 2563 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [2,0,0,0,0,0|0,0,1]=3 2564 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [2,0,0,0,0,0|1,0,1]=4 2565 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [2,0,0,0,0,0|1,0,1]=4 2566 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [2,0,0,0,0,0|1,0,1]=4 2567 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [2,0,0,0,0,0|1,0,1]=4 2568 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [2,0,0,0,0,0|1,0,1]=4 2569 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [2,0,0,0,0,0|1,0,1]=4 2570 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [2,0,0,0,0,0|1,0,1]=4 2571 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [2,0,0,0,0,0|1,0,1]=4 2572 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [2,0,0,0,0,0|1,0,1]=4 2573 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [2,0,0,0,0,0|1,0,1]=4 2574 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [2,0,0,0,0,0|1,0,0]=3 2575 B9R1.15 NCc1cccnc1O 271570a_203496583355_100015189234 [2,0,0,0,0,0|2,0,0]=4 2576 B9R1.15 NCc1ccncc1O 271570a_203496583355_100020640021 [2,0,0,0,0,0|2,0,0]=4 2577 B9R1.15 NCc1ncccc1O 271570a_203496583355_100020591323 [2,0,0,0,0,0|2,0,0]=4 2578 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [2,0,0,0,0,0|2,0,0]=4 2579 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [2,0,0,0,0,0|1,0,0]=3 2580 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [2,0,0,0,0,0|2,0,0]=4 2581 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [2,0,0,0,0,0|2,0,0]=4 2582 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [2,0,0,0,0,0|2,0,0]=4 2583 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [2,0,0,0,0,0|2,0,0]=4 2584 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [2,0,0,0,0,0|1,0,0]=3 2585 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [2,0,0,0,0,0|2,0,0]=4 2586 B9R1.15 OCc1ccncc1O 271570a_203496583355_100009873359 [2,0,0,0,0,0|2,0,0]=4 2587 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [2,0,0,0,0,0|2,0,0]=4 2588 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [2,0,0,0,0,0|2,0,0]=4 2589 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [2,0,0,0,0,0|1,0,1]=4 2590 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [2,0,0,0,0,0|1,0,1]=4 2591 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [2,0,0,0,0,0|1,0,1]=4 2592 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [2,0,0,0,0,0|0,0,2]=4 2593 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [2,0,0,0,0,0|0,0,2]=4 2594 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [2,0,0,0,0,0|1,0,1]=4 2595 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [2,0,0,0,0,0|1,0,1]=4 2596 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [2,0,0,0,0,0|1,0,1]=4 2597 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [2,0,0,0,0,0|1,0,1]=4 2598 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [2,0,0,0,0,0|1,0,1]=4 2599 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [2,0,0,0,0,0|1,0,1]=4 2600 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [2,0,0,0,0,0|1,0,1]=4 2601 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [2,0,0,0,0,0|1,0,1]=4 2602 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [2,0,0,0,0,0|1,0,1]=4 2603 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [2,0,0,0,0,0|1,0,1]=4 2604 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [2,0,0,0,0,0|1,0,1]=4 2605 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [2,0,0,0,0,0|1,0,1]=4 2606 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [2,0,0,0,0,0|1,0,1]=4 2607 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [2,0,0,0,0,0|1,0,1]=4 2608 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [2,0,0,0,0,0|1,0,1]=4 2609 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [2,0,0,0,0,0|1,0,1]=4 2610 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [2,0,0,0,0,0|1,0,1]=4 2611 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [2,0,0,0,0,0|1,0,1]=4 2612 B11R0.98 C=CCN(CC=C)C(=O)C(=C)C 11a_100000210471_100000185857 [0,1,1,0,0,0|1,0,1]=4 2613 B11R0.98 C=CCN(CC=C)C(=O)C(=C)C 1626a_100000210471_100000185857 [0,1,1,0,0,0|1,0,1]=4 2614 B11R0.70 C=CCCC(=O)C=CC(=CC)C 1458a_100000692105_100000754431 [0,1,1,0,0,0|1,0,1]=4 2615 B11R0.70 C=CCNC(=O)C=CC(=CC)C 1626a_100020586998_100000692105 [0,1,1,0,0,0|2,0,0]=4 2616 B11R1.8 C=Cc1cc(cc(c1Br)F)F 271570a_100011290941_100010256416 [1,1,0,0,0,0|2,0,0]=4 2617 B11R1.8 C=Cc1cc(cc(c1C)C)N 271570a_100011290941_100010368239 [1,1,0,0,0,0|1,0,0]=3 2618 B11R1.8 C=Cc1cc(cc(c1C)C)O 271570a_100011290941_100010068915 [1,1,0,0,0,0|1,0,0]=3 2619 B11R1.8 C=Cc1cc(cc(c1C)F)C 271570a_100011290941_100015473476 [1,1,0,0,0,0|2,0,0]=4 2620 B11R1.8 C=Cc1cc(cc(c1C)F)F 271570a_100011290941_100015579730 [1,1,0,0,0,0|2,0,0]=4 2621 B11R1.8 C=Cc1cc(cc(c1C)F)N 271570a_100011290941_100010254531 [1,1,0,0,0,0|2,0,0]=4 2622 B11R1.8 C=Cc1cc(cc(c1C)N)C 271570a_100011290941_102495365385 [1,1,0,0,0,0|2,0,0]=4 2623 B11R1.8 C=Cc1cc(cc(c1C)N)Cl 271570a_100011290941_200000050010 [1,1,0,0,0,0|2,0,0]=4 2624 B11R1.8 C=Cc1cc(cc(c1C)N)F 271570a_100011290941_100009814351 [1,1,0,0,0,0|2,0,0]=4 2625 B11R1.8 C=Cc1cc(cc(c1Cl)Cl)Cl 271570a_100011290941_200000042848 [1,1,0,0,0,0|2,0,0]=4 2626 B11R1.8 C=Cc1cc(cc(c1F)C)C 271570a_100011290941_200010204574 [1,1,0,0,0,0|1,0,0]=3 2627 B11R1.8 C=Cc1cc(cc(c1F)C)F 271570a_100011290941_100010291795 [1,1,0,0,0,0|1,0,0]=3 2628 B11R1.8 C=Cc1cc(cc(c1F)Cl)Br 271570a_100011290941_100010270166 [1,1,0,0,0,0|2,0,0]=4 2629 B11R1.8 C=Cc1cc(cc(c1F)F)C 271570a_100011290941_100010141297 [1,1,0,0,0,0|2,0,0]=4 2630 B11R1.8 C=Cc1cc(cc(c1F)F)F 271570a_100011290941_100000724850 [1,1,0,0,0,0|2,0,0]=4 2631 B11R1.8 C=Cc1cc(cc(c1F)F)N 271570a_100011290941_100009816004 [1,1,0,0,0,0|2,0,0]=4 2632 B11R1.8 C=Cc1cc(cc(c1F)N)C 271570a_100011290941_100010589139 [1,1,0,0,0,0|2,0,0]=4 2633 B11R1.8 C=Cc1cc(cc(c1F)N)F 271570a_100011290941_100000722353 [1,1,0,0,0,0|2,0,0]=4 2634 B11R1.8 C=Cc1cc(cc(c1N)Br)Cl 271570a_100011290941_200012970264 [1,1,0,0,0,0|2,0,0]=4 2635 B11R1.8 C=Cc1cc(cc(c1N)C)Br 271570a_100011290941_200000690823 [1,1,0,0,0,0|1,0,0]=3 2636 B11R1.8 C=Cc1cc(cc(c1N)C)C 271570a_100011290941_100000688863 [1,1,0,0,0,0|1,0,0]=3 2637 B11R1.8 C=Cc1cc(cc(c1N)C)Cl 271570a_100011290941_100012344046 [1,1,0,0,0,0|1,0,0]=3 2638 B11R1.8 C=Cc1cc(cc(c1N)C)F 271570a_100011290941_100011216670 [1,1,0,0,0,0|1,0,0]=3 2639 B11R1.8 C=Cc1cc(cc(c1N)Cl)Cl 271570a_100011290941_100011216899 [1,1,0,0,0,0|2,0,0]=4 2640 B11R1.8 C=Cc1cc(cc(c1N)F)Br 271570a_100011290941_100012970276 [1,1,0,0,0,0|2,0,0]=4 2641 B11R1.8 C=Cc1cc(cc(c1N)F)C 271570a_100011290941_100012353694 [1,1,0,0,0,0|2,0,0]=4 2642 B11R1.8 C=Cc1cc(cc(c1N)F)Cl 271570a_100011290941_100011214900 [1,1,0,0,0,0|2,0,0]=4 2643 B11R1.8 C=Cc1cc(cc(c1N)F)F 271570a_100011290941_100000211602 [1,1,0,0,0,0|2,0,0]=4 2644 B11R1.8 C=Cc1cc(cc(c1N)N)C 271570a_100011290941_100012348275 [1,1,0,0,0,0|2,0,0]=4 2645 B11R1.8 C=Cc1cc(cc(c1N)N)F 271570a_100011290941_100011934818 [1,1,0,0,0,0|2,0,0]=4 2646 B11R1.8 C=Cc1cc(cc(c1O)Br)F 271570a_100011290941_200013085147 [1,1,0,0,0,0|1,0,0]=3 2647 B11R1.8 C=Cc1cc(cc(c1O)C)C 271570a_100011290941_100011934984 [1,1,0,0,0,0|0,0,0]=2 2648 B11R1.8 C=Cc1cc(cc(c1O)C)Cl 271570a_100011290941_100012343667 [1,1,0,0,0,0|0,0,0]=2 2649 B11R1.8 C=Cc1cc(cc(c1O)C)N 271570a_100011290941_100010064301 [1,1,0,0,0,0|0,0,0]=2 2650 B11R1.8 C=Cc1cc(cc(c1O)Cl)Cl 271570a_100011290941_200012339341 [1,1,0,0,0,0|1,0,0]=3 2651 B11R1.8 C=Cc1cc(cc(c1O)F)Br 271570a_100011290941_100013354677 [1,1,0,0,0,0|1,0,0]=3 2652 B11R1.8 C=Cc1cc(cc(c1O)F)C 271570a_100011290941_200135191068 [1,1,0,0,0,0|1,0,0]=3 2653 B11R1.8 C=Cc1cc(cc(c1O)F)F 271570a_100011290941_100000688693 [1,1,0,0,0,0|1,0,0]=3 2654 B11R1.8 C=Cc1cc(cc(c1O)N)F 271570a_100011290941_200011217456 [1,1,0,0,0,0|1,0,0]=3 2655 B11R1.8 C=Cc1cc(cn(c1=O)C)C 271570a_100011290941_100011068373 [1,1,0,0,0,0|1,0,1]=4 2656 B11R1.8 C=Cc1nc(cc(c1N)C)C 271570a_100011290941_100009816701 [1,1,0,0,0,0|2,0,0]=4 2657 B11R1.8 C=Cc1nc(cc(c1N)C)Cl 271570a_100011290941_100021194808 [1,1,0,0,0,0|2,0,0]=4 2658 B11R1.8 CCc1cc(cc(c1N)C)O 271570a_203496583355_200000186424 [1,1,0,0,0,0|1,0,1]=4 2659 B11R1.8 CCc1cc(cc(c1O)C)O 271570a_203496583355_100010659108 [1,1,0,0,0,0|0,0,1]=3 2660 B11R1.8 CNc1cc(cc(c1O)C)Br 34a_100011825904_200000210301 [1,1,0,0,0,0|1,0,1]=4 2661 B11R1.8 CNc1cc(cc(c1O)C)Br 7a_100011825904_200000210301 [1,1,0,0,0,0|1,0,1]=4 2662 B11R1.8 CNc1cc(cc(c1O)C)C 34a_100011216242_200000210301 [1,1,0,0,0,0|1,0,1]=4 2663 B11R1.8 CNc1cc(cc(c1O)C)C 7a_100011216242_200000210301 [1,1,0,0,0,0|1,0,1]=4 2664 B11R1.8 CNc1cc(cc(c1O)C)F 34a_100000130126_200000210301 [1,1,0,0,0,0|1,0,1]=4 2665 B11R1.8 CNc1cc(cc(c1O)C)F 7a_100000130126_200000210301 [1,1,0,0,0,0|1,0,1]=4 2666 B11R1.8 CSc1cc(cc(c1O)C)C 62a_100011934984_200000210301 [1,1,0,0,0,0|1,0,1]=4 2667 B11R1.8 CSc1cc(cc(c1O)C)C 62a_200000210301_100011934984 [1,1,0,0,0,0|1,0,1]=4 2668 B11R1.8 CSc1cc(cc(c1O)C)Cl 62a_100012343667_200000210301 [1,1,0,0,0,0|1,0,1]=4 2669 B11R1.8 CSc1cc(cc(c1O)C)Cl 62a_200000210301_100012343667 [1,1,0,0,0,0|1,0,1]=4 2670 B11R1.8 CSc1cc(cc(c1O)C)N 62a_100010064301_200000210301 [1,1,0,0,0,0|1,0,1]=4 2671 B11R1.8 CSc1cc(cc(c1O)C)N 62a_200000210301_100010064301 [1,1,0,0,0,0|1,0,1]=4 2672 B11R1.8 Cc1cc(c(c(c1)C=O)O)O 271570a_203496583355_100000698970 [1,1,0,0,0,0|2,0,0]=4 2673 B11R1.8 Cc1cc(c(c(c1)N[13CH3])O)C 34a_100011216242_200025704644 [1,1,0,0,0,0|1,0,1]=4 2674 B11R1.8 Cc1cc(c(c(c1)N[13CH3])O)C 7a_100011216242_200025704644 [1,1,0,0,0,0|1,0,1]=4 2675 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)C 62a_100011934984_200025704644 [1,1,0,0,0,0|1,0,1]=4 2676 B11R1.8 Cc1cc(c(c(c1)S[13CH3])O)C 62a_200025704644_100011934984 [1,1,0,0,0,0|1,0,1]=4 2677 B11R1.8 Cc1cc(cc(c1F)C=O)O 271570a_203496583355_100010235757 [1,1,0,0,0,0|2,0,0]=4 2678 B11R1.8 Cc1cc(cc(c1F)CO)O 271570a_203496583355_200010782270 [1,1,0,0,0,0|2,0,0]=4 2679 B11R1.8 Cc1cc(cc(c1O)C#N)O 271570a_203496583355_100010195408 [1,1,0,0,0,0|1,0,1]=4 2680 B11R1.8 Cc1cc(cc(c1O)N[13CH3])Br 34a_100011825904_200025704644 [1,1,0,0,0,0|1,0,1]=4 2681 B11R1.8 Cc1cc(cc(c1O)N[13CH3])Br 7a_100011825904_200025704644 [1,1,0,0,0,0|1,0,1]=4 2682 B11R1.8 Cc1cc(cc(c1O)N[13CH3])F 34a_100000130126_200025704644 [1,1,0,0,0,0|1,0,1]=4 2683 B11R1.8 Cc1cc(cc(c1O)N[13CH3])F 7a_100000130126_200025704644 [1,1,0,0,0,0|1,0,1]=4 2684 B11R1.8 Cc1cc(cc(c1O)S[13CH3])Cl 62a_100012343667_200025704644 [1,1,0,0,0,0|1,0,1]=4 2685 B11R1.8 Cc1cc(cc(c1O)S[13CH3])Cl 62a_200025704644_100012343667 [1,1,0,0,0,0|1,0,1]=4 2686 B11R1.8 Cc1cc(cc(c1O)S[13CH3])N 62a_100010064301_200025704644 [1,1,0,0,0,0|1,0,1]=4 2687 B11R1.8 Cc1cc(cc(c1O)S[13CH3])N 62a_200025704644_100010064301 [1,1,0,0,0,0|1,0,1]=4 2688 B11R1.8 O=Cc1cc(cc(c1O)F)O 271570a_203496583355_100011217654 [1,1,0,0,0,0|2,0,0]=4 2689 B11R1.8 O=Cc1cc(cc(c1O)O)F 271570a_203496583355_100011659637 [1,1,0,0,0,0|2,0,0]=4 2690 B11R1.8 Oc1c(cc(cc1CF)F)F 271570a_203496583355_100160470656 [1,1,0,0,0,0|2,0,0]=4 2691 B11R1.72 C=Cc1c(ccc(c1C)F)C 271570a_100011290941_100011068659 [1,1,0,0,0,0|2,0,0]=4 2692 B11R1.72 C=Cc1c(ccc(c1C)F)F 271570a_100011290941_100010167959 [1,1,0,0,0,0|2,0,0]=4 2693 B11R1.72 C=Cc1c(ccc(c1C)N)C 271570a_100011290941_106354213274 [1,1,0,0,0,0|2,0,0]=4 2694 B11R1.72 C=Cc1c(ccc(c1C)O)C 271570a_100011290941_100010659238 [1,1,0,0,0,0|2,0,0]=4 2695 B11R1.72 C=Cc1c(ccc(c1Cl)Br)N 271570a_100011290941_200010779962 [1,1,0,0,0,0|2,0,0]=4 2696 B11R1.72 C=Cc1c(ccc(c1Cl)Cl)Cl 271570a_100011290941_200010170825 [1,1,0,0,0,0|2,0,0]=4 2697 B11R1.72 C=Cc1c(ccc(c1Cl)Cl)F 271570a_100011290941_200015697950 [1,1,0,0,0,0|2,0,0]=4 2698 B11R1.72 C=Cc1c(ccc(c1Cl)Cl)N 271570a_100011290941_200011093878 [1,1,0,0,0,0|2,0,0]=4 2699 B11R1.72 C=Cc1c(ccc(c1Cl)F)Br 271570a_100011290941_200037249116 [1,1,0,0,0,0|2,0,0]=4 2700 B11R1.72 C=Cc1c(ccc(c1Cl)F)F 271570a_100011290941_100010167948 [1,1,0,0,0,0|2,0,0]=4 2701 B11R1.72 C=Cc1c(ccc(c1F)Br)Cl 271570a_100011290941_100011092007 [1,1,0,0,0,0|2,0,0]=4 2702 B11R1.72 C=Cc1c(ccc(c1F)Br)F 271570a_100011290941_100000722365 [1,1,0,0,0,0|2,0,0]=4 2703 B11R1.72 C=Cc1c(ccc(c1F)Cl)Br 271570a_100011290941_100011084128 [1,1,0,0,0,0|2,0,0]=4 2704 B11R1.72 C=Cc1c(ccc(c1F)Cl)F 271570a_100011290941_200010167938 [1,1,0,0,0,0|2,0,0]=4 2705 B11R1.72 C=Cc1c(ccc(c1F)Cl)N 271570a_100011290941_100010134325 [1,1,0,0,0,0|2,0,0]=4 2706 B11R1.72 C=Cc1c(ccc(c1F)F)F 271570a_100011290941_100009814005 [1,1,0,0,0,0|2,0,0]=4 2707 B11R1.72 C=Cc1c(ccc(c1F)F)N 271570a_100011290941_100010232473 [1,1,0,0,0,0|2,0,0]=4 2708 B11R1.72 C=Cc1c(ccc(c1F)N)F 271570a_100011290941_100010070858 [1,1,0,0,0,0|2,0,0]=4 2709 B11R1.72 C=Cc1c(ccc(c1N)F)F 271570a_100011290941_100014094178 [1,1,0,0,0,0|2,0,0]=4 2710 B11R1.72 C=Cc1c(ccc(c1N)N)F 271570a_100011290941_100010128261 [1,1,0,0,0,0|2,0,0]=4 2711 B11R1.72 C=Cc1c(ccc(c1O)F)C 271570a_100011290941_200010223207 [1,1,0,0,0,0|1,0,0]=3 2712 B11R1.72 C=Cc1c(ccc(c1O)F)F 271570a_100011290941_100010170822 [1,1,0,0,0,0|1,0,0]=3 2713 B11R1.72 Cc1ccc(c(c1F)C=O)O 271570a_203496583355_100000039034 [1,1,0,0,0,0|2,0,0]=4 2714 B11R1.72 Cc1ccc(c(c1O)C#N)F 271570a_203496583355_100000062000 [1,1,0,0,0,0|1,0,1]=4 2715 B11R1.72 Cc1ccc(c(c1O)C=O)F 271570a_203496583355_100000033498 [1,1,0,0,0,0|1,0,0]=3 2716 B11R1.72 Cc1ccc(c(c1O)CO)F 271570a_203496583355_100010365568 [1,1,0,0,0,0|1,0,0]=3 2717 B11R1.72 O=Cc1c(ccc(c1O)F)F 271570a_203496583355_100000034233 [1,1,0,0,0,0|2,0,0]=4 2718 B11R1.72 O=Cc1c(ccc(c1O)F)O 271570a_203496583355_100010762561 [1,1,0,0,0,0|2,0,0]=4 2719 B11R1.72 O=Cc1c(ccc(c1O)O)O 271570a_203496583355_100010184888 [1,1,0,0,0,0|2,0,0]=4 2720 B11R1.72 OCc1c(ccc(c1O)F)F 271570a_203496583355_100011071053 [1,1,0,0,0,0|2,0,0]=4 2721 B11R1.159 C=C(C)c1cccc(c1Br)O 271570a_100000694244_100010187914 [1,1,0,0,0,0|2,0,0]=4 2722 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [1,1,0,0,0,0|2,0,0]=4 2723 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [1,1,0,0,0,0|1,0,0]=3 2724 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [1,1,0,0,0,0|2,0,0]=4 2725 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [1,1,0,0,0,0|2,0,0]=4 2726 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [1,1,0,0,0,0|2,0,0]=4 2727 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [1,1,0,0,0,0|2,0,0]=4 2728 B11R1.159 C=C(C)c1cccc(c1Cl)Br 271570a_100000694244_100010142854 [1,1,0,0,0,0|2,0,0]=4 2729 B11R1.159 C=C(C)c1cccc(c1Cl)C 271570a_100000694244_200012352035 [1,1,0,0,0,0|1,0,0]=3 2730 B11R1.159 C=C(C)c1cccc(c1Cl)Cl 271570a_100000694244_100011215384 [1,1,0,0,0,0|2,0,0]=4 2731 B11R1.159 C=C(C)c1cccc(c1Cl)F 271570a_100000694244_200010234923 [1,1,0,0,0,0|2,0,0]=4 2732 B11R1.159 C=C(C)c1cccc(c1Cl)O 271570a_100000694244_100000049636 [1,1,0,0,0,0|2,0,0]=4 2733 B11R1.159 C=C(C)c1cccc(c1F)Br 271570a_100000694244_100000702267 [1,1,0,0,0,0|2,0,0]=4 2734 B11R1.159 C=C(C)c1cccc(c1F)C 271570a_100000694244_100000717567 [1,1,0,0,0,0|1,0,0]=3 2735 B11R1.159 C=C(C)c1cccc(c1F)Cl 271570a_100000694244_100011217346 [1,1,0,0,0,0|2,0,0]=4 2736 B11R1.159 C=C(C)c1cccc(c1F)F 271570a_100000694244_100000694657 [1,1,0,0,0,0|2,0,0]=4 2737 B11R1.159 C=C(C)c1cccc(c1F)N 271570a_100000694244_100011935091 [1,1,0,0,0,0|2,0,0]=4 2738 B11R1.159 C=C(C)c1cccc(c1F)O 271570a_100000694244_100009817021 [1,1,0,0,0,0|2,0,0]=4 2739 B11R1.159 C=C(C)c1cccc(c1N)Br 271570a_100000694244_100010146558 [1,1,0,0,0,0|2,0,0]=4 2740 B11R1.159 C=C(C)c1cccc(c1N)C 271570a_100000694244_100011834072 [1,1,0,0,0,0|1,0,0]=3 2741 B11R1.159 C=C(C)c1cccc(c1N)Cl 271570a_100000694244_100010190421 [1,1,0,0,0,0|2,0,0]=4 2742 B11R1.159 C=C(C)c1cccc(c1N)F 271570a_100000694244_100000042321 [1,1,0,0,0,0|2,0,0]=4 2743 B11R1.159 C=C(C)c1cccc(c1N)N 271570a_100000694244_100015191791 [1,1,0,0,0,0|2,0,0]=4 2744 B11R1.159 C=C(C)c1cccc(c1N)O 271570a_100000694244_100011934926 [1,1,0,0,0,0|2,0,0]=4 2745 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [1,1,0,0,0,0|1,0,0]=3 2746 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [1,1,0,0,0,0|0,0,0]=2 2747 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [1,1,0,0,0,0|1,0,0]=3 2748 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [1,1,0,0,0,0|1,0,0]=3 2749 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [1,1,0,0,0,0|1,0,0]=3 2750 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [1,1,0,0,0,0|1,0,0]=3 2751 B11R1.159 C=C(C)c1cccn(c1=O)C 271570a_100000694244_100000687173 [1,1,0,0,0,0|1,0,1]=4 2752 B11R1.159 C=C(C)c1ccnc(c1C)C 271570a_100000694244_100009846815 [1,1,0,0,0,0|2,0,0]=4 2753 B11R1.159 C=C(C)c1ccnc(c1Cl)C 271570a_100000694244_100000698670 [1,1,0,0,0,0|2,0,0]=4 2754 B11R1.159 C=C(C)c1ccnc(c1F)C 271570a_100000694244_100009849794 [1,1,0,0,0,0|2,0,0]=4 2755 B11R1.159 C=C(C)c1ccnc(c1N)C 271570a_100000694244_100009885578 [1,1,0,0,0,0|2,0,0]=4 2756 B11R1.159 C=C(C)c1cncc(c1C)C 271570a_100000694244_100009864703 [1,1,0,0,0,0|2,0,0]=4 2757 B11R1.159 C=C(C)c1cncc(c1N)C 271570a_100000694244_100009818025 [1,1,0,0,0,0|2,0,0]=4 2758 B11R1.159 C=C(C)c1nccc(c1C)C 271570a_100000694244_100009847204 [1,1,0,0,0,0|2,0,0]=4 2759 B11R1.159 C=C(C)c1nccc(c1F)C 271570a_100000694244_100009817629 [1,1,0,0,0,0|2,0,0]=4 2760 B11R1.159 C=C(C)c1nccc(c1N)C 271570a_100000694244_100000763560 [1,1,0,0,0,0|2,0,0]=4 2761 B11R1.159 C=C(C)c1nccc(c1O)C 271570a_100000694244_100000696282 [1,1,0,0,0,0|1,0,0]=3 2762 B11R1.159 C=C(C)c1nccc(c1O)F 271570a_100000694244_100009867227 [1,1,0,0,0,0|2,0,0]=4 2763 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [1,1,0,0,0,0|1,0,1]=4 2764 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [1,1,0,0,0,0|1,0,1]=4 2765 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [1,1,0,0,0,0|1,0,1]=4 2766 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [1,1,0,0,0,0|1,0,1]=4 2767 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [1,1,0,0,0,0|1,0,1]=4 2768 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [1,1,0,0,0,0|1,0,1]=4 2769 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [1,1,0,0,0,0|0,0,1]=3 2770 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [1,1,0,0,0,0|1,0,1]=4 2771 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [1,1,0,0,0,0|1,0,1]=4 2772 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [1,1,0,0,0,0|1,0,1]=4 2773 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [1,1,0,0,0,0|1,0,1]=4 2774 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [1,1,0,0,0,0|1,0,1]=4 2775 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [1,1,0,0,0,0|1,0,1]=4 2776 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [1,1,0,0,0,0|1,0,1]=4 2777 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [1,1,0,0,0,0|1,0,1]=4 2778 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [1,1,0,0,0,0|1,0,1]=4 2779 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [1,1,0,0,0,0|1,0,1]=4 2780 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [1,1,0,0,0,0|1,0,0]=3 2781 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [1,1,0,0,0,0|0,0,1]=3 2782 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [1,1,0,0,0,0|2,0,0]=4 2783 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [1,1,0,0,0,0|1,0,1]=4 2784 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [1,1,0,0,0,0|1,0,1]=4 2785 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [1,1,0,0,0,0|1,0,1]=4 2786 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [1,1,0,0,0,0|1,0,1]=4 2787 B11R1.265 C=Cc1c(cccc1CC)C 271570a_100011290941_100000036235 [1,1,0,0,0,0|1,0,1]=4 2788 B11R1.265 C=Cc1c(cccc1CO)C 271570a_100011290941_100011659289 [1,1,0,0,0,0|2,0,0]=4 2789 B11R1.265 C=Cc1cccc(c1C#N)Br 271570a_100011290941_100010071968 [1,1,0,0,0,0|2,0,0]=4 2790 B11R1.265 C=Cc1cccc(c1C#N)C 271570a_100011290941_100009819585 [1,1,0,0,0,0|1,0,0]=3 2791 B11R1.265 C=Cc1cccc(c1C#N)Cl 271570a_100011290941_200000049503 [1,1,0,0,0,0|2,0,0]=4 2792 B11R1.265 C=Cc1cccc(c1C#N)F 271570a_100011290941_100000699744 [1,1,0,0,0,0|2,0,0]=4 2793 B11R1.265 C=Cc1cccc(c1C#N)N 271570a_100011290941_100011935054 [1,1,0,0,0,0|2,0,0]=4 2794 B11R1.265 C=Cc1cccc(c1C#N)O 271570a_100011290941_100012180507 [1,1,0,0,0,0|2,0,0]=4 2795 B11R1.265 C=Cc1cccc(c1C=O)C 271570a_100011290941_100000041122 [1,1,0,0,0,0|0,0,1]=3 2796 B11R1.265 C=Cc1cccc(c1C=O)Cl 271570a_100011290941_100010147682 [1,1,0,0,0,0|1,0,1]=4 2797 B11R1.265 C=Cc1cccc(c1C=O)F 271570a_100011290941_100000210083 [1,1,0,0,0,0|1,0,1]=4 2798 B11R1.265 C=Cc1cccc(c1C=O)N 271570a_100011290941_100010232536 [1,1,0,0,0,0|1,0,1]=4 2799 B11R1.265 C=Cc1cccc(c1C=O)O 271570a_100011290941_100009814793 [1,1,0,0,0,0|1,0,1]=4 2800 B11R1.265 C=Cc1cccc(c1CN)F 271570a_100011290941_100012349121 [1,1,0,0,0,0|2,0,0]=4 2801 B11R1.265 C=Cc1cccc(c1CO)F 271570a_100011290941_100012355691 [1,1,0,0,0,0|1,0,0]=3 2802 B11R1.265 C=Cc1cccc(c1CO)N 271570a_100011290941_100000747656 [1,1,0,0,0,0|1,0,0]=3 2803 B11R1.265 C=Cc1cccc(c1NC)N 271570a_100011290941_100010510394 [1,1,0,0,0,0|2,0,0]=4 2804 B11R1.265 C=Cc1cccc(c1NN)F 271570a_100011290941_100016994982 [1,1,0,0,0,0|2,0,0]=4 2805 B11R1.265 C=Cc1cccc(c1OC)Br 271570a_100011290941_100010146560 [1,1,0,0,0,0|1,0,0]=3 2806 B11R1.265 C=Cc1cccc(c1OC)C 271570a_100011290941_100010141385 [1,1,0,0,0,0|0,0,0]=2 2807 B11R1.265 C=Cc1cccc(c1OC)Cl 271570a_100011290941_100010147678 [1,1,0,0,0,0|1,0,0]=3 2808 B11R1.265 C=Cc1cccc(c1OC)F 271570a_100011290941_100009816759 [1,1,0,0,0,0|1,0,0]=3 2809 B11R1.265 C=Cc1cccc(c1OC)N 271570a_100011290941_100011935253 [1,1,0,0,0,0|1,0,0]=3 2810 B11R1.265 C=Cc1cccc(c1OC)O 271570a_100011290941_100010234590 [1,1,0,0,0,0|1,0,0]=3 2811 B11R1.265 C=Cc1cccc(c1SC)F 271570a_100011290941_200010709249 [1,1,0,0,0,0|1,1,0]=4 2812 B11R1.265 C=Cc1ccnc(c1CO)Cl 271570a_100011290941_100000047008 [1,1,0,0,0,0|2,0,0]=4 2813 B11R1.265 C=Cc1ccnc(c1CO)F 271570a_100011290941_100000050056 [1,1,0,0,0,0|2,0,0]=4 2814 B11R1.265 C=Cc1ccnc(c1OC)C 271570a_100011290941_100000685116 [1,1,0,0,0,0|1,0,0]=3 2815 B11R1.265 C=Cc1ccnc(c1OC)Cl 271570a_100011290941_100010068014 [1,1,0,0,0,0|2,0,0]=4 2816 B11R1.265 C=Cc1ccnc(c1OC)N 271570a_100011290941_100009880012 [1,1,0,0,0,0|2,0,0]=4 2817 B11R1.265 C=Cc1cncc(c1C#N)C 271570a_100011290941_200009887794 [1,1,0,0,0,0|2,0,0]=4 2818 B11R1.265 C=Cc1cncc(c1OC)N 271570a_100011290941_100012359933 [1,1,0,0,0,0|2,0,0]=4 2819 B11R1.265 C=Cc1nccc(c1C#N)C 271570a_100011290941_100000691447 [1,1,0,0,0,0|2,0,0]=4 2820 B11R1.265 C=Cc1nccc(c1OC)N 271570a_100011290941_100000104429 [1,1,0,0,0,0|2,0,0]=4 2821 B11R1.265 C=Cc1nccc(c1OC)O 271570a_100011290941_100000104430 [1,1,0,0,0,0|2,0,0]=4 2822 B11R1.265 CCc1cccc(c1NC)C 2230a_100000210048_200000210301 [1,1,0,0,0,0|1,0,1]=4 2823 B11R1.265 CCc1cccc(c1NC)C 34a_100000210048_200000210301 [1,1,0,0,0,0|1,0,1]=4 2824 B11R1.265 CCc1cccc(c1NC)C 7a_100000210048_200000210301 [1,1,0,0,0,0|1,0,1]=4 2825 B11R1.265 CCc1cccc(c1N[13CH3])C 2230a_100000210048_200025704644 [1,1,0,0,0,0|1,0,1]=4 2826 B11R1.265 CCc1cccc(c1N[13CH3])C 34a_100000210048_200025704644 [1,1,0,0,0,0|1,0,1]=4 2827 B11R1.265 CCc1cccc(c1N[13CH3])C 7a_100000210048_200025704644 [1,1,0,0,0,0|1,0,1]=4 2828 B11R1.265 CCc1cccc(c1OC)Br 34a_200010001580_200000210301 [1,1,0,0,0,0|1,0,1]=4 2829 B11R1.265 CCc1cccc(c1OC)Br 7a_200010001580_200000210301 [1,1,0,0,0,0|1,0,1]=4 2830 B11R1.265 CCc1cccc(c1OC)C 34a_100000034007_200000210301 [1,1,0,0,0,0|0,0,1]=3 2831 B11R1.265 CCc1cccc(c1OC)C 7a_100000034007_200000210301 [1,1,0,0,0,0|0,0,1]=3 2832 B11R1.265 CCc1cccc(c1O[13CH3])Br 34a_200010001580_200025704644 [1,1,0,0,0,0|1,0,1]=4 2833 B11R1.265 CCc1cccc(c1O[13CH3])Br 7a_200010001580_200025704644 [1,1,0,0,0,0|1,0,1]=4 2834 B11R1.265 CCc1cccc(c1O[13CH3])C 34a_100000034007_200025704644 [1,1,0,0,0,0|0,0,1]=3 2835 B11R1.265 CCc1cccc(c1O[13CH3])C 7a_100000034007_200025704644 [1,1,0,0,0,0|0,0,1]=3 2836 B11R1.265 CCc1cccc(c1SC)C 62a_100000036235_200000210301 [1,1,0,0,0,0|0,1,1]=4 2837 B11R1.265 CCc1cccc(c1SC)C 62a_200000210301_100000036235 [1,1,0,0,0,0|0,1,1]=4 2838 B11R1.265 CCc1cccc(c1S[13CH3])C 62a_100000036235_200025704644 [1,1,0,0,0,0|0,1,1]=4 2839 B11R1.265 CCc1cccc(c1S[13CH3])C 62a_200025704644_100000036235 [1,1,0,0,0,0|0,1,1]=4 2840 B11R1.265 CNc1c(cccc1CO)C 34a_100011215590_200000210301 [1,1,0,0,0,0|2,0,0]=4 2841 B11R1.265 CNc1cccc(c1OC)C 34a_100012017360_200000210301 [1,1,0,0,0,0|1,0,1]=4 2842 B11R1.265 COc1c(cccc1C#N)C 34a_100011659161_200000210301 [1,1,0,0,0,0|1,0,1]=4 2843 B11R1.265 COc1c(cccc1C#N)C 7a_100011659161_200000210301 [1,1,0,0,0,0|1,0,1]=4 2844 B11R1.265 COc1c(cccc1C=O)O 271570a_203496583355_100000692592 [1,1,0,0,0,0|2,0,0]=4 2845 B11R1.265 COc1c(cccc1CN)C 34a_100020639391_200000210301 [1,1,0,0,0,0|1,0,0]=3 2846 B11R1.265 COc1c(cccc1CO)F 34a_100011997349_200000210301 [1,1,0,0,0,0|2,0,0]=4 2847 B11R1.265 COc1c(cccc1CO)F 7a_100011997349_200000210301 [1,1,0,0,0,0|2,0,0]=4 2848 B11R1.265 COc1c(cccc1CO)O 271570a_203496583355_100000704359 [1,1,0,0,0,0|2,0,0]=4 2849 B11R1.265 COc1c(cccc1N[13CH3])C 34a_100012017360_200025704644 [1,1,0,0,0,0|1,0,1]=4 2850 B11R1.265 COc1c(cccc1SC)C 62a_100010141385_200000210301 [1,1,0,0,0,0|1,0,1]=4 2851 B11R1.265 COc1c(cccc1SC)C 62a_200000210301_100010141385 [1,1,0,0,0,0|1,0,1]=4 2852 B11R1.265 COc1c(cccc1S[13CH3])C 62a_100010141385_200025704644 [1,1,0,0,0,0|1,0,1]=4 2853 B11R1.265 COc1c(cccc1S[13CH3])C 62a_200025704644_100010141385 [1,1,0,0,0,0|1,0,1]=4 2854 B11R1.265 COc1cccc(c1CO)C 34a_200009874777_200000210301 [1,1,0,0,0,0|1,0,1]=4 2855 B11R1.265 COc1cccc(c1CO)C 7a_200009874777_200000210301 [1,1,0,0,0,0|1,0,1]=4 2856 B11R1.265 COc1cccc(c1OC)C 34a_100011219253_200000210301 [1,1,0,0,0,0|1,0,1]=4 2857 B11R1.265 COc1cccc(c1OC)C 7a_100011219253_200000210301 [1,1,0,0,0,0|1,0,1]=4 2858 B11R1.265 COc1cccc(c1O[13CH3])C 34a_100011219253_200025704644 [1,1,0,0,0,0|1,0,1]=4 2859 B11R1.265 COc1cccc(c1O[13CH3])C 7a_100011219253_200025704644 [1,1,0,0,0,0|1,0,1]=4 2860 B11R1.265 CSc1c(cccc1C=O)C 62a_100012186367_200000210301 [1,1,0,0,0,0|1,1,0]=4 2861 B11R1.265 CSc1c(cccc1C=O)C 62a_200000210301_100012186367 [1,1,0,0,0,0|1,1,0]=4 2862 B11R1.265 CSc1c(cccc1CO)C 62a_100011659289_200000210301 [1,1,0,0,0,0|1,1,0]=4 2863 B11R1.265 CSc1c(cccc1CO)C 62a_200000210301_100011659289 [1,1,0,0,0,0|1,1,0]=4 2864 B11R1.265 Cc1cccc(c1CO)O[13CH3] 34a_200009874777_200025704644 [1,1,0,0,0,0|1,0,1]=4 2865 B11R1.265 Cc1cccc(c1CO)O[13CH3] 7a_200009874777_200025704644 [1,1,0,0,0,0|1,0,1]=4 2866 B11R1.265 Cc1cccc(c1N[13CH3])CO 34a_100011215590_200025704644 [1,1,0,0,0,0|2,0,0]=4 2867 B11R1.265 Cc1cccc(c1O[13CH3])C#N 34a_100011659161_200025704644 [1,1,0,0,0,0|1,0,1]=4 2868 B11R1.265 Cc1cccc(c1O[13CH3])C#N 7a_100011659161_200025704644 [1,1,0,0,0,0|1,0,1]=4 2869 B11R1.265 Cc1cccc(c1O[13CH3])CN 34a_100020639391_200025704644 [1,1,0,0,0,0|1,0,0]=3 2870 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_100012186367_200025704644 [1,1,0,0,0,0|1,1,0]=4 2871 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_200025704644_100012186367 [1,1,0,0,0,0|1,1,0]=4 2872 B11R1.265 Cc1cccc(c1S[13CH3])CO 62a_100011659289_200025704644 [1,1,0,0,0,0|1,1,0]=4 2873 B11R1.265 Cc1cccc(c1S[13CH3])CO 62a_200025704644_100011659289 [1,1,0,0,0,0|1,1,0]=4 2874 B11R1.265 [13CH3]Oc1c(cccc1CO)F 34a_100011997349_200025704644 [1,1,0,0,0,0|2,0,0]=4 2875 B11R1.265 [13CH3]Oc1c(cccc1CO)F 7a_100011997349_200025704644 [1,1,0,0,0,0|2,0,0]=4 2876 B11R1.267 C=Cc1cccc(c1Br)CO 271570a_100011290941_100010240205 [1,1,0,0,0,0|1,0,0]=3 2877 B11R1.267 C=Cc1cccc(c1C)C#N 271570a_100011290941_100000721996 [1,1,0,0,0,0|1,0,1]=4 2878 B11R1.267 C=Cc1cccc(c1C)C=O 271570a_100011290941_100012179384 [1,1,0,0,0,0|1,0,1]=4 2879 B11R1.267 C=Cc1cccc(c1C)CN 271570a_100011290941_100000724210 [1,1,0,0,0,0|1,0,0]=3 2880 B11R1.267 C=Cc1cccc(c1C)CO 271570a_100011290941_100000694458 [1,1,0,0,0,0|1,0,0]=3 2881 B11R1.267 C=Cc1cccc(c1C)OC 271570a_100011290941_100010002647 [1,1,0,0,0,0|1,0,0]=3 2882 B11R1.267 C=Cc1cccc(c1Cl)OC 271570a_100011290941_100010147677 [1,1,0,0,0,0|1,0,0]=3 2883 B11R1.267 C=Cc1cccc(c1F)C#N 271570a_100011290941_100011934600 [1,1,0,0,0,0|1,0,1]=4 2884 B11R1.267 C=Cc1cccc(c1F)C=O 271570a_100011290941_100000766533 [1,1,0,0,0,0|1,0,1]=4 2885 B11R1.267 C=Cc1cccc(c1F)CN 271570a_100011290941_100015189953 [1,1,0,0,0,0|1,0,0]=3 2886 B11R1.267 C=Cc1cccc(c1F)CO 271570a_100011290941_100011935076 [1,1,0,0,0,0|1,0,0]=3 2887 B11R1.267 C=Cc1cccc(c1F)OC 271570a_100011290941_100010185846 [1,1,0,0,0,0|1,0,0]=3 2888 B11R1.267 C=Cc1cccc(c1F)SC 62a_100010741937_200000210301 [1,1,0,0,0,0|1,0,0]=3 2889 B11R1.267 C=Cc1cccc(c1F)SC 62a_200000210301_100010741937 [1,1,0,0,0,0|1,0,0]=3 2890 B11R1.267 C=Cc1cccc(c1F)S[13CH3] 62a_100010741937_200025704644 [1,1,0,0,0,0|1,0,0]=3 2891 B11R1.267 C=Cc1cccc(c1F)S[13CH3] 62a_200025704644_100010741937 [1,1,0,0,0,0|1,0,0]=3 2892 B11R1.267 C=Cc1cccc(c1N)C#N 271570a_100011290941_100000690598 [1,1,0,0,0,0|1,0,1]=4 2893 B11R1.267 C=Cc1cccc(c1N)C=O 271570a_100011290941_100010144990 [1,1,0,0,0,0|1,0,1]=4 2894 B11R1.267 C=Cc1cccc(c1N)CO 271570a_100011290941_100012349457 [1,1,0,0,0,0|1,0,0]=3 2895 B11R1.267 C=Cc1cccc(c1N)NC 271570a_100011290941_100000695761 [1,1,0,0,0,0|1,0,0]=3 2896 B11R1.267 C=Cc1cccc(c1N)OC 271570a_100011290941_100000708083 [1,1,0,0,0,0|1,0,0]=3 2897 B11R1.267 C=Cc1cccc(c1O)C#N 271570a_100011290941_100009817103 [1,1,0,0,0,0|0,0,1]=3 2898 B11R1.267 C=Cc1cccc(c1O)C=O 271570a_100011290941_100000737635 [1,1,0,0,0,0|0,0,1]=3 2899 B11R1.267 C=Cc1cccc(c1O)CC 271570a_100011290941_200010001580 [1,1,0,0,0,0|0,0,0]=2 2900 B11R1.267 C=Cc1cccc(c1O)OC 271570a_100011290941_100000686866 [1,1,0,0,0,0|0,0,0]=2 2901 B11R1.267 C=Cc1ccnc(c1C)OC 271570a_100011290941_100010068544 [1,1,0,0,0,0|2,0,0]=4 2902 B11R1.267 C=Cc1ccnc(c1F)OC 271570a_100011290941_100009885657 [1,1,0,0,0,0|2,0,0]=4 2903 B11R1.267 C=Cc1cncc(c1C)OC 271570a_100011290941_100010136163 [1,1,0,0,0,0|2,0,0]=4 2904 B11R1.267 C=Cc1cncc(c1N)CO 271570a_100011290941_200010988789 [1,1,0,0,0,0|2,0,0]=4 2905 B11R1.267 C=Cc1nccc(c1C)OC 271570a_100011290941_100010067686 [1,1,0,0,0,0|2,0,0]=4 2906 B11R1.267 C=Cc1nccc(c1F)CO 271570a_100011290941_100000101314 [1,1,0,0,0,0|2,0,0]=4 2907 B11R1.267 C=Cc1nccc(c1F)OC 271570a_100011290941_200010136267 [1,1,0,0,0,0|2,0,0]=4 2908 B11R1.267 C=Cc1nccc(c1F)SC 271570a_100011290941_200021123860 [1,1,0,0,0,0|2,0,0]=4 2909 B11R1.267 C=Cc1nccc(c1N)NC 271570a_100011290941_200000076579 [1,1,0,0,0,0|2,0,0]=4 2910 B11R1.267 C=Cc1nccc(c1N)OC 271570a_100011290941_100000100113 [1,1,0,0,0,0|2,0,0]=4 2911 B11R1.267 CCc1cccc(c1O)CC 271570a_203496583355_100010212195 [1,1,0,0,0,0|0,0,1]=3 2912 B11R1.267 CCc1cccc(c1O)SC 62a_200000210301_200010001580 [1,1,0,0,0,0|0,0,1]=3 2913 B11R1.267 CCc1cccc(c1O)SC 62a_200010001580_200000210301 [1,1,0,0,0,0|0,0,1]=3 2914 B11R1.267 CCc1cccc(c1O)S[13CH3] 62a_200010001580_200025704644 [1,1,0,0,0,0|0,0,1]=3 2915 B11R1.267 CCc1cccc(c1O)S[13CH3] 62a_200025704644_200010001580 [1,1,0,0,0,0|0,0,1]=3 2916 B11R1.267 CNc1cccc(c1C)CO 2230a_102495339961_200000210301 [1,1,0,0,0,0|2,0,0]=4 2917 B11R1.267 CNc1cccc(c1C)CO 34a_102495339961_200000210301 [1,1,0,0,0,0|2,0,0]=4 2918 B11R1.267 CNc1cccc(c1F)CO 34a_100012023829_200000210301 [1,1,0,0,0,0|2,0,0]=4 2919 B11R1.267 CNc1cccc(c1O)OC 34a_100000123586_200000210301 [1,1,0,0,0,0|1,0,1]=4 2920 B11R1.267 COc1cccc(c1C)CO 34a_200000084602_200000210301 [1,1,0,0,0,0|2,0,0]=4 2921 B11R1.267 COc1cccc(c1C)CO 7a_200000084602_200000210301 [1,1,0,0,0,0|2,0,0]=4 2922 B11R1.267 COc1cccc(c1F)CN 34a_100025773512_200000210301 [1,1,0,0,0,0|2,0,0]=4 2923 B11R1.267 COc1cccc(c1O)CO 271570a_203496583355_100010236476 [1,1,0,0,0,0|1,0,0]=3 2924 B11R1.267 COc1cccc(c1O)N[13CH3] 34a_100000123586_200025704644 [1,1,0,0,0,0|1,0,1]=4 2925 B11R1.267 COc1cccc(c1O)OC 271570a_203496583355_100000050062 [1,1,0,0,0,0|1,0,1]=4 2926 B11R1.267 COc1cccc(c1O)SC 62a_200000210301_100000686866 [1,1,0,0,0,0|1,0,1]=4 2927 B11R1.267 COc1cccc(c1O)S[13CH3] 62a_200025704644_100000686866 [1,1,0,0,0,0|1,0,1]=4 2928 B11R1.267 CSc1cccc(c1Br)CO 62a_100010240205_200000210301 [1,1,0,0,0,0|2,0,0]=4 2929 B11R1.267 CSc1cccc(c1Br)CO 62a_200000210301_100010240205 [1,1,0,0,0,0|2,0,0]=4 2930 B11R1.267 CSc1cccc(c1C)C=O 62a_100012179384_200000210301 [1,1,0,0,0,0|2,0,0]=4 2931 B11R1.267 CSc1cccc(c1C)C=O 62a_200000210301_100012179384 [1,1,0,0,0,0|2,0,0]=4 2932 B11R1.267 CSc1cccc(c1C)CN 62a_100000724210_200000210301 [1,1,0,0,0,0|2,0,0]=4 2933 B11R1.267 CSc1cccc(c1C)CN 62a_200000210301_100000724210 [1,1,0,0,0,0|2,0,0]=4 2934 B11R1.267 CSc1cccc(c1C)CO 62a_100000694458_200000210301 [1,1,0,0,0,0|2,0,0]=4 2935 B11R1.267 CSc1cccc(c1C)CO 62a_200000210301_100000694458 [1,1,0,0,0,0|2,0,0]=4 2936 B11R1.267 CSc1cccc(c1F)C=O 62a_100000766533_200000210301 [1,1,0,0,0,0|2,0,0]=4 2937 B11R1.267 CSc1cccc(c1F)C=O 62a_200000210301_100000766533 [1,1,0,0,0,0|2,0,0]=4 2938 B11R1.267 CSc1cccc(c1F)CN 62a_100015189953_200000210301 [1,1,0,0,0,0|2,0,0]=4 2939 B11R1.267 CSc1cccc(c1F)CN 62a_200000210301_100015189953 [1,1,0,0,0,0|2,0,0]=4 2940 B11R1.267 CSc1cccc(c1F)CO 62a_100011935076_200000210301 [1,1,0,0,0,0|2,0,0]=4 2941 B11R1.267 CSc1cccc(c1F)CO 62a_200000210301_100011935076 [1,1,0,0,0,0|2,0,0]=4 2942 B11R1.267 CSc1cccc(c1N)C=O 62a_100010144990_200000210301 [1,1,0,0,0,0|2,0,0]=4 2943 B11R1.267 CSc1cccc(c1N)CO 62a_100012349457_200000210301 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.267 CSc1cccc(c1N)CO 62a_200000210301_100012349457 [1,1,0,0,0,0|2,0,0]=4 2945 B11R1.267 CSc1cccc(c1O)C#N 62a_200000210301_100009817103 [1,1,0,0,0,0|1,0,1]=4 2946 B11R1.267 CSc1cccc(c1O)C=O 62a_200000210301_100010171435 [1,1,0,0,0,0|1,0,0]=3 2947 B11R1.267 CSc1cncc(c1O)C=O 62a_100010729654_200000210301 [1,1,0,0,0,0|2,0,0]=4 2948 B11R1.267 CSc1cncc(c1O)C=O 62a_200000210301_100010729654 [1,1,0,0,0,0|2,0,0]=4 2949 B11R1.267 Cc1c(cccc1N[13CH3])CO 2230a_102495339961_200025704644 [1,1,0,0,0,0|2,0,0]=4 2950 B11R1.267 Cc1c(cccc1N[13CH3])CO 34a_102495339961_200025704644 [1,1,0,0,0,0|2,0,0]=4 2951 B11R1.267 Cc1c(cccc1O[13CH3])CO 34a_200000084602_200025704644 [1,1,0,0,0,0|2,0,0]=4 2952 B11R1.267 Cc1c(cccc1O[13CH3])CO 7a_200000084602_200025704644 [1,1,0,0,0,0|2,0,0]=4 2953 B11R1.267 Cc1c(cccc1S[13CH3])C=O 62a_100012179384_200025704644 [1,1,0,0,0,0|2,0,0]=4 2954 B11R1.267 Cc1c(cccc1S[13CH3])C=O 62a_200025704644_100012179384 [1,1,0,0,0,0|2,0,0]=4 2955 B11R1.267 Cc1c(cccc1S[13CH3])CN 62a_100000724210_200025704644 [1,1,0,0,0,0|2,0,0]=4 2956 B11R1.267 Cc1c(cccc1S[13CH3])CN 62a_200025704644_100000724210 [1,1,0,0,0,0|2,0,0]=4 2957 B11R1.267 Cc1c(cccc1S[13CH3])CO 62a_100000694458_200025704644 [1,1,0,0,0,0|2,0,0]=4 2958 B11R1.267 Cc1c(cccc1S[13CH3])CO 62a_200025704644_100000694458 [1,1,0,0,0,0|2,0,0]=4 2959 B11R1.267 N#Cc1cccc(c1O)C=O 271570a_203496583355_100010133059 [1,1,0,0,0,0|1,0,1]=4 2960 B11R1.267 [13CH3]Nc1cccc(c1F)CO 34a_100012023829_200025704644 [1,1,0,0,0,0|2,0,0]=4 2961 B11R1.267 [13CH3]Oc1cccc(c1F)CN 34a_100025773512_200025704644 [1,1,0,0,0,0|2,0,0]=4 2962 B11R1.267 [13CH3]Sc1cccc(c1Br)CO 62a_100010240205_200025704644 [1,1,0,0,0,0|2,0,0]=4 2963 B11R1.267 [13CH3]Sc1cccc(c1Br)CO 62a_200025704644_100010240205 [1,1,0,0,0,0|2,0,0]=4 2964 B11R1.267 [13CH3]Sc1cccc(c1F)C=O 62a_100000766533_200025704644 [1,1,0,0,0,0|2,0,0]=4 2965 B11R1.267 [13CH3]Sc1cccc(c1F)C=O 62a_200025704644_100000766533 [1,1,0,0,0,0|2,0,0]=4 2966 B11R1.267 [13CH3]Sc1cccc(c1F)CN 62a_100015189953_200025704644 [1,1,0,0,0,0|2,0,0]=4 2967 B11R1.267 [13CH3]Sc1cccc(c1F)CN 62a_200025704644_100015189953 [1,1,0,0,0,0|2,0,0]=4 2968 B11R1.267 [13CH3]Sc1cccc(c1F)CO 62a_100011935076_200025704644 [1,1,0,0,0,0|2,0,0]=4 2969 B11R1.267 [13CH3]Sc1cccc(c1F)CO 62a_200025704644_100011935076 [1,1,0,0,0,0|2,0,0]=4 2970 B11R1.267 [13CH3]Sc1cccc(c1N)C=O 62a_100010144990_200025704644 [1,1,0,0,0,0|2,0,0]=4 2971 B11R1.267 [13CH3]Sc1cccc(c1N)CO 62a_100012349457_200025704644 [1,1,0,0,0,0|2,0,0]=4 2972 B11R1.267 [13CH3]Sc1cccc(c1N)CO 62a_200025704644_100012349457 [1,1,0,0,0,0|2,0,0]=4 2973 B11R1.267 [13CH3]Sc1cccc(c1O)C#N 62a_200025704644_100009817103 [1,1,0,0,0,0|1,0,1]=4 2974 B11R1.267 [13CH3]Sc1cccc(c1O)C=O 62a_200025704644_100010171435 [1,1,0,0,0,0|1,0,0]=3 2975 B11R1.267 [13CH3]Sc1cncc(c1O)C=O 62a_100010729654_200025704644 [1,1,0,0,0,0|2,0,0]=4 2976 B11R1.267 [13CH3]Sc1cncc(c1O)C=O 62a_200025704644_100010729654 [1,1,0,0,0,0|2,0,0]=4 2977 B11R1.278 C=Cc1cc[n+](c(c1C)C)[O-] 271570a_100011290941_100000083769 [1,1,0,0,0,0|2,0,0]=4 2978 B11R1.278 C=Cc1ccc(c(c1C)C)Br 271570a_100011290941_200010185626 [1,1,0,0,0,0|1,0,0]=3 2979 B11R1.278 C=Cc1ccc(c(c1C)C)F 271570a_100011290941_100009816033 [1,1,0,0,0,0|1,0,0]=3 2980 B11R1.278 C=Cc1ccc(c(c1C)C)N 271570a_100011290941_100009816967 [1,1,0,0,0,0|1,0,0]=3 2981 B11R1.278 C=Cc1ccc(c(c1C)C)O 271570a_100011290941_100012353674 [1,1,0,0,0,0|1,0,0]=3 2982 B11R1.278 C=Cc1ccc(c(c1C)Cl)Br 271570a_100011290941_200010212245 [1,1,0,0,0,0|2,0,0]=4 2983 B11R1.278 C=Cc1ccc(c(c1C)F)Br 271570a_100011290941_100010208201 [1,1,0,0,0,0|2,0,0]=4 2984 B11R1.278 C=Cc1ccc(c(c1C)F)F 271570a_100011290941_100009815991 [1,1,0,0,0,0|2,0,0]=4 2985 B11R1.278 C=Cc1ccc(c(c1C)F)N 271570a_100011290941_100000722916 [1,1,0,0,0,0|2,0,0]=4 2986 B11R1.278 C=Cc1ccc(c(c1C)N)C 271570a_100011290941_200010074581 [1,1,0,0,0,0|2,0,0]=4 2987 B11R1.278 C=Cc1ccc(c(c1C)N)F 271570a_100011290941_100010588651 [1,1,0,0,0,0|2,0,0]=4 2988 B11R1.278 C=Cc1ccc(c(c1C)N)N 271570a_100011290941_100010009725 [1,1,0,0,0,0|2,0,0]=4 2989 B11R1.278 C=Cc1ccc(c(c1C)N)O 271570a_100011290941_100013039247 [1,1,0,0,0,0|2,0,0]=4 2990 B11R1.278 C=Cc1ccc(c(c1Cl)C)Br 271570a_100011290941_100055076181 [1,1,0,0,0,0|1,0,0]=3 2991 B11R1.278 C=Cc1ccc(c(c1Cl)C)Cl 271570a_100011290941_100010730154 [1,1,0,0,0,0|1,0,0]=3 2992 B11R1.278 C=Cc1ccc(c(c1Cl)Cl)Br 271570a_100011290941_200012356690 [1,1,0,0,0,0|2,0,0]=4 2993 B11R1.278 C=Cc1ccc(c(c1F)Br)F 271570a_100011290941_100010167943 [1,1,0,0,0,0|2,0,0]=4 2994 B11R1.278 C=Cc1ccc(c(c1F)Br)N 271570a_100011290941_100015781493 [1,1,0,0,0,0|2,0,0]=4 2995 B11R1.278 C=Cc1ccc(c(c1F)C)C 271570a_100011290941_200015555822 [1,1,0,0,0,0|1,0,0]=3 2996 B11R1.278 C=Cc1ccc(c(c1F)C)F 271570a_100011290941_100009815987 [1,1,0,0,0,0|1,0,0]=3 2997 B11R1.278 C=Cc1ccc(c(c1F)C)N 271570a_100011290941_100010208198 [1,1,0,0,0,0|1,0,0]=3 2998 B11R1.278 C=Cc1ccc(c(c1F)C)O 271570a_100011290941_100010390934 [1,1,0,0,0,0|1,0,0]=3 2999 B11R1.278 C=Cc1ccc(c(c1F)Cl)Br 271570a_100011290941_100010212236 [1,1,0,0,0,0|2,0,0]=4 3000 B11R1.278 C=Cc1ccc(c(c1F)Cl)F 271570a_100011290941_200000038702 [1,1,0,0,0,0|2,0,0]=4 3001 B11R1.278 C=Cc1ccc(c(c1F)F)Br 271570a_100011290941_100010212264 [1,1,0,0,0,0|2,0,0]=4 3002 B11R1.278 C=Cc1ccc(c(c1F)F)C 271570a_100011290941_100012766498 [1,1,0,0,0,0|2,0,0]=4 3003 B11R1.278 C=Cc1ccc(c(c1F)F)F 271570a_100011290941_100000750562 [1,1,0,0,0,0|2,0,0]=4 3004 B11R1.278 C=Cc1ccc(c(c1F)F)N 271570a_100011290941_100010200256 [1,1,0,0,0,0|2,0,0]=4 3005 B11R1.278 C=Cc1ccc(c(c1F)F)O 271570a_100011290941_100011830415 [1,1,0,0,0,0|2,0,0]=4 3006 B11R1.278 C=Cc1ccc(c(c1F)N)F 271570a_100011290941_100025793129 [1,1,0,0,0,0|2,0,0]=4 3007 B11R1.278 C=Cc1ccc(c(c1F)N)N 271570a_100011290941_100009814308 [1,1,0,0,0,0|2,0,0]=4 3008 B11R1.278 C=Cc1ccc(c(c1F)O)Br 271570a_100011290941_200010782288 [1,1,0,0,0,0|2,0,0]=4 3009 B11R1.278 C=Cc1ccc(c(c1F)O)F 271570a_100011290941_100010167067 [1,1,0,0,0,0|2,0,0]=4 3010 B11R1.278 C=Cc1ccc(c(c1N)C)F 271570a_100011290941_100011009917 [1,1,0,0,0,0|1,0,0]=3 3011 B11R1.278 C=Cc1ccc(c(c1N)F)F 271570a_100011290941_100010008850 [1,1,0,0,0,0|2,0,0]=4 3012 B11R1.278 C=Cc1ccc(c(c1N)N)F 271570a_100011290941_100011102919 [1,1,0,0,0,0|2,0,0]=4 3013 B11R1.278 C=Cc1ccc(c(c1N)O)Br 271570a_100011290941_100020748643 [1,1,0,0,0,0|2,0,0]=4 3014 B11R1.278 C=Cc1ccc(c(c1O)C)F 271570a_100011290941_200010391124 [1,1,0,0,0,0|0,0,0]=2 3015 B11R1.278 C=Cc1ccc(c(c1O)F)C 271570a_100011290941_100000722096 [1,1,0,0,0,0|1,0,0]=3 3016 B11R1.278 C=Cc1ccc(c(c1O)F)F 271570a_100011290941_100010243909 [1,1,0,0,0,0|1,0,0]=3 3017 B11R1.278 C=Cc1cnc(c(c1C)C)N 271570a_100011290941_100009813837 [1,1,0,0,0,0|2,0,0]=4 3018 B11R1.278 C=Cc1cnc(c(c1C)C)O 271570a_100011290941_200011099879 [1,1,0,0,0,0|2,0,0]=4 3019 B11R1.278 CSc1ccc(c(c1O)C)F 62a_200000210301_200010391124 [1,1,0,0,0,0|1,0,1]=4 3020 B11R1.278 CSc1ccc(c(c1O)C)F 62a_200010391124_200000210301 [1,1,0,0,0,0|1,0,1]=4 3021 B11R1.278 Cc1c(ccc(c1F)C=O)O 271570a_203496583355_100015546853 [1,1,0,0,0,0|2,0,0]=4 3022 B11R1.278 Cc1c(ccc(c1O)C#N)F 271570a_203496583355_100009859896 [1,1,0,0,0,0|1,0,1]=4 3023 B11R1.278 Cc1c(ccc(c1O)C=O)F 271570a_203496583355_100009872231 [1,1,0,0,0,0|1,0,0]=3 3024 B11R1.278 Cc1c(ccc(c1O)S[13CH3])F 62a_200010391124_200025704644 [1,1,0,0,0,0|1,0,1]=4 3025 B11R1.278 Cc1c(ccc(c1O)S[13CH3])F 62a_200025704644_200010391124 [1,1,0,0,0,0|1,0,1]=4 3026 B11R1.278 O=Cc1ccc(c(c1O)F)F 271570a_203496583355_100015087033 [1,1,0,0,0,0|2,0,0]=4 3027 B11R1.278 O=Cc1ccc(c(c1O)F)O 271570a_203496583355_100010762540 [1,1,0,0,0,0|2,0,0]=4 3028 B11R1.278 OCc1ccc(c(c1O)F)F 271570a_203496583355_100015087060 [1,1,0,0,0,0|2,0,0]=4 3029 B11R1.17 C#CCNc1ccccc1O 34a_100000185747_100000184674 [1,1,0,0,0,0|0,0,2]=4 3030 B11R1.17 C#CCSc1ccccc1O 62a_100000038162_100000739446 [1,1,0,0,0,0|0,0,2]=4 3031 B11R1.17 C=CCNc1ccccc1Br 34a_100000210017_100015514636 [1,1,0,0,0,0|1,0,0]=3 3032 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [1,1,0,0,0,0|1,0,0]=3 3033 B11R1.17 C=CCNc1ccccc1Cl 34a_100000185783_100015514636 [1,1,0,0,0,0|1,0,0]=3 3034 B11R1.17 C=CCNc1ccccc1F 34a_100000210422_100015514636 [1,1,0,0,0,0|1,0,0]=3 3035 B11R1.17 C=CCNc1ccccc1I 34a_100000210053_100015514636 [1,1,0,0,0,0|1,0,0]=3 3036 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [1,1,0,0,0,0|0,0,0]=2 3037 B11R1.17 C=CCNc1ccncc1Br 27a_100020586998_100000726257 [1,1,0,0,0,0|2,0,0]=4 3038 B11R1.17 C=CCNc1ccncc1C 27a_100020586998_100000765111 [1,1,0,0,0,0|2,0,0]=4 3039 B11R1.17 C=CCNc1ccncc1F 27a_100020586998_100000035921 [1,1,0,0,0,0|2,0,0]=4 3040 B11R1.17 C=CCNc1ncccc1Br 27a_100020586998_100000696092 [1,1,0,0,0,0|2,0,0]=4 3041 B11R1.17 C=CCOc1cccc[n+]1[O-] 7a_100000211761_100015514636 [1,1,0,0,0,0|1,0,1]=4 3042 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [1,1,0,0,0,0|1,0,0]=3 3043 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [1,1,0,0,0,0|1,0,0]=3 3044 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [1,1,0,0,0,0|1,0,0]=3 3045 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [1,1,0,0,0,0|1,0,0]=3 3046 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [1,1,0,0,0,0|1,0,0]=3 3047 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [1,1,0,0,0,0|1,0,0]=3 3048 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [1,1,0,0,0,0|1,0,0]=3 3049 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [1,1,0,0,0,0|1,0,0]=3 3050 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [1,1,0,0,0,0|1,0,0]=3 3051 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [1,1,0,0,0,0|1,0,0]=3 3052 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [1,1,0,0,0,0|1,0,0]=3 3053 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [1,1,0,0,0,0|1,0,0]=3 3054 B11R1.17 C=CCOc1cccnc1Br 34a_100000744436_100015514636 [1,1,0,0,0,0|2,0,0]=4 3055 B11R1.17 C=CCOc1cccnc1Br 7a_100000744436_100015514636 [1,1,0,0,0,0|2,0,0]=4 3056 B11R1.17 C=CCOc1cccnc1C 34a_100000745507_100015514636 [1,1,0,0,0,0|2,0,0]=4 3057 B11R1.17 C=CCOc1cccnc1C 7a_100000745507_100015514636 [1,1,0,0,0,0|2,0,0]=4 3058 B11R1.17 C=CCOc1cccnc1Cl 34a_100000757616_100015514636 [1,1,0,0,0,0|2,0,0]=4 3059 B11R1.17 C=CCOc1cccnc1Cl 7a_100000757616_100015514636 [1,1,0,0,0,0|2,0,0]=4 3060 B11R1.17 C=CCOc1cccnc1F 34a_100000061740_100015514636 [1,1,0,0,0,0|2,0,0]=4 3061 B11R1.17 C=CCOc1cccnc1F 7a_100000061740_100015514636 [1,1,0,0,0,0|2,0,0]=4 3062 B11R1.17 C=CCOc1cccnc1I 34a_100000034122_100015514636 [1,1,0,0,0,0|2,0,0]=4 3063 B11R1.17 C=CCOc1cccnc1I 7a_100000034122_100015514636 [1,1,0,0,0,0|2,0,0]=4 3064 B11R1.17 C=CCOc1cccnc1N 34a_100000211975_100015514636 [1,1,0,0,0,0|2,0,0]=4 3065 B11R1.17 C=CCOc1cccnc1N 7a_100000211975_100015514636 [1,1,0,0,0,0|2,0,0]=4 3066 B11R1.17 C=CCOc1cccoc1=O 34a_100000077404_100015514636 [1,1,0,0,0,0|1,0,1]=4 3067 B11R1.17 C=CCOc1cccoc1=O 7a_100000077404_100015514636 [1,1,0,0,0,0|1,0,1]=4 3068 B11R1.17 C=CCOc1ccncc1Br 34a_100011996408_100015514636 [1,1,0,0,0,0|2,0,0]=4 3069 B11R1.17 C=CCOc1ccncc1C 34a_100000694293_100015514636 [1,1,0,0,0,0|2,0,0]=4 3070 B11R1.17 C=CCOc1ccncc1Cl 34a_100011997054_100015514636 [1,1,0,0,0,0|2,0,0]=4 3071 B11R1.17 C=CCOc1ccncc1F 34a_200000081243_100015514636 [1,1,0,0,0,0|2,0,0]=4 3072 B11R1.17 C=CCOc1cnccc1C 34a_100011997053_100015514636 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.17 C=CCOc1cnccc1C 7a_100011997053_100015514636 [1,1,0,0,0,0|2,0,0]=4 3074 B11R1.17 C=CCOc1cnccc1Cl 34a_100011996695_100015514636 [1,1,0,0,0,0|2,0,0]=4 3075 B11R1.17 C=CCOc1cnccc1I 34a_100000050107_100015514636 [1,1,0,0,0,0|2,0,0]=4 3076 B11R1.17 C=CCOc1cnccc1N 34a_100000753702_100015514636 [1,1,0,0,0,0|2,0,0]=4 3077 B11R1.17 C=CCOc1coccc1=O 34a_100000060831_100015514636 [1,1,0,0,0,0|1,0,1]=4 3078 B11R1.17 C=CCOc1ncccc1Cl 34a_100011290957_100015514636 [1,1,0,0,0,0|2,0,0]=4 3079 B11R1.17 C=CCOc1ncccc1F 34a_100011219419_100015514636 [1,1,0,0,0,0|2,0,0]=4 3080 B11R1.17 C=CCOc1ncccc1N 34a_100000746358_100015514636 [1,1,0,0,0,0|2,0,0]=4 3081 B11R1.17 C=CCSc1c[nH]ccc1=O 62a_100000210623_100009998708 [1,1,0,0,0,0|1,0,1]=4 3082 B11R1.17 C=CCSc1c[nH]ccc1=O 62a_100009998708_100000210623 [1,1,0,0,0,0|1,0,1]=4 3083 B11R1.17 C=CCSc1c[nH]ccc1=S 62a_100000210623_200012280681 [1,1,0,0,0,0|1,1,0]=4 3084 B11R1.17 C=CCSc1c[nH]ccc1=S 62a_200012280681_100000210623 [1,1,0,0,0,0|1,1,0]=4 3085 B11R1.17 C=CCSc1cccc[n+]1C 62a_100000210623_100000212160 [1,1,0,0,0,0|2,0,0]=4 3086 B11R1.17 C=CCSc1cccc[n+]1[O-] 62a_100000210623_200000042595 [1,1,0,0,0,0|1,0,1]=4 3087 B11R1.17 C=CCSc1ccccc1Br 62a_100000210623_100000695589 [1,1,0,0,0,0|1,0,0]=3 3088 B11R1.17 C=CCSc1ccccc1Br 62a_100000695589_100000210623 [1,1,0,0,0,0|1,0,0]=3 3089 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [1,1,0,0,0,0|1,0,0]=3 3090 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [1,1,0,0,0,0|1,0,0]=3 3091 B11R1.17 C=CCSc1ccccc1Cl 62a_100000210623_100000764095 [1,1,0,0,0,0|1,0,0]=3 3092 B11R1.17 C=CCSc1ccccc1Cl 62a_100000764095_100000210623 [1,1,0,0,0,0|1,0,0]=3 3093 B11R1.17 C=CCSc1ccccc1F 62a_100000210623_100011215700 [1,1,0,0,0,0|1,0,0]=3 3094 B11R1.17 C=CCSc1ccccc1F 62a_100011215700_100000210623 [1,1,0,0,0,0|1,0,0]=3 3095 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [1,1,0,0,0,0|1,0,0]=3 3096 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [1,1,0,0,0,0|1,0,0]=3 3097 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [1,1,0,0,0,0|0,0,0]=2 3098 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [1,1,0,0,0,0|0,0,0]=2 3099 B11R1.17 C=CCSc1cccnc1Br 62a_100000210623_100010202626 [1,1,0,0,0,0|2,0,0]=4 3100 B11R1.17 C=CCSc1cccnc1Br 62a_100010202626_100000210623 [1,1,0,0,0,0|2,0,0]=4 3101 B11R1.17 C=CCSc1cccnc1C 62a_100000210623_100000751574 [1,1,0,0,0,0|2,0,0]=4 3102 B11R1.17 C=CCSc1cccnc1C 62a_100000751574_100000210623 [1,1,0,0,0,0|2,0,0]=4 3103 B11R1.17 C=CCSc1cccnc1Cl 62a_100000036424_100000210623 [1,1,0,0,0,0|2,0,0]=4 3104 B11R1.17 C=CCSc1cccnc1Cl 62a_100000210623_100000036424 [1,1,0,0,0,0|2,0,0]=4 3105 B11R1.17 C=CCSc1cccnc1F 62a_100000210623_100009816115 [1,1,0,0,0,0|2,0,0]=4 3106 B11R1.17 C=CCSc1cccnc1F 62a_100009816115_100000210623 [1,1,0,0,0,0|2,0,0]=4 3107 B11R1.17 C=CCSc1cccnc1N 62a_100000045569_100000210623 [1,1,0,0,0,0|2,0,0]=4 3108 B11R1.17 C=CCSc1cccnc1N 62a_100000210623_100000045569 [1,1,0,0,0,0|2,0,0]=4 3109 B11R1.17 C=CCSc1cccnc1O 62a_100000210623_100000760158 [1,1,0,0,0,0|1,0,0]=3 3110 B11R1.17 C=CCSc1cccnc1O 62a_100000760158_100000210623 [1,1,0,0,0,0|1,0,0]=3 3111 B11R1.17 C=CCSc1ccncc1Br 62a_100000210623_100000726257 [1,1,0,0,0,0|2,0,0]=4 3112 B11R1.17 C=CCSc1ccncc1Br 62a_100000726257_100000210623 [1,1,0,0,0,0|2,0,0]=4 3113 B11R1.17 C=CCSc1ccncc1C 62a_100000210623_100000765111 [1,1,0,0,0,0|2,0,0]=4 3114 B11R1.17 C=CCSc1ccncc1C 62a_100000765111_100000210623 [1,1,0,0,0,0|2,0,0]=4 3115 B11R1.17 C=CCSc1ccncc1Cl 62a_100000210623_100000708259 [1,1,0,0,0,0|2,0,0]=4 3116 B11R1.17 C=CCSc1ccncc1Cl 62a_100000708259_100000210623 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.17 C=CCSc1ccncc1F 62a_100000047030_100000210623 [1,1,0,0,0,0|2,0,0]=4 3118 B11R1.17 C=CCSc1ccncc1F 62a_100000210623_100000047030 [1,1,0,0,0,0|2,0,0]=4 3119 B11R1.17 C=CCSc1ccncc1N 62a_100000210623_100000756074 [1,1,0,0,0,0|2,0,0]=4 3120 B11R1.17 C=CCSc1ccncc1N 62a_100000756074_100000210623 [1,1,0,0,0,0|2,0,0]=4 3121 B11R1.17 C=CCSc1ccncc1O 62a_100000210623_100009817591 [1,1,0,0,0,0|1,0,0]=3 3122 B11R1.17 C=CCSc1ccncc1O 62a_100009817591_100000210623 [1,1,0,0,0,0|1,0,0]=3 3123 B11R1.17 C=CCSc1cnccc1Br 62a_100000210623_100010138639 [1,1,0,0,0,0|2,0,0]=4 3124 B11R1.17 C=CCSc1cnccc1Br 62a_100010138639_100000210623 [1,1,0,0,0,0|2,0,0]=4 3125 B11R1.17 C=CCSc1cnccc1C 62a_100000210623_100000761580 [1,1,0,0,0,0|2,0,0]=4 3126 B11R1.17 C=CCSc1cnccc1C 62a_100000761580_100000210623 [1,1,0,0,0,0|2,0,0]=4 3127 B11R1.17 C=CCSc1cnccc1Cl 62a_100000210623_100009995489 [1,1,0,0,0,0|2,0,0]=4 3128 B11R1.17 C=CCSc1cnccc1Cl 62a_100009995489_100000210623 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.17 C=CCSc1cnccc1F 62a_100000210623_100009820683 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.17 C=CCSc1cnccc1F 62a_100009820683_100000210623 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.17 C=CCSc1cnccc1N 62a_100000047001_100000210623 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.17 C=CCSc1cnccc1N 62a_100000210623_100000047001 [1,1,0,0,0,0|2,0,0]=4 3133 B11R1.17 C=CCSc1cncnc1O 62a_100000210623_100000751107 [1,1,0,0,0,0|2,0,0]=4 3134 B11R1.17 C=CCSc1cncnc1O 62a_100000751107_100000210623 [1,1,0,0,0,0|2,0,0]=4 3135 B11R1.17 C=CCSc1ncccc1Br 62a_100000210623_100000696092 [1,1,0,0,0,0|2,0,0]=4 3136 B11R1.17 C=CCSc1ncccc1Br 62a_100000696092_100000210623 [1,1,0,0,0,0|2,0,0]=4 3137 B11R1.17 C=CCSc1ncccc1C 62a_100000210623_100000751373 [1,1,0,0,0,0|2,0,0]=4 3138 B11R1.17 C=CCSc1ncccc1C 62a_100000751373_100000210623 [1,1,0,0,0,0|2,0,0]=4 3139 B11R1.17 C=CCSc1ncccc1Cl 62a_100000210623_100011356963 [1,1,0,0,0,0|2,0,0]=4 3140 B11R1.17 C=CCSc1ncccc1Cl 62a_100011356963_100000210623 [1,1,0,0,0,0|2,0,0]=4 3141 B11R1.17 C=CCSc1ncccc1F 62a_100000210623_100000685392 [1,1,0,0,0,0|2,0,0]=4 3142 B11R1.17 C=CCSc1ncccc1F 62a_100000685392_100000210623 [1,1,0,0,0,0|2,0,0]=4 3143 B11R1.17 C=CCSc1ncccc1N 62a_100000210623_100000688686 [1,1,0,0,0,0|2,0,0]=4 3144 B11R1.17 C=CCSc1ncccc1N 62a_100000688686_100000210623 [1,1,0,0,0,0|2,0,0]=4 3145 B11R1.17 C=CCSc1ncccc1O 62a_100000034122_100000210623 [1,1,0,0,0,0|1,0,0]=3 3146 B11R1.17 C=CCSc1ncccc1O 62a_100000210623_100000034122 [1,1,0,0,0,0|1,0,0]=3 3147 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [1,1,0,0,0,0|0,0,2]=4 3148 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [1,1,0,0,0,0|0,0,2]=4 3149 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [1,1,0,0,0,0|0,0,2]=4 3150 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [1,1,0,0,0,0|0,0,2]=4 3151 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [1,1,0,0,0,0|0,0,2]=4 3152 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [1,1,0,0,0,0|0,0,2]=4 3153 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [1,1,0,0,0,0|0,0,2]=4 3154 B11R1.17 CCSCc1ccccc1O 271570a_203496583355_200000173030 [1,1,0,0,0,0|0,0,2]=4 3155 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [1,1,0,0,0,0|0,0,2]=4 3156 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [1,1,0,0,0,0|0,0,2]=4 3157 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [1,1,0,0,0,0|0,0,2]=4 3158 B11R1.17 COCCc1ccccc1O 34a_100138415774_100000722297 [1,1,0,0,0,0|0,0,2]=4 3159 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [1,1,0,0,0,0|1,0,1]=4 3160 B11R1.17 COCSc1ccccc1O 62a_100000739446_100000766300 [1,1,0,0,0,0|1,0,1]=4 3161 B11R1.17 COCSc1ccccc1O 62a_100000766300_100000739446 [1,1,0,0,0,0|1,0,1]=4 3162 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [1,1,0,0,0,0|0,0,2]=4 3163 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [1,1,0,0,0,0|0,0,2]=4 3164 B11R1.17 CSCNc1ccccc1O 34a_100000185747_100011218213 [1,1,0,0,0,0|1,0,1]=4 3165 B11R1.17 CSCSc1ccccc1O 62a_100000739446_100011218213 [1,1,0,0,0,0|1,0,1]=4 3166 B11R1.17 CSCSc1ccccc1O 62a_100011218213_100000739446 [1,1,0,0,0,0|1,0,1]=4 3167 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [1,1,0,0,0,0|2,0,0]=4 3168 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [1,1,0,0,0,0|2,0,0]=4 3169 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [1,1,0,0,0,0|2,0,0]=4 3170 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [1,1,0,0,0,0|2,0,0]=4 3171 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [1,1,0,0,0,0|2,0,0]=4 3172 B11R1.17 N#CCOc1ccccc1O 271570a_203496583355_200000173881 [1,1,0,0,0,0|1,0,1]=4 3173 B11R1.17 N#CCSc1ccccc1O 62a_100000739446_100011215382 [1,1,0,0,0,0|1,0,1]=4 3174 B11R1.17 N#CCSc1ccccc1O 62a_100011215382_100000739446 [1,1,0,0,0,0|1,0,1]=4 3175 B11R1.17 N#CSCc1ccccc1O 271570a_203496583355_200010199460 [1,1,0,0,0,0|1,0,1]=4 3176 B11R1.17 NCCOc1ccccc1O 271570a_203496583355_100000744007 [1,1,0,0,0,0|1,0,1]=4 3177 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [1,1,0,0,0,0|2,0,0]=4 3178 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [1,1,0,0,0,0|2,0,0]=4 3179 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [1,1,0,0,0,0|2,0,0]=4 3180 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [1,1,0,0,0,0|2,0,0]=4 3181 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [1,1,0,0,0,0|0,0,1]=3 3182 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [1,1,0,0,0,0|2,0,0]=4 3183 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [1,1,0,0,0,0|2,0,0]=4 3184 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [1,1,0,0,0,0|2,0,0]=4 3185 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [1,1,0,0,0,0|2,0,0]=4 3186 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [1,1,0,0,0,0|1,0,0]=3 3187 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [1,1,0,0,0,0|2,0,0]=4 3188 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [1,1,0,0,0,0|2,0,0]=4 3189 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [1,1,0,0,0,0|2,0,0]=4 3190 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [1,1,0,0,0,0|2,0,0]=4 3192 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [1,1,0,0,0,0|2,0,0]=4 3193 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [1,1,0,0,0,0|2,0,0]=4 3194 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [1,1,0,0,0,0|2,0,0]=4 3195 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [1,1,0,0,0,0|2,0,0]=4 3196 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [1,1,0,0,0,0|2,0,0]=4 3197 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [1,1,0,0,0,0|2,0,0]=4 3198 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [1,1,0,0,0,0|2,0,0]=4 3199 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [1,1,0,0,0,0|2,0,0]=4 3200 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [1,1,0,0,0,0|2,0,0]=4 3201 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [1,1,0,0,0,0|1,0,0]=3 3202 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [1,1,0,0,0,0|1,0,0]=3 3203 B11R1.17 O=CCSc1cccnc1O 62a_100000760158_200015260668 [1,1,0,0,0,0|2,0,0]=4 3204 B11R1.17 O=CCSc1cccnc1O 62a_200015260668_100000760158 [1,1,0,0,0,0|2,0,0]=4 3205 B11R1.17 O=CCSc1ccncc1O 62a_100009817591_200015260668 [1,1,0,0,0,0|2,0,0]=4 3206 B11R1.17 O=CCSc1ccncc1O 62a_200015260668_100009817591 [1,1,0,0,0,0|2,0,0]=4 3207 B11R1.17 O=CCSc1ncccc1O 62a_100000034122_200015260668 [1,1,0,0,0,0|2,0,0]=4 3208 B11R1.17 O=CCSc1ncccc1O 62a_200015260668_100000034122 [1,1,0,0,0,0|2,0,0]=4 3209 B11R1.17 OCCCc1ccccc1O 271570a_203496583355_100000699526 [1,1,0,0,0,0|0,0,2]=4 3210 B11R1.17 OCCNc1ccccc1O 34a_100000185747_100000211926 [1,1,0,0,0,0|1,0,1]=4 3211 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [1,1,0,0,0,0|1,0,1]=4 3212 B11R1.17 OCCSc1ccccc1O 271570a_203496583355_200000230852 [1,1,0,0,0,0|1,0,1]=4 3213 B11R1.17 OCCSc1ccccc1O 62a_100000211926_100000739446 [1,1,0,0,0,0|1,0,1]=4 3214 B11R1.17 OCCSc1ccccc1O 62a_100000739446_100000211926 [1,1,0,0,0,0|1,0,1]=4 3215 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [1,1,0,0,0,0|1,0,1]=4 3216 B11R1.17 Oc1ccccc1NCCF 34a_100000185747_100011217306 [1,1,0,0,0,0|1,0,1]=4 3217 B11R1.17 Oc1ccccc1SCCF 62a_100000739446_100011217306 [1,1,0,0,0,0|1,0,1]=4 3218 B11R1.17 Oc1ccccc1SCCF 62a_100011217306_100000739446 [1,1,0,0,0,0|1,0,1]=4 3219 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [1,1,0,0,0,0|0,0,2]=4 3220 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [1,1,0,0,0,0|0,0,2]=4 3221 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [1,1,0,0,0,0|0,0,2]=4 3222 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [1,1,0,0,0,0|0,0,2]=4 3223 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [1,1,0,0,0,0|0,0,2]=4 3224 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [1,1,0,0,0,0|0,0,2]=4 3225 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [1,1,0,0,0,0|0,0,2]=4 3226 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [1,1,0,0,0,0|0,0,2]=4 3227 B11R1.41 C=C=Cc1ccccc1OC 271570a_100015277604_100000174000 [1,1,0,0,0,0|0,0,2]=4 3228 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [1,1,0,0,0,0|1,0,0]=3 3229 B11R1.41 C=CCc1ccccc1NC 2230a_200138433279_200000210301 [1,1,0,0,0,0|1,0,0]=3 3230 B11R1.41 C=CCc1ccccc1NC 34a_200138433279_200000210301 [1,1,0,0,0,0|1,0,0]=3 3231 B11R1.41 C=CCc1ccccc1N[13CH3] 2230a_200138433279_200025704644 [1,1,0,0,0,0|1,0,0]=3 3232 B11R1.41 C=CCc1ccccc1N[13CH3] 34a_200138433279_200025704644 [1,1,0,0,0,0|1,0,0]=3 3233 B11R1.41 C=CCc1ccccc1OC 34a_100000211836_200000210301 [1,1,0,0,0,0|0,0,0]=2 3234 B11R1.41 C=CCc1ccccc1OC 7a_100000211836_200000210301 [1,1,0,0,0,0|0,0,0]=2 3235 B11R1.41 C=CCc1ccccc1O[13CH3] 34a_100000211836_200025704644 [1,1,0,0,0,0|0,0,0]=2 3236 B11R1.41 C=CCc1ccccc1O[13CH3] 7a_100000211836_200025704644 [1,1,0,0,0,0|0,0,0]=2 3237 B11R1.41 C=CCc1ccccc1SC 62a_100009828059_200000210301 [1,1,0,0,0,0|0,1,0]=3 3238 B11R1.41 C=CCc1ccccc1SC 62a_200000210301_100009828059 [1,1,0,0,0,0|0,1,0]=3 3239 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_100009828059_200025704644 [1,1,0,0,0,0|0,1,0]=3 3240 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_200025704644_100009828059 [1,1,0,0,0,0|0,1,0]=3 3241 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [1,1,0,0,0,0|0,0,2]=4 3242 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [1,1,0,0,0,0|0,0,2]=4 3243 B11R1.41 CCCc1ccccc1OC 34a_100011217252_200000210301 [1,1,0,0,0,0|0,0,2]=4 3244 B11R1.41 CCCc1ccccc1OC 7a_100011217252_200000210301 [1,1,0,0,0,0|0,0,2]=4 3245 B11R1.41 CCCc1ccccc1O[13CH3] 34a_100011217252_200025704644 [1,1,0,0,0,0|0,0,2]=4 3246 B11R1.41 CCCc1ccccc1O[13CH3] 7a_100011217252_200025704644 [1,1,0,0,0,0|0,0,2]=4 3247 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [1,1,0,0,0,0|1,0,1]=4 3248 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [1,1,0,0,0,0|1,0,1]=4 3249 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [1,1,0,0,0,0|1,0,1]=4 3250 B11R1.41 CNCc1ccccc1OC 207a_100102657272_100000169842 [1,1,0,0,0,0|1,0,1]=4 3251 B11R1.41 CNCc1ccccc1OC 2230a_106832991635_100000210004 [1,1,0,0,0,0|1,0,1]=4 3252 B11R1.41 CNCc1ccccc1OC 270004a_106832991635_100000169842 [1,1,0,0,0,0|1,0,1]=4 3253 B11R1.41 CNCc1ccccc1OC 34a_100000188900_200000210301 [1,1,0,0,0,0|1,0,1]=4 3254 B11R1.41 CNCc1ccccc1OC 34a_100015189988_200000210301 [1,1,0,0,0,0|1,0,1]=4 3255 B11R1.41 CNCc1ccccc1OC 34a_100102657272_100000210004 [1,1,0,0,0,0|1,0,1]=4 3256 B11R1.41 CNCc1ccccc1OC 7a_106832991635_100000210004 [1,1,0,0,0,0|1,0,1]=4 3257 B11R1.41 CNCc1ccccc1O[13CH3] 34a_100015189988_200025704644 [1,1,0,0,0,0|1,0,1]=4 3258 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [1,1,0,0,0,0|1,0,1]=4 3259 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [1,1,0,0,0,0|1,0,1]=4 3260 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [1,1,0,0,0,0|1,0,1]=4 3261 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [1,1,0,0,0,0|1,0,1]=4 3262 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [1,1,0,0,0,0|1,0,1]=4 3263 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [1,1,0,0,0,0|1,0,1]=4 3264 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [1,1,0,0,0,0|1,0,1]=4 3265 B11R1.41 COc1ccccc1CC#N 34a_100000043107_200000210301 [1,1,0,0,0,0|1,0,1]=4 3266 B11R1.41 COc1ccccc1CC#N 7a_100000043107_200000210301 [1,1,0,0,0,0|1,0,1]=4 3267 B11R1.41 COc1ccccc1CCBr 34a_100000722297_200000210301 [1,1,0,0,0,0|1,0,1]=4 3268 B11R1.41 COc1ccccc1CCBr 7a_100000722297_200000210301 [1,1,0,0,0,0|1,0,1]=4 3269 B11R1.41 COc1ccccc1CCN 34a_100011207237_200000210301 [1,1,0,0,0,0|1,0,1]=4 3270 B11R1.41 COc1ccccc1CCO 34a_100000719421_200000210301 [1,1,0,0,0,0|1,0,1]=4 3271 B11R1.41 COc1ccccc1CCO 7a_100000719421_200000210301 [1,1,0,0,0,0|1,0,1]=4 3272 B11R1.41 COc1ccccc1CN[13CH3] 34a_100000188900_200025704644 [1,1,0,0,0,0|1,0,1]=4 3273 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [1,1,0,0,0,0|1,0,1]=4 3274 B11R1.41 COc1ccccc1CSC 62a_100000210004_200000210301 [1,1,0,0,0,0|1,0,1]=4 3275 B11R1.41 COc1ccccc1CSC 62a_200000210301_100000210004 [1,1,0,0,0,0|1,0,1]=4 3276 B11R1.41 COc1ccccc1CS[13CH3] 62a_100000210004_200025704644 [1,1,0,0,0,0|1,0,1]=4 3277 B11R1.41 COc1ccccc1CS[13CH3] 62a_200025704644_100000210004 [1,1,0,0,0,0|1,0,1]=4 3278 B11R1.41 CSCc1ccccc1CO 62a_100009816955_200000210301 [1,1,0,0,0,0|1,0,1]=4 3279 B11R1.41 CSCc1ccccc1CO 62a_200000210301_100009816955 [1,1,0,0,0,0|1,0,1]=4 3280 B11R1.41 [13CH3]Oc1ccccc1CC#N 34a_100000043107_200025704644 [1,1,0,0,0,0|1,0,1]=4 3281 B11R1.41 [13CH3]Oc1ccccc1CC#N 7a_100000043107_200025704644 [1,1,0,0,0,0|1,0,1]=4 3282 B11R1.41 [13CH3]Oc1ccccc1CCBr 34a_100000722297_200025704644 [1,1,0,0,0,0|1,0,1]=4 3283 B11R1.41 [13CH3]Oc1ccccc1CCBr 7a_100000722297_200025704644 [1,1,0,0,0,0|1,0,1]=4 3284 B11R1.41 [13CH3]Oc1ccccc1CCN 34a_100011207237_200025704644 [1,1,0,0,0,0|1,0,1]=4 3285 B11R1.41 [13CH3]Oc1ccccc1CCO 34a_100000719421_200025704644 [1,1,0,0,0,0|1,0,1]=4 3286 B11R1.41 [13CH3]Oc1ccccc1CCO 7a_100000719421_200025704644 [1,1,0,0,0,0|1,0,1]=4 3287 B11R1.41 [13CH3]SCc1ccccc1CO 62a_100009816955_200025704644 [1,1,0,0,0,0|1,0,1]=4 3288 B11R1.41 [13CH3]SCc1ccccc1CO 62a_200025704644_100009816955 [1,1,0,0,0,0|1,0,1]=4 3289 B11R1.81 C=C=Cc1ccc(cc1O)Br 271570a_100015277604_100012344904 [1,1,0,0,0,0|0,0,2]=4 3290 B11R1.81 C=C=Cc1ccc(cc1O)C 271570a_100015277604_100012002257 [1,1,0,0,0,0|0,0,2]=4 3291 B11R1.81 C=C=Cc1ccc(cc1O)Cl 271570a_100015277604_100000050036 [1,1,0,0,0,0|0,0,2]=4 3292 B11R1.81 C=C=Cc1ccc(cc1O)F 271570a_100015277604_100000690578 [1,1,0,0,0,0|0,0,2]=4 3293 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [1,1,0,0,0,0|0,0,2]=4 3294 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [1,1,0,0,0,0|0,0,2]=4 3295 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [1,1,0,0,0,0|0,0,2]=4 3296 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [1,1,0,0,0,0|0,0,2]=4 3297 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [1,1,0,0,0,0|0,0,2]=4 3298 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [1,1,0,0,0,0|0,0,2]=4 3299 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [1,1,0,0,0,0|1,0,1]=4 3300 B11R1.81 N#CCc1ccc(cc1O)F 271570a_203496583355_100011207962 [1,1,0,0,0,0|1,0,1]=4 3301 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [1,1,0,0,0,0|0,0,2]=4 3302 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [1,1,0,0,0,0|1,0,1]=4 3303 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [1,1,0,0,0,0|1,0,1]=4 3304 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [1,1,0,0,0,0|1,0,1]=4 3305 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [1,1,0,0,0,0|1,0,1]=4 3306 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [1,1,0,0,0,0|1,0,1]=4 3307 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [1,1,0,0,0,0|1,0,1]=4 3308 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [1,1,0,0,0,0|1,0,1]=4 3309 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [1,1,0,0,0,0|1,0,1]=4 3310 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [1,1,0,0,0,0|1,0,1]=4 3311 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [1,1,0,0,0,0|1,0,1]=4 3312 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [1,1,0,0,0,0|0,0,1]=3 3313 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [1,1,0,0,0,0|0,0,1]=3 3314 B11R1.86 CC(=O)Cc1ncccc1O 1458a_100000070787_200020655725 [1,1,0,0,0,0|1,0,1]=4 3315 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [1,1,0,0,0,0|1,0,1]=4 3316 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [1,1,0,0,0,0|1,0,1]=4 3317 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [1,1,0,0,0,0|1,0,1]=4 3318 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [1,1,0,0,0,0|1,0,1]=4 3319 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [1,1,0,0,0,0|1,0,1]=4 3320 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [1,1,0,0,0,0|1,0,1]=4 3321 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [1,1,0,0,0,0|1,0,1]=4 3322 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [1,1,0,0,0,0|1,0,1]=4 3323 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [1,1,0,0,0,0|1,0,1]=4 3324 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [1,1,0,0,0,0|1,0,1]=4 3325 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [1,1,0,0,0,0|1,0,0]=3 3326 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [1,1,0,0,0,0|2,0,0]=4 3327 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [1,1,0,0,0,0|1,0,1]=4 3328 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [1,1,0,0,0,0|1,0,1]=4 3329 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [1,1,0,0,0,0|1,0,1]=4 3330 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [1,1,0,0,0,0|1,0,1]=4 3331 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [1,1,0,0,0,0|0,0,1]=3 3332 B11R1.182 C=C=Cc1cc(ccc1O)Br 271570a_100015277604_100012355227 [1,1,0,0,0,0|0,0,2]=4 3333 B11R1.182 C=C=Cc1cc(ccc1O)C 271570a_100015277604_100000765521 [1,1,0,0,0,0|0,0,2]=4 3334 B11R1.182 C=C=Cc1cc(ccc1O)Cl 271570a_100015277604_100011356953 [1,1,0,0,0,0|0,0,2]=4 3335 B11R1.182 C=C=Cc1cc(ccc1O)F 271570a_100015277604_100000211999 [1,1,0,0,0,0|0,0,2]=4 3336 B11R1.182 C=C=Cc1cc(ccc1O)N 271570a_100015277604_100011534360 [1,1,0,0,0,0|0,0,2]=4 3337 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [1,1,0,0,0,0|0,0,2]=4 3338 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [1,1,0,0,0,0|0,0,2]=4 3339 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [1,1,0,0,0,0|0,0,2]=4 3340 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [1,1,0,0,0,0|0,0,2]=4 3341 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [1,1,0,0,0,0|0,0,2]=4 3342 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [1,1,0,0,0,0|0,0,2]=4 3343 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [1,1,0,0,0,0|0,0,2]=4 3344 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [1,1,0,0,0,0|1,0,1]=4 3345 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [1,1,0,0,0,0|1,0,1]=4 3346 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [1,1,0,0,0,0|1,0,1]=4 3347 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [1,1,0,0,0,0|1,0,1]=4 3348 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [1,1,0,0,0,0|1,0,1]=4 3349 B11R1.182 COCc1cc(ccc1O)F 34a_100138415774_100010161318 [1,1,0,0,0,0|1,0,1]=4 3350 B11R1.182 CSCc1cc(ccc1O)F 62a_100010161318_200000210301 [1,1,0,0,0,0|1,0,1]=4 3351 B11R1.182 CSCc1cc(ccc1O)F 62a_200000210301_100010161318 [1,1,0,0,0,0|1,0,1]=4 3352 B11R1.182 Cc1ccc(c(c1)CC#N)O 271570a_203496583355_100010147026 [1,1,0,0,0,0|1,0,1]=4 3353 B11R1.182 N#CCc1cc(ccc1O)F 271570a_203496583355_100011206898 [1,1,0,0,0,0|1,0,1]=4 3354 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [1,1,0,0,0,0|1,0,1]=4 3355 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [1,1,0,0,0,0|1,0,1]=4 3356 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_100010161318_200025704644 [1,1,0,0,0,0|1,0,1]=4 3357 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_200025704644_100010161318 [1,1,0,0,0,0|1,0,1]=4 3358 B11R1.222 CC(C#N)c1ccccc1O 271570a_203496583355_200010232107 [1,1,0,0,0,0|1,0,1]=4 3359 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [1,1,0,0,0,0|1,0,1]=4 3360 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [1,1,0,0,0,0|1,0,1]=4 3361 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [1,1,0,0,0,0|1,0,1]=4 3362 B11R1.222 NCC(O)c1ccccc1O 271570a_203496583355_100011236429 [1,1,0,0,0,0|1,0,1]=4 3363 B11R1.222 N[C@H](CO)c1ccccc1O 271570a_203496583355_100161155918 [1,1,0,0,0,0|1,0,1]=4 3364 B11R1.605 C=C=Cc1c(cccc1Br)O 271570a_100015277604_100010187912 [1,1,0,0,0,0|0,0,2]=4 3365 B11R1.605 C=C=Cc1c(cccc1Cl)O 271570a_100015277604_100000050174 [1,1,0,0,0,0|0,0,2]=4 3366 B11R1.605 C=C=Cc1c(cccc1F)O 271570a_100015277604_100009820682 [1,1,0,0,0,0|0,0,2]=4 3367 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [1,1,0,0,0,0|0,0,2]=4 3368 B11R1.605 C=C=Cc1c(cccc1O)N 271570a_100015277604_100012183704 [1,1,0,0,0,0|0,0,2]=4 3369 B11R1.605 C=C=Cc1c(cccc1O)O 271570a_100015277604_100010205330 [1,1,0,0,0,0|0,0,2]=4 3370 B11R1.605 C=CCc1c(ccnc1F)O 271570a_203496583355_200010238768 [1,1,0,0,0,0|1,0,0]=3 3371 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [1,1,0,0,0,0|0,0,2]=4 3372 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [1,1,0,0,0,0|0,0,2]=4 3373 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [1,1,0,0,0,0|0,0,2]=4 3374 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [1,1,0,0,0,0|0,0,2]=4 3375 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [1,1,0,0,0,0|0,0,2]=4 3376 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [1,1,0,0,0,0|0,0,2]=4 3377 B11R1.605 CNCc1c(cccc1F)O 271570a_203496583355_106744473292 [1,1,0,0,0,0|1,0,1]=4 3378 B11R1.605 Cc1cccc(c1CC#N)O 271570a_203496583355_100010147027 [1,1,0,0,0,0|1,0,1]=4 3379 B11R1.605 N#CCc1c(cccc1F)O 271570a_203496583355_100009817144 [1,1,0,0,0,0|1,0,1]=4 3380 B11R1.23 CNC(C)c1cccc(c1)C 269862a_106832991636_100000211476 [1,1,0,0,0,0|1,0,1]=4 3381 B11R1.23 CN[C@H](C)c1cccc(c1)C 2230a_100000698126_200000210301 [1,1,0,0,0,0|1,0,1]=4 3382 B11R1.23 CN[C@H](C)c1cccc(c1)C 34a_100000698126_200000210301 [1,1,0,0,0,0|1,0,1]=4 3383 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [1,1,0,0,0,0|1,0,1]=4 3384 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [1,1,0,0,0,0|1,0,1]=4 3385 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [1,1,0,0,0,0|1,0,1]=4 3386 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [1,1,0,0,0,0|1,0,1]=4 3387 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 2230a_100000698126_200025704644 [1,1,0,0,0,0|1,0,1]=4 3388 B11R1.23 Cc1cccc(c1)[C@@H](C)N[13CH3] 34a_100000698126_200025704644 [1,1,0,0,0,0|1,0,1]=4 3389 B11R1.24 C#CCNc1cccc(c1)C 2230a_100000188690_100000038162 [1,1,0,0,0,0|0,0,2]=4 3390 B11R1.24 C#CCNc1cccc(c1)C 34a_100000188690_100000184674 [1,1,0,0,0,0|0,0,2]=4 3391 B11R1.24 C#CCOc1cccc(c1)C 34a_100000210337_100000184674 [1,1,0,0,0,0|0,0,2]=4 3392 B11R1.24 C#CCOc1cccc(c1)C 7a_100000210337_100000038162 [1,1,0,0,0,0|0,0,2]=4 3393 B11R1.24 C#CCSc1cccc(c1)C 62a_100000038162_100011215228 [1,1,0,0,0,0|0,0,2]=4 3394 B11R1.24 C=CCNc1cc(ccn1)F 27a_100020586998_100000764206 [1,1,0,0,0,0|2,0,0]=4 3395 B11R1.24 C=CCNc1cc(cnn1)C 27a_100020586998_100000070100 [1,1,0,0,0,0|2,0,0]=4 3396 B11R1.24 C=CCNc1cc(ncn1)C 27a_100020586998_100000744208 [1,1,0,0,0,0|2,0,0]=4 3397 B11R1.24 C=CCNc1cc[nH]c(=O)c1 27a_100020586998_100000061649 [1,1,0,0,0,0|2,0,0]=4 3398 B11R1.24 C=CCNc1cccc(c1)Br 34a_100000210019_100015514636 [1,1,0,0,0,0|1,0,0]=3 3399 B11R1.24 C=CCNc1cccc(c1)C 2230a_100000188690_100000210623 [1,1,0,0,0,0|0,0,0]=2 3400 B11R1.24 C=CCNc1cccc(c1)C 34a_100000188690_100015514636 [1,1,0,0,0,0|0,0,0]=2 3401 B11R1.24 C=CCNc1cccc(c1)Cl 34a_100000185859_100015514636 [1,1,0,0,0,0|1,0,0]=3 3402 B11R1.24 C=CCNc1cccc(c1)F 34a_100000210047_100015514636 [1,1,0,0,0,0|1,0,0]=3 3403 B11R1.24 C=CCNc1cccc(c1)I 34a_100000211102_100015514636 [1,1,0,0,0,0|1,0,0]=3 3404 B11R1.24 C=CCNc1cccc(c1)O 34a_100000210217_100015514636 [1,1,0,0,0,0|1,0,0]=3 3405 B11R1.24 C=CCNc1cccc(n1)F 27a_100020586998_100009815982 [1,1,0,0,0,0|2,0,0]=4 3406 B11R1.24 C=CCNc1ccnc(c1)C 27a_100020586998_100000758586 [1,1,0,0,0,0|1,0,0]=3 3407 B11R1.24 C=CCNc1ccnc(c1)F 27a_100020586998_100009816116 [1,1,0,0,0,0|2,0,0]=4 3408 B11R1.24 C=CCNc1ccnc(n1)C 27a_100020586998_100000749937 [1,1,0,0,0,0|2,0,0]=4 3409 B11R1.24 C=CCNc1cncc(n1)C 27a_100020586998_100000754123 [1,1,0,0,0,0|2,0,0]=4 3410 B11R1.24 C=CCNc1nccc(n1)C 27a_100020586998_100000750684 [1,1,0,0,0,0|2,0,0]=4 3411 B11R1.24 C=CCOc1cc(cnn1)C 34a_100000766097_100015514636 [1,1,0,0,0,0|2,0,0]=4 3412 B11R1.24 C=CCOc1cc[nH]c(=O)c1 34a_100000032262_100015514636 [1,1,0,0,0,0|2,0,0]=4 3413 B11R1.24 C=CCOc1ccc[n+](c1)[O-] 34a_100000039713_100015514636 [1,1,0,0,0,0|2,0,0]=4 3414 B11R1.24 C=CCOc1ccc[n+](c1)[O-] 7a_100000039713_100015514636 [1,1,0,0,0,0|2,0,0]=4 3415 B11R1.24 C=CCOc1cccc(=O)[nH]1 34a_100000033347_100015514636 [1,1,0,0,0,0|2,0,0]=4 3416 B11R1.24 C=CCOc1cccc(c1)Br 34a_100000210342_100015514636 [1,1,0,0,0,0|1,0,0]=3 3417 B11R1.24 C=CCOc1cccc(c1)Br 7a_100000210342_100015514636 [1,1,0,0,0,0|1,0,0]=3 3418 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [1,1,0,0,0,0|0,0,0]=2 3419 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [1,1,0,0,0,0|0,0,0]=2 3420 B11R1.24 C=CCOc1cccc(c1)Cl 34a_100000210295_100015514636 [1,1,0,0,0,0|1,0,0]=3 3421 B11R1.24 C=CCOc1cccc(c1)Cl 7a_100000210295_100015514636 [1,1,0,0,0,0|1,0,0]=3 3422 B11R1.24 C=CCOc1cccc(c1)F 34a_100000210426_100015514636 [1,1,0,0,0,0|1,0,0]=3 3423 B11R1.24 C=CCOc1cccc(c1)F 7a_100000210426_100015514636 [1,1,0,0,0,0|1,0,0]=3 3424 B11R1.24 C=CCOc1cccc(c1)I 34a_100000211634_100015514636 [1,1,0,0,0,0|1,0,0]=3 3425 B11R1.24 C=CCOc1cccc(c1)I 7a_100000211634_100015514636 [1,1,0,0,0,0|1,0,0]=3 3426 B11R1.24 C=CCOc1cccc(c1)N 34a_100000210217_100015514636 [1,1,0,0,0,0|1,0,0]=3 3427 B11R1.24 C=CCOc1cccc(n1)F 34a_100011432558_100015514636 [1,1,0,0,0,0|2,0,0]=4 3428 B11R1.24 C=CCOc1ccnc(c1)C 34a_100000688365_100015514636 [1,1,0,0,0,0|1,0,0]=3 3429 B11R1.24 C=CCOc1ccnc(c1)Cl 34a_100000762945_100015514636 [1,1,0,0,0,0|2,0,0]=4 3430 B11R1.24 C=CCOc1ccnc(c1)F 34a_100000732698_100015514636 [1,1,0,0,0,0|2,0,0]=4 3431 B11R1.24 C=CCOc1ccnc(c1)N 34a_100011834064_100015514636 [1,1,0,0,0,0|2,0,0]=4 3432 B11R1.24 C=CCOc1cncc(c1)Br 34a_100000754920_100015514636 [1,1,0,0,0,0|2,0,0]=4 3433 B11R1.24 C=CCOc1cncc(c1)Br 7a_100000754920_100015514636 [1,1,0,0,0,0|2,0,0]=4 3434 B11R1.24 C=CCOc1cncc(c1)C 34a_100011830280_100015514636 [1,1,0,0,0,0|1,0,0]=3 3435 B11R1.24 C=CCOc1cncc(c1)C 7a_100011830280_100015514636 [1,1,0,0,0,0|1,0,0]=3 3436 B11R1.24 C=CCOc1cncc(c1)Cl 7a_100000032511_100015514636 [1,1,0,0,0,0|2,0,0]=4 3437 B11R1.24 C=CCOc1cncc(c1)F 34a_100011830296_100015514636 [1,1,0,0,0,0|2,0,0]=4 3438 B11R1.24 C=CCOc1cncc(c1)F 7a_100011830296_100015514636 [1,1,0,0,0,0|2,0,0]=4 3439 B11R1.24 C=CCOc1cncc(c1)N 34a_100011997051_100015514636 [1,1,0,0,0,0|2,0,0]=4 3440 B11R1.24 C=CCSc1cc(=O)cc[nH]1 62a_100009817434_100000210623 [1,1,0,0,0,0|2,0,0]=4 3441 B11R1.24 C=CCSc1cc(ccn1)C 62a_100000210623_100000750283 [1,1,0,0,0,0|1,0,0]=3 3442 B11R1.24 C=CCSc1cc(ccn1)C 62a_100000750283_100000210623 [1,1,0,0,0,0|1,0,0]=3 3443 B11R1.24 C=CCSc1cc(ccn1)Cl 62a_100000210623_100010167805 [1,1,0,0,0,0|2,0,0]=4 3444 B11R1.24 C=CCSc1cc(ccn1)Cl 62a_100010167805_100000210623 [1,1,0,0,0,0|2,0,0]=4 3445 B11R1.24 C=CCSc1cc(ccn1)F 62a_100000210623_100000764206 [1,1,0,0,0,0|2,0,0]=4 3446 B11R1.24 C=CCSc1cc(ccn1)F 62a_100000764206_100000210623 [1,1,0,0,0,0|2,0,0]=4 3447 B11R1.24 C=CCSc1cc(ccn1)N 62a_100000210623_100009814236 [1,1,0,0,0,0|2,0,0]=4 3448 B11R1.24 C=CCSc1cc(ccn1)N 62a_100009814236_100000210623 [1,1,0,0,0,0|2,0,0]=4 3449 B11R1.24 C=CCSc1cc(ccn1)O 62a_100000210623_100000762945 [1,1,0,0,0,0|2,0,0]=4 3450 B11R1.24 C=CCSc1cc(cnn1)C 62a_100000070100_100000210623 [1,1,0,0,0,0|2,0,0]=4 3451 B11R1.24 C=CCSc1cc(cnn1)C 62a_100000210623_100000070100 [1,1,0,0,0,0|2,0,0]=4 3452 B11R1.24 C=CCSc1cc(ncn1)C 62a_100000210623_100000744208 [1,1,0,0,0,0|2,0,0]=4 3453 B11R1.24 C=CCSc1cc(ncn1)C 62a_100000744208_100000210623 [1,1,0,0,0,0|2,0,0]=4 3454 B11R1.24 C=CCSc1cc[nH]c(=O)c1 62a_100000210623_100009816521 [1,1,0,0,0,0|2,0,0]=4 3455 B11R1.24 C=CCSc1cc[nH]c(=O)c1 62a_100009816521_100000210623 [1,1,0,0,0,0|2,0,0]=4 3456 B11R1.24 C=CCSc1ccc[n+](c1)C 62a_100000210623_100009996589 [1,1,0,0,0,0|1,0,0]=3 3457 B11R1.24 C=CCSc1ccc[n+](c1)C 62a_100009996589_100000210623 [1,1,0,0,0,0|1,0,0]=3 3458 B11R1.24 C=CCSc1ccc[n+](c1)[O-] 62a_100000210623_100009815978 [1,1,0,0,0,0|2,0,0]=4 3459 B11R1.24 C=CCSc1cccc(=O)[nH]1 62a_100000210623_100000752884 [1,1,0,0,0,0|2,0,0]=4 3460 B11R1.24 C=CCSc1cccc(c1)Br 62a_100000210623_100000691529 [1,1,0,0,0,0|1,0,0]=3 3461 B11R1.24 C=CCSc1cccc(c1)Br 62a_100000691529_100000210623 [1,1,0,0,0,0|1,0,0]=3 3462 B11R1.24 C=CCSc1cccc(c1)C 62a_100000210623_100011215228 [1,1,0,0,0,0|0,0,0]=2 3463 B11R1.24 C=CCSc1cccc(c1)C 62a_100011215228_100000210623 [1,1,0,0,0,0|0,0,0]=2 3464 B11R1.24 C=CCSc1cccc(c1)Cl 62a_100000210623_100000699651 [1,1,0,0,0,0|1,0,0]=3 3465 B11R1.24 C=CCSc1cccc(c1)Cl 62a_100000699651_100000210623 [1,1,0,0,0,0|1,0,0]=3 3466 B11R1.24 C=CCSc1cccc(c1)F 62a_100000210623_100000685547 [1,1,0,0,0,0|1,0,0]=3 3467 B11R1.24 C=CCSc1cccc(c1)F 62a_100000685547_100000210623 [1,1,0,0,0,0|1,0,0]=3 3468 B11R1.24 C=CCSc1cccc(c1)N 62a_100000210019_100000210623 [1,1,0,0,0,0|1,0,0]=3 3469 B11R1.24 C=CCSc1cccc(c1)N 62a_100000210623_100000210019 [1,1,0,0,0,0|1,0,0]=3 3470 B11R1.24 C=CCSc1cccc(c1)O 62a_100000210623_100000211634 [1,1,0,0,0,0|1,0,0]=3 3471 B11R1.24 C=CCSc1cccc(c1)[S] 62a_100000210623_114929384022 [1,1,0,0,0,0|1,0,0]=3 3472 B11R1.24 C=CCSc1cccc(c1)[S] 62a_114929384022_100000210623 [1,1,0,0,0,0|1,0,0]=3 3473 B11R1.24 C=CCSc1cccc(n1)Br 62a_100000210623_100000684672 [1,1,0,0,0,0|2,0,0]=4 3474 B11R1.24 C=CCSc1cccc(n1)Br 62a_100000684672_100000210623 [1,1,0,0,0,0|2,0,0]=4 3475 B11R1.24 C=CCSc1cccc(n1)C 62a_100000210623_100000742759 [1,1,0,0,0,0|1,0,0]=3 3476 B11R1.24 C=CCSc1cccc(n1)C 62a_100000742759_100000210623 [1,1,0,0,0,0|1,0,0]=3 3477 B11R1.24 C=CCSc1cccc(n1)Cl 62a_100000051397_100000210623 [1,1,0,0,0,0|2,0,0]=4 3478 B11R1.24 C=CCSc1cccc(n1)Cl 62a_100000210623_100000051397 [1,1,0,0,0,0|2,0,0]=4 3479 B11R1.24 C=CCSc1cccc(n1)F 62a_100000210623_100009815982 [1,1,0,0,0,0|2,0,0]=4 3480 B11R1.24 C=CCSc1cccc(n1)F 62a_100009815982_100000210623 [1,1,0,0,0,0|2,0,0]=4 3481 B11R1.24 C=CCSc1cccc(n1)N 62a_100000210623_100000740741 [1,1,0,0,0,0|2,0,0]=4 3482 B11R1.24 C=CCSc1cccc(n1)N 62a_100000740741_100000210623 [1,1,0,0,0,0|2,0,0]=4 3483 B11R1.24 C=CCSc1ccnc(c1)Br 62a_100000210623_100009814637 [1,1,0,0,0,0|2,0,0]=4 3484 B11R1.24 C=CCSc1ccnc(c1)Br 62a_100009814637_100000210623 [1,1,0,0,0,0|2,0,0]=4 3485 B11R1.24 C=CCSc1ccnc(c1)C 62a_100000210623_100000758586 [1,1,0,0,0,0|1,0,0]=3 3486 B11R1.24 C=CCSc1ccnc(c1)C 62a_100000758586_100000210623 [1,1,0,0,0,0|1,0,0]=3 3487 B11R1.24 C=CCSc1ccnc(c1)Cl 62a_100000035001_100000210623 [1,1,0,0,0,0|2,0,0]=4 3488 B11R1.24 C=CCSc1ccnc(c1)Cl 62a_100000210623_100000035001 [1,1,0,0,0,0|2,0,0]=4 3489 B11R1.24 C=CCSc1ccnc(c1)F 62a_100000210623_100009816116 [1,1,0,0,0,0|2,0,0]=4 3490 B11R1.24 C=CCSc1ccnc(c1)F 62a_100009816116_100000210623 [1,1,0,0,0,0|2,0,0]=4 3491 B11R1.24 C=CCSc1ccnc(c1)N 62a_100000049665_100000210623 [1,1,0,0,0,0|2,0,0]=4 3492 B11R1.24 C=CCSc1ccnc(c1)N 62a_100000210623_100000049665 [1,1,0,0,0,0|2,0,0]=4 3493 B11R1.24 C=CCSc1ccnc(n1)C 62a_100000210623_100000749937 [1,1,0,0,0,0|2,0,0]=4 3494 B11R1.24 C=CCSc1ccnc(n1)C 62a_100000749937_100000210623 [1,1,0,0,0,0|2,0,0]=4 3495 B11R1.24 C=CCSc1cncc(c1)Br 62a_100000210623_100000728054 [1,1,0,0,0,0|2,0,0]=4 3496 B11R1.24 C=CCSc1cncc(c1)Br 62a_100000728054_100000210623 [1,1,0,0,0,0|2,0,0]=4 3497 B11R1.24 C=CCSc1cncc(c1)C 62a_100000210623_100000760492 [1,1,0,0,0,0|1,0,0]=3 3498 B11R1.24 C=CCSc1cncc(c1)C 62a_100000760492_100000210623 [1,1,0,0,0,0|1,0,0]=3 3499 B11R1.24 C=CCSc1cncc(c1)Cl 62a_100000049639_100000210623 [1,1,0,0,0,0|2,0,0]=4 3500 B11R1.24 C=CCSc1cncc(c1)Cl 62a_100000210623_100000049639 [1,1,0,0,0,0|2,0,0]=4 3501 B11R1.24 C=CCSc1cncc(c1)F 62a_100000210623_100000744099 [1,1,0,0,0,0|2,0,0]=4 3502 B11R1.24 C=CCSc1cncc(c1)F 62a_100000744099_100000210623 [1,1,0,0,0,0|2,0,0]=4 3503 B11R1.24 C=CCSc1cncc(c1)N 62a_100000210623_100000687067 [1,1,0,0,0,0|2,0,0]=4 3504 B11R1.24 C=CCSc1cncc(c1)N 62a_100000687067_100000210623 [1,1,0,0,0,0|2,0,0]=4 3505 B11R1.24 C=CCSc1cncc(c1)O 62a_100000210623_100000754920 [1,1,0,0,0,0|2,0,0]=4 3506 B11R1.24 C=CCSc1cncc(c1)O 62a_100000754920_100000210623 [1,1,0,0,0,0|2,0,0]=4 3507 B11R1.24 C=CCSc1cncc(n1)C 62a_100000210623_100000754123 [1,1,0,0,0,0|2,0,0]=4 3508 B11R1.24 C=CCSc1cncc(n1)C 62a_100000754123_100000210623 [1,1,0,0,0,0|2,0,0]=4 3509 B11R1.24 C=CCSc1nccc(n1)C 62a_100000210623_100011243806 [1,1,0,0,0,0|2,0,0]=4 3510 B11R1.24 C=CCSc1nccc(n1)C 62a_100011243806_100000210623 [1,1,0,0,0,0|2,0,0]=4 3511 B11R1.24 CC=NNc1cccc(c1)C 4a_100000681630_200000210099 [1,1,0,0,0,0|1,0,1]=4 3512 B11R1.24 CCCCc1cccc(c1)C 271570a_100020621405_100011215228 [1,1,0,0,0,0|0,0,2]=4 3513 B11R1.24 CCCNc1cccc(c1)C 2230a_100000188690_100000210303 [1,1,0,0,0,0|0,0,2]=4 3514 B11R1.24 CCCNc1cccc(c1)C 34a_100000188690_100000210303 [1,1,0,0,0,0|0,0,2]=4 3515 B11R1.24 CCCOc1cccc(c1)C 34a_100000210337_100000210303 [1,1,0,0,0,0|0,0,2]=4 3516 B11R1.24 CCCOc1cccc(c1)C 7a_100000210337_100000210303 [1,1,0,0,0,0|0,0,2]=4 3517 B11R1.24 CCCSc1cccc(c1)C 62a_100000210303_100011215228 [1,1,0,0,0,0|0,0,2]=4 3518 B11R1.24 CCCSc1cccc(c1)C 62a_100011215228_100000210303 [1,1,0,0,0,0|0,0,2]=4 3519 B11R1.24 CCNCc1cccc(c1)C 207a_100015525214_100000211157 [1,1,0,0,0,0|0,0,2]=4 3520 B11R1.24 CCNCc1cccc(c1)C 2230a_100000185548_100000210202 [1,1,0,0,0,0|0,0,2]=4 3521 B11R1.24 CCNCc1cccc(c1)C 2230a_100015525214_100000211840 [1,1,0,0,0,0|0,0,2]=4 3522 B11R1.24 CCNCc1cccc(c1)C 270004a_100015525214_100000211157 [1,1,0,0,0,0|0,0,2]=4 3523 B11R1.24 CCNCc1cccc(c1)C 34a_100000185548_100000210202 [1,1,0,0,0,0|0,0,2]=4 3524 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [1,1,0,0,0,0|0,0,2]=4 3525 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [1,1,0,0,0,0|0,0,2]=4 3526 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [1,1,0,0,0,0|0,0,2]=4 3527 B11R1.24 CCSCc1cccc(c1)C 62a_100000210202_100000211840 [1,1,0,0,0,0|0,0,2]=4 3528 B11R1.24 CCSCc1cccc(c1)C 62a_100000211840_100000210202 [1,1,0,0,0,0|0,0,2]=4 3529 B11R1.24 CNCCc1cccc(c1)C 2230a_100000749837_200000210301 [1,1,0,0,0,0|0,0,2]=4 3530 B11R1.24 CNCCc1cccc(c1)C 2230a_106832991635_100011713685 [1,1,0,0,0,0|0,0,2]=4 3531 B11R1.24 CNCCc1cccc(c1)C 34a_100000749837_200000210301 [1,1,0,0,0,0|0,0,2]=4 3532 B11R1.24 CNCCc1cccc(c1)C 34a_100102657272_100011713685 [1,1,0,0,0,0|0,0,2]=4 3533 B11R1.24 CNCCc1cccc(c1)C 7a_106832991635_100011713685 [1,1,0,0,0,0|0,0,2]=4 3534 B11R1.24 COCCc1cccc(c1)C 34a_100011217157_200000210301 [1,1,0,0,0,0|0,0,2]=4 3535 B11R1.24 COCCc1cccc(c1)C 34a_100138415774_100011713685 [1,1,0,0,0,0|0,0,2]=4 3536 B11R1.24 COCCc1cccc(c1)C 7a_100011217157_200000210301 [1,1,0,0,0,0|0,0,2]=4 3537 B11R1.24 COCNc1cccc(c1)C 2230a_100000188690_100000766300 [1,1,0,0,0,0|1,0,1]=4 3538 B11R1.24 COCSc1cccc(c1)C 62a_100000766300_100011215228 [1,1,0,0,0,0|1,0,1]=4 3539 B11R1.24 COCSc1cccc(c1)C 62a_100011215228_100000766300 [1,1,0,0,0,0|1,0,1]=4 3540 B11R1.24 CSCCc1cccc(c1)C 62a_100011713685_200000210301 [1,1,0,0,0,0|0,0,2]=4 3541 B11R1.24 CSCCc1cccc(c1)C 62a_200000210301_100011713685 [1,1,0,0,0,0|0,0,2]=4 3542 B11R1.24 CSCNc1cccc(c1)C 2230a_100000188690_100011218213 [1,1,0,0,0,0|1,0,1]=4 3543 B11R1.24 CSCNc1cccc(c1)C 34a_100000188690_100011218213 [1,1,0,0,0,0|1,0,1]=4 3544 B11R1.24 CSCOc1cccc(c1)C 34a_100000210337_100011218213 [1,1,0,0,0,0|1,0,1]=4 3545 B11R1.24 CSCSc1cccc(c1)C 62a_100011215228_100011218213 [1,1,0,0,0,0|1,0,1]=4 3546 B11R1.24 CSCSc1cccc(c1)C 62a_100011218213_100011215228 [1,1,0,0,0,0|1,0,1]=4 3547 B11R1.24 C[n+]1cccc(c1)SCC=O 62a_100009996589_200015260668 [1,1,0,0,0,0|2,0,0]=4 3548 B11R1.24 C[n+]1cccc(c1)SCC=O 62a_200015260668_100009996589 [1,1,0,0,0,0|2,0,0]=4 3549 B11R1.24 Cc1cc(ccn1)OCC=O 34a_100000688365_200009817547 [1,1,0,0,0,0|2,0,0]=4 3550 B11R1.24 Cc1cc(ccn1)SCC=O 62a_100000758586_200015260668 [1,1,0,0,0,0|2,0,0]=4 3551 B11R1.24 Cc1cc(ccn1)SCC=O 62a_200015260668_100000758586 [1,1,0,0,0,0|2,0,0]=4 3552 B11R1.24 Cc1cccc(c1)CCN[13CH3] 2230a_100000749837_200025704644 [1,1,0,0,0,0|0,0,2]=4 3553 B11R1.24 Cc1cccc(c1)CCN[13CH3] 34a_100000749837_200025704644 [1,1,0,0,0,0|0,0,2]=4 3554 B11R1.24 Cc1cccc(c1)CCO[13CH3] 34a_100011217157_200025704644 [1,1,0,0,0,0|0,0,2]=4 3555 B11R1.24 Cc1cccc(c1)CCO[13CH3] 7a_100011217157_200025704644 [1,1,0,0,0,0|0,0,2]=4 3556 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_100011713685_200025704644 [1,1,0,0,0,0|0,0,2]=4 3557 B11R1.24 Cc1cccc(c1)CCS[13CH3] 62a_200025704644_100011713685 [1,1,0,0,0,0|0,0,2]=4 3558 B11R1.24 Cc1cccc(c1)CNCF 34a_100000185548_100015361967 [1,1,0,0,0,0|1,0,1]=4 3559 B11R1.24 Cc1cccc(c1)COCF 34a_100011217746_100015361967 [1,1,0,0,0,0|1,0,1]=4 3560 B11R1.24 Cc1cccc(c1)COCF 7a_100011217746_100015361967 [1,1,0,0,0,0|1,0,1]=4 3561 B11R1.24 Cc1cccc(c1)CSCF 62a_100000211840_100015361967 [1,1,0,0,0,0|1,0,1]=4 3562 B11R1.24 Cc1cccc(c1)CSCF 62a_100015361967_100000211840 [1,1,0,0,0,0|1,0,1]=4 3563 B11R1.24 Cc1cccc(c1)NCC#N 2230a_100000188690_100011215382 [1,1,0,0,0,0|1,0,1]=4 3564 B11R1.24 Cc1cccc(c1)NCC=O 2230a_100000188690_200015260668 [1,1,0,0,0,0|1,0,0]=3 3565 B11R1.24 Cc1cccc(c1)NCC=O 34a_100000188690_200009817547 [1,1,0,0,0,0|1,0,0]=3 3566 B11R1.24 Cc1cccc(c1)NCCF 2230a_100000188690_100011217306 [1,1,0,0,0,0|1,0,1]=4 3567 B11R1.24 Cc1cccc(c1)NCCF 34a_100000188690_100011217306 [1,1,0,0,0,0|1,0,1]=4 3568 B11R1.24 Cc1cccc(c1)NCCO 2230a_100000188690_100000211926 [1,1,0,0,0,0|1,0,1]=4 3569 B11R1.24 Cc1cccc(c1)NCCO 34a_100000188690_100000211926 [1,1,0,0,0,0|1,0,1]=4 3570 B11R1.24 Cc1cccc(c1)OCC#N 7a_100000210337_100011215382 [1,1,0,0,0,0|1,0,1]=4 3571 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [1,1,0,0,0,0|1,0,0]=3 3572 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [1,1,0,0,0,0|1,0,0]=3 3573 B11R1.24 Cc1cccc(c1)OCCF 34a_100000210337_100011217306 [1,1,0,0,0,0|1,0,1]=4 3574 B11R1.24 Cc1cccc(c1)OCCF 7a_100000210337_100011217306 [1,1,0,0,0,0|1,0,1]=4 3575 B11R1.24 Cc1cccc(c1)OCCO 34a_100000210337_100000211926 [1,1,0,0,0,0|1,0,1]=4 3576 B11R1.24 Cc1cccc(c1)OCCO 7a_100000210337_100000211926 [1,1,0,0,0,0|1,0,1]=4 3577 B11R1.24 Cc1cccc(c1)SCC#N 62a_100011215228_100011215382 [1,1,0,0,0,0|1,0,1]=4 3578 B11R1.24 Cc1cccc(c1)SCC#N 62a_100011215382_100011215228 [1,1,0,0,0,0|1,0,1]=4 3579 B11R1.24 Cc1cccc(c1)SCC=O 62a_100011215228_200015260668 [1,1,0,0,0,0|1,0,0]=3 3580 B11R1.24 Cc1cccc(c1)SCC=O 62a_200015260668_100011215228 [1,1,0,0,0,0|1,0,0]=3 3581 B11R1.24 Cc1cccc(c1)SCCF 62a_100011215228_100011217306 [1,1,0,0,0,0|1,0,1]=4 3582 B11R1.24 Cc1cccc(c1)SCCF 62a_100011217306_100011215228 [1,1,0,0,0,0|1,0,1]=4 3583 B11R1.24 Cc1cccc(c1)SCCO 62a_100000211926_100011215228 [1,1,0,0,0,0|1,0,1]=4 3584 B11R1.24 Cc1cccc(c1)SCCO 62a_100011215228_100000211926 [1,1,0,0,0,0|1,0,1]=4 3585 B11R1.24 Cc1cccc(n1)SCC=O 62a_100000742759_200015260668 [1,1,0,0,0,0|2,0,0]=4 3586 B11R1.24 Cc1cccc(n1)SCC=O 62a_200015260668_100000742759 [1,1,0,0,0,0|2,0,0]=4 3587 B11R1.24 Cc1ccnc(c1)SCC=O 62a_100000750283_200015260668 [1,1,0,0,0,0|2,0,0]=4 3588 B11R1.24 Cc1ccnc(c1)SCC=O 62a_200015260668_100000750283 [1,1,0,0,0,0|2,0,0]=4 3589 B11R1.24 Cc1cncc(c1)OCC=O 34a_100011830280_200009817547 [1,1,0,0,0,0|2,0,0]=4 3590 B11R1.24 Cc1cncc(c1)OCC=O 7a_100011830280_200015260668 [1,1,0,0,0,0|2,0,0]=4 3591 B11R1.24 Cc1cncc(c1)SCC=O 62a_100000760492_200015260668 [1,1,0,0,0,0|2,0,0]=4 3592 B11R1.24 Cc1cncc(c1)SCC=O 62a_200015260668_100000760492 [1,1,0,0,0,0|2,0,0]=4 3593 B11R1.24 Nc1cccc(c1)OCC=O 34a_100000210217_200009817547 [1,1,0,0,0,0|2,0,0]=4 3594 B11R1.24 Nc1cccc(c1)SCC=O 62a_100000210019_200015260668 [1,1,0,0,0,0|2,0,0]=4 3595 B11R1.24 Nc1cccc(c1)SCC=O 62a_200015260668_100000210019 [1,1,0,0,0,0|2,0,0]=4 3596 B11R1.24 O=CCNc1cccc(c1)Br 34a_100000210019_200009817547 [1,1,0,0,0,0|2,0,0]=4 3597 B11R1.24 O=CCNc1cccc(c1)Cl 34a_100000185859_200009817547 [1,1,0,0,0,0|2,0,0]=4 3598 B11R1.24 O=CCNc1cccc(c1)F 34a_100000210047_200009817547 [1,1,0,0,0,0|2,0,0]=4 3599 B11R1.24 O=CCNc1cccc(c1)I 34a_100000211102_200009817547 [1,1,0,0,0,0|2,0,0]=4 3600 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [1,1,0,0,0,0|2,0,0]=4 3601 B11R1.24 O=CCOc1cccc(c1)Br 34a_100000210342_200009817547 [1,1,0,0,0,0|2,0,0]=4 3602 B11R1.24 O=CCOc1cccc(c1)Br 7a_100000210342_200015260668 [1,1,0,0,0,0|2,0,0]=4 3603 B11R1.24 O=CCOc1cccc(c1)Cl 34a_100000210295_200009817547 [1,1,0,0,0,0|2,0,0]=4 3604 B11R1.24 O=CCOc1cccc(c1)Cl 7a_100000210295_200015260668 [1,1,0,0,0,0|2,0,0]=4 3605 B11R1.24 O=CCOc1cccc(c1)F 34a_100000210426_200009817547 [1,1,0,0,0,0|2,0,0]=4 3606 B11R1.24 O=CCOc1cccc(c1)F 7a_100000210426_200015260668 [1,1,0,0,0,0|2,0,0]=4 3607 B11R1.24 O=CCOc1cccc(c1)I 34a_100000211634_200009817547 [1,1,0,0,0,0|2,0,0]=4 3608 B11R1.24 O=CCOc1cccc(c1)I 7a_100000211634_200015260668 [1,1,0,0,0,0|2,0,0]=4 3609 B11R1.24 O=CCSc1cccc(c1)Br 62a_100000691529_200015260668 [1,1,0,0,0,0|2,0,0]=4 3610 B11R1.24 O=CCSc1cccc(c1)Br 62a_200015260668_100000691529 [1,1,0,0,0,0|2,0,0]=4 3611 B11R1.24 O=CCSc1cccc(c1)Cl 62a_100000699651_200015260668 [1,1,0,0,0,0|2,0,0]=4 3612 B11R1.24 O=CCSc1cccc(c1)Cl 62a_200015260668_100000699651 [1,1,0,0,0,0|2,0,0]=4 3613 B11R1.24 O=CCSc1cccc(c1)F 62a_100000685547_200015260668 [1,1,0,0,0,0|2,0,0]=4 3614 B11R1.24 O=CCSc1cccc(c1)F 62a_200015260668_100000685547 [1,1,0,0,0,0|2,0,0]=4 3615 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [1,1,0,0,0,0|2,0,0]=4 3616 B11R1.24 O=CCSc1cccc(c1)[S] 62a_114929384022_200015260668 [1,1,0,0,0,0|2,0,0]=4 3617 B11R1.24 O=CCSc1cccc(c1)[S] 62a_200015260668_114929384022 [1,1,0,0,0,0|2,0,0]=4 3618 B11R1.34 C=C=Cc1cc(cc(c1)C)C 271570a_100015277604_100011215608 [1,1,0,0,0,0|0,0,2]=4 3619 B11R1.34 C=C=Cc1cc(cc(c1)Cl)C 271570a_100015277604_100010172791 [1,1,0,0,0,0|0,0,2]=4 3620 B11R1.34 C=C=Cc1cc(cc(c1)F)C 271570a_100015277604_100011356977 [1,1,0,0,0,0|0,0,2]=4 3621 B11R1.34 C=C=Cc1cc(cc(c1)N)C 271570a_100015277604_100000695972 [1,1,0,0,0,0|0,0,2]=4 3622 B11R1.34 C=C=Cc1cc(cc(c1)O)C 271570a_100015277604_100011999630 [1,1,0,0,0,0|0,0,2]=4 3623 B11R1.34 CC=Cc1cc(cc(c1)C)C 271570a_100016259895_100011215608 [1,1,0,0,0,0|0,0,2]=4 3624 B11R1.34 CC=Cc1cc(cc(c1)Cl)C 271570a_100016259895_100010172791 [1,1,0,0,0,0|0,0,2]=4 3625 B11R1.34 CC=Cc1cc(cc(c1)F)C 271570a_100016259895_100011356977 [1,1,0,0,0,0|0,0,2]=4 3626 B11R1.34 CC=Cc1cc(cc(c1)N)C 271570a_100016259895_100000695972 [1,1,0,0,0,0|0,0,2]=4 3627 B11R1.34 CC=Cc1cc(cc(c1)O)C 271570a_100016259895_100011999630 [1,1,0,0,0,0|0,0,2]=4 3628 B11R1.34 CNCc1cc(cc(c1)Br)C 207a_100102657272_100000686105 [1,1,0,0,0,0|1,0,1]=4 3629 B11R1.34 CNCc1cc(cc(c1)Br)C 2230a_106832991635_100012348363 [1,1,0,0,0,0|1,0,1]=4 3630 B11R1.34 CNCc1cc(cc(c1)Br)C 269862a_106832991636_100000686105 [1,1,0,0,0,0|1,0,1]=4 3631 B11R1.34 CNCc1cc(cc(c1)Br)C 26a_100102657272_100011999630 [1,1,0,0,0,0|1,0,1]=4 3632 B11R1.34 CNCc1cc(cc(c1)Br)C 270004a_106832991635_100000686105 [1,1,0,0,0,0|1,0,1]=4 3633 B11R1.34 CNCc1cc(cc(c1)Br)C 34a_100102657272_100012348363 [1,1,0,0,0,0|1,0,1]=4 3634 B11R1.34 CNCc1cc(cc(c1)Br)C 7a_106832991635_100012348363 [1,1,0,0,0,0|1,0,1]=4 3635 B11R1.34 CNCc1cc(cc(c1)C)C 207a_100102657272_100000745632 [1,1,0,0,0,0|1,0,1]=4 3636 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_100020591340_200000210301 [1,1,0,0,0,0|1,0,1]=4 3637 B11R1.34 CNCc1cc(cc(c1)C)C 2230a_106832991635_100000181317 [1,1,0,0,0,0|1,0,1]=4 3638 B11R1.34 CNCc1cc(cc(c1)C)C 270004a_106832991635_100000745632 [1,1,0,0,0,0|1,0,1]=4 3639 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100020591340_200000210301 [1,1,0,0,0,0|1,0,1]=4 3640 B11R1.34 CNCc1cc(cc(c1)C)C 34a_100102657272_100000181317 [1,1,0,0,0,0|1,0,1]=4 3641 B11R1.34 CNCc1cc(cc(c1)C)C 7a_106832991635_100000181317 [1,1,0,0,0,0|1,0,1]=4 3642 B11R1.34 CNCc1cc(cc(c1)Cl)C 207a_100102657272_100000684525 [1,1,0,0,0,0|1,0,1]=4 3643 B11R1.34 CNCc1cc(cc(c1)Cl)C 270004a_106832991635_100000684525 [1,1,0,0,0,0|1,0,1]=4 3644 B11R1.34 CNCc1cc(cc(c1)F)C 207a_100102657272_100011217087 [1,1,0,0,0,0|1,0,1]=4 3645 B11R1.34 CNCc1cc(cc(c1)F)C 2230a_100011830484_200000210301 [1,1,0,0,0,0|1,0,1]=4 3646 B11R1.34 CNCc1cc(cc(c1)F)C 2230a_106832991635_100011219130 [1,1,0,0,0,0|1,0,1]=4 3647 B11R1.34 CNCc1cc(cc(c1)F)C 270004a_106832991635_100011217087 [1,1,0,0,0,0|1,0,1]=4 3648 B11R1.34 CNCc1cc(cc(c1)F)C 34a_100011830484_200000210301 [1,1,0,0,0,0|1,0,1]=4 3649 B11R1.34 CNCc1cc(cc(c1)F)C 34a_100102657272_100011219130 [1,1,0,0,0,0|1,0,1]=4 3650 B11R1.34 CNCc1cc(cc(c1)F)C 7a_106832991635_100011219130 [1,1,0,0,0,0|1,0,1]=4 3651 B11R1.34 CNCc1cc(cc(c1)O)C 207a_100102657272_100009853434 [1,1,0,0,0,0|1,0,1]=4 3652 B11R1.34 CNCc1cc(cc(c1)O)C 270004a_106832991635_100009853434 [1,1,0,0,0,0|1,0,1]=4 3653 B11R1.34 COCc1cc(cc(c1)Br)C 34a_100000720511_200000210301 [1,1,0,0,0,0|1,0,1]=4 3654 B11R1.34 COCc1cc(cc(c1)Br)C 34a_100138415774_100012348363 [1,1,0,0,0,0|1,0,1]=4 3655 B11R1.34 COCc1cc(cc(c1)Br)C 7a_100000720511_200000210301 [1,1,0,0,0,0|1,0,1]=4 3656 B11R1.34 COCc1cc(cc(c1)C)C 34a_100011216556_200000210301 [1,1,0,0,0,0|1,0,1]=4 3657 B11R1.34 COCc1cc(cc(c1)C)C 34a_100138415774_100000181317 [1,1,0,0,0,0|1,0,1]=4 3658 B11R1.34 COCc1cc(cc(c1)C)C 7a_100011216556_200000210301 [1,1,0,0,0,0|1,0,1]=4 3659 B11R1.34 COCc1cc(cc(c1)F)C 34a_100011217934_200000210301 [1,1,0,0,0,0|1,0,1]=4 3660 B11R1.34 COCc1cc(cc(c1)F)C 34a_100138415774_100011219130 [1,1,0,0,0,0|1,0,1]=4 3661 B11R1.34 COCc1cc(cc(c1)F)C 7a_100011217934_200000210301 [1,1,0,0,0,0|1,0,1]=4 3662 B11R1.34 CSCc1cc(cc(c1)Br)C 62a_100012348363_200000210301 [1,1,0,0,0,0|1,0,1]=4 3663 B11R1.34 CSCc1cc(cc(c1)Br)C 62a_200000210301_100012348363 [1,1,0,0,0,0|1,0,1]=4 3664 B11R1.34 CSCc1cc(cc(c1)C)C 62a_100000181317_200000210301 [1,1,0,0,0,0|1,0,1]=4 3665 B11R1.34 CSCc1cc(cc(c1)C)C 62a_200000210301_100000181317 [1,1,0,0,0,0|1,0,1]=4 3666 B11R1.34 CSCc1cc(cc(c1)F)C 62a_100011219130_200000210301 [1,1,0,0,0,0|1,0,1]=4 3667 B11R1.34 CSCc1cc(cc(c1)F)C 62a_200000210301_100011219130 [1,1,0,0,0,0|1,0,1]=4 3668 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 2230a_100020591340_200025704644 [1,1,0,0,0,0|1,0,1]=4 3669 B11R1.34 Cc1cc(cc(c1)CN[13CH3])C 34a_100020591340_200025704644 [1,1,0,0,0,0|1,0,1]=4 3670 B11R1.34 Cc1cc(cc(c1)CN[13CH3])F 2230a_100011830484_200025704644 [1,1,0,0,0,0|1,0,1]=4 3671 B11R1.34 Cc1cc(cc(c1)CN[13CH3])F 34a_100011830484_200025704644 [1,1,0,0,0,0|1,0,1]=4 3672 B11R1.34 Cc1cc(cc(c1)CO[13CH3])Br 34a_100000720511_200025704644 [1,1,0,0,0,0|1,0,1]=4 3673 B11R1.34 Cc1cc(cc(c1)CO[13CH3])Br 7a_100000720511_200025704644 [1,1,0,0,0,0|1,0,1]=4 3674 B11R1.34 Cc1cc(cc(c1)CO[13CH3])C 34a_100011216556_200025704644 [1,1,0,0,0,0|1,0,1]=4 3675 B11R1.34 Cc1cc(cc(c1)CO[13CH3])C 7a_100011216556_200025704644 [1,1,0,0,0,0|1,0,1]=4 3676 B11R1.34 Cc1cc(cc(c1)CO[13CH3])F 34a_100011217934_200025704644 [1,1,0,0,0,0|1,0,1]=4 3677 B11R1.34 Cc1cc(cc(c1)CO[13CH3])F 7a_100011217934_200025704644 [1,1,0,0,0,0|1,0,1]=4 3678 B11R1.34 Cc1cc(cc(c1)CS[13CH3])Br 62a_100012348363_200025704644 [1,1,0,0,0,0|1,0,1]=4 3679 B11R1.34 Cc1cc(cc(c1)CS[13CH3])Br 62a_200025704644_100012348363 [1,1,0,0,0,0|1,0,1]=4 3680 B11R1.34 Cc1cc(cc(c1)CS[13CH3])C 62a_100000181317_200025704644 [1,1,0,0,0,0|1,0,1]=4 3681 B11R1.34 Cc1cc(cc(c1)CS[13CH3])C 62a_200025704644_100000181317 [1,1,0,0,0,0|1,0,1]=4 3682 B11R1.34 Cc1cc(cc(c1)CS[13CH3])F 62a_100011219130_200025704644 [1,1,0,0,0,0|1,0,1]=4 3683 B11R1.34 Cc1cc(cc(c1)CS[13CH3])F 62a_200025704644_100011219130 [1,1,0,0,0,0|1,0,1]=4 3684 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [1,1,0,0,0,0|0,0,2]=4 3685 B11R1.157 CC(=O)Cc1cc(ccn1)C 1458a_100000070787_100000718516 [1,1,0,0,0,0|1,0,1]=4 3686 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [1,1,0,0,0,0|1,0,1]=4 3687 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [1,1,0,0,0,0|1,0,1]=4 3688 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [1,1,0,0,0,0|0,0,1]=3 3689 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [1,1,0,0,0,0|0,0,1]=3 3690 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [1,1,0,0,0,0|1,0,1]=4 3691 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [1,1,0,0,0,0|1,0,1]=4 3692 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [1,1,0,0,0,0|1,0,1]=4 3693 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [1,1,0,0,0,0|1,0,1]=4 3694 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [1,1,0,0,0,0|1,0,1]=4 3695 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [1,1,0,0,0,0|1,0,1]=4 3696 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [1,1,0,0,0,0|1,0,1]=4 3697 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [1,1,0,0,0,0|1,0,1]=4 3698 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [1,1,0,0,0,0|1,0,1]=4 3699 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100000070787_100000757606 [1,1,0,0,0,0|1,0,1]=4 3700 B11R1.157 CC(=O)Cc1cccc(n1)C 1458a_100012001110_200000210301 [1,1,0,0,0,0|1,0,1]=4 3701 B11R1.157 CC(=O)Cc1ccnc(c1)C 1458a_100000070787_200020672517 [1,1,0,0,0,0|1,0,1]=4 3702 B11R1.157 CC(=O)Cc1cncc(c1)C 1458a_100000070787_100000716715 [1,1,0,0,0,0|1,0,1]=4 3703 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [1,1,0,0,0,0|1,0,1]=4 3704 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [1,1,0,0,0,0|1,0,1]=4 3705 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [1,1,0,0,0,0|1,0,1]=4 3706 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [1,1,0,0,0,0|1,0,1]=4 3707 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [1,1,0,0,0,0|0,0,1]=3 3708 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_100102631434_100000211840 [1,1,0,0,0,0|1,0,1]=4 3709 B11R1.157 Cc1cccc(c1)CN(C)C 2230a_102495364743_200000210301 [1,1,0,0,0,0|1,0,1]=4 3710 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_100102631434_100000211840 [1,1,0,0,0,0|1,0,1]=4 3711 B11R1.157 Cc1cccc(c1)CN(C)C 269982a_102495364743_200000210301 [1,1,0,0,0,0|1,0,1]=4 3712 B11R1.157 Cc1cccc(c1)CN(C)C 270004a_100102631434_100000211157 [1,1,0,0,0,0|1,0,1]=4 3713 B11R1.157 Cc1cccc(c1)CN(C)C 34a_102495364743_200000210301 [1,1,0,0,0,0|1,0,1]=4 3714 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 2230a_102495364743_200025704644 [1,1,0,0,0,0|1,0,1]=4 3715 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 269982a_102495364743_200025704644 [1,1,0,0,0,0|1,0,1]=4 3716 B11R1.157 Cc1cccc(c1)CN(C)[13CH3] 34a_102495364743_200025704644 [1,1,0,0,0,0|1,0,1]=4 3717 B11R1.157 Cc1cccc(n1)CC(=O)[13CH3] 1458a_100012001110_200025704644 [1,1,0,0,0,0|1,0,1]=4 3718 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [1,1,0,0,0,0|2,0,0]=4 3719 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [1,1,0,0,0,0|1,0,1]=4 3720 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [1,1,0,0,0,0|1,0,1]=4 3721 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [1,1,0,0,0,0|1,0,1]=4 3722 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [1,1,0,0,0,0|1,0,1]=4 3723 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [1,1,0,0,0,0|1,0,1]=4 3724 B11R1.189 C=C=Cc1cccc(c1)CC 271570a_100015277604_100000684523 [1,1,0,0,0,0|0,0,2]=4 3725 B11R1.189 C=C=Cc1cccc(c1)CF 271570a_100015277604_100010878472 [1,1,0,0,0,0|0,0,2]=4 3726 B11R1.189 C=C=Cc1cccc(c1)CN 271570a_100015277604_100000106179 [1,1,0,0,0,0|0,0,2]=4 3727 B11R1.189 C=C=Cc1cccc(c1)CO 271570a_100015277604_100000687537 [1,1,0,0,0,0|0,0,2]=4 3728 B11R1.189 C=C=Cc1cccc(c1)NC 271570a_100015277604_100000219648 [1,1,0,0,0,0|0,0,2]=4 3729 B11R1.189 C=C=Cc1cccc(c1)OC 271570a_100015277604_100000170001 [1,1,0,0,0,0|0,0,2]=4 3730 B11R1.189 C=C=Cc1cccc(c1)SC 271570a_100015277604_100011215954 [1,1,0,0,0,0|0,0,2]=4 3731 B11R1.189 C=CCc1cccc(c1)C=C 271570a_100011290941_100009816576 [1,1,0,0,0,0|0,0,1]=3 3732 B11R1.189 C=CCc1cccc(c1)SC 62a_100009816576_200000210301 [1,1,0,0,0,0|0,0,0]=2 3733 B11R1.189 C=CCc1cccc(c1)SC 62a_200000210301_100009816576 [1,1,0,0,0,0|0,0,0]=2 3734 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_100009816576_200025704644 [1,1,0,0,0,0|0,0,0]=2 3735 B11R1.189 C=CCc1cccc(c1)S[13CH3] 62a_200025704644_100009816576 [1,1,0,0,0,0|0,0,0]=2 3736 B11R1.189 C=Cc1cccc(c1)CC=O 271570a_100011290941_200000698211 [1,1,0,0,0,0|1,0,1]=4 3737 B11R1.189 CC=Cc1cccc(c1)CC 271570a_100016259895_100000684523 [1,1,0,0,0,0|0,0,2]=4 3738 B11R1.189 CC=Cc1cccc(c1)CF 271570a_100016259895_100010878472 [1,1,0,0,0,0|0,0,2]=4 3739 B11R1.189 CC=Cc1cccc(c1)CN 271570a_100016259895_100000106179 [1,1,0,0,0,0|0,0,2]=4 3740 B11R1.189 CC=Cc1cccc(c1)CO 271570a_100016259895_100000687537 [1,1,0,0,0,0|0,0,2]=4 3741 B11R1.189 CC=Cc1cccc(c1)NC 271570a_100016259895_100000219648 [1,1,0,0,0,0|0,0,2]=4 3742 B11R1.189 CC=Cc1cccc(c1)OC 271570a_100016259895_100000170001 [1,1,0,0,0,0|0,0,2]=4 3743 B11R1.189 CC=Cc1cccc(c1)SC 271570a_100016259895_100011215954 [1,1,0,0,0,0|0,0,2]=4 3744 B11R1.189 CCCc1cccc(c1)OC 34a_100000039106_200000210301 [1,1,0,0,0,0|0,0,2]=4 3745 B11R1.189 CCCc1cccc(c1)OC 7a_100000039106_200000210301 [1,1,0,0,0,0|0,0,2]=4 3746 B11R1.189 CCCc1cccc(c1)O[13CH3] 34a_100000039106_200025704644 [1,1,0,0,0,0|0,0,2]=4 3747 B11R1.189 CCCc1cccc(c1)O[13CH3] 7a_100000039106_200025704644 [1,1,0,0,0,0|0,0,2]=4 3748 B11R1.189 CCCc1cccc(c1)SC 62a_100000694964_200000210301 [1,1,0,0,0,0|0,0,2]=4 3749 B11R1.189 CCCc1cccc(c1)SC 62a_200000210301_100000694964 [1,1,0,0,0,0|0,0,2]=4 3750 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_100000694964_200025704644 [1,1,0,0,0,0|0,0,2]=4 3751 B11R1.189 CCCc1cccc(c1)S[13CH3] 62a_200025704644_100000694964 [1,1,0,0,0,0|0,0,2]=4 3752 B11R1.189 CCc1cccc(c1)CNC 207a_100102657272_100011999841 [1,1,0,0,0,0|1,0,1]=4 3753 B11R1.189 CCc1cccc(c1)CNC 26a_100102657272_100000211550 [1,1,0,0,0,0|1,0,1]=4 3754 B11R1.189 CCc1cccc(c1)CNC 270004a_106832991635_100011999841 [1,1,0,0,0,0|1,0,1]=4 3755 B11R1.189 CNCc1cccc(c1)CBr 26a_100102657272_100011660834 [1,1,0,0,0,0|1,0,1]=4 3756 B11R1.189 CNCc1cccc(c1)CCl 26a_100102657272_100000084143 [1,1,0,0,0,0|1,0,1]=4 3757 B11R1.189 CNCc1cccc(c1)CO 207a_100102657272_200000050894 [1,1,0,0,0,0|1,0,1]=4 3758 B11R1.189 CNCc1cccc(c1)CO 2230a_100011269909_200000210301 [1,1,0,0,0,0|1,0,1]=4 3759 B11R1.189 CNCc1cccc(c1)CO 2230a_106832991635_100010188025 [1,1,0,0,0,0|1,0,1]=4 3760 B11R1.189 CNCc1cccc(c1)CO 26a_100102657272_100011214949 [1,1,0,0,0,0|1,0,1]=4 3761 B11R1.189 CNCc1cccc(c1)CO 270004a_106832991635_200000050894 [1,1,0,0,0,0|1,0,1]=4 3762 B11R1.189 CNCc1cccc(c1)CO 34a_100011269909_200000210301 [1,1,0,0,0,0|1,0,1]=4 3763 B11R1.189 CNCc1cccc(c1)CO 34a_100102657272_100010188025 [1,1,0,0,0,0|1,0,1]=4 3764 B11R1.189 CNCc1cccc(c1)CO 7a_106832991635_100010188025 [1,1,0,0,0,0|1,0,1]=4 3765 B11R1.189 CNCc1cccc(c1)OC 207a_100102657272_100000170238 [1,1,0,0,0,0|1,0,1]=4 3766 B11R1.189 CNCc1cccc(c1)OC 2230a_100000174954_200000210301 [1,1,0,0,0,0|1,0,1]=4 3767 B11R1.189 CNCc1cccc(c1)OC 2230a_106832991635_100000211672 [1,1,0,0,0,0|1,0,1]=4 3768 B11R1.189 CNCc1cccc(c1)OC 26a_100102657272_100000211255 [1,1,0,0,0,0|1,0,1]=4 3769 B11R1.189 CNCc1cccc(c1)OC 270004a_106832991635_100000170238 [1,1,0,0,0,0|1,0,1]=4 3770 B11R1.189 CNCc1cccc(c1)OC 34a_100000174954_200000210301 [1,1,0,0,0,0|1,0,1]=4 3771 B11R1.189 CNCc1cccc(c1)OC 34a_100000207540_200000210301 [1,1,0,0,0,0|1,0,1]=4 3772 B11R1.189 CNCc1cccc(c1)OC 34a_100102657272_100000688526 [1,1,0,0,0,0|1,0,1]=4 3773 B11R1.189 CNCc1cccc(c1)OC 7a_106832991635_100000211672 [1,1,0,0,0,0|1,0,1]=4 3774 B11R1.189 CNCc1cccc(c1)O[13CH3] 34a_100000207540_200025704644 [1,1,0,0,0,0|1,0,1]=4 3775 B11R1.189 CNCc1cccc(c1)SC 207a_100102657272_100011935093 [1,1,0,0,0,0|1,0,1]=4 3776 B11R1.189 CNCc1cccc(c1)SC 26a_100102657272_100011265683 [1,1,0,0,0,0|1,0,1]=4 3777 B11R1.189 CNCc1cccc(c1)SC 270004a_106832991635_100011935093 [1,1,0,0,0,0|1,0,1]=4 3778 B11R1.189 CNCc1cccc(c1)SC 62a_100000187585_200000210301 [1,1,0,0,0,0|1,0,1]=4 3779 B11R1.189 CNCc1cccc(c1)SC 62a_200000210301_100000187585 [1,1,0,0,0,0|1,0,1]=4 3780 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_100000187585_200025704644 [1,1,0,0,0,0|1,0,1]=4 3781 B11R1.189 CNCc1cccc(c1)S[13CH3] 62a_200025704644_100000187585 [1,1,0,0,0,0|1,0,1]=4 3782 B11R1.189 CNc1cccc(c1)CC#N 2230a_100000017804_200000210301 [1,1,0,0,0,0|1,0,1]=4 3783 B11R1.189 CNc1cccc(c1)CC#N 34a_100000017804_200000210301 [1,1,0,0,0,0|1,0,1]=4 3784 B11R1.189 CNc1cccc(c1)CCO 2230a_100011996697_200000210301 [1,1,0,0,0,0|1,0,1]=4 3785 B11R1.189 CNc1cccc(c1)CCO 34a_100011996697_200000210301 [1,1,0,0,0,0|1,0,1]=4 3786 B11R1.189 CNc1cccc(c1)COC 2230a_100000737370_200000210301 [1,1,0,0,0,0|1,0,1]=4 3787 B11R1.189 CNc1cccc(c1)COC 34a_100000737370_200000210301 [1,1,0,0,0,0|1,0,1]=4 3788 B11R1.189 COCc1cccc(c1)CBr 34a_100010188025_200000210301 [1,1,0,0,0,0|1,0,1]=4 3789 B11R1.189 COCc1cccc(c1)CBr 7a_100010188025_200000210301 [1,1,0,0,0,0|1,0,1]=4 3790 B11R1.189 COCc1cccc(c1)CCl 34a_200000090956_200000210301 [1,1,0,0,0,0|1,0,1]=4 3791 B11R1.189 COCc1cccc(c1)CCl 7a_200000090956_200000210301 [1,1,0,0,0,0|1,0,1]=4 3792 B11R1.189 COCc1cccc(c1)CN 34a_100011269909_200000210301 [1,1,0,0,0,0|1,0,1]=4 3793 B11R1.189 COCc1cccc(c1)CO 34a_100138415774_100010188025 [1,1,0,0,0,0|1,0,1]=4 3794 B11R1.189 COCc1cccc(c1)N[13CH3] 2230a_100000737370_200025704644 [1,1,0,0,0,0|1,0,1]=4 3795 B11R1.189 COCc1cccc(c1)N[13CH3] 34a_100000737370_200025704644 [1,1,0,0,0,0|1,0,1]=4 3796 B11R1.189 COCc1cccc(c1)OC 34a_100000198976_200000210301 [1,1,0,0,0,0|1,0,1]=4 3797 B11R1.189 COCc1cccc(c1)OC 34a_100138415774_100000688526 [1,1,0,0,0,0|1,0,1]=4 3798 B11R1.189 COCc1cccc(c1)SC 62a_100011493687_200000210301 [1,1,0,0,0,0|1,0,1]=4 3799 B11R1.189 COCc1cccc(c1)SC 62a_200000210301_100011493687 [1,1,0,0,0,0|1,0,1]=4 3800 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_100011493687_200025704644 [1,1,0,0,0,0|1,0,1]=4 3801 B11R1.189 COCc1cccc(c1)S[13CH3] 62a_200025704644_100011493687 [1,1,0,0,0,0|1,0,1]=4 3802 B11R1.189 COc1cccc(c1)CC#N 7a_100000696680_200000210301 [1,1,0,0,0,0|1,0,1]=4 3803 B11R1.189 COc1cccc(c1)CCN 34a_100000747277_200000210301 [1,1,0,0,0,0|1,0,1]=4 3804 B11R1.189 COc1cccc(c1)CCO 34a_100011215281_200000210301 [1,1,0,0,0,0|1,0,1]=4 3805 B11R1.189 COc1cccc(c1)CCO 7a_100011215281_200000210301 [1,1,0,0,0,0|1,0,1]=4 3806 B11R1.189 COc1cccc(c1)CNN 34a_100000008902_200000210301 [1,1,0,0,0,0|2,0,0]=4 3807 B11R1.189 COc1cccc(c1)CN[13CH3] 2230a_100000174954_200025704644 [1,1,0,0,0,0|1,0,1]=4 3808 B11R1.189 COc1cccc(c1)CN[13CH3] 34a_100000174954_200025704644 [1,1,0,0,0,0|1,0,1]=4 3809 B11R1.189 COc1cccc(c1)CO[13CH3] 34a_100000198976_200025704644 [1,1,0,0,0,0|1,0,1]=4 3810 B11R1.189 COc1cccc(c1)CSC 62a_100000688526_200000210301 [1,1,0,0,0,0|1,0,1]=4 3811 B11R1.189 COc1cccc(c1)CSC 62a_200000210301_100000211672 [1,1,0,0,0,0|1,0,1]=4 3812 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_100000688526_200025704644 [1,1,0,0,0,0|1,0,1]=4 3813 B11R1.189 COc1cccc(c1)CS[13CH3] 62a_200025704644_100000211672 [1,1,0,0,0,0|1,0,1]=4 3814 B11R1.189 CSCc1cccc(c1)CO 62a_100010188025_200000210301 [1,1,0,0,0,0|1,0,1]=4 3815 B11R1.189 CSCc1cccc(c1)CO 62a_200000210301_100010188025 [1,1,0,0,0,0|1,0,1]=4 3816 B11R1.189 CSc1cccc(c1)CC#N 62a_100000034040_200000210301 [1,1,0,0,0,0|1,0,1]=4 3817 B11R1.189 CSc1cccc(c1)CC#N 62a_200000210301_100000034040 [1,1,0,0,0,0|1,0,1]=4 3818 B11R1.189 CSc1cccc(c1)CC=O 62a_200000210301_200000698211 [1,1,0,0,0,0|1,0,0]=3 3819 B11R1.189 CSc1cccc(c1)CC=O 62a_200000698211_200000210301 [1,1,0,0,0,0|1,0,0]=3 3820 B11R1.189 CSc1cccc(c1)CCN 62a_100011207229_200000210301 [1,1,0,0,0,0|1,0,1]=4 3821 B11R1.189 CSc1cccc(c1)CCN 62a_200000210301_100011207229 [1,1,0,0,0,0|1,0,1]=4 3822 B11R1.189 CSc1cccc(c1)CCO 62a_100011217444_200000210301 [1,1,0,0,0,0|1,0,1]=4 3823 B11R1.189 CSc1cccc(c1)CCO 62a_200000210301_100011217444 [1,1,0,0,0,0|1,0,1]=4 3824 B11R1.189 CSc1cccc(c1)CNN 62a_100000686200_200000210301 [1,1,0,0,0,0|2,0,0]=4 3825 B11R1.189 CSc1cccc(c1)CNN 62a_200000210301_100000686200 [1,1,0,0,0,0|2,0,0]=4 3826 B11R1.189 [13CH3]NCc1cccc(c1)CO 2230a_100011269909_200025704644 [1,1,0,0,0,0|1,0,1]=4 3827 B11R1.189 [13CH3]NCc1cccc(c1)CO 34a_100011269909_200025704644 [1,1,0,0,0,0|1,0,1]=4 3828 B11R1.189 [13CH3]Nc1cccc(c1)CC#N 2230a_100000017804_200025704644 [1,1,0,0,0,0|1,0,1]=4 3829 B11R1.189 [13CH3]Nc1cccc(c1)CC#N 34a_100000017804_200025704644 [1,1,0,0,0,0|1,0,1]=4 3830 B11R1.189 [13CH3]Nc1cccc(c1)CCO 2230a_100011996697_200025704644 [1,1,0,0,0,0|1,0,1]=4 3831 B11R1.189 [13CH3]Nc1cccc(c1)CCO 34a_100011996697_200025704644 [1,1,0,0,0,0|1,0,1]=4 3832 B11R1.189 [13CH3]OCc1cccc(c1)CBr 34a_100010188025_200025704644 [1,1,0,0,0,0|1,0,1]=4 3833 B11R1.189 [13CH3]OCc1cccc(c1)CBr 7a_100010188025_200025704644 [1,1,0,0,0,0|1,0,1]=4 3834 B11R1.189 [13CH3]OCc1cccc(c1)CCl 34a_200000090956_200025704644 [1,1,0,0,0,0|1,0,1]=4 3835 B11R1.189 [13CH3]OCc1cccc(c1)CCl 7a_200000090956_200025704644 [1,1,0,0,0,0|1,0,1]=4 3836 B11R1.189 [13CH3]OCc1cccc(c1)CN 34a_100011269909_200025704644 [1,1,0,0,0,0|1,0,1]=4 3837 B11R1.189 [13CH3]Oc1cccc(c1)CC#N 7a_100000696680_200025704644 [1,1,0,0,0,0|1,0,1]=4 3838 B11R1.189 [13CH3]Oc1cccc(c1)CCN 34a_100000747277_200025704644 [1,1,0,0,0,0|1,0,1]=4 3839 B11R1.189 [13CH3]Oc1cccc(c1)CCO 34a_100011215281_200025704644 [1,1,0,0,0,0|1,0,1]=4 3840 B11R1.189 [13CH3]Oc1cccc(c1)CCO 7a_100011215281_200025704644 [1,1,0,0,0,0|1,0,1]=4 3841 B11R1.189 [13CH3]Oc1cccc(c1)CNN 34a_100000008902_200025704644 [1,1,0,0,0,0|2,0,0]=4 3842 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_100010188025_200025704644 [1,1,0,0,0,0|1,0,1]=4 3843 B11R1.189 [13CH3]SCc1cccc(c1)CO 62a_200025704644_100010188025 [1,1,0,0,0,0|1,0,1]=4 3844 B11R1.189 [13CH3]Sc1cccc(c1)CC#N 62a_100000034040_200025704644 [1,1,0,0,0,0|1,0,1]=4 3845 B11R1.189 [13CH3]Sc1cccc(c1)CC#N 62a_200025704644_100000034040 [1,1,0,0,0,0|1,0,1]=4 3846 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200000698211_200025704644 [1,1,0,0,0,0|1,0,0]=3 3847 B11R1.189 [13CH3]Sc1cccc(c1)CC=O 62a_200025704644_200000698211 [1,1,0,0,0,0|1,0,0]=3 3848 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_100011207229_200025704644 [1,1,0,0,0,0|1,0,1]=4 3849 B11R1.189 [13CH3]Sc1cccc(c1)CCN 62a_200025704644_100011207229 [1,1,0,0,0,0|1,0,1]=4 3850 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_100011217444_200025704644 [1,1,0,0,0,0|1,0,1]=4 3851 B11R1.189 [13CH3]Sc1cccc(c1)CCO 62a_200025704644_100011217444 [1,1,0,0,0,0|1,0,1]=4 3852 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_100000686200_200025704644 [1,1,0,0,0,0|2,0,0]=4 3853 B11R1.189 [13CH3]Sc1cccc(c1)CNN 62a_200025704644_100000686200 [1,1,0,0,0,0|2,0,0]=4 3854 B11R1.192 C=C=Cc1ccc(c(c1)C)Br 271570a_100015277604_100009813585 [1,1,0,0,0,0|0,0,2]=4 3855 B11R1.192 C=C=Cc1ccc(c(c1)C)C 271570a_100015277604_100011215607 [1,1,0,0,0,0|0,0,2]=4 3856 B11R1.192 C=C=Cc1ccc(c(c1)C)Cl 271570a_100015277604_100000049509 [1,1,0,0,0,0|0,0,2]=4 3857 B11R1.192 C=C=Cc1ccc(c(c1)C)F 271570a_100015277604_100011218330 [1,1,0,0,0,0|0,0,2]=4 3858 B11R1.192 C=C=Cc1ccc(c(c1)C)N 271570a_100015277604_100000211769 [1,1,0,0,0,0|0,0,2]=4 3859 B11R1.192 C=C=Cc1ccc(c(c1)C)O 271570a_100015277604_100000186361 [1,1,0,0,0,0|0,0,2]=4 3860 B11R1.192 CC=Cc1ccc(c(c1)C)Br 271570a_100016259895_100009813585 [1,1,0,0,0,0|0,0,2]=4 3861 B11R1.192 CC=Cc1ccc(c(c1)C)C 271570a_100016259895_100011215607 [1,1,0,0,0,0|0,0,2]=4 3862 B11R1.192 CC=Cc1ccc(c(c1)C)Cl 271570a_100016259895_100000049509 [1,1,0,0,0,0|0,0,2]=4 3863 B11R1.192 CC=Cc1ccc(c(c1)C)F 271570a_100016259895_100011218330 [1,1,0,0,0,0|0,0,2]=4 3864 B11R1.192 CC=Cc1ccc(c(c1)C)N 271570a_100016259895_100000211769 [1,1,0,0,0,0|0,0,2]=4 3865 B11R1.192 CC=Cc1ccc(c(c1)C)O 271570a_100016259895_100000186361 [1,1,0,0,0,0|0,0,2]=4 3866 B11R1.192 CNCc1ccc(c(c1)C)Br 207a_100102657272_100000765772 [1,1,0,0,0,0|1,0,1]=4 3867 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_100015205234_200000210301 [1,1,0,0,0,0|1,0,1]=4 3868 B11R1.192 CNCc1ccc(c(c1)C)Br 2230a_106832991635_100000727479 [1,1,0,0,0,0|1,0,1]=4 3869 B11R1.192 CNCc1ccc(c(c1)C)Br 26a_100102657272_100000690111 [1,1,0,0,0,0|1,0,1]=4 3870 B11R1.192 CNCc1ccc(c(c1)C)Br 270004a_106832991635_100000765772 [1,1,0,0,0,0|1,0,1]=4 3871 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100015205234_200000210301 [1,1,0,0,0,0|1,0,1]=4 3872 B11R1.192 CNCc1ccc(c(c1)C)Br 34a_100102657272_100000727479 [1,1,0,0,0,0|1,0,1]=4 3873 B11R1.192 CNCc1ccc(c(c1)C)Br 7a_106832991635_100000727479 [1,1,0,0,0,0|1,0,1]=4 3874 B11R1.192 CNCc1ccc(c(c1)C)C 207a_100102657272_100000229942 [1,1,0,0,0,0|1,0,1]=4 3875 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_100025706692_200000210301 [1,1,0,0,0,0|1,0,1]=4 3876 B11R1.192 CNCc1ccc(c(c1)C)C 2230a_106832991635_100000742320 [1,1,0,0,0,0|1,0,1]=4 3877 B11R1.192 CNCc1ccc(c(c1)C)C 270004a_106832991635_100000229942 [1,1,0,0,0,0|1,0,1]=4 3878 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100025706692_200000210301 [1,1,0,0,0,0|1,0,1]=4 3879 B11R1.192 CNCc1ccc(c(c1)C)C 34a_100102657272_100000742320 [1,1,0,0,0,0|1,0,1]=4 3880 B11R1.192 CNCc1ccc(c(c1)C)C 7a_106832991635_100000742320 [1,1,0,0,0,0|1,0,1]=4 3881 B11R1.192 CNCc1ccc(c(c1)C)Cl 207a_100102657272_100000698814 [1,1,0,0,0,0|1,0,1]=4 3882 B11R1.192 CNCc1ccc(c(c1)C)Cl 2230a_106832991635_100012184735 [1,1,0,0,0,0|1,0,1]=4 3883 B11R1.192 CNCc1ccc(c(c1)C)Cl 26a_100102657272_100000211092 [1,1,0,0,0,0|1,0,1]=4 3884 B11R1.192 CNCc1ccc(c(c1)C)Cl 270004a_106832991635_100000698814 [1,1,0,0,0,0|1,0,1]=4 3885 B11R1.192 CNCc1ccc(c(c1)C)Cl 34a_100102657272_100012184735 [1,1,0,0,0,0|1,0,1]=4 3886 B11R1.192 CNCc1ccc(c(c1)C)Cl 7a_106832991635_100012184735 [1,1,0,0,0,0|1,0,1]=4 3887 B11R1.192 CNCc1ccc(c(c1)C)F 207a_100102657272_100000748208 [1,1,0,0,0,0|1,0,1]=4 3888 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_100000239911_200000210301 [1,1,0,0,0,0|1,0,1]=4 3889 B11R1.192 CNCc1ccc(c(c1)C)F 2230a_106832991635_100011216667 [1,1,0,0,0,0|1,0,1]=4 3890 B11R1.192 CNCc1ccc(c(c1)C)F 270004a_106832991635_100000748208 [1,1,0,0,0,0|1,0,1]=4 3891 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100000239911_200000210301 [1,1,0,0,0,0|1,0,1]=4 3892 B11R1.192 CNCc1ccc(c(c1)C)F 34a_100102657272_100011216667 [1,1,0,0,0,0|1,0,1]=4 3893 B11R1.192 CNCc1ccc(c(c1)C)F 7a_106832991635_100011216667 [1,1,0,0,0,0|1,0,1]=4 3894 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100000718852_200000210301 [1,1,0,0,0,0|1,0,1]=4 3895 B11R1.192 COCc1ccc(c(c1)C)Br 34a_100138415774_100000727479 [1,1,0,0,0,0|1,0,1]=4 3896 B11R1.192 COCc1ccc(c(c1)C)Br 7a_100000718852_200000210301 [1,1,0,0,0,0|1,0,1]=4 3897 B11R1.192 COCc1ccc(c(c1)C)C 34a_100011215342_200000210301 [1,1,0,0,0,0|1,0,1]=4 3898 B11R1.192 COCc1ccc(c(c1)C)C 34a_100138415774_100000742320 [1,1,0,0,0,0|1,0,1]=4 3899 B11R1.192 COCc1ccc(c(c1)C)C 7a_100011215342_200000210301 [1,1,0,0,0,0|1,0,1]=4 3900 B11R1.192 COCc1ccc(c(c1)C)Cl 34a_100138415774_100012184735 [1,1,0,0,0,0|1,0,1]=4 3901 B11R1.192 COCc1ccc(c(c1)C)F 34a_100011219793_200000210301 [1,1,0,0,0,0|1,0,1]=4 3902 B11R1.192 COCc1ccc(c(c1)C)F 34a_100138415774_100011216667 [1,1,0,0,0,0|1,0,1]=4 3903 B11R1.192 COCc1ccc(c(c1)C)F 7a_100011219793_200000210301 [1,1,0,0,0,0|1,0,1]=4 3904 B11R1.192 COCc1ccc(c(c1)C)N 34a_200011997030_200000210301 [1,1,0,0,0,0|1,0,1]=4 3905 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_100000727479_200000210301 [1,1,0,0,0,0|1,0,1]=4 3906 B11R1.192 CSCc1ccc(c(c1)C)Br 62a_200000210301_100000727479 [1,1,0,0,0,0|1,0,1]=4 3907 B11R1.192 CSCc1ccc(c(c1)C)C 62a_100000742320_200000210301 [1,1,0,0,0,0|1,0,1]=4 3908 B11R1.192 CSCc1ccc(c(c1)C)C 62a_200000210301_100000742320 [1,1,0,0,0,0|1,0,1]=4 3909 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_100012184735_200000210301 [1,1,0,0,0,0|1,0,1]=4 3910 B11R1.192 CSCc1ccc(c(c1)C)Cl 62a_200000210301_100012184735 [1,1,0,0,0,0|1,0,1]=4 3911 B11R1.192 CSCc1ccc(c(c1)C)F 62a_100011216667_200000210301 [1,1,0,0,0,0|1,0,1]=4 3912 B11R1.192 CSCc1ccc(c(c1)C)F 62a_200000210301_100011216667 [1,1,0,0,0,0|1,0,1]=4 3913 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 2230a_100015205234_200025704644 [1,1,0,0,0,0|1,0,1]=4 3914 B11R1.192 Cc1cc(ccc1Br)CN[13CH3] 34a_100015205234_200025704644 [1,1,0,0,0,0|1,0,1]=4 3915 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 34a_100000718852_200025704644 [1,1,0,0,0,0|1,0,1]=4 3916 B11R1.192 Cc1cc(ccc1Br)CO[13CH3] 7a_100000718852_200025704644 [1,1,0,0,0,0|1,0,1]=4 3917 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_100000727479_200025704644 [1,1,0,0,0,0|1,0,1]=4 3918 B11R1.192 Cc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100000727479 [1,1,0,0,0,0|1,0,1]=4 3919 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_100012184735_200025704644 [1,1,0,0,0,0|1,0,1]=4 3920 B11R1.192 Cc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_100012184735 [1,1,0,0,0,0|1,0,1]=4 3921 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 2230a_100000239911_200025704644 [1,1,0,0,0,0|1,0,1]=4 3922 B11R1.192 Cc1cc(ccc1F)CN[13CH3] 34a_100000239911_200025704644 [1,1,0,0,0,0|1,0,1]=4 3923 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 34a_100011219793_200025704644 [1,1,0,0,0,0|1,0,1]=4 3924 B11R1.192 Cc1cc(ccc1F)CO[13CH3] 7a_100011219793_200025704644 [1,1,0,0,0,0|1,0,1]=4 3925 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_100011216667_200025704644 [1,1,0,0,0,0|1,0,1]=4 3926 B11R1.192 Cc1cc(ccc1F)CS[13CH3] 62a_200025704644_100011216667 [1,1,0,0,0,0|1,0,1]=4 3927 B11R1.192 Cc1cc(ccc1N)CO[13CH3] 34a_200011997030_200025704644 [1,1,0,0,0,0|1,0,1]=4 3928 B11R1.192 Cc1cc(ccc1O)CC#N 271570a_203496583355_100000726167 [1,1,0,0,0,0|1,0,1]=4 3929 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 2230a_100025706692_200025704644 [1,1,0,0,0,0|1,0,1]=4 3930 B11R1.192 Cc1ccc(cc1C)CN[13CH3] 34a_100025706692_200025704644 [1,1,0,0,0,0|1,0,1]=4 3931 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 34a_100011215342_200025704644 [1,1,0,0,0,0|1,0,1]=4 3932 B11R1.192 Cc1ccc(cc1C)CO[13CH3] 7a_100011215342_200025704644 [1,1,0,0,0,0|1,0,1]=4 3933 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_100000742320_200025704644 [1,1,0,0,0,0|1,0,1]=4 3934 B11R1.192 Cc1ccc(cc1C)CS[13CH3] 62a_200025704644_100000742320 [1,1,0,0,0,0|1,0,1]=4 3935 B11R1.212 C=CCSc1csc(c1C)C 62a_100000210623_100009820295 [0,1,0,0,1,0|2,0,0]=4 3936 B11R1.212 C=CCSc1csc(c1C)C 62a_100009820295_100000210623 [0,1,0,0,1,0|2,0,0]=4 3937 B13R1.12 C#CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000184674 [0,2,0,0,0,0|0,0,2]=4 3938 B13R1.12 C=CCC(=O)c1cccc(c1Br)Br 1458a_100012360534_100000210623 [0,2,0,0,0,0|2,0,0]=4 3939 B13R1.12 C=CCC(=O)c1cccc(c1Br)C 1458a_100000692419_100000210623 [0,2,0,0,0,0|1,0,0]=3 3940 B13R1.12 C=CCC(=O)c1cccc(c1Br)Cl 1458a_100012339722_100000210623 [0,2,0,0,0,0|2,0,0]=4 3941 B13R1.12 C=CCC(=O)c1cccc(c1Br)F 1458a_100011217547_100000210623 [0,2,0,0,0,0|2,0,0]=4 3942 B13R1.12 C=CCC(=O)c1cccc(c1Br)I 1458a_100010232522_100000210623 [0,2,0,0,0,0|2,0,0]=4 3943 B13R1.12 C=CCC(=O)c1cccc(c1Br)O 1458a_100010230362_100000210623 [0,2,0,0,0,0|2,0,0]=4 3944 B13R1.12 C=CCC(=O)c1cccc(c1C)Br 1458a_100000760464_100000210623 [0,2,0,0,0,0|2,0,0]=4 3945 B13R1.12 C=CCC(=O)c1cccc(c1C)C 1458a_100000183679_100000210623 [0,2,0,0,0,0|1,0,0]=3 3946 B13R1.12 C=CCC(=O)c1cccc(c1C)Cl 1458a_100000690184_100000210623 [0,2,0,0,0,0|2,0,0]=4 3947 B13R1.12 C=CCC(=O)c1cccc(c1C)F 1458a_100011218272_100000210623 [0,2,0,0,0,0|2,0,0]=4 3948 B13R1.12 C=CCC(=O)c1cccc(c1C)I 1458a_100000751865_100000210623 [0,2,0,0,0,0|2,0,0]=4 3949 B13R1.12 C=CCC(=O)c1cccc(c1C)O 1458a_100000766327_100000210623 [0,2,0,0,0,0|2,0,0]=4 3950 B13R1.12 C=CCC(=O)c1cccc(c1Cl)Br 1458a_100000760540_100000210623 [0,2,0,0,0,0|2,0,0]=4 3951 B13R1.12 C=CCC(=O)c1cccc(c1Cl)C 1458a_100000693142_100000210623 [0,2,0,0,0,0|1,0,0]=3 3952 B13R1.12 C=CCC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_100000210623 [0,2,0,0,0,0|2,0,0]=4 3953 B13R1.12 C=CCC(=O)c1cccc(c1Cl)F 1458a_100000759904_100000210623 [0,2,0,0,0,0|2,0,0]=4 3954 B13R1.12 C=CCC(=O)c1cccc(c1Cl)I 1458a_100010176783_100000210623 [0,2,0,0,0,0|2,0,0]=4 3955 B13R1.12 C=CCC(=O)c1cccc(c1Cl)O 1458a_100000092362_100000210623 [0,2,0,0,0,0|2,0,0]=4 3956 B13R1.12 C=CCC(=O)c1cccc(c1F)Br 1458a_100000756403_100000210623 [0,2,0,0,0,0|2,0,0]=4 3957 B13R1.12 C=CCC(=O)c1cccc(c1F)C 1458a_100000766181_100000210623 [0,2,0,0,0,0|1,0,0]=3 3958 B13R1.12 C=CCC(=O)c1cccc(c1F)Cl 1458a_100000688816_100000210623 [0,2,0,0,0,0|2,0,0]=4 3959 B13R1.12 C=CCC(=O)c1cccc(c1F)F 1458a_100000748134_100000210623 [0,2,0,0,0,0|2,0,0]=4 3960 B13R1.12 C=CCC(=O)c1cccc(c1F)I 1458a_100010185205_100000210623 [0,2,0,0,0,0|2,0,0]=4 3961 B13R1.12 C=CCC(=O)c1cccc(c1F)O 1458a_100000037433_100000210623 [0,2,0,0,0,0|2,0,0]=4 3962 B13R1.12 C=CCC(=O)c1cccc(c1I)Br 1458a_100000688019_100000210623 [0,2,0,0,0,0|2,0,0]=4 3963 B13R1.12 C=CCC(=O)c1cccc(c1I)C 1458a_100000739377_100000210623 [0,2,0,0,0,0|1,0,0]=3 3964 B13R1.12 C=CCC(=O)c1cccc(c1I)Cl 1458a_100010176784_100000210623 [0,2,0,0,0,0|2,0,0]=4 3965 B13R1.12 C=CCC(=O)c1cccc(c1I)F 1458a_100000690930_100000210623 [0,2,0,0,0,0|2,0,0]=4 3966 B13R1.12 C=CCC(=O)c1cccc(c1I)O 1458a_100010084636_100000210623 [0,2,0,0,0,0|2,0,0]=4 3967 B13R1.12 C=CCC(=O)c1cccc(c1O)Br 1458a_100000752940_100000210623 [0,2,0,0,0,0|1,0,0]=3 3968 B13R1.12 C=CCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210623 [0,2,0,0,0,0|0,0,0]=2 3969 B13R1.12 C=CCC(=O)c1cccc(c1O)Cl 1458a_100000742801_100000210623 [0,2,0,0,0,0|1,0,0]=3 3970 B13R1.12 C=CCC(=O)c1cccc(c1O)F 1458a_100011217230_100000210623 [0,2,0,0,0,0|1,0,0]=3 3971 B13R1.12 C=CCC(=O)c1cccc(c1O)O 1458a_100000690420_100000210623 [0,2,0,0,0,0|1,0,0]=3 3972 B13R1.12 C=CCN(C)c1cccc(c1C)Cl 2230a_100020606106_100000210623 [0,2,0,0,0,0|2,0,0]=4 3973 B13R1.12 C=CCN(C)c1cccc(c1C)Cl 269982a_100020606106_100000210623 [0,2,0,0,0,0|2,0,0]=4 3974 B13R1.12 C=CCN(C)c1cccc(c1C)Cl 34a_100020606106_100015514636 [0,2,0,0,0,0|2,0,0]=4 3975 B13R1.12 C=CCN(C)c1cccc(c1C)Cl 38a_100020606106_100000210623 [0,2,0,0,0,0|2,0,0]=4 3976 B13R1.12 C=CCN(C)c1cccc(c1Cl)Cl 2230a_100000742713_100000210623 [0,2,0,0,0,0|2,0,0]=4 3977 B13R1.12 C=CCN(C)c1cccc(c1Cl)Cl 269982a_100000742713_100000210623 [0,2,0,0,0,0|2,0,0]=4 3978 B13R1.12 C=CCN(C)c1cccc(c1Cl)Cl 34a_100000742713_100015514636 [0,2,0,0,0,0|2,0,0]=4 3979 B13R1.12 C=CCN(C)c1cccc(c1F)Cl 2230a_100020633735_100000210623 [0,2,0,0,0,0|2,0,0]=4 3980 B13R1.12 C=CCN(C)c1cccc(c1F)Cl 269982a_100020633735_100000210623 [0,2,0,0,0,0|2,0,0]=4 3981 B13R1.12 C=CCN(C)c1cccc(c1F)Cl 34a_100020633735_100015514636 [0,2,0,0,0,0|2,0,0]=4 3982 B13R1.12 C=CCN(C)c1cccc(c1F)Cl 38a_100020633735_100000210623 [0,2,0,0,0,0|2,0,0]=4 3983 B13R1.12 CCCC(=O)c1cccc(c1O)C 1458a_100000183896_100000210303 [0,2,0,0,0,0|0,0,2]=4 3984 B13R1.12 CCNC(C)c1cccc(c1O)C 269862a_100015525214_100009847209 [0,2,0,0,0,0|0,0,2]=4 3985 B13R1.12 Cc1cccc(c1O)C(=O)CC#N 1458a_100000183896_100011214920 [0,2,0,0,0,0|1,0,1]=4 3986 B13R1.12 Cc1cccc(c1O)C(=O)CCF 1458a_100000183896_100011217306 [0,2,0,0,0,0|1,0,1]=4 3987 B13R1.12 Cc1cccc(c1O)C(=O)CCO 1458a_100000183896_100000211926 [0,2,0,0,0,0|1,0,1]=4 3988 B13R1.107 CNC(C)c1cccc(c1OC)C 269862a_106832991636_100000101305 [0,2,0,0,0,0|1,0,1]=4 3989 B13R1.3768 CC(=C(C)c1cccc(c1O)C)C 271570a_200000049429_100009817157 [0,2,0,0,0,0|0,0,2]=4 3990 B13R1.3768 CC(=O)C(C)c1cccc(c1C)C 1458a_100000070787_100012183177 [0,2,0,0,0,0|1,0,1]=4 3991 B13R1.4789 CNC(C)c1cc(cc(c1O)C)C 269862a_106832991636_100000188341 [0,2,0,0,0,0|1,0,1]=4 3992 B13R1.16 C#CCCNc1cccc(c1O)C 34a_100000756359_100000688953 [0,2,0,0,0,0|0,0,2]=4 3993 B13R1.16 C#CCCSc1cccc(c1O)C 62a_100000688953_100009817157 [0,2,0,0,0,0|0,0,2]=4 3994 B13R1.16 C#CCCSc1cccc(c1O)C 62a_100009817157_100000688953 [0,2,0,0,0,0|0,0,2]=4 3995 B13R1.16 C#CCNCc1cccc(c1O)C 34a_100020639391_100000184674 [0,2,0,0,0,0|0,0,2]=4 3996 B13R1.16 C/C=C/CNc1cccc(c1Br)C 34a_100000684715_100102629194 [0,2,0,0,0,0|1,0,0]=3 3997 B13R1.16 C/C=C/CNc1cccc(c1Br)Cl 34a_100000687072_100102629194 [0,2,0,0,0,0|2,0,0]=4 3998 B13R1.16 C/C=C/CNc1cccc(c1Br)F 34a_100011934729_100102629194 [0,2,0,0,0,0|2,0,0]=4 3999 B13R1.16 C/C=C/CNc1cccc(c1Br)O 34a_100012183704_100102629194 [0,2,0,0,0,0|2,0,0]=4 4000 B13R1.16 C/C=C/CNc1cccc(c1Br)O 7a_100012183704_100102629194 [0,2,0,0,0,0|2,0,0]=4 4001 B13R1.16 C/C=C/CNc1cccc(c1C)Br 34a_100000750434_100102629194 [0,2,0,0,0,0|2,0,0]=4 4002 B13R1.16 C/C=C/CNc1cccc(c1C)C 34a_100000210026_100102629194 [0,2,0,0,0,0|1,0,0]=3 4003 B13R1.16 C/C=C/CNc1cccc(c1C)C 7a_100000210026_100102629194 [0,2,0,0,0,0|1,0,0]=3 4004 B13R1.16 C/C=C/CNc1cccc(c1C)Cl 34a_100000210441_100102629194 [0,2,0,0,0,0|2,0,0]=4 4005 B13R1.16 C/C=C/CNc1cccc(c1C)Cl 7a_100000210441_100102629194 [0,2,0,0,0,0|2,0,0]=4 4006 B13R1.16 C/C=C/CNc1cccc(c1C)F 34a_100000745574_100102629194 [0,2,0,0,0,0|2,0,0]=4 4007 B13R1.16 C/C=C/CNc1cccc(c1C)F 7a_100000745574_100102629194 [0,2,0,0,0,0|2,0,0]=4 4008 B13R1.16 C/C=C/CNc1cccc(c1C)I 34a_100000761887_100102629194 [0,2,0,0,0,0|2,0,0]=4 4009 B13R1.16 C/C=C/CNc1cccc(c1C)O 34a_100011216573_100102629194 [0,2,0,0,0,0|2,0,0]=4 4010 B13R1.16 C/C=C/CNc1cccc(c1C)O 7a_100011216573_100102629194 [0,2,0,0,0,0|2,0,0]=4 4011 B13R1.16 C/C=C/CNc1cccc(c1Cl)Br 34a_100000687075_100102629194 [0,2,0,0,0,0|2,0,0]=4 4012 B13R1.16 C/C=C/CNc1cccc(c1Cl)C 34a_100000765562_100102629194 [0,2,0,0,0,0|1,0,0]=3 4013 B13R1.16 C/C=C/CNc1cccc(c1Cl)C 7a_100000765562_100102629194 [0,2,0,0,0,0|1,0,0]=3 4014 B13R1.16 C/C=C/CNc1cccc(c1Cl)Cl 34a_100000185733_100102629194 [0,2,0,0,0,0|2,0,0]=4 4015 B13R1.16 C/C=C/CNc1cccc(c1Cl)F 34a_100000692321_100102629194 [0,2,0,0,0,0|2,0,0]=4 4016 B13R1.16 C/C=C/CNc1cccc(c1Cl)O 34a_100012002038_100102629194 [0,2,0,0,0,0|2,0,0]=4 4017 B13R1.16 C/C=C/CNc1cccc(c1Cl)O 7a_100012002038_100102629194 [0,2,0,0,0,0|2,0,0]=4 4018 B13R1.16 C/C=C/CNc1cccc(c1F)Br 34a_100011935091_100102629194 [0,2,0,0,0,0|2,0,0]=4 4019 B13R1.16 C/C=C/CNc1cccc(c1F)C 34a_100000697159_100102629194 [0,2,0,0,0,0|1,0,0]=3 4020 B13R1.16 C/C=C/CNc1cccc(c1F)C 7a_100000697159_100102629194 [0,2,0,0,0,0|1,0,0]=3 4021 B13R1.16 C/C=C/CNc1cccc(c1F)Cl 34a_100000199060_100102629194 [0,2,0,0,0,0|2,0,0]=4 4022 B13R1.16 C/C=C/CNc1cccc(c1F)F 34a_100000743855_100102629194 [0,2,0,0,0,0|2,0,0]=4 4023 B13R1.16 C/C=C/CNc1cccc(c1I)Br 34a_100020590159_100102629194 [0,2,0,0,0,0|2,0,0]=4 4024 B13R1.16 C/C=C/CNc1cccc(c1I)C 34a_100000761888_100102629194 [0,2,0,0,0,0|1,0,0]=3 4025 B13R1.16 C/C=C/CNc1cccc(c1I)Cl 34a_100000049713_100102629194 [0,2,0,0,0,0|2,0,0]=4 4026 B13R1.16 C/C=C/CNc1cccc(c1I)F 34a_100000690935_100102629194 [0,2,0,0,0,0|2,0,0]=4 4027 B13R1.16 C/C=C/CNc1cccc(c1O)Br 34a_100011934915_100102629194 [0,2,0,0,0,0|1,0,0]=3 4028 B13R1.16 C/C=C/CNc1cccc(c1O)C 34a_100000756359_100102629194 [0,2,0,0,0,0|0,0,0]=2 4029 B13R1.16 C/C=C/CNc1cccc(c1O)Cl 34a_100000754742_100102629194 [0,2,0,0,0,0|1,0,0]=3 4030 B13R1.16 C/C=C/CNc1cccc(c1O)F 34a_100011934987_100102629194 [0,2,0,0,0,0|1,0,0]=3 4031 B13R1.16 C/C=C/COc1cccc(c1Br)Br 34a_100010187966_100102629194 [0,2,0,0,0,0|2,0,0]=4 4032 B13R1.16 C/C=C/COc1cccc(c1Br)Br 7a_100010187966_100102629194 [0,2,0,0,0,0|2,0,0]=4 4033 B13R1.16 C/C=C/COc1cccc(c1Br)C 34a_100000686692_100102629194 [0,2,0,0,0,0|1,0,0]=3 4034 B13R1.16 C/C=C/COc1cccc(c1Br)C 7a_100000686692_100102629194 [0,2,0,0,0,0|1,0,0]=3 4035 B13R1.16 C/C=C/COc1cccc(c1Br)Cl 34a_100012348804_100102629194 [0,2,0,0,0,0|2,0,0]=4 4036 B13R1.16 C/C=C/COc1cccc(c1Br)Cl 7a_100012348804_100102629194 [0,2,0,0,0,0|2,0,0]=4 4037 B13R1.16 C/C=C/COc1cccc(c1Br)F 34a_100009820682_100102629194 [0,2,0,0,0,0|2,0,0]=4 4038 B13R1.16 C/C=C/COc1cccc(c1Br)F 7a_100009820682_100102629194 [0,2,0,0,0,0|2,0,0]=4 4039 B13R1.16 C/C=C/COc1cccc(c1Br)I 34a_100010187914_100102629194 [0,2,0,0,0,0|2,0,0]=4 4040 B13R1.16 C/C=C/COc1cccc(c1Br)I 7a_100010187914_100102629194 [0,2,0,0,0,0|2,0,0]=4 4041 B13R1.16 C/C=C/COc1cccc(c1Br)N 34a_100012183704_100102629194 [0,2,0,0,0,0|2,0,0]=4 4042 B13R1.16 C/C=C/COc1cccc(c1Br)N 7a_100012183704_100102629194 [0,2,0,0,0,0|2,0,0]=4 4043 B13R1.16 C/C=C/COc1cccc(c1C)Br 34a_100012002258_100102629194 [0,2,0,0,0,0|2,0,0]=4 4044 B13R1.16 C/C=C/COc1cccc(c1C)Br 7a_100012002258_100102629194 [0,2,0,0,0,0|2,0,0]=4 4045 B13R1.16 C/C=C/COc1cccc(c1C)C 34a_100000185855_100102629194 [0,2,0,0,0,0|1,0,0]=3 4046 B13R1.16 C/C=C/COc1cccc(c1C)C 7a_100000185855_100102629194 [0,2,0,0,0,0|1,0,0]=3 4047 B13R1.16 C/C=C/COc1cccc(c1C)Cl 34a_100011265684_100102629194 [0,2,0,0,0,0|2,0,0]=4 4048 B13R1.16 C/C=C/COc1cccc(c1C)Cl 7a_100011265684_100102629194 [0,2,0,0,0,0|2,0,0]=4 4049 B13R1.16 C/C=C/COc1cccc(c1C)F 34a_100011217231_100102629194 [0,2,0,0,0,0|2,0,0]=4 4050 B13R1.16 C/C=C/COc1cccc(c1C)F 7a_100011217231_100102629194 [0,2,0,0,0,0|2,0,0]=4 4051 B13R1.16 C/C=C/COc1cccc(c1C)N 34a_100011216573_100102629194 [0,2,0,0,0,0|2,0,0]=4 4052 B13R1.16 C/C=C/COc1cccc(c1C)N 7a_100011216573_100102629194 [0,2,0,0,0,0|2,0,0]=4 4053 B13R1.16 C/C=C/COc1cccc(c1Cl)Br 34a_100010187913_100102629194 [0,2,0,0,0,0|2,0,0]=4 4054 B13R1.16 C/C=C/COc1cccc(c1Cl)Br 7a_100010187913_100102629194 [0,2,0,0,0,0|2,0,0]=4 4055 B13R1.16 C/C=C/COc1cccc(c1Cl)C 34a_100000695629_100102629194 [0,2,0,0,0,0|1,0,0]=3 4056 B13R1.16 C/C=C/COc1cccc(c1Cl)C 7a_100000695629_100102629194 [0,2,0,0,0,0|1,0,0]=3 4057 B13R1.16 C/C=C/COc1cccc(c1Cl)Cl 34a_100000211076_100102629194 [0,2,0,0,0,0|2,0,0]=4 4058 B13R1.16 C/C=C/COc1cccc(c1Cl)Cl 7a_100000211076_100102629194 [0,2,0,0,0,0|2,0,0]=4 4059 B13R1.16 C/C=C/COc1cccc(c1Cl)F 34a_100000087408_100102629194 [0,2,0,0,0,0|2,0,0]=4 4060 B13R1.16 C/C=C/COc1cccc(c1Cl)F 7a_100000087408_100102629194 [0,2,0,0,0,0|2,0,0]=4 4061 B13R1.16 C/C=C/COc1cccc(c1Cl)I 34a_100000049636_100102629194 [0,2,0,0,0,0|2,0,0]=4 4062 B13R1.16 C/C=C/COc1cccc(c1Cl)I 7a_100000049636_100102629194 [0,2,0,0,0,0|2,0,0]=4 4063 B13R1.16 C/C=C/COc1cccc(c1Cl)N 34a_100012002038_100102629194 [0,2,0,0,0,0|2,0,0]=4 4064 B13R1.16 C/C=C/COc1cccc(c1Cl)N 7a_100012002038_100102629194 [0,2,0,0,0,0|2,0,0]=4 4065 B13R1.16 C/C=C/COc1cccc(c1F)Br 34a_100009817021_100102629194 [0,2,0,0,0,0|2,0,0]=4 4066 B13R1.16 C/C=C/COc1cccc(c1F)Br 7a_100009817021_100102629194 [0,2,0,0,0,0|2,0,0]=4 4067 B13R1.16 C/C=C/COc1cccc(c1F)C 34a_100000751311_100102629194 [0,2,0,0,0,0|1,0,0]=3 4068 B13R1.16 C/C=C/COc1cccc(c1F)C 7a_100000751311_100102629194 [0,2,0,0,0,0|1,0,0]=3 4069 B13R1.16 C/C=C/COc1cccc(c1F)Cl 34a_100000687438_100102629194 [0,2,0,0,0,0|2,0,0]=4 4070 B13R1.16 C/C=C/COc1cccc(c1F)Cl 7a_100000687438_100102629194 [0,2,0,0,0,0|2,0,0]=4 4071 B13R1.16 C/C=C/COc1cccc(c1F)F 34a_100000751161_100102629194 [0,2,0,0,0,0|2,0,0]=4 4072 B13R1.16 C/C=C/COc1cccc(c1F)F 7a_100000751161_100102629194 [0,2,0,0,0,0|2,0,0]=4 4073 B13R1.16 C/C=C/COc1cccc(c1I)Br 34a_100010187912_100102629194 [0,2,0,0,0,0|2,0,0]=4 4074 B13R1.16 C/C=C/COc1cccc(c1I)Br 7a_100010187912_100102629194 [0,2,0,0,0,0|2,0,0]=4 4075 B13R1.16 C/C=C/COc1cccc(c1I)C 34a_100010083724_100102629194 [0,2,0,0,0,0|1,0,0]=3 4076 B13R1.16 C/C=C/COc1cccc(c1I)C 7a_100010083724_100102629194 [0,2,0,0,0,0|1,0,0]=3 4077 B13R1.16 C/C=C/COc1cccc(c1I)Cl 34a_100000050174_100102629194 [0,2,0,0,0,0|2,0,0]=4 4078 B13R1.16 C/C=C/COc1cccc(c1I)Cl 7a_100000050174_100102629194 [0,2,0,0,0,0|2,0,0]=4 4079 B13R1.16 C/C=C/COc1cccc(c1I)F 34a_100000690913_100102629194 [0,2,0,0,0,0|2,0,0]=4 4080 B13R1.16 C/C=C/COc1cccc(c1I)F 7a_100000690913_100102629194 [0,2,0,0,0,0|2,0,0]=4 4081 B13R1.16 C/C=C/COc1cccc(c1N)Br 34a_100011934926_100102629194 [0,2,0,0,0,0|2,0,0]=4 4082 B13R1.16 C/C=C/COc1cccc(c1N)Br 7a_100011934926_100102629194 [0,2,0,0,0,0|2,0,0]=4 4083 B13R1.16 C/C=C/COc1cccc(c1N)C 34a_100000743429_100102629194 [0,2,0,0,0,0|1,0,0]=3 4084 B13R1.16 C/C=C/COc1cccc(c1N)C 7a_100000743429_100102629194 [0,2,0,0,0,0|1,0,0]=3 4085 B13R1.16 C/C=C/COc1cccc(c1N)Cl 34a_100012022510_100102629194 [0,2,0,0,0,0|2,0,0]=4 4086 B13R1.16 C/C=C/COc1cccc(c1N)Cl 7a_100012022510_100102629194 [0,2,0,0,0,0|2,0,0]=4 4087 B13R1.16 C/C=C/COc1cccc(c1N)F 34a_100020591140_100102629194 [0,2,0,0,0,0|2,0,0]=4 4088 B13R1.16 C/C=C/COc1cccc(c1N)F 7a_100020591140_100102629194 [0,2,0,0,0,0|2,0,0]=4 4089 B13R1.16 C/C=C/COc1cccc(c1N)I 34a_200000049512_100102629194 [0,2,0,0,0,0|2,0,0]=4 4090 B13R1.16 C/C=C/COc1cccc(c1N)I 7a_200000049512_100102629194 [0,2,0,0,0,0|2,0,0]=4 4091 B13R1.16 C/C=C/COc1cccc(c1N)N 34a_100000033209_100102629194 [0,2,0,0,0,0|2,0,0]=4 4092 B13R1.16 C/C=C/COc1cccn(c1=O)C 34a_100000117616_100102629194 [0,2,0,0,0,0|1,0,1]=4 4093 B13R1.16 C/C=C/COc1cccn(c1=O)C 7a_100000117616_100102629194 [0,2,0,0,0,0|1,0,1]=4 4094 B13R1.16 C/C=C/COc1nccc(c1Br)C 34a_100012000493_100102629194 [0,2,0,0,0,0|2,0,0]=4 4095 B13R1.16 C/C=C/CSc1cccc(c1Br)Br 62a_100010175083_100102629194 [0,2,0,0,0,0|2,0,0]=4 4096 B13R1.16 C/C=C/CSc1cccc(c1Br)Br 62a_100102629194_100010175083 [0,2,0,0,0,0|2,0,0]=4 4097 B13R1.16 C/C=C/CSc1cccc(c1Br)C 62a_100012362457_100102629194 [0,2,0,0,0,0|1,0,0]=3 4098 B13R1.16 C/C=C/CSc1cccc(c1Br)C 62a_100102629194_100012362457 [0,2,0,0,0,0|1,0,0]=3 4099 B13R1.16 C/C=C/CSc1cccc(c1Br)Cl 62a_100014021842_100102629194 [0,2,0,0,0,0|2,0,0]=4 4100 B13R1.16 C/C=C/CSc1cccc(c1Br)Cl 62a_100102629194_100014021842 [0,2,0,0,0,0|2,0,0]=4 4101 B13R1.16 C/C=C/CSc1cccc(c1Br)F 62a_100010202630_100102629194 [0,2,0,0,0,0|2,0,0]=4 4102 B13R1.16 C/C=C/CSc1cccc(c1Br)F 62a_100102629194_100010202630 [0,2,0,0,0,0|2,0,0]=4 4103 B13R1.16 C/C=C/CSc1cccc(c1Br)O 62a_100010187914_100102629194 [0,2,0,0,0,0|2,0,0]=4 4104 B13R1.16 C/C=C/CSc1cccc(c1Br)O 62a_100102629194_100010187914 [0,2,0,0,0,0|2,0,0]=4 4105 B13R1.16 C/C=C/CSc1cccc(c1C)Br 62a_100012353703_100102629194 [0,2,0,0,0,0|2,0,0]=4 4106 B13R1.16 C/C=C/CSc1cccc(c1C)Br 62a_100102629194_100012353703 [0,2,0,0,0,0|2,0,0]=4 4107 B13R1.16 C/C=C/CSc1cccc(c1C)C 62a_100011214922_100102629194 [0,2,0,0,0,0|1,0,0]=3 4108 B13R1.16 C/C=C/CSc1cccc(c1C)C 62a_100102629194_100011214922 [0,2,0,0,0,0|1,0,0]=3 4109 B13R1.16 C/C=C/CSc1cccc(c1C)Cl 62a_100000726075_100102629194 [0,2,0,0,0,0|2,0,0]=4 4110 B13R1.16 C/C=C/CSc1cccc(c1C)Cl 62a_100102629194_100000726075 [0,2,0,0,0,0|2,0,0]=4 4111 B13R1.16 C/C=C/CSc1cccc(c1C)F 62a_100011216893_100102629194 [0,2,0,0,0,0|2,0,0]=4 4112 B13R1.16 C/C=C/CSc1cccc(c1C)F 62a_100102629194_100011216893 [0,2,0,0,0,0|2,0,0]=4 4113 B13R1.16 C/C=C/CSc1cccc(c1C)N 62a_100000761887_100102629194 [0,2,0,0,0,0|2,0,0]=4 4114 B13R1.16 C/C=C/CSc1cccc(c1C)N 62a_100102629194_100000761887 [0,2,0,0,0,0|2,0,0]=4 4115 B13R1.16 C/C=C/CSc1cccc(c1C)O 62a_100012002258_100102629194 [0,2,0,0,0,0|2,0,0]=4 4116 B13R1.16 C/C=C/CSc1cccc(c1C)O 62a_100102629194_100012002258 [0,2,0,0,0,0|2,0,0]=4 4117 B13R1.16 C/C=C/CSc1cccc(c1Cl)Br 62a_100010142854_100102629194 [0,2,0,0,0,0|2,0,0]=4 4118 B13R1.16 C/C=C/CSc1cccc(c1Cl)Br 62a_100102629194_100010142854 [0,2,0,0,0,0|2,0,0]=4 4119 B13R1.16 C/C=C/CSc1cccc(c1Cl)C 62a_100102629194_200012352035 [0,2,0,0,0,0|1,0,0]=3 4120 B13R1.16 C/C=C/CSc1cccc(c1Cl)C 62a_200012352035_100102629194 [0,2,0,0,0,0|1,0,0]=3 4121 B13R1.16 C/C=C/CSc1cccc(c1Cl)Cl 62a_100011215384_100102629194 [0,2,0,0,0,0|2,0,0]=4 4122 B13R1.16 C/C=C/CSc1cccc(c1Cl)Cl 62a_100102629194_100011215384 [0,2,0,0,0,0|2,0,0]=4 4123 B13R1.16 C/C=C/CSc1cccc(c1Cl)F 62a_100102629194_200010234923 [0,2,0,0,0,0|2,0,0]=4 4124 B13R1.16 C/C=C/CSc1cccc(c1Cl)F 62a_200010234923_100102629194 [0,2,0,0,0,0|2,0,0]=4 4125 B13R1.16 C/C=C/CSc1cccc(c1Cl)O 62a_100102629194_100000049636 [0,2,0,0,0,0|2,0,0]=4 4126 B13R1.16 C/C=C/CSc1cccc(c1F)Br 62a_100000702267_100102629194 [0,2,0,0,0,0|2,0,0]=4 4127 B13R1.16 C/C=C/CSc1cccc(c1F)Br 62a_100102629194_100000702267 [0,2,0,0,0,0|2,0,0]=4 4128 B13R1.16 C/C=C/CSc1cccc(c1F)C 62a_100000717567_100102629194 [0,2,0,0,0,0|1,0,0]=3 4129 B13R1.16 C/C=C/CSc1cccc(c1F)C 62a_100102629194_100000717567 [0,2,0,0,0,0|1,0,0]=3 4130 B13R1.16 C/C=C/CSc1cccc(c1F)Cl 62a_100011217346_100102629194 [0,2,0,0,0,0|2,0,0]=4 4131 B13R1.16 C/C=C/CSc1cccc(c1F)Cl 62a_100102629194_100011217346 [0,2,0,0,0,0|2,0,0]=4 4132 B13R1.16 C/C=C/CSc1cccc(c1F)F 62a_100000694657_100102629194 [0,2,0,0,0,0|2,0,0]=4 4133 B13R1.16 C/C=C/CSc1cccc(c1F)F 62a_100102629194_100000694657 [0,2,0,0,0,0|2,0,0]=4 4134 B13R1.16 C/C=C/CSc1cccc(c1F)N 62a_100011935091_100102629194 [0,2,0,0,0,0|2,0,0]=4 4135 B13R1.16 C/C=C/CSc1cccc(c1F)N 62a_100102629194_100011935091 [0,2,0,0,0,0|2,0,0]=4 4136 B13R1.16 C/C=C/CSc1cccc(c1F)O 62a_100009817021_100102629194 [0,2,0,0,0,0|2,0,0]=4 4137 B13R1.16 C/C=C/CSc1cccc(c1F)O 62a_100102629194_100009817021 [0,2,0,0,0,0|2,0,0]=4 4138 B13R1.16 C/C=C/CSc1cccc(c1N)Br 62a_100010146558_100102629194 [0,2,0,0,0,0|2,0,0]=4 4139 B13R1.16 C/C=C/CSc1cccc(c1N)Br 62a_100102629194_100010146558 [0,2,0,0,0,0|2,0,0]=4 4140 B13R1.16 C/C=C/CSc1cccc(c1N)C 62a_100011834072_100102629194 [0,2,0,0,0,0|1,0,0]=3 4141 B13R1.16 C/C=C/CSc1cccc(c1N)C 62a_100102629194_100011834072 [0,2,0,0,0,0|1,0,0]=3 4142 B13R1.16 C/C=C/CSc1cccc(c1N)Cl 62a_100010190421_100102629194 [0,2,0,0,0,0|2,0,0]=4 4143 B13R1.16 C/C=C/CSc1cccc(c1N)Cl 62a_100102629194_100010190421 [0,2,0,0,0,0|2,0,0]=4 4144 B13R1.16 C/C=C/CSc1cccc(c1N)F 62a_100000042321_100102629194 [0,2,0,0,0,0|2,0,0]=4 4145 B13R1.16 C/C=C/CSc1cccc(c1N)F 62a_100102629194_100000042321 [0,2,0,0,0,0|2,0,0]=4 4146 B13R1.16 C/C=C/CSc1cccc(c1N)N 62a_100015191791_100102629194 [0,2,0,0,0,0|2,0,0]=4 4147 B13R1.16 C/C=C/CSc1cccc(c1N)O 62a_100102629194_100011934926 [0,2,0,0,0,0|2,0,0]=4 4148 B13R1.16 C/C=C/CSc1cccc(c1O)Br 62a_100010084509_100102629194 [0,2,0,0,0,0|1,0,0]=3 4149 B13R1.16 C/C=C/CSc1cccc(c1O)Br 62a_100102629194_100010084509 [0,2,0,0,0,0|1,0,0]=3 4150 B13R1.16 C/C=C/CSc1cccc(c1O)C 62a_100009817157_100102629194 [0,2,0,0,0,0|0,0,0]=2 4151 B13R1.16 C/C=C/CSc1cccc(c1O)C 62a_100102629194_100009817157 [0,2,0,0,0,0|0,0,0]=2 4152 B13R1.16 C/C=C/CSc1cccc(c1O)Cl 62a_100010202889_100102629194 [0,2,0,0,0,0|1,0,0]=3 4153 B13R1.16 C/C=C/CSc1cccc(c1O)Cl 62a_100102629194_100010202889 [0,2,0,0,0,0|1,0,0]=3 4154 B13R1.16 C/C=C/CSc1cccc(c1O)F 62a_100009813666_100102629194 [0,2,0,0,0,0|1,0,0]=3 4155 B13R1.16 C/C=C/CSc1cccc(c1O)F 62a_100102629194_100009813666 [0,2,0,0,0,0|1,0,0]=3 4156 B13R1.16 C/C=C/CSc1cccc(c1O)N 62a_100011934915_100102629194 [0,2,0,0,0,0|1,0,0]=3 4157 B13R1.16 C/C=C/CSc1cccc(c1O)N 62a_100102629194_100010084371 [0,2,0,0,0,0|1,0,0]=3 4158 B13R1.16 C/C=C/CSc1cccc(c1O)O 62a_100102629194_100009815950 [0,2,0,0,0,0|1,0,0]=3 4159 B13R1.16 C/C=C/CSc1cccn(c1=O)C 62a_100000687173_100102629194 [0,2,0,0,0,0|1,0,1]=4 4160 B13R1.16 C/C=C/CSc1cccn(c1=O)C 62a_100102629194_100000687173 [0,2,0,0,0,0|1,0,1]=4 4161 B13R1.16 C/C=C/CSc1ccnc(c1C)C 62a_100009846815_100102629194 [0,2,0,0,0,0|2,0,0]=4 4162 B13R1.16 C/C=C/CSc1ccnc(c1C)C 62a_100102629194_100009846815 [0,2,0,0,0,0|2,0,0]=4 4163 B13R1.16 C/C=C/CSc1ccnc(c1Cl)C 62a_100000698670_100102629194 [0,2,0,0,0,0|2,0,0]=4 4164 B13R1.16 C/C=C/CSc1ccnc(c1Cl)C 62a_100102629194_100000698670 [0,2,0,0,0,0|2,0,0]=4 4165 B13R1.16 C/C=C/CSc1ccnc(c1F)C 62a_100009849794_100102629194 [0,2,0,0,0,0|2,0,0]=4 4166 B13R1.16 C/C=C/CSc1ccnc(c1F)C 62a_100102629194_100009849794 [0,2,0,0,0,0|2,0,0]=4 4167 B13R1.16 C/C=C/CSc1ccnc(c1N)C 62a_100009885578_100102629194 [0,2,0,0,0,0|2,0,0]=4 4168 B13R1.16 C/C=C/CSc1ccnc(c1N)C 62a_100102629194_100009885578 [0,2,0,0,0,0|2,0,0]=4 4169 B13R1.16 C/C=C/CSc1ccnc(c1O)Cl 62a_100102629194_100010067911 [0,2,0,0,0,0|2,0,0]=4 4170 B13R1.16 C/C=C/CSc1cncc(c1C)C 62a_100009864703_100102629194 [0,2,0,0,0,0|2,0,0]=4 4171 B13R1.16 C/C=C/CSc1cncc(c1C)C 62a_100102629194_100009864703 [0,2,0,0,0,0|2,0,0]=4 4172 B13R1.16 C/C=C/CSc1cncc(c1N)C 62a_100009818025_100102629194 [0,2,0,0,0,0|2,0,0]=4 4173 B13R1.16 C/C=C/CSc1cncc(c1N)C 62a_100102629194_100009818025 [0,2,0,0,0,0|2,0,0]=4 4174 B13R1.16 C/C=C/CSc1cncc(c1O)N 62a_100000694263_100102629194 [0,2,0,0,0,0|2,0,0]=4 4175 B13R1.16 C/C=C/CSc1cncc(c1O)N 62a_100102629194_100000694263 [0,2,0,0,0,0|2,0,0]=4 4176 B13R1.16 C/C=C/CSc1nccc(c1C)C 62a_100009847204_100102629194 [0,2,0,0,0,0|2,0,0]=4 4177 B13R1.16 C/C=C/CSc1nccc(c1C)C 62a_100102629194_100009847204 [0,2,0,0,0,0|2,0,0]=4 4178 B13R1.16 C/C=C/CSc1nccc(c1F)C 62a_100009817629_100102629194 [0,2,0,0,0,0|2,0,0]=4 4179 B13R1.16 C/C=C/CSc1nccc(c1F)C 62a_100102629194_100009817629 [0,2,0,0,0,0|2,0,0]=4 4180 B13R1.16 C/C=C/CSc1nccc(c1N)C 62a_100000763560_100102629194 [0,2,0,0,0,0|2,0,0]=4 4181 B13R1.16 C/C=C/CSc1nccc(c1N)C 62a_100102629194_100000763560 [0,2,0,0,0,0|2,0,0]=4 4182 B13R1.16 C/C=C/CSc1nccc(c1O)C 62a_100102629194_100000696282 [0,2,0,0,0,0|1,0,0]=3 4183 B13R1.16 C/C=C/CSc1nccc(c1O)F 62a_100102629194_100009867227 [0,2,0,0,0,0|2,0,0]=4 4184 B13R1.16 C/C=C/CSc1nccc(c1O)N 62a_100102629194_100009844647 [0,2,0,0,0,0|2,0,0]=4 4185 B13R1.16 C=CCCNc1cccc(c1Br)C 34a_100000684715_100000754431 [0,2,0,0,0,0|1,0,0]=3 4186 B13R1.16 C=CCCNc1cccc(c1Br)Cl 34a_100000687072_100000754431 [0,2,0,0,0,0|2,0,0]=4 4187 B13R1.16 C=CCCNc1cccc(c1Br)F 34a_100011934729_100000754431 [0,2,0,0,0,0|2,0,0]=4 4188 B13R1.16 C=CCCNc1cccc(c1Br)O 34a_100012183704_100000754431 [0,2,0,0,0,0|2,0,0]=4 4189 B13R1.16 C=CCCNc1cccc(c1Br)O 7a_100012183704_100000754431 [0,2,0,0,0,0|2,0,0]=4 4190 B13R1.16 C=CCCNc1cccc(c1C)Br 34a_100000750434_100000754431 [0,2,0,0,0,0|2,0,0]=4 4191 B13R1.16 C=CCCNc1cccc(c1C)C 2230a_100000210026_100000754431 [0,2,0,0,0,0|1,0,0]=3 4192 B13R1.16 C=CCCNc1cccc(c1C)C 34a_100000210026_100000754431 [0,2,0,0,0,0|1,0,0]=3 4193 B13R1.16 C=CCCNc1cccc(c1C)C 7a_100000210026_100000754431 [0,2,0,0,0,0|1,0,0]=3 4194 B13R1.16 C=CCCNc1cccc(c1C)Cl 2230a_100000210441_100000754431 [0,2,0,0,0,0|2,0,0]=4 4195 B13R1.16 C=CCCNc1cccc(c1C)Cl 34a_100000210441_100000754431 [0,2,0,0,0,0|2,0,0]=4 4196 B13R1.16 C=CCCNc1cccc(c1C)Cl 7a_100000210441_100000754431 [0,2,0,0,0,0|2,0,0]=4 4197 B13R1.16 C=CCCNc1cccc(c1C)F 34a_100000745574_100000754431 [0,2,0,0,0,0|2,0,0]=4 4198 B13R1.16 C=CCCNc1cccc(c1C)F 7a_100000745574_100000754431 [0,2,0,0,0,0|2,0,0]=4 4199 B13R1.16 C=CCCNc1cccc(c1C)I 34a_100000761887_100000754431 [0,2,0,0,0,0|2,0,0]=4 4200 B13R1.16 C=CCCNc1cccc(c1C)O 34a_100011216573_100000754431 [0,2,0,0,0,0|2,0,0]=4 4201 B13R1.16 C=CCCNc1cccc(c1C)O 7a_100011216573_100000754431 [0,2,0,0,0,0|2,0,0]=4 4202 B13R1.16 C=CCCNc1cccc(c1Cl)Br 34a_100000687075_100000754431 [0,2,0,0,0,0|2,0,0]=4 4203 B13R1.16 C=CCCNc1cccc(c1Cl)C 34a_100000765562_100000754431 [0,2,0,0,0,0|1,0,0]=3 4204 B13R1.16 C=CCCNc1cccc(c1Cl)C 7a_100000765562_100000754431 [0,2,0,0,0,0|1,0,0]=3 4205 B13R1.16 C=CCCNc1cccc(c1Cl)Cl 34a_100000185733_100000754431 [0,2,0,0,0,0|2,0,0]=4 4206 B13R1.16 C=CCCNc1cccc(c1Cl)F 34a_100000692321_100000754431 [0,2,0,0,0,0|2,0,0]=4 4207 B13R1.16 C=CCCNc1cccc(c1Cl)O 34a_100012002038_100000754431 [0,2,0,0,0,0|2,0,0]=4 4208 B13R1.16 C=CCCNc1cccc(c1Cl)O 7a_100012002038_100000754431 [0,2,0,0,0,0|2,0,0]=4 4209 B13R1.16 C=CCCNc1cccc(c1F)Br 2230a_100011935091_100000754431 [0,2,0,0,0,0|2,0,0]=4 4210 B13R1.16 C=CCCNc1cccc(c1F)Br 34a_100011935091_100000754431 [0,2,0,0,0,0|2,0,0]=4 4211 B13R1.16 C=CCCNc1cccc(c1F)C 2230a_100000697159_100000754431 [0,2,0,0,0,0|1,0,0]=3 4212 B13R1.16 C=CCCNc1cccc(c1F)C 34a_100000697159_100000754431 [0,2,0,0,0,0|1,0,0]=3 4213 B13R1.16 C=CCCNc1cccc(c1F)C 7a_100000697159_100000754431 [0,2,0,0,0,0|1,0,0]=3 4214 B13R1.16 C=CCCNc1cccc(c1F)Cl 2230a_100000199060_100000754431 [0,2,0,0,0,0|2,0,0]=4 4215 B13R1.16 C=CCCNc1cccc(c1F)Cl 34a_100000199060_100000754431 [0,2,0,0,0,0|2,0,0]=4 4216 B13R1.16 C=CCCNc1cccc(c1F)F 34a_100000743855_100000754431 [0,2,0,0,0,0|2,0,0]=4 4217 B13R1.16 C=CCCNc1cccc(c1I)Br 34a_100020590159_100000754431 [0,2,0,0,0,0|2,0,0]=4 4218 B13R1.16 C=CCCNc1cccc(c1I)C 34a_100000761888_100000754431 [0,2,0,0,0,0|1,0,0]=3 4219 B13R1.16 C=CCCNc1cccc(c1I)Cl 34a_100000049713_100000754431 [0,2,0,0,0,0|2,0,0]=4 4220 B13R1.16 C=CCCNc1cccc(c1I)F 34a_100000690935_100000754431 [0,2,0,0,0,0|2,0,0]=4 4221 B13R1.16 C=CCCNc1cccc(c1O)Br 34a_100011934915_100000754431 [0,2,0,0,0,0|1,0,0]=3 4222 B13R1.16 C=CCCNc1cccc(c1O)C 34a_100000756359_100000754431 [0,2,0,0,0,0|0,0,0]=2 4223 B13R1.16 C=CCCNc1cccc(c1O)Cl 34a_100000754742_100000754431 [0,2,0,0,0,0|1,0,0]=3 4224 B13R1.16 C=CCCNc1cccc(c1O)F 34a_100011934987_100000754431 [0,2,0,0,0,0|1,0,0]=3 4225 B13R1.16 C=CCCNc1ccnc(c1Cl)C 27a_100015191253_100000698670 [0,2,0,0,0,0|2,0,0]=4 4226 B13R1.16 C=CCCNc1ccnc(c1F)C 27a_100015191253_100009849794 [0,2,0,0,0,0|2,0,0]=4 4227 B13R1.16 C=CCCOc1cccc(c1Br)Br 34a_100010187966_100000754431 [0,2,0,0,0,0|2,0,0]=4 4228 B13R1.16 C=CCCOc1cccc(c1Br)Br 7a_100010187966_100000754431 [0,2,0,0,0,0|2,0,0]=4 4229 B13R1.16 C=CCCOc1cccc(c1Br)C 34a_100000686692_100000754431 [0,2,0,0,0,0|1,0,0]=3 4230 B13R1.16 C=CCCOc1cccc(c1Br)C 7a_100000686692_100000754431 [0,2,0,0,0,0|1,0,0]=3 4231 B13R1.16 C=CCCOc1cccc(c1Br)Cl 34a_100012348804_100000754431 [0,2,0,0,0,0|2,0,0]=4 4232 B13R1.16 C=CCCOc1cccc(c1Br)Cl 7a_100012348804_100000754431 [0,2,0,0,0,0|2,0,0]=4 4233 B13R1.16 C=CCCOc1cccc(c1Br)F 34a_100009820682_100000754431 [0,2,0,0,0,0|2,0,0]=4 4234 B13R1.16 C=CCCOc1cccc(c1Br)F 7a_100009820682_100000754431 [0,2,0,0,0,0|2,0,0]=4 4235 B13R1.16 C=CCCOc1cccc(c1Br)I 34a_100010187914_100000754431 [0,2,0,0,0,0|2,0,0]=4 4236 B13R1.16 C=CCCOc1cccc(c1Br)I 7a_100010187914_100000754431 [0,2,0,0,0,0|2,0,0]=4 4237 B13R1.16 C=CCCOc1cccc(c1Br)N 34a_100012183704_100000754431 [0,2,0,0,0,0|2,0,0]=4 4238 B13R1.16 C=CCCOc1cccc(c1Br)N 7a_100012183704_100000754431 [0,2,0,0,0,0|2,0,0]=4 4239 B13R1.16 C=CCCOc1cccc(c1C)Br 34a_100012002258_100000754431 [0,2,0,0,0,0|2,0,0]=4 4240 B13R1.16 C=CCCOc1cccc(c1C)Br 7a_100012002258_100000754431 [0,2,0,0,0,0|2,0,0]=4 4241 B13R1.16 C=CCCOc1cccc(c1C)C 34a_100000185855_100000754431 [0,2,0,0,0,0|1,0,0]=3 4242 B13R1.16 C=CCCOc1cccc(c1C)C 7a_100000185855_100000754431 [0,2,0,0,0,0|1,0,0]=3 4243 B13R1.16 C=CCCOc1cccc(c1C)Cl 34a_100011265684_100000754431 [0,2,0,0,0,0|2,0,0]=4 4244 B13R1.16 C=CCCOc1cccc(c1C)Cl 7a_100011265684_100000754431 [0,2,0,0,0,0|2,0,0]=4 4245 B13R1.16 C=CCCOc1cccc(c1C)F 34a_100011217231_100000754431 [0,2,0,0,0,0|2,0,0]=4 4246 B13R1.16 C=CCCOc1cccc(c1C)F 7a_100011217231_100000754431 [0,2,0,0,0,0|2,0,0]=4 4247 B13R1.16 C=CCCOc1cccc(c1C)N 34a_100011216573_100000754431 [0,2,0,0,0,0|2,0,0]=4 4248 B13R1.16 C=CCCOc1cccc(c1C)N 7a_100011216573_100000754431 [0,2,0,0,0,0|2,0,0]=4 4249 B13R1.16 C=CCCOc1cccc(c1Cl)Br 34a_100010187913_100000754431 [0,2,0,0,0,0|2,0,0]=4 4250 B13R1.16 C=CCCOc1cccc(c1Cl)Br 7a_100010187913_100000754431 [0,2,0,0,0,0|2,0,0]=4 4251 B13R1.16 C=CCCOc1cccc(c1Cl)C 34a_100000695629_100000754431 [0,2,0,0,0,0|1,0,0]=3 4252 B13R1.16 C=CCCOc1cccc(c1Cl)C 7a_100000695629_100000754431 [0,2,0,0,0,0|1,0,0]=3 4253 B13R1.16 C=CCCOc1cccc(c1Cl)Cl 34a_100000211076_100000754431 [0,2,0,0,0,0|2,0,0]=4 4254 B13R1.16 C=CCCOc1cccc(c1Cl)Cl 7a_100000211076_100000754431 [0,2,0,0,0,0|2,0,0]=4 4255 B13R1.16 C=CCCOc1cccc(c1Cl)F 34a_100000087408_100000754431 [0,2,0,0,0,0|2,0,0]=4 4256 B13R1.16 C=CCCOc1cccc(c1Cl)F 7a_100000087408_100000754431 [0,2,0,0,0,0|2,0,0]=4 4257 B13R1.16 C=CCCOc1cccc(c1Cl)I 34a_100000049636_100000754431 [0,2,0,0,0,0|2,0,0]=4 4258 B13R1.16 C=CCCOc1cccc(c1Cl)I 7a_100000049636_100000754431 [0,2,0,0,0,0|2,0,0]=4 4259 B13R1.16 C=CCCOc1cccc(c1Cl)N 34a_100012002038_100000754431 [0,2,0,0,0,0|2,0,0]=4 4260 B13R1.16 C=CCCOc1cccc(c1Cl)N 7a_100012002038_100000754431 [0,2,0,0,0,0|2,0,0]=4 4261 B13R1.16 C=CCCOc1cccc(c1F)Br 34a_100009817021_100000754431 [0,2,0,0,0,0|2,0,0]=4 4262 B13R1.16 C=CCCOc1cccc(c1F)Br 7a_100009817021_100000754431 [0,2,0,0,0,0|2,0,0]=4 4263 B13R1.16 C=CCCOc1cccc(c1F)C 34a_100000751311_100000754431 [0,2,0,0,0,0|1,0,0]=3 4264 B13R1.16 C=CCCOc1cccc(c1F)C 7a_100000751311_100000754431 [0,2,0,0,0,0|1,0,0]=3 4265 B13R1.16 C=CCCOc1cccc(c1F)Cl 34a_100000687438_100000754431 [0,2,0,0,0,0|2,0,0]=4 4266 B13R1.16 C=CCCOc1cccc(c1F)Cl 7a_100000687438_100000754431 [0,2,0,0,0,0|2,0,0]=4 4267 B13R1.16 C=CCCOc1cccc(c1F)F 34a_100000751161_100000754431 [0,2,0,0,0,0|2,0,0]=4 4268 B13R1.16 C=CCCOc1cccc(c1F)F 7a_100000751161_100000754431 [0,2,0,0,0,0|2,0,0]=4 4269 B13R1.16 C=CCCOc1cccc(c1I)Br 34a_100010187912_100000754431 [0,2,0,0,0,0|2,0,0]=4 4270 B13R1.16 C=CCCOc1cccc(c1I)Br 7a_100010187912_100000754431 [0,2,0,0,0,0|2,0,0]=4 4271 B13R1.16 C=CCCOc1cccc(c1I)C 34a_100010083724_100000754431 [0,2,0,0,0,0|1,0,0]=3 4272 B13R1.16 C=CCCOc1cccc(c1I)C 7a_100010083724_100000754431 [0,2,0,0,0,0|1,0,0]=3 4273 B13R1.16 C=CCCOc1cccc(c1I)Cl 34a_100000050174_100000754431 [0,2,0,0,0,0|2,0,0]=4 4274 B13R1.16 C=CCCOc1cccc(c1I)Cl 7a_100000050174_100000754431 [0,2,0,0,0,0|2,0,0]=4 4275 B13R1.16 C=CCCOc1cccc(c1I)F 34a_100000690913_100000754431 [0,2,0,0,0,0|2,0,0]=4 4276 B13R1.16 C=CCCOc1cccc(c1I)F 7a_100000690913_100000754431 [0,2,0,0,0,0|2,0,0]=4 4277 B13R1.16 C=CCCOc1cccc(c1N)Br 34a_100011934926_100000754431 [0,2,0,0,0,0|2,0,0]=4 4278 B13R1.16 C=CCCOc1cccc(c1N)Br 7a_100011934926_100000754431 [0,2,0,0,0,0|2,0,0]=4 4279 B13R1.16 C=CCCOc1cccc(c1N)C 34a_100000743429_100000754431 [0,2,0,0,0,0|1,0,0]=3 4280 B13R1.16 C=CCCOc1cccc(c1N)C 7a_100000743429_100000754431 [0,2,0,0,0,0|1,0,0]=3 4281 B13R1.16 C=CCCOc1cccc(c1N)Cl 34a_100012022510_100000754431 [0,2,0,0,0,0|2,0,0]=4 4282 B13R1.16 C=CCCOc1cccc(c1N)Cl 7a_100012022510_100000754431 [0,2,0,0,0,0|2,0,0]=4 4283 B13R1.16 C=CCCOc1cccc(c1N)F 34a_100020591140_100000754431 [0,2,0,0,0,0|2,0,0]=4 4284 B13R1.16 C=CCCOc1cccc(c1N)F 7a_100020591140_100000754431 [0,2,0,0,0,0|2,0,0]=4 4285 B13R1.16 C=CCCOc1cccc(c1N)I 34a_200000049512_100000754431 [0,2,0,0,0,0|2,0,0]=4 4286 B13R1.16 C=CCCOc1cccc(c1N)I 7a_200000049512_100000754431 [0,2,0,0,0,0|2,0,0]=4 4287 B13R1.16 C=CCCOc1cccc(c1N)N 34a_100000033209_100000754431 [0,2,0,0,0,0|2,0,0]=4 4288 B13R1.16 C=CCCOc1cccn(c1=O)C 34a_100000117616_100000754431 [0,2,0,0,0,0|1,0,1]=4 4289 B13R1.16 C=CCCOc1cccn(c1=O)C 7a_100000117616_100000754431 [0,2,0,0,0,0|1,0,1]=4 4290 B13R1.16 C=CCCOc1nccc(c1Br)C 34a_100012000493_100000754431 [0,2,0,0,0,0|2,0,0]=4 4291 B13R1.16 C=CCCSc1cccc(c1Br)Br 62a_100000754431_100010175083 [0,2,0,0,0,0|2,0,0]=4 4292 B13R1.16 C=CCCSc1cccc(c1Br)Br 62a_100010175083_100000754431 [0,2,0,0,0,0|2,0,0]=4 4293 B13R1.16 C=CCCSc1cccc(c1Br)C 62a_100000754431_100012362457 [0,2,0,0,0,0|1,0,0]=3 4294 B13R1.16 C=CCCSc1cccc(c1Br)C 62a_100012362457_100000754431 [0,2,0,0,0,0|1,0,0]=3 4295 B13R1.16 C=CCCSc1cccc(c1Br)Cl 62a_100000754431_100014021842 [0,2,0,0,0,0|2,0,0]=4 4296 B13R1.16 C=CCCSc1cccc(c1Br)Cl 62a_100014021842_100000754431 [0,2,0,0,0,0|2,0,0]=4 4297 B13R1.16 C=CCCSc1cccc(c1Br)F 62a_100000754431_100010202630 [0,2,0,0,0,0|2,0,0]=4 4298 B13R1.16 C=CCCSc1cccc(c1Br)F 62a_100010202630_100000754431 [0,2,0,0,0,0|2,0,0]=4 4299 B13R1.16 C=CCCSc1cccc(c1Br)O 62a_100000754431_100010187914 [0,2,0,0,0,0|2,0,0]=4 4300 B13R1.16 C=CCCSc1cccc(c1Br)O 62a_100010187914_100000754431 [0,2,0,0,0,0|2,0,0]=4 4301 B13R1.16 C=CCCSc1cccc(c1C)Br 62a_100000754431_100012353703 [0,2,0,0,0,0|2,0,0]=4 4302 B13R1.16 C=CCCSc1cccc(c1C)Br 62a_100012353703_100000754431 [0,2,0,0,0,0|2,0,0]=4 4303 B13R1.16 C=CCCSc1cccc(c1C)C 62a_100000754431_100011214922 [0,2,0,0,0,0|1,0,0]=3 4304 B13R1.16 C=CCCSc1cccc(c1C)C 62a_100011214922_100000754431 [0,2,0,0,0,0|1,0,0]=3 4305 B13R1.16 C=CCCSc1cccc(c1C)Cl 62a_100000726075_100000754431 [0,2,0,0,0,0|2,0,0]=4 4306 B13R1.16 C=CCCSc1cccc(c1C)Cl 62a_100000754431_100000726075 [0,2,0,0,0,0|2,0,0]=4 4307 B13R1.16 C=CCCSc1cccc(c1C)F 62a_100000754431_100011216893 [0,2,0,0,0,0|2,0,0]=4 4308 B13R1.16 C=CCCSc1cccc(c1C)F 62a_100011216893_100000754431 [0,2,0,0,0,0|2,0,0]=4 4309 B13R1.16 C=CCCSc1cccc(c1C)N 62a_100000754431_100000761887 [0,2,0,0,0,0|2,0,0]=4 4310 B13R1.16 C=CCCSc1cccc(c1C)N 62a_100000761887_100000754431 [0,2,0,0,0,0|2,0,0]=4 4311 B13R1.16 C=CCCSc1cccc(c1C)O 62a_100000754431_100012002258 [0,2,0,0,0,0|2,0,0]=4 4312 B13R1.16 C=CCCSc1cccc(c1C)O 62a_100012002258_100000754431 [0,2,0,0,0,0|2,0,0]=4 4313 B13R1.16 C=CCCSc1cccc(c1Cl)Br 62a_100000754431_100010142854 [0,2,0,0,0,0|2,0,0]=4 4314 B13R1.16 C=CCCSc1cccc(c1Cl)Br 62a_100010142854_100000754431 [0,2,0,0,0,0|2,0,0]=4 4315 B13R1.16 C=CCCSc1cccc(c1Cl)C 62a_100000754431_200012352035 [0,2,0,0,0,0|1,0,0]=3 4316 B13R1.16 C=CCCSc1cccc(c1Cl)C 62a_200012352035_100000754431 [0,2,0,0,0,0|1,0,0]=3 4317 B13R1.16 C=CCCSc1cccc(c1Cl)Cl 62a_100000754431_100011215384 [0,2,0,0,0,0|2,0,0]=4 4318 B13R1.16 C=CCCSc1cccc(c1Cl)Cl 62a_100011215384_100000754431 [0,2,0,0,0,0|2,0,0]=4 4319 B13R1.16 C=CCCSc1cccc(c1Cl)F 62a_100000754431_200010234923 [0,2,0,0,0,0|2,0,0]=4 4320 B13R1.16 C=CCCSc1cccc(c1Cl)F 62a_200010234923_100000754431 [0,2,0,0,0,0|2,0,0]=4 4321 B13R1.16 C=CCCSc1cccc(c1Cl)O 62a_100000754431_100000049636 [0,2,0,0,0,0|2,0,0]=4 4322 B13R1.16 C=CCCSc1cccc(c1F)Br 62a_100000702267_100000754431 [0,2,0,0,0,0|2,0,0]=4 4323 B13R1.16 C=CCCSc1cccc(c1F)Br 62a_100000754431_100000702267 [0,2,0,0,0,0|2,0,0]=4 4324 B13R1.16 C=CCCSc1cccc(c1F)C 62a_100000717567_100000754431 [0,2,0,0,0,0|1,0,0]=3 4325 B13R1.16 C=CCCSc1cccc(c1F)C 62a_100000754431_100000717567 [0,2,0,0,0,0|1,0,0]=3 4326 B13R1.16 C=CCCSc1cccc(c1F)Cl 62a_100000754431_100011217346 [0,2,0,0,0,0|2,0,0]=4 4327 B13R1.16 C=CCCSc1cccc(c1F)Cl 62a_100011217346_100000754431 [0,2,0,0,0,0|2,0,0]=4 4328 B13R1.16 C=CCCSc1cccc(c1F)F 62a_100000694657_100000754431 [0,2,0,0,0,0|2,0,0]=4 4329 B13R1.16 C=CCCSc1cccc(c1F)F 62a_100000754431_100000694657 [0,2,0,0,0,0|2,0,0]=4 4330 B13R1.16 C=CCCSc1cccc(c1F)N 62a_100000754431_100011935091 [0,2,0,0,0,0|2,0,0]=4 4331 B13R1.16 C=CCCSc1cccc(c1F)N 62a_100011935091_100000754431 [0,2,0,0,0,0|2,0,0]=4 4332 B13R1.16 C=CCCSc1cccc(c1F)O 62a_100000754431_100009817021 [0,2,0,0,0,0|2,0,0]=4 4333 B13R1.16 C=CCCSc1cccc(c1F)O 62a_100009817021_100000754431 [0,2,0,0,0,0|2,0,0]=4 4334 B13R1.16 C=CCCSc1cccc(c1N)Br 62a_100000754431_100010146558 [0,2,0,0,0,0|2,0,0]=4 4335 B13R1.16 C=CCCSc1cccc(c1N)Br 62a_100010146558_100000754431 [0,2,0,0,0,0|2,0,0]=4 4336 B13R1.16 C=CCCSc1cccc(c1N)C 62a_100000754431_100011834072 [0,2,0,0,0,0|1,0,0]=3 4337 B13R1.16 C=CCCSc1cccc(c1N)C 62a_100011834072_100000754431 [0,2,0,0,0,0|1,0,0]=3 4338 B13R1.16 C=CCCSc1cccc(c1N)Cl 62a_100000754431_100010190421 [0,2,0,0,0,0|2,0,0]=4 4339 B13R1.16 C=CCCSc1cccc(c1N)Cl 62a_100010190421_100000754431 [0,2,0,0,0,0|2,0,0]=4 4340 B13R1.16 C=CCCSc1cccc(c1N)F 62a_100000042321_100000754431 [0,2,0,0,0,0|2,0,0]=4 4341 B13R1.16 C=CCCSc1cccc(c1N)F 62a_100000754431_100000042321 [0,2,0,0,0,0|2,0,0]=4 4342 B13R1.16 C=CCCSc1cccc(c1N)N 62a_100015191791_100000754431 [0,2,0,0,0,0|2,0,0]=4 4343 B13R1.16 C=CCCSc1cccc(c1N)O 62a_100000754431_100011934926 [0,2,0,0,0,0|2,0,0]=4 4344 B13R1.16 C=CCCSc1cccc(c1O)Br 62a_100000754431_100010084509 [0,2,0,0,0,0|1,0,0]=3 4345 B13R1.16 C=CCCSc1cccc(c1O)Br 62a_100010084509_100000754431 [0,2,0,0,0,0|1,0,0]=3 4346 B13R1.16 C=CCCSc1cccc(c1O)C 62a_100000754431_100009817157 [0,2,0,0,0,0|0,0,0]=2 4347 B13R1.16 C=CCCSc1cccc(c1O)C 62a_100009817157_100000754431 [0,2,0,0,0,0|0,0,0]=2 4348 B13R1.16 C=CCCSc1cccc(c1O)Cl 62a_100000754431_100010202889 [0,2,0,0,0,0|1,0,0]=3 4349 B13R1.16 C=CCCSc1cccc(c1O)Cl 62a_100010202889_100000754431 [0,2,0,0,0,0|1,0,0]=3 4350 B13R1.16 C=CCCSc1cccc(c1O)F 62a_100000754431_100009813666 [0,2,0,0,0,0|1,0,0]=3 4351 B13R1.16 C=CCCSc1cccc(c1O)F 62a_100009813666_100000754431 [0,2,0,0,0,0|1,0,0]=3 4352 B13R1.16 C=CCCSc1cccc(c1O)N 62a_100000754431_100010084371 [0,2,0,0,0,0|1,0,0]=3 4353 B13R1.16 C=CCCSc1cccc(c1O)N 62a_100011934915_100000754431 [0,2,0,0,0,0|1,0,0]=3 4354 B13R1.16 C=CCCSc1cccc(c1O)O 62a_100000754431_100009815950 [0,2,0,0,0,0|1,0,0]=3 4355 B13R1.16 C=CCCSc1cccn(c1=O)C 62a_100000687173_100000754431 [0,2,0,0,0,0|1,0,1]=4 4356 B13R1.16 C=CCCSc1cccn(c1=O)C 62a_100000754431_100000687173 [0,2,0,0,0,0|1,0,1]=4 4357 B13R1.16 C=CCCSc1ccnc(c1C)C 62a_100000754431_100009846815 [0,2,0,0,0,0|2,0,0]=4 4358 B13R1.16 C=CCCSc1ccnc(c1C)C 62a_100009846815_100000754431 [0,2,0,0,0,0|2,0,0]=4 4359 B13R1.16 C=CCCSc1ccnc(c1Cl)C 62a_100000698670_100000754431 [0,2,0,0,0,0|2,0,0]=4 4360 B13R1.16 C=CCCSc1ccnc(c1Cl)C 62a_100000754431_100000698670 [0,2,0,0,0,0|2,0,0]=4 4361 B13R1.16 C=CCCSc1ccnc(c1F)C 62a_100000754431_100009849794 [0,2,0,0,0,0|2,0,0]=4 4362 B13R1.16 C=CCCSc1ccnc(c1F)C 62a_100009849794_100000754431 [0,2,0,0,0,0|2,0,0]=4 4363 B13R1.16 C=CCCSc1ccnc(c1N)C 62a_100000754431_100009885578 [0,2,0,0,0,0|2,0,0]=4 4364 B13R1.16 C=CCCSc1ccnc(c1N)C 62a_100009885578_100000754431 [0,2,0,0,0,0|2,0,0]=4 4365 B13R1.16 C=CCCSc1ccnc(c1O)Cl 62a_100000754431_100010067911 [0,2,0,0,0,0|2,0,0]=4 4366 B13R1.16 C=CCCSc1cncc(c1C)C 62a_100000754431_100009864703 [0,2,0,0,0,0|2,0,0]=4 4367 B13R1.16 C=CCCSc1cncc(c1C)C 62a_100009864703_100000754431 [0,2,0,0,0,0|2,0,0]=4 4368 B13R1.16 C=CCCSc1cncc(c1N)C 62a_100000754431_100009818025 [0,2,0,0,0,0|2,0,0]=4 4369 B13R1.16 C=CCCSc1cncc(c1N)C 62a_100009818025_100000754431 [0,2,0,0,0,0|2,0,0]=4 4370 B13R1.16 C=CCCSc1cncc(c1O)N 62a_100000694263_100000754431 [0,2,0,0,0,0|2,0,0]=4 4371 B13R1.16 C=CCCSc1cncc(c1O)N 62a_100000754431_100000694263 [0,2,0,0,0,0|2,0,0]=4 4372 B13R1.16 C=CCCSc1nccc(c1C)C 62a_100000754431_100009847204 [0,2,0,0,0,0|2,0,0]=4 4373 B13R1.16 C=CCCSc1nccc(c1C)C 62a_100009847204_100000754431 [0,2,0,0,0,0|2,0,0]=4 4374 B13R1.16 C=CCCSc1nccc(c1F)C 62a_100000754431_100009817629 [0,2,0,0,0,0|2,0,0]=4 4375 B13R1.16 C=CCCSc1nccc(c1F)C 62a_100009817629_100000754431 [0,2,0,0,0,0|2,0,0]=4 4376 B13R1.16 C=CCCSc1nccc(c1N)C 62a_100000754431_100000763560 [0,2,0,0,0,0|2,0,0]=4 4377 B13R1.16 C=CCCSc1nccc(c1N)C 62a_100000763560_100000754431 [0,2,0,0,0,0|2,0,0]=4 4378 B13R1.16 C=CCCSc1nccc(c1O)C 62a_100000754431_100000696282 [0,2,0,0,0,0|1,0,0]=3 4379 B13R1.16 C=CCCSc1nccc(c1O)F 62a_100000754431_100009867227 [0,2,0,0,0,0|2,0,0]=4 4380 B13R1.16 C=CCCSc1nccc(c1O)N 62a_100000754431_100009844647 [0,2,0,0,0,0|2,0,0]=4 4381 B13R1.16 C=CCNCc1cccc(c1Br)Br 270004a_100020586998_100010240334 [0,2,0,0,0,0|2,0,0]=4 4382 B13R1.16 C=CCNCc1cccc(c1Br)C 2230a_100020586998_200012349612 [0,2,0,0,0,0|1,0,0]=3 4383 B13R1.16 C=CCNCc1cccc(c1Br)C 270004a_100020586998_100012186367 [0,2,0,0,0,0|1,0,0]=3 4384 B13R1.16 C=CCNCc1cccc(c1Br)Cl 2230a_100020586998_100010145525 [0,2,0,0,0,0|2,0,0]=4 4385 B13R1.16 C=CCNCc1cccc(c1Br)Cl 270004a_100020586998_100010232083 [0,2,0,0,0,0|2,0,0]=4 4386 B13R1.16 C=CCNCc1cccc(c1Br)F 2230a_100020586998_100012351116 [0,2,0,0,0,0|2,0,0]=4 4387 B13R1.16 C=CCNCc1cccc(c1Br)F 2230a_100020638964_100000210623 [0,2,0,0,0,0|2,0,0]=4 4388 B13R1.16 C=CCNCc1cccc(c1Br)F 270004a_100020586998_100011934749 [0,2,0,0,0,0|2,0,0]=4 4389 B13R1.16 C=CCNCc1cccc(c1Br)F 34a_100020638964_100015514636 [0,2,0,0,0,0|2,0,0]=4 4390 B13R1.16 C=CCNCc1cccc(c1Br)I 2230a_100020586998_100010254545 [0,2,0,0,0,0|2,0,0]=4 4391 B13R1.16 C=CCNCc1cccc(c1C)Br 2230a_100020586998_100000694682 [0,2,0,0,0,0|2,0,0]=4 4392 B13R1.16 C=CCNCc1cccc(c1C)Br 270004a_100020586998_100012179384 [0,2,0,0,0,0|2,0,0]=4 4393 B13R1.16 C=CCNCc1cccc(c1C)Br 34a_100000724210_100015514636 [0,2,0,0,0,0|2,0,0]=4 4394 B13R1.16 C=CCNCc1cccc(c1C)C 2230a_100011211637_100000210623 [0,2,0,0,0,0|1,0,0]=3 4395 B13R1.16 C=CCNCc1cccc(c1C)C 2230a_100020586998_100011515928 [0,2,0,0,0,0|1,0,0]=3 4396 B13R1.16 C=CCNCc1cccc(c1C)C 270004a_100020586998_100000229941 [0,2,0,0,0,0|1,0,0]=3 4397 B13R1.16 C=CCNCc1cccc(c1C)C 34a_100011211637_100015514636 [0,2,0,0,0,0|1,0,0]=3 4398 B13R1.16 C=CCNCc1cccc(c1C)Cl 2230a_100020586998_100012186920 [0,2,0,0,0,0|2,0,0]=4 4399 B13R1.16 C=CCNCc1cccc(c1C)Cl 2230a_100020639605_100000210623 [0,2,0,0,0,0|2,0,0]=4 4400 B13R1.16 C=CCNCc1cccc(c1C)Cl 270004a_100020586998_100012002129 [0,2,0,0,0,0|2,0,0]=4 4401 B13R1.16 C=CCNCc1cccc(c1C)Cl 34a_100020639605_100015514636 [0,2,0,0,0,0|2,0,0]=4 4402 B13R1.16 C=CCNCc1cccc(c1C)F 2230a_100020586998_100009813626 [0,2,0,0,0,0|2,0,0]=4 4403 B13R1.16 C=CCNCc1cccc(c1C)F 2230a_100132306986_100000210623 [0,2,0,0,0,0|2,0,0]=4 4404 B13R1.16 C=CCNCc1cccc(c1C)F 270004a_100020586998_100000037668 [0,2,0,0,0,0|2,0,0]=4 4405 B13R1.16 C=CCNCc1cccc(c1C)F 34a_100132306986_100015514636 [0,2,0,0,0,0|2,0,0]=4 4406 B13R1.16 C=CCNCc1cccc(c1C)I 2230a_100020586998_100010150147 [0,2,0,0,0,0|2,0,0]=4 4407 B13R1.16 C=CCNCc1cccc(c1C)O 270004a_100020586998_100009868165 [0,2,0,0,0,0|2,0,0]=4 4408 B13R1.16 C=CCNCc1cccc(c1Cl)Br 2230a_100020586998_100012349491 [0,2,0,0,0,0|2,0,0]=4 4409 B13R1.16 C=CCNCc1cccc(c1Cl)Br 270004a_100020586998_100012362481 [0,2,0,0,0,0|2,0,0]=4 4410 B13R1.16 C=CCNCc1cccc(c1Cl)C 2230a_100025705714_100000210623 [0,2,0,0,0,0|1,0,0]=3 4411 B13R1.16 C=CCNCc1cccc(c1Cl)C 270004a_100020586998_100012017286 [0,2,0,0,0,0|1,0,0]=3 4412 B13R1.16 C=CCNCc1cccc(c1Cl)C 34a_100025705714_100015514636 [0,2,0,0,0,0|1,0,0]=3 4413 B13R1.16 C=CCNCc1cccc(c1Cl)Cl 2230a_100011211633_100000210623 [0,2,0,0,0,0|2,0,0]=4 4414 B13R1.16 C=CCNCc1cccc(c1Cl)Cl 2230a_100020586998_100000723366 [0,2,0,0,0,0|2,0,0]=4 4415 B13R1.16 C=CCNCc1cccc(c1Cl)Cl 270004a_100020586998_100000210504 [0,2,0,0,0,0|2,0,0]=4 4416 B13R1.16 C=CCNCc1cccc(c1Cl)Cl 34a_100011211633_100015514636 [0,2,0,0,0,0|2,0,0]=4 4417 B13R1.16 C=CCNCc1cccc(c1Cl)F 2230a_100012001614_100000210623 [0,2,0,0,0,0|2,0,0]=4 4418 B13R1.16 C=CCNCc1cccc(c1Cl)F 2230a_100020586998_100000696688 [0,2,0,0,0,0|2,0,0]=4 4419 B13R1.16 C=CCNCc1cccc(c1Cl)F 270004a_100020586998_100011998484 [0,2,0,0,0,0|2,0,0]=4 4420 B13R1.16 C=CCNCc1cccc(c1Cl)F 34a_100012001614_100015514636 [0,2,0,0,0,0|2,0,0]=4 4421 B13R1.16 C=CCNCc1cccc(c1Cl)O 270004a_100020586998_100000050521 [0,2,0,0,0,0|2,0,0]=4 4422 B13R1.16 C=CCNCc1cccc(c1F)Br 2230a_100015189953_100000210623 [0,2,0,0,0,0|2,0,0]=4 4423 B13R1.16 C=CCNCc1cccc(c1F)Br 2230a_100020586998_100012356506 [0,2,0,0,0,0|2,0,0]=4 4424 B13R1.16 C=CCNCc1cccc(c1F)Br 270004a_100020586998_100011361543 [0,2,0,0,0,0|2,0,0]=4 4425 B13R1.16 C=CCNCc1cccc(c1F)Br 34a_100015189953_100015514636 [0,2,0,0,0,0|2,0,0]=4 4426 B13R1.16 C=CCNCc1cccc(c1F)C 2230a_100012002060_100000210623 [0,2,0,0,0,0|1,0,0]=3 4427 B13R1.16 C=CCNCc1cccc(c1F)C 2230a_100020586998_100011216058 [0,2,0,0,0,0|1,0,0]=3 4428 B13R1.16 C=CCNCc1cccc(c1F)C 270004a_100020586998_100011219516 [0,2,0,0,0,0|1,0,0]=3 4429 B13R1.16 C=CCNCc1cccc(c1F)C 34a_100012002060_100015514636 [0,2,0,0,0,0|1,0,0]=3 4430 B13R1.16 C=CCNCc1cccc(c1F)Cl 2230a_100000764326_100000210623 [0,2,0,0,0,0|2,0,0]=4 4431 B13R1.16 C=CCNCc1cccc(c1F)Cl 2230a_100020586998_100000716733 [0,2,0,0,0,0|2,0,0]=4 4432 B13R1.16 C=CCNCc1cccc(c1F)Cl 270004a_100020586998_100000766533 [0,2,0,0,0,0|2,0,0]=4 4433 B13R1.16 C=CCNCc1cccc(c1F)Cl 34a_100000764326_100015514636 [0,2,0,0,0,0|2,0,0]=4 4434 B13R1.16 C=CCNCc1cccc(c1F)F 2230a_100011199105_100000210623 [0,2,0,0,0,0|2,0,0]=4 4435 B13R1.16 C=CCNCc1cccc(c1F)F 2230a_100020586998_100000217499 [0,2,0,0,0,0|2,0,0]=4 4436 B13R1.16 C=CCNCc1cccc(c1F)F 270004a_100020586998_100000753312 [0,2,0,0,0,0|2,0,0]=4 4437 B13R1.16 C=CCNCc1cccc(c1F)F 34a_100011199105_100015514636 [0,2,0,0,0,0|2,0,0]=4 4438 B13R1.16 C=CCNCc1cccc(c1F)I 270004a_100020586998_100010202174 [0,2,0,0,0,0|2,0,0]=4 4439 B13R1.16 C=CCNCc1cccc(c1F)O 34a_100025773512_100015514636 [0,2,0,0,0,0|2,0,0]=4 4440 B13R1.16 C=CCNCc1cccc(c1I)F 2230a_100020586998_100010149603 [0,2,0,0,0,0|2,0,0]=4 4441 B13R1.16 C=CCNCc1cccc(c1I)F 270004a_100020586998_100010186293 [0,2,0,0,0,0|2,0,0]=4 4442 B13R1.16 C=CCNCc1cccc(c1O)C 34a_100020639391_100015514636 [0,2,0,0,0,0|0,0,0]=2 4443 B13R1.16 C=CCNCc1cccn(c1=O)C 270004a_100020586998_100010354164 [0,2,0,0,0,0|1,0,1]=4 4444 B13R1.16 C=CCOCc1cccc(c1Br)C 34a_100011659289_100015514636 [0,2,0,0,0,0|1,0,0]=3 4445 B13R1.16 C=CCOCc1cccc(c1Br)C 34a_200000210373_200012349612 [0,2,0,0,0,0|1,0,0]=3 4446 B13R1.16 C=CCOCc1cccc(c1Br)C 7a_100011659289_100015514636 [0,2,0,0,0,0|1,0,0]=3 4447 B13R1.16 C=CCOCc1cccc(c1Br)Cl 34a_100010168166_100015514636 [0,2,0,0,0,0|2,0,0]=4 4448 B13R1.16 C=CCOCc1cccc(c1Br)Cl 34a_200000210373_100010145525 [0,2,0,0,0,0|2,0,0]=4 4449 B13R1.16 C=CCOCc1cccc(c1Br)Cl 7a_100010168166_100015514636 [0,2,0,0,0,0|2,0,0]=4 4450 B13R1.16 C=CCOCc1cccc(c1Br)F 34a_100012351117_100015514636 [0,2,0,0,0,0|2,0,0]=4 4451 B13R1.16 C=CCOCc1cccc(c1Br)F 34a_200000210373_100012351116 [0,2,0,0,0,0|2,0,0]=4 4452 B13R1.16 C=CCOCc1cccc(c1Br)F 7a_100012351117_100015514636 [0,2,0,0,0,0|2,0,0]=4 4453 B13R1.16 C=CCOCc1cccc(c1Br)I 34a_100010240205_100015514636 [0,2,0,0,0,0|2,0,0]=4 4454 B13R1.16 C=CCOCc1cccc(c1Br)I 34a_200000210373_100010254545 [0,2,0,0,0,0|2,0,0]=4 4455 B13R1.16 C=CCOCc1cccc(c1Br)I 7a_100010240205_100015514636 [0,2,0,0,0,0|2,0,0]=4 4456 B13R1.16 C=CCOCc1cccc(c1C)Br 34a_100000694458_100015514636 [0,2,0,0,0,0|2,0,0]=4 4457 B13R1.16 C=CCOCc1cccc(c1C)Br 34a_200000210373_100000694682 [0,2,0,0,0,0|2,0,0]=4 4458 B13R1.16 C=CCOCc1cccc(c1C)Br 7a_100000694458_100015514636 [0,2,0,0,0,0|2,0,0]=4 4459 B13R1.16 C=CCOCc1cccc(c1C)C 34a_100011219135_100015514636 [0,2,0,0,0,0|1,0,0]=3 4460 B13R1.16 C=CCOCc1cccc(c1C)C 34a_200000210373_100011273979 [0,2,0,0,0,0|1,0,0]=3 4461 B13R1.16 C=CCOCc1cccc(c1C)C 7a_100011219135_100015514636 [0,2,0,0,0,0|1,0,0]=3 4462 B13R1.16 C=CCOCc1cccc(c1C)Cl 34a_100012000165_100015514636 [0,2,0,0,0,0|2,0,0]=4 4463 B13R1.16 C=CCOCc1cccc(c1C)Cl 34a_200000210373_100012186920 [0,2,0,0,0,0|2,0,0]=4 4464 B13R1.16 C=CCOCc1cccc(c1C)Cl 7a_100012000165_100015514636 [0,2,0,0,0,0|2,0,0]=4 4465 B13R1.16 C=CCOCc1cccc(c1C)F 34a_100000042775_100015514636 [0,2,0,0,0,0|2,0,0]=4 4466 B13R1.16 C=CCOCc1cccc(c1C)F 34a_200000210373_100009813626 [0,2,0,0,0,0|2,0,0]=4 4467 B13R1.16 C=CCOCc1cccc(c1C)F 7a_100000042775_100015514636 [0,2,0,0,0,0|2,0,0]=4 4468 B13R1.16 C=CCOCc1cccc(c1C)I 34a_100010150139_100015514636 [0,2,0,0,0,0|2,0,0]=4 4469 B13R1.16 C=CCOCc1cccc(c1C)I 34a_200000210373_100010150147 [0,2,0,0,0,0|2,0,0]=4 4470 B13R1.16 C=CCOCc1cccc(c1C)I 7a_100010150139_100015514636 [0,2,0,0,0,0|2,0,0]=4 4471 B13R1.16 C=CCOCc1cccc(c1C)N 34a_102495339961_100015514636 [0,2,0,0,0,0|2,0,0]=4 4472 B13R1.16 C=CCOCc1cccc(c1C)N 7a_102495339961_100015514636 [0,2,0,0,0,0|2,0,0]=4 4473 B13R1.16 C=CCOCc1cccc(c1Cl)Br 34a_100012351182_100015514636 [0,2,0,0,0,0|2,0,0]=4 4474 B13R1.16 C=CCOCc1cccc(c1Cl)Br 34a_200000210373_100012349491 [0,2,0,0,0,0|2,0,0]=4 4475 B13R1.16 C=CCOCc1cccc(c1Cl)Br 7a_100012351182_100015514636 [0,2,0,0,0,0|2,0,0]=4 4476 B13R1.16 C=CCOCc1cccc(c1Cl)C 34a_100000710031_100015514636 [0,2,0,0,0,0|1,0,0]=3 4477 B13R1.16 C=CCOCc1cccc(c1Cl)C 7a_100000710031_100015514636 [0,2,0,0,0,0|1,0,0]=3 4478 B13R1.16 C=CCOCc1cccc(c1Cl)Cl 34a_100000720469_100015514636 [0,2,0,0,0,0|2,0,0]=4 4479 B13R1.16 C=CCOCc1cccc(c1Cl)Cl 34a_200000210373_100000723366 [0,2,0,0,0,0|2,0,0]=4 4480 B13R1.16 C=CCOCc1cccc(c1Cl)Cl 7a_100000720469_100015514636 [0,2,0,0,0,0|2,0,0]=4 4481 B13R1.16 C=CCOCc1cccc(c1Cl)F 34a_100000696319_100015514636 [0,2,0,0,0,0|2,0,0]=4 4482 B13R1.16 C=CCOCc1cccc(c1Cl)F 34a_200000210373_100000696688 [0,2,0,0,0,0|2,0,0]=4 4483 B13R1.16 C=CCOCc1cccc(c1Cl)F 7a_100000696319_100015514636 [0,2,0,0,0,0|2,0,0]=4 4484 B13R1.16 C=CCOCc1cccc(c1F)Br 34a_100011935076_100015514636 [0,2,0,0,0,0|2,0,0]=4 4485 B13R1.16 C=CCOCc1cccc(c1F)Br 34a_200000210373_100012356506 [0,2,0,0,0,0|2,0,0]=4 4486 B13R1.16 C=CCOCc1cccc(c1F)Br 7a_100011935076_100015514636 [0,2,0,0,0,0|2,0,0]=4 4487 B13R1.16 C=CCOCc1cccc(c1F)C 34a_200000210373_100011216058 [0,2,0,0,0,0|1,0,0]=3 4488 B13R1.16 C=CCOCc1cccc(c1F)C 34a_200011219517_100015514636 [0,2,0,0,0,0|1,0,0]=3 4489 B13R1.16 C=CCOCc1cccc(c1F)C 7a_200011219517_100015514636 [0,2,0,0,0,0|1,0,0]=3 4490 B13R1.16 C=CCOCc1cccc(c1F)Cl 34a_100011216988_100015514636 [0,2,0,0,0,0|2,0,0]=4 4491 B13R1.16 C=CCOCc1cccc(c1F)Cl 34a_200000210373_100000716733 [0,2,0,0,0,0|2,0,0]=4 4492 B13R1.16 C=CCOCc1cccc(c1F)Cl 7a_100011216988_100015514636 [0,2,0,0,0,0|2,0,0]=4 4493 B13R1.16 C=CCOCc1cccc(c1F)F 34a_100011218644_100015514636 [0,2,0,0,0,0|2,0,0]=4 4494 B13R1.16 C=CCOCc1cccc(c1F)F 34a_200000210373_100000217499 [0,2,0,0,0,0|2,0,0]=4 4495 B13R1.16 C=CCOCc1cccc(c1F)F 7a_100011218644_100015514636 [0,2,0,0,0,0|2,0,0]=4 4496 B13R1.16 C=CCOCc1cccc(c1F)I 34a_200010235739_100015514636 [0,2,0,0,0,0|2,0,0]=4 4497 B13R1.16 C=CCOCc1cccc(c1F)I 7a_200010235739_100015514636 [0,2,0,0,0,0|2,0,0]=4 4498 B13R1.16 C=CCOCc1cccc(c1F)N 34a_100012023829_100015514636 [0,2,0,0,0,0|2,0,0]=4 4499 B13R1.16 C=CCOCc1cccc(c1I)Br 34a_100010146604_100015514636 [0,2,0,0,0,0|2,0,0]=4 4500 B13R1.16 C=CCOCc1cccc(c1I)Br 7a_100010146604_100015514636 [0,2,0,0,0,0|2,0,0]=4 4501 B13R1.16 C=CCOCc1cccc(c1I)C 34a_100012349780_100015514636 [0,2,0,0,0,0|1,0,0]=3 4502 B13R1.16 C=CCOCc1cccc(c1I)C 7a_100012349780_100015514636 [0,2,0,0,0,0|1,0,0]=3 4503 B13R1.16 C=CCOCc1cccc(c1I)F 34a_100000692438_100015514636 [0,2,0,0,0,0|2,0,0]=4 4504 B13R1.16 C=CCOCc1cccc(c1I)F 34a_200000210373_100010149603 [0,2,0,0,0,0|2,0,0]=4 4505 B13R1.16 C=CCOCc1cccc(c1I)F 7a_100000692438_100015514636 [0,2,0,0,0,0|2,0,0]=4 4506 B13R1.16 C=CCOCc1cccc(c1N)Br 34a_100012349457_100015514636 [0,2,0,0,0,0|2,0,0]=4 4507 B13R1.16 C=CCOCc1cccc(c1N)C 34a_100011215590_100015514636 [0,2,0,0,0,0|1,0,0]=3 4508 B13R1.16 C=CCOCc1cccc(c1N)Cl 34a_100012182729_100015514636 [0,2,0,0,0,0|2,0,0]=4 4509 B13R1.16 C=CCOCc1cccc(c1N)F 34a_100000692437_100015514636 [0,2,0,0,0,0|2,0,0]=4 4510 B13R1.16 C=CCSCc1cccc(c1Br)C 62a_100000210623_200012349612 [0,2,0,0,0,0|1,0,0]=3 4511 B13R1.16 C=CCSCc1cccc(c1Br)C 62a_200012349612_100000210623 [0,2,0,0,0,0|1,0,0]=3 4512 B13R1.16 C=CCSCc1cccc(c1Br)Cl 62a_100000210623_100010145525 [0,2,0,0,0,0|2,0,0]=4 4513 B13R1.16 C=CCSCc1cccc(c1Br)Cl 62a_100010145525_100000210623 [0,2,0,0,0,0|2,0,0]=4 4514 B13R1.16 C=CCSCc1cccc(c1Br)F 62a_100000210623_100012351116 [0,2,0,0,0,0|2,0,0]=4 4515 B13R1.16 C=CCSCc1cccc(c1Br)F 62a_100012351116_100000210623 [0,2,0,0,0,0|2,0,0]=4 4516 B13R1.16 C=CCSCc1cccc(c1Br)I 62a_100000210623_100010254545 [0,2,0,0,0,0|2,0,0]=4 4517 B13R1.16 C=CCSCc1cccc(c1Br)I 62a_100010254545_100000210623 [0,2,0,0,0,0|2,0,0]=4 4518 B13R1.16 C=CCSCc1cccc(c1C)Br 62a_100000210623_100000694682 [0,2,0,0,0,0|2,0,0]=4 4519 B13R1.16 C=CCSCc1cccc(c1C)Br 62a_100000694682_100000210623 [0,2,0,0,0,0|2,0,0]=4 4520 B13R1.16 C=CCSCc1cccc(c1C)C 62a_100000210623_100011515928 [0,2,0,0,0,0|1,0,0]=3 4521 B13R1.16 C=CCSCc1cccc(c1C)C 62a_100011515928_100000210623 [0,2,0,0,0,0|1,0,0]=3 4522 B13R1.16 C=CCSCc1cccc(c1C)Cl 62a_100000210623_100012186920 [0,2,0,0,0,0|2,0,0]=4 4523 B13R1.16 C=CCSCc1cccc(c1C)Cl 62a_100012186920_100000210623 [0,2,0,0,0,0|2,0,0]=4 4524 B13R1.16 C=CCSCc1cccc(c1C)F 62a_100000210623_100009813626 [0,2,0,0,0,0|2,0,0]=4 4525 B13R1.16 C=CCSCc1cccc(c1C)F 62a_100009813626_100000210623 [0,2,0,0,0,0|2,0,0]=4 4526 B13R1.16 C=CCSCc1cccc(c1C)I 62a_100000210623_100010150147 [0,2,0,0,0,0|2,0,0]=4 4527 B13R1.16 C=CCSCc1cccc(c1C)I 62a_100010150147_100000210623 [0,2,0,0,0,0|2,0,0]=4 4528 B13R1.16 C=CCSCc1cccc(c1Cl)Br 62a_100000210623_100012349491 [0,2,0,0,0,0|2,0,0]=4 4529 B13R1.16 C=CCSCc1cccc(c1Cl)Br 62a_100012349491_100000210623 [0,2,0,0,0,0|2,0,0]=4 4530 B13R1.16 C=CCSCc1cccc(c1Cl)Cl 62a_100000210623_100000723366 [0,2,0,0,0,0|2,0,0]=4 4531 B13R1.16 C=CCSCc1cccc(c1Cl)Cl 62a_100000720918_100000210623 [0,2,0,0,0,0|2,0,0]=4 4532 B13R1.16 C=CCSCc1cccc(c1Cl)F 62a_100000210623_100000696688 [0,2,0,0,0,0|2,0,0]=4 4533 B13R1.16 C=CCSCc1cccc(c1Cl)F 62a_100000696688_100000210623 [0,2,0,0,0,0|2,0,0]=4 4534 B13R1.16 C=CCSCc1cccc(c1F)Br 62a_100000210623_100012356506 [0,2,0,0,0,0|2,0,0]=4 4535 B13R1.16 C=CCSCc1cccc(c1F)Br 62a_100012356506_100000210623 [0,2,0,0,0,0|2,0,0]=4 4536 B13R1.16 C=CCSCc1cccc(c1F)C 62a_100000210623_100011216058 [0,2,0,0,0,0|1,0,0]=3 4537 B13R1.16 C=CCSCc1cccc(c1F)C 62a_100011216058_100000210623 [0,2,0,0,0,0|1,0,0]=3 4538 B13R1.16 C=CCSCc1cccc(c1F)Cl 62a_100000210623_100000716733 [0,2,0,0,0,0|2,0,0]=4 4539 B13R1.16 C=CCSCc1cccc(c1F)Cl 62a_100000716733_100000210623 [0,2,0,0,0,0|2,0,0]=4 4540 B13R1.16 C=CCSCc1cccc(c1F)F 62a_100000210623_100000217499 [0,2,0,0,0,0|2,0,0]=4 4541 B13R1.16 C=CCSCc1cccc(c1F)F 62a_100000217499_100000210623 [0,2,0,0,0,0|2,0,0]=4 4542 B13R1.16 C=CCSCc1cccc(c1I)F 62a_100000210623_100010149603 [0,2,0,0,0,0|2,0,0]=4 4543 B13R1.16 C=CCSCc1cccc(c1I)F 62a_100010149603_100000210623 [0,2,0,0,0,0|2,0,0]=4 4544 B13R1.16 CC#CCNc1cccc(c1O)C 34a_100000756359_100000748600 [0,2,0,0,0,0|0,0,2]=4 4545 B13R1.16 CC#CCSc1cccc(c1O)C 62a_100000748600_100009817157 [0,2,0,0,0,0|0,0,2]=4 4546 B13R1.16 CC#CCSc1cccc(c1O)C 62a_100009817157_100000748600 [0,2,0,0,0,0|0,0,2]=4 4547 B13R1.16 CC=CCNc1cccc(c1Br)C 34a_100000684715_100000070051 [0,2,0,0,0,0|1,0,0]=3 4548 B13R1.16 CC=CCNc1cccc(c1Br)Cl 34a_100000687072_100000070051 [0,2,0,0,0,0|2,0,0]=4 4549 B13R1.16 CC=CCNc1cccc(c1Br)F 34a_100011934729_100000070051 [0,2,0,0,0,0|2,0,0]=4 4550 B13R1.16 CC=CCNc1cccc(c1Br)O 34a_100012183704_100000070051 [0,2,0,0,0,0|2,0,0]=4 4551 B13R1.16 CC=CCNc1cccc(c1Br)O 7a_100012183704_100000070051 [0,2,0,0,0,0|2,0,0]=4 4552 B13R1.16 CC=CCNc1cccc(c1C)Br 34a_100000750434_100000070051 [0,2,0,0,0,0|2,0,0]=4 4553 B13R1.16 CC=CCNc1cccc(c1C)C 2230a_100000210026_100000070051 [0,2,0,0,0,0|1,0,0]=3 4554 B13R1.16 CC=CCNc1cccc(c1C)C 34a_100000210026_100000070051 [0,2,0,0,0,0|1,0,0]=3 4555 B13R1.16 CC=CCNc1cccc(c1C)C 7a_100000210026_100000070051 [0,2,0,0,0,0|1,0,0]=3 4556 B13R1.16 CC=CCNc1cccc(c1C)Cl 2230a_100000210441_100000070051 [0,2,0,0,0,0|2,0,0]=4 4557 B13R1.16 CC=CCNc1cccc(c1C)Cl 34a_100000210441_100000070051 [0,2,0,0,0,0|2,0,0]=4 4558 B13R1.16 CC=CCNc1cccc(c1C)Cl 7a_100000210441_100000070051 [0,2,0,0,0,0|2,0,0]=4 4559 B13R1.16 CC=CCNc1cccc(c1C)F 34a_100000745574_100000070051 [0,2,0,0,0,0|2,0,0]=4 4560 B13R1.16 CC=CCNc1cccc(c1C)F 7a_100000745574_100000070051 [0,2,0,0,0,0|2,0,0]=4 4561 B13R1.16 CC=CCNc1cccc(c1C)I 34a_100000761887_100000070051 [0,2,0,0,0,0|2,0,0]=4 4562 B13R1.16 CC=CCNc1cccc(c1C)O 34a_100011216573_100000070051 [0,2,0,0,0,0|2,0,0]=4 4563 B13R1.16 CC=CCNc1cccc(c1C)O 7a_100011216573_100000070051 [0,2,0,0,0,0|2,0,0]=4 4564 B13R1.16 CC=CCNc1cccc(c1Cl)Br 34a_100000687075_100000070051 [0,2,0,0,0,0|2,0,0]=4 4565 B13R1.16 CC=CCNc1cccc(c1Cl)C 34a_100000765562_100000070051 [0,2,0,0,0,0|1,0,0]=3 4566 B13R1.16 CC=CCNc1cccc(c1Cl)C 7a_100000765562_100000070051 [0,2,0,0,0,0|1,0,0]=3 4567 B13R1.16 CC=CCNc1cccc(c1Cl)Cl 34a_100000185733_100000070051 [0,2,0,0,0,0|2,0,0]=4 4568 B13R1.16 CC=CCNc1cccc(c1Cl)F 34a_100000692321_100000070051 [0,2,0,0,0,0|2,0,0]=4 4569 B13R1.16 CC=CCNc1cccc(c1Cl)O 34a_100012002038_100000070051 [0,2,0,0,0,0|2,0,0]=4 4570 B13R1.16 CC=CCNc1cccc(c1Cl)O 7a_100012002038_100000070051 [0,2,0,0,0,0|2,0,0]=4 4571 B13R1.16 CC=CCNc1cccc(c1F)Br 2230a_100011935091_100000070051 [0,2,0,0,0,0|2,0,0]=4 4572 B13R1.16 CC=CCNc1cccc(c1F)Br 34a_100011935091_100000070051 [0,2,0,0,0,0|2,0,0]=4 4573 B13R1.16 CC=CCNc1cccc(c1F)C 2230a_100000697159_100000070051 [0,2,0,0,0,0|1,0,0]=3 4574 B13R1.16 CC=CCNc1cccc(c1F)C 34a_100000697159_100000070051 [0,2,0,0,0,0|1,0,0]=3 4575 B13R1.16 CC=CCNc1cccc(c1F)C 7a_100000697159_100000070051 [0,2,0,0,0,0|1,0,0]=3 4576 B13R1.16 CC=CCNc1cccc(c1F)Cl 2230a_100000199060_100000070051 [0,2,0,0,0,0|2,0,0]=4 4577 B13R1.16 CC=CCNc1cccc(c1F)Cl 34a_100000199060_100000070051 [0,2,0,0,0,0|2,0,0]=4 4578 B13R1.16 CC=CCNc1cccc(c1F)F 34a_100000743855_100000070051 [0,2,0,0,0,0|2,0,0]=4 4579 B13R1.16 CC=CCNc1cccc(c1I)Br 34a_100020590159_100000070051 [0,2,0,0,0,0|2,0,0]=4 4580 B13R1.16 CC=CCNc1cccc(c1I)C 34a_100000761888_100000070051 [0,2,0,0,0,0|1,0,0]=3 4581 B13R1.16 CC=CCNc1cccc(c1I)Cl 34a_100000049713_100000070051 [0,2,0,0,0,0|2,0,0]=4 4582 B13R1.16 CC=CCNc1cccc(c1I)F 34a_100000690935_100000070051 [0,2,0,0,0,0|2,0,0]=4 4583 B13R1.16 CC=CCNc1cccc(c1O)Br 34a_100011934915_100000070051 [0,2,0,0,0,0|1,0,0]=3 4584 B13R1.16 CC=CCNc1cccc(c1O)C 34a_100000756359_100000070051 [0,2,0,0,0,0|0,0,0]=2 4585 B13R1.16 CC=CCNc1cccc(c1O)Cl 34a_100000754742_100000070051 [0,2,0,0,0,0|1,0,0]=3 4586 B13R1.16 CC=CCNc1cccc(c1O)F 34a_100011934987_100000070051 [0,2,0,0,0,0|1,0,0]=3 4587 B13R1.16 CC=CCOc1cccc(c1Br)Br 34a_100010187966_100000070051 [0,2,0,0,0,0|2,0,0]=4 4588 B13R1.16 CC=CCOc1cccc(c1Br)Br 7a_100010187966_100000070051 [0,2,0,0,0,0|2,0,0]=4 4589 B13R1.16 CC=CCOc1cccc(c1Br)C 34a_100000686692_100000070051 [0,2,0,0,0,0|1,0,0]=3 4590 B13R1.16 CC=CCOc1cccc(c1Br)C 7a_100000686692_100000070051 [0,2,0,0,0,0|1,0,0]=3 4591 B13R1.16 CC=CCOc1cccc(c1Br)Cl 34a_100012348804_100000070051 [0,2,0,0,0,0|2,0,0]=4 4592 B13R1.16 CC=CCOc1cccc(c1Br)Cl 7a_100012348804_100000070051 [0,2,0,0,0,0|2,0,0]=4 4593 B13R1.16 CC=CCOc1cccc(c1Br)F 34a_100009820682_100000070051 [0,2,0,0,0,0|2,0,0]=4 4594 B13R1.16 CC=CCOc1cccc(c1Br)F 7a_100009820682_100000070051 [0,2,0,0,0,0|2,0,0]=4 4595 B13R1.16 CC=CCOc1cccc(c1Br)I 34a_100010187914_100000070051 [0,2,0,0,0,0|2,0,0]=4 4596 B13R1.16 CC=CCOc1cccc(c1Br)I 7a_100010187914_100000070051 [0,2,0,0,0,0|2,0,0]=4 4597 B13R1.16 CC=CCOc1cccc(c1Br)N 34a_100012183704_100000070051 [0,2,0,0,0,0|2,0,0]=4 4598 B13R1.16 CC=CCOc1cccc(c1Br)N 7a_100012183704_100000070051 [0,2,0,0,0,0|2,0,0]=4 4599 B13R1.16 CC=CCOc1cccc(c1C)Br 34a_100012002258_100000070051 [0,2,0,0,0,0|2,0,0]=4 4600 B13R1.16 CC=CCOc1cccc(c1C)Br 7a_100012002258_100000070051 [0,2,0,0,0,0|2,0,0]=4 4601 B13R1.16 CC=CCOc1cccc(c1C)C 34a_100000185855_100000070051 [0,2,0,0,0,0|1,0,0]=3 4602 B13R1.16 CC=CCOc1cccc(c1C)C 7a_100000185855_100000070051 [0,2,0,0,0,0|1,0,0]=3 4603 B13R1.16 CC=CCOc1cccc(c1C)Cl 34a_100011265684_100000070051 [0,2,0,0,0,0|2,0,0]=4 4604 B13R1.16 CC=CCOc1cccc(c1C)Cl 7a_100011265684_100000070051 [0,2,0,0,0,0|2,0,0]=4 4605 B13R1.16 CC=CCOc1cccc(c1C)F 34a_100011217231_100000070051 [0,2,0,0,0,0|2,0,0]=4 4606 B13R1.16 CC=CCOc1cccc(c1C)F 7a_100011217231_100000070051 [0,2,0,0,0,0|2,0,0]=4 4607 B13R1.16 CC=CCOc1cccc(c1C)N 34a_100011216573_100000070051 [0,2,0,0,0,0|2,0,0]=4 4608 B13R1.16 CC=CCOc1cccc(c1C)N 7a_100011216573_100000070051 [0,2,0,0,0,0|2,0,0]=4 4609 B13R1.16 CC=CCOc1cccc(c1Cl)Br 34a_100010187913_100000070051 [0,2,0,0,0,0|2,0,0]=4 4610 B13R1.16 CC=CCOc1cccc(c1Cl)Br 7a_100010187913_100000070051 [0,2,0,0,0,0|2,0,0]=4 4611 B13R1.16 CC=CCOc1cccc(c1Cl)C 34a_100000695629_100000070051 [0,2,0,0,0,0|1,0,0]=3 4612 B13R1.16 CC=CCOc1cccc(c1Cl)C 7a_100000695629_100000070051 [0,2,0,0,0,0|1,0,0]=3 4613 B13R1.16 CC=CCOc1cccc(c1Cl)Cl 34a_100000211076_100000070051 [0,2,0,0,0,0|2,0,0]=4 4614 B13R1.16 CC=CCOc1cccc(c1Cl)Cl 7a_100000211076_100000070051 [0,2,0,0,0,0|2,0,0]=4 4615 B13R1.16 CC=CCOc1cccc(c1Cl)F 34a_100000087408_100000070051 [0,2,0,0,0,0|2,0,0]=4 4616 B13R1.16 CC=CCOc1cccc(c1Cl)F 7a_100000087408_100000070051 [0,2,0,0,0,0|2,0,0]=4 4617 B13R1.16 CC=CCOc1cccc(c1Cl)I 34a_100000049636_100000070051 [0,2,0,0,0,0|2,0,0]=4 4618 B13R1.16 CC=CCOc1cccc(c1Cl)I 7a_100000049636_100000070051 [0,2,0,0,0,0|2,0,0]=4 4619 B13R1.16 CC=CCOc1cccc(c1Cl)N 34a_100012002038_100000070051 [0,2,0,0,0,0|2,0,0]=4 4620 B13R1.16 CC=CCOc1cccc(c1Cl)N 7a_100012002038_100000070051 [0,2,0,0,0,0|2,0,0]=4 4621 B13R1.16 CC=CCOc1cccc(c1F)Br 34a_100009817021_100000070051 [0,2,0,0,0,0|2,0,0]=4 4622 B13R1.16 CC=CCOc1cccc(c1F)Br 7a_100009817021_100000070051 [0,2,0,0,0,0|2,0,0]=4 4623 B13R1.16 CC=CCOc1cccc(c1F)C 34a_100000751311_100000070051 [0,2,0,0,0,0|1,0,0]=3 4624 B13R1.16 CC=CCOc1cccc(c1F)C 7a_100000751311_100000070051 [0,2,0,0,0,0|1,0,0]=3 4625 B13R1.16 CC=CCOc1cccc(c1F)Cl 34a_100000687438_100000070051 [0,2,0,0,0,0|2,0,0]=4 4626 B13R1.16 CC=CCOc1cccc(c1F)Cl 7a_100000687438_100000070051 [0,2,0,0,0,0|2,0,0]=4 4627 B13R1.16 CC=CCOc1cccc(c1F)F 34a_100000751161_100000070051 [0,2,0,0,0,0|2,0,0]=4 4628 B13R1.16 CC=CCOc1cccc(c1F)F 7a_100000751161_100000070051 [0,2,0,0,0,0|2,0,0]=4 4629 B13R1.16 CC=CCOc1cccc(c1I)Br 34a_100010187912_100000070051 [0,2,0,0,0,0|2,0,0]=4 4630 B13R1.16 CC=CCOc1cccc(c1I)Br 7a_100010187912_100000070051 [0,2,0,0,0,0|2,0,0]=4 4631 B13R1.16 CC=CCOc1cccc(c1I)C 34a_100010083724_100000070051 [0,2,0,0,0,0|1,0,0]=3 4632 B13R1.16 CC=CCOc1cccc(c1I)C 7a_100010083724_100000070051 [0,2,0,0,0,0|1,0,0]=3 4633 B13R1.16 CC=CCOc1cccc(c1I)Cl 34a_100000050174_100000070051 [0,2,0,0,0,0|2,0,0]=4 4634 B13R1.16 CC=CCOc1cccc(c1I)Cl 7a_100000050174_100000070051 [0,2,0,0,0,0|2,0,0]=4 4635 B13R1.16 CC=CCOc1cccc(c1I)F 34a_100000690913_100000070051 [0,2,0,0,0,0|2,0,0]=4 4636 B13R1.16 CC=CCOc1cccc(c1I)F 7a_100000690913_100000070051 [0,2,0,0,0,0|2,0,0]=4 4637 B13R1.16 CC=CCOc1cccc(c1N)Br 34a_100011934926_100000070051 [0,2,0,0,0,0|2,0,0]=4 4638 B13R1.16 CC=CCOc1cccc(c1N)Br 7a_100011934926_100000070051 [0,2,0,0,0,0|2,0,0]=4 4639 B13R1.16 CC=CCOc1cccc(c1N)C 34a_100000743429_100000070051 [0,2,0,0,0,0|1,0,0]=3 4640 B13R1.16 CC=CCOc1cccc(c1N)C 7a_100000743429_100000070051 [0,2,0,0,0,0|1,0,0]=3 4641 B13R1.16 CC=CCOc1cccc(c1N)Cl 34a_100012022510_100000070051 [0,2,0,0,0,0|2,0,0]=4 4642 B13R1.16 CC=CCOc1cccc(c1N)Cl 7a_100012022510_100000070051 [0,2,0,0,0,0|2,0,0]=4 4643 B13R1.16 CC=CCOc1cccc(c1N)F 34a_100020591140_100000070051 [0,2,0,0,0,0|2,0,0]=4 4644 B13R1.16 CC=CCOc1cccc(c1N)F 7a_100020591140_100000070051 [0,2,0,0,0,0|2,0,0]=4 4645 B13R1.16 CC=CCOc1cccc(c1N)I 34a_200000049512_100000070051 [0,2,0,0,0,0|2,0,0]=4 4646 B13R1.16 CC=CCOc1cccc(c1N)I 7a_200000049512_100000070051 [0,2,0,0,0,0|2,0,0]=4 4647 B13R1.16 CC=CCOc1cccc(c1N)N 34a_100000033209_100000070051 [0,2,0,0,0,0|2,0,0]=4 4648 B13R1.16 CC=CCOc1cccn(c1=O)C 34a_100000117616_100000070051 [0,2,0,0,0,0|1,0,1]=4 4649 B13R1.16 CC=CCOc1cccn(c1=O)C 7a_100000117616_100000070051 [0,2,0,0,0,0|1,0,1]=4 4650 B13R1.16 CC=CCOc1nccc(c1Br)C 34a_100012000493_100000070051 [0,2,0,0,0,0|2,0,0]=4 4651 B13R1.16 CC=CCSc1cccc(c1Br)Br 62a_100000070051_100010175083 [0,2,0,0,0,0|2,0,0]=4 4652 B13R1.16 CC=CCSc1cccc(c1Br)Br 62a_100010175083_100000070051 [0,2,0,0,0,0|2,0,0]=4 4653 B13R1.16 CC=CCSc1cccc(c1Br)C 62a_100000070051_100012362457 [0,2,0,0,0,0|1,0,0]=3 4654 B13R1.16 CC=CCSc1cccc(c1Br)C 62a_100012362457_100000070051 [0,2,0,0,0,0|1,0,0]=3 4655 B13R1.16 CC=CCSc1cccc(c1Br)Cl 62a_100000070051_100014021842 [0,2,0,0,0,0|2,0,0]=4 4656 B13R1.16 CC=CCSc1cccc(c1Br)Cl 62a_100014021842_100000070051 [0,2,0,0,0,0|2,0,0]=4 4657 B13R1.16 CC=CCSc1cccc(c1Br)F 62a_100000070051_100010202630 [0,2,0,0,0,0|2,0,0]=4 4658 B13R1.16 CC=CCSc1cccc(c1Br)F 62a_100010202630_100000070051 [0,2,0,0,0,0|2,0,0]=4 4659 B13R1.16 CC=CCSc1cccc(c1Br)O 62a_100000070051_100010187914 [0,2,0,0,0,0|2,0,0]=4 4660 B13R1.16 CC=CCSc1cccc(c1Br)O 62a_100010187914_100000070051 [0,2,0,0,0,0|2,0,0]=4 4661 B13R1.16 CC=CCSc1cccc(c1C)Br 62a_100000070051_100012353703 [0,2,0,0,0,0|2,0,0]=4 4662 B13R1.16 CC=CCSc1cccc(c1C)Br 62a_100012353703_100000070051 [0,2,0,0,0,0|2,0,0]=4 4663 B13R1.16 CC=CCSc1cccc(c1C)C 62a_100000070051_100011214922 [0,2,0,0,0,0|1,0,0]=3 4664 B13R1.16 CC=CCSc1cccc(c1C)C 62a_100011214922_100000070051 [0,2,0,0,0,0|1,0,0]=3 4665 B13R1.16 CC=CCSc1cccc(c1C)Cl 62a_100000070051_100000726075 [0,2,0,0,0,0|2,0,0]=4 4666 B13R1.16 CC=CCSc1cccc(c1C)Cl 62a_100000726075_100000070051 [0,2,0,0,0,0|2,0,0]=4 4667 B13R1.16 CC=CCSc1cccc(c1C)F 62a_100000070051_100011216893 [0,2,0,0,0,0|2,0,0]=4 4668 B13R1.16 CC=CCSc1cccc(c1C)F 62a_100011216893_100000070051 [0,2,0,0,0,0|2,0,0]=4 4669 B13R1.16 CC=CCSc1cccc(c1C)N 62a_100000070051_100000761887 [0,2,0,0,0,0|2,0,0]=4 4670 B13R1.16 CC=CCSc1cccc(c1C)N 62a_100000761887_100000070051 [0,2,0,0,0,0|2,0,0]=4 4671 B13R1.16 CC=CCSc1cccc(c1C)O 62a_100000070051_100012002258 [0,2,0,0,0,0|2,0,0]=4 4672 B13R1.16 CC=CCSc1cccc(c1C)O 62a_100012002258_100000070051 [0,2,0,0,0,0|2,0,0]=4 4673 B13R1.16 CC=CCSc1cccc(c1Cl)Br 62a_100000070051_100010142854 [0,2,0,0,0,0|2,0,0]=4 4674 B13R1.16 CC=CCSc1cccc(c1Cl)Br 62a_100010142854_100000070051 [0,2,0,0,0,0|2,0,0]=4 4675 B13R1.16 CC=CCSc1cccc(c1Cl)C 62a_100000070051_200012352035 [0,2,0,0,0,0|1,0,0]=3 4676 B13R1.16 CC=CCSc1cccc(c1Cl)C 62a_200012352035_100000070051 [0,2,0,0,0,0|1,0,0]=3 4677 B13R1.16 CC=CCSc1cccc(c1Cl)Cl 62a_100000070051_100011215384 [0,2,0,0,0,0|2,0,0]=4 4678 B13R1.16 CC=CCSc1cccc(c1Cl)Cl 62a_100011215384_100000070051 [0,2,0,0,0,0|2,0,0]=4 4679 B13R1.16 CC=CCSc1cccc(c1Cl)F 62a_100000070051_200010234923 [0,2,0,0,0,0|2,0,0]=4 4680 B13R1.16 CC=CCSc1cccc(c1Cl)F 62a_200010234923_100000070051 [0,2,0,0,0,0|2,0,0]=4 4681 B13R1.16 CC=CCSc1cccc(c1Cl)O 62a_100000070051_100000049636 [0,2,0,0,0,0|2,0,0]=4 4682 B13R1.16 CC=CCSc1cccc(c1F)Br 62a_100000070051_100000702267 [0,2,0,0,0,0|2,0,0]=4 4683 B13R1.16 CC=CCSc1cccc(c1F)Br 62a_100000702267_100000070051 [0,2,0,0,0,0|2,0,0]=4 4684 B13R1.16 CC=CCSc1cccc(c1F)C 62a_100000070051_100000717567 [0,2,0,0,0,0|1,0,0]=3 4685 B13R1.16 CC=CCSc1cccc(c1F)C 62a_100000717567_100000070051 [0,2,0,0,0,0|1,0,0]=3 4686 B13R1.16 CC=CCSc1cccc(c1F)Cl 62a_100000070051_100011217346 [0,2,0,0,0,0|2,0,0]=4 4687 B13R1.16 CC=CCSc1cccc(c1F)Cl 62a_100011217346_100000070051 [0,2,0,0,0,0|2,0,0]=4 4688 B13R1.16 CC=CCSc1cccc(c1F)F 62a_100000070051_100000694657 [0,2,0,0,0,0|2,0,0]=4 4689 B13R1.16 CC=CCSc1cccc(c1F)F 62a_100000694657_100000070051 [0,2,0,0,0,0|2,0,0]=4 4690 B13R1.16 CC=CCSc1cccc(c1F)N 62a_100000070051_100011935091 [0,2,0,0,0,0|2,0,0]=4 4691 B13R1.16 CC=CCSc1cccc(c1F)N 62a_100011935091_100000070051 [0,2,0,0,0,0|2,0,0]=4 4692 B13R1.16 CC=CCSc1cccc(c1F)O 62a_100000070051_100009817021 [0,2,0,0,0,0|2,0,0]=4 4693 B13R1.16 CC=CCSc1cccc(c1F)O 62a_100009817021_100000070051 [0,2,0,0,0,0|2,0,0]=4 4694 B13R1.16 CC=CCSc1cccc(c1N)Br 62a_100000070051_100010146558 [0,2,0,0,0,0|2,0,0]=4 4695 B13R1.16 CC=CCSc1cccc(c1N)Br 62a_100010146558_100000070051 [0,2,0,0,0,0|2,0,0]=4 4696 B13R1.16 CC=CCSc1cccc(c1N)C 62a_100000070051_100011834072 [0,2,0,0,0,0|1,0,0]=3 4697 B13R1.16 CC=CCSc1cccc(c1N)C 62a_100011834072_100000070051 [0,2,0,0,0,0|1,0,0]=3 4698 B13R1.16 CC=CCSc1cccc(c1N)Cl 62a_100000070051_100010190421 [0,2,0,0,0,0|2,0,0]=4 4699 B13R1.16 CC=CCSc1cccc(c1N)Cl 62a_100010190421_100000070051 [0,2,0,0,0,0|2,0,0]=4 4700 B13R1.16 CC=CCSc1cccc(c1N)F 62a_100000042321_100000070051 [0,2,0,0,0,0|2,0,0]=4 4701 B13R1.16 CC=CCSc1cccc(c1N)F 62a_100000070051_100000042321 [0,2,0,0,0,0|2,0,0]=4 4702 B13R1.16 CC=CCSc1cccc(c1N)N 62a_100015191791_100000070051 [0,2,0,0,0,0|2,0,0]=4 4703 B13R1.16 CC=CCSc1cccc(c1N)O 62a_100000070051_100011934926 [0,2,0,0,0,0|2,0,0]=4 4704 B13R1.16 CC=CCSc1cccc(c1O)Br 62a_100000070051_100010084509 [0,2,0,0,0,0|1,0,0]=3 4705 B13R1.16 CC=CCSc1cccc(c1O)Br 62a_100010084509_100000070051 [0,2,0,0,0,0|1,0,0]=3 4706 B13R1.16 CC=CCSc1cccc(c1O)C 62a_100000070051_100009817157 [0,2,0,0,0,0|0,0,0]=2 4707 B13R1.16 CC=CCSc1cccc(c1O)C 62a_100009817157_100000070051 [0,2,0,0,0,0|0,0,0]=2 4708 B13R1.16 CC=CCSc1cccc(c1O)Cl 62a_100000070051_100010202889 [0,2,0,0,0,0|1,0,0]=3 4709 B13R1.16 CC=CCSc1cccc(c1O)Cl 62a_100010202889_100000070051 [0,2,0,0,0,0|1,0,0]=3 4710 B13R1.16 CC=CCSc1cccc(c1O)F 62a_100000070051_100009813666 [0,2,0,0,0,0|1,0,0]=3 4711 B13R1.16 CC=CCSc1cccc(c1O)F 62a_100009813666_100000070051 [0,2,0,0,0,0|1,0,0]=3 4712 B13R1.16 CC=CCSc1cccc(c1O)N 62a_100000070051_100010084371 [0,2,0,0,0,0|1,0,0]=3 4713 B13R1.16 CC=CCSc1cccc(c1O)N 62a_100011934915_100000070051 [0,2,0,0,0,0|1,0,0]=3 4714 B13R1.16 CC=CCSc1cccc(c1O)O 62a_100000070051_100009815950 [0,2,0,0,0,0|1,0,0]=3 4715 B13R1.16 CC=CCSc1cccn(c1=O)C 62a_100000070051_100000687173 [0,2,0,0,0,0|1,0,1]=4 4716 B13R1.16 CC=CCSc1cccn(c1=O)C 62a_100000687173_100000070051 [0,2,0,0,0,0|1,0,1]=4 4717 B13R1.16 CC=CCSc1ccnc(c1C)C 62a_100000070051_100009846815 [0,2,0,0,0,0|2,0,0]=4 4718 B13R1.16 CC=CCSc1ccnc(c1C)C 62a_100009846815_100000070051 [0,2,0,0,0,0|2,0,0]=4 4719 B13R1.16 CC=CCSc1ccnc(c1Cl)C 62a_100000070051_100000698670 [0,2,0,0,0,0|2,0,0]=4 4720 B13R1.16 CC=CCSc1ccnc(c1Cl)C 62a_100000698670_100000070051 [0,2,0,0,0,0|2,0,0]=4 4721 B13R1.16 CC=CCSc1ccnc(c1F)C 62a_100000070051_100009849794 [0,2,0,0,0,0|2,0,0]=4 4722 B13R1.16 CC=CCSc1ccnc(c1F)C 62a_100009849794_100000070051 [0,2,0,0,0,0|2,0,0]=4 4723 B13R1.16 CC=CCSc1ccnc(c1N)C 62a_100000070051_100009885578 [0,2,0,0,0,0|2,0,0]=4 4724 B13R1.16 CC=CCSc1ccnc(c1N)C 62a_100009885578_100000070051 [0,2,0,0,0,0|2,0,0]=4 4725 B13R1.16 CC=CCSc1ccnc(c1O)Cl 62a_100000070051_100010067911 [0,2,0,0,0,0|2,0,0]=4 4726 B13R1.16 CC=CCSc1cncc(c1C)C 62a_100000070051_100009864703 [0,2,0,0,0,0|2,0,0]=4 4727 B13R1.16 CC=CCSc1cncc(c1C)C 62a_100009864703_100000070051 [0,2,0,0,0,0|2,0,0]=4 4728 B13R1.16 CC=CCSc1cncc(c1N)C 62a_100000070051_100009818025 [0,2,0,0,0,0|2,0,0]=4 4729 B13R1.16 CC=CCSc1cncc(c1N)C 62a_100009818025_100000070051 [0,2,0,0,0,0|2,0,0]=4 4730 B13R1.16 CC=CCSc1cncc(c1O)N 62a_100000070051_100000694263 [0,2,0,0,0,0|2,0,0]=4 4731 B13R1.16 CC=CCSc1cncc(c1O)N 62a_100000694263_100000070051 [0,2,0,0,0,0|2,0,0]=4 4732 B13R1.16 CC=CCSc1nccc(c1C)C 62a_100000070051_100009847204 [0,2,0,0,0,0|2,0,0]=4 4733 B13R1.16 CC=CCSc1nccc(c1C)C 62a_100009847204_100000070051 [0,2,0,0,0,0|2,0,0]=4 4734 B13R1.16 CC=CCSc1nccc(c1F)C 62a_100000070051_100009817629 [0,2,0,0,0,0|2,0,0]=4 4735 B13R1.16 CC=CCSc1nccc(c1F)C 62a_100009817629_100000070051 [0,2,0,0,0,0|2,0,0]=4 4736 B13R1.16 CC=CCSc1nccc(c1N)C 62a_100000070051_100000763560 [0,2,0,0,0,0|2,0,0]=4 4737 B13R1.16 CC=CCSc1nccc(c1N)C 62a_100000763560_100000070051 [0,2,0,0,0,0|2,0,0]=4 4738 B13R1.16 CC=CCSc1nccc(c1O)C 62a_100000070051_100000696282 [0,2,0,0,0,0|1,0,0]=3 4739 B13R1.16 CC=CCSc1nccc(c1O)F 62a_100000070051_100009867227 [0,2,0,0,0,0|2,0,0]=4 4740 B13R1.16 CC=CCSc1nccc(c1O)N 62a_100000070051_100009844647 [0,2,0,0,0,0|2,0,0]=4 4741 B13R1.16 CCCC=Cc1cccc(c1O)C 271570a_100016258520_100009817157 [0,2,0,0,0,0|0,0,2]=4 4742 B13R1.16 CCCCNc1cccc(c1O)C 34a_100000756359_100000210210 [0,2,0,0,0,0|0,0,2]=4 4743 B13R1.16 CCCCSc1cccc(c1O)C 62a_100000210211_100009817157 [0,2,0,0,0,0|0,0,2]=4 4744 B13R1.16 CCCCSc1cccc(c1O)C 62a_100009817157_100000210210 [0,2,0,0,0,0|0,0,2]=4 4745 B13R1.16 CCCNCc1cccc(c1O)C 34a_100020639391_100000210303 [0,2,0,0,0,0|0,0,2]=4 4746 B13R1.16 CCOC=Cc1cccc(c1O)C 271570a_100016256518_100009817157 [0,2,0,0,0,0|0,0,2]=4 4747 B13R1.16 CCOCSc1cccc(c1O)C 62a_100000739092_100009817157 [0,2,0,0,0,0|0,0,2]=4 4748 B13R1.16 CCOCSc1cccc(c1O)C 62a_100009817157_100000739092 [0,2,0,0,0,0|0,0,2]=4 4749 B13R1.16 COCC=Cc1cccc(c1O)C 271570a_100016286323_100009817157 [0,2,0,0,0,0|0,0,2]=4 4750 B13R1.16 COCCNc1cccc(c1O)C 34a_100000756359_100011201679 [0,2,0,0,0,0|0,0,2]=4 4751 B13R1.16 COCCSc1cccc(c1O)C 62a_100000233755_100009817157 [0,2,0,0,0,0|0,0,2]=4 4752 B13R1.16 COCCSc1cccc(c1O)C 62a_100009817157_100000233755 [0,2,0,0,0,0|0,0,2]=4 4753 B13R1.16 CSCCNc1cccc(c1O)C 34a_100000756359_100000212216 [0,2,0,0,0,0|0,0,2]=4 4754 B13R1.16 CSCCSc1cccc(c1O)C 62a_100000212216_100009817157 [0,2,0,0,0,0|0,0,2]=4 4755 B13R1.16 CSCCSc1cccc(c1O)C 62a_100009817157_100000751147 [0,2,0,0,0,0|0,0,2]=4 4756 B13R1.16 CSCNCc1cccc(c1O)C 34a_100020639391_100011218213 [0,2,0,0,0,0|0,0,2]=4 4757 B13R1.16 Cc1cccc(c1Br)COCC=O 34a_100011659289_200009817547 [0,2,0,0,0,0|1,0,1]=4 4758 B13R1.16 Cc1cccc(c1Br)COCC=O 7a_100011659289_200015260668 [0,2,0,0,0,0|1,0,1]=4 4759 B13R1.16 Cc1cccc(c1Br)CSCC=O 62a_200012349612_200015260668 [0,2,0,0,0,0|1,0,1]=4 4760 B13R1.16 Cc1cccc(c1Br)CSCC=O 62a_200015260668_200012349612 [0,2,0,0,0,0|1,0,1]=4 4761 B13R1.16 Cc1cccc(c1C)CNCC=O 2230a_100011211637_200015260668 [0,2,0,0,0,0|1,0,1]=4 4762 B13R1.16 Cc1cccc(c1C)CNCC=O 34a_100011211637_200009817547 [0,2,0,0,0,0|1,0,1]=4 4763 B13R1.16 Cc1cccc(c1C)COCC=O 34a_100011219135_200009817547 [0,2,0,0,0,0|1,0,1]=4 4764 B13R1.16 Cc1cccc(c1C)COCC=O 7a_100011219135_200015260668 [0,2,0,0,0,0|1,0,1]=4 4765 B13R1.16 Cc1cccc(c1C)CSCC=O 62a_100011515928_200015260668 [0,2,0,0,0,0|1,0,1]=4 4766 B13R1.16 Cc1cccc(c1C)CSCC=O 62a_200015260668_100011515928 [0,2,0,0,0,0|1,0,1]=4 4767 B13R1.16 Cc1cccc(c1Cl)CNCC=O 2230a_100025705714_200015260668 [0,2,0,0,0,0|1,0,1]=4 4768 B13R1.16 Cc1cccc(c1Cl)CNCC=O 34a_100025705714_200009817547 [0,2,0,0,0,0|1,0,1]=4 4769 B13R1.16 Cc1cccc(c1Cl)COCC=O 34a_100000710031_200009817547 [0,2,0,0,0,0|1,0,1]=4 4770 B13R1.16 Cc1cccc(c1Cl)COCC=O 7a_100000710031_200015260668 [0,2,0,0,0,0|1,0,1]=4 4771 B13R1.16 Cc1cccc(c1F)CNCC=O 2230a_100012002060_200015260668 [0,2,0,0,0,0|1,0,1]=4 4772 B13R1.16 Cc1cccc(c1F)CNCC=O 34a_100012002060_200009817547 [0,2,0,0,0,0|1,0,1]=4 4773 B13R1.16 Cc1cccc(c1F)COCC=O 34a_200011219517_200009817547 [0,2,0,0,0,0|1,0,1]=4 4774 B13R1.16 Cc1cccc(c1F)COCC=O 7a_200011219517_200015260668 [0,2,0,0,0,0|1,0,1]=4 4775 B13R1.16 Cc1cccc(c1F)CSCC=O 62a_100011216058_200015260668 [0,2,0,0,0,0|1,0,1]=4 4776 B13R1.16 Cc1cccc(c1F)CSCC=O 62a_200015260668_100011216058 [0,2,0,0,0,0|1,0,1]=4 4777 B13R1.16 Cc1cccc(c1I)COCC=O 34a_100012349780_200009817547 [0,2,0,0,0,0|1,0,1]=4 4778 B13R1.16 Cc1cccc(c1I)COCC=O 7a_100012349780_200015260668 [0,2,0,0,0,0|1,0,1]=4 4779 B13R1.16 Cc1cccc(c1N)COCC=O 34a_100011215590_200009817547 [0,2,0,0,0,0|1,0,1]=4 4780 B13R1.16 Cc1cccc(c1O)CNCC=O 34a_100020639391_200009817547 [0,2,0,0,0,0|0,0,1]=3 4781 B13R1.16 Cc1cccc(c1O)CNCCF 34a_100020639391_100011217306 [0,2,0,0,0,0|0,0,2]=4 4782 B13R1.16 Cc1cccc(c1O)CNCCO 34a_100020639391_100000211926 [0,2,0,0,0,0|0,0,2]=4 4783 B13R1.16 Cc1cccc(c1O)NCCCF 34a_100000756359_100011934791 [0,2,0,0,0,0|0,0,2]=4 4784 B13R1.16 Cc1cccc(c1O)NCCCO 34a_100000756359_100000230001 [0,2,0,0,0,0|0,0,2]=4 4785 B13R1.16 Cc1cccc(c1O)SCCC#N 62a_100009817157_100011215226 [0,2,0,0,0,0|0,0,2]=4 4786 B13R1.16 Cc1cccc(c1O)SCCC#N 62a_100011215226_100009817157 [0,2,0,0,0,0|0,0,2]=4 4787 B13R1.16 Cc1cccc(c1O)SCCCF 62a_100009817157_100011934791 [0,2,0,0,0,0|0,0,2]=4 4788 B13R1.16 Cc1cccc(c1O)SCCCF 62a_100011934791_100009817157 [0,2,0,0,0,0|0,0,2]=4 4789 B13R1.16 Cc1cccc(c1O)SCCCO 62a_100009817157_100011215043 [0,2,0,0,0,0|0,0,2]=4 4790 B13R1.16 Cc1cccc(c1O)SCCCO 62a_100011215043_100009817157 [0,2,0,0,0,0|0,0,2]=4 4791 B13R1.16 Cc1cccc(c1O)SCSC#N 62a_100000211825_100009817157 [0,2,0,0,0,0|1,0,1]=4 4792 B13R1.16 Cc1cccc(c1O)SCSC#N 62a_100009817157_100000211825 [0,2,0,0,0,0|1,0,1]=4 4793 B13R1.40 C#CC(=O)Cc1cccc(c1Br)C 1458a_100000211873_200012349612 [0,2,0,0,0,0|1,0,1]=4 4794 B13R1.40 C#CC(=O)Cc1cccc(c1C)C 1458a_100000211873_100011515928 [0,2,0,0,0,0|1,0,1]=4 4795 B13R1.40 C#CC(=O)Cc1cccc(c1F)C 1458a_100000211873_100011216058 [0,2,0,0,0,0|1,0,1]=4 4796 B13R1.40 C#CC(C)Nc1cccc(c1O)C 34a_100000756359_200000035995 [0,2,0,0,0,0|0,0,2]=4 4797 B13R1.40 C#CC(C)Sc1cccc(c1O)C 62a_200000035995_100009817157 [0,2,0,0,0,0|0,0,2]=4 4798 B13R1.40 C=CC(=O)Cc1cccc(c1Br)C 1458a_100000185746_200012349612 [0,2,0,0,0,0|1,0,0]=3 4799 B13R1.40 C=CC(=O)Cc1cccc(c1Br)Cl 1458a_100000185746_100010145525 [0,2,0,0,0,0|2,0,0]=4 4800 B13R1.40 C=CC(=O)Cc1cccc(c1Br)F 1458a_100000185746_100012351116 [0,2,0,0,0,0|2,0,0]=4 4801 B13R1.40 C=CC(=O)Cc1cccc(c1Br)I 1458a_100000185746_100010254545 [0,2,0,0,0,0|2,0,0]=4 4802 B13R1.40 C=CC(=O)Cc1cccc(c1C)Br 1458a_100000185746_100000694682 [0,2,0,0,0,0|2,0,0]=4 4803 B13R1.40 C=CC(=O)Cc1cccc(c1C)C 1458a_100000185746_100011515928 [0,2,0,0,0,0|1,0,0]=3 4804 B13R1.40 C=CC(=O)Cc1cccc(c1C)Cl 1458a_100000185746_100012186920 [0,2,0,0,0,0|2,0,0]=4 4805 B13R1.40 C=CC(=O)Cc1cccc(c1C)F 1458a_100000185746_100009813626 [0,2,0,0,0,0|2,0,0]=4 4806 B13R1.40 C=CC(=O)Cc1cccc(c1C)I 1458a_100000185746_100010150147 [0,2,0,0,0,0|2,0,0]=4 4807 B13R1.40 C=CC(=O)Cc1cccc(c1Cl)Br 1458a_100000185746_100012349491 [0,2,0,0,0,0|2,0,0]=4 4808 B13R1.40 C=CC(=O)Cc1cccc(c1Cl)Cl 1458a_100000185746_100000720918 [0,2,0,0,0,0|2,0,0]=4 4809 B13R1.40 C=CC(=O)Cc1cccc(c1Cl)F 1458a_100000185746_100000696688 [0,2,0,0,0,0|2,0,0]=4 4810 B13R1.40 C=CC(=O)Cc1cccc(c1F)Br 1458a_100000185746_100012356507 [0,2,0,0,0,0|2,0,0]=4 4811 B13R1.40 C=CC(=O)Cc1cccc(c1F)C 1458a_100000185746_100011216058 [0,2,0,0,0,0|1,0,0]=3 4812 B13R1.40 C=CC(=O)Cc1cccc(c1F)Cl 1458a_100000185746_100000716733 [0,2,0,0,0,0|2,0,0]=4 4813 B13R1.40 C=CC(=O)Cc1cccc(c1F)F 1458a_100000185746_100000217499 [0,2,0,0,0,0|2,0,0]=4 4814 B13R1.40 C=CC(=O)Cc1cccc(c1I)F 1458a_100000185746_100010149603 [0,2,0,0,0,0|2,0,0]=4 4815 B13R1.40 C=CC(=O)Nc1cccc(c1Br)C 1626a_100000684715_100000185746 [0,2,0,0,0,0|1,0,1]=4 4816 B13R1.40 C=CC(=O)Nc1cccc(c1Br)C 22a_100000684715_100000185746 [0,2,0,0,0,0|1,0,1]=4 4817 B13R1.40 C=CC(=O)Nc1cccc(c1C)C 1626a_100000210026_100000185746 [0,2,0,0,0,0|1,0,1]=4 4818 B13R1.40 C=CC(=O)Nc1cccc(c1C)C 22a_100000210026_100000185746 [0,2,0,0,0,0|1,0,1]=4 4819 B13R1.40 C=CC(=O)Nc1cccc(c1Cl)C 1626a_100000765562_100000185746 [0,2,0,0,0,0|1,0,1]=4 4820 B13R1.40 C=CC(=O)Nc1cccc(c1Cl)C 22a_100000765562_100000185746 [0,2,0,0,0,0|1,0,1]=4 4821 B13R1.40 C=CC(=O)Nc1cccc(c1F)C 1626a_100000697159_100000185746 [0,2,0,0,0,0|1,0,1]=4 4822 B13R1.40 C=CC(=O)Nc1cccc(c1I)C 1626a_100000761888_100000185746 [0,2,0,0,0,0|1,0,1]=4 4823 B13R1.40 C=CC(=O)Nc1cccc(c1O)Br 22a_100011934915_100000185746 [0,2,0,0,0,0|1,0,1]=4 4824 B13R1.40 C=CC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000185746 [0,2,0,0,0,0|0,0,1]=3 4825 B13R1.40 C=CC(=O)Nc1cccc(c1O)C 22a_100000756359_100000185746 [0,2,0,0,0,0|0,0,1]=3 4826 B13R1.40 C=CC(=O)Nc1cccc(c1O)Cl 22a_100000754742_100000185746 [0,2,0,0,0,0|1,0,1]=4 4827 B13R1.40 C=CC(=O)Nc1cccc(c1O)F 1626a_100011934987_100000185746 [0,2,0,0,0,0|1,0,1]=4 4828 B13R1.40 C=CC(=O)Nc1cccc(c1O)F 22a_100011934987_100000185746 [0,2,0,0,0,0|1,0,1]=4 4829 B13R1.40 C=CC(=O)Nc1cccc(c1O)I 1626a_100010084371_100000185746 [0,2,0,0,0,0|1,0,1]=4 4830 B13R1.40 C=CC(=O)Nc1cccc(c1O)I 22a_100010084371_100000185746 [0,2,0,0,0,0|1,0,1]=4 4831 B13R1.40 C=CC(C)Sc1cccc(c1Br)Br 62a_100011215867_100010175083 [0,2,0,0,0,0|2,0,0]=4 4832 B13R1.40 C=CC(C)Sc1cccc(c1Br)C 62a_100011215867_100012362457 [0,2,0,0,0,0|1,0,0]=3 4833 B13R1.40 C=CC(C)Sc1cccc(c1Br)Cl 62a_100011215867_100014021842 [0,2,0,0,0,0|2,0,0]=4 4834 B13R1.40 C=CC(C)Sc1cccc(c1Br)F 62a_100011215867_100010202630 [0,2,0,0,0,0|2,0,0]=4 4835 B13R1.40 C=CC(C)Sc1cccc(c1Br)O 62a_100011215867_100010187914 [0,2,0,0,0,0|2,0,0]=4 4836 B13R1.40 C=CC(C)Sc1cccc(c1C)Br 62a_100011215867_100012353703 [0,2,0,0,0,0|2,0,0]=4 4837 B13R1.40 C=CC(C)Sc1cccc(c1C)C 62a_100011215867_100011214922 [0,2,0,0,0,0|1,0,0]=3 4838 B13R1.40 C=CC(C)Sc1cccc(c1C)Cl 62a_100011215867_100000726075 [0,2,0,0,0,0|2,0,0]=4 4839 B13R1.40 C=CC(C)Sc1cccc(c1C)F 62a_100011215867_100011216893 [0,2,0,0,0,0|2,0,0]=4 4840 B13R1.40 C=CC(C)Sc1cccc(c1C)N 62a_100011215867_100000761887 [0,2,0,0,0,0|2,0,0]=4 4841 B13R1.40 C=CC(C)Sc1cccc(c1C)O 62a_100011215867_100012002258 [0,2,0,0,0,0|2,0,0]=4 4842 B13R1.40 C=CC(C)Sc1cccc(c1Cl)Br 62a_100011215867_100010142854 [0,2,0,0,0,0|2,0,0]=4 4843 B13R1.40 C=CC(C)Sc1cccc(c1Cl)C 62a_100011215867_200012352035 [0,2,0,0,0,0|1,0,0]=3 4844 B13R1.40 C=CC(C)Sc1cccc(c1Cl)Cl 62a_100011215867_100011215384 [0,2,0,0,0,0|2,0,0]=4 4845 B13R1.40 C=CC(C)Sc1cccc(c1Cl)F 62a_100011215867_200010234923 [0,2,0,0,0,0|2,0,0]=4 4846 B13R1.40 C=CC(C)Sc1cccc(c1Cl)O 62a_100011215867_100000049636 [0,2,0,0,0,0|2,0,0]=4 4847 B13R1.40 C=CC(C)Sc1cccc(c1F)Br 62a_100011215867_100000702267 [0,2,0,0,0,0|2,0,0]=4 4848 B13R1.40 C=CC(C)Sc1cccc(c1F)C 62a_100011215867_100000717567 [0,2,0,0,0,0|1,0,0]=3 4849 B13R1.40 C=CC(C)Sc1cccc(c1F)Cl 62a_100011215867_100011217346 [0,2,0,0,0,0|2,0,0]=4 4850 B13R1.40 C=CC(C)Sc1cccc(c1F)F 62a_100011215867_100000694657 [0,2,0,0,0,0|2,0,0]=4 4851 B13R1.40 C=CC(C)Sc1cccc(c1F)N 62a_100011215867_100011935091 [0,2,0,0,0,0|2,0,0]=4 4852 B13R1.40 C=CC(C)Sc1cccc(c1F)O 62a_100011215867_100009817021 [0,2,0,0,0,0|2,0,0]=4 4853 B13R1.40 C=CC(C)Sc1cccc(c1N)Br 62a_100011215867_100010146558 [0,2,0,0,0,0|2,0,0]=4 4854 B13R1.40 C=CC(C)Sc1cccc(c1N)C 62a_100011215867_100011834072 [0,2,0,0,0,0|1,0,0]=3 4855 B13R1.40 C=CC(C)Sc1cccc(c1N)Cl 62a_100011215867_100010190421 [0,2,0,0,0,0|2,0,0]=4 4856 B13R1.40 C=CC(C)Sc1cccc(c1N)F 62a_100011215867_100000042321 [0,2,0,0,0,0|2,0,0]=4 4857 B13R1.40 C=CC(C)Sc1cccc(c1N)O 62a_100011215867_100011934926 [0,2,0,0,0,0|2,0,0]=4 4858 B13R1.40 C=CC(C)Sc1cccc(c1O)Br 62a_100011215867_100010084509 [0,2,0,0,0,0|1,0,0]=3 4859 B13R1.40 C=CC(C)Sc1cccc(c1O)C 62a_100011215867_100009817157 [0,2,0,0,0,0|0,0,0]=2 4860 B13R1.40 C=CC(C)Sc1cccc(c1O)Cl 62a_100011215867_100010202889 [0,2,0,0,0,0|1,0,0]=3 4861 B13R1.40 C=CC(C)Sc1cccc(c1O)F 62a_100011215867_100009813666 [0,2,0,0,0,0|1,0,0]=3 4862 B13R1.40 C=CC(C)Sc1cccc(c1O)N 62a_100011215867_100010084371 [0,2,0,0,0,0|1,0,0]=3 4863 B13R1.40 C=CC(C)Sc1cccc(c1O)O 62a_100011215867_100009815950 [0,2,0,0,0,0|1,0,0]=3 4864 B13R1.40 C=CC(C)Sc1cccn(c1=O)C 62a_100011215867_100000687173 [0,2,0,0,0,0|1,0,1]=4 4865 B13R1.40 C=CC(C)Sc1ccnc(c1C)C 62a_100011215867_100009846815 [0,2,0,0,0,0|2,0,0]=4 4866 B13R1.40 C=CC(C)Sc1ccnc(c1Cl)C 62a_100011215867_100000698670 [0,2,0,0,0,0|2,0,0]=4 4867 B13R1.40 C=CC(C)Sc1ccnc(c1F)C 62a_100011215867_100009849794 [0,2,0,0,0,0|2,0,0]=4 4868 B13R1.40 C=CC(C)Sc1ccnc(c1N)C 62a_100011215867_100009885578 [0,2,0,0,0,0|2,0,0]=4 4869 B13R1.40 C=CC(C)Sc1ccnc(c1O)Cl 62a_100011215867_100010067911 [0,2,0,0,0,0|2,0,0]=4 4870 B13R1.40 C=CC(C)Sc1cncc(c1C)C 62a_100011215867_100009864703 [0,2,0,0,0,0|2,0,0]=4 4871 B13R1.40 C=CC(C)Sc1cncc(c1N)C 62a_100011215867_100009818025 [0,2,0,0,0,0|2,0,0]=4 4872 B13R1.40 C=CC(C)Sc1cncc(c1O)N 62a_100011215867_100000694263 [0,2,0,0,0,0|2,0,0]=4 4873 B13R1.40 C=CC(C)Sc1nccc(c1C)C 62a_100011215867_100009847204 [0,2,0,0,0,0|2,0,0]=4 4874 B13R1.40 C=CC(C)Sc1nccc(c1F)C 62a_100011215867_100009817629 [0,2,0,0,0,0|2,0,0]=4 4875 B13R1.40 C=CC(C)Sc1nccc(c1N)C 62a_100011215867_100000763560 [0,2,0,0,0,0|2,0,0]=4 4876 B13R1.40 C=CC(C)Sc1nccc(c1O)C 62a_100011215867_100000696282 [0,2,0,0,0,0|1,0,0]=3 4877 B13R1.40 C=CC(C)Sc1nccc(c1O)F 62a_100011215867_100009867227 [0,2,0,0,0,0|2,0,0]=4 4878 B13R1.40 C=CC(C)Sc1nccc(c1O)N 62a_100011215867_100009844647 [0,2,0,0,0,0|2,0,0]=4 4879 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100000210414_200012349612 [0,2,0,0,0,0|1,0,1]=4 4880 B13R1.40 CCC(=O)Cc1cccc(c1Br)C 1458a_100010147021_100000210202 [0,2,0,0,0,0|1,0,1]=4 4881 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100000210414_100011515928 [0,2,0,0,0,0|1,0,1]=4 4882 B13R1.40 CCC(=O)Cc1cccc(c1C)C 1458a_100011698479_100000210202 [0,2,0,0,0,0|1,0,1]=4 4883 B13R1.40 CCC(=O)Cc1cccc(c1F)C 1458a_100000210414_100011216058 [0,2,0,0,0,0|1,0,1]=4 4884 B13R1.40 CCC(=O)Nc1cccc(c1O)C 11a_100000756359_100000210414 [0,2,0,0,0,0|1,0,1]=4 4885 B13R1.40 CCC(=O)Nc1cccc(c1O)C 1626a_100000756359_100000210414 [0,2,0,0,0,0|1,0,1]=4 4886 B13R1.40 CCC(=O)Nc1cccc(c1O)C 22a_100000756359_100000210414 [0,2,0,0,0,0|1,0,1]=4 4887 B13R1.40 CCC(=O)Nc1cccc(c1O)C 527a_100000756359_100000210414 [0,2,0,0,0,0|1,0,1]=4 4888 B13R1.40 CCC(C)Nc1cccc(c1O)C 34a_100000756359_100011215416 [0,2,0,0,0,0|0,0,2]=4 4889 B13R1.40 CCC(C)Sc1cccc(c1O)C 62a_100000758301_100009817157 [0,2,0,0,0,0|0,0,2]=4 4890 B13R1.40 CCC(C)Sc1cccc(c1O)C 62a_100009817157_100000758301 [0,2,0,0,0,0|0,0,2]=4 4891 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 11a_106832991635_100010147021 [0,2,0,0,0,0|1,0,1]=4 4892 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 1626a_100102657272_100010147021 [0,2,0,0,0,0|1,0,1]=4 4893 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 240690a_100102657272_100010147021 [0,2,0,0,0,0|1,0,1]=4 4894 B13R1.40 CNC(=O)Cc1cccc(c1Br)C 527a_100102657272_100010147021 [0,2,0,0,0,0|1,0,1]=4 4895 B13R1.40 CNC(=O)Cc1cccc(c1C)C 11a_106832991635_100011698479 [0,2,0,0,0,0|1,0,1]=4 4896 B13R1.40 CNC(=O)Cc1cccc(c1C)C 1626a_100102657272_100011698479 [0,2,0,0,0,0|1,0,1]=4 4897 B13R1.40 CNC(=O)Cc1cccc(c1C)C 240690a_100102657272_100011698479 [0,2,0,0,0,0|1,0,1]=4 4898 B13R1.40 CNC(=O)Cc1cccc(c1C)C 527a_100102657272_100011698479 [0,2,0,0,0,0|1,0,1]=4 4899 B13R1.40 CNC(=O)Nc1cccc(c1O)C 2430a_100000756359_100102657272 [0,2,0,0,0,0|1,0,1]=4 4900 B13R1.40 COC(=O)Cc1cccc(c1O)C 271570a_203496583355_200010150888 [0,2,0,0,0,0|0,0,1]=3 4901 B13R1.40 COC(=O)Cc1cccc(c1O)O 271570a_203496583355_100010150830 [0,2,0,0,0,0|1,0,1]=4 4902 B13R1.40 COC(C)Sc1cccc(c1O)C 62a_100009817157_100009879195 [0,2,0,0,0,0|1,0,1]=4 4903 B13R1.40 COC(C)Sc1cccc(c1O)C 62a_100009879195_100009817157 [0,2,0,0,0,0|1,0,1]=4 4904 B13R1.40 Cc1cccc(c1Br)CC(=O)CF 1458a_100010147021_100015361967 [0,2,0,0,0,0|1,0,1]=4 4905 B13R1.40 Cc1cccc(c1Br)CC(=O)CO 1458a_100000210174_200012349612 [0,2,0,0,0,0|1,0,1]=4 4906 B13R1.40 Cc1cccc(c1C)CC(=O)CF 1458a_100011698479_100015361967 [0,2,0,0,0,0|1,0,1]=4 4907 B13R1.40 Cc1cccc(c1C)CC(=O)CO 1458a_100000210174_100011515928 [0,2,0,0,0,0|1,0,1]=4 4908 B13R1.40 Cc1cccc(c1F)CC(=O)CO 1458a_100000210174_100011216058 [0,2,0,0,0,0|1,0,1]=4 4909 B13R1.40 Cc1cccc(c1O)NC(=O)CO 22a_100000756359_100000210174 [0,2,0,0,0,0|1,0,1]=4 4910 B13R1.40 Cc1cccc(c1O)NC(=O)CO 527a_100000756359_100000210174 [0,2,0,0,0,0|1,0,1]=4 4911 B13R1.40 Cc1cccc(c1O)NC(C)CO 34a_100000756359_100012180447 [0,2,0,0,0,0|1,0,1]=4 4912 B13R1.40 Cc1cccc(c1O)SC(C)C#N 62a_100000703298_100009817157 [0,2,0,0,0,0|1,0,1]=4 4913 B13R1.40 Cc1cccc(c1O)SC(C)C#N 62a_100009817157_100000703298 [0,2,0,0,0,0|1,0,1]=4 4914 B13R1.40 Cc1cccc(c1O)SC(C)CO 62a_100012180447_100009817157 [0,2,0,0,0,0|1,0,1]=4 4915 B13R1.40 Cc1cccc(c1O)SC(F)C#N 62a_100009817157_200000117898 [0,2,0,0,0,0|1,0,1]=4 4916 B13R1.40 Cc1cccc(c1O)SC(F)C#N 62a_200000117898_100009817157 [0,2,0,0,0,0|1,0,1]=4 4917 B13R1.40 Cc1cccc(c1O)S[C@H](C)CO 62a_100009817157_100016084084 [0,2,0,0,0,0|1,0,1]=4 4918 B13R1.40 Cc1cccc(c1O)S[C@H](C)CO 62a_100016084084_100009817157 [0,2,0,0,0,0|1,0,1]=4 4919 B13R1.123 C#CCNc1cc(cc(c1O)C)Br 34a_100011825904_100000184674 [0,2,0,0,0,0|0,0,2]=4 4920 B13R1.123 C#CCNc1cc(cc(c1O)C)Br 7a_100011825904_100000038162 [0,2,0,0,0,0|0,0,2]=4 4921 B13R1.123 C#CCNc1cc(cc(c1O)C)C 34a_100011216242_100000184674 [0,2,0,0,0,0|0,0,2]=4 4922 B13R1.123 C#CCNc1cc(cc(c1O)C)C 7a_100011216242_100000038162 [0,2,0,0,0,0|0,0,2]=4 4923 B13R1.123 C#CCNc1cc(cc(c1O)C)F 34a_100000130126_100000184674 [0,2,0,0,0,0|0,0,2]=4 4924 B13R1.123 C#CCNc1cc(cc(c1O)C)F 7a_100000130126_100000038162 [0,2,0,0,0,0|0,0,2]=4 4925 B13R1.123 C#CCSc1cc(cc(c1O)C)C 62a_100000038162_100011934984 [0,2,0,0,0,0|0,0,2]=4 4926 B13R1.123 C#CCSc1cc(cc(c1O)C)Cl 62a_100000038162_100012343667 [0,2,0,0,0,0|0,0,2]=4 4927 B13R1.123 C#CCSc1cc(cc(c1O)C)N 62a_100000038162_100010064301 [0,2,0,0,0,0|0,0,2]=4 4928 B13R1.123 C=CCNc1cc(cc(c1Br)Cl)Cl 34a_200010220950_100015514636 [0,2,0,0,0,0|2,0,0]=4 4929 B13R1.123 C=CCNc1cc(cc(c1Br)Cl)Cl 7a_200010220950_100015514636 [0,2,0,0,0,0|2,0,0]=4 4930 B13R1.123 C=CCNc1cc(cc(c1Br)F)F 34a_100000716482_100015514636 [0,2,0,0,0,0|2,0,0]=4 4931 B13R1.123 C=CCNc1cc(cc(c1Br)F)F 7a_100000716482_100015514636 [0,2,0,0,0,0|2,0,0]=4 4932 B13R1.123 C=CCNc1cc(cc(c1C)Br)Br 34a_100010206801_100015514636 [0,2,0,0,0,0|2,0,0]=4 4933 B13R1.123 C=CCNc1cc(cc(c1C)Br)Br 7a_100010206801_100015514636 [0,2,0,0,0,0|2,0,0]=4 4934 B13R1.123 C=CCNc1cc(cc(c1C)Br)C 2230a_102495365385_100000210623 [0,2,0,0,0,0|2,0,0]=4 4935 B13R1.123 C=CCNc1cc(cc(c1C)Br)C 34a_102495365385_100015514636 [0,2,0,0,0,0|2,0,0]=4 4936 B13R1.123 C=CCNc1cc(cc(c1C)Br)C 7a_102495365385_100015514636 [0,2,0,0,0,0|2,0,0]=4 4937 B13R1.123 C=CCNc1cc(cc(c1C)Br)Cl 34a_100010063005_100015514636 [0,2,0,0,0,0|2,0,0]=4 4938 B13R1.123 C=CCNc1cc(cc(c1C)Br)Cl 7a_100010063005_100015514636 [0,2,0,0,0,0|2,0,0]=4 4939 B13R1.123 C=CCNc1cc(cc(c1C)Br)F 34a_100009814351_100015514636 [0,2,0,0,0,0|2,0,0]=4 4940 B13R1.123 C=CCNc1cc(cc(c1C)Br)F 7a_100009814351_100015514636 [0,2,0,0,0,0|2,0,0]=4 4941 B13R1.123 C=CCNc1cc(cc(c1C)C)C 2230a_100000035412_100000210623 [0,2,0,0,0,0|1,0,0]=3 4942 B13R1.123 C=CCNc1cc(cc(c1C)C)C 34a_100000035412_100015514636 [0,2,0,0,0,0|1,0,0]=3 4943 B13R1.123 C=CCNc1cc(cc(c1C)C)C 7a_100000035412_100015514636 [0,2,0,0,0,0|1,0,0]=3 4944 B13R1.123 C=CCNc1cc(cc(c1C)Cl)Cl 34a_200009956477_100015514636 [0,2,0,0,0,0|2,0,0]=4 4945 B13R1.123 C=CCNc1cc(cc(c1C)Cl)Cl 7a_200009956477_100015514636 [0,2,0,0,0,0|2,0,0]=4 4946 B13R1.123 C=CCNc1cc(cc(c1C)F)Br 34a_100009813729_100015514636 [0,2,0,0,0,0|2,0,0]=4 4947 B13R1.123 C=CCNc1cc(cc(c1C)F)Br 7a_100009813729_100015514636 [0,2,0,0,0,0|2,0,0]=4 4948 B13R1.123 C=CCNc1cc(cc(c1C)I)Cl 34a_200000050010_100015514636 [0,2,0,0,0,0|2,0,0]=4 4949 B13R1.123 C=CCNc1cc(cc(c1C)I)Cl 7a_200000050010_100015514636 [0,2,0,0,0,0|2,0,0]=4 4950 B13R1.123 C=CCNc1cc(cc(c1Cl)Cl)Cl 34a_106623411496_100015514636 [0,2,0,0,0,0|2,0,0]=4 4951 B13R1.123 C=CCNc1cc(cc(c1Cl)Cl)Cl 7a_106623411496_100015514636 [0,2,0,0,0,0|2,0,0]=4 4952 B13R1.123 C=CCNc1cc(cc(c1Cl)F)F 34a_100000037168_100015514636 [0,2,0,0,0,0|2,0,0]=4 4953 B13R1.123 C=CCNc1cc(cc(c1Cl)F)F 7a_100000037168_100015514636 [0,2,0,0,0,0|2,0,0]=4 4954 B13R1.123 C=CCNc1cc(cc(c1F)Br)C 2230a_100010589139_100000210623 [0,2,0,0,0,0|2,0,0]=4 4955 B13R1.123 C=CCNc1cc(cc(c1F)Br)C 34a_100010589139_100015514636 [0,2,0,0,0,0|2,0,0]=4 4956 B13R1.123 C=CCNc1cc(cc(c1F)Br)C 7a_100010589139_100015514636 [0,2,0,0,0,0|2,0,0]=4 4957 B13R1.123 C=CCNc1cc(cc(c1F)Br)Cl 34a_100010110407_100015514636 [0,2,0,0,0,0|2,0,0]=4 4958 B13R1.123 C=CCNc1cc(cc(c1F)Br)Cl 7a_100010110407_100015514636 [0,2,0,0,0,0|2,0,0]=4 4959 B13R1.123 C=CCNc1cc(cc(c1F)Br)F 34a_100000722353_100015514636 [0,2,0,0,0,0|2,0,0]=4 4960 B13R1.123 C=CCNc1cc(cc(c1F)Br)F 7a_100000722353_100015514636 [0,2,0,0,0,0|2,0,0]=4 4961 B13R1.123 C=CCNc1cc(cc(c1F)C)Br 34a_100010381932_100015514636 [0,2,0,0,0,0|1,0,0]=3 4962 B13R1.123 C=CCNc1cc(cc(c1F)C)Br 7a_100010381932_100015514636 [0,2,0,0,0,0|1,0,0]=3 4963 B13R1.123 C=CCNc1cc(cc(c1F)Cl)Cl 34a_100010713094_100015514636 [0,2,0,0,0,0|2,0,0]=4 4964 B13R1.123 C=CCNc1cc(cc(c1F)Cl)Cl 7a_100010713094_100015514636 [0,2,0,0,0,0|2,0,0]=4 4965 B13R1.123 C=CCNc1cc(cc(c1F)F)F 34a_100000037171_100015514636 [0,2,0,0,0,0|2,0,0]=4 4966 B13R1.123 C=CCNc1cc(cc(c1F)F)F 7a_100000037171_100015514636 [0,2,0,0,0,0|2,0,0]=4 4967 B13R1.123 C=CCNc1cc(cc(c1I)Br)F 34a_200010740111_100015514636 [0,2,0,0,0,0|2,0,0]=4 4968 B13R1.123 C=CCNc1cc(cc(c1I)C)Cl 34a_100000698757_100015514636 [0,2,0,0,0,0|1,0,0]=3 4969 B13R1.123 C=CCNc1cc(cc(c1I)C)Cl 7a_100000698757_100015514636 [0,2,0,0,0,0|1,0,0]=3 4970 B13R1.123 C=CCNc1cc(cc(c1I)F)C 34a_100021129147_100015514636 [0,2,0,0,0,0|2,0,0]=4 4971 B13R1.123 C=CCNc1cc(cc(c1I)F)C 7a_100021129147_100015514636 [0,2,0,0,0,0|2,0,0]=4 4972 B13R1.123 C=CCNc1cc(cc(c1I)F)Cl 34a_200021297760_100015514636 [0,2,0,0,0,0|2,0,0]=4 4973 B13R1.123 C=CCNc1cc(cc(c1I)F)Cl 7a_200021297760_100015514636 [0,2,0,0,0,0|2,0,0]=4 4974 B13R1.123 C=CCNc1cc(cc(c1I)F)F 34a_100016149863_100015514636 [0,2,0,0,0,0|2,0,0]=4 4975 B13R1.123 C=CCNc1cc(cc(c1I)F)F 7a_100016149863_100015514636 [0,2,0,0,0,0|2,0,0]=4 4976 B13R1.123 C=CCNc1cc(cc(c1O)Br)Br 34a_100010781877_100015514636 [0,2,0,0,0,0|1,0,0]=3 4977 B13R1.123 C=CCNc1cc(cc(c1O)Br)Cl 34a_106741647128_100015514636 [0,2,0,0,0,0|1,0,0]=3 4978 B13R1.123 C=CCNc1cc(cc(c1O)Br)F 34a_200011217456_100015514636 [0,2,0,0,0,0|1,0,0]=3 4979 B13R1.123 C=CCNc1cc(cc(c1O)C)Br 34a_100011825904_100015514636 [0,2,0,0,0,0|0,0,0]=2 4980 B13R1.123 C=CCNc1cc(cc(c1O)C)Br 7a_100011825904_100015514636 [0,2,0,0,0,0|0,0,0]=2 4981 B13R1.123 C=CCNc1cc(cc(c1O)C)C 34a_100011216242_100015514636 [0,2,0,0,0,0|0,0,0]=2 4982 B13R1.123 C=CCNc1cc(cc(c1O)C)C 7a_100011216242_100015514636 [0,2,0,0,0,0|0,0,0]=2 4983 B13R1.123 C=CCNc1cc(cc(c1O)C)F 34a_100000130126_100015514636 [0,2,0,0,0,0|0,0,0]=2 4984 B13R1.123 C=CCNc1cc(cc(c1O)C)F 7a_100000130126_100015514636 [0,2,0,0,0,0|0,0,0]=2 4985 B13R1.123 C=CCNc1cc(cc(c1O)Cl)Br 34a_100000694353_100015514636 [0,2,0,0,0,0|1,0,0]=3 4986 B13R1.123 C=CCNc1cc(cc(c1O)Cl)Cl 34a_100000695819_100015514636 [0,2,0,0,0,0|1,0,0]=3 4987 B13R1.123 C=CCNc1cc(cc(c1O)F)Br 34a_100011217383_100015514636 [0,2,0,0,0,0|1,0,0]=3 4988 B13R1.123 C=CCNc1cc(cc(c1O)F)Br 7a_100011217383_100015514636 [0,2,0,0,0,0|1,0,0]=3 4989 B13R1.123 C=CCNc1cc(cc(c1O)F)F 34a_100015205836_100015514636 [0,2,0,0,0,0|1,0,0]=3 4990 B13R1.123 C=CCOc1cc(=O)[nH]c(c1C)C 34a_200000102741_100015514636 [0,2,0,0,0,0|2,0,0]=4 4991 B13R1.123 C=CCOc1cc(=O)[nH]c(c1C)C 7a_200000102741_100015514636 [0,2,0,0,0,0|2,0,0]=4 4992 B13R1.123 C=CCOc1cc(cc(c1Br)C)C 34a_100010342985_100015514636 [0,2,0,0,0,0|1,0,0]=3 4993 B13R1.123 C=CCOc1cc(cc(c1Br)C)C 7a_100010342985_100015514636 [0,2,0,0,0,0|1,0,0]=3 4994 B13R1.123 C=CCOc1cc(cc(c1Br)F)Cl 34a_100015539415_100015514636 [0,2,0,0,0,0|2,0,0]=4 4995 B13R1.123 C=CCOc1cc(cc(c1Br)F)Cl 7a_100015539415_100015514636 [0,2,0,0,0,0|2,0,0]=4 4996 B13R1.123 C=CCOc1cc(cc(c1Br)F)F 34a_100009815984_100015514636 [0,2,0,0,0,0|2,0,0]=4 4997 B13R1.123 C=CCOc1cc(cc(c1Br)F)F 7a_100009815984_100015514636 [0,2,0,0,0,0|2,0,0]=4 4998 B13R1.123 C=CCOc1cc(cc(c1C)C)C 34a_100000230004_100015514636 [0,2,0,0,0,0|1,0,0]=3 4999 B13R1.123 C=CCOc1cc(cc(c1C)C)C 7a_100000230004_100015514636 [0,2,0,0,0,0|1,0,0]=3 5000 B13R1.123 C=CCOc1cc(cc(c1Cl)C)C 34a_100000094344_100015514636 [0,2,0,0,0,0|1,0,0]=3 5001 B13R1.123 C=CCOc1cc(cc(c1Cl)C)C 7a_100000094344_100015514636 [0,2,0,0,0,0|1,0,0]=3 5002 B13R1.123 C=CCOc1cc(cc(c1Cl)Cl)N 34a_100015839415_100015514636 [0,2,0,0,0,0|2,0,0]=4 5003 B13R1.123 C=CCOc1cc(cc(c1Cl)Cl)N 7a_100015839415_100015514636 [0,2,0,0,0,0|2,0,0]=4 5004 B13R1.123 C=CCOc1cc(cc(c1Cl)F)Br 34a_100010981968_100015514636 [0,2,0,0,0,0|2,0,0]=4 5005 B13R1.123 C=CCOc1cc(cc(c1Cl)F)Br 7a_100010981968_100015514636 [0,2,0,0,0,0|2,0,0]=4 5006 B13R1.123 C=CCOc1cc(cc(c1Cl)F)F 34a_200000037661_100015514636 [0,2,0,0,0,0|2,0,0]=4 5007 B13R1.123 C=CCOc1cc(cc(c1Cl)F)F 7a_200000037661_100015514636 [0,2,0,0,0,0|2,0,0]=4 5008 B13R1.123 C=CCOc1cc(cc(c1F)Cl)Br 34a_100010077842_100015514636 [0,2,0,0,0,0|2,0,0]=4 5009 B13R1.123 C=CCOc1cc(cc(c1F)Cl)Br 7a_100010077842_100015514636 [0,2,0,0,0,0|2,0,0]=4 5010 B13R1.123 C=CCOc1cc(cc(c1F)F)Br 34a_100000709865_100015514636 [0,2,0,0,0,0|2,0,0]=4 5011 B13R1.123 C=CCOc1cc(cc(c1F)F)Br 7a_100000709865_100015514636 [0,2,0,0,0,0|2,0,0]=4 5012 B13R1.123 C=CCOc1cc(cc(c1F)F)F 34a_200011215507_100015514636 [0,2,0,0,0,0|2,0,0]=4 5013 B13R1.123 C=CCOc1cc(cc(c1F)F)F 7a_200011215507_100015514636 [0,2,0,0,0,0|2,0,0]=4 5014 B13R1.123 C=CCOc1cc(cc(c1I)C)Cl 34a_100010254216_100015514636 [0,2,0,0,0,0|1,0,0]=3 5015 B13R1.123 C=CCOc1cc(cc(c1I)C)Cl 7a_100010254216_100015514636 [0,2,0,0,0,0|1,0,0]=3 5016 B13R1.123 C=CCOc1cc(cc(c1N)Br)Cl 34a_100015696055_100015514636 [0,2,0,0,0,0|2,0,0]=4 5017 B13R1.123 C=CCOc1cc(cc(c1N)Br)Cl 7a_100015696055_100015514636 [0,2,0,0,0,0|2,0,0]=4 5018 B13R1.123 C=CCOc1cc(cc(c1N)C)Br 34a_100010371313_100015514636 [0,2,0,0,0,0|1,0,0]=3 5019 B13R1.123 C=CCOc1cc(cc(c1N)C)Br 7a_100010371313_100015514636 [0,2,0,0,0,0|1,0,0]=3 5020 B13R1.123 C=CCOc1cc(cc(c1N)Cl)C 34a_100015906060_100015514636 [0,2,0,0,0,0|2,0,0]=4 5021 B13R1.123 C=CCOc1cc(cc(c1N)Cl)C 7a_100015906060_100015514636 [0,2,0,0,0,0|2,0,0]=4 5022 B13R1.123 C=CCOc1cc(cc(c1N)F)Br 34a_100015475841_100015514636 [0,2,0,0,0,0|2,0,0]=4 5023 B13R1.123 C=CCOc1cc(cc(c1N)F)Br 7a_100015475841_100015514636 [0,2,0,0,0,0|2,0,0]=4 5024 B13R1.123 C=CCOc1cc(cc(c1N)F)Cl 34a_100010883250_100015514636 [0,2,0,0,0,0|2,0,0]=4 5025 B13R1.123 C=CCOc1cc(cc(c1N)F)Cl 7a_100010883250_100015514636 [0,2,0,0,0,0|2,0,0]=4 5026 B13R1.123 C=CCOc1cc(cc(c1N)F)F 34a_100011217947_100015514636 [0,2,0,0,0,0|2,0,0]=4 5027 B13R1.123 C=CCOc1cc(cc(c1N)F)F 7a_100011217947_100015514636 [0,2,0,0,0,0|2,0,0]=4 5028 B13R1.123 C=CCSc1cc(cc(c1Br)F)F 62a_100000210623_100010256416 [0,2,0,0,0,0|2,0,0]=4 5029 B13R1.123 C=CCSc1cc(cc(c1Br)F)F 62a_100010256416_100000210623 [0,2,0,0,0,0|2,0,0]=4 5030 B13R1.123 C=CCSc1cc(cc(c1C)C)N 62a_100000210623_100010368239 [0,2,0,0,0,0|1,0,0]=3 5031 B13R1.123 C=CCSc1cc(cc(c1C)C)N 62a_100010368239_100000210623 [0,2,0,0,0,0|1,0,0]=3 5032 B13R1.123 C=CCSc1cc(cc(c1C)C)O 62a_100000210623_100010068915 [0,2,0,0,0,0|1,0,0]=3 5033 B13R1.123 C=CCSc1cc(cc(c1C)C)O 62a_100010068915_100000210623 [0,2,0,0,0,0|1,0,0]=3 5034 B13R1.123 C=CCSc1cc(cc(c1C)F)C 62a_100000210623_100015473476 [0,2,0,0,0,0|2,0,0]=4 5035 B13R1.123 C=CCSc1cc(cc(c1C)F)C 62a_100015473476_100000210623 [0,2,0,0,0,0|2,0,0]=4 5036 B13R1.123 C=CCSc1cc(cc(c1C)F)F 62a_100000210623_100015579730 [0,2,0,0,0,0|2,0,0]=4 5037 B13R1.123 C=CCSc1cc(cc(c1C)F)F 62a_100015579730_100000210623 [0,2,0,0,0,0|2,0,0]=4 5038 B13R1.123 C=CCSc1cc(cc(c1C)F)N 62a_100000210623_100010254531 [0,2,0,0,0,0|2,0,0]=4 5039 B13R1.123 C=CCSc1cc(cc(c1C)F)N 62a_100010254531_100000210623 [0,2,0,0,0,0|2,0,0]=4 5040 B13R1.123 C=CCSc1cc(cc(c1C)N)C 62a_100000210623_102495365385 [0,2,0,0,0,0|2,0,0]=4 5041 B13R1.123 C=CCSc1cc(cc(c1C)N)C 62a_102495365385_100000210623 [0,2,0,0,0,0|2,0,0]=4 5042 B13R1.123 C=CCSc1cc(cc(c1C)N)Cl 62a_100000210623_200000050010 [0,2,0,0,0,0|2,0,0]=4 5043 B13R1.123 C=CCSc1cc(cc(c1C)N)Cl 62a_200000050010_100000210623 [0,2,0,0,0,0|2,0,0]=4 5044 B13R1.123 C=CCSc1cc(cc(c1C)N)F 62a_100000210623_100009814351 [0,2,0,0,0,0|2,0,0]=4 5045 B13R1.123 C=CCSc1cc(cc(c1C)N)F 62a_100009814351_100000210623 [0,2,0,0,0,0|2,0,0]=4 5046 B13R1.123 C=CCSc1cc(cc(c1Cl)Cl)Cl 62a_100000210623_200000042848 [0,2,0,0,0,0|2,0,0]=4 5047 B13R1.123 C=CCSc1cc(cc(c1Cl)Cl)Cl 62a_200000042848_100000210623 [0,2,0,0,0,0|2,0,0]=4 5048 B13R1.123 C=CCSc1cc(cc(c1F)C)C 62a_100000210623_200010204574 [0,2,0,0,0,0|1,0,0]=3 5049 B13R1.123 C=CCSc1cc(cc(c1F)C)C 62a_200010204574_100000210623 [0,2,0,0,0,0|1,0,0]=3 5050 B13R1.123 C=CCSc1cc(cc(c1F)C)F 62a_100000210623_100010291795 [0,2,0,0,0,0|1,0,0]=3 5051 B13R1.123 C=CCSc1cc(cc(c1F)C)F 62a_100010291795_100000210623 [0,2,0,0,0,0|1,0,0]=3 5052 B13R1.123 C=CCSc1cc(cc(c1F)Cl)Br 62a_100000210623_100010270166 [0,2,0,0,0,0|2,0,0]=4 5053 B13R1.123 C=CCSc1cc(cc(c1F)Cl)Br 62a_100010270166_100000210623 [0,2,0,0,0,0|2,0,0]=4 5054 B13R1.123 C=CCSc1cc(cc(c1F)F)C 62a_100000210623_100010141297 [0,2,0,0,0,0|2,0,0]=4 5055 B13R1.123 C=CCSc1cc(cc(c1F)F)C 62a_100010141297_100000210623 [0,2,0,0,0,0|2,0,0]=4 5056 B13R1.123 C=CCSc1cc(cc(c1F)F)F 62a_100000210623_100000724850 [0,2,0,0,0,0|2,0,0]=4 5057 B13R1.123 C=CCSc1cc(cc(c1F)F)F 62a_100000724850_100000210623 [0,2,0,0,0,0|2,0,0]=4 5058 B13R1.123 C=CCSc1cc(cc(c1F)F)N 62a_100000210623_100009816004 [0,2,0,0,0,0|2,0,0]=4 5059 B13R1.123 C=CCSc1cc(cc(c1F)F)N 62a_100009816004_100000210623 [0,2,0,0,0,0|2,0,0]=4 5060 B13R1.123 C=CCSc1cc(cc(c1F)N)C 62a_100000210623_100010589139 [0,2,0,0,0,0|2,0,0]=4 5061 B13R1.123 C=CCSc1cc(cc(c1F)N)C 62a_100010589139_100000210623 [0,2,0,0,0,0|2,0,0]=4 5062 B13R1.123 C=CCSc1cc(cc(c1F)N)F 62a_100000210623_100000722353 [0,2,0,0,0,0|2,0,0]=4 5063 B13R1.123 C=CCSc1cc(cc(c1F)N)F 62a_100000722353_100000210623 [0,2,0,0,0,0|2,0,0]=4 5064 B13R1.123 C=CCSc1cc(cc(c1N)Br)Cl 62a_100000210623_200012970264 [0,2,0,0,0,0|2,0,0]=4 5065 B13R1.123 C=CCSc1cc(cc(c1N)Br)Cl 62a_200012970264_100000210623 [0,2,0,0,0,0|2,0,0]=4 5066 B13R1.123 C=CCSc1cc(cc(c1N)C)Br 62a_100000210623_200000690823 [0,2,0,0,0,0|1,0,0]=3 5067 B13R1.123 C=CCSc1cc(cc(c1N)C)Br 62a_200000690823_100000210623 [0,2,0,0,0,0|1,0,0]=3 5068 B13R1.123 C=CCSc1cc(cc(c1N)C)C 62a_100000210623_100000688863 [0,2,0,0,0,0|1,0,0]=3 5069 B13R1.123 C=CCSc1cc(cc(c1N)C)C 62a_100000688863_100000210623 [0,2,0,0,0,0|1,0,0]=3 5070 B13R1.123 C=CCSc1cc(cc(c1N)C)Cl 62a_100000210623_100012344046 [0,2,0,0,0,0|1,0,0]=3 5071 B13R1.123 C=CCSc1cc(cc(c1N)C)Cl 62a_100012344046_100000210623 [0,2,0,0,0,0|1,0,0]=3 5072 B13R1.123 C=CCSc1cc(cc(c1N)C)F 62a_100000210623_100011216670 [0,2,0,0,0,0|1,0,0]=3 5073 B13R1.123 C=CCSc1cc(cc(c1N)C)F 62a_100011216670_100000210623 [0,2,0,0,0,0|1,0,0]=3 5074 B13R1.123 C=CCSc1cc(cc(c1N)Cl)Cl 62a_100000210623_100011216899 [0,2,0,0,0,0|2,0,0]=4 5075 B13R1.123 C=CCSc1cc(cc(c1N)Cl)Cl 62a_100011216899_100000210623 [0,2,0,0,0,0|2,0,0]=4 5076 B13R1.123 C=CCSc1cc(cc(c1N)F)Br 62a_100000210623_100012970276 [0,2,0,0,0,0|2,0,0]=4 5077 B13R1.123 C=CCSc1cc(cc(c1N)F)Br 62a_100012970276_100000210623 [0,2,0,0,0,0|2,0,0]=4 5078 B13R1.123 C=CCSc1cc(cc(c1N)F)C 62a_100000210623_100012353694 [0,2,0,0,0,0|2,0,0]=4 5079 B13R1.123 C=CCSc1cc(cc(c1N)F)C 62a_100012353694_100000210623 [0,2,0,0,0,0|2,0,0]=4 5080 B13R1.123 C=CCSc1cc(cc(c1N)F)Cl 62a_100000210623_100011214900 [0,2,0,0,0,0|2,0,0]=4 5081 B13R1.123 C=CCSc1cc(cc(c1N)F)Cl 62a_100011214900_100000210623 [0,2,0,0,0,0|2,0,0]=4 5082 B13R1.123 C=CCSc1cc(cc(c1N)F)F 62a_100000210623_100000211602 [0,2,0,0,0,0|2,0,0]=4 5083 B13R1.123 C=CCSc1cc(cc(c1N)F)F 62a_100000211602_100000210623 [0,2,0,0,0,0|2,0,0]=4 5084 B13R1.123 C=CCSc1cc(cc(c1N)N)C 62a_100000210623_100012348275 [0,2,0,0,0,0|2,0,0]=4 5085 B13R1.123 C=CCSc1cc(cc(c1N)N)C 62a_100012348275_100000210623 [0,2,0,0,0,0|2,0,0]=4 5086 B13R1.123 C=CCSc1cc(cc(c1N)N)F 62a_100000210623_100011934818 [0,2,0,0,0,0|2,0,0]=4 5087 B13R1.123 C=CCSc1cc(cc(c1N)N)F 62a_100011934818_100000210623 [0,2,0,0,0,0|2,0,0]=4 5088 B13R1.123 C=CCSc1cc(cc(c1O)Br)F 62a_100000210623_200013085147 [0,2,0,0,0,0|1,0,0]=3 5089 B13R1.123 C=CCSc1cc(cc(c1O)Br)F 62a_200013085147_100000210623 [0,2,0,0,0,0|1,0,0]=3 5090 B13R1.123 C=CCSc1cc(cc(c1O)C)C 62a_100000210623_100011934984 [0,2,0,0,0,0|0,0,0]=2 5091 B13R1.123 C=CCSc1cc(cc(c1O)C)C 62a_100011934984_100000210623 [0,2,0,0,0,0|0,0,0]=2 5092 B13R1.123 C=CCSc1cc(cc(c1O)C)Cl 62a_100000210623_100012343667 [0,2,0,0,0,0|0,0,0]=2 5093 B13R1.123 C=CCSc1cc(cc(c1O)C)Cl 62a_100012343667_100000210623 [0,2,0,0,0,0|0,0,0]=2 5094 B13R1.123 C=CCSc1cc(cc(c1O)C)N 62a_100000210623_100010064301 [0,2,0,0,0,0|0,0,0]=2 5095 B13R1.123 C=CCSc1cc(cc(c1O)C)N 62a_100010064301_100000210623 [0,2,0,0,0,0|0,0,0]=2 5096 B13R1.123 C=CCSc1cc(cc(c1O)Cl)Cl 62a_100000210623_200012339341 [0,2,0,0,0,0|1,0,0]=3 5097 B13R1.123 C=CCSc1cc(cc(c1O)Cl)Cl 62a_200012339341_100000210623 [0,2,0,0,0,0|1,0,0]=3 5098 B13R1.123 C=CCSc1cc(cc(c1O)F)Br 62a_100000210623_100013354677 [0,2,0,0,0,0|1,0,0]=3 5099 B13R1.123 C=CCSc1cc(cc(c1O)F)Br 62a_100013354677_100000210623 [0,2,0,0,0,0|1,0,0]=3 5100 B13R1.123 C=CCSc1cc(cc(c1O)F)C 62a_100000210623_200135191068 [0,2,0,0,0,0|1,0,0]=3 5101 B13R1.123 C=CCSc1cc(cc(c1O)F)C 62a_200135191068_100000210623 [0,2,0,0,0,0|1,0,0]=3 5102 B13R1.123 C=CCSc1cc(cc(c1O)F)F 62a_100000210623_100000688693 [0,2,0,0,0,0|1,0,0]=3 5103 B13R1.123 C=CCSc1cc(cc(c1O)F)F 62a_100000688693_100000210623 [0,2,0,0,0,0|1,0,0]=3 5104 B13R1.123 C=CCSc1cc(cc(c1O)N)Br 62a_100000210623_100016071998 [0,2,0,0,0,0|1,0,0]=3 5105 B13R1.123 C=CCSc1cc(cc(c1O)N)Br 62a_100016071998_100000210623 [0,2,0,0,0,0|1,0,0]=3 5106 B13R1.123 C=CCSc1cc(cc(c1O)N)F 62a_100000210623_200011217456 [0,2,0,0,0,0|1,0,0]=3 5107 B13R1.123 C=CCSc1cc(cc(c1O)N)F 62a_200011217456_100000210623 [0,2,0,0,0,0|1,0,0]=3 5108 B13R1.123 C=CCSc1cc(cn(c1=O)C)C 62a_100000210623_100011068373 [0,2,0,0,0,0|1,0,1]=4 5109 B13R1.123 C=CCSc1cc(cn(c1=O)C)C 62a_100011068373_100000210623 [0,2,0,0,0,0|1,0,1]=4 5110 B13R1.123 C=CCSc1nc(cc(c1N)C)C 62a_100000210623_100009816701 [0,2,0,0,0,0|2,0,0]=4 5111 B13R1.123 C=CCSc1nc(cc(c1N)C)C 62a_100009816701_100000210623 [0,2,0,0,0,0|2,0,0]=4 5112 B13R1.123 C=CCSc1nc(cc(c1N)C)Cl 62a_100000210623_100021194808 [0,2,0,0,0,0|2,0,0]=4 5113 B13R1.123 C=CCSc1nc(cc(c1N)C)Cl 62a_100021194808_100000210623 [0,2,0,0,0,0|2,0,0]=4 5114 B13R1.123 CCCCc1cc(cc(c1O)C)C 271570a_100020621405_100011934984 [0,2,0,0,0,0|0,0,2]=4 5115 B13R1.123 CCCCc1cc(cc(c1O)C)Cl 271570a_100020621405_100012343667 [0,2,0,0,0,0|0,0,2]=4 5116 B13R1.123 CCCCc1cc(cc(c1O)C)N 271570a_100020621405_100010064301 [0,2,0,0,0,0|0,0,2]=4 5117 B13R1.123 CCCNc1cc(cc(c1O)C)Br 34a_100011825904_100000210303 [0,2,0,0,0,0|0,0,2]=4 5118 B13R1.123 CCCNc1cc(cc(c1O)C)Br 7a_100011825904_100000210303 [0,2,0,0,0,0|0,0,2]=4 5119 B13R1.123 CCCNc1cc(cc(c1O)C)C 34a_100011216242_100000210303 [0,2,0,0,0,0|0,0,2]=4 5120 B13R1.123 CCCNc1cc(cc(c1O)C)C 7a_100011216242_100000210303 [0,2,0,0,0,0|0,0,2]=4 5121 B13R1.123 CCCNc1cc(cc(c1O)C)F 34a_100000130126_100000210303 [0,2,0,0,0,0|0,0,2]=4 5122 B13R1.123 CCCNc1cc(cc(c1O)C)F 7a_100000130126_100000210303 [0,2,0,0,0,0|0,0,2]=4 5123 B13R1.123 CCCSc1cc(cc(c1O)C)C 62a_100000210303_100011934984 [0,2,0,0,0,0|0,0,2]=4 5124 B13R1.123 CCCSc1cc(cc(c1O)C)C 62a_100011934984_100000210303 [0,2,0,0,0,0|0,0,2]=4 5125 B13R1.123 CCCSc1cc(cc(c1O)C)Cl 62a_100000210303_100012343667 [0,2,0,0,0,0|0,0,2]=4 5126 B13R1.123 CCCSc1cc(cc(c1O)C)Cl 62a_100012343667_100000210303 [0,2,0,0,0,0|0,0,2]=4 5127 B13R1.123 CCCSc1cc(cc(c1O)C)N 62a_100000210303_100010064301 [0,2,0,0,0,0|0,0,2]=4 5128 B13R1.123 CCCSc1cc(cc(c1O)C)N 62a_100010064301_100000210303 [0,2,0,0,0,0|0,0,2]=4 5129 B13R1.123 COCSc1cc(cc(c1O)C)C 62a_100000766300_100011934984 [0,2,0,0,0,0|1,0,1]=4 5130 B13R1.123 COCSc1cc(cc(c1O)C)C 62a_100011934984_100000766300 [0,2,0,0,0,0|1,0,1]=4 5131 B13R1.123 COCSc1cc(cc(c1O)C)Cl 62a_100000766300_100012343667 [0,2,0,0,0,0|1,0,1]=4 5132 B13R1.123 COCSc1cc(cc(c1O)C)Cl 62a_100012343667_100000766300 [0,2,0,0,0,0|1,0,1]=4 5133 B13R1.123 COCSc1cc(cc(c1O)C)N 62a_100000766300_100010064301 [0,2,0,0,0,0|1,0,1]=4 5134 B13R1.123 COCSc1cc(cc(c1O)C)N 62a_100010064301_100000766300 [0,2,0,0,0,0|1,0,1]=4 5135 B13R1.123 CSCNc1cc(cc(c1O)C)Br 34a_100011825904_100011218213 [0,2,0,0,0,0|1,0,1]=4 5136 B13R1.123 CSCNc1cc(cc(c1O)C)C 34a_100011216242_100011218213 [0,2,0,0,0,0|1,0,1]=4 5137 B13R1.123 CSCNc1cc(cc(c1O)C)F 34a_100000130126_100011218213 [0,2,0,0,0,0|1,0,1]=4 5138 B13R1.123 CSCSc1cc(cc(c1O)C)C 62a_100011218213_100011934984 [0,2,0,0,0,0|1,0,1]=4 5139 B13R1.123 CSCSc1cc(cc(c1O)C)C 62a_100011934984_100011218213 [0,2,0,0,0,0|1,0,1]=4 5140 B13R1.123 CSCSc1cc(cc(c1O)C)Cl 62a_100011218213_100012343667 [0,2,0,0,0,0|1,0,1]=4 5141 B13R1.123 CSCSc1cc(cc(c1O)C)Cl 62a_100012343667_100011218213 [0,2,0,0,0,0|1,0,1]=4 5142 B13R1.123 CSCSc1cc(cc(c1O)C)N 62a_100010064301_100011218213 [0,2,0,0,0,0|1,0,1]=4 5143 B13R1.123 CSCSc1cc(cc(c1O)C)N 62a_100011218213_100010064301 [0,2,0,0,0,0|1,0,1]=4 5144 B13R1.123 Cc1cc(c(c(c1)NCC#N)O)C 7a_100011216242_100011215382 [0,2,0,0,0,0|1,0,1]=4 5145 B13R1.123 Cc1cc(c(c(c1)NCC=O)C)C 2230a_100000035412_200015260668 [0,2,0,0,0,0|2,0,0]=4 5146 B13R1.123 Cc1cc(c(c(c1)NCC=O)C)C 34a_100000035412_200009817547 [0,2,0,0,0,0|2,0,0]=4 5147 B13R1.123 Cc1cc(c(c(c1)NCC=O)C)C 7a_100000035412_200015260668 [0,2,0,0,0,0|2,0,0]=4 5148 B13R1.123 Cc1cc(c(c(c1)NCC=O)O)C 34a_100011216242_200009817547 [0,2,0,0,0,0|1,0,0]=3 5149 B13R1.123 Cc1cc(c(c(c1)NCC=O)O)C 7a_100011216242_200015260668 [0,2,0,0,0,0|1,0,0]=3 5150 B13R1.123 Cc1cc(c(c(c1)NCCF)O)C 34a_100011216242_100011217306 [0,2,0,0,0,0|1,0,1]=4 5151 B13R1.123 Cc1cc(c(c(c1)NCCF)O)C 7a_100011216242_100011217306 [0,2,0,0,0,0|1,0,1]=4 5152 B13R1.123 Cc1cc(c(c(c1)NCCO)O)C 34a_100011216242_100000211926 [0,2,0,0,0,0|1,0,1]=4 5153 B13R1.123 Cc1cc(c(c(c1)NCCO)O)C 7a_100011216242_100000211926 [0,2,0,0,0,0|1,0,1]=4 5154 B13R1.123 Cc1cc(c(c(c1)OCC=O)Br)C 34a_100010342985_200009817547 [0,2,0,0,0,0|2,0,0]=4 5155 B13R1.123 Cc1cc(c(c(c1)OCC=O)Br)C 7a_100010342985_200015260668 [0,2,0,0,0,0|2,0,0]=4 5156 B13R1.123 Cc1cc(c(c(c1)OCC=O)C)C 34a_100000230004_200009817547 [0,2,0,0,0,0|2,0,0]=4 5157 B13R1.123 Cc1cc(c(c(c1)OCC=O)C)C 7a_100000230004_200015260668 [0,2,0,0,0,0|2,0,0]=4 5158 B13R1.123 Cc1cc(c(c(c1)OCC=O)Cl)C 34a_100000094344_200009817547 [0,2,0,0,0,0|2,0,0]=4 5159 B13R1.123 Cc1cc(c(c(c1)OCC=O)Cl)C 7a_100000094344_200015260668 [0,2,0,0,0,0|2,0,0]=4 5160 B13R1.123 Cc1cc(c(c(c1)SCC#N)O)C 62a_100011215382_100011934984 [0,2,0,0,0,0|1,0,1]=4 5161 B13R1.123 Cc1cc(c(c(c1)SCC#N)O)C 62a_100011934984_100011215382 [0,2,0,0,0,0|1,0,1]=4 5162 B13R1.123 Cc1cc(c(c(c1)SCC=O)F)C 62a_200010204574_200015260668 [0,2,0,0,0,0|2,0,0]=4 5163 B13R1.123 Cc1cc(c(c(c1)SCC=O)F)C 62a_200015260668_200010204574 [0,2,0,0,0,0|2,0,0]=4 5164 B13R1.123 Cc1cc(c(c(c1)SCC=O)N)C 62a_100000688863_200015260668 [0,2,0,0,0,0|2,0,0]=4 5165 B13R1.123 Cc1cc(c(c(c1)SCC=O)N)C 62a_200015260668_100000688863 [0,2,0,0,0,0|2,0,0]=4 5166 B13R1.123 Cc1cc(c(c(c1)SCC=O)O)C 62a_100011934984_200015260668 [0,2,0,0,0,0|1,0,0]=3 5167 B13R1.123 Cc1cc(c(c(c1)SCC=O)O)C 62a_200015260668_100011934984 [0,2,0,0,0,0|1,0,0]=3 5168 B13R1.123 Cc1cc(c(c(c1)SCC=O)O)F 62a_200015260668_200135191068 [0,2,0,0,0,0|2,0,0]=4 5169 B13R1.123 Cc1cc(c(c(c1)SCC=O)O)F 62a_200135191068_200015260668 [0,2,0,0,0,0|2,0,0]=4 5170 B13R1.123 Cc1cc(c(c(c1)SCCF)O)C 62a_100011217306_100011934984 [0,2,0,0,0,0|1,0,1]=4 5171 B13R1.123 Cc1cc(c(c(c1)SCCF)O)C 62a_100011934984_100011217306 [0,2,0,0,0,0|1,0,1]=4 5172 B13R1.123 Cc1cc(c(c(c1)SCCO)O)C 62a_100000211926_100011934984 [0,2,0,0,0,0|1,0,1]=4 5173 B13R1.123 Cc1cc(c(c(c1)SCCO)O)C 62a_100011934984_100000211926 [0,2,0,0,0,0|1,0,1]=4 5174 B13R1.123 Cc1cc(cc(c1C)SCC=O)N 62a_100010368239_200015260668 [0,2,0,0,0,0|2,0,0]=4 5175 B13R1.123 Cc1cc(cc(c1C)SCC=O)N 62a_200015260668_100010368239 [0,2,0,0,0,0|2,0,0]=4 5176 B13R1.123 Cc1cc(cc(c1C)SCC=O)O 62a_100010068915_200015260668 [0,2,0,0,0,0|2,0,0]=4 5177 B13R1.123 Cc1cc(cc(c1C)SCC=O)O 62a_200015260668_100010068915 [0,2,0,0,0,0|2,0,0]=4 5178 B13R1.123 Cc1cc(cc(c1F)NCC=O)Br 34a_100010381932_200009817547 [0,2,0,0,0,0|2,0,0]=4 5179 B13R1.123 Cc1cc(cc(c1F)NCC=O)Br 7a_100010381932_200015260668 [0,2,0,0,0,0|2,0,0]=4 5180 B13R1.123 Cc1cc(cc(c1F)SCC=O)F 62a_100010291795_200015260668 [0,2,0,0,0,0|2,0,0]=4 5181 B13R1.123 Cc1cc(cc(c1F)SCC=O)F 62a_200015260668_100010291795 [0,2,0,0,0,0|2,0,0]=4 5182 B13R1.123 Cc1cc(cc(c1I)NCC=O)Cl 34a_100000698757_200009817547 [0,2,0,0,0,0|2,0,0]=4 5183 B13R1.123 Cc1cc(cc(c1I)NCC=O)Cl 7a_100000698757_200015260668 [0,2,0,0,0,0|2,0,0]=4 5184 B13R1.123 Cc1cc(cc(c1I)OCC=O)Cl 34a_100010254216_200009817547 [0,2,0,0,0,0|2,0,0]=4 5185 B13R1.123 Cc1cc(cc(c1I)OCC=O)Cl 7a_100010254216_200015260668 [0,2,0,0,0,0|2,0,0]=4 5186 B13R1.123 Cc1cc(cc(c1N)OCC=O)Br 34a_100010371313_200009817547 [0,2,0,0,0,0|2,0,0]=4 5187 B13R1.123 Cc1cc(cc(c1N)OCC=O)Br 7a_100010371313_200015260668 [0,2,0,0,0,0|2,0,0]=4 5188 B13R1.123 Cc1cc(cc(c1N)SCC=O)Br 62a_200000690823_200015260668 [0,2,0,0,0,0|2,0,0]=4 5189 B13R1.123 Cc1cc(cc(c1N)SCC=O)Br 62a_200015260668_200000690823 [0,2,0,0,0,0|2,0,0]=4 5190 B13R1.123 Cc1cc(cc(c1N)SCC=O)Cl 62a_100012344046_200015260668 [0,2,0,0,0,0|2,0,0]=4 5191 B13R1.123 Cc1cc(cc(c1N)SCC=O)Cl 62a_200015260668_100012344046 [0,2,0,0,0,0|2,0,0]=4 5192 B13R1.123 Cc1cc(cc(c1N)SCC=O)F 62a_100011216670_200015260668 [0,2,0,0,0,0|2,0,0]=4 5193 B13R1.123 Cc1cc(cc(c1N)SCC=O)F 62a_200015260668_100011216670 [0,2,0,0,0,0|2,0,0]=4 5194 B13R1.123 Cc1cc(cc(c1O)NCC#N)Br 7a_100011825904_100011215382 [0,2,0,0,0,0|1,0,1]=4 5195 B13R1.123 Cc1cc(cc(c1O)NCC#N)F 7a_100000130126_100011215382 [0,2,0,0,0,0|1,0,1]=4 5196 B13R1.123 Cc1cc(cc(c1O)NCC=O)Br 34a_100011825904_200009817547 [0,2,0,0,0,0|1,0,0]=3 5197 B13R1.123 Cc1cc(cc(c1O)NCC=O)Br 7a_100011825904_200015260668 [0,2,0,0,0,0|1,0,0]=3 5198 B13R1.123 Cc1cc(cc(c1O)NCC=O)F 34a_100000130126_200009817547 [0,2,0,0,0,0|1,0,0]=3 5199 B13R1.123 Cc1cc(cc(c1O)NCC=O)F 7a_100000130126_200015260668 [0,2,0,0,0,0|1,0,0]=3 5200 B13R1.123 Cc1cc(cc(c1O)NCCF)Br 34a_100011825904_100011217306 [0,2,0,0,0,0|1,0,1]=4 5201 B13R1.123 Cc1cc(cc(c1O)NCCF)Br 7a_100011825904_100011217306 [0,2,0,0,0,0|1,0,1]=4 5202 B13R1.123 Cc1cc(cc(c1O)NCCF)F 34a_100000130126_100011217306 [0,2,0,0,0,0|1,0,1]=4 5203 B13R1.123 Cc1cc(cc(c1O)NCCF)F 7a_100000130126_100011217306 [0,2,0,0,0,0|1,0,1]=4 5204 B13R1.123 Cc1cc(cc(c1O)NCCO)Br 34a_100011825904_100000211926 [0,2,0,0,0,0|1,0,1]=4 5205 B13R1.123 Cc1cc(cc(c1O)NCCO)Br 7a_100011825904_100000211926 [0,2,0,0,0,0|1,0,1]=4 5206 B13R1.123 Cc1cc(cc(c1O)NCCO)F 34a_100000130126_100000211926 [0,2,0,0,0,0|1,0,1]=4 5207 B13R1.123 Cc1cc(cc(c1O)NCCO)F 7a_100000130126_100000211926 [0,2,0,0,0,0|1,0,1]=4 5208 B13R1.123 Cc1cc(cc(c1O)SCC#N)Cl 62a_100011215382_100012343667 [0,2,0,0,0,0|1,0,1]=4 5209 B13R1.123 Cc1cc(cc(c1O)SCC#N)Cl 62a_100012343667_100011215382 [0,2,0,0,0,0|1,0,1]=4 5210 B13R1.123 Cc1cc(cc(c1O)SCC#N)N 62a_100010064301_100011215382 [0,2,0,0,0,0|1,0,1]=4 5211 B13R1.123 Cc1cc(cc(c1O)SCC#N)N 62a_100011215382_100010064301 [0,2,0,0,0,0|1,0,1]=4 5212 B13R1.123 Cc1cc(cc(c1O)SCC=O)Cl 62a_100012343667_200015260668 [0,2,0,0,0,0|1,0,0]=3 5213 B13R1.123 Cc1cc(cc(c1O)SCC=O)Cl 62a_200015260668_100012343667 [0,2,0,0,0,0|1,0,0]=3 5214 B13R1.123 Cc1cc(cc(c1O)SCC=O)N 62a_100010064301_200015260668 [0,2,0,0,0,0|1,0,0]=3 5215 B13R1.123 Cc1cc(cc(c1O)SCC=O)N 62a_200015260668_100010064301 [0,2,0,0,0,0|1,0,0]=3 5216 B13R1.123 Cc1cc(cc(c1O)SCCF)Cl 62a_100011217306_100012343667 [0,2,0,0,0,0|1,0,1]=4 5217 B13R1.123 Cc1cc(cc(c1O)SCCF)Cl 62a_100012343667_100011217306 [0,2,0,0,0,0|1,0,1]=4 5218 B13R1.123 Cc1cc(cc(c1O)SCCF)N 62a_100010064301_100011217306 [0,2,0,0,0,0|1,0,1]=4 5219 B13R1.123 Cc1cc(cc(c1O)SCCF)N 62a_100011217306_100010064301 [0,2,0,0,0,0|1,0,1]=4 5220 B13R1.123 Cc1cc(cc(c1O)SCCO)Cl 62a_100000211926_100012343667 [0,2,0,0,0,0|1,0,1]=4 5221 B13R1.123 Cc1cc(cc(c1O)SCCO)Cl 62a_100012343667_100000211926 [0,2,0,0,0,0|1,0,1]=4 5222 B13R1.123 Cc1cc(cc(c1O)SCCO)N 62a_100000211926_100010064301 [0,2,0,0,0,0|1,0,1]=4 5223 B13R1.123 Cc1cc(cc(c1O)SCCO)N 62a_100010064301_100000211926 [0,2,0,0,0,0|1,0,1]=4 5224 B13R1.123 Nc1cc(cc(c1O)SCC=O)Br 62a_100016071998_200015260668 [0,2,0,0,0,0|2,0,0]=4 5225 B13R1.123 Nc1cc(cc(c1O)SCC=O)Br 62a_200015260668_100016071998 [0,2,0,0,0,0|2,0,0]=4 5226 B13R1.123 Nc1cc(cc(c1O)SCC=O)F 62a_200011217456_200015260668 [0,2,0,0,0,0|2,0,0]=4 5227 B13R1.123 Nc1cc(cc(c1O)SCC=O)F 62a_200015260668_200011217456 [0,2,0,0,0,0|2,0,0]=4 5228 B13R1.123 O=CCNc1cc(cc(c1O)Br)Br 34a_100010781877_200009817547 [0,2,0,0,0,0|2,0,0]=4 5229 B13R1.123 O=CCNc1cc(cc(c1O)Br)Cl 34a_106741647128_200009817547 [0,2,0,0,0,0|2,0,0]=4 5230 B13R1.123 O=CCNc1cc(cc(c1O)Br)F 34a_200011217456_200009817547 [0,2,0,0,0,0|2,0,0]=4 5231 B13R1.123 O=CCNc1cc(cc(c1O)Cl)Br 34a_100000694353_200009817547 [0,2,0,0,0,0|2,0,0]=4 5232 B13R1.123 O=CCNc1cc(cc(c1O)Cl)Cl 34a_100000695819_200009817547 [0,2,0,0,0,0|2,0,0]=4 5233 B13R1.123 O=CCNc1cc(cc(c1O)F)Br 34a_100011217383_200009817547 [0,2,0,0,0,0|2,0,0]=4 5234 B13R1.123 O=CCNc1cc(cc(c1O)F)Br 7a_100011217383_200015260668 [0,2,0,0,0,0|2,0,0]=4 5235 B13R1.123 O=CCNc1cc(cc(c1O)F)F 34a_100015205836_200009817547 [0,2,0,0,0,0|2,0,0]=4 5236 B13R1.123 O=CCSc1cc(cc(c1O)Br)F 62a_200013085147_200015260668 [0,2,0,0,0,0|2,0,0]=4 5237 B13R1.123 O=CCSc1cc(cc(c1O)Br)F 62a_200015260668_200013085147 [0,2,0,0,0,0|2,0,0]=4 5238 B13R1.123 O=CCSc1cc(cc(c1O)Cl)Cl 62a_200012339341_200015260668 [0,2,0,0,0,0|2,0,0]=4 5239 B13R1.123 O=CCSc1cc(cc(c1O)Cl)Cl 62a_200015260668_200012339341 [0,2,0,0,0,0|2,0,0]=4 5240 B13R1.123 O=CCSc1cc(cc(c1O)F)Br 62a_100013354677_200015260668 [0,2,0,0,0,0|2,0,0]=4 5241 B13R1.123 O=CCSc1cc(cc(c1O)F)Br 62a_200015260668_100013354677 [0,2,0,0,0,0|2,0,0]=4 5242 B13R1.123 O=CCSc1cc(cc(c1O)F)F 62a_100000688693_200015260668 [0,2,0,0,0,0|2,0,0]=4 5243 B13R1.123 O=CCSc1cc(cc(c1O)F)F 62a_200015260668_100000688693 [0,2,0,0,0,0|2,0,0]=4 5244 B13R1.150 C=C(C)CNc1cccc(c1Br)C 34a_100000684715_100000748629 [0,2,0,0,0,0|1,0,0]=3 5245 B13R1.150 C=C(C)CNc1cccc(c1Br)Cl 34a_100000687072_100000748629 [0,2,0,0,0,0|2,0,0]=4 5246 B13R1.150 C=C(C)CNc1cccc(c1Br)F 34a_100011934729_100000748629 [0,2,0,0,0,0|2,0,0]=4 5247 B13R1.150 C=C(C)CNc1cccc(c1Br)O 34a_100012183704_100000748629 [0,2,0,0,0,0|2,0,0]=4 5248 B13R1.150 C=C(C)CNc1cccc(c1Br)O 7a_100012183704_100000748629 [0,2,0,0,0,0|2,0,0]=4 5249 B13R1.150 C=C(C)CNc1cccc(c1C)Br 34a_100000750434_100000748629 [0,2,0,0,0,0|2,0,0]=4 5250 B13R1.150 C=C(C)CNc1cccc(c1C)C 2230a_100000210026_100000748629 [0,2,0,0,0,0|1,0,0]=3 5251 B13R1.150 C=C(C)CNc1cccc(c1C)C 34a_100000210026_100000748629 [0,2,0,0,0,0|1,0,0]=3 5252 B13R1.150 C=C(C)CNc1cccc(c1C)C 7a_100000210026_100000748629 [0,2,0,0,0,0|1,0,0]=3 5253 B13R1.150 C=C(C)CNc1cccc(c1C)Cl 2230a_100000210441_100000748629 [0,2,0,0,0,0|2,0,0]=4 5254 B13R1.150 C=C(C)CNc1cccc(c1C)Cl 34a_100000210441_100000748629 [0,2,0,0,0,0|2,0,0]=4 5255 B13R1.150 C=C(C)CNc1cccc(c1C)Cl 7a_100000210441_100000748629 [0,2,0,0,0,0|2,0,0]=4 5256 B13R1.150 C=C(C)CNc1cccc(c1C)F 34a_100000745574_100000748629 [0,2,0,0,0,0|2,0,0]=4 5257 B13R1.150 C=C(C)CNc1cccc(c1C)F 7a_100000745574_100000748629 [0,2,0,0,0,0|2,0,0]=4 5258 B13R1.150 C=C(C)CNc1cccc(c1C)I 34a_100000761887_100000748629 [0,2,0,0,0,0|2,0,0]=4 5259 B13R1.150 C=C(C)CNc1cccc(c1C)O 34a_100011216573_100000748629 [0,2,0,0,0,0|2,0,0]=4 5260 B13R1.150 C=C(C)CNc1cccc(c1C)O 7a_100011216573_100000748629 [0,2,0,0,0,0|2,0,0]=4 5261 B13R1.150 C=C(C)CNc1cccc(c1Cl)Br 34a_100000687075_100000748629 [0,2,0,0,0,0|2,0,0]=4 5262 B13R1.150 C=C(C)CNc1cccc(c1Cl)C 34a_100000765562_100000748629 [0,2,0,0,0,0|1,0,0]=3 5263 B13R1.150 C=C(C)CNc1cccc(c1Cl)C 7a_100000765562_100000748629 [0,2,0,0,0,0|1,0,0]=3 5264 B13R1.150 C=C(C)CNc1cccc(c1Cl)Cl 34a_100000185733_100000748629 [0,2,0,0,0,0|2,0,0]=4 5265 B13R1.150 C=C(C)CNc1cccc(c1Cl)F 34a_100000692321_100000748629 [0,2,0,0,0,0|2,0,0]=4 5266 B13R1.150 C=C(C)CNc1cccc(c1Cl)O 34a_100012002038_100000748629 [0,2,0,0,0,0|2,0,0]=4 5267 B13R1.150 C=C(C)CNc1cccc(c1Cl)O 7a_100012002038_100000748629 [0,2,0,0,0,0|2,0,0]=4 5268 B13R1.150 C=C(C)CNc1cccc(c1F)Br 2230a_100011935091_100000748629 [0,2,0,0,0,0|2,0,0]=4 5269 B13R1.150 C=C(C)CNc1cccc(c1F)Br 34a_100011935091_100000748629 [0,2,0,0,0,0|2,0,0]=4 5270 B13R1.150 C=C(C)CNc1cccc(c1F)C 2230a_100000697159_100000748629 [0,2,0,0,0,0|1,0,0]=3 5271 B13R1.150 C=C(C)CNc1cccc(c1F)C 34a_100000697159_100000748629 [0,2,0,0,0,0|1,0,0]=3 5272 B13R1.150 C=C(C)CNc1cccc(c1F)C 7a_100000697159_100000748629 [0,2,0,0,0,0|1,0,0]=3 5273 B13R1.150 C=C(C)CNc1cccc(c1F)Cl 2230a_100000199060_100000748629 [0,2,0,0,0,0|2,0,0]=4 5274 B13R1.150 C=C(C)CNc1cccc(c1F)Cl 34a_100000199060_100000748629 [0,2,0,0,0,0|2,0,0]=4 5275 B13R1.150 C=C(C)CNc1cccc(c1F)F 34a_100000743855_100000748629 [0,2,0,0,0,0|2,0,0]=4 5276 B13R1.150 C=C(C)CNc1cccc(c1I)Br 34a_100020590159_100000748629 [0,2,0,0,0,0|2,0,0]=4 5277 B13R1.150 C=C(C)CNc1cccc(c1I)C 34a_100000761888_100000748629 [0,2,0,0,0,0|1,0,0]=3 5278 B13R1.150 C=C(C)CNc1cccc(c1I)Cl 34a_100000049713_100000748629 [0,2,0,0,0,0|2,0,0]=4 5279 B13R1.150 C=C(C)CNc1cccc(c1I)F 34a_100000690935_100000748629 [0,2,0,0,0,0|2,0,0]=4 5280 B13R1.150 C=C(C)CNc1cccc(c1O)Br 34a_100011934915_100000748629 [0,2,0,0,0,0|1,0,0]=3 5281 B13R1.150 C=C(C)CNc1cccc(c1O)C 34a_100000756359_100000748629 [0,2,0,0,0,0|0,0,0]=2 5282 B13R1.150 C=C(C)CNc1cccc(c1O)Cl 34a_100000754742_100000748629 [0,2,0,0,0,0|1,0,0]=3 5283 B13R1.150 C=C(C)CNc1cccc(c1O)F 34a_100011934987_100000748629 [0,2,0,0,0,0|1,0,0]=3 5284 B13R1.150 C=C(C)CNc1ccnc(c1Cl)C 27a_100000765925_100000698670 [0,2,0,0,0,0|2,0,0]=4 5285 B13R1.150 C=C(C)CNc1ccnc(c1F)C 27a_100000765925_100009849794 [0,2,0,0,0,0|2,0,0]=4 5286 B13R1.150 C=C(C)COc1cccc(c1Br)Br 34a_100010187966_100000748629 [0,2,0,0,0,0|2,0,0]=4 5287 B13R1.150 C=C(C)COc1cccc(c1Br)Br 7a_100010187966_100000748629 [0,2,0,0,0,0|2,0,0]=4 5288 B13R1.150 C=C(C)COc1cccc(c1Br)C 34a_100000686692_100000748629 [0,2,0,0,0,0|1,0,0]=3 5289 B13R1.150 C=C(C)COc1cccc(c1Br)C 7a_100000686692_100000748629 [0,2,0,0,0,0|1,0,0]=3 5290 B13R1.150 C=C(C)COc1cccc(c1Br)Cl 34a_100012348804_100000748629 [0,2,0,0,0,0|2,0,0]=4 5291 B13R1.150 C=C(C)COc1cccc(c1Br)Cl 7a_100012348804_100000748629 [0,2,0,0,0,0|2,0,0]=4 5292 B13R1.150 C=C(C)COc1cccc(c1Br)F 34a_100009820682_100000748629 [0,2,0,0,0,0|2,0,0]=4 5293 B13R1.150 C=C(C)COc1cccc(c1Br)F 7a_100009820682_100000748629 [0,2,0,0,0,0|2,0,0]=4 5294 B13R1.150 C=C(C)COc1cccc(c1Br)I 34a_100010187914_100000748629 [0,2,0,0,0,0|2,0,0]=4 5295 B13R1.150 C=C(C)COc1cccc(c1Br)I 7a_100010187914_100000748629 [0,2,0,0,0,0|2,0,0]=4 5296 B13R1.150 C=C(C)COc1cccc(c1Br)N 34a_100012183704_100000748629 [0,2,0,0,0,0|2,0,0]=4 5297 B13R1.150 C=C(C)COc1cccc(c1Br)N 7a_100012183704_100000748629 [0,2,0,0,0,0|2,0,0]=4 5298 B13R1.150 C=C(C)COc1cccc(c1C)Br 34a_100012002258_100000748629 [0,2,0,0,0,0|2,0,0]=4 5299 B13R1.150 C=C(C)COc1cccc(c1C)Br 7a_100012002258_100000748629 [0,2,0,0,0,0|2,0,0]=4 5300 B13R1.150 C=C(C)COc1cccc(c1C)C 34a_100000185855_100000748629 [0,2,0,0,0,0|1,0,0]=3 5301 B13R1.150 C=C(C)COc1cccc(c1C)C 7a_100000185855_100000748629 [0,2,0,0,0,0|1,0,0]=3 5302 B13R1.150 C=C(C)COc1cccc(c1C)Cl 34a_100011265684_100000748629 [0,2,0,0,0,0|2,0,0]=4 5303 B13R1.150 C=C(C)COc1cccc(c1C)Cl 7a_100011265684_100000748629 [0,2,0,0,0,0|2,0,0]=4 5304 B13R1.150 C=C(C)COc1cccc(c1C)F 34a_100011217231_100000748629 [0,2,0,0,0,0|2,0,0]=4 5305 B13R1.150 C=C(C)COc1cccc(c1C)F 7a_100011217231_100000748629 [0,2,0,0,0,0|2,0,0]=4 5306 B13R1.150 C=C(C)COc1cccc(c1C)N 34a_100011216573_100000748629 [0,2,0,0,0,0|2,0,0]=4 5307 B13R1.150 C=C(C)COc1cccc(c1C)N 7a_100011216573_100000748629 [0,2,0,0,0,0|2,0,0]=4 5308 B13R1.150 C=C(C)COc1cccc(c1Cl)Br 34a_100010187913_100000748629 [0,2,0,0,0,0|2,0,0]=4 5309 B13R1.150 C=C(C)COc1cccc(c1Cl)Br 7a_100010187913_100000748629 [0,2,0,0,0,0|2,0,0]=4 5310 B13R1.150 C=C(C)COc1cccc(c1Cl)C 34a_100000695629_100000748629 [0,2,0,0,0,0|1,0,0]=3 5311 B13R1.150 C=C(C)COc1cccc(c1Cl)C 7a_100000695629_100000748629 [0,2,0,0,0,0|1,0,0]=3 5312 B13R1.150 C=C(C)COc1cccc(c1Cl)Cl 34a_100000211076_100000748629 [0,2,0,0,0,0|2,0,0]=4 5313 B13R1.150 C=C(C)COc1cccc(c1Cl)Cl 7a_100000211076_100000748629 [0,2,0,0,0,0|2,0,0]=4 5314 B13R1.150 C=C(C)COc1cccc(c1Cl)F 34a_100000087408_100000748629 [0,2,0,0,0,0|2,0,0]=4 5315 B13R1.150 C=C(C)COc1cccc(c1Cl)F 7a_100000087408_100000748629 [0,2,0,0,0,0|2,0,0]=4 5316 B13R1.150 C=C(C)COc1cccc(c1Cl)I 34a_100000049636_100000748629 [0,2,0,0,0,0|2,0,0]=4 5317 B13R1.150 C=C(C)COc1cccc(c1Cl)I 7a_100000049636_100000748629 [0,2,0,0,0,0|2,0,0]=4 5318 B13R1.150 C=C(C)COc1cccc(c1Cl)N 34a_100012002038_100000748629 [0,2,0,0,0,0|2,0,0]=4 5319 B13R1.150 C=C(C)COc1cccc(c1Cl)N 7a_100012002038_100000748629 [0,2,0,0,0,0|2,0,0]=4 5320 B13R1.150 C=C(C)COc1cccc(c1F)Br 34a_100009817021_100000748629 [0,2,0,0,0,0|2,0,0]=4 5321 B13R1.150 C=C(C)COc1cccc(c1F)Br 7a_100009817021_100000748629 [0,2,0,0,0,0|2,0,0]=4 5322 B13R1.150 C=C(C)COc1cccc(c1F)C 34a_100000751311_100000748629 [0,2,0,0,0,0|1,0,0]=3 5323 B13R1.150 C=C(C)COc1cccc(c1F)C 7a_100000751311_100000748629 [0,2,0,0,0,0|1,0,0]=3 5324 B13R1.150 C=C(C)COc1cccc(c1F)Cl 34a_100000687438_100000748629 [0,2,0,0,0,0|2,0,0]=4 5325 B13R1.150 C=C(C)COc1cccc(c1F)Cl 7a_100000687438_100000748629 [0,2,0,0,0,0|2,0,0]=4 5326 B13R1.150 C=C(C)COc1cccc(c1F)F 34a_100000751161_100000748629 [0,2,0,0,0,0|2,0,0]=4 5327 B13R1.150 C=C(C)COc1cccc(c1F)F 7a_100000751161_100000748629 [0,2,0,0,0,0|2,0,0]=4 5328 B13R1.150 C=C(C)COc1cccc(c1I)Br 34a_100010187912_100000748629 [0,2,0,0,0,0|2,0,0]=4 5329 B13R1.150 C=C(C)COc1cccc(c1I)Br 7a_100010187912_100000748629 [0,2,0,0,0,0|2,0,0]=4 5330 B13R1.150 C=C(C)COc1cccc(c1I)C 34a_100010083724_100000748629 [0,2,0,0,0,0|1,0,0]=3 5331 B13R1.150 C=C(C)COc1cccc(c1I)C 7a_100010083724_100000748629 [0,2,0,0,0,0|1,0,0]=3 5332 B13R1.150 C=C(C)COc1cccc(c1I)Cl 34a_100000050174_100000748629 [0,2,0,0,0,0|2,0,0]=4 5333 B13R1.150 C=C(C)COc1cccc(c1I)Cl 7a_100000050174_100000748629 [0,2,0,0,0,0|2,0,0]=4 5334 B13R1.150 C=C(C)COc1cccc(c1I)F 34a_100000690913_100000748629 [0,2,0,0,0,0|2,0,0]=4 5335 B13R1.150 C=C(C)COc1cccc(c1I)F 7a_100000690913_100000748629 [0,2,0,0,0,0|2,0,0]=4 5336 B13R1.150 C=C(C)COc1cccc(c1N)Br 34a_100011934926_100000748629 [0,2,0,0,0,0|2,0,0]=4 5337 B13R1.150 C=C(C)COc1cccc(c1N)Br 7a_100011934926_100000748629 [0,2,0,0,0,0|2,0,0]=4 5338 B13R1.150 C=C(C)COc1cccc(c1N)C 34a_100000743429_100000748629 [0,2,0,0,0,0|1,0,0]=3 5339 B13R1.150 C=C(C)COc1cccc(c1N)C 7a_100000743429_100000748629 [0,2,0,0,0,0|1,0,0]=3 5340 B13R1.150 C=C(C)COc1cccc(c1N)Cl 34a_100012022510_100000748629 [0,2,0,0,0,0|2,0,0]=4 5341 B13R1.150 C=C(C)COc1cccc(c1N)Cl 7a_100012022510_100000748629 [0,2,0,0,0,0|2,0,0]=4 5342 B13R1.150 C=C(C)COc1cccc(c1N)F 34a_100020591140_100000748629 [0,2,0,0,0,0|2,0,0]=4 5343 B13R1.150 C=C(C)COc1cccc(c1N)F 7a_100020591140_100000748629 [0,2,0,0,0,0|2,0,0]=4 5344 B13R1.150 C=C(C)COc1cccc(c1N)I 34a_200000049512_100000748629 [0,2,0,0,0,0|2,0,0]=4 5345 B13R1.150 C=C(C)COc1cccc(c1N)I 7a_200000049512_100000748629 [0,2,0,0,0,0|2,0,0]=4 5346 B13R1.150 C=C(C)COc1cccc(c1N)N 34a_100000033209_100000748629 [0,2,0,0,0,0|2,0,0]=4 5347 B13R1.150 C=C(C)COc1cccn(c1=O)C 34a_100000117616_100000748629 [0,2,0,0,0,0|1,0,1]=4 5348 B13R1.150 C=C(C)COc1cccn(c1=O)C 7a_100000117616_100000748629 [0,2,0,0,0,0|1,0,1]=4 5349 B13R1.150 C=C(C)COc1nccc(c1Br)C 34a_100012000493_100000748629 [0,2,0,0,0,0|2,0,0]=4 5350 B13R1.150 C=C(C)CSc1cccc(c1Br)Br 62a_100000748629_100010175083 [0,2,0,0,0,0|2,0,0]=4 5351 B13R1.150 C=C(C)CSc1cccc(c1Br)Br 62a_100010175083_100000211660 [0,2,0,0,0,0|2,0,0]=4 5352 B13R1.150 C=C(C)CSc1cccc(c1Br)C 62a_100000748629_100012362457 [0,2,0,0,0,0|1,0,0]=3 5353 B13R1.150 C=C(C)CSc1cccc(c1Br)C 62a_100012362457_100000211660 [0,2,0,0,0,0|1,0,0]=3 5354 B13R1.150 C=C(C)CSc1cccc(c1Br)Cl 62a_100000748629_100014021842 [0,2,0,0,0,0|2,0,0]=4 5355 B13R1.150 C=C(C)CSc1cccc(c1Br)Cl 62a_100014021842_100000211660 [0,2,0,0,0,0|2,0,0]=4 5356 B13R1.150 C=C(C)CSc1cccc(c1Br)F 62a_100000748629_100010202630 [0,2,0,0,0,0|2,0,0]=4 5357 B13R1.150 C=C(C)CSc1cccc(c1Br)F 62a_100010202630_100000211660 [0,2,0,0,0,0|2,0,0]=4 5358 B13R1.150 C=C(C)CSc1cccc(c1Br)O 62a_100000748629_100010187914 [0,2,0,0,0,0|2,0,0]=4 5359 B13R1.150 C=C(C)CSc1cccc(c1Br)O 62a_100010187914_100000211660 [0,2,0,0,0,0|2,0,0]=4 5360 B13R1.150 C=C(C)CSc1cccc(c1C)Br 62a_100000748629_100012353703 [0,2,0,0,0,0|2,0,0]=4 5361 B13R1.150 C=C(C)CSc1cccc(c1C)Br 62a_100012353703_100000211660 [0,2,0,0,0,0|2,0,0]=4 5362 B13R1.150 C=C(C)CSc1cccc(c1C)C 62a_100000748629_100011214922 [0,2,0,0,0,0|1,0,0]=3 5363 B13R1.150 C=C(C)CSc1cccc(c1C)C 62a_100011214922_100000211660 [0,2,0,0,0,0|1,0,0]=3 5364 B13R1.150 C=C(C)CSc1cccc(c1C)Cl 62a_100000726075_100000211660 [0,2,0,0,0,0|2,0,0]=4 5365 B13R1.150 C=C(C)CSc1cccc(c1C)Cl 62a_100000748629_100000726075 [0,2,0,0,0,0|2,0,0]=4 5366 B13R1.150 C=C(C)CSc1cccc(c1C)F 62a_100000748629_100011216893 [0,2,0,0,0,0|2,0,0]=4 5367 B13R1.150 C=C(C)CSc1cccc(c1C)F 62a_100011216893_100000211660 [0,2,0,0,0,0|2,0,0]=4 5368 B13R1.150 C=C(C)CSc1cccc(c1C)N 62a_100000748629_100000761887 [0,2,0,0,0,0|2,0,0]=4 5369 B13R1.150 C=C(C)CSc1cccc(c1C)N 62a_100000761887_100000211660 [0,2,0,0,0,0|2,0,0]=4 5370 B13R1.150 C=C(C)CSc1cccc(c1C)O 62a_100000748629_100012002258 [0,2,0,0,0,0|2,0,0]=4 5371 B13R1.150 C=C(C)CSc1cccc(c1C)O 62a_100012002258_100000211660 [0,2,0,0,0,0|2,0,0]=4 5372 B13R1.150 C=C(C)CSc1cccc(c1Cl)Br 62a_100000748629_100010142854 [0,2,0,0,0,0|2,0,0]=4 5373 B13R1.150 C=C(C)CSc1cccc(c1Cl)Br 62a_100010142854_100000211660 [0,2,0,0,0,0|2,0,0]=4 5374 B13R1.150 C=C(C)CSc1cccc(c1Cl)C 62a_100000748629_200012352035 [0,2,0,0,0,0|1,0,0]=3 5375 B13R1.150 C=C(C)CSc1cccc(c1Cl)C 62a_200012352035_100000211660 [0,2,0,0,0,0|1,0,0]=3 5376 B13R1.150 C=C(C)CSc1cccc(c1Cl)Cl 62a_100000748629_100011215384 [0,2,0,0,0,0|2,0,0]=4 5377 B13R1.150 C=C(C)CSc1cccc(c1Cl)Cl 62a_100011215384_100000211660 [0,2,0,0,0,0|2,0,0]=4 5378 B13R1.150 C=C(C)CSc1cccc(c1Cl)F 62a_100000748629_200010234923 [0,2,0,0,0,0|2,0,0]=4 5379 B13R1.150 C=C(C)CSc1cccc(c1Cl)F 62a_200010234923_100000211660 [0,2,0,0,0,0|2,0,0]=4 5380 B13R1.150 C=C(C)CSc1cccc(c1Cl)O 62a_100000748629_100000049636 [0,2,0,0,0,0|2,0,0]=4 5381 B13R1.150 C=C(C)CSc1cccc(c1F)Br 62a_100000702267_100000211660 [0,2,0,0,0,0|2,0,0]=4 5382 B13R1.150 C=C(C)CSc1cccc(c1F)Br 62a_100000748629_100000702267 [0,2,0,0,0,0|2,0,0]=4 5383 B13R1.150 C=C(C)CSc1cccc(c1F)C 62a_100000717567_100000211660 [0,2,0,0,0,0|1,0,0]=3 5384 B13R1.150 C=C(C)CSc1cccc(c1F)C 62a_100000748629_100000717567 [0,2,0,0,0,0|1,0,0]=3 5385 B13R1.150 C=C(C)CSc1cccc(c1F)Cl 62a_100000748629_100011217346 [0,2,0,0,0,0|2,0,0]=4 5386 B13R1.150 C=C(C)CSc1cccc(c1F)Cl 62a_100011217346_100000211660 [0,2,0,0,0,0|2,0,0]=4 5387 B13R1.150 C=C(C)CSc1cccc(c1F)F 62a_100000694657_100000211660 [0,2,0,0,0,0|2,0,0]=4 5388 B13R1.150 C=C(C)CSc1cccc(c1F)F 62a_100000748629_100000694657 [0,2,0,0,0,0|2,0,0]=4 5389 B13R1.150 C=C(C)CSc1cccc(c1F)N 62a_100000748629_100011935091 [0,2,0,0,0,0|2,0,0]=4 5390 B13R1.150 C=C(C)CSc1cccc(c1F)N 62a_100011935091_100000211660 [0,2,0,0,0,0|2,0,0]=4 5391 B13R1.150 C=C(C)CSc1cccc(c1F)O 62a_100000748629_100009817021 [0,2,0,0,0,0|2,0,0]=4 5392 B13R1.150 C=C(C)CSc1cccc(c1F)O 62a_100009817021_100000211660 [0,2,0,0,0,0|2,0,0]=4 5393 B13R1.150 C=C(C)CSc1cccc(c1N)Br 62a_100000748629_100010146558 [0,2,0,0,0,0|2,0,0]=4 5394 B13R1.150 C=C(C)CSc1cccc(c1N)Br 62a_100010146558_100000211660 [0,2,0,0,0,0|2,0,0]=4 5395 B13R1.150 C=C(C)CSc1cccc(c1N)C 62a_100000748629_100011834072 [0,2,0,0,0,0|1,0,0]=3 5396 B13R1.150 C=C(C)CSc1cccc(c1N)C 62a_100011834072_100000211660 [0,2,0,0,0,0|1,0,0]=3 5397 B13R1.150 C=C(C)CSc1cccc(c1N)Cl 62a_100000748629_100010190421 [0,2,0,0,0,0|2,0,0]=4 5398 B13R1.150 C=C(C)CSc1cccc(c1N)Cl 62a_100010190421_100000211660 [0,2,0,0,0,0|2,0,0]=4 5399 B13R1.150 C=C(C)CSc1cccc(c1N)F 62a_100000042321_100000211660 [0,2,0,0,0,0|2,0,0]=4 5400 B13R1.150 C=C(C)CSc1cccc(c1N)F 62a_100000748629_100000042321 [0,2,0,0,0,0|2,0,0]=4 5401 B13R1.150 C=C(C)CSc1cccc(c1N)N 62a_100015191791_100000211660 [0,2,0,0,0,0|2,0,0]=4 5402 B13R1.150 C=C(C)CSc1cccc(c1N)O 62a_100000748629_100011934926 [0,2,0,0,0,0|2,0,0]=4 5403 B13R1.150 C=C(C)CSc1cccc(c1O)Br 62a_100000748629_100010084509 [0,2,0,0,0,0|1,0,0]=3 5404 B13R1.150 C=C(C)CSc1cccc(c1O)Br 62a_100010084509_100000211660 [0,2,0,0,0,0|1,0,0]=3 5405 B13R1.150 C=C(C)CSc1cccc(c1O)C 62a_100000748629_100009817157 [0,2,0,0,0,0|0,0,0]=2 5406 B13R1.150 C=C(C)CSc1cccc(c1O)C 62a_100009817157_100000211660 [0,2,0,0,0,0|0,0,0]=2 5407 B13R1.150 C=C(C)CSc1cccc(c1O)Cl 62a_100000748629_100010202889 [0,2,0,0,0,0|1,0,0]=3 5408 B13R1.150 C=C(C)CSc1cccc(c1O)Cl 62a_100010202889_100000211660 [0,2,0,0,0,0|1,0,0]=3 5409 B13R1.150 C=C(C)CSc1cccc(c1O)F 62a_100000748629_100009813666 [0,2,0,0,0,0|1,0,0]=3 5410 B13R1.150 C=C(C)CSc1cccc(c1O)F 62a_100009813666_100000211660 [0,2,0,0,0,0|1,0,0]=3 5411 B13R1.150 C=C(C)CSc1cccc(c1O)N 62a_100000748629_100010084371 [0,2,0,0,0,0|1,0,0]=3 5412 B13R1.150 C=C(C)CSc1cccc(c1O)N 62a_100011934915_100000211660 [0,2,0,0,0,0|1,0,0]=3 5413 B13R1.150 C=C(C)CSc1cccc(c1O)O 62a_100000748629_100009815950 [0,2,0,0,0,0|1,0,0]=3 5414 B13R1.150 C=C(C)CSc1cccn(c1=O)C 62a_100000687173_100000211660 [0,2,0,0,0,0|1,0,1]=4 5415 B13R1.150 C=C(C)CSc1cccn(c1=O)C 62a_100000748629_100000687173 [0,2,0,0,0,0|1,0,1]=4 5416 B13R1.150 C=C(C)CSc1ccnc(c1C)C 62a_100000748629_100009846815 [0,2,0,0,0,0|2,0,0]=4 5417 B13R1.150 C=C(C)CSc1ccnc(c1C)C 62a_100009846815_100000211660 [0,2,0,0,0,0|2,0,0]=4 5418 B13R1.150 C=C(C)CSc1ccnc(c1Cl)C 62a_100000698670_100000211660 [0,2,0,0,0,0|2,0,0]=4 5419 B13R1.150 C=C(C)CSc1ccnc(c1Cl)C 62a_100000748629_100000698670 [0,2,0,0,0,0|2,0,0]=4 5420 B13R1.150 C=C(C)CSc1ccnc(c1F)C 62a_100000748629_100009849794 [0,2,0,0,0,0|2,0,0]=4 5421 B13R1.150 C=C(C)CSc1ccnc(c1F)C 62a_100009849794_100000211660 [0,2,0,0,0,0|2,0,0]=4 5422 B13R1.150 C=C(C)CSc1ccnc(c1N)C 62a_100000748629_100009885578 [0,2,0,0,0,0|2,0,0]=4 5423 B13R1.150 C=C(C)CSc1ccnc(c1N)C 62a_100009885578_100000211660 [0,2,0,0,0,0|2,0,0]=4 5424 B13R1.150 C=C(C)CSc1ccnc(c1O)Cl 62a_100000748629_100010067911 [0,2,0,0,0,0|2,0,0]=4 5425 B13R1.150 C=C(C)CSc1cncc(c1C)C 62a_100000748629_100009864703 [0,2,0,0,0,0|2,0,0]=4 5426 B13R1.150 C=C(C)CSc1cncc(c1C)C 62a_100009864703_100000211660 [0,2,0,0,0,0|2,0,0]=4 5427 B13R1.150 C=C(C)CSc1cncc(c1N)C 62a_100000748629_100009818025 [0,2,0,0,0,0|2,0,0]=4 5428 B13R1.150 C=C(C)CSc1cncc(c1N)C 62a_100009818025_100000211660 [0,2,0,0,0,0|2,0,0]=4 5429 B13R1.150 C=C(C)CSc1cncc(c1O)N 62a_100000694263_100000211660 [0,2,0,0,0,0|2,0,0]=4 5430 B13R1.150 C=C(C)CSc1cncc(c1O)N 62a_100000748629_100000694263 [0,2,0,0,0,0|2,0,0]=4 5431 B13R1.150 C=C(C)CSc1nccc(c1C)C 62a_100000748629_100009847204 [0,2,0,0,0,0|2,0,0]=4 5432 B13R1.150 C=C(C)CSc1nccc(c1C)C 62a_100009847204_100000211660 [0,2,0,0,0,0|2,0,0]=4 5433 B13R1.150 C=C(C)CSc1nccc(c1F)C 62a_100000748629_100009817629 [0,2,0,0,0,0|2,0,0]=4 5434 B13R1.150 C=C(C)CSc1nccc(c1F)C 62a_100009817629_100000211660 [0,2,0,0,0,0|2,0,0]=4 5435 B13R1.150 C=C(C)CSc1nccc(c1N)C 62a_100000748629_100000763560 [0,2,0,0,0,0|2,0,0]=4 5436 B13R1.150 C=C(C)CSc1nccc(c1N)C 62a_100000763560_100000211660 [0,2,0,0,0,0|2,0,0]=4 5437 B13R1.150 C=C(C)CSc1nccc(c1O)C 62a_100000748629_100000696282 [0,2,0,0,0,0|1,0,0]=3 5438 B13R1.150 C=C(C)CSc1nccc(c1O)F 62a_100000748629_100009867227 [0,2,0,0,0,0|2,0,0]=4 5439 B13R1.150 C=C(C)CSc1nccc(c1O)N 62a_100000748629_100009844647 [0,2,0,0,0,0|2,0,0]=4 5440 B13R1.150 C=C(F)CNc1cccc(c1Br)C 34a_100000684715_100009893438 [0,2,0,0,0,0|1,0,0]=3 5441 B13R1.150 C=C(F)CNc1cccc(c1Br)Cl 34a_100000687072_100009893438 [0,2,0,0,0,0|2,0,0]=4 5442 B13R1.150 C=C(F)CNc1cccc(c1Br)F 34a_100011934729_100009893438 [0,2,0,0,0,0|2,0,0]=4 5443 B13R1.150 C=C(F)CNc1cccc(c1Br)O 34a_100012183704_100009893438 [0,2,0,0,0,0|2,0,0]=4 5444 B13R1.150 C=C(F)CNc1cccc(c1Br)O 7a_100012183704_100000042424 [0,2,0,0,0,0|2,0,0]=4 5445 B13R1.150 C=C(F)CNc1cccc(c1C)Br 34a_100000750434_100009893438 [0,2,0,0,0,0|2,0,0]=4 5446 B13R1.150 C=C(F)CNc1cccc(c1C)C 2230a_100000210026_100009893438 [0,2,0,0,0,0|1,0,0]=3 5447 B13R1.150 C=C(F)CNc1cccc(c1C)C 34a_100000210026_100009893438 [0,2,0,0,0,0|1,0,0]=3 5448 B13R1.150 C=C(F)CNc1cccc(c1C)C 7a_100000210026_100000042424 [0,2,0,0,0,0|1,0,0]=3 5449 B13R1.150 C=C(F)CNc1cccc(c1C)Cl 2230a_100000210441_100009893438 [0,2,0,0,0,0|2,0,0]=4 5450 B13R1.150 C=C(F)CNc1cccc(c1C)Cl 34a_100000210441_100009893438 [0,2,0,0,0,0|2,0,0]=4 5451 B13R1.150 C=C(F)CNc1cccc(c1C)Cl 7a_100000210441_100000042424 [0,2,0,0,0,0|2,0,0]=4 5452 B13R1.150 C=C(F)CNc1cccc(c1C)F 34a_100000745574_100009893438 [0,2,0,0,0,0|2,0,0]=4 5453 B13R1.150 C=C(F)CNc1cccc(c1C)F 7a_100000745574_100000042424 [0,2,0,0,0,0|2,0,0]=4 5454 B13R1.150 C=C(F)CNc1cccc(c1C)I 34a_100000761887_100009893438 [0,2,0,0,0,0|2,0,0]=4 5455 B13R1.150 C=C(F)CNc1cccc(c1C)O 34a_100011216573_100009893438 [0,2,0,0,0,0|2,0,0]=4 5456 B13R1.150 C=C(F)CNc1cccc(c1C)O 7a_100011216573_100000042424 [0,2,0,0,0,0|2,0,0]=4 5457 B13R1.150 C=C(F)CNc1cccc(c1Cl)Br 34a_100000687075_100009893438 [0,2,0,0,0,0|2,0,0]=4 5458 B13R1.150 C=C(F)CNc1cccc(c1Cl)C 34a_100000765562_100009893438 [0,2,0,0,0,0|1,0,0]=3 5459 B13R1.150 C=C(F)CNc1cccc(c1Cl)C 7a_100000765562_100000042424 [0,2,0,0,0,0|1,0,0]=3 5460 B13R1.150 C=C(F)CNc1cccc(c1Cl)Cl 34a_100000185733_100009893438 [0,2,0,0,0,0|2,0,0]=4 5461 B13R1.150 C=C(F)CNc1cccc(c1Cl)F 34a_100000692321_100009893438 [0,2,0,0,0,0|2,0,0]=4 5462 B13R1.150 C=C(F)CNc1cccc(c1Cl)O 34a_100012002038_100009893438 [0,2,0,0,0,0|2,0,0]=4 5463 B13R1.150 C=C(F)CNc1cccc(c1Cl)O 7a_100012002038_100000042424 [0,2,0,0,0,0|2,0,0]=4 5464 B13R1.150 C=C(F)CNc1cccc(c1F)Br 2230a_100011935091_100009893438 [0,2,0,0,0,0|2,0,0]=4 5465 B13R1.150 C=C(F)CNc1cccc(c1F)Br 34a_100011935091_100009893438 [0,2,0,0,0,0|2,0,0]=4 5466 B13R1.150 C=C(F)CNc1cccc(c1F)C 2230a_100000697159_100009893438 [0,2,0,0,0,0|1,0,0]=3 5467 B13R1.150 C=C(F)CNc1cccc(c1F)C 34a_100000697159_100009893438 [0,2,0,0,0,0|1,0,0]=3 5468 B13R1.150 C=C(F)CNc1cccc(c1F)C 7a_100000697159_100000042424 [0,2,0,0,0,0|1,0,0]=3 5469 B13R1.150 C=C(F)CNc1cccc(c1F)Cl 2230a_100000199060_100009893438 [0,2,0,0,0,0|2,0,0]=4 5470 B13R1.150 C=C(F)CNc1cccc(c1F)Cl 34a_100000199060_100009893438 [0,2,0,0,0,0|2,0,0]=4 5471 B13R1.150 C=C(F)CNc1cccc(c1F)F 34a_100000743855_100009893438 [0,2,0,0,0,0|2,0,0]=4 5472 B13R1.150 C=C(F)CNc1cccc(c1I)Br 34a_100020590159_100009893438 [0,2,0,0,0,0|2,0,0]=4 5473 B13R1.150 C=C(F)CNc1cccc(c1I)C 34a_100000761888_100009893438 [0,2,0,0,0,0|1,0,0]=3 5474 B13R1.150 C=C(F)CNc1cccc(c1I)Cl 34a_100000049713_100009893438 [0,2,0,0,0,0|2,0,0]=4 5475 B13R1.150 C=C(F)CNc1cccc(c1I)F 34a_100000690935_100009893438 [0,2,0,0,0,0|2,0,0]=4 5476 B13R1.150 C=C(F)CNc1cccc(c1O)Br 34a_100011934915_100009893438 [0,2,0,0,0,0|1,0,0]=3 5477 B13R1.150 C=C(F)CNc1cccc(c1O)C 34a_100000756359_100009893438 [0,2,0,0,0,0|0,0,0]=2 5478 B13R1.150 C=C(F)CNc1cccc(c1O)Cl 34a_100000754742_100009893438 [0,2,0,0,0,0|1,0,0]=3 5479 B13R1.150 C=C(F)CNc1cccc(c1O)F 34a_100011934987_100009893438 [0,2,0,0,0,0|1,0,0]=3 5480 B13R1.150 C=C(F)COc1cccc(c1Br)Br 34a_100010187966_100009893438 [0,2,0,0,0,0|2,0,0]=4 5481 B13R1.150 C=C(F)COc1cccc(c1Br)Br 7a_100010187966_100000042424 [0,2,0,0,0,0|2,0,0]=4 5482 B13R1.150 C=C(F)COc1cccc(c1Br)C 34a_100000686692_100009893438 [0,2,0,0,0,0|1,0,0]=3 5483 B13R1.150 C=C(F)COc1cccc(c1Br)C 7a_100000686692_100000042424 [0,2,0,0,0,0|1,0,0]=3 5484 B13R1.150 C=C(F)COc1cccc(c1Br)Cl 34a_100012348804_100009893438 [0,2,0,0,0,0|2,0,0]=4 5485 B13R1.150 C=C(F)COc1cccc(c1Br)Cl 7a_100012348804_100000042424 [0,2,0,0,0,0|2,0,0]=4 5486 B13R1.150 C=C(F)COc1cccc(c1Br)F 34a_100009820682_100009893438 [0,2,0,0,0,0|2,0,0]=4 5487 B13R1.150 C=C(F)COc1cccc(c1Br)F 7a_100009820682_100000042424 [0,2,0,0,0,0|2,0,0]=4 5488 B13R1.150 C=C(F)COc1cccc(c1Br)I 34a_100010187914_100009893438 [0,2,0,0,0,0|2,0,0]=4 5489 B13R1.150 C=C(F)COc1cccc(c1Br)I 7a_100010187914_100000042424 [0,2,0,0,0,0|2,0,0]=4 5490 B13R1.150 C=C(F)COc1cccc(c1Br)N 34a_100012183704_100009893438 [0,2,0,0,0,0|2,0,0]=4 5491 B13R1.150 C=C(F)COc1cccc(c1Br)N 7a_100012183704_100000042424 [0,2,0,0,0,0|2,0,0]=4 5492 B13R1.150 C=C(F)COc1cccc(c1C)Br 34a_100012002258_100009893438 [0,2,0,0,0,0|2,0,0]=4 5493 B13R1.150 C=C(F)COc1cccc(c1C)Br 7a_100012002258_100000042424 [0,2,0,0,0,0|2,0,0]=4 5494 B13R1.150 C=C(F)COc1cccc(c1C)C 34a_100000185855_100009893438 [0,2,0,0,0,0|1,0,0]=3 5495 B13R1.150 C=C(F)COc1cccc(c1C)C 7a_100000185855_100000042424 [0,2,0,0,0,0|1,0,0]=3 5496 B13R1.150 C=C(F)COc1cccc(c1C)Cl 34a_100011265684_100009893438 [0,2,0,0,0,0|2,0,0]=4 5497 B13R1.150 C=C(F)COc1cccc(c1C)Cl 7a_100011265684_100000042424 [0,2,0,0,0,0|2,0,0]=4 5498 B13R1.150 C=C(F)COc1cccc(c1C)F 34a_100011217231_100009893438 [0,2,0,0,0,0|2,0,0]=4 5499 B13R1.150 C=C(F)COc1cccc(c1C)F 7a_100011217231_100000042424 [0,2,0,0,0,0|2,0,0]=4 5500 B13R1.150 C=C(F)COc1cccc(c1C)N 34a_100011216573_100009893438 [0,2,0,0,0,0|2,0,0]=4 5501 B13R1.150 C=C(F)COc1cccc(c1C)N 7a_100011216573_100000042424 [0,2,0,0,0,0|2,0,0]=4 5502 B13R1.150 C=C(F)COc1cccc(c1Cl)Br 34a_100010187913_100009893438 [0,2,0,0,0,0|2,0,0]=4 5503 B13R1.150 C=C(F)COc1cccc(c1Cl)Br 7a_100010187913_100000042424 [0,2,0,0,0,0|2,0,0]=4 5504 B13R1.150 C=C(F)COc1cccc(c1Cl)C 34a_100000695629_100009893438 [0,2,0,0,0,0|1,0,0]=3 5505 B13R1.150 C=C(F)COc1cccc(c1Cl)C 7a_100000695629_100000042424 [0,2,0,0,0,0|1,0,0]=3 5506 B13R1.150 C=C(F)COc1cccc(c1Cl)Cl 34a_100000211076_100009893438 [0,2,0,0,0,0|2,0,0]=4 5507 B13R1.150 C=C(F)COc1cccc(c1Cl)Cl 7a_100000211076_100000042424 [0,2,0,0,0,0|2,0,0]=4 5508 B13R1.150 C=C(F)COc1cccc(c1Cl)F 34a_100000087408_100009893438 [0,2,0,0,0,0|2,0,0]=4 5509 B13R1.150 C=C(F)COc1cccc(c1Cl)F 7a_100000087408_100000042424 [0,2,0,0,0,0|2,0,0]=4 5510 B13R1.150 C=C(F)COc1cccc(c1Cl)I 34a_100000049636_100009893438 [0,2,0,0,0,0|2,0,0]=4 5511 B13R1.150 C=C(F)COc1cccc(c1Cl)I 7a_100000049636_100000042424 [0,2,0,0,0,0|2,0,0]=4 5512 B13R1.150 C=C(F)COc1cccc(c1Cl)N 34a_100012002038_100009893438 [0,2,0,0,0,0|2,0,0]=4 5513 B13R1.150 C=C(F)COc1cccc(c1Cl)N 7a_100012002038_100000042424 [0,2,0,0,0,0|2,0,0]=4 5514 B13R1.150 C=C(F)COc1cccc(c1F)Br 34a_100009817021_100009893438 [0,2,0,0,0,0|2,0,0]=4 5515 B13R1.150 C=C(F)COc1cccc(c1F)Br 7a_100009817021_100000042424 [0,2,0,0,0,0|2,0,0]=4 5516 B13R1.150 C=C(F)COc1cccc(c1F)C 34a_100000751311_100009893438 [0,2,0,0,0,0|1,0,0]=3 5517 B13R1.150 C=C(F)COc1cccc(c1F)C 7a_100000751311_100000042424 [0,2,0,0,0,0|1,0,0]=3 5518 B13R1.150 C=C(F)COc1cccc(c1F)Cl 34a_100000687438_100009893438 [0,2,0,0,0,0|2,0,0]=4 5519 B13R1.150 C=C(F)COc1cccc(c1F)Cl 7a_100000687438_100000042424 [0,2,0,0,0,0|2,0,0]=4 5520 B13R1.150 C=C(F)COc1cccc(c1F)F 34a_100000751161_100009893438 [0,2,0,0,0,0|2,0,0]=4 5521 B13R1.150 C=C(F)COc1cccc(c1F)F 7a_100000751161_100000042424 [0,2,0,0,0,0|2,0,0]=4 5522 B13R1.150 C=C(F)COc1cccc(c1I)Br 34a_100010187912_100009893438 [0,2,0,0,0,0|2,0,0]=4 5523 B13R1.150 C=C(F)COc1cccc(c1I)Br 7a_100010187912_100000042424 [0,2,0,0,0,0|2,0,0]=4 5524 B13R1.150 C=C(F)COc1cccc(c1I)C 34a_100010083724_100009893438 [0,2,0,0,0,0|1,0,0]=3 5525 B13R1.150 C=C(F)COc1cccc(c1I)C 7a_100010083724_100000042424 [0,2,0,0,0,0|1,0,0]=3 5526 B13R1.150 C=C(F)COc1cccc(c1I)Cl 34a_100000050174_100009893438 [0,2,0,0,0,0|2,0,0]=4 5527 B13R1.150 C=C(F)COc1cccc(c1I)Cl 7a_100000050174_100000042424 [0,2,0,0,0,0|2,0,0]=4 5528 B13R1.150 C=C(F)COc1cccc(c1I)F 34a_100000690913_100009893438 [0,2,0,0,0,0|2,0,0]=4 5529 B13R1.150 C=C(F)COc1cccc(c1I)F 7a_100000690913_100000042424 [0,2,0,0,0,0|2,0,0]=4 5530 B13R1.150 C=C(F)COc1cccc(c1N)Br 34a_100011934926_100009893438 [0,2,0,0,0,0|2,0,0]=4 5531 B13R1.150 C=C(F)COc1cccc(c1N)Br 7a_100011934926_100000042424 [0,2,0,0,0,0|2,0,0]=4 5532 B13R1.150 C=C(F)COc1cccc(c1N)C 34a_100000743429_100009893438 [0,2,0,0,0,0|1,0,0]=3 5533 B13R1.150 C=C(F)COc1cccc(c1N)C 7a_100000743429_100000042424 [0,2,0,0,0,0|1,0,0]=3 5534 B13R1.150 C=C(F)COc1cccc(c1N)Cl 34a_100012022510_100009893438 [0,2,0,0,0,0|2,0,0]=4 5535 B13R1.150 C=C(F)COc1cccc(c1N)Cl 7a_100012022510_100000042424 [0,2,0,0,0,0|2,0,0]=4 5536 B13R1.150 C=C(F)COc1cccc(c1N)F 34a_100020591140_100009893438 [0,2,0,0,0,0|2,0,0]=4 5537 B13R1.150 C=C(F)COc1cccc(c1N)F 7a_100020591140_100000042424 [0,2,0,0,0,0|2,0,0]=4 5538 B13R1.150 C=C(F)COc1cccc(c1N)I 34a_200000049512_100009893438 [0,2,0,0,0,0|2,0,0]=4 5539 B13R1.150 C=C(F)COc1cccc(c1N)I 7a_200000049512_100000042424 [0,2,0,0,0,0|2,0,0]=4 5540 B13R1.150 C=C(F)COc1cccc(c1N)N 34a_100000033209_100009893438 [0,2,0,0,0,0|2,0,0]=4 5541 B13R1.150 C=C(F)COc1cccn(c1=O)C 34a_100000117616_100009893438 [0,2,0,0,0,0|1,0,1]=4 5542 B13R1.150 C=C(F)COc1cccn(c1=O)C 7a_100000117616_100000042424 [0,2,0,0,0,0|1,0,1]=4 5543 B13R1.150 C=C(F)COc1nccc(c1Br)C 34a_100012000493_100009893438 [0,2,0,0,0,0|2,0,0]=4 5544 B13R1.150 C=C(F)CSc1cccc(c1Br)Br 62a_100000042424_100010175083 [0,2,0,0,0,0|2,0,0]=4 5545 B13R1.150 C=C(F)CSc1cccc(c1Br)Br 62a_100010175083_100000042424 [0,2,0,0,0,0|2,0,0]=4 5546 B13R1.150 C=C(F)CSc1cccc(c1Br)C 62a_100000042424_100012362457 [0,2,0,0,0,0|1,0,0]=3 5547 B13R1.150 C=C(F)CSc1cccc(c1Br)C 62a_100012362457_100000042424 [0,2,0,0,0,0|1,0,0]=3 5548 B13R1.150 C=C(F)CSc1cccc(c1Br)Cl 62a_100000042424_100014021842 [0,2,0,0,0,0|2,0,0]=4 5549 B13R1.150 C=C(F)CSc1cccc(c1Br)Cl 62a_100014021842_100000042424 [0,2,0,0,0,0|2,0,0]=4 5550 B13R1.150 C=C(F)CSc1cccc(c1Br)F 62a_100000042424_100010202630 [0,2,0,0,0,0|2,0,0]=4 5551 B13R1.150 C=C(F)CSc1cccc(c1Br)F 62a_100010202630_100000042424 [0,2,0,0,0,0|2,0,0]=4 5552 B13R1.150 C=C(F)CSc1cccc(c1Br)O 62a_100000042424_100010187914 [0,2,0,0,0,0|2,0,0]=4 5553 B13R1.150 C=C(F)CSc1cccc(c1Br)O 62a_100010187914_100000042424 [0,2,0,0,0,0|2,0,0]=4 5554 B13R1.150 C=C(F)CSc1cccc(c1C)Br 62a_100000042424_100012353703 [0,2,0,0,0,0|2,0,0]=4 5555 B13R1.150 C=C(F)CSc1cccc(c1C)Br 62a_100012353703_100000042424 [0,2,0,0,0,0|2,0,0]=4 5556 B13R1.150 C=C(F)CSc1cccc(c1C)C 62a_100000042424_100011214922 [0,2,0,0,0,0|1,0,0]=3 5557 B13R1.150 C=C(F)CSc1cccc(c1C)C 62a_100011214922_100000042424 [0,2,0,0,0,0|1,0,0]=3 5558 B13R1.150 C=C(F)CSc1cccc(c1C)Cl 62a_100000042424_100000726075 [0,2,0,0,0,0|2,0,0]=4 5559 B13R1.150 C=C(F)CSc1cccc(c1C)Cl 62a_100000726075_100000042424 [0,2,0,0,0,0|2,0,0]=4 5560 B13R1.150 C=C(F)CSc1cccc(c1C)F 62a_100000042424_100011216893 [0,2,0,0,0,0|2,0,0]=4 5561 B13R1.150 C=C(F)CSc1cccc(c1C)F 62a_100011216893_100000042424 [0,2,0,0,0,0|2,0,0]=4 5562 B13R1.150 C=C(F)CSc1cccc(c1C)N 62a_100000042424_100000761887 [0,2,0,0,0,0|2,0,0]=4 5563 B13R1.150 C=C(F)CSc1cccc(c1C)N 62a_100000761887_100000042424 [0,2,0,0,0,0|2,0,0]=4 5564 B13R1.150 C=C(F)CSc1cccc(c1C)O 62a_100000042424_100012002258 [0,2,0,0,0,0|2,0,0]=4 5565 B13R1.150 C=C(F)CSc1cccc(c1C)O 62a_100012002258_100000042424 [0,2,0,0,0,0|2,0,0]=4 5566 B13R1.150 C=C(F)CSc1cccc(c1Cl)Br 62a_100000042424_100010142854 [0,2,0,0,0,0|2,0,0]=4 5567 B13R1.150 C=C(F)CSc1cccc(c1Cl)Br 62a_100010142854_100000042424 [0,2,0,0,0,0|2,0,0]=4 5568 B13R1.150 C=C(F)CSc1cccc(c1Cl)C 62a_100000042424_200012352035 [0,2,0,0,0,0|1,0,0]=3 5569 B13R1.150 C=C(F)CSc1cccc(c1Cl)C 62a_200012352035_100000042424 [0,2,0,0,0,0|1,0,0]=3 5570 B13R1.150 C=C(F)CSc1cccc(c1Cl)Cl 62a_100000042424_100011215384 [0,2,0,0,0,0|2,0,0]=4 5571 B13R1.150 C=C(F)CSc1cccc(c1Cl)Cl 62a_100011215384_100000042424 [0,2,0,0,0,0|2,0,0]=4 5572 B13R1.150 C=C(F)CSc1cccc(c1Cl)F 62a_100000042424_200010234923 [0,2,0,0,0,0|2,0,0]=4 5573 B13R1.150 C=C(F)CSc1cccc(c1Cl)F 62a_200010234923_100000042424 [0,2,0,0,0,0|2,0,0]=4 5574 B13R1.150 C=C(F)CSc1cccc(c1Cl)O 62a_100000042424_100000049636 [0,2,0,0,0,0|2,0,0]=4 5575 B13R1.150 C=C(F)CSc1cccc(c1F)Br 62a_100000042424_100000702267 [0,2,0,0,0,0|2,0,0]=4 5576 B13R1.150 C=C(F)CSc1cccc(c1F)Br 62a_100000702267_100000042424 [0,2,0,0,0,0|2,0,0]=4 5577 B13R1.150 C=C(F)CSc1cccc(c1F)C 62a_100000042424_100000717567 [0,2,0,0,0,0|1,0,0]=3 5578 B13R1.150 C=C(F)CSc1cccc(c1F)C 62a_100000717567_100000042424 [0,2,0,0,0,0|1,0,0]=3 5579 B13R1.150 C=C(F)CSc1cccc(c1F)Cl 62a_100000042424_100011217346 [0,2,0,0,0,0|2,0,0]=4 5580 B13R1.150 C=C(F)CSc1cccc(c1F)Cl 62a_100011217346_100000042424 [0,2,0,0,0,0|2,0,0]=4 5581 B13R1.150 C=C(F)CSc1cccc(c1F)F 62a_100000042424_100000694657 [0,2,0,0,0,0|2,0,0]=4 5582 B13R1.150 C=C(F)CSc1cccc(c1F)F 62a_100000694657_100000042424 [0,2,0,0,0,0|2,0,0]=4 5583 B13R1.150 C=C(F)CSc1cccc(c1F)N 62a_100000042424_100011935091 [0,2,0,0,0,0|2,0,0]=4 5584 B13R1.150 C=C(F)CSc1cccc(c1F)N 62a_100011935091_100000042424 [0,2,0,0,0,0|2,0,0]=4 5585 B13R1.150 C=C(F)CSc1cccc(c1F)O 62a_100000042424_100009817021 [0,2,0,0,0,0|2,0,0]=4 5586 B13R1.150 C=C(F)CSc1cccc(c1F)O 62a_100009817021_100000042424 [0,2,0,0,0,0|2,0,0]=4 5587 B13R1.150 C=C(F)CSc1cccc(c1N)Br 62a_100000042424_100010146558 [0,2,0,0,0,0|2,0,0]=4 5588 B13R1.150 C=C(F)CSc1cccc(c1N)Br 62a_100010146558_100000042424 [0,2,0,0,0,0|2,0,0]=4 5589 B13R1.150 C=C(F)CSc1cccc(c1N)C 62a_100000042424_100011834072 [0,2,0,0,0,0|1,0,0]=3 5590 B13R1.150 C=C(F)CSc1cccc(c1N)C 62a_100011834072_100000042424 [0,2,0,0,0,0|1,0,0]=3 5591 B13R1.150 C=C(F)CSc1cccc(c1N)Cl 62a_100000042424_100010190421 [0,2,0,0,0,0|2,0,0]=4 5592 B13R1.150 C=C(F)CSc1cccc(c1N)Cl 62a_100010190421_100000042424 [0,2,0,0,0,0|2,0,0]=4 5593 B13R1.150 C=C(F)CSc1cccc(c1N)F 62a_100000042321_100000042424 [0,2,0,0,0,0|2,0,0]=4 5594 B13R1.150 C=C(F)CSc1cccc(c1N)F 62a_100000042424_100000042321 [0,2,0,0,0,0|2,0,0]=4 5595 B13R1.150 C=C(F)CSc1cccc(c1N)N 62a_100015191791_100000042424 [0,2,0,0,0,0|2,0,0]=4 5596 B13R1.150 C=C(F)CSc1cccc(c1N)O 62a_100000042424_100011934926 [0,2,0,0,0,0|2,0,0]=4 5597 B13R1.150 C=C(F)CSc1cccc(c1O)Br 62a_100000042424_100010084509 [0,2,0,0,0,0|1,0,0]=3 5598 B13R1.150 C=C(F)CSc1cccc(c1O)Br 62a_100010084509_100000042424 [0,2,0,0,0,0|1,0,0]=3 5599 B13R1.150 C=C(F)CSc1cccc(c1O)C 62a_100000042424_100009817157 [0,2,0,0,0,0|0,0,0]=2 5600 B13R1.150 C=C(F)CSc1cccc(c1O)C 62a_100009817157_100000042424 [0,2,0,0,0,0|0,0,0]=2 5601 B13R1.150 C=C(F)CSc1cccc(c1O)Cl 62a_100000042424_100010202889 [0,2,0,0,0,0|1,0,0]=3 5602 B13R1.150 C=C(F)CSc1cccc(c1O)Cl 62a_100010202889_100000042424 [0,2,0,0,0,0|1,0,0]=3 5603 B13R1.150 C=C(F)CSc1cccc(c1O)F 62a_100000042424_100009813666 [0,2,0,0,0,0|1,0,0]=3 5604 B13R1.150 C=C(F)CSc1cccc(c1O)F 62a_100009813666_100000042424 [0,2,0,0,0,0|1,0,0]=3 5605 B13R1.150 C=C(F)CSc1cccc(c1O)N 62a_100000042424_100010084371 [0,2,0,0,0,0|1,0,0]=3 5606 B13R1.150 C=C(F)CSc1cccc(c1O)N 62a_100011934915_100000042424 [0,2,0,0,0,0|1,0,0]=3 5607 B13R1.150 C=C(F)CSc1cccc(c1O)O 62a_100000042424_100009815950 [0,2,0,0,0,0|1,0,0]=3 5608 B13R1.150 C=C(F)CSc1cccn(c1=O)C 62a_100000042424_100000687173 [0,2,0,0,0,0|1,0,1]=4 5609 B13R1.150 C=C(F)CSc1cccn(c1=O)C 62a_100000687173_100000042424 [0,2,0,0,0,0|1,0,1]=4 5610 B13R1.150 C=C(F)CSc1ccnc(c1C)C 62a_100000042424_100009846815 [0,2,0,0,0,0|2,0,0]=4 5611 B13R1.150 C=C(F)CSc1ccnc(c1C)C 62a_100009846815_100000042424 [0,2,0,0,0,0|2,0,0]=4 5612 B13R1.150 C=C(F)CSc1ccnc(c1Cl)C 62a_100000042424_100000698670 [0,2,0,0,0,0|2,0,0]=4 5613 B13R1.150 C=C(F)CSc1ccnc(c1Cl)C 62a_100000698670_100000042424 [0,2,0,0,0,0|2,0,0]=4 5614 B13R1.150 C=C(F)CSc1ccnc(c1F)C 62a_100000042424_100009849794 [0,2,0,0,0,0|2,0,0]=4 5615 B13R1.150 C=C(F)CSc1ccnc(c1F)C 62a_100009849794_100000042424 [0,2,0,0,0,0|2,0,0]=4 5616 B13R1.150 C=C(F)CSc1ccnc(c1N)C 62a_100000042424_100009885578 [0,2,0,0,0,0|2,0,0]=4 5617 B13R1.150 C=C(F)CSc1ccnc(c1N)C 62a_100009885578_100000042424 [0,2,0,0,0,0|2,0,0]=4 5618 B13R1.150 C=C(F)CSc1ccnc(c1O)Cl 62a_100000042424_100010067911 [0,2,0,0,0,0|2,0,0]=4 5619 B13R1.150 C=C(F)CSc1cncc(c1C)C 62a_100000042424_100009864703 [0,2,0,0,0,0|2,0,0]=4 5620 B13R1.150 C=C(F)CSc1cncc(c1C)C 62a_100009864703_100000042424 [0,2,0,0,0,0|2,0,0]=4 5621 B13R1.150 C=C(F)CSc1cncc(c1N)C 62a_100000042424_100009818025 [0,2,0,0,0,0|2,0,0]=4 5622 B13R1.150 C=C(F)CSc1cncc(c1N)C 62a_100009818025_100000042424 [0,2,0,0,0,0|2,0,0]=4 5623 B13R1.150 C=C(F)CSc1cncc(c1O)N 62a_100000042424_100000694263 [0,2,0,0,0,0|2,0,0]=4 5624 B13R1.150 C=C(F)CSc1cncc(c1O)N 62a_100000694263_100000042424 [0,2,0,0,0,0|2,0,0]=4 5625 B13R1.150 C=C(F)CSc1nccc(c1C)C 62a_100000042424_100009847204 [0,2,0,0,0,0|2,0,0]=4 5626 B13R1.150 C=C(F)CSc1nccc(c1C)C 62a_100009847204_100000042424 [0,2,0,0,0,0|2,0,0]=4 5627 B13R1.150 C=C(F)CSc1nccc(c1F)C 62a_100000042424_100009817629 [0,2,0,0,0,0|2,0,0]=4 5628 B13R1.150 C=C(F)CSc1nccc(c1F)C 62a_100009817629_100000042424 [0,2,0,0,0,0|2,0,0]=4 5629 B13R1.150 C=C(F)CSc1nccc(c1N)C 62a_100000042424_100000763560 [0,2,0,0,0,0|2,0,0]=4 5630 B13R1.150 C=C(F)CSc1nccc(c1N)C 62a_100000763560_100000042424 [0,2,0,0,0,0|2,0,0]=4 5631 B13R1.150 C=C(F)CSc1nccc(c1O)C 62a_100000042424_100000696282 [0,2,0,0,0,0|1,0,0]=3 5632 B13R1.150 C=C(F)CSc1nccc(c1O)F 62a_100000042424_100009867227 [0,2,0,0,0,0|2,0,0]=4 5633 B13R1.150 C=C(F)CSc1nccc(c1O)N 62a_100000042424_100009844647 [0,2,0,0,0,0|2,0,0]=4 5634 B13R1.150 CC(=O)CCc1cccc(c1C)C 1458a_100011218151_200000210301 [0,2,0,0,0,0|1,0,1]=4 5635 B13R1.150 CC(=O)CCc1cccc(c1O)O 1458a_100009873524_200000210301 [0,2,0,0,0,0|1,0,1]=4 5636 B13R1.150 CC(=O)COc1cccc(c1C)C 1458a_200000183798_200000210301 [0,2,0,0,0,0|1,0,1]=4 5637 B13R1.150 CC(=O)NCc1cccc(c1C)C 11a_100011211637_100015343762 [0,2,0,0,0,0|1,0,1]=4 5638 B13R1.150 CC(=O)NCc1cccc(c1C)C 1626a_100011211637_100015343762 [0,2,0,0,0,0|1,0,1]=4 5639 B13R1.150 CC(=O)NCc1cccc(c1C)C 240690a_100011211637_100015343762 [0,2,0,0,0,0|1,0,1]=4 5640 B13R1.150 CC(=O)NCc1cccc(c1C)C 527a_100011211637_100103153847 [0,2,0,0,0,0|1,0,1]=4 5641 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 11a_100025705714_100015343762 [0,2,0,0,0,0|1,0,1]=4 5642 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 1626a_100025705714_100015343762 [0,2,0,0,0,0|1,0,1]=4 5643 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 240690a_100025705714_100015343762 [0,2,0,0,0,0|1,0,1]=4 5644 B13R1.150 CC(=O)NCc1cccc(c1Cl)C 527a_100025705714_100103153847 [0,2,0,0,0,0|1,0,1]=4 5645 B13R1.150 CC(=O)NCc1cccc(c1F)C 11a_100012002060_100015343762 [0,2,0,0,0,0|1,0,1]=4 5646 B13R1.150 CC(=O)NCc1cccc(c1F)C 1626a_100012002060_100015343762 [0,2,0,0,0,0|1,0,1]=4 5647 B13R1.150 CC(=O)NCc1cccc(c1F)C 240690a_100012002060_100015343762 [0,2,0,0,0,0|1,0,1]=4 5648 B13R1.150 CC(=O)NCc1cccc(c1F)C 527a_100012002060_100103153847 [0,2,0,0,0,0|1,0,1]=4 5649 B13R1.150 CC(=O)NCc1cccc(c1O)C 11a_100020639391_100015343762 [0,2,0,0,0,0|0,0,1]=3 5650 B13R1.150 CC(=O)NCc1cccc(c1O)C 240690a_100020639391_100015343762 [0,2,0,0,0,0|0,0,1]=3 5651 B13R1.150 CC(=O)NCc1cccc(c1O)C 527a_100020639391_100103153847 [0,2,0,0,0,0|0,0,1]=3 5652 B13R1.150 Cc1cccc(c1Br)NCC(=O)N 34a_100000684715_100000187820 [0,2,0,0,0,0|2,0,0]=4 5653 B13R1.150 Cc1cccc(c1Br)NCC(=O)[O-] 34a_100000684715_100020667443 [0,2,0,0,0,0|2,0,0]=4 5654 B13R1.150 Cc1cccc(c1Br)OCC(=O)N 34a_100000686692_100000187820 [0,2,0,0,0,0|2,0,0]=4 5655 B13R1.150 Cc1cccc(c1Br)OCC(=O)N 7a_100000686692_100000187820 [0,2,0,0,0,0|2,0,0]=4 5656 B13R1.150 Cc1cccc(c1Br)OCC(=O)[O-] 34a_100000686692_100020667443 [0,2,0,0,0,0|2,0,0]=4 5657 B13R1.150 Cc1cccc(c1Br)SCC(=O)N 62a_100000747473_100012362457 [0,2,0,0,0,0|2,0,0]=4 5658 B13R1.150 Cc1cccc(c1Br)SCC(=O)N 62a_100012362457_100000747473 [0,2,0,0,0,0|2,0,0]=4 5659 B13R1.150 Cc1cccc(c1Br)SCC(=O)[O-] 62a_100012362457_100020667443 [0,2,0,0,0,0|2,0,0]=4 5660 B13R1.150 Cc1cccc(c1Br)SCC(=O)[O-] 62a_100020667443_100012362457 [0,2,0,0,0,0|2,0,0]=4 5661 B13R1.150 Cc1cccc(c1C)CCC(=O)[13CH3] 1458a_100011218151_200025704644 [0,2,0,0,0,0|1,0,1]=4 5662 B13R1.150 Cc1cccc(c1C)NCC(=O)N 2230a_100000210026_100000747473 [0,2,0,0,0,0|2,0,0]=4 5663 B13R1.150 Cc1cccc(c1C)NCC(=O)N 34a_100000210026_100000187820 [0,2,0,0,0,0|2,0,0]=4 5664 B13R1.150 Cc1cccc(c1C)NCC(=O)N 7a_100000210026_100000187820 [0,2,0,0,0,0|2,0,0]=4 5665 B13R1.150 Cc1cccc(c1C)NCC(=O)[O-] 34a_100000210026_100020667443 [0,2,0,0,0,0|2,0,0]=4 5666 B13R1.150 Cc1cccc(c1C)OCC(=O)N 34a_100000185855_100000187820 [0,2,0,0,0,0|2,0,0]=4 5667 B13R1.150 Cc1cccc(c1C)OCC(=O)N 7a_100000185855_100000187820 [0,2,0,0,0,0|2,0,0]=4 5668 B13R1.150 Cc1cccc(c1C)OCC(=O)[13CH3] 1458a_200000183798_200025704644 [0,2,0,0,0,0|1,0,1]=4 5669 B13R1.150 Cc1cccc(c1C)OCC(=O)[O-] 34a_100000185855_100020667443 [0,2,0,0,0,0|2,0,0]=4 5670 B13R1.150 Cc1cccc(c1C)SCC(=O)N 62a_100000747473_100011214922 [0,2,0,0,0,0|2,0,0]=4 5671 B13R1.150 Cc1cccc(c1C)SCC(=O)N 62a_100011214922_100000747473 [0,2,0,0,0,0|2,0,0]=4 5672 B13R1.150 Cc1cccc(c1C)SCC(=O)[O-] 62a_100011214922_100020667443 [0,2,0,0,0,0|2,0,0]=4 5673 B13R1.150 Cc1cccc(c1C)SCC(=O)[O-] 62a_100020667443_100011214922 [0,2,0,0,0,0|2,0,0]=4 5674 B13R1.150 Cc1cccc(c1Cl)NCC(=O)N 34a_100000765562_100000187820 [0,2,0,0,0,0|2,0,0]=4 5675 B13R1.150 Cc1cccc(c1Cl)NCC(=O)N 7a_100000765562_100000187820 [0,2,0,0,0,0|2,0,0]=4 5676 B13R1.150 Cc1cccc(c1Cl)NCC(=O)[O-] 34a_100000765562_100020667443 [0,2,0,0,0,0|2,0,0]=4 5677 B13R1.150 Cc1cccc(c1Cl)OCC(=O)N 34a_100000695629_100000187820 [0,2,0,0,0,0|2,0,0]=4 5678 B13R1.150 Cc1cccc(c1Cl)OCC(=O)N 7a_100000695629_100000187820 [0,2,0,0,0,0|2,0,0]=4 5679 B13R1.150 Cc1cccc(c1Cl)OCC(=O)[O-] 34a_100000695629_100020667443 [0,2,0,0,0,0|2,0,0]=4 5680 B13R1.150 Cc1cccc(c1Cl)SCC(=O)N 62a_100000747473_200012352035 [0,2,0,0,0,0|2,0,0]=4 5681 B13R1.150 Cc1cccc(c1Cl)SCC(=O)N 62a_200012352035_100000747473 [0,2,0,0,0,0|2,0,0]=4 5682 B13R1.150 Cc1cccc(c1Cl)SCC(=O)[O-] 62a_100020667443_200012352035 [0,2,0,0,0,0|2,0,0]=4 5683 B13R1.150 Cc1cccc(c1Cl)SCC(=O)[O-] 62a_200012352035_100020667443 [0,2,0,0,0,0|2,0,0]=4 5684 B13R1.150 Cc1cccc(c1F)NCC(=O)N 2230a_100000697159_100000747473 [0,2,0,0,0,0|2,0,0]=4 5685 B13R1.150 Cc1cccc(c1F)NCC(=O)N 34a_100000697159_100000187820 [0,2,0,0,0,0|2,0,0]=4 5686 B13R1.150 Cc1cccc(c1F)NCC(=O)N 7a_100000697159_100000187820 [0,2,0,0,0,0|2,0,0]=4 5687 B13R1.150 Cc1cccc(c1F)NCC(=O)[O-] 34a_100000697159_100020667443 [0,2,0,0,0,0|2,0,0]=4 5688 B13R1.150 Cc1cccc(c1F)OCC(=O)N 34a_100000751311_100000187820 [0,2,0,0,0,0|2,0,0]=4 5689 B13R1.150 Cc1cccc(c1F)OCC(=O)N 7a_100000751311_100000187820 [0,2,0,0,0,0|2,0,0]=4 5690 B13R1.150 Cc1cccc(c1F)OCC(=O)[O-] 34a_100000751311_100020667443 [0,2,0,0,0,0|2,0,0]=4 5691 B13R1.150 Cc1cccc(c1F)SCC(=O)N 62a_100000717567_100000747473 [0,2,0,0,0,0|2,0,0]=4 5692 B13R1.150 Cc1cccc(c1F)SCC(=O)N 62a_100000747473_100000717567 [0,2,0,0,0,0|2,0,0]=4 5693 B13R1.150 Cc1cccc(c1F)SCC(=O)[O-] 62a_100000717567_100020667443 [0,2,0,0,0,0|2,0,0]=4 5694 B13R1.150 Cc1cccc(c1F)SCC(=O)[O-] 62a_100020667443_100000717567 [0,2,0,0,0,0|2,0,0]=4 5695 B13R1.150 Cc1cccc(c1I)NCC(=O)N 34a_100000761888_100000187820 [0,2,0,0,0,0|2,0,0]=4 5696 B13R1.150 Cc1cccc(c1I)NCC(=O)[O-] 34a_100000761888_100020667443 [0,2,0,0,0,0|2,0,0]=4 5697 B13R1.150 Cc1cccc(c1I)OCC(=O)N 34a_100010083724_100000187820 [0,2,0,0,0,0|2,0,0]=4 5698 B13R1.150 Cc1cccc(c1I)OCC(=O)N 7a_100010083724_100000187820 [0,2,0,0,0,0|2,0,0]=4 5699 B13R1.150 Cc1cccc(c1I)OCC(=O)[O-] 34a_100010083724_100020667443 [0,2,0,0,0,0|2,0,0]=4 5700 B13R1.150 Cc1cccc(c1N)OCC(=O)N 34a_100000743429_100000187820 [0,2,0,0,0,0|2,0,0]=4 5701 B13R1.150 Cc1cccc(c1N)OCC(=O)N 7a_100000743429_100000187820 [0,2,0,0,0,0|2,0,0]=4 5702 B13R1.150 Cc1cccc(c1N)OCC(=O)[O-] 34a_100000743429_100020667443 [0,2,0,0,0,0|2,0,0]=4 5703 B13R1.150 Cc1cccc(c1N)SCC(=O)N 62a_100000747473_100011834072 [0,2,0,0,0,0|2,0,0]=4 5704 B13R1.150 Cc1cccc(c1N)SCC(=O)N 62a_100011834072_100000747473 [0,2,0,0,0,0|2,0,0]=4 5705 B13R1.150 Cc1cccc(c1N)SCC(=O)[O-] 62a_100011834072_100020667443 [0,2,0,0,0,0|2,0,0]=4 5706 B13R1.150 Cc1cccc(c1N)SCC(=O)[O-] 62a_100020667443_100011834072 [0,2,0,0,0,0|2,0,0]=4 5707 B13R1.150 Cc1cccc(c1O)C=CC(C)C 271570a_100016257149_100009817157 [0,2,0,0,0,0|0,0,2]=4 5708 B13R1.150 Cc1cccc(c1O)C=CC(C)O 271570a_200011019289_100009817157 [0,2,0,0,0,0|0,0,2]=4 5709 B13R1.150 Cc1cccc(c1O)CNC(C)C 34a_100020639391_100000210206 [0,2,0,0,0,0|0,0,2]=4 5710 B13R1.150 Cc1cccc(c1O)NCC(=O)N 34a_100000756359_100000187820 [0,2,0,0,0,0|1,0,0]=3 5711 B13R1.150 Cc1cccc(c1O)NCC(=O)[O-] 34a_100000756359_100020667443 [0,2,0,0,0,0|1,0,0]=3 5712 B13R1.150 Cc1cccc(c1O)NCC(C)C 34a_100000756359_100000210624 [0,2,0,0,0,0|0,0,2]=4 5713 B13R1.150 Cc1cccc(c1O)NCC(C)O 34a_100000756359_100011218427 [0,2,0,0,0,0|0,0,2]=4 5714 B13R1.150 Cc1cccc(c1O)NCC(F)F 34a_100000756359_100011934356 [0,2,0,0,0,0|1,0,1]=4 5715 B13R1.150 Cc1cccc(c1O)NC[C@@H](C)O 34a_100000756359_100009817552 [0,2,0,0,0,0|0,0,2]=4 5716 B13R1.150 Cc1cccc(c1O)NC[N+](=O)[O-] 34a_100000756359_100000761209 [0,2,0,0,0,0|2,0,0]=4 5717 B13R1.150 Cc1cccc(c1O)SCC(=O)N 62a_100000747473_100009817157 [0,2,0,0,0,0|1,0,0]=3 5718 B13R1.150 Cc1cccc(c1O)SCC(=O)N 62a_100009817157_100000747473 [0,2,0,0,0,0|1,0,0]=3 5719 B13R1.150 Cc1cccc(c1O)SCC(=O)[O-] 62a_100009817157_100020667443 [0,2,0,0,0,0|1,0,0]=3 5720 B13R1.150 Cc1cccc(c1O)SCC(=O)[O-] 62a_100020667443_100009817157 [0,2,0,0,0,0|1,0,0]=3 5721 B13R1.150 Cc1cccc(c1O)SCC(C)C 62a_100000210624_100009817157 [0,2,0,0,0,0|0,0,2]=4 5722 B13R1.150 Cc1cccc(c1O)SCC(C)C 62a_100009817157_100000210760 [0,2,0,0,0,0|0,0,2]=4 5723 B13R1.150 Cc1cccc(c1O)SCC(C)O 62a_100009817157_100011218427 [0,2,0,0,0,0|0,0,2]=4 5724 B13R1.150 Cc1cccc(c1O)SCC(C)O 62a_100011218427_100009817157 [0,2,0,0,0,0|0,0,2]=4 5725 B13R1.150 Cc1cccc(c1O)SCC(F)F 62a_100009817157_100011934356 [0,2,0,0,0,0|1,0,1]=4 5726 B13R1.150 Cc1cccc(c1O)SCC(F)F 62a_100011934356_100009817157 [0,2,0,0,0,0|1,0,1]=4 5727 B13R1.150 Cc1cccc(c1O)SC[C@@H](C)O 62a_100009817157_100009817552 [0,2,0,0,0,0|0,0,2]=4 5728 B13R1.150 Cc1cccc(c1O)SC[C@@H](C)O 62a_100009817552_100009817157 [0,2,0,0,0,0|0,0,2]=4 5729 B13R1.150 Cc1cccc(c1O)SC[N+](=O)[O-] 62a_100009817157_100000761209 [0,2,0,0,0,0|2,0,0]=4 5730 B13R1.150 Cc1ccnc(c1O)SCC(=O)N 62a_100000747473_100000696282 [0,2,0,0,0,0|2,0,0]=4 5731 B13R1.150 Cc1ccnc(c1O)SCC(=O)[O-] 62a_100020667443_100000696282 [0,2,0,0,0,0|2,0,0]=4 5732 B13R1.150 NC(=O)CNc1cccc(c1O)Br 34a_100011934915_100000187820 [0,2,0,0,0,0|2,0,0]=4 5733 B13R1.150 NC(=O)CNc1cccc(c1O)Cl 34a_100000754742_100000187820 [0,2,0,0,0,0|2,0,0]=4 5734 B13R1.150 NC(=O)CNc1cccc(c1O)F 34a_100011934987_100000187820 [0,2,0,0,0,0|2,0,0]=4 5735 B13R1.150 NC(=O)CSc1cccc(c1O)Br 62a_100000747473_100010084509 [0,2,0,0,0,0|2,0,0]=4 5736 B13R1.150 NC(=O)CSc1cccc(c1O)Br 62a_100010084509_100000747473 [0,2,0,0,0,0|2,0,0]=4 5737 B13R1.150 NC(=O)CSc1cccc(c1O)Cl 62a_100000747473_100010202889 [0,2,0,0,0,0|2,0,0]=4 5738 B13R1.150 NC(=O)CSc1cccc(c1O)Cl 62a_100010202889_100000747473 [0,2,0,0,0,0|2,0,0]=4 5739 B13R1.150 NC(=O)CSc1cccc(c1O)F 62a_100000747473_100009813666 [0,2,0,0,0,0|2,0,0]=4 5740 B13R1.150 NC(=O)CSc1cccc(c1O)F 62a_100009813666_100000747473 [0,2,0,0,0,0|2,0,0]=4 5741 B13R1.150 NC(=O)CSc1cccc(c1O)N 62a_100000747473_100010084371 [0,2,0,0,0,0|2,0,0]=4 5742 B13R1.150 NC(=O)CSc1cccc(c1O)N 62a_100011934915_100000747473 [0,2,0,0,0,0|2,0,0]=4 5743 B13R1.150 NC(=O)CSc1cccc(c1O)O 62a_100000747473_100009815950 [0,2,0,0,0,0|2,0,0]=4 5744 B13R1.150 Nc1cccc(c1O)SCC(=O)[O-] 62a_100011934915_100020667443 [0,2,0,0,0,0|2,0,0]=4 5745 B13R1.150 Nc1cccc(c1O)SCC(=O)[O-] 62a_100020667443_100010084371 [0,2,0,0,0,0|2,0,0]=4 5746 B13R1.150 O=C([O-])CNc1cccc(c1O)Br 34a_100011934915_100020667443 [0,2,0,0,0,0|2,0,0]=4 5747 B13R1.150 O=C([O-])CNc1cccc(c1O)Cl 34a_100000754742_100020667443 [0,2,0,0,0,0|2,0,0]=4 5748 B13R1.150 O=C([O-])CNc1cccc(c1O)F 34a_100011934987_100020667443 [0,2,0,0,0,0|2,0,0]=4 5749 B13R1.150 O=C([O-])CSc1cccc(c1O)Br 62a_100010084509_100020667443 [0,2,0,0,0,0|2,0,0]=4 5750 B13R1.150 O=C([O-])CSc1cccc(c1O)Br 62a_100020667443_100010084509 [0,2,0,0,0,0|2,0,0]=4 5751 B13R1.150 O=C([O-])CSc1cccc(c1O)Cl 62a_100010202889_100020667443 [0,2,0,0,0,0|2,0,0]=4 5752 B13R1.150 O=C([O-])CSc1cccc(c1O)Cl 62a_100020667443_100010202889 [0,2,0,0,0,0|2,0,0]=4 5753 B13R1.150 O=C([O-])CSc1cccc(c1O)F 62a_100009813666_100020667443 [0,2,0,0,0,0|2,0,0]=4 5754 B13R1.150 O=C([O-])CSc1cccc(c1O)F 62a_100020667443_100009813666 [0,2,0,0,0,0|2,0,0]=4 5755 B13R1.150 O=C([O-])CSc1cccc(c1O)O 62a_100020667443_100009815950 [0,2,0,0,0,0|2,0,0]=4 5756 B13R1.150 [13CH3]C(=O)CCc1cccc(c1O)O 1458a_100009873524_200025704644 [0,2,0,0,0,0|1,0,1]=4 5757 B13R1.569 C#CCNc1cccc(c1O)OC 34a_100000123586_100000184674 [0,2,0,0,0,0|0,0,2]=4 5758 B13R1.569 C#CCSc1cccc(c1O)CC 62a_100000038162_200010001580 [0,2,0,0,0,0|0,0,2]=4 5759 B13R1.569 C#CCSc1cccc(c1O)OC 62a_100000038162_100000686866 [0,2,0,0,0,0|0,0,2]=4 5760 B13R1.569 C=CCNc1cccc(c1Br)C#N 34a_100009877206_100015514636 [0,2,0,0,0,0|1,0,1]=4 5761 B13R1.569 C=CCNc1cccc(c1Br)OC 34a_100000703447_100015514636 [0,2,0,0,0,0|1,0,0]=3 5762 B13R1.569 C=CCNc1cccc(c1C)CO 2230a_102495339961_100000210623 [0,2,0,0,0,0|1,0,0]=3 5763 B13R1.569 C=CCNc1cccc(c1C)CO 34a_102495339961_100015514636 [0,2,0,0,0,0|1,0,0]=3 5764 B13R1.569 C=CCNc1cccc(c1C)OC 34a_100011244893_100015514636 [0,2,0,0,0,0|1,0,0]=3 5765 B13R1.569 C=CCNc1cccc(c1C)OC 7a_100011244893_100015514636 [0,2,0,0,0,0|1,0,0]=3 5766 B13R1.569 C=CCNc1cccc(c1Cl)C#N 34a_100012184300_100015514636 [0,2,0,0,0,0|1,0,1]=4 5767 B13R1.569 C=CCNc1cccc(c1Cl)OC 34a_100000089720_100015514636 [0,2,0,0,0,0|1,0,0]=3 5768 B13R1.569 C=CCNc1cccc(c1F)C#N 34a_100000087142_100015514636 [0,2,0,0,0,0|1,0,1]=4 5769 B13R1.569 C=CCNc1cccc(c1F)CO 34a_100012023829_100015514636 [0,2,0,0,0,0|1,0,0]=3 5770 B13R1.569 C=CCNc1cccc(c1F)OC 34a_100000100910_100015514636 [0,2,0,0,0,0|1,0,0]=3 5771 B13R1.569 C=CCNc1cccc(c1I)OC 34a_100010245509_100015514636 [0,2,0,0,0,0|1,0,0]=3 5772 B13R1.569 C=CCNc1cccc(c1O)OC 34a_100000123586_100015514636 [0,2,0,0,0,0|0,0,0]=2 5773 B13R1.569 C=CCOc1cccc(c1Br)C#N 34a_100009818990_100015514636 [0,2,0,0,0,0|1,0,1]=4 5774 B13R1.569 C=CCOc1cccc(c1Br)C#N 7a_100009818990_100015514636 [0,2,0,0,0,0|1,0,1]=4 5775 B13R1.569 C=CCOc1cccc(c1Br)OC 34a_100010202623_100015514636 [0,2,0,0,0,0|1,0,0]=3 5776 B13R1.569 C=CCOc1cccc(c1Br)OC 7a_100010202623_100015514636 [0,2,0,0,0,0|1,0,0]=3 5777 B13R1.569 C=CCOc1cccc(c1C)C#N 34a_100000079589_100015514636 [0,2,0,0,0,0|1,0,1]=4 5778 B13R1.569 C=CCOc1cccc(c1C)C#N 7a_100000079589_100015514636 [0,2,0,0,0,0|1,0,1]=4 5779 B13R1.569 C=CCOc1cccc(c1C)CO 34a_200000084602_100015514636 [0,2,0,0,0,0|1,0,0]=3 5780 B13R1.569 C=CCOc1cccc(c1C)CO 7a_200000084602_100015514636 [0,2,0,0,0,0|1,0,0]=3 5781 B13R1.569 C=CCOc1cccc(c1Cl)C#N 34a_200009871651_100015514636 [0,2,0,0,0,0|1,0,1]=4 5782 B13R1.569 C=CCOc1cccc(c1Cl)C#N 7a_200009871651_100015514636 [0,2,0,0,0,0|1,0,1]=4 5783 B13R1.569 C=CCOc1cccc(c1Cl)OC 34a_100000087810_100015514636 [0,2,0,0,0,0|1,0,0]=3 5784 B13R1.569 C=CCOc1cccc(c1Cl)OC 7a_100000087810_100015514636 [0,2,0,0,0,0|1,0,0]=3 5785 B13R1.569 C=CCOc1cccc(c1F)C#N 34a_200000094591_100015514636 [0,2,0,0,0,0|1,0,1]=4 5786 B13R1.569 C=CCOc1cccc(c1F)C#N 7a_200000094591_100015514636 [0,2,0,0,0,0|1,0,1]=4 5787 B13R1.569 C=CCOc1cccc(c1F)CN 34a_100025773512_100015514636 [0,2,0,0,0,0|1,0,0]=3 5788 B13R1.569 C=CCOc1cccc(c1F)OC 34a_100000102366_100015514636 [0,2,0,0,0,0|1,0,0]=3 5789 B13R1.569 C=CCOc1cccc(c1F)OC 7a_100000102366_100015514636 [0,2,0,0,0,0|1,0,0]=3 5790 B13R1.569 C=CCOc1cccc(c1I)OC 34a_200010201982_100015514636 [0,2,0,0,0,0|1,0,0]=3 5791 B13R1.569 C=CCOc1cccc(c1I)OC 7a_200010201982_100015514636 [0,2,0,0,0,0|1,0,0]=3 5792 B13R1.569 C=CCOc1cccc(c1N)OC 34a_100012022766_100015514636 [0,2,0,0,0,0|1,0,0]=3 5793 B13R1.569 C=CCOc1cccc(c1N)OC 7a_100012022766_100015514636 [0,2,0,0,0,0|1,0,0]=3 5794 B13R1.569 C=CCSc1cccc(c1Br)CO 62a_100000210623_100010240205 [0,2,0,0,0,0|1,0,0]=3 5795 B13R1.569 C=CCSc1cccc(c1Br)CO 62a_100010240205_100000210623 [0,2,0,0,0,0|1,0,0]=3 5796 B13R1.569 C=CCSc1cccc(c1Br)OC 62a_100000210623_100010146559 [0,2,0,0,0,0|1,0,0]=3 5797 B13R1.569 C=CCSc1cccc(c1Br)OC 62a_100010146559_100000210623 [0,2,0,0,0,0|1,0,0]=3 5798 B13R1.569 C=CCSc1cccc(c1C)C#N 62a_100000210623_100000721996 [0,2,0,0,0,0|1,0,1]=4 5799 B13R1.569 C=CCSc1cccc(c1C)C=O 62a_100000210623_100012179384 [0,2,0,0,0,0|1,0,1]=4 5800 B13R1.569 C=CCSc1cccc(c1C)C=O 62a_100012179384_100000210623 [0,2,0,0,0,0|1,0,1]=4 5801 B13R1.569 C=CCSc1cccc(c1C)CN 62a_100000210623_100000724210 [0,2,0,0,0,0|1,0,0]=3 5802 B13R1.569 C=CCSc1cccc(c1C)CN 62a_100000724210_100000210623 [0,2,0,0,0,0|1,0,0]=3 5803 B13R1.569 C=CCSc1cccc(c1C)CO 62a_100000210623_100000694458 [0,2,0,0,0,0|1,0,0]=3 5804 B13R1.569 C=CCSc1cccc(c1C)CO 62a_100000694458_100000210623 [0,2,0,0,0,0|1,0,0]=3 5805 B13R1.569 C=CCSc1cccc(c1C)OC 62a_100000210623_100010002647 [0,2,0,0,0,0|1,0,0]=3 5806 B13R1.569 C=CCSc1cccc(c1C)OC 62a_100010002647_100000210623 [0,2,0,0,0,0|1,0,0]=3 5807 B13R1.569 C=CCSc1cccc(c1Cl)OC 62a_100000210623_100010147677 [0,2,0,0,0,0|1,0,0]=3 5808 B13R1.569 C=CCSc1cccc(c1Cl)OC 62a_100010147677_100000210623 [0,2,0,0,0,0|1,0,0]=3 5809 B13R1.569 C=CCSc1cccc(c1F)C#N 62a_100000210623_100000239898 [0,2,0,0,0,0|1,0,1]=4 5810 B13R1.569 C=CCSc1cccc(c1F)C=C 62a_100000210623_100010741937 [0,2,0,0,0,0|1,0,1]=4 5811 B13R1.569 C=CCSc1cccc(c1F)C=C 62a_100010741937_100000210623 [0,2,0,0,0,0|1,0,1]=4 5812 B13R1.569 C=CCSc1cccc(c1F)C=O 62a_100000210623_100000766533 [0,2,0,0,0,0|1,0,1]=4 5813 B13R1.569 C=CCSc1cccc(c1F)C=O 62a_100000766533_100000210623 [0,2,0,0,0,0|1,0,1]=4 5814 B13R1.569 C=CCSc1cccc(c1F)CN 62a_100000210623_100015189953 [0,2,0,0,0,0|1,0,0]=3 5815 B13R1.569 C=CCSc1cccc(c1F)CN 62a_100015189953_100000210623 [0,2,0,0,0,0|1,0,0]=3 5816 B13R1.569 C=CCSc1cccc(c1F)CO 62a_100000210623_100011935076 [0,2,0,0,0,0|1,0,0]=3 5817 B13R1.569 C=CCSc1cccc(c1F)CO 62a_100011935076_100000210623 [0,2,0,0,0,0|1,0,0]=3 5818 B13R1.569 C=CCSc1cccc(c1F)OC 62a_100000210623_100010185846 [0,2,0,0,0,0|1,0,0]=3 5819 B13R1.569 C=CCSc1cccc(c1F)OC 62a_100010185846_100000210623 [0,2,0,0,0,0|1,0,0]=3 5820 B13R1.569 C=CCSc1cccc(c1N)C#N 62a_100000210623_100011934406 [0,2,0,0,0,0|1,0,1]=4 5821 B13R1.569 C=CCSc1cccc(c1N)C=O 62a_100010144990_100000210623 [0,2,0,0,0,0|1,0,1]=4 5822 B13R1.569 C=CCSc1cccc(c1N)CO 62a_100000210623_100012349457 [0,2,0,0,0,0|1,0,0]=3 5823 B13R1.569 C=CCSc1cccc(c1N)CO 62a_100012349457_100000210623 [0,2,0,0,0,0|1,0,0]=3 5824 B13R1.569 C=CCSc1cccc(c1N)NC 62a_100000695761_100000210623 [0,2,0,0,0,0|1,0,0]=3 5825 B13R1.569 C=CCSc1cccc(c1N)OC 62a_100000708083_100000210623 [0,2,0,0,0,0|1,0,0]=3 5826 B13R1.569 C=CCSc1cccc(c1O)C#N 62a_100000210623_100009817103 [0,2,0,0,0,0|0,0,1]=3 5827 B13R1.569 C=CCSc1cccc(c1O)C=O 62a_100000210623_100010171435 [0,2,0,0,0,0|0,0,1]=3 5828 B13R1.569 C=CCSc1cccc(c1O)CC 62a_100000210623_200010001580 [0,2,0,0,0,0|0,0,0]=2 5829 B13R1.569 C=CCSc1cccc(c1O)CC 62a_200010001580_100000210623 [0,2,0,0,0,0|0,0,0]=2 5830 B13R1.569 C=CCSc1cccc(c1O)OC 62a_100000210623_100000686866 [0,2,0,0,0,0|0,0,0]=2 5831 B13R1.569 C=CCSc1ccnc(c1C)OC 62a_100000210623_100010068544 [0,2,0,0,0,0|2,0,0]=4 5832 B13R1.569 C=CCSc1ccnc(c1C)OC 62a_100010068544_100000210623 [0,2,0,0,0,0|2,0,0]=4 5833 B13R1.569 C=CCSc1ccnc(c1F)OC 62a_100000210623_100009885657 [0,2,0,0,0,0|2,0,0]=4 5834 B13R1.569 C=CCSc1ccnc(c1F)OC 62a_100009885657_100000210623 [0,2,0,0,0,0|2,0,0]=4 5835 B13R1.569 C=CCSc1cncc(c1C)OC 62a_100000210623_100010136163 [0,2,0,0,0,0|2,0,0]=4 5836 B13R1.569 C=CCSc1cncc(c1C)OC 62a_100010136163_100000210623 [0,2,0,0,0,0|2,0,0]=4 5837 B13R1.569 C=CCSc1cncc(c1N)CO 62a_100000210623_200010988789 [0,2,0,0,0,0|2,0,0]=4 5838 B13R1.569 C=CCSc1cncc(c1N)CO 62a_200010988789_100000210623 [0,2,0,0,0,0|2,0,0]=4 5839 B13R1.569 C=CCSc1cncc(c1O)C=O 62a_100000210623_100010729654 [0,2,0,0,0,0|1,0,1]=4 5840 B13R1.569 C=CCSc1cncc(c1O)C=O 62a_100010729654_100000210623 [0,2,0,0,0,0|1,0,1]=4 5841 B13R1.569 C=CCSc1nccc(c1C)OC 62a_100000210623_100010067686 [0,2,0,0,0,0|2,0,0]=4 5842 B13R1.569 C=CCSc1nccc(c1C)OC 62a_100010067686_100000210623 [0,2,0,0,0,0|2,0,0]=4 5843 B13R1.569 C=CCSc1nccc(c1F)CO 62a_100000101314_100000210623 [0,2,0,0,0,0|2,0,0]=4 5844 B13R1.569 C=CCSc1nccc(c1F)CO 62a_100000210623_100000101314 [0,2,0,0,0,0|2,0,0]=4 5845 B13R1.569 C=CCSc1nccc(c1F)OC 62a_100000210623_200010136267 [0,2,0,0,0,0|2,0,0]=4 5846 B13R1.569 C=CCSc1nccc(c1F)OC 62a_200010136267_100000210623 [0,2,0,0,0,0|2,0,0]=4 5847 B13R1.569 C=CCSc1nccc(c1F)SC 62a_100000210623_200021123860 [0,2,0,0,0,0|2,0,0]=4 5848 B13R1.569 C=CCSc1nccc(c1F)SC 62a_200021123860_100000210623 [0,2,0,0,0,0|2,0,0]=4 5849 B13R1.569 C=CCSc1nccc(c1N)NC 62a_100000210623_200000076579 [0,2,0,0,0,0|2,0,0]=4 5850 B13R1.569 C=CCSc1nccc(c1N)OC 62a_100000210623_100000100113 [0,2,0,0,0,0|2,0,0]=4 5851 B13R1.569 C=CCSc1nccc(c1N)OC 62a_100010233645_100000210623 [0,2,0,0,0,0|2,0,0]=4 5852 B13R1.569 CCCCc1cccc(c1O)CC 271570a_100020621405_200010001580 [0,2,0,0,0,0|0,0,2]=4 5853 B13R1.569 CCCCc1cccc(c1O)OC 271570a_100020621405_100000686866 [0,2,0,0,0,0|0,0,2]=4 5854 B13R1.569 CCCNc1cccc(c1O)OC 34a_100000123586_100000210303 [0,2,0,0,0,0|0,0,2]=4 5855 B13R1.569 CCCSc1cccc(c1O)CC 62a_100000210303_200010001580 [0,2,0,0,0,0|0,0,2]=4 5856 B13R1.569 CCCSc1cccc(c1O)CC 62a_200010001580_100000210303 [0,2,0,0,0,0|0,0,2]=4 5857 B13R1.569 CCCSc1cccc(c1O)OC 62a_100000210303_100000686866 [0,2,0,0,0,0|0,0,2]=4 5858 B13R1.569 CCc1cccc(c1O)SCC#N 62a_100011215382_200010001580 [0,2,0,0,0,0|1,0,1]=4 5859 B13R1.569 CCc1cccc(c1O)SCC#N 62a_200010001580_100011215382 [0,2,0,0,0,0|1,0,1]=4 5860 B13R1.569 CCc1cccc(c1O)SCC=O 62a_200010001580_200015260668 [0,2,0,0,0,0|1,0,0]=3 5861 B13R1.569 CCc1cccc(c1O)SCC=O 62a_200015260668_200010001580 [0,2,0,0,0,0|1,0,0]=3 5862 B13R1.569 CCc1cccc(c1O)SCCF 62a_100011217306_200010001580 [0,2,0,0,0,0|1,0,1]=4 5863 B13R1.569 CCc1cccc(c1O)SCCF 62a_200010001580_100011217306 [0,2,0,0,0,0|1,0,1]=4 5864 B13R1.569 CCc1cccc(c1O)SCCO 62a_100000211926_200010001580 [0,2,0,0,0,0|1,0,1]=4 5865 B13R1.569 CCc1cccc(c1O)SCCO 62a_200010001580_100000211926 [0,2,0,0,0,0|1,0,1]=4 5866 B13R1.569 CCc1cccc(c1O)SCOC 62a_100000766300_200010001580 [0,2,0,0,0,0|1,0,1]=4 5867 B13R1.569 CCc1cccc(c1O)SCOC 62a_200010001580_100000766300 [0,2,0,0,0,0|1,0,1]=4 5868 B13R1.569 CCc1cccc(c1O)SCSC 62a_100011218213_200010001580 [0,2,0,0,0,0|1,0,1]=4 5869 B13R1.569 CCc1cccc(c1O)SCSC 62a_200010001580_100011218213 [0,2,0,0,0,0|1,0,1]=4 5870 B13R1.569 CNc1cccc(c1N)SCC=O 62a_100000695761_200015260668 [0,2,0,0,0,0|2,0,0]=4 5871 B13R1.569 COCSc1cccc(c1O)OC 62a_100000766300_100000686866 [0,2,0,0,0,0|1,0,1]=4 5872 B13R1.569 COc1cccc(c1Br)NCC=O 34a_100000703447_200009817547 [0,2,0,0,0,0|2,0,0]=4 5873 B13R1.569 COc1cccc(c1Br)OCC=O 34a_100010202623_200009817547 [0,2,0,0,0,0|2,0,0]=4 5874 B13R1.569 COc1cccc(c1Br)OCC=O 7a_100010202623_200015260668 [0,2,0,0,0,0|2,0,0]=4 5875 B13R1.569 COc1cccc(c1Br)SCC=O 62a_100010146559_200015260668 [0,2,0,0,0,0|2,0,0]=4 5876 B13R1.569 COc1cccc(c1Br)SCC=O 62a_200015260668_100010146559 [0,2,0,0,0,0|2,0,0]=4 5877 B13R1.569 COc1cccc(c1C)NCC=O 34a_100011244893_200009817547 [0,2,0,0,0,0|2,0,0]=4 5878 B13R1.569 COc1cccc(c1C)NCC=O 7a_100011244893_200015260668 [0,2,0,0,0,0|2,0,0]=4 5879 B13R1.569 COc1cccc(c1C)SCC=O 62a_100010002647_200015260668 [0,2,0,0,0,0|2,0,0]=4 5880 B13R1.569 COc1cccc(c1C)SCC=O 62a_200015260668_100010002647 [0,2,0,0,0,0|2,0,0]=4 5881 B13R1.569 COc1cccc(c1Cl)NCC=O 34a_100000089720_200009817547 [0,2,0,0,0,0|2,0,0]=4 5882 B13R1.569 COc1cccc(c1Cl)OCC=O 34a_100000087810_200009817547 [0,2,0,0,0,0|2,0,0]=4 5883 B13R1.569 COc1cccc(c1Cl)OCC=O 7a_100000087810_200015260668 [0,2,0,0,0,0|2,0,0]=4 5884 B13R1.569 COc1cccc(c1Cl)SCC=O 62a_100010147677_200015260668 [0,2,0,0,0,0|2,0,0]=4 5885 B13R1.569 COc1cccc(c1Cl)SCC=O 62a_200015260668_100010147677 [0,2,0,0,0,0|2,0,0]=4 5886 B13R1.569 COc1cccc(c1F)NCC=O 34a_100000100910_200009817547 [0,2,0,0,0,0|2,0,0]=4 5887 B13R1.569 COc1cccc(c1F)OCC=O 34a_100000102366_200009817547 [0,2,0,0,0,0|2,0,0]=4 5888 B13R1.569 COc1cccc(c1F)OCC=O 7a_100000102366_200015260668 [0,2,0,0,0,0|2,0,0]=4 5889 B13R1.569 COc1cccc(c1F)SCC=O 62a_100010185846_200015260668 [0,2,0,0,0,0|2,0,0]=4 5890 B13R1.569 COc1cccc(c1F)SCC=O 62a_200015260668_100010185846 [0,2,0,0,0,0|2,0,0]=4 5891 B13R1.569 COc1cccc(c1I)NCC=O 34a_100010245509_200009817547 [0,2,0,0,0,0|2,0,0]=4 5892 B13R1.569 COc1cccc(c1I)OCC=O 34a_200010201982_200009817547 [0,2,0,0,0,0|2,0,0]=4 5893 B13R1.569 COc1cccc(c1I)OCC=O 7a_200010201982_200015260668 [0,2,0,0,0,0|2,0,0]=4 5894 B13R1.569 COc1cccc(c1N)OCC=O 34a_100012022766_200009817547 [0,2,0,0,0,0|2,0,0]=4 5895 B13R1.569 COc1cccc(c1N)OCC=O 7a_100012022766_200015260668 [0,2,0,0,0,0|2,0,0]=4 5896 B13R1.569 COc1cccc(c1N)SCC=O 62a_100000708083_200015260668 [0,2,0,0,0,0|2,0,0]=4 5897 B13R1.569 COc1cccc(c1O)NCC=O 34a_100000123586_200009817547 [0,2,0,0,0,0|1,0,0]=3 5898 B13R1.569 COc1cccc(c1O)NCCF 34a_100000123586_100011217306 [0,2,0,0,0,0|1,0,1]=4 5899 B13R1.569 COc1cccc(c1O)NCCO 34a_100000123586_100000211926 [0,2,0,0,0,0|1,0,1]=4 5900 B13R1.569 COc1cccc(c1O)NCSC 34a_100000123586_100011218213 [0,2,0,0,0,0|1,0,1]=4 5901 B13R1.569 COc1cccc(c1O)SCC#N 62a_100011215382_100000686866 [0,2,0,0,0,0|1,0,1]=4 5902 B13R1.569 COc1cccc(c1O)SCC=O 62a_200015260668_100000686866 [0,2,0,0,0,0|1,0,0]=3 5903 B13R1.569 COc1cccc(c1O)SCCF 62a_100011217306_100000686866 [0,2,0,0,0,0|1,0,1]=4 5904 B13R1.569 COc1cccc(c1O)SCCO 62a_100000211926_100000686866 [0,2,0,0,0,0|1,0,1]=4 5905 B13R1.569 COc1cccc(c1O)SCSC 62a_100011218213_100000686866 [0,2,0,0,0,0|1,0,1]=4 5906 B13R1.569 Cc1c(cccc1NCC=O)CO 2230a_102495339961_200015260668 [0,2,0,0,0,0|2,0,0]=4 5907 B13R1.569 Cc1c(cccc1NCC=O)CO 34a_102495339961_200009817547 [0,2,0,0,0,0|2,0,0]=4 5908 B13R1.569 Cc1c(cccc1OCC=O)CO 34a_200000084602_200009817547 [0,2,0,0,0,0|2,0,0]=4 5909 B13R1.569 Cc1c(cccc1OCC=O)CO 7a_200000084602_200015260668 [0,2,0,0,0,0|2,0,0]=4 5910 B13R1.569 Cc1c(cccc1SCC=O)CN 62a_100000724210_200015260668 [0,2,0,0,0,0|2,0,0]=4 5911 B13R1.569 Cc1c(cccc1SCC=O)CN 62a_200015260668_100000724210 [0,2,0,0,0,0|2,0,0]=4 5912 B13R1.569 Cc1c(cccc1SCC=O)CO 62a_100000694458_200015260668 [0,2,0,0,0,0|2,0,0]=4 5913 B13R1.569 Cc1c(cccc1SCC=O)CO 62a_200015260668_100000694458 [0,2,0,0,0,0|2,0,0]=4 5914 B13R1.569 N#Cc1cccc(c1O)SCC=O 62a_200015260668_100009817103 [0,2,0,0,0,0|1,0,1]=4 5915 B13R1.569 NCc1cccc(c1F)OCC=O 34a_100025773512_200009817547 [0,2,0,0,0,0|2,0,0]=4 5916 B13R1.569 NCc1cccc(c1F)SCC=O 62a_100015189953_200015260668 [0,2,0,0,0,0|2,0,0]=4 5917 B13R1.569 NCc1cccc(c1F)SCC=O 62a_200015260668_100015189953 [0,2,0,0,0,0|2,0,0]=4 5918 B13R1.569 Nc1c(cccc1SCC=O)CO 62a_100012349457_200015260668 [0,2,0,0,0,0|2,0,0]=4 5919 B13R1.569 Nc1c(cccc1SCC=O)CO 62a_200015260668_100012349457 [0,2,0,0,0,0|2,0,0]=4 5920 B13R1.569 O=CCNc1cccc(c1F)CO 34a_100012023829_200009817547 [0,2,0,0,0,0|2,0,0]=4 5921 B13R1.569 O=CCSc1cccc(c1Br)CO 62a_100010240205_200015260668 [0,2,0,0,0,0|2,0,0]=4 5922 B13R1.569 O=CCSc1cccc(c1Br)CO 62a_200015260668_100010240205 [0,2,0,0,0,0|2,0,0]=4 5923 B13R1.569 O=CCSc1cccc(c1F)CO 62a_100011935076_200015260668 [0,2,0,0,0,0|2,0,0]=4 5924 B13R1.569 O=CCSc1cccc(c1F)CO 62a_200015260668_100011935076 [0,2,0,0,0,0|2,0,0]=4 5925 B13R1.569 O=CCSc1cccc(c1O)C=O 62a_200015260668_100010171435 [0,2,0,0,0,0|1,0,1]=4 5926 B13R1.3395 C=CCNc1c(ccc(c1Br)F)F 34a_100014094178_100015514636 [0,2,0,0,0,0|2,0,0]=4 5927 B13R1.3395 C=CCNc1c(ccc(c1C)Br)C 34a_200010074581_100015514636 [0,2,0,0,0,0|2,0,0]=4 5928 B13R1.3395 C=CCNc1c(ccc(c1C)Br)F 2230a_100010588651_100000210623 [0,2,0,0,0,0|2,0,0]=4 5929 B13R1.3395 C=CCNc1c(ccc(c1C)Br)F 34a_100010588651_100015514636 [0,2,0,0,0,0|2,0,0]=4 5930 B13R1.3395 C=CCNc1c(ccc(c1C)Br)O 34a_100013039247_100015514636 [0,2,0,0,0,0|2,0,0]=4 5931 B13R1.3395 C=CCNc1c(ccc(c1C)C)C 2230a_100000117417_100000210623 [0,2,0,0,0,0|1,0,0]=3 5932 B13R1.3395 C=CCNc1c(ccc(c1C)C)C 34a_100000117417_100015514636 [0,2,0,0,0,0|1,0,0]=3 5933 B13R1.3395 C=CCNc1c(ccc(c1C)C)C 7a_100000117417_100015514636 [0,2,0,0,0,0|1,0,0]=3 5934 B13R1.3395 C=CCNc1c(ccc(c1C)Cl)C 2230a_200020642106_100000210623 [0,2,0,0,0,0|2,0,0]=4 5935 B13R1.3395 C=CCNc1c(ccc(c1C)Cl)C 34a_200020642106_100015514636 [0,2,0,0,0,0|2,0,0]=4 5936 B13R1.3395 C=CCNc1c(ccc(c1C)Cl)Cl 34a_100009961198_100015514636 [0,2,0,0,0,0|2,0,0]=4 5937 B13R1.3395 C=CCNc1c(ccc(c1C)F)Br 34a_100011009917_100015514636 [0,2,0,0,0,0|2,0,0]=4 5938 B13R1.3395 C=CCNc1c(ccc(c1C)I)C 34a_200010115591_100015514636 [0,2,0,0,0,0|2,0,0]=4 5939 B13R1.3395 C=CCNc1c(ccc(c1Cl)C)Cl 34a_100000210993_100015514636 [0,2,0,0,0,0|1,0,0]=3 5940 B13R1.3395 C=CCNc1c(ccc(c1Cl)C)F 34a_106744479701_100015514636 [0,2,0,0,0,0|1,0,0]=3 5941 B13R1.3395 C=CCNc1c(ccc(c1Cl)Cl)Cl 34a_103437851083_100015514636 [0,2,0,0,0,0|2,0,0]=4 5942 B13R1.3395 C=CCNc1c(ccc(c1Cl)Cl)F 34a_100000061523_100015514636 [0,2,0,0,0,0|2,0,0]=4 5943 B13R1.3395 C=CCNc1c(ccc(c1Cl)F)F 34a_100000062006_100015514636 [0,2,0,0,0,0|2,0,0]=4 5944 B13R1.3395 C=CCNc1c(ccc(c1Cl)O)Cl 34a_100016988457_100015514636 [0,2,0,0,0,0|2,0,0]=4 5945 B13R1.3395 C=CCNc1c(ccc(c1Cl)O)Cl 7a_100016988457_100015514636 [0,2,0,0,0,0|2,0,0]=4 5946 B13R1.3395 C=CCNc1c(ccc(c1F)Br)Cl 34a_100010995236_100015514636 [0,2,0,0,0,0|2,0,0]=4 5947 B13R1.3395 C=CCNc1c(ccc(c1F)Br)F 2230a_100025793129_100000210623 [0,2,0,0,0,0|2,0,0]=4 5948 B13R1.3395 C=CCNc1c(ccc(c1F)Br)F 34a_100025793129_100015514636 [0,2,0,0,0,0|2,0,0]=4 5949 B13R1.3395 C=CCNc1c(ccc(c1F)C)Cl 34a_100000062009_100015514636 [0,2,0,0,0,0|1,0,0]=3 5950 B13R1.3395 C=CCNc1c(ccc(c1F)C)F 2230a_102495364760_100000210623 [0,2,0,0,0,0|1,0,0]=3 5951 B13R1.3395 C=CCNc1c(ccc(c1F)C)F 34a_102495364760_100015514636 [0,2,0,0,0,0|1,0,0]=3 5952 B13R1.3395 C=CCNc1c(ccc(c1F)Cl)Br 34a_100011010633_100015514636 [0,2,0,0,0,0|2,0,0]=4 5953 B13R1.3395 C=CCNc1c(ccc(c1F)Cl)Cl 34a_200000061452_100015514636 [0,2,0,0,0,0|2,0,0]=4 5954 B13R1.3395 C=CCNc1c(ccc(c1F)Cl)F 34a_102495364764_100015514636 [0,2,0,0,0,0|2,0,0]=4 5955 B13R1.3395 C=CCNc1c(ccc(c1F)F)Br 34a_100010008850_100015514636 [0,2,0,0,0,0|2,0,0]=4 5956 B13R1.3395 C=CCNc1c(ccc(c1F)F)Cl 34a_200010381624_100015514636 [0,2,0,0,0,0|2,0,0]=4 5957 B13R1.3395 C=CCNc1c(ccc(c1F)F)F 34a_100000037384_100015514636 [0,2,0,0,0,0|2,0,0]=4 5958 B13R1.3395 C=CCNc1c(ccc(c1F)F)I 34a_100015763296_100015514636 [0,2,0,0,0,0|2,0,0]=4 5959 B13R1.3395 C=CCOc1c(ccc(c1Br)C)F 34a_200010223207_100015514636 [0,2,0,0,0,0|1,0,0]=3 5960 B13R1.3395 C=CCOc1c(ccc(c1Br)C)F 7a_200010223207_100015514636 [0,2,0,0,0,0|1,0,0]=3 5961 B13R1.3395 C=CCOc1c(ccc(c1Br)F)F 34a_100010170822_100015514636 [0,2,0,0,0,0|2,0,0]=4 5962 B13R1.3395 C=CCOc1c(ccc(c1Br)F)F 7a_100010170822_100015514636 [0,2,0,0,0,0|2,0,0]=4 5963 B13R1.3395 C=CCOc1c(ccc(c1Br)F)N 34a_100010128263_100015514636 [0,2,0,0,0,0|2,0,0]=4 5964 B13R1.3395 C=CCOc1c(ccc(c1Br)F)N 7a_100010128263_100015514636 [0,2,0,0,0,0|2,0,0]=4 5965 B13R1.3395 C=CCOc1c(ccc(c1C)C)C 34a_100000211305_100015514636 [0,2,0,0,0,0|1,0,0]=3 5966 B13R1.3395 C=CCOc1c(ccc(c1C)C)C 7a_100000211305_100015514636 [0,2,0,0,0,0|1,0,0]=3 5967 B13R1.3395 C=CCOc1c(ccc(c1C)Cl)Br 34a_200010391122_100015514636 [0,2,0,0,0,0|2,0,0]=4 5968 B13R1.3395 C=CCOc1c(ccc(c1C)Cl)Br 7a_200010391122_100015514636 [0,2,0,0,0,0|2,0,0]=4 5969 B13R1.3395 C=CCOc1c(ccc(c1C)F)Br 34a_200010391124_100015514636 [0,2,0,0,0,0|2,0,0]=4 5970 B13R1.3395 C=CCOc1c(ccc(c1C)F)Br 7a_200010391124_100015514636 [0,2,0,0,0,0|2,0,0]=4 5971 B13R1.3395 C=CCOc1c(ccc(c1Cl)Br)Cl 34a_100010089855_100015514636 [0,2,0,0,0,0|2,0,0]=4 5972 B13R1.3395 C=CCOc1c(ccc(c1Cl)Br)Cl 7a_100010089855_100015514636 [0,2,0,0,0,0|2,0,0]=4 5973 B13R1.3395 C=CCOc1c(ccc(c1Cl)C)Cl 34a_200000087117_100015514636 [0,2,0,0,0,0|1,0,0]=3 5974 B13R1.3395 C=CCOc1c(ccc(c1Cl)C)Cl 7a_200000087117_100015514636 [0,2,0,0,0,0|1,0,0]=3 5975 B13R1.3395 C=CCOc1c(ccc(c1Cl)C)F 34a_100000035349_100015514636 [0,2,0,0,0,0|1,0,0]=3 5976 B13R1.3395 C=CCOc1c(ccc(c1Cl)C)F 7a_100000035349_100015514636 [0,2,0,0,0,0|1,0,0]=3 5977 B13R1.3395 C=CCOc1c(ccc(c1Cl)Cl)Cl 34a_100000042553_100015514636 [0,2,0,0,0,0|2,0,0]=4 5978 B13R1.3395 C=CCOc1c(ccc(c1Cl)Cl)Cl 7a_100000042553_100015514636 [0,2,0,0,0,0|2,0,0]=4 5979 B13R1.3395 C=CCOc1c(ccc(c1Cl)Cl)F 34a_100000062035_100015514636 [0,2,0,0,0,0|2,0,0]=4 5980 B13R1.3395 C=CCOc1c(ccc(c1Cl)Cl)F 7a_100000062035_100015514636 [0,2,0,0,0,0|2,0,0]=4 5981 B13R1.3395 C=CCOc1c(ccc(c1Cl)F)Br 34a_100014979575_100015514636 [0,2,0,0,0,0|2,0,0]=4 5982 B13R1.3395 C=CCOc1c(ccc(c1Cl)F)Br 7a_100014979575_100015514636 [0,2,0,0,0,0|2,0,0]=4 5983 B13R1.3395 C=CCOc1c(ccc(c1Cl)F)F 34a_100000038336_100015514636 [0,2,0,0,0,0|2,0,0]=4 5984 B13R1.3395 C=CCOc1c(ccc(c1Cl)F)F 7a_100000038336_100015514636 [0,2,0,0,0,0|2,0,0]=4 5985 B13R1.3395 C=CCOc1c(ccc(c1Cl)N)C 34a_100000036876_100015514636 [0,2,0,0,0,0|2,0,0]=4 5986 B13R1.3395 C=CCOc1c(ccc(c1Cl)N)C 7a_100000036876_100015514636 [0,2,0,0,0,0|2,0,0]=4 5987 B13R1.3395 C=CCOc1c(ccc(c1F)Br)Cl 34a_100010240321_100015514636 [0,2,0,0,0,0|2,0,0]=4 5988 B13R1.3395 C=CCOc1c(ccc(c1F)Br)Cl 7a_100010240321_100015514636 [0,2,0,0,0,0|2,0,0]=4 5989 B13R1.3395 C=CCOc1c(ccc(c1F)Br)F 34a_100010167067_100015514636 [0,2,0,0,0,0|2,0,0]=4 5990 B13R1.3395 C=CCOc1c(ccc(c1F)Br)F 7a_100010167067_100015514636 [0,2,0,0,0,0|2,0,0]=4 5991 B13R1.3395 C=CCOc1c(ccc(c1F)C)Br 34a_100000722096_100015514636 [0,2,0,0,0,0|1,0,0]=3 5992 B13R1.3395 C=CCOc1c(ccc(c1F)C)Br 7a_100000722096_100015514636 [0,2,0,0,0,0|1,0,0]=3 5993 B13R1.3395 C=CCOc1c(ccc(c1F)C)Cl 34a_200000034537_100015514636 [0,2,0,0,0,0|1,0,0]=3 5994 B13R1.3395 C=CCOc1c(ccc(c1F)C)Cl 7a_200000034537_100015514636 [0,2,0,0,0,0|1,0,0]=3 5995 B13R1.3395 C=CCOc1c(ccc(c1F)C)F 34a_100011216644_100015514636 [0,2,0,0,0,0|1,0,0]=3 5996 B13R1.3395 C=CCOc1c(ccc(c1F)C)F 7a_100011216644_100015514636 [0,2,0,0,0,0|1,0,0]=3 5997 B13R1.3395 C=CCOc1c(ccc(c1F)Cl)Br 34a_100010081130_100015514636 [0,2,0,0,0,0|2,0,0]=4 5998 B13R1.3395 C=CCOc1c(ccc(c1F)Cl)Br 7a_100010081130_100015514636 [0,2,0,0,0,0|2,0,0]=4 5999 B13R1.3395 C=CCOc1c(ccc(c1F)Cl)F 34a_100000034634_100015514636 [0,2,0,0,0,0|2,0,0]=4 6000 B13R1.3395 C=CCOc1c(ccc(c1F)Cl)F 7a_100000034634_100015514636 [0,2,0,0,0,0|2,0,0]=4 6001 B13R1.3395 C=CCOc1c(ccc(c1F)F)Br 34a_100010243909_100015514636 [0,2,0,0,0,0|2,0,0]=4 6002 B13R1.3395 C=CCOc1c(ccc(c1F)F)Br 7a_100010243909_100015514636 [0,2,0,0,0,0|2,0,0]=4 6003 B13R1.3395 C=CCOc1c(ccc(c1F)F)F 34a_100000031686_100015514636 [0,2,0,0,0,0|2,0,0]=4 6004 B13R1.3395 C=CCOc1c(ccc(c1F)F)F 7a_100000031686_100015514636 [0,2,0,0,0,0|2,0,0]=4 6005 B13R1.3395 C=CCOc1c(ccc(c1F)F)N 34a_100015205010_100015514636 [0,2,0,0,0,0|2,0,0]=4 6006 B13R1.3395 C=CCOc1c(ccc(c1F)F)N 7a_100015205010_100015514636 [0,2,0,0,0,0|2,0,0]=4 6007 B13R1.3395 C=CCOc1c(ccc(c1F)I)Br 34a_200010782288_100015514636 [0,2,0,0,0,0|2,0,0]=4 6008 B13R1.3395 C=CCOc1c(ccc(c1F)I)Br 7a_200010782288_100015514636 [0,2,0,0,0,0|2,0,0]=4 6009 B13R1.3395 C=CCOc1c(n(ccc1=O)C)C 34a_100000032683_100015514636 [0,2,0,0,0,0|2,0,0]=4 6010 B13R1.3395 C=CCOc1c(n(ccc1=O)C)C 7a_100000032683_100015514636 [0,2,0,0,0,0|2,0,0]=4 6011 B13R1.3395 C=CCSc1c(ccc(c1Br)F)F 62a_100000210623_100010167956 [0,2,0,0,0,0|2,0,0]=4 6012 B13R1.3395 C=CCSc1c(ccc(c1Br)F)F 62a_100010167956_100000210623 [0,2,0,0,0,0|2,0,0]=4 6013 B13R1.3395 C=CCSc1c(ccc(c1Br)F)N 62a_100000210623_100020765651 [0,2,0,0,0,0|2,0,0]=4 6014 B13R1.3395 C=CCSc1c(ccc(c1Br)F)N 62a_100020765651_100000210623 [0,2,0,0,0,0|2,0,0]=4 6015 B13R1.3395 C=CCSc1c(ccc(c1C)F)C 62a_100000210623_100011068659 [0,2,0,0,0,0|2,0,0]=4 6016 B13R1.3395 C=CCSc1c(ccc(c1C)F)C 62a_100011068659_100000210623 [0,2,0,0,0,0|2,0,0]=4 6017 B13R1.3395 C=CCSc1c(ccc(c1C)F)F 62a_100000210623_100010167959 [0,2,0,0,0,0|2,0,0]=4 6018 B13R1.3395 C=CCSc1c(ccc(c1C)F)F 62a_100010167959_100000210623 [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.3395 C=CCSc1c(ccc(c1C)N)C 62a_100000210623_106354213274 [0,2,0,0,0,0|2,0,0]=4 6020 B13R1.3395 C=CCSc1c(ccc(c1C)N)C 62a_106354213274_100000210623 [0,2,0,0,0,0|2,0,0]=4 6021 B13R1.3395 C=CCSc1c(ccc(c1C)O)C 62a_100000210623_100010659238 [0,2,0,0,0,0|2,0,0]=4 6022 B13R1.3395 C=CCSc1c(ccc(c1C)O)C 62a_100010659238_100000210623 [0,2,0,0,0,0|2,0,0]=4 6023 B13R1.3395 C=CCSc1c(ccc(c1Cl)Br)N 62a_100000210623_200010779962 [0,2,0,0,0,0|2,0,0]=4 6024 B13R1.3395 C=CCSc1c(ccc(c1Cl)Br)N 62a_200010779962_100000210623 [0,2,0,0,0,0|2,0,0]=4 6025 B13R1.3395 C=CCSc1c(ccc(c1Cl)Cl)Cl 62a_100000210623_200010170825 [0,2,0,0,0,0|2,0,0]=4 6026 B13R1.3395 C=CCSc1c(ccc(c1Cl)Cl)Cl 62a_200010170825_100000210623 [0,2,0,0,0,0|2,0,0]=4 6027 B13R1.3395 C=CCSc1c(ccc(c1Cl)Cl)F 62a_100000210623_200015697950 [0,2,0,0,0,0|2,0,0]=4 6028 B13R1.3395 C=CCSc1c(ccc(c1Cl)Cl)F 62a_200015697950_100000210623 [0,2,0,0,0,0|2,0,0]=4 6029 B13R1.3395 C=CCSc1c(ccc(c1Cl)Cl)N 62a_100000210623_200011093878 [0,2,0,0,0,0|2,0,0]=4 6030 B13R1.3395 C=CCSc1c(ccc(c1Cl)Cl)N 62a_200011093878_100000210623 [0,2,0,0,0,0|2,0,0]=4 6031 B13R1.3395 C=CCSc1c(ccc(c1Cl)F)Br 62a_100000210623_200037249116 [0,2,0,0,0,0|2,0,0]=4 6032 B13R1.3395 C=CCSc1c(ccc(c1Cl)F)Br 62a_200037249116_100000210623 [0,2,0,0,0,0|2,0,0]=4 6033 B13R1.3395 C=CCSc1c(ccc(c1Cl)F)F 62a_100000210623_100010167948 [0,2,0,0,0,0|2,0,0]=4 6034 B13R1.3395 C=CCSc1c(ccc(c1Cl)F)F 62a_100010167948_100000210623 [0,2,0,0,0,0|2,0,0]=4 6035 B13R1.3395 C=CCSc1c(ccc(c1F)Br)Cl 62a_100000210623_100011092007 [0,2,0,0,0,0|2,0,0]=4 6036 B13R1.3395 C=CCSc1c(ccc(c1F)Br)Cl 62a_100011092007_100000210623 [0,2,0,0,0,0|2,0,0]=4 6037 B13R1.3395 C=CCSc1c(ccc(c1F)Br)F 62a_100000210623_100000722365 [0,2,0,0,0,0|2,0,0]=4 6038 B13R1.3395 C=CCSc1c(ccc(c1F)Br)F 62a_100000722365_100000210623 [0,2,0,0,0,0|2,0,0]=4 6039 B13R1.3395 C=CCSc1c(ccc(c1F)Cl)Br 62a_100000210623_100011084128 [0,2,0,0,0,0|2,0,0]=4 6040 B13R1.3395 C=CCSc1c(ccc(c1F)Cl)Br 62a_100011084128_100000210623 [0,2,0,0,0,0|2,0,0]=4 6041 B13R1.3395 C=CCSc1c(ccc(c1F)Cl)F 62a_100000210623_200010167938 [0,2,0,0,0,0|2,0,0]=4 6042 B13R1.3395 C=CCSc1c(ccc(c1F)Cl)F 62a_200010167938_100000210623 [0,2,0,0,0,0|2,0,0]=4 6043 B13R1.3395 C=CCSc1c(ccc(c1F)Cl)N 62a_100000210623_100010134325 [0,2,0,0,0,0|2,0,0]=4 6044 B13R1.3395 C=CCSc1c(ccc(c1F)Cl)N 62a_100010134325_100000210623 [0,2,0,0,0,0|2,0,0]=4 6045 B13R1.3395 C=CCSc1c(ccc(c1F)F)F 62a_100000210623_100009814005 [0,2,0,0,0,0|2,0,0]=4 6046 B13R1.3395 C=CCSc1c(ccc(c1F)F)F 62a_100009814005_100000210623 [0,2,0,0,0,0|2,0,0]=4 6047 B13R1.3395 C=CCSc1c(ccc(c1F)F)N 62a_100000210623_100010232473 [0,2,0,0,0,0|2,0,0]=4 6048 B13R1.3395 C=CCSc1c(ccc(c1F)F)N 62a_100010232473_100000210623 [0,2,0,0,0,0|2,0,0]=4 6049 B13R1.3395 C=CCSc1c(ccc(c1F)N)F 62a_100000210623_100010070858 [0,2,0,0,0,0|2,0,0]=4 6050 B13R1.3395 C=CCSc1c(ccc(c1F)N)F 62a_100010070858_100000210623 [0,2,0,0,0,0|2,0,0]=4 6051 B13R1.3395 C=CCSc1c(ccc(c1N)F)F 62a_100000210623_100014094178 [0,2,0,0,0,0|2,0,0]=4 6052 B13R1.3395 C=CCSc1c(ccc(c1N)F)F 62a_100014094178_100000210623 [0,2,0,0,0,0|2,0,0]=4 6053 B13R1.3395 C=CCSc1c(ccc(c1N)N)F 62a_100010128261_100000210623 [0,2,0,0,0,0|2,0,0]=4 6054 B13R1.3395 C=CCSc1c(ccc(c1O)F)C 62a_100000210623_200010223207 [0,2,0,0,0,0|1,0,0]=3 6055 B13R1.3395 C=CCSc1c(ccc(c1O)F)C 62a_200010223207_100000210623 [0,2,0,0,0,0|1,0,0]=3 6056 B13R1.3395 C=CCSc1c(ccc(c1O)F)F 62a_100000210623_100010170822 [0,2,0,0,0,0|1,0,0]=3 6057 B13R1.3395 C=CCSc1c(ccc(c1O)F)F 62a_100010170822_100000210623 [0,2,0,0,0,0|1,0,0]=3 6058 B13R1.3395 C=CCSc1c(ccc(c1O)N)F 62a_100000210623_100010128263 [0,2,0,0,0,0|1,0,0]=3 6059 B13R1.3395 C=CCSc1c(ccc(c1O)N)F 62a_100010128263_100000210623 [0,2,0,0,0,0|1,0,0]=3 6060 B13R1.3395 Cc1ccc(c(c1Br)OCC=O)F 34a_200010223207_200009817547 [0,2,0,0,0,0|2,0,0]=4 6061 B13R1.3395 Cc1ccc(c(c1Br)OCC=O)F 7a_200010223207_200015260668 [0,2,0,0,0,0|2,0,0]=4 6062 B13R1.3395 Cc1ccc(c(c1C)NCC=O)C 2230a_100000117417_200015260668 [0,2,0,0,0,0|2,0,0]=4 6063 B13R1.3395 Cc1ccc(c(c1C)NCC=O)C 34a_100000117417_200009817547 [0,2,0,0,0,0|2,0,0]=4 6064 B13R1.3395 Cc1ccc(c(c1C)NCC=O)C 7a_100000117417_200015260668 [0,2,0,0,0,0|2,0,0]=4 6065 B13R1.3395 Cc1ccc(c(c1C)OCC=O)C 34a_100000211305_200009817547 [0,2,0,0,0,0|2,0,0]=4 6066 B13R1.3395 Cc1ccc(c(c1C)OCC=O)C 7a_100000211305_200015260668 [0,2,0,0,0,0|2,0,0]=4 6067 B13R1.3395 Cc1ccc(c(c1Cl)NCC=O)Cl 34a_100000210993_200009817547 [0,2,0,0,0,0|2,0,0]=4 6068 B13R1.3395 Cc1ccc(c(c1Cl)NCC=O)F 34a_106744479701_200009817547 [0,2,0,0,0,0|2,0,0]=4 6069 B13R1.3395 Cc1ccc(c(c1Cl)OCC=O)Cl 34a_200000087117_200009817547 [0,2,0,0,0,0|2,0,0]=4 6070 B13R1.3395 Cc1ccc(c(c1Cl)OCC=O)Cl 7a_200000087117_200015260668 [0,2,0,0,0,0|2,0,0]=4 6071 B13R1.3395 Cc1ccc(c(c1Cl)OCC=O)F 34a_100000035349_200009817547 [0,2,0,0,0,0|2,0,0]=4 6072 B13R1.3395 Cc1ccc(c(c1Cl)OCC=O)F 7a_100000035349_200015260668 [0,2,0,0,0,0|2,0,0]=4 6073 B13R1.3395 Cc1ccc(c(c1F)NCC=O)Cl 34a_100000062009_200009817547 [0,2,0,0,0,0|2,0,0]=4 6074 B13R1.3395 Cc1ccc(c(c1F)NCC=O)F 2230a_102495364760_200015260668 [0,2,0,0,0,0|2,0,0]=4 6075 B13R1.3395 Cc1ccc(c(c1F)NCC=O)F 34a_102495364760_200009817547 [0,2,0,0,0,0|2,0,0]=4 6076 B13R1.3395 Cc1ccc(c(c1F)OCC=O)Br 34a_100000722096_200009817547 [0,2,0,0,0,0|2,0,0]=4 6077 B13R1.3395 Cc1ccc(c(c1F)OCC=O)Br 7a_100000722096_200015260668 [0,2,0,0,0,0|2,0,0]=4 6078 B13R1.3395 Cc1ccc(c(c1F)OCC=O)Cl 34a_200000034537_200009817547 [0,2,0,0,0,0|2,0,0]=4 6079 B13R1.3395 Cc1ccc(c(c1F)OCC=O)Cl 7a_200000034537_200015260668 [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.3395 Cc1ccc(c(c1F)OCC=O)F 34a_100011216644_200009817547 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.3395 Cc1ccc(c(c1F)OCC=O)F 7a_100011216644_200015260668 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.3395 Cc1ccc(c(c1SCC=O)O)F 62a_200010223207_200015260668 [0,2,0,0,0,0|2,0,0]=4 6083 B13R1.3395 Cc1ccc(c(c1SCC=O)O)F 62a_200015260668_200010223207 [0,2,0,0,0,0|2,0,0]=4 6084 B13R1.3395 Nc1ccc(c(c1O)SCC=O)F 62a_100010128263_200015260668 [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.3395 Nc1ccc(c(c1O)SCC=O)F 62a_200015260668_100010128263 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.3395 O=CCSc1c(ccc(c1O)F)F 62a_100010170822_200015260668 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.3395 O=CCSc1c(ccc(c1O)F)F 62a_200015260668_100010170822 [0,2,0,0,0,0|2,0,0]=4 6088 B13R1.3516 C#CCNc1cccc(c1OC)C 34a_100012017360_100000184674 [0,2,0,0,0,0|0,0,2]=4 6089 B13R1.3516 C#CCOc1cccc(c1CO)C 34a_200009874777_100000184674 [0,2,0,0,0,0|0,0,2]=4 6090 B13R1.3516 C#CCOc1cccc(c1CO)C 7a_200009874777_100000038162 [0,2,0,0,0,0|0,0,2]=4 6091 B13R1.3516 C#CCSc1cccc(c1OC)C 62a_100000038162_100010141385 [0,2,0,0,0,0|0,0,2]=4 6092 B13R1.3516 C=CCNc1cccc(c1C#N)Br 27a_100020586998_100010071968 [0,2,0,0,0,0|2,0,0]=4 6093 B13R1.3516 C=CCNc1cccc(c1C#N)Br 7a_100011935054_100015514636 [0,2,0,0,0,0|2,0,0]=4 6094 B13R1.3516 C=CCNc1cccc(c1C#N)C 2230a_100000763283_100000210623 [0,2,0,0,0,0|1,0,0]=3 6095 B13R1.3516 C=CCNc1cccc(c1C#N)C 34a_100000763283_100015514636 [0,2,0,0,0,0|1,0,0]=3 6096 B13R1.3516 C=CCNc1cccc(c1C#N)C 7a_100000763283_100015514636 [0,2,0,0,0,0|1,0,0]=3 6097 B13R1.3516 C=CCNc1cccc(c1C#N)Cl 2230a_100000236969_100000210623 [0,2,0,0,0,0|2,0,0]=4 6098 B13R1.3516 C=CCNc1cccc(c1C#N)Cl 27a_100020586998_200000049503 [0,2,0,0,0,0|2,0,0]=4 6099 B13R1.3516 C=CCNc1cccc(c1C#N)Cl 7a_100000236969_100015514636 [0,2,0,0,0,0|2,0,0]=4 6100 B13R1.3516 C=CCNc1cccc(c1C#N)F 2230a_100000236971_100000210623 [0,2,0,0,0,0|2,0,0]=4 6101 B13R1.3516 C=CCNc1cccc(c1C#N)F 27a_100020586998_100000039607 [0,2,0,0,0,0|2,0,0]=4 6102 B13R1.3516 C=CCNc1cccc(c1C#N)F 34a_100000236971_100015514636 [0,2,0,0,0,0|2,0,0]=4 6103 B13R1.3516 C=CCNc1cccc(c1C#N)F 7a_100000236971_100015514636 [0,2,0,0,0,0|2,0,0]=4 6104 B13R1.3516 C=CCNc1cccc(c1CO)Br 34a_100000747656_100015514636 [0,2,0,0,0,0|1,0,0]=3 6105 B13R1.3516 C=CCNc1cccc(c1CO)Cl 34a_100011916388_100015514636 [0,2,0,0,0,0|1,0,0]=3 6106 B13R1.3516 C=CCNc1cccc(c1CO)F 34a_100011846719_100015514636 [0,2,0,0,0,0|1,0,0]=3 6107 B13R1.3516 C=CCNc1cccc(c1OC)Br 34a_100011935253_100015514636 [0,2,0,0,0,0|1,0,0]=3 6108 B13R1.3516 C=CCNc1cccc(c1OC)C 34a_100012017360_100015514636 [0,2,0,0,0,0|0,0,0]=2 6109 B13R1.3516 C=CCNc1cccc(c1OC)Cl 2230a_100000743799_100000210623 [0,2,0,0,0,0|1,0,0]=3 6110 B13R1.3516 C=CCNc1cccc(c1OC)Cl 34a_100000743799_100015514636 [0,2,0,0,0,0|1,0,0]=3 6111 B13R1.3516 C=CCNc1cccc(c1OC)F 34a_100011215007_100015514636 [0,2,0,0,0,0|1,0,0]=3 6112 B13R1.3516 C=CCNc1cncc(c1C#N)C 27a_100020586998_200009887794 [0,2,0,0,0,0|2,0,0]=4 6113 B13R1.3516 C=CCNc1nccc(c1C#N)C 27a_100020586998_100000691447 [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.3516 C=CCOc1cccc(c1C#N)Br 34a_100012180507_100015514636 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.3516 C=CCOc1cccc(c1C#N)Br 7a_100012180507_100015514636 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.3516 C=CCOc1cccc(c1C#N)C 34a_100000079363_100015514636 [0,2,0,0,0,0|1,0,0]=3 6117 B13R1.3516 C=CCOc1cccc(c1C#N)C 7a_100000079363_100015514636 [0,2,0,0,0,0|1,0,0]=3 6118 B13R1.3516 C=CCOc1cccc(c1C#N)Cl 34a_100000764475_100015514636 [0,2,0,0,0,0|2,0,0]=4 6119 B13R1.3516 C=CCOc1cccc(c1C#N)Cl 7a_100000764475_100015514636 [0,2,0,0,0,0|2,0,0]=4 6120 B13R1.3516 C=CCOc1cccc(c1C#N)F 34a_100000741147_100015514636 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.3516 C=CCOc1cccc(c1C#N)F 7a_100000741147_100015514636 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.3516 C=CCOc1cccc(c1CO)C 34a_200009874777_100015514636 [0,2,0,0,0,0|0,0,0]=2 6123 B13R1.3516 C=CCOc1cccc(c1CO)C 7a_200009874777_100015514636 [0,2,0,0,0,0|0,0,0]=2 6124 B13R1.3516 C=CCOc1cccc(c1OC)Br 34a_100010234590_100015514636 [0,2,0,0,0,0|1,0,0]=3 6125 B13R1.3516 C=CCOc1cccc(c1OC)Cl 34a_200009886253_100015514636 [0,2,0,0,0,0|1,0,0]=3 6126 B13R1.3516 C=CCOc1cccc(c1OC)Cl 7a_200009886253_100015514636 [0,2,0,0,0,0|1,0,0]=3 6127 B13R1.3516 C=CCOc1cccc(c1SC)C 34a_200000099257_100015514636 [0,2,0,0,0,0|0,1,0]=3 6128 B13R1.3516 C=CCOc1cccc(c1SC)C 7a_200000099257_100015514636 [0,2,0,0,0,0|0,1,0]=3 6129 B13R1.3516 C=CCOc1ccnc(c1OC)Cl 34a_100000104430_100015514636 [0,2,0,0,0,0|2,0,0]=4 6130 B13R1.3516 C=CCSc1cccc(c1C#N)Br 62a_100000210623_100010071968 [0,2,0,0,0,0|2,0,0]=4 6131 B13R1.3516 C=CCSc1cccc(c1C#N)Br 62a_100010071968_100000210623 [0,2,0,0,0,0|2,0,0]=4 6132 B13R1.3516 C=CCSc1cccc(c1C#N)C 62a_100000210623_100009819585 [0,2,0,0,0,0|1,0,0]=3 6133 B13R1.3516 C=CCSc1cccc(c1C#N)Cl 62a_100000210623_200000049503 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.3516 C=CCSc1cccc(c1C#N)F 62a_100000210623_100000039607 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.3516 C=CCSc1cccc(c1C#N)N 62a_100000210623_100011935054 [0,2,0,0,0,0|2,0,0]=4 6136 B13R1.3516 C=CCSc1cccc(c1C#N)O 62a_100000210623_100012180507 [0,2,0,0,0,0|2,0,0]=4 6137 B13R1.3516 C=CCSc1cccc(c1C=O)C 62a_100000041122_100000210623 [0,2,0,0,0,0|0,0,1]=3 6138 B13R1.3516 C=CCSc1cccc(c1C=O)C 62a_100000210623_100000041122 [0,2,0,0,0,0|0,0,1]=3 6139 B13R1.3516 C=CCSc1cccc(c1C=O)Cl 62a_100000210623_100010147682 [0,2,0,0,0,0|1,0,1]=4 6140 B13R1.3516 C=CCSc1cccc(c1C=O)Cl 62a_100010147682_100000210623 [0,2,0,0,0,0|1,0,1]=4 6141 B13R1.3516 C=CCSc1cccc(c1C=O)F 62a_100000210083_100000210623 [0,2,0,0,0,0|1,0,1]=4 6142 B13R1.3516 C=CCSc1cccc(c1C=O)F 62a_100000210623_100000210083 [0,2,0,0,0,0|1,0,1]=4 6143 B13R1.3516 C=CCSc1cccc(c1C=O)N 62a_100010232536_100000210623 [0,2,0,0,0,0|1,0,1]=4 6144 B13R1.3516 C=CCSc1cccc(c1C=O)O 62a_100000210623_100010193437 [0,2,0,0,0,0|1,0,1]=4 6145 B13R1.3516 C=CCSc1cccc(c1CN)F 62a_100000210623_100012349121 [0,2,0,0,0,0|2,0,0]=4 6146 B13R1.3516 C=CCSc1cccc(c1CN)F 62a_100012349121_100000210623 [0,2,0,0,0,0|2,0,0]=4 6147 B13R1.3516 C=CCSc1cccc(c1CO)F 62a_100000210623_100012355691 [0,2,0,0,0,0|1,0,0]=3 6148 B13R1.3516 C=CCSc1cccc(c1CO)F 62a_100012355691_100000210623 [0,2,0,0,0,0|1,0,0]=3 6149 B13R1.3516 C=CCSc1cccc(c1CO)N 62a_100000210623_100000747656 [0,2,0,0,0,0|1,0,0]=3 6150 B13R1.3516 C=CCSc1cccc(c1CO)N 62a_100000747656_100000210623 [0,2,0,0,0,0|1,0,0]=3 6151 B13R1.3516 C=CCSc1cccc(c1NC)N 62a_100010510394_100000210623 [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.3516 C=CCSc1cccc(c1NN)F 62a_100000210623_100016994982 [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.3516 C=CCSc1cccc(c1NN)F 62a_100016994982_100000210623 [0,2,0,0,0,0|2,0,0]=4 6154 B13R1.3516 C=CCSc1cccc(c1OC)Br 62a_100000210623_100010146560 [0,2,0,0,0,0|1,0,0]=3 6155 B13R1.3516 C=CCSc1cccc(c1OC)Br 62a_100010146560_100000210623 [0,2,0,0,0,0|1,0,0]=3 6156 B13R1.3516 C=CCSc1cccc(c1OC)C 62a_100000210623_100010141385 [0,2,0,0,0,0|0,0,0]=2 6157 B13R1.3516 C=CCSc1cccc(c1OC)C 62a_100010141385_100000210623 [0,2,0,0,0,0|0,0,0]=2 6158 B13R1.3516 C=CCSc1cccc(c1OC)Cl 62a_100000210623_100010147678 [0,2,0,0,0,0|1,0,0]=3 6159 B13R1.3516 C=CCSc1cccc(c1OC)Cl 62a_100010147678_100000210623 [0,2,0,0,0,0|1,0,0]=3 6160 B13R1.3516 C=CCSc1cccc(c1OC)F 62a_100000210623_100009816759 [0,2,0,0,0,0|1,0,0]=3 6161 B13R1.3516 C=CCSc1cccc(c1OC)F 62a_100009816759_100000210623 [0,2,0,0,0,0|1,0,0]=3 6162 B13R1.3516 C=CCSc1cccc(c1OC)N 62a_100011935253_100000210623 [0,2,0,0,0,0|1,0,0]=3 6163 B13R1.3516 C=CCSc1cccc(c1OC)O 62a_100000210623_100010234590 [0,2,0,0,0,0|1,0,0]=3 6164 B13R1.3516 C=CCSc1cccc(c1SC)F 62a_100000210623_200010709249 [0,2,0,0,0,0|1,1,0]=4 6165 B13R1.3516 C=CCSc1cccc(c1SC)F 62a_200010709249_100000210623 [0,2,0,0,0,0|1,1,0]=4 6166 B13R1.3516 C=CCSc1ccnc(c1CO)Cl 62a_100000047008_100000210623 [0,2,0,0,0,0|2,0,0]=4 6167 B13R1.3516 C=CCSc1ccnc(c1CO)Cl 62a_100000210623_100000047008 [0,2,0,0,0,0|2,0,0]=4 6168 B13R1.3516 C=CCSc1ccnc(c1CO)F 62a_100000050056_100000210623 [0,2,0,0,0,0|2,0,0]=4 6169 B13R1.3516 C=CCSc1ccnc(c1CO)F 62a_100000210623_100000050056 [0,2,0,0,0,0|2,0,0]=4 6170 B13R1.3516 C=CCSc1ccnc(c1OC)C 62a_100000210623_100000685116 [0,2,0,0,0,0|1,0,0]=3 6171 B13R1.3516 C=CCSc1ccnc(c1OC)C 62a_100000685116_100000210623 [0,2,0,0,0,0|1,0,0]=3 6172 B13R1.3516 C=CCSc1ccnc(c1OC)Cl 62a_100000210623_100010068014 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.3516 C=CCSc1ccnc(c1OC)Cl 62a_100010068014_100000210623 [0,2,0,0,0,0|2,0,0]=4 6174 B13R1.3516 C=CCSc1ccnc(c1OC)N 62a_100000210623_100009880012 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.3516 C=CCSc1ccnc(c1OC)N 62a_100009880012_100000210623 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.3516 C=CCSc1cncc(c1C#N)C 62a_100000210623_200009887794 [0,2,0,0,0,0|2,0,0]=4 6177 B13R1.3516 C=CCSc1cncc(c1OC)N 62a_100000210623_100012359933 [0,2,0,0,0,0|2,0,0]=4 6178 B13R1.3516 C=CCSc1cncc(c1OC)N 62a_100012359933_100000210623 [0,2,0,0,0,0|2,0,0]=4 6179 B13R1.3516 C=CCSc1nccc(c1C#N)C 62a_100000210623_100000691447 [0,2,0,0,0,0|2,0,0]=4 6180 B13R1.3516 C=CCSc1nccc(c1OC)N 62a_100000104429_100000210623 [0,2,0,0,0,0|2,0,0]=4 6181 B13R1.3516 C=CCSc1nccc(c1OC)N 62a_100000210623_100000104429 [0,2,0,0,0,0|2,0,0]=4 6182 B13R1.3516 C=CCSc1nccc(c1OC)O 62a_100000210623_100000104430 [0,2,0,0,0,0|2,0,0]=4 6183 B13R1.3516 CCCCc1cccc(c1OC)C 271570a_100020621405_100010141385 [0,2,0,0,0,0|0,0,2]=4 6184 B13R1.3516 CCCNc1cccc(c1OC)C 34a_100012017360_100000210303 [0,2,0,0,0,0|0,0,2]=4 6185 B13R1.3516 CCCOc1cccc(c1CO)C 34a_200009874777_100000210303 [0,2,0,0,0,0|0,0,2]=4 6186 B13R1.3516 CCCOc1cccc(c1CO)C 7a_200009874777_100000210303 [0,2,0,0,0,0|0,0,2]=4 6187 B13R1.3516 CCCSc1cccc(c1OC)C 62a_100000210303_100010141385 [0,2,0,0,0,0|0,0,2]=4 6188 B13R1.3516 CCCSc1cccc(c1OC)C 62a_100010141385_100000210303 [0,2,0,0,0,0|0,0,2]=4 6189 B13R1.3516 CCNCc1cccc(c1OC)C 207a_100015525214_100011361485 [0,2,0,0,0,0|0,0,2]=4 6190 B13R1.3516 CCNCc1cccc(c1OC)C 2230a_100015525214_100012349798 [0,2,0,0,0,0|0,0,2]=4 6191 B13R1.3516 CCNCc1cccc(c1OC)C 270004a_100015525214_100011361485 [0,2,0,0,0,0|0,0,2]=4 6192 B13R1.3516 CCOCc1cccc(c1OC)C 34a_100012184769_100000210202 [0,2,0,0,0,0|0,0,2]=4 6193 B13R1.3516 CCOCc1cccc(c1OC)C 34a_100121572206_100012349798 [0,2,0,0,0,0|0,0,2]=4 6194 B13R1.3516 CCOCc1cccc(c1OC)C 7a_100012184769_100000210202 [0,2,0,0,0,0|0,0,2]=4 6195 B13R1.3516 CCSCc1cccc(c1OC)C 62a_100000210202_100012349798 [0,2,0,0,0,0|0,0,2]=4 6196 B13R1.3516 CCSCc1cccc(c1OC)C 62a_100012349798_100000210202 [0,2,0,0,0,0|0,0,2]=4 6197 B13R1.3516 COCSc1cccc(c1OC)C 62a_100000766300_100010141385 [0,2,0,0,0,0|1,0,1]=4 6198 B13R1.3516 COCSc1cccc(c1OC)C 62a_100010141385_100000766300 [0,2,0,0,0,0|1,0,1]=4 6199 B13R1.3516 COc1c(cccc1COCF)C 34a_100012184769_100015361967 [0,2,0,0,0,0|1,0,1]=4 6200 B13R1.3516 COc1c(cccc1COCF)C 7a_100012184769_100015361967 [0,2,0,0,0,0|1,0,1]=4 6201 B13R1.3516 COc1c(cccc1CSCF)C 62a_100012349798_100015361967 [0,2,0,0,0,0|1,0,1]=4 6202 B13R1.3516 COc1c(cccc1CSCF)C 62a_100015361967_100012349798 [0,2,0,0,0,0|1,0,1]=4 6203 B13R1.3516 COc1c(cccc1NCC=O)Br 34a_100011935253_200009817547 [0,2,0,0,0,0|2,0,0]=4 6204 B13R1.3516 COc1c(cccc1NCC=O)C 34a_100012017360_200009817547 [0,2,0,0,0,0|1,0,0]=3 6205 B13R1.3516 COc1c(cccc1NCC=O)Cl 2230a_100000743799_200015260668 [0,2,0,0,0,0|2,0,0]=4 6206 B13R1.3516 COc1c(cccc1NCC=O)Cl 34a_100000743799_200009817547 [0,2,0,0,0,0|2,0,0]=4 6207 B13R1.3516 COc1c(cccc1NCC=O)F 34a_100011215007_200009817547 [0,2,0,0,0,0|2,0,0]=4 6208 B13R1.3516 COc1c(cccc1NCCF)C 34a_100012017360_100011217306 [0,2,0,0,0,0|1,0,1]=4 6209 B13R1.3516 COc1c(cccc1NCCO)C 34a_100012017360_100000211926 [0,2,0,0,0,0|1,0,1]=4 6210 B13R1.3516 COc1c(cccc1NCSC)C 34a_100012017360_100011218213 [0,2,0,0,0,0|1,0,1]=4 6211 B13R1.3516 COc1c(cccc1OCC=O)Br 34a_100010234590_200009817547 [0,2,0,0,0,0|2,0,0]=4 6212 B13R1.3516 COc1c(cccc1OCC=O)Cl 34a_200009886253_200009817547 [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.3516 COc1c(cccc1OCC=O)Cl 7a_200009886253_200015260668 [0,2,0,0,0,0|2,0,0]=4 6214 B13R1.3516 COc1c(cccc1SCC#N)C 62a_100010141385_100011215382 [0,2,0,0,0,0|1,0,1]=4 6215 B13R1.3516 COc1c(cccc1SCC#N)C 62a_100011215382_100010141385 [0,2,0,0,0,0|1,0,1]=4 6216 B13R1.3516 COc1c(cccc1SCC=O)Br 62a_100010146560_200015260668 [0,2,0,0,0,0|2,0,0]=4 6217 B13R1.3516 COc1c(cccc1SCC=O)Br 62a_200015260668_100010146560 [0,2,0,0,0,0|2,0,0]=4 6218 B13R1.3516 COc1c(cccc1SCC=O)C 62a_100010141385_200015260668 [0,2,0,0,0,0|1,0,0]=3 6219 B13R1.3516 COc1c(cccc1SCC=O)C 62a_200015260668_100010141385 [0,2,0,0,0,0|1,0,0]=3 6220 B13R1.3516 COc1c(cccc1SCC=O)Cl 62a_100010147678_200015260668 [0,2,0,0,0,0|2,0,0]=4 6221 B13R1.3516 COc1c(cccc1SCC=O)Cl 62a_200015260668_100010147678 [0,2,0,0,0,0|2,0,0]=4 6222 B13R1.3516 COc1c(cccc1SCC=O)F 62a_100009816759_200015260668 [0,2,0,0,0,0|2,0,0]=4 6223 B13R1.3516 COc1c(cccc1SCC=O)F 62a_200015260668_100009816759 [0,2,0,0,0,0|2,0,0]=4 6224 B13R1.3516 COc1c(cccc1SCC=O)N 62a_100011935253_200015260668 [0,2,0,0,0,0|2,0,0]=4 6225 B13R1.3516 COc1c(cccc1SCC=O)O 62a_200015260668_100010234590 [0,2,0,0,0,0|2,0,0]=4 6226 B13R1.3516 COc1c(cccc1SCCF)C 62a_100010141385_100011217306 [0,2,0,0,0,0|1,0,1]=4 6227 B13R1.3516 COc1c(cccc1SCCF)C 62a_100011217306_100010141385 [0,2,0,0,0,0|1,0,1]=4 6228 B13R1.3516 COc1c(cccc1SCCO)C 62a_100000211926_100010141385 [0,2,0,0,0,0|1,0,1]=4 6229 B13R1.3516 COc1c(cccc1SCCO)C 62a_100010141385_100000211926 [0,2,0,0,0,0|1,0,1]=4 6230 B13R1.3516 COc1c(cccc1SCSC)C 62a_100010141385_100011218213 [0,2,0,0,0,0|1,0,1]=4 6231 B13R1.3516 COc1c(cccc1SCSC)C 62a_100011218213_100010141385 [0,2,0,0,0,0|1,0,1]=4 6232 B13R1.3516 COc1c(ccnc1C)SCC=O 62a_100000685116_200015260668 [0,2,0,0,0,0|2,0,0]=4 6233 B13R1.3516 COc1c(ccnc1C)SCC=O 62a_200015260668_100000685116 [0,2,0,0,0,0|2,0,0]=4 6234 B13R1.3516 CSCOc1cccc(c1CO)C 34a_200009874777_100011218213 [0,2,0,0,0,0|1,0,1]=4 6235 B13R1.3516 CSc1c(cccc1OCC=O)C 34a_200000099257_200009817547 [0,2,0,0,0,0|1,1,0]=4 6236 B13R1.3516 CSc1c(cccc1OCC=O)C 7a_200000099257_200015260668 [0,2,0,0,0,0|1,1,0]=4 6237 B13R1.3516 Cc1cccc(c1C#N)NCC=O 2230a_100000763283_200015260668 [0,2,0,0,0,0|2,0,0]=4 6238 B13R1.3516 Cc1cccc(c1C#N)NCC=O 34a_100000763283_200009817547 [0,2,0,0,0,0|2,0,0]=4 6239 B13R1.3516 Cc1cccc(c1C#N)NCC=O 7a_100000763283_200015260668 [0,2,0,0,0,0|2,0,0]=4 6240 B13R1.3516 Cc1cccc(c1C#N)OCC=O 34a_100000079363_200009817547 [0,2,0,0,0,0|2,0,0]=4 6241 B13R1.3516 Cc1cccc(c1C#N)OCC=O 7a_100000079363_200015260668 [0,2,0,0,0,0|2,0,0]=4 6242 B13R1.3516 Cc1cccc(c1C#N)SCC=O 62a_200015260668_100009819585 [0,2,0,0,0,0|2,0,0]=4 6243 B13R1.3516 Cc1cccc(c1C=O)SCC=O 62a_100000041122_200015260668 [0,2,0,0,0,0|1,0,1]=4 6244 B13R1.3516 Cc1cccc(c1C=O)SCC=O 62a_200015260668_100000041122 [0,2,0,0,0,0|1,0,1]=4 6245 B13R1.3516 Cc1cccc(c1CO)OCC#N 7a_200009874777_100011215382 [0,2,0,0,0,0|1,0,1]=4 6246 B13R1.3516 Cc1cccc(c1CO)OCC=O 34a_200009874777_200009817547 [0,2,0,0,0,0|1,0,0]=3 6247 B13R1.3516 Cc1cccc(c1CO)OCC=O 7a_200009874777_200015260668 [0,2,0,0,0,0|1,0,0]=3 6248 B13R1.3516 Cc1cccc(c1CO)OCCF 34a_200009874777_100011217306 [0,2,0,0,0,0|1,0,1]=4 6249 B13R1.3516 Cc1cccc(c1CO)OCCF 7a_200009874777_100011217306 [0,2,0,0,0,0|1,0,1]=4 6250 B13R1.3516 Cc1cccc(c1CO)OCCO 34a_200009874777_100000211926 [0,2,0,0,0,0|1,0,1]=4 6251 B13R1.3516 Cc1cccc(c1CO)OCCO 7a_200009874777_100000211926 [0,2,0,0,0,0|1,0,1]=4 6252 B13R1.3516 Nc1cccc(c1CO)SCC=O 62a_100000747656_200015260668 [0,2,0,0,0,0|2,0,0]=4 6253 B13R1.3516 Nc1cccc(c1CO)SCC=O 62a_200015260668_100000747656 [0,2,0,0,0,0|2,0,0]=4 6254 B13R1.3516 O=CCNc1cccc(c1CO)Br 34a_100000747656_200009817547 [0,2,0,0,0,0|2,0,0]=4 6255 B13R1.3516 O=CCNc1cccc(c1CO)Cl 34a_100011916388_200009817547 [0,2,0,0,0,0|2,0,0]=4 6256 B13R1.3516 O=CCNc1cccc(c1CO)F 34a_100011846719_200009817547 [0,2,0,0,0,0|2,0,0]=4 6257 B13R1.3516 O=CCSc1cccc(c1CO)F 62a_100012355691_200015260668 [0,2,0,0,0,0|2,0,0]=4 6258 B13R1.3516 O=CCSc1cccc(c1CO)F 62a_200015260668_100012355691 [0,2,0,0,0,0|2,0,0]=4 6259 B13R1.3518 C#CCSc1ccc(c(c1O)C)F 62a_100000038162_200010391124 [0,2,0,0,0,0|0,0,2]=4 6260 B13R1.3518 C=CCNc1ccc(c(c1Br)Br)Br 34a_100010151465_100015514636 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.3518 C=CCNc1ccc(c(c1Br)Cl)Cl 34a_100021501213_100015514636 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.3518 C=CCNc1ccc(c(c1Br)F)F 2230a_100010232473_100000210623 [0,2,0,0,0,0|2,0,0]=4 6263 B13R1.3518 C=CCNc1ccc(c(c1Br)F)F 34a_100010232473_100015514636 [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.3518 C=CCNc1ccc(c(c1Br)F)F 7a_100010232473_100015514636 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.3518 C=CCNc1ccc(c(c1Br)F)I 34a_100015781493_100015514636 [0,2,0,0,0,0|2,0,0]=4 6266 B13R1.3518 C=CCNc1ccc(c(c1C)Br)Br 2230a_100010244494_100000210623 [0,2,0,0,0,0|2,0,0]=4 6267 B13R1.3518 C=CCNc1ccc(c(c1C)Br)Br 34a_100010244494_100015514636 [0,2,0,0,0,0|2,0,0]=4 6268 B13R1.3518 C=CCNc1ccc(c(c1C)Br)Br 7a_100010244494_100015514636 [0,2,0,0,0,0|2,0,0]=4 6269 B13R1.3518 C=CCNc1ccc(c(c1C)Br)C 2230a_106354213274_100000210623 [0,2,0,0,0,0|2,0,0]=4 6270 B13R1.3518 C=CCNc1ccc(c(c1C)Br)C 34a_106354213274_100015514636 [0,2,0,0,0,0|2,0,0]=4 6271 B13R1.3518 C=CCNc1ccc(c(c1C)Br)C 7a_106354213274_100015514636 [0,2,0,0,0,0|2,0,0]=4 6272 B13R1.3518 C=CCNc1ccc(c(c1C)Br)Cl 2230a_100016073598_100000210623 [0,2,0,0,0,0|2,0,0]=4 6273 B13R1.3518 C=CCNc1ccc(c(c1C)Br)Cl 34a_100016073598_100015514636 [0,2,0,0,0,0|2,0,0]=4 6274 B13R1.3518 C=CCNc1ccc(c(c1C)Br)Cl 7a_100016073598_100015514636 [0,2,0,0,0,0|2,0,0]=4 6275 B13R1.3518 C=CCNc1ccc(c(c1C)C)Br 2230a_100009816967_100000210623 [0,2,0,0,0,0|1,0,0]=3 6276 B13R1.3518 C=CCNc1ccc(c(c1C)C)Br 34a_100009816967_100015514636 [0,2,0,0,0,0|1,0,0]=3 6277 B13R1.3518 C=CCNc1ccc(c(c1C)C)Br 7a_100009816967_100015514636 [0,2,0,0,0,0|1,0,0]=3 6278 B13R1.3518 C=CCNc1ccc(c(c1C)C)C 2230a_100000116900_100000210623 [0,2,0,0,0,0|1,0,0]=3 6279 B13R1.3518 C=CCNc1ccc(c(c1C)C)C 34a_100000116900_100015514636 [0,2,0,0,0,0|1,0,0]=3 6280 B13R1.3518 C=CCNc1ccc(c(c1C)C)C 7a_100000116900_100015514636 [0,2,0,0,0,0|1,0,0]=3 6281 B13R1.3518 C=CCNc1ccc(c(c1C)C)F 2230a_100000062172_100000210623 [0,2,0,0,0,0|1,0,0]=3 6282 B13R1.3518 C=CCNc1ccc(c(c1C)C)F 34a_100000062172_100015514636 [0,2,0,0,0,0|1,0,0]=3 6283 B13R1.3518 C=CCNc1ccc(c(c1C)C)F 7a_100000062172_100015514636 [0,2,0,0,0,0|1,0,0]=3 6284 B13R1.3518 C=CCNc1ccc(c(c1C)C)O 34a_200011216674_100015514636 [0,2,0,0,0,0|1,0,0]=3 6285 B13R1.3518 C=CCNc1ccc(c(c1C)C)O 7a_200011216674_100015514636 [0,2,0,0,0,0|1,0,0]=3 6286 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)Br 2230a_100009816872_100000210623 [0,2,0,0,0,0|2,0,0]=4 6287 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)Br 34a_100009816872_100015514636 [0,2,0,0,0,0|2,0,0]=4 6288 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)Br 7a_100009816872_100015514636 [0,2,0,0,0,0|2,0,0]=4 6289 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)C 2230a_100009954856_100000210623 [0,2,0,0,0,0|2,0,0]=4 6290 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)C 34a_100009954856_100015514636 [0,2,0,0,0,0|2,0,0]=4 6291 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)C 7a_100009954856_100015514636 [0,2,0,0,0,0|2,0,0]=4 6292 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)Cl 2230a_114948340058_100000210623 [0,2,0,0,0,0|2,0,0]=4 6293 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)Cl 34a_114948340058_100015514636 [0,2,0,0,0,0|2,0,0]=4 6294 B13R1.3518 C=CCNc1ccc(c(c1C)Cl)Cl 7a_114948340058_100015514636 [0,2,0,0,0,0|2,0,0]=4 6295 B13R1.3518 C=CCNc1ccc(c(c1C)F)Br 2230a_100010208198_100000210623 [0,2,0,0,0,0|2,0,0]=4 6296 B13R1.3518 C=CCNc1ccc(c(c1C)F)Br 34a_100010208198_100015514636 [0,2,0,0,0,0|2,0,0]=4 6297 B13R1.3518 C=CCNc1ccc(c(c1C)F)Br 7a_100010208198_100015514636 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.3518 C=CCNc1ccc(c(c1C)F)I 34a_100010291050_100015514636 [0,2,0,0,0,0|2,0,0]=4 6299 B13R1.3518 C=CCNc1ccc(c(c1C)F)I 7a_100010291050_100015514636 [0,2,0,0,0,0|2,0,0]=4 6300 B13R1.3518 C=CCNc1ccc(c(c1C)I)C 34a_100011170560_100015514636 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.3518 C=CCNc1ccc(c(c1C)I)C 7a_100011170560_100015514636 [0,2,0,0,0,0|2,0,0]=4 6302 B13R1.3518 C=CCNc1ccc(c(c1Cl)C)Cl 34a_100011935240_100015514636 [0,2,0,0,0,0|1,0,0]=3 6303 B13R1.3518 C=CCNc1ccc(c(c1Cl)C)Cl 7a_100011935240_100015514636 [0,2,0,0,0,0|1,0,0]=3 6304 B13R1.3518 C=CCNc1ccc(c(c1Cl)C)F 2230a_100009863382_100000210623 [0,2,0,0,0,0|1,0,0]=3 6305 B13R1.3518 C=CCNc1ccc(c(c1Cl)C)F 34a_100009863382_100015514636 [0,2,0,0,0,0|1,0,0]=3 6306 B13R1.3518 C=CCNc1ccc(c(c1Cl)C)F 7a_100009863382_100015514636 [0,2,0,0,0,0|1,0,0]=3 6307 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)Br 34a_100000701039_100015514636 [0,2,0,0,0,0|2,0,0]=4 6308 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)Cl 34a_200000033989_100015514636 [0,2,0,0,0,0|2,0,0]=4 6309 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)F 2230a_100000068956_100000210623 [0,2,0,0,0,0|2,0,0]=4 6310 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)F 34a_100000068956_100015514636 [0,2,0,0,0,0|2,0,0]=4 6311 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)F 7a_100000068956_100015514636 [0,2,0,0,0,0|2,0,0]=4 6312 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)O 34a_100012017499_100015514636 [0,2,0,0,0,0|2,0,0]=4 6313 B13R1.3518 C=CCNc1ccc(c(c1Cl)Cl)O 7a_100012017499_100015514636 [0,2,0,0,0,0|2,0,0]=4 6314 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)Br 2230a_100010109752_100000210623 [0,2,0,0,0,0|2,0,0]=4 6315 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)Br 34a_100010109752_100015514636 [0,2,0,0,0,0|2,0,0]=4 6316 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)Cl 2230a_100000069711_100000210623 [0,2,0,0,0,0|2,0,0]=4 6317 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)Cl 34a_100000069711_100015514636 [0,2,0,0,0,0|2,0,0]=4 6318 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)Cl 7a_100000069711_100015514636 [0,2,0,0,0,0|2,0,0]=4 6319 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)F 2230a_100000101296_100000210623 [0,2,0,0,0,0|2,0,0]=4 6320 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)F 34a_100000101296_100015514636 [0,2,0,0,0,0|2,0,0]=4 6321 B13R1.3518 C=CCNc1ccc(c(c1Cl)F)F 7a_100000101296_100015514636 [0,2,0,0,0,0|2,0,0]=4 6322 B13R1.3518 C=CCNc1ccc(c(c1Cl)O)C 34a_100000036876_100015514636 [0,2,0,0,0,0|2,0,0]=4 6323 B13R1.3518 C=CCNc1ccc(c(c1Cl)O)C 7a_100000036876_100015514636 [0,2,0,0,0,0|2,0,0]=4 6324 B13R1.3518 C=CCNc1ccc(c(c1F)Br)F 2230a_100010070858_100000210623 [0,2,0,0,0,0|2,0,0]=4 6325 B13R1.3518 C=CCNc1ccc(c(c1F)Br)F 34a_100010070858_100015514636 [0,2,0,0,0,0|2,0,0]=4 6326 B13R1.3518 C=CCNc1ccc(c(c1F)Br)F 7a_100010070858_100015514636 [0,2,0,0,0,0|2,0,0]=4 6327 B13R1.3518 C=CCNc1ccc(c(c1F)C)Br 2230a_100000722916_100000210623 [0,2,0,0,0,0|1,0,0]=3 6328 B13R1.3518 C=CCNc1ccc(c(c1F)C)Br 34a_100000722916_100015514636 [0,2,0,0,0,0|1,0,0]=3 6329 B13R1.3518 C=CCNc1ccc(c(c1F)C)Br 7a_100000722916_100015514636 [0,2,0,0,0,0|1,0,0]=3 6330 B13R1.3518 C=CCNc1ccc(c(c1F)C)F 2230a_102495366501_100000210623 [0,2,0,0,0,0|1,0,0]=3 6331 B13R1.3518 C=CCNc1ccc(c(c1F)C)F 34a_102495366501_100015514636 [0,2,0,0,0,0|1,0,0]=3 6332 B13R1.3518 C=CCNc1ccc(c(c1F)C)F 7a_102495366501_100015514636 [0,2,0,0,0,0|1,0,0]=3 6333 B13R1.3518 C=CCNc1ccc(c(c1F)C)O 34a_200000126710_100015514636 [0,2,0,0,0,0|1,0,0]=3 6334 B13R1.3518 C=CCNc1ccc(c(c1F)C)O 7a_200000126710_100015514636 [0,2,0,0,0,0|1,0,0]=3 6335 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)Br 2230a_100009813730_100000210623 [0,2,0,0,0,0|2,0,0]=4 6336 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)Br 34a_100009813730_100015514636 [0,2,0,0,0,0|2,0,0]=4 6337 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)Cl 2230a_100000036759_100000210623 [0,2,0,0,0,0|2,0,0]=4 6338 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)Cl 34a_100000036759_100015514636 [0,2,0,0,0,0|2,0,0]=4 6339 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)F 2230a_100000038966_100000210623 [0,2,0,0,0,0|2,0,0]=4 6340 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)F 34a_100000038966_100015514636 [0,2,0,0,0,0|2,0,0]=4 6341 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)F 7a_100000038966_100015514636 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)O 34a_200000098347_100015514636 [0,2,0,0,0,0|2,0,0]=4 6343 B13R1.3518 C=CCNc1ccc(c(c1F)Cl)O 7a_200000098347_100015514636 [0,2,0,0,0,0|2,0,0]=4 6344 B13R1.3518 C=CCNc1ccc(c(c1F)F)Br 2230a_100010200256_100000210623 [0,2,0,0,0,0|2,0,0]=4 6345 B13R1.3518 C=CCNc1ccc(c(c1F)F)Br 34a_100010200256_100015514636 [0,2,0,0,0,0|2,0,0]=4 6346 B13R1.3518 C=CCNc1ccc(c(c1F)F)C 2230a_100000062217_100000210623 [0,2,0,0,0,0|2,0,0]=4 6347 B13R1.3518 C=CCNc1ccc(c(c1F)F)C 34a_100000062217_100015514636 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.3518 C=CCNc1ccc(c(c1F)F)C 7a_100000062217_100015514636 [0,2,0,0,0,0|2,0,0]=4 6349 B13R1.3518 C=CCNc1ccc(c(c1F)F)Cl 2230a_100000088996_100000210623 [0,2,0,0,0,0|2,0,0]=4 6350 B13R1.3518 C=CCNc1ccc(c(c1F)F)Cl 34a_100000088996_100015514636 [0,2,0,0,0,0|2,0,0]=4 6351 B13R1.3518 C=CCNc1ccc(c(c1F)F)Cl 7a_100000088996_100015514636 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.3518 C=CCNc1ccc(c(c1F)F)F 2230a_100000210235_100000210623 [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.3518 C=CCNc1ccc(c(c1F)F)F 34a_100000210235_100015514636 [0,2,0,0,0,0|2,0,0]=4 6354 B13R1.3518 C=CCNc1ccc(c(c1F)F)F 7a_100000210235_100015514636 [0,2,0,0,0,0|2,0,0]=4 6355 B13R1.3518 C=CCNc1ccc(c(c1F)F)I 34a_100010291506_100015514636 [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.3518 C=CCNc1ccc(c(c1F)F)I 7a_100010291506_100015514636 [0,2,0,0,0,0|2,0,0]=4 6357 B13R1.3518 C=CCNc1ccc(c(c1F)F)O 34a_100015204651_100015514636 [0,2,0,0,0,0|2,0,0]=4 6358 B13R1.3518 C=CCNc1ccc(c(c1F)F)O 7a_100015204651_100015514636 [0,2,0,0,0,0|2,0,0]=4 6359 B13R1.3518 C=CCNc1ccc(c(c1F)I)F 34a_100015510717_100015514636 [0,2,0,0,0,0|2,0,0]=4 6360 B13R1.3518 C=CCNc1ccc(c(c1I)Br)F 34a_100020765651_100015514636 [0,2,0,0,0,0|2,0,0]=4 6361 B13R1.3518 C=CCNc1ccc(c(c1I)Cl)Br 34a_200010779962_100015514636 [0,2,0,0,0,0|2,0,0]=4 6362 B13R1.3518 C=CCNc1ccc(c(c1I)Cl)Cl 34a_200011093878_100015514636 [0,2,0,0,0,0|2,0,0]=4 6363 B13R1.3518 C=CCNc1ccc(c(c1I)F)Cl 34a_100010134325_100015514636 [0,2,0,0,0,0|2,0,0]=4 6364 B13R1.3518 C=CCNc1ccc(c(c1O)Br)F 34a_100010128263_100015514636 [0,2,0,0,0,0|1,0,0]=3 6365 B13R1.3518 C=CCNc1ccc(c(c1O)F)F 34a_100015205010_100015514636 [0,2,0,0,0,0|1,0,0]=3 6366 B13R1.3518 C=CCOc1ccc(c(c1C)Br)C 34a_100010659238_100015514636 [0,2,0,0,0,0|2,0,0]=4 6367 B13R1.3518 C=CCOc1ccc(c(c1C)Br)C 7a_100010659238_100015514636 [0,2,0,0,0,0|2,0,0]=4 6368 B13R1.3518 C=CCOc1ccc(c(c1C)C)Br 34a_100012353674_100015514636 [0,2,0,0,0,0|1,0,0]=3 6369 B13R1.3518 C=CCOc1ccc(c(c1C)C)Br 7a_100012353674_100015514636 [0,2,0,0,0,0|1,0,0]=3 6370 B13R1.3518 C=CCOc1ccc(c(c1C)C)F 34a_100009847123_100015514636 [0,2,0,0,0,0|1,0,0]=3 6371 B13R1.3518 C=CCOc1ccc(c(c1C)C)F 7a_100009847123_100015514636 [0,2,0,0,0,0|1,0,0]=3 6372 B13R1.3518 C=CCOc1ccc(c(c1C)C)I 34a_100011356951_100015514636 [0,2,0,0,0,0|1,0,0]=3 6373 B13R1.3518 C=CCOc1ccc(c(c1C)C)I 7a_100011356951_100015514636 [0,2,0,0,0,0|1,0,0]=3 6374 B13R1.3518 C=CCOc1ccc(c(c1C)C)N 34a_200011216674_100015514636 [0,2,0,0,0,0|1,0,0]=3 6375 B13R1.3518 C=CCOc1ccc(c(c1C)C)N 7a_200011216674_100015514636 [0,2,0,0,0,0|1,0,0]=3 6376 B13R1.3518 C=CCOc1ccc(c(c1C)F)Br 34a_100010390934_100015514636 [0,2,0,0,0,0|2,0,0]=4 6377 B13R1.3518 C=CCOc1ccc(c(c1C)F)Br 7a_100010390934_100015514636 [0,2,0,0,0,0|2,0,0]=4 6378 B13R1.3518 C=CCOc1ccc(c(c1C)F)N 34a_200000126710_100015514636 [0,2,0,0,0,0|2,0,0]=4 6379 B13R1.3518 C=CCOc1ccc(c(c1C)F)N 7a_200000126710_100015514636 [0,2,0,0,0,0|2,0,0]=4 6380 B13R1.3518 C=CCOc1ccc(c(c1Cl)C)Br 34a_100021574527_100015514636 [0,2,0,0,0,0|1,0,0]=3 6381 B13R1.3518 C=CCOc1ccc(c(c1Cl)C)Br 7a_100021574527_100015514636 [0,2,0,0,0,0|1,0,0]=3 6382 B13R1.3518 C=CCOc1ccc(c(c1Cl)Cl)Br 34a_100011988769_100015514636 [0,2,0,0,0,0|2,0,0]=4 6383 B13R1.3518 C=CCOc1ccc(c(c1Cl)Cl)Br 7a_100011988769_100015514636 [0,2,0,0,0,0|2,0,0]=4 6384 B13R1.3518 C=CCOc1ccc(c(c1Cl)Cl)Cl 34a_200011215298_100015514636 [0,2,0,0,0,0|2,0,0]=4 6385 B13R1.3518 C=CCOc1ccc(c(c1Cl)Cl)Cl 7a_200011215298_100015514636 [0,2,0,0,0,0|2,0,0]=4 6386 B13R1.3518 C=CCOc1ccc(c(c1Cl)Cl)N 34a_100012017499_100015514636 [0,2,0,0,0,0|2,0,0]=4 6387 B13R1.3518 C=CCOc1ccc(c(c1Cl)Cl)N 7a_100012017499_100015514636 [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.3518 C=CCOc1ccc(c(c1Cl)F)Br 34a_100010245746_100015514636 [0,2,0,0,0,0|2,0,0]=4 6389 B13R1.3518 C=CCOc1ccc(c(c1Cl)F)Br 7a_100010245746_100015514636 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.3518 C=CCOc1ccc(c(c1Cl)F)N 34a_200000098347_100015514636 [0,2,0,0,0,0|2,0,0]=4 6391 B13R1.3518 C=CCOc1ccc(c(c1Cl)F)N 7a_200000098347_100015514636 [0,2,0,0,0,0|2,0,0]=4 6392 B13R1.3518 C=CCOc1ccc(c(c1Cl)N)Cl 34a_100016988457_100015514636 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.3518 C=CCOc1ccc(c(c1Cl)N)Cl 7a_100016988457_100015514636 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.3518 C=CCOc1ccc(c(c1F)F)Br 34a_100011830415_100015514636 [0,2,0,0,0,0|2,0,0]=4 6395 B13R1.3518 C=CCOc1ccc(c(c1F)F)Br 7a_100011830415_100015514636 [0,2,0,0,0,0|2,0,0]=4 6396 B13R1.3518 C=CCOc1ccc(c(c1F)F)C 34a_100000036877_100015514636 [0,2,0,0,0,0|2,0,0]=4 6397 B13R1.3518 C=CCOc1ccc(c(c1F)F)C 7a_100000036877_100015514636 [0,2,0,0,0,0|2,0,0]=4 6398 B13R1.3518 C=CCOc1ccc(c(c1F)F)F 34a_100000230025_100015514636 [0,2,0,0,0,0|2,0,0]=4 6399 B13R1.3518 C=CCOc1ccc(c(c1F)F)F 7a_100000230025_100015514636 [0,2,0,0,0,0|2,0,0]=4 6400 B13R1.3518 C=CCOc1ccc(c(c1F)F)I 34a_200011356956_100015514636 [0,2,0,0,0,0|2,0,0]=4 6401 B13R1.3518 C=CCOc1ccc(c(c1F)F)I 7a_200011356956_100015514636 [0,2,0,0,0,0|2,0,0]=4 6402 B13R1.3518 C=CCOc1ccc(c(c1F)F)N 34a_100015204651_100015514636 [0,2,0,0,0,0|2,0,0]=4 6403 B13R1.3518 C=CCOc1ccc(c(c1F)F)N 7a_100015204651_100015514636 [0,2,0,0,0,0|2,0,0]=4 6404 B13R1.3518 C=CCOc1ccc(c(c1N)C)Br 34a_100013039247_100015514636 [0,2,0,0,0,0|1,0,0]=3 6405 B13R1.3518 C=CCOc1ccc(c(c1N)C)Br 7a_100013039247_100015514636 [0,2,0,0,0,0|1,0,0]=3 6406 B13R1.3518 C=CCOc1ncc(c(c1Br)C)Cl 34a_200010175591_100015514636 [0,2,0,0,0,0|2,0,0]=4 6407 B13R1.3518 C=CCOc1ncc(c(c1C)C)Br 34a_200011099879_100015514636 [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.3518 C=CCSc1cc[n+](c(c1C)C)[O-] 62a_100000210623_100000083769 [0,2,0,0,0,0|2,0,0]=4 6409 B13R1.3518 C=CCSc1ccc(c(c1C)C)Br 62a_100000210623_200010185626 [0,2,0,0,0,0|1,0,0]=3 6410 B13R1.3518 C=CCSc1ccc(c(c1C)C)Br 62a_200010185626_100000210623 [0,2,0,0,0,0|1,0,0]=3 6411 B13R1.3518 C=CCSc1ccc(c(c1C)C)F 62a_100000210623_100009816033 [0,2,0,0,0,0|1,0,0]=3 6412 B13R1.3518 C=CCSc1ccc(c(c1C)C)F 62a_100009816033_100000210623 [0,2,0,0,0,0|1,0,0]=3 6413 B13R1.3518 C=CCSc1ccc(c(c1C)C)N 62a_100000210623_100009816967 [0,2,0,0,0,0|1,0,0]=3 6414 B13R1.3518 C=CCSc1ccc(c(c1C)C)N 62a_100009816967_100000210623 [0,2,0,0,0,0|1,0,0]=3 6415 B13R1.3518 C=CCSc1ccc(c(c1C)C)O 62a_100000210623_100012353674 [0,2,0,0,0,0|1,0,0]=3 6416 B13R1.3518 C=CCSc1ccc(c(c1C)C)O 62a_100012353674_100000210623 [0,2,0,0,0,0|1,0,0]=3 6417 B13R1.3518 C=CCSc1ccc(c(c1C)Cl)Br 62a_100000210623_200010212245 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.3518 C=CCSc1ccc(c(c1C)Cl)Br 62a_200010212245_100000210623 [0,2,0,0,0,0|2,0,0]=4 6419 B13R1.3518 C=CCSc1ccc(c(c1C)F)Br 62a_100000210623_100010208201 [0,2,0,0,0,0|2,0,0]=4 6420 B13R1.3518 C=CCSc1ccc(c(c1C)F)Br 62a_100010208201_100000210623 [0,2,0,0,0,0|2,0,0]=4 6421 B13R1.3518 C=CCSc1ccc(c(c1C)F)F 62a_100000210623_100009815991 [0,2,0,0,0,0|2,0,0]=4 6422 B13R1.3518 C=CCSc1ccc(c(c1C)F)F 62a_100009815991_100000210623 [0,2,0,0,0,0|2,0,0]=4 6423 B13R1.3518 C=CCSc1ccc(c(c1C)F)N 62a_100000210623_100000722916 [0,2,0,0,0,0|2,0,0]=4 6424 B13R1.3518 C=CCSc1ccc(c(c1C)F)N 62a_100000722916_100000210623 [0,2,0,0,0,0|2,0,0]=4 6425 B13R1.3518 C=CCSc1ccc(c(c1C)N)C 62a_100000210623_200010074581 [0,2,0,0,0,0|2,0,0]=4 6426 B13R1.3518 C=CCSc1ccc(c(c1C)N)C 62a_200010074581_100000210623 [0,2,0,0,0,0|2,0,0]=4 6427 B13R1.3518 C=CCSc1ccc(c(c1C)N)F 62a_100000210623_100010588651 [0,2,0,0,0,0|2,0,0]=4 6428 B13R1.3518 C=CCSc1ccc(c(c1C)N)F 62a_100010588651_100000210623 [0,2,0,0,0,0|2,0,0]=4 6429 B13R1.3518 C=CCSc1ccc(c(c1C)N)N 62a_100010009725_100000210623 [0,2,0,0,0,0|2,0,0]=4 6430 B13R1.3518 C=CCSc1ccc(c(c1C)N)O 62a_100000210623_100013039247 [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.3518 C=CCSc1ccc(c(c1C)N)O 62a_100013039247_100000210623 [0,2,0,0,0,0|2,0,0]=4 6432 B13R1.3518 C=CCSc1ccc(c(c1Cl)C)Br 62a_100000210623_100055076181 [0,2,0,0,0,0|1,0,0]=3 6433 B13R1.3518 C=CCSc1ccc(c(c1Cl)C)Br 62a_100055076181_100000210623 [0,2,0,0,0,0|1,0,0]=3 6434 B13R1.3518 C=CCSc1ccc(c(c1Cl)C)Cl 62a_100000210623_100010730154 [0,2,0,0,0,0|1,0,0]=3 6435 B13R1.3518 C=CCSc1ccc(c(c1Cl)C)Cl 62a_100010730154_100000210623 [0,2,0,0,0,0|1,0,0]=3 6436 B13R1.3518 C=CCSc1ccc(c(c1F)Br)F 62a_100000210623_100010167943 [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.3518 C=CCSc1ccc(c(c1F)Br)F 62a_100010167943_100000210623 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.3518 C=CCSc1ccc(c(c1F)Br)N 62a_100000210623_100015781493 [0,2,0,0,0,0|2,0,0]=4 6439 B13R1.3518 C=CCSc1ccc(c(c1F)Br)N 62a_100015781493_100000210623 [0,2,0,0,0,0|2,0,0]=4 6440 B13R1.3518 C=CCSc1ccc(c(c1F)C)C 62a_100000210623_200015555822 [0,2,0,0,0,0|1,0,0]=3 6441 B13R1.3518 C=CCSc1ccc(c(c1F)C)C 62a_200015555822_100000210623 [0,2,0,0,0,0|1,0,0]=3 6442 B13R1.3518 C=CCSc1ccc(c(c1F)C)F 62a_100000210623_100009815987 [0,2,0,0,0,0|1,0,0]=3 6443 B13R1.3518 C=CCSc1ccc(c(c1F)C)F 62a_100009815987_100000210623 [0,2,0,0,0,0|1,0,0]=3 6444 B13R1.3518 C=CCSc1ccc(c(c1F)C)N 62a_100000210623_100010208198 [0,2,0,0,0,0|1,0,0]=3 6445 B13R1.3518 C=CCSc1ccc(c(c1F)C)N 62a_100010208198_100000210623 [0,2,0,0,0,0|1,0,0]=3 6446 B13R1.3518 C=CCSc1ccc(c(c1F)C)O 62a_100000210623_100010390934 [0,2,0,0,0,0|1,0,0]=3 6447 B13R1.3518 C=CCSc1ccc(c(c1F)C)O 62a_100010390934_100000210623 [0,2,0,0,0,0|1,0,0]=3 6448 B13R1.3518 C=CCSc1ccc(c(c1F)Cl)Br 62a_100000210623_100010212236 [0,2,0,0,0,0|2,0,0]=4 6449 B13R1.3518 C=CCSc1ccc(c(c1F)Cl)Br 62a_100010212236_100000210623 [0,2,0,0,0,0|2,0,0]=4 6450 B13R1.3518 C=CCSc1ccc(c(c1F)Cl)F 62a_100000210623_200000038702 [0,2,0,0,0,0|2,0,0]=4 6451 B13R1.3518 C=CCSc1ccc(c(c1F)Cl)F 62a_200000038702_100000210623 [0,2,0,0,0,0|2,0,0]=4 6452 B13R1.3518 C=CCSc1ccc(c(c1F)F)Br 62a_100000210623_100010212264 [0,2,0,0,0,0|2,0,0]=4 6453 B13R1.3518 C=CCSc1ccc(c(c1F)F)Br 62a_100010212264_100000210623 [0,2,0,0,0,0|2,0,0]=4 6454 B13R1.3518 C=CCSc1ccc(c(c1F)F)C 62a_100000210623_100012766498 [0,2,0,0,0,0|2,0,0]=4 6455 B13R1.3518 C=CCSc1ccc(c(c1F)F)C 62a_100012766498_100000210623 [0,2,0,0,0,0|2,0,0]=4 6456 B13R1.3518 C=CCSc1ccc(c(c1F)F)F 62a_100000210623_100000750562 [0,2,0,0,0,0|2,0,0]=4 6457 B13R1.3518 C=CCSc1ccc(c(c1F)F)F 62a_100000750562_100000210623 [0,2,0,0,0,0|2,0,0]=4 6458 B13R1.3518 C=CCSc1ccc(c(c1F)F)N 62a_100000210623_100010200256 [0,2,0,0,0,0|2,0,0]=4 6459 B13R1.3518 C=CCSc1ccc(c(c1F)F)N 62a_100010200256_100000210623 [0,2,0,0,0,0|2,0,0]=4 6460 B13R1.3518 C=CCSc1ccc(c(c1F)F)O 62a_100000210623_100011830415 [0,2,0,0,0,0|2,0,0]=4 6461 B13R1.3518 C=CCSc1ccc(c(c1F)F)O 62a_100011830415_100000210623 [0,2,0,0,0,0|2,0,0]=4 6462 B13R1.3518 C=CCSc1ccc(c(c1F)N)F 62a_100000210623_100025793129 [0,2,0,0,0,0|2,0,0]=4 6463 B13R1.3518 C=CCSc1ccc(c(c1F)N)F 62a_100025793129_100000210623 [0,2,0,0,0,0|2,0,0]=4 6464 B13R1.3518 C=CCSc1ccc(c(c1F)N)N 62a_100009814308_100000210623 [0,2,0,0,0,0|2,0,0]=4 6465 B13R1.3518 C=CCSc1ccc(c(c1F)O)Br 62a_100000210623_200010782288 [0,2,0,0,0,0|2,0,0]=4 6466 B13R1.3518 C=CCSc1ccc(c(c1F)O)Br 62a_200010782288_100000210623 [0,2,0,0,0,0|2,0,0]=4 6467 B13R1.3518 C=CCSc1ccc(c(c1F)O)F 62a_100000210623_100010167067 [0,2,0,0,0,0|2,0,0]=4 6468 B13R1.3518 C=CCSc1ccc(c(c1F)O)F 62a_100010167067_100000210623 [0,2,0,0,0,0|2,0,0]=4 6469 B13R1.3518 C=CCSc1ccc(c(c1N)C)F 62a_100000210623_100011009917 [0,2,0,0,0,0|1,0,0]=3 6470 B13R1.3518 C=CCSc1ccc(c(c1N)C)F 62a_100011009917_100000210623 [0,2,0,0,0,0|1,0,0]=3 6471 B13R1.3518 C=CCSc1ccc(c(c1N)F)F 62a_100000210623_100010008850 [0,2,0,0,0,0|2,0,0]=4 6472 B13R1.3518 C=CCSc1ccc(c(c1N)F)F 62a_100010008850_100000210623 [0,2,0,0,0,0|2,0,0]=4 6473 B13R1.3518 C=CCSc1ccc(c(c1N)N)F 62a_100011102919_100000210623 [0,2,0,0,0,0|2,0,0]=4 6474 B13R1.3518 C=CCSc1ccc(c(c1N)O)Br 62a_100020748643_100000210623 [0,2,0,0,0,0|2,0,0]=4 6475 B13R1.3518 C=CCSc1ccc(c(c1O)C)F 62a_100000210623_200010391124 [0,2,0,0,0,0|0,0,0]=2 6476 B13R1.3518 C=CCSc1ccc(c(c1O)C)F 62a_200010391124_100000210623 [0,2,0,0,0,0|0,0,0]=2 6477 B13R1.3518 C=CCSc1ccc(c(c1O)F)C 62a_100000210623_100000722096 [0,2,0,0,0,0|1,0,0]=3 6478 B13R1.3518 C=CCSc1ccc(c(c1O)F)C 62a_100000722096_100000210623 [0,2,0,0,0,0|1,0,0]=3 6479 B13R1.3518 C=CCSc1ccc(c(c1O)F)F 62a_100000210623_100010243909 [0,2,0,0,0,0|1,0,0]=3 6480 B13R1.3518 C=CCSc1ccc(c(c1O)F)F 62a_100010243909_100000210623 [0,2,0,0,0,0|1,0,0]=3 6481 B13R1.3518 C=CCSc1cnc(c(c1C)C)N 62a_100000210623_100009813837 [0,2,0,0,0,0|2,0,0]=4 6482 B13R1.3518 C=CCSc1cnc(c(c1C)C)N 62a_100009813837_100000210623 [0,2,0,0,0,0|2,0,0]=4 6483 B13R1.3518 C=CCSc1cnc(c(c1C)C)O 62a_100000210623_200011099879 [0,2,0,0,0,0|2,0,0]=4 6484 B13R1.3518 C=CCSc1cnc(c(c1C)C)O 62a_200011099879_100000210623 [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.3518 CCCCc1ccc(c(c1O)C)F 271570a_100020621405_200010391124 [0,2,0,0,0,0|0,0,2]=4 6486 B13R1.3518 CCCSc1ccc(c(c1O)C)F 62a_100000210303_200010391124 [0,2,0,0,0,0|0,0,2]=4 6487 B13R1.3518 CCCSc1ccc(c(c1O)C)F 62a_200010391124_100000210303 [0,2,0,0,0,0|0,0,2]=4 6488 B13R1.3518 COCSc1ccc(c(c1O)C)F 62a_100000766300_200010391124 [0,2,0,0,0,0|1,0,1]=4 6489 B13R1.3518 COCSc1ccc(c(c1O)C)F 62a_200010391124_100000766300 [0,2,0,0,0,0|1,0,1]=4 6490 B13R1.3518 CSCSc1ccc(c(c1O)C)F 62a_100011218213_200010391124 [0,2,0,0,0,0|1,0,1]=4 6491 B13R1.3518 CSCSc1ccc(c(c1O)C)F 62a_200010391124_100011218213 [0,2,0,0,0,0|1,0,1]=4 6492 B13R1.3518 Cc1c(ccc(c1C)NCC=O)Br 2230a_100009816967_200015260668 [0,2,0,0,0,0|2,0,0]=4 6493 B13R1.3518 Cc1c(ccc(c1C)NCC=O)Br 34a_100009816967_200009817547 [0,2,0,0,0,0|2,0,0]=4 6494 B13R1.3518 Cc1c(ccc(c1C)NCC=O)Br 7a_100009816967_200015260668 [0,2,0,0,0,0|2,0,0]=4 6495 B13R1.3518 Cc1c(ccc(c1C)NCC=O)F 2230a_100000062172_200015260668 [0,2,0,0,0,0|2,0,0]=4 6496 B13R1.3518 Cc1c(ccc(c1C)NCC=O)F 34a_100000062172_200009817547 [0,2,0,0,0,0|2,0,0]=4 6497 B13R1.3518 Cc1c(ccc(c1C)NCC=O)F 7a_100000062172_200015260668 [0,2,0,0,0,0|2,0,0]=4 6498 B13R1.3518 Cc1c(ccc(c1C)NCC=O)O 34a_200011216674_200009817547 [0,2,0,0,0,0|2,0,0]=4 6499 B13R1.3518 Cc1c(ccc(c1C)NCC=O)O 7a_200011216674_200015260668 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.3518 Cc1c(ccc(c1C)OCC=O)Br 34a_100012353674_200009817547 [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.3518 Cc1c(ccc(c1C)OCC=O)Br 7a_100012353674_200015260668 [0,2,0,0,0,0|2,0,0]=4 6502 B13R1.3518 Cc1c(ccc(c1C)OCC=O)F 34a_100009847123_200009817547 [0,2,0,0,0,0|2,0,0]=4 6503 B13R1.3518 Cc1c(ccc(c1C)OCC=O)F 7a_100009847123_200015260668 [0,2,0,0,0,0|2,0,0]=4 6504 B13R1.3518 Cc1c(ccc(c1C)OCC=O)I 34a_100011356951_200009817547 [0,2,0,0,0,0|2,0,0]=4 6505 B13R1.3518 Cc1c(ccc(c1C)OCC=O)I 7a_100011356951_200015260668 [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.3518 Cc1c(ccc(c1C)OCC=O)N 34a_200011216674_200009817547 [0,2,0,0,0,0|2,0,0]=4 6507 B13R1.3518 Cc1c(ccc(c1C)OCC=O)N 7a_200011216674_200015260668 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.3518 Cc1c(ccc(c1C)SCC=O)Br 62a_200010185626_200015260668 [0,2,0,0,0,0|2,0,0]=4 6509 B13R1.3518 Cc1c(ccc(c1C)SCC=O)Br 62a_200015260668_200010185626 [0,2,0,0,0,0|2,0,0]=4 6510 B13R1.3518 Cc1c(ccc(c1C)SCC=O)F 62a_100009816033_200015260668 [0,2,0,0,0,0|2,0,0]=4 6511 B13R1.3518 Cc1c(ccc(c1C)SCC=O)F 62a_200015260668_100009816033 [0,2,0,0,0,0|2,0,0]=4 6512 B13R1.3518 Cc1c(ccc(c1C)SCC=O)N 62a_100009816967_200015260668 [0,2,0,0,0,0|2,0,0]=4 6513 B13R1.3518 Cc1c(ccc(c1C)SCC=O)N 62a_200015260668_100009816967 [0,2,0,0,0,0|2,0,0]=4 6514 B13R1.3518 Cc1c(ccc(c1C)SCC=O)O 62a_100012353674_200015260668 [0,2,0,0,0,0|2,0,0]=4 6515 B13R1.3518 Cc1c(ccc(c1C)SCC=O)O 62a_200015260668_100012353674 [0,2,0,0,0,0|2,0,0]=4 6516 B13R1.3518 Cc1c(ccc(c1Cl)NCC=O)Cl 34a_100011935240_200009817547 [0,2,0,0,0,0|2,0,0]=4 6517 B13R1.3518 Cc1c(ccc(c1Cl)NCC=O)Cl 7a_100011935240_200015260668 [0,2,0,0,0,0|2,0,0]=4 6518 B13R1.3518 Cc1c(ccc(c1Cl)NCC=O)F 2230a_100009863382_200015260668 [0,2,0,0,0,0|2,0,0]=4 6519 B13R1.3518 Cc1c(ccc(c1Cl)NCC=O)F 34a_100009863382_200009817547 [0,2,0,0,0,0|2,0,0]=4 6520 B13R1.3518 Cc1c(ccc(c1Cl)NCC=O)F 7a_100009863382_200015260668 [0,2,0,0,0,0|2,0,0]=4 6521 B13R1.3518 Cc1c(ccc(c1Cl)OCC=O)Br 34a_100021574527_200009817547 [0,2,0,0,0,0|2,0,0]=4 6522 B13R1.3518 Cc1c(ccc(c1Cl)OCC=O)Br 7a_100021574527_200015260668 [0,2,0,0,0,0|2,0,0]=4 6523 B13R1.3518 Cc1c(ccc(c1Cl)SCC=O)Br 62a_100055076181_200015260668 [0,2,0,0,0,0|2,0,0]=4 6524 B13R1.3518 Cc1c(ccc(c1Cl)SCC=O)Br 62a_200015260668_100055076181 [0,2,0,0,0,0|2,0,0]=4 6525 B13R1.3518 Cc1c(ccc(c1Cl)SCC=O)Cl 62a_100010730154_200015260668 [0,2,0,0,0,0|2,0,0]=4 6526 B13R1.3518 Cc1c(ccc(c1Cl)SCC=O)Cl 62a_200015260668_100010730154 [0,2,0,0,0,0|2,0,0]=4 6527 B13R1.3518 Cc1c(ccc(c1F)NCC=O)Br 2230a_100000722916_200015260668 [0,2,0,0,0,0|2,0,0]=4 6528 B13R1.3518 Cc1c(ccc(c1F)NCC=O)Br 34a_100000722916_200009817547 [0,2,0,0,0,0|2,0,0]=4 6529 B13R1.3518 Cc1c(ccc(c1F)NCC=O)Br 7a_100000722916_200015260668 [0,2,0,0,0,0|2,0,0]=4 6530 B13R1.3518 Cc1c(ccc(c1F)NCC=O)F 2230a_102495366501_200015260668 [0,2,0,0,0,0|2,0,0]=4 6531 B13R1.3518 Cc1c(ccc(c1F)NCC=O)F 34a_102495366501_200009817547 [0,2,0,0,0,0|2,0,0]=4 6532 B13R1.3518 Cc1c(ccc(c1F)NCC=O)F 7a_102495366501_200015260668 [0,2,0,0,0,0|2,0,0]=4 6533 B13R1.3518 Cc1c(ccc(c1F)NCC=O)O 34a_200000126710_200009817547 [0,2,0,0,0,0|2,0,0]=4 6534 B13R1.3518 Cc1c(ccc(c1F)NCC=O)O 7a_200000126710_200015260668 [0,2,0,0,0,0|2,0,0]=4 6535 B13R1.3518 Cc1c(ccc(c1F)SCC=O)F 62a_100009815987_200015260668 [0,2,0,0,0,0|2,0,0]=4 6536 B13R1.3518 Cc1c(ccc(c1F)SCC=O)F 62a_200015260668_100009815987 [0,2,0,0,0,0|2,0,0]=4 6537 B13R1.3518 Cc1c(ccc(c1F)SCC=O)N 62a_100010208198_200015260668 [0,2,0,0,0,0|2,0,0]=4 6538 B13R1.3518 Cc1c(ccc(c1F)SCC=O)N 62a_200015260668_100010208198 [0,2,0,0,0,0|2,0,0]=4 6539 B13R1.3518 Cc1c(ccc(c1F)SCC=O)O 62a_100010390934_200015260668 [0,2,0,0,0,0|2,0,0]=4 6540 B13R1.3518 Cc1c(ccc(c1F)SCC=O)O 62a_200015260668_100010390934 [0,2,0,0,0,0|2,0,0]=4 6541 B13R1.3518 Cc1c(ccc(c1N)OCC=O)Br 34a_100013039247_200009817547 [0,2,0,0,0,0|2,0,0]=4 6542 B13R1.3518 Cc1c(ccc(c1N)OCC=O)Br 7a_100013039247_200015260668 [0,2,0,0,0,0|2,0,0]=4 6543 B13R1.3518 Cc1c(ccc(c1N)SCC=O)F 62a_100011009917_200015260668 [0,2,0,0,0,0|2,0,0]=4 6544 B13R1.3518 Cc1c(ccc(c1N)SCC=O)F 62a_200015260668_100011009917 [0,2,0,0,0,0|2,0,0]=4 6545 B13R1.3518 Cc1c(ccc(c1O)SCC#N)F 62a_100011215382_200010391124 [0,2,0,0,0,0|1,0,1]=4 6546 B13R1.3518 Cc1c(ccc(c1O)SCC#N)F 62a_200010391124_100011215382 [0,2,0,0,0,0|1,0,1]=4 6547 B13R1.3518 Cc1c(ccc(c1O)SCC=O)F 62a_200010391124_200015260668 [0,2,0,0,0,0|1,0,0]=3 6548 B13R1.3518 Cc1c(ccc(c1O)SCC=O)F 62a_200015260668_200010391124 [0,2,0,0,0,0|1,0,0]=3 6549 B13R1.3518 Cc1c(ccc(c1O)SCCF)F 62a_100011217306_200010391124 [0,2,0,0,0,0|1,0,1]=4 6550 B13R1.3518 Cc1c(ccc(c1O)SCCF)F 62a_200010391124_100011217306 [0,2,0,0,0,0|1,0,1]=4 6551 B13R1.3518 Cc1c(ccc(c1O)SCCO)F 62a_100000211926_200010391124 [0,2,0,0,0,0|1,0,1]=4 6552 B13R1.3518 Cc1c(ccc(c1O)SCCO)F 62a_200010391124_100000211926 [0,2,0,0,0,0|1,0,1]=4 6553 B13R1.3518 Cc1ccc(c(c1C)C)NCC=O 2230a_100000116900_200015260668 [0,2,0,0,0,0|2,0,0]=4 6554 B13R1.3518 Cc1ccc(c(c1C)C)NCC=O 34a_100000116900_200009817547 [0,2,0,0,0,0|2,0,0]=4 6555 B13R1.3518 Cc1ccc(c(c1C)C)NCC=O 7a_100000116900_200015260668 [0,2,0,0,0,0|2,0,0]=4 6556 B13R1.3518 Cc1ccc(c(c1C)F)SCC=O 62a_200015260668_200015555822 [0,2,0,0,0,0|2,0,0]=4 6557 B13R1.3518 Cc1ccc(c(c1C)F)SCC=O 62a_200015555822_200015260668 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.3518 Cc1ccc(c(c1F)O)SCC=O 62a_100000722096_200015260668 [0,2,0,0,0,0|2,0,0]=4 6559 B13R1.3518 Cc1ccc(c(c1F)O)SCC=O 62a_200015260668_100000722096 [0,2,0,0,0,0|2,0,0]=4 6560 B13R1.3518 O=CCNc1ccc(c(c1O)Br)F 34a_100010128263_200009817547 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.3518 O=CCNc1ccc(c(c1O)F)F 34a_100015205010_200009817547 [0,2,0,0,0,0|2,0,0]=4 6562 B13R1.3518 O=CCSc1ccc(c(c1O)F)F 62a_100010243909_200015260668 [0,2,0,0,0,0|2,0,0]=4 6563 B13R1.3518 O=CCSc1ccc(c(c1O)F)F 62a_200015260668_100010243909 [0,2,0,0,0,0|2,0,0]=4 6564 B13R1.2816 CC(=Cc1cc(cc(c1O)C)C)C 271570a_100102525489_100011934984 [0,2,0,0,0,0|0,0,2]=4 6565 B13R1.2816 CC(=Cc1cc(cc(c1O)C)Cl)C 271570a_100102525489_100012343667 [0,2,0,0,0,0|0,0,2]=4 6566 B13R1.2816 CC(=Cc1cc(cc(c1O)C)N)C 271570a_100102525489_100010064301 [0,2,0,0,0,0|0,0,2]=4 6567 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Br)Br 1458a_100000070787_200009814416 [0,2,0,0,0,0|1,0,1]=4 6568 B13R1.2816 CC(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200000210301 [0,2,0,0,0,0|1,0,1]=4 6569 B13R1.2816 CC(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200000210301 [0,2,0,0,0,0|1,0,1]=4 6570 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 11a_100011825904_100015343762 [0,2,0,0,0,0|1,0,1]=4 6571 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 22a_100011825904_100000070787 [0,2,0,0,0,0|1,0,1]=4 6572 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)Br 527a_100011825904_100103153847 [0,2,0,0,0,0|1,0,1]=4 6573 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 11a_100011216242_100015343762 [0,2,0,0,0,0|1,0,1]=4 6574 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 22a_100011216242_100000070787 [0,2,0,0,0,0|1,0,1]=4 6575 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)C 527a_100011216242_100103153847 [0,2,0,0,0,0|1,0,1]=4 6576 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 11a_100000130126_100015343762 [0,2,0,0,0,0|1,0,1]=4 6577 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 22a_100000130126_100000070787 [0,2,0,0,0,0|1,0,1]=4 6578 B13R1.2816 CC(=O)Nc1cc(cc(c1O)C)F 527a_100000130126_100103153847 [0,2,0,0,0,0|1,0,1]=4 6579 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)Cl)Cl 1458a_100010323609_200025704644 [0,2,0,0,0,0|1,0,1]=4 6580 B13R1.2816 [13CH3]C(=O)Cc1cc(cc(c1O)F)F 1458a_200015623426_200025704644 [0,2,0,0,0,0|1,0,1]=4 6581 B13R1.3980 C=C=Cc1cc(cc(c1OC)C)N 271570a_100015277604_100010071304 [0,2,0,0,0,0|0,0,2]=4 6582 B13R1.3980 CC=Cc1cc(cc(c1OC)C)N 271570a_100016259895_100010071304 [0,2,0,0,0,0|0,0,2]=4 6583 B13R1.3980 CNCc1cc(cc(c1OC)C)C 207a_100102657272_100000050482 [0,2,0,0,0,0|1,0,1]=4 6584 B13R1.3980 CNCc1cc(cc(c1OC)C)C 270004a_106832991635_100000050482 [0,2,0,0,0,0|1,0,1]=4 6585 B13R1.3982 C=C=Cc1cc(cc(c1O)OC)F 271570a_100015277604_200010391102 [0,2,0,0,0,0|0,0,2]=4 6586 B13R1.3982 CC=Cc1cc(cc(c1O)OC)F 271570a_100016259895_200010391102 [0,2,0,0,0,0|0,0,2]=4 6587 B13R1.115 C=Cc1c(cccc1CC(=O)N)C 271570a_100011290941_100011096275 [0,2,0,0,0,0|2,0,0]=4 6588 B13R1.115 COc1c(cccc1C=C(C)C)C 271570a_100102525489_100010141385 [0,2,0,0,0,0|0,0,2]=4 6589 B13R1.115 COc1c(cccc1CC(=O)C)Br 1458a_100000070787_100011470457 [0,2,0,0,0,0|1,0,1]=4 6590 B13R1.115 COc1c(cccc1CC(=O)C)C 1458a_100000070787_100012349798 [0,2,0,0,0,0|0,0,1]=3 6591 B13R1.115 COc1c(cccc1CC(=O)C)F 1458a_100000061543_200000210301 [0,2,0,0,0,0|1,0,1]=4 6592 B13R1.115 COc1c(cccc1CC(=O)[13CH3])F 1458a_100000061543_200025704644 [0,2,0,0,0,0|1,0,1]=4 6593 B13R1.115 COc1c(cccc1CN(C)C)C 2230a_100102631434_100012349798 [0,2,0,0,0,0|1,0,1]=4 6594 B13R1.115 COc1c(cccc1CN(C)C)C 269982a_100102631434_100012349798 [0,2,0,0,0,0|1,0,1]=4 6595 B13R1.115 COc1c(cccc1CN(C)C)C 270004a_100102631434_100011361485 [0,2,0,0,0,0|1,0,1]=4 6596 B13R1.115 COc1c(cccc1NC(=O)C)C 11a_100012017360_100015343762 [0,2,0,0,0,0|1,0,1]=4 6597 B13R1.115 COc1c(cccc1NC(=O)C)C 1626a_100012017360_100015343762 [0,2,0,0,0,0|1,0,1]=4 6598 B13R1.115 COc1c(cccc1NC(=O)C)C 22a_100012017360_100000070787 [0,2,0,0,0,0|1,0,1]=4 6599 B13R1.115 COc1c(cccc1NC(=O)C)C 527a_100012017360_100103153847 [0,2,0,0,0,0|1,0,1]=4 6600 B13R1.115 CSc1c(cccc1CC(=O)N)C 62a_100011096275_200000210301 [0,2,0,0,0,0|1,1,0]=4 6601 B13R1.115 CSc1c(cccc1CC(=O)N)C 62a_200000210301_100011096275 [0,2,0,0,0,0|1,1,0]=4 6602 B13R1.115 Cc1cccc(c1S[13CH3])CC(=O)N 62a_100011096275_200025704644 [0,2,0,0,0,0|1,1,0]=4 6603 B13R1.115 Cc1cccc(c1S[13CH3])CC(=O)N 62a_200025704644_100011096275 [0,2,0,0,0,0|1,1,0]=4 6604 B13R1.641 CCc1cccc(c1O)C=C(C)C 271570a_100102525489_200010001580 [0,2,0,0,0,0|0,0,2]=4 6605 B13R1.641 COc1cccc(c1C)CC(=O)C 1458a_100000070787_100009876938 [0,2,0,0,0,0|1,0,1]=4 6606 B13R1.641 COc1cccc(c1Cl)CC(=O)C 1458a_100000070787_200010147866 [0,2,0,0,0,0|1,0,1]=4 6607 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000070787_100011260763 [0,2,0,0,0,0|1,0,1]=4 6608 B13R1.641 COc1cccc(c1F)CC(=O)C 1458a_100000698549_200000210301 [0,2,0,0,0,0|1,0,1]=4 6609 B13R1.641 COc1cccc(c1F)CC(=O)[13CH3] 1458a_100000698549_200025704644 [0,2,0,0,0,0|1,0,1]=4 6610 B13R1.641 COc1cccc(c1O)C=C(C)C 271570a_100102525489_100000686866 [0,2,0,0,0,0|0,0,2]=4 6611 B13R1.641 COc1cccc(c1O)NC(=O)C 22a_100000123586_100000070787 [0,2,0,0,0,0|1,0,1]=4 6612 B13R1.641 COc1cccc(c1O)NC(=O)C 527a_100000123586_100103153847 [0,2,0,0,0,0|1,0,1]=4 6613 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)Cl 1458a_100000070787_200010220899 [0,2,0,0,0,0|1,0,1]=4 6614 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000038137_200000210301 [0,2,0,0,0,0|1,0,1]=4 6615 B13R1.885 CC(=O)Cc1c(ccc(c1Cl)C)F 1458a_100000070787_100009813558 [0,2,0,0,0,0|1,0,1]=4 6616 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000035286_200000210301 [0,2,0,0,0,0|1,0,1]=4 6617 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)Cl 1458a_100000070787_100009813557 [0,2,0,0,0,0|1,0,1]=4 6618 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100000070787_100011217880 [0,2,0,0,0,0|1,0,1]=4 6619 B13R1.885 CC(=O)Cc1c(ccc(c1F)C)F 1458a_100011218906_200000210301 [0,2,0,0,0,0|1,0,1]=4 6620 B13R1.885 Cc1ccc(c(c1Cl)CC(=O)[13CH3])F 1458a_100000038137_200025704644 [0,2,0,0,0,0|1,0,1]=4 6621 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])Cl 1458a_100000035286_200025704644 [0,2,0,0,0,0|1,0,1]=4 6622 B13R1.885 Cc1ccc(c(c1F)CC(=O)[13CH3])F 1458a_100011218906_200025704644 [0,2,0,0,0,0|1,0,1]=4 6623 B13R1.3528 CC(=Cc1ccc(c(c1O)C)F)C 271570a_100102525489_200010391124 [0,2,0,0,0,0|0,0,2]=4 6624 B13R1.377 C=C=Cc1cccc(c1O)C(=O)C 271570a_100015277604_100009815558 [0,2,0,0,0,0|0,0,2]=4 6625 B13R1.377 CC=Cc1cccc(c1O)C(=O)C 271570a_100016259895_100009815558 [0,2,0,0,0,0|0,0,2]=4 6626 B13R1.3911 C=C=Cc1cccc(c1OC)CO 271570a_100015277604_100000704359 [0,2,0,0,0,0|0,0,2]=4 6627 B13R1.3911 C=C=Cc1cccc(c1OC)OC 271570a_100015277604_100009815961 [0,2,0,0,0,0|0,0,2]=4 6628 B13R1.3911 CC=Cc1cccc(c1OC)CO 271570a_100016259895_100000704359 [0,2,0,0,0,0|0,0,2]=4 6629 B13R1.3911 CC=Cc1cccc(c1OC)OC 271570a_100016259895_100009815961 [0,2,0,0,0,0|0,0,2]=4 6630 B13R1.3911 CNCc1cccc(c1OC)OC 207a_100102657272_100000210086 [0,2,0,0,0,0|1,0,1]=4 6631 B13R1.3911 CNCc1cccc(c1OC)OC 2230a_106832991635_100011217692 [0,2,0,0,0,0|1,0,1]=4 6632 B13R1.3911 CNCc1cccc(c1OC)OC 270004a_106832991635_100000210086 [0,2,0,0,0,0|1,0,1]=4 6633 B13R1.3911 CNCc1cccc(c1OC)OC 34a_100000737870_200000210301 [0,2,0,0,0,0|1,0,1]=4 6634 B13R1.3911 CNCc1cccc(c1OC)OC 34a_100102657272_100011217692 [0,2,0,0,0,0|1,0,1]=4 6635 B13R1.3911 CNCc1cccc(c1OC)OC 7a_106832991635_100011217692 [0,2,0,0,0,0|1,0,1]=4 6636 B13R1.3911 COCc1cccc(c1OC)OC 34a_100000211494_200000210301 [0,2,0,0,0,0|1,0,1]=4 6637 B13R1.3911 COCc1cccc(c1OC)OC 34a_100138415774_100011217692 [0,2,0,0,0,0|1,0,1]=4 6638 B13R1.3911 COc1c(cccc1SC)CC#N 62a_100010146820_200000210301 [0,2,0,0,0,0|1,0,1]=4 6639 B13R1.3911 COc1c(cccc1SC)CC#N 62a_200000210301_100010146820 [0,2,0,0,0,0|1,0,1]=4 6640 B13R1.3911 COc1c(cccc1S[13CH3])CC#N 62a_100010146820_200025704644 [0,2,0,0,0,0|1,0,1]=4 6641 B13R1.3911 COc1c(cccc1S[13CH3])CC#N 62a_200025704644_100010146820 [0,2,0,0,0,0|1,0,1]=4 6642 B13R1.3911 COc1cccc(c1OC)CN[13CH3] 34a_100000737870_200025704644 [0,2,0,0,0,0|1,0,1]=4 6643 B13R1.3911 COc1cccc(c1OC)CO[13CH3] 34a_100000211494_200025704644 [0,2,0,0,0,0|1,0,1]=4 6644 B13R1.3911 COc1cccc(c1OC)CSC 62a_100011217692_200000210301 [0,2,0,0,0,0|1,0,1]=4 6645 B13R1.3911 COc1cccc(c1OC)CSC 62a_200000210301_100011217692 [0,2,0,0,0,0|1,0,1]=4 6646 B13R1.3911 COc1cccc(c1OC)CS[13CH3] 62a_100011217692_200025704644 [0,2,0,0,0,0|1,0,1]=4 6647 B13R1.3911 COc1cccc(c1OC)CS[13CH3] 62a_200025704644_100011217692 [0,2,0,0,0,0|1,0,1]=4 6648 B13R1.3910 C=CCc1cccc(c1CNC)C 26a_100102657272_200011218211 [0,2,0,0,0,0|1,0,0]=3 6649 B13R1.3910 C=CCc1cccc(c1OCC)C 34a_200011218211_100000210202 [0,2,0,0,0,0|0,0,0]=2 6650 B13R1.3910 C=CCc1cccc(c1OCC)C 7a_200011218211_100000210202 [0,2,0,0,0,0|0,0,0]=2 6651 B13R1.3910 C=CCc1cccc(c1OCF)C 34a_200011218211_100015361967 [0,2,0,0,0,0|0,0,0]=2 6652 B13R1.3910 C=CCc1cccc(c1OCF)C 7a_200011218211_100015361967 [0,2,0,0,0,0|0,0,0]=2 6653 B11R1.277 C=Cc1cc(c(cc1F)C)O 271570a_100011290941_100014242602 [0,0,1,1,0,0|1,0,1]=4 6654 B11R1.83 C=CCc1ccc(cc1)OC 34a_100000078792_200000210301 [0,0,1,1,0,0|2,0,0]=4 6655 B11R1.83 C=CCc1ccc(cc1)OC 7a_100000078792_200000210301 [0,0,1,1,0,0|2,0,0]=4 6656 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 34a_100000078792_200025704644 [0,0,1,1,0,0|2,0,0]=4 6657 B11R1.83 C=CCc1ccc(cc1)O[13CH3] 7a_100000078792_200025704644 [0,0,1,1,0,0|2,0,0]=4 6658 B11R1.127 C=CCc1noc(n1)C=CC 270196a_100000746013_100000210699 [0,0,1,1,0,0|2,0,0]=4 6659 B11R1.1 C=CCNc1ccc(cc1)C 34a_100000124888_100015514636 [0,0,1,1,0,0|2,0,0]=4 6660 B11R1.1 C=CCOc1ccc(cc1)C 34a_100000210336_100015514636 [0,0,1,1,0,0|2,0,0]=4 6661 B11R1.1 C=CCOc1ccc(cc1)C 7a_100000210336_100015514636 [0,0,1,1,0,0|2,0,0]=4 6662 B11R1.1 C=CCOc1ccc(cn1)C 34a_100000759353_100015514636 [0,0,1,1,0,0|2,0,0]=4 6663 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000186775_100000210623 [0,0,1,1,0,0|2,0,0]=4 6664 B11R1.1 C=CCSc1ccc(cc1)C 62a_100000210623_100000186775 [0,0,1,1,0,0|2,0,0]=4 6665 B11R1.1 C=CCSc1ccc(cn1)C 62a_100000210623_100000754016 [0,0,1,1,0,0|2,0,0]=4 6666 B11R1.1 C=CCSc1ccc(cn1)C 62a_100011192072_100000210623 [0,0,1,1,0,0|2,0,0]=4 6667 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,0,0,1,0,0|2,0,0]=4 6668 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [1,0,0,1,0,0|1,0,1]=4 6669 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,0,0,1,0,0|2,0,0]=4 6670 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,0,0,1,0,0|1,0,0]=3 6671 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,0,0,1,0,0|2,0,0]=4 6672 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,0,0,1,0,0|2,0,0]=4 6673 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,0,0,1,0,0|1,1,0]=4 6674 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [1,0,0,1,0,0|2,0,0]=4 6675 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [1,0,0,1,0,0|1,0,1]=4 6676 B11R2.55 Oc1ccccc1C2CC2 271570a_100011220607_100000739446 [1,0,0,1,0,0|0,0,2]=4 6677 B11R2.55 Oc1ccccc1C2CC2 271570a_203496583355_100009819954 [1,0,0,1,0,0|0,0,2]=4 6678 B11R2.35 Cc1cccc(c1)C2CC2 271570a_100011220607_100011215228 [1,0,0,1,0,0|0,0,2]=4 6679 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,0,0,1,0,0|1,0,0]=3 6680 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,0,0,1,0,0|2,0,0]=4 6681 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,0,0,1,0,0|2,0,0]=4 6682 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,0,0,1,0,0|2,0,0]=4 6683 B13R2.9 C=Cc1n[nH]c2c1cccc2C 271570a_100011290941_100010186057 [0,1,0,1,0,0|1,0,1]=4 6684 B13R2.342 Cc1cccc2c1nccc2O 271570a_203496583355_100000751276 [0,1,0,1,0,0|1,0,1]=4 6685 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,1,0,0|1,0,1]=4 6686 B13R2.32 Cc1c(ccc2c1cccn2)O 271570a_203496583355_200010137439 [0,1,0,1,0,0|2,0,0]=4 6687 B13R2.32 Cc1c(ccc2c1nccc2)O 271570a_203496583355_100010214467 [0,1,0,1,0,0|1,0,1]=4 6688 B13R2.32 Cc1c(ccc2c1nccn2)O 271570a_203496583355_100135414757 [0,1,0,1,0,0|2,0,0]=4 6689 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,1,0,0|0,0,1]=3 6690 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [0,1,0,1,0,0|0,0,1]=3 6691 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,1,0,1,0,0|1,0,1]=4 6692 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,1,0,1,0,0|1,0,1]=4 6693 B13R2.32 Nc1ccc2cnccc2c1O 271570a_203496583355_100010245214 [0,1,0,1,0,0|1,0,1]=4 6694 B13R2.32 Nc1ccc2ncccc2c1O 271570a_203496583355_200009995563 [0,1,0,1,0,0|1,0,1]=4 6695 B13R2.32 Nc1ccc2nccnc2c1O 271570a_203496583355_100000729981 [0,1,0,1,0,0|2,0,0]=4 6696 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,1,0,1,0,0|1,0,1]=4 6697 B13R2.32 Oc1c(ccc2c1ccnc2)F 271570a_203496583355_100010272212 [0,1,0,1,0,0|1,0,1]=4 6698 B13R2.32 Oc1c(ccc2c1cncc2)F 271570a_203496583355_200015767032 [0,1,0,1,0,0|1,0,1]=4 6699 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,1,0,0|1,0,1]=4 6700 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,1,0,0|1,0,1]=4 6701 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100009816563 [0,1,0,1,0,0|1,0,1]=4 6702 B13R2.32 Oc1ccc2cccnc2c1O 271570a_203496583355_100010173343 [0,1,0,1,0,0|1,0,1]=4 6703 B13R2.32 Oc1ccc2ccncc2c1O 271570a_203496583355_200010115057 [0,1,0,1,0,0|1,0,1]=4 6704 B13R2.54 C=Cc1nc2c(cccc2s1)C 271570a_100011290941_100010008827 [0,1,0,1,0,0|1,0,1]=4 6705 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,1,0,0|1,0,1]=4 6706 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,1,0,0|1,0,1]=4 6707 B13R2.5180 Cc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010133459 [0,1,0,1,0,0|0,0,1]=3 6708 B13R2.5180 O=C1CCc2c1ccc(c2O)F 271570a_203496583355_200010133454 [0,1,0,1,0,0|1,0,1]=4 6709 B13R2.5325 Cc1cccc(c1O)NC2CC2 34a_100000756359_100000211595 [0,1,0,1,0,0|0,0,2]=4 6710 B13R2.5325 Cc1cccc(c1O)SC2CC2 62a_100009817157_100000211595 [0,1,0,1,0,0|0,0,2]=4 6711 B13R2.328 Cc1cc(cc2c1nccc2)O 271570a_203496583355_100010130319 [0,1,0,1,0,0|1,0,1]=4 6712 B13R2.328 Cc1cc(cc2c1nccn2)O 271570a_203496583355_100010080486 [0,1,0,1,0,0|2,0,0]=4 6713 B13R2.5393 Cc1cc(c2[nH]ccc2c1O)C 271570a_203496583355_100010244417 [0,1,0,1,0,0|1,0,1]=4 6714 B13R2.11035 Cc1cc(c(c(c1)C2CC2)O)C 271570a_100011220607_100011934984 [0,1,0,1,0,0|0,0,2]=4 6715 B13R2.11035 Cc1cc(cc(c1O)C2CC2)Cl 271570a_100011220607_100012343667 [0,1,0,1,0,0|0,0,2]=4 6716 B13R2.11035 Cc1cc(cc(c1O)C2CC2)N 271570a_100011220607_100010064301 [0,1,0,1,0,0|0,0,2]=4 6717 B13R2.3050 Cc1ccc2c(c1O)CC(=O)N2 271570a_203496583355_100015548004 [0,1,0,1,0,0|1,0,0]=3 6718 B13R2.3050 Cc1ccc2sc(nc2c1O)N 271570a_203496583355_100012962237 [0,1,0,1,0,0|2,0,0]=4 6719 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,1,0,0|1,0,1]=4 6720 B13R2.82 CCc1cccc(c1O)C2CC2 271570a_100011220607_200010001580 [0,1,0,1,0,0|0,0,2]=4 6721 B13R2.82 COc1cccc(c1O)C2CC2 271570a_100011220607_100000686866 [0,1,0,1,0,0|0,0,2]=4 6722 B13R2.82 CSc1cccc(c1O)C2CC2 62a_100010664954_200000210301 [0,1,0,1,0,0|0,0,2]=4 6723 B13R2.82 CSc1cccc(c1O)C2CC2 62a_200000210301_100010664954 [0,1,0,1,0,0|0,0,2]=4 6724 B13R2.82 [13CH3]Sc1cccc(c1O)C2CC2 62a_100010664954_200025704644 [0,1,0,1,0,0|0,0,2]=4 6725 B13R2.82 [13CH3]Sc1cccc(c1O)C2CC2 62a_200025704644_100010664954 [0,1,0,1,0,0|0,0,2]=4 6726 B13R2.84 COc1ccc2[nH]ccc2c1O 271570a_203496583355_100010169049 [0,1,0,1,0,0|1,0,1]=4 6727 B13R2.84 COc1ncc2cc[nH]c2c1O 271570a_203496583355_100010168355 [0,1,0,1,0,0|2,0,0]=4 6728 B13R2.84 CSc1ccc2c(c1O)CCC2 62a_100010662108_200000210301 [0,1,0,1,0,0|0,0,2]=4 6729 B13R2.84 CSc1ccc2c(c1O)CCC2 62a_200000210301_100010662108 [0,1,0,1,0,0|0,0,2]=4 6730 B13R2.84 CSc1ccc2cc[nH]c2c1C 62a_200000210301_100009816929 [0,1,0,1,0,0|2,0,0]=4 6731 B13R2.84 Cc1c(ccc2c1[nH]cc2)S[13CH3] 62a_200025704644_100009816929 [0,1,0,1,0,0|2,0,0]=4 6732 B13R2.84 N#Cc1ccc2cc[nH]c2c1O 271570a_203496583355_103550291079 [0,1,0,1,0,0|1,0,1]=4 6733 B13R2.84 [13CH3]Sc1ccc2c(c1O)CCC2 62a_100010662108_200025704644 [0,1,0,1,0,0|0,0,2]=4 6734 B13R2.84 [13CH3]Sc1ccc2c(c1O)CCC2 62a_200025704644_100010662108 [0,1,0,1,0,0|0,0,2]=4 6735 B13R2.292 C=C=Cc1cccc2c1COC2 271570a_100015277604_100010384907 [0,1,0,1,0,0|0,0,2]=4 6736 B13R2.292 C=C=Cc1cccc2c1OCC2 271570a_100015277604_100009818991 [0,1,0,1,0,0|0,0,2]=4 6737 B13R2.292 C=C=Cc1cccc2c1OCO2 271570a_100015277604_100009814252 [0,1,0,1,0,0|0,0,2]=4 6738 B13R2.292 CC=Cc1cccc2c1COC2 271570a_100016259895_100010384907 [0,1,0,1,0,0|0,0,2]=4 6739 B13R2.292 CC=Cc1cccc2c1OCC2 271570a_100016259895_100009818991 [0,1,0,1,0,0|0,0,2]=4 6740 B13R2.292 CC=Cc1cccc2c1OCO2 271570a_100016259895_100009814252 [0,1,0,1,0,0|0,0,2]=4 6741 B13R2.292 CNCc1cccc2c1OCC2 207a_100102657272_100011934426 [0,1,0,1,0,0|1,0,1]=4 6742 B13R2.292 CNCc1cccc2c1OCC2 2230a_200000703977_200000210301 [0,1,0,1,0,0|1,0,1]=4 6743 B13R2.292 CNCc1cccc2c1OCC2 270004a_106832991635_100011934426 [0,1,0,1,0,0|1,0,1]=4 6744 B13R2.292 CNCc1cccc2c1OCC2 34a_200000703977_200000210301 [0,1,0,1,0,0|1,0,1]=4 6745 B13R2.292 CNCc1cccc2c1OCO2 207a_100102657272_100000028116 [0,1,0,1,0,0|1,0,1]=4 6746 B13R2.292 CNCc1cccc2c1OCO2 2230a_100000743722_200000210301 [0,1,0,1,0,0|1,0,1]=4 6747 B13R2.292 CNCc1cccc2c1OCO2 34a_100000743722_200000210301 [0,1,0,1,0,0|1,0,1]=4 6748 B13R2.292 CNCc1cccc2c1OCO2 7a_106832991635_100010369185 [0,1,0,1,0,0|1,0,1]=4 6749 B13R2.292 COCc1cccc2c1OCC2 34a_100011934603_200000210301 [0,1,0,1,0,0|1,0,1]=4 6750 B13R2.292 COCc1cccc2c1OCC2 7a_100011934603_200000210301 [0,1,0,1,0,0|1,0,1]=4 6751 B13R2.292 COCc1cccc2c1OCO2 34a_100011219355_200000210301 [0,1,0,1,0,0|1,0,1]=4 6752 B13R2.292 CSCc1cccc2c1OCO2 62a_100010369185_200000210301 [0,1,0,1,0,0|1,0,1]=4 6753 B13R2.292 [13CH3]NCc1cccc2c1OCC2 2230a_200000703977_200025704644 [0,1,0,1,0,0|1,0,1]=4 6754 B13R2.292 [13CH3]NCc1cccc2c1OCC2 34a_200000703977_200025704644 [0,1,0,1,0,0|1,0,1]=4 6755 B13R2.292 [13CH3]NCc1cccc2c1OCO2 2230a_100000743722_200025704644 [0,1,0,1,0,0|1,0,1]=4 6756 B13R2.292 [13CH3]NCc1cccc2c1OCO2 34a_100000743722_200025704644 [0,1,0,1,0,0|1,0,1]=4 6757 B13R2.292 [13CH3]OCc1cccc2c1OCC2 34a_100011934603_200025704644 [0,1,0,1,0,0|1,0,1]=4 6758 B13R2.292 [13CH3]OCc1cccc2c1OCC2 7a_100011934603_200025704644 [0,1,0,1,0,0|1,0,1]=4 6759 B13R2.292 [13CH3]OCc1cccc2c1OCO2 34a_100011219355_200025704644 [0,1,0,1,0,0|1,0,1]=4 6760 B13R2.292 [13CH3]SCc1cccc2c1OCO2 62a_100010369185_200025704644 [0,1,0,1,0,0|1,0,1]=4 6761 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 2230a_100000124160_200025704644 [0,1,0,1,0,0|0,0,2]=4 6762 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 34a_100000124160_200025704644 [0,1,0,1,0,0|0,0,2]=4 6763 B13R2.581 CNc1cccc2c1OC(C2)C 2230a_100000124160_200000210301 [0,1,0,1,0,0|0,0,2]=4 6764 B13R2.581 CNc1cccc2c1OC(C2)C 34a_100000124160_200000210301 [0,1,0,1,0,0|0,0,2]=4 6765 B13R2.581 CNc1cccc2c1oc(c2)C 34a_200015185323_200000210301 [0,1,0,1,0,0|0,0,2]=4 6766 B13R2.581 CSc1cccc2c1CC(=O)C2 62a_100010205903_200000210301 [0,1,0,1,0,0|2,0,0]=4 6767 B13R2.581 CSc1cccc2c1NC(=O)C2 62a_200000210301_100000767046 [0,1,0,1,0,0|2,0,0]=4 6768 B13R2.581 CSc1cccc2c1oc(n2)C 62a_200000210301_100010168998 [0,1,0,1,0,0|1,0,1]=4 6769 B13R2.581 Cc1cc2cccc(c2o1)N[13CH3] 34a_200015185323_200025704644 [0,1,0,1,0,0|0,0,2]=4 6770 B13R2.581 Cc1nc2cccc(c2o1)S[13CH3] 62a_200025704644_100010168998 [0,1,0,1,0,0|1,0,1]=4 6771 B13R2.581 [13CH3]Sc1cccc2c1CC(=O)C2 62a_100010205903_200025704644 [0,1,0,1,0,0|2,0,0]=4 6772 B13R2.581 [13CH3]Sc1cccc2c1NC(=O)C2 62a_200025704644_100000767046 [0,1,0,1,0,0|2,0,0]=4 6773 B13R2.1613 CNc1cccc2c1cccc2 34a_100000185869_200000210301 [0,1,0,1,0,0|1,0,1]=4 6774 B13R2.1613 CNc1cccc2c1cccn2 27a_100102657272_100011290932 [0,1,0,1,0,0|2,0,0]=4 6775 B13R2.1613 CNc1cccc2c1cccn2 34a_100000183906_200000210301 [0,1,0,1,0,0|2,0,0]=4 6776 B13R2.1613 CNc1cccc2c1nccc2 34a_100000181377_200000210301 [0,1,0,1,0,0|1,0,1]=4 6777 B13R2.1613 CNc1cccc2c1nccn2 27a_100102657272_100010003881 [0,1,0,1,0,0|2,0,0]=4 6778 B13R2.1613 COc1cccc2c1CC=CC2 34a_100000074931_200000210301 [0,1,0,1,0,0|1,0,0]=3 6779 B13R2.1613 COc1cccc2c1CC=CC2 7a_100000074931_200000210301 [0,1,0,1,0,0|1,0,0]=3 6780 B13R2.1613 COc1cccc2c1cccc2 34a_100000210388_200000210301 [0,1,0,1,0,0|1,0,1]=4 6781 B13R2.1613 COc1cccc2c1cccc2 7a_100000210388_200000210301 [0,1,0,1,0,0|1,0,1]=4 6782 B13R2.1613 COc1cccc2c1cccn2 34a_100011197808_200000210301 [0,1,0,1,0,0|2,0,0]=4 6783 B13R2.1613 COc1cccc2c1nccc2 34a_100000056035_200000210301 [0,1,0,1,0,0|1,0,1]=4 6784 B13R2.1613 COc1cccc2c1nccn2 34a_100000077048_200000210301 [0,1,0,1,0,0|2,0,0]=4 6785 B13R2.1613 CSc1cccc2c1OCCC2 62a_100010204675_200000210301 [0,1,0,1,0,0|0,0,2]=4 6786 B13R2.1613 CSc1cccc2c1OCCC2 62a_200000210301_100010204675 [0,1,0,1,0,0|0,0,2]=4 6787 B13R2.1613 CSc1cccc2c1cccc2 62a_200000210301_100000210605 [0,1,0,1,0,0|1,0,1]=4 6788 B13R2.1613 CSc1cccc2c1cccn2 62a_100011290932_200000210301 [0,1,0,1,0,0|2,0,0]=4 6789 B13R2.1613 CSc1cccc2c1cccn2 62a_200000210301_100011290932 [0,1,0,1,0,0|2,0,0]=4 6790 B13R2.1613 CSc1cccc2c1nccc2 62a_200000210301_100011215545 [0,1,0,1,0,0|1,0,1]=4 6791 B13R2.1613 CSc1cccc2c1nccn2 62a_100010003881_200000210301 [0,1,0,1,0,0|2,0,0]=4 6792 B13R2.1613 CSc1cccc2c1nccn2 62a_200000210301_100010003881 [0,1,0,1,0,0|2,0,0]=4 6793 B13R2.1613 [13CH3]Nc1cccc2c1cccc2 34a_100000185869_200025704644 [0,1,0,1,0,0|1,0,1]=4 6794 B13R2.1613 [13CH3]Nc1cccc2c1cccn2 34a_100000183906_200025704644 [0,1,0,1,0,0|2,0,0]=4 6795 B13R2.1613 [13CH3]Nc1cccc2c1nccc2 34a_100000181377_200025704644 [0,1,0,1,0,0|1,0,1]=4 6796 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 34a_100000074931_200025704644 [0,1,0,1,0,0|1,0,0]=3 6797 B13R2.1613 [13CH3]Oc1cccc2c1CC=CC2 7a_100000074931_200025704644 [0,1,0,1,0,0|1,0,0]=3 6798 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 34a_100000210388_200025704644 [0,1,0,1,0,0|1,0,1]=4 6799 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 7a_100000210388_200025704644 [0,1,0,1,0,0|1,0,1]=4 6800 B13R2.1613 [13CH3]Oc1cccc2c1cccn2 34a_100011197808_200025704644 [0,1,0,1,0,0|2,0,0]=4 6801 B13R2.1613 [13CH3]Oc1cccc2c1nccc2 34a_100000056035_200025704644 [0,1,0,1,0,0|1,0,1]=4 6802 B13R2.1613 [13CH3]Oc1cccc2c1nccn2 34a_100000077048_200025704644 [0,1,0,1,0,0|2,0,0]=4 6803 B13R2.1613 [13CH3]Sc1cccc2c1OCCC2 62a_100010204675_200025704644 [0,1,0,1,0,0|0,0,2]=4 6804 B13R2.1613 [13CH3]Sc1cccc2c1OCCC2 62a_200025704644_100010204675 [0,1,0,1,0,0|0,0,2]=4 6805 B13R2.1613 [13CH3]Sc1cccc2c1cccc2 62a_200025704644_100000210605 [0,1,0,1,0,0|1,0,1]=4 6806 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_100011290932_200025704644 [0,1,0,1,0,0|2,0,0]=4 6807 B13R2.1613 [13CH3]Sc1cccc2c1cccn2 62a_200025704644_100011290932 [0,1,0,1,0,0|2,0,0]=4 6808 B13R2.1613 [13CH3]Sc1cccc2c1nccc2 62a_200025704644_100011215545 [0,1,0,1,0,0|1,0,1]=4 6809 B13R2.1613 [13CH3]Sc1cccc2c1nccn2 62a_100010003881_200025704644 [0,1,0,1,0,0|2,0,0]=4 6810 B13R2.1613 [13CH3]Sc1cccc2c1nccn2 62a_200025704644_100010003881 [0,1,0,1,0,0|2,0,0]=4 6811 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [0,1,0,1,0,0|1,0,1]=4 6812 B13R2.371 Cc1ccc(c2c1nccc2)O 271570a_203496583355_100000694312 [0,1,0,1,0,0|1,0,1]=4 6813 B13R2.121 C=Cc1c(ccc2c1[nH]cc2)C 271570a_100011290941_100010717004 [0,1,0,1,0,0|2,0,0]=4 6814 B13R2.121 CSc1c(ccc2c1[nH]cc2)C 62a_200000210301_100010717004 [0,1,0,1,0,0|1,1,0]=4 6815 B13R2.121 Cc1ccc2cc[nH]c2c1S[13CH3] 62a_200025704644_100010717004 [0,1,0,1,0,0|1,1,0]=4 6816 B13R2.2615 COc1c(cccc1C2CC2)C 271570a_100011220607_100010141385 [0,1,0,1,0,0|0,0,2]=4 6817 B13R2.4818 Cc1cccc2c1c(ccc2)O 271570a_203496583355_100009995290 [0,1,0,1,0,0|0,0,1]=3 6818 B13R2.4818 Cc1cncc2c1c(ccc2)O 271570a_203496583355_100009817140 [0,1,0,1,0,0|1,0,1]=4 6819 B13R2.4818 Nc1cccc2c1c(ccc2)O 271570a_203496583355_100010002837 [0,1,0,1,0,0|1,0,1]=4 6820 B13R2.4818 Nc1cccc2c1c(ccn2)O 271570a_203496583355_100010263589 [0,1,0,1,0,0|2,0,0]=4 6821 B13R2.4818 Oc1cccc2c1c(ccc2)Br 271570a_203496583355_100010243825 [0,1,0,1,0,0|1,0,1]=4 6822 B13R2.4818 Oc1cccc2c1c(ccc2)F 271570a_203496583355_100010177852 [0,1,0,1,0,0|1,0,1]=4 6823 B13R2.4818 Oc1cccc2c1c(ccc2)O 271570a_203496583355_100010089961 [0,1,0,1,0,0|1,0,1]=4 6824 B13R2.4818 Oc1cccc2c1c(ccn2)O 271570a_203496583355_100010187735 [0,1,0,1,0,0|2,0,0]=4 6825 B13R2.5398 Cc1c(ccc(c1O)C2CC2)F 271570a_100011220607_200010391124 [0,1,0,1,0,0|0,0,2]=4 6826 B9R1.132 C=Cc1csc(c1C)C 271570a_100011290941_100009820295 [1,0,0,0,1,0|2,0,0]=4