0 B11R1.172 C/C(=C/CNc1cocn1)/I 535d3793aa37b86c8ca5ed64f674e4e8 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.172 C/C(=C/CNc1cscn1)/I 889be8c653df4fa156dffcf0870ad2b8 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.172 C/C(=C/CNc1nc[nH]n1)/I 60ecce82cbc2494db63b23d838ed36d6 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.172 C/C(=C/COc1c[nH]cn1)/I 78ffb4c4b493b120a833590f418e4c32 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.172 C/C(=C\CNc1cocn1)/Cl 3918900e2ba0ab7000eb9e05c3a5316f [0,0,0,0,0,0|4,0,0]=4 5 B11R1.172 C/C(=C\CNc1cscn1)/Cl 544de1bbfd6183987acee3c6ba7427a5 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.172 C/C(=C\CNc1nc[nH]n1)/Cl cd3ec3bf09561603523af41c5046e6ed [0,0,0,0,0,0|4,0,0]=4 7 B11R1.172 C/C(=C\COc1c[nH]cn1)/Cl dde4ca5bd5a1d72feb7e553da6da8a40 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.172 C=C(C)CCNc1c[nH]cn1 849283e3f26224ab91de6d344bf3e469 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.172 C=C(C)CCNc1cscn1 c48334e7b07ead235f556f1297132cba [0,0,0,0,0,0|4,0,0]=4 10 B11R1.172 C=C(C)CCNc1nc[nH]n1 b1f008e07cf313a7f457667e259b702d [0,0,0,0,0,0|4,0,0]=4 11 B11R1.172 C=C(C)CCOc1c[nH]cn1 470e19f38e69ac261b0582927ab34edd [0,0,0,0,0,0|3,0,0]=3 12 B11R1.172 C=C(C)CNCc1c[nH]nn1 3137dcc780975994bebc5b9f19d024f1 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.172 C=C(C)CNCc1cc[nH]c1 50f2aa4e3c39a54dd13e762971262f6d [0,0,0,0,0,0|4,0,0]=4 14 B11R1.172 C=C(C)CNCc1cocn1 af54ee321741c53920837d351adf9e58 [0,0,0,0,0,0|4,0,0]=4 15 B11R1.172 C=C(C)CNCc1cscn1 4ad540f3a947767068a882aaaf78a231 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.172 C=C(C)COCc1cc[nH]c1 61d39546d4dd213878c11941a46e8520 [0,0,0,0,0,0|4,0,0]=4 17 B11R1.172 C=C(C)COCc1cocn1 b2a42310785b919199ea33315d0ce3e3 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.172 C=C(C)COCc1cscn1 327b550de8b63d931c25c5dedf369d7f [0,0,0,0,0,0|4,0,0]=4 19 B11R1.172 C=C(C)COCc1nc[nH]n1 c16a672be4812b96d41dfdc2ebdb889f [0,0,0,0,0,0|4,0,0]=4 20 B11R1.172 CC(=CCNc1c[nH]cn1)C 407ffa674f3acd9b2e06db8d42f8d438 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.172 CC(=CCNc1c[nH]nn1)C 78b2287c3e3b2b88182f41eb6c2427d8 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.172 CC(=CCNc1cocn1)C 84cbcfdbd1ddf4db7e935b3a31c510b6 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.172 CC(=CCNc1cocn1)Cl 7741ab652b233c6da6518a915d960c20 [0,0,0,0,0,0|4,0,0]=4 24 B11R1.172 CC(=CCNc1cocn1)I dea3d1d316fdbc2cfdd276c8820eaa31 [0,0,0,0,0,0|4,0,0]=4 25 B11R1.172 CC(=CCNc1cscn1)C 78bf19b137feabdd8490e2e77ecf6c17 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.172 CC(=CCNc1cscn1)Cl 329d56719516b0993c3182613c50c669 [0,0,0,0,0,0|4,0,0]=4 27 B11R1.172 CC(=CCNc1cscn1)I ec9b16f81a6b4d7e264f5b035ec02c03 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.172 CC(=CCNc1nc[nH]n1)C 13815be1609b9679e33fb6d1f1bf9547 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.172 CC(=CCNc1nc[nH]n1)Cl ebf3bbe2df2d42dcbf09a956332f507d [0,0,0,0,0,0|4,0,0]=4 30 B11R1.172 CC(=CCNc1nc[nH]n1)I a6b548311dc803746d5f60f73317307b [0,0,0,0,0,0|4,0,0]=4 31 B11R1.172 CC(=CCOc1c[nH]cn1)C 8be043cf63f7f9e3cf44a5696811b559 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.172 CC(=CCOc1c[nH]cn1)Cl 44b079ff6186ee90fd43eb3c8632151d [0,0,0,0,0,0|3,0,0]=3 33 B11R1.172 CC(=CCOc1c[nH]cn1)I c4ba7758be36f7dc878abda7ecdfea99 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.172 CC(=O)CCNc1cc[nH]n1 883daeb3188304b9d7044762105d7937 [0,0,0,0,0,0|4,0,0]=4 35 B11R1.172 CC(=O)CCNc1cccs1 3705e6b236dd0e242edc581b5639fa6d [0,0,0,0,0,0|4,0,0]=4 36 B11R1.172 CC(=O)CCNc1ccon1 fa2bb5bb8d68fa453bbdefdb1d759682 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.172 CC(=O)CCNc1ccsc1 651e0759f022e69c9736f48a37d6dc91 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.172 CC(=O)CCNc1cn[nH]c1 7d66f6ede45a2af16504ad668ffaf96f [0,0,0,0,0,0|4,0,0]=4 39 B11R1.172 CC(=O)CCNc1cncs1 bce7d96e9d22cce9e72ec22be1ef03a0 [0,0,0,0,0,0|3,0,1]=4 40 B11R1.172 CC(=O)CCNc1cnon1 63cc17715a6cefa6fb84f965e21a3d90 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.172 CC(=O)CCNc1cocn1 f4edda95f1039e89d30a273f43e079c6 [0,0,0,0,0,0|3,0,0]=3 42 B11R1.172 CC(=O)CCNc1cscn1 bae0a140e53827c0132f1292745b570f [0,0,0,0,0,0|3,0,0]=3 43 B11R1.172 CC(=O)CCNc1nc[nH]n1 658f33e9672980f1f6cbb85d83bd982e [0,0,0,0,0,0|3,0,0]=3 44 B11R1.172 CC(=O)CCNc1ncc[nH]1 f62fc8122f45927eb0ccc652b7a4c5b1 [0,0,0,0,0,0|4,0,0]=4 45 B11R1.172 CC(=O)CCNc1ncco1 6db9a64456f72643bc08fa8bb5731698 [0,0,0,0,0,0|4,0,0]=4 46 B11R1.172 CC(=O)CCNc1nccs1 3d5d28b8f113842ebbf2ec44dd1bf59f [0,0,0,0,0,0|4,0,0]=4 47 B11R1.172 CC(=O)CCNc1ncns1 867e7fa39fd0e3b4438f7c5090c86799 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.172 CC(=O)CCNc1ncon1 25e1bc32b260c787b63c837184643bc3 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.172 CC(=O)CCNc1ncsn1 485a676941c1e855a62576fa76833a9b [0,0,0,0,0,0|4,0,0]=4 50 B11R1.172 CC(=O)CCNc1nn[nH]n1 4f159a903fffbe3ae192cac3a35398d8 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.172 CC(=O)CCOc1c[nH]cn1 5a2c247b0e6ea2d9a0d6482af004727a [0,0,0,0,0,0|2,0,0]=2 52 B11R1.172 CC(=O)CCOc1ccco1 1304331aa569973df701f4c541cd36f9 [0,0,0,0,0,0|4,0,0]=4 53 B11R1.172 CC(=O)CCOc1cccs1 b63fa1eb430f81b21edb5306b25d0cdb [0,0,0,0,0,0|4,0,0]=4 54 B11R1.172 CC(=O)CCOc1ccsc1 fee7f80d39017e359bb48461fa26983e [0,0,0,0,0,0|4,0,0]=4 55 B11R1.172 CC(=O)CCOc1cn[nH]c1 dab2bbadeeffff63c50657b5bf5975d2 [0,0,0,0,0,0|4,0,0]=4 56 B11R1.172 CC(=O)CCOc1cnsn1 3e7bbc5621e61df60e7aed79df56ac6e [0,0,0,0,0,0|3,0,1]=4 57 B11R1.172 CC(=O)CCOc1nccs1 cf08ec43f863de4c460f793b78c9f67a [0,0,0,0,0,0|4,0,0]=4 58 B11R1.172 CC(=O)CCOn1cccn1 97b5dcdee09e1afa32f5e7b00efd9045 [0,0,0,0,0,0|4,0,0]=4 59 B11R1.172 CC(=O)CNCc1ccco1 5349a004945f22466223fdea062b1a26 [0,0,0,0,0,0|4,0,0]=4 60 B11R1.172 CC(=O)CNCc1cccs1 b1e4a802d58216630369ed1cb1193c6c [0,0,0,0,0,0|4,0,0]=4 61 B11R1.172 CC(=O)CNCc1ccon1 23626df2e39d6d34262af4f6b23b9170 [0,0,0,0,0,0|4,0,0]=4 62 B11R1.172 CC(=O)CNCc1ccsc1 16ff0b76a99c7d3314b4299765d3106e [0,0,0,0,0,0|4,0,0]=4 63 B11R1.172 CC(=O)CNCc1cnc[nH]1 7961c596f66c2db5f4c710df2da78fd9 [0,0,0,0,0,0|2,0,2]=4 64 B11R1.172 CC(=O)CNCc1cnco1 99f78d679b27a44216bef491e144dcce [0,0,0,0,0,0|3,0,1]=4 65 B11R1.172 CC(=O)CNCc1cocn1 5a325c13f3d51587b1011738e379fe43 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.172 CC(=O)CNCc1cscn1 50abab540491be2882a1c0a0909785fd [0,0,0,0,0,0|3,0,0]=3 67 B11R1.172 CC(=O)CNCc1nc[nH]n1 81c6a86f409b416be1f8ea1bf52a0b80 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.172 CC(=O)CNCc1ncc[nH]1 778742788fb1ab1bab5ccf4fe2a0da32 [0,0,0,0,0,0|4,0,0]=4 69 B11R1.172 CC(=O)CNCc1ncco1 08548bfba2487e3629cbfdeac38ddfed [0,0,0,0,0,0|4,0,0]=4 70 B11R1.172 CC(=O)CNCc1nccs1 a8747eb331576143633e408625f188a4 [0,0,0,0,0,0|4,0,0]=4 71 B11R1.172 CC(=O)CNCc1ncno1 83bb31529ce46ee4ded2789dbac5f2aa [0,0,0,0,0,0|3,0,1]=4 72 B11R1.172 CC(=O)CNCc1ncon1 3de623be577aab81a1ec9c60abb5646c [0,0,0,0,0,0|4,0,0]=4 73 B11R1.172 CC(=O)CNCn1cncn1 106e1be9a757ec363fd492b463e2128a [0,0,0,0,0,0|3,0,1]=4 74 B11R1.172 CC(=O)COCc1ccco1 eb376918d478215b7784a307211ac4b9 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.172 CC(=O)COCc1cccs1 230c5eb2cad29c6e94ed984c95bb8914 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.172 CC(=O)COCc1ccon1 9e19981729836118dd19c0826084c66d [0,0,0,0,0,0|4,0,0]=4 77 B11R1.172 CC(=O)COCc1ccsc1 78bf80be00349b2116046f3effe94e73 [0,0,0,0,0,0|4,0,0]=4 78 B11R1.172 CC(=O)COCc1cnc[nH]1 8cf8a4d7b712ee5ea9cd56a3720c3ebf [0,0,0,0,0,0|2,0,2]=4 79 B11R1.172 CC(=O)COCc1cocn1 1dc479cb33ceaf076f3723d82bb37f46 [0,0,0,0,0,0|3,0,0]=3 80 B11R1.172 CC(=O)COCc1cscn1 19a63737f28646eb23fa503a4700b862 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.172 CC(=O)COCc1nc[nH]n1 67206ef46f3011cc5fd571ae58cd4fb2 [0,0,0,0,0,0|3,0,0]=3 82 B11R1.172 CC(=O)COCc1ncc[nH]1 63019179786ec8451185c7af212d962c [0,0,0,0,0,0|4,0,0]=4 83 B11R1.172 CC(=O)COCc1ncco1 6392edc6fd8ff743b74fd77ae0ebc6d1 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.172 CC(=O)COCc1nccs1 f6b227f8e0531f674da6013bb44fdfb1 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.172 CC(=O)COCc1ncno1 1d52bc01789c9da548e7c29e4041ef4d [0,0,0,0,0,0|3,0,1]=4 86 B11R1.172 CC(=O)COCc1ncon1 4c7449d2a7469e8fd6d60f010e6872f0 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.172 CC(=O)COCn1cncn1 379fdad34f424ea03b90faf48e16283d [0,0,0,0,0,0|3,0,1]=4 88 B11R1.172 CC(=O)NCCN1CC=CC1 079617e389066509e162f58fbfef7b5e [0,0,0,0,0,0|3,0,1]=4 89 B11R1.172 CC(=O)NCCc1ccco1 f97fcd1be9cacf4675351753b4b97ccf [0,0,0,0,0,0|2,0,0]=2 90 B11R1.172 CC(=O)NCCc1cccs1 b2bccd28809b44ec5e70798b6aa4c45f [0,0,0,0,0,0|2,0,0]=2 91 B11R1.172 CC(=O)NCCc1ccsc1 10819fa3dfc260c6efcff456e5254d1c [0,0,0,0,0,0|2,0,0]=2 92 B11R1.172 CC(=O)NCCc1cnoc1 75c79654465201d0cf77c9fee5814382 [0,0,0,0,0,0|2,0,1]=3 93 B11R1.172 CC(=O)NCCc1cscn1 5a0e906e9ec17b0b664a4310d6205079 [0,0,0,0,0,0|1,0,0]=1 94 B11R1.172 CC(=O)NCCc1nccs1 e199f90e06fe8a9fa8ec6cff53ae1078 [0,0,0,0,0,0|2,0,0]=2 95 B11R1.172 CC(=O)NCCc1nncs1 479c1c69ca7fcc56462b325695d52c02 [0,0,0,0,0,0|2,0,1]=3 96 B11R1.172 CC(=O)NCCn1cccc1 90ca4d7dc3d7deccd3fd7667822b2621 [0,0,0,0,0,0|3,0,0]=3 97 B11R1.172 CC(=O)NCCn1cccn1 09d1495aa7ae7b34ce16de2f3bc9823f [0,0,0,0,0,0|2,0,0]=2 98 B11R1.172 CC(=O)NCCn1ccnc1 3c7aa21845cf70d5932e3e647a27912d [0,0,0,0,0,0|2,0,1]=3 99 B11R1.172 CC(=O)NCCn1ccnn1 44337fbd674b60676626f71ea89b17d3 [0,0,0,0,0,0|3,0,0]=3 100 B11R1.172 CC(=O)NCCn1cncn1 6b25a91e7f42d6ef33a09467890b4c75 [0,0,0,0,0,0|1,0,1]=2 101 B11R1.172 CC(=O)NCCn1cnnc1 7ee2778db9419d34090813b36694e32d [0,0,0,0,0,0|3,0,1]=4 102 B11R1.172 CC(=O)OCNc1cc[nH]n1 f1d4e3409eb19701aaae47828ddadb2c [0,0,0,0,0,0|4,0,0]=4 103 B11R1.172 CC(=O)OCNc1cccs1 9bfb4558c6114317955d0a73b0c80837 [0,0,0,0,0,0|4,0,0]=4 104 B11R1.172 CC(=O)OCNc1ccon1 4d3da0c7217ff2f017b541fce9582b6c [0,0,0,0,0,0|4,0,0]=4 105 B11R1.172 CC(=O)OCNc1ccsc1 a16b14492d247d5b0fba4c89c8652c37 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.172 CC(=O)OCNc1cn[nH]c1 7dc2958bd7cbfd90ce31adae504646b3 [0,0,0,0,0,0|4,0,0]=4 107 B11R1.172 CC(=O)OCNc1cncs1 9a6e7eff9e67f8d7869dbea990d12924 [0,0,0,0,0,0|3,0,1]=4 108 B11R1.172 CC(=O)OCNc1cnon1 bf990502958e858c88a7e195c99ef3e8 [0,0,0,0,0,0|3,0,1]=4 109 B11R1.172 CC(=O)OCNc1cocn1 dd521c2131d3bdac6bae185b11c989b6 [0,0,0,0,0,0|3,0,0]=3 110 B11R1.172 CC(=O)OCNc1cscn1 c1fe35d7a3b6c55d0700de45dfb1de72 [0,0,0,0,0,0|3,0,0]=3 111 B11R1.172 CC(=O)OCNc1nc[nH]n1 a636bab26ad996f00d2fbda17d77cc23 [0,0,0,0,0,0|3,0,0]=3 112 B11R1.172 CC(=O)OCNc1ncc[nH]1 fa8f0e4b6cef200e463b5cd2599645c4 [0,0,0,0,0,0|4,0,0]=4 113 B11R1.172 CC(=O)OCNc1ncco1 5827ef4ddf2b1a5038d42cb3806f2688 [0,0,0,0,0,0|4,0,0]=4 114 B11R1.172 CC(=O)OCNc1nccs1 dd895c7060485b6d76ce578804f9fd66 [0,0,0,0,0,0|4,0,0]=4 115 B11R1.172 CC(=O)OCNc1ncns1 ed3c151b6c25f68d50caa199cc662d66 [0,0,0,0,0,0|3,0,1]=4 116 B11R1.172 CC(=O)OCNc1ncon1 4940595d01c5402522d8f8a8e2da0190 [0,0,0,0,0,0|4,0,0]=4 117 B11R1.172 CC(=O)OCNc1ncsn1 a1db9ecc5c7bbb364cff2ba4854d1351 [0,0,0,0,0,0|4,0,0]=4 118 B11R1.172 CC(=O)OCNc1nn[nH]n1 aba1470925eac29e61af320fc1fbc298 [0,0,0,0,0,0|4,0,0]=4 119 B11R1.172 CC(=O)OCOc1c[nH]cn1 77ad85680c2a23ead707f1ef692fee0a [0,0,0,0,0,0|2,0,0]=2 120 B11R1.172 CC(=O)OCOc1ccco1 18a8842f6bf66d2e01121a7a178b294d [0,0,0,0,0,0|4,0,0]=4 121 B11R1.172 CC(=O)OCOc1cccs1 01a2361020ef2a379439fd07806b9e9d [0,0,0,0,0,0|4,0,0]=4 122 B11R1.172 CC(=O)OCOc1ccsc1 5d38b23aafc842ce5f7b8229487d2e29 [0,0,0,0,0,0|4,0,0]=4 123 B11R1.172 CC(=O)OCOc1cn[nH]c1 b88cebaa8806e3e7b27011f6cec5a789 [0,0,0,0,0,0|4,0,0]=4 124 B11R1.172 CC(=O)OCOc1cnsn1 31544201a3acbbbededdd868b79096d1 [0,0,0,0,0,0|3,0,1]=4 125 B11R1.172 CC(=O)OCOc1nccs1 a61f9bf88998c7775f63e887f1f8e3e8 [0,0,0,0,0,0|4,0,0]=4 126 B11R1.172 CC(=O)OCOn1cccn1 8d7ea3787a22a61e882111ec2e7551a7 [0,0,0,0,0,0|4,0,0]=4 127 B11R1.172 CC(C)CCNc1c[nH]cn1 7ae04c4a3f44fe3217857895da9d7971 [0,0,0,0,0,0|3,0,1]=4 128 B11R1.172 CC(C)CCOc1c[nH]cn1 9e5c4f69ca08c5d42944d2ec9516f86a [0,0,0,0,0,0|3,0,1]=4 129 B11R1.172 CC(C)NCCc1c[nH]cn1 d9b1093684083398f09b2bcc7c136d3f [0,0,0,0,0,0|1,0,1]=2 130 B11R1.172 CC(C)NCCc1cc[nH]n1 19f8bfea33503f6d301578a663802f79 [0,0,0,0,0,0|3,0,1]=4 131 B11R1.172 CC(C)NCCc1ccc[nH]1 2373d6633e894ab6620732174fbf2348 [0,0,0,0,0,0|2,0,2]=4 132 B11R1.172 CC(C)NCCc1ccco1 f5a48b9013a3de5311256701c81ca609 [0,0,0,0,0,0|3,0,1]=4 133 B11R1.172 CC(C)NCCc1ccsc1 635101e28400fe3ec9e545656df9f636 [0,0,0,0,0,0|3,0,1]=4 134 B11R1.172 CC(C)NCCc1cn[nH]c1 e4224d1e9bf968cead09332a0a78b8aa [0,0,0,0,0,0|3,0,1]=4 135 B11R1.172 CC(C)NCCc1cscn1 8268b8eefd70916f6371029db98c0cad [0,0,0,0,0,0|2,0,1]=3 136 B11R1.172 CC(C)NCCc1ncc[nH]1 a69741db26734503d0ab0defbe57728b [0,0,0,0,0,0|3,0,1]=4 137 B11R1.172 CC(C)NCCc1nccs1 22245f012db5b34cbd3c6d6fbc31907a [0,0,0,0,0,0|3,0,1]=4 138 B11R1.172 CC(C)NCCn1cccn1 d6b7145559ee08162a45046e431411c0 [0,0,0,0,0,0|3,0,1]=4 139 B11R1.172 CC(C)NCCn1cncn1 eb2b7d73ec68313f3c74756f54b0bf7f [0,0,0,0,0,0|2,0,2]=4 140 B11R1.172 CC(C)OCCc1c[nH]cn1 afa4852823a31685051d73ac8913effc [0,0,0,0,0,0|2,0,1]=3 141 B11R1.172 CC(C)OCCc1cscn1 fc1cb18e419ffcc961dd1ccb5c250885 [0,0,0,0,0,0|3,0,1]=4 142 B11R1.172 CC(C)OCOc1c[nH]cn1 a11a2c20d65e431dd1c2dddeea05e4ee [0,0,0,0,0,0|3,0,1]=4 143 B11R1.172 CC(O)CCNc1c[nH]cn1 420677d5e03666f5f5886d01fd8d5405 [0,0,0,0,0,0|2,0,2]=4 144 B11R1.172 CN(C)CCNc1c[nH]cn1 15780488e3445645dd2ff3ad3a09befa [0,0,0,0,0,0|4,0,0]=4 145 B11R1.172 CN(C)CCOc1c[nH]cn1 5fab8822a420cb1df5dea09ea55a40ca [0,0,0,0,0,0|4,0,0]=4 146 B11R1.172 CS(=O)CCNc1c[nH]cn1 9ffe291fe5ad6adf3800bcadbb74d5dc [0,0,0,0,0,0|3,0,0]=3 147 B11R1.172 CS(=O)CCNc1c[nH]nn1 4861fdadf293ecf30582ecd5ff851bd0 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.172 CS(=O)CCNc1cocn1 789a92317fe457bded899c874d5944ce [0,0,0,0,0,0|4,0,0]=4 149 B11R1.172 CS(=O)CCNc1cscn1 520b15dd2b340909ea38c3341f89a255 [0,0,0,0,0,0|4,0,0]=4 150 B11R1.172 CS(=O)CCNc1nc[nH]n1 78d83807794ea332bc05d99464ed663e [0,0,0,0,0,0|4,0,0]=4 151 B11R1.172 CS(=O)CCOc1c[nH]cn1 ff5cd75ccd19e6e16dbe28e4c495b386 [0,0,0,0,0,0|3,0,0]=3 152 B11R1.172 C[C@@H](O)CCNc1c[nH]cn1 aa5a03ac4bbb4ba849f275222810d984 [0,0,0,0,0,0|2,0,2]=4 153 B11R1.172 C[C@H](O)CCNc1c[nH]cn1 4b2cf3b78b6c5abfe10eb6cc1cd44283 [0,0,0,0,0,0|2,0,2]=4 154 B11R1.172 ClC(=CCOc1c[nH]cn1)Cl dca27b6a140ead4c6e35ff4ece9241f3 [0,0,0,0,0,0|4,0,0]=4 155 B11R1.172 NC(=O)CCNc1c[nH]cn1 87cc850012210008152c1d1fa6a89217 [0,0,0,0,0,0|3,0,0]=3 156 B11R1.172 NC(=O)CCNc1cocn1 149b0df3a03d3b93ab08bcd991851019 [0,0,0,0,0,0|4,0,0]=4 157 B11R1.172 NC(=O)CCNc1cscn1 d29f27d3eb8c061dadd7b3e69419608b [0,0,0,0,0,0|4,0,0]=4 158 B11R1.172 NC(=O)CCNc1nc[nH]n1 b3c5db7b6d53fc385d98bd0884c52c94 [0,0,0,0,0,0|4,0,0]=4 159 B11R1.172 NC(=O)CCOc1c[nH]cn1 5f9be08c8256a22682fe9ab499d7c47f [0,0,0,0,0,0|3,0,0]=3 160 B11R1.172 NC(=O)CNCc1c[nH]nn1 aab20b4904bee03865be11094a499bac [0,0,0,0,0,0|4,0,0]=4 161 B11R1.172 NC(=O)CNCc1cc[nH]c1 7945772b7a5e5e854c45247c250e536f [0,0,0,0,0,0|4,0,0]=4 162 B11R1.172 NC(=O)CNCc1cocn1 8f4fcccb843d37ff3762b1cf3e5f53f3 [0,0,0,0,0,0|4,0,0]=4 163 B11R1.172 NC(=O)CNCc1cscn1 c6eb2c365fc2865cb9451a1a0f248df2 [0,0,0,0,0,0|4,0,0]=4 164 B11R1.172 NC(=O)COCc1cc[nH]c1 ca9a17aa36d73f55106881bb289d5442 [0,0,0,0,0,0|4,0,0]=4 165 B11R1.172 NC(=O)COCc1cocn1 346ed68517b24cb7ad6c65717dcb18bb [0,0,0,0,0,0|4,0,0]=4 166 B11R1.172 NC(=O)COCc1cscn1 3fac59ce4fce802fbaa9cef874f44fa3 [0,0,0,0,0,0|4,0,0]=4 167 B11R1.172 NC(=O)COCc1nc[nH]n1 3417bc8fce31115cd6666dfccce82f09 [0,0,0,0,0,0|4,0,0]=4 168 B11R1.172 NC(=O)SCNc1cocn1 b98c57ae231029bb80e9d12e48d56330 [0,0,0,0,0,0|4,0,0]=4 169 B11R1.172 NC(=O)SCNc1cscn1 f6e71f6accbc169b0cbf865b16363d91 [0,0,0,0,0,0|4,0,0]=4 170 B11R1.172 NC(=O)SCNc1nc[nH]n1 96b713be23d5072e0977bccbae4555ad [0,0,0,0,0,0|4,0,0]=4 171 B11R1.172 NC(=O)SCOc1c[nH]cn1 e972d8d7e60d85746b3d5bc0e68615d4 [0,0,0,0,0,0|3,0,0]=3 172 B11R1.172 NC(=S)CCNc1c[nH]cn1 c8c6e0a3513990810e2d7d81a76e825f [0,0,0,0,0,0|3,1,0]=4 173 B11R1.172 O=C(O)CCNc1c[nH]cn1 50eb713893be35a09e34f1767ca949af [0,0,0,0,0,0|3,0,0]=3 174 B11R1.172 O=C(O)CCNc1cocn1 3b949f48cca00da2cb46c4f3db3c609a [0,0,0,0,0,0|4,0,0]=4 175 B11R1.172 O=C(O)CCNc1cscn1 c1f042d73c163747890fb34c04fb3827 [0,0,0,0,0,0|4,0,0]=4 176 B11R1.172 O=C(O)CCNc1nc[nH]n1 5cccd9bf721f820972e6f2cac8213681 [0,0,0,0,0,0|4,0,0]=4 177 B11R1.172 O=C(O)CCOc1c[nH]cn1 a647bcea462f771f4eb3530c5c3f7b39 [0,0,0,0,0,0|3,0,0]=3 178 B11R1.172 O=C(O)CNCc1c[nH]nn1 6afb19011e008dbeb2fb2d5f617b5358 [0,0,0,0,0,0|4,0,0]=4 179 B11R1.172 O=C(O)CNCc1cc[nH]c1 ad1545a2535c92a94cb4b770bdc582e2 [0,0,0,0,0,0|4,0,0]=4 180 B11R1.172 O=C(O)CNCc1cocn1 9dd0f56cb9645473bd88a4714a65c285 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.172 O=C(O)CNCc1cscn1 ab0953006c5e0edb33635d07ef299b35 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.172 O=C(O)CNCc1nc[nH]n1 13614a32a08c7404bed60bd2274ea8a4 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.172 O=C(O)COCc1cc[nH]c1 0000d8dd863a04d7f4797db125a9bade [0,0,0,0,0,0|4,0,0]=4 184 B11R1.172 O=C(O)COCc1cocn1 f93d278a2fe950df72a6211245f5f818 [0,0,0,0,0,0|4,0,0]=4 185 B11R1.172 O=C(O)COCc1cscn1 fdc5bd1c51080fa79e5195e10498857b [0,0,0,0,0,0|4,0,0]=4 186 B11R1.172 O=C(O)COCc1nc[nH]n1 a71f83d885117b8d8c7d49944b872553 [0,0,0,0,0,0|4,0,0]=4 187 B11R1.172 O=S(O)CCNc1c[nH]cn1 7c73f59f4064c737e01d956a9a152a4c [0,0,0,0,0,0|4,0,0]=4 188 B10R1.21 C/C=C/CNc1cocn1 8a53ed752bb3b2d542a538f50bc308d7 [1,0,0,0,0,0|3,0,0]=4 189 B10R1.21 C/C=C/CNc1cscn1 e1f6b99378d48cc8d4f5ee41c69b24a3 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.21 C/C=C/CNc1nc[nH]n1 cbfac97b91f7f50d06e8af15888cf224 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.21 C/C=C/COc1c[nH]cn1 3a010fe3d1a9e7f9b35c1d05260ea385 [1,0,0,0,0,0|2,0,0]=3 192 B10R1.21 C/C=C\CNc1cocn1 ecea3e06c48fc790ff6b64b46d5bbb2a [1,0,0,0,0,0|3,0,0]=4 193 B10R1.21 C/C=C\CNc1cscn1 b97f0d28024116f9577d4e6b201f401c [1,0,0,0,0,0|3,0,0]=4 194 B10R1.21 C/C=C\CNc1nc[nH]n1 95a42eacdd4853a0a542bc75de1a1d85 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.21 C/C=C\COc1c[nH]cn1 6a41a70c06fa488a12645e2f95a912dc [1,0,0,0,0,0|2,0,0]=3 196 B10R1.21 C=CCCNc1c[nH]cn1 70b81c3dc04797a2430cde6003632eaf [1,0,0,0,0,0|2,0,1]=4 197 B10R1.21 C=CCCOc1c[nH]cn1 80a90fc0cffcbf3e36e432a798907ffb [1,0,0,0,0,0|2,0,1]=4 198 B10R1.21 CC=CCNc1c[nH]cn1 5370d3478c1fb26c56749fbca1432f9b [1,0,0,0,0,0|2,0,0]=3 199 B10R1.21 CC=CCNc1c[nH]nn1 d6503e14b0a8bea0b5be9f9dc4452a79 [1,0,0,0,0,0|3,0,0]=4 200 B10R1.21 CC=CCNc1cocn1 8f4f1d0d08ad2fca41ab25d0c9b7c20a [1,0,0,0,0,0|3,0,0]=4 201 B10R1.21 CC=CCNc1cscn1 fcfc6f6234804404bf623eb408f21882 [1,0,0,0,0,0|3,0,0]=4 202 B10R1.21 CC=CCNc1nc[nH]n1 080aacbf40b8f3da0b4cc51f3045217e [1,0,0,0,0,0|3,0,0]=4 203 B10R1.21 CCCCNc1c[nH]cn1 c32a5f86e55cb9897330164d8efcb9fe [1,0,0,0,0,0|2,0,1]=4 204 B10R1.21 CCCCOc1c[nH]cn1 2de79fd47cbcb5ac95e2c102e85f22a4 [1,0,0,0,0,0|2,0,1]=4 205 B10R1.21 CCNCCc1c[nH]cn1 5d8976b386787bb539681dc4bbe582eb [1,0,0,0,0,0|0,0,1]=2 206 B10R1.21 CCNCCc1cc[nH]n1 19a12fba6307d4d49877f9d3ba8b08dd [1,0,0,0,0,0|2,0,1]=4 207 B10R1.21 CCNCCc1ccc[nH]1 8213ac8e4b9d94b1198a75f34bf94d78 [1,0,0,0,0,0|1,0,2]=4 208 B10R1.21 CCNCCc1ccco1 1ad917faeddbc2d8d316341d3d41b62a [1,0,0,0,0,0|2,0,1]=4 209 B10R1.21 CCNCCc1cccs1 f1bb449dfb857924f62fa7b623b4a581 [1,0,0,0,0,0|2,0,1]=4 210 B10R1.21 CCNCCc1ccsc1 2ea71ee3ba82753ba2a28e730c57ed02 [1,0,0,0,0,0|2,0,1]=4 211 B10R1.21 CCNCCc1cn[nH]c1 33b8602a59775cffdef08b48cc6c7bc1 [1,0,0,0,0,0|2,0,1]=4 212 B10R1.21 CCNCCc1cscn1 c90d7abebf31b4546037db2893fb081b [1,0,0,0,0,0|1,0,1]=3 213 B10R1.21 CCNCCc1ncc[nH]1 10739b1151014cf40521e7f6f68f5f08 [1,0,0,0,0,0|2,0,1]=4 214 B10R1.21 CCNCCc1nccs1 ff3ceb5e0153da3ae8a88aa515d57d9f [1,0,0,0,0,0|2,0,1]=4 215 B10R1.21 CCNCCn1cccn1 58fbe0f55d79423be74c4217047e7a9d [1,0,0,0,0,0|2,0,1]=4 216 B10R1.21 CCNCCn1cncn1 3fdfb18b2dd2a2c5f52dbd1951066ea7 [1,0,0,0,0,0|1,0,2]=4 217 B10R1.21 CCOCCc1c[nH]cn1 aedba343b36eaee1c14567760ebbcea9 [1,0,0,0,0,0|1,0,1]=3 218 B10R1.21 CCOCCc1cscn1 1cd5c95d3af30f19b925f6c604b09676 [1,0,0,0,0,0|2,0,1]=4 219 B10R1.21 CCOCOc1c[nH]cn1 77a5a056bda1a382071b8f7d9843f3ed [1,0,0,0,0,0|2,0,1]=4 220 B10R1.21 COCCNc1c[nH]cn1 31b5e19647757b8c8ff224c51156209f [1,0,0,0,0,0|3,0,0]=4 221 B10R1.21 COCCOc1c[nH]cn1 c22d372def312a114ce12682b28da196 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.21 CSCCNc1c[nH]cn1 137b35293b0dc85bb31d2e32ee40a86e [1,0,0,0,0,0|3,0,0]=4 223 B10R1.21 CSCCOc1c[nH]cn1 562e0b23ec0786e0fd18550873f0babf [1,0,0,0,0,0|3,0,0]=4 224 B10R1.21 Cl/C=C/COc1c[nH]cn1 c60a66216f18b7ff0d749d5508d10766 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.21 Cl/C=C\COc1c[nH]cn1 2c9e805dde0d72cbe5fce87182b4d3ae [1,0,0,0,0,0|3,0,0]=4 226 B10R1.21 FCNCCc1c[nH]cn1 5494221e6ff8321957b1f00f7d3f58ac [1,0,0,0,0,0|1,0,1]=3 227 B10R1.21 FCNCCc1cscn1 741620d8532723c36d5ed8157030c1f6 [1,0,0,0,0,0|2,0,1]=4 228 B10R1.21 FCOCCc1c[nH]cn1 4d549ea41c918a10f0105a3f3b12fe92 [1,0,0,0,0,0|2,0,1]=4 229 B10R1.21 N#CNCCc1c[nH]cn1 8fb9c1521f3ec9c0464b4307f902e443 [1,0,0,0,0,0|1,0,1]=3 230 B10R1.21 N#CNCCc1cscn1 998cb16821b5bc0e201054fd44b46b1d [1,0,0,0,0,0|2,0,1]=4 231 B10R1.21 O=CCCNc1cocn1 9b651ced5384524592e6d49a1a8c628d [1,0,0,0,0,0|3,0,0]=4 232 B10R1.21 O=CCCNc1cscn1 970a566956c175f49ff33928637300e7 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.21 O=CCCNc1nc[nH]n1 29dc349c2813122d0cdf5a42d98a3a7b [1,0,0,0,0,0|3,0,0]=4 234 B10R1.21 O=CCCOc1c[nH]cn1 40722884efca362ac72380dad1a01b51 [1,0,0,0,0,0|2,0,0]=3 235 B10R1.21 O=CCNCc1c[nH]nn1 86b900c343df5934c3e604b03a04663e [1,0,0,0,0,0|3,0,0]=4 236 B10R1.21 O=CCNCc1cc[nH]c1 7bd98127b6ed34fc346e296ba4f3f373 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.21 O=CCNCc1cocn1 f886d0ec381ee97f2b620bc4ac7dca05 [1,0,0,0,0,0|3,0,0]=4 238 B10R1.21 O=CCNCc1cscn1 969d5ebde0bb1a20c743c3c8836c2153 [1,0,0,0,0,0|3,0,0]=4 239 B10R1.21 O=CCOCc1cc[nH]c1 efe8feb7746260a5e0774b30b9119620 [1,0,0,0,0,0|3,0,0]=4 240 B10R1.21 O=CCOCc1cocn1 e8353df610be40777c8824242f8ab0c2 [1,0,0,0,0,0|3,0,0]=4 241 B10R1.21 O=CCOCc1cscn1 eb1d18581e17760c4af776097ce46c7d [1,0,0,0,0,0|3,0,0]=4 242 B10R1.21 O=CCOCc1nc[nH]n1 9e1f54de21f53a873e2d629de0e94a1f [1,0,0,0,0,0|3,0,0]=4 243 B10R1.21 O=CNCCc1ccco1 0b737060dc1ee55a5f0568ed4921621c [1,0,0,0,0,0|2,0,0]=3 244 B10R1.21 O=CNCCc1cccs1 fd1222ac3d0e2b6ccbfd32e31af9a8d7 [1,0,0,0,0,0|2,0,0]=3 245 B10R1.21 O=CNCCc1ccsc1 40aeed6734dbe1c85d4189f6964d5072 [1,0,0,0,0,0|2,0,0]=3 246 B10R1.21 O=CNCCc1cnoc1 cc46b3040041894bed62071322654f8c [1,0,0,0,0,0|2,0,1]=4 247 B10R1.21 O=CNCCc1cscn1 57421cd860fb5996df12d7b0a782b075 [1,0,0,0,0,0|1,0,0]=2 248 B10R1.21 O=CNCCc1nccs1 a3ee9ddc95123af1d2954f4589596163 [1,0,0,0,0,0|2,0,0]=3 249 B10R1.21 O=CNCCc1nncs1 2cc8639472b6590acce4bb11b88facc6 [1,0,0,0,0,0|2,0,1]=4 250 B10R1.21 O=CNCCn1cccc1 695fd6974fcc57efd656a9e645bf7643 [1,0,0,0,0,0|3,0,0]=4 251 B10R1.21 O=CNCCn1cccn1 da97265d2ac7d99f64b268331827132d [1,0,0,0,0,0|2,0,0]=3 252 B10R1.21 O=CNCCn1ccnc1 63572b22d1da96f1d1e95eb8f856ad60 [1,0,0,0,0,0|2,0,1]=4 253 B10R1.21 O=CNCCn1ccnn1 366d21ea89e671926044c4a954fe2e6c [1,0,0,0,0,0|3,0,0]=4 254 B10R1.21 O=CNCCn1cncn1 63bce569c3f4b7b952d426a059e276e6 [1,0,0,0,0,0|1,0,1]=3 255 B10R1.21 OCNCCc1c[nH]cn1 c090f5b8a873a83e934d30ddd4325ed3 [1,0,0,0,0,0|0,0,2]=3 256 B10R1.21 OCNCCc1cscn1 3b65d047d0401c4eb374c6dbd74a0aa0 [1,0,0,0,0,0|1,0,2]=4 257 B12R1.54 CC(=O)NCC(C)n1cccn1 51575719ce0b872e548011f5c3734769 [0,1,0,0,0,0|2,0,0]=3 258 B12R1.54 CC(=O)NCC(C)n1cncn1 31331bc93c2757abd63413ab59f19f91 [0,1,0,0,0,0|1,0,1]=3 259 B12R1.54 CC(=O)NCC(O)c1ccco1 f2e81afc8e8304b7e3ab1869a2593ba5 [0,1,0,0,0,0|2,0,0]=3 260 B12R1.54 CC(=O)NCC(O)c1cccs1 43262675cb0d43f197929195cc595e21 [0,1,0,0,0,0|2,0,0]=3 261 B12R1.105 C/C(=C/CNc1cn(cn1)C)/I 3a4363143910f42199586ca3a7c9a502 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.105 C/C(=C\CNc1cn(cn1)C)/Cl 9938d7e8bc186afef889c43f93b25487 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.105 C=C(C)CCNc1cn(cn1)C d4915bb799db8984a37cb8a8e221db71 [0,1,0,0,0,0|3,0,0]=4 264 B12R1.105 C=C(C)CNCc1c[nH]c(n1)C 57f02fe956a81b6afc6728b3c14e4e26 [0,1,0,0,0,0|3,0,0]=4 265 B12R1.105 C=C(C)CNCc1cn(cn1)C 6296e622e8bfc36f9a2bdae1f5d1daee [0,1,0,0,0,0|3,0,0]=4 266 B12R1.105 C=C(C)COCc1c[nH]c(n1)C 0d91a513e1475242c2cd508aa6355c13 [0,1,0,0,0,0|3,0,0]=4 267 B12R1.105 C=C(C)COCc1cn(cn1)C 0a1ef813b0f0c456b4ad050805f30df5 [0,1,0,0,0,0|3,0,0]=4 268 B12R1.105 CC(=CCNc1c[nH]c(n1)N)C 288f0fe23a75c1f93edf56d3db821e60 [0,1,0,0,0,0|3,0,0]=4 269 B12R1.105 CC(=CCNc1cn(cn1)C)C daf622075787244dcb27dc2b28d67220 [0,1,0,0,0,0|3,0,0]=4 270 B12R1.105 CC(=CCNc1cn(cn1)C)Cl a9d0b36381f1267ad09d678b7df26f30 [0,1,0,0,0,0|3,0,0]=4 271 B12R1.105 CC(=CCNc1cn(cn1)C)I 44c214777b6ec5efad2a526e9cde3593 [0,1,0,0,0,0|3,0,0]=4 272 B12R1.105 CC(=O)CCNc1cn(cn1)C 5b8750d526c1aeae6d3de6ae65681707 [0,1,0,0,0,0|2,0,0]=3 273 B12R1.105 CC(=O)CCNc1cn(nn1)C f61819999cc940bcc523c642726e2aad [0,1,0,0,0,0|3,0,0]=4 274 B12R1.105 CC(=O)CCNc1csc(n1)Br e4ea5353d1686ec524a6b384ed907b0d [0,1,0,0,0,0|3,0,0]=4 275 B12R1.105 CC(=O)CCNc1n[nH]c(n1)Br b018a1f6120588912ed0856259f19ff1 [0,1,0,0,0,0|3,0,0]=4 276 B12R1.105 CC(=O)CCNc1n[nH]c(n1)S 78e9e67e1043252ef91c9d307160d014 [0,1,0,0,0,0|3,0,0]=4 277 B12R1.105 CC(=O)CCNc1ncn(n1)C 4abcb465c01ec41de8c40213438f090d [0,1,0,0,0,0|3,0,0]=4 278 B12R1.105 CC(=O)CCOc1n[nH]c(n1)C 73bf0bf6c1c882ca9805ed01b63160eb [0,1,0,0,0,0|3,0,0]=4 279 B12R1.105 CC(=O)CNCc1coc(n1)C 3ab839409e269e253890925eb86f034a [0,1,0,0,0,0|3,0,0]=4 280 B12R1.105 CC(=O)CNCc1csc(n1)Br db7f7fd8014ca4cabb39cb62065c957f [0,1,0,0,0,0|3,0,0]=4 281 B12R1.105 CC(=O)CNCc1csc(n1)C 57e136de7b71c92ebddcfd7a939a2a8b [0,1,0,0,0,0|3,0,0]=4 282 B12R1.105 CC(=O)CNCc1csc(n1)Cl 88d8120c264ac2acccd02c9f488dceef [0,1,0,0,0,0|3,0,0]=4 283 B12R1.105 CC(=O)CNCc1ncn(n1)C fab0709ed2b0c29ffafc91f2d6033331 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.105 CC(=O)COCc1coc(n1)C e5872e41b060ee1aa5f922c37a0264de [0,1,0,0,0,0|3,0,0]=4 285 B12R1.105 CC(=O)COCc1csc(n1)Br f3d702eb8b7a08d53c9d8f1b47fdc22b [0,1,0,0,0,0|3,0,0]=4 286 B12R1.105 CC(=O)COCc1csc(n1)C f47e26eab2f834121aa0fd280fb82c1c [0,1,0,0,0,0|3,0,0]=4 287 B12R1.105 CC(=O)COCc1csc(n1)Cl 942d1cc90ba3890ea5bf44b51698d8db [0,1,0,0,0,0|3,0,0]=4 288 B12R1.105 CC(=O)COCc1ncn(n1)C b964510607bdb783f07d1a9f52031c4e [0,1,0,0,0,0|3,0,0]=4 289 B12R1.105 CC(=O)NCCN1CNC(=O)C1 0c0bb3bd4e2cdfe9f1e0328d12ed8e3c [0,1,0,0,0,0|2,0,1]=4 290 B12R1.105 CC(=O)NCCc1ccc(o1)C 4144320537f66e193f4d4afa8ee729d8 [0,1,0,0,0,0|2,0,0]=3 291 B12R1.105 CC(=O)NCCc1ccc(s1)Br a0b2b99f536ee6e2b9d90a6a9b83004c [0,1,0,0,0,0|2,0,0]=3 292 B12R1.105 CC(=O)NCCc1ccc(s1)C c9e2ebb4e9c51f1e96468b2a4fdce03b [0,1,0,0,0,0|2,0,0]=3 293 B12R1.105 CC(=O)NCCc1ccn(n1)C 8c74c7bafbef3328d705e044c78245c8 [0,1,0,0,0,0|2,0,0]=3 294 B12R1.105 CC(=O)NCCc1cn(cn1)C e5015f70dba55b454bf0975551da242b [0,1,0,0,0,0|0,0,0]=1 295 B12R1.105 CC(=O)NCCc1cn(nn1)C 17460ec39ea568ac71b036867507fc45 [0,1,0,0,0,0|1,0,0]=2 296 B12R1.105 CC(=O)NCCc1cnn(c1)C 6bdfc25635e7e7acddc0fd413f5baf09 [0,1,0,0,0,0|2,0,0]=3 297 B12R1.105 CC(=O)NCCc1csc(n1)C 544225d27bd7978bbe77eee23c436407 [0,1,0,0,0,0|1,0,0]=2 298 B12R1.105 CC(=O)NCCc1nc(cs1)C 503df50bc40760cfe1ec0af3b8a80267 [0,1,0,0,0,0|2,0,0]=3 299 B12R1.105 CC(=O)NCCc1ncc(o1)C 4d6a2e6fcd496d7e64bc793507caac8a [0,1,0,0,0,0|2,0,0]=3 300 B12R1.105 CC(=O)NCCn1cc(cn1)Br 038f13af7e676365a45b905fb9de138b [0,1,0,0,0,0|2,0,0]=3 301 B12R1.105 CC(=O)NCCn1cc(cn1)C c1372a6c436d899ef1accee663cd1fcc [0,1,0,0,0,0|2,0,0]=3 302 B12R1.105 CC(=O)NCCn1cc(cn1)Cl af282fa00965036fa257a1ad48cacb76 [0,1,0,0,0,0|2,0,0]=3 303 B12R1.105 CC(=O)NCCn1cc(cn1)F 79184affd93c7d67644183997197d248 [0,1,0,0,0,0|2,0,0]=3 304 B12R1.105 CC(=O)NCCn1cc(cn1)I 940e1a0b6538e2556ba45e37392c1868 [0,1,0,0,0,0|2,0,0]=3 305 B12R1.105 CC(=O)NCCn1cc(nn1)C 16085ea08bec54eea9ed5e82d6a5c24b [0,1,0,0,0,0|3,0,0]=4 306 B12R1.105 CC(=O)NCCn1ccc(n1)C 9b6631dff134b58306c990d0344b3b0b [0,1,0,0,0,0|2,0,0]=3 307 B12R1.105 CC(=O)OCNc1cn(cn1)C 451a7d386afb0d792aa39faa92590d48 [0,1,0,0,0,0|2,0,0]=3 308 B12R1.105 CC(=O)OCNc1cn(nn1)C 809405072acf96cb9b09db53836f121d [0,1,0,0,0,0|3,0,0]=4 309 B12R1.105 CC(=O)OCNc1csc(n1)Br 644ed8d4bbbdd0a741eac3fbc6d40cc5 [0,1,0,0,0,0|3,0,0]=4 310 B12R1.105 CC(=O)OCNc1n[nH]c(n1)Br d5341a11d71d76f16d3bc4e3f8033366 [0,1,0,0,0,0|3,0,0]=4 311 B12R1.105 CC(=O)OCNc1n[nH]c(n1)S 94669ed62640ed2f73d73c6f54cf4593 [0,1,0,0,0,0|3,0,0]=4 312 B12R1.105 CC(=O)OCNc1ncn(n1)C 0be57e62d3e21548f9c3705df7150be2 [0,1,0,0,0,0|3,0,0]=4 313 B12R1.105 CC(=O)OCOc1n[nH]c(n1)C 124dab02212818c3df59a6a772fed50c [0,1,0,0,0,0|3,0,0]=4 314 B12R1.105 CC(C)NCCc1cn(cn1)C eb3b968bd8c0cc9172f7c5aa475f3040 [0,1,0,0,0,0|1,0,1]=3 315 B12R1.105 CC(C)NCCc1cn(nn1)C 9ad2a86c719173ab0a5d4d429367a7c7 [0,1,0,0,0,0|2,0,1]=4 316 B12R1.105 CS(=O)CCNc1c[nH]c(n1)N 6efeea2271a0cbd7d59f503ab75dd0a6 [0,1,0,0,0,0|3,0,0]=4 317 B12R1.105 Cc1nc(c[nH]1)CNCC(=O)N 2b62e6e94d794c9638c1e758556c6989 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.105 Cc1nc(c[nH]1)CNCC(=O)O 0a71b7fc1ed30f0c4eed10c288a62c8d [0,1,0,0,0,0|3,0,0]=4 319 B12R1.105 Cc1nc(c[nH]1)COCC(=O)N d8517d7d54f8f8b21a8574077f937d44 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.105 Cc1nc(c[nH]1)COCC(=O)O 7fe638a0649682f3baa3e6df68ae54f6 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.105 Cc1nc(cs1)CCNC(C)C 38f26e3d05c04adf8fbc95d0d14dd08b [0,1,0,0,0,0|2,0,1]=4 322 B12R1.105 Cn1cnc(c1)CNCC(=O)N 274917a53112d18839d77f3fcb2b4600 [0,1,0,0,0,0|3,0,0]=4 323 B12R1.105 Cn1cnc(c1)CNCC(=O)O c0c37563b4485f4de4cc8e33261e70a0 [0,1,0,0,0,0|3,0,0]=4 324 B12R1.105 Cn1cnc(c1)COCC(=O)N 0df1f6d5271afe013c112f6b2e3a0f50 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.105 Cn1cnc(c1)COCC(=O)O c64b2fe9a9609091a8f8d868ad65ce4c [0,1,0,0,0,0|3,0,0]=4 326 B12R1.105 Cn1cnc(c1)NCCC(=O)N 7a36ab9297695aecd0b65776626d8a1d [0,1,0,0,0,0|3,0,0]=4 327 B12R1.105 Cn1cnc(c1)NCCC(=O)O a5415d89575384bc8bb40f8ab047ca6c [0,1,0,0,0,0|3,0,0]=4 328 B12R1.105 Cn1cnc(c1)NCCS(=O)C 1dd7b7b95416c55f736a8c137cae9219 [0,1,0,0,0,0|3,0,0]=4 329 B12R1.105 Cn1cnc(c1)NCSC(=O)N e672e67bd26d2f88ce7151bf0ee66d62 [0,1,0,0,0,0|3,0,0]=4 330 B12R1.105 NC(=O)CCNc1c[nH]c(n1)N 566361de97db7305812dd9f5bb79a182 [0,1,0,0,0,0|3,0,0]=4 331 B12R1.130 C=C(C)CNCc1nc[nH]c1C 9a13a2bfe48fe3a11cecceff47d7ae1f [0,1,0,0,0,0|3,0,0]=4 332 B12R1.130 C=C(C)COCc1nc[nH]c1C 42554796f8e8f4b459de0f7f80618a57 [0,1,0,0,0,0|3,0,0]=4 333 B12R1.130 CC(=CCNc1nc[nH]c1C)C c3acf6ac87bf458b62458455dd02a427 [0,1,0,0,0,0|3,0,0]=4 334 B12R1.130 CC(=O)CCNc1ncsc1Br f57f1332f14677a136686b8a87c9cfcd [0,1,0,0,0,0|3,0,0]=4 335 B12R1.130 CC(=O)CCNc1no[nH]c1=O 05db78bcabe0d11dd7f159b161df86b1 [0,1,0,0,0,0|3,0,0]=4 336 B12R1.130 CC(=O)CNCc1ncoc1C 198cac87c609657cb871a1f3711a727e [0,1,0,0,0,0|3,0,0]=4 337 B12R1.130 CC(=O)COCc1ncoc1C 9869f87516e51a39983ac09673ee9b11 [0,1,0,0,0,0|3,0,0]=4 338 B12R1.130 CC(=O)NCCN1CCNC1=O e612093a41a5208b98ea8626711f8743 [0,1,0,0,0,0|2,0,1]=4 339 B12R1.130 CC(=O)NCCc1cccn1C 228840714ab5d74414a22726164b559c [0,1,0,0,0,0|1,0,1]=3 340 B12R1.130 CC(=O)NCCc1ccnn1C ceb821115b7877485faf70fd4aad6649 [0,1,0,0,0,0|2,0,1]=4 341 B12R1.130 CC(=O)NCCc1ccsc1Br 7874094ac103ccd5f791804ccec05c2d [0,1,0,0,0,0|2,0,0]=3 342 B12R1.130 CC(=O)NCCc1nccn1C 11af52188e30b420e3343b752682e7d2 [0,1,0,0,0,0|2,0,0]=3 343 B12R1.130 CC(=O)NCCc1sccc1C 54d2325cc7c28ca90bd4f8f05c8ba280 [0,1,0,0,0,0|2,0,0]=3 344 B12R1.130 CC(=O)NCCc1scnc1C b192de06a9fd78bc08ea3dc896d82d5c [0,1,0,0,0,0|1,0,1]=3 345 B12R1.130 CC(=O)OCNc1no[nH]c1=O d1e2db24ce1791e8340da5a9f4ed7fde [0,1,0,0,0,0|3,0,0]=4 346 B12R1.130 Cc1[nH]cnc1CNCC(=O)N 61ef45ca03b127b316e20525b0e1a9de [0,1,0,0,0,0|3,0,0]=4 347 B12R1.130 Cc1[nH]cnc1CNCC(=O)O ee0380bff801a69c1bde8952ac2ed110 [0,1,0,0,0,0|3,0,0]=4 348 B12R1.130 Cc1[nH]cnc1COCC(=O)N 0dc73ceac43a1c5ee6672c90f4d653aa [0,1,0,0,0,0|3,0,0]=4 349 B12R1.130 Cc1[nH]cnc1COCC(=O)O a33c5ffe3d114504db3bbf62d5cdcf1c [0,1,0,0,0,0|3,0,0]=4 350 B12R1.260 CC(=O)NC(C)Cc1ccco1 6cb720845f829a0cf0aeb92e5ca9c2a4 [0,1,0,0,0,0|2,0,0]=3 351 B12R1.260 CC(=O)NC(C)Cc1ccsc1 fb6c0aa145e8dfd84369d3b981abcf56 [0,1,0,0,0,0|2,0,0]=3 352 B12R1.260 CC(=O)NC(C)Cn1cccn1 70bdd7c950ab8dd61870fb6525bc38ee [0,1,0,0,0,0|2,0,0]=3 353 B12R1.260 CC(=O)NC(C)Cn1cncn1 8459d550f26aa47f90cf77eaaceb39e5 [0,1,0,0,0,0|1,0,1]=3 354 B12R1.260 CC(=O)OC(C)Nc1cocn1 17265ecb61daa78d2b07422d313c944b [0,1,0,0,0,0|3,0,0]=4 355 B12R1.260 CC(=O)OC(C)Nc1cscn1 0a44d5aa4f759cb967b63cfeeffc7672 [0,1,0,0,0,0|3,0,0]=4 356 B12R1.260 CC(=O)OC(C)Nc1nc[nH]n1 e72094e0c0095ab77b570ddf1eb417ff [0,1,0,0,0,0|3,0,0]=4 357 B12R1.260 CC(=O)OC(C)Oc1c[nH]cn1 c9d201d8057e49e5589167f3ff1e85a2 [0,1,0,0,0,0|2,0,0]=3 358 B12R1.260 CC(C)NC(C)Cc1c[nH]cn1 01383f629180b51a60606f5aa8159319 [0,1,0,0,0,0|1,0,1]=3 359 B12R1.260 CC(C)N[C@@H](C)Cc1c[nH]cn1 1773144c4ae62b57006a74ec170209f6 [0,1,0,0,0,0|1,0,1]=3 360 B12R1.260 CC(C)N[C@H](C)Cc1c[nH]cn1 6a69a5eb26c396290c7ce126ad9f5f40 [0,1,0,0,0,0|1,0,1]=3 361 B12R1.260 CC(CC(=O)O)Nc1c[nH]cn1 e82ae7918caf9661af52b2594ac44b51 [0,1,0,0,0,0|3,0,0]=4 362 B12R1.260 CC(CC(=O)O)Oc1c[nH]cn1 b2ddbf2aadf06eba9baaf68ec9fcc9d7 [0,1,0,0,0,0|3,0,0]=4 363 B12R1.260 C[C@@H](CC(=O)O)Nc1c[nH]cn1 167e97d8bbc05ea6201170bad0a39c93 [0,1,0,0,0,0|3,0,0]=4 364 B12R1.260 C[C@H](CC(=O)O)Nc1c[nH]cn1 4f4407f2fcff87b064f96554f3c102f7 [0,1,0,0,0,0|3,0,0]=4 365 B12R1.264 C=C(COc1c[nH]cn1)C(=O)O 23fdd592fbcbf778fca7ed0c347e9144 [0,1,0,0,0,0|3,0,0]=4 366 B12R1.264 CC(=O)C(=O)CNc1cocn1 ea0848efc205cf9b962a5fcbc09ec914 [0,1,0,0,0,0|3,0,0]=4 367 B12R1.264 CC(=O)C(=O)CNc1cscn1 551644b49fc539e776cae746687ba25f [0,1,0,0,0,0|3,0,0]=4 368 B12R1.264 CC(=O)C(=O)CNc1nc[nH]n1 e0c019184843ef4ccb6748ee2e628115 [0,1,0,0,0,0|3,0,0]=4 369 B12R1.264 CC(=O)C(=O)COc1c[nH]cn1 b7be03e63d61e7f791d7c89b5c598d2b [0,1,0,0,0,0|2,0,0]=3 370 B12R1.264 CC(=O)C(=O)NCc1cocn1 4ff9d9f61bf6584bbdc40aed93327542 [0,1,0,0,0,0|3,0,0]=4 371 B12R1.264 CC(=O)C(=O)NCc1cscn1 b0719055f900e76838ef8a1fbd98f1c3 [0,1,0,0,0,0|3,0,0]=4 372 B12R1.264 CC(=O)C(C)NCc1c[nH]nn1 419e250c6b5d511b30844f76c0b8dd7c [0,1,0,0,0,0|3,0,0]=4 373 B12R1.264 CC(=O)C(C)NCc1cc[nH]c1 d12ff95775979fd2fc665461999baafe [0,1,0,0,0,0|3,0,0]=4 374 B12R1.264 CC(=O)C(C)NCc1cocn1 eb4577e36eae1f822777eb3d634595d0 [0,1,0,0,0,0|3,0,0]=4 375 B12R1.264 CC(=O)C(C)NCc1cscn1 ed03d483b9cf1038e141637a53820f68 [0,1,0,0,0,0|3,0,0]=4 376 B12R1.264 CC(=O)C(C)OCc1cocn1 08b2e8a9c3edc483e580d3b808f57cea [0,1,0,0,0,0|3,0,0]=4 377 B12R1.264 CC(=O)C(C)OCc1cscn1 75b5ab99cd1cb558dd05149ba932c51e [0,1,0,0,0,0|3,0,0]=4 378 B12R1.264 CC(=O)C(C)OCc1nc[nH]n1 3da3a134af338882090a15562b2f98fe [0,1,0,0,0,0|3,0,0]=4 379 B12R1.264 CC(=O)N(C)CCc1cccs1 1c9999f099c6a54703cd1e3489f23412 [0,1,0,0,0,0|2,0,0]=3 380 B12R1.264 CC(=O)N(C)CCn1ccnc1 0d81b0d70b1ec6beffd192931a5bd228 [0,1,0,0,0,0|2,0,1]=4 381 B12R1.264 CC(C)N(C)CCc1c[nH]cn1 f808e300b2dc08a7035fad67febcb740 [0,1,0,0,0,0|1,0,1]=3 382 B12R1.264 CC(COc1c[nH]cn1)C(=O)O 245c4031e669c905f6c158578d242ea9 [0,1,0,0,0,0|3,0,0]=4 383 B12R1.264 O=C(O)C(=O)COc1c[nH]cn1 d67328faf347090424590d8d94cde91b [0,1,0,0,0,0|3,0,0]=4 384 B12R1.264 O=C(O)C(F)CNc1c[nH]cn1 bb4690315184d6dc10be286b1626b0ba [0,1,0,0,0,0|3,0,0]=4 385 B12R1.477 C#CC(=O)NCCc1ccco1 acc3fec118e663ac0cbb0160e81e745a [0,1,0,0,0,0|2,0,1]=4 386 B12R1.477 C#CC(=O)NCCc1cccs1 0c66771001200ab22cbc030349a89e24 [0,1,0,0,0,0|2,0,1]=4 387 B12R1.477 C#CC(=O)NCCc1ccsc1 995908330e2ee7233457ba1a95b2edf1 [0,1,0,0,0,0|2,0,1]=4 388 B12R1.477 C#CC(=O)NCCc1cscn1 a8f1e6b4076ffe8db15f44f50fcd655e [0,1,0,0,0,0|1,0,1]=3 389 B12R1.477 C#CC(=O)NCCc1nccs1 f9f33c94633429694e8de679d4bff377 [0,1,0,0,0,0|2,0,1]=4 390 B12R1.477 C#CC(=O)NCCn1cccn1 9fc33a42dc6d98de6b247c7c994893a0 [0,1,0,0,0,0|2,0,1]=4 391 B12R1.477 C#CC(=O)NCCn1cncn1 ea5e436674d87a3d93063e0327135476 [0,1,0,0,0,0|1,0,2]=4 392 B12R1.477 C#CC(C)NCCc1c[nH]cn1 6bb413575bd75cfea359c2f846c6be91 [0,1,0,0,0,0|1,0,1]=3 393 B12R1.477 C#CC(C)NCCc1cscn1 391ca41f5cce3b24b42a78322963d0c3 [0,1,0,0,0,0|2,0,1]=4 394 B12R1.477 C#CC(C)OCCc1c[nH]cn1 d56b8f812f4c702d4a83ac9c8bc3fced [0,1,0,0,0,0|2,0,1]=4 395 B12R1.477 C#C[C@@H](C)NCCc1c[nH]cn1 0ca4a11632030cf986805c97a7cdb568 [0,1,0,0,0,0|1,0,1]=3 396 B12R1.477 C#C[C@@H](C)NCCc1cscn1 142165dfda039c0943519adf59d465b1 [0,1,0,0,0,0|2,0,1]=4 397 B12R1.477 C#C[C@@H](C)OCCc1c[nH]cn1 26a563fe184f9a77947683e398cb9a96 [0,1,0,0,0,0|2,0,1]=4 398 B12R1.477 C#C[C@H](C)NCCc1c[nH]cn1 f1ebe36ec1dcc8bea11edcae0798035b [0,1,0,0,0,0|1,0,1]=3 399 B12R1.477 C#C[C@H](C)NCCc1cscn1 dfe1773666511d983669c4feae7ae9af [0,1,0,0,0,0|2,0,1]=4 400 B12R1.477 C#C[C@H](C)OCCc1c[nH]cn1 df26f7f9b623024e163949246f7f2b85 [0,1,0,0,0,0|2,0,1]=4 401 B12R1.477 C=C(C=O)OCCc1c[nH]cn1 db3894dbd7905fadf75bc25b599d74bf [0,1,0,0,0,0|1,0,1]=3 402 B12R1.477 C=C(C=O)OCCc1cscn1 6fdfcbfde022b3c3c8f05a565dc1128f [0,1,0,0,0,0|2,0,1]=4 403 B12R1.477 C=CC(=O)NCCc1ccco1 1ddb9046ba07351bdd94e2a85d1031a4 [0,1,0,0,0,0|2,0,1]=4 404 B12R1.477 C=CC(=O)NCCc1cccs1 abdbc5286d9883c43d21698527dc9ebb [0,1,0,0,0,0|2,0,1]=4 405 B12R1.477 C=CC(=O)NCCc1ccsc1 1105ba63bb8750cde025117d9ca0da77 [0,1,0,0,0,0|2,0,1]=4 406 B12R1.477 C=CC(=O)NCCc1cscn1 0894a3a45733e8541e96f545d9759e65 [0,1,0,0,0,0|1,0,1]=3 407 B12R1.477 C=CC(=O)NCCc1nccs1 6eb64ee5216a2b08aa79864cd4e618ee [0,1,0,0,0,0|2,0,1]=4 408 B12R1.477 C=CC(=O)NCCn1cccn1 b49766f86fb3d6dd85c6d217ab0c6a78 [0,1,0,0,0,0|2,0,1]=4 409 B12R1.477 C=CC(=O)NCCn1cncn1 504eec597e3e3a5a351c9dce0f9af03c [0,1,0,0,0,0|1,0,2]=4 410 B12R1.477 C=CC(C)NCCc1c[nH]cn1 f147f886c5c5889334e405f8fb8eaf17 [0,1,0,0,0,0|1,0,1]=3 411 B12R1.477 C=CC(C)NCCc1cscn1 422d105921e6b35dd21b66536940d0a2 [0,1,0,0,0,0|2,0,1]=4 412 B12R1.477 C=CC(C)OCCc1c[nH]cn1 eac18d3c8363239ead945c43717d14d2 [0,1,0,0,0,0|2,0,1]=4 413 B12R1.477 C=C[C@H](C)OCCc1c[nH]cn1 925daf2a2b41db55a8e73489fcdc8a23 [0,1,0,0,0,0|2,0,1]=4 414 B12R1.477 CC(C#N)NCCc1c[nH]cn1 dc9606dfcbc993daa174e84b611dda7e [0,1,0,0,0,0|1,0,1]=3 415 B12R1.477 CC(C#N)NCCc1cscn1 b06ca37bff510aee1c6bb257f17c622f [0,1,0,0,0,0|2,0,1]=4 416 B12R1.477 CC(C#N)OCCc1c[nH]cn1 102cbda046a64675e16958f4b381cd1b [0,1,0,0,0,0|2,0,1]=4 417 B12R1.477 CC(C=O)NCCc1c[nH]cn1 48397eddb29942d31ceb8d1e6c835987 [0,1,0,0,0,0|0,0,1]=2 418 B12R1.477 CC(C=O)NCCc1cc[nH]n1 fdbedbe72c16e62da869432d51e07398 [0,1,0,0,0,0|2,0,1]=4 419 B12R1.477 CC(C=O)NCCc1ccc[nH]1 3f7ddb22392788b27286076425c8819c [0,1,0,0,0,0|1,0,2]=4 420 B12R1.477 CC(C=O)NCCc1ccco1 74c805978d89fb335630f3e0efc6cf33 [0,1,0,0,0,0|2,0,1]=4 421 B12R1.477 CC(C=O)NCCc1cccs1 3ed6f4f435c825f7bd74abf741af2ade [0,1,0,0,0,0|2,0,1]=4 422 B12R1.477 CC(C=O)NCCc1ccsc1 f12126d0464ff9f289478f40f6c7beea [0,1,0,0,0,0|2,0,1]=4 423 B12R1.477 CC(C=O)NCCc1cn[nH]c1 12935523892e4f59b9825d7fc1def3fd [0,1,0,0,0,0|2,0,1]=4 424 B12R1.477 CC(C=O)NCCc1cscn1 55a21066ca0fd2cfd2615604f1cb8637 [0,1,0,0,0,0|1,0,1]=3 425 B12R1.477 CC(C=O)NCCc1ncc[nH]1 82ebdd5cd22ee96cfcb963eae4f77e1c [0,1,0,0,0,0|2,0,1]=4 426 B12R1.477 CC(C=O)NCCc1nccs1 b56a5c252d94a482e98bc93b4ac368a4 [0,1,0,0,0,0|2,0,1]=4 427 B12R1.477 CC(C=O)NCCn1cccn1 fc3cb8e2994fa6a99c3900e012a5876f [0,1,0,0,0,0|2,0,1]=4 428 B12R1.477 CC(C=O)NCCn1cncn1 5fde28c5e214a5a85e616a520e542dcf [0,1,0,0,0,0|1,0,2]=4 429 B12R1.477 CC(C=O)OCCc1c[nH]cn1 de62d2f1dca6fb66c128889f0a6be984 [0,1,0,0,0,0|1,0,1]=3 430 B12R1.477 CC(C=O)OCCc1cscn1 37296fa3629eec240f671a397ef4a9b2 [0,1,0,0,0,0|2,0,1]=4 431 B12R1.477 CC(CF)OCCc1c[nH]cn1 b079d5c295de013701b4315cee9b14aa [0,1,0,0,0,0|2,0,1]=4 432 B12R1.477 CC(CO)NCCc1c[nH]cn1 22bba351656d71bdcffec3e691358bda [0,1,0,0,0,0|0,0,2]=3 433 B12R1.477 CC(CO)NCCc1cscn1 5a4f28a23aaa4b3d1bdc88c593fb0070 [0,1,0,0,0,0|1,0,2]=4 434 B12R1.477 CC(CS)OCCc1c[nH]cn1 70b46a03e8ea2fe9e68aea383a48611f [0,1,0,0,0,0|1,1,1]=4 435 B12R1.477 CCC(=O)CNCc1c[nH]nn1 13f103585e161ef5dbd43f88c7bf5b0a [0,1,0,0,0,0|3,0,0]=4 436 B12R1.477 CCC(=O)CNCc1cc[nH]c1 3646ce99cb3850a5ffbe344b8b893d81 [0,1,0,0,0,0|3,0,0]=4 437 B12R1.477 CCC(=O)CNCc1cocn1 dd011e3559bf75fadd72430e14dbac9c [0,1,0,0,0,0|3,0,0]=4 438 B12R1.477 CCC(=O)CNCc1cscn1 d491f51593036ddebedf462d232c01a1 [0,1,0,0,0,0|3,0,0]=4 439 B12R1.477 CCC(=O)COCc1cc[nH]c1 fa7d9c089e529d4e0108123119c1b733 [0,1,0,0,0,0|3,0,0]=4 440 B12R1.477 CCC(=O)COCc1cocn1 6d59998f171390b917675b20bbe92204 [0,1,0,0,0,0|3,0,0]=4 441 B12R1.477 CCC(=O)COCc1cscn1 5d89f6bb2e9d50220da49645dd779fd0 [0,1,0,0,0,0|3,0,0]=4 442 B12R1.477 CCC(=O)COCc1nc[nH]n1 75811db1242cc610c4da90bc79581b8a [0,1,0,0,0,0|3,0,0]=4 443 B12R1.477 CCC(=O)NCCc1ccco1 a57a3f81596031473f72e71516ffc990 [0,1,0,0,0,0|2,0,0]=3 444 B12R1.477 CCC(=O)NCCc1cccs1 fc6c794fcf581c196e6509dcd1a8b636 [0,1,0,0,0,0|2,0,0]=3 445 B12R1.477 CCC(=O)NCCc1ccsc1 7c55d82f8daf8ab72c270c2aa1076dbc [0,1,0,0,0,0|2,0,0]=3 446 B12R1.477 CCC(=O)NCCc1cnoc1 b1b49d09c7fa370eecc387d89470f843 [0,1,0,0,0,0|2,0,1]=4 447 B12R1.477 CCC(=O)NCCc1cscn1 e43422e040109af83b4a33a11d9ce3d8 [0,1,0,0,0,0|1,0,0]=2 448 B12R1.477 CCC(=O)NCCc1nccs1 de69a1fbc50f98bee8e6c626d637b1b7 [0,1,0,0,0,0|2,0,0]=3 449 B12R1.477 CCC(=O)NCCc1nncs1 57ca4e934f017ec5619d888c5269ed50 [0,1,0,0,0,0|2,0,1]=4 450 B12R1.477 CCC(=O)NCCn1cccc1 1059cccc794ee47259d28f42951e16bb [0,1,0,0,0,0|3,0,0]=4 451 B12R1.477 CCC(=O)NCCn1cccn1 f4552e9fa259196519707790cb3ae578 [0,1,0,0,0,0|2,0,0]=3 452 B12R1.477 CCC(=O)NCCn1ccnc1 744b8f7ad69b1e516ff63c52e7bfa567 [0,1,0,0,0,0|2,0,1]=4 453 B12R1.477 CCC(=O)NCCn1ccnn1 3473a316c61ee6ad604798e256684f64 [0,1,0,0,0,0|3,0,0]=4 454 B12R1.477 CCC(=O)NCCn1cncn1 8eace49fbb85802d177933034318efd1 [0,1,0,0,0,0|1,0,1]=3 455 B12R1.477 CCC(=O)OCOc1c[nH]cn1 70411d9f534680a83f1485c50d49b2de [0,1,0,0,0,0|2,0,0]=3 456 B12R1.477 CCC(C)NCCc1c[nH]cn1 6864b52385935181b7809d729536d95f [0,1,0,0,0,0|1,0,1]=3 457 B12R1.477 CCC(C)NCCc1cscn1 122d85315d320cc834319bdbb2f3a989 [0,1,0,0,0,0|2,0,1]=4 458 B12R1.477 CCC(C)OCCc1c[nH]cn1 f8dc772e0970bda624f694956c800f15 [0,1,0,0,0,0|2,0,1]=4 459 B12R1.477 CCS(=O)CCOc1c[nH]cn1 77c990ddf1de7b873b1385172a6b147d [0,1,0,0,0,0|3,0,0]=4 460 B12R1.477 CC[C@@H](C)NCCc1c[nH]cn1 5397ab1da447a9e1b5745b7bfa974e3b [0,1,0,0,0,0|1,0,1]=3 461 B12R1.477 CC[C@@H](C)NCCc1cscn1 3f19afc52e8364e97b9fd07491e05347 [0,1,0,0,0,0|2,0,1]=4 462 B12R1.477 CC[C@@H](C)OCCc1c[nH]cn1 e5cdb752990d6fbbfc6e1a59bb183377 [0,1,0,0,0,0|2,0,1]=4 463 B12R1.477 CC[C@H](C)NCCc1c[nH]cn1 9a3ee3b99cf79f7ef7da5c6492bc3652 [0,1,0,0,0,0|1,0,1]=3 464 B12R1.477 CC[C@H](C)NCCc1cscn1 cbc843a348d6fd47ef1485e6ad6e0407 [0,1,0,0,0,0|2,0,1]=4 465 B12R1.477 CC[C@H](C)OCCc1c[nH]cn1 2770ea50f495ba0f02fc4fc63f7e66b9 [0,1,0,0,0,0|2,0,1]=4 466 B12R1.477 CNC(=O)CCNc1c[nH]cn1 bfeb6a45e2aaeecb9853c7ce09da8187 [0,1,0,0,0,0|2,0,0]=3 467 B12R1.477 CNC(=O)CCNc1c[nH]nn1 699fe259f725555d23693d900261b8d5 [0,1,0,0,0,0|3,0,0]=4 468 B12R1.477 CNC(=O)CCNc1cocn1 c4043fc9ed8d4918ac85b81d24273912 [0,1,0,0,0,0|3,0,0]=4 469 B12R1.477 CNC(=O)CCNc1cscn1 37019c241c625fd10a2688e6abd6a3cf [0,1,0,0,0,0|3,0,0]=4 470 B12R1.477 CNC(=O)CCNc1nc[nH]n1 2851e0ce4c4ee07cfe6406e382dca42d [0,1,0,0,0,0|3,0,0]=4 471 B12R1.477 CNC(=O)CCOc1c[nH]cn1 df3f99952d971a1f6d74c1b8b340f5f0 [0,1,0,0,0,0|2,0,0]=3 472 B12R1.477 CNC(=O)CNCc1c[nH]nn1 4e31e77da06d4da91ae58c4423fc56b1 [0,1,0,0,0,0|3,0,0]=4 473 B12R1.477 CNC(=O)CNCc1cc[nH]c1 8d49ad7f48d56c847c97f6a141cd5659 [0,1,0,0,0,0|3,0,0]=4 474 B12R1.477 CNC(=O)CNCc1cocn1 f059b90a4aa1d935a381fb0ca60d6aee [0,1,0,0,0,0|3,0,0]=4 475 B12R1.477 CNC(=O)CNCc1cscn1 49564b67b237049bf97d6fb1baf1b37d [0,1,0,0,0,0|3,0,0]=4 476 B12R1.477 CNC(=O)COCc1cc[nH]c1 ce5ca1c7ae4c1bf121626cc8f5e0c76d [0,1,0,0,0,0|3,0,0]=4 477 B12R1.477 CNC(=O)COCc1cocn1 0ac0b8bdc6724a1bd0b839b6276c24bf [0,1,0,0,0,0|3,0,0]=4 478 B12R1.477 CNC(=O)COCc1cscn1 60741b25c6bb1921101f354a0e479738 [0,1,0,0,0,0|3,0,0]=4 479 B12R1.477 CNC(=O)COCc1nc[nH]n1 260905ce4debbb74eb99a328a271e1e7 [0,1,0,0,0,0|3,0,0]=4 480 B12R1.477 COC(=O)CCNc1c[nH]cn1 d3e7100295cc9c4173a5d5e088e4e84b [0,1,0,0,0,0|2,0,0]=3 481 B12R1.477 COC(=O)CCNc1cocn1 40197941e60de7319c7a49cd8fa1f01d [0,1,0,0,0,0|3,0,0]=4 482 B12R1.477 COC(=O)CCNc1cscn1 a1893fc4fdf0707bc067f30778bf8a41 [0,1,0,0,0,0|3,0,0]=4 483 B12R1.477 COC(=O)CCNc1nc[nH]n1 91d5713adedbbfe4780dd6fadb93fc81 [0,1,0,0,0,0|3,0,0]=4 484 B12R1.477 COC(=O)CCOc1c[nH]cn1 b54cbaa4b8968a54eb60ee6fd3a9e0d5 [0,1,0,0,0,0|2,0,0]=3 485 B12R1.477 COC(=O)CNCc1c[nH]nn1 02eecaa08369a47b9520df95466f932a [0,1,0,0,0,0|3,0,0]=4 486 B12R1.477 COC(=O)CNCc1cc[nH]c1 2f96fbab15c2435dde51b779077ea3fb [0,1,0,0,0,0|3,0,0]=4 487 B12R1.477 COC(=O)CNCc1cocn1 ae739ccfacea18c9b27110b47f3e1c0f [0,1,0,0,0,0|3,0,0]=4 488 B12R1.477 COC(=O)CNCc1cscn1 e1283ba2aac20852917a08386567c98f [0,1,0,0,0,0|3,0,0]=4 489 B12R1.477 COC(=O)COCc1cc[nH]c1 df5caccfc2d2c597bab44f0c9a12d4b5 [0,1,0,0,0,0|3,0,0]=4 490 B12R1.477 COC(=O)COCc1cocn1 744f606dadbd654185db37c77bc908f2 [0,1,0,0,0,0|3,0,0]=4 491 B12R1.477 COC(=O)COCc1cscn1 6c19dd2734d0618f34ca651a9ea1a9d1 [0,1,0,0,0,0|3,0,0]=4 492 B12R1.477 COC(=O)COCc1nc[nH]n1 a823e48b9c220930b25c6f16d7567c9d [0,1,0,0,0,0|3,0,0]=4 493 B12R1.477 COC(=O)OCOc1c[nH]cn1 b16c64d93bb78a36b7d331b58436eb01 [0,1,0,0,0,0|2,0,0]=3 494 B12R1.477 C[C@@H](CO)NCCc1c[nH]cn1 ec379b0a65293e8e5c6c3f12e8054b17 [0,1,0,0,0,0|0,0,2]=3 495 B12R1.477 C[C@@H](CO)NCCc1cscn1 1e9ea6be93f95d76e220063567061752 [0,1,0,0,0,0|1,0,2]=4 496 B12R1.477 C[C@H](C=O)NCCc1c[nH]cn1 32ecc67715ca31906132459af6625335 [0,1,0,0,0,0|0,0,1]=2 497 B12R1.477 C[C@H](C=O)NCCc1cc[nH]n1 3572ca7c46af9221375af41fec024a75 [0,1,0,0,0,0|2,0,1]=4 498 B12R1.477 C[C@H](C=O)NCCc1ccc[nH]1 37e1b485066d68bb972103b2d15a0d37 [0,1,0,0,0,0|1,0,2]=4 499 B12R1.477 C[C@H](C=O)NCCc1ccco1 9a950faafafd4ac5cfe77991e35bd62b [0,1,0,0,0,0|2,0,1]=4 500 B12R1.477 C[C@H](C=O)NCCc1cccs1 3aa6ffadd2bc1b70ea08f6dc8b49a26f [0,1,0,0,0,0|2,0,1]=4 501 B12R1.477 C[C@H](C=O)NCCc1ccsc1 2fae2d357c876ab94809d402860a6787 [0,1,0,0,0,0|2,0,1]=4 502 B12R1.477 C[C@H](C=O)NCCc1cn[nH]c1 2925c39530b4c11a80bf4e432bf0de62 [0,1,0,0,0,0|2,0,1]=4 503 B12R1.477 C[C@H](C=O)NCCc1cscn1 deb9fe7e4c55c73f0c824add7fb55ce4 [0,1,0,0,0,0|1,0,1]=3 504 B12R1.477 C[C@H](C=O)NCCc1ncc[nH]1 fbe18335486480c1fab9273db8d29e46 [0,1,0,0,0,0|2,0,1]=4 505 B12R1.477 C[C@H](C=O)NCCc1nccs1 e1ea5f2a7f6624e7db14b4f876ed3fc0 [0,1,0,0,0,0|2,0,1]=4 506 B12R1.477 C[C@H](C=O)NCCn1cccn1 b7a289c83ecfd34a38f8d6bf8f5c0d25 [0,1,0,0,0,0|2,0,1]=4 507 B12R1.477 C[C@H](C=O)NCCn1cncn1 b150f91982a950049d908c2e4ed62a50 [0,1,0,0,0,0|1,0,2]=4 508 B12R1.477 C[C@H](C=O)OCCc1c[nH]cn1 93be87937152a22aebefb240afd1951b [0,1,0,0,0,0|1,0,1]=3 509 B12R1.477 C[C@H](C=O)OCCc1cscn1 eb9550a4ab39c505cfae9a5b28ed72db [0,1,0,0,0,0|2,0,1]=4 510 B12R1.477 C[C@H](CO)NCCc1c[nH]cn1 95fff0dedc9404a9e26fa5a6a97e002e [0,1,0,0,0,0|0,0,2]=3 511 B12R1.477 C[C@H](CO)NCCc1cscn1 5de8bb5a8dac7bc448c1f5db7dbfe9f4 [0,1,0,0,0,0|1,0,2]=4 512 B12R1.477 C[C@H](CS)OCCc1c[nH]cn1 e8dd10f3e2ced09d91232b06b8258c21 [0,1,0,0,0,0|1,1,1]=4 513 B12R1.477 O=C(CCNc1c[nH]cn1)NO 04220e2f1a03a68b0a5669410625d433 [0,1,0,0,0,0|3,0,0]=4 514 B12R1.477 O=C(CF)NCCc1ccco1 a5468b77bbeee8125a1cf82982213246 [0,1,0,0,0,0|2,0,0]=3 515 B12R1.477 O=C(CF)NCCc1cccs1 8ad0a550d473de8f84056b481bfae7f4 [0,1,0,0,0,0|2,0,0]=3 516 B12R1.477 O=C(CF)NCCc1ccsc1 dcd390b195d85d68b5510a861880b325 [0,1,0,0,0,0|2,0,0]=3 517 B12R1.477 O=C(CF)NCCc1cnoc1 0493ea17d0359a1e49dbb2b2e6d81e2c [0,1,0,0,0,0|2,0,1]=4 518 B12R1.477 O=C(CF)NCCc1cscn1 2744a12092b97175a0d80c5b58356bb3 [0,1,0,0,0,0|1,0,0]=2 519 B12R1.477 O=C(CF)NCCc1nccs1 33f335a3792a70e383c79eeb5b4454c9 [0,1,0,0,0,0|2,0,0]=3 520 B12R1.477 O=C(CF)NCCc1nncs1 d9a11dcb094f8e581ca951e3723ef615 [0,1,0,0,0,0|2,0,1]=4 521 B12R1.477 O=C(CF)NCCn1cccc1 a82e48a183e6ca7d95e2080b900f7064 [0,1,0,0,0,0|3,0,0]=4 522 B12R1.477 O=C(CF)NCCn1cccn1 0dda3f4ef5c6e343160c237cb23da323 [0,1,0,0,0,0|2,0,0]=3 523 B12R1.477 O=C(CF)NCCn1ccnc1 9d87cb69a5def752d92015318846f97a [0,1,0,0,0,0|2,0,1]=4 524 B12R1.477 O=C(CF)NCCn1ccnn1 a57a42aefd5fac1a5073ca61bb911ee3 [0,1,0,0,0,0|3,0,0]=4 525 B12R1.477 O=C(CF)NCCn1cncn1 55a1a111673d381c29d1a0bdd8e838b5 [0,1,0,0,0,0|1,0,1]=3 526 B12R1.477 O=C(CO)CNCc1c[nH]nn1 c0427b6a44bcead199842f628403d2c7 [0,1,0,0,0,0|3,0,0]=4 527 B12R1.477 O=C(CO)CNCc1cc[nH]c1 cdd5e4705ae293a5856dca531304f580 [0,1,0,0,0,0|3,0,0]=4 528 B12R1.477 O=C(CO)CNCc1cocn1 0b9006a1afdfe9fc0a978fcab7152aad [0,1,0,0,0,0|3,0,0]=4 529 B12R1.477 O=C(CO)CNCc1cscn1 3be04622fe03d5b2730cae47298ca6af [0,1,0,0,0,0|3,0,0]=4 530 B12R1.477 O=C(CO)NCCc1ccco1 ad96d88f7253f10830cfafa1d4f43183 [0,1,0,0,0,0|2,0,0]=3 531 B12R1.477 O=C(CO)NCCc1cccs1 9f2e0da32d88862d93c942c60f2d338a [0,1,0,0,0,0|2,0,0]=3 532 B12R1.477 O=C(CO)NCCc1ccsc1 fac9a46f75f682642febcf6e3578e9e2 [0,1,0,0,0,0|2,0,0]=3 533 B12R1.477 O=C(CO)NCCc1cnoc1 d5b2db24f0d51a7aeb94d7bc8ea7616c [0,1,0,0,0,0|2,0,1]=4 534 B12R1.477 O=C(CO)NCCc1cscn1 12ded82859b41536ba50cea5e6e9e01d [0,1,0,0,0,0|1,0,0]=2 535 B12R1.477 O=C(CO)NCCc1nccs1 a4940d2425d04c4f1141e2c040b6a8ac [0,1,0,0,0,0|2,0,0]=3 536 B12R1.477 O=C(CO)NCCc1nncs1 c3e93abcc533500d9c9539225d32a651 [0,1,0,0,0,0|2,0,1]=4 537 B12R1.477 O=C(CO)NCCn1cccc1 9c86028ace416a8f047fa5f19cce66df [0,1,0,0,0,0|3,0,0]=4 538 B12R1.477 O=C(CO)NCCn1cccn1 ad3999d31d973f413eb3a2bd27c2a3db [0,1,0,0,0,0|2,0,0]=3 539 B12R1.477 O=C(CO)NCCn1ccnc1 f34d5a1f3c6364f0e2d29b109b334374 [0,1,0,0,0,0|2,0,1]=4 540 B12R1.477 O=C(CO)NCCn1ccnn1 10c04c569fefecaf85768e1022d67d89 [0,1,0,0,0,0|3,0,0]=4 541 B12R1.477 O=C(CO)NCCn1cncn1 a451064a916c51d6f49af0d88364a5e5 [0,1,0,0,0,0|1,0,1]=3 542 B12R1.477 O=C(CS)NCCc1ccco1 3467c703b66b0c74a5d31bad2d6c4232 [0,1,0,0,0,0|2,0,0]=3 543 B12R1.477 O=C(CS)NCCc1cccs1 727fb833bd1797230419b932f1b67fc0 [0,1,0,0,0,0|2,0,0]=3 544 B12R1.477 O=C(CS)NCCc1ccsc1 3db3af717285b516a574475b45ff66a3 [0,1,0,0,0,0|2,0,0]=3 545 B12R1.477 O=C(CS)NCCc1cnoc1 21a929f9cbc1fa7a85e823b6110540d2 [0,1,0,0,0,0|2,0,1]=4 546 B12R1.477 O=C(CS)NCCc1cscn1 c53042598e6dd9a97dd1fb84e233fd2d [0,1,0,0,0,0|1,0,0]=2 547 B12R1.477 O=C(CS)NCCc1nccs1 9bac3c4e6c537e806ce875fdcf1086ca [0,1,0,0,0,0|2,0,0]=3 548 B12R1.477 O=C(CS)NCCc1nncs1 0f3630fa81039424c138ee0b1e8190db [0,1,0,0,0,0|2,0,1]=4 549 B12R1.477 O=C(CS)NCCn1cccc1 a5cd0b1aa65a804d13022e5be8b266aa [0,1,0,0,0,0|3,0,0]=4 550 B12R1.477 O=C(CS)NCCn1cccn1 6a3992d578fe5d1eb815f4513df7bd45 [0,1,0,0,0,0|2,0,0]=3 551 B12R1.477 O=C(CS)NCCn1ccnc1 aaf8ffaf0a186546a03d1dc138bdb51b [0,1,0,0,0,0|2,0,1]=4 552 B12R1.477 O=C(CS)NCCn1ccnn1 3667751dcfd302406a47f5cf301a98dc [0,1,0,0,0,0|3,0,0]=4 553 B12R1.477 O=CC(=O)NCCc1ccco1 748bbf1293f222141b476fa3de2650f5 [0,1,0,0,0,0|2,0,1]=4 554 B12R1.477 O=CC(=O)NCCc1cccs1 94d25322109c7cc039e71b2378551b39 [0,1,0,0,0,0|2,0,1]=4 555 B12R1.477 O=CC(=O)NCCc1ccsc1 8f0b991146468c06c9def09ee11dab27 [0,1,0,0,0,0|2,0,1]=4 556 B12R1.477 O=CC(=O)NCCc1cscn1 40254cebd73a277e9fa9269409db4b13 [0,1,0,0,0,0|1,0,1]=3 557 B12R1.477 O=CC(=O)NCCc1nccs1 5872f78502b6494fd3a9be60a544ecc8 [0,1,0,0,0,0|2,0,1]=4 558 B12R1.477 O=CC(=O)NCCn1cccn1 0f9b7833902ed3303f18cfeb1c9f6c0b [0,1,0,0,0,0|2,0,1]=4 559 B12R1.477 O=CC(=O)NCCn1cncn1 d684bfaa60b19eafec1acd0ab0e30db5 [0,1,0,0,0,0|1,0,2]=4 560 B12R1.890 CC(C)(C)NCCc1c[nH]cn1 53d5fe89cb0c6e2d4a9ebe345e4d0788 [0,1,0,0,0,0|1,0,1]=3 561 B12R1.890 CC(C)(C)NCCc1cscn1 e9ce353029234e7e62fe437c344b5dad [0,1,0,0,0,0|2,0,1]=4 562 B12R1.890 CS(=O)(=O)CCNc1c[nH]cn1 21e1331c5d36a0e2ccc683d4cbc4e588 [0,1,0,0,0,0|3,0,0]=4 563 B12R1.890 CS(=O)(=O)CCOc1c[nH]cn1 1a3854df1a5c3790777a9d79bf0fc2dd [0,1,0,0,0,0|3,0,0]=4 564 B10R0.4 CC(=O)NCCCCNC=O 7f9daa482f34546fab8572802320de5d [0,0,1,0,0,0|1,0,2]=4 565 B12R2.6 Cc1cc(c[nH]1)c2c[nH]cn2 e1bdc821929caecb05e90f8d3541c1fc [0,0,0,1,0,0|1,0,2]=4 566 B12R2.6 Cc1cc(n[nH]1)c2c[nH]cn2 c001c5d5e9af20e352ea67f7648dba37 [0,0,0,1,0,0|2,0,1]=4 567 B12R2.136 O=C1CC(C1)Nc2cscn2 c24cf2cf3c022e9cbae789634fd7882b [0,0,0,1,0,0|3,0,0]=4 568 B12R2.136 O=C1CC(C1)Nc2nc[nH]n2 c980d3a9af7d3fd35b316af307b07e58 [0,0,0,1,0,0|3,0,0]=4 569 B12R2.136 O=C1CC(C1)Oc2c[nH]cn2 daeaa377876d1536f7f754556adb98de [0,0,0,1,0,0|2,0,0]=3 570 B12R2.1362 CC(=O)N1CCn2c1ccn2 a1b761aed5ff1f067e5c34a339ce9074 [0,0,0,1,0,0|2,0,0]=3 571 B12R2.2383 c1nc(c[nH]1)CCNC2CC2 5fed8ecb09116d453bd87fbe68f45693 [0,0,0,1,0,0|1,0,1]=3 572 B12R2.2383 c1nc(c[nH]1)CCOC2CC2 9b4812b2e8bc1118881d267da84226c8 [0,0,0,1,0,0|2,0,1]=4 573 B12R2.2383 c1nc(cs1)CCNC2CC2 d9a408169218e1719313399f08be8dde [0,0,0,1,0,0|2,0,1]=4 574 B10R1.66 C=C(Br)CNc1c[nH]cn1 4827e0d06343613cd92fbfe67068a219 [0,0,0,0,1,0|2,0,1]=4 575 B10R1.66 C=C(Br)COc1c[nH]cn1 e4c2d0d06af3c7172492f2f8a429bded [0,0,0,0,1,0|2,0,1]=4 576 B10R1.66 C=C(C)CNc1c[nH]cn1 8c938fd26c0bf911e0915545b61668f4 [0,0,0,0,1,0|2,0,0]=3 577 B10R1.66 C=C(C)CNc1cocn1 523bad2f76461dc8652c04462f4bea86 [0,0,0,0,1,0|3,0,0]=4 578 B10R1.66 C=C(C)CNc1cscn1 abf8a3fcef4b9e5ba22d56373b4b2611 [0,0,0,0,1,0|3,0,0]=4 579 B10R1.66 C=C(C)CNc1nc[nH]n1 3455617f26e2e25f8505b2e4667ee659 [0,0,0,0,1,0|3,0,0]=4 580 B10R1.66 C=C(C)COc1c[nH]cn1 e74389c29cb803b52dea97da02b860f9 [0,0,0,0,1,0|2,0,0]=3 581 B10R1.66 C=C(Cl)COc1c[nH]cn1 880a848e3f0c6d484fee03dc7f66b6fc [0,0,0,0,1,0|2,0,1]=4 582 B10R1.66 C=C(F)COc1c[nH]cn1 39d1e1b17da364263229fff4d0bb6575 [0,0,0,0,1,0|2,0,1]=4 583 B10R1.66 CC(=O)CNc1c[nH]cn1 be2bea778bbeba0f31cba71636f977f9 [0,0,0,0,1,0|1,0,0]=2 584 B10R1.66 CC(=O)CNc1c[nH]nn1 98e6305e8dcfefd87e76c7c44894a726 [0,0,0,0,1,0|2,0,0]=3 585 B10R1.66 CC(=O)CNc1ccco1 a59c8e4ff03257d947231d2e71f4d6c9 [0,0,0,0,1,0|3,0,0]=4 586 B10R1.66 CC(=O)CNc1cccs1 cd83157d86433e62c17b868e5fb1470c [0,0,0,0,1,0|3,0,0]=4 587 B10R1.66 CC(=O)CNc1ccoc1 f96f84316e97865366e82ff70b21a405 [0,0,0,0,1,0|3,0,0]=4 588 B10R1.66 CC(=O)CNc1ccsc1 264cfd5bd6905699df6036299a4d94ea [0,0,0,0,1,0|3,0,0]=4 589 B10R1.66 CC(=O)CNc1cncs1 08e34da9bd442eefd33450d52d14bc76 [0,0,0,0,1,0|2,0,1]=4 590 B10R1.66 CC(=O)CNc1cnsn1 772a2495fca3c8eabbdb48353588b2d6 [0,0,0,0,1,0|2,0,1]=4 591 B10R1.66 CC(=O)CNc1cscn1 482c21989e7459cf1cfac3954fb324f0 [0,0,0,0,1,0|2,0,0]=3 592 B10R1.66 CC(=O)CNc1nccs1 77a4f07613bba7bf49318b232ac5c431 [0,0,0,0,1,0|3,0,0]=4 593 B10R1.66 CC(=O)CNc1ncns1 2fec184f3d1bbec40161d26f8efc4473 [0,0,0,0,1,0|2,0,1]=4 594 B10R1.66 CC(=O)NCc1ccco1 88956646aad494b49b38617dc9c4b71b [0,0,0,0,1,0|2,0,0]=3 595 B10R1.66 CC(=O)NCc1cccs1 f628a56aae62b1b399cb045563e5a584 [0,0,0,0,1,0|2,0,0]=3 596 B10R1.66 CC(=O)NCc1ccno1 23171c461f7c76fb2a080276054f467a [0,0,0,0,1,0|2,0,1]=4 597 B10R1.66 CC(=O)NCc1ccns1 f18c0206268e4f0158791ee7d4b44adb [0,0,0,0,1,0|2,0,1]=4 598 B10R1.66 CC(=O)NCc1ccoc1 ce9871ea53622fcc38533d8f5672809d [0,0,0,0,1,0|2,0,0]=3 599 B10R1.66 CC(=O)NCc1ccon1 5c65e5956a6b69a35911040d15d7c19a [0,0,0,0,1,0|2,0,0]=3 600 B10R1.66 CC(=O)NCc1ccsc1 32c7f46af3edcc14e3d5f823406c656c [0,0,0,0,1,0|2,0,0]=3 601 B10R1.66 CC(=O)NCc1ccsn1 612816c731f283ec818c1ce3ed185f54 [0,0,0,0,1,0|2,0,0]=3 602 B10R1.66 CC(=O)NCc1cnco1 2f9cdc814f8776fe414302b1109682db [0,0,0,0,1,0|1,0,1]=3 603 B10R1.66 CC(=O)NCc1cncs1 ec5ecc8d905108c74de005c1c70641d3 [0,0,0,0,1,0|1,0,1]=3 604 B10R1.66 CC(=O)NCc1cnoc1 3a77bef0085ef939cf7657711c85b32d [0,0,0,0,1,0|2,0,1]=4 605 B10R1.66 CC(=O)NCc1cnsc1 5360a9f0ca8024aec48880c0ca08d867 [0,0,0,0,1,0|2,0,1]=4 606 B10R1.66 CC(=O)NCc1cocn1 8ce50f68f5fa07856aef854923c4aaad [0,0,0,0,1,0|1,0,0]=2 607 B10R1.66 CC(=O)NCc1cscn1 7bbb3e803cbe4292859eedd99dcc8b12 [0,0,0,0,1,0|1,0,0]=2 608 B10R1.66 CC(=O)NCc1ncco1 6519ae7ebb18199243fcd7f03af8a730 [0,0,0,0,1,0|2,0,0]=3 609 B10R1.66 CC(=O)NCc1nccs1 d681868309a7cd5cf6bf7a2c5c44b5ed [0,0,0,0,1,0|2,0,0]=3 610 B10R1.66 CC(C)COc1c[nH]cn1 5a6a70e59cd27d2b7c499cd9ff765ea7 [0,0,0,0,1,0|2,0,1]=4 611 B10R1.66 CC(C)NCc1c[nH]nn1 f35ceb1f6617dc1928630563699ec6c0 [0,0,0,0,1,0|2,0,1]=4 612 B10R1.66 CC(C)NCc1cc[nH]c1 cf294f8cbcc8fb18d9d4535f2cee2d84 [0,0,0,0,1,0|2,0,1]=4 613 B10R1.66 CC(C)NCc1cocn1 3e73ea0e671b05fed02b627457e2107c [0,0,0,0,1,0|2,0,1]=4 614 B10R1.66 CC(C)NCc1cscn1 fdb4d7fae55eaddf7fbeb89a356bd12f [0,0,0,0,1,0|2,0,1]=4 615 B10R1.66 CN(C)COc1c[nH]cn1 9ef8c23dc24aea0e999629fad2eb6acf [0,0,0,0,1,0|3,0,0]=4 616 B10R1.66 NC(=O)CNc1c[nH]cn1 49f3dce7c7daf9f8a40be1fbe24cd813 [0,0,0,0,1,0|2,0,0]=3 617 B10R1.66 NC(=O)CNc1c[nH]nn1 8fe91d6faf2a50eadec79d27475e9ed8 [0,0,0,0,1,0|3,0,0]=4 618 B10R1.66 NC(=O)CNc1cocn1 2685411193f495f19c3dcb122ff22cd2 [0,0,0,0,1,0|3,0,0]=4 619 B10R1.66 NC(=O)CNc1cscn1 69ae87ec27c5df6a6e1ae9a3c6120e24 [0,0,0,0,1,0|3,0,0]=4 620 B10R1.66 NC(=O)CNc1nc[nH]n1 0a9b733f95f6571a5b181cf8f4168b0c [0,0,0,0,1,0|3,0,0]=4 621 B10R1.66 NC(=O)COc1c[nH]cn1 c659a70f0960037fb1ab525386925538 [0,0,0,0,1,0|2,0,0]=3 622 B10R1.66 O=C(O)CNc1cocn1 a8c539d2b48144c59d381afebd90d7fe [0,0,0,0,1,0|3,0,0]=4 623 B10R1.66 O=C(O)CNc1cscn1 6412361c6df5c58a950b702f8eef61ac [0,0,0,0,1,0|3,0,0]=4 624 B10R1.66 O=C(O)CNc1nc[nH]n1 c1da874f0b865f5ce9169b4d3d57e5ab [0,0,0,0,1,0|3,0,0]=4 625 B10R1.66 O=C(O)COc1c[nH]cn1 ef84dd58bacee98312668113ab73c4d1 [0,0,0,0,1,0|2,0,0]=3 626 B10R1.66 O=[N+]([O-])COc1c[nH]cn1 750efdaac75656bc9e7254c54bd2aaa1 [0,0,0,0,1,0|3,0,0]=4 627 B12R1.252 CC(=O)CCNc1ccccn1 997919901794ee27201838f3f268a693 [0,0,0,0,0,1|3,0,0]=4 628 B12R1.252 CC(=O)CCNc1cccnc1 d55d133f13b833b5bf8507a979c71c53 [0,0,0,0,0,1|3,0,0]=4 629 B12R1.252 CC(=O)CCNc1cccnn1 32d799f5ae0f043ddfd98d242d6e2b83 [0,0,0,0,0,1|3,0,0]=4 630 B12R1.252 CC(=O)CCNc1ccncn1 0028a4c9e1e1e7e2cab45e31e5dcdf1c [0,0,0,0,0,1|2,0,1]=4 631 B12R1.252 CC(=O)CCNc1cnccn1 8194d0ad6d30ebb45605078893d0b86f [0,0,0,0,0,1|2,0,1]=4 632 B12R1.252 CC(=O)CCNc1cncnc1 7410d78cb0dba9b828d46217fb70a24b [0,0,0,0,0,1|2,0,1]=4 633 B12R1.252 CC(=O)CCNc1cnncn1 cdac78ed222661f6e2ea67a8ddb9d91f [0,0,0,0,0,1|2,0,1]=4 634 B12R1.252 CC(=O)CCNc1ncccn1 f9af544460838f47ce2dd0d8d6fb8e65 [0,0,0,0,0,1|3,0,0]=4 635 B12R1.252 CC(=O)CCNc1ncncn1 2c92a1e4340e278f38f2e8cc12ec8a52 [0,0,0,0,0,1|2,0,1]=4 636 B12R1.252 CC(=O)CCOc1ccccn1 f0d6b589e7af691479be38abbd6bcdf3 [0,0,0,0,0,1|3,0,0]=4 637 B12R1.252 CC(=O)CCOc1cccnc1 67dae2709723517ab5af883d0837054b [0,0,0,0,0,1|3,0,0]=4 638 B12R1.252 CC(=O)CCOc1cnccn1 470130b5fcbc6995e03cec6409a7e88f [0,0,0,0,0,1|2,0,1]=4 639 B12R1.252 CC(=O)CCOc1cncnc1 099e9e708e8f8e782761fe111edeb6fe [0,0,0,0,0,1|2,0,1]=4 640 B12R1.252 CC(=O)CCOc1ncccn1 cb317663dda387ed6c769a3c84b9ec4a [0,0,0,0,0,1|3,0,0]=4 641 B12R1.252 CC(=O)CNCc1ccccn1 6857f6976c347e411d9abdd48f8982fb [0,0,0,0,0,1|3,0,0]=4 642 B12R1.252 CC(=O)CNCc1cccnc1 39d89333d7252b4434a1fdfd17a4d718 [0,0,0,0,0,1|3,0,0]=4 643 B12R1.252 CC(=O)CNCc1cccnn1 69a4573b28e6734fdd6ea189d6e37041 [0,0,0,0,0,1|3,0,0]=4 644 B12R1.252 CC(=O)CNCc1ccncn1 9280fb5fc212f0e227894d5f435d42d3 [0,0,0,0,0,1|2,0,1]=4 645 B12R1.252 CC(=O)CNCc1cncnc1 70d5a2ac2ac7c6f411b67827ce57726d [0,0,0,0,0,1|2,0,1]=4 646 B12R1.252 CC(=O)CNCc1ncccn1 ebcbf993e63f54e2a531cc36cbf3d20b [0,0,0,0,0,1|3,0,0]=4 647 B12R1.252 CC(=O)COCc1ccccn1 f8ed3ffb815bee7f1737eacfe042d64f [0,0,0,0,0,1|3,0,0]=4 648 B12R1.252 CC(=O)COCc1cccnc1 36638c01e0a61511be9d007508b97b48 [0,0,0,0,0,1|3,0,0]=4 649 B12R1.252 CC(=O)COCc1cccnn1 e5ce14b0f3485754a3b54e412cf985cc [0,0,0,0,0,1|3,0,0]=4 650 B12R1.252 CC(=O)COCc1ccncn1 0d85e9f224c2952d6d7e3faef841c4cd [0,0,0,0,0,1|2,0,1]=4 651 B12R1.252 CC(=O)COCc1cncnc1 a6210dfea47295d579916cba8a09c6f7 [0,0,0,0,0,1|2,0,1]=4 652 B12R1.252 CC(=O)COCc1ncccn1 b330e3f5176d6d50393a8f323d76eb16 [0,0,0,0,0,1|3,0,0]=4 653 B12R1.252 CC(=O)NCCC1=CCCCC1 35fff8557826429185cf35ce14a639e0 [0,0,0,0,0,1|2,0,1]=4 654 B12R1.252 CC(=O)NCCc1ccccc1 1052e9521fedb3e85cab4ef571c55982 [0,0,0,0,0,1|2,0,0]=3 655 B12R1.252 CC(=O)NCCc1ccccn1 3ad8e2876430ef8ccd3cbeba8ed6119f [0,0,0,0,0,1|1,0,0]=2 656 B12R1.252 CC(=O)NCCc1cccnc1 3962e9654ba13e9ef1bdd3c037e7deff [0,0,0,0,0,1|1,0,0]=2 657 B12R1.252 CC(=O)NCCc1ccncc1 56311f224412b2ab7d4e3e56f79fd239 [0,0,0,0,0,1|1,0,1]=3 658 B12R1.252 CC(=O)NCCc1ccncn1 fab966eb0085b8e36cdf3d0657da7143 [0,0,0,0,0,1|0,0,1]=2 659 B12R1.252 CC(=O)NCCc1cnccn1 1cf21aa316ea8133ba87ed31740cb5a0 [0,0,0,0,0,1|0,0,1]=2 660 B12R1.252 CC(=O)NCCc1ncccn1 6cea7b81fd8f7f4399691623e3b09425 [0,0,0,0,0,1|1,0,0]=2 661 B12R1.252 CC(=O)OCNc1ccccn1 a41f1b71ededa97eb4355e9af8654026 [0,0,0,0,0,1|3,0,0]=4 662 B12R1.252 CC(=O)OCNc1cccnc1 4178bffb832b0edcfc9121cf9bba84c2 [0,0,0,0,0,1|3,0,0]=4 663 B12R1.252 CC(=O)OCNc1cccnn1 8c98d445e1e0cc487041b61de0ea911c [0,0,0,0,0,1|3,0,0]=4 664 B12R1.252 CC(=O)OCNc1ccncn1 bf20837dfac7b7bae382ad769a09b6f4 [0,0,0,0,0,1|2,0,1]=4 665 B12R1.252 CC(=O)OCNc1cnccn1 bdb0ee3fc5470597e07f96ab12fbc213 [0,0,0,0,0,1|2,0,1]=4 666 B12R1.252 CC(=O)OCNc1cncnc1 5b068758d6a2798d700ddb1e206b71e0 [0,0,0,0,0,1|2,0,1]=4 667 B12R1.252 CC(=O)OCNc1cnncn1 f9db9f32f8b2a609254498098eeb8926 [0,0,0,0,0,1|2,0,1]=4 668 B12R1.252 CC(=O)OCNc1ncccn1 906e0b59248f23fb7691c6448550e547 [0,0,0,0,0,1|3,0,0]=4 669 B12R1.252 CC(=O)OCNc1ncncn1 c45f6872cc6e114671f1550779edc2fe [0,0,0,0,0,1|2,0,1]=4 670 B12R1.252 CC(=O)OCOc1ccccn1 86abcd8d807149e2e6ef73302de6ba90 [0,0,0,0,0,1|3,0,0]=4 671 B12R1.252 CC(=O)OCOc1cccnc1 276102d131e97a552c86e2e9163e6724 [0,0,0,0,0,1|3,0,0]=4 672 B12R1.252 CC(=O)OCOc1cnccn1 7137929c8a41977d22d81b105aca6c2e [0,0,0,0,0,1|2,0,1]=4 673 B12R1.252 CC(=O)OCOc1cncnc1 92f7ed10cc4158ac96eb4ae613a62a52 [0,0,0,0,0,1|2,0,1]=4 674 B12R1.252 CC(=O)OCOc1cncnn1 2aa92de76010fb2c4e90973261dcfb0b [0,0,0,0,0,1|2,0,1]=4 675 B12R1.252 CC(=O)OCOc1ncccn1 8b175a52d1a3c6c8bd19153f2e2293d7 [0,0,0,0,0,1|3,0,0]=4 676 B12R1.252 CC(C)NCCc1ccccn1 60db3ccccaed87369474311fbbb2ee61 [0,0,0,0,0,1|2,0,1]=4 677 B12R1.252 CC(C)NCCc1cccnc1 f39609cf740b878733069b3389a379d4 [0,0,0,0,0,1|2,0,1]=4 678 B12R1.252 CC(C)NCCc1ccncn1 f7502abf563207bb5d53cb2d326dbabf [0,0,0,0,0,1|1,0,2]=4 679 B12R1.252 CC(C)NCCc1cnccn1 35c3b70c1897dffd7b3a32c2343123fc [0,0,0,0,0,1|1,0,2]=4 680 B12R1.252 CC(C)NCCc1ncccn1 794cc03a494745a4fc8f3acdee35c851 [0,0,0,0,0,1|2,0,1]=4 681 B12R1.255 C/C(=C/CNCc1c[nH]nn1)/I ea7109b4308b4537c183456f611f94fa [0,0,0,0,0,1|3,0,0]=4 682 B12R1.255 C/C(=C/CNCc1cc[nH]c1)/I 4a131b4048aab94cf23943f9ea51490d [0,0,0,0,0,1|3,0,0]=4 683 B12R1.255 C/C(=C/CNCc1cocn1)/I 7f41fce78bfff97b6dd6cd21e638d8b7 [0,0,0,0,0,1|3,0,0]=4 684 B12R1.255 C/C(=C/CNCc1cscn1)/I 97c2b06ce9cf61d8c06967db0a143f25 [0,0,0,0,0,1|3,0,0]=4 685 B12R1.255 C/C(=C/COCc1cc[nH]c1)/I 255f6ddcb368cc65f26a578e04884562 [0,0,0,0,0,1|3,0,0]=4 686 B12R1.255 C/C(=C/COCc1cocn1)/Cl 078e5d9714e4c02ce0cc75eacd0a996e [0,0,0,0,0,1|3,0,0]=4 687 B12R1.255 C/C(=C/COCc1cocn1)/I e9042af809d83b5b257069c4fc023827 [0,0,0,0,0,1|3,0,0]=4 688 B12R1.255 C/C(=C/COCc1cscn1)/Cl 3d5a081d638d9a3a1fec8d9cb8f49774 [0,0,0,0,0,1|3,0,0]=4 689 B12R1.255 C/C(=C/COCc1cscn1)/I 48b417cecf5b32a6beeea1b3dd944617 [0,0,0,0,0,1|3,0,0]=4 690 B12R1.255 C/C(=C/COCc1nc[nH]n1)/Cl 056c39913ab5b0ceb04ba1c35b306e70 [0,0,0,0,0,1|3,0,0]=4 691 B12R1.255 C/C(=C/COCc1nc[nH]n1)/I dad1e438a01e1003f453e78f0960ff66 [0,0,0,0,0,1|3,0,0]=4 692 B12R1.255 C/C(=C\CNCc1c[nH]nn1)/Cl 2b8923f5133a23beb75baefc65712988 [0,0,0,0,0,1|3,0,0]=4 693 B12R1.255 C/C(=C\CNCc1cc[nH]c1)/Cl ae3de2d9e2f98f7ec722bcb4184d2529 [0,0,0,0,0,1|3,0,0]=4 694 B12R1.255 C/C(=C\CNCc1cocn1)/Cl 568eb56b14e82c81f0b600dd6ab77efb [0,0,0,0,0,1|3,0,0]=4 695 B12R1.255 C/C(=C\CNCc1cscn1)/Cl 1759ce4bf9a7644b7e8e2f46d1dd57b9 [0,0,0,0,0,1|3,0,0]=4 696 B12R1.255 C/C(=C\COCc1cc[nH]c1)/Cl 3e8a2a3e18218553260106d37339f17d [0,0,0,0,0,1|3,0,0]=4 697 B12R1.255 C/C(=C\COCc1cocn1)/Cl d538fe1c9442085d5370449d9b390bf5 [0,0,0,0,0,1|3,0,0]=4 698 B12R1.255 C/C(=C\COCc1cscn1)/Cl ddfe192f030a5b597f7fff523c5c904b [0,0,0,0,0,1|3,0,0]=4 699 B12R1.255 C/C(=C\COCc1nc[nH]n1)/Cl 8e5b452e592cd24cf7685970a72045ee [0,0,0,0,0,1|3,0,0]=4 700 B12R1.255 C=C(Br)CNCCc1c[nH]cn1 336892bb238ea31a85bd1849e855c9e9 [0,0,0,0,0,1|1,0,1]=3 701 B12R1.255 C=C(Br)CNCCc1cscn1 cc4a61edaafc48a100fadf6f71169078 [0,0,0,0,0,1|2,0,1]=4 702 B12R1.255 C=C(Br)COCCc1c[nH]cn1 c41dd2f817aadc22d7582625c4459136 [0,0,0,0,0,1|2,0,1]=4 703 B12R1.255 C=C(C)CCCNc1cocn1 5f7b71af8e04d0d0b5bee654579bdae7 [0,0,0,0,0,1|3,0,0]=4 704 B12R1.255 C=C(C)CCCNc1cscn1 81743b34f0db119d47f0324817dba9c0 [0,0,0,0,0,1|3,0,0]=4 705 B12R1.255 C=C(C)CCCNc1nc[nH]n1 237657b09019b75219132adb9714c88a [0,0,0,0,0,1|3,0,0]=4 706 B12R1.255 C=C(C)CCCOc1c[nH]cn1 39d771f31f47dda4b4a9bcd8ece5dace [0,0,0,0,0,1|2,0,0]=3 707 B12R1.255 C=C(C)CCNCc1c[nH]nn1 65bd2ceb8d7a167419882089b1eaa200 [0,0,0,0,0,1|3,0,0]=4 708 B12R1.255 C=C(C)CCNCc1cc[nH]c1 51dfef06d77a637e7c7d5b63f66cace1 [0,0,0,0,0,1|3,0,0]=4 709 B12R1.255 C=C(C)CCNCc1cocn1 03434ab3b87648640bb9022a488e678c [0,0,0,0,0,1|3,0,0]=4 710 B12R1.255 C=C(C)CCNCc1cscn1 0061dab67f6f19788e4ddeecfdf2f21d [0,0,0,0,0,1|3,0,0]=4 711 B12R1.255 C=C(C)CCOCc1cc[nH]c1 3a14c96e7f1a982259b75b5ebf5dea26 [0,0,0,0,0,1|3,0,0]=4 712 B12R1.255 C=C(C)CCOCc1cocn1 79fc55c79489fc368fa6c7d014e928fb [0,0,0,0,0,1|3,0,0]=4 713 B12R1.255 C=C(C)CCOCc1cscn1 fc6c1b263c8dadf9ffdaf9b3c155977d [0,0,0,0,0,1|3,0,0]=4 714 B12R1.255 C=C(C)CCOCc1nc[nH]n1 d2eb980840543da2ecc7fe1d9f59a4ac [0,0,0,0,0,1|3,0,0]=4 715 B12R1.255 C=C(C)CNCCc1c[nH]cn1 64f9cd29106016499590b566dd205806 [0,0,0,0,0,1|1,0,0]=2 716 B12R1.255 C=C(C)CNCCc1cc[nH]n1 20f291b542d99553e765cb9e01e9c622 [0,0,0,0,0,1|3,0,0]=4 717 B12R1.255 C=C(C)CNCCc1ccc[nH]1 d7ed3051e5b6f45e2cd3dfab3595fb5c [0,0,0,0,0,1|2,0,1]=4 718 B12R1.255 C=C(C)CNCCc1ccco1 e71ed1eb849ed6ebe64b9b0571b3c248 [0,0,0,0,0,1|3,0,0]=4 719 B12R1.255 C=C(C)CNCCc1cccs1 ed46a9cf9921c92198af1ba913954c4a [0,0,0,0,0,1|3,0,0]=4 720 B12R1.255 C=C(C)CNCCc1ccsc1 87e8a4c6296e16431336b5c8a2ebbe97 [0,0,0,0,0,1|3,0,0]=4 721 B12R1.255 C=C(C)CNCCc1cn[nH]c1 8f46076128d452c62248f5cc42d65955 [0,0,0,0,0,1|3,0,0]=4 722 B12R1.255 C=C(C)CNCCc1cscn1 45750698d326677c8768c34d3a83376f [0,0,0,0,0,1|2,0,0]=3 723 B12R1.255 C=C(C)CNCCc1ncc[nH]1 a00c42fd0208bd694ec0b8d4604b4c98 [0,0,0,0,0,1|3,0,0]=4 724 B12R1.255 C=C(C)CNCCc1nccs1 4cc08d9113037721529f7a958da5ea40 [0,0,0,0,0,1|3,0,0]=4 725 B12R1.255 C=C(C)CNCCc1ncon1 0d0a1bd40c1a792020f9779c59322ae0 [0,0,0,0,0,1|3,0,0]=4 726 B12R1.255 C=C(C)CNCCn1cccn1 093d68ce01972cfca30d62da55275f47 [0,0,0,0,0,1|3,0,0]=4 727 B12R1.255 C=C(C)CNCCn1cncn1 f3536676910bc03f197ea65afcb62101 [0,0,0,0,0,1|2,0,1]=4 728 B12R1.255 C=C(C)COCCc1c[nH]cn1 6ced897aa37f94fe99a44d4fd01b263d [0,0,0,0,0,1|2,0,0]=3 729 B12R1.255 C=C(C)COCCc1cscn1 2cc73e2d3df5f0fb13985e89faf43a11 [0,0,0,0,0,1|3,0,0]=4 730 B12R1.255 C=C(Cl)CNCCc1c[nH]cn1 11311d20d1df8733a1862b6c6752fe73 [0,0,0,0,0,1|1,0,1]=3 731 B12R1.255 C=C(Cl)CNCCc1cscn1 ba09d8618056cc588cb6caffd3c1bee3 [0,0,0,0,0,1|2,0,1]=4 732 B12R1.255 C=C(Cl)COCCc1c[nH]cn1 53746bfdf87c9c26b47c458db09785b7 [0,0,0,0,0,1|2,0,1]=4 733 B12R1.255 C=C(F)CNCCc1c[nH]cn1 1bb5dce62207be49bfed2d4c96e8f156 [0,0,0,0,0,1|1,0,1]=3 734 B12R1.255 C=C(F)CNCCc1cscn1 24824a6d296d0d599119961eedea822e [0,0,0,0,0,1|2,0,1]=4 735 B12R1.255 C=C(F)COCCc1c[nH]cn1 205667330ee40b8374a1af139e88baec [0,0,0,0,0,1|2,0,1]=4 736 B12R1.255 C=C(I)COCCc1c[nH]cn1 88b7b48a184a97440b02227f603532d4 [0,0,0,0,0,1|2,0,1]=4 737 B12R1.255 CC(=CCCNc1cocn1)C 673d20f90ca7a31454be0bcf2bf528af [0,0,0,0,0,1|3,0,0]=4 738 B12R1.255 CC(=CCCNc1cscn1)C c2491d264d39231f5a2fe172dcef666f [0,0,0,0,0,1|3,0,0]=4 739 B12R1.255 CC(=CCCNc1nc[nH]n1)C 645974d1453f38b6d84c075cd887c0e2 [0,0,0,0,0,1|3,0,0]=4 740 B12R1.255 CC(=CCCOc1c[nH]cn1)C 10effd7998d8ac3ca3ee40791e603207 [0,0,0,0,0,1|2,0,0]=3 741 B12R1.255 CC(=CCNCc1c[nH]nn1)C 3ecb1c6098996b1ff45762ff7dfcc2a0 [0,0,0,0,0,1|3,0,0]=4 742 B12R1.255 CC(=CCNCc1c[nH]nn1)Cl f711ec077f544c396f1911fdf355248a [0,0,0,0,0,1|3,0,0]=4 743 B12R1.255 CC(=CCNCc1c[nH]nn1)I 80f2024f6578a9efe3e5fa8f6bbdd8b6 [0,0,0,0,0,1|3,0,0]=4 744 B12R1.255 CC(=CCNCc1cc[nH]c1)C 558f9b79141310e38f35bf4288341689 [0,0,0,0,0,1|3,0,0]=4 745 B12R1.255 CC(=CCNCc1cc[nH]c1)Cl dbe7af1146dada16dded76da59eacb32 [0,0,0,0,0,1|3,0,0]=4 746 B12R1.255 CC(=CCNCc1cc[nH]c1)I 937d372b7e58849eeaf74af212bb24cd [0,0,0,0,0,1|3,0,0]=4 747 B12R1.255 CC(=CCNCc1cocn1)C 3a21953d3039a2ebc967b343075e7840 [0,0,0,0,0,1|3,0,0]=4 748 B12R1.255 CC(=CCNCc1cocn1)Cl 430268c5d427620d66a02f1287eb2d16 [0,0,0,0,0,1|3,0,0]=4 749 B12R1.255 CC(=CCNCc1cocn1)I a3757e12db1a82ea9e1fff0233b4c535 [0,0,0,0,0,1|3,0,0]=4 750 B12R1.255 CC(=CCNCc1cscn1)C 0b48360b8114a5e0e269db2715ef78fc [0,0,0,0,0,1|3,0,0]=4 751 B12R1.255 CC(=CCNCc1cscn1)Cl 0002e642208879a3712124419efe0249 [0,0,0,0,0,1|3,0,0]=4 752 B12R1.255 CC(=CCNCc1cscn1)I 878cda14c558b6daa356d33cb4dd62db [0,0,0,0,0,1|3,0,0]=4 753 B12R1.255 CC(=CCOCc1cc[nH]c1)C 3fcca0ae210bf69584e1b719d479fca4 [0,0,0,0,0,1|3,0,0]=4 754 B12R1.255 CC(=CCOCc1cc[nH]c1)Cl 3fd81b9c3ef6829d28c43d80b4bf0dda [0,0,0,0,0,1|3,0,0]=4 755 B12R1.255 CC(=CCOCc1cc[nH]c1)I 1757516baedf6b2f8e306d2d6af1b03f [0,0,0,0,0,1|3,0,0]=4 756 B12R1.255 CC(=CCOCc1cocn1)C 33491e4f40d5dc84ad89a4810d15d06f [0,0,0,0,0,1|3,0,0]=4 757 B12R1.255 CC(=CCOCc1cocn1)Cl 94ff765d83740de726bce7bb940bdb1a [0,0,0,0,0,1|3,0,0]=4 758 B12R1.255 CC(=CCOCc1cocn1)I 12b9214c3e7010d7f6e505869fe2fb19 [0,0,0,0,0,1|3,0,0]=4 759 B12R1.255 CC(=CCOCc1cscn1)C cd0bfc5ba96afe2d52253c4e932d37b4 [0,0,0,0,0,1|3,0,0]=4 760 B12R1.255 CC(=CCOCc1cscn1)Cl 8eaa5ea905387575c3155e2b1c7f3c0c [0,0,0,0,0,1|3,0,0]=4 761 B12R1.255 CC(=CCOCc1cscn1)I ebdf1188027b8437fc031097980c7207 [0,0,0,0,0,1|3,0,0]=4 762 B12R1.255 CC(=CCOCc1nc[nH]n1)C 58faf5bdcc1edefb79ee53cd3d4795f1 [0,0,0,0,0,1|3,0,0]=4 763 B12R1.255 CC(=CCOCc1nc[nH]n1)Cl f4c23763af445bf37898fdd06ad8a553 [0,0,0,0,0,1|3,0,0]=4 764 B12R1.255 CC(=CCOCc1nc[nH]n1)I f6d1ac7540d4297077690fc7c0e4720c [0,0,0,0,0,1|3,0,0]=4 765 B12R1.255 CC(=O)CCCNc1cc[nH]n1 123f3795b8c951cefe2271b34825a951 [0,0,0,0,0,1|3,0,0]=4 766 B12R1.255 CC(=O)CCCNc1cccs1 3533038623349dc11f21a8b98ed58548 [0,0,0,0,0,1|3,0,0]=4 767 B12R1.255 CC(=O)CCCNc1ccon1 468c95521732e1217d382ae288053064 [0,0,0,0,0,1|3,0,0]=4 768 B12R1.255 CC(=O)CCCNc1ccsc1 bbf1a951b4ec091462ba52e3c4fbd18f [0,0,0,0,0,1|3,0,0]=4 769 B12R1.255 CC(=O)CCCNc1cn[nH]c1 e85315964eabbea4163d2ad37064aecc [0,0,0,0,0,1|3,0,0]=4 770 B12R1.255 CC(=O)CCCNc1cncs1 32cd8b27395c5e8c5639cd2e4e80a4bd [0,0,0,0,0,1|2,0,1]=4 771 B12R1.255 CC(=O)CCCNc1cnon1 f9e1ed10cbd5d018ef617039362cc035 [0,0,0,0,0,1|2,0,1]=4 772 B12R1.255 CC(=O)CCCNc1cocn1 f7bedc09f7cc16115fae2e9a1143a09f [0,0,0,0,0,1|2,0,0]=3 773 B12R1.255 CC(=O)CCCNc1cscn1 9814682e27c13dfbbe2ffd9908e547b6 [0,0,0,0,0,1|2,0,0]=3 774 B12R1.255 CC(=O)CCCNc1nc[nH]n1 e5ad3297d9b5f4adf043e9b125f018bc [0,0,0,0,0,1|2,0,0]=3 775 B12R1.255 CC(=O)CCCNc1ncc[nH]1 c6c442ad5eac5a303f33135ef7dd7643 [0,0,0,0,0,1|3,0,0]=4 776 B12R1.255 CC(=O)CCCNc1ncco1 140205b69a990a5c669394310fb9d71c [0,0,0,0,0,1|3,0,0]=4 777 B12R1.255 CC(=O)CCCNc1nccs1 2d89a0ea4d314c16ea02f911a78b3ae4 [0,0,0,0,0,1|3,0,0]=4 778 B12R1.255 CC(=O)CCCNc1ncns1 1f77f705d1cb311779c063125fa09900 [0,0,0,0,0,1|2,0,1]=4 779 B12R1.255 CC(=O)CCCNc1ncon1 7790b446883543813d0627f1a2c578f2 [0,0,0,0,0,1|3,0,0]=4 780 B12R1.255 CC(=O)CCCNc1ncsn1 2d791010e748a797dd160f004c20a987 [0,0,0,0,0,1|3,0,0]=4 781 B12R1.255 CC(=O)CCCNc1nn[nH]n1 b2b57d502b00aa37583d2164bf2e8377 [0,0,0,0,0,1|3,0,0]=4 782 B12R1.255 CC(=O)CCCOc1c[nH]cn1 3969219ba7965394a0aa099f9e542684 [0,0,0,0,0,1|1,0,0]=2 783 B12R1.255 CC(=O)CCCOc1ccco1 f00e61f445dc6ee381836d29a67abaed [0,0,0,0,0,1|3,0,0]=4 784 B12R1.255 CC(=O)CCCOc1cccs1 fdbe6c6ac6d7cc74ad5226a55e50b681 [0,0,0,0,0,1|3,0,0]=4 785 B12R1.255 CC(=O)CCCOc1ccsc1 02b7a836d279ff6c2c9d7b0b844b26c5 [0,0,0,0,0,1|3,0,0]=4 786 B12R1.255 CC(=O)CCCOc1cn[nH]c1 cdf76a2a53d776999189f2fa3656a7f4 [0,0,0,0,0,1|3,0,0]=4 787 B12R1.255 CC(=O)CCCOc1cnsn1 a07dfabd6b74ad38dc843bc406b13c90 [0,0,0,0,0,1|2,0,1]=4 788 B12R1.255 CC(=O)CCCOc1nccs1 d2b472626114f40c2e63d78b5c96eb2a [0,0,0,0,0,1|3,0,0]=4 789 B12R1.255 CC(=O)CCCOn1cccn1 31057599bc85a621c2a3fbf58fa36b4d [0,0,0,0,0,1|3,0,0]=4 790 B12R1.255 CC(=O)CCNCc1c[nH]nn1 25fbb90d20415b45b5f19644f88e407a [0,0,0,0,0,1|2,0,0]=3 791 B12R1.255 CC(=O)CCNCc1cc[nH]c1 9249388620b1b6d0dbefbb358be60826 [0,0,0,0,0,1|2,0,0]=3 792 B12R1.255 CC(=O)CCNCc1ccc[nH]1 9b5627f8ee979e3cb705edcf1121d22b [0,0,0,0,0,1|2,0,1]=4 793 B12R1.255 CC(=O)CCNCc1ccco1 88fb4b8d3b60021a60c70d858800ba28 [0,0,0,0,0,1|3,0,0]=4 794 B12R1.255 CC(=O)CCNCc1cccs1 434fcc6d3b3186d12b3fd048a811c33a [0,0,0,0,0,1|3,0,0]=4 795 B12R1.255 CC(=O)CCNCc1ccoc1 71cf3069cb20d5e00d6a4b5e2aaffd4b [0,0,0,0,0,1|3,0,0]=4 796 B12R1.255 CC(=O)CCNCc1ccon1 d66faa87052fc21523659317c616b2e5 [0,0,0,0,0,1|3,0,0]=4 797 B12R1.255 CC(=O)CCNCc1ccsc1 b9ebd0a9538f3be3a9273e3a7d53911b [0,0,0,0,0,1|3,0,0]=4 798 B12R1.255 CC(=O)CCNCc1ccsn1 c5f0cce6afb9bae4fe3a983b63472b9d [0,0,0,0,0,1|3,0,0]=4 799 B12R1.255 CC(=O)CCNCc1cn[nH]c1 3a2a5bafcdea480c45d080c277893f0b [0,0,0,0,0,1|3,0,0]=4 800 B12R1.255 CC(=O)CCNCc1cnco1 92a9a7e0777b7bee0d224228f33b19d0 [0,0,0,0,0,1|2,0,1]=4 801 B12R1.255 CC(=O)CCNCc1cncs1 856d83c0ca0d01226c7ae56fab131e1b [0,0,0,0,0,1|2,0,1]=4 802 B12R1.255 CC(=O)CCNCc1cocn1 c56ed8ec00812f09c6d3852f16aeb827 [0,0,0,0,0,1|2,0,0]=3 803 B12R1.255 CC(=O)CCNCc1cscn1 60010674615b526ce217d39cdb632049 [0,0,0,0,0,1|2,0,0]=3 804 B12R1.255 CC(=O)CCNCc1ncc[nH]1 76f7532c497d14f0a8a5ff5dc9685512 [0,0,0,0,0,1|3,0,0]=4 805 B12R1.255 CC(=O)CCNCc1ncco1 bc4fc3302009666aacf55aa22ad007fb [0,0,0,0,0,1|3,0,0]=4 806 B12R1.255 CC(=O)CCNCc1nccs1 530dd6345ee685ecc0bbda2254cd67ed [0,0,0,0,0,1|3,0,0]=4 807 B12R1.255 CC(=O)CCNCc1ncn[nH]1 618355b46586d03f0564f7e536c42c17 [0,0,0,0,0,1|2,0,1]=4 808 B12R1.255 CC(=O)CCOCc1cc[nH]c1 f04073e125d614033bab1399c36f9df6 [0,0,0,0,0,1|2,0,0]=3 809 B12R1.255 CC(=O)CCOCc1ccc[nH]1 7c081328c3e3b08c6b1076a30ffe4717 [0,0,0,0,0,1|2,0,1]=4 810 B12R1.255 CC(=O)CCOCc1ccco1 8c882a70fc6ceb65186f83d1f22dd2e7 [0,0,0,0,0,1|3,0,0]=4 811 B12R1.255 CC(=O)CCOCc1cccs1 f16401d6798282ad4782e7afe706d353 [0,0,0,0,0,1|3,0,0]=4 812 B12R1.255 CC(=O)CCOCc1ccon1 0dc387c1bf7dfbd801e95be24ca6bb8e [0,0,0,0,0,1|3,0,0]=4 813 B12R1.255 CC(=O)CCOCc1ccsc1 1fd82edcecefe8ebb4695e8fcbb37c1b [0,0,0,0,0,1|3,0,0]=4 814 B12R1.255 CC(=O)CCOCc1ccsn1 d229f3ee6b3cfc9d5096b90e6c2ce49e [0,0,0,0,0,1|3,0,0]=4 815 B12R1.255 CC(=O)CCOCc1cn[nH]c1 c4292ed73a893f15f246c47e99eaec43 [0,0,0,0,0,1|3,0,0]=4 816 B12R1.255 CC(=O)CCOCc1cnc[nH]1 4a9deafd9e4444915abff7a625273e76 [0,0,0,0,0,1|1,0,2]=4 817 B12R1.255 CC(=O)CCOCc1cnco1 f8b19a4ebfa304050e17334f691dcc5a [0,0,0,0,0,1|2,0,1]=4 818 B12R1.255 CC(=O)CCOCc1cncs1 4789db9d2571d10f5a7e7b538fb7bd33 [0,0,0,0,0,1|2,0,1]=4 819 B12R1.255 CC(=O)CCOCc1cnsn1 b1116d346c6df4f8499ba93ea53b3915 [0,0,0,0,0,1|2,0,1]=4 820 B12R1.255 CC(=O)CCOCc1cocn1 1622482a6e31cab11085fbbab0455e7a [0,0,0,0,0,1|2,0,0]=3 821 B12R1.255 CC(=O)CCOCc1cscn1 8edd21b293c2d0cb4750360b85f594e0 [0,0,0,0,0,1|2,0,0]=3 822 B12R1.255 CC(=O)CCOCc1csnn1 2bac3b019b8f882f82f1423f2c7dd5bb [0,0,0,0,0,1|3,0,0]=4 823 B12R1.255 CC(=O)CCOCc1nc[nH]n1 e20aa029ab4d3fdafc6a796e05b06e93 [0,0,0,0,0,1|2,0,0]=3 824 B12R1.255 CC(=O)CCOCc1ncc[nH]1 c7f59610045088221dd08d7d00227bb8 [0,0,0,0,0,1|3,0,0]=4 825 B12R1.255 CC(=O)CCOCc1ncco1 8a3958338e4d53bac1c6546aaeee1dbf [0,0,0,0,0,1|3,0,0]=4 826 B12R1.255 CC(=O)CCOCc1nccs1 5b2a8c0e5d4e062d8248cea8ae2eee21 [0,0,0,0,0,1|3,0,0]=4 827 B12R1.255 CC(=O)CCOCc1ncno1 728276fdb82d205bc76200ea9f471a04 [0,0,0,0,0,1|2,0,1]=4 828 B12R1.255 CC(=O)CCOCc1ncns1 5277fb0c595afe32e915a16955456f52 [0,0,0,0,0,1|2,0,1]=4 829 B12R1.255 CC(=O)CCOCc1ncon1 c7110439c743c36381a8e23a76c47408 [0,0,0,0,0,1|3,0,0]=4 830 B12R1.255 CC(=O)CCOCc1nn[nH]n1 ee3a1307631c3ac03b9f343ba7aeaacb [0,0,0,0,0,1|3,0,0]=4 831 B12R1.255 CC(=O)CCOCn1cccn1 6e7981d297c3277015f7b818e7fd0363 [0,0,0,0,0,1|3,0,0]=4 832 B12R1.255 CC(=O)CCOCn1cncn1 d3e088a87c4cba4484a699843a01b817 [0,0,0,0,0,1|2,0,1]=4 833 B12R1.255 CC(=O)CNCCc1c[nH]cn1 9acb2afbd3f37ca8adfc0440d8578f3a [0,0,0,0,0,1|0,0,0]=1 834 B12R1.255 CC(=O)CNCCc1cccs1 28b073b661eeda62f9d1e15484e88d1d [0,0,0,0,0,1|2,0,0]=3 835 B12R1.255 CC(=O)CNCCc1ccn[nH]1 cd35b48e43ea281f529165f120c98918 [0,0,0,0,0,1|2,0,1]=4 836 B12R1.255 CC(=O)CNCCc1ccsc1 b1dcd57bc2f086c83088097245274d49 [0,0,0,0,0,1|2,0,0]=3 837 B12R1.255 CC(=O)CNCCc1cn[nH]c1 adbab7a914d45db34615b1e983e233df [0,0,0,0,0,1|2,0,0]=3 838 B12R1.255 CC(=O)CNCCc1cscn1 5a6063bd6f23dfccaead29520e75df70 [0,0,0,0,0,1|1,0,0]=2 839 B12R1.255 CC(=O)CNCCc1ncon1 35b54eff9256acfeb915cd6cfdacfa60 [0,0,0,0,0,1|2,0,0]=3 840 B12R1.255 CC(=O)CNCCn1cccc1 dd44851f67accea6ed66b3b964d713bd [0,0,0,0,0,1|3,0,0]=4 841 B12R1.255 CC(=O)CNCCn1cccn1 067ac7fbff7b9bdae180218d1bb69333 [0,0,0,0,0,1|2,0,0]=3 842 B12R1.255 CC(=O)CNCCn1ccnc1 343d699a29fea6e7f483601be4976a98 [0,0,0,0,0,1|2,0,1]=4 843 B12R1.255 CC(=O)CNCCn1cncn1 4d62ddeb97209f401cda41f998a8a7ef [0,0,0,0,0,1|1,0,1]=3 844 B12R1.255 CC(=O)CNCCn1nccn1 f2f74017cf0f1b94d7272842cdb41956 [0,0,0,0,0,1|3,0,0]=4 845 B12R1.255 CC(=O)COCCc1c[nH]cn1 0a56221cbbdf6c49090c154287c279c1 [0,0,0,0,0,1|1,0,0]=2 846 B12R1.255 CC(=O)COCCc1cccs1 1429fcea1ed51e0c2471b3e0c0959bfd [0,0,0,0,0,1|3,0,0]=4 847 B12R1.255 CC(=O)COCCc1ccsc1 3824e425c43dcede0504c2629ef9084e [0,0,0,0,0,1|3,0,0]=4 848 B12R1.255 CC(=O)COCCc1cn[nH]c1 0d9e17251079a002658c44586b1af05a [0,0,0,0,0,1|3,0,0]=4 849 B12R1.255 CC(=O)COCCc1cscn1 b9a3e9df1321a07945d98942e39898b6 [0,0,0,0,0,1|2,0,0]=3 850 B12R1.255 CC(=O)COCCc1ncon1 03a1ea9a322fcaf987182027e11e73eb [0,0,0,0,0,1|3,0,0]=4 851 B12R1.255 CC(=O)COCCn1cccn1 c44d11b7c06afdaea28682c6ebe8e7f9 [0,0,0,0,0,1|3,0,0]=4 852 B12R1.255 CC(=O)COCCn1cncn1 cae6bef3fa69b7429793ac24c3a10754 [0,0,0,0,0,1|2,0,1]=4 853 B12R1.255 CC(=O)NCCCc1ccco1 e1aa4320962591f5a687835bb172466e [0,0,0,0,0,1|2,0,0]=3 854 B12R1.255 CC(=O)NCCCc1cccs1 917fd69e3534cdf219a2d9a26477a872 [0,0,0,0,0,1|2,0,0]=3 855 B12R1.255 CC(=O)NCCCn1cccc1 1381d782a9ab20c30ba27a199a868271 [0,0,0,0,0,1|3,0,0]=4 856 B12R1.255 CC(=O)NCCCn1cccn1 14f3da978b4b004d068a79ffacfed968 [0,0,0,0,0,1|2,0,0]=3 857 B12R1.255 CC(=O)NCCCn1ccnc1 b0ea76d7a6f741a03ae02a6acd4eb3d6 [0,0,0,0,0,1|2,0,1]=4 858 B12R1.255 CC(=O)NCCCn1ccnn1 e81323a9b8368067f5f54233c7ad5248 [0,0,0,0,0,1|3,0,0]=4 859 B12R1.255 CC(=O)NCCCn1cncn1 e437e09e21fdc83894056112abecc814 [0,0,0,0,0,1|1,0,1]=3 860 B12R1.255 CC(=O)NCCNc1c[nH]cn1 ce7e5558e7e93c5df3c7860c82410d69 [0,0,0,0,0,1|0,0,0]=1 861 B12R1.255 CC(=O)NCCNc1c[nH]nn1 84ca8c806821c5e25a4d60dd811de1ca [0,0,0,0,0,1|1,0,0]=2 862 B12R1.255 CC(=O)NCCNc1cc[nH]n1 841542c87ebc28995c9d48fbbfcf3df6 [0,0,0,0,0,1|2,0,0]=3 863 B12R1.255 CC(=O)NCCNc1ccco1 02d7c9de06ca612458e46496608e10cd [0,0,0,0,0,1|2,0,0]=3 864 B12R1.255 CC(=O)NCCNc1cccs1 2521f2a8f803be736c1d1fa5bf67eb80 [0,0,0,0,0,1|2,0,0]=3 865 B12R1.255 CC(=O)NCCNc1ccno1 9faa9e61ad821504ce5acd8739c41265 [0,0,0,0,0,1|2,0,1]=4 866 B12R1.255 CC(=O)NCCNc1ccns1 b5eac335eb541cecb531c959f241ce4b [0,0,0,0,0,1|2,0,1]=4 867 B12R1.255 CC(=O)NCCNc1ccoc1 81ca0777fafdb19d014e111820214021 [0,0,0,0,0,1|2,0,0]=3 868 B12R1.255 CC(=O)NCCNc1ccon1 8dec2cc6afad3878c6de10b7aa452f02 [0,0,0,0,0,1|2,0,0]=3 869 B12R1.255 CC(=O)NCCNc1ccsc1 5f76fe62b52683f9a196961f53b06c76 [0,0,0,0,0,1|2,0,0]=3 870 B12R1.255 CC(=O)NCCNc1ccsn1 18ea5b73f453fd51286de8790aba4c9a [0,0,0,0,0,1|2,0,0]=3 871 B12R1.255 CC(=O)NCCNc1cn[nH]c1 08f4eeb9fdb4088aae5b324f7c77ebe7 [0,0,0,0,0,1|2,0,0]=3 872 B12R1.255 CC(=O)NCCNc1cncs1 b41940ae399c2e5452dc5aacdb16312c [0,0,0,0,0,1|1,0,1]=3 873 B12R1.255 CC(=O)NCCNc1cnns1 5476710cc7737e05650c5a2a33519538 [0,0,0,0,0,1|2,0,1]=4 874 B12R1.255 CC(=O)NCCNc1cnoc1 9da879810300059b80242c183937284e [0,0,0,0,0,1|2,0,1]=4 875 B12R1.255 CC(=O)NCCNc1cnon1 d4c6291982c5ba66afc15dcbb3fb34b8 [0,0,0,0,0,1|1,0,1]=3 876 B12R1.255 CC(=O)NCCNc1cnsc1 20bab17b127ae74c9c87985f08e6dc6b [0,0,0,0,0,1|2,0,1]=4 877 B12R1.255 CC(=O)NCCNc1cnsn1 d4ad1efa8513e152bdc085a6868df5c4 [0,0,0,0,0,1|1,0,1]=3 878 B12R1.255 CC(=O)NCCNc1cocn1 47b17e53f7959caf414ffb51c3cd5ada [0,0,0,0,0,1|1,0,0]=2 879 B12R1.255 CC(=O)NCCNc1cscn1 72a816d99c849d07ea599ad519a5c3ee [0,0,0,0,0,1|1,0,0]=2 880 B12R1.255 CC(=O)NCCNc1csnn1 4cbf2db91f04851a6b9cd537725829a0 [0,0,0,0,0,1|2,0,0]=3 881 B12R1.255 CC(=O)NCCNc1nc[nH]n1 44b10294e612f566cc08e4253310bccf [0,0,0,0,0,1|1,0,0]=2 882 B12R1.255 CC(=O)NCCNc1ncc[nH]1 69b9be76aa2082f057c23556f2ecf94a [0,0,0,0,0,1|2,0,0]=3 883 B12R1.255 CC(=O)NCCNc1ncco1 ba9b48e8f94f54139f4c543f62fd7d6f [0,0,0,0,0,1|2,0,0]=3 884 B12R1.255 CC(=O)NCCNc1nccs1 7349889b2367836b267fdb6e6fd970bf [0,0,0,0,0,1|2,0,0]=3 885 B12R1.255 CC(=O)NCCNc1ncns1 eef0372f370cccf36c44854b21eb6f4a [0,0,0,0,0,1|1,0,1]=3 886 B12R1.255 CC(=O)NCCNc1ncon1 05c8f266bba9258b5ce4612aa481306e [0,0,0,0,0,1|2,0,0]=3 887 B12R1.255 CC(=O)NCCNc1ncsn1 326c1ec96ec9887ad09f70bc1be8cae2 [0,0,0,0,0,1|2,0,0]=3 888 B12R1.255 CC(=O)NCCNc1nn[nH]n1 d6362dded9646b53d9ebf66011462393 [0,0,0,0,0,1|2,0,0]=3 889 B12R1.255 CC(=O)NCCNc1nnco1 ed9f40d4963d699f2542d1e04b9780ec [0,0,0,0,0,1|2,0,1]=4 890 B12R1.255 CC(=O)NCCNc1nncs1 08ba149a3f996108545d1d9dff3c2052 [0,0,0,0,0,1|2,0,1]=4 891 B12R1.255 CC(=O)NCCNc1nnns1 1c42cc77882411b6995fa8d10ea52191 [0,0,0,0,0,1|2,0,1]=4 892 B12R1.255 CC(=O)NCCOc1c[nH]cn1 a71d2585ad15b81c2de6938f9fb6939c [0,0,0,0,0,1|0,0,0]=1 893 B12R1.255 CC(=O)NCCOc1ccco1 6bb64cc5c3c8c0629b7d67f0d9b5b754 [0,0,0,0,0,1|2,0,0]=3 894 B12R1.255 CC(=O)NCCOc1cccs1 0352caf0d8868c165ffebe393229173e [0,0,0,0,0,1|2,0,0]=3 895 B12R1.255 CC(=O)NCCOc1ccn[nH]1 b04964e3a18f75b103539fd701312033 [0,0,0,0,0,1|2,0,1]=4 896 B12R1.255 CC(=O)NCCOc1ccsc1 753350ab8783585349f6e6096d37db3b [0,0,0,0,0,1|2,0,0]=3 897 B12R1.255 CC(=O)NCCOc1cn[nH]c1 a07c55e94b21078f991f93086f971b7c [0,0,0,0,0,1|2,0,0]=3 898 B12R1.255 CC(=O)NCCOc1cnoc1 9944d2300a09d5c5cc4c1b3e51849590 [0,0,0,0,0,1|2,0,1]=4 899 B12R1.255 CC(=O)NCCOc1cnsn1 797a97769504ae54eabb04b7e2a20c38 [0,0,0,0,0,1|1,0,1]=3 900 B12R1.255 CC(=O)NCCOc1nccs1 5af7538144e493a46d26a964c443076d [0,0,0,0,0,1|2,0,0]=3 901 B12R1.255 CC(=O)NCCOc1nncs1 72d2c3c4e388d4083a9a5861573a620a [0,0,0,0,0,1|2,0,1]=4 902 B12R1.255 CC(=O)NCCOn1cccn1 b6e9a408d638f8f7574e533bc927425b [0,0,0,0,0,1|2,0,0]=3 903 B12R1.255 CC(=O)NCCOn1ccnc1 18423fa12b269efd243375f535f8cc62 [0,0,0,0,0,1|2,0,1]=4 904 B12R1.255 CC(=O)NCOCc1ccco1 10c99e6a3e71803ab2933516b8c03932 [0,0,0,0,0,1|2,0,0]=3 905 B12R1.255 CC(=O)NCOCc1cccs1 8801ae8ae3fe9f550173b61a2e88b077 [0,0,0,0,0,1|2,0,0]=3 906 B12R1.255 CC(=O)NCOCc1ccno1 170b210256575eb149ba65f2ee8cc533 [0,0,0,0,0,1|2,0,1]=4 907 B12R1.255 CC(=O)NCOCc1ccon1 4bd225bb222c4b0f3ed63de6645ad2e0 [0,0,0,0,0,1|2,0,0]=3 908 B12R1.255 CC(=O)NCOCc1ccsc1 9da784a1da00010eea46c0388193f5f2 [0,0,0,0,0,1|2,0,0]=3 909 B12R1.255 CC(=O)NCOCc1cnc[nH]1 d9419f984af4e548b7d2c88d06d72a82 [0,0,0,0,0,1|0,0,2]=3 910 B12R1.255 CC(=O)NCOCc1cnoc1 a738ecdb845ce728670d0708f41a6f15 [0,0,0,0,0,1|2,0,1]=4 911 B12R1.255 CC(=O)NCOCc1cocn1 1cbe4a493dca987102731d216dc1d2c3 [0,0,0,0,0,1|1,0,0]=2 912 B12R1.255 CC(=O)NCOCc1cscn1 e6b05eb03f6204bc35728f6046b7ec4a [0,0,0,0,0,1|1,0,0]=2 913 B12R1.255 CC(=O)NCOCc1nc[nH]n1 8805ea1c27d6683b27135c2466c4cde4 [0,0,0,0,0,1|1,0,0]=2 914 B12R1.255 CC(=O)NCOCc1ncc[nH]1 f8488d682d60601adb51dfc1237721e7 [0,0,0,0,0,1|2,0,0]=3 915 B12R1.255 CC(=O)NCOCc1ncco1 e311cb9d26c42c0f25b713f7ef157684 [0,0,0,0,0,1|2,0,0]=3 916 B12R1.255 CC(=O)NCOCc1nccs1 5642ccff4815f8807c8777d76dd42c9c [0,0,0,0,0,1|2,0,0]=3 917 B12R1.255 CC(=O)NCOCc1ncno1 b3582fab902953dd1562dca436a08e95 [0,0,0,0,0,1|1,0,1]=3 918 B12R1.255 CC(=O)NCOCc1ncon1 c5fa7d69f6cc47a120a06d96425b4375 [0,0,0,0,0,1|2,0,0]=3 919 B12R1.255 CC(=O)NCOCc1nnco1 1af1c3fa632314207c10852a0b07680b [0,0,0,0,0,1|2,0,1]=4 920 B12R1.255 CC(=O)NCOCc1nnn[nH]1 786b20c1f8c39bd91e58a95ac7a0afa1 [0,0,0,0,0,1|2,0,1]=4 921 B12R1.255 CC(=O)NCOCn1cncn1 dab4a2ce4133f2674bc8ed7e9b4afc5f [0,0,0,0,0,1|1,0,1]=3 922 B12R1.255 CC(=O)NCOCn1nccn1 f0b3ce5270137c419a7ccf3e5f112f5b [0,0,0,0,0,1|3,0,0]=4 923 B12R1.255 CC(=O)OCCNc1cc[nH]n1 1c663701a8e203a4c64724c789b8b902 [0,0,0,0,0,1|3,0,0]=4 924 B12R1.255 CC(=O)OCCNc1cccs1 fe698497c2f5a7b4634f770efc9fbbd5 [0,0,0,0,0,1|3,0,0]=4 925 B12R1.255 CC(=O)OCCNc1ccon1 2a7f737c533b3943573116b0445f3b8b [0,0,0,0,0,1|3,0,0]=4 926 B12R1.255 CC(=O)OCCNc1ccsc1 5b2a1b0ab1f5e93dcf7dcf8ccf0df365 [0,0,0,0,0,1|3,0,0]=4 927 B12R1.255 CC(=O)OCCNc1cn[nH]c1 8524e57594f05841f4c358481f59a11b [0,0,0,0,0,1|3,0,0]=4 928 B12R1.255 CC(=O)OCCNc1cncs1 406a58e0c50f9ed1d8efd92efe9b0593 [0,0,0,0,0,1|2,0,1]=4 929 B12R1.255 CC(=O)OCCNc1cnon1 d8cd874c432bcf2783a22504805592ba [0,0,0,0,0,1|2,0,1]=4 930 B12R1.255 CC(=O)OCCNc1cocn1 56167c08550762f9111a628d85d1f4f0 [0,0,0,0,0,1|2,0,0]=3 931 B12R1.255 CC(=O)OCCNc1cscn1 5c84614e5f6fd3adaf948216ffa1d023 [0,0,0,0,0,1|2,0,0]=3 932 B12R1.255 CC(=O)OCCNc1nc[nH]n1 01f537d8e5d1fb70ee684885ac9970f0 [0,0,0,0,0,1|2,0,0]=3 933 B12R1.255 CC(=O)OCCNc1ncc[nH]1 a8ba833590c30c28002e88bd42705b0c [0,0,0,0,0,1|3,0,0]=4 934 B12R1.255 CC(=O)OCCNc1ncco1 e9dfbe49593d08788d35f7e204f8eb83 [0,0,0,0,0,1|3,0,0]=4 935 B12R1.255 CC(=O)OCCNc1nccs1 a81052f18d99f8664ef38c9cd42786cd [0,0,0,0,0,1|3,0,0]=4 936 B12R1.255 CC(=O)OCCNc1ncns1 735aafc79ab89c9150ac24c42c0a3b64 [0,0,0,0,0,1|2,0,1]=4 937 B12R1.255 CC(=O)OCCNc1ncon1 1a9841fbd71d1396b8ca392d90dadb12 [0,0,0,0,0,1|3,0,0]=4 938 B12R1.255 CC(=O)OCCNc1ncsn1 78642937f18a011800e320886f196370 [0,0,0,0,0,1|3,0,0]=4 939 B12R1.255 CC(=O)OCCNc1nn[nH]n1 eaae4a89dd23b371327314b7f57a61cb [0,0,0,0,0,1|3,0,0]=4 940 B12R1.255 CC(=O)OCCOc1c[nH]cn1 9e115b46cd03b5729128a042e6bc6ae0 [0,0,0,0,0,1|1,0,0]=2 941 B12R1.255 CC(=O)OCCOc1ccco1 8c68d713ece66b6ffb83b011b9d2449f [0,0,0,0,0,1|3,0,0]=4 942 B12R1.255 CC(=O)OCCOc1cccs1 169b1d0f25fc492249ecd6050e668ba0 [0,0,0,0,0,1|3,0,0]=4 943 B12R1.255 CC(=O)OCCOc1ccsc1 c4f01c11a781f6a40d785373e3dfa616 [0,0,0,0,0,1|3,0,0]=4 944 B12R1.255 CC(=O)OCCOc1cn[nH]c1 814dd2d5d9145131eb4b50e5f8aaaea8 [0,0,0,0,0,1|3,0,0]=4 945 B12R1.255 CC(=O)OCCOc1cnsn1 2cc059600504a7cff2d2cab46d2d8ab2 [0,0,0,0,0,1|2,0,1]=4 946 B12R1.255 CC(=O)OCCOc1nccs1 dea825aabb32d3702bd1a2e8feaf3614 [0,0,0,0,0,1|3,0,0]=4 947 B12R1.255 CC(=O)OCCOn1cccn1 0f02ea0dc52f81e2bb9820423f5986e3 [0,0,0,0,0,1|3,0,0]=4 948 B12R1.255 CC(=O)OCNCc1c[nH]nn1 5dc39dbe0f9278a06bfc7e1cf0dc96a0 [0,0,0,0,0,1|2,0,0]=3 949 B12R1.255 CC(=O)OCNCc1cc[nH]c1 34e284411fc08e9074d68daa9f5d3f96 [0,0,0,0,0,1|2,0,0]=3 950 B12R1.255 CC(=O)OCNCc1ccc[nH]1 aff1fefb10670d83920c7fb35b6e4b8b [0,0,0,0,0,1|2,0,1]=4 951 B12R1.255 CC(=O)OCNCc1ccco1 dc3bad65438da0ec925d64c99fc4dd0b [0,0,0,0,0,1|3,0,0]=4 952 B12R1.255 CC(=O)OCNCc1cccs1 6187085c5e41f58018c5b643b59dabfe [0,0,0,0,0,1|3,0,0]=4 953 B12R1.255 CC(=O)OCNCc1ccoc1 b828ad9330c794fd372e381e41706b19 [0,0,0,0,0,1|3,0,0]=4 954 B12R1.255 CC(=O)OCNCc1ccon1 e6afa533007f7cfe7a9fe37a6169bd70 [0,0,0,0,0,1|3,0,0]=4 955 B12R1.255 CC(=O)OCNCc1ccsc1 c90380da7a0a7dee9b434791dca2b042 [0,0,0,0,0,1|3,0,0]=4 956 B12R1.255 CC(=O)OCNCc1ccsn1 1596a38778747b198753dcfcaee55b96 [0,0,0,0,0,1|3,0,0]=4 957 B12R1.255 CC(=O)OCNCc1cn[nH]c1 8153a72232d26a033f0bc7e9e7ecd61a [0,0,0,0,0,1|3,0,0]=4 958 B12R1.255 CC(=O)OCNCc1cnco1 7375b242e22de0efbd943461563bf1f4 [0,0,0,0,0,1|2,0,1]=4 959 B12R1.255 CC(=O)OCNCc1cncs1 6e17a568b27a561ebe53ee64473f69f4 [0,0,0,0,0,1|2,0,1]=4 960 B12R1.255 CC(=O)OCNCc1cocn1 0b4528784c39c3dec6e678495f1473ae [0,0,0,0,0,1|2,0,0]=3 961 B12R1.255 CC(=O)OCNCc1cscn1 a1c58c2a712cf80e6fef29c11907648e [0,0,0,0,0,1|2,0,0]=3 962 B12R1.255 CC(=O)OCNCc1ncc[nH]1 562e3465250db845e5ba1d98be4d4e05 [0,0,0,0,0,1|3,0,0]=4 963 B12R1.255 CC(=O)OCNCc1ncco1 c7cd7e4ad44da595349937e6560ecc86 [0,0,0,0,0,1|3,0,0]=4 964 B12R1.255 CC(=O)OCNCc1nccs1 5adfb2263bc6ade3405765372eebb686 [0,0,0,0,0,1|3,0,0]=4 965 B12R1.255 CC(=O)OCNCc1ncn[nH]1 78f4b5800a05a40646f60ae37131aced [0,0,0,0,0,1|2,0,1]=4 966 B12R1.255 CC(=O)OCOCc1cc[nH]c1 c183f67f1242d41df342370852a07247 [0,0,0,0,0,1|2,0,0]=3 967 B12R1.255 CC(=O)OCOCc1ccc[nH]1 7c6d5af61c4ae9052635c09455fa5cb6 [0,0,0,0,0,1|2,0,1]=4 968 B12R1.255 CC(=O)OCOCc1ccco1 b4c1e1e90975e5a59f904fb08792cf48 [0,0,0,0,0,1|3,0,0]=4 969 B12R1.255 CC(=O)OCOCc1cccs1 d0a768db9043c08159530735f4d00ce4 [0,0,0,0,0,1|3,0,0]=4 970 B12R1.255 CC(=O)OCOCc1ccoc1 d287f1e9febf374ef7dab67e0d7f9c4f [0,0,0,0,0,1|3,0,0]=4 971 B12R1.255 CC(=O)OCOCc1ccon1 89108a2692e7963a1b9bce8abac892f2 [0,0,0,0,0,1|3,0,0]=4 972 B12R1.255 CC(=O)OCOCc1ccsc1 917d38116239444d1aa6d7fc72bfeb81 [0,0,0,0,0,1|3,0,0]=4 973 B12R1.255 CC(=O)OCOCc1ccsn1 d730980be867a3697f1fb857cc8e7a4a [0,0,0,0,0,1|3,0,0]=4 974 B12R1.255 CC(=O)OCOCc1cn[nH]c1 34303149f019e08a7ae4462daccfc080 [0,0,0,0,0,1|3,0,0]=4 975 B12R1.255 CC(=O)OCOCc1cnc[nH]1 d5ec9ec74776c546016d70f06afe6fb9 [0,0,0,0,0,1|1,0,2]=4 976 B12R1.255 CC(=O)OCOCc1cnco1 574d971a01c2b24758bb2f7b198c9bf9 [0,0,0,0,0,1|2,0,1]=4 977 B12R1.255 CC(=O)OCOCc1cncs1 bffb63e2704cfbccfbc42fcc9ca5f5de [0,0,0,0,0,1|2,0,1]=4 978 B12R1.255 CC(=O)OCOCc1cnsn1 7f8ecadd2ffd3b092f9570cc54033a35 [0,0,0,0,0,1|2,0,1]=4 979 B12R1.255 CC(=O)OCOCc1cocn1 bf4a8a5cefa079cbb9612f05acc02838 [0,0,0,0,0,1|2,0,0]=3 980 B12R1.255 CC(=O)OCOCc1cscn1 65d8ae8d374311b5d5241083e0e3cc46 [0,0,0,0,0,1|2,0,0]=3 981 B12R1.255 CC(=O)OCOCc1csnn1 1f35d4e9e4e2b6c574a4ecf39591d5e6 [0,0,0,0,0,1|3,0,0]=4 982 B12R1.255 CC(=O)OCOCc1nc[nH]n1 edc01d4e75e1ed77ffb1b4c888caacf7 [0,0,0,0,0,1|2,0,0]=3 983 B12R1.255 CC(=O)OCOCc1ncc[nH]1 b212f2d42d8d34aa0f870a0dd133a990 [0,0,0,0,0,1|3,0,0]=4 984 B12R1.255 CC(=O)OCOCc1ncco1 77d7cff900511ef0eb94d4b2346d905b [0,0,0,0,0,1|3,0,0]=4 985 B12R1.255 CC(=O)OCOCc1nccs1 3fbdc50438bb0ecaa0036615f52df878 [0,0,0,0,0,1|3,0,0]=4 986 B12R1.255 CC(=O)OCOCc1ncno1 98f5f445c9766f36afaf67401ce14771 [0,0,0,0,0,1|2,0,1]=4 987 B12R1.255 CC(=O)OCOCc1ncns1 727077fdaefa58059d9eb592f2df0883 [0,0,0,0,0,1|2,0,1]=4 988 B12R1.255 CC(=O)OCOCc1ncon1 f936fa15053b17a597660ee8a4f3b7c0 [0,0,0,0,0,1|3,0,0]=4 989 B12R1.255 CC(=O)OCOCc1nn[nH]n1 5e919f8811f1ad4a9010d9ab378ecbcd [0,0,0,0,0,1|3,0,0]=4 990 B12R1.255 CC(=O)OCOCn1cccn1 8a3450af43718f2f4203c3b2d43d1fba [0,0,0,0,0,1|3,0,0]=4 991 B12R1.255 CC(=O)OCOCn1cncn1 551207601730b1aab847aae573776e59 [0,0,0,0,0,1|2,0,1]=4 992 B12R1.255 CC(=O)SCCNc1cc[nH]n1 4240df493eb683e474ce2b57a51e550d [0,0,0,0,0,1|3,0,0]=4 993 B12R1.255 CC(=O)SCCNc1cccs1 57567ee9fe3ccfe39354f36f5ccc582b [0,0,0,0,0,1|3,0,0]=4 994 B12R1.255 CC(=O)SCCNc1ccon1 57c9c3a3664eed1743f52fc0470ef73f [0,0,0,0,0,1|3,0,0]=4 995 B12R1.255 CC(=O)SCCNc1ccsc1 f04a323e8d817d6055c289d7d6b683db [0,0,0,0,0,1|3,0,0]=4 996 B12R1.255 CC(=O)SCCNc1cn[nH]c1 eff127db97c120acada18274357f4303 [0,0,0,0,0,1|3,0,0]=4 997 B12R1.255 CC(=O)SCCNc1cncs1 5599d3aafca3c3284b98a807f03a668c [0,0,0,0,0,1|2,0,1]=4 998 B12R1.255 CC(=O)SCCNc1cnon1 63d143b3f8dbbf2da97a6490ef09a3d3 [0,0,0,0,0,1|2,0,1]=4 999 B12R1.255 CC(=O)SCCNc1cocn1 f8dbda12c0cfe746c1ea685f2b21d7d8 [0,0,0,0,0,1|2,0,0]=3 1000 B12R1.255 CC(=O)SCCNc1cscn1 f595ebe899d29e984262dfb8ac1eb03f [0,0,0,0,0,1|2,0,0]=3 1001 B12R1.255 CC(=O)SCCNc1nc[nH]n1 f468e4c081be0b5404f98c1b4735d2d9 [0,0,0,0,0,1|2,0,0]=3 1002 B12R1.255 CC(=O)SCCNc1ncc[nH]1 d27ad31c0e2986d91046f149879d6242 [0,0,0,0,0,1|3,0,0]=4 1003 B12R1.255 CC(=O)SCCNc1ncco1 1c3fb2d914400c50d798fd40e860cabf [0,0,0,0,0,1|3,0,0]=4 1004 B12R1.255 CC(=O)SCCNc1nccs1 b948761104704e349b9aeebed80f662d [0,0,0,0,0,1|3,0,0]=4 1005 B12R1.255 CC(=O)SCCNc1ncns1 e3ba8376e4437619667531a40eaa8ddc [0,0,0,0,0,1|2,0,1]=4 1006 B12R1.255 CC(=O)SCCNc1ncon1 d94582581a68cf86bc956343033300c7 [0,0,0,0,0,1|3,0,0]=4 1007 B12R1.255 CC(=O)SCCNc1ncsn1 aa92b3c1e8eced2992ae207e000e1539 [0,0,0,0,0,1|3,0,0]=4 1008 B12R1.255 CC(=O)SCCNc1nn[nH]n1 fd265cdb398346d6b0baccf482a768ac [0,0,0,0,0,1|3,0,0]=4 1009 B12R1.255 CC(=O)SCCOc1c[nH]cn1 8bcd60922d60eb71808063db9772ec2f [0,0,0,0,0,1|1,0,0]=2 1010 B12R1.255 CC(=O)SCCOc1ccco1 1b65e07bf700c69aaf49b8c86dac647c [0,0,0,0,0,1|3,0,0]=4 1011 B12R1.255 CC(=O)SCCOc1cccs1 5821f5d023d9347fee830d2270c1abc4 [0,0,0,0,0,1|3,0,0]=4 1012 B12R1.255 CC(=O)SCCOc1ccsc1 d36683d2b6faf4bda72fa48f8f9a7bd8 [0,0,0,0,0,1|3,0,0]=4 1013 B12R1.255 CC(=O)SCCOc1cn[nH]c1 7ee76b84f6af9115b0f89eea86773b76 [0,0,0,0,0,1|3,0,0]=4 1014 B12R1.255 CC(=O)SCCOc1cnsn1 c42941620e47b20b9cafdb83a28e7997 [0,0,0,0,0,1|2,0,1]=4 1015 B12R1.255 CC(=O)SCCOc1nccs1 0b041ca071a4a4b7de809ed9629e37dd [0,0,0,0,0,1|3,0,0]=4 1016 B12R1.255 CC(=O)SCCOn1cccn1 9c15d15e903cd533d950eb98fff2b22b [0,0,0,0,0,1|3,0,0]=4 1017 B12R1.255 CC(C)CCCNc1c[nH]cn1 1d12d46ab5e904238ae7a6c9d87a7ab8 [0,0,0,0,0,1|2,0,1]=4 1018 B12R1.255 CC(C)CCCOc1c[nH]cn1 39c0cdf09b2c4f190ce300dc432d2230 [0,0,0,0,0,1|2,0,1]=4 1019 B12R1.255 CC(C)CNCCc1c[nH]cn1 5fe4f06338de5343e6539cb2cdf3233d [0,0,0,0,0,1|1,0,1]=3 1020 B12R1.255 CC(C)CNCCc1cscn1 7b1b467a12f950c56649537afe229157 [0,0,0,0,0,1|2,0,1]=4 1021 B12R1.255 CC(C)COCCc1c[nH]cn1 f00b0d7aba882e7ef4c72bdc2d138af7 [0,0,0,0,0,1|2,0,1]=4 1022 B12R1.255 CC(C)NCCCc1c[nH]cn1 0634568923ffa1ffeb731c771e117350 [0,0,0,0,0,1|1,0,1]=3 1023 B12R1.255 CC(C)OCCNc1c[nH]cn1 33a9f087e9b50d63e07cf09d1a72d6a8 [0,0,0,0,0,1|2,0,1]=4 1024 B12R1.255 CC(C)OCCOc1c[nH]cn1 90176d823e1dfa223aa929a7b05a9526 [0,0,0,0,0,1|2,0,1]=4 1025 B12R1.255 CC(C)SCCOc1c[nH]cn1 984669c9709e20ae9f2ed32aed89e2f1 [0,0,0,0,0,1|2,0,1]=4 1026 B12R1.255 CC(F)COCCc1c[nH]cn1 11b921ed2763aa5fabf3934b48acacbe [0,0,0,0,0,1|2,0,1]=4 1027 B12R1.255 CC(O)CNCCc1c[nH]cn1 07a7b1f4fe50e5103b1dfe2d653edae6 [0,0,0,0,0,1|0,0,2]=3 1028 B12R1.255 CC(O)CNCCc1cscn1 9039ee22d1440b59ab81b3ae7473eb91 [0,0,0,0,0,1|1,0,2]=4 1029 B12R1.255 CC(S)COCCc1c[nH]cn1 3c8ab5ce882f4e80b01e23babb03a945 [0,0,0,0,0,1|1,1,1]=4 1030 B12R1.255 CN(C)CCCNc1c[nH]cn1 5d6e6b07119e758fd54f20f477fe42f4 [0,0,0,0,0,1|3,0,0]=4 1031 B12R1.255 CN(C)CCCOc1c[nH]cn1 f97fb7761a10a206d725b0c7c8b480fa [0,0,0,0,0,1|3,0,0]=4 1032 B12R1.255 CN(C)CNCCc1c[nH]cn1 cc0d2159e08b0ee77c3e28081cfd5d37 [0,0,0,0,0,1|2,0,0]=3 1033 B12R1.255 CN(C)CNCCc1cscn1 569c46595ccdf08e13b07bccdb65d059 [0,0,0,0,0,1|3,0,0]=4 1034 B12R1.255 CN(C)COCCc1c[nH]cn1 b11c17f54d3f63151ffd93e3fbf4baed [0,0,0,0,0,1|3,0,0]=4 1035 B12R1.255 CS(=O)CCCNc1c[nH]cn1 de2f7a1b248c9d731e69d5921a1053b7 [0,0,0,0,0,1|2,0,0]=3 1036 B12R1.255 CS(=O)CCCNc1c[nH]nn1 6306c245f1ec58b73e3add89737954b1 [0,0,0,0,0,1|3,0,0]=4 1037 B12R1.255 CS(=O)CCCNc1cocn1 3847fe131c9df0c0875137d91e272c87 [0,0,0,0,0,1|3,0,0]=4 1038 B12R1.255 CS(=O)CCCNc1cscn1 b24a3127fe4637d4e18b941fdbbf9e88 [0,0,0,0,0,1|3,0,0]=4 1039 B12R1.255 CS(=O)CCCNc1nc[nH]n1 76f19f5606de88c4c58ff4e28430b9b9 [0,0,0,0,0,1|3,0,0]=4 1040 B12R1.255 CS(=O)CCNCc1c[nH]nn1 f9b34620eea99b780a03dbe885538996 [0,0,0,0,0,1|3,0,0]=4 1041 B12R1.255 CS(=O)CCNCc1cc[nH]c1 74233bdd4b1ee4f783710257b3d46435 [0,0,0,0,0,1|3,0,0]=4 1042 B12R1.255 CS(=O)CCNCc1cocn1 7a831937bee191d55a472114dfd834d8 [0,0,0,0,0,1|3,0,0]=4 1043 B12R1.255 CS(=O)CCNCc1cscn1 39c4187cf23189907dbb52770e1553ee [0,0,0,0,0,1|3,0,0]=4 1044 B12R1.255 CS(=O)CCOCc1cc[nH]c1 58041ab3cae3c6e3f150ae8424c2f818 [0,0,0,0,0,1|3,0,0]=4 1045 B12R1.255 CS(=O)CCOCc1cocn1 c51a0ac7214be9bbf1d70fdc57149611 [0,0,0,0,0,1|3,0,0]=4 1046 B12R1.255 CS(=O)CCOCc1cscn1 63515a598a5b7184b4be5ae765b326f9 [0,0,0,0,0,1|3,0,0]=4 1047 B12R1.255 CS(=O)CCOCc1nc[nH]n1 96ef318f74644771c4bac14ad053e989 [0,0,0,0,0,1|3,0,0]=4 1048 B12R1.255 C[C@@H](F)COCCc1c[nH]cn1 5d3c58c7c1c47c210b8fcd478109a990 [0,0,0,0,0,1|2,0,1]=4 1049 B12R1.255 C[C@@H](O)CNCCc1c[nH]cn1 4a77e264b40a3987c1bd1da815d4f99c [0,0,0,0,0,1|0,0,2]=3 1050 B12R1.255 C[C@@H](O)CNCCc1cscn1 cc9ca1e7b154c7284944aa3dd0ea878f [0,0,0,0,0,1|1,0,2]=4 1051 B12R1.255 C[C@H](F)COCCc1c[nH]cn1 b3d0c92d4f1d4a9e9822e7ac914a5457 [0,0,0,0,0,1|2,0,1]=4 1052 B12R1.255 C[C@H](O)CNCCc1c[nH]cn1 e82d7e86db7b0dbaab0ea0236fdcd8e9 [0,0,0,0,0,1|0,0,2]=3 1053 B12R1.255 C[C@H](O)CNCCc1cscn1 e94e57a30e611b8b55a41c7f6c01576e [0,0,0,0,0,1|1,0,2]=4 1054 B12R1.255 FC(=CCCOc1c[nH]cn1)F 5b999d591ee2843f04c37475380fa730 [0,0,0,0,0,1|3,0,0]=4 1055 B12R1.255 FC(F)CNCCc1c[nH]cn1 c913781075d926d84072d78578b2da13 [0,0,0,0,0,1|2,0,1]=4 1056 B12R1.255 NC(=O)C#CCNc1c[nH]cn1 d3ca165054378d50f117b0c2b520bd04 [0,0,0,0,0,1|2,0,1]=4 1057 B12R1.255 NC(=O)CCCNc1c[nH]cn1 4a472fd14be6386cff07433c7c1c98f1 [0,0,0,0,0,1|2,0,0]=3 1058 B12R1.255 NC(=O)CCCNc1c[nH]nn1 aa85094dcd9357324cd8af1e6798ad1d [0,0,0,0,0,1|3,0,0]=4 1059 B12R1.255 NC(=O)CCCNc1cocn1 5c3456debf793c4a5dc4bee2056c1bdd [0,0,0,0,0,1|3,0,0]=4 1060 B12R1.255 NC(=O)CCCNc1cscn1 ed79bc408420354880584dbb702e0a1e [0,0,0,0,0,1|3,0,0]=4 1061 B12R1.255 NC(=O)CCCNc1nc[nH]n1 5f2834d75f75b756781270ba4768b93b [0,0,0,0,0,1|3,0,0]=4 1062 B12R1.255 NC(=O)CCCOc1c[nH]cn1 1f50b9eec1ce3a0449a6522fb485f4f7 [0,0,0,0,0,1|2,0,0]=3 1063 B12R1.255 NC(=O)CCNCc1c[nH]nn1 6460a93fb0fbbc8aaebc039b2ff15d3c [0,0,0,0,0,1|3,0,0]=4 1064 B12R1.255 NC(=O)CCNCc1cc[nH]c1 f314aa37865c714318ee8f41bff08e2f [0,0,0,0,0,1|3,0,0]=4 1065 B12R1.255 NC(=O)CCNCc1cocn1 b9f34efcb3f35f434039dbfcb1fc1c73 [0,0,0,0,0,1|3,0,0]=4 1066 B12R1.255 NC(=O)CCNCc1cscn1 3a546c90b4c537b0446c8a99a9640bbf [0,0,0,0,0,1|3,0,0]=4 1067 B12R1.255 NC(=O)CCOCc1cc[nH]c1 0669fa9d3da5b3059f2e30d388082841 [0,0,0,0,0,1|3,0,0]=4 1068 B12R1.255 NC(=O)CCOCc1cocn1 0a640cae0a6a7a163972976005c8825e [0,0,0,0,0,1|3,0,0]=4 1069 B12R1.255 NC(=O)CCOCc1cscn1 a27bc4a876af471103c0849e6f57bd7c [0,0,0,0,0,1|3,0,0]=4 1070 B12R1.255 NC(=O)CCOCc1nc[nH]n1 f7f89bd83a14bdc44a93357d2648124f [0,0,0,0,0,1|3,0,0]=4 1071 B12R1.255 NC(=O)CNCCc1c[nH]cn1 bbef68be7389871cd84fe72f0d6b9967 [0,0,0,0,0,1|1,0,0]=2 1072 B12R1.255 NC(=O)CNCCc1cc[nH]n1 b00580dae7009071ffcfcb5edd9a2ad6 [0,0,0,0,0,1|3,0,0]=4 1073 B12R1.255 NC(=O)CNCCc1ccc[nH]1 ccd36e018f2dc283872db1ce32c69941 [0,0,0,0,0,1|2,0,1]=4 1074 B12R1.255 NC(=O)CNCCc1ccco1 2386bc25c1b740c7b496e40a490c4751 [0,0,0,0,0,1|3,0,0]=4 1075 B12R1.255 NC(=O)CNCCc1cccs1 a95d34c2de8a12e928b1316f7378cc9c [0,0,0,0,0,1|3,0,0]=4 1076 B12R1.255 NC(=O)CNCCc1ccsc1 5d209aa47026354c41e1292ed8d70073 [0,0,0,0,0,1|3,0,0]=4 1077 B12R1.255 NC(=O)CNCCc1cn[nH]c1 429956ccc0c5fcfd8bd971ed50a10904 [0,0,0,0,0,1|3,0,0]=4 1078 B12R1.255 NC(=O)CNCCc1cscn1 55dc18648db2a8c1838d0cf695d7f288 [0,0,0,0,0,1|2,0,0]=3 1079 B12R1.255 NC(=O)CNCCc1ncc[nH]1 853d7fe80f9ced6cfc2d514e41c7a042 [0,0,0,0,0,1|3,0,0]=4 1080 B12R1.255 NC(=O)CNCCc1nccs1 f8318d5e4127c688e421dc76cf8e1623 [0,0,0,0,0,1|3,0,0]=4 1081 B12R1.255 NC(=O)CNCCc1ncon1 1772713b24d2af8869820e588c5cd53d [0,0,0,0,0,1|3,0,0]=4 1082 B12R1.255 NC(=O)CNCCn1cccn1 5fc6e27eb9045ed25f08f6cda16d3ea7 [0,0,0,0,0,1|3,0,0]=4 1083 B12R1.255 NC(=O)CNCCn1cncn1 56f8485521f1679696714789ed3ad03e [0,0,0,0,0,1|2,0,1]=4 1084 B12R1.255 NC(=O)COCCc1c[nH]cn1 a44dcf89de62e927be51d5b61c705c6d [0,0,0,0,0,1|2,0,0]=3 1085 B12R1.255 NC(=O)COCCc1cscn1 fe353d031cb9d1fbea88359ee06dbd11 [0,0,0,0,0,1|3,0,0]=4 1086 B12R1.255 NC(=O)NCCNc1cc[nH]n1 b8ad8725e6819805d2224428d53cf890 [0,0,0,0,0,1|3,0,0]=4 1087 B12R1.255 NC(=O)NCCNc1cccs1 fa19a958f0edd61b9dc8cb5d7811351f [0,0,0,0,0,1|3,0,0]=4 1088 B12R1.255 NC(=O)NCCNc1ccon1 6d4c6858d5e8471e3e0cbd19882ab203 [0,0,0,0,0,1|3,0,0]=4 1089 B12R1.255 NC(=O)NCCNc1ccsc1 a62701af16f99ffa9032e095695d9b5a [0,0,0,0,0,1|3,0,0]=4 1090 B12R1.255 NC(=O)NCCNc1cn[nH]c1 8755ed5b82dca76e71a36109f2ce530c [0,0,0,0,0,1|3,0,0]=4 1091 B12R1.255 NC(=O)NCCNc1cncs1 9529fdbb592db9c74ecd75750b006497 [0,0,0,0,0,1|2,0,1]=4 1092 B12R1.255 NC(=O)NCCNc1cnon1 c14631953c46c884bcbb8599b95e317b [0,0,0,0,0,1|2,0,1]=4 1093 B12R1.255 NC(=O)NCCNc1cocn1 4cb0a965893dd559ed9a069e67cca2a8 [0,0,0,0,0,1|2,0,0]=3 1094 B12R1.255 NC(=O)NCCNc1cscn1 93ec6f1bb596784f1f42e1cd8aa3a30b [0,0,0,0,0,1|2,0,0]=3 1095 B12R1.255 NC(=O)NCCNc1nc[nH]n1 f7dfd23e1641b744f4817f02681af8c8 [0,0,0,0,0,1|2,0,0]=3 1096 B12R1.255 NC(=O)NCCNc1ncc[nH]1 6f748a89944b15a0e196fef4aa204288 [0,0,0,0,0,1|3,0,0]=4 1097 B12R1.255 NC(=O)NCCNc1ncco1 cc1302e632cc6a419033c12ca1198582 [0,0,0,0,0,1|3,0,0]=4 1098 B12R1.255 NC(=O)NCCNc1nccs1 51cad1500c77384103fcabe9e2b4dd4c [0,0,0,0,0,1|3,0,0]=4 1099 B12R1.255 NC(=O)NCCNc1ncns1 91602c4b729cb2406180d91c6107cf98 [0,0,0,0,0,1|2,0,1]=4 1100 B12R1.255 NC(=O)NCCNc1ncon1 14b40b5a56f2bed2348267dec239ae48 [0,0,0,0,0,1|3,0,0]=4 1101 B12R1.255 NC(=O)NCCNc1nn[nH]n1 bbebf57d51676102187c36e9c7918e4e [0,0,0,0,0,1|3,0,0]=4 1102 B12R1.255 NC(=O)NCCOc1c[nH]cn1 f488fc94ec6ec0bdad7e82ec1d795219 [0,0,0,0,0,1|1,0,0]=2 1103 B12R1.255 NC(=O)NCCOc1ccco1 bc5c6fa4693dea19c767ad0f8c325bea [0,0,0,0,0,1|3,0,0]=4 1104 B12R1.255 NC(=O)NCCOc1cccs1 e13987a19ab0ed869e696c3546f41983 [0,0,0,0,0,1|3,0,0]=4 1105 B12R1.255 NC(=O)NCCOc1ccsc1 78500f85c6d56f52ea19b660d0eb1035 [0,0,0,0,0,1|3,0,0]=4 1106 B12R1.255 NC(=O)NCCOc1cn[nH]c1 8d27c2d4675c34338d5282b8b72d1d1e [0,0,0,0,0,1|3,0,0]=4 1107 B12R1.255 NC(=O)NCCOc1cnsn1 9187ed460d23253d38197492d4efe5b4 [0,0,0,0,0,1|2,0,1]=4 1108 B12R1.255 NC(=O)NCCOc1nccs1 0cd4e966091c58c60abd0ca30c98e246 [0,0,0,0,0,1|3,0,0]=4 1109 B12R1.255 NC(=O)NCCOn1cccn1 c7309d5c6a5083582cb8ec612e45b911 [0,0,0,0,0,1|3,0,0]=4 1110 B12R1.255 NC(=O)NCOCc1ccco1 84230926f3768909b55827f3243e90d6 [0,0,0,0,0,1|3,0,0]=4 1111 B12R1.255 NC(=O)NCOCc1cccs1 6b80d9819fb5fc0063945fe57a52e3fb [0,0,0,0,0,1|3,0,0]=4 1112 B12R1.255 NC(=O)NCOCc1ccon1 81c015ef09af8e5aa79c38659004e308 [0,0,0,0,0,1|3,0,0]=4 1113 B12R1.255 NC(=O)NCOCc1ccsc1 b3b79f2ecf5883018ac2b69631679115 [0,0,0,0,0,1|3,0,0]=4 1114 B12R1.255 NC(=O)NCOCc1cnc[nH]1 404b01a07ebd7a62cf67955e3c4bf346 [0,0,0,0,0,1|1,0,2]=4 1115 B12R1.255 NC(=O)NCOCc1cocn1 773ec79487fea0e1be46bda7637fd7d9 [0,0,0,0,0,1|2,0,0]=3 1116 B12R1.255 NC(=O)NCOCc1cscn1 62683eb05a571e882ef58d8976ae1c55 [0,0,0,0,0,1|2,0,0]=3 1117 B12R1.255 NC(=O)NCOCc1nc[nH]n1 ef8a45a9a8aee0063766b200d6443ddf [0,0,0,0,0,1|2,0,0]=3 1118 B12R1.255 NC(=O)NCOCc1ncc[nH]1 c3b37a5b20bdf40ce8c26109889c0e88 [0,0,0,0,0,1|3,0,0]=4 1119 B12R1.255 NC(=O)NCOCc1ncco1 8c6db3736c7c0211d902821d495f894c [0,0,0,0,0,1|3,0,0]=4 1120 B12R1.255 NC(=O)NCOCc1nccs1 e435735519308234d02a1dc96bfabb34 [0,0,0,0,0,1|3,0,0]=4 1121 B12R1.255 NC(=O)NCOCc1ncno1 c4c6921a5a9cce84339997324dc2524e [0,0,0,0,0,1|2,0,1]=4 1122 B12R1.255 NC(=O)NCOCc1ncon1 c6cd502d127b0eccedc1f228a1c2fcbe [0,0,0,0,0,1|3,0,0]=4 1123 B12R1.255 NC(=O)NCOCn1cncn1 9049f37e70bbbb88a7c81f414a948767 [0,0,0,0,0,1|2,0,1]=4 1124 B12R1.255 NC(=O)SCNCc1c[nH]nn1 ae7248c417da5c88e1f948975def0387 [0,0,0,0,0,1|3,0,0]=4 1125 B12R1.255 NC(=O)SCNCc1cc[nH]c1 9fb39662be4d0e05f420818baca3c0d6 [0,0,0,0,0,1|3,0,0]=4 1126 B12R1.255 NC(=O)SCNCc1cscn1 41962cea17abdd3b1357982fbc43cb8c [0,0,0,0,0,1|3,0,0]=4 1127 B12R1.255 NC(=O)SCOCc1cc[nH]c1 3fd1e13b29217df376b4628857aafad4 [0,0,0,0,0,1|3,0,0]=4 1128 B12R1.255 NC(=O)SCOCc1cocn1 499b58b027888e38ea985429a87f7436 [0,0,0,0,0,1|3,0,0]=4 1129 B12R1.255 NC(=O)SCOCc1cscn1 0d8c2147b63edf5901ae2fd121cde35c [0,0,0,0,0,1|3,0,0]=4 1130 B12R1.255 NC(=O)SCOCc1nc[nH]n1 b5d972975524cf6603d934cff91b3f7c [0,0,0,0,0,1|3,0,0]=4 1131 B12R1.255 NC(=S)COCCc1c[nH]cn1 e117c352c8db5af5b3ea43589e081976 [0,0,0,0,0,1|2,1,0]=4 1132 B12R1.255 NC(=S)NCCNc1c[nH]cn1 d447069ef99c5f595a683d2c805b4260 [0,0,0,0,0,1|1,1,0]=3 1133 B12R1.255 NC(=S)NCCNc1c[nH]nn1 71c33e50f8f6e3d6132f0e65b19d38de [0,0,0,0,0,1|2,1,0]=4 1134 B12R1.255 NC(=S)NCCNc1cocn1 682beecda75168718bb4844f0938215e [0,0,0,0,0,1|2,1,0]=4 1135 B12R1.255 NC(=S)NCCNc1cscn1 3f61c10d4af93574b15790e24b25e085 [0,0,0,0,0,1|2,1,0]=4 1136 B12R1.255 NC(=S)NCCNc1nc[nH]n1 b9d254851da1d91413b778b21e2c9275 [0,0,0,0,0,1|2,1,0]=4 1137 B12R1.255 O=C(O)/C=C/CNc1c[nH]cn1 cae0e5bd20c6a5398f9f773cafc73dec [0,0,0,0,0,1|2,0,1]=4 1138 B12R1.255 O=C(O)/C=C/COc1c[nH]cn1 9c54462e648919de1180f9c915e21b8a [0,0,0,0,0,1|2,0,1]=4 1139 B12R1.255 O=C(O)C#CCNc1c[nH]cn1 9389e48688c43f529309109cad6ed874 [0,0,0,0,0,1|2,0,1]=4 1140 B12R1.255 O=C(O)C=CCNc1c[nH]cn1 c2a22fa2b05306e5501d9ee2d5786bb8 [0,0,0,0,0,1|2,0,1]=4 1141 B12R1.255 O=C(O)C=CCOc1c[nH]cn1 02cecdbd0208bb78c03c903b98b5f916 [0,0,0,0,0,1|2,0,1]=4 1142 B12R1.255 O=C(O)CCCNc1c[nH]cn1 9c9b197eddc3e0dab53be4e1c16ae906 [0,0,0,0,0,1|2,0,0]=3 1143 B12R1.255 O=C(O)CCCNc1c[nH]nn1 0e0ca52f039d89a1b898fccc154b9f10 [0,0,0,0,0,1|3,0,0]=4 1144 B12R1.255 O=C(O)CCCNc1cscn1 216c3d5e9d9b47a28b8918537b5f821c [0,0,0,0,0,1|3,0,0]=4 1145 B12R1.255 O=C(O)CCCOc1c[nH]cn1 f4975d63cd45522ecc03499557313751 [0,0,0,0,0,1|2,0,0]=3 1146 B12R1.255 O=C(O)CCNCc1c[nH]nn1 c655f7ae3f4d08ceccf082ac68712bc6 [0,0,0,0,0,1|3,0,0]=4 1147 B12R1.255 O=C(O)CCNCc1cc[nH]c1 0c3b44ff48bee6034eb8e6f307c7a008 [0,0,0,0,0,1|3,0,0]=4 1148 B12R1.255 O=C(O)CCNCc1cocn1 a003c5cccc75cbf6b3abdd21163b70a8 [0,0,0,0,0,1|3,0,0]=4 1149 B12R1.255 O=C(O)CCNCc1cscn1 bf1c54d49e7184768c34f3c9a93715d0 [0,0,0,0,0,1|3,0,0]=4 1150 B12R1.255 O=C(O)CCNCc1nc[nH]n1 bb4f4978e1c300674d8e271536e1585e [0,0,0,0,0,1|3,0,0]=4 1151 B12R1.255 O=C(O)CCOCc1cc[nH]c1 3fd79aa3347a9b7d1426287d8e95613f [0,0,0,0,0,1|3,0,0]=4 1152 B12R1.255 O=C(O)CCOCc1cocn1 132f412ec36aa624d064838036c4fd17 [0,0,0,0,0,1|3,0,0]=4 1153 B12R1.255 O=C(O)CCOCc1cscn1 a89390452d29839c6c9b07f7202e1e2d [0,0,0,0,0,1|3,0,0]=4 1154 B12R1.255 O=C(O)CCOCc1nc[nH]n1 9844715533fa531f77fb80966756d76f [0,0,0,0,0,1|3,0,0]=4 1155 B12R1.255 O=C(O)CNCCc1c[nH]cn1 28c3c5553ae7808a7a6752f8f825555c [0,0,0,0,0,1|1,0,0]=2 1156 B12R1.255 O=C(O)CNCCc1cc[nH]n1 951413b6f8dd66a136a3da6a782e8ed5 [0,0,0,0,0,1|3,0,0]=4 1157 B12R1.255 O=C(O)CNCCc1ccc[nH]1 ea5646582502ed2189e35ebafaa1f840 [0,0,0,0,0,1|2,0,1]=4 1158 B12R1.255 O=C(O)CNCCc1ccco1 b120de61f4d3984fe919620d8a506603 [0,0,0,0,0,1|3,0,0]=4 1159 B12R1.255 O=C(O)CNCCc1cccs1 8bca4fb35803e79ed6d7dc4a447762dd [0,0,0,0,0,1|3,0,0]=4 1160 B12R1.255 O=C(O)CNCCc1ccsc1 eea86bf5c494e6e6a29fced5c8d60f9c [0,0,0,0,0,1|3,0,0]=4 1161 B12R1.255 O=C(O)CNCCc1cn[nH]c1 d87caef79bb94c7c80b18051c31a3d44 [0,0,0,0,0,1|3,0,0]=4 1162 B12R1.255 O=C(O)CNCCc1cscn1 0b4cdd6d23e9229d6f9629a36a2d4ac3 [0,0,0,0,0,1|2,0,0]=3 1163 B12R1.255 O=C(O)CNCCc1ncc[nH]1 72a3c9f8d8547d16f9609cf4286b87b6 [0,0,0,0,0,1|3,0,0]=4 1164 B12R1.255 O=C(O)CNCCc1nccs1 1bbbb1a91fea6556dcc77b68046b0361 [0,0,0,0,0,1|3,0,0]=4 1165 B12R1.255 O=C(O)CNCCc1ncon1 4c05e73f6ee04bceb29c932b709f738c [0,0,0,0,0,1|3,0,0]=4 1166 B12R1.255 O=C(O)CNCCn1cccn1 fe84f281a662e5f64188829e43847ebc [0,0,0,0,0,1|3,0,0]=4 1167 B12R1.255 O=C(O)CNCCn1cncn1 169f1c2cccd8216289d7ce9718735aae [0,0,0,0,0,1|2,0,1]=4 1168 B12R1.255 O=C(O)COCCc1c[nH]cn1 847075b3c972a42fca822276eda4e532 [0,0,0,0,0,1|2,0,0]=3 1169 B12R1.255 O=C(O)COCCc1cscn1 514bc4c5bb92314696e7fc9e9471ab6a [0,0,0,0,0,1|3,0,0]=4 1170 B12R1.255 O=S(O)COCCc1c[nH]cn1 8074216818ea8bf6c7fb9c3c6fd2b5ce [0,0,0,0,0,1|3,0,0]=4 1171 B12R1.255 O=[N+]([O-])CCCOc1c[nH]cn1 0ce705ee083e0ebc17581499bba70076 [0,0,0,0,0,1|3,0,0]=4 1172 B12R1.255 O=[N+]([O-])CNCCc1c[nH]cn1 11f2b8fd11145f3aec06e0653b94a111 [0,0,0,0,0,1|2,0,0]=3 1173 B12R1.255 O=[N+]([O-])CNCCc1cscn1 0f8b9fc84ec070f546995a1ad5ec4ca1 [0,0,0,0,0,1|3,0,0]=4 1174 B12R1.255 O=[N+]([O-])COCCc1c[nH]cn1 4fda680930d80d6f506947a63d756dc0 [0,0,0,0,0,1|3,0,0]=4 1175 B9R0.1 CC(=O)NCCC(=O)NO 7869db29b1010d2c8be4de04860ee1c2 [1,0,1,0,0,0|2,0,0]=4 1176 B9R0.1 CNC(=O)CCNC(=O)C f3a3033dad8e1aab7fc770fc0743d310 [1,0,1,0,0,0|1,0,1]=4 1177 B9R0.2 C=C/C=C/CCNC(=O)C d1d4b0874c1cb5c136899f1ca87a2779 [1,0,1,0,0,0|1,0,0]=3 1178 B9R0.2 C=CCCCCNC(=O)C e363a045dea279ada86c2460a8f9bcff [1,0,1,0,0,0|1,0,1]=4 1179 B9R0.2 C=CCNCCNC(=O)C c42155b1cb479e87c905460fc595ad3c [1,0,1,0,0,0|2,0,0]=4 1180 B9R0.2 C=CCOCCNC(=O)C a53ca486da172a5bf65bca1009789a59 [1,0,1,0,0,0|2,0,0]=4 1181 B9R0.2 C=COCCCNC(=O)C 22a1f61726553b5b3b9530b2825ec005 [1,0,1,0,0,0|1,0,1]=4 1182 B9R0.2 CC(=O)NCCCNC=O 5fbc3ba2791f885f7e7155f5fab225dd [1,0,1,0,0,0|1,0,1]=4 1183 B9R1.12 C=CCOc1c[nH]cn1 b64bd5797da60b1d481d5ef5f4601f86 [2,0,0,0,0,0|1,0,1]=4 1184 B9R1.12 CCCNc1c[nH]cn1 6b63b2271006eeda903e175a88c0546a [2,0,0,0,0,0|1,0,1]=4 1185 B9R1.12 CCCOc1c[nH]cn1 45a2af4246e68dfa1ee3afde5dc82ddf [2,0,0,0,0,0|1,0,1]=4 1186 B9R1.12 CCNCc1c[nH]nn1 c766f9b8045c81bedb021714f686c053 [2,0,0,0,0,0|1,0,1]=4 1187 B9R1.12 CCNCc1cc[nH]c1 5f34bb16d580f8126d210a7f1c922122 [2,0,0,0,0,0|1,0,1]=4 1188 B9R1.12 CCNCc1cocn1 ee5152002bd65a9d43431c8076f0a4d3 [2,0,0,0,0,0|1,0,1]=4 1189 B9R1.12 CCNCc1cscn1 6ac8fdacb085e4e7af5e2a744e0781a5 [2,0,0,0,0,0|1,0,1]=4 1190 B9R1.12 COCOc1c[nH]cn1 6c2115fe6273b19af20bea24cbbde651 [2,0,0,0,0,0|2,0,0]=4 1191 B9R1.12 CSCOc1c[nH]cn1 8e109d64c8f73539e4b4622297cabda6 [2,0,0,0,0,0|2,0,0]=4 1192 B9R1.12 O=CCNc1cocn1 d39f7e50656af0661ead6cb79ad14799 [2,0,0,0,0,0|2,0,0]=4 1193 B9R1.12 O=CCNc1cscn1 4e568c756a2c7a44625a27be1d3d2997 [2,0,0,0,0,0|2,0,0]=4 1194 B9R1.12 O=CCNc1nc[nH]n1 5fcdd5b3d2c48731c3e9de0f9f417f56 [2,0,0,0,0,0|2,0,0]=4 1195 B9R1.12 O=CCOc1c[nH]cn1 70217748d9d99784da867c7efa39800b [2,0,0,0,0,0|1,0,0]=3 1196 B9R1.12 O=CNCc1ccco1 500b938a7f3d3a911f6dbf809f17e808 [2,0,0,0,0,0|2,0,0]=4 1197 B9R1.12 O=CNCc1cccs1 fecfb8c88f46a0100ee636a1638f8376 [2,0,0,0,0,0|2,0,0]=4 1198 B9R1.12 O=CNCc1ccoc1 2c2ecd250ae8d80c965c3936a532f64f [2,0,0,0,0,0|2,0,0]=4 1199 B9R1.12 O=CNCc1ccon1 05a7c7357b01af9907ee2695fef4fb77 [2,0,0,0,0,0|2,0,0]=4 1200 B9R1.12 O=CNCc1ccsc1 71d20289537e24af987dd9a4d89d93c2 [2,0,0,0,0,0|2,0,0]=4 1201 B9R1.12 O=CNCc1ccsn1 444c9355991d0957139525c9d0279686 [2,0,0,0,0,0|2,0,0]=4 1202 B9R1.12 O=CNCc1cnco1 ee7ea837847f21c2df5abd28f3d73bda [2,0,0,0,0,0|1,0,1]=4 1203 B9R1.12 O=CNCc1cncs1 20afedbba0f28c6c3d07abf84cac939f [2,0,0,0,0,0|1,0,1]=4 1204 B9R1.12 O=CNCc1cocn1 42478e097d60710681f75d45a49c9050 [2,0,0,0,0,0|1,0,0]=3 1205 B9R1.12 O=CNCc1cscn1 41d80a5eda7e9f8599d0e415e67384b2 [2,0,0,0,0,0|1,0,0]=3 1206 B9R1.12 O=CNCc1ncco1 ae229f156f358694ec9fa8df5fdba020 [2,0,0,0,0,0|2,0,0]=4 1207 B9R1.12 O=CNCc1nccs1 d021f154403f9d3ac1cd2b03fa215329 [2,0,0,0,0,0|2,0,0]=4 1208 B11R1.4 BrCCNCCc1c[nH]cn1 214fe1312f093f04d187bab9d6270019 [1,1,0,0,0,0|0,0,1]=3 1209 B11R1.4 BrCCNCCc1cscn1 14be45d109f8b1547bbc0b2e8617f7a9 [1,1,0,0,0,0|1,0,1]=4 1210 B11R1.4 C#CCNCCc1c[nH]cn1 0c5a8f08d303dc1764806ef78bbac084 [1,1,0,0,0,0|0,0,2]=4 1211 B11R1.4 C/C=C/CNCc1c[nH]nn1 ae537e68ab6b98e9c6253fb5f0a988e1 [1,1,0,0,0,0|2,0,0]=4 1212 B11R1.4 C/C=C/CNCc1cc[nH]c1 60602a6469f4480f1ae69e16eb1e525f [1,1,0,0,0,0|2,0,0]=4 1213 B11R1.4 C/C=C/CNCc1cocn1 c6a91ba0c742ac9bb3bd2c08c483f548 [1,1,0,0,0,0|2,0,0]=4 1214 B11R1.4 C/C=C/CNCc1cscn1 12b8a301135974a22b86dff5e9f771ca [1,1,0,0,0,0|2,0,0]=4 1215 B11R1.4 C/C=C/COCc1cc[nH]c1 e6ac46971860494358f84dee6f6b6d2b [1,1,0,0,0,0|2,0,0]=4 1216 B11R1.4 C/C=C/COCc1cocn1 e9a086d5aebcacb31e05bac2493ecbd6 [1,1,0,0,0,0|2,0,0]=4 1217 B11R1.4 C/C=C/COCc1cscn1 eb2d04c54d268eda4069a2e45d58c55f [1,1,0,0,0,0|2,0,0]=4 1218 B11R1.4 C/C=C/COCc1nc[nH]n1 0060ca7ef1a2574504e21a5c15136a31 [1,1,0,0,0,0|2,0,0]=4 1219 B11R1.4 C/C=C\CNCc1c[nH]nn1 300d9a7f211f4075730c1a8cb05c2878 [1,1,0,0,0,0|2,0,0]=4 1220 B11R1.4 C/C=C\CNCc1cc[nH]c1 47a9877b4d8e6542946128dfedf03345 [1,1,0,0,0,0|2,0,0]=4 1221 B11R1.4 C/C=C\CNCc1cocn1 022b7b447ae11a1c26e42261e53439bd [1,1,0,0,0,0|2,0,0]=4 1222 B11R1.4 C/C=C\CNCc1cscn1 e03902e2e2731f11a972d555a7492f8d [1,1,0,0,0,0|2,0,0]=4 1223 B11R1.4 C/C=C\COCc1cc[nH]c1 e8fdfc3f516e436bb23f5e4a86329464 [1,1,0,0,0,0|2,0,0]=4 1224 B11R1.4 C/C=C\COCc1cocn1 890e521bf40d808f4227a005efedf28e [1,1,0,0,0,0|2,0,0]=4 1225 B11R1.4 C/C=C\COCc1cscn1 de0937b14a48b3aabddb77116e22bf02 [1,1,0,0,0,0|2,0,0]=4 1226 B11R1.4 C/C=C\COCc1nc[nH]n1 4910d05a74e0651acbecc129fbecb136 [1,1,0,0,0,0|2,0,0]=4 1227 B11R1.4 C=CCCCNc1c[nH]cn1 0bd0ad252593588817f497137c572533 [1,1,0,0,0,0|1,0,1]=4 1228 B11R1.4 C=CCCCOc1c[nH]cn1 8c6fef912c08ca5d049db98eed44ae42 [1,1,0,0,0,0|1,0,1]=4 1229 B11R1.4 C=CCNCCc1c[nH]cn1 2b0dcf3a623090494908dc7496e137a7 [1,1,0,0,0,0|0,0,1]=3 1230 B11R1.4 C=CCNCCc1cscn1 d9b0f5291d3503fb819a534dd9aa1057 [1,1,0,0,0,0|1,0,1]=4 1231 B11R1.4 C=CCOCCc1c[nH]cn1 89e58c3aeab147f072a7bf15c2551a0f [1,1,0,0,0,0|1,0,1]=4 1232 B11R1.4 C=COCCNc1c[nH]cn1 b6f448082c99825c36031284c2a9e37f [1,1,0,0,0,0|1,0,1]=4 1233 B11R1.4 CC/C=C/COc1c[nH]cn1 93779fed6b986225f9bd25ac646dd066 [1,1,0,0,0,0|2,0,0]=4 1234 B11R1.4 CC=CCNCc1cocn1 771bf96afc102be069ed7c0037f6245d [1,1,0,0,0,0|2,0,0]=4 1235 B11R1.4 CC=CCNCc1cscn1 586f255e5ebb0886409f2c2be2ec58b1 [1,1,0,0,0,0|2,0,0]=4 1236 B11R1.4 CC=CCNCc1nc[nH]n1 169162bb9f8e9a8425ad360b01aa5ccc [1,1,0,0,0,0|2,0,0]=4 1237 B11R1.4 CC=CCOCc1cocn1 e6a4fe4f4d343c796f659dbb6e0c47ce [1,1,0,0,0,0|2,0,0]=4 1238 B11R1.4 CC=CCOCc1cscn1 2a6eb2187e67fef99847620f649a9f3c [1,1,0,0,0,0|2,0,0]=4 1239 B11R1.4 CC=CCOCc1nc[nH]n1 3d62d2acdb334280260871e44fa29054 [1,1,0,0,0,0|2,0,0]=4 1240 B11R1.4 CCCCCNc1c[nH]cn1 b01a7065862deeeed0d6b4ab0d92cb4f [1,1,0,0,0,0|1,0,1]=4 1241 B11R1.4 CCCCCOc1c[nH]cn1 04b204461b754698acf232511926a4fb [1,1,0,0,0,0|1,0,1]=4 1242 B11R1.4 CCCNCCc1c[nH]cn1 b7f00a6a1372a16ef0e024ef22595d63 [1,1,0,0,0,0|0,0,1]=3 1243 B11R1.4 CCCNCCc1cscn1 29f669849f317b7ecbc34774cd24e763 [1,1,0,0,0,0|1,0,1]=4 1244 B11R1.4 CCCOCCc1c[nH]cn1 b153bf5049d0a5387dd8550da7bcdec7 [1,1,0,0,0,0|1,0,1]=4 1245 B11R1.4 CCNCCCc1c[nH]cn1 964cc9cc7a3784a0fd2b3bea5b2627fd [1,1,0,0,0,0|0,0,1]=3 1246 B11R1.4 CCOCCNc1c[nH]cn1 21a482199857c17b6c0442bc67dcbefd [1,1,0,0,0,0|1,0,1]=4 1247 B11R1.4 CCOCCOc1c[nH]cn1 b5322efc4d13345ba7c455c0c2ffa2aa [1,1,0,0,0,0|1,0,1]=4 1248 B11R1.4 CCSCCOc1c[nH]cn1 3f29bd6aef2a79356b95d64a29796001 [1,1,0,0,0,0|1,0,1]=4 1249 B11R1.4 COCCCNc1c[nH]cn1 4690f87c46396c4000ca4a22dd46d5f3 [1,1,0,0,0,0|2,0,0]=4 1250 B11R1.4 COCCCOc1c[nH]cn1 65068a29f5c1582135acb5b6715c546e [1,1,0,0,0,0|2,0,0]=4 1251 B11R1.4 COCNCCc1c[nH]cn1 9a88dc6a2ab6a7d66ec9eddc40961899 [1,1,0,0,0,0|0,0,1]=3 1252 B11R1.4 COCNCCc1cscn1 9ddb058d3133772eae465b3afb4355f2 [1,1,0,0,0,0|1,0,1]=4 1253 B11R1.4 COCOCCc1c[nH]cn1 6fcbe4c14c5ba24dfed665b43553ea94 [1,1,0,0,0,0|1,0,1]=4 1254 B11R1.4 CSCCCNc1c[nH]cn1 8ef70c9b07767162fc03a9dab8f5a750 [1,1,0,0,0,0|2,0,0]=4 1255 B11R1.4 CSCCCOc1c[nH]cn1 bf9a4caed1a4bcc29617d389401cb31d [1,1,0,0,0,0|2,0,0]=4 1256 B11R1.4 CSCNCCc1c[nH]cn1 56f9e493a17ecc4a3ecb62ef095ebc2b [1,1,0,0,0,0|0,0,1]=3 1257 B11R1.4 CSCNCCc1cscn1 f8617fb3fb5d1e106eb147ff88d0301c [1,1,0,0,0,0|1,0,1]=4 1258 B11R1.4 CSCOCCc1c[nH]cn1 28ba63414b90c4d86f11fd807bc57da2 [1,1,0,0,0,0|1,0,1]=4 1259 B11R1.4 FCCNCCc1c[nH]cn1 c04262d71458490a6630e23e9511a295 [1,1,0,0,0,0|0,0,1]=3 1260 B11R1.4 FCCNCCc1cscn1 cb6d17bf0c5768e752d1b39c5818322b [1,1,0,0,0,0|1,0,1]=4 1261 B11R1.4 FCCOCCc1c[nH]cn1 026cd78d47398ff87f3accfb46124d4e [1,1,0,0,0,0|1,0,1]=4 1262 B11R1.4 FCNCCCc1c[nH]cn1 c47cc90906cf9e1490932036c30bbce2 [1,1,0,0,0,0|1,0,1]=4 1263 B11R1.4 ICCNCCc1c[nH]cn1 46c07a44188f8b2bfc6be626e4d2c2a3 [1,1,0,0,0,0|0,0,1]=3 1264 B11R1.4 ICCNCCc1cscn1 a22570961ae5026044933e059bca2405 [1,1,0,0,0,0|1,0,1]=4 1265 B11R1.4 N#CCNCCc1c[nH]cn1 e3f4b36cadedf74248f6914cf8c0b12a [1,1,0,0,0,0|0,0,2]=4 1266 B11R1.4 O=CCCCNc1cocn1 1d99d975fe6631bfcd06489d0605297e [1,1,0,0,0,0|2,0,0]=4 1267 B11R1.4 O=CCCCNc1cscn1 f01ed4521f22fd12fc185df437a74f59 [1,1,0,0,0,0|2,0,0]=4 1268 B11R1.4 O=CCCCNc1nc[nH]n1 127dad37917348bf5b2a2f8ac509e750 [1,1,0,0,0,0|2,0,0]=4 1269 B11R1.4 O=CCCCOc1c[nH]cn1 348afb2e6dad050b0e38bb1bab3a900b [1,1,0,0,0,0|1,0,0]=3 1270 B11R1.4 O=CCCNCc1c[nH]nn1 85012732cf3d07fcc7edb0603416a548 [1,1,0,0,0,0|2,0,0]=4 1271 B11R1.4 O=CCCNCc1cc[nH]c1 4e27000da74d468ea76ecdf5c7dbc2ff [1,1,0,0,0,0|2,0,0]=4 1272 B11R1.4 O=CCCNCc1cocn1 a4dbcfe38224d5a4032a640a5d195fb1 [1,1,0,0,0,0|2,0,0]=4 1273 B11R1.4 O=CCCNCc1cscn1 54fb6f52d6646d21c08654a8b27159b5 [1,1,0,0,0,0|2,0,0]=4 1274 B11R1.4 O=CCCOCc1cc[nH]c1 8fb1639b68a41c895dc73fbaed35e1db [1,1,0,0,0,0|2,0,0]=4 1275 B11R1.4 O=CCCOCc1cocn1 33e42f236de91671b3c341ef264250f6 [1,1,0,0,0,0|2,0,0]=4 1276 B11R1.4 O=CCCOCc1cscn1 ea3f12d4d1ccafc55a80670b6c3eb087 [1,1,0,0,0,0|2,0,0]=4 1277 B11R1.4 O=CCCOCc1nc[nH]n1 60f3ea90d23c0c620c1e23896baae659 [1,1,0,0,0,0|2,0,0]=4 1278 B11R1.4 O=CCNCCc1c[nH]cn1 4af9e0ea209ce67e1127fd9bd343b064 [1,1,0,0,0,0|0,0,0]=2 1279 B11R1.4 O=CCNCCc1cc[nH]n1 2d68790bfecf50269c479d328292a7a0 [1,1,0,0,0,0|2,0,0]=4 1280 B11R1.4 O=CCNCCc1ccc[nH]1 c14e8bb3f1e339a28081dcc6b2429684 [1,1,0,0,0,0|1,0,1]=4 1281 B11R1.4 O=CCNCCc1ccco1 90b2f15652d4f7f338b7a0ecf82dcfed [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.4 O=CCNCCc1cccs1 4951a1e61692bd3cdcf9786dafeda551 [1,1,0,0,0,0|2,0,0]=4 1283 B11R1.4 O=CCNCCc1ccsc1 a7ec196204384e6c1ac36ee39b9c264b [1,1,0,0,0,0|2,0,0]=4 1284 B11R1.4 O=CCNCCc1cn[nH]c1 b84a205e968ce77413ca5ddda25e66be [1,1,0,0,0,0|2,0,0]=4 1285 B11R1.4 O=CCNCCc1cscn1 ccc31e8432e9844761a721b996be5db0 [1,1,0,0,0,0|1,0,0]=3 1286 B11R1.4 O=CCNCCc1ncc[nH]1 5cd85a2a679fb94fecc58a7fa1f611a9 [1,1,0,0,0,0|2,0,0]=4 1287 B11R1.4 O=CCNCCc1nccs1 a9e14046161fad6d82d049d858a292c0 [1,1,0,0,0,0|2,0,0]=4 1288 B11R1.4 O=CCNCCn1cccn1 1a685f25330534818b95045d940bcbe9 [1,1,0,0,0,0|2,0,0]=4 1289 B11R1.4 O=CCNCCn1cncn1 92fb53d3dbc6cef34a25f5bfa5b7358b [1,1,0,0,0,0|1,0,1]=4 1290 B11R1.4 O=CCOCCc1c[nH]cn1 d7abcf4a847ec7bf1bc3728e1e3f5efa [1,1,0,0,0,0|1,0,0]=3 1291 B11R1.4 O=CCOCCc1cscn1 e36a507fd589fb89431c2c6149773c7d [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.4 O=CNCCCc1ccco1 981b26f66e868917ac721bcbb2fc6c44 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.4 O=CNCCCc1cccs1 c2fe476b5ab713278a8b507ae6f64f04 [1,1,0,0,0,0|2,0,0]=4 1294 B11R1.4 O=CNCCCn1cccn1 e8b887951e6a1ca602e7077dc75dcd14 [1,1,0,0,0,0|2,0,0]=4 1295 B11R1.4 O=CNCCCn1cncn1 c2f71000ca6ce9cdfdc554dc313154bd [1,1,0,0,0,0|1,0,1]=4 1296 B11R1.4 OCCNCCc1c[nH]cn1 7265fa602cc3fd239fa763186f7ee489 [1,1,0,0,0,0|0,0,1]=3 1297 B11R1.4 OCCNCCc1cscn1 f1bcea372efdae7f654524cc1729d29b [1,1,0,0,0,0|1,0,1]=4 1298 B11R1.4 OCNCCCc1c[nH]cn1 c43622a38316abb5398debd7be93d47b [1,1,0,0,0,0|0,0,2]=4 1299 B11R1.4 SCCNCCc1c[nH]cn1 6ebfd1982a2e6ceb7ca49d458cf68d88 [1,1,0,0,0,0|0,0,1]=3 1300 B11R1.4 SCCNCCc1cscn1 6924c314bd6a8f410e7781f72515b2ee [1,1,0,0,0,0|1,0,1]=4 1301 B11R1.4 SCCOCCc1c[nH]cn1 4acdc1eec2a35737728987391ce73925 [1,1,0,0,0,0|1,0,1]=4 1302 B11R1.25 CCN(C)CCc1c[nH]cn1 6d06ee2cf4ac187e9996d3f73566a236 [1,1,0,0,0,0|0,0,1]=3 1303 B11R1.25 CCN(C)CCc1cscn1 76be0f92bc1b84a0ed347bab3fa7389a [1,1,0,0,0,0|1,0,1]=4 1304 B11R1.25 CN(C=O)CCc1cccs1 2d56ad68d9909e2002ac43c88c0f1e93 [1,1,0,0,0,0|2,0,0]=4 1305 B11R1.27 C/C=C/CNc1cn(cn1)C 5a3d746f0d87f8d4ad6fe89b51b105c0 [1,1,0,0,0,0|2,0,0]=4 1306 B11R1.27 C/C=C\CNc1cn(cn1)C f3498257e4a0463f6f7368686ffaa358 [1,1,0,0,0,0|2,0,0]=4 1307 B11R1.27 CC=CCNc1c[nH]c(n1)C 04a830e6a5b12a13de599bce0bf0ef91 [1,1,0,0,0,0|2,0,0]=4 1308 B11R1.27 CC=CCNc1c[nH]c(n1)N 5dc42004a745140bccf45d76b12943be [1,1,0,0,0,0|2,0,0]=4 1309 B11R1.27 CC=CCNc1cn(cn1)C 581c1734433904ec672104f6bb32c88d [1,1,0,0,0,0|2,0,0]=4 1310 B11R1.27 CCNCCc1cn(cn1)C 4d1a7eb5558775f23f913631273ff7f0 [1,1,0,0,0,0|0,0,1]=3 1311 B11R1.27 CCNCCc1cn(nn1)C 96cf1be2ce4d59a1c02674dbc3e62897 [1,1,0,0,0,0|1,0,1]=4 1312 B11R1.27 CCNCCc1csc(n1)C 5156e21f8d58d9ee47a166d40c504bce [1,1,0,0,0,0|1,0,1]=4 1313 B11R1.27 Cc1ccc(o1)CCNC=O f8759a731ab1164b69d2907134afa90f [1,1,0,0,0,0|2,0,0]=4 1314 B11R1.27 Cc1ccc(s1)CCNC=O 41e961793edb8e4c98abb50a640ebe62 [1,1,0,0,0,0|2,0,0]=4 1315 B11R1.27 Cc1ccn(n1)CCNC=O 26224f005e6b31d0803e5ca7c0f3622f [1,1,0,0,0,0|2,0,0]=4 1316 B11R1.27 Cc1cnc(o1)CCNC=O c4ce25eb3556aa936801049a828c5f30 [1,1,0,0,0,0|2,0,0]=4 1317 B11R1.27 Cc1cnn(c1)CCNC=O f9f38bac1748396b09c8729833ed49e6 [1,1,0,0,0,0|2,0,0]=4 1318 B11R1.27 Cc1csc(n1)CCNC=O fed7e6dd5d211b5fb55e96e4e5a1af0f [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.27 Cc1nc(c[nH]1)CNCC=O ba0c2669bd70856f0873676e6b4c317e [1,1,0,0,0,0|2,0,0]=4 1320 B11R1.27 Cc1nc(c[nH]1)COCC=O d098ef3d69f8aa2119671aaa2909c08f [1,1,0,0,0,0|2,0,0]=4 1321 B11R1.27 Cc1nc(cs1)CCNC=O 796986ca8aea4599c853b69fd2769bcf [1,1,0,0,0,0|1,0,0]=3 1322 B11R1.27 Cn1cc(cn1)CCNC=O e8e8821b77276ec206400e0aa544bad7 [1,1,0,0,0,0|2,0,0]=4 1323 B11R1.27 Cn1cc(nn1)CCNC=O 3e12b79a461ab13df8944392504bca0e [1,1,0,0,0,0|1,0,0]=3 1324 B11R1.27 Cn1ccc(n1)CCNC=O 40eff944d1d7209e1d178892450a1e9b [1,1,0,0,0,0|2,0,0]=4 1325 B11R1.27 Cn1cnc(c1)CCNC=O 0f5fe10b57b74f2ff81b983756201ab9 [1,1,0,0,0,0|0,0,0]=2 1326 B11R1.27 Cn1cnc(c1)CCNCF 53843ac14fa0f6d8780be00f6efb3830 [1,1,0,0,0,0|1,0,1]=4 1327 B11R1.27 Cn1cnc(c1)CCNCO 8fd26eeccdfd0be7736864d0ea0617a8 [1,1,0,0,0,0|0,0,2]=4 1328 B11R1.27 Cn1cnc(c1)CNCC=O c0720f250b3d6c1489dbbedeff3593e8 [1,1,0,0,0,0|2,0,0]=4 1329 B11R1.27 Cn1cnc(c1)COCC=O f75a1e738665367bdc71d0062896e3a1 [1,1,0,0,0,0|2,0,0]=4 1330 B11R1.27 Cn1cnc(c1)NCCC=O e54d7889a273b893f5ecf40234b92890 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.27 O=CNCCc1ccc(s1)Br ee1507ea50188bf15bd354cd4d764203 [1,1,0,0,0,0|2,0,0]=4 1332 B11R1.27 O=CNCCn1cc(cn1)Br e291e5663b1cc4d816b188f6a1586729 [1,1,0,0,0,0|2,0,0]=4 1333 B11R1.27 O=CNCCn1cc(cn1)Cl 4deb9d43a57389c1821c13344d29c2f9 [1,1,0,0,0,0|2,0,0]=4 1334 B11R1.27 O=CNCCn1cc(cn1)F 24bb532e21c0bab44e9a0819ec3d8ccb [1,1,0,0,0,0|2,0,0]=4 1335 B11R1.27 O=CNCCn1cc(cn1)I 5538e888a2ab7aa7c050332b29b2747d [1,1,0,0,0,0|2,0,0]=4 1336 B11R1.29 CC(CNC=O)n1cccn1 7f18b1977d8377b7d0da37c38004cf30 [1,1,0,0,0,0|2,0,0]=4 1337 B11R1.29 CC(CNC=O)n1cncn1 dd4d42d13c9db625309567da3e1f4885 [1,1,0,0,0,0|1,0,1]=4 1338 B11R1.29 O=CNCC(O)c1ccco1 6bc0d1377efb6eaf73117839a38c77b5 [1,1,0,0,0,0|2,0,0]=4 1339 B11R1.29 O=CNCC(O)c1cccs1 9875a03e15a5e7655b6105fa64131dec [1,1,0,0,0,0|2,0,0]=4 1340 B11R1.30 CC(Cc1c[nH]cn1)NCF c9d2f9d6ef1da8f7cb90caf4c7f4cd7f [1,1,0,0,0,0|1,0,1]=4 1341 B11R1.30 CC(Cc1c[nH]cn1)NCO 46ca993ab9eae68eeb0dc9e1984db9fd [1,1,0,0,0,0|0,0,2]=4 1342 B11R1.30 CC(Cc1ccco1)NC=O bf69bf05946b0a12a5fc0dc718f62f91 [1,1,0,0,0,0|2,0,0]=4 1343 B11R1.30 CC(Cc1ccsc1)NC=O a20af09521ac0318d7193662d877d12c [1,1,0,0,0,0|2,0,0]=4 1344 B11R1.30 CC(Cn1cccn1)NC=O a04c012b04b836b9efb11c4805223dab [1,1,0,0,0,0|2,0,0]=4 1345 B11R1.30 CC(Cn1cncn1)NC=O 37343b272792cb65acd767d9158d490e [1,1,0,0,0,0|1,0,1]=4 1346 B11R1.30 CCNC(C)Cc1c[nH]cn1 890adc82d4ddb1d850124c26f5e2d212 [1,1,0,0,0,0|0,0,1]=3 1347 B11R1.30 CCN[C@@H](C)Cc1c[nH]cn1 9a181267ba59ccaafbc8207412e20465 [1,1,0,0,0,0|0,0,1]=3 1348 B11R1.30 CCN[C@H](C)Cc1c[nH]cn1 213cc2413d44b8115606eef751860d0c [1,1,0,0,0,0|0,0,1]=3 1349 B11R1.30 C[C@@H](Cc1c[nH]cn1)NCF c846081c97f755d07ffb50154dc6ec48 [1,1,0,0,0,0|1,0,1]=4 1350 B11R1.30 C[C@@H](Cc1c[nH]cn1)NCO 29b7fc80cd7187f053922c5e8e737091 [1,1,0,0,0,0|0,0,2]=4 1351 B11R1.30 C[C@H](Cc1c[nH]cn1)NCF b82e4cdd1242381d051680295d828dc7 [1,1,0,0,0,0|1,0,1]=4 1352 B11R1.30 C[C@H](Cc1c[nH]cn1)NCO fb52c3bc5e2756882f34f420fb22e33b [1,1,0,0,0,0|0,0,2]=4 1353 B11R1.180 CC=CCNc1nc[nH]c1C 3f4c034cecf84ec56c72ea237d71d291 [1,1,0,0,0,0|2,0,0]=4 1354 B11R1.180 Cc1[nH]cnc1CNCC=O 4435fffcb42fadd5b79559551dae0309 [1,1,0,0,0,0|2,0,0]=4 1355 B11R1.180 Cc1[nH]cnc1COCC=O 77aff6093083037bb5dd5f994c2ce977 [1,1,0,0,0,0|2,0,0]=4 1356 B11R1.180 Cc1ccsc1CCNC=O face3e688d3bcb97c791ad679777e4f8 [1,1,0,0,0,0|2,0,0]=4 1357 B11R1.180 Cc1ncsc1CCNC=O 306e67493ea2ae5971f9c8dc133f4fd0 [1,1,0,0,0,0|1,0,1]=4 1358 B11R1.180 Cn1cccc1CCNC=O d3239d1298f1c704eb8fbad4005e928f [1,1,0,0,0,0|1,0,1]=4 1359 B11R1.180 Cn1ccnc1CCNC=O eee622d91781bcbd359afc4333c26fc9 [1,1,0,0,0,0|2,0,0]=4 1360 B11R1.180 O=CNCCc1ccsc1Br 4caef2d97f2dd9abaf24e8516c170477 [1,1,0,0,0,0|2,0,0]=4 1361 B11R1.35 CC(=O)C(C)Nc1cocn1 6817ff68c31034e0169670a66aea4cfd [0,1,0,0,1,0|2,0,0]=4 1362 B11R1.35 CC(=O)C(C)Nc1cscn1 1782a2ac16f7b60d8d8280c635128f5a [0,1,0,0,1,0|2,0,0]=4 1363 B11R1.35 CC(=O)C(C)Nc1nc[nH]n1 6db3ad6562e307897e205a2484dbac2e [0,1,0,0,1,0|2,0,0]=4 1364 B11R1.35 CC(=O)C(C)Oc1c[nH]cn1 ff154e84df5be6126ad7296dcdda4d34 [0,1,0,0,1,0|1,0,0]=3 1365 B11R1.35 CC(=O)N(C)Cc1ccco1 595130f102a13741ef8c5e6d70797c2c [0,1,0,0,1,0|2,0,0]=4 1366 B11R1.35 CC(=O)N(C)Cc1cccs1 0772ccd40fb0e419289038500ce1ac59 [0,1,0,0,1,0|2,0,0]=4 1367 B11R1.35 CC(=O)N(C)Cc1ccoc1 5cbb32d1835ea7ec1049d53c7ac44884 [0,1,0,0,1,0|2,0,0]=4 1368 B11R1.35 CC(=O)N(C)Cc1ccsc1 823f62cacd71cae7b515ff7fa707b235 [0,1,0,0,1,0|2,0,0]=4 1369 B11R1.35 CC(=O)N(C)Cc1cncs1 6583c908276bf2b2de03b941c6c544c5 [0,1,0,0,1,0|1,0,1]=4 1370 B11R1.35 CC(=O)N(C)Cc1ncco1 03c185527acb051596e25be641bafa58 [0,1,0,0,1,0|2,0,0]=4 1371 B11R1.35 CC(=O)N(C)Cc1nccs1 94ddf6672d43a9a3d00ecd27fbe0a253 [0,1,0,0,1,0|2,0,0]=4 1372 B11R1.35 CC(Nc1c[nH]cn1)C(=O)N 113e790154c5dc1b39fe6636456ae58b [0,1,0,0,1,0|2,0,0]=4 1373 B11R1.35 CC(Oc1c[nH]cn1)C(=O)N 29be5edabcaf740a90fc832940753354 [0,1,0,0,1,0|2,0,0]=4 1374 B11R1.35 CC(Oc1c[nH]cn1)C(=O)O dbb2c01a0ba87e181d7242792aa42b10 [0,1,0,0,1,0|2,0,0]=4 1375 B11R1.35 C[C@@H](Nc1c[nH]cn1)C(=O)N ca263924826933be3edb69bc1b04ff64 [0,1,0,0,1,0|2,0,0]=4 1376 B11R1.35 C[C@@H](Oc1c[nH]cn1)C(=O)N 90c1ce460ed0355ee90c0a175426da41 [0,1,0,0,1,0|2,0,0]=4 1377 B11R1.35 C[C@@H](Oc1c[nH]cn1)C(=O)O ba9315c77565d829b4a0aae3ec5ef969 [0,1,0,0,1,0|2,0,0]=4 1378 B11R1.35 C[C@H](Nc1c[nH]cn1)C(=O)N ca161898589bf019b0614fe13983f126 [0,1,0,0,1,0|2,0,0]=4 1379 B11R1.35 C[C@H](Oc1c[nH]cn1)C(=O)N 9b58fdd5d32c92a6c2fe146b42105b5e [0,1,0,0,1,0|2,0,0]=4 1380 B11R1.35 C[C@H](Oc1c[nH]cn1)C(=O)O effd76e4bdd4ea74bca4131092d0baec [0,1,0,0,1,0|2,0,0]=4 1381 B11R1.35 NC(=O)C(F)Oc1c[nH]cn1 1fb2ba64c7ad4eefd4f4daae8137fb8d [0,1,0,0,1,0|2,0,0]=4 1382 B11R1.35 O=C(O)C(F)Oc1c[nH]cn1 61fbd857b8e69f534c7fee0b9a5d05da [0,1,0,0,1,0|2,0,0]=4 1383 B11R1.35 O=C(O)[C@H](F)Oc1c[nH]cn1 eab0b815f3385c3e77b7487f9ba7205c [0,1,0,0,1,0|2,0,0]=4 1384 B11R1.75 C=C(C)CNc1c[nH]c(n1)N 4866d8ea0acf0db7b85d24ce0704eedb [0,1,0,0,1,0|2,0,0]=4 1385 B11R1.75 C=C(C)CNc1cn(cn1)C ed060c7c508ee25ad50dab0962c1234e [0,1,0,0,1,0|2,0,0]=4 1386 B11R1.75 CC(=O)CNc1c[nH]c(n1)N da7f05433e13466abacd85b438f66ab2 [0,1,0,0,1,0|1,0,0]=3 1387 B11R1.75 CC(=O)CNc1cn(cn1)C d019be0b128da512935f98524ec75bfa [0,1,0,0,1,0|1,0,0]=3 1388 B11R1.75 CC(=O)CNc1coc(n1)N b9e0b4459c225ffdacc09eac55c537bc [0,1,0,0,1,0|2,0,0]=4 1389 B11R1.75 CC(=O)CNc1csc(n1)N 670e1214cae16efa0e35ab019cb56a45 [0,1,0,0,1,0|2,0,0]=4 1390 B11R1.75 CC(=O)NCc1cc(co1)C c264239ea631634196e8ffbc272a6263 [0,1,0,0,1,0|2,0,0]=4 1391 B11R1.75 CC(=O)NCc1cc(cs1)Br f821fa34e12e09cd1e600dc31015c2eb [0,1,0,0,1,0|2,0,0]=4 1392 B11R1.75 CC(=O)NCc1cc(cs1)C 0d4b575a1b11cb6ea4b4be7c6d495674 [0,1,0,0,1,0|2,0,0]=4 1393 B11R1.75 CC(=O)NCc1cc(cs1)Cl 3a2517ce3e79620b78862bd11b65a507 [0,1,0,0,1,0|2,0,0]=4 1394 B11R1.75 CC(=O)NCc1cc(on1)C 47e01145468070a6948ba2a9f3c33435 [0,1,0,0,1,0|2,0,0]=4 1395 B11R1.75 CC(=O)NCc1cc(sn1)Br ae8cb576e4e1ad66bc2d02d70a7dbdb3 [0,1,0,0,1,0|2,0,0]=4 1396 B11R1.75 CC(=O)NCc1ccc(o1)Br 6e710dbc8a7ab5ca5f302eac2d542d29 [0,1,0,0,1,0|2,0,0]=4 1397 B11R1.75 CC(=O)NCc1ccc(o1)C b13cd0bd40ca6cf6e3c39d68d12bdda4 [0,1,0,0,1,0|2,0,0]=4 1398 B11R1.75 CC(=O)NCc1ccc(s1)Br ef690d997add5e800fffb852f10def11 [0,1,0,0,1,0|2,0,0]=4 1399 B11R1.75 CC(=O)NCc1ccc(s1)C fbe57bc2ff3d0b0d111a80584c69c601 [0,1,0,0,1,0|2,0,0]=4 1400 B11R1.75 CC(=O)NCc1ccc(s1)Cl 8946dbc6989b3b104bd57098260101ef [0,1,0,0,1,0|2,0,0]=4 1401 B11R1.75 CC(=O)NCc1ccc(s1)F c9981b70a243f88d2eb4fb9ce9558f87 [0,1,0,0,1,0|2,0,0]=4 1402 B11R1.75 CC(=O)NCc1ccn(n1)C 9c7726a559ff94859d378348f5cedd5c [0,1,0,0,1,0|2,0,0]=4 1403 B11R1.75 CC(=O)NCc1cn(cn1)C fc0c1bb0ffb8b35be6e2cf440ac8d967 [0,1,0,0,1,0|0,0,0]=2 1404 B11R1.75 CC(=O)NCc1cn(nn1)C 12c2ac3ee95f52c7445e2863e724a063 [0,1,0,0,1,0|1,0,0]=3 1405 B11R1.75 CC(=O)NCc1cnc(o1)C c884235d974f23eff843a6ec5da668ea [0,1,0,0,1,0|1,0,1]=4 1406 B11R1.75 CC(=O)NCc1cnc(s1)Br f1cf6ace0e9592d1484a8dbaa052e1ae [0,1,0,0,1,0|1,0,1]=4 1407 B11R1.75 CC(=O)NCc1cnc(s1)C b73e1aa9a71048ee3690df81db487142 [0,1,0,0,1,0|1,0,1]=4 1408 B11R1.75 CC(=O)NCc1cnc(s1)Cl 7d2d9761c556b27c25cd7bcb9fe984c2 [0,1,0,0,1,0|1,0,1]=4 1409 B11R1.75 CC(=O)NCc1cnn(c1)C f3254dcc9f7706798861d1e816ba8feb [0,1,0,0,1,0|2,0,0]=4 1410 B11R1.75 CC(=O)NCc1coc(n1)C f68086b8999937e17da266e4f80df767 [0,1,0,0,1,0|1,0,0]=3 1411 B11R1.75 CC(=O)NCc1csc(c1)Br 25d212c98737f32c95cd9f989e3c66f1 [0,1,0,0,1,0|2,0,0]=4 1412 B11R1.75 CC(=O)NCc1csc(c1)Cl 4e85ec7c6bd728ce7a81f9aeeb6b5ce6 [0,1,0,0,1,0|2,0,0]=4 1413 B11R1.75 CC(=O)NCc1csc(n1)Br 2fe72f13d7a047cef5ff1aed1ba7470a [0,1,0,0,1,0|1,0,0]=3 1414 B11R1.75 CC(=O)NCc1csc(n1)C c8f56a84ab8a5c807766e5951d1f100b [0,1,0,0,1,0|1,0,0]=3 1415 B11R1.75 CC(=O)NCc1csc(n1)Cl 1dede6422f7721b80462854645c31b2f [0,1,0,0,1,0|1,0,0]=3 1416 B11R1.75 CC(=O)NCc1nc(co1)C 25f1ce64520e2a8b20381c6ab0be5921 [0,1,0,0,1,0|2,0,0]=4 1417 B11R1.75 CC(=O)NCc1nc(cs1)Br 80a1a3d1da1476ffa02a41a2404f4ce3 [0,1,0,0,1,0|2,0,0]=4 1418 B11R1.75 CC(=O)NCc1nc(cs1)C 87b0edd5d9a1977001e05c17b02118c6 [0,1,0,0,1,0|2,0,0]=4 1419 B11R1.75 CC(=O)NCc1nc(cs1)Cl e548b052ec0f7549568e87d25256d1ff [0,1,0,0,1,0|2,0,0]=4 1420 B11R1.75 CC(=O)NCc1ncc(o1)Br 3d04f7f69b69ebfc9b082258a32470e6 [0,1,0,0,1,0|2,0,0]=4 1421 B11R1.75 CC(=O)NCc1ncc(o1)C b96c864fd9d090130791d073abfa9d4e [0,1,0,0,1,0|2,0,0]=4 1422 B11R1.75 CC(=O)NCc1ncc(s1)C c20c2d441d54f13e01b71caf6b20d1c5 [0,1,0,0,1,0|2,0,0]=4 1423 B11R1.75 CC(=O)NCc1ncc(s1)Cl 5a89206349512354a19b74e866e48ee7 [0,1,0,0,1,0|2,0,0]=4 1424 B11R1.75 CC(=O)NCc1ncn(n1)C 83f0447cd584ad78569a263bbb65b81f [0,1,0,0,1,0|1,0,0]=3 1425 B11R1.75 CC(=O)NCc1noc(n1)C fba32cb6cc3399af62351270c58948f5 [0,1,0,0,1,0|2,0,0]=4 1426 B11R1.75 CC(C)NCc1cn(cn1)C 1c37fb4f023fffba8e06170efa6e80d5 [0,1,0,0,1,0|1,0,1]=4 1427 B11R1.75 Cc1nc(c[nH]1)CNC(C)C 8cf3d9aaceb557c78336ea7b21ac44cf [0,1,0,0,1,0|1,0,1]=4 1428 B11R1.75 Cn1cnc(c1)NCC(=O)N 0008fb20c456b893020a6646a281d18a [0,1,0,0,1,0|2,0,0]=4 1429 B11R1.75 Cn1cnc(c1)NCC(=O)O 2921fffcf280c914c4951231b5f2f0e6 [0,1,0,0,1,0|2,0,0]=4 1430 B11R1.75 NC(=O)CNc1c[nH]c(n1)N 6fc844874aef5852ea51ee29ff79abdc [0,1,0,0,1,0|2,0,0]=4 1431 B11R1.77 CC(=O)NC(C)c1ccco1 c1f414cbe29927a43c5ea82bc1066b08 [0,1,0,0,1,0|2,0,0]=4 1432 B11R1.77 CC(=O)NC(C)c1cccs1 e7ae72928c15ab3e748d7e1c8cf72906 [0,1,0,0,1,0|2,0,0]=4 1433 B11R1.77 CC(=O)NC(C)c1ccoc1 f05fb1ac4899069c33da6b59ba925378 [0,1,0,0,1,0|2,0,0]=4 1434 B11R1.77 CC(=O)NC(C)c1ccon1 0ca964294da6ae6106779874e1c2e2f0 [0,1,0,0,1,0|2,0,0]=4 1435 B11R1.77 CC(=O)NC(C)c1ccsc1 b5322239eb2b3ea576be5e9c37a82962 [0,1,0,0,1,0|2,0,0]=4 1436 B11R1.77 CC(=O)NC(C)c1cncs1 cb797d456b50b3aec89e981e775568b5 [0,1,0,0,1,0|1,0,1]=4 1437 B11R1.77 CC(=O)NC(C)c1cscn1 bf490a05719af0dacf6079b03b5c06ba [0,1,0,0,1,0|1,0,0]=3 1438 B11R1.77 CC(=O)NC(C)c1ncco1 fd525221588f8253603eb6525149d065 [0,1,0,0,1,0|2,0,0]=4 1439 B11R1.77 CC(=O)NC(C)c1nccs1 0a448acc08f5cf357cfb71fa073e12ba [0,1,0,0,1,0|2,0,0]=4 1440 B11R1.77 CC(=O)N[C@@H](C)c1cccs1 b818cd586259681e42d14261ef748959 [0,1,0,0,1,0|2,0,0]=4 1441 B11R1.77 CC(=O)N[C@@H](C)c1ccoc1 e1ec52bf4cf96dc7f38f0bf9b1ce980a [0,1,0,0,1,0|2,0,0]=4 1442 B11R1.77 CC(=O)N[C@@H](C)c1ccsc1 a37c11f7f4aa2f992f5f64350aa3a346 [0,1,0,0,1,0|2,0,0]=4 1443 B11R1.77 CC(=O)N[C@@H](C)c1cncs1 31cdc634b839f967cbdc0644b2b6f9de [0,1,0,0,1,0|1,0,1]=4 1444 B11R1.77 CC(=O)N[C@@H](C)c1nccs1 a2ddac4b6d3dfec46922786d18b57837 [0,1,0,0,1,0|2,0,0]=4 1445 B11R1.77 CC(=O)N[C@H](C)c1ccco1 b21b5fa102dd5d98ec9d9b39f45da936 [0,1,0,0,1,0|2,0,0]=4 1446 B11R1.77 CC(=O)N[C@H](C)c1cccs1 f815dc1cf41a56fe27ec577f5b868185 [0,1,0,0,1,0|2,0,0]=4 1447 B11R1.77 CN(CC(=O)N)c1c[nH]cn1 5b9db9ce53a9187fec167a4971aafa62 [0,1,0,0,1,0|2,0,0]=4 1448 B11R1.90 CC(=O)CNc1nc[nH]c1C a323939d9deaefc2e9a0dccc9533e3ce [0,1,0,0,1,0|1,0,0]=3 1449 B11R1.90 CC(=O)NCc1cccn1C c151d1f61aa9cd59abb8cce6e932be56 [0,1,0,0,1,0|1,0,1]=4 1450 B11R1.90 CC(=O)NCc1ccoc1C d4bf342ef095f84c20b4b56088d719c3 [0,1,0,0,1,0|2,0,0]=4 1451 B11R1.90 CC(=O)NCc1ccsc1Br be7751e3a80880d5b038d55245e9d1d3 [0,1,0,0,1,0|2,0,0]=4 1452 B11R1.90 CC(=O)NCc1cncn1C 29854fad683d3dbe89e1694fa8b6fea2 [0,1,0,0,1,0|0,0,2]=4 1453 B11R1.90 CC(=O)NCc1nccn1C 77e32c6fa27f08a1c2c3d9ffa5da6e3a [0,1,0,0,1,0|2,0,0]=4 1454 B11R1.90 CC(=O)NCc1ncnn1C 41f292363e0e82bbab32a457d480dd4d [0,1,0,0,1,0|1,0,1]=4 1455 B11R1.90 CC(=O)NCc1ncoc1C 45d2d5362019d7f10f1974d937ea79ad [0,1,0,0,1,0|1,0,0]=3 1456 B11R1.90 CC(=O)NCc1nocc1C 6c27413e56b465c6f7e15dd994363f1f [0,1,0,0,1,0|2,0,0]=4 1457 B11R1.90 CC(=O)NCc1nonc1C bd56036f340350fcb7a7da522d2a5215 [0,1,0,0,1,0|1,0,1]=4 1458 B11R1.90 CC(=O)NCc1occc1C 6dcfcfae995904333b31ef08b1e3652a [0,1,0,0,1,0|2,0,0]=4 1459 B11R1.90 CC(=O)NCc1sccc1Br aa8241562c41a8b68afd8977c5e634b3 [0,1,0,0,1,0|2,0,0]=4 1460 B11R1.90 CC(=O)NCc1sccc1Cl 469e4ea001d68b0cdcf3b2b0e26a3aef [0,1,0,0,1,0|2,0,0]=4 1461 B11R1.90 CC(=O)NCc1sccc1F b59507f5337bd9b9f20d21f304068893 [0,1,0,0,1,0|2,0,0]=4 1462 B11R1.90 CC(=O)NCc1scnc1Br 93689180a97bbc7a2baafc901e4f42cc [0,1,0,0,1,0|1,0,1]=4 1463 B11R1.90 CC(=O)NCc1scnc1C 589e78d4eb9f0a6d802bb730d38ce454 [0,1,0,0,1,0|1,0,1]=4 1464 B11R1.90 Cc1[nH]cnc1CNC(C)C e64a9d7d520c74b97a3325691d27e2d9 [0,1,0,0,1,0|1,0,1]=4 1465 B11R1.510 CS(=O)(=O)COc1c[nH]cn1 52e3078bc6432469c496fa0b4ed4bd8b [0,1,0,0,1,0|2,0,0]=4 1466 B13R1.45 CC(=O)NCC(C)c1ccccc1 605838f13626664b2f33081202ec2bc5 [0,1,0,0,0,1|2,0,0]=4 1467 B13R1.45 CC(=O)NCC(O)c1ccccc1 338fd8ffb5a5b3263ec1b7d66185bbe1 [0,1,0,0,0,1|2,0,0]=4 1468 B13R1.45 CC(=O)NCC(O)c1ccccn1 c375421136f21f2463522a716f5ae893 [0,1,0,0,0,1|1,0,0]=3 1469 B13R1.45 CC(=O)NCC(O)c1cccnc1 432a247dfbe746a7d6c7c86aec2b6614 [0,1,0,0,0,1|1,0,0]=3 1470 B13R1.45 CC(=O)NCC(O)c1ccncc1 950e7b24efba883117c1d27ba0033ae1 [0,1,0,0,0,1|1,0,1]=4 1471 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 3c11938df208c26416c9256f7ea627c2 [0,1,0,0,0,1|2,0,0]=4 1472 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 63185760d23ecc3a7db9fda738b2ead6 [0,1,0,0,0,1|2,0,0]=4 1473 B13R1.45 CC(=O)NC[C@H](C)c1ccccc1 5bf75215a0ba164735bf6fc81e4e8b22 [0,1,0,0,0,1|2,0,0]=4 1474 B13R1.45 CC(=O)NC[C@H](O)c1ccccc1 1a789d2dbdb75e4d6d04d7189c08238f [0,1,0,0,0,1|2,0,0]=4 1475 B13R1.149 CC(=O)CCNc1cc[nH]c(=O)n1 f8e33966146b9cf3f6421036da464ccf [0,1,0,0,0,1|2,0,0]=4 1476 B13R1.149 CC(=O)CCNc1cn[nH]c(=O)n1 13a0c29192121de2fa5f056b720e0211 [0,1,0,0,0,1|2,0,0]=4 1477 B13R1.149 CC(=O)CCNc1nc[nH]c(=O)n1 353b66377a1587b0c8f42193bb691005 [0,1,0,0,0,1|2,0,0]=4 1478 B13R1.149 CC(=O)NCCc1cccc(c1)Br 8202131f3aa3263a92393847e2e5c11e [0,1,0,0,0,1|2,0,0]=4 1479 B13R1.149 CC(=O)NCCc1cccc(c1)C 04fcba57b515841f1f1d9a044ec6473c [0,1,0,0,0,1|2,0,0]=4 1480 B13R1.149 CC(=O)NCCc1cccc(c1)Cl d1d03190e0c04e944f92fbae168d6388 [0,1,0,0,0,1|2,0,0]=4 1481 B13R1.149 CC(=O)NCCc1cccc(c1)F 193a0bdbef44d9aa6cc7fc807fc9b2f1 [0,1,0,0,0,1|2,0,0]=4 1482 B13R1.149 CC(=O)NCCc1cccc(c1)I d0de4b155688f488d78e5c6ac7692103 [0,1,0,0,0,1|2,0,0]=4 1483 B13R1.149 CC(=O)NCCc1cccc(c1)O c926c4963477095ca6de2d98b4084a6e [0,1,0,0,0,1|2,0,0]=4 1484 B13R1.149 CC(=O)NCCc1cccc(n1)C d4af43807ce62dbd6667fdb38cb4556a [0,1,0,0,0,1|1,0,0]=3 1485 B13R1.149 CC(=O)NCCc1ccnc(c1)C 1a78be0134983529bbd5e6eed4dba960 [0,1,0,0,0,1|1,0,1]=4 1486 B13R1.149 CC(=O)NCCc1cncc(c1)F 826c07592c0163fab9ee4420317fe93f [0,1,0,0,0,1|1,0,0]=3 1487 B13R1.149 CC(=O)OCNc1cc[nH]c(=O)n1 bd454cc0432dbd7b6d4a090327378bc4 [0,1,0,0,0,1|2,0,0]=4 1488 B13R1.149 CC(=O)OCNc1cn[nH]c(=O)n1 9bcaf7af8b3c2453c52f1ad0a1fbd746 [0,1,0,0,0,1|2,0,0]=4 1489 B13R1.149 CC(=O)OCNc1nc[nH]c(=O)n1 2383b53eb8604b18d69be63a0dfce777 [0,1,0,0,0,1|2,0,0]=4 1490 B13R1.158 CC(=O)CCNc1c[nH]cnc1=O 999b4aaee8c0747e97b77e14ecdbae15 [0,1,0,0,0,1|2,0,0]=4 1491 B13R1.158 CC(=O)CCOc1c[nH]cnc1=O a718f0f51356897993742f5a51c936ff [0,1,0,0,0,1|2,0,0]=4 1492 B13R1.158 CC(=O)NCCc1ccccc1Br 414c42bc6a30fed988c730129553d9e2 [0,1,0,0,0,1|2,0,0]=4 1493 B13R1.158 CC(=O)NCCc1ccccc1C b4606f09098b64d9a25eb82a936db50b [0,1,0,0,0,1|2,0,0]=4 1494 B13R1.158 CC(=O)NCCc1ccccc1Cl 57235090bd0f2738bb4b9f80028e7402 [0,1,0,0,0,1|2,0,0]=4 1495 B13R1.158 CC(=O)NCCc1ccccc1F 07dfbf064513a293f98d23feae25991d [0,1,0,0,0,1|2,0,0]=4 1496 B13R1.158 CC(=O)NCCc1ccccc1O eb5602a4fb6d80eb4b340e466746dc41 [0,1,0,0,0,1|2,0,0]=4 1497 B13R1.158 CC(=O)NCCc1ncccc1Br 374ae28439bcde66856236919a65e735 [0,1,0,0,0,1|1,0,0]=3 1498 B13R1.158 CC(=O)NCCc1ncccc1C 3f397de82cf784f420f6a7b59558b06b [0,1,0,0,0,1|1,0,0]=3 1499 B13R1.158 CC(=O)NCCn1ncccc1=O ec6dc50a46e9ab4db798f92b3d491dfb [0,1,0,0,0,1|2,0,0]=4 1500 B13R1.158 CC(=O)OCNc1c[nH]cnc1=O 8ee60002808032eacae0fd5c488a3f83 [0,1,0,0,0,1|2,0,0]=4 1501 B13R1.158 CC(=O)OCOc1c[nH]cnc1=O d43f6d8a394da51a2b6fa488ce10e016 [0,1,0,0,0,1|2,0,0]=4 1502 B13R1.348 CC(=O)NC(C)Cc1ccccn1 2a33bb1a2db0d29dc689b065e03e6778 [0,1,0,0,0,1|1,0,0]=3 1503 B13R1.348 CC(=O)NC(C)Cc1cccnc1 7ef0d19688269a0edc79ab83a719012c [0,1,0,0,0,1|1,0,0]=3 1504 B13R1.348 CC(=O)NC(C)Cc1ccncc1 934c4429ea38def8798ce158dfd7db0e [0,1,0,0,0,1|1,0,1]=4 1505 B13R1.348 CC(=O)NC(C)Cc1cnccn1 5afa02c5731346e347efba3a4a7cc125 [0,1,0,0,0,1|0,0,1]=3 1506 B13R1.351 CC(=O)N(C)CCc1ccccc1 9469c367d1a70a79856a46b178f0d450 [0,1,0,0,0,1|2,0,0]=4 1507 B13R1.351 CC(=O)N(C)CCc1ccccn1 28bad44297d658a472891d82560dce93 [0,1,0,0,0,1|1,0,0]=3 1508 B13R1.351 CC(=O)N(C)CCc1cccnc1 b4c72e492250a171a413ae03e11bbe4b [0,1,0,0,0,1|1,0,0]=3 1509 B13R1.351 CC(=O)N(C)CCc1ccncc1 222ef2fc402298684edb8f1ad046f5fb [0,1,0,0,0,1|1,0,1]=4 1510 B13R1.513 CC(=O)CCNc1cnc(=O)[nH]c1 147865a234e26293e43dab021a4c1437 [0,1,0,0,0,1|2,0,0]=4 1511 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 2cc4881ea9242d2e44ff570bb37d2650 [0,1,0,0,0,1|2,0,0]=4 1512 B13R1.513 CC(=O)NCCc1ccc(cc1)C da725421b190aa6a16673cb3be0680d5 [0,1,0,0,0,1|2,0,0]=4 1513 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl f9a823ec8d391334b2bd601a1bc4caee [0,1,0,0,0,1|2,0,0]=4 1514 B13R1.513 CC(=O)NCCc1ccc(cc1)F ca0bc7959144760b108c788e7e580a73 [0,1,0,0,0,1|2,0,0]=4 1515 B13R1.513 CC(=O)NCCc1ccc(cc1)I bc040422debbf93a7cef01a88de4b9dc [0,1,0,0,0,1|2,0,0]=4 1516 B13R1.513 CC(=O)NCCc1ccc(cc1)O 52c317afed0f03f4a45dbc4ae1d4a51e [0,1,0,0,0,1|2,0,0]=4 1517 B13R1.513 CC(=O)NCCc1ccc(cn1)Br 9b6a81fde97541582fcc907062ae8e65 [0,1,0,0,0,1|1,0,0]=3 1518 B13R1.513 CC(=O)NCCc1ccc(nc1)Br 3c92df369e36fe4e3bf2479e3e56f8ab [0,1,0,0,0,1|1,0,0]=3 1519 B13R1.513 CC(=O)NCCc1ccc(nc1)C c28834a5f3e5c3774f940f066b737e8d [0,1,0,0,0,1|1,0,0]=3 1520 B13R1.513 CC(=O)NCCc1ccc(nc1)Cl 16f06dd84004a9e83535c3c82471e9f4 [0,1,0,0,0,1|1,0,0]=3 1521 B13R1.513 CC(=O)NCCc1cnc(cn1)C d859bd968bfded2d88add6791e3cf706 [0,1,0,0,0,1|0,0,1]=3 1522 B13R1.513 CC(=O)NCCc1cnc(nc1)Cl 2be8b46ea5763c16b8449eb31212dc4c [0,1,0,0,0,1|0,0,1]=3 1523 B13R1.513 CC(=O)OCNc1cnc(=O)[nH]c1 e6ac57d104eafff92e3034863ef47078 [0,1,0,0,0,1|2,0,0]=4 1524 B13R1.718 C#CC(=O)NCCc1ccccn1 b1d2bda725a24f23fd76080381e2c339 [0,1,0,0,0,1|1,0,1]=4 1525 B13R1.718 C#CC(=O)NCCc1cccnc1 fb69fa02c3f485882c43ffacf542d8cb [0,1,0,0,0,1|1,0,1]=4 1526 B13R1.718 C#CC(=O)NCCc1ccncn1 cb615ef889cdc75d19ca0793687a6d36 [0,1,0,0,0,1|0,0,2]=4 1527 B13R1.718 C#CC(=O)NCCc1cnccn1 9c5ce4a83e5bd2b2efd7e9009c424eb4 [0,1,0,0,0,1|0,0,2]=4 1528 B13R1.718 C#CC(=O)NCCc1ncccn1 91277befc9687fe5f8a0cd444e924b0a [0,1,0,0,0,1|1,0,1]=4 1529 B13R1.718 C=CC(=O)NCCc1ccccn1 cf0e126ee3a96b6a1f02143e4afc9c18 [0,1,0,0,0,1|1,0,1]=4 1530 B13R1.718 C=CC(=O)NCCc1cccnc1 14430439abd4aac7280581fe57d8a5dd [0,1,0,0,0,1|1,0,1]=4 1531 B13R1.718 C=CC(=O)NCCc1ccncn1 8317ea604412260d65283338e1fc75a0 [0,1,0,0,0,1|0,0,2]=4 1532 B13R1.718 C=CC(=O)NCCc1cnccn1 1950195daad180078369648f1561027c [0,1,0,0,0,1|0,0,2]=4 1533 B13R1.718 C=CC(=O)NCCc1ncccn1 b7fb8050ecb3ac44557f43453376b9bb [0,1,0,0,0,1|1,0,1]=4 1534 B13R1.718 CC(C=O)NCCc1ccccn1 bb61eba4dab3d84b63c0644b0add725c [0,1,0,0,0,1|1,0,1]=4 1535 B13R1.718 CC(C=O)NCCc1cccnc1 662cc1caeb8e88b5cd6fab2008086675 [0,1,0,0,0,1|1,0,1]=4 1536 B13R1.718 CC(C=O)NCCc1ccncn1 1e81c60b0b5316267afbc7eb9ab31110 [0,1,0,0,0,1|0,0,2]=4 1537 B13R1.718 CC(C=O)NCCc1cnccn1 49d90d042da0286d527de87e6a62e593 [0,1,0,0,0,1|0,0,2]=4 1538 B13R1.718 CC(C=O)NCCc1ncccn1 d081442b64dc7caa297f9b0aa5d546d9 [0,1,0,0,0,1|1,0,1]=4 1539 B13R1.718 CCC(=O)NCCc1ccccc1 5d7fd1b17306dee08da5fe69e0aad8af [0,1,0,0,0,1|2,0,0]=4 1540 B13R1.718 CCC(=O)NCCc1ccccn1 8ff236b760dbcab6c961d04aef4daa87 [0,1,0,0,0,1|1,0,0]=3 1541 B13R1.718 CCC(=O)NCCc1cccnc1 1d09c254c28e535106dd788f27f21fc0 [0,1,0,0,0,1|1,0,0]=3 1542 B13R1.718 CCC(=O)NCCc1ccncc1 f85569835255162aafb6fa996ca40c6e [0,1,0,0,0,1|1,0,1]=4 1543 B13R1.718 CCC(=O)NCCc1ccncn1 169c22832199f1232a27fed3d65db1ce [0,1,0,0,0,1|0,0,1]=3 1544 B13R1.718 CCC(=O)NCCc1cnccn1 8e7b478c8fddad20021e54d0b0fccb37 [0,1,0,0,0,1|0,0,1]=3 1545 B13R1.718 CCC(=O)NCCc1ncccn1 4a4fe222276c027ffc692816dd889bfe [0,1,0,0,0,1|1,0,0]=3 1546 B13R1.718 C[C@H](C=O)NCCc1ccccn1 c977a8364ba24cc1d61310fcbf27fa2a [0,1,0,0,0,1|1,0,1]=4 1547 B13R1.718 C[C@H](C=O)NCCc1cccnc1 27cb005d06195dc85ecf0f3b31adf25f [0,1,0,0,0,1|1,0,1]=4 1548 B13R1.718 C[C@H](C=O)NCCc1ccncn1 d73f764ddb2aa22c1dc4ed82e51cb6ae [0,1,0,0,0,1|0,0,2]=4 1549 B13R1.718 C[C@H](C=O)NCCc1cnccn1 dcd4dac9ab59cb6c0763e4d429bd3882 [0,1,0,0,0,1|0,0,2]=4 1550 B13R1.718 C[C@H](C=O)NCCc1ncccn1 3a53d6f5ce0b96b2b579db258ecc3336 [0,1,0,0,0,1|1,0,1]=4 1551 B13R1.718 O=C(CF)NCCc1ccccc1 f900d87f98238c5feff53bf05fdf5016 [0,1,0,0,0,1|2,0,0]=4 1552 B13R1.718 O=C(CF)NCCc1ccccn1 50d92d1bfd960be51534e45157ac7563 [0,1,0,0,0,1|1,0,0]=3 1553 B13R1.718 O=C(CF)NCCc1cccnc1 f912cf2c4f074227d6e423310a425132 [0,1,0,0,0,1|1,0,0]=3 1554 B13R1.718 O=C(CF)NCCc1ccncc1 e55986fc3032a4e43d81352f6950ef8c [0,1,0,0,0,1|1,0,1]=4 1555 B13R1.718 O=C(CF)NCCc1ccncn1 891311fc0332e48563c1afead5532cd5 [0,1,0,0,0,1|0,0,1]=3 1556 B13R1.718 O=C(CF)NCCc1cnccn1 329cc45858705bab29a58de0634bfbeb [0,1,0,0,0,1|0,0,1]=3 1557 B13R1.718 O=C(CF)NCCc1ncccn1 2cf0dc9faba4d6e92b52a6492a67652c [0,1,0,0,0,1|1,0,0]=3 1558 B13R1.718 O=C(CO)NCCc1ccccc1 f13a088047fed9c1f5f150212711bedf [0,1,0,0,0,1|2,0,0]=4 1559 B13R1.718 O=C(CO)NCCc1ccccn1 456df6a075b8bafd16fed309d27cf7e8 [0,1,0,0,0,1|1,0,0]=3 1560 B13R1.718 O=C(CO)NCCc1cccnc1 3eae8ddd9e0e51d578592e13c720b936 [0,1,0,0,0,1|1,0,0]=3 1561 B13R1.718 O=C(CO)NCCc1ccncc1 a5dc1800c86bc7664416aea89f1fa49e [0,1,0,0,0,1|1,0,1]=4 1562 B13R1.718 O=C(CO)NCCc1ccncn1 fcf92e590fc39f66f8a5e425dc947aa3 [0,1,0,0,0,1|0,0,1]=3 1563 B13R1.718 O=C(CO)NCCc1cnccn1 8d4c97f104da89cd62eade279119faef [0,1,0,0,0,1|0,0,1]=3 1564 B13R1.718 O=C(CO)NCCc1ncccn1 1a48f33b7ecd12149980ad7cf0c4d20f [0,1,0,0,0,1|1,0,0]=3 1565 B13R1.718 O=C(CS)NCCc1ccccc1 8a319e6418c994c74d21a416016099d2 [0,1,0,0,0,1|2,0,0]=4 1566 B13R1.718 O=C(CS)NCCc1ccccn1 df755efe53bd0a7791f4a7df524a8b3a [0,1,0,0,0,1|1,0,0]=3 1567 B13R1.718 O=C(CS)NCCc1cccnc1 8e058d56bbfc6a71981d83b6e82147c4 [0,1,0,0,0,1|1,0,0]=3 1568 B13R1.718 O=C(CS)NCCc1ccncc1 37d178a8c4828a58e3dd04b3fdda093e [0,1,0,0,0,1|1,0,1]=4 1569 B13R1.718 O=C(CS)NCCc1ccncn1 b9aa97df1539052d2ff52d6f99df4b50 [0,1,0,0,0,1|0,0,1]=3 1570 B13R1.718 O=C(CS)NCCc1cnccn1 3eeda47b89cf580ae8bcf488694cc256 [0,1,0,0,0,1|0,0,1]=3 1571 B13R1.718 O=C(CS)NCCc1ncccn1 ccd86879a73eb1e16150813ca31e7a00 [0,1,0,0,0,1|1,0,0]=3 1572 B13R1.718 O=CC(=O)NCCc1ccccn1 584c5d9e3e93bc5cef2a239dda201cae [0,1,0,0,0,1|1,0,1]=4 1573 B13R1.718 O=CC(=O)NCCc1cccnc1 fa52c4cffb1a504f4cd08fcf72cbbb96 [0,1,0,0,0,1|1,0,1]=4 1574 B13R1.718 O=CC(=O)NCCc1ccncn1 cb5f9e1d58a4110b4d7e1deed602384d [0,1,0,0,0,1|0,0,2]=4 1575 B13R1.718 O=CC(=O)NCCc1cnccn1 2c6901cb1cac3d4970f335a139f1343d [0,1,0,0,0,1|0,0,2]=4 1576 B13R1.718 O=CC(=O)NCCc1ncccn1 96dc0f58a1986728cf4acb05876dfa01 [0,1,0,0,0,1|1,0,1]=4 1577 B13R1.128 C/C(=C/CNCc1c[nH]c(n1)C)/I 39fa0633294385e0afabc80fd868c06a [0,1,0,0,0,1|2,0,0]=4 1578 B13R1.128 C/C(=C/CNCc1cn(cn1)C)/I 7b8d1495ab56f0f697c0e7b5f37219a0 [0,1,0,0,0,1|2,0,0]=4 1579 B13R1.128 C/C(=C/COCc1c[nH]c(n1)C)/I 21ded01709c6d49ff57e109250416e63 [0,1,0,0,0,1|2,0,0]=4 1580 B13R1.128 C/C(=C/COCc1cn(cn1)C)/I bfb38e960f1fa855f37359dfbdec70e6 [0,1,0,0,0,1|2,0,0]=4 1581 B13R1.128 C/C(=C\CNCc1c[nH]c(n1)C)/Cl ac10ae58248fc71d45c236339e0fc7f3 [0,1,0,0,0,1|2,0,0]=4 1582 B13R1.128 C/C(=C\CNCc1cn(cn1)C)/Cl 2f2706327298f1ae46d0172e1b765c45 [0,1,0,0,0,1|2,0,0]=4 1583 B13R1.128 C/C(=C\COCc1c[nH]c(n1)C)/Cl 77ff690b13f8cbb3c7961adaa61df5d9 [0,1,0,0,0,1|2,0,0]=4 1584 B13R1.128 C/C(=C\COCc1cn(cn1)C)/Cl 6816da26384c8aafd1c898782298747b [0,1,0,0,0,1|2,0,0]=4 1585 B13R1.128 C=C(Br)CNCCc1cn(cn1)C 03980806964cea9c037a5f01c1326212 [0,1,0,0,0,1|1,0,1]=4 1586 B13R1.128 C=C(C)CCCNc1cn(cn1)C b90531aff02bcf79a6590abc4484baf4 [0,1,0,0,0,1|2,0,0]=4 1587 B13R1.128 C=C(C)CCNCc1c[nH]c(n1)C 762c499f18308a6749f6c4258a6f51b3 [0,1,0,0,0,1|2,0,0]=4 1588 B13R1.128 C=C(C)CCNCc1cn(cn1)C 94f2b0a3e136523e78e6d09e855457da [0,1,0,0,0,1|2,0,0]=4 1589 B13R1.128 C=C(C)CCOCc1c[nH]c(n1)C 5af834eeb9b0805e8bc5f80d2b91590d [0,1,0,0,0,1|2,0,0]=4 1590 B13R1.128 C=C(C)CCOCc1cn(cn1)C 5b97c8c65235d67cf3b0d67f57cd0d43 [0,1,0,0,0,1|2,0,0]=4 1591 B13R1.128 C=C(C)CNCCc1cn(cn1)C c100df1e96ce4913cc5a59ba7f06f962 [0,1,0,0,0,1|1,0,0]=3 1592 B13R1.128 C=C(C)CNCCc1cn(nn1)C d0b434f1a8219549b85ca517adf7cc25 [0,1,0,0,0,1|2,0,0]=4 1593 B13R1.128 C=C(C)CNCCc1csc(n1)C 8c6ee2b2e04050348177dd4038fb5d65 [0,1,0,0,0,1|2,0,0]=4 1594 B13R1.128 C=C(Cl)CNCCc1cn(cn1)C 33ab87fbefd6e1a9e4f51c971fa977f9 [0,1,0,0,0,1|1,0,1]=4 1595 B13R1.128 C=C(F)CNCCc1cn(cn1)C 274224a538da69d80db6d70b2164ac80 [0,1,0,0,0,1|1,0,1]=4 1596 B13R1.128 CC(=CCCNc1cn(cn1)C)C ce204051f77b63f44a07e7a51c1dc5d1 [0,1,0,0,0,1|2,0,0]=4 1597 B13R1.128 CC(=CCNCc1c[nH]c(n1)C)C fb38daba0852a3dbcfcc4c8af1806619 [0,1,0,0,0,1|2,0,0]=4 1598 B13R1.128 CC(=CCNCc1c[nH]c(n1)C)Cl b6d1b04c913c88ab6926b93b06655ef1 [0,1,0,0,0,1|2,0,0]=4 1599 B13R1.128 CC(=CCNCc1c[nH]c(n1)C)I 7b2bea31932551657327f42d2d7b8e1a [0,1,0,0,0,1|2,0,0]=4 1600 B13R1.128 CC(=CCNCc1cn(cn1)C)C b9f97bbb8c1aecc55b434955fd2117b9 [0,1,0,0,0,1|2,0,0]=4 1601 B13R1.128 CC(=CCNCc1cn(cn1)C)Cl 9b0d1b33d25af5f41baf11ac61c3bab0 [0,1,0,0,0,1|2,0,0]=4 1602 B13R1.128 CC(=CCNCc1cn(cn1)C)I 8ffe278ee7e7703486ee10c7ad30ab97 [0,1,0,0,0,1|2,0,0]=4 1603 B13R1.128 CC(=CCOCc1c[nH]c(n1)C)C 5953861ff712cb3871c04344bead457a [0,1,0,0,0,1|2,0,0]=4 1604 B13R1.128 CC(=CCOCc1c[nH]c(n1)C)Cl ae624fd05c491dad216f45b90241db3e [0,1,0,0,0,1|2,0,0]=4 1605 B13R1.128 CC(=CCOCc1c[nH]c(n1)C)I 95046ce41115691aabcf5e6f84691909 [0,1,0,0,0,1|2,0,0]=4 1606 B13R1.128 CC(=CCOCc1cn(cn1)C)C a2e05abb0092ee90d926a655efb8f801 [0,1,0,0,0,1|2,0,0]=4 1607 B13R1.128 CC(=CCOCc1cn(cn1)C)Cl ff4f668ec55b703efc9a3a33ab5ebf16 [0,1,0,0,0,1|2,0,0]=4 1608 B13R1.128 CC(=CCOCc1cn(cn1)C)I 781ec97c1f6d219c9ea20cdf2aaa6e24 [0,1,0,0,0,1|2,0,0]=4 1609 B13R1.128 CC(=O)CCCNc1cn(cn1)C 73a45c458c209c3be0a4b2db37da5356 [0,1,0,0,0,1|1,0,0]=3 1610 B13R1.128 CC(=O)CCCNc1cn(nn1)C 8623f2612fe89ddf7c73825b9088e1f6 [0,1,0,0,0,1|2,0,0]=4 1611 B13R1.128 CC(=O)CCCNc1csc(n1)Br 9049446819eb4170a4ed5355f424c1e7 [0,1,0,0,0,1|2,0,0]=4 1612 B13R1.128 CC(=O)CCCNc1n[nH]c(n1)Br f72a032ab23cd329ff8d9ee90981263c [0,1,0,0,0,1|2,0,0]=4 1613 B13R1.128 CC(=O)CCCNc1n[nH]c(n1)S 4eed0038c4a471b28e3c1eb8844ac10c [0,1,0,0,0,1|2,0,0]=4 1614 B13R1.128 CC(=O)CCCNc1ncn(n1)C 6726e760dc612a0a858fba0633916b4e [0,1,0,0,0,1|2,0,0]=4 1615 B13R1.128 CC(=O)CCCOc1n[nH]c(n1)C 053728593a541c66929a7f8103bd7d4e [0,1,0,0,0,1|2,0,0]=4 1616 B13R1.128 CC(=O)CCNCc1c[nH]c(n1)C 886a6af347818c8c44d7fdbd09a98014 [0,1,0,0,0,1|1,0,0]=3 1617 B13R1.128 CC(=O)CCNCc1cn(cn1)C a3b0216439a155cf9478d798e320f0b9 [0,1,0,0,0,1|1,0,0]=3 1618 B13R1.128 CC(=O)CCNCc1cn(nn1)C 10c3a95caad6c6383568e93118f01e83 [0,1,0,0,0,1|2,0,0]=4 1619 B13R1.128 CC(=O)CCNCc1coc(n1)C 89ba7985c36da5d29fe52af39efd98a2 [0,1,0,0,0,1|2,0,0]=4 1620 B13R1.128 CC(=O)CCNCc1csc(n1)Br 9177f4cc080107aa3aea7a911ac94208 [0,1,0,0,0,1|2,0,0]=4 1621 B13R1.128 CC(=O)CCNCc1csc(n1)C df6b394bc3b7bea5f41826a412577fa6 [0,1,0,0,0,1|2,0,0]=4 1622 B13R1.128 CC(=O)CCNCc1csc(n1)Cl e8e4786098072e4ead563d30f33a676e [0,1,0,0,0,1|2,0,0]=4 1623 B13R1.128 CC(=O)CCNCc1ncn(n1)C 2706fcf94c230077388618c37ec7f06d [0,1,0,0,0,1|2,0,0]=4 1624 B13R1.128 CC(=O)CCOCc1c[nH]c(n1)C 6002b5a4ae560891ca7302e58bf5a841 [0,1,0,0,0,1|1,0,0]=3 1625 B13R1.128 CC(=O)CCOCc1ccn(c1)C 9d4aab4e8501253a500a7e799bb1f976 [0,1,0,0,0,1|2,0,0]=4 1626 B13R1.128 CC(=O)CCOCc1cn(cn1)C 70d0c04ed42434decd04f4013dcc13ad [0,1,0,0,0,1|1,0,0]=3 1627 B13R1.128 CC(=O)CCOCc1cn(nn1)C 25a80528695cf06e5897d65554e207ff [0,1,0,0,0,1|2,0,0]=4 1628 B13R1.128 CC(=O)CCOCc1coc(n1)Br 11a64f2795563ad505143d464e317698 [0,1,0,0,0,1|2,0,0]=4 1629 B13R1.128 CC(=O)CCOCc1coc(n1)C 370c00d612631fd993d0dcf2d6a28d74 [0,1,0,0,0,1|2,0,0]=4 1630 B13R1.128 CC(=O)CCOCc1coc(n1)Cl 911fb4bc8829ce419bfea85d560f9cd7 [0,1,0,0,0,1|2,0,0]=4 1631 B13R1.128 CC(=O)CCOCc1csc(n1)Br 52940ac85748f983292396107fae3c3f [0,1,0,0,0,1|2,0,0]=4 1632 B13R1.128 CC(=O)CCOCc1csc(n1)C ca23200518388c95dcd9a16d6355169b [0,1,0,0,0,1|2,0,0]=4 1633 B13R1.128 CC(=O)CCOCc1csc(n1)Cl f39f03dd348e35513c5276815947d496 [0,1,0,0,0,1|2,0,0]=4 1634 B13R1.128 CC(=O)CCOCc1nc(=S)[nH][nH]1 607cbe817836ecd88187543834b3091a [0,1,0,0,0,1|2,0,0]=4 1635 B13R1.128 CC(=O)CCOCc1ncn(n1)C 655433c1c185bab543e9a5c78a7e1399 [0,1,0,0,0,1|2,0,0]=4 1636 B13R1.128 CC(=O)CNCCc1cnn(c1)C 80d0081eee46fd4d218c88e5d7a2f9f2 [0,1,0,0,0,1|2,0,0]=4 1637 B13R1.128 CC(=O)CNCCc1csc(n1)C a9f1eb494efa809b65f2e2e0d5b457ee [0,1,0,0,0,1|1,0,0]=3 1638 B13R1.128 CC(=O)CNCCn1cc(cn1)C 1f96dfb48320ebd53eec0acb8be5792d [0,1,0,0,0,1|2,0,0]=4 1639 B13R1.128 CC(=O)CNCCn1cc(cn1)Cl 161e310d6aecd1f2146c753fff4f8b5f [0,1,0,0,0,1|2,0,0]=4 1640 B13R1.128 CC(=O)CNCCn1cc(cn1)F 8cb94e39b36453864bd6dfec9fbe99af [0,1,0,0,0,1|2,0,0]=4 1641 B13R1.128 CC(=O)CNCCn1ccc(n1)C bcd37b3bdd29f0d255f3eb6f110474a3 [0,1,0,0,0,1|2,0,0]=4 1642 B13R1.128 CC(=O)COCCc1csc(n1)C d29632a417c03bbfb13fe03ba778b75d [0,1,0,0,0,1|2,0,0]=4 1643 B13R1.128 CC(=O)NCCCc1ccc(s1)C 4ec77f30528aa1f3643e41b9aa98e0e4 [0,1,0,0,0,1|2,0,0]=4 1644 B13R1.128 CC(=O)NCCCc1cnn(c1)C 9fb254d95e5c0d58c24e10690695743a [0,1,0,0,0,1|2,0,0]=4 1645 B13R1.128 CC(=O)NCCCn1cc(cn1)Br 9e8a99938c7283f2d3a616667c6d0412 [0,1,0,0,0,1|2,0,0]=4 1646 B13R1.128 CC(=O)NCCCn1cc(cn1)C 92e3bbdc2387203e0c6c560aedc8279a [0,1,0,0,0,1|2,0,0]=4 1647 B13R1.128 CC(=O)NCCNc1c[nH]c(n1)N 2c5618e2ff95a9f05354cb755e0825b8 [0,1,0,0,0,1|0,0,0]=2 1648 B13R1.128 CC(=O)NCCNc1cc(=O)[nH]o1 281665408f7f78240af4ab2f1f8cc373 [0,1,0,0,0,1|2,0,0]=4 1649 B13R1.128 CC(=O)NCCNc1cc([nH]n1)Br ef539106774d09d579e20f9a1d525ecd [0,1,0,0,0,1|2,0,0]=4 1650 B13R1.128 CC(=O)NCCNc1cc([nH]n1)C 66927cb57c28483e75019d3862c89197 [0,1,0,0,0,1|2,0,0]=4 1651 B13R1.128 CC(=O)NCCNc1cc([nH]n1)F 7ce9c56ea20c5d5130d7bff6ececc1e9 [0,1,0,0,0,1|2,0,0]=4 1652 B13R1.128 CC(=O)NCCNc1cc(co1)C 5e23a09dc0b5c004057aad5ce17881f6 [0,1,0,0,0,1|2,0,0]=4 1653 B13R1.128 CC(=O)NCCNc1cc(on1)C e47c5896673688b44cf0e3b40af2cc52 [0,1,0,0,0,1|2,0,0]=4 1654 B13R1.128 CC(=O)NCCNc1cc(sn1)Br 1a67da81a988e448191c484fdb5fff45 [0,1,0,0,0,1|2,0,0]=4 1655 B13R1.128 CC(=O)NCCNc1ccc(o1)C def3660471a4e5545e1d643df11368b5 [0,1,0,0,0,1|2,0,0]=4 1656 B13R1.128 CC(=O)NCCNc1ccc(s1)Br ffb4b7b9ca07412ef278d0a50bb591bd [0,1,0,0,0,1|2,0,0]=4 1657 B13R1.128 CC(=O)NCCNc1ccc(s1)C 8d2a8d654ecdd309b5bf296b6e654e34 [0,1,0,0,0,1|2,0,0]=4 1658 B13R1.128 CC(=O)NCCNc1ccc(s1)F f715abe126c2c5eec52ba19f20538dd5 [0,1,0,0,0,1|2,0,0]=4 1659 B13R1.128 CC(=O)NCCNc1ccc(s1)O 42b20e28bf9433d7f6326ed39514d501 [0,1,0,0,0,1|2,0,0]=4 1660 B13R1.128 CC(=O)NCCNc1ccn(c1)C 33fff0dfef4bd649e0c7c48cff245dad [0,1,0,0,0,1|1,0,0]=3 1661 B13R1.128 CC(=O)NCCNc1ccn(n1)C 06812bdf59bc216534b0cb5a5295d748 [0,1,0,0,0,1|2,0,0]=4 1662 B13R1.128 CC(=O)NCCNc1cn(cn1)C db4e3a701c728bc5862027218776db93 [0,1,0,0,0,1|0,0,0]=2 1663 B13R1.128 CC(=O)NCCNc1cn(nn1)C 983510dbe9cac161b3bef0ac8765de05 [0,1,0,0,0,1|1,0,0]=3 1664 B13R1.128 CC(=O)NCCNc1cnc(o1)C c2e437518b4413c7a81bf3da2019de36 [0,1,0,0,0,1|1,0,1]=4 1665 B13R1.128 CC(=O)NCCNc1cnc(s1)Br c79e71ac37816c7af5f898fe3d185681 [0,1,0,0,0,1|1,0,1]=4 1666 B13R1.128 CC(=O)NCCNc1cnc(s1)C d6f195c5567bf0e87e0e7093eb8b03d7 [0,1,0,0,0,1|1,0,1]=4 1667 B13R1.128 CC(=O)NCCNc1cnc(s1)N 45b0803e1bf555d3bc91c65c88aaec13 [0,1,0,0,0,1|1,0,1]=4 1668 B13R1.128 CC(=O)NCCNc1cnc(s1)S d3de9f17a06e87cdc1c5d8bf9d9d20f0 [0,1,0,0,0,1|1,0,1]=4 1669 B13R1.128 CC(=O)NCCNc1cnn(c1)C 46b5e4b0ed09b2dfae2f780714f337cb [0,1,0,0,0,1|2,0,0]=4 1670 B13R1.128 CC(=O)NCCNc1cnn(n1)C d8e11a3382962bde4c4aede8e358f5ed [0,1,0,0,0,1|1,0,1]=4 1671 B13R1.128 CC(=O)NCCNc1coc(n1)N ba653acd24279120b953d0da0f0bec48 [0,1,0,0,0,1|1,0,0]=3 1672 B13R1.128 CC(=O)NCCNc1csc(c1)C 5056b63f2b27cd1e46741d485127bc21 [0,1,0,0,0,1|2,0,0]=4 1673 B13R1.128 CC(=O)NCCNc1csc(n1)Br 1c998020d9a00aea3693fbc741fd7c25 [0,1,0,0,0,1|1,0,0]=3 1674 B13R1.128 CC(=O)NCCNc1csc(n1)N ab93a623b648928205b6146cb6634678 [0,1,0,0,0,1|1,0,0]=3 1675 B13R1.128 CC(=O)NCCNc1n[nH]c(=O)[nH]1 edcec4215102b8d2c1be4335b6a7f567 [0,1,0,0,0,1|1,0,1]=4 1676 B13R1.128 CC(=O)NCCNc1n[nH]c(n1)Br dc99f0fedac1ec9dc9c97cddb11ae352 [0,1,0,0,0,1|1,0,0]=3 1677 B13R1.128 CC(=O)NCCNc1n[nH]c(n1)S d83e24b56b1156f17c761b61f3cf8925 [0,1,0,0,0,1|1,0,0]=3 1678 B13R1.128 CC(=O)NCCNc1nc(=S)ss1 e6cbb1c69ae0ea73c711f2c7b1e28f12 [0,1,0,0,0,1|2,0,0]=4 1679 B13R1.128 CC(=O)NCCNc1nc(c[nH]1)Br ebf31199587a7505800d565b3f53d472 [0,1,0,0,0,1|2,0,0]=4 1680 B13R1.128 CC(=O)NCCNc1nc(co1)Br fc9567ffd5858ae09125070e5560c11f [0,1,0,0,0,1|2,0,0]=4 1681 B13R1.128 CC(=O)NCCNc1nc(co1)C 5ce35272f088b12504a1ef528db5aac1 [0,1,0,0,0,1|2,0,0]=4 1682 B13R1.128 CC(=O)NCCNc1nc(cs1)Br 4307991cd0d319b7b6941c7273d29b90 [0,1,0,0,0,1|2,0,0]=4 1683 B13R1.128 CC(=O)NCCNc1nc(cs1)C 04dbb1c99de02306ef8c587dc07e5802 [0,1,0,0,0,1|2,0,0]=4 1684 B13R1.128 CC(=O)NCCNc1nc(cs1)Cl c843dbf0b8b45644752847c75a947a89 [0,1,0,0,0,1|2,0,0]=4 1685 B13R1.128 CC(=O)NCCNc1nc(n[nH]1)C 84798bc044bf1265007effb39684a893 [0,1,0,0,0,1|1,0,1]=4 1686 B13R1.128 CC(=O)NCCNc1nc(n[nH]1)Cl deea426eee00ac6a3702459b292817a9 [0,1,0,0,0,1|1,0,1]=4 1687 B13R1.128 CC(=O)NCCNc1nc(no1)C 8d76b26f243a26a8afc5bdd44a894686 [0,1,0,0,0,1|1,0,1]=4 1688 B13R1.128 CC(=O)NCCNc1nc(ns1)Br 583c5c0e9763935f6ceb44f9ed05b548 [0,1,0,0,0,1|1,0,1]=4 1689 B13R1.128 CC(=O)NCCNc1nc(ns1)C fa88e2aa91cf6e3d70381ebec00b9481 [0,1,0,0,0,1|1,0,1]=4 1690 B13R1.128 CC(=O)NCCNc1nc(ns1)Cl 0185051a58abc9bf56d93a5cca7c031c [0,1,0,0,0,1|1,0,1]=4 1691 B13R1.128 CC(=O)NCCNc1ncc([nH]1)C 5afc583b9f72805c62537bada47ca4be [0,1,0,0,0,1|2,0,0]=4 1692 B13R1.128 CC(=O)NCCNc1ncc(o1)C f421009434ec2c4f6ebbd34f543782f4 [0,1,0,0,0,1|2,0,0]=4 1693 B13R1.128 CC(=O)NCCNc1ncc(s1)Br 7da3c3242a600c3f8e5fa00b8d555cca [0,1,0,0,0,1|2,0,0]=4 1694 B13R1.128 CC(=O)NCCNc1ncc(s1)C 2843fc8d009679b50d1a6da286e7f5c4 [0,1,0,0,0,1|2,0,0]=4 1695 B13R1.128 CC(=O)NCCNc1ncc(s1)Cl 1d0db6e164a97510558c904ba1f517a7 [0,1,0,0,0,1|2,0,0]=4 1696 B13R1.128 CC(=O)NCCNc1ncc(s1)F 267bf07b6448a8df2f1910118d781cef [0,1,0,0,0,1|2,0,0]=4 1697 B13R1.128 CC(=O)NCCNc1ncc(s1)S d5678558648762d7658b14c76c5e2c78 [0,1,0,0,0,1|2,0,0]=4 1698 B13R1.128 CC(=O)NCCNc1ncn(n1)C 727b0e558780f8abe0298944361c10f0 [0,1,0,0,0,1|1,0,0]=3 1699 B13R1.128 CC(=O)NCCNc1nnn(n1)C 72aa67e5c9e6943fe8bccc9b7b69fd80 [0,1,0,0,0,1|2,0,0]=4 1700 B13R1.128 CC(=O)NCCNc1noc(n1)C b2117af31296c3493b1d4734333aca04 [0,1,0,0,0,1|2,0,0]=4 1701 B13R1.128 CC(=O)NCCNc1nsc(n1)C 8dbabd606a2e092430ca31ee8c562945 [0,1,0,0,0,1|2,0,0]=4 1702 B13R1.128 CC(=O)NCCOC1=CC(=O)NC1 7df09cf90571479e1e7ea8b4cc148154 [0,1,0,0,0,1|1,0,1]=4 1703 B13R1.128 CC(=O)NCCOC1=COC(=O)C1 ff0359bd2ecb1262724928a8b30e5424 [0,1,0,0,0,1|2,0,0]=4 1704 B13R1.128 CC(=O)NCCOc1cc(cs1)C 41d7d2617707bed3fc973eb1d817a4bb [0,1,0,0,0,1|2,0,0]=4 1705 B13R1.128 CC(=O)NCCOc1cc(sn1)Cl 0e2eb67143d5ff12dc4ed692d44d7986 [0,1,0,0,0,1|2,0,0]=4 1706 B13R1.128 CC(=O)NCCOc1ccc(s1)Br 0d115c8938cf256bd949e6e6f928981f [0,1,0,0,0,1|2,0,0]=4 1707 B13R1.128 CC(=O)NCCOc1ccn(n1)C ceddae97ca30eea738bb243ddd12c5f0 [0,1,0,0,0,1|2,0,0]=4 1708 B13R1.128 CC(=O)NCCOc1cnn(c1)C d061c9fd52c4495e6f6de06d6c04b6bc [0,1,0,0,0,1|2,0,0]=4 1709 B13R1.128 CC(=O)NCCOc1n[nH]c(n1)C 98a1bf301d71a33719d4fd94572d01f6 [0,1,0,0,0,1|1,0,0]=3 1710 B13R1.128 CC(=O)NCCOc1nc(cs1)Br aeea854c4c82da6a33517df1596bd814 [0,1,0,0,0,1|2,0,0]=4 1711 B13R1.128 CC(=O)NCCOc1nc(n[nH]1)Br 84e89651b99a9ba6fdee7c164e84fba7 [0,1,0,0,0,1|1,0,1]=4 1712 B13R1.128 CC(=O)NCCOc1nc(no1)C 98bf2a8c428e0afc3e14a1ebbd4d82c6 [0,1,0,0,0,1|1,0,1]=4 1713 B13R1.128 CC(=O)NCCOn1cc(cn1)I a32d756ff218a4ad560480665fd7709f [0,1,0,0,0,1|2,0,0]=4 1714 B13R1.128 CC(=O)NCOCc1cc(cs1)Br 94cda8c308817ae1300552281a2edc38 [0,1,0,0,0,1|2,0,0]=4 1715 B13R1.128 CC(=O)NCOCc1cc(on1)C a9646b9a12025b6080800cf8ad31c474 [0,1,0,0,0,1|2,0,0]=4 1716 B13R1.128 CC(=O)NCOCc1cc(sn1)Br f18ebb369988335de10987c800fe3477 [0,1,0,0,0,1|2,0,0]=4 1717 B13R1.128 CC(=O)NCOCc1ccc(s1)Br b5573726f2297c8472100afaa53d00a3 [0,1,0,0,0,1|2,0,0]=4 1718 B13R1.128 CC(=O)NCOCc1ccc(s1)Cl 6a123695b6e2eeb9fd54d35115a2f27b [0,1,0,0,0,1|2,0,0]=4 1719 B13R1.128 CC(=O)NCOCc1ccn(n1)C a6bfbb0b564325bde8991cdb38173fda [0,1,0,0,0,1|2,0,0]=4 1720 B13R1.128 CC(=O)NCOCc1cnc(o1)C 77263c3e1252fafbe06db49ea1366bbb [0,1,0,0,0,1|1,0,1]=4 1721 B13R1.128 CC(=O)NCOCc1cnc(s1)Br 59d605bd2197ea4be0a57c60a2b918c7 [0,1,0,0,0,1|1,0,1]=4 1722 B13R1.128 CC(=O)NCOCc1cnc(s1)C 41a67ce2d526ab25e34559c9fd51b6ca [0,1,0,0,0,1|1,0,1]=4 1723 B13R1.128 CC(=O)NCOCc1cnc(s1)Cl d53d4d784957516fba3483df6dbebaf7 [0,1,0,0,0,1|1,0,1]=4 1724 B13R1.128 CC(=O)NCOCc1cnn(c1)C 6f07b7973bfcc24c3be717f874588894 [0,1,0,0,0,1|2,0,0]=4 1725 B13R1.128 CC(=O)NCOCc1cnn(n1)C 65d56de0a23e7eab4b967b4bdaa5e65d [0,1,0,0,0,1|1,0,1]=4 1726 B13R1.128 CC(=O)NCOCc1coc(=O)o1 a8173cde893e96e99e9f07cb17d51978 [0,1,0,0,0,1|2,0,0]=4 1727 B13R1.128 CC(=O)NCOCc1coc(n1)C c954cb308aa2d6295e6314994a53b241 [0,1,0,0,0,1|1,0,0]=3 1728 B13R1.128 CC(=O)NCOCc1csc(c1)C 7772f5f859268318e3a980e446da92b1 [0,1,0,0,0,1|2,0,0]=4 1729 B13R1.128 CC(=O)NCOCc1csc(n1)Br 3f513929126df61ea2b96339f7e182ea [0,1,0,0,0,1|1,0,0]=3 1730 B13R1.128 CC(=O)NCOCc1csc(n1)C ece2f536d03a8f52310ca222cd846e9b [0,1,0,0,0,1|1,0,0]=3 1731 B13R1.128 CC(=O)NCOCc1csc(n1)Cl 4a3592c76b12129b9a280822cb04eeb0 [0,1,0,0,0,1|1,0,0]=3 1732 B13R1.128 CC(=O)NCOCc1nc(cs1)Br fed9fc598b05a851008c1596b989add3 [0,1,0,0,0,1|2,0,0]=4 1733 B13R1.128 CC(=O)NCOCc1nc(cs1)C 5f4914d40d56179609df6651ab513a41 [0,1,0,0,0,1|2,0,0]=4 1734 B13R1.128 CC(=O)NCOCc1nc(no1)Br 9353a4c54ca5acc147149e9a63d6b54e [0,1,0,0,0,1|1,0,1]=4 1735 B13R1.128 CC(=O)NCOCc1nc(no1)C cfb689f653b835a7591388e11be904a8 [0,1,0,0,0,1|1,0,1]=4 1736 B13R1.128 CC(=O)NCOCc1ncc(o1)Br 0f7810b08c077a2242fe40f0cb2a5939 [0,1,0,0,0,1|2,0,0]=4 1737 B13R1.128 CC(=O)NCOCc1ncc(o1)C e360ef46066ac84538b3c962b79e61f0 [0,1,0,0,0,1|2,0,0]=4 1738 B13R1.128 CC(=O)NCOCc1ncc(s1)Br 52516436d52061ccaa3df6f2137385c1 [0,1,0,0,0,1|2,0,0]=4 1739 B13R1.128 CC(=O)NCOCc1ncc(s1)Cl 14bda3f6cd0a85de853cc201cf4eda48 [0,1,0,0,0,1|2,0,0]=4 1740 B13R1.128 CC(=O)NCOCc1ncn(n1)C 9bf56f713804924e2a8defd1a3fa83ff [0,1,0,0,0,1|1,0,0]=3 1741 B13R1.128 CC(=O)NCOCc1noc(n1)C 7486d933f4487ae5388efd2703aacf82 [0,1,0,0,0,1|2,0,0]=4 1742 B13R1.128 CC(=O)NCOCc1nsc(n1)Cl 964907fa8ece3fdc23537ed4f5b15d02 [0,1,0,0,0,1|2,0,0]=4 1743 B13R1.128 CC(=O)NCOCn1cc(cn1)Cl 9c8f9f45542dde97c1f9b57188d8b7f4 [0,1,0,0,0,1|2,0,0]=4 1744 B13R1.128 CC(=O)OCCNc1cn(cn1)C f35b384af7eceabbf0bb9ce96373bef8 [0,1,0,0,0,1|1,0,0]=3 1745 B13R1.128 CC(=O)OCCNc1cn(nn1)C 90db73984eb3b16a3d4b49d9ac81ceb9 [0,1,0,0,0,1|2,0,0]=4 1746 B13R1.128 CC(=O)OCCNc1csc(n1)Br da1b121cf4f2d9ab45ebb5f5807a99c1 [0,1,0,0,0,1|2,0,0]=4 1747 B13R1.128 CC(=O)OCCNc1n[nH]c(n1)Br 0ba8cfa9f7eb22d9521f09629b9ac7cb [0,1,0,0,0,1|2,0,0]=4 1748 B13R1.128 CC(=O)OCCNc1n[nH]c(n1)S 187ee8c6e06e8e6148260c9a2e7058a9 [0,1,0,0,0,1|2,0,0]=4 1749 B13R1.128 CC(=O)OCCNc1ncn(n1)C cbfa023519232a2018e656b6312c0ee4 [0,1,0,0,0,1|2,0,0]=4 1750 B13R1.128 CC(=O)OCCOc1n[nH]c(n1)C e5604ca3252ded17890133c2761fbc30 [0,1,0,0,0,1|2,0,0]=4 1751 B13R1.128 CC(=O)OCNCc1c[nH]c(n1)C e313bd883793dfe3f89bc5ac48e04d37 [0,1,0,0,0,1|1,0,0]=3 1752 B13R1.128 CC(=O)OCNCc1cn(cn1)C 9a3141d73caefc5ff32b8864a203b5f0 [0,1,0,0,0,1|1,0,0]=3 1753 B13R1.128 CC(=O)OCNCc1cn(nn1)C 060fed59781f3c499bff6a5895dd6fb8 [0,1,0,0,0,1|2,0,0]=4 1754 B13R1.128 CC(=O)OCNCc1coc(n1)C 1b384a67a2259623440def271a77fa13 [0,1,0,0,0,1|2,0,0]=4 1755 B13R1.128 CC(=O)OCNCc1csc(n1)Br d4ff9131dce47438588f8e4aa649d70c [0,1,0,0,0,1|2,0,0]=4 1756 B13R1.128 CC(=O)OCNCc1csc(n1)C 7de30a1fc2ff9a81fd46770efe36dee8 [0,1,0,0,0,1|2,0,0]=4 1757 B13R1.128 CC(=O)OCNCc1csc(n1)Cl 5862e216c5263778e6f4b50d8adf9852 [0,1,0,0,0,1|2,0,0]=4 1758 B13R1.128 CC(=O)OCNCc1ncn(n1)C 722272d760e07e3c78523262c76e6ac9 [0,1,0,0,0,1|2,0,0]=4 1759 B13R1.128 CC(=O)OCOCc1c[nH]c(n1)C 998935cdc67df47b8bc775ecc40f16d1 [0,1,0,0,0,1|1,0,0]=3 1760 B13R1.128 CC(=O)OCOCc1ccn(c1)C 0b7ed3a7f8af32503b3b12e057586330 [0,1,0,0,0,1|2,0,0]=4 1761 B13R1.128 CC(=O)OCOCc1cn(cn1)C 73fa4612691de44be7ba585ec8ccfadb [0,1,0,0,0,1|1,0,0]=3 1762 B13R1.128 CC(=O)OCOCc1cn(nn1)C 03901b6ec66746af91a6e40bc2d12382 [0,1,0,0,0,1|2,0,0]=4 1763 B13R1.128 CC(=O)OCOCc1coc(n1)Br 1ed0492f17d8907c28e591799ff414a0 [0,1,0,0,0,1|2,0,0]=4 1764 B13R1.128 CC(=O)OCOCc1coc(n1)C a6cde0bb2c570bc6cb73927c424f8153 [0,1,0,0,0,1|2,0,0]=4 1765 B13R1.128 CC(=O)OCOCc1coc(n1)Cl e5ac5844c0da331311cbb6dd46a13c2a [0,1,0,0,0,1|2,0,0]=4 1766 B13R1.128 CC(=O)OCOCc1csc(n1)Br c36769a397cf5503415866cdef4ef99f [0,1,0,0,0,1|2,0,0]=4 1767 B13R1.128 CC(=O)OCOCc1csc(n1)C 142c54ea9c7dd339c348161b75a6379e [0,1,0,0,0,1|2,0,0]=4 1768 B13R1.128 CC(=O)OCOCc1csc(n1)Cl 7e9a05801b36907975938b781ac88a97 [0,1,0,0,0,1|2,0,0]=4 1769 B13R1.128 CC(=O)OCOCc1nc(=S)[nH][nH]1 b0b527ab39c9f8220890e16a09e1c074 [0,1,0,0,0,1|2,0,0]=4 1770 B13R1.128 CC(=O)OCOCc1ncn(n1)C 6d4bdb4d0307b732520862c067e382eb [0,1,0,0,0,1|2,0,0]=4 1771 B13R1.128 CC(=O)SCCNc1cn(cn1)C a28d301648f8ce1c823ba7b2f4fbd874 [0,1,0,0,0,1|1,0,0]=3 1772 B13R1.128 CC(=O)SCCNc1cn(nn1)C 042a96c62cb0896ed98ee2aef3697d92 [0,1,0,0,0,1|2,0,0]=4 1773 B13R1.128 CC(=O)SCCNc1csc(n1)Br fecc6ac7ecab92294c12906edf18a80f [0,1,0,0,0,1|2,0,0]=4 1774 B13R1.128 CC(=O)SCCNc1n[nH]c(n1)Br 4f4775d311731187b9b7ee5663283bee [0,1,0,0,0,1|2,0,0]=4 1775 B13R1.128 CC(=O)SCCNc1n[nH]c(n1)S 10a051014b3e0af684e9ce5ec2abc05f [0,1,0,0,0,1|2,0,0]=4 1776 B13R1.128 CC(=O)SCCNc1ncn(n1)C ec0d935786221fc00a6d739c71b13c1d [0,1,0,0,0,1|2,0,0]=4 1777 B13R1.128 CC(=O)SCCOc1n[nH]c(n1)C 513d51e38da1a96eb241e0387849c12a [0,1,0,0,0,1|2,0,0]=4 1778 B13R1.128 CC(C)CNCCc1cn(cn1)C dacd95eaefdbb823c3662cfe8a25b121 [0,1,0,0,0,1|1,0,1]=4 1779 B13R1.128 CC(O)CNCCc1cn(cn1)C 40735022cfc48774f07b16a09d199f54 [0,1,0,0,0,1|0,0,2]=4 1780 B13R1.128 CN(C)CNCCc1cn(cn1)C e0c5f998951b5d3ef9afb8abcd653c5d [0,1,0,0,0,1|2,0,0]=4 1781 B13R1.128 CS(=O)CCCNc1c[nH]c(n1)N 6377be94c5ddde2397c4b005c7b337bc [0,1,0,0,0,1|2,0,0]=4 1782 B13R1.128 C[C@@H](O)CNCCc1cn(cn1)C 3d26aa3103448c4bc31d13897ae0c27c [0,1,0,0,0,1|0,0,2]=4 1783 B13R1.128 C[C@H](O)CNCCc1cn(cn1)C 45f81917af1e1cb831fe30ea98a4c9a2 [0,1,0,0,0,1|0,0,2]=4 1784 B13R1.128 Cc1nc(c[nH]1)CNCCC(=O)N c6a0b99c919af364ca86300d300219d3 [0,1,0,0,0,1|2,0,0]=4 1785 B13R1.128 Cc1nc(c[nH]1)CNCCC(=O)O f82d75c5a8eb66306911710acde9ea83 [0,1,0,0,0,1|2,0,0]=4 1786 B13R1.128 Cc1nc(c[nH]1)CNCCS(=O)C 7ce02356b20041d9d2138cce121c5045 [0,1,0,0,0,1|2,0,0]=4 1787 B13R1.128 Cc1nc(c[nH]1)CNCSC(=O)N 8220baf8b21be9ae1f037fa031fda4ff [0,1,0,0,0,1|2,0,0]=4 1788 B13R1.128 Cc1nc(c[nH]1)COCCC(=O)N cecfb019f35707d10154e05e79e5c6a4 [0,1,0,0,0,1|2,0,0]=4 1789 B13R1.128 Cc1nc(c[nH]1)COCCC(=O)O 0487320fe9f24c0b9733a291cdce3a06 [0,1,0,0,0,1|2,0,0]=4 1790 B13R1.128 Cc1nc(c[nH]1)COCCS(=O)C b347b62d2d8ddeec6b7b129a3ec23b96 [0,1,0,0,0,1|2,0,0]=4 1791 B13R1.128 Cc1nc(c[nH]1)COCSC(=O)N 8d4989d959303ce71ec89dc1e46bee7b [0,1,0,0,0,1|2,0,0]=4 1792 B13R1.128 Cc1nc(c[nH]1)NCCCS(=O)C 9cec6a41dbf6fae00c213784a37f7089 [0,1,0,0,0,1|2,0,0]=4 1793 B13R1.128 Cc1nc(co1)COCNC(=O)N ea159ee226f8847c334dca6065c72651 [0,1,0,0,0,1|2,0,0]=4 1794 B13R1.128 Cc1nc(cs1)CCNCC(=O)N 5c80e843cc37c18e3f56b2f7540f993f [0,1,0,0,0,1|2,0,0]=4 1795 B13R1.128 Cc1nc(cs1)CCNCC(=O)O a2ea691686cce0d3bfe5e2b471d3421a [0,1,0,0,0,1|2,0,0]=4 1796 B13R1.128 Cc1nc(cs1)COCNC(=O)N f10bcc63eb64c0b1687d2adeded3aea2 [0,1,0,0,0,1|2,0,0]=4 1797 B13R1.128 Cc1nc(n[nH]1)OCCNC(=O)N 548f48f70adb7bb8d070ceb4ef15e4e6 [0,1,0,0,0,1|2,0,0]=4 1798 B13R1.128 Cn1cc(nn1)CCNCC(=O)N 8efd50fa82172bd427c5045c722e8148 [0,1,0,0,0,1|2,0,0]=4 1799 B13R1.128 Cn1cc(nn1)CCNCC(=O)O a884e01a85c6de8dbf65563cd1415543 [0,1,0,0,0,1|2,0,0]=4 1800 B13R1.128 Cn1cc(nn1)NCCNC(=O)N 2e0778617d20abe025e5b0c65202669f [0,1,0,0,0,1|2,0,0]=4 1801 B13R1.128 Cn1cnc(c1)CCNCC(=O)N 468933cb6b71a488c720c3668a902d93 [0,1,0,0,0,1|1,0,0]=3 1802 B13R1.128 Cn1cnc(c1)CCNCC(=O)O 24bd97afccc628b6e0488638cf5f76a0 [0,1,0,0,0,1|1,0,0]=3 1803 B13R1.128 Cn1cnc(c1)CCNC[N+](=O)[O-] 25d30ee100806defdbce7bdcf0e411ba [0,1,0,0,0,1|2,0,0]=4 1804 B13R1.128 Cn1cnc(c1)CNCCC(=O)N 429969f47fa3780ed3a1936a50f6ccf8 [0,1,0,0,0,1|2,0,0]=4 1805 B13R1.128 Cn1cnc(c1)CNCCC(=O)O 5749d6cdba717330834a0ff608dcb038 [0,1,0,0,0,1|2,0,0]=4 1806 B13R1.128 Cn1cnc(c1)CNCCS(=O)C 1dc6b73169274d05365ec3e5f5a2fd60 [0,1,0,0,0,1|2,0,0]=4 1807 B13R1.128 Cn1cnc(c1)CNCSC(=O)N f8df39dd5063e922a47c72433904f15e [0,1,0,0,0,1|2,0,0]=4 1808 B13R1.128 Cn1cnc(c1)COCCC(=O)N 68f002664aae57872b20e19494a25489 [0,1,0,0,0,1|2,0,0]=4 1809 B13R1.128 Cn1cnc(c1)COCCC(=O)O 7163e7ac145d5a7d5e361808943171a6 [0,1,0,0,0,1|2,0,0]=4 1810 B13R1.128 Cn1cnc(c1)COCCS(=O)C ada25442b965ff5712616e4bd99136c3 [0,1,0,0,0,1|2,0,0]=4 1811 B13R1.128 Cn1cnc(c1)COCSC(=O)N 820cd3f33f35aad22a8d459b57b19095 [0,1,0,0,0,1|2,0,0]=4 1812 B13R1.128 Cn1cnc(c1)NCCCC(=O)N dc0acadd5bed7126524d97a673cafe1d [0,1,0,0,0,1|2,0,0]=4 1813 B13R1.128 Cn1cnc(c1)NCCCC(=O)O ee0ce48c6b436f243e9b4b76e573d00f [0,1,0,0,0,1|2,0,0]=4 1814 B13R1.128 Cn1cnc(c1)NCCCS(=O)C f07d9981ad5e6122b3edbefd0febcfbc [0,1,0,0,0,1|2,0,0]=4 1815 B13R1.128 Cn1cnc(c1)NCCNC(=O)N 4ddfb1946e4e14c3d3b7d0e55271e91a [0,1,0,0,0,1|1,0,0]=3 1816 B13R1.128 Cn1cnc(c1)NCCNC(=S)N 6d6052bb8e5815e07efd1714d3ce6af8 [0,1,0,0,0,1|1,1,0]=4 1817 B13R1.128 Cn1cnc(n1)COCNC(=O)N 596a29573cb2f493ac95fa5162e3fe1a [0,1,0,0,0,1|2,0,0]=4 1818 B13R1.128 Cn1cnc(n1)NCCNC(=O)N 24164250eeef859926bdc21d897eee2e [0,1,0,0,0,1|2,0,0]=4 1819 B13R1.128 NC(=O)CCCNc1c[nH]c(n1)N e116f76fbdf75e85258b72d8ac61776d [0,1,0,0,0,1|2,0,0]=4 1820 B13R1.128 NC(=O)NCCNc1csc(n1)Br 96b160de4e79e209c88b4fe703485de1 [0,1,0,0,0,1|2,0,0]=4 1821 B13R1.128 NC(=O)NCCNc1n[nH]c(n1)Br 1a6ceef46ca3bb410cc511098866ebad [0,1,0,0,0,1|2,0,0]=4 1822 B13R1.128 NC(=O)NCOCc1csc(n1)Br 080758054c5422b573a88b7ce5a06bbb [0,1,0,0,0,1|2,0,0]=4 1823 B13R1.128 NC(=S)NCCNc1c[nH]c(n1)N 3c4ae4c9f6df84a3827ac640b8414300 [0,1,0,0,0,1|1,1,0]=4 1824 B13R1.167 C/C(=C/CNCc1nc[nH]c1C)/I 0cf475cc97792b2863aae49535fa8d51 [0,1,0,0,0,1|2,0,0]=4 1825 B13R1.167 C/C(=C/COCc1nc[nH]c1C)/I 717078d733a0b014b2bc969a84cbdd1c [0,1,0,0,0,1|2,0,0]=4 1826 B13R1.167 C/C(=C\CNCc1nc[nH]c1C)/Cl 7a42168f03a23070388b0afd50573ec7 [0,1,0,0,0,1|2,0,0]=4 1827 B13R1.167 C/C(=C\COCc1nc[nH]c1C)/Cl b55a1b9c0544eb4f3d8400b541980d12 [0,1,0,0,0,1|2,0,0]=4 1828 B13R1.167 C=C(C)CCNCc1nc[nH]c1C a1640e979de1b366d2be06f8c20e05f2 [0,1,0,0,0,1|2,0,0]=4 1829 B13R1.167 C=C(C)CCOCc1nc[nH]c1C 7139771950de0cd660ba6e35b76de627 [0,1,0,0,0,1|2,0,0]=4 1830 B13R1.167 CC(=CCNCc1nc[nH]c1C)C 7d1cdd23c28c62bf90a8a78a544bd845 [0,1,0,0,0,1|2,0,0]=4 1831 B13R1.167 CC(=CCNCc1nc[nH]c1C)Cl 9797bdf6bc5d4d28eb0f9f0f907d9193 [0,1,0,0,0,1|2,0,0]=4 1832 B13R1.167 CC(=CCNCc1nc[nH]c1C)I 86bd9808b0cb826cc9216b9a8b693d8e [0,1,0,0,0,1|2,0,0]=4 1833 B13R1.167 CC(=CCOCc1nc[nH]c1C)C 411e70af183a04b9c724ed86ff3b7580 [0,1,0,0,0,1|2,0,0]=4 1834 B13R1.167 CC(=CCOCc1nc[nH]c1C)Cl 52f769d8ab8958c44bc8d798dcf6ce94 [0,1,0,0,0,1|2,0,0]=4 1835 B13R1.167 CC(=CCOCc1nc[nH]c1C)I c4dc8e81fe457d24aedf741e9a417819 [0,1,0,0,0,1|2,0,0]=4 1836 B13R1.167 CC(=O)CCCNc1ncsc1Br 4de3e3552503c5252adc43114f0242f9 [0,1,0,0,0,1|2,0,0]=4 1837 B13R1.167 CC(=O)CCCNc1no[nH]c1=O adfb1c34ae0f3e2b94f460f68b697f15 [0,1,0,0,0,1|2,0,0]=4 1838 B13R1.167 CC(=O)CCNCc1nc[nH]c1C ac451910e6671bcfd301ef964747821f [0,1,0,0,0,1|1,0,0]=3 1839 B13R1.167 CC(=O)CCNCc1ncoc1C c6a946059d3fb710fe4065996e855a0c [0,1,0,0,0,1|2,0,0]=4 1840 B13R1.167 CC(=O)CCOCc1nc[nH]c1C f1d7de8dab326ac6c944be934b07a75d [0,1,0,0,0,1|1,0,0]=3 1841 B13R1.167 CC(=O)CCOCc1ncoc1C 72f0e12b23cbcc71d34bb2cc9b23ccf3 [0,1,0,0,0,1|2,0,0]=4 1842 B13R1.167 CC(=O)CCOCc1ncsc1C 0a72b693cf1be6cf72cc3d537b55c9e8 [0,1,0,0,0,1|2,0,0]=4 1843 B13R1.167 CC(=O)CNCCc1scnc1C e91cb87e130e5e4e823ce7221182d189 [0,1,0,0,0,1|1,0,1]=4 1844 B13R1.167 CC(=O)CNCCn1cc[nH]c1=O d9c089977dcc904335301e839834bd69 [0,1,0,0,0,1|2,0,0]=4 1845 B13R1.167 CC(=O)CNCCn1nccc1C d1181b9f4b4263a3693e6cb1c8a6783b [0,1,0,0,0,1|2,0,0]=4 1846 B13R1.167 CC(=O)NCCCc1nccn1C 309467e3369b02e8651d662df64caa2b [0,1,0,0,0,1|2,0,0]=4 1847 B13R1.167 CC(=O)NCCCc1scnc1C a455d565f5412d78cfc4c4b08f95ded5 [0,1,0,0,0,1|1,0,1]=4 1848 B13R1.167 CC(=O)NCCCn1nccc1C 0bbb847433a56324c5f8d45dccd13da1 [0,1,0,0,0,1|2,0,0]=4 1849 B13R1.167 CC(=O)NCCNc1[nH]cnc1C 7bd149e298e202bc7179ad147d2c2375 [0,1,0,0,0,1|0,0,2]=4 1850 B13R1.167 CC(=O)NCCNc1c[nH]nc1Br 16ff67f3deb705cf600f362710b3173f [0,1,0,0,0,1|2,0,0]=4 1851 B13R1.167 CC(=O)NCCNc1c[nH]nc1C 7cb274b08c7218d9030631ebe83294ed [0,1,0,0,0,1|2,0,0]=4 1852 B13R1.167 CC(=O)NCCNc1c[nH]nc1Cl 8ba322993918e6ded774e44daf38a279 [0,1,0,0,0,1|2,0,0]=4 1853 B13R1.167 CC(=O)NCCNc1c[nH]nc1F af10dbf97601ad7fdc2f29b2227b7221 [0,1,0,0,0,1|2,0,0]=4 1854 B13R1.167 CC(=O)NCCNc1cccn1C 07573aed3a01bbf84d1b87274b192fbe [0,1,0,0,0,1|1,0,1]=4 1855 B13R1.167 CC(=O)NCCNc1ccsc1C 0c98d8c7831e561a5ce508cc8b5e1a59 [0,1,0,0,0,1|2,0,0]=4 1856 B13R1.167 CC(=O)NCCNc1cncn1C 2f5f8fcb9c0142583e621fc5451a34fa [0,1,0,0,0,1|0,0,2]=4 1857 B13R1.167 CC(=O)NCCNc1cscc1Br 47af4a8b01078331f7e99d503af753bb [0,1,0,0,0,1|2,0,0]=4 1858 B13R1.167 CC(=O)NCCNc1cscc1C 1025df4e16449a06d9ec42a61573a76f [0,1,0,0,0,1|2,0,0]=4 1859 B13R1.167 CC(=O)NCCNc1n[nH]cc1Br 3728fdfd54900d718f1506ccf8bd5b32 [0,1,0,0,0,1|2,0,0]=4 1860 B13R1.167 CC(=O)NCCNc1n[nH]cc1C 796a998ab066247875e2d4f3f7d3e4bd [0,1,0,0,0,1|2,0,0]=4 1861 B13R1.167 CC(=O)NCCNc1n[nH]cc1Cl f5bfac8d0c3bcd5e27e7bd92f64edce1 [0,1,0,0,0,1|2,0,0]=4 1862 B13R1.167 CC(=O)NCCNc1n[nH]cc1I ed61a3ff165b0992b19bfc7d9b92ae5a [0,1,0,0,0,1|2,0,0]=4 1863 B13R1.167 CC(=O)NCCNc1n[nH]cc1N 679f050ba4aa8a3bcc29af3b95da878f [0,1,0,0,0,1|2,0,0]=4 1864 B13R1.167 CC(=O)NCCNc1nccn1C c587cf51e6cd04b66a9c56e905516e95 [0,1,0,0,0,1|2,0,0]=4 1865 B13R1.167 CC(=O)NCCNc1ncnn1C d3386c2358aa2d693c471e7d8d1d2935 [0,1,0,0,0,1|1,0,1]=4 1866 B13R1.167 CC(=O)NCCNc1ncsc1Br d6c3c679354d54ec905c8115c6282cf0 [0,1,0,0,0,1|1,0,0]=3 1867 B13R1.167 CC(=O)NCCNc1no[nH]c1=O 022f63a22dff46a06475aac069a9291c [0,1,0,0,0,1|1,0,0]=3 1868 B13R1.167 CC(=O)NCCNc1nocc1Br 399efeecca4c6d1e6bc3f2fc75893502 [0,1,0,0,0,1|2,0,0]=4 1869 B13R1.167 CC(=O)NCCNc1nocc1C 38ed730cba65206909cd8a618a7b4bd1 [0,1,0,0,0,1|2,0,0]=4 1870 B13R1.167 CC(=O)NCCNc1nocc1Cl d1818b50f8a9a13150023502a05b7de4 [0,1,0,0,0,1|2,0,0]=4 1871 B13R1.167 CC(=O)NCCNc1nonc1C 8054943b809d45c611b0ff9a26b12033 [0,1,0,0,0,1|1,0,1]=4 1872 B13R1.167 CC(=O)NCCNc1nsnc1Cl cff68c2654f56fd8d859becb81ad51bb [0,1,0,0,0,1|1,0,1]=4 1873 B13R1.167 CC(=O)NCCNc1sccc1C 558263f3dd79dba89f820a5a6e5b40cc [0,1,0,0,0,1|2,0,0]=4 1874 B13R1.167 CC(=O)NCCNc1scnc1C 4e4bd833bdb55c15b1c1f3d568217496 [0,1,0,0,0,1|1,0,1]=4 1875 B13R1.167 CC(=O)NCCOc1cccn1C a7675daaa0dca6d9e54323876a521ea5 [0,1,0,0,0,1|1,0,1]=4 1876 B13R1.167 CC(=O)NCCOc1cn[nH]c1C 278d7be2b4cab7db0ddd032069f05c01 [0,1,0,0,0,1|2,0,0]=4 1877 B13R1.167 CC(=O)NCCOc1n[nH]cc1C b5b57f32f1d46d5fdace03a4369c9d80 [0,1,0,0,0,1|2,0,0]=4 1878 B13R1.167 CC(=O)NCCOc1nocc1Br 8fc08650addbfec08cc6a206c681912c [0,1,0,0,0,1|2,0,0]=4 1879 B13R1.167 CC(=O)NCCOc1nsnc1Cl 42343ad977c9b4e6e39471855a7d4cf5 [0,1,0,0,0,1|1,0,1]=4 1880 B13R1.167 CC(=O)NCCSc1nccn1C 9247fe2160002ef79b08f220f0a2ccae [0,1,0,0,0,1|2,0,0]=4 1881 B13R1.167 CC(=O)NCOCc1ccsc1Br 6299f1bb2ebb3d5de8db0b85b32f6328 [0,1,0,0,0,1|2,0,0]=4 1882 B13R1.167 CC(=O)NCOCc1ccsc1Cl be1b9497c6a544ac1c67b6d444abb4a2 [0,1,0,0,0,1|2,0,0]=4 1883 B13R1.167 CC(=O)NCOCc1cncn1C b2a1a56b0f11939a4ffed54d256c1323 [0,1,0,0,0,1|0,0,2]=4 1884 B13R1.167 CC(=O)NCOCc1cscc1Br 26f65ac126211aff472fcdcd2f362042 [0,1,0,0,0,1|2,0,0]=4 1885 B13R1.167 CC(=O)NCOCc1nccn1C 47a36ab1de7f9d7684b90f051d2d54c1 [0,1,0,0,0,1|2,0,0]=4 1886 B13R1.167 CC(=O)NCOCc1ncoc1C 89707a7df6cd3e04c47df1fcbbf87b20 [0,1,0,0,0,1|1,0,0]=3 1887 B13R1.167 CC(=O)NCOCc1nnsc1Cl b83428f2a66f239b0f3f12c8f3ea49df [0,1,0,0,0,1|2,0,0]=4 1888 B13R1.167 CC(=O)NCOCc1nocc1Br d9ada4df26ccf82603a12212dee11152 [0,1,0,0,0,1|2,0,0]=4 1889 B13R1.167 CC(=O)NCOCc1nonc1C 2634257ef0caf9f1192588819850aac5 [0,1,0,0,0,1|1,0,1]=4 1890 B13R1.167 CC(=O)NCOCc1scnc1C cb9eb1a1f5c3dc6567afb6a1244a9201 [0,1,0,0,0,1|1,0,1]=4 1891 B13R1.167 CC(=O)NCOCc1scnc1Cl 34a6d3bee1eba3884b37d13de71d2cfb [0,1,0,0,0,1|1,0,1]=4 1892 B13R1.167 CC(=O)OCCNc1ncsc1Br 1ac64e6c84c628428d122fc71eef5bef [0,1,0,0,0,1|2,0,0]=4 1893 B13R1.167 CC(=O)OCCNc1no[nH]c1=O b06632bce03d0864467e699ea49f7784 [0,1,0,0,0,1|2,0,0]=4 1894 B13R1.167 CC(=O)OCNCc1nc[nH]c1C c9e3139632dc78b45534b1e0450ff961 [0,1,0,0,0,1|1,0,0]=3 1895 B13R1.167 CC(=O)OCNCc1ncoc1C 5fcc32eed3723c38c94ed38170e5ab92 [0,1,0,0,0,1|2,0,0]=4 1896 B13R1.167 CC(=O)OCOCc1nc[nH]c1C 3fdc4fc52e54831b384b2bcf5b815e0a [0,1,0,0,0,1|1,0,0]=3 1897 B13R1.167 CC(=O)OCOCc1ncoc1C 742fbb9b100edd90cb58f7eb53effdd4 [0,1,0,0,0,1|2,0,0]=4 1898 B13R1.167 CC(=O)OCOCc1ncsc1Br 72561bb50f983c4811915595d1343139 [0,1,0,0,0,1|2,0,0]=4 1899 B13R1.167 CC(=O)OCOCc1ncsc1C 6df4e8dba126ee884cddc7fc58d85825 [0,1,0,0,0,1|2,0,0]=4 1900 B13R1.167 CC(=O)SCCNc1ncsc1Br 6d46cb577950c2a657d74379361e9698 [0,1,0,0,0,1|2,0,0]=4 1901 B13R1.167 CC(=O)SCCNc1no[nH]c1=O 1bff55961fbf43cce76f7aa0466bbd63 [0,1,0,0,0,1|2,0,0]=4 1902 B13R1.167 Cc1[nH]cnc1CNCCC(=O)N d7670f84133b19e7d74a250bcdae02f3 [0,1,0,0,0,1|2,0,0]=4 1903 B13R1.167 Cc1[nH]cnc1CNCCC(=O)O 9ad3582839798795c926c4560e893c82 [0,1,0,0,0,1|2,0,0]=4 1904 B13R1.167 Cc1[nH]cnc1CNCCS(=O)C 867208159c9cbf6e5c9c30d924452682 [0,1,0,0,0,1|2,0,0]=4 1905 B13R1.167 Cc1[nH]cnc1CNCSC(=O)N 44682ee0e37f5ea34f90d932f2339566 [0,1,0,0,0,1|2,0,0]=4 1906 B13R1.167 Cc1[nH]cnc1COCCC(=O)N f61a88338e6cd7bd65172627751bf2d2 [0,1,0,0,0,1|2,0,0]=4 1907 B13R1.167 Cc1[nH]cnc1COCCC(=O)O 151511c1725d5141aab3c4b087f2d794 [0,1,0,0,0,1|2,0,0]=4 1908 B13R1.167 Cc1[nH]cnc1COCCS(=O)C d4350ce9b48511cea17d9f5d9e7cb117 [0,1,0,0,0,1|2,0,0]=4 1909 B13R1.167 Cc1[nH]cnc1COCSC(=O)N 81eb23bf259ef5a8645d77430c78c819 [0,1,0,0,0,1|2,0,0]=4 1910 B13R1.167 Cc1[nH]cnc1NCCCC(=O)N 8431ebba8401ddaf4a5e2ea65486ebd1 [0,1,0,0,0,1|2,0,0]=4 1911 B13R1.167 Cc1[nH]cnc1NCCCS(=O)C fc78cc5a94d69d42c2c6aac1dc335472 [0,1,0,0,0,1|2,0,0]=4 1912 B13R1.167 Cc1ocnc1COCNC(=O)N 750fc9acf70510f2f09c9b81408de81b [0,1,0,0,0,1|2,0,0]=4 1913 B13R1.167 NC(=O)NCCNc1no[nH]c1=O ab4b90f8bb2c331f8aaeaaa25f416d00 [0,1,0,0,0,1|2,0,0]=4 1914 B13R1.342 CC(=O)CCNC(C)c1cscn1 d3bdd1286000f6d64cbe5565d991fab1 [0,1,0,0,0,1|2,0,0]=4 1915 B13R1.342 CC(=O)CNCC(=O)c1cocn1 bd7dd984af4c0c4d62b65512ec6d35c6 [0,1,0,0,0,1|1,0,1]=4 1916 B13R1.342 CC(=O)NCCN(C)c1cc[nH]n1 82670fd4a282ba08151c9b06d34b4d30 [0,1,0,0,0,1|2,0,0]=4 1917 B13R1.342 CC(=O)NCCN(C)c1ccon1 94bd978a4ab95b1a09ecc65410a60ce6 [0,1,0,0,0,1|2,0,0]=4 1918 B13R1.342 CC(=O)NCCN(C)c1ccsc1 2e86e152f2d9a038e8b48d26997a1572 [0,1,0,0,0,1|2,0,0]=4 1919 B13R1.342 CC(=O)NCCN(C)c1ncc[nH]1 12af250eb03790e4fae97b59e8e51e94 [0,1,0,0,0,1|2,0,0]=4 1920 B13R1.342 CC(=O)NCCN(C)c1ncco1 95b2bba50204b0630109c336f2f4d2c9 [0,1,0,0,0,1|2,0,0]=4 1921 B13R1.342 CC(=O)NCCN(C)c1nccs1 50d77543596b987b174e9a4df0a401b1 [0,1,0,0,0,1|2,0,0]=4 1922 B13R1.342 CC(=O)OCNC(C)c1cscn1 fd3ef2b0722ef5921c9bea7f8b2f2176 [0,1,0,0,0,1|2,0,0]=4 1923 B13R1.344 C=C(Br)CNC(C)Cc1c[nH]cn1 404898bb0714724d0af69b75ba6469ba [0,1,0,0,0,1|1,0,1]=4 1924 B13R1.344 C=C(Br)CN[C@@H](C)Cc1c[nH]cn1 e1122e70114929ca1b9eec1662997ab9 [0,1,0,0,0,1|1,0,1]=4 1925 B13R1.344 C=C(Br)CN[C@H](C)Cc1c[nH]cn1 6a09e3d70cfa33f262938da1018545cc [0,1,0,0,0,1|1,0,1]=4 1926 B13R1.344 C=C(C)CNC(C)Cc1c[nH]cn1 9c55e21c794cf7fda54fe8e9b345877f [0,1,0,0,0,1|1,0,0]=3 1927 B13R1.344 C=C(C)CN[C@@H](C)Cc1c[nH]cn1 439c519fcde28d2e6eedbc858f22ed70 [0,1,0,0,0,1|1,0,0]=3 1928 B13R1.344 C=C(C)CN[C@H](C)Cc1c[nH]cn1 582b1e906fe52f662ce78ad8a00f89e2 [0,1,0,0,0,1|1,0,0]=3 1929 B13R1.344 C=C(Cl)CNC(C)Cc1c[nH]cn1 547e221898c4ca5d5982b3e6b3387872 [0,1,0,0,0,1|1,0,1]=4 1930 B13R1.344 C=C(Cl)CN[C@@H](C)Cc1c[nH]cn1 5197251b2f8df9c7211fb3efc2397e59 [0,1,0,0,0,1|1,0,1]=4 1931 B13R1.344 C=C(Cl)CN[C@H](C)Cc1c[nH]cn1 1efd24c39dcc8c137a6aaff59e6cd8a1 [0,1,0,0,0,1|1,0,1]=4 1932 B13R1.344 C=C(F)CNC(C)Cc1c[nH]cn1 81032388295027f12cfe5b1440528fea [0,1,0,0,0,1|1,0,1]=4 1933 B13R1.344 C=C(F)CN[C@@H](C)Cc1c[nH]cn1 e5732067f2ce4754436a0e8c0ec6f127 [0,1,0,0,0,1|1,0,1]=4 1934 B13R1.344 C=C(F)CN[C@H](C)Cc1c[nH]cn1 75420cc5a55efc210f6385954eacc21a [0,1,0,0,0,1|1,0,1]=4 1935 B13R1.344 CC(=O)CNC(=O)Cc1cscn1 bd8b77d8b5c7e71d1e7c12d437fee9bb [0,1,0,0,0,1|1,0,1]=4 1936 B13R1.344 CC(=O)NCC(=O)Nc1cocn1 c4e393f5b43896b802f5808df55a86ec [0,1,0,0,0,1|1,0,1]=4 1937 B13R1.344 CC(=O)NCC(=O)Nc1cscn1 efa4cf5fd325681a16723e8b1b00b21f [0,1,0,0,0,1|1,0,1]=4 1938 B13R1.344 CC(=O)NCC(C)Cn1cccn1 796972f08026b10f22963b2aecdc931c [0,1,0,0,0,1|2,0,0]=4 1939 B13R1.344 CC(=O)NCC(O)Cn1cccn1 a58cfe6f20ed6a0f051ccc0164f27526 [0,1,0,0,0,1|2,0,0]=4 1940 B13R1.344 CC(C)CNC(C)Cc1c[nH]cn1 1c72d76714cedc6af587d200027b6bd1 [0,1,0,0,0,1|1,0,1]=4 1941 B13R1.344 CC(C)CN[C@@H](C)Cc1c[nH]cn1 c8be10935ad0ed8730454c7e2d12044b [0,1,0,0,0,1|1,0,1]=4 1942 B13R1.344 CC(C)CN[C@H](C)Cc1c[nH]cn1 f34dae42f7d8eab7e63523d7750ab7cc [0,1,0,0,0,1|1,0,1]=4 1943 B13R1.344 CC(CCC(=O)O)Oc1c[nH]cn1 26e00eb28d330d4ef9f5c331f33693d9 [0,1,0,0,0,1|2,0,0]=4 1944 B13R1.344 CC(Cc1c[nH]cn1)NCC(=O)N 0b30e937fb1b82a0397960f70a9e9c32 [0,1,0,0,0,1|1,0,0]=3 1945 B13R1.344 CC(Cc1c[nH]cn1)NCC(=O)O 00573451903723af720367b75d3d7e36 [0,1,0,0,0,1|1,0,0]=3 1946 B13R1.344 CC(Cc1c[nH]cn1)NCN(C)C f1bcf0abc203183ce8d132a9e1242d8d [0,1,0,0,0,1|2,0,0]=4 1947 B13R1.344 CC(Cc1c[nH]cn1)NC[C@@H](C)O 37cb67cdc3fae021a1cdd0cad0335b00 [0,1,0,0,0,1|0,0,2]=4 1948 B13R1.344 CC(Cc1c[nH]cn1)NC[C@H](C)O b4c555e0bfd90e19fcf1069b5f824652 [0,1,0,0,0,1|0,0,2]=4 1949 B13R1.344 CC(Cc1c[nH]cn1)NC[N+](=O)[O-] 823545108f4ce103a9f5f246d19c729a [0,1,0,0,0,1|2,0,0]=4 1950 B13R1.344 CC(O)CNC(C)Cc1c[nH]cn1 07219c56628b22c3197e3c5527421b9d [0,1,0,0,0,1|0,0,2]=4 1951 B13R1.344 CC(O)CN[C@@H](C)Cc1c[nH]cn1 e090b7592aeff1704e67f1640c788147 [0,1,0,0,0,1|0,0,2]=4 1952 B13R1.344 CC(O)CN[C@H](C)Cc1c[nH]cn1 43f80e22601c14635c909c1e08c36da7 [0,1,0,0,0,1|0,0,2]=4 1953 B13R1.344 C[C@@H](Cc1c[nH]cn1)NCC(=O)N 70aa2e3f8cf84fddce9538380c036941 [0,1,0,0,0,1|1,0,0]=3 1954 B13R1.344 C[C@@H](Cc1c[nH]cn1)NCC(=O)O 3b6a7e4cef8241347adf9edb2dcbd8ed [0,1,0,0,0,1|1,0,0]=3 1955 B13R1.344 C[C@@H](Cc1c[nH]cn1)NCN(C)C d8bc6f02c0c878d83046c87f3f7ee6bf [0,1,0,0,0,1|2,0,0]=4 1956 B13R1.344 C[C@@H](Cc1c[nH]cn1)NC[N+](=O)[O-] 7e1978b2820fb56b9374e63a0f9c4681 [0,1,0,0,0,1|2,0,0]=4 1957 B13R1.344 C[C@@H](O)CN[C@@H](C)Cc1c[nH]cn1 32589d583a3a9548435994c19c33f3fc [0,1,0,0,0,1|0,0,2]=4 1958 B13R1.344 C[C@H](Cc1c[nH]cn1)NCC(=O)N ff390ae72b2cdd26d781b9dabed6e37c [0,1,0,0,0,1|1,0,0]=3 1959 B13R1.344 C[C@H](Cc1c[nH]cn1)NCC(=O)O ecfad5a871fbb1fbef1732f441f14086 [0,1,0,0,0,1|1,0,0]=3 1960 B13R1.344 C[C@H](Cc1c[nH]cn1)NCN(C)C 7e341a869633b55853bcbeffe85a5102 [0,1,0,0,0,1|2,0,0]=4 1961 B13R1.344 C[C@H](Cc1c[nH]cn1)NC[C@@H](C)O d130712b58944517bd60464ca3608fa3 [0,1,0,0,0,1|0,0,2]=4 1962 B13R1.344 C[C@H](Cc1c[nH]cn1)NC[N+](=O)[O-] 0631a61d722e231ccaa81f5afe318e36 [0,1,0,0,0,1|2,0,0]=4 1963 B13R1.344 C[C@H](O)CN[C@@H](C)Cc1c[nH]cn1 349feafb82dfeb01bcac0e6e92227de0 [0,1,0,0,0,1|0,0,2]=4 1964 B13R1.344 C[C@H](O)CN[C@H](C)Cc1c[nH]cn1 1c7e86cfd4d674f914dd9d2c8c08c24b [0,1,0,0,0,1|0,0,2]=4 1965 B13R1.536 BrCC(Br)CNCCc1c[nH]cn1 c023afd04f45cbe0c697c6aab7904fb6 [0,1,0,0,0,1|1,0,1]=4 1966 B13R1.536 C#CC(C)NCCCc1c[nH]cn1 a676621f31b7475d4671ba5cdce9795d [0,1,0,0,0,1|1,0,1]=4 1967 B13R1.536 C/C(=C\I)/COCCc1c[nH]cn1 4f10c61145f6725b03670e38f1cac11e [0,1,0,0,0,1|2,0,0]=4 1968 B13R1.536 C=C(C#N)CNCCc1c[nH]cn1 6f341b62e6f4def1da8d138ed44de38d [0,1,0,0,0,1|1,0,1]=4 1969 B13R1.536 C=C(CC)CNCCc1c[nH]cn1 d160a82becd4a3aa9e76f295f40b0c9c [0,1,0,0,0,1|1,0,0]=3 1970 B13R1.536 C=C(CC)CNCCc1cscn1 fab771c5691e74b4b317a9287341fa16 [0,1,0,0,0,1|2,0,0]=4 1971 B13R1.536 C=C(CC)COCCc1c[nH]cn1 c8558601bba0844c9de593a24a20cc22 [0,1,0,0,0,1|2,0,0]=4 1972 B13R1.536 C=C(CNCCc1c[nH]cn1)OC 8c6cc81d35bf5e31c71fbef191876ea7 [0,1,0,0,0,1|1,0,0]=3 1973 B13R1.536 C=C(CNCCc1cscn1)OC 67877e978893d01830dd96f34e788016 [0,1,0,0,0,1|2,0,0]=4 1974 B13R1.536 C=C(CO)CNCCc1c[nH]cn1 21cc990ce14995086d7afdfce1d7cca3 [0,1,0,0,0,1|1,0,0]=3 1975 B13R1.536 C=C(CO)CNCCc1cscn1 aad9e7963ff511956793f75e299623b8 [0,1,0,0,0,1|2,0,0]=4 1976 B13R1.536 C=C(COCCc1c[nH]cn1)OC 10fd117a12373ad73d0f709c2e0478fa [0,1,0,0,0,1|2,0,0]=4 1977 B13R1.536 C=CC(=O)CCCOc1c[nH]cn1 a96816c657ae434247b0911f404591a4 [0,1,0,0,0,1|1,0,1]=4 1978 B13R1.536 C=CC(=O)NCCNc1c[nH]cn1 3b2400ae24e0ef7e4487eb84f272693a [0,1,0,0,0,1|0,0,1]=3 1979 B13R1.536 C=CC(=O)NCCNc1c[nH]nn1 4cc8fc4a5cc6b6b560315860b4224c26 [0,1,0,0,0,1|1,0,1]=4 1980 B13R1.536 C=CC(=O)NCCNc1cocn1 88bf3b601d95f57dbae9540f4f57699d [0,1,0,0,0,1|1,0,1]=4 1981 B13R1.536 C=CC(=O)NCCNc1cscn1 0a915f7fd09eb405b2f7f7f42b1f162e [0,1,0,0,0,1|1,0,1]=4 1982 B13R1.536 C=CC(=O)NCCNc1nc[nH]n1 3967e4ab9bebbe1bf71c6a3153e14554 [0,1,0,0,0,1|1,0,1]=4 1983 B13R1.536 C=CC(=O)NCOCc1cocn1 6080275e6156e64adcb5d98571f80d41 [0,1,0,0,0,1|1,0,1]=4 1984 B13R1.536 C=CC(=O)NCOCc1cscn1 8a8298c64275bb1b85a176a6189ae605 [0,1,0,0,0,1|1,0,1]=4 1985 B13R1.536 C=CC(=O)NCOCc1nc[nH]n1 b95af077d9869f8b8acf4deca6253b20 [0,1,0,0,0,1|1,0,1]=4 1986 B13R1.536 C=CC(=O)OCCOc1c[nH]cn1 2001009b62d6cacdcaa2a126e5e9ecd3 [0,1,0,0,0,1|1,0,1]=4 1987 B13R1.536 C=CC(C)NCCCc1c[nH]cn1 3b5c59776f6dc71c79aee52e63c7246d [0,1,0,0,0,1|1,0,1]=4 1988 B13R1.536 CC(=CI)COCCc1c[nH]cn1 7f078a98415e6fd96d4628c2b25ec266 [0,1,0,0,0,1|2,0,0]=4 1989 B13R1.536 CC(C#N)CNCCc1c[nH]cn1 318e30609e037394984ef524c3988333 [0,1,0,0,0,1|1,0,1]=4 1990 B13R1.536 CC(C#N)NCCCc1c[nH]cn1 64fef83ac8bbd34dce1e74a01d57ccb4 [0,1,0,0,0,1|1,0,1]=4 1991 B13R1.536 CC(C=O)NCCCc1c[nH]cn1 a484ce7b79b7fb564c0331c4f88e9633 [0,1,0,0,0,1|0,0,1]=3 1992 B13R1.536 CC(CO)CNCCc1c[nH]cn1 98b2acf29087810457a9c9648fa9c5b0 [0,1,0,0,0,1|0,0,2]=4 1993 B13R1.536 CC(CO)NCCCc1c[nH]cn1 7ef7b457b5df2ac2885f9d1c1abcbf01 [0,1,0,0,0,1|0,0,2]=4 1994 B13R1.536 CCC(=O)CNCCc1c[nH]cn1 a3b63a1a68eae4a63b742ab1a4707cc7 [0,1,0,0,0,1|0,0,0]=2 1995 B13R1.536 CCC(=O)CNCCc1cc[nH]n1 20bfd4eb4a7e330c91cec6d87cd32f55 [0,1,0,0,0,1|2,0,0]=4 1996 B13R1.536 CCC(=O)CNCCc1ccc[nH]1 2194df23bcd90b89feb5031e72bdcd73 [0,1,0,0,0,1|1,0,1]=4 1997 B13R1.536 CCC(=O)CNCCc1ccco1 ee7703ebfb456c6bdc92966c28974af5 [0,1,0,0,0,1|2,0,0]=4 1998 B13R1.536 CCC(=O)CNCCc1cccs1 39be79fcadb2793a9286e788725ad934 [0,1,0,0,0,1|2,0,0]=4 1999 B13R1.536 CCC(=O)CNCCc1ccsc1 a2349b2eb20948a0c754a5bbd0702677 [0,1,0,0,0,1|2,0,0]=4 2000 B13R1.536 CCC(=O)CNCCc1cn[nH]c1 8e398a9200ece67a75cb97b2f254c975 [0,1,0,0,0,1|2,0,0]=4 2001 B13R1.536 CCC(=O)CNCCc1cscn1 a08ee0ef92c3cf7d3a68e4a339ba04b4 [0,1,0,0,0,1|1,0,0]=3 2002 B13R1.536 CCC(=O)CNCCc1ncc[nH]1 c92ed2b0809e6475ef7cb68505426049 [0,1,0,0,0,1|2,0,0]=4 2003 B13R1.536 CCC(=O)CNCCc1nccs1 41fcf8212ad0c7c429e86b2fbc92a2dd [0,1,0,0,0,1|2,0,0]=4 2004 B13R1.536 CCC(=O)CNCCn1cccn1 0b4aed8fb8c4c9191bd68b642611cce5 [0,1,0,0,0,1|2,0,0]=4 2005 B13R1.536 CCC(=O)CNCCn1cncn1 622a3339bcd0d7f35a50b695e6a359e0 [0,1,0,0,0,1|1,0,1]=4 2006 B13R1.536 CCC(=O)COCCc1c[nH]cn1 5313211cc3ec143daef81f4c2ba2e753 [0,1,0,0,0,1|1,0,0]=3 2007 B13R1.536 CCC(=O)COCCc1cscn1 3e76a0d71ac311063769171a3885860e [0,1,0,0,0,1|2,0,0]=4 2008 B13R1.536 CCC(=O)NCCCc1ccco1 bb94f3047a3952db18dd94c8d959fc7f [0,1,0,0,0,1|2,0,0]=4 2009 B13R1.536 CCC(=O)NCCCc1cccs1 fa3c50c232da3dfe178ee65b2cc995a1 [0,1,0,0,0,1|2,0,0]=4 2010 B13R1.536 CCC(=O)NCCCn1cccn1 2faa3aa810542aba509f9cf60c1e77ae [0,1,0,0,0,1|2,0,0]=4 2011 B13R1.536 CCC(=O)NCCCn1cncn1 c864236f7e1c2d47f6a19cf7531550be [0,1,0,0,0,1|1,0,1]=4 2012 B13R1.536 CCC(=O)NCCNc1c[nH]cn1 9d0a157d1316e53cfa0a7dc81b53fcd2 [0,1,0,0,0,1|0,0,0]=2 2013 B13R1.536 CCC(=O)NCCNc1c[nH]nn1 0bbadf4555d34004facb3053678745e4 [0,1,0,0,0,1|1,0,0]=3 2014 B13R1.536 CCC(=O)NCCNc1cc[nH]n1 f75d1314917c8acf50e7e25543190f5e [0,1,0,0,0,1|2,0,0]=4 2015 B13R1.536 CCC(=O)NCCNc1ccco1 504d4d17dc3405cf6acb86ee62c4fea8 [0,1,0,0,0,1|2,0,0]=4 2016 B13R1.536 CCC(=O)NCCNc1cccs1 7c9a7f7a2f701af8d02ca988c4deaf50 [0,1,0,0,0,1|2,0,0]=4 2017 B13R1.536 CCC(=O)NCCNc1ccoc1 2f3e6f6a9640665e37eea24dba9c0c4e [0,1,0,0,0,1|2,0,0]=4 2018 B13R1.536 CCC(=O)NCCNc1ccon1 77073d78cbda8936b91afcb0d0e41246 [0,1,0,0,0,1|2,0,0]=4 2019 B13R1.536 CCC(=O)NCCNc1ccsc1 741deaf9ec34ab081ce438ce9eac5588 [0,1,0,0,0,1|2,0,0]=4 2020 B13R1.536 CCC(=O)NCCNc1ccsn1 31dff61882b5788b80552aa72c8903c0 [0,1,0,0,0,1|2,0,0]=4 2021 B13R1.536 CCC(=O)NCCNc1cn[nH]c1 f25477a8df2270ade344e8b1b9d0bd95 [0,1,0,0,0,1|2,0,0]=4 2022 B13R1.536 CCC(=O)NCCNc1cncs1 97a22777f36fca71acf3af11b7b03dd3 [0,1,0,0,0,1|1,0,1]=4 2023 B13R1.536 CCC(=O)NCCNc1cnsn1 dd0fa45aaeabf3db770670d627d542d7 [0,1,0,0,0,1|1,0,1]=4 2024 B13R1.536 CCC(=O)NCCNc1cocn1 d0d6332766a1e8a5c783150f7f63944d [0,1,0,0,0,1|1,0,0]=3 2025 B13R1.536 CCC(=O)NCCNc1cscn1 d531c1a4914c57bf0883f8637a3addfe [0,1,0,0,0,1|1,0,0]=3 2026 B13R1.536 CCC(=O)NCCNc1ncc[nH]1 beba569a8976f91c12fc3a88132fe77c [0,1,0,0,0,1|2,0,0]=4 2027 B13R1.536 CCC(=O)NCCNc1ncco1 0ef473a257cd99f24ec8f70b01b3401f [0,1,0,0,0,1|2,0,0]=4 2028 B13R1.536 CCC(=O)NCCNc1nccs1 e25dff6b7f2a0b369343d0760b2f7dbb [0,1,0,0,0,1|2,0,0]=4 2029 B13R1.536 CCC(=O)NCCNc1ncns1 c10a0df905d31a84a7a0dd5dbd129308 [0,1,0,0,0,1|1,0,1]=4 2030 B13R1.536 CCC(=O)OCNCc1c[nH]nn1 39df5e19b607f88a5d3a5b93595c5c1e [0,1,0,0,0,1|2,0,0]=4 2031 B13R1.536 CCC(=O)OCNCc1cc[nH]c1 5aed1d6db0949aa719ca7e5e5065e8b8 [0,1,0,0,0,1|2,0,0]=4 2032 B13R1.536 CCC(=O)OCNCc1cscn1 2f9fd6b4e32ae19dda0ee89235859692 [0,1,0,0,0,1|2,0,0]=4 2033 B13R1.536 CCC(=O)OCOCc1cc[nH]c1 afa258b0ece9e02314ac63f3c166c0bc [0,1,0,0,0,1|2,0,0]=4 2034 B13R1.536 CCC(=O)OCOCc1cscn1 2a76ed2e4c659f0750920697a4deb8c0 [0,1,0,0,0,1|2,0,0]=4 2035 B13R1.536 CCC(=O)OCOCc1nc[nH]n1 8e72e212849952c643451e7fa5661246 [0,1,0,0,0,1|2,0,0]=4 2036 B13R1.536 CCC(C)CNCCc1c[nH]cn1 5e7b70421061d77ef0dcee1def39805f [0,1,0,0,0,1|1,0,1]=4 2037 B13R1.536 CCC(C)NCCCc1c[nH]cn1 f1d05677483cb6ea04e684bf5372a562 [0,1,0,0,0,1|1,0,1]=4 2038 B13R1.536 CCC(O)CNCCc1c[nH]cn1 4632a2c03f542fb9a4777de59b434cbd [0,1,0,0,0,1|0,0,2]=4 2039 B13R1.536 CC[C@@H](C)CNCCc1c[nH]cn1 23f943e613b3d7b5193e10d696e2208a [0,1,0,0,0,1|1,0,1]=4 2040 B13R1.536 CC[C@@H](O)CNCCc1c[nH]cn1 374b91afc9fd9eed7f67f9c6d8591b67 [0,1,0,0,0,1|0,0,2]=4 2041 B13R1.536 CC[C@H](C)CNCCc1c[nH]cn1 eaea1835c09d0955e413347bf21b0cf8 [0,1,0,0,0,1|1,0,1]=4 2042 B13R1.536 CNC(=O)CCCNc1cocn1 c5e89048cf4333b1566052974f668bc9 [0,1,0,0,0,1|2,0,0]=4 2043 B13R1.536 CNC(=O)CCCNc1cscn1 a05d0afbefc54872f45d4bbf8f8b7baf [0,1,0,0,0,1|2,0,0]=4 2044 B13R1.536 CNC(=O)CCCNc1nc[nH]n1 7e98cac61f94a3aeaee64414b428cbb5 [0,1,0,0,0,1|2,0,0]=4 2045 B13R1.536 CNC(=O)CCCOc1c[nH]cn1 bb8d10363cb6b2b7fb12c7a0624f44e1 [0,1,0,0,0,1|1,0,0]=3 2046 B13R1.536 CNC(=O)CCNCc1c[nH]nn1 6b64f55c76fb48a5aad721b65cdaaf07 [0,1,0,0,0,1|2,0,0]=4 2047 B13R1.536 CNC(=O)CCNCc1cc[nH]c1 f6bebb76d6357bdef21d492442a05ef9 [0,1,0,0,0,1|2,0,0]=4 2048 B13R1.536 CNC(=O)CCNCc1cocn1 36516e0964c630e1920d284ea7c30eaf [0,1,0,0,0,1|2,0,0]=4 2049 B13R1.536 CNC(=O)CCNCc1cscn1 d9c77ccbaa41957cfdaecf293b57962c [0,1,0,0,0,1|2,0,0]=4 2050 B13R1.536 CNC(=O)CCOCc1cc[nH]c1 203b6ba8d3d2ca33f2a6365d0c2246ec [0,1,0,0,0,1|2,0,0]=4 2051 B13R1.536 CNC(=O)CCOCc1cocn1 eeebfd67fe10ffac838edca8a175df4f [0,1,0,0,0,1|2,0,0]=4 2052 B13R1.536 CNC(=O)CCOCc1cscn1 e93acc0afeda1e84dba522e903928db8 [0,1,0,0,0,1|2,0,0]=4 2053 B13R1.536 CNC(=O)CCOCc1nc[nH]n1 58bcaccb996e2c4c90b2fb2cbb530287 [0,1,0,0,0,1|2,0,0]=4 2054 B13R1.536 CNC(=O)CNCCc1c[nH]cn1 36d3ec7ea0e04f8950f00ebe8b5f4cad [0,1,0,0,0,1|0,0,0]=2 2055 B13R1.536 CNC(=O)CNCCc1cc[nH]n1 2a9d541e7861e3395f2f810faa58f773 [0,1,0,0,0,1|2,0,0]=4 2056 B13R1.536 CNC(=O)CNCCc1ccc[nH]1 503a3688b1ef22135c41f51e0e0a4ae0 [0,1,0,0,0,1|1,0,1]=4 2057 B13R1.536 CNC(=O)CNCCc1ccco1 1a5a87cba9705e054ce8bd5fafe1bc02 [0,1,0,0,0,1|2,0,0]=4 2058 B13R1.536 CNC(=O)CNCCc1cccs1 06b7339798871e0ee12e74df7b1b2b5f [0,1,0,0,0,1|2,0,0]=4 2059 B13R1.536 CNC(=O)CNCCc1ccsc1 0396253d095ee139f6bffa66c7f1c5ac [0,1,0,0,0,1|2,0,0]=4 2060 B13R1.536 CNC(=O)CNCCc1cn[nH]c1 36057c851241b32de3a1e71c0cb6b60f [0,1,0,0,0,1|2,0,0]=4 2061 B13R1.536 CNC(=O)CNCCc1cscn1 7e4efc71739ddbdb9efcd74af7693778 [0,1,0,0,0,1|1,0,0]=3 2062 B13R1.536 CNC(=O)CNCCc1ncc[nH]1 46456068ea7097f0d18d7055d952b906 [0,1,0,0,0,1|2,0,0]=4 2063 B13R1.536 CNC(=O)CNCCc1nccs1 2860d8b37d1c10306dca72e476a1cfdd [0,1,0,0,0,1|2,0,0]=4 2064 B13R1.536 CNC(=O)CNCCc1ncon1 d39be732fe44e28eb528e39da551f8f1 [0,1,0,0,0,1|2,0,0]=4 2065 B13R1.536 CNC(=O)CNCCn1cccn1 02489ef6c4b20d653eb62a6df0700d7a [0,1,0,0,0,1|2,0,0]=4 2066 B13R1.536 CNC(=O)CNCCn1cncn1 e0ffbff4483869d79975441daf22180c [0,1,0,0,0,1|1,0,1]=4 2067 B13R1.536 CNC(=O)COCCc1c[nH]cn1 cf8852928f5c29299a6a36d66b52a3ac [0,1,0,0,0,1|1,0,0]=3 2068 B13R1.536 CNC(=O)COCCc1cscn1 81bba9cb9c58339f9554c8b522329558 [0,1,0,0,0,1|2,0,0]=4 2069 B13R1.536 COC(=O)/C=C/COc1c[nH]cn1 28efe92cc2334ad7305c2a7c6ee1fbaa [0,1,0,0,0,1|1,0,1]=4 2070 B13R1.536 COC(=O)/C=C\COc1c[nH]cn1 2724de602b21372011ea287bfe2cab78 [0,1,0,0,0,1|1,0,1]=4 2071 B13R1.536 COC(=O)C#CCOc1c[nH]cn1 414c1f7fa3582d1474d2d2ab483b5653 [0,1,0,0,0,1|1,0,1]=4 2072 B13R1.536 COC(=O)C=CCOc1c[nH]cn1 6987051e98a9557392517524f537d818 [0,1,0,0,0,1|1,0,1]=4 2073 B13R1.536 COC(=O)CCCNc1c[nH]cn1 cda4d8503661ef8ae325fecd2d33ecd2 [0,1,0,0,0,1|1,0,0]=3 2074 B13R1.536 COC(=O)CCCNc1c[nH]nn1 a67fc37e83da1ec1d8512f92a555f25e [0,1,0,0,0,1|2,0,0]=4 2075 B13R1.536 COC(=O)CCCNc1cocn1 befb881aa0a1ddcc512e2b45930c5084 [0,1,0,0,0,1|2,0,0]=4 2076 B13R1.536 COC(=O)CCCNc1cscn1 994c9f6641378032df351e81d0f8f4d9 [0,1,0,0,0,1|2,0,0]=4 2077 B13R1.536 COC(=O)CCCNc1nc[nH]n1 4d7e7fe772c831e491a51e2e5c8538e8 [0,1,0,0,0,1|2,0,0]=4 2078 B13R1.536 COC(=O)CCCOc1c[nH]cn1 8c45a96202acd563c1d5f64e9c8365d4 [0,1,0,0,0,1|1,0,0]=3 2079 B13R1.536 COC(=O)CCNCc1c[nH]nn1 87be57a54f1db4f8fdb7515d3b5e3ecb [0,1,0,0,0,1|2,0,0]=4 2080 B13R1.536 COC(=O)CCNCc1cc[nH]c1 29654276a444f5fdc588131dcaf16bbc [0,1,0,0,0,1|2,0,0]=4 2081 B13R1.536 COC(=O)CCNCc1cocn1 beaaab83ef3b6b04c22d3172aaece760 [0,1,0,0,0,1|2,0,0]=4 2082 B13R1.536 COC(=O)CCNCc1cscn1 0e1be4134cd6e14faf4271fa9d66d26d [0,1,0,0,0,1|2,0,0]=4 2083 B13R1.536 COC(=O)CCOCc1cc[nH]c1 6b3fee10a92cbb7a6ce1e0ef4d8e1bda [0,1,0,0,0,1|2,0,0]=4 2084 B13R1.536 COC(=O)CCOCc1cocn1 aebf4c30b745e4c33f70f2cb89747d0b [0,1,0,0,0,1|2,0,0]=4 2085 B13R1.536 COC(=O)CCOCc1cscn1 06a177635a7e26ddf0d4e20ecc4f0125 [0,1,0,0,0,1|2,0,0]=4 2086 B13R1.536 COC(=O)CCOCc1nc[nH]n1 8e13f6034d0f3e63892ecfd998355e86 [0,1,0,0,0,1|2,0,0]=4 2087 B13R1.536 COC(=O)CNCCc1c[nH]cn1 61f3aabba43484166f0864ac2c25164d [0,1,0,0,0,1|0,0,0]=2 2088 B13R1.536 COC(=O)CNCCc1cc[nH]n1 beb95f375079b9082faaa840544f5a34 [0,1,0,0,0,1|2,0,0]=4 2089 B13R1.536 COC(=O)CNCCc1ccc[nH]1 0d413bf5ba5bc28cab5a57b32609afc6 [0,1,0,0,0,1|1,0,1]=4 2090 B13R1.536 COC(=O)CNCCc1ccco1 81915a487d2994bd56544b0cf5157e9d [0,1,0,0,0,1|2,0,0]=4 2091 B13R1.536 COC(=O)CNCCc1cccs1 daf68b0b1bfed2d124381272699778fb [0,1,0,0,0,1|2,0,0]=4 2092 B13R1.536 COC(=O)CNCCc1ccsc1 78715f5195b954724de2118620f0d5a1 [0,1,0,0,0,1|2,0,0]=4 2093 B13R1.536 COC(=O)CNCCc1cn[nH]c1 2a690cc1bdb6100786f81e4ecfbbb0bd [0,1,0,0,0,1|2,0,0]=4 2094 B13R1.536 COC(=O)CNCCc1cscn1 0208c8d564252ab3090c470fd684e82a [0,1,0,0,0,1|1,0,0]=3 2095 B13R1.536 COC(=O)CNCCc1ncc[nH]1 89853605391a751ae7ad022201eca71c [0,1,0,0,0,1|2,0,0]=4 2096 B13R1.536 COC(=O)CNCCc1nccs1 c72de22230d0671223ccc9bc180a8d47 [0,1,0,0,0,1|2,0,0]=4 2097 B13R1.536 COC(=O)CNCCc1ncon1 8c13d93fa5533e6003842bd8e4c203af [0,1,0,0,0,1|2,0,0]=4 2098 B13R1.536 COC(=O)CNCCn1cccn1 2432487d7f3ca2b41579436cacab6243 [0,1,0,0,0,1|2,0,0]=4 2099 B13R1.536 COC(=O)CNCCn1cncn1 2e53329d031e9170b0e4fdc25a9919bb [0,1,0,0,0,1|1,0,1]=4 2100 B13R1.536 COC(=O)COCCc1c[nH]cn1 c9c6c79172a784aabe21d50d7613bd2d [0,1,0,0,0,1|1,0,0]=3 2101 B13R1.536 COC(=O)COCCc1cscn1 12c79a7cb7f22a92e62fb43f14cb06fc [0,1,0,0,0,1|2,0,0]=4 2102 B13R1.536 COC(=O)OCNCc1c[nH]nn1 52fb306dfe76051e56ff787402a0ab5f [0,1,0,0,0,1|2,0,0]=4 2103 B13R1.536 COC(=O)OCNCc1cc[nH]c1 adc726134337f172d79d78ba18ae7f48 [0,1,0,0,0,1|2,0,0]=4 2104 B13R1.536 COC(=O)OCNCc1cscn1 7f50a53163b0107e8f488a0afea03e06 [0,1,0,0,0,1|2,0,0]=4 2105 B13R1.536 COC(=O)OCOCc1cc[nH]c1 cdced8eeb70b553a637180e9e0cf4542 [0,1,0,0,0,1|2,0,0]=4 2106 B13R1.536 COC(=O)OCOCc1cscn1 2010590ce9988dbae17f6ba6d373434b [0,1,0,0,0,1|2,0,0]=4 2107 B13R1.536 COC(=O)OCOCc1nc[nH]n1 25e6fe96851a4f42e0d0f97026e42f10 [0,1,0,0,0,1|2,0,0]=4 2108 B13R1.536 COC(C)CNCCc1c[nH]cn1 782ef7bfe00913bdc465eaa3661259b6 [0,1,0,0,0,1|0,0,2]=4 2109 B13R1.536 CO[C@@H](C)CNCCc1c[nH]cn1 c80c3957fe01a93895986202d19046bf [0,1,0,0,0,1|0,0,2]=4 2110 B13R1.536 CO[C@H](C)CNCCc1c[nH]cn1 c890c70e1d7a8c856d371f68705970a3 [0,1,0,0,0,1|0,0,2]=4 2111 B13R1.536 C[C@@H](CO)CNCCc1c[nH]cn1 28a4953e2a4a20a2f18bdcf6023a5522 [0,1,0,0,0,1|0,0,2]=4 2112 B13R1.536 C[C@@H](CO)NCCCc1c[nH]cn1 ab8c9d772517c036b760799240e95fa9 [0,1,0,0,0,1|0,0,2]=4 2113 B13R1.536 C[C@H](C=O)NCCCc1c[nH]cn1 c48b9c419b0159458a9880ff3e657e05 [0,1,0,0,0,1|0,0,1]=3 2114 B13R1.536 C[C@H](CO)CNCCc1c[nH]cn1 ab03ae616fcdbaf43613f6a297774112 [0,1,0,0,0,1|0,0,2]=4 2115 B13R1.536 C[C@H](CO)NCCCc1c[nH]cn1 f5a0f80e70d749fea3c21dff2dbfea7e [0,1,0,0,0,1|0,0,2]=4 2116 B13R1.536 Cl/C=C(\Cl)/CNCCc1c[nH]cn1 9008f57f6f59095a21d3f1dc7b7e98f2 [0,1,0,0,0,1|1,0,1]=4 2117 B13R1.536 O=C(CF)NCCCc1ccco1 8c7e8a1d4b76da79805710978e987ec1 [0,1,0,0,0,1|2,0,0]=4 2118 B13R1.536 O=C(CF)NCCCc1cccs1 953723f12da45a24b335d724b70ea1fc [0,1,0,0,0,1|2,0,0]=4 2119 B13R1.536 O=C(CF)NCCCn1cccn1 bebe9befdc3a3e5c8cfe4c36dc72950c [0,1,0,0,0,1|2,0,0]=4 2120 B13R1.536 O=C(CF)NCCCn1cncn1 b6366e31a4bb51d3449e6b271df26af3 [0,1,0,0,0,1|1,0,1]=4 2121 B13R1.536 O=C(CNCCc1c[nH]cn1)NO 19d686a769efd7127a76d3104e6a1c84 [0,1,0,0,0,1|1,0,0]=3 2122 B13R1.536 O=C(CNCCc1cscn1)NO ad491b21d8db5379498fbb7cfdf9d95e [0,1,0,0,0,1|2,0,0]=4 2123 B13R1.536 O=C(CO)CNCCc1c[nH]cn1 6bc61756528b659e629e807d5d942a7c [0,1,0,0,0,1|0,0,0]=2 2124 B13R1.536 O=C(CO)CNCCc1cc[nH]n1 8f8cb33e2c0e87f5f5a03078933ac462 [0,1,0,0,0,1|2,0,0]=4 2125 B13R1.536 O=C(CO)CNCCc1ccc[nH]1 d2ab04243b1c90a7022e9de3f1e176a5 [0,1,0,0,0,1|1,0,1]=4 2126 B13R1.536 O=C(CO)CNCCc1ccco1 1b10aa3ef4fe6f4c50b32f37ca028116 [0,1,0,0,0,1|2,0,0]=4 2127 B13R1.536 O=C(CO)CNCCc1cccs1 e4f643756db414a89f0776d058415cc9 [0,1,0,0,0,1|2,0,0]=4 2128 B13R1.536 O=C(CO)CNCCc1ccsc1 8cd2111e88887ad04713371f0854183a [0,1,0,0,0,1|2,0,0]=4 2129 B13R1.536 O=C(CO)CNCCc1cn[nH]c1 f233cddbd0f5eab398dac64986bcd6a3 [0,1,0,0,0,1|2,0,0]=4 2130 B13R1.536 O=C(CO)CNCCc1cscn1 b4d5d4422f5f7da3a51f174738bf642b [0,1,0,0,0,1|1,0,0]=3 2131 B13R1.536 O=C(CO)CNCCc1ncc[nH]1 ee04616012d785de0950f86b954ecf58 [0,1,0,0,0,1|2,0,0]=4 2132 B13R1.536 O=C(CO)CNCCc1nccs1 86f890a662f6163b0d36f988bfcb1baa [0,1,0,0,0,1|2,0,0]=4 2133 B13R1.536 O=C(CO)CNCCn1cccn1 a8da4dee03ac954801326edac5615a77 [0,1,0,0,0,1|2,0,0]=4 2134 B13R1.536 O=C(CO)CNCCn1cncn1 462032ba26f388f5a194a20a837fd84a [0,1,0,0,0,1|1,0,1]=4 2135 B13R1.536 O=C(CO)NCCCc1ccco1 d1e96fa66e98357939890dd570d4fb8c [0,1,0,0,0,1|2,0,0]=4 2136 B13R1.536 O=C(CO)NCCCc1cccs1 44e41264c21a25665a9b95cecfe63498 [0,1,0,0,0,1|2,0,0]=4 2137 B13R1.536 O=C(CO)NCCCn1cccn1 a8355b8f3078704317de21840b64082d [0,1,0,0,0,1|2,0,0]=4 2138 B13R1.536 O=C(CO)NCCCn1cncn1 da3dd319cde6eee56baead392a990329 [0,1,0,0,0,1|1,0,1]=4 2139 B13R1.536 O=C(CS)NCCCc1ccco1 c770a3a7b78908257f02dd81d0b02b1d [0,1,0,0,0,1|2,0,0]=4 2140 B13R1.536 O=C(CS)NCCCc1cccs1 b9faaf4d81d9f81ccdd4030c41cdb6bd [0,1,0,0,0,1|2,0,0]=4 2141 B13R1.536 O=C(CS)NCCCn1cccn1 5adb71f02db30a36c108db4b0eeb0131 [0,1,0,0,0,1|2,0,0]=4 2142 B13R1.536 O=C(CS)NCCCn1cncn1 4cce77919523f45c9a365b199b55526a [0,1,0,0,0,1|1,0,1]=4 2143 B13R1.536 OC(CF)CNCCc1c[nH]cn1 9a5c36a3d4827b29a065fe2ceb5cca68 [0,1,0,0,0,1|0,0,2]=4 2144 B13R1.536 OCC(F)CNCCc1c[nH]cn1 0f9b22bdb18720cdf760384fd099a4d9 [0,1,0,0,0,1|1,0,1]=4 2145 B13R1.536 OCC(O)CNCCc1c[nH]cn1 81c4c1bcd3047269bed08eca62eb94e6 [0,1,0,0,0,1|0,0,2]=4 2146 B13R1.536 OC[C@@H](F)CNCCc1c[nH]cn1 81a00985ca2ba00e6f29ef6947046f4f [0,1,0,0,0,1|1,0,1]=4 2147 B13R1.536 OC[C@@H](O)CNCCc1c[nH]cn1 ff7fadacb51baa70542ee8d6f6cdb882 [0,1,0,0,0,1|0,0,2]=4 2148 B13R1.536 OC[C@H](F)CNCCc1c[nH]cn1 17b50dad73498a30bd595b34753f8f6c [0,1,0,0,0,1|1,0,1]=4 2149 B13R1.536 OC[C@H](O)CNCCc1c[nH]cn1 7d660d56cdf7cd4349c2966c428c6207 [0,1,0,0,0,1|0,0,2]=4 2150 B13R1.593 CC(=O)NC(=O)CNc1cocn1 26a92d228e610a7f6ba45a46d9dc5867 [0,1,0,0,0,1|1,0,1]=4 2151 B13R1.593 CC(=O)NC(=O)CNc1cscn1 97998bcb93e63ddf87c403091408df6f [0,1,0,0,0,1|1,0,1]=4 2152 B13R1.593 CC(=O)NC(=O)COc1c[nH]cn1 395607bea643729908b5eaef6935623b [0,1,0,0,0,1|0,0,1]=3 2153 B13R1.593 CC(=O)NC(C)CCc1ccco1 96b66e2bb7e5e06e03252922c10be4f0 [0,1,0,0,0,1|2,0,0]=4 2154 B13R1.593 CC(=O)NC(C)CCn1cccn1 dda6ef3bf38ef92bc38b08cd612fb31b [0,1,0,0,0,1|2,0,0]=4 2155 B13R1.593 CC(=O)OC(C)NCc1c[nH]nn1 f3013d433245c1eabd189c39ec5d25bc [0,1,0,0,0,1|2,0,0]=4 2156 B13R1.593 CC(=O)OC(C)NCc1cc[nH]c1 cf416037b2b02b9dc1815ea2a5a7e8d1 [0,1,0,0,0,1|2,0,0]=4 2157 B13R1.593 CC(=O)OC(C)NCc1cscn1 1ca90c1c4898d2fb85aac4925f28fbdf [0,1,0,0,0,1|2,0,0]=4 2158 B13R1.593 CC(=O)OC(C)OCc1cc[nH]c1 7acefc8848aaf9265c900d2a64474006 [0,1,0,0,0,1|2,0,0]=4 2159 B13R1.593 CC(=O)OC(C)OCc1cocn1 cd5fe15286ff0c992698a00877007e9c [0,1,0,0,0,1|2,0,0]=4 2160 B13R1.593 CC(=O)OC(C)OCc1cscn1 9b18275563c5e1276750043c7aea6d52 [0,1,0,0,0,1|2,0,0]=4 2161 B13R1.593 CC(=O)OC(C)OCc1nc[nH]n1 5c176853dc231402aafecd8ba3e85008 [0,1,0,0,0,1|2,0,0]=4 2162 B13R1.593 CC(C)CN(C)CCc1c[nH]cn1 62b2098470f632a80a867347b9521be5 [0,1,0,0,0,1|1,0,1]=4 2163 B13R1.593 CC(O)CN(C)CCc1c[nH]cn1 43b0cda4c8111505f2f0290c49889295 [0,1,0,0,0,1|0,0,2]=4 2164 B13R1.593 CN(CCc1c[nH]cn1)CC(=O)N 9ce2f25975ecd0d8516124bf84a68943 [0,1,0,0,0,1|1,0,0]=3 2165 B13R1.593 CN(CCc1c[nH]cn1)CC(=O)O 3430a3035c4f7bf6b2f653755583aa68 [0,1,0,0,0,1|1,0,0]=3 2166 B13R1.593 CN(CCc1cscn1)CC(=O)N e6720eadf5fb5bff29c59fd8f5b9e0a1 [0,1,0,0,0,1|2,0,0]=4 2167 B13R1.593 CN(CCc1cscn1)CC(=O)O b3ce457d45c22ac38b17260c666f1ac3 [0,1,0,0,0,1|2,0,0]=4 2168 B13R1.593 C[C@H](O)CN(C)CCc1c[nH]cn1 440e6dec46047472ebaaa07625b542fa [0,1,0,0,0,1|0,0,2]=4 2169 B13R1.593 O=C(O)CC(O)CNc1c[nH]cn1 a5ddce004a5813f85908e92ee3a84a26 [0,1,0,0,0,1|2,0,0]=4 2170 B13R1.593 O=C(O)C[C@@H](O)CNc1c[nH]cn1 876ffb1e2dec041fe028b084f29b78fc [0,1,0,0,0,1|2,0,0]=4 2171 B13R1.593 O=C(O)C[C@H](O)CNc1c[nH]cn1 0ec97da2d9636af6dcfe0647de5c9751 [0,1,0,0,0,1|2,0,0]=4 2172 B13R1.1110 C=C(C)C(=O)NCCc1cscn1 81131e11165299293fa2fa710631725a [0,1,0,0,0,1|2,0,0]=4 2173 B13R1.1110 CC(=O)C(=O)CNCc1c[nH]nn1 357e1c779e7b3d651d4d56fc413ad352 [0,1,0,0,0,1|2,0,0]=4 2174 B13R1.1110 CC(=O)C(=O)CNCc1cc[nH]c1 8173e13dd2f93bbc3bca0fbf015ebad2 [0,1,0,0,0,1|2,0,0]=4 2175 B13R1.1110 CC(=O)C(=O)CNCc1cocn1 6e85f193dfc18973b6e596e87acff8ee [0,1,0,0,0,1|2,0,0]=4 2176 B13R1.1110 CC(=O)C(=O)CNCc1cscn1 8bd08d3dfca8d3274765bef4bdc18924 [0,1,0,0,0,1|2,0,0]=4 2177 B13R1.1110 CC(=O)C(=O)COCc1cc[nH]c1 2728b778d74a08a3443fc8034da96400 [0,1,0,0,0,1|2,0,0]=4 2178 B13R1.1110 CC(=O)C(=O)COCc1cocn1 c35134d6624a519c521d2e9d4301c736 [0,1,0,0,0,1|2,0,0]=4 2179 B13R1.1110 CC(=O)C(=O)COCc1cscn1 987ff949267954c8453c8af93180f8a3 [0,1,0,0,0,1|2,0,0]=4 2180 B13R1.1110 CC(=O)C(=O)COCc1nc[nH]n1 036b3842b63076b3ec29138ffd5caf94 [0,1,0,0,0,1|2,0,0]=4 2181 B13R1.1110 CC(=O)C(=O)NCCc1ccco1 765d25ec0170c6749eff7b4986057ad7 [0,1,0,0,0,1|2,0,0]=4 2182 B13R1.1110 CC(=O)C(=O)NCCc1cccs1 c429b4a7b0bc75ac05fa01152c010bde [0,1,0,0,0,1|2,0,0]=4 2183 B13R1.1110 CC(=O)C(=O)NCCc1ccsc1 560500410b949f44072d47c70e887f20 [0,1,0,0,0,1|2,0,0]=4 2184 B13R1.1110 CC(=O)C(=O)NCCc1cscn1 4f454ede73e647a7a91e06f60209d9eb [0,1,0,0,0,1|1,0,0]=3 2185 B13R1.1110 CC(=O)C(=O)NCCc1nccs1 acbc6f271a74326f6ea8b809a9161de5 [0,1,0,0,0,1|2,0,0]=4 2186 B13R1.1110 CC(=O)C(=O)NCCn1cccn1 16a89fd33c9d5d03e3296d1a53382e38 [0,1,0,0,0,1|2,0,0]=4 2187 B13R1.1110 CC(=O)C(=O)NCCn1cncn1 b590e145d54b641bd5938af39dc88008 [0,1,0,0,0,1|1,0,1]=4 2188 B13R1.1110 CC(=O)C(C)COCc1cocn1 9f2ed82bfe716981a2a15a8799ec9cba [0,1,0,0,0,1|2,0,0]=4 2189 B13R1.1110 CC(=O)C(C)COCc1cscn1 3304862f66ee3e63ca666482a07c8726 [0,1,0,0,0,1|2,0,0]=4 2190 B13R1.1110 CC(=O)C(C)COCc1nc[nH]n1 b814b185611ca8f44874fa53ba91aafa [0,1,0,0,0,1|2,0,0]=4 2191 B13R1.1110 CC(=O)C(C)NCCc1c[nH]cn1 91bc1b9d48db3ad6c395ddab9e0c7c80 [0,1,0,0,0,1|0,0,0]=2 2192 B13R1.1110 CC(=O)C(C)NCCc1cc[nH]n1 3bdea5526effa6bcb36856551bda9931 [0,1,0,0,0,1|2,0,0]=4 2193 B13R1.1110 CC(=O)C(C)NCCc1ccc[nH]1 a0f32026a8679369eff8b390ee549c42 [0,1,0,0,0,1|1,0,1]=4 2194 B13R1.1110 CC(=O)C(C)NCCc1ccco1 7f79e0920c416e7a11c233bb0fc17146 [0,1,0,0,0,1|2,0,0]=4 2195 B13R1.1110 CC(=O)C(C)NCCc1cccs1 f4773dc61e9dca26e24e706d2ea8a89e [0,1,0,0,0,1|2,0,0]=4 2196 B13R1.1110 CC(=O)C(C)NCCc1ccsc1 63256e226931566fc8d7e12304744773 [0,1,0,0,0,1|2,0,0]=4 2197 B13R1.1110 CC(=O)C(C)NCCc1cn[nH]c1 ea53019190646fd7fa8ccd91ccf83fe5 [0,1,0,0,0,1|2,0,0]=4 2198 B13R1.1110 CC(=O)C(C)NCCc1cscn1 dec28a63d5c43d05be1a478286bca1f1 [0,1,0,0,0,1|1,0,0]=3 2199 B13R1.1110 CC(=O)C(C)NCCc1ncc[nH]1 12fb5e3aebb2d96c29fa5c2b50649da3 [0,1,0,0,0,1|2,0,0]=4 2200 B13R1.1110 CC(=O)C(C)NCCc1nccs1 69f2f230ba3a2276fac2cc0a100e9d8e [0,1,0,0,0,1|2,0,0]=4 2201 B13R1.1110 CC(=O)C(C)NCCn1cccn1 1edbdd4b5153bfd1829a730437e7f3af [0,1,0,0,0,1|2,0,0]=4 2202 B13R1.1110 CC(=O)C(C)NCCn1cncn1 bd5c4f5883acabd9bb9b5ac432307efa [0,1,0,0,0,1|1,0,1]=4 2203 B13R1.1110 CC(=O)C(C)OCCc1c[nH]cn1 d2b3276998956ae73d609003a9a56a78 [0,1,0,0,0,1|1,0,0]=3 2204 B13R1.1110 CC(=O)C(C)OCCc1cscn1 93b758e61e9ee97438ba53c58a37a379 [0,1,0,0,0,1|2,0,0]=4 2205 B13R1.1110 CC(=O)N(C)CCCc1ccco1 c06d4923a646e2c8bff3a78dd084f2f9 [0,1,0,0,0,1|2,0,0]=4 2206 B13R1.1110 CC(=O)N(C)CCCn1cccn1 bcafa42fa266b882e04414bcb157f481 [0,1,0,0,0,1|2,0,0]=4 2207 B13R1.1110 CC(C)C(C)NCCc1c[nH]cn1 73e2756d5324aeb4289d3d69fcdca28a [0,1,0,0,0,1|1,0,1]=4 2208 B13R1.1110 CC(C)N(C)CCNc1c[nH]cn1 d5929df3868a1befef861996ecdfdb98 [0,1,0,0,0,1|1,0,1]=4 2209 B13R1.1110 CC(C)[C@@H](C)NCCc1c[nH]cn1 b71d6155b9ca63629e0bf29fc7b01a3a [0,1,0,0,0,1|1,0,1]=4 2210 B13R1.1110 CC(C)[C@H](C)NCCc1c[nH]cn1 646777403e3fdde9b8b131ff4a104cec [0,1,0,0,0,1|1,0,1]=4 2211 B13R1.1110 CC(NCCc1c[nH]cn1)C(=O)N 448def98eb7e204c89c6ce3ae38217d1 [0,1,0,0,0,1|1,0,0]=3 2212 B13R1.1110 CC(NCCc1c[nH]cn1)C(=O)O 44e4a5ba2fb8614c2e1af40a3d6a7705 [0,1,0,0,0,1|1,0,0]=3 2213 B13R1.1110 CC(NCCc1cscn1)C(=O)N 2f4bb26223eb76e75da22b34b7affacd [0,1,0,0,0,1|2,0,0]=4 2214 B13R1.1110 CC(NCCc1cscn1)C(=O)O a6126d5df9d723cec185c27a6661c9a3 [0,1,0,0,0,1|2,0,0]=4 2215 B13R1.1110 CC(O)C(C)NCCc1c[nH]cn1 b7cbc6717022a0a0dc24efba2cf6722b [0,1,0,0,0,1|0,0,2]=4 2216 B13R1.1110 CC(OCCc1c[nH]cn1)C(=O)N 06843edb8a3f84f61758a6226ac30bd1 [0,1,0,0,0,1|2,0,0]=4 2217 B13R1.1110 CC(OCCc1c[nH]cn1)C(=O)O f8089cd58e68682577a727655d2b48b6 [0,1,0,0,0,1|2,0,0]=4 2218 B13R1.1110 C[C@@H](NCCc1c[nH]cn1)C(=O)N bf68b82800b207d65394004e3e006656 [0,1,0,0,0,1|1,0,0]=3 2219 B13R1.1110 C[C@@H](NCCc1c[nH]cn1)C(=O)O 7cecd85b3c078a94f96d3c56ed5e6407 [0,1,0,0,0,1|1,0,0]=3 2220 B13R1.1110 C[C@@H](NCCc1cscn1)C(=O)N 0233840041421c9a0d7e90493bd62739 [0,1,0,0,0,1|2,0,0]=4 2221 B13R1.1110 C[C@@H](NCCc1cscn1)C(=O)O 648ef6e446a80b45e10ada1e5e632623 [0,1,0,0,0,1|2,0,0]=4 2222 B13R1.1110 C[C@@H](OCCc1c[nH]cn1)C(=O)N e28fe78bb1d686a36c0f07152c23845f [0,1,0,0,0,1|2,0,0]=4 2223 B13R1.1110 C[C@@H](OCCc1c[nH]cn1)C(=O)O f5c547713627fedfb52ff079c48cac95 [0,1,0,0,0,1|2,0,0]=4 2224 B13R1.1110 C[C@H](NCCc1c[nH]cn1)C(=O)N 5895b3b6b82e957afe245cc34bbed961 [0,1,0,0,0,1|1,0,0]=3 2225 B13R1.1110 C[C@H](NCCc1c[nH]cn1)C(=O)O 607593da3d4edb068c189c79cf429271 [0,1,0,0,0,1|1,0,0]=3 2226 B13R1.1110 C[C@H](NCCc1cscn1)C(=O)N 18ac800e28b2c4728b6dba0e7266223c [0,1,0,0,0,1|2,0,0]=4 2227 B13R1.1110 C[C@H](NCCc1cscn1)C(=O)O f5fd1b8714fd0e764bcd3bde3481647b [0,1,0,0,0,1|2,0,0]=4 2228 B13R1.1110 C[C@H](OCCc1c[nH]cn1)C(=O)N c45bb595f592a9c775210a79c3a0cd37 [0,1,0,0,0,1|2,0,0]=4 2229 B13R1.1110 C[C@H](OCCc1c[nH]cn1)C(=O)O 03c67adc6f22aadba9ab3e4a6dbc7098 [0,1,0,0,0,1|2,0,0]=4 2230 B13R1.1110 NC(=O)C(=O)NCCc1cscn1 95f1d9d453ac0363afb722af514f1896 [0,1,0,0,0,1|2,0,0]=4 2231 B13R1.1110 NC(=O)C(F)NCCc1c[nH]cn1 979a7158cb906604ca2c8e95b2444c6e [0,1,0,0,0,1|1,0,0]=3 2232 B13R1.1110 NC(=O)C(F)NCCc1cscn1 4f8943d0e6f528953650ee9408f2a14b [0,1,0,0,0,1|2,0,0]=4 2233 B13R1.1110 NC(=O)C(F)OCCc1c[nH]cn1 9b8940aba52222e1a557990863cc4d3d [0,1,0,0,0,1|2,0,0]=4 2234 B13R1.1110 O=C(O)C(F)CCNc1c[nH]cn1 de4adcc7c7bee31e996ed38c71116c00 [0,1,0,0,0,1|2,0,0]=4 2235 B13R1.1110 O=C(O)C(F)NCCc1c[nH]cn1 572d3557c67451a768ea304da22e53d6 [0,1,0,0,0,1|1,0,0]=3 2236 B13R1.1110 O=C(O)C(F)NCCc1cscn1 6a4b086f5fefa7c2264c11a4f41cf78e [0,1,0,0,0,1|2,0,0]=4 2237 B13R1.1110 O=C(O)C(F)OCCc1c[nH]cn1 bd5e644034782e4c6a0361b5f0f8948f [0,1,0,0,0,1|2,0,0]=4 2238 B13R1.1110 O=C(O)C(O)NCCc1c[nH]cn1 c78031885067bee73fa3691ccafc209a [0,1,0,0,0,1|1,0,0]=3 2239 B13R1.1110 O=C(O)C(O)NCCc1cscn1 f5bac554c1b71cab645032d41324e5ef [0,1,0,0,0,1|2,0,0]=4 2240 B13R1.1110 O=C(O)[C@H](F)NCCc1c[nH]cn1 9e70fef6b2ccdc823b0694c8055c2e59 [0,1,0,0,0,1|1,0,0]=3 2241 B13R1.1110 O=C(O)[C@H](F)OCCc1c[nH]cn1 2600b9f5f5c33e9bf7cbb98360d14448 [0,1,0,0,0,1|2,0,0]=4 2242 B13R1.2904 CC(C)(C)CNCCc1c[nH]cn1 2e18ffaae8eb5036a357925f9443a12f [0,1,0,0,0,1|1,0,1]=4 2243 B13R1.2904 CC(C)(F)CNCCc1c[nH]cn1 09a15bbcff945fa9502ea22ccc02dba6 [0,1,0,0,0,1|1,0,1]=4 2244 B13R1.2904 CC(C)(O)CNCCc1c[nH]cn1 96d4f0fe6f3239331958a28e7d1d3ee1 [0,1,0,0,0,1|0,0,2]=4 2245 B13R1.2904 CC(F)(F)CNCCc1c[nH]cn1 5baf40e58879067a555e42832c82a062 [0,1,0,0,0,1|1,0,1]=4 2246 B13R1.2904 CS(=O)(=O)CCCNc1c[nH]cn1 c2820a1686f72136e30c2f80391b6329 [0,1,0,0,0,1|2,0,0]=4 2247 B13R1.2904 CS(=O)(=O)CCCOc1c[nH]cn1 1dd7c0d1a74c692f197b7ddd0635aaa0 [0,1,0,0,0,1|2,0,0]=4 2248 B13R1.2904 CS(=O)(=O)CNCCc1c[nH]cn1 df90807d6f240b13ae199958d23f95bb [0,1,0,0,0,1|1,0,0]=3 2249 B13R1.2904 CS(=O)(=O)CNCCc1cscn1 0b3ea9fa33c792524e1b1508434948bb [0,1,0,0,0,1|2,0,0]=4 2250 B13R1.2904 CS(=O)(=O)COCCc1c[nH]cn1 4c26299a7b5a415ac074dcb8b9ac3ddd [0,1,0,0,0,1|2,0,0]=4 2251 B13R1.2904 CS(=O)(=O)NCCNc1cocn1 91aae2104c633db7a35a91d6edacd878 [0,1,0,0,0,1|2,0,0]=4 2252 B13R1.2904 CS(=O)(=O)NCCNc1cscn1 1bcb4f2a15c3d6a0ddb0fdf95138f8a6 [0,1,0,0,0,1|2,0,0]=4 2253 B13R1.2904 CS(=O)(=O)NCCNc1nc[nH]n1 00f5e98d5578dd5b296c87b36cbf0cf5 [0,1,0,0,0,1|2,0,0]=4 2254 B13R1.2904 CS(=O)(=O)NCCOc1c[nH]cn1 cd769b673c3b5aba3a52458dee4b1e5f [0,1,0,0,0,1|1,0,0]=3 2255 B13R1.2904 CS(=O)(=O)OCCOc1c[nH]cn1 49905f9258b792a92ca0401e2f0a1d63 [0,1,0,0,0,1|2,0,0]=4 2256 B13R1.2904 NS(=O)(=O)CNCCc1c[nH]cn1 84b46e8dcef2779a6d5c3af5b2e9c295 [0,1,0,0,0,1|2,0,0]=4 2257 B13R1.2904 O=S(=O)(Cl)NCCOc1c[nH]cn1 ad596fddae02d77f25a0a8fbaf9d265f [0,1,0,0,0,1|2,0,0]=4 2258 B13R1.2904 O=S(=O)(O)CNCCc1c[nH]cn1 b13e70b09e9c3c2589d92c8d08ef9695 [0,1,0,0,0,1|2,0,0]=4 2259 B13R1.129 CC(=O)NCC(C)c1nc(cs1)C fc52ac265d6626c20d3c19a7e2091d27 [0,2,0,0,0,0|2,0,0]=4 2260 B13R1.129 CC(=O)NCC(C)n1ccc(n1)C eb52f0f67ae4414582e9cc8c0fe3e4d6 [0,2,0,0,0,0|2,0,0]=4 2261 B13R1.162 CC(CNC(=O)CF)n1cccn1 3af80dd9041c64f9c05e3bda8376b6e8 [0,2,0,0,0,0|2,0,0]=4 2262 B13R1.162 CC(CNC(=O)CF)n1cncn1 b59822cc9d40698ccdabd6e801fededa [0,2,0,0,0,0|1,0,1]=4 2263 B13R1.162 CC(CNC(=O)CO)n1cccn1 e83a78629ddd5f79bda9b212079a556f [0,2,0,0,0,0|2,0,0]=4 2264 B13R1.162 CC(CNC(=O)CO)n1cncn1 12235468099f9e2c86d04a5dcfc61f30 [0,2,0,0,0,0|1,0,1]=4 2265 B13R1.162 CC(CNC(=O)CS)n1cccn1 7d88efb0b5db423cec97482e311f16ae [0,2,0,0,0,0|2,0,0]=4 2266 B13R1.162 CC(CNC(=O)CS)n1cncn1 134a1bf7e84663d7bd60a628592b4d41 [0,2,0,0,0,0|1,0,1]=4 2267 B13R1.162 CCC(=O)NCC(C)n1cccn1 c10288348011a1fef39cf6ca059b79f9 [0,2,0,0,0,0|2,0,0]=4 2268 B13R1.162 CCC(=O)NCC(C)n1cncn1 67776847969718d41a3e2a4b1625b359 [0,2,0,0,0,0|1,0,1]=4 2269 B13R1.162 CCC(=O)NCC(O)c1ccco1 aee187a5b49cb65023e1761a9b14e28c [0,2,0,0,0,0|2,0,0]=4 2270 B13R1.162 CCC(=O)NCC(O)c1cccs1 b8808390cb3be47a1064ed4f702ae9f1 [0,2,0,0,0,0|2,0,0]=4 2271 B13R1.162 CNC(=O)CCN(C)c1c[nH]cn1 6fc9fc7e62ade6504ec15e97ae25c447 [0,2,0,0,0,0|2,0,0]=4 2272 B13R1.162 COC(=O)CCN(C)c1c[nH]cn1 c370b636a29ee4a5e99ae8ea87480e33 [0,2,0,0,0,0|2,0,0]=4 2273 B13R1.162 O=C(CF)NCC(O)c1ccco1 e5b846f4a7df52790c4fcc1d9d9ba40c [0,2,0,0,0,0|2,0,0]=4 2274 B13R1.162 O=C(CF)NCC(O)c1cccs1 50e7ed5f68f6ba20cea95215313b3001 [0,2,0,0,0,0|2,0,0]=4 2275 B13R1.162 O=C(CO)NCC(O)c1ccco1 eea6f4db891cc9d105cc840cc740455c [0,2,0,0,0,0|2,0,0]=4 2276 B13R1.162 O=C(CO)NCC(O)c1cccs1 e2e842affc8cae5aabaf7936515aa854 [0,2,0,0,0,0|2,0,0]=4 2277 B13R1.162 O=C(CS)NCC(O)c1ccco1 d21597cc83c9570e44dcdde87ab42d10 [0,2,0,0,0,0|2,0,0]=4 2278 B13R1.162 O=C(CS)NCC(O)c1cccs1 ee476677be3b4c30f31690932db03bb9 [0,2,0,0,0,0|2,0,0]=4 2279 B13R1.413 CCC(CNC(=O)C)n1cccn1 0ae2a08e2c1b62dc1e8525bb574982e8 [0,2,0,0,0,0|2,0,0]=4 2280 B13R1.60 CCc1csc(n1)CCNC(=O)C 16f825960748d0e7a15b6d0b5263aa62 [0,2,0,0,0,0|2,0,0]=4 2281 B13R1.60 CCc1nc(cs1)CCNC(=O)C ad4d41356ef23af6c006df9a4e8f829f [0,2,0,0,0,0|1,0,0]=3 2282 B13R1.717 C#CC(=O)NCCc1cn(cn1)C af42d30173550082adc9c8df07b74352 [0,2,0,0,0,0|0,0,1]=3 2283 B13R1.717 C#CC(=O)NCCc1cn(nn1)C 59885a2137c01cd2ff845da6fe6a1df4 [0,2,0,0,0,0|1,0,1]=4 2284 B13R1.717 C#CC(=O)NCCc1csc(n1)C 504531772cb78377bd5bf4b402360590 [0,2,0,0,0,0|1,0,1]=4 2285 B13R1.717 C#CC(C)NCCc1cn(cn1)C 9c00a92cd83db32ca7c04a7cf4cd1746 [0,2,0,0,0,0|1,0,1]=4 2286 B13R1.717 C=CC(=O)NCCc1cn(cn1)C 42e81b13dba65a893cdf53f27a172a96 [0,2,0,0,0,0|0,0,1]=3 2287 B13R1.717 C=CC(=O)NCCc1cn(nn1)C 58d6ca288b2513731776b065d654eece [0,2,0,0,0,0|1,0,1]=4 2288 B13R1.717 C=CC(=O)NCCc1csc(n1)C 4f609840100b02ba31cb78f67dc5d5bc [0,2,0,0,0,0|1,0,1]=4 2289 B13R1.717 C=CC(C)NCCc1cn(cn1)C 67b99d7c235bb5aff04497aa0cc7f758 [0,2,0,0,0,0|1,0,1]=4 2290 B13R1.717 CC(C#N)NCCc1cn(cn1)C 7f9e544043fc415b1c672468f45cfeea [0,2,0,0,0,0|1,0,1]=4 2291 B13R1.717 CC(C=O)NCCc1cn(cn1)C 43137f9686ad36209ded8ea3c6501e20 [0,2,0,0,0,0|0,0,1]=3 2292 B13R1.717 CC(C=O)NCCc1cn(nn1)C 93853bfa62aa874041ea1ce8dad41777 [0,2,0,0,0,0|1,0,1]=4 2293 B13R1.717 CC(CO)NCCc1cn(cn1)C dd7d26a4b19b64f20ab3ff987cdef74a [0,2,0,0,0,0|0,0,2]=4 2294 B13R1.717 CCC(=O)CNCc1c[nH]c(n1)C f4ef1837bb6da4058d3bc0e6732e9f8f [0,2,0,0,0,0|2,0,0]=4 2295 B13R1.717 CCC(=O)CNCc1cn(cn1)C 5acb0d916f61812ee6c93664aa5b773f [0,2,0,0,0,0|2,0,0]=4 2296 B13R1.717 CCC(=O)COCc1c[nH]c(n1)C c461c0437fa5182cd139e7114c561725 [0,2,0,0,0,0|2,0,0]=4 2297 B13R1.717 CCC(=O)COCc1cn(cn1)C ff50c36941119df75de0996afccd2790 [0,2,0,0,0,0|2,0,0]=4 2298 B13R1.717 CCC(=O)NCCc1ccc(o1)C 8ad85ca9e41b88a0198f5f51909fb739 [0,2,0,0,0,0|2,0,0]=4 2299 B13R1.717 CCC(=O)NCCc1ccc(s1)Br fe796d4092e3a11e9badc80b74d05799 [0,2,0,0,0,0|2,0,0]=4 2300 B13R1.717 CCC(=O)NCCc1ccc(s1)C ff8bd2daf2a7ea503a73b1c2a8ef30ea [0,2,0,0,0,0|2,0,0]=4 2301 B13R1.717 CCC(=O)NCCc1ccn(n1)C 70d740a4166fbe8e22ef91353d7f7f4a [0,2,0,0,0,0|2,0,0]=4 2302 B13R1.717 CCC(=O)NCCc1cn(cn1)C de1c0b03fbad0a4eff51d7e7e3e1122b [0,2,0,0,0,0|0,0,0]=2 2303 B13R1.717 CCC(=O)NCCc1cn(nn1)C 1c49c085036c355fc400cf1a29d5968d [0,2,0,0,0,0|1,0,0]=3 2304 B13R1.717 CCC(=O)NCCc1cnn(c1)C 0bd656babbf5ff67389319e79af77cc6 [0,2,0,0,0,0|2,0,0]=4 2305 B13R1.717 CCC(=O)NCCc1csc(n1)C 304c22275a7af14e0ebb2fb19e030f91 [0,2,0,0,0,0|1,0,0]=3 2306 B13R1.717 CCC(=O)NCCc1nc(cs1)C 434e44d90860effdd8a203d827f136c8 [0,2,0,0,0,0|2,0,0]=4 2307 B13R1.717 CCC(=O)NCCc1ncc(o1)C 9f8dc4a97b32b2ea2446e518f572209d [0,2,0,0,0,0|2,0,0]=4 2308 B13R1.717 CCC(=O)NCCn1cc(cn1)Br 0cd2503d65fbffc35a2cff3a82a19276 [0,2,0,0,0,0|2,0,0]=4 2309 B13R1.717 CCC(=O)NCCn1cc(cn1)C 7a7351b4904855e071f895299c366d20 [0,2,0,0,0,0|2,0,0]=4 2310 B13R1.717 CCC(=O)NCCn1cc(cn1)Cl 743a9b512299608285b733a187e03943 [0,2,0,0,0,0|2,0,0]=4 2311 B13R1.717 CCC(=O)NCCn1cc(cn1)F 12999224d90726a0d3e8f282a24ca4d5 [0,2,0,0,0,0|2,0,0]=4 2312 B13R1.717 CCC(=O)NCCn1cc(cn1)I 9661815bc6e4209dea010bd4d136a18d [0,2,0,0,0,0|2,0,0]=4 2313 B13R1.717 CCC(=O)NCCn1ccc(n1)C 99436ff04117df578d98b092621233f8 [0,2,0,0,0,0|2,0,0]=4 2314 B13R1.717 CCC(C)NCCc1cn(cn1)C 481e317f6f45059980a8be14473e1c89 [0,2,0,0,0,0|1,0,1]=4 2315 B13R1.717 CNC(=O)CCNc1c[nH]c(n1)N 7dfb66d3a3e87835e9bcb6f509b06144 [0,2,0,0,0,0|2,0,0]=4 2316 B13R1.717 CNC(=O)CCNc1cn(cn1)C 1d40fec4d045120cf561a1e10b250540 [0,2,0,0,0,0|2,0,0]=4 2317 B13R1.717 CNC(=O)CNCc1c[nH]c(n1)C 4b4218a80d3574796e4073291f0f6175 [0,2,0,0,0,0|2,0,0]=4 2318 B13R1.717 CNC(=O)CNCc1cn(cn1)C 836fdac78b3742a31628c519bcf64ab2 [0,2,0,0,0,0|2,0,0]=4 2319 B13R1.717 CNC(=O)COCc1c[nH]c(n1)C b19bc463ba41270ec0abd81f2b455ba3 [0,2,0,0,0,0|2,0,0]=4 2320 B13R1.717 CNC(=O)COCc1cn(cn1)C 00e12e164c8f546f0bf631277ff796e9 [0,2,0,0,0,0|2,0,0]=4 2321 B13R1.717 COC(=O)CCNc1c[nH]c(n1)N 922908703c5d73d41378ae24ab86b089 [0,2,0,0,0,0|2,0,0]=4 2322 B13R1.717 COC(=O)CCNc1cn(cn1)C 567e9bb75ae75baa27c6838a893d7536 [0,2,0,0,0,0|2,0,0]=4 2323 B13R1.717 COC(=O)CNCc1c[nH]c(n1)C cec1a1e3c88ce19f767af7aed62f5097 [0,2,0,0,0,0|2,0,0]=4 2324 B13R1.717 COC(=O)CNCc1cn(cn1)C 8d5c7dc382b5b4eb1cd697239a16f630 [0,2,0,0,0,0|2,0,0]=4 2325 B13R1.717 COC(=O)COCc1c[nH]c(n1)C 82fad2bd3afcb9fb2420701fbd389ea1 [0,2,0,0,0,0|2,0,0]=4 2326 B13R1.717 COC(=O)COCc1cn(cn1)C 77dc7a1bc9c1fa5903fdbf9d701ad46c [0,2,0,0,0,0|2,0,0]=4 2327 B13R1.717 C[C@@H](CO)NCCc1cn(cn1)C 5b18ac7fb26e283b30b0149524efb88b [0,2,0,0,0,0|0,0,2]=4 2328 B13R1.717 C[C@H](C=O)NCCc1cn(cn1)C 3205595b2664a2e344bf723c0d356f2e [0,2,0,0,0,0|0,0,1]=3 2329 B13R1.717 C[C@H](C=O)NCCc1cn(nn1)C 03fad5d3a64885ebaf814d951e0062d6 [0,2,0,0,0,0|1,0,1]=4 2330 B13R1.717 C[C@H](CO)NCCc1cn(cn1)C 466e87400b9756f96a85b6e7abd34c21 [0,2,0,0,0,0|0,0,2]=4 2331 B13R1.717 Cc1ccc(o1)CCNC(=O)CF 52b3ccc1add9534d86f90760841bb847 [0,2,0,0,0,0|2,0,0]=4 2332 B13R1.717 Cc1ccc(o1)CCNC(=O)CO e77e6dce1ecdc51e1f30fe79f9c2c7ac [0,2,0,0,0,0|2,0,0]=4 2333 B13R1.717 Cc1ccc(o1)CCNC(=O)CS f608c1908f5c93469c0c60bd333505d4 [0,2,0,0,0,0|2,0,0]=4 2334 B13R1.717 Cc1ccc(s1)CCNC(=O)CF b7287a28a27d8e5d90cf4c91f662cbb3 [0,2,0,0,0,0|2,0,0]=4 2335 B13R1.717 Cc1ccc(s1)CCNC(=O)CO 6e117757d75d094a79a646b90c964bbb [0,2,0,0,0,0|2,0,0]=4 2336 B13R1.717 Cc1ccc(s1)CCNC(=O)CS 64cb663f9110620788ede271d10d15d8 [0,2,0,0,0,0|2,0,0]=4 2337 B13R1.717 Cc1ccn(n1)CCNC(=O)CF cea1f91fafb011470f40546ec39ea9f0 [0,2,0,0,0,0|2,0,0]=4 2338 B13R1.717 Cc1ccn(n1)CCNC(=O)CO 6b0c9f349a1b13413d8e03c456af921f [0,2,0,0,0,0|2,0,0]=4 2339 B13R1.717 Cc1ccn(n1)CCNC(=O)CS 18d324d8a82c0ba1fb799f58c446ae13 [0,2,0,0,0,0|2,0,0]=4 2340 B13R1.717 Cc1cnc(o1)CCNC(=O)CF 50f59fb105ca70f7982974aa63270b43 [0,2,0,0,0,0|2,0,0]=4 2341 B13R1.717 Cc1cnc(o1)CCNC(=O)CO 65cd9acfa64ef680ef99454025d59b87 [0,2,0,0,0,0|2,0,0]=4 2342 B13R1.717 Cc1cnc(o1)CCNC(=O)CS f7bb4c7b2b11537776be558736095235 [0,2,0,0,0,0|2,0,0]=4 2343 B13R1.717 Cc1cnn(c1)CCNC(=O)CF fc9ad883f7ab3ebb01c87752835c3556 [0,2,0,0,0,0|2,0,0]=4 2344 B13R1.717 Cc1cnn(c1)CCNC(=O)CO e457f50e3ca9f0b341022915386569fa [0,2,0,0,0,0|2,0,0]=4 2345 B13R1.717 Cc1cnn(c1)CCNC(=O)CS b9d1acb15d676af205f774c6e5ddcd46 [0,2,0,0,0,0|2,0,0]=4 2346 B13R1.717 Cc1csc(n1)CCNC(=O)CF b48aac10dfd55dcd07fb5d4fd1260ca7 [0,2,0,0,0,0|2,0,0]=4 2347 B13R1.717 Cc1csc(n1)CCNC(=O)CO fe72ceda59d4d9384efa6a43e5fde448 [0,2,0,0,0,0|2,0,0]=4 2348 B13R1.717 Cc1csc(n1)CCNC(=O)CS 898bb0ec25e5035548a19792dd70de28 [0,2,0,0,0,0|2,0,0]=4 2349 B13R1.717 Cc1nc(c[nH]1)CNCC(=O)CO eb8a292a8867171763d96651fdc11564 [0,2,0,0,0,0|2,0,0]=4 2350 B13R1.717 Cc1nc(cs1)CCNC(=O)C=O 3cc4bc3c749bbff8588ef860e33a8cb6 [0,2,0,0,0,0|1,0,1]=4 2351 B13R1.717 Cc1nc(cs1)CCNC(=O)CF 29102a285c4604feb67fd5039a1720a5 [0,2,0,0,0,0|1,0,0]=3 2352 B13R1.717 Cc1nc(cs1)CCNC(=O)CO 5ebfcb0c063e66345b964990bd5257c3 [0,2,0,0,0,0|1,0,0]=3 2353 B13R1.717 Cc1nc(cs1)CCNC(=O)CS 765dd80a53aef05bdd0d3d23d6ec70d8 [0,2,0,0,0,0|1,0,0]=3 2354 B13R1.717 Cc1nc(cs1)CCNC(C)C=O ed99433f9b2ba368fada611fb6eb90da [0,2,0,0,0,0|1,0,1]=4 2355 B13R1.717 Cc1nc(cs1)CCN[C@H](C)C=O a777f20a64289694b5c040d495bbf091 [0,2,0,0,0,0|1,0,1]=4 2356 B13R1.717 Cn1cc(cn1)CCNC(=O)CF 387f35fbe01832a8327596fccbc712d0 [0,2,0,0,0,0|2,0,0]=4 2357 B13R1.717 Cn1cc(cn1)CCNC(=O)CO 1519a1fccca0127fb40e8f4184b0a2da [0,2,0,0,0,0|2,0,0]=4 2358 B13R1.717 Cn1cc(cn1)CCNC(=O)CS 26c77cedf9d5135784c71ec789e52d16 [0,2,0,0,0,0|2,0,0]=4 2359 B13R1.717 Cn1cc(nn1)CCNC(=O)C=O 93adee67914fc9baa57cdddc2cf37c93 [0,2,0,0,0,0|1,0,1]=4 2360 B13R1.717 Cn1cc(nn1)CCNC(=O)CF 3010b43b6155b50fcfb2757eb8d4eabc [0,2,0,0,0,0|1,0,0]=3 2361 B13R1.717 Cn1cc(nn1)CCNC(=O)CO 863c930428f352a371d784306f80296a [0,2,0,0,0,0|1,0,0]=3 2362 B13R1.717 Cn1cc(nn1)CCNC(=O)CS eeeccf9ca8498656aa6b5ec4cb0d09be [0,2,0,0,0,0|1,0,0]=3 2363 B13R1.717 Cn1ccc(n1)CCNC(=O)CF 3a23891ac0f44c45628befed30d35321 [0,2,0,0,0,0|2,0,0]=4 2364 B13R1.717 Cn1ccc(n1)CCNC(=O)CO c7c25b99294c90114090e9b0bd962621 [0,2,0,0,0,0|2,0,0]=4 2365 B13R1.717 Cn1ccc(n1)CCNC(=O)CS b6a291581b8c41bee9f67065af056f86 [0,2,0,0,0,0|2,0,0]=4 2366 B13R1.717 Cn1cnc(c1)CCNC(=O)C=O b9aa2d33fb83fe39b5bd76d3d4411fa0 [0,2,0,0,0,0|0,0,1]=3 2367 B13R1.717 Cn1cnc(c1)CCNC(=O)CF 125533f2369181191bc74f23502ea225 [0,2,0,0,0,0|0,0,0]=2 2368 B13R1.717 Cn1cnc(c1)CCNC(=O)CO fc0d30be1553d2fc3b3c27e8718694ec [0,2,0,0,0,0|0,0,0]=2 2369 B13R1.717 Cn1cnc(c1)CCNC(=O)CS 5e5fad4804aa838ccffa2e02810a023a [0,2,0,0,0,0|0,0,0]=2 2370 B13R1.717 Cn1cnc(c1)CNCC(=O)CO d1ba8f82efa74d6b3120533dcf05f610 [0,2,0,0,0,0|2,0,0]=4 2371 B13R1.717 O=C(CF)NCCc1ccc(s1)Br edbc5096d3442b259443b69ebf96d74d [0,2,0,0,0,0|2,0,0]=4 2372 B13R1.717 O=C(CF)NCCn1cc(cn1)Br 19d701a41adc6468a75ca22dbdd5cc5e [0,2,0,0,0,0|2,0,0]=4 2373 B13R1.717 O=C(CF)NCCn1cc(cn1)Cl e0f81e3a35ee6c6d4ecf4ba7bd660c1a [0,2,0,0,0,0|2,0,0]=4 2374 B13R1.717 O=C(CF)NCCn1cc(cn1)F 74bfe4255a09688e90bea48911837b28 [0,2,0,0,0,0|2,0,0]=4 2375 B13R1.717 O=C(CF)NCCn1cc(cn1)I e59c34a851c989fda0e788afd6740f7a [0,2,0,0,0,0|2,0,0]=4 2376 B13R1.717 O=C(CO)NCCc1ccc(s1)Br 52e57229bbd54704fd168d6306dc1089 [0,2,0,0,0,0|2,0,0]=4 2377 B13R1.717 O=C(CO)NCCn1cc(cn1)Br 5108e46d93da1acbef5abb7f10d7370d [0,2,0,0,0,0|2,0,0]=4 2378 B13R1.717 O=C(CO)NCCn1cc(cn1)Cl ebc8817b5b845541cc6eef0b22885b77 [0,2,0,0,0,0|2,0,0]=4 2379 B13R1.717 O=C(CO)NCCn1cc(cn1)F 661c25f7a6c69464b68bcebcfb0cb821 [0,2,0,0,0,0|2,0,0]=4 2380 B13R1.717 O=C(CO)NCCn1cc(cn1)I 4c11389e6ee1e6e0475ee4494385778c [0,2,0,0,0,0|2,0,0]=4 2381 B13R1.717 O=C(CS)NCCc1ccc(s1)Br 7cce76a1bd5ab4ac7f971a9fae430cb5 [0,2,0,0,0,0|2,0,0]=4 2382 B13R1.717 O=C(CS)NCCn1cc(cn1)Br 4350dcefb57447e95cb879b69c2a5aa0 [0,2,0,0,0,0|2,0,0]=4 2383 B13R1.717 O=C(CS)NCCn1cc(cn1)Cl dcb422c1db6d835fa9c4af7d1455e2c3 [0,2,0,0,0,0|2,0,0]=4 2384 B13R1.717 O=C(CS)NCCn1cc(cn1)F 501b60e7070b6f238de03214af92bf8f [0,2,0,0,0,0|2,0,0]=4 2385 B13R1.717 O=C(CS)NCCn1cc(cn1)I dcba2ad928fd78916c873e6133a01d38 [0,2,0,0,0,0|2,0,0]=4 2386 B13R1.3424 CC(=O)NC(C)Cc1cn(cn1)C 801034cf3abe89f724b8fed68e1beb7d [0,2,0,0,0,0|0,0,0]=2 2387 B13R1.3424 CC(=O)NC(C)Cn1cc(cn1)C f105f4603f1aebefece9bf43676ff1fb [0,2,0,0,0,0|2,0,0]=4 2388 B13R1.3424 CC(=O)NC(C)Cn1ccc(n1)C 53b7b5c87125b86c5941c52e5453bc26 [0,2,0,0,0,0|2,0,0]=4 2389 B13R1.3424 CC(=O)N[C@@H](C)Cc1cn(cn1)C 88d3e99c3b16afacbd4205dd1141881c [0,2,0,0,0,0|0,0,0]=2 2390 B13R1.3424 CC(=O)N[C@H](C)Cc1cn(cn1)C 22049d25f4034e597e00263738b5fe50 [0,2,0,0,0,0|0,0,0]=2 2391 B13R1.3424 CC(=O)OC(C)Nc1cn(cn1)C 12c62dad0295ae82bf53b18d915da407 [0,2,0,0,0,0|2,0,0]=4 2392 B13R1.3424 CC(C)NC(C)Cc1cn(cn1)C 92d8d38fd3b1c7c0a7321dd59cc7773f [0,2,0,0,0,0|1,0,1]=4 2393 B13R1.3424 CC(C)N[C@@H](C)Cc1cn(cn1)C 4ab5fe25ff4ede001888d7e2d5b824ee [0,2,0,0,0,0|1,0,1]=4 2394 B13R1.3424 CC(C)N[C@H](C)Cc1cn(cn1)C 101d21e14a57355613985f42330916dd [0,2,0,0,0,0|1,0,1]=4 2395 B13R1.3425 CC(=O)C(=O)CNc1cn(cn1)C 54343b19e9fc3f241ed7dba9366acbc2 [0,2,0,0,0,0|2,0,0]=4 2396 B13R1.3425 CC(=O)C(=O)NCc1cn(cn1)C f8f1dc9882e14911868581383be468a2 [0,2,0,0,0,0|2,0,0]=4 2397 B13R1.3425 CC(=O)C(C)NCc1c[nH]c(n1)C 92f6c1cd92ef373c2ef1a37e6afe8d68 [0,2,0,0,0,0|2,0,0]=4 2398 B13R1.3425 CC(=O)C(C)NCc1cn(cn1)C e2b0bbca97a9d3fb937efaaa8f14d46d [0,2,0,0,0,0|2,0,0]=4 2399 B13R1.3425 CC(=O)C(C)OCc1c[nH]c(n1)C e9086256595698ff892f26bd0df65122 [0,2,0,0,0,0|2,0,0]=4 2400 B13R1.3425 CC(=O)C(C)OCc1cn(cn1)C 61fe40762592309fa74ec150ee9a401b [0,2,0,0,0,0|2,0,0]=4 2401 B13R1.3425 CC(=O)N(C)CCc1cnn(c1)C fce8b40048dcd5caa3f30da1493fc9a2 [0,2,0,0,0,0|2,0,0]=4 2402 B13R1.3443 CC(=O)NCCc1nc(c(s1)C)C aaaed4b49d106abf8a9e200a1d6d002b [0,2,0,0,0,0|2,0,0]=4 2403 B13R1.3485 CC(=O)CCNc1nc([nH]c1Br)Br 05e496699e926992588a9dfce8aafbe4 [0,2,0,0,0,0|2,0,0]=4 2404 B13R1.3485 CC(=O)NCCc1sc(nc1C)C e6769187f7948b44f3814f1e6c9325a9 [0,2,0,0,0,0|1,0,1]=4 2405 B13R1.3485 CC(=O)NCCn1nc(cc1C)C a5908ee34abab481a7224c005440a9e8 [0,2,0,0,0,0|2,0,0]=4 2406 B13R1.3485 CC(=O)OCNc1nc([nH]c1Br)Br 7798c5662855c09299baed34c51059f1 [0,2,0,0,0,0|2,0,0]=4 2407 B13R1.103 CC(=O)CCNc1nc[nH]c1C#N 379173451ce53a4db1a08f5dedb9c9c2 [0,2,0,0,0,0|2,0,0]=4 2408 B13R1.103 CC(=O)OCNc1nc[nH]c1C#N d0c9ce7f10698c30740cc60768b1a909 [0,2,0,0,0,0|2,0,0]=4 2409 B13R1.169 CC(=O)C(C)NCc1nc[nH]c1C 985e2719669a7b1eb15792513f2ed7f4 [0,2,0,0,0,0|2,0,0]=4 2410 B13R1.169 CC(=O)C(C)OCc1nc[nH]c1C 749897c5be865e3b5d8eeac7a97c7d77 [0,2,0,0,0,0|2,0,0]=4 2411 B13R1.599 CCC(=O)CNCc1nc[nH]c1C 3c0a93bb4a1f2d04c15f0e3359edac3d [0,2,0,0,0,0|2,0,0]=4 2412 B13R1.599 CCC(=O)COCc1nc[nH]c1C b26b5b102c43a361ce16301c10289a19 [0,2,0,0,0,0|2,0,0]=4 2413 B13R1.599 CCC(=O)NCCc1cccn1C fe8288892c6ab4384a622dfab352ce6a [0,2,0,0,0,0|1,0,1]=4 2414 B13R1.599 CCC(=O)NCCc1ccsc1Br 439e0298940704bc33ff416ef90206ed [0,2,0,0,0,0|2,0,0]=4 2415 B13R1.599 CCC(=O)NCCc1nccn1C 936dc773b6c4de52b25d67e2d160b67a [0,2,0,0,0,0|2,0,0]=4 2416 B13R1.599 CCC(=O)NCCc1sccc1C e51946eabe6036c1d5886daa013e12cb [0,2,0,0,0,0|2,0,0]=4 2417 B13R1.599 CCC(=O)NCCc1scnc1C e1cf090064db3cc7b5b99a7f3857e142 [0,2,0,0,0,0|1,0,1]=4 2418 B13R1.599 CNC(=O)CNCc1nc[nH]c1C 6fc4097616b6508089e2c91ef868ed5b [0,2,0,0,0,0|2,0,0]=4 2419 B13R1.599 CNC(=O)COCc1nc[nH]c1C 58820fed867c851373bff1c99b99acee [0,2,0,0,0,0|2,0,0]=4 2420 B13R1.599 COC(=O)CCNc1nc[nH]c1C 1425a0abf976363f5ee097167b7c689d [0,2,0,0,0,0|2,0,0]=4 2421 B13R1.599 COC(=O)CNCc1nc[nH]c1C 6b033de3ef167c3ee63e3897d2f5d2f6 [0,2,0,0,0,0|2,0,0]=4 2422 B13R1.599 COC(=O)COCc1nc[nH]c1C 05e75bf05b9758ca6fb388c830a15058 [0,2,0,0,0,0|2,0,0]=4 2423 B13R1.599 Cc1[nH]cnc1CNCC(=O)CO b1f746164fe8ff661da09a3689546265 [0,2,0,0,0,0|2,0,0]=4 2424 B13R1.599 Cc1ccsc1CCNC(=O)CF e6bd7dba2c89b8a303a5d1e892a3f231 [0,2,0,0,0,0|2,0,0]=4 2425 B13R1.599 Cc1ccsc1CCNC(=O)CO 708c4b81251978d9dc8ee781f31e4244 [0,2,0,0,0,0|2,0,0]=4 2426 B13R1.599 Cc1ccsc1CCNC(=O)CS 7faa26837a5f0b65fcc800662a6cc003 [0,2,0,0,0,0|2,0,0]=4 2427 B13R1.599 Cc1ncsc1CCNC(=O)CF 6038a900051cac4de785f377cf6853b2 [0,2,0,0,0,0|1,0,1]=4 2428 B13R1.599 Cc1ncsc1CCNC(=O)CO 8820ef3c077127ee0a3c8fa3fb0b4014 [0,2,0,0,0,0|1,0,1]=4 2429 B13R1.599 Cc1ncsc1CCNC(=O)CS cfc215c958cedfb96be7d9775f7972d0 [0,2,0,0,0,0|1,0,1]=4 2430 B13R1.599 Cn1cccc1CCNC(=O)CF 059d3339cad35654ae42dcde38a0111f [0,2,0,0,0,0|1,0,1]=4 2431 B13R1.599 Cn1cccc1CCNC(=O)CO bfbc909bcacfe36c2bb1ca2029957d37 [0,2,0,0,0,0|1,0,1]=4 2432 B13R1.599 Cn1cccc1CCNC(=O)CS 2a7af9a16261ab4bb411858ac01f8970 [0,2,0,0,0,0|1,0,1]=4 2433 B13R1.599 Cn1ccnc1CCNC(=O)CF 04d1be84129baa7c8892d3d756d0ed52 [0,2,0,0,0,0|2,0,0]=4 2434 B13R1.599 Cn1ccnc1CCNC(=O)CO 9fd8e94de45ef02325a8e499da3f3ff2 [0,2,0,0,0,0|2,0,0]=4 2435 B13R1.599 Cn1ccnc1CCNC(=O)CS 04a4b8d1480cbb0b3436482510ec4a4b [0,2,0,0,0,0|2,0,0]=4 2436 B13R1.599 O=C(CF)NCCc1ccsc1Br bc36727bb5b56f02e441fe5c728e3869 [0,2,0,0,0,0|2,0,0]=4 2437 B13R1.599 O=C(CO)NCCc1ccsc1Br 7659e76e103898969a25c33c826444df [0,2,0,0,0,0|2,0,0]=4 2438 B13R1.599 O=C(CS)NCCc1ccsc1Br 0f2f4d4acbbe38b3008f9a784c6ad61b [0,2,0,0,0,0|2,0,0]=4 2439 B13R1.545 C#CC(C)NC(C)Cc1c[nH]cn1 8c4f0c2ecc9f7d1c3900b8916299367d [0,2,0,0,0,0|1,0,1]=4 2440 B13R1.545 C#CC(C)N[C@@H](C)Cc1c[nH]cn1 1950966f241af4444aaed5c49ba1a4ae [0,2,0,0,0,0|1,0,1]=4 2441 B13R1.545 C#CC(C)N[C@H](C)Cc1c[nH]cn1 6511630cac30abfc71e023268f3af854 [0,2,0,0,0,0|1,0,1]=4 2442 B13R1.545 C=CC(C)NC(C)Cc1c[nH]cn1 d91d46d1c6ea09795148cf842c902cf3 [0,2,0,0,0,0|1,0,1]=4 2443 B13R1.545 C=CC(C)N[C@@H](C)Cc1c[nH]cn1 9d2397d2c1dfd6e107e9089927ae6441 [0,2,0,0,0,0|1,0,1]=4 2444 B13R1.545 C=CC(C)N[C@H](C)Cc1c[nH]cn1 90dc7adad24e6852a27729bf2ec08098 [0,2,0,0,0,0|1,0,1]=4 2445 B13R1.545 CC(C#N)NC(C)Cc1c[nH]cn1 2296ae3e9af8f3b5f909cf749d93acf7 [0,2,0,0,0,0|1,0,1]=4 2446 B13R1.545 CC(C#N)N[C@@H](C)Cc1c[nH]cn1 2eb902296dcf22c54e10074475fd53f2 [0,2,0,0,0,0|1,0,1]=4 2447 B13R1.545 CC(C#N)N[C@H](C)Cc1c[nH]cn1 f2f0dfac3ffa3c912e51218b368b7de3 [0,2,0,0,0,0|1,0,1]=4 2448 B13R1.545 CC(C=O)NC(C)Cc1c[nH]cn1 4b213ae8001da3fc175c845816e07d9c [0,2,0,0,0,0|0,0,1]=3 2449 B13R1.545 CC(C=O)N[C@@H](C)Cc1c[nH]cn1 6e86b7cba486974d81aad78bc545adbe [0,2,0,0,0,0|0,0,1]=3 2450 B13R1.545 CC(C=O)N[C@H](C)Cc1c[nH]cn1 2e311a6f6e17b01fc544cae3208e6e35 [0,2,0,0,0,0|0,0,1]=3 2451 B13R1.545 CC(CO)NC(C)Cc1c[nH]cn1 b6d664eb7057653ea7f6b6a7b5892f0f [0,2,0,0,0,0|0,0,2]=4 2452 B13R1.545 CC(CO)N[C@@H](C)Cc1c[nH]cn1 56d6fa55c80005aa4c721c3ea0d715b9 [0,2,0,0,0,0|0,0,2]=4 2453 B13R1.545 CC(CO)N[C@H](C)Cc1c[nH]cn1 097d35f04c932f80d7a5cd4c46f4fdd1 [0,2,0,0,0,0|0,0,2]=4 2454 B13R1.545 CC(Cc1c[nH]cn1)N[C@@H](C)CO ccf3dd8e4afb6000d6e583d308701b50 [0,2,0,0,0,0|0,0,2]=4 2455 B13R1.545 CC(Cc1c[nH]cn1)N[C@H](C)C=O a07b6ba59304fc9455ec52f87889e8fb [0,2,0,0,0,0|0,0,1]=3 2456 B13R1.545 CC(Cc1c[nH]cn1)N[C@H](C)CO 66d673c307ee23de9ba122e0e1c98150 [0,2,0,0,0,0|0,0,2]=4 2457 B13R1.545 CC(Cc1ccco1)NC(=O)CF 81b1d0487e8ac7a30260b0279f5ca5b2 [0,2,0,0,0,0|2,0,0]=4 2458 B13R1.545 CC(Cc1ccco1)NC(=O)CO de69fd5a1067ce9df6ba344f35fa4535 [0,2,0,0,0,0|2,0,0]=4 2459 B13R1.545 CC(Cc1ccco1)NC(=O)CS ad640fc60db997ab130a9af4b4f3177a [0,2,0,0,0,0|2,0,0]=4 2460 B13R1.545 CC(Cc1ccsc1)NC(=O)CF 02ac657a882e1b9c28137818f77b1827 [0,2,0,0,0,0|2,0,0]=4 2461 B13R1.545 CC(Cc1ccsc1)NC(=O)CO 0318aa899e4fc63ea4f09b62bcda6805 [0,2,0,0,0,0|2,0,0]=4 2462 B13R1.545 CC(Cc1ccsc1)NC(=O)CS 0e22a3639eaeea958d6df365caa7887f [0,2,0,0,0,0|2,0,0]=4 2463 B13R1.545 CC(Cn1cccn1)NC(=O)CF bbd1e5cc66a1f0c661a42ac1e655829c [0,2,0,0,0,0|2,0,0]=4 2464 B13R1.545 CC(Cn1cccn1)NC(=O)CO 780e2bd625de9ead3697dda887580745 [0,2,0,0,0,0|2,0,0]=4 2465 B13R1.545 CC(Cn1cccn1)NC(=O)CS 8be91b8e60deafb7d93979f0c2b60925 [0,2,0,0,0,0|2,0,0]=4 2466 B13R1.545 CC(Cn1cncn1)NC(=O)CF 116bbbc6edda00fc000655b429eaf3d9 [0,2,0,0,0,0|1,0,1]=4 2467 B13R1.545 CC(Cn1cncn1)NC(=O)CO bd83766622fc1bb5cb8b4b7be4253438 [0,2,0,0,0,0|1,0,1]=4 2468 B13R1.545 CC(Cn1cncn1)NC(=O)CS b26a058c81e622fe730573050c78dede [0,2,0,0,0,0|1,0,1]=4 2469 B13R1.545 CCC(=O)NC(C)Cc1ccco1 5756d31c737cc7a6b6ce9e64d77ab8fe [0,2,0,0,0,0|2,0,0]=4 2470 B13R1.545 CCC(=O)NC(C)Cc1ccsc1 6dd98129e5b290897b45126593840a72 [0,2,0,0,0,0|2,0,0]=4 2471 B13R1.545 CCC(=O)NC(C)Cn1cccn1 49b0788d722956a4241300e27784ab26 [0,2,0,0,0,0|2,0,0]=4 2472 B13R1.545 CCC(=O)NC(C)Cn1cncn1 a13f85b65889ae006f3625ee9bee3615 [0,2,0,0,0,0|1,0,1]=4 2473 B13R1.545 CCC(C)NC(C)Cc1c[nH]cn1 b4df34712d20d574cd657185e513bac9 [0,2,0,0,0,0|1,0,1]=4 2474 B13R1.545 CCC(C)N[C@@H](C)Cc1c[nH]cn1 a4f2db018d7ff54afc50b5c0114a158c [0,2,0,0,0,0|1,0,1]=4 2475 B13R1.545 CCC(C)N[C@H](C)Cc1c[nH]cn1 298add7664874e34b6cb5a805ac5d8cf [0,2,0,0,0,0|1,0,1]=4 2476 B13R1.545 COC(=O)CC(C)Nc1c[nH]cn1 01f13a670f7a94f134aabce18b8b60b1 [0,2,0,0,0,0|2,0,0]=4 2477 B13R1.545 COC(=O)CC(C)Oc1c[nH]cn1 aae408f8ad29e10535d20e3bd07a67ee [0,2,0,0,0,0|2,0,0]=4 2478 B13R1.545 COC(=O)C[C@@H](C)Nc1c[nH]cn1 cef6d854b6544e11e553280c26ff7c56 [0,2,0,0,0,0|2,0,0]=4 2479 B13R1.545 COC(=O)C[C@H](C)Nc1c[nH]cn1 b6b772c9016014746ad9155c1b03fae7 [0,2,0,0,0,0|2,0,0]=4 2480 B13R1.545 COC(=O)C[C@H](C)Oc1c[nH]cn1 e3a044daec2ab4e6dcfc7e76212db684 [0,2,0,0,0,0|2,0,0]=4 2481 B13R1.545 C[C@@H](CO)N[C@@H](C)Cc1c[nH]cn1 5cc1707e8f9e470aad31b38280d8d734 [0,2,0,0,0,0|0,0,2]=4 2482 B13R1.545 C[C@H](C=O)N[C@@H](C)Cc1c[nH]cn1 3af5ec9fa8b5123cd8aa957fee21eab0 [0,2,0,0,0,0|0,0,1]=3 2483 B13R1.545 C[C@H](C=O)N[C@H](C)Cc1c[nH]cn1 fc8f2eda062ee2c4a38536f5258f91a3 [0,2,0,0,0,0|0,0,1]=3 2484 B13R1.545 C[C@H](CO)N[C@@H](C)Cc1c[nH]cn1 0416bab48ee54edf26697db8dfd43cc2 [0,2,0,0,0,0|0,0,2]=4 2485 B13R1.545 C[C@H](CO)N[C@H](C)Cc1c[nH]cn1 b4a4c71fbe4d85179cf803e867733a96 [0,2,0,0,0,0|0,0,2]=4 2486 B13R1.545 C[C@H](Cc1c[nH]cn1)N[C@@H](C)CO b17dc566494c26604d1444372d97b9d8 [0,2,0,0,0,0|0,0,2]=4 2487 B13R1.2007 CC(=O)CC(C)(C)Nc1c[nH]cn1 04bc2cbe907be99786b1b3b6713f9ae1 [0,2,0,0,0,0|2,0,0]=4 2488 B13R1.554 C=C(COc1c[nH]cn1)C(=O)OC f7e6efb61d2ec37f8c206afa3f2d596e [0,2,0,0,0,0|2,0,0]=4 2489 B13R1.554 CC(CO)N(C)CCc1c[nH]cn1 91d3fe3f05ce72af69474508371c7583 [0,2,0,0,0,0|0,0,2]=4 2490 B13R1.554 CCC(=O)N(C)CCc1cccs1 a8a039b0a64bc578ad668c52d85af0bb [0,2,0,0,0,0|2,0,0]=4 2491 B13R1.554 CCC(C)N(C)CCc1c[nH]cn1 f0253551778c6d9a4045e90a0193b0a1 [0,2,0,0,0,0|1,0,1]=4 2492 B13R1.554 CN(CCc1cccs1)C(=O)CF 65472d9d6e3b95c861b3a3e1d5bb42ee [0,2,0,0,0,0|2,0,0]=4 2493 B13R1.554 CN(CCc1cccs1)C(=O)CO aff94c6e142920aa2cef3d153eb42d85 [0,2,0,0,0,0|2,0,0]=4 2494 B13R1.554 CN(CCc1cccs1)C(=O)CS 6819b0a3b7e9f42b6d7df393b7e59265 [0,2,0,0,0,0|2,0,0]=4 2495 B13R1.554 COC(=O)C(=O)COc1c[nH]cn1 5e5d608942e8a709066db29cbd986ab0 [0,2,0,0,0,0|2,0,0]=4 2496 B13R1.554 COC(=O)C(C)CNc1c[nH]cn1 10d9b93a5df4fda44dd28d5d819e3fb0 [0,2,0,0,0,0|2,0,0]=4 2497 B13R1.554 COC(=O)C(C)COc1c[nH]cn1 77c1241f0f5c13128dd1452437cf9ce7 [0,2,0,0,0,0|2,0,0]=4 2498 B13R1.554 COC(=O)[C@@H](C)COc1c[nH]cn1 c4028ac28d34343b3b20e955a8c659d7 [0,2,0,0,0,0|2,0,0]=4 2499 B13R1.554 COC(=O)[C@H](C)COc1c[nH]cn1 807d2c0ba58d4e9a57c15a35e534ed07 [0,2,0,0,0,0|2,0,0]=4 2500 B13R1.554 C[C@@H](CO)N(C)CCc1c[nH]cn1 6a3601276c9ef2f5c41664d8b396bc27 [0,2,0,0,0,0|0,0,2]=4 2501 B13R1.554 C[C@H](CO)N(C)CCc1c[nH]cn1 7aa786aa7dd2cd96f71a77a0e80dfebe [0,2,0,0,0,0|0,0,2]=4 2502 B13R1.2781 CN(CCc1c[nH]cn1)C(C)(C)C fc20bedb558a600ebcc2f2159d22684d [0,2,0,0,0,0|1,0,1]=4 2503 B13R1.3383 CCN(CCc1c[nH]cn1)C(C)C 679ceae38157cb9ec7a1fbcffd2477d6 [0,2,0,0,0,0|1,0,1]=4 2504 B13R1.3383 CCN(CCn1cccn1)C(=O)C da3415f9786ceb92f9a3dd7c537a7fdd [0,2,0,0,0,0|2,0,0]=4 2505 B13R1.252 C#CC(C)(C)NCCc1c[nH]cn1 66508340c21273217e1e1d8f39b632d4 [0,2,0,0,0,0|1,0,1]=4 2506 B13R1.252 CC(C)(C#N)NCCc1c[nH]cn1 3e867f399d476a5ca70a2e058ff938b7 [0,2,0,0,0,0|1,0,1]=4 2507 B13R1.252 CC(C)(CF)NCCc1c[nH]cn1 6a6e1db1d4dbca36718d8eb1677ffea3 [0,2,0,0,0,0|1,0,1]=4 2508 B13R1.252 CC(C)(CO)NCCc1c[nH]cn1 6a649c2d881948536ecb678b5c3f2591 [0,2,0,0,0,0|0,0,2]=4 2509 B13R1.404 C#CCC(=O)NCCc1ccco1 6ba9226f75b3e47e3e3ab631336586e9 [0,2,0,0,0,0|2,0,0]=4 2510 B13R1.404 C#CCC(=O)NCCc1cccs1 31c4572bcf21b956be3023d5699afaae [0,2,0,0,0,0|2,0,0]=4 2511 B13R1.404 C#CCC(=O)NCCc1ccsc1 d7e1dbf8975b525418a6822fbe523718 [0,2,0,0,0,0|2,0,0]=4 2512 B13R1.404 C#CCC(=O)NCCc1cscn1 eba757fd1f3eb897debe103abb976297 [0,2,0,0,0,0|1,0,0]=3 2513 B13R1.404 C#CCC(=O)NCCc1nccs1 acceaafc269b080a742ff085269e55f6 [0,2,0,0,0,0|2,0,0]=4 2514 B13R1.404 C#CCC(=O)NCCn1cccn1 b2f52e7ac389f23e8ceab1a4d1038360 [0,2,0,0,0,0|2,0,0]=4 2515 B13R1.404 C#CCC(=O)NCCn1cncn1 572ffa68d4bed825c054c8ec288ae532 [0,2,0,0,0,0|1,0,1]=4 2516 B13R1.404 C/C=C/C(=O)NCCc1ccco1 0b8bbed72a349cc99fc26441dacc9a0f [0,2,0,0,0,0|2,0,0]=4 2517 B13R1.404 C/C=C/C(=O)NCCc1cccs1 03f02c9631aa3b2e02e3e13df824c0ca [0,2,0,0,0,0|2,0,0]=4 2518 B13R1.404 C/C=C/C(=O)NCCc1ccsc1 de4ea0e093308b9fb065f1b38c4d0759 [0,2,0,0,0,0|2,0,0]=4 2519 B13R1.404 C/C=C/C(=O)NCCc1cscn1 9681a8e4c31e4b52e8541c2cbf014983 [0,2,0,0,0,0|1,0,0]=3 2520 B13R1.404 C/C=C/C(=O)NCCc1nccs1 dfa274b4a8c011a965952dfc53a5b138 [0,2,0,0,0,0|2,0,0]=4 2521 B13R1.404 C/C=C/C(=O)NCCn1cccn1 3bcc6edf8c9532a9712e00c695fb4e12 [0,2,0,0,0,0|2,0,0]=4 2522 B13R1.404 C/C=C/C(=O)NCCn1cncn1 2fd480b73309e72521e42e178f176215 [0,2,0,0,0,0|1,0,1]=4 2523 B13R1.404 C=CCC(=O)NCCc1ccco1 f3031e1a8a641ec20b021374d8266c53 [0,2,0,0,0,0|2,0,0]=4 2524 B13R1.404 C=CCC(=O)NCCc1cccs1 23512ea52f0a028de62de3f00f32afe9 [0,2,0,0,0,0|2,0,0]=4 2525 B13R1.404 C=CCC(=O)NCCc1ccsc1 e5c571a369af944fc9a8fdd1545eb110 [0,2,0,0,0,0|2,0,0]=4 2526 B13R1.404 C=CCC(=O)NCCc1cscn1 16c0b413266805ff1d18332cc055089c [0,2,0,0,0,0|1,0,0]=3 2527 B13R1.404 C=CCC(=O)NCCc1nccs1 54330a1562496314ba6d65c4b824dcd1 [0,2,0,0,0,0|2,0,0]=4 2528 B13R1.404 C=CCC(=O)NCCn1cccn1 112d2e6668b3f94fa2d20165987038cf [0,2,0,0,0,0|2,0,0]=4 2529 B13R1.404 C=CCC(=O)NCCn1cncn1 64de8dd232ce2a48e7c250d99409fb74 [0,2,0,0,0,0|1,0,1]=4 2530 B13R1.404 CC#CC(=O)NCCc1ccco1 91729de17f3b1c523cb32bc312637a95 [0,2,0,0,0,0|2,0,0]=4 2531 B13R1.404 CC#CC(=O)NCCc1cccs1 2e603beb1ff4fd758203d7a61672db07 [0,2,0,0,0,0|2,0,0]=4 2532 B13R1.404 CC#CC(=O)NCCc1ccsc1 e3a2c826bab8f6d0012232190d645056 [0,2,0,0,0,0|2,0,0]=4 2533 B13R1.404 CC#CC(=O)NCCc1cscn1 372f284ab8f3f3729e4d5b1174f9b015 [0,2,0,0,0,0|1,0,0]=3 2534 B13R1.404 CC#CC(=O)NCCc1nccs1 aa630f44554d7a0a7156787753fc1667 [0,2,0,0,0,0|2,0,0]=4 2535 B13R1.404 CC#CC(=O)NCCn1cccn1 ad62b4aabecdced0e6539c8cf2661f23 [0,2,0,0,0,0|2,0,0]=4 2536 B13R1.404 CC#CC(=O)NCCn1cncn1 a11ccfa8d5fcfe2186a1cb8414d76283 [0,2,0,0,0,0|1,0,1]=4 2537 B13R1.404 CC(CC#N)NCCc1c[nH]cn1 35a04806ad7cec81d21bdcbcbbfe6535 [0,2,0,0,0,0|1,0,1]=4 2538 B13R1.404 CC(CCO)NCCc1c[nH]cn1 084aed9ff6f7aed031ea6adc9ea67e68 [0,2,0,0,0,0|0,0,2]=4 2539 B13R1.404 CCCC(=O)NCCc1ccco1 397800d281b9afd2ab02374de5bb95f8 [0,2,0,0,0,0|2,0,0]=4 2540 B13R1.404 CCCC(=O)NCCc1cccs1 75f4307366c7fc78e7e90a2e11e3d454 [0,2,0,0,0,0|2,0,0]=4 2541 B13R1.404 CCCC(=O)NCCc1ccsc1 e4ea3730912896d4d76d5e997fc1d7d5 [0,2,0,0,0,0|2,0,0]=4 2542 B13R1.404 CCCC(=O)NCCc1cscn1 955a6b35425a8ed291415d572215c672 [0,2,0,0,0,0|1,0,0]=3 2543 B13R1.404 CCCC(=O)NCCc1nccs1 147477202768a3230a2885fec8feface [0,2,0,0,0,0|2,0,0]=4 2544 B13R1.404 CCCC(=O)NCCn1cccn1 3d38ed7d0c48623b6cf76e99b9e2b02b [0,2,0,0,0,0|2,0,0]=4 2545 B13R1.404 CCCC(=O)NCCn1cncn1 91c5defa6d74b7a7350d3737360ba078 [0,2,0,0,0,0|1,0,1]=4 2546 B13R1.404 CCCC(=O)OCOc1c[nH]cn1 6c451f08cb59b0434c39fdd6a8f7e0ba [0,2,0,0,0,0|2,0,0]=4 2547 B13R1.404 CCCC(=S)OCCc1c[nH]cn1 9d94041a16b0f3a24ab8a562d806a661 [0,2,0,0,0,0|1,1,0]=4 2548 B13R1.404 CCCC(C)NCCc1c[nH]cn1 618fe69b406cef4cd5f4c2594c31519e [0,2,0,0,0,0|1,0,1]=4 2549 B13R1.404 CCC[C@H](C)NCCc1c[nH]cn1 d2749ccc001d39693a80f4c87fe7c12d [0,2,0,0,0,0|1,0,1]=4 2550 B13R1.404 CCNC(=O)CCOc1c[nH]cn1 250528f703b9b4792344c0920e628335 [0,2,0,0,0,0|2,0,0]=4 2551 B13R1.404 CCOC(=O)CCNc1c[nH]cn1 1f9d13afe0904ccf6ea7083e451dcb36 [0,2,0,0,0,0|2,0,0]=4 2552 B13R1.404 CCOC(=O)CCOc1c[nH]cn1 c9197747d0afb5c5cad330cef5b55d75 [0,2,0,0,0,0|2,0,0]=4 2553 B13R1.404 CCOC(=O)OCOc1c[nH]cn1 ef071d032a4af2bb3dfbc784b3b9fc54 [0,2,0,0,0,0|2,0,0]=4 2554 B13R1.404 CCSC(=O)OCOc1c[nH]cn1 7476b63ba22087ceab7146c78c046510 [0,2,0,0,0,0|2,0,0]=4 2555 B13R1.404 COCC(=O)NCCc1ccco1 011d85332f13c906333dd026ab87434d [0,2,0,0,0,0|2,0,0]=4 2556 B13R1.404 COCC(=O)NCCc1cccs1 5bb8d3650f472b064ba9fdb7279aceae [0,2,0,0,0,0|2,0,0]=4 2557 B13R1.404 COCC(=O)NCCc1ccsc1 30f76d520acc59eb4cf98547dd65bd98 [0,2,0,0,0,0|2,0,0]=4 2558 B13R1.404 COCC(=O)NCCc1cscn1 06e162106c3b35527ba869489ea57c37 [0,2,0,0,0,0|1,0,0]=3 2559 B13R1.404 COCC(=O)NCCc1nccs1 d34be08dd9e99094840e7a420e8995a4 [0,2,0,0,0,0|2,0,0]=4 2560 B13R1.404 COCC(=O)NCCn1cccn1 179f2f3620ce6bc283854f2448f6cbe5 [0,2,0,0,0,0|2,0,0]=4 2561 B13R1.404 COCC(=O)NCCn1cncn1 ba16b4651f9f056fa150d44758fa6378 [0,2,0,0,0,0|1,0,1]=4 2562 B13R1.404 COCC(C)NCCc1c[nH]cn1 44ad41692078c226a6c805b85d52affb [0,2,0,0,0,0|0,0,2]=4 2563 B13R1.404 COC[C@@H](C)NCCc1c[nH]cn1 5f4ccf78947e947234ffcdc4f23d42fa [0,2,0,0,0,0|0,0,2]=4 2564 B13R1.404 COC[C@H](C)NCCc1c[nH]cn1 674984189b44d481294cf0d477df9396 [0,2,0,0,0,0|0,0,2]=4 2565 B13R1.404 CSCC(=O)NCCc1ccco1 758a3e3914deecff514cdcd1e3b4d68a [0,2,0,0,0,0|2,0,0]=4 2566 B13R1.404 CSCC(=O)NCCc1cccs1 f2645c7120c59a638f430620dcffde0d [0,2,0,0,0,0|2,0,0]=4 2567 B13R1.404 CSCC(=O)NCCc1ccsc1 5766ed503895ead96c7e93cfee1578f3 [0,2,0,0,0,0|2,0,0]=4 2568 B13R1.404 CSCC(=O)NCCc1cscn1 4c27c5848f7fc189771bc802970bb334 [0,2,0,0,0,0|1,0,0]=3 2569 B13R1.404 CSCC(=O)NCCc1nccs1 f68c259cfa5b3aa6284f2e6574838825 [0,2,0,0,0,0|2,0,0]=4 2570 B13R1.404 CSCC(=O)NCCn1cccn1 beea89c37ea2746dd5f3aae697c43bc8 [0,2,0,0,0,0|2,0,0]=4 2571 B13R1.404 CSCC(=O)NCCn1cncn1 66882263060cd0a569cf63239f730b4f [0,2,0,0,0,0|1,0,1]=4 2572 B13R1.404 C[C@@H](CCO)NCCc1c[nH]cn1 714bff69ba9779f3ffd3b14a2dda799b [0,2,0,0,0,0|0,0,2]=4 2573 B13R1.404 C[C@H](CCO)NCCc1c[nH]cn1 bacb05bbbc02cdf6cc515a6594492fe3 [0,2,0,0,0,0|0,0,2]=4 2574 B13R1.404 N#CCC(=O)NCCc1ccco1 a1e2e2d64eac29594b85484a07fa3b59 [0,2,0,0,0,0|2,0,0]=4 2575 B13R1.404 N#CCC(=O)NCCc1cccs1 30dd0aa35b48a47526f42a9939d04210 [0,2,0,0,0,0|2,0,0]=4 2576 B13R1.404 N#CCC(=O)NCCc1ccsc1 3b12ed76ec9300ce4f5fa029bd7d3cae [0,2,0,0,0,0|2,0,0]=4 2577 B13R1.404 N#CCC(=O)NCCc1cscn1 9e5004d9438fd14b6d58b12a08c21eae [0,2,0,0,0,0|1,0,0]=3 2578 B13R1.404 N#CCC(=O)NCCc1nccs1 21bb0a4df043d21e2611b24105a41e7b [0,2,0,0,0,0|2,0,0]=4 2579 B13R1.404 N#CCC(=O)NCCn1cccn1 0b8cd2b5492c03b0bf15d5d948a48942 [0,2,0,0,0,0|2,0,0]=4 2580 B13R1.404 N#CCC(=O)NCCn1cncn1 1649b00bdd2803332ef994b0c3417b04 [0,2,0,0,0,0|1,0,1]=4 2581 B13R1.404 N#CNC(=O)NCCc1c[nH]cn1 2126aa83a4921a1dfba8e543d6d1c83a [0,2,0,0,0,0|0,0,1]=3 2582 B13R1.404 N#CNC(=O)NCCc1cscn1 c0e4b626e6c329bca65d89ff83241f09 [0,2,0,0,0,0|1,0,1]=4 2583 B13R1.404 N#CNC(=S)NCCc1c[nH]cn1 34ce27036db0650b6605ea256ec4b1c6 [0,2,0,0,0,0|0,1,1]=4 2584 B13R1.404 NOCC(=O)NCCc1ccco1 86dac2f46909ff4f0380f975636e8e94 [0,2,0,0,0,0|2,0,0]=4 2585 B13R1.404 NOCC(=O)NCCc1cccs1 d0eb381aa340ceefba21e7c5a61d7a97 [0,2,0,0,0,0|2,0,0]=4 2586 B13R1.404 NOCC(=O)NCCc1ccsc1 fa683df0fd5d31299bad639ff34c15f2 [0,2,0,0,0,0|2,0,0]=4 2587 B13R1.404 NOCC(=O)NCCc1cscn1 a4f25be5113eec8f976f65c20b4c697b [0,2,0,0,0,0|1,0,0]=3 2588 B13R1.404 NOCC(=O)NCCc1nccs1 8cf47e508e959759f3087115020f83cb [0,2,0,0,0,0|2,0,0]=4 2589 B13R1.404 NOCC(=O)NCCn1cccn1 583d4444e2fe58f9889d6db19d22869d [0,2,0,0,0,0|2,0,0]=4 2590 B13R1.404 NOCC(=O)NCCn1cncn1 59674f40bf96def1531ab6f41a8d7efb [0,2,0,0,0,0|1,0,1]=4 2591 B13R1.404 O=C(/C=C/Br)NCCc1cscn1 2868268e9e5818581b982317df32a5aa [0,2,0,0,0,0|1,0,1]=4 2592 B13R1.404 O=C(/C=C/Cl)NCCc1cscn1 20220a011a8e9293b9b9483a8f00d234 [0,2,0,0,0,0|1,0,1]=4 2593 B13R1.404 O=C(/C=C/I)NCCc1cscn1 778025ffaa6aac00cd1f0b389447ae11 [0,2,0,0,0,0|1,0,1]=4 2594 B13R1.404 O=C(/C=C\Br)NCCc1cscn1 8ef563be554e32f8289d3b52819b302b [0,2,0,0,0,0|1,0,1]=4 2595 B13R1.404 O=C(/C=C\Cl)NCCc1cscn1 bf6e2642188278144beaeb100c756d10 [0,2,0,0,0,0|1,0,1]=4 2596 B13R1.404 O=C(/C=C\I)NCCc1cscn1 81a4c914bce1852a5f5f66023f8712fc [0,2,0,0,0,0|1,0,1]=4 2597 B13R1.404 O=C(C#CBr)NCCc1cscn1 0348834d4d7832897c8c830cffb4f734 [0,2,0,0,0,0|1,0,1]=4 2598 B13R1.404 O=C(C=CBr)NCCc1cscn1 215f88cb90dbd06111bc17dd1117ef2a [0,2,0,0,0,0|1,0,1]=4 2599 B13R1.404 O=C(C=CI)NCCc1cscn1 7fe87298a1dd203292e980fbcda0ff06 [0,2,0,0,0,0|1,0,1]=4 2600 B13R1.404 O=C(CCF)NCCc1ccco1 b075cb0b7b729ad6c8749719e8a27ea8 [0,2,0,0,0,0|2,0,0]=4 2601 B13R1.404 O=C(CCF)NCCc1cccs1 26f8a133c57057ed941153f3148e24f4 [0,2,0,0,0,0|2,0,0]=4 2602 B13R1.404 O=C(CCF)NCCc1ccsc1 4d11fb68ae12e38d7e6ff6f1d8d26efe [0,2,0,0,0,0|2,0,0]=4 2603 B13R1.404 O=C(CCF)NCCc1cscn1 775e12a841e46b4d65769c9725daecb7 [0,2,0,0,0,0|1,0,0]=3 2604 B13R1.404 O=C(CCF)NCCc1nccs1 569409b0f390d250e4518baee5c1ce44 [0,2,0,0,0,0|2,0,0]=4 2605 B13R1.404 O=C(CCF)NCCn1cccn1 e1221889f8183941023f17437941ba8b [0,2,0,0,0,0|2,0,0]=4 2606 B13R1.404 O=C(CCF)NCCn1cncn1 d83ee66dad34bde3ae0a51250ef03fde [0,2,0,0,0,0|1,0,1]=4 2607 B13R1.404 O=C(CCO)NCCc1ccco1 8b4cf3214327328007b06d5bd40dcfbb [0,2,0,0,0,0|2,0,0]=4 2608 B13R1.404 O=C(CCO)NCCc1cccs1 80fecdedb7e7b5d1003c7b796acde308 [0,2,0,0,0,0|2,0,0]=4 2609 B13R1.404 O=C(CCO)NCCc1ccsc1 fe3f30fe6c1bb0355488d5c9a0c7de47 [0,2,0,0,0,0|2,0,0]=4 2610 B13R1.404 O=C(CCO)NCCc1cscn1 78b900be09abfcba16c826223d7364eb [0,2,0,0,0,0|1,0,0]=3 2611 B13R1.404 O=C(CCO)NCCc1nccs1 420c33936f0d5d05a2611d76c4d35144 [0,2,0,0,0,0|2,0,0]=4 2612 B13R1.404 O=C(CCO)NCCn1cccn1 5b732b07130fdafbb755568c2cf171cd [0,2,0,0,0,0|2,0,0]=4 2613 B13R1.404 O=C(CCO)NCCn1cncn1 d6e7df6d767f42aa64f2253fa940b466 [0,2,0,0,0,0|1,0,1]=4 2614 B13R1.404 O=C(CCS)NCCc1ccco1 de318ba95986bf87cec95a90e086e300 [0,2,0,0,0,0|2,0,0]=4 2615 B13R1.404 O=C(CCS)NCCc1cccs1 14b138bc21385211f7dc100355a44583 [0,2,0,0,0,0|2,0,0]=4 2616 B13R1.404 O=C(CCS)NCCc1ccsc1 4e47875367363ba6909d5b1246433fdc [0,2,0,0,0,0|2,0,0]=4 2617 B13R1.404 O=C(CCS)NCCc1cscn1 a0b77a37280fbce0a7c767255f5167f2 [0,2,0,0,0,0|1,0,0]=3 2618 B13R1.404 O=C(CCS)NCCc1nccs1 4676a0c8139d1d020ac1578b7c1c0018 [0,2,0,0,0,0|2,0,0]=4 2619 B13R1.404 O=C(CCS)NCCn1cccn1 3d4dc171a4592b276c231275473dad40 [0,2,0,0,0,0|2,0,0]=4 2620 B13R1.404 O=C(CCS)NCCn1cncn1 71757d5be5ab82199de8aad7b52df625 [0,2,0,0,0,0|1,0,1]=4 2621 B13R1.404 O=CCC(=O)NCCc1ccco1 fc4d128984ace5d944dd048d0980821e [0,2,0,0,0,0|2,0,0]=4 2622 B13R1.404 O=CCC(=O)NCCc1cccs1 eeed954676305270e8223edc4d8134b4 [0,2,0,0,0,0|2,0,0]=4 2623 B13R1.404 O=CCC(=O)NCCc1ccsc1 8ef26593dd9092310f269ba3e76fb397 [0,2,0,0,0,0|2,0,0]=4 2624 B13R1.404 O=CCC(=O)NCCc1cscn1 87a64851ab4d8ab18e3754be92e44851 [0,2,0,0,0,0|1,0,0]=3 2625 B13R1.404 O=CCC(=O)NCCc1nccs1 9d7b87863c48535c74b044b3d6d551c3 [0,2,0,0,0,0|2,0,0]=4 2626 B13R1.404 O=CCC(=O)NCCn1cccn1 abf6267841e24fe1569635707ada06c9 [0,2,0,0,0,0|2,0,0]=4 2627 B13R1.404 O=CCC(=O)NCCn1cncn1 5c3de6178ec7d9abb51295f7401a5527 [0,2,0,0,0,0|1,0,1]=4 2628 B13R1.415 C=C[C@@H](CO)NCCc1c[nH]cn1 6788e27f4f079e83a6f9e6c3cbc0b9e8 [0,2,0,0,0,0|1,0,1]=4 2629 B13R1.415 CCC(C=O)NCCc1c[nH]cn1 6b0c45e3c3bb1f9800086ee8593de8b6 [0,2,0,0,0,0|0,0,1]=3 2630 B13R1.415 CCC(C=O)NCCc1cscn1 33fbb318ea79f83b2907620c17ca7064 [0,2,0,0,0,0|1,0,1]=4 2631 B13R1.415 CCC(C=O)OCCc1c[nH]cn1 e2c28a1d24e4aaa2569ae43b989ab374 [0,2,0,0,0,0|1,0,1]=4 2632 B13R1.415 CCC(CC)NCCc1c[nH]cn1 17f7cda73112cd75577ab0fbd889e020 [0,2,0,0,0,0|1,0,1]=4 2633 B13R1.415 CCC(CO)NCCc1c[nH]cn1 e2a01598d2bd27a8ff80e89eb2eb4b28 [0,2,0,0,0,0|0,0,2]=4 2634 B13R1.415 CC[C@@H](CO)NCCc1c[nH]cn1 7e8eb3a04d26335bb4b48b7f06b6d4b2 [0,2,0,0,0,0|0,0,2]=4 2635 B13R1.415 CC[C@H](CO)NCCc1c[nH]cn1 8935093c21cb5065bdf2e7570948b166 [0,2,0,0,0,0|0,0,2]=4 2636 B13R1.415 N#CC(C=O)NCCc1c[nH]cn1 5a7f304a2342af06c1ce79a09042da66 [0,2,0,0,0,0|0,0,2]=4 2637 B13R1.415 O=CC(C=O)NCCc1c[nH]cn1 3147a968053b14adb5467d780d92cabb [0,2,0,0,0,0|0,0,2]=4 2638 B13R1.415 OCC(CO)NCCc1c[nH]cn1 887e8d69690745f5f9f0ae00ea92c0b3 [0,2,0,0,0,0|0,0,2]=4 2639 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [0,0,1,1,0,0|1,0,1]=4 2640 B11R1.91 CC(=O)NCc1cccnc1 7b71a51c058bd0c2c3114d8b61c7e1f0 [0,0,1,1,0,0|1,0,1]=4 2641 B11R1.91 CC(=O)NCc1ccncn1 bb4e634dd2d2ac1df6c40895aef3c1f0 [0,0,1,1,0,0|0,0,2]=4 2642 B11R1.91 CC(=O)NCc1cncnc1 1788fa75b9a7d3ec40c95f826ad49ab5 [0,0,1,1,0,0|0,0,2]=4 2643 B11R2.191 O=CN1CCn2c1ccn2 21cba250c68f4469c1391044c444be33 [1,0,0,1,0,0|2,0,0]=4 2644 B13R2.72 CC(=O)N1CCc2c1cccc2 06be9692527493672f216ca7cabc8bee [0,0,0,1,0,1|2,0,0]=4 2645 B13R2.72 CC(=O)N1CCc2c1cccn2 cace13d03125c22f0b076fa307071656 [0,0,0,1,0,1|1,0,0]=3 2646 B13R2.72 CC(=O)N1CCc2c1ccnc2 43696cab199efbf3d817303e4ead7716 [0,0,0,1,0,1|1,0,0]=3 2647 B13R2.72 CC(=O)N1CCc2c1cncc2 8743a7db8f186255cf444d652cbf2ff3 [0,0,0,1,0,1|1,0,1]=4 2648 B13R2.72 CC(=O)N1CCc2c1nccc2 a50667ae9032d1830af5e23281a81a70 [0,0,0,1,0,1|1,0,0]=3 2649 B13R2.72 CC(=O)N1CCc2c1nccn2 ef49b0853e146abf21112fc3fd70e4ef [0,0,0,1,0,1|0,0,1]=3 2650 B13R2.72 CC(=O)N1CCc2c1ncnc2 6bd20886c2a25dfeedc18fe2f157dc15 [0,0,0,1,0,1|0,0,1]=3 2651 B13R2.423 CC(=O)N1CC1c2ccccc2 bdc9a9f283b4c1f3b1a56bf7092820e7 [0,0,0,1,0,1|2,0,0]=4 2652 B13R2.423 CC(=O)N1C[C@@H]1c2ccccc2 580257c50481dcd5a619adce6e734789 [0,0,0,1,0,1|2,0,0]=4 2653 B13R2.142 O=C1CC(CN1)Nc2c[nH]cn2 ea8c7f0d85983936c7463951de239ff9 [0,0,0,1,0,1|0,0,0]=2 2654 B13R2.142 O=C1CC(CN1)Nc2ccoc2 c262035cb0d859603806088db6c0e2c8 [0,0,0,1,0,1|2,0,0]=4 2655 B13R2.142 O=C1CC(CN1)Nc2nccs2 a6dc5b2a818eaa006ff471310f6483df [0,0,0,1,0,1|2,0,0]=4 2656 B13R2.142 O=C1CC(CN1)Nc2nn[nH]n2 6b8b50e27fcfa66ac43ab2ae42ab910f [0,0,0,1,0,1|2,0,0]=4 2657 B13R2.142 O=C1CN(CN1)Cc2ccco2 0be169b9cc2ef972fee61662507c9f6b [0,0,0,1,0,1|2,0,0]=4 2658 B13R2.142 O=C1CN(CN1)Cc2cccs2 91264f2438d322c3e96d2e25cae30e97 [0,0,0,1,0,1|2,0,0]=4 2659 B13R2.142 O=C1CN(CN1)Cc2ccon2 32dfe9d89586dc76fce6fce8e9c580c4 [0,0,0,1,0,1|2,0,0]=4 2660 B13R2.142 O=C1CN(CN1)Cc2ccsc2 8d2169aa4d20d9beabc908227f0b70ca [0,0,0,1,0,1|2,0,0]=4 2661 B13R2.142 O=C1CN(CN1)Cc2cnc[nH]2 b4198c753f64f18cd60d9696c19669d5 [0,0,0,1,0,1|0,0,2]=4 2662 B13R2.142 O=C1CN(CN1)Cc2cnco2 0d9406c2bed3bf6f5ff26aea547583af [0,0,0,1,0,1|1,0,1]=4 2663 B13R2.142 O=C1CN(CN1)Cc2cocn2 80d9302e8ee8bf36a7bf1b650b96448d [0,0,0,1,0,1|1,0,0]=3 2664 B13R2.142 O=C1CN(CN1)Cc2cscn2 37ae9ae3661a23eb8bc77af5e4dfc86e [0,0,0,1,0,1|1,0,0]=3 2665 B13R2.142 O=C1CN(CN1)Cc2nc[nH]n2 8270255cf238937c298d84dfde32bede [0,0,0,1,0,1|1,0,0]=3 2666 B13R2.142 O=C1CN(CN1)Cc2ncc[nH]2 7090e973ad21b773fd5082769855ba84 [0,0,0,1,0,1|2,0,0]=4 2667 B13R2.142 O=C1CN(CN1)Cc2ncco2 29b264e630df5aa00e2db63e66849b68 [0,0,0,1,0,1|2,0,0]=4 2668 B13R2.142 O=C1CN(CN1)Cc2nccs2 8ded0e90aff1cc67d57d2dff708162ce [0,0,0,1,0,1|2,0,0]=4 2669 B13R2.142 O=C1CN(CN1)Cc2ncno2 311633a54af18bebd8d6f2b86c964923 [0,0,0,1,0,1|1,0,1]=4 2670 B13R2.142 O=C1CN(CN1)Cc2ncon2 da175b5f229b4e6d1c8b1748cd42881e [0,0,0,1,0,1|2,0,0]=4 2671 B13R2.142 O=C1CN(CN1)Cn2cncn2 f2f710a281a5e905d73800ab83d4f1ae [0,0,0,1,0,1|1,0,1]=4 2672 B13R2.142 O=C1C[C@@H](CN1)Nc2c[nH]cn2 45e669845b068d99d6ec016d2f974626 [0,0,0,1,0,1|0,0,0]=2 2673 B13R2.142 O=C1C[C@@H](CN1)Nc2ccoc2 44db30c44a78154a8202e75008861adf [0,0,0,1,0,1|2,0,0]=4 2674 B13R2.142 O=C1C[C@@H](CN1)Nc2nccs2 2ae6263c068eb2c871e95504cfcac064 [0,0,0,1,0,1|2,0,0]=4 2675 B13R2.142 O=C1C[C@@H](CN1)Nc2nn[nH]n2 ec31d26ec58f1e03cccc1407e2ee3c17 [0,0,0,1,0,1|2,0,0]=4 2676 B13R2.142 O=C1C[C@H](CN1)Nc2c[nH]cn2 70835992d830d2575bd1c26dda4edfd4 [0,0,0,1,0,1|0,0,0]=2 2677 B13R2.142 O=C1C[C@H](CN1)Nc2ccoc2 c7cce2fdc6ec6a9d3d7ea6421f8981e4 [0,0,0,1,0,1|2,0,0]=4 2678 B13R2.142 O=C1C[C@H](CN1)Nc2nccs2 dccc7aca2f88809046eeecd478a5b5be [0,0,0,1,0,1|2,0,0]=4 2679 B13R2.142 O=C1C[C@H](CN1)Nc2nn[nH]n2 061f65ecd0238067b5afa8ec60a647d6 [0,0,0,1,0,1|2,0,0]=4 2680 B13R2.196 CC1CC1NCCc2c[nH]cn2 439d53a79e3ba2319b5ecd12a599b2ed [0,0,0,1,0,1|1,0,1]=4 2681 B13R2.196 F[C@@H]1C[C@@H]1NCCc2c[nH]cn2 fbf81c4216320c119533cf0cb2c4c61b [0,0,0,1,0,1|1,0,1]=4 2682 B13R2.196 F[C@@H]1C[C@H]1NCCc2c[nH]cn2 a471ccfc35d111cbdc72e9608376f6e2 [0,0,0,1,0,1|1,0,1]=4 2683 B13R2.196 F[C@H]1C[C@@H]1NCCc2c[nH]cn2 f0393c9c257b49a4ca26c219c03d137a [0,0,0,1,0,1|1,0,1]=4 2684 B13R2.241 C=C1CC(C1)COc2c[nH]cn2 2e3e893bc013dc2ea9b972d14f593129 [0,0,0,1,0,1|2,0,0]=4 2685 B13R2.241 FC1CN(C1)CCc2c[nH]cn2 0115ed157e9fd82273bce5ba8c2a8c45 [0,0,0,1,0,1|1,0,1]=4 2686 B13R2.241 O=C1CC(C1)CNc2cocn2 00e8f751837e82e25555d2f585d8bb44 [0,0,0,1,0,1|2,0,0]=4 2687 B13R2.241 O=C1CC(C1)CNc2cscn2 faf5e098ec5022b7a74a9d062f7cdf6e [0,0,0,1,0,1|2,0,0]=4 2688 B13R2.241 O=C1CC(C1)CNc2nc[nH]n2 ff53e656213b9869eff326f743d3d7fd [0,0,0,1,0,1|2,0,0]=4 2689 B13R2.241 O=C1CC(C1)COc2c[nH]cn2 05855dafa050df80875a7fb93cedb176 [0,0,0,1,0,1|1,0,0]=3 2690 B13R2.241 O=C1CC(C1)NCc2c[nH]nn2 9671e8f1d98620635a9ef5bb1eb21809 [0,0,0,1,0,1|2,0,0]=4 2691 B13R2.241 O=C1CC(C1)NCc2cc[nH]c2 bf515bd02dcb8074004852041c8a5814 [0,0,0,1,0,1|2,0,0]=4 2692 B13R2.241 O=C1CC(C1)NCc2cscn2 c88200e9e5644e2f5fd2b8f2c06c5a88 [0,0,0,1,0,1|2,0,0]=4 2693 B13R2.241 O=C1CC(C1)OCc2cc[nH]c2 e4c9cc6e563cb313c7ae55e9a5b30db4 [0,0,0,1,0,1|2,0,0]=4 2694 B13R2.241 O=C1CC(C1)OCc2cocn2 b3e377a1f5082882f38c66b8fa6833a9 [0,0,0,1,0,1|2,0,0]=4 2695 B13R2.241 O=C1CC(C1)OCc2cscn2 d1a8bfa3a9bb6bfc3436ea757116a366 [0,0,0,1,0,1|2,0,0]=4 2696 B13R2.241 O=C1CC(C1)OCc2nc[nH]n2 80aa26cb05976ba146a806159b84bb1c [0,0,0,1,0,1|2,0,0]=4 2697 B13R2.241 O=C1CC(N1)CNc2cc[nH]n2 f24aac2297ab37822bccf59790628b8f [0,0,0,1,0,1|2,0,0]=4 2698 B13R2.241 O=C1CC(N1)CNc2cccs2 403b0c2f5865f3f8445af2d113498e84 [0,0,0,1,0,1|2,0,0]=4 2699 B13R2.241 O=C1CC(N1)CNc2ccon2 cd174d11e67e14fc8ccbb3d7d21a24b6 [0,0,0,1,0,1|2,0,0]=4 2700 B13R2.241 O=C1CC(N1)CNc2ccsc2 9d71e33863d7e1dfbef9ba0b666fc527 [0,0,0,1,0,1|2,0,0]=4 2701 B13R2.241 O=C1CC(N1)CNc2cn[nH]c2 e8b8524bb31d4bb58e02fc1ef754d145 [0,0,0,1,0,1|2,0,0]=4 2702 B13R2.241 O=C1CC(N1)CNc2cncs2 f0139ac19f6a2052d4658765e5c1f189 [0,0,0,1,0,1|1,0,1]=4 2703 B13R2.241 O=C1CC(N1)CNc2cnon2 864f6315405f6dbcbf5986645f9be659 [0,0,0,1,0,1|1,0,1]=4 2704 B13R2.241 O=C1CC(N1)CNc2cocn2 57dd9cf3f0cfa074d5cd533ea470f630 [0,0,0,1,0,1|1,0,0]=3 2705 B13R2.241 O=C1CC(N1)CNc2cscn2 1175efe7bd07191de6a78f84fdddb04a [0,0,0,1,0,1|1,0,0]=3 2706 B13R2.241 O=C1CC(N1)CNc2nc[nH]n2 be0075eabaabea615c29cd47e0ed81ea [0,0,0,1,0,1|1,0,0]=3 2707 B13R2.241 O=C1CC(N1)CNc2ncc[nH]2 2415d402a81c7e307f0d20d3a016e89f [0,0,0,1,0,1|2,0,0]=4 2708 B13R2.241 O=C1CC(N1)CNc2ncco2 1959765270802084c424712ce52ee328 [0,0,0,1,0,1|2,0,0]=4 2709 B13R2.241 O=C1CC(N1)CNc2nccs2 69cfac0ca4e28844bb7369177861375f [0,0,0,1,0,1|2,0,0]=4 2710 B13R2.241 O=C1CC(N1)CNc2ncns2 5c9ca6ea1339477abd81a32682e08aed [0,0,0,1,0,1|1,0,1]=4 2711 B13R2.241 O=C1CC(N1)CNc2ncon2 a5f431efb2b48026b2b878d5833d71f2 [0,0,0,1,0,1|2,0,0]=4 2712 B13R2.241 O=C1CC(N1)CNc2ncsn2 f8cba3d0c035cca9cf02edb18913bef3 [0,0,0,1,0,1|2,0,0]=4 2713 B13R2.241 O=C1CC(N1)CNc2nn[nH]n2 641ad7481b8d7d0198156be5d6882820 [0,0,0,1,0,1|2,0,0]=4 2714 B13R2.241 O=C1CC(N1)COc2c[nH]cn2 dce12c12a289c62f80c9b20a99a739b3 [0,0,0,1,0,1|0,0,0]=2 2715 B13R2.241 O=C1CC(N1)COc2ccco2 e4a4ecb511785b3757ca32dca67a9df3 [0,0,0,1,0,1|2,0,0]=4 2716 B13R2.241 O=C1CC(N1)COc2cccs2 52db346586e9bab6427a90159d18ff46 [0,0,0,1,0,1|2,0,0]=4 2717 B13R2.241 O=C1CC(N1)COc2ccsc2 e6f7959975237baeba1300e16c77e8fb [0,0,0,1,0,1|2,0,0]=4 2718 B13R2.241 O=C1CC(N1)COc2cn[nH]c2 1514802442d92fcc82088e4ea39c72cb [0,0,0,1,0,1|2,0,0]=4 2719 B13R2.241 O=C1CC(N1)COc2cnsn2 88e30f9fc74bde066763b368e654ebe0 [0,0,0,1,0,1|1,0,1]=4 2720 B13R2.241 O=C1CC(N1)COc2nccs2 dd3192f14a7c6fbdefd5dcac4eeeca10 [0,0,0,1,0,1|2,0,0]=4 2721 B13R2.241 O=C1CC(N1)COn2cccn2 44d14e0816c0e3fd3be255312e0a869b [0,0,0,1,0,1|2,0,0]=4 2722 B13R2.241 O=C1CC(O1)CNc2cocn2 b18af09e92d225b7b917cd6c2b3317fb [0,0,0,1,0,1|2,0,0]=4 2723 B13R2.241 O=C1CC(O1)CNc2cscn2 6969c46ed77b0b754ba634a99b76bed1 [0,0,0,1,0,1|2,0,0]=4 2724 B13R2.241 O=C1CC(O1)CNc2nc[nH]n2 a92ca496e061430481a7e576c23d91cb [0,0,0,1,0,1|2,0,0]=4 2725 B13R2.241 O=C1CC(O1)COc2c[nH]cn2 efcfccd5c58f3faeba081d920258b370 [0,0,0,1,0,1|1,0,0]=3 2726 B13R2.241 OC1CN(C1)CCc2c[nH]cn2 f686fed77abb7dcf0eb8710293649587 [0,0,0,1,0,1|0,0,2]=4 2727 B13R2.424 O=C(O)[C@@H]1C[C@@H]1Oc2c[nH]cn2 b84bf702395d2da7e3ba53a91aa39593 [0,0,0,1,0,1|2,0,0]=4 2728 B13R2.424 O=C(O)[C@H]1C[C@@H]1Oc2c[nH]cn2 6eba49cc22cfd71e236a544f3942736e [0,0,0,1,0,1|2,0,0]=4 2729 B13R2.424 O=C(O)[C@H]1C[C@H]1Oc2c[nH]cn2 fb6d8a75d8bb448a0d15a593491b16a8 [0,0,0,1,0,1|2,0,0]=4 2730 B13R2.687 CC(=O)NC1CCc2c1ccs2 4dabcc2e669846bb4ff0bdb4ae0f78af [0,0,0,1,0,1|2,0,0]=4 2731 B13R2.2380 c1nc(c[nH]1)CCCNC2CC2 94c0e50b9fb5e999a5a9350e47e9a0c5 [0,0,0,1,0,1|1,0,1]=4 2732 B13R2.2380 c1nc(c[nH]1)CCNCC2CC2 ac407ba910e2dd28af8251e9bc5d745c [0,0,0,1,0,1|1,0,1]=4 2733 B13R2.3598 CC1(CN1CCc2c[nH]cn2)C f4c9a2f708e07b404018cde494bab280 [0,0,0,1,0,1|1,0,1]=4 2734 B13R2.5569 CC(=O)N1CCCn2c1ccn2 9685644a84ffcb1e542c33f415018532 [0,0,0,1,0,1|2,0,0]=4 2735 B13R2.436 CC(=O)N1CC(C1)n2cccn2 b6cc3de9825b2590d925c6f892e3566a [0,1,0,1,0,0|2,0,0]=4 2736 B13R2.436 CC(=O)N1CC(C1)n2cncn2 fc027e9c68f70b89577f4835d4640f2c [0,1,0,1,0,0|1,0,1]=4 2737 B13R2.2965 Cn1cnc(c1)NC2CC(=O)C2 b7022939067fe16ac64b09bfbf4ec79e [0,1,0,1,0,0|2,0,0]=4 2738 B13R2.2973 Cn1cnc(c1)CCNC2CC2 049a8028724337a52e1f6fc202a4e16d [0,1,0,1,0,0|1,0,1]=4 2739 B13R2.430 CC(=O)N1CCc2ncsc2C1 905502e68ba42e06e44095bcf8f6bf36 [0,1,0,1,0,0|1,0,0]=3 2740 B13R2.430 CC(=O)N1CCc2nocc2C1 78ef8ccaf329b1c8a2e1d66a910db308 [0,1,0,1,0,0|2,0,0]=4 2741 B13R2.430 CC(=O)N1CCc2occc2C1 d833edff8fbaf155c90389316aab7001 [0,1,0,1,0,0|2,0,0]=4 2742 B13R2.430 CC(=O)N1CCc2sccc2C1 0c3ec934eae6b4098596d25bf4f8902f [0,1,0,1,0,0|2,0,0]=4 2743 B13R2.430 CC(=O)N1CCc2scnc2C1 6df6944f15a000facb63e6d5d5aaf15a [0,1,0,1,0,0|1,0,1]=4 2744 B13R2.430 CC(=O)N1CCn2nccc2C1 081fd3efb60760e4fcf7bc5e7a46698f [0,1,0,1,0,0|2,0,0]=4 2745 B13R2.430 CC(=O)N1CCn2ncnc2C1 c6495da76e177e0df5fabe250d7a2a68 [0,1,0,1,0,0|1,0,1]=4 2746 B13R2.696 CC(Cc1c[nH]cn1)NC2CC2 bc165234732ce23f27fd228a733f1d88 [0,1,0,1,0,0|1,0,1]=4 2747 B13R2.696 C[C@@H](Cc1c[nH]cn1)NC2CC2 72eddbcda98fcb1463dac04fd9b27a4a [0,1,0,1,0,0|1,0,1]=4 2748 B13R2.696 C[C@H](Cc1c[nH]cn1)NC2CC2 636b01c35358b1ded3b0adfb8708f087 [0,1,0,1,0,0|1,0,1]=4 2749 B13R2.158 O=C1OCC1COc2c[nH]cn2 f45ff80b844c300b7d541dec34bf590d [0,1,0,1,0,0|2,0,0]=4 2750 B13R2.6970 CN(CCc1c[nH]cn1)C2CC2 a81061720568688c8b0d294e2e8cb167 [0,1,0,1,0,0|1,0,1]=4 2751 B13R2.1095 CCC(=O)N1CCn2c1ccn2 4f9f20910561be4f79edcd5989d40499 [0,1,0,1,0,0|2,0,0]=4 2752 B13R2.1095 O=C(CF)N1CCn2c1ccn2 ba45ab6cc9fc85f248ef39379dba425c [0,1,0,1,0,0|2,0,0]=4 2753 B13R2.1095 O=C(CO)N1CCn2c1ccn2 007c187cbc72a11fc20ea7ff55b4796f [0,1,0,1,0,0|2,0,0]=4 2754 B13R2.2381 c1nc(c[nH]1)CCNC2CCC2 a3bde400e2c0494d395d0e46f20a106a [0,1,0,1,0,0|1,0,1]=4 2755 B13R2.2381 c1nc(c[nH]1)CCNC2COC2 6edc0781d655c6ceb23087654e50d0bd [0,1,0,1,0,0|0,0,2]=4 2756 B13R2.3205 CC1(CC1)NCCc2c[nH]cn2 439d2aa83e35b6a28124085b61dd0f15 [0,1,0,1,0,0|1,0,1]=4 2757 B9R1.13 CC(=O)Nc1cccs1 f70dc40a2b7a68d7210198fbab697918 [0,0,0,0,2,0|2,0,0]=4 2758 B9R1.13 CC(=O)Nc1ccsc1 b43c291cb5d72b5ddddbae12e8c0d0d9 [0,0,0,0,2,0|2,0,0]=4 2759 B9R1.13 CC(=O)Nc1cncs1 8e4d874841813b151af824130870907f [0,0,0,0,2,0|1,0,1]=4 2760 B9R1.13 CC(=O)Nc1cnon1 071250f23b295cbad50171808e0c5032 [0,0,0,0,2,0|1,0,1]=4 2761 B9R1.13 CC(=O)Nc1cocn1 4089e82890500e24c2afb0f19306f425 [0,0,0,0,2,0|1,0,0]=3 2762 B9R1.13 CC(=O)Nc1cscn1 40e369b2af88cefbcc061c4b162a2ec0 [0,0,0,0,2,0|1,0,0]=3 2763 B9R1.13 CC(=O)Nc1ncco1 b16f0a75e381dc1cebd6e7c0a9c2918e [0,0,0,0,2,0|2,0,0]=4 2764 B9R1.13 CC(=O)Nc1nccs1 77a8d229d5e2ebce94e2316ec872dfb6 [0,0,0,0,2,0|2,0,0]=4 2765 B9R1.13 CC(=O)Nc1ncns1 18eb207d1ea047dd616d0591bfe85991 [0,0,0,0,2,0|1,0,1]=4 2766 B11R1.28 CCNCCc1ccccn1 08ffb64a8c703d8e611cb4b81d73ea48 [1,0,0,0,0,1|1,0,1]=4 2767 B11R1.28 CCNCCc1cccnc1 4a3a0c73e4e732e57ab84a312bb6bfb2 [1,0,0,0,0,1|1,0,1]=4 2768 B11R1.28 CCNCCc1ccncn1 dba79812e975c4d64e5e25d258f9e6a6 [1,0,0,0,0,1|0,0,2]=4 2769 B11R1.28 CCNCCc1cnccn1 2497cab3d04dd1dac7aa9e87fb020630 [1,0,0,0,0,1|0,0,2]=4 2770 B11R1.28 CCNCCc1ncccn1 8878621879d60c35f5e690c8ce15ae29 [1,0,0,0,0,1|1,0,1]=4 2771 B11R1.28 O=CNCCc1ccccc1 d1fab3f35b45ae0bc45cf7bf9f19384c [1,0,0,0,0,1|2,0,0]=4 2772 B11R1.28 O=CNCCc1ccccn1 36fb465b4a699ed2860619296ed044a4 [1,0,0,0,0,1|1,0,0]=3 2773 B11R1.28 O=CNCCc1cccnc1 5111296cce1960f11ad77b3eaf87d913 [1,0,0,0,0,1|1,0,0]=3 2774 B11R1.28 O=CNCCc1ccncc1 5e83eff0a4bbf0070c01463bdeac3941 [1,0,0,0,0,1|1,0,1]=4 2775 B11R1.28 O=CNCCc1ccncn1 c61ffee11aa76c4b79dbd40eecd5754f [1,0,0,0,0,1|0,0,1]=3 2776 B11R1.28 O=CNCCc1cnccn1 aa33cad7c82b76f9314494217572508e [1,0,0,0,0,1|0,0,1]=3 2777 B11R1.28 O=CNCCc1ncccn1 205f827e0f0482740367998916b6a3ab [1,0,0,0,0,1|1,0,0]=3 2778 B13R1.337 C=C(C)CNCCc1ccccn1 8c13fe86cc5bf325d72a3e3f5212f6c3 [0,0,0,0,0,2|2,0,0]=4 2779 B13R1.337 C=C(C)CNCCc1cccnc1 71e140503491c2d8d40f3be819e212e2 [0,0,0,0,0,2|2,0,0]=4 2780 B13R1.337 C=C(C)CNCCc1ccncn1 e89318b95490e6de04616f788334ea6c [0,0,0,0,0,2|1,0,1]=4 2781 B13R1.337 C=C(C)CNCCc1cnccn1 b2a08840667cd4745e2d612a9ddea005 [0,0,0,0,0,2|1,0,1]=4 2782 B13R1.337 C=C(C)CNCCc1ncccn1 e70aa06ef6970c9f524c410cbaa33bc1 [0,0,0,0,0,2|2,0,0]=4 2783 B13R1.337 CC(=O)CCCNc1ccccn1 ecf3c5b1c504f1704f05ce63ebe264d7 [0,0,0,0,0,2|2,0,0]=4 2784 B13R1.337 CC(=O)CCCNc1cccnc1 20c92d1509ab46d75c7f1ad219029dc5 [0,0,0,0,0,2|2,0,0]=4 2785 B13R1.337 CC(=O)CCCNc1cccnn1 9ad0b942c8dbbd18ce8711b0a9a02637 [0,0,0,0,0,2|2,0,0]=4 2786 B13R1.337 CC(=O)CCCNc1ccncn1 467ebb8f46097a9a2ddfc0b5f582069a [0,0,0,0,0,2|1,0,1]=4 2787 B13R1.337 CC(=O)CCCNc1cnccn1 cc4c5d5148d148ab7a0a14838948c100 [0,0,0,0,0,2|1,0,1]=4 2788 B13R1.337 CC(=O)CCCNc1cncnc1 d67daf3e03313f7fe9adab3b1d8e99b0 [0,0,0,0,0,2|1,0,1]=4 2789 B13R1.337 CC(=O)CCCNc1cnncn1 7a57f34e911364ad66dd20ab7b47bcea [0,0,0,0,0,2|1,0,1]=4 2790 B13R1.337 CC(=O)CCCNc1ncccn1 d0c73229e3092c99c57e8cc22f340d30 [0,0,0,0,0,2|2,0,0]=4 2791 B13R1.337 CC(=O)CCCNc1ncncn1 e827141bc86ffaf4acd7667dfa0fdf0f [0,0,0,0,0,2|1,0,1]=4 2792 B13R1.337 CC(=O)CCCOc1ccccn1 eabb395048f3ce092959f8c8a00ccc13 [0,0,0,0,0,2|2,0,0]=4 2793 B13R1.337 CC(=O)CCCOc1cccnc1 a0dee480be33de89665303fbfcfe38d5 [0,0,0,0,0,2|2,0,0]=4 2794 B13R1.337 CC(=O)CCCOc1cnccn1 693d4e43b728989b30abf92af984baa4 [0,0,0,0,0,2|1,0,1]=4 2795 B13R1.337 CC(=O)CCCOc1cncnc1 e82194ff03ececd5a3b1cc8addd604ea [0,0,0,0,0,2|1,0,1]=4 2796 B13R1.337 CC(=O)CCCOc1ncccn1 0d7c050c7c524eb5ea33721fce7fce9c [0,0,0,0,0,2|2,0,0]=4 2797 B13R1.337 CC(=O)CCNCc1ccccn1 23774b7b8b1ff0aeefd338f8d559d542 [0,0,0,0,0,2|2,0,0]=4 2798 B13R1.337 CC(=O)CCNCc1cccnc1 0b35ad7bc1a13d5a7ac075baa9669822 [0,0,0,0,0,2|2,0,0]=4 2799 B13R1.337 CC(=O)CCNCc1cccnn1 61e6e75f2f0004e230ef76a3d8caeb89 [0,0,0,0,0,2|2,0,0]=4 2800 B13R1.337 CC(=O)CCNCc1ccncn1 3ce84ceaea4c51c032eda2596eab9b2a [0,0,0,0,0,2|1,0,1]=4 2801 B13R1.337 CC(=O)CCNCc1cnccn1 45f9f3ab4a61b6672dd65e22cc5514ec [0,0,0,0,0,2|1,0,1]=4 2802 B13R1.337 CC(=O)CCNCc1cncnc1 62cf9c16572171d24baeaab9cdd480c3 [0,0,0,0,0,2|1,0,1]=4 2803 B13R1.337 CC(=O)CCNCc1ncccn1 23168e27eecba2f88a5dcadfbde8f2ee [0,0,0,0,0,2|2,0,0]=4 2804 B13R1.337 CC(=O)CCOCc1ccccn1 195cdad993f8bee565ad3b388160ec64 [0,0,0,0,0,2|2,0,0]=4 2805 B13R1.337 CC(=O)CCOCc1cccnc1 dd4457e56c42f37c43a3ffb9c7a09212 [0,0,0,0,0,2|2,0,0]=4 2806 B13R1.337 CC(=O)CCOCc1cccnn1 0c8b385ec7ed5c17dad246e55727569e [0,0,0,0,0,2|2,0,0]=4 2807 B13R1.337 CC(=O)CCOCc1ccncn1 cfc9f25faa06311d677297aa729e837b [0,0,0,0,0,2|1,0,1]=4 2808 B13R1.337 CC(=O)CCOCc1cnccn1 3320241e698646ad11a82ab2a10139f3 [0,0,0,0,0,2|1,0,1]=4 2809 B13R1.337 CC(=O)CCOCc1cncnc1 e35b1579d400dbf9b1afc3c71d28b06c [0,0,0,0,0,2|1,0,1]=4 2810 B13R1.337 CC(=O)CCOCc1ncccn1 a99b8c39da4d07dcb4fc3ef0d1db1259 [0,0,0,0,0,2|2,0,0]=4 2811 B13R1.337 CC(=O)CNCCc1ccccc1 a0e5ecc2a075f9e99967492b413c2b22 [0,0,0,0,0,2|2,0,0]=4 2812 B13R1.337 CC(=O)CNCCc1ccccn1 a441a020b240663c7bada837cc739b6a [0,0,0,0,0,2|1,0,0]=3 2813 B13R1.337 CC(=O)CNCCc1cccnc1 78534792801a932e3d94e2c0195dfa92 [0,0,0,0,0,2|1,0,0]=3 2814 B13R1.337 CC(=O)CNCCc1ccncc1 016eb4f86810d43551e9e67f08a73bb2 [0,0,0,0,0,2|1,0,1]=4 2815 B13R1.337 CC(=O)COCCc1ccccn1 41b627783cd849a02e5a5467d6e48c12 [0,0,0,0,0,2|2,0,0]=4 2816 B13R1.337 CC(=O)COCCc1cccnc1 2d6a672b950cf55d1c1e8182e5a11e7e [0,0,0,0,0,2|2,0,0]=4 2817 B13R1.337 CC(=O)NCCCc1ccccc1 4cae49b29a0d5e4aca63abcd8931e637 [0,0,0,0,0,2|2,0,0]=4 2818 B13R1.337 CC(=O)NCCCc1ccccn1 8030cfa265aedf8993932b4e2416dfc8 [0,0,0,0,0,2|1,0,0]=3 2819 B13R1.337 CC(=O)NCCCc1cccnc1 3bae424a78a6780dc7ec4fb1d07763d4 [0,0,0,0,0,2|1,0,0]=3 2820 B13R1.337 CC(=O)NCCCc1ccncc1 11be0e8d23a6b5dfcee2290e21576eff [0,0,0,0,0,2|1,0,1]=4 2821 B13R1.337 CC(=O)NCCNc1ccccc1 9fe3a3b17be53badb53fa3480b6904f5 [0,0,0,0,0,2|2,0,0]=4 2822 B13R1.337 CC(=O)NCCNc1ccccn1 3c7a6e625442c26642f9b476adfb1495 [0,0,0,0,0,2|1,0,0]=3 2823 B13R1.337 CC(=O)NCCNc1cccnc1 e22efd788e781455731fc51ac30c51b3 [0,0,0,0,0,2|1,0,0]=3 2824 B13R1.337 CC(=O)NCCNc1cccnn1 87ad04191ac85127f29cefb94c2f0ed7 [0,0,0,0,0,2|1,0,0]=3 2825 B13R1.337 CC(=O)NCCNc1ccncc1 e04993055096f69e4368927312ecab95 [0,0,0,0,0,2|1,0,1]=4 2826 B13R1.337 CC(=O)NCCNc1ccncn1 eb073421c3d79cfc6dc12de1a584309a [0,0,0,0,0,2|0,0,1]=3 2827 B13R1.337 CC(=O)NCCNc1ccnnc1 ee678491142470f4a99b6d4059cae451 [0,0,0,0,0,2|1,0,1]=4 2828 B13R1.337 CC(=O)NCCNc1cnccn1 c1accd147a9c7e4d89080fcd2ddbb94f [0,0,0,0,0,2|0,0,1]=3 2829 B13R1.337 CC(=O)NCCNc1cncnc1 5c533fe005408f05af2526ba1232b77d [0,0,0,0,0,2|0,0,1]=3 2830 B13R1.337 CC(=O)NCCNc1cncnn1 bf3175f3a25c3b7e11683341f9ee207c [0,0,0,0,0,2|0,0,1]=3 2831 B13R1.337 CC(=O)NCCNc1cnncn1 49968b0cd090f7127a8657402c8e3437 [0,0,0,0,0,2|0,0,1]=3 2832 B13R1.337 CC(=O)NCCNc1ncccn1 3f780d712d1eb794d4c047175fb86004 [0,0,0,0,0,2|1,0,0]=3 2833 B13R1.337 CC(=O)NCCNc1nccnn1 1c74aaef5c1f8b9dbb46d6a48a543cab [0,0,0,0,0,2|1,0,1]=4 2834 B13R1.337 CC(=O)NCCNc1ncncn1 866d4a5a9c4b80b35655929ebc141e80 [0,0,0,0,0,2|0,0,1]=3 2835 B13R1.337 CC(=O)NCCOc1ccccc1 2a851f694c8810e62a6bcd967df0637e [0,0,0,0,0,2|2,0,0]=4 2836 B13R1.337 CC(=O)NCCOc1ccccn1 12308e44d5c01510963b41941e29af8a [0,0,0,0,0,2|1,0,0]=3 2837 B13R1.337 CC(=O)NCCOc1cccnc1 6d1b9ef1c70d49dca3c07c74240aef4b [0,0,0,0,0,2|1,0,0]=3 2838 B13R1.337 CC(=O)NCCOc1ccncc1 ae9c120f6c292622ff954e7e84c7e123 [0,0,0,0,0,2|1,0,1]=4 2839 B13R1.337 CC(=O)NCCOc1ccnnc1 f28b2ed7b0a822987af56d4cfb56c42f [0,0,0,0,0,2|1,0,1]=4 2840 B13R1.337 CC(=O)NCCOc1cnccn1 96bb652ad960e092f1a86940028ea054 [0,0,0,0,0,2|0,0,1]=3 2841 B13R1.337 CC(=O)NCCOc1cncnc1 84972c7d0821f5bc17d6a7759979ece6 [0,0,0,0,0,2|0,0,1]=3 2842 B13R1.337 CC(=O)NCCOc1cncnn1 793573e3e6bf34522603b47e86308a2e [0,0,0,0,0,2|0,0,1]=3 2843 B13R1.337 CC(=O)NCCOc1ncccn1 ec5aa4b32daba759aed735db8e6e2067 [0,0,0,0,0,2|1,0,0]=3 2844 B13R1.337 CC(=O)NCOCc1ccccc1 1af0909d000886beedd618909e7c680f [0,0,0,0,0,2|2,0,0]=4 2845 B13R1.337 CC(=O)NCOCc1ccccn1 3eb6c8ef72b2de5db8d159544375d7fa [0,0,0,0,0,2|1,0,0]=3 2846 B13R1.337 CC(=O)NCOCc1cccnc1 3c6afe3f10d57231f793007404e276a5 [0,0,0,0,0,2|1,0,0]=3 2847 B13R1.337 CC(=O)NCOCc1cccnn1 22a31c3111ddcbbcd087a32538523bc0 [0,0,0,0,0,2|1,0,0]=3 2848 B13R1.337 CC(=O)NCOCc1ccncn1 1fb1e731a5445cf84574dad153ffced9 [0,0,0,0,0,2|0,0,1]=3 2849 B13R1.337 CC(=O)NCOCc1cncnc1 65fbeb0f3c22091951555b05486e14d1 [0,0,0,0,0,2|0,0,1]=3 2850 B13R1.337 CC(=O)NCOCc1ncccn1 f6941c54fe0846451eda8470dcf021bd [0,0,0,0,0,2|1,0,0]=3 2851 B13R1.337 CC(=O)OCCNc1ccccn1 36f9aaa066cbdc63edf5f85707ea3e7e [0,0,0,0,0,2|2,0,0]=4 2852 B13R1.337 CC(=O)OCCNc1cccnc1 5f4a0bb24d0c907e46e736ed5bc4516f [0,0,0,0,0,2|2,0,0]=4 2853 B13R1.337 CC(=O)OCCNc1cccnn1 195ba3f543438e86979686b3797710d9 [0,0,0,0,0,2|2,0,0]=4 2854 B13R1.337 CC(=O)OCCNc1ccncn1 3dff7add68762d659bea7510b9582b58 [0,0,0,0,0,2|1,0,1]=4 2855 B13R1.337 CC(=O)OCCNc1cnccn1 1ab17e3786a22c9cffa3cc639d190ef5 [0,0,0,0,0,2|1,0,1]=4 2856 B13R1.337 CC(=O)OCCNc1cncnc1 d5ccc3b386162fdf404fced6fae0a4d4 [0,0,0,0,0,2|1,0,1]=4 2857 B13R1.337 CC(=O)OCCNc1cnncn1 a1024a568cfbad56009910d3922d2b3a [0,0,0,0,0,2|1,0,1]=4 2858 B13R1.337 CC(=O)OCCNc1ncccn1 b93419324554458544b7a77cdf37e8d1 [0,0,0,0,0,2|2,0,0]=4 2859 B13R1.337 CC(=O)OCCNc1ncncn1 e9a2f821290cceb1e8594bf44b0191d9 [0,0,0,0,0,2|1,0,1]=4 2860 B13R1.337 CC(=O)OCCOc1ccccn1 27e7e62882cf9061dddd2eb5fd7ce7e4 [0,0,0,0,0,2|2,0,0]=4 2861 B13R1.337 CC(=O)OCCOc1cccnc1 35d60c306aca329f44d9af8ced8e1a1a [0,0,0,0,0,2|2,0,0]=4 2862 B13R1.337 CC(=O)OCCOc1cnccn1 df05b77a18d6630531cc1df7af1d0223 [0,0,0,0,0,2|1,0,1]=4 2863 B13R1.337 CC(=O)OCCOc1cncnc1 7c981c290d0690ff5b511c197f42daf5 [0,0,0,0,0,2|1,0,1]=4 2864 B13R1.337 CC(=O)OCCOc1cncnn1 1c32e6e3e36023f854e44d126e3261e6 [0,0,0,0,0,2|1,0,1]=4 2865 B13R1.337 CC(=O)OCCOc1ncccn1 1d9eae17535c10cb9519b57b63b3b6e3 [0,0,0,0,0,2|2,0,0]=4 2866 B13R1.337 CC(=O)OCNCc1ccccn1 dabb5163d1bee795543dd5fed2ec6d0a [0,0,0,0,0,2|2,0,0]=4 2867 B13R1.337 CC(=O)OCNCc1cccnc1 eb1d6947cc1b5459de7c5372a49a6e45 [0,0,0,0,0,2|2,0,0]=4 2868 B13R1.337 CC(=O)OCNCc1cccnn1 11d1f71e05af857519e0c71f8d3976ea [0,0,0,0,0,2|2,0,0]=4 2869 B13R1.337 CC(=O)OCNCc1ccncn1 64b7169b084a113fa64f7f1f9811c31a [0,0,0,0,0,2|1,0,1]=4 2870 B13R1.337 CC(=O)OCNCc1cnccn1 b66584699301af86ce65c3f872ff3ddc [0,0,0,0,0,2|1,0,1]=4 2871 B13R1.337 CC(=O)OCNCc1cncnc1 88de0a3b4a20b01f1720681e839207af [0,0,0,0,0,2|1,0,1]=4 2872 B13R1.337 CC(=O)OCNCc1ncccn1 e2d0cddc27b5b1378ffac6b39636f2ff [0,0,0,0,0,2|2,0,0]=4 2873 B13R1.337 CC(=O)OCOCc1ccccn1 f888943600b8a8b01e54a130579921cd [0,0,0,0,0,2|2,0,0]=4 2874 B13R1.337 CC(=O)OCOCc1cccnc1 e02d5412e3dc67d0ea07c3851105d55b [0,0,0,0,0,2|2,0,0]=4 2875 B13R1.337 CC(=O)OCOCc1cccnn1 be39418e0bd281f96496e752b0c9f99e [0,0,0,0,0,2|2,0,0]=4 2876 B13R1.337 CC(=O)OCOCc1ccncn1 e9e3d1e93303c97c6f553b300cfb46a4 [0,0,0,0,0,2|1,0,1]=4 2877 B13R1.337 CC(=O)OCOCc1cnccn1 c1fa8b6df1420541f17064a0d4f3d894 [0,0,0,0,0,2|1,0,1]=4 2878 B13R1.337 CC(=O)OCOCc1cncnc1 81352d7298d6822a5f4bb98649541b8d [0,0,0,0,0,2|1,0,1]=4 2879 B13R1.337 CC(=O)OCOCc1ncccn1 ba730e4a81a7a8d780a3c855f550bf96 [0,0,0,0,0,2|2,0,0]=4 2880 B13R1.337 CC(=O)SCCNc1ccccn1 ca81179c54819f28ac0c77959a0f256b [0,0,0,0,0,2|2,0,0]=4 2881 B13R1.337 CC(=O)SCCNc1cccnc1 5ce1b7dbca15c1bb4ba6af8e7587f841 [0,0,0,0,0,2|2,0,0]=4 2882 B13R1.337 CC(=O)SCCNc1cccnn1 bc334f94a8ce6550ed67847697820e73 [0,0,0,0,0,2|2,0,0]=4 2883 B13R1.337 CC(=O)SCCNc1ccncn1 6aaff1538eeff43b7d80f20735790b32 [0,0,0,0,0,2|1,0,1]=4 2884 B13R1.337 CC(=O)SCCNc1cnccn1 165611e8715cf2c97b73db025ebbe017 [0,0,0,0,0,2|1,0,1]=4 2885 B13R1.337 CC(=O)SCCNc1cncnc1 46bc47ecaecb9410511c588f98aac849 [0,0,0,0,0,2|1,0,1]=4 2886 B13R1.337 CC(=O)SCCNc1cnncn1 25f17b009ca3b6206d111c391c0f0998 [0,0,0,0,0,2|1,0,1]=4 2887 B13R1.337 CC(=O)SCCNc1ncccn1 1c50129f57b762babefacb1b85f54ee0 [0,0,0,0,0,2|2,0,0]=4 2888 B13R1.337 CC(=O)SCCNc1ncncn1 f41755697a3888971c65b9d143856ce6 [0,0,0,0,0,2|1,0,1]=4 2889 B13R1.337 CC(=O)SCCOc1ccccn1 00d0d41886e10476d9d344abd1e39b43 [0,0,0,0,0,2|2,0,0]=4 2890 B13R1.337 CC(=O)SCCOc1cccnc1 864aee88a66c9104f496567431d52385 [0,0,0,0,0,2|2,0,0]=4 2891 B13R1.337 CC(=O)SCCOc1cnccn1 5f96e20e955e1eeac119d323c6088d54 [0,0,0,0,0,2|1,0,1]=4 2892 B13R1.337 CC(=O)SCCOc1cncnc1 b3944518cc407a3c2a3e1ce991388311 [0,0,0,0,0,2|1,0,1]=4 2893 B13R1.337 CC(=O)SCCOc1cncnn1 6dbdae5a1de3727c898ccbf372a02dbe [0,0,0,0,0,2|1,0,1]=4 2894 B13R1.337 CC(=O)SCCOc1ncccn1 1e5a16ed4d6a5b7b4d164b5a1f58545b [0,0,0,0,0,2|2,0,0]=4 2895 B13R1.337 NC(=O)CNCCc1ccccn1 4af4b4271ac4cfbbf6df67583c5e09c3 [0,0,0,0,0,2|2,0,0]=4 2896 B13R1.337 NC(=O)CNCCc1cccnc1 79c029eaa7b96533f63d818adc8bec6f [0,0,0,0,0,2|2,0,0]=4 2897 B13R1.337 NC(=O)CNCCc1ccncn1 5306a694080b7a50ca0d9f3398269efc [0,0,0,0,0,2|1,0,1]=4 2898 B13R1.337 NC(=O)CNCCc1cnccn1 0f9c2c59621ebe0274da9d5b3f52f982 [0,0,0,0,0,2|1,0,1]=4 2899 B13R1.337 NC(=O)CNCCc1ncccn1 c60fc478e3a35ad103800572d3d2eb28 [0,0,0,0,0,2|2,0,0]=4 2900 B13R1.337 NC(=O)NCCNc1ccccn1 56b00f31aa1b622473424165dbdb2c5f [0,0,0,0,0,2|2,0,0]=4 2901 B13R1.337 NC(=O)NCCNc1cccnc1 246cafea3e13e67f0537b9d4a2e78cb8 [0,0,0,0,0,2|2,0,0]=4 2902 B13R1.337 NC(=O)NCCNc1cccnn1 aac2633a425faf7d77d89e27bc5a250f [0,0,0,0,0,2|2,0,0]=4 2903 B13R1.337 NC(=O)NCCNc1ccncn1 5a81ebefa62e63ad06b83c3d1a4c434f [0,0,0,0,0,2|1,0,1]=4 2904 B13R1.337 NC(=O)NCCNc1cnccn1 ad745f7c216591a860d32118f88a0fde [0,0,0,0,0,2|1,0,1]=4 2905 B13R1.337 NC(=O)NCCNc1cncnc1 c93b53fbd19bc9ba8ae9b7592ba47337 [0,0,0,0,0,2|1,0,1]=4 2906 B13R1.337 NC(=O)NCCNc1cnncn1 0055be8fd0b469c95f10531ce51c7535 [0,0,0,0,0,2|1,0,1]=4 2907 B13R1.337 NC(=O)NCCNc1ncccn1 e1ca498b22a6e7082450990f8c225e4d [0,0,0,0,0,2|2,0,0]=4 2908 B13R1.337 NC(=O)NCCNc1ncncn1 5c02bac783775553e94cd08ad368c7b1 [0,0,0,0,0,2|1,0,1]=4 2909 B13R1.337 NC(=O)NCCOc1ccccn1 55b226c9b4a5505ef3cfbdca3e7f345b [0,0,0,0,0,2|2,0,0]=4 2910 B13R1.337 NC(=O)NCCOc1cccnc1 b4a5f36f975e8c4da45148de8714658e [0,0,0,0,0,2|2,0,0]=4 2911 B13R1.337 NC(=O)NCCOc1cnccn1 0f757c153ca91154605d25f1c38288cc [0,0,0,0,0,2|1,0,1]=4 2912 B13R1.337 NC(=O)NCCOc1cncnc1 832f930570c6c7fa9b6da11fc9a5fd1b [0,0,0,0,0,2|1,0,1]=4 2913 B13R1.337 NC(=O)NCCOc1cncnn1 5bcb3912c3b97abb37588403ab636b98 [0,0,0,0,0,2|1,0,1]=4 2914 B13R1.337 NC(=O)NCCOc1ncccn1 bc9d2425f50b4a14b968d1aee4dcaf98 [0,0,0,0,0,2|2,0,0]=4 2915 B13R1.337 NC(=O)NCOCc1ccccn1 cd7b4ca8011e267bc2f123010ca7c760 [0,0,0,0,0,2|2,0,0]=4 2916 B13R1.337 NC(=O)NCOCc1cccnc1 0f857d6325b972ac0666ce2ee7341ed3 [0,0,0,0,0,2|2,0,0]=4 2917 B13R1.337 NC(=O)NCOCc1cccnn1 786f59f0d9b1cc8d46014113c9abe3ff [0,0,0,0,0,2|2,0,0]=4 2918 B13R1.337 NC(=O)NCOCc1ccncn1 8c873e062b6ef3d569eba6b7fed3903a [0,0,0,0,0,2|1,0,1]=4 2919 B13R1.337 NC(=O)NCOCc1cncnc1 53922184a9477f0b477ddd9d885ac652 [0,0,0,0,0,2|1,0,1]=4 2920 B13R1.337 NC(=O)NCOCc1ncccn1 61dd65eaa20a41ca5166b784b3aeec1a [0,0,0,0,0,2|2,0,0]=4 2921 B13R1.337 O=C(O)CNCCc1ccccn1 4888ff39cfb844c6fdaaa9b184121fa3 [0,0,0,0,0,2|2,0,0]=4 2922 B13R1.337 O=C(O)CNCCc1cccnc1 85f9915d15848c4684ad5b87bbf8053e [0,0,0,0,0,2|2,0,0]=4 2923 B13R1.337 O=C(O)CNCCc1ccncn1 5a08f94f966a47cd6f2a7ebe39633d1e [0,0,0,0,0,2|1,0,1]=4 2924 B13R1.337 O=C(O)CNCCc1cnccn1 75028e22692953481ee40be76592319c [0,0,0,0,0,2|1,0,1]=4 2925 B13R1.337 O=C(O)CNCCc1ncccn1 62bd525e43388d395c12c09a95cec5c5 [0,0,0,0,0,2|2,0,0]=4 2926 B13R1.343 C/C(=C/CNCCc1c[nH]cn1)/I eb5583c16a9c44935343649430e9b73a [0,0,0,0,0,2|1,0,0]=3 2927 B13R1.343 C/C(=C/CNCCc1cscn1)/I 2c157391997799ff8f8b2e86480501d7 [0,0,0,0,0,2|2,0,0]=4 2928 B13R1.343 C/C(=C/COCCc1c[nH]cn1)/Cl cc1d0bd3876c79ecbac5cd16664826b2 [0,0,0,0,0,2|2,0,0]=4 2929 B13R1.343 C/C(=C/COCCc1c[nH]cn1)/I 83a0aee41f483591dc9cabc993c02700 [0,0,0,0,0,2|2,0,0]=4 2930 B13R1.343 C/C(=C\CNCCc1c[nH]cn1)/Cl 8f4d17e26bb16137bcebdb4ae409a516 [0,0,0,0,0,2|1,0,0]=3 2931 B13R1.343 C/C(=C\CNCCc1cscn1)/Cl 73ff9e20b103299ce2f51bb33562a202 [0,0,0,0,0,2|2,0,0]=4 2932 B13R1.343 C/C(=C\COCCc1c[nH]cn1)/Cl 98577a8be13b159b7715de3295b83f67 [0,0,0,0,0,2|2,0,0]=4 2933 B13R1.343 C=C(Br)CNCCCc1c[nH]cn1 d89ec2d712bd07ce3ae7635116354eac [0,0,0,0,0,2|1,0,1]=4 2934 B13R1.343 C=C(C)CCNCCc1c[nH]cn1 8cd3f255b501779e60b4e965c2bc1570 [0,0,0,0,0,2|1,0,0]=3 2935 B13R1.343 C=C(C)CCNCCc1cscn1 e0cc5a357c827d6d6523c2371f08b105 [0,0,0,0,0,2|2,0,0]=4 2936 B13R1.343 C=C(C)CCOCCc1c[nH]cn1 23255203659c4271fc4dfe783f3af287 [0,0,0,0,0,2|2,0,0]=4 2937 B13R1.343 C=C(C)CNCCCc1c[nH]cn1 c08a0d281029b732d22d93a05e951d01 [0,0,0,0,0,2|1,0,0]=3 2938 B13R1.343 C=C(Cl)CNCCCc1c[nH]cn1 ae1ea0b6ea520fa62311126db7d1fff3 [0,0,0,0,0,2|1,0,1]=4 2939 B13R1.343 C=C(F)CNCCCc1c[nH]cn1 b611c858fdf373dbea551bec8d609c3d [0,0,0,0,0,2|1,0,1]=4 2940 B13R1.343 CC(=CCNCCc1c[nH]cn1)C d6ec84ade4d513d37993c2be466d1d55 [0,0,0,0,0,2|1,0,0]=3 2941 B13R1.343 CC(=CCNCCc1c[nH]cn1)Cl eecf84a233bca4d4ea8641ca781d1ed6 [0,0,0,0,0,2|1,0,0]=3 2942 B13R1.343 CC(=CCNCCc1c[nH]cn1)I 6eab19c4a3cdb3663b54859396d3e650 [0,0,0,0,0,2|1,0,0]=3 2943 B13R1.343 CC(=CCNCCc1cscn1)C 478c7f2148a5a85a6f761951d07dbdb6 [0,0,0,0,0,2|2,0,0]=4 2944 B13R1.343 CC(=CCNCCc1cscn1)Cl cb4a92b18624650b58aaf0e6d02f398c [0,0,0,0,0,2|2,0,0]=4 2945 B13R1.343 CC(=CCNCCc1cscn1)I 235a77d9d1ba1465dabe85e6d5af1595 [0,0,0,0,0,2|2,0,0]=4 2946 B13R1.343 CC(=CCOCCc1c[nH]cn1)C ea2bd9375d88b6cc425f49a312327063 [0,0,0,0,0,2|2,0,0]=4 2947 B13R1.343 CC(=CCOCCc1c[nH]cn1)Cl ac42227a935421470560f05a5fe0f5f9 [0,0,0,0,0,2|2,0,0]=4 2948 B13R1.343 CC(=CCOCCc1c[nH]cn1)I b848840c2e3d1ccbb77e923ab886b1a7 [0,0,0,0,0,2|2,0,0]=4 2949 B13R1.343 CC(=O)CCCCNc1cocn1 276f5b8299952a7e4bcee8e3e0bfbe10 [0,0,0,0,0,2|2,0,0]=4 2950 B13R1.343 CC(=O)CCCCNc1cscn1 e0437102dcbc0348b3126962b233b137 [0,0,0,0,0,2|2,0,0]=4 2951 B13R1.343 CC(=O)CCCCNc1nc[nH]n1 c851a28477c5846a06824228fa3a38bc [0,0,0,0,0,2|2,0,0]=4 2952 B13R1.343 CC(=O)CCCCOc1c[nH]cn1 007528043860f4d4ef58604f579194cc [0,0,0,0,0,2|1,0,0]=3 2953 B13R1.343 CC(=O)CCCNCc1c[nH]nn1 5f886b2dc33d3027e46f62fc19d739a3 [0,0,0,0,0,2|2,0,0]=4 2954 B13R1.343 CC(=O)CCCNCc1cc[nH]c1 aa030117a49f7b3997955a5d782d5565 [0,0,0,0,0,2|2,0,0]=4 2955 B13R1.343 CC(=O)CCCNCc1cocn1 bab8f2a77a6e2f959140d902f57c0562 [0,0,0,0,0,2|2,0,0]=4 2956 B13R1.343 CC(=O)CCCNCc1cscn1 c416735c65623f340a4a4ff3617969ff [0,0,0,0,0,2|2,0,0]=4 2957 B13R1.343 CC(=O)CCCOCc1cc[nH]c1 56e47f3c276b994ca501c5651b2180e1 [0,0,0,0,0,2|2,0,0]=4 2958 B13R1.343 CC(=O)CCCOCc1cocn1 82bcd2b12f04a43e1ac66b700276e20c [0,0,0,0,0,2|2,0,0]=4 2959 B13R1.343 CC(=O)CCCOCc1cscn1 3b7f698e6568a30d47654cf56f03df90 [0,0,0,0,0,2|2,0,0]=4 2960 B13R1.343 CC(=O)CCCOCc1nc[nH]n1 a2449a4ee8344a3885e463e6443576fb [0,0,0,0,0,2|2,0,0]=4 2961 B13R1.343 CC(=O)CCNCCc1c[nH]cn1 72a1b30733ee7c6d0d30fd1bc4ff45c9 [0,0,0,0,0,2|0,0,0]=2 2962 B13R1.343 CC(=O)CCNCCc1cc[nH]n1 3703e8051181ebdbb627bd06495b7c29 [0,0,0,0,0,2|2,0,0]=4 2963 B13R1.343 CC(=O)CCNCCc1ccc[nH]1 cd95a66c6e03bba7748e3ca19b4b33a7 [0,0,0,0,0,2|1,0,1]=4 2964 B13R1.343 CC(=O)CCNCCc1ccco1 06b1e1b056efcfdca5588a0c2d7e6e6c [0,0,0,0,0,2|2,0,0]=4 2965 B13R1.343 CC(=O)CCNCCc1cccs1 987fc6aa2f4ad9098ba51f58c859a9e5 [0,0,0,0,0,2|2,0,0]=4 2966 B13R1.343 CC(=O)CCNCCc1ccsc1 c2341d4c22348d012241bc1870833836 [0,0,0,0,0,2|2,0,0]=4 2967 B13R1.343 CC(=O)CCNCCc1cn[nH]c1 73adc0713200074e8dd316db79bd0fa1 [0,0,0,0,0,2|2,0,0]=4 2968 B13R1.343 CC(=O)CCNCCc1cscn1 2f36fa878671f82881bd154c846cd51c [0,0,0,0,0,2|1,0,0]=3 2969 B13R1.343 CC(=O)CCNCCc1ncc[nH]1 5b8213308dae3eddb82007e47d0cdd19 [0,0,0,0,0,2|2,0,0]=4 2970 B13R1.343 CC(=O)CCNCCc1nccs1 c6a1d2ced0dda8a0f849ec36f79cf0ed [0,0,0,0,0,2|2,0,0]=4 2971 B13R1.343 CC(=O)CCNCCn1cccn1 6a7e66ba5bbb92ae73c7976287fe9398 [0,0,0,0,0,2|2,0,0]=4 2972 B13R1.343 CC(=O)CCNCCn1cncn1 c4069f3ed7b46b9bf09cfc290c189e67 [0,0,0,0,0,2|1,0,1]=4 2973 B13R1.343 CC(=O)CCOCCc1c[nH]cn1 efabcbfafa9be945163885c470d7f33a [0,0,0,0,0,2|1,0,0]=3 2974 B13R1.343 CC(=O)CCOCCc1cscn1 c172e5ac729d0d6cd2242537e9b64289 [0,0,0,0,0,2|2,0,0]=4 2975 B13R1.343 CC(=O)CNCCCc1cccs1 1871fa192753f2f96c1e20618ad12f99 [0,0,0,0,0,2|2,0,0]=4 2976 B13R1.343 CC(=O)CNCCCc1ccsc1 861b9cd52993f8c182d25a39c9b3f426 [0,0,0,0,0,2|2,0,0]=4 2977 B13R1.343 CC(=O)CNCCCn1cccn1 57a85f1210df901ee9e1b28bf5043b4d [0,0,0,0,0,2|2,0,0]=4 2978 B13R1.343 CC(=O)NCCCNc1c[nH]cn1 70d96b61c0479a0c60e030c70bae0ef7 [0,0,0,0,0,2|0,0,0]=2 2979 B13R1.343 CC(=O)NCCCNc1c[nH]nn1 651ae9450f78fa50b53e7a2ed4e5e505 [0,0,0,0,0,2|1,0,0]=3 2980 B13R1.343 CC(=O)NCCCNc1cc[nH]n1 27150993df25134a0d539a1587074a92 [0,0,0,0,0,2|2,0,0]=4 2981 B13R1.343 CC(=O)NCCCNc1ccco1 32825132e1bf16e644b350c5e1d754b5 [0,0,0,0,0,2|2,0,0]=4 2982 B13R1.343 CC(=O)NCCCNc1cccs1 443c49936ed1f82aa658f685dd3791f5 [0,0,0,0,0,2|2,0,0]=4 2983 B13R1.343 CC(=O)NCCCNc1ccoc1 75e0704d9fa6470d294d5d3c0a58675c [0,0,0,0,0,2|2,0,0]=4 2984 B13R1.343 CC(=O)NCCCNc1ccon1 03f9a7724242abc0ef91535003c726ff [0,0,0,0,0,2|2,0,0]=4 2985 B13R1.343 CC(=O)NCCCNc1ccsc1 7ed2368f182fccae8a8d0c9a3bb3e40b [0,0,0,0,0,2|2,0,0]=4 2986 B13R1.343 CC(=O)NCCCNc1ccsn1 28db62301995023abbcd1bb9e03fb7f3 [0,0,0,0,0,2|2,0,0]=4 2987 B13R1.343 CC(=O)NCCCNc1cn[nH]c1 ee82234086be26b0645c2cb61ebe2a48 [0,0,0,0,0,2|2,0,0]=4 2988 B13R1.343 CC(=O)NCCCNc1cncs1 e965bc9dc00f803f399b15d62c0af098 [0,0,0,0,0,2|1,0,1]=4 2989 B13R1.343 CC(=O)NCCCNc1cnon1 2c98e80c7790ef1a9dd8a28acad4cf23 [0,0,0,0,0,2|1,0,1]=4 2990 B13R1.343 CC(=O)NCCCNc1cnsn1 bcf4f6cc37eb18edb1ebbd9b09006da4 [0,0,0,0,0,2|1,0,1]=4 2991 B13R1.343 CC(=O)NCCCNc1cocn1 ae53e6aa535f22cec4c56319bfdcf9a1 [0,0,0,0,0,2|1,0,0]=3 2992 B13R1.343 CC(=O)NCCCNc1cscn1 e2cfa480d3a5c920d5be08e7772ca346 [0,0,0,0,0,2|1,0,0]=3 2993 B13R1.343 CC(=O)NCCCNc1csnn1 c8dfb52a5ec90c28b5659d134b69cb90 [0,0,0,0,0,2|2,0,0]=4 2994 B13R1.343 CC(=O)NCCCNc1nc[nH]n1 af46d72ba6add946fbdf8fe766e5bff3 [0,0,0,0,0,2|1,0,0]=3 2995 B13R1.343 CC(=O)NCCCNc1ncc[nH]1 27411b66a56d1fad44663ed51174e35f [0,0,0,0,0,2|2,0,0]=4 2996 B13R1.343 CC(=O)NCCCNc1ncco1 7c6b26cc5cf60eb47ae84b00b2386450 [0,0,0,0,0,2|2,0,0]=4 2997 B13R1.343 CC(=O)NCCCNc1nccs1 8246f79620f348d9bc785a8eabfc7357 [0,0,0,0,0,2|2,0,0]=4 2998 B13R1.343 CC(=O)NCCCNc1ncns1 5fd450b1aa92f704adb2c1e70d5184ea [0,0,0,0,0,2|1,0,1]=4 2999 B13R1.343 CC(=O)NCCCNc1ncon1 7ea9abcd4b4b81ddf9a93ba12d642162 [0,0,0,0,0,2|2,0,0]=4 3000 B13R1.343 CC(=O)NCCCNc1ncsn1 07551e886c8dd52c6474d1a3774bc4bb [0,0,0,0,0,2|2,0,0]=4 3001 B13R1.343 CC(=O)NCCCNc1nn[nH]n1 8f321c29bfbb165a401ee69b0021a353 [0,0,0,0,0,2|2,0,0]=4 3002 B13R1.343 CC(=O)NCCCOc1c[nH]cn1 9f063127d17db6417f2f679ef6c045d9 [0,0,0,0,0,2|0,0,0]=2 3003 B13R1.343 CC(=O)NCCCOc1ccco1 ee655e1d1b91e60b2e47c177bc7674df [0,0,0,0,0,2|2,0,0]=4 3004 B13R1.343 CC(=O)NCCCOc1cccs1 a48e1198a2aa16df0d471b9333cbd7ef [0,0,0,0,0,2|2,0,0]=4 3005 B13R1.343 CC(=O)NCCCOc1ccsc1 c81fe00dedc60d798b76f4fc79773121 [0,0,0,0,0,2|2,0,0]=4 3006 B13R1.343 CC(=O)NCCCOc1cn[nH]c1 91388c7663339d5af699cd7d19446271 [0,0,0,0,0,2|2,0,0]=4 3007 B13R1.343 CC(=O)NCCCOc1cnsn1 24db1310556aee8311cf13f47856203f [0,0,0,0,0,2|1,0,1]=4 3008 B13R1.343 CC(=O)NCCCOc1nccs1 26d9df35b43f0b6de03efcb902f81c13 [0,0,0,0,0,2|2,0,0]=4 3009 B13R1.343 CC(=O)NCCCOn1cccn1 0f6ec0fdb73df4ee43363319321e45e7 [0,0,0,0,0,2|2,0,0]=4 3010 B13R1.343 CC(=O)NCCNCc1c[nH]nn1 8deb9abcd7d6382f6108d8ed9eefa335 [0,0,0,0,0,2|1,0,0]=3 3011 B13R1.343 CC(=O)NCCNCc1cc[nH]c1 978ccfced79da30b7886a96592e1c939 [0,0,0,0,0,2|1,0,0]=3 3012 B13R1.343 CC(=O)NCCNCc1ccc[nH]1 a8432ac9af25a444f36cdca575b6c0a7 [0,0,0,0,0,2|1,0,1]=4 3013 B13R1.343 CC(=O)NCCNCc1ccco1 e9ee6de4e5efa6b4f8a9da6c26381a74 [0,0,0,0,0,2|2,0,0]=4 3014 B13R1.343 CC(=O)NCCNCc1cccs1 1aa1ff595bad6f9713ef43e73c0f1842 [0,0,0,0,0,2|2,0,0]=4 3015 B13R1.343 CC(=O)NCCNCc1ccoc1 25242a7def9a23b0f144c23545c089a6 [0,0,0,0,0,2|2,0,0]=4 3016 B13R1.343 CC(=O)NCCNCc1ccon1 b158fe226e38cbb403980bb2e90ac519 [0,0,0,0,0,2|2,0,0]=4 3017 B13R1.343 CC(=O)NCCNCc1ccsc1 8a467dc26fcd9c7c98b03493a40fcb2e [0,0,0,0,0,2|2,0,0]=4 3018 B13R1.343 CC(=O)NCCNCc1ccsn1 54ae3c7022ef371950ea868b102b3ceb [0,0,0,0,0,2|2,0,0]=4 3019 B13R1.343 CC(=O)NCCNCc1cn[nH]c1 a03a5d87f483cb67766f94c3ff5e30ce [0,0,0,0,0,2|2,0,0]=4 3020 B13R1.343 CC(=O)NCCNCc1cnc[nH]1 5aea1824c3845a8af7b6ba01f94ac9e9 [0,0,0,0,0,2|0,0,2]=4 3021 B13R1.343 CC(=O)NCCNCc1cnco1 d19681a8085ac9d53b93bfe6a2fb83e0 [0,0,0,0,0,2|1,0,1]=4 3022 B13R1.343 CC(=O)NCCNCc1cncs1 7c4e1c76f0fe7d657fce1215cd6e94d2 [0,0,0,0,0,2|1,0,1]=4 3023 B13R1.343 CC(=O)NCCNCc1cocn1 7983044e7c48d8514417ec4629d1fa24 [0,0,0,0,0,2|1,0,0]=3 3024 B13R1.343 CC(=O)NCCNCc1cscn1 04c3e87f8699dfec814abd9adbbfa246 [0,0,0,0,0,2|1,0,0]=3 3025 B13R1.343 CC(=O)NCCNCc1ncc[nH]1 f2f5d47a638b4f2179481ef97c6a31db [0,0,0,0,0,2|2,0,0]=4 3026 B13R1.343 CC(=O)NCCNCc1ncco1 2389399b6ffda005a0fc3d8bf07a6793 [0,0,0,0,0,2|2,0,0]=4 3027 B13R1.343 CC(=O)NCCNCc1nccs1 83c753c28cb9576e735a60d6e3aec146 [0,0,0,0,0,2|2,0,0]=4 3028 B13R1.343 CC(=O)NCCNCc1ncn[nH]1 13edcd8580fe6c11e59ceb4204954f8a [0,0,0,0,0,2|1,0,1]=4 3029 B13R1.343 CC(=O)NCCNCc1ncno1 3f76088024f1cb86b6120f4774ab783a [0,0,0,0,0,2|1,0,1]=4 3030 B13R1.343 CC(=O)NCCNCc1ncon1 c044d6ff2b2a6958df25bde6845c0b75 [0,0,0,0,0,2|2,0,0]=4 3031 B13R1.343 CC(=O)NCCNCn1cncn1 a4471a33926452c66ca44ecd48fcc02e [0,0,0,0,0,2|1,0,1]=4 3032 B13R1.343 CC(=O)NCCOCc1cc[nH]c1 41d966552a08db9be302381b5c2dd760 [0,0,0,0,0,2|1,0,0]=3 3033 B13R1.343 CC(=O)NCCOCc1ccc[nH]1 22d7e94f457960db3c458299182d4852 [0,0,0,0,0,2|1,0,1]=4 3034 B13R1.343 CC(=O)NCCOCc1ccco1 a563b44e09ad596cecf06de1f9173a8c [0,0,0,0,0,2|2,0,0]=4 3035 B13R1.343 CC(=O)NCCOCc1cccs1 0fc2ed3282dd84e91b3b4f5c5a19dfff [0,0,0,0,0,2|2,0,0]=4 3036 B13R1.343 CC(=O)NCCOCc1ccoc1 fe578b07c6cfe695879cc8f94f02f972 [0,0,0,0,0,2|2,0,0]=4 3037 B13R1.343 CC(=O)NCCOCc1ccon1 3f995ed53ce24ae0b400bb24ea4f3c96 [0,0,0,0,0,2|2,0,0]=4 3038 B13R1.343 CC(=O)NCCOCc1ccsc1 496b34c8a086ce1d90e8f62bdc6a22f7 [0,0,0,0,0,2|2,0,0]=4 3039 B13R1.343 CC(=O)NCCOCc1ccsn1 09896647d5329f4be779de9b30001cdb [0,0,0,0,0,2|2,0,0]=4 3040 B13R1.343 CC(=O)NCCOCc1cn[nH]c1 d10b6b33adf40201466dc517b9b42862 [0,0,0,0,0,2|2,0,0]=4 3041 B13R1.343 CC(=O)NCCOCc1cnc[nH]1 7be754965ae8f6ce8ff6d2d308aba257 [0,0,0,0,0,2|0,0,2]=4 3042 B13R1.343 CC(=O)NCCOCc1cnco1 cf52e0fa12f3b5d872b50de6e9050071 [0,0,0,0,0,2|1,0,1]=4 3043 B13R1.343 CC(=O)NCCOCc1cncs1 7a924c7bbe900cdcbfd0e80a239c4026 [0,0,0,0,0,2|1,0,1]=4 3044 B13R1.343 CC(=O)NCCOCc1cnsn1 b184bd18ef5ed2c05a2ef741cbb2189e [0,0,0,0,0,2|1,0,1]=4 3045 B13R1.343 CC(=O)NCCOCc1cocn1 395de8796853ad5eee960e9d9826f1eb [0,0,0,0,0,2|1,0,0]=3 3046 B13R1.343 CC(=O)NCCOCc1cscn1 3d5229ec3de198888e9999881f53c547 [0,0,0,0,0,2|1,0,0]=3 3047 B13R1.343 CC(=O)NCCOCc1csnn1 5205d275014683c2c21aae30ea3585c7 [0,0,0,0,0,2|2,0,0]=4 3048 B13R1.343 CC(=O)NCCOCc1nc[nH]n1 9de86fc2e26cbbf42ab58dcfe72c43bc [0,0,0,0,0,2|1,0,0]=3 3049 B13R1.343 CC(=O)NCCOCc1ncc[nH]1 7f793e6272d6138fdf09d517771b1a37 [0,0,0,0,0,2|2,0,0]=4 3050 B13R1.343 CC(=O)NCCOCc1ncco1 31f99d69ac36b2dd518aab508bcf1818 [0,0,0,0,0,2|2,0,0]=4 3051 B13R1.343 CC(=O)NCCOCc1nccs1 25f88a4b78e98d497fd35589ddaa7a06 [0,0,0,0,0,2|2,0,0]=4 3052 B13R1.343 CC(=O)NCCOCc1ncno1 018756bb4b3ebce07a0dc22e80cef9e1 [0,0,0,0,0,2|1,0,1]=4 3053 B13R1.343 CC(=O)NCCOCc1ncns1 b6833854b7771d5a412d0878ac246c00 [0,0,0,0,0,2|1,0,1]=4 3054 B13R1.343 CC(=O)NCCOCc1ncon1 dabe2d9a54770ed6df8cf35b882b88bc [0,0,0,0,0,2|2,0,0]=4 3055 B13R1.343 CC(=O)NCCOCc1nn[nH]n1 ed6ffe7673d0dbd7823bd49379dbac7a [0,0,0,0,0,2|2,0,0]=4 3056 B13R1.343 CC(=O)NCCOCn1cccn1 e8c2b1a6fe11e27eb4918d10e03df19a [0,0,0,0,0,2|2,0,0]=4 3057 B13R1.343 CC(=O)NCCOCn1cncn1 2f840374f816075ebaeded1091344b3a [0,0,0,0,0,2|1,0,1]=4 3058 B13R1.343 CC(=O)NCCSCc1ccco1 038c2003f2251c862a950a466ea50e67 [0,0,0,0,0,2|2,0,0]=4 3059 B13R1.343 CC(=O)NCOCCc1c[nH]cn1 21de8442e7ca7ed7235e3bb54140c323 [0,0,0,0,0,2|0,0,0]=2 3060 B13R1.343 CC(=O)NCOCCc1cccs1 13b7053912fe1d062abeebabd22774c6 [0,0,0,0,0,2|2,0,0]=4 3061 B13R1.343 CC(=O)NCOCCc1ccsc1 bc3c81c1ed051808d9bf827024798137 [0,0,0,0,0,2|2,0,0]=4 3062 B13R1.343 CC(=O)NCOCCc1cn[nH]c1 6849b705285644df80795b499029887b [0,0,0,0,0,2|2,0,0]=4 3063 B13R1.343 CC(=O)NCOCCc1cscn1 d089b080db856b0e2b62edcf3c457dbd [0,0,0,0,0,2|1,0,0]=3 3064 B13R1.343 CC(=O)NCOCCc1ncon1 4cd7a513d386e700d51112be6eb3fc88 [0,0,0,0,0,2|2,0,0]=4 3065 B13R1.343 CC(=O)NCOCCn1cccn1 f304c5ebeecc65c7be5ffc08f7133597 [0,0,0,0,0,2|2,0,0]=4 3066 B13R1.343 CC(=O)NCOCCn1cncn1 56d04e15afb697789faa47c079c31805 [0,0,0,0,0,2|1,0,1]=4 3067 B13R1.343 CC(=O)OCCCNc1cocn1 9a33e2c543b2282d5a57445c8e26fed4 [0,0,0,0,0,2|2,0,0]=4 3068 B13R1.343 CC(=O)OCCCNc1cscn1 a77f06a899f15798f926edec7a9e461b [0,0,0,0,0,2|2,0,0]=4 3069 B13R1.343 CC(=O)OCCCNc1nc[nH]n1 a7b77f265db8c6d33617794ce76a27ff [0,0,0,0,0,2|2,0,0]=4 3070 B13R1.343 CC(=O)OCCCOc1c[nH]cn1 32f5771e5a944385b6e593cbc58a1dae [0,0,0,0,0,2|1,0,0]=3 3071 B13R1.343 CC(=O)OCCNCc1c[nH]nn1 3e6f22b8c5a074bd8ea5ff4d4581254e [0,0,0,0,0,2|2,0,0]=4 3072 B13R1.343 CC(=O)OCCNCc1cc[nH]c1 0be3add63f6dc000dd46068e2a1cf577 [0,0,0,0,0,2|2,0,0]=4 3073 B13R1.343 CC(=O)OCCNCc1cocn1 64e6fff50357af635942f5e50171b9b2 [0,0,0,0,0,2|2,0,0]=4 3074 B13R1.343 CC(=O)OCCNCc1cscn1 f08c416fb5192a489d44b8ad7ae5062f [0,0,0,0,0,2|2,0,0]=4 3075 B13R1.343 CC(=O)OCCOCc1cc[nH]c1 162701099e6ba9ca6554fefaf7a5eb6e [0,0,0,0,0,2|2,0,0]=4 3076 B13R1.343 CC(=O)OCCOCc1cocn1 99729b1a8804d43e0bb8336c4b8d2b80 [0,0,0,0,0,2|2,0,0]=4 3077 B13R1.343 CC(=O)OCCOCc1cscn1 cfa28958f338913febde9b6e40302a40 [0,0,0,0,0,2|2,0,0]=4 3078 B13R1.343 CC(=O)OCCOCc1nc[nH]n1 7abcc58c22bcdefbef07702b3193572a [0,0,0,0,0,2|2,0,0]=4 3079 B13R1.343 CC(=O)OCNCCc1c[nH]cn1 4a208c4d8809024f7185186e116aaba2 [0,0,0,0,0,2|0,0,0]=2 3080 B13R1.343 CC(=O)OCNCCc1cc[nH]n1 d5daef829712600f3d5dead7cfb2e9b4 [0,0,0,0,0,2|2,0,0]=4 3081 B13R1.343 CC(=O)OCNCCc1ccc[nH]1 fac2fb9011840d70603c232cc3071c5a [0,0,0,0,0,2|1,0,1]=4 3082 B13R1.343 CC(=O)OCNCCc1ccco1 9e77efdf9ab8f718aab4027ae39c8b51 [0,0,0,0,0,2|2,0,0]=4 3083 B13R1.343 CC(=O)OCNCCc1cccs1 c1472721b69835a7eb4af90dfa7eddef [0,0,0,0,0,2|2,0,0]=4 3084 B13R1.343 CC(=O)OCNCCc1ccsc1 7f546567e88c240a5d73676c02db682d [0,0,0,0,0,2|2,0,0]=4 3085 B13R1.343 CC(=O)OCNCCc1cn[nH]c1 3d0c4666645b39f53ab904722d4fcd0a [0,0,0,0,0,2|2,0,0]=4 3086 B13R1.343 CC(=O)OCNCCc1cscn1 255ea3e1688bf8c394768c48987c3927 [0,0,0,0,0,2|1,0,0]=3 3087 B13R1.343 CC(=O)OCNCCc1ncc[nH]1 3eba47deb3e285d86301ccca987076f8 [0,0,0,0,0,2|2,0,0]=4 3088 B13R1.343 CC(=O)OCNCCc1nccs1 9bd6d95f4bca68cebbc1963e0afa4eea [0,0,0,0,0,2|2,0,0]=4 3089 B13R1.343 CC(=O)OCNCCn1cccn1 1eb5bdd2c5a1105249febe8594178f77 [0,0,0,0,0,2|2,0,0]=4 3090 B13R1.343 CC(=O)OCNCCn1cncn1 b10383193933a7b849f8f74a86b3406f [0,0,0,0,0,2|1,0,1]=4 3091 B13R1.343 CC(=O)OCOCCc1c[nH]cn1 4dfa97cd8c14e10ce919fdd552c862a0 [0,0,0,0,0,2|1,0,0]=3 3092 B13R1.343 CC(=O)OCOCCc1cscn1 f4556b347992a448ce4cb02de7bc8ae4 [0,0,0,0,0,2|2,0,0]=4 3093 B13R1.343 CC(=O)SCCCNc1cocn1 31ffc8955b93087c0f56e1a81b40b64d [0,0,0,0,0,2|2,0,0]=4 3094 B13R1.343 CC(=O)SCCCNc1cscn1 b053a7de44acd434223189424e46b199 [0,0,0,0,0,2|2,0,0]=4 3095 B13R1.343 CC(=O)SCCCNc1nc[nH]n1 0d2350d5cf6ce7c2a7b2bafc3b6f5b59 [0,0,0,0,0,2|2,0,0]=4 3096 B13R1.343 CC(=O)SCCCOc1c[nH]cn1 b763318ba69ff69e4b37bf4b46e3ec0e [0,0,0,0,0,2|1,0,0]=3 3097 B13R1.343 CC(=O)SCCNCc1c[nH]nn1 ea51c48cd7a393e25497c4610e93aa8a [0,0,0,0,0,2|2,0,0]=4 3098 B13R1.343 CC(=O)SCCNCc1cc[nH]c1 ba083b462e2cb42deac4c8cb1a05e504 [0,0,0,0,0,2|2,0,0]=4 3099 B13R1.343 CC(=O)SCCNCc1cocn1 56f8e98db916e075eca0953a69394a77 [0,0,0,0,0,2|2,0,0]=4 3100 B13R1.343 CC(=O)SCCNCc1cscn1 15ce24ff909b5907480b7312b43145ba [0,0,0,0,0,2|2,0,0]=4 3101 B13R1.343 CC(=O)SCCOCc1cc[nH]c1 754ac3098d669e50202796a28c839d92 [0,0,0,0,0,2|2,0,0]=4 3102 B13R1.343 CC(=O)SCCOCc1cocn1 9190fa35084c7417ca2856150a5b0dbb [0,0,0,0,0,2|2,0,0]=4 3103 B13R1.343 CC(=O)SCCOCc1cscn1 188ba127ec37c15789892ac66aad30c6 [0,0,0,0,0,2|2,0,0]=4 3104 B13R1.343 CC(=O)SCCOCc1nc[nH]n1 dc7feb9d2212834d28bbcc85e6866ae5 [0,0,0,0,0,2|2,0,0]=4 3105 B13R1.343 CC(=S)OCCCOc1c[nH]cn1 09b945cd1c1b06e65d347dbcba3d2f5a [0,0,0,0,0,2|1,1,0]=4 3106 B13R1.343 CC(C)CCNCCc1c[nH]cn1 1dba52a2e6e3c23b97263a5da9af6c53 [0,0,0,0,0,2|1,0,1]=4 3107 B13R1.343 CC(C)CNCCCc1c[nH]cn1 40f85ee3f2d4cff25fa313d6825f2d34 [0,0,0,0,0,2|1,0,1]=4 3108 B13R1.343 CC(C)OCNCCc1c[nH]cn1 996c1819267be3014467d21f0575e279 [0,0,0,0,0,2|1,0,1]=4 3109 B13R1.343 CC(O)CCNCCc1c[nH]cn1 d593b0c67490801efca2218123b5fa11 [0,0,0,0,0,2|0,0,2]=4 3110 B13R1.343 CC(O)CNCCCc1c[nH]cn1 1a91c4433c63a2423f79f956adad00e9 [0,0,0,0,0,2|0,0,2]=4 3111 B13R1.343 CN(C)CCNCCc1c[nH]cn1 cf52b5e8d63672aaa93dcda409fcd671 [0,0,0,0,0,2|2,0,0]=4 3112 B13R1.343 CN(C)CNCCCc1c[nH]cn1 9091f58e7eeb6fce6ab004f66aea5fba [0,0,0,0,0,2|2,0,0]=4 3113 B13R1.343 CS(=O)CCNCCc1c[nH]cn1 f7cc5c2e35833440ee00e9f68243907d [0,0,0,0,0,2|1,0,0]=3 3114 B13R1.343 CS(=O)CCNCCc1cscn1 e63223246160510ea022b3aab1bd2303 [0,0,0,0,0,2|2,0,0]=4 3115 B13R1.343 CS(=O)CCOCCc1c[nH]cn1 fcfe60e7d2dff2480b98e2bfe4f50f9a [0,0,0,0,0,2|2,0,0]=4 3116 B13R1.343 C[C@@H](O)CCNCCc1c[nH]cn1 df0aa9b4430b6aae11c608f4d8494c97 [0,0,0,0,0,2|0,0,2]=4 3117 B13R1.343 C[C@@H](O)CNCCCc1c[nH]cn1 a95885dbe2fe0fc93133c0b5f2d832b1 [0,0,0,0,0,2|0,0,2]=4 3118 B13R1.343 C[C@H](O)CCNCCc1c[nH]cn1 7eb0c8e4c399ee82e23cc5eee5264ae5 [0,0,0,0,0,2|0,0,2]=4 3119 B13R1.343 C[C@H](O)CNCCCc1c[nH]cn1 ec763ecb775578087262868900ae019b [0,0,0,0,0,2|0,0,2]=4 3120 B13R1.343 ClC(=CCNCCc1c[nH]cn1)Cl 05e6fed4316ebb4e854bb0cdd5024f2c [0,0,0,0,0,2|2,0,0]=4 3121 B13R1.343 NC(=O)CCCCNc1c[nH]cn1 54012404db1bfaf15fdd36fd6b8bdf3b [0,0,0,0,0,2|2,0,0]=4 3122 B13R1.343 NC(=O)CCCCOc1c[nH]cn1 83c40c84101e88b0229589775bba0b0c [0,0,0,0,0,2|2,0,0]=4 3123 B13R1.343 NC(=O)CCNCCc1c[nH]cn1 ed9baf9abf7c6515f28292282e162aaa [0,0,0,0,0,2|1,0,0]=3 3124 B13R1.343 NC(=O)CCNCCc1cscn1 46bc18150176ca41c8017223a432f0c3 [0,0,0,0,0,2|2,0,0]=4 3125 B13R1.343 NC(=O)CCOCCc1c[nH]cn1 993d6d4e8600ba5232baf020bab7d4e5 [0,0,0,0,0,2|2,0,0]=4 3126 B13R1.343 NC(=O)CNCCCc1c[nH]cn1 0471b748076b1e8fbefc53e175b12c5a [0,0,0,0,0,2|1,0,0]=3 3127 B13R1.343 NC(=O)COCCOc1c[nH]cn1 23b201c233db35c31c84ed40061769aa [0,0,0,0,0,2|2,0,0]=4 3128 B13R1.343 NC(=O)NCCNCc1c[nH]nn1 d012eb974324820d8650e56332219ce5 [0,0,0,0,0,2|2,0,0]=4 3129 B13R1.343 NC(=O)NCCNCc1cc[nH]c1 57e42958c4742dd4f925d6eafbac53e5 [0,0,0,0,0,2|2,0,0]=4 3130 B13R1.343 NC(=O)NCCNCc1cocn1 4b43f2116868a85a45462f67c491048e [0,0,0,0,0,2|2,0,0]=4 3131 B13R1.343 NC(=O)NCCNCc1cscn1 49ec7cd04d3d6307c7e1b202e7f539c5 [0,0,0,0,0,2|2,0,0]=4 3132 B13R1.343 NC(=O)NCCOCc1cc[nH]c1 01451288c1f98fe0ff865988087d0e3b [0,0,0,0,0,2|2,0,0]=4 3133 B13R1.343 NC(=O)NCCOCc1cocn1 b4ebfc5000b6c2e30fdce22d392e12b6 [0,0,0,0,0,2|2,0,0]=4 3134 B13R1.343 NC(=O)NCCOCc1cscn1 a51f838a729f19e4ecee2f07a2d8bb37 [0,0,0,0,0,2|2,0,0]=4 3135 B13R1.343 NC(=O)NCCOCc1nc[nH]n1 51ed22912252d8e746f9fa3250d3ddc3 [0,0,0,0,0,2|2,0,0]=4 3136 B13R1.343 NC(=O)NCOCCc1c[nH]cn1 07e5fecfb4ce8207428f12c933b0c711 [0,0,0,0,0,2|1,0,0]=3 3137 B13R1.343 NC(=O)NCOCCc1cscn1 a6534b89171c0ecabc04b357e39486e7 [0,0,0,0,0,2|2,0,0]=4 3138 B13R1.343 NC(=O)SCNCCc1c[nH]cn1 e3d4445232acaab81e969908668e719e [0,0,0,0,0,2|1,0,0]=3 3139 B13R1.343 NC(=O)SCNCCc1cscn1 d04db2ba0854cd112e66ccf43892d7e4 [0,0,0,0,0,2|2,0,0]=4 3140 B13R1.343 NC(=O)SCOCCc1c[nH]cn1 8e5abacbd3e6bd1d632e1e9facb2f8b9 [0,0,0,0,0,2|2,0,0]=4 3141 B13R1.343 NC(=S)CCNCCc1c[nH]cn1 7a0644bdd9a2d1bd87b3c319c80941f6 [0,0,0,0,0,2|1,1,0]=4 3142 B13R1.343 O=C(O)CCCCNc1c[nH]cn1 1f371c78992ef3d58945975ff85c0d51 [0,0,0,0,0,2|2,0,0]=4 3143 B13R1.343 O=C(O)CCCCOc1c[nH]cn1 a2957227358b24708d7e8dedd7982457 [0,0,0,0,0,2|2,0,0]=4 3144 B13R1.343 O=C(O)CCNCCc1c[nH]cn1 f08817964cbee4d9cdde1c56134e0240 [0,0,0,0,0,2|1,0,0]=3 3145 B13R1.343 O=C(O)CCNCCc1cscn1 cb227eba32e7ac3843a4e31ea5e89616 [0,0,0,0,0,2|2,0,0]=4 3146 B13R1.343 O=C(O)CCOCCc1c[nH]cn1 f3906a3d8c85ebe1e38cb3aeb6008d25 [0,0,0,0,0,2|2,0,0]=4 3147 B13R1.343 O=C(O)CNCCCc1c[nH]cn1 40c140ab57c399fa20eb3ddb6d541f84 [0,0,0,0,0,2|1,0,0]=3 3148 B13R1.343 O=C(O)COCCNc1c[nH]cn1 5559b43b1af608dafa0a442ff8b67240 [0,0,0,0,0,2|2,0,0]=4 3149 B13R1.343 O=C(O)COCCOc1c[nH]cn1 ec99a18ecf3c7ae621c1bf2481859959 [0,0,0,0,0,2|2,0,0]=4 3150 B13R1.343 O=S(O)CCNCCc1c[nH]cn1 a43edb336efd8014a6489035ca1548c9 [0,0,0,0,0,2|2,0,0]=4 3151 B13R1.343 O=[N+]([O-])CNCCCc1c[nH]cn1 ebc6f920ba039266c3b7a47f26bbe6be [0,0,0,0,0,2|2,0,0]=4