0 B9R1.33 CCNc1c[nH]nc1C 31178d0c85575aeec64e51c7817396ce [0,0,0,0,0,0|4,0,0]=4 1 B9R1.33 CCNc1ccnn1C 7d1c97d7ff5ec58f3b22515f5e983d4e [0,0,0,0,0,0|4,0,0]=4 2 B9R1.33 CCNc1ccsc1C 77679f4a4608797405be9c01b56f6c78 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.33 CCNc1conc1C 3d085436d148ed509a92e856636c7841 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.33 CCNc1csnc1C 7fa107734fecb90d4eb4406d5ed8864b [0,0,0,0,0,0|4,0,0]=4 5 B9R1.33 CCNc1ncnn1C 2629676b79ace6297b0c29e66134bc64 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.33 CCNc1nonc1C 975ff53d51729495264ac7ce489eb43e [0,0,0,0,0,0|4,0,0]=4 7 B9R1.33 CCNc1scnc1C 598ef1fd07e91eb9697ee31a08cdcde7 [0,0,0,0,0,0|2,0,0]=2 8 B9R1.33 CCOc1ccnn1C 0d0572773a82c29e2468f53c6de093db [0,0,0,0,0,0|4,0,0]=4 9 B9R1.33 Cc1c[nH]nc1NCO 64a2361a26c71fcd9a5ccaa6f4127492 [0,0,0,0,0,0|4,0,0]=4 10 B9R1.33 Cc1cnoc1NCO 6fa061c951cf0ae5d1ed5a80ccd9a4d7 [0,0,0,0,0,0|3,1,0]=4 11 B9R1.33 Cc1conc1NCO f11a6e78d0dc79c7fd8e6aa2bc156622 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.33 Cc1cscc1NCO a1fce12bf5331bb4cc5329208ddadffa [0,0,0,0,0,0|4,0,0]=4 13 B9R1.33 Cc1n[nH]cc1NCF 470923ea002ffd0578778b7f7074fc0f [0,0,0,0,0,0|4,0,0]=4 14 B9R1.33 Cc1n[nH]cc1NCO a18fd5a569e348df112b87487921fe14 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.33 Cc1ncsc1NC=O 9ce065a598efb44ea1079e1d362e476d [0,0,0,0,0,0|1,0,2]=3 16 B9R1.33 Cc1ncsc1NCF 35a68244a2fba9354c705268dcd80977 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.33 Cc1ncsc1NCO df3e797faa7c3c37b6894aa2e0c6e3c0 [0,0,0,0,0,0|1,0,0]=1 18 B9R1.33 Cc1nocc1NCF 9aa668b20ffbc630c2881c91667b273b [0,0,0,0,0,0|4,0,0]=4 19 B9R1.33 Cc1nocc1NCO e0f96014ec8132ec4a64b0bdeee5ca15 [0,0,0,0,0,0|3,0,0]=3 20 B9R1.33 Cc1nonc1NCF 90578767bca8567a03fdd26338e29bee [0,0,0,0,0,0|4,0,0]=4 21 B9R1.33 Cc1nonc1NCO 0723852fc26661c37f5160b84e0a9e73 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.33 Cc1oncc1NCO 63ce3102ec099c614958f61f7eb57ca2 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.33 Cc1sccc1NCF fa35967e805143f7c72170528ccfdcb8 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.33 Cc1sccc1NCO eaf1014d6ce5279a6c551297535b0b15 [0,0,0,0,0,0|3,0,0]=3 25 B9R1.33 Cn1ccnc1NCO b37932f59f58516d6969ea182cb9ba90 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.33 Cn1nccc1NCF a265347a31bd1324d2c4fa694af5f1a7 [0,0,0,0,0,0|4,0,0]=4 27 B9R1.33 Cn1nccc1NCO 6a2808c985a37903f271f78ca4a1b540 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.33 Cn1nccc1OCF 3289f6d3a845252e58325d77c0068692 [0,0,0,0,0,0|4,0,0]=4 29 B9R1.33 Cn1ncnc1NCF b716a11d1b8710627be6bf6727d1a7e5 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.33 Cn1ncnc1NCO 7bd0851f52140b6bfb085b23588c591b [0,0,0,0,0,0|3,0,0]=3 31 B9R1.33 Cn1nncc1NCO 1728cfc7742ab16792ce5fa6f61e72c0 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.33 Cn1nnnc1NCO 76630823110ecc1cb4a4964135923878 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.33 OCNc1c[nH]nc1Br 5833d54c48e3c95a94adcbe27699a8d3 [0,0,0,0,0,0|4,0,0]=4 34 B9R1.33 OCNc1c[nH]nc1Cl 7b78609deed040345e3e83fbc2465ba2 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.33 OCNc1ncsc1Br 4b9f0115d1dd5d777929034ea5f39fd8 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.33 OCNc1nsnc1Cl fe48ad5e05904446d5aaee5a5d3a6733 [0,0,0,0,0,0|4,0,0]=4 37 B8R1.8 CCNc1cccs1 f92887221cdfe270aa88f70a5b6538c3 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.8 CCNc1cncs1 caf47a09a037d51cb6d8de3ed1ef2cd8 [1,0,0,0,0,0|2,0,0]=3 39 B8R1.8 CCNc1cnns1 715fe9c1555857b6f93ab97018c34b16 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.8 CCNc1nncs1 f4238bbf01e2da8c7cb3260825740713 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.8 CCOc1cccs1 d21292a98c2ee3c1ea9b8b00e074b6ef [1,0,0,0,0,0|3,0,0]=4 42 B8R1.8 CCOc1nncs1 e127a60b711c378b5df75f4dfb79580f [1,0,0,0,0,0|3,0,0]=4 43 B8R1.8 FCNc1cccs1 5e75f288d43648c29cd49234a17e1a9b [1,0,0,0,0,0|3,0,0]=4 44 B8R1.8 FCNc1cncs1 8b493dc10d152e95cc556b0e6f254623 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.8 FCNc1cnns1 3a25b8b2695ad355c69509e9a451724c [1,0,0,0,0,0|3,0,0]=4 46 B8R1.8 FCNc1nncs1 ca86f341beb4089a98cfd64168dab1e9 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.8 FCOc1cccs1 5abe6db260cf1bf0ece10764373fe2fd [1,0,0,0,0,0|3,0,0]=4 48 B8R1.8 FCOc1nncs1 077267ee662842c6b6a5be59731196b4 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.8 O=CNc1cncs1 2fc027c30eccc6d6784fdd08eb71b5dd [1,0,0,0,0,0|1,0,2]=4 50 B8R1.8 OCNc1cccs1 2c9e101236047184adb7524dbc050fa0 [1,0,0,0,0,0|2,0,0]=3 51 B8R1.8 OCNc1ccno1 478600583886de8c6682fe554d125237 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.8 OCNc1ccns1 e57f2a4ef26f21fe834381dfd9a1257b [1,0,0,0,0,0|3,0,0]=4 53 B8R1.8 OCNc1ccsc1 baaeacb9206ca69c746a94490c876825 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.8 OCNc1cn[nH]c1 bee71e5be9ca1489720a048052d96c78 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.8 OCNc1cncs1 6a1421c2b1d1c1d56a31b7e716ddbb04 [1,0,0,0,0,0|1,0,0]=2 56 B8R1.8 OCNc1cnns1 b219825f251ac751e31d5fee60cb9c19 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.8 OCNc1cnoc1 512fbc62ec343f0b10e9c60eefcbadbd [1,0,0,0,0,0|3,0,0]=4 58 B8R1.8 OCNc1cnon1 c34536149518d4f050c263cd8f7fe019 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.8 OCNc1cnsc1 78b39415a80669927282be04a2cf9047 [1,0,0,0,0,0|3,0,0]=4 60 B8R1.8 OCNc1cocn1 e1a60a0cc7051579fcf6090e396569f9 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.8 OCNc1cscn1 ad7de3e895d3dc9dfaeb615236b65625 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.8 OCNc1nccs1 45a5a57bb5cb8d2f68397bed9047efc5 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.8 OCNc1ncns1 b231840248e86b995fbc178e94ae85e1 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.8 OCNc1nnco1 59ddb0b14d4c463a6b9d69bbcd410c87 [1,0,0,0,0,0|2,1,0]=4 65 B8R1.8 OCNc1nncs1 75e77ace8df5a3eeb9f190bacbdc90d6 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.8 OCNc1nnns1 22796823db015d92ba8501553bbab96c [1,0,0,0,0,0|3,0,0]=4 67 B10R1.5 CCc1n[nH]cc1NCO 217c10f0d918c1f259a6a5af98f0cce7 [0,1,0,0,0,0|3,0,0]=4 68 B10R1.5 CCn1nccc1NCO 781a67746d45f4f8f865fdf3ebb70861 [0,1,0,0,0,0|3,0,0]=4 69 B10R1.5 CCn1ncnc1NCO 0cbdc466d5e13e835b70bdec402ec271 [0,1,0,0,0,0|3,0,0]=4 70 B10R1.5 COc1n[nH]cc1NCO 16ca7723947aeb260a85d56fc484da68 [0,1,0,0,0,0|3,0,0]=4 71 B10R1.5 COc1nonc1NCO e18b32c0bc8ea40907a630c6c17f4c21 [0,1,0,0,0,0|3,0,0]=4 72 B10R1.5 N#Cc1ccsc1NCO 378ba6857f0d9629ac1ec0050746a8b7 [0,1,0,0,0,0|2,0,1]=4 73 B10R1.5 N#Cc1ncoc1NCO 4c279cfa3f03079eea14e53cc4d84943 [0,1,0,0,0,0|1,1,1]=4 74 B10R1.5 OCNc1ccsc1CO d97c6e153b61b6512f31e048abe17bdf [0,1,0,0,0,0|3,0,0]=4 75 B10R1.5 OCNc1nonc1CO 91f448f7561ddd14eb99cce9e15c4ae5 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.29 C#CCNc1scnc1C 67f96c8c3781e92018aed23be760c259 [0,1,0,0,0,0|1,0,1]=3 77 B10R1.29 C=CCNc1scnc1C b6438694cf2458680f83458ac12bce37 [0,1,0,0,0,0|1,0,1]=3 78 B10R1.29 CCCNc1c[nH]nc1C 2a3c6954ff42dd1962bdfa3411b5f776 [0,1,0,0,0,0|3,0,0]=4 79 B10R1.29 CCCNc1ccnn1C ac2723158833494ae34194bb87079e2a [0,1,0,0,0,0|3,0,0]=4 80 B10R1.29 CCCNc1ccsc1C a372e2f3816660711e96911387a99aaa [0,1,0,0,0,0|3,0,0]=4 81 B10R1.29 CCCNc1conc1C bb60cf7c9c66e5a810c9734f7729da9e [0,1,0,0,0,0|3,0,0]=4 82 B10R1.29 CCCNc1csnc1C ac8d73c2619da3bc0e71cf48be00d4c1 [0,1,0,0,0,0|3,0,0]=4 83 B10R1.29 CCCNc1ncnn1C 785a857415acb78add4c1d1646e5d1fb [0,1,0,0,0,0|3,0,0]=4 84 B10R1.29 CCCNc1nonc1C 65efa12dbaa1ff0150ce7af07c8bd120 [0,1,0,0,0,0|3,0,0]=4 85 B10R1.29 CCCNc1scnc1C 8ea9fcb5aa8469e9b9552a4f260d83dd [0,1,0,0,0,0|1,0,0]=2 86 B10R1.29 CCCOc1ccnn1C 4f9c9cf7f6632f8ccce0de7ef6f0fe94 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.29 CCNCc1ccnn1C 3009e3fbccd3d81701fcdecc0585decb [0,1,0,0,0,0|3,0,0]=4 88 B10R1.29 CCNCc1ccoc1C 37875bf99e24435822de4bec2aaa3263 [0,1,0,0,0,0|3,0,0]=4 89 B10R1.29 CCNCc1conc1C e7fb19c444626802c2892a87a3c8c9e1 [0,1,0,0,0,0|3,0,0]=4 90 B10R1.29 CCNCc1nc[nH]c1C d93c2f3cb100c3d8f2138b043d5c34c6 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.29 CCNCc1ncnn1C 0a0e86898a479a6c8d41c7579a9a80bd [0,1,0,0,0,0|3,0,0]=4 92 B10R1.29 CCNCc1ncoc1C 1fde5cae72cb3a5574bf15138744fb93 [0,1,0,0,0,0|3,0,0]=4 93 B10R1.29 CCNCc1nonc1C 9c8ca6d294f9da19f773823f107dd25c [0,1,0,0,0,0|3,0,0]=4 94 B10R1.29 CCNCc1occc1C 9ef238004378a81a0f74d5a2034266a3 [0,1,0,0,0,0|2,1,0]=4 95 B10R1.29 CCNCc1sccc1Cl f49871b4cf667255cdeb6dcff922461b [0,1,0,0,0,0|3,0,0]=4 96 B10R1.29 CCNCc1sccc1F ab368184a4e0fe6fd349be18a1c40dcb [0,1,0,0,0,0|3,0,0]=4 97 B10R1.29 CCNCc1scnc1Br 1e49b52b78482f108d467746f4f3283b [0,1,0,0,0,0|2,0,0]=3 98 B10R1.29 CCNCc1scnc1C 9204d7565d57b0e0bb5537f7bf04b137 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.29 CCNCc1snnc1C 64563078720a591ec917fc8f5b47b067 [0,1,0,0,0,0|2,0,0]=3 100 B10R1.29 CCOCc1c[nH]nc1C b7f7d652bfd281b1cd8a8bd99909bf80 [0,1,0,0,0,0|3,0,0]=4 101 B10R1.29 CCOCc1ccnn1C 7152d1b83895df39c09aefa48b08233a [0,1,0,0,0,0|3,0,0]=4 102 B10R1.29 CCOCc1ccoc1C eae898938246cdd68c7bd43fc9c7f9c1 [0,1,0,0,0,0|3,0,0]=4 103 B10R1.29 CCOCc1nc[nH]c1C 0ba0d4825fcf5ed952a6bd0a5c7fd15d [0,1,0,0,0,0|2,0,1]=4 104 B10R1.29 CCOCc1ncnn1C bc183c002d455c91d47d2c0e4f920760 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.29 CCOCc1ncoc1C 9a2a1aa1173211c6287b8fde5c32c63d [0,1,0,0,0,0|3,0,0]=4 106 B10R1.29 CCOCc1ncsc1C 28ffe15b9b1d1c489a7ceec5d8c550e7 [0,1,0,0,0,0|3,0,0]=4 107 B10R1.29 CCOCc1nonc1C ef489f05c8eba596482ae956b93e3036 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.29 CCOCc1occc1C e7df444d3db70c6d7ce1aeb39d71e1ae [0,1,0,0,0,0|2,1,0]=4 109 B10R1.29 CCOCc1ocnc1C f1dadf16dcac5a44fda51d454c25e0ef [0,1,0,0,0,0|1,1,0]=3 110 B10R1.29 CCOCc1sccc1C 928528f7c346be07c81d918139c5ea3e [0,1,0,0,0,0|2,0,0]=3 111 B10R1.29 CCOCc1sccc1Cl f1a6b399714310adf358afa7a2f0e9d6 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.29 CCOCc1sccc1F c318c2baa23b667c6c94321ee13cd20c [0,1,0,0,0,0|3,0,0]=4 113 B10R1.29 CCOCc1scnc1Br c74b3983e9b8e0903e9641d9202d7326 [0,1,0,0,0,0|2,0,0]=3 114 B10R1.29 CCOCc1scnc1C 08fbb584585273c03ccb3fc3c54d5a67 [0,1,0,0,0,0|1,0,0]=2 115 B10R1.29 CCOCc1scnc1Cl eb2d8e57dca2907a8f5c1bc4885bbd70 [0,1,0,0,0,0|2,0,0]=3 116 B10R1.29 CCOCc1snnc1C 6613c9f9afa6aa6b3c44843f6cc42b29 [0,1,0,0,0,0|2,0,0]=3 117 B10R1.29 COCNc1c[nH]nc1C 2702f5c2b63ba20705d36f537b666c96 [0,1,0,0,0,0|3,0,0]=4 118 B10R1.29 COCNc1ccnn1C 5258bb537b0b730492e7408b9e5e81c5 [0,1,0,0,0,0|3,0,0]=4 119 B10R1.29 COCNc1ccsc1C 3b6f44b0065f692a170f9d5d75bd7ace [0,1,0,0,0,0|3,0,0]=4 120 B10R1.29 COCNc1conc1C dce19d74dd4b77fe5a208e7f8a2a3e35 [0,1,0,0,0,0|3,0,0]=4 121 B10R1.29 COCNc1csnc1C 2a98d118cd6a7aaf3209f9e0f3f0625f [0,1,0,0,0,0|3,0,0]=4 122 B10R1.29 COCNc1ncnn1C 45f36337ed79dc501bb58726fd72e37a [0,1,0,0,0,0|3,0,0]=4 123 B10R1.29 COCNc1nonc1C 61f97f7d75bfbec117baa5fa149ca91d [0,1,0,0,0,0|3,0,0]=4 124 B10R1.29 COCNc1scnc1C e4989af1dc6b47dbd8147f3d6a5a8b8b [0,1,0,0,0,0|1,0,0]=2 125 B10R1.29 COCOc1ccnn1C 7bb8184c7ae3f6dd4d9985deb771b2b9 [0,1,0,0,0,0|3,0,0]=4 126 B10R1.29 CSCNc1scnc1C d2e7d398810d36055d38c863cb5d03a8 [0,1,0,0,0,0|1,1,0]=3 127 B10R1.29 Cc1[nH]cnc1CNCF e7aca94b0f90e85e34245ab1ffdd3743 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.29 Cc1[nH]cnc1CNCO 383a42a231d818bd405b5f179f363340 [0,1,0,0,0,0|1,0,1]=3 129 B10R1.29 Cc1[nH]cnc1COCF 4c22f0e5bb03e9428ff1cd459cd374f8 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.29 Cc1[nH]ncc1CNCO 3643c1ce2cba5a873004c0ef674aaf80 [0,1,0,0,0,0|2,0,1]=4 131 B10R1.29 Cc1c[nH]nc1NCCO e7e6137a87ce7f3b9668f38afca408b1 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.29 Cc1ccoc1CNCF 7b90ffac2b3622c1b5bd007449c27acf [0,1,0,0,0,0|2,1,0]=4 133 B10R1.29 Cc1ccoc1CNCO 3b1ec24b65f1554651ff21c7bec117dc [0,1,0,0,0,0|1,1,0]=3 134 B10R1.29 Cc1ccoc1COCF 1d5154e89e1774674d960ff6e2f2ac51 [0,1,0,0,0,0|2,1,0]=4 135 B10R1.29 Cc1ccsc1COCF 8bd384f9c0495488683fd6c5d33cbce1 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.29 Cc1ccsc1NCCO 49a32e43bb25c1beeffaf1c7a3ba2439 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.29 Cc1ccsc1NCCS cc49c8382ba84bd72f8bedd3ab2903ab [0,1,0,0,0,0|1,1,0]=3 138 B10R1.29 Cc1cnoc1NCCO 5b58587492bc9368124951dd55f4f01d [0,1,0,0,0,0|2,1,0]=4 139 B10R1.29 Cc1conc1CNCO c02a000e47cae8572065b21abedc7f49 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.29 Cc1conc1NCCO 48b7e5dea4dd7354519a6f911128fea4 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.29 Cc1cscc1NCCO b909db2725239e0b9460abfedff465cb [0,1,0,0,0,0|3,0,0]=4 142 B10R1.29 Cc1n[nH]cc1COCF 334abd5f61d66da356b16e8b372d1446 [0,1,0,0,0,0|3,0,0]=4 143 B10R1.29 Cc1n[nH]cc1NCCF fdcabaa1bd3cb6d23b2a2e4b6c8dc4af [0,1,0,0,0,0|3,0,0]=4 144 B10R1.29 Cc1n[nH]cc1NCCO 153fb67cccfd9e7837afffa47a752444 [0,1,0,0,0,0|2,0,0]=3 145 B10R1.29 Cc1n[nH]cc1NCCS a738e8637e382c297cafa94a9e49f2c7 [0,1,0,0,0,0|2,1,0]=4 146 B10R1.29 Cc1ncoc1COCF bd05682725a15597384625227d594f5f [0,1,0,0,0,0|1,1,0]=3 147 B10R1.29 Cc1ncsc1CNC#N ab6c4fa64febce0bc8865488c7e780b7 [0,1,0,0,0,0|1,0,1]=3 148 B10R1.29 Cc1ncsc1CNC=O 30603d5ccfcad65650375e89d44db747 [0,1,0,0,0,0|0,0,2]=3 149 B10R1.29 Cc1ncsc1CNCF 2af11a40b7e1bd982f7dda52c6fa142e [0,1,0,0,0,0|1,0,0]=2 150 B10R1.29 Cc1ncsc1CNCO 6a174d97cb14e8bdfeb32b87340382ed [0,1,0,0,0,0|0,0,0]=1 151 B10R1.29 Cc1ncsc1COCF ba902554290dc5aa89e5daceb46e45e7 [0,1,0,0,0,0|1,0,0]=2 152 B10R1.29 Cc1ncsc1NCC#N a2fa6c9787e981d376c93e374dfede47 [0,1,0,0,0,0|1,0,1]=3 153 B10R1.29 Cc1ncsc1NCC=O dbfc4627e90345c93fd3dd842a3c9f1c [0,1,0,0,0,0|0,0,2]=3 154 B10R1.29 Cc1ncsc1NCCF 6d5421e81fb87ecf0ed60ec2ed652d87 [0,1,0,0,0,0|1,0,0]=2 155 B10R1.29 Cc1ncsc1NCCO abfede32d6c25c90a0a8cfe5561ec8bb [0,1,0,0,0,0|0,0,0]=1 156 B10R1.29 Cc1ncsc1NCCS f0c2ec1de0530025d1d55dfda9076b20 [0,1,0,0,0,0|0,1,0]=2 157 B10R1.29 Cc1nnsc1CNC#N 21bcca8c8b313f7e0e46a6d152c5672d [0,1,0,0,0,0|2,0,1]=4 158 B10R1.29 Cc1nnsc1CNC=O 594c0b9e61b4414dc25010c0dab66323 [0,1,0,0,0,0|1,0,2]=4 159 B10R1.29 Cc1nnsc1CNCF c01038f48850145d094a34e955255269 [0,1,0,0,0,0|2,0,0]=3 160 B10R1.29 Cc1nnsc1CNCO fe9e438ed92fa4218273563ee7c1f03e [0,1,0,0,0,0|1,0,0]=2 161 B10R1.29 Cc1nnsc1COCF 391cc088bbe6a94ae0f8a37e57bcaba2 [0,1,0,0,0,0|2,0,0]=3 162 B10R1.29 Cc1nocc1CNCF f9a1b9d3dec1f20d4e060f8a13fd5251 [0,1,0,0,0,0|3,0,0]=4 163 B10R1.29 Cc1nocc1CNCO 8fe9f9d5beb3d3a18c3aa31158837900 [0,1,0,0,0,0|2,0,0]=3 164 B10R1.29 Cc1nocc1NCCF f4166173c140d59a4d68b62c49511d8d [0,1,0,0,0,0|3,0,0]=4 165 B10R1.29 Cc1nocc1NCCO b25ae511cd23a57348915672e91905d5 [0,1,0,0,0,0|2,0,0]=3 166 B10R1.29 Cc1nocc1NCCS 95f609da2c36d26c519411c34e490008 [0,1,0,0,0,0|2,1,0]=4 167 B10R1.29 Cc1nonc1CNCF 0d7b7d001b53d2373b5483df90239f9b [0,1,0,0,0,0|3,0,0]=4 168 B10R1.29 Cc1nonc1CNCO 8ff4ea29930fdcf2f4955724f5c1b2bc [0,1,0,0,0,0|2,0,0]=3 169 B10R1.29 Cc1nonc1COCF e7ff0e220ad35189938f093221ebb7b8 [0,1,0,0,0,0|3,0,0]=4 170 B10R1.29 Cc1nonc1NCCF 9bd736066d68bc9f94c4330a2e104d38 [0,1,0,0,0,0|3,0,0]=4 171 B10R1.29 Cc1nonc1NCCO 33539b7feda797f117c0e6a7c9729506 [0,1,0,0,0,0|2,0,0]=3 172 B10R1.29 Cc1nonc1NCCS 805578d10539c794bc2257f8009f9f80 [0,1,0,0,0,0|2,1,0]=4 173 B10R1.29 Cc1nscc1NCCF 51917484a3763fe34975ba6a7fddcb7e [0,1,0,0,0,0|3,0,0]=4 174 B10R1.29 Cc1nscc1NCCO f4d0d1511c1a50f8b869770edc01aa6e [0,1,0,0,0,0|2,0,0]=3 175 B10R1.29 Cc1nscc1NCCS ab299f915e6b2c5fd8a9a4b146b90a38 [0,1,0,0,0,0|2,1,0]=4 176 B10R1.29 Cc1occc1CNCF debbb46e003ef38737ad013d4d2082c4 [0,1,0,0,0,0|3,0,0]=4 177 B10R1.29 Cc1occc1CNCO 4fc10a8ae65b3f0bb432accc32f35890 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.29 Cc1occc1COCF c540d7b4f63007ff9017777dfd157adb [0,1,0,0,0,0|3,0,0]=4 179 B10R1.29 Cc1ocnc1CNCF d39e7df4cf5434eb354c7f566f6116d5 [0,1,0,0,0,0|3,0,0]=4 180 B10R1.29 Cc1ocnc1CNCO 5e8780da41fe3aadef919ae7b4f2d178 [0,1,0,0,0,0|2,0,0]=3 181 B10R1.29 Cc1ocnc1COCF 3881755686c1dfb7b44f847c5983c402 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.29 Cc1oncc1CNCO f9dab1421c8d560830efd29b61d2d5b1 [0,1,0,0,0,0|3,0,0]=4 183 B10R1.29 Cc1oncc1NCCO ce07c41a61dc6e026a4d2fd8b4694547 [0,1,0,0,0,0|3,0,0]=4 184 B10R1.29 Cc1sccc1NCCBr fc52c130ed88866be4775db4af864018 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.29 Cc1sccc1NCCF 7812a3b4ff1c0b6940d0df24124110ea [0,1,0,0,0,0|3,0,0]=4 186 B10R1.29 Cc1sccc1NCCI a8b77651892394fd120db7db54da458e [0,1,0,0,0,0|3,0,0]=4 187 B10R1.29 Cc1sccc1NCCO c0f2f4a2cfb28eb9d2f7052ce9280b59 [0,1,0,0,0,0|2,0,0]=3 188 B10R1.29 Cc1sccc1NCCS 98ce751c64e6c849319f91682ca82365 [0,1,0,0,0,0|2,1,0]=4 189 B10R1.29 Cc1scnc1COCF 2d593487b79832ecea45addc323efeab [0,1,0,0,0,0|3,0,0]=4 190 B10R1.29 Cn1cccc1CNCO 8797ef092b0a11a7c0adc121ee7b19c7 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.29 Cn1ccnc1CNCO 8cf17dffe4cd64ae7275502072176b16 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.29 Cn1ccnc1NCCO 3e9bdae9ff535e40d080d589c74fcb43 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.29 Cn1nccc1CNCF 3096d05bb562c83232647567954182d1 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.29 Cn1nccc1CNCO 2ff64548a49b3284ee6924e23e51731f [0,1,0,0,0,0|2,0,0]=3 195 B10R1.29 Cn1nccc1COCF 7096f14918104312b82c998b5d2d3734 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.29 Cn1nccc1NCCBr c986fa880cc33864343d60a25b591b0c [0,1,0,0,0,0|3,0,0]=4 197 B10R1.29 Cn1nccc1NCCF b527bcc934322981be7d51b28ec978e8 [0,1,0,0,0,0|3,0,0]=4 198 B10R1.29 Cn1nccc1NCCI cb241ff82d9e9358b8af8fa0241431b1 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.29 Cn1nccc1NCCO 050638778c951af8c1f10bcf19c37bd9 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.29 Cn1nccc1NCCS 25e881319d4a514148adaf12cb814f54 [0,1,0,0,0,0|2,1,0]=4 201 B10R1.29 Cn1nccc1OCCF ab491437948b0ff021cb6e7c899548e2 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.29 Cn1nccc1OCCS a63b663a4e6689ad2392604f3425592d [0,1,0,0,0,0|2,1,0]=4 203 B10R1.29 Cn1ncnc1CNCF c3b23f6ff4844bfab2c7f56f0342f1e5 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.29 Cn1ncnc1CNCO 493b7e9d49201bcda1deb5d89ce6fc3c [0,1,0,0,0,0|2,0,0]=3 205 B10R1.29 Cn1ncnc1COCF 5978681bff26e05d87ad26af84c51877 [0,1,0,0,0,0|3,0,0]=4 206 B10R1.29 Cn1ncnc1NCCF d2bbe4f2e6f7997f7d71e4db8e06b80d [0,1,0,0,0,0|3,0,0]=4 207 B10R1.29 Cn1ncnc1NCCO 16852cb59a753956f5b9cb3c72e82e53 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.29 Cn1ncnc1NCCS a7d87308c7cb5c3406f502dd7e18b454 [0,1,0,0,0,0|2,1,0]=4 209 B10R1.29 Cn1nncc1NCCO d9d0aed32bf6aa92e952a8ca9333f2c9 [0,1,0,0,0,0|3,0,0]=4 210 B10R1.29 Cn1nnnc1NCCO 6c603e0ad25b461b57b311b391fd11ec [0,1,0,0,0,0|3,0,0]=4 211 B10R1.29 FCNCc1sccc1Cl a830839c49bdf27be3956dc3b3a7b591 [0,1,0,0,0,0|3,0,0]=4 212 B10R1.29 FCNCc1sccc1F 31669fe5ce8cb4bed183fee3f8ece114 [0,1,0,0,0,0|3,0,0]=4 213 B10R1.29 FCNCc1scnc1Br e39bb8061db100f9b327be0f13e82fb3 [0,1,0,0,0,0|2,0,0]=3 214 B10R1.29 FCOCc1sccc1Cl 282ccab1e970ff62220453ce70175452 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.29 FCOCc1sccc1F de9a0aa5a49c03e683eeedff3c47d02e [0,1,0,0,0,0|3,0,0]=4 216 B10R1.29 FCOCc1scnc1Br e8072d784f759c02226686bdf633bdb2 [0,1,0,0,0,0|2,0,0]=3 217 B10R1.29 FCOCc1scnc1Cl c1bf0b5b4988889d80a973048387d99c [0,1,0,0,0,0|2,0,0]=3 218 B10R1.29 N#CNCc1scnc1Cl cd355ba8e874d1cead18f458f18298c3 [0,1,0,0,0,0|2,0,1]=4 219 B10R1.29 O=CNCc1scnc1Br 753bb045494b8ca281cd77cd4574b1dc [0,1,0,0,0,0|1,0,2]=4 220 B10R1.29 OCCNc1c[nH]nc1Br 25038bffd1288330dfa6a971589e8453 [0,1,0,0,0,0|3,0,0]=4 221 B10R1.29 OCCNc1c[nH]nc1Cl 88c1d55675d13da80fc7320bb6cbceae [0,1,0,0,0,0|3,0,0]=4 222 B10R1.29 OCCNc1ncsc1Br 5bf60ef665d19923f8acf78acf08a84d [0,1,0,0,0,0|3,0,0]=4 223 B10R1.29 OCCNc1nsnc1Cl 43f3fb784ef811d704bb228aa7a6f211 [0,1,0,0,0,0|3,0,0]=4 224 B10R1.29 OCNCc1ccsc1Br f9cbf8dcdb4f0ea30ce750b2e8b342e1 [0,1,0,0,0,0|3,0,0]=4 225 B10R1.29 OCNCc1sccc1Br 3c3ebd02cdf6fedc08a880a1d6c85417 [0,1,0,0,0,0|2,0,0]=3 226 B10R1.29 OCNCc1sccc1Cl 7be4dfc982a65581b6d36aa70ab20278 [0,1,0,0,0,0|2,0,0]=3 227 B10R1.29 OCNCc1sccc1F bf7c7f8ff7b45f0365a70f93453847d6 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.29 OCNCc1scnc1Br 52d22848948d42f3cb80e700cacf2df4 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.64 CC(=O)Nc1scnc1C d9c5db1d555c273edf064ea3f50fb573 [0,1,0,0,0,0|1,0,2]=4 230 B10R1.64 Cc1ncsc1NC(C)C d83ee4be5b5cd699a0352cb1a444d69f [0,1,0,0,0,0|2,0,0]=3 231 B10R1.130 CCOc1[nH]c(nc1C)C 81be7bfb35ff0e08bffa8f8fe586d83d [0,1,0,0,0,0|3,0,0]=4 232 B10R1.130 Cc1cc(n(n1)C)NCO 572c6956bc71a1e41b339b78f7d9abd1 [0,1,0,0,0,0|3,0,0]=4 233 B10R1.130 Cc1nc(c([nH]1)OCF)C 54418595c555ecdd03c8203eb30668aa [0,1,0,0,0,0|3,0,0]=4 234 B10R1.130 Cc1nc(n(n1)C)NCO 9b2d10e90af7a9a8e840df995ff76515 [0,1,0,0,0,0|3,0,0]=4 235 B10R1.130 Cc1nn(cc1NCO)C 62a43f1f22b6cb4075a783b6d35f4ab0 [0,1,0,0,0,0|3,0,0]=4 236 B10R1.130 Cn1nc(cc1NCO)Br eb9921e6cd63c424f70a247d5761173a [0,1,0,0,0,0|3,0,0]=4 237 B10R1.130 Cn1nc(cc1NCO)Cl 722f453a296d812a1983e50184d69531 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.130 Cn1nc(nc1NCO)Br 9c0ddf288c4386d4191b2bf4ac96447e [0,1,0,0,0,0|3,0,0]=4 239 B10R1.149 CCN(C)c1sccc1C 980430f2ff5e590baeb4fe4f062a4173 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.187 CCNc1c(ncn1C)C a141127ed49a846339d282a85e0cfe79 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.187 Cc1cnn(c1NCO)C 9c793885796a166f54c5ad4c16514ef1 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.187 Cc1n[nH]c(c1NCO)C b6970a89a882d0fc99e50c4e7e3f034c [0,1,0,0,0,0|3,0,0]=4 243 B10R1.187 Cc1n[nH]c(c1NCO)Cl b41572e7dba886d67e6c5c683fb8d2c7 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.187 Cc1ncn(c1NCF)C f6da943bf45acbd6baafdf4f9b961617 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.187 Cc1ncn(c1NCO)C 1d1e7a27e7a602180d7940f47bef5223 [0,1,0,0,0,0|2,0,0]=3 246 B10R1.187 Cc1nnn(c1NCO)C a2ff0bf7c6daf11eba9643bc34e3f752 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.187 Cc1noc(c1NCO)C 7906361553c56b4c9489b56aabfaa69f [0,1,0,0,0,0|3,0,0]=4 248 B10R1.187 Cn1ncc(c1NCO)Cl 9f037d7892068eac1a44f2d8c23df66b [0,1,0,0,0,0|3,0,0]=4 249 B10R1.187 Cn1ncc(c1NCO)I 4d1e83e9ae82248e6380b29617acb660 [0,1,0,0,0,0|3,0,0]=4 250 B10R1.4 CCNc1cccnc1C aa29ce1aae1cb0173cce32ed6de53439 [0,0,0,0,0,1|3,0,0]=4 251 B10R1.4 CCNc1ccncc1C a4036471d4d817efbd65f0f570537bae [0,0,0,0,0,1|3,0,0]=4 252 B10R1.4 CCNc1ccnnc1C b89b8af7958b7cd2d083023eee6d381c [0,0,0,0,0,1|3,0,0]=4 253 B10R1.4 CCNc1cncnc1C c780de3350d8a4ea3afb5887d12adc9b [0,0,0,0,0,1|3,0,0]=4 254 B10R1.4 CCNc1nccnc1C 3a642966a1abe913b5ad08a3a9152c71 [0,0,0,0,0,1|3,0,0]=4 255 B10R1.4 CCNc1ncncc1C 43473af78e8552e155b26029efd11eef [0,0,0,0,0,1|3,0,0]=4 256 B10R1.4 CCOc1cccnc1C 0260c4935677d055d800178e37d974b6 [0,0,0,0,0,1|3,0,0]=4 257 B10R1.4 CCOc1ccncc1C 20c8f7e703c3d3baef36021d316a4da0 [0,0,0,0,0,1|3,0,0]=4 258 B10R1.4 CCOc1cncnc1C ae58a7be391f847fd7fcfb6c7cbd61b8 [0,0,0,0,0,1|3,0,0]=4 259 B10R1.4 CCOc1nccnc1C 51150a087141b1b997c624a726b47861 [0,0,0,0,0,1|3,0,0]=4 260 B10R1.4 CCOc1ncncc1C a024efe8fb00db7ba69958a60fccd3f1 [0,0,0,0,0,1|3,0,0]=4 261 B10R1.4 Cc1cccnc1NCO b9826d2a8449ec373392c9bb98cfc60e [0,0,0,0,0,1|3,0,0]=4 262 B10R1.4 Cc1ccncc1NCO e4933813d96bfefaf0bee2f99290507f [0,0,0,0,0,1|3,0,0]=4 263 B10R1.4 Cc1ccnnc1NCO f84caaf9b6d21df079793e4cbf879057 [0,0,0,0,0,1|3,0,0]=4 264 B10R1.4 Cc1cnccc1NCF 919be919cd2a8b08089ffcf31ad2866e [0,0,0,0,0,1|3,0,0]=4 265 B10R1.4 Cc1cnccc1NCO 9c8541485e7e2429c3deeaca1ea35ffc [0,0,0,0,0,1|2,0,0]=3 266 B10R1.4 Cc1cnccc1OCF ff08b5342b953cd9c073ac8ccce03fce [0,0,0,0,0,1|3,0,0]=4 267 B10R1.4 Cc1cncnc1NCO ca1c64b6e743bc13e67b608cbc9e222f [0,0,0,0,0,1|2,0,0]=3 268 B10R1.4 Cc1cncnc1OCF 15d70d1080a7e6fa4acd29ca63e12c54 [0,0,0,0,0,1|3,0,0]=4 269 B10R1.4 Cc1ncccc1NCF 811f0102399d1828b22fe489d7a22ddb [0,0,0,0,0,1|3,0,0]=4 270 B10R1.4 Cc1ncccc1NCO 2163da6c3951ac44c1be417e09664d52 [0,0,0,0,0,1|2,0,0]=3 271 B10R1.4 Cc1ncccc1OCF 5bc55fc04a01d4a91e7fbd84fd947089 [0,0,0,0,0,1|3,0,0]=4 272 B10R1.4 Cc1nccnc1NCF 75f59e3232eacc54a7d91ec4a824414b [0,0,0,0,0,1|3,0,0]=4 273 B10R1.4 Cc1nccnc1NCO b7efb285f742fc426f6d2f93fedaca5c [0,0,0,0,0,1|2,0,0]=3 274 B10R1.4 Cc1nccnc1OCF 63364eacb2362dc6d4479f9c92ad80c8 [0,0,0,0,0,1|3,0,0]=4 275 B10R1.4 Cc1ncncc1NCO 93665cbde74a24c33608f61db671f6c5 [0,0,0,0,0,1|2,0,0]=3 276 B10R1.4 Cc1ncncc1OCF c01b5e76af4816e8c6e8576ca724b5d8 [0,0,0,0,0,1|3,0,0]=4 277 B10R1.4 Cc1nnccc1NCF 9d7a2a0f882537f913d8e9ebe4f78264 [0,0,0,0,0,1|3,0,0]=4 278 B10R1.4 Cc1nnccc1NCO 9f9f1200c59cec52393a521506539045 [0,0,0,0,0,1|2,0,0]=3 279 B10R1.4 O=c1[nH]nccc1NCO 4342eb40d9c05509f3040190fe6949f9 [0,0,0,0,0,1|3,0,0]=4 280 B10R1.4 O=c1nc[nH]cc1NCO c11df53a6528d3d0e0e1ae9adda9ddae [0,0,0,0,0,1|3,0,0]=4 281 B10R1.4 OCNc1cccnc1Br 7e757b1b55f902889855879ddc522fb0 [0,0,0,0,0,1|3,0,0]=4 282 B10R1.4 OCNc1cccnc1Cl 698ab8db9bc7be3255bc7380ce9aaa39 [0,0,0,0,0,1|3,0,0]=4 283 B10R1.4 OCNc1cccnc1F fa95074763d1b79d4379cbccbf606177 [0,0,0,0,0,1|3,0,0]=4 284 B10R1.4 OCNc1cccnc1I 24ae1d254ba17b837d586845f299b407 [0,0,0,0,0,1|3,0,0]=4 285 B10R1.4 OCNc1ccn[nH]c1=S c59229ec77249aec8d7823827063fe89 [0,0,0,0,0,1|3,0,0]=4 286 B10R1.4 OCNc1ccncc1Br 043c6178a1ab58a98fa93ec425d203ca [0,0,0,0,0,1|3,0,0]=4 287 B10R1.4 OCNc1ccncc1Cl 2b47f51ab4733ba853a497ee10ffa423 [0,0,0,0,0,1|3,0,0]=4 288 B10R1.4 OCNc1ccncc1F 40fbda4234bf042d70ef0fda5d7316e1 [0,0,0,0,0,1|3,0,0]=4 289 B10R1.4 OCNc1ccncc1I 3ac21fc2c03a013c796b1896ac37dcd3 [0,0,0,0,0,1|3,0,0]=4 290 B10R1.4 OCNc1ccnnc1Br 179822fe8f088bf2c40d96cad1cac4ea [0,0,0,0,0,1|3,0,0]=4 291 B10R1.4 OCNc1ccnnc1Cl 521c30d41a60b640484938350119461d [0,0,0,0,0,1|3,0,0]=4 292 B10R1.4 OCNc1cncnc1Br f532c779795ecc66cdae0fa23b949df3 [0,0,0,0,0,1|3,0,0]=4 293 B10R1.4 OCNc1cncnc1Cl 069a181016f0bb277062a2272d7e52f1 [0,0,0,0,0,1|3,0,0]=4 294 B10R1.4 OCNc1nccnc1Br 7af049698c29a358d0876489e041db17 [0,0,0,0,0,1|3,0,0]=4 295 B10R1.4 OCNc1nccnc1Cl cbb688ed77e7f2172670808df4fc3df7 [0,0,0,0,0,1|3,0,0]=4 296 B10R1.4 OCNc1nccnc1I 9575c4b17a9e104d2c49002bcf42a737 [0,0,0,0,0,1|3,0,0]=4 297 B10R1.4 OCNc1ncncc1Br 4c12ad2a7b3749d365b018f2348307f6 [0,0,0,0,0,1|3,0,0]=4 298 B10R1.4 OCNc1ncncc1Cl 741cfd5cbe20b7411851b740cd6c4c00 [0,0,0,0,0,1|3,0,0]=4 299 B10R1.4 OCNc1ncncc1F 9fe2223628387dfb1b4414052336fc8e [0,0,0,0,0,1|3,0,0]=4 300 B10R1.4 OCNc1ncncc1I 0f4fe75ed5242fe97cb6a987f6d71953 [0,0,0,0,0,1|3,0,0]=4 301 B10R1.10 CCNc1cc(ncn1)C b1c6d3b0277aa9e6703ce1ebdf90b7a8 [0,0,0,0,0,1|3,0,0]=4 302 B10R1.10 CCNc1ccnc(c1)C 58ebbaae6a202dff8555d7dd291a0bc7 [0,0,0,0,0,1|3,0,0]=4 303 B10R1.10 CCNc1ccnc(n1)C d168f3526a84c167c0cca101bf3886ab [0,0,0,0,0,1|3,0,0]=4 304 B10R1.10 CCOc1cc(ncn1)C 32aed1e82b8f4aa7523f5f5a34fcd17b [0,0,0,0,0,1|3,0,0]=4 305 B10R1.10 CCOc1ccnc(c1)C 4df81811aab21f04d442f5835764e2f5 [0,0,0,0,0,1|3,0,0]=4 306 B10R1.10 CCOc1ccnc(n1)C 75a439f9f8e7946ad9bf1fd305e7c9d8 [0,0,0,0,0,1|3,0,0]=4 307 B10R1.10 Cc1cc(ccn1)NCF 07192002c4cc897a4627bafce0530f7b [0,0,0,0,0,1|3,0,0]=4 308 B10R1.10 Cc1cc(ccn1)NCO 353dcdae75673eff669a504a76ea86a7 [0,0,0,0,0,1|2,0,0]=3 309 B10R1.10 Cc1cc(ccn1)OCF aeb6541847ae11a0f391273dfd630fe8 [0,0,0,0,0,1|3,0,0]=4 310 B10R1.10 Cc1cc(ncn1)NCF 120cc88af2651d8cc5aee06302219807 [0,0,0,0,0,1|3,0,0]=4 311 B10R1.10 Cc1cc(ncn1)NCO 584c215f23b53614acfda3e0bcb50f95 [0,0,0,0,0,1|2,0,0]=3 312 B10R1.10 Cc1cc(ncn1)OCF 7d20b542158c49ee7445c89aa5829628 [0,0,0,0,0,1|3,0,0]=4 313 B10R1.10 Cc1cccc(c1)NCO eb61e002278030a37368dc2bd095ceec [0,0,0,0,0,1|3,0,0]=4 314 B10R1.10 Cc1cccc(n1)NCO 14b645ff6dbf83910f77237887d6e3d4 [0,0,0,0,0,1|3,0,0]=4 315 B10R1.10 Cc1ccnc(c1)NCO 65994d174363031ffa8868b3de8821ab [0,0,0,0,0,1|3,0,0]=4 316 B10R1.10 Cc1ccnc(n1)NCO 5c29b7361d25706bea6ace2e379b4add [0,0,0,0,0,1|3,0,0]=4 317 B10R1.10 Cc1nccc(n1)NCF ae775128cbd4c75c5149d9a20cf6d4a4 [0,0,0,0,0,1|3,0,0]=4 318 B10R1.10 Cc1nccc(n1)NCO 72183a9f3cc182d599dbd026e320f5d2 [0,0,0,0,0,1|2,0,0]=3 319 B10R1.10 Cc1nccc(n1)OCF ae76db9d85d4ab666b28b3243a4a24cd [0,0,0,0,0,1|3,0,0]=4 320 B10R1.10 Cc1nncc(n1)NCO 3aa033dcd063e36721bf06e5c187a5bf [0,0,0,0,0,1|3,0,0]=4 321 B10R1.10 OCNc1cc(ncn1)Br a34705796134d385a7c3a8adec776786 [0,0,0,0,0,1|3,0,0]=4 322 B10R1.10 OCNc1cc(ncn1)Cl 868164745f56291a6ec9f99b651a93e9 [0,0,0,0,0,1|3,0,0]=4 323 B10R1.10 OCNc1cc(ncn1)F 8608bea3ed2e596dcc86777d64522e21 [0,0,0,0,0,1|3,0,0]=4 324 B10R1.10 OCNc1cc(ncn1)I 697fc15f1966307fb2d525ce3839fcee [0,0,0,0,0,1|3,0,0]=4 325 B10R1.10 OCNc1ccnc(c1)Br f34c84263462672ec08c1545d87606f1 [0,0,0,0,0,1|3,0,0]=4 326 B10R1.10 OCNc1ccnc(c1)Cl 035bab7c33e3139ab7e61c532e36a8da [0,0,0,0,0,1|3,0,0]=4 327 B10R1.10 OCNc1ccnc(c1)F 8f926e1f9368883964881b96087d85c9 [0,0,0,0,0,1|3,0,0]=4 328 B10R1.10 OCNc1ccnc(c1)I 9c2baa838f3f9d27815664d79d1a550a [0,0,0,0,0,1|3,0,0]=4 329 B10R1.10 OCNc1ccnc(n1)Br 4f7a2e9b7070e8c210aa87edb7d978c4 [0,0,0,0,0,1|3,0,0]=4 330 B10R1.10 OCNc1ccnc(n1)Cl 18ef91cb222217925e43de336868727b [0,0,0,0,0,1|3,0,0]=4 331 B10R1.10 OCNc1ccnc(n1)F 1b8e7d32957368285953bb674beef3f2 [0,0,0,0,0,1|3,0,0]=4 332 B10R1.10 OCNc1ccnc(n1)S 4544bc878168190eac62ee85d9800f29 [0,0,0,0,0,1|3,0,0]=4 333 B10R1.10 OCNc1ncnc(n1)Cl a33e12a7b1e683f9bd6db4293695a8d7 [0,0,0,0,0,1|3,0,0]=4 334 B10R1.10 OCNc1ncnc(n1)S 85f42c1b316e83f14981d1e0da615b7b [0,0,0,0,0,1|3,0,0]=4 335 B7R0.1 C/C=C/CNCCO 46233ffdd427019cbe6b11058a9a63af [1,0,1,0,0,0|2,0,0]=4 336 B7R0.1 C/C=C\CNCCO e483151d6d53004ee90a0eb1d13c2feb [1,0,1,0,0,0|2,0,0]=4 337 B7R0.1 CC=CCNCCO 93f2efc2ffb774dced82bd601d90a1f7 [1,0,1,0,0,0|2,0,0]=4 338 B9R1.7 CCNc1cnc(s1)Br e2c3ff4ac1535b31ecad73ee51e097f4 [1,1,0,0,0,0|2,0,0]=4 339 B9R1.7 CCNc1cnc(s1)C ac585df68cb12d993b05e0ff0ef620a3 [1,1,0,0,0,0|2,0,0]=4 340 B9R1.7 CCNc1cnc(s1)S 6e7113bbfd11b80d937aac2745e9de88 [1,1,0,0,0,0|2,0,0]=4 341 B9R1.7 Cc1ccc(s1)NCO 00e2af5e98f8ffe71855be0007a81a6f [1,1,0,0,0,0|2,0,0]=4 342 B9R1.7 Cc1ncc(o1)NCO 2ed7cecb25e96ca1af6f4fcac58c786f [1,1,0,0,0,0|1,1,0]=4 343 B9R1.7 Cc1ncc(s1)NCF 9e96fbddb436c3ee7eca123d5a19acce [1,1,0,0,0,0|2,0,0]=4 344 B9R1.7 Cc1ncc(s1)NCO 3475e89217242ecce2a31d6dc9047a7d [1,1,0,0,0,0|1,0,0]=3 345 B9R1.7 Cc1nnc(s1)NCO 64f40de9c6820b5e3ac1cc015186b12b [1,1,0,0,0,0|2,0,0]=4 346 B9R1.7 FCNc1cnc(s1)Br b8bf800838b1f60a4cf49160805278e3 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.7 FCNc1cnc(s1)S 191e2acba8fad212a325e392d7d1e5e5 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.7 OCNc1ccc(s1)Br aa4dc4257fd9f4315f24935017c46f91 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.7 OCNc1cnc(s1)Br 406e88c0689f9b6b01d73783dbf9d922 [1,1,0,0,0,0|1,0,0]=3 350 B9R1.7 OCNc1cnc(s1)S 853590b68f6a073c6cbd6f34396e65e2 [1,1,0,0,0,0|1,0,0]=3 351 B9R1.7 OCNc1nnc(s1)Br 2b3b0ead841c94b30f9cd010ac5402e3 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.7 OCNc1nnc(s1)Cl 93e88d7e3f17654e283ba657d6657595 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.7 OCNc1nnc(s1)S 3af9655fa9b7b2f309dc51caace8afa4 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.11 CN(CO)c1nncs1 dd28a6a977dbeeff048a33a30357358a [1,1,0,0,0,0|2,0,0]=4 355 B9R1.12 BrCCNc1cccs1 c09b0f0dcebf0fcb791d9c0fae97e4ed [1,1,0,0,0,0|2,0,0]=4 356 B9R1.12 C#CCNc1cncs1 09a93b9cb080f5ccccef31fc1154d7d8 [1,1,0,0,0,0|1,0,1]=4 357 B9R1.12 C=CCNc1cncs1 7def881c4c141e9b7b8e15acb7689ca7 [1,1,0,0,0,0|1,0,1]=4 358 B9R1.12 CCCNc1cccs1 dddbeb0cebfad93e2ee450a927f1f846 [1,1,0,0,0,0|2,0,0]=4 359 B9R1.12 CCCNc1cncs1 d9981c3c4bf58afdd44af083430ae37f [1,1,0,0,0,0|1,0,0]=3 360 B9R1.12 CCCNc1cnns1 4c99af26421576ad269398b0d12b0db6 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.12 CCCNc1nncs1 6e3185c90a121f6bd5b1de1a33da093b [1,1,0,0,0,0|2,0,0]=4 362 B9R1.12 CCCOc1cccs1 08634ab81341ae1b1178430949f9ac0f [1,1,0,0,0,0|2,0,0]=4 363 B9R1.12 CCCOc1nncs1 0701431acd24640060df3cdf521cfd84 [1,1,0,0,0,0|2,0,0]=4 364 B9R1.12 CCNCc1cccs1 4bb993aa1ef7b62c5d2b7781bf586f7d [1,1,0,0,0,0|2,0,0]=4 365 B9R1.12 CCNCc1cnco1 1035caf61cdb047204144eeeaf71318d [1,1,0,0,0,0|1,1,0]=4 366 B9R1.12 CCNCc1cncs1 766ca9698d87ebdd1f3395f38204ee85 [1,1,0,0,0,0|1,0,0]=3 367 B9R1.12 CCOCc1cccs1 8766881c6db57c6784fc6c93385667d4 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.12 CCOCc1cnc[nH]1 9627bc2d6cb500602677f06a6a7d9bf4 [1,1,0,0,0,0|2,0,0]=4 369 B9R1.12 CCOCc1cnco1 682660b9b5fafc169b6b4f8ad83fea44 [1,1,0,0,0,0|1,1,0]=4 370 B9R1.12 CCOCc1cncs1 8515774c41cb1b7c89894f4d4fd2f475 [1,1,0,0,0,0|1,0,0]=3 371 B9R1.12 COCNc1cccs1 a445fc20137d5de04e37049f9b7acf2c [1,1,0,0,0,0|2,0,0]=4 372 B9R1.12 COCNc1cncs1 d8aa9030b888e2ce0dd175cd8386e218 [1,1,0,0,0,0|1,0,0]=3 373 B9R1.12 COCNc1cnns1 92bee5d62ae7a8dda201a5b25224dc59 [1,1,0,0,0,0|2,0,0]=4 374 B9R1.12 COCNc1nncs1 ac875f194f77fff7ee6d9d08eecef1fa [1,1,0,0,0,0|2,0,0]=4 375 B9R1.12 COCOc1cccs1 f7e2b3cd366d3a572662b6a110d9cdff [1,1,0,0,0,0|2,0,0]=4 376 B9R1.12 COCOc1nncs1 9eb85fc88a710f76b7d2f0e96c8999f6 [1,1,0,0,0,0|2,0,0]=4 377 B9R1.12 CSCNc1cncs1 3beb8ba66092659d529a2317040f5d97 [1,1,0,0,0,0|1,1,0]=4 378 B9R1.12 FCCNc1cccs1 72d30de6f7107428d208ec2105512673 [1,1,0,0,0,0|2,0,0]=4 379 B9R1.12 FCCNc1cncs1 14fd99ec0e4a761c563866bd4d0ba7d8 [1,1,0,0,0,0|1,0,0]=3 380 B9R1.12 FCCNc1cnns1 1d67fefaf63e4144ba3257794f1a7e3d [1,1,0,0,0,0|2,0,0]=4 381 B9R1.12 FCCNc1nncs1 a9fa33e3d7ab1c51424e0659dd15b11c [1,1,0,0,0,0|2,0,0]=4 382 B9R1.12 FCCOc1cccs1 4d4e0d32e310d3d0cee0221bc94ba774 [1,1,0,0,0,0|2,0,0]=4 383 B9R1.12 FCCOc1nncs1 f5772a13a470dc1ffccb61452dcf7459 [1,1,0,0,0,0|2,0,0]=4 384 B9R1.12 FCNCc1cccs1 1969e67372fdc757bbfda3428419fdb3 [1,1,0,0,0,0|2,0,0]=4 385 B9R1.12 FCNCc1cnco1 cf86c8bb9bd895bc4ce3c992d4d2142e [1,1,0,0,0,0|1,1,0]=4 386 B9R1.12 FCNCc1cncs1 76fd908de105c0540337c1ef239bc68d [1,1,0,0,0,0|1,0,0]=3 387 B9R1.12 FCOCc1cccs1 d20aa0b5d32f374e73f69643d763b140 [1,1,0,0,0,0|2,0,0]=4 388 B9R1.12 FCOCc1cnc[nH]1 b85322375d2bddd3354b8d4445a26470 [1,1,0,0,0,0|2,0,0]=4 389 B9R1.12 FCOCc1cnco1 a420d70118564f414ea32375d2dd9975 [1,1,0,0,0,0|1,1,0]=4 390 B9R1.12 FCOCc1cncs1 392d6d5ac538060a9f76173dc86c914f [1,1,0,0,0,0|1,0,0]=3 391 B9R1.12 ICCNc1cccs1 8499be8b0e3a22886e79ca6d717dc693 [1,1,0,0,0,0|2,0,0]=4 392 B9R1.12 N#CCNc1cncs1 3cf86406d8dcb5f68a8ae20b6f67fd5c [1,1,0,0,0,0|1,0,1]=4 393 B9R1.12 O=CCNc1cncs1 5f5a2584eb4c060b08c3c591786f1ea1 [1,1,0,0,0,0|0,0,2]=4 394 B9R1.12 O=CNCc1cncs1 20afedbba0f28c6c3d07abf84cac939f [1,1,0,0,0,0|0,0,2]=4 395 B9R1.12 OCCNc1c[nH]cn1 6bbb7b84fc258f74f81697f9e606085b [1,1,0,0,0,0|1,0,1]=4 396 B9R1.12 OCCNc1ccco1 133a22307e236e8d6e7724cd612f28fd [1,1,0,0,0,0|1,1,0]=4 397 B9R1.12 OCCNc1cccs1 2ba78ef34c75ea3069c9d7a18a33b4b5 [1,1,0,0,0,0|1,0,0]=3 398 B9R1.12 OCCNc1ccno1 f9d4a2c229db87b9a999f7bc1ae8173c [1,1,0,0,0,0|2,0,0]=4 399 B9R1.12 OCCNc1ccns1 94ecdd8d4c31792c77fe23ccc3ac57df [1,1,0,0,0,0|2,0,0]=4 400 B9R1.12 OCCNc1ccoc1 57b3dbe9a8463690570ac98cb9dbd904 [1,1,0,0,0,0|2,0,0]=4 401 B9R1.12 OCCNc1ccsc1 0f9832f0a4c7ccbac5bb22dfab5dcad2 [1,1,0,0,0,0|2,0,0]=4 402 B9R1.12 OCCNc1cn[nH]c1 00664d2153f8feeac8be898222b8c36e [1,1,0,0,0,0|2,0,0]=4 403 B9R1.12 OCCNc1cncs1 8d778bef0f6f8b54315efeb996bc566e [1,1,0,0,0,0|0,0,0]=2 404 B9R1.12 OCCNc1cnns1 338bbeefa89945b5f29da9c948ad0f79 [1,1,0,0,0,0|1,0,0]=3 405 B9R1.12 OCCNc1cnoc1 21a2cca80ab3b519013ea558cc5f53fd [1,1,0,0,0,0|2,0,0]=4 406 B9R1.12 OCCNc1cnon1 1650f1950f449a33c8c03ec638bd79d6 [1,1,0,0,0,0|2,0,0]=4 407 B9R1.12 OCCNc1cnsc1 c57c33704840e3bb0662a89a65173ebf [1,1,0,0,0,0|2,0,0]=4 408 B9R1.12 OCCNc1cocn1 53f1a08e03b0c5dc1d44b11951086402 [1,1,0,0,0,0|2,0,0]=4 409 B9R1.12 OCCNc1cscn1 7621abb92b5880bf9a85fff3da9e8ad1 [1,1,0,0,0,0|2,0,0]=4 410 B9R1.12 OCCNc1nccs1 97ef5b568316a3301eb9dffbc2fa937a [1,1,0,0,0,0|2,0,0]=4 411 B9R1.12 OCCNc1ncns1 4f1785a0888137c7db46610fc38ec0e4 [1,1,0,0,0,0|2,0,0]=4 412 B9R1.12 OCCNc1nnco1 2b9dff29f94d208bafe82398e5c71cf6 [1,1,0,0,0,0|1,1,0]=4 413 B9R1.12 OCCNc1nncs1 a718e41c726d100809d68e07b7eda617 [1,1,0,0,0,0|1,0,0]=3 414 B9R1.12 OCCNc1nnns1 997b622c4973cfa5e73d1eea9e4f0bf4 [1,1,0,0,0,0|2,0,0]=4 415 B9R1.12 OCNCc1cc[nH]c1 f5a137e18f15de138541ca934254f440 [1,1,0,0,0,0|1,0,1]=4 416 B9R1.12 OCNCc1ccc[nH]1 b011ce93b48fe889bae376897837b402 [1,1,0,0,0,0|2,0,0]=4 417 B9R1.12 OCNCc1ccco1 65cac21f3029c35a0c20d324fb578c01 [1,1,0,0,0,0|1,1,0]=4 418 B9R1.12 OCNCc1cccs1 2d672a9efcaba2b89f20e3b8a4fffaa8 [1,1,0,0,0,0|1,0,0]=3 419 B9R1.12 OCNCc1ccn[nH]1 4f644eaa1c198c0d47e157b2251dd9df [1,1,0,0,0,0|2,0,0]=4 420 B9R1.12 OCNCc1ccno1 5ee1390985394a1ac47e98b34aaa079d [1,1,0,0,0,0|2,0,0]=4 421 B9R1.12 OCNCc1ccns1 02f2c7810f1c3e540cfce6395bda8c6e [1,1,0,0,0,0|2,0,0]=4 422 B9R1.12 OCNCc1ccoc1 9c7027d5d74585d7a26015dc4962abeb [1,1,0,0,0,0|2,0,0]=4 423 B9R1.12 OCNCc1ccsc1 e98282527dce2dcf482e445dc6ab3297 [1,1,0,0,0,0|2,0,0]=4 424 B9R1.12 OCNCc1cn[nH]c1 880838e3a5f427d757ee9ee8e0822947 [1,1,0,0,0,0|2,0,0]=4 425 B9R1.12 OCNCc1cnco1 ff41cd25219a84912d0d2df0441c6a9f [1,1,0,0,0,0|0,1,0]=3 426 B9R1.12 OCNCc1cncs1 7e0889ebf2097242016deaebafe8acfa [1,1,0,0,0,0|0,0,0]=2 427 B9R1.12 OCNCc1cnoc1 e19c60b8c4dc93b35185c19ce79542a3 [1,1,0,0,0,0|2,0,0]=4 428 B9R1.12 OCNCc1cnsc1 571383838b3773f7d614793401dd2282 [1,1,0,0,0,0|2,0,0]=4 429 B9R1.12 OCNCc1cocn1 62065bc3c4e6fec9b8a9661dcdc38734 [1,1,0,0,0,0|2,0,0]=4 430 B9R1.12 OCNCc1cscn1 c4e4a0e9b088904696061154b9ed9b67 [1,1,0,0,0,0|2,0,0]=4 431 B9R1.12 OCNCc1nccs1 11e087dc3a42e81fae34a358a44fd79d [1,1,0,0,0,0|2,0,0]=4 432 B9R1.12 OCNCc1ncn[nH]1 62464763f599f1fbff904fedf2c2904c [1,1,0,0,0,0|2,0,0]=4 433 B9R1.12 SCCNc1cccs1 8a17ff5b35bec33fda4ea52f977bd5ac [1,1,0,0,0,0|1,1,0]=4 434 B9R1.12 SCCNc1cncs1 57506bc644f03c6ed82e786fef9c6476 [1,1,0,0,0,0|0,1,0]=3 435 B9R1.12 SCCNc1cnns1 92e3870c6911877538ebe11e8e926a68 [1,1,0,0,0,0|1,1,0]=4 436 B9R1.12 SCCNc1nncs1 90715abc84f8499af1a395659889a5c4 [1,1,0,0,0,0|1,1,0]=4 437 B9R1.12 SCCOc1cccs1 76d2470c19021421703a4592f24d10d6 [1,1,0,0,0,0|1,1,0]=4 438 B9R1.12 SCCOc1nncs1 3b537034d03ab87f7550415bc5f344a5 [1,1,0,0,0,0|1,1,0]=4 439 B9R1.13 CC(C)Nc1cncs1 52121261cabe3794162f74d6b81b293a [1,1,0,0,0,0|2,0,0]=4 440 B11R1.13 Cc1c(ccnc1Br)NCO 8e0bd9b7c58cf709e96ceffa5ecdb02f [0,1,0,0,0,1|2,0,0]=4 441 B11R1.13 Cc1c(ccnc1Cl)NCO d757ec579640102f04a0bc58dbb4286c [0,1,0,0,0,1|2,0,0]=4 442 B11R1.13 Cc1c(ccnc1F)NCO 68d6c30ce6692af2a149c8355f82d0a0 [0,1,0,0,0,1|2,0,0]=4 443 B11R1.13 Cc1c(ncnc1NCO)Cl 46edc84fcbb1a0f664cc426c927c29db [0,1,0,0,0,1|2,0,0]=4 444 B11R1.13 Cc1c(ncnc1NCO)F 42c76841ef6052a0b98352df6da5b1d6 [0,1,0,0,0,1|2,0,0]=4 445 B11R1.13 Cc1nccc(c1C)NCO b5eef1f688f537c13e56415784cdca18 [0,1,0,0,0,1|2,0,0]=4 446 B11R1.13 Cc1ncnc(c1C)NCO 28a407d8d7d3e2b10f3b02211bcca0ab [0,1,0,0,0,1|2,0,0]=4 447 B11R1.17 CCCNc1cccnc1C 22a2471d4061d7e8b2734dc78b59847f [0,1,0,0,0,1|2,0,0]=4 448 B11R1.17 CCCNc1ccncc1C ed096cc09ac09389a33110eb02659afe [0,1,0,0,0,1|2,0,0]=4 449 B11R1.17 CCCNc1ccnnc1C e249c84e7ea7f04f5c898532ed4d6203 [0,1,0,0,0,1|2,0,0]=4 450 B11R1.17 CCCNc1cncnc1C 706089b7ad1c15054146037bf73522dc [0,1,0,0,0,1|2,0,0]=4 451 B11R1.17 CCCNc1nccnc1C 7959f3a041ff51b3c70e5e598f2f50d9 [0,1,0,0,0,1|2,0,0]=4 452 B11R1.17 CCCNc1ncncc1C c39d1566d97133b153fe318962c5d196 [0,1,0,0,0,1|2,0,0]=4 453 B11R1.17 CCCOc1cccnc1C 1ed437f8fbe2f5e0b870ba84e31d17c0 [0,1,0,0,0,1|2,0,0]=4 454 B11R1.17 CCCOc1ccncc1C 3073b76d6073e61bbeb487a8fcbb554b [0,1,0,0,0,1|2,0,0]=4 455 B11R1.17 CCCOc1cncnc1C 08df783e8dbed335e989f2618299e671 [0,1,0,0,0,1|2,0,0]=4 456 B11R1.17 CCCOc1nccnc1C 0b16d5dccf3e1318f521652f165dafab [0,1,0,0,0,1|2,0,0]=4 457 B11R1.17 CCCOc1ncncc1C d6c9a597c3b3261675984146b270ba14 [0,1,0,0,0,1|2,0,0]=4 458 B11R1.17 CCNCc1cccnc1C 0a1b3485e2e73031e3e3fc0c87c75e22 [0,1,0,0,0,1|2,0,0]=4 459 B11R1.17 CCNCc1ccncc1C 959f5887b5695b7da0c1d9119cd1d02d [0,1,0,0,0,1|2,0,0]=4 460 B11R1.17 CCOCc1cccnc1C 10fe290309f01ddd76b919ada33fcfb8 [0,1,0,0,0,1|2,0,0]=4 461 B11R1.17 CCOCc1ccncc1C c2e03a76229a18838878f9a03032e5ea [0,1,0,0,0,1|2,0,0]=4 462 B11R1.17 CCOCc1ccnnc1C c56ffc0a29a1113f0a0c29537ec1c0f2 [0,1,0,0,0,1|2,0,0]=4 463 B11R1.17 CCOCc1nccnc1C 47c62f7c04b33077f76d36a56e394ddf [0,1,0,0,0,1|2,0,0]=4 464 B11R1.17 COCNc1cccnc1C 6b682e80c911fe37c9c071bed81835e1 [0,1,0,0,0,1|2,0,0]=4 465 B11R1.17 COCNc1ccncc1C 9c3be265a857f8bfbebb531da24465f9 [0,1,0,0,0,1|2,0,0]=4 466 B11R1.17 COCNc1ccnnc1C 17fe860fb7146413075fb32b8f4db92d [0,1,0,0,0,1|2,0,0]=4 467 B11R1.17 COCNc1cncnc1C 0ea008dacc6527ce762e34b08305052e [0,1,0,0,0,1|2,0,0]=4 468 B11R1.17 COCNc1nccnc1C f7a21258816bfef448bfb97023f7df6f [0,1,0,0,0,1|2,0,0]=4 469 B11R1.17 COCNc1ncncc1C 38ee36d2ac94543403fda0d164b95f21 [0,1,0,0,0,1|2,0,0]=4 470 B11R1.17 COCOc1cccnc1C ec22ad41ed163d24a1597dbeb8a4a6ff [0,1,0,0,0,1|2,0,0]=4 471 B11R1.17 COCOc1ccncc1C edee7c0be535f1c77b9bbbf7fe881c62 [0,1,0,0,0,1|2,0,0]=4 472 B11R1.17 COCOc1cncnc1C 7e1251670ec58b5ea55039014ad37716 [0,1,0,0,0,1|2,0,0]=4 473 B11R1.17 COCOc1nccnc1C 36aac378352b0c12566f983bf9b4e4ce [0,1,0,0,0,1|2,0,0]=4 474 B11R1.17 COCOc1ncncc1C d2ebe371d23f1c6249db69ef7122c33a [0,1,0,0,0,1|2,0,0]=4 475 B11R1.17 Cc1ccccc1CNCO f33352c0e02ea4b4ea9a0720598f200e [0,1,0,0,0,1|2,0,0]=4 476 B11R1.17 Cc1ccccc1NCCO 5035e646db6f3a444835335ac8083c14 [0,1,0,0,0,1|2,0,0]=4 477 B11R1.17 Cc1cccnc1CNCO 30441c00bc8726da80cd698c0c87c74c [0,1,0,0,0,1|2,0,0]=4 478 B11R1.17 Cc1cccnc1NCCO 478e63720a6f78f7fa3d3c8fa6de1dc4 [0,1,0,0,0,1|2,0,0]=4 479 B11R1.17 Cc1ccncc1CNCO 8820a85b37c3e4693661ff6b2f5470a7 [0,1,0,0,0,1|2,0,0]=4 480 B11R1.17 Cc1ccncc1NCCO 71303c497b4f37f3acd74a0343a0436a [0,1,0,0,0,1|2,0,0]=4 481 B11R1.17 Cc1ccnnc1CNCO 3e0ea6ea3eecd15401d0ea825c17e967 [0,1,0,0,0,1|2,0,0]=4 482 B11R1.17 Cc1ccnnc1NCCO 9355bc05ecca1e731178eec29eae94c1 [0,1,0,0,0,1|2,0,0]=4 483 B11R1.17 Cc1cnccc1CNCF 41618b823bf47a72d876d2d565d2e2e8 [0,1,0,0,0,1|2,0,0]=4 484 B11R1.17 Cc1cnccc1CNCO f46edf824f8d525036629a5904a74512 [0,1,0,0,0,1|1,0,0]=3 485 B11R1.17 Cc1cnccc1COCF f999801730ba8a2525e52378579e076f [0,1,0,0,0,1|2,0,0]=4 486 B11R1.17 Cc1cnccc1NCCF e216285f6128b168ce549d3af76aeece [0,1,0,0,0,1|2,0,0]=4 487 B11R1.17 Cc1cnccc1NCCO 0a487d14b9965ddf673112095ea27432 [0,1,0,0,0,1|1,0,0]=3 488 B11R1.17 Cc1cnccc1NCCS 1b5c9e3146854d4ce3d8b9b51d3d45f3 [0,1,0,0,0,1|1,1,0]=4 489 B11R1.17 Cc1cnccc1OCCF dcd1c4a13b877382c727c4e87a30bd84 [0,1,0,0,0,1|2,0,0]=4 490 B11R1.17 Cc1cnccc1OCCS 2b62f67ec9564ce543a9097c3acd66f4 [0,1,0,0,0,1|1,1,0]=4 491 B11R1.17 Cc1cncnc1NCCF aaf8e9f159268e4b5c01da56fbca1b8c [0,1,0,0,0,1|2,0,0]=4 492 B11R1.17 Cc1cncnc1NCCO 67dceabf03539bf31b079f316e40daf8 [0,1,0,0,0,1|1,0,0]=3 493 B11R1.17 Cc1cncnc1NCCS d1b67b73c9a7a0b425ca28e586c597e2 [0,1,0,0,0,1|1,1,0]=4 494 B11R1.17 Cc1cncnc1OCCF c73145c4a858a656ec15051c8fbf30ff [0,1,0,0,0,1|2,0,0]=4 495 B11R1.17 Cc1cncnc1OCCS 1b55efcf14109f142d9a7fbd3f4e32b0 [0,1,0,0,0,1|1,1,0]=4 496 B11R1.17 Cc1ncccc1CNCF 42120e4e220f799847279a84e94cfdbc [0,1,0,0,0,1|2,0,0]=4 497 B11R1.17 Cc1ncccc1CNCO ebac33228c10df30635cfd2541d72802 [0,1,0,0,0,1|1,0,0]=3 498 B11R1.17 Cc1ncccc1COCF 46ede525f55173cd145969e403185011 [0,1,0,0,0,1|2,0,0]=4 499 B11R1.17 Cc1ncccc1NCCF 9c2f8d2321a295a109e1aa76cb8ce55a [0,1,0,0,0,1|2,0,0]=4 500 B11R1.17 Cc1ncccc1NCCO ab9708ed7eee969d0130cff840722f62 [0,1,0,0,0,1|1,0,0]=3 501 B11R1.17 Cc1ncccc1NCCS 50f8f955ec73f64bd1f215b873f4222e [0,1,0,0,0,1|1,1,0]=4 502 B11R1.17 Cc1ncccc1OCCF 5b73715426081cbea599efa1da7ddb58 [0,1,0,0,0,1|2,0,0]=4 503 B11R1.17 Cc1ncccc1OCCS 00c7b154e3d7df917df7504ccc99990a [0,1,0,0,0,1|1,1,0]=4 504 B11R1.17 Cc1nccnc1COCF e38786363e40b0491bc2a209c6e78704 [0,1,0,0,0,1|2,0,0]=4 505 B11R1.17 Cc1nccnc1NCCF 8d2e9c2f4c0063d9bf02367ce15c7c4c [0,1,0,0,0,1|2,0,0]=4 506 B11R1.17 Cc1nccnc1NCCO d0ad8d72f79faf6fcc5be3bb779c12c3 [0,1,0,0,0,1|1,0,0]=3 507 B11R1.17 Cc1nccnc1NCCS 4357054951ca4e2125dfb5ab67f126b1 [0,1,0,0,0,1|1,1,0]=4 508 B11R1.17 Cc1nccnc1OCCF 0ced02cb053d97e019ccbdfa3447d9a4 [0,1,0,0,0,1|2,0,0]=4 509 B11R1.17 Cc1nccnc1OCCS fa15d6d156c64b9df3fac7dd58d19b44 [0,1,0,0,0,1|1,1,0]=4 510 B11R1.17 Cc1ncncc1NCCF 0b924ca69e7beef3bd8eb488ff749630 [0,1,0,0,0,1|2,0,0]=4 511 B11R1.17 Cc1ncncc1NCCO 455adc7c4fd36cf47cf6544478c6fbc9 [0,1,0,0,0,1|1,0,0]=3 512 B11R1.17 Cc1ncncc1NCCS 1fda58a173f22e28af12590ec45e92aa [0,1,0,0,0,1|1,1,0]=4 513 B11R1.17 Cc1ncncc1OCCF 966be9daedc050562b41dcb24c0420b8 [0,1,0,0,0,1|2,0,0]=4 514 B11R1.17 Cc1ncncc1OCCS a925784f6b90aa7a43400e3d4abcc7ce [0,1,0,0,0,1|1,1,0]=4 515 B11R1.17 Cc1nnccc1COCF 99284aa3f5e160479c405f37e150c06d [0,1,0,0,0,1|2,0,0]=4 516 B11R1.17 Cc1nnccc1NCCF adc376f34f13bc275d84f9bd237bc9f2 [0,1,0,0,0,1|2,0,0]=4 517 B11R1.17 Cc1nnccc1NCCO 619582f15720ca97e46ad4630268cb7c [0,1,0,0,0,1|1,0,0]=3 518 B11R1.17 Cc1nnccc1NCCS 053c5ae2a9c870fa00885edf51d9d99e [0,1,0,0,0,1|1,1,0]=4 519 B11R1.17 O=c1[nH]nccc1NCCO d948b8aedc2f71f7ff1be5eddb426c5a [0,1,0,0,0,1|2,0,0]=4 520 B11R1.17 O=c1nc[nH]cc1NCCO 30b17437fa64233b5ccbc09183c864da [0,1,0,0,0,1|2,0,0]=4 521 B11R1.17 OCCNc1cccnc1Br 632fae30d029a1c8ef0a9e6f61a983a9 [0,1,0,0,0,1|2,0,0]=4 522 B11R1.17 OCCNc1cccnc1Cl 4e43b583e8ff101b60a4e7e9502f1ee3 [0,1,0,0,0,1|2,0,0]=4 523 B11R1.17 OCCNc1cccnc1F 491a8db0e71e9cf9b49f5b0b7b046e39 [0,1,0,0,0,1|2,0,0]=4 524 B11R1.17 OCCNc1cccnc1I 7a6f746233f4e6bd5fec2cf961b376a4 [0,1,0,0,0,1|2,0,0]=4 525 B11R1.17 OCCNc1ccn[nH]c1=S 142a9a64eeec283417efa41b7bb92846 [0,1,0,0,0,1|2,0,0]=4 526 B11R1.17 OCCNc1ccncc1Br 2211ba876dd3a8159d70bed4d722d56b [0,1,0,0,0,1|2,0,0]=4 527 B11R1.17 OCCNc1ccncc1Cl 60c6f2518e071d1ae0e5a82422510783 [0,1,0,0,0,1|2,0,0]=4 528 B11R1.17 OCCNc1ccncc1F ef4e40a51c04130c9155c74dbf9133e9 [0,1,0,0,0,1|2,0,0]=4 529 B11R1.17 OCCNc1ccncc1I a2a0550d234a33f36a2beb202155df7a [0,1,0,0,0,1|2,0,0]=4 530 B11R1.17 OCCNc1ccnnc1Br 798cdd27e92d36220fac1543df011285 [0,1,0,0,0,1|2,0,0]=4 531 B11R1.17 OCCNc1ccnnc1Cl 03f9a216b270cb42b84fce40345f50d4 [0,1,0,0,0,1|2,0,0]=4 532 B11R1.17 OCCNc1cncnc1Br 8cea0fad48f010c05718152d4642b9a9 [0,1,0,0,0,1|2,0,0]=4 533 B11R1.17 OCCNc1cncnc1Cl 4b56a0132e0b2075774fb068242c6866 [0,1,0,0,0,1|2,0,0]=4 534 B11R1.17 OCCNc1nccnc1Br 0455803b690a11861704b627f2353598 [0,1,0,0,0,1|2,0,0]=4 535 B11R1.17 OCCNc1nccnc1Cl 18f94bea143288632f56cac0e4c600b7 [0,1,0,0,0,1|2,0,0]=4 536 B11R1.17 OCCNc1nccnc1I bdec6eb3ba7717537d84202488b38217 [0,1,0,0,0,1|2,0,0]=4 537 B11R1.17 OCCNc1ncncc1Br bc8ede54c4de68ffd6dbba0c59542186 [0,1,0,0,0,1|2,0,0]=4 538 B11R1.17 OCCNc1ncncc1Cl 6d126eae993ed6f41ea8df8159510c03 [0,1,0,0,0,1|2,0,0]=4 539 B11R1.17 OCCNc1ncncc1F 7ce1e43008b8f38deab630afa1d5aa52 [0,1,0,0,0,1|2,0,0]=4 540 B11R1.17 OCCNc1ncncc1I 7c5f1739c59467897979e84e7b620cc0 [0,1,0,0,0,1|2,0,0]=4 541 B11R1.17 OCNCc1cccnc1Br fa04fbdfe2ab7ab585c87e8888997fde [0,1,0,0,0,1|2,0,0]=4 542 B11R1.17 OCNCc1cccnc1Cl e098226076d1bf05b07c0db61b1608b0 [0,1,0,0,0,1|2,0,0]=4 543 B11R1.17 OCNCc1cccnc1F becc02815a15c17406558b70fdb845a8 [0,1,0,0,0,1|2,0,0]=4 544 B11R1.17 OCNCc1ccncc1Br 217383617b17a78941bd521a0c40dae7 [0,1,0,0,0,1|2,0,0]=4 545 B11R1.17 OCNCc1ccncc1Cl 6d17554379bde9c33e92fb7fd7d0b9f9 [0,1,0,0,0,1|2,0,0]=4 546 B11R1.17 OCNCc1ccncc1F aa8afb20a67cbc48484f103b5e2b4346 [0,1,0,0,0,1|2,0,0]=4 547 B11R1.17 OCNCc1nccnc1Cl 7234e46201f4bc12b5f2f81c58b16ce3 [0,1,0,0,0,1|2,0,0]=4 548 B11R1.41 CCc1ncccc1NCO 8def9462b4d3408652c8d04c365636b2 [0,1,0,0,0,1|2,0,0]=4 549 B11R1.41 CCc1nccnc1NCO 2ac635d3f17a2c0c22976fdb1330769b [0,1,0,0,0,1|2,0,0]=4 550 B11R1.41 COc1cnccc1NCO ae2fd4619a5595053a51a322bfcb8cf1 [0,1,0,0,0,1|2,0,0]=4 551 B11R1.41 COc1cncnc1NCO 1548bb6ac38137fed5b5c463499ddf9f [0,1,0,0,0,1|2,0,0]=4 552 B11R1.41 COc1ncccc1NCO ef5fe630a16e11fd0b5a7f2f24f2ad4a [0,1,0,0,0,1|2,0,0]=4 553 B11R1.41 COc1nccnc1NCO 4679584531f3e420c46cede4443d9182 [0,1,0,0,0,1|2,0,0]=4 554 B11R1.41 COc1ncncc1NCO 217ddce5e39324ba1b27875742ff5fd5 [0,1,0,0,0,1|2,0,0]=4 555 B11R1.41 COc1nnccc1NCO 6ac10408415e84f466dcf31e3fda9ac5 [0,1,0,0,0,1|2,0,0]=4 556 B11R1.41 CSc1cnccc1NCO e318f34706f0e2249ddb4ce3fa077664 [0,1,0,0,0,1|2,0,0]=4 557 B11R1.41 OCNc1cccnc1CCl 362b7b0a0719f5da1df4a6cbe0274d59 [0,1,0,0,0,1|2,0,0]=4 558 B11R1.41 OCNc1cccnc1CO 37074b2f0d149ac3ec159a61482bea08 [0,1,0,0,0,1|2,0,0]=4 559 B11R1.41 OCNc1ccncc1CO 4a8059095aabbe898ce350ca330b7d98 [0,1,0,0,0,1|2,0,0]=4 560 B11R1.41 OCNc1nccnc1CO 41e786d7fc5e3d1c90268722c5ac1f17 [0,1,0,0,0,1|2,0,0]=4 561 B11R1.41 OCNc1ncncc1CO c18e20dc039475281ac9724025cc6f4d [0,1,0,0,0,1|2,0,0]=4 562 B11R1.81 Cc1ccc(c(n1)C)NCO 11670c719c5571336c861d0954476d55 [0,1,0,0,0,1|2,0,0]=4 563 B11R1.81 Cc1cnc(c(n1)C)NCO d35260c9db238060a7218e4fc5db02b7 [0,1,0,0,0,1|2,0,0]=4 564 B11R1.81 Cc1nc(ccc1NCO)Br f2f5076b202d3b06a2b14c968ccb5bf8 [0,1,0,0,0,1|2,0,0]=4 565 B11R1.81 Cc1nc(ccc1NCO)Cl e4eb153f9ed3f6b4ef74564811bce220 [0,1,0,0,0,1|2,0,0]=4 566 B11R1.81 Cc1nc(ccc1NCO)F d836aafa4084b94b343aa6df63a9353e [0,1,0,0,0,1|2,0,0]=4 567 B11R1.81 Cc1nc(cnc1NCO)Br 6b7597367c39cd7e4f8060bb0f762928 [0,1,0,0,0,1|2,0,0]=4 568 B11R1.81 Cc1nc(cnc1NCO)Cl 8e8c1456cad4fdd700e44f5f0abb6265 [0,1,0,0,0,1|2,0,0]=4 569 B11R1.81 Cc1nc(cnc1NCO)I f64108c255fcd93470fd41ec4ab3327a [0,1,0,0,0,1|2,0,0]=4 570 B11R1.81 Cc1nc(ncc1NCO)Br 0937c8bca1fe04e1497b44705a32032f [0,1,0,0,0,1|2,0,0]=4 571 B11R1.81 Cc1nc(ncc1NCO)Cl f364ab975d3ce674391eb505b5f7175f [0,1,0,0,0,1|2,0,0]=4 572 B11R1.81 Cc1ncc(c(n1)C)NCO 8d4477963c17c47b73b4ddcced6c62f3 [0,1,0,0,0,1|2,0,0]=4 573 B11R1.182 Cc1cnc(c(c1)NCO)C 1fa7fa269cc131e60c1c45a488582948 [0,1,0,0,0,1|2,0,0]=4 574 B11R1.182 Cc1cnc(c(n1)NCO)C e2b171a5923ab1648d6a74a9ce03d478 [0,1,0,0,0,1|2,0,0]=4 575 B11R1.182 Cc1cnc(cc1NCO)Br 5b699a167ff91156e8d4d49b85af1b91 [0,1,0,0,0,1|2,0,0]=4 576 B11R1.182 Cc1cnc(cc1NCO)Cl 29102a1e863d5f7c31153dd2048a5396 [0,1,0,0,0,1|2,0,0]=4 577 B11R1.182 Cc1cnc(cc1NCO)F 0ab35f3c6b1d1b477b6ceea8ca9896af [0,1,0,0,0,1|2,0,0]=4 578 B11R1.182 Cc1cnc(nc1NCO)Br 5a6048979c4b65bec47bfbe227bc559e [0,1,0,0,0,1|2,0,0]=4 579 B11R1.182 Cc1cnc(nc1NCO)Cl 8ee980564cf2692f367fd589f24bbfe7 [0,1,0,0,0,1|2,0,0]=4 580 B11R1.182 Cc1n[nH]c(=O)nc1NCO ebc61fe1a244e25510e482c0d873727d [0,1,0,0,0,1|2,0,0]=4 581 B11R1.182 Cc1ncc(c(n1)NCO)C 2f145b7a4f093387c489160fae0fb834 [0,1,0,0,0,1|2,0,0]=4 582 B11R1.182 Cc1ncc(cc1NCO)Br f73b354a108fee72a8e23ed017ff6e15 [0,1,0,0,0,1|2,0,0]=4 583 B11R1.182 Cc1ncc(cc1NCO)Cl 96a69f2024de909294090f53152b3a84 [0,1,0,0,0,1|2,0,0]=4 584 B11R1.182 Cc1ncc(cc1NCO)F c8b9f8b2f578689d07e45d31b8092606 [0,1,0,0,0,1|2,0,0]=4 585 B11R1.182 Cc1ncc(nc1NCO)Cl 60b87d2f022d7018e4b443bfc697b413 [0,1,0,0,0,1|2,0,0]=4 586 B11R1.182 Cc1nnc(cc1NCO)Cl 81f8be0193af3bbbe4a37dd1faae52de [0,1,0,0,0,1|2,0,0]=4 587 B11R1.222 Cc1ncccc1N(C)CO a6cff45c2e0229235d921297d1fe2795 [0,1,0,0,0,1|2,0,0]=4 588 B11R1.222 Cc1nccnc1N(C)CO f1e1ceafafa3cb3a2476908de66105b7 [0,1,0,0,0,1|2,0,0]=4 589 B11R1.605 Cc1ccnc(c1NCO)C f0d019b65e653e51f3c7e50e832f0403 [0,1,0,0,0,1|2,0,0]=4 590 B11R1.605 Cc1cncc(c1NCO)Br 0944efc7b4b1d5765b77a0bd93ffd6cc [0,1,0,0,0,1|2,0,0]=4 591 B11R1.605 Cc1cncc(c1NCO)C 8c5dbfa67300ec62c4c85a3ba2949447 [0,1,0,0,0,1|2,0,0]=4 592 B11R1.605 Cc1cncc(c1NCO)Cl 646d3afd1a6d9a391ddf978b6db7b303 [0,1,0,0,0,1|2,0,0]=4 593 B11R1.605 Cc1cncc(c1NCO)F c13ac964d0b1c9506f9a7059b20ccc98 [0,1,0,0,0,1|2,0,0]=4 594 B11R1.605 Cc1cncc(c1NCO)I 7612a9fa7a97ba8faa98549ea745122b [0,1,0,0,0,1|2,0,0]=4 595 B11R1.605 Cc1nc[nH]c(=O)c1NCO cec89f2abdbfd3147f47a024a623f8e3 [0,1,0,0,0,1|2,0,0]=4 596 B11R1.605 Cc1nccc(c1NCO)Br 6227414f6e8b744c75b96c01ed81e5c5 [0,1,0,0,0,1|2,0,0]=4 597 B11R1.605 Cc1nccc(c1NCO)Cl 1559222875086b2458fc8574688e98c3 [0,1,0,0,0,1|2,0,0]=4 598 B11R1.605 Cc1ncnc(c1NCO)C bea00e309901836e538443b8c0990190 [0,1,0,0,0,1|2,0,0]=4 599 B11R1.605 Cc1ncnc(c1NCO)Cl eb84d58f63cab7a643ab4be16cf8790e [0,1,0,0,0,1|2,0,0]=4 600 B11R1.24 CCCNc1cc(ncn1)C 87347225ae278d70f2d6167b359700d6 [0,1,0,0,0,1|2,0,0]=4 601 B11R1.24 CCCNc1ccnc(c1)C b66f498b52f5cbd7e72f509e0a6f41be [0,1,0,0,0,1|2,0,0]=4 602 B11R1.24 CCCNc1ccnc(n1)C 3aba40c76e38d5e5b178926b1611aad5 [0,1,0,0,0,1|2,0,0]=4 603 B11R1.24 CCCOc1cc(ncn1)C 600e497facc27cc106f73273f78d6b5d [0,1,0,0,0,1|2,0,0]=4 604 B11R1.24 CCCOc1ccnc(c1)C fb2ea1b15a9dd2b3d4e9dfb65ec1523f [0,1,0,0,0,1|2,0,0]=4 605 B11R1.24 CCCOc1ccnc(n1)C 2daef3bcca61affddd659cb8093de78c [0,1,0,0,0,1|2,0,0]=4 606 B11R1.24 CCNCc1ccnc(c1)C 7d2184712237385ae4b34f01a3fd0b0c [0,1,0,0,0,1|2,0,0]=4 607 B11R1.24 CCNCc1ccnc(n1)C 0f8f456432ce41f11e5f9f5897bc38f3 [0,1,0,0,0,1|2,0,0]=4 608 B11R1.24 CCOCc1cc(ncn1)C 75d27a4d886a004f6162bae5e71bd31f [0,1,0,0,0,1|2,0,0]=4 609 B11R1.24 CCOCc1ccnc(c1)C d26a680f89e28ac8a7fa03bb8fe9903c [0,1,0,0,0,1|2,0,0]=4 610 B11R1.24 CCOCc1ccnc(n1)C 677d8c08e328514263ff0ac51349ebac [0,1,0,0,0,1|2,0,0]=4 611 B11R1.24 COCNc1cc(ncn1)C 6d318f84b920bdb6372df23391036da4 [0,1,0,0,0,1|2,0,0]=4 612 B11R1.24 COCNc1ccnc(c1)C 1811146363430dd89ec6b80f6a37da8c [0,1,0,0,0,1|2,0,0]=4 613 B11R1.24 COCNc1ccnc(n1)C 845dfe85ae41d7a2853cb269cf8cd45e [0,1,0,0,0,1|2,0,0]=4 614 B11R1.24 COCOc1cc(ncn1)C 17f2756091c952f5c526bea2f69cbd53 [0,1,0,0,0,1|2,0,0]=4 615 B11R1.24 COCOc1ccnc(c1)C d896b3ff0683e270a34b09cd84bf786f [0,1,0,0,0,1|2,0,0]=4 616 B11R1.24 COCOc1ccnc(n1)C fe4444303d1c57660c8ffd6866ec67cb [0,1,0,0,0,1|2,0,0]=4 617 B11R1.24 Cc1cc(ccn1)CNCF 84efdf8898b3954d41c47b5aecfaa510 [0,1,0,0,0,1|2,0,0]=4 618 B11R1.24 Cc1cc(ccn1)CNCO 220fd9dc96cf7acc9670e8e8f858e714 [0,1,0,0,0,1|1,0,0]=3 619 B11R1.24 Cc1cc(ccn1)COCF 3d6c010790e9d96177af19abcae2e406 [0,1,0,0,0,1|2,0,0]=4 620 B11R1.24 Cc1cc(ccn1)NCCF c13f3fdecb0cdb6a61678f34d10f98bd [0,1,0,0,0,1|2,0,0]=4 621 B11R1.24 Cc1cc(ccn1)NCCO 4b5fda830696a55c8dc770d11c7ac6ab [0,1,0,0,0,1|1,0,0]=3 622 B11R1.24 Cc1cc(ccn1)NCCS 24992d02f4a6e6e5f417047d0c49a1d6 [0,1,0,0,0,1|1,1,0]=4 623 B11R1.24 Cc1cc(ccn1)OCCF b34f8ae3deb40598cbdf9e83af8cff08 [0,1,0,0,0,1|2,0,0]=4 624 B11R1.24 Cc1cc(ccn1)OCCS dbd8a64e8f435225d1693abc86fd741b [0,1,0,0,0,1|1,1,0]=4 625 B11R1.24 Cc1cc(ncn1)COCF 354bea39cf8837bd4d9569d0ba88db6a [0,1,0,0,0,1|2,0,0]=4 626 B11R1.24 Cc1cc(ncn1)NCCF da95f7d7a10b6129fbaf6afff0fe663f [0,1,0,0,0,1|2,0,0]=4 627 B11R1.24 Cc1cc(ncn1)NCCO fc64001e0a2607d3cdc24e07472c4a44 [0,1,0,0,0,1|1,0,0]=3 628 B11R1.24 Cc1cc(ncn1)NCCS 6cbc043dac1e1fa25722f2125874f4f3 [0,1,0,0,0,1|1,1,0]=4 629 B11R1.24 Cc1cc(ncn1)OCCF 282cbd08643277a25b889d4ad2ca8bed [0,1,0,0,0,1|2,0,0]=4 630 B11R1.24 Cc1cc(ncn1)OCCS 7d6091fcf61f7138b626123287efb372 [0,1,0,0,0,1|1,1,0]=4 631 B11R1.24 Cc1cccc(c1)CNCO d0a6ec7f4afcd99e7d28be3d4dacede0 [0,1,0,0,0,1|2,0,0]=4 632 B11R1.24 Cc1cccc(c1)NCCO 788520a7b5122ba23efd60ec7af11b62 [0,1,0,0,0,1|2,0,0]=4 633 B11R1.24 Cc1cccc(n1)CNCO fe42a0006039c5b282c8b0832528d029 [0,1,0,0,0,1|2,0,0]=4 634 B11R1.24 Cc1cccc(n1)NCCO 2f6549d226cf28bd97ca9c8eed2ac2de [0,1,0,0,0,1|2,0,0]=4 635 B11R1.24 Cc1ccnc(c1)CNCO 5f13cb4049c3b8923e25988be44c27eb [0,1,0,0,0,1|2,0,0]=4 636 B11R1.24 Cc1ccnc(c1)NCCO 19d12f5117ef4128697081bba6fe0041 [0,1,0,0,0,1|2,0,0]=4 637 B11R1.24 Cc1ccnc(n1)CNCO 119421b39a551f6124f343ad9d4602e7 [0,1,0,0,0,1|2,0,0]=4 638 B11R1.24 Cc1ccnc(n1)NCCO 6bdc0ad255ce1a531995fb2a4f4a3f18 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.24 Cc1nccc(n1)CNCF a9c1f4556dc1d3f42d2857e648d2753d [0,1,0,0,0,1|2,0,0]=4 640 B11R1.24 Cc1nccc(n1)CNCO 87799b1e4ed63c4e75aa37554ab0e812 [0,1,0,0,0,1|1,0,0]=3 641 B11R1.24 Cc1nccc(n1)COCF a2db88671ccc88077db62cece8894da2 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.24 Cc1nccc(n1)NCCF 3906ef4e638d16c6b5cc67dc40e24dfc [0,1,0,0,0,1|2,0,0]=4 643 B11R1.24 Cc1nccc(n1)NCCO 738aadfd5bf9a662ece3a86a1b78b50d [0,1,0,0,0,1|1,0,0]=3 644 B11R1.24 Cc1nccc(n1)NCCS 79445aa126c0301374592152810f1951 [0,1,0,0,0,1|1,1,0]=4 645 B11R1.24 Cc1nccc(n1)OCCF afca05f1a119e2449294e5865931ab30 [0,1,0,0,0,1|2,0,0]=4 646 B11R1.24 Cc1nccc(n1)OCCS 4570f5b6116c9ea5107ebf7ed7ac58b9 [0,1,0,0,0,1|1,1,0]=4 647 B11R1.24 Cc1nncc(n1)NCCO 2b891036c50dadd03bb7877c514e7292 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.24 OCCNc1cc(ncn1)Br 13b85263bf47049753ad06428791cc12 [0,1,0,0,0,1|2,0,0]=4 649 B11R1.24 OCCNc1cc(ncn1)Cl 715f6cfb0e47bf7eaffd8f118476ebdb [0,1,0,0,0,1|2,0,0]=4 650 B11R1.24 OCCNc1cc(ncn1)F 8fb8cd337f1fe6d2e22435beac4cf334 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.24 OCCNc1cc(ncn1)I 1c5d438e386c4071a5065d4ccef16a5f [0,1,0,0,0,1|2,0,0]=4 652 B11R1.24 OCCNc1ccnc(c1)Br b200f0856d5da5e2a16447f55e9aa61a [0,1,0,0,0,1|2,0,0]=4 653 B11R1.24 OCCNc1ccnc(c1)Cl 3ffc831c5d727a7d566cfb2f2129d6e9 [0,1,0,0,0,1|2,0,0]=4 654 B11R1.24 OCCNc1ccnc(c1)F 5ba3ed8dbf00788462e880b9e109daef [0,1,0,0,0,1|2,0,0]=4 655 B11R1.24 OCCNc1ccnc(c1)I 93104159a05486eee76aacf8b07b4419 [0,1,0,0,0,1|2,0,0]=4 656 B11R1.24 OCCNc1ccnc(n1)Br 9d461ceb94dff0f34e52681f6aacd4f6 [0,1,0,0,0,1|2,0,0]=4 657 B11R1.24 OCCNc1ccnc(n1)Cl 16fdcfa62bef8bf69875b2211a281083 [0,1,0,0,0,1|2,0,0]=4 658 B11R1.24 OCCNc1ccnc(n1)F 7e7f9a41222492e023e165c71c5badde [0,1,0,0,0,1|2,0,0]=4 659 B11R1.24 OCCNc1ccnc(n1)S 4c8b98e5c8b658c6c060e21932cd18a8 [0,1,0,0,0,1|2,0,0]=4 660 B11R1.24 OCCNc1ncnc(n1)Cl e30af9794dfa139bfacab9c96713ffa4 [0,1,0,0,0,1|2,0,0]=4 661 B11R1.24 OCNCc1ccnc(c1)Br 3a0e55a9ff73d236d99460783912071e [0,1,0,0,0,1|2,0,0]=4 662 B11R1.24 OCNCc1ccnc(c1)Cl e808e8311876b6a3d48faefd4bc8115e [0,1,0,0,0,1|2,0,0]=4 663 B11R1.24 OCNCc1ccnc(c1)F 5c6920251d116376c180ff91e7c1250a [0,1,0,0,0,1|2,0,0]=4 664 B11R1.34 Cc1cc(cc(n1)Br)NCO 9fe36d1beb891b43d2f271a24ef97c56 [0,1,0,0,0,1|2,0,0]=4 665 B11R1.34 Cc1cc(cc(n1)C)NCO 5380e933f4f38bb7aec6314d9e1abf91 [0,1,0,0,0,1|2,0,0]=4 666 B11R1.34 Cc1cc(cc(n1)Cl)NCO 9f4da53f6a3473da90259413908e5216 [0,1,0,0,0,1|2,0,0]=4 667 B11R1.34 Cc1cc(cc(n1)F)NCO 2db4c1081e0f0e48111def07e305007a [0,1,0,0,0,1|2,0,0]=4 668 B11R1.34 Cc1cc(nc(n1)Br)NCO 7aec0e272a944cc496d4e32486786437 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.34 Cc1cc(nc(n1)C)NCO da1f9808ed1fe81647991e3fbc32044c [0,1,0,0,0,1|2,0,0]=4 670 B11R1.34 Cc1cc(nc(n1)Cl)NCO f34aa53c69b347106bbb12f418093546 [0,1,0,0,0,1|2,0,0]=4 671 B11R1.34 Cc1cc(nc(n1)S)NCO 48a251ec538a81af97741b15f215f44b [0,1,0,0,0,1|2,0,0]=4 672 B11R1.34 Cc1nc(cc(n1)NCO)Br 972dae4217f289a5a367e79d2554f39d [0,1,0,0,0,1|2,0,0]=4 673 B11R1.34 Cc1nc(cc(n1)NCO)Cl 2b7649a472b1a0e5282dd1402a4a51bd [0,1,0,0,0,1|2,0,0]=4 674 B11R1.34 Cc1nc(cc(n1)NCO)I 1fdad421eb93d7bd0238df552df515c9 [0,1,0,0,0,1|2,0,0]=4 675 B11R1.34 Cc1nc(nc(n1)NCO)Cl c8c4f282d1fa0a2c78c948ba7023cf20 [0,1,0,0,0,1|2,0,0]=4 676 B11R1.189 CCc1cc(ccn1)NCO 9895f8b0c28b4f7244250cc314052c7b [0,1,0,0,0,1|2,0,0]=4 677 B11R1.189 CCc1cc(ncn1)NCO 4ec47af3ebb37306dec798b67bdc52ff [0,1,0,0,0,1|2,0,0]=4 678 B11R1.189 COc1cc(ccn1)NCO c10fcdc35bcfb819551feac610af9ee0 [0,1,0,0,0,1|2,0,0]=4 679 B11R1.189 COc1cc(ncn1)NCO 1fce1fcdd37f2d4ac09c46d15a491a70 [0,1,0,0,0,1|2,0,0]=4 680 B11R1.189 COc1nccc(n1)NCO a9b04b4464f15b1ff1beb65a97792bd7 [0,1,0,0,0,1|2,0,0]=4 681 B11R1.189 CSc1cc(ccn1)NCO c51a6bdf4bb3e7928e27b825242e2aa8 [0,1,0,0,0,1|2,0,0]=4 682 B11R1.189 CSc1cc(ncn1)NCO 6156bb1aa8d3ca6d8b3433ae9aeb24e2 [0,1,0,0,0,1|2,0,0]=4 683 B11R1.189 CSc1nccc(n1)NCO e8befacc60b904c0d9297ea150e0fe8c [0,1,0,0,0,1|2,0,0]=4 684 B11R1.189 CSc1ncnc(n1)NCO 03b357bb88ed2982fa2a3ae26967087f [0,1,0,0,0,1|2,0,0]=4 685 B11R1.189 OCNc1ccnc(c1)CO 96bcbc2e95632cd99a4715fa5e918a0e [0,1,0,0,0,1|2,0,0]=4 686 B11R1.189 OCNc1ccnc(n1)CCl 0f767ea601db2b44a27b41799a77f2b2 [0,1,0,0,0,1|2,0,0]=4 687 B11R1.18 CCCNc1sccc1CC 3e298c8dda0d4da51cd705fb50c3fa09 [0,2,0,0,0,0|2,0,0]=4 688 B11R1.18 CCCNc1sccc1CO f8611ae46a8754422a89671673b7e76a [0,2,0,0,0,0|2,0,0]=4 689 B11R1.18 CCCNc1scnc1CO b8b30ac18de1a5f01147243a518a715f [0,2,0,0,0,0|1,0,0]=3 690 B11R1.18 CCNCc1sccc1OC bfcb3a48db7c2b44cd82bdc661ee9c06 [0,2,0,0,0,0|2,0,0]=4 691 B11R1.18 CCc1ccsc1NCCBr 6aa3da9bb91886550fd4ba5b92a0334f [0,2,0,0,0,0|2,0,0]=4 692 B11R1.18 CCc1ccsc1NCCF ec5fd41cdc1a0ed1672139e91ce94176 [0,2,0,0,0,0|2,0,0]=4 693 B11R1.18 CCc1ccsc1NCCI 6c628469c9dc5f6bb5f421b61f831d5c [0,2,0,0,0,0|2,0,0]=4 694 B11R1.18 CCc1ccsc1NCCO 54ed3c59e5f3a1819d311127c865eb8a [0,2,0,0,0,0|1,0,0]=3 695 B11R1.18 CCc1ccsc1NCCS c9776800cd888f573f07f8256bf57bc1 [0,2,0,0,0,0|1,1,0]=4 696 B11R1.18 CCc1n[nH]cc1NCCO 921459e372832d5c1ef32001cc156a79 [0,2,0,0,0,0|2,0,0]=4 697 B11R1.18 CCc1nocc1NCCO ecc50f5ee608e18898ecab731e7738b2 [0,2,0,0,0,0|2,0,0]=4 698 B11R1.18 CCn1nccc1NCCO e93430618d0f76970e6d8af7f0760fb3 [0,2,0,0,0,0|2,0,0]=4 699 B11R1.18 CCn1ncnc1NCCO faa7ff09300df9cdb754d744ba284636 [0,2,0,0,0,0|2,0,0]=4 700 B11R1.18 COc1ccsc1CNCF b825bab9ef5e44c0289412b2854800e7 [0,2,0,0,0,0|2,0,0]=4 701 B11R1.18 COc1ccsc1CNCO ec19e94d552b292f27f423c9965389c4 [0,2,0,0,0,0|1,0,0]=3 702 B11R1.18 COc1n[nH]cc1NCCO 53be15ba3c28a05a7e8bf49059f7ca54 [0,2,0,0,0,0|2,0,0]=4 703 B11R1.18 COc1nonc1NCCO 26fb23dae5a14a9d2c06e553515c8ac3 [0,2,0,0,0,0|2,0,0]=4 704 B11R1.18 CSc1sccc1NCCO 6c071a0fc1366a87ac7f6054cb93c463 [0,2,0,0,0,0|2,0,0]=4 705 B11R1.18 N#CCNc1scnc1CO 89ccaea9df56d063858955e572fc70f3 [0,2,0,0,0,0|1,0,1]=4 706 B11R1.18 N#Cc1ccsc1NCCO 398b1bfb4e1799e3d6202a567a4d6725 [0,2,0,0,0,0|1,0,1]=4 707 B11R1.18 N#Cc1ncoc1NCCO 249b480e3651ce9afc164c420c6ebd17 [0,2,0,0,0,0|0,1,1]=4 708 B11R1.18 O=Cc1ccsc1NCCO 62af03bd678651f67ad9b380a8bc1065 [0,2,0,0,0,0|1,0,1]=4 709 B11R1.18 O=Cc1nc[nH]c1NCCO b84e52111ce054a914ac369c31fbf00e [0,2,0,0,0,0|1,0,1]=4 710 B11R1.18 O=Cc1ncsc1NCCBr 87b9d5ba99ae2bb6c83dca5a9cb08f8e [0,2,0,0,0,0|1,0,1]=4 711 B11R1.18 O=Cc1ncsc1NCCF 49b6a1fda3cbc86b0e7109c66d515785 [0,2,0,0,0,0|1,0,1]=4 712 B11R1.18 O=Cc1ncsc1NCCO 67bc1dab68150523023052a4324a15d6 [0,2,0,0,0,0|0,0,1]=3 713 B11R1.18 O=Cc1ncsc1NCCS 6a75681a8989aa5169d02118a95ace43 [0,2,0,0,0,0|0,1,1]=4 714 B11R1.18 OCCNc1ccsc1CO f496ee2d39479f3d02cb79a91ed85ca6 [0,2,0,0,0,0|2,0,0]=4 715 B11R1.18 OCCNc1nonc1CO 4e6c9756adde6576777d8762812d5466 [0,2,0,0,0,0|2,0,0]=4 716 B11R1.18 OCCNc1sccc1CO fdd1e50825620da5b9678f4096f0fd95 [0,2,0,0,0,0|1,0,0]=3 717 B11R1.18 OCCNc1scnc1CO 167c2f0a59d95e6251aadfbd8b0bf05c [0,2,0,0,0,0|0,0,0]=2 718 B11R1.18 OCc1ccsc1NCCI f662804eb341059859afbfe177239cd3 [0,2,0,0,0,0|2,0,0]=4 719 B11R1.18 OCc1ccsc1NCCS 6866fa5c61fa83761533709f5150d048 [0,2,0,0,0,0|1,1,0]=4 720 B11R1.18 OCc1ncsc1NCCBr e92b6410a48a792563ea7456ca933c84 [0,2,0,0,0,0|1,0,0]=3 721 B11R1.18 OCc1ncsc1NCCF 16c721e42d36fc8e884b1e953e1b958f [0,2,0,0,0,0|1,0,0]=3 722 B11R1.18 OCc1ncsc1NCCI 54100fe11c1e747f14849f1ed2ce792e [0,2,0,0,0,0|1,0,0]=3 723 B11R1.18 OCc1ncsc1NCCS f96b82f095d073712c11e0721a41e470 [0,2,0,0,0,0|0,1,0]=3 724 B11R1.183 Cc1nc(c(s1)NCO)C#N 92faafd0c7c4491924b7acb119b9d9db [0,2,0,0,0,0|1,0,1]=4 725 B11R1.193 CC(=O)c1ccsc1NCO ed0d495723156970dbb61a409960e771 [0,2,0,0,0,0|2,0,0]=4 726 B11R1.193 NC(=O)c1ncsc1NCO 702dc60b7c581fa7e581f3979b181c55 [0,2,0,0,0,0|1,0,1]=4 727 B11R1.90 C=C(Br)CNc1scnc1C db31cf40ffdb4bc7e7b458b5f23abd9a [0,2,0,0,0,0|1,0,1]=4 728 B11R1.90 C=C(C)CNc1scnc1C fb97117e59ec2ea7b11f636783edab34 [0,2,0,0,0,0|1,0,1]=4 729 B11R1.90 C=C(Cl)CNc1scnc1C a772015db1dec37639406661fe4f3522 [0,2,0,0,0,0|1,0,1]=4 730 B11R1.90 C=C(F)CNc1scnc1C 847059365301d6a7b9f71712eaa46966 [0,2,0,0,0,0|1,0,1]=4 731 B11R1.90 CC(=O)CNc1scnc1C 54d07dafb1770d143ef0644844578c24 [0,2,0,0,0,0|0,0,2]=4 732 B11R1.90 CC(=O)NCc1scnc1C 589e78d4eb9f0a6d802bb730d38ce454 [0,2,0,0,0,0|0,0,2]=4 733 B11R1.90 CC(C)NCc1scnc1Br e781d85c44ab0e53c5ebdde28bbdf04c [0,2,0,0,0,0|2,0,0]=4 734 B11R1.90 CC(C)OCc1scnc1Cl 999f833f8ba69ef972c18d95b894b46c [0,2,0,0,0,0|2,0,0]=4 735 B11R1.90 CC(O)CNc1ccnn1C e369edecb600abacc822ac194e65e10c [0,2,0,0,0,0|2,0,0]=4 736 B11R1.90 CC(O)CNc1ncnn1C b4c7c721c00dcc472206116e937e985a [0,2,0,0,0,0|2,0,0]=4 737 B11R1.90 C[C@@H](O)CNc1ccnn1C d3cf34bc2f58b98c7024d625cbdf75de [0,2,0,0,0,0|2,0,0]=4 738 B11R1.90 C[C@H](O)CNc1ccnn1C 60e00acd8db84aeebc86e6f235f5cd8c [0,2,0,0,0,0|2,0,0]=4 739 B11R1.90 C[C@H](O)CNc1ncnn1C f4ddb615d24b77fbfabe1fed2651bdc6 [0,2,0,0,0,0|2,0,0]=4 740 B11R1.90 Cc1n[nH]cc1NCC(C)O e6de2c1f4056f89303a78b7b38a6b4b1 [0,2,0,0,0,0|2,0,0]=4 741 B11R1.90 Cc1n[nH]cc1NC[C@@H](C)O 214268718822b090de06f9fb0ef6cb0f [0,2,0,0,0,0|2,0,0]=4 742 B11R1.90 Cc1n[nH]cc1NC[C@H](C)O 0e15f8f67261c1673e26375f05f4bc08 [0,2,0,0,0,0|2,0,0]=4 743 B11R1.90 Cc1ncoc1COC(C)C ddd054a1676efc2bf2c8f9d19e17079a [0,2,0,0,0,0|1,1,0]=4 744 B11R1.90 Cc1ncsc1CNC(C)C a985b3b6952bc9dae50718f7e18651f1 [0,2,0,0,0,0|1,0,0]=3 745 B11R1.90 Cc1ncsc1COC(C)C 77bffa14fb367206ae7c1269caca4d67 [0,2,0,0,0,0|1,0,0]=3 746 B11R1.90 Cc1ncsc1NCC(=O)N 44c11f132443394cfe229f8971c4f121 [0,2,0,0,0,0|0,0,2]=4 747 B11R1.90 Cc1ncsc1NCC(=O)O 23a180e40897b7b0e9ce0b672a350c2a [0,2,0,0,0,0|0,0,1]=3 748 B11R1.90 Cc1ncsc1NCC(C)C 0c3fdb810a77d1bb11e98419a018f65b [0,2,0,0,0,0|1,0,0]=3 749 B11R1.90 Cc1ncsc1NCC(C)O 5e3fb4963f7d5e5d7aabd2a41fccf587 [0,2,0,0,0,0|0,0,0]=2 750 B11R1.90 Cc1ncsc1NCC(F)F 8541c45cc3d0d64370d20b46e9084261 [0,2,0,0,0,0|1,0,0]=3 751 B11R1.90 Cc1ncsc1NCN(C)C 4b0db09207c00a8c67275c1c641bac0f [0,2,0,0,0,0|2,0,0]=4 752 B11R1.90 Cc1ncsc1NC[C@@H](C)O ad15cf6dbf9f6377fc58490c594cbac4 [0,2,0,0,0,0|0,0,0]=2 753 B11R1.90 Cc1ncsc1NC[C@H](C)O 5edf0f570cbe094c2340e284ba1b5273 [0,2,0,0,0,0|0,0,0]=2 754 B11R1.90 Cc1ncsc1NC[N+](=O)[O-] 77f8d7e71cf3ab06b6d3cbf609bc6327 [0,2,0,0,0,0|1,0,1]=4 755 B11R1.90 Cc1nnsc1CNC(C)C 5dcb1c1aa44bdd75d0e2407342f8c77e [0,2,0,0,0,0|2,0,0]=4 756 B11R1.90 Cc1nnsc1COC(C)C 04e87628abb552b6670f69f782a8a5be [0,2,0,0,0,0|2,0,0]=4 757 B11R1.90 Cc1nocc1NCC(C)O aac865034c1342f5e54fd19267f41cfd [0,2,0,0,0,0|2,0,0]=4 758 B11R1.90 Cc1nocc1NC[C@H](C)O 25f0d68297360a2927e4a2d998d058f3 [0,2,0,0,0,0|2,0,0]=4 759 B11R1.90 Cc1nonc1NCC(C)O bec8b65265d23f201b881f441f7339ad [0,2,0,0,0,0|2,0,0]=4 760 B11R1.90 Cc1nonc1NC[C@H](C)O 8971d28ad0289e80a109a8845e737b50 [0,2,0,0,0,0|2,0,0]=4 761 B11R1.90 Cc1nscc1NCC(C)O 5b3b264fdd4822ceddc35fabef72b3d1 [0,2,0,0,0,0|2,0,0]=4 762 B11R1.90 Cc1nscc1NC[C@H](C)O 903ef5a8618347f7e2e390a70b7710c2 [0,2,0,0,0,0|2,0,0]=4 763 B11R1.90 Cc1sccc1NCC(C)O 8fc8d2a49842c583c78c02db29ba6f62 [0,2,0,0,0,0|2,0,0]=4 764 B11R1.90 Cc1sccc1NC[C@H](C)O ecb5525c1fe997b79263e45d4e5f4173 [0,2,0,0,0,0|2,0,0]=4 765 B11R1.180 C#CCCNc1scnc1C b09f661c43f527e7f2f23c448104ea51 [0,2,0,0,0,0|1,0,0]=3 766 B11R1.180 C#CCNCc1scnc1Br d72264383f54401f8209f77789505532 [0,2,0,0,0,0|2,0,0]=4 767 B11R1.180 C#CCNCc1scnc1C 09bbf6ceeb979f57808ad0352e6ef22b [0,2,0,0,0,0|1,0,0]=3 768 B11R1.180 C#CCNCc1scnc1Cl 15f0b8d41aa01406b2d7ac272f16f2c0 [0,2,0,0,0,0|2,0,0]=4 769 B11R1.180 C#CCNCc1snnc1C 489dd0ba1dac191c6c0e577d2d7ce9cc [0,2,0,0,0,0|2,0,0]=4 770 B11R1.180 C#CCOCc1ocnc1C 018b88c93f7c48a0be37c237dd0034d4 [0,2,0,0,0,0|1,1,0]=4 771 B11R1.180 C#CCOCc1sccc1C ac17bb7aeae6409cf13914e436abf624 [0,2,0,0,0,0|2,0,0]=4 772 B11R1.180 C#CCOCc1scnc1Br cf9836f72e15d90d3c71ee444d621e27 [0,2,0,0,0,0|2,0,0]=4 773 B11R1.180 C#CCOCc1scnc1C 580423581852eaa97b747199c222445a [0,2,0,0,0,0|1,0,0]=3 774 B11R1.180 C#CCOCc1scnc1Cl 1aa5db421a2bd5b0173a7a34647bf9d3 [0,2,0,0,0,0|2,0,0]=4 775 B11R1.180 C#CCOCc1snnc1C a1e7db864795419c2c91b4e2ee6cb4e5 [0,2,0,0,0,0|2,0,0]=4 776 B11R1.180 C/C=C/CNc1scnc1C c69988677860ab05e7d2623db5567978 [0,2,0,0,0,0|1,0,1]=4 777 B11R1.180 C/C=C\CNc1scnc1C c4d3eedc2b7e96ec9342de983430f948 [0,2,0,0,0,0|1,0,1]=4 778 B11R1.180 C=CCCNc1sccc1C 60cd6bb62f80a22c03ade9a45d3c133e [0,2,0,0,0,0|2,0,0]=4 779 B11R1.180 C=CCCNc1scnc1C 9ccfe863d2f778f67d794a56fb166aa7 [0,2,0,0,0,0|1,0,0]=3 780 B11R1.180 C=CCCNc1snnc1C fa262dd636bc2e1512631e4cd3014255 [0,2,0,0,0,0|2,0,0]=4 781 B11R1.180 C=CCNCc1scnc1Br 0ad82bb1b1ba9b226328fa2abbfd86e1 [0,2,0,0,0,0|2,0,0]=4 782 B11R1.180 C=CCNCc1scnc1C c4ed06540b3a6d5f69e5636715608fe0 [0,2,0,0,0,0|1,0,0]=3 783 B11R1.180 C=CCNCc1snnc1C 12a13e7110e222b83ef8b326886fc7e4 [0,2,0,0,0,0|2,0,0]=4 784 B11R1.180 C=CCOCc1ocnc1C 2609094ece8196390aa9c8552bdf2fb9 [0,2,0,0,0,0|1,1,0]=4 785 B11R1.180 C=CCOCc1sccc1C e409e193949dce014878901936af5cc9 [0,2,0,0,0,0|2,0,0]=4 786 B11R1.180 C=CCOCc1scnc1Br 8cee64e19a28914f8e975451d6b4623a [0,2,0,0,0,0|2,0,0]=4 787 B11R1.180 C=CCOCc1scnc1C 4c6e05aa811bdd8fe66b13b70228876c [0,2,0,0,0,0|1,0,0]=3 788 B11R1.180 C=CCOCc1scnc1Cl b69ca94f8ee44841623e94e8f1da0a67 [0,2,0,0,0,0|2,0,0]=4 789 B11R1.180 C=CCOCc1snnc1C ee2849ddf1a367074fd88e3c6b9ce82c [0,2,0,0,0,0|2,0,0]=4 790 B11R1.180 CC=CCNc1scnc1C bf0d4a6a3d90d4d4bf212d85df92ca1f [0,2,0,0,0,0|1,0,1]=4 791 B11R1.180 CCCCNc1sccc1C b5489a4a5937f782ef16c288eda79112 [0,2,0,0,0,0|2,0,0]=4 792 B11R1.180 CCCCNc1scnc1C a953d1ca90e919ae12ebf72c94309d02 [0,2,0,0,0,0|1,0,0]=3 793 B11R1.180 CCCNCc1scnc1Br f5fbe32ffc88dc86a65566d0393daa71 [0,2,0,0,0,0|2,0,0]=4 794 B11R1.180 CCCNCc1scnc1C c2523451deed12d729c1b04cfc7b37a1 [0,2,0,0,0,0|1,0,0]=3 795 B11R1.180 CCCNCc1scnc1Cl cf7a72306a74ffe75a19fed66d25fe86 [0,2,0,0,0,0|2,0,0]=4 796 B11R1.180 CCCNCc1snnc1C ed92e46a765f1fea0ecc055657426c9b [0,2,0,0,0,0|2,0,0]=4 797 B11R1.180 CCCOCc1ocnc1C 218849497850e36b842606f5c4cde9c9 [0,2,0,0,0,0|1,1,0]=4 798 B11R1.180 CCCOCc1sccc1C f1db515b4bc7ba1569929001c68c4beb [0,2,0,0,0,0|2,0,0]=4 799 B11R1.180 CCCOCc1scnc1Br 5a3b07a99480bbdb1787a6146acbc076 [0,2,0,0,0,0|2,0,0]=4 800 B11R1.180 CCCOCc1scnc1C 0f93c70fa6bce92185614499be1b9f8e [0,2,0,0,0,0|1,0,0]=3 801 B11R1.180 CCCOCc1scnc1Cl 999d979003c9e0c20c887c0776505183 [0,2,0,0,0,0|2,0,0]=4 802 B11R1.180 CCCOCc1snnc1C e42b334f3d6cc0f1c6a78ac33bad1cfd [0,2,0,0,0,0|2,0,0]=4 803 B11R1.180 CCNCCc1sccc1C e5d25d38d1fd0f601f4e275056cd9808 [0,2,0,0,0,0|2,0,0]=4 804 B11R1.180 CCNCCc1scnc1C 7e0301501f7a99da68aba2c0ba99f639 [0,2,0,0,0,0|1,0,0]=3 805 B11R1.180 CCOCCc1ncsc1C 7967d2d240fa0f0a1e9238e41e3edf4f [0,2,0,0,0,0|2,0,0]=4 806 B11R1.180 CCOCCc1scnc1C cf10344eb1014692cafbbc7c6d57ba00 [0,2,0,0,0,0|0,0,0]=2 807 B11R1.180 CCOCCn1ccnc1C 774c66d4a7e04f82e54e3b4f75e9d200 [0,2,0,0,0,0|2,0,0]=4 808 B11R1.180 CCOCNc1scnc1C 31e3d8d948eec3e9c061412b426a878c [0,2,0,0,0,0|1,0,0]=3 809 B11R1.180 COCCNc1[nH]nnc1C f33a270b90d6de07d9d13d67f9e1f7ad [0,2,0,0,0,0|2,0,0]=4 810 B11R1.180 COCCNc1c[nH]nc1C ded3e79fcd3bfb92de6462c500f4068f [0,2,0,0,0,0|2,0,0]=4 811 B11R1.180 COCCNc1ccnn1C 09993891fe1d93ae895ae25e956b52d5 [0,2,0,0,0,0|2,0,0]=4 812 B11R1.180 COCCNc1ccsc1C 219f44c9bda3381e21d30ebf02a73b51 [0,2,0,0,0,0|2,0,0]=4 813 B11R1.180 COCCNc1conc1C e0e4630f89762bc29987662fa4751936 [0,2,0,0,0,0|2,0,0]=4 814 B11R1.180 COCCNc1csnc1C 737987776902570fd07e327d7be497e1 [0,2,0,0,0,0|2,0,0]=4 815 B11R1.180 COCCNc1nc[nH]c1C 3bb01eb80b2d5dbf4ddc0c4e4cc133e3 [0,2,0,0,0,0|1,0,1]=4 816 B11R1.180 COCCNc1ncnn1C 57edfdfffa022ff0327118070cdb9da0 [0,2,0,0,0,0|2,0,0]=4 817 B11R1.180 COCCNc1ncoc1C ac2b8d69da68cf126265710cd0d2920d [0,2,0,0,0,0|2,0,0]=4 818 B11R1.180 COCCNc1ncsc1C 19a21dcce51d055143541c445a1020f7 [0,2,0,0,0,0|2,0,0]=4 819 B11R1.180 COCCNc1nonc1C 2d60a25c001bddb4060843fd650fc651 [0,2,0,0,0,0|2,0,0]=4 820 B11R1.180 COCCNc1sccc1C 2ae4735b0410f8899b62616c813bdf46 [0,2,0,0,0,0|1,0,0]=3 821 B11R1.180 COCCNc1scnc1C f52df40ec9eef1424c00e5b1db21c1c9 [0,2,0,0,0,0|0,0,0]=2 822 B11R1.180 COCCNc1sncc1C 28c791bec01eb66dab7e651aaf4ea754 [0,2,0,0,0,0|2,0,0]=4 823 B11R1.180 COCCNc1snnc1C 71ef78f8a29818ca832ab78c4c070e81 [0,2,0,0,0,0|1,0,0]=3 824 B11R1.180 COCCOc1ccnn1C 2f092181fc642dd461ea0e4eaef5558c [0,2,0,0,0,0|2,0,0]=4 825 B11R1.180 COCNCc1ccnn1C 8f28bc3a44b45f9ec36c512a36312bc1 [0,2,0,0,0,0|2,0,0]=4 826 B11R1.180 COCNCc1ccoc1C 5360e413a6f512dd75cee418b6c0e6d4 [0,2,0,0,0,0|2,0,0]=4 827 B11R1.180 COCNCc1conc1C e96a030ff8c0ea65c95a83094d7ce7b8 [0,2,0,0,0,0|2,0,0]=4 828 B11R1.180 COCNCc1nc[nH]c1C 50b1fe08ce173c755101419a3edfdf51 [0,2,0,0,0,0|1,0,1]=4 829 B11R1.180 COCNCc1ncnn1C 7985741336f08eca9776fecacfa398d7 [0,2,0,0,0,0|2,0,0]=4 830 B11R1.180 COCNCc1ncoc1C d96671b84bdc7a91521243d015ec645e [0,2,0,0,0,0|2,0,0]=4 831 B11R1.180 COCNCc1nonc1C 8d13a9af34356657c8da5b241578e175 [0,2,0,0,0,0|2,0,0]=4 832 B11R1.180 COCNCc1occc1C 92fa3d300208039b2e73f6268b72eab6 [0,2,0,0,0,0|1,1,0]=4 833 B11R1.180 COCNCc1sccc1Br 7c2d11ffb5ce3e9532a1661c7547fae8 [0,2,0,0,0,0|2,0,0]=4 834 B11R1.180 COCNCc1sccc1Cl 0c00268cd5242da162fc5ad9da6fd766 [0,2,0,0,0,0|2,0,0]=4 835 B11R1.180 COCNCc1sccc1F ddbd6c01574c33c530d72cd21eded9e7 [0,2,0,0,0,0|2,0,0]=4 836 B11R1.180 COCNCc1scnc1Br 17b61d3ee6ede5cea737e5350eca7c20 [0,2,0,0,0,0|1,0,0]=3 837 B11R1.180 COCNCc1scnc1C b2058a3696cbae342a1f4f1f85120406 [0,2,0,0,0,0|0,0,0]=2 838 B11R1.180 COCNCc1snnc1C 8ffff031b470ff299e236afce33f0e75 [0,2,0,0,0,0|1,0,0]=3 839 B11R1.180 COCOCc1c[nH]nc1C edc33aabdcb5012596317b731e80ef9a [0,2,0,0,0,0|2,0,0]=4 840 B11R1.180 COCOCc1ccnn1C d42fcf8dd3e33bf2124e7f92a37c7917 [0,2,0,0,0,0|2,0,0]=4 841 B11R1.180 COCOCc1ccoc1C c4a1a94e4ddd0b66d18e5dae394021e7 [0,2,0,0,0,0|2,0,0]=4 842 B11R1.180 COCOCc1nc[nH]c1C 5daf13e597b9e853dd66333eb4a07585 [0,2,0,0,0,0|1,0,1]=4 843 B11R1.180 COCOCc1ncnn1C 858071835ddd558dcd17392bb8e782a3 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.180 COCOCc1ncoc1C 602814d6014ebf0c0ce5d1853ffae6b6 [0,2,0,0,0,0|2,0,0]=4 845 B11R1.180 COCOCc1ncsc1C f5fa7566f010e627de039246093289d6 [0,2,0,0,0,0|2,0,0]=4 846 B11R1.180 COCOCc1nonc1C 1260eedc46ee7196001fe70fdecdda92 [0,2,0,0,0,0|2,0,0]=4 847 B11R1.180 COCOCc1occc1C da83e7b159f8df93d85773fceab7af85 [0,2,0,0,0,0|1,1,0]=4 848 B11R1.180 COCOCc1ocnc1C 48ccfed75e75c8630fa7bd88868ae285 [0,2,0,0,0,0|0,1,0]=3 849 B11R1.180 COCOCc1sccc1C 56a7ba85449ec3ddb0b50e395185a7d9 [0,2,0,0,0,0|1,0,0]=3 850 B11R1.180 COCOCc1sccc1Cl ceed74a291bb2e735ec412bbc8a9e70b [0,2,0,0,0,0|2,0,0]=4 851 B11R1.180 COCOCc1sccc1F b280851c871d43461aa59dda4d910fed [0,2,0,0,0,0|2,0,0]=4 852 B11R1.180 COCOCc1scnc1Br 62758d4b9456cfbe0e069fdfccc41c5a [0,2,0,0,0,0|1,0,0]=3 853 B11R1.180 COCOCc1scnc1C 8d606a1dcda285b3761d860ebc393793 [0,2,0,0,0,0|0,0,0]=2 854 B11R1.180 COCOCc1scnc1Cl 9b5db3d4e2aef773764390b53b30cc27 [0,2,0,0,0,0|1,0,0]=3 855 B11R1.180 COCOCc1snnc1C fd4866b76124d2340936ee6c8500a5af [0,2,0,0,0,0|1,0,0]=3 856 B11R1.180 CSCCNc1scnc1C 7a30d8e3885eb993a8bf9b4c177f5bad [0,2,0,0,0,0|0,1,0]=3 857 B11R1.180 CSCNCc1scnc1Br 498da82d9046a99074568078b748e31e [0,2,0,0,0,0|1,1,0]=4 858 B11R1.180 CSCNCc1scnc1C 493cbf637123a1a702e2b974f4762632 [0,2,0,0,0,0|0,1,0]=3 859 B11R1.180 CSCNCc1snnc1C d4967a0272c6dc7172e3af4de6ea0638 [0,2,0,0,0,0|1,1,0]=4 860 B11R1.180 CSCOCc1ocnc1C ae62cd20c67e49d6a739d73bf9e0477b [0,2,0,0,0,0|0,2,0]=4 861 B11R1.180 CSCOCc1sccc1C cd32dc53b254ad85b9d855d05d1a277d [0,2,0,0,0,0|1,1,0]=4 862 B11R1.180 CSCOCc1scnc1Br c4d677b78fb37a3c43e6f3313f298910 [0,2,0,0,0,0|1,1,0]=4 863 B11R1.180 CSCOCc1scnc1C 6182e85dd04e1073d9303e3832b2dd44 [0,2,0,0,0,0|0,1,0]=3 864 B11R1.180 CSCOCc1scnc1Cl ecbd82252c1a59c1bcb9d56e5dff3bff [0,2,0,0,0,0|1,1,0]=4 865 B11R1.180 CSCOCc1snnc1C 5b94399afe0c35ee9f2d3d36842edc73 [0,2,0,0,0,0|1,1,0]=4 866 B11R1.180 Cc1[nH]cnc1CNCCO cf38af2af0efb4d55d298410cde817b0 [0,2,0,0,0,0|1,0,1]=4 867 B11R1.180 Cc1ccoc1CNCCO 1ff4153120961ed0729996cf1352ee31 [0,2,0,0,0,0|1,1,0]=4 868 B11R1.180 Cc1ccsc1CCNC=O face3e688d3bcb97c791ad679777e4f8 [0,2,0,0,0,0|1,0,1]=4 869 B11R1.180 Cc1ccsc1CCNCF 8734b71a41c3ea03a5cf82fc7862dcf2 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.180 Cc1ccsc1CCNCO 4ccf4eeb0f3bf5c9d4c9e144d84c17da [0,2,0,0,0,0|1,0,0]=3 871 B11R1.180 Cc1ccsc1COCC#N 84c7b64710681747239f977133e64632 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.180 Cc1ccsc1COCC=O 8e458cceb0d3d5b6b25ae017c776e982 [0,2,0,0,0,0|1,0,1]=4 873 B11R1.180 Cc1ccsc1COCCF 57079926303eccce3647bf23dcb06ae5 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.180 Cc1ccsc1COCCS 40c20cb47fe5a87a3d243755de26e61f [0,2,0,0,0,0|1,1,0]=4 875 B11R1.180 Cc1ccsc1NCCCCl ca0ed3597466b0d6f4f8e973c897bf22 [0,2,0,0,0,0|2,0,0]=4 876 B11R1.180 Cc1ccsc1NCCCO 4e0f5115b7942a0bdc1e21216afbe694 [0,2,0,0,0,0|1,0,0]=3 877 B11R1.180 Cc1ccsc1NCCON 0e726338b691f2f20740407d3098cecc [0,2,0,0,0,0|1,0,0]=3 878 B11R1.180 Cc1cnsc1NCCON 116ce08bec9f0ad703b5aba78ac05c0c [0,2,0,0,0,0|2,0,0]=4 879 B11R1.180 Cc1n[nH]cc1NCCCO 7f2a60e64d0bb5ea11d3440df75a7779 [0,2,0,0,0,0|2,0,0]=4 880 B11R1.180 Cc1n[nH]cc1NCCON bb51bbe46a84f9943af3f911effd9065 [0,2,0,0,0,0|2,0,0]=4 881 B11R1.180 Cc1nc[nH]c1NCCON 870948b5b98cacc18813c9d9a81cda90 [0,2,0,0,0,0|1,0,0]=3 882 B11R1.180 Cc1nccn1CCOCF 179da1cf6e861700bfb0fb6377c61020 [0,2,0,0,0,0|2,0,0]=4 883 B11R1.180 Cc1ncoc1COCC#N ddcd1debff6cba8041800eb8f53a0621 [0,2,0,0,0,0|1,1,0]=4 884 B11R1.180 Cc1ncoc1COCC=O e84cf5daf02129d80592a429a81d738c [0,2,0,0,0,0|0,1,1]=4 885 B11R1.180 Cc1ncoc1COCCF e7b1e8a464755783d799d3de9c607fa9 [0,2,0,0,0,0|1,1,0]=4 886 B11R1.180 Cc1ncoc1COCCS 6a322c803e4c0d4b41bd3a6cc6725443 [0,2,0,0,0,0|0,2,0]=4 887 B11R1.180 Cc1ncsc1CCNC#N 376a26665c896bebc72c49175405f1f8 [0,2,0,0,0,0|1,0,0]=3 888 B11R1.180 Cc1ncsc1CCNC=O 306e67493ea2ae5971f9c8dc133f4fd0 [0,2,0,0,0,0|0,0,1]=3 889 B11R1.180 Cc1ncsc1CCNCF 7cdf7486c1c6d1c32667a1b32348526a [0,2,0,0,0,0|1,0,0]=3 890 B11R1.180 Cc1ncsc1CCNCO 386ae8a43e1d4958f9665a79fb5af047 [0,2,0,0,0,0|0,0,0]=2 891 B11R1.180 Cc1ncsc1CCOCF b730c0a35ac2c0398a187cdcff8ad81e [0,2,0,0,0,0|0,0,0]=2 892 B11R1.180 Cc1ncsc1CNCC#N 2a0d74a5f3ea238c8b69fd679af8e94f [0,2,0,0,0,0|1,0,0]=3 893 B11R1.180 Cc1ncsc1CNCC=O 42b2b866ceb320505bf405807d04c23a [0,2,0,0,0,0|0,0,1]=3 894 B11R1.180 Cc1ncsc1CNCCBr f9047c12fc1071c3e6b309c63def5eae [0,2,0,0,0,0|1,0,0]=3 895 B11R1.180 Cc1ncsc1CNCCF 378a4f28b561aced139abb9d0a4d5f3b [0,2,0,0,0,0|1,0,0]=3 896 B11R1.180 Cc1ncsc1CNCCI d07462d530881b522592144d8268d302 [0,2,0,0,0,0|1,0,0]=3 897 B11R1.180 Cc1ncsc1CNCCO c4d0433734ba1ad41c0aaeb4d3e0d0a0 [0,2,0,0,0,0|0,0,0]=2 898 B11R1.180 Cc1ncsc1CNCCS c7167c1d0061132c4cbef80aff903e3f [0,2,0,0,0,0|0,1,0]=3 899 B11R1.180 Cc1ncsc1COCC#N 384ca1b3b9dc78dc28c65e3cf5364590 [0,2,0,0,0,0|1,0,0]=3 900 B11R1.180 Cc1ncsc1COCC=O 7b6579766e4fd39c94968a0e5efbcf03 [0,2,0,0,0,0|0,0,1]=3 901 B11R1.180 Cc1ncsc1COCCF bd1cc08a3d57298d731e4843fafac877 [0,2,0,0,0,0|1,0,0]=3 902 B11R1.180 Cc1ncsc1COCCS 8f59ce2ab720ec83ffcc4bb4f1e8a4f6 [0,2,0,0,0,0|0,1,0]=3 903 B11R1.180 Cc1ncsc1NC/C=C/Cl d275e89f741e71efbd7495432a47452e [0,2,0,0,0,0|1,0,1]=4 904 B11R1.180 Cc1ncsc1NC/C=C\Cl 4d37ff53fc6e64c9bac9f9fca244aa41 [0,2,0,0,0,0|1,0,1]=4 905 B11R1.180 Cc1ncsc1NC/C=C\O 00c68c4f0ebb367d4a9e19741c221959 [0,2,0,0,0,0|0,0,1]=3 906 B11R1.180 Cc1ncsc1NCCC#N 75aaa4203fac7311e8b11ea1ec3620dd [0,2,0,0,0,0|1,0,0]=3 907 B11R1.180 Cc1ncsc1NCCC=O b3a8e3da57ebf9ed08e59f06e12adb98 [0,2,0,0,0,0|0,0,1]=3 908 B11R1.180 Cc1ncsc1NCCCCl 394587fbc1f0d70e2a091a124f74d1cd [0,2,0,0,0,0|1,0,0]=3 909 B11R1.180 Cc1ncsc1NCCCF fd2ed6c534a1bfa669f52d9d16665ce2 [0,2,0,0,0,0|1,0,0]=3 910 B11R1.180 Cc1ncsc1NCCCO 2378880407e972625730edd99097d523 [0,2,0,0,0,0|0,0,0]=2 911 B11R1.180 Cc1ncsc1NCCCS 843916b03c27e907545bbd81acc78ee9 [0,2,0,0,0,0|0,1,0]=3 912 B11R1.180 Cc1ncsc1NCCON 4f1a4b3dda87f35fcc30a085a01108dd [0,2,0,0,0,0|0,0,0]=2 913 B11R1.180 Cc1ncsc1NCSC#N 0c2298fb95f7db2dd0241bfb58a1b594 [0,2,0,0,0,0|1,0,1]=4 914 B11R1.180 Cc1nn[nH]c1NCCCO e97ac791183b800ebe02dfc0cf2777ed [0,2,0,0,0,0|2,0,0]=4 915 B11R1.180 Cc1nn[nH]c1NCCON e44181f64718e86f9d505a9bbf57ce5f [0,2,0,0,0,0|2,0,0]=4 916 B11R1.180 Cc1nnsc1CNCC#N d19acf7aa9953506488cce38d7d0962e [0,2,0,0,0,0|2,0,0]=4 917 B11R1.180 Cc1nnsc1CNCC=O 9bb6bc2bd8e41b3f2e7ece6c43f30bfc [0,2,0,0,0,0|1,0,1]=4 918 B11R1.180 Cc1nnsc1CNCCBr d77e282666250af9d4a853c6931f7e3e [0,2,0,0,0,0|2,0,0]=4 919 B11R1.180 Cc1nnsc1CNCCF 8cb55f070a033d6b05ea7b4cbe347ee0 [0,2,0,0,0,0|2,0,0]=4 920 B11R1.180 Cc1nnsc1CNCCI 83a5aed64e4c216b634d52947b2c3e25 [0,2,0,0,0,0|2,0,0]=4 921 B11R1.180 Cc1nnsc1CNCCO 5784621e537daf2ff38d488c6acfae4b [0,2,0,0,0,0|1,0,0]=3 922 B11R1.180 Cc1nnsc1CNCCS 76f936e831dc03e8f5659eef929125eb [0,2,0,0,0,0|1,1,0]=4 923 B11R1.180 Cc1nnsc1COCC#N f3826ca3556abce16c072f9ee9d3117b [0,2,0,0,0,0|2,0,0]=4 924 B11R1.180 Cc1nnsc1COCC=O 55c7e684c0d35bbcb1bd5fc7a79fe599 [0,2,0,0,0,0|1,0,1]=4 925 B11R1.180 Cc1nnsc1COCCF 062820017513ad02e37c5d8572724277 [0,2,0,0,0,0|2,0,0]=4 926 B11R1.180 Cc1nnsc1COCCS 886fb986d65bd6f91c610ae94ba119a6 [0,2,0,0,0,0|1,1,0]=4 927 B11R1.180 Cc1nnsc1NCCON aae18e96c37db8275c71f810f942def0 [0,2,0,0,0,0|1,0,0]=3 928 B11R1.180 Cc1nocc1CNCCO 85249a1c1549c7ab8c2f9b163d23bb34 [0,2,0,0,0,0|2,0,0]=4 929 B11R1.180 Cc1nocc1NCCCO 0e9a0d284978f41729a6bda018e5c5b8 [0,2,0,0,0,0|2,0,0]=4 930 B11R1.180 Cc1nocc1NCCON e877f3dae65901f3d73d0b38ff4e8742 [0,2,0,0,0,0|2,0,0]=4 931 B11R1.180 Cc1nonc1CNCCO a4b800b311724c7ce0c74843cdb0e2d0 [0,2,0,0,0,0|2,0,0]=4 932 B11R1.180 Cc1nonc1NCCCO e593359cbd851dfa5899e970694a9ffe [0,2,0,0,0,0|2,0,0]=4 933 B11R1.180 Cc1nscc1NCCCO 452aaba3b7fe428a98d7afdcd06c89a5 [0,2,0,0,0,0|2,0,0]=4 934 B11R1.180 Cc1occc1CNCCO d4c3f8f5eecd5b2cdd03064d37af6a76 [0,2,0,0,0,0|2,0,0]=4 935 B11R1.180 Cc1ocnc1CNCCO 35bc37ad87359796ab6fb46a274690dc [0,2,0,0,0,0|2,0,0]=4 936 B11R1.180 Cc1ocnc1NCCON a1958e0c93f5d53a0a7a503e94d5b94c [0,2,0,0,0,0|2,0,0]=4 937 B11R1.180 Cc1sccc1NCCCO 7b64a2800d735c7156cd91e5ce0c349d [0,2,0,0,0,0|2,0,0]=4 938 B11R1.180 Cc1sccc1NCCON a0ccdb1f9f659e74d2ee47fc17c8ee6c [0,2,0,0,0,0|2,0,0]=4 939 B11R1.180 Cc1scnc1CCOCF 35fa1604e4859c25cf920b3c14ae7d24 [0,2,0,0,0,0|2,0,0]=4 940 B11R1.180 Cc1scnc1NCCON 3f233969350bc77da50091ac6baaa9fa [0,2,0,0,0,0|2,0,0]=4 941 B11R1.180 Clc1ncsc1CNCCBr 62edc93dcea54ffaa4b773d0c995fe61 [0,2,0,0,0,0|2,0,0]=4 942 B11R1.180 Clc1ncsc1CNCCI ad9ea3fb56733ba6842c599c3ed4f7c2 [0,2,0,0,0,0|2,0,0]=4 943 B11R1.180 Cn1nccc1CCNCO c5585876e6b51ee4386cdcccb85f702d [0,2,0,0,0,0|2,0,0]=4 944 B11R1.180 Cn1nccc1CNCCO c3ecb94542e51960a023f46264d8aa5d [0,2,0,0,0,0|2,0,0]=4 945 B11R1.180 Cn1nccc1NCCCO 0560f649349672311721d5431d670f85 [0,2,0,0,0,0|2,0,0]=4 946 B11R1.180 Cn1nccc1NCCON f5dcc94edb6c9a7c75be30cd58a07b0d [0,2,0,0,0,0|2,0,0]=4 947 B11R1.180 Cn1ncnc1CNCCO 28bc2250facc301037c68c2527091ef8 [0,2,0,0,0,0|2,0,0]=4 948 B11R1.180 Cn1ncnc1NCCCO 296f0ad74a8afddb4122242606097f77 [0,2,0,0,0,0|2,0,0]=4 949 B11R1.180 FCCNCc1scnc1Br e2f1f7418c34b3026eef0e1fac2ed721 [0,2,0,0,0,0|2,0,0]=4 950 B11R1.180 FCCNCc1scnc1Cl 24276dcf5fc18a5e4c57b9b2ba759896 [0,2,0,0,0,0|2,0,0]=4 951 B11R1.180 FCCOCc1scnc1Br 0e1515c86c33e63469b5e0fdbe4b5feb [0,2,0,0,0,0|2,0,0]=4 952 B11R1.180 FCCOCc1scnc1Cl 05aa413af27457abb1e7ea0f87c81f85 [0,2,0,0,0,0|2,0,0]=4 953 B11R1.180 N#CCNCc1scnc1Br e3c0e541eaf078bc2b9382e1feb0aee4 [0,2,0,0,0,0|2,0,0]=4 954 B11R1.180 N#CCNCc1scnc1Cl 5d3f3d4389365d1a2e129f0bdfbc83d5 [0,2,0,0,0,0|2,0,0]=4 955 B11R1.180 N#CCOCc1scnc1Br 59b8c00e4bf1e2a8a34a3df3cf1d3923 [0,2,0,0,0,0|2,0,0]=4 956 B11R1.180 N#CCOCc1scnc1Cl f2c5f5bfeb27348b2b7f5cdc9a3732ce [0,2,0,0,0,0|2,0,0]=4 957 B11R1.180 NOCCNc1[nH]cnc1F 24aca2388bc900ea2e1b11ae49a3ad9b [0,2,0,0,0,0|2,0,0]=4 958 B11R1.180 O=CCNCc1scnc1Br ecd6468473feb1fae5014bde7d2a50d4 [0,2,0,0,0,0|1,0,1]=4 959 B11R1.180 O=CCOCc1scnc1Br 47de647da269846062b5aca190cf559e [0,2,0,0,0,0|1,0,1]=4 960 B11R1.180 O=CCOCc1scnc1Cl a756708b257eb44be0aa7d06ce66f1b3 [0,2,0,0,0,0|1,0,1]=4 961 B11R1.180 OCCNCc1sccc1Br 63faa4bf2d2e5653a3308fac8331fa67 [0,2,0,0,0,0|2,0,0]=4 962 B11R1.180 OCCNCc1sccc1Cl a1ef48275d39586222c438d1024c4827 [0,2,0,0,0,0|2,0,0]=4 963 B11R1.180 OCCNCc1sccc1F 76fc54aa42ccb7c1187898e82a9f0018 [0,2,0,0,0,0|2,0,0]=4 964 B11R1.180 OCCNCc1scnc1Br 0069cc4a681306d1c625a778a07c53bc [0,2,0,0,0,0|1,0,0]=3 965 B11R1.180 OCCNCc1scnc1Cl 658a1c5d4836d170dcc5397b51d2145e [0,2,0,0,0,0|1,0,0]=3 966 B11R1.180 SCCNCc1scnc1Br 907027737b468f84882e4c14b3a0b8ff [0,2,0,0,0,0|1,1,0]=4 967 B11R1.180 SCCNCc1scnc1Cl ba9b948a9789cf19d75147b00f034858 [0,2,0,0,0,0|1,1,0]=4 968 B11R1.180 SCCOCc1scnc1Br b12dd10dfafcfca3130a141670710403 [0,2,0,0,0,0|1,1,0]=4 969 B11R1.180 SCCOCc1scnc1Cl 47dba34472f56db6cbbcad7d389f1cd2 [0,2,0,0,0,0|1,1,0]=4 970 B11R1.199 C=CCN(C)c1scnc1C 9fe7249fd011a88990a0afdd7994d1dc [0,2,0,0,0,0|1,0,1]=4 971 B11R1.199 CC(NCO)c1ccnn1C dc15c2194254f691107e78c59cbf4823 [0,2,0,0,0,0|2,0,0]=4 972 B11R1.199 CCOC(C)c1scnc1C aa41067b061092b09036f800e45bf386 [0,2,0,0,0,0|1,0,0]=3 973 B11R1.199 Cc1ccsc1N(C)CCO 21ef0ddfeb73ed2dad9a6da99934ac47 [0,2,0,0,0,0|1,0,0]=3 974 B11R1.199 Cc1ncsc1C(C)OCF cb043aa4cc80c6d731b5010dadc6bc72 [0,2,0,0,0,0|1,0,0]=3 975 B11R1.199 Cc1sccc1N(C)CCO 17b25f049f568949c20a212526175038 [0,2,0,0,0,0|2,0,0]=4 976 B11R1.228 C=CC(C)Nc1scnc1C 93870137c43190da07b7d0aa611e0198 [0,2,0,0,0,0|1,0,1]=4 977 B11R1.228 CC(CO)Nc1ccnn1C 57beb2357c64c1eb2b4babeb156734a5 [0,2,0,0,0,0|2,0,0]=4 978 B11R1.228 CCC(=O)Nc1scnc1C 21a80faa0f046d24ad27a74a70c85d93 [0,2,0,0,0,0|1,0,1]=4 979 B11R1.228 CCC(C)Nc1scnc1C f8eec397733a239bcfd4bc69c3ebfda4 [0,2,0,0,0,0|1,0,0]=3 980 B11R1.228 CCN(C)Cc1scnc1C 5e7eed1c28b76dc7001a590a52643d49 [0,2,0,0,0,0|1,0,0]=3 981 B11R1.228 CCN(C)Cc1scnc1Cl ab2b293d7904024ee1ad7a1347a4be8f [0,2,0,0,0,0|2,0,0]=4 982 B11R1.228 CCN(C)Cc1snnc1C 4d94017e0c6ece6b4681e52ad44c7524 [0,2,0,0,0,0|2,0,0]=4 983 B11R1.228 CN(CO)Cc1ccnn1C 0d0b83070e91c64da79363c5b8da74ae [0,2,0,0,0,0|2,0,0]=4 984 B11R1.228 C[C@@H](CO)Nc1ccnn1C f3de24a9e14fdde03d683c07f621c582 [0,2,0,0,0,0|2,0,0]=4 985 B11R1.228 C[C@H](CO)Nc1ccnn1C 4622423c9a1cef741f627cb04e266b6e [0,2,0,0,0,0|2,0,0]=4 986 B11R1.228 Cc1ccoc1CN(C)CO 0cc786586d62b23b53102b1f5f8f2b2d [0,2,0,0,0,0|1,1,0]=4 987 B11R1.228 Cc1n[nH]cc1NC(C)CO 9fb092b01279f02502e7691c362b84e3 [0,2,0,0,0,0|2,0,0]=4 988 B11R1.228 Cc1n[nH]cc1N[C@@H](C)CO 2b7b575dce5357bfb5fbaab19e3c8131 [0,2,0,0,0,0|2,0,0]=4 989 B11R1.228 Cc1n[nH]cc1N[C@H](C)CO 3bbae2fe1afd823ff1f3f16ccbecc2ad [0,2,0,0,0,0|2,0,0]=4 990 B11R1.228 Cc1ncsc1CN(C)C=O 6334d7675a056f45274cd9c156e5807a [0,2,0,0,0,0|0,0,2]=4 991 B11R1.228 Cc1ncsc1CN(C)CF 29b73276e0fccce7b879c77720ad5cff [0,2,0,0,0,0|1,0,0]=3 992 B11R1.228 Cc1ncsc1CN(C)CO 604b86fcd4817870a3aea95c88a4b76a [0,2,0,0,0,0|0,0,0]=2 993 B11R1.228 Cc1ncsc1NC(=O)CF 77327307398e4402e1cef93da9f4972b [0,2,0,0,0,0|1,0,1]=4 994 B11R1.228 Cc1ncsc1NC(=O)CO 518beb2d3a8e2e0f7852916a517ddd8f [0,2,0,0,0,0|0,0,1]=3 995 B11R1.228 Cc1ncsc1NC(=O)CS 651aaf4fe1ef9f78581841c61534c348 [0,2,0,0,0,0|0,1,1]=4 996 B11R1.228 Cc1ncsc1NC(C)C=O b7f583f2ff4c2be91390f78b7887edb1 [0,2,0,0,0,0|0,0,2]=4 997 B11R1.228 Cc1ncsc1NC(C)CO b3934688944a7a3c865c9f1452c00eab [0,2,0,0,0,0|0,0,0]=2 998 B11R1.228 Cc1ncsc1N[C@@H](C)CO f315b7cc72435c0392072d234c996624 [0,2,0,0,0,0|0,0,0]=2 999 B11R1.228 Cc1ncsc1N[C@H](C)C=O 4fada73616bc30a140a9fff0d29de939 [0,2,0,0,0,0|0,0,2]=4 1000 B11R1.228 Cc1ncsc1N[C@H](C)CO 0c94fba1e190d607a27f8e14b9a6352e [0,2,0,0,0,0|0,0,0]=2 1001 B11R1.228 Cc1nnsc1CN(C)CF 1caa8abd898417861de0c7053a9a4f57 [0,2,0,0,0,0|2,0,0]=4 1002 B11R1.228 Cc1nnsc1CN(C)CO bd9af5a206db91a53dd212021053d06d [0,2,0,0,0,0|1,0,0]=3 1003 B11R1.228 Cc1nocc1NC(C)CO 6f3ccdec20255e2fc5f9e8f5dce785e3 [0,2,0,0,0,0|2,0,0]=4 1004 B11R1.228 Cc1nocc1N[C@@H](C)CO 4126cb0153eb982f86e0c96ae38d988d [0,2,0,0,0,0|2,0,0]=4 1005 B11R1.228 Cc1nocc1N[C@H](C)CO 2646e0294329f4f90c9b7165ab92109b [0,2,0,0,0,0|2,0,0]=4 1006 B11R1.228 Cc1nonc1CN(C)CO 4278623a69ba16ccd07318ff2cbeccd5 [0,2,0,0,0,0|2,0,0]=4 1007 B11R1.228 Cc1nonc1NC(C)CO 1d06ada66ffd346190bd16e7318f6470 [0,2,0,0,0,0|2,0,0]=4 1008 B11R1.228 Cc1nonc1N[C@@H](C)CO fe9f49411bedcd85bf2ed879e51cbef6 [0,2,0,0,0,0|2,0,0]=4 1009 B11R1.228 Cc1nonc1N[C@H](C)CO a73b40839b8c8e9e2fc70057916afdb2 [0,2,0,0,0,0|2,0,0]=4 1010 B11R1.228 Cc1occc1CN(C)CO fbdc82495b03606ae750249a3b742cb6 [0,2,0,0,0,0|2,0,0]=4 1011 B11R1.228 Cc1sccc1NC(C)CO c0138d48a278b9e9b3ed9d3f02fdbfe8 [0,2,0,0,0,0|2,0,0]=4 1012 B11R1.228 Cc1sccc1N[C@@H](C)CO fc93aa32d242b468f535a4d0299aef22 [0,2,0,0,0,0|2,0,0]=4 1013 B11R1.228 Cc1sccc1N[C@H](C)CO 2b6f13eabe5a9437b1b39cf4e1b4de91 [0,2,0,0,0,0|2,0,0]=4 1014 B11R1.230 CCCNc1oc(nc1C)C 1670d08be85a70e0d5d86f557d464475 [0,2,0,0,0,0|1,1,0]=4 1015 B11R1.230 CCCOc1[nH]c(nc1C)C 63145f4375e301c1e69633fcab1a8955 [0,2,0,0,0,0|2,0,0]=4 1016 B11R1.230 CCNCc1oc(nc1C)C 4680f1d7b01d56f46ebc91df7dd4bb45 [0,2,0,0,0,0|1,1,0]=4 1017 B11R1.230 CCNCc1sc(nc1C)Br eb8b1338519eaf9ec608a42fa77bc230 [0,2,0,0,0,0|1,0,0]=3 1018 B11R1.230 CCNCc1sc(nc1C)C 76606552ddc087a543fbd70b605414ba [0,2,0,0,0,0|1,0,0]=3 1019 B11R1.230 CCOCc1oc(nc1C)C 223437e34a06a9fe7d747b713ddbac61 [0,2,0,0,0,0|1,1,0]=4 1020 B11R1.230 CCOCc1sc(nc1Br)Br 186bdfbe658c76b72c89d02bf1c84b36 [0,2,0,0,0,0|2,0,0]=4 1021 B11R1.230 CCOCc1sc(nc1Cl)Cl 0df47e2628adf99b98259e476579a8f6 [0,2,0,0,0,0|2,0,0]=4 1022 B11R1.230 COCOc1[nH]c(nc1C)C 00e07e8990f171be93bf29e66e460694 [0,2,0,0,0,0|2,0,0]=4 1023 B11R1.230 Cc1cc(c(o1)C)CNCO 402980e367dd715d0f0953a0929ca005 [0,2,0,0,0,0|2,0,0]=4 1024 B11R1.230 Cc1cc(n(n1)C)CNCO dfae61ddb847dfda9af9b81047a9b542 [0,2,0,0,0,0|2,0,0]=4 1025 B11R1.230 Cc1cc(n(n1)C)NCCO dddc8ce58a5d9802170568f0e270a192 [0,2,0,0,0,0|2,0,0]=4 1026 B11R1.230 Cc1nc(c([nH]1)OCCF)C 1739876adca702c43bca559a3e50a119 [0,2,0,0,0,0|2,0,0]=4 1027 B11R1.230 Cc1nc(c([nH]1)OCCS)C f11f6b67dc3998afbb796d9912729619 [0,2,0,0,0,0|1,1,0]=4 1028 B11R1.230 Cc1nc(c(o1)C)CNCO b85af3b87a1a1d8e21244f7cff677406 [0,2,0,0,0,0|2,0,0]=4 1029 B11R1.230 Cc1nc(c(o1)C)NCCO b9440d1407dacfb81727b93f2e2b3275 [0,2,0,0,0,0|2,0,0]=4 1030 B11R1.230 Cc1nc(c(o1)CNCF)C 8cff9c29147c3e95112a10f14f5b6ede [0,2,0,0,0,0|1,1,0]=4 1031 B11R1.230 Cc1nc(c(o1)CNCO)C 0383d3abed5aaf8a097ac38c7e3c4538 [0,2,0,0,0,0|0,1,0]=3 1032 B11R1.230 Cc1nc(c(o1)COCF)C 1124b133222d2255a4cd08619ebdb84b [0,2,0,0,0,0|1,1,0]=4 1033 B11R1.230 Cc1nc(c(o1)NCCBr)C 947b9e7d14b800f4031fba40ceac2c58 [0,2,0,0,0,0|1,1,0]=4 1034 B11R1.230 Cc1nc(c(o1)NCCF)C d4aabae579b45702a490d495e70751cf [0,2,0,0,0,0|1,1,0]=4 1035 B11R1.230 Cc1nc(c(o1)NCCI)C 537dbef0373be47b1c80139e83ec594e [0,2,0,0,0,0|1,1,0]=4 1036 B11R1.230 Cc1nc(c(o1)NCCO)C 917e2fa02ce2b2ca1aa55dc13c9e40d1 [0,2,0,0,0,0|0,1,0]=3 1037 B11R1.230 Cc1nc(c(o1)NCCS)C ba6c72de54cbbeabb77586730497fa7e [0,2,0,0,0,0|0,2,0]=4 1038 B11R1.230 Cc1nc(c(s1)CNC#N)C c574a16d894bd77bab3832e9f3deb48a [0,2,0,0,0,0|1,0,1]=4 1039 B11R1.230 Cc1nc(c(s1)CNC=O)C 7e2ddbf4cb914e68d8219fb18bbe3b99 [0,2,0,0,0,0|0,0,2]=4 1040 B11R1.230 Cc1nc(c(s1)CNCF)C aaed020a6e98970d27bf24fe204ef99f [0,2,0,0,0,0|1,0,0]=3 1041 B11R1.230 Cc1nc(c(s1)CNCO)C eeaac64c70a6c8310a4c17b72037afc5 [0,2,0,0,0,0|0,0,0]=2 1042 B11R1.230 Cc1nc(c(s1)NCCBr)C 215981d4377460e55f1369d0e339a609 [0,2,0,0,0,0|1,0,0]=3 1043 B11R1.230 Cc1nc(c(s1)NCCS)C 5cfab0b486ccd76ecb8042b77f661ea8 [0,2,0,0,0,0|0,1,0]=3 1044 B11R1.230 Cc1nc(n(n1)C)NCCO b514f98fa338f92fd1cb7a082dd8e8b9 [0,2,0,0,0,0|2,0,0]=4 1045 B11R1.230 Cc1nc(sc1CNC=O)Br cea9b69bfa63f9a8f7194907cb3e1e38 [0,2,0,0,0,0|0,0,2]=4 1046 B11R1.230 Cc1nc(sc1CNCF)Br 577353c27e03ac41eb45cdb7ac154fff [0,2,0,0,0,0|1,0,0]=3 1047 B11R1.230 Cc1nc(sc1CNCO)Br f15af3adca0a189460dffb2d285f7557 [0,2,0,0,0,0|0,0,0]=2 1048 B11R1.230 Cc1nc(sc1NCCBr)N 7f9eaf3638ca0ece0d965e99d7af9e21 [0,2,0,0,0,0|1,0,0]=3 1049 B11R1.230 Cc1nc(sc1NCCI)N b322693bb2b7d8718d8654e59909d28f [0,2,0,0,0,0|1,0,0]=3 1050 B11R1.230 Cc1nc(sc1NCCO)N ce40fae546e096ff3f802b7877da1ca1 [0,2,0,0,0,0|0,0,0]=2 1051 B11R1.230 Cc1nn(cc1CNCO)C 92028b0ffd9625843c88a06b35deb7d0 [0,2,0,0,0,0|2,0,0]=4 1052 B11R1.230 Cc1nn(cc1NCCO)C c4446c352db11eb243b90f445e192fff [0,2,0,0,0,0|2,0,0]=4 1053 B11R1.230 Cn1nc(cc1NCCO)Cl 4f29273822c78207a82a563194a141e4 [0,2,0,0,0,0|2,0,0]=4 1054 B11R1.230 Cn1nc(nc1NCCO)Br f2147840ad1df7b23cdfae680e41d2b9 [0,2,0,0,0,0|2,0,0]=4 1055 B11R1.230 FCOCc1sc(nc1Br)Br 40633bcb0fecc54e6886c1b663bda965 [0,2,0,0,0,0|2,0,0]=4 1056 B11R1.230 FCOCc1sc(nc1Cl)Cl dc8404caef852a4f8856feb935dde33c [0,2,0,0,0,0|2,0,0]=4 1057 B11R1.465 CCCNc1c(ncn1C)C 4d2776e2e57ba8153a51bd5139974814 [0,2,0,0,0,0|2,0,0]=4 1058 B11R1.465 COCNc1c(ncn1C)C dcc9d87349dc12c0bcc970817e930ebd [0,2,0,0,0,0|2,0,0]=4 1059 B11R1.465 Cc1cnn(c1NCCO)C 233d657cc7c09b5f7dfda7a34babc866 [0,2,0,0,0,0|2,0,0]=4 1060 B11R1.465 Cc1n[nH]c(c1NCCO)C d7ece58847d005a1b21741e80ed55e17 [0,2,0,0,0,0|2,0,0]=4 1061 B11R1.465 Cc1n[nH]c(c1NCCO)Cl f9998bfcf415b188c55214ccf269c549 [0,2,0,0,0,0|2,0,0]=4 1062 B11R1.465 Cc1ncn(c1NCCF)C 65945ecc4c7a40fd9208a465825d06a8 [0,2,0,0,0,0|2,0,0]=4 1063 B11R1.465 Cc1ncn(c1NCCO)C 53d3045b314a9d713bdb9bbbac8c9524 [0,2,0,0,0,0|1,0,0]=3 1064 B11R1.465 Cc1ncn(c1NCCS)C 1c5f8ff60d94ba86ccce944bf88e5886 [0,2,0,0,0,0|1,1,0]=4 1065 B11R1.465 Cc1nnn(c1NCCO)C 679a30576828e32b8e09637027b560ed [0,2,0,0,0,0|2,0,0]=4 1066 B11R1.465 Cc1noc(c1CNCO)C 079c8d9e67ae6222c813f103f33fc8b8 [0,2,0,0,0,0|2,0,0]=4 1067 B11R1.465 Cc1noc(c1NCCO)C c70089e5959d7391a175d96cbad580d3 [0,2,0,0,0,0|2,0,0]=4 1068 B11R1.465 Cn1ncc(c1NCCO)Cl 9514406228a1c9b4107bd0b96e7f96b4 [0,2,0,0,0,0|2,0,0]=4 1069 B11R1.465 Cn1ncc(c1NCCO)I a8ebb0acc81613aeea558c75db18c619 [0,2,0,0,0,0|2,0,0]=4 1070 B11R1.465 Cn1ncc(c1NCCO)N e76d35f97f0b23224d1a84defe9d2566 [0,2,0,0,0,0|2,0,0]=4 1071 B11R2.15 CCN1Cc2ncsc2C1 b57b421bd9cd8d1582f35d66a649685f [0,1,0,1,0,0|1,0,0]=3 1072 B11R2.15 FCN1Cc2ncsc2C1 cfcc3e0c5405b5d07a54cce70fde8612 [0,1,0,1,0,0|1,0,0]=3 1073 B11R2.15 O=CN1Cc2ncsc2C1 355fd76f3d22cd6151d46a9dd0f855a5 [0,1,0,1,0,0|0,0,2]=4 1074 B11R2.15 OCN1Cc2ncsc2C1 76de56fd8926ae7428375f078d02119f [0,1,0,1,0,0|0,0,0]=2 1075 B11R2.115 Cc1ccsc1NC2CC2 379c13f08c0b8c74f28dd2d7a2da2cec [0,1,0,1,0,0|2,0,0]=4