0 B10R1.1 CCNc1ccc(nc1)C c6a305032b477973c3c3fbf0a9e4e681 [0,0,1,0,0,0|3,0,0]=4 1 B10R1.1 CCNc1cnc(nc1)Br 7b1bbd5d331434da1dc189fc2ddf49b7 [0,0,1,0,0,0|3,0,0]=4 2 B10R1.1 CCNc1cnc(nc1)C dbe594b14a04dd73ff8c9bcf511ef8e0 [0,0,1,0,0,0|2,0,0]=3 3 B10R1.1 CCNc1cnc(nc1)Cl b1ff6250e52182ef03fda4d6a9ffccaa [0,0,1,0,0,0|3,0,0]=4 4 B10R1.1 CCNc1cnc(nc1)I 5db750ec576a1c51623f1a79e3d99e73 [0,0,1,0,0,0|3,0,0]=4 5 B10R1.1 CCOc1ccc(nc1)C a681f7f0cc1b45047bb455631f3beced [0,0,1,0,0,0|3,0,0]=4 6 B10R1.1 CCOc1cnc(nc1)Br fa2c0fdb7e883c6004d644fad185f6d3 [0,0,1,0,0,0|3,0,0]=4 7 B10R1.1 CCOc1cnc(nc1)C d7956e7814c65fdaee661cddc1d6f6d3 [0,0,1,0,0,0|2,0,0]=3 8 B10R1.1 CCOc1cnc(nc1)Cl 72d1b4ea92a00fe1e697303076b2bf21 [0,0,1,0,0,0|3,0,0]=4 9 B10R1.1 Cc1ncc(cn1)NC=O 37d565fb8ea2c9e131f98e0f4c687cdb [0,0,1,0,0,0|3,0,0]=4 10 B10R1.1 Cc1ncc(cn1)NCF bb263139c3b425cdd635d4e951c03299 [0,0,1,0,0,0|3,0,0]=4 11 B10R1.1 Cc1ncc(cn1)NCO d0ddc7ade30da92e24de300fd39df6c6 [0,0,1,0,0,0|3,0,0]=4 12 B10R1.1 Cc1ncc(cn1)OCF 947b4018635fcce82d61ce43cad48f61 [0,0,1,0,0,0|3,0,0]=4 13 B10R1.10 CCNc1cccc(n1)C a6d43cd595c5eb0b178fe2416f91b131 [0,0,1,0,0,0|3,0,0]=4 14 B10R1.10 CCNc1ccnc(c1)C 58ebbaae6a202dff8555d7dd291a0bc7 [0,0,1,0,0,0|3,0,0]=4 15 B10R1.10 CCNc1ccnc(n1)Br a585973a8c919a7b09f709aed55cacdf [0,0,1,0,0,0|3,0,0]=4 16 B10R1.10 CCNc1ccnc(n1)C d168f3526a84c167c0cca101bf3886ab [0,0,1,0,0,0|2,0,0]=3 17 B10R1.10 CCNc1ccnc(n1)Cl 1dd9b7b7cc179cf8d98edf94a1fa1f77 [0,0,1,0,0,0|3,0,0]=4 18 B10R1.10 CCNc1ccnc(n1)F 3fe489000a1e48ed5042647c862eca0b [0,0,1,0,0,0|3,0,0]=4 19 B10R1.10 CCNc1ccnc(n1)S 803d5de29daf1b488485ba113a2fcec2 [0,0,1,0,0,0|3,0,0]=4 20 B10R1.10 CCNc1cnnc(n1)C 64ace7faec3fc6757e0acb4f488f1d70 [0,0,1,0,0,0|3,0,0]=4 21 B10R1.10 CCOc1cccc(n1)C 8886c898bef83c4de5a441ddd5f1e8cd [0,0,1,0,0,0|3,0,0]=4 22 B10R1.10 CCOc1ccnc(c1)C 4df81811aab21f04d442f5835764e2f5 [0,0,1,0,0,0|3,0,0]=4 23 B10R1.10 CCOc1ccnc(n1)C 75a439f9f8e7946ad9bf1fd305e7c9d8 [0,0,1,0,0,0|2,0,0]=3 24 B10R1.10 CCOc1ccnc(n1)Cl 91a4e1ace2a0e123093d0ccfd945c9d9 [0,0,1,0,0,0|3,0,0]=4 25 B10R1.10 Cc1nccc(n1)NC=O e84c30325902b0646d151aa501bd82b0 [0,0,1,0,0,0|3,0,0]=4 26 B10R1.10 Cc1nccc(n1)NCF ae775128cbd4c75c5149d9a20cf6d4a4 [0,0,1,0,0,0|3,0,0]=4 27 B10R1.10 Cc1nccc(n1)NCO 72183a9f3cc182d599dbd026e320f5d2 [0,0,1,0,0,0|3,0,0]=4 28 B10R1.10 Cc1nccc(n1)OCF ae76db9d85d4ab666b28b3243a4a24cd [0,0,1,0,0,0|3,0,0]=4 29 B9R1.8 CCNc1ccncn1 e04846be86a5c479e545d0cb402fe182 [1,0,1,0,0,0|2,0,0]=4 30 B9R1.8 CCNc1cncnc1 d22064ed1cc1956224a6568ef26d5099 [1,0,1,0,0,0|2,0,0]=4 31 B9R1.8 CCOc1cncnc1 8629022d8ea6564de249e44f3cfd1da9 [1,0,1,0,0,0|2,0,0]=4 32 B11R1.1 C#CCNc1cnc(nc1)C 99e1b8edfbc82eaa477de331d665b00b [0,1,1,0,0,0|1,0,1]=4 33 B11R1.1 C#CCOc1cnc(nc1)C 591d9ab784923f4fbdc64d74d4a68876 [0,1,1,0,0,0|1,0,1]=4 34 B11R1.1 C=CCNc1cnc(nc1)C aee0257849af4ae01b29c2f0bcf4cacc [0,1,1,0,0,0|1,0,1]=4 35 B11R1.1 C=CCOc1cnc(nc1)C 5477d8a63810d919d0ce13483f3bf9cd [0,1,1,0,0,0|1,0,1]=4 36 B11R1.1 CCCNc1ccc(nc1)C 7d88a307944adac731bde6f988e446cd [0,1,1,0,0,0|2,0,0]=4 37 B11R1.1 CCCNc1cnc(nc1)Br 94042efcb2b0d33e3e76c448f9d5cccd [0,1,1,0,0,0|2,0,0]=4 38 B11R1.1 CCCNc1cnc(nc1)C d7af60d153686f509764acc529f19253 [0,1,1,0,0,0|1,0,0]=3 39 B11R1.1 CCCNc1cnc(nc1)Cl 4f24105aa6c380fcfdb9255f6fd37f94 [0,1,1,0,0,0|2,0,0]=4 40 B11R1.1 CCCNc1cnc(nc1)I 7be86e7663ad025ab1392aef407906b0 [0,1,1,0,0,0|2,0,0]=4 41 B11R1.1 CCCOc1ccc(nc1)C e7dbc804100b6abbbe2b0f45f45546ba [0,1,1,0,0,0|2,0,0]=4 42 B11R1.1 CCCOc1cnc(nc1)Br 089be6ffa6a30d80a90401930a9a2322 [0,1,1,0,0,0|2,0,0]=4 43 B11R1.1 CCCOc1cnc(nc1)C e8644d69cee3d5c0d3bd283f9419e98c [0,1,1,0,0,0|1,0,0]=3 44 B11R1.1 CCCOc1cnc(nc1)Cl aa45ee548b3839327c402d72fe7240d7 [0,1,1,0,0,0|2,0,0]=4 45 B11R1.1 CCNCc1ccc(nc1)C be9f6396d87f569ee4a97d2c73536694 [0,1,1,0,0,0|2,0,0]=4 46 B11R1.1 CCNCc1cnc(nc1)C a0cd4797a47b54f1a46467cdaa74ef85 [0,1,1,0,0,0|1,0,0]=3 47 B11R1.1 CCNCc1cnc(nc1)Cl 00a66ddee8886588d4ccbb06a1b75b8c [0,1,1,0,0,0|2,0,0]=4 48 B11R1.1 CCOCc1ccc(nc1)C a880cc0302e1c9d4e4d89c1a296d8d06 [0,1,1,0,0,0|1,1,0]=4 49 B11R1.1 CCOCc1cnc(nc1)Br da10aeb763c8bfaeab9b9aa85c7fc1dc [0,1,1,0,0,0|1,1,0]=4 50 B11R1.1 CCOCc1cnc(nc1)C 3ce2eed4e3810f8f9ccf57821d8d4e5c [0,1,1,0,0,0|0,1,0]=3 51 B11R1.1 CCOCc1cnc(nc1)Cl 7cfe2b7d0c63b0dd104d17051d62e2cf [0,1,1,0,0,0|1,1,0]=4 52 B11R1.1 COCNc1ccc(nc1)C f292d8e7950b5c4d802142ace58c7355 [0,1,1,0,0,0|1,1,0]=4 53 B11R1.1 COCNc1cnc(nc1)Br 411d5525b4fa95dccc38348e421175aa [0,1,1,0,0,0|1,1,0]=4 54 B11R1.1 COCNc1cnc(nc1)C ec4876fdb9ea674cb3ad3540b9c2246a [0,1,1,0,0,0|0,1,0]=3 55 B11R1.1 COCNc1cnc(nc1)Cl 4c830565c072e94cdf47599a9949292b [0,1,1,0,0,0|1,1,0]=4 56 B11R1.1 COCNc1cnc(nc1)I 8a79537b124f259d7dffb3cf61609844 [0,1,1,0,0,0|1,1,0]=4 57 B11R1.1 COCOc1ccc(nc1)C 67dbeac8ce2d0a66189b3e7d9573b367 [0,1,1,0,0,0|1,1,0]=4 58 B11R1.1 COCOc1cnc(nc1)Br 69e2107c0e3b0f38216cd7efaff9e7b4 [0,1,1,0,0,0|1,1,0]=4 59 B11R1.1 COCOc1cnc(nc1)C fa5cdcf151bf24cfb63e951238dc42d4 [0,1,1,0,0,0|0,1,0]=3 60 B11R1.1 COCOc1cnc(nc1)Cl a08aba6dd530a941dbc279bd9d956081 [0,1,1,0,0,0|1,1,0]=4 61 B11R1.1 CSCNc1ccc(cc1)C 7cc547f88ae9a9501b6ce615095d8aea [0,1,1,0,0,0|2,0,0]=4 62 B11R1.1 CSCNc1ccc(nc1)Br 6a609440b229d0b06de8f79f20e90478 [0,1,1,0,0,0|2,0,0]=4 63 B11R1.1 CSCNc1ccc(nc1)C 3e2aaf6e003a3767539d4b7570883155 [0,1,1,0,0,0|1,0,0]=3 64 B11R1.1 CSCNc1ccc(nc1)Cl 00441936874621936042ff7229e394eb [0,1,1,0,0,0|2,0,0]=4 65 B11R1.1 CSCNc1ccc(nc1)F 59038a01298afe984646cd59d604ccfe [0,1,1,0,0,0|2,0,0]=4 66 B11R1.1 CSCNc1ccc(nc1)I 65b43c6bdcf6ea95fd2666b65cb6a0f7 [0,1,1,0,0,0|2,0,0]=4 67 B11R1.1 CSCNc1ccc(nn1)C 360d60a2ac5e29c92e79ab5b1a9a04fb [0,1,1,0,0,0|2,0,0]=4 68 B11R1.1 CSCNc1cnc(cn1)C c24fd09b3ea24e803bb51a1280bea81a [0,1,1,0,0,0|2,0,0]=4 69 B11R1.1 CSCNc1cnc(nc1)Br 3c93cfa1935ea982928e8cbe6fb4de12 [0,1,1,0,0,0|1,0,0]=3 70 B11R1.1 CSCNc1cnc(nc1)C bd033e21473d8c39895015d2ed893377 [0,1,1,0,0,0|0,0,0]=2 71 B11R1.1 CSCNc1cnc(nc1)Cl c924ea417c9c51c0d0a4f2d46b0b686f [0,1,1,0,0,0|1,0,0]=3 72 B11R1.1 CSCNc1cnc(nc1)I d1f8949ff3b89127e5068164de933277 [0,1,1,0,0,0|1,0,0]=3 73 B11R1.1 CSCOc1ccc(cc1)C 35277f269b6e4bad5ee1cc6923a583fd [0,1,1,0,0,0|2,0,0]=4 74 B11R1.1 CSCOc1ccc(nc1)Br 78fdb59d6147dc2019e0a9b544f5eaf0 [0,1,1,0,0,0|2,0,0]=4 75 B11R1.1 CSCOc1ccc(nc1)C 6f8114890842d135092685d5d6777a64 [0,1,1,0,0,0|1,0,0]=3 76 B11R1.1 CSCOc1ccc(nc1)Cl 5d811a91df457bcf86d230ee079bbd08 [0,1,1,0,0,0|2,0,0]=4 77 B11R1.1 CSCOc1ccc(nc1)F de88ffba7cf9851ecec71607a72fd7cd [0,1,1,0,0,0|2,0,0]=4 78 B11R1.1 CSCOc1ccc(nc1)I 89a292478202e53919068cdff48480a8 [0,1,1,0,0,0|2,0,0]=4 79 B11R1.1 CSCOc1ccc(nn1)C fbd2ec0567e4bfceae284870bd206aa1 [0,1,1,0,0,0|2,0,0]=4 80 B11R1.1 CSCOc1cnc(cn1)C 71270f8fd091b1f58683f862118ded52 [0,1,1,0,0,0|2,0,0]=4 81 B11R1.1 CSCOc1cnc(nc1)Br f397d785e2e8b91e749285979900da55 [0,1,1,0,0,0|1,0,0]=3 82 B11R1.1 CSCOc1cnc(nc1)C 609491fb0bcd71d6a0b0acaf62751781 [0,1,1,0,0,0|0,0,0]=2 83 B11R1.1 CSCOc1cnc(nc1)Cl 317de757021b9035bf19ea539e281e1a [0,1,1,0,0,0|1,0,0]=3 84 B11R1.1 Cc1ccc(cn1)CNCF 0cc4818483a961efd54405e647f545e7 [0,1,1,0,0,0|2,0,0]=4 85 B11R1.1 Cc1ccc(cn1)CNCO dee3af3568e11618521f283cbcaf609a [0,1,1,0,0,0|2,0,0]=4 86 B11R1.1 Cc1ccc(cn1)COCF 7dec6859a8025db27e45799679442682 [0,1,1,0,0,0|1,1,0]=4 87 B11R1.1 Cc1ncc(cn1)CNC#N 9b488ef160ea8b47f3c9a4f67f4fddcd [0,1,1,0,0,0|1,0,1]=4 88 B11R1.1 Cc1ncc(cn1)CNC=O 9d4214027e7f3b43681103a2f9f5a916 [0,1,1,0,0,0|1,0,1]=4 89 B11R1.1 Cc1ncc(cn1)CNCO 8fc4d9eea8092a5e7ea616f1ec855276 [0,1,1,0,0,0|1,0,0]=3 90 B11R1.1 Cc1ncc(cn1)COCF d229854c33db4b7b3a04194c2ef6e950 [0,1,1,0,0,0|0,1,0]=3 91 B11R1.1 Cc1ncc(cn1)NCC#N 068010b68aa2f347b21071eec45d9179 [0,1,1,0,0,0|2,0,0]=4 92 B11R1.1 Cc1ncc(cn1)NCC=O e8f762a7bbe46d1386b9cc3bb5abe85d [0,1,1,0,0,0|2,0,0]=4 93 B11R1.1 Cc1ncc(cn1)NCCF adf2b4778cdd6cf01d749154fe625ee4 [0,1,1,0,0,0|2,0,0]=4 94 B11R1.1 Cc1ncc(cn1)NCCO caffeaf42f2316cd55987b80efa9e271 [0,1,1,0,0,0|2,0,0]=4 95 B11R1.1 Cc1ncc(cn1)NCCS 57dbde96212ed0cef54e66e31615be73 [0,1,1,0,0,0|2,0,0]=4 96 B11R1.1 Cc1ncc(cn1)OCC#N da6db76083edac4cde15a88876d61d22 [0,1,1,0,0,0|2,0,0]=4 97 B11R1.1 Cc1ncc(cn1)OCC=O 20dcd75ae4542b52427e70fd7cbc854a [0,1,1,0,0,0|2,0,0]=4 98 B11R1.1 Cc1ncc(cn1)OCCF 10b0bb10d34992968204f6f060ad84cd [0,1,1,0,0,0|2,0,0]=4 99 B11R1.1 Cc1ncc(cn1)OCCS cfba9faf2dc7ac9939f3d9a99f4340a9 [0,1,1,0,0,0|2,0,0]=4 100 B11R1.1 FCNCc1cnc(nc1)Cl ee4234b3f9b48b78d672178209ddde09 [0,1,1,0,0,0|2,0,0]=4 101 B11R1.1 FCOCc1cnc(nc1)Br 715df309bb99152240f029ee0afe3ee3 [0,1,1,0,0,0|1,1,0]=4 102 B11R1.1 FCOCc1cnc(nc1)Cl 2ec9cb504b08a74732f83adf90ad140b [0,1,1,0,0,0|1,1,0]=4 103 B11R1.1 OCNCc1cnc(nc1)Cl 8e1ba5d276407ff88bce32740a69de2f [0,1,1,0,0,0|2,0,0]=4 104 B11R1.20 Cc1ncc(cn1)NC(C)C 5670a0984e7163331880fbed117040f8 [0,1,1,0,0,0|2,0,0]=4 105 B11R1.20 Cc1ncc(cn1)OC(C)C c8623025f78d21d543d230fe689706e7 [0,1,1,0,0,0|2,0,0]=4 106 B11R1.81 CCNc1cnc(nc1C)C 7d73ddf799253a0a54a16486da338d22 [0,1,1,0,0,0|2,0,0]=4 107 B11R1.81 CCNc1cnc(nc1Cl)C e781e28342c8c9ce30c1c63c87ae9f29 [0,1,1,0,0,0|2,0,0]=4 108 B11R1.81 CCOc1cnc(nc1C)C 7a8d6b2fb705ca3100cd19a67d4809d1 [0,1,1,0,0,0|2,0,0]=4 109 B11R1.83 CCNc1cnc(nc1)CC ea81a24da6ebc5751ac1af1d4dd04620 [0,1,1,0,0,0|2,0,0]=4 110 B11R1.83 CCNc1cnc(nc1)CO 4ba05e2805f36d3d113ffc69d73cd38f [0,1,1,0,0,0|2,0,0]=4 111 B11R1.83 CCNc1cnc(nc1)OC 3c8d15c0fe2cffc16be4aa9092baec6e [0,1,1,0,0,0|2,0,0]=4 112 B11R1.83 CCNc1cnc(nc1)SC 416a7a6832c2b5b5380da1ea0d6a013f [0,1,1,0,0,0|2,0,0]=4 113 B11R1.83 CCOc1cnc(nc1)CF 3fee3381c1c6d5efb37ec2b4e7679ae3 [0,1,1,0,0,0|2,0,0]=4 114 B11R1.83 CCOc1cnc(nc1)OC 4d20e0e82d1b41d74367ad3908dd935c [0,1,1,0,0,0|2,0,0]=4 115 B11R1.83 CCOc1cnc(nc1)SC 84e278a931a0822fac52e4e636de3e25 [0,1,1,0,0,0|2,0,0]=4 116 B11R1.24 C#CCNc1ccnc(n1)C d70323cf20354e4853bb5c30dce8496a [0,1,1,0,0,0|1,0,1]=4 117 B11R1.24 C#CCOc1ccnc(n1)C f6f41679900b17139440c6853014bed1 [0,1,1,0,0,0|1,0,1]=4 118 B11R1.24 C=CCNc1ccnc(n1)C 1ac67376fe8520054bdf93030ec0d16d [0,1,1,0,0,0|1,0,1]=4 119 B11R1.24 C=CCOc1ccnc(n1)C cc0074fbd1c501d3ee467ba928bf2dbb [0,1,1,0,0,0|1,0,1]=4 120 B11R1.24 CCCNc1cccc(n1)C ac360e9e258569f548399e28fa3180d8 [0,1,1,0,0,0|2,0,0]=4 121 B11R1.24 CCCNc1ccnc(c1)C b66f498b52f5cbd7e72f509e0a6f41be [0,1,1,0,0,0|2,0,0]=4 122 B11R1.24 CCCNc1ccnc(n1)Br fa977abbc6d9cff2c3ae03758bad3270 [0,1,1,0,0,0|2,0,0]=4 123 B11R1.24 CCCNc1ccnc(n1)C 3aba40c76e38d5e5b178926b1611aad5 [0,1,1,0,0,0|1,0,0]=3 124 B11R1.24 CCCNc1ccnc(n1)Cl c96f4af2b89fd7e023f65403b41e6c3e [0,1,1,0,0,0|2,0,0]=4 125 B11R1.24 CCCNc1ccnc(n1)F 6488712c4a4fa17bbe8c2dcf794ea8ed [0,1,1,0,0,0|2,0,0]=4 126 B11R1.24 CCCNc1ccnc(n1)S ae0314785915cd696e265596a76d89ff [0,1,1,0,0,0|2,0,0]=4 127 B11R1.24 CCCNc1cnnc(n1)C de5d854934181abf5a97df5c6bfd3e21 [0,1,1,0,0,0|2,0,0]=4 128 B11R1.24 CCCOc1cccc(n1)C 39c146d9d455282915fb415280d9321f [0,1,1,0,0,0|2,0,0]=4 129 B11R1.24 CCCOc1ccnc(c1)C fb2ea1b15a9dd2b3d4e9dfb65ec1523f [0,1,1,0,0,0|2,0,0]=4 130 B11R1.24 CCCOc1ccnc(n1)C 2daef3bcca61affddd659cb8093de78c [0,1,1,0,0,0|1,0,0]=3 131 B11R1.24 CCCOc1ccnc(n1)Cl 4013358112d99c5824b106c92e0dc790 [0,1,1,0,0,0|2,0,0]=4 132 B11R1.24 CCNCc1cccc(n1)C 152e97bb6eb9a6a331f50dff3115da53 [0,1,1,0,0,0|2,0,0]=4 133 B11R1.24 CCNCc1ccnc(c1)C 7d2184712237385ae4b34f01a3fd0b0c [0,1,1,0,0,0|2,0,0]=4 134 B11R1.24 CCNCc1ccnc(n1)C 0f8f456432ce41f11e5f9f5897bc38f3 [0,1,1,0,0,0|1,0,0]=3 135 B11R1.24 CCOCc1cccc(n1)C 28a36ef1d20cbd44690d599ab87bdc5f [0,1,1,0,0,0|1,1,0]=4 136 B11R1.24 CCOCc1ccnc(c1)C d26a680f89e28ac8a7fa03bb8fe9903c [0,1,1,0,0,0|1,1,0]=4 137 B11R1.24 CCOCc1ccnc(n1)C 677d8c08e328514263ff0ac51349ebac [0,1,1,0,0,0|0,1,0]=3 138 B11R1.24 CCOCc1ccnc(n1)Cl 51dee434d948e123cd309c5f43d1d44c [0,1,1,0,0,0|1,1,0]=4 139 B11R1.24 COCNc1cccc(n1)C be3044ceb0ac6b2a92548da526a4558a [0,1,1,0,0,0|1,1,0]=4 140 B11R1.24 COCNc1ccnc(c1)C 1811146363430dd89ec6b80f6a37da8c [0,1,1,0,0,0|1,1,0]=4 141 B11R1.24 COCNc1ccnc(n1)Br ade708b34a4735ffa744ab1d6f7e3de4 [0,1,1,0,0,0|1,1,0]=4 142 B11R1.24 COCNc1ccnc(n1)C 845dfe85ae41d7a2853cb269cf8cd45e [0,1,1,0,0,0|0,1,0]=3 143 B11R1.24 COCNc1ccnc(n1)Cl 9ccdc3308b8b069b939f022f3d1fa7d6 [0,1,1,0,0,0|1,1,0]=4 144 B11R1.24 COCNc1ccnc(n1)F 482595b767f6184727b55545b02d2662 [0,1,1,0,0,0|1,1,0]=4 145 B11R1.24 COCNc1ccnc(n1)S 1a72c178b165d5cf7e5009344a4317a0 [0,1,1,0,0,0|1,1,0]=4 146 B11R1.24 COCNc1cnnc(n1)C 6065ea1902eea6bf5fbb2d0b82ff615f [0,1,1,0,0,0|1,1,0]=4 147 B11R1.24 COCOc1cccc(n1)C fdff37993ec0f9f87123e33942d46a32 [0,1,1,0,0,0|1,1,0]=4 148 B11R1.24 COCOc1ccnc(c1)C d896b3ff0683e270a34b09cd84bf786f [0,1,1,0,0,0|1,1,0]=4 149 B11R1.24 COCOc1ccnc(n1)C fe4444303d1c57660c8ffd6866ec67cb [0,1,1,0,0,0|0,1,0]=3 150 B11R1.24 COCOc1ccnc(n1)Cl 2dd26efe996b2bf1378f3bb7d14a42ea [0,1,1,0,0,0|1,1,0]=4 151 B11R1.24 CSCNc1cc(ncn1)C d2d9f080b058eb6d684a72c3dbcef347 [0,1,1,0,0,0|2,0,0]=4 152 B11R1.24 CSCNc1cc[nH]c(=O)n1 38eeb90d5cfefd639602783de1f74d1b [0,1,1,0,0,0|1,0,1]=4 153 B11R1.24 CSCNc1cccc(c1)C c0825a11246fc57479dbaf679e542a1e [0,1,1,0,0,0|2,0,0]=4 154 B11R1.24 CSCNc1cccc(n1)Br 2c83887440e46bac8434e5134018863d [0,1,1,0,0,0|2,0,0]=4 155 B11R1.24 CSCNc1cccc(n1)C 75461631c24f8880a127b1a36251a2bb [0,1,1,0,0,0|1,0,0]=3 156 B11R1.24 CSCNc1cccc(n1)F 843bd2ecc7e55bd6274d61364e4e1e97 [0,1,1,0,0,0|2,0,0]=4 157 B11R1.24 CSCNc1cccc(n1)I fa81b640f7e964620d7adf874a9ca42c [0,1,1,0,0,0|2,0,0]=4 158 B11R1.24 CSCNc1ccnc(c1)Br f4699c0ac3f2c664539e774cba512632 [0,1,1,0,0,0|2,0,0]=4 159 B11R1.24 CSCNc1ccnc(c1)C c7b0e8d7d1b3944365c00cd26ebbe6fa [0,1,1,0,0,0|1,0,0]=3 160 B11R1.24 CSCNc1ccnc(c1)Cl fd4810bb7cfddd000c5ef54e28ed0d05 [0,1,1,0,0,0|2,0,0]=4 161 B11R1.24 CSCNc1ccnc(c1)F a18b9f124d05ed39d2810f35e7c521fd [0,1,1,0,0,0|2,0,0]=4 162 B11R1.24 CSCNc1ccnc(c1)I 5ba9d7539c2617e40033d71121becefb [0,1,1,0,0,0|2,0,0]=4 163 B11R1.24 CSCNc1ccnc(n1)Br 43033e80c610f32bbbbd7ab83f627aed [0,1,1,0,0,0|1,0,0]=3 164 B11R1.24 CSCNc1ccnc(n1)C 5ec7e6cafac2234cea25b17d44cac095 [0,1,1,0,0,0|0,0,0]=2 165 B11R1.24 CSCNc1ccnc(n1)Cl 29604fd52823294cd83c70585a1e92ed [0,1,1,0,0,0|1,0,0]=3 166 B11R1.24 CSCNc1ccnc(n1)F afdf316149d93bd6da8476c83f3ea99d [0,1,1,0,0,0|1,0,0]=3 167 B11R1.24 CSCNc1ccnc(n1)S e2b1de94c5b43bf7867cfb11e20724f5 [0,1,1,0,0,0|1,0,0]=3 168 B11R1.24 CSCNc1cnnc(n1)C 774e29f1a22049f70997dbbdd8298ef6 [0,1,1,0,0,0|1,0,0]=3 169 B11R1.24 CSCNc1cnnc(n1)Cl f16c6826dde1e1d9256d95a401187e6d [0,1,1,0,0,0|2,0,0]=4 170 B11R1.24 CSCNc1nccc(n1)C 16c4c6024d97556146c46599a8111068 [0,1,1,0,0,0|2,0,0]=4 171 B11R1.24 CSCNc1ncnc(n1)Cl f6968eb5114b8849f877ed31a802a4bd [0,1,1,0,0,0|2,0,0]=4 172 B11R1.24 CSCOc1cc(ncn1)C c1c101bc28b633cbdab0cb87c93814ca [0,1,1,0,0,0|2,0,0]=4 173 B11R1.24 CSCOc1cccc(c1)C 3bbece07bfd11b6c7fccb7bd794595e6 [0,1,1,0,0,0|2,0,0]=4 174 B11R1.24 CSCOc1cccc(n1)Br adf643fe9b877dfeed3d0b1ba4335256 [0,1,1,0,0,0|2,0,0]=4 175 B11R1.24 CSCOc1cccc(n1)C 0e5e219e6e56059f9820074336b83010 [0,1,1,0,0,0|1,0,0]=3 176 B11R1.24 CSCOc1cccc(n1)F 42143d365a182477003511c6587dfea5 [0,1,1,0,0,0|2,0,0]=4 177 B11R1.24 CSCOc1ccnc(c1)Br f7bb32b619d2a25ae3d12efd90805774 [0,1,1,0,0,0|2,0,0]=4 178 B11R1.24 CSCOc1ccnc(c1)C a3e4d842d5e2076ede81ff72719014b5 [0,1,1,0,0,0|1,0,0]=3 179 B11R1.24 CSCOc1ccnc(c1)Cl c444686bce4202fef14e96fa9a4221f5 [0,1,1,0,0,0|2,0,0]=4 180 B11R1.24 CSCOc1ccnc(c1)F 32720fbd4eace1c7a04b2ac05f2c8ef3 [0,1,1,0,0,0|2,0,0]=4 181 B11R1.24 CSCOc1ccnc(n1)C e293d9f1b875ebbd95cc7585c5f3d21a [0,1,1,0,0,0|0,0,0]=2 182 B11R1.24 CSCOc1ccnc(n1)Cl 0e061d9ad6cdfedbb1e6b57650e00837 [0,1,1,0,0,0|1,0,0]=3 183 B11R1.24 CSCOc1cncc(n1)C 974dcf491a63584a8fff5791f598f424 [0,1,1,0,0,0|2,0,0]=4 184 B11R1.24 Cc1cc(ccn1)CNCF 84efdf8898b3954d41c47b5aecfaa510 [0,1,1,0,0,0|2,0,0]=4 185 B11R1.24 Cc1cc(ccn1)CNCO 220fd9dc96cf7acc9670e8e8f858e714 [0,1,1,0,0,0|2,0,0]=4 186 B11R1.24 Cc1cc(ccn1)COCF 3d6c010790e9d96177af19abcae2e406 [0,1,1,0,0,0|1,1,0]=4 187 B11R1.24 Cc1cccc(n1)CNCF 05a62d73686ee79fd8505033ca49baa7 [0,1,1,0,0,0|2,0,0]=4 188 B11R1.24 Cc1cccc(n1)CNCO fe42a0006039c5b282c8b0832528d029 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.24 Cc1cccc(n1)COCF df2174f806dfe5ac9f4371901df5434b [0,1,1,0,0,0|1,1,0]=4 190 B11R1.24 Cc1nccc(n1)CNC=O 06cdccc57890d25fdfce672836435032 [0,1,1,0,0,0|1,0,1]=4 191 B11R1.24 Cc1nccc(n1)CNCF a9c1f4556dc1d3f42d2857e648d2753d [0,1,1,0,0,0|1,0,0]=3 192 B11R1.24 Cc1nccc(n1)CNCO 87799b1e4ed63c4e75aa37554ab0e812 [0,1,1,0,0,0|1,0,0]=3 193 B11R1.24 Cc1nccc(n1)COCF a2db88671ccc88077db62cece8894da2 [0,1,1,0,0,0|0,1,0]=3 194 B11R1.24 Cc1nccc(n1)NCC#N 10dd93577203d175dd43b7e1e465da77 [0,1,1,0,0,0|2,0,0]=4 195 B11R1.24 Cc1nccc(n1)NCC=O 135b51ae4e27cbccbf0f26edfaecd5c6 [0,1,1,0,0,0|2,0,0]=4 196 B11R1.24 Cc1nccc(n1)NCCF 3906ef4e638d16c6b5cc67dc40e24dfc [0,1,1,0,0,0|2,0,0]=4 197 B11R1.24 Cc1nccc(n1)NCCO 738aadfd5bf9a662ece3a86a1b78b50d [0,1,1,0,0,0|2,0,0]=4 198 B11R1.24 Cc1nccc(n1)NCCS 79445aa126c0301374592152810f1951 [0,1,1,0,0,0|2,0,0]=4 199 B11R1.24 Cc1nccc(n1)OCC#N 99be64b8e6ee7677c9ff2e2e479c34c0 [0,1,1,0,0,0|2,0,0]=4 200 B11R1.24 Cc1nccc(n1)OCC=O be674437aa89937770359bec7decd1f9 [0,1,1,0,0,0|2,0,0]=4 201 B11R1.24 Cc1nccc(n1)OCCF afca05f1a119e2449294e5865931ab30 [0,1,1,0,0,0|2,0,0]=4 202 B11R1.24 Cc1nccc(n1)OCCS 4570f5b6116c9ea5107ebf7ed7ac58b9 [0,1,1,0,0,0|2,0,0]=4 203 B11R1.24 FCOCc1ccnc(n1)Cl eaec09905d1284d5ef1844a36beabcc8 [0,1,1,0,0,0|1,1,0]=4 204 B11R1.34 CCNc1cc(nc(n1)C)Br a6584690b753f14d0ca97e5ef9fe0f59 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.34 CCNc1cc(nc(n1)C)C 87c23d0f9f7fb65814170a057495bec5 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.34 CCNc1cc(nc(n1)C)Cl 094bb4cc32c3bff327786d37a7bbe13d [0,1,1,0,0,0|2,0,0]=4 207 B11R1.34 CCNc1cc(nc(n1)C)I ddc9a0946cbc58a52dbf594ce5eabf37 [0,1,1,0,0,0|2,0,0]=4 208 B11R1.34 CCOc1cc(nc(n1)C)Br 3721cad4e77f4d0521c133f9cfc4bcc7 [0,1,1,0,0,0|2,0,0]=4 209 B11R1.34 CCOc1cc(nc(n1)C)C 4f115775fa592125850377251088ba7d [0,1,1,0,0,0|2,0,0]=4 210 B11R1.34 CCOc1cc(nc(n1)C)Cl bfa1bb8b43cb1c37daa6f14f67502c7d [0,1,1,0,0,0|2,0,0]=4 211 B11R1.157 CC(=O)Nc1ccnc(n1)C a99fb752268446820ef6d543ffd6e63c [0,1,1,0,0,0|2,0,0]=4 212 B11R1.157 Cc1nccc(n1)NC(C)C 3a9428fcaf13437ef4b5516937990bcd [0,1,1,0,0,0|2,0,0]=4 213 B11R1.157 Cc1nccc(n1)OC(C)C 46a7711b5129a14c339de4512deb786a [0,1,1,0,0,0|2,0,0]=4 214 B11R1.182 CCNc1nc(ncc1Br)C d3d1eae742cbab0e357b5fa8081ddcd6 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.182 CCNc1nc(ncc1C)C b0db7dcfe7228723495cd29b43cdb16d [0,1,1,0,0,0|2,0,0]=4 216 B11R1.182 CCNc1nc(ncc1Cl)C ded544e2d606f6a52a2ee6e3bff4d040 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.182 CCNc1nc(ncc1F)C f50ad1378467470a9566838f632ec053 [0,1,1,0,0,0|2,0,0]=4 218 B11R1.182 CCOc1nc(ncc1Br)C 0c7143042a54618aaef823bc67e6402f [0,1,1,0,0,0|2,0,0]=4 219 B11R1.182 CCOc1nc(ncc1C)C b502623712b695fbbae0a7d407a614fa [0,1,1,0,0,0|2,0,0]=4 220 B11R1.182 CCOc1nc(ncc1F)C d1cb410115f04e6ec85d063caafcc4d7 [0,1,1,0,0,0|2,0,0]=4 221 B11R1.182 CCOc1nc(ncc1I)C b2ab28bfd1ba3ddd0552450fd3396449 [0,1,1,0,0,0|2,0,0]=4 222 B11R1.189 CCNc1ccnc(n1)CCl 32ae96d3684109dafc4db70d6772f084 [0,1,1,0,0,0|2,0,0]=4 223 B11R1.189 CCNc1ccnc(n1)OC c6f079ca14126ca7f1eb9231ce5dc9b4 [0,1,1,0,0,0|2,0,0]=4 224 B11R1.189 CCNc1ccnc(n1)SC e80b9c13bf6f3d994b9e501e712ee2ae [0,1,1,0,0,0|2,0,0]=4 225 B11R1.189 CCOc1ccnc(n1)CC 2de1ebe65e8f6a2d5439b7cde7f7fd69 [0,1,1,0,0,0|2,0,0]=4 226 B11R1.189 CCOc1ccnc(n1)OC 0109eeabea61b1a7d9519be31a341445 [0,1,1,0,0,0|2,0,0]=4 227 B13R2.449 CCNc1ccc2c(n1)CCC2 e186855fc72d2150cf238c4ad5fb3ad5 [0,2,0,0,0,0|2,0,0]=4 228 B13R2.449 CCNc1ncc2c(n1)CCC2 5110d3d26365a2f98d64c68ab5373525 [0,2,0,0,0,0|1,0,0]=3 229 B13R2.449 CCNc1ncc2c(n1)OCC2 b374768158d671cd1f88dde8f8047486 [0,2,0,0,0,0|2,0,0]=4 230 B13R2.449 CCOc1ccc2c(n1)CCC2 723a7ccc2db40ca7daaf49a6582acc78 [0,2,0,0,0,0|2,0,0]=4 231 B13R2.449 FCNc1ccc2c(n1)CCC2 5d0d0401c9de70913adce711dc482a40 [0,2,0,0,0,0|2,0,0]=4 232 B13R2.449 FCNc1ncc2c(n1)CCC2 80ce1641773b95d3ca3baeb8386a68d9 [0,2,0,0,0,0|1,0,0]=3 233 B13R2.449 FCNc1ncc2c(n1)OCC2 bb3cedbcf54868ade9e9666a74e8133a [0,2,0,0,0,0|2,0,0]=4 234 B13R2.449 FCOc1ccc2c(n1)CCC2 8b6599cfaa9444b103f5e8f87eb57ec1 [0,2,0,0,0,0|2,0,0]=4 235 B13R2.449 OCNc1ccc2c(n1)CCC2 581e5b7977884a6f70f79e6b188e9e5b [0,2,0,0,0,0|2,0,0]=4 236 B13R2.449 OCNc1ncc2c(n1)CCC2 865fe346c0d7b89674f906481bad37d1 [0,2,0,0,0,0|1,0,0]=3 237 B13R2.449 OCNc1ncc2c(n1)OCC2 b4afe0ec972c7ad16199a3ced8cef8e2 [0,2,0,0,0,0|2,0,0]=4 238 B13R2.43 CCN1Cc2ccc(nc2C1)C e32ba5443344cc9ad47a1e92ead7a163 [0,2,0,0,0,0|2,0,0]=4 239 B13R2.43 CCN1Cc2cnc(nc2C1)C 56dc0a120a6857192e562bca087fa548 [0,2,0,0,0,0|1,0,0]=3 240 B13R2.43 Cc1cc2c(cn1)CN(C2)C=O c64b833b601f05013283b3d3c62ee221 [0,2,0,0,0,0|2,0,0]=4 241 B13R2.43 Cc1ccc2c(n1)CN(C2)C=O 8e7c387369bddd0c6cee6ba5c8266e73 [0,2,0,0,0,0|2,0,0]=4 242 B13R2.43 Cc1ccc2c(n1)CN(C2)CF 5b539f6bbe6aa40d86e5986cb31cf772 [0,2,0,0,0,0|2,0,0]=4 243 B13R2.43 Cc1ccc2c(n1)CN(C2)CO bfbe1342a5da8009018ceec67b03042e [0,2,0,0,0,0|2,0,0]=4 244 B13R2.43 Cc1ncc2c(n1)CN(C2)C=O 476e0ee02dd2f70312f96b0dfd96272f [0,2,0,0,0,0|1,0,0]=3 245 B13R2.43 Cc1ncc2c(n1)CN(C2)CF 8f5cbb3d77b6a1c661afebde2d8fdf32 [0,2,0,0,0,0|1,0,0]=3 246 B13R2.43 Cc1ncc2c(n1)CN(C2)CO b660cce3273a2580e246d9b98391b5a6 [0,2,0,0,0,0|1,0,0]=3