0 B15R1.138 C#CCCCCNC(=O)c1ccccc1 838fbaf71970fb979b72898868e73730 [0,0,0,0,0,0|1,0,2]=3 1 B15R1.138 C#CCCCCNC(=O)c1ccccn1 2d897301b20ae4be136cca251513aa59 [0,0,0,0,0,0|2,0,2]=4 2 B15R1.138 C#CCCCCNC(=O)c1cccnc1 b940d20febd6b6b30c15a0555c1f8a16 [0,0,0,0,0,0|2,0,2]=4 3 B15R1.138 C#CCCCCNC(=O)c1ccncc1 fffa76c019eeed84af8ec68e18c23e50 [0,0,0,0,0,0|2,0,2]=4 4 B15R1.138 C#CCCCCOC(C)c1ccccc1 a00d305d7ecc4c8259273dec52f3e5b0 [0,0,0,0,0,0|1,0,3]=4 5 B15R1.138 C#CCCCCO[C@@H](C)c1ccccc1 77368328797522d11a12310fd485aad2 [0,0,0,0,0,0|1,0,3]=4 6 B15R1.138 C#CCCCCO[C@H](C)c1ccccc1 5409869df320ab5112772a4f59049a6d [0,0,0,0,0,0|1,0,3]=4 7 B15R1.138 C#CCCCNCC(=O)c1ccccc1 ad42e01d6ebdcce2f1d47a1f0ff3578d [0,0,0,0,0,0|2,0,2]=4 8 B15R1.138 C#CCCCOCC(=O)c1ccccc1 adbac5ef7689a2be16f4ee15c982e50c [0,0,0,0,0,0|2,0,2]=4 9 B15R1.138 C#CCCNCOC(=O)c1ccccc1 4835b621cee42a6a4f6045cf64562e9f [0,0,0,0,0,0|1,0,2]=3 10 B15R1.138 C#CCCOCCC(=O)c1ccccc1 94f5812268cd989688266e427ab2352f [0,0,0,0,0,0|2,0,2]=4 11 B15R1.138 C#CCCOCNC(=O)c1ccccc1 4d621b668034788bc47fc4ee62b40974 [0,0,0,0,0,0|2,0,2]=4 12 B15R1.138 C#CCCOCOC(=O)c1ccccc1 a849ab8d6ece1b095b149b83f1d9ba73 [0,0,0,0,0,0|1,0,2]=3 13 B15R1.138 C#CCNCCNC(=O)c1ccccc1 9ca0803d72231aba07bb53e9065af662 [0,0,0,0,0,0|2,0,2]=4 14 B15R1.138 C#CCNCCOC(=O)c1ccccc1 ce1f405fd38562fa5075bd34b8382fa7 [0,0,0,0,0,0|1,0,2]=3 15 B15R1.138 C#CCOCCCC(=O)c1ccccc1 fb03ba226a93e71e0c6adc294f0e8020 [0,0,0,0,0,0|2,0,2]=4 16 B15R1.138 C#CCOCCNC(=O)c1ccccc1 d6b8b350f01d1e3b568308f198edf6e0 [0,0,0,0,0,0|2,0,2]=4 17 B15R1.138 C#CCOCCOC(=O)c1ccccc1 892e08a4e4735cd036d13ca95e7cada9 [0,0,0,0,0,0|1,0,2]=3 18 B15R1.138 C#CCOCCOC(=O)c1cccnc1 b5cd98d96314f3e20d7cc9a40f4a038c [0,0,0,0,0,0|2,0,2]=4 19 B15R1.138 C/C=C/CCCOC(C)c1ccccc1 e1cb17b51d95c1bbd46f45bef29313e1 [0,0,0,0,0,0|1,0,3]=4 20 B15R1.138 C/C=C/CCCO[C@@H](C)c1ccccc1 6ce9a7635a05dc8b073abf2216dda08b [0,0,0,0,0,0|1,0,3]=4 21 B15R1.138 C/C=C/CCCO[C@H](C)c1ccccc1 b4bcaecb0c1a948fff07cc9353bd91ea [0,0,0,0,0,0|1,0,3]=4 22 B15R1.138 C/C=C/CCOCC(=O)c1ccccc1 7b46395e2034568ee407e2f3e5ec8c0f [0,0,0,0,0,0|2,0,2]=4 23 B15R1.138 C/C=C/COCCC(=O)c1ccccc1 bf2685df4c8afc15f23bda94b4adec2c [0,0,0,0,0,0|2,0,2]=4 24 B15R1.138 C/C=C/COCNC(=O)c1ccccc1 4eb53ef5ccb227329e8d46ca166c7ff8 [0,0,0,0,0,0|2,0,2]=4 25 B15R1.138 C/C=C/COCOC(=O)c1ccccc1 431308a6d4c8b7fe16e096b7429e0de9 [0,0,0,0,0,0|1,0,2]=3 26 B15R1.138 C/C=C\CCCOC(C)c1ccccc1 a457accff9186084e6624ec21108ef09 [0,0,0,0,0,0|1,0,3]=4 27 B15R1.138 C/C=C\CCCO[C@@H](C)c1ccccc1 a43480f6448f2f6bd230ac924a8ddcde [0,0,0,0,0,0|1,0,3]=4 28 B15R1.138 C/C=C\CCCO[C@H](C)c1ccccc1 37dcd759b20add7ad835610457e7388d [0,0,0,0,0,0|1,0,3]=4 29 B15R1.138 C/C=C\COCCC(=O)c1ccccc1 6ac99ae5f39358c7065fce671f181f39 [0,0,0,0,0,0|2,0,2]=4 30 B15R1.138 C/C=C\COCNC(=O)c1ccccc1 120d1ff87513c80802024ab4fc6102eb [0,0,0,0,0,0|2,0,2]=4 31 B15R1.138 C/C=C\COCOC(=O)c1ccccc1 9c49b7b4bef7fff060ac38b351bd093d [0,0,0,0,0,0|1,0,2]=3 32 B15R1.138 C=C(CCOCCCC)c1ccncc1 00c16811e0b6bfdc9497e29cedab2c4e [0,0,0,0,0,0|4,0,0]=4 33 B15R1.138 C=C(CNCCCCCl)c1ccccc1 47f5cefe3b4ff49b07e50c87d3dce2e6 [0,0,0,0,0,0|4,0,0]=4 34 B15R1.138 C=C(CNCCCCO)c1ccccc1 8076d2eeebaff3e4db800885171eca62 [0,0,0,0,0,0|4,0,0]=4 35 B15R1.138 C=C(CNCCCSC)c1ccccc1 6d7266aa7db8c2438f17b64ed1780d0c [0,0,0,0,0,0|4,0,0]=4 36 B15R1.138 C=C(COCCCCC)c1ccccc1 49434f0260471245d91fb88398c2c1d5 [0,0,0,0,0,0|3,0,0]=3 37 B15R1.138 C=C(COCCCCC)c1ccccn1 571e042840a190b463862f9aceb7b06c [0,0,0,0,0,0|4,0,0]=4 38 B15R1.138 C=C(COCCCCF)c1ccccc1 e9f28466941aaeb4f37817db3e04364b [0,0,0,0,0,0|4,0,0]=4 39 B15R1.138 C=C(COCCCCS)c1ccccc1 a876f067467764ccd256d00257949493 [0,0,0,0,0,0|4,0,0]=4 40 B15R1.138 C=C(COCCCOC)c1ccccc1 bfc43346409468e7af2058b3cb87e211 [0,0,0,0,0,0|4,0,0]=4 41 B15R1.138 C=C(COCCCSC)c1ccccc1 6e5bd7f6d8e41eb33d5e86de4445dc5c [0,0,0,0,0,0|4,0,0]=4 42 B15R1.138 C=C(COCCOCC)c1ccccc1 ecf574ea07566d73b8fe45c6ab9934bd [0,0,0,0,0,0|4,0,0]=4 43 B15R1.138 C=C(COCCSCC)c1ccccc1 c3550ed6c57c62ff207fb7a0d515681b [0,0,0,0,0,0|4,0,0]=4 44 B15R1.138 C=CCCCCNC(=O)c1ccccc1 5fa470d9d8480dcf7baef39a9ab3c890 [0,0,0,0,0,0|1,0,2]=3 45 B15R1.138 C=CCCCCNC(=O)c1ccccn1 58f0d3922a30088d3aa5a24e137e1a42 [0,0,0,0,0,0|2,0,2]=4 46 B15R1.138 C=CCCCCNC(=O)c1cccnc1 3ed068e584488ee79b31437c9bd80e16 [0,0,0,0,0,0|2,0,2]=4 47 B15R1.138 C=CCCCCNC(=O)c1ccncc1 8c47c58949d497cae2eb998c834c141f [0,0,0,0,0,0|2,0,2]=4 48 B15R1.138 C=CCCCCOC(C)c1ccccc1 ecd7ada28a0f6410c22ced5ac146efb4 [0,0,0,0,0,0|1,0,3]=4 49 B15R1.138 C=CCCCCO[C@@H](C)c1ccccc1 7c3fa54d426554e33dae93f2307ce080 [0,0,0,0,0,0|1,0,3]=4 50 B15R1.138 C=CCCCCO[C@H](C)c1ccccc1 63f7597c602c06bb54e4616282e4a452 [0,0,0,0,0,0|1,0,3]=4 51 B15R1.138 C=CCCCNCC(=O)c1ccccc1 a1f0bd6c80f7b2329b8ecf9eca70874a [0,0,0,0,0,0|2,0,2]=4 52 B15R1.138 C=CCCCOCC(=O)c1ccccc1 b1f673a89255699f1b0906a098f585b8 [0,0,0,0,0,0|2,0,2]=4 53 B15R1.138 C=CCCNCCC(=O)c1ccccc1 534834e5bf7395b216ba17f9833ac9ba [0,0,0,0,0,0|2,0,2]=4 54 B15R1.138 C=CCCNCOC(=O)c1ccccc1 6d6d81a95d6dbea55f2c608a6c342ea5 [0,0,0,0,0,0|1,0,2]=3 55 B15R1.138 C=CCCOCCC(=O)c1ccccc1 aebbff9013302cf2e7d890ffb2c0eb73 [0,0,0,0,0,0|2,0,2]=4 56 B15R1.138 C=CCCOCNC(=O)c1ccccc1 45a29b089040737a82e74fbd063f2a01 [0,0,0,0,0,0|2,0,2]=4 57 B15R1.138 C=CCCOCOC(=O)c1ccccc1 0d9bbcb7bf89dc36ccd55b23c3a8d9ff [0,0,0,0,0,0|1,0,2]=3 58 B15R1.138 C=CCOCCCC(=O)c1ccccc1 dd84cb1ebc983d88b54facd293453406 [0,0,0,0,0,0|2,0,2]=4 59 B15R1.138 C=CCOCCNC(=O)c1ccccc1 3b77ef881bd156e7480724c6df32f7cb [0,0,0,0,0,0|2,0,2]=4 60 B15R1.138 C=CCOCCOC(=O)c1ccccc1 9e2a8502aca0e90176a66aff651489e4 [0,0,0,0,0,0|1,0,2]=3 61 B15R1.138 C=CCOCCOC(=O)c1cccnc1 13bc9880e71faf366e090f9a20a4a4e3 [0,0,0,0,0,0|2,0,2]=4 62 B15R1.138 C=COCCCNC(=O)c1ccccc1 7188245dedceb556ee899c14e1c5f065 [0,0,0,0,0,0|2,0,2]=4 63 B15R1.138 CC#CCCOCC(=O)c1ccccc1 b27779a9298775127237e1392bbeb7ee [0,0,0,0,0,0|2,0,2]=4 64 B15R1.138 CC#CCNCOC(=O)c1ccccc1 551abfed8ba108af94cb07c4298f3fd9 [0,0,0,0,0,0|1,0,2]=3 65 B15R1.138 CC#CCOCCC(=O)c1ccccc1 a0bec1e9dfe66fc0d5d911e6e4699602 [0,0,0,0,0,0|2,0,2]=4 66 B15R1.138 CC#CCOCNC(=O)c1ccccc1 00e8d06ae493c13ca31a0cef6b2855a9 [0,0,0,0,0,0|2,0,2]=4 67 B15R1.138 CC#CCOCOC(=O)c1ccccc1 519d60b5d826082d9b5fea9a36b39543 [0,0,0,0,0,0|1,0,2]=3 68 B15R1.138 CC(NCCCCCF)c1ccccc1 e10a23e4370cc92a2a2e7c911ed8d3bc [0,0,0,0,0,0|3,0,1]=4 69 B15R1.138 CC(OCCCCC#N)c1ccccc1 4e5a6f89dab603bed0c095c82fb6a26e [0,0,0,0,0,0|2,0,2]=4 70 B15R1.138 CC(OCCCCC=O)c1ccccc1 ca941632666942ce07c540323c4250a4 [0,0,0,0,0,0|2,0,2]=4 71 B15R1.138 CC(OCCCCCF)c1ccccc1 1095c00f55bd3beb91d13ff7a61a067c [0,0,0,0,0,0|2,0,1]=3 72 B15R1.138 CC(OCCCCCF)c1ccccn1 c807ed070328970752a2e8a586bbf156 [0,0,0,0,0,0|3,0,1]=4 73 B15R1.138 CC(OCCCCCF)c1cccnc1 bad307d5c9c6d50d1c3396c4174e4ec1 [0,0,0,0,0,0|3,0,1]=4 74 B15R1.138 CC(OCCCCCF)c1ccncc1 4f5bc8f7d13b6fc3a69660933c7bafe9 [0,0,0,0,0,0|3,0,1]=4 75 B15R1.138 CC(OCCOCCF)c1ccccc1 3d7a340ee50dac0fc98d8f966209315b [0,0,0,0,0,0|3,0,1]=4 76 B15R1.138 CC(OCCOCCS)c1ccccc1 3eefa8f18f861c3d78fb3a588ccfcb02 [0,0,0,0,0,0|3,0,1]=4 77 B15R1.138 CC/C=C/CNCC(=O)c1ccccc1 fd159e8e6c17984cc8fef2af90351278 [0,0,0,0,0,0|2,0,2]=4 78 B15R1.138 CC/C=C/COCC(=O)c1ccccc1 05ec067602766c40854cf20b4ad7ac67 [0,0,0,0,0,0|2,0,2]=4 79 B15R1.138 CC/C=C\CCOC(C)c1ccccc1 adc00ba33fa4adf442ae664d8262c28e [0,0,0,0,0,0|1,0,3]=4 80 B15R1.138 CC/C=C\CCO[C@@H](C)c1ccccc1 2c7be15c2cf5f9d997482250f5073b22 [0,0,0,0,0,0|1,0,3]=4 81 B15R1.138 CC/C=C\CCO[C@H](C)c1ccccc1 03db5edc7fdfe17a725f3ddc84fbf8e8 [0,0,0,0,0,0|1,0,3]=4 82 B15R1.138 CC/C=C\COCC(=O)c1ccccc1 c28f25dc5276cd11d9bf4b768fea5064 [0,0,0,0,0,0|2,0,2]=4 83 B15R1.138 CC=CCCCOC(C)c1ccccc1 a3f666dd91ad35d3990b45ccc71af9e4 [0,0,0,0,0,0|1,0,3]=4 84 B15R1.138 CC=CCCCO[C@@H](C)c1ccccc1 58f61283d37107b5269d3c8a6e2dc391 [0,0,0,0,0,0|1,0,3]=4 85 B15R1.138 CC=CCCCO[C@H](C)c1ccccc1 17d1bc1a6a39db25b264e639860faee9 [0,0,0,0,0,0|1,0,3]=4 86 B15R1.138 CC=CCNCCC(=O)c1ccccc1 0ee69c5e4b132050c78ce81bca9b8d56 [0,0,0,0,0,0|2,0,2]=4 87 B15R1.138 CC=CCNCOC(=O)c1ccccc1 e345cbed0aeaa57c195a0b1ecc51a0d9 [0,0,0,0,0,0|1,0,2]=3 88 B15R1.138 CC=CCOCCC(=O)c1ccccc1 0aacdd239610258a40073077bccca0b2 [0,0,0,0,0,0|2,0,2]=4 89 B15R1.138 CC=CCOCOC(=O)c1ccccc1 a3dd820e93c98213fed9bfc4a44e5ced [0,0,0,0,0,0|1,0,2]=3 90 B15R1.138 CCC#CCNCC(=O)c1ccccc1 3012d98597d8e57b48e1bdb306e3b891 [0,0,0,0,0,0|2,0,2]=4 91 B15R1.138 CCC#CCOCC(=O)c1ccccc1 073bd3f774cf8fe33de0380871463618 [0,0,0,0,0,0|2,0,2]=4 92 B15R1.138 CCC/C=C/COC(C)c1ccccc1 4b55913fc101c2576821b917fb1c004a [0,0,0,0,0,0|1,0,3]=4 93 B15R1.138 CCC/C=C/CO[C@@H](C)c1ccccc1 88875200769ff5af8e7fe2228a7469dc [0,0,0,0,0,0|1,0,3]=4 94 B15R1.138 CCC/C=C/CO[C@H](C)c1ccccc1 145c22615da98fb328d548667f2d0ebe [0,0,0,0,0,0|1,0,3]=4 95 B15R1.138 CCC/C=C\COC(C)c1ccccc1 4a670c7051212ab0117123d51c16fbd9 [0,0,0,0,0,0|1,0,3]=4 96 B15R1.138 CCC/C=C\CO[C@@H](C)c1ccccc1 5c254d94479e7176a2ad6401175eecde [0,0,0,0,0,0|1,0,3]=4 97 B15R1.138 CCC/C=C\CO[C@H](C)c1ccccc1 97acf5939758f5e183f6aa13eec4f3ee [0,0,0,0,0,0|1,0,3]=4 98 B15R1.138 CCCCCCCN(C)c1ccccc1 73df67fe2848a15df6409c9ca86e18db [0,0,0,0,0,0|3,0,0]=3 99 B15R1.138 CCCCCCCN(C)c1cccnc1 1ea5b47057d4a850e6c8b94c5dd8e022 [0,0,0,0,0,0|4,0,0]=4 100 B15R1.138 CCCCCCNC(=O)c1ccccc1 dc30e2604982b7501d9dd0d6813d35db [0,0,0,0,0,0|1,0,0]=1 101 B15R1.138 CCCCCCNC(=O)c1ccccn1 593aaddb34439459379236e9f10a58f5 [0,0,0,0,0,0|2,0,0]=2 102 B15R1.138 CCCCCCNC(=O)c1cccnc1 7e345d8df5a211a72ab243f2155b45b2 [0,0,0,0,0,0|2,0,0]=2 103 B15R1.138 CCCCCCNC(=O)c1cccnn1 c10656b01f9ac366e10dbb578c12e0d9 [0,0,0,0,0,0|3,0,0]=3 104 B15R1.138 CCCCCCNC(=O)c1ccncc1 ad2543a5759e6e282d2b502cdaa51543 [0,0,0,0,0,0|2,0,0]=2 105 B15R1.138 CCCCCCNC(=O)c1ccncn1 588ec8ef70acdf430ee512cee9f2ec88 [0,0,0,0,0,0|3,0,0]=3 106 B15R1.138 CCCCCCNC(=O)c1ccnnc1 1b1f24fd38cd92d2c5a2fab377f54f19 [0,0,0,0,0,0|3,0,0]=3 107 B15R1.138 CCCCCCNC(=O)c1cnccn1 74d7906a0056aff1594b2114088f7f2f [0,0,0,0,0,0|3,0,0]=3 108 B15R1.138 CCCCCCNC(=O)c1cncnc1 8f3fd98ff9100808f0f5f90d0f863dfe [0,0,0,0,0,0|3,0,0]=3 109 B15R1.138 CCCCCCNC(=O)c1ncccn1 56cfeb41d3bb0697f2a8bc782071bba3 [0,0,0,0,0,0|3,0,0]=3 110 B15R1.138 CCCCCCNC(C)c1ccccc1 ece55a3f5caeb80fcb6258278bb3ff82 [0,0,0,0,0,0|2,0,1]=3 111 B15R1.138 CCCCCCNC(C)c1ccccn1 fcc0197a755a2abf2f56d9e806cc8258 [0,0,0,0,0,0|3,0,1]=4 112 B15R1.138 CCCCCCNC(C)c1cccnc1 7b6e4e996dc53fcd2c2c1d8baf083d88 [0,0,0,0,0,0|3,0,1]=4 113 B15R1.138 CCCCCCNC(C)c1ccncc1 115195a237af7fe8a5befb4e563a2896 [0,0,0,0,0,0|3,0,1]=4 114 B15R1.138 CCCCCCN[C@@H](C)c1ccccc1 a69ca366eed7045b1edd91d68cc993d7 [0,0,0,0,0,0|2,0,1]=3 115 B15R1.138 CCCCCCN[C@@H](C)c1ccccn1 a133dd8da596f8e9689ce6c2a706a0f1 [0,0,0,0,0,0|3,0,1]=4 116 B15R1.138 CCCCCCN[C@@H](C)c1cccnc1 0932abfeaeaf8be0124cc5f49e910eba [0,0,0,0,0,0|3,0,1]=4 117 B15R1.138 CCCCCCN[C@@H](C)c1ccncc1 d19e548f0d80b4df487fa4d6b4138fd7 [0,0,0,0,0,0|3,0,1]=4 118 B15R1.138 CCCCCCN[C@H](C)c1ccccc1 e135b27f23fed94981a99e3d9780506c [0,0,0,0,0,0|2,0,1]=3 119 B15R1.138 CCCCCCN[C@H](C)c1ccccn1 f63c577703f31f8f137b0b98be6567d2 [0,0,0,0,0,0|3,0,1]=4 120 B15R1.138 CCCCCCN[C@H](C)c1cccnc1 839e09fce5540de247da7282d2e543cb [0,0,0,0,0,0|3,0,1]=4 121 B15R1.138 CCCCCCN[C@H](C)c1ccncc1 5afbac4d252409c45a84dd4f255a76fc [0,0,0,0,0,0|3,0,1]=4 122 B15R1.138 CCCCCCOC(C)c1ccccc1 85fd133f17e8ca9fc13ba1dea6507805 [0,0,0,0,0,0|1,0,1]=2 123 B15R1.138 CCCCCCOC(C)c1ccccn1 7d7fe56d140eeeb8648f57df88c8d6d7 [0,0,0,0,0,0|2,0,1]=3 124 B15R1.138 CCCCCCOC(C)c1cccnc1 70b244c55b2debc729a83fcbc2cc6aac [0,0,0,0,0,0|2,0,1]=3 125 B15R1.138 CCCCCCOC(C)c1cccnn1 4acebb99d39cf98a11ddd085535f6aa3 [0,0,0,0,0,0|3,0,1]=4 126 B15R1.138 CCCCCCOC(C)c1ccncc1 7e6001df4bf4b3423cc8e25d07ac5840 [0,0,0,0,0,0|2,0,1]=3 127 B15R1.138 CCCCCCOC(C)c1ncccn1 fc7e797e85205bc679096107b2134d4e [0,0,0,0,0,0|3,0,1]=4 128 B15R1.138 CCCCCCO[C@@H](C)c1ccccc1 30d1cdd2170841c72415c514a24635f6 [0,0,0,0,0,0|1,0,1]=2 129 B15R1.138 CCCCCCO[C@@H](C)c1ccccn1 176e8fb0e9abb413788cedacc75c367c [0,0,0,0,0,0|2,0,1]=3 130 B15R1.138 CCCCCCO[C@@H](C)c1cccnc1 26b473a9e19729d0daee2dccf6bf8be4 [0,0,0,0,0,0|2,0,1]=3 131 B15R1.138 CCCCCCO[C@@H](C)c1ccncc1 eccb7b89ac88ab3942158b1889d0d62c [0,0,0,0,0,0|2,0,1]=3 132 B15R1.138 CCCCCCO[C@@H](C)c1ncccn1 e43304960f5ba4838b01bc3c606cea26 [0,0,0,0,0,0|3,0,1]=4 133 B15R1.138 CCCCCCO[C@H](C)c1ccccc1 f1022e2ba920ddfaea9e7a330f782fdb [0,0,0,0,0,0|1,0,1]=2 134 B15R1.138 CCCCCCO[C@H](C)c1ccccn1 9bf943f58d4fa455b7866ae5dfc11b57 [0,0,0,0,0,0|2,0,1]=3 135 B15R1.138 CCCCCCO[C@H](C)c1cccnc1 b65621ea9f7156ef3a0f597447da6039 [0,0,0,0,0,0|2,0,1]=3 136 B15R1.138 CCCCCCO[C@H](C)c1cccnn1 9fd9dad8feaa5526a81e1bc4f2b3cfdc [0,0,0,0,0,0|3,0,1]=4 137 B15R1.138 CCCCCCO[C@H](C)c1ccncc1 ad183a48aba0001ff658969ea2c8b886 [0,0,0,0,0,0|2,0,1]=3 138 B15R1.138 CCCCCCO[C@H](C)c1ncccn1 f6bb2c3945ade4cfce3e9d9524f3d401 [0,0,0,0,0,0|3,0,1]=4 139 B15R1.138 CCCCCNCC(=O)c1ccccc1 4c7a4e62db680d757a170beb5eddbf14 [0,0,0,0,0,0|2,0,0]=2 140 B15R1.138 CCCCCNCC(=O)c1ccccn1 9cb814ad497b8dda746626f8d6119f81 [0,0,0,0,0,0|3,0,0]=3 141 B15R1.138 CCCCCNCC(=O)c1cccnc1 d7b5a74d275f87163f406474a227c2d4 [0,0,0,0,0,0|3,0,0]=3 142 B15R1.138 CCCCCNCC(=O)c1ccncn1 fa34b266e47354ceb1ffaee82292548b [0,0,0,0,0,0|4,0,0]=4 143 B15R1.138 CCCCCNCC(=O)c1cnccn1 82f95ce380828adac3f77f46ac8768dd [0,0,0,0,0,0|4,0,0]=4 144 B15R1.138 CCCCCNCC(C)c1ccccc1 8b5d861eed74b77798b10d8211605d01 [0,0,0,0,0,0|3,0,1]=4 145 B15R1.138 CCCCCNCC(F)c1ccccc1 3549fcaab688760e4c6bd92942bde624 [0,0,0,0,0,0|3,0,1]=4 146 B15R1.138 CCCCCNC[C@@H](C)c1ccccc1 5646e5cf21523c88c54c7c0af5a35945 [0,0,0,0,0,0|3,0,1]=4 147 B15R1.138 CCCCCNC[C@H](C)c1ccccc1 6997e2a118a9369c95c42bae4191564d [0,0,0,0,0,0|3,0,1]=4 148 B15R1.138 CCCCCOCC(=O)c1ccccc1 107d34f77624ae87e8557673ee0ea5b7 [0,0,0,0,0,0|2,0,0]=2 149 B15R1.138 CCCCCOCC(=O)c1ccccn1 f1b813bd3029fee2881d1db8aecbbbf6 [0,0,0,0,0,0|3,0,0]=3 150 B15R1.138 CCCCCOCC(=O)c1cccnc1 e8ff88d772ee5ec42007975772a87eb5 [0,0,0,0,0,0|3,0,0]=3 151 B15R1.138 CCCCCOCC(=O)c1ccncn1 88eb0e1550b53537360d8045e398f39b [0,0,0,0,0,0|4,0,0]=4 152 B15R1.138 CCCCCOCC(=O)c1cnccn1 d63eac927561b122c59c5ec0a88309f5 [0,0,0,0,0,0|4,0,0]=4 153 B15R1.138 CCCCCOCC(C)c1ccccc1 be9ac1800786c2e37b8fd0fe6a1a6ded [0,0,0,0,0,0|3,0,1]=4 154 B15R1.138 CCCCCOC[C@@H](C)c1ccccc1 073ff5ef46c7e21468d8045c04ceced8 [0,0,0,0,0,0|3,0,1]=4 155 B15R1.138 CCCCCOC[C@H](C)c1ccccc1 00e9026ffe1053c90820beb044ec12f9 [0,0,0,0,0,0|3,0,1]=4 156 B15R1.138 CCCCNCCC(C)c1ccccc1 9ceb84346ecfd2381e6fcd4d7761621a [0,0,0,0,0,0|3,0,1]=4 157 B15R1.138 CCCCNCCC(O)c1ccccc1 0ed972901689140ebad8bdadd90cd2e9 [0,0,0,0,0,0|2,0,2]=4 158 B15R1.138 CCCCNCCN(C)c1ccccc1 f718bf5fe32ff22bb10fb9dec30db4f4 [0,0,0,0,0,0|4,0,0]=4 159 B15R1.138 CCCCNCC[C@@H](O)c1ccccc1 b1ff335f71fd597e04d2168c27725abc [0,0,0,0,0,0|2,0,2]=4 160 B15R1.138 CCCCNCC[C@H](O)c1ccccc1 bed5621e1b1c2cd51d4d0fcbfd5e2913 [0,0,0,0,0,0|2,0,2]=4 161 B15R1.138 CCCCNCOC(=O)c1ccccc1 b5dd4091325b174bf4bd924cc8353104 [0,0,0,0,0,0|1,0,0]=1 162 B15R1.138 CCCCOC/C=C(\C)/c1ccccn1 39fc821fa1736d8173e2cc43d2242142 [0,0,0,0,0,0|4,0,0]=4 163 B15R1.138 CCCCOCCC(=O)c1ccccc1 e082ab5dad4575b9813cd604fa28c426 [0,0,0,0,0,0|2,0,0]=2 164 B15R1.138 CCCCOCCC(C)c1ccccc1 4e44e30e250785204da3ef0338b60570 [0,0,0,0,0,0|3,0,1]=4 165 B15R1.138 CCCCOCCN(C)c1ccccc1 50adf753d9a331ad0481bc90655e11c6 [0,0,0,0,0,0|4,0,0]=4 166 B15R1.138 CCCCOCCS(=O)c1ccccc1 c763a342b38b95a5e885a2e545f8958c [0,0,0,0,0,0|3,0,0]=3 167 B15R1.138 CCCCOCNC(=O)c1ccccc1 eb61b5f787c88d9dd64f671afde26648 [0,0,0,0,0,0|2,0,0]=2 168 B15R1.138 CCCCOCNC(=O)c1cccnc1 4267598f6a2cf1663beee57c23caaf9d [0,0,0,0,0,0|3,0,0]=3 169 B15R1.138 CCCCOCNC(C)c1ccccc1 625287d2879cb63ab8b092b88e55d098 [0,0,0,0,0,0|3,0,1]=4 170 B15R1.138 CCCCOCN[C@@H](C)c1ccccc1 599a651bbc56ec41b8e41b81f590d8b9 [0,0,0,0,0,0|3,0,1]=4 171 B15R1.138 CCCCOCN[C@H](C)c1ccccc1 709787dc73e53ce9479c2f20525e732e [0,0,0,0,0,0|3,0,1]=4 172 B15R1.138 CCCCOCOC(=O)c1ccccc1 2e8aa29726789f2221f755ee36ae9490 [0,0,0,0,0,0|1,0,0]=1 173 B15R1.138 CCCCOCOC(C)c1ccccc1 179b21023245c1d9d59d103010fc9738 [0,0,0,0,0,0|2,0,1]=3 174 B15R1.138 CCCCOCOC(C)c1ccccn1 f2eac69b04258e692f16d4c3a1c9db49 [0,0,0,0,0,0|3,0,1]=4 175 B15R1.138 CCCCOCOC(C)c1cccnc1 5b5ec721ce1941af513ed9f001b25f63 [0,0,0,0,0,0|3,0,1]=4 176 B15R1.138 CCCCOCOC(C)c1ccncc1 b205a7ae2b13d5be1ad1dc1733f37434 [0,0,0,0,0,0|3,0,1]=4 177 B15R1.138 CCCCOCO[C@@H](C)c1ccccc1 355fbd81af6784e1bf8e40897745cf05 [0,0,0,0,0,0|2,0,1]=3 178 B15R1.138 CCCCOCO[C@@H](C)c1ccccn1 414e4604224aaceab9da131255b2bf93 [0,0,0,0,0,0|3,0,1]=4 179 B15R1.138 CCCCOCO[C@@H](C)c1cccnc1 7238a6b6eb48878932db921d8f1864a4 [0,0,0,0,0,0|3,0,1]=4 180 B15R1.138 CCCCOCO[C@@H](C)c1ccncc1 ac677883e3933163776845e27d33139e [0,0,0,0,0,0|3,0,1]=4 181 B15R1.138 CCCCOCO[C@H](C)c1ccccc1 f5e625d3b6ad809fea6e602df6bd6dc9 [0,0,0,0,0,0|2,0,1]=3 182 B15R1.138 CCCCOCO[C@H](C)c1ccccn1 318adeb98b25e1980c31fa7e73495126 [0,0,0,0,0,0|3,0,1]=4 183 B15R1.138 CCCCOCO[C@H](C)c1cccnc1 deda80dd8a9437742cfee0e79f357470 [0,0,0,0,0,0|3,0,1]=4 184 B15R1.138 CCCCOCO[C@H](C)c1ccncc1 2a3abc1df86d4d4817342f371f17bf99 [0,0,0,0,0,0|3,0,1]=4 185 B15R1.138 CCCNCCCN(C)c1ccccc1 6259fd93ad4e7002d9ddb26b415355db [0,0,0,0,0,0|4,0,0]=4 186 B15R1.138 CCCNCCNC(=O)c1ccccc1 29e798db39b6636297507ad0e1ed3cfa [0,0,0,0,0,0|2,0,0]=2 187 B15R1.138 CCCNCCNC(=O)c1ccccn1 f319c02b9d6b770cd49afe2b3be31794 [0,0,0,0,0,0|3,0,0]=3 188 B15R1.138 CCCNCCNC(=O)c1ccncc1 3aaaa7014cef2ce2c8045a8325a92a4f [0,0,0,0,0,0|3,0,0]=3 189 B15R1.138 CCCNCCOC(=O)c1ccccc1 62a9b84637e703ef613cf064f4c4045d [0,0,0,0,0,0|1,0,0]=1 190 B15R1.138 CCCOCCCC(=O)c1ccccc1 0d7917bb43e14d591901a1f020d9f33c [0,0,0,0,0,0|2,0,0]=2 191 B15R1.138 CCCOCCCC(=O)c1cccnc1 98845a3a6dce88018ec995f6d49df9cd [0,0,0,0,0,0|3,0,0]=3 192 B15R1.138 CCCOCCCN(C)c1ccccc1 89d07fa635cdeeba55771c0889672ab7 [0,0,0,0,0,0|4,0,0]=4 193 B15R1.138 CCCOCCNC(=O)c1ccccc1 666c597e029487a7b8eaa0b02fc5212f [0,0,0,0,0,0|2,0,0]=2 194 B15R1.138 CCCOCCNC(=O)c1ccccn1 fdcbc37c11fc737b2163b17ccb6a1832 [0,0,0,0,0,0|3,0,0]=3 195 B15R1.138 CCCOCCNC(=O)c1cccnc1 3f76475da9de0c6142f14027d71239aa [0,0,0,0,0,0|3,0,0]=3 196 B15R1.138 CCCOCCNC(=O)c1cccnn1 5816fabbfa7a7d9f95bc018ba566bac5 [0,0,0,0,0,0|4,0,0]=4 197 B15R1.138 CCCOCCNC(=O)c1ccncc1 4b85b1545b6faa4c76252c09faa408e1 [0,0,0,0,0,0|3,0,0]=3 198 B15R1.138 CCCOCCNC(=O)c1ccncn1 015ee8a9905b82f84a3643f94706f629 [0,0,0,0,0,0|4,0,0]=4 199 B15R1.138 CCCOCCNC(=O)c1ccnnc1 a7fb5680e3b0d404057ba77873c0cb21 [0,0,0,0,0,0|4,0,0]=4 200 B15R1.138 CCCOCCNC(=O)c1cnccn1 b0c17f041e650c3596fd49865f9c36a1 [0,0,0,0,0,0|4,0,0]=4 201 B15R1.138 CCCOCCNC(=O)c1cncnc1 d9adc59989170b965a7179545b2f4c98 [0,0,0,0,0,0|4,0,0]=4 202 B15R1.138 CCCOCCNC(=O)c1ncccn1 ef9b720e9233804ab0b91aefef2ccdbe [0,0,0,0,0,0|4,0,0]=4 203 B15R1.138 CCCOCCNC(C)c1ccccc1 06a53b51cd0f036b75b144d16bf1d0e8 [0,0,0,0,0,0|3,0,1]=4 204 B15R1.138 CCCOCCN[C@@H](C)c1ccccc1 63a1d2784bd10afb635270273e1fb90b [0,0,0,0,0,0|3,0,1]=4 205 B15R1.138 CCCOCCN[C@H](C)c1ccccc1 691f2bb41eeff6c3200c2fa0d012aa8a [0,0,0,0,0,0|3,0,1]=4 206 B15R1.138 CCCOCCOC(=O)c1ccccc1 957100ba1a2f4516bf1e68b972d0ff84 [0,0,0,0,0,0|1,0,0]=1 207 B15R1.138 CCCOCCOC(=O)c1cccnc1 557225ff25958573c018825fe707e86f [0,0,0,0,0,0|2,0,0]=2 208 B15R1.138 CCCOCCOC(C)c1ccccc1 fec2669d6ec872b29d7169d3ce84c70d [0,0,0,0,0,0|2,0,1]=3 209 B15R1.138 CCCOCCOC(C)c1ccccn1 2a593635cffa0bd8f15dd76326c48823 [0,0,0,0,0,0|3,0,1]=4 210 B15R1.138 CCCOCCOC(C)c1cccnc1 3104d6858ec9164385617017db0683b1 [0,0,0,0,0,0|3,0,1]=4 211 B15R1.138 CCCOCCOC(C)c1ccncc1 92a3adf4623bc2d47d07e614b714fae9 [0,0,0,0,0,0|3,0,1]=4 212 B15R1.138 CCCOCCO[C@@H](C)c1ccccc1 35a33d11e63abe659918be11fc93b55a [0,0,0,0,0,0|2,0,1]=3 213 B15R1.138 CCCOCCO[C@@H](C)c1ccccn1 3701706fa223b0df6f09cb0a5e328a2e [0,0,0,0,0,0|3,0,1]=4 214 B15R1.138 CCCOCCO[C@@H](C)c1cccnc1 9ba50caad528b6c00bfdd062f8f11872 [0,0,0,0,0,0|3,0,1]=4 215 B15R1.138 CCCOCCO[C@@H](C)c1ccncc1 bc4bd125d2fb8a1cf62119f145dd2ae4 [0,0,0,0,0,0|3,0,1]=4 216 B15R1.138 CCCOCCO[C@H](C)c1ccccc1 d22c4bc23cba9b9a34d1cffd072de428 [0,0,0,0,0,0|2,0,1]=3 217 B15R1.138 CCCOCCO[C@H](C)c1ccccn1 b174688f5841e08abca1d3e9e9362f85 [0,0,0,0,0,0|3,0,1]=4 218 B15R1.138 CCCOCCO[C@H](C)c1cccnc1 1fba152ad22aa02e79dcbf7814e4b713 [0,0,0,0,0,0|3,0,1]=4 219 B15R1.138 CCCOCCO[C@H](C)c1ccncc1 1c7240bc7ef6ca5b3644ba158b322a0c [0,0,0,0,0,0|3,0,1]=4 220 B15R1.138 CCNCCCCN(C)c1ccccc1 02e7dbdff9ce5a3da1bc36400bc8f987 [0,0,0,0,0,0|4,0,0]=4 221 B15R1.138 CCOCCCCN(C)c1ccccc1 5c93ae2f79730ed4fd4c637873a59416 [0,0,0,0,0,0|4,0,0]=4 222 B15R1.138 CCOCCCNC(=O)c1ccccc1 745f2e052c0404b9a97919bd42ec16ef [0,0,0,0,0,0|2,0,0]=2 223 B15R1.138 CCOCCCNC(=O)c1ccccn1 0d5e06b775ccd4b5dd29b0d18be98f4f [0,0,0,0,0,0|3,0,0]=3 224 B15R1.138 CCOCCCNC(=O)c1cccnc1 f9257f172871091c11b091c6d2f22e12 [0,0,0,0,0,0|3,0,0]=3 225 B15R1.138 CCOCCCNC(=O)c1cccnn1 89b828f67c3a7b2e6b218c0a654c620a [0,0,0,0,0,0|4,0,0]=4 226 B15R1.138 CCOCCCNC(=O)c1ccncc1 27aa0ec40bc7192739b0ddbab8ad2006 [0,0,0,0,0,0|3,0,0]=3 227 B15R1.138 CCOCCCNC(=O)c1ccncn1 fe30bd6b1c1df8ceb56f71b9b57975c9 [0,0,0,0,0,0|4,0,0]=4 228 B15R1.138 CCOCCCNC(=O)c1ccnnc1 f03b8a7f63b6245377814b153a05e74b [0,0,0,0,0,0|4,0,0]=4 229 B15R1.138 CCOCCCNC(=O)c1cnccn1 c1d89ef123415851f3b3998066607135 [0,0,0,0,0,0|4,0,0]=4 230 B15R1.138 CCOCCCNC(=O)c1cncnc1 e1f73cb78193cb46d177d11d97a2a028 [0,0,0,0,0,0|4,0,0]=4 231 B15R1.138 CCOCCCNC(=O)c1ncccn1 518a995e0b0da2982324a9ea3b7882db [0,0,0,0,0,0|4,0,0]=4 232 B15R1.138 CCOCCCNC(C)c1ccccc1 fbd4da59aadc2781e4f68c0d15838996 [0,0,0,0,0,0|3,0,1]=4 233 B15R1.138 CCOCCCN[C@@H](C)c1ccccc1 c0e1242a924396a7fb09d3a6d3077e37 [0,0,0,0,0,0|3,0,1]=4 234 B15R1.138 CCOCCCN[C@H](C)c1ccccc1 93d7f63c84591c812ed9e0122469c953 [0,0,0,0,0,0|3,0,1]=4 235 B15R1.138 CCOCCCOC(C)c1ccccc1 cc0d2d76dd4fcdca2028826c84fa045a [0,0,0,0,0,0|2,0,1]=3 236 B15R1.138 CCOCCCOC(C)c1ccccn1 5a03584d8fe698c58dcbf402449d5289 [0,0,0,0,0,0|3,0,1]=4 237 B15R1.138 CCOCCCOC(C)c1cccnc1 bfd340b0968abc628ec9d0a2462f3fff [0,0,0,0,0,0|3,0,1]=4 238 B15R1.138 CCOCCCOC(C)c1ccncc1 566bad8b0aafe4837bac5b350d553c4f [0,0,0,0,0,0|3,0,1]=4 239 B15R1.138 CCOCCCO[C@@H](C)c1ccccc1 7d0003b0e0a44b48639492b5fb77088b [0,0,0,0,0,0|2,0,1]=3 240 B15R1.138 CCOCCCO[C@@H](C)c1ccccn1 6a5d36a7f593930d03f9f4af39422453 [0,0,0,0,0,0|3,0,1]=4 241 B15R1.138 CCOCCCO[C@@H](C)c1cccnc1 1063a843305897280860479453938e6f [0,0,0,0,0,0|3,0,1]=4 242 B15R1.138 CCOCCCO[C@@H](C)c1ccncc1 9367c534225a99790765ed49d539c004 [0,0,0,0,0,0|3,0,1]=4 243 B15R1.138 CCOCCCO[C@H](C)c1ccccc1 f66e4ec4e6a413001e385fcc34d21d93 [0,0,0,0,0,0|2,0,1]=3 244 B15R1.138 CCOCCCO[C@H](C)c1ccccn1 233b263ec066c92fed227eae8fc5634b [0,0,0,0,0,0|3,0,1]=4 245 B15R1.138 CCOCCCO[C@H](C)c1cccnc1 b7e8f1b8e5029cec5282dfb631216efe [0,0,0,0,0,0|3,0,1]=4 246 B15R1.138 CCOCCCO[C@H](C)c1ccncc1 36127a9f50a13b914a76308cbca1a42b [0,0,0,0,0,0|3,0,1]=4 247 B15R1.138 CCOCCNCC(=O)c1ccccc1 a758306fbcd1d6302fca70aa7c5f08aa [0,0,0,0,0,0|3,0,0]=3 248 B15R1.138 CCOCCNCC(=O)c1ccccn1 88d54101938ca540b4ddc092210377d8 [0,0,0,0,0,0|4,0,0]=4 249 B15R1.138 CCOCCNCC(=O)c1cccnc1 759ed6fc6cb049fcf5291e200b16dc24 [0,0,0,0,0,0|4,0,0]=4 250 B15R1.138 CCOCCOCC(=O)c1ccccc1 613b086a5d64abe369380301a9f879ae [0,0,0,0,0,0|3,0,0]=3 251 B15R1.138 CCOCCOCC(=O)c1ccccn1 8a8429f60e81582a2d6c88640e73cc4d [0,0,0,0,0,0|4,0,0]=4 252 B15R1.138 CCOCCOCC(=O)c1cccnc1 e3efa70d0d4ad8dfa9b71775c4b47605 [0,0,0,0,0,0|4,0,0]=4 253 B15R1.138 CCOCCOCS(=O)c1ccccc1 b3195ae2e791a5798e14c6f9d72ed1a7 [0,0,0,0,0,0|4,0,0]=4 254 B15R1.138 CCOCOCCC(=O)c1ccccc1 c2a3811b5df66c0f66e591254ee2f202 [0,0,0,0,0,0|3,0,0]=3 255 B15R1.138 CCOCOCNC(=O)c1ccccc1 ef49153236a2fede00d3387fca31f5a4 [0,0,0,0,0,0|3,0,0]=3 256 B15R1.138 CCOCOCNC(=O)c1cccnc1 b84b1146a34922500f85d4afc9e3dcdb [0,0,0,0,0,0|4,0,0]=4 257 B15R1.138 CCSCCCNC(C)c1ccccc1 60225ed28098104aff2f6180540ffbdd [0,0,0,0,0,0|3,0,1]=4 258 B15R1.138 CCSCCCN[C@@H](C)c1ccccc1 0910e8f93152c4c12b4e2ac60ad83bea [0,0,0,0,0,0|3,0,1]=4 259 B15R1.138 CCSCCCN[C@H](C)c1ccccc1 41f45c79b3eec84b91680cbca6e4f58e [0,0,0,0,0,0|3,0,1]=4 260 B15R1.138 CCSCCCOC(C)c1ccccc1 7686a8ca29c7ce882dc473743cc03296 [0,0,0,0,0,0|2,0,1]=3 261 B15R1.138 CCSCCCOC(C)c1ccccn1 c629c3f3563e64ae9a306fbe95a8234b [0,0,0,0,0,0|3,0,1]=4 262 B15R1.138 CCSCCCOC(C)c1cccnc1 571aa75279c503d2a73d76d24b5404f9 [0,0,0,0,0,0|3,0,1]=4 263 B15R1.138 CCSCCCOC(C)c1ccncc1 c88e3d8b342bbf143e264d9454b6bd4e [0,0,0,0,0,0|3,0,1]=4 264 B15R1.138 CCSCCCO[C@@H](C)c1ccccc1 66dc9d52a285a32aa3f7dfda1e596630 [0,0,0,0,0,0|2,0,1]=3 265 B15R1.138 CCSCCCO[C@@H](C)c1ccccn1 4ad2fa3361f78c936b8102e223926124 [0,0,0,0,0,0|3,0,1]=4 266 B15R1.138 CCSCCCO[C@@H](C)c1cccnc1 c7f9a4358b907b5bd35d61648a838757 [0,0,0,0,0,0|3,0,1]=4 267 B15R1.138 CCSCCCO[C@@H](C)c1ccncc1 65eae3b835c7de5b127b5d2e2c019d55 [0,0,0,0,0,0|3,0,1]=4 268 B15R1.138 CCSCCCO[C@H](C)c1ccccc1 9fc823814269c09dbb412997fab8b6de [0,0,0,0,0,0|2,0,1]=3 269 B15R1.138 CCSCCCO[C@H](C)c1ccccn1 e0b376ff1d7c79b9386f83ae840dd44e [0,0,0,0,0,0|3,0,1]=4 270 B15R1.138 CCSCCCO[C@H](C)c1cccnc1 abc3683916c5e8cb65793d290600eab4 [0,0,0,0,0,0|3,0,1]=4 271 B15R1.138 CCSCCCO[C@H](C)c1ccncc1 b26b560505f78cc538b9c2432c99070c [0,0,0,0,0,0|3,0,1]=4 272 B15R1.138 CCSCCNCC(=O)c1ccccc1 b2d078cdf3309fea330cf5442375170a [0,0,0,0,0,0|3,0,0]=3 273 B15R1.138 CCSCCNCC(=O)c1ccccn1 9899e05bf3c1bd6d6532b984e920a4cc [0,0,0,0,0,0|4,0,0]=4 274 B15R1.138 CCSCCNCC(=O)c1cccnc1 e013a7919d07d79b59f12e6301fba115 [0,0,0,0,0,0|4,0,0]=4 275 B15R1.138 CCSCCOCC(=O)c1ccccc1 d411bae01d2fdd6589624caeab0daf32 [0,0,0,0,0,0|3,0,0]=3 276 B15R1.138 CCSCCOCC(=O)c1ccccn1 a7087e84670c7714abfdc03d955a77d8 [0,0,0,0,0,0|4,0,0]=4 277 B15R1.138 CCSCCOCC(=O)c1cccnc1 424f0b5169171239264d8df333f0ce25 [0,0,0,0,0,0|4,0,0]=4 278 B15R1.138 CN(CCCCCCO)c1ccccc1 9d14ed1f5413cccbea1e75ff06ae753b [0,0,0,0,0,0|4,0,0]=4 279 B15R1.138 COCCCCCN(C)c1ccccc1 f72bf57151ab6654db3f3998b0e2a400 [0,0,0,0,0,0|4,0,0]=4 280 B15R1.138 COCCCCNC(=O)c1ccccc1 5505842ace206b909ff78c10bb0c0c14 [0,0,0,0,0,0|2,0,0]=2 281 B15R1.138 COCCCCNC(=O)c1ccccn1 850258b4acb7049d2ef23836851e8591 [0,0,0,0,0,0|3,0,0]=3 282 B15R1.138 COCCCCNC(=O)c1cccnc1 5fdc1d1a85211fb5bbb9047c0c40cbd6 [0,0,0,0,0,0|3,0,0]=3 283 B15R1.138 COCCCCNC(=O)c1cccnn1 c6765841422da85f739165668dbe8d45 [0,0,0,0,0,0|4,0,0]=4 284 B15R1.138 COCCCCNC(=O)c1ccncc1 87fb94c91d7129d6af756562646941da [0,0,0,0,0,0|3,0,0]=3 285 B15R1.138 COCCCCNC(=O)c1ccncn1 abc879433309e19ee14f63833cb6121f [0,0,0,0,0,0|4,0,0]=4 286 B15R1.138 COCCCCNC(=O)c1ccnnc1 b219225810ee75de634a3683f12a9ac5 [0,0,0,0,0,0|4,0,0]=4 287 B15R1.138 COCCCCNC(=O)c1cnccn1 e95a85d943ca70f5829dc4d2e0e57e4a [0,0,0,0,0,0|4,0,0]=4 288 B15R1.138 COCCCCNC(=O)c1cncnc1 2c10729a39c6ee5424c93cbe4b8ecaea [0,0,0,0,0,0|4,0,0]=4 289 B15R1.138 COCCCCNC(=O)c1ncccn1 7eba5b17b6fe8c32439e63a384bd8571 [0,0,0,0,0,0|4,0,0]=4 290 B15R1.138 COCCCCNC(C)c1ccccc1 07b6bc8c7775a6a4c99bbecde522851b [0,0,0,0,0,0|3,0,1]=4 291 B15R1.138 COCCCCN[C@@H](C)c1ccccc1 007bd37e4382b4d5095ad97db621cc36 [0,0,0,0,0,0|3,0,1]=4 292 B15R1.138 COCCCCN[C@H](C)c1ccccc1 44841ba96a286b82353608090b14e734 [0,0,0,0,0,0|3,0,1]=4 293 B15R1.138 COCCCCOC(C)c1ccccc1 68ed94b17a40f0a003c56a6a7c0dc338 [0,0,0,0,0,0|2,0,1]=3 294 B15R1.138 COCCCCOC(C)c1ccccn1 ac4cadcc423544a2108fea07f5a84033 [0,0,0,0,0,0|3,0,1]=4 295 B15R1.138 COCCCCOC(C)c1cccnc1 1a5a49bfa28284f394822a3d387dbb02 [0,0,0,0,0,0|3,0,1]=4 296 B15R1.138 COCCCCOC(C)c1ccncc1 7ed81252fb19df92bebd423a59f7098d [0,0,0,0,0,0|3,0,1]=4 297 B15R1.138 COCCCCO[C@@H](C)c1ccccc1 04a233503a176a51c067a7853fb190f3 [0,0,0,0,0,0|2,0,1]=3 298 B15R1.138 COCCCCO[C@@H](C)c1ccccn1 3d2b9bc0a0c97d74d6728bcbdbb38647 [0,0,0,0,0,0|3,0,1]=4 299 B15R1.138 COCCCCO[C@@H](C)c1cccnc1 c19161de1ad136bbfc329cbf7cd4a0ea [0,0,0,0,0,0|3,0,1]=4 300 B15R1.138 COCCCCO[C@@H](C)c1ccncc1 60aef92f2abf6d4b1c1235382071ba9f [0,0,0,0,0,0|3,0,1]=4 301 B15R1.138 COCCCCO[C@H](C)c1ccccc1 a68860b91113fc87c063860031763b23 [0,0,0,0,0,0|2,0,1]=3 302 B15R1.138 COCCCCO[C@H](C)c1ccccn1 5855676bea414bb24ca1f4c25a6e6f74 [0,0,0,0,0,0|3,0,1]=4 303 B15R1.138 COCCCCO[C@H](C)c1cccnc1 fda9c82f7d3b2662498d2d9700970868 [0,0,0,0,0,0|3,0,1]=4 304 B15R1.138 COCCCCO[C@H](C)c1ccncc1 714ff981f45f9a5498fb62c490069db5 [0,0,0,0,0,0|3,0,1]=4 305 B15R1.138 COCCCNCC(=O)c1ccccc1 2017db0e959d47e94f76561d57cbb17f [0,0,0,0,0,0|3,0,0]=3 306 B15R1.138 COCCCNCC(=O)c1ccccn1 0e2ef4b03b986342fb623c1a45abe47b [0,0,0,0,0,0|4,0,0]=4 307 B15R1.138 COCCCNCC(=O)c1cccnc1 75f6671b7d77df5a2ad808a0f034fc06 [0,0,0,0,0,0|4,0,0]=4 308 B15R1.138 COCCCOCC(=O)c1ccccc1 80acff18d84d7e38b17c21f346eb34b4 [0,0,0,0,0,0|3,0,0]=3 309 B15R1.138 COCCCOCC(=O)c1ccccn1 bd78bdfd7b042fa044344e49e2db142c [0,0,0,0,0,0|4,0,0]=4 310 B15R1.138 COCCCOCC(=O)c1cccnc1 657d7c20ce433433f6992c62b613119f [0,0,0,0,0,0|4,0,0]=4 311 B15R1.138 COCCNCOC(=O)c1ccccc1 136d6fd52af831886706420aec7e35e4 [0,0,0,0,0,0|2,0,0]=2 312 B15R1.138 COCCOCCC(=O)c1ccccc1 e4d4388c01ef320d4e8ce6731a62a886 [0,0,0,0,0,0|3,0,0]=3 313 B15R1.138 COCCOCCS(=O)c1ccccc1 e8b86fea4ef24df7a85a598c4001c5f8 [0,0,0,0,0,0|4,0,0]=4 314 B15R1.138 COCCOCNC(=O)c1ccccc1 868336d46046ff08b0026f62f0579a42 [0,0,0,0,0,0|3,0,0]=3 315 B15R1.138 COCCOCNC(=O)c1cccnc1 4971d95b5588ac3004e8f8f52d42ef64 [0,0,0,0,0,0|4,0,0]=4 316 B15R1.138 COCCOCOC(=O)c1ccccc1 747cb5b3e18d4023a6a6e4ac7556dc5a [0,0,0,0,0,0|2,0,0]=2 317 B15R1.138 COCCOCOC(C)c1ccccc1 015b3ef7324fa7384f7731fa14428e0d [0,0,0,0,0,0|3,0,1]=4 318 B15R1.138 COCCOCO[C@@H](C)c1ccccc1 874378711434cc9b23a9f47f7c08bfd6 [0,0,0,0,0,0|3,0,1]=4 319 B15R1.138 COCCOCO[C@H](C)c1ccccc1 0d9b5a0182417d31a5d47d7b75140c87 [0,0,0,0,0,0|3,0,1]=4 320 B15R1.138 COCNCCNC(=O)c1ccncc1 d87dda7284a141399d59bd1f56471786 [0,0,0,0,0,0|4,0,0]=4 321 B15R1.138 COCOCCCC(=O)c1ccccc1 f87e0b3714ebe93a7e673abf07f0fe7a [0,0,0,0,0,0|3,0,0]=3 322 B15R1.138 COCOCCCC(=O)c1cccnc1 e660b76fa2af8ce2dc69bfcc54250409 [0,0,0,0,0,0|4,0,0]=4 323 B15R1.138 COCOCCNC(=O)c1ccccc1 4380557e6640d525a6348415a543e24a [0,0,0,0,0,0|3,0,0]=3 324 B15R1.138 COCOCCNC(=O)c1ccccn1 592e7f7001092b1ffc8f62700d1ce391 [0,0,0,0,0,0|4,0,0]=4 325 B15R1.138 COCOCCNC(=O)c1cccnc1 5396350f59e5f990d07a72c2b509be4c [0,0,0,0,0,0|4,0,0]=4 326 B15R1.138 COCOCCNC(=O)c1ccncc1 d641ed4d096ea0655e4fd16fcc2bcf7f [0,0,0,0,0,0|4,0,0]=4 327 B15R1.138 COCOCCOC(=O)c1ccccc1 f4a679da22e4b424f7edd7a794ac0f13 [0,0,0,0,0,0|2,0,0]=2 328 B15R1.138 COCOCCOC(=O)c1cccnc1 b3f3d227ef6aaf3ede4c5867d67ebc9f [0,0,0,0,0,0|3,0,0]=3 329 B15R1.138 COCOCCOC(C)c1ccccc1 6e609ae93b6842f720c3182048953278 [0,0,0,0,0,0|3,0,1]=4 330 B15R1.138 COCOCCO[C@@H](C)c1ccccc1 3a5675cf727f488c56d15d0dcdd185f0 [0,0,0,0,0,0|3,0,1]=4 331 B15R1.138 COCOCCO[C@H](C)c1ccccc1 01c5870a134f63e4cf664dbbdc44df5b [0,0,0,0,0,0|3,0,1]=4 332 B15R1.138 CSCCCCNC(=O)c1ccccc1 038aa4a35bc6f2c051b91cfefe8d070e [0,0,0,0,0,0|2,0,0]=2 333 B15R1.138 CSCCCCNC(=O)c1ccccn1 03c75f530854bdb4c45fe6741199aa10 [0,0,0,0,0,0|3,0,0]=3 334 B15R1.138 CSCCCCNC(=O)c1cccnc1 95c7557ce357eafdafff4f8ed9cb6e95 [0,0,0,0,0,0|3,0,0]=3 335 B15R1.138 CSCCCCNC(=O)c1cccnn1 12779ed807523560b2a4738b5964d0ba [0,0,0,0,0,0|4,0,0]=4 336 B15R1.138 CSCCCCNC(=O)c1ccncc1 1bb021b982ba9ed5f82efb4688052989 [0,0,0,0,0,0|3,0,0]=3 337 B15R1.138 CSCCCCNC(=O)c1ccncn1 c91f9ca1383984acce2e53e28957bd4c [0,0,0,0,0,0|4,0,0]=4 338 B15R1.138 CSCCCCNC(=O)c1ccnnc1 53af0313791d6cb7aa14123c03325bad [0,0,0,0,0,0|4,0,0]=4 339 B15R1.138 CSCCCCNC(=O)c1cnccn1 724a709cdb115c7ea54e070e4d26ac72 [0,0,0,0,0,0|4,0,0]=4 340 B15R1.138 CSCCCCNC(=O)c1cncnc1 f1c8a9ada943b7e82250353b3933368d [0,0,0,0,0,0|4,0,0]=4 341 B15R1.138 CSCCCCNC(=O)c1ncccn1 36d651f0da7960a541425a021c3cc2f4 [0,0,0,0,0,0|4,0,0]=4 342 B15R1.138 CSCCCNCC(=O)c1ccccc1 89964387a0482a912f3f166b93d649cf [0,0,0,0,0,0|3,0,0]=3 343 B15R1.138 CSCCCNCC(=O)c1ccccn1 f1dfd28629b397a9b8091c97b3a9660a [0,0,0,0,0,0|4,0,0]=4 344 B15R1.138 CSCCCNCC(=O)c1cccnc1 1b23857f8223088cf5ba51d354eb5500 [0,0,0,0,0,0|4,0,0]=4 345 B15R1.138 CSCCCOCC(=O)c1ccccc1 edacd2be2e784fb5b2c2f16a2fde8126 [0,0,0,0,0,0|3,0,0]=3 346 B15R1.138 CSCCCOCC(=O)c1ccccn1 df46fa3aa0527183f4bbbca0bf61dfa3 [0,0,0,0,0,0|4,0,0]=4 347 B15R1.138 CSCCCOCC(=O)c1cccnc1 e3bb1adab4357afc71d9c8c5e585ec4b [0,0,0,0,0,0|4,0,0]=4 348 B15R1.138 CSCCNCOC(=O)c1ccccc1 7d1bc58fcf38f2a181f15443ebd6e718 [0,0,0,0,0,0|2,0,0]=2 349 B15R1.138 CSCCOCCC(=O)c1ccccc1 2297bbe5dc1ae6c01e878c3bfb162047 [0,0,0,0,0,0|3,0,0]=3 350 B15R1.138 CSCCOCCS(=O)c1ccccc1 dfb2e7eb3a7c6a46a174fe1ab97b8a3c [0,0,0,0,0,0|4,0,0]=4 351 B15R1.138 CSCCOCNC(=O)c1ccccc1 571b34c0d362ffc6ac8e0970d90fa62a [0,0,0,0,0,0|3,0,0]=3 352 B15R1.138 CSCCOCNC(=O)c1cccnc1 020822cc65bc362a31c0cc1c55767b4d [0,0,0,0,0,0|4,0,0]=4 353 B15R1.138 CSCCOCOC(=O)c1ccccc1 8a1700e76403d3193c9fc8531bccd013 [0,0,0,0,0,0|2,0,0]=2 354 B15R1.138 CSCNCCNC(=O)c1ccncc1 b0042ff1f2b86d9ffc1a18282e518755 [0,0,0,0,0,0|4,0,0]=4 355 B15R1.138 CSCOCCCC(=O)c1ccccc1 1c7339858586ca28fedbe404607dbae5 [0,0,0,0,0,0|3,0,0]=3 356 B15R1.138 CSCOCCCC(=O)c1cccnc1 b3a62fa1340ca41db5399871be93b840 [0,0,0,0,0,0|4,0,0]=4 357 B15R1.138 CSCOCCNC(=O)c1ccccc1 8d0bc58077282256c0937c8b62274705 [0,0,0,0,0,0|3,0,0]=3 358 B15R1.138 CSCOCCNC(=O)c1ccccn1 33de7ffebeb23b630c8a6cd8f1fa46e1 [0,0,0,0,0,0|4,0,0]=4 359 B15R1.138 CSCOCCNC(=O)c1cccnc1 4ed961361b3bc3caf94a2a385e3ce749 [0,0,0,0,0,0|4,0,0]=4 360 B15R1.138 CSCOCCNC(=O)c1ccncc1 6630985d69f6fb156828c4bec0c7fc0e [0,0,0,0,0,0|4,0,0]=4 361 B15R1.138 CSCOCCOC(=O)c1ccccc1 4de07fe10ac45783a6ddccc42a847b49 [0,0,0,0,0,0|2,0,0]=2 362 B15R1.138 CSCOCCOC(=O)c1cccnc1 5f1342500b3f9c756545b203e2a888f1 [0,0,0,0,0,0|3,0,0]=3 363 B15R1.138 C[C@@H](NCCCCCF)c1ccccc1 c4861c0980661ac0482949c4ebb21643 [0,0,0,0,0,0|3,0,1]=4 364 B15R1.138 C[C@@H](OCCCCC#N)c1ccccc1 95d942a32c1917508a2e77726c8ff77f [0,0,0,0,0,0|2,0,2]=4 365 B15R1.138 C[C@@H](OCCCCC=O)c1ccccc1 128b69c9c8a46a35d7fcf55a11ad31c8 [0,0,0,0,0,0|2,0,2]=4 366 B15R1.138 C[C@@H](OCCCCCF)c1ccccc1 bfa2380681a9b9fcba865ef1f0db413f [0,0,0,0,0,0|2,0,1]=3 367 B15R1.138 C[C@@H](OCCCCCF)c1ccccn1 186c5ce360f0f496e70b5f50bc6eb692 [0,0,0,0,0,0|3,0,1]=4 368 B15R1.138 C[C@@H](OCCCCCF)c1cccnc1 b8325ae1232ceefbf6cfcd11507cd189 [0,0,0,0,0,0|3,0,1]=4 369 B15R1.138 C[C@@H](OCCCCCF)c1ccncc1 a9c8757ac7e09e7dedd0ce2b4e84fc9a [0,0,0,0,0,0|3,0,1]=4 370 B15R1.138 C[C@@H](OCCOCCF)c1ccccc1 23ff9827f59a62414d708fc0975ecf97 [0,0,0,0,0,0|3,0,1]=4 371 B15R1.138 C[C@@H](OCCOCCS)c1ccccc1 ec6c098bcf0a3d34cd2905861e60fa5e [0,0,0,0,0,0|3,0,1]=4 372 B15R1.138 C[C@H](NCCCCCF)c1ccccc1 9dc447815c1be0df44492e04d9466ec4 [0,0,0,0,0,0|3,0,1]=4 373 B15R1.138 C[C@H](OCCCCC#N)c1ccccc1 ece65c96f1828ecbdd7ad5b8e2f46712 [0,0,0,0,0,0|2,0,2]=4 374 B15R1.138 C[C@H](OCCCCC=O)c1ccccc1 e05126d80e39486687f8a324b9dc42b7 [0,0,0,0,0,0|2,0,2]=4 375 B15R1.138 C[C@H](OCCCCCF)c1ccccc1 f7b66b9730bf979e698f65d01b397d2f [0,0,0,0,0,0|2,0,1]=3 376 B15R1.138 C[C@H](OCCCCCF)c1ccccn1 5a8ddc127877587c3bf97eeb55452a7c [0,0,0,0,0,0|3,0,1]=4 377 B15R1.138 C[C@H](OCCCCCF)c1cccnc1 07041dc20da59fb6a78d21006ac97426 [0,0,0,0,0,0|3,0,1]=4 378 B15R1.138 C[C@H](OCCCCCF)c1ccncc1 fb6831b360ca887ed70066c5cd2747d2 [0,0,0,0,0,0|3,0,1]=4 379 B15R1.138 C[C@H](OCCOCCF)c1ccccc1 eab07b7894d52c3443584997f78d38cc [0,0,0,0,0,0|3,0,1]=4 380 B15R1.138 C[C@H](OCCOCCS)c1ccccc1 f73b7ecf4f6d787776fba7dd8a581bd7 [0,0,0,0,0,0|3,0,1]=4 381 B15R1.138 N#CCCCCNC(=O)c1ccccc1 3f3fcae47bf0365cab44b1fa20198378 [0,0,0,0,0,0|2,0,1]=3 382 B15R1.138 N#CCCCCNC(=O)c1ccccn1 eceba6a7ec426640b43996d028810e81 [0,0,0,0,0,0|3,0,1]=4 383 B15R1.138 N#CCCCCNC(=O)c1cccnc1 4e3e3ff9177ec52c67cd24f27bc709fb [0,0,0,0,0,0|3,0,1]=4 384 B15R1.138 N#CCCCCNC(=O)c1ccncc1 b803977e4ad65dea6bfc4485cf9053d3 [0,0,0,0,0,0|3,0,1]=4 385 B15R1.138 N#CCCCNCC(=O)c1ccccc1 272882ff5dbaf14c92622e56b5a2bfa4 [0,0,0,0,0,0|3,0,1]=4 386 B15R1.138 N#CCCCOCC(=O)c1ccccc1 e99abe91eef2a89f9067d6cb16a8f977 [0,0,0,0,0,0|3,0,1]=4 387 B15R1.138 N#CCCNCOC(=O)c1ccccc1 1743f70604685cc5c18618ccc977e5b2 [0,0,0,0,0,0|2,0,1]=3 388 B15R1.138 N#CCCOCCC(=O)c1ccccc1 dccb99e2fa4792b73409716e18ba0eca [0,0,0,0,0,0|3,0,1]=4 389 B15R1.138 N#CCCOCNC(=O)c1ccccc1 91706d10f4faa925a8e18415d4d09757 [0,0,0,0,0,0|3,0,1]=4 390 B15R1.138 N#CCCOCOC(=O)c1ccccc1 1484c0fb2770d57905c6d32c1fa84c00 [0,0,0,0,0,0|2,0,1]=3 391 B15R1.138 N#CCNCCOC(=O)c1ccccc1 8d2f012946e3cbba92d0a2712d9653f3 [0,0,0,0,0,0|2,0,1]=3 392 B15R1.138 N#CCOCCCC(=O)c1ccccc1 330f2e8660a424f9a5bb25a51e032599 [0,0,0,0,0,0|3,0,1]=4 393 B15R1.138 N#CCOCCNC(=O)c1ccccc1 de0a609c33d0da8547590d4ebb4736fc [0,0,0,0,0,0|3,0,1]=4 394 B15R1.138 N#CCOCCOC(=O)c1ccccc1 4d09fdf862847768d3cf48edd5bfd05c [0,0,0,0,0,0|2,0,1]=3 395 B15R1.138 N#CCOCCOC(=O)c1cccnc1 73e8a92fea1b3d2bf0dfe5c7454d7ff1 [0,0,0,0,0,0|3,0,1]=4 396 B15R1.138 NOCCNCOC(=O)c1ccccc1 6be9c9cc395a2b9a30961d34afee9f83 [0,0,0,0,0,0|3,0,0]=3 397 B15R1.138 O=C(CCCOCCF)c1ccccc1 d976196113730614a10f899e2222a8aa [0,0,0,0,0,0|3,0,0]=3 398 B15R1.138 O=C(CCCOCCF)c1cccnc1 34c84ef392a52d4f56a9a46d89a0eb26 [0,0,0,0,0,0|4,0,0]=4 399 B15R1.138 O=C(CCCOCCS)c1ccccc1 620981a86e826c1c1de9999a2d5869a7 [0,0,0,0,0,0|3,0,0]=3 400 B15R1.138 O=C(CCCOCCS)c1cccnc1 2695bac0f0f8b9323b5130bf4cf16303 [0,0,0,0,0,0|4,0,0]=4 401 B15R1.138 O=C(CCOCCCF)c1ccccc1 bccb8f12faba38899c768f64a974dd2c [0,0,0,0,0,0|3,0,0]=3 402 B15R1.138 O=C(CCOCCCS)c1ccccc1 4665b348bb159ca6f036ece9ee167314 [0,0,0,0,0,0|3,0,0]=3 403 B15R1.138 O=C(CNCCCCCl)c1ccccc1 74d69838607531804734eb10bbacd3fe [0,0,0,0,0,0|3,0,0]=3 404 B15R1.138 O=C(CNCCCCCl)c1ccccn1 88ef033c2d61b559155b07ee8995b5f4 [0,0,0,0,0,0|4,0,0]=4 405 B15R1.138 O=C(CNCCCCCl)c1cccnc1 f4e847910cb7c1439a5a097ab6dd7755 [0,0,0,0,0,0|4,0,0]=4 406 B15R1.138 O=C(CNCCCCF)c1ccccc1 5ec24301c21141ec9c66a04323aae8ff [0,0,0,0,0,0|3,0,0]=3 407 B15R1.138 O=C(CNCCCCO)c1ccccc1 496d6057743a4cdc010de1b9ffe5830c [0,0,0,0,0,0|3,0,0]=3 408 B15R1.138 O=C(CNCCCCO)c1ccccn1 797e300ba5e7a02a649b3442a51f7abb [0,0,0,0,0,0|4,0,0]=4 409 B15R1.138 O=C(CNCCCCO)c1cccnc1 5f146aa61c1f5fcf55b0a3b4954154ac [0,0,0,0,0,0|4,0,0]=4 410 B15R1.138 O=C(CNCCCCS)c1ccccc1 ba010e73c7f31927e3eb3702315e5d8d [0,0,0,0,0,0|3,0,0]=3 411 B15R1.138 O=C(CNCCCCS)c1ccccn1 95bf85b0d9f913b381edc2b9ef2a752e [0,0,0,0,0,0|4,0,0]=4 412 B15R1.138 O=C(CNCCCCS)c1cccnc1 69c794b473a6584368d140f19ddaa1c0 [0,0,0,0,0,0|4,0,0]=4 413 B15R1.138 O=C(COCCCCF)c1ccccc1 47d1aee4146eae0b012ee683ce53e6a7 [0,0,0,0,0,0|3,0,0]=3 414 B15R1.138 O=C(COCCCCF)c1ccccn1 e08b2a804636300b4032ebdb3957aa48 [0,0,0,0,0,0|4,0,0]=4 415 B15R1.138 O=C(COCCCCF)c1cccnc1 c3822758bc078f24f35674cdfc0460c3 [0,0,0,0,0,0|4,0,0]=4 416 B15R1.138 O=C(COCCCCS)c1ccccc1 890f06d14d6583348372c4ef1b6d6165 [0,0,0,0,0,0|3,0,0]=3 417 B15R1.138 O=C(COCCCCS)c1ccccn1 3dcc41747bd0f68175295fdb55e1ae2a [0,0,0,0,0,0|4,0,0]=4 418 B15R1.138 O=C(COCCCCS)c1cccnc1 bf84c46832bff91c37566df48b076a99 [0,0,0,0,0,0|4,0,0]=4 419 B15R1.138 O=C(NCCCCCCl)c1ccccc1 a85f8f6bb4ea95f92087b55c043e2b22 [0,0,0,0,0,0|2,0,0]=2 420 B15R1.138 O=C(NCCCCCCl)c1ccccn1 075bf9e9dbbb96d262b71a81c782f791 [0,0,0,0,0,0|3,0,0]=3 421 B15R1.138 O=C(NCCCCCCl)c1cccnc1 b6f4d3dbb4090af40c7ab3a16360642a [0,0,0,0,0,0|3,0,0]=3 422 B15R1.138 O=C(NCCCCCCl)c1cccnn1 7dddfe23773a4f05612196399c472b3d [0,0,0,0,0,0|4,0,0]=4 423 B15R1.138 O=C(NCCCCCCl)c1ccncc1 7d37394542d52e52f5a5bba55a10a075 [0,0,0,0,0,0|3,0,0]=3 424 B15R1.138 O=C(NCCCCCCl)c1ccncn1 5a6af3cfd60664651cfe4b8e806a12d4 [0,0,0,0,0,0|4,0,0]=4 425 B15R1.138 O=C(NCCCCCCl)c1ccnnc1 93b9c2aa2be9f4e41fb0612a3811c011 [0,0,0,0,0,0|4,0,0]=4 426 B15R1.138 O=C(NCCCCCCl)c1cnccn1 030ee522abb93cecb8c064d941234948 [0,0,0,0,0,0|4,0,0]=4 427 B15R1.138 O=C(NCCCCCCl)c1cncnc1 729ce4fffa4ca91b1837ac796df664cb [0,0,0,0,0,0|4,0,0]=4 428 B15R1.138 O=C(NCCCCCCl)c1ncccn1 850c8bf478c11fda22adbd6815fd265b [0,0,0,0,0,0|4,0,0]=4 429 B15R1.138 O=C(NCCCCCO)c1ccccc1 2f84a8c575e6c26c6ad5c703c3a46ba4 [0,0,0,0,0,0|2,0,0]=2 430 B15R1.138 O=C(NCCCCCO)c1ccccn1 e88aa40183630c87fe04b434e8addb1e [0,0,0,0,0,0|3,0,0]=3 431 B15R1.138 O=C(NCCCCCO)c1cccnc1 532c28a59522382d41bd4f9c03aaeb64 [0,0,0,0,0,0|3,0,0]=3 432 B15R1.138 O=C(NCCCCCO)c1cccnn1 9858d07c1fb9a5d8da184348aaacb3ae [0,0,0,0,0,0|4,0,0]=4 433 B15R1.138 O=C(NCCCCCO)c1ccncc1 72414c5585d53045edad8ed6bea2e496 [0,0,0,0,0,0|3,0,0]=3 434 B15R1.138 O=C(NCCCCCO)c1ccncn1 200ea9ff977b5c8d3c78dc67e2dd0c3a [0,0,0,0,0,0|4,0,0]=4 435 B15R1.138 O=C(NCCCCCO)c1ccnnc1 99357c6a26c93b2dd16d8aa4a54c3e7e [0,0,0,0,0,0|4,0,0]=4 436 B15R1.138 O=C(NCCCCCO)c1cnccn1 deb76ba51146188af2cafc940c2f17ed [0,0,0,0,0,0|4,0,0]=4 437 B15R1.138 O=C(NCCCCCO)c1cncnc1 258cc1da6fbec15fe91d1590e4f41b92 [0,0,0,0,0,0|4,0,0]=4 438 B15R1.138 O=C(NCCCCCO)c1ncccn1 3d1d3316493087b163d5cc802b9f1c60 [0,0,0,0,0,0|4,0,0]=4 439 B15R1.138 O=C(NCCCOCF)c1ccccc1 54ab1f955249732e4371e5f2fb041ae1 [0,0,0,0,0,0|3,0,0]=3 440 B15R1.138 O=C(NCCNCCBr)c1ccccn1 57d64e1a73a94e31eb6164ed90cc9d6e [0,0,0,0,0,0|4,0,0]=4 441 B15R1.138 O=C(NCCNCCF)c1ccccn1 9f8a1e40ebe7b8da188ba6ec97db6ffe [0,0,0,0,0,0|4,0,0]=4 442 B15R1.138 O=C(NCCNCCF)c1ccncc1 882643eeea076909e10c78b951319ee1 [0,0,0,0,0,0|4,0,0]=4 443 B15R1.138 O=C(NCCNCCI)c1ccccc1 db30891ab98048c29aa965bb2633908a [0,0,0,0,0,0|3,0,0]=3 444 B15R1.138 O=C(NCCNCCI)c1ccccn1 ee34ff806eef5261ccd81b9c009662aa [0,0,0,0,0,0|4,0,0]=4 445 B15R1.138 O=C(NCCNCCO)c1ccccc1 3e607f8b33763d4fdd65002a9ede761d [0,0,0,0,0,0|3,0,0]=3 446 B15R1.138 O=C(NCCNCCO)c1ccccn1 e6dc75d916a882886cfe64a0f750db53 [0,0,0,0,0,0|4,0,0]=4 447 B15R1.138 O=C(NCCNCCO)c1ccncc1 d31c696747d9dbbd1a8431e24872f8fa [0,0,0,0,0,0|4,0,0]=4 448 B15R1.138 O=C(NCCNCCS)c1ccccc1 6bd9020d9aa10b14b3adba0b38bd275a [0,0,0,0,0,0|3,0,0]=3 449 B15R1.138 O=C(NCCNCCS)c1ccccn1 bc715e06575dc53dfd1498ccb7650163 [0,0,0,0,0,0|4,0,0]=4 450 B15R1.138 O=C(NCCNCCS)c1ccncc1 60bb472bf5f9a84172481434d81976e0 [0,0,0,0,0,0|4,0,0]=4 451 B15R1.138 O=C(NCCOCCF)c1ccccc1 e0f5658fad9888b3b68f3d361ffd2e4b [0,0,0,0,0,0|3,0,0]=3 452 B15R1.138 O=C(NCCOCCF)c1ccccn1 ee3264616b5c99b8eb73854c534fbb2c [0,0,0,0,0,0|4,0,0]=4 453 B15R1.138 O=C(NCCOCCF)c1cccnc1 10c0518b8e7cbeb9f8d2bc67f8f61141 [0,0,0,0,0,0|4,0,0]=4 454 B15R1.138 O=C(NCCOCCF)c1ccncc1 2497f79fc23b7497b585954ff89c1f73 [0,0,0,0,0,0|4,0,0]=4 455 B15R1.138 O=C(NCCOCCO)c1ccccc1 d73ba41f944839ccf3b08da68ef66b82 [0,0,0,0,0,0|3,0,0]=3 456 B15R1.138 O=C(NCCOCCO)c1ccccn1 79c75d3d1150ada32cb3ae5c55e15ba2 [0,0,0,0,0,0|4,0,0]=4 457 B15R1.138 O=C(NCCOCCO)c1cccnc1 cc26e0dc63e9428cec7ecc93f3b01292 [0,0,0,0,0,0|4,0,0]=4 458 B15R1.138 O=C(NCCOCCO)c1ccncc1 065683c43f50a45169b23ec09d5e984b [0,0,0,0,0,0|4,0,0]=4 459 B15R1.138 O=C(NCCOCCS)c1ccccc1 b39a8bc9212f6a2ff8897ce318937e9e [0,0,0,0,0,0|3,0,0]=3 460 B15R1.138 O=C(NCCOCCS)c1ccccn1 d4e09839e479e4c822343f8bc1e9e8bb [0,0,0,0,0,0|4,0,0]=4 461 B15R1.138 O=C(NCCOCCS)c1cccnc1 5489f2c617b2bf4d0de53aca2935f6df [0,0,0,0,0,0|4,0,0]=4 462 B15R1.138 O=C(NCCOCCS)c1ccncc1 277054e20759583c4034cb55e045c356 [0,0,0,0,0,0|4,0,0]=4 463 B15R1.138 O=C(NCCSCCO)c1ccccc1 8bf9eabd9e9347ecbdf5f63d4241b0ec [0,0,0,0,0,0|3,0,0]=3 464 B15R1.138 O=C(NCCSCCO)c1ccccn1 71764edf2a91e2ca4453981193682f26 [0,0,0,0,0,0|4,0,0]=4 465 B15R1.138 O=C(NCCSCCO)c1cccnc1 e6f1bc9eac785693bdd4fe2fcb1e2ec4 [0,0,0,0,0,0|4,0,0]=4 466 B15R1.138 O=C(NCCSCCO)c1ccncc1 0a062b87dc16771e10efa2f98242d2ea [0,0,0,0,0,0|4,0,0]=4 467 B15R1.138 O=C(NCOCCCF)c1ccccc1 be1436561a5f9a2db87ea16a6f383144 [0,0,0,0,0,0|3,0,0]=3 468 B15R1.138 O=C(NCOCCCF)c1cccnc1 7fef654a243161067e61c3e146417bfc [0,0,0,0,0,0|4,0,0]=4 469 B15R1.138 O=C(NCOCCCS)c1ccccc1 d610b3c422554a67a6ef68ae6082030a [0,0,0,0,0,0|3,0,0]=3 470 B15R1.138 O=C(NCOCCCS)c1cccnc1 14ba4186c0f04de19f54f3bc5bc67022 [0,0,0,0,0,0|4,0,0]=4 471 B15R1.138 O=C(OCCNCCBr)c1ccccc1 13fac959b136443ce53a5128bf815cf4 [0,0,0,0,0,0|2,0,0]=2 472 B15R1.138 O=C(OCCNCCF)c1ccccc1 75e6ecc021d530123b4292722ecfefde [0,0,0,0,0,0|2,0,0]=2 473 B15R1.138 O=C(OCCNCCI)c1ccccc1 30617c90424fe21dbb86da3f5f493d42 [0,0,0,0,0,0|2,0,0]=2 474 B15R1.138 O=C(OCCNCCO)c1ccccc1 8cf1a0a201572ce97431de1f5b43935e [0,0,0,0,0,0|2,0,0]=2 475 B15R1.138 O=C(OCCNCCS)c1ccccc1 f7cd7f0763c9b980ee4fe152280ec36b [0,0,0,0,0,0|2,0,0]=2 476 B15R1.138 O=C(OCCOCCF)c1ccccc1 e8acababa849e7de547f016a743564e5 [0,0,0,0,0,0|2,0,0]=2 477 B15R1.138 O=C(OCCOCCF)c1cccnc1 959b1e12aff3b163704870eeb4fe090b [0,0,0,0,0,0|3,0,0]=3 478 B15R1.138 O=C(OCCOCCS)c1ccccc1 e5f085fcd1f1ccb14a4a8d1ff7269296 [0,0,0,0,0,0|2,0,0]=2 479 B15R1.138 O=C(OCCOCCS)c1cccnc1 c28d6137307f5fa090011be0921cc5b5 [0,0,0,0,0,0|3,0,0]=3 480 B15R1.138 O=C(OCNCCCCl)c1ccccc1 d325bb2f6d37dc9a6223d959349bfeea [0,0,0,0,0,0|2,0,0]=2 481 B15R1.138 O=C(OCNCCCO)c1ccccc1 6bb1be05c1c3dd7584d65adb10b8a162 [0,0,0,0,0,0|2,0,0]=2 482 B15R1.138 O=C(OCOC/C=C/Cl)c1ccccc1 7f30064109e6e50ae7813b185afdc22b [0,0,0,0,0,0|2,0,2]=4 483 B15R1.138 O=C(OCOCC#CI)c1ccccc1 d04d9917ef771576cb628146b198abd8 [0,0,0,0,0,0|2,0,2]=4 484 B15R1.138 O=C(OCOCC=CCl)c1ccccc1 6930004102d6c7360108324fc57ba1f5 [0,0,0,0,0,0|2,0,2]=4 485 B15R1.138 O=C(OCOCCCF)c1ccccc1 a32a9749b7b302255922d045f8716404 [0,0,0,0,0,0|2,0,0]=2 486 B15R1.138 O=C(OCOCCCS)c1ccccc1 39c7d9c49f52c8dabed103f8ad9efa5e [0,0,0,0,0,0|2,0,0]=2 487 B15R1.138 O=CCCCNCC(=O)c1ccccc1 afbdbef7cc2380e5942e1a24a5d4ec58 [0,0,0,0,0,0|3,0,1]=4 488 B15R1.138 O=CCCCOCC(=O)c1ccccc1 8b1561eeee86066be7ecd2dff65caec4 [0,0,0,0,0,0|3,0,1]=4 489 B15R1.138 O=CCCOCCC(=O)c1ccccc1 280fbff1d5eab2244c3dd8391dbd5d77 [0,0,0,0,0,0|3,0,1]=4 490 B15R1.138 O=CCCOCNC(=O)c1ccccc1 d20ed9708596c31dfae046ab88107e7c [0,0,0,0,0,0|3,0,1]=4 491 B15R1.138 O=CCCOCOC(=O)c1ccccc1 d552736526f99d64a5024cdfe79fd7f8 [0,0,0,0,0,0|2,0,1]=3 492 B15R1.138 O=CCOCCCC(=O)c1ccccc1 3e9c1c85a33337b57fa3e36ebd3716c5 [0,0,0,0,0,0|3,0,1]=4 493 B15R1.138 O=CCOCCNC(=O)c1ccccc1 8cba1f76cacef64ee84300f3b42295d5 [0,0,0,0,0,0|3,0,1]=4 494 B15R1.138 O=CCOCCOC(=O)c1ccccc1 d9e5b8d732f78b625d55210e63487aae [0,0,0,0,0,0|2,0,1]=3 495 B15R1.138 O=CCOCCOC(=O)c1cccnc1 ff53ae74e4fc163e1b657b2684fdbe5a [0,0,0,0,0,0|3,0,1]=4 496 B15R1.138 O=S(CCOCCCF)c1ccccc1 2a0e3aa3adcbb2f8a2e8ebb4d91004a6 [0,0,0,0,0,0|4,0,0]=4 497 B14R1.38 C#CCCCNC(=O)c1ccccc1 e003eefeb25045564589eae60b509892 [1,0,0,0,0,0|1,0,2]=4 498 B14R1.38 C#CCCNCC(=O)c1ccccc1 2ad190f6dcea69778a5d02863f57ae12 [1,0,0,0,0,0|1,0,2]=4 499 B14R1.38 C#CCCOCC(=O)c1ccccc1 72e8764bebe30286349519bbca1d8f0d [1,0,0,0,0,0|1,0,2]=4 500 B14R1.38 C#CCNCOC(=O)c1ccccc1 b78ec5809b7a572432a596009cdb3ca6 [1,0,0,0,0,0|1,0,2]=4 501 B14R1.38 C#CCOCCC(=O)c1ccccc1 2dec97156a1e2099c1451798b8f5261e [1,0,0,0,0,0|1,0,2]=4 502 B14R1.38 C#CCOCOC(=O)c1ccccc1 0e0c3568f1966cb70c054eefdf80d4da [1,0,0,0,0,0|1,0,2]=4 503 B14R1.38 C/C=C/CNCC(=O)c1ccccc1 868b1f3321b97b26b3df0ca31db2eaa4 [1,0,0,0,0,0|1,0,2]=4 504 B14R1.38 C/C=C/COCC(=O)c1ccccc1 1a59ddc8ff28b980c52041161bbe526b [1,0,0,0,0,0|1,0,2]=4 505 B14R1.38 C/C=C\CNCC(=O)c1ccccc1 d12a73fe772963863420cdacbf6023e1 [1,0,0,0,0,0|1,0,2]=4 506 B14R1.38 C/C=C\COCC(=O)c1ccccc1 aa9c534401115c2fa62a3556ab3d621a [1,0,0,0,0,0|1,0,2]=4 507 B14R1.38 C=C(CCOCCC)c1ccncc1 fa741885011f7c4ed9635742c7e99eba [1,0,0,0,0,0|3,0,0]=4 508 B14R1.38 C=C(CNCCCCl)c1ccccc1 9a0c3e7297ddf97507488845aac12b06 [1,0,0,0,0,0|3,0,0]=4 509 B14R1.38 C=C(CNCCCO)c1ccccc1 c5f661808dc0658a6ab9eb8d16fb06b8 [1,0,0,0,0,0|3,0,0]=4 510 B14R1.38 C=C(CNCCOC)c1ccccc1 644cf6f06231d5582ef424a03f004f1d [1,0,0,0,0,0|3,0,0]=4 511 B14R1.38 C=C(CNCCSC)c1ccccc1 3be6c0ff8ad7906568a17738f71d66bc [1,0,0,0,0,0|3,0,0]=4 512 B14R1.38 C=C(COCCCC)c1ccccc1 377aba09b8cc730962c85414fb6cea1a [1,0,0,0,0,0|2,0,0]=3 513 B14R1.38 C=C(COCCCC)c1ccccn1 48389bb1d51f8395de209da66fe5ed17 [1,0,0,0,0,0|3,0,0]=4 514 B14R1.38 C=C(COCCCF)c1ccccc1 f42a05f72677d10f1a93d1a75014642f [1,0,0,0,0,0|3,0,0]=4 515 B14R1.38 C=C(COCCCS)c1ccccc1 e5642989c69142d8736e2009f130731f [1,0,0,0,0,0|3,0,0]=4 516 B14R1.38 C=C(COCCOC)c1ccccc1 1c2d70a1e09a56b4550b1c7df58cbd0e [1,0,0,0,0,0|3,0,0]=4 517 B14R1.38 C=C(COCCSC)c1ccccc1 06289f7bc6de7351743f717301b9f420 [1,0,0,0,0,0|3,0,0]=4 518 B14R1.38 C=CCCCNC(=O)c1ccccc1 d1c350bd58bf6fdeee0bca9acae108cf [1,0,0,0,0,0|1,0,2]=4 519 B14R1.38 C=CCCNCC(=O)c1ccccc1 62a173b45a411799752590f9f45a1f82 [1,0,0,0,0,0|1,0,2]=4 520 B14R1.38 C=CCCOCC(=O)c1ccccc1 d0cdd1dfebd3df726c3b7975aeacf84b [1,0,0,0,0,0|1,0,2]=4 521 B14R1.38 C=CCOCCC(=O)c1ccccc1 519dd6587a376a5f634662bb7c613c98 [1,0,0,0,0,0|1,0,2]=4 522 B14R1.38 CC#CCNCC(=O)c1ccccc1 943b77b71d2c93a375cc6ac595cab920 [1,0,0,0,0,0|1,0,2]=4 523 B14R1.38 CC#CCOCC(=O)c1ccccc1 cf7eb75e2c097526b3d65f7f8c47b006 [1,0,0,0,0,0|1,0,2]=4 524 B14R1.38 CC(OCCCCF)c1ccccc1 c02b9084f23debfb091e19ad82bbbd16 [1,0,0,0,0,0|2,0,1]=4 525 B14R1.38 CC=CCNCC(=O)c1ccccc1 5acf972eec424942d8b5ab8f24076809 [1,0,0,0,0,0|1,0,2]=4 526 B14R1.38 CC=CCOCC(=O)c1ccccc1 c0ee39e63fada1d31cd7931879b3dd2e [1,0,0,0,0,0|1,0,2]=4 527 B14R1.38 CCCCCCN(C)c1ccccc1 92b4692fad224cde5cdbd1bb87364ead [1,0,0,0,0,0|2,0,0]=3 528 B14R1.38 CCCCCCN(C)c1cccnc1 47c04c2931e54865fcf2de56c2cf6b5b [1,0,0,0,0,0|3,0,0]=4 529 B14R1.38 CCCCCNC(=O)c1ccccc1 340b722c7d86ddfbd029d7d4b12b4957 [1,0,0,0,0,0|1,0,0]=2 530 B14R1.38 CCCCCNC(=O)c1ccccn1 9d42f6feb08118dc76b96b769ddf0e13 [1,0,0,0,0,0|2,0,0]=3 531 B14R1.38 CCCCCNC(=O)c1cccnc1 c2733276d9faf9e32f86e32eb1099f50 [1,0,0,0,0,0|2,0,0]=3 532 B14R1.38 CCCCCNC(=O)c1cccnn1 7efba9fc0fed5be44245a5630d29b273 [1,0,0,0,0,0|3,0,0]=4 533 B14R1.38 CCCCCNC(=O)c1ccncc1 0bb710ac04a09cf857c22068cbf825f1 [1,0,0,0,0,0|2,0,0]=3 534 B14R1.38 CCCCCNC(=O)c1ccncn1 346faa989bb3d2f952fda4f1c526191c [1,0,0,0,0,0|3,0,0]=4 535 B14R1.38 CCCCCNC(=O)c1ccnnc1 6ce824eec11577557539ce29b7bc274f [1,0,0,0,0,0|3,0,0]=4 536 B14R1.38 CCCCCNC(=O)c1cnccn1 20033ced8fd6d7034187b07910c54930 [1,0,0,0,0,0|3,0,0]=4 537 B14R1.38 CCCCCNC(=O)c1cncnc1 c5d4b6ae6e6112dac4009139ed2fb01c [1,0,0,0,0,0|3,0,0]=4 538 B14R1.38 CCCCCNC(=O)c1ncccn1 aa9c19856c436f6ce76e7c1a790874c2 [1,0,0,0,0,0|3,0,0]=4 539 B14R1.38 CCCCCNC(C)c1ccccc1 de784c697e3da52995dde5d0e1b761fc [1,0,0,0,0,0|2,0,1]=4 540 B14R1.38 CCCCCN[C@@H](C)c1ccccc1 45c8f296ed76b6152c9255fe1403415f [1,0,0,0,0,0|2,0,1]=4 541 B14R1.38 CCCCCN[C@H](C)c1ccccc1 ed752a6e6f183154f5bbdf7b293d5d48 [1,0,0,0,0,0|2,0,1]=4 542 B14R1.38 CCCCCOC(C)c1ccccc1 2bbc28e62ca2b340cad5230b812c5843 [1,0,0,0,0,0|1,0,1]=3 543 B14R1.38 CCCCCOC(C)c1ccccn1 58edee58f5c0de789c8d29204d967e55 [1,0,0,0,0,0|2,0,1]=4 544 B14R1.38 CCCCCOC(C)c1cccnc1 8a038cc6bc239e163713f13b2ac30298 [1,0,0,0,0,0|2,0,1]=4 545 B14R1.38 CCCCCOC(C)c1ccncc1 77721e79b88869b3e3e45807ed223a59 [1,0,0,0,0,0|2,0,1]=4 546 B14R1.38 CCCCCO[C@@H](C)c1ccccc1 e65998a2c4c0199d974622c4f9ba0ffa [1,0,0,0,0,0|1,0,1]=3 547 B14R1.38 CCCCCO[C@@H](C)c1ccccn1 2effe978a6700a2ebb15c6719ad96048 [1,0,0,0,0,0|2,0,1]=4 548 B14R1.38 CCCCCO[C@@H](C)c1cccnc1 f38e5d0b7ceb8530393b0aaba9d64e03 [1,0,0,0,0,0|2,0,1]=4 549 B14R1.38 CCCCCO[C@@H](C)c1ccncc1 e45e5979e51db9ce575eeef166ce332e [1,0,0,0,0,0|2,0,1]=4 550 B14R1.38 CCCCCO[C@H](C)c1ccccc1 c0ce706b6f7357d547b24c27aad6a2c7 [1,0,0,0,0,0|1,0,1]=3 551 B14R1.38 CCCCCO[C@H](C)c1ccccn1 e528dc0323e8cdab1cf84e6b82670ebd [1,0,0,0,0,0|2,0,1]=4 552 B14R1.38 CCCCCO[C@H](C)c1cccnc1 f1f55473901c98444758cc3ac62d1710 [1,0,0,0,0,0|2,0,1]=4 553 B14R1.38 CCCCCO[C@H](C)c1ccncc1 dd5d17dcd381eda46058ad10d290b57b [1,0,0,0,0,0|2,0,1]=4 554 B14R1.38 CCCCNCC(=O)c1ccccc1 df2c3370904b266b7fadb1c30ef2424a [1,0,0,0,0,0|1,0,0]=2 555 B14R1.38 CCCCNCC(=O)c1ccccn1 a7df5453bc9faf605b244e6686922b45 [1,0,0,0,0,0|2,0,0]=3 556 B14R1.38 CCCCNCC(=O)c1cccnc1 5507ddd59c70e6bb563a0e24008ef30d [1,0,0,0,0,0|2,0,0]=3 557 B14R1.38 CCCCNCC(=O)c1ccncn1 f02ac423702b3da601a489cb4264d9d9 [1,0,0,0,0,0|3,0,0]=4 558 B14R1.38 CCCCNCC(=O)c1cnccn1 9931819e25ba1836a7611ec9cdf67351 [1,0,0,0,0,0|3,0,0]=4 559 B14R1.38 CCCCNCC(C)c1ccccc1 cfa609dee845e0356199bb1c31e52484 [1,0,0,0,0,0|2,0,1]=4 560 B14R1.38 CCCCNCC(F)c1ccccc1 f922d874e92f88510543fb4f9aef7213 [1,0,0,0,0,0|2,0,1]=4 561 B14R1.38 CCCCNCC(O)c1ccccc1 5020ed9db8eb324e10664856874df2a3 [1,0,0,0,0,0|1,0,2]=4 562 B14R1.38 CCCCNC[C@@H](C)c1ccccc1 2a74cfffb342a19042f4589a5d211fd9 [1,0,0,0,0,0|2,0,1]=4 563 B14R1.38 CCCCNC[C@@H](O)c1ccccc1 b5339fd99b12f0a94c1877650e398da1 [1,0,0,0,0,0|1,0,2]=4 564 B14R1.38 CCCCNC[C@H](C)c1ccccc1 c970c03b64defe0043b00b26d3a8cb5c [1,0,0,0,0,0|2,0,1]=4 565 B14R1.38 CCCCNC[C@H](O)c1ccccc1 7a874363217635c5aae8e9e7f051ba74 [1,0,0,0,0,0|1,0,2]=4 566 B14R1.38 CCCCOCC(=O)c1ccccc1 2c74b78903a5c534445e054c80395b71 [1,0,0,0,0,0|1,0,0]=2 567 B14R1.38 CCCCOCC(=O)c1ccccn1 629160b08c9f13ab14aa0eeee3c8f48b [1,0,0,0,0,0|2,0,0]=3 568 B14R1.38 CCCCOCC(=O)c1cccnc1 94a5e677f13fc55ef68c5428087a94cc [1,0,0,0,0,0|2,0,0]=3 569 B14R1.38 CCCCOCC(=O)c1ccncn1 04e81921d17d395f49d80a61b8cc4596 [1,0,0,0,0,0|3,0,0]=4 570 B14R1.38 CCCCOCC(=O)c1cnccn1 fbf70063120a7cefbbb2b0beff7e3a13 [1,0,0,0,0,0|3,0,0]=4 571 B14R1.38 CCCCOCC(C)c1ccccc1 ec7b90d2817557257261fa49031ce5e3 [1,0,0,0,0,0|2,0,1]=4 572 B14R1.38 CCCCOCC(F)c1ccccc1 144ebe4a98390b7d76eb6d08a8859b5f [1,0,0,0,0,0|2,0,1]=4 573 B14R1.38 CCCCOCN(C)c1ccccc1 34b5f540d100fecd11b78646d9e592e8 [1,0,0,0,0,0|3,0,0]=4 574 B14R1.38 CCCCOC[C@@H](C)c1ccccc1 b0d552e7f4d73398356282666bc79e63 [1,0,0,0,0,0|2,0,1]=4 575 B14R1.38 CCCCOC[C@H](C)c1ccccc1 0888f051f647f10932628db2ecacdd33 [1,0,0,0,0,0|2,0,1]=4 576 B14R1.38 CCCNCCC(C)c1ccccc1 04434b45a6fe8c63dc981c451a498094 [1,0,0,0,0,0|2,0,1]=4 577 B14R1.38 CCCNCCC(O)c1ccccc1 5d7165ef64b6138df3625d1a2a6dee98 [1,0,0,0,0,0|1,0,2]=4 578 B14R1.38 CCCNCCN(C)c1ccccc1 0b6762abf764c7e50c079006fbbb699e [1,0,0,0,0,0|3,0,0]=4 579 B14R1.38 CCCNCC[C@@H](O)c1ccccc1 b211e58abd93318bd6a0379665d19ff8 [1,0,0,0,0,0|1,0,2]=4 580 B14R1.38 CCCNCC[C@H](O)c1ccccc1 3616d015f4c0057e71344f7f912d75a3 [1,0,0,0,0,0|1,0,2]=4 581 B14R1.38 CCCNCOC(=O)c1ccccc1 980b795eba9d0ea7bd3eda8ef41884cb [1,0,0,0,0,0|1,0,0]=2 582 B14R1.38 CCCOCCC(=O)c1ccccc1 87be133495879180154a28bb6d454dc9 [1,0,0,0,0,0|1,0,0]=2 583 B14R1.38 CCCOCCC(C)c1ccccc1 3c46a9bdc2bb9c0669df5ccd976c8af2 [1,0,0,0,0,0|2,0,1]=4 584 B14R1.38 CCCOCCN(C)c1ccccc1 43a723bda9d6c883d7df41fe7b0fafa9 [1,0,0,0,0,0|3,0,0]=4 585 B14R1.38 CCCOCCS(=O)c1ccccc1 874eba27a62ba489de0ea5abf4a38ddd [1,0,0,0,0,0|2,0,0]=3 586 B14R1.38 CCCOCNC(=O)c1ccccc1 51bf2abea61b00fc9fdb50b9b1ceb816 [1,0,0,0,0,0|2,0,0]=3 587 B14R1.38 CCCOCNC(=O)c1cccnc1 c1e2c76617bf961e4991de9ffc5d51cf [1,0,0,0,0,0|3,0,0]=4 588 B14R1.38 CCCOCOC(=O)c1ccccc1 cc70ac2fa60876ecf022c56208b28ea7 [1,0,0,0,0,0|1,0,0]=2 589 B14R1.38 CCNCCCN(C)c1ccccc1 6463f7a45c4c60225ef684bd93c1551f [1,0,0,0,0,0|3,0,0]=4 590 B14R1.38 CCNCCNC(=O)c1ccncc1 7e105ee3dd54acdafa8ea82d89b0b6d6 [1,0,0,0,0,0|3,0,0]=4 591 B14R1.38 CCOCCCC(=O)c1ccccc1 707f140a5f7130a6ec804efeefbd9ff9 [1,0,0,0,0,0|1,0,0]=2 592 B14R1.38 CCOCCCC(=O)c1cccnc1 057c851bf9bd57cac62c62738c043d19 [1,0,0,0,0,0|2,0,0]=3 593 B14R1.38 CCOCCCN(C)c1ccccc1 d986ee48c2c70cffd40a409eea9f16d2 [1,0,0,0,0,0|3,0,0]=4 594 B14R1.38 CCOCCNC(=O)c1ccccc1 1e5e9cfc433868898144e5aeded1b2e9 [1,0,0,0,0,0|2,0,0]=3 595 B14R1.38 CCOCCNC(=O)c1ccccn1 7cd7908bf4fd4d0ebce5f7eccb399739 [1,0,0,0,0,0|3,0,0]=4 596 B14R1.38 CCOCCNC(=O)c1cccnc1 91babe4ed13e3d7fa91e5b0224b8e61a [1,0,0,0,0,0|3,0,0]=4 597 B14R1.38 CCOCCNC(=O)c1ccncc1 74ae5347e6fb8e24ed5fda9020b19793 [1,0,0,0,0,0|3,0,0]=4 598 B14R1.38 CCOCCOC(=O)c1ccccc1 8a4572a3e70b3dd100d6c56b45676621 [1,0,0,0,0,0|1,0,0]=2 599 B14R1.38 CCOCCOC(=O)c1cccnc1 007d9ff82eede535d7ed35cc3d187855 [1,0,0,0,0,0|2,0,0]=3 600 B14R1.38 CCOCCOC(C)c1ccccc1 2a8e32ade010cd5267770d7d575ebce6 [1,0,0,0,0,0|2,0,1]=4 601 B14R1.38 CCOCCO[C@@H](C)c1ccccc1 75aa9a313f1181ac356bdcef32582166 [1,0,0,0,0,0|2,0,1]=4 602 B14R1.38 CCOCCO[C@H](C)c1ccccc1 42f3639e418d0e668edf4be4ad767227 [1,0,0,0,0,0|2,0,1]=4 603 B14R1.38 CCOCNCC(=O)c1ccccc1 d3e1cf9a7e116805e860af16c05fe191 [1,0,0,0,0,0|2,0,0]=3 604 B14R1.38 CCOCOCC(=O)c1ccccc1 2c0f96df98b3240f69fc761286b50da9 [1,0,0,0,0,0|2,0,0]=3 605 B14R1.38 CCOCOCC(=O)c1ccccn1 8bfa907c7cf72172148629948c443d6b [1,0,0,0,0,0|3,0,0]=4 606 B14R1.38 CCOCOCC(=O)c1cccnc1 eecc42c529580540db0507daaf14ed88 [1,0,0,0,0,0|3,0,0]=4 607 B14R1.38 CCSCCCN(C)c1ccccc1 d87b802bcb31e624261a2f86ee11e6fb [1,0,0,0,0,0|3,0,0]=4 608 B14R1.38 CCSCCNC(=O)c1ccccc1 3d379f84b37bc8197331415247495bba [1,0,0,0,0,0|2,0,0]=3 609 B14R1.38 CCSCCNC(=O)c1ccccn1 4de65292b29186811ea43b88b7f6a6ed [1,0,0,0,0,0|3,0,0]=4 610 B14R1.38 CCSCCNC(=O)c1cccnc1 3b9f1f62699a5c0bfa45cea4038b9caf [1,0,0,0,0,0|3,0,0]=4 611 B14R1.38 CCSCCNC(=O)c1ccncc1 227e353b613a45ee7ac25f71d2e1f381 [1,0,0,0,0,0|3,0,0]=4 612 B14R1.38 CN(CCCCCO)c1ccccc1 2c03b69eaedd29e9d84b1bd5bd33d5e0 [1,0,0,0,0,0|3,0,0]=4 613 B14R1.38 COCCCCN(C)c1ccccc1 67221e4e9e95cfd994f81ba9a65aea7c [1,0,0,0,0,0|3,0,0]=4 614 B14R1.38 COCCCNC(=O)c1ccccc1 a322adf595398d60c7b641ec34bd5dcd [1,0,0,0,0,0|2,0,0]=3 615 B14R1.38 COCCCNC(=O)c1ccccn1 8d38acd5f0699f4d486af1b55beb6177 [1,0,0,0,0,0|3,0,0]=4 616 B14R1.38 COCCCNC(=O)c1cccnc1 3fbfabfa6c6fd95e1828db7efad37746 [1,0,0,0,0,0|3,0,0]=4 617 B14R1.38 COCCCNC(=O)c1ccncc1 ecbab2195d5df6c29ec1098131a571c6 [1,0,0,0,0,0|3,0,0]=4 618 B14R1.38 COCCCOC(C)c1ccccc1 eb71ce70e13fac1c3accd5dd05cb4867 [1,0,0,0,0,0|2,0,1]=4 619 B14R1.38 COCCCO[C@@H](C)c1ccccc1 66c810b8a7c198fb0793a18b2a9e6e87 [1,0,0,0,0,0|2,0,1]=4 620 B14R1.38 COCCCO[C@H](C)c1ccccc1 0063144da5ab7663ecb0dab5228bf7ea [1,0,0,0,0,0|2,0,1]=4 621 B14R1.38 COCCNCC(=O)c1ccccc1 a2a8c53f9a9cc16583afcc882449691f [1,0,0,0,0,0|2,0,0]=3 622 B14R1.38 COCCNCC(=O)c1ccccn1 d7abbdda8caa278792ceb276d7c31058 [1,0,0,0,0,0|3,0,0]=4 623 B14R1.38 COCCNCC(=O)c1cccnc1 44edcfea5d93ae8722dc277430190a28 [1,0,0,0,0,0|3,0,0]=4 624 B14R1.38 COCCOCC(=O)c1ccccc1 654eb93fb1775369277e37df679f72b4 [1,0,0,0,0,0|2,0,0]=3 625 B14R1.38 COCCOCC(=O)c1ccccn1 78e319d2e7cf16ace6ff193afb599214 [1,0,0,0,0,0|3,0,0]=4 626 B14R1.38 COCCOCC(=O)c1cccnc1 315997628dcd340dbbf2eb2c5858c8c6 [1,0,0,0,0,0|3,0,0]=4 627 B14R1.38 COCCOCS(=O)c1ccccc1 f173e1bf9df9c151df1785c0d4bc3261 [1,0,0,0,0,0|3,0,0]=4 628 B14R1.38 COCOCCC(=O)c1ccccc1 f90c10295098d1c9a4ec0b548db605b2 [1,0,0,0,0,0|2,0,0]=3 629 B14R1.38 COCOCCS(=O)c1ccccc1 2df16b59efdc9c8dfb312f33b08e3983 [1,0,0,0,0,0|3,0,0]=4 630 B14R1.38 COCOCNC(=O)c1ccccc1 6a29d7ff74761da3d90bb2d63eae7775 [1,0,0,0,0,0|3,0,0]=4 631 B14R1.38 COCOCOC(=O)c1ccccc1 f0e766de931ac8ad0b2807186836e34f [1,0,0,0,0,0|2,0,0]=3 632 B14R1.38 CSCCCNC(=O)c1ccccc1 940c730daf8e5f79d21a37cdb24a69a6 [1,0,0,0,0,0|2,0,0]=3 633 B14R1.38 CSCCCNC(=O)c1ccccn1 425fbc44fb1326770d6bb5db5cda6931 [1,0,0,0,0,0|3,0,0]=4 634 B14R1.38 CSCCCNC(=O)c1cccnc1 810b23012c9cba7bbb43654faeedf32b [1,0,0,0,0,0|3,0,0]=4 635 B14R1.38 CSCCCNC(=O)c1ccncc1 c5b4777e7fb756b5575191c11797fa77 [1,0,0,0,0,0|3,0,0]=4 636 B14R1.38 CSCCCOC(C)c1ccccc1 8aeaa62abae625bd84729c40c968601e [1,0,0,0,0,0|2,0,1]=4 637 B14R1.38 CSCCCO[C@@H](C)c1ccccc1 2beefede0beb4a4f218d79221c4db542 [1,0,0,0,0,0|2,0,1]=4 638 B14R1.38 CSCCCO[C@H](C)c1ccccc1 a8a607da640588a96010c62c01eeb169 [1,0,0,0,0,0|2,0,1]=4 639 B14R1.38 CSCCNCC(=O)c1ccccc1 ad2d46ea8e6dad3d50c6c7d6eab8c3df [1,0,0,0,0,0|2,0,0]=3 640 B14R1.38 CSCCNCC(=O)c1ccccn1 ae8ebebdea3cc4da7cd653b5a6ba4f36 [1,0,0,0,0,0|3,0,0]=4 641 B14R1.38 CSCCNCC(=O)c1cccnc1 1289d6e6ff4f1b3d5ee6c38a68a97c6f [1,0,0,0,0,0|3,0,0]=4 642 B14R1.38 CSCCOCC(=O)c1ccccc1 b97cd9b64c37acac075771beef31f58f [1,0,0,0,0,0|2,0,0]=3 643 B14R1.38 CSCCOCC(=O)c1ccccn1 7fec93b955390227a66cdf7697223896 [1,0,0,0,0,0|3,0,0]=4 644 B14R1.38 CSCCOCC(=O)c1cccnc1 29a953420ed3283dc3cdcbbb91a1cb38 [1,0,0,0,0,0|3,0,0]=4 645 B14R1.38 CSCOCCC(=O)c1ccccc1 c3cd597dc43b49c40eeb1afdd226db6b [1,0,0,0,0,0|2,0,0]=3 646 B14R1.38 CSCOCCS(=O)c1ccccc1 4c1c2de168cd195479125bdda212c52c [1,0,0,0,0,0|3,0,0]=4 647 B14R1.38 CSCOCNC(=O)c1ccccc1 86069a2a50391fbee6eba72bbbf4cd4b [1,0,0,0,0,0|3,0,0]=4 648 B14R1.38 C[C@@H](OCCCCF)c1ccccc1 b91599a9324fed707e09a486bd404b58 [1,0,0,0,0,0|2,0,1]=4 649 B14R1.38 C[C@H](OCCCCF)c1ccccc1 04e9392209e366d0f5581fd90cb50c34 [1,0,0,0,0,0|2,0,1]=4 650 B14R1.38 N#CCCCNC(=O)c1ccccc1 93352393bbe075329b06bf2e0632d2f8 [1,0,0,0,0,0|2,0,1]=4 651 B14R1.38 N#CCCNCC(=O)c1ccccc1 b33d8770e254b731d36486b5005578cd [1,0,0,0,0,0|2,0,1]=4 652 B14R1.38 N#CCCOCC(=O)c1ccccc1 75289523bbfaf41ff551c1b652d24aad [1,0,0,0,0,0|2,0,1]=4 653 B14R1.38 N#CCNCOC(=O)c1ccccc1 6deae80d7f8d8e0f77627be0504824b8 [1,0,0,0,0,0|2,0,1]=4 654 B14R1.38 N#CCOCCC(=O)c1ccccc1 f195d52883732a3f069d6bfd169cfe55 [1,0,0,0,0,0|2,0,1]=4 655 B14R1.38 N#CCOCOC(=O)c1ccccc1 f735230c29cf7a131d425e03e73e818f [1,0,0,0,0,0|2,0,1]=4 656 B14R1.38 N#CNCCOC(=O)c1ccccc1 caeeb3de36d9af6cfe413bc1435da2a6 [1,0,0,0,0,0|2,0,1]=4 657 B14R1.38 NOCCNCC(=O)c1ccccc1 d4835b31fe4e8645fc27e2358c5e8bf4 [1,0,0,0,0,0|3,0,0]=4 658 B14R1.38 O=C(CCCOCF)c1ccccc1 69ee3c21d806f7e13495ec53c1f0b747 [1,0,0,0,0,0|2,0,0]=3 659 B14R1.38 O=C(CCCOCF)c1cccnc1 33665951f9d5f237ddb8af062be9a2f8 [1,0,0,0,0,0|3,0,0]=4 660 B14R1.38 O=C(CCOCCF)c1ccccc1 1d44777f3185c832636a9e30d7f67e80 [1,0,0,0,0,0|2,0,0]=3 661 B14R1.38 O=C(CCOCCS)c1ccccc1 bc08e1b784906a6c370ac5522f7eba2e [1,0,0,0,0,0|2,0,0]=3 662 B14R1.38 O=C(CNCCCCl)c1ccccc1 ca081f661b44a8dd8a5d95ade5b4f67a [1,0,0,0,0,0|2,0,0]=3 663 B14R1.38 O=C(CNCCCCl)c1ccccn1 86041295f3f4c8669260dd3e02d0dbf5 [1,0,0,0,0,0|3,0,0]=4 664 B14R1.38 O=C(CNCCCCl)c1cccnc1 098df543c983bc00dc877be6d3db0d0e [1,0,0,0,0,0|3,0,0]=4 665 B14R1.38 O=C(CNCCCF)c1ccccc1 1d6c11b1f28b9670de406c2cc5fe3c98 [1,0,0,0,0,0|2,0,0]=3 666 B14R1.38 O=C(CNCCCO)c1ccccc1 2a41551119f379285d5557aee8bc058e [1,0,0,0,0,0|2,0,0]=3 667 B14R1.38 O=C(CNCCCO)c1ccccn1 ddbf5defde5bcd60a415c48118c34960 [1,0,0,0,0,0|3,0,0]=4 668 B14R1.38 O=C(CNCCCO)c1cccnc1 fbaef8d06a774008ca363cb586e39917 [1,0,0,0,0,0|3,0,0]=4 669 B14R1.38 O=C(CNCCCS)c1ccccc1 d96f4cf54e4242e6a4c383866ae69184 [1,0,0,0,0,0|2,0,0]=3 670 B14R1.38 O=C(COCCCF)c1ccccc1 4e9276709847847986c949083fb85c6e [1,0,0,0,0,0|2,0,0]=3 671 B14R1.38 O=C(COCCCF)c1ccccn1 10bd1d512186c2a30aede480ccbfe08a [1,0,0,0,0,0|3,0,0]=4 672 B14R1.38 O=C(COCCCF)c1cccnc1 a33e599a3bde261b14949061cfe3f8d2 [1,0,0,0,0,0|3,0,0]=4 673 B14R1.38 O=C(COCCCS)c1ccccc1 90bdc7b34ad5d7302c63006aca7d1337 [1,0,0,0,0,0|2,0,0]=3 674 B14R1.38 O=C(COCCCS)c1ccccn1 1e79512d069eaca6101b4655ab3d7dd3 [1,0,0,0,0,0|3,0,0]=4 675 B14R1.38 O=C(COCCCS)c1cccnc1 423556c8f5cec8f0a35dd18b6e726052 [1,0,0,0,0,0|3,0,0]=4 676 B14R1.38 O=C(NCCCCCl)c1ccccc1 df0a98adefb736a9adba458624a945bd [1,0,0,0,0,0|2,0,0]=3 677 B14R1.38 O=C(NCCCCCl)c1ccccn1 926d33ec4bdd2f6cc312a9e27495de71 [1,0,0,0,0,0|3,0,0]=4 678 B14R1.38 O=C(NCCCCCl)c1cccnc1 cc090ef7a804fc0c9ed5a0ff9b539abc [1,0,0,0,0,0|3,0,0]=4 679 B14R1.38 O=C(NCCCCCl)c1ccncc1 106c6c0df91a12a24f287cc5b1989e1c [1,0,0,0,0,0|3,0,0]=4 680 B14R1.38 O=C(NCCCCO)c1ccccc1 a78b91475a8e5c986fd890faa355caf2 [1,0,0,0,0,0|2,0,0]=3 681 B14R1.38 O=C(NCCCCO)c1ccccn1 5407779a109f79348550a3c88df66a86 [1,0,0,0,0,0|3,0,0]=4 682 B14R1.38 O=C(NCCCCO)c1cccnc1 0790a17f8ef1766c04b48263b99bed4c [1,0,0,0,0,0|3,0,0]=4 683 B14R1.38 O=C(NCCCCO)c1ccncc1 04e4f05e12354f129707e7db743f5afd [1,0,0,0,0,0|3,0,0]=4 684 B14R1.38 O=C(NCCCCS)c1ccccc1 b46718086931a7bc59bad7e3a7a87ee1 [1,0,0,0,0,0|2,0,0]=3 685 B14R1.38 O=C(NCCCCS)c1ccccn1 45697b841f79033558292bc65977fd67 [1,0,0,0,0,0|3,0,0]=4 686 B14R1.38 O=C(NCCCCS)c1cccnc1 6cd88658d067d41195aad3dd0f44f001 [1,0,0,0,0,0|3,0,0]=4 687 B14R1.38 O=C(NCCCCS)c1ccncc1 c70c66626840dfbb42d757785e35a6ae [1,0,0,0,0,0|3,0,0]=4 688 B14R1.38 O=C(NCCOCF)c1ccccc1 6ed248b80beaafeda8a704a8b637a3be [1,0,0,0,0,0|3,0,0]=4 689 B14R1.38 O=C(NCOCCF)c1ccccc1 3b0b15dbd16532459934c657b08d77e3 [1,0,0,0,0,0|3,0,0]=4 690 B14R1.38 O=C(NCOCCS)c1ccccc1 65c9c3c63e9eadd71469d87b999b6ba0 [1,0,0,0,0,0|3,0,0]=4 691 B14R1.38 O=C(OCCOCF)c1ccccc1 5d7f8326d36111b6b0c33c4c5d8166dc [1,0,0,0,0,0|2,0,0]=3 692 B14R1.38 O=C(OCCOCF)c1cccnc1 692fe6728df001ef266fcebd9a4e40d7 [1,0,0,0,0,0|3,0,0]=4 693 B14R1.38 O=C(OCNCCBr)c1ccccc1 346078716b7ce63b5e943545038e36bf [1,0,0,0,0,0|2,0,0]=3 694 B14R1.38 O=C(OCNCCF)c1ccccc1 e3fe3be86393cf229967f46768cb38fa [1,0,0,0,0,0|2,0,0]=3 695 B14R1.38 O=C(OCNCCI)c1ccccc1 156e8c9cfbea820b0be7266d03251db4 [1,0,0,0,0,0|2,0,0]=3 696 B14R1.38 O=C(OCNCCO)c1ccccc1 3d5dd9712e30b7c162f7328ee94625f1 [1,0,0,0,0,0|2,0,0]=3 697 B14R1.38 O=C(OCNCCS)c1ccccc1 e015a49ba21d5db5dd0c42b16f37a0b8 [1,0,0,0,0,0|2,0,0]=3 698 B14R1.38 O=C(OCOCCF)c1ccccc1 2be9fa10d8521e550f28422149034112 [1,0,0,0,0,0|2,0,0]=3 699 B14R1.38 O=C(OCOCCS)c1ccccc1 319c42278185c6fd6a171677806d2319 [1,0,0,0,0,0|2,0,0]=3 700 B14R1.38 O=CCCNCC(=O)c1ccccc1 886692e4218ab77ca587b20470cf9d64 [1,0,0,0,0,0|2,0,1]=4 701 B14R1.38 O=CCCOCC(=O)c1ccccc1 335aa7f7d55f848d485bfc105a702da9 [1,0,0,0,0,0|2,0,1]=4 702 B14R1.38 O=CCOCCC(=O)c1ccccc1 b3d4cdca17bedf4a6d3632d4b2edb435 [1,0,0,0,0,0|2,0,1]=4 703 B14R1.38 O=S(CCOCCS)c1ccccc1 3c96eda77b6741bdf15034bb69f090a3 [1,0,0,0,0,0|3,0,0]=4 704 B14R1.123 BrCCNCCOCc1ccccc1 65b5ec62b5c1e7c632bdd4b62a7a7641 [1,0,0,0,0,0|2,0,1]=4 705 B14R1.123 C#CCCCCOCc1ccccc1 57b8e9ed5e61cabb1e0b8943cbf90f26 [1,0,0,0,0,0|0,0,3]=4 706 B14R1.123 C/C=C/CCCOCc1ccccc1 ee5b3f950e81a18d78414c2529b10f28 [1,0,0,0,0,0|0,0,3]=4 707 B14R1.123 C/C=C\CCCOCc1ccccc1 9e5f141603dbfa006d1602cf781982e2 [1,0,0,0,0,0|0,0,3]=4 708 B14R1.123 C=CCCCCOCc1ccccc1 a17c13041a3cf26be3418793b842c914 [1,0,0,0,0,0|0,0,3]=4 709 B14R1.123 CC#CCCCOCc1ccccc1 4b39aecbdc9065bdf7c0434d043d7256 [1,0,0,0,0,0|0,0,3]=4 710 B14R1.123 CC/C=C/CCOCc1ccccc1 0c940929909ae78df89f7cdda55fe534 [1,0,0,0,0,0|0,0,3]=4 711 B14R1.123 CC/C=C\CCOCc1ccccc1 fd9cce5d566eaf9a678ac257677cb780 [1,0,0,0,0,0|0,0,3]=4 712 B14R1.123 CC=CCCCOCc1ccccc1 389039f091ae7d97e4e4d586c0bf9242 [1,0,0,0,0,0|0,0,3]=4 713 B14R1.123 CCC#CCCOCc1ccccc1 e6e06fb38090262e00c92e967c108618 [1,0,0,0,0,0|0,0,3]=4 714 B14R1.123 CCC/C=C/COCc1ccccc1 5b2ff5e1ce0de6e884a6d48e5fc63859 [1,0,0,0,0,0|0,0,3]=4 715 B14R1.123 CCC/C=C\COCc1ccccc1 d492c090ff0db0ebdd96878f6d88fa2c [1,0,0,0,0,0|0,0,3]=4 716 B14R1.123 CCCC#CCOCc1ccccc1 00fc032b5c9bdc8a7a9cbe513d578e64 [1,0,0,0,0,0|0,0,3]=4 717 B14R1.123 CCCCCCCNc1ccccc1 24e7a34d87b70ae5e123a53c0bb09bce [1,0,0,0,0,0|2,0,0]=3 718 B14R1.123 CCCCCCCNc1ccccn1 a9bccb57ef64b8cf517735c80682225a [1,0,0,0,0,0|3,0,0]=4 719 B14R1.123 CCCCCCCNc1cccnc1 edec09a800670a37181495961ae97341 [1,0,0,0,0,0|3,0,0]=4 720 B14R1.123 CCCCCCCNc1ccncc1 064bc4b0f7106b1801399f21531a27ef [1,0,0,0,0,0|3,0,0]=4 721 B14R1.123 CCCCCCCOc1ccccn1 12d7ec931a2f5d56d73fe4b4d868c63f [1,0,0,0,0,0|3,0,0]=4 722 B14R1.123 CCCCCCCOc1cccnc1 72f110b2e4522df10985b653f75c9b94 [1,0,0,0,0,0|3,0,0]=4 723 B14R1.123 CCCCCCCOc1ccncc1 af6173eaae9076c0dd0c337fe20ab830 [1,0,0,0,0,0|3,0,0]=4 724 B14R1.123 CCCCCCNCc1ccccc1 965724898f13bbc06c11939da64ee855 [1,0,0,0,0,0|1,0,1]=3 725 B14R1.123 CCCCCCNCc1ccccn1 775963929c2255f150cae7927c408e9c [1,0,0,0,0,0|2,0,1]=4 726 B14R1.123 CCCCCCNCc1cccnc1 534fee81a77bb2bf91567a2d552033b4 [1,0,0,0,0,0|2,0,1]=4 727 B14R1.123 CCCCCCNCc1ccncc1 319288868883e436ad5279ed92ff77be [1,0,0,0,0,0|2,0,1]=4 728 B14R1.123 CCCCCCOCc1ccccc1 8339fed2005c0b21353d61b2fe809acd [1,0,0,0,0,0|0,0,1]=2 729 B14R1.123 CCCCCCOCc1ccccn1 b3b22363b6c373129905c325cb2981d2 [1,0,0,0,0,0|1,0,1]=3 730 B14R1.123 CCCCCCOCc1cccnc1 5825d048b4e0fdd32ad1203ecec84914 [1,0,0,0,0,0|1,0,1]=3 731 B14R1.123 CCCCCCOCc1cccnn1 17ba1b3ed15f6c025ef566599696040f [1,0,0,0,0,0|2,0,1]=4 732 B14R1.123 CCCCCCOCc1ccncc1 807e67b825e1d621ef013edf1f3e8aa0 [1,0,0,0,0,0|1,0,1]=3 733 B14R1.123 CCCCCCOCc1ccncn1 b6b53fbe9c71e06f2f3e47c5587d66c0 [1,0,0,0,0,0|2,0,1]=4 734 B14R1.123 CCCCCCOCc1ccnnc1 724aa2193a5e7d6c2c8e4cd5d166bc37 [1,0,0,0,0,0|2,0,1]=4 735 B14R1.123 CCCCCCOCc1cnccn1 72a5e974328df4c07ed699f0bdbadc2f [1,0,0,0,0,0|2,0,1]=4 736 B14R1.123 CCCCCCOCc1cncnc1 cc14da7120807f5b16e6b42c3b1adc07 [1,0,0,0,0,0|2,0,1]=4 737 B14R1.123 CCCCCCOCc1ncccn1 22019001b12c4b6f59ab7957ee2075c7 [1,0,0,0,0,0|2,0,1]=4 738 B14R1.123 CCCCCNCCc1ccccc1 cccd913a3cc2366afc1e8883c8fc5f10 [1,0,0,0,0,0|2,0,1]=4 739 B14R1.123 CCCCCOCCc1ccccc1 7612522524f046e5697aa891dbc2353d [1,0,0,0,0,0|2,0,1]=4 740 B14R1.123 CCCCNC/C=C/c1ccccc1 908a465b63d6994eef7abba1b0b62403 [1,0,0,0,0,0|2,0,0]=3 741 B14R1.123 CCCCNCC#Cc1ccccc1 fed2e0cdfc40611de3a021e9a844e768 [1,0,0,0,0,0|2,0,1]=4 742 B14R1.123 CCCCNCC=Cc1ccccc1 a69c549f05984c12a4894fd98cdf3109 [1,0,0,0,0,0|2,0,0]=3 743 B14R1.123 CCCCNCCCc1ccccc1 db3cadb4bdc5548728d2e379524771ec [1,0,0,0,0,0|2,0,1]=4 744 B14R1.123 CCCCNCCOc1ccccc1 18f12f5c110e2219b5273154f8b27abb [1,0,0,0,0,0|3,0,0]=4 745 B14R1.123 CCCCNCOCc1ccccc1 966de4623ef2313127aff52d130a7135 [1,0,0,0,0,0|1,0,1]=3 746 B14R1.123 CCCCNCSCc1ccccc1 334d6ba422bc2129ddf6d80d90158712 [1,0,0,0,0,0|1,1,1]=4 747 B14R1.123 CCCCOC/C=C/c1ccccc1 10e0f05eba20ce69db632cbaf84e0a6e [1,0,0,0,0,0|2,0,0]=3 748 B14R1.123 CCCCOC/C=C/c1ccccn1 c5459e81948e2f3a1f310da737155d5a [1,0,0,0,0,0|3,0,0]=4 749 B14R1.123 CCCCOC/C=C/c1cccnc1 b6bc71c490aec5fa6d190dfadedd09fd [1,0,0,0,0,0|3,0,0]=4 750 B14R1.123 CCCCOC/C=C/c1ccncc1 0f17749aca0ba85deaa5ce21bd366665 [1,0,0,0,0,0|3,0,0]=4 751 B14R1.123 CCCCOC/C=C\c1ccccc1 69d3aefbc8d261322493934c4076d03d [1,0,0,0,0,0|2,0,0]=3 752 B14R1.123 CCCCOC/C=C\c1ccncc1 21955ceca445c3eea36509698fcfeb74 [1,0,0,0,0,0|3,0,0]=4 753 B14R1.123 CCCCOCC#Cc1ccccc1 b50402a1fcfcdf20c27566e1c8a835de [1,0,0,0,0,0|2,0,1]=4 754 B14R1.123 CCCCOCC=Cc1ccccc1 d5aae9c9241babbb8a3c59c834044b7a [1,0,0,0,0,0|2,0,0]=3 755 B14R1.123 CCCCOCC=Cc1ccncc1 44485fe403ddd409adc0dd1fd3c535c0 [1,0,0,0,0,0|3,0,0]=4 756 B14R1.123 CCCCOCCCc1ccccc1 5f4dab8a29d4c27ab4f609a3e2340103 [1,0,0,0,0,0|2,0,1]=4 757 B14R1.123 CCCCOCCNc1ccccc1 0cfe565e12514f1afbc00f85a9bcf780 [1,0,0,0,0,0|3,0,0]=4 758 B14R1.123 CCCCOCCOc1ccccc1 e65bde90c68f11c1d4b4b9ed93208d27 [1,0,0,0,0,0|3,0,0]=4 759 B14R1.123 CCCCOCCSc1ccccc1 eece7efef51492180321958704c07aa1 [1,0,0,0,0,0|3,0,0]=4 760 B14R1.123 CCCCOCNCc1ccccc1 f5d68097958fddef958938ce13533e99 [1,0,0,0,0,0|2,0,1]=4 761 B14R1.123 CCCCOCOCc1ccccn1 3653aac0bde039c2ccf72d58a71d31db [1,0,0,0,0,0|2,0,1]=4 762 B14R1.123 CCCCOCOCc1cccnc1 dd65727544b21f2063ef558ab71b1d71 [1,0,0,0,0,0|2,0,1]=4 763 B14R1.123 CCCCOCOCc1ccncc1 214e53f9e6c612e96d467a45e4ab9f60 [1,0,0,0,0,0|2,0,1]=4 764 B14R1.123 CCCNCC/C=C/c1ccccc1 faeae4bdad7bc87b1fb833bc74af62a6 [1,0,0,0,0,0|2,0,0]=3 765 B14R1.123 CCCNCCCCc1ccccc1 a98cdca6a4002fe043a948fbd42b3fdc [1,0,0,0,0,0|2,0,1]=4 766 B14R1.123 CCCNCCCOc1ccccc1 c44c37e88c9d686faf9087eabb2a8582 [1,0,0,0,0,0|3,0,0]=4 767 B14R1.123 CCCNCCOCc1ccccc1 6d0ac95e77361bf111b9af051d64ee86 [1,0,0,0,0,0|1,0,1]=3 768 B14R1.123 CCCNCCSCc1ccccc1 e862d04935722dccd816d25b40d50ce9 [1,0,0,0,0,0|1,1,1]=4 769 B14R1.123 CCCOCCC#Cc1ccccc1 8a4bb739a32c0b350c2c3ad400bbda7f [1,0,0,0,0,0|2,0,1]=4 770 B14R1.123 CCCOCCCCc1ccccc1 df45b67fd9f86d69d66731bbb203346a [1,0,0,0,0,0|2,0,1]=4 771 B14R1.123 CCCOCCCNc1ccccc1 73792eee9c95013ac15a0bb8c6643f93 [1,0,0,0,0,0|3,0,0]=4 772 B14R1.123 CCCOCCCOc1ccccc1 a110c637da2df84ef062a6c3011ecf69 [1,0,0,0,0,0|3,0,0]=4 773 B14R1.123 CCCOCCCSc1ccccc1 693a72a040cbdbaa857c97d346386f97 [1,0,0,0,0,0|3,0,0]=4 774 B14R1.123 CCCOCCNCc1ccccc1 1d5a9144386d2f8fd758fb9fdd747b23 [1,0,0,0,0,0|2,0,1]=4 775 B14R1.123 CCCOCCOCc1ccccc1 247492e0fdef1e9af2651cbdc97e2a87 [1,0,0,0,0,0|1,0,1]=3 776 B14R1.123 CCCOCCOCc1ccccn1 9bdb4697ce71154c1ee3a92a9ec4ef34 [1,0,0,0,0,0|2,0,1]=4 777 B14R1.123 CCCOCCOCc1cccnc1 f83cd0e9537374706be8abe9ade6d662 [1,0,0,0,0,0|2,0,1]=4 778 B14R1.123 CCCOCCOCc1ccncc1 0389405efbf8b0b40f40e13199d2f474 [1,0,0,0,0,0|2,0,1]=4 779 B14R1.123 CCCOCCSCc1ccccc1 92f923466bcf8081a6ca11ff3ae55ecc [1,0,0,0,0,0|1,1,1]=4 780 B14R1.123 CCCSCCOCc1ccccc1 3b43a70ba040c3ec33148c2441e00e42 [1,0,0,0,0,0|1,0,1]=3 781 B14R1.123 CCCSCCOCc1ccccn1 6c289017f022794a4a8d905f67c7a997 [1,0,0,0,0,0|2,0,1]=4 782 B14R1.123 CCCSCCOCc1cccnc1 d209402f3056d6e81ad7962b3da28318 [1,0,0,0,0,0|2,0,1]=4 783 B14R1.123 CCNCCCCCc1ccccc1 d23c59fda970e464e2ed0f71cbef10cc [1,0,0,0,0,0|2,0,1]=4 784 B14R1.123 CCNCCCCOc1ccccc1 8bc6d94b8e17c95c0f9138f27307ff82 [1,0,0,0,0,0|3,0,0]=4 785 B14R1.123 CCNCCCOCc1ccccc1 db90a4450dbb69f3e90707fd36c925db [1,0,0,0,0,0|1,0,1]=3 786 B14R1.123 CCOCCCC#Cc1ccccc1 a4b650129b4a3fccdedc7bb7cdbb1206 [1,0,0,0,0,0|2,0,1]=4 787 B14R1.123 CCOCCCCCc1ccccc1 8053e6959e3b790608431b7e668ecabe [1,0,0,0,0,0|2,0,1]=4 788 B14R1.123 CCOCCCNCc1ccccc1 2a693c32ec825802d938979f20f6d439 [1,0,0,0,0,0|2,0,1]=4 789 B14R1.123 CCOCCCOCc1ccccc1 fa62747007116d9be331d37fc979a6f1 [1,0,0,0,0,0|1,0,1]=3 790 B14R1.123 CCOCCCOCc1ccccn1 0538af0d7289a22e332f4c72277f2db0 [1,0,0,0,0,0|2,0,1]=4 791 B14R1.123 CCOCCCOCc1cccnc1 99ab4175299a96ffd862e1def5bd56b5 [1,0,0,0,0,0|2,0,1]=4 792 B14R1.123 CCOCCCOCc1ccncc1 fae2865150bc5f0828eddf5033ecba6c [1,0,0,0,0,0|2,0,1]=4 793 B14R1.123 CCOCCCSCc1ccccc1 b1e95030090479283de7a43464dfe03a [1,0,0,0,0,0|1,1,1]=4 794 B14R1.123 CCOCNC/C=C/c1ccccc1 887afdaa505c3782830eba744c9ab8fc [1,0,0,0,0,0|3,0,0]=4 795 B14R1.123 CCOCOC/C=C/c1ccccc1 98ed4e62400d58b6833f349dbdc46f45 [1,0,0,0,0,0|3,0,0]=4 796 B14R1.123 CCOCOC/C=C\c1ccccc1 7bdc042a67cbfe1bf9598d5815335aea [1,0,0,0,0,0|3,0,0]=4 797 B14R1.123 CCOCOCC=Cc1ccccc1 c7ce4ee82534182ceb98c1d80d1dab8c [1,0,0,0,0,0|3,0,0]=4 798 B14R1.123 CCSCCCCNc1ccccc1 725032b154f2e4c5d63bd6f424a134ff [1,0,0,0,0,0|3,0,0]=4 799 B14R1.123 CCSCCCNCc1ccccc1 d3af7d44a1bc1475c8f4cae3d033d0fe [1,0,0,0,0,0|2,0,1]=4 800 B14R1.123 CCSCCCOCc1ccccc1 9da24101debdb89172cef0cd871755a8 [1,0,0,0,0,0|1,0,1]=3 801 B14R1.123 CCSCCCOCc1ccccn1 c926369017f0dee755b8f8f618f70cf1 [1,0,0,0,0,0|2,0,1]=4 802 B14R1.123 CCSCCCOCc1cccnc1 6f34a19f540c518f5675b8d64323414c [1,0,0,0,0,0|2,0,1]=4 803 B14R1.123 CCSCCCOCc1ccncc1 a582b92ecaf4cf7f18ef6abbdc9cf454 [1,0,0,0,0,0|2,0,1]=4 804 B14R1.123 COCCCCCNc1ccccc1 424b4e62991558314e16305af846a945 [1,0,0,0,0,0|3,0,0]=4 805 B14R1.123 COCCCCNCc1ccccc1 12cae58d037c54af84b6eddfb646d428 [1,0,0,0,0,0|2,0,1]=4 806 B14R1.123 COCCCCOCc1ccccc1 6c919662d6fe77135a162cea51e76fe8 [1,0,0,0,0,0|1,0,1]=3 807 B14R1.123 COCCCCOCc1ccccn1 04c7e0771266e769f0adcaef12ef64c7 [1,0,0,0,0,0|2,0,1]=4 808 B14R1.123 COCCCCOCc1cccnc1 da1dd63e6e9d3c95416db28c834cccca [1,0,0,0,0,0|2,0,1]=4 809 B14R1.123 COCCCCOCc1ccncc1 e8eca599796bddbe0217d7318040f7c5 [1,0,0,0,0,0|2,0,1]=4 810 B14R1.123 COCCNC/C=C/c1ccccc1 d73710c6dcd7fe14a5c3c1c7ad968cd7 [1,0,0,0,0,0|3,0,0]=4 811 B14R1.123 COCCNCC=Cc1ccccc1 f9cc77ec6ab874cb4b98610072f3f427 [1,0,0,0,0,0|3,0,0]=4 812 B14R1.123 COCCNCOCc1ccccc1 42b1ae6cdba43f246191effb2bb75b7b [1,0,0,0,0,0|2,0,1]=4 813 B14R1.123 COCCOC/C=C/c1ccccc1 c7a7480f900d89ae0afea140c5430549 [1,0,0,0,0,0|3,0,0]=4 814 B14R1.123 COCCOC/C=C\c1ccccc1 230024d9940b798a6978e0a619f77e45 [1,0,0,0,0,0|3,0,0]=4 815 B14R1.123 COCCOCC=Cc1ccccc1 06fd5fa67fc041cb2dc538090ab228f9 [1,0,0,0,0,0|3,0,0]=4 816 B14R1.123 COCCOCOCc1ccccc1 4a58c761ad5afe70d3785eeb01774298 [1,0,0,0,0,0|2,0,1]=4 817 B14R1.123 COCNCC/C=C/c1ccccc1 75ec76f9635066b8924e3ee188fb4669 [1,0,0,0,0,0|3,0,0]=4 818 B14R1.123 COCNCCOCc1ccccc1 6f363c1159ba4f0b0ee9cb65c2f52801 [1,0,0,0,0,0|2,0,1]=4 819 B14R1.123 COCOCCOCc1ccccc1 181fc688747cef851748a2dea3463e15 [1,0,0,0,0,0|2,0,1]=4 820 B14R1.123 CSCCCCNCc1ccccc1 e5ca7de0cadd5b3058adfc487cdb399b [1,0,0,0,0,0|2,0,1]=4 821 B14R1.123 CSCCCCOCc1ccccc1 a5dc78a5e53b6e222ff1a9004728bd1f [1,0,0,0,0,0|1,0,1]=3 822 B14R1.123 CSCCCCOCc1ccccn1 3ca3e752d10c267d5ff5f53f2a4735bc [1,0,0,0,0,0|2,0,1]=4 823 B14R1.123 CSCCCCOCc1cccnc1 14748351b2efbef1db35bbca4e58f7a8 [1,0,0,0,0,0|2,0,1]=4 824 B14R1.123 CSCCNC/C=C/c1ccccc1 cc02f54249981f3c2996845e667dd112 [1,0,0,0,0,0|3,0,0]=4 825 B14R1.123 CSCCOC/C=C/c1ccccc1 b35741d2461a8a05b5dcb1b6e9253232 [1,0,0,0,0,0|3,0,0]=4 826 B14R1.123 CSCCOC/C=C\c1ccccc1 dd37855012afc9fb850132c373003008 [1,0,0,0,0,0|3,0,0]=4 827 B14R1.123 CSCCOCC=Cc1ccccc1 3df979bfb1149105f86bf4e237608ce7 [1,0,0,0,0,0|3,0,0]=4 828 B14R1.123 CSCNCC/C=C/c1ccccc1 795aa00f59a971959122c6d082e15f71 [1,0,0,0,0,0|3,0,0]=4 829 B14R1.123 CSCNCCOCc1ccccc1 dadf4da7484b9bae9e204d01dae69581 [1,0,0,0,0,0|2,0,1]=4 830 B14R1.123 CSCOCCOCc1ccccc1 e55766fe6e7811f043c0d0107333fcd2 [1,0,0,0,0,0|2,0,1]=4 831 B14R1.123 ClCCCCCCNc1ccccc1 c5143082595ca5d27650229e32f91fa4 [1,0,0,0,0,0|3,0,0]=4 832 B14R1.123 ClCCCCCNCc1ccccc1 e61f6d2a4b87121f9da8f4afc3906643 [1,0,0,0,0,0|2,0,1]=4 833 B14R1.123 ClCCCNC/C=C/c1ccccc1 e5502871697cf84a037a5fd57295d651 [1,0,0,0,0,0|3,0,0]=4 834 B14R1.123 ClCCCNCC=Cc1ccccc1 d8330cdce69a6c57f75635c09b9af055 [1,0,0,0,0,0|3,0,0]=4 835 B14R1.123 ClCCCNCOCc1ccccc1 fa7f15ea3ca25db479be02ffab0398e8 [1,0,0,0,0,0|2,0,1]=4 836 B14R1.123 FCCCCCCNc1ccccc1 403980f52b6e209312b236d4b9472450 [1,0,0,0,0,0|3,0,0]=4 837 B14R1.123 FCCCCCNCc1ccccc1 214768c9c7c40ba215e9e58ee344cd99 [1,0,0,0,0,0|2,0,1]=4 838 B14R1.123 FCCCCCOCc1ccccc1 d6bb662b1a7e26005011cf5313751fb9 [1,0,0,0,0,0|1,0,1]=3 839 B14R1.123 FCCCCCOCc1ccccn1 58cffc13ca74604854c4f7dc1868c549 [1,0,0,0,0,0|2,0,1]=4 840 B14R1.123 FCCCCCOCc1cccnc1 0ec29f40b026a0cc0b535d6f81f0cc38 [1,0,0,0,0,0|2,0,1]=4 841 B14R1.123 FCCCCCOCc1ccncc1 b07ff4dc6dc7d37183ad080261bfe059 [1,0,0,0,0,0|2,0,1]=4 842 B14R1.123 FCCCNC/C=C/c1ccccc1 103dd95bfb3f63d7659b2271e06da70e [1,0,0,0,0,0|3,0,0]=4 843 B14R1.123 FCCCOC/C=C/c1ccccc1 4005f06792057130168659e5455de7fc [1,0,0,0,0,0|3,0,0]=4 844 B14R1.123 FCCCOC/C=C\c1ccccc1 5ae4ff51fc38f4db37727cd4fa33524d [1,0,0,0,0,0|3,0,0]=4 845 B14R1.123 FCCCOCC=Cc1ccccc1 20003b8cce64fd7e84567296e1449907 [1,0,0,0,0,0|3,0,0]=4 846 B14R1.123 FCCNCC/C=C/c1ccccc1 8b091e3edd7705d4852621be5856e2c5 [1,0,0,0,0,0|3,0,0]=4 847 B14R1.123 FCCNCCOCc1ccccc1 28958571bc60dfcc51dd89b69a0f6a38 [1,0,0,0,0,0|2,0,1]=4 848 B14R1.123 FCCOCCOCc1ccccc1 b560c39cbef03ade5c7c76c3e5b5fb88 [1,0,0,0,0,0|2,0,1]=4 849 B14R1.123 FCNCCCOCc1ccccc1 5a1e1430167925e47d8e5798c7affe13 [1,0,0,0,0,0|2,0,1]=4 850 B14R1.123 FCOCCCOCc1ccccc1 76b41a6f33274b2f454d102dcf56d838 [1,0,0,0,0,0|2,0,1]=4 851 B14R1.123 ICCNCCOCc1ccccc1 bfd3e540e39f340c0e51a05d4d40a011 [1,0,0,0,0,0|2,0,1]=4 852 B14R1.123 N#CCCCCOCc1ccccc1 de63952f62f9cf21f010904ee48800af [1,0,0,0,0,0|1,0,2]=4 853 B14R1.123 O=CCCCCOCc1ccccc1 171fdc338a873528533ef544e8600c8c [1,0,0,0,0,0|1,0,2]=4 854 B14R1.123 OCCCCCCNc1ccccc1 c32f5c597b7f4884d6c2f0d1656a674a [1,0,0,0,0,0|3,0,0]=4 855 B14R1.123 OCCCCCNCc1ccccc1 fb643243abb367fbb3eba06d11fa4a0e [1,0,0,0,0,0|2,0,1]=4 856 B14R1.123 OCCCNC/C=C/c1ccccc1 880518648de8034e0405dde3227d58e4 [1,0,0,0,0,0|3,0,0]=4 857 B14R1.123 OCCCNCC=Cc1ccccc1 14f7f8216a6c613043e88bb0d7d6cbc9 [1,0,0,0,0,0|3,0,0]=4 858 B14R1.123 OCCNCC/C=C/c1ccccc1 ab2c733968dc063205471beb26716fba [1,0,0,0,0,0|3,0,0]=4 859 B14R1.123 OCCNCCOCc1ccccc1 456a28c0e93446d435e48cc33f0aa13a [1,0,0,0,0,0|2,0,1]=4 860 B14R1.123 SCCCNC/C=C/c1ccccc1 7821ae6c9bcf1ab5063f2e628ae10783 [1,0,0,0,0,0|3,0,0]=4 861 B14R1.123 SCCCOC/C=C/c1ccccc1 ccadb3eec011bebd25791deffd13fee4 [1,0,0,0,0,0|3,0,0]=4 862 B14R1.123 SCCCOC/C=C\c1ccccc1 9747c9b837eb8eac6c8d7f2d67017063 [1,0,0,0,0,0|3,0,0]=4 863 B14R1.123 SCCCOCC=Cc1ccccc1 6d251bf9c38adf7068474fecd54a538b [1,0,0,0,0,0|3,0,0]=4 864 B14R1.123 SCCNCC/C=C/c1ccccc1 22b4c5c3e3a964706921ff995008e874 [1,0,0,0,0,0|3,0,0]=4 865 B14R1.123 SCCNCCOCc1ccccc1 56ccaf3f8784009d8a63eb3968a4c0fd [1,0,0,0,0,0|2,0,1]=4 866 B14R1.123 SCCOCCOCc1ccccc1 36a3d5e0b96f674e23adb274e2d7d697 [1,0,0,0,0,0|2,0,1]=4 867 B16R1.35 CCCCCC(C)NC(=O)c1ccccc1 2db3e74109294c122c7a66bb668010cf [0,1,0,0,0,0|1,0,0]=2 868 B16R1.35 CCCCCC(C)NC(=O)c1ccccn1 cdc3e3a981229693d383dac1bff8312e [0,1,0,0,0,0|2,0,0]=3 869 B16R1.35 CCCCCC(C)NC(=O)c1cccnc1 5cd0144a628a4a0c7444d5c3be13d01a [0,1,0,0,0,0|2,0,0]=3 870 B16R1.35 CCCCCC(C)NC(=O)c1cccnn1 8eb5ba8527d41df66baf7f31fd4a9d45 [0,1,0,0,0,0|3,0,0]=4 871 B16R1.35 CCCCCC(C)NC(=O)c1ccncc1 c00010cc9a91421032bf4564e4cb0c1e [0,1,0,0,0,0|2,0,0]=3 872 B16R1.35 CCCCCC(C)NC(=O)c1ccncn1 3f2d5f4cd6b68b55af27e542b86ae0c1 [0,1,0,0,0,0|3,0,0]=4 873 B16R1.35 CCCCCC(C)NC(=O)c1ccnnc1 d5879a5e4f1501eb6979be55e170a726 [0,1,0,0,0,0|3,0,0]=4 874 B16R1.35 CCCCCC(C)NC(=O)c1cnccn1 56038f653e91e485b87c0e757be56a87 [0,1,0,0,0,0|3,0,0]=4 875 B16R1.35 CCCCCC(C)NC(=O)c1cncnc1 814c12db91991f04d794adbcd7b6d877 [0,1,0,0,0,0|3,0,0]=4 876 B16R1.35 CCCCCC(C)NC(=O)c1ncccn1 4e3cac30eca92cd68b91134a8edf179f [0,1,0,0,0,0|3,0,0]=4 877 B16R1.35 CCCCCC(C)OC(C)c1ccncc1 f0e2f596984ce66658a6532a63f7f5b6 [0,1,0,0,0,0|2,0,1]=4 878 B16R1.35 CCCCCC(C)O[C@@H](C)c1ccncc1 fa6bf9e6583b469b201d5ac5e5cbf6ba [0,1,0,0,0,0|2,0,1]=4 879 B16R1.35 CCCCCC(C)O[C@H](C)c1ccncc1 caeecc36aaf2c1ea13d4a5e8a59ceba2 [0,1,0,0,0,0|2,0,1]=4 880 B16R1.35 CCCCCN(C)CC(=O)c1ccccn1 4ba7cc02ac46a0661856f42a3a0be3b7 [0,1,0,0,0,0|3,0,0]=4 881 B16R1.35 CCCCCN(C)CC(=O)c1cccnc1 095d182e8cf94f4e48ef4057f071de90 [0,1,0,0,0,0|3,0,0]=4 882 B16R1.35 CCCCC[C@H](C)NC(=O)c1ccccc1 7e77344b62a4821e8b1a1400e0f8e635 [0,1,0,0,0,0|1,0,0]=2 883 B16R1.35 CCCCC[C@H](C)NC(=O)c1ccccn1 1cf0e9235e534f74229af737162b9e39 [0,1,0,0,0,0|2,0,0]=3 884 B16R1.35 CCCCC[C@H](C)NC(=O)c1cccnc1 a43fc40649292675f4436276a2eb7d80 [0,1,0,0,0,0|2,0,0]=3 885 B16R1.35 CCCCC[C@H](C)NC(=O)c1cccnn1 26dddcb491cc49071101a1ffcb5f6413 [0,1,0,0,0,0|3,0,0]=4 886 B16R1.35 CCCCC[C@H](C)NC(=O)c1ccncc1 8e09a5c773bb3778bd1944480b927575 [0,1,0,0,0,0|2,0,0]=3 887 B16R1.35 CCCCC[C@H](C)NC(=O)c1ccncn1 518690cdd893e0ce4d26a1884607325e [0,1,0,0,0,0|3,0,0]=4 888 B16R1.35 CCCCC[C@H](C)NC(=O)c1ccnnc1 a99a9f81c5d209708f14503c8e72c770 [0,1,0,0,0,0|3,0,0]=4 889 B16R1.35 CCCCC[C@H](C)NC(=O)c1cnccn1 9df1008c6a28d3685108806228f27893 [0,1,0,0,0,0|3,0,0]=4 890 B16R1.35 CCCCC[C@H](C)NC(=O)c1cncnc1 ad882a0349d48367fa364d1cba4b6cca [0,1,0,0,0,0|3,0,0]=4 891 B16R1.35 CCCCC[C@H](C)NC(=O)c1ncccn1 49a14cf5a42d182d66b4d3ac4dca6fdf [0,1,0,0,0,0|3,0,0]=4 892 B16R1.35 CCCCC[C@H](C)OC(C)c1ccccn1 e1f2a599310d82ba434cdc58776e9720 [0,1,0,0,0,0|2,0,1]=4 893 B16R1.35 CCCCC[C@H](C)OC(C)c1cccnc1 6964886840de894bf115a05be8ce302a [0,1,0,0,0,0|2,0,1]=4 894 B16R1.35 CCCCC[C@H](C)OC(C)c1ccncc1 f3aa313b37345cf3079ad21dcd5c0e6e [0,1,0,0,0,0|2,0,1]=4 895 B16R1.35 CCCCC[C@H](C)O[C@@H](C)c1ccccn1 53f32b448b3d7d2abb6c39ec7fc4340f [0,1,0,0,0,0|2,0,1]=4 896 B16R1.35 CCCCC[C@H](C)O[C@@H](C)c1cccnc1 8536ff0bf8ffb148c4e4c75b8be20b8f [0,1,0,0,0,0|2,0,1]=4 897 B16R1.35 CCCCC[C@H](C)O[C@@H](C)c1ccncc1 0fa2c11cdc2a452ecc89d0648f5d371c [0,1,0,0,0,0|2,0,1]=4 898 B16R1.35 CCCCC[C@H](C)O[C@H](C)c1ccccn1 1eb4889b9dd8a6543fa78de4f7f0f8ed [0,1,0,0,0,0|2,0,1]=4 899 B16R1.35 CCCCC[C@H](C)O[C@H](C)c1cccnc1 66149af6775bcd7f8feb547c8643696f [0,1,0,0,0,0|2,0,1]=4 900 B16R1.35 CCCCC[C@H](C)O[C@H](C)c1ccncc1 d7d471f2748855254ec833dcd9f54a98 [0,1,0,0,0,0|2,0,1]=4 901 B16R1.35 CCOCCN(C)CC(=O)c1ccccc1 ede0cf2079a3262a673224994d8877b4 [0,1,0,0,0,0|3,0,0]=4 902 B16R1.35 CN(CCCCO)CC(=O)c1ccccc1 641e928364a19b0cbfa9890c9b3471c2 [0,1,0,0,0,0|3,0,0]=4 903 B16R1.64 C#CCCCCCNC(=O)c1ccccc1 13d3d473cbf1a8d7c560598d9bb71e3e [0,1,0,0,0,0|1,0,1]=3 904 B16R1.64 C#CCCCCCNC(=O)c1ccccn1 1465ecb93398bfefd8b2a1d2ebf0ba64 [0,1,0,0,0,0|2,0,1]=4 905 B16R1.64 C#CCCCCCNC(=O)c1cccnc1 e4e80bfdf3876adf8343d01594d3fb16 [0,1,0,0,0,0|2,0,1]=4 906 B16R1.64 C#CCCCCCNC(=O)c1ccncc1 86f3784cf0e5d461d440fd92da58b0ec [0,1,0,0,0,0|2,0,1]=4 907 B16R1.64 C#CCCCCCOC(C)c1ccccc1 b094469bce14fbbabea8d4702fb25533 [0,1,0,0,0,0|1,0,2]=4 908 B16R1.64 C#CCCCCCO[C@@H](C)c1ccccc1 60797a142d9a5dedfa3400290c84fb12 [0,1,0,0,0,0|1,0,2]=4 909 B16R1.64 C#CCCCCCO[C@H](C)c1ccccc1 404ef1404faffb7ab033bfcdab2374ed [0,1,0,0,0,0|1,0,2]=4 910 B16R1.64 C#CCCCCNCC(=O)c1ccccc1 0b917342f936484d09867d23d1a91060 [0,1,0,0,0,0|1,0,2]=4 911 B16R1.64 C#CCCCCOCC(=C)c1ccccc1 b0b1703489cb7d3ddb44b54b8f002d92 [0,1,0,0,0,0|1,0,2]=4 912 B16R1.64 C#CCCCCOCC(=O)c1ccccc1 bc74ab12bf5f4bb9f80cee618465120d [0,1,0,0,0,0|0,0,2]=3 913 B16R1.64 C#CCCCCOCC(=O)c1ccccn1 2acd533686c1ca59850adfce7daea185 [0,1,0,0,0,0|1,0,2]=4 914 B16R1.64 C#CCCCCOCC(=O)c1cccnc1 c06266c2bf9dade7d98e2fb7df021eb4 [0,1,0,0,0,0|1,0,2]=4 915 B16R1.64 C#CCCCNCOC(=O)c1ccccc1 d50ef9a0381d147b701bd2f2b31c4c5e [0,1,0,0,0,0|0,0,2]=3 916 B16R1.64 C#CCCCOCCC(=O)c1ccccc1 c0f15a3ce1a2f9b4a7d373d88a0f879d [0,1,0,0,0,0|1,0,2]=4 917 B16R1.64 C#CCCCOCNC(=O)c1ccccc1 54569f6679beef1c36d3c6d443f05897 [0,1,0,0,0,0|1,0,2]=4 918 B16R1.64 C#CCCCOCOC(=O)c1ccccc1 b5dcf5e05fe0ad59bda341efcfd9ff2d [0,1,0,0,0,0|0,0,2]=3 919 B16R1.64 C#CCCNCCNC(=O)c1ccccc1 589dba93863556de89a5dbfeb3ad4feb [0,1,0,0,0,0|1,0,2]=4 920 B16R1.64 C#CCCNCCOC(=O)c1ccccc1 dc642ebcb6318f7c5c7bb364cce6d3e7 [0,1,0,0,0,0|0,0,2]=3 921 B16R1.64 C#CCCOCCCC(=O)c1ccccc1 bd05ed04adfa8ada545d6a8dd4dbfb57 [0,1,0,0,0,0|1,0,2]=4 922 B16R1.64 C#CCCOCCNC(=O)c1ccccc1 d4541499246c46c4af63364af2abd45c [0,1,0,0,0,0|1,0,2]=4 923 B16R1.64 C#CCCOCCOC(=O)c1ccccc1 bb02b757e1277b75fbcd1badbf416e8e [0,1,0,0,0,0|0,0,2]=3 924 B16R1.64 C#CCCOCCOC(=O)c1cccnc1 dbb4d6adb74872d37baa3495fee74905 [0,1,0,0,0,0|1,0,2]=4 925 B16R1.64 C#CCOCCCNC(=O)c1ccccc1 25c790ec31060bdc19472513404bc78d [0,1,0,0,0,0|1,0,2]=4 926 B16R1.64 C#CCOCCOCC(=O)c1ccccc1 8ae2e18d45487e27485ad4956e2a52f8 [0,1,0,0,0,0|1,0,2]=4 927 B16R1.64 C/C=C/CCCOCC(=O)c1ccccc1 53c6c61fe6753e15f036f2d9351706dd [0,1,0,0,0,0|0,0,2]=3 928 B16R1.64 C/C=C/CCCOCC(=O)c1ccccn1 162dba49b0b023f24ab4c94a6cf49e96 [0,1,0,0,0,0|1,0,2]=4 929 B16R1.64 C/C=C/CCCOCC(=O)c1cccnc1 893b4a0782e7fbfe60ba53a0bc6044b3 [0,1,0,0,0,0|1,0,2]=4 930 B16R1.64 C/C=C/CCCOCS(=O)c1ccccc1 83bdff6739adb830fe6173500f41b82f [0,1,0,0,0,0|1,0,2]=4 931 B16R1.64 C/C=C/CCOCCC(=O)c1ccccc1 b737a0721f0e67f40e7e2ea793ef7cfd [0,1,0,0,0,0|1,0,2]=4 932 B16R1.64 C/C=C/CCOCOC(=O)c1ccccc1 4255d5ae4a3ba9ab1c36ceed821dcc42 [0,1,0,0,0,0|0,0,2]=3 933 B16R1.64 C/C=C/COCCCC(=O)c1ccccc1 8dda952b0f49f3400fce23750b644967 [0,1,0,0,0,0|1,0,2]=4 934 B16R1.64 C/C=C/COCCNC(=O)c1ccccc1 9b18d51859bcef0c316f34ee00c0d8db [0,1,0,0,0,0|1,0,2]=4 935 B16R1.64 C/C=C/COCCOC(=O)c1ccccc1 7883d0161da2b456b6fcc252ca71dca3 [0,1,0,0,0,0|0,0,2]=3 936 B16R1.64 C/C=C/COCCOC(=O)c1cccnc1 0d9e708fe84c6ab59ab6fb57e5915626 [0,1,0,0,0,0|1,0,2]=4 937 B16R1.64 C/C=C\CCCNCC(=O)c1ccccc1 b25efb054ff9cd739fa36709424feaa6 [0,1,0,0,0,0|1,0,2]=4 938 B16R1.64 C/C=C\CCCOCC(=O)c1ccccc1 39e18bb1e02e07ce96787b37af83a96f [0,1,0,0,0,0|0,0,2]=3 939 B16R1.64 C/C=C\CCCOCC(=O)c1ccccn1 548611d02c83cba0807761cc1a473013 [0,1,0,0,0,0|1,0,2]=4 940 B16R1.64 C/C=C\CCCOCC(=O)c1cccnc1 3114e3a3e10adfe2df3c97421759e176 [0,1,0,0,0,0|1,0,2]=4 941 B16R1.64 C/C=C\CCCOCS(=O)c1ccccc1 42af6a0df52331364ac78df871e7a705 [0,1,0,0,0,0|1,0,2]=4 942 B16R1.64 C/C=C\COCCCC(=O)c1ccccc1 740504f33abbab244c4a19f4cc847d56 [0,1,0,0,0,0|1,0,2]=4 943 B16R1.64 C/C=C\COCCNC(=O)c1ccccc1 5ef9c0f873702d00f59af5895db47c85 [0,1,0,0,0,0|1,0,2]=4 944 B16R1.64 C/C=C\COCCOC(=O)c1ccccc1 49da275f066de58d4dfb0edbfdb999a1 [0,1,0,0,0,0|0,0,2]=3 945 B16R1.64 C/C=C\COCCOC(=O)c1cccnc1 2aac49e912d207f3e6bc8b2f9d059d5c [0,1,0,0,0,0|1,0,2]=4 946 B16R1.64 C=C(CCOCCCCC)c1ccncc1 81d987e9e7ce162c16e82e1de098e514 [0,1,0,0,0,0|3,0,0]=4 947 B16R1.64 C=C(CNCCCCCCl)c1ccccc1 260e8f40344a778df67c09091c620c63 [0,1,0,0,0,0|3,0,0]=4 948 B16R1.64 C=C(CNCCCCCO)c1ccccc1 bfc37421d63d4f279196fde65b06ad54 [0,1,0,0,0,0|3,0,0]=4 949 B16R1.64 C=C(COC/C=C/CCC)c1ccccc1 fbc39267f5e9648ac07b7350e8c06b0d [0,1,0,0,0,0|1,0,2]=4 950 B16R1.64 C=C(COC/C=C\CCC)c1ccccc1 48573bc769c2701f657ab505bfa41f3b [0,1,0,0,0,0|1,0,2]=4 951 B16R1.64 C=C(COCC/C=C/CC)c1ccccc1 946dcc8ab3944638d00c00654fe1e5fb [0,1,0,0,0,0|1,0,2]=4 952 B16R1.64 C=C(COCC/C=C\CC)c1ccccc1 77f19db866f24be944ec1c000308b3f2 [0,1,0,0,0,0|1,0,2]=4 953 B16R1.64 C=C(COCCC/C=C/C)c1ccccc1 00dc750f6e8e9d311fc4feae1d38b472 [0,1,0,0,0,0|1,0,2]=4 954 B16R1.64 C=C(COCCC/C=C\C)c1ccccc1 8eafb914378148c91e154805130e730b [0,1,0,0,0,0|1,0,2]=4 955 B16R1.64 C=C(COCCCC#CC)c1ccccc1 c2d4bfef6868315a8b6d431e9a8b5424 [0,1,0,0,0,0|1,0,2]=4 956 B16R1.64 C=C(COCCCC=CC)c1ccccc1 1689c21be6cf6cb2c8e5f740667a34af [0,1,0,0,0,0|1,0,2]=4 957 B16R1.64 C=C(COCCCCC#N)c1ccccc1 3d6da0635fd3025befc3615c9ce1ae3a [0,1,0,0,0,0|2,0,1]=4 958 B16R1.64 C=C(COCCCCC=O)c1ccccc1 b06188c2743bf4999e3952823e27902c [0,1,0,0,0,0|2,0,1]=4 959 B16R1.64 C=C(COCCCCCC)c1ccccc1 27b364de06bd50d739a69d1a8ce8512c [0,1,0,0,0,0|1,0,0]=2 960 B16R1.64 C=C(COCCCCCC)c1ccccn1 b9fbf6a291c07f031e49dc4963aaedbb [0,1,0,0,0,0|2,0,0]=3 961 B16R1.64 C=C(COCCCCCF)c1ccccc1 2298fb5f57e4ae180870221e5166b8ae [0,1,0,0,0,0|2,0,0]=3 962 B16R1.64 C=C(COCCCCCF)c1ccccn1 d5df74de957be7315792f1c9a4f2eebf [0,1,0,0,0,0|3,0,0]=4 963 B16R1.64 C=C(COCCCCOC)c1ccccc1 e9fda3b224fa914495471055bee7e4ae [0,1,0,0,0,0|2,0,0]=3 964 B16R1.64 C=C(COCCCCOC)c1ccccn1 ced650ac36992e018846772bd23db993 [0,1,0,0,0,0|3,0,0]=4 965 B16R1.64 C=C(COCCCCSC)c1ccccc1 bde408f71b3add472cfe978e0289a8ed [0,1,0,0,0,0|2,0,0]=3 966 B16R1.64 C=C(COCCCOCC)c1ccccc1 acbdc5003c0dd81452ab1941522f492b [0,1,0,0,0,0|2,0,0]=3 967 B16R1.64 C=C(COCCCOCC)c1ccccn1 a686344e5077d640cbe6fe565f9870ff [0,1,0,0,0,0|3,0,0]=4 968 B16R1.64 C=C(COCCCSCC)c1ccccc1 ac194f9a4ade85497115fae78276935d [0,1,0,0,0,0|2,0,0]=3 969 B16R1.64 C=C(COCCCSCC)c1ccccn1 206199b534d86bb8727768c7ef8439ef [0,1,0,0,0,0|3,0,0]=4 970 B16R1.64 C=C(COCCOCCC)c1ccccc1 5c72cb915a7d891223fdc933955db349 [0,1,0,0,0,0|2,0,0]=3 971 B16R1.64 C=C(COCCOCCC)c1ccccn1 dace6f55042b55bc61a698403e17b2b3 [0,1,0,0,0,0|3,0,0]=4 972 B16R1.64 C=C(COCCOCCF)c1ccccc1 ea2f5644faafde0ff42f57c69494d412 [0,1,0,0,0,0|3,0,0]=4 973 B16R1.64 C=C(COCCOCCS)c1ccccc1 35aab4a1fb440db957f89b22412e887e [0,1,0,0,0,0|3,0,0]=4 974 B16R1.64 C=C(COCCOCOC)c1ccccc1 2657f562c97867facef133289d59da05 [0,1,0,0,0,0|3,0,0]=4 975 B16R1.64 C=C(COCCSCCC)c1ccccc1 a0dc60de93c1b5de711764833483dfc0 [0,1,0,0,0,0|2,0,0]=3 976 B16R1.64 C=C(COCOCCCC)c1ccccc1 6ff69224bd07225d2a2863a4dac3f323 [0,1,0,0,0,0|2,0,0]=3 977 B16R1.64 C=C(COCOCCCC)c1ccccn1 9fd2fdcdabc643ff82cf33cf3be06929 [0,1,0,0,0,0|3,0,0]=4 978 B16R1.64 C=C(COCOCCOC)c1ccccc1 c2641af3ddede1b0fcc707c43b41bf76 [0,1,0,0,0,0|3,0,0]=4 979 B16R1.64 C=C=CCCOCOC(=O)c1ccccc1 e8031bc308f2118bf94b4d37da21fe13 [0,1,0,0,0,0|0,0,3]=4 980 B16R1.64 C=CCCCCCNC(=O)c1ccccc1 24533fabcd6512bb0d6492d1ad976b56 [0,1,0,0,0,0|1,0,1]=3 981 B16R1.64 C=CCCCCCNC(=O)c1ccccn1 072e40a8b5db79fe73e252cdb046140d [0,1,0,0,0,0|2,0,1]=4 982 B16R1.64 C=CCCCCCNC(=O)c1cccnc1 3d2420352dfbeabd702ece7b8a37f8e5 [0,1,0,0,0,0|2,0,1]=4 983 B16R1.64 C=CCCCCCNC(=O)c1ccncc1 391ea002be89425a5498a4dae9271a53 [0,1,0,0,0,0|2,0,1]=4 984 B16R1.64 C=CCCCCCOC(C)c1ccccc1 1def085633c16cface44290f752f85f5 [0,1,0,0,0,0|1,0,2]=4 985 B16R1.64 C=CCCCCCO[C@@H](C)c1ccccc1 aa08984d795327ada28766b6cd8a0115 [0,1,0,0,0,0|1,0,2]=4 986 B16R1.64 C=CCCCCCO[C@H](C)c1ccccc1 90be433cd1a7f3da42199982513c5e69 [0,1,0,0,0,0|1,0,2]=4 987 B16R1.64 C=CCCCCNCC(=O)c1ccccc1 45ffef5159e64b8e4c4ff9651bb3764e [0,1,0,0,0,0|1,0,2]=4 988 B16R1.64 C=CCCCCOCC(=C)c1ccccc1 4abbeb235aa52f2c0edd4e62f9850654 [0,1,0,0,0,0|1,0,2]=4 989 B16R1.64 C=CCCCCOCC(=O)c1ccccc1 112cf5605389c9f3eb3a17e3cadae684 [0,1,0,0,0,0|0,0,2]=3 990 B16R1.64 C=CCCCCOCC(=O)c1ccccn1 8b42f785bf8ecd0da68b41d13cec31e8 [0,1,0,0,0,0|1,0,2]=4 991 B16R1.64 C=CCCCCOCC(=O)c1cccnc1 c68bf7661a6adb0cc0999ccfcd548ee6 [0,1,0,0,0,0|1,0,2]=4 992 B16R1.64 C=CCCCCOCS(=O)c1ccccc1 d805e35372a707ad9a5f0ce138dcb1b2 [0,1,0,0,0,0|1,0,2]=4 993 B16R1.64 C=CCCCNCCC(=O)c1ccccc1 231857d3400bccd02ca91f6047abad9a [0,1,0,0,0,0|1,0,2]=4 994 B16R1.64 C=CCCCNCOC(=O)c1ccccc1 db762f65f209a30c4c3d34ea64cdd8ab [0,1,0,0,0,0|0,0,2]=3 995 B16R1.64 C=CCCCOCCC(=O)c1ccccc1 5f82800cec0ff445c7fe8b3ff7951f66 [0,1,0,0,0,0|1,0,2]=4 996 B16R1.64 C=CCCCOCNC(=O)c1ccccc1 74419156389aeb441c5fab33dca13ab0 [0,1,0,0,0,0|1,0,2]=4 997 B16R1.64 C=CCCCOCOC(=O)c1ccccc1 a4278ea80938a612d56db1321c7fcb51 [0,1,0,0,0,0|0,0,2]=3 998 B16R1.64 C=CCCNCCCC(=O)c1ccccc1 18af37a6912d484ce0826c4ab78cfd76 [0,1,0,0,0,0|1,0,2]=4 999 B16R1.64 C=CCCNCCNC(=O)c1ccccc1 6fc02a3ae88e99d24b270fa7c9b0748d [0,1,0,0,0,0|1,0,2]=4 1000 B16R1.64 C=CCCNCCOC(=O)c1ccccc1 1fdd4c76b98df0a55e598f6ea71c7e2a [0,1,0,0,0,0|0,0,2]=3 1001 B16R1.64 C=CCCOCCCC(=O)c1ccccc1 d5b1c97559f260877bf1768374f1a519 [0,1,0,0,0,0|1,0,2]=4 1002 B16R1.64 C=CCCOCCNC(=O)c1ccccc1 4993af7ed0c4c0265897605e2155ecbc [0,1,0,0,0,0|1,0,2]=4 1003 B16R1.64 C=CCCOCCOC(=O)c1ccccc1 6ee248d3a96c1a0f2e8e56c3ac1f6e13 [0,1,0,0,0,0|0,0,2]=3 1004 B16R1.64 C=CCCOCCOC(=O)c1cccnc1 4a7bc086650423cb09cb63b16a853723 [0,1,0,0,0,0|1,0,2]=4 1005 B16R1.64 C=CCOCCCNC(=O)c1ccccc1 3a0673e0639853d37d9abdd88e36aa3b [0,1,0,0,0,0|1,0,2]=4 1006 B16R1.64 C=CCOCCOCC(=O)c1ccccc1 b6049d6f0d0fff47dc91a9b3fa494528 [0,1,0,0,0,0|1,0,2]=4 1007 B16R1.64 C=COCCNCOC(=O)c1ccccc1 b3b3b69dfaa6cd66ec00520ceff4c1cb [0,1,0,0,0,0|1,0,2]=4 1008 B16R1.64 C=COCCOCOC(=O)c1ccccc1 835ad0315fa6743f6f9aaba09a18978d [0,1,0,0,0,0|1,0,2]=4 1009 B16R1.64 CC#CCCCNCC(=O)c1ccccc1 eeb4ccf0d6a409f4d866bd3383e7c60d [0,1,0,0,0,0|1,0,2]=4 1010 B16R1.64 CC#CCCCOCC(=O)c1ccccc1 cf80dc9d954cf613248ceb56c4228657 [0,1,0,0,0,0|0,0,2]=3 1011 B16R1.64 CC#CCCCOCC(=O)c1ccccn1 0c69bacb8f7d5b1f5d3e06e905422918 [0,1,0,0,0,0|1,0,2]=4 1012 B16R1.64 CC#CCCCOCC(=O)c1cccnc1 7580ca94a642a26643d74a611177c216 [0,1,0,0,0,0|1,0,2]=4 1013 B16R1.64 CC#CCCOCOC(=O)c1ccccc1 5179fe10a4a18c33a160f0c17bc9f0ac [0,1,0,0,0,0|0,0,2]=3 1014 B16R1.64 CC#CCNCCOC(=O)c1ccccc1 f369b6d8ac2a97de6fac9369020c78db [0,1,0,0,0,0|0,0,2]=3 1015 B16R1.64 CC#CCOCCNC(=O)c1ccccc1 697dcfc9fd8653e92da470a1906017e5 [0,1,0,0,0,0|1,0,2]=4 1016 B16R1.64 CC#CCOCCOC(=O)c1ccccc1 7b91de094e140be00b358ead8110eb18 [0,1,0,0,0,0|0,0,2]=3 1017 B16R1.64 CC#CCOCCOC(=O)c1cccnc1 ddb75970343b75b7c4057f34a1f1cede [0,1,0,0,0,0|1,0,2]=4 1018 B16R1.64 CC(COCCCCCF)c1ccccc1 e20c9d78fc4c73e7eba4df6265834412 [0,1,0,0,0,0|2,0,1]=4 1019 B16R1.64 CC(NCCCCCCF)c1ccccc1 6317e205ff42e2aeef1bb631aaf10699 [0,1,0,0,0,0|2,0,1]=4 1020 B16R1.64 CC(OCCCCCC#N)c1ccccc1 7a92c625cf085bdfe02cb9567e5a18d2 [0,1,0,0,0,0|1,0,2]=4 1021 B16R1.64 CC(OCCCCCC=O)c1ccccc1 89f959bbe25eb2b672245a2acc09a644 [0,1,0,0,0,0|1,0,2]=4 1022 B16R1.64 CC(OCCCCCCF)c1ccccc1 1651b2b97e217057e8f686758c3a0c11 [0,1,0,0,0,0|1,0,1]=3 1023 B16R1.64 CC(OCCCCCCF)c1ccccn1 f1c5707fd58d753b14940729ca8bd69c [0,1,0,0,0,0|2,0,1]=4 1024 B16R1.64 CC(OCCCCCCF)c1cccnc1 bbb43506a178b6004f59c06c6bc9bcb9 [0,1,0,0,0,0|2,0,1]=4 1025 B16R1.64 CC(OCCCCCCF)c1ccncc1 b21998eeb3aa3f72ed28d9025701f838 [0,1,0,0,0,0|2,0,1]=4 1026 B16R1.64 CC/C=C/CCOCC(=O)c1ccccc1 d154510c6b0de3f8dc460bde651dc6ab [0,1,0,0,0,0|0,0,2]=3 1027 B16R1.64 CC/C=C/CCOCC(=O)c1ccccn1 a49a54348fa3f4a084fc25a3eccb6abe [0,1,0,0,0,0|1,0,2]=4 1028 B16R1.64 CC/C=C/CCOCC(=O)c1cccnc1 ecc7d57f1579f24cfe4a8d64dd3cad68 [0,1,0,0,0,0|1,0,2]=4 1029 B16R1.64 CC/C=C/CCOCS(=O)c1ccccc1 2a33c0915576532ecf0e1fe23c1a46ed [0,1,0,0,0,0|1,0,2]=4 1030 B16R1.64 CC/C=C/COCCC(=O)c1ccccc1 bcb8cf98362a4d6c4b48df1e390a670c [0,1,0,0,0,0|1,0,2]=4 1031 B16R1.64 CC/C=C/COCNC(=O)c1ccccc1 539f175a4e8ca3da729dea5781686930 [0,1,0,0,0,0|1,0,2]=4 1032 B16R1.64 CC/C=C/COCOC(=O)c1ccccc1 0fc66270e0deb9df759964526febc04c [0,1,0,0,0,0|0,0,2]=3 1033 B16R1.64 CC/C=C\CCCOC(C)c1ccccc1 adf9045fd5522fd1e2872458e3f32979 [0,1,0,0,0,0|1,0,2]=4 1034 B16R1.64 CC/C=C\CCCO[C@@H](C)c1ccccc1 b75a7240886b8233c1d352b7ced46d2b [0,1,0,0,0,0|1,0,2]=4 1035 B16R1.64 CC/C=C\CCCO[C@H](C)c1ccccc1 d67e2783e69b05fc20363f3d25c20893 [0,1,0,0,0,0|1,0,2]=4 1036 B16R1.64 CC/C=C\CCNCC(=O)c1ccccc1 8d13ac90f54700cc2d3a623ef739e582 [0,1,0,0,0,0|1,0,2]=4 1037 B16R1.64 CC/C=C\CCOCC(=O)c1ccccc1 7794da1f07a0da21efa3fd80128b9601 [0,1,0,0,0,0|0,0,2]=3 1038 B16R1.64 CC/C=C\CCOCC(=O)c1ccccn1 a059d8417d0c93032e60d9d04b65faa6 [0,1,0,0,0,0|1,0,2]=4 1039 B16R1.64 CC/C=C\CCOCC(=O)c1cccnc1 38dcd15cf187a3b034830ff5acbfb971 [0,1,0,0,0,0|1,0,2]=4 1040 B16R1.64 CC/C=C\CCOCS(=O)c1ccccc1 d7d6883b99afcbb592037512cc0594f7 [0,1,0,0,0,0|1,0,2]=4 1041 B16R1.64 CC/C=C\COCCC(=O)c1ccccc1 591a56f330a72774f4b9b3fe0646c5c0 [0,1,0,0,0,0|1,0,2]=4 1042 B16R1.64 CC/C=C\COCOC(=O)c1ccccc1 3d0652b6058cddcf26d72fd9092a65b7 [0,1,0,0,0,0|0,0,2]=3 1043 B16R1.64 CC=C=CCCOCC(=O)c1ccccc1 87ab0976c3816348932cf626bf6cc1a2 [0,1,0,0,0,0|0,0,3]=4 1044 B16R1.64 CC=CCCCOCC(=O)c1ccccc1 8e92bf1951d0a7202b1f64ae115fd495 [0,1,0,0,0,0|0,0,2]=3 1045 B16R1.64 CC=CCCCOCC(=O)c1ccccn1 b7dac930407d00253d84ed1659b80fd3 [0,1,0,0,0,0|1,0,2]=4 1046 B16R1.64 CC=CCCCOCC(=O)c1cccnc1 37f60ef19ff58157e2a471e67943f3e5 [0,1,0,0,0,0|1,0,2]=4 1047 B16R1.64 CC=CCCCOCS(=O)c1ccccc1 c2a98ba1e9623c6afe696d8106fab757 [0,1,0,0,0,0|1,0,2]=4 1048 B16R1.64 CC=CCNCCCC(=O)c1ccccc1 b02ceb56be24fdc61c27da8fbff70136 [0,1,0,0,0,0|1,0,2]=4 1049 B16R1.64 CC=CCNCCNC(=O)c1ccccc1 3ad56803ecad2c8e8d01f8402c469ab9 [0,1,0,0,0,0|1,0,2]=4 1050 B16R1.64 CC=CCNCCOC(=O)c1ccccc1 8d98846616081bb190ff0b3a6ecaed92 [0,1,0,0,0,0|0,0,2]=3 1051 B16R1.64 CC=CCOCCCC(=O)c1ccccc1 e7d119611225b2c6a04e2751e99fa9ad [0,1,0,0,0,0|1,0,2]=4 1052 B16R1.64 CC=CCOCCNC(=O)c1ccccc1 005081f1d38cd45b47627a33e024e3f1 [0,1,0,0,0,0|1,0,2]=4 1053 B16R1.64 CC=CCOCCOC(=O)c1ccccc1 46920c1ee6d3761d786c7247d93323a5 [0,1,0,0,0,0|0,0,2]=3 1054 B16R1.64 CCC#CCCOCC(=O)c1ccccc1 9b7b405e04e745fa7a2495db23ca4d92 [0,1,0,0,0,0|0,0,2]=3 1055 B16R1.64 CCC#CCCOCC(=O)c1ccccn1 77740b44015d3d07b011e7dd32814502 [0,1,0,0,0,0|1,0,2]=4 1056 B16R1.64 CCC#CCCOCC(=O)c1cccnc1 4c29f648210bd9d2a190017dd7f6172d [0,1,0,0,0,0|1,0,2]=4 1057 B16R1.64 CCC#CCOCCC(=O)c1ccccc1 5a0c71bafc049d1b3e9f9a4ae382cb46 [0,1,0,0,0,0|1,0,2]=4 1058 B16R1.64 CCC#CCOCNC(=O)c1ccccc1 6ac194d62e34a0cc6b0ce6c903b6b8c3 [0,1,0,0,0,0|1,0,2]=4 1059 B16R1.64 CCC#CCOCOC(=O)c1ccccc1 40c627abecaa6c0a2fc2512763d443ed [0,1,0,0,0,0|0,0,2]=3 1060 B16R1.64 CCC/C=C/CNCC(=O)c1ccccc1 8b956c8890703978d9397749caa3b516 [0,1,0,0,0,0|1,0,2]=4 1061 B16R1.64 CCC/C=C/COCC(=O)c1ccccc1 8bc9e882607ebeaf3c2ec106eeea36e1 [0,1,0,0,0,0|0,0,2]=3 1062 B16R1.64 CCC/C=C/COCC(=O)c1ccccn1 d7e8e63120ff458dc078565c8009a28f [0,1,0,0,0,0|1,0,2]=4 1063 B16R1.64 CCC/C=C/COCC(=O)c1cccnc1 900a556c1c61a79095175aecc1c6bac7 [0,1,0,0,0,0|1,0,2]=4 1064 B16R1.64 CCC/C=C/COCS(=O)c1ccccc1 6e94f8adaf6f3e3b31ef9212c92559fc [0,1,0,0,0,0|1,0,2]=4 1065 B16R1.64 CCC/C=C\CNCC(=O)c1ccccc1 6b84c0cc485bd04221021607d1f60596 [0,1,0,0,0,0|1,0,2]=4 1066 B16R1.64 CCC/C=C\COCC(=O)c1ccccc1 408c65bc97cee4998f51305dcc8716e3 [0,1,0,0,0,0|0,0,2]=3 1067 B16R1.64 CCC/C=C\COCC(=O)c1ccccn1 97b45539e51b98f11402be791656ea95 [0,1,0,0,0,0|1,0,2]=4 1068 B16R1.64 CCC/C=C\COCC(=O)c1cccnc1 ff4772be1c157607286aca2928aea32b [0,1,0,0,0,0|1,0,2]=4 1069 B16R1.64 CCC/C=C\COCS(=O)c1ccccc1 3a3d4782c2fdd126239fa03fd8119571 [0,1,0,0,0,0|1,0,2]=4 1070 B16R1.64 CCCC#CCOCC(=O)c1ccccc1 6b2545f90cf1e1f2a8cdecf2e0bcba23 [0,1,0,0,0,0|0,0,2]=3 1071 B16R1.64 CCCC#CCOCC(=O)c1ccccn1 1a7fa5dda6cafefeb22f6c27ec198422 [0,1,0,0,0,0|1,0,2]=4 1072 B16R1.64 CCCC#CCOCC(=O)c1cccnc1 b4d1bb686637e808480be96d8c238456 [0,1,0,0,0,0|1,0,2]=4 1073 B16R1.64 CCCC/C=C/COC(C)c1ccccc1 70735b38a046728ff7c90723c68fd7dc [0,1,0,0,0,0|1,0,2]=4 1074 B16R1.64 CCCC/C=C/CO[C@@H](C)c1ccccc1 0c17439b0abf5b55fb99803d6e72f6a2 [0,1,0,0,0,0|1,0,2]=4 1075 B16R1.64 CCCC/C=C/CO[C@H](C)c1ccccc1 66ff6edbce8e537952829ee90a7cff79 [0,1,0,0,0,0|1,0,2]=4 1076 B16R1.64 CCCC/C=C\COC(C)c1ccccc1 8644ec513cf39b65d16ed48f0920b577 [0,1,0,0,0,0|1,0,2]=4 1077 B16R1.64 CCCC/C=C\CO[C@@H](C)c1ccccc1 2e1165c144ee5964eda82c1c217e8f2d [0,1,0,0,0,0|1,0,2]=4 1078 B16R1.64 CCCC/C=C\CO[C@H](C)c1ccccc1 f469c973461297eedff274a529d054c0 [0,1,0,0,0,0|1,0,2]=4 1079 B16R1.64 CCCCCCCCN(C)c1ccccc1 74b038637bbf9e582dc48283883eb376 [0,1,0,0,0,0|3,0,0]=4 1080 B16R1.64 CCCCCCCNC(=O)c1ccccc1 213c736e7bffe1b666a108db1c48cf21 [0,1,0,0,0,0|1,0,0]=2 1081 B16R1.64 CCCCCCCNC(=O)c1ccccn1 64aa59c4fdb95506f89426b7789436e1 [0,1,0,0,0,0|2,0,0]=3 1082 B16R1.64 CCCCCCCNC(=O)c1cccnc1 def2ef5990b4c141855ed21df82a4e34 [0,1,0,0,0,0|2,0,0]=3 1083 B16R1.64 CCCCCCCNC(=O)c1cccnn1 e6206ee5434bd16175af0f75d2594d4c [0,1,0,0,0,0|3,0,0]=4 1084 B16R1.64 CCCCCCCNC(=O)c1ccncc1 e30adc5d8d8aa079d05753ca032b1488 [0,1,0,0,0,0|2,0,0]=3 1085 B16R1.64 CCCCCCCNC(=O)c1ccncn1 0e73faf6a06f901cd5f7d8c64e0964de [0,1,0,0,0,0|3,0,0]=4 1086 B16R1.64 CCCCCCCNC(=O)c1ccnnc1 c68771194fa10d1e97fbe01ab5969fb4 [0,1,0,0,0,0|3,0,0]=4 1087 B16R1.64 CCCCCCCNC(=O)c1cnccn1 4169e85188680386d2a23edb54fd4570 [0,1,0,0,0,0|3,0,0]=4 1088 B16R1.64 CCCCCCCNC(=O)c1cncnc1 76967a47e530fbb1f7525ec2ced42ee5 [0,1,0,0,0,0|3,0,0]=4 1089 B16R1.64 CCCCCCCNC(=O)c1ncccn1 161c079a32aa060ed47dec7456ea9ba1 [0,1,0,0,0,0|3,0,0]=4 1090 B16R1.64 CCCCCCCNC(C)c1ccccc1 ed02093dc10d857d94ebb0a037992421 [0,1,0,0,0,0|2,0,1]=4 1091 B16R1.64 CCCCCCCN[C@@H](C)c1ccccc1 4df5f6c20ff0ceee1901154a68d75064 [0,1,0,0,0,0|2,0,1]=4 1092 B16R1.64 CCCCCCCN[C@H](C)c1ccccc1 d7ff22cb8f3c4a55b188f525f232e236 [0,1,0,0,0,0|2,0,1]=4 1093 B16R1.64 CCCCCCCOC(C)c1ccccc1 41fcfc572fd6f23f440911853e78f0cc [0,1,0,0,0,0|1,0,1]=3 1094 B16R1.64 CCCCCCCOC(C)c1ccccn1 6d907d087f87856791e525c7e2443bb0 [0,1,0,0,0,0|2,0,1]=4 1095 B16R1.64 CCCCCCCOC(C)c1cccnc1 76487cddb31ee9877ec0b2b02016e047 [0,1,0,0,0,0|2,0,1]=4 1096 B16R1.64 CCCCCCCOC(C)c1ccncc1 1a6cab6fb3e76830b3b8083ff8e29bc6 [0,1,0,0,0,0|2,0,1]=4 1097 B16R1.64 CCCCCCCO[C@@H](C)c1ccccc1 96f938c8c66e55b0e2b072f3f3edc5a9 [0,1,0,0,0,0|1,0,1]=3 1098 B16R1.64 CCCCCCCO[C@@H](C)c1ccccn1 95edfbf21b91a35182e47526c6cde991 [0,1,0,0,0,0|2,0,1]=4 1099 B16R1.64 CCCCCCCO[C@@H](C)c1cccnc1 0c5eff0d3340dcf585ad38ae5f767fe6 [0,1,0,0,0,0|2,0,1]=4 1100 B16R1.64 CCCCCCCO[C@@H](C)c1ccncc1 c386c99c1f7711732b24ddb51be46c91 [0,1,0,0,0,0|2,0,1]=4 1101 B16R1.64 CCCCCCCO[C@H](C)c1ccccc1 eb223f99078fbf7527b235f1d3d5c926 [0,1,0,0,0,0|1,0,1]=3 1102 B16R1.64 CCCCCCCO[C@H](C)c1ccccn1 975029fe7aa0ebd6e7425173f8d84d81 [0,1,0,0,0,0|2,0,1]=4 1103 B16R1.64 CCCCCCCO[C@H](C)c1cccnc1 c9c5db282e1e47a0d7d705014e2111a8 [0,1,0,0,0,0|2,0,1]=4 1104 B16R1.64 CCCCCCCO[C@H](C)c1ccncc1 e66d6052beaba616cf364143a3ce6d18 [0,1,0,0,0,0|2,0,1]=4 1105 B16R1.64 CCCCCCNCC(=O)c1ccccc1 57dc487b8ba8a4764f5ff17ae696e76f [0,1,0,0,0,0|1,0,0]=2 1106 B16R1.64 CCCCCCNCC(=O)c1ccccn1 22af6f868b22698b873c9f8b3573c544 [0,1,0,0,0,0|2,0,0]=3 1107 B16R1.64 CCCCCCNCC(=O)c1cccnc1 71ccc08758d151755379d73e92a299eb [0,1,0,0,0,0|2,0,0]=3 1108 B16R1.64 CCCCCCNCC(=O)c1ccncn1 4f2161063ebfbe5f778cb1f9c24ca03a [0,1,0,0,0,0|3,0,0]=4 1109 B16R1.64 CCCCCCNCC(=O)c1cnccn1 aff50ae90673b12e7ef1579d8a24b41e [0,1,0,0,0,0|3,0,0]=4 1110 B16R1.64 CCCCCCNCC(C)c1ccccc1 4a5e4fe6fdef0670104a3bb7bb5c4d5f [0,1,0,0,0,0|2,0,1]=4 1111 B16R1.64 CCCCCCNCC(F)c1ccccc1 b55e9b697cabf45685c04d3aaee921d9 [0,1,0,0,0,0|2,0,1]=4 1112 B16R1.64 CCCCCCNCC(O)c1ccccc1 e162b8cad42cfb3166174419ac2a17a4 [0,1,0,0,0,0|1,0,2]=4 1113 B16R1.64 CCCCCCNC[C@@H](C)c1ccccc1 2966fe4610255c03511ab447f51118c6 [0,1,0,0,0,0|2,0,1]=4 1114 B16R1.64 CCCCCCNC[C@@H](O)c1ccccc1 b31adffb52750e80aab58f7a7c8e0079 [0,1,0,0,0,0|1,0,2]=4 1115 B16R1.64 CCCCCCNC[C@H](C)c1ccccc1 135518850900fa41cd881495e60f85ad [0,1,0,0,0,0|2,0,1]=4 1116 B16R1.64 CCCCCCNC[C@H](O)c1ccccc1 293bb6e94702a18e6627ef77034c7bd5 [0,1,0,0,0,0|1,0,2]=4 1117 B16R1.64 CCCCCCOCC(=O)c1ccccc1 198e411277784a92995f0516949f20da [0,1,0,0,0,0|0,0,0]=1 1118 B16R1.64 CCCCCCOCC(=O)c1ccccn1 5fbbd7d2152fcafc30493c7e31d1b368 [0,1,0,0,0,0|1,0,0]=2 1119 B16R1.64 CCCCCCOCC(=O)c1cccnc1 b3a4456397faab0d92f5a00354a50f5e [0,1,0,0,0,0|1,0,0]=2 1120 B16R1.64 CCCCCCOCC(=O)c1ccncn1 f04f9e70982f2570f6e83c7c164043a6 [0,1,0,0,0,0|2,0,0]=3 1121 B16R1.64 CCCCCCOCC(=O)c1cnccn1 e32d4b7795b5b1ae38b4c91ee29417c1 [0,1,0,0,0,0|2,0,0]=3 1122 B16R1.64 CCCCCCOCC(C)c1ccccc1 c6ace5a4ac1312c66ea24cd78ceb51b2 [0,1,0,0,0,0|1,0,1]=3 1123 B16R1.64 CCCCCCOCC(C)c1ccccn1 3163fc0fa087ef8eaefa0f9fc73c2c96 [0,1,0,0,0,0|2,0,1]=4 1124 B16R1.64 CCCCCCOCC(F)c1ccccc1 c7ee6ffe9c78907eb2379ad1763495b2 [0,1,0,0,0,0|1,0,1]=3 1125 B16R1.64 CCCCCCOC[C@@H](C)c1ccccc1 605613e1b88e6a7e292489223af83238 [0,1,0,0,0,0|1,0,1]=3 1126 B16R1.64 CCCCCCOC[C@H](C)c1ccccc1 20ae887f71ad39c04fdf46aee25cae30 [0,1,0,0,0,0|1,0,1]=3 1127 B16R1.64 CCCCCNCCC(C)c1ccccc1 bd38fae47db646130a82579db7df6aeb [0,1,0,0,0,0|2,0,1]=4 1128 B16R1.64 CCCCCNCCC(O)c1ccccc1 0aea9e3e8e6373b2f64667ceb0ef9ce2 [0,1,0,0,0,0|1,0,2]=4 1129 B16R1.64 CCCCCNCCN(C)c1ccccc1 799c12a4571629563b33d3fd6e535fdd [0,1,0,0,0,0|3,0,0]=4 1130 B16R1.64 CCCCCNCC[C@@H](O)c1ccccc1 9794d7fd61617790db91a473e7803068 [0,1,0,0,0,0|1,0,2]=4 1131 B16R1.64 CCCCCNCC[C@H](O)c1ccccc1 98a5c8972a9fc9ba6df874256075b41a [0,1,0,0,0,0|1,0,2]=4 1132 B16R1.64 CCCCCNCOC(=O)c1ccccc1 c14caa3529edc6d5fad79d69bc568667 [0,1,0,0,0,0|0,0,0]=1 1133 B16R1.64 CCCCCOC/C=C(\C)/c1ccccn1 a86ed4b253b0a7d98ab8319f61d0b0bf [0,1,0,0,0,0|3,0,0]=4 1134 B16R1.64 CCCCCOCCC(=O)c1ccccc1 19fa23a60a7c13f4a9371a0f1c4ffe23 [0,1,0,0,0,0|1,0,0]=2 1135 B16R1.64 CCCCCOCCC(C)c1ccccc1 f9d32fe0d362df4173cb551a17c07570 [0,1,0,0,0,0|2,0,1]=4 1136 B16R1.64 CCCCCOCCN(C)c1ccccc1 9bacc4cbc6e5a218b64174843b25345e [0,1,0,0,0,0|3,0,0]=4 1137 B16R1.64 CCCCCOCNC(=O)c1ccccc1 142f8101740401fddddd06fe03072af9 [0,1,0,0,0,0|1,0,0]=2 1138 B16R1.64 CCCCCOCNC(=O)c1cccnc1 add06e0d93a045bcddce6beb24e1a440 [0,1,0,0,0,0|2,0,0]=3 1139 B16R1.64 CCCCCOCOC(=O)c1ccccc1 6286d0faba4598b44f257676b56da90b [0,1,0,0,0,0|0,0,0]=1 1140 B16R1.64 CCCCNCCCN(C)c1ccccc1 82d0f4b383d2553c58b721864c4f81bf [0,1,0,0,0,0|3,0,0]=4 1141 B16R1.64 CCCCNCCNC(=O)c1ccccc1 bbc4af268f54474795f508a8c9d19c95 [0,1,0,0,0,0|1,0,0]=2 1142 B16R1.64 CCCCNCCNC(=O)c1ccccn1 5b64765afdc4137bb3191a6d0b409512 [0,1,0,0,0,0|2,0,0]=3 1143 B16R1.64 CCCCNCCNC(=O)c1ccncc1 24f31a87bbf1a9f699f4f950de89e91c [0,1,0,0,0,0|2,0,0]=3 1144 B16R1.64 CCCCNCCOC(=O)c1ccccc1 807d8eae8e738cb74ebad7f607336cb5 [0,1,0,0,0,0|0,0,0]=1 1145 B16R1.64 CCCCOCCCC(=O)c1ccccc1 f85238a3362ce1ada1025ed5627f345e [0,1,0,0,0,0|1,0,0]=2 1146 B16R1.64 CCCCOCCCC(=O)c1cccnc1 e0eda3db114881031985084904ba35e2 [0,1,0,0,0,0|2,0,0]=3 1147 B16R1.64 CCCCOCCNC(=O)c1ccccc1 9e5241710217787ae99507987a333e71 [0,1,0,0,0,0|1,0,0]=2 1148 B16R1.64 CCCCOCCNC(=O)c1ccccn1 442374da307551a7c8ac4560f14b1f1a [0,1,0,0,0,0|2,0,0]=3 1149 B16R1.64 CCCCOCCNC(=O)c1cccnc1 cb731537c0f30aa8f83f1a98eac87282 [0,1,0,0,0,0|2,0,0]=3 1150 B16R1.64 CCCCOCCNC(=O)c1cccnn1 f65683248c9f9c7091a7c7bcc4c986ea [0,1,0,0,0,0|3,0,0]=4 1151 B16R1.64 CCCCOCCNC(=O)c1ccncc1 5cf346deff44a67188442301f2babdbf [0,1,0,0,0,0|2,0,0]=3 1152 B16R1.64 CCCCOCCNC(=O)c1ccncn1 71f09df085ef701dbc44f3ad541921db [0,1,0,0,0,0|3,0,0]=4 1153 B16R1.64 CCCCOCCNC(=O)c1ccnnc1 6b8b5dfc90437ea6cf3a7b94c06546d0 [0,1,0,0,0,0|3,0,0]=4 1154 B16R1.64 CCCCOCCNC(=O)c1cnccn1 4499e3b57c287f30366a558bee704b1c [0,1,0,0,0,0|3,0,0]=4 1155 B16R1.64 CCCCOCCNC(=O)c1cncnc1 052af6aa460ed8ccaa2993fda77eedb8 [0,1,0,0,0,0|3,0,0]=4 1156 B16R1.64 CCCCOCCNC(=O)c1ncccn1 5937f07c87954ae27ecad23418765bed [0,1,0,0,0,0|3,0,0]=4 1157 B16R1.64 CCCCOCCNC(C)c1ccccc1 86e793f9092028f891996f235b45846a [0,1,0,0,0,0|2,0,1]=4 1158 B16R1.64 CCCCOCCN[C@@H](C)c1ccccc1 67fa3810193112f9ce5d073ba74093ae [0,1,0,0,0,0|2,0,1]=4 1159 B16R1.64 CCCCOCCN[C@H](C)c1ccccc1 567c78bd111e106c345d03afbd62bda9 [0,1,0,0,0,0|2,0,1]=4 1160 B16R1.64 CCCCOCCOC(=O)c1ccccc1 0ec8484235b840dd19b319bfdb7165b7 [0,1,0,0,0,0|0,0,0]=1 1161 B16R1.64 CCCCOCCOC(=O)c1cccnc1 6d86879473adafb4fe781c9bd7df3497 [0,1,0,0,0,0|1,0,0]=2 1162 B16R1.64 CCCCOCCOC(C)c1ccccc1 9d9117a3c386ac608718025edb3194a5 [0,1,0,0,0,0|1,0,1]=3 1163 B16R1.64 CCCCOCCOC(C)c1ccccn1 6fcca95ad0b6e50885294279992e9150 [0,1,0,0,0,0|2,0,1]=4 1164 B16R1.64 CCCCOCCOC(C)c1cccnc1 9fc085b3a188275bdcc1f57bd74c69db [0,1,0,0,0,0|2,0,1]=4 1165 B16R1.64 CCCCOCCOC(C)c1ccncc1 1aaa97f337b88b562f86239678888e9f [0,1,0,0,0,0|2,0,1]=4 1166 B16R1.64 CCCCOCCO[C@@H](C)c1ccccc1 725630b6582e6da18b73dfbb42ac63cd [0,1,0,0,0,0|1,0,1]=3 1167 B16R1.64 CCCCOCCO[C@@H](C)c1ccccn1 9cca23e2e7867b5c6c5ce30424ba9b1f [0,1,0,0,0,0|2,0,1]=4 1168 B16R1.64 CCCCOCCO[C@@H](C)c1cccnc1 db2f8dd4b429d0752795ea52ccbeac87 [0,1,0,0,0,0|2,0,1]=4 1169 B16R1.64 CCCCOCCO[C@@H](C)c1ccncc1 8125e730808c0ce5d29fe2dcc56de3d8 [0,1,0,0,0,0|2,0,1]=4 1170 B16R1.64 CCCCOCCO[C@H](C)c1ccccc1 9f77e247178530722d9b8da5e12c3f1e [0,1,0,0,0,0|1,0,1]=3 1171 B16R1.64 CCCCOCCO[C@H](C)c1ccccn1 e0e4cf0b2f0499b23ad547460644949c [0,1,0,0,0,0|2,0,1]=4 1172 B16R1.64 CCCCOCCO[C@H](C)c1cccnc1 5621e1554335170caaf4f68af05ee7b4 [0,1,0,0,0,0|2,0,1]=4 1173 B16R1.64 CCCCOCCO[C@H](C)c1ccncc1 13335e16e1d120abb5b28903d150252a [0,1,0,0,0,0|2,0,1]=4 1174 B16R1.64 CCCCOCNCC(=O)c1ccccc1 9b422d4813b24d37072c7627cde6c70d [0,1,0,0,0,0|2,0,0]=3 1175 B16R1.64 CCCCOCOCC(=O)c1ccccc1 e23efbf2f3d1b5c4a7be447dad21dd24 [0,1,0,0,0,0|1,0,0]=2 1176 B16R1.64 CCCCOCOCC(=O)c1ccccn1 f924bdd5ed2bb89fd6b18b8de0ed2872 [0,1,0,0,0,0|2,0,0]=3 1177 B16R1.64 CCCCOCOCC(=O)c1cccnc1 58bd41bead28fe74ce6b856f035185fa [0,1,0,0,0,0|2,0,0]=3 1178 B16R1.64 CCCCOCOCC(C)c1ccccc1 27485871e857aa5f38ce70a8f481c534 [0,1,0,0,0,0|2,0,1]=4 1179 B16R1.64 CCCCOCOC[C@@H](C)c1ccccc1 d85c1975a4d7a0348759e9febf2e6499 [0,1,0,0,0,0|2,0,1]=4 1180 B16R1.64 CCCCOCOC[C@H](C)c1ccccc1 5638053a53ac7f897824ddcd21344619 [0,1,0,0,0,0|2,0,1]=4 1181 B16R1.64 CCCNCCCCN(C)c1ccccc1 0d543369f400e612d628ea81ca4f61b4 [0,1,0,0,0,0|3,0,0]=4 1182 B16R1.64 CCCOCCCCN(C)c1ccccc1 9a928d83bfa022e356b3386253f4bfc1 [0,1,0,0,0,0|3,0,0]=4 1183 B16R1.64 CCCOCCCNC(=O)c1ccccc1 21348dcf18f0d2cbd26b71589ea7cef5 [0,1,0,0,0,0|1,0,0]=2 1184 B16R1.64 CCCOCCCNC(=O)c1ccccn1 595865fa9c505e6cbb33ef215dc3a41d [0,1,0,0,0,0|2,0,0]=3 1185 B16R1.64 CCCOCCCNC(=O)c1cccnc1 b49145f44e9ab52cf578b37ef08c720d [0,1,0,0,0,0|2,0,0]=3 1186 B16R1.64 CCCOCCCNC(=O)c1cccnn1 c5f03e0052ea1ad08e8b9d06712e99c4 [0,1,0,0,0,0|3,0,0]=4 1187 B16R1.64 CCCOCCCNC(=O)c1ccncc1 5522e10bc5304b7a57e6ce1486931481 [0,1,0,0,0,0|2,0,0]=3 1188 B16R1.64 CCCOCCCNC(=O)c1ccncn1 106999e821017a042014aa1b3b330aad [0,1,0,0,0,0|3,0,0]=4 1189 B16R1.64 CCCOCCCNC(=O)c1ccnnc1 aebe379f3c97705e9c97bbaf8cf6b6ae [0,1,0,0,0,0|3,0,0]=4 1190 B16R1.64 CCCOCCCNC(=O)c1cnccn1 0ee5f4bb4890f4fb2fbaa2a49eef1cc2 [0,1,0,0,0,0|3,0,0]=4 1191 B16R1.64 CCCOCCCNC(=O)c1cncnc1 231f0bfd8f53146d92606e8303fedd7f [0,1,0,0,0,0|3,0,0]=4 1192 B16R1.64 CCCOCCCNC(=O)c1ncccn1 40a85f16894899aa6f4546e09688bdde [0,1,0,0,0,0|3,0,0]=4 1193 B16R1.64 CCCOCCCNC(C)c1ccccc1 2c4a80cf630339b6809d96a935289185 [0,1,0,0,0,0|2,0,1]=4 1194 B16R1.64 CCCOCCCN[C@@H](C)c1ccccc1 f5ccc8693758b2520ed16ff10fef3849 [0,1,0,0,0,0|2,0,1]=4 1195 B16R1.64 CCCOCCCN[C@H](C)c1ccccc1 69b18f7a9efd1f198b5d3fd0ee2082a3 [0,1,0,0,0,0|2,0,1]=4 1196 B16R1.64 CCCOCCCOC(C)c1ccccc1 15915f8d6c85b0ba039bd1917306e589 [0,1,0,0,0,0|1,0,1]=3 1197 B16R1.64 CCCOCCCOC(C)c1ccccn1 17bba5dede3ee64565f9abf99da22364 [0,1,0,0,0,0|2,0,1]=4 1198 B16R1.64 CCCOCCCOC(C)c1cccnc1 75c05ada1edab5d467422b3ffd95294d [0,1,0,0,0,0|2,0,1]=4 1199 B16R1.64 CCCOCCCOC(C)c1ccncc1 6f16ca8cda1fb663286f0efb1ee03c8f [0,1,0,0,0,0|2,0,1]=4 1200 B16R1.64 CCCOCCCO[C@@H](C)c1ccccc1 17f9ed7a6bc478646050f9b697b7687e [0,1,0,0,0,0|1,0,1]=3 1201 B16R1.64 CCCOCCCO[C@@H](C)c1ccccn1 ea00e45f9897f168732e41e9adbdb622 [0,1,0,0,0,0|2,0,1]=4 1202 B16R1.64 CCCOCCCO[C@@H](C)c1cccnc1 6318f9a4a06251afa8fee43f2556762e [0,1,0,0,0,0|2,0,1]=4 1203 B16R1.64 CCCOCCCO[C@@H](C)c1ccncc1 4dcc46e0c9fced49f8ce8202fda34338 [0,1,0,0,0,0|2,0,1]=4 1204 B16R1.64 CCCOCCCO[C@H](C)c1ccccc1 0c3ef3bd4b0c0d89c55b1b39a4e8d5fb [0,1,0,0,0,0|1,0,1]=3 1205 B16R1.64 CCCOCCCO[C@H](C)c1ccccn1 0c6fc5dbada033f697894c8eb18da400 [0,1,0,0,0,0|2,0,1]=4 1206 B16R1.64 CCCOCCCO[C@H](C)c1cccnc1 d4a9405166994a441b40f2a39e5a432c [0,1,0,0,0,0|2,0,1]=4 1207 B16R1.64 CCCOCCCO[C@H](C)c1ccncc1 60170e53234295f335078f2a5dff0b48 [0,1,0,0,0,0|2,0,1]=4 1208 B16R1.64 CCCOCCNCC(=O)c1ccccc1 4c9fcf852c780b55ea276e73950e5c61 [0,1,0,0,0,0|2,0,0]=3 1209 B16R1.64 CCCOCCNCC(=O)c1ccccn1 a5a63fd81f70f64fad3c9d3ed6e07525 [0,1,0,0,0,0|3,0,0]=4 1210 B16R1.64 CCCOCCNCC(=O)c1cccnc1 379ce4c1ded79d33d65b006674d2ef2d [0,1,0,0,0,0|3,0,0]=4 1211 B16R1.64 CCCOCCOCC(=O)c1ccccc1 8aa65eb071f3164236aa701eabad5b90 [0,1,0,0,0,0|1,0,0]=2 1212 B16R1.64 CCCOCCOCC(=O)c1ccccn1 eb78db75b4a37c9ad361a2338d47bec9 [0,1,0,0,0,0|2,0,0]=3 1213 B16R1.64 CCCOCCOCC(=O)c1cccnc1 bac9c7d1ef65ac2ab1b62cb9d795555d [0,1,0,0,0,0|2,0,0]=3 1214 B16R1.64 CCCOCCOCC(=O)c1ccncn1 3f115b181946b87aafc5b3ea0d29f0e6 [0,1,0,0,0,0|3,0,0]=4 1215 B16R1.64 CCCOCCOCC(=O)c1cnccn1 cfc6b0244384b605e37ec74912cc751c [0,1,0,0,0,0|3,0,0]=4 1216 B16R1.64 CCCOCCOCC(C)c1ccccc1 d976a4709e9cd83af07797a2d0f9b290 [0,1,0,0,0,0|2,0,1]=4 1217 B16R1.64 CCCOCCOCC(F)c1ccccc1 f9e746b0aacb34b43edad22366c5ce55 [0,1,0,0,0,0|2,0,1]=4 1218 B16R1.64 CCCOCCOCS(=O)c1ccccc1 1c933ba5b313b1307ec9ea8aa167c3b3 [0,1,0,0,0,0|2,0,0]=3 1219 B16R1.64 CCCOCCOC[C@@H](C)c1ccccc1 162be54e8782386d477f4992b728d0cb [0,1,0,0,0,0|2,0,1]=4 1220 B16R1.64 CCCOCCOC[C@H](C)c1ccccc1 e0a533f98047f7edc24bca2909571a0e [0,1,0,0,0,0|2,0,1]=4 1221 B16R1.64 CCCSCCOCC(=O)c1ccccc1 d8af3c91c714d2c724b3b7f28bc46558 [0,1,0,0,0,0|1,0,0]=2 1222 B16R1.64 CCCSCCOCC(=O)c1ccccn1 f5a1713d03f760f38de4931c5b57ccea [0,1,0,0,0,0|2,0,0]=3 1223 B16R1.64 CCCSCCOCC(=O)c1cccnc1 002be236980b915d9398b738f92804a4 [0,1,0,0,0,0|2,0,0]=3 1224 B16R1.64 CCCSCCOCC(=O)c1ccncn1 caca8f9669fff6ad6957b6c390ffe4c5 [0,1,0,0,0,0|3,0,0]=4 1225 B16R1.64 CCCSCCOCC(=O)c1cnccn1 fbb76648260555e64086e009d96c4ccd [0,1,0,0,0,0|3,0,0]=4 1226 B16R1.64 CCCSCCOCC(C)c1ccccc1 ce94dc89c94083273782ebae123a91ce [0,1,0,0,0,0|2,0,1]=4 1227 B16R1.64 CCCSCCOC[C@@H](C)c1ccccc1 6690b802dbb5e950ba4d3e173b9867d2 [0,1,0,0,0,0|2,0,1]=4 1228 B16R1.64 CCOCCCNCC(=O)c1ccccc1 fe59cb5c4224b627a2184e9c44609ff6 [0,1,0,0,0,0|2,0,0]=3 1229 B16R1.64 CCOCCCNCC(=O)c1ccccn1 325799de765038321053306128db23bc [0,1,0,0,0,0|3,0,0]=4 1230 B16R1.64 CCOCCCNCC(=O)c1cccnc1 9448e5ddb987ebcc50f473571eb3694a [0,1,0,0,0,0|3,0,0]=4 1231 B16R1.64 CCOCCCOCC(=O)c1ccccc1 43377c834b7c060624dda17081fe24dc [0,1,0,0,0,0|1,0,0]=2 1232 B16R1.64 CCOCCCOCC(=O)c1ccccn1 441a3f5e67320e3e1b7aee12d3495170 [0,1,0,0,0,0|2,0,0]=3 1233 B16R1.64 CCOCCCOCC(=O)c1cccnc1 bd249242d5e315bfc10b41307063c764 [0,1,0,0,0,0|2,0,0]=3 1234 B16R1.64 CCOCCCOCC(=O)c1ccncn1 3669378c97c7db0f3b4071865509bcbf [0,1,0,0,0,0|3,0,0]=4 1235 B16R1.64 CCOCCCOCC(=O)c1cnccn1 a6b4eb727e7b99cb404cd93edafdb05b [0,1,0,0,0,0|3,0,0]=4 1236 B16R1.64 CCOCCCOCC(C)c1ccccc1 56368adfc746815f782cad3bd1aea78b [0,1,0,0,0,0|2,0,1]=4 1237 B16R1.64 CCOCCCOC[C@@H](C)c1ccccc1 168106693aa95a3e23d268960078dcf4 [0,1,0,0,0,0|2,0,1]=4 1238 B16R1.64 CCOCCCOC[C@H](C)c1ccccc1 5a8489823dfc9aa37da6c8b9c82812cc [0,1,0,0,0,0|2,0,1]=4 1239 B16R1.64 CCOCCOCCC(=O)c1ccccc1 cb11a11a91ae1c24dec7221fe284fef4 [0,1,0,0,0,0|2,0,0]=3 1240 B16R1.64 CCOCCOCCS(=O)c1ccccc1 6ecb963c990787fb16d99205bebd0b09 [0,1,0,0,0,0|3,0,0]=4 1241 B16R1.64 CCOCCOCNC(=O)c1ccccc1 a4f00c4cc8cb84bcc6825430a3824ad1 [0,1,0,0,0,0|2,0,0]=3 1242 B16R1.64 CCOCCOCNC(=O)c1cccnc1 9aedec1e25a392155ae881f487f325b7 [0,1,0,0,0,0|3,0,0]=4 1243 B16R1.64 CCOCCOCOC(=O)c1ccccc1 43892557bd072152945913d03c0f7211 [0,1,0,0,0,0|1,0,0]=2 1244 B16R1.64 CCOCNCCNC(=O)c1ccncc1 663eedbe5be23543d6cd23dd925c2afa [0,1,0,0,0,0|3,0,0]=4 1245 B16R1.64 CCOCOCCCC(=O)c1ccccc1 656c7c49408f63d2a0e02e669da8dab3 [0,1,0,0,0,0|2,0,0]=3 1246 B16R1.64 CCOCOCCCC(=O)c1cccnc1 d168d9f023bc4d8fcf204018a2acee76 [0,1,0,0,0,0|3,0,0]=4 1247 B16R1.64 CCOCOCCNC(=O)c1ccccc1 f5915c960bdbeae852943b3fe9980e65 [0,1,0,0,0,0|2,0,0]=3 1248 B16R1.64 CCOCOCCNC(=O)c1ccccn1 07b7589eda512721692ed25ef95c3f1d [0,1,0,0,0,0|3,0,0]=4 1249 B16R1.64 CCOCOCCNC(=O)c1cccnc1 7a3a4ac8535359b35cba08017a5126ff [0,1,0,0,0,0|3,0,0]=4 1250 B16R1.64 CCOCOCCNC(=O)c1ccncc1 bf76dd42dfae71a7d6098d6ce761f582 [0,1,0,0,0,0|3,0,0]=4 1251 B16R1.64 CCOCOCCOC(=O)c1ccccc1 c0785b6464616548950bfe7544304257 [0,1,0,0,0,0|1,0,0]=2 1252 B16R1.64 CCOCOCCOC(=O)c1cccnc1 3d0d50f59f12bad2815eca750582b2d1 [0,1,0,0,0,0|2,0,0]=3 1253 B16R1.64 CCSCCCCNC(=O)c1ccccc1 3271a6cdf70758cd7b642e12a9c3a45d [0,1,0,0,0,0|1,0,0]=2 1254 B16R1.64 CCSCCCCNC(=O)c1ccccn1 0983ffefe8f4f91d9e4fddf53834972c [0,1,0,0,0,0|2,0,0]=3 1255 B16R1.64 CCSCCCCNC(=O)c1cccnc1 6c71474e4151234f77ed7e6e2dc41be4 [0,1,0,0,0,0|2,0,0]=3 1256 B16R1.64 CCSCCCCNC(=O)c1cccnn1 c92d3586ddba41ffb8f7b83c0054b16f [0,1,0,0,0,0|3,0,0]=4 1257 B16R1.64 CCSCCCCNC(=O)c1ccncc1 344bd514d02e71ff9532994d7088d426 [0,1,0,0,0,0|2,0,0]=3 1258 B16R1.64 CCSCCCCNC(=O)c1ccncn1 64954eb132a080dc19b6c1fcd647d7ae [0,1,0,0,0,0|3,0,0]=4 1259 B16R1.64 CCSCCCCNC(=O)c1ccnnc1 b1670bacd671acf39feea6772c6c266e [0,1,0,0,0,0|3,0,0]=4 1260 B16R1.64 CCSCCCCNC(=O)c1cnccn1 d21ea516eb6862e498932aa39239ed71 [0,1,0,0,0,0|3,0,0]=4 1261 B16R1.64 CCSCCCCNC(=O)c1cncnc1 0145baf21d8e0b37b174700460d0310f [0,1,0,0,0,0|3,0,0]=4 1262 B16R1.64 CCSCCCCNC(=O)c1ncccn1 d3b4b52a3828376454bc6ce008cd94a0 [0,1,0,0,0,0|3,0,0]=4 1263 B16R1.64 CCSCCCNCC(=O)c1ccccc1 77f6eefd9e5a68bdf1631773002e00e0 [0,1,0,0,0,0|2,0,0]=3 1264 B16R1.64 CCSCCCOCC(=O)c1ccccc1 92f92241dddbfcc83124c1d2995a5b7e [0,1,0,0,0,0|1,0,0]=2 1265 B16R1.64 CCSCCCOCC(=O)c1ccccn1 3602612c5f00e9fec0664258e6e87653 [0,1,0,0,0,0|2,0,0]=3 1266 B16R1.64 CCSCCCOCC(=O)c1cccnc1 1694012b6cfcb51e7841ac0b56e72fe9 [0,1,0,0,0,0|2,0,0]=3 1267 B16R1.64 CCSCCCOCC(=O)c1ccncn1 77e2c77c8bd8510984d21f7ae98937c3 [0,1,0,0,0,0|3,0,0]=4 1268 B16R1.64 CCSCCCOCC(=O)c1cnccn1 3b0d123fb28753017771d01c75060aaa [0,1,0,0,0,0|3,0,0]=4 1269 B16R1.64 CCSCCCOCC(C)c1ccccc1 aa4e7da695113f3bde9160519588df99 [0,1,0,0,0,0|2,0,1]=4 1270 B16R1.64 CCSCCCOCC(F)c1ccccc1 676cff45c1e13b2b16f8866aaabb9384 [0,1,0,0,0,0|2,0,1]=4 1271 B16R1.64 CCSCCCOC[C@@H](C)c1ccccc1 f7855b90a8bba8926f57e3c5ba2a4c50 [0,1,0,0,0,0|2,0,1]=4 1272 B16R1.64 CCSCCCOC[C@H](C)c1ccccc1 34d2d66d14782947ff6d91037a7e643b [0,1,0,0,0,0|2,0,1]=4 1273 B16R1.64 CCSCCNCOC(=O)c1ccccc1 b79b1291de6058ed4aff85295b06e7fd [0,1,0,0,0,0|1,0,0]=2 1274 B16R1.64 CCSCCOCCC(=O)c1ccccc1 34c7f9032a1ab1ddd294811e1feef3ad [0,1,0,0,0,0|2,0,0]=3 1275 B16R1.64 CCSCCOCNC(=O)c1ccccc1 4a6c178f6e36b8178735a49593fb0da7 [0,1,0,0,0,0|2,0,0]=3 1276 B16R1.64 CCSCCOCNC(=O)c1cccnc1 bc37798efd6987e3273cc1818fe6efe6 [0,1,0,0,0,0|3,0,0]=4 1277 B16R1.64 CCSCCOCOC(=O)c1ccccc1 63c84b89d5f695064f7bac4d6768cdb5 [0,1,0,0,0,0|1,0,0]=2 1278 B16R1.64 COCCCCCCN(C)c1ccccc1 807dfd372a7e6b332f8b1f2d2fd68183 [0,1,0,0,0,0|3,0,0]=4 1279 B16R1.64 COCCCCCNC(=O)c1ccccc1 994e2376575155efe6c2ac5d5ac6414e [0,1,0,0,0,0|1,0,0]=2 1280 B16R1.64 COCCCCCNC(=O)c1ccccn1 4b90584d1e9dec28f1635678facce21a [0,1,0,0,0,0|2,0,0]=3 1281 B16R1.64 COCCCCCNC(=O)c1cccnc1 eaa1399e3351d6b6d4dd7ffb7f856816 [0,1,0,0,0,0|2,0,0]=3 1282 B16R1.64 COCCCCCNC(=O)c1cccnn1 779a04ca621edb02509c765f17b60607 [0,1,0,0,0,0|3,0,0]=4 1283 B16R1.64 COCCCCCNC(=O)c1ccncc1 72f49735995be0be7c72cd0d86a6135c [0,1,0,0,0,0|2,0,0]=3 1284 B16R1.64 COCCCCCNC(=O)c1ccncn1 a5f8eb23ca71babe910f87aa49d16700 [0,1,0,0,0,0|3,0,0]=4 1285 B16R1.64 COCCCCCNC(=O)c1ccnnc1 d1d6294788c9585238fddb23ac26c346 [0,1,0,0,0,0|3,0,0]=4 1286 B16R1.64 COCCCCCNC(=O)c1cnccn1 b4b8b5f946b1d7ba4da1ee25288e40c9 [0,1,0,0,0,0|3,0,0]=4 1287 B16R1.64 COCCCCCNC(=O)c1cncnc1 9ae6123c41f6d963aeb8574b36dc024c [0,1,0,0,0,0|3,0,0]=4 1288 B16R1.64 COCCCCCNC(=O)c1ncccn1 9146bf8979d813be749397f7a4567512 [0,1,0,0,0,0|3,0,0]=4 1289 B16R1.64 COCCCCCNC(C)c1ccccc1 7f801346533cf4e26e8084f39bd51262 [0,1,0,0,0,0|2,0,1]=4 1290 B16R1.64 COCCCCCN[C@@H](C)c1ccccc1 d2f93489d19fd9152de21bf7da9e7c05 [0,1,0,0,0,0|2,0,1]=4 1291 B16R1.64 COCCCCCN[C@H](C)c1ccccc1 9995eeb5841f1677fdce9de2f2e502b6 [0,1,0,0,0,0|2,0,1]=4 1292 B16R1.64 COCCCCCOC(C)c1ccccc1 e397869a4ada7682d4cd5220e0bd94cc [0,1,0,0,0,0|1,0,1]=3 1293 B16R1.64 COCCCCCOC(C)c1ccccn1 5796078fbe62f71fee5e0d7e98b4c751 [0,1,0,0,0,0|2,0,1]=4 1294 B16R1.64 COCCCCCOC(C)c1cccnc1 78ea80993418b2024750b94665209812 [0,1,0,0,0,0|2,0,1]=4 1295 B16R1.64 COCCCCCOC(C)c1ccncc1 71c071c7604448d11a75165dbc14a1ac [0,1,0,0,0,0|2,0,1]=4 1296 B16R1.64 COCCCCCO[C@@H](C)c1ccccc1 63a3c903b44ee4ab91bb423e6d528d6d [0,1,0,0,0,0|1,0,1]=3 1297 B16R1.64 COCCCCCO[C@@H](C)c1ccccn1 0d3d2012052347d2579ce0d46ffb6b45 [0,1,0,0,0,0|2,0,1]=4 1298 B16R1.64 COCCCCCO[C@@H](C)c1cccnc1 6cdee901b33d1751826da7721e7e1cb2 [0,1,0,0,0,0|2,0,1]=4 1299 B16R1.64 COCCCCCO[C@@H](C)c1ccncc1 c2a11804fa0247af25b6ac5019ce5619 [0,1,0,0,0,0|2,0,1]=4 1300 B16R1.64 COCCCCCO[C@H](C)c1ccccc1 d0076c0289004c8c36a6aac933d9e22e [0,1,0,0,0,0|1,0,1]=3 1301 B16R1.64 COCCCCCO[C@H](C)c1ccccn1 a454644705199dc24ab390b05b762799 [0,1,0,0,0,0|2,0,1]=4 1302 B16R1.64 COCCCCCO[C@H](C)c1cccnc1 6e0ae2478a06a91f825bb8559bc2b62d [0,1,0,0,0,0|2,0,1]=4 1303 B16R1.64 COCCCCCO[C@H](C)c1ccncc1 48f590292bceeba69ae3e9ce92afc1c1 [0,1,0,0,0,0|2,0,1]=4 1304 B16R1.64 COCCCCNCC(=O)c1ccccc1 c321702f79bab1f3e8ddac6d389393c2 [0,1,0,0,0,0|2,0,0]=3 1305 B16R1.64 COCCCCNCC(=O)c1ccccn1 2ca8bf8cbcb28c10b6909b472bec14fc [0,1,0,0,0,0|3,0,0]=4 1306 B16R1.64 COCCCCNCC(=O)c1cccnc1 fd6b9702a9eb37e02825733ef1a16dc5 [0,1,0,0,0,0|3,0,0]=4 1307 B16R1.64 COCCCCOCC(=O)c1ccccc1 ee5d86e8d5259fc5e47262959920136c [0,1,0,0,0,0|1,0,0]=2 1308 B16R1.64 COCCCCOCC(=O)c1ccccn1 934d664ad0a681eebf2d51f94c18b319 [0,1,0,0,0,0|2,0,0]=3 1309 B16R1.64 COCCCCOCC(=O)c1cccnc1 85f68ed7a487c1b097aa19b9682b69c0 [0,1,0,0,0,0|2,0,0]=3 1310 B16R1.64 COCCCCOCC(=O)c1ccncn1 1687157ea3203d0e0d0f89b91a5e1d17 [0,1,0,0,0,0|3,0,0]=4 1311 B16R1.64 COCCCCOCC(=O)c1cnccn1 833a0cb2abc089152a395d900e9297bb [0,1,0,0,0,0|3,0,0]=4 1312 B16R1.64 COCCCCOCC(C)c1ccccc1 c52fa05c519f2c7dd7d888a8eb5a0dce [0,1,0,0,0,0|2,0,1]=4 1313 B16R1.64 COCCCCOCC(F)c1ccccc1 6e23e81112bb4ce463a596972e2cebad [0,1,0,0,0,0|2,0,1]=4 1314 B16R1.64 COCCCCOC[C@@H](C)c1ccccc1 bcf2c5ae75f7ee1dbf21599f73e2c1e1 [0,1,0,0,0,0|2,0,1]=4 1315 B16R1.64 COCCCCOC[C@H](C)c1ccccc1 37c14574bd1dfda6a86af93c0aad63cd [0,1,0,0,0,0|2,0,1]=4 1316 B16R1.64 COCCCNCOC(=O)c1ccccc1 a0a2d82186e7398e499ab6c53983f07b [0,1,0,0,0,0|1,0,0]=2 1317 B16R1.64 COCCCOCCC(=O)c1ccccc1 5ded106c1e247cfdc0a4b6d9c3d0b739 [0,1,0,0,0,0|2,0,0]=3 1318 B16R1.64 COCCCOCCS(=O)c1ccccc1 9782b6dd8abccd91fc6a622f0c554f59 [0,1,0,0,0,0|3,0,0]=4 1319 B16R1.64 COCCCOCNC(=O)c1ccccc1 75a2bad8d4091cbcc85de04c985e7916 [0,1,0,0,0,0|2,0,0]=3 1320 B16R1.64 COCCCOCNC(=O)c1cccnc1 055beb4aff82462a52a2799161bedc37 [0,1,0,0,0,0|3,0,0]=4 1321 B16R1.64 COCCCOCOC(=O)c1ccccc1 1db16353e815d6c9861f6d23718f864f [0,1,0,0,0,0|1,0,0]=2 1322 B16R1.64 COCCNCCNC(=O)c1ccccn1 f9b3b8438c6fff22d3609ee6f3edcea9 [0,1,0,0,0,0|3,0,0]=4 1323 B16R1.64 COCCNCCNC(=O)c1ccncc1 6e058a6dbb77ab9456703f3eef7fe4ec [0,1,0,0,0,0|3,0,0]=4 1324 B16R1.64 COCCNCCOC(=O)c1ccccc1 b254cadccda4d8ae0b617e75566f545d [0,1,0,0,0,0|1,0,0]=2 1325 B16R1.64 COCCOCCCC(=O)c1ccccc1 9c3838155c8835ddb0a04e801addd15e [0,1,0,0,0,0|2,0,0]=3 1326 B16R1.64 COCCOCCCC(=O)c1cccnc1 2c619fc634b4db16318856c1f01989a5 [0,1,0,0,0,0|3,0,0]=4 1327 B16R1.64 COCCOCCCS(=O)c1ccccc1 d7e6d2600d542b54f499b059e269119c [0,1,0,0,0,0|3,0,0]=4 1328 B16R1.64 COCCOCCNC(=O)c1ccccc1 de28550ff69a2f9bdbc8869ab617ff3b [0,1,0,0,0,0|2,0,0]=3 1329 B16R1.64 COCCOCCNC(=O)c1ccccn1 b45d0c688b9a237dbd20c9fb5d3766bb [0,1,0,0,0,0|3,0,0]=4 1330 B16R1.64 COCCOCCNC(=O)c1cccnc1 95430445128d166235d8d97b1559ad3b [0,1,0,0,0,0|3,0,0]=4 1331 B16R1.64 COCCOCCNC(=O)c1ccncc1 984e66a8a90a9e2ef3ac86834dfcfc05 [0,1,0,0,0,0|3,0,0]=4 1332 B16R1.64 COCCOCCOC(=O)c1ccccc1 b37ee447f119520ab58bdce9aa19bf49 [0,1,0,0,0,0|1,0,0]=2 1333 B16R1.64 COCCOCCOC(=O)c1cccnc1 dafb9f5589de1dcb2bda67f576290560 [0,1,0,0,0,0|2,0,0]=3 1334 B16R1.64 COCCOCCOC(C)c1ccccc1 ee9147e4164a20140b79e24198e52b06 [0,1,0,0,0,0|2,0,1]=4 1335 B16R1.64 COCCOCCO[C@@H](C)c1ccccc1 0406023939c6fdadeaea3fb33428e2af [0,1,0,0,0,0|2,0,1]=4 1336 B16R1.64 COCCOCCO[C@H](C)c1ccccc1 49e8aaa8d71573f0738dcb38f5b0f887 [0,1,0,0,0,0|2,0,1]=4 1337 B16R1.64 COCCOCNCC(=O)c1ccccc1 e26b05e7eaabfab4b34ad63f569cd8f8 [0,1,0,0,0,0|3,0,0]=4 1338 B16R1.64 COCCOCOCC(=O)c1ccccc1 acd97d1922532f80d0bda8d110dd9633 [0,1,0,0,0,0|2,0,0]=3 1339 B16R1.64 COCCOCOCC(=O)c1ccccn1 c9da9eb0aa91331341b2ac1ed49fbef2 [0,1,0,0,0,0|3,0,0]=4 1340 B16R1.64 COCCOCOCC(=O)c1cccnc1 813042e1a35a7e36262652a9cb63a549 [0,1,0,0,0,0|3,0,0]=4 1341 B16R1.64 COCOCCCNC(=O)c1ccccc1 ebe0411b9b2dd0dc6c9fe5065af98983 [0,1,0,0,0,0|2,0,0]=3 1342 B16R1.64 COCOCCNCC(=O)c1ccccc1 6db9111850827f2459e152e1080a13d7 [0,1,0,0,0,0|3,0,0]=4 1343 B16R1.64 COCOCCOCC(=O)c1ccccc1 580fa6da24a647a24fc0d11a72c469c0 [0,1,0,0,0,0|2,0,0]=3 1344 B16R1.64 COCOCCOCC(=O)c1ccccn1 249af8957098bc3cb6672831fc891722 [0,1,0,0,0,0|3,0,0]=4 1345 B16R1.64 COCOCCOCC(=O)c1cccnc1 3d92a46ba391dbec0a1ad30328815c06 [0,1,0,0,0,0|3,0,0]=4 1346 B16R1.64 CSCCCCNCC(=O)c1ccccc1 df1f24f2413bcb177885d13b9fb4507b [0,1,0,0,0,0|2,0,0]=3 1347 B16R1.64 CSCCCCNCC(=O)c1ccccn1 330aef346bdb024840e5150fab1e3f6d [0,1,0,0,0,0|3,0,0]=4 1348 B16R1.64 CSCCCCNCC(=O)c1cccnc1 928c860ad2fd15f021b5bba05115fec6 [0,1,0,0,0,0|3,0,0]=4 1349 B16R1.64 CSCCCCOCC(=O)c1ccccc1 671290897c2e56fbeb46dc4e0b112253 [0,1,0,0,0,0|1,0,0]=2 1350 B16R1.64 CSCCCCOCC(=O)c1ccccn1 d09ceebae01cdf4909395ab08dda14da [0,1,0,0,0,0|2,0,0]=3 1351 B16R1.64 CSCCCCOCC(=O)c1cccnc1 3e0e501269442f456fbfbe5979dd618e [0,1,0,0,0,0|2,0,0]=3 1352 B16R1.64 CSCCCCOCC(=O)c1ccncn1 008131e7e7597bff45cfcc8b3f3b2b91 [0,1,0,0,0,0|3,0,0]=4 1353 B16R1.64 CSCCCCOCC(=O)c1cnccn1 fe0250fcdb6d528ffe5082521655cc94 [0,1,0,0,0,0|3,0,0]=4 1354 B16R1.64 CSCCCCOCC(C)c1ccccc1 372464ecc4afbcaf4b5f90734f95f76f [0,1,0,0,0,0|2,0,1]=4 1355 B16R1.64 CSCCCCOCC(F)c1ccccc1 57dde96c8052bfc47f89f6aece114620 [0,1,0,0,0,0|2,0,1]=4 1356 B16R1.64 CSCCCCOC[C@@H](C)c1ccccc1 5a2ee2ca17cdcba9297e9843f17ecf24 [0,1,0,0,0,0|2,0,1]=4 1357 B16R1.64 CSCCCNCOC(=O)c1ccccc1 a797488f4c0015e2cfef886c9a33b69b [0,1,0,0,0,0|1,0,0]=2 1358 B16R1.64 CSCCCOCCC(=O)c1ccccc1 24744904469237613b0d385e2783bc42 [0,1,0,0,0,0|2,0,0]=3 1359 B16R1.64 CSCCCOCCS(=O)c1ccccc1 32a1555175140c19286ccab1818f7fd7 [0,1,0,0,0,0|3,0,0]=4 1360 B16R1.64 CSCCCOCNC(=O)c1ccccc1 9ee5743d6c49574a3e3b239a2dee338c [0,1,0,0,0,0|2,0,0]=3 1361 B16R1.64 CSCCCOCNC(=O)c1cccnc1 1e3cc5d1bfce74c1504a769fffa93bf7 [0,1,0,0,0,0|3,0,0]=4 1362 B16R1.64 CSCCCOCOC(=O)c1ccccc1 d0cee5ddb078832e46a35e80e8e9408a [0,1,0,0,0,0|1,0,0]=2 1363 B16R1.64 CSCCNCCNC(=O)c1ccccc1 2f77c7bdfed6056d5f52fb397a7360ed [0,1,0,0,0,0|2,0,0]=3 1364 B16R1.64 CSCCNCCNC(=O)c1ccccn1 a998ea4b00835de06c7144e17b59e95e [0,1,0,0,0,0|3,0,0]=4 1365 B16R1.64 CSCCNCCNC(=O)c1ccncc1 e944912eab1969d6232216a56d6a6dc7 [0,1,0,0,0,0|3,0,0]=4 1366 B16R1.64 CSCCNCCOC(=O)c1ccccc1 53fa2a809010c6002b95d162a6b87baf [0,1,0,0,0,0|1,0,0]=2 1367 B16R1.64 CSCCOCCCC(=O)c1ccccc1 fb66995d69440c889dc6ef0e0c59778e [0,1,0,0,0,0|2,0,0]=3 1368 B16R1.64 CSCCOCCCC(=O)c1cccnc1 ee041fabdcf287baf10e805b852e6de8 [0,1,0,0,0,0|3,0,0]=4 1369 B16R1.64 CSCCOCCCS(=O)c1ccccc1 0c185d887160abcdf1f3aaa19b057eda [0,1,0,0,0,0|3,0,0]=4 1370 B16R1.64 CSCCOCCNC(=O)c1ccccc1 1daef649b5c5aaa46fad5dc1c220b6b7 [0,1,0,0,0,0|2,0,0]=3 1371 B16R1.64 CSCCOCCNC(=O)c1ccccn1 5007f064938596037bb9a7b2ca834aae [0,1,0,0,0,0|3,0,0]=4 1372 B16R1.64 CSCCOCCNC(=O)c1cccnc1 66dc29b74e810a3dfcf1c39a434e270b [0,1,0,0,0,0|3,0,0]=4 1373 B16R1.64 CSCCOCCNC(=O)c1ccncc1 9903b0f7027f6e429d8cdcfc9eac8ed1 [0,1,0,0,0,0|3,0,0]=4 1374 B16R1.64 CSCCOCCOC(=O)c1ccccc1 0fbf23c9cdaa789e6eb9fd7a81095021 [0,1,0,0,0,0|1,0,0]=2 1375 B16R1.64 CSCCOCCOC(=O)c1cccnc1 abb77e8ef41cdc30dd69a930368bca0a [0,1,0,0,0,0|2,0,0]=3 1376 B16R1.64 CSCOCCCNC(=O)c1ccccc1 85ef90e85a27e01f6ed34fb113d60bab [0,1,0,0,0,0|2,0,0]=3 1377 B16R1.64 C[C@@H](COCCCCCF)c1ccccc1 96aa13abef764a210937c76aef0386b9 [0,1,0,0,0,0|2,0,1]=4 1378 B16R1.64 C[C@@H](NCCCCCCF)c1ccccc1 94ff97151407cb2317598a8f4baafd1e [0,1,0,0,0,0|2,0,1]=4 1379 B16R1.64 C[C@@H](OCCCCCC#N)c1ccccc1 6a9400df646ca6bfea247072916b850f [0,1,0,0,0,0|1,0,2]=4 1380 B16R1.64 C[C@@H](OCCCCCC=O)c1ccccc1 c48959db2ac3eee8aac143c4ece753f4 [0,1,0,0,0,0|1,0,2]=4 1381 B16R1.64 C[C@@H](OCCCCCCF)c1ccccc1 22ffa5740f657a0fbd2c7af61f0c9ced [0,1,0,0,0,0|1,0,1]=3 1382 B16R1.64 C[C@@H](OCCCCCCF)c1ccccn1 f82a50086d529d0a3742fc6145d4c820 [0,1,0,0,0,0|2,0,1]=4 1383 B16R1.64 C[C@@H](OCCCCCCF)c1cccnc1 680b16bc2375185a895fee786213c7a1 [0,1,0,0,0,0|2,0,1]=4 1384 B16R1.64 C[C@@H](OCCCCCCF)c1ccncc1 91d56ed00d7fff50e763ba9af32c0706 [0,1,0,0,0,0|2,0,1]=4 1385 B16R1.64 C[C@H](COCCCCCF)c1ccccc1 5059c3f4bfc0fedf971d24940e234702 [0,1,0,0,0,0|2,0,1]=4 1386 B16R1.64 C[C@H](NCCCCCCF)c1ccccc1 9a00d62d9ab7006042fbba426e02bdc8 [0,1,0,0,0,0|2,0,1]=4 1387 B16R1.64 C[C@H](OCCCCCC#N)c1ccccc1 e4425c1b41de838003f4353ea376e9ee [0,1,0,0,0,0|1,0,2]=4 1388 B16R1.64 C[C@H](OCCCCCC=O)c1ccccc1 b574550da83804342d0dad6aca4ed3c1 [0,1,0,0,0,0|1,0,2]=4 1389 B16R1.64 C[C@H](OCCCCCCF)c1ccccc1 8e28716198c22134b321fe31c5bd2435 [0,1,0,0,0,0|1,0,1]=3 1390 B16R1.64 C[C@H](OCCCCCCF)c1ccccn1 55c09eec4d39b758728abd1021687c1c [0,1,0,0,0,0|2,0,1]=4 1391 B16R1.64 C[C@H](OCCCCCCF)c1cccnc1 f35ceb4335044299cd8324ffc4af0d0b [0,1,0,0,0,0|2,0,1]=4 1392 B16R1.64 C[C@H](OCCCCCCF)c1ccncc1 313b0f4d505959e99d16ef3584d21bf4 [0,1,0,0,0,0|2,0,1]=4 1393 B16R1.64 N#CCCCCCNC(=O)c1ccccc1 58964df8d80524529c386495d2be511b [0,1,0,0,0,0|1,0,1]=3 1394 B16R1.64 N#CCCCCCNC(=O)c1ccccn1 37a20ef32c2b55cb1a696889be6a193f [0,1,0,0,0,0|2,0,1]=4 1395 B16R1.64 N#CCCCCCNC(=O)c1cccnc1 69ba3cb2547f30334a1bc7e1d6227637 [0,1,0,0,0,0|2,0,1]=4 1396 B16R1.64 N#CCCCCCNC(=O)c1ccncc1 695a0447c9e88156067c677805495aa3 [0,1,0,0,0,0|2,0,1]=4 1397 B16R1.64 N#CCCCCNCC(=O)c1ccccc1 1af7d2fcada74c0587d291cf9f9f7fc1 [0,1,0,0,0,0|2,0,1]=4 1398 B16R1.64 N#CCCCCOCC(=O)c1ccccc1 d00cc1f1e95c368d660a50a02e43938f [0,1,0,0,0,0|1,0,1]=3 1399 B16R1.64 N#CCCCCOCC(=O)c1ccccn1 48a195aa2f87a302df0fe36157cf8de8 [0,1,0,0,0,0|2,0,1]=4 1400 B16R1.64 N#CCCCCOCC(=O)c1cccnc1 1690a9d63e2575699cab9625bfbf8f34 [0,1,0,0,0,0|2,0,1]=4 1401 B16R1.64 N#CCCCNCOC(=O)c1ccccc1 885284bb01269c13fc7d1e2a4eea484b [0,1,0,0,0,0|1,0,1]=3 1402 B16R1.64 N#CCCCOCCC(=O)c1ccccc1 c59dc1d8257694122262cfe6b941a87f [0,1,0,0,0,0|2,0,1]=4 1403 B16R1.64 N#CCCCOCNC(=O)c1ccccc1 2a5b095083d30d9458265f41842664b4 [0,1,0,0,0,0|2,0,1]=4 1404 B16R1.64 N#CCCCOCOC(=O)c1ccccc1 88326c6f7b2bceef3a748c87f142709c [0,1,0,0,0,0|1,0,1]=3 1405 B16R1.64 N#CCCNCCNC(=O)c1ccccc1 039baf936e39f66b08988de90e290527 [0,1,0,0,0,0|2,0,1]=4 1406 B16R1.64 N#CCCNCCOC(=O)c1ccccc1 827e6d08f98e3a02e8a2d63b193c42b9 [0,1,0,0,0,0|1,0,1]=3 1407 B16R1.64 N#CCCOCCCC(=O)c1ccccc1 7a4e1a4f01d28592e44d4d51295f21d5 [0,1,0,0,0,0|2,0,1]=4 1408 B16R1.64 N#CCCOCCNC(=O)c1ccccc1 855040e7c4b06d6f87b6be20197ffa2d [0,1,0,0,0,0|2,0,1]=4 1409 B16R1.64 N#CCCOCCOC(=O)c1ccccc1 216fab4858eb49ac3852d798f5125426 [0,1,0,0,0,0|1,0,1]=3 1410 B16R1.64 N#CCCOCCOC(=O)c1cccnc1 48de8ac9f747f7533d0aca0876c844a7 [0,1,0,0,0,0|2,0,1]=4 1411 B16R1.64 N#CCOCCCNC(=O)c1ccccc1 a64c508d8821dacf0cc8333d940e9915 [0,1,0,0,0,0|2,0,1]=4 1412 B16R1.64 N#CCOCCOCC(=O)c1ccccc1 84b1aebe9bab8ea8cd6b2547c7748706 [0,1,0,0,0,0|2,0,1]=4 1413 B16R1.64 N#CNCCCCOC(=O)c1ccccc1 4063fef3f4e52feea5ec6452bdb8a27f [0,1,0,0,0,0|1,0,1]=3 1414 B16R1.64 N#CSCOCCOC(=O)c1ccccc1 6248ca14c1d04ffee9de0a8397abb9a9 [0,1,0,0,0,0|2,0,1]=4 1415 B16R1.64 NOCCCCNCC(=O)c1ccccc1 bf5e94370c9eeb503d0e434b4f2d43fd [0,1,0,0,0,0|3,0,0]=4 1416 B16R1.64 NOCCNCCOC(=O)c1ccccc1 6a5892f88d0fdd943481960ee62f4182 [0,1,0,0,0,0|2,0,0]=3 1417 B16R1.64 NOCCOCCNC(=O)c1ccccc1 99e2edc3d5ccde3752843f4bdc890573 [0,1,0,0,0,0|3,0,0]=4 1418 B16R1.64 O=C(CCCOCCCF)c1ccccc1 40a53ae71e53ef6f43367a3d4a7f03aa [0,1,0,0,0,0|2,0,0]=3 1419 B16R1.64 O=C(CCCOCCCF)c1cccnc1 fe3de2002197b9b8db4bcccadf3763cd [0,1,0,0,0,0|3,0,0]=4 1420 B16R1.64 O=C(CCCOCCCS)c1ccccc1 4f2f7e206f3a569f2e7fb6f089469cc5 [0,1,0,0,0,0|2,0,0]=3 1421 B16R1.64 O=C(CCCOCCCS)c1cccnc1 799645589db4a06b01a6e709043741bf [0,1,0,0,0,0|3,0,0]=4 1422 B16R1.64 O=C(CCOCCCCF)c1ccccc1 c58d0e1e8bf5815292ee1e5057ca9d09 [0,1,0,0,0,0|2,0,0]=3 1423 B16R1.64 O=C(CNCCCCCCl)c1ccccc1 52c888442bc899dbd41358feccfc5565 [0,1,0,0,0,0|2,0,0]=3 1424 B16R1.64 O=C(CNCCCCCCl)c1ccccn1 1902f9e5fb0f516a0b431cd0b0dafcb2 [0,1,0,0,0,0|3,0,0]=4 1425 B16R1.64 O=C(CNCCCCCCl)c1cccnc1 bb1c940851b667c61aef267dc7918a35 [0,1,0,0,0,0|3,0,0]=4 1426 B16R1.64 O=C(CNCCCCCF)c1ccccc1 91998f42bcf1c63afbfa6f907864eb45 [0,1,0,0,0,0|2,0,0]=3 1427 B16R1.64 O=C(CNCCCCCO)c1ccccc1 ae09805d29b74bea9b4d4733e785a6db [0,1,0,0,0,0|2,0,0]=3 1428 B16R1.64 O=C(CNCCCCCO)c1ccccn1 f9b83e0c14bbbe375eeb0ece6ba3397e [0,1,0,0,0,0|3,0,0]=4 1429 B16R1.64 O=C(CNCCCCCO)c1cccnc1 84e2a8bd2b9c5e608e63f70b8eab860d [0,1,0,0,0,0|3,0,0]=4 1430 B16R1.64 O=C(CNCCOCCO)c1ccccc1 9a7cf830cc117ff2a5c6bab01a687c83 [0,1,0,0,0,0|3,0,0]=4 1431 B16R1.64 O=C(CNCCOCCS)c1ccccc1 e150a69771c0ea36987f53e16d6f2876 [0,1,0,0,0,0|3,0,0]=4 1432 B16R1.64 O=C(CNCCSCCO)c1ccccc1 a4bb3e5954df8fdf70ff37ce376c5ede [0,1,0,0,0,0|3,0,0]=4 1433 B16R1.64 O=C(COCCCCCF)c1ccccc1 2116774849af507afca34f3ca36b0086 [0,1,0,0,0,0|1,0,0]=2 1434 B16R1.64 O=C(COCCCCCF)c1ccccn1 ca4716d826cf5615386cb422fd93daa3 [0,1,0,0,0,0|2,0,0]=3 1435 B16R1.64 O=C(COCCCCCF)c1cccnc1 2e8b001c56bd4b7b54927dced9f99d26 [0,1,0,0,0,0|2,0,0]=3 1436 B16R1.64 O=C(COCCOCCF)c1ccccc1 c6db71e4ae68917805a151643ec9e400 [0,1,0,0,0,0|2,0,0]=3 1437 B16R1.64 O=C(COCCOCCF)c1ccccn1 ab3fb5730867e6bda15c55c35137a064 [0,1,0,0,0,0|3,0,0]=4 1438 B16R1.64 O=C(COCCOCCF)c1cccnc1 a87bcccbe4b371a0581d6f7ae205aecd [0,1,0,0,0,0|3,0,0]=4 1439 B16R1.64 O=C(COCCOCCS)c1ccccc1 319b143e3b78eaa182a8b891ff115c66 [0,1,0,0,0,0|2,0,0]=3 1440 B16R1.64 O=C(COCCOCCS)c1ccccn1 00507cc98692d745de9fe5172c5181a3 [0,1,0,0,0,0|3,0,0]=4 1441 B16R1.64 O=C(COCCOCCS)c1cccnc1 0fdd4de7878c445619755b20e9009658 [0,1,0,0,0,0|3,0,0]=4 1442 B16R1.64 O=C(NCCCCCCCl)c1ccccc1 6fa9220086956f2435a0b30ac04e1a5c [0,1,0,0,0,0|1,0,0]=2 1443 B16R1.64 O=C(NCCCCCCCl)c1ccccn1 90f063c989344523842ea579558bc4bd [0,1,0,0,0,0|2,0,0]=3 1444 B16R1.64 O=C(NCCCCCCCl)c1cccnc1 dddaab772fb2945070688b0d15f570f1 [0,1,0,0,0,0|2,0,0]=3 1445 B16R1.64 O=C(NCCCCCCCl)c1cccnn1 0403c82543c913d5f5836c55d7b0ac1c [0,1,0,0,0,0|3,0,0]=4 1446 B16R1.64 O=C(NCCCCCCCl)c1ccncc1 99923902f2a5cdad6e3f38b9e9009251 [0,1,0,0,0,0|2,0,0]=3 1447 B16R1.64 O=C(NCCCCCCCl)c1ccncn1 748e7065ccd9eff385a9a0dc79db7de5 [0,1,0,0,0,0|3,0,0]=4 1448 B16R1.64 O=C(NCCCCCCCl)c1ccnnc1 ded47d9c0f136e7d6abee4bc14506a93 [0,1,0,0,0,0|3,0,0]=4 1449 B16R1.64 O=C(NCCCCCCCl)c1cnccn1 1ca8928e52f540f830262b399486b3ab [0,1,0,0,0,0|3,0,0]=4 1450 B16R1.64 O=C(NCCCCCCCl)c1cncnc1 2ad84cd6bb9c6f67fdecd2f288d15323 [0,1,0,0,0,0|3,0,0]=4 1451 B16R1.64 O=C(NCCCCCCCl)c1ncccn1 96b4ae022caa87078afda89d0be91d28 [0,1,0,0,0,0|3,0,0]=4 1452 B16R1.64 O=C(NCCCCCCO)c1ccccc1 c8bec19297ed04b7ab241b3239450eb2 [0,1,0,0,0,0|1,0,0]=2 1453 B16R1.64 O=C(NCCCCCCO)c1ccccn1 61d7ceda38951b719c518a7423ea0105 [0,1,0,0,0,0|2,0,0]=3 1454 B16R1.64 O=C(NCCCCCCO)c1cccnc1 c088d2af89091648585f5dc43650e84a [0,1,0,0,0,0|2,0,0]=3 1455 B16R1.64 O=C(NCCCCCCO)c1cccnn1 972aa220864a5d6b427eabdc91d90692 [0,1,0,0,0,0|3,0,0]=4 1456 B16R1.64 O=C(NCCCCCCO)c1ccncc1 4a807b96d9b109b4e2699fae46502429 [0,1,0,0,0,0|2,0,0]=3 1457 B16R1.64 O=C(NCCCCCCO)c1ccncn1 2830226ad7fd6a2768f7e5a9b5a5658b [0,1,0,0,0,0|3,0,0]=4 1458 B16R1.64 O=C(NCCCCCCO)c1ccnnc1 7874671caec0c72e632da5d04ab80083 [0,1,0,0,0,0|3,0,0]=4 1459 B16R1.64 O=C(NCCCCCCO)c1cnccn1 a44dee87d4f16c2c5f33f3f02b83af63 [0,1,0,0,0,0|3,0,0]=4 1460 B16R1.64 O=C(NCCCCCCO)c1cncnc1 8c134042d72769fed9e19cd7d42f999f [0,1,0,0,0,0|3,0,0]=4 1461 B16R1.64 O=C(NCCCCCCO)c1ncccn1 c2ea90de1349412107badf8ce7d2f087 [0,1,0,0,0,0|3,0,0]=4 1462 B16R1.64 O=C(NCCCOCCF)c1ccccc1 b67923b59cafaf55b0fe030860b8c206 [0,1,0,0,0,0|2,0,0]=3 1463 B16R1.64 O=C(NCCCOCCO)c1ccccc1 613f8795c04bc3ef8c8c750cbe21712a [0,1,0,0,0,0|2,0,0]=3 1464 B16R1.64 O=C(NCCCOCCO)c1ccccn1 ecc663d936900318982c4b604984a735 [0,1,0,0,0,0|3,0,0]=4 1465 B16R1.64 O=C(NCCCOCCO)c1cccnc1 45f24fab53f6a9c03656bd59d7ec7d23 [0,1,0,0,0,0|3,0,0]=4 1466 B16R1.64 O=C(NCCCOCCO)c1ccncc1 57789dfc4d5cc6291b37a177449635da [0,1,0,0,0,0|3,0,0]=4 1467 B16R1.64 O=C(NCCCOCCS)c1ccccc1 4050e6d43668d344ececc753cf535ca0 [0,1,0,0,0,0|2,0,0]=3 1468 B16R1.64 O=C(NCCNCCCCl)c1ccccc1 9c77c52c396761e22d840907d3beb76b [0,1,0,0,0,0|2,0,0]=3 1469 B16R1.64 O=C(NCCNCCCCl)c1ccccn1 75a6b45b43231f3cbdea7ba4fb02b841 [0,1,0,0,0,0|3,0,0]=4 1470 B16R1.64 O=C(NCCNCCCF)c1ccncc1 b709a13329ff13cb3e6baed531863a70 [0,1,0,0,0,0|3,0,0]=4 1471 B16R1.64 O=C(NCCNCCCO)c1ccccn1 f4e1c653ef09d9def9e639a130c0b70f [0,1,0,0,0,0|3,0,0]=4 1472 B16R1.64 O=C(NCCNCCCO)c1ccncc1 a2543c6616a9e037568d919fc340fbd0 [0,1,0,0,0,0|3,0,0]=4 1473 B16R1.64 O=C(NCCNCCCS)c1ccncc1 10cff4212acd0745e7d04cebaea0eba1 [0,1,0,0,0,0|3,0,0]=4 1474 B16R1.64 O=C(NCCOCCCF)c1ccccc1 1d528794303d09cf704413ee4c06d8fc [0,1,0,0,0,0|2,0,0]=3 1475 B16R1.64 O=C(NCCOCCCF)c1ccccn1 e36362b9efa4767d6b4a6ba76a69abda [0,1,0,0,0,0|3,0,0]=4 1476 B16R1.64 O=C(NCCOCCCF)c1cccnc1 1994d10d3020107c854dd63a96a4e72e [0,1,0,0,0,0|3,0,0]=4 1477 B16R1.64 O=C(NCCOCCCF)c1ccncc1 8aef63add3ff9c4dd1c87c8c438b405d [0,1,0,0,0,0|3,0,0]=4 1478 B16R1.64 O=C(NCCOCCCO)c1ccccc1 2d2361722196349aa61e49d573a44cbf [0,1,0,0,0,0|2,0,0]=3 1479 B16R1.64 O=C(NCCOCCCO)c1ccccn1 3969febe1ca04da228a6e7fbb9717c72 [0,1,0,0,0,0|3,0,0]=4 1480 B16R1.64 O=C(NCCOCCCO)c1cccnc1 25aac647467dcd183a77f2d22fa54e25 [0,1,0,0,0,0|3,0,0]=4 1481 B16R1.64 O=C(NCCOCCCO)c1ccncc1 e73614aee0a28113ad8d76ef8ddde7b0 [0,1,0,0,0,0|3,0,0]=4 1482 B16R1.64 O=C(NCCOCCCS)c1ccccc1 a1a86d3494899c61f30016a376ee7f19 [0,1,0,0,0,0|2,0,0]=3 1483 B16R1.64 O=C(NCCOCCCS)c1ccccn1 0947547184dd3e8b734b3ab23cb581e1 [0,1,0,0,0,0|3,0,0]=4 1484 B16R1.64 O=C(NCCOCCCS)c1cccnc1 90e846a39800d61457db734e02bd577e [0,1,0,0,0,0|3,0,0]=4 1485 B16R1.64 O=C(NCCOCCCS)c1ccncc1 6719a0bf11bf8962b3e3f9ba4327379e [0,1,0,0,0,0|3,0,0]=4 1486 B16R1.64 O=C(NCCSSCCO)c1ccccc1 c15ff4baabb15f02b9fa47eac3c927b9 [0,1,0,0,0,0|3,0,0]=4 1487 B16R1.64 O=C(NCOCCCCF)c1ccccc1 8bbf804ca11a05cf068c006ace3549ed [0,1,0,0,0,0|2,0,0]=3 1488 B16R1.64 O=C(NCOCCCCF)c1cccnc1 47bf787e129dc116100c08fc891bf84e [0,1,0,0,0,0|3,0,0]=4 1489 B16R1.64 O=C(OCCCNCCO)c1ccccc1 3834864b1c99cbbfd625187d9faa6f04 [0,1,0,0,0,0|1,0,0]=2 1490 B16R1.64 O=C(OCCNCCCCl)c1ccccc1 0910dac2f9f32e06959f50c3b286d2cc [0,1,0,0,0,0|1,0,0]=2 1491 B16R1.64 O=C(OCCNCCCO)c1ccccc1 00d1cec880f7ed71954a067abf1c44b5 [0,1,0,0,0,0|1,0,0]=2 1492 B16R1.64 O=C(OCCOC/C=C/Cl)c1ccccc1 1c2b3e51c0b4c75325172d6eb8c9ff9d [0,1,0,0,0,0|1,0,2]=4 1493 B16R1.64 O=C(OCCOC/C=C\Cl)c1ccccc1 aa1801693a08b2964c248c794efb1c90 [0,1,0,0,0,0|1,0,2]=4 1494 B16R1.64 O=C(OCCOCC#CI)c1ccccc1 848cb479c0c42dc01f26ae53b3639796 [0,1,0,0,0,0|1,0,2]=4 1495 B16R1.64 O=C(OCCOCC=CCl)c1ccccc1 af30dc25e48fdb60869c986dad71f66b [0,1,0,0,0,0|1,0,2]=4 1496 B16R1.64 O=C(OCCOCCCF)c1ccccc1 61e8bef892fd878df98fde46bc0c2a83 [0,1,0,0,0,0|1,0,0]=2 1497 B16R1.64 O=C(OCCOCCCF)c1cccnc1 30d89eb4b1f0af1447e6735fc8d219ec [0,1,0,0,0,0|2,0,0]=3 1498 B16R1.64 O=C(OCCOCCCS)c1ccccc1 a68f40d9f99a2c9ea67230514bdc2908 [0,1,0,0,0,0|1,0,0]=2 1499 B16R1.64 O=C(OCCOCCCS)c1cccnc1 c85d12b81c5646a1099908ebccaca993 [0,1,0,0,0,0|2,0,0]=3 1500 B16R1.64 O=C(OCNCC#CCO)c1ccccc1 f719bf3c940fd3a68e33d6cbbebcb8be [0,1,0,0,0,0|1,0,2]=4 1501 B16R1.64 O=C(OCNCCCCCl)c1ccccc1 2484ae0f177d0ad366995e76a15b6594 [0,1,0,0,0,0|1,0,0]=2 1502 B16R1.64 O=C(OCNCCCCO)c1ccccc1 c5c738daf6064c3ac5d4ae979d01e360 [0,1,0,0,0,0|1,0,0]=2 1503 B16R1.64 O=C(OCNCCCCS)c1ccccc1 503ffa7d1ea23d00e7732088226275ba [0,1,0,0,0,0|1,0,0]=2 1504 B16R1.64 O=C(OCOCCCCF)c1ccccc1 b49ff27922bcfd18b336c4c90a470dca [0,1,0,0,0,0|1,0,0]=2 1505 B16R1.64 O=C(OCOCCCCS)c1ccccc1 6af1f0253ab48d0b35dbf1648c0c87e5 [0,1,0,0,0,0|1,0,0]=2 1506 B16R1.64 O=CCCCCNCC(=O)c1ccccc1 fdee055a4da898b38697338644ae5b9d [0,1,0,0,0,0|2,0,1]=4 1507 B16R1.64 O=CCCCCOCC(=O)c1ccccc1 8d33de93dc7989d2692727847281a7eb [0,1,0,0,0,0|1,0,1]=3 1508 B16R1.64 O=CCCCCOCC(=O)c1ccccn1 89a335ec1415459302aaec95bf201c75 [0,1,0,0,0,0|2,0,1]=4 1509 B16R1.64 O=CCCCCOCC(=O)c1cccnc1 0a2eb0fd95fd243e158256f777860598 [0,1,0,0,0,0|2,0,1]=4 1510 B16R1.64 O=CCCCCOCS(=O)c1ccccc1 f9a3b85330e9ee05f789fcd939d61712 [0,1,0,0,0,0|2,0,1]=4 1511 B16R1.64 O=CCCCOCCC(=O)c1ccccc1 71809463b7b3974e73e9f5ba3143695e [0,1,0,0,0,0|2,0,1]=4 1512 B16R1.64 O=CCCCOCNC(=O)c1ccccc1 ee27feaef9d63cbe86736593b9ecfd02 [0,1,0,0,0,0|2,0,1]=4 1513 B16R1.64 O=CCCCOCOC(=O)c1ccccc1 e4ea9d5bf4f06dd8040b0690c00d6ffc [0,1,0,0,0,0|1,0,1]=3 1514 B16R1.64 O=CCCOCCCC(=O)c1ccccc1 7b6b29479e9e8ffdc0437f46484784a3 [0,1,0,0,0,0|2,0,1]=4 1515 B16R1.64 O=CCCOCCNC(=O)c1ccccc1 ca1ede11803dca4ae2569b3427f9869d [0,1,0,0,0,0|2,0,1]=4 1516 B16R1.64 O=CCCOCCOC(=O)c1ccccc1 207b1ab116a04ff8d72eb3b57e557dc1 [0,1,0,0,0,0|1,0,1]=3 1517 B16R1.64 O=CCCOCCOC(=O)c1cccnc1 071827900ceb6c3e5d770c5c74512680 [0,1,0,0,0,0|2,0,1]=4 1518 B16R1.64 O=CCOCCCNC(=O)c1ccccc1 244639f2b05c43f2dd8f5e66ca8d419b [0,1,0,0,0,0|2,0,1]=4 1519 B16R1.64 O=CCOCCOCC(=O)c1ccccc1 18067789c9bfe704e2688453d4cf7f5e [0,1,0,0,0,0|2,0,1]=4 1520 B16R1.64 O=CNCCOCOC(=O)c1ccccc1 e0a0dd7a17750ca96668776054cd7d33 [0,1,0,0,0,0|2,0,1]=4 1521 B16R1.64 O=COCCOCOC(=O)c1ccccc1 9dec9cc44bda22db1f824c90828df779 [0,1,0,0,0,0|2,0,1]=4 1522 B16R1.64 O=S(COCCOCCF)c1ccccc1 cca8ec244f1237880eaf37c695b347aa [0,1,0,0,0,0|3,0,0]=4 1523 B16R1.64 O=S(COCCOCCS)c1ccccc1 b57debb32606018cb6147bcfbed909d1 [0,1,0,0,0,0|3,0,0]=4 1524 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)Br ece6158048e647a44b86bd62fe29a3fd [0,1,0,0,0,0|1,0,2]=4 1525 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)C e4b7c3d90b3a0785c8fccc8a068fb078 [0,1,0,0,0,0|1,0,2]=4 1526 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)Cl 18e972ccb3e9dd45d6a7b439baafb77e [0,1,0,0,0,0|1,0,2]=4 1527 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)F c5c322d028aacfaaed4e7e869ce5ba32 [0,1,0,0,0,0|1,0,2]=4 1528 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)I 65e866c12f464935efcadd2e00799657 [0,1,0,0,0,0|1,0,2]=4 1529 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)O 110451408d79d9f7478c56a2ff70a25b [0,1,0,0,0,0|1,0,2]=4 1530 B16R1.91 C#CCCCCNC(=O)c1ccc(cc1)S 6eb7f7e44ac64af4f3e3de257a1c32bc [0,1,0,0,0,0|1,0,2]=4 1531 B16R1.91 C#CCCNCOC(=O)c1ccc(cc1)F d0ccd61f14e965d96cb80fd703d1485c [0,1,0,0,0,0|1,0,2]=4 1532 B16R1.91 C#CCCOCOC(=O)c1ccc(cc1)F 4d71fa9497f65d166dc0603f3edb40e2 [0,1,0,0,0,0|1,0,2]=4 1533 B16R1.91 C#CCOCCOC(=O)c1ccc(cc1)C e59c0d0e95b39eedb050f2e0ba2712af [0,1,0,0,0,0|1,0,2]=4 1534 B16R1.91 C/C=C/COCOC(=O)c1ccc(cc1)F b1c98e3f1f9d61406b9bed89bbcd756e [0,1,0,0,0,0|1,0,2]=4 1535 B16R1.91 C/C=C\COCOC(=O)c1ccc(cc1)F 10a3e1ed195be4fb80c146007b3a466c [0,1,0,0,0,0|1,0,2]=4 1536 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)Br 34ea2146c35ba30ecf69b0fabbacd8ba [0,1,0,0,0,0|1,0,2]=4 1537 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)C 4ece882b646c65db8bde9c7a19e81974 [0,1,0,0,0,0|1,0,2]=4 1538 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)Cl 5318cb5ad0fb9689e66ed42d94d0fc63 [0,1,0,0,0,0|1,0,2]=4 1539 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)F 96db8da6a42d2ba076e9eda4f2229a68 [0,1,0,0,0,0|1,0,2]=4 1540 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)I a640926841bcb31c5b2d15162903f5b6 [0,1,0,0,0,0|1,0,2]=4 1541 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)O fcdc3e5c903e8ea349d5461c527ba517 [0,1,0,0,0,0|1,0,2]=4 1542 B16R1.91 C=CCCCCNC(=O)c1ccc(cc1)S 5a104916bc50ca3628228499806555a4 [0,1,0,0,0,0|1,0,2]=4 1543 B16R1.91 C=CCCNCOC(=O)c1ccc(cc1)F 16a1cf3ea84cf4306327e2d16a9562a3 [0,1,0,0,0,0|1,0,2]=4 1544 B16R1.91 C=CCCOCOC(=O)c1ccc(cc1)F 23b32567defc40c74d2349e36f372215 [0,1,0,0,0,0|1,0,2]=4 1545 B16R1.91 C=CCOCCOC(=O)c1ccc(cc1)C 8a6782d252299c1f2723dc9bfea81a69 [0,1,0,0,0,0|1,0,2]=4 1546 B16R1.91 CC#CCOCOC(=O)c1ccc(cc1)F c509756fc1986bfd6d8d1f624edbb2bf [0,1,0,0,0,0|1,0,2]=4 1547 B16R1.91 CC(OCCCCCF)c1ccc(cc1)F 4e6445b4855ea7912a7a8dcd3101967e [0,1,0,0,0,0|2,0,1]=4 1548 B16R1.91 CC(OCCCCCF)c1ccc(cc1)I 13f6a3e28cf2fb25397fc6747f499b6e [0,1,0,0,0,0|2,0,1]=4 1549 B16R1.91 CC=CCNCOC(=O)c1ccc(cc1)F 05c257cd115c1599811dc5911f8f3c3e [0,1,0,0,0,0|1,0,2]=4 1550 B16R1.91 CC=CCOCOC(=O)c1ccc(cc1)F 52b476198926061bd42c207db27e49ee [0,1,0,0,0,0|1,0,2]=4 1551 B16R1.91 CCCCCCCN(C)c1ccc(cc1)F 4862a9e708c85a96286a6a9f5f959864 [0,1,0,0,0,0|3,0,0]=4 1552 B16R1.91 CCCCCCCN(C)c1ccc(cc1)S dd99bff1ead84348f812ec4a6249cde3 [0,1,0,0,0,0|3,0,0]=4 1553 B16R1.91 CCCCCCNC(=O)C1=CCC(=CC1)C 9f9e4bbedd7fc30d14e16666986dd953 [0,1,0,0,0,0|1,0,2]=4 1554 B16R1.91 CCCCCCNC(=O)c1cc[n+](cc1)[O-] ca1bae64897acf48294dd94655fe4b84 [0,1,0,0,0,0|2,0,0]=3 1555 B16R1.91 CCCCCCNC(=O)c1ccc(=O)oc1 d67aa444ff9b6fc0da748964ea478c5b [0,1,0,0,0,0|2,0,0]=3 1556 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)Br c0fa99f6aa6c2a283a169457bc481cdf [0,1,0,0,0,0|1,0,0]=2 1557 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)C 4d3d5364f673b8413ae59bcb6ac5f2e1 [0,1,0,0,0,0|1,0,0]=2 1558 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)Cl c91d097d5985a74f89af61de864aa883 [0,1,0,0,0,0|1,0,0]=2 1559 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)F 81c3777157f8a1a40795195bffc2c620 [0,1,0,0,0,0|1,0,0]=2 1560 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)I 740a99e088ce2a0022b90c80659a3784 [0,1,0,0,0,0|1,0,0]=2 1561 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)O d97fe06cb6a6e0370c9f4a43da75e4e4 [0,1,0,0,0,0|1,0,0]=2 1562 B16R1.91 CCCCCCNC(=O)c1ccc(cc1)S 7f0e04c1294620239b5f1ff9a981911c [0,1,0,0,0,0|1,0,0]=2 1563 B16R1.91 CCCCCCNC(=O)c1ccc(cn1)Br cda77f323fd9c61c4f0ea1e539c36af9 [0,1,0,0,0,0|2,0,0]=3 1564 B16R1.91 CCCCCCNC(=O)c1ccc(cn1)C bf9278f3fe75d546218c22da498c00d8 [0,1,0,0,0,0|2,0,0]=3 1565 B16R1.91 CCCCCCNC(=O)c1ccc(cn1)Cl 1fc640bfa729cbacac2e9720f52230f1 [0,1,0,0,0,0|2,0,0]=3 1566 B16R1.91 CCCCCCNC(=O)c1ccc(cn1)F 1dd86eb3f087019fe4614ef98101d700 [0,1,0,0,0,0|2,0,0]=3 1567 B16R1.91 CCCCCCNC(=O)c1ccc(cn1)I f895261a104d70c64c33a07c171040a3 [0,1,0,0,0,0|2,0,0]=3 1568 B16R1.91 CCCCCCNC(=O)c1ccc(cn1)O 790b8e35a0faac7d1407e4294c1b2fd7 [0,1,0,0,0,0|2,0,0]=3 1569 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)Br 372481eb6ffd7213ddb71856040cefc4 [0,1,0,0,0,0|2,0,0]=3 1570 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)C 8f5839b4d11d29ace70f76b8c035fb09 [0,1,0,0,0,0|2,0,0]=3 1571 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)Cl 271c6e3c221b2627530de9addc8cbe1e [0,1,0,0,0,0|2,0,0]=3 1572 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)F db3f2131684f5ec8c9341a51f3f417aa [0,1,0,0,0,0|2,0,0]=3 1573 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)I 4e504d318cbabaf476e0b86f48b79cfc [0,1,0,0,0,0|2,0,0]=3 1574 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)O 34e76f14789deeceaf945bfedd0e1a7c [0,1,0,0,0,0|2,0,0]=3 1575 B16R1.91 CCCCCCNC(=O)c1ccc(nc1)S 7ab699b5662454da5585641c3eb4de0d [0,1,0,0,0,0|2,0,0]=3 1576 B16R1.91 CCCCCCNC(=O)c1ccc(nn1)Br ef25b131012a5fb6c4e02b513b986fc2 [0,1,0,0,0,0|3,0,0]=4 1577 B16R1.91 CCCCCCNC(=O)c1ccc(nn1)C 8fe837e38d058450cfeca17877e48e5a [0,1,0,0,0,0|3,0,0]=4 1578 B16R1.91 CCCCCCNC(=O)c1ccc(nn1)Cl 5108b01c221f64336fbcb2ab92c13838 [0,1,0,0,0,0|3,0,0]=4 1579 B16R1.91 CCCCCCNC(=O)c1cnc(cn1)Br 0d4715f1c7e7c09d00bc1b5deea76dcc [0,1,0,0,0,0|3,0,0]=4 1580 B16R1.91 CCCCCCNC(=O)c1cnc(cn1)C 763d80790e817b24f8c97d3a4ac7bb18 [0,1,0,0,0,0|3,0,0]=4 1581 B16R1.91 CCCCCCNC(=O)c1cnc(cn1)Cl 922deb23cc7c0781c416eafee090c8bc [0,1,0,0,0,0|3,0,0]=4 1582 B16R1.91 CCCCCCNC(=O)c1cnc(cn1)F 2137b2ad620a5f79e278c880dffeaf29 [0,1,0,0,0,0|3,0,0]=4 1583 B16R1.91 CCCCCCNC(=O)c1cnc(cn1)O e8bf66275054506a1381795235c9e8d9 [0,1,0,0,0,0|3,0,0]=4 1584 B16R1.91 CCCCCCNC(=O)c1cnc(nc1)Br a1bc25df516b3d68f735ae0c05cfbe69 [0,1,0,0,0,0|3,0,0]=4 1585 B16R1.91 CCCCCCNC(=O)c1cnc(nc1)C b7852021a8254d4fc3ab35276486675f [0,1,0,0,0,0|3,0,0]=4 1586 B16R1.91 CCCCCCNC(=O)c1cnc(nc1)Cl 0d0989abc03008d10f512fc1b7df3cfd [0,1,0,0,0,0|3,0,0]=4 1587 B16R1.91 CCCCCCNC(=O)c1cnc(nc1)O ae2feb18e57d09f5eeb0d0992939a59e [0,1,0,0,0,0|3,0,0]=4 1588 B16R1.91 CCCCCCNC(=O)c1ncc(cn1)Br 2ed14009f65d029a284173a669c9c1be [0,1,0,0,0,0|3,0,0]=4 1589 B16R1.91 CCCCCCNC(=O)c1ncc(cn1)C dfa03a5b0ca9a3196f84ad7c0e5530a1 [0,1,0,0,0,0|3,0,0]=4 1590 B16R1.91 CCCCCCNC(=O)c1ncc(cn1)Cl 7d8be45c241b14f51c48981cb953c83d [0,1,0,0,0,0|3,0,0]=4 1591 B16R1.91 CCCCCCNC(=O)c1ncc(cn1)F ac40dc621e120ff7ba5c2f2e5e764a2d [0,1,0,0,0,0|3,0,0]=4 1592 B16R1.91 CCCCCCNC(=O)c1ncc(cn1)O 1afe1c7bbb1e3d9a3d35a89380410b34 [0,1,0,0,0,0|3,0,0]=4 1593 B16R1.91 CCCCCCNC(C)c1ccc(cc1)Br ebe8434aeafba9beb51631859fb2b730 [0,1,0,0,0,0|2,0,1]=4 1594 B16R1.91 CCCCCCNC(C)c1ccc(cc1)F b972566f75f51ae55a2dbdf8cc486cc5 [0,1,0,0,0,0|2,0,1]=4 1595 B16R1.91 CCCCCCNC(C)c1ccc(cc1)I 74afe677637cefc45f4f61acfbe2abb0 [0,1,0,0,0,0|2,0,1]=4 1596 B16R1.91 CCCCCCN[C@@H](C)c1ccc(cc1)F 0f235d0301cb652b13e536a0d903177c [0,1,0,0,0,0|2,0,1]=4 1597 B16R1.91 CCCCCCN[C@@H](C)c1ccc(cc1)I ae452fb83dcb59728d86b35cd81c923b [0,1,0,0,0,0|2,0,1]=4 1598 B16R1.91 CCCCCCN[C@H](C)c1ccc(cc1)F 4bb35093388db5f5f1ca4cc20d9f9b1d [0,1,0,0,0,0|2,0,1]=4 1599 B16R1.91 CCCCCCN[C@H](C)c1ccc(cc1)I 59a63043a9e25053ec097df32bce5e2b [0,1,0,0,0,0|2,0,1]=4 1600 B16R1.91 CCCCCCOC(C)c1ccc(cc1)C f04274a45ce0d74368c9ca9fed33c5c3 [0,1,0,0,0,0|1,0,1]=3 1601 B16R1.91 CCCCCCOC(C)c1ccc(cc1)F 1606d9b5f0559ffd11f74a15cc4927bf [0,1,0,0,0,0|1,0,1]=3 1602 B16R1.91 CCCCCCOC(C)c1ccc(cc1)I b811576c794a022bf155002f75527d29 [0,1,0,0,0,0|1,0,1]=3 1603 B16R1.91 CCCCCCOC(C)c1ccc(nc1)F 92092340bd2df1cb1e449357fef62aeb [0,1,0,0,0,0|2,0,1]=4 1604 B16R1.91 CCCCCCO[C@@H](C)c1ccc(cc1)C bf7a9717b1fef9041b7da4dd3bc7a5ae [0,1,0,0,0,0|1,0,1]=3 1605 B16R1.91 CCCCCCO[C@@H](C)c1ccc(cc1)F dfd0880d2ba6ec9f5d93e9b7618cf7ef [0,1,0,0,0,0|1,0,1]=3 1606 B16R1.91 CCCCCCO[C@@H](C)c1ccc(cc1)I 658be4ca59a6d01d7d61e8e0f35eb4b2 [0,1,0,0,0,0|1,0,1]=3 1607 B16R1.91 CCCCCCO[C@H](C)c1ccc(cc1)C 98327a4a8fe954a58a82fa9768810fb2 [0,1,0,0,0,0|1,0,1]=3 1608 B16R1.91 CCCCCCO[C@H](C)c1ccc(cc1)F 7bc26059123f3c15590dd5143d35d9eb [0,1,0,0,0,0|1,0,1]=3 1609 B16R1.91 CCCCCCO[C@H](C)c1ccc(cc1)I d0493c6ce425aac82748640dad1f544b [0,1,0,0,0,0|1,0,1]=3 1610 B16R1.91 CCCCCNCC(=O)c1ccc(cc1)Br 97b1c8d104513daf3f9b707989cc2b05 [0,1,0,0,0,0|2,0,0]=3 1611 B16R1.91 CCCCCNCC(=O)c1ccc(cc1)C cd6d600cc9e3e0c9f299248db7e61739 [0,1,0,0,0,0|2,0,0]=3 1612 B16R1.91 CCCCCNCC(=O)c1ccc(cc1)Cl 50924e194c724fdaa29401b1c2a17bee [0,1,0,0,0,0|2,0,0]=3 1613 B16R1.91 CCCCCNCC(=O)c1ccc(cc1)F f1dd2dac163545e1d5d454dd48773468 [0,1,0,0,0,0|2,0,0]=3 1614 B16R1.91 CCCCCNCC(=O)c1ccc(cc1)I 57dc8e1790afccecbd6cbe64d83d586d [0,1,0,0,0,0|2,0,0]=3 1615 B16R1.91 CCCCCNCC(=O)c1ccc(cn1)Br 96969ef09aa92e5149c5a5885c837d49 [0,1,0,0,0,0|3,0,0]=4 1616 B16R1.91 CCCCCNCC(=O)c1ccc(cn1)C fa361d59f03a38f3646e87ab4dec0049 [0,1,0,0,0,0|3,0,0]=4 1617 B16R1.91 CCCCCNCC(=O)c1ccc(cn1)Cl c24bd3ef9424aba0859bde949793e955 [0,1,0,0,0,0|3,0,0]=4 1618 B16R1.91 CCCCCNCC(=O)c1ccc(cn1)F b558a6f3b2cf20de87d7d4dd1ed498de [0,1,0,0,0,0|3,0,0]=4 1619 B16R1.91 CCCCCNCC(=O)c1ccc(nc1)C 75dd6c7b45c485df3bc80268e70cb318 [0,1,0,0,0,0|3,0,0]=4 1620 B16R1.91 CCCCCNCC(=O)c1ccc(nc1)Cl c4810c2cb16d0b6c18e617356678d666 [0,1,0,0,0,0|3,0,0]=4 1621 B16R1.91 CCCCCOCC(=O)c1ccc(cc1)Br 950d0bff12b5aa74cdf6b4a945cb28d4 [0,1,0,0,0,0|2,0,0]=3 1622 B16R1.91 CCCCCOCC(=O)c1ccc(cc1)C ac7365ec2c041d17fcbc727f726ec22b [0,1,0,0,0,0|2,0,0]=3 1623 B16R1.91 CCCCCOCC(=O)c1ccc(cc1)Cl 72baf27f9a633b6f34740bfdbcdf4fa7 [0,1,0,0,0,0|2,0,0]=3 1624 B16R1.91 CCCCCOCC(=O)c1ccc(cc1)F 538ad14eda09d36528d04753f97a864b [0,1,0,0,0,0|2,0,0]=3 1625 B16R1.91 CCCCCOCC(=O)c1ccc(cc1)I beccc4ec42734dfeb641254717c567b1 [0,1,0,0,0,0|2,0,0]=3 1626 B16R1.91 CCCCCOCC(=O)c1ccc(cn1)Br 4066051514dde0ba1865d24648892ce8 [0,1,0,0,0,0|3,0,0]=4 1627 B16R1.91 CCCCCOCC(=O)c1ccc(cn1)Cl e07fa354b087927053a80f987d92f5bd [0,1,0,0,0,0|3,0,0]=4 1628 B16R1.91 CCCCCOCC(=O)c1ccc(cn1)F 3185c5cd452bd35c0788b5faa0a0682e [0,1,0,0,0,0|3,0,0]=4 1629 B16R1.91 CCCCCOCC(=O)c1ccc(nc1)Br 8d85ab430d33e6f1186da8e56d385fce [0,1,0,0,0,0|3,0,0]=4 1630 B16R1.91 CCCCCOCC(=O)c1ccc(nc1)C 943beb5b34716216192c1ceb270a261e [0,1,0,0,0,0|3,0,0]=4 1631 B16R1.91 CCCCCOCC(=O)c1ccc(nc1)Cl c548d04df2ef7ea67418cb3c6a3a06f1 [0,1,0,0,0,0|3,0,0]=4 1632 B16R1.91 CCCCNCCC(=O)c1ccc(cc1)Br 4062f4a12c90841a29d3a61127dce884 [0,1,0,0,0,0|2,0,0]=3 1633 B16R1.91 CCCCNCCC(=O)c1ccc(cc1)C ea08b67b79f45942eb5e7890a22c7911 [0,1,0,0,0,0|2,0,0]=3 1634 B16R1.91 CCCCNCCC(=O)c1ccc(cc1)F 7709bab39293f4ab8acc441d618af56c [0,1,0,0,0,0|2,0,0]=3 1635 B16R1.91 CCCCNCOC(=O)c1ccc(cc1)F f44445bbb7958e96a4433c79fdfd7c6f [0,1,0,0,0,0|1,0,0]=2 1636 B16R1.91 CCCCOCCC(=O)c1ccc(cc1)Cl 8de105c550ce93e63bb7dfbfdef984a8 [0,1,0,0,0,0|2,0,0]=3 1637 B16R1.91 CCCCOCCC(=O)c1ccc(cc1)F afd6ec1ba6d4bc9f19e06939372d2bcb [0,1,0,0,0,0|2,0,0]=3 1638 B16R1.91 CCCCOCOC(=O)c1ccc(cc1)F b4a25bb09a37cb37c8573d651b85565b [0,1,0,0,0,0|1,0,0]=2 1639 B16R1.91 CCCCOCOC(C)c1ccc(cc1)Br c20ad658e94b87dee8b0415797046990 [0,1,0,0,0,0|2,0,1]=4 1640 B16R1.91 CCCCOCOC(C)c1ccc(cc1)C 803c0877d2bca41758d2da093ceba528 [0,1,0,0,0,0|2,0,1]=4 1641 B16R1.91 CCCCOCOC(C)c1ccc(cc1)Cl 52493e8e8681153fc52cdd2f152d6521 [0,1,0,0,0,0|2,0,1]=4 1642 B16R1.91 CCCCOCOC(C)c1ccc(cc1)F de5131fa0c1dd5d2e1d1f89a5c1a45b6 [0,1,0,0,0,0|2,0,1]=4 1643 B16R1.91 CCCCOCOC(C)c1ccc(cc1)I 4631c3647243fe5cda46dec420b2a0fd [0,1,0,0,0,0|2,0,1]=4 1644 B16R1.91 CCCCOCO[C@@H](C)c1ccc(cc1)Br a61baa7f77bee08a2a8ff23b40053020 [0,1,0,0,0,0|2,0,1]=4 1645 B16R1.91 CCCCOCO[C@@H](C)c1ccc(cc1)C 6f6943e1c6ab2c2d9800f1b1def6e946 [0,1,0,0,0,0|2,0,1]=4 1646 B16R1.91 CCCCOCO[C@@H](C)c1ccc(cc1)Cl 4c1c77d891835fce240b8c5ad507604c [0,1,0,0,0,0|2,0,1]=4 1647 B16R1.91 CCCCOCO[C@@H](C)c1ccc(cc1)F 6d30da5c6842b930953cd5155b394ba4 [0,1,0,0,0,0|2,0,1]=4 1648 B16R1.91 CCCCOCO[C@@H](C)c1ccc(cc1)I 14069c80ef7c7e490d2a6aae271d5b5b [0,1,0,0,0,0|2,0,1]=4 1649 B16R1.91 CCCCOCO[C@H](C)c1ccc(cc1)Br 5c7a392c79ce9290b3a24991ece52aa8 [0,1,0,0,0,0|2,0,1]=4 1650 B16R1.91 CCCCOCO[C@H](C)c1ccc(cc1)C fae0d869f643bfa2a8eec136492fc79e [0,1,0,0,0,0|2,0,1]=4 1651 B16R1.91 CCCCOCO[C@H](C)c1ccc(cc1)Cl 1c249710373207da1a8a6e132d24d77a [0,1,0,0,0,0|2,0,1]=4 1652 B16R1.91 CCCCOCO[C@H](C)c1ccc(cc1)F 68d37ed8c21e7c720c240296d4bd2990 [0,1,0,0,0,0|2,0,1]=4 1653 B16R1.91 CCCCOCO[C@H](C)c1ccc(cc1)I d34d63825116a03b0df06928a4230686 [0,1,0,0,0,0|2,0,1]=4 1654 B16R1.91 CCCNCCCC(=O)c1ccc(cc1)C 0736ea3d5e6376322a23f479b8b67185 [0,1,0,0,0,0|2,0,0]=3 1655 B16R1.91 CCCNCCCC(=O)c1ccc(cc1)Cl 249c52db3b3b2e92e4bd587b9e7c1b54 [0,1,0,0,0,0|2,0,0]=3 1656 B16R1.91 CCCNCCCC(=O)c1ccc(cc1)F 912816ad7640848897517ece1e430142 [0,1,0,0,0,0|2,0,0]=3 1657 B16R1.91 CCCNCCNC(=O)c1ccc(cn1)Cl 5c5a20a2e399f5230f93883499ff555b [0,1,0,0,0,0|3,0,0]=4 1658 B16R1.91 CCCOCCCC(=O)c1ccc(cc1)Cl e0d343975b665f9ee3d4505bdb3d0fad [0,1,0,0,0,0|2,0,0]=3 1659 B16R1.91 CCCOCCCC(=O)c1ccc(cc1)F 16540f34069f808332cde944f9ba7ed6 [0,1,0,0,0,0|2,0,0]=3 1660 B16R1.91 CCCOCCNC(=O)c1cc[n+](cc1)[O-] 8b548dcaa418f6c1bfe01e19ec14b955 [0,1,0,0,0,0|3,0,0]=4 1661 B16R1.91 CCCOCCNC(=O)c1ccc(=O)oc1 5abfb9363c5c1719e12daf185f16b53f [0,1,0,0,0,0|3,0,0]=4 1662 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)Br db8ed52088054302ec2f059577fe3a00 [0,1,0,0,0,0|2,0,0]=3 1663 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)C ff0f3058f6cf787fdc9dad463d887327 [0,1,0,0,0,0|2,0,0]=3 1664 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)Cl d0c5f358e9dc0eb75d636107e585fbaf [0,1,0,0,0,0|2,0,0]=3 1665 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)F e58c1fdbb28f969e09485eb4d880cead [0,1,0,0,0,0|2,0,0]=3 1666 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)I 9328fded0bc8ca314feb884afb0a1ad2 [0,1,0,0,0,0|2,0,0]=3 1667 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)O c3751c7597ab494fe9a0de3a99862ea6 [0,1,0,0,0,0|2,0,0]=3 1668 B16R1.91 CCCOCCNC(=O)c1ccc(cc1)S 0bd1b5307bc2b6e5021e393686ce47b3 [0,1,0,0,0,0|2,0,0]=3 1669 B16R1.91 CCCOCCNC(=O)c1ccc(cn1)Br 0758d9ae183994cbd438bedb2d487b0f [0,1,0,0,0,0|3,0,0]=4 1670 B16R1.91 CCCOCCNC(=O)c1ccc(cn1)C aeadac74b131a07dfbb5a408da1fde38 [0,1,0,0,0,0|3,0,0]=4 1671 B16R1.91 CCCOCCNC(=O)c1ccc(cn1)Cl 2f087679de3e0575a88238cfc6286f6c [0,1,0,0,0,0|3,0,0]=4 1672 B16R1.91 CCCOCCNC(=O)c1ccc(cn1)F 06a8196e9118b107ee8b6b44dd1cea0f [0,1,0,0,0,0|3,0,0]=4 1673 B16R1.91 CCCOCCNC(=O)c1ccc(cn1)I 42877c4993f61fb055034c3b29f8b88b [0,1,0,0,0,0|3,0,0]=4 1674 B16R1.91 CCCOCCNC(=O)c1ccc(cn1)O 18761e93bb57781db99e8fe379e130a0 [0,1,0,0,0,0|3,0,0]=4 1675 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)Br cd5df3bfce2329ffb5dc62b9340566b6 [0,1,0,0,0,0|3,0,0]=4 1676 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)C 851d88912fd95692e2686143a508c99a [0,1,0,0,0,0|3,0,0]=4 1677 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)Cl 34b53e209247b6ff382f1698a31fadb6 [0,1,0,0,0,0|3,0,0]=4 1678 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)F 6408634c402b1269027102d533068fd6 [0,1,0,0,0,0|3,0,0]=4 1679 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)I fb2a5501eae4c0788e7ec4b48a21a1ab [0,1,0,0,0,0|3,0,0]=4 1680 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)O 8d3f9a2f81d6fd6ec4ff5b8b23b57c56 [0,1,0,0,0,0|3,0,0]=4 1681 B16R1.91 CCCOCCNC(=O)c1ccc(nc1)S 20ea164c30983c6258d9406e5ab79fc3 [0,1,0,0,0,0|3,0,0]=4 1682 B16R1.91 CCCOCCOC(=O)c1ccc(cc1)C 6b927df3ccd9dcee22e7366e7f344db4 [0,1,0,0,0,0|1,0,0]=2 1683 B16R1.91 CCCOCCOC(C)c1ccc(cc1)Br dce123abe3d1f54af4940d53951858d2 [0,1,0,0,0,0|2,0,1]=4 1684 B16R1.91 CCCOCCOC(C)c1ccc(cc1)C 49cd898a89bd5c924bf7ef4abfb9aa99 [0,1,0,0,0,0|2,0,1]=4 1685 B16R1.91 CCCOCCOC(C)c1ccc(cc1)Cl 81e6a3dcab83f1919d7a09f1e3b25bb5 [0,1,0,0,0,0|2,0,1]=4 1686 B16R1.91 CCCOCCOC(C)c1ccc(cc1)F 5bd5f3c425fc8594f677ff3540fc79c0 [0,1,0,0,0,0|2,0,1]=4 1687 B16R1.91 CCCOCCOC(C)c1ccc(cc1)I feab83c4d81260dbb876e449db0743f5 [0,1,0,0,0,0|2,0,1]=4 1688 B16R1.91 CCCOCCO[C@@H](C)c1ccc(cc1)Br 00b8bc65f1f5a8f36e17bead38726317 [0,1,0,0,0,0|2,0,1]=4 1689 B16R1.91 CCCOCCO[C@@H](C)c1ccc(cc1)C cb3fcb9ce2941bf96783a861a4990a24 [0,1,0,0,0,0|2,0,1]=4 1690 B16R1.91 CCCOCCO[C@@H](C)c1ccc(cc1)Cl 9f4e63e21178389ab1c549d62c44d3d9 [0,1,0,0,0,0|2,0,1]=4 1691 B16R1.91 CCCOCCO[C@@H](C)c1ccc(cc1)F 7abbe949de5e8c4cbe47d30ed230a38e [0,1,0,0,0,0|2,0,1]=4 1692 B16R1.91 CCCOCCO[C@@H](C)c1ccc(cc1)I 578a9c0088a9acfee70442d1b096cb8d [0,1,0,0,0,0|2,0,1]=4 1693 B16R1.91 CCCOCCO[C@H](C)c1ccc(cc1)Br 1deac881b1cee32868aa3987ad500630 [0,1,0,0,0,0|2,0,1]=4 1694 B16R1.91 CCCOCCO[C@H](C)c1ccc(cc1)C 6b14a2b5ccb1b048a44f20904969cf26 [0,1,0,0,0,0|2,0,1]=4 1695 B16R1.91 CCCOCCO[C@H](C)c1ccc(cc1)Cl 71d6b2506f7c4f916384664655f2d4f1 [0,1,0,0,0,0|2,0,1]=4 1696 B16R1.91 CCCOCCO[C@H](C)c1ccc(cc1)F 005d32f566cdfa0458c10c6b2fb6a6b2 [0,1,0,0,0,0|2,0,1]=4 1697 B16R1.91 CCCOCCO[C@H](C)c1ccc(cc1)I 4673181c38bb0e1734f22d9e52866946 [0,1,0,0,0,0|2,0,1]=4 1698 B16R1.91 CCCSCCOC(C)c1ccc(cc1)F 0106bc55e6bdbb9ad74effcb9a10ce34 [0,1,0,0,0,0|2,0,1]=4 1699 B16R1.91 CCOCCCNC(=O)c1cc[n+](cc1)[O-] 2bed5a6df34c8e6564f04972c74c936f [0,1,0,0,0,0|3,0,0]=4 1700 B16R1.91 CCOCCCNC(=O)c1ccc(=O)oc1 988c39f636014fc887a08eb7a3135f79 [0,1,0,0,0,0|3,0,0]=4 1701 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)Br 131f7b6e51fb2fee10134c164cb7a287 [0,1,0,0,0,0|2,0,0]=3 1702 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)C e6694512aeb00fc53294805ca6f8e039 [0,1,0,0,0,0|2,0,0]=3 1703 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)Cl a3f481736d7f54ff074e9312d8de144c [0,1,0,0,0,0|2,0,0]=3 1704 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)F bd6e856587a6cc2c9acfc21cb39197eb [0,1,0,0,0,0|2,0,0]=3 1705 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)I 09ee6d023904401b644d806619a3e9eb [0,1,0,0,0,0|2,0,0]=3 1706 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)O 90f040861d03af64bf3df63292e2c815 [0,1,0,0,0,0|2,0,0]=3 1707 B16R1.91 CCOCCCNC(=O)c1ccc(cc1)S 6beb0515b13736827f35e8c8436a4815 [0,1,0,0,0,0|2,0,0]=3 1708 B16R1.91 CCOCCCNC(=O)c1ccc(cn1)Br e2304d89e10ee23803640bc9677870db [0,1,0,0,0,0|3,0,0]=4 1709 B16R1.91 CCOCCCNC(=O)c1ccc(cn1)C 2df5f234a61b399521bad23952435324 [0,1,0,0,0,0|3,0,0]=4 1710 B16R1.91 CCOCCCNC(=O)c1ccc(cn1)Cl f37bcaf3a1954304170ebd72f974cf2d [0,1,0,0,0,0|3,0,0]=4 1711 B16R1.91 CCOCCCNC(=O)c1ccc(cn1)F 5a6ccc52c8c92afe7efb45c7d80331ed [0,1,0,0,0,0|3,0,0]=4 1712 B16R1.91 CCOCCCNC(=O)c1ccc(cn1)I 274a4199cf160580ecfce3e1f13295e6 [0,1,0,0,0,0|3,0,0]=4 1713 B16R1.91 CCOCCCNC(=O)c1ccc(cn1)O 79575b2fe20538cccd480c4a164d337c [0,1,0,0,0,0|3,0,0]=4 1714 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)Br f07f46495a12b3dbd47adc38fcb3a527 [0,1,0,0,0,0|3,0,0]=4 1715 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)C deb37fa56910981ef4427f56df4f70c2 [0,1,0,0,0,0|3,0,0]=4 1716 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)Cl e5e7b9d045b1b8dc9d621e5c18971f0a [0,1,0,0,0,0|3,0,0]=4 1717 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)F cf1297c6742f6aa168d2f3dcb1cec965 [0,1,0,0,0,0|3,0,0]=4 1718 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)I 6d422abfb4557a988cb7f26bf101f9a8 [0,1,0,0,0,0|3,0,0]=4 1719 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)O 737ed4b6da354cfe1d592a5ab7f4bf01 [0,1,0,0,0,0|3,0,0]=4 1720 B16R1.91 CCOCCCNC(=O)c1ccc(nc1)S 32bd3a98e352a999603cf38c4307ca2c [0,1,0,0,0,0|3,0,0]=4 1721 B16R1.91 CCOCCCOC(C)c1ccc(cc1)Br 5f1b9b46c1a31f44c290675acdcb0c37 [0,1,0,0,0,0|2,0,1]=4 1722 B16R1.91 CCOCCCOC(C)c1ccc(cc1)C 2c3e85ca5eec34180221e8ad342fc3d9 [0,1,0,0,0,0|2,0,1]=4 1723 B16R1.91 CCOCCCOC(C)c1ccc(cc1)Cl 05d14e09449e0b4fe5ceb106e0cabe0d [0,1,0,0,0,0|2,0,1]=4 1724 B16R1.91 CCOCCCOC(C)c1ccc(cc1)F 5522e400464bf0abeca9807dba0fd883 [0,1,0,0,0,0|2,0,1]=4 1725 B16R1.91 CCOCCCOC(C)c1ccc(cc1)I de67c50dc76264c375552481fd86d55b [0,1,0,0,0,0|2,0,1]=4 1726 B16R1.91 CCOCCCO[C@@H](C)c1ccc(cc1)Br 805b298a3e3e3564ff3e62a294e5364a [0,1,0,0,0,0|2,0,1]=4 1727 B16R1.91 CCOCCCO[C@@H](C)c1ccc(cc1)C 197d412274d22fa21183ee6385e0d237 [0,1,0,0,0,0|2,0,1]=4 1728 B16R1.91 CCOCCCO[C@@H](C)c1ccc(cc1)Cl 4b7b1506cc52e7af0bcb5cbe5a167e78 [0,1,0,0,0,0|2,0,1]=4 1729 B16R1.91 CCOCCCO[C@@H](C)c1ccc(cc1)F 6b6578514eb76a7938462a1c57e05b2d [0,1,0,0,0,0|2,0,1]=4 1730 B16R1.91 CCOCCCO[C@@H](C)c1ccc(cc1)I 6a497c54a3ebca7982d90b6312e6fe6b [0,1,0,0,0,0|2,0,1]=4 1731 B16R1.91 CCOCCCO[C@H](C)c1ccc(cc1)Br 0ae80006430e7b0338af9272250361b6 [0,1,0,0,0,0|2,0,1]=4 1732 B16R1.91 CCOCCCO[C@H](C)c1ccc(cc1)C c97c641b5c3bb3a4709dc64d24aa3119 [0,1,0,0,0,0|2,0,1]=4 1733 B16R1.91 CCOCCCO[C@H](C)c1ccc(cc1)Cl 483ff5314e8360584d5fffa47355905c [0,1,0,0,0,0|2,0,1]=4 1734 B16R1.91 CCOCCCO[C@H](C)c1ccc(cc1)F 75c3bc4f8519c0abf6099fff31217720 [0,1,0,0,0,0|2,0,1]=4 1735 B16R1.91 CCOCCCO[C@H](C)c1ccc(cc1)I cad0fa87885d005c02cf4d107e908917 [0,1,0,0,0,0|2,0,1]=4 1736 B16R1.91 CCOCCNCC(=O)c1ccc(cc1)Br 488c06e5dbd2a1c71ba28d6321b4267d [0,1,0,0,0,0|3,0,0]=4 1737 B16R1.91 CCOCCNCC(=O)c1ccc(cc1)C 4fb17f54ffc8910cfc3aa7a6574717d4 [0,1,0,0,0,0|3,0,0]=4 1738 B16R1.91 CCOCCNCC(=O)c1ccc(cc1)Cl 275403c13461e05a9abb108cd656ed4b [0,1,0,0,0,0|3,0,0]=4 1739 B16R1.91 CCOCCNCC(=O)c1ccc(cc1)F 7e1b1fb05bb86c601873d4b0bf59bf5c [0,1,0,0,0,0|3,0,0]=4 1740 B16R1.91 CCOCCNCC(=O)c1ccc(cc1)I d6f1f5f44fb0634dd4ded0e14fe94b4a [0,1,0,0,0,0|3,0,0]=4 1741 B16R1.91 CCOCCOCC(=O)c1ccc(cc1)Br a660088419f8a507c72285ec075dd747 [0,1,0,0,0,0|3,0,0]=4 1742 B16R1.91 CCOCCOCC(=O)c1ccc(cc1)C 2358f0ecbdfe43a728ffa2cd8ba48acf [0,1,0,0,0,0|3,0,0]=4 1743 B16R1.91 CCOCCOCC(=O)c1ccc(cc1)Cl 518252db94e00bfeb33fa2547c7cdb2c [0,1,0,0,0,0|3,0,0]=4 1744 B16R1.91 CCOCCOCC(=O)c1ccc(cc1)F df3d586a1079b897a74d56156a2fa386 [0,1,0,0,0,0|3,0,0]=4 1745 B16R1.91 CCOCCOCC(=O)c1ccc(cc1)I 31d8ba2714e95930fba31113d139b864 [0,1,0,0,0,0|3,0,0]=4 1746 B16R1.91 CCOCOCCC(=O)c1ccc(cc1)Cl 35c0cc75ed5b99158628ef8b185bc377 [0,1,0,0,0,0|3,0,0]=4 1747 B16R1.91 CCSCCCOC(C)c1ccc(cc1)Br bd837c48e42d5e10f5dcd7be2269cb00 [0,1,0,0,0,0|2,0,1]=4 1748 B16R1.91 CCSCCCOC(C)c1ccc(cc1)C fa5bb81c1860c3d14d24e344d2ea947e [0,1,0,0,0,0|2,0,1]=4 1749 B16R1.91 CCSCCCOC(C)c1ccc(cc1)Cl cfa0f27c12863b5e762e6d20b81407d7 [0,1,0,0,0,0|2,0,1]=4 1750 B16R1.91 CCSCCCOC(C)c1ccc(cc1)F f7e7b0f8d48c5cd430db2d1e987a924e [0,1,0,0,0,0|2,0,1]=4 1751 B16R1.91 CCSCCCOC(C)c1ccc(cc1)I 61edd23f2688dc95a6c1f6e5c6691921 [0,1,0,0,0,0|2,0,1]=4 1752 B16R1.91 CCSCCCO[C@@H](C)c1ccc(cc1)Br 18f6da39786e4fbe5950c058079b4593 [0,1,0,0,0,0|2,0,1]=4 1753 B16R1.91 CCSCCCO[C@@H](C)c1ccc(cc1)C 865513bd6da279abfb3e4b2e5d6d0c91 [0,1,0,0,0,0|2,0,1]=4 1754 B16R1.91 CCSCCCO[C@@H](C)c1ccc(cc1)Cl 30c41809e25caa285db1a328d7845380 [0,1,0,0,0,0|2,0,1]=4 1755 B16R1.91 CCSCCCO[C@@H](C)c1ccc(cc1)F fbb6b1693c3ba1aee58b02b5fc7591c9 [0,1,0,0,0,0|2,0,1]=4 1756 B16R1.91 CCSCCCO[C@@H](C)c1ccc(cc1)I 1ace054704a2f95a452cd16eabecd063 [0,1,0,0,0,0|2,0,1]=4 1757 B16R1.91 CCSCCCO[C@H](C)c1ccc(cc1)Br ca198aa102b7af05c5542c1b2b9aa4fd [0,1,0,0,0,0|2,0,1]=4 1758 B16R1.91 CCSCCCO[C@H](C)c1ccc(cc1)C c0a5fe4c4342a1d1b635d7b1835083b1 [0,1,0,0,0,0|2,0,1]=4 1759 B16R1.91 CCSCCCO[C@H](C)c1ccc(cc1)Cl e9363711fc7aad227c2ab697f007a3bb [0,1,0,0,0,0|2,0,1]=4 1760 B16R1.91 CCSCCCO[C@H](C)c1ccc(cc1)F bb84301f01b3433339d331316c16d0fa [0,1,0,0,0,0|2,0,1]=4 1761 B16R1.91 CCSCCCO[C@H](C)c1ccc(cc1)I 2c48493f9bf594881087c09cf5bb7643 [0,1,0,0,0,0|2,0,1]=4 1762 B16R1.91 CCSCCNCC(=O)c1ccc(cc1)Br 7f9eb37e12e27d5f7ee71cd511ed6f03 [0,1,0,0,0,0|3,0,0]=4 1763 B16R1.91 CCSCCNCC(=O)c1ccc(cc1)C 7981e953c68d9fb3946cddb43517b623 [0,1,0,0,0,0|3,0,0]=4 1764 B16R1.91 CCSCCNCC(=O)c1ccc(cc1)Cl 4fc8e677edbfa431ae803b8a3e6eb814 [0,1,0,0,0,0|3,0,0]=4 1765 B16R1.91 CCSCCNCC(=O)c1ccc(cc1)F 3ef8b3509e195c36278c80e45f366a58 [0,1,0,0,0,0|3,0,0]=4 1766 B16R1.91 CCSCCNCC(=O)c1ccc(cc1)I 9c0cf6a79e8e6f1dec31cb4fc9537d8b [0,1,0,0,0,0|3,0,0]=4 1767 B16R1.91 CCSCCOCC(=O)c1ccc(cc1)Br 0c205f0894c3e0efcd2d562305c592a0 [0,1,0,0,0,0|3,0,0]=4 1768 B16R1.91 CCSCCOCC(=O)c1ccc(cc1)C c02283a7057bd01c7188bf62403e6fb9 [0,1,0,0,0,0|3,0,0]=4 1769 B16R1.91 CCSCCOCC(=O)c1ccc(cc1)Cl df4752c5d6d10329ba784fb04044d6e1 [0,1,0,0,0,0|3,0,0]=4 1770 B16R1.91 CCSCCOCC(=O)c1ccc(cc1)F 7d09fce829ce2a9796ab158f31b04fa7 [0,1,0,0,0,0|3,0,0]=4 1771 B16R1.91 CCSCCOCC(=O)c1ccc(cc1)I 4142a053597c2c74b0388cc4c05f8dc5 [0,1,0,0,0,0|3,0,0]=4 1772 B16R1.91 COCCCCNC(=O)c1cc[n+](cc1)[O-] e1c7c91e871a28c94224332dec3f98da [0,1,0,0,0,0|3,0,0]=4 1773 B16R1.91 COCCCCNC(=O)c1ccc(=O)oc1 1df70a2bfe361a2d0f127e0a81973f01 [0,1,0,0,0,0|3,0,0]=4 1774 B16R1.91 COCCCCNC(=O)c1ccc(cc1)Br 592092f0db04eafa83321267d20525d4 [0,1,0,0,0,0|2,0,0]=3 1775 B16R1.91 COCCCCNC(=O)c1ccc(cc1)C 2b8604c116bab0187da1eef954426338 [0,1,0,0,0,0|2,0,0]=3 1776 B16R1.91 COCCCCNC(=O)c1ccc(cc1)Cl 1576d01e0e8939f8df917ff7df06af9a [0,1,0,0,0,0|2,0,0]=3 1777 B16R1.91 COCCCCNC(=O)c1ccc(cc1)F 517ef0d315122e6c3d15ac4a9670a59f [0,1,0,0,0,0|2,0,0]=3 1778 B16R1.91 COCCCCNC(=O)c1ccc(cc1)I 62941cbbe4bb97a2e69e1bdd56ff9781 [0,1,0,0,0,0|2,0,0]=3 1779 B16R1.91 COCCCCNC(=O)c1ccc(cc1)O 8943368d05d323001fb3e43ee5d2d276 [0,1,0,0,0,0|2,0,0]=3 1780 B16R1.91 COCCCCNC(=O)c1ccc(cc1)S 11833a8e22f8621e2e1748a7fa0affb8 [0,1,0,0,0,0|2,0,0]=3 1781 B16R1.91 COCCCCNC(=O)c1ccc(cn1)Br 9da6a7883ca6d64f632bc9a268531851 [0,1,0,0,0,0|3,0,0]=4 1782 B16R1.91 COCCCCNC(=O)c1ccc(cn1)C adab787ca4284a1aef874ba9fb0cfd00 [0,1,0,0,0,0|3,0,0]=4 1783 B16R1.91 COCCCCNC(=O)c1ccc(cn1)Cl 0ef7acd74656429183920d9350d9be58 [0,1,0,0,0,0|3,0,0]=4 1784 B16R1.91 COCCCCNC(=O)c1ccc(cn1)F 41ecd7b5d9937c77df0253a01e753086 [0,1,0,0,0,0|3,0,0]=4 1785 B16R1.91 COCCCCNC(=O)c1ccc(cn1)I be0f4179d057c5f5c6e4bdf42b8dcdd7 [0,1,0,0,0,0|3,0,0]=4 1786 B16R1.91 COCCCCNC(=O)c1ccc(cn1)O 2b5998c2da9f0c26cf3e19fc4e17151f [0,1,0,0,0,0|3,0,0]=4 1787 B16R1.91 COCCCCNC(=O)c1ccc(nc1)Br c1d13d318fd69b8222330a944014ccf2 [0,1,0,0,0,0|3,0,0]=4 1788 B16R1.91 COCCCCNC(=O)c1ccc(nc1)C 7f45597e024d52d65264887652a0d618 [0,1,0,0,0,0|3,0,0]=4 1789 B16R1.91 COCCCCNC(=O)c1ccc(nc1)Cl edcdce0d076fa4a3b257841cfc6f8e37 [0,1,0,0,0,0|3,0,0]=4 1790 B16R1.91 COCCCCNC(=O)c1ccc(nc1)F e29d5ee5568b09b21104914d0d20aaf3 [0,1,0,0,0,0|3,0,0]=4 1791 B16R1.91 COCCCCNC(=O)c1ccc(nc1)I 2f1f3041ea1f5a6adab82623abf55b60 [0,1,0,0,0,0|3,0,0]=4 1792 B16R1.91 COCCCCNC(=O)c1ccc(nc1)O 5c875efbd0e6c0f1133e166f8eb7271c [0,1,0,0,0,0|3,0,0]=4 1793 B16R1.91 COCCCCNC(=O)c1ccc(nc1)S 3332baf4a2cc46c3d61230fd2d217e50 [0,1,0,0,0,0|3,0,0]=4 1794 B16R1.91 COCCCCOC(C)c1ccc(cc1)Br 95e689153891ffdde76d63f2b148852e [0,1,0,0,0,0|2,0,1]=4 1795 B16R1.91 COCCCCOC(C)c1ccc(cc1)C 5806245f421f2a5d0e1198b4331fa460 [0,1,0,0,0,0|2,0,1]=4 1796 B16R1.91 COCCCCOC(C)c1ccc(cc1)Cl 52bffb42dee1de3e23dd17a444aa2604 [0,1,0,0,0,0|2,0,1]=4 1797 B16R1.91 COCCCCOC(C)c1ccc(cc1)F d209762d2cf9af50c5697a37a5694908 [0,1,0,0,0,0|2,0,1]=4 1798 B16R1.91 COCCCCOC(C)c1ccc(cc1)I caed4fb670184fe2fde38081cdcc3044 [0,1,0,0,0,0|2,0,1]=4 1799 B16R1.91 COCCCCO[C@@H](C)c1ccc(cc1)Br 6785955ef4ca4f3dc51d8c9d69dbb0ee [0,1,0,0,0,0|2,0,1]=4 1800 B16R1.91 COCCCCO[C@@H](C)c1ccc(cc1)C 7993d5e8fdb487e5b9d6d9363d9a7220 [0,1,0,0,0,0|2,0,1]=4 1801 B16R1.91 COCCCCO[C@@H](C)c1ccc(cc1)Cl f2f4c3cb8e71e705804a02d517bbc3ca [0,1,0,0,0,0|2,0,1]=4 1802 B16R1.91 COCCCCO[C@@H](C)c1ccc(cc1)F b16216031681c8cb7fb3cb7ca7497afe [0,1,0,0,0,0|2,0,1]=4 1803 B16R1.91 COCCCCO[C@@H](C)c1ccc(cc1)I 97f2895f5ad8d6cbf4840ca09f4f04ef [0,1,0,0,0,0|2,0,1]=4 1804 B16R1.91 COCCCCO[C@H](C)c1ccc(cc1)Br 6d4003a04534777a93164b67e30346c0 [0,1,0,0,0,0|2,0,1]=4 1805 B16R1.91 COCCCCO[C@H](C)c1ccc(cc1)C 9f97fac76304fb560f6fa6be4b89080f [0,1,0,0,0,0|2,0,1]=4 1806 B16R1.91 COCCCCO[C@H](C)c1ccc(cc1)Cl 5fdab0b15b5144516df3add3690bbce4 [0,1,0,0,0,0|2,0,1]=4 1807 B16R1.91 COCCCCO[C@H](C)c1ccc(cc1)F 221a8c8a48a44cbcb9fad401dd5f4bff [0,1,0,0,0,0|2,0,1]=4 1808 B16R1.91 COCCCCO[C@H](C)c1ccc(cc1)I 8895284197110ee72e5be2cd6d9c0b0f [0,1,0,0,0,0|2,0,1]=4 1809 B16R1.91 COCCCNCC(=O)c1ccc(cc1)Br 59fc1b10fcad17001df268fe86bf6253 [0,1,0,0,0,0|3,0,0]=4 1810 B16R1.91 COCCCNCC(=O)c1ccc(cc1)C f08afc2784ffb220cdbba9c8836afaec [0,1,0,0,0,0|3,0,0]=4 1811 B16R1.91 COCCCNCC(=O)c1ccc(cc1)Cl 38f640b437ce8551b5925cf565571ba8 [0,1,0,0,0,0|3,0,0]=4 1812 B16R1.91 COCCCNCC(=O)c1ccc(cc1)F 4ec0e54a855bc75c2d2eac0ee4a76f8d [0,1,0,0,0,0|3,0,0]=4 1813 B16R1.91 COCCCNCC(=O)c1ccc(cc1)I c1788be9a53c3ea00e677e5b2add975a [0,1,0,0,0,0|3,0,0]=4 1814 B16R1.91 COCCCOCC(=O)c1ccc(cc1)Br 53dc35ce4b831472bdd56803186ffcfc [0,1,0,0,0,0|3,0,0]=4 1815 B16R1.91 COCCCOCC(=O)c1ccc(cc1)C 45850f7a2c9bde2df67c522c1a97964c [0,1,0,0,0,0|3,0,0]=4 1816 B16R1.91 COCCCOCC(=O)c1ccc(cc1)Cl ac75fa27afe685aa88bd24657fe6c89b [0,1,0,0,0,0|3,0,0]=4 1817 B16R1.91 COCCCOCC(=O)c1ccc(cc1)F e45b08d1c983d14e879b83e140de8109 [0,1,0,0,0,0|3,0,0]=4 1818 B16R1.91 COCCCOCC(=O)c1ccc(cc1)I c172178c838443d29a067ba5e76408e6 [0,1,0,0,0,0|3,0,0]=4 1819 B16R1.91 COCCNCCC(=O)c1ccc(cc1)Br e198cf7084b50890784dacf1dc1dcb35 [0,1,0,0,0,0|3,0,0]=4 1820 B16R1.91 COCCNCCC(=O)c1ccc(cc1)C 7c6d7cada3abdbd55c6cf9a040eeecae [0,1,0,0,0,0|3,0,0]=4 1821 B16R1.91 COCCNCCC(=O)c1ccc(cc1)F 1348d876a183bc425fca43b4eb72856c [0,1,0,0,0,0|3,0,0]=4 1822 B16R1.91 COCCNCOC(=O)c1ccc(cc1)F 6a977bd8c2e88520c3491d2cb4b15f18 [0,1,0,0,0,0|2,0,0]=3 1823 B16R1.91 COCCOCCC(=O)c1ccc(cc1)Br 1f21e16aa41f599e52d058d69ef6381a [0,1,0,0,0,0|3,0,0]=4 1824 B16R1.91 COCCOCCC(=O)c1ccc(cc1)C 27eb818ffa4ff6c79cb0fe9a9516ccec [0,1,0,0,0,0|3,0,0]=4 1825 B16R1.91 COCCOCCC(=O)c1ccc(cc1)Cl 27462cd39a111210820a484bb2a6db04 [0,1,0,0,0,0|3,0,0]=4 1826 B16R1.91 COCCOCCC(=O)c1ccc(cc1)F 610f7533c6df0250d3152d069c1c9853 [0,1,0,0,0,0|3,0,0]=4 1827 B16R1.91 COCCOCOC(=O)c1ccc(cc1)F 838b2c79ea884e75d430c3e374a476fe [0,1,0,0,0,0|2,0,0]=3 1828 B16R1.91 COCOCCCC(=O)c1ccc(cc1)Cl f30d9214932b31c84a41d788e706397f [0,1,0,0,0,0|3,0,0]=4 1829 B16R1.91 COCOCCCC(=O)c1ccc(cc1)F a72f52571ca1273d73966bfb358833eb [0,1,0,0,0,0|3,0,0]=4 1830 B16R1.91 COCOCCNC(=O)c1ccc(cc1)Br 4da07f3baf5a97a5811c7eb251182f60 [0,1,0,0,0,0|3,0,0]=4 1831 B16R1.91 COCOCCNC(=O)c1ccc(cc1)C c9a812a24d357a582300ae9210139ba8 [0,1,0,0,0,0|3,0,0]=4 1832 B16R1.91 COCOCCOC(=O)c1ccc(cc1)C fa9c85266db90303d55ea79877f3e3ec [0,1,0,0,0,0|2,0,0]=3 1833 B16R1.91 CSCCCCNC(=O)c1cc[n+](cc1)[O-] b261cc9f1d0bd46b2f87095633173252 [0,1,0,0,0,0|3,0,0]=4 1834 B16R1.91 CSCCCCNC(=O)c1ccc(=O)oc1 a343170439878365c5b47e757604ea20 [0,1,0,0,0,0|3,0,0]=4 1835 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)Br bc35833ce2b30d157e505cffa962fc6a [0,1,0,0,0,0|2,0,0]=3 1836 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)C 88f4bc3b9fa0001cb95115c34f8db50e [0,1,0,0,0,0|2,0,0]=3 1837 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)Cl 784407becfefcb910b91aa80b8d6192b [0,1,0,0,0,0|2,0,0]=3 1838 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)F 0637701517ce93b9a90a0e987d9d017d [0,1,0,0,0,0|2,0,0]=3 1839 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)I c8fc56b8c9e5d77330af2134c69da37b [0,1,0,0,0,0|2,0,0]=3 1840 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)O 71e155c6d304a8d8fc4d777a6c0b1a5a [0,1,0,0,0,0|2,0,0]=3 1841 B16R1.91 CSCCCCNC(=O)c1ccc(cc1)S c61f2a124f49b48454c574bbe8372d43 [0,1,0,0,0,0|2,0,0]=3 1842 B16R1.91 CSCCCCNC(=O)c1ccc(cn1)Br 6e35e7a841206252b67f2ec5cb2baa3e [0,1,0,0,0,0|3,0,0]=4 1843 B16R1.91 CSCCCCNC(=O)c1ccc(cn1)C 053d182038c52a8fb91e8822e60d881e [0,1,0,0,0,0|3,0,0]=4 1844 B16R1.91 CSCCCCNC(=O)c1ccc(cn1)Cl 0f5148f8dc135449556bdea7fbbfb0ab [0,1,0,0,0,0|3,0,0]=4 1845 B16R1.91 CSCCCCNC(=O)c1ccc(cn1)F 059feebb4b852f403d452cc06a5d9740 [0,1,0,0,0,0|3,0,0]=4 1846 B16R1.91 CSCCCCNC(=O)c1ccc(cn1)I a187f33be6c52c94b35d72d80eb441c6 [0,1,0,0,0,0|3,0,0]=4 1847 B16R1.91 CSCCCCNC(=O)c1ccc(cn1)O 7026bf860bfd8411a0cd8f559905976b [0,1,0,0,0,0|3,0,0]=4 1848 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)Br 23e462529b12ccfecb7ff3f3510e6199 [0,1,0,0,0,0|3,0,0]=4 1849 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)C 0f3fa4ad5cc5e6308dff799da71cff12 [0,1,0,0,0,0|3,0,0]=4 1850 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)Cl d1c3da87fe8694631be70cc394d28317 [0,1,0,0,0,0|3,0,0]=4 1851 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)F 458e22c1790f05da1f3e495cbb170ce8 [0,1,0,0,0,0|3,0,0]=4 1852 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)I f0f2180252def4941a207e52fa7db3d3 [0,1,0,0,0,0|3,0,0]=4 1853 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)O 9594e1e190eb2096ff16c1890823d14f [0,1,0,0,0,0|3,0,0]=4 1854 B16R1.91 CSCCCCNC(=O)c1ccc(nc1)S 821e2f62d15b38ce529322dd59e387ef [0,1,0,0,0,0|3,0,0]=4 1855 B16R1.91 CSCCCCOC(C)c1ccc(cc1)F 905a3acdf1a15baf61e709b82172416d [0,1,0,0,0,0|2,0,1]=4 1856 B16R1.91 CSCCCNCC(=O)c1ccc(cc1)Br 610c8f085cecd4c05d9211563855fcbd [0,1,0,0,0,0|3,0,0]=4 1857 B16R1.91 CSCCCNCC(=O)c1ccc(cc1)C a1748333af276422ef2f5fa47b2a5824 [0,1,0,0,0,0|3,0,0]=4 1858 B16R1.91 CSCCCNCC(=O)c1ccc(cc1)Cl 2aea607d79334d3dcf171f13a00b6e1d [0,1,0,0,0,0|3,0,0]=4 1859 B16R1.91 CSCCCNCC(=O)c1ccc(cc1)F 2945a47372700008b4ec8f7836d483e3 [0,1,0,0,0,0|3,0,0]=4 1860 B16R1.91 CSCCCNCC(=O)c1ccc(cc1)I d792e401ee77c001887675a96fd945f9 [0,1,0,0,0,0|3,0,0]=4 1861 B16R1.91 CSCCCOCC(=O)c1ccc(cc1)Br e060b4f2f3164b54293b2d3d212b6a2f [0,1,0,0,0,0|3,0,0]=4 1862 B16R1.91 CSCCCOCC(=O)c1ccc(cc1)C c622e8249760ead7fdc0d841b166bae2 [0,1,0,0,0,0|3,0,0]=4 1863 B16R1.91 CSCCCOCC(=O)c1ccc(cc1)Cl ab379274b6df0d954f88ba5a54de1f86 [0,1,0,0,0,0|3,0,0]=4 1864 B16R1.91 CSCCCOCC(=O)c1ccc(cc1)F d15b85b4f6a59c6f1f81de3a0b7e1b15 [0,1,0,0,0,0|3,0,0]=4 1865 B16R1.91 CSCCCOCC(=O)c1ccc(cc1)I b4a31789fa0375a2bf11e08dd6a31268 [0,1,0,0,0,0|3,0,0]=4 1866 B16R1.91 CSCCNCCC(=O)c1ccc(cc1)Br 0e53b63b2f9af0733850772a38c8dd0e [0,1,0,0,0,0|3,0,0]=4 1867 B16R1.91 CSCCNCCC(=O)c1ccc(cc1)C eb865baabddc236abaca753437cb7829 [0,1,0,0,0,0|3,0,0]=4 1868 B16R1.91 CSCCNCCC(=O)c1ccc(cc1)F 514afc470d5a5864a60f373efe8751da [0,1,0,0,0,0|3,0,0]=4 1869 B16R1.91 CSCCNCOC(=O)c1ccc(cc1)F e517f618ffb8235b8023b5c1a6faac50 [0,1,0,0,0,0|2,0,0]=3 1870 B16R1.91 CSCCOCCC(=O)c1ccc(cc1)Br 1f77e60f8b61d0fd138435cafa21b11d [0,1,0,0,0,0|3,0,0]=4 1871 B16R1.91 CSCCOCCC(=O)c1ccc(cc1)C 936763a8ba7a7d991953a86e51eaa884 [0,1,0,0,0,0|3,0,0]=4 1872 B16R1.91 CSCCOCCC(=O)c1ccc(cc1)Cl 446ffe6ea4cd56dc90fd3e08b442cbe7 [0,1,0,0,0,0|3,0,0]=4 1873 B16R1.91 CSCCOCCC(=O)c1ccc(cc1)F e9f3d52226a4c7f3ac839b7ce6ed2f10 [0,1,0,0,0,0|3,0,0]=4 1874 B16R1.91 CSCCOCOC(=O)c1ccc(cc1)F 0f39eb0f67d02d27b4ec71697b76bcf9 [0,1,0,0,0,0|2,0,0]=3 1875 B16R1.91 CSCOCCCC(=O)c1ccc(cc1)F d7d35bd0653410d3e051c3130f5bcdaa [0,1,0,0,0,0|3,0,0]=4 1876 B16R1.91 CSCOCCNC(=O)c1ccc(cc1)Br 346597089ac24d52adde02e7c19fa7b8 [0,1,0,0,0,0|3,0,0]=4 1877 B16R1.91 CSCOCCNC(=O)c1ccc(cc1)C ee70e1c5c6db2ea56272049c7d4bdad5 [0,1,0,0,0,0|3,0,0]=4 1878 B16R1.91 CSCOCCOC(=O)c1ccc(cc1)C 2bc6d3713186d5c40a761cca94812123 [0,1,0,0,0,0|2,0,0]=3 1879 B16R1.91 C[C@@H](OCCCCCF)c1ccc(cc1)F 980fb4dd9eed2744b7799a27118c67a8 [0,1,0,0,0,0|2,0,1]=4 1880 B16R1.91 C[C@@H](OCCCCCF)c1ccc(cc1)I cd9864575fd55c16802b38d6c9f29030 [0,1,0,0,0,0|2,0,1]=4 1881 B16R1.91 C[C@H](OCCCCCF)c1ccc(cc1)F 5598b7d772a8ffe0fe782c7bdd1fa204 [0,1,0,0,0,0|2,0,1]=4 1882 B16R1.91 C[C@H](OCCCCCF)c1ccc(cc1)I 7a59f3ac9cd220993c9c6698f1d2675c [0,1,0,0,0,0|2,0,1]=4 1883 B16R1.91 Cc1ccc(cc1)C(=O)CCCNCCBr 4528800425c75748fa29646a8d53500c [0,1,0,0,0,0|3,0,0]=4 1884 B16R1.91 Cc1ccc(cc1)C(=O)CCCNCCF 553668ffcf01317011219f86dea7207e [0,1,0,0,0,0|3,0,0]=4 1885 B16R1.91 Cc1ccc(cc1)C(=O)CCCNCCI 94b87b83f0ca0dd2fe7d6a6bebf7c3cd [0,1,0,0,0,0|3,0,0]=4 1886 B16R1.91 Cc1ccc(cc1)C(=O)CCCNCCO 77ee4db4339a417173775fba29d7533b [0,1,0,0,0,0|3,0,0]=4 1887 B16R1.91 Cc1ccc(cc1)C(=O)CCCNCCS 4ac84a1d0fd474bb710fdb3e51ee567b [0,1,0,0,0,0|3,0,0]=4 1888 B16R1.91 Cc1ccc(cc1)C(=O)CCCOCCS 1c92ec14f9f5086ab1e06c24feef41de [0,1,0,0,0,0|3,0,0]=4 1889 B16R1.91 Cc1ccc(cc1)C(=O)CCNCCCCl f348347ed331437872ff87ea2f580d66 [0,1,0,0,0,0|3,0,0]=4 1890 B16R1.91 Cc1ccc(cc1)C(=O)CCNCCCO 2cb5107503220b1ae18573d52955b034 [0,1,0,0,0,0|3,0,0]=4 1891 B16R1.91 Cc1ccc(cc1)C(=O)CCOCCCF 907bb2e928756af57fb5e46cde40da56 [0,1,0,0,0,0|3,0,0]=4 1892 B16R1.91 Cc1ccc(cc1)C(=O)CNCCCCCl 4e84786ddb3df9f30c186d1dc42db28a [0,1,0,0,0,0|3,0,0]=4 1893 B16R1.91 Cc1ccc(cc1)C(=O)CNCCCCF ccc86f1e84ea6d4b072f666080e5542e [0,1,0,0,0,0|3,0,0]=4 1894 B16R1.91 Cc1ccc(cc1)C(=O)CNCCCCO 2d377ed698da17bcd6bdde28c6e31d48 [0,1,0,0,0,0|3,0,0]=4 1895 B16R1.91 Cc1ccc(cc1)C(=O)CNCCCCS fb5a07ebdebc59629cea8f976bc55a7e [0,1,0,0,0,0|3,0,0]=4 1896 B16R1.91 Cc1ccc(cc1)C(=O)COCCCCF 7b68b90a341135456780a1078b5d1bf5 [0,1,0,0,0,0|3,0,0]=4 1897 B16R1.91 Cc1ccc(cc1)C(=O)COCCCCS 0b099fd641128861ac9c8b69ab096f33 [0,1,0,0,0,0|3,0,0]=4 1898 B16R1.91 Cc1ccc(cc1)C(=O)NCCCCC#N 7fd13a09a4a85c64778b8a0ebcc980dd [0,1,0,0,0,0|2,0,1]=4 1899 B16R1.91 Cc1ccc(cc1)C(=O)NCCCCCCl 3e7ef4677f6f4ea530d9b48bda5aa58b [0,1,0,0,0,0|2,0,0]=3 1900 B16R1.91 Cc1ccc(cc1)C(=O)NCCCCCO fc518b77cd80f1d16ad7e0082f621b66 [0,1,0,0,0,0|2,0,0]=3 1901 B16R1.91 Cc1ccc(cc1)C(=O)NCCOCCF 14fe0b7025e0b0160e90665c0b822477 [0,1,0,0,0,0|3,0,0]=4 1902 B16R1.91 Cc1ccc(cc1)C(=O)NCCOCCO 2f6f895d27f236bae5ff2e62d760f8b5 [0,1,0,0,0,0|3,0,0]=4 1903 B16R1.91 Cc1ccc(cc1)C(=O)NCCOCCS 5f5c3febcdcfe092021ab167f27da3b5 [0,1,0,0,0,0|3,0,0]=4 1904 B16R1.91 Cc1ccc(cc1)C(=O)NCCSCCO 9ba1380737234e3369b00eb1617b319b [0,1,0,0,0,0|3,0,0]=4 1905 B16R1.91 Cc1ccc(cc1)C(=O)OCCOCC#N 542856812ae861d93f9fe95bea427e69 [0,1,0,0,0,0|2,0,1]=4 1906 B16R1.91 Cc1ccc(cc1)C(=O)OCCOCC=O 1032c02e81505bad0e6ad3f0882a7dc2 [0,1,0,0,0,0|2,0,1]=4 1907 B16R1.91 Cc1ccc(cc1)C(=O)OCCOCCF 79e9fb0add530f63416d80f9a9ba4b22 [0,1,0,0,0,0|2,0,0]=3 1908 B16R1.91 Cc1ccc(cc1)C(=O)OCCOCCS 7129cc86703cdb9e3031175f390e8216 [0,1,0,0,0,0|2,0,0]=3 1909 B16R1.91 Cc1ccc(cc1)C(C)OCCCCCF 99347ba6d781f387dd9d7306d7960061 [0,1,0,0,0,0|2,0,1]=4 1910 B16R1.91 Cc1ccc(cc1)[C@@H](C)OCCCCCF e1842c958c193e67e1a5b04c935edc17 [0,1,0,0,0,0|2,0,1]=4 1911 B16R1.91 Cc1ccc(cc1)[C@H](C)OCCCCCF 107bcac9acce816281237ca1a4333f70 [0,1,0,0,0,0|2,0,1]=4 1912 B16R1.91 Cc1ccc(cn1)C(=O)NCCCCCCl 61a2292337dd10f03e5aba421b95888d [0,1,0,0,0,0|3,0,0]=4 1913 B16R1.91 Cc1ccc(cn1)C(=O)NCCCCCO 3d015c60154c904f8058d04f54926a0e [0,1,0,0,0,0|3,0,0]=4 1914 B16R1.91 Cc1ccc(nc1)C(=O)NCCCCCCl 77b1cff3473f53da943478687c4b7557 [0,1,0,0,0,0|3,0,0]=4 1915 B16R1.91 Cc1ccc(nc1)C(=O)NCCCCCO 514c0efb290ac22e50e28be9e0c9e8ac [0,1,0,0,0,0|3,0,0]=4 1916 B16R1.91 N#CCCCCNC(=O)c1ccc(cc1)Br f36030a94f3fb51b2d67579b9b0eef14 [0,1,0,0,0,0|2,0,1]=4 1917 B16R1.91 N#CCCCCNC(=O)c1ccc(cc1)Cl 5ef6f2550741454ef63de3ec535567c0 [0,1,0,0,0,0|2,0,1]=4 1918 B16R1.91 N#CCCCCNC(=O)c1ccc(cc1)F eb3e8a4d00085b122a0094c2c7d57f7a [0,1,0,0,0,0|2,0,1]=4 1919 B16R1.91 N#CCCCCNC(=O)c1ccc(cc1)I d5c16602599a3bb0402473f365c7759e [0,1,0,0,0,0|2,0,1]=4 1920 B16R1.91 N#CCCCCNC(=O)c1ccc(cc1)O b8c021a45c6900ecccb8648cf00133cd [0,1,0,0,0,0|2,0,1]=4 1921 B16R1.91 N#CCCCCNC(=O)c1ccc(cc1)S c01b878713fbfa3cd04c28624133e918 [0,1,0,0,0,0|2,0,1]=4 1922 B16R1.91 N#CCCNCOC(=O)c1ccc(cc1)F 44215381b0a0ebd1713072925a771384 [0,1,0,0,0,0|2,0,1]=4 1923 B16R1.91 N#CCCOCOC(=O)c1ccc(cc1)F 3103abc78b8133e81dc42d41f60f5bff [0,1,0,0,0,0|2,0,1]=4 1924 B16R1.91 NOCCNCOC(=O)c1ccc(cc1)F a64aec07abeb0b95f76a201569eb7aa1 [0,1,0,0,0,0|3,0,0]=4 1925 B16R1.91 O=C(CCCNCCBr)c1ccc(cc1)Cl 916dc0b7442263b3d042a40434ada09a [0,1,0,0,0,0|3,0,0]=4 1926 B16R1.91 O=C(CCCNCCBr)c1ccc(cc1)F 30a2cc8d710a320dc75f90b9249d0a77 [0,1,0,0,0,0|3,0,0]=4 1927 B16R1.91 O=C(CCCNCCF)c1ccc(cc1)Cl 67b14f1f6d582e43c63a4303de33d6f0 [0,1,0,0,0,0|3,0,0]=4 1928 B16R1.91 O=C(CCCNCCF)c1ccc(cc1)F 5a841fcf7c19ad7f90275ad6f5dccca4 [0,1,0,0,0,0|3,0,0]=4 1929 B16R1.91 O=C(CCCNCCI)c1ccc(cc1)Cl afd2372f116016a5aa19077f0369a420 [0,1,0,0,0,0|3,0,0]=4 1930 B16R1.91 O=C(CCCNCCI)c1ccc(cc1)F b8d060ac8f49f9fc9f17e17ac59a4726 [0,1,0,0,0,0|3,0,0]=4 1931 B16R1.91 O=C(CCCNCCO)c1ccc(cc1)Cl 6b587c3d193f629046495217d6cc9801 [0,1,0,0,0,0|3,0,0]=4 1932 B16R1.91 O=C(CCCNCCO)c1ccc(cc1)F 3ff52f64c47f66080cab48ca109004a4 [0,1,0,0,0,0|3,0,0]=4 1933 B16R1.91 O=C(CCCNCCS)c1ccc(cc1)Cl e3fd89363cc1c97f97e988709c95805a [0,1,0,0,0,0|3,0,0]=4 1934 B16R1.91 O=C(CCCNCCS)c1ccc(cc1)F 88d33092d8532f7548a8d3e8e66bcc4e [0,1,0,0,0,0|3,0,0]=4 1935 B16R1.91 O=C(CCCOCCF)c1ccc(cc1)Cl 30d6a289a45d3f14d95b8f9db9cc4708 [0,1,0,0,0,0|3,0,0]=4 1936 B16R1.91 O=C(CCCOCCF)c1ccc(cc1)F d410a64aa912982f3144d2c62661ea3a [0,1,0,0,0,0|3,0,0]=4 1937 B16R1.91 O=C(CCCOCCS)c1ccc(cc1)Cl 292695bc7198bfc9676c623612a0891a [0,1,0,0,0,0|3,0,0]=4 1938 B16R1.91 O=C(CCCOCCS)c1ccc(cc1)F b2fb89127f072621328e619ba0a32447 [0,1,0,0,0,0|3,0,0]=4 1939 B16R1.91 O=C(CCNCCCCl)c1ccc(cc1)Br 6494edb16f395c368b2c415fe82c53f6 [0,1,0,0,0,0|3,0,0]=4 1940 B16R1.91 O=C(CCNCCCCl)c1ccc(cc1)F a869b34dbc1914fd6d3d467d3dd28c2e [0,1,0,0,0,0|3,0,0]=4 1941 B16R1.91 O=C(CCNCCCO)c1ccc(cc1)Br 8c41d5aed0b2877562ea0537afc39fc9 [0,1,0,0,0,0|3,0,0]=4 1942 B16R1.91 O=C(CCNCCCO)c1ccc(cc1)F 0140a5c6180c96825fcb959a128aeff4 [0,1,0,0,0,0|3,0,0]=4 1943 B16R1.91 O=C(CCOCCCF)c1ccc(cc1)Br 0257443d1980cce2bedce32deaf8238d [0,1,0,0,0,0|3,0,0]=4 1944 B16R1.91 O=C(CCOCCCF)c1ccc(cc1)Cl 1e1a810ecdaa558f207428eda4801c91 [0,1,0,0,0,0|3,0,0]=4 1945 B16R1.91 O=C(CCOCCCF)c1ccc(cc1)F 25623951ccd2cfd03893d4fbbda47003 [0,1,0,0,0,0|3,0,0]=4 1946 B16R1.91 O=C(CCOCCCS)c1ccc(cc1)Cl d52f995f884d2ff3e175ff4402e9ed23 [0,1,0,0,0,0|3,0,0]=4 1947 B16R1.91 O=C(CCOCCCS)c1ccc(cc1)F c929c17bb0355a73a710d3540915e7e8 [0,1,0,0,0,0|3,0,0]=4 1948 B16R1.91 O=C(CNCCCCCl)c1ccc(cc1)Br 24bccd733ea025a43c1a3b40c79aec72 [0,1,0,0,0,0|3,0,0]=4 1949 B16R1.91 O=C(CNCCCCCl)c1ccc(cc1)Cl d0381313994bee85a44749deb45e31b5 [0,1,0,0,0,0|3,0,0]=4 1950 B16R1.91 O=C(CNCCCCCl)c1ccc(cc1)F 5c38db6a102578102766e074b36dfe4d [0,1,0,0,0,0|3,0,0]=4 1951 B16R1.91 O=C(CNCCCCCl)c1ccc(cc1)I 3484ec87a65c6e39b0bce27683ba6707 [0,1,0,0,0,0|3,0,0]=4 1952 B16R1.91 O=C(CNCCCCF)c1ccc(cc1)Br 1d90aef52a6c6efcfc2d83a926a09527 [0,1,0,0,0,0|3,0,0]=4 1953 B16R1.91 O=C(CNCCCCF)c1ccc(cc1)Cl e1ed8bde1fcc8d1fa6cd9a7232ddbb6a [0,1,0,0,0,0|3,0,0]=4 1954 B16R1.91 O=C(CNCCCCO)c1ccc(cc1)Br 191ab8f03af8c7dac8c2d4b9691dcc44 [0,1,0,0,0,0|3,0,0]=4 1955 B16R1.91 O=C(CNCCCCO)c1ccc(cc1)Cl 810f43fbda42741a3db49d82ecad413b [0,1,0,0,0,0|3,0,0]=4 1956 B16R1.91 O=C(CNCCCCO)c1ccc(cc1)F 009220b4753bf8a3117b26acfef9b9db [0,1,0,0,0,0|3,0,0]=4 1957 B16R1.91 O=C(CNCCCCO)c1ccc(cc1)I fff02a5af4df4261e7aa1988a0286f21 [0,1,0,0,0,0|3,0,0]=4 1958 B16R1.91 O=C(CNCCCCS)c1ccc(cc1)Br 8bf7f8a564106e3e1bc557faa4245a0d [0,1,0,0,0,0|3,0,0]=4 1959 B16R1.91 O=C(CNCCCCS)c1ccc(cc1)Cl 35bfa4573a2bc2a686c9026c0b0f3d26 [0,1,0,0,0,0|3,0,0]=4 1960 B16R1.91 O=C(CNCCCCS)c1ccc(cc1)F 5e3f7fe92e19a6e436b2129d5988fd5d [0,1,0,0,0,0|3,0,0]=4 1961 B16R1.91 O=C(CNCCCCS)c1ccc(cc1)I 7b69079fedc09575471e6533e0951227 [0,1,0,0,0,0|3,0,0]=4 1962 B16R1.91 O=C(COCCCCF)c1ccc(cc1)Br 38df29be4b3688688068726bfb354f64 [0,1,0,0,0,0|3,0,0]=4 1963 B16R1.91 O=C(COCCCCF)c1ccc(cc1)Cl ae5c9857a974bc64b26dd650b7bf924a [0,1,0,0,0,0|3,0,0]=4 1964 B16R1.91 O=C(COCCCCF)c1ccc(cc1)F a84c8a97a9e1e454f5fb99dc3c7ba974 [0,1,0,0,0,0|3,0,0]=4 1965 B16R1.91 O=C(COCCCCF)c1ccc(cc1)I 255cf371b35cbd2349a20a776f91e699 [0,1,0,0,0,0|3,0,0]=4 1966 B16R1.91 O=C(COCCCCS)c1ccc(cc1)Br 5d08d190faf878ca5237bc9a42902d08 [0,1,0,0,0,0|3,0,0]=4 1967 B16R1.91 O=C(COCCCCS)c1ccc(cc1)Cl 81442376aa1e9b6f1a44c7b1307c5aa9 [0,1,0,0,0,0|3,0,0]=4 1968 B16R1.91 O=C(COCCCCS)c1ccc(cc1)F fb779666e0531f0e26ab80ed71296e64 [0,1,0,0,0,0|3,0,0]=4 1969 B16R1.91 O=C(COCCCCS)c1ccc(cc1)I 306aa4537f1dd386057b3c2011041474 [0,1,0,0,0,0|3,0,0]=4 1970 B16R1.91 O=C(NCCCCCCl)c1cc[n+](cc1)[O-] c4acbbca74ad893b3d40b20aeed95b02 [0,1,0,0,0,0|3,0,0]=4 1971 B16R1.91 O=C(NCCCCCCl)c1ccc(=O)oc1 ae4e84fc1d7dbf77422b16f0efcfd2ca [0,1,0,0,0,0|3,0,0]=4 1972 B16R1.91 O=C(NCCCCCCl)c1ccc(cc1)Br eff457537e759afdb342ff028753dede [0,1,0,0,0,0|2,0,0]=3 1973 B16R1.91 O=C(NCCCCCCl)c1ccc(cc1)Cl 1d78cb96bc962c4566cea510dd294fdb [0,1,0,0,0,0|2,0,0]=3 1974 B16R1.91 O=C(NCCCCCCl)c1ccc(cc1)F 0278093edd225bfc1ea326d8cb1ed30e [0,1,0,0,0,0|2,0,0]=3 1975 B16R1.91 O=C(NCCCCCCl)c1ccc(cc1)I 38cbcb10c3ad79433de9875558fc2184 [0,1,0,0,0,0|2,0,0]=3 1976 B16R1.91 O=C(NCCCCCCl)c1ccc(cc1)O dd6ec5c002c91b256f4c256034bf52c1 [0,1,0,0,0,0|2,0,0]=3 1977 B16R1.91 O=C(NCCCCCCl)c1ccc(cc1)S dfedd9858f7958cabcc6af49f4dbfa76 [0,1,0,0,0,0|2,0,0]=3 1978 B16R1.91 O=C(NCCCCCCl)c1ccc(cn1)Br 1408df2cdd6cd4704d3e9f9b0ca8b0ae [0,1,0,0,0,0|3,0,0]=4 1979 B16R1.91 O=C(NCCCCCCl)c1ccc(cn1)Cl e668cbabb070d2194d68d196f319ce31 [0,1,0,0,0,0|3,0,0]=4 1980 B16R1.91 O=C(NCCCCCCl)c1ccc(cn1)F 61175883153e355a56985d313fd2dbd1 [0,1,0,0,0,0|3,0,0]=4 1981 B16R1.91 O=C(NCCCCCCl)c1ccc(cn1)I e52f7a7e7f969edbf70ffc70e4fd046d [0,1,0,0,0,0|3,0,0]=4 1982 B16R1.91 O=C(NCCCCCCl)c1ccc(cn1)O 5896342538420c8b27536a94d190515e [0,1,0,0,0,0|3,0,0]=4 1983 B16R1.91 O=C(NCCCCCCl)c1ccc(nc1)Br 5fec1a87d0785cea7aba7e19f09e4b7d [0,1,0,0,0,0|3,0,0]=4 1984 B16R1.91 O=C(NCCCCCCl)c1ccc(nc1)Cl a1a6cdc1dcf86e24b9ec101b3665598b [0,1,0,0,0,0|3,0,0]=4 1985 B16R1.91 O=C(NCCCCCCl)c1ccc(nc1)F c000e58cb7e23a88d48374c602de22c9 [0,1,0,0,0,0|3,0,0]=4 1986 B16R1.91 O=C(NCCCCCCl)c1ccc(nc1)I 7c8ad171cf2918281ad79be3c0303847 [0,1,0,0,0,0|3,0,0]=4 1987 B16R1.91 O=C(NCCCCCCl)c1ccc(nc1)O 054b50d255195036d12b55e0a11da61d [0,1,0,0,0,0|3,0,0]=4 1988 B16R1.91 O=C(NCCCCCCl)c1ccc(nc1)S 54c8cc0eca78150ba32c23d50ab864d5 [0,1,0,0,0,0|3,0,0]=4 1989 B16R1.91 O=C(NCCCCCO)c1cc[n+](cc1)[O-] baf9b58d6548542c0e5572dd25c3c130 [0,1,0,0,0,0|3,0,0]=4 1990 B16R1.91 O=C(NCCCCCO)c1ccc(=O)oc1 d760afd1fe23e838e36679b620a807ed [0,1,0,0,0,0|3,0,0]=4 1991 B16R1.91 O=C(NCCCCCO)c1ccc(cc1)Br 1c49f085909719ca835e0cb54ced5ee8 [0,1,0,0,0,0|2,0,0]=3 1992 B16R1.91 O=C(NCCCCCO)c1ccc(cc1)Cl a6dc54c51d062aa3cf952c668ce82e7d [0,1,0,0,0,0|2,0,0]=3 1993 B16R1.91 O=C(NCCCCCO)c1ccc(cc1)F 800f9c08660cd33979fc2b1afe3ce618 [0,1,0,0,0,0|2,0,0]=3 1994 B16R1.91 O=C(NCCCCCO)c1ccc(cc1)I 5ce04eac5f7e6dd3741e255be2477b10 [0,1,0,0,0,0|2,0,0]=3 1995 B16R1.91 O=C(NCCCCCO)c1ccc(cc1)O 07984794a58d8d22bae3ec7521c82e77 [0,1,0,0,0,0|2,0,0]=3 1996 B16R1.91 O=C(NCCCCCO)c1ccc(cc1)S 635bff642dad4bfa8866a22ca73be4ce [0,1,0,0,0,0|2,0,0]=3 1997 B16R1.91 O=C(NCCCCCO)c1ccc(cn1)Br 3783829e8109aaa9f66e0432aaa27502 [0,1,0,0,0,0|3,0,0]=4 1998 B16R1.91 O=C(NCCCCCO)c1ccc(cn1)Cl e551e0b00f0c1f5560de817bc6497b41 [0,1,0,0,0,0|3,0,0]=4 1999 B16R1.91 O=C(NCCCCCO)c1ccc(cn1)F 82aab014715cba54ec29eb816902703e [0,1,0,0,0,0|3,0,0]=4 2000 B16R1.91 O=C(NCCCCCO)c1ccc(cn1)I 87a4f3c1e6a2e1614f49d1f81d458dd8 [0,1,0,0,0,0|3,0,0]=4 2001 B16R1.91 O=C(NCCCCCO)c1ccc(cn1)O 61dcedaf1232e5deb6c8de6113cb4af9 [0,1,0,0,0,0|3,0,0]=4 2002 B16R1.91 O=C(NCCCCCO)c1ccc(nc1)Br 03686935a26edf9ffadd2bd1e3453d76 [0,1,0,0,0,0|3,0,0]=4 2003 B16R1.91 O=C(NCCCCCO)c1ccc(nc1)Cl 4318e67ab43892803f6cbc547e860107 [0,1,0,0,0,0|3,0,0]=4 2004 B16R1.91 O=C(NCCCCCO)c1ccc(nc1)F 4b9bf3e3173c1798e16ee4a92f13ed43 [0,1,0,0,0,0|3,0,0]=4 2005 B16R1.91 O=C(NCCCCCO)c1ccc(nc1)I ccae35b36f7646176d0510b7a68e480b [0,1,0,0,0,0|3,0,0]=4 2006 B16R1.91 O=C(NCCCCCO)c1ccc(nc1)O 1c4dfa9daa5c5f6e85418cb4dbda6c53 [0,1,0,0,0,0|3,0,0]=4 2007 B16R1.91 O=C(NCCCCCO)c1ccc(nc1)S 76cbd9dfecc30b00b77a3ffd9127fafc [0,1,0,0,0,0|3,0,0]=4 2008 B16R1.91 O=C(NCCOCCF)c1ccc(cc1)Br 639d0c0799551a7b99567461813e8d55 [0,1,0,0,0,0|3,0,0]=4 2009 B16R1.91 O=C(NCCOCCO)c1ccc(cc1)Br 0c747f8b743dd7045907b2a7050b61c8 [0,1,0,0,0,0|3,0,0]=4 2010 B16R1.91 O=C(NCCOCCO)c1ccc(cc1)Cl 76f4805d356fedd7c863abca24fa7a1f [0,1,0,0,0,0|3,0,0]=4 2011 B16R1.91 O=C(NCCOCCO)c1ccc(cc1)F 9af9792c699d5647a03df96d559d7d3f [0,1,0,0,0,0|3,0,0]=4 2012 B16R1.91 O=C(NCCOCCO)c1ccc(cc1)I edd51b8fc8ae94ee1a27571efb960b01 [0,1,0,0,0,0|3,0,0]=4 2013 B16R1.91 O=C(NCCOCCO)c1ccc(cc1)O 6a877a3e54e32c2765ed1cf82f3cbfe8 [0,1,0,0,0,0|3,0,0]=4 2014 B16R1.91 O=C(NCCOCCO)c1ccc(cc1)S 1c8a5c3b951dc716a770809be8308201 [0,1,0,0,0,0|3,0,0]=4 2015 B16R1.91 O=C(NCCOCCS)c1ccc(cc1)Br 03d165b726386988651f05a33e6763cb [0,1,0,0,0,0|3,0,0]=4 2016 B16R1.91 O=C(NCCOCCS)c1ccc(cc1)Cl 00cc1011a604bf24c981b37ed1890df9 [0,1,0,0,0,0|3,0,0]=4 2017 B16R1.91 O=C(NCCOCCS)c1ccc(cc1)F bf8a8fedc708caa76cc7c7a5b1a74b2a [0,1,0,0,0,0|3,0,0]=4 2018 B16R1.91 O=C(NCCOCCS)c1ccc(cc1)I 0b539e9fe56f2065983e9d9b8d388db4 [0,1,0,0,0,0|3,0,0]=4 2019 B16R1.91 O=C(NCCOCCS)c1ccc(cc1)O d93ef2bd833775d93a46cc1974e05c22 [0,1,0,0,0,0|3,0,0]=4 2020 B16R1.91 O=C(NCCOCCS)c1ccc(cc1)S 4dbda4177b5f3e57aa2840b9b3e23eb2 [0,1,0,0,0,0|3,0,0]=4 2021 B16R1.91 O=C(NCCSCCO)c1ccc(cc1)Br 9949d9298aebe0bce26927886b89145f [0,1,0,0,0,0|3,0,0]=4 2022 B16R1.91 O=C(NCCSCCO)c1ccc(cc1)Cl d63dd08174b3afd2a3562684a8c82f17 [0,1,0,0,0,0|3,0,0]=4 2023 B16R1.91 O=C(NCCSCCO)c1ccc(cc1)F 444caa18345e60f52a3e71640419997b [0,1,0,0,0,0|3,0,0]=4 2024 B16R1.91 O=C(NCCSCCO)c1ccc(cc1)I 8eaa45c5fff9aa118bf6f502ba7b772f [0,1,0,0,0,0|3,0,0]=4 2025 B16R1.91 O=C(NCCSCCO)c1ccc(cc1)O 040520230dd4e73b88fb20187ad67061 [0,1,0,0,0,0|3,0,0]=4 2026 B16R1.91 O=C(NCCSCCO)c1ccc(cc1)S 473288d08fac014de5093d6586781a1d [0,1,0,0,0,0|3,0,0]=4 2027 B16R1.91 O=C(OCNCCCCl)c1ccc(cc1)F 49ac6c6ab884adc9e03b066066b69462 [0,1,0,0,0,0|2,0,0]=3 2028 B16R1.91 O=C(OCNCCCO)c1ccc(cc1)F 9af784df67c5af95e59a388ad182975e [0,1,0,0,0,0|2,0,0]=3 2029 B16R1.91 O=C(OCOCCCF)c1ccc(cc1)F 299dc2d7d8313bcd4dd8b7d57458c020 [0,1,0,0,0,0|2,0,0]=3 2030 B16R1.91 O=C(OCOCCCS)c1ccc(cc1)F 67b5048386528f41b6a862c190de021a [0,1,0,0,0,0|2,0,0]=3 2031 B16R1.91 O=CCCOCOC(=O)c1ccc(cc1)F 83b22963b61fa7b674ea535043063c1f [0,1,0,0,0,0|2,0,1]=4 2032 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)Br ddf5a9a9c4d075705b29626e6e1828fe [0,1,0,0,0,0|1,0,2]=4 2033 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)C 377457dae0ccf5e3f2f9df66a8425a22 [0,1,0,0,0,0|1,0,2]=4 2034 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)Cl ff39b22dbbbb0b15ce712d38b15c441a [0,1,0,0,0,0|1,0,2]=4 2035 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)F aa4c07947ab539a3e9452f0dd876ab6a [0,1,0,0,0,0|1,0,2]=4 2036 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)I 271a2d215777ab7368dc01c83def947f [0,1,0,0,0,0|1,0,2]=4 2037 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)O 61d5f1ac949bfa9daa2ebf06972a0661 [0,1,0,0,0,0|1,0,2]=4 2038 B16R1.92 C#CCCCCNC(=O)c1cccc(c1)S e427bed07e1076f2c860b85d96726d2f [0,1,0,0,0,0|1,0,2]=4 2039 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)Br 0ebb6572c7f6433dda2940650e06ec54 [0,1,0,0,0,0|1,0,2]=4 2040 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)C 6e0f22c154300917fff0572e3c7f02c6 [0,1,0,0,0,0|1,0,2]=4 2041 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)Cl a82f03e6f036251d2e03554a8db50f18 [0,1,0,0,0,0|1,0,2]=4 2042 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)F 34ef4622289b9dd006cdd588b95f1105 [0,1,0,0,0,0|1,0,2]=4 2043 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)I ebea8f233e0f5e929ddbd70844bd7fa5 [0,1,0,0,0,0|1,0,2]=4 2044 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)O 9eedb1fb704a6c06c24d92a2ff4e7bb8 [0,1,0,0,0,0|1,0,2]=4 2045 B16R1.92 C=CCCCCNC(=O)c1cccc(c1)S a9ae7de3e635aba0f26881f8460890b4 [0,1,0,0,0,0|1,0,2]=4 2046 B16R1.92 CC(OCCCCCF)c1cccc(c1)Br f033edaaac4b73001d245a7e3d3182f9 [0,1,0,0,0,0|2,0,1]=4 2047 B16R1.92 CC(OCCCCCF)c1cccc(c1)Cl 4580cc5b8e987c53625e646a87437690 [0,1,0,0,0,0|2,0,1]=4 2048 B16R1.92 CC(OCCCCCF)c1cccc(c1)F 715b04769850e50cc44e7a04d68c1ce9 [0,1,0,0,0,0|2,0,1]=4 2049 B16R1.92 CC(OCCCCCF)c1cccc(c1)I f1cc1fc8cfdac59efa5e387dfc180e77 [0,1,0,0,0,0|2,0,1]=4 2050 B16R1.92 CCCCCCCN(C)c1cccc(c1)Br f1dd0b92f88226e0606648612e1ed219 [0,1,0,0,0,0|3,0,0]=4 2051 B16R1.92 CCCCCCCN(C)c1cccc(c1)C abc0458dd457753dacb41f6ffdd91837 [0,1,0,0,0,0|3,0,0]=4 2052 B16R1.92 CCCCCCCN(C)c1cccc(c1)F a0e7c639f2fda78748a55b777643bfd6 [0,1,0,0,0,0|3,0,0]=4 2053 B16R1.92 CCCCCCCN(C)c1cccc(c1)I f98c5851bebbebff828df5827718f12f [0,1,0,0,0,0|3,0,0]=4 2054 B16R1.92 CCCCCCNC(=O)c1cc(=O)cco1 27ed3a4473314f51db3c3d00f08c27ca [0,1,0,0,0,0|2,0,0]=3 2055 B16R1.92 CCCCCCNC(=O)c1cc(ccn1)Br 8c19996f2d69a4ee503a3d5a72e89f8e [0,1,0,0,0,0|2,0,0]=3 2056 B16R1.92 CCCCCCNC(=O)c1cc(ccn1)C d9999b06f23e35209235d0107cec1dee [0,1,0,0,0,0|2,0,0]=3 2057 B16R1.92 CCCCCCNC(=O)c1cc(ccn1)Cl 4ad304dc4988a393e8a1c6c215558e52 [0,1,0,0,0,0|2,0,0]=3 2058 B16R1.92 CCCCCCNC(=O)c1cc(ccn1)F 84f300f9b4d678d04cf5ec04ab76610a [0,1,0,0,0,0|2,0,0]=3 2059 B16R1.92 CCCCCCNC(=O)c1cc(ccn1)I 2c26b521dd30378b2f3bd53e709e36c8 [0,1,0,0,0,0|2,0,0]=3 2060 B16R1.92 CCCCCCNC(=O)c1cc(ccn1)O 50328f5a177f39881d2ef0074a930865 [0,1,0,0,0,0|2,0,0]=3 2061 B16R1.92 CCCCCCNC(=O)c1cc(cnn1)C 7e66ae5a6b8c6d90d48edca48ec65ab5 [0,1,0,0,0,0|3,0,0]=4 2062 B16R1.92 CCCCCCNC(=O)c1cc(cnn1)Cl 301eed0592531c12b86e0804d88ed804 [0,1,0,0,0,0|3,0,0]=4 2063 B16R1.92 CCCCCCNC(=O)c1cc(ncn1)C e784819cdfca9d6f3839921c97fcdcef [0,1,0,0,0,0|3,0,0]=4 2064 B16R1.92 CCCCCCNC(=O)c1cc(ncn1)Cl ede9859127e7d661930d4fb02610176c [0,1,0,0,0,0|3,0,0]=4 2065 B16R1.92 CCCCCCNC(=O)c1cc(ncn1)O 44113ffc4c00aabf584c2b7f04762f43 [0,1,0,0,0,0|3,0,0]=4 2066 B16R1.92 CCCCCCNC(=O)c1ccc[n+](c1)[O-] a9573b1d7713580f5d10921becc2c8f1 [0,1,0,0,0,0|2,0,0]=3 2067 B16R1.92 CCCCCCNC(=O)c1cccc(c1)Br df1d39d03e2ad5c235a019b93a575e8d [0,1,0,0,0,0|1,0,0]=2 2068 B16R1.92 CCCCCCNC(=O)c1cccc(c1)C e5a71575cd3e07394bdd5a3fed0eb217 [0,1,0,0,0,0|1,0,0]=2 2069 B16R1.92 CCCCCCNC(=O)c1cccc(c1)Cl 707e9351c48f02aeeccd02f88006801f [0,1,0,0,0,0|1,0,0]=2 2070 B16R1.92 CCCCCCNC(=O)c1cccc(c1)F 79bcae77fac37e35fa54f8e9a036e6d1 [0,1,0,0,0,0|1,0,0]=2 2071 B16R1.92 CCCCCCNC(=O)c1cccc(c1)I 8d0d50425c20bc613a659d802f4330de [0,1,0,0,0,0|1,0,0]=2 2072 B16R1.92 CCCCCCNC(=O)c1cccc(c1)O 8b473df563b6332609618b122dc2bc6c [0,1,0,0,0,0|1,0,0]=2 2073 B16R1.92 CCCCCCNC(=O)c1cccc(c1)S 249618ac97bfb5d2b9c9aee0933aa80d [0,1,0,0,0,0|1,0,0]=2 2074 B16R1.92 CCCCCCNC(=O)c1cccc(n1)Br 0c8427c1c70206ab1d4a5176c1b1933b [0,1,0,0,0,0|2,0,0]=3 2075 B16R1.92 CCCCCCNC(=O)c1cccc(n1)C 3de4849b3b78ea3f47fbf081c059a612 [0,1,0,0,0,0|2,0,0]=3 2076 B16R1.92 CCCCCCNC(=O)c1cccc(n1)Cl 78ef48e95ac46629ff222d957fa72e5e [0,1,0,0,0,0|2,0,0]=3 2077 B16R1.92 CCCCCCNC(=O)c1cccc(n1)F 2d69b27295dbb79e07a6220bc387ea7a [0,1,0,0,0,0|2,0,0]=3 2078 B16R1.92 CCCCCCNC(=O)c1cccc(n1)I ec571ee42c74603ceb1de146a1649c01 [0,1,0,0,0,0|2,0,0]=3 2079 B16R1.92 CCCCCCNC(=O)c1cccc(n1)O 0c1b1c940eb47f9f7c8ca08d74d30fe0 [0,1,0,0,0,0|2,0,0]=3 2080 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)Br 406bcd095dbb99904c66b847341c2a95 [0,1,0,0,0,0|2,0,0]=3 2081 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)C 6ae76a984606a917d5202b0c8fe131c0 [0,1,0,0,0,0|2,0,0]=3 2082 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)Cl 403ba439c02f3aff1e373273001933cd [0,1,0,0,0,0|2,0,0]=3 2083 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)F f3031fde6e268010cf190fdcf8f2368f [0,1,0,0,0,0|2,0,0]=3 2084 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)I 3953c1e47e3f185bbff68cdbcd0ae1fa [0,1,0,0,0,0|2,0,0]=3 2085 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)O b5a0cbd86cf393f293c8e0cfacdb8be5 [0,1,0,0,0,0|2,0,0]=3 2086 B16R1.92 CCCCCCNC(=O)c1ccnc(c1)S f74a23b8809ccb861cef5ff27625bc83 [0,1,0,0,0,0|2,0,0]=3 2087 B16R1.92 CCCCCCNC(=O)c1ccnc(n1)Br c35df3bc64a1630ecf98508d8dcb5297 [0,1,0,0,0,0|3,0,0]=4 2088 B16R1.92 CCCCCCNC(=O)c1ccnc(n1)C 5b1e303c7db8bdcc78f66042b8e9beb2 [0,1,0,0,0,0|3,0,0]=4 2089 B16R1.92 CCCCCCNC(=O)c1ccnc(n1)Cl 8943cb6a4fe06d15cecf5e5834eefb93 [0,1,0,0,0,0|3,0,0]=4 2090 B16R1.92 CCCCCCNC(=O)c1cncc(c1)Br d880097bb406d3a9624b77e977110439 [0,1,0,0,0,0|2,0,0]=3 2091 B16R1.92 CCCCCCNC(=O)c1cncc(c1)C 1a121990f39c3df2e4e2fc3ec711f74f [0,1,0,0,0,0|2,0,0]=3 2092 B16R1.92 CCCCCCNC(=O)c1cncc(c1)Cl 47aab1a1b016173935bae36072ee1f38 [0,1,0,0,0,0|2,0,0]=3 2093 B16R1.92 CCCCCCNC(=O)c1cncc(c1)F a2b4415f42e71f1b88e4353ae3c3f68f [0,1,0,0,0,0|2,0,0]=3 2094 B16R1.92 CCCCCCNC(=O)c1cncc(c1)I 69acdef4957ed996327b1d0c81cb61fe [0,1,0,0,0,0|2,0,0]=3 2095 B16R1.92 CCCCCCNC(=O)c1cncc(c1)O f3834c083b7a2f165d75546acb381000 [0,1,0,0,0,0|2,0,0]=3 2096 B16R1.92 CCCCCCNC(=O)c1cncc(n1)Br 939ab3402b7834702d9a6cec3db0d651 [0,1,0,0,0,0|3,0,0]=4 2097 B16R1.92 CCCCCCNC(=O)c1cncc(n1)C 41c6d9f643dd6a36173fd2d91fb0426b [0,1,0,0,0,0|3,0,0]=4 2098 B16R1.92 CCCCCCNC(=O)c1cncc(n1)Cl 95ab3cd6046541103805af4ffdfc2364 [0,1,0,0,0,0|3,0,0]=4 2099 B16R1.92 CCCCCCNC(=O)c1cnnc(c1)Br fa341d2002b7d78addabfb7b928691c5 [0,1,0,0,0,0|3,0,0]=4 2100 B16R1.92 CCCCCCNC(=O)c1cnnc(c1)C 115bd310f544906d48486a9b55380b52 [0,1,0,0,0,0|3,0,0]=4 2101 B16R1.92 CCCCCCNC(=O)c1cnnc(c1)Cl 07d5ab54afad81ed193065e943463568 [0,1,0,0,0,0|3,0,0]=4 2102 B16R1.92 CCCCCCNC(=O)c1nccc(n1)C be8ad616c7cd6241fad3a7b4c8453f4c [0,1,0,0,0,0|3,0,0]=4 2103 B16R1.92 CCCCCCNC(=O)c1nccc(n1)Cl b12d6220467db3b0677e26e346d881c5 [0,1,0,0,0,0|3,0,0]=4 2104 B16R1.92 CCCCCCNC(C)c1cccc(c1)Br ad901e0dfd7d12eba65003de9305a93d [0,1,0,0,0,0|2,0,1]=4 2105 B16R1.92 CCCCCCNC(C)c1cccc(c1)C 29a53939cc7686ed0330ffea21fc4bfe [0,1,0,0,0,0|2,0,1]=4 2106 B16R1.92 CCCCCCNC(C)c1cccc(c1)Cl 45e2f329a70d6ac77c206ef7baa80c78 [0,1,0,0,0,0|2,0,1]=4 2107 B16R1.92 CCCCCCNC(C)c1cccc(c1)F 39757017c0e5fe3939295bf78f8e63fc [0,1,0,0,0,0|2,0,1]=4 2108 B16R1.92 CCCCCCN[C@@H](C)c1cccc(c1)Br cc585df50a82eb010258dab2ec711032 [0,1,0,0,0,0|2,0,1]=4 2109 B16R1.92 CCCCCCN[C@@H](C)c1cccc(c1)C 33a271b2496b00bcc269ee963d910e6d [0,1,0,0,0,0|2,0,1]=4 2110 B16R1.92 CCCCCCN[C@@H](C)c1cccc(c1)Cl bb7796b5711d499d1e64dff2b70a8581 [0,1,0,0,0,0|2,0,1]=4 2111 B16R1.92 CCCCCCN[C@@H](C)c1cccc(c1)F 233f7433c586f4cf19a968c56cfbec06 [0,1,0,0,0,0|2,0,1]=4 2112 B16R1.92 CCCCCCN[C@@H](C)c1cccc(c1)I 838f73832c98c6b7ddc52908ee659dc9 [0,1,0,0,0,0|2,0,1]=4 2113 B16R1.92 CCCCCCN[C@H](C)c1cccc(c1)Br 5bb9b140bfe8c0cc4b3c84a556d86c7f [0,1,0,0,0,0|2,0,1]=4 2114 B16R1.92 CCCCCCN[C@H](C)c1cccc(c1)C 654dede68b678b4a889fbdbc1f4e1d3b [0,1,0,0,0,0|2,0,1]=4 2115 B16R1.92 CCCCCCN[C@H](C)c1cccc(c1)Cl ea7f7ba9212652b7e2e068dc681e2b1d [0,1,0,0,0,0|2,0,1]=4 2116 B16R1.92 CCCCCCN[C@H](C)c1cccc(c1)F 3d5af565ec3362bb87fc9be2e597fc91 [0,1,0,0,0,0|2,0,1]=4 2117 B16R1.92 CCCCCCOC(C)c1cccc(c1)Br c9738706ac6aab51e32a808f7e574725 [0,1,0,0,0,0|1,0,1]=3 2118 B16R1.92 CCCCCCOC(C)c1cccc(c1)C d3e0ac747ef70b1a3bd23ed25a4de5ea [0,1,0,0,0,0|1,0,1]=3 2119 B16R1.92 CCCCCCOC(C)c1cccc(c1)Cl 558bcebd38b9287f7b46dc513d6b4af9 [0,1,0,0,0,0|1,0,1]=3 2120 B16R1.92 CCCCCCOC(C)c1cccc(c1)F 84e4906a131fc7a7592f6bee825b72cd [0,1,0,0,0,0|1,0,1]=3 2121 B16R1.92 CCCCCCOC(C)c1cccc(c1)I a4f68318ee4fab2fefc6af959375a81a [0,1,0,0,0,0|1,0,1]=3 2122 B16R1.92 CCCCCCOC(C)c1ccnc(c1)Br ae0c9fd72fe43eff2272d81c24140c3f [0,1,0,0,0,0|2,0,1]=4 2123 B16R1.92 CCCCCCOC(C)c1ccnc(c1)C 2bbed3eecc8f8dcf9251d5a6fef10ee3 [0,1,0,0,0,0|2,0,1]=4 2124 B16R1.92 CCCCCCOC(C)c1ccnc(c1)Cl cf2911be81f22ea20f0df73c20d0487c [0,1,0,0,0,0|2,0,1]=4 2125 B16R1.92 CCCCCCOC(C)c1cncc(c1)Cl 544cfb2cea4eeb5ad227a19e64c20f33 [0,1,0,0,0,0|2,0,1]=4 2126 B16R1.92 CCCCCCOC(C)c1cncc(c1)F 6440422373e4b3f6f60a6628ccdb8f69 [0,1,0,0,0,0|2,0,1]=4 2127 B16R1.92 CCCCCCO[C@@H](C)c1cccc(c1)Br aac901d4b60f4fb2c1dff7042febb769 [0,1,0,0,0,0|1,0,1]=3 2128 B16R1.92 CCCCCCO[C@@H](C)c1cccc(c1)C a2f343a940678f69c41bd3c2780836ce [0,1,0,0,0,0|1,0,1]=3 2129 B16R1.92 CCCCCCO[C@@H](C)c1cccc(c1)Cl ee137280b74168505ae56e1c016fce67 [0,1,0,0,0,0|1,0,1]=3 2130 B16R1.92 CCCCCCO[C@@H](C)c1cccc(c1)F 1775ea1b49be8f3c652888b1bb795789 [0,1,0,0,0,0|1,0,1]=3 2131 B16R1.92 CCCCCCO[C@H](C)c1cccc(c1)Br ef540b4469564e190c8a45527e8fb43c [0,1,0,0,0,0|1,0,1]=3 2132 B16R1.92 CCCCCCO[C@H](C)c1cccc(c1)C ed0ae607ef8ea99eaa51de6830d5f0e9 [0,1,0,0,0,0|1,0,1]=3 2133 B16R1.92 CCCCCCO[C@H](C)c1cccc(c1)Cl 5ca0f08e92752e42061fb2b13ff8e2f6 [0,1,0,0,0,0|1,0,1]=3 2134 B16R1.92 CCCCCCO[C@H](C)c1cccc(c1)F 1dc191d273360ae24c58a177cc270e78 [0,1,0,0,0,0|1,0,1]=3 2135 B16R1.92 CCCCCNCC(=O)c1cc(ccn1)Cl 62a37b3c7d4f9f60950471e42d293bba [0,1,0,0,0,0|3,0,0]=4 2136 B16R1.92 CCCCCNCC(=O)c1cccc(c1)Br 94b991c274ce40f2dc8ed8a60491d03d [0,1,0,0,0,0|2,0,0]=3 2137 B16R1.92 CCCCCNCC(=O)c1cccc(c1)C 6e42c12dba7c258675c5262ff1e51a22 [0,1,0,0,0,0|2,0,0]=3 2138 B16R1.92 CCCCCNCC(=O)c1cccc(c1)Cl 2afd5215d813b6257a198b4892e59932 [0,1,0,0,0,0|2,0,0]=3 2139 B16R1.92 CCCCCNCC(=O)c1cccc(c1)F 7a38df899134639fff20f3625d5074d1 [0,1,0,0,0,0|2,0,0]=3 2140 B16R1.92 CCCCCNCC(=O)c1cccc(c1)I 0cd00bd949cf70b440db6a7e23376399 [0,1,0,0,0,0|2,0,0]=3 2141 B16R1.92 CCCCCNCC(=O)c1cccc(n1)Br 485ef4c62261f432dc4c54baf69bd002 [0,1,0,0,0,0|3,0,0]=4 2142 B16R1.92 CCCCCNCC(=O)c1cccc(n1)C 6a1c250840b244c652eb6b5332d1df61 [0,1,0,0,0,0|3,0,0]=4 2143 B16R1.92 CCCCCNCC(=O)c1ccnc(c1)Cl 96ccc60526e4297f2df2f023bd8538d4 [0,1,0,0,0,0|3,0,0]=4 2144 B16R1.92 CCCCCNCC(=O)c1ccnc(c1)F eade9f26ca876dfc677a700a2a82d749 [0,1,0,0,0,0|3,0,0]=4 2145 B16R1.92 CCCCCOCC(=O)c1cc(ccn1)Cl 58a66495c082186b0ef9f07175335ff1 [0,1,0,0,0,0|3,0,0]=4 2146 B16R1.92 CCCCCOCC(=O)c1cccc(c1)Br 61ba53ff2b7a99ee883bdf25023b1c5c [0,1,0,0,0,0|2,0,0]=3 2147 B16R1.92 CCCCCOCC(=O)c1cccc(c1)C b8685ecc85680b5a08f500a4ca12af95 [0,1,0,0,0,0|2,0,0]=3 2148 B16R1.92 CCCCCOCC(=O)c1cccc(c1)Cl 447292aa6f308c50d1d4b0258be9d9d4 [0,1,0,0,0,0|2,0,0]=3 2149 B16R1.92 CCCCCOCC(=O)c1cccc(c1)F f5771185be8830d5af22a999af95f239 [0,1,0,0,0,0|2,0,0]=3 2150 B16R1.92 CCCCCOCC(=O)c1cccc(c1)I 5ff27f05bad7070fbececfd714a2fe9e [0,1,0,0,0,0|2,0,0]=3 2151 B16R1.92 CCCCCOCC(=O)c1cccc(n1)Br 2fc08538b9d542bee743ad58872fb553 [0,1,0,0,0,0|3,0,0]=4 2152 B16R1.92 CCCCCOCC(=O)c1cccc(n1)C ad0dce316150ec6416e83e38e3e65ae9 [0,1,0,0,0,0|3,0,0]=4 2153 B16R1.92 CCCCCOCC(=O)c1ccnc(c1)Cl 786a9d7b26107cffc10b40188efd9671 [0,1,0,0,0,0|3,0,0]=4 2154 B16R1.92 CCCCCOCC(=O)c1ccnc(c1)F 38f6095d33e4cc68b60e22a9f9f362f0 [0,1,0,0,0,0|3,0,0]=4 2155 B16R1.92 CCCCOCNC(=O)c1cccc(c1)C 1fa8e5ad9db557efc79d9cbef56b4f3b [0,1,0,0,0,0|2,0,0]=3 2156 B16R1.92 CCCCOCOC(C)c1cccc(c1)Br f06cfb35f6c9e51a954b95eb3e725986 [0,1,0,0,0,0|2,0,1]=4 2157 B16R1.92 CCCCOCOC(C)c1cccc(c1)C 848eb97821891069c33129625f98d9cf [0,1,0,0,0,0|2,0,1]=4 2158 B16R1.92 CCCCOCOC(C)c1cccc(c1)Cl cd8906a58d4c2104eebd62d546f1fa85 [0,1,0,0,0,0|2,0,1]=4 2159 B16R1.92 CCCCOCOC(C)c1cccc(c1)F 4801ee3e2a44c0a3bc0700078d0c2ae9 [0,1,0,0,0,0|2,0,1]=4 2160 B16R1.92 CCCCOCOC(C)c1cccc(c1)I d4927961d2248633d3357e3c1af2973e [0,1,0,0,0,0|2,0,1]=4 2161 B16R1.92 CCCCOCO[C@@H](C)c1cccc(c1)Br f18737ced3a06d27da66079c5e90427b [0,1,0,0,0,0|2,0,1]=4 2162 B16R1.92 CCCCOCO[C@@H](C)c1cccc(c1)C 86d3fd31bdc1439794bee9924b535650 [0,1,0,0,0,0|2,0,1]=4 2163 B16R1.92 CCCCOCO[C@@H](C)c1cccc(c1)Cl 539010617972e3e1e04ebf1eb7d4f6f5 [0,1,0,0,0,0|2,0,1]=4 2164 B16R1.92 CCCCOCO[C@@H](C)c1cccc(c1)F 5843d87c87f0b640b74a841374415d79 [0,1,0,0,0,0|2,0,1]=4 2165 B16R1.92 CCCCOCO[C@H](C)c1cccc(c1)Br 047bcb8aa9dd81ee3528706c42bf8008 [0,1,0,0,0,0|2,0,1]=4 2166 B16R1.92 CCCCOCO[C@H](C)c1cccc(c1)C 341562802491bccabd93dad59c15fe95 [0,1,0,0,0,0|2,0,1]=4 2167 B16R1.92 CCCCOCO[C@H](C)c1cccc(c1)Cl cd6adb33168ab5bec9d0098b3521511f [0,1,0,0,0,0|2,0,1]=4 2168 B16R1.92 CCCCOCO[C@H](C)c1cccc(c1)F 86b396ba7636a83922252fe1bc2da41b [0,1,0,0,0,0|2,0,1]=4 2169 B16R1.92 CCCNCCCC(=O)c1cccc(c1)C dbb3008e0ea52133420aa5e2665f314d [0,1,0,0,0,0|2,0,0]=3 2170 B16R1.92 CCCNCCCC(=O)c1cccc(c1)F 5f4a85cb1c13713b2c183a156539dbdd [0,1,0,0,0,0|2,0,0]=3 2171 B16R1.92 CCCOCCCC(=O)c1cccc(c1)F 9d21b08b2d49f70ace6692a96e09b9c5 [0,1,0,0,0,0|2,0,0]=3 2172 B16R1.92 CCCOCCNC(=O)c1cc(=O)cco1 98e82ba17446900ebda02d4187008142 [0,1,0,0,0,0|3,0,0]=4 2173 B16R1.92 CCCOCCNC(=O)c1cc(ccn1)Br 63f22fc828b69d119a0b519da86e1374 [0,1,0,0,0,0|3,0,0]=4 2174 B16R1.92 CCCOCCNC(=O)c1cc(ccn1)C 9f6d8392f508b047d06ec1841b91abeb [0,1,0,0,0,0|3,0,0]=4 2175 B16R1.92 CCCOCCNC(=O)c1cc(ccn1)Cl d2f78cc6b85f6222e06384933370e8bd [0,1,0,0,0,0|3,0,0]=4 2176 B16R1.92 CCCOCCNC(=O)c1cc(ccn1)F d6eb3d578b1a4e708b689de5e6e45556 [0,1,0,0,0,0|3,0,0]=4 2177 B16R1.92 CCCOCCNC(=O)c1cc(ccn1)I c8437fe48f2e23bf522a355d771e4890 [0,1,0,0,0,0|3,0,0]=4 2178 B16R1.92 CCCOCCNC(=O)c1cc(ccn1)O a00ae36570319742a5c8f9464a91a0d1 [0,1,0,0,0,0|3,0,0]=4 2179 B16R1.92 CCCOCCNC(=O)c1ccc[n+](c1)[O-] 645a276fdecdb477933d1ba6b6cda6a3 [0,1,0,0,0,0|3,0,0]=4 2180 B16R1.92 CCCOCCNC(=O)c1cccc(c1)Br 72ee8379cb66fa6ddfac1cda89255d8c [0,1,0,0,0,0|2,0,0]=3 2181 B16R1.92 CCCOCCNC(=O)c1cccc(c1)C 3f815a08ef458a43a4e0bea7817ce629 [0,1,0,0,0,0|2,0,0]=3 2182 B16R1.92 CCCOCCNC(=O)c1cccc(c1)Cl f5cb864f3252a3889ded11f53d752831 [0,1,0,0,0,0|2,0,0]=3 2183 B16R1.92 CCCOCCNC(=O)c1cccc(c1)F 993f496aa064aa6e10d30288dbc119c6 [0,1,0,0,0,0|2,0,0]=3 2184 B16R1.92 CCCOCCNC(=O)c1cccc(c1)I 2a7a8e0efaaf8a855005b353becf8f1d [0,1,0,0,0,0|2,0,0]=3 2185 B16R1.92 CCCOCCNC(=O)c1cccc(c1)O c997b445ee2f97e4384a6f30b07cc43b [0,1,0,0,0,0|2,0,0]=3 2186 B16R1.92 CCCOCCNC(=O)c1cccc(c1)S 0e1935fc66c40421cf05040997f55574 [0,1,0,0,0,0|2,0,0]=3 2187 B16R1.92 CCCOCCNC(=O)c1cccc(n1)Br f598eb5dfaccd7c7dc93d51f1dc330e3 [0,1,0,0,0,0|3,0,0]=4 2188 B16R1.92 CCCOCCNC(=O)c1cccc(n1)C 1d2f486d0388cb8fc3d2a33d07bf5641 [0,1,0,0,0,0|3,0,0]=4 2189 B16R1.92 CCCOCCNC(=O)c1cccc(n1)Cl c67679f43d0667475e8a3f9af8cd4809 [0,1,0,0,0,0|3,0,0]=4 2190 B16R1.92 CCCOCCNC(=O)c1cccc(n1)F d74293d4cff5350fab91a9f6fc11e1ea [0,1,0,0,0,0|3,0,0]=4 2191 B16R1.92 CCCOCCNC(=O)c1cccc(n1)I ed4a61e12b138490f4947a5cddd2f5a5 [0,1,0,0,0,0|3,0,0]=4 2192 B16R1.92 CCCOCCNC(=O)c1cccc(n1)O 5381fa9bb9370247eab4bb4560abeab9 [0,1,0,0,0,0|3,0,0]=4 2193 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)Br 4f892e50c365777c4d40959fa23de227 [0,1,0,0,0,0|3,0,0]=4 2194 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)C 5d534fbfacb36dee1e140a11f0e45168 [0,1,0,0,0,0|3,0,0]=4 2195 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)Cl 7dbcfd5e8cd8b24eed01d252ff862227 [0,1,0,0,0,0|3,0,0]=4 2196 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)F 0f8f149846f1396ded5301b174c2bbed [0,1,0,0,0,0|3,0,0]=4 2197 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)I 91a246ba16e065490d1d52847017b2dc [0,1,0,0,0,0|3,0,0]=4 2198 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)O 09a97cb34a3dad8c5f078b5657bacfcb [0,1,0,0,0,0|3,0,0]=4 2199 B16R1.92 CCCOCCNC(=O)c1ccnc(c1)S a54c7d2e0cb9f45361e037bb3b7640c0 [0,1,0,0,0,0|3,0,0]=4 2200 B16R1.92 CCCOCCNC(=O)c1cncc(c1)Br 37a1d75f1704915734858e18afa050a0 [0,1,0,0,0,0|3,0,0]=4 2201 B16R1.92 CCCOCCNC(=O)c1cncc(c1)C 8f1b217cd6eca394df4b3042cf53b2a9 [0,1,0,0,0,0|3,0,0]=4 2202 B16R1.92 CCCOCCNC(=O)c1cncc(c1)Cl 0da67a262713ee22965d4d49e2fd6bc1 [0,1,0,0,0,0|3,0,0]=4 2203 B16R1.92 CCCOCCNC(=O)c1cncc(c1)F e5d3368c4abf9706e0b66111dbbfcfec [0,1,0,0,0,0|3,0,0]=4 2204 B16R1.92 CCCOCCNC(=O)c1cncc(c1)I 95662b31a261c8b43b89635f845cc30a [0,1,0,0,0,0|3,0,0]=4 2205 B16R1.92 CCCOCCNC(=O)c1cncc(c1)O bf927237e087fd4c269024b3083c551f [0,1,0,0,0,0|3,0,0]=4 2206 B16R1.92 CCCOCCOC(C)c1cccc(c1)Br af451559eadfe1da8d8a64dc418b5033 [0,1,0,0,0,0|2,0,1]=4 2207 B16R1.92 CCCOCCOC(C)c1cccc(c1)C 193cd15398790b6c829be58f9f42c476 [0,1,0,0,0,0|2,0,1]=4 2208 B16R1.92 CCCOCCOC(C)c1cccc(c1)Cl e31ffc4d7a7f5a724117fd0f7b59246e [0,1,0,0,0,0|2,0,1]=4 2209 B16R1.92 CCCOCCOC(C)c1cccc(c1)F 110f05e9b49fc789d7d6cc3093147f59 [0,1,0,0,0,0|2,0,1]=4 2210 B16R1.92 CCCOCCOC(C)c1cccc(c1)I d4e31fd2ad07c75789f79b2029bbc1cb [0,1,0,0,0,0|2,0,1]=4 2211 B16R1.92 CCCOCCO[C@@H](C)c1cccc(c1)Br a47d4a486984ee0d6087af5e365ec6bc [0,1,0,0,0,0|2,0,1]=4 2212 B16R1.92 CCCOCCO[C@@H](C)c1cccc(c1)C 2515bc7b7faaf09210bdf32cea5b3742 [0,1,0,0,0,0|2,0,1]=4 2213 B16R1.92 CCCOCCO[C@@H](C)c1cccc(c1)Cl b50a2bb875c100f592f2373f647a667c [0,1,0,0,0,0|2,0,1]=4 2214 B16R1.92 CCCOCCO[C@@H](C)c1cccc(c1)F 5cb5acae1a0973d0b85a2bd1844c3a06 [0,1,0,0,0,0|2,0,1]=4 2215 B16R1.92 CCCOCCO[C@H](C)c1cccc(c1)Br 52a42d83bd67a47164ac2ba584bcdf47 [0,1,0,0,0,0|2,0,1]=4 2216 B16R1.92 CCCOCCO[C@H](C)c1cccc(c1)C 9bbbc8427e8740a7c76ad4a7d5fc5aa2 [0,1,0,0,0,0|2,0,1]=4 2217 B16R1.92 CCCOCCO[C@H](C)c1cccc(c1)Cl 1a8e2182c468c8b1f6c8ec31a94a0038 [0,1,0,0,0,0|2,0,1]=4 2218 B16R1.92 CCCOCCO[C@H](C)c1cccc(c1)F 24e21e3b2c7704d18038d2405ca9f53d [0,1,0,0,0,0|2,0,1]=4 2219 B16R1.92 CCCSCCOC(C)c1cccc(c1)Cl 4175ea156964b35995c06384cf2c14fb [0,1,0,0,0,0|2,0,1]=4 2220 B16R1.92 CCCSCCOC(C)c1cccc(c1)F 85b4a04d9c911c0b7f245318f66107ad [0,1,0,0,0,0|2,0,1]=4 2221 B16R1.92 CCNCCCNC(=O)c1cccc(c1)Br 8865f4f3c02fb7ec7199dcfc6bfbcd89 [0,1,0,0,0,0|2,0,0]=3 2222 B16R1.92 CCOCCCNC(=O)c1cc(=O)cco1 b2b030a5fef017aef3dc5b852c3cb35a [0,1,0,0,0,0|3,0,0]=4 2223 B16R1.92 CCOCCCNC(=O)c1cc(ccn1)Br 0cb34777d5373a882d5806dd0c4619cd [0,1,0,0,0,0|3,0,0]=4 2224 B16R1.92 CCOCCCNC(=O)c1cc(ccn1)C 6d41fff3e46d8ba90b2d5985a36355db [0,1,0,0,0,0|3,0,0]=4 2225 B16R1.92 CCOCCCNC(=O)c1cc(ccn1)Cl 9d2852db0b3b108fee11d8604e402474 [0,1,0,0,0,0|3,0,0]=4 2226 B16R1.92 CCOCCCNC(=O)c1cc(ccn1)F 8294ec883665674db0acec51dba84a45 [0,1,0,0,0,0|3,0,0]=4 2227 B16R1.92 CCOCCCNC(=O)c1cc(ccn1)I 762f6f5dfa1ab679a25226b27d7a4ecf [0,1,0,0,0,0|3,0,0]=4 2228 B16R1.92 CCOCCCNC(=O)c1cc(ccn1)O 65c04f160f6a0e9c2d3c39e56bf9025e [0,1,0,0,0,0|3,0,0]=4 2229 B16R1.92 CCOCCCNC(=O)c1ccc[n+](c1)[O-] 3b7abf85b78077137c7eb2db233058be [0,1,0,0,0,0|3,0,0]=4 2230 B16R1.92 CCOCCCNC(=O)c1cccc(c1)Br 1db7bd67c8b11e365dfa5acbd007403f [0,1,0,0,0,0|2,0,0]=3 2231 B16R1.92 CCOCCCNC(=O)c1cccc(c1)C f7e59cb0fe648906878c17fc45035748 [0,1,0,0,0,0|2,0,0]=3 2232 B16R1.92 CCOCCCNC(=O)c1cccc(c1)Cl 2348a7c1c02fb603a6e665dc401ce9a1 [0,1,0,0,0,0|2,0,0]=3 2233 B16R1.92 CCOCCCNC(=O)c1cccc(c1)F 41275ed80acc485022308e3685bcd70c [0,1,0,0,0,0|2,0,0]=3 2234 B16R1.92 CCOCCCNC(=O)c1cccc(c1)I eaa6f4f70fa28ff6fbb38c60fdafb044 [0,1,0,0,0,0|2,0,0]=3 2235 B16R1.92 CCOCCCNC(=O)c1cccc(c1)O 593f2a3e71df7ca457f9ab7cc1aad3ed [0,1,0,0,0,0|2,0,0]=3 2236 B16R1.92 CCOCCCNC(=O)c1cccc(c1)S f1c9c76faf70c921a90354271bd92591 [0,1,0,0,0,0|2,0,0]=3 2237 B16R1.92 CCOCCCNC(=O)c1cccc(n1)Br 0be0588953a81915748fb965c9512174 [0,1,0,0,0,0|3,0,0]=4 2238 B16R1.92 CCOCCCNC(=O)c1cccc(n1)C bb029ab7b12eada85af040b7cfd862eb [0,1,0,0,0,0|3,0,0]=4 2239 B16R1.92 CCOCCCNC(=O)c1cccc(n1)Cl 774b1eb9e2ca1ee0fc3a67fb7063ca77 [0,1,0,0,0,0|3,0,0]=4 2240 B16R1.92 CCOCCCNC(=O)c1cccc(n1)F 62b6dbeae4db60c4b8d46cb2dcde7bc7 [0,1,0,0,0,0|3,0,0]=4 2241 B16R1.92 CCOCCCNC(=O)c1cccc(n1)I b66b301ce6f1eb5bb73f24db46d76864 [0,1,0,0,0,0|3,0,0]=4 2242 B16R1.92 CCOCCCNC(=O)c1cccc(n1)O ae2fc1104e7567fbc22e3b4ca4b992aa [0,1,0,0,0,0|3,0,0]=4 2243 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)Br 48591dc65f8bfef24880122d143c0673 [0,1,0,0,0,0|3,0,0]=4 2244 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)C 46eca9c6c4464ea6072094671bf4e376 [0,1,0,0,0,0|3,0,0]=4 2245 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)Cl 3dfc3899df1d1198666fbedf70bf4779 [0,1,0,0,0,0|3,0,0]=4 2246 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)F 6b6cb1920496477cbf02851cec5eb0df [0,1,0,0,0,0|3,0,0]=4 2247 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)I 6856c8811f1c5bd942e72ae2aa90adc1 [0,1,0,0,0,0|3,0,0]=4 2248 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)O bb649bae22663fe4fcafab759cbcb313 [0,1,0,0,0,0|3,0,0]=4 2249 B16R1.92 CCOCCCNC(=O)c1ccnc(c1)S c5d67daffce4e09a0e8aa1f76113354a [0,1,0,0,0,0|3,0,0]=4 2250 B16R1.92 CCOCCCNC(=O)c1cncc(c1)Br f229301da27bbe9f3782482108ce1df2 [0,1,0,0,0,0|3,0,0]=4 2251 B16R1.92 CCOCCCNC(=O)c1cncc(c1)C bf61bda296da5bdf387f7e34fec3e2ca [0,1,0,0,0,0|3,0,0]=4 2252 B16R1.92 CCOCCCNC(=O)c1cncc(c1)Cl 6d6ee016324d6bc863684f4aaae69f44 [0,1,0,0,0,0|3,0,0]=4 2253 B16R1.92 CCOCCCNC(=O)c1cncc(c1)F ec0011ff602bcb35e35a81d466b6b41d [0,1,0,0,0,0|3,0,0]=4 2254 B16R1.92 CCOCCCNC(=O)c1cncc(c1)I b124a188c6474c169558b364fae2d98e [0,1,0,0,0,0|3,0,0]=4 2255 B16R1.92 CCOCCCNC(=O)c1cncc(c1)O 3c7180589e0aa9266f6c19fbaae090e3 [0,1,0,0,0,0|3,0,0]=4 2256 B16R1.92 CCOCCCOC(C)c1cccc(c1)Br 3deff1a89760441d27d2714c625075cb [0,1,0,0,0,0|2,0,1]=4 2257 B16R1.92 CCOCCCOC(C)c1cccc(c1)C 68dbefea2ad1375fd6d1751c7315cd33 [0,1,0,0,0,0|2,0,1]=4 2258 B16R1.92 CCOCCCOC(C)c1cccc(c1)Cl 113513603336e5799d8c5ff247599038 [0,1,0,0,0,0|2,0,1]=4 2259 B16R1.92 CCOCCCOC(C)c1cccc(c1)F f76d07aea068513d45ebd215074fb668 [0,1,0,0,0,0|2,0,1]=4 2260 B16R1.92 CCOCCCOC(C)c1cccc(c1)I ebe0b6936f4e07e291162428c348f87c [0,1,0,0,0,0|2,0,1]=4 2261 B16R1.92 CCOCCCO[C@@H](C)c1cccc(c1)Br 94346aaf7c7bd992633b18fc19cbebc1 [0,1,0,0,0,0|2,0,1]=4 2262 B16R1.92 CCOCCCO[C@@H](C)c1cccc(c1)C f6e665eabb0f5dc96586917b1af89a97 [0,1,0,0,0,0|2,0,1]=4 2263 B16R1.92 CCOCCCO[C@@H](C)c1cccc(c1)Cl 8748f1c203b11d87eab6acbe1ce6b053 [0,1,0,0,0,0|2,0,1]=4 2264 B16R1.92 CCOCCCO[C@@H](C)c1cccc(c1)F 40899d1e324a744588b6839b041eab82 [0,1,0,0,0,0|2,0,1]=4 2265 B16R1.92 CCOCCCO[C@H](C)c1cccc(c1)Br dd9edcb3426f46fc70866c4189d9538c [0,1,0,0,0,0|2,0,1]=4 2266 B16R1.92 CCOCCCO[C@H](C)c1cccc(c1)C f6f1da989b3d32b78c9cc805e97a32f7 [0,1,0,0,0,0|2,0,1]=4 2267 B16R1.92 CCOCCCO[C@H](C)c1cccc(c1)Cl 8dc198a8d3f5d9de0903d3abdfdf9aa0 [0,1,0,0,0,0|2,0,1]=4 2268 B16R1.92 CCOCCCO[C@H](C)c1cccc(c1)F d6f21f7ea10082c788b068d627f52c00 [0,1,0,0,0,0|2,0,1]=4 2269 B16R1.92 CCOCCNCC(=O)c1cccc(c1)Br a39f51d284ba2149f3ceefa1ecf80bd4 [0,1,0,0,0,0|3,0,0]=4 2270 B16R1.92 CCOCCNCC(=O)c1cccc(c1)C b3510dcd4129cadd5b2d856972dee01d [0,1,0,0,0,0|3,0,0]=4 2271 B16R1.92 CCOCCNCC(=O)c1cccc(c1)Cl b22dfcc1f6131fb3dfeda6610aa82c95 [0,1,0,0,0,0|3,0,0]=4 2272 B16R1.92 CCOCCNCC(=O)c1cccc(c1)F 42b02f50a2a6fa522a0c018d3a05c582 [0,1,0,0,0,0|3,0,0]=4 2273 B16R1.92 CCOCCNCC(=O)c1cccc(c1)I 8743ed3469c7b814a3ce1b6a549cd1e2 [0,1,0,0,0,0|3,0,0]=4 2274 B16R1.92 CCOCCOCC(=O)c1cccc(c1)Br 1dc65b44989fe8773c95fa6b90e1135e [0,1,0,0,0,0|3,0,0]=4 2275 B16R1.92 CCOCCOCC(=O)c1cccc(c1)C e60ddfeb185d8583d94a9e763cc72769 [0,1,0,0,0,0|3,0,0]=4 2276 B16R1.92 CCOCCOCC(=O)c1cccc(c1)Cl fb240d7bfb16dc5ad23c8a8842611095 [0,1,0,0,0,0|3,0,0]=4 2277 B16R1.92 CCOCCOCC(=O)c1cccc(c1)F 00c4f6c21a33662984303df5b079e637 [0,1,0,0,0,0|3,0,0]=4 2278 B16R1.92 CCOCCOCC(=O)c1cccc(c1)I e145731cc4b1f1a31e102053411ee417 [0,1,0,0,0,0|3,0,0]=4 2279 B16R1.92 CCOCOCNC(=O)c1cccc(c1)C 2cb7ed9add822c128dd368aa07485656 [0,1,0,0,0,0|3,0,0]=4 2280 B16R1.92 CCSCCCOC(C)c1cccc(c1)Br 56c7a505e22d0bdd44b1ff1e9a6715c8 [0,1,0,0,0,0|2,0,1]=4 2281 B16R1.92 CCSCCCOC(C)c1cccc(c1)C 403d9ce33caabd3b239afa790270e60b [0,1,0,0,0,0|2,0,1]=4 2282 B16R1.92 CCSCCCOC(C)c1cccc(c1)Cl ce6492159ca3c6b53c4e7232917f950a [0,1,0,0,0,0|2,0,1]=4 2283 B16R1.92 CCSCCCOC(C)c1cccc(c1)F abf63138abcb9fed9af0dc1edf88613b [0,1,0,0,0,0|2,0,1]=4 2284 B16R1.92 CCSCCCOC(C)c1cccc(c1)I 505e4d3c80ccdce99cee1d3a0032520e [0,1,0,0,0,0|2,0,1]=4 2285 B16R1.92 CCSCCCO[C@@H](C)c1cccc(c1)Br e3e263ccad7b030414bb5bb3aa842bb2 [0,1,0,0,0,0|2,0,1]=4 2286 B16R1.92 CCSCCCO[C@@H](C)c1cccc(c1)C 2c7a62f9d603355419297ed583b425d0 [0,1,0,0,0,0|2,0,1]=4 2287 B16R1.92 CCSCCCO[C@@H](C)c1cccc(c1)Cl 22be65be5c7472b100b4319a536e69c2 [0,1,0,0,0,0|2,0,1]=4 2288 B16R1.92 CCSCCCO[C@@H](C)c1cccc(c1)F 8354e5d303c09ebae3b7f86889ba1b1a [0,1,0,0,0,0|2,0,1]=4 2289 B16R1.92 CCSCCCO[C@H](C)c1cccc(c1)Br 603c817013f1805245b920c41f255eb1 [0,1,0,0,0,0|2,0,1]=4 2290 B16R1.92 CCSCCCO[C@H](C)c1cccc(c1)C 7ca6e8f5b7643beecc0b34f8fd5ee7c4 [0,1,0,0,0,0|2,0,1]=4 2291 B16R1.92 CCSCCCO[C@H](C)c1cccc(c1)Cl 4a398479227f15c6f3ad3361d3e40a5c [0,1,0,0,0,0|2,0,1]=4 2292 B16R1.92 CCSCCCO[C@H](C)c1cccc(c1)F c1bb12a3e6ffe16204e11a9b495d053a [0,1,0,0,0,0|2,0,1]=4 2293 B16R1.92 CCSCCNCC(=O)c1cccc(c1)Br fef1c4d89292a291b71574cd3c032e4d [0,1,0,0,0,0|3,0,0]=4 2294 B16R1.92 CCSCCNCC(=O)c1cccc(c1)C e42acdfc39739a28b7e904882ae93107 [0,1,0,0,0,0|3,0,0]=4 2295 B16R1.92 CCSCCNCC(=O)c1cccc(c1)Cl 4aeda4dbd2c2a818a243aaf7e25ceb8a [0,1,0,0,0,0|3,0,0]=4 2296 B16R1.92 CCSCCNCC(=O)c1cccc(c1)F dbe0af43360999e9a6900eee350dd6f6 [0,1,0,0,0,0|3,0,0]=4 2297 B16R1.92 CCSCCNCC(=O)c1cccc(c1)I 4684f1d3159ccb4b37e8ff2b61f9bec9 [0,1,0,0,0,0|3,0,0]=4 2298 B16R1.92 CCSCCOCC(=O)c1cccc(c1)Br c8e74bd1d17fa115609d125e83238de2 [0,1,0,0,0,0|3,0,0]=4 2299 B16R1.92 CCSCCOCC(=O)c1cccc(c1)C ff58ef99dabeacc1fc1fe448e5d5d06e [0,1,0,0,0,0|3,0,0]=4 2300 B16R1.92 CCSCCOCC(=O)c1cccc(c1)Cl 7687fb6922fdeb727871c639d67efa11 [0,1,0,0,0,0|3,0,0]=4 2301 B16R1.92 CCSCCOCC(=O)c1cccc(c1)F 143f926df7ac916147293c2220b2273d [0,1,0,0,0,0|3,0,0]=4 2302 B16R1.92 CCSCCOCC(=O)c1cccc(c1)I 9858a7b95609d712772530a82dc6a521 [0,1,0,0,0,0|3,0,0]=4 2303 B16R1.92 COCCCCNC(=O)c1cc(=O)cco1 9fe9bf04675dcdc279ef1df24f0edb57 [0,1,0,0,0,0|3,0,0]=4 2304 B16R1.92 COCCCCNC(=O)c1cc(ccn1)Br 4b6069e8c4d1ecfde36fc97043381d78 [0,1,0,0,0,0|3,0,0]=4 2305 B16R1.92 COCCCCNC(=O)c1cc(ccn1)C 5da43226733b833b91daa70df9667aab [0,1,0,0,0,0|3,0,0]=4 2306 B16R1.92 COCCCCNC(=O)c1cc(ccn1)Cl fca77993286b9fdc1bca01fda61bf4bb [0,1,0,0,0,0|3,0,0]=4 2307 B16R1.92 COCCCCNC(=O)c1cc(ccn1)F 663793730f1b286e5274dde5188f3655 [0,1,0,0,0,0|3,0,0]=4 2308 B16R1.92 COCCCCNC(=O)c1cc(ccn1)I 389a6bc9fddb9a43f84dc9e2e8b02d2c [0,1,0,0,0,0|3,0,0]=4 2309 B16R1.92 COCCCCNC(=O)c1cc(ccn1)O 269ba0512c7e07b5fcd475de4bc0a55d [0,1,0,0,0,0|3,0,0]=4 2310 B16R1.92 COCCCCNC(=O)c1ccc[n+](c1)[O-] fd72adc5b0626c86949c47210a8b0a32 [0,1,0,0,0,0|3,0,0]=4 2311 B16R1.92 COCCCCNC(=O)c1cccc(c1)Br 36b25fdecbad7466d05143ad52ce8444 [0,1,0,0,0,0|2,0,0]=3 2312 B16R1.92 COCCCCNC(=O)c1cccc(c1)C c02ca0664f85f1ce8fe08f57e8438a86 [0,1,0,0,0,0|2,0,0]=3 2313 B16R1.92 COCCCCNC(=O)c1cccc(c1)Cl 6afe77a7b7228359021005eadf5d4540 [0,1,0,0,0,0|2,0,0]=3 2314 B16R1.92 COCCCCNC(=O)c1cccc(c1)F 1245c2f134fc7396409d1b18b02c8750 [0,1,0,0,0,0|2,0,0]=3 2315 B16R1.92 COCCCCNC(=O)c1cccc(c1)I 2a2e5a19e9205c16bb1e583423e823fc [0,1,0,0,0,0|2,0,0]=3 2316 B16R1.92 COCCCCNC(=O)c1cccc(c1)O cb14489819073041004408fda250e298 [0,1,0,0,0,0|2,0,0]=3 2317 B16R1.92 COCCCCNC(=O)c1cccc(c1)S 3538e8cb23bc637e0f5984c858b79283 [0,1,0,0,0,0|2,0,0]=3 2318 B16R1.92 COCCCCNC(=O)c1cccc(n1)Br 53fc1298ac769fb4b73dc2502f0f82ff [0,1,0,0,0,0|3,0,0]=4 2319 B16R1.92 COCCCCNC(=O)c1cccc(n1)C c45f4ad008f071a1691d8090463db5ba [0,1,0,0,0,0|3,0,0]=4 2320 B16R1.92 COCCCCNC(=O)c1cccc(n1)Cl 68c2d3c953a5dab8d466970cffa9ac01 [0,1,0,0,0,0|3,0,0]=4 2321 B16R1.92 COCCCCNC(=O)c1cccc(n1)F 4f897f293d326543e40811e45f88ae50 [0,1,0,0,0,0|3,0,0]=4 2322 B16R1.92 COCCCCNC(=O)c1cccc(n1)I b234aaab14d6a704b2b6d41c18637f06 [0,1,0,0,0,0|3,0,0]=4 2323 B16R1.92 COCCCCNC(=O)c1cccc(n1)O 0887a5bd3c6ef1cf174aa5a90ea2bce1 [0,1,0,0,0,0|3,0,0]=4 2324 B16R1.92 COCCCCNC(=O)c1ccnc(c1)Br b6f161e69ba3d51b7b663a349b3e4d58 [0,1,0,0,0,0|3,0,0]=4 2325 B16R1.92 COCCCCNC(=O)c1ccnc(c1)C 1ee3d47b6cb342aab04237863cb130c5 [0,1,0,0,0,0|3,0,0]=4 2326 B16R1.92 COCCCCNC(=O)c1ccnc(c1)Cl 63bf14a3449c15148be5154b245769c4 [0,1,0,0,0,0|3,0,0]=4 2327 B16R1.92 COCCCCNC(=O)c1ccnc(c1)F 0a6b1429d1a1b3e2d338c0ac13b59cf2 [0,1,0,0,0,0|3,0,0]=4 2328 B16R1.92 COCCCCNC(=O)c1ccnc(c1)I 7babd95fb209ae5991887f29e1fc8cbb [0,1,0,0,0,0|3,0,0]=4 2329 B16R1.92 COCCCCNC(=O)c1ccnc(c1)O 52ad62b3e52be23633b6e172cc8a9d6c [0,1,0,0,0,0|3,0,0]=4 2330 B16R1.92 COCCCCNC(=O)c1ccnc(c1)S c9f0e2086c5a849264d90a0908b21340 [0,1,0,0,0,0|3,0,0]=4 2331 B16R1.92 COCCCCNC(=O)c1cncc(c1)Br 4d2f42143bfb0d2068e542da5415ab5b [0,1,0,0,0,0|3,0,0]=4 2332 B16R1.92 COCCCCNC(=O)c1cncc(c1)C 2b2f52c0f06f218894e0fefeb1896a99 [0,1,0,0,0,0|3,0,0]=4 2333 B16R1.92 COCCCCNC(=O)c1cncc(c1)Cl 06feb3f3d87f91419d50e31298635c0f [0,1,0,0,0,0|3,0,0]=4 2334 B16R1.92 COCCCCNC(=O)c1cncc(c1)F 5c1aba0a20aaadef12485ea5e5ff73b3 [0,1,0,0,0,0|3,0,0]=4 2335 B16R1.92 COCCCCNC(=O)c1cncc(c1)I d89ad43061c643023d554b507b3d67cb [0,1,0,0,0,0|3,0,0]=4 2336 B16R1.92 COCCCCNC(=O)c1cncc(c1)O 99b4351e41c0b654377f660ad8db77fb [0,1,0,0,0,0|3,0,0]=4 2337 B16R1.92 COCCCCOC(C)c1cccc(c1)Br a30bf6812ae8ad2de725a2fed9e25a71 [0,1,0,0,0,0|2,0,1]=4 2338 B16R1.92 COCCCCOC(C)c1cccc(c1)C fca5b1ad3b5644c7e44954fcce838e39 [0,1,0,0,0,0|2,0,1]=4 2339 B16R1.92 COCCCCOC(C)c1cccc(c1)Cl 3400519dd828997c61bdd896df38a17d [0,1,0,0,0,0|2,0,1]=4 2340 B16R1.92 COCCCCOC(C)c1cccc(c1)F a66f5db600f81b7c66bc4186036b1617 [0,1,0,0,0,0|2,0,1]=4 2341 B16R1.92 COCCCCOC(C)c1cccc(c1)I 88ab7a5505e699c648f0e5bc139c7922 [0,1,0,0,0,0|2,0,1]=4 2342 B16R1.92 COCCCCO[C@@H](C)c1cccc(c1)Br baaffe661ec61a20776e3d7e57cc8f87 [0,1,0,0,0,0|2,0,1]=4 2343 B16R1.92 COCCCCO[C@@H](C)c1cccc(c1)C af1955fd943b7646305f0f1e666fb51d [0,1,0,0,0,0|2,0,1]=4 2344 B16R1.92 COCCCCO[C@@H](C)c1cccc(c1)Cl b9f201b21feac9a86feb74ac412f4553 [0,1,0,0,0,0|2,0,1]=4 2345 B16R1.92 COCCCCO[C@@H](C)c1cccc(c1)F 9b7b081e32d7587aa04bbadb4ba58893 [0,1,0,0,0,0|2,0,1]=4 2346 B16R1.92 COCCCCO[C@H](C)c1cccc(c1)Br 2b8e450f3ee89188eee963ddb85f3171 [0,1,0,0,0,0|2,0,1]=4 2347 B16R1.92 COCCCCO[C@H](C)c1cccc(c1)C f6cf04c8da95d8c019b67f30afa0a8c1 [0,1,0,0,0,0|2,0,1]=4 2348 B16R1.92 COCCCCO[C@H](C)c1cccc(c1)Cl 53d91a3f127726dce5a2b71bcdd0b6bb [0,1,0,0,0,0|2,0,1]=4 2349 B16R1.92 COCCCCO[C@H](C)c1cccc(c1)F 6a79b688fcdcaa41317faf7555283cdf [0,1,0,0,0,0|2,0,1]=4 2350 B16R1.92 COCCCNCC(=O)c1cccc(c1)Br 411cbd370d89121489a104b58a0ba3fe [0,1,0,0,0,0|3,0,0]=4 2351 B16R1.92 COCCCNCC(=O)c1cccc(c1)C b7f0fed162db8846bc697d701c6d8a10 [0,1,0,0,0,0|3,0,0]=4 2352 B16R1.92 COCCCNCC(=O)c1cccc(c1)Cl 95afafcb785adf1247f5729b40138aea [0,1,0,0,0,0|3,0,0]=4 2353 B16R1.92 COCCCNCC(=O)c1cccc(c1)F 6c519bd5d7bdcdceb12fb0bc9665d823 [0,1,0,0,0,0|3,0,0]=4 2354 B16R1.92 COCCCNCC(=O)c1cccc(c1)I 64a9db7abd1c3bca1557c31cf082dcfe [0,1,0,0,0,0|3,0,0]=4 2355 B16R1.92 COCCCOCC(=O)c1cccc(c1)Br 9870a1df65532dccd69fb6ba9b78c807 [0,1,0,0,0,0|3,0,0]=4 2356 B16R1.92 COCCCOCC(=O)c1cccc(c1)C 6d3934aa15d8224ab1600c9477eb0cb7 [0,1,0,0,0,0|3,0,0]=4 2357 B16R1.92 COCCCOCC(=O)c1cccc(c1)Cl f43715a4c084b846897a888eb9b65eea [0,1,0,0,0,0|3,0,0]=4 2358 B16R1.92 COCCCOCC(=O)c1cccc(c1)F f890e89b88201cf7c6335d235cfe5dd0 [0,1,0,0,0,0|3,0,0]=4 2359 B16R1.92 COCCCOCC(=O)c1cccc(c1)I fa6cd8072fd442826dba4ed138e4f9c1 [0,1,0,0,0,0|3,0,0]=4 2360 B16R1.92 COCCOCNC(=O)c1cccc(c1)C c00b46a92dcce627af3f35fdd224a50b [0,1,0,0,0,0|3,0,0]=4 2361 B16R1.92 COCOCCCC(=O)c1cccc(c1)F a1881725aa2467e56688a702078fc267 [0,1,0,0,0,0|3,0,0]=4 2362 B16R1.92 COCOCCNC(=O)c1cccc(c1)Br 7ff41aed94e3664186fb87dff750f5b8 [0,1,0,0,0,0|3,0,0]=4 2363 B16R1.92 COCOCCNC(=O)c1cccc(c1)C cf649d956780691853f6e205ac726fcf [0,1,0,0,0,0|3,0,0]=4 2364 B16R1.92 COCOCCNC(=O)c1cccc(c1)Cl 9e118908c400b1939d19dfc5dffd323d [0,1,0,0,0,0|3,0,0]=4 2365 B16R1.92 CSCCCCNC(=O)c1cc(=O)cco1 e5b863ff3c7434441563db3bb41e5ed5 [0,1,0,0,0,0|3,0,0]=4 2366 B16R1.92 CSCCCCNC(=O)c1cc(ccn1)Br 27e19abf80fd7f650283b5996c61bc6e [0,1,0,0,0,0|3,0,0]=4 2367 B16R1.92 CSCCCCNC(=O)c1cc(ccn1)C ff70bb1a79d4d7651b4d13d3e7e2af5e [0,1,0,0,0,0|3,0,0]=4 2368 B16R1.92 CSCCCCNC(=O)c1cc(ccn1)Cl 65476bc9663ef0a3aeb526f84ccb499d [0,1,0,0,0,0|3,0,0]=4 2369 B16R1.92 CSCCCCNC(=O)c1cc(ccn1)F 4e582def1e3e89269afb79b47d823f45 [0,1,0,0,0,0|3,0,0]=4 2370 B16R1.92 CSCCCCNC(=O)c1cc(ccn1)I e9311bc2295240727555f0e52090dfbd [0,1,0,0,0,0|3,0,0]=4 2371 B16R1.92 CSCCCCNC(=O)c1cc(ccn1)O 85b7821ed5236d860202bde21084ce6b [0,1,0,0,0,0|3,0,0]=4 2372 B16R1.92 CSCCCCNC(=O)c1ccc[n+](c1)[O-] 380919c5ff4bc6f3c1b2f7ed3f0e3dd4 [0,1,0,0,0,0|3,0,0]=4 2373 B16R1.92 CSCCCCNC(=O)c1cccc(c1)Br b949755a5d253549bfc26c2e4f4108ed [0,1,0,0,0,0|2,0,0]=3 2374 B16R1.92 CSCCCCNC(=O)c1cccc(c1)C 6309854551f7e3ce215a1bbcf8dd36fb [0,1,0,0,0,0|2,0,0]=3 2375 B16R1.92 CSCCCCNC(=O)c1cccc(c1)Cl a60c4bf785027bbd955ef7d20fa84f9c [0,1,0,0,0,0|2,0,0]=3 2376 B16R1.92 CSCCCCNC(=O)c1cccc(c1)F fdd52bed645310c70290dccae04ada50 [0,1,0,0,0,0|2,0,0]=3 2377 B16R1.92 CSCCCCNC(=O)c1cccc(c1)I f07a877ff3d36660838916a99fd2d04e [0,1,0,0,0,0|2,0,0]=3 2378 B16R1.92 CSCCCCNC(=O)c1cccc(c1)O d486845a0d379a7b53b9f79e6739c4b7 [0,1,0,0,0,0|2,0,0]=3 2379 B16R1.92 CSCCCCNC(=O)c1cccc(c1)S d090d7f60d2795cc5ced3d699f1c10f1 [0,1,0,0,0,0|2,0,0]=3 2380 B16R1.92 CSCCCCNC(=O)c1cccc(n1)Br 48aca2f8434d2b78c0583523f768a13d [0,1,0,0,0,0|3,0,0]=4 2381 B16R1.92 CSCCCCNC(=O)c1cccc(n1)C 452a3aad17b51863df809181e3bdcc84 [0,1,0,0,0,0|3,0,0]=4 2382 B16R1.92 CSCCCCNC(=O)c1cccc(n1)Cl cdab0e50287b1fa5ff474564e1c2c36d [0,1,0,0,0,0|3,0,0]=4 2383 B16R1.92 CSCCCCNC(=O)c1cccc(n1)F ced4121dc27edf37333fee1fefbcd340 [0,1,0,0,0,0|3,0,0]=4 2384 B16R1.92 CSCCCCNC(=O)c1cccc(n1)I b9bac4a9a41f188e373f0054b812a243 [0,1,0,0,0,0|3,0,0]=4 2385 B16R1.92 CSCCCCNC(=O)c1cccc(n1)O b1e551c18866d6eea039530a2a479068 [0,1,0,0,0,0|3,0,0]=4 2386 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)Br 5b39abad937fa9c6a2d7760d884c043e [0,1,0,0,0,0|3,0,0]=4 2387 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)C 1b45bc6c833baf55fd5e116d94e13ce7 [0,1,0,0,0,0|3,0,0]=4 2388 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)Cl f4638fbf7499d2a688e1cefa726b5b62 [0,1,0,0,0,0|3,0,0]=4 2389 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)F 7654711ca81372346753ab9e5a9a3e3d [0,1,0,0,0,0|3,0,0]=4 2390 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)I ef93a2753fe12e5bf271f184bf8e2517 [0,1,0,0,0,0|3,0,0]=4 2391 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)O bea996cef9d8bf231112362f3de86ead [0,1,0,0,0,0|3,0,0]=4 2392 B16R1.92 CSCCCCNC(=O)c1ccnc(c1)S 7b08906c222c6b38888ad1833bf89feb [0,1,0,0,0,0|3,0,0]=4 2393 B16R1.92 CSCCCCNC(=O)c1cncc(c1)Br 494e167a3c56bd80b32dacfe8fb4c60c [0,1,0,0,0,0|3,0,0]=4 2394 B16R1.92 CSCCCCNC(=O)c1cncc(c1)C f7333275c341d90c39a26a77563ce232 [0,1,0,0,0,0|3,0,0]=4 2395 B16R1.92 CSCCCCNC(=O)c1cncc(c1)Cl c504b162fa73e5223735084f8283cea9 [0,1,0,0,0,0|3,0,0]=4 2396 B16R1.92 CSCCCCNC(=O)c1cncc(c1)F ee16f205dd8b2f5f0bf26c5425b9ab3a [0,1,0,0,0,0|3,0,0]=4 2397 B16R1.92 CSCCCCNC(=O)c1cncc(c1)I 96596c46ccda718becbed00a062d9be2 [0,1,0,0,0,0|3,0,0]=4 2398 B16R1.92 CSCCCCNC(=O)c1cncc(c1)O 45539821aa901be2b4673ab77f5432d4 [0,1,0,0,0,0|3,0,0]=4 2399 B16R1.92 CSCCCCOC(C)c1cccc(c1)Cl 710a47185ec2a545f6403bae7fe94643 [0,1,0,0,0,0|2,0,1]=4 2400 B16R1.92 CSCCCCOC(C)c1cccc(c1)F ea20a67f7065ad12bfff16fc71b1f8ea [0,1,0,0,0,0|2,0,1]=4 2401 B16R1.92 CSCCCNCC(=O)c1cccc(c1)Br 6bd4621c32b3164fb54453f336efc189 [0,1,0,0,0,0|3,0,0]=4 2402 B16R1.92 CSCCCNCC(=O)c1cccc(c1)C 32a708cb8ff0bc7af3ff38e4ae7f7eef [0,1,0,0,0,0|3,0,0]=4 2403 B16R1.92 CSCCCNCC(=O)c1cccc(c1)Cl 57d1efe81929fee38ab6899388996620 [0,1,0,0,0,0|3,0,0]=4 2404 B16R1.92 CSCCCNCC(=O)c1cccc(c1)F c3ecea2eaa682e98540275d8a55c083f [0,1,0,0,0,0|3,0,0]=4 2405 B16R1.92 CSCCCNCC(=O)c1cccc(c1)I ee968374e6464433b05cf59ffb8b4545 [0,1,0,0,0,0|3,0,0]=4 2406 B16R1.92 CSCCCOCC(=O)c1cccc(c1)Br 447c83b9f9bb0891fcac2637cb690ffd [0,1,0,0,0,0|3,0,0]=4 2407 B16R1.92 CSCCCOCC(=O)c1cccc(c1)C 95920b751366dff6f7f765fcd0957dd1 [0,1,0,0,0,0|3,0,0]=4 2408 B16R1.92 CSCCCOCC(=O)c1cccc(c1)Cl 4349ea6e1865034f8476e7bfa411024d [0,1,0,0,0,0|3,0,0]=4 2409 B16R1.92 CSCCCOCC(=O)c1cccc(c1)F 680cd4c27cfffa0c88475b8d7d7eba75 [0,1,0,0,0,0|3,0,0]=4 2410 B16R1.92 CSCCCOCC(=O)c1cccc(c1)I f552f865132876e03269bed8c5777e22 [0,1,0,0,0,0|3,0,0]=4 2411 B16R1.92 CSCCOCNC(=O)c1cccc(c1)C 5c939fbf67626b43a71f63892de8493f [0,1,0,0,0,0|3,0,0]=4 2412 B16R1.92 CSCOCCNC(=O)c1cccc(c1)Br d868aceba7601b73d779db1d23a1c03c [0,1,0,0,0,0|3,0,0]=4 2413 B16R1.92 CSCOCCNC(=O)c1cccc(c1)C 974495627c31e1922266079e6ac9e29e [0,1,0,0,0,0|3,0,0]=4 2414 B16R1.92 CSCOCCNC(=O)c1cccc(c1)Cl 4059d6c102ccf71021a4500a8eff8d28 [0,1,0,0,0,0|3,0,0]=4 2415 B16R1.92 C[C@@H](OCCCCCF)c1cccc(c1)Br 403da51a8b526d1b06cb6a3199d281ea [0,1,0,0,0,0|2,0,1]=4 2416 B16R1.92 C[C@@H](OCCCCCF)c1cccc(c1)Cl a5375834b7ad58e569653c8158060d3e [0,1,0,0,0,0|2,0,1]=4 2417 B16R1.92 C[C@@H](OCCCCCF)c1cccc(c1)F 9638b4bbd78db4d692574972e8d36b1b [0,1,0,0,0,0|2,0,1]=4 2418 B16R1.92 C[C@H](OCCCCCF)c1cccc(c1)Br bd2905d899c0951370c610a30eaf292f [0,1,0,0,0,0|2,0,1]=4 2419 B16R1.92 C[C@H](OCCCCCF)c1cccc(c1)Cl 5ba23e4cdaf03d36bf99bf011b34e364 [0,1,0,0,0,0|2,0,1]=4 2420 B16R1.92 C[C@H](OCCCCCF)c1cccc(c1)F af03f04bc936db6bf4dd871c8f5bd5b9 [0,1,0,0,0,0|2,0,1]=4 2421 B16R1.92 Cc1cc(ccn1)C(=O)NCCCCCCl cbfc2bf5591ee2b63b61c4984c4e8b97 [0,1,0,0,0,0|3,0,0]=4 2422 B16R1.92 Cc1cc(ccn1)C(=O)NCCCCCO 2f1d335a574d73e4aaad8d2bba4b5a56 [0,1,0,0,0,0|3,0,0]=4 2423 B16R1.92 Cc1cccc(c1)C(=O)CCCNCCF 286d70145f20412908a7b868de7a4318 [0,1,0,0,0,0|3,0,0]=4 2424 B16R1.92 Cc1cccc(c1)C(=O)CCCNCCI d112ab2467a4a463da5e390c4590ba60 [0,1,0,0,0,0|3,0,0]=4 2425 B16R1.92 Cc1cccc(c1)C(=O)CCCNCCO 4b8486212ca8e2d52d81fd053596d430 [0,1,0,0,0,0|3,0,0]=4 2426 B16R1.92 Cc1cccc(c1)C(=O)CCCNCCS 72c4eb7a017b6c3dcb620da707945f05 [0,1,0,0,0,0|3,0,0]=4 2427 B16R1.92 Cc1cccc(c1)C(=O)CNCCCCCl ed515adc56461a0a604cc8909080cbba [0,1,0,0,0,0|3,0,0]=4 2428 B16R1.92 Cc1cccc(c1)C(=O)CNCCCCO b7c6645d0b49656bb683da454473a02e [0,1,0,0,0,0|3,0,0]=4 2429 B16R1.92 Cc1cccc(c1)C(=O)CNCCCCS ffd49762c1faf201d9b4627aac4048c4 [0,1,0,0,0,0|3,0,0]=4 2430 B16R1.92 Cc1cccc(c1)C(=O)COCCCCF a632237f71fcc9932814ee95bb8d2400 [0,1,0,0,0,0|3,0,0]=4 2431 B16R1.92 Cc1cccc(c1)C(=O)COCCCCS a5d69fa4921dafc4483f09e21165a86a [0,1,0,0,0,0|3,0,0]=4 2432 B16R1.92 Cc1cccc(c1)C(=O)NCCCCC#N 44ea61a8420642a132a95e41dbfe668f [0,1,0,0,0,0|2,0,1]=4 2433 B16R1.92 Cc1cccc(c1)C(=O)NCCCCCCl 512b3638c06b3ca0d80e0144f774347c [0,1,0,0,0,0|2,0,0]=3 2434 B16R1.92 Cc1cccc(c1)C(=O)NCCCCCO 75a266aabf6411f10303dd871b8f8069 [0,1,0,0,0,0|2,0,0]=3 2435 B16R1.92 Cc1cccc(c1)C(=O)NCCOCCF b404c74d23fdfb0ce9b7842e89737ef2 [0,1,0,0,0,0|3,0,0]=4 2436 B16R1.92 Cc1cccc(c1)C(=O)NCCOCCO 0b4c27f7b43a96a6b363cc1e17c00cbe [0,1,0,0,0,0|3,0,0]=4 2437 B16R1.92 Cc1cccc(c1)C(=O)NCCOCCS 1963177997197d7e39cded332cb45566 [0,1,0,0,0,0|3,0,0]=4 2438 B16R1.92 Cc1cccc(c1)C(=O)NCCSCCO d7951f9b7c972853ec53c48b6f5b5cc4 [0,1,0,0,0,0|3,0,0]=4 2439 B16R1.92 Cc1cccc(c1)C(=O)NCOCCCF bdbe9b29f8f54caf8f10c996d3e0cd24 [0,1,0,0,0,0|3,0,0]=4 2440 B16R1.92 Cc1cccc(c1)C(=O)NCOCCCS fad7055d24f0bdf4be41b3073699df3c [0,1,0,0,0,0|3,0,0]=4 2441 B16R1.92 Cc1cccc(c1)C(C)OCCCCCF 9fbc02eec2196bc80b5974e1e8c709ea [0,1,0,0,0,0|2,0,1]=4 2442 B16R1.92 Cc1cccc(c1)[C@@H](C)OCCCCCF 9d3384f0252ad0ff254d824177c63ac9 [0,1,0,0,0,0|2,0,1]=4 2443 B16R1.92 Cc1cccc(c1)[C@H](C)OCCCCCF e7baebeaee2539b188fe2afc98751a62 [0,1,0,0,0,0|2,0,1]=4 2444 B16R1.92 Cc1cccc(n1)C(=O)NCCCCCCl 1256bdf4a0620ed5eb5851c8be7bc9f3 [0,1,0,0,0,0|3,0,0]=4 2445 B16R1.92 Cc1cccc(n1)C(=O)NCCCCCO 3d637a26e2526941bf1d734c6a506bb7 [0,1,0,0,0,0|3,0,0]=4 2446 B16R1.92 Cc1ccnc(c1)C(=O)NCCCCCCl 4233501c9468ea0a9344cb61dbfd4967 [0,1,0,0,0,0|3,0,0]=4 2447 B16R1.92 Cc1ccnc(c1)C(=O)NCCCCCO 910c746bb6f659eb146969f4ca8df8eb [0,1,0,0,0,0|3,0,0]=4 2448 B16R1.92 Cc1cncc(c1)C(=O)NCCCCCCl 1520d2ba56981f44a5938b40c5e5578b [0,1,0,0,0,0|3,0,0]=4 2449 B16R1.92 Cc1cncc(c1)C(=O)NCCCCCO ba47960dc912f54bacfb6b0bbd7a06c3 [0,1,0,0,0,0|3,0,0]=4 2450 B16R1.92 N#CCCCCNC(=O)c1cccc(c1)Br 0f785a85975797d8563218b65c5ef24f [0,1,0,0,0,0|2,0,1]=4 2451 B16R1.92 N#CCCCCNC(=O)c1cccc(c1)Cl e69ab9d45d819e3dbbbc4d4503751f06 [0,1,0,0,0,0|2,0,1]=4 2452 B16R1.92 N#CCCCCNC(=O)c1cccc(c1)F 3ae4a184d42295f6c6e5512b9d64490a [0,1,0,0,0,0|2,0,1]=4 2453 B16R1.92 N#CCCCCNC(=O)c1cccc(c1)I b300ac256690c265db79b7e2c1456b85 [0,1,0,0,0,0|2,0,1]=4 2454 B16R1.92 N#CCCCCNC(=O)c1cccc(c1)O c029d3786240d621309d9a807ca0d16c [0,1,0,0,0,0|2,0,1]=4 2455 B16R1.92 N#CCCCCNC(=O)c1cccc(c1)S a810c5bcbc27a44dcbc7408fd0056746 [0,1,0,0,0,0|2,0,1]=4 2456 B16R1.92 O=C(CCCNCCBr)c1cccc(c1)F 67c0156355bea267547c6256b68bcc9d [0,1,0,0,0,0|3,0,0]=4 2457 B16R1.92 O=C(CCCNCCF)c1cccc(c1)F de88019df6a2b3f47bafae507c28ba7d [0,1,0,0,0,0|3,0,0]=4 2458 B16R1.92 O=C(CCCNCCI)c1cccc(c1)F e228c37973e5615495a492b63d48945d [0,1,0,0,0,0|3,0,0]=4 2459 B16R1.92 O=C(CCCNCCO)c1cccc(c1)F b261352c74a9bf3f8e322b98409ef7bc [0,1,0,0,0,0|3,0,0]=4 2460 B16R1.92 O=C(CCCNCCS)c1cccc(c1)F e5874ce12ffe3fdf3dc268c58e8d669f [0,1,0,0,0,0|3,0,0]=4 2461 B16R1.92 O=C(CCCOCCF)c1cccc(c1)F 5153ea1716beea1c8b07d9f576307027 [0,1,0,0,0,0|3,0,0]=4 2462 B16R1.92 O=C(CCCOCCS)c1cccc(c1)F d0e645c99bfb9eabd00bf0bbe59a9fb1 [0,1,0,0,0,0|3,0,0]=4 2463 B16R1.92 O=C(CNCCCCCl)c1cccc(c1)Br 4caa0fb1a9f6748e9cc24305bfd92d0a [0,1,0,0,0,0|3,0,0]=4 2464 B16R1.92 O=C(CNCCCCCl)c1cccc(c1)Cl a4ed289c22ce3aeead2e9a4675519016 [0,1,0,0,0,0|3,0,0]=4 2465 B16R1.92 O=C(CNCCCCCl)c1cccc(c1)F e326bbe7738a18382d6719fd91e2dc7c [0,1,0,0,0,0|3,0,0]=4 2466 B16R1.92 O=C(CNCCCCCl)c1cccc(c1)I 5329ecacbfd2c9a604d0280735074108 [0,1,0,0,0,0|3,0,0]=4 2467 B16R1.92 O=C(CNCCCCO)c1cccc(c1)Br 6ccdba78efa36cf1e2691b48c5a896ef [0,1,0,0,0,0|3,0,0]=4 2468 B16R1.92 O=C(CNCCCCO)c1cccc(c1)Cl f5b1709dc972e329e66c127aa0e74fa7 [0,1,0,0,0,0|3,0,0]=4 2469 B16R1.92 O=C(CNCCCCO)c1cccc(c1)F c5450cf66fb228eaefb48ac9555077ec [0,1,0,0,0,0|3,0,0]=4 2470 B16R1.92 O=C(CNCCCCO)c1cccc(c1)I 5e6b2d05de438d17ef55c48c9e703125 [0,1,0,0,0,0|3,0,0]=4 2471 B16R1.92 O=C(CNCCCCS)c1cccc(c1)Br 912a06dc7f63f0f13d192e58f82b2b48 [0,1,0,0,0,0|3,0,0]=4 2472 B16R1.92 O=C(CNCCCCS)c1cccc(c1)Cl dc1b82b2a685fd8aa4b28bc9fa90b61d [0,1,0,0,0,0|3,0,0]=4 2473 B16R1.92 O=C(CNCCCCS)c1cccc(c1)F 112535c58725193ac685c06482af3ae7 [0,1,0,0,0,0|3,0,0]=4 2474 B16R1.92 O=C(CNCCCCS)c1cccc(c1)I 9d52c132619624f2f3273ee12c25252a [0,1,0,0,0,0|3,0,0]=4 2475 B16R1.92 O=C(COCCCCF)c1cccc(c1)Br a4655995d102c57d5bc3af390ac4982e [0,1,0,0,0,0|3,0,0]=4 2476 B16R1.92 O=C(COCCCCF)c1cccc(c1)Cl c78680470a7eacf06025fc32476e620d [0,1,0,0,0,0|3,0,0]=4 2477 B16R1.92 O=C(COCCCCF)c1cccc(c1)F dbc73b8f2e98046438053b43c511ca1a [0,1,0,0,0,0|3,0,0]=4 2478 B16R1.92 O=C(COCCCCF)c1cccc(c1)I 130f68a90b6345decd50b906a59438cd [0,1,0,0,0,0|3,0,0]=4 2479 B16R1.92 O=C(COCCCCS)c1cccc(c1)Br f85d71c21e0b9e4659b5fee9fc7fb6b4 [0,1,0,0,0,0|3,0,0]=4 2480 B16R1.92 O=C(COCCCCS)c1cccc(c1)Cl f52cd247df09a2740bd608d5a037a4ab [0,1,0,0,0,0|3,0,0]=4 2481 B16R1.92 O=C(COCCCCS)c1cccc(c1)F 094daf6c41846db87c5a0b0de1e7d1b5 [0,1,0,0,0,0|3,0,0]=4 2482 B16R1.92 O=C(COCCCCS)c1cccc(c1)I 77e0c3ba58cdb34fc53a2a70a9cdb5d7 [0,1,0,0,0,0|3,0,0]=4 2483 B16R1.92 O=C(NCCCCCCl)c1cc(=O)cco1 8fa84f3dad38e66a400adf4ecccc0baf [0,1,0,0,0,0|3,0,0]=4 2484 B16R1.92 O=C(NCCCCCCl)c1cc(ccn1)Br 903c54e978ae3d78c997a7586734ffd5 [0,1,0,0,0,0|3,0,0]=4 2485 B16R1.92 O=C(NCCCCCCl)c1cc(ccn1)Cl cc58168046b2e39bde430fe8f9fcdab1 [0,1,0,0,0,0|3,0,0]=4 2486 B16R1.92 O=C(NCCCCCCl)c1cc(ccn1)F 31faf4acc34618187038f6b31875c9e5 [0,1,0,0,0,0|3,0,0]=4 2487 B16R1.92 O=C(NCCCCCCl)c1cc(ccn1)I cd1cbf2b44005273a26b2eccad2ad345 [0,1,0,0,0,0|3,0,0]=4 2488 B16R1.92 O=C(NCCCCCCl)c1cc(ccn1)O 70f0b0453734bd5689a38f4866fd452a [0,1,0,0,0,0|3,0,0]=4 2489 B16R1.92 O=C(NCCCCCCl)c1ccc[n+](c1)[O-] ce7cb035c744d727644101b4ee57f0b6 [0,1,0,0,0,0|3,0,0]=4 2490 B16R1.92 O=C(NCCCCCCl)c1cccc(c1)Br 26c6ca2b5916e61e61e2503cd73c48ea [0,1,0,0,0,0|2,0,0]=3 2491 B16R1.92 O=C(NCCCCCCl)c1cccc(c1)Cl 6ae6185f80923863b8c31f7c60bc117b [0,1,0,0,0,0|2,0,0]=3 2492 B16R1.92 O=C(NCCCCCCl)c1cccc(c1)F c8d58595cd27ae4aca8ed23d0f6091c7 [0,1,0,0,0,0|2,0,0]=3 2493 B16R1.92 O=C(NCCCCCCl)c1cccc(c1)I aa8baabfbf2f5804d9318bdf08b2c2c3 [0,1,0,0,0,0|2,0,0]=3 2494 B16R1.92 O=C(NCCCCCCl)c1cccc(c1)O 330d23c5d8de252aee1536f43ee81c61 [0,1,0,0,0,0|2,0,0]=3 2495 B16R1.92 O=C(NCCCCCCl)c1cccc(c1)S 328a5b19a064d6d8b03c74659161f078 [0,1,0,0,0,0|2,0,0]=3 2496 B16R1.92 O=C(NCCCCCCl)c1cccc(n1)Br a154f66e43facd5127940954cc485802 [0,1,0,0,0,0|3,0,0]=4 2497 B16R1.92 O=C(NCCCCCCl)c1cccc(n1)Cl 28d8fa781b75351013f8d2db3f7c44e6 [0,1,0,0,0,0|3,0,0]=4 2498 B16R1.92 O=C(NCCCCCCl)c1cccc(n1)F 9c675eb95b79676d7f394bc647769264 [0,1,0,0,0,0|3,0,0]=4 2499 B16R1.92 O=C(NCCCCCCl)c1cccc(n1)I 0b020d7248f6d92b79bdce945c5e7196 [0,1,0,0,0,0|3,0,0]=4 2500 B16R1.92 O=C(NCCCCCCl)c1cccc(n1)O 7e76aab0f9041093d6302cb18dbf624d [0,1,0,0,0,0|3,0,0]=4 2501 B16R1.92 O=C(NCCCCCCl)c1ccnc(c1)Br 85167e50fb04551311afb08a0776ec4e [0,1,0,0,0,0|3,0,0]=4 2502 B16R1.92 O=C(NCCCCCCl)c1ccnc(c1)Cl 7fd30a7b5aee6f8f0208ec309e951d1a [0,1,0,0,0,0|3,0,0]=4 2503 B16R1.92 O=C(NCCCCCCl)c1ccnc(c1)F e55709aaa307119f1d4d1db51d686345 [0,1,0,0,0,0|3,0,0]=4 2504 B16R1.92 O=C(NCCCCCCl)c1ccnc(c1)I 565538d0372674a01f88a8a2f0804bd8 [0,1,0,0,0,0|3,0,0]=4 2505 B16R1.92 O=C(NCCCCCCl)c1ccnc(c1)O a260d52e7c9c37429340aad5c4f30fe2 [0,1,0,0,0,0|3,0,0]=4 2506 B16R1.92 O=C(NCCCCCCl)c1ccnc(c1)S 610192fe2d39be202e2b8f94af76be16 [0,1,0,0,0,0|3,0,0]=4 2507 B16R1.92 O=C(NCCCCCCl)c1cncc(c1)Br b062f685f67d6e147376f0e365649c49 [0,1,0,0,0,0|3,0,0]=4 2508 B16R1.92 O=C(NCCCCCCl)c1cncc(c1)Cl 0b588681a221f2ebaad8a2983f2a06bc [0,1,0,0,0,0|3,0,0]=4 2509 B16R1.92 O=C(NCCCCCCl)c1cncc(c1)F ee948c41d9dda02f23f7821b0c982e78 [0,1,0,0,0,0|3,0,0]=4 2510 B16R1.92 O=C(NCCCCCCl)c1cncc(c1)I bc1af9ddd0ab7a664df9295ba714b3dc [0,1,0,0,0,0|3,0,0]=4 2511 B16R1.92 O=C(NCCCCCCl)c1cncc(c1)O 40ea5785fdc3bb993195e26fba2699bc [0,1,0,0,0,0|3,0,0]=4 2512 B16R1.92 O=C(NCCCCCO)c1cc(=O)cco1 e46aca97c4d357a1522464377ab43411 [0,1,0,0,0,0|3,0,0]=4 2513 B16R1.92 O=C(NCCCCCO)c1cc(ccn1)Br 78905d692ac207bb70be7d3775d1376e [0,1,0,0,0,0|3,0,0]=4 2514 B16R1.92 O=C(NCCCCCO)c1cc(ccn1)Cl 32a77d68360f0749b154f7e03defe9c3 [0,1,0,0,0,0|3,0,0]=4 2515 B16R1.92 O=C(NCCCCCO)c1cc(ccn1)F 8d5632f92faa5d5c7841d66dc2067711 [0,1,0,0,0,0|3,0,0]=4 2516 B16R1.92 O=C(NCCCCCO)c1cc(ccn1)I 7b1f375de57e6e76e0d2ae92d39d2e00 [0,1,0,0,0,0|3,0,0]=4 2517 B16R1.92 O=C(NCCCCCO)c1cc(ccn1)O dab409e908f8c73c8b132e79a5babce1 [0,1,0,0,0,0|3,0,0]=4 2518 B16R1.92 O=C(NCCCCCO)c1ccc[n+](c1)[O-] a6690c944c4b38ac6ffe46cc715dc040 [0,1,0,0,0,0|3,0,0]=4 2519 B16R1.92 O=C(NCCCCCO)c1cccc(c1)Br 5c978d74d2da2aff45f5b67b25d83563 [0,1,0,0,0,0|2,0,0]=3 2520 B16R1.92 O=C(NCCCCCO)c1cccc(c1)Cl d048f6c81022b880e8f98ea2ab9f820e [0,1,0,0,0,0|2,0,0]=3 2521 B16R1.92 O=C(NCCCCCO)c1cccc(c1)F 73c1cbd0b65676200cf20e37cb156bc4 [0,1,0,0,0,0|2,0,0]=3 2522 B16R1.92 O=C(NCCCCCO)c1cccc(c1)I c901eeae881d3941825f44287d655c4b [0,1,0,0,0,0|2,0,0]=3 2523 B16R1.92 O=C(NCCCCCO)c1cccc(c1)O 86cc6b29960a826fee882b3928796c06 [0,1,0,0,0,0|2,0,0]=3 2524 B16R1.92 O=C(NCCCCCO)c1cccc(c1)S 84dd4591ba707d560826bdf601694ba0 [0,1,0,0,0,0|2,0,0]=3 2525 B16R1.92 O=C(NCCCCCO)c1cccc(n1)Br 4917770f53a19b0be18ac64c9ca08537 [0,1,0,0,0,0|3,0,0]=4 2526 B16R1.92 O=C(NCCCCCO)c1cccc(n1)Cl a16c39de463d12680ab107a12618065f [0,1,0,0,0,0|3,0,0]=4 2527 B16R1.92 O=C(NCCCCCO)c1cccc(n1)F 32a9518898c532ea1e88fdb5208a371b [0,1,0,0,0,0|3,0,0]=4 2528 B16R1.92 O=C(NCCCCCO)c1cccc(n1)I dc8f10dadfd65b6f505c64e8e278073e [0,1,0,0,0,0|3,0,0]=4 2529 B16R1.92 O=C(NCCCCCO)c1cccc(n1)O 25a046583e4c025a7e300ba36edd89ec [0,1,0,0,0,0|3,0,0]=4 2530 B16R1.92 O=C(NCCCCCO)c1ccnc(c1)Br 18e437f56252d06207cc00fb3d601a61 [0,1,0,0,0,0|3,0,0]=4 2531 B16R1.92 O=C(NCCCCCO)c1ccnc(c1)Cl 7e5d89b5da6de60556ae743af032d40e [0,1,0,0,0,0|3,0,0]=4 2532 B16R1.92 O=C(NCCCCCO)c1ccnc(c1)F a04aea4d7fe494c857b15f854e16a909 [0,1,0,0,0,0|3,0,0]=4 2533 B16R1.92 O=C(NCCCCCO)c1ccnc(c1)I a19de5806b9f29e4f3f296a0413b4cbd [0,1,0,0,0,0|3,0,0]=4 2534 B16R1.92 O=C(NCCCCCO)c1ccnc(c1)O ed0fe9c5512d9dbcaa578b824f8f2fde [0,1,0,0,0,0|3,0,0]=4 2535 B16R1.92 O=C(NCCCCCO)c1ccnc(c1)S e257ad4f960e86f86beac8189c25b171 [0,1,0,0,0,0|3,0,0]=4 2536 B16R1.92 O=C(NCCCCCO)c1cncc(c1)Br b685420dcd05a3ddd80910a7d68c21b2 [0,1,0,0,0,0|3,0,0]=4 2537 B16R1.92 O=C(NCCCCCO)c1cncc(c1)Cl 23f9c325e3cbb50f5e7a4210494c61ee [0,1,0,0,0,0|3,0,0]=4 2538 B16R1.92 O=C(NCCCCCO)c1cncc(c1)F c21df697ba63d3bc86c03cb344a5e3d5 [0,1,0,0,0,0|3,0,0]=4 2539 B16R1.92 O=C(NCCCCCO)c1cncc(c1)I c28ed0098525d04fad3aef8c72f4a43a [0,1,0,0,0,0|3,0,0]=4 2540 B16R1.92 O=C(NCCCCCO)c1cncc(c1)O 33daea159c615575433d384a4641e0ad [0,1,0,0,0,0|3,0,0]=4 2541 B16R1.92 O=C(NCCCNCF)c1cccc(c1)Br 8b08dee880cfd4605b3db761cac21abc [0,1,0,0,0,0|3,0,0]=4 2542 B16R1.92 O=C(NCCCNCO)c1cccc(c1)Br cec6847730bcd857c4c23b4bfca73147 [0,1,0,0,0,0|3,0,0]=4 2543 B16R1.92 O=C(NCCOCCF)c1cccc(c1)Br 89f6ef8cb9bfde72c344030ee0d008ee [0,1,0,0,0,0|3,0,0]=4 2544 B16R1.92 O=C(NCCOCCF)c1cccc(c1)Cl c06b6cbe85b4a9c29cfaeb098e0248ba [0,1,0,0,0,0|3,0,0]=4 2545 B16R1.92 O=C(NCCOCCO)c1cccc(c1)Br 671d084c717252f56bbd9ea5fad94b16 [0,1,0,0,0,0|3,0,0]=4 2546 B16R1.92 O=C(NCCOCCO)c1cccc(c1)Cl c45bb9a21f3167c8a54ec178d11ff85b [0,1,0,0,0,0|3,0,0]=4 2547 B16R1.92 O=C(NCCOCCO)c1cccc(c1)F 93b5f2f2649f7440d79773a1dbcd994e [0,1,0,0,0,0|3,0,0]=4 2548 B16R1.92 O=C(NCCOCCO)c1cccc(c1)I 35a152e30a237aa24612682e5e9328f2 [0,1,0,0,0,0|3,0,0]=4 2549 B16R1.92 O=C(NCCOCCO)c1cccc(c1)O 0ad0ff8820c8f6a6dce41fc9e4909c54 [0,1,0,0,0,0|3,0,0]=4 2550 B16R1.92 O=C(NCCOCCO)c1cccc(c1)S 45084897553af064ad2cb07ad1debef7 [0,1,0,0,0,0|3,0,0]=4 2551 B16R1.92 O=C(NCCOCCS)c1cccc(c1)Br 19ed7cde6593eea9802b84909e912d2f [0,1,0,0,0,0|3,0,0]=4 2552 B16R1.92 O=C(NCCOCCS)c1cccc(c1)Cl e43e5779f9eafb5f6a3c409a4c63dc99 [0,1,0,0,0,0|3,0,0]=4 2553 B16R1.92 O=C(NCCOCCS)c1cccc(c1)F e0381947a5cc70aaba5abdc4e58cd03f [0,1,0,0,0,0|3,0,0]=4 2554 B16R1.92 O=C(NCCOCCS)c1cccc(c1)I 6ab77ea66cb1752d56ed13af83d8b187 [0,1,0,0,0,0|3,0,0]=4 2555 B16R1.92 O=C(NCCOCCS)c1cccc(c1)O 5cc7467e5d88ceb4152e21aa896cd74e [0,1,0,0,0,0|3,0,0]=4 2556 B16R1.92 O=C(NCCOCCS)c1cccc(c1)S 9549eac3fdda8257e4a38fff5e1433ba [0,1,0,0,0,0|3,0,0]=4 2557 B16R1.92 O=C(NCCSCCO)c1cccc(c1)Br d10dd4f71e86fe52b09b08b02725c5c8 [0,1,0,0,0,0|3,0,0]=4 2558 B16R1.92 O=C(NCCSCCO)c1cccc(c1)Cl e6572cdf12d58beccbea20ccc9bb0736 [0,1,0,0,0,0|3,0,0]=4 2559 B16R1.92 O=C(NCCSCCO)c1cccc(c1)F efa5016310af9afadcb4a00300b3707f [0,1,0,0,0,0|3,0,0]=4 2560 B16R1.92 O=C(NCCSCCO)c1cccc(c1)I b8b5e770e2382d455ac8b21e76af9694 [0,1,0,0,0,0|3,0,0]=4 2561 B16R1.92 O=C(NCCSCCO)c1cccc(c1)O 1cedaac2d40af4ea5615e62e37b23142 [0,1,0,0,0,0|3,0,0]=4 2562 B16R1.92 O=C(NCCSCCO)c1cccc(c1)S 66baef376ec72e830cc12286e23016a4 [0,1,0,0,0,0|3,0,0]=4 2563 B16R1.609 C/C(=C/COCOC(=O)c1ccccc1)/Cl ae3d1f54c024a42fe929f58d83a03a31 [0,1,0,0,0,0|1,0,2]=4 2564 B16R1.609 C/C(=C/COCOC(=O)c1ccccc1)/I 0f21373809e58e0148d9ffa536eb864a [0,1,0,0,0,0|1,0,2]=4 2565 B16R1.609 C=C(Br)CCOCOC(=O)c1ccccc1 77bc149ae35030b1ff24a68a4427373a [0,1,0,0,0,0|1,0,2]=4 2566 B16R1.609 C=C(Br)CNCCOC(=O)c1ccccc1 afa30419a5effe4998a8215ef88b2177 [0,1,0,0,0,0|1,0,2]=4 2567 B16R1.609 C=C(Br)COCCOC(=O)c1ccccc1 74485d71577de988cdc10f82f8637f02 [0,1,0,0,0,0|1,0,2]=4 2568 B16R1.609 C=C(C)CCCNCC(=O)c1ccccc1 787529a30d87ec494c4d9fe686c04c1e [0,1,0,0,0,0|2,0,1]=4 2569 B16R1.609 C=C(C)CCCOCC(=O)c1ccccc1 4cf8690d1f41a317065b9fe5355c939c [0,1,0,0,0,0|2,0,1]=4 2570 B16R1.609 C=C(C)CCOCCC(=O)c1ccccc1 93f7b5e134d3df477d9a1acdfcf5f5a9 [0,1,0,0,0,0|2,0,1]=4 2571 B16R1.609 C=C(C)CCOCNC(=O)c1ccccc1 72d4200ec6cfdf732174d946c1df597d [0,1,0,0,0,0|2,0,1]=4 2572 B16R1.609 C=C(C)CNCCOC(=O)c1ccccc1 861b0451ca2b69544d8b31a4247a2784 [0,1,0,0,0,0|1,0,1]=3 2573 B16R1.609 C=C(C)COCCCC(=O)c1ccccc1 72b149b3ad5b4bf56ffe58c1569b66e0 [0,1,0,0,0,0|2,0,1]=4 2574 B16R1.609 C=C(C)COCCNC(=O)c1ccccc1 955a034b9bc3a87f5a1d7dc30f47c803 [0,1,0,0,0,0|2,0,1]=4 2575 B16R1.609 C=C(C)COCCOC(=O)c1ccccc1 f50b8b5baa0d70488b8c29be960516c7 [0,1,0,0,0,0|1,0,1]=3 2576 B16R1.609 C=C(C)COCCOC(=O)c1cccnc1 869e7800826a56db61bb4d815a7ecc16 [0,1,0,0,0,0|2,0,1]=4 2577 B16R1.609 C=C(CNCCCC(C)C)c1ccccc1 0d66de00bd1c9b7f99aaeb4bead70e48 [0,1,0,0,0,0|3,0,0]=4 2578 B16R1.609 C=C(COCCCC(C)C)c1ccccc1 9432af11d8a103b97a4e190eb0203f21 [0,1,0,0,0,0|3,0,0]=4 2579 B16R1.609 C=C(Cl)COCCOC(=O)c1ccccc1 6a5b30282eb2ac25acab50bf9e883cc5 [0,1,0,0,0,0|1,0,2]=4 2580 B16R1.609 C=C(F)COCCOC(=O)c1ccccc1 5d40f5728332c527f6627849d129edf7 [0,1,0,0,0,0|1,0,2]=4 2581 B16R1.609 C=C(I)COCCOC(=O)c1ccccc1 c0a8e930a9618a18358ba790f8301be4 [0,1,0,0,0,0|1,0,2]=4 2582 B16R1.609 CC(=CCNCOC(=O)c1ccccc1)C 8cd0ce4e4baffb9f7bbc8554caad9803 [0,1,0,0,0,0|1,0,2]=4 2583 B16R1.609 CC(=CCOCOC(=O)c1ccccc1)C 37b09b63cdc16fcea276f7c0162863ea [0,1,0,0,0,0|1,0,2]=4 2584 B16R1.609 CC(=CCOCOC(=O)c1ccccc1)I 6d757b313ecb027ad1b2d45cc86cdebf [0,1,0,0,0,0|1,0,2]=4 2585 B16R1.609 CC(=O)CCCNCC(=O)c1ccccc1 e263c763aead381e9095714d41abb169 [0,1,0,0,0,0|2,0,1]=4 2586 B16R1.609 CC(=O)CCCOCC(=O)c1ccccc1 ea5db70c650bb868c34c81a291888da0 [0,1,0,0,0,0|2,0,1]=4 2587 B16R1.609 CC(=O)CCOCCC(=O)c1ccccc1 bf6449cad0408765b234efcfa63bd856 [0,1,0,0,0,0|2,0,1]=4 2588 B16R1.609 CC(=O)CCOCNC(=O)c1ccccc1 de509da645e7fdec533dc44bc69e82cf [0,1,0,0,0,0|2,0,1]=4 2589 B16R1.609 CC(=O)CCOCOC(=O)c1ccccc1 7435db9fc3166d573db08e8b84345cc8 [0,1,0,0,0,0|1,0,1]=3 2590 B16R1.609 CC(=O)CNCCNC(=O)c1ccccc1 633f5e8e635178c79db524c9544eda45 [0,1,0,0,0,0|2,0,1]=4 2591 B16R1.609 CC(=O)CNCCOC(=O)c1ccccc1 bc8fee2fb9531493900d4cc1e0b117f2 [0,1,0,0,0,0|1,0,1]=3 2592 B16R1.609 CC(=O)COCCOC(=O)c1ccccc1 c4d549068fa1abcba0cbc8f7dbd3a342 [0,1,0,0,0,0|1,0,1]=3 2593 B16R1.609 CC(=O)NCCCNC(=O)c1ccccc1 56e17712a3295816e5f462bed7709216 [0,1,0,0,0,0|2,0,1]=4 2594 B16R1.609 CC(=O)NCOCOC(=O)c1ccccc1 bc5f168db932e6a75543be4f23009aa6 [0,1,0,0,0,0|2,0,1]=4 2595 B16R1.609 CC(C)CCCCCN(C)c1ccccc1 ebc54f26c7bbdc7f3f8f39f1ec2642cc [0,1,0,0,0,0|3,0,0]=4 2596 B16R1.609 CC(C)CCCCNC(C)c1ccccc1 a3f70adaba4e37bf8d601426563a03ba [0,1,0,0,0,0|2,0,1]=4 2597 B16R1.609 CC(C)CCCCN[C@@H](C)c1ccccc1 26ad67d3fc66e3f591a1dffbdd9b23b8 [0,1,0,0,0,0|2,0,1]=4 2598 B16R1.609 CC(C)CCCCN[C@H](C)c1ccccc1 4e94d17c0ec8ec6133fcf96a0918ff5d [0,1,0,0,0,0|2,0,1]=4 2599 B16R1.609 CC(C)CCCCOC(C)c1ccccc1 6d2c87ebf730350c860a124f1181f4e9 [0,1,0,0,0,0|1,0,1]=3 2600 B16R1.609 CC(C)CCCCOC(C)c1ccccn1 b318e8844ebcd3bf879d3f43750bba28 [0,1,0,0,0,0|2,0,1]=4 2601 B16R1.609 CC(C)CCCCOC(C)c1cccnc1 6e90182bf6d83b9df8d177981154a46d [0,1,0,0,0,0|2,0,1]=4 2602 B16R1.609 CC(C)CCCCOC(C)c1ccncc1 481e74fc9744e7935474b7f15ca36678 [0,1,0,0,0,0|2,0,1]=4 2603 B16R1.609 CC(C)CCCCO[C@@H](C)c1ccccc1 f7246f876c96cbfb9ec716314d2bd719 [0,1,0,0,0,0|1,0,1]=3 2604 B16R1.609 CC(C)CCCCO[C@@H](C)c1ccccn1 104938fc9f6a078ecf221f38ff2c781b [0,1,0,0,0,0|2,0,1]=4 2605 B16R1.609 CC(C)CCCCO[C@@H](C)c1cccnc1 2c54da16be150325f4070667bea2699b [0,1,0,0,0,0|2,0,1]=4 2606 B16R1.609 CC(C)CCCCO[C@@H](C)c1ccncc1 4c4091f949435ac52ded953e92005e08 [0,1,0,0,0,0|2,0,1]=4 2607 B16R1.609 CC(C)CCCCO[C@H](C)c1ccccc1 a4003d9979168f7b30986346b916f97f [0,1,0,0,0,0|1,0,1]=3 2608 B16R1.609 CC(C)CCCCO[C@H](C)c1ccccn1 4c03ef2377fcd810056800d5fadbb598 [0,1,0,0,0,0|2,0,1]=4 2609 B16R1.609 CC(C)CCCCO[C@H](C)c1cccnc1 91911b01b52de3fe7d11fe3476d36b2a [0,1,0,0,0,0|2,0,1]=4 2610 B16R1.609 CC(C)CCCCO[C@H](C)c1ccncc1 8e0bd2dac539a825f3a5760b2ac80118 [0,1,0,0,0,0|2,0,1]=4 2611 B16R1.609 CC(C)CCCNCC(=O)c1ccccc1 73dadce1bd2705f64ee6c8cbb6fa0adf [0,1,0,0,0,0|2,0,0]=3 2612 B16R1.609 CC(C)CCCNCC(=O)c1ccccn1 cf61a0fd8547d7ce091d02506ce11c64 [0,1,0,0,0,0|3,0,0]=4 2613 B16R1.609 CC(C)CCCNCC(=O)c1cccnc1 56e39a2affa550072f23354039e60685 [0,1,0,0,0,0|3,0,0]=4 2614 B16R1.609 CC(C)CCCOCC(=O)c1ccccc1 e0032849ccafac44bf1453dd5819abae [0,1,0,0,0,0|2,0,0]=3 2615 B16R1.609 CC(C)CCCOCC(=O)c1ccccn1 cb9d78861a520c443ed211ed7392067e [0,1,0,0,0,0|3,0,0]=4 2616 B16R1.609 CC(C)CCCOCC(=O)c1cccnc1 537d468981d522d33b730c7e764a2260 [0,1,0,0,0,0|3,0,0]=4 2617 B16R1.609 CC(C)CCNCOC(=O)c1ccccc1 e4556d4cf87fab381fa8a977fe9795c1 [0,1,0,0,0,0|1,0,0]=2 2618 B16R1.609 CC(C)CCOCCC(=O)c1ccccc1 4a16193a5205ef8f3e5de07c7ba8247e [0,1,0,0,0,0|2,0,0]=3 2619 B16R1.609 CC(C)CCOCCS(=O)c1ccccc1 82459641941bd1b1e7e5698fdde7f54c [0,1,0,0,0,0|3,0,0]=4 2620 B16R1.609 CC(C)CCOCNC(=O)c1ccccc1 08329fab26aeb1c6259f608e0efa7609 [0,1,0,0,0,0|2,0,0]=3 2621 B16R1.609 CC(C)CCOCNC(=O)c1cccnc1 8e677c118252fed9ff4c29c8db7b817d [0,1,0,0,0,0|3,0,0]=4 2622 B16R1.609 CC(C)CCOCOC(=O)c1ccccc1 44702575269cbe3b7047122cca9551c2 [0,1,0,0,0,0|1,0,0]=2 2623 B16R1.609 CC(C)CNCCNC(=O)c1ccccc1 954c0f432400e557db8967ce49896862 [0,1,0,0,0,0|2,0,0]=3 2624 B16R1.609 CC(C)CNCCNC(=O)c1ccccn1 0bd35236af7608845f016aa4a4988919 [0,1,0,0,0,0|3,0,0]=4 2625 B16R1.609 CC(C)CNCCNC(=O)c1ccncc1 3cc854ff2bceb07d7a13766ac784a432 [0,1,0,0,0,0|3,0,0]=4 2626 B16R1.609 CC(C)CNCCOC(=O)c1ccccc1 75699ebdf8d9847d43a1f74738b09b43 [0,1,0,0,0,0|1,0,0]=2 2627 B16R1.609 CC(C)COCCCC(=O)c1ccccc1 0dde39ed25dc401131149507233f9a77 [0,1,0,0,0,0|2,0,0]=3 2628 B16R1.609 CC(C)COCCCC(=O)c1cccnc1 88239ac183eeb81939666853d50bd207 [0,1,0,0,0,0|3,0,0]=4 2629 B16R1.609 CC(C)COCCNC(=O)c1ccccc1 68a05c80e943f26fbd961924f3e2ac73 [0,1,0,0,0,0|2,0,0]=3 2630 B16R1.609 CC(C)COCCNC(=O)c1ccccn1 7104c39f52939834eb398b519232ec1a [0,1,0,0,0,0|3,0,0]=4 2631 B16R1.609 CC(C)COCCNC(=O)c1cccnc1 1287ed906c1d74597870a3ca054d6cb1 [0,1,0,0,0,0|3,0,0]=4 2632 B16R1.609 CC(C)COCCNC(=O)c1ccncc1 b9f45e59d132f7c340e7af618c166b73 [0,1,0,0,0,0|3,0,0]=4 2633 B16R1.609 CC(C)COCCOC(=O)c1ccccc1 fe3a09749adff39414421b3b0dc2a116 [0,1,0,0,0,0|1,0,0]=2 2634 B16R1.609 CC(C)COCCOC(=O)c1cccnc1 0897c1c7482f8cb2174b070695f050cf [0,1,0,0,0,0|2,0,0]=3 2635 B16R1.609 CC(C)COCCOC(C)c1ccccc1 381726215db270bd2cb83e58e3acade6 [0,1,0,0,0,0|2,0,1]=4 2636 B16R1.609 CC(C)COCCO[C@@H](C)c1ccccc1 ab8854d241ce375fb9ef49dd3bd69bee [0,1,0,0,0,0|2,0,1]=4 2637 B16R1.609 CC(C)COCCO[C@H](C)c1ccccc1 9cb61d0394eacc918479d4fe79487689 [0,1,0,0,0,0|2,0,1]=4 2638 B16R1.609 CC(C)OCCCNC(=O)c1ccccc1 f7049a761cc742b393b3712c8eb01162 [0,1,0,0,0,0|2,0,0]=3 2639 B16R1.609 CC(C)OCCCNC(=O)c1ccccn1 288597e82254357797fa437caf4197f3 [0,1,0,0,0,0|3,0,0]=4 2640 B16R1.609 CC(C)OCCCNC(=O)c1cccnc1 dedcd681f4340597c672d637c4103e73 [0,1,0,0,0,0|3,0,0]=4 2641 B16R1.609 CC(C)OCCCNC(=O)c1ccncc1 677b5365eefafb68160824e4a741ff1c [0,1,0,0,0,0|3,0,0]=4 2642 B16R1.609 CC(C)OCCNCC(=O)c1ccccc1 62c6cea35a1641b8c1b82b193862e27b [0,1,0,0,0,0|3,0,0]=4 2643 B16R1.609 CC(C)OCCOCC(=O)c1ccccc1 4a1021fec0fcd501082e1dccd33c0286 [0,1,0,0,0,0|3,0,0]=4 2644 B16R1.609 CC(C)OCOCCC(=O)c1ccccc1 4080f3da0d6025416c0a1ef0a6e49b0d [0,1,0,0,0,0|3,0,0]=4 2645 B16R1.609 CC(C)OCOCNC(=O)c1ccccc1 08dc81ddb74f497fb60984bba2f26443 [0,1,0,0,0,0|3,0,0]=4 2646 B16R1.609 CC(C)SCCCNC(=O)c1ccccc1 dffe94ff5cf43c07e88ef78940ec4173 [0,1,0,0,0,0|2,0,0]=3 2647 B16R1.609 CC(C)SCCCNC(=O)c1ccccn1 685c720457ca67f9adbcd86b82e0421f [0,1,0,0,0,0|3,0,0]=4 2648 B16R1.609 CC(C)SCCCNC(=O)c1cccnc1 2a57cfaee81a5fbb2aa8889074e0d91a [0,1,0,0,0,0|3,0,0]=4 2649 B16R1.609 CC(C)SCCCNC(=O)c1ccncc1 8e9508377629a5505ef17cc5398a4407 [0,1,0,0,0,0|3,0,0]=4 2650 B16R1.609 CC(C)SCCNCC(=O)c1ccccc1 156eb98537fcb4ecf37f3d463f3c9fb4 [0,1,0,0,0,0|3,0,0]=4 2651 B16R1.609 CC(C)SCCOCC(=O)c1ccccc1 33a137bf0a0621aa773082fba68bea70 [0,1,0,0,0,0|3,0,0]=4 2652 B16R1.609 CC(F)COCCNC(=O)c1ccccn1 b10f0790fb3102985cd7c33a618b7bb6 [0,1,0,0,0,0|3,0,0]=4 2653 B16R1.609 CC(F)COCCOC(=O)c1ccccc1 91dbb5e1960b3cdadb9574273a1b5ad9 [0,1,0,0,0,0|1,0,0]=2 2654 B16R1.609 CC(O)CCCNCC(=O)c1ccccc1 664f52345eaf9bbb885d9de0845c85d0 [0,1,0,0,0,0|2,0,0]=3 2655 B16R1.609 CC(O)CCNCOC(=O)c1ccccc1 3549a2b252afed344d6fa0f7d97a90cd [0,1,0,0,0,0|1,0,0]=2 2656 B16R1.609 CC(O)CNCCNC(=O)c1ccccc1 9b7cd88a1e6df621528f1047e0e18033 [0,1,0,0,0,0|2,0,0]=3 2657 B16R1.609 CC(O)CNCCNC(=O)c1ccccn1 63ed8032f12be0f6676a72bc530d7ffd [0,1,0,0,0,0|3,0,0]=4 2658 B16R1.609 CC(O)CNCCNC(=O)c1ccncc1 1651897ff7ae9aa4f78df18751439b1e [0,1,0,0,0,0|3,0,0]=4 2659 B16R1.609 CC(O)CNCCOC(=O)c1ccccc1 a8c235bd32af4669a61ccd845fc169ac [0,1,0,0,0,0|1,0,0]=2 2660 B16R1.609 CC(OCCCCN(C)C)c1ccccc1 67088562ffd846cb03cefc521508e015 [0,1,0,0,0,0|2,0,1]=4 2661 B16R1.609 CC(S)COCCNC(=O)c1ccccn1 2b1555aea1fa4f1c46d4591071c28ac0 [0,1,0,0,0,0|3,0,0]=4 2662 B16R1.609 CC(S)COCCOC(=O)c1ccccc1 4a35e218092521a3e84fcac2ccdfc963 [0,1,0,0,0,0|1,0,0]=2 2663 B16R1.609 CN(C)CCCCNC(=O)c1ccccc1 0753ed7361e4895c72ea4eaada2d1d29 [0,1,0,0,0,0|2,0,0]=3 2664 B16R1.609 CN(C)CCCCNC(=O)c1ccccn1 4688d7493cb5ae48ed374fdce409896e [0,1,0,0,0,0|3,0,0]=4 2665 B16R1.609 CN(C)CCCCNC(=O)c1cccnc1 809b762596de17680c9a698c959003dd [0,1,0,0,0,0|3,0,0]=4 2666 B16R1.609 CN(C)CCCCNC(=O)c1ccncc1 6e562a50b608d9a00f6eea57f616282a [0,1,0,0,0,0|3,0,0]=4 2667 B16R1.609 CN(C)CCCNCC(=O)c1ccccc1 88239280474c63cd6d9b9c57c41e659d [0,1,0,0,0,0|3,0,0]=4 2668 B16R1.609 CN(C)CCCOCC(=O)c1ccccc1 57e6359845fee04a10a57684727f2d62 [0,1,0,0,0,0|3,0,0]=4 2669 B16R1.609 CN(C)CCNCOC(=O)c1ccccc1 27c622d276f284602caa9362e2d5a3fe [0,1,0,0,0,0|2,0,0]=3 2670 B16R1.609 CN(C)CCOCCC(=O)c1ccccc1 482913c37a57faf5d2bc5cdd3fbb8726 [0,1,0,0,0,0|3,0,0]=4 2671 B16R1.609 CN(C)CCOCNC(=O)c1ccccc1 741e1109e6c76659d99f32e3673d56cc [0,1,0,0,0,0|3,0,0]=4 2672 B16R1.609 CN(C)CCOCOC(=O)c1ccccc1 8794fe1fd5b15a3fa7cca34f7a906579 [0,1,0,0,0,0|2,0,0]=3 2673 B16R1.609 CN(C)COCCCC(=O)c1ccccc1 c22b209f155153dd4566ba5d16a02536 [0,1,0,0,0,0|3,0,0]=4 2674 B16R1.609 CN(C)COCCNC(=O)c1ccccc1 a5481a3bab247c170fcec36097ab9a45 [0,1,0,0,0,0|3,0,0]=4 2675 B16R1.609 CN(C)COCCOC(=O)c1ccccc1 7c01dcce8ba1e68c3c80a019f41c1fa8 [0,1,0,0,0,0|2,0,0]=3 2676 B16R1.609 CN(C)COCCOC(=O)c1cccnc1 ec71802e0bac6d0d1fde6bb6f9b09892 [0,1,0,0,0,0|3,0,0]=4 2677 B16R1.609 CS(=O)CCCNCC(=O)c1ccccc1 679ad24c4f991c2c8f9046a5251d34ee [0,1,0,0,0,0|3,0,0]=4 2678 B16R1.609 CS(=O)CCNCOC(=O)c1ccccc1 ea27dc4f5fcf230616ff75b33fcefaf6 [0,1,0,0,0,0|2,0,0]=3 2679 B16R1.609 CS(=O)CCOCCC(=O)c1ccccc1 44182c934bb5137573d911f922d71cf9 [0,1,0,0,0,0|3,0,0]=4 2680 B16R1.609 CS(=O)CCOCNC(=O)c1ccccc1 039c72b92c757bc6a48af190830a483e [0,1,0,0,0,0|3,0,0]=4 2681 B16R1.609 CS(=O)CCOCOC(=O)c1ccccc1 5f284779708879e8e63de770efaf99c8 [0,1,0,0,0,0|2,0,0]=3 2682 B16R1.609 C[C@@H](F)COCCNC(=O)c1ccccn1 5015fa5b66ee44d7ec6835d29a0a3058 [0,1,0,0,0,0|3,0,0]=4 2683 B16R1.609 C[C@@H](F)COCCOC(=O)c1ccccc1 4392e7086ea7ba97726bbf0502539717 [0,1,0,0,0,0|1,0,0]=2 2684 B16R1.609 C[C@@H](O)CCNCOC(=O)c1ccccc1 23c0e6c30edeaae44c7c59b55f4001b4 [0,1,0,0,0,0|1,0,0]=2 2685 B16R1.609 C[C@@H](O)CNCCNC(=O)c1ccccc1 e2c942e7a2085daeb138856d505d8fa2 [0,1,0,0,0,0|2,0,0]=3 2686 B16R1.609 C[C@@H](O)CNCCNC(=O)c1ccccn1 f42c25df15c0cd626e0e90127baa3cd4 [0,1,0,0,0,0|3,0,0]=4 2687 B16R1.609 C[C@@H](O)CNCCNC(=O)c1ccncc1 6b65818be51e7743ad911400eadea97b [0,1,0,0,0,0|3,0,0]=4 2688 B16R1.609 C[C@@H](O)CNCCOC(=O)c1ccccc1 6b9a40bcf5d0b313cf1792624839564b [0,1,0,0,0,0|1,0,0]=2 2689 B16R1.609 C[C@@H](OCCCCN(C)C)c1ccccc1 684e69e0dfd1b17328586fed2cda9029 [0,1,0,0,0,0|2,0,1]=4 2690 B16R1.609 C[C@H](F)COCCNC(=O)c1ccccn1 2bc798efe500f6159ea2873704b582ca [0,1,0,0,0,0|3,0,0]=4 2691 B16R1.609 C[C@H](F)COCCOC(=O)c1ccccc1 83570168084e32522099042370c85cce [0,1,0,0,0,0|1,0,0]=2 2692 B16R1.609 C[C@H](O)CCNCOC(=O)c1ccccc1 90620c9cbc6c240379dd3f667261dcf4 [0,1,0,0,0,0|1,0,0]=2 2693 B16R1.609 C[C@H](O)CNCCNC(=O)c1ccccc1 65a2fedfca31078dd2eda33fa72c9473 [0,1,0,0,0,0|2,0,0]=3 2694 B16R1.609 C[C@H](O)CNCCNC(=O)c1ccccn1 07f05c46df87f76b847a1d756e78e6d3 [0,1,0,0,0,0|3,0,0]=4 2695 B16R1.609 C[C@H](O)CNCCNC(=O)c1ccncc1 d0cc893a7667b40cf6a16e87d055dfbe [0,1,0,0,0,0|3,0,0]=4 2696 B16R1.609 C[C@H](O)CNCCOC(=O)c1ccccc1 fdfa287c27467056ce663995be145581 [0,1,0,0,0,0|1,0,0]=2 2697 B16R1.609 C[C@H](OCCCCN(C)C)c1ccccc1 50b7bccc013f52e6e26af277e8610426 [0,1,0,0,0,0|2,0,1]=4 2698 B16R1.609 NC(=O)CCCCNC(=O)c1ccccc1 76a56ce3e9c09373ee3ca0a4c1d2c449 [0,1,0,0,0,0|2,0,1]=4 2699 B16R1.609 NC(=O)CCNCOC(=O)c1ccccc1 171630687c84693bdf29c22621a97bf2 [0,1,0,0,0,0|2,0,1]=4 2700 B16R1.609 NC(=O)CCOCOC(=O)c1ccccc1 68c1b08035d77907f0375ec38b93ec04 [0,1,0,0,0,0|2,0,1]=4 2701 B16R1.609 NC(=O)CNCCOC(=O)c1ccccc1 04dde296c5ae85aa6f6a6043f10d6e2b [0,1,0,0,0,0|2,0,1]=4 2702 B16R1.609 NC(=O)COCCOC(=O)c1ccccc1 1565ef92fb59c98443855e2a4babd47c [0,1,0,0,0,0|2,0,1]=4 2703 B16R1.609 NC(=S)CCNCOC(=O)c1ccccc1 5f9a66b962bc5c897cf0a3c19afc3b10 [0,1,0,0,0,0|2,0,1]=4 2704 B16R1.609 NC(=S)COCCOC(=O)c1ccccc1 39774781787e0acf40e29b743231aa31 [0,1,0,0,0,0|2,0,1]=4 2705 B16R1.609 O=C(CCCOCC(F)F)c1ccccc1 aab8c995631d7f1f8c0e75dad0fa2738 [0,1,0,0,0,0|3,0,0]=4 2706 B16R1.609 O=C(NCCCCC(F)F)c1ccccc1 795166854a2a87d8bd836ad87d588d64 [0,1,0,0,0,0|2,0,0]=3 2707 B16R1.609 O=C(NCCCCC(F)F)c1ccccn1 c374fb4f49ef13baeeda51f934c9d3ef [0,1,0,0,0,0|3,0,0]=4 2708 B16R1.609 O=C(NCCCCC(F)F)c1cccnc1 640b883a2d986eae18b3f59aad25fec4 [0,1,0,0,0,0|3,0,0]=4 2709 B16R1.609 O=C(NCCCCC(F)F)c1ccncc1 67e157f439befec61a2efebbb2a8a57e [0,1,0,0,0,0|3,0,0]=4 2710 B16R1.609 O=C(NCCCOC(F)F)c1ccccc1 e751e8a7750fa5a05716db18b928e4db [0,1,0,0,0,0|3,0,0]=4 2711 B16R1.609 O=C(NCCNCC(F)F)c1ccccc1 ed8af37a2416ad70d6ad243863ae0113 [0,1,0,0,0,0|3,0,0]=4 2712 B16R1.609 O=C(NCCOCC(F)F)c1ccccc1 0637ab4d521a094a5cb66e7f6a3f50a0 [0,1,0,0,0,0|3,0,0]=4 2713 B16R1.609 O=C(O)CCNCOC(=O)c1ccccc1 de29290f336db8a84865e2ebad487ea2 [0,1,0,0,0,0|2,0,1]=4 2714 B16R1.609 O=C(O)CCOCOC(=O)c1ccccc1 79137883702254837e15cc466fd1a9c5 [0,1,0,0,0,0|2,0,1]=4 2715 B16R1.609 O=C(O)CNCCOC(=O)c1ccccc1 1a9c3c9aa0a217edaf278265e14228a7 [0,1,0,0,0,0|2,0,1]=4 2716 B16R1.609 O=C(O)COCCOC(=O)c1ccccc1 a533250a54761934ee40c52c530f25ca [0,1,0,0,0,0|2,0,1]=4 2717 B16R1.609 O=C(OCCNCC(F)F)c1ccccc1 ecad3c7a0afcca865a5317b327447a08 [0,1,0,0,0,0|2,0,0]=3 2718 B16R1.609 O=C(OCCOCC(F)F)c1ccccc1 1ef2ad7b79998202771297e30eab08ae [0,1,0,0,0,0|2,0,0]=3 2719 B16R1.609 O=C(OCCOCC(F)F)c1cccnc1 fbac18aad6f5099e93894479c41b7b4d [0,1,0,0,0,0|3,0,0]=4 2720 B16R1.609 O=C(OCCOCS(=O)O)c1ccccc1 9fac9f8adb02213d6ba18a0042039328 [0,1,0,0,0,0|3,0,0]=4 2721 B16R1.609 O=C(OCCOC[N+](=O)[O-])c1ccccc1 9eac7ecd0e1f2ce211f5b875d4019c04 [0,1,0,0,0,0|3,0,0]=4 2722 B16R1.609 O=C(OCNCCC(F)F)c1ccccc1 003da4a11a03638d9a64d2cea467577e [0,1,0,0,0,0|2,0,0]=3 2723 B16R1.609 O=C(OCNCCS(=O)O)c1ccccc1 ad444816255028b69c4d28caf8722ec0 [0,1,0,0,0,0|3,0,0]=4 2724 B16R1.609 O=C(OCOCCC(F)F)c1ccccc1 8ec3c80b02e9ac039ac57027e3d39b37 [0,1,0,0,0,0|2,0,0]=3 2725 B16R1.609 O=C(OCOCC[N+](=O)[O-])c1ccccc1 a159e09a0a2359aef367b383a74e2e01 [0,1,0,0,0,0|3,0,0]=4 2726 B16R1.641 C#CC(OCCCCCC)c1ccccc1 27f5cbd2e302cb271d1b0062b0c98528 [0,1,0,0,0,0|1,0,1]=3 2727 B16R1.641 C#CC(OCCCCCC)c1ccccn1 581fcd48e2355e82f7ff9fe5484e3f16 [0,1,0,0,0,0|2,0,1]=4 2728 B16R1.641 C#CC(OCCCCCC)c1ccncc1 ef7286eb0611f016dba926950fbe80d4 [0,1,0,0,0,0|2,0,1]=4 2729 B16R1.641 C#CC(OCCCCCF)c1ccccc1 ff899f944a993bad9534482574ef88fc [0,1,0,0,0,0|2,0,1]=4 2730 B16R1.641 C#CC(OCCCCOC)c1ccccc1 4e1b6328eeab8f00facc42c8fc01ce8e [0,1,0,0,0,0|2,0,1]=4 2731 B16R1.641 C#CC(OCCCOCC)c1ccccc1 f9b5faf94f608a47437110463b060eb2 [0,1,0,0,0,0|2,0,1]=4 2732 B16R1.641 C#CC(OCCCSCC)c1ccccc1 23af33161d7477c43ed4eededbe3110a [0,1,0,0,0,0|2,0,1]=4 2733 B16R1.641 C#CC(OCCOCCC)c1ccccc1 3c53591e376a9585feac3bd7367427b0 [0,1,0,0,0,0|2,0,1]=4 2734 B16R1.641 C#CC(OCOCCCC)c1ccccc1 8aad84d0ae9b94b44f81f34db13547fc [0,1,0,0,0,0|2,0,1]=4 2735 B16R1.641 C#C[C@@H](OCCCCCC)c1ccccc1 b5bebf23bfbddf6810b7721678051b9e [0,1,0,0,0,0|1,0,1]=3 2736 B16R1.641 C#C[C@@H](OCCCCCF)c1ccccc1 3880676d33070ed9fa03baedd6049dc4 [0,1,0,0,0,0|2,0,1]=4 2737 B16R1.641 C#C[C@@H](OCCCCOC)c1ccccc1 b5e90655d42ec5c89576b39c3feca6eb [0,1,0,0,0,0|2,0,1]=4 2738 B16R1.641 C#C[C@@H](OCCCOCC)c1ccccc1 9221210322125ff42ca82d5e5e4f7de6 [0,1,0,0,0,0|2,0,1]=4 2739 B16R1.641 C#C[C@@H](OCCCSCC)c1ccccc1 eda77d42fdeafa8731991e0e32018162 [0,1,0,0,0,0|2,0,1]=4 2740 B16R1.641 C#C[C@@H](OCCOCCC)c1ccccc1 36582769d4dcbb14d3e088854d7f1a76 [0,1,0,0,0,0|2,0,1]=4 2741 B16R1.641 C#C[C@@H](OCOCCCC)c1ccccc1 9c4f319f65aa13aafc515a076ec3800f [0,1,0,0,0,0|2,0,1]=4 2742 B16R1.641 C#C[C@H](OCCCCCC)c1ccccc1 4514931be0cc165e994138be9299f0f0 [0,1,0,0,0,0|1,0,1]=3 2743 B16R1.641 C#C[C@H](OCCCCCF)c1ccccc1 04bad8fd38771e8e7252c13beba7962e [0,1,0,0,0,0|2,0,1]=4 2744 B16R1.641 C#C[C@H](OCCCCOC)c1ccccc1 62cc497457374c2f343afa2d8e954290 [0,1,0,0,0,0|2,0,1]=4 2745 B16R1.641 C#C[C@H](OCCCOCC)c1ccccc1 e0a850379d51d84e9d5a78521225cb61 [0,1,0,0,0,0|2,0,1]=4 2746 B16R1.641 C#C[C@H](OCCCSCC)c1ccccc1 91ae1bf83a94117934579a67863d4e4a [0,1,0,0,0,0|2,0,1]=4 2747 B16R1.641 C#C[C@H](OCCOCCC)c1ccccc1 3df21fd52d66bff9c8360003f4beeebe [0,1,0,0,0,0|2,0,1]=4 2748 B16R1.641 C#C[C@H](OCOCCCC)c1ccccc1 502c7aec07f6c0a0e991fb7e667c0259 [0,1,0,0,0,0|2,0,1]=4 2749 B16R1.641 C=CC(NCCCCCC)c1ccccc1 cd2f535e3a6541a6039ad080f2cee1d9 [0,1,0,0,0,0|2,0,1]=4 2750 B16R1.641 C=CC(OCCCCCC)c1ccccc1 ec1fa40a5737a5c63b17e3442bcaef8d [0,1,0,0,0,0|1,0,1]=3 2751 B16R1.641 C=CC(OCCCCCF)c1ccccc1 17ffe04248edd6bb5a54077d093b378e [0,1,0,0,0,0|2,0,1]=4 2752 B16R1.641 C=CC(OCCCCOC)c1ccccc1 5c6498728384708f47a89932725433c2 [0,1,0,0,0,0|2,0,1]=4 2753 B16R1.641 C=CC(OCCCCSC)c1ccccc1 482fe42ade9ebf99c57ff49b4882420c [0,1,0,0,0,0|2,0,1]=4 2754 B16R1.641 C=CC(OCCCOCC)c1ccccc1 86301dc43297b9d825b03a6692f83e52 [0,1,0,0,0,0|2,0,1]=4 2755 B16R1.641 C=CC(OCCCSCC)c1ccccc1 6e3f47da4c6886a520a337b007ec9e42 [0,1,0,0,0,0|2,0,1]=4 2756 B16R1.641 C=CC(OCCOCCC)c1ccccc1 b7fdafec151c2b239c276d32ae0a949b [0,1,0,0,0,0|2,0,1]=4 2757 B16R1.641 C=CC(OCCSCCC)c1ccccc1 217e401486b29e4d6bd6d01f337022a8 [0,1,0,0,0,0|2,0,1]=4 2758 B16R1.641 C=CC(OCOCCCC)c1ccccc1 6eddee68df1ae9595faecb6d6cf5fe54 [0,1,0,0,0,0|2,0,1]=4 2759 B16R1.641 C=C[C@@H](NCCCCCC)c1ccccc1 a3f5af3beaf15f3b2d9ebf14e8e319b6 [0,1,0,0,0,0|2,0,1]=4 2760 B16R1.641 C=C[C@H](NCCCCCC)c1ccccc1 46c882b8d397a223ba240bd37b8505a0 [0,1,0,0,0,0|2,0,1]=4 2761 B16R1.641 CC#CCCCOC(C=O)c1ccccc1 7fce0565af274c72a111cf0e01d268c2 [0,1,0,0,0,0|0,0,3]=4 2762 B16R1.641 CCC(OCCCCCF)c1ccccc1 eef80279b7ab8e51935da67fd87bab07 [0,1,0,0,0,0|2,0,1]=4 2763 B16R1.641 CCC(OCCCCOC)c1ccccc1 465eae31cbe750a4d31290db23722d1e [0,1,0,0,0,0|2,0,1]=4 2764 B16R1.641 CCC(OCCCCSC)c1ccccc1 d5559194c5d891882a868a3c673829cc [0,1,0,0,0,0|2,0,1]=4 2765 B16R1.641 CCCCCCCN(C#N)c1ccccc1 70b8c0aab7a6e6f46749bc2fa85e8f7c [0,1,0,0,0,0|3,0,0]=4 2766 B16R1.641 CCCCCCCN(CC)c1ccccc1 5539768230613fc52eb98cdcfcb58750 [0,1,0,0,0,0|3,0,0]=4 2767 B16R1.641 CCCCCCNC(C#N)c1ccccc1 177e20c2facb64c40e49aa0c7fc40008 [0,1,0,0,0,0|2,0,1]=4 2768 B16R1.641 CCCCCCNC(C=O)c1ccccc1 77ae9aa07aea8b16993f0c94c42a303b [0,1,0,0,0,0|1,0,1]=3 2769 B16R1.641 CCCCCCNC(CC)c1ccccc1 2a191f790ca055871497b0688f29684a [0,1,0,0,0,0|2,0,1]=4 2770 B16R1.641 CCCCCCNC(CO)c1ccccc1 11b82837f7260e252154cf4028c559ae [0,1,0,0,0,0|1,0,2]=4 2771 B16R1.641 CCCCCCN[C@@H](CC)c1ccccc1 f6c484761b06ae6f67ed24b28d7f2b53 [0,1,0,0,0,0|2,0,1]=4 2772 B16R1.641 CCCCCCN[C@@H](CF)c1ccccc1 03e8f26270d30719358590fd087c2418 [0,1,0,0,0,0|2,0,1]=4 2773 B16R1.641 CCCCCCN[C@@H](CO)c1ccccc1 4b0e72b36f3649db8ed6f8645c1aacd9 [0,1,0,0,0,0|1,0,2]=4 2774 B16R1.641 CCCCCCN[C@H](CC)c1ccccc1 c38b8df1759075ceb5569484c71c6d1f [0,1,0,0,0,0|2,0,1]=4 2775 B16R1.641 CCCCCCN[C@H](CO)c1ccccc1 1b9ec3e0e61980e9bc71a9643efd982e [0,1,0,0,0,0|1,0,2]=4 2776 B16R1.641 CCCCCCOC(C#N)c1ccccc1 f4dd3ff2acf2c173070bb938aae7b7fa [0,1,0,0,0,0|1,0,1]=3 2777 B16R1.641 CCCCCCOC(C#N)c1cccnc1 dc037e8fd7c991a4184281f4e8de645a [0,1,0,0,0,0|2,0,1]=4 2778 B16R1.641 CCCCCCOC(CC)c1ccccc1 994fc56ea6966643ab440eb1e8cbf2aa [0,1,0,0,0,0|1,0,1]=3 2779 B16R1.641 CCCCCCOC(CF)c1ccccc1 355845754d79145913dcbcbe8496ef2b [0,1,0,0,0,0|1,0,1]=3 2780 B16R1.641 CCCCCCO[C@@H](C#N)c1ccccc1 7fc515cf9a3524304881c77efa2a49af [0,1,0,0,0,0|1,0,1]=3 2781 B16R1.641 CCCCCCO[C@@H](CC)c1ccccc1 349e3bddb5a70ac32e07689220ea1ca0 [0,1,0,0,0,0|1,0,1]=3 2782 B16R1.641 CCCCCCO[C@H](CC)c1ccccc1 311102fdaece1955bcd5c4b719ae9761 [0,1,0,0,0,0|1,0,1]=3 2783 B16R1.641 CCCCCCO[C@H](CF)c1ccccc1 5e479923e4e72bdb640b73d7305a57e0 [0,1,0,0,0,0|1,0,1]=3 2784 B16R1.641 CCCCCO/C=C(\C=O)/c1ccccc1 32d25ad72d8448e41bb958e2e6773a1e [0,1,0,0,0,0|2,0,0]=3 2785 B16R1.641 CCCCCO/C=C(\C=O)/c1ccccn1 01aa136de32a38f3b7c1a4a1419a5ef5 [0,1,0,0,0,0|3,0,0]=4 2786 B16R1.641 CCCCCO/C=C(\C=O)/c1ccncc1 ea45db88f2c7218518e1cd934930ef0e [0,1,0,0,0,0|3,0,0]=4 2787 B16R1.641 CCCCCOC=C(C#N)c1ccccc1 6d62cd4e6a95b551b5d3e09a4b47d903 [0,1,0,0,0,0|3,0,0]=4 2788 B16R1.641 CCCCOCOC(C#N)c1ccccc1 e25ca9e044211972aa7eeed0897c09c4 [0,1,0,0,0,0|2,0,1]=4 2789 B16R1.641 CCCCOCOC(CC)c1ccccc1 45ca5fa3f23242287aff64f427fc9b1b [0,1,0,0,0,0|2,0,1]=4 2790 B16R1.641 CCCCOCOC(CF)c1ccccc1 e5acd78da91690b74da67b2cbb8f98c0 [0,1,0,0,0,0|2,0,1]=4 2791 B16R1.641 CCCCOCO[C@@H](C#N)c1ccccc1 827b7e0d16aa60303ef676b4716cb25a [0,1,0,0,0,0|2,0,1]=4 2792 B16R1.641 CCCCOCO[C@@H](CC)c1ccccc1 dc890b0e8ee74dfe2ed457862dd8b142 [0,1,0,0,0,0|2,0,1]=4 2793 B16R1.641 CCCCOCO[C@H](CC)c1ccccc1 798a84bf8ec712a57df8ce1cc130befb [0,1,0,0,0,0|2,0,1]=4 2794 B16R1.641 CCCCOCO[C@H](CF)c1ccccc1 532c902a3f6f09c76993086718736a18 [0,1,0,0,0,0|2,0,1]=4 2795 B16R1.641 CCCOCCNC(C=O)c1ccccc1 178d20e11fb3ff98ca53dbab7cec3185 [0,1,0,0,0,0|2,0,1]=4 2796 B16R1.641 CCCOCCOC(C#N)c1ccccc1 9e696af40fa17567c585d90e2ab53c24 [0,1,0,0,0,0|2,0,1]=4 2797 B16R1.641 CCCOCCOC(C=O)c1ccccc1 b57e39a13869936ba9ff267b9f37486f [0,1,0,0,0,0|1,0,1]=3 2798 B16R1.641 CCCOCCOC(CC)c1ccccc1 6e5872bc480937c473d2424b4c1936c2 [0,1,0,0,0,0|2,0,1]=4 2799 B16R1.641 CCCOCCOC(CF)c1ccccc1 5fd177124a98b239515c629d3bdb4da0 [0,1,0,0,0,0|2,0,1]=4 2800 B16R1.641 CCCOCCOC(CS)c1ccccc1 ea188e304ae0d83f7f71394c6fa945c8 [0,1,0,0,0,0|1,1,1]=4 2801 B16R1.641 CCCOCCO[C@@H](C#N)c1ccccc1 8df941315aa525c7d2578ab1f2e4314b [0,1,0,0,0,0|2,0,1]=4 2802 B16R1.641 CCCOCCO[C@@H](CC)c1ccccc1 ded85df9e8a19d1264e7ba41bb597102 [0,1,0,0,0,0|2,0,1]=4 2803 B16R1.641 CCCOCCO[C@H](CC)c1ccccc1 c15761184d347e78c45c52caeb6bf067 [0,1,0,0,0,0|2,0,1]=4 2804 B16R1.641 CCCOCCO[C@H](CF)c1ccccc1 b862cd1333406989c53ae5339d8b845a [0,1,0,0,0,0|2,0,1]=4 2805 B16R1.641 CCCSCCOC(CC)c1ccccc1 0209d9d1f20a2b0ab73921072fba4a7f [0,1,0,0,0,0|2,0,1]=4 2806 B16R1.641 CCOCCCNC(C=O)c1ccccc1 6695062473a9329511082b78f62dc4fc [0,1,0,0,0,0|2,0,1]=4 2807 B16R1.641 CCOCCCOC(C#N)c1ccccc1 34b66061a10d02e23ee5bd44f10bfc0e [0,1,0,0,0,0|2,0,1]=4 2808 B16R1.641 CCOCCCOC(CC)c1ccccc1 eb2c7ca1b3d94188b38e409ff37d50a5 [0,1,0,0,0,0|2,0,1]=4 2809 B16R1.641 CCOCCCOC(CF)c1ccccc1 ced8e9ca7dadfe17209733af801a61f9 [0,1,0,0,0,0|2,0,1]=4 2810 B16R1.641 CCOCCCOC(CS)c1ccccc1 dcd23f78b8c2256703751e13d84a0277 [0,1,0,0,0,0|1,1,1]=4 2811 B16R1.641 CCOCCCO[C@@H](C#N)c1ccccc1 5c73b62e8fb1c5a66a4a1e56015da846 [0,1,0,0,0,0|2,0,1]=4 2812 B16R1.641 CCOCCCO[C@@H](CC)c1ccccc1 53b9375f427c8fd19eec8373b1205564 [0,1,0,0,0,0|2,0,1]=4 2813 B16R1.641 CCOCCCO[C@H](CC)c1ccccc1 959f4158ba2e51707139d61f3dbcfda8 [0,1,0,0,0,0|2,0,1]=4 2814 B16R1.641 CCOCCCO[C@H](CF)c1ccccc1 beb2e5fb30d6cedb357fc4ce47b4e7fa [0,1,0,0,0,0|2,0,1]=4 2815 B16R1.641 CCOCCO/C=C(\C=O)/c1ccccc1 3227f4561780153f4f4e9508840c43e8 [0,1,0,0,0,0|3,0,0]=4 2816 B16R1.641 CCSCCCOC(C#N)c1ccccc1 5465c15dec6379011ac1dd32fe7f5896 [0,1,0,0,0,0|2,0,1]=4 2817 B16R1.641 CCSCCCOC(CC)c1ccccc1 99f99cfc3d09e5fd9204c75bd6f947ac [0,1,0,0,0,0|2,0,1]=4 2818 B16R1.641 CCSCCCOC(CF)c1ccccc1 db5dd8c17d160806313c6eaa6e86f05a [0,1,0,0,0,0|2,0,1]=4 2819 B16R1.641 CCSCCCO[C@@H](C#N)c1ccccc1 8ac8e4359179d143aa916ff90f5086de [0,1,0,0,0,0|2,0,1]=4 2820 B16R1.641 CCSCCCO[C@@H](CC)c1ccccc1 77f1ed3dcb1e7f7d7c918a3abb32b524 [0,1,0,0,0,0|2,0,1]=4 2821 B16R1.641 CCSCCCO[C@H](CC)c1ccccc1 174845d1dd2fef4e5a060cb2e8d4cad9 [0,1,0,0,0,0|2,0,1]=4 2822 B16R1.641 CCSCCCO[C@H](CF)c1ccccc1 b7f59db7e70a2ba59fb7a3634237b40a [0,1,0,0,0,0|2,0,1]=4 2823 B16R1.641 CCSCCO/C=C(\C=O)/c1ccccc1 c5ae7198847ea1a165f86e4d23b60151 [0,1,0,0,0,0|3,0,0]=4 2824 B16R1.641 CC[C@@H](OCCCCCF)c1ccccc1 48f68ba54f15bc03458fb545c91d901b [0,1,0,0,0,0|2,0,1]=4 2825 B16R1.641 CC[C@@H](OCCCCOC)c1ccccc1 964f9ce6de92a81d771c48e906777586 [0,1,0,0,0,0|2,0,1]=4 2826 B16R1.641 CC[C@H](OCCCCCF)c1ccccc1 8cde581b9789ab1bc4501e03fd085109 [0,1,0,0,0,0|2,0,1]=4 2827 B16R1.641 CC[C@H](OCCCCOC)c1ccccc1 ee421f2866b3a955fecd7eb80aa269ee [0,1,0,0,0,0|2,0,1]=4 2828 B16R1.641 COCCCCNC(C=O)c1ccccc1 65db91b62e936b0fc1d14b6f12b6385d [0,1,0,0,0,0|2,0,1]=4 2829 B16R1.641 COCCCCOC(C#N)c1ccccc1 d3bdf26b70f8bf4a3c62632c6ad8a6c6 [0,1,0,0,0,0|2,0,1]=4 2830 B16R1.641 COCCCCOC(CF)c1ccccc1 b476daec603ee08124bcb18a859e3d3f [0,1,0,0,0,0|2,0,1]=4 2831 B16R1.641 COCCCCOC(CS)c1ccccc1 ee5bcdc7965e3e77b8e4d4795223ba2b [0,1,0,0,0,0|1,1,1]=4 2832 B16R1.641 COCCCCO[C@@H](C#N)c1ccccc1 85cdb64d2ceb91ca3a7ebd1bcf26cc8d [0,1,0,0,0,0|2,0,1]=4 2833 B16R1.641 COCCCCO[C@H](CF)c1ccccc1 2681e66d5e87adceb4f0ca9998bbd6dc [0,1,0,0,0,0|2,0,1]=4 2834 B16R1.641 COCCCO/C=C(\C=O)/c1ccccc1 fb33e4829f87d714bc45639be5c228c9 [0,1,0,0,0,0|3,0,0]=4 2835 B16R1.641 CSCCCCNC(C=O)c1ccccc1 90ea59c5deb9af9db3e39f2813fda3e0 [0,1,0,0,0,0|2,0,1]=4 2836 B16R1.641 CSCCCO/C=C(\C=O)/c1ccccc1 511c842f2e89ba5716eb9127692ce6ee [0,1,0,0,0,0|3,0,0]=4 2837 B16R1.641 FCCCCCOC(CF)c1ccccc1 71e6f767d2fd438bfa6bbb51d08c2cdf [0,1,0,0,0,0|2,0,1]=4 2838 B16R1.641 FCCCCCO[C@H](CF)c1ccccc1 c2e9bdfcbbc2c6a5b1883177ed62ae2f [0,1,0,0,0,0|2,0,1]=4 2839 B16R1.641 N#CC(OCCCCCF)c1ccccc1 642043e3871f73411814479abebde811 [0,1,0,0,0,0|2,0,1]=4 2840 B16R1.641 N#C[C@H](OCCCCCF)c1ccccc1 e865b1d0f61c7afddbb4b50ad51d5943 [0,1,0,0,0,0|2,0,1]=4 2841 B16R1.641 O=C/C(=C\OCCCCF)/c1ccccc1 60eae7450b947ecaeae19c5019674e18 [0,1,0,0,0,0|3,0,0]=4 2842 B16R1.641 O=CC(NCCCCCCl)c1ccccc1 f0c0ca238f92a8c14e1c0e6dbc893674 [0,1,0,0,0,0|2,0,1]=4 2843 B16R1.641 O=CC(NCCCCCO)c1ccccc1 900f40422dc459e6dbfa15744288f0d4 [0,1,0,0,0,0|2,0,1]=4 2844 B16R1.641 O=CC(OCCOCCF)c1ccccc1 8e468550cb780da6dfdd78310351d647 [0,1,0,0,0,0|2,0,1]=4 2845 B16R1.641 O=CC(OCCOCCS)c1ccccc1 27cca587fb878c4df7db5cc84b25ab34 [0,1,0,0,0,0|2,0,1]=4 2846 B16R1.700 C#CCCN(C)COC(=O)c1ccccc1 c2c47e493a6ce44ff6ab360e252f515e [0,1,0,0,0,0|1,0,2]=4 2847 B16R1.700 C=CCCC(O)CNC(=O)c1ccccc1 566f4b99588b9915abfe8931628fb299 [0,1,0,0,0,0|1,0,2]=4 2848 B16R1.700 C=CCCN(C)COC(=O)c1ccccc1 80b6cdd837294cfe154b5b586dd2143d [0,1,0,0,0,0|1,0,2]=4 2849 B16R1.700 CC(CCCO)NCC(=O)c1ccccc1 dead79352b1f0773734c5f9231310bfb [0,1,0,0,0,0|3,0,0]=4 2850 B16R1.700 CC(CNC(=O)c1ccccc1)OCCF cacee6b41288d1f56dac5878e648ec7a [0,1,0,0,0,0|3,0,0]=4 2851 B16R1.700 CC(CNC(=O)c1ccccc1)OCCS 47d09514c504aa162bd2ae5a92b86c7d [0,1,0,0,0,0|3,0,0]=4 2852 B16R1.700 CCCCC(=O)NCC(=O)c1ccccc1 9bba5e2f30890edd8cab8c966897ee6d [0,1,0,0,0,0|2,0,1]=4 2853 B16R1.700 CCCCC(C)NCC(=O)c1ccccc1 5e956f43e0414013fed92ebadc13d783 [0,1,0,0,0,0|2,0,0]=3 2854 B16R1.700 CCCCC(C)NCC(=O)c1ccccn1 98b5cc15f6a39122cfef94a0a11d84f1 [0,1,0,0,0,0|3,0,0]=4 2855 B16R1.700 CCCCC(C)NCC(=O)c1cccnc1 9dfdb22d52a563d1ecf84455cced683c [0,1,0,0,0,0|3,0,0]=4 2856 B16R1.700 CCCCC(C)OCC(=O)c1ccccc1 8ebb17eedc9f7628451a5eb8964e8c5d [0,1,0,0,0,0|2,0,0]=3 2857 B16R1.700 CCCCC(C)OCC(=O)c1ccccn1 840898786ce902340b303c7201744993 [0,1,0,0,0,0|3,0,0]=4 2858 B16R1.700 CCCCC(C)OCC(=O)c1cccnc1 f79b0d55c693247c6fe06b71ceb7bedd [0,1,0,0,0,0|3,0,0]=4 2859 B16R1.700 CCCCC(O)CNC(=O)c1ccccc1 1a5e318f1109780b3f2af9051c6cb880 [0,1,0,0,0,0|1,0,0]=2 2860 B16R1.700 CCCCC(O)CNC(=O)c1ccccn1 f6b3f1f51ed34983019c6ca1a7863522 [0,1,0,0,0,0|2,0,0]=3 2861 B16R1.700 CCCCC(O)CNC(=O)c1cccnc1 1d4df505f4262540a473b78a968fa52a [0,1,0,0,0,0|2,0,0]=3 2862 B16R1.700 CCCCC(O)CNC(=O)c1cccnn1 f4a41ec90709d68956d4bb839e1cb523 [0,1,0,0,0,0|3,0,0]=4 2863 B16R1.700 CCCCC(O)CNC(=O)c1ccncc1 f05a164b52dcb8888eb2c8a07b29a8ae [0,1,0,0,0,0|2,0,0]=3 2864 B16R1.700 CCCCC(O)CNC(=O)c1ccncn1 e30fa55ebb13e89db0dc023988c8dfa2 [0,1,0,0,0,0|3,0,0]=4 2865 B16R1.700 CCCCC(O)CNC(=O)c1ccnnc1 e1b8bbe66dfb5d02426fa851c1b9a9c7 [0,1,0,0,0,0|3,0,0]=4 2866 B16R1.700 CCCCC(O)CNC(=O)c1cnccn1 66663e38ccafdbe18e18d12327a3706e [0,1,0,0,0,0|3,0,0]=4 2867 B16R1.700 CCCCC(O)CNC(=O)c1cncnc1 8edd6427244ead64859e254d66f98f4b [0,1,0,0,0,0|3,0,0]=4 2868 B16R1.700 CCCCC(O)CNC(=O)c1ncccn1 f63df1d2585813b1d71ea890511bfe02 [0,1,0,0,0,0|3,0,0]=4 2869 B16R1.700 CCCCN(C)CCS(=O)c1ccccc1 15b01da41d148b6bfed5193c02f605dc [0,1,0,0,0,0|3,0,0]=4 2870 B16R1.700 CCCCN(C)COC(=O)c1ccccc1 ad7b573e1f7d26dc4aab6685520650c2 [0,1,0,0,0,0|1,0,0]=2 2871 B16R1.700 CCCC[C@@H](C)NCC(=O)c1ccccn1 f1ce961ebf9dc788293cfd29d22b14a0 [0,1,0,0,0,0|3,0,0]=4 2872 B16R1.700 CCCC[C@@H](C)NCC(=O)c1cccnc1 55a23c8b5ce004d5b5c80859fc04a357 [0,1,0,0,0,0|3,0,0]=4 2873 B16R1.700 CCCC[C@@H](C)OCC(=O)c1ccccn1 821bafb1c7782f11216fb023ca7f9394 [0,1,0,0,0,0|3,0,0]=4 2874 B16R1.700 CCCC[C@@H](C)OCC(=O)c1cccnc1 01cf2fdd07cb4d81dd816e61dc0a48a0 [0,1,0,0,0,0|3,0,0]=4 2875 B16R1.700 CCCC[C@H](C)OCC(=O)c1ccccn1 5b8dffa1e9e6b7a40f2ad1b67297dbb5 [0,1,0,0,0,0|3,0,0]=4 2876 B16R1.700 CCCC[C@H](C)OCC(=O)c1cccnc1 0eabb4ba7624ad3e211daf11e3ed055d [0,1,0,0,0,0|3,0,0]=4 2877 B16R1.700 CCCNC(=O)CCC(=O)c1ccccc1 c067a8247a0a82eeee5785208bf3bc1e [0,1,0,0,0,0|2,0,1]=4 2878 B16R1.700 CCCNC(=O)CNC(=O)c1ccccc1 6e8aa8916375c887376b61e2c4a9e306 [0,1,0,0,0,0|2,0,1]=4 2879 B16R1.700 CCCOC(C)CNC(=O)c1ccccc1 c8b78f66a100737808abcf70909bd52a [0,1,0,0,0,0|2,0,0]=3 2880 B16R1.700 CCOCC(O)CNC(=O)c1ccccc1 c20a22607d04e9be5bde3a245c47311b [0,1,0,0,0,0|2,0,0]=3 2881 B16R1.700 CCOCC(O)CNC(=O)c1ccccn1 01aea002942b4d8cc4b9669eb7cae823 [0,1,0,0,0,0|3,0,0]=4 2882 B16R1.700 CCOCC(O)CNC(=O)c1cccnc1 a97654e9ed0cfb471d6acd440b1bc9ed [0,1,0,0,0,0|3,0,0]=4 2883 B16R1.700 CCOCC(O)CNC(=O)c1ccncc1 648d0df1936d0308cef436d56d496d47 [0,1,0,0,0,0|3,0,0]=4 2884 B16R1.700 CN(CCC#N)COC(=O)c1ccccc1 aca923faef825b16ce913dfd970d49b1 [0,1,0,0,0,0|2,0,1]=4 2885 B16R1.700 CN(CCCO)COC(=O)c1ccccc1 2296665dac212a37468f1f06b74accca [0,1,0,0,0,0|2,0,0]=3 2886 B16R1.700 CN(CCON)COC(=O)c1ccccc1 d4ddc42bb9574d80c03a4bf629129a5a [0,1,0,0,0,0|3,0,0]=4 2887 B16R1.700 COCCC(C)OCC(=O)c1ccccc1 9939c0a6fbf53fae1cfdea3ff3d52930 [0,1,0,0,0,0|3,0,0]=4 2888 B16R1.700 COCCN(C)COC(=O)c1ccccc1 50a8dc5e199909586ec110a70f4b6175 [0,1,0,0,0,0|2,0,0]=3 2889 B16R1.700 COCOC(C)CNC(=O)c1ccccc1 3abd1664d02b169fcf11d8be764ae667 [0,1,0,0,0,0|3,0,0]=4 2890 B16R1.700 CSCCC(C)OCC(=O)c1ccccc1 ef6d7f93c857cc237bc5b866f447f12b [0,1,0,0,0,0|3,0,0]=4 2891 B16R1.700 CSCCN(C)COC(=O)c1ccccc1 b59b60c3c0a3ddd027fa3028fb094d72 [0,1,0,0,0,0|2,0,0]=3 2892 B16R1.700 CSCOC(C)CNC(=O)c1ccccc1 7ab3e193416e543b88812b8407a4be4f [0,1,0,0,0,0|3,0,0]=4 2893 B16R1.700 C[C@H](CCCO)CNC(=O)c1ccccc1 d33aa8e793f62de6d0cb846d0fccba77 [0,1,0,0,0,0|2,0,0]=3 2894 B16R1.700 C[C@H](CCCO)CNC(=O)c1ccccn1 984876d445de1e74f82049efd76eac72 [0,1,0,0,0,0|3,0,0]=4 2895 B16R1.700 C[C@H](CCCO)CNC(=O)c1cccnc1 494bfc56209c2e572750eca826c115d0 [0,1,0,0,0,0|3,0,0]=4 2896 B16R1.700 C[C@H](CCCO)CNC(=O)c1ccncc1 9f277e48a806278c0f46158e6d28bbf6 [0,1,0,0,0,0|3,0,0]=4 2897 B16R1.700 C[C@H](CCCO)NCC(=O)c1ccccc1 20d336aa2c3561c22629f3acb5f65bc5 [0,1,0,0,0,0|3,0,0]=4 2898 B16R1.705 C=C(C(=O)NCCCCC)c1ccccc1 42a8c43000e81524db8ced10e7d36eaf [0,1,0,0,0,0|3,0,0]=4 2899 B16R1.705 C=CCCCCN(C)C(=O)c1ccccc1 65e710644020996744e3b16b595f40f8 [0,1,0,0,0,0|1,0,2]=4 2900 B16R1.705 CCCCCCN(C)C(=O)c1ccccc1 e8d314c6d3ea3ab3891b7f1005bf2ac0 [0,1,0,0,0,0|1,0,0]=2 2901 B16R1.705 CCCCCCN(C)C(=O)c1ccccn1 06c935edbee1c0a601e29cb9a5416093 [0,1,0,0,0,0|2,0,0]=3 2902 B16R1.705 CCCCCCN(C)C(=O)c1cccnc1 f8faf15c4d5294c1ed916b817b65a845 [0,1,0,0,0,0|2,0,0]=3 2903 B16R1.705 CCCCCCN(C)C(=O)c1cccnn1 99dedab19be06fa3fdbb90799364f8af [0,1,0,0,0,0|3,0,0]=4 2904 B16R1.705 CCCCCCN(C)C(=O)c1ccncc1 db0d7489a1635e45bf13da879fdc33aa [0,1,0,0,0,0|2,0,0]=3 2905 B16R1.705 CCCCCCN(C)C(=O)c1ccncn1 181f78c211f3ca47e3be6de7239d7c25 [0,1,0,0,0,0|3,0,0]=4 2906 B16R1.705 CCCCCCN(C)C(=O)c1ccnnc1 b90050db14a9acb0e9c3f2cfc79e0095 [0,1,0,0,0,0|3,0,0]=4 2907 B16R1.705 CCCCCCN(C)C(=O)c1cnccn1 e701475c61fc4feb15ffc93674098c07 [0,1,0,0,0,0|3,0,0]=4 2908 B16R1.705 CCCCCCN(C)C(=O)c1cncnc1 73a78a5986e70c3505ccc08e5c3958d5 [0,1,0,0,0,0|3,0,0]=4 2909 B16R1.705 CCCCCCN(C)C(=O)c1ncccn1 a8413cec56bf22d5644ad80a49b5e61c [0,1,0,0,0,0|3,0,0]=4 2910 B16R1.705 CCCCCNC(=O)C(=O)c1ccccc1 ec4c4f741c88068665ada4aadf591d5d [0,1,0,0,0,0|2,0,0]=3 2911 B16R1.705 CCCCCNC(=O)C(=O)c1cccnc1 ed7f34559e26a9b8b4fd5a2798dfc664 [0,1,0,0,0,0|3,0,0]=4 2912 B16R1.705 CCOCCNC(=O)C(=O)c1ccccc1 ead399218aaa735b8c911be227438814 [0,1,0,0,0,0|3,0,0]=4 2913 B16R1.705 CCSCCNC(=O)C(=O)c1ccccc1 8a66833fe936c96c698a137f1e3c2544 [0,1,0,0,0,0|3,0,0]=4 2914 B16R1.705 CN(CCCCCO)C(=O)c1ccccc1 e64bd6ad6bc3f922c8c35be71b356edd [0,1,0,0,0,0|2,0,0]=3 2915 B16R1.705 CN(CCCCCO)C(=O)c1ccccn1 9027b9a5794d5f9edd0d996bb42e5e9a [0,1,0,0,0,0|3,0,0]=4 2916 B16R1.705 CN(CCCCCO)C(=O)c1cccnc1 4bbd120c9fc40001f02d27c4a421d486 [0,1,0,0,0,0|3,0,0]=4 2917 B16R1.705 CN(CCCCCO)C(=O)c1ccncc1 3582b12814af214bb50efef1c338c197 [0,1,0,0,0,0|3,0,0]=4 2918 B16R1.705 CN(CCOCCO)C(=O)c1ccccc1 3242a7e2b484310796fa78b086fe974e [0,1,0,0,0,0|3,0,0]=4 2919 B16R1.705 COCCCCN(C)C(=O)c1ccccc1 41dfe4f1ffe37734a24043a666345811 [0,1,0,0,0,0|2,0,0]=3 2920 B16R1.705 COCCCCN(C)C(=O)c1ccccn1 328d4b3100bd6add8bd6a9370a78f7ba [0,1,0,0,0,0|3,0,0]=4 2921 B16R1.705 COCCCCN(C)C(=O)c1cccnc1 6ee091b7680295924463d70980b12d1c [0,1,0,0,0,0|3,0,0]=4 2922 B16R1.705 COCCCCN(C)C(=O)c1ccncc1 e3d606199f8e16a80fca671de1a89dd0 [0,1,0,0,0,0|3,0,0]=4 2923 B16R1.705 COCCCNC(=O)C(=O)c1ccccc1 bd9ce7ad9ca16a6cb12e3f6c6585c7e9 [0,1,0,0,0,0|3,0,0]=4 2924 B16R1.705 CSCCCNC(=O)C(=O)c1ccccc1 e8dc0ae9bd5ba819c7ef82101b6e47eb [0,1,0,0,0,0|3,0,0]=4 2925 B16R1.705 O=C(NCCCCCl)C(=O)c1ccccc1 70e0efb31c0c60ae183215e8fb4cd4d1 [0,1,0,0,0,0|3,0,0]=4 2926 B16R1.705 O=C(NCCCCO)C(=O)c1ccccc1 40193a75e6cf21f876b2b54e6707318e [0,1,0,0,0,0|3,0,0]=4 2927 B16R1.705 O=C(NCCCCS)C(=O)c1ccccc1 7c73d181558053d91fa1b0fcf592f539 [0,1,0,0,0,0|3,0,0]=4 2928 B16R1.929 C#CCN(C)CCOC(=O)c1ccccc1 e69dbfd6cb006a30238ff4b4b3932582 [0,1,0,0,0,0|1,0,2]=4 2929 B16R1.929 C/C=C/C(C)OCOC(=O)c1ccccc1 781da489949d97678fec6115d44e1f6d [0,1,0,0,0,0|1,0,2]=4 2930 B16R1.929 C=C(COCC(C)CCC)c1ccccc1 21ce9f14591df51bb66d7635176b30a0 [0,1,0,0,0,0|3,0,0]=4 2931 B16R1.929 C=CCN(C)CCOC(=O)c1ccccc1 b472081150426d690ba99a5091876533 [0,1,0,0,0,0|1,0,2]=4 2932 B16R1.929 CC#CC(C)OCOC(=O)c1ccccc1 79f412a3c8441521d68102556a42eb49 [0,1,0,0,0,0|1,0,2]=4 2933 B16R1.929 CC(CC#N)NCOC(=O)c1ccccc1 17f9933a2472d33c63a503f4c2132f22 [0,1,0,0,0,0|2,0,1]=4 2934 B16R1.929 CC(CCO)CNCC(=O)c1ccccc1 cba9e7e555cc99c6585a305f1b20388d [0,1,0,0,0,0|3,0,0]=4 2935 B16R1.929 CC(CCO)NCOC(=O)c1ccccc1 b3bb953affd6641f0f457a280f74829b [0,1,0,0,0,0|2,0,0]=3 2936 B16R1.929 CC=CC(C)OCOC(=O)c1ccccc1 da5a0e515f7494577cea01105498586c [0,1,0,0,0,0|1,0,2]=4 2937 B16R1.929 CCCC(=O)CNCC(=O)c1ccccc1 333a5c6de74dcaff2aa7fd920ace3fb7 [0,1,0,0,0,0|2,0,1]=4 2938 B16R1.929 CCCC(=O)COCC(=O)c1ccccc1 61eb5860f2e0571e890429e99475f32f [0,1,0,0,0,0|2,0,1]=4 2939 B16R1.929 CCCC(=S)OCCC(=O)c1ccccc1 cd8091d1fdd16a2eae8a9ba6a9880af5 [0,1,0,0,0,0|2,0,1]=4 2940 B16R1.929 CCCC(=S)OCOC(=O)c1ccccc1 92c5160bc16aa034ccc0fc45a84aa6b9 [0,1,0,0,0,0|1,0,1]=3 2941 B16R1.929 CCCC(C)CNCC(=O)c1ccccc1 99a48a5863cbbbcc8760588a4844bee0 [0,1,0,0,0,0|2,0,0]=3 2942 B16R1.929 CCCC(C)COCC(=O)c1ccccc1 50230c4307b6cba90a8363d78e7010f8 [0,1,0,0,0,0|2,0,0]=3 2943 B16R1.929 CCCC(C)COCC(=O)c1ccccn1 b30841cb553e8db4f0e2068cb74b0a2e [0,1,0,0,0,0|3,0,0]=4 2944 B16R1.929 CCCC(C)COCC(=O)c1cccnc1 522af193213ed2242861fc46456ca83b [0,1,0,0,0,0|3,0,0]=4 2945 B16R1.929 CCCC(C)NCOC(=O)c1ccccc1 04714900d1b9d5eaa664c24c00d648c7 [0,1,0,0,0,0|1,0,0]=2 2946 B16R1.929 CCCC(C)OCCC(=O)c1ccccc1 e66d097195888ddbddf9e89c1babdbfe [0,1,0,0,0,0|2,0,0]=3 2947 B16R1.929 CCCC(C)OCNC(=O)c1ccccc1 1369ab641432912947c9a093b97cb609 [0,1,0,0,0,0|2,0,0]=3 2948 B16R1.929 CCCC(C)OCNC(=O)c1cccnc1 3aa90b7d028de8edad6f95349cd33901 [0,1,0,0,0,0|3,0,0]=4 2949 B16R1.929 CCCC(O)CNCC(=O)c1ccccc1 b831318ba72ac4def0d6d85e8e6cfc24 [0,1,0,0,0,0|2,0,0]=3 2950 B16R1.929 CCCC(O)CNCC(=O)c1ccccn1 d1a468d8bda7c95273aeaa0a00dcc6a9 [0,1,0,0,0,0|3,0,0]=4 2951 B16R1.929 CCCC(O)CNCC(=O)c1cccnc1 68ccc5dd5fd92843ebaa38af579f609e [0,1,0,0,0,0|3,0,0]=4 2952 B16R1.929 CCCN(C)CCNC(=O)c1ccccn1 0ee51f8e83cdd464c4198c007d74b89d [0,1,0,0,0,0|3,0,0]=4 2953 B16R1.929 CCCN(C)CCOC(=O)c1ccccc1 c6c55cb482468d2925817c494bd01c2c [0,1,0,0,0,0|1,0,0]=2 2954 B16R1.929 CCC[C@H](C)NCOC(=O)c1ccccc1 3ca6d89219b42c5717a38389c489da59 [0,1,0,0,0,0|1,0,0]=2 2955 B16R1.929 CCOC(=O)CCNC(=O)c1ccccc1 fa4a5e573911103ddb48640db5e59dbb [0,1,0,0,0,0|2,0,1]=4 2956 B16R1.929 CCOC(C)CNCC(=O)c1ccccc1 4370eb6ff405f20607d04a6ef7b02738 [0,1,0,0,0,0|3,0,0]=4 2957 B16R1.929 CCOC(C)COCC(=O)c1ccccc1 8b0fc024251c02052a5804369592e248 [0,1,0,0,0,0|3,0,0]=4 2958 B16R1.929 CN(CC#N)CCOC(=O)c1ccccc1 e901e83c82833d40f9d046af5cea441e [0,1,0,0,0,0|2,0,1]=4 2959 B16R1.929 CN(CCF)CCOC(=O)c1ccccc1 19c1f74c3aa3694a9c2be8c7639fcf6c [0,1,0,0,0,0|2,0,0]=3 2960 B16R1.929 CN(CCO)CCNC(=O)c1ccccc1 a3bf5151cb4c0631e0479c689d90ff8e [0,1,0,0,0,0|3,0,0]=4 2961 B16R1.929 CN(CCO)CCOC(=O)c1ccccc1 6452deeec17a8b355688213f0fe69359 [0,1,0,0,0,0|2,0,0]=3 2962 B16R1.929 COCC(C)COCC(=O)c1ccccc1 2373b0cef1a23d9556948d397e42f344 [0,1,0,0,0,0|3,0,0]=4 2963 B16R1.929 COCC(C)NCOC(=O)c1ccccc1 ce50fb70f518d5eaf20f0f55fd9bfc76 [0,1,0,0,0,0|2,0,0]=3 2964 B16R1.929 COCC(C)OCCC(=O)c1ccccc1 0b7728fd43ae84e5b976fc5a061d24b5 [0,1,0,0,0,0|3,0,0]=4 2965 B16R1.929 COCC(C)OCNC(=O)c1ccccc1 d77cd69c9f4b3268de0506dc25e1028b [0,1,0,0,0,0|3,0,0]=4 2966 B16R1.929 COCC(C)OCOC(=O)c1ccccc1 80eddd871065e49fdfb07a15b9368c2c [0,1,0,0,0,0|2,0,0]=3 2967 B16R1.929 COCC(O)CNCC(=O)c1ccccc1 5ff3a5f7b242762dcab365c398252403 [0,1,0,0,0,0|3,0,0]=4 2968 B16R1.929 COC[C@@H](C)NCOC(=O)c1ccccc1 257bdf70322e1701dbe0291e7f1a46d0 [0,1,0,0,0,0|2,0,0]=3 2969 B16R1.929 COC[C@@H](C)OCOC(=O)c1ccccc1 7c6847889be52818d0fda6177a36b961 [0,1,0,0,0,0|2,0,0]=3 2970 B16R1.929 COC[C@@H](O)CNCC(=O)c1ccccc1 80d35ca8913d22010f6b7aad157743e4 [0,1,0,0,0,0|3,0,0]=4 2971 B16R1.929 COC[C@H](C)COCC(=O)c1ccccc1 33ff5da8580928753e7d08a3109e071e [0,1,0,0,0,0|3,0,0]=4 2972 B16R1.929 COC[C@H](C)NCOC(=O)c1ccccc1 99bc9d166f58d1a0baf6377ed882028c [0,1,0,0,0,0|2,0,0]=3 2973 B16R1.929 COC[C@H](C)OCOC(=O)c1ccccc1 1542f70baf07a5657565aae16c45943d [0,1,0,0,0,0|2,0,0]=3 2974 B16R1.929 CSCC(C)OCOC(=O)c1ccccc1 8bd9d19b99030ff5969ae723e90fb5dd [0,1,0,0,0,0|2,0,0]=3 2975 B16R1.929 C[C@@H](CCO)NCOC(=O)c1ccccc1 99887bb002e05f59e5be230eaf9b00ab [0,1,0,0,0,0|2,0,0]=3 2976 B16R1.929 C[C@H](CCO)NCOC(=O)c1ccccc1 8f4265a9fbf4a012dcdd40db18142896 [0,1,0,0,0,0|2,0,0]=3 2977 B16R1.929 O=C(CNC[C@@H](O)CCO)c1ccccc1 0afc47fd5ebb776039570cc52a53fe56 [0,1,0,0,0,0|3,0,0]=4 2978 B16R1.929 O=C(COC[C@@H](O)CCO)c1ccccc1 0b47810ca3fa3d30c341daa3759fa39e [0,1,0,0,0,0|3,0,0]=4 2979 B16R1.1132 C#CC(C)NCCOC(=O)c1ccccc1 a556009da45e44b6c1221f68f98f637e [0,1,0,0,0,0|1,0,2]=4 2980 B16R1.1132 C#CC(C)OCCOC(=O)c1ccccc1 446de061c2e2aeeac676bba6325b1fae [0,1,0,0,0,0|1,0,2]=4 2981 B16R1.1132 C#C[C@@H](C)NCCOC(=O)c1ccccc1 d23b5dfc396fbd41bdf1ea124289126e [0,1,0,0,0,0|1,0,2]=4 2982 B16R1.1132 C#C[C@@H](C)OCCOC(=O)c1ccccc1 c140fede952ef4be4bdc7e090663e614 [0,1,0,0,0,0|1,0,2]=4 2983 B16R1.1132 C#C[C@H](C)NCCOC(=O)c1ccccc1 0c633be445e47ca9c19c47176d1f68e6 [0,1,0,0,0,0|1,0,2]=4 2984 B16R1.1132 C#C[C@H](C)OCCOC(=O)c1ccccc1 4be3eb51e9ff803bf82b7d2a40c6e7d1 [0,1,0,0,0,0|1,0,2]=4 2985 B16R1.1132 C=C(CC)COCCC(=O)c1ccccc1 0d37552a2caf2f5062c6fb282d7044c8 [0,1,0,0,0,0|2,0,1]=4 2986 B16R1.1132 C=C(CC)COCNC(=O)c1ccccc1 15bbee34b9b5d9c3cee9e0d9191bf38b [0,1,0,0,0,0|2,0,1]=4 2987 B16R1.1132 C=C(COCCC(C)CC)c1ccccc1 8c34072a0150f072567e4704f06009a7 [0,1,0,0,0,0|3,0,0]=4 2988 B16R1.1132 C=C(COCCC(S)CC)c1ccccc1 d12f631c0c3f79f75d2c0aef3d2094d5 [0,1,0,0,0,0|3,0,0]=4 2989 B16R1.1132 C=C(COCC[C@@H](C)CC)c1ccccc1 10a3e9a3315ba7720cea310bcabdeadf [0,1,0,0,0,0|3,0,0]=4 2990 B16R1.1132 C=CC(C)COCOC(=O)c1ccccc1 55dfd0a91e3211b02510f1dd1ce7151a [0,1,0,0,0,0|1,0,2]=4 2991 B16R1.1132 C=CC(C)NCCOC(=O)c1ccccc1 921761cc40887653649fcf256c02750e [0,1,0,0,0,0|1,0,2]=4 2992 B16R1.1132 C=CC(C)OCCOC(=O)c1ccccc1 c7acf6182d05ca06163c17964730d4c0 [0,1,0,0,0,0|1,0,2]=4 2993 B16R1.1132 C=CC(O)CNCOC(=O)c1ccccc1 68a4c7d65a065a622713eefb1c258ecc [0,1,0,0,0,0|1,0,2]=4 2994 B16R1.1132 C=C[C@H](C)OCCOC(=O)c1ccccc1 8d6031924b512634ed5ecf3daefdc889 [0,1,0,0,0,0|1,0,2]=4 2995 B16R1.1132 CC(C#N)CNCOC(=O)c1ccccc1 f4a24aba85692fbc3492733f38c12bdc [0,1,0,0,0,0|2,0,1]=4 2996 B16R1.1132 CC(C#N)COCOC(=O)c1ccccc1 8bfe1a63b3e87ff4c46cef03d602ea78 [0,1,0,0,0,0|2,0,1]=4 2997 B16R1.1132 CC(C#N)NCCOC(=O)c1ccccc1 469ac513d5b6281a12309626231c2bc7 [0,1,0,0,0,0|2,0,1]=4 2998 B16R1.1132 CC(C#N)OCCOC(=O)c1ccccc1 60d21fc1ac8e9563d28978c7bfcd5842 [0,1,0,0,0,0|2,0,1]=4 2999 B16R1.1132 CC(C=O)OCCOC(=O)c1ccccc1 406b305327ccdec881d88af044ee6536 [0,1,0,0,0,0|2,0,1]=4 3000 B16R1.1132 CC(CF)OCCOC(=O)c1ccccc1 4c98552003695ada3770bd075f2aa758 [0,1,0,0,0,0|2,0,0]=3 3001 B16R1.1132 CC(CO)CCCNC(=O)c1ccccc1 d77b5ad413326d374d3aafd457f34ad2 [0,1,0,0,0,0|2,0,0]=3 3002 B16R1.1132 CC(CO)CCCNC(=O)c1ccccn1 7384c01dd1a3e59747ce527a6b36ac87 [0,1,0,0,0,0|3,0,0]=4 3003 B16R1.1132 CC(CO)CCCNC(=O)c1cccnc1 987e0418221d7fa1d1287d146a61a7ec [0,1,0,0,0,0|3,0,0]=4 3004 B16R1.1132 CC(CO)CCCNC(=O)c1ccncc1 37a48f40b5c62c5ed32e1369ac25773a [0,1,0,0,0,0|3,0,0]=4 3005 B16R1.1132 CC(CO)CCNCC(=O)c1ccccc1 d8d65b871e9a70b849ec5647a8a6d04c [0,1,0,0,0,0|3,0,0]=4 3006 B16R1.1132 CC(CO)CNCOC(=O)c1ccccc1 92a65a3bfc2d0318465e54db6133ad70 [0,1,0,0,0,0|2,0,0]=3 3007 B16R1.1132 CC(CO)NCCNC(=O)c1ccccc1 c0e9c1787ff2332fe335b183dee7b985 [0,1,0,0,0,0|3,0,0]=4 3008 B16R1.1132 CC(CO)NCCOC(=O)c1ccccc1 6c31180e1c2e77f129bb8ed2332f5530 [0,1,0,0,0,0|2,0,0]=3 3009 B16R1.1132 CCC(=O)COCCC(=O)c1ccccc1 89df7d128714b0130fa178577a663441 [0,1,0,0,0,0|2,0,1]=4 3010 B16R1.1132 CCC(=O)COCNC(=O)c1ccccc1 a9008c15782bb81f7de1095e9b5023cc [0,1,0,0,0,0|2,0,1]=4 3011 B16R1.1132 CCC(=O)COCOC(=O)c1ccccc1 e1e973a27997173bddd8d6a57247d8ce [0,1,0,0,0,0|1,0,1]=3 3012 B16R1.1132 CCC(=O)NCCNC(=O)c1ccccc1 d7b00978eea95b84a7a0e604dc756af2 [0,1,0,0,0,0|2,0,1]=4 3013 B16R1.1132 CCC(C)CCNCC(=O)c1ccccc1 6cefd14a0f234b2d59913f460ed05577 [0,1,0,0,0,0|2,0,0]=3 3014 B16R1.1132 CCC(C)CCNCC(=O)c1ccccn1 8992ec832b764f4ad5c244d4420e54ba [0,1,0,0,0,0|3,0,0]=4 3015 B16R1.1132 CCC(C)CCNCC(=O)c1cccnc1 f162b9fd0499710a675d98d9aebd5467 [0,1,0,0,0,0|3,0,0]=4 3016 B16R1.1132 CCC(C)CCOCC(=O)c1ccccc1 a57f52a2512f6fe56fc341ab75d544dc [0,1,0,0,0,0|2,0,0]=3 3017 B16R1.1132 CCC(C)CCOCC(=O)c1ccccn1 4fbebac7ff8481d0f9f84ad7362242b5 [0,1,0,0,0,0|3,0,0]=4 3018 B16R1.1132 CCC(C)CCOCC(=O)c1cccnc1 c7b78e3ed661d408678d4800512d3c54 [0,1,0,0,0,0|3,0,0]=4 3019 B16R1.1132 CCC(C)CNCOC(=O)c1ccccc1 3ca938f051cb39374b99547a3d7b0c2d [0,1,0,0,0,0|1,0,0]=2 3020 B16R1.1132 CCC(C)COCCC(=O)c1ccccc1 07d8be8107b66246074240b07d790a7a [0,1,0,0,0,0|2,0,0]=3 3021 B16R1.1132 CCC(C)COCCS(=O)c1ccccc1 578851bbf2dede37393b243855492eb4 [0,1,0,0,0,0|3,0,0]=4 3022 B16R1.1132 CCC(C)COCNC(=O)c1ccccc1 5d9aa8f058caf38f1fcae11cd9120ee1 [0,1,0,0,0,0|2,0,0]=3 3023 B16R1.1132 CCC(C)COCNC(=O)c1cccnc1 f4f59caa6a1b1ed2387c44b641fa0e58 [0,1,0,0,0,0|3,0,0]=4 3024 B16R1.1132 CCC(C)COCOC(=O)c1ccccc1 299feb1d3d487c1e6e815878c6325453 [0,1,0,0,0,0|1,0,0]=2 3025 B16R1.1132 CCC(C)NCCNC(=O)c1ccccn1 ecd3a9a70431b21205d048fd5b370027 [0,1,0,0,0,0|3,0,0]=4 3026 B16R1.1132 CCC(C)NCCNC(=O)c1ccncc1 bc2d6a5598efdc71fcffee2f62b6f381 [0,1,0,0,0,0|3,0,0]=4 3027 B16R1.1132 CCC(C)NCCOC(=O)c1ccccc1 c2beee370af0c8d035a5079fa3b15df5 [0,1,0,0,0,0|1,0,0]=2 3028 B16R1.1132 CCC(C)OCCCC(=O)c1ccccc1 267b1174f83957e5701719802bd80f71 [0,1,0,0,0,0|2,0,0]=3 3029 B16R1.1132 CCC(C)OCCCC(=O)c1cccnc1 c379b4046c3256766cb7a91336eb5c1e [0,1,0,0,0,0|3,0,0]=4 3030 B16R1.1132 CCC(C)OCCNC(=O)c1ccccc1 22a2b341efdf9ec8eaa7dc77ca1362c4 [0,1,0,0,0,0|2,0,0]=3 3031 B16R1.1132 CCC(C)OCCNC(=O)c1ccccn1 8b8d34506024aa1b196fa39081afcb8e [0,1,0,0,0,0|3,0,0]=4 3032 B16R1.1132 CCC(C)OCCNC(=O)c1cccnc1 844ee9b7e611ffc4a66f6035dd1a4cb0 [0,1,0,0,0,0|3,0,0]=4 3033 B16R1.1132 CCC(C)OCCNC(=O)c1ccncc1 290bdb8fe51d05ffca628e201fa32227 [0,1,0,0,0,0|3,0,0]=4 3034 B16R1.1132 CCC(C)OCCOC(=O)c1ccccc1 d4d8aaba16c63f31ac3a9eab2b5b158b [0,1,0,0,0,0|1,0,0]=2 3035 B16R1.1132 CCC(C)OCCOC(=O)c1cccnc1 2b80629820b07697dd1642c2b4f4860d [0,1,0,0,0,0|2,0,0]=3 3036 B16R1.1132 CCC(O)CNCOC(=O)c1ccccc1 1e74395b12f03d2c713a98ca2c16aaec [0,1,0,0,0,0|1,0,0]=2 3037 B16R1.1132 CCC(S)CCOCC(=O)c1ccccc1 1c106caf9a7fdb53f49a024d3e5084c2 [0,1,0,0,0,0|2,0,0]=3 3038 B16R1.1132 CCC(S)CCOCC(=O)c1ccccn1 28f13889d913179194efaffd45068656 [0,1,0,0,0,0|3,0,0]=4 3039 B16R1.1132 CCC(S)CCOCC(=O)c1cccnc1 677f4775c5462b474f5261f162d5bada [0,1,0,0,0,0|3,0,0]=4 3040 B16R1.1132 CCN(C)CCCNC(=O)c1ccccc1 80e93aa66060c8d97875b61d412a6e75 [0,1,0,0,0,0|2,0,0]=3 3041 B16R1.1132 CCN(C)CCCNC(=O)c1ccccn1 3b87353240e3985609dc11a8df700ab1 [0,1,0,0,0,0|3,0,0]=4 3042 B16R1.1132 CCN(C)CCCNC(=O)c1cccnc1 cd78de8eca17ded2161702ac13060a2f [0,1,0,0,0,0|3,0,0]=4 3043 B16R1.1132 CCN(C)CCCNC(=O)c1ccncc1 ba7e3bc0938593e7cdfc2f93af1c4c9a [0,1,0,0,0,0|3,0,0]=4 3044 B16R1.1132 CCS(=O)CCNCC(=O)c1ccccc1 2152237248b05240d140389260970fd6 [0,1,0,0,0,0|3,0,0]=4 3045 B16R1.1132 CCS(=O)CCOCC(=O)c1ccccc1 fef21d998eefbdc3cc14cf3d1fa96e2c [0,1,0,0,0,0|3,0,0]=4 3046 B16R1.1132 CC[C@@H](C)COCCC(=O)c1ccccc1 c12a152e51b0d00fea11612479a357ca [0,1,0,0,0,0|2,0,0]=3 3047 B16R1.1132 CC[C@@H](C)COCCS(=O)c1ccccc1 f2dac5ea75bab447d375f6246185a405 [0,1,0,0,0,0|3,0,0]=4 3048 B16R1.1132 CC[C@@H](C)COCNC(=O)c1ccccc1 a3e9d0b22121f6fd0d68a08a1ec31314 [0,1,0,0,0,0|2,0,0]=3 3049 B16R1.1132 CC[C@@H](C)COCNC(=O)c1cccnc1 6ef539dd9c142e14a8cb9c909c581fd8 [0,1,0,0,0,0|3,0,0]=4 3050 B16R1.1132 CC[C@@H](C)COCOC(=O)c1ccccc1 1d8234231b62a2feb96427311cb4cf3c [0,1,0,0,0,0|1,0,0]=2 3051 B16R1.1132 CC[C@@H](C)NCCNC(=O)c1ccccn1 6651afcdb9c22f638bad379cb08ce88f [0,1,0,0,0,0|3,0,0]=4 3052 B16R1.1132 CC[C@@H](C)NCCOC(=O)c1ccccc1 d85b2a162014ced5894cca2064f34970 [0,1,0,0,0,0|1,0,0]=2 3053 B16R1.1132 CC[C@@H](C)OCCNC(=O)c1ccccn1 93ee1a7fcdf5ee078867b7272185446f [0,1,0,0,0,0|3,0,0]=4 3054 B16R1.1132 CC[C@@H](C)OCCOC(=O)c1ccccc1 4f3f14babdef46a9a13d40d8611a9bd3 [0,1,0,0,0,0|1,0,0]=2 3055 B16R1.1132 CC[C@@H](O)CNCOC(=O)c1ccccc1 fb0db422b18823072013bc8aca0c0dfd [0,1,0,0,0,0|1,0,0]=2 3056 B16R1.1132 CC[C@H](C)CCOCC(=O)c1ccccc1 51ed3aa441867ea96802a338dfeb9e3a [0,1,0,0,0,0|2,0,0]=3 3057 B16R1.1132 CC[C@H](C)CCOCC(=O)c1ccccn1 4dc3e561c408886b64ac13b24b10f9a1 [0,1,0,0,0,0|3,0,0]=4 3058 B16R1.1132 CC[C@H](C)CCOCC(=O)c1cccnc1 0f10d93b7b80c521f46c0b3c285bfeb1 [0,1,0,0,0,0|3,0,0]=4 3059 B16R1.1132 CC[C@H](C)CNCOC(=O)c1ccccc1 4e679a41896475ddaafab58208a31b42 [0,1,0,0,0,0|1,0,0]=2 3060 B16R1.1132 CC[C@H](C)COCCC(=O)c1ccccc1 ba9894558f2ec2f923e6c6f5d7c36119 [0,1,0,0,0,0|2,0,0]=3 3061 B16R1.1132 CC[C@H](C)COCCS(=O)c1ccccc1 af70b049441215ab2b2dea3269b792a3 [0,1,0,0,0,0|3,0,0]=4 3062 B16R1.1132 CC[C@H](C)COCNC(=O)c1ccccc1 4ba0bf1130b8617df36b1b5ef8fb5e7a [0,1,0,0,0,0|2,0,0]=3 3063 B16R1.1132 CC[C@H](C)COCNC(=O)c1cccnc1 0d8cf161bd95717d02b9801f6f0a9b91 [0,1,0,0,0,0|3,0,0]=4 3064 B16R1.1132 CC[C@H](C)COCOC(=O)c1ccccc1 4ff89e7fe9c63642aae6c0001f928155 [0,1,0,0,0,0|1,0,0]=2 3065 B16R1.1132 CC[C@H](C)NCCNC(=O)c1ccccn1 948620453ed7dbc46887db65fa79af24 [0,1,0,0,0,0|3,0,0]=4 3066 B16R1.1132 CC[C@H](C)NCCOC(=O)c1ccccc1 6ce09785978c36cb97b1f1c77bd04794 [0,1,0,0,0,0|1,0,0]=2 3067 B16R1.1132 CC[C@H](C)OCCNC(=O)c1ccccn1 161fca916f6c0a308f50062db7c72f37 [0,1,0,0,0,0|3,0,0]=4 3068 B16R1.1132 CC[C@H](C)OCCOC(=O)c1ccccc1 b9faef9a837b5cefc3da8a7599ae0bfd [0,1,0,0,0,0|1,0,0]=2 3069 B16R1.1132 CNC(=O)CNCOC(=O)c1ccccc1 39b83211a382a28f7f6982d01ba4d961 [0,1,0,0,0,0|2,0,1]=4 3070 B16R1.1132 CNC(=O)COCOC(=O)c1ccccc1 1ea5208ac52307aee9c380e4e11bdf3a [0,1,0,0,0,0|2,0,1]=4 3071 B16R1.1132 COC(=O)CCCNC(=O)c1ccccc1 b9c3ae4542a8b673178a2fed9047e1c1 [0,1,0,0,0,0|2,0,1]=4 3072 B16R1.1132 COC(=O)CNCOC(=O)c1ccccc1 c4328718ee191e6ca5849d66e21f82af [0,1,0,0,0,0|2,0,1]=4 3073 B16R1.1132 COC(=O)COCOC(=O)c1ccccc1 ddf6bf4c5389efc8a94c20720af045e5 [0,1,0,0,0,0|2,0,1]=4 3074 B16R1.1132 COC(C)CCOCC(=O)c1ccccc1 798d7878aadae1d4e97bde86491a3bd0 [0,1,0,0,0,0|3,0,0]=4 3075 B16R1.1132 COC(C)COCCC(=O)c1ccccc1 ac62b6ac01f2db7489b155a0a0e73848 [0,1,0,0,0,0|3,0,0]=4 3076 B16R1.1132 COC(C)COCNC(=O)c1ccccc1 a2890d124ebd1c1ca3193efbcf056c1a [0,1,0,0,0,0|3,0,0]=4 3077 B16R1.1132 COC(C)COCOC(=O)c1ccccc1 dcdab182bea726f7b8a16a645c4d5088 [0,1,0,0,0,0|2,0,0]=3 3078 B16R1.1132 CO[C@@H](C)CNCOC(=O)c1ccccc1 84063c45966a7d807013f307c5d30fce [0,1,0,0,0,0|2,0,0]=3 3079 B16R1.1132 CO[C@@H](C)COCCC(=O)c1ccccc1 7d7e2a4a1f3a677e3c4df8adc834f543 [0,1,0,0,0,0|3,0,0]=4 3080 B16R1.1132 CO[C@@H](C)COCNC(=O)c1ccccc1 decca7ddbf2edcefb63a54d7493798a3 [0,1,0,0,0,0|3,0,0]=4 3081 B16R1.1132 CO[C@@H](C)COCOC(=O)c1ccccc1 9f8a6abf42f74adab84268762b983766 [0,1,0,0,0,0|2,0,0]=3 3082 B16R1.1132 CO[C@H](C)CNCOC(=O)c1ccccc1 24e9e9081040ee59cb9bc024d993c61b [0,1,0,0,0,0|2,0,0]=3 3083 B16R1.1132 CO[C@H](C)COCCC(=O)c1ccccc1 ff311428f8b72113c82e875acac1c88a [0,1,0,0,0,0|3,0,0]=4 3084 B16R1.1132 CO[C@H](C)COCNC(=O)c1ccccc1 6b3b4a26c24997443be4154ee27d36f1 [0,1,0,0,0,0|3,0,0]=4 3085 B16R1.1132 CO[C@H](C)COCOC(=O)c1ccccc1 169916fdac6f7366aaf4b25734d15c0d [0,1,0,0,0,0|2,0,0]=3 3086 B16R1.1132 C[C@@H](CO)CCNCC(=O)c1ccccc1 b3b433a16f0c48c8528bd76fbbe709df [0,1,0,0,0,0|3,0,0]=4 3087 B16R1.1132 C[C@@H](CO)NCCNC(=O)c1ccccc1 52cef46cdba7b49a70eb56d3193c80fd [0,1,0,0,0,0|3,0,0]=4 3088 B16R1.1132 C[C@@H](CO)NCCOC(=O)c1ccccc1 95d8bd7228479bb2dce080c75303e60a [0,1,0,0,0,0|2,0,0]=3 3089 B16R1.1132 C[C@H](C=O)OCCOC(=O)c1ccccc1 cce65fd29016d5e895a5f85bb0c77ce3 [0,1,0,0,0,0|2,0,1]=4 3090 B16R1.1132 C[C@H](CO)CNCOC(=O)c1ccccc1 806d694bfb658a327f213fa3f545d965 [0,1,0,0,0,0|2,0,0]=3 3091 B16R1.1132 C[C@H](CO)NCCNC(=O)c1ccccc1 a9d9fa5d4105dcd02ef460fd01808bfe [0,1,0,0,0,0|3,0,0]=4 3092 B16R1.1132 C[C@H](CO)NCCOC(=O)c1ccccc1 278eff12324b0b2daeed31494fb8139e [0,1,0,0,0,0|2,0,0]=3 3093 B16R1.1132 O=C(CCNCC(F)CO)c1ccccc1 1bfc09b846859ab44d5f44005b45967e [0,1,0,0,0,0|3,0,0]=4 3094 B16R1.1132 O=C(CCNC[C@@H](F)CO)c1ccccc1 9cf2be4d9c53bae5c938cc1288ef8692 [0,1,0,0,0,0|3,0,0]=4 3095 B16R1.1132 O=C(CCNC[C@H](F)CO)c1ccccc1 3fda462ec465a75213202488a19797a2 [0,1,0,0,0,0|3,0,0]=4 3096 B16R1.1132 O=C(CCOCC(O)CO)c1ccccc1 23276d944d5e852220649fc760202d02 [0,1,0,0,0,0|3,0,0]=4 3097 B16R1.1132 O=C(CCOC[C@@H](O)CO)c1ccccc1 6ef1f06d8f95ff1c16cf2518dfd6ffbf [0,1,0,0,0,0|3,0,0]=4 3098 B16R1.1132 O=C(CCOC[C@H](O)CO)c1ccccc1 3aa8f5d075bc03bb9aa96a804bb14849 [0,1,0,0,0,0|3,0,0]=4 3099 B16R1.1132 O=C(CNCCC(O)CO)c1ccccc1 95108a8a0764374e76f54be10b252458 [0,1,0,0,0,0|3,0,0]=4 3100 B16R1.1132 O=C(NCOCC(O)CO)c1ccccc1 d57dbc0182daa2495a03557629989628 [0,1,0,0,0,0|3,0,0]=4 3101 B16R1.1132 O=C(NCOC[C@@H](O)CO)c1ccccc1 760ad60aab9dc6d1fb23250eedc5a13d [0,1,0,0,0,0|3,0,0]=4 3102 B16R1.1132 O=C(NCOC[C@H](O)CO)c1ccccc1 0d73637527885d3a3fb00aa84eed8470 [0,1,0,0,0,0|3,0,0]=4 3103 B16R1.1132 O=C(OCNCC(Br)CBr)c1ccccc1 e1078f24bfe7e4cec50fa1d0523179cd [0,1,0,0,0,0|2,0,0]=3 3104 B16R1.1132 O=C(OCNCC(F)CO)c1ccccc1 0b016f5d1c3087d9d005969e29f502cb [0,1,0,0,0,0|2,0,0]=3 3105 B16R1.1132 O=C(OCNCC(O)CO)c1ccccc1 ec777b95014452d8ca64a5985db87b1d [0,1,0,0,0,0|2,0,0]=3 3106 B16R1.1132 O=C(OCNC[C@@H](F)CO)c1ccccc1 e8b5f09353d1117eb8566fec3bd44f3f [0,1,0,0,0,0|2,0,0]=3 3107 B16R1.1132 O=C(OCNC[C@@H](O)CO)c1ccccc1 7997a9bcdb4a63ce66e7c425acb9a17c [0,1,0,0,0,0|2,0,0]=3 3108 B16R1.1132 O=C(OCNC[C@H](F)CO)c1ccccc1 68adf995d8b74f91dccd30eb0d7c6ad7 [0,1,0,0,0,0|2,0,0]=3 3109 B16R1.1132 O=C(OCNC[C@H](O)CO)c1ccccc1 dde2a7d02f5faf72d1a2cce37c1301c9 [0,1,0,0,0,0|2,0,0]=3 3110 B16R1.1132 O=C(OCOCC(Br)CBr)c1ccccc1 e1bc22136545822e001dc8a0ecb6fa6e [0,1,0,0,0,0|2,0,0]=3 3111 B16R1.1132 O=C(OCOCC(Cl)CCl)c1ccccc1 266564993c74207fa930e7971eb5f477 [0,1,0,0,0,0|2,0,0]=3 3112 B16R1.1132 O=C(OCOCC(S)CS)c1ccccc1 6f2d8c2ed36737201fadbc69b663ccdc [0,1,0,0,0,0|2,0,0]=3 3113 B16R1.1201 CC(C)(OCCCCCF)c1ccccc1 4a7fdefe560a3c32a7f8983d87955dea [0,1,0,0,0,0|2,0,1]=4 3114 B16R1.1201 CCCCCCNC(C)(C)c1ccccc1 45fa06b5d7e63491291b212bec048e3a [0,1,0,0,0,0|2,0,1]=4 3115 B16R1.1201 CCCCCCOC(C)(C)c1ccccc1 9841a4cfea1ca18066b6591d6146cdd0 [0,1,0,0,0,0|1,0,1]=3 3116 B16R1.1201 CCCCCCOC(C)(C)c1ccccn1 47d28b2ea9286a53c0e8d0aaf4e75f70 [0,1,0,0,0,0|2,0,1]=4 3117 B16R1.1201 CCCCCCOC(C)(C)c1cccnc1 eab2074a1aa16ac8af212bc96fbbbe82 [0,1,0,0,0,0|2,0,1]=4 3118 B16R1.1201 CCCCCCOC(C)(C)c1ccncc1 156ff8a35401c6399b1eed46fe442e6c [0,1,0,0,0,0|2,0,1]=4 3119 B16R1.1201 CCCCCNCS(=O)(=O)c1ccccc1 3b81689d1461fc9d92f54cfd6f2007a4 [0,1,0,0,0,0|3,0,0]=4 3120 B16R1.1201 CCCCCOCS(=O)(=O)c1ccccc1 5ea517a97d4b2e8d7b2e97ddf30667b2 [0,1,0,0,0,0|3,0,0]=4 3121 B16R1.1201 CCCCNCCS(=O)(=O)c1ccccc1 763c96d7a6ecc6efc35480677c1c45df [0,1,0,0,0,0|3,0,0]=4 3122 B16R1.1201 CCCCOCCS(=O)(=O)c1ccccc1 200834beb9e8a02bb008e82d92a24628 [0,1,0,0,0,0|3,0,0]=4 3123 B16R1.1201 CCCNCCCS(=O)(=O)c1ccccc1 e0393c2ecdaa45920121628416e3d610 [0,1,0,0,0,0|3,0,0]=4 3124 B16R1.1201 CCCNCCOS(=O)(=O)c1ccccc1 d268581f2f2d192890331b365cf244d1 [0,1,0,0,0,0|2,0,0]=3 3125 B16R1.1201 CCCOCCCS(=O)(=O)c1ccccc1 b0ea3dfc1f471679ab8f1197058f4c2a [0,1,0,0,0,0|3,0,0]=4 3126 B16R1.1201 CCCOCCOC(C)(C)c1ccccc1 def367a9a057e5264de5880837a809f7 [0,1,0,0,0,0|2,0,1]=4 3127 B16R1.1201 CCCOCCOS(=O)(=O)c1ccccc1 d7c509adf1573558300c0ad276ad59e4 [0,1,0,0,0,0|2,0,0]=3 3128 B16R1.1201 CCOCCCOC(C)(C)c1ccccc1 8357a6a62d17872124567b95ece5764a [0,1,0,0,0,0|2,0,1]=4 3129 B16R1.1201 CCSCCCOC(C)(C)c1ccccc1 f85fd9d20228ba336f78a3fa2d6f1cc3 [0,1,0,0,0,0|2,0,1]=4 3130 B16R1.1201 COCCCCOC(C)(C)c1ccccc1 ff696b5ef565734f03c05e2a42e4af28 [0,1,0,0,0,0|2,0,1]=4 3131 B16R1.1201 COCOCCOS(=O)(=O)c1ccccc1 6d11fa4958deb47867ca1d541e8735d5 [0,1,0,0,0,0|3,0,0]=4 3132 B16R1.1201 CSCOCCOS(=O)(=O)c1ccccc1 b049dfae5910e16de52985baa7b2ffb3 [0,1,0,0,0,0|3,0,0]=4 3133 B16R1.1201 O=S(=O)(OCCNCCBr)c1ccccc1 82d5754d947ffe3b1016bc8b95f3da42 [0,1,0,0,0,0|3,0,0]=4 3134 B16R1.1201 O=S(=O)(OCCNCCF)c1ccccc1 c8f0b049df92081a91b821648d406e89 [0,1,0,0,0,0|3,0,0]=4 3135 B16R1.1201 O=S(=O)(OCCNCCI)c1ccccc1 ff97f2eecd8db2db461851f04d2e8848 [0,1,0,0,0,0|3,0,0]=4 3136 B16R1.1201 O=S(=O)(OCCNCCO)c1ccccc1 4bb0b655f07a7756e22102f2f839046e [0,1,0,0,0,0|3,0,0]=4 3137 B16R1.1201 O=S(=O)(OCCNCCS)c1ccccc1 dc15c698c91a45519dfc631da6f47af5 [0,1,0,0,0,0|3,0,0]=4 3138 B16R1.1201 O=S(=O)(OCCOCCF)c1ccccc1 44e83393a9aefbb00ebb18f455ab69e0 [0,1,0,0,0,0|3,0,0]=4 3139 B16R1.1201 O=S(=O)(OCCOCCS)c1ccccc1 c143d2359ec09b5cd62cb602edf78aff [0,1,0,0,0,0|3,0,0]=4 3140 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Br 33dd29c06a00c96ddc89f8c89ce6e101 [0,1,0,0,0,0|1,0,2]=4 3141 B16R1.7596 C#CCCCCNC(=O)c1ccccc1C a15b07e86fb8d38bc7aa2cf420472f8e [0,1,0,0,0,0|1,0,2]=4 3142 B16R1.7596 C#CCCCCNC(=O)c1ccccc1Cl 53f9746af6cda118ef528263dfd6697a [0,1,0,0,0,0|1,0,2]=4 3143 B16R1.7596 C#CCCCCNC(=O)c1ccccc1F 01bec1f4fee7ed7544c6a67a647a755d [0,1,0,0,0,0|1,0,2]=4 3144 B16R1.7596 C#CCCCCNC(=O)c1ccccc1I 6a98948440e5ec5473091adf50acc9fc [0,1,0,0,0,0|1,0,2]=4 3145 B16R1.7596 C#CCCCCNC(=O)c1ccccc1O 58bbc231e88be7da7e9c9838478683db [0,1,0,0,0,0|1,0,2]=4 3146 B16R1.7596 C#CCCCCNC(=O)c1ccccc1S 0f8a91d6cc858ac80203535e15201ee9 [0,1,0,0,0,0|1,0,2]=4 3147 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Br e03b9c48bbb9b4bcfd3346a441fc33c7 [0,1,0,0,0,0|1,0,2]=4 3148 B16R1.7596 C=CCCCCNC(=O)c1ccccc1C 3c6e94a69c07209e5c65ddf664cb873e [0,1,0,0,0,0|1,0,2]=4 3149 B16R1.7596 C=CCCCCNC(=O)c1ccccc1Cl 1c4a21f81802fe21a1e247572c4e1883 [0,1,0,0,0,0|1,0,2]=4 3150 B16R1.7596 C=CCCCCNC(=O)c1ccccc1F aafb2efd417619875f4bcb891aabf970 [0,1,0,0,0,0|1,0,2]=4 3151 B16R1.7596 C=CCCCCNC(=O)c1ccccc1I 2a0418bffdd34d1b1ed9eb2793c14414 [0,1,0,0,0,0|1,0,2]=4 3152 B16R1.7596 C=CCCCCNC(=O)c1ccccc1O 977cf6728d5dcc8afcc274427ff2fc6a [0,1,0,0,0,0|1,0,2]=4 3153 B16R1.7596 C=CCCCCNC(=O)c1ccccc1S 1c7590a4c54dfba1640518d586ece165 [0,1,0,0,0,0|1,0,2]=4 3154 B16R1.7596 CCCCCCCN(C)c1ccccc1C 6b1f1a27c086a01ff85d14087ffeebfe [0,1,0,0,0,0|3,0,0]=4 3155 B16R1.7596 CCCCCCCN(C)c1ccccc1F acc8136a8d06b4429d4aa6ebfe2e6dc1 [0,1,0,0,0,0|3,0,0]=4 3156 B16R1.7596 CCCCCCNC(=O)c1cccc[n+]1[O-] f376ced63e03c190e7b2b91884be7043 [0,1,0,0,0,0|2,0,0]=3 3157 B16R1.7596 CCCCCCNC(=O)c1ccccc1Br a4b69da5bdb1bd83fe11ff6d52e60ed9 [0,1,0,0,0,0|1,0,0]=2 3158 B16R1.7596 CCCCCCNC(=O)c1ccccc1C 513a207a56051d3edb57864069248844 [0,1,0,0,0,0|1,0,0]=2 3159 B16R1.7596 CCCCCCNC(=O)c1ccccc1Cl eb92dc8ecae65f0e5cbeabdf8ca4e78e [0,1,0,0,0,0|1,0,0]=2 3160 B16R1.7596 CCCCCCNC(=O)c1ccccc1F 72b2257ddffd940901c90d3d63eed90e [0,1,0,0,0,0|1,0,0]=2 3161 B16R1.7596 CCCCCCNC(=O)c1ccccc1I c066174f04f272cca78b87362fd0ab25 [0,1,0,0,0,0|1,0,0]=2 3162 B16R1.7596 CCCCCCNC(=O)c1ccccc1O bdcfd921bd1b1783700b3bf2e71be598 [0,1,0,0,0,0|1,0,0]=2 3163 B16R1.7596 CCCCCCNC(=O)c1ccccc1S ade5c3d7e5754c058eac1f445ed949a6 [0,1,0,0,0,0|1,0,0]=2 3164 B16R1.7596 CCCCCCNC(=O)c1cccnc1Br 9cff2e753540a22cc3d21f615952f6dc [0,1,0,0,0,0|2,0,0]=3 3165 B16R1.7596 CCCCCCNC(=O)c1cccnc1C 740e3691859878c1d70c9cc1c6f45f87 [0,1,0,0,0,0|2,0,0]=3 3166 B16R1.7596 CCCCCCNC(=O)c1cccnc1Cl 9a3d7c2823e32f02d8a0dc47360c7b8d [0,1,0,0,0,0|2,0,0]=3 3167 B16R1.7596 CCCCCCNC(=O)c1cccnc1F e6de8493e08d07251d81bcc93c05cf9a [0,1,0,0,0,0|2,0,0]=3 3168 B16R1.7596 CCCCCCNC(=O)c1cccnc1I 62d22d35bf745425274cd2bde72ef17b [0,1,0,0,0,0|2,0,0]=3 3169 B16R1.7596 CCCCCCNC(=O)c1cccnc1O c948df37739e7e99c7bc6381d4fd8d9d [0,1,0,0,0,0|2,0,0]=3 3170 B16R1.7596 CCCCCCNC(=O)c1cccnc1S 29418b4eef669fcfc7f0be46f72e0aaa [0,1,0,0,0,0|2,0,0]=3 3171 B16R1.7596 CCCCCCNC(=O)c1ccncc1Br 8912583cb5e1718181c9352ae7988612 [0,1,0,0,0,0|2,0,0]=3 3172 B16R1.7596 CCCCCCNC(=O)c1ccncc1C fb80f9aac3ad6f8b9aaa8516f3299bae [0,1,0,0,0,0|2,0,0]=3 3173 B16R1.7596 CCCCCCNC(=O)c1ccncc1Cl 5b2df494e232d700e345fdd5588b6a0c [0,1,0,0,0,0|2,0,0]=3 3174 B16R1.7596 CCCCCCNC(=O)c1ccncc1F 05b5554cf06a973c0ca6a58bdeebf59a [0,1,0,0,0,0|2,0,0]=3 3175 B16R1.7596 CCCCCCNC(=O)c1ccncc1I cb36f2a6dc0c3c5e3b3e91a27a2ee418 [0,1,0,0,0,0|2,0,0]=3 3176 B16R1.7596 CCCCCCNC(=O)c1ccncc1O a3729a5b90c2f7da6bce616333786c80 [0,1,0,0,0,0|2,0,0]=3 3177 B16R1.7596 CCCCCCNC(=O)c1ccnnc1C 4454c24e84d44d0917cb415a579eb6c9 [0,1,0,0,0,0|3,0,0]=4 3178 B16R1.7596 CCCCCCNC(=O)c1ccnnc1Cl a04e9729912365633878992556ccb531 [0,1,0,0,0,0|3,0,0]=4 3179 B16R1.7596 CCCCCCNC(=O)c1cnccc1Br 0c816e95465b41ce7fed7ec80565e252 [0,1,0,0,0,0|2,0,0]=3 3180 B16R1.7596 CCCCCCNC(=O)c1cnccc1C 3f908fa4b2afbbe11b82a6345ce12e0d [0,1,0,0,0,0|2,0,0]=3 3181 B16R1.7596 CCCCCCNC(=O)c1cnccc1Cl 0ec4b661c890abf7a8b910961e38ee6c [0,1,0,0,0,0|2,0,0]=3 3182 B16R1.7596 CCCCCCNC(=O)c1cnccc1F 5ad9338205921be4cb0a519973132d86 [0,1,0,0,0,0|2,0,0]=3 3183 B16R1.7596 CCCCCCNC(=O)c1cnccc1O f8744154e9bbab83a975706126d66ebf [0,1,0,0,0,0|2,0,0]=3 3184 B16R1.7596 CCCCCCNC(=O)c1cncnc1C 044470a3b9519d79e7627b0b91056e2a [0,1,0,0,0,0|3,0,0]=4 3185 B16R1.7596 CCCCCCNC(=O)c1cncnc1Cl 6388bb5fa590706b11b299a10228f65e [0,1,0,0,0,0|3,0,0]=4 3186 B16R1.7596 CCCCCCNC(=O)c1cnncc1Br 65ef1061ab2a9db47c8f17c6c6d7fc70 [0,1,0,0,0,0|3,0,0]=4 3187 B16R1.7596 CCCCCCNC(=O)c1cnncc1C 4e68f8a785f717f8f1ef108dc6c0f9be [0,1,0,0,0,0|3,0,0]=4 3188 B16R1.7596 CCCCCCNC(=O)c1cnncc1Cl 80a84a2225990816035caeeda28f82d3 [0,1,0,0,0,0|3,0,0]=4 3189 B16R1.7596 CCCCCCNC(=O)c1ncccc1Br 7582fb705a0160756e145b64ab22c2d4 [0,1,0,0,0,0|2,0,0]=3 3190 B16R1.7596 CCCCCCNC(=O)c1ncccc1C 4bd0a96840a2f9ae9e24108f96b69b9c [0,1,0,0,0,0|2,0,0]=3 3191 B16R1.7596 CCCCCCNC(=O)c1ncccc1Cl 6276130ad40139b989a1269e94df400c [0,1,0,0,0,0|2,0,0]=3 3192 B16R1.7596 CCCCCCNC(=O)c1ncccc1F 3e52e54a3679b8435bfae288a356a935 [0,1,0,0,0,0|2,0,0]=3 3193 B16R1.7596 CCCCCCNC(=O)c1ncccc1I e86efe48f4cf633b1700f80f6338f576 [0,1,0,0,0,0|2,0,0]=3 3194 B16R1.7596 CCCCCCNC(=O)c1ncccc1O 44a573c1d46b26a50f7d127fe3e8871b [0,1,0,0,0,0|2,0,0]=3 3195 B16R1.7596 CCCCCCNC(=O)c1nccnc1Br 9717f2e1cfb6bddc6a0b4bd8b66275d1 [0,1,0,0,0,0|3,0,0]=4 3196 B16R1.7596 CCCCCCNC(=O)c1nccnc1C 9d9087f4a585b4d6f66cb84696837d18 [0,1,0,0,0,0|3,0,0]=4 3197 B16R1.7596 CCCCCCNC(=O)c1nccnc1Cl 734bc88acd4dead3c27d474dd64ff9a5 [0,1,0,0,0,0|3,0,0]=4 3198 B16R1.7596 CCCCCCNC(=O)c1nccnc1F d97b0681b58118e6dabb79cf17fc9df4 [0,1,0,0,0,0|3,0,0]=4 3199 B16R1.7596 CCCCCCNC(=O)c1nccnc1I 16a2e25488bebc6e6d4ada16fc37f276 [0,1,0,0,0,0|3,0,0]=4 3200 B16R1.7596 CCCCCCNC(=O)c1nccnc1O 7354aa27c6c09ffe1705acdc914a9d7e [0,1,0,0,0,0|3,0,0]=4 3201 B16R1.7596 CCCCCCNC(=O)c1ncncc1Br a564d06924288371333a66fac8ee8289 [0,1,0,0,0,0|3,0,0]=4 3202 B16R1.7596 CCCCCCNC(=O)c1ncncc1C 7a90e09b909e44bea0cd84277b03c9fa [0,1,0,0,0,0|3,0,0]=4 3203 B16R1.7596 CCCCCCNC(=O)c1ncncc1Cl 30091f1087fcc33fd9093ee4638dc81e [0,1,0,0,0,0|3,0,0]=4 3204 B16R1.7596 CCCCCCNC(=O)c1ncncc1F 9e3fdd9db43f3a97e663f959671b64a6 [0,1,0,0,0,0|3,0,0]=4 3205 B16R1.7596 CCCCCCNC(=O)c1nnccc1C 236dcf01c1d9bb0a7dbfe60bcfd9cd4d [0,1,0,0,0,0|3,0,0]=4 3206 B16R1.7596 CCCCCCNC(C)c1ccccc1C ee56a24877c911087e3f4dd0ae473d46 [0,1,0,0,0,0|2,0,1]=4 3207 B16R1.7596 CCCCCCNC(C)c1ccccc1Cl ed0a78b38051b4a20d247cce152279b7 [0,1,0,0,0,0|2,0,1]=4 3208 B16R1.7596 CCCCCCNC(C)c1ccccc1F 97b1174cca92315b9e09da3c748b6f0d [0,1,0,0,0,0|2,0,1]=4 3209 B16R1.7596 CCCCCCNC(C)c1ccccc1I 31e9abba52cca1d5a86bddbd02423e48 [0,1,0,0,0,0|2,0,1]=4 3210 B16R1.7596 CCCCCCN[C@@H](C)c1ccccc1C 19ee2d2dbfd0b50ac9bacbbca5618de2 [0,1,0,0,0,0|2,0,1]=4 3211 B16R1.7596 CCCCCCN[C@@H](C)c1ccccc1Cl 51e31086c16722529b82f6d2c8ab4f6b [0,1,0,0,0,0|2,0,1]=4 3212 B16R1.7596 CCCCCCN[C@@H](C)c1ccccc1F c7ee7df226dd9323e4bbe824f338b6de [0,1,0,0,0,0|2,0,1]=4 3213 B16R1.7596 CCCCCCN[C@H](C)c1ccccc1C 69290db7d66545be83f1075ec7b45b84 [0,1,0,0,0,0|2,0,1]=4 3214 B16R1.7596 CCCCCCN[C@H](C)c1ccccc1Cl 442bc8a2b9f1cc0c4b5f9060084773e9 [0,1,0,0,0,0|2,0,1]=4 3215 B16R1.7596 CCCCCCN[C@H](C)c1ccccc1F fd1f45bde7d2b64a8d950616fb667b65 [0,1,0,0,0,0|2,0,1]=4 3216 B16R1.7596 CCCCCCOC(C)c1ccccc1F dd03398646b087d7e8e7ced926ba3b99 [0,1,0,0,0,0|1,0,1]=3 3217 B16R1.7596 CCCCCCOC(C)c1cccnc1Br 0d6abc4f4765335c921e4a691d29b38b [0,1,0,0,0,0|2,0,1]=4 3218 B16R1.7596 CCCCCCOC(C)c1cccnc1C a6c012dfcaebb5318bc48cb8703288d6 [0,1,0,0,0,0|2,0,1]=4 3219 B16R1.7596 CCCCCCOC(C)c1ccncc1Cl 27c6441da56c534297b1f1b9fef7d883 [0,1,0,0,0,0|2,0,1]=4 3220 B16R1.7596 CCCCCCOC(C)c1ncccc1C 4cbe02dd74a4aa3e683286ebd73d0a6a [0,1,0,0,0,0|2,0,1]=4 3221 B16R1.7596 CCCCCCOC(C)c1ncccc1Cl 7d3527391e9fa8093f15141393e28922 [0,1,0,0,0,0|2,0,1]=4 3222 B16R1.7596 CCCCCCOC(C)c1ncccc1F 498a47ab3e821091e37388426c322970 [0,1,0,0,0,0|2,0,1]=4 3223 B16R1.7596 CCCCCCO[C@@H](C)c1ccccc1F 9af3c147c4df72f025e62789a0d00a66 [0,1,0,0,0,0|1,0,1]=3 3224 B16R1.7596 CCCCCCO[C@H](C)c1ccccc1F e98ba6af7317371c0e8db9f8ce3d4583 [0,1,0,0,0,0|1,0,1]=3 3225 B16R1.7596 CCCCCCO[C@H](C)c1ncccc1C 8ec2b5a5d23ad491165177c81b8122d2 [0,1,0,0,0,0|2,0,1]=4 3226 B16R1.7596 CCCCCCO[C@H](C)c1ncccc1F 81d117e4e336be2ccbb137b18a83808d [0,1,0,0,0,0|2,0,1]=4 3227 B16R1.7596 CCCCCNCC(=O)c1ccccc1C 85b64a3a384d8bbbb6d052a360ce0067 [0,1,0,0,0,0|2,0,0]=3 3228 B16R1.7596 CCCCCNCC(=O)c1ccccc1Cl 49f36e33a9079e95521e803164f1d56b [0,1,0,0,0,0|2,0,0]=3 3229 B16R1.7596 CCCCCNCC(=O)c1ccccc1F 28d353f31360d067c2d8b47a892e1bd8 [0,1,0,0,0,0|2,0,0]=3 3230 B16R1.7596 CCCCCNCC(=O)c1ccccc1I 70283cd437aac9f4d4023c858d60bd73 [0,1,0,0,0,0|2,0,0]=3 3231 B16R1.7596 CCCCCNCC(=O)c1cccnc1Cl 5e5ce4a0ababb6bcdec0dcabd6b9b608 [0,1,0,0,0,0|3,0,0]=4 3232 B16R1.7596 CCCCCNCC(=O)c1ncccc1F d12c06205a62f5ba477170e216a2117a [0,1,0,0,0,0|3,0,0]=4 3233 B16R1.7596 CCCCCOCC(=O)c1ccccc1C 129fbc28a89ccd6ffc560d92cb3e6baa [0,1,0,0,0,0|2,0,0]=3 3234 B16R1.7596 CCCCCOCC(=O)c1ccccc1Cl ca0e2ab7e6b960547e6adaae1fc59b47 [0,1,0,0,0,0|2,0,0]=3 3235 B16R1.7596 CCCCCOCC(=O)c1ccccc1F 22b57d2079be21713aa4512f10f36976 [0,1,0,0,0,0|2,0,0]=3 3236 B16R1.7596 CCCCCOCC(=O)c1ccccc1I dee409228459a881431bf846b2f850a3 [0,1,0,0,0,0|2,0,0]=3 3237 B16R1.7596 CCCCCOCC(=O)c1cccnc1Cl ac44bacf780bd95b6a9e312416eb4293 [0,1,0,0,0,0|3,0,0]=4 3238 B16R1.7596 CCCCCOCC(=O)c1ncccc1F c36b57b13810a29606e997d3f4ca8593 [0,1,0,0,0,0|3,0,0]=4 3239 B16R1.7596 CCCCNCCC(=O)c1ccccc1F 8cd9b27a14643ee71b35869f43a8691d [0,1,0,0,0,0|2,0,0]=3 3240 B16R1.7596 CCCNCCCC(=O)c1ccccc1F 65ccc0fc41614e830688df2581fd9fd6 [0,1,0,0,0,0|2,0,0]=3 3241 B16R1.7596 CCCNCCNC(=O)c1ccccc1Cl 8baae7cea638babc424b51cfca80d7d3 [0,1,0,0,0,0|2,0,0]=3 3242 B16R1.7596 CCCNCCNC(=O)c1ccccc1F 723e27c5f3cd44f2575fc6217bdde86d [0,1,0,0,0,0|2,0,0]=3 3243 B16R1.7596 CCCNCCNC(=O)c1ccccc1I 8afb9a578f0c38d76e8648edcf1c4409 [0,1,0,0,0,0|2,0,0]=3 3244 B16R1.7596 CCCOCCNC(=O)c1cccc[n+]1[O-] 5079f47d5d1f158d8f2994e22ec88730 [0,1,0,0,0,0|3,0,0]=4 3245 B16R1.7596 CCCOCCNC(=O)c1ccccc1Br 71caefd5ff90e804ba8a59ba0ec2f077 [0,1,0,0,0,0|2,0,0]=3 3246 B16R1.7596 CCCOCCNC(=O)c1ccccc1C 12efaec380bc95fb007e8d763caf68a9 [0,1,0,0,0,0|2,0,0]=3 3247 B16R1.7596 CCCOCCNC(=O)c1ccccc1Cl 3d896e3318f148b156550d28f0d5b56c [0,1,0,0,0,0|2,0,0]=3 3248 B16R1.7596 CCCOCCNC(=O)c1ccccc1F bceadf09f9a7a74492ca7d08ef5804e4 [0,1,0,0,0,0|2,0,0]=3 3249 B16R1.7596 CCCOCCNC(=O)c1ccccc1I 5d3c265963a09d6d7920611dcce37358 [0,1,0,0,0,0|2,0,0]=3 3250 B16R1.7596 CCCOCCNC(=O)c1ccccc1O c7eb19c615e994e20c8f6b10fbd6ec75 [0,1,0,0,0,0|2,0,0]=3 3251 B16R1.7596 CCCOCCNC(=O)c1ccccc1S 5230424ab41ea448e95619d399dbcd73 [0,1,0,0,0,0|2,0,0]=3 3252 B16R1.7596 CCCOCCNC(=O)c1cccnc1Br 4522a049ab8cbec6afd37ef1a9ae6b18 [0,1,0,0,0,0|3,0,0]=4 3253 B16R1.7596 CCCOCCNC(=O)c1cccnc1C 9c8da46eda19a82d041a1f1e609df39a [0,1,0,0,0,0|3,0,0]=4 3254 B16R1.7596 CCCOCCNC(=O)c1cccnc1Cl 4e1842ced4c69b06ed19c20566b74b7c [0,1,0,0,0,0|3,0,0]=4 3255 B16R1.7596 CCCOCCNC(=O)c1cccnc1F e7b1cb7227796df737b4a909fa0d5378 [0,1,0,0,0,0|3,0,0]=4 3256 B16R1.7596 CCCOCCNC(=O)c1cccnc1I 6c2ef0f1b3499c4a46276bff2fe735ba [0,1,0,0,0,0|3,0,0]=4 3257 B16R1.7596 CCCOCCNC(=O)c1cccnc1O e724f699595ec5e991521fc3502aa877 [0,1,0,0,0,0|3,0,0]=4 3258 B16R1.7596 CCCOCCNC(=O)c1cccnc1S 1711237ebdf1d798acfd0ac0edfe983d [0,1,0,0,0,0|3,0,0]=4 3259 B16R1.7596 CCCOCCNC(=O)c1ccncc1Br 6780770d78991ab48e312df173ef4088 [0,1,0,0,0,0|3,0,0]=4 3260 B16R1.7596 CCCOCCNC(=O)c1ccncc1C 77c9b366da08c0aff782e048025d902e [0,1,0,0,0,0|3,0,0]=4 3261 B16R1.7596 CCCOCCNC(=O)c1ccncc1Cl 0100469b722383c33c5f5ffff8d53a0a [0,1,0,0,0,0|3,0,0]=4 3262 B16R1.7596 CCCOCCNC(=O)c1ccncc1F 87787fc8efd7cddeb34712664ff7e7bb [0,1,0,0,0,0|3,0,0]=4 3263 B16R1.7596 CCCOCCNC(=O)c1ccncc1I 86a7bb466a54f5d85df6102b421b303a [0,1,0,0,0,0|3,0,0]=4 3264 B16R1.7596 CCCOCCNC(=O)c1ccncc1O e4a12ecf4ab37376a9feed9a2fc92593 [0,1,0,0,0,0|3,0,0]=4 3265 B16R1.7596 CCCOCCNC(=O)c1cnccc1Br 342874ab6b7784377caa6209876e7cf2 [0,1,0,0,0,0|3,0,0]=4 3266 B16R1.7596 CCCOCCNC(=O)c1cnccc1C dd6f746f5e07fc8f88af5e30588ea932 [0,1,0,0,0,0|3,0,0]=4 3267 B16R1.7596 CCCOCCNC(=O)c1cnccc1Cl 25d4a6e6da203e67c6511f6a9ee59fab [0,1,0,0,0,0|3,0,0]=4 3268 B16R1.7596 CCCOCCNC(=O)c1cnccc1F db738f0be2cae72642c0521cf7ef7f92 [0,1,0,0,0,0|3,0,0]=4 3269 B16R1.7596 CCCOCCNC(=O)c1cnccc1O 3bee7f4a2c60ab5c31f04951419ce896 [0,1,0,0,0,0|3,0,0]=4 3270 B16R1.7596 CCCOCCNC(=O)c1ncccc1Br 8d93f678e2d99875c3efeafa1a355097 [0,1,0,0,0,0|3,0,0]=4 3271 B16R1.7596 CCCOCCNC(=O)c1ncccc1C 8bd07aae3d3972736b5d1153ab294072 [0,1,0,0,0,0|3,0,0]=4 3272 B16R1.7596 CCCOCCNC(=O)c1ncccc1Cl 979a0781de411e8722077a98c5e0b106 [0,1,0,0,0,0|3,0,0]=4 3273 B16R1.7596 CCCOCCNC(=O)c1ncccc1F f83a684fbd3de3b9575eb8e0118fbe6c [0,1,0,0,0,0|3,0,0]=4 3274 B16R1.7596 CCCOCCNC(=O)c1ncccc1I af4955f1eceb9d2467fd632cbceec603 [0,1,0,0,0,0|3,0,0]=4 3275 B16R1.7596 CCCOCCNC(=O)c1ncccc1O 08999522ce8dc5566863c98de9e67453 [0,1,0,0,0,0|3,0,0]=4 3276 B16R1.7596 CCCOCCOC(C)c1ccccc1Br 429e357513ca0c2680e8c394df8e3fa8 [0,1,0,0,0,0|2,0,1]=4 3277 B16R1.7596 CCCOCCOC(C)c1ccccc1C 8000f32b1c3f89cda1fa53ee3cda79be [0,1,0,0,0,0|2,0,1]=4 3278 B16R1.7596 CCCOCCOC(C)c1ccccc1Cl 30fb807af9b6db884db583bb903def4a [0,1,0,0,0,0|2,0,1]=4 3279 B16R1.7596 CCCOCCOC(C)c1ccccc1F 95ebaba155862ee9a6a8ea2279face70 [0,1,0,0,0,0|2,0,1]=4 3280 B16R1.7596 CCCOCCOC(C)c1ccccc1I c3f7b7388309617607f4da8dd62f5bc3 [0,1,0,0,0,0|2,0,1]=4 3281 B16R1.7596 CCCOCCO[C@@H](C)c1ccccc1Br 621b7a31188a2870ef7a72bf9bb40bfa [0,1,0,0,0,0|2,0,1]=4 3282 B16R1.7596 CCCOCCO[C@@H](C)c1ccccc1C 50e3281dc871f6091a8d0dec7af17b47 [0,1,0,0,0,0|2,0,1]=4 3283 B16R1.7596 CCCOCCO[C@@H](C)c1ccccc1Cl 24adfece5d36dab72736bc8fc6156191 [0,1,0,0,0,0|2,0,1]=4 3284 B16R1.7596 CCCOCCO[C@@H](C)c1ccccc1F 3abc43a41b053b8c73427e20e3e6303b [0,1,0,0,0,0|2,0,1]=4 3285 B16R1.7596 CCCOCCO[C@H](C)c1ccccc1Br 1f5bbda0bfeefd94d18f0d97795fa8da [0,1,0,0,0,0|2,0,1]=4 3286 B16R1.7596 CCCOCCO[C@H](C)c1ccccc1Cl 3c5ddbefabf39a6b3c44346f3b9a004e [0,1,0,0,0,0|2,0,1]=4 3287 B16R1.7596 CCCOCCO[C@H](C)c1ccccc1F c99d085cef27a558a35667a634a0dbea [0,1,0,0,0,0|2,0,1]=4 3288 B16R1.7596 CCOCCCNC(=O)c1cccc[n+]1[O-] e781804f26cabfe9e69531000cb33297 [0,1,0,0,0,0|3,0,0]=4 3289 B16R1.7596 CCOCCCNC(=O)c1ccccc1Br fdc5da0fe81931f70ad801b80026b739 [0,1,0,0,0,0|2,0,0]=3 3290 B16R1.7596 CCOCCCNC(=O)c1ccccc1C ec9408d8bf1ce38b58985cafba039d62 [0,1,0,0,0,0|2,0,0]=3 3291 B16R1.7596 CCOCCCNC(=O)c1ccccc1Cl 25ff7fb0a3e673fd985a02ed07ea2cc8 [0,1,0,0,0,0|2,0,0]=3 3292 B16R1.7596 CCOCCCNC(=O)c1ccccc1F 382c469206e78caa7b960ca69941ec3b [0,1,0,0,0,0|2,0,0]=3 3293 B16R1.7596 CCOCCCNC(=O)c1ccccc1I 67f4f86f6099b39db0978a54d30d437d [0,1,0,0,0,0|2,0,0]=3 3294 B16R1.7596 CCOCCCNC(=O)c1ccccc1O 388f6f9c6873a414bcd22fd571da1014 [0,1,0,0,0,0|2,0,0]=3 3295 B16R1.7596 CCOCCCNC(=O)c1ccccc1S c32e90cf3c6968a6fe352e759e1a3b2a [0,1,0,0,0,0|2,0,0]=3 3296 B16R1.7596 CCOCCCNC(=O)c1cccnc1Br 39ff3100971e359f0e9db840081d7e10 [0,1,0,0,0,0|3,0,0]=4 3297 B16R1.7596 CCOCCCNC(=O)c1cccnc1C 57d77124329524217c1f1e360c8565e6 [0,1,0,0,0,0|3,0,0]=4 3298 B16R1.7596 CCOCCCNC(=O)c1cccnc1Cl 59e290ea7302df0054fe31eae1465721 [0,1,0,0,0,0|3,0,0]=4 3299 B16R1.7596 CCOCCCNC(=O)c1cccnc1F f29573cd70fd9166e423cce44b0a82b9 [0,1,0,0,0,0|3,0,0]=4 3300 B16R1.7596 CCOCCCNC(=O)c1cccnc1I 0e47fbce013a3c639c1e1db1fe02bd1c [0,1,0,0,0,0|3,0,0]=4 3301 B16R1.7596 CCOCCCNC(=O)c1cccnc1O 00b3b55fcc143148ba92739557ed4a45 [0,1,0,0,0,0|3,0,0]=4 3302 B16R1.7596 CCOCCCNC(=O)c1cccnc1S b52fc72785f72cdbd702e7ffbf80266e [0,1,0,0,0,0|3,0,0]=4 3303 B16R1.7596 CCOCCCNC(=O)c1ccncc1Br 6fe0e8bbe45c0b125819b22f4fdb4a86 [0,1,0,0,0,0|3,0,0]=4 3304 B16R1.7596 CCOCCCNC(=O)c1ccncc1C f28085f8371287c55da88e76a3471147 [0,1,0,0,0,0|3,0,0]=4 3305 B16R1.7596 CCOCCCNC(=O)c1ccncc1Cl 8c241ecb81e7702ba880143b01d44fa2 [0,1,0,0,0,0|3,0,0]=4 3306 B16R1.7596 CCOCCCNC(=O)c1ccncc1F 4a6507ba69be35e968e519d5e1718107 [0,1,0,0,0,0|3,0,0]=4 3307 B16R1.7596 CCOCCCNC(=O)c1ccncc1I e4e0402f7a54fb099ebb10893b370545 [0,1,0,0,0,0|3,0,0]=4 3308 B16R1.7596 CCOCCCNC(=O)c1ccncc1O 0a405297ebf5ec3673bcb6f144ec0071 [0,1,0,0,0,0|3,0,0]=4 3309 B16R1.7596 CCOCCCNC(=O)c1cnccc1Br f63290ac706a1713f7dcf5bd961fd608 [0,1,0,0,0,0|3,0,0]=4 3310 B16R1.7596 CCOCCCNC(=O)c1cnccc1C f87098c19f4fcde6a7ce6cc96ab61181 [0,1,0,0,0,0|3,0,0]=4 3311 B16R1.7596 CCOCCCNC(=O)c1cnccc1Cl 034d9c7cfa7714e8168606417de5eb37 [0,1,0,0,0,0|3,0,0]=4 3312 B16R1.7596 CCOCCCNC(=O)c1cnccc1F ebd8d5ff380ccaeea19d68fc4d210113 [0,1,0,0,0,0|3,0,0]=4 3313 B16R1.7596 CCOCCCNC(=O)c1cnccc1O cebdaea970d3cd56a464cf7504d5404b [0,1,0,0,0,0|3,0,0]=4 3314 B16R1.7596 CCOCCCNC(=O)c1ncccc1Br 2ff62a0de11ff5dc05f851cf1aafde9f [0,1,0,0,0,0|3,0,0]=4 3315 B16R1.7596 CCOCCCNC(=O)c1ncccc1C 3f3dfb9dc3fc85cb06152cec41418245 [0,1,0,0,0,0|3,0,0]=4 3316 B16R1.7596 CCOCCCNC(=O)c1ncccc1Cl 93db0e544babc922e778dcd7c77664f1 [0,1,0,0,0,0|3,0,0]=4 3317 B16R1.7596 CCOCCCNC(=O)c1ncccc1F d632b87eaa8ec32ee54d0336cd90dada [0,1,0,0,0,0|3,0,0]=4 3318 B16R1.7596 CCOCCCNC(=O)c1ncccc1I f88c7d13aedd98e9bdeda30ef9035f01 [0,1,0,0,0,0|3,0,0]=4 3319 B16R1.7596 CCOCCCNC(=O)c1ncccc1O 553d9118fed660782f3207ab4c5cd894 [0,1,0,0,0,0|3,0,0]=4 3320 B16R1.7596 CCOCCCOC(C)c1ccccc1C 87411d45826ac70e5adb685021dc1412 [0,1,0,0,0,0|2,0,1]=4 3321 B16R1.7596 CCOCCCOC(C)c1ccccc1Cl 48b0eba93293dfba774c3e7c5b889578 [0,1,0,0,0,0|2,0,1]=4 3322 B16R1.7596 CCOCCCOC(C)c1ccccc1F 6a3e3767f26af2853a38b2a745c4f603 [0,1,0,0,0,0|2,0,1]=4 3323 B16R1.7596 CCOCCCOC(C)c1ccccc1I 07c053a310e79af699f80eadb0e8079d [0,1,0,0,0,0|2,0,1]=4 3324 B16R1.7596 CCOCCCO[C@@H](C)c1ccccc1C 6c0e5a8ba14b85bc10ee9b7cd8a1d2fd [0,1,0,0,0,0|2,0,1]=4 3325 B16R1.7596 CCOCCCO[C@@H](C)c1ccccc1Cl c18f1fa9c07ab892a3e932999a1f5060 [0,1,0,0,0,0|2,0,1]=4 3326 B16R1.7596 CCOCCCO[C@@H](C)c1ccccc1F d7f152c442379b7549e2bab196b8b402 [0,1,0,0,0,0|2,0,1]=4 3327 B16R1.7596 CCOCCCO[C@H](C)c1ccccc1Cl d6b3df6b55c144bbb104c14922becf3d [0,1,0,0,0,0|2,0,1]=4 3328 B16R1.7596 CCOCCCO[C@H](C)c1ccccc1F 861890c1d990977b290667d4c3447874 [0,1,0,0,0,0|2,0,1]=4 3329 B16R1.7596 CCOCCNCC(=O)c1ccccc1C 5856611d1455b28c7ecff3d066b30d09 [0,1,0,0,0,0|3,0,0]=4 3330 B16R1.7596 CCOCCNCC(=O)c1ccccc1Cl 36b65c58504eac3684f3c2530df58a4e [0,1,0,0,0,0|3,0,0]=4 3331 B16R1.7596 CCOCCNCC(=O)c1ccccc1F 2d9d0faf5a785394c0361c6aad39271e [0,1,0,0,0,0|3,0,0]=4 3332 B16R1.7596 CCOCCNCC(=O)c1ccccc1I 942371113459f375bf7cdd42cb4c45e3 [0,1,0,0,0,0|3,0,0]=4 3333 B16R1.7596 CCOCCOCC(=O)c1ccccc1Br 0f79a69ab233a2f1ce5fd5762e68bd30 [0,1,0,0,0,0|3,0,0]=4 3334 B16R1.7596 CCOCCOCC(=O)c1ccccc1C 5e9720ff4624f747bfb353d2d30d93f9 [0,1,0,0,0,0|3,0,0]=4 3335 B16R1.7596 CCOCCOCC(=O)c1ccccc1Cl cb5fcb756c77beac913529d764d6cf56 [0,1,0,0,0,0|3,0,0]=4 3336 B16R1.7596 CCOCCOCC(=O)c1ccccc1F 132e4b244e0d505b55486b8c55e4bf82 [0,1,0,0,0,0|3,0,0]=4 3337 B16R1.7596 CCOCCOCC(=O)c1ccccc1I d350b8e372b0ace6add1a115b4190eea [0,1,0,0,0,0|3,0,0]=4 3338 B16R1.7596 CCSCCCOC(C)c1ccccc1Cl e13d4907fb3e329aa31455fe33976c5a [0,1,0,0,0,0|2,0,1]=4 3339 B16R1.7596 CCSCCCOC(C)c1ccccc1F b10b18984d1aa4c7e33fd290f66603fc [0,1,0,0,0,0|2,0,1]=4 3340 B16R1.7596 CCSCCCOC(C)c1ccccc1I 8c8811fbeab3763c4ee6b53903c8a009 [0,1,0,0,0,0|2,0,1]=4 3341 B16R1.7596 CCSCCCO[C@@H](C)c1ccccc1Cl a5105a9a16337c3d1dac93ead4d47ce1 [0,1,0,0,0,0|2,0,1]=4 3342 B16R1.7596 CCSCCCO[C@@H](C)c1ccccc1F c40a3c90bf64bab575f16294ed32d9f1 [0,1,0,0,0,0|2,0,1]=4 3343 B16R1.7596 CCSCCCO[C@H](C)c1ccccc1Cl 31a6fa0bd4d90f7d48292d0d32dca388 [0,1,0,0,0,0|2,0,1]=4 3344 B16R1.7596 CCSCCCO[C@H](C)c1ccccc1F 859b4685e8fdb2746a1b634c75b0590a [0,1,0,0,0,0|2,0,1]=4 3345 B16R1.7596 CCSCCNCC(=O)c1ccccc1C 9f7a948ea574c12548b6d42b9f3190e1 [0,1,0,0,0,0|3,0,0]=4 3346 B16R1.7596 CCSCCNCC(=O)c1ccccc1Cl 5290e7eb1ae0e2d6e5aaccabf04f62ba [0,1,0,0,0,0|3,0,0]=4 3347 B16R1.7596 CCSCCNCC(=O)c1ccccc1F ce9c28e268663ec5521db8c1eab65ed8 [0,1,0,0,0,0|3,0,0]=4 3348 B16R1.7596 CCSCCNCC(=O)c1ccccc1I 4fe130adba903bfe49eced1ab9e60c0e [0,1,0,0,0,0|3,0,0]=4 3349 B16R1.7596 CCSCCOCC(=O)c1ccccc1C ca57798a23e68c2aa92fc42f2f96a748 [0,1,0,0,0,0|3,0,0]=4 3350 B16R1.7596 CCSCCOCC(=O)c1ccccc1Cl 203e14275b554c28db1699d5f813d4e4 [0,1,0,0,0,0|3,0,0]=4 3351 B16R1.7596 CCSCCOCC(=O)c1ccccc1F 04c41e5720ded5d879716d8610c4ec2e [0,1,0,0,0,0|3,0,0]=4 3352 B16R1.7596 CCSCCOCC(=O)c1ccccc1I 13dc06fe0481aac1a3239817d44ef6c5 [0,1,0,0,0,0|3,0,0]=4 3353 B16R1.7596 COCCCCNC(=O)c1cccc[n+]1[O-] 03c239819f15651a277d36dda50d6ed8 [0,1,0,0,0,0|3,0,0]=4 3354 B16R1.7596 COCCCCNC(=O)c1ccccc1Br f8a3294ae9ece29ffae83e0b37366036 [0,1,0,0,0,0|2,0,0]=3 3355 B16R1.7596 COCCCCNC(=O)c1ccccc1C c9b61a4049791317efa3161c63a678b9 [0,1,0,0,0,0|2,0,0]=3 3356 B16R1.7596 COCCCCNC(=O)c1ccccc1Cl fbabf61740c31867def070190bec1e0d [0,1,0,0,0,0|2,0,0]=3 3357 B16R1.7596 COCCCCNC(=O)c1ccccc1F 0c820d64f6ae8b6f1bf881515ad6a94f [0,1,0,0,0,0|2,0,0]=3 3358 B16R1.7596 COCCCCNC(=O)c1ccccc1I 8bba461547f9a72d6854a61a39b92fba [0,1,0,0,0,0|2,0,0]=3 3359 B16R1.7596 COCCCCNC(=O)c1ccccc1O e37233e233ae038574778ba4493fd246 [0,1,0,0,0,0|2,0,0]=3 3360 B16R1.7596 COCCCCNC(=O)c1ccccc1S 0fb1dec444bcc6fd83b0f20af41904f6 [0,1,0,0,0,0|2,0,0]=3 3361 B16R1.7596 COCCCCNC(=O)c1cccnc1Br 987a0e550b2cf4a8c7366d54f0068ec9 [0,1,0,0,0,0|3,0,0]=4 3362 B16R1.7596 COCCCCNC(=O)c1cccnc1C 50568930df4c5b745671b1167b17fed4 [0,1,0,0,0,0|3,0,0]=4 3363 B16R1.7596 COCCCCNC(=O)c1cccnc1Cl 34a62c41077d887a7ef4d988f712ffac [0,1,0,0,0,0|3,0,0]=4 3364 B16R1.7596 COCCCCNC(=O)c1cccnc1F 09d0b455d10a08628c61dd12c949e6f0 [0,1,0,0,0,0|3,0,0]=4 3365 B16R1.7596 COCCCCNC(=O)c1cccnc1I 357254c2430f750583412560455ba59e [0,1,0,0,0,0|3,0,0]=4 3366 B16R1.7596 COCCCCNC(=O)c1cccnc1O bf856aa78a3d03f355a5afc0727dcd6e [0,1,0,0,0,0|3,0,0]=4 3367 B16R1.7596 COCCCCNC(=O)c1cccnc1S 6e6152efde0bb3d16f618f702582a525 [0,1,0,0,0,0|3,0,0]=4 3368 B16R1.7596 COCCCCNC(=O)c1ccncc1Br 45be29884a0ae1b1e37f67a886a94c1b [0,1,0,0,0,0|3,0,0]=4 3369 B16R1.7596 COCCCCNC(=O)c1ccncc1C 58909498ea5c9ecda3cfc99648a34fb0 [0,1,0,0,0,0|3,0,0]=4 3370 B16R1.7596 COCCCCNC(=O)c1ccncc1Cl 6e02f0b160526873833821e251e931f1 [0,1,0,0,0,0|3,0,0]=4 3371 B16R1.7596 COCCCCNC(=O)c1ccncc1F 86b93cb19954ca659a94ad02c8d0de5e [0,1,0,0,0,0|3,0,0]=4 3372 B16R1.7596 COCCCCNC(=O)c1ccncc1I 75b972aeff9b4de2054bb04337c4703a [0,1,0,0,0,0|3,0,0]=4 3373 B16R1.7596 COCCCCNC(=O)c1ccncc1O 603e8313ac0c8fb297087a3fe62ae818 [0,1,0,0,0,0|3,0,0]=4 3374 B16R1.7596 COCCCCNC(=O)c1cnccc1Br 81ba81e10bc03d7c0386632ef41b2093 [0,1,0,0,0,0|3,0,0]=4 3375 B16R1.7596 COCCCCNC(=O)c1cnccc1C 420b97dbf8d83b8eec7326fb2ec477c0 [0,1,0,0,0,0|3,0,0]=4 3376 B16R1.7596 COCCCCNC(=O)c1cnccc1Cl 498358de48f879b694204ede684b904a [0,1,0,0,0,0|3,0,0]=4 3377 B16R1.7596 COCCCCNC(=O)c1cnccc1F 66396f0ea10917843f879b7b142ce9f9 [0,1,0,0,0,0|3,0,0]=4 3378 B16R1.7596 COCCCCNC(=O)c1cnccc1O cf8980b94af96474ef9359309a77f04d [0,1,0,0,0,0|3,0,0]=4 3379 B16R1.7596 COCCCCNC(=O)c1ncccc1Br 5a084ceb718f3cc838dd0f6e962624bd [0,1,0,0,0,0|3,0,0]=4 3380 B16R1.7596 COCCCCNC(=O)c1ncccc1C ac1f5d2a4948a4c7c8557ce81f4a1ea9 [0,1,0,0,0,0|3,0,0]=4 3381 B16R1.7596 COCCCCNC(=O)c1ncccc1Cl 538bf7f63310fb39867be4f2adff1dfa [0,1,0,0,0,0|3,0,0]=4 3382 B16R1.7596 COCCCCNC(=O)c1ncccc1F d01cb17558bca5aa211a334eebf0d5ca [0,1,0,0,0,0|3,0,0]=4 3383 B16R1.7596 COCCCCNC(=O)c1ncccc1I db01acf38acf3de8316eae75ded1a174 [0,1,0,0,0,0|3,0,0]=4 3384 B16R1.7596 COCCCCNC(=O)c1ncccc1O ca4cf5bdd06b52facc734a927f9ab50f [0,1,0,0,0,0|3,0,0]=4 3385 B16R1.7596 COCCCCOC(C)c1ccccc1C 962f2ce7df6e104e86af25eeffd7e2a1 [0,1,0,0,0,0|2,0,1]=4 3386 B16R1.7596 COCCCCOC(C)c1ccccc1Cl f72bcb3286309a0d639f97621de3f767 [0,1,0,0,0,0|2,0,1]=4 3387 B16R1.7596 COCCCCOC(C)c1ccccc1F ba6d6982a9267210d4e6c3ed11ff701b [0,1,0,0,0,0|2,0,1]=4 3388 B16R1.7596 COCCCCOC(C)c1ccccc1I d9e8bff2dd1f5e91b6b9b3342dd7a694 [0,1,0,0,0,0|2,0,1]=4 3389 B16R1.7596 COCCCCO[C@@H](C)c1ccccc1C 7871d01987a468dc07a6c6b0250d65f8 [0,1,0,0,0,0|2,0,1]=4 3390 B16R1.7596 COCCCCO[C@@H](C)c1ccccc1Cl 318077f25f163746e6114adb72d3589e [0,1,0,0,0,0|2,0,1]=4 3391 B16R1.7596 COCCCCO[C@@H](C)c1ccccc1F c4a76bceba8e240b24c82d17c04f4ddc [0,1,0,0,0,0|2,0,1]=4 3392 B16R1.7596 COCCCCO[C@H](C)c1ccccc1Cl 44232a062577085df3e87e2cda51fedf [0,1,0,0,0,0|2,0,1]=4 3393 B16R1.7596 COCCCCO[C@H](C)c1ccccc1F 7faa9cce54b980d6b5bab1774a760c62 [0,1,0,0,0,0|2,0,1]=4 3394 B16R1.7596 COCCCNCC(=O)c1ccccc1C 32d0b8f52ec1f55d93bb58c93dacfc61 [0,1,0,0,0,0|3,0,0]=4 3395 B16R1.7596 COCCCNCC(=O)c1ccccc1Cl bcfe5c83c0827840e0802a3986614b0a [0,1,0,0,0,0|3,0,0]=4 3396 B16R1.7596 COCCCNCC(=O)c1ccccc1F f4af6b49b8974d7d302b61e05be61976 [0,1,0,0,0,0|3,0,0]=4 3397 B16R1.7596 COCCCNCC(=O)c1ccccc1I 94932f0d90a3082d3845596f12a1f8d8 [0,1,0,0,0,0|3,0,0]=4 3398 B16R1.7596 COCCCOCC(=O)c1ccccc1Br a598364a073513404c061894461d7514 [0,1,0,0,0,0|3,0,0]=4 3399 B16R1.7596 COCCCOCC(=O)c1ccccc1C 2d4277007336f06417b837ad860ed986 [0,1,0,0,0,0|3,0,0]=4 3400 B16R1.7596 COCCCOCC(=O)c1ccccc1Cl abc569046775e772f61689447dcd4090 [0,1,0,0,0,0|3,0,0]=4 3401 B16R1.7596 COCCCOCC(=O)c1ccccc1F c6fe556f8134f2f4915c31011906c6cd [0,1,0,0,0,0|3,0,0]=4 3402 B16R1.7596 COCCCOCC(=O)c1ccccc1I 4e12b02900e793bdf42664a0125d199a [0,1,0,0,0,0|3,0,0]=4 3403 B16R1.7596 COCCNCCC(=O)c1ccccc1F 8da3d94246c435acc8c9ecc1f1fc8e63 [0,1,0,0,0,0|3,0,0]=4 3404 B16R1.7596 COCCOCCC(=O)c1ccccc1F 60add3d123ea2973d29c99b1fbb0c457 [0,1,0,0,0,0|3,0,0]=4 3405 B16R1.7596 COCNCCNC(=O)c1ccccc1Cl 567c8deaed8ee9b72aee841c1d1f6032 [0,1,0,0,0,0|3,0,0]=4 3406 B16R1.7596 COCNCCNC(=O)c1ccccc1F af1f9f6e47b16c0de1adf1094777b6d3 [0,1,0,0,0,0|3,0,0]=4 3407 B16R1.7596 COCNCCNC(=O)c1ccccc1I 1880101a931b5c4a4a9502ec694d2625 [0,1,0,0,0,0|3,0,0]=4 3408 B16R1.7596 COCOCCNC(=O)c1ccccc1Br ff14206bde9f2882c2f4d86e7f31a836 [0,1,0,0,0,0|3,0,0]=4 3409 B16R1.7596 CSCCCCNC(=O)c1cccc[n+]1[O-] c414eacc7dc0caea603188daab175cb9 [0,1,0,0,0,0|3,0,0]=4 3410 B16R1.7596 CSCCCCNC(=O)c1ccccc1Br 310de9c51a7641a119fc3a70499a4aa1 [0,1,0,0,0,0|2,0,0]=3 3411 B16R1.7596 CSCCCCNC(=O)c1ccccc1C d3891a7776e44bcbfbcd57047e5d75d2 [0,1,0,0,0,0|2,0,0]=3 3412 B16R1.7596 CSCCCCNC(=O)c1ccccc1Cl 4b7c8ce41d6ff4544b61bc8542733a59 [0,1,0,0,0,0|2,0,0]=3 3413 B16R1.7596 CSCCCCNC(=O)c1ccccc1F ceee34d31be64bbe29d1b1583a1d57bc [0,1,0,0,0,0|2,0,0]=3 3414 B16R1.7596 CSCCCCNC(=O)c1ccccc1I 9734ed8b55db3aca118eb1ae414055dd [0,1,0,0,0,0|2,0,0]=3 3415 B16R1.7596 CSCCCCNC(=O)c1ccccc1O 2ba2e3ccad5fd2418848f2a1f053fdd7 [0,1,0,0,0,0|2,0,0]=3 3416 B16R1.7596 CSCCCCNC(=O)c1ccccc1S 09ab21c3cb9939ab4856024c5c171f65 [0,1,0,0,0,0|2,0,0]=3 3417 B16R1.7596 CSCCCCNC(=O)c1cccnc1Br 550b40979072418d64b08d1742b525b1 [0,1,0,0,0,0|3,0,0]=4 3418 B16R1.7596 CSCCCCNC(=O)c1cccnc1C 2781bc4fc56a256d9dc89616c3e7ef71 [0,1,0,0,0,0|3,0,0]=4 3419 B16R1.7596 CSCCCCNC(=O)c1cccnc1Cl e6b7534321b721cab76fbff66d617822 [0,1,0,0,0,0|3,0,0]=4 3420 B16R1.7596 CSCCCCNC(=O)c1cccnc1F ae31a82f0707b567e1ce7496a4ba0242 [0,1,0,0,0,0|3,0,0]=4 3421 B16R1.7596 CSCCCCNC(=O)c1cccnc1I d6f738511b7191c7f0a8ba0f79bfa7c6 [0,1,0,0,0,0|3,0,0]=4 3422 B16R1.7596 CSCCCCNC(=O)c1cccnc1O bf6659f4f345920fbf41f84f19967af7 [0,1,0,0,0,0|3,0,0]=4 3423 B16R1.7596 CSCCCCNC(=O)c1cccnc1S 05d08855a4517fbf7a9446715236e801 [0,1,0,0,0,0|3,0,0]=4 3424 B16R1.7596 CSCCCCNC(=O)c1ccncc1Br e72003e4f176efe84db5336e5432f14e [0,1,0,0,0,0|3,0,0]=4 3425 B16R1.7596 CSCCCCNC(=O)c1ccncc1C 51a18efc9cfc7276aef26661deb9a603 [0,1,0,0,0,0|3,0,0]=4 3426 B16R1.7596 CSCCCCNC(=O)c1ccncc1Cl 0d880a9642e33d59a450a7d080f67b85 [0,1,0,0,0,0|3,0,0]=4 3427 B16R1.7596 CSCCCCNC(=O)c1ccncc1F 81ac2f2273021ededc9b15520a74505a [0,1,0,0,0,0|3,0,0]=4 3428 B16R1.7596 CSCCCCNC(=O)c1ccncc1I 6780f2bad7499cba04318532b3fcbe2b [0,1,0,0,0,0|3,0,0]=4 3429 B16R1.7596 CSCCCCNC(=O)c1ccncc1O 341d9efe3a4c8261a29779483a3448bd [0,1,0,0,0,0|3,0,0]=4 3430 B16R1.7596 CSCCCCNC(=O)c1cnccc1Br 4779022944dda06b5fda7f163473449f [0,1,0,0,0,0|3,0,0]=4 3431 B16R1.7596 CSCCCCNC(=O)c1cnccc1C d9f6bc1006c0dc75f6bdb3eebb1ed41a [0,1,0,0,0,0|3,0,0]=4 3432 B16R1.7596 CSCCCCNC(=O)c1cnccc1Cl 582bc841d41a221b0f02bd19ab1cdbc8 [0,1,0,0,0,0|3,0,0]=4 3433 B16R1.7596 CSCCCCNC(=O)c1cnccc1F 9713c15fd9d7d56e69de6139772d65bb [0,1,0,0,0,0|3,0,0]=4 3434 B16R1.7596 CSCCCCNC(=O)c1cnccc1O 9e10464558a4ad2d5c73f93299b0265f [0,1,0,0,0,0|3,0,0]=4 3435 B16R1.7596 CSCCCCNC(=O)c1ncccc1Br 11654a971560dfeed4159fe9d29c7b3c [0,1,0,0,0,0|3,0,0]=4 3436 B16R1.7596 CSCCCCNC(=O)c1ncccc1C eabb35b01086af3058b138436c2466b0 [0,1,0,0,0,0|3,0,0]=4 3437 B16R1.7596 CSCCCCNC(=O)c1ncccc1Cl cd6478faf0bdd4158d1dbd94f003a3e9 [0,1,0,0,0,0|3,0,0]=4 3438 B16R1.7596 CSCCCCNC(=O)c1ncccc1F 54ee20e19aad69cdac2328f28e9d53e3 [0,1,0,0,0,0|3,0,0]=4 3439 B16R1.7596 CSCCCCNC(=O)c1ncccc1I 920a96be318d53d7d0a945fc895868a0 [0,1,0,0,0,0|3,0,0]=4 3440 B16R1.7596 CSCCCCNC(=O)c1ncccc1O 11831dae39899f4622c09c4408594458 [0,1,0,0,0,0|3,0,0]=4 3441 B16R1.7596 CSCCCNCC(=O)c1ccccc1C e82c8a746861a3e500360c90d9927564 [0,1,0,0,0,0|3,0,0]=4 3442 B16R1.7596 CSCCCNCC(=O)c1ccccc1Cl 9466e0df6edbe3b7c3a313d699e4111d [0,1,0,0,0,0|3,0,0]=4 3443 B16R1.7596 CSCCCNCC(=O)c1ccccc1F 8da7e96bd47f7e2aacf80fd089bf20d7 [0,1,0,0,0,0|3,0,0]=4 3444 B16R1.7596 CSCCCNCC(=O)c1ccccc1I c37acddec21fccb032e5ab1003bed864 [0,1,0,0,0,0|3,0,0]=4 3445 B16R1.7596 CSCCCOCC(=O)c1ccccc1C df12d6dc4b337fd2120ebba5bac0df7d [0,1,0,0,0,0|3,0,0]=4 3446 B16R1.7596 CSCCCOCC(=O)c1ccccc1Cl 64645ca2feab7d3de068764ba0825765 [0,1,0,0,0,0|3,0,0]=4 3447 B16R1.7596 CSCCCOCC(=O)c1ccccc1F dee874547f1f3ea42a56ccb3a13c2208 [0,1,0,0,0,0|3,0,0]=4 3448 B16R1.7596 CSCCCOCC(=O)c1ccccc1I 7ca33c88502e03842271de7150542aea [0,1,0,0,0,0|3,0,0]=4 3449 B16R1.7596 CSCCNCCC(=O)c1ccccc1F 2d7a8f5f3fe45a56c59847b3b199616b [0,1,0,0,0,0|3,0,0]=4 3450 B16R1.7596 CSCCOCCC(=O)c1ccccc1F 85bc21b2fddf24d01e5f87022fab4a9f [0,1,0,0,0,0|3,0,0]=4 3451 B16R1.7596 CSCNCCNC(=O)c1ccccc1Cl e4ce9e6eb3fc1365769d870920101bab [0,1,0,0,0,0|3,0,0]=4 3452 B16R1.7596 CSCNCCNC(=O)c1ccccc1F 8d90b43b372a7295d2c08f9ec84cc60e [0,1,0,0,0,0|3,0,0]=4 3453 B16R1.7596 CSCNCCNC(=O)c1ccccc1I 192154958be3879d841c81ed5966c39d [0,1,0,0,0,0|3,0,0]=4 3454 B16R1.7596 Cc1ccccc1C(=O)CNCCCCCl 84aad0e84823f435b1fc402a13f590d9 [0,1,0,0,0,0|3,0,0]=4 3455 B16R1.7596 Cc1ccccc1C(=O)CNCCCCO 71bee0f7f262fa11dd3274c0357ff7e0 [0,1,0,0,0,0|3,0,0]=4 3456 B16R1.7596 Cc1ccccc1C(=O)CNCCCCS 9c6b0a3f604a77a7ca2163a34af07482 [0,1,0,0,0,0|3,0,0]=4 3457 B16R1.7596 Cc1ccccc1C(=O)COCCCCF 4db23c21894bea9950e5027c09c9369f [0,1,0,0,0,0|3,0,0]=4 3458 B16R1.7596 Cc1ccccc1C(=O)COCCCCS 0a4c1a737ae40bffd6347b8b809b74fd [0,1,0,0,0,0|3,0,0]=4 3459 B16R1.7596 Cc1ccccc1C(=O)NCCCCC#N 4e2b84ead3735a6e99220ef0caae7a19 [0,1,0,0,0,0|2,0,1]=4 3460 B16R1.7596 Cc1ccccc1C(=O)NCCCCCCl ae1b5d5d5f006d45e68cb72ad057f6ef [0,1,0,0,0,0|2,0,0]=3 3461 B16R1.7596 Cc1ccccc1C(=O)NCCCCCO aa02d27149616db139079d706922cf7b [0,1,0,0,0,0|2,0,0]=3 3462 B16R1.7596 Cc1ccccc1C(=O)NCCOCCO 540df73c4d910fa5953b4edd8061a13c [0,1,0,0,0,0|3,0,0]=4 3463 B16R1.7596 Cc1ccccc1C(=O)NCCOCCS 550c54b8246b0aa13aeacf048d0050eb [0,1,0,0,0,0|3,0,0]=4 3464 B16R1.7596 Cc1ccccc1C(=O)NCCSCCO a593f19f8f3464ae36565be8340f8e8c [0,1,0,0,0,0|3,0,0]=4 3465 B16R1.7596 Cc1cccnc1C(=O)NCCCCCCl 7dbd527ec8515f00cbd6345384a52e74 [0,1,0,0,0,0|3,0,0]=4 3466 B16R1.7596 Cc1cccnc1C(=O)NCCCCCO 0c01ab1e2642f8e8a101441cbe0eedc7 [0,1,0,0,0,0|3,0,0]=4 3467 B16R1.7596 Cc1ccncc1C(=O)NCCCCCCl b433b96ec521dbca1a723770c0419f5b [0,1,0,0,0,0|3,0,0]=4 3468 B16R1.7596 Cc1ccncc1C(=O)NCCCCCO cf99734d3ef485922f113010fafc6278 [0,1,0,0,0,0|3,0,0]=4 3469 B16R1.7596 Cc1cnccc1C(=O)NCCCCCCl 3c0f91389177598c8db8f8578ef33abc [0,1,0,0,0,0|3,0,0]=4 3470 B16R1.7596 Cc1cnccc1C(=O)NCCCCCO b29288b70625011636a09d140b904ddc [0,1,0,0,0,0|3,0,0]=4 3471 B16R1.7596 Cc1ncccc1C(=O)NCCCCCCl f46a13ea978bf2382dea7b733efc08c2 [0,1,0,0,0,0|3,0,0]=4 3472 B16R1.7596 Cc1ncccc1C(=O)NCCCCCO 54f5f1ef352b74b72486117e11019374 [0,1,0,0,0,0|3,0,0]=4 3473 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Br e8c46cacddb31405521df43528f9669c [0,1,0,0,0,0|2,0,1]=4 3474 B16R1.7596 N#CCCCCNC(=O)c1ccccc1Cl 4556e2936ce6d905c3879b4bb2af2c40 [0,1,0,0,0,0|2,0,1]=4 3475 B16R1.7596 N#CCCCCNC(=O)c1ccccc1F de5a183a8630628e1eb326ef1ace6eea [0,1,0,0,0,0|2,0,1]=4 3476 B16R1.7596 N#CCCCCNC(=O)c1ccccc1I 203c17c8383f0197a67667e123a852cd [0,1,0,0,0,0|2,0,1]=4 3477 B16R1.7596 N#CCCCCNC(=O)c1ccccc1O bd8f5445de29df59e44da0db0ba47a39 [0,1,0,0,0,0|2,0,1]=4 3478 B16R1.7596 N#CCCCCNC(=O)c1ccccc1S 17fedda536a3f10fbcaf8311951abc8a [0,1,0,0,0,0|2,0,1]=4 3479 B16R1.7596 O=C(CCCNCCBr)c1ccccc1F 14a1d984d5c9cec785b96c42fcc6bc3b [0,1,0,0,0,0|3,0,0]=4 3480 B16R1.7596 O=C(CCCNCCF)c1ccccc1F 02b66a71df65db77bc250e4b503fd0a6 [0,1,0,0,0,0|3,0,0]=4 3481 B16R1.7596 O=C(CCCNCCI)c1ccccc1F 900a4bd5ec7e4a010a82845e5f121a6c [0,1,0,0,0,0|3,0,0]=4 3482 B16R1.7596 O=C(CCCNCCO)c1ccccc1F d3b410d4bf6a8d422141ab99a7ebac84 [0,1,0,0,0,0|3,0,0]=4 3483 B16R1.7596 O=C(CCCNCCS)c1ccccc1F 51d303fdc8ead41a05371b3b64a89639 [0,1,0,0,0,0|3,0,0]=4 3484 B16R1.7596 O=C(CCCOCCF)c1ccccc1F 8214cbf76cdc396f04d4da6b8abffc14 [0,1,0,0,0,0|3,0,0]=4 3485 B16R1.7596 O=C(CCCOCCS)c1ccccc1F d2372fc2cafdaeb7d91bb9677be9d68e [0,1,0,0,0,0|3,0,0]=4 3486 B16R1.7596 O=C(CCNCCCCl)c1ccccc1F 20ed460985d4cb29c48870f95b6c8a1f [0,1,0,0,0,0|3,0,0]=4 3487 B16R1.7596 O=C(CCNCCCO)c1ccccc1F e20523a475055a199a95560150d90b2f [0,1,0,0,0,0|3,0,0]=4 3488 B16R1.7596 O=C(CCOCCCF)c1ccccc1F af38651358ccfabcd0f1f85aedc49e1a [0,1,0,0,0,0|3,0,0]=4 3489 B16R1.7596 O=C(CNCCCCCl)c1ccccc1Br 6d5325f3431fd34be32d110b86a9ad60 [0,1,0,0,0,0|3,0,0]=4 3490 B16R1.7596 O=C(CNCCCCCl)c1ccccc1Cl 8391075a809f918aec08728e7e0ae9f1 [0,1,0,0,0,0|3,0,0]=4 3491 B16R1.7596 O=C(CNCCCCCl)c1ccccc1F 40165596301afce69b1cfb97f6230a99 [0,1,0,0,0,0|3,0,0]=4 3492 B16R1.7596 O=C(CNCCCCCl)c1ccccc1I 3a0e2ace53ef473b2f81b1f2cf0c36b2 [0,1,0,0,0,0|3,0,0]=4 3493 B16R1.7596 O=C(CNCCCCO)c1ccccc1Br 355c313badbd0cdd9959a35548dfd395 [0,1,0,0,0,0|3,0,0]=4 3494 B16R1.7596 O=C(CNCCCCO)c1ccccc1Cl 718f9fc202e98370dc4e3a3dbf169140 [0,1,0,0,0,0|3,0,0]=4 3495 B16R1.7596 O=C(CNCCCCO)c1ccccc1F e2c5c9ae7db87bfdaedf1662fb368ade [0,1,0,0,0,0|3,0,0]=4 3496 B16R1.7596 O=C(CNCCCCO)c1ccccc1I b4be4367a70e1d01a9a814a49816e382 [0,1,0,0,0,0|3,0,0]=4 3497 B16R1.7596 O=C(CNCCCCS)c1ccccc1Br 6b5071e4690bc0352665bec75301252e [0,1,0,0,0,0|3,0,0]=4 3498 B16R1.7596 O=C(CNCCCCS)c1ccccc1Cl 03e50ec3e073ca0fd622fc468d421c47 [0,1,0,0,0,0|3,0,0]=4 3499 B16R1.7596 O=C(CNCCCCS)c1ccccc1F 798c66111da97b975f54682aa59f42c5 [0,1,0,0,0,0|3,0,0]=4 3500 B16R1.7596 O=C(CNCCCCS)c1ccccc1I 9b55cf515940efc3e631190a8f22b42c [0,1,0,0,0,0|3,0,0]=4 3501 B16R1.7596 O=C(COCCCCF)c1ccccc1Cl 74be675b4c3404cf29cd05b9b1fb0319 [0,1,0,0,0,0|3,0,0]=4 3502 B16R1.7596 O=C(COCCCCF)c1ccccc1F 62149a5c5d937c5bd534339f7c1a9560 [0,1,0,0,0,0|3,0,0]=4 3503 B16R1.7596 O=C(COCCCCF)c1ccccc1I 147740af359022078dd1268b67f13ada [0,1,0,0,0,0|3,0,0]=4 3504 B16R1.7596 O=C(COCCCCS)c1ccccc1Br e1ac6041743a9938aba92ff695330ad7 [0,1,0,0,0,0|3,0,0]=4 3505 B16R1.7596 O=C(COCCCCS)c1ccccc1Cl 98e0306c6286ee1a431baed6376c09d0 [0,1,0,0,0,0|3,0,0]=4 3506 B16R1.7596 O=C(COCCCCS)c1ccccc1F 93bff827f9718c3e8e132c91b401f133 [0,1,0,0,0,0|3,0,0]=4 3507 B16R1.7596 O=C(COCCCCS)c1ccccc1I bff920166ea1ff01ff930219e137707b [0,1,0,0,0,0|3,0,0]=4 3508 B16R1.7596 O=C(NCCCCCCl)c1cccc[n+]1[O-] e7caacf2f133af6e93757a104b022c41 [0,1,0,0,0,0|3,0,0]=4 3509 B16R1.7596 O=C(NCCCCCCl)c1ccccc1Br a42851307ec2d92ab3c3763cef52ebce [0,1,0,0,0,0|2,0,0]=3 3510 B16R1.7596 O=C(NCCCCCCl)c1ccccc1Cl 24ca174f58c4a1dc0b34d4553198b6ed [0,1,0,0,0,0|2,0,0]=3 3511 B16R1.7596 O=C(NCCCCCCl)c1ccccc1F 78e17917c871734bde9232355dce8f0f [0,1,0,0,0,0|2,0,0]=3 3512 B16R1.7596 O=C(NCCCCCCl)c1ccccc1I 28084ec4d7b376defa1daedbb114f559 [0,1,0,0,0,0|2,0,0]=3 3513 B16R1.7596 O=C(NCCCCCCl)c1ccccc1O 623bb56d3fcc986f63290c2a4032ccd2 [0,1,0,0,0,0|2,0,0]=3 3514 B16R1.7596 O=C(NCCCCCCl)c1ccccc1S ddecb7c13f6edbbabf219b416e83eb63 [0,1,0,0,0,0|2,0,0]=3 3515 B16R1.7596 O=C(NCCCCCCl)c1cccnc1Br 1f0c78eb5809cbe78da09ac63e799f65 [0,1,0,0,0,0|3,0,0]=4 3516 B16R1.7596 O=C(NCCCCCCl)c1cccnc1Cl bb5b9bc1011c6c564ba50d398d3fd3d0 [0,1,0,0,0,0|3,0,0]=4 3517 B16R1.7596 O=C(NCCCCCCl)c1cccnc1F f2de9842a1841771dc3f4698220d84a0 [0,1,0,0,0,0|3,0,0]=4 3518 B16R1.7596 O=C(NCCCCCCl)c1cccnc1I 5b682fc35f0962a8dc2c2f9110be8d0f [0,1,0,0,0,0|3,0,0]=4 3519 B16R1.7596 O=C(NCCCCCCl)c1cccnc1O bfa9c5e87fd78aad1939d9823eba61a9 [0,1,0,0,0,0|3,0,0]=4 3520 B16R1.7596 O=C(NCCCCCCl)c1cccnc1S 7518eac7b71c942934d48d2eeb12873a [0,1,0,0,0,0|3,0,0]=4 3521 B16R1.7596 O=C(NCCCCCCl)c1ccncc1Br b24f277637238c1009942c432c9e0e23 [0,1,0,0,0,0|3,0,0]=4 3522 B16R1.7596 O=C(NCCCCCCl)c1ccncc1Cl 72a81d986cce1df954e12813ddccd63c [0,1,0,0,0,0|3,0,0]=4 3523 B16R1.7596 O=C(NCCCCCCl)c1ccncc1F 7ac1971ba670944c87355113627e1c42 [0,1,0,0,0,0|3,0,0]=4 3524 B16R1.7596 O=C(NCCCCCCl)c1ccncc1I 7b7f6d31b2b060a3db180dd4e2db0a58 [0,1,0,0,0,0|3,0,0]=4 3525 B16R1.7596 O=C(NCCCCCCl)c1ccncc1O 121de3b5642d79b28317a40880b4bd6f [0,1,0,0,0,0|3,0,0]=4 3526 B16R1.7596 O=C(NCCCCCCl)c1cnccc1Br 4e4c137a7993ddc08c92808f9a46d573 [0,1,0,0,0,0|3,0,0]=4 3527 B16R1.7596 O=C(NCCCCCCl)c1cnccc1Cl e95a6fff98d13f38bf1a9d62d1e8ccc2 [0,1,0,0,0,0|3,0,0]=4 3528 B16R1.7596 O=C(NCCCCCCl)c1cnccc1F fbb3c1567e4923c829896030fa207f16 [0,1,0,0,0,0|3,0,0]=4 3529 B16R1.7596 O=C(NCCCCCCl)c1cnccc1O 333dc05555e4636e52fe2b1532fd5460 [0,1,0,0,0,0|3,0,0]=4 3530 B16R1.7596 O=C(NCCCCCCl)c1ncccc1Br f8b3d51e0bcf576e29f1c24a09bf56d9 [0,1,0,0,0,0|3,0,0]=4 3531 B16R1.7596 O=C(NCCCCCCl)c1ncccc1Cl c72cd785f872435b5c301236eebb6a6c [0,1,0,0,0,0|3,0,0]=4 3532 B16R1.7596 O=C(NCCCCCCl)c1ncccc1F 30884883406a74ca438714de846a2d5d [0,1,0,0,0,0|3,0,0]=4 3533 B16R1.7596 O=C(NCCCCCCl)c1ncccc1I 400d2ecca155b14b27acce6718519342 [0,1,0,0,0,0|3,0,0]=4 3534 B16R1.7596 O=C(NCCCCCCl)c1ncccc1O ded853f9f530ab377f3290fb931b62f5 [0,1,0,0,0,0|3,0,0]=4 3535 B16R1.7596 O=C(NCCCCCO)c1cccc[n+]1[O-] 650230e4f9e271cdebe44b9eac35dcf9 [0,1,0,0,0,0|3,0,0]=4 3536 B16R1.7596 O=C(NCCCCCO)c1ccccc1Br 05b3ff0ab4702951a529650a25185592 [0,1,0,0,0,0|2,0,0]=3 3537 B16R1.7596 O=C(NCCCCCO)c1ccccc1Cl b2f0bf12cb7740217abe5631088fe0d3 [0,1,0,0,0,0|2,0,0]=3 3538 B16R1.7596 O=C(NCCCCCO)c1ccccc1F 76e44693a84c7edcb82cdd378d5e169e [0,1,0,0,0,0|2,0,0]=3 3539 B16R1.7596 O=C(NCCCCCO)c1ccccc1I 31548bcc8f6caacdb989a18b58c86012 [0,1,0,0,0,0|2,0,0]=3 3540 B16R1.7596 O=C(NCCCCCO)c1ccccc1O ae91095149af2a89234b08f06debd9f5 [0,1,0,0,0,0|2,0,0]=3 3541 B16R1.7596 O=C(NCCCCCO)c1ccccc1S 49d77c3d88b86884f2e7cb9bca6e8d0a [0,1,0,0,0,0|2,0,0]=3 3542 B16R1.7596 O=C(NCCCCCO)c1cccnc1Br 9be265f2f94fcb46aba2cdbe20640d56 [0,1,0,0,0,0|3,0,0]=4 3543 B16R1.7596 O=C(NCCCCCO)c1cccnc1Cl 4b3a3ebdaa0af817363b0ad95205b77e [0,1,0,0,0,0|3,0,0]=4 3544 B16R1.7596 O=C(NCCCCCO)c1cccnc1F 2e38a6feed05af333636fb9e0ac62f25 [0,1,0,0,0,0|3,0,0]=4 3545 B16R1.7596 O=C(NCCCCCO)c1cccnc1I e694e06b9fc518593e3e442f4ad5b361 [0,1,0,0,0,0|3,0,0]=4 3546 B16R1.7596 O=C(NCCCCCO)c1cccnc1O ccbc1c7c5bc8d0697016069686ff2bac [0,1,0,0,0,0|3,0,0]=4 3547 B16R1.7596 O=C(NCCCCCO)c1cccnc1S 279cb5f8b40f05fd1bb9a2c8a4918292 [0,1,0,0,0,0|3,0,0]=4 3548 B16R1.7596 O=C(NCCCCCO)c1ccncc1Br 6684de8d9608a9c42ba77e37eb8614f2 [0,1,0,0,0,0|3,0,0]=4 3549 B16R1.7596 O=C(NCCCCCO)c1ccncc1Cl 565b4213f325b4ba1ab2de0a74a15de1 [0,1,0,0,0,0|3,0,0]=4 3550 B16R1.7596 O=C(NCCCCCO)c1ccncc1F 677146d521a46e12f86d8c62454457b6 [0,1,0,0,0,0|3,0,0]=4 3551 B16R1.7596 O=C(NCCCCCO)c1ccncc1I 322e1bed9dca2cdd8cca57a005d0bef8 [0,1,0,0,0,0|3,0,0]=4 3552 B16R1.7596 O=C(NCCCCCO)c1ccncc1O d5d769e07bf7c3936ba22d22f42ea3e9 [0,1,0,0,0,0|3,0,0]=4 3553 B16R1.7596 O=C(NCCCCCO)c1cnccc1Br 108e7581ae1ab8691e6f9b3aa056fcca [0,1,0,0,0,0|3,0,0]=4 3554 B16R1.7596 O=C(NCCCCCO)c1cnccc1Cl 7afa3e30d8fa33b5d9368b7d677a1603 [0,1,0,0,0,0|3,0,0]=4 3555 B16R1.7596 O=C(NCCCCCO)c1cnccc1F ab3f3d968af787f1686e4008cb1f3686 [0,1,0,0,0,0|3,0,0]=4 3556 B16R1.7596 O=C(NCCCCCO)c1cnccc1O 6a8368f5592a30aa6243b0f0f6f82fe3 [0,1,0,0,0,0|3,0,0]=4 3557 B16R1.7596 O=C(NCCCCCO)c1ncccc1Br 0e1c7d8bc0d75ca67dbdf18b67de36e1 [0,1,0,0,0,0|3,0,0]=4 3558 B16R1.7596 O=C(NCCCCCO)c1ncccc1Cl 17b094e8f9775cc60122e39930110a3f [0,1,0,0,0,0|3,0,0]=4 3559 B16R1.7596 O=C(NCCCCCO)c1ncccc1F 69e5f02e836c5a400d36e96a2bed1327 [0,1,0,0,0,0|3,0,0]=4 3560 B16R1.7596 O=C(NCCCCCO)c1ncccc1I d41f274cf798bec234886ddb7462e8ce [0,1,0,0,0,0|3,0,0]=4 3561 B16R1.7596 O=C(NCCCCCO)c1ncccc1O fc4b34dc073fb52d3fdc17d10bca5d4b [0,1,0,0,0,0|3,0,0]=4 3562 B16R1.7596 O=C(NCCNCCF)c1ccccc1Cl 961a54173345895d9111ae27a8c12478 [0,1,0,0,0,0|3,0,0]=4 3563 B16R1.7596 O=C(NCCNCCF)c1ccccc1F ba3b50a7e9d9de816ef9d4b538fb8929 [0,1,0,0,0,0|3,0,0]=4 3564 B16R1.7596 O=C(NCCNCCF)c1ccccc1I 4d25b1a7f543685403ed4b4286f5ba24 [0,1,0,0,0,0|3,0,0]=4 3565 B16R1.7596 O=C(NCCNCCO)c1ccccc1Cl 576a403c9b027d15abfd6881fb649372 [0,1,0,0,0,0|3,0,0]=4 3566 B16R1.7596 O=C(NCCNCCO)c1ccccc1F 76886538e864a2c8033c891043455345 [0,1,0,0,0,0|3,0,0]=4 3567 B16R1.7596 O=C(NCCNCCO)c1ccccc1I 9667cbad89f06584e930dc5c1e7eb629 [0,1,0,0,0,0|3,0,0]=4 3568 B16R1.7596 O=C(NCCNCCS)c1ccccc1Cl cc98470d41e68a70bbc087b685fd09fc [0,1,0,0,0,0|3,0,0]=4 3569 B16R1.7596 O=C(NCCNCCS)c1ccccc1F 57949d02ed0e8baccb4a463aea57bbb7 [0,1,0,0,0,0|3,0,0]=4 3570 B16R1.7596 O=C(NCCNCCS)c1ccccc1I fdd517889f812973fcff0f14e46d0d2a [0,1,0,0,0,0|3,0,0]=4 3571 B16R1.7596 O=C(NCCOCCO)c1ccccc1Br 1694cab206bf5d4b4083b909a43f8a8f [0,1,0,0,0,0|3,0,0]=4 3572 B16R1.7596 O=C(NCCOCCO)c1ccccc1Cl 52464f4886f4b794b60d6e39eead370f [0,1,0,0,0,0|3,0,0]=4 3573 B16R1.7596 O=C(NCCOCCO)c1ccccc1F 292595047668f9c78b73f51eca84dc93 [0,1,0,0,0,0|3,0,0]=4 3574 B16R1.7596 O=C(NCCOCCO)c1ccccc1I 091d17c8af071a13f61371f9c8db4901 [0,1,0,0,0,0|3,0,0]=4 3575 B16R1.7596 O=C(NCCOCCO)c1ccccc1O 62eb6c28bfc5a8a8dea1eedf283e19e5 [0,1,0,0,0,0|3,0,0]=4 3576 B16R1.7596 O=C(NCCOCCO)c1ccccc1S 7ef39169dc7af472c10b4cbec5c29817 [0,1,0,0,0,0|3,0,0]=4 3577 B16R1.7596 O=C(NCCOCCS)c1ccccc1Br 8787350e2360aa8dee447faef229f11e [0,1,0,0,0,0|3,0,0]=4 3578 B16R1.7596 O=C(NCCOCCS)c1ccccc1Cl a866d9b948c1d8a350852abd7608f86e [0,1,0,0,0,0|3,0,0]=4 3579 B16R1.7596 O=C(NCCOCCS)c1ccccc1F 009076a6979d5121d194e504c1c53e5c [0,1,0,0,0,0|3,0,0]=4 3580 B16R1.7596 O=C(NCCOCCS)c1ccccc1I bccb7f954cd8b3352ea7a1f695097143 [0,1,0,0,0,0|3,0,0]=4 3581 B16R1.7596 O=C(NCCOCCS)c1ccccc1O cd9151cf5237f9979d851c8fe6ed2b8b [0,1,0,0,0,0|3,0,0]=4 3582 B16R1.7596 O=C(NCCOCCS)c1ccccc1S dfa22ccab89f815200289e22195ab4b4 [0,1,0,0,0,0|3,0,0]=4 3583 B16R1.7596 O=C(NCCSCCO)c1ccccc1Br 95bf479233fb86c7bf0f443db5185056 [0,1,0,0,0,0|3,0,0]=4 3584 B16R1.7596 O=C(NCCSCCO)c1ccccc1Cl 42f29a42c62fdb82a0abcdb71139d648 [0,1,0,0,0,0|3,0,0]=4 3585 B16R1.7596 O=C(NCCSCCO)c1ccccc1F b766b27114533de43c43acc13ce513b3 [0,1,0,0,0,0|3,0,0]=4 3586 B16R1.7596 O=C(NCCSCCO)c1ccccc1I a6d953220796cc8dd8dd7404f611fdbc [0,1,0,0,0,0|3,0,0]=4 3587 B16R1.7596 O=C(NCCSCCO)c1ccccc1O 0a369b64101f97c1a28cbd0a5ba643c3 [0,1,0,0,0,0|3,0,0]=4 3588 B16R1.7596 O=C(NCCSCCO)c1ccccc1S 5c72c35c2cba11616e602c3fcf78bd0d [0,1,0,0,0,0|3,0,0]=4 3589 B16R2.88 CC(OC1CCCCC1)c2ccccc2 05cacaa14cf61327499c9d6927a967a3 [0,0,0,1,0,0|1,0,1]=3 3590 B16R2.88 CC(OC1CCCCC1)c2ccccn2 1398d136034816891f6582d3b0d68378 [0,0,0,1,0,0|2,0,1]=4 3591 B16R2.88 CC(OC1CCCCC1)c2cccnc2 8661b97b7a26ce45f6ae3a143f7a8279 [0,0,0,1,0,0|2,0,1]=4 3592 B16R2.88 CC(OC1CCCCC1)c2ccncc2 c033d642cbf20339a9e407ec8d250e46 [0,0,0,1,0,0|2,0,1]=4 3593 B16R2.88 CC(OC1CCCCO1)c2ccccc2 e2a85706e54ce0d7db958b1757f646be [0,0,0,1,0,0|2,0,1]=4 3594 B16R2.88 CC(OC1CCSCC1)c2ccccc2 4435f47482a2b5b6014bafc4e73d4519 [0,0,0,1,0,0|2,0,1]=4 3595 B16R2.88 CN(CC1CCCCC1)c2ccccc2 90467fa69290e2b84e8d7aa7fdbd8f61 [0,0,0,1,0,0|3,0,0]=4 3596 B16R2.88 C[C@@H](OC1CCCCC1)c2ccccc2 23538b46a38254245092d979b4103eed [0,0,0,1,0,0|1,0,1]=3 3597 B16R2.88 C[C@@H](OC1CCCCC1)c2ccccn2 ea1ef9d08f23cb2dadf7977286a89774 [0,0,0,1,0,0|2,0,1]=4 3598 B16R2.88 C[C@@H](OC1CCCCC1)c2cccnc2 b27988cf67434b53dcf6987ebfbee6f1 [0,0,0,1,0,0|2,0,1]=4 3599 B16R2.88 C[C@@H](OC1CCCCC1)c2ccncc2 ddfe40261dc7d8efc8db1de74eb217cf [0,0,0,1,0,0|2,0,1]=4 3600 B16R2.88 C[C@@H](OC1CCCCO1)c2ccccc2 7bdbaa1d69f46b7f5f5bed948b3d65b8 [0,0,0,1,0,0|2,0,1]=4 3601 B16R2.88 C[C@@H](OC1CCSCC1)c2ccccc2 fc91470a9f16943ede9864d2bb76bb49 [0,0,0,1,0,0|2,0,1]=4 3602 B16R2.88 C[C@H](OC1CCCCC1)c2ccccc2 7dbbae1b272034e49ebb3babbe6fd11a [0,0,0,1,0,0|1,0,1]=3 3603 B16R2.88 C[C@H](OC1CCCCC1)c2ccccn2 116f8d1b2f085107115a6367d66502a1 [0,0,0,1,0,0|2,0,1]=4 3604 B16R2.88 C[C@H](OC1CCCCC1)c2cccnc2 2b55c8feb8474e647e0855f1a76a82f1 [0,0,0,1,0,0|2,0,1]=4 3605 B16R2.88 C[C@H](OC1CCCCC1)c2ccncc2 924625a0d92c191d10555a2c42c9975e [0,0,0,1,0,0|2,0,1]=4 3606 B16R2.88 C[C@H](OC1CCCCO1)c2ccccc2 a9ed2b408517598b75c33dc3e5e509b0 [0,0,0,1,0,0|2,0,1]=4 3607 B16R2.88 C[C@H](OC1CCSCC1)c2ccccc2 acd0196a312c8b4e4df6dcc60ef8556a [0,0,0,1,0,0|2,0,1]=4 3608 B16R2.88 O=C(CN1CCCOC1)c2ccccc2 063d5e808e35d0bb3dd39c1e9f820a34 [0,0,0,1,0,0|3,0,0]=4 3609 B16R2.88 O=C(CN1CCCSC1)c2ccccc2 02c040916018026bd7248d9ae101cae7 [0,0,0,1,0,0|3,0,0]=4 3610 B16R2.88 O=C(CN1CCOCC1)c2ccccc2 eab4d4dd315c1440b136ccb76a8c3da7 [0,0,0,1,0,0|3,0,0]=4 3611 B16R2.88 O=C(CN1CCSCC1)c2ccccc2 df7059522cec966b2abf69b2c2de1c81 [0,0,0,1,0,0|3,0,0]=4 3612 B16R2.88 O=C(NC1C=CCCC1)c2ccccc2 22d475499803ae587d3b5e35bd4b5321 [0,0,0,1,0,0|1,0,2]=4 3613 B16R2.88 O=C(NC1CCCOC1)c2ccccc2 9b7d8d47b397af1ff8c47976620734db [0,0,0,1,0,0|2,0,0]=3 3614 B16R2.88 O=C(NC1CCCOC1)c2ccccn2 8c2e8f8fc03ac75d1027a81e1814d7cb [0,0,0,1,0,0|3,0,0]=4 3615 B16R2.88 O=C(NC1CCCOC1)c2cccnc2 edc8516fb3b8b1085dfed5a1f208ab20 [0,0,0,1,0,0|3,0,0]=4 3616 B16R2.88 O=C(NC1CCCOC1)c2ccncc2 49967dd1a34755085b9979b678681ecc [0,0,0,1,0,0|3,0,0]=4 3617 B16R2.88 O=C(NC1CCOCC1)c2ccccc2 a2f3a3a195a32f90ab2d73be3e66c448 [0,0,0,1,0,0|2,0,0]=3 3618 B16R2.88 O=C(NC1CCOCC1)c2ccccn2 a6f969b4dc878dd276a6407be271284b [0,0,0,1,0,0|3,0,0]=4 3619 B16R2.88 O=C(NC1CCOCC1)c2cccnc2 8f52796e9b00e8dceee4eac13f31fa1b [0,0,0,1,0,0|3,0,0]=4 3620 B16R2.88 O=C(NC1CCOCC1)c2ccncc2 7437b0d5a85788b8524f919f0aae2d8d [0,0,0,1,0,0|3,0,0]=4 3621 B16R2.88 O=C(NC1CCSCC1)c2ccccc2 425edd9cb6c48caa9fe95411db7cd510 [0,0,0,1,0,0|2,0,0]=3 3622 B16R2.88 O=C(NC1CCSCC1)c2ccccn2 b46d1d20e6058177c9159c8820797bcc [0,0,0,1,0,0|3,0,0]=4 3623 B16R2.88 O=C(NC1CCSCC1)c2cccnc2 46c3318bd0939d86c7480ff8d1d1df9e [0,0,0,1,0,0|3,0,0]=4 3624 B16R2.88 O=C(NC1CCSCC1)c2ccncc2 e21b14bc0d89b22ed89a9acf76229f73 [0,0,0,1,0,0|3,0,0]=4 3625 B16R2.88 O=C(NC1CSCSC1)c2ccccc2 f8eed342531259c02c09ab46361f2368 [0,0,0,1,0,0|3,0,0]=4 3626 B16R2.88 O=C(N[C@@H]1CCCOC1)c2ccccc2 79eba11edf990aec05a3f3efdfc8d96f [0,0,0,1,0,0|2,0,0]=3 3627 B16R2.88 O=C(N[C@@H]1CCCOC1)c2ccccn2 e45c89570353ecdbadc9086fa6de0065 [0,0,0,1,0,0|3,0,0]=4 3628 B16R2.88 O=C(N[C@@H]1CCCOC1)c2cccnc2 0f73369aa133d064adabfe1eeeeac1ae [0,0,0,1,0,0|3,0,0]=4 3629 B16R2.88 O=C(N[C@@H]1CCCOC1)c2ccncc2 d08354887bbddb7079ebebf0912fd47c [0,0,0,1,0,0|3,0,0]=4 3630 B16R2.88 O=C(N[C@H]1CCCOC1)c2ccccc2 5ccb1145801ded81bc04e2bb6d71e6fe [0,0,0,1,0,0|2,0,0]=3 3631 B16R2.88 O=C(N[C@H]1CCCOC1)c2ccccn2 c7ebb5e566eb0f4726365b5b18c209c8 [0,0,0,1,0,0|3,0,0]=4 3632 B16R2.88 O=C(N[C@H]1CCCOC1)c2cccnc2 2bcb9aa5a5ef772538667e30b9221f1f [0,0,0,1,0,0|3,0,0]=4 3633 B16R2.88 O=C(N[C@H]1CCCOC1)c2ccncc2 31152bd2969cd0a5ff5bd45f5863e257 [0,0,0,1,0,0|3,0,0]=4 3634 B16R2.94 CCCN1CCOC(C1)c2ccccc2 d3660e20acca188647c4bc2572e1b8d8 [0,0,0,1,0,0|2,0,1]=4 3635 B16R2.94 CCCN1CCO[C@@H](C1)c2ccccc2 9f4d818270d4eec01ad0082c795ec311 [0,0,0,1,0,0|2,0,1]=4 3636 B16R2.94 CCCN1CCO[C@H](C1)c2ccccc2 f88338264175f447cc2d925daa250b25 [0,0,0,1,0,0|2,0,1]=4 3637 B16R2.94 CCNC1CCOC(C1)c2ccccc2 8bcc6c0848ac2f20ad197889736c8888 [0,0,0,1,0,0|2,0,1]=4 3638 B16R2.94 CCOC1CCOC(C1)c2ccccc2 6b0ae84bebc257977929474e00ad033a [0,0,0,1,0,0|2,0,1]=4 3639 B16R2.150 CCCOC1C=C(CC1)c2ccccc2 1a5932c02ad5206602ffb87107e389d1 [0,0,0,1,0,0|3,0,0]=4 3640 B16R2.285 C=C(CN[C@@H]1CC[C@H]1C)c2ccccc2 2822e8c6512200fb5e4ace056213a64e [0,0,0,1,0,0|3,0,0]=4 3641 B16R2.285 C=C(CN[C@H]1CC[C@H]1C)c2ccccc2 501f922e1dc80137d8218a9a22f93994 [0,0,0,1,0,0|3,0,0]=4 3642 B16R2.285 CC1OCC1NCC(=O)c2ccccc2 525ede587b85ab5266759d52ff282c75 [0,0,0,1,0,0|3,0,0]=4 3643 B16R2.285 CC1OCC1OCC(=O)c2ccccc2 123534a3dc27003620367f4fccd6926b [0,0,0,1,0,0|3,0,0]=4 3644 B16R2.285 CN1CCC1CNC(=O)c2ccccc2 e6b99246152a4f8240f7e736f43c5fe4 [0,0,0,1,0,0|2,0,0]=3 3645 B16R2.285 CN1CCC1CNC(=O)c2ccccn2 249e44afd86f051faef27c81baa031ec [0,0,0,1,0,0|3,0,0]=4 3646 B16R2.285 CN1CCC1CNC(=O)c2cccnc2 e7ad3e724b0c2e32b195958af1d0170b [0,0,0,1,0,0|3,0,0]=4 3647 B16R2.285 CN1CCC1CNC(=O)c2ccncc2 775fea2721b3e937c5827ea8f2fb515c [0,0,0,1,0,0|3,0,0]=4 3648 B16R2.285 C[C@@H]1CC[C@@H]1NCC(=O)c2ccccc2 01943e6fce612e3931898abe85681346 [0,0,0,1,0,0|2,0,0]=3 3649 B16R2.285 C[C@@H]1CC[C@@H]1NCC(=O)c2ccccn2 a7aec212589061d03e29eaa884d80b39 [0,0,0,1,0,0|3,0,0]=4 3650 B16R2.285 C[C@@H]1CC[C@@H]1NCC(=O)c2cccnc2 7c47ee12ed78f92ae77e2a0bd4c25fef [0,0,0,1,0,0|3,0,0]=4 3651 B16R2.285 C[C@@H]1CC[C@@H]1NCS(=O)c2ccccc2 a32ab20f81fc6a16a36e21a3e3a58a55 [0,0,0,1,0,0|3,0,0]=4 3652 B16R2.285 C[C@@H]1CC[C@H]1NCC(=O)c2ccccc2 84e11ff5e6a2180e8ce652edc3a9b020 [0,0,0,1,0,0|2,0,0]=3 3653 B16R2.285 C[C@@H]1CC[C@H]1NCC(=O)c2ccccn2 5964882415de22d57a1dc3c434cd5d31 [0,0,0,1,0,0|3,0,0]=4 3654 B16R2.285 C[C@@H]1CC[C@H]1NCC(=O)c2cccnc2 d7b7f38b873cac522ad60c591b652891 [0,0,0,1,0,0|3,0,0]=4 3655 B16R2.285 C[C@@H]1CC[C@H]1NCS(=O)c2ccccc2 9d8dc101a5334c329b052de8f507c892 [0,0,0,1,0,0|3,0,0]=4 3656 B16R2.285 O=C(CNC1CCC1F)c2ccccc2 0595ddffab46ce40750d0bdbf0b1de4f [0,0,0,1,0,0|3,0,0]=4 3657 B16R2.285 O=C(CNC1CCC1O)c2ccccc2 7504db8e6c397ed9335b1b9fa5cb522f [0,0,0,1,0,0|3,0,0]=4 3658 B16R2.285 O=C(CN[C@@H]1CC[C@@H]1O)c2ccccc2 7c1f70b533efe2a70b42ca83488560ac [0,0,0,1,0,0|3,0,0]=4 3659 B16R2.285 O=C(CN[C@@H]1CC[C@H]1O)c2ccccc2 4ac8338ad39f8ea3ff130c941dfb5666 [0,0,0,1,0,0|3,0,0]=4 3660 B16R2.285 O=C(CN[C@H]1CC[C@@H]1O)c2ccccc2 ef8e0240e6d369e032123b83d815550a [0,0,0,1,0,0|3,0,0]=4 3661 B16R2.285 O=C(CN[C@H]1CC[C@H]1O)c2ccccc2 9785ff3ec05dbe1e013ab45eda5d50d2 [0,0,0,1,0,0|3,0,0]=4 3662 B16R2.522 C=C(CNCC1CCC1)c2ccccc2 39e0443adfb6a1e0e8dfb5885d2af797 [0,0,0,1,0,0|3,0,0]=4 3663 B16R2.522 C=C(COCC1CCC1)c2ccccc2 25f12cce15c892c660556ce7820c240d [0,0,0,1,0,0|3,0,0]=4 3664 B16R2.522 CC(NCCC1CCC1)c2ccccc2 bba1e86d5c12fd88ce71cfff43bbe641 [0,0,0,1,0,0|2,0,1]=4 3665 B16R2.522 CC(OCCC1CCC1)c2ccccc2 a25c70dec813e63234b2c906034b666a [0,0,0,1,0,0|1,0,1]=3 3666 B16R2.522 CC(OCCC1CCC1)c2ccccn2 19681b98ec5082b3928674b0957f8716 [0,0,0,1,0,0|2,0,1]=4 3667 B16R2.522 CC(OCCC1CCC1)c2cccnc2 b145f2c39680b6906abd606956f0dcf4 [0,0,0,1,0,0|2,0,1]=4 3668 B16R2.522 CC(OCCC1CCC1)c2ccncc2 3b06dea1ca3ca31b177b54052cd20078 [0,0,0,1,0,0|2,0,1]=4 3669 B16R2.522 CC(OCCC1CCO1)c2ccccc2 e495d35204522e2bbb027cd80bf72c4b [0,0,0,1,0,0|2,0,1]=4 3670 B16R2.522 CC(OCCC1COC1)c2ccccc2 b402bd90b9711129a07f33fdae9cd190 [0,0,0,1,0,0|2,0,1]=4 3671 B16R2.522 CC(OCC[C@@H]1CCO1)c2ccccc2 d58cbd6e663f0623a1e9e819b41d79cf [0,0,0,1,0,0|2,0,1]=4 3672 B16R2.522 CC(OCC[C@H]1CCO1)c2ccccc2 b073f3b3102ae849c03e5606ca0e67c4 [0,0,0,1,0,0|2,0,1]=4 3673 B16R2.522 C[C@@H](NCCC1CCC1)c2ccccc2 e1dc1ed5fbe9387fe4b9c5a18b354b0d [0,0,0,1,0,0|2,0,1]=4 3674 B16R2.522 C[C@@H](OCCC1CCC1)c2ccccc2 5f8ea25e8bbe5889289a11eb5d88d328 [0,0,0,1,0,0|1,0,1]=3 3675 B16R2.522 C[C@@H](OCCC1CCC1)c2ccccn2 f2fd736bf8a1b0c07b75e7a53b89502a [0,0,0,1,0,0|2,0,1]=4 3676 B16R2.522 C[C@@H](OCCC1CCC1)c2cccnc2 e23069fe7c87db1bcc1dad9f1a62ae91 [0,0,0,1,0,0|2,0,1]=4 3677 B16R2.522 C[C@@H](OCCC1CCC1)c2ccncc2 6e049277f2ea65f26dc07be95bc48556 [0,0,0,1,0,0|2,0,1]=4 3678 B16R2.522 C[C@@H](OCCC1CCO1)c2ccccc2 d7f6c80133a0c99415bc132e30b644d2 [0,0,0,1,0,0|2,0,1]=4 3679 B16R2.522 C[C@@H](OCCC1COC1)c2ccccc2 649e011f3d4cb7d2da87b10045188b41 [0,0,0,1,0,0|2,0,1]=4 3680 B16R2.522 C[C@@H](OCC[C@@H]1CCO1)c2ccccc2 44b41d69a31137e37e9f9d5452e884af [0,0,0,1,0,0|2,0,1]=4 3681 B16R2.522 C[C@@H](OCC[C@H]1CCO1)c2ccccc2 1f2beee4f885b93276919a94f8125ef1 [0,0,0,1,0,0|2,0,1]=4 3682 B16R2.522 C[C@H](NCCC1CCC1)c2ccccc2 5f8c94cf4cb967e53e029740e87f061f [0,0,0,1,0,0|2,0,1]=4 3683 B16R2.522 C[C@H](OCCC1CCC1)c2ccccc2 afbfb93ca220db2e264f9beeaeb248de [0,0,0,1,0,0|1,0,1]=3 3684 B16R2.522 C[C@H](OCCC1CCC1)c2ccccn2 af1780b42eff419bd983ebb928b9a6ce [0,0,0,1,0,0|2,0,1]=4 3685 B16R2.522 C[C@H](OCCC1CCC1)c2cccnc2 3e448bbe7f8c58556121421174f750e4 [0,0,0,1,0,0|2,0,1]=4 3686 B16R2.522 C[C@H](OCCC1CCC1)c2ccncc2 a2d1255cbe0a4cc7d1fa393e2fc160d9 [0,0,0,1,0,0|2,0,1]=4 3687 B16R2.522 C[C@H](OCCC1CCO1)c2ccccc2 d7f6051da1fc60820dea2959343312d0 [0,0,0,1,0,0|2,0,1]=4 3688 B16R2.522 C[C@H](OCCC1COC1)c2ccccc2 6d5a43d834b040541f751b17ab9902d6 [0,0,0,1,0,0|2,0,1]=4 3689 B16R2.522 C[C@H](OCC[C@@H]1CCO1)c2ccccc2 612e6577fe0e959c8f096ca0161f0b15 [0,0,0,1,0,0|2,0,1]=4 3690 B16R2.522 C[C@H](OCC[C@H]1CCO1)c2ccccc2 a4046159c741cb0a51c8cceebef65c34 [0,0,0,1,0,0|2,0,1]=4 3691 B16R2.522 O=C(CCOC1CCC1)c2ccccc2 cf1239e40238560eecea6328a2491835 [0,0,0,1,0,0|2,0,0]=3 3692 B16R2.522 O=C(CCOC1COC1)c2ccccc2 20874cb4164b3c715a7ef8c0088ab972 [0,0,0,1,0,0|3,0,0]=4 3693 B16R2.522 O=C(CNCC1CCC1)c2ccccc2 12e1db1dc78ba24dd84fd2d5bd91353d [0,0,0,1,0,0|2,0,0]=3 3694 B16R2.522 O=C(CNCC1CCC1)c2ccccn2 6328b0fd378c0360cae23b1c12a73e63 [0,0,0,1,0,0|3,0,0]=4 3695 B16R2.522 O=C(CNCC1CCC1)c2cccnc2 4adaf6db2d17fb93bf1dbd485e78b6a9 [0,0,0,1,0,0|3,0,0]=4 3696 B16R2.522 O=C(CNCC1CCO1)c2ccccc2 87cfb270cb34c96b907e38fcf1a9725e [0,0,0,1,0,0|3,0,0]=4 3697 B16R2.522 O=C(CNCC1COC1)c2ccccc2 8e539cdb22ada3c2be9ba4892b6003d1 [0,0,0,1,0,0|3,0,0]=4 3698 B16R2.522 O=C(CNC[C@@H]1CCO1)c2ccccc2 41f3504cfcc1f140910fdb8d83cc2475 [0,0,0,1,0,0|3,0,0]=4 3699 B16R2.522 O=C(CNC[C@H]1CCO1)c2ccccc2 770f4e005e81e3dbaa2e5e0422c6e49b [0,0,0,1,0,0|3,0,0]=4 3700 B16R2.522 O=C(COCC1CCC1)c2ccccc2 21701b346ce60959d750324e86b97bc2 [0,0,0,1,0,0|2,0,0]=3 3701 B16R2.522 O=C(COCC1CCC1)c2ccccn2 0f2cc8e48d4f7eb7173a84676c4d4f61 [0,0,0,1,0,0|3,0,0]=4 3702 B16R2.522 O=C(COCC1CCC1)c2cccnc2 fbd4f856b8501bfa0fe8d1d752c40839 [0,0,0,1,0,0|3,0,0]=4 3703 B16R2.522 O=C(COCC1CCO1)c2ccccc2 8a2a957754e8ec89297861f2ed9720b6 [0,0,0,1,0,0|3,0,0]=4 3704 B16R2.522 O=C(COCC1COC1)c2ccccc2 f931f402461c6f14660cc02906524239 [0,0,0,1,0,0|3,0,0]=4 3705 B16R2.522 O=C(COCC1CSC1)c2ccccc2 f46edea2c5a9bc4729860b071c754cd0 [0,0,0,1,0,0|3,0,0]=4 3706 B16R2.522 O=C(COC[C@@H]1CCO1)c2ccccc2 5636627a45982b80eeb128d7c49d33f4 [0,0,0,1,0,0|3,0,0]=4 3707 B16R2.522 O=C(COC[C@H]1CCO1)c2ccccc2 1c5fa400df4628ca9a0244d1b225d4f4 [0,0,0,1,0,0|3,0,0]=4 3708 B16R2.522 O=C(NCCC1CCC1)c2ccccc2 74e8aca42315eb37d5470cac08b26e51 [0,0,0,1,0,0|1,0,0]=2 3709 B16R2.522 O=C(NCCC1CCC1)c2ccccn2 1a5d5e5abb4f42b2f03cb5703f7d3b69 [0,0,0,1,0,0|2,0,0]=3 3710 B16R2.522 O=C(NCCC1CCC1)c2cccnc2 2abb916232fb9e9e4065ea2325b2117f [0,0,0,1,0,0|2,0,0]=3 3711 B16R2.522 O=C(NCCC1CCC1)c2cccnn2 29c8ae235b9efda27a5aa9b1bb0b77e3 [0,0,0,1,0,0|3,0,0]=4 3712 B16R2.522 O=C(NCCC1CCC1)c2ccncc2 06da4580af90c566a6bf5aa0d65df47d [0,0,0,1,0,0|2,0,0]=3 3713 B16R2.522 O=C(NCCC1CCC1)c2ccncn2 cfdd03492e09384d1475c33df8f87260 [0,0,0,1,0,0|3,0,0]=4 3714 B16R2.522 O=C(NCCC1CCC1)c2ccnnc2 2a96feb838de5af012d12037ff193aae [0,0,0,1,0,0|3,0,0]=4 3715 B16R2.522 O=C(NCCC1CCC1)c2cnccn2 818b72a252c526ea7e2b977a22cbec0d [0,0,0,1,0,0|3,0,0]=4 3716 B16R2.522 O=C(NCCC1CCC1)c2cncnc2 cbf239dc1e1454c8cbc57a640d8ceeec [0,0,0,1,0,0|3,0,0]=4 3717 B16R2.522 O=C(NCCC1CCC1)c2ncccn2 64e7efa26099c0a5fd132ad976a95a25 [0,0,0,1,0,0|3,0,0]=4 3718 B16R2.522 O=C(NCCC1CCO1)c2ccccc2 2ba0a135049340a7c8222a844d2bb927 [0,0,0,1,0,0|2,0,0]=3 3719 B16R2.522 O=C(NCCC1CCO1)c2ccccn2 9a3a7405d642bae782d08955f37446e4 [0,0,0,1,0,0|3,0,0]=4 3720 B16R2.522 O=C(NCCC1CCO1)c2cccnc2 03d12b6dc69bb6929f1bf558cf0002cb [0,0,0,1,0,0|3,0,0]=4 3721 B16R2.522 O=C(NCCC1CCO1)c2ccncc2 20bfea6e15fa48665c68673567f50d40 [0,0,0,1,0,0|3,0,0]=4 3722 B16R2.522 O=C(NCCC1COC1)c2ccccc2 c7cb32a02e0fe7b85580130a3e199baf [0,0,0,1,0,0|2,0,0]=3 3723 B16R2.522 O=C(NCCC1COC1)c2ccccn2 95162af762333930141ba138ac4d37c6 [0,0,0,1,0,0|3,0,0]=4 3724 B16R2.522 O=C(NCCC1COC1)c2cccnc2 ea34eeef4a6b3efe81ab6ebec93434de [0,0,0,1,0,0|3,0,0]=4 3725 B16R2.522 O=C(NCCC1COC1)c2ccncc2 6bcec356b085b4e70a991f82834b0953 [0,0,0,1,0,0|3,0,0]=4 3726 B16R2.522 O=C(NCCN1CCC1)c2ccccc2 ebbf5d8e751ec604f9b086e0dadb4008 [0,0,0,1,0,0|2,0,0]=3 3727 B16R2.522 O=C(NCCN1CCC1)c2ccccn2 30abc425b19073d4c4ada27e63f2bf0b [0,0,0,1,0,0|3,0,0]=4 3728 B16R2.522 O=C(NCCN1CCC1)c2cccnc2 41be4bf5180c7c4d09a0b8f4fab14d0b [0,0,0,1,0,0|3,0,0]=4 3729 B16R2.522 O=C(NCCN1CCC1)c2ccncc2 e79a5807a1604dce3458dbe4d61ce40b [0,0,0,1,0,0|3,0,0]=4 3730 B16R2.522 O=C(NCC[C@@H]1CCO1)c2ccccc2 b666edb26c074d78c8aeba2fa6507f1f [0,0,0,1,0,0|2,0,0]=3 3731 B16R2.522 O=C(NCC[C@@H]1CCO1)c2ccccn2 32d01a6a78fb8bd74ddd60eb6a07d4ee [0,0,0,1,0,0|3,0,0]=4 3732 B16R2.522 O=C(NCC[C@@H]1CCO1)c2cccnc2 8f610c0c8a73ecdb853b64e92f500741 [0,0,0,1,0,0|3,0,0]=4 3733 B16R2.522 O=C(NCC[C@@H]1CCO1)c2ccncc2 d5fe2a7df85c6c6e6302de4f09deb9ba [0,0,0,1,0,0|3,0,0]=4 3734 B16R2.522 O=C(NCOC1CCC1)c2ccccc2 1e38a7a7b36c02fcb001050383803464 [0,0,0,1,0,0|2,0,0]=3 3735 B16R2.522 O=C(NCOC1CCC1)c2cccnc2 552a69d162cea93ae2378d57ed39eec9 [0,0,0,1,0,0|3,0,0]=4 3736 B16R2.522 O=C(NCOC1COC1)c2ccccc2 2462ac6f8cde95ded05a78c1c642218f [0,0,0,1,0,0|3,0,0]=4 3737 B16R2.522 O=C(OCCN1CCC1)c2ccccc2 2c85b5a5f603af74a4bf04978e150b66 [0,0,0,1,0,0|1,0,0]=2 3738 B16R2.522 O=C(OCNC1CCC1)c2ccccc2 d5291d913f32467ce2a02d937700e13f [0,0,0,1,0,0|1,0,0]=2 3739 B16R2.522 O=C(OCNC1COC1)c2ccccc2 aac373f1349a484fb06eca9d2925930c [0,0,0,1,0,0|2,0,0]=3 3740 B16R2.522 O=C(OCOC1CCC1)c2ccccc2 1c72ddd4459a2e8fe6e0506cec7c8e7a [0,0,0,1,0,0|1,0,0]=2 3741 B16R2.522 O=C(OCOC1COC1)c2ccccc2 e126e622f122b3adc80250cc9132b128 [0,0,0,1,0,0|2,0,0]=3 3742 B16R2.522 O=C(OCOC1CSC1)c2ccccc2 68cce56bd5aebb39851096abf2370daf [0,0,0,1,0,0|2,0,0]=3 3743 B16R2.522 O=S(CCOC1CCC1)c2ccccc2 4f49a578ae3ed8592593a76cc1fbe629 [0,0,0,1,0,0|3,0,0]=4 3744 B16R2.1265 CCCCCCN1CC1c2ccccc2 2659881dacc2e85064c034115bf86d19 [0,0,0,1,0,0|2,0,1]=4 3745 B16R2.1265 CCCCCCN1C[C@@H]1c2ccccc2 9b9630c835ba8032edb931500c135e88 [0,0,0,1,0,0|2,0,1]=4 3746 B16R2.1757 CO[C@H]1C[C@H]1NCC(=O)c2ccccc2 329172d326649876f701821b5b04d0a1 [0,0,0,1,0,0|3,0,0]=4 3747 B16R2.1757 O=C(CN[C@@H]1C[C@H]1CO)c2ccccc2 4527138a4725dd8db9af439e08e5b46b [0,0,0,1,0,0|3,0,0]=4 3748 B16R2.1757 O=C(CN[C@H]1C[C@@H]1CO)c2ccccc2 14055de97967978ea950e425e6d41c08 [0,0,0,1,0,0|3,0,0]=4 3749 B16R2.1757 O=C(CN[C@H]1C[C@H]1CO)c2ccccc2 9cf689b26455c191f928dfe304a95b0d [0,0,0,1,0,0|3,0,0]=4 3750 B16R2.1757 O=C(NCC1CC1CO)c2ccccc2 d40d4ce6b3cebb75ad7f29a6d281c96b [0,0,0,1,0,0|2,0,0]=3 3751 B16R2.1757 O=C(NCC1CC1CO)c2ccccn2 c014fa51bd64eb4c5f4a25aa4c75b8e6 [0,0,0,1,0,0|3,0,0]=4 3752 B16R2.1757 O=C(NCC1CC1CO)c2cccnc2 51fc6396b05fa33260d809e793636c8c [0,0,0,1,0,0|3,0,0]=4 3753 B16R2.1757 O=C(NCC1CC1CO)c2ccncc2 62f2629146701ec7ea75737cee66496c [0,0,0,1,0,0|3,0,0]=4 3754 B16R2.2002 C=C(CN1CCC1CC)c2ccccc2 4280783501b604219241ab69e29635e1 [0,0,0,1,0,0|3,0,0]=4 3755 B16R2.2002 CCC1CCN1CC(=O)c2ccccc2 dc4fbe40079bf2434799fbb4751a6c47 [0,0,0,1,0,0|2,0,0]=3 3756 B16R2.2002 CCC1CCN1CC(=O)c2ccccn2 03b5181701f06cbbb1ee40ac7ec038e6 [0,0,0,1,0,0|3,0,0]=4 3757 B16R2.2002 CCC1CCN1CC(=O)c2cccnc2 757b70a5976c91771b4ce556ac2802d6 [0,0,0,1,0,0|3,0,0]=4 3758 B16R2.2002 CCC1CCN1CS(=O)c2ccccc2 e5f2644293292539064e8fcaab09893b [0,0,0,1,0,0|3,0,0]=4 3759 B16R2.2002 COC1CCC1NC(=O)c2ccccc2 50cfb53052be71ed89140c5c2331192f [0,0,0,1,0,0|2,0,0]=3 3760 B16R2.2002 COC1CCC1NC(=O)c2ccccn2 c2653909b4846cef01053b748b6b3ee0 [0,0,0,1,0,0|3,0,0]=4 3761 B16R2.2002 COC1CCC1NC(=O)c2cccnc2 8e6405cd3e592805c58573dc9f1351ac [0,0,0,1,0,0|3,0,0]=4 3762 B16R2.2002 COC1CCC1NC(=O)c2ccncc2 db446131f2cd9765e8a9f86eb0ffe401 [0,0,0,1,0,0|3,0,0]=4 3763 B16R2.2002 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2 f3227c06be95c249de4d40e1d84bb590 [0,0,0,1,0,0|2,0,0]=3 3764 B16R2.2002 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccn2 66c183c0d4bdc2451c0fc770a3d67aef [0,0,0,1,0,0|3,0,0]=4 3765 B16R2.2002 CO[C@@H]1CC[C@@H]1NC(=O)c2cccnc2 3318d5270df0bf78fedfa91179e9bb7a [0,0,0,1,0,0|3,0,0]=4 3766 B16R2.2002 CO[C@@H]1CC[C@@H]1NC(=O)c2ccncc2 8bf704f44192ec2248ae9a26f157ddb5 [0,0,0,1,0,0|3,0,0]=4 3767 B16R2.2002 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2 836006397386e44578469a99afc73612 [0,0,0,1,0,0|2,0,0]=3 3768 B16R2.2002 CO[C@@H]1CC[C@H]1NC(=O)c2ccccn2 5bf08b3452c61cf49b6a4cfd17b293ae [0,0,0,1,0,0|3,0,0]=4 3769 B16R2.2002 CO[C@@H]1CC[C@H]1NC(=O)c2cccnc2 eefbb929b6db011bb3bffc6f9af09699 [0,0,0,1,0,0|3,0,0]=4 3770 B16R2.2002 CO[C@@H]1CC[C@H]1NC(=O)c2ccncc2 e83e3c2fabfdc288f4c4344568a44605 [0,0,0,1,0,0|3,0,0]=4 3771 B16R2.2002 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2 a8bfe285acdf6e7b92f0f080773d5bd4 [0,0,0,1,0,0|2,0,0]=3 3772 B16R2.2002 CO[C@H]1CC[C@@H]1NC(=O)c2ccccn2 837fdf88548840ecf10498200648f642 [0,0,0,1,0,0|3,0,0]=4 3773 B16R2.2002 CO[C@H]1CC[C@@H]1NC(=O)c2cccnc2 d80f1ec23e554ac865f7fa92ac4b8885 [0,0,0,1,0,0|3,0,0]=4 3774 B16R2.2002 CO[C@H]1CC[C@@H]1NC(=O)c2ccncc2 691e1ae0aff1e6030af25cf4110533bb [0,0,0,1,0,0|3,0,0]=4 3775 B16R2.2002 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2 10a55e6bf72a20fed49eb0b64d0b29c9 [0,0,0,1,0,0|2,0,0]=3 3776 B16R2.2002 CO[C@H]1CC[C@H]1NC(=O)c2ccccn2 3f55f094336b34fd1cb206191a288f29 [0,0,0,1,0,0|3,0,0]=4 3777 B16R2.2002 CO[C@H]1CC[C@H]1NC(=O)c2cccnc2 fb9cee31d43eee2b9972ca710f07bd5b [0,0,0,1,0,0|3,0,0]=4 3778 B16R2.2002 CO[C@H]1CC[C@H]1NC(=O)c2ccncc2 82e29a7df52eb7e6f8e9e596e9c3ac8b [0,0,0,1,0,0|3,0,0]=4 3779 B16R2.2002 O=C(CN1CCC1CO)c2ccccc2 30d82211ffca7e88276a23ebdcf905ae [0,0,0,1,0,0|3,0,0]=4 3780 B16R2.2002 O=C(CN1CC[C@@H]1CO)c2ccccc2 0904e8bb2b1d58a045d7b348152ce482 [0,0,0,1,0,0|3,0,0]=4 3781 B16R2.2002 O=C(CN1CC[C@H]1CO)c2ccccc2 4f374969edd0dd5e90d0647999412d2e [0,0,0,1,0,0|3,0,0]=4 3782 B16R2.2209 O=C(c1ccccc1)N2CCCCCC2 09d24b6f0c53d9d0211b86c18e40a413 [0,0,0,1,0,0|1,0,0]=2 3783 B16R2.2209 O=C(c1ccccc1)N2CCCOCC2 dfa2e58086a982557b8f5658852ef96b [0,0,0,1,0,0|2,0,0]=3 3784 B16R2.2209 O=C(c1ccccn1)N2CCCCCC2 169b3f58b663341305ee33d26277b152 [0,0,0,1,0,0|2,0,0]=3 3785 B16R2.2209 O=C(c1ccccn1)N2CCCOCC2 580ad776b5f9f2bfc05313bf37003bf1 [0,0,0,1,0,0|3,0,0]=4 3786 B16R2.2209 O=C(c1cccnc1)N2CCCCCC2 e64c050f2c2cedc2df034a2b3af31b6a [0,0,0,1,0,0|2,0,0]=3 3787 B16R2.2209 O=C(c1cccnc1)N2CCCOCC2 901c63da5b95ed80a053abfca1a4d931 [0,0,0,1,0,0|3,0,0]=4 3788 B16R2.2209 O=C(c1cccnn1)N2CCCCCC2 9dcf8df201e26df2643a28cd77646644 [0,0,0,1,0,0|3,0,0]=4 3789 B16R2.2209 O=C(c1ccncc1)N2CCCCCC2 a313529a73bd34277d43070ba8db25f0 [0,0,0,1,0,0|2,0,0]=3 3790 B16R2.2209 O=C(c1ccncc1)N2CCCOCC2 3d64e6104a909d020df4c6df3daa94e3 [0,0,0,1,0,0|3,0,0]=4 3791 B16R2.2209 O=C(c1ccncn1)N2CCCCCC2 a4882e42286cc4c847f9e25f5815e119 [0,0,0,1,0,0|3,0,0]=4 3792 B16R2.2209 O=C(c1ccnnc1)N2CCCCCC2 25b8972a38eed5c265dd966239c13183 [0,0,0,1,0,0|3,0,0]=4 3793 B16R2.2209 O=C(c1cnccn1)N2CCCCCC2 9293eba431a28c734972d4be89858109 [0,0,0,1,0,0|3,0,0]=4 3794 B16R2.2209 O=C(c1cncnc1)N2CCCCCC2 9bd8d1a4dc47e6727fa2e8e925386e51 [0,0,0,1,0,0|3,0,0]=4 3795 B16R2.2209 O=C(c1ncccn1)N2CCCCCC2 4d101230d75ce9aeb530c719cfbafdf2 [0,0,0,1,0,0|3,0,0]=4 3796 B16R2.2516 C#CC1CCCN1C(=O)c2ccccc2 55eebeaf60de8948044b766d80072a12 [0,0,0,1,0,0|1,0,2]=4 3797 B16R2.2516 CCC1CCCN1C(=O)c2ccccc2 5c9537d37f382325d36bfae663575e62 [0,0,0,1,0,0|1,0,0]=2 3798 B16R2.2516 CCC1CCCN1C(=O)c2ccccn2 4a8d3d1a56ebae9b70d1c757c97192db [0,0,0,1,0,0|2,0,0]=3 3799 B16R2.2516 CCC1CCCN1C(=O)c2cccnc2 488e90866ad2d1985e334b655545c593 [0,0,0,1,0,0|2,0,0]=3 3800 B16R2.2516 CCC1CCCN1C(=O)c2cccnn2 7dfcd9ac9d06fbb91657cd05136af4d5 [0,0,0,1,0,0|3,0,0]=4 3801 B16R2.2516 CCC1CCCN1C(=O)c2ccncc2 cb58d66cf84b75eeaf2584a7f5f7bb1c [0,0,0,1,0,0|2,0,0]=3 3802 B16R2.2516 CCC1CCCN1C(=O)c2ccncn2 72427b938df577dc2d80b9cf4c75e229 [0,0,0,1,0,0|3,0,0]=4 3803 B16R2.2516 CCC1CCCN1C(=O)c2ccnnc2 1725749c63dd663cde1b432adec94736 [0,0,0,1,0,0|3,0,0]=4 3804 B16R2.2516 CCC1CCCN1C(=O)c2cnccn2 983c8eaf5863e0d1b8f629ce07deca6f [0,0,0,1,0,0|3,0,0]=4 3805 B16R2.2516 CCC1CCCN1C(=O)c2cncnc2 889ace94582f82f1e2e4da9456f92bfa [0,0,0,1,0,0|3,0,0]=4 3806 B16R2.2516 CCC1CCCN1C(=O)c2ncccn2 09a3c95972810f5263f4a4dd137b475c [0,0,0,1,0,0|3,0,0]=4 3807 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2ccccc2 c08e64b2b7eb83c56e0c1b5636811255 [0,0,0,1,0,0|1,0,0]=2 3808 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2ccccn2 25649a5d017f314e39f603f678cd4baf [0,0,0,1,0,0|2,0,0]=3 3809 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2cccnc2 d4163c0284bbcbefe51dbb168da4bc03 [0,0,0,1,0,0|2,0,0]=3 3810 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2cccnn2 8d8fe2cb255c42f6a44076a95cef3017 [0,0,0,1,0,0|3,0,0]=4 3811 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2ccncc2 5891981c267a67bdbe78c3540251c1bd [0,0,0,1,0,0|2,0,0]=3 3812 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2ccncn2 600a7f026b7102dde0ba3cc092c1f5ce [0,0,0,1,0,0|3,0,0]=4 3813 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2ccnnc2 e572755a2a672d79001ef692bdfeef80 [0,0,0,1,0,0|3,0,0]=4 3814 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2cnccn2 31b062d1ae523b4cee3b96cd4dfe6853 [0,0,0,1,0,0|3,0,0]=4 3815 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2cncnc2 9e743887756f156e0248504afc52a4c0 [0,0,0,1,0,0|3,0,0]=4 3816 B16R2.2516 CC[C@@H]1CCCN1C(=O)c2ncccn2 da177b1fbd3076e5698799cf2921c4e4 [0,0,0,1,0,0|3,0,0]=4 3817 B16R2.2516 COC1CCCN1C(=O)c2ccccc2 3a19822654f23365a1c8182d5c559956 [0,0,0,1,0,0|2,0,0]=3 3818 B16R2.2516 COC1CCCN1C(=O)c2ccccn2 e51bf0c5a1314af69b1ae3a7b198e5e8 [0,0,0,1,0,0|3,0,0]=4 3819 B16R2.2516 COC1CCCN1C(=O)c2cccnc2 1321cb5183f7d64fec3888a50d281d2b [0,0,0,1,0,0|3,0,0]=4 3820 B16R2.2516 COC1CCCN1C(=O)c2ccncc2 a70e5f2b0c05317f1d325aa9ba66bfb2 [0,0,0,1,0,0|3,0,0]=4 3821 B16R2.2516 N#CC1CCCN1C(=O)c2ccccc2 7ec2e1683aa286a523406140601d4bbb [0,0,0,1,0,0|2,0,1]=4 3822 B16R2.2516 N#C[C@@H]1CCCN1C(=O)c2ccccc2 da471d2ba81d7a2a75bac1cd917c050c [0,0,0,1,0,0|2,0,1]=4 3823 B16R2.2516 O=C(c1ccccc1)N2CCCC2CO e75c52c979c6d3ee48c95d05fc8da353 [0,0,0,1,0,0|2,0,0]=3 3824 B16R2.2516 O=C(c1ccccc1)N2CCC[C@@H]2CF cd240b8a73da8df31339b00eeacdc788 [0,0,0,1,0,0|2,0,0]=3 3825 B16R2.2516 O=C(c1ccccc1)N2CCC[C@@H]2CO 52f233e3a0c3b6dd6c7e86ed25727a34 [0,0,0,1,0,0|2,0,0]=3 3826 B16R2.2516 O=C(c1ccccc1)N2CCC[C@H]2CF a6ee3405af1e0591fb98c6f3e92fc372 [0,0,0,1,0,0|2,0,0]=3 3827 B16R2.2516 O=C(c1ccccc1)N2CCC[C@H]2CO f6f6c5dd2ead6d1e7fd86f08576a5a6b [0,0,0,1,0,0|2,0,0]=3 3828 B16R2.2516 O=C(c1ccccn1)N2CCCC2CO 854023580d00190d54da08ae9646944d [0,0,0,1,0,0|3,0,0]=4 3829 B16R2.2516 O=C(c1ccccn1)N2CCC[C@@H]2CF e8cd6753f653cbc5ea1638e7c3cae83e [0,0,0,1,0,0|3,0,0]=4 3830 B16R2.2516 O=C(c1ccccn1)N2CCC[C@@H]2CO 494c802e3e1d3fa87c3aa57ec3dd17b1 [0,0,0,1,0,0|3,0,0]=4 3831 B16R2.2516 O=C(c1ccccn1)N2CCC[C@H]2CF ed1b7a2df7d975e29babc8df3bc38a6a [0,0,0,1,0,0|3,0,0]=4 3832 B16R2.2516 O=C(c1ccccn1)N2CCC[C@H]2CO 708f2a1e256e5ac69ff4587330c96fab [0,0,0,1,0,0|3,0,0]=4 3833 B16R2.2516 O=C(c1cccnc1)N2CCCC2CO bf51fd92074820da4a18b336b74d8a70 [0,0,0,1,0,0|3,0,0]=4 3834 B16R2.2516 O=C(c1cccnc1)N2CCC[C@@H]2CF ffaee369221adaea746d65d70dfb11ec [0,0,0,1,0,0|3,0,0]=4 3835 B16R2.2516 O=C(c1cccnc1)N2CCC[C@@H]2CO 7ae3b5578fff8b417ab67f122ce45d8c [0,0,0,1,0,0|3,0,0]=4 3836 B16R2.2516 O=C(c1cccnc1)N2CCC[C@H]2CF 43be6e5b4107f4055a018874efdbce9b [0,0,0,1,0,0|3,0,0]=4 3837 B16R2.2516 O=C(c1cccnc1)N2CCC[C@H]2CO 8b72f09164d9fff27efec3ae9bca2a2c [0,0,0,1,0,0|3,0,0]=4 3838 B16R2.2516 O=C(c1ccncc1)N2CCCC2CO 77f4be1f93c41abfe7a50a3625e19086 [0,0,0,1,0,0|3,0,0]=4 3839 B16R2.2516 O=C(c1ccncc1)N2CCC[C@@H]2CF 93a5f98df295bafe461058f74d4ddc62 [0,0,0,1,0,0|3,0,0]=4 3840 B16R2.2516 O=C(c1ccncc1)N2CCC[C@@H]2CO 5a1976573f36ce3a6ffb1d7d928b6a09 [0,0,0,1,0,0|3,0,0]=4 3841 B16R2.2516 O=C(c1ccncc1)N2CCC[C@H]2CF 9aa94565e00e796635b5830f70d7eb78 [0,0,0,1,0,0|3,0,0]=4 3842 B16R2.2516 O=C(c1ccncc1)N2CCC[C@H]2CO 1a248ac56e9542032d998de8a12ac191 [0,0,0,1,0,0|3,0,0]=4 3843 B16R2.3014 CC1CCCN1CC(=O)c2ccccc2 07b18dd96653287228dd058c9e2165b5 [0,0,0,1,0,0|2,0,0]=3 3844 B16R2.3014 CC1CCCN1CC(=O)c2ccccn2 723a6051ff7d1c3bbccafcec4ee158f1 [0,0,0,1,0,0|3,0,0]=4 3845 B16R2.3014 CC1CCCN1CC(=O)c2cccnc2 cbc914a9ccaf40f3c1423c99649363c4 [0,0,0,1,0,0|3,0,0]=4 3846 B16R2.3014 C[C@@H]1CCCN1CC(=O)c2ccccc2 c1cd04c14ace2ac4f98f8d1cefefec24 [0,0,0,1,0,0|2,0,0]=3 3847 B16R2.3014 C[C@@H]1CCCN1CC(=O)c2ccccn2 c52b15a32f86aaa559cb73137a998607 [0,0,0,1,0,0|3,0,0]=4 3848 B16R2.3014 C[C@@H]1CCCN1CC(=O)c2cccnc2 42318c141aae39babd787fe5a1701a2e [0,0,0,1,0,0|3,0,0]=4 3849 B16R2.3014 C[C@H]1CCCN1CC(=O)c2ccccc2 547d9f1e13eff3378ac671e9469d699a [0,0,0,1,0,0|2,0,0]=3 3850 B16R2.3014 C[C@H]1CCCN1CC(=O)c2ccccn2 ad89d108d29a6af61550840ddf402834 [0,0,0,1,0,0|3,0,0]=4 3851 B16R2.3014 C[C@H]1CCCN1CC(=O)c2cccnc2 ab1d843eb4faa6be195e2961daa23961 [0,0,0,1,0,0|3,0,0]=4 3852 B16R2.3014 O=C(CN1CCCC1O)c2ccccc2 d7ed51c8f16edadd2fc6bedc661c7ec6 [0,0,0,1,0,0|3,0,0]=4 3853 B16R2.3014 O=C(NC1CCCC1O)c2ccccc2 4646120644975a62b55d0e7724d40ad6 [0,0,0,1,0,0|2,0,0]=3 3854 B16R2.3014 O=C(NC1CCCC1O)c2ccccn2 3cd6dcfa320cf0856ddd9891b0d60a9f [0,0,0,1,0,0|3,0,0]=4 3855 B16R2.3014 O=C(NC1CCCC1O)c2cccnc2 6576d52e742b0e25da9688a322bc1086 [0,0,0,1,0,0|3,0,0]=4 3856 B16R2.3014 O=C(NC1CCCC1O)c2ccncc2 8856004dda9f5a2b78ff9106a8cda708 [0,0,0,1,0,0|3,0,0]=4 3857 B16R2.3014 O=C(NC1COCC1O)c2ccccc2 01c48afbdcffe81484a003e4bd6198c4 [0,0,0,1,0,0|3,0,0]=4 3858 B16R2.3014 O=C(N[C@@H]1CCC[C@@H]1O)c2ccccc2 e50cd1dd6917a1900e7ada41231d9d66 [0,0,0,1,0,0|2,0,0]=3 3859 B16R2.3014 O=C(N[C@@H]1CCC[C@@H]1O)c2ccccn2 ca1a030685162ecaef827b02ae04ff6e [0,0,0,1,0,0|3,0,0]=4 3860 B16R2.3014 O=C(N[C@@H]1CCC[C@@H]1O)c2cccnc2 9fdfc3fd18a6cb11163431d3a3df0289 [0,0,0,1,0,0|3,0,0]=4 3861 B16R2.3014 O=C(N[C@@H]1CCC[C@@H]1O)c2ccncc2 fc9abef39e2088b6016f7db54b04da96 [0,0,0,1,0,0|3,0,0]=4 3862 B16R2.3014 O=C(N[C@@H]1CCC[C@H]1O)c2ccccc2 55d986ec328fd6921198f9d59d0263c1 [0,0,0,1,0,0|2,0,0]=3 3863 B16R2.3014 O=C(N[C@@H]1CCC[C@H]1O)c2ccccn2 ff1347656963b319e37776dbdd8c92cc [0,0,0,1,0,0|3,0,0]=4 3864 B16R2.3014 O=C(N[C@@H]1CCC[C@H]1O)c2cccnc2 75f60a7da1571289cbfd033293be3f53 [0,0,0,1,0,0|3,0,0]=4 3865 B16R2.3014 O=C(N[C@@H]1CCC[C@H]1O)c2ccncc2 3444f1766aaf373f2a833806d72b8f54 [0,0,0,1,0,0|3,0,0]=4 3866 B16R2.3014 O=C(N[C@@H]1COC[C@@H]1O)c2ccccc2 87f75633dd0de8a8f8159cf84dbc7826 [0,0,0,1,0,0|3,0,0]=4 3867 B16R2.3014 O=C(N[C@@H]1COC[C@H]1O)c2ccccc2 a5cb64853e6c0a227bb6b791858c2c89 [0,0,0,1,0,0|3,0,0]=4 3868 B16R2.3014 O=C(N[C@H]1CCC[C@@H]1O)c2ccccc2 2441f64ef1c6799fe62afbec03f66bcd [0,0,0,1,0,0|2,0,0]=3 3869 B16R2.3014 O=C(N[C@H]1CCC[C@@H]1O)c2ccccn2 e0a4c246067b089d92cef2e4e360b643 [0,0,0,1,0,0|3,0,0]=4 3870 B16R2.3014 O=C(N[C@H]1CCC[C@@H]1O)c2cccnc2 93fbdbf74f37186608f5a87cb921a80a [0,0,0,1,0,0|3,0,0]=4 3871 B16R2.3014 O=C(N[C@H]1CCC[C@@H]1O)c2ccncc2 40aab0c4d1e6394fc4bcdac7ab0b9e9d [0,0,0,1,0,0|3,0,0]=4 3872 B16R2.3014 O=C(N[C@H]1CCC[C@H]1O)c2ccccc2 c867a2313aa1badd2104fb36f015992f [0,0,0,1,0,0|2,0,0]=3 3873 B16R2.3014 O=C(N[C@H]1CCC[C@H]1O)c2ccccn2 9ac70a1f202edbc19aef829976277aaf [0,0,0,1,0,0|3,0,0]=4 3874 B16R2.3014 O=C(N[C@H]1CCC[C@H]1O)c2cccnc2 a400962ae7ca6034fc854b8af24f0d42 [0,0,0,1,0,0|3,0,0]=4 3875 B16R2.3014 O=C(N[C@H]1CCC[C@H]1O)c2ccncc2 13d54465bf2fea7f03272dc858397e59 [0,0,0,1,0,0|3,0,0]=4 3876 B16R2.3014 O=C(N[C@H]1COC[C@@H]1O)c2ccccc2 d44471431836aced6683082ba8edd925 [0,0,0,1,0,0|3,0,0]=4 3877 B16R2.3014 O=C(N[C@H]1COC[C@H]1F)c2ccccc2 5d235c33f7c3e39f816bce320046a1f5 [0,0,0,1,0,0|3,0,0]=4 3878 B16R2.3014 O=C(N[C@H]1COC[C@H]1O)c2ccccc2 0a7c9429898309d28979a38e4019db7e [0,0,0,1,0,0|3,0,0]=4 3879 B16R2.3189 C=C(COCC1CC1C)c2ccccc2 78d119079f3b6178144c56205f5daf42 [0,0,0,1,0,0|3,0,0]=4 3880 B16R2.3189 C=C(COC[C@@H]1C[C@@H]1C)c2ccccc2 f8a5511a423c25e5d4fa4cf54ad1b09e [0,0,0,1,0,0|3,0,0]=4 3881 B16R2.3189 C=C(COC[C@@H]1C[C@H]1C)c2ccccc2 e4a41346946854287a511ea7ca9746ca [0,0,0,1,0,0|3,0,0]=4 3882 B16R2.3189 C=C(COC[C@H]1C[C@@H]1C)c2ccccc2 47b292f4ff1825271920af3b02853f67 [0,0,0,1,0,0|3,0,0]=4 3883 B16R2.3189 CC1CC1COCC(=O)c2ccccc2 dfade20ec18cbdf62778dd5cc79b1615 [0,0,0,1,0,0|2,0,0]=3 3884 B16R2.3189 CC1CC1COCC(=O)c2ccccn2 2c1c6eaa55169d272d7d4bd85da1e1dd [0,0,0,1,0,0|3,0,0]=4 3885 B16R2.3189 CC1CC1COCC(=O)c2cccnc2 6bccbc5c9f6fa3c854540dac4af14524 [0,0,0,1,0,0|3,0,0]=4 3886 B16R2.3189 CC1CC1NCOC(=O)c2ccccc2 8c086eb63a0791416fbc7be721525780 [0,0,0,1,0,0|1,0,0]=2 3887 B16R2.3189 C[C@@H]1C[C@H]1COCC(=O)c2ccccc2 9b7789121ab65293af83d3d3e666fa47 [0,0,0,1,0,0|2,0,0]=3 3888 B16R2.3189 C[C@@H]1C[C@H]1COCC(=O)c2ccccn2 e8015ab7f5003dd42f813b6346a0179d [0,0,0,1,0,0|3,0,0]=4 3889 B16R2.3189 C[C@@H]1C[C@H]1COCC(=O)c2cccnc2 8d7458c8786cd9c3bdccff5c7ad4dbbb [0,0,0,1,0,0|3,0,0]=4 3890 B16R2.3189 C[C@H]1C[C@@H]1COCC(=O)c2ccccc2 ec5a3bc1af1b6ed5c149136bbfeb2503 [0,0,0,1,0,0|2,0,0]=3 3891 B16R2.3189 C[C@H]1C[C@@H]1COCC(=O)c2ccccn2 335a88aefeb69ac27c19c2f41264b84f [0,0,0,1,0,0|3,0,0]=4 3892 B16R2.3189 C[C@H]1C[C@@H]1COCC(=O)c2cccnc2 0b1a703c222752d1f9ef8a3646ce62f1 [0,0,0,1,0,0|3,0,0]=4 3893 B16R2.3189 C[C@H]1C[C@H]1COCC(=O)c2ccccc2 97eab836f02ba397205d5393782ae280 [0,0,0,1,0,0|2,0,0]=3 3894 B16R2.3189 C[C@H]1C[C@H]1COCC(=O)c2ccccn2 6c2beae6519888966817f986436499a5 [0,0,0,1,0,0|3,0,0]=4 3895 B16R2.3189 C[C@H]1C[C@H]1COCC(=O)c2cccnc2 2d291032e1b3d0a67f3ca5c2f6f8d9fb [0,0,0,1,0,0|3,0,0]=4 3896 B16R2.3189 O=C(COC[C@@H]1C[C@@H]1F)c2ccccc2 875b469143e54067ece1f718adb2fc3f [0,0,0,1,0,0|3,0,0]=4 3897 B16R2.3189 O=C(COC[C@@H]1C[C@H]1F)c2ccccc2 84bb768d1fe9ae3242c64a5c6c3f74c9 [0,0,0,1,0,0|3,0,0]=4 3898 B16R2.3189 O=C(COC[C@H]1C[C@@H]1F)c2ccccc2 2a8ecc7d985971ed161241069308de9d [0,0,0,1,0,0|3,0,0]=4 3899 B16R2.3189 O=C(COC[C@H]1C[C@H]1F)c2ccccc2 9c22dd05f0bad61dc63c2be8751f5f74 [0,0,0,1,0,0|3,0,0]=4 3900 B16R2.3189 O=C(OCN[C@@H]1C[C@H]1F)c2ccccc2 3b9a8e99ac0e435b28560531e3963b66 [0,0,0,1,0,0|2,0,0]=3 3901 B16R2.3189 O=C(OCN[C@H]1C[C@@H]1F)c2ccccc2 e08dbfba8816e6bf3e4d0f5708b549cd [0,0,0,1,0,0|2,0,0]=3 3902 B16R2.3189 O=C(OCN[C@H]1C[C@H]1F)c2ccccc2 aeba16bc8036663b289ab46a33a3d37c [0,0,0,1,0,0|2,0,0]=3 3903 B16R2.3447 COCC1CCN1C(=O)c2ccccc2 51af3584e66385b7ae3bbce82d7e74f7 [0,0,0,1,0,0|2,0,0]=3 3904 B16R2.3447 COCC1CCN1C(=O)c2ccccn2 8684b1ef74f37d65785ef73137ef7c3d [0,0,0,1,0,0|3,0,0]=4 3905 B16R2.3447 COCC1CCN1C(=O)c2cccnc2 416cb40f1c2698bd7f7a140417718179 [0,0,0,1,0,0|3,0,0]=4 3906 B16R2.3447 COCC1CCN1C(=O)c2ccncc2 ac9b1e6476103fd3196957fd788ff7b0 [0,0,0,1,0,0|3,0,0]=4 3907 B16R2.3447 COC[C@@H]1CCN1C(=O)c2ccccc2 1a9b620eb42acf1feb2e30d4fe59fcd8 [0,0,0,1,0,0|2,0,0]=3 3908 B16R2.3447 COC[C@@H]1CCN1C(=O)c2ccccn2 0f4820bde3303ab4ba6f964f158f6fae [0,0,0,1,0,0|3,0,0]=4 3909 B16R2.3447 COC[C@@H]1CCN1C(=O)c2cccnc2 0378be4f6c2bc2f0a4c54775071acf70 [0,0,0,1,0,0|3,0,0]=4 3910 B16R2.3447 COC[C@@H]1CCN1C(=O)c2ccncc2 8c563118a2f14a423a474b493bf46d9f [0,0,0,1,0,0|3,0,0]=4 3911 B16R2.3447 COC[C@H]1CCN1C(=O)c2ccccc2 8075424b1c34a433a1c8790ad8c9fdcc [0,0,0,1,0,0|2,0,0]=3 3912 B16R2.3447 COC[C@H]1CCN1C(=O)c2ccccn2 8fb0b7e09e88964953b7f5ba782ac0ca [0,0,0,1,0,0|3,0,0]=4 3913 B16R2.3447 COC[C@H]1CCN1C(=O)c2cccnc2 334f6148e21b97a22a19b492b54f7378 [0,0,0,1,0,0|3,0,0]=4 3914 B16R2.3447 COC[C@H]1CCN1C(=O)c2ccncc2 a1ab8f34e15985c22cf4852c4c7f96ce [0,0,0,1,0,0|3,0,0]=4 3915 B16R2.3447 O=C(c1ccccc1)N2CCC2CCO 796b3e8bf578b03b820de27373689103 [0,0,0,1,0,0|2,0,0]=3 3916 B16R2.3447 O=C(c1ccccn1)N2CCC2CCO 2e21d0e823fe50be90832e499fb0d4d4 [0,0,0,1,0,0|3,0,0]=4 3917 B16R2.3447 O=C(c1cccnc1)N2CCC2CCO a36925cb3541ae068ac8524a63d8969f [0,0,0,1,0,0|3,0,0]=4 3918 B16R2.3447 O=C(c1ccncc1)N2CCC2CCO f15a27bae2e44d83011c78e9e541028f [0,0,0,1,0,0|3,0,0]=4 3919 B16R2.3751 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2 329369fc0b556b03413a5b13059e8036 [0,0,0,1,0,0|2,0,0]=3 3920 B16R2.3751 COC[C@@H]1C[C@@H]1NC(=O)c2ccccn2 384c30f4e354a3520c19df62f562f3ad [0,0,0,1,0,0|3,0,0]=4 3921 B16R2.3751 COC[C@@H]1C[C@@H]1NC(=O)c2cccnc2 75a1fec5c219063ecc8538b4e045e1db [0,0,0,1,0,0|3,0,0]=4 3922 B16R2.3751 COC[C@@H]1C[C@@H]1NC(=O)c2ccncc2 9daf0cb2db39b18bad48e1a7c7ba4628 [0,0,0,1,0,0|3,0,0]=4 3923 B16R2.3751 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2 099e6bbe6d26ca6d988199ee3927f705 [0,0,0,1,0,0|2,0,0]=3 3924 B16R2.3751 COC[C@H]1C[C@@H]1NC(=O)c2ccccn2 bd8a4d29d488131c0fa0a62400dbf78c [0,0,0,1,0,0|3,0,0]=4 3925 B16R2.3751 COC[C@H]1C[C@@H]1NC(=O)c2cccnc2 c944bc9c75500940c446be8acab7a532 [0,0,0,1,0,0|3,0,0]=4 3926 B16R2.3751 COC[C@H]1C[C@@H]1NC(=O)c2ccncc2 1c7e1784a6c191110544c37a7d56fd8f [0,0,0,1,0,0|3,0,0]=4 3927 B16R2.3896 CC1CCCCN1C(=O)c2ccccc2 6d84f6302c484381fe0fa4e85b5c3d1a [0,0,0,1,0,0|1,0,0]=2 3928 B16R2.3896 CC1CCCCN1C(=O)c2ccccn2 1fa9428354ba8208b29e7974a218b4bb [0,0,0,1,0,0|2,0,0]=3 3929 B16R2.3896 CC1CCCCN1C(=O)c2cccnc2 58636296ea63ed12fa7a7e200479f091 [0,0,0,1,0,0|2,0,0]=3 3930 B16R2.3896 CC1CCCCN1C(=O)c2cccnn2 ba28f0177f107c111d4b29e275eb7117 [0,0,0,1,0,0|3,0,0]=4 3931 B16R2.3896 CC1CCCCN1C(=O)c2ccncc2 1d3ed24a34daf62012a8cb95f0f35358 [0,0,0,1,0,0|2,0,0]=3 3932 B16R2.3896 CC1CCCCN1C(=O)c2ccncn2 d17b02e0b9586792f1f8c5ec741b8f5c [0,0,0,1,0,0|3,0,0]=4 3933 B16R2.3896 CC1CCCCN1C(=O)c2ccnnc2 12653b2a612f96bcbc4c61119c483427 [0,0,0,1,0,0|3,0,0]=4 3934 B16R2.3896 CC1CCCCN1C(=O)c2cnccn2 662dc3be755b4f206ba053dba5dfe814 [0,0,0,1,0,0|3,0,0]=4 3935 B16R2.3896 CC1CCCCN1C(=O)c2cncnc2 b8a7429987ec1a6db1eecaf33576f086 [0,0,0,1,0,0|3,0,0]=4 3936 B16R2.3896 CC1CCCCN1C(=O)c2ncccn2 4f7ef9ea6cae4cc280976379a043b8d1 [0,0,0,1,0,0|3,0,0]=4 3937 B16R2.3896 CC1COCCN1C(=O)c2ccccc2 bb74aeec62ad438f3a7b5de66fc1e158 [0,0,0,1,0,0|2,0,0]=3 3938 B16R2.3896 CC1COCCN1C(=O)c2ccccn2 4bd3022ffcc2c25f5435b602858e60cf [0,0,0,1,0,0|3,0,0]=4 3939 B16R2.3896 CC1COCCN1C(=O)c2cccnc2 3f0d2144b7462940040523a4da69e61a [0,0,0,1,0,0|3,0,0]=4 3940 B16R2.3896 CC1COCCN1C(=O)c2ccncc2 c74a4275f5dc373161bfbcd4db7f3d84 [0,0,0,1,0,0|3,0,0]=4 3941 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2ccccc2 cb6c42ae2248912feb5e610420194aa3 [0,0,0,1,0,0|1,0,0]=2 3942 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2ccccn2 cb29c0d525e1bc6f29121d2cc0a266e7 [0,0,0,1,0,0|2,0,0]=3 3943 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2cccnc2 e94adb1d0c2666c016b592ab67b4fd06 [0,0,0,1,0,0|2,0,0]=3 3944 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2cccnn2 fcdca734d00ccf2ff80bbbc3c3b60705 [0,0,0,1,0,0|3,0,0]=4 3945 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2ccncc2 9a0ad5121dff15bfd09df42d131f8aed [0,0,0,1,0,0|2,0,0]=3 3946 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2ccncn2 f04b3a818bcf5c5b4e0f90b595526dff [0,0,0,1,0,0|3,0,0]=4 3947 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2ccnnc2 ed8c06a994ca48db9626ef91204589c8 [0,0,0,1,0,0|3,0,0]=4 3948 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2cnccn2 23449c4772e317a220af16b5b0f1fa90 [0,0,0,1,0,0|3,0,0]=4 3949 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2cncnc2 a3e2c00d9408e0dfc4a74dbe6eadede2 [0,0,0,1,0,0|3,0,0]=4 3950 B16R2.3896 C[C@@H]1CCCCN1C(=O)c2ncccn2 147b1ea2bc7150123e2c1f5619f4155a [0,0,0,1,0,0|3,0,0]=4 3951 B16R2.3896 C[C@@H]1CCCC[C@@H]1N(C)c2ccccc2 65abe1e51eb2e62f8d4de47b324c6939 [0,0,0,1,0,0|3,0,0]=4 3952 B16R2.3896 C[C@@H]1COCCN1C(=O)c2ccccc2 6ca68133d4edf503b322e07fd985bdb6 [0,0,0,1,0,0|2,0,0]=3 3953 B16R2.3896 C[C@@H]1COCCN1C(=O)c2ccccn2 164044bf4365400afd31c56e41446a8e [0,0,0,1,0,0|3,0,0]=4 3954 B16R2.3896 C[C@@H]1COCCN1C(=O)c2cccnc2 705830fea9c733b2b558ca97c7801889 [0,0,0,1,0,0|3,0,0]=4 3955 B16R2.3896 C[C@@H]1COCCN1C(=O)c2ccncc2 bdcfb2dab36bef18cf91aeb0026e4fbc [0,0,0,1,0,0|3,0,0]=4 3956 B16R2.3896 C[C@H]1CCCCN1C(=O)c2ccccc2 f413165ce66aa42b923e56ed847a622c [0,0,0,1,0,0|1,0,0]=2 3957 B16R2.3896 C[C@H]1CCCCN1C(=O)c2ccccn2 0866a5a0898141d3099d758d6138be93 [0,0,0,1,0,0|2,0,0]=3 3958 B16R2.3896 C[C@H]1CCCCN1C(=O)c2cccnc2 d8c6d12016b1b05240f8a74fe8f063d8 [0,0,0,1,0,0|2,0,0]=3 3959 B16R2.3896 C[C@H]1CCCCN1C(=O)c2cccnn2 a104d72af18417936652c6791e993b8c [0,0,0,1,0,0|3,0,0]=4 3960 B16R2.3896 C[C@H]1CCCCN1C(=O)c2ccncc2 a1c0e792674c085029165ee85d83fef1 [0,0,0,1,0,0|2,0,0]=3 3961 B16R2.3896 C[C@H]1CCCCN1C(=O)c2ccncn2 34b4e864e886fb6ee254511a6ac1ed34 [0,0,0,1,0,0|3,0,0]=4 3962 B16R2.3896 C[C@H]1CCCCN1C(=O)c2ccnnc2 1b7d77358b312f0817f2e21d959f6aab [0,0,0,1,0,0|3,0,0]=4 3963 B16R2.3896 C[C@H]1CCCCN1C(=O)c2cnccn2 5adb1bbb33be4b60cc5b56efa1c805a0 [0,0,0,1,0,0|3,0,0]=4 3964 B16R2.3896 C[C@H]1CCCCN1C(=O)c2cncnc2 0b55b4ae63974a3a3f92faa2ebb331a3 [0,0,0,1,0,0|3,0,0]=4 3965 B16R2.3896 C[C@H]1CCCCN1C(=O)c2ncccn2 98457cac6be850613964f8bbce102ac1 [0,0,0,1,0,0|3,0,0]=4 3966 B16R2.3896 C[C@H]1COCCN1C(=O)c2ccccc2 f56b193742f5e1445489342ed1e26e5f [0,0,0,1,0,0|2,0,0]=3 3967 B16R2.3896 C[C@H]1COCCN1C(=O)c2ccccn2 144a5d711a4e6988ccd63a24b660f045 [0,0,0,1,0,0|3,0,0]=4 3968 B16R2.3896 C[C@H]1COCCN1C(=O)c2cccnc2 b57389b2d2062f476c0ad9c42cecaa45 [0,0,0,1,0,0|3,0,0]=4 3969 B16R2.3896 C[C@H]1COCCN1C(=O)c2ccncc2 3de272c2129b0769893a565ffe3ca315 [0,0,0,1,0,0|3,0,0]=4 3970 B16R2.5767 C=C(COC1CCCC1)c2ccccc2 3ba8ac2980b469255e615ae7c49d8357 [0,0,0,1,0,0|3,0,0]=4 3971 B16R2.5767 CC(NCC1CCCC1)c2ccccc2 b0f7b1517149aae8a83e34f5f965fc8b [0,0,0,1,0,0|2,0,1]=4 3972 B16R2.5767 CC(OCC1CCCC1)c2ccccc2 89865facca0eadd37e21a525ecb98d06 [0,0,0,1,0,0|1,0,1]=3 3973 B16R2.5767 CC(OCC1CCCC1)c2ccccn2 98ae64be7349c33a54efc43df7ae9c57 [0,0,0,1,0,0|2,0,1]=4 3974 B16R2.5767 CC(OCC1CCCC1)c2cccnc2 da7327738de7097caa6431fe4ff17bca [0,0,0,1,0,0|2,0,1]=4 3975 B16R2.5767 CC(OCC1CCCC1)c2ccncc2 811f4d90ce40203f47d29fe183155042 [0,0,0,1,0,0|2,0,1]=4 3976 B16R2.5767 CC(OCC1CCOC1)c2ccccc2 992326d00bcd372ad5552755c4db00c0 [0,0,0,1,0,0|2,0,1]=4 3977 B16R2.5767 CN(CCC1CCCC1)c2ccccc2 f6e59b52cf717128e56c56625c3376c8 [0,0,0,1,0,0|3,0,0]=4 3978 B16R2.5767 C[C@@H](NCC1CCCC1)c2ccccc2 40836315abd781812f8dc7c227f80c1a [0,0,0,1,0,0|2,0,1]=4 3979 B16R2.5767 C[C@@H](OCC1CCCC1)c2ccccc2 b4a76ab91aebf4c816904ca9c4b123cb [0,0,0,1,0,0|1,0,1]=3 3980 B16R2.5767 C[C@@H](OCC1CCCC1)c2ccccn2 f33eb3f7aafa2dae3000e123230fd9d7 [0,0,0,1,0,0|2,0,1]=4 3981 B16R2.5767 C[C@@H](OCC1CCCC1)c2cccnc2 75360caf622e9e82d18f09eed2d9eca0 [0,0,0,1,0,0|2,0,1]=4 3982 B16R2.5767 C[C@@H](OCC1CCCC1)c2ccncc2 f52a0e5994054cb44c0c49cdf5ced11b [0,0,0,1,0,0|2,0,1]=4 3983 B16R2.5767 C[C@@H](OCC1CCOC1)c2ccccc2 764f9d046b8086ab1e277b3480f5c6c0 [0,0,0,1,0,0|2,0,1]=4 3984 B16R2.5767 C[C@H](NCC1CCCC1)c2ccccc2 7781d21de2769f5d787ec9860bb822d5 [0,0,0,1,0,0|2,0,1]=4 3985 B16R2.5767 C[C@H](OCC1CCCC1)c2ccccc2 5155f51ffc40afde605de7fca395517a [0,0,0,1,0,0|1,0,1]=3 3986 B16R2.5767 C[C@H](OCC1CCCC1)c2ccccn2 81c7d9e2a83addd1687020e82ffa00fd [0,0,0,1,0,0|2,0,1]=4 3987 B16R2.5767 C[C@H](OCC1CCCC1)c2cccnc2 198c5636b15ae75f8791070b80859beb [0,0,0,1,0,0|2,0,1]=4 3988 B16R2.5767 C[C@H](OCC1CCCC1)c2ccncc2 06e33729335f81cf17e07c2827dafdad [0,0,0,1,0,0|2,0,1]=4 3989 B16R2.5767 C[C@H](OCC1CCOC1)c2ccccc2 6ed4290d9a07f0c17d77500126283b2a [0,0,0,1,0,0|2,0,1]=4 3990 B16R2.5767 O=C(CCN1CCSC1)c2ccccc2 7e9bb23dcea277cbcf993f9bbf0442b8 [0,0,0,1,0,0|3,0,0]=4 3991 B16R2.5767 O=C(CNC1CCCC1)c2ccccc2 5446b19f3f346e7d18aa1d2675077189 [0,0,0,1,0,0|2,0,0]=3 3992 B16R2.5767 O=C(CNC1CCCC1)c2ccccn2 04e2ce938ccdaed95527df8b617f0973 [0,0,0,1,0,0|3,0,0]=4 3993 B16R2.5767 O=C(CNC1CCCC1)c2cccnc2 380653b67e8ef99debdd46ccef67862a [0,0,0,1,0,0|3,0,0]=4 3994 B16R2.5767 O=C(CNC1CCOC1)c2ccccc2 9d266dd0d9817cfe8519e07d265e5ffe [0,0,0,1,0,0|3,0,0]=4 3995 B16R2.5767 O=C(CNC1CCSC1)c2ccccc2 cfdf626dbde498dbeed0b102eb328dd2 [0,0,0,1,0,0|3,0,0]=4 3996 B16R2.5767 O=C(CN[C@@H]1CCOC1)c2ccccc2 f0a17831396cf505f8311b4e89972b94 [0,0,0,1,0,0|3,0,0]=4 3997 B16R2.5767 O=C(CN[C@H]1CCOC1)c2ccccc2 dc089808917bb4d4d2fb9c2ba967c5e9 [0,0,0,1,0,0|3,0,0]=4 3998 B16R2.5767 O=C(COC1CCCC1)c2ccccc2 b10ca01566a060b7d1e16138fc3b9fc4 [0,0,0,1,0,0|2,0,0]=3 3999 B16R2.5767 O=C(COC1CCCC1)c2ccccn2 44bd269ff8cf8fc780d0fc3b6216238e [0,0,0,1,0,0|3,0,0]=4 4000 B16R2.5767 O=C(COC1CCCC1)c2cccnc2 6263f2279dbf4268dff2e0898e9d22fa [0,0,0,1,0,0|3,0,0]=4 4001 B16R2.5767 O=C(COC1CCCO1)c2ccccc2 a6ad541ccc5d4dd6cbcaed3f78db6de1 [0,0,0,1,0,0|3,0,0]=4 4002 B16R2.5767 O=C(COC1CCOC1)c2ccccc2 bfc0a442b8b6ec265ab57d7444c3b615 [0,0,0,1,0,0|3,0,0]=4 4003 B16R2.5767 O=C(COC1CCSC1)c2ccccc2 e9a9a753e33a1c9da4ce73a77a8e1cd2 [0,0,0,1,0,0|3,0,0]=4 4004 B16R2.5767 O=C(CO[C@@H]1CCOC1)c2ccccc2 dcd0d38e797675d3e5f6c1a9b57e69a5 [0,0,0,1,0,0|3,0,0]=4 4005 B16R2.5767 O=C(CO[C@@H]1CCSC1)c2ccccc2 2cdba9ea80898b8c744f15218cd7d540 [0,0,0,1,0,0|3,0,0]=4 4006 B16R2.5767 O=C(CO[C@H]1CCOC1)c2ccccc2 3dec9f3613a510ed087c0e1d9985af02 [0,0,0,1,0,0|3,0,0]=4 4007 B16R2.5767 O=C(CO[C@H]1CCSC1)c2ccccc2 7a21a026f18a4b99862269e888cf2328 [0,0,0,1,0,0|3,0,0]=4 4008 B16R2.5767 O=C(NCC1CC=CC1)c2ccccc2 b803a5f0bb19f539d49a72a4e8f79d1d [0,0,0,1,0,0|1,0,2]=4 4009 B16R2.5767 O=C(NCC1CCCC1)c2ccccc2 416d739bcd2b3a0a6ef55d8483cb962a [0,0,0,1,0,0|1,0,0]=2 4010 B16R2.5767 O=C(NCC1CCCC1)c2ccccn2 229c97cab0dc4c80369b8b1539a28072 [0,0,0,1,0,0|2,0,0]=3 4011 B16R2.5767 O=C(NCC1CCCC1)c2cccnc2 ed32d0b8f11a0e8b5402d7ae941e12e0 [0,0,0,1,0,0|2,0,0]=3 4012 B16R2.5767 O=C(NCC1CCCC1)c2cccnn2 b5b553b1a1bfd919b3ba1be1d0904ca3 [0,0,0,1,0,0|3,0,0]=4 4013 B16R2.5767 O=C(NCC1CCCC1)c2ccncc2 75ab251d825e9ad8f8aa6f3996106183 [0,0,0,1,0,0|2,0,0]=3 4014 B16R2.5767 O=C(NCC1CCCC1)c2ccncn2 cc4050dcddfffee8e4a48d5fdd21040a [0,0,0,1,0,0|3,0,0]=4 4015 B16R2.5767 O=C(NCC1CCCC1)c2ccnnc2 1150439eecda7371cb760553fe45cf59 [0,0,0,1,0,0|3,0,0]=4 4016 B16R2.5767 O=C(NCC1CCCC1)c2cnccn2 dc0b134b6a6f5c69e200bc160cd8a770 [0,0,0,1,0,0|3,0,0]=4 4017 B16R2.5767 O=C(NCC1CCCC1)c2cncnc2 ff455592c47000362e48ae17a23f0867 [0,0,0,1,0,0|3,0,0]=4 4018 B16R2.5767 O=C(NCC1CCCC1)c2ncccn2 6a48a498390e8656dcc8484f7e43a64d [0,0,0,1,0,0|3,0,0]=4 4019 B16R2.5767 O=C(NCC1CCCO1)c2ccccc2 cb1317eec01f35117acb78801a2b8e9a [0,0,0,1,0,0|2,0,0]=3 4020 B16R2.5767 O=C(NCC1CCCO1)c2ccccn2 247ccf3b76a42c234ec4e05d73734c38 [0,0,0,1,0,0|3,0,0]=4 4021 B16R2.5767 O=C(NCC1CCCO1)c2cccnc2 44a9feec37bb75761e47571eee8bd389 [0,0,0,1,0,0|3,0,0]=4 4022 B16R2.5767 O=C(NCC1CCCO1)c2ccncc2 a5fbcd81876d247f5950e08d6f041f98 [0,0,0,1,0,0|3,0,0]=4 4023 B16R2.5767 O=C(NCC1CCOC1)c2ccccc2 acc5eefbf2f48f01eac8d62ac364a8f6 [0,0,0,1,0,0|2,0,0]=3 4024 B16R2.5767 O=C(NCC1CCOC1)c2ccccn2 c3783fe601e308c050607f9d4af1fb27 [0,0,0,1,0,0|3,0,0]=4 4025 B16R2.5767 O=C(NCC1CCOC1)c2cccnc2 38d13bd0abf96525c2a2185db3418d8b [0,0,0,1,0,0|3,0,0]=4 4026 B16R2.5767 O=C(NCC1CCOC1)c2ccncc2 f00c8ea88549769e38e10a998ca02aae [0,0,0,1,0,0|3,0,0]=4 4027 B16R2.5767 O=C(NC[C@@H]1CCCO1)c2ccccc2 1d172cfba068a7cc18925f1258283f56 [0,0,0,1,0,0|2,0,0]=3 4028 B16R2.5767 O=C(NC[C@@H]1CCCO1)c2ccccn2 c57578b88566bfbf05fd327dcc56a033 [0,0,0,1,0,0|3,0,0]=4 4029 B16R2.5767 O=C(NC[C@@H]1CCCO1)c2cccnc2 9f6bf435c7f167a7e6d8f63860215ad4 [0,0,0,1,0,0|3,0,0]=4 4030 B16R2.5767 O=C(NC[C@@H]1CCCO1)c2ccncc2 fc570fbaa318d4bf2907b8671d1edcab [0,0,0,1,0,0|3,0,0]=4 4031 B16R2.5767 O=C(NC[C@@H]1CCOC1)c2ccccc2 c52ccfe703247b57dbb88e13daa19af7 [0,0,0,1,0,0|2,0,0]=3 4032 B16R2.5767 O=C(NC[C@@H]1CCOC1)c2ccccn2 12be35b794d57885d84969dd37aa74ec [0,0,0,1,0,0|3,0,0]=4 4033 B16R2.5767 O=C(NC[C@@H]1CCOC1)c2cccnc2 104e0ae664e38487311b1fc582d8579b [0,0,0,1,0,0|3,0,0]=4 4034 B16R2.5767 O=C(NC[C@@H]1CCOC1)c2ccncc2 ca02a47de9287161000415e0d7bd8b08 [0,0,0,1,0,0|3,0,0]=4 4035 B16R2.5767 O=C(NC[C@H]1CCCO1)c2ccccc2 848dc4280c3bfdb5196ac7d223ce7ab3 [0,0,0,1,0,0|2,0,0]=3 4036 B16R2.5767 O=C(NC[C@H]1CCCO1)c2ccccn2 345633d3233fb42505d8171070653d6d [0,0,0,1,0,0|3,0,0]=4 4037 B16R2.5767 O=C(NC[C@H]1CCCO1)c2cccnc2 eb4efa76a0272a3bc4c68103d01b5958 [0,0,0,1,0,0|3,0,0]=4 4038 B16R2.5767 O=C(NC[C@H]1CCCO1)c2ccncc2 ae23a204922719895617e7b239a58337 [0,0,0,1,0,0|3,0,0]=4 4039 B16R2.5767 O=C(NC[C@H]1CCOC1)c2ccccc2 dbb3b4e96a897a6d0301c0784bdb41af [0,0,0,1,0,0|2,0,0]=3 4040 B16R2.5767 O=C(NC[C@H]1CCOC1)c2ccccn2 664c153d76564f3865896b35d3a91b16 [0,0,0,1,0,0|3,0,0]=4 4041 B16R2.5767 O=C(NC[C@H]1CCOC1)c2cccnc2 1b01f96be6458f7985c5c975e5a739a4 [0,0,0,1,0,0|3,0,0]=4 4042 B16R2.5767 O=C(NC[C@H]1CCOC1)c2ccncc2 954f9f39675fd7abef7d7f2154f40f9a [0,0,0,1,0,0|3,0,0]=4 4043 B16R2.5767 O=C(OCN1CC=CC1)c2ccccc2 e103bcc1697a098d106fc2df2ec152b8 [0,0,0,1,0,0|1,0,2]=4 4044 B16R2.5767 O=C(OCN1CCSC1)c2ccccc2 e97b52afdaf9d85eda89914fff365116 [0,0,0,1,0,0|2,0,0]=3 4045 B16R2.5767 O=S(CNC1CCCC1)c2ccccc2 d00886d26cb71c98710b303817b3ebb1 [0,0,0,1,0,0|3,0,0]=4 4046 B16R2.5767 O=S(COC1CCCC1)c2ccccc2 9199222e1e51a8ad1a2cf235d3728927 [0,0,0,1,0,0|3,0,0]=4 4047 B16R2.6329 C#CCCNC1OC(=O)c2c1cccc2 0de6745df2b284b34015bcb9e5b4699c [0,0,0,1,0,0|1,0,2]=4 4048 B16R2.6329 C#CCCOC1OC(=O)c2c1cccc2 8d97e883689418cd9537aa5b91fcca8f [0,0,0,1,0,0|1,0,2]=4 4049 B16R2.6329 C/C=C/COC1OC(=O)c2c1cccc2 d9dd948370b0a5f642bd597117b112b6 [0,0,0,1,0,0|1,0,2]=4 4050 B16R2.6329 C/C=C\COC1OC(=O)c2c1cccc2 f19ce1b6ed576adf71622a0907a041e7 [0,0,0,1,0,0|1,0,2]=4 4051 B16R2.6329 C=CCCNC1OC(=O)c2c1cccc2 ae1bd4c9acbd492352d01859e501a416 [0,0,0,1,0,0|1,0,2]=4 4052 B16R2.6329 C=CCCOC1OC(=O)c2c1cccc2 ce24c0650d2a879f3cf0933dee08522c [0,0,0,1,0,0|1,0,2]=4 4053 B16R2.6329 CC=CCNC1OC(=O)c2c1cccc2 a024afbb85ca48fe925923c50a281467 [0,0,0,1,0,0|1,0,2]=4 4054 B16R2.6329 CC=CCOC1OC(=O)c2c1cccc2 6d85fd183e8647fdc7e47dc085bcf71f [0,0,0,1,0,0|1,0,2]=4 4055 B16R2.6329 CCCCNC1CC(=O)c2c1cccc2 22c7bf5186a5b68caa8ace7837fde942 [0,0,0,1,0,0|2,0,0]=3 4056 B16R2.6329 CCCCNC1NC(=O)c2c1cccc2 7bab1321727e23621eb3c44028418a01 [0,0,0,1,0,0|2,0,0]=3 4057 B16R2.6329 CCCCOC1CC(=O)c2c1cccc2 f507a9d581849f3658011ab28f7d77b4 [0,0,0,1,0,0|2,0,0]=3 4058 B16R2.6329 CCCCOC1OC(=O)c2c1cccc2 a14ef27256a5c5f5a9e1cddad663c6cc [0,0,0,1,0,0|1,0,0]=2 4059 B16R2.6329 CCCCOC1OC(=O)c2c1cncc2 b89989edabc1537d57cadf506af562a1 [0,0,0,1,0,0|2,0,0]=3 4060 B16R2.6329 CCOCNC1NC(=O)c2c1cccc2 ecd688f367366607d873251b233ca390 [0,0,0,1,0,0|3,0,0]=4 4061 B16R2.6329 CCOCOC1CC(=O)c2c1cccc2 58c55667250510b8076f7f88860e2305 [0,0,0,1,0,0|3,0,0]=4 4062 B16R2.6329 CCOCOC1OC(=O)c2c1cncc2 18b93ca553b82dd93fc4888f781646de [0,0,0,1,0,0|3,0,0]=4 4063 B16R2.6329 COCCNC1CC(=O)c2c1cccc2 0dd3062bdb046c4ae10da20c12ba1a2a [0,0,0,1,0,0|3,0,0]=4 4064 B16R2.6329 COCCNC1NC(=O)c2c1cccc2 2bb3fb4ff7cb6c45a22fb3f2b2cf56ed [0,0,0,1,0,0|3,0,0]=4 4065 B16R2.6329 COCCOC1CC(=O)c2c1cccc2 d0bc03e4ae08dc40d7444cacdf554e3f [0,0,0,1,0,0|3,0,0]=4 4066 B16R2.6329 COCCOC1OC(=O)c2c1cccc2 d683fb6b0d44492676b535284e6d57bb [0,0,0,1,0,0|2,0,0]=3 4067 B16R2.6329 COCCOC1OC(=O)c2c1cncc2 3c3781a5f45f284f2c38affafa00c01f [0,0,0,1,0,0|3,0,0]=4 4068 B16R2.6329 CSCCNC1CC(=O)c2c1cccc2 1fb6b13fe1cb0131b2e7822b006c0ae5 [0,0,0,1,0,0|3,0,0]=4 4069 B16R2.6329 CSCCNC1NC(=O)c2c1cccc2 d409baa575f69c51dc5af484d2735a28 [0,0,0,1,0,0|3,0,0]=4 4070 B16R2.6329 CSCCNC1OC(=O)c2c1cccc2 f709bb29021ea1f061cd4ce197239b61 [0,0,0,1,0,0|2,0,0]=3 4071 B16R2.6329 CSCCOC1CC(=O)c2c1cccc2 475c6d2f23bdffe00466a5a6cffdf6ce [0,0,0,1,0,0|3,0,0]=4 4072 B16R2.6329 CSCCOC1OC(=O)c2c1cccc2 880a3688b0cb83e3ca151cf18b18430b [0,0,0,1,0,0|2,0,0]=3 4073 B16R2.6329 CSCCOC1OC(=O)c2c1cncc2 6778bb66fa75df925c39117c129e3920 [0,0,0,1,0,0|3,0,0]=4 4074 B16R2.6329 N#CCCNC1OC(=O)c2c1cccc2 cf7199669bac50f1e05df8d79861be8a [0,0,0,1,0,0|2,0,1]=4 4075 B16R2.6329 N#CCCOC1OC(=O)c2c1cccc2 cc0da5ea9f2bde3936be2c9337d0b581 [0,0,0,1,0,0|2,0,1]=4 4076 B16R2.6329 O=C1CC(c2c1cccc2)NCCCCl 97793296e5be383b1caa386a0890fb08 [0,0,0,1,0,0|3,0,0]=4 4077 B16R2.6329 O=C1CC(c2c1cccc2)NCCCO fec7e27a743cd9ab5cf558345871ba61 [0,0,0,1,0,0|3,0,0]=4 4078 B16R2.6329 O=C1CC(c2c1cccc2)OCCCF aa73f25d89f4a87b668db09194803907 [0,0,0,1,0,0|3,0,0]=4 4079 B16R2.6329 O=C1CC(c2c1cccc2)OCCCS 6a2caa59378f76e644ba3ce9f0c2b187 [0,0,0,1,0,0|3,0,0]=4 4080 B16R2.6329 O=C1NC(c2c1cccc2)NCCCF 085039cc3e4929cb0e94483f4f0ea27f [0,0,0,1,0,0|3,0,0]=4 4081 B16R2.6329 O=C1NC(c2c1cccc2)NCCCO 0c70acda767acce4c3ceedb634ec3813 [0,0,0,1,0,0|3,0,0]=4 4082 B16R2.6329 O=C1NC(c2c1cccc2)NCCCS e86a8163c4ecf7d921f9fe3ca704fdc3 [0,0,0,1,0,0|3,0,0]=4 4083 B16R2.6329 O=C1OC(c2c1cccc2)NCCCO abe3f527531dad291eefaf0b9a05e205 [0,0,0,1,0,0|2,0,0]=3 4084 B16R2.6329 O=C1OC(c2c1cccc2)OCCCF b0be02c966a8abdcb31f254dd20fc3b5 [0,0,0,1,0,0|2,0,0]=3 4085 B16R2.6329 O=C1OC(c2c1cccc2)OCCCS 619ca0c0d92a78d4b1bce296928c54f2 [0,0,0,1,0,0|2,0,0]=3 4086 B16R2.6329 O=C1OC(c2c1ccnc2)OCCCF fcf8e112869f8d3b8e0222c42cd7e61f [0,0,0,1,0,0|3,0,0]=4 4087 B16R2.6329 O=C1OC(c2c1ccnc2)OCCCS 4b9e2fea8a77928c3e2db222ecf5e22e [0,0,0,1,0,0|3,0,0]=4 4088 B16R2.6329 O=CCCOC1OC(=O)c2c1cccc2 f1a3cef04c9a07592a518017ec1ebe65 [0,0,0,1,0,0|2,0,1]=4 4089 B16R2.12192 CCCCN1CCC(=O)c2c1ccnc2 fbca45eaa787dddbf733011943868549 [0,0,0,1,0,0|3,0,0]=4 4090 B16R2.12192 CCCCN1CCC(=O)c2c1nccc2 ad49d8339db06ac95f435b8ab1d926d8 [0,0,0,1,0,0|3,0,0]=4 4091 B16R2.12192 CCCOC1CCC(=O)c2c1cccc2 14301ff26f8cc956c0af3481d084497f [0,0,0,1,0,0|2,0,0]=3 4092 B16R2.12192 COCCN1CCC(=O)c2c1cccc2 a940d38fbb6a65bda7415913ab6eb94f [0,0,0,1,0,0|3,0,0]=4 4093 B16R2.12192 COCOC1CCC(=O)c2c1cccc2 0909dd62db8044ddc61d033652632a50 [0,0,0,1,0,0|3,0,0]=4 4094 B16R2.12192 CSCCN1CCC(=O)c2c1cccc2 8777fbe937ad66df0e1045832a3bcb65 [0,0,0,1,0,0|3,0,0]=4 4095 B16R2.12192 CSCOC1CCC(=O)c2c1cccc2 7d5efd80904ae2319269780956cee3f1 [0,0,0,1,0,0|3,0,0]=4 4096 B16R2.12192 O=C1CCC(c2c1cccc2)NCCI 6a2ef27b262375e3ecae12dcdd70932a [0,0,0,1,0,0|3,0,0]=4 4097 B16R2.12192 O=C1CCC(c2c1cccc2)NCCO eee9e64af223dadffe55fb74e0ac7e7a [0,0,0,1,0,0|3,0,0]=4 4098 B16R2.12192 O=C1CCC(c2c1cccc2)OCCF 606956db7e919317d3ee3eb8e838400a [0,0,0,1,0,0|3,0,0]=4 4099 B16R2.12192 O=C1CCC(c2c1cccc2)OCCS cc51e20f78c6faa4effb457efde8d4aa [0,0,0,1,0,0|3,0,0]=4 4100 B16R2.12192 O=C1CCN(c2c1cccc2)CCCO f70bbf9f0464ed284ce54dc073331f6b [0,0,0,1,0,0|3,0,0]=4 4101 B16R2.27749 C=C(CNCCC1CC1)c2ccccc2 8ca4abde7807d8ecedb7d3596be52f49 [0,0,0,1,0,0|3,0,0]=4 4102 B16R2.27749 C=C(COCCC1CC1)c2ccccc2 f85e509167ca718bbd88fcf167fe3856 [0,0,0,1,0,0|3,0,0]=4 4103 B16R2.27749 CC(OCCOC1CC1)c2ccccc2 5c98bac1a89e8e25cd2fee4a2459386f [0,0,0,1,0,0|2,0,1]=4 4104 B16R2.27749 C[C@@H](OCCOC1CC1)c2ccccc2 8e2471a9cafdd57aaaedc5a0795e2e16 [0,0,0,1,0,0|2,0,1]=4 4105 B16R2.27749 C[C@H](OCCOC1CC1)c2ccccc2 8775ec15e90a4620bb966eb69a4732e5 [0,0,0,1,0,0|2,0,1]=4 4106 B16R2.27749 O=C(CCCOC1CC1)c2ccccc2 6bafa30af62db3adcb6f312ec7e30acf [0,0,0,1,0,0|2,0,0]=3 4107 B16R2.27749 O=C(CCCOC1CC1)c2cccnc2 8943861a71565be0a7ac224856589e63 [0,0,0,1,0,0|3,0,0]=4 4108 B16R2.27749 O=C(CCOCC1CC1)c2ccccc2 81fd9632223166dfe9dac5a2595f052c [0,0,0,1,0,0|2,0,0]=3 4109 B16R2.27749 O=C(CNCCC1CC1)c2ccccc2 e3340b11e8d761cb648cdb86e3407dda [0,0,0,1,0,0|2,0,0]=3 4110 B16R2.27749 O=C(CNCCC1CC1)c2ccccn2 7c2a2f615c9d4d7ed2c8d254cab7389a [0,0,0,1,0,0|3,0,0]=4 4111 B16R2.27749 O=C(CNCCC1CC1)c2cccnc2 f0191831f7099759b6f28ea10ea8254a [0,0,0,1,0,0|3,0,0]=4 4112 B16R2.27749 O=C(CNCCN1CC1)c2ccccc2 64fc28280d63b20cd37e6f06c6db1236 [0,0,0,1,0,0|3,0,0]=4 4113 B16R2.27749 O=C(COCCC1CC1)c2ccccc2 7cd06f3bc926d85ae364b092221662f1 [0,0,0,1,0,0|2,0,0]=3 4114 B16R2.27749 O=C(COCCC1CC1)c2ccccn2 2998e2660f125357f1c4aad8ddc0d568 [0,0,0,1,0,0|3,0,0]=4 4115 B16R2.27749 O=C(COCCC1CC1)c2cccnc2 6d0f5b97ddb88dc523a63a181a121ed5 [0,0,0,1,0,0|3,0,0]=4 4116 B16R2.27749 O=C(COCCN1CC1)c2ccccc2 847010ad4365ab7aec43ebe46d9d901e [0,0,0,1,0,0|3,0,0]=4 4117 B16R2.27749 O=C(NCCNC1CC1)c2ccccc2 60ef6cd857784f45db324359b2f505fa [0,0,0,1,0,0|2,0,0]=3 4118 B16R2.27749 O=C(NCCNC1CC1)c2ccccn2 bfcd81057a13f1950a0b3c19e5ff79d6 [0,0,0,1,0,0|3,0,0]=4 4119 B16R2.27749 O=C(NCCNC1CC1)c2ccncc2 f5666d4beaf62d79404721232f1a1ffd [0,0,0,1,0,0|3,0,0]=4 4120 B16R2.27749 O=C(NCCOC1CC1)c2ccccc2 f486152fa7c9fa1f430029f7a6839c7a [0,0,0,1,0,0|2,0,0]=3 4121 B16R2.27749 O=C(NCCOC1CC1)c2ccccn2 1a24acf7de6b4b760a72d1dc8b645d9b [0,0,0,1,0,0|3,0,0]=4 4122 B16R2.27749 O=C(NCCOC1CC1)c2cccnc2 239ed7365cf1d1813179f2914f048ddd [0,0,0,1,0,0|3,0,0]=4 4123 B16R2.27749 O=C(NCCOC1CC1)c2ccncc2 fe31a3a89fa0caff801db6cf445d839c [0,0,0,1,0,0|3,0,0]=4 4124 B16R2.27749 O=C(NCOCC1CC1)c2ccccc2 26b5aa49f56bc6447e5709e23ccdc584 [0,0,0,1,0,0|2,0,0]=3 4125 B16R2.27749 O=C(NCOCC1CC1)c2cccnc2 bd35b0617c935ac08918bfadf520e1a7 [0,0,0,1,0,0|3,0,0]=4 4126 B16R2.27749 O=C(OCCNC1CC1)c2ccccc2 0904a6ad9c1cecf7fb801ce52fee37b1 [0,0,0,1,0,0|1,0,0]=2 4127 B16R2.27749 O=C(OCCOC1CC1)c2ccccc2 22bb86bba5665036a47a8d8675cc8f90 [0,0,0,1,0,0|1,0,0]=2 4128 B16R2.27749 O=C(OCCOC1CC1)c2cccnc2 b322add42c7780442b5bef42c7dc07e1 [0,0,0,1,0,0|2,0,0]=3 4129 B16R2.27749 O=C(OCNCC1CC1)c2ccccc2 fa54905c67fc90c3a8384c63a0d61a42 [0,0,0,1,0,0|1,0,0]=2 4130 B16R2.27749 O=C(OCOCC1CC1)c2ccccc2 d6bd07c13dc138fc0d3da53c78ebc47b [0,0,0,1,0,0|1,0,0]=2 4131 B16R2.27749 O=S(CCCOC1CC1)c2ccccc2 48c85230a8d4c5d3699f0feb48955ad0 [0,0,0,1,0,0|3,0,0]=4 4132 B16R2.27749 O=S(CCOCC1CC1)c2ccccc2 bb70d836a4dfa8b22a3c9028223a2e3f [0,0,0,1,0,0|3,0,0]=4 4133 B16R2.28258 CCCN1CCCC(=O)c2c1cccc2 2ca2dab3fe2253abac911335ece937aa [0,0,0,1,0,0|2,0,0]=3 4134 B16R2.28258 CCCN1CCNC(=O)c2c1cccc2 5e58f85242d03528b64f0068e73e0f21 [0,0,0,1,0,0|2,0,0]=3 4135 B16R2.28258 CCO[C@@H]1CCCC(=O)c2c1nccc2 a7f288c81cea67acd8d0252b0649208e [0,0,0,1,0,0|3,0,0]=4 4136 B16R2.28258 CCO[C@H]1CCCC(=O)c2c1nccc2 2277c78c01c9b058c4faf79768f78899 [0,0,0,1,0,0|3,0,0]=4 4137 B16R2.28258 COCN1CCCC(=O)c2c1cccc2 4911861e93d04b462c90fd555f6d11ab [0,0,0,1,0,0|3,0,0]=4 4138 B16R2.28258 COCN1CCNC(=O)c2c1cccc2 39431dfef5321ba5a670d194048d4c51 [0,0,0,1,0,0|3,0,0]=4 4139 B16R2.28258 CSCN1CCCC(=O)c2c1cccc2 1adbb93e82f8021b178955800fec9511 [0,0,0,1,0,0|3,0,0]=4 4140 B16R2.28258 CSCN1CCNC(=O)c2c1cccc2 f279dbf1352d45b31ac05d93a521c455 [0,0,0,1,0,0|3,0,0]=4 4141 B16R2.28258 O=C1CCCN(c2c1cccc2)CCO 0064a09c455f7dbb62a75d4f598b1c6d [0,0,0,1,0,0|3,0,0]=4 4142 B16R2.28258 O=C1CCCN(c2c1cccc2)CCS b7b42d9308730053301bd87dc848b509 [0,0,0,1,0,0|3,0,0]=4 4143 B16R2.28258 O=C1NCCN(c2c1cccc2)CCF 38d73c6720c7fff3bcf247ff213fbaa0 [0,0,0,1,0,0|3,0,0]=4 4144 B16R2.28258 O=C1NCCN(c2c1cccc2)CCO 10eaaf52871e4e1ce5406f9596b945be [0,0,0,1,0,0|3,0,0]=4 4145 B16R2.28258 O=C1NCCN(c2c1cccc2)CCS d1b82d85ea0e060f67ad78c21e3fe7d5 [0,0,0,1,0,0|3,0,0]=4 4146 B16R2.177828 CCCCCCNC1Cc2c1cccc2 f30cc9230babe9ac7197152b73806f65 [0,0,0,1,0,0|2,0,1]=4 4147 B16R2.177828 CCCCCCOC1Cc2c1cccc2 ee99e9fd3a4f677a2f94916d4ff545da [0,0,0,1,0,0|1,0,1]=3 4148 B16R2.177828 CCCCOCOC1Cc2c1cccc2 55aba9adc867a66d2d2854d6d2241b34 [0,0,0,1,0,0|2,0,1]=4 4149 B16R2.177828 CCCOCCOC1Cc2c1cccc2 4ffec1d2bdce8949d1b51b8dfb596452 [0,0,0,1,0,0|2,0,1]=4 4150 B16R2.177828 CCOCCCOC1Cc2c1cccc2 d86e608467ee5c257a5be7f6ccd33f39 [0,0,0,1,0,0|2,0,1]=4 4151 B16R2.177828 CCSCCCOC1Cc2c1cccc2 10096ff774a3b7c09393163d2596f10c [0,0,0,1,0,0|2,0,1]=4 4152 B16R2.177828 COCCCCOC1Cc2c1cccc2 d98ac8e526bf645e7718201fb91bca77 [0,0,0,1,0,0|2,0,1]=4 4153 B16R2.177828 FCCCCCOC1Cc2c1cccc2 8ebade8804861886878eb8fd61160a80 [0,0,0,1,0,0|2,0,1]=4 4154 B14R1.169 CCCCCCNC(=O)c1ccco1 029a58775391588ba58a37211d7ea375 [0,0,0,0,1,0|2,0,0]=3 4155 B14R1.169 CCCCCCNC(=O)c1cccs1 93d374971ccf10aac547c8b558be7c33 [0,0,0,0,1,0|2,0,0]=3 4156 B14R1.169 CCCCCCNC(=O)c1ccno1 50131b1c4f362293208dc04541ab4fdc [0,0,0,0,1,0|3,0,0]=4 4157 B14R1.169 CCCCCCNC(=O)c1ccns1 164362f5fad0d92e30fc99985a74c81e [0,0,0,0,1,0|3,0,0]=4 4158 B14R1.169 CCCCCCNC(=O)c1ccoc1 0cf0d841f6dd45ea4a4d2f13c13d4395 [0,0,0,0,1,0|2,0,0]=3 4159 B14R1.169 CCCCCCNC(=O)c1ccon1 dfdd624a74b6d9997c385a4e57922f36 [0,0,0,0,1,0|3,0,0]=4 4160 B14R1.169 CCCCCCNC(=O)c1ccsc1 b698d390a5ba09068ac66acc19125347 [0,0,0,0,1,0|2,0,0]=3 4161 B14R1.169 CCCCCCNC(=O)c1ccsn1 075bb0da5f022f63b78c1f5dec461717 [0,0,0,0,1,0|3,0,0]=4 4162 B14R1.169 CCCCCCNC(=O)c1cnco1 cd7570d9fa3f7025cfbc61a4c8a6f2fa [0,0,0,0,1,0|3,0,0]=4 4163 B14R1.169 CCCCCCNC(=O)c1cncs1 37c08142e08e6c2fae114814091e1336 [0,0,0,0,1,0|3,0,0]=4 4164 B14R1.169 CCCCCCNC(=O)c1cnoc1 e32c4e968fbdf7346f2ebb24983557db [0,0,0,0,1,0|3,0,0]=4 4165 B14R1.169 CCCCCCNC(=O)c1cnsc1 3aae71d6ad70431eac7108ee771fcef1 [0,0,0,0,1,0|3,0,0]=4 4166 B14R1.169 CCCCCCNC(=O)c1cocn1 3ede2d6a4ec92ebbd3e4ebf5bb456f52 [0,0,0,0,1,0|3,0,0]=4 4167 B14R1.169 CCCCCCNC(=O)c1cscn1 65eb73bca9dbf335b011ef0ff51149b3 [0,0,0,0,1,0|3,0,0]=4 4168 B14R1.169 CCCCCCNC(=O)c1ncco1 3f3bbda4829463c02b108a38263fb506 [0,0,0,0,1,0|3,0,0]=4 4169 B14R1.169 CCCCCCNC(=O)c1nccs1 b4813269e105a3a708b98f4b3420c7fc [0,0,0,0,1,0|3,0,0]=4 4170 B14R1.169 CCCCCCOC(C)c1ccco1 49c944cb5cb28382ee337b57bdb2afbf [0,0,0,0,1,0|2,0,1]=4 4171 B14R1.169 CCCCCCOC(C)c1cccs1 dff4a304419216322f891a351fa497f2 [0,0,0,0,1,0|2,0,1]=4 4172 B14R1.169 CCCCCCOC(C)c1ccsc1 178141215debb53eb641d9424de4620e [0,0,0,0,1,0|2,0,1]=4 4173 B14R1.169 CCCCCCO[C@@H](C)c1cccs1 3cf8fcfcd0b82d14974545bad508c6ad [0,0,0,0,1,0|2,0,1]=4 4174 B14R1.169 CCCCCCO[C@H](C)c1ccco1 dd51a6da7da95ce159e05b69ff82f2b7 [0,0,0,0,1,0|2,0,1]=4 4175 B14R1.169 CCCCCCO[C@H](C)c1cccs1 61a81ca81b569f31003579f92abe04bd [0,0,0,0,1,0|2,0,1]=4 4176 B14R1.169 CCCCCNCC(=O)c1ccc[nH]1 d477c3d3222aac6f5425871115f068f1 [0,0,0,0,1,0|3,0,0]=4 4177 B14R1.169 CCCCCNCC(=O)c1ccco1 70d39794430c956c906bc285396dab25 [0,0,0,0,1,0|3,0,0]=4 4178 B14R1.169 CCCCCNCC(=O)c1cccs1 47ccb1d1511ce052cd242273f609fe84 [0,0,0,0,1,0|3,0,0]=4 4179 B14R1.169 CCCCCNCC(=O)c1ccsc1 2e55aaf0c5bc47a938009d9dde2784dd [0,0,0,0,1,0|3,0,0]=4 4180 B14R1.169 CCCCCOCC(=O)c1ccco1 f0f3d20184e5a761639d63b7fa4fb474 [0,0,0,0,1,0|3,0,0]=4 4181 B14R1.169 CCCCCOCC(=O)c1cccs1 3570fb4023149481dafd841e9b549f43 [0,0,0,0,1,0|3,0,0]=4 4182 B14R1.169 CCCCCOCC(=O)c1ccsc1 d5ad7c2a54c2aaa69f4781cad2a64efe [0,0,0,0,1,0|3,0,0]=4 4183 B14R1.169 CCCCNCCC(=O)c1cccs1 fca7ba41a707ada414a044ffb9c17c24 [0,0,0,0,1,0|3,0,0]=4 4184 B14R1.169 CCCOCCNC(=O)c1ccc[nH]1 1e3a6a3b725feabc39c39152fd13ece4 [0,0,0,0,1,0|3,0,0]=4 4185 B14R1.169 CCCOCCNC(=O)c1ccco1 ea0975d05683db78d6f17529833b4ef7 [0,0,0,0,1,0|3,0,0]=4 4186 B14R1.169 CCCOCCNC(=O)c1cccs1 7fc210a5440a9516b1768198f2331c6a [0,0,0,0,1,0|3,0,0]=4 4187 B14R1.169 CCCOCCNC(=O)c1ccoc1 275de975741408a3076e047fede7a4d4 [0,0,0,0,1,0|3,0,0]=4 4188 B14R1.169 CCCOCCNC(=O)c1ccsc1 e9c2e81d596fec38c54502d9ba620a89 [0,0,0,0,1,0|3,0,0]=4 4189 B14R1.169 CCOCCCNC(=O)c1ccco1 80f2befb2a60819db0470da2d52736a5 [0,0,0,0,1,0|3,0,0]=4 4190 B14R1.169 CCOCCCNC(=O)c1cccs1 f588d238ed915182b95052883aa7a999 [0,0,0,0,1,0|3,0,0]=4 4191 B14R1.169 CCOCCCNC(=O)c1ccoc1 6cb3609d7d8642e8c00462d173ae3f1a [0,0,0,0,1,0|3,0,0]=4 4192 B14R1.169 CCOCCCNC(=O)c1ccsc1 fb5e7739f4643eba982fbdd15d20593c [0,0,0,0,1,0|3,0,0]=4 4193 B14R1.169 COCCCCNC(=O)c1ccco1 fab44c8d0621f7dcf4ba03d4bd760fa3 [0,0,0,0,1,0|3,0,0]=4 4194 B14R1.169 COCCCCNC(=O)c1cccs1 1ec24ba3f6233ba410e3f26e90b9ce9d [0,0,0,0,1,0|3,0,0]=4 4195 B14R1.169 COCCCCNC(=O)c1ccoc1 4f4a656bf7fcb50d13865c9d880cbd21 [0,0,0,0,1,0|3,0,0]=4 4196 B14R1.169 COCCCCNC(=O)c1ccsc1 b53581e4bb3f1334a47ca80a12552511 [0,0,0,0,1,0|3,0,0]=4 4197 B14R1.169 CSCCCCNC(=O)c1ccco1 563dbec5502233ea01c041d11d98fc29 [0,0,0,0,1,0|3,0,0]=4 4198 B14R1.169 CSCCCCNC(=O)c1cccs1 4e20937b615b29448f7e0c2ea83c86d0 [0,0,0,0,1,0|3,0,0]=4 4199 B14R1.169 CSCCCCNC(=O)c1ccoc1 354a9135ba93218328623f036da0d343 [0,0,0,0,1,0|3,0,0]=4 4200 B14R1.169 CSCCCCNC(=O)c1ccsc1 21cfdef8c6e17ad4222d18d171ae8775 [0,0,0,0,1,0|3,0,0]=4 4201 B14R1.169 O=C(NCCCCCCl)c1ccco1 424a3cf533e8bdc9c8646612f3eab71b [0,0,0,0,1,0|3,0,0]=4 4202 B14R1.169 O=C(NCCCCCCl)c1cccs1 86fc9a5968310f1863e43baca9881132 [0,0,0,0,1,0|3,0,0]=4 4203 B14R1.169 O=C(NCCCCCCl)c1ccoc1 2caa7594b20715c511981c93311ac307 [0,0,0,0,1,0|3,0,0]=4 4204 B14R1.169 O=C(NCCCCCCl)c1ccsc1 c4f23f5c5c40e445e0a5b2f7cbccc2bf [0,0,0,0,1,0|3,0,0]=4 4205 B14R1.169 O=C(NCCCCCO)c1ccco1 a5b3d8d90f87f8a16fc8bfb3e24abedb [0,0,0,0,1,0|3,0,0]=4 4206 B14R1.169 O=C(NCCCCCO)c1cccs1 dc3461988153a3b07acb33ebd142d464 [0,0,0,0,1,0|3,0,0]=4 4207 B14R1.169 O=C(NCCCCCO)c1ccoc1 4f4d13da1c04a57786ef756b260826c5 [0,0,0,0,1,0|3,0,0]=4 4208 B14R1.169 O=C(NCCCCCO)c1ccsc1 4e89ab9ea8fc1c261a2a3abac5c9c852 [0,0,0,0,1,0|3,0,0]=4 4209 B16R1.693 C#CCCCCCC(=O)Nc1ccccc1 fa859898ea502bdb9cdd52356b6d1c28 [0,0,0,0,0,1|1,0,2]=4 4210 B16R1.693 C=CCCCCCC(=O)Nc1ccccc1 4f74d9a4459e27865f391f0db968ece2 [0,0,0,0,0,1|1,0,2]=4 4211 B16R1.693 C=CCCCCNC(=O)Nc1ccccc1 baef889ab60f00ad78d67314235eea03 [0,0,0,0,0,1|1,0,2]=4 4212 B16R1.693 CC(Cc1ccccc1)OCCCCCF 6f6bc508883abe3139ad16546a6f082f [0,0,0,0,0,1|2,0,1]=4 4213 B16R1.693 CCC/C=C/CCC(=O)Nc1ccccc1 bf78846316eded4a6c1de3f72cae4579 [0,0,0,0,0,1|1,0,2]=4 4214 B16R1.693 CCC/C=C\CCC(=O)Nc1ccccc1 a3e38b12744cb9597e156d80316aedcb [0,0,0,0,0,1|1,0,2]=4 4215 B16R1.693 CCCC/C=C/CC(=O)Nc1ccccc1 339ed7974533c0e77f08f15332a6758d [0,0,0,0,0,1|1,0,2]=4 4216 B16R1.693 CCCCC/C=C/C(=O)Nc1ccccc1 cf523aa2b6c4465ed8e634c9a5fe0040 [0,0,0,0,0,1|1,0,1]=3 4217 B16R1.693 CCCCC/C=C/C(=O)Nc1ccccn1 f12d87cc305eaba31f0f7ef832cc9224 [0,0,0,0,0,1|2,0,1]=4 4218 B16R1.693 CCCCC/C=C/C(=O)Nc1cccnc1 a4b41b87144064c1c8b253ebe76ca7e9 [0,0,0,0,0,1|2,0,1]=4 4219 B16R1.693 CCCCC/C=C/C(=O)Nc1ccncc1 49c7e705a6bc5aba0536934e57a8e154 [0,0,0,0,0,1|2,0,1]=4 4220 B16R1.693 CCCCCC#CC(=O)Nc1ccccn1 37d886a34cc6fdb6e4a035ed36cf1cdc [0,0,0,0,0,1|2,0,1]=4 4221 B16R1.693 CCCCCC#CC(=O)Nc1cccnc1 96f55ed2f6a746bf662276f8373a2b0a [0,0,0,0,0,1|2,0,1]=4 4222 B16R1.693 CCCCCC#CC(=O)Nc1ccncc1 106f894e4eda2d5dd0162b797d290043 [0,0,0,0,0,1|2,0,1]=4 4223 B16R1.693 CCCCCCCC(=O)Nc1ccccc1 f27e95ff48e990f690f14407b234a3d1 [0,0,0,0,0,1|1,0,0]=2 4224 B16R1.693 CCCCCCCC(=O)Nc1ccccn1 9f6c079cc4059db14f62480d4059c4e7 [0,0,0,0,0,1|2,0,0]=3 4225 B16R1.693 CCCCCCCC(=O)Nc1cccnc1 9409f4a79dc5d0ee676322334e5d424e [0,0,0,0,0,1|2,0,0]=3 4226 B16R1.693 CCCCCCCC(=O)Nc1cccnn1 866a48b42da86958825149b2e8502a00 [0,0,0,0,0,1|3,0,0]=4 4227 B16R1.693 CCCCCCCC(=O)Nc1ccncc1 0895ec83e50c1d0411de52f7d11144bd [0,0,0,0,0,1|2,0,0]=3 4228 B16R1.693 CCCCCCCC(=O)Nc1ccncn1 9d33c671687953145927ac4c624ee431 [0,0,0,0,0,1|3,0,0]=4 4229 B16R1.693 CCCCCCCC(=O)Nc1ccnnc1 c48ce0eaa084c498593dcf9d8a0ec7f3 [0,0,0,0,0,1|3,0,0]=4 4230 B16R1.693 CCCCCCCC(=O)Nc1cnccn1 2873c126381c130021dac6c72c8e5eff [0,0,0,0,0,1|3,0,0]=4 4231 B16R1.693 CCCCCCCN(C)Cc1ccccc1 5ac42b5aaf70fdb2aa5d97fca54fac40 [0,0,0,0,0,1|3,0,0]=4 4232 B16R1.693 CCCCCCC[C@H](C)Nc1ccccc1 8ece3bffd0632e526c240f96219fa6cf [0,0,0,0,0,1|2,0,1]=4 4233 B16R1.693 CCCCCCNC(=O)Cc1ccccn1 6e8bcd00943d804e4cc3bd425de1999e [0,0,0,0,0,1|2,0,0]=3 4234 B16R1.693 CCCCCCNC(=O)Cc1cccnc1 a51f85a4ec04d309ebf52fb44712e727 [0,0,0,0,0,1|2,0,0]=3 4235 B16R1.693 CCCCCCNC(=O)Cc1ccncc1 5facea844cbafc2579931dcdc3507827 [0,0,0,0,0,1|2,0,0]=3 4236 B16R1.693 CCCCCCNC(=O)Cc1ccncn1 065c16ce775aff6436f7fda5948bd1bd [0,0,0,0,0,1|3,0,0]=4 4237 B16R1.693 CCCCCCNC(=O)Cc1cnccn1 5abfcc684ad90322099b80a3e8841565 [0,0,0,0,0,1|3,0,0]=4 4238 B16R1.693 CCCCCCNC(=O)Cc1cncnc1 f20dd4a23bd71e14e6dfc9fd9b73f6e9 [0,0,0,0,0,1|3,0,0]=4 4239 B16R1.693 CCCCCCNC(=O)Cc1ncccn1 c01d9d0bec781567776f5c362d69b37a [0,0,0,0,0,1|3,0,0]=4 4240 B16R1.693 CCCCCCNC(=O)Nc1ccccn1 d13e453b7cd96a62523b0e5516fda3f6 [0,0,0,0,0,1|2,0,0]=3 4241 B16R1.693 CCCCCCNC(=O)Nc1cccnc1 8221fbb7d3f6a891155294d62394348b [0,0,0,0,0,1|2,0,0]=3 4242 B16R1.693 CCCCCCNC(=O)Nc1cccnn1 66f2867419f65844320eff5bcb028906 [0,0,0,0,0,1|3,0,0]=4 4243 B16R1.693 CCCCCCNC(=O)Nc1ccncc1 9f671c880842046de59cabad0f011bbf [0,0,0,0,0,1|2,0,0]=3 4244 B16R1.693 CCCCCCNC(=O)Nc1ccnnc1 572457f47834fa0730dc069c383ee7fd [0,0,0,0,0,1|3,0,0]=4 4245 B16R1.693 CCCCCCNC(=O)Nc1cnccn1 4b0a60822b29809bd76895b39fd4bac4 [0,0,0,0,0,1|3,0,0]=4 4246 B16R1.693 CCCCCCNC(=O)Nc1ncccn1 d278471f99b188c75125db21e8d453c2 [0,0,0,0,0,1|3,0,0]=4 4247 B16R1.693 CCCCCCNC(=S)Nc1ccccc1 b5ae7a57cbef3936954d6d9c3f255b57 [0,0,0,0,0,1|1,1,0]=3 4248 B16R1.693 CCCCCCNC(=S)Nc1ccccn1 a908074cf47c320a8ac1b5a05277b7c6 [0,0,0,0,0,1|2,1,0]=4 4249 B16R1.693 CCCCCCNC(=S)Nc1cccnc1 5616f4bf04d514a50e3652930c0fc8ba [0,0,0,0,0,1|2,1,0]=4 4250 B16R1.693 CCCCCCNC(=S)Nc1ccncc1 175fd28819f08254720f440a561241d0 [0,0,0,0,0,1|2,1,0]=4 4251 B16R1.693 CCCCCCOC(C)Cc1ccccc1 60aacd90bbd60db9285b76062c3a2555 [0,0,0,0,0,1|1,0,1]=3 4252 B16R1.693 CCCCCCOC(C)Cc1ccccn1 74a229395174e427067c7df6d5bae332 [0,0,0,0,0,1|2,0,1]=4 4253 B16R1.693 CCCCCCO[C@@H](C)Cc1ccccc1 348eb92823c6c3dab30f48fdc3bfdfcc [0,0,0,0,0,1|1,0,1]=3 4254 B16R1.693 CCCCCCO[C@H](C)Cc1ccccc1 bae8f5287392eb451c15b55b63927f27 [0,0,0,0,0,1|1,0,1]=3 4255 B16R1.693 CCCCCNCC(=O)Cc1ccccc1 97144b5a66d2e1a6df67b5335be01bb6 [0,0,0,0,0,1|2,0,0]=3 4256 B16R1.693 CCCCCNCC(=O)Nc1ccccc1 2ce0c8d5bd5de5f304407ba7328a53b9 [0,0,0,0,0,1|2,0,0]=3 4257 B16R1.693 CCCCCNCC(=O)Nc1ccccn1 1b24a698d30c7b15740b211b79bd85d5 [0,0,0,0,0,1|3,0,0]=4 4258 B16R1.693 CCCCCNCC(=O)Nc1ccncc1 1a06f92786248935329bf951148df76d [0,0,0,0,0,1|3,0,0]=4 4259 B16R1.693 CCCCCNCC(=O)Oc1ccccc1 27ebfc00be726b64f14ccd7509f0b402 [0,0,0,0,0,1|2,0,0]=3 4260 B16R1.693 CCCCCOC/C(=C/c1ccccc1)/C 5a7cefd0be88cd91ab5cad6be63cb52d [0,0,0,0,0,1|3,0,0]=4 4261 B16R1.693 CCCCCOCC(=O)Cc1ccccc1 a7fc5887241837ca94c215a88313fb4f [0,0,0,0,0,1|2,0,0]=3 4262 B16R1.693 CCCCCOCC(=O)Nc1ccccc1 aa92062367d2f9624438ed2b8c7dcc65 [0,0,0,0,0,1|2,0,0]=3 4263 B16R1.693 CCCCCOCC(=O)Nc1ccccn1 c082e3b9280252bcc9670122ca2bade1 [0,0,0,0,0,1|3,0,0]=4 4264 B16R1.693 CCCCCOCC(=O)Nc1ccncc1 7e717bf9c695ffbe722609689f9cf412 [0,0,0,0,0,1|3,0,0]=4 4265 B16R1.693 CCCCCOCC(=O)Oc1ccccc1 0e59a071857a8f62b1022bc0bfa6aedd [0,0,0,0,0,1|2,0,0]=3 4266 B16R1.693 CCCCNCCC(=O)Nc1ccccc1 1f1f08b9afc87490d131c39f4bb42978 [0,0,0,0,0,1|2,0,0]=3 4267 B16R1.693 CCCCNCCC(=O)Nc1ccccn1 144c3f50bdcf8f5c1ce38125bca974c0 [0,0,0,0,0,1|3,0,0]=4 4268 B16R1.693 CCCCNCCC(=O)Nc1cccnc1 51589bffdc010a06eabe9a94af042c1e [0,0,0,0,0,1|3,0,0]=4 4269 B16R1.693 CCCCOCCC(=O)Nc1ccccn1 b0fb7a710f7691417fbd294a52e295dd [0,0,0,0,0,1|3,0,0]=4 4270 B16R1.693 CCCCOCCC(=O)Nc1cccnc1 0efdc281d7a2f927043855256f76de2d [0,0,0,0,0,1|3,0,0]=4 4271 B16R1.693 CCCCOCNC(=O)Cc1ccccc1 c299d08fc2c409774c6a888907f58e88 [0,0,0,0,0,1|2,0,0]=3 4272 B16R1.693 CCCCOCOC(C)Cc1ccccc1 352594e27e14b50e23a14089eb278d6c [0,0,0,0,0,1|2,0,1]=4 4273 B16R1.693 CCCCOCO[C@@H](C)Cc1ccccc1 c68c2f81bd33dd9194232882ddb36c58 [0,0,0,0,0,1|2,0,1]=4 4274 B16R1.693 CCCCOCO[C@H](C)Cc1ccccc1 ec71a751d87b7c88df6021983341b6d3 [0,0,0,0,0,1|2,0,1]=4 4275 B16R1.693 CCCNCCCC(=O)Nc1ccccc1 baf5650979bd4de9f297c66b9775341d [0,0,0,0,0,1|2,0,0]=3 4276 B16R1.693 CCCNCCNC(=O)Cc1ccccc1 8e5adc3211bc9edced0e251f76d5e226 [0,0,0,0,0,1|2,0,0]=3 4277 B16R1.693 CCCNCCNC(=O)Nc1cccnc1 4ad0fd3e93b7c28b07dd11039f8af2cb [0,0,0,0,0,1|3,0,0]=4 4278 B16R1.693 CCCNCCNC(=O)Nc1ccncc1 63df1bff4f4796ab176f68220d5f9d37 [0,0,0,0,0,1|3,0,0]=4 4279 B16R1.693 CCCOCCCC(=O)Nc1ccccc1 a67b6c6bf0006a7f551009b8b0f8c7f5 [0,0,0,0,0,1|2,0,0]=3 4280 B16R1.693 CCCOCCNC(=O)Cc1ccccc1 1face143571a92105671e4b349c97029 [0,0,0,0,0,1|2,0,0]=3 4281 B16R1.693 CCCOCCNC(=O)Cc1ccccn1 2a762f7d4651fce5d4eaf39e15e20bc3 [0,0,0,0,0,1|3,0,0]=4 4282 B16R1.693 CCCOCCNC(=O)Cc1cccnc1 9b0beaa3ebfc9168c9845c26fb1f74bf [0,0,0,0,0,1|3,0,0]=4 4283 B16R1.693 CCCOCCNC(=O)Cc1ccncc1 599ae087498fc3ce8139da1fc79e49d3 [0,0,0,0,0,1|3,0,0]=4 4284 B16R1.693 CCCOCCNC(=O)Nc1ccccn1 8990eec6d6439da7a75da064a46b0f9e [0,0,0,0,0,1|3,0,0]=4 4285 B16R1.693 CCCOCCNC(=O)Nc1cccnc1 fde0cdd799e089586f67e284cf893d81 [0,0,0,0,0,1|3,0,0]=4 4286 B16R1.693 CCCOCCNC(=O)Nc1ccncc1 1cc07656e5b54aa4888a3645513ab3fd [0,0,0,0,0,1|3,0,0]=4 4287 B16R1.693 CCCOCCNC(=S)Nc1ccccc1 f3bbe3a0133c55ad5f2cfe00e5de882e [0,0,0,0,0,1|2,1,0]=4 4288 B16R1.693 CCCOCCOC(C)Cc1ccccc1 b660d03f3d2f5a86cc19af88fa689dfa [0,0,0,0,0,1|2,0,1]=4 4289 B16R1.693 CCCOCCO[C@@H](C)Cc1ccccc1 a9e6b28fc4a98408d93a19542eb160c3 [0,0,0,0,0,1|2,0,1]=4 4290 B16R1.693 CCCOCCO[C@H](C)Cc1ccccc1 a0441da4e70fdf90a99e34afc9609b0f [0,0,0,0,0,1|2,0,1]=4 4291 B16R1.693 CCOCCCCC(=O)Nc1ccccn1 db89c1fc1564486c6edc708fe13791a2 [0,0,0,0,0,1|3,0,0]=4 4292 B16R1.693 CCOCCCCC(=O)Nc1cccnc1 d3e42b857735cbc205f7ede00c7d4588 [0,0,0,0,0,1|3,0,0]=4 4293 B16R1.693 CCOCCCCC(=O)Nc1ccncc1 a54420232e5db0603e3d67abe6fe8ca3 [0,0,0,0,0,1|3,0,0]=4 4294 B16R1.693 CCOCCCNC(=O)Cc1ccccn1 fae4c5cdf04d297265001393ea00e438 [0,0,0,0,0,1|3,0,0]=4 4295 B16R1.693 CCOCCCNC(=O)Cc1cccnc1 6216b4c58b9934a503a2e4df0cecdbc2 [0,0,0,0,0,1|3,0,0]=4 4296 B16R1.693 CCOCCCNC(=O)Cc1ccncc1 24be3961921129ebbf3cf75a5abb5910 [0,0,0,0,0,1|3,0,0]=4 4297 B16R1.693 CCOCCCNC(=O)Nc1ccccc1 6fcd80226466e7f5ca4f888c85e57a28 [0,0,0,0,0,1|2,0,0]=3 4298 B16R1.693 CCOCCCNC(=O)Nc1ccccn1 d85dd35b1653c6b105bf320e1c437bcc [0,0,0,0,0,1|3,0,0]=4 4299 B16R1.693 CCOCCCNC(=O)Nc1cccnc1 f5a16a31d1dc04065937b710ab6c27e4 [0,0,0,0,0,1|3,0,0]=4 4300 B16R1.693 CCOCCCNC(=O)Nc1ccncc1 f85ba9eccffc5769a554c8aac92947ae [0,0,0,0,0,1|3,0,0]=4 4301 B16R1.693 CCOCCCNC(=S)Nc1ccccc1 ff9a34d40bd6a9c74624cc19d7d197f1 [0,0,0,0,0,1|2,1,0]=4 4302 B16R1.693 CCOCCCOC(C)Cc1ccccc1 3d2088234ac1d26d2ad38da1e03c857e [0,0,0,0,0,1|2,0,1]=4 4303 B16R1.693 CCOCCCO[C@@H](C)Cc1ccccc1 6be5a3e3132253152a6d234ea1b516c2 [0,0,0,0,0,1|2,0,1]=4 4304 B16R1.693 CCOCCCO[C@H](C)Cc1ccccc1 b9400cc1630ecf662c034a1123525820 [0,0,0,0,0,1|2,0,1]=4 4305 B16R1.693 CCOCCNCC(=O)Cc1ccccc1 7a7d40a29c1c77c297dc571f6396c722 [0,0,0,0,0,1|3,0,0]=4 4306 B16R1.693 CCOCCNCC(=O)Nc1ccccc1 e75a6695fe69712cd0eaacfe7218f45c [0,0,0,0,0,1|3,0,0]=4 4307 B16R1.693 CCOCCOCC(=O)Cc1ccccc1 ec2cd7d55a68a01eb4d19358fa45113b [0,0,0,0,0,1|3,0,0]=4 4308 B16R1.693 CCOCCOCC(=O)Nc1ccccc1 536f7bdfcf9edfb43ae5f63fdc453d13 [0,0,0,0,0,1|3,0,0]=4 4309 B16R1.693 CCOCCOCC(=O)Oc1ccccc1 9b547a4480ca2c3218f9d6ddfd3cbacc [0,0,0,0,0,1|3,0,0]=4 4310 B16R1.693 CCOCOCNC(=O)Cc1ccccc1 4a3a47576997c3fdb088b0bc7dfea747 [0,0,0,0,0,1|3,0,0]=4 4311 B16R1.693 CCSCCCOC(C)Cc1ccccc1 78b9593562f6829611ed5f140517e6ad [0,0,0,0,0,1|2,0,1]=4 4312 B16R1.693 CCSCCCO[C@@H](C)Cc1ccccc1 d97631f295fa8c9e316fe23f6ed95296 [0,0,0,0,0,1|2,0,1]=4 4313 B16R1.693 CCSCCCO[C@H](C)Cc1ccccc1 64f7ebb188b1b3b3c331ecb57ddda479 [0,0,0,0,0,1|2,0,1]=4 4314 B16R1.693 CCSCCNCC(=O)Cc1ccccc1 385706f534a78b2cc6cff43988eed702 [0,0,0,0,0,1|3,0,0]=4 4315 B16R1.693 CCSCCNCC(=O)Nc1ccccc1 e628570d3ec710b0c0b57fc68b845775 [0,0,0,0,0,1|3,0,0]=4 4316 B16R1.693 CCSCCNCC(=O)Oc1ccccc1 766faa307a9215968db0e0589eb08af1 [0,0,0,0,0,1|3,0,0]=4 4317 B16R1.693 CCSCCOCC(=O)Cc1ccccc1 53a64cad4b6eac4bbf793da36ee799df [0,0,0,0,0,1|3,0,0]=4 4318 B16R1.693 CCSCCOCC(=O)Nc1ccccc1 7ed9f2e08b639b26b24f5f90fcae6497 [0,0,0,0,0,1|3,0,0]=4 4319 B16R1.693 COCCCCCC(=O)Nc1ccccc1 99a1ac9d051cca01aa8b44cedc8acfb4 [0,0,0,0,0,1|2,0,0]=3 4320 B16R1.693 COCCCCCC(=O)Nc1ccccn1 bb1cb8010a6b9ca2bd698f6b40d03060 [0,0,0,0,0,1|3,0,0]=4 4321 B16R1.693 COCCCCCC(=O)Nc1cccnc1 3dba441a907f6e2a5233d4fe9e5ec9c3 [0,0,0,0,0,1|3,0,0]=4 4322 B16R1.693 COCCCCCC(=O)Nc1ccncc1 4acb5a886f7117583b813cf409b73136 [0,0,0,0,0,1|3,0,0]=4 4323 B16R1.693 COCCCCNC(=O)Cc1ccccn1 88dabf52db256a34403c27c08bccd34e [0,0,0,0,0,1|3,0,0]=4 4324 B16R1.693 COCCCCNC(=O)Cc1cccnc1 ae2faab2b0af46d7ebdf4d9d4913ff9c [0,0,0,0,0,1|3,0,0]=4 4325 B16R1.693 COCCCCNC(=O)Cc1ccncc1 051bb1c5876347909b7c337fb31a24c9 [0,0,0,0,0,1|3,0,0]=4 4326 B16R1.693 COCCCCNC(=O)Nc1ccccn1 cf17ffcbe0897e4a9a6a99f085e3f3e5 [0,0,0,0,0,1|3,0,0]=4 4327 B16R1.693 COCCCCNC(=O)Nc1cccnc1 65b3ef1a6ff58a20d2db48287ab39b97 [0,0,0,0,0,1|3,0,0]=4 4328 B16R1.693 COCCCCNC(=O)Nc1ccncc1 fee313551a64f6e27b78101aa0be23ef [0,0,0,0,0,1|3,0,0]=4 4329 B16R1.693 COCCCCNC(=S)Nc1ccccc1 5e9f1df2bff05c7d890b3b7cacbb43ba [0,0,0,0,0,1|2,1,0]=4 4330 B16R1.693 COCCCCOC(C)Cc1ccccc1 0ca49ceb021a04ae9e911dfd3df2e299 [0,0,0,0,0,1|2,0,1]=4 4331 B16R1.693 COCCCCO[C@@H](C)Cc1ccccc1 8141deb930d439be18486089f7b5bf5b [0,0,0,0,0,1|2,0,1]=4 4332 B16R1.693 COCCCCO[C@H](C)Cc1ccccc1 d9719dad5056109fc257ae284db7c2ae [0,0,0,0,0,1|2,0,1]=4 4333 B16R1.693 COCCCNCC(=O)Cc1ccccc1 0245113b628951457b5ffcfdb3d97941 [0,0,0,0,0,1|3,0,0]=4 4334 B16R1.693 COCCCNCC(=O)Nc1ccccc1 21f9166913f7a8b5094c02feb6f055d5 [0,0,0,0,0,1|3,0,0]=4 4335 B16R1.693 COCCCNCC(=O)Oc1ccccc1 20ff1975d8b6e32475c87d829721871f [0,0,0,0,0,1|3,0,0]=4 4336 B16R1.693 COCCCOCC(=O)Cc1ccccc1 48166ab608e8ffb08a1e97c525ec0d2f [0,0,0,0,0,1|3,0,0]=4 4337 B16R1.693 COCCCOCC(=O)Nc1ccccc1 d2ef036878347e05ad1e5b9e191ddfde [0,0,0,0,0,1|3,0,0]=4 4338 B16R1.693 COCCCOCC(=O)Oc1ccccc1 5ec1ff57665b8ad73fd4ba2d1d896787 [0,0,0,0,0,1|3,0,0]=4 4339 B16R1.693 COCCNCCC(=O)Nc1ccccc1 e0405d3bc19415e8a8780f5f3fe40c43 [0,0,0,0,0,1|3,0,0]=4 4340 B16R1.693 COCCOCCC(=O)Nc1ccccc1 aeeadca48c60d662ad979cb55ff2fc9e [0,0,0,0,0,1|3,0,0]=4 4341 B16R1.693 COCCOCCC(=O)Oc1ccccc1 b6083b92cfb9963457de894b768db6e4 [0,0,0,0,0,1|3,0,0]=4 4342 B16R1.693 COCCOCNC(=O)Cc1ccccc1 8fb860f1e81ba612d772cfeb23336c08 [0,0,0,0,0,1|3,0,0]=4 4343 B16R1.693 COCNCCCC(=O)Nc1ccccc1 32b6a8ea666bce1a35a38ff8762148a7 [0,0,0,0,0,1|3,0,0]=4 4344 B16R1.693 COCOCCCC(=O)Nc1ccccc1 97f91dc979c6422b7e03b03697614a64 [0,0,0,0,0,1|3,0,0]=4 4345 B16R1.693 COCOCCNC(=O)Cc1ccccc1 9626083c4767c166709512a26a883523 [0,0,0,0,0,1|3,0,0]=4 4346 B16R1.693 CSCCCCNC(=O)Cc1ccccn1 d9860c77eebcebd188b81ad538ebcb3b [0,0,0,0,0,1|3,0,0]=4 4347 B16R1.693 CSCCCCNC(=O)Cc1cccnc1 c19f5664b8bb9647b4a1ffe3bf4d69ae [0,0,0,0,0,1|3,0,0]=4 4348 B16R1.693 CSCCCCNC(=O)Cc1ccncc1 2dc250e3a73ae129d22f0dbe825ea886 [0,0,0,0,0,1|3,0,0]=4 4349 B16R1.693 CSCCCCNC(=O)Nc1cccnc1 52bd7f312f93b5161da86363bd508ea7 [0,0,0,0,0,1|3,0,0]=4 4350 B16R1.693 CSCCCCNC(=O)Nc1ccncc1 52a032e697d1a8b758caf36696b2bb22 [0,0,0,0,0,1|3,0,0]=4 4351 B16R1.693 CSCCCCNC(=S)Nc1ccccc1 af408e29098dfea5273544852544075c [0,0,0,0,0,1|2,1,0]=4 4352 B16R1.693 CSCCCNCC(=O)Cc1ccccc1 df13653a9b7f2f2d68f0c6c88e4fecb9 [0,0,0,0,0,1|3,0,0]=4 4353 B16R1.693 CSCCCNCC(=O)Nc1ccccc1 d6ab3ca24173296a3a78cf226c079ff1 [0,0,0,0,0,1|3,0,0]=4 4354 B16R1.693 CSCCCNCC(=O)Oc1ccccc1 929049525387031a1e7c11e5928cbca2 [0,0,0,0,0,1|3,0,0]=4 4355 B16R1.693 CSCCCOCC(=O)Cc1ccccc1 38a64e04dd7cc76ca38c3861247f080e [0,0,0,0,0,1|3,0,0]=4 4356 B16R1.693 CSCCCOCC(=O)Nc1ccccc1 4cd0eb55914ec3d8c89ccfef2e26d245 [0,0,0,0,0,1|3,0,0]=4 4357 B16R1.693 CSCCCOCC(=O)Oc1ccccc1 2b4939edaad3c4cf7ac2a803fa2a2cbe [0,0,0,0,0,1|3,0,0]=4 4358 B16R1.693 CSCCNCCC(=O)Nc1ccccc1 d76dee12021fb0089129c18b9a83858a [0,0,0,0,0,1|3,0,0]=4 4359 B16R1.693 CSCCOCCC(=O)Nc1ccccc1 4fc4e1fee010a81059db250aa0e32f55 [0,0,0,0,0,1|3,0,0]=4 4360 B16R1.693 CSCCOCNC(=O)Cc1ccccc1 385a9c3e55d56eedc95ec378ade82b66 [0,0,0,0,0,1|3,0,0]=4 4361 B16R1.693 CSCNCCCC(=O)Nc1ccccc1 cf1315c9657230ca2afe24af5b4f8680 [0,0,0,0,0,1|3,0,0]=4 4362 B16R1.693 CSCOCCNC(=O)Cc1ccccc1 df0c729e9f32d441cc134a13df4dd174 [0,0,0,0,0,1|3,0,0]=4 4363 B16R1.693 C[C@@H](Cc1ccccc1)OCCCCCF fc89e2aa906f0ce9e2601793c3c1ad76 [0,0,0,0,0,1|2,0,1]=4 4364 B16R1.693 C[C@H](Cc1ccccc1)OCCCCCF f033d3b49378061d916eb9e31bde7951 [0,0,0,0,0,1|2,0,1]=4 4365 B16R1.693 NCCCCCNC(=O)Nc1ccccn1 754c0cf373cbe1a478aada8aa00c4bf2 [0,0,0,0,0,1|3,0,0]=4 4366 B16R1.693 NCCCCCNC(=O)Nc1cccnc1 2e49ca2642aa10fe78a632710aff97da [0,0,0,0,0,1|3,0,0]=4 4367 B16R1.693 NCCCCCNC(=O)Nc1ccncc1 123ae96b753c85de9b9a3c551e96f92e [0,0,0,0,0,1|3,0,0]=4 4368 B16R1.693 NCCCCCNC(=S)Nc1ccccc1 60ce3cddf80711a5c6273937d7ace2b0 [0,0,0,0,0,1|2,1,0]=4 4369 B16R1.693 O=C(CCCCCCF)Nc1ccccc1 9d62c003a6cffd367ef343a951af483d [0,0,0,0,0,1|2,0,0]=3 4370 B16R1.693 O=C(CCCCCCF)Nc1ccccn1 05b209d426ea5370091e556575021fe0 [0,0,0,0,0,1|3,0,0]=4 4371 B16R1.693 O=C(CCCCCCF)Nc1cccnc1 8202f7febe5d2f3b790d760545110039 [0,0,0,0,0,1|3,0,0]=4 4372 B16R1.693 O=C(CCCCCCF)Nc1ccncc1 06e1e1bca25dd28382500c8d97cfe38e [0,0,0,0,0,1|3,0,0]=4 4373 B16R1.693 O=C(CCCCCCO)Nc1ccccc1 9ae138fc95da93d8f7fc393e207c891f [0,0,0,0,0,1|2,0,0]=3 4374 B16R1.693 O=C(CCCCCCO)Nc1ccccn1 1709b801fc89783f777bbf5ce4d474e7 [0,0,0,0,0,1|3,0,0]=4 4375 B16R1.693 O=C(CCCCCCO)Nc1cccnc1 125892c4bc05fd8b666e0dbcfe264320 [0,0,0,0,0,1|3,0,0]=4 4376 B16R1.693 O=C(CCCCCCO)Nc1ccncc1 b4fe5274a290bc3aa8cbb5c3efbe2cfd [0,0,0,0,0,1|3,0,0]=4 4377 B16R1.693 O=C(CCCCCCS)Nc1ccccc1 766ac1229e65e7284ace9b41ea3e8f33 [0,0,0,0,0,1|2,0,0]=3 4378 B16R1.693 O=C(CCCCCCS)Nc1ccccn1 957d16120ee4e09c0fa3f672870f421e [0,0,0,0,0,1|3,0,0]=4 4379 B16R1.693 O=C(CCCCCCS)Nc1cccnc1 7a92efa496266cde594bfc72dcf95638 [0,0,0,0,0,1|3,0,0]=4 4380 B16R1.693 O=C(CCCCCCS)Nc1ccncc1 f22a84246f2888b095e489f9f0a05d14 [0,0,0,0,0,1|3,0,0]=4 4381 B16R1.693 O=C(CCCNCCBr)Nc1ccccc1 002fed40767b9c8bbb3d404abe40358f [0,0,0,0,0,1|3,0,0]=4 4382 B16R1.693 O=C(CCCNCCF)Nc1ccccc1 a22a626a38b0e46aec9f1f51e38d31e7 [0,0,0,0,0,1|3,0,0]=4 4383 B16R1.693 O=C(CCCNCCI)Nc1ccccc1 0102e981ccba2c3190e513645dfc1a80 [0,0,0,0,0,1|3,0,0]=4 4384 B16R1.693 O=C(CCCNCCO)Nc1ccccc1 bfc121a116e22379adaeefe81f0cccc2 [0,0,0,0,0,1|3,0,0]=4 4385 B16R1.693 O=C(CCCNCCS)Nc1ccccc1 60a5bffd37596107659698018105814a [0,0,0,0,0,1|3,0,0]=4 4386 B16R1.693 O=C(CCCOCCF)Nc1ccccc1 2a6d658ce6bbfb9f8dd9f3d8ba5cf513 [0,0,0,0,0,1|3,0,0]=4 4387 B16R1.693 O=C(CCCOCCS)Nc1ccccc1 59f07147165ca3fc1589280892811100 [0,0,0,0,0,1|3,0,0]=4 4388 B16R1.693 O=C(CCNCCCCl)Nc1ccccc1 b7f8507a2ad177091deb5f035960a8b3 [0,0,0,0,0,1|3,0,0]=4 4389 B16R1.693 O=C(CCNCCCF)Nc1ccccc1 daae2e84f8e848057e2aca212df7e7a0 [0,0,0,0,0,1|3,0,0]=4 4390 B16R1.693 O=C(CCNCCCO)Nc1ccccc1 79b68128a67945c6f94d9f5c8a4ea65c [0,0,0,0,0,1|3,0,0]=4 4391 B16R1.693 O=C(CCOCCCF)Nc1ccccc1 fe6c60981f5ee1247f306bd1574dd269 [0,0,0,0,0,1|3,0,0]=4 4392 B16R1.693 O=C(CNCCCCCl)Cc1ccccc1 b5199a48490102c0f81c4b85c4a8ee1d [0,0,0,0,0,1|3,0,0]=4 4393 B16R1.693 O=C(CNCCCCCl)Nc1ccccc1 c92e1ff69b3ef82f718cc3fb34fb16e7 [0,0,0,0,0,1|3,0,0]=4 4394 B16R1.693 O=C(CNCCCCCl)Oc1ccccc1 c9e360f58d1633c8e641b84e9f367102 [0,0,0,0,0,1|3,0,0]=4 4395 B16R1.693 O=C(CNCCCCO)Cc1ccccc1 f13dac561883cbdd2b112b4a814fa554 [0,0,0,0,0,1|3,0,0]=4 4396 B16R1.693 O=C(CNCCCCO)Nc1ccccc1 7136f89db6a7db4e3c35201bd4593108 [0,0,0,0,0,1|3,0,0]=4 4397 B16R1.693 O=C(CNCCCCO)Oc1ccccc1 399d7e2fc76ebab2dd90bb97da80e14f [0,0,0,0,0,1|3,0,0]=4 4398 B16R1.693 O=C(CNCCCCS)Cc1ccccc1 df0de1385f588e907b5ba03bb86111ff [0,0,0,0,0,1|3,0,0]=4 4399 B16R1.693 O=C(CNCCCCS)Nc1ccccc1 114e9c49227e84e320e84d4dba7beecd [0,0,0,0,0,1|3,0,0]=4 4400 B16R1.693 O=C(CNCCCCS)Oc1ccccc1 81537ba00851a84e1be738ea73cd92ec [0,0,0,0,0,1|3,0,0]=4 4401 B16R1.693 O=C(COCCCCF)Cc1ccccc1 3975f53f9440d8e6b88c8c4f260a539a [0,0,0,0,0,1|3,0,0]=4 4402 B16R1.693 O=C(COCCCCF)Nc1ccccc1 dd389363b2455e8307f441773d551569 [0,0,0,0,0,1|3,0,0]=4 4403 B16R1.693 O=C(COCCCCF)Oc1ccccc1 592d5937f016fc95fff306a9c6eb7138 [0,0,0,0,0,1|3,0,0]=4 4404 B16R1.693 O=C(COCCCCS)Cc1ccccc1 2e35c138987027038e4758b4b1a64da4 [0,0,0,0,0,1|3,0,0]=4 4405 B16R1.693 O=C(COCCCCS)Nc1ccccc1 028ebed36263fb816f911d6e266726b9 [0,0,0,0,0,1|3,0,0]=4 4406 B16R1.693 O=C(COCCCCS)Oc1ccccc1 7c050bef07712e28e741cca2b7b0e35a [0,0,0,0,0,1|3,0,0]=4 4407 B16R1.693 O=C(Cc1ccccc1)NCCNCCBr 2843b148b383a24b0685b55c72359147 [0,0,0,0,0,1|3,0,0]=4 4408 B16R1.693 O=C(Cc1ccccc1)NCCNCCF babf74e4c5a5624d814375ec874efecd [0,0,0,0,0,1|3,0,0]=4 4409 B16R1.693 O=C(Cc1ccccc1)NCCNCCI 280af8ee9418323904adbd6d5ecf9550 [0,0,0,0,0,1|3,0,0]=4 4410 B16R1.693 O=C(Cc1ccccc1)NCCNCCO 167f50cdb64440c11f0fbd7f20c61ca8 [0,0,0,0,0,1|3,0,0]=4 4411 B16R1.693 O=C(Cc1ccccc1)NCCNCCS 41a147bb863006e940290c8b559796c4 [0,0,0,0,0,1|3,0,0]=4 4412 B16R1.693 O=C(Cc1ccccc1)NCCOCCF 091c435fe2349df9ec4649d0a9d30a92 [0,0,0,0,0,1|3,0,0]=4 4413 B16R1.693 O=C(Cc1ccccc1)NCCOCCS f2cf4af733f9b1f14c7a2f3cdade2594 [0,0,0,0,0,1|3,0,0]=4 4414 B16R1.693 O=C(Cc1ccccc1)NCOCCCF d1491347a971fa3c96064b97b37e4d05 [0,0,0,0,0,1|3,0,0]=4 4415 B16R1.693 O=C(Cc1ccccc1)NCOCCCS dd35f554fb906ffa0086b16621c72e72 [0,0,0,0,0,1|3,0,0]=4 4416 B16R1.693 O=C(Cc1ccccn1)NCCCCCCl 9aa63b5232c1a160d9213aaa4c2b080c [0,0,0,0,0,1|3,0,0]=4 4417 B16R1.693 O=C(Cc1ccccn1)NCCCCCO 8137f1ee6ea58b62765511cc044fa0cf [0,0,0,0,0,1|3,0,0]=4 4418 B16R1.693 O=C(Cc1cccnc1)NCCCCCCl 089d767ea1ee93de41c0f135f55a7fab [0,0,0,0,0,1|3,0,0]=4 4419 B16R1.693 O=C(Cc1cccnc1)NCCCCCO bc8195cb0f0988ff0304f4cb595dded4 [0,0,0,0,0,1|3,0,0]=4 4420 B16R1.693 O=C(Cc1ccncc1)NCCCCCCl d79a91fe0bd903fcdd2fc5a059ca6de0 [0,0,0,0,0,1|3,0,0]=4 4421 B16R1.693 O=C(Cc1ccncc1)NCCCCCO aa0256cececbe505316e10d9e0959d02 [0,0,0,0,0,1|3,0,0]=4 4422 B16R1.693 O=C(NCCCCCO)Nc1cccnc1 9011d1d8fa58c918ebe76d8b865269fb [0,0,0,0,0,1|3,0,0]=4 4423 B16R1.693 O=C(NCCCCCO)Nc1ccncc1 de74d7cab8b125083ad3e5d96afc7b41 [0,0,0,0,0,1|3,0,0]=4 4424 B16R1.693 O=CCCCCCC(=O)Nc1ccccc1 f58de544795e8ced06b75ef83eb46437 [0,0,0,0,0,1|2,0,1]=4 4425 B16R1.693 OCCCCCNC(=S)Nc1ccccc1 24c013c1016357720ef3cb8c8e50f500 [0,0,0,0,0,1|2,1,0]=4 4426 B13R0.338 C/C=C/C=C/C(=O)NCCCCCC 964860fb971fb1cde6acf6a17224cb2a [1,0,1,0,0,0|1,0,1]=4 4427 B13R0.338 CC=CC=CC(=O)NCCCCCC 339ff6404ad39c5fd17cc0bc953539b9 [1,0,1,0,0,0|1,0,1]=4 4428 B13R1.24 C=C(COCCC)c1ccccc1 f6317ef758d7b96aae38d82e773caa14 [2,0,0,0,0,0|2,0,0]=4 4429 B13R1.24 CCCCCN(C)c1ccccc1 8e838ed249d36a49c1970673664302dd [2,0,0,0,0,0|2,0,0]=4 4430 B13R1.24 CCCCNC(=O)c1ccccc1 99aac20acff97b38b71835a38991434c [2,0,0,0,0,0|1,0,0]=3 4431 B13R1.24 CCCCNC(=O)c1ccccn1 e2650feea24ca80c17dfb4597476b32e [2,0,0,0,0,0|2,0,0]=4 4432 B13R1.24 CCCCNC(=O)c1cccnc1 28676687860046409f3a17da4b2bf927 [2,0,0,0,0,0|2,0,0]=4 4433 B13R1.24 CCCCNC(=O)c1ccncc1 45bf4079e762a938f4e5aa1e26b0f105 [2,0,0,0,0,0|2,0,0]=4 4434 B13R1.24 CCCCOC(C)c1ccccc1 116618646832f472e55dfbe2113618bc [2,0,0,0,0,0|1,0,1]=4 4435 B13R1.24 CCCCO[C@@H](C)c1ccccc1 93a610cc42c8d64b3ebf86e26c026ac9 [2,0,0,0,0,0|1,0,1]=4 4436 B13R1.24 CCCCO[C@H](C)c1ccccc1 11ad6d63bfec5cb3281b9eb95b5e04f0 [2,0,0,0,0,0|1,0,1]=4 4437 B13R1.24 CCCNCC(=O)c1ccccc1 48fbf30db6382cb4b2aad3c23f152050 [2,0,0,0,0,0|1,0,0]=3 4438 B13R1.24 CCCNCC(=O)c1ccccn1 b5b83294351e5de62eefe79416e3decf [2,0,0,0,0,0|2,0,0]=4 4439 B13R1.24 CCCNCC(=O)c1cccnc1 c0c7f9b131fa79a55369b395104475a4 [2,0,0,0,0,0|2,0,0]=4 4440 B13R1.24 CCCOCC(=O)c1ccccc1 fafbf9582888297afc92283765371327 [2,0,0,0,0,0|1,0,0]=3 4441 B13R1.24 CCCOCC(=O)c1ccccn1 1744139d5574e9d85a93e82b301f11fe [2,0,0,0,0,0|2,0,0]=4 4442 B13R1.24 CCCOCC(=O)c1cccnc1 1941e357d32a8b76ad3c8c1776642a0f [2,0,0,0,0,0|2,0,0]=4 4443 B13R1.24 CCOCCC(=O)c1ccccc1 a6e0d6be21888dbba948192f59c92561 [2,0,0,0,0,0|1,0,0]=3 4444 B13R1.24 CCOCCS(=O)c1ccccc1 9a9b7f91a079702892d7981c8f731eba [2,0,0,0,0,0|2,0,0]=4 4445 B13R1.24 CCOCNC(=O)c1ccccc1 ccf2c03b54c5f75f969a54da2fc3c152 [2,0,0,0,0,0|2,0,0]=4 4446 B13R1.24 COCCNC(=O)c1ccccc1 b8bdb69f469dbcccd4aebf3e52009e23 [2,0,0,0,0,0|2,0,0]=4 4447 B13R1.24 COCNCC(=O)c1ccccc1 44f961dc30cf452e9f5fa4660d0a10ec [2,0,0,0,0,0|2,0,0]=4 4448 B13R1.24 COCOCC(=O)c1ccccc1 83c820df9692b3b1dbdce14eae5f0594 [2,0,0,0,0,0|2,0,0]=4 4449 B13R1.24 CSCCNC(=O)c1ccccc1 6500472e8f8e4c41049bdb6932e83240 [2,0,0,0,0,0|2,0,0]=4 4450 B13R1.24 CSCNCC(=O)c1ccccc1 aeb61a1bfc7cddd521fa2ae019334296 [2,0,0,0,0,0|2,0,0]=4 4451 B13R1.24 CSCOCC(=O)c1ccccc1 40a97e0dcc8b2710695a7d10950b8d18 [2,0,0,0,0,0|2,0,0]=4 4452 B13R1.24 O=C(CCOCF)c1ccccc1 1237eef9c45ef06dfd3da7be481e3a9e [2,0,0,0,0,0|2,0,0]=4 4453 B13R1.24 O=C(CNCCBr)c1ccccc1 a38f41f3a5ae52e734c810a3a9bf5d32 [2,0,0,0,0,0|2,0,0]=4 4454 B13R1.24 O=C(CNCCF)c1ccccc1 214fd0f4f5e525f079604687428b491e [2,0,0,0,0,0|2,0,0]=4 4455 B13R1.24 O=C(CNCCI)c1ccccc1 a71d041a3a395aaa7ce8e61c655578b7 [2,0,0,0,0,0|2,0,0]=4 4456 B13R1.24 O=C(CNCCO)c1ccccc1 60fc64e7dfba65baef92157ef0478d91 [2,0,0,0,0,0|2,0,0]=4 4457 B13R1.24 O=C(CNCCS)c1ccccc1 398abb5acd94e59165e73ac1f020a734 [2,0,0,0,0,0|2,0,0]=4 4458 B13R1.24 O=C(COCCF)c1ccccc1 0379d66e9d5f5e002a51f8fcce067389 [2,0,0,0,0,0|2,0,0]=4 4459 B13R1.24 O=C(COCCS)c1ccccc1 638c6bad091c24d29f577840210c801b [2,0,0,0,0,0|2,0,0]=4 4460 B13R1.24 O=C(NCCCCl)c1ccccc1 d04c1f75bc42d25a9f1002447a634bc8 [2,0,0,0,0,0|2,0,0]=4 4461 B13R1.24 O=C(NCCCO)c1ccccc1 f6ee9332b3ae90eb49159f9f34e99516 [2,0,0,0,0,0|2,0,0]=4 4462 B13R1.28 BrCCNCCOc1ccccc1 9b6ecbdf8afdd4773fe4ffea82ac3ebd [2,0,0,0,0,0|2,0,0]=4 4463 B13R1.28 CCCCCCNc1ccccc1 048baa466684ceb36ce0ec04def923a7 [2,0,0,0,0,0|1,0,0]=3 4464 B13R1.28 CCCCCCNc1ccccn1 ea586188b0fe3baf5bdb7887dd5a5702 [2,0,0,0,0,0|2,0,0]=4 4465 B13R1.28 CCCCCCNc1cccnc1 7d1c621510db8e702966edda94a42213 [2,0,0,0,0,0|2,0,0]=4 4466 B13R1.28 CCCCCCNc1ccncc1 57a244ed12e2aaacade906ad479d0009 [2,0,0,0,0,0|2,0,0]=4 4467 B13R1.28 CCCCCCOc1ccccn1 d0fcd2e50a7cdeef600d7d7c11ff9582 [2,0,0,0,0,0|1,0,0]=3 4468 B13R1.28 CCCCCCOc1cccnc1 76e4a0b1ac556aa9e477636e1f8dd89a [2,0,0,0,0,0|1,0,0]=3 4469 B13R1.28 CCCCCCOc1ccncc1 31cc026bbc8708ee3022eca19ac7e8d0 [2,0,0,0,0,0|1,0,0]=3 4470 B13R1.28 CCCCCCOc1ccnnc1 f19c2505f08b959965e55a713880f7f1 [2,0,0,0,0,0|2,0,0]=4 4471 B13R1.28 CCCCCCOc1cnccn1 49ea171243eb3f5b4fcbb85aae0aa50c [2,0,0,0,0,0|2,0,0]=4 4472 B13R1.28 CCCCCCOc1cncnc1 729c759df1ca9de387e3f26c49f4293e [2,0,0,0,0,0|2,0,0]=4 4473 B13R1.28 CCCCCCOc1ncccn1 bf7c57a2397c4a6fb8c0eab8d68ef7a8 [2,0,0,0,0,0|2,0,0]=4 4474 B13R1.28 CCCCCNCc1ccccc1 ceac33fb77d66ab1855d13c360a20a4d [2,0,0,0,0,0|1,0,1]=4 4475 B13R1.28 CCCCCOCc1ccccc1 7cca4ff4b2d15a92f4795dbfa1992899 [2,0,0,0,0,0|0,0,1]=3 4476 B13R1.28 CCCCCOCc1ccccn1 0ba417f448bc1245af8da2a6e3d648f6 [2,0,0,0,0,0|1,0,1]=4 4477 B13R1.28 CCCCCOCc1cccnc1 cc529a7f196852dcb1bb1033e3a71e59 [2,0,0,0,0,0|1,0,1]=4 4478 B13R1.28 CCCCCOCc1ccncc1 0625b58747449f61f7743dde19c0769c [2,0,0,0,0,0|1,0,1]=4 4479 B13R1.28 CCCCNCCc1ccccc1 0109fb426bf3ff59afa8f634257d80f2 [2,0,0,0,0,0|1,0,1]=4 4480 B13R1.28 CCCCOCCc1ccccc1 9579249358ed59a0332ebffafb432191 [2,0,0,0,0,0|1,0,1]=4 4481 B13R1.28 CCCCOCNc1ccccc1 58afdac690557bc2f9492d390ebdd20f [2,0,0,0,0,0|2,0,0]=4 4482 B13R1.28 CCCCOCOc1ccccn1 9ff0cfe902ba813d8299b205adff7e2c [2,0,0,0,0,0|2,0,0]=4 4483 B13R1.28 CCCCOCOc1cccnc1 2eacdff2a1d9af5b36f4054e3204de03 [2,0,0,0,0,0|2,0,0]=4 4484 B13R1.28 CCCCOCOc1ccncc1 b9650943f2a1e668f3d2144a0662d151 [2,0,0,0,0,0|2,0,0]=4 4485 B13R1.28 CCCNC/C=C/c1ccccc1 0f131056fcef7b81d083ae6154c2f752 [2,0,0,0,0,0|1,0,1]=4 4486 B13R1.28 CCCNCCCc1ccccc1 5f33b3d16423cf0638bca02ea5d6c817 [2,0,0,0,0,0|1,0,1]=4 4487 B13R1.28 CCCNCCOc1ccccc1 06184b73079e1278e398ef36adb88360 [2,0,0,0,0,0|1,0,0]=3 4488 B13R1.28 CCCNCCOc1ccccn1 ca069553132cbd69b9536450ab2d33b1 [2,0,0,0,0,0|2,0,0]=4 4489 B13R1.28 CCCNCCOc1cccnc1 bcff883eb13097bbdb88baca399a8907 [2,0,0,0,0,0|2,0,0]=4 4490 B13R1.28 CCCOC/C=C/c1ccccc1 28247541af14b4d0978af4a7a31a6e56 [2,0,0,0,0,0|1,0,1]=4 4491 B13R1.28 CCCOC/C=C\c1ccccc1 e2915b273a825531ccbc15ca740665c7 [2,0,0,0,0,0|1,0,1]=4 4492 B13R1.28 CCCOCC=Cc1ccccc1 7e801731f67fe56756a9b0772d9097db [2,0,0,0,0,0|1,0,1]=4 4493 B13R1.28 CCCOCCCc1ccccc1 c076ca63eede7ffa17c8465c98023cf9 [2,0,0,0,0,0|1,0,1]=4 4494 B13R1.28 CCCOCCNc1ccccc1 e211ec8e58646c8d8b6932bf2937cc35 [2,0,0,0,0,0|2,0,0]=4 4495 B13R1.28 CCCOCCOc1ccccc1 3aa0f9a231fbc547c5dc537bd93c941d [2,0,0,0,0,0|1,0,0]=3 4496 B13R1.28 CCCOCCOc1ccccn1 40f7c903094682ce5283878321083496 [2,0,0,0,0,0|2,0,0]=4 4497 B13R1.28 CCCOCCOc1cccnc1 9910d5f59c86fb6a95f8da6bc1c2bf7a [2,0,0,0,0,0|2,0,0]=4 4498 B13R1.28 CCCOCCOc1ccncc1 e39a11a5e91b817ec965caf366e95821 [2,0,0,0,0,0|2,0,0]=4 4499 B13R1.28 CCCOCCSc1ccccc1 d76a87a5dbcc7f9ae05dc56de64b2364 [2,0,0,0,0,0|1,1,0]=4 4500 B13R1.28 CCNCC/C=C/c1ccccc1 e2a23c0864e33e9b2de6354a72cb9762 [2,0,0,0,0,0|1,0,1]=4 4501 B13R1.28 CCNCCCCc1ccccc1 0282fc60fa78241a55156a48d7ec01f1 [2,0,0,0,0,0|1,0,1]=4 4502 B13R1.28 CCNCCCOc1ccccc1 3727f99c3be5d27cfdb90b361ca95f52 [2,0,0,0,0,0|1,0,0]=3 4503 B13R1.28 CCNCCCOc1ccccn1 fee701232feda333b3ea6eda8f5f11e8 [2,0,0,0,0,0|2,0,0]=4 4504 B13R1.28 CCNCCCOc1cccnc1 fcba12104465b6cf3041943be9274091 [2,0,0,0,0,0|2,0,0]=4 4505 B13R1.28 CCNCCOCc1ccccc1 1510815a698923cadc0f69cbfb039804 [2,0,0,0,0,0|1,0,1]=4 4506 B13R1.28 CCOCCCCc1ccccc1 ea19cd42cab00d72c00f828af735e7ef [2,0,0,0,0,0|1,0,1]=4 4507 B13R1.28 CCOCCCNc1ccccc1 f7037d100465397bc9870a07e0a6460f [2,0,0,0,0,0|2,0,0]=4 4508 B13R1.28 CCOCCCOc1ccccc1 7326db3541a7a8308790a9d6ce5fbce1 [2,0,0,0,0,0|1,0,0]=3 4509 B13R1.28 CCOCCCOc1ccccn1 931dc237c0a912c518eb5fd3c773b292 [2,0,0,0,0,0|2,0,0]=4 4510 B13R1.28 CCOCCCOc1cccnc1 11c3a9fdc9574103d954705056ce0816 [2,0,0,0,0,0|2,0,0]=4 4511 B13R1.28 CCOCCCOc1ccncc1 6185f58b94531f27184cfb83efb97caf [2,0,0,0,0,0|2,0,0]=4 4512 B13R1.28 CCOCCCSc1ccccc1 d995d954b5cf5746d4e00d02b32b007d [2,0,0,0,0,0|1,1,0]=4 4513 B13R1.28 CCOCCOCc1ccccc1 0e4b7394449b597fb1689d77c822d1e4 [2,0,0,0,0,0|1,0,1]=4 4514 B13R1.28 CCSCCCNc1ccccc1 e25c7841146cdbd831103e2ade51ae85 [2,0,0,0,0,0|2,0,0]=4 4515 B13R1.28 CCSCCCOc1ccccn1 63370f853bbb0a81f96d60257487f164 [2,0,0,0,0,0|2,0,0]=4 4516 B13R1.28 CCSCCCOc1cccnc1 3b7ecd33728062f9809c3af0648cd57b [2,0,0,0,0,0|2,0,0]=4 4517 B13R1.28 CCSCCCOc1ccncc1 e4bd88431e112269151a023397453a3f [2,0,0,0,0,0|2,0,0]=4 4518 B13R1.28 CCSCCOCc1ccccc1 892d64f9c9c2211c658e41916d24cd83 [2,0,0,0,0,0|1,0,1]=4 4519 B13R1.28 COCCCCNc1ccccc1 2f5eb05f588d34eeb3c5f37bd21d4ce0 [2,0,0,0,0,0|2,0,0]=4 4520 B13R1.28 COCCCCOc1ccccn1 91b5ce385a16d933bbf8a8d408ded633 [2,0,0,0,0,0|2,0,0]=4 4521 B13R1.28 COCCCCOc1cccnc1 f839815e843b970afb8aaa36c920d1e1 [2,0,0,0,0,0|2,0,0]=4 4522 B13R1.28 COCCCCOc1ccncc1 39dcc8d6fb19dec037581b8f3f000aa3 [2,0,0,0,0,0|2,0,0]=4 4523 B13R1.28 COCCCOCc1ccccc1 b2314cc7e18905a9d78f5fb2c3c5bf45 [2,0,0,0,0,0|1,0,1]=4 4524 B13R1.28 COCNCCOc1ccccc1 5ba1fcd51da08f3878df18623bf9fad3 [2,0,0,0,0,0|2,0,0]=4 4525 B13R1.28 COCOCCOc1ccccc1 bf555a71e4f4c7e4a4a31d791cefe748 [2,0,0,0,0,0|2,0,0]=4 4526 B13R1.28 CSCCCCNc1ccccc1 4bc5adb305c61106204d8292741c71b4 [2,0,0,0,0,0|2,0,0]=4 4527 B13R1.28 CSCCCOCc1ccccc1 141cb52f7ea1e2af27ad5c61b4835846 [2,0,0,0,0,0|1,0,1]=4 4528 B13R1.28 CSCNCCOc1ccccc1 85fe539b173efdbe18cce8ea2b18384c [2,0,0,0,0,0|2,0,0]=4 4529 B13R1.28 CSCOCCOc1ccccc1 90c1ef192b469e6198695927b2ac9436 [2,0,0,0,0,0|2,0,0]=4 4530 B13R1.28 ClCCCCCNc1ccccc1 c6ecde0e555ff6a799ee38d2f2708233 [2,0,0,0,0,0|2,0,0]=4 4531 B13R1.28 FCCCCCNc1ccccc1 6979ef07ec2626a2af5f14792eff3d71 [2,0,0,0,0,0|2,0,0]=4 4532 B13R1.28 FCCCCCOc1ccccn1 cdb1caa92cec0e1074012f8dc023f156 [2,0,0,0,0,0|2,0,0]=4 4533 B13R1.28 FCCCCCOc1cccnc1 27050460746ba84083e03b5327164bc4 [2,0,0,0,0,0|2,0,0]=4 4534 B13R1.28 FCCCCCOc1ccncc1 6aa363d461ac6e4325380481294ef12c [2,0,0,0,0,0|2,0,0]=4 4535 B13R1.28 FCCCCOCc1ccccc1 d0a25bd9ee98a1642a8c47d86db8d7c1 [2,0,0,0,0,0|1,0,1]=4 4536 B13R1.28 FCCNCCOc1ccccc1 a25d58a1095a40517be1120aaa79cbd2 [2,0,0,0,0,0|2,0,0]=4 4537 B13R1.28 FCCOCCOc1ccccc1 12bf0f6f8d8cc5531af5bbeee76ef129 [2,0,0,0,0,0|2,0,0]=4 4538 B13R1.28 FCNCCCOc1ccccc1 3f39c1d248b312630983fb8fa0812f7c [2,0,0,0,0,0|2,0,0]=4 4539 B13R1.28 FCOCCCOc1ccccc1 b10b401514a0578346514a6b45eff062 [2,0,0,0,0,0|2,0,0]=4 4540 B13R1.28 ICCNCCOc1ccccc1 6c63ad6a8ab9e443b5ad1d4b5dbedc5d [2,0,0,0,0,0|2,0,0]=4 4541 B13R1.28 OCCCCCNc1ccccc1 3703e8864ede01d8d44cbde375640e29 [2,0,0,0,0,0|2,0,0]=4 4542 B13R1.28 OCCNCCOc1ccccc1 2c56f221dafab9550d882a95f830bd7f [2,0,0,0,0,0|2,0,0]=4 4543 B13R1.28 OCNCCCOc1ccccc1 ac53e18bca360d0f2178806411bc6ea8 [2,0,0,0,0,0|2,0,0]=4 4544 B13R1.28 SCCCCOCc1ccccc1 c54a16ae6a3454def5d9cd9a56f5dc07 [2,0,0,0,0,0|1,0,1]=4 4545 B13R1.28 SCCNCCOc1ccccc1 fa3020f64f92bcb26f0b95cf1ad2223d [2,0,0,0,0,0|2,0,0]=4 4546 B13R1.28 SCCOCCOc1ccccc1 3efd9316c964647f28cf89874689d65f [2,0,0,0,0,0|2,0,0]=4 4547 B15R1.30 CCCCCCN(C)c1ccc(cc1)F 2f0c2d623e0eb1eef367b901cc97f823 [1,1,0,0,0,0|2,0,0]=4 4548 B15R1.30 CCCCCCN(C)c1ccc(cc1)S 828f7899135fe420c7f27645725d303c [1,1,0,0,0,0|2,0,0]=4 4549 B15R1.30 CCCCCNC(=O)c1cc[n+](cc1)[O-] 41f09d239c5cc458d3596b8512f58446 [1,1,0,0,0,0|2,0,0]=4 4550 B15R1.30 CCCCCNC(=O)c1ccc(=O)oc1 739e42304efc857b530fbfced3e5451a [1,1,0,0,0,0|2,0,0]=4 4551 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Br b301fffe4ab1c92e56ce8c47bcdf07cb [1,1,0,0,0,0|1,0,0]=3 4552 B15R1.30 CCCCCNC(=O)c1ccc(cc1)C 8502bab2a93c95daa52553166090cdb2 [1,1,0,0,0,0|1,0,0]=3 4553 B15R1.30 CCCCCNC(=O)c1ccc(cc1)Cl a68f2e5174e8fae66fe3b4ad6f3007fc [1,1,0,0,0,0|1,0,0]=3 4554 B15R1.30 CCCCCNC(=O)c1ccc(cc1)F 18ccb507c582f96e0325a481432f1fe5 [1,1,0,0,0,0|1,0,0]=3 4555 B15R1.30 CCCCCNC(=O)c1ccc(cc1)I 3ac9974c3a1af6857154281f6c52b6f7 [1,1,0,0,0,0|1,0,0]=3 4556 B15R1.30 CCCCCNC(=O)c1ccc(cc1)O 951607f0ce0be9d4fb4e6725c3d11d80 [1,1,0,0,0,0|1,0,0]=3 4557 B15R1.30 CCCCCNC(=O)c1ccc(cc1)S 94921741fc224cc7147676f943854ca0 [1,1,0,0,0,0|1,0,0]=3 4558 B15R1.30 CCCCCNC(=O)c1ccc(cn1)Br d3bf669960669848350bf19569ff6868 [1,1,0,0,0,0|2,0,0]=4 4559 B15R1.30 CCCCCNC(=O)c1ccc(cn1)C fcf4814dc3ed87bc78502d7db7944b8f [1,1,0,0,0,0|2,0,0]=4 4560 B15R1.30 CCCCCNC(=O)c1ccc(cn1)Cl 5060eb299097206b015c19ed1f4954a9 [1,1,0,0,0,0|2,0,0]=4 4561 B15R1.30 CCCCCNC(=O)c1ccc(cn1)F 612c2c5f9a2b4a8db3364210dfb616c5 [1,1,0,0,0,0|2,0,0]=4 4562 B15R1.30 CCCCCNC(=O)c1ccc(cn1)I 983133658b62a1405e1c31c797cd0428 [1,1,0,0,0,0|2,0,0]=4 4563 B15R1.30 CCCCCNC(=O)c1ccc(cn1)O 236404c4a8fd4970c87a895118e19354 [1,1,0,0,0,0|2,0,0]=4 4564 B15R1.30 CCCCCNC(=O)c1ccc(nc1)Br e87a9e8c0287fa1d41a399028a8b8145 [1,1,0,0,0,0|2,0,0]=4 4565 B15R1.30 CCCCCNC(=O)c1ccc(nc1)C f91c19ce86c3baaab0e8cae137bdf920 [1,1,0,0,0,0|2,0,0]=4 4566 B15R1.30 CCCCCNC(=O)c1ccc(nc1)Cl 5093cf54905902898a224dca1e4e68df [1,1,0,0,0,0|2,0,0]=4 4567 B15R1.30 CCCCCNC(=O)c1ccc(nc1)F 6f75b92b89b5c7d2806256e79d0937d1 [1,1,0,0,0,0|2,0,0]=4 4568 B15R1.30 CCCCCNC(=O)c1ccc(nc1)I cedb8156b78c06108d8860976171b133 [1,1,0,0,0,0|2,0,0]=4 4569 B15R1.30 CCCCCNC(=O)c1ccc(nc1)O dd159fc37089b15dab1110103256ab08 [1,1,0,0,0,0|2,0,0]=4 4570 B15R1.30 CCCCCNC(=O)c1ccc(nc1)S 4bb4825233cb902269e93feb49116cf2 [1,1,0,0,0,0|2,0,0]=4 4571 B15R1.30 CCCCCOC(C)c1ccc(cc1)Br 3096c7bf6eec039e2de77611661780bd [1,1,0,0,0,0|1,0,1]=4 4572 B15R1.30 CCCCCOC(C)c1ccc(cc1)C b9bc4e4fcf4eeae16d07f691ffb6f8cc [1,1,0,0,0,0|1,0,1]=4 4573 B15R1.30 CCCCCOC(C)c1ccc(cc1)Cl 608e12f2feeacbff47902bcdb7769c37 [1,1,0,0,0,0|1,0,1]=4 4574 B15R1.30 CCCCCOC(C)c1ccc(cc1)F 615554d22d0f76a0b96881ca1da39d7b [1,1,0,0,0,0|1,0,1]=4 4575 B15R1.30 CCCCCOC(C)c1ccc(cc1)I b205d7ee269d37c1ee54a51fcc13b1b9 [1,1,0,0,0,0|1,0,1]=4 4576 B15R1.30 CCCCCO[C@@H](C)c1ccc(cc1)Br d44fe1909e131e080f8f8612057b98ae [1,1,0,0,0,0|1,0,1]=4 4577 B15R1.30 CCCCCO[C@@H](C)c1ccc(cc1)C f4a9dd5d214c257dd591969b7a7c827d [1,1,0,0,0,0|1,0,1]=4 4578 B15R1.30 CCCCCO[C@@H](C)c1ccc(cc1)Cl 059592f494fe84245b59a26eb2061048 [1,1,0,0,0,0|1,0,1]=4 4579 B15R1.30 CCCCCO[C@@H](C)c1ccc(cc1)F a3e371f82431f94a43cf66eacc5fcf83 [1,1,0,0,0,0|1,0,1]=4 4580 B15R1.30 CCCCCO[C@@H](C)c1ccc(cc1)I 3728627da2b5edbee710907b9846c3ed [1,1,0,0,0,0|1,0,1]=4 4581 B15R1.30 CCCCCO[C@H](C)c1ccc(cc1)Br 300124c6113c69b65852b5693813a6e0 [1,1,0,0,0,0|1,0,1]=4 4582 B15R1.30 CCCCCO[C@H](C)c1ccc(cc1)C 5567380cde65268dac2965d45d1f79cf [1,1,0,0,0,0|1,0,1]=4 4583 B15R1.30 CCCCCO[C@H](C)c1ccc(cc1)Cl b41c40dc9c266305ca3ddff8e8c87ed0 [1,1,0,0,0,0|1,0,1]=4 4584 B15R1.30 CCCCCO[C@H](C)c1ccc(cc1)F bcf093eebf5c61623018e0e041a6c994 [1,1,0,0,0,0|1,0,1]=4 4585 B15R1.30 CCCCCO[C@H](C)c1ccc(cc1)I 9ed5c93f8692705144dfa3d443e8dd07 [1,1,0,0,0,0|1,0,1]=4 4586 B15R1.30 CCCCNCC(=O)c1ccc(cc1)Br 212d58b704806cdce16f23045b50da8a [1,1,0,0,0,0|1,0,0]=3 4587 B15R1.30 CCCCNCC(=O)c1ccc(cc1)C ac4fbeae24c4e8fa421d2896f396614a [1,1,0,0,0,0|1,0,0]=3 4588 B15R1.30 CCCCNCC(=O)c1ccc(cc1)Cl d1ceaf55aa997281152eb287622d1c60 [1,1,0,0,0,0|1,0,0]=3 4589 B15R1.30 CCCCNCC(=O)c1ccc(cc1)F 17f23875a462feb43d9ab5b887ca1843 [1,1,0,0,0,0|1,0,0]=3 4590 B15R1.30 CCCCNCC(=O)c1ccc(cc1)I 2ba7db6cde299407a25cadf121a18cf6 [1,1,0,0,0,0|1,0,0]=3 4591 B15R1.30 CCCCNCC(=O)c1ccc(cn1)Br 16cb1202930090f8d4b94d9ac86aac05 [1,1,0,0,0,0|2,0,0]=4 4592 B15R1.30 CCCCNCC(=O)c1ccc(cn1)C 3c47f6653baad1d3517c607d80fbc4df [1,1,0,0,0,0|2,0,0]=4 4593 B15R1.30 CCCCNCC(=O)c1ccc(cn1)Cl 2845f8fbe07b5f4a643866e7fbf8661a [1,1,0,0,0,0|2,0,0]=4 4594 B15R1.30 CCCCNCC(=O)c1ccc(cn1)F 20444408ec410d0e0678ca70e1ce3dd4 [1,1,0,0,0,0|2,0,0]=4 4595 B15R1.30 CCCCNCC(=O)c1ccc(nc1)C 71fdb86b65d1cc8b229d7dc412de2c58 [1,1,0,0,0,0|2,0,0]=4 4596 B15R1.30 CCCCNCC(=O)c1ccc(nc1)Cl 9965a2934ade7d553b0a39ee97dbafe8 [1,1,0,0,0,0|2,0,0]=4 4597 B15R1.30 CCCCOCC(=O)c1ccc(cc1)Br 10e1da8f59ef023cafb81c1dc614d28e [1,1,0,0,0,0|1,0,0]=3 4598 B15R1.30 CCCCOCC(=O)c1ccc(cc1)C 72b97535522df46aaa1ca4cae6b2ba1f [1,1,0,0,0,0|1,0,0]=3 4599 B15R1.30 CCCCOCC(=O)c1ccc(cc1)Cl 3fbec875c6330f5e5d5e3128b849e19a [1,1,0,0,0,0|1,0,0]=3 4600 B15R1.30 CCCCOCC(=O)c1ccc(cc1)F 8d5b512dd890ea059b6cb0598018c0c3 [1,1,0,0,0,0|1,0,0]=3 4601 B15R1.30 CCCCOCC(=O)c1ccc(cc1)I 943f7b024e75e7a3436e56d92b07d803 [1,1,0,0,0,0|1,0,0]=3 4602 B15R1.30 CCCCOCC(=O)c1ccc(cn1)Br e88d53874109c5e65be0075aad99e664 [1,1,0,0,0,0|2,0,0]=4 4603 B15R1.30 CCCCOCC(=O)c1ccc(cn1)Cl 24c2f9aca79d8e274e9030118e2fbe52 [1,1,0,0,0,0|2,0,0]=4 4604 B15R1.30 CCCCOCC(=O)c1ccc(cn1)F 2df22b3003ac431db56ef96a01a9525c [1,1,0,0,0,0|2,0,0]=4 4605 B15R1.30 CCCCOCC(=O)c1ccc(nc1)Br 86112b38c193b43c0a68e248260d746b [1,1,0,0,0,0|2,0,0]=4 4606 B15R1.30 CCCCOCC(=O)c1ccc(nc1)C 592f86787699da3f5ae61f9de26533af [1,1,0,0,0,0|2,0,0]=4 4607 B15R1.30 CCCCOCC(=O)c1ccc(nc1)Cl 075503f4bcc1a1a60d7b3d2ae6540176 [1,1,0,0,0,0|2,0,0]=4 4608 B15R1.30 CCCNCCC(=O)c1ccc(cc1)Br f9d993182d8d27c5325aaf5433441b05 [1,1,0,0,0,0|1,0,0]=3 4609 B15R1.30 CCCNCCC(=O)c1ccc(cc1)C 9aa9b6e6813a16a140d8deed1b3c038c [1,1,0,0,0,0|1,0,0]=3 4610 B15R1.30 CCCNCCC(=O)c1ccc(cc1)F 2e91741ad69c9cb3c53e662da6496201 [1,1,0,0,0,0|1,0,0]=3 4611 B15R1.30 CCCNCOC(=O)c1ccc(cc1)F 70c4e0f335b7cec2b02985734cb0fed1 [1,1,0,0,0,0|1,0,0]=3 4612 B15R1.30 CCCOCCC(=O)c1ccc(cc1)Br 3646d1355373c64908733f0cbe5e17cb [1,1,0,0,0,0|1,0,0]=3 4613 B15R1.30 CCCOCCC(=O)c1ccc(cc1)C 94fd985d7f2cb03a859c284f7b802900 [1,1,0,0,0,0|1,0,0]=3 4614 B15R1.30 CCCOCCC(=O)c1ccc(cc1)Cl 3469ca39a17ba3db4ebdfe3fa0faf513 [1,1,0,0,0,0|1,0,0]=3 4615 B15R1.30 CCCOCCC(=O)c1ccc(cc1)F 9123532805d5e99fb0a90a53484d48b5 [1,1,0,0,0,0|1,0,0]=3 4616 B15R1.30 CCCOCOC(=O)c1ccc(cc1)F dfe420f4ba29ff65594c4853770ddd99 [1,1,0,0,0,0|1,0,0]=3 4617 B15R1.30 CCOCCCC(=O)c1ccc(cc1)F 61eb39c491de7d4c158f8d5bebad1c26 [1,1,0,0,0,0|1,0,0]=3 4618 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Br 42b64bfe7ffe407ed05bfff3f0ec45c7 [1,1,0,0,0,0|2,0,0]=4 4619 B15R1.30 CCOCCNC(=O)c1ccc(cc1)C 835f980079888513f2854a258b7e197c [1,1,0,0,0,0|2,0,0]=4 4620 B15R1.30 CCOCCNC(=O)c1ccc(cc1)Cl 340d28bca0e787a24c0be26efd1096d2 [1,1,0,0,0,0|2,0,0]=4 4621 B15R1.30 CCOCCNC(=O)c1ccc(cc1)F 0ea6fa5c55873332301a0523aef6fd2a [1,1,0,0,0,0|2,0,0]=4 4622 B15R1.30 CCOCCNC(=O)c1ccc(cc1)I ce97fbb2f159d8638f94301471d90068 [1,1,0,0,0,0|2,0,0]=4 4623 B15R1.30 CCOCCNC(=O)c1ccc(cc1)O 42909025b7239c547a527665c874d303 [1,1,0,0,0,0|2,0,0]=4 4624 B15R1.30 CCOCCNC(=O)c1ccc(cc1)S 7a4747e6b337f9f167566f72ddbe4bf0 [1,1,0,0,0,0|2,0,0]=4 4625 B15R1.30 CCOCCOC(=O)c1ccc(cc1)C 017e6c0021779e8283c25ccecd9e4af8 [1,1,0,0,0,0|1,0,0]=3 4626 B15R1.30 CCOCNCC(=O)c1ccc(cc1)Br 9fc3396e877466c9f1cdf002315fa6d1 [1,1,0,0,0,0|2,0,0]=4 4627 B15R1.30 CCOCNCC(=O)c1ccc(cc1)C dc7b681f8f6987d1560a5cce184a5c52 [1,1,0,0,0,0|2,0,0]=4 4628 B15R1.30 CCOCNCC(=O)c1ccc(cc1)Cl 1dfa84b3a8e25e77bd4712e803b0e082 [1,1,0,0,0,0|2,0,0]=4 4629 B15R1.30 CCOCOCC(=O)c1ccc(cc1)Br 2917809867c00e9da54fafc4ab7330d0 [1,1,0,0,0,0|2,0,0]=4 4630 B15R1.30 CCOCOCC(=O)c1ccc(cc1)C 5e584a1e41d65ac0eb34750ce011bc36 [1,1,0,0,0,0|2,0,0]=4 4631 B15R1.30 CCOCOCC(=O)c1ccc(cc1)I 9183c4a54086ea640e78ae3d984c3d62 [1,1,0,0,0,0|2,0,0]=4 4632 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Br 65117e022de60ad7c722c8b8bda669a4 [1,1,0,0,0,0|2,0,0]=4 4633 B15R1.30 CCSCCNC(=O)c1ccc(cc1)C b84e43f7fc635ff14fcc1a6eab036d4b [1,1,0,0,0,0|2,0,0]=4 4634 B15R1.30 CCSCCNC(=O)c1ccc(cc1)Cl fb78f324727d84c2c73943b20d90d339 [1,1,0,0,0,0|2,0,0]=4 4635 B15R1.30 CCSCCNC(=O)c1ccc(cc1)F ff257f17571473c17ceea9f6a1c4e205 [1,1,0,0,0,0|2,0,0]=4 4636 B15R1.30 CCSCCNC(=O)c1ccc(cc1)I 50760ccba91d2749e447708e47e390be [1,1,0,0,0,0|2,0,0]=4 4637 B15R1.30 CCSCCNC(=O)c1ccc(cc1)O 9e3b6ddf6b5db251e8a23a70c14dcc4f [1,1,0,0,0,0|2,0,0]=4 4638 B15R1.30 CCSCCNC(=O)c1ccc(cc1)S a853e27ff5f8ae67465421d8e0a5b1e0 [1,1,0,0,0,0|2,0,0]=4 4639 B15R1.30 COCCCNC(=O)c1ccc(cc1)Br e54aa0e109482cf9d8939f2bda332af8 [1,1,0,0,0,0|2,0,0]=4 4640 B15R1.30 COCCCNC(=O)c1ccc(cc1)C b552204c2bfc2d0b045f7c7c6fb55e5c [1,1,0,0,0,0|2,0,0]=4 4641 B15R1.30 COCCCNC(=O)c1ccc(cc1)Cl 489671966365af6c79bbcd41781d268f [1,1,0,0,0,0|2,0,0]=4 4642 B15R1.30 COCCCNC(=O)c1ccc(cc1)F ccfa00491bc540f28811441569db5141 [1,1,0,0,0,0|2,0,0]=4 4643 B15R1.30 COCCCNC(=O)c1ccc(cc1)I 4aeadd78cf332f3a9f7f44ee8d44e523 [1,1,0,0,0,0|2,0,0]=4 4644 B15R1.30 COCCCNC(=O)c1ccc(cc1)O a40a399128a625a28a2a4e00dda4a1ec [1,1,0,0,0,0|2,0,0]=4 4645 B15R1.30 COCCCNC(=O)c1ccc(cc1)S bccd358a9979dcc49fd595cd19e65612 [1,1,0,0,0,0|2,0,0]=4 4646 B15R1.30 COCCNCC(=O)c1ccc(cc1)Br 55fcbce4226e307c8fb31f32462ed307 [1,1,0,0,0,0|2,0,0]=4 4647 B15R1.30 COCCNCC(=O)c1ccc(cc1)C 49645ad99a1d2fb6bda1af86bbc46ba2 [1,1,0,0,0,0|2,0,0]=4 4648 B15R1.30 COCCNCC(=O)c1ccc(cc1)Cl a2abf261dd8bec2a137c526bc4727f01 [1,1,0,0,0,0|2,0,0]=4 4649 B15R1.30 COCCNCC(=O)c1ccc(cc1)F ed3a1a61f84501f6f1c6cd600d893c77 [1,1,0,0,0,0|2,0,0]=4 4650 B15R1.30 COCCNCC(=O)c1ccc(cc1)I f7b7047c4b2e6819d558121492b2ed26 [1,1,0,0,0,0|2,0,0]=4 4651 B15R1.30 COCCOCC(=O)c1ccc(cc1)Br 9bc62f51dd65364443348ede36c639fd [1,1,0,0,0,0|2,0,0]=4 4652 B15R1.30 COCCOCC(=O)c1ccc(cc1)C a138759ded486c7114ab75e510477d95 [1,1,0,0,0,0|2,0,0]=4 4653 B15R1.30 COCCOCC(=O)c1ccc(cc1)Cl 2498b4c761ffa7cdc7d08f716fa6c8c2 [1,1,0,0,0,0|2,0,0]=4 4654 B15R1.30 COCCOCC(=O)c1ccc(cc1)F ef0dcfd8b4246a00a00d451aa575896f [1,1,0,0,0,0|2,0,0]=4 4655 B15R1.30 COCCOCC(=O)c1ccc(cc1)I 8ae1c9ee0cc3f5722b664a8a7cd354de [1,1,0,0,0,0|2,0,0]=4 4656 B15R1.30 COCOCCC(=O)c1ccc(cc1)Br 5ca30f656529e1de3164c09ec3f8bd19 [1,1,0,0,0,0|2,0,0]=4 4657 B15R1.30 COCOCCC(=O)c1ccc(cc1)C 3ed609bff84b798d93c28ac650c30440 [1,1,0,0,0,0|2,0,0]=4 4658 B15R1.30 COCOCCC(=O)c1ccc(cc1)Cl 13419f57742a9dc3bf0a0fc8738432da [1,1,0,0,0,0|2,0,0]=4 4659 B15R1.30 COCOCCC(=O)c1ccc(cc1)F 5fb65a065cd6a5da2973bb8d099539f1 [1,1,0,0,0,0|2,0,0]=4 4660 B15R1.30 COCOCOC(=O)c1ccc(cc1)F 3c0b60d67d9b001394d81351be8885de [1,1,0,0,0,0|2,0,0]=4 4661 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Br e54822d95f7795345182749a0eeb0c5d [1,1,0,0,0,0|2,0,0]=4 4662 B15R1.30 CSCCCNC(=O)c1ccc(cc1)C 94419e7a3434d6a77e3eeb91a08cdedb [1,1,0,0,0,0|2,0,0]=4 4663 B15R1.30 CSCCCNC(=O)c1ccc(cc1)Cl 945d55f434b6c114577beee19b71534b [1,1,0,0,0,0|2,0,0]=4 4664 B15R1.30 CSCCCNC(=O)c1ccc(cc1)F 9c588194730c3d1317befcfeb3fe4137 [1,1,0,0,0,0|2,0,0]=4 4665 B15R1.30 CSCCCNC(=O)c1ccc(cc1)I a514e7f0ceecf0dee6698c2782f30e65 [1,1,0,0,0,0|2,0,0]=4 4666 B15R1.30 CSCCCNC(=O)c1ccc(cc1)O d610a4a62aa3b5cfd7c7d9d63bb624fb [1,1,0,0,0,0|2,0,0]=4 4667 B15R1.30 CSCCCNC(=O)c1ccc(cc1)S c14a6a5d9989b63ff7c0a973a3c17d92 [1,1,0,0,0,0|2,0,0]=4 4668 B15R1.30 CSCCNCC(=O)c1ccc(cc1)Br 1501ab9632d9bc0eec5e87e642f8f8d6 [1,1,0,0,0,0|2,0,0]=4 4669 B15R1.30 CSCCNCC(=O)c1ccc(cc1)C fb5eb271e5aeda19d51de575a63d946f [1,1,0,0,0,0|2,0,0]=4 4670 B15R1.30 CSCCNCC(=O)c1ccc(cc1)Cl da37f8a17b85fc36e985be1ea219af63 [1,1,0,0,0,0|2,0,0]=4 4671 B15R1.30 CSCCNCC(=O)c1ccc(cc1)F 4460a0393716528b5a9e49352214852f [1,1,0,0,0,0|2,0,0]=4 4672 B15R1.30 CSCCNCC(=O)c1ccc(cc1)I 579e23a3f16d6658b5b3072bbc1034be [1,1,0,0,0,0|2,0,0]=4 4673 B15R1.30 CSCCOCC(=O)c1ccc(cc1)Br e00f4d256e1fa0538a3a9a6dac2e4007 [1,1,0,0,0,0|2,0,0]=4 4674 B15R1.30 CSCCOCC(=O)c1ccc(cc1)C 7f8938599e4511f31495be5b3624a1ff [1,1,0,0,0,0|2,0,0]=4 4675 B15R1.30 CSCCOCC(=O)c1ccc(cc1)Cl df7f2af62a30625213926dcf1bd50021 [1,1,0,0,0,0|2,0,0]=4 4676 B15R1.30 CSCCOCC(=O)c1ccc(cc1)F 380ffc28758a720b8ea62a385b72e935 [1,1,0,0,0,0|2,0,0]=4 4677 B15R1.30 CSCCOCC(=O)c1ccc(cc1)I d2610bd117f03b5e81a587db1bec3835 [1,1,0,0,0,0|2,0,0]=4 4678 B15R1.30 CSCOCCC(=O)c1ccc(cc1)Cl 93fc30f99c9b53da5ab6d90ac9b505ca [1,1,0,0,0,0|2,0,0]=4 4679 B15R1.30 Cc1ccc(cc1)C(=O)CCNCCBr 1c25bbcaee58b36267066bd69d3045ae [1,1,0,0,0,0|2,0,0]=4 4680 B15R1.30 Cc1ccc(cc1)C(=O)CCNCCF 80123699b87d87689d53ef1ae05d6e81 [1,1,0,0,0,0|2,0,0]=4 4681 B15R1.30 Cc1ccc(cc1)C(=O)CCNCCI 648fccc45fe4a38a29e9df9783ced46f [1,1,0,0,0,0|2,0,0]=4 4682 B15R1.30 Cc1ccc(cc1)C(=O)CCNCCO 8e20fe780812c1cbf3846141836471d7 [1,1,0,0,0,0|2,0,0]=4 4683 B15R1.30 Cc1ccc(cc1)C(=O)CCNCCS 454f68cb4f363907c343e9af9a980f5e [1,1,0,0,0,0|2,0,0]=4 4684 B15R1.30 Cc1ccc(cc1)C(=O)CCOCCF c5fc80a30490d8bf7e6fd99b7a5b886a [1,1,0,0,0,0|2,0,0]=4 4685 B15R1.30 Cc1ccc(cc1)C(=O)CCOCCS ff56e7148b2b9b385161a7a564485c09 [1,1,0,0,0,0|2,0,0]=4 4686 B15R1.30 Cc1ccc(cc1)C(=O)CNCCCCl 6259393e91f6ef16ceaf01d3b8f8d9e8 [1,1,0,0,0,0|2,0,0]=4 4687 B15R1.30 Cc1ccc(cc1)C(=O)CNCCCF e6302915d27bcd71e65888f588f8822b [1,1,0,0,0,0|2,0,0]=4 4688 B15R1.30 Cc1ccc(cc1)C(=O)CNCCCO b8d550d027a099b9e0b9eb05814785d0 [1,1,0,0,0,0|2,0,0]=4 4689 B15R1.30 Cc1ccc(cc1)C(=O)CNCCCS 4ec18c9cb3163b23c5bdfe0968d1fff1 [1,1,0,0,0,0|2,0,0]=4 4690 B15R1.30 Cc1ccc(cc1)C(=O)COCCCF 3b727d11b5631902b75f06a7cb415793 [1,1,0,0,0,0|2,0,0]=4 4691 B15R1.30 Cc1ccc(cc1)C(=O)COCCCS 312a5fc1e6630030319bc0f0add10df9 [1,1,0,0,0,0|2,0,0]=4 4692 B15R1.30 Cc1ccc(cc1)C(=O)NCCCCCl b6d0c20c5903571393c94a2df188cb14 [1,1,0,0,0,0|2,0,0]=4 4693 B15R1.30 Cc1ccc(cc1)C(=O)NCCCCO 7a584c36103ba912243138baceba599b [1,1,0,0,0,0|2,0,0]=4 4694 B15R1.30 Cc1ccc(cc1)C(=O)NCCCCS 926430d5e3c2324740b054b944e8660c [1,1,0,0,0,0|2,0,0]=4 4695 B15R1.30 Cc1ccc(cc1)C(=O)OCCOCF 3a56050765d643af944dd24474fcac9a [1,1,0,0,0,0|2,0,0]=4 4696 B15R1.30 O=C(CCCOCF)c1ccc(cc1)F ba3d728f3add00846948882c9eca2b8a [1,1,0,0,0,0|2,0,0]=4 4697 B15R1.30 O=C(CCNCCBr)c1ccc(cc1)Br cce4413248d0a82d170db5710ea2d265 [1,1,0,0,0,0|2,0,0]=4 4698 B15R1.30 O=C(CCNCCBr)c1ccc(cc1)F 961488aefd4ce45fc874810d53c0b5b7 [1,1,0,0,0,0|2,0,0]=4 4699 B15R1.30 O=C(CCNCCF)c1ccc(cc1)Br b36e1d36ec8562ac8e7ac31272d75a93 [1,1,0,0,0,0|2,0,0]=4 4700 B15R1.30 O=C(CCNCCF)c1ccc(cc1)F 4edd611944f3ed9bfa24cdfcb408bf7f [1,1,0,0,0,0|2,0,0]=4 4701 B15R1.30 O=C(CCNCCI)c1ccc(cc1)Br 48e3a99b0153a9af9fabcdd66a286972 [1,1,0,0,0,0|2,0,0]=4 4702 B15R1.30 O=C(CCNCCI)c1ccc(cc1)Cl 3b2580862efcb53970fafc337325378a [1,1,0,0,0,0|2,0,0]=4 4703 B15R1.30 O=C(CCNCCI)c1ccc(cc1)F e121a31ec0df960e4b9b3bf4bbed54b2 [1,1,0,0,0,0|2,0,0]=4 4704 B15R1.30 O=C(CCNCCO)c1ccc(cc1)Br ca05f8b7add9ba3a55bb937f0a7d879b [1,1,0,0,0,0|2,0,0]=4 4705 B15R1.30 O=C(CCNCCO)c1ccc(cc1)Cl b419d4f6efcc002b1f9fe337eb483f99 [1,1,0,0,0,0|2,0,0]=4 4706 B15R1.30 O=C(CCNCCO)c1ccc(cc1)F db655b4fe3ed35ae941ab784fddb9aab [1,1,0,0,0,0|2,0,0]=4 4707 B15R1.30 O=C(CCNCCS)c1ccc(cc1)Br aabbb100198ea08f266f07036f276016 [1,1,0,0,0,0|2,0,0]=4 4708 B15R1.30 O=C(CCNCCS)c1ccc(cc1)F 7489671bd161aaf6c387e473235e70ed [1,1,0,0,0,0|2,0,0]=4 4709 B15R1.30 O=C(CCOCCF)c1ccc(cc1)Br 96848b31868471851015b882bb850114 [1,1,0,0,0,0|2,0,0]=4 4710 B15R1.30 O=C(CCOCCF)c1ccc(cc1)Cl fc575ad22e1b1e419ebdd349557ec480 [1,1,0,0,0,0|2,0,0]=4 4711 B15R1.30 O=C(CCOCCF)c1ccc(cc1)F cc8ec6a0fe9fe183714c5760b9886ae8 [1,1,0,0,0,0|2,0,0]=4 4712 B15R1.30 O=C(CCOCCS)c1ccc(cc1)Br 06c9a392f9634b91835f9920ab96b12a [1,1,0,0,0,0|2,0,0]=4 4713 B15R1.30 O=C(CCOCCS)c1ccc(cc1)Cl c3cd2508be4a20dba2d1f1253dec2e99 [1,1,0,0,0,0|2,0,0]=4 4714 B15R1.30 O=C(CCOCCS)c1ccc(cc1)F e3d93cb7a391b2422dc5652171c0f6da [1,1,0,0,0,0|2,0,0]=4 4715 B15R1.30 O=C(CNCCCCl)c1ccc(cc1)Br b70ed61bb7f5f9dbef0633876a1cf8ef [1,1,0,0,0,0|2,0,0]=4 4716 B15R1.30 O=C(CNCCCCl)c1ccc(cc1)Cl 0a95da7ade588feb2349b97204a3943c [1,1,0,0,0,0|2,0,0]=4 4717 B15R1.30 O=C(CNCCCCl)c1ccc(cc1)F 1e4633a38f3ebb423cfc6633aefc5d9e [1,1,0,0,0,0|2,0,0]=4 4718 B15R1.30 O=C(CNCCCCl)c1ccc(cc1)I b2e0fe6bc0d52686b10aa9374c0694f6 [1,1,0,0,0,0|2,0,0]=4 4719 B15R1.30 O=C(CNCCCF)c1ccc(cc1)Br 6b4fee93c5ca00b7e12eb4b376f687ff [1,1,0,0,0,0|2,0,0]=4 4720 B15R1.30 O=C(CNCCCF)c1ccc(cc1)Cl af099a84b809a48c1223d5f9200d84a9 [1,1,0,0,0,0|2,0,0]=4 4721 B15R1.30 O=C(CNCCCO)c1ccc(cc1)Br b9ba813d07c3eb5d94c88d51b65df665 [1,1,0,0,0,0|2,0,0]=4 4722 B15R1.30 O=C(CNCCCO)c1ccc(cc1)Cl f84f93ae90cc8605b6b4513a5e9add6c [1,1,0,0,0,0|2,0,0]=4 4723 B15R1.30 O=C(CNCCCO)c1ccc(cc1)F 84f407cc6767a03734ea06ff0ee831f7 [1,1,0,0,0,0|2,0,0]=4 4724 B15R1.30 O=C(CNCCCO)c1ccc(cc1)I fee00458915ddbdbb54c0174e5ac8c6c [1,1,0,0,0,0|2,0,0]=4 4725 B15R1.30 O=C(CNCCCS)c1ccc(cc1)Br 4875361859795687985edaf8cd5f6979 [1,1,0,0,0,0|2,0,0]=4 4726 B15R1.30 O=C(CNCCCS)c1ccc(cc1)Cl 7d146aacb9026c39e1d377d31ff3649f [1,1,0,0,0,0|2,0,0]=4 4727 B15R1.30 O=C(COCCCF)c1ccc(cc1)Br 6238a296fcd957eab5bc98c784bf5585 [1,1,0,0,0,0|2,0,0]=4 4728 B15R1.30 O=C(COCCCF)c1ccc(cc1)Cl 69ee19fd0d350c175fc2b68594afdadb [1,1,0,0,0,0|2,0,0]=4 4729 B15R1.30 O=C(COCCCF)c1ccc(cc1)F 760337b48db8ab7a5d8d44797fc0f1a6 [1,1,0,0,0,0|2,0,0]=4 4730 B15R1.30 O=C(COCCCF)c1ccc(cc1)I d0f6d6d96cf2b8d753fdb732f77c82aa [1,1,0,0,0,0|2,0,0]=4 4731 B15R1.30 O=C(COCCCS)c1ccc(cc1)Br eef6c99e635fb94f47c0cee93adeb79b [1,1,0,0,0,0|2,0,0]=4 4732 B15R1.30 O=C(COCCCS)c1ccc(cc1)Cl bdab9d152815446f03ecb008ab9976a7 [1,1,0,0,0,0|2,0,0]=4 4733 B15R1.30 O=C(COCCCS)c1ccc(cc1)F 352559f7102a9048baf41348873306ca [1,1,0,0,0,0|2,0,0]=4 4734 B15R1.30 O=C(COCCCS)c1ccc(cc1)I 83aa281c9e8425065a095a1234a1df2d [1,1,0,0,0,0|2,0,0]=4 4735 B15R1.30 O=C(NCCCCCl)c1ccc(cc1)Br 3b683e7900908c4dd02842a88c1ffa0d [1,1,0,0,0,0|2,0,0]=4 4736 B15R1.30 O=C(NCCCCCl)c1ccc(cc1)Cl 29a36079a648a5b8327d539abd164d01 [1,1,0,0,0,0|2,0,0]=4 4737 B15R1.30 O=C(NCCCCCl)c1ccc(cc1)F 819f9ee21c61f90fd7cc0227600352e5 [1,1,0,0,0,0|2,0,0]=4 4738 B15R1.30 O=C(NCCCCCl)c1ccc(cc1)I 7fa9f517fad36d44eb4e0a580e6e1a45 [1,1,0,0,0,0|2,0,0]=4 4739 B15R1.30 O=C(NCCCCCl)c1ccc(cc1)O e4d6700e7ff7f5a8645146eaebc202af [1,1,0,0,0,0|2,0,0]=4 4740 B15R1.30 O=C(NCCCCCl)c1ccc(cc1)S 7918c660d2d71de9379b4a2d6b149a7d [1,1,0,0,0,0|2,0,0]=4 4741 B15R1.30 O=C(NCCCCO)c1ccc(cc1)Br 96523b92e8ecca98e76780783a30c51e [1,1,0,0,0,0|2,0,0]=4 4742 B15R1.30 O=C(NCCCCO)c1ccc(cc1)Cl 5bd40a1c866491459b29e6df508caa07 [1,1,0,0,0,0|2,0,0]=4 4743 B15R1.30 O=C(NCCCCO)c1ccc(cc1)F cbcdab8b177d1591a5c2e061abff1a32 [1,1,0,0,0,0|2,0,0]=4 4744 B15R1.30 O=C(NCCCCO)c1ccc(cc1)I 83da520b4d6828be6d63d0306aa8b905 [1,1,0,0,0,0|2,0,0]=4 4745 B15R1.30 O=C(NCCCCO)c1ccc(cc1)O effb12611963f5a760e1085d1995f8dd [1,1,0,0,0,0|2,0,0]=4 4746 B15R1.30 O=C(NCCCCO)c1ccc(cc1)S 9f5bdbc0a3868ec028a3ac011ac8a0a0 [1,1,0,0,0,0|2,0,0]=4 4747 B15R1.30 O=C(NCCCCS)c1ccc(cc1)Br 30ba252da12aecabf2a4478a5fcbaf37 [1,1,0,0,0,0|2,0,0]=4 4748 B15R1.30 O=C(NCCCCS)c1ccc(cc1)Cl 795b11b2a51577063ce4e769a3e6fc26 [1,1,0,0,0,0|2,0,0]=4 4749 B15R1.30 O=C(NCCCCS)c1ccc(cc1)F a001edf1be5b48ad82e154def7b17cf8 [1,1,0,0,0,0|2,0,0]=4 4750 B15R1.30 O=C(NCCCCS)c1ccc(cc1)I 013e21c11de38f4f3d17cd6172c79516 [1,1,0,0,0,0|2,0,0]=4 4751 B15R1.30 O=C(NCCCCS)c1ccc(cc1)O 6023801d2dbb36b8bc75108d022c0bb8 [1,1,0,0,0,0|2,0,0]=4 4752 B15R1.30 O=C(NCCCCS)c1ccc(cc1)S 254d5ceeb8fea0fd82979add4cea6eb0 [1,1,0,0,0,0|2,0,0]=4 4753 B15R1.30 O=C(OCNCCBr)c1ccc(cc1)F 6cd6c90701d00785761763bedfb98893 [1,1,0,0,0,0|2,0,0]=4 4754 B15R1.30 O=C(OCNCCF)c1ccc(cc1)F fcd8d1e873f71963403ce59bf5e4976c [1,1,0,0,0,0|2,0,0]=4 4755 B15R1.30 O=C(OCNCCI)c1ccc(cc1)F c484a891cc42afbbcdfcdf20d333923a [1,1,0,0,0,0|2,0,0]=4 4756 B15R1.30 O=C(OCNCCO)c1ccc(cc1)F a6253faea91a4cefb8a6f4e2d3615cae [1,1,0,0,0,0|2,0,0]=4 4757 B15R1.30 O=C(OCNCCS)c1ccc(cc1)F 1fc228918fc12e58b2f561f7d3cc2f75 [1,1,0,0,0,0|2,0,0]=4 4758 B15R1.30 O=C(OCOCCF)c1ccc(cc1)F 19c26af700b357e2bae98346ca09e0d0 [1,1,0,0,0,0|2,0,0]=4 4759 B15R1.30 O=C(OCOCCS)c1ccc(cc1)F b483803ad48afbd5cca7c931e28aff27 [1,1,0,0,0,0|2,0,0]=4 4760 B15R1.31 CCCCCCN(C)c1cccc(c1)Br cc71e7b16143e455f0247f881367fe64 [1,1,0,0,0,0|2,0,0]=4 4761 B15R1.31 CCCCCCN(C)c1cccc(c1)C 351f2e60ce38af7140459a83d493c742 [1,1,0,0,0,0|2,0,0]=4 4762 B15R1.31 CCCCCCN(C)c1cccc(c1)F 7d2d00e72b7f5400585245522730553e [1,1,0,0,0,0|2,0,0]=4 4763 B15R1.31 CCCCCCN(C)c1cccc(c1)I 4fcf59d671ece9c48fe97adbebea4a58 [1,1,0,0,0,0|2,0,0]=4 4764 B15R1.31 CCCCCNC(=O)c1cc(=O)cco1 65a36c238ac65560674eeeb3e1814810 [1,1,0,0,0,0|2,0,0]=4 4765 B15R1.31 CCCCCNC(=O)c1cc(ccn1)Br 8dc052e09102291ef981381c52e79c5d [1,1,0,0,0,0|2,0,0]=4 4766 B15R1.31 CCCCCNC(=O)c1cc(ccn1)C 7067c30eda509ef624081c930118ad37 [1,1,0,0,0,0|2,0,0]=4 4767 B15R1.31 CCCCCNC(=O)c1cc(ccn1)Cl f5078b052b30fafa79acbf4bf001e8e7 [1,1,0,0,0,0|2,0,0]=4 4768 B15R1.31 CCCCCNC(=O)c1cc(ccn1)F 8edc4605c1726b501c20b1d8aef23d14 [1,1,0,0,0,0|2,0,0]=4 4769 B15R1.31 CCCCCNC(=O)c1cc(ccn1)I 1da5df87ea581b4453d1d564b29aca07 [1,1,0,0,0,0|2,0,0]=4 4770 B15R1.31 CCCCCNC(=O)c1cc(ccn1)O de996b94b0fc47dfe5336bfd6a5a2ff5 [1,1,0,0,0,0|2,0,0]=4 4771 B15R1.31 CCCCCNC(=O)c1ccc[n+](c1)[O-] 6cc2356e07079cc1d822ce71e063ab6c [1,1,0,0,0,0|2,0,0]=4 4772 B15R1.31 CCCCCNC(=O)c1cccc(c1)Br 7b7669f7b054285c760b93ba7fb5092c [1,1,0,0,0,0|1,0,0]=3 4773 B15R1.31 CCCCCNC(=O)c1cccc(c1)C 8b6fc54fc77d526073109a5764bf26a0 [1,1,0,0,0,0|1,0,0]=3 4774 B15R1.31 CCCCCNC(=O)c1cccc(c1)Cl 3902ac0ca5f0bd894fc1ebca8b6bad57 [1,1,0,0,0,0|1,0,0]=3 4775 B15R1.31 CCCCCNC(=O)c1cccc(c1)F 95762aa2c3dbc13e10b82833d243e99c [1,1,0,0,0,0|1,0,0]=3 4776 B15R1.31 CCCCCNC(=O)c1cccc(c1)I c6c564c64b66ef7ca321e7325998319a [1,1,0,0,0,0|1,0,0]=3 4777 B15R1.31 CCCCCNC(=O)c1cccc(c1)O 178e6ce39291ed9d3f5711eb927a4726 [1,1,0,0,0,0|1,0,0]=3 4778 B15R1.31 CCCCCNC(=O)c1cccc(c1)S 7ef2244a0b3e5024770af3e35ade1f4e [1,1,0,0,0,0|1,0,0]=3 4779 B15R1.31 CCCCCNC(=O)c1cccc(n1)Br 409e0bbc499fdb7869e645f41549dc1b [1,1,0,0,0,0|2,0,0]=4 4780 B15R1.31 CCCCCNC(=O)c1cccc(n1)C e42ed154f03b7fb96da459ea454985b4 [1,1,0,0,0,0|2,0,0]=4 4781 B15R1.31 CCCCCNC(=O)c1cccc(n1)Cl 8d638e9e6ace585661af72e20ed1bf17 [1,1,0,0,0,0|2,0,0]=4 4782 B15R1.31 CCCCCNC(=O)c1cccc(n1)F 5401bc08efbaf721eb971021fa00f244 [1,1,0,0,0,0|2,0,0]=4 4783 B15R1.31 CCCCCNC(=O)c1cccc(n1)I 233d30709d89bd9612c8a4ea694cc1ae [1,1,0,0,0,0|2,0,0]=4 4784 B15R1.31 CCCCCNC(=O)c1cccc(n1)O 39b58f764b3092f95bcee029e6eb7e9c [1,1,0,0,0,0|2,0,0]=4 4785 B15R1.31 CCCCCNC(=O)c1ccnc(c1)Br 47820dca26408d9d0e92794b7b1ded4b [1,1,0,0,0,0|2,0,0]=4 4786 B15R1.31 CCCCCNC(=O)c1ccnc(c1)C dd4f0092b25f3fd9f2e9955da712563f [1,1,0,0,0,0|2,0,0]=4 4787 B15R1.31 CCCCCNC(=O)c1ccnc(c1)Cl ed69ccc03bde2bec742f382540290616 [1,1,0,0,0,0|2,0,0]=4 4788 B15R1.31 CCCCCNC(=O)c1ccnc(c1)F 70ac0e04e024924f01fe54f01610367a [1,1,0,0,0,0|2,0,0]=4 4789 B15R1.31 CCCCCNC(=O)c1ccnc(c1)I 7aeb729df3db71274a1098fefe28c6b6 [1,1,0,0,0,0|2,0,0]=4 4790 B15R1.31 CCCCCNC(=O)c1ccnc(c1)O c8cd02051d2b6f0d5d634504b3254f33 [1,1,0,0,0,0|2,0,0]=4 4791 B15R1.31 CCCCCNC(=O)c1ccnc(c1)S 01cab74947adbc13924a0759196b5a70 [1,1,0,0,0,0|2,0,0]=4 4792 B15R1.31 CCCCCNC(=O)c1cncc(c1)Br 990bfa72c1736d4529bfba584d164cbc [1,1,0,0,0,0|2,0,0]=4 4793 B15R1.31 CCCCCNC(=O)c1cncc(c1)C 9d55cc34131a71bc2895318d321d132b [1,1,0,0,0,0|2,0,0]=4 4794 B15R1.31 CCCCCNC(=O)c1cncc(c1)Cl 8ca7e58d476a9e03a373df4513b1a563 [1,1,0,0,0,0|2,0,0]=4 4795 B15R1.31 CCCCCNC(=O)c1cncc(c1)F 4a410b9309ddb38a8079f9a1bb6a8637 [1,1,0,0,0,0|2,0,0]=4 4796 B15R1.31 CCCCCNC(=O)c1cncc(c1)I fd07a5826ca115f2bbce2936c5392a60 [1,1,0,0,0,0|2,0,0]=4 4797 B15R1.31 CCCCCNC(=O)c1cncc(c1)O 510c2301e875e48f5d28dacc7ac51676 [1,1,0,0,0,0|2,0,0]=4 4798 B15R1.31 CCCCCOC(C)c1cccc(c1)Br 475d87bd9e037af42290bbad31b319c5 [1,1,0,0,0,0|1,0,1]=4 4799 B15R1.31 CCCCCOC(C)c1cccc(c1)C 994d4cec40afe56ae61e25b489c9ccee [1,1,0,0,0,0|1,0,1]=4 4800 B15R1.31 CCCCCOC(C)c1cccc(c1)Cl 753ccc182d2db919002a86d4f08bbeff [1,1,0,0,0,0|1,0,1]=4 4801 B15R1.31 CCCCCOC(C)c1cccc(c1)F ce227f191f7dbb04afa94dd6f9788e8f [1,1,0,0,0,0|1,0,1]=4 4802 B15R1.31 CCCCCOC(C)c1cccc(c1)I abce83ee8e441ed1a35536dde07ee132 [1,1,0,0,0,0|1,0,1]=4 4803 B15R1.31 CCCCCO[C@@H](C)c1cccc(c1)Br 4859c5008e237bfbf50d7d078b591cfa [1,1,0,0,0,0|1,0,1]=4 4804 B15R1.31 CCCCCO[C@@H](C)c1cccc(c1)C dbadca78311a7ebe215fc03d82b5f1a8 [1,1,0,0,0,0|1,0,1]=4 4805 B15R1.31 CCCCCO[C@@H](C)c1cccc(c1)Cl e4d2340cfb90159182c0b37596a090d5 [1,1,0,0,0,0|1,0,1]=4 4806 B15R1.31 CCCCCO[C@@H](C)c1cccc(c1)F 441c2c8f55d922a51b794da48bd226dd [1,1,0,0,0,0|1,0,1]=4 4807 B15R1.31 CCCCCO[C@H](C)c1cccc(c1)Br 52a4bd9b7deb249a0a72aa794a7a864b [1,1,0,0,0,0|1,0,1]=4 4808 B15R1.31 CCCCCO[C@H](C)c1cccc(c1)C 71cd8d226acbf270706d52d5da634a7f [1,1,0,0,0,0|1,0,1]=4 4809 B15R1.31 CCCCCO[C@H](C)c1cccc(c1)Cl ba25adfbd1bdcc38197fbd5e3bb39670 [1,1,0,0,0,0|1,0,1]=4 4810 B15R1.31 CCCCCO[C@H](C)c1cccc(c1)F de3078efa987c7bad470d5f41863a4b8 [1,1,0,0,0,0|1,0,1]=4 4811 B15R1.31 CCCCNCC(=O)c1cc(ccn1)Cl 6b4489e43a15f51f0120113d9d32ef0c [1,1,0,0,0,0|2,0,0]=4 4812 B15R1.31 CCCCNCC(=O)c1cccc(c1)Br eff16fb84b8aa824efd6378ec42e7775 [1,1,0,0,0,0|1,0,0]=3 4813 B15R1.31 CCCCNCC(=O)c1cccc(c1)C 8769eeea50cb9892bb967748a3564b2e [1,1,0,0,0,0|1,0,0]=3 4814 B15R1.31 CCCCNCC(=O)c1cccc(c1)Cl 0f077a6d240606989d2ee20e420575f9 [1,1,0,0,0,0|1,0,0]=3 4815 B15R1.31 CCCCNCC(=O)c1cccc(c1)F e33f89bbbfd5c502f81ccfa775e77318 [1,1,0,0,0,0|1,0,0]=3 4816 B15R1.31 CCCCNCC(=O)c1cccc(c1)I 5bd51cc9ab30a44372830e7aed34a544 [1,1,0,0,0,0|1,0,0]=3 4817 B15R1.31 CCCCNCC(=O)c1cccc(n1)Br b13e1120cd6a435dbbed51f60d7734c7 [1,1,0,0,0,0|2,0,0]=4 4818 B15R1.31 CCCCNCC(=O)c1cccc(n1)C 9bc9b7904465316f1445ca6fdeb8e0ea [1,1,0,0,0,0|2,0,0]=4 4819 B15R1.31 CCCCNCC(=O)c1ccnc(c1)Cl 9e9698b9908b5e47aef52dd75f2355bb [1,1,0,0,0,0|2,0,0]=4 4820 B15R1.31 CCCCNCC(=O)c1ccnc(c1)F e30b2711fd8eb7635ce153e19429c357 [1,1,0,0,0,0|2,0,0]=4 4821 B15R1.31 CCCCOCC(=O)c1cc(ccn1)Cl 3007259692fd046210b2c833643008a6 [1,1,0,0,0,0|2,0,0]=4 4822 B15R1.31 CCCCOCC(=O)c1cccc(c1)Br 8fbf47378f62ddecdff810d4aa4b8fd1 [1,1,0,0,0,0|1,0,0]=3 4823 B15R1.31 CCCCOCC(=O)c1cccc(c1)C 4c12dfcc6ce5290c9fa385149cb9fcfa [1,1,0,0,0,0|1,0,0]=3 4824 B15R1.31 CCCCOCC(=O)c1cccc(c1)Cl 0c9bad1e335f25c0b5ae1935af0635af [1,1,0,0,0,0|1,0,0]=3 4825 B15R1.31 CCCCOCC(=O)c1cccc(c1)F 06a51091ccd0224733fed98b2e95381f [1,1,0,0,0,0|1,0,0]=3 4826 B15R1.31 CCCCOCC(=O)c1cccc(c1)I 96b9c6f1487aa3e6601cc781698a4b7b [1,1,0,0,0,0|1,0,0]=3 4827 B15R1.31 CCCCOCC(=O)c1cccc(n1)Br 18b5a13d0ecc1d88e03c76a8033e6715 [1,1,0,0,0,0|2,0,0]=4 4828 B15R1.31 CCCCOCC(=O)c1cccc(n1)C e5f20e24af00f3528164e7cedf01972d [1,1,0,0,0,0|2,0,0]=4 4829 B15R1.31 CCCCOCC(=O)c1ccnc(c1)Cl d31eb9e84fd9a427da7a3f41ded3557f [1,1,0,0,0,0|2,0,0]=4 4830 B15R1.31 CCCCOCC(=O)c1ccnc(c1)F 637534a51f5126fad36130ef6b1710d5 [1,1,0,0,0,0|2,0,0]=4 4831 B15R1.31 CCCOCNC(=O)c1cccc(c1)C f8544e0199ef140b4680c6764729cc22 [1,1,0,0,0,0|2,0,0]=4 4832 B15R1.31 CCOCCNC(=O)c1cccc(c1)Br 94b0eeeec207c6eba398568264c5ba1e [1,1,0,0,0,0|2,0,0]=4 4833 B15R1.31 CCOCCNC(=O)c1cccc(c1)C d52dd69cf2e8f36c79f5c7e8111c81ba [1,1,0,0,0,0|2,0,0]=4 4834 B15R1.31 CCOCCNC(=O)c1cccc(c1)Cl da5537642dfc3e8ee91648cc69fde8d9 [1,1,0,0,0,0|2,0,0]=4 4835 B15R1.31 CCOCCNC(=O)c1cccc(c1)F 7ef1c0108343842ae0035ca44ff4be97 [1,1,0,0,0,0|2,0,0]=4 4836 B15R1.31 CCOCCNC(=O)c1cccc(c1)I 5e895e748c50e79612df1a9c5ab99dfe [1,1,0,0,0,0|2,0,0]=4 4837 B15R1.31 CCOCCNC(=O)c1cccc(c1)O 3c79e06f2ede16abd80112e3f438ae47 [1,1,0,0,0,0|2,0,0]=4 4838 B15R1.31 CCOCCNC(=O)c1cccc(c1)S c6be7d84ba3b291c98a38a83747dd953 [1,1,0,0,0,0|2,0,0]=4 4839 B15R1.31 CCOCOCC(=O)c1cccc(c1)Br 092456611a72d79c66ded6b118cc03a8 [1,1,0,0,0,0|2,0,0]=4 4840 B15R1.31 CCOCOCC(=O)c1cccc(c1)Cl 881cc46dea5c29fee737ce44083b8f7f [1,1,0,0,0,0|2,0,0]=4 4841 B15R1.31 CCOCOCC(=O)c1cccc(c1)F 4ad1feb5ffefb54e10a5d9c8e69b3edf [1,1,0,0,0,0|2,0,0]=4 4842 B15R1.31 CCSCCNC(=O)c1cccc(c1)Br af922e68b13964cbcbaa6e7322369c38 [1,1,0,0,0,0|2,0,0]=4 4843 B15R1.31 CCSCCNC(=O)c1cccc(c1)C 9163e98d5ca24ea47e725478b8e01c03 [1,1,0,0,0,0|2,0,0]=4 4844 B15R1.31 CCSCCNC(=O)c1cccc(c1)Cl 499097132c6d854fa6f9571c91a17758 [1,1,0,0,0,0|2,0,0]=4 4845 B15R1.31 CCSCCNC(=O)c1cccc(c1)F 72f922ebcb5f561aac0d67fdb950252e [1,1,0,0,0,0|2,0,0]=4 4846 B15R1.31 CCSCCNC(=O)c1cccc(c1)I 34f29f2f71be5d04ac1525c85966b825 [1,1,0,0,0,0|2,0,0]=4 4847 B15R1.31 CCSCCNC(=O)c1cccc(c1)O 2fd54b5daff72ae19e64aac5328b6c94 [1,1,0,0,0,0|2,0,0]=4 4848 B15R1.31 CCSCCNC(=O)c1cccc(c1)S dad45ec91f8c9320ccea320dea379864 [1,1,0,0,0,0|2,0,0]=4 4849 B15R1.31 COCCCNC(=O)c1cccc(c1)Br 0eb7bdfc3fc20b1e54ddc19cf19e3c69 [1,1,0,0,0,0|2,0,0]=4 4850 B15R1.31 COCCCNC(=O)c1cccc(c1)C d8be36431785f2ba674cc28255e85adf [1,1,0,0,0,0|2,0,0]=4 4851 B15R1.31 COCCCNC(=O)c1cccc(c1)Cl 7b0892941954a1aa5ec46eb0496385c4 [1,1,0,0,0,0|2,0,0]=4 4852 B15R1.31 COCCCNC(=O)c1cccc(c1)F 8a82efe01620b68e80a218e3169282f2 [1,1,0,0,0,0|2,0,0]=4 4853 B15R1.31 COCCCNC(=O)c1cccc(c1)I 693aad430674d5e2f1fae381365f4fd0 [1,1,0,0,0,0|2,0,0]=4 4854 B15R1.31 COCCCNC(=O)c1cccc(c1)O 4b167db55f49aad5ffb0b623dc7c2527 [1,1,0,0,0,0|2,0,0]=4 4855 B15R1.31 COCCCNC(=O)c1cccc(c1)S c10691c9a4a66d9545ead68d0d2e3e0a [1,1,0,0,0,0|2,0,0]=4 4856 B15R1.31 COCCNCC(=O)c1cccc(c1)Br 18bdac99546744baaa676d5bdc462861 [1,1,0,0,0,0|2,0,0]=4 4857 B15R1.31 COCCNCC(=O)c1cccc(c1)C c66c8539454f33b104908822391c6343 [1,1,0,0,0,0|2,0,0]=4 4858 B15R1.31 COCCNCC(=O)c1cccc(c1)Cl cd55173684a5ccffc76b5ce973312d68 [1,1,0,0,0,0|2,0,0]=4 4859 B15R1.31 COCCNCC(=O)c1cccc(c1)F 1e282748785c65aa0fee136d45bfb1d0 [1,1,0,0,0,0|2,0,0]=4 4860 B15R1.31 COCCNCC(=O)c1cccc(c1)I 40a37132a01a8ed523da113401fb6bbc [1,1,0,0,0,0|2,0,0]=4 4861 B15R1.31 COCCOCC(=O)c1cccc(c1)Br 52c00dae76a4f3eea6a71cff9c710517 [1,1,0,0,0,0|2,0,0]=4 4862 B15R1.31 COCCOCC(=O)c1cccc(c1)C 720599e53ef8bcf65602634e0add1e10 [1,1,0,0,0,0|2,0,0]=4 4863 B15R1.31 COCCOCC(=O)c1cccc(c1)Cl 3c7aa4641979afd250d61e75027a1615 [1,1,0,0,0,0|2,0,0]=4 4864 B15R1.31 COCCOCC(=O)c1cccc(c1)F a3d26dae7bd47cd795a89fc486e49e45 [1,1,0,0,0,0|2,0,0]=4 4865 B15R1.31 COCCOCC(=O)c1cccc(c1)I e08d2dc07b16dbb082da1fbb2adc049c [1,1,0,0,0,0|2,0,0]=4 4866 B15R1.31 CSCCCNC(=O)c1cccc(c1)Br 0b8848b197b57aa79ec6852b4fa729dc [1,1,0,0,0,0|2,0,0]=4 4867 B15R1.31 CSCCCNC(=O)c1cccc(c1)C adf930762a825f66d28e73065f004f2b [1,1,0,0,0,0|2,0,0]=4 4868 B15R1.31 CSCCCNC(=O)c1cccc(c1)Cl 596fd4b2e1ba8d2bcddbba8b050b8224 [1,1,0,0,0,0|2,0,0]=4 4869 B15R1.31 CSCCCNC(=O)c1cccc(c1)F 1f79a21bb7dac745bf60508a11c13bdb [1,1,0,0,0,0|2,0,0]=4 4870 B15R1.31 CSCCCNC(=O)c1cccc(c1)I d719ee8d4ae9f707bde61399a385bdfa [1,1,0,0,0,0|2,0,0]=4 4871 B15R1.31 CSCCCNC(=O)c1cccc(c1)O 1eb5fcbff9a56e73310e06d55a437c7d [1,1,0,0,0,0|2,0,0]=4 4872 B15R1.31 CSCCCNC(=O)c1cccc(c1)S 2276355d8e4da59edaad424e40470305 [1,1,0,0,0,0|2,0,0]=4 4873 B15R1.31 CSCCNCC(=O)c1cccc(c1)Br 718c7b45d6199c01857478cf1bc1a83b [1,1,0,0,0,0|2,0,0]=4 4874 B15R1.31 CSCCNCC(=O)c1cccc(c1)C 952036d3fa8f553e5d81a2f92837660b [1,1,0,0,0,0|2,0,0]=4 4875 B15R1.31 CSCCNCC(=O)c1cccc(c1)Cl a7039a2dbeba35583f0a7a49a9a8ecc2 [1,1,0,0,0,0|2,0,0]=4 4876 B15R1.31 CSCCNCC(=O)c1cccc(c1)F 23db2f5cb5203d9af5e2d6f7c0e3a7a9 [1,1,0,0,0,0|2,0,0]=4 4877 B15R1.31 CSCCNCC(=O)c1cccc(c1)I d85d81f0b6e09ca800081ba883ce039e [1,1,0,0,0,0|2,0,0]=4 4878 B15R1.31 CSCCOCC(=O)c1cccc(c1)Br bf849661c771f12a391673fde70dfec3 [1,1,0,0,0,0|2,0,0]=4 4879 B15R1.31 CSCCOCC(=O)c1cccc(c1)C f4d33ac7b1aedb82c7effe2fe75d74d6 [1,1,0,0,0,0|2,0,0]=4 4880 B15R1.31 CSCCOCC(=O)c1cccc(c1)Cl 3d0dae5a77fa1f2af08ace2ef09b78d2 [1,1,0,0,0,0|2,0,0]=4 4881 B15R1.31 CSCCOCC(=O)c1cccc(c1)F e1af37ede41edf1ac3234a706a72bb1c [1,1,0,0,0,0|2,0,0]=4 4882 B15R1.31 CSCCOCC(=O)c1cccc(c1)I cf784922a952776bfb9efbbf19497643 [1,1,0,0,0,0|2,0,0]=4 4883 B15R1.31 Cc1cccc(c1)C(=O)CNCCCCl ffb884ae4a50241b18f6b9ffdedc104e [1,1,0,0,0,0|2,0,0]=4 4884 B15R1.31 Cc1cccc(c1)C(=O)CNCCCO 51dea6ad6c55ea73c32d7d2e6bba94cb [1,1,0,0,0,0|2,0,0]=4 4885 B15R1.31 Cc1cccc(c1)C(=O)COCCCF eec47daa786e71751789214ec514cf66 [1,1,0,0,0,0|2,0,0]=4 4886 B15R1.31 Cc1cccc(c1)C(=O)COCCCS ead44475e3081057e1e8f29f8d7905dd [1,1,0,0,0,0|2,0,0]=4 4887 B15R1.31 Cc1cccc(c1)C(=O)NCCCCCl 83ca008f4ae5d2964b24b236ce4497b4 [1,1,0,0,0,0|2,0,0]=4 4888 B15R1.31 Cc1cccc(c1)C(=O)NCCCCO c1fddd72379d2bd819e775faa487e7e2 [1,1,0,0,0,0|2,0,0]=4 4889 B15R1.31 Cc1cccc(c1)C(=O)NCCCCS 2ddbd3e8582aa21329ea154a83a73f6b [1,1,0,0,0,0|2,0,0]=4 4890 B15R1.31 O=C(CNCCCCl)c1cccc(c1)Br e9dfc9517b7e77be0f3091f71c6b688c [1,1,0,0,0,0|2,0,0]=4 4891 B15R1.31 O=C(CNCCCCl)c1cccc(c1)Cl b4bb0cc80dbec1b7e77e3935e0b4e0c6 [1,1,0,0,0,0|2,0,0]=4 4892 B15R1.31 O=C(CNCCCCl)c1cccc(c1)F 018a63f5523c8b58f9b3bd079896a46f [1,1,0,0,0,0|2,0,0]=4 4893 B15R1.31 O=C(CNCCCCl)c1cccc(c1)I 91923dacfc4d2da211a4b6083f6db87b [1,1,0,0,0,0|2,0,0]=4 4894 B15R1.31 O=C(CNCCCO)c1cccc(c1)Br dd117cdbc65d64af01f9e907f5a3caad [1,1,0,0,0,0|2,0,0]=4 4895 B15R1.31 O=C(CNCCCO)c1cccc(c1)Cl 70f45ace620b94ce6b3dba8ede0849af [1,1,0,0,0,0|2,0,0]=4 4896 B15R1.31 O=C(CNCCCO)c1cccc(c1)F 26ab693b5887231a14bc40be7c13ae77 [1,1,0,0,0,0|2,0,0]=4 4897 B15R1.31 O=C(CNCCCO)c1cccc(c1)I 677f3dad02b698e818c58647c9b69d7b [1,1,0,0,0,0|2,0,0]=4 4898 B15R1.31 O=C(COCCCF)c1cccc(c1)Br a058757b46a4c5dd5a0f4f933f567f41 [1,1,0,0,0,0|2,0,0]=4 4899 B15R1.31 O=C(COCCCF)c1cccc(c1)Cl 1e270aba6eec8802997e539c6aaabda0 [1,1,0,0,0,0|2,0,0]=4 4900 B15R1.31 O=C(COCCCF)c1cccc(c1)F a3967f8894b5a1814fe344274d13ef9a [1,1,0,0,0,0|2,0,0]=4 4901 B15R1.31 O=C(COCCCF)c1cccc(c1)I afa57c13e7f0c0a05d208c2503574dcc [1,1,0,0,0,0|2,0,0]=4 4902 B15R1.31 O=C(COCCCS)c1cccc(c1)Br 04ebccf78ae14efdcf54dfa45fdde730 [1,1,0,0,0,0|2,0,0]=4 4903 B15R1.31 O=C(COCCCS)c1cccc(c1)Cl de714f1fd9056b5402b9877ec61869d8 [1,1,0,0,0,0|2,0,0]=4 4904 B15R1.31 O=C(COCCCS)c1cccc(c1)F 2195212ff02cbae8f2ec3e567866c77c [1,1,0,0,0,0|2,0,0]=4 4905 B15R1.31 O=C(COCCCS)c1cccc(c1)I 17497fba01e820844f2fd7b5ab3212d7 [1,1,0,0,0,0|2,0,0]=4 4906 B15R1.31 O=C(NCCCCCl)c1cccc(c1)Br 4103609a174c3df6c78be10806d338aa [1,1,0,0,0,0|2,0,0]=4 4907 B15R1.31 O=C(NCCCCCl)c1cccc(c1)Cl 7186c0af357b77a588078d01fd7bf75b [1,1,0,0,0,0|2,0,0]=4 4908 B15R1.31 O=C(NCCCCCl)c1cccc(c1)F b32b46f8ae619b65049daf5c9d568b37 [1,1,0,0,0,0|2,0,0]=4 4909 B15R1.31 O=C(NCCCCCl)c1cccc(c1)I a905fe7155be801d99bece36a8a85e55 [1,1,0,0,0,0|2,0,0]=4 4910 B15R1.31 O=C(NCCCCCl)c1cccc(c1)O 5e27b1f9bf7ae3d0a7b53b77b59eeef8 [1,1,0,0,0,0|2,0,0]=4 4911 B15R1.31 O=C(NCCCCCl)c1cccc(c1)S 86083aec41c5c6084d181be1569550ad [1,1,0,0,0,0|2,0,0]=4 4912 B15R1.31 O=C(NCCCCO)c1cccc(c1)Br 4dd9d1b2e5902990735be2cc387f6cbe [1,1,0,0,0,0|2,0,0]=4 4913 B15R1.31 O=C(NCCCCO)c1cccc(c1)Cl 41551093c55211131f617903b0c0d743 [1,1,0,0,0,0|2,0,0]=4 4914 B15R1.31 O=C(NCCCCO)c1cccc(c1)F 2ee8ad968148ad4b96052b79ed036a46 [1,1,0,0,0,0|2,0,0]=4 4915 B15R1.31 O=C(NCCCCO)c1cccc(c1)I 6386791780ffdbb1aeabb46d43b4e663 [1,1,0,0,0,0|2,0,0]=4 4916 B15R1.31 O=C(NCCCCO)c1cccc(c1)O c6d491b31aa2975536a0fe3931fda9b5 [1,1,0,0,0,0|2,0,0]=4 4917 B15R1.31 O=C(NCCCCO)c1cccc(c1)S b08701338d9abafef403bd926fc0d2e7 [1,1,0,0,0,0|2,0,0]=4 4918 B15R1.31 O=C(NCCCCS)c1cccc(c1)Br 18a6fee7edbf6a456469e5296607d794 [1,1,0,0,0,0|2,0,0]=4 4919 B15R1.31 O=C(NCCCCS)c1cccc(c1)Cl e2a4bcbd7caaccd81569154cc661274e [1,1,0,0,0,0|2,0,0]=4 4920 B15R1.31 O=C(NCCCCS)c1cccc(c1)F d4971f4f416b07dd78ebc9311b572c34 [1,1,0,0,0,0|2,0,0]=4 4921 B15R1.31 O=C(NCCCCS)c1cccc(c1)I 0e99f181a6610f4695a12d6037555586 [1,1,0,0,0,0|2,0,0]=4 4922 B15R1.31 O=C(NCCCCS)c1cccc(c1)O 53fbb314c7de8bddc9e7879ec8db990f [1,1,0,0,0,0|2,0,0]=4 4923 B15R1.31 O=C(NCCCCS)c1cccc(c1)S 73c9f8317634d3fc83da8ad2430a8908 [1,1,0,0,0,0|2,0,0]=4 4924 B15R1.33 C#CC(OCCCCC)c1ccccc1 fc2aeafdc5dee0dc2b4c9c0dc6e88c59 [1,1,0,0,0,0|1,0,1]=4 4925 B15R1.33 C#C[C@@H](OCCCCC)c1ccccc1 3d37158b440ada4354b516f75e8adcbb [1,1,0,0,0,0|1,0,1]=4 4926 B15R1.33 C#C[C@H](OCCCCC)c1ccccc1 adcf9640dc8b1c129a6a05962acabf9f [1,1,0,0,0,0|1,0,1]=4 4927 B15R1.33 C=CC(OCCCCC)c1ccccc1 38a2c9eafa359d2db21f8a33753da1d2 [1,1,0,0,0,0|1,0,1]=4 4928 B15R1.33 CCCCCCN(C#N)c1ccccc1 f4b68f34b939e53379518868b9eefad8 [1,1,0,0,0,0|2,0,0]=4 4929 B15R1.33 CCCCCCN(C=O)c1ccccc1 55ba51274918d4286660dff554426e4c [1,1,0,0,0,0|1,0,0]=3 4930 B15R1.33 CCCCCCN(CC)c1ccccc1 113385284e6ce39d8704be90a703efcb [1,1,0,0,0,0|2,0,0]=4 4931 B15R1.33 CCCCCNC(C=O)c1ccccc1 5627b7e160d55ddab6777d18e003255c [1,1,0,0,0,0|1,0,1]=4 4932 B15R1.33 CCCCCOC(C#N)c1ccccc1 a3ddd2f50173341a5fa984e9c2c32aa9 [1,1,0,0,0,0|1,0,1]=4 4933 B15R1.33 CCCCCOC(CC)c1ccccc1 525655371121712a53d2955a2b19e8a1 [1,1,0,0,0,0|1,0,1]=4 4934 B15R1.33 CCCCCOC(CF)c1ccccc1 684a360f7f718575ac87e09b4f37882f [1,1,0,0,0,0|1,0,1]=4 4935 B15R1.33 CCCCCO[C@@H](C#N)c1ccccc1 4eaa344b8d38c0314ca7fc16776a48f0 [1,1,0,0,0,0|1,0,1]=4 4936 B15R1.33 CCCCCO[C@@H](CC)c1ccccc1 60b77625cc84e47b45c7535634049223 [1,1,0,0,0,0|1,0,1]=4 4937 B15R1.33 CCCCCO[C@H](CC)c1ccccc1 59e205cd4b35be25b061bfd10a910800 [1,1,0,0,0,0|1,0,1]=4 4938 B15R1.33 CCCCCO[C@H](CF)c1ccccc1 aa4a967bae8859a2db3e4b0981cd350b [1,1,0,0,0,0|1,0,1]=4 4939 B15R1.33 CCCCO/C=C(\C=O)/c1ccccc1 1c9cc9ec4f87f1b220f0cfe79f7b1df1 [1,1,0,0,0,0|1,0,1]=4 4940 B15R1.33 CCOCCOC(C=O)c1ccccc1 245ec0b4ae9f13f7ce0ae0f123c80b2c [1,1,0,0,0,0|1,0,1]=4 4941 B15R1.33 O=CC(OCCCCF)c1ccccc1 4abf8369a60b92aa417d59ada200868d [1,1,0,0,0,0|1,0,1]=4 4942 B15R1.89 C=C(COC(C)CCC)c1ccccc1 7f542c409f64c2fd00e1b323552ac641 [1,1,0,0,0,0|2,0,0]=4 4943 B15R1.89 CC(CCO)CNC(=O)c1ccccc1 059a838897a6c7b4416ab0e031b3e755 [1,1,0,0,0,0|2,0,0]=4 4944 B15R1.89 CC(CCO)NCC(=O)c1ccccc1 1722ba932400f48651c5ab38f1cb6510 [1,1,0,0,0,0|2,0,0]=4 4945 B15R1.89 CCCC(=O)NCC(=O)c1ccccc1 319872d35a642997a1bde124d017e046 [1,1,0,0,0,0|1,0,1]=4 4946 B15R1.89 CCCC(=S)OCC(=O)c1ccccc1 378e0d4b321dd3bb2dc64eba37c8e93a [1,1,0,0,0,0|1,0,1]=4 4947 B15R1.89 CCCC(C)COC(C)c1ccccc1 3a6aec960130c47c02aacd5245c58f91 [1,1,0,0,0,0|1,0,1]=4 4948 B15R1.89 CCCC(C)CO[C@@H](C)c1ccccc1 eda51bff79c0055e663114b4d91fe4be [1,1,0,0,0,0|1,0,1]=4 4949 B15R1.89 CCCC(C)CO[C@H](C)c1ccccc1 b9852c68e934fdaefe42093ab3a92ecb [1,1,0,0,0,0|1,0,1]=4 4950 B15R1.89 CCCC(C)NCC(=O)c1ccccc1 31898c4b72a47278462be1dcfb7abec2 [1,1,0,0,0,0|1,0,0]=3 4951 B15R1.89 CCCC(C)NCC(=O)c1ccccn1 f9676618c86708b55f3b0e9820cc855f [1,1,0,0,0,0|2,0,0]=4 4952 B15R1.89 CCCC(C)NCC(=O)c1cccnc1 8f5774abc1a2992d2f3665107af5c8a1 [1,1,0,0,0,0|2,0,0]=4 4953 B15R1.89 CCCC(C)OCC(=O)c1ccccc1 63ed80b42a06af6df2ce194b7a2beaa3 [1,1,0,0,0,0|1,0,0]=3 4954 B15R1.89 CCCC(C)OCC(=O)c1ccccn1 df4d43604117b238425fc736eae7db1e [1,1,0,0,0,0|2,0,0]=4 4955 B15R1.89 CCCC(C)OCC(=O)c1cccnc1 bf30198bd8caa3d4238fc180396cbf8c [1,1,0,0,0,0|2,0,0]=4 4956 B15R1.89 CCCC(O)CNC(=O)c1ccccc1 a9c85f96e4081437978f3eb5d23837be [1,1,0,0,0,0|1,0,0]=3 4957 B15R1.89 CCCC(O)CNC(=O)c1ccccn1 9e687181a4ae07c26e4de22aaf6d53ee [1,1,0,0,0,0|2,0,0]=4 4958 B15R1.89 CCCC(O)CNC(=O)c1cccnc1 8e790c63469bd269e3e591d4aa1f07d9 [1,1,0,0,0,0|2,0,0]=4 4959 B15R1.89 CCCC(O)CNC(=O)c1ccncc1 c49f7bca7931c267a11bd19e682feebb [1,1,0,0,0,0|2,0,0]=4 4960 B15R1.89 CCCN(C)CCS(=O)c1ccccc1 45177aa1437fe71466768cdac99b1eea [1,1,0,0,0,0|2,0,0]=4 4961 B15R1.89 CCCN(C)COC(=O)c1ccccc1 9e627ea1d93df9d447c1d99b9ff49bff [1,1,0,0,0,0|1,0,0]=3 4962 B15R1.89 CCC[C@@H](C)OCC(=O)c1ccccn1 aea248b10bd78da736752a26d7ba799c [1,1,0,0,0,0|2,0,0]=4 4963 B15R1.89 CCC[C@@H](C)OCC(=O)c1cccnc1 06c45abf06b5ee34f1cf130aeea7e1ec [1,1,0,0,0,0|2,0,0]=4 4964 B15R1.89 CCC[C@H](C)NCC(=O)c1ccccc1 ce1d18b0e70da40b8ca0b308e4a65c0d [1,1,0,0,0,0|1,0,0]=3 4965 B15R1.89 CCC[C@H](C)NCC(=O)c1ccccn1 f621baad0cffcf8a9a61eed53176553c [1,1,0,0,0,0|2,0,0]=4 4966 B15R1.89 CCC[C@H](C)NCC(=O)c1cccnc1 8c1544b610ab5cc2584d951bdfe41a7c [1,1,0,0,0,0|2,0,0]=4 4967 B15R1.89 CCC[C@H](C)OCC(=O)c1ccccn1 22677d891695347ce8fce8b27dc39b49 [1,1,0,0,0,0|2,0,0]=4 4968 B15R1.89 CCC[C@H](C)OCC(=O)c1cccnc1 b78a6d305d52c97ae4461a97f4e3a376 [1,1,0,0,0,0|2,0,0]=4 4969 B15R1.89 CCOC(C)CNC(=O)c1ccccc1 6d01f9583711abc146311aba66c1e2c3 [1,1,0,0,0,0|2,0,0]=4 4970 B15R1.89 CN(CCF)COC(=O)c1ccccc1 fd816a1ed3b873eecf42633b334ad7f7 [1,1,0,0,0,0|2,0,0]=4 4971 B15R1.89 CN(CCO)COC(=O)c1ccccc1 a2ca3b93b3fc1c26447e1fbc5da26dd2 [1,1,0,0,0,0|2,0,0]=4 4972 B15R1.89 COCC(C)NCC(=O)c1ccccc1 a012ec3c9cc6a2a04d82e36eefdcdffe [1,1,0,0,0,0|2,0,0]=4 4973 B15R1.89 COCC(C)OCC(=O)c1ccccc1 fedcb927c95eef46367634d903bc1a76 [1,1,0,0,0,0|2,0,0]=4 4974 B15R1.89 COCC(O)CNC(=O)c1ccccc1 7442be1d849fd7e2e522c6786c7b5d44 [1,1,0,0,0,0|2,0,0]=4 4975 B15R1.89 COC[C@@H](C)NCC(=O)c1ccccc1 46a7f661fe0009ca3db2601c69e5517a [1,1,0,0,0,0|2,0,0]=4 4976 B15R1.89 COC[C@@H](C)OCC(=O)c1ccccc1 01a3859c0c6d3aab1713c5e28ae609f4 [1,1,0,0,0,0|2,0,0]=4 4977 B15R1.89 COC[C@@H](O)CNC(=O)c1ccccc1 4d0b168c50ec50fbe7afb2eaddc7a855 [1,1,0,0,0,0|2,0,0]=4 4978 B15R1.89 COC[C@H](C)NCC(=O)c1ccccc1 8a989ebabc3d056016c4c8e1d9ba92c3 [1,1,0,0,0,0|2,0,0]=4 4979 B15R1.89 COC[C@H](C)OCC(=O)c1ccccc1 e98d31773fa615768d958b1c3366f179 [1,1,0,0,0,0|2,0,0]=4 4980 B15R1.89 CSCC(C)OCC(=O)c1ccccc1 fad75901d39914b3c968cc45958ec718 [1,1,0,0,0,0|2,0,0]=4 4981 B15R1.89 C[C@@H](CCO)NCC(=O)c1ccccc1 21359469d352aa0e42b63a8eccacdf6e [1,1,0,0,0,0|2,0,0]=4 4982 B15R1.89 C[C@H](CCO)NCC(=O)c1ccccc1 69f72f09d51951604d472fc823108758 [1,1,0,0,0,0|2,0,0]=4 4983 B15R1.93 CCCCCN(C)C(=O)c1ccccc1 c6ffe640984401bdec67141629bf3c63 [1,1,0,0,0,0|1,0,0]=3 4984 B15R1.93 CCCCCN(C)C(=O)c1ccccn1 58a096aa106abd53b7b4579c11d0504d [1,1,0,0,0,0|2,0,0]=4 4985 B15R1.93 CCCCCN(C)C(=O)c1cccnc1 db80f5efe14e2e41b7e6f5fe73b02521 [1,1,0,0,0,0|2,0,0]=4 4986 B15R1.93 CCCCCN(C)C(=O)c1ccncc1 43f7b6690e21366ff108b7516a7449e0 [1,1,0,0,0,0|2,0,0]=4 4987 B15R1.93 CCCCNC(=O)C(=O)c1ccccc1 e5f1a260c934b126c5be96cf3d6e0c93 [1,1,0,0,0,0|1,0,1]=4 4988 B15R1.93 CCOCCN(C)C(=O)c1ccccc1 db52527326bf984cd29e9654596db7c3 [1,1,0,0,0,0|2,0,0]=4 4989 B15R1.93 CN(CCCCO)C(=O)c1ccccc1 c5a145d88b0173e95c4748f363966a28 [1,1,0,0,0,0|2,0,0]=4 4990 B15R1.93 COCCCN(C)C(=O)c1ccccc1 c507e36389191361c69f9badfd1d03a4 [1,1,0,0,0,0|2,0,0]=4 4991 B15R1.115 CC(CCCO)NC(=O)c1ccccc1 8ac1f8e54b3e69dd4991e47bb5588cdd [1,1,0,0,0,0|2,0,0]=4 4992 B15R1.115 CCCCC(C)NC(=O)c1ccccc1 db7f1c631979810fa866cfea2616cf7e [1,1,0,0,0,0|1,0,0]=3 4993 B15R1.115 CCCCC(C)NC(=O)c1ccccn1 d37cb5cece4dadbc4208f267f4be1f34 [1,1,0,0,0,0|2,0,0]=4 4994 B15R1.115 CCCCC(C)NC(=O)c1cccnc1 a4041f0c5481a5eb7a4dbb6eec6edc2d [1,1,0,0,0,0|2,0,0]=4 4995 B15R1.115 CCCCC(C)NC(=O)c1ccncc1 9f222edc590e306bf7af56e5a3117e7f [1,1,0,0,0,0|2,0,0]=4 4996 B15R1.115 CCCCC(C)OC(C)c1ccccc1 d9582c27bf558a2cc9988699a0c23f9d [1,1,0,0,0,0|1,0,1]=4 4997 B15R1.115 CCCCC(C)O[C@@H](C)c1ccccc1 d7fb20d9911ea2bd497aa6114c6e3988 [1,1,0,0,0,0|1,0,1]=4 4998 B15R1.115 CCCCC(C)O[C@H](C)c1ccccc1 33f285c169d12bdb56ddd3a0fb2a89c2 [1,1,0,0,0,0|1,0,1]=4 4999 B15R1.115 CCCCN(C)CC(=O)c1ccccc1 efc939817a7794b4f6ab26b010e86235 [1,1,0,0,0,0|1,0,0]=3 5000 B15R1.115 CCCCN(C)CC(=O)c1ccccn1 9d0f7d44c25dafae2293668a591d94ec [1,1,0,0,0,0|2,0,0]=4 5001 B15R1.115 CCCCN(C)CC(=O)c1cccnc1 cb0591c98a77ea2decb00c2ee89f056a [1,1,0,0,0,0|2,0,0]=4 5002 B15R1.115 CCCC[C@@H](C)NC(=O)c1ccccc1 37ae854939a2728d8ec211d805fe0331 [1,1,0,0,0,0|1,0,0]=3 5003 B15R1.115 CCCC[C@@H](C)NC(=O)c1ccccn1 eca995d29a79f7c9a37249312f04c1f5 [1,1,0,0,0,0|2,0,0]=4 5004 B15R1.115 CCCC[C@@H](C)NC(=O)c1cccnc1 7bdd9ba6561f3545cb29ac6954f79ae9 [1,1,0,0,0,0|2,0,0]=4 5005 B15R1.115 CCCC[C@@H](C)NC(=O)c1ccncc1 ef6e1fe255f33c82907d930a75b96211 [1,1,0,0,0,0|2,0,0]=4 5006 B15R1.115 CN(CCCO)CC(=O)c1ccccc1 23acdf68643cb2d3e596be81c50406d8 [1,1,0,0,0,0|2,0,0]=4 5007 B15R1.115 COCCN(C)CC(=O)c1ccccc1 586673e74610fbccc9b4eff1e4b05c6b [1,1,0,0,0,0|2,0,0]=4 5008 B15R1.115 CSCCN(C)CC(=O)c1ccccc1 5829ceb3e0da6995f8f912b65780229d [1,1,0,0,0,0|2,0,0]=4 5009 B15R1.115 C[C@H](CCCO)NC(=O)c1ccccc1 49433d2f465e0195d9d36e08f9f4c949 [1,1,0,0,0,0|2,0,0]=4 5010 B15R1.497 C=C(C)CCNCC(=O)c1ccccc1 883066acff50cef2d46b25687c62935b [1,1,0,0,0,0|1,0,1]=4 5011 B15R1.497 C=C(C)CCOCC(=O)c1ccccc1 7cc1af31418cb5952765ba2d69e7b856 [1,1,0,0,0,0|1,0,1]=4 5012 B15R1.497 C=C(C)COCCC(=O)c1ccccc1 af0f8dcd3ab1ed82131eb2736286be29 [1,1,0,0,0,0|1,0,1]=4 5013 B15R1.497 C=C(C)COCOC(=O)c1ccccc1 8bc47fb4ff9df2a7d355be92697ae8f2 [1,1,0,0,0,0|1,0,1]=4 5014 B15R1.497 C=C(CNCCC(C)O)c1ccccc1 2c9fd5479f64cc6d1935a23142caa682 [1,1,0,0,0,0|2,0,0]=4 5015 B15R1.497 C=C(CNCC[C@@H](C)O)c1ccccc1 a459ea69a9028626072d56dbbbd21d7b [1,1,0,0,0,0|2,0,0]=4 5016 B15R1.497 C=C(CNCC[C@H](C)O)c1ccccc1 d28995d04dde26cdff3b80375205f477 [1,1,0,0,0,0|2,0,0]=4 5017 B15R1.497 C=C(COCCC(C)C)c1ccccc1 bef5aab22deb356465ef37902f17a1a6 [1,1,0,0,0,0|2,0,0]=4 5018 B15R1.497 CC(=O)CCNCC(=O)c1ccccc1 e58dc9fde917955221ca432367082470 [1,1,0,0,0,0|1,0,1]=4 5019 B15R1.497 CC(=O)CCOCC(=O)c1ccccc1 3ab3fe999d85c2cabb284e4f5c5f1c2e [1,1,0,0,0,0|1,0,1]=4 5020 B15R1.497 CC(=O)CNCOC(=O)c1ccccc1 38612a83526ef99d7fb0ea93777c4f20 [1,1,0,0,0,0|1,0,1]=4 5021 B15R1.497 CC(=O)COCOC(=O)c1ccccc1 31cc19ae6a9d37d21f4c208ed95d6c50 [1,1,0,0,0,0|1,0,1]=4 5022 B15R1.497 CC(C)CCCCN(C)c1ccccc1 4b7cfa2723e9d160675d1246233f794b [1,1,0,0,0,0|2,0,0]=4 5023 B15R1.497 CC(C)CCCNC(=O)c1ccccc1 90385639d1ac6a463e8e483175131f5c [1,1,0,0,0,0|1,0,0]=3 5024 B15R1.497 CC(C)CCCNC(=O)c1ccccn1 d1dbb2f70117961e8132655e183ae924 [1,1,0,0,0,0|2,0,0]=4 5025 B15R1.497 CC(C)CCCNC(=O)c1cccnc1 d8677125cc2be7cb80b08f88a91a3940 [1,1,0,0,0,0|2,0,0]=4 5026 B15R1.497 CC(C)CCCNC(=O)c1ccncc1 81a3e1eec80101e840bdfc36d9a74259 [1,1,0,0,0,0|2,0,0]=4 5027 B15R1.497 CC(C)CCCOC(C)c1ccccc1 18a20561dab6d7e93d7a0ef0793de36d [1,1,0,0,0,0|1,0,1]=4 5028 B15R1.497 CC(C)CCCO[C@@H](C)c1ccccc1 f81ac650823b557acc05e49df4d82644 [1,1,0,0,0,0|1,0,1]=4 5029 B15R1.497 CC(C)CCCO[C@H](C)c1ccccc1 8ac83efbffcc66b3264dfa0ec00325e9 [1,1,0,0,0,0|1,0,1]=4 5030 B15R1.497 CC(C)CCNCC(=O)c1ccccc1 2892a515a27dc21ce732cb4584b6f482 [1,1,0,0,0,0|1,0,0]=3 5031 B15R1.497 CC(C)CCNCC(=O)c1ccccn1 d2e193f789acbe81ab053b1a79a7cf18 [1,1,0,0,0,0|2,0,0]=4 5032 B15R1.497 CC(C)CCNCC(=O)c1cccnc1 40b8d14370b0b314106e5df80ecb7412 [1,1,0,0,0,0|2,0,0]=4 5033 B15R1.497 CC(C)CCOCC(=O)c1ccccc1 060a208c76e923686c7a9c524519b641 [1,1,0,0,0,0|1,0,0]=3 5034 B15R1.497 CC(C)CCOCC(=O)c1ccccn1 3b0b79b84aecd798a694dd5f99059e43 [1,1,0,0,0,0|2,0,0]=4 5035 B15R1.497 CC(C)CCOCC(=O)c1cccnc1 2b4ad43b6672cb0a260c0496536ef0ad [1,1,0,0,0,0|2,0,0]=4 5036 B15R1.497 CC(C)CNCOC(=O)c1ccccc1 820ab4fff1043b585252e53374e8dfe2 [1,1,0,0,0,0|1,0,0]=3 5037 B15R1.497 CC(C)COCCC(=O)c1ccccc1 8f55313cacec9868a20c52c8fc4134e0 [1,1,0,0,0,0|1,0,0]=3 5038 B15R1.497 CC(C)COCCS(=O)c1ccccc1 f2705754673c9a6cbf38d6db6269390f [1,1,0,0,0,0|2,0,0]=4 5039 B15R1.497 CC(C)COCNC(=O)c1ccccc1 95d9b9f14c7d865f8d18db498cdc34ad [1,1,0,0,0,0|2,0,0]=4 5040 B15R1.497 CC(C)COCOC(=O)c1ccccc1 6d40fff42ff46adab51fbbf99073758f [1,1,0,0,0,0|1,0,0]=3 5041 B15R1.497 CC(C)OCCCC(=O)c1ccccc1 c86724cd0205b1319764c5f43df05965 [1,1,0,0,0,0|1,0,0]=3 5042 B15R1.497 CC(C)OCCCC(=O)c1cccnc1 47f7c6183a85f312733374e8134d5d45 [1,1,0,0,0,0|2,0,0]=4 5043 B15R1.497 CC(C)OCCNC(=O)c1ccccc1 dac449b333da6163ff8eee523b28ef92 [1,1,0,0,0,0|2,0,0]=4 5044 B15R1.497 CC(C)OCCOC(=O)c1ccccc1 56a2ff31eaee22470d9bb7195d65d92e [1,1,0,0,0,0|1,0,0]=3 5045 B15R1.497 CC(C)OCCOC(=O)c1cccnc1 f5172d3937e31f885d92b2c23c13ff97 [1,1,0,0,0,0|2,0,0]=4 5046 B15R1.497 CC(C)OCNCC(=O)c1ccccc1 b45c71b3d313a690cc01f77c83a99fc8 [1,1,0,0,0,0|2,0,0]=4 5047 B15R1.497 CC(C)OCOCC(=O)c1ccccc1 2b0395ca0ab0af27eae3e845beecf7bc [1,1,0,0,0,0|2,0,0]=4 5048 B15R1.497 CC(F)COCOC(=O)c1ccccc1 2fbe2014f57dfd0470b0acd39170fcb8 [1,1,0,0,0,0|1,0,0]=3 5049 B15R1.497 CC(O)CCNCC(=O)c1ccccc1 b33301a1d3332e20598a425712c7db50 [1,1,0,0,0,0|1,0,0]=3 5050 B15R1.497 CC(O)CCNCC(=O)c1ccccn1 1c0113f33f5ae3a908aa321edf2d477c [1,1,0,0,0,0|2,0,0]=4 5051 B15R1.497 CC(O)CCNCC(=O)c1cccnc1 e3348b142b280ab487523524c6818de6 [1,1,0,0,0,0|2,0,0]=4 5052 B15R1.497 CC(O)CNCOC(=O)c1ccccc1 5809e95059ea995f91ab67ae0668db64 [1,1,0,0,0,0|1,0,0]=3 5053 B15R1.497 CC(S)COCOC(=O)c1ccccc1 91ea3644e6a003224d614e78b4752830 [1,1,0,0,0,0|1,0,0]=3 5054 B15R1.497 CN(C)CCCNC(=O)c1ccccc1 4d7ca42e1c4aeccf8669b6e0b429a5c7 [1,1,0,0,0,0|2,0,0]=4 5055 B15R1.497 CN(C)CCNCC(=O)c1ccccc1 370f8e01ea79730981f4dc3f56534ede [1,1,0,0,0,0|2,0,0]=4 5056 B15R1.497 CN(C)CCOCC(=O)c1ccccc1 67e20436ca6cdb4200f13588292f92fa [1,1,0,0,0,0|2,0,0]=4 5057 B15R1.497 CN(C)COCCC(=O)c1ccccc1 cb7d0c6a7d0efe3a2aac0287ed252fe8 [1,1,0,0,0,0|2,0,0]=4 5058 B15R1.497 CS(=O)CCCNC(=O)c1ccccc1 a01358b92e655f0e797f515e5f16cdf1 [1,1,0,0,0,0|2,0,0]=4 5059 B15R1.497 CS(=O)CCNCC(=O)c1ccccc1 f20a47cdf9e00300148e27235d9b5dc3 [1,1,0,0,0,0|2,0,0]=4 5060 B15R1.497 CS(=O)CCOCC(=O)c1ccccc1 a6d1803757f85a0b6151bb39c4b0f4d7 [1,1,0,0,0,0|2,0,0]=4 5061 B15R1.497 C[C@@H](F)COCOC(=O)c1ccccc1 e6aace2cb51d4a193f2e37c80b78d688 [1,1,0,0,0,0|1,0,0]=3 5062 B15R1.497 C[C@@H](O)CCNCC(=O)c1ccccc1 130a323ae6de79952d80e2b8bf2aff6e [1,1,0,0,0,0|1,0,0]=3 5063 B15R1.497 C[C@@H](O)CCNCC(=O)c1ccccn1 cc12a9bec54edc60ce18322c0e697bad [1,1,0,0,0,0|2,0,0]=4 5064 B15R1.497 C[C@@H](O)CCNCC(=O)c1cccnc1 7e1e01d353c6d8f8e747145e1a8a28b6 [1,1,0,0,0,0|2,0,0]=4 5065 B15R1.497 C[C@@H](O)CNCOC(=O)c1ccccc1 4e448c29a1a64554e572f624372d724a [1,1,0,0,0,0|1,0,0]=3 5066 B15R1.497 C[C@H](F)COCOC(=O)c1ccccc1 876d10c5372cef8ebcbb1affca47a311 [1,1,0,0,0,0|1,0,0]=3 5067 B15R1.497 C[C@H](O)CCNCC(=O)c1ccccc1 7d93ff31e71ce8f1bd1dfc5d79b9c722 [1,1,0,0,0,0|1,0,0]=3 5068 B15R1.497 C[C@H](O)CCNCC(=O)c1ccccn1 d42e0451b71c13fccb654b0a48c33e81 [1,1,0,0,0,0|2,0,0]=4 5069 B15R1.497 C[C@H](O)CCNCC(=O)c1cccnc1 70127ef512f5de3182e2e8ed643df9e7 [1,1,0,0,0,0|2,0,0]=4 5070 B15R1.497 C[C@H](O)CNCOC(=O)c1ccccc1 1c46f96e94eb6b4c024cd40276e9e663 [1,1,0,0,0,0|1,0,0]=3 5071 B15R1.497 O=C(CCOCC(F)F)c1ccccc1 76776a7c27679357e3b4fd374d6c13fa [1,1,0,0,0,0|2,0,0]=4 5072 B15R1.497 O=C(CNCCC(F)F)c1ccccc1 111ff2319701fb868910fc6fc5cffc00 [1,1,0,0,0,0|2,0,0]=4 5073 B15R1.497 O=C(COCCC(F)F)c1ccccc1 f948b135bca52b5299c08351b0bfc03c [1,1,0,0,0,0|2,0,0]=4 5074 B15R1.497 O=C(OCNCC(F)F)c1ccccc1 4a338d8cbce66840e94fe6f3663e46bd [1,1,0,0,0,0|2,0,0]=4 5075 B15R1.497 O=C(OCOCC(F)F)c1ccccc1 a37fe3f5d93db211c3b3a510e8f25d4c [1,1,0,0,0,0|2,0,0]=4 5076 B15R1.536 CCCCCOC(C)(C)c1ccccc1 db363b2039f226e4bb03b6f3f383b374 [1,1,0,0,0,0|1,0,1]=4 5077 B15R1.536 CCCCNCS(=O)(=O)c1ccccc1 67a5974a1271526416070e6a51f7abc1 [1,1,0,0,0,0|2,0,0]=4 5078 B15R1.536 CCCCOCS(=O)(=O)c1ccccc1 6f08d8ef8d14ee12510d5f19dba0ef1c [1,1,0,0,0,0|2,0,0]=4 5079 B15R1.536 CCCNCCS(=O)(=O)c1ccccc1 6f4a00c7846876d246de5ee29a2f09ce [1,1,0,0,0,0|2,0,0]=4 5080 B15R1.536 CCCOCCS(=O)(=O)c1ccccc1 19d114570c2415b7790cf90066cce620 [1,1,0,0,0,0|2,0,0]=4 5081 B15R1.536 CCOCCCS(=O)(=O)c1ccccc1 d820b194484e3ddd0c1e3e96bec8b9d0 [1,1,0,0,0,0|2,0,0]=4 5082 B15R1.536 CCOCCOS(=O)(=O)c1ccccc1 97959a3503ed27f8cb6570721720c8a3 [1,1,0,0,0,0|2,0,0]=4 5083 B15R1.959 C=C(CC)CNCC(=O)c1ccccc1 3ec331c4c01ab045ae9ef698a51c8ebe [1,1,0,0,0,0|1,0,1]=4 5084 B15R1.959 C=C(CC)COCC(=O)c1ccccc1 b0aaa8d30738467a0355c46008a331e7 [1,1,0,0,0,0|1,0,1]=4 5085 B15R1.959 C=C(COCC(C)CC)c1ccccc1 1ef11038c99d8a8ecab6a693c2fb198d [1,1,0,0,0,0|2,0,0]=4 5086 B15R1.959 C=C(COC[C@@H](C)CC)c1ccccc1 413a972a7659e32cf1bb5ee6fca62540 [1,1,0,0,0,0|2,0,0]=4 5087 B15R1.959 C=C(COC[C@H](C)CC)c1ccccc1 14b13eff9cb5f79fa7f4c9be005065c2 [1,1,0,0,0,0|2,0,0]=4 5088 B15R1.959 CC(CF)OCOC(=O)c1ccccc1 189578fae4f508db1b8507d1803bbd50 [1,1,0,0,0,0|2,0,0]=4 5089 B15R1.959 CC(CO)CCNC(=O)c1ccccc1 961cb4ac5c019eb5aee1947889364d25 [1,1,0,0,0,0|2,0,0]=4 5090 B15R1.959 CC(CO)CNCC(=O)c1ccccc1 172ffa582e41f3128be0d57185deae99 [1,1,0,0,0,0|2,0,0]=4 5091 B15R1.959 CC(CO)NCOC(=O)c1ccccc1 a162805d2c216d837c0abffc39238580 [1,1,0,0,0,0|2,0,0]=4 5092 B15R1.959 CCC(=O)CNCC(=O)c1ccccc1 1bbc0668bb6515df7ef96cc49eff3dcf [1,1,0,0,0,0|1,0,1]=4 5093 B15R1.959 CCC(=O)COCC(=O)c1ccccc1 8ba8283f8bed04bb8586bbdf2c56327c [1,1,0,0,0,0|1,0,1]=4 5094 B15R1.959 CCC(C)CCNC(=O)c1ccccc1 4e7911fb2d1e7dffbc088bee6aebf235 [1,1,0,0,0,0|1,0,0]=3 5095 B15R1.959 CCC(C)CCNC(=O)c1ccccn1 99f65b40d30c7d648ffdc0b34d5416e4 [1,1,0,0,0,0|2,0,0]=4 5096 B15R1.959 CCC(C)CCNC(=O)c1cccnc1 04532dea4663d252b4b46cc275fb475b [1,1,0,0,0,0|2,0,0]=4 5097 B15R1.959 CCC(C)CCNC(=O)c1ccncc1 7ae59e454c2c143d379a6abced97ac66 [1,1,0,0,0,0|2,0,0]=4 5098 B15R1.959 CCC(C)CCOC(C)c1ccccc1 33cac763a8283f636dd16eddda362b30 [1,1,0,0,0,0|1,0,1]=4 5099 B15R1.959 CCC(C)CCO[C@@H](C)c1ccccc1 c6ef88c191d025ee68af4543643b88f5 [1,1,0,0,0,0|1,0,1]=4 5100 B15R1.959 CCC(C)CCO[C@H](C)c1ccccc1 abb7931ab6a8705db13fd02c5f9ca61c [1,1,0,0,0,0|1,0,1]=4 5101 B15R1.959 CCC(C)CNCC(=O)c1ccccc1 cdc8f65fa1ad420ef28123d2dfacd68e [1,1,0,0,0,0|1,0,0]=3 5102 B15R1.959 CCC(C)CNCC(=O)c1ccccn1 0b276161a39cdca032c667cbca469ad4 [1,1,0,0,0,0|2,0,0]=4 5103 B15R1.959 CCC(C)CNCC(=O)c1cccnc1 955f87799b4470dd1f3711ad0e17b78a [1,1,0,0,0,0|2,0,0]=4 5104 B15R1.959 CCC(C)COCC(=O)c1ccccc1 6e0be115fd5d7a79a0e830a3e5a5d45a [1,1,0,0,0,0|1,0,0]=3 5105 B15R1.959 CCC(C)COCC(=O)c1ccccn1 ba52f9dbfc4eb49f5dbddc2dcd006fa1 [1,1,0,0,0,0|2,0,0]=4 5106 B15R1.959 CCC(C)COCC(=O)c1cccnc1 0466a1f46e435e603a5f955ca79bf772 [1,1,0,0,0,0|2,0,0]=4 5107 B15R1.959 CCC(C)NCOC(=O)c1ccccc1 beae0b453ac5fdbc6100b1c2eb70711d [1,1,0,0,0,0|1,0,0]=3 5108 B15R1.959 CCC(C)OCCC(=O)c1ccccc1 3b984de76a78cda9b3bce093e2ffea04 [1,1,0,0,0,0|1,0,0]=3 5109 B15R1.959 CCC(C)OCCS(=O)c1ccccc1 bba29bae64176ae9dadf06e521568cc7 [1,1,0,0,0,0|2,0,0]=4 5110 B15R1.959 CCC(C)OCNC(=O)c1ccccc1 094bfc2195366ddc50f2380f0c4641e7 [1,1,0,0,0,0|2,0,0]=4 5111 B15R1.959 CCC(O)CNCC(=O)c1ccccc1 f290b098a9b7ae6beb8e5da0d48abcad [1,1,0,0,0,0|1,0,0]=3 5112 B15R1.959 CCC(O)CNCC(=O)c1ccccn1 7fc6a729917c22e5af5d4f3d0ec6d775 [1,1,0,0,0,0|2,0,0]=4 5113 B15R1.959 CCC(O)CNCC(=O)c1cccnc1 63ca0de606809c401d0a8a59df86766a [1,1,0,0,0,0|2,0,0]=4 5114 B15R1.959 CCN(C)CCOC(=O)c1ccccc1 c8c155651adaf7773bbbb576fb24cdf2 [1,1,0,0,0,0|1,0,0]=3 5115 B15R1.959 CC[C@@H](C)CNCC(=O)c1ccccc1 6f029c905a9ec1dd11394f0bc7105f68 [1,1,0,0,0,0|1,0,0]=3 5116 B15R1.959 CC[C@@H](C)COCC(=O)c1ccccc1 90ddab7ffb5154b2aab548fc22763f64 [1,1,0,0,0,0|1,0,0]=3 5117 B15R1.959 CC[C@@H](C)COCC(=O)c1ccccn1 afd3454ab6943e6dee8e1b3d63d316fc [1,1,0,0,0,0|2,0,0]=4 5118 B15R1.959 CC[C@@H](C)COCC(=O)c1cccnc1 c335084b5d9db52583263c8f855f9eb3 [1,1,0,0,0,0|2,0,0]=4 5119 B15R1.959 CC[C@@H](C)NCOC(=O)c1ccccc1 cf401faee7f52f3e2f46735b38f22d71 [1,1,0,0,0,0|1,0,0]=3 5120 B15R1.959 CC[C@@H](O)CNCC(=O)c1ccccc1 2f3eeb5dd789f54a245735cbcace9db4 [1,1,0,0,0,0|1,0,0]=3 5121 B15R1.959 CC[C@@H](O)CNCC(=O)c1ccccn1 0e7a1777514da85402b5f69b5d68792f [1,1,0,0,0,0|2,0,0]=4 5122 B15R1.959 CC[C@@H](O)CNCC(=O)c1cccnc1 684e34eab9b53671d25f14b4db1e5518 [1,1,0,0,0,0|2,0,0]=4 5123 B15R1.959 CC[C@H](C)CNCC(=O)c1ccccc1 8d8e1984d10860f4d972d6863382d9f7 [1,1,0,0,0,0|1,0,0]=3 5124 B15R1.959 CC[C@H](C)CNCC(=O)c1ccccn1 d05ad82a8e5e9f8338be6d5ee6ec3eb8 [1,1,0,0,0,0|2,0,0]=4 5125 B15R1.959 CC[C@H](C)CNCC(=O)c1cccnc1 2a23e85a5299c05832f2e6d2e262977a [1,1,0,0,0,0|2,0,0]=4 5126 B15R1.959 CC[C@H](C)COCC(=O)c1ccccc1 00ec6afb34592e340fa825d7e64ecd03 [1,1,0,0,0,0|1,0,0]=3 5127 B15R1.959 CC[C@H](C)COCC(=O)c1ccccn1 f2171766a7af612119cdf3995d2e35b5 [1,1,0,0,0,0|2,0,0]=4 5128 B15R1.959 CC[C@H](C)COCC(=O)c1cccnc1 38892799a29016c8d1884d5f6f9b00b7 [1,1,0,0,0,0|2,0,0]=4 5129 B15R1.959 CC[C@H](C)NCOC(=O)c1ccccc1 873f189dec7fda0f1df2676c1450da1e [1,1,0,0,0,0|1,0,0]=3 5130 B15R1.959 COC(C)CNCC(=O)c1ccccc1 bd49401b7c5a9887b6d8e7d8b259ddac [1,1,0,0,0,0|2,0,0]=4 5131 B15R1.959 COC(C)COCC(=O)c1ccccc1 9cdb6a106155c99b6ff870e5d6d95285 [1,1,0,0,0,0|2,0,0]=4 5132 B15R1.959 CO[C@@H](C)CNCC(=O)c1ccccc1 d6920b665e3bce71dbef6329723eba7d [1,1,0,0,0,0|2,0,0]=4 5133 B15R1.959 CO[C@@H](C)COCC(=O)c1ccccc1 d25195b87b6ead1729fce1288587d820 [1,1,0,0,0,0|2,0,0]=4 5134 B15R1.959 CO[C@H](C)CNCC(=O)c1ccccc1 6893b73afd83dbee8abce7b895df9d9f [1,1,0,0,0,0|2,0,0]=4 5135 B15R1.959 CO[C@H](C)COCC(=O)c1ccccc1 8e63c0aefb2f9b2c01cf3d0b2805c992 [1,1,0,0,0,0|2,0,0]=4 5136 B15R1.959 C[C@@H](CO)CCNC(=O)c1ccccc1 a48938c704df80eb791680b11734cfe0 [1,1,0,0,0,0|2,0,0]=4 5137 B15R1.959 C[C@@H](CO)CNCC(=O)c1ccccc1 9727c5aaf1714958fbe92bba26e3ae9e [1,1,0,0,0,0|2,0,0]=4 5138 B15R1.959 C[C@@H](CO)NCOC(=O)c1ccccc1 bb671c7ef6f3ea63d04d7b84374e559d [1,1,0,0,0,0|2,0,0]=4 5139 B15R1.959 C[C@H](CO)CNCC(=O)c1ccccc1 3c7b3cb48df6ee03074e836c4d33832a [1,1,0,0,0,0|2,0,0]=4 5140 B15R1.959 C[C@H](CO)NCOC(=O)c1ccccc1 3c3af47ea8d5b73220cba666a7a4dc4a [1,1,0,0,0,0|2,0,0]=4 5141 B15R1.959 O=C(CNCC(Br)CBr)c1ccccc1 90823c786c41df7845cea53dd72d6e3a [1,1,0,0,0,0|2,0,0]=4 5142 B15R1.959 O=C(CNCC(F)CO)c1ccccc1 ba72113ee81aef46de8c6fea3567171f [1,1,0,0,0,0|2,0,0]=4 5143 B15R1.959 O=C(CNCC(O)CF)c1ccccc1 fcc1ccb676f8a17afcb499e44795e781 [1,1,0,0,0,0|2,0,0]=4 5144 B15R1.959 O=C(CNCC(O)CO)c1ccccc1 dbf62a8176e30cb85edaa601d109b482 [1,1,0,0,0,0|2,0,0]=4 5145 B15R1.959 O=C(CNC[C@@H](F)CO)c1ccccc1 3901134aa81a75759280ba50fc187c49 [1,1,0,0,0,0|2,0,0]=4 5146 B15R1.959 O=C(CNC[C@@H](O)CO)c1ccccc1 32ac6805161733a7db8db4a246213666 [1,1,0,0,0,0|2,0,0]=4 5147 B15R1.959 O=C(CNC[C@H](F)CO)c1ccccc1 11449ac04e348e444f36a369f5e679f6 [1,1,0,0,0,0|2,0,0]=4 5148 B15R1.959 O=C(CNC[C@H](O)CO)c1ccccc1 a7abd7e0e26b0766b63612bb3dc43796 [1,1,0,0,0,0|2,0,0]=4 5149 B15R1.959 O=C(COCC(Br)CBr)c1ccccc1 7a0f1368a19c1f1a5bdbcbc0595ebd76 [1,1,0,0,0,0|2,0,0]=4 5150 B15R1.959 O=C(COCC(Cl)CCl)c1ccccc1 c3b45b6b598afd6799c28eed383bb7e1 [1,1,0,0,0,0|2,0,0]=4 5151 B15R1.959 O=C(COCC(O)CO)c1ccccc1 4a578cea129dd207d58d75f64791c08c [1,1,0,0,0,0|2,0,0]=4 5152 B15R1.959 O=C(COCC(S)CS)c1ccccc1 c0770661b684c42fc4f8d438f4be098a [1,1,0,0,0,0|2,0,0]=4 5153 B15R1.959 O=C(COC[C@@H](O)CO)c1ccccc1 a4207445c834fe849dd86e907f7fab56 [1,1,0,0,0,0|2,0,0]=4 5154 B15R1.959 O=C(COC[C@H](O)CO)c1ccccc1 1f313506196038022e3891762f5f0dd1 [1,1,0,0,0,0|2,0,0]=4 5155 B15R1.959 O=C(NCCC(O)CO)c1ccccc1 d6a460450cb285c9844457c655ffd416 [1,1,0,0,0,0|2,0,0]=4 5156 B15R1.3965 CCCCCCN(C)c1ccccc1C 52b24e51f9f2cbd28fe81e0763fbdcc6 [1,1,0,0,0,0|2,0,0]=4 5157 B15R1.3965 CCCCCCN(C)c1ccccc1F 070a5c1eba2d2fc745b7c89b6d1871d4 [1,1,0,0,0,0|2,0,0]=4 5158 B15R1.3965 CCCCCNC(=O)c1cccc[n+]1[O-] 430008cfc8009d927527229e29a01e3c [1,1,0,0,0,0|2,0,0]=4 5159 B15R1.3965 CCCCCNC(=O)c1ccccc1Br 4a8d54c0b9d0d201b8a00d81b4d6c609 [1,1,0,0,0,0|1,0,0]=3 5160 B15R1.3965 CCCCCNC(=O)c1ccccc1C 263bbc6e3ee1fe0b09e6053ec5752e2b [1,1,0,0,0,0|1,0,0]=3 5161 B15R1.3965 CCCCCNC(=O)c1ccccc1Cl ed4f26c431eae0516076d45b2e2781ed [1,1,0,0,0,0|1,0,0]=3 5162 B15R1.3965 CCCCCNC(=O)c1ccccc1F c599bf3b9267b445dc838a41cd2f2455 [1,1,0,0,0,0|1,0,0]=3 5163 B15R1.3965 CCCCCNC(=O)c1ccccc1I c57b98beac80aa61f66cc900984ebcf1 [1,1,0,0,0,0|1,0,0]=3 5164 B15R1.3965 CCCCCNC(=O)c1ccccc1O 1c0d0c088cfdfab14636a122636225da [1,1,0,0,0,0|1,0,0]=3 5165 B15R1.3965 CCCCCNC(=O)c1ccccc1S 37c1897d03c92b9d4590f4f7101ffd15 [1,1,0,0,0,0|1,0,0]=3 5166 B15R1.3965 CCCCCNC(=O)c1cccnc1Br 1cc35a2bdca9ca7d22b8ea9c5feb320c [1,1,0,0,0,0|2,0,0]=4 5167 B15R1.3965 CCCCCNC(=O)c1cccnc1C bd35c68a1f7e6a798a38ce05b6d2c7a4 [1,1,0,0,0,0|2,0,0]=4 5168 B15R1.3965 CCCCCNC(=O)c1cccnc1Cl bd7b7d2cf469a8320fe6762f97409346 [1,1,0,0,0,0|2,0,0]=4 5169 B15R1.3965 CCCCCNC(=O)c1cccnc1F 6c001486817ce3c006fc42c482a8f4ed [1,1,0,0,0,0|2,0,0]=4 5170 B15R1.3965 CCCCCNC(=O)c1cccnc1I f0d132002c619cfa9762381cc5942192 [1,1,0,0,0,0|2,0,0]=4 5171 B15R1.3965 CCCCCNC(=O)c1cccnc1O 5cae60622ccec802bbad8643260fe43e [1,1,0,0,0,0|2,0,0]=4 5172 B15R1.3965 CCCCCNC(=O)c1cccnc1S bb1d6def20cd256bf81bc4d3f5a6d564 [1,1,0,0,0,0|2,0,0]=4 5173 B15R1.3965 CCCCCNC(=O)c1ccncc1Br 401505f23b692fd9cb0d16545562c266 [1,1,0,0,0,0|2,0,0]=4 5174 B15R1.3965 CCCCCNC(=O)c1ccncc1C 6df5c1da3759ca4391a39e50a2954480 [1,1,0,0,0,0|2,0,0]=4 5175 B15R1.3965 CCCCCNC(=O)c1ccncc1Cl 9b465067c94d505be14ec3e9cad7f372 [1,1,0,0,0,0|2,0,0]=4 5176 B15R1.3965 CCCCCNC(=O)c1ccncc1F 6b3f053b4a929006533a3161e7c6b12c [1,1,0,0,0,0|2,0,0]=4 5177 B15R1.3965 CCCCCNC(=O)c1ccncc1I 146a7c380bc49b9fa60110f49932405b [1,1,0,0,0,0|2,0,0]=4 5178 B15R1.3965 CCCCCNC(=O)c1ccncc1O c3290cde597fad2a390853c1d9a8df86 [1,1,0,0,0,0|2,0,0]=4 5179 B15R1.3965 CCCCCNC(=O)c1cnccc1Br c026e31147d2d1f304a26ce636e5b218 [1,1,0,0,0,0|2,0,0]=4 5180 B15R1.3965 CCCCCNC(=O)c1cnccc1C c457f4d038c81c2785a5b2670032ab04 [1,1,0,0,0,0|2,0,0]=4 5181 B15R1.3965 CCCCCNC(=O)c1cnccc1Cl fd5d2abccc6ec26f2dc5dcec202bef0f [1,1,0,0,0,0|2,0,0]=4 5182 B15R1.3965 CCCCCNC(=O)c1cnccc1F 0082d648bed98923f68b504138818fca [1,1,0,0,0,0|2,0,0]=4 5183 B15R1.3965 CCCCCNC(=O)c1cnccc1O b5e71500bab858108221ef3ea72961d5 [1,1,0,0,0,0|2,0,0]=4 5184 B15R1.3965 CCCCCNC(=O)c1ncccc1Br bd4c123a01ef660714604ba0681d9b75 [1,1,0,0,0,0|2,0,0]=4 5185 B15R1.3965 CCCCCNC(=O)c1ncccc1C 736bb4c647cc54765e3c23a386ed4cfb [1,1,0,0,0,0|2,0,0]=4 5186 B15R1.3965 CCCCCNC(=O)c1ncccc1Cl 9455a66c67aa956c9b097d80aea5e7f0 [1,1,0,0,0,0|2,0,0]=4 5187 B15R1.3965 CCCCCNC(=O)c1ncccc1F 4246ccdf78572f77279e80ad985a480d [1,1,0,0,0,0|2,0,0]=4 5188 B15R1.3965 CCCCCNC(=O)c1ncccc1I 863e2951dd6f6c47fe2e4241ca080db0 [1,1,0,0,0,0|2,0,0]=4 5189 B15R1.3965 CCCCCNC(=O)c1ncccc1O 82e0ada429577407771983935369c48c [1,1,0,0,0,0|2,0,0]=4 5190 B15R1.3965 CCCCNCC(=O)c1ccccc1C 425b7625746cd08969df2e84c5316e6d [1,1,0,0,0,0|1,0,0]=3 5191 B15R1.3965 CCCCNCC(=O)c1ccccc1Cl 4ca9a2b82e434625c4018116c48444b0 [1,1,0,0,0,0|1,0,0]=3 5192 B15R1.3965 CCCCNCC(=O)c1ccccc1F c87895b44c37de3fc10ebb9c5dcb6b86 [1,1,0,0,0,0|1,0,0]=3 5193 B15R1.3965 CCCCNCC(=O)c1ccccc1I d2b9faf6c2b7f3cab3cab3dac4c9250a [1,1,0,0,0,0|1,0,0]=3 5194 B15R1.3965 CCCCNCC(=O)c1cccnc1Cl 63fce896a0be08969159d8b2519c5bf3 [1,1,0,0,0,0|2,0,0]=4 5195 B15R1.3965 CCCCNCC(=O)c1ncccc1C 91248a3db9a902e19496a1df9477c049 [1,1,0,0,0,0|2,0,0]=4 5196 B15R1.3965 CCCCNCC(=O)c1ncccc1F 6f7abb336c300a92ded9a6a7fa0e4eaf [1,1,0,0,0,0|2,0,0]=4 5197 B15R1.3965 CCCCOCC(=O)c1ccccc1C a5b8e3ffe5a327061fcffd5e8f7348c8 [1,1,0,0,0,0|1,0,0]=3 5198 B15R1.3965 CCCCOCC(=O)c1ccccc1Cl e65367b5d9ba70ebaae86cd101c47517 [1,1,0,0,0,0|1,0,0]=3 5199 B15R1.3965 CCCCOCC(=O)c1ccccc1F f78c94770cb685f67aa76a808dad4946 [1,1,0,0,0,0|1,0,0]=3 5200 B15R1.3965 CCCCOCC(=O)c1ccccc1I b0ad613d72ccd6f66cec640a0a942e27 [1,1,0,0,0,0|1,0,0]=3 5201 B15R1.3965 CCCCOCC(=O)c1cccnc1Cl 0af7401926cc48110d7a372d38dc922f [1,1,0,0,0,0|2,0,0]=4 5202 B15R1.3965 CCCCOCC(=O)c1ncccc1F 7cfdfc296d8359d1d154c842a427c646 [1,1,0,0,0,0|2,0,0]=4 5203 B15R1.3965 CCCNCCC(=O)c1ccccc1F 95e940a7332c64e83af1f7f687003803 [1,1,0,0,0,0|1,0,0]=3 5204 B15R1.3965 CCNCCNC(=O)c1ccccc1Cl 865a2a87bd695432002f411ac5728373 [1,1,0,0,0,0|2,0,0]=4 5205 B15R1.3965 CCNCCNC(=O)c1ccccc1F d6403c3ef0a2c503eb0c6d7f7b275fe0 [1,1,0,0,0,0|2,0,0]=4 5206 B15R1.3965 CCNCCNC(=O)c1ccccc1I 59447c4ea6acdb39622f8300aeaa1285 [1,1,0,0,0,0|2,0,0]=4 5207 B15R1.3965 CCOCCNC(=O)c1ccccc1Br 2e835857b245bada0d1bb889b76e68e1 [1,1,0,0,0,0|2,0,0]=4 5208 B15R1.3965 CCOCCNC(=O)c1ccccc1C a695121a0ff221ce1c2dbe57e89a3047 [1,1,0,0,0,0|2,0,0]=4 5209 B15R1.3965 CCOCCNC(=O)c1ccccc1Cl 584678ee89453ad68aa95ac4143f6a31 [1,1,0,0,0,0|2,0,0]=4 5210 B15R1.3965 CCOCCNC(=O)c1ccccc1F c95003dd137c22e4005ab615cab11ed5 [1,1,0,0,0,0|2,0,0]=4 5211 B15R1.3965 CCOCCNC(=O)c1ccccc1I 96eaad1f252312826f6e00c97beca795 [1,1,0,0,0,0|2,0,0]=4 5212 B15R1.3965 CCOCCNC(=O)c1ccccc1O 5d0452c7101c9a28adc1b59a6c17c395 [1,1,0,0,0,0|2,0,0]=4 5213 B15R1.3965 CCOCCNC(=O)c1ccccc1S 0ab0e5d0f7cf9903a9149b5ba416c363 [1,1,0,0,0,0|2,0,0]=4 5214 B15R1.3965 CCSCCNC(=O)c1ccccc1Br c4f4fbd413e85ce3ed86a7fe91457866 [1,1,0,0,0,0|2,0,0]=4 5215 B15R1.3965 CCSCCNC(=O)c1ccccc1C 4375a30aeb7e9ebcd8e527acd2af651a [1,1,0,0,0,0|2,0,0]=4 5216 B15R1.3965 CCSCCNC(=O)c1ccccc1Cl 0607647a691f2cdaaee1459316763d7d [1,1,0,0,0,0|2,0,0]=4 5217 B15R1.3965 CCSCCNC(=O)c1ccccc1F fe8270084c5110abeb6d0e224c2d1370 [1,1,0,0,0,0|2,0,0]=4 5218 B15R1.3965 CCSCCNC(=O)c1ccccc1I 3dbc72cc8e0c1709926767274191eadd [1,1,0,0,0,0|2,0,0]=4 5219 B15R1.3965 CCSCCNC(=O)c1ccccc1O d81a2e85bec6f35465562877386e1c37 [1,1,0,0,0,0|2,0,0]=4 5220 B15R1.3965 CCSCCNC(=O)c1ccccc1S db10a02eb88577fadcafdb7934eb5673 [1,1,0,0,0,0|2,0,0]=4 5221 B15R1.3965 COCCCNC(=O)c1ccccc1Br 2173d2246ed7fc33269ba8fc1ab344bf [1,1,0,0,0,0|2,0,0]=4 5222 B15R1.3965 COCCCNC(=O)c1ccccc1C 32cab642b619c4a4699199111043670e [1,1,0,0,0,0|2,0,0]=4 5223 B15R1.3965 COCCCNC(=O)c1ccccc1Cl dcd096ebef9927c16f36bac881eff8a9 [1,1,0,0,0,0|2,0,0]=4 5224 B15R1.3965 COCCCNC(=O)c1ccccc1F 70eaac8cb79a90e644496635e266d0b6 [1,1,0,0,0,0|2,0,0]=4 5225 B15R1.3965 COCCCNC(=O)c1ccccc1I aad0932e50713138eed2a99853320862 [1,1,0,0,0,0|2,0,0]=4 5226 B15R1.3965 COCCCNC(=O)c1ccccc1O 9f238aff28f574dd91d6acba6c172454 [1,1,0,0,0,0|2,0,0]=4 5227 B15R1.3965 COCCCNC(=O)c1ccccc1S 0178087d716b15ace5206c8f3b94b3d1 [1,1,0,0,0,0|2,0,0]=4 5228 B15R1.3965 COCCNCC(=O)c1ccccc1C aa1e67b33bcd71bf75cc2a5705d2034a [1,1,0,0,0,0|2,0,0]=4 5229 B15R1.3965 COCCNCC(=O)c1ccccc1Cl 19495d57ae62a30d044fe790e537fc27 [1,1,0,0,0,0|2,0,0]=4 5230 B15R1.3965 COCCNCC(=O)c1ccccc1F a1e24efe23c2b80aec852e673872880b [1,1,0,0,0,0|2,0,0]=4 5231 B15R1.3965 COCCNCC(=O)c1ccccc1I c7b18f329caa2d88d00d985d97ecb7bf [1,1,0,0,0,0|2,0,0]=4 5232 B15R1.3965 COCCOCC(=O)c1ccccc1Br 2e58fb9c25537dd3db6862352f5aabbf [1,1,0,0,0,0|2,0,0]=4 5233 B15R1.3965 COCCOCC(=O)c1ccccc1C a519df34432a6cf6477b79c50f292fec [1,1,0,0,0,0|2,0,0]=4 5234 B15R1.3965 COCCOCC(=O)c1ccccc1Cl e67e207978c44d3e2d38792a84660fd5 [1,1,0,0,0,0|2,0,0]=4 5235 B15R1.3965 COCCOCC(=O)c1ccccc1F 41356f225a9c8e70a201e73767a30b51 [1,1,0,0,0,0|2,0,0]=4 5236 B15R1.3965 COCCOCC(=O)c1ccccc1I e3f9828440e56e51fe10a179616f7db7 [1,1,0,0,0,0|2,0,0]=4 5237 B15R1.3965 CSCCCNC(=O)c1ccccc1Br 82720274dc1d73066d7a0df9841ffa37 [1,1,0,0,0,0|2,0,0]=4 5238 B15R1.3965 CSCCCNC(=O)c1ccccc1C 70495452ad4978323e4482c26cd79725 [1,1,0,0,0,0|2,0,0]=4 5239 B15R1.3965 CSCCCNC(=O)c1ccccc1Cl f742f3c025a291214e683c46c1874b6d [1,1,0,0,0,0|2,0,0]=4 5240 B15R1.3965 CSCCCNC(=O)c1ccccc1F 527b1997ed287e83e9a9c35c5ba39ddb [1,1,0,0,0,0|2,0,0]=4 5241 B15R1.3965 CSCCCNC(=O)c1ccccc1I a3052ed0186069f4bb5bd8268d3b4b4d [1,1,0,0,0,0|2,0,0]=4 5242 B15R1.3965 CSCCCNC(=O)c1ccccc1O 75c4c3fd9dfdd990fd041547373b1883 [1,1,0,0,0,0|2,0,0]=4 5243 B15R1.3965 CSCCCNC(=O)c1ccccc1S 57838bf6e1fc31fb70b00a85bf6e33ad [1,1,0,0,0,0|2,0,0]=4 5244 B15R1.3965 CSCCNCC(=O)c1ccccc1C 1ca20b1ce5479bcafe45ffe55db1d5c5 [1,1,0,0,0,0|2,0,0]=4 5245 B15R1.3965 CSCCNCC(=O)c1ccccc1Cl ac3ae70b1cd2da821bd53a40422a1b7d [1,1,0,0,0,0|2,0,0]=4 5246 B15R1.3965 CSCCNCC(=O)c1ccccc1F 1daa4c98f5098805eb2bf364a46e21e6 [1,1,0,0,0,0|2,0,0]=4 5247 B15R1.3965 CSCCNCC(=O)c1ccccc1I 4db3af6b05e7f49fa46e69236b53d818 [1,1,0,0,0,0|2,0,0]=4 5248 B15R1.3965 CSCCOCC(=O)c1ccccc1Br 2eb061dcc9ef9b4bc90f63a0a3175db7 [1,1,0,0,0,0|2,0,0]=4 5249 B15R1.3965 CSCCOCC(=O)c1ccccc1C cccb4becd05aa444524456ba23d046cc [1,1,0,0,0,0|2,0,0]=4 5250 B15R1.3965 CSCCOCC(=O)c1ccccc1Cl 9739e0775e9c1329833fd73e43e2cb28 [1,1,0,0,0,0|2,0,0]=4 5251 B15R1.3965 CSCCOCC(=O)c1ccccc1F f25944d0e986a04146e140c8afd987f5 [1,1,0,0,0,0|2,0,0]=4 5252 B15R1.3965 CSCCOCC(=O)c1ccccc1I 28f631293efb7f2a3ed107131f4db5b3 [1,1,0,0,0,0|2,0,0]=4 5253 B15R1.3965 Cc1ccccc1C(=O)CNCCCCl 5e4c4ebea56adf70c8f6d44110d1783d [1,1,0,0,0,0|2,0,0]=4 5254 B15R1.3965 Cc1ccccc1C(=O)CNCCCO cafd83a17bd4ffd31488b493cf8b3c83 [1,1,0,0,0,0|2,0,0]=4 5255 B15R1.3965 Cc1ccccc1C(=O)COCCCF b8422dbb8be24bf1b9844e8ca82eb7c2 [1,1,0,0,0,0|2,0,0]=4 5256 B15R1.3965 Cc1ccccc1C(=O)COCCCS b0f469ea37edd80652be52565e5cfc37 [1,1,0,0,0,0|2,0,0]=4 5257 B15R1.3965 Cc1ccccc1C(=O)NCCCCCl 53f3046249ad0a76c1711b67ba506df3 [1,1,0,0,0,0|2,0,0]=4 5258 B15R1.3965 Cc1ccccc1C(=O)NCCCCO 7ccf8f82572d12cb354c71737e1b8535 [1,1,0,0,0,0|2,0,0]=4 5259 B15R1.3965 Cc1ccccc1C(=O)NCCCCS 32489248a5f08ce14174c29aff9f26b1 [1,1,0,0,0,0|2,0,0]=4 5260 B15R1.3965 O=C(CCNCCBr)c1ccccc1F e5ddcae16ca20d1faa83034f7d6312c4 [1,1,0,0,0,0|2,0,0]=4 5261 B15R1.3965 O=C(CCNCCI)c1ccccc1F 97ba4c999de4144c4d9c6d143890a284 [1,1,0,0,0,0|2,0,0]=4 5262 B15R1.3965 O=C(CCNCCO)c1ccccc1F 07f2ff25273743a07e87f57f96de2e43 [1,1,0,0,0,0|2,0,0]=4 5263 B15R1.3965 O=C(CCNCCS)c1ccccc1F 8e3b27c6b33d359434488cab26bac843 [1,1,0,0,0,0|2,0,0]=4 5264 B15R1.3965 O=C(CCOCCS)c1ccccc1F 0d5e309d1e18bee50659cee39732dc16 [1,1,0,0,0,0|2,0,0]=4 5265 B15R1.3965 O=C(CNCCCCl)c1ccccc1Br 569ab94921e68796ae7007610c0779ce [1,1,0,0,0,0|2,0,0]=4 5266 B15R1.3965 O=C(CNCCCCl)c1ccccc1Cl 52ec062544d0726eea64a446b2f939dd [1,1,0,0,0,0|2,0,0]=4 5267 B15R1.3965 O=C(CNCCCCl)c1ccccc1F 91e8f7bfbb6bf29acd72b001e12df484 [1,1,0,0,0,0|2,0,0]=4 5268 B15R1.3965 O=C(CNCCCCl)c1ccccc1I 4c4ceae5e6925e3df8ffc252c5031c3e [1,1,0,0,0,0|2,0,0]=4 5269 B15R1.3965 O=C(CNCCCO)c1ccccc1Br 76c97d446db22cfdc47158b9c5e9b614 [1,1,0,0,0,0|2,0,0]=4 5270 B15R1.3965 O=C(CNCCCO)c1ccccc1Cl 948f3ceab865d69b38abd717eafb7e5d [1,1,0,0,0,0|2,0,0]=4 5271 B15R1.3965 O=C(CNCCCO)c1ccccc1F 5d132a7c3f1714ab4b22c2e4d259b963 [1,1,0,0,0,0|2,0,0]=4 5272 B15R1.3965 O=C(CNCCCO)c1ccccc1I 32f56358b8e57abb310832b603ddd9ef [1,1,0,0,0,0|2,0,0]=4 5273 B15R1.3965 O=C(COCCCF)c1ccccc1Br 34f2659827c1f295c4b68707386e6002 [1,1,0,0,0,0|2,0,0]=4 5274 B15R1.3965 O=C(COCCCF)c1ccccc1Cl 2598484d7e3e50984e35524dccbe9855 [1,1,0,0,0,0|2,0,0]=4 5275 B15R1.3965 O=C(COCCCF)c1ccccc1F 7475efd82843029020c4fbac89ce4d00 [1,1,0,0,0,0|2,0,0]=4 5276 B15R1.3965 O=C(COCCCF)c1ccccc1I 4bd78282c85a2d48b27cf8959fd69976 [1,1,0,0,0,0|2,0,0]=4 5277 B15R1.3965 O=C(COCCCS)c1ccccc1Cl bb078288a1d107e340c89a7912909ca8 [1,1,0,0,0,0|2,0,0]=4 5278 B15R1.3965 O=C(COCCCS)c1ccccc1F 0fa846f3b681fda03a487bf0be62e4dc [1,1,0,0,0,0|2,0,0]=4 5279 B15R1.3965 O=C(COCCCS)c1ccccc1I 5eb116be658442284d327f8c1c5ee604 [1,1,0,0,0,0|2,0,0]=4 5280 B15R1.3965 O=C(NCCCCCl)c1ccccc1Br 1ab17155a6d15a5ff5d13ee114ec4645 [1,1,0,0,0,0|2,0,0]=4 5281 B15R1.3965 O=C(NCCCCCl)c1ccccc1Cl 4e5d48f7020680efd75abeb9de01e4ac [1,1,0,0,0,0|2,0,0]=4 5282 B15R1.3965 O=C(NCCCCCl)c1ccccc1F eb227bfa9df1f1f726116c921599a4c2 [1,1,0,0,0,0|2,0,0]=4 5283 B15R1.3965 O=C(NCCCCCl)c1ccccc1I dc9d07a70abd43db7a59812accd3a797 [1,1,0,0,0,0|2,0,0]=4 5284 B15R1.3965 O=C(NCCCCCl)c1ccccc1O 6fb97edfd58f0d285baa41c4ab6b2916 [1,1,0,0,0,0|2,0,0]=4 5285 B15R1.3965 O=C(NCCCCCl)c1ccccc1S 685a7665f0452328be310c1799336f79 [1,1,0,0,0,0|2,0,0]=4 5286 B15R1.3965 O=C(NCCCCO)c1ccccc1Br 5407ac0876a29d49e5d1e622fd77533a [1,1,0,0,0,0|2,0,0]=4 5287 B15R1.3965 O=C(NCCCCO)c1ccccc1Cl 602ba1955cb5f70ffbafef421101e0d3 [1,1,0,0,0,0|2,0,0]=4 5288 B15R1.3965 O=C(NCCCCO)c1ccccc1F acf750a966cb99d3807e1ec794c1abf9 [1,1,0,0,0,0|2,0,0]=4 5289 B15R1.3965 O=C(NCCCCO)c1ccccc1I 6765a90f191826c669ab073659551162 [1,1,0,0,0,0|2,0,0]=4 5290 B15R1.3965 O=C(NCCCCO)c1ccccc1O f0615d9bd0ce8bba098440b906aa2ef3 [1,1,0,0,0,0|2,0,0]=4 5291 B15R1.3965 O=C(NCCCCO)c1ccccc1S c4296660b01d19f4cb55eb1da8c27548 [1,1,0,0,0,0|2,0,0]=4 5292 B15R1.3965 O=C(NCCCCS)c1ccccc1Br 7f1bb474f222db9b7f9f68d2dae9288e [1,1,0,0,0,0|2,0,0]=4 5293 B15R1.3965 O=C(NCCCCS)c1ccccc1Cl 453f818a87554996cb7a9f01a7ddfc2f [1,1,0,0,0,0|2,0,0]=4 5294 B15R1.3965 O=C(NCCCCS)c1ccccc1F 6984385ff7b19e500ca284e05814c22a [1,1,0,0,0,0|2,0,0]=4 5295 B15R1.3965 O=C(NCCCCS)c1ccccc1I 8c1aa77c8c711018abc9e5f75243fd55 [1,1,0,0,0,0|2,0,0]=4 5296 B15R1.3965 O=C(NCCCCS)c1ccccc1O 6189cf56218f4a865468fa0d5db346b8 [1,1,0,0,0,0|2,0,0]=4 5297 B15R1.3965 O=C(NCCCCS)c1ccccc1S e2aee8e0a3481a6c5ff9edb93a839e9d [1,1,0,0,0,0|2,0,0]=4 5298 B15R1.12 CCCCCCCNc1ccc(cc1)Br a588ce212b0b01bda80aef4b26367dba [1,1,0,0,0,0|2,0,0]=4 5299 B15R1.12 CCCCCCCNc1ccc(cc1)C 5649c898cd76e7ac04f7ddee3c5390b3 [1,1,0,0,0,0|2,0,0]=4 5300 B15R1.12 CCCCCCCNc1ccc(cc1)Cl d01102283d66dff2a0f93f4400953343 [1,1,0,0,0,0|2,0,0]=4 5301 B15R1.12 CCCCCCCNc1ccc(cc1)F c7ef9a867d01fe0ca650986a39d06937 [1,1,0,0,0,0|2,0,0]=4 5302 B15R1.12 CCCCCCCNc1ccc(cc1)I 259326fec4ba992eebf7025b889826a3 [1,1,0,0,0,0|2,0,0]=4 5303 B15R1.12 CCCCCCCNc1ccc(cc1)S 0ccf27f53bf96a22a877b7d6551fb495 [1,1,0,0,0,0|2,0,0]=4 5304 B15R1.12 CCCCCCCOc1ccc(cc1)Br d75d46e74bbf4487709eccbfcebc2a07 [1,1,0,0,0,0|2,0,0]=4 5305 B15R1.12 CCCCCCCOc1ccc(cc1)C 8b4e693de9bf04464debfcaec65f9db8 [1,1,0,0,0,0|2,0,0]=4 5306 B15R1.12 CCCCCCCOc1ccc(cc1)Cl b7c4bb373201241a04785994e2568c14 [1,1,0,0,0,0|2,0,0]=4 5307 B15R1.12 CCCCCCCOc1ccc(cc1)F dd44f5613e21cc30baee259e6eb319ab [1,1,0,0,0,0|2,0,0]=4 5308 B15R1.12 CCCCCCCOc1ccc(cc1)I 864960bd09b2b81d1e98d2ba7009c7eb [1,1,0,0,0,0|2,0,0]=4 5309 B15R1.12 CCCCCCCOc1ccc(cc1)S 961bdeb4f3af4f2765fab2c24ba0dc9f [1,1,0,0,0,0|2,0,0]=4 5310 B15R1.12 CCCCCCNCc1ccc(cc1)Br dc0be10bc9baea1882f26caac458996a [1,1,0,0,0,0|1,0,1]=4 5311 B15R1.12 CCCCCCNCc1ccc(cc1)C fab713396cf555a6b9712887999f1fae [1,1,0,0,0,0|1,0,1]=4 5312 B15R1.12 CCCCCCNCc1ccc(cc1)Cl 452c0029ada9ec872beaa73c8ab56c2b [1,1,0,0,0,0|1,0,1]=4 5313 B15R1.12 CCCCCCNCc1ccc(cc1)F 96d4fec2064b25e7aa8d1155082c233f [1,1,0,0,0,0|1,0,1]=4 5314 B15R1.12 CCCCCCNCc1ccc(cc1)I 635fea56fb73662717898f55197a90be [1,1,0,0,0,0|1,0,1]=4 5315 B15R1.12 CCCCCCOCc1cc[n+](cc1)[O-] ce85a2345edbe6f78d0ee21f25617457 [1,1,0,0,0,0|1,0,1]=4 5316 B15R1.12 CCCCCCOCc1ccc(cc1)Br b80fa9f5ca06f88522fb71875ba8059b [1,1,0,0,0,0|0,0,1]=3 5317 B15R1.12 CCCCCCOCc1ccc(cc1)C 5b91c36d190c244adc013ac38ae55496 [1,1,0,0,0,0|0,0,1]=3 5318 B15R1.12 CCCCCCOCc1ccc(cc1)Cl cadbfcd32d85489ee48ff42080598a84 [1,1,0,0,0,0|0,0,1]=3 5319 B15R1.12 CCCCCCOCc1ccc(cc1)F 4c335eb4963f9177b44c32ac771251fe [1,1,0,0,0,0|0,0,1]=3 5320 B15R1.12 CCCCCCOCc1ccc(cc1)I e33e64557805b49339f39b2575a9aa41 [1,1,0,0,0,0|0,0,1]=3 5321 B15R1.12 CCCCCCOCc1ccc(cc1)S a521b2b0fe227502ba0a08fe73d0b3b0 [1,1,0,0,0,0|0,0,1]=3 5322 B15R1.12 CCCCCCOCc1ccc(cn1)Br e7dab70581de8ddb456eafb271f2bcc7 [1,1,0,0,0,0|1,0,1]=4 5323 B15R1.12 CCCCCCOCc1ccc(cn1)C 8d9a80bba32773136390c36f1edcaa8a [1,1,0,0,0,0|1,0,1]=4 5324 B15R1.12 CCCCCCOCc1ccc(cn1)Cl 2c0f922361e6b91af0b5a89e9b45018f [1,1,0,0,0,0|1,0,1]=4 5325 B15R1.12 CCCCCCOCc1ccc(cn1)F fb25fa942dee195c7612aa3d6fee496b [1,1,0,0,0,0|1,0,1]=4 5326 B15R1.12 CCCCCCOCc1ccc(cn1)I dce5c6fb016c89a643745398a6c9da61 [1,1,0,0,0,0|1,0,1]=4 5327 B15R1.12 CCCCCCOCc1ccc(nc1)Br 924b1d5a93a4420de0c7555fb1578abc [1,1,0,0,0,0|1,0,1]=4 5328 B15R1.12 CCCCCCOCc1ccc(nc1)C 84bb1e5ea868fa69adf2450631ff86fb [1,1,0,0,0,0|1,0,1]=4 5329 B15R1.12 CCCCCCOCc1ccc(nc1)Cl 8699e9a345660b69948cedd35abc241b [1,1,0,0,0,0|1,0,1]=4 5330 B15R1.12 CCCCCCOCc1ccc(nc1)F 0ca5f885c160e2acbe44a6a840e56764 [1,1,0,0,0,0|1,0,1]=4 5331 B15R1.12 CCCCNC/C=C/c1ccc(cc1)Cl 395bee0ce3d7098f03a083c7459614cf [1,1,0,0,0,0|2,0,0]=4 5332 B15R1.12 CCCCNC/C=C/c1ccc(cc1)F 530d43f77ee12124db5d6e9bffa2576b [1,1,0,0,0,0|2,0,0]=4 5333 B15R1.12 CCCCOC/C=C/c1ccc(cc1)Br 0939423c6c7728a494ba0d3c5643c10e [1,1,0,0,0,0|2,0,0]=4 5334 B15R1.12 CCCCOC/C=C/c1ccc(cc1)Cl e191f9965db5249a4356ceb12c515c81 [1,1,0,0,0,0|2,0,0]=4 5335 B15R1.12 CCCCOC/C=C/c1ccc(cc1)F a0d637535aa163387f4d712bfa0624ed [1,1,0,0,0,0|2,0,0]=4 5336 B15R1.12 CCCCOCOCc1ccc(cc1)Br 5fbd012a04259dcf8d83b6e37e490344 [1,1,0,0,0,0|1,0,1]=4 5337 B15R1.12 CCCCOCOCc1ccc(cc1)C 404edbca7a199b1a65abd775ea1109f9 [1,1,0,0,0,0|1,0,1]=4 5338 B15R1.12 CCCCOCOCc1ccc(cc1)Cl 3716d5b19ad43303c207141075d63a6b [1,1,0,0,0,0|1,0,1]=4 5339 B15R1.12 CCCCOCOCc1ccc(cc1)F 2c92f5c4ffedfbfa5e840564ea00a197 [1,1,0,0,0,0|1,0,1]=4 5340 B15R1.12 CCCCOCOCc1ccc(cc1)I a337aaadc563258f2812e301a3bdb749 [1,1,0,0,0,0|1,0,1]=4 5341 B15R1.12 CCCCOCOCc1ccc(cc1)S d9d9cc9c5c9a993962b5a503f80b62b2 [1,1,0,0,0,0|1,0,1]=4 5342 B15R1.12 CCCNCCOCc1ccc(cc1)Cl 4e439b3faefa760498090178fee16cc9 [1,1,0,0,0,0|1,0,1]=4 5343 B15R1.12 CCCOCCOCc1ccc(cc1)Br 5e7e7e65c49fcb378611ca3f2059f844 [1,1,0,0,0,0|1,0,1]=4 5344 B15R1.12 CCCOCCOCc1ccc(cc1)C 1b90cf1d0a7929f4431620b0fe9637df [1,1,0,0,0,0|1,0,1]=4 5345 B15R1.12 CCCOCCOCc1ccc(cc1)Cl 8a64bf4ec4c9d1a906af72ecf5e3adc2 [1,1,0,0,0,0|1,0,1]=4 5346 B15R1.12 CCCOCCOCc1ccc(cc1)F c925f8fbf055c0c2411e22ea559f8772 [1,1,0,0,0,0|1,0,1]=4 5347 B15R1.12 CCCOCCOCc1ccc(cc1)I c89b9848fef0edd644ec74388b69a6bf [1,1,0,0,0,0|1,0,1]=4 5348 B15R1.12 CCCOCCOCc1ccc(cc1)S 535551b517b4e5821478956ec3fbc7d4 [1,1,0,0,0,0|1,0,1]=4 5349 B15R1.12 CCCSCCOCc1ccc(cc1)Br 0ea977e0769a0cb9d7c4394ef0b805ca [1,1,0,0,0,0|1,0,1]=4 5350 B15R1.12 CCCSCCOCc1ccc(cc1)C 25024a46535fa9628e5a4a5811653893 [1,1,0,0,0,0|1,0,1]=4 5351 B15R1.12 CCCSCCOCc1ccc(cc1)Cl 05725571927722e59285e88d8892fc06 [1,1,0,0,0,0|1,0,1]=4 5352 B15R1.12 CCCSCCOCc1ccc(cc1)F 39b3499da0da5dcf49f7a4cac9ed2a76 [1,1,0,0,0,0|1,0,1]=4 5353 B15R1.12 CCCSCCOCc1ccc(cc1)I 4babe12bc71bc5d86f5d316fcd76b080 [1,1,0,0,0,0|1,0,1]=4 5354 B15R1.12 CCOCCCOCc1ccc(cc1)Br 6e77d2a9ccb4aae83dbf68042af38688 [1,1,0,0,0,0|1,0,1]=4 5355 B15R1.12 CCOCCCOCc1ccc(cc1)C cdad0656bf10aeec571f94baf1082bb7 [1,1,0,0,0,0|1,0,1]=4 5356 B15R1.12 CCOCCCOCc1ccc(cc1)Cl 23141a318cd74918c995af796797ecf0 [1,1,0,0,0,0|1,0,1]=4 5357 B15R1.12 CCOCCCOCc1ccc(cc1)F 6e3808bcc5797392d8520e90ec517868 [1,1,0,0,0,0|1,0,1]=4 5358 B15R1.12 CCOCCCOCc1ccc(cc1)I d6ec0c3b9a2d564d0bda9a8051417fc8 [1,1,0,0,0,0|1,0,1]=4 5359 B15R1.12 CCOCCCOCc1ccc(cc1)S d3c2b88a901a6a405313436e05771395 [1,1,0,0,0,0|1,0,1]=4 5360 B15R1.12 CCSCCCOCc1ccc(cc1)Br a68fae6c6414123014e898e7daac6d02 [1,1,0,0,0,0|1,0,1]=4 5361 B15R1.12 CCSCCCOCc1ccc(cc1)C 29015d3d7daacbf08761b93f66f9da5c [1,1,0,0,0,0|1,0,1]=4 5362 B15R1.12 CCSCCCOCc1ccc(cc1)Cl c44f2eda1d6583a64529c647dc7fa88a [1,1,0,0,0,0|1,0,1]=4 5363 B15R1.12 CCSCCCOCc1ccc(cc1)F 2880ad8d6a1e05543608c98d6d8276f4 [1,1,0,0,0,0|1,0,1]=4 5364 B15R1.12 CCSCCCOCc1ccc(cc1)I 3f1db32a9bf89f7b3276f6410b10bca5 [1,1,0,0,0,0|1,0,1]=4 5365 B15R1.12 CCSCCCOCc1ccc(cc1)S 04907957e10bc2ed977a5570d268477a [1,1,0,0,0,0|1,0,1]=4 5366 B15R1.12 COCCCCOCc1ccc(cc1)Br 1cf38ad30d9d18dd414a0870e985f67f [1,1,0,0,0,0|1,0,1]=4 5367 B15R1.12 COCCCCOCc1ccc(cc1)C 2dd0eb8bd5d68b18b2438489902f7d44 [1,1,0,0,0,0|1,0,1]=4 5368 B15R1.12 COCCCCOCc1ccc(cc1)Cl 2aab7d284bcaa72374aec40d16da586b [1,1,0,0,0,0|1,0,1]=4 5369 B15R1.12 COCCCCOCc1ccc(cc1)F 21fe5c49e8b840a42f0e85fa6a887ab4 [1,1,0,0,0,0|1,0,1]=4 5370 B15R1.12 COCCCCOCc1ccc(cc1)I 63e487b505497de4761eaec43d4317df [1,1,0,0,0,0|1,0,1]=4 5371 B15R1.12 COCCCCOCc1ccc(cc1)S ab6cbc1551b56c4a6c0488280d87c048 [1,1,0,0,0,0|1,0,1]=4 5372 B15R1.12 CSCCCCOCc1ccc(cc1)Br 02bec4876dc785bf658594778eda7cb1 [1,1,0,0,0,0|1,0,1]=4 5373 B15R1.12 CSCCCCOCc1ccc(cc1)C 0c540599891aa2c6d6fcca75f02a936e [1,1,0,0,0,0|1,0,1]=4 5374 B15R1.12 CSCCCCOCc1ccc(cc1)Cl d4f1398b4854bd025812caf1da11783a [1,1,0,0,0,0|1,0,1]=4 5375 B15R1.12 CSCCCCOCc1ccc(cc1)F 9d31b5538d62a7432c94f3c89aec199d [1,1,0,0,0,0|1,0,1]=4 5376 B15R1.12 CSCCCCOCc1ccc(cc1)I 500519951b05dafa1e665c13dd0b63e1 [1,1,0,0,0,0|1,0,1]=4 5377 B15R1.12 Cc1ccc(cc1)COCCCCCF c908fa5db2c1f3ff8be78fc42cde6efa [1,1,0,0,0,0|1,0,1]=4 5378 B15R1.12 FCCCCCOCc1ccc(cc1)Br 4893d6b5d7a1d5be0d7d7a0aeb85f211 [1,1,0,0,0,0|1,0,1]=4 5379 B15R1.12 FCCCCCOCc1ccc(cc1)Cl f9a06a006e5fbf44ee11c6ae944628ce [1,1,0,0,0,0|1,0,1]=4 5380 B15R1.12 FCCCCCOCc1ccc(cc1)F 876658ec6644f26837149c2891ae6b2d [1,1,0,0,0,0|1,0,1]=4 5381 B15R1.12 FCCCCCOCc1ccc(cc1)I f79770b7eff2e5196b19f5567dd5c6d8 [1,1,0,0,0,0|1,0,1]=4 5382 B15R1.12 FCCCCCOCc1ccc(cc1)S 550806d2045732a0c886bb45f7f40c41 [1,1,0,0,0,0|1,0,1]=4 5383 B15R1.35 BrCCNCCCOCc1ccccc1 d5fc685551e2db23b2d912acaef3496a [1,1,0,0,0,0|1,0,1]=4 5384 B15R1.35 C#CCCCCCOCc1ccccc1 322abbba1697c8b927a7b8a71c1bd276 [1,1,0,0,0,0|0,0,2]=4 5385 B15R1.35 C=CCCCCCOCc1ccccc1 ae9628203d95c86162f78fb96afa312c [1,1,0,0,0,0|0,0,2]=4 5386 B15R1.35 CC/C=C\CCCOCc1ccccc1 4c65064fd4a5bc7048620a99c54ace9f [1,1,0,0,0,0|0,0,2]=4 5387 B15R1.35 CCC/C=C\CCOCc1ccccc1 596a996cc3c389fca1d1e935ce0c49f6 [1,1,0,0,0,0|0,0,2]=4 5388 B15R1.35 CCCC#CCCOCc1ccccc1 76d5ad88ce7ce2ec786cef847e4cb5d7 [1,1,0,0,0,0|0,0,2]=4 5389 B15R1.35 CCCC/C=C/COCc1ccccc1 662bd2995ddae1fce2455b2571d21492 [1,1,0,0,0,0|0,0,2]=4 5390 B15R1.35 CCCC/C=C\COCc1ccccc1 ff26e9d440c4077067d5ff1b0e410184 [1,1,0,0,0,0|0,0,2]=4 5391 B15R1.35 CCCCC#CCOCc1ccccc1 22f8543e7e9eb24a6910f0683cf37af2 [1,1,0,0,0,0|0,0,2]=4 5392 B15R1.35 CCCCCCCCNc1ccccc1 ac577ba88d3acb7c7608bfb2c8e32e96 [1,1,0,0,0,0|1,0,1]=4 5393 B15R1.35 CCCCCCCNCc1ccccc1 eea83c9f1c6ac4978dd503e75e06fe00 [1,1,0,0,0,0|1,0,1]=4 5394 B15R1.35 CCCCCCCOCc1ccccc1 597e4cb64ecc8ac9dd02123f33e8b8e4 [1,1,0,0,0,0|0,0,1]=3 5395 B15R1.35 CCCCCCCOCc1ccccn1 06412f95d0634d92c6ef84f3559b7eda [1,1,0,0,0,0|1,0,1]=4 5396 B15R1.35 CCCCCCCOCc1cccnc1 750182c23f4cc3d13f1bdd9aeb3e6133 [1,1,0,0,0,0|1,0,1]=4 5397 B15R1.35 CCCCCCCOCc1ccncc1 0ef1a82857a9e51115405985cb8e281f [1,1,0,0,0,0|1,0,1]=4 5398 B15R1.35 CCCCCCNCCc1ccccc1 0d320cc192af3988f0cfdcbd9f7aa136 [1,1,0,0,0,0|1,0,1]=4 5399 B15R1.35 CCCCCCOCCc1ccccc1 f4e1861a0470532cc3bd43eca0b02519 [1,1,0,0,0,0|0,0,1]=3 5400 B15R1.35 CCCCCCOCCc1ccccn1 af9037102dee7d400b2f953ae3f45efa [1,1,0,0,0,0|1,0,1]=4 5401 B15R1.35 CCCCCCOCCc1cccnc1 aeceb28361a54aa70194193a548491cb [1,1,0,0,0,0|1,0,1]=4 5402 B15R1.35 CCCCCCOCCc1ccncc1 afe85d71eaee7342f2fc7040463b6a60 [1,1,0,0,0,0|1,0,1]=4 5403 B15R1.35 CCCCCNC/C=C/c1ccccc1 73b3778532e49f4b610a3101b98bf649 [1,1,0,0,0,0|1,0,0]=3 5404 B15R1.35 CCCCCNCC=Cc1ccccc1 2e2d2dd6283c0dd0c85c5ac8d3165530 [1,1,0,0,0,0|1,0,0]=3 5405 B15R1.35 CCCCCNCCCc1ccccc1 139a4409e925203f78e07d2ffa470a79 [1,1,0,0,0,0|1,0,1]=4 5406 B15R1.35 CCCCCNCCOc1ccccc1 fa20f37ecb18277d8a5a1797619e0459 [1,1,0,0,0,0|2,0,0]=4 5407 B15R1.35 CCCCCNCOCc1ccccc1 c59483db73f8d23d28c1897456e710b8 [1,1,0,0,0,0|0,0,1]=3 5408 B15R1.35 CCCCCOC/C=C/c1ccccc1 9403d9c552c7cfce89880b3ac3304fb2 [1,1,0,0,0,0|1,0,0]=3 5409 B15R1.35 CCCCCOC/C=C/c1ccccn1 f4f965c2dbca32244c7ca1032873afea [1,1,0,0,0,0|2,0,0]=4 5410 B15R1.35 CCCCCOC/C=C/c1cccnc1 2148bcf211fcc94ec1291b9bcfb39dde [1,1,0,0,0,0|2,0,0]=4 5411 B15R1.35 CCCCCOC/C=C/c1ccncc1 77494dc8d8009fd99763262c1d40686c [1,1,0,0,0,0|2,0,0]=4 5412 B15R1.35 CCCCCOC/C=C\c1ccccc1 5598baa8793ad9aa6eedc3242cdb3c9a [1,1,0,0,0,0|1,0,0]=3 5413 B15R1.35 CCCCCOC/C=C\c1ccncc1 296c86d3f6e540a4bad0ac6d2c6f8319 [1,1,0,0,0,0|2,0,0]=4 5414 B15R1.35 CCCCCOCC#Cc1ccccc1 ca6a7ee035c8509d4c1f9cd09b588238 [1,1,0,0,0,0|1,0,1]=4 5415 B15R1.35 CCCCCOCC=Cc1ccccc1 aecf8e5c2a922eda393fb2ebc0620a1c [1,1,0,0,0,0|1,0,0]=3 5416 B15R1.35 CCCCCOCC=Cc1ccncc1 294b5e63bccc710e2833a5104c642a52 [1,1,0,0,0,0|2,0,0]=4 5417 B15R1.35 CCCCCOCCCc1ccccc1 512902f6120a192675f4d62207162ad5 [1,1,0,0,0,0|1,0,1]=4 5418 B15R1.35 CCCCCOCCOc1ccccc1 090e72a8225e8283b45f07325b38e1ad [1,1,0,0,0,0|2,0,0]=4 5419 B15R1.35 CCCCCOCCSc1ccccc1 dd0e27ab313fee4a534d758c73fd85ab [1,1,0,0,0,0|2,0,0]=4 5420 B15R1.35 CCCCNCC/C=C/c1ccccc1 a29dae1ae8416445f9681c8c63e66cd3 [1,1,0,0,0,0|1,0,0]=3 5421 B15R1.35 CCCCNCCCCc1ccccc1 b770123dab7cd0d45840a344a1db1589 [1,1,0,0,0,0|1,0,1]=4 5422 B15R1.35 CCCCNCCCOc1ccccc1 c218d0e2bdf850c2fa9c7c929352382b [1,1,0,0,0,0|2,0,0]=4 5423 B15R1.35 CCCCNCCCSc1ccccc1 1cd14ba0c3e8e77bcba4d44db411993a [1,1,0,0,0,0|2,0,0]=4 5424 B15R1.35 CCCCNCCOCc1ccccc1 7d05da2c0cabd0837dba4038ed1d74fc [1,1,0,0,0,0|0,0,1]=3 5425 B15R1.35 CCCCNCCSCc1ccccc1 c2428403b9223dfa94396c682bf33855 [1,1,0,0,0,0|0,1,1]=4 5426 B15R1.35 CCCCOCCC#Cc1ccccc1 7f3e64d890cf152073a49a23c27db3ee [1,1,0,0,0,0|1,0,1]=4 5427 B15R1.35 CCCCOCCCCc1ccccc1 05438d14e2e0a0f9b6d1124ed6cf7be3 [1,1,0,0,0,0|1,0,1]=4 5428 B15R1.35 CCCCOCCCNc1ccccc1 dfc5d9e886dca19c7e735ce7f4b4cb9a [1,1,0,0,0,0|2,0,0]=4 5429 B15R1.35 CCCCOCCCOc1ccccc1 cb18ded81a085fbb2dd4520762e0c74e [1,1,0,0,0,0|2,0,0]=4 5430 B15R1.35 CCCCOCCCSc1ccccc1 6ab577ac073df1cfbca93af5562bbf54 [1,1,0,0,0,0|2,0,0]=4 5431 B15R1.35 CCCCOCCNCc1ccccc1 79eb1c7068dfa3955634e3424299f726 [1,1,0,0,0,0|1,0,1]=4 5432 B15R1.35 CCCCOCCOCc1ccccc1 759d071aedf1a62c73acce962951c7a6 [1,1,0,0,0,0|0,0,1]=3 5433 B15R1.35 CCCCOCCOCc1ccccn1 d7379af7f1e900dee421fa690de07ec5 [1,1,0,0,0,0|1,0,1]=4 5434 B15R1.35 CCCCOCCOCc1cccnc1 f7a0d018bccd0dba53e9d55f764a825a [1,1,0,0,0,0|1,0,1]=4 5435 B15R1.35 CCCCOCCOCc1ccncc1 d0e6e2a33ec413de8fecc98f7d491f4b [1,1,0,0,0,0|1,0,1]=4 5436 B15R1.35 CCCCOCCSCc1ccccc1 fa1ad7af562dd7ae957852a51dfa748c [1,1,0,0,0,0|0,1,1]=4 5437 B15R1.35 CCCCOCOCCc1ccccc1 d6cc5f44e09ae8710a7e3dff8f804327 [1,1,0,0,0,0|1,0,1]=4 5438 B15R1.35 CCCCSCCOCc1ccccc1 2f8ec1c9118e29e1317eea6fec9822d5 [1,1,0,0,0,0|0,0,1]=3 5439 B15R1.35 CCCCSCCOCc1ccccn1 e68bdd852d9231bfd48f43347d10a3e5 [1,1,0,0,0,0|1,0,1]=4 5440 B15R1.35 CCCCSCCOCc1cccnc1 c314b1fcee27168c49db488ca1de7d9f [1,1,0,0,0,0|1,0,1]=4 5441 B15R1.35 CCCNCCCCCc1ccccc1 536c5ca673f53109942ed4b7aba39bd3 [1,1,0,0,0,0|1,0,1]=4 5442 B15R1.35 CCCNCCCCOc1ccccc1 a46ffe37d124c2c0a1198919463023b6 [1,1,0,0,0,0|2,0,0]=4 5443 B15R1.35 CCCNCCCOCc1ccccc1 ab6247d1538f39c6097cd7afd1939497 [1,1,0,0,0,0|0,0,1]=3 5444 B15R1.35 CCCOCCCC#Cc1ccccc1 027aca66ab8176672c18e6799700043d [1,1,0,0,0,0|1,0,1]=4 5445 B15R1.35 CCCOCCCCCc1ccccc1 57c125414e9f74713dbaae91f0d300aa [1,1,0,0,0,0|1,0,1]=4 5446 B15R1.35 CCCOCCCCOc1ccccc1 0ae74143a43e13ee16da26380f6f0962 [1,1,0,0,0,0|2,0,0]=4 5447 B15R1.35 CCCOCCCNCc1ccccc1 8cc4c25ca8ed073b46eb69f1da6a772c [1,1,0,0,0,0|1,0,1]=4 5448 B15R1.35 CCCOCCCOCc1ccccc1 10744409e90b858d0119ebc100ee9dc2 [1,1,0,0,0,0|0,0,1]=3 5449 B15R1.35 CCCOCCCOCc1ccccn1 5c13611d31667395bb42429a198ea4b1 [1,1,0,0,0,0|1,0,1]=4 5450 B15R1.35 CCCOCCCOCc1cccnc1 93602f01b0dd5dd7e9076d4dbd1f80c0 [1,1,0,0,0,0|1,0,1]=4 5451 B15R1.35 CCCOCCCOCc1ccncc1 459700515c119a9c4445d61c67e3f6e4 [1,1,0,0,0,0|1,0,1]=4 5452 B15R1.35 CCCOCCCSCc1ccccc1 c2bdf5d501c0f025d4ef54342aa452c0 [1,1,0,0,0,0|0,1,1]=4 5453 B15R1.35 CCCOCCOCCc1ccccc1 b376f48eccc3163c19cbd9d212927953 [1,1,0,0,0,0|1,0,1]=4 5454 B15R1.35 CCCOCCOCSc1ccccc1 a257023c43604a04a9a785e7a252cf65 [1,1,0,0,0,0|1,0,1]=4 5455 B15R1.35 CCCSCCCCNc1ccccc1 7f679f6d6ca9f5143bd1ded36cb2cf66 [1,1,0,0,0,0|2,0,0]=4 5456 B15R1.35 CCCSCCOCCc1ccccc1 3e9f689107642d6e559f8f5ff735283f [1,1,0,0,0,0|1,0,1]=4 5457 B15R1.35 CCNCCCCCCc1ccccc1 9b15e7a5b36675fd1e30f911e7f4a0b0 [1,1,0,0,0,0|1,0,1]=4 5458 B15R1.35 CCNCCCCCOc1ccccc1 3254c38952d4ad6253975a195f73d878 [1,1,0,0,0,0|2,0,0]=4 5459 B15R1.35 CCNCCCCOCc1ccccc1 432cd6b3612c687f2b2a34c21f72500e [1,1,0,0,0,0|0,0,1]=3 5460 B15R1.35 CCOCCCCCCc1ccccc1 6696743dffe19439f0b8fa3407ca9c0f [1,1,0,0,0,0|1,0,1]=4 5461 B15R1.35 CCOCCCCOCc1ccccc1 83bb050b255be324ae1d03dcff84027d [1,1,0,0,0,0|0,0,1]=3 5462 B15R1.35 CCOCCCOCCc1ccccc1 86fe6945cd1a5887ea59152212edd484 [1,1,0,0,0,0|1,0,1]=4 5463 B15R1.35 CCOCCNC/C=C/c1ccccc1 923c14536f20962c62995a2504aa44c2 [1,1,0,0,0,0|2,0,0]=4 5464 B15R1.35 CCOCCOC/C=C/c1ccccc1 b2813388b3e20bf99874c871fa292c74 [1,1,0,0,0,0|2,0,0]=4 5465 B15R1.35 CCOCCOC/C=C\c1ccccc1 deb56b1bd4eef0af0fc34ced277c3d43 [1,1,0,0,0,0|2,0,0]=4 5466 B15R1.35 CCOCCOCC=Cc1ccccc1 5c2c686c30ab00ea1bd363fb5498bca3 [1,1,0,0,0,0|2,0,0]=4 5467 B15R1.35 CCOCCOCOCc1ccccc1 fc498bb116f863bd272452f0be0e98f9 [1,1,0,0,0,0|1,0,1]=4 5468 B15R1.35 CCOCNCC/C=C/c1ccccc1 12a88b88811225590ee8f0d904df42e6 [1,1,0,0,0,0|2,0,0]=4 5469 B15R1.35 CCOCOCCOCc1ccccc1 de54cd79375c24fe2bc91d0a8259be62 [1,1,0,0,0,0|1,0,1]=4 5470 B15R1.35 CCSCCCCNCc1ccccc1 f4703de3cb69f807e2184b8b1f86cabc [1,1,0,0,0,0|1,0,1]=4 5471 B15R1.35 CCSCCCOCCc1ccccc1 e95b07e903b0f2bf37e44eb37b4699b2 [1,1,0,0,0,0|1,0,1]=4 5472 B15R1.35 CCSCCNC/C=C/c1ccccc1 2699a1da0277ed475470e565489bcf0d [1,1,0,0,0,0|2,0,0]=4 5473 B15R1.35 CCSCCOC/C=C/c1ccccc1 2e82fd7f2eedaef903680c748c168734 [1,1,0,0,0,0|2,0,0]=4 5474 B15R1.35 CCSCCOC/C=C\c1ccccc1 3964fa18e8fc1804b485fd9cf2905fa0 [1,1,0,0,0,0|2,0,0]=4 5475 B15R1.35 CCSCCOCC=Cc1ccccc1 bbbad0a4e466cced5afa1656a4135d18 [1,1,0,0,0,0|2,0,0]=4 5476 B15R1.35 COCCCCCCNc1ccccc1 5eac438d8010ca2baf70dd48accf91ea [1,1,0,0,0,0|2,0,0]=4 5477 B15R1.35 COCCCCCNCc1ccccc1 0c585fb6c02a0470f8e33c99a169f3df [1,1,0,0,0,0|1,0,1]=4 5478 B15R1.35 COCCCCCOCc1ccccc1 e6a7864e2a1cec8772f009caee8ed700 [1,1,0,0,0,0|0,0,1]=3 5479 B15R1.35 COCCCCCOCc1ccccn1 7a1eed78c9d323b81d8e1ad191ff2020 [1,1,0,0,0,0|1,0,1]=4 5480 B15R1.35 COCCCCCOCc1cccnc1 e93d3b87286d7d7ae5b57b2a168e5fb0 [1,1,0,0,0,0|1,0,1]=4 5481 B15R1.35 COCCCCCOCc1ccncc1 42130555b0318129b15dd7c7315594a3 [1,1,0,0,0,0|1,0,1]=4 5482 B15R1.35 COCCCCOCCc1ccccc1 077764755762f384c2e08e61ee49d665 [1,1,0,0,0,0|1,0,1]=4 5483 B15R1.35 COCCCNC/C=C/c1ccccc1 d81e10a3b1d449187ba2af16f702f13a [1,1,0,0,0,0|2,0,0]=4 5484 B15R1.35 COCCCOC/C=C/c1ccccc1 11c6935314fb44ffe3d8e84c4baee029 [1,1,0,0,0,0|2,0,0]=4 5485 B15R1.35 COCCCOC/C=C\c1ccccc1 048e73f28f82318195eb148b974b917d [1,1,0,0,0,0|2,0,0]=4 5486 B15R1.35 COCCCOCC=Cc1ccccc1 f1dea6b83a900f16c47a8f89542a8a17 [1,1,0,0,0,0|2,0,0]=4 5487 B15R1.35 COCCNCC/C=C/c1ccccc1 7df723a1c9713b93d62db5c1000e8c96 [1,1,0,0,0,0|2,0,0]=4 5488 B15R1.35 COCCNCCOCc1ccccc1 f2345eb8f538bdb282cc65c2138b7aab [1,1,0,0,0,0|1,0,1]=4 5489 B15R1.35 COCCOCCOCc1ccccc1 251d7f70b94044cbbfa09f7c6b74285a [1,1,0,0,0,0|1,0,1]=4 5490 B15R1.35 COCNCCCOCc1ccccc1 84146c8aea9d9dc0089d8b72b838e879 [1,1,0,0,0,0|1,0,1]=4 5491 B15R1.35 COCOCCCOCc1ccccc1 080f57cda1b7ccd49a712a87b2835e33 [1,1,0,0,0,0|1,0,1]=4 5492 B15R1.35 CSCCCCOCCc1ccccc1 e036ac03358e24c776829f5452956e43 [1,1,0,0,0,0|1,0,1]=4 5493 B15R1.35 CSCCCNC/C=C/c1ccccc1 c1514c30de7f07e98e66d72b92a24483 [1,1,0,0,0,0|2,0,0]=4 5494 B15R1.35 CSCCCOC/C=C/c1ccccc1 7468f04661abaa80c8b68b76f786ac73 [1,1,0,0,0,0|2,0,0]=4 5495 B15R1.35 CSCCCOC/C=C\c1ccccc1 87e9e0b75455935009226bfd42ca3f4d [1,1,0,0,0,0|2,0,0]=4 5496 B15R1.35 CSCCCOCC=Cc1ccccc1 8192c5c683b4cb5a11392d0cd15fab29 [1,1,0,0,0,0|2,0,0]=4 5497 B15R1.35 CSCCNCC/C=C/c1ccccc1 2df2fc935907df97a978e81f58eafc8c [1,1,0,0,0,0|2,0,0]=4 5498 B15R1.35 CSCCNCCOCc1ccccc1 600e4f33dea26f0d82ba79aa173a6fda [1,1,0,0,0,0|1,0,1]=4 5499 B15R1.35 CSCCOCCOCc1ccccc1 b86b4a447f4ce775b25bc660efbef162 [1,1,0,0,0,0|1,0,1]=4 5500 B15R1.35 CSCNCCCOCc1ccccc1 fe3650664c691d9365ac238132a172db [1,1,0,0,0,0|1,0,1]=4 5501 B15R1.35 CSCOCCCOCc1ccccc1 ef00f3f2b2445828700bc97b22d3441f [1,1,0,0,0,0|1,0,1]=4 5502 B15R1.35 ClCCCCCCNCc1ccccc1 7e1142a0312a3f99d549b624e7d465f0 [1,1,0,0,0,0|1,0,1]=4 5503 B15R1.35 ClCCCCNC/C=C/c1ccccc1 4cd8c2d3d7ee7f2841f42877da2bf792 [1,1,0,0,0,0|2,0,0]=4 5504 B15R1.35 ClCCCCNCC=Cc1ccccc1 9d2fab4d106a779485afcf19b83f1cfd [1,1,0,0,0,0|2,0,0]=4 5505 B15R1.35 ClCCCCNCOCc1ccccc1 0bf3692f27b7e8b905a57532f06382b9 [1,1,0,0,0,0|1,0,1]=4 5506 B15R1.35 ClCCCNCCOCc1ccccc1 f5ad667148c9be243306527c80677296 [1,1,0,0,0,0|1,0,1]=4 5507 B15R1.35 FCCCCCCNCc1ccccc1 e48add09c30f1863d2d630dc262eebeb [1,1,0,0,0,0|1,0,1]=4 5508 B15R1.35 FCCCCCCOCc1ccccc1 432f5bbb05a2ad3a6f1c9b3a92ea792f [1,1,0,0,0,0|0,0,1]=3 5509 B15R1.35 FCCCCCCOCc1ccccn1 79fd1d1351f09303b7b5fa80e724425d [1,1,0,0,0,0|1,0,1]=4 5510 B15R1.35 FCCCCCCOCc1cccnc1 2c75e1f420bffb59a920a2af38391b31 [1,1,0,0,0,0|1,0,1]=4 5511 B15R1.35 FCCCCCCOCc1ccncc1 82e29c42f12d723b445c74443a59b9e4 [1,1,0,0,0,0|1,0,1]=4 5512 B15R1.35 FCCCCCOCCc1ccccc1 a84586625da3d7cba839ca3e2f369d68 [1,1,0,0,0,0|1,0,1]=4 5513 B15R1.35 FCCCCNC/C=C/c1ccccc1 c428e9609b2f5e2999bd84590acfc5d6 [1,1,0,0,0,0|2,0,0]=4 5514 B15R1.35 FCCCCOC/C=C/c1ccccc1 625bd0bcc976f781b255e6679bade906 [1,1,0,0,0,0|2,0,0]=4 5515 B15R1.35 FCCCCOC/C=C\c1ccccc1 994131e3a5f28ed2a5db0822cab59d85 [1,1,0,0,0,0|2,0,0]=4 5516 B15R1.35 FCCCCOCC=Cc1ccccc1 06f86a4e266c4c8b6f920f2a57a93b85 [1,1,0,0,0,0|2,0,0]=4 5517 B15R1.35 FCCCNCC/C=C/c1ccccc1 96047684033a69d22b4c2d08545774ad [1,1,0,0,0,0|2,0,0]=4 5518 B15R1.35 FCCCNCCOCc1ccccc1 b05a69e52e02eaf36002cbfa65a81728 [1,1,0,0,0,0|1,0,1]=4 5519 B15R1.35 FCCCOCCOCc1ccccc1 4906aed8286139d6825e185c500aa001 [1,1,0,0,0,0|1,0,1]=4 5520 B15R1.35 FCCNCCCOCc1ccccc1 756281c4780ad1a51a1d99def556d13d [1,1,0,0,0,0|1,0,1]=4 5521 B15R1.35 FCCOCCCOCc1ccccc1 f6b293c3516638e0818f551b473faa29 [1,1,0,0,0,0|1,0,1]=4 5522 B15R1.35 FCNCCCCOCc1ccccc1 6ebf04ca52fa135c51c77409255316c8 [1,1,0,0,0,0|1,0,1]=4 5523 B15R1.35 FCOCCCCOCc1ccccc1 f1a73d885f4bdecce81309d875354af9 [1,1,0,0,0,0|1,0,1]=4 5524 B15R1.35 ICCNCCCOCc1ccccc1 eaf881bc3740790513f374d9151a92f7 [1,1,0,0,0,0|1,0,1]=4 5525 B15R1.35 N#CCCCCCOCc1ccccc1 ad55a8284cc400327dddd5930c442376 [1,1,0,0,0,0|0,0,2]=4 5526 B15R1.35 O=CCCCCCOCc1ccccc1 c4f4159780586a9e6a0eb7ac881aaaa0 [1,1,0,0,0,0|0,0,2]=4 5527 B15R1.35 OCCCCCCCNc1ccccc1 bc04f9ce2fa37f06eee67cec10de2e4d [1,1,0,0,0,0|2,0,0]=4 5528 B15R1.35 OCCCCCCNCc1ccccc1 a7d4d1ae14414da20151f87afb5cc46a [1,1,0,0,0,0|1,0,1]=4 5529 B15R1.35 OCCCCNC/C=C/c1ccccc1 82b06966756e9c6f7683f36f3c29a37d [1,1,0,0,0,0|2,0,0]=4 5530 B15R1.35 OCCCCNCC=Cc1ccccc1 a078573260bde81fc9195d6a623ce60c [1,1,0,0,0,0|2,0,0]=4 5531 B15R1.35 OCCCNCC/C=C/c1ccccc1 b743472cb8d05850865731cd1d3b5b44 [1,1,0,0,0,0|2,0,0]=4 5532 B15R1.35 OCCCNCCOCc1ccccc1 519823094044a3916afbb0ff77c45df0 [1,1,0,0,0,0|1,0,1]=4 5533 B15R1.35 OCCNCCCOCc1ccccc1 9750b6db0fc71d54b020fc649f7de9ab [1,1,0,0,0,0|1,0,1]=4 5534 B15R1.35 SCCCCCCOCc1ccccc1 7b6d82e37b31864f932f5101229970a2 [1,1,0,0,0,0|0,0,1]=3 5535 B15R1.35 SCCCCCCOCc1ccccn1 af199c9784435e9b80bc6695b57b71f0 [1,1,0,0,0,0|1,0,1]=4 5536 B15R1.35 SCCCCCCOCc1cccnc1 fb99f6627c8c1ec0c5144bf9434da931 [1,1,0,0,0,0|1,0,1]=4 5537 B15R1.35 SCCCCNC/C=C/c1ccccc1 1e6a1b2385d99f86b336adf0c673c3fc [1,1,0,0,0,0|2,0,0]=4 5538 B15R1.35 SCCCCNCC=Cc1ccccc1 e1375bfa0873e5a07b225a597d90bcfc [1,1,0,0,0,0|2,0,0]=4 5539 B15R1.35 SCCCCOC/C=C/c1ccccc1 9b26b27673b784a4fe7619bd20e566ac [1,1,0,0,0,0|2,0,0]=4 5540 B15R1.35 SCCCCOCC=Cc1ccccc1 d9904ec6913383bce96dbff51a39293b [1,1,0,0,0,0|2,0,0]=4 5541 B15R1.35 SCCCNCC/C=C/c1ccccc1 0eb26dac8901964fbd1719a7d0c76846 [1,1,0,0,0,0|2,0,0]=4 5542 B15R1.35 SCCCOCCOCc1ccccc1 18d4f9e50c662736f2ff2afa5352424f [1,1,0,0,0,0|1,0,1]=4 5543 B15R1.35 SCCNCCCOCc1ccccc1 b41821e9c51fff94846efaa0504a88e7 [1,1,0,0,0,0|1,0,1]=4 5544 B15R1.35 SCCOCCCOCc1ccccc1 707ae5cc5cc77a8a2fff8dc8a4713dc0 [1,1,0,0,0,0|1,0,1]=4 5545 B15R1.78 CCCCCC(C)NCc1ccccc1 9f8d1d82eab10443e7932883a7d2cadc [1,1,0,0,0,0|1,0,1]=4 5546 B15R1.78 CCCCCC(C)OCc1ccccc1 164aa4be4da51dc2e4ef365a91c6b94d [1,1,0,0,0,0|0,0,1]=3 5547 B15R1.78 CCCCCC(C)OCc1ccccn1 91a4a14a27b2de9b0783db6e73d08046 [1,1,0,0,0,0|1,0,1]=4 5548 B15R1.78 CCCCCC(C)OCc1cccnc1 e894b6fd8759680421df596d15b77afa [1,1,0,0,0,0|1,0,1]=4 5549 B15R1.78 CCCCCC(C)OCc1ccncc1 5d4c284879f824c6d712df0163a7c889 [1,1,0,0,0,0|1,0,1]=4 5550 B15R1.78 CCCCC[C@@H](C)OCc1ccccc1 28d35c123f9c07a0854e11cb42839d05 [1,1,0,0,0,0|0,0,1]=3 5551 B15R1.78 CCCCC[C@@H](C)OCc1ccccn1 49994462b404d6ecc440e65d1814070e [1,1,0,0,0,0|1,0,1]=4 5552 B15R1.78 CCCCC[C@@H](C)OCc1cccnc1 5c5032470beced7bcaabb9de4a79dd64 [1,1,0,0,0,0|1,0,1]=4 5553 B15R1.78 CCCCC[C@H](C)NCc1ccccc1 8e19ea4dcfd8debfe9064dc2a14ea8ad [1,1,0,0,0,0|1,0,1]=4 5554 B15R1.78 CCCCC[C@H](C)OCc1ccccc1 e7a1be92c819339ca26afd4d6cce71fd [1,1,0,0,0,0|0,0,1]=3 5555 B15R1.78 CCCCC[C@H](C)OCc1ccccn1 c52c078e7378edabe104673274f1a158 [1,1,0,0,0,0|1,0,1]=4 5556 B15R1.78 CCCCC[C@H](C)OCc1cccnc1 4b37dd3f935a0ecc95049d5eada5e19b [1,1,0,0,0,0|1,0,1]=4 5557 B15R1.78 CCCCC[C@H](C)OCc1ccncc1 7c959ab7528d4eaf80bb0d415d786c5b [1,1,0,0,0,0|1,0,1]=4 5558 B15R1.78 CCCCO[C@@H](C)/C=C/c1ccccc1 bb10ab03295069e50e41ba757799a637 [1,1,0,0,0,0|2,0,0]=4 5559 B15R1.78 CCCCO[C@H](C)/C=C/c1ccccc1 bf0a5a3276a8d5b284903e9c461b6df5 [1,1,0,0,0,0|2,0,0]=4 5560 B15R1.78 CCCOCC(C)OCc1ccccc1 bb72d6a8c8b5ae32697e4bfd38d01e50 [1,1,0,0,0,0|1,0,1]=4 5561 B15R1.78 CCCOC[C@@H](C)OCc1ccccc1 d8440b28c3b84b903c06491e08e4d236 [1,1,0,0,0,0|1,0,1]=4 5562 B15R1.78 CCCOC[C@H](C)OCc1ccccc1 ba0df5c9eb886ba58b2fa8c809bb1dd4 [1,1,0,0,0,0|1,0,1]=4 5563 B15R1.83 CCCCCCC(=O)Nc1ccccc1 297f2f73893c257e64b6989b1bf54f57 [1,1,0,0,0,0|2,0,0]=4 5564 B15R1.83 CCCCCCC(C)Nc1ccccc1 c0c3ffc52fa5ffe068cbd96c72210086 [1,1,0,0,0,0|2,0,0]=4 5565 B15R1.83 CCCCCCN(C)Cc1ccccc1 e069d188d7b09c258bf2e85af2ca03fb [1,1,0,0,0,0|1,0,1]=4 5566 B15R1.83 CCCCCC[C@@H](C)Nc1ccccc1 2f81a37c0f7c86345b6cc24f65c4558a [1,1,0,0,0,0|2,0,0]=4 5567 B15R1.83 CCCCCC[C@H](C)Nc1ccccc1 6152cce6200419557dcc9f52a57215a6 [1,1,0,0,0,0|2,0,0]=4 5568 B15R1.83 CCCCOC/C(=C/c1ccccc1)/C 59af07652eb2c576401ef29486559b25 [1,1,0,0,0,0|2,0,0]=4 5569 B15R1.106 CCCCCCCNc1cccc(c1)Br c1abfe1fdddbba73d4eaee9bbf6fb663 [1,1,0,0,0,0|2,0,0]=4 5570 B15R1.106 CCCCCCCNc1cccc(c1)C acf2fb5e21823add1af1064321be381a [1,1,0,0,0,0|2,0,0]=4 5571 B15R1.106 CCCCCCCNc1cccc(c1)Cl dd3b75fda5d688907a72e94f5a587891 [1,1,0,0,0,0|2,0,0]=4 5572 B15R1.106 CCCCCCCNc1cccc(c1)F a548f95293f3dc06ced70e0f24244af0 [1,1,0,0,0,0|2,0,0]=4 5573 B15R1.106 CCCCCCCNc1cccc(c1)I 83ec5a4e02bd83f3ed7d6d3da146910c [1,1,0,0,0,0|2,0,0]=4 5574 B15R1.106 CCCCCCCNc1cccc(c1)O da6b4bf9ee1d555afa965e8319fab278 [1,1,0,0,0,0|2,0,0]=4 5575 B15R1.106 CCCCCCCNc1cccc(c1)S fa9b8c9a70ae77ddb9ced86bfe58becb [1,1,0,0,0,0|2,0,0]=4 5576 B15R1.106 CCCCCCCOc1cccc(c1)Br ccff89ab7e5f265f32169fe188c2486f [1,1,0,0,0,0|2,0,0]=4 5577 B15R1.106 CCCCCCCOc1cccc(c1)C 982befca752cc3eea827f343ba350151 [1,1,0,0,0,0|2,0,0]=4 5578 B15R1.106 CCCCCCCOc1cccc(c1)Cl 9448067e8e85f5968bf042a37d01a7ba [1,1,0,0,0,0|2,0,0]=4 5579 B15R1.106 CCCCCCCOc1cccc(c1)F da193ff26e2a17697db9ee2001981ab1 [1,1,0,0,0,0|2,0,0]=4 5580 B15R1.106 CCCCCCCOc1cccc(c1)I 58f6d0520dfeb1dcf9991b165c22c0a5 [1,1,0,0,0,0|2,0,0]=4 5581 B15R1.106 CCCCCCCOc1cccc(c1)S fe01047c1c7474158a18a4f08fca266e [1,1,0,0,0,0|2,0,0]=4 5582 B15R1.106 CCCCCCNCc1cccc(c1)Br 941662d5e2795909c42e29c60663ce4d [1,1,0,0,0,0|1,0,1]=4 5583 B15R1.106 CCCCCCNCc1cccc(c1)C dd53cd1af2d195d448acd0f927a17222 [1,1,0,0,0,0|1,0,1]=4 5584 B15R1.106 CCCCCCNCc1cccc(c1)Cl 07f7aa0730a197fd8c79ac2e0e1d8944 [1,1,0,0,0,0|1,0,1]=4 5585 B15R1.106 CCCCCCNCc1cccc(c1)F 2cc8a0cfee311e9f024a6f5a02336518 [1,1,0,0,0,0|1,0,1]=4 5586 B15R1.106 CCCCCCNCc1cccc(c1)I fc8b16ac1b715e3b5235c832ff4edf50 [1,1,0,0,0,0|1,0,1]=4 5587 B15R1.106 CCCCCCOCc1cc(ccn1)Br 6912b019dc3f087525783ced23046163 [1,1,0,0,0,0|1,0,1]=4 5588 B15R1.106 CCCCCCOCc1cc(ccn1)C 010d5cb79afd6b753d98ec2fcca96316 [1,1,0,0,0,0|1,0,1]=4 5589 B15R1.106 CCCCCCOCc1cc(ccn1)Cl 02f946e2956a9135bb27cd85913bf3a7 [1,1,0,0,0,0|1,0,1]=4 5590 B15R1.106 CCCCCCOCc1cc(ccn1)F bca84d5d5b991f67d9f81a73325fd04c [1,1,0,0,0,0|1,0,1]=4 5591 B15R1.106 CCCCCCOCc1cc(ccn1)I 2451718f1cfb24ebea47ef28d5c46e30 [1,1,0,0,0,0|1,0,1]=4 5592 B15R1.106 CCCCCCOCc1cc[nH]c(=O)c1 6ded2448880ba184a40a543ce90cb691 [1,1,0,0,0,0|1,0,1]=4 5593 B15R1.106 CCCCCCOCc1ccc[n+](c1)[O-] 2651f230ef8ca284f80809a50fb8af52 [1,1,0,0,0,0|1,0,1]=4 5594 B15R1.106 CCCCCCOCc1cccc(c1)Br 344cff9543b23b2041c601e01d0f8526 [1,1,0,0,0,0|0,0,1]=3 5595 B15R1.106 CCCCCCOCc1cccc(c1)C 3a3d00d8904a69473a587c7d8750cce4 [1,1,0,0,0,0|0,0,1]=3 5596 B15R1.106 CCCCCCOCc1cccc(c1)Cl 9fd689cb935ef60f81ec3b07144f712e [1,1,0,0,0,0|0,0,1]=3 5597 B15R1.106 CCCCCCOCc1cccc(c1)F a8958ef4b5bd1c2835e29fe133917a44 [1,1,0,0,0,0|0,0,1]=3 5598 B15R1.106 CCCCCCOCc1cccc(c1)I 16fc267c27e9b1aecbc1e22f0cbd367c [1,1,0,0,0,0|0,0,1]=3 5599 B15R1.106 CCCCCCOCc1cccc(n1)Br be3ba815b92a23f82e17dfda6de9c083 [1,1,0,0,0,0|1,0,1]=4 5600 B15R1.106 CCCCCCOCc1cccc(n1)C d2188ad539574ac015a22a2243984bbf [1,1,0,0,0,0|1,0,1]=4 5601 B15R1.106 CCCCCCOCc1cccc(n1)Cl eeb673e9688e8ec07369fbafec5e4b1a [1,1,0,0,0,0|1,0,1]=4 5602 B15R1.106 CCCCCCOCc1cccc(n1)F 631ab4666bbfd9e93e28c327470ad1fb [1,1,0,0,0,0|1,0,1]=4 5603 B15R1.106 CCCCCCOCc1cccc(n1)I 299e7fb5f7a16745d31beb1ccf835752 [1,1,0,0,0,0|1,0,1]=4 5604 B15R1.106 CCCCCCOCc1ccnc(c1)Br 2dd615d5ed8e6f312d01832432d02e51 [1,1,0,0,0,0|1,0,1]=4 5605 B15R1.106 CCCCCCOCc1ccnc(c1)C ddb02e7a6d317853872f0d7f4fc28adf [1,1,0,0,0,0|1,0,1]=4 5606 B15R1.106 CCCCCCOCc1ccnc(c1)Cl e886a5d6aad717efe52f9b64905a4fd5 [1,1,0,0,0,0|1,0,1]=4 5607 B15R1.106 CCCCCCOCc1ccnc(c1)F 381c35e1178d0f19952435d7f5d835bb [1,1,0,0,0,0|1,0,1]=4 5608 B15R1.106 CCCCCCOCc1cncc(c1)Br afd9389ac5d2121c8a92d785064f4756 [1,1,0,0,0,0|1,0,1]=4 5609 B15R1.106 CCCCCCOCc1cncc(c1)Cl 038e666cf6c57eb64d03c1ca2e352e03 [1,1,0,0,0,0|1,0,1]=4 5610 B15R1.106 CCCCCCOCc1cncc(c1)F 53035692ca0b9efdcbf0bae7a9d1852c [1,1,0,0,0,0|1,0,1]=4 5611 B15R1.106 CCCCCCOCc1cncc(c1)I cc506ff97ecf3f8e0137fd8a8fc1b7a7 [1,1,0,0,0,0|1,0,1]=4 5612 B15R1.106 CCCCOC/C=C/c1cccc(c1)Br 981a15c68836a7e38b766eb7739df3f8 [1,1,0,0,0,0|2,0,0]=4 5613 B15R1.106 CCCCOC/C=C/c1cccc(c1)F 2c1d4c47f18b4f3e8e99d634368105ce [1,1,0,0,0,0|2,0,0]=4 5614 B15R1.106 CCCCOCOCc1cccc(c1)Br 7351088f2663adabf21d7851bd1e2d3e [1,1,0,0,0,0|1,0,1]=4 5615 B15R1.106 CCCCOCOCc1cccc(c1)C 3fd1ddf1abe2aa11edb9a4f775fd6f56 [1,1,0,0,0,0|1,0,1]=4 5616 B15R1.106 CCCCOCOCc1cccc(c1)Cl ee71c81448eff3e2c846fb2d824ee0ee [1,1,0,0,0,0|1,0,1]=4 5617 B15R1.106 CCCCOCOCc1cccc(c1)F 542229f2f21ee43694bf53e68d34e9c3 [1,1,0,0,0,0|1,0,1]=4 5618 B15R1.106 CCCCOCOCc1cccc(c1)I 10eeef180d2ee45fb8ea19247253c31b [1,1,0,0,0,0|1,0,1]=4 5619 B15R1.106 CCCOCCOCc1cccc(c1)Br fae2171672f1b0a5a0e9223ced46a0f9 [1,1,0,0,0,0|1,0,1]=4 5620 B15R1.106 CCCOCCOCc1cccc(c1)C 3f5d6403c79ab813df904e08c2e47c23 [1,1,0,0,0,0|1,0,1]=4 5621 B15R1.106 CCCOCCOCc1cccc(c1)Cl fac314f1dca15a89607e8ccac77650dc [1,1,0,0,0,0|1,0,1]=4 5622 B15R1.106 CCCOCCOCc1cccc(c1)F ee5696e060dab139cf74aca7a159bd37 [1,1,0,0,0,0|1,0,1]=4 5623 B15R1.106 CCCOCCOCc1cccc(c1)I 0a9d778e125607f16159a78120d96d05 [1,1,0,0,0,0|1,0,1]=4 5624 B15R1.106 CCCSCCOCc1cccc(c1)Br 261700be3f3ef872c5ec1f59bc3ed418 [1,1,0,0,0,0|1,0,1]=4 5625 B15R1.106 CCCSCCOCc1cccc(c1)C 91f1ea9235ca8fafd1d03e1c86c5c47b [1,1,0,0,0,0|1,0,1]=4 5626 B15R1.106 CCCSCCOCc1cccc(c1)Cl 1095aff4590943b0379b2107344e3950 [1,1,0,0,0,0|1,0,1]=4 5627 B15R1.106 CCCSCCOCc1cccc(c1)F b34c1255065af9d8bf4c476d8b64cb1f [1,1,0,0,0,0|1,0,1]=4 5628 B15R1.106 CCCSCCOCc1cccc(c1)I 9b90011ba58c7a69c6e80eefb50f117b [1,1,0,0,0,0|1,0,1]=4 5629 B15R1.106 CCOCCCOCc1cccc(c1)Br da236b0ddba71616c203b63bad0e1da3 [1,1,0,0,0,0|1,0,1]=4 5630 B15R1.106 CCOCCCOCc1cccc(c1)C 2dbcd8d90a243b2cfb3d6d8479599da4 [1,1,0,0,0,0|1,0,1]=4 5631 B15R1.106 CCOCCCOCc1cccc(c1)Cl 4e28fca0f33600bebc73ee357f16a97d [1,1,0,0,0,0|1,0,1]=4 5632 B15R1.106 CCOCCCOCc1cccc(c1)F 8c3550677f64760ce482a0f3ad7796e1 [1,1,0,0,0,0|1,0,1]=4 5633 B15R1.106 CCOCCCOCc1cccc(c1)I a51116358beee47fd3905e3f467549e6 [1,1,0,0,0,0|1,0,1]=4 5634 B15R1.106 CCSCCCOCc1cccc(c1)Br 1b61b15d04b13244d450bda26465f3c3 [1,1,0,0,0,0|1,0,1]=4 5635 B15R1.106 CCSCCCOCc1cccc(c1)C 5213a613d2a14fd43515c22c5dc866aa [1,1,0,0,0,0|1,0,1]=4 5636 B15R1.106 CCSCCCOCc1cccc(c1)Cl 88c4c0b4eb31bbacbee085306a0d6bfb [1,1,0,0,0,0|1,0,1]=4 5637 B15R1.106 CCSCCCOCc1cccc(c1)F bedd06d56923892288f0bbf91ec0a0fc [1,1,0,0,0,0|1,0,1]=4 5638 B15R1.106 CCSCCCOCc1cccc(c1)I a832dfaf116d277462ebe30134b64602 [1,1,0,0,0,0|1,0,1]=4 5639 B15R1.106 COCCCCOCc1cccc(c1)Br add817e6d56ca05f5031b9efa4ceadbf [1,1,0,0,0,0|1,0,1]=4 5640 B15R1.106 COCCCCOCc1cccc(c1)C 48f835c4a9f93fdad67d6e0a976346be [1,1,0,0,0,0|1,0,1]=4 5641 B15R1.106 COCCCCOCc1cccc(c1)Cl 491b449277c67989826820b2ed2f104e [1,1,0,0,0,0|1,0,1]=4 5642 B15R1.106 COCCCCOCc1cccc(c1)F 35d392b39045e879e9c0a9880330d3e6 [1,1,0,0,0,0|1,0,1]=4 5643 B15R1.106 COCCCCOCc1cccc(c1)I df474734b4afb7f2bff15d4233619d98 [1,1,0,0,0,0|1,0,1]=4 5644 B15R1.106 CSCCCCOCc1cccc(c1)Br 95b3f8fd472305544085808b0399dae8 [1,1,0,0,0,0|1,0,1]=4 5645 B15R1.106 CSCCCCOCc1cccc(c1)C 8afc927730a3b91416e3dcb63482a5f0 [1,1,0,0,0,0|1,0,1]=4 5646 B15R1.106 CSCCCCOCc1cccc(c1)Cl 9cdcc8144ed8329f5ea730e9ca380021 [1,1,0,0,0,0|1,0,1]=4 5647 B15R1.106 CSCCCCOCc1cccc(c1)F 5193436cf0e2e26e04a30507e67657c1 [1,1,0,0,0,0|1,0,1]=4 5648 B15R1.106 CSCCCCOCc1cccc(c1)I c8ab444aefc0be117761d393e2ba84c6 [1,1,0,0,0,0|1,0,1]=4 5649 B15R1.106 Cc1cccc(c1)COCCCCCF d3505435b420b94021dd3f82578dfc64 [1,1,0,0,0,0|1,0,1]=4 5650 B15R1.106 FCCCCCOCc1cccc(c1)Br 7dcd3fc262e87d0168958276b7e10488 [1,1,0,0,0,0|1,0,1]=4 5651 B15R1.106 FCCCCCOCc1cccc(c1)Cl 80fdb48c891007aed4b09cfaf8c8d557 [1,1,0,0,0,0|1,0,1]=4 5652 B15R1.106 FCCCCCOCc1cccc(c1)F 37c4b61160ee542573ebfe30e5a3058b [1,1,0,0,0,0|1,0,1]=4 5653 B15R1.106 FCCCCCOCc1cccc(c1)I 7d3e8bb7c8b4226a62253c8bfc4a55a1 [1,1,0,0,0,0|1,0,1]=4 5654 B15R1.157 CCCCC(C)COCc1ccccc1 41c93374e13100bae52be8cce110b32c [1,1,0,0,0,0|0,0,1]=3 5655 B15R1.157 CCCCC(C)COCc1ccccn1 87324d57f8fb457e59d740f98dcbaaef [1,1,0,0,0,0|1,0,1]=4 5656 B15R1.157 CCCCC(C)COCc1cccnc1 c9d8b87df51cb609c844d5bf1f91c255 [1,1,0,0,0,0|1,0,1]=4 5657 B15R1.157 CCCCC(O)CNCc1ccccc1 0abff25ea36fb19bf5d6771bd07ebab2 [1,1,0,0,0,0|1,0,1]=4 5658 B15R1.157 CCCCN(C)C/C=C/c1ccccc1 e8ec0261b8fab5309d2ab77ae007e271 [1,1,0,0,0,0|2,0,0]=4 5659 B15R1.157 CCCCN(C)COCc1ccccc1 d3fdedbb4ea77aace9e80d4268b69e9a [1,1,0,0,0,0|1,0,1]=4 5660 B15R1.157 CCCNC(C)COCc1ccccc1 ef89cdafa600d945a6c4811775c64c73 [1,1,0,0,0,0|1,0,1]=4 5661 B15R1.157 CCCN[C@@H](C)COCc1ccccc1 57a093d9710cc82f87d8c26aa21b8169 [1,1,0,0,0,0|1,0,1]=4 5662 B15R1.157 CCCOC(C)COCc1ccccc1 01765172929abae80fcd4eee84d442c6 [1,1,0,0,0,0|1,0,1]=4 5663 B15R1.157 CCCO[C@@H](C)COCc1ccccc1 d51eca82e056d17e3d5d29b465a44445 [1,1,0,0,0,0|1,0,1]=4 5664 B15R1.157 CCCO[C@H](C)COCc1ccccc1 aee9644b7bc040f9a1ba9aa51d6695cc [1,1,0,0,0,0|1,0,1]=4 5665 B15R1.157 CCNCC(O)COCc1ccccc1 648b793b0dd8bdbb8b74a62765ce820d [1,1,0,0,0,0|1,0,1]=4 5666 B15R1.157 CCNC[C@@H](O)COCc1ccccc1 f8a7480f10fbf0d261fd746c36771b04 [1,1,0,0,0,0|1,0,1]=4 5667 B15R1.157 CCNC[C@H](O)COCc1ccccc1 9657969c298b986fc638217dd1855004 [1,1,0,0,0,0|1,0,1]=4 5668 B15R1.157 CCOCC(C)COCc1ccccc1 2b75598bf584dda903d4ccb2cd706aec [1,1,0,0,0,0|1,0,1]=4 5669 B15R1.220 CCCCCCCNc1ccccc1C b869a80c652224c992dad0a750706be6 [1,1,0,0,0,0|2,0,0]=4 5670 B15R1.220 CCCCCCCNc1ccccc1Cl a400f762f0595fcfcb409bb87ddd121f [1,1,0,0,0,0|2,0,0]=4 5671 B15R1.220 CCCCCCCNc1ccccc1F 4dc6278c38097b1cce6dc824a6a4e071 [1,1,0,0,0,0|2,0,0]=4 5672 B15R1.220 CCCCCCCNc1ccccc1I 64ed2fb508dfb8b6d8f602caed99020b [1,1,0,0,0,0|2,0,0]=4 5673 B15R1.220 CCCCCCCNc1ccccc1S 04361bd00c5fc952edeafbafefb9cbd7 [1,1,0,0,0,0|2,0,0]=4 5674 B15R1.220 CCCCCCCOc1ccccc1C 447678a35e1cf1d4d2fe24936f4445e9 [1,1,0,0,0,0|2,0,0]=4 5675 B15R1.220 CCCCCCCOc1ccccc1Cl 9d50acaaf2fb5e4754ca1424819b0146 [1,1,0,0,0,0|2,0,0]=4 5676 B15R1.220 CCCCCCCOc1ccccc1F 3d5b55bff657c5e01acda6b57f89ebde [1,1,0,0,0,0|2,0,0]=4 5677 B15R1.220 CCCCCCCOc1ccccc1I 97de8b67d64f0d6e18079fa358ff1631 [1,1,0,0,0,0|2,0,0]=4 5678 B15R1.220 CCCCCCNCc1ccccc1C 848f99a9db05b4410e74b6d8c46d4490 [1,1,0,0,0,0|1,0,1]=4 5679 B15R1.220 CCCCCCNCc1ccccc1Cl f800ea5708efda9fe96cfab20059f2f1 [1,1,0,0,0,0|1,0,1]=4 5680 B15R1.220 CCCCCCNCc1ccccc1F a9b37b05ce9b37e307a0913dd09ae186 [1,1,0,0,0,0|1,0,1]=4 5681 B15R1.220 CCCCCCNCc1ccccc1I ab6a71472cffe306d9f9b98bbb92078c [1,1,0,0,0,0|1,0,1]=4 5682 B15R1.220 CCCCCCOCc1ccc[nH]c1=O ad52c8f15cc7de4310e26e8fd23d8acb [1,1,0,0,0,0|1,0,1]=4 5683 B15R1.220 CCCCCCOCc1ccccc1C 6d52b61931fe18adbb6af56893265a03 [1,1,0,0,0,0|0,0,1]=3 5684 B15R1.220 CCCCCCOCc1ccccc1Cl 491e10f9eaf90285fd8fb9ef83723ab5 [1,1,0,0,0,0|0,0,1]=3 5685 B15R1.220 CCCCCCOCc1ccccc1F fdad9869852a172435d57428627d3bb6 [1,1,0,0,0,0|0,0,1]=3 5686 B15R1.220 CCCCCCOCc1ccccc1I bbb149c2435d19f94e148d9690afa856 [1,1,0,0,0,0|0,0,1]=3 5687 B15R1.220 CCCCCCOCc1cccnc1Br efb722bd23e171b022a78d912638003e [1,1,0,0,0,0|1,0,1]=4 5688 B15R1.220 CCCCCCOCc1cccnc1C 21c0027b79e327beb4b8486fe768f131 [1,1,0,0,0,0|1,0,1]=4 5689 B15R1.220 CCCCCCOCc1cccnc1Cl 1746e92c65ca00c3c9c85bb864acfab3 [1,1,0,0,0,0|1,0,1]=4 5690 B15R1.220 CCCCCCOCc1cccnc1F 7c5ad676aa15f82a9af3a142a9dd57ad [1,1,0,0,0,0|1,0,1]=4 5691 B15R1.220 CCCCCCOCc1ccncc1Br 8e625b0d3ded3c2b7af9b0461ba1cdf2 [1,1,0,0,0,0|1,0,1]=4 5692 B15R1.220 CCCCCCOCc1ccncc1C a8c3b6ba407bd31de2c5d2e7e60a4741 [1,1,0,0,0,0|1,0,1]=4 5693 B15R1.220 CCCCCCOCc1ccncc1Cl bb54eb7a0f11c03c4cb71a1dc948301a [1,1,0,0,0,0|1,0,1]=4 5694 B15R1.220 CCCCCCOCc1ccncc1F 00d9b29891eeb6c3b8bf4d0e1a5cedda [1,1,0,0,0,0|1,0,1]=4 5695 B15R1.220 CCCCCCOCc1ccncc1I 28f8125491512a5eab08999ab2841319 [1,1,0,0,0,0|1,0,1]=4 5696 B15R1.220 CCCCCCOCc1cnccc1C 81c9ef27ba0a5bd509f997c155c5cc8f [1,1,0,0,0,0|1,0,1]=4 5697 B15R1.220 CCCCCCOCc1cnccc1Cl ecf99c039c1304282e6c444b5972f57f [1,1,0,0,0,0|1,0,1]=4 5698 B15R1.220 CCCCCCOCc1cnccc1F 861bc050e0d5595f50a782dbb806033a [1,1,0,0,0,0|1,0,1]=4 5699 B15R1.220 CCCCCCOCc1ncccc1Br 16da8ac23cb4de77038b54bbd1f0bef0 [1,1,0,0,0,0|1,0,1]=4 5700 B15R1.220 CCCCCCOCc1ncccc1C b9ddd1a2b9c60293ffbb32f2ee3edd27 [1,1,0,0,0,0|1,0,1]=4 5701 B15R1.220 CCCCCCOCc1ncccc1Cl e025bb65958c3f4e05bd24070adc961f [1,1,0,0,0,0|1,0,1]=4 5702 B15R1.220 CCCCCCOCc1ncccc1F 89bfee293b1da1788a158a65410c7369 [1,1,0,0,0,0|1,0,1]=4 5703 B15R1.220 CCCCOC/C=C/c1ccccc1C eefdfb649f27111560ffc627aee4bdb0 [1,1,0,0,0,0|2,0,0]=4 5704 B15R1.220 CCCCOC/C=C/c1ccccc1Cl 0c5780d9545bb55104395c3d043a1d23 [1,1,0,0,0,0|2,0,0]=4 5705 B15R1.220 CCCCOC/C=C/c1ccccc1F 68624b68eae7d81dfc2cb380ab91ff2a [1,1,0,0,0,0|2,0,0]=4 5706 B15R1.220 CCCCOCOCc1ccccc1Cl 253933536712554b7aeff03e2e1441c9 [1,1,0,0,0,0|1,0,1]=4 5707 B15R1.220 CCCCOCOCc1ccccc1F c038cf4fc73c6984d831c319433ec0c1 [1,1,0,0,0,0|1,0,1]=4 5708 B15R1.220 CCCCOCOCc1ccccc1I e18813ce6280bf6223ad3c94a75996b8 [1,1,0,0,0,0|1,0,1]=4 5709 B15R1.220 CCCNCCOCc1ccccc1Cl 45ee7e7383188789824078a6c39bd566 [1,1,0,0,0,0|1,0,1]=4 5710 B15R1.220 CCCOCCOCc1ccccc1Br 4aa694c92e50954d7b40d5b4437767d5 [1,1,0,0,0,0|1,0,1]=4 5711 B15R1.220 CCCOCCOCc1ccccc1C c680041fca30ff3502d53f6b525086b6 [1,1,0,0,0,0|1,0,1]=4 5712 B15R1.220 CCCOCCOCc1ccccc1Cl 56308cb77168d706e7f002bfecbf6a9e [1,1,0,0,0,0|1,0,1]=4 5713 B15R1.220 CCCOCCOCc1ccccc1F 5e70678bba512dbdb1df1a271c5b7722 [1,1,0,0,0,0|1,0,1]=4 5714 B15R1.220 CCCOCCOCc1ccccc1I b3604fa2269e3ece1d4573ef409c8a9a [1,1,0,0,0,0|1,0,1]=4 5715 B15R1.220 CCCOCCOCc1ccccc1S 3e7d05488ee03b2abe86295bfb4f6b5f [1,1,0,0,0,0|1,0,1]=4 5716 B15R1.220 CCCSCCOCc1ccccc1C 1e296459c53bac6efaea9b1ecd3593e0 [1,1,0,0,0,0|1,0,1]=4 5717 B15R1.220 CCCSCCOCc1ccccc1Cl e9f92399fbfa135a352cc97bf047f260 [1,1,0,0,0,0|1,0,1]=4 5718 B15R1.220 CCCSCCOCc1ccccc1F a8aab68621535a53300875d2a5a4b74f [1,1,0,0,0,0|1,0,1]=4 5719 B15R1.220 CCCSCCOCc1ccccc1I 42b2791de3db6e1cd0f66af40e3ac241 [1,1,0,0,0,0|1,0,1]=4 5720 B15R1.220 CCOCCCOCc1ccccc1Br 741ea7db3e8e87870fd92e2c92ecc7e7 [1,1,0,0,0,0|1,0,1]=4 5721 B15R1.220 CCOCCCOCc1ccccc1C 9f36db04e244f5094dfff83e674bcae7 [1,1,0,0,0,0|1,0,1]=4 5722 B15R1.220 CCOCCCOCc1ccccc1Cl 3898f4b4615e71f59b843534644af220 [1,1,0,0,0,0|1,0,1]=4 5723 B15R1.220 CCOCCCOCc1ccccc1F d7e9b9f4c39184a81b0cd5cec3cbdf5d [1,1,0,0,0,0|1,0,1]=4 5724 B15R1.220 CCOCCCOCc1ccccc1I 2285b0629b2cfc53296b67a414bdfd44 [1,1,0,0,0,0|1,0,1]=4 5725 B15R1.220 CCOCCCOCc1ccccc1S 72d0dcb436aafc8d786c905501683dc1 [1,1,0,0,0,0|1,0,1]=4 5726 B15R1.220 CCSCCCOCc1ccccc1Br 550c962a9b686e1f1385a4ff3fa6053b [1,1,0,0,0,0|1,0,1]=4 5727 B15R1.220 CCSCCCOCc1ccccc1C 72881376f395d8a7345e5c2a889b245d [1,1,0,0,0,0|1,0,1]=4 5728 B15R1.220 CCSCCCOCc1ccccc1Cl c02d80b862bd86ea508b7d9b547b418f [1,1,0,0,0,0|1,0,1]=4 5729 B15R1.220 CCSCCCOCc1ccccc1F 0c087643ea8cb87cf53d0cda082215a5 [1,1,0,0,0,0|1,0,1]=4 5730 B15R1.220 CCSCCCOCc1ccccc1I ce88238cfc0667f07726c077d85155ba [1,1,0,0,0,0|1,0,1]=4 5731 B15R1.220 CCSCCCOCc1ccccc1S ac515456b55b32eba3c6cb7b8d932908 [1,1,0,0,0,0|1,0,1]=4 5732 B15R1.220 COCCCCOCc1ccccc1Br 2ce34f90f244dfe7c736f657a54670d3 [1,1,0,0,0,0|1,0,1]=4 5733 B15R1.220 COCCCCOCc1ccccc1C fe2741979d677799103c08934890cd68 [1,1,0,0,0,0|1,0,1]=4 5734 B15R1.220 COCCCCOCc1ccccc1Cl b1da2a54f8c01b1bf4ed6fee21668289 [1,1,0,0,0,0|1,0,1]=4 5735 B15R1.220 COCCCCOCc1ccccc1F cdc7858f6e41728dd6b73206d5221a02 [1,1,0,0,0,0|1,0,1]=4 5736 B15R1.220 COCCCCOCc1ccccc1I b9d46f444a1343fe5c89511343e6ad5b [1,1,0,0,0,0|1,0,1]=4 5737 B15R1.220 COCCCCOCc1ccccc1S c1861ab51a7599ee63690b091cb59bd4 [1,1,0,0,0,0|1,0,1]=4 5738 B15R1.220 CSCCCCOCc1ccccc1C 3f469889880bcd37abe490b3ed70ca4e [1,1,0,0,0,0|1,0,1]=4 5739 B15R1.220 CSCCCCOCc1ccccc1Cl 5aa9ba53b759ebb915fc4a7f8f1c4748 [1,1,0,0,0,0|1,0,1]=4 5740 B15R1.220 CSCCCCOCc1ccccc1F 1fe946e0fcb61b2062211b6437750a68 [1,1,0,0,0,0|1,0,1]=4 5741 B15R1.220 CSCCCCOCc1ccccc1I baa18b7dde5066bf473af43826ae5a14 [1,1,0,0,0,0|1,0,1]=4 5742 B15R1.220 Cc1ccccc1COCCCCCF 4f0d51aedf91a51b387c7744083dc446 [1,1,0,0,0,0|1,0,1]=4 5743 B15R1.220 FCCCCCOCc1ccccc1Br 035896cf1bf702f7df2b659dcfa30ae5 [1,1,0,0,0,0|1,0,1]=4 5744 B15R1.220 FCCCCCOCc1ccccc1Cl 283f5826e48e695cf8c503b3ab522da5 [1,1,0,0,0,0|1,0,1]=4 5745 B15R1.220 FCCCCCOCc1ccccc1F e0159eca0485ec867731daeae09a0df9 [1,1,0,0,0,0|1,0,1]=4 5746 B15R1.220 FCCCCCOCc1ccccc1I 48508f95b6b7d10ecd9ca7e3950066ea [1,1,0,0,0,0|1,0,1]=4 5747 B15R1.220 FCCCCCOCc1ccccc1S 127fab3156a162047dd621e91641540a [1,1,0,0,0,0|1,0,1]=4 5748 B15R1.504 CC(=O)CCCCOCc1ccccc1 60104521cb9d2ce2105946d40dc30aff [1,1,0,0,0,0|0,0,2]=4 5749 B15R1.504 CC(C)CCCCCNc1ccccc1 07bae37b63c06d8397c3c170c4974f20 [1,1,0,0,0,0|2,0,0]=4 5750 B15R1.504 CC(C)CCCCNCc1ccccc1 e6269ffda20592b4fa8372ce1342eb23 [1,1,0,0,0,0|1,0,1]=4 5751 B15R1.504 CC(C)CCCCOCc1ccccc1 41ca4626bf277671d91bcf6f6fbdeafb [1,1,0,0,0,0|0,0,1]=3 5752 B15R1.504 CC(C)CCCCOCc1ccccn1 be4d1a4d90edb678de97337b7f896bbc [1,1,0,0,0,0|1,0,1]=4 5753 B15R1.504 CC(C)CCCCOCc1cccnc1 56ad612c851bc733d60043b28235d1d2 [1,1,0,0,0,0|1,0,1]=4 5754 B15R1.504 CC(C)CCCCOCc1ccncc1 01b0a21541b0d063cebdfa7cc2f6b8bf [1,1,0,0,0,0|1,0,1]=4 5755 B15R1.504 CC(C)CCNC/C=C/c1ccccc1 cce3306ab04d12faf9bdeaf03f11f5b8 [1,1,0,0,0,0|2,0,0]=4 5756 B15R1.504 CC(C)CCNCOCc1ccccc1 157c0b906bb216b20f76ee23f77166c1 [1,1,0,0,0,0|1,0,1]=4 5757 B15R1.504 CC(C)CCOC/C=C/c1ccccc1 6000795b1fb60c046b573dc793784f7a [1,1,0,0,0,0|2,0,0]=4 5758 B15R1.504 CC(C)CCOC/C=C\c1ccccc1 e124672c6f9b6c138755fb8980478299 [1,1,0,0,0,0|2,0,0]=4 5759 B15R1.504 CC(C)CCOCC=Cc1ccccc1 073ab8339c1ef16e157c7854ed46d478 [1,1,0,0,0,0|2,0,0]=4 5760 B15R1.504 CC(C)CNCC/C=C/c1ccccc1 2a9346647e53281412fbecb8be792310 [1,1,0,0,0,0|2,0,0]=4 5761 B15R1.504 CC(C)CNCCOCc1ccccc1 82495e0f978d03ddd7d37f4cce04f411 [1,1,0,0,0,0|1,0,1]=4 5762 B15R1.504 CC(C)COCCOCc1ccccc1 f37e01dd20105d42a1678b4030af0ff6 [1,1,0,0,0,0|1,0,1]=4 5763 B15R1.504 CC(C)CSCCOCc1ccccc1 4a03da2da0b1ac6190f52b99dab5ff4d [1,1,0,0,0,0|1,0,1]=4 5764 B15R1.504 CC(C)NCCCOCc1ccccc1 129aeccaa0896b89a040730847196522 [1,1,0,0,0,0|1,0,1]=4 5765 B15R1.504 CC(C)OCCCOCc1ccccc1 4c73cb3f7ba77482af75ab91b34c1605 [1,1,0,0,0,0|1,0,1]=4 5766 B15R1.504 CC(C)SCCCOCc1ccccc1 74087477f2d1982a7e4890da19018256 [1,1,0,0,0,0|1,0,1]=4 5767 B15R1.504 CC(F)COCCOCc1ccccc1 b1c958bc94fbf919475cf6462d75c416 [1,1,0,0,0,0|1,0,1]=4 5768 B15R1.504 CC(O)CCCCNCc1ccccc1 f47eeb2199d545a3e8dc307ca5a8882c [1,1,0,0,0,0|1,0,1]=4 5769 B15R1.504 CC(O)CCNC/C=C/c1ccccc1 d3c38a7e376349b37f03866775d62ad3 [1,1,0,0,0,0|2,0,0]=4 5770 B15R1.504 CC(O)CCNCC=Cc1ccccc1 967679a031632e33726bb3c2dc5808a5 [1,1,0,0,0,0|2,0,0]=4 5771 B15R1.504 CC(O)CCNCOCc1ccccc1 53c52ace7d4300e059f2e7d1df76acaa [1,1,0,0,0,0|1,0,1]=4 5772 B15R1.504 CC(O)CNCC/C=C/c1ccccc1 68b7dc9310b23a5d194b4f72e34f3e5c [1,1,0,0,0,0|2,0,0]=4 5773 B15R1.504 CC(O)CNCCOCc1ccccc1 ca8b54cd418454a4c03162a16632db1b [1,1,0,0,0,0|1,0,1]=4 5774 B15R1.504 CC(S)COCCOCc1ccccc1 aa0dcf312359d8bdfeead51376f95137 [1,1,0,0,0,0|1,0,1]=4 5775 B15R1.504 CN(C)CCCCOCc1ccccc1 3d19c2492c78e20df8d962ff582e56ab [1,1,0,0,0,0|1,0,1]=4 5776 B15R1.504 C[C@@H](F)COCCOCc1ccccc1 dd20fe2860c2c956348c1b482494ed4a [1,1,0,0,0,0|1,0,1]=4 5777 B15R1.504 C[C@@H](O)CCCCNCc1ccccc1 2d2b3eeb8824f996f195275035a55a1a [1,1,0,0,0,0|1,0,1]=4 5778 B15R1.504 C[C@@H](O)CCNC/C=C/c1ccccc1 328ebee98093f4b613686087be2408e3 [1,1,0,0,0,0|2,0,0]=4 5779 B15R1.504 C[C@@H](O)CCNCC=Cc1ccccc1 9d5ee1edcccff6c729e2ba8859c809d5 [1,1,0,0,0,0|2,0,0]=4 5780 B15R1.504 C[C@@H](O)CCNCOCc1ccccc1 05f672e0066b4bcce7795ce1db31246d [1,1,0,0,0,0|1,0,1]=4 5781 B15R1.504 C[C@@H](O)CNCC/C=C/c1ccccc1 5184009efbb0e55df568da9acce8f6a7 [1,1,0,0,0,0|2,0,0]=4 5782 B15R1.504 C[C@@H](O)CNCCOCc1ccccc1 67676a2a7e2a0cbbdf42ad361f8417d2 [1,1,0,0,0,0|1,0,1]=4 5783 B15R1.504 C[C@H](F)COCCOCc1ccccc1 7c412e2e7ece194c8172af968135d1bc [1,1,0,0,0,0|1,0,1]=4 5784 B15R1.504 C[C@H](O)CCNC/C=C/c1ccccc1 5345693ba1b4f82a03e98b062a518485 [1,1,0,0,0,0|2,0,0]=4 5785 B15R1.504 C[C@H](O)CCNCC=Cc1ccccc1 6ac585aa634a4cc4aa3b2f5f16a2a96e [1,1,0,0,0,0|2,0,0]=4 5786 B15R1.504 C[C@H](O)CCNCOCc1ccccc1 510269eb5c173efbfdfe375ce2a40702 [1,1,0,0,0,0|1,0,1]=4 5787 B15R1.504 C[C@H](O)CNCC/C=C/c1ccccc1 79b01ac0846ef860d44686ab2e195dfb [1,1,0,0,0,0|2,0,0]=4 5788 B15R1.504 C[C@H](O)CNCCOCc1ccccc1 a0a17e7af16af97d4f856ac50152a506 [1,1,0,0,0,0|1,0,1]=4 5789 B15R1.778 CCCC(C)CCOCc1ccccc1 e12710b0366a5c379fe0649d079ff812 [1,1,0,0,0,0|0,0,1]=3 5790 B15R1.778 CCCC(C)CCOCc1ccccn1 93b0f4c5df6b2766dcfb011553f83e9f [1,1,0,0,0,0|1,0,1]=4 5791 B15R1.778 CCCC(C)CCOCc1cccnc1 03d08b611f45202221c2fd9841095a0d [1,1,0,0,0,0|1,0,1]=4 5792 B15R1.778 CCCC(C)NC/C=C/c1ccccc1 7dbc04d46d86cf232a6738a7e5a6b456 [1,1,0,0,0,0|2,0,0]=4 5793 B15R1.778 CCCC(C)NCOCc1ccccc1 f54176a47fb548ed68bce0d5eef8097e [1,1,0,0,0,0|1,0,1]=4 5794 B15R1.778 CCCC(S)CCOCc1ccccc1 28550760fdba0a2ca3f1728c28eb3fbe [1,1,0,0,0,0|0,0,1]=3 5795 B15R1.778 CCCC(S)CCOCc1ccccn1 4fe30205b03d883f5ff4156ae9af1498 [1,1,0,0,0,0|1,0,1]=4 5796 B15R1.778 CCCC(S)CCOCc1cccnc1 99151a54a2b44e9dfcf862c22726bad7 [1,1,0,0,0,0|1,0,1]=4 5797 B15R1.778 CCCN(C)CCOCc1ccccc1 026cdb1a4837f8f5e0e6e676d0c3b1db [1,1,0,0,0,0|1,0,1]=4 5798 B15R1.778 CCC[C@H](C)NCOCc1ccccc1 1cc52a4b291e64f5efb1ac372f8e6737 [1,1,0,0,0,0|1,0,1]=4 5799 B15R1.962 CCC(C)CCCOCc1ccccc1 8ef74be099bf6f4c920205501eeef862 [1,1,0,0,0,0|0,0,1]=3 5800 B15R1.962 CCC(C)CCCOCc1ccccn1 550477c26c97c196baef775be0bdf16c [1,1,0,0,0,0|1,0,1]=4 5801 B15R1.962 CCC(C)CCCOCc1cccnc1 4e3ce8cdcfe103156195eca7f62dd954 [1,1,0,0,0,0|1,0,1]=4 5802 B15R1.962 CCC(C)CNC/C=C/c1ccccc1 40bcde1365cf0c0cb37981fa138c2802 [1,1,0,0,0,0|2,0,0]=4 5803 B15R1.962 CCC(C)CNCOCc1ccccc1 653d5ff4e033cfe659879a5497efdff4 [1,1,0,0,0,0|1,0,1]=4 5804 B15R1.962 CCC(C)COC/C=C/c1ccccc1 a95fbcd9b593a6780d935c952fa49fb6 [1,1,0,0,0,0|2,0,0]=4 5805 B15R1.962 CCC(C)COC/C=C\c1ccccc1 8e543822a7f50cefee7f814b152ca70f [1,1,0,0,0,0|2,0,0]=4 5806 B15R1.962 CCC(C)COCC=Cc1ccccc1 44d49102fe3db851a0691fb3852d2091 [1,1,0,0,0,0|2,0,0]=4 5807 B15R1.962 CCC(C)NCC/C=C/c1ccccc1 f3b442a0c7409c8cd05b71b9b21d79f5 [1,1,0,0,0,0|2,0,0]=4 5808 B15R1.962 CCC(C)NCCOCc1ccccc1 d62f974e8ea5a1e3ba11e18c1fe93116 [1,1,0,0,0,0|1,0,1]=4 5809 B15R1.962 CCC(C)OCCOCc1ccccc1 48311a0869962b45daca2cb61d51a195 [1,1,0,0,0,0|1,0,1]=4 5810 B15R1.962 CCC(O)CNC/C=C/c1ccccc1 f7791d98fdc0aba0b8480d33cb176594 [1,1,0,0,0,0|2,0,0]=4 5811 B15R1.962 CCC(O)CNCOCc1ccccc1 b73640d1e77d5a6171aac45eef416604 [1,1,0,0,0,0|1,0,1]=4 5812 B15R1.962 CCN(C)CCCOCc1ccccc1 7e130cbdfdb4bbc7101b7e797f9ed734 [1,1,0,0,0,0|1,0,1]=4 5813 B15R1.962 CC[C@@H](C)CNC/C=C/c1ccccc1 f863a529172b7a4247d300ce74ca0d6a [1,1,0,0,0,0|2,0,0]=4 5814 B15R1.962 CC[C@@H](C)COC/C=C/c1ccccc1 aa05cd574301682afed39eb10d558a49 [1,1,0,0,0,0|2,0,0]=4 5815 B15R1.962 CC[C@@H](C)COC/C=C\c1ccccc1 16a840d8333907ae26c42907fbaa626c [1,1,0,0,0,0|2,0,0]=4 5816 B15R1.962 CC[C@@H](C)COCC=Cc1ccccc1 c8a4e146f5653526fec5f63ff642fc12 [1,1,0,0,0,0|2,0,0]=4 5817 B15R1.962 CC[C@@H](C)NCCOCc1ccccc1 4c12728f16c880fec9b68be5be8b7317 [1,1,0,0,0,0|1,0,1]=4 5818 B15R1.962 CC[C@@H](C)OCCOCc1ccccc1 ccc360a5bf2fc33d2f3256c61283c9df [1,1,0,0,0,0|1,0,1]=4 5819 B15R1.962 CC[C@@H](O)CNCOCc1ccccc1 b00ebc2d1a8e8831f49488a9cd6eb89c [1,1,0,0,0,0|1,0,1]=4 5820 B15R1.962 CC[C@H](C)CCCOCc1ccccc1 0ea281120448ab5829fcc8636bb454e7 [1,1,0,0,0,0|0,0,1]=3 5821 B15R1.962 CC[C@H](C)CCCOCc1ccccn1 0e6590bda945af3ee3456914dace96b6 [1,1,0,0,0,0|1,0,1]=4 5822 B15R1.962 CC[C@H](C)CCCOCc1cccnc1 bf9e8c0ff9812350834e7f8ea59586dd [1,1,0,0,0,0|1,0,1]=4 5823 B15R1.962 CC[C@H](C)CNC/C=C/c1ccccc1 8e658e3ab0db83ef61e60c6bf5b171c5 [1,1,0,0,0,0|2,0,0]=4 5824 B15R1.962 CC[C@H](C)CNCOCc1ccccc1 ae9d5b1c2c7943d20de2d2f3054cf2a0 [1,1,0,0,0,0|1,0,1]=4 5825 B15R1.962 CC[C@H](C)COC/C=C/c1ccccc1 30e204674ae174e4d5bee5a6c07554b7 [1,1,0,0,0,0|2,0,0]=4 5826 B15R1.962 CC[C@H](C)COC/C=C\c1ccccc1 ef99957d203be1330f4c7982da2d14d0 [1,1,0,0,0,0|2,0,0]=4 5827 B15R1.962 CC[C@H](C)COCC=Cc1ccccc1 e0f9984992fb96b8619b3df30490bac9 [1,1,0,0,0,0|2,0,0]=4 5828 B15R1.962 CC[C@H](C)NCCOCc1ccccc1 44bb1310678132dd984c9745806c2ca5 [1,1,0,0,0,0|1,0,1]=4 5829 B15R1.962 CC[C@H](C)OCCOCc1ccccc1 33b57b96a04e86ddcc63916e4b025a86 [1,1,0,0,0,0|1,0,1]=4 5830 B15R1.51 CCCCCC(C)NC(=O)c1ccco1 23b36c5a63c6e1d228d133c5a3f13a30 [0,1,0,0,1,0|2,0,0]=4 5831 B15R1.51 CCCCCC(C)NC(=O)c1cccs1 0c48c35eef9add6eb99fef30179099cc [0,1,0,0,1,0|2,0,0]=4 5832 B15R1.51 CCCCCC(C)NC(=O)c1ccoc1 6afe8bac32ec7a6e1d9b54ea4cb363b1 [0,1,0,0,1,0|2,0,0]=4 5833 B15R1.51 CCCCCC(C)NC(=O)c1ccsc1 d3d451e06dae51dadaa3f5bb2fb97d1f [0,1,0,0,1,0|2,0,0]=4 5834 B15R1.51 CCCCC[C@H](C)NC(=O)c1ccco1 a7822e72f6bbd4b8fd079bb8312713ed [0,1,0,0,1,0|2,0,0]=4 5835 B15R1.51 CCCCC[C@H](C)NC(=O)c1cccs1 6d72d113146553851339b5ed67da2e43 [0,1,0,0,1,0|2,0,0]=4 5836 B15R1.51 CCCCC[C@H](C)NC(=O)c1ccoc1 55304e000b5d5198014eda5462c84ff7 [0,1,0,0,1,0|2,0,0]=4 5837 B15R1.51 CCCCC[C@H](C)NC(=O)c1ccsc1 490a7dc0f8269af682ac4d8caca3c0a9 [0,1,0,0,1,0|2,0,0]=4 5838 B15R1.96 CCCCCCCNC(=O)c1ccco1 69b0742f654fb0a2d3ec830d85b50fed [0,1,0,0,1,0|2,0,0]=4 5839 B15R1.96 CCCCCCCNC(=O)c1cccs1 50fb051a87a8a253984ae3601791c0f1 [0,1,0,0,1,0|2,0,0]=4 5840 B15R1.96 CCCCCCCNC(=O)c1ccoc1 c297c683c93c83aa7372920885679d59 [0,1,0,0,1,0|2,0,0]=4 5841 B15R1.96 CCCCCCCNC(=O)c1ccsc1 00fbeeb70e9da7529bda3c2d75367e17 [0,1,0,0,1,0|2,0,0]=4 5842 B15R1.96 CCCCCCNCC(=O)c1ccc[nH]1 f10ed101996949869fd75f202835a579 [0,1,0,0,1,0|2,0,0]=4 5843 B15R1.96 CCCCCCNCC(=O)c1ccco1 887813e2e5a46ce00265ee7d5f0ce217 [0,1,0,0,1,0|2,0,0]=4 5844 B15R1.96 CCCCCCNCC(=O)c1cccs1 18f9edf99d52cd207a05d191b0b997f0 [0,1,0,0,1,0|2,0,0]=4 5845 B15R1.96 CCCCCCNCC(=O)c1ccsc1 86936e35f6f3fe1daa024d22431b16b3 [0,1,0,0,1,0|2,0,0]=4 5846 B15R1.96 CCCCCCOCC(=O)c1ccco1 3aa8e608274efafc0b9fe777e73653dc [0,1,0,0,1,0|1,0,0]=3 5847 B15R1.96 CCCCCCOCC(=O)c1cccs1 c6a31db5f1d2656954934f2377d4c1f3 [0,1,0,0,1,0|1,0,0]=3 5848 B15R1.96 CCCCCCOCC(=O)c1ccsc1 1d61d6e920afca70cd6b05929cf4cbd2 [0,1,0,0,1,0|1,0,0]=3 5849 B15R1.96 CCCCCCOCC(=O)c1cocn1 c7caacfe4a13bfae6c4350d27fe9242c [0,1,0,0,1,0|2,0,0]=4 5850 B15R1.96 CCCCCCOCC(=O)c1ncco1 98d0c747697e771948ae833655c38200 [0,1,0,0,1,0|2,0,0]=4 5851 B15R1.96 CCCCCCOCC(=O)c1nccs1 7fe070357a787016f0096df803135d47 [0,1,0,0,1,0|2,0,0]=4 5852 B15R1.96 CCCCCCOCC(=O)n1cccn1 af8c2110c9753834d36b45f52f4777cd [0,1,0,0,1,0|2,0,0]=4 5853 B15R1.96 CCCCOCCNC(=O)c1ccc[nH]1 962ba090932f9f4cf67bff3ad0c9be06 [0,1,0,0,1,0|2,0,0]=4 5854 B15R1.96 CCCCOCCNC(=O)c1ccco1 1f2e9148a9bb97738c2529fa6b5120e7 [0,1,0,0,1,0|2,0,0]=4 5855 B15R1.96 CCCCOCCNC(=O)c1cccs1 e79a8d16ce7a188fd01c02ee9aa8d0cc [0,1,0,0,1,0|2,0,0]=4 5856 B15R1.96 CCCCOCCNC(=O)c1ccoc1 573fac91eec3e970a1ad137b1c407109 [0,1,0,0,1,0|2,0,0]=4 5857 B15R1.96 CCCCOCCNC(=O)c1ccsc1 a62552e363f031f7ba2f74832a89653a [0,1,0,0,1,0|2,0,0]=4 5858 B15R1.96 CCCCOCOCC(=O)c1ccco1 cb304a776cb11b739916824cafb8eea9 [0,1,0,0,1,0|2,0,0]=4 5859 B15R1.96 CCCOCCCNC(=O)c1ccco1 73e941d4b851d40b63c67f7e26c79f17 [0,1,0,0,1,0|2,0,0]=4 5860 B15R1.96 CCCOCCCNC(=O)c1cccs1 87810ff8d6b864d15bbd1731e0476514 [0,1,0,0,1,0|2,0,0]=4 5861 B15R1.96 CCCOCCCNC(=O)c1ccoc1 38476f7c4dcc8c7470ff247be6aec872 [0,1,0,0,1,0|2,0,0]=4 5862 B15R1.96 CCCOCCCNC(=O)c1ccsc1 23dde44ebda091b7f0b248a56f550b99 [0,1,0,0,1,0|2,0,0]=4 5863 B15R1.96 CCCOCCOCC(=O)c1ccc[nH]1 84eba5c289f9a4809338417fc7e3e941 [0,1,0,0,1,0|2,0,0]=4 5864 B15R1.96 CCCOCCOCC(=O)c1ccco1 4b10fc5b1194d0c4326aa235c1b7ae74 [0,1,0,0,1,0|2,0,0]=4 5865 B15R1.96 CCCOCCOCC(=O)c1cccs1 dd526b841d51435dda623ac080bbb7b7 [0,1,0,0,1,0|2,0,0]=4 5866 B15R1.96 CCCOCCOCC(=O)c1ccsc1 a1e4127b621f500e9c5bb38eac399df0 [0,1,0,0,1,0|2,0,0]=4 5867 B15R1.96 CCCSCCOCC(=O)c1ccco1 1315c31d483fbe5d560b54adebfca224 [0,1,0,0,1,0|2,0,0]=4 5868 B15R1.96 CCCSCCOCC(=O)c1cccs1 a0cfdd42cdbfe5aea30c2feb8af6f68e [0,1,0,0,1,0|2,0,0]=4 5869 B15R1.96 CCCSCCOCC(=O)c1ccsc1 dc483095430a16c0589d0f485fd6c02f [0,1,0,0,1,0|2,0,0]=4 5870 B15R1.96 CCOCCCOCC(=O)c1ccco1 ffb56ab3e349c5b2bf681811e17ad985 [0,1,0,0,1,0|2,0,0]=4 5871 B15R1.96 CCOCCCOCC(=O)c1ccsc1 385f0494269074437edcf3536289d266 [0,1,0,0,1,0|2,0,0]=4 5872 B15R1.96 CCSCCCCNC(=O)c1ccco1 f1d863362449c69c06157a50ff6eecca [0,1,0,0,1,0|2,0,0]=4 5873 B15R1.96 CCSCCCCNC(=O)c1cccs1 38c6642046cd9c50bd2725dc1ea690f2 [0,1,0,0,1,0|2,0,0]=4 5874 B15R1.96 CCSCCCCNC(=O)c1ccoc1 546a7bbf8041ac6866fcd1fd8f6020dc [0,1,0,0,1,0|2,0,0]=4 5875 B15R1.96 CCSCCCCNC(=O)c1ccsc1 53060ef26c9fd14b076496bbb56e2923 [0,1,0,0,1,0|2,0,0]=4 5876 B15R1.96 CCSCCCOCC(=O)c1ccco1 5f16d7f9b743adaf548d87554705450e [0,1,0,0,1,0|2,0,0]=4 5877 B15R1.96 CCSCCCOCC(=O)c1cccs1 222fa30f0d79da3305a72b403340cfc6 [0,1,0,0,1,0|2,0,0]=4 5878 B15R1.96 CCSCCCOCC(=O)c1ccsc1 d1dd065be1659e426e443e7217b59b5c [0,1,0,0,1,0|2,0,0]=4 5879 B15R1.96 COCCCCCNC(=O)c1ccco1 5606b94f12204991806758b6181aed6d [0,1,0,0,1,0|2,0,0]=4 5880 B15R1.96 COCCCCCNC(=O)c1cccs1 052832fbe286f8283d69001128d707a3 [0,1,0,0,1,0|2,0,0]=4 5881 B15R1.96 COCCCCCNC(=O)c1ccoc1 2904c1d01be3081973d4bf95917b39c1 [0,1,0,0,1,0|2,0,0]=4 5882 B15R1.96 COCCCCCNC(=O)c1ccsc1 186987ca3323f4a8b420c16ba026cf82 [0,1,0,0,1,0|2,0,0]=4 5883 B15R1.96 COCCCCOCC(=O)c1ccco1 19f3493f8df74b97d0e87939bbe745e7 [0,1,0,0,1,0|2,0,0]=4 5884 B15R1.96 COCCCCOCC(=O)c1cccs1 15bc0a13a0aa2e5dba16e79988bd898a [0,1,0,0,1,0|2,0,0]=4 5885 B15R1.96 COCCCCOCC(=O)c1ccsc1 a62dae435b305636432f66a27235d62c [0,1,0,0,1,0|2,0,0]=4 5886 B15R1.96 CSCCCCOCC(=O)c1ccco1 009ef119cdbc2e9e999fa71f8b3b7d32 [0,1,0,0,1,0|2,0,0]=4 5887 B15R1.96 CSCCCCOCC(=O)c1cccs1 6a83f632b65d35b752ea8c7377766a8c [0,1,0,0,1,0|2,0,0]=4 5888 B15R1.96 CSCCCCOCC(=O)c1ccsc1 c84ce5150ff39ee3a4c5223ff25e52b8 [0,1,0,0,1,0|2,0,0]=4 5889 B15R1.96 O=C(COCCCCCF)c1ccco1 088b3a3c92c716eb112855db4e5c36c1 [0,1,0,0,1,0|2,0,0]=4 5890 B15R1.96 O=C(NCCCCCCCl)c1ccco1 64c86b86d577639402c449bacdeb5d59 [0,1,0,0,1,0|2,0,0]=4 5891 B15R1.96 O=C(NCCCCCCCl)c1cccs1 4a27ec07f1086557180267001f7cd49e [0,1,0,0,1,0|2,0,0]=4 5892 B15R1.96 O=C(NCCCCCCCl)c1ccoc1 a50cb072ea36d538c012a3d4ca0a5f38 [0,1,0,0,1,0|2,0,0]=4 5893 B15R1.96 O=C(NCCCCCCCl)c1ccsc1 5b6b95eb3264680fc8df81d50b094945 [0,1,0,0,1,0|2,0,0]=4 5894 B15R1.96 O=C(NCCCCCCO)c1ccco1 1f73029f38db355b154af8f0693bd433 [0,1,0,0,1,0|2,0,0]=4 5895 B15R1.96 O=C(NCCCCCCO)c1cccs1 c6b9b438b9ab32200049620b7338cac1 [0,1,0,0,1,0|2,0,0]=4 5896 B15R1.96 O=C(NCCCCCCO)c1ccoc1 38bab03920e224b739c5ed05c17d2af5 [0,1,0,0,1,0|2,0,0]=4 5897 B15R1.96 O=C(NCCCCCCO)c1ccsc1 577497f272d3ede147818869f0d17e5e [0,1,0,0,1,0|2,0,0]=4 5898 B15R1.137 CCCCCCNC(=O)c1cc(co1)Br 5182a59c55993c3e36a5ca6e3235bb1d [0,1,0,0,1,0|2,0,0]=4 5899 B15R1.137 CCCCCCNC(=O)c1cc(co1)C 23c628ce93034a7ea62b46349cbe4ad5 [0,1,0,0,1,0|2,0,0]=4 5900 B15R1.137 CCCCCCNC(=O)c1cc(co1)Cl 2de1fd35c097482d283c45b7506903cb [0,1,0,0,1,0|2,0,0]=4 5901 B15R1.137 CCCCCCNC(=O)c1cc(cs1)Br 594d142c3cd8e2ce0f4be06438c9178f [0,1,0,0,1,0|2,0,0]=4 5902 B15R1.137 CCCCCCNC(=O)c1cc(cs1)C bfb2f96de92fbecc99d4080ae386a9a8 [0,1,0,0,1,0|2,0,0]=4 5903 B15R1.137 CCCCCCNC(=O)c1cc(cs1)Cl 288e40f485e3e342882ee0f19f72fa6b [0,1,0,0,1,0|2,0,0]=4 5904 B15R1.137 CCCCCCNC(=O)c1cc(cs1)F 9b902dee317c381bf5765b532cf78274 [0,1,0,0,1,0|2,0,0]=4 5905 B15R1.137 CCCCCCNC(=O)c1cc(cs1)O 22c0a7985f7331dab1dd0b52080e45f3 [0,1,0,0,1,0|2,0,0]=4 5906 B15R1.137 CCCCCCNC(=O)c1ccc(o1)Br f497f842d5ca882caf1b37e7f60f8f83 [0,1,0,0,1,0|2,0,0]=4 5907 B15R1.137 CCCCCCNC(=O)c1ccc(o1)C d44ea4e4f77a8734101765ee610b5e0a [0,1,0,0,1,0|2,0,0]=4 5908 B15R1.137 CCCCCCNC(=O)c1ccc(o1)Cl e47577b34bbcfe5f72a356ac1da3c825 [0,1,0,0,1,0|2,0,0]=4 5909 B15R1.137 CCCCCCNC(=O)c1ccc(o1)F 3f1bceda7cbeb0dd69ce0a407cd80a90 [0,1,0,0,1,0|2,0,0]=4 5910 B15R1.137 CCCCCCNC(=O)c1ccc(o1)I f029aaf4a71518039511abe1f76210d4 [0,1,0,0,1,0|2,0,0]=4 5911 B15R1.137 CCCCCCNC(=O)c1ccc(s1)Br 5a1aa9077c5ba45dc34bf366c7e1e1f8 [0,1,0,0,1,0|2,0,0]=4 5912 B15R1.137 CCCCCCNC(=O)c1ccc(s1)C f8d002f06d71b4a728cf4d4a70cc2c5e [0,1,0,0,1,0|2,0,0]=4 5913 B15R1.137 CCCCCCNC(=O)c1ccc(s1)Cl c1e07863bc38a480d83f40095809f59c [0,1,0,0,1,0|2,0,0]=4 5914 B15R1.137 CCCCCCNC(=O)c1ccc(s1)F 57eeb3f46a39f25fade465aec159ad3b [0,1,0,0,1,0|2,0,0]=4 5915 B15R1.137 CCCCCCNC(=O)c1ccc(s1)I 7a37462bd145f6b23966c87941d07b85 [0,1,0,0,1,0|2,0,0]=4 5916 B15R1.137 CCCCCCNC(=O)c1ccn(c1)C 55c2d8a404cdeb17d0f2e134d5cb2c6d [0,1,0,0,1,0|2,0,0]=4 5917 B15R1.137 CCCCCCNC(=O)c1coc(c1)Br a98f4761e1564c94c53ecef23195de7b [0,1,0,0,1,0|2,0,0]=4 5918 B15R1.137 CCCCCCNC(=O)c1coc(c1)C 0d6aa4585b955c4d1f995ae7446592c2 [0,1,0,0,1,0|2,0,0]=4 5919 B15R1.137 CCCCCCNC(=O)c1csc(c1)Br 5e8f73bd0c95d67cbd5de93d5cccc7d4 [0,1,0,0,1,0|2,0,0]=4 5920 B15R1.137 CCCCCCNC(=O)c1csc(c1)C 80fb23016134f16b1e7695f66f4c9bee [0,1,0,0,1,0|2,0,0]=4 5921 B15R1.137 CCCCCCNC(=O)c1csc(c1)Cl 3c245d7a4297c160b30cab2e1a28a893 [0,1,0,0,1,0|2,0,0]=4 5922 B15R1.137 CCCCCCNC(=O)c1csc(c1)I 3d9434658b9d383084404154d8bf7e76 [0,1,0,0,1,0|2,0,0]=4 5923 B15R1.593 CCCCC(O)CNC(=O)c1ccco1 bafe2486c6b7f5f9fab6775a09061bf8 [0,1,0,0,1,0|2,0,0]=4 5924 B15R1.593 CCCCC(O)CNC(=O)c1cccs1 0058f142e23acdd89560793c7b11bdbc [0,1,0,0,1,0|2,0,0]=4 5925 B15R1.593 CCCCC(O)CNC(=O)c1ccoc1 3b6ac5d760fcfa228dde7db3e6bc7182 [0,1,0,0,1,0|2,0,0]=4 5926 B15R1.593 CCCCC(O)CNC(=O)c1ccsc1 6a2408c3fdbbe777b261ad72b08dd429 [0,1,0,0,1,0|2,0,0]=4 5927 B15R1.600 CCCCCCN(C)C(=O)c1ccco1 3c13f99a3c837adce42c49f0207e76ef [0,1,0,0,1,0|2,0,0]=4 5928 B15R1.600 CCCCCCN(C)C(=O)c1cccs1 6c480f850cd0273fc91c81306cd28de8 [0,1,0,0,1,0|2,0,0]=4 5929 B15R1.600 CCCCCCN(C)C(=O)c1ccoc1 e015fa4d422379aea3bae1c1477fe51b [0,1,0,0,1,0|2,0,0]=4 5930 B15R1.600 CCCCCCN(C)C(=O)c1ccsc1 e3f0bc41d578def9170c7d6039c3f278 [0,1,0,0,1,0|2,0,0]=4 5931 B15R1.5906 CCCCCCNC(=O)c1cccn1C 7f293a879d15dc5fece0f97fc21bddbb [0,1,0,0,1,0|2,0,0]=4 5932 B15R1.5906 CCCCCCNC(=O)c1ccoc1Br 936d23a406facc63be69d8c1fd1b6310 [0,1,0,0,1,0|2,0,0]=4 5933 B15R1.5906 CCCCCCNC(=O)c1ccoc1C 697e0eaf1d1715f10d74c8aa78184423 [0,1,0,0,1,0|2,0,0]=4 5934 B15R1.5906 CCCCCCNC(=O)c1ccoc1Cl 425747bd3ee90d2a068bbfc1c3bdade3 [0,1,0,0,1,0|2,0,0]=4 5935 B15R1.5906 CCCCCCNC(=O)c1ccoc1I 8688a675ad9eadbdc862cad155f35cf7 [0,1,0,0,1,0|2,0,0]=4 5936 B15R1.5906 CCCCCCNC(=O)c1ccsc1Br dae16032c99cef899b60d0e463bdb5da [0,1,0,0,1,0|2,0,0]=4 5937 B15R1.5906 CCCCCCNC(=O)c1ccsc1C 81888de9e9642fd6ad0c9085cb40a70e [0,1,0,0,1,0|2,0,0]=4 5938 B15R1.5906 CCCCCCNC(=O)c1ccsc1Cl 7044c54ba4c211348c12d976c39a5edf [0,1,0,0,1,0|2,0,0]=4 5939 B15R1.5906 CCCCCCNC(=O)c1ccsc1F cd4b746de4014438ee007889e851cdae [0,1,0,0,1,0|2,0,0]=4 5940 B15R1.5906 CCCCCCNC(=O)c1ccsc1I 958b863472aa35c5343eb1b2ff714925 [0,1,0,0,1,0|2,0,0]=4 5941 B15R1.5906 CCCCCCNC(=O)c1cocc1Br 1d260b0529ba1656280605db98222c3b [0,1,0,0,1,0|2,0,0]=4 5942 B15R1.5906 CCCCCCNC(=O)c1cocc1C 38101bab0dd5461315df0fdfdd09f4b5 [0,1,0,0,1,0|2,0,0]=4 5943 B15R1.5906 CCCCCCNC(=O)c1cscc1Br caaca8c5f7da0a0dc6759c45a1d8608f [0,1,0,0,1,0|2,0,0]=4 5944 B15R1.5906 CCCCCCNC(=O)c1cscc1C d52dfb894194b83162ab207bff691fbc [0,1,0,0,1,0|2,0,0]=4 5945 B15R1.5906 CCCCCCNC(=O)c1cscc1Cl b909f11a6579dee7195817858f594046 [0,1,0,0,1,0|2,0,0]=4 5946 B15R1.5906 CCCCCCNC(=O)c1occc1Br 6674c1a57f8cb167d2c10b8e46b2c082 [0,1,0,0,1,0|2,0,0]=4 5947 B15R1.5906 CCCCCCNC(=O)c1occc1C d0c73f026d40b842aa86ccb815aea98e [0,1,0,0,1,0|2,0,0]=4 5948 B15R1.5906 CCCCCCNC(=O)c1sccc1Br a0cd78a1d595277617b594d43b7ded0b [0,1,0,0,1,0|2,0,0]=4 5949 B15R1.5906 CCCCCCNC(=O)c1sccc1C f09d01edf78dc5e3a00b6a40357f1774 [0,1,0,0,1,0|2,0,0]=4 5950 B15R1.5906 CCCCCCNC(=O)c1sccc1Cl 09a9f27e94096b290f7a8b477be2fc63 [0,1,0,0,1,0|2,0,0]=4 5951 B15R1.5906 CCCCCCNC(=O)c1sccc1F f735bf821c05de22f55b1dd967199767 [0,1,0,0,1,0|2,0,0]=4 5952 B15R1.5906 CCCCCCNC(=O)c1sccc1I 25175289ef46132fb2805bf0de7efea2 [0,1,0,0,1,0|2,0,0]=4 5953 B15R1.5906 CCCCCCNC(=O)c1sccc1O 49329006d0c9082740dedc236731dad6 [0,1,0,0,1,0|2,0,0]=4 5954 B15R1.5906 CCCCCCNC(=O)c1sccc1S 585deb6ad51f79f208df946dc1cbf345 [0,1,0,0,1,0|2,0,0]=4 5955 B17R1.304 C#CC(Cc1ccccc1)OCCCCCC e159c289bf946b74b5646fc19d3d4f7b [0,1,0,0,0,1|1,0,1]=4 5956 B17R1.304 CCCCCCNC(C=O)Cc1ccccc1 8ecda39e10c57310b56260a123caf490 [0,1,0,0,0,1|1,0,1]=4 5957 B17R1.304 CCCCCCOC(CC)Cc1ccccc1 24bf89b06557443e98e70cc976633985 [0,1,0,0,0,1|1,0,1]=4 5958 B17R1.304 CCCOCCOC(C=O)Cc1ccccc1 bc2174470c3507796bc1851fd7e9bb79 [0,1,0,0,0,1|1,0,1]=4 5959 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)Br 1ac4f3756405661f39d120e4c8c6e274 [0,1,0,0,0,1|1,0,1]=4 5960 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)C 0b84b73f086cbe150a9ae4f9296b03dd [0,1,0,0,0,1|1,0,1]=4 5961 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)Cl 009a983a8acedbdb66e7e864052ecd02 [0,1,0,0,0,1|1,0,1]=4 5962 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)F eb81202a943abc495b6df7ce606974d4 [0,1,0,0,0,1|1,0,1]=4 5963 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)I 175ff59cdb4639f3024c1ee5fa9a7042 [0,1,0,0,0,1|1,0,1]=4 5964 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)O 5d536af8c16a123f84c5ebb415b40c5c [0,1,0,0,0,1|1,0,1]=4 5965 B17R1.744 CCCCC/C=C/C(=O)Nc1ccc(cc1)S 0cd574690d9f0a3c3a36d5a0ea8f8d41 [0,1,0,0,0,1|1,0,1]=4 5966 B17R1.744 CCCCCC#CC(=O)Nc1ccc(cc1)C 36e971a1aac6e3bd5217e6ed4bfdd70f [0,1,0,0,0,1|1,0,1]=4 5967 B17R1.744 CCCCCC#CC(=O)Nc1ccc(cc1)F ae147b1f7d33bd9cc088136cdc1032e4 [0,1,0,0,0,1|1,0,1]=4 5968 B17R1.744 CCCCCC#CC(=O)Nc1ccc(cc1)I 37a6f675815e0d856b59e7d5936356bd [0,1,0,0,0,1|1,0,1]=4 5969 B17R1.744 CCCCCC#CC(=O)Nc1ccc(cc1)O 7952346a76ab5a092de31fb752486b92 [0,1,0,0,0,1|1,0,1]=4 5970 B17R1.744 CCCCCC#CC(=O)Nc1ccc(cc1)S 205d1047216a5f25e9b880fa7ad3807e [0,1,0,0,0,1|1,0,1]=4 5971 B17R1.744 CCCCCCCC(=O)Nc1ccc(cc1)Br b96a223fcd300395942803f40a0683ca [0,1,0,0,0,1|1,0,0]=3 5972 B17R1.744 CCCCCCCC(=O)Nc1ccc(cc1)C 3f4875998346e0a2d6bc5ae48a8f74e0 [0,1,0,0,0,1|1,0,0]=3 5973 B17R1.744 CCCCCCCC(=O)Nc1ccc(cc1)F cb03f7286fa405086444598509198bd9 [0,1,0,0,0,1|1,0,0]=3 5974 B17R1.744 CCCCCCCC(=O)Nc1ccc(cc1)I a37ead782fdd20676d85849dd31ca592 [0,1,0,0,0,1|1,0,0]=3 5975 B17R1.744 CCCCCCCC(=O)Nc1ccc(cc1)O 0d6f35e145de455fd7747cbb83484c0f [0,1,0,0,0,1|1,0,0]=3 5976 B17R1.744 CCCCCCCC(=O)Nc1ccc(cc1)S c09df4117b659462542acdc45cd669a1 [0,1,0,0,0,1|1,0,0]=3 5977 B17R1.744 CCCCCCCC(=O)Nc1ccc(cn1)Br 6b39d4c3a8a2375e7084a0052bc72ff1 [0,1,0,0,0,1|2,0,0]=4 5978 B17R1.744 CCCCCCCC(=O)Nc1ccc(cn1)C 2fe8512092fa97996aecc974fa78e1f0 [0,1,0,0,0,1|2,0,0]=4 5979 B17R1.744 CCCCCCCC(=O)Nc1ccc(cn1)Cl 3c87dcefc2a9771724382bf96ae89d13 [0,1,0,0,0,1|2,0,0]=4 5980 B17R1.744 CCCCCCCC(=O)Nc1ccc(cn1)F cafa07ff42f7ab2fb58f1da2794a0c43 [0,1,0,0,0,1|2,0,0]=4 5981 B17R1.744 CCCCCCCC(=O)Nc1ccc(cn1)I 2965eb53d326558c43b54f24d747966f [0,1,0,0,0,1|2,0,0]=4 5982 B17R1.744 CCCCCCCC(=O)Nc1ccc(cn1)O dba9d2af13cf2b39d1ba83b5fc69295c [0,1,0,0,0,1|2,0,0]=4 5983 B17R1.744 CCCCCCCC(=O)Nc1ccc(nc1)Br bc8232bc4098dd217d3db7c5d876b275 [0,1,0,0,0,1|2,0,0]=4 5984 B17R1.744 CCCCCCCC(=O)Nc1ccc(nc1)F 2c98f37530df0b6be4c23abf84a1d06e [0,1,0,0,0,1|2,0,0]=4 5985 B17R1.744 CCCCCCCC(=O)Nc1ccc(nc1)I 937046eab996fb5bcce91224f594288c [0,1,0,0,0,1|2,0,0]=4 5986 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)Br bc7dd906c7b3b3c8a8cdf946fb3bfb71 [0,1,0,0,0,1|1,0,0]=3 5987 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)C e8d1c49de24725ea7c11dc483ad3aa7f [0,1,0,0,0,1|1,0,0]=3 5988 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)Cl f26f4804c5cffb159586172459e7951d [0,1,0,0,0,1|1,0,0]=3 5989 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)F 79676d3979091fd61c75fc91f616ffca [0,1,0,0,0,1|1,0,0]=3 5990 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)I 8bfc1c102bbb60a5371cc22c5087ebfd [0,1,0,0,0,1|1,0,0]=3 5991 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)O 25347861df6338780cff3c10f5867532 [0,1,0,0,0,1|1,0,0]=3 5992 B17R1.744 CCCCCCNC(=O)Cc1ccc(cc1)S 42ce7bbb8378b66df38cbf97e0673461 [0,1,0,0,0,1|1,0,0]=3 5993 B17R1.744 CCCCCCNC(=O)Cc1ccc(cn1)Br 3b5fc60218ee7bc201af145730fa37d4 [0,1,0,0,0,1|2,0,0]=4 5994 B17R1.744 CCCCCCNC(=O)Cc1ccc(cn1)C a618fb18061f2eb5e42cdc60d9be55d2 [0,1,0,0,0,1|2,0,0]=4 5995 B17R1.744 CCCCCCNC(=O)Cc1ccc(cn1)Cl 3d880d29b33e3a992c7f30e816e9fd4c [0,1,0,0,0,1|2,0,0]=4 5996 B17R1.744 CCCCCCNC(=O)Cc1ccc(cn1)F de662cce29be982252009b58390dfcb9 [0,1,0,0,0,1|2,0,0]=4 5997 B17R1.744 CCCCCCNC(=O)Cc1ccc(cn1)I 0f34dd8f0ce2fdfe99d36496c752d203 [0,1,0,0,0,1|2,0,0]=4 5998 B17R1.744 CCCCCCNC(=O)Cc1ccc(cn1)O ccac413cb8674258649c9b2f2850213e [0,1,0,0,0,1|2,0,0]=4 5999 B17R1.744 CCCCCCNC(=O)Cc1ccc(nc1)Br b981b7c7bfb2857cdfa2ae4b69eff4ab [0,1,0,0,0,1|2,0,0]=4 6000 B17R1.744 CCCCCCNC(=O)Cc1ccc(nc1)C d790a7f8ce3d8537fc07523d170b45aa [0,1,0,0,0,1|2,0,0]=4 6001 B17R1.744 CCCCCCNC(=O)Cc1ccc(nc1)Cl 8e2cd376f8cdd467d984b8e7a9130d5e [0,1,0,0,0,1|2,0,0]=4 6002 B17R1.744 CCCCCCNC(=O)Cc1ccc(nc1)F 45262cabbdee3117713b3580cbdf43cc [0,1,0,0,0,1|2,0,0]=4 6003 B17R1.744 CCCCCCNC(=O)Cc1ccc(nc1)O a9a237bb2fe3aa4d9ac160bac9ea3671 [0,1,0,0,0,1|2,0,0]=4 6004 B17R1.744 CCCCCCNC(=O)Cn1ccc(=O)cc1 7117ba9036e062e8518aeeca195c6bf1 [0,1,0,0,0,1|2,0,0]=4 6005 B17R1.744 CCCCCCNC(=O)Nc1ccc(cc1)Br 3d9c1036cc2e13a8ee432406bf1fa3ab [0,1,0,0,0,1|1,0,0]=3 6006 B17R1.744 CCCCCCNC(=O)Nc1ccc(cc1)C f7a89d7b3e2583c2c499e828dec61ac4 [0,1,0,0,0,1|1,0,0]=3 6007 B17R1.744 CCCCCCNC(=O)Nc1ccc(cc1)F 42d57ef40dcf686950e72160a085d214 [0,1,0,0,0,1|1,0,0]=3 6008 B17R1.744 CCCCCCNC(=O)Nc1ccc(cc1)I 0439df3fa8832a492ac69531ab902795 [0,1,0,0,0,1|1,0,0]=3 6009 B17R1.744 CCCCCCNC(=O)Nc1ccc(cc1)S ecc2f23b1c909d8dd219058b2061c285 [0,1,0,0,0,1|1,0,0]=3 6010 B17R1.744 CCCCCCNC(=O)Nc1ccc(nc1)Cl 1f0f2bf8559045f0091e3184366352fc [0,1,0,0,0,1|2,0,0]=4 6011 B17R1.744 CCCCCCNC(=O)Nc1ccc(nc1)F 3fcaf6a9f46c692471b8fe1596ee449e [0,1,0,0,0,1|2,0,0]=4 6012 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)Br 37df66401ae4e10ae6e3c3187ff28f57 [0,1,0,0,0,1|1,1,0]=4 6013 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)C f7f0501af9728818312d399d9190ccf6 [0,1,0,0,0,1|1,1,0]=4 6014 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)Cl 6619a5a2cb764f8f53be3a149326d43d [0,1,0,0,0,1|1,1,0]=4 6015 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)F ac8e043ecbeecacb01640e31cf02cdeb [0,1,0,0,0,1|1,1,0]=4 6016 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)I c4cf1bc4d9482a0d7695b2547cc782ed [0,1,0,0,0,1|1,1,0]=4 6017 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)N b24cdbdfe7b47d28d0b1e4621fda8a51 [0,1,0,0,0,1|1,1,0]=4 6018 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)O ef18e585a0ecefaec7366d4b3793068c [0,1,0,0,0,1|1,1,0]=4 6019 B17R1.744 CCCCCCNC(=S)Nc1ccc(cc1)S 6107154ccef55ed3232ed4210fd3683b [0,1,0,0,0,1|1,1,0]=4 6020 B17R1.744 CCCCCCOC(C)Cc1ccc(cc1)Br d9b3cfef17e28f387259aba7cd1b6d64 [0,1,0,0,0,1|1,0,1]=4 6021 B17R1.744 CCCCCCOC(C)Cc1ccc(cc1)C 2763a362640b83f4896503a3b7aa76c2 [0,1,0,0,0,1|1,0,1]=4 6022 B17R1.744 CCCCCCOC(C)Cc1ccc(cc1)F f0b1460183c07570b342d0065b16c535 [0,1,0,0,0,1|1,0,1]=4 6023 B17R1.744 CCCCCNCC(=O)Nc1ccc(cc1)C 3ba824b7413d2c324d4c7bd0c65c8890 [0,1,0,0,0,1|2,0,0]=4 6024 B17R1.744 CCCCCNCC(=O)Nc1ccc(cc1)Cl 61f27ca33cb0aaff92f4bd3589aaa330 [0,1,0,0,0,1|2,0,0]=4 6025 B17R1.744 CCCCCNCC(=O)Nc1ccc(cc1)F c8477a535ced7b9ec22d6bd04721dcb6 [0,1,0,0,0,1|2,0,0]=4 6026 B17R1.744 CCCCCNCC(=O)Oc1ccc(cc1)Cl 7eb2fbf6eeb89fb6ab39fd98e6400fc6 [0,1,0,0,0,1|2,0,0]=4 6027 B17R1.744 CCCCCOCC(=O)Nc1ccc(cc1)F 647574a817923e11e8510adca33fbebb [0,1,0,0,0,1|2,0,0]=4 6028 B17R1.744 CCCCOCCC(=O)Nc1ccc(cc1)S 99cb62ec53529e9c14dd46f01b540278 [0,1,0,0,0,1|2,0,0]=4 6029 B17R1.744 CCCNCCCC(=O)Nc1ccc(cc1)Br 8655bb09617573bcb4591725f13a9c6b [0,1,0,0,0,1|2,0,0]=4 6030 B17R1.744 CCCNCCCC(=O)Nc1ccc(cc1)C 0b3f43e33d8380b2ed69b690d10fdd4e [0,1,0,0,0,1|2,0,0]=4 6031 B17R1.744 CCCNCCNC(=O)Cc1ccc(cc1)F 6b7de91e4b33496702ebdd4f4bd2b211 [0,1,0,0,0,1|2,0,0]=4 6032 B17R1.744 CCCNCCNC(=O)Nc1ccc(cc1)Br 2559ff5e179679a53da33f88784cda95 [0,1,0,0,0,1|2,0,0]=4 6033 B17R1.744 CCCNCCNC(=O)Nc1ccc(cc1)F 780036f4a66c168a9f081a3cac0b0e98 [0,1,0,0,0,1|2,0,0]=4 6034 B17R1.744 CCCOCCCC(=O)Nc1ccc(cc1)Br d28c60fbc0ded8707c73cddf4dde0914 [0,1,0,0,0,1|2,0,0]=4 6035 B17R1.744 CCCOCCCC(=O)Nc1ccc(cc1)C 990d5d48a71a2a1334f5ff5f9e58b3e1 [0,1,0,0,0,1|2,0,0]=4 6036 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)Br e183eb83003c70990b06bf5c75687ded [0,1,0,0,0,1|2,0,0]=4 6037 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)C b9037246123c723cfce4d799298e9cc7 [0,1,0,0,0,1|2,0,0]=4 6038 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)Cl 9661f8932bea13f31924f5a9609619fe [0,1,0,0,0,1|2,0,0]=4 6039 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)F 5ec60f3521c2e581486bb26a8e39da55 [0,1,0,0,0,1|2,0,0]=4 6040 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)I 95c1d5f6a32c674389db87a16037368e [0,1,0,0,0,1|2,0,0]=4 6041 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)O 9c95ff8c7f3f196b3e8143c68442f629 [0,1,0,0,0,1|2,0,0]=4 6042 B17R1.744 CCCOCCNC(=O)Cc1ccc(cc1)S 730600f173c1cdba46cdac44aca3dab0 [0,1,0,0,0,1|2,0,0]=4 6043 B17R1.744 CCCOCCNC(=O)Nc1ccc(cc1)Br 5105e65eeae45b4f4bbef1c9f127e9ff [0,1,0,0,0,1|2,0,0]=4 6044 B17R1.744 CCCOCCNC(=O)Nc1ccc(cc1)C 1f13189c042afc0e5d53df6b820be64d [0,1,0,0,0,1|2,0,0]=4 6045 B17R1.744 CCCOCCNC(=O)Nc1ccc(cc1)F 8a068950f133a765a12b4f31af4eee50 [0,1,0,0,0,1|2,0,0]=4 6046 B17R1.744 CCOCCCCC(=O)Nc1ccc(cc1)C 9e3d0dc3763f1fedcb5297266d247223 [0,1,0,0,0,1|2,0,0]=4 6047 B17R1.744 CCOCCCCC(=O)Nc1ccc(cc1)F ce83c306830e5f846693449a42b78561 [0,1,0,0,0,1|2,0,0]=4 6048 B17R1.744 CCOCCCCC(=O)Nc1ccc(cc1)I 8a920bfb237712c682193bcdb3e224a1 [0,1,0,0,0,1|2,0,0]=4 6049 B17R1.744 CCOCCCCC(=O)Nc1ccc(cc1)O 4bfbb5a2aa1bf32d7c08261defdb48a8 [0,1,0,0,0,1|2,0,0]=4 6050 B17R1.744 CCOCCCCC(=O)Nc1ccc(cc1)S 3e395b04886c6668fb3ad3d811c73bdf [0,1,0,0,0,1|2,0,0]=4 6051 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)Br 73a1e12fdd6e525061ad127ec8874665 [0,1,0,0,0,1|2,0,0]=4 6052 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)C 086da0212fcb8a86001f6bb5e906c64f [0,1,0,0,0,1|2,0,0]=4 6053 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)Cl 8d2f499ec68687254fde33484f0200ef [0,1,0,0,0,1|2,0,0]=4 6054 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)F 0ec4172b0e5891a1197f8d038ab0e995 [0,1,0,0,0,1|2,0,0]=4 6055 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)I ad1fe314e57cb715c5117202c81480d7 [0,1,0,0,0,1|2,0,0]=4 6056 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)O 3ac9ad57471ac4cd3fd8c608168bbf24 [0,1,0,0,0,1|2,0,0]=4 6057 B17R1.744 CCOCCCNC(=O)Cc1ccc(cc1)S fe3f4aff69a524b4d64d975bec3204b4 [0,1,0,0,0,1|2,0,0]=4 6058 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)Br 46292d8d53a600a3bf92995d8e702001 [0,1,0,0,0,1|2,0,0]=4 6059 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)C 29b6b24fb9f6c89991b1c9aa04543ae9 [0,1,0,0,0,1|2,0,0]=4 6060 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)Cl 5434cb0b10bacad9e18ffb7ecff79419 [0,1,0,0,0,1|2,0,0]=4 6061 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)F 25a4eb5e8ecbc877528298a4f82fb914 [0,1,0,0,0,1|2,0,0]=4 6062 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)I 5e5a846b5bb93fc22968ef1adc6abfc7 [0,1,0,0,0,1|2,0,0]=4 6063 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)N f38723a62dfaa1c394f9f3af8eeda61a [0,1,0,0,0,1|2,0,0]=4 6064 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)O 9a15ccfa5c87e307aee654fcb3f379f4 [0,1,0,0,0,1|2,0,0]=4 6065 B17R1.744 CCOCCCNC(=O)Nc1ccc(cc1)S 1f058b17931b7a5f859cdafd95b9ad18 [0,1,0,0,0,1|2,0,0]=4 6066 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)Br fa6904cab4cb1265728631e1e9d97ebd [0,1,0,0,0,1|2,0,0]=4 6067 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)C 9e6f40023dfa11e108e8a3e908553561 [0,1,0,0,0,1|2,0,0]=4 6068 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)Cl f8edc1fa83ba511b2e34676618e0d747 [0,1,0,0,0,1|2,0,0]=4 6069 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)F a010c3e2770c2c11c14243f9064efd08 [0,1,0,0,0,1|2,0,0]=4 6070 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)I e5f56ea751c24234810ab14c2b0c2fd7 [0,1,0,0,0,1|2,0,0]=4 6071 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)O 274d97d083f3843633e91a35193d7f1b [0,1,0,0,0,1|2,0,0]=4 6072 B17R1.744 COCCCCCC(=O)Nc1ccc(cc1)S 6e3f2766ba7172f3d2e3a3f195ac4970 [0,1,0,0,0,1|2,0,0]=4 6073 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)Br ed1288c4fb47102de392d65d505d7008 [0,1,0,0,0,1|2,0,0]=4 6074 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)C f842e5dcdbcda54aca1731ec690a0abe [0,1,0,0,0,1|2,0,0]=4 6075 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)Cl 2b57c096836b1022ea01727da376e58d [0,1,0,0,0,1|2,0,0]=4 6076 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)F e586d35c7950e3526f798770298805e1 [0,1,0,0,0,1|2,0,0]=4 6077 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)I 1ef4d411d327ce9f324907028a874b9f [0,1,0,0,0,1|2,0,0]=4 6078 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)O 73d39d9b010c73ce0ea5dd0e9fa289e4 [0,1,0,0,0,1|2,0,0]=4 6079 B17R1.744 COCCCCNC(=O)Cc1ccc(cc1)S 46fb2253e9378c6d0387bfc384c38668 [0,1,0,0,0,1|2,0,0]=4 6080 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)Br caf7d0ebc57a87cdf7273c4ddd60d074 [0,1,0,0,0,1|2,0,0]=4 6081 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)C 633197f53b78e32287d5497adfb31286 [0,1,0,0,0,1|2,0,0]=4 6082 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)Cl 4eb25d751778c25eae07d789afcb6a89 [0,1,0,0,0,1|2,0,0]=4 6083 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)F c31a0100c7885bd22eea23dcb78561f4 [0,1,0,0,0,1|2,0,0]=4 6084 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)I e779a5c53706ca0c770e12aff4600b3c [0,1,0,0,0,1|2,0,0]=4 6085 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)N 15da10046de383c7c01ce0af49818cfd [0,1,0,0,0,1|2,0,0]=4 6086 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)O 200e73a45866ad0f53df629672eb5f85 [0,1,0,0,0,1|2,0,0]=4 6087 B17R1.744 COCCCCNC(=O)Nc1ccc(cc1)S 997eb1e9b2e017e052bec0e313263207 [0,1,0,0,0,1|2,0,0]=4 6088 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)Br b0314b8c9a02b160f8acf9f0d6644d66 [0,1,0,0,0,1|2,0,0]=4 6089 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)C b0e3f0e3133888130e9b41520f1e3b11 [0,1,0,0,0,1|2,0,0]=4 6090 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)Cl 529de2286b45616ce4190ac7bbf46272 [0,1,0,0,0,1|2,0,0]=4 6091 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)F 077090aec6ad97914da9e56c1b45e5f7 [0,1,0,0,0,1|2,0,0]=4 6092 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)I 9359db1a58be9c5f1384574d35650ef4 [0,1,0,0,0,1|2,0,0]=4 6093 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)O fb83b59b9cc861deb4570b4aaeba8e85 [0,1,0,0,0,1|2,0,0]=4 6094 B17R1.744 CSCCCCNC(=O)Cc1ccc(cc1)S 8172d61601b092e6d6e8e806613789ff [0,1,0,0,0,1|2,0,0]=4 6095 B17R1.744 CSCCCCNC(=O)Nc1ccc(cc1)F 559a9b9507fb6e64f41809ab2b2a6be0 [0,1,0,0,0,1|2,0,0]=4 6096 B17R1.744 CSCCCCNC(=O)Nc1ccc(cc1)S 14cb913e6c91a493a42a6198e7efc1e8 [0,1,0,0,0,1|2,0,0]=4 6097 B17R1.744 Cc1ccc(cc1)CC(=O)NCCCCCCl aba50fe3c4fe9900f47d873403da7626 [0,1,0,0,0,1|2,0,0]=4 6098 B17R1.744 Cc1ccc(cc1)CC(=O)NCCCCCO 226837ea4c2d04d041e633fd346e37ff [0,1,0,0,0,1|2,0,0]=4 6099 B17R1.744 Cc1ccc(cc1)NC(=O)CCCCCCF 905aafde71be0474b44f400394de3f60 [0,1,0,0,0,1|2,0,0]=4 6100 B17R1.744 Cc1ccc(cc1)NC(=O)CCCCCCO f704065f4eba9d2955076a2599648944 [0,1,0,0,0,1|2,0,0]=4 6101 B17R1.744 Cc1ccc(cc1)NC(=O)CCCCCCS e25a195520d4cd4d40252e2da84c13dd [0,1,0,0,0,1|2,0,0]=4 6102 B17R1.744 Cc1ccc(cc1)NC(=O)NCCCCCN ebcbe18683af641218cabe0f8689af60 [0,1,0,0,0,1|2,0,0]=4 6103 B17R1.744 Cc1ccc(cc1)NC(=O)NCCCCCO 3a4715454f958a727b37008948abf6ee [0,1,0,0,0,1|2,0,0]=4 6104 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)Br b7599f19acfc79c053ba2e0f34de24af [0,1,0,0,0,1|2,0,0]=4 6105 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)Cl b4817cf2f0b4dbf9d73b3b2ba08a61a5 [0,1,0,0,0,1|2,0,0]=4 6106 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)F 8076913b7cd7c7ab411e21c8d6f1b723 [0,1,0,0,0,1|2,0,0]=4 6107 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)I 6d9d741171f2d315eb30988eeb568457 [0,1,0,0,0,1|2,0,0]=4 6108 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)N 34a968a3d90ad97999cb5be119c34fc8 [0,1,0,0,0,1|2,0,0]=4 6109 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)O 048059539817f933f691f22352b1a47d [0,1,0,0,0,1|2,0,0]=4 6110 B17R1.744 NCCCCCNC(=O)Nc1ccc(cc1)S 0ab2a557c19076998872782cc958074e [0,1,0,0,0,1|2,0,0]=4 6111 B17R1.744 O=C(CCCCCCF)Nc1ccc(cc1)Br 80b5e8d17db6570133c0078b335de38e [0,1,0,0,0,1|2,0,0]=4 6112 B17R1.744 O=C(CCCCCCF)Nc1ccc(cc1)Cl eba7aa3207a5ff1cfe8c05f608fac188 [0,1,0,0,0,1|2,0,0]=4 6113 B17R1.744 O=C(CCCCCCF)Nc1ccc(cc1)F 3db105cf61071b152efb83585093523b [0,1,0,0,0,1|2,0,0]=4 6114 B17R1.744 O=C(CCCCCCF)Nc1ccc(cc1)I 2d6d62aef0839701ee98c17162b23a49 [0,1,0,0,0,1|2,0,0]=4 6115 B17R1.744 O=C(CCCCCCF)Nc1ccc(cc1)O 9c3d6bd1641ed5ebdef9052aed8dd5ac [0,1,0,0,0,1|2,0,0]=4 6116 B17R1.744 O=C(CCCCCCF)Nc1ccc(cc1)S 615e1dd439c7042b3467300bfb9d1196 [0,1,0,0,0,1|2,0,0]=4 6117 B17R1.744 O=C(CCCCCCO)Nc1ccc(cc1)Br 8f6fe8bd61f2459ccf90e9921dbfb67c [0,1,0,0,0,1|2,0,0]=4 6118 B17R1.744 O=C(CCCCCCO)Nc1ccc(cc1)F 0e039bb894ce83f78f93944135bbd300 [0,1,0,0,0,1|2,0,0]=4 6119 B17R1.744 O=C(CCCCCCO)Nc1ccc(cc1)I 7d4e437d54511becce393e0fd17596ae [0,1,0,0,0,1|2,0,0]=4 6120 B17R1.744 O=C(CCCCCCO)Nc1ccc(cc1)O 2222b574cf337aa72863edb0e69a5b21 [0,1,0,0,0,1|2,0,0]=4 6121 B17R1.744 O=C(CCCCCCO)Nc1ccc(cc1)S a5385c7f6073c877194be856cfb18b5e [0,1,0,0,0,1|2,0,0]=4 6122 B17R1.744 O=C(CCCCCCS)Nc1ccc(cc1)F cc86e1f7eeab86f24d177e8c35dee04d [0,1,0,0,0,1|2,0,0]=4 6123 B17R1.744 O=C(CCCCCCS)Nc1ccc(cc1)I 953b0731002aa96c128658d765131df9 [0,1,0,0,0,1|2,0,0]=4 6124 B17R1.744 O=C(CCCCCCS)Nc1ccc(cc1)O 55e379c163dbc0872eb4e4dd60c9d98a [0,1,0,0,0,1|2,0,0]=4 6125 B17R1.744 O=C(CCCCCCS)Nc1ccc(cc1)S 9e2490eeefbe168cc7ab2a903710a3fb [0,1,0,0,0,1|2,0,0]=4 6126 B17R1.744 O=C(Cc1ccc(cc1)Br)NCCCCCCl 8eb9ed922bd80f80723da501e6aefa04 [0,1,0,0,0,1|2,0,0]=4 6127 B17R1.744 O=C(Cc1ccc(cc1)Br)NCCCCCO 83fac685c4b8c9e3579262dcd43b7b77 [0,1,0,0,0,1|2,0,0]=4 6128 B17R1.744 O=C(Cc1ccc(cc1)Cl)NCCCCCCl 7feb994bc710e3820ebed6ee6f7baf22 [0,1,0,0,0,1|2,0,0]=4 6129 B17R1.744 O=C(Cc1ccc(cc1)Cl)NCCCCCO eeea8dbe18df7af3e81ea3e6019ab921 [0,1,0,0,0,1|2,0,0]=4 6130 B17R1.744 O=C(Cc1ccc(cc1)F)NCCCCCCl 0da3760a00e9f981ac7c4dee6e561336 [0,1,0,0,0,1|2,0,0]=4 6131 B17R1.744 O=C(Cc1ccc(cc1)F)NCCCCCO 26524431d0b4ac7436a7af07b25cc3c1 [0,1,0,0,0,1|2,0,0]=4 6132 B17R1.744 O=C(Cc1ccc(cc1)I)NCCCCCCl 26d88a09d867353b4fcf552306db4bce [0,1,0,0,0,1|2,0,0]=4 6133 B17R1.744 O=C(Cc1ccc(cc1)I)NCCCCCO 6c7b6826b5a6a7d807fd4d7a5d39acb7 [0,1,0,0,0,1|2,0,0]=4 6134 B17R1.744 O=C(Cc1ccc(cc1)O)NCCCCCCl 8d483170e0b260b1d0f2a0394e301ad5 [0,1,0,0,0,1|2,0,0]=4 6135 B17R1.744 O=C(Cc1ccc(cc1)O)NCCCCCO 489f2f181378b6653741ee4273fca580 [0,1,0,0,0,1|2,0,0]=4 6136 B17R1.744 O=C(Cc1ccc(cc1)S)NCCCCCCl 106bea8aa3717d0bf4dcdefa91c51fb4 [0,1,0,0,0,1|2,0,0]=4 6137 B17R1.744 O=C(Cc1ccc(cc1)S)NCCCCCO 93e3041c226c62fcfc0acd459c498e3b [0,1,0,0,0,1|2,0,0]=4 6138 B17R1.744 O=C(NCCCCCO)Nc1ccc(cc1)Br 821b6eb531bb71c2d13237514bf2ae6f [0,1,0,0,0,1|2,0,0]=4 6139 B17R1.744 O=C(NCCCCCO)Nc1ccc(cc1)F 9ee8c5e84308b9cd71b215e6dd3d73fe [0,1,0,0,0,1|2,0,0]=4 6140 B17R1.744 O=C(NCCCCCO)Nc1ccc(cc1)I cdc37b66f68e1064d7ca53f2563954b9 [0,1,0,0,0,1|2,0,0]=4 6141 B17R1.744 O=C(NCCCCCO)Nc1ccc(cc1)O 0beb02b215aa7d6cb977a9d7fa81d958 [0,1,0,0,0,1|2,0,0]=4 6142 B17R1.744 O=C(NCCCCCO)Nc1ccc(cc1)S eb0bdd40dc8634bcf8be12cecd2732f1 [0,1,0,0,0,1|2,0,0]=4 6143 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)Br 71f81629a50e837a77b7d2a0776e3448 [0,1,0,0,0,1|1,0,1]=4 6144 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)C af63417643a685a8f60a9a11ccb81f55 [0,1,0,0,0,1|1,0,1]=4 6145 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)Cl 019ef418691b744ea9e053c720bc79f8 [0,1,0,0,0,1|1,0,1]=4 6146 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)F 27db89602116bb9b1baf650af7cb0814 [0,1,0,0,0,1|1,0,1]=4 6147 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)I 3ca7717f37d159df0c8097b9416f819e [0,1,0,0,0,1|1,0,1]=4 6148 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)O 20bca14a560750cf96bb23086e7c183a [0,1,0,0,0,1|1,0,1]=4 6149 B17R1.745 CCCCC/C=C/C(=O)Nc1cccc(c1)S 27308897a9b1e0e52f488ad60ba3220e [0,1,0,0,0,1|1,0,1]=4 6150 B17R1.745 CCCCCC#CC(=O)Nc1cccc(c1)C a735040f2c056c9f9bd55707e877da4a [0,1,0,0,0,1|1,0,1]=4 6151 B17R1.745 CCCCCC#CC(=O)Nc1cccc(c1)Cl 86ed51c3377cd9f94462be5a8b6672d0 [0,1,0,0,0,1|1,0,1]=4 6152 B17R1.745 CCCCCC#CC(=O)Nc1cccc(c1)F 7bc182ef87c74d270f7ba10f7291789c [0,1,0,0,0,1|1,0,1]=4 6153 B17R1.745 CCCCCC#CC(=O)Nc1cccc(c1)I d9e2ec09b34cfa6ac9b509c708f122a8 [0,1,0,0,0,1|1,0,1]=4 6154 B17R1.745 CCCCCC#CC(=O)Nc1cccc(c1)O fe9df500ce85052cc1ef0af5f1ada0d0 [0,1,0,0,0,1|1,0,1]=4 6155 B17R1.745 CCCCCCCC(=O)Nc1cc(ccn1)Br d7ab75dcdd28f273f7e585d52544170b [0,1,0,0,0,1|2,0,0]=4 6156 B17R1.745 CCCCCCCC(=O)Nc1cc(ccn1)C 4074803f37bc2e4da3b49b042cf1c2a8 [0,1,0,0,0,1|2,0,0]=4 6157 B17R1.745 CCCCCCCC(=O)Nc1cc(ccn1)Cl c68bd9a7a021122de17928358615cf01 [0,1,0,0,0,1|2,0,0]=4 6158 B17R1.745 CCCCCCCC(=O)Nc1cc(ccn1)F 91d5bdde3fedf1721efdc7b6f48879bf [0,1,0,0,0,1|2,0,0]=4 6159 B17R1.745 CCCCCCCC(=O)Nc1cc(ccn1)I 8d0ebc55c1d0abc743e0e017d81832e0 [0,1,0,0,0,1|2,0,0]=4 6160 B17R1.745 CCCCCCCC(=O)Nc1cc(ccn1)O df89c4c6a0eed47b5b8e37f2f3abf9c7 [0,1,0,0,0,1|2,0,0]=4 6161 B17R1.745 CCCCCCCC(=O)Nc1cccc(c1)C bd74cc2c6f411ab7d55ea3a5c817d274 [0,1,0,0,0,1|1,0,0]=3 6162 B17R1.745 CCCCCCCC(=O)Nc1cccc(c1)Cl 281019ac6d93faeba27775d76b753430 [0,1,0,0,0,1|1,0,0]=3 6163 B17R1.745 CCCCCCCC(=O)Nc1cccc(c1)F a3abf544add29f96b1ad26593e78712a [0,1,0,0,0,1|1,0,0]=3 6164 B17R1.745 CCCCCCCC(=O)Nc1cccc(c1)I cb9a4baeb59d2e3d54e6fdc933fb08c7 [0,1,0,0,0,1|1,0,0]=3 6165 B17R1.745 CCCCCCCC(=O)Nc1cccc(c1)O d7c17338ffe30eab721c28131b348264 [0,1,0,0,0,1|1,0,0]=3 6166 B17R1.745 CCCCCCCC(=O)Nc1cccc(n1)Br 2eda5ffe0bba5ced168c85978f1907e8 [0,1,0,0,0,1|2,0,0]=4 6167 B17R1.745 CCCCCCCC(=O)Nc1cccc(n1)C 85487842568f4dbd0d60272d4646260f [0,1,0,0,0,1|2,0,0]=4 6168 B17R1.745 CCCCCCCC(=O)Nc1cccc(n1)Cl 31cd0709b2b54418bf28622538436543 [0,1,0,0,0,1|2,0,0]=4 6169 B17R1.745 CCCCCCCC(=O)Nc1cccc(n1)F ecc3b03637a8f760947a4434c2b934d3 [0,1,0,0,0,1|2,0,0]=4 6170 B17R1.745 CCCCCCCC(=O)Nc1cccc(n1)I ede3658f15678ae3b64c8e5cf96e5e71 [0,1,0,0,0,1|2,0,0]=4 6171 B17R1.745 CCCCCCCC(=O)Nc1cccc(n1)O e7a4efdf33ba3754655c4d81e0c79322 [0,1,0,0,0,1|2,0,0]=4 6172 B17R1.745 CCCCCCCC(=O)Nc1ccnc(c1)Br 5514b3830e2a3e24d42906a5cd32d02a [0,1,0,0,0,1|2,0,0]=4 6173 B17R1.745 CCCCCCCC(=O)Nc1ccnc(c1)C be34ec3ac2f36dd946902135e8e5d516 [0,1,0,0,0,1|2,0,0]=4 6174 B17R1.745 CCCCCCCC(=O)Nc1ccnc(c1)F ed52f108a2260a62a3e325559f090f5a [0,1,0,0,0,1|2,0,0]=4 6175 B17R1.745 CCCCCCCC(=O)Nc1ccnc(c1)O f547f2d592c741f51b7f604d41368a29 [0,1,0,0,0,1|2,0,0]=4 6176 B17R1.745 CCCCCCCC(=O)Nc1cncc(c1)C ddbe2260d79ced6e7a8d7be5b98c1130 [0,1,0,0,0,1|2,0,0]=4 6177 B17R1.745 CCCCCCCC(=O)Nc1cncc(c1)Cl abd38d5cc461f988bd4e635235c5d360 [0,1,0,0,0,1|2,0,0]=4 6178 B17R1.745 CCCCCCCC(=O)Nc1cncc(c1)F 9845a7533d6804f11e15cb0440948bfd [0,1,0,0,0,1|2,0,0]=4 6179 B17R1.745 CCCCCCCC(=O)Nc1cncc(c1)I cef7bb38909f90207827266a4bdaac18 [0,1,0,0,0,1|2,0,0]=4 6180 B17R1.745 CCCCCCCC(=O)Nc1cncc(c1)O 7e5d273baa4a3b27f6e2c0136c13f7f7 [0,1,0,0,0,1|2,0,0]=4 6181 B17R1.745 CCCCCCNC(=O)Cc1cc(ccn1)Br 930a583c371850294275e248dfec8895 [0,1,0,0,0,1|2,0,0]=4 6182 B17R1.745 CCCCCCNC(=O)Cc1cc(ccn1)C 06b140eed7a90302c86849445a0ff09c [0,1,0,0,0,1|2,0,0]=4 6183 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)Br 8ea6e5774bbb0342ef3ffad3f0ab0659 [0,1,0,0,0,1|1,0,0]=3 6184 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)C de55b7595f1f3ae61e13a8e0978c1159 [0,1,0,0,0,1|1,0,0]=3 6185 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)Cl be5b52c4ffd261573eb9b6c4fb6cb65f [0,1,0,0,0,1|1,0,0]=3 6186 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)F 34931c35a7115d8c3000583700fd6e18 [0,1,0,0,0,1|1,0,0]=3 6187 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)I 7d51eba87f48d3d764939bf0e927e78f [0,1,0,0,0,1|1,0,0]=3 6188 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)O 6dc9fb4d481e005384c5f905677f7bf5 [0,1,0,0,0,1|1,0,0]=3 6189 B17R1.745 CCCCCCNC(=O)Cc1cccc(c1)S d5b459885b581716bc94494163c4db91 [0,1,0,0,0,1|1,0,0]=3 6190 B17R1.745 CCCCCCNC(=O)Cc1cccc(n1)Br f2fa7286a5e3203eb05ff932f868abfc [0,1,0,0,0,1|2,0,0]=4 6191 B17R1.745 CCCCCCNC(=O)Cc1cccc(n1)C fa9ac346294f1ae49679c86300751a2f [0,1,0,0,0,1|2,0,0]=4 6192 B17R1.745 CCCCCCNC(=O)Cc1cccc(n1)Cl 807f3acdfdaa293653fb3c91c781ad8e [0,1,0,0,0,1|2,0,0]=4 6193 B17R1.745 CCCCCCNC(=O)Cc1cccc(n1)F 39380f736d4239c121eaa72b31306153 [0,1,0,0,0,1|2,0,0]=4 6194 B17R1.745 CCCCCCNC(=O)Cc1ccnc(c1)Br c7f0dbf7ecc1cf2d893101c85943ef92 [0,1,0,0,0,1|2,0,0]=4 6195 B17R1.745 CCCCCCNC(=O)Cc1ccnc(c1)C 6e363d2525fd72cf463870dc27f6afb7 [0,1,0,0,0,1|2,0,0]=4 6196 B17R1.745 CCCCCCNC(=O)Cc1ccnc(c1)Cl 7c7a770d23c645d1c07c8dd6df1ad3c7 [0,1,0,0,0,1|2,0,0]=4 6197 B17R1.745 CCCCCCNC(=O)Cc1ccnc(c1)F a49f98c9c1af6c939c347671c8f84e26 [0,1,0,0,0,1|2,0,0]=4 6198 B17R1.745 CCCCCCNC(=O)Cc1cncc(c1)Br 46dd96343d2ba869e1389b4d55d96736 [0,1,0,0,0,1|2,0,0]=4 6199 B17R1.745 CCCCCCNC(=O)Cc1cncc(c1)C 97d9bba35e5c9da631c131abda834ca6 [0,1,0,0,0,1|2,0,0]=4 6200 B17R1.745 CCCCCCNC(=O)Cc1cncc(c1)Cl ab788a27d2f602602be4ab1456ac056a [0,1,0,0,0,1|2,0,0]=4 6201 B17R1.745 CCCCCCNC(=O)Cc1cncc(c1)F a72b15a80233efab82b7444321bcdc3a [0,1,0,0,0,1|2,0,0]=4 6202 B17R1.745 CCCCCCNC(=O)Nc1cc[nH]c(=S)c1 752871c569f4f72ee4edce144e5d72c7 [0,1,0,0,0,1|2,0,0]=4 6203 B17R1.745 CCCCCCNC(=O)Nc1cccc(c1)Cl 7acc1d0fdaa55699733d18ab0e3191ff [0,1,0,0,0,1|1,0,0]=3 6204 B17R1.745 CCCCCCNC(=O)Nc1cccc(n1)I 157a8676f8087f246f3f07270491c1f8 [0,1,0,0,0,1|2,0,0]=4 6205 B17R1.745 CCCCCCNC(=O)Nc1ccnc(c1)Br 86b54f12a2825ac3ab6e231fa2566d1c [0,1,0,0,0,1|2,0,0]=4 6206 B17R1.745 CCCCCCNC(=O)Nc1ccnc(c1)C b293dc60dce79b2aedb679f6391f5a6b [0,1,0,0,0,1|2,0,0]=4 6207 B17R1.745 CCCCCCNC(=O)Nc1ccnc(c1)Cl 280996737a41e9dc395209d8e2a84340 [0,1,0,0,0,1|2,0,0]=4 6208 B17R1.745 CCCCCCNC(=O)Nc1ccnc(c1)F 29549a91f7e4a03bc9017ff5a01353bd [0,1,0,0,0,1|2,0,0]=4 6209 B17R1.745 CCCCCCNC(=O)Nc1ccnc(c1)I e44ed80ad60b7eba33ae003e2d0dd883 [0,1,0,0,0,1|2,0,0]=4 6210 B17R1.745 CCCCCCNC(=O)Nc1ccnc(c1)O 53342c49c7527a17a67fd3c3d24f5b5b [0,1,0,0,0,1|2,0,0]=4 6211 B17R1.745 CCCCCCNC(=O)Nc1cncc(c1)C 20ea5df200575d80552192220fba79e2 [0,1,0,0,0,1|2,0,0]=4 6212 B17R1.745 CCCCCCNC(=O)Nc1cncc(c1)Cl 30c7e984552898032f9f426860f6df0a [0,1,0,0,0,1|2,0,0]=4 6213 B17R1.745 CCCCCCNC(=O)Nc1cncc(c1)F d5a5ef06d37487b45162fb7d389aa875 [0,1,0,0,0,1|2,0,0]=4 6214 B17R1.745 CCCCCCNC(=O)Nc1cncc(c1)I 5a026e58c4ecaf839b37407a18d70a7f [0,1,0,0,0,1|2,0,0]=4 6215 B17R1.745 CCCCCCNC(=O)Nc1cncc(c1)N e52f2f208f15de4aa6e3836280b6622a [0,1,0,0,0,1|2,0,0]=4 6216 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)Br d66986c636e67265580c5336e8ed23ee [0,1,0,0,0,1|1,1,0]=4 6217 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)C d5696582b61d1a580e00c15ee773ff0b [0,1,0,0,0,1|1,1,0]=4 6218 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)Cl 1d3d575de1a9500ac71a8f13d8470cd1 [0,1,0,0,0,1|1,1,0]=4 6219 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)F 37228aaab3e200625953ff58294f7762 [0,1,0,0,0,1|1,1,0]=4 6220 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)I dd63e7ba52315e3e6f874857f65b0a43 [0,1,0,0,0,1|1,1,0]=4 6221 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)N ff9b285011e2797df9561c556d814793 [0,1,0,0,0,1|1,1,0]=4 6222 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)O 45d79cea8414a1c3e0cb7bb514ab4fa8 [0,1,0,0,0,1|1,1,0]=4 6223 B17R1.745 CCCCCCNC(=S)Nc1cccc(c1)S a0445af00b079c9ae820c357bc280714 [0,1,0,0,0,1|1,1,0]=4 6224 B17R1.745 CCCCCCOC(C)Cc1cccc(c1)C ce6b2f2dd3a65acaaddc50c8657df9ae [0,1,0,0,0,1|1,0,1]=4 6225 B17R1.745 CCCCCCOC(C)Cc1cccc(c1)F 3300ba0c6c6cdecd48c247c53280f7fc [0,1,0,0,0,1|1,0,1]=4 6226 B17R1.745 CCCCCNCC(=O)Cc1cccc(c1)Br b3e1cbd51769297983fd50f2e24864d8 [0,1,0,0,0,1|2,0,0]=4 6227 B17R1.745 CCCCCNCC(=O)Nc1cccc(c1)Cl 34e735e36da3272f789c1b4ea4bb4eb3 [0,1,0,0,0,1|2,0,0]=4 6228 B17R1.745 CCCCCOCC(=O)Cc1cccc(c1)Br 83f57fe2b7679fb37389286299d32b29 [0,1,0,0,0,1|2,0,0]=4 6229 B17R1.745 CCCCCOCC(=O)Nc1cccc(c1)Br 5519a06315918d2ae6fb209bb41c48d8 [0,1,0,0,0,1|2,0,0]=4 6230 B17R1.745 CCCCCOCC(=O)Nc1cccc(c1)C b2d9fb60dada915ee48c97a0118102ce [0,1,0,0,0,1|2,0,0]=4 6231 B17R1.745 CCCCCOCC(=O)Nc1cccc(c1)Cl 66d5a45c914ffe4107924b131a09ae8b [0,1,0,0,0,1|2,0,0]=4 6232 B17R1.745 CCCNCCCC(=O)Nc1cccc(c1)C 0369dcf012499ec904d041b489b10168 [0,1,0,0,0,1|2,0,0]=4 6233 B17R1.745 CCCNCCNC(=O)Cc1cccc(c1)F 13bce8097ff43ab9366a66767eb4a023 [0,1,0,0,0,1|2,0,0]=4 6234 B17R1.745 CCCNCCNC(=O)Nc1cccc(c1)Br 755cdc1f44ab8949120d00c48fe0beb3 [0,1,0,0,0,1|2,0,0]=4 6235 B17R1.745 CCCNCCNC(=O)Nc1cccc(c1)F 991fc1190e2b57d90cb8515c180feb9b [0,1,0,0,0,1|2,0,0]=4 6236 B17R1.745 CCCOCCCC(=O)Nc1cccc(c1)C aebe14c3892e67d9417d302ae072c372 [0,1,0,0,0,1|2,0,0]=4 6237 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)Br 3ac1e418404b93d7c96253c4fd9b4de9 [0,1,0,0,0,1|2,0,0]=4 6238 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)C 945f0cc72fae313aa2ebb936a78752f1 [0,1,0,0,0,1|2,0,0]=4 6239 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)Cl 31cdb672d93a7e9da95d3a1abdc12ff8 [0,1,0,0,0,1|2,0,0]=4 6240 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)F acf7671c585021f93c870dd14691bbbb [0,1,0,0,0,1|2,0,0]=4 6241 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)I afc41f083c5722339570fcf75148baed [0,1,0,0,0,1|2,0,0]=4 6242 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)O ef94ddc816f2cefe850d203dbbbeb274 [0,1,0,0,0,1|2,0,0]=4 6243 B17R1.745 CCCOCCNC(=O)Cc1cccc(c1)S d2363ef76420db8d333d8d2ceb00a7ab [0,1,0,0,0,1|2,0,0]=4 6244 B17R1.745 CCCOCCNC(=O)Nc1cccc(c1)Br 60045250fa7155f11bef3f292b597abc [0,1,0,0,0,1|2,0,0]=4 6245 B17R1.745 CCCOCCNC(=O)Nc1cccc(c1)Cl 60067614349163f16e527157b86b8be0 [0,1,0,0,0,1|2,0,0]=4 6246 B17R1.745 CCCOCCNC(=O)Nc1cccc(c1)F 62a1a89d7640e9fefcfeab932b09700c [0,1,0,0,0,1|2,0,0]=4 6247 B17R1.745 CCCOCCNC(=O)Nc1cccc(c1)I 6c9bf188bf51eb1beb6f12133f06e697 [0,1,0,0,0,1|2,0,0]=4 6248 B17R1.745 CCCOCCNC(=O)Nc1cccc(c1)N 5eece87c92dcd1dcb5efd3de30f19dcc [0,1,0,0,0,1|2,0,0]=4 6249 B17R1.745 CCCOCCNC(=O)Nc1cccc(c1)O 18d92ec326b5eb4447533e34c4e0ab07 [0,1,0,0,0,1|2,0,0]=4 6250 B17R1.745 CCOCCCCC(=O)Nc1cccc(c1)C 4e5e57cfb01810a04f5545ac99e05885 [0,1,0,0,0,1|2,0,0]=4 6251 B17R1.745 CCOCCCCC(=O)Nc1cccc(c1)F 0997cd0b7f1c91d852402279ec507375 [0,1,0,0,0,1|2,0,0]=4 6252 B17R1.745 CCOCCCCC(=O)Nc1cccc(c1)I 9e7ef47631ee5120fb163b04c349a209 [0,1,0,0,0,1|2,0,0]=4 6253 B17R1.745 CCOCCCCC(=O)Nc1cccc(c1)O d5325c307570e5f755230c8afb1a67ef [0,1,0,0,0,1|2,0,0]=4 6254 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)Br 8bd0390a66904e19bd8467884d49abf2 [0,1,0,0,0,1|2,0,0]=4 6255 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)C b2c5fa67d7d8b37b1778995baa123473 [0,1,0,0,0,1|2,0,0]=4 6256 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)Cl 8d647fe8e1bbd2852cda0da14af4fab2 [0,1,0,0,0,1|2,0,0]=4 6257 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)F 6a80db227c8d89051ea61dfaebf13344 [0,1,0,0,0,1|2,0,0]=4 6258 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)I 6a03a2dd6b2e8ae65a62d9521b3fde4f [0,1,0,0,0,1|2,0,0]=4 6259 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)O 6def7dd96b9ff23c1bf3d23cdfc4bef8 [0,1,0,0,0,1|2,0,0]=4 6260 B17R1.745 CCOCCCNC(=O)Cc1cccc(c1)S 3b1369f1a487b9627caafc1fcf41c909 [0,1,0,0,0,1|2,0,0]=4 6261 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)Br 33c66a999de4110ad07b2bc7126bc91f [0,1,0,0,0,1|2,0,0]=4 6262 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)C 45d16271a9feda23f1b48978d43f0a2d [0,1,0,0,0,1|2,0,0]=4 6263 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)Cl c8845483a27c3525de068e41378070fe [0,1,0,0,0,1|2,0,0]=4 6264 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)F ee1816f1f71917730889665f10360d6b [0,1,0,0,0,1|2,0,0]=4 6265 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)I 0a902307b2cf979cc9e0bd4cc5db90d4 [0,1,0,0,0,1|2,0,0]=4 6266 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)N fdf3d8889346c1be139e89c0e99ab730 [0,1,0,0,0,1|2,0,0]=4 6267 B17R1.745 CCOCCCNC(=O)Nc1cccc(c1)O 7911f794e705edc483a0aa0733ad550b [0,1,0,0,0,1|2,0,0]=4 6268 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)Br 9453152c461e848ab72864c08596ea78 [0,1,0,0,0,1|2,0,0]=4 6269 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)C c742d4774695bc8b70c00b23b8803e59 [0,1,0,0,0,1|2,0,0]=4 6270 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)Cl b9c709c8e6e32776ffba5de054c1cc7c [0,1,0,0,0,1|2,0,0]=4 6271 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)F 73a85f8902bded08126206d6b3b572b5 [0,1,0,0,0,1|2,0,0]=4 6272 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)I eb8f174890fd91a74ebdbf3ffa09d457 [0,1,0,0,0,1|2,0,0]=4 6273 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)O d53c1bf040301a34892f44b79d9af099 [0,1,0,0,0,1|2,0,0]=4 6274 B17R1.745 COCCCCCC(=O)Nc1cccc(c1)S 12ad8940517022d65fd0137be439e01c [0,1,0,0,0,1|2,0,0]=4 6275 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)Br aa610d70de4ccdfb52b8785e8d06acdd [0,1,0,0,0,1|2,0,0]=4 6276 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)C 608307de195d232552291995e4609eec [0,1,0,0,0,1|2,0,0]=4 6277 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)Cl 69c968f6714d65d671b5e0b9d911ebac [0,1,0,0,0,1|2,0,0]=4 6278 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)F dffaff3bd36e2b1cce0fe552fb4019a0 [0,1,0,0,0,1|2,0,0]=4 6279 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)I 3ebdbb8742de75bd51b24792ad27045b [0,1,0,0,0,1|2,0,0]=4 6280 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)O b6998afbfeb081b59cd2f5fdacda3d5c [0,1,0,0,0,1|2,0,0]=4 6281 B17R1.745 COCCCCNC(=O)Cc1cccc(c1)S 4a25a411e9f58168688e9838d3cd0970 [0,1,0,0,0,1|2,0,0]=4 6282 B17R1.745 COCCCCNC(=O)Nc1cccc(c1)Br dc28f2482ed982c24963229a5e5487f3 [0,1,0,0,0,1|2,0,0]=4 6283 B17R1.745 COCCCCNC(=O)Nc1cccc(c1)Cl 385487dbf1ee7c2e8bdcec503eef18f3 [0,1,0,0,0,1|2,0,0]=4 6284 B17R1.745 COCCCCNC(=O)Nc1cccc(c1)F 50f09dd8caa53de934a70dd205fb50c2 [0,1,0,0,0,1|2,0,0]=4 6285 B17R1.745 COCCCCNC(=O)Nc1cccc(c1)I 154b918c084daaaa5b529b52a80fe12d [0,1,0,0,0,1|2,0,0]=4 6286 B17R1.745 COCCCCNC(=O)Nc1cccc(c1)N c5bb3908cdefb6a4ea7ae881df500be2 [0,1,0,0,0,1|2,0,0]=4 6287 B17R1.745 COCCCCNC(=O)Nc1cccc(c1)O 09b1fc2c89b79e25294d8541bf5b00d8 [0,1,0,0,0,1|2,0,0]=4 6288 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)Br 39c12dae9f5dc8d78c9cae56827a0fdc [0,1,0,0,0,1|2,0,0]=4 6289 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)C 5ece15268a98e06062a7628f08b5b223 [0,1,0,0,0,1|2,0,0]=4 6290 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)Cl 822b26469272e892c2c3d6ebac4056ab [0,1,0,0,0,1|2,0,0]=4 6291 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)F 312f5f2d26b44e20533556fb1cf59fad [0,1,0,0,0,1|2,0,0]=4 6292 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)I fa22a9caf3dd95b4703687330e8a6b4b [0,1,0,0,0,1|2,0,0]=4 6293 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)O 82865afd56cc0d14d465a03d75a35b0d [0,1,0,0,0,1|2,0,0]=4 6294 B17R1.745 CSCCCCNC(=O)Cc1cccc(c1)S 5f993dfc27838d24c8d46fdee514f035 [0,1,0,0,0,1|2,0,0]=4 6295 B17R1.745 CSCCCCNC(=O)Nc1cccc(c1)Cl 8bf28115b9dc811fba3304cd794b3962 [0,1,0,0,0,1|2,0,0]=4 6296 B17R1.745 CSCCCCNC(=O)Nc1cccc(c1)I c24b12b911a35630ea6200f8a615437c [0,1,0,0,0,1|2,0,0]=4 6297 B17R1.745 Cc1cccc(c1)CC(=O)NCCCCCCl 96c2b1a6a8f651706e8ddfc9815ed577 [0,1,0,0,0,1|2,0,0]=4 6298 B17R1.745 Cc1cccc(c1)CC(=O)NCCCCCO 9ec84c39c20714d686dd3b8050408da3 [0,1,0,0,0,1|2,0,0]=4 6299 B17R1.745 Cc1cccc(c1)NC(=O)CCCCCCF cecfd61923f04e9f3b1538657325c111 [0,1,0,0,0,1|2,0,0]=4 6300 B17R1.745 Cc1cccc(c1)NC(=O)CCCCCCO 77ccb689845495e9e20295f5f91180e7 [0,1,0,0,0,1|2,0,0]=4 6301 B17R1.745 Cc1cccc(c1)NC(=O)CCCCCCS f7581b30e17a5058025c00d549ea5953 [0,1,0,0,0,1|2,0,0]=4 6302 B17R1.745 NCCCCCNC(=O)Nc1cccc(c1)Cl 501dc04f152068538dc18f3eff1bf5e6 [0,1,0,0,0,1|2,0,0]=4 6303 B17R1.745 NCCCCCNC(=O)Nc1cccc(c1)F 79de6c95ebad310cfab67e6d38b84de0 [0,1,0,0,0,1|2,0,0]=4 6304 B17R1.745 NCCCCCNC(=O)Nc1cccc(c1)I 35d6f3945fe3dab065304ab188863e23 [0,1,0,0,0,1|2,0,0]=4 6305 B17R1.745 NCCCCCNC(=O)Nc1cccc(c1)O eb1b9fee1d92e3a7aead7a166791c3f7 [0,1,0,0,0,1|2,0,0]=4 6306 B17R1.745 O=C(CCCCCCF)Nc1cccc(c1)Br a5e646c5c0b7fd3428c2c2e6f3ce5b81 [0,1,0,0,0,1|2,0,0]=4 6307 B17R1.745 O=C(CCCCCCF)Nc1cccc(c1)Cl ad30a304d508fb442887aeab3e77ec58 [0,1,0,0,0,1|2,0,0]=4 6308 B17R1.745 O=C(CCCCCCF)Nc1cccc(c1)F 529c99fd8f2dbcc846cdbd6b6c7b16e9 [0,1,0,0,0,1|2,0,0]=4 6309 B17R1.745 O=C(CCCCCCF)Nc1cccc(c1)I f54457d5000e58f3832cf441894015f9 [0,1,0,0,0,1|2,0,0]=4 6310 B17R1.745 O=C(CCCCCCF)Nc1cccc(c1)O 5601ec253c11f77fe7a1fc544d2770c6 [0,1,0,0,0,1|2,0,0]=4 6311 B17R1.745 O=C(CCCCCCF)Nc1cccc(c1)S 33294239528b8eff031d20ce6687eae5 [0,1,0,0,0,1|2,0,0]=4 6312 B17R1.745 O=C(CCCCCCO)Nc1cccc(c1)Br bcb5788d012d2b3255b6fc20934c7661 [0,1,0,0,0,1|2,0,0]=4 6313 B17R1.745 O=C(CCCCCCO)Nc1cccc(c1)Cl 34dca46f12468559618638cfc5fbfff2 [0,1,0,0,0,1|2,0,0]=4 6314 B17R1.745 O=C(CCCCCCO)Nc1cccc(c1)F ec471986f03a1b6c348e1be0324c1787 [0,1,0,0,0,1|2,0,0]=4 6315 B17R1.745 O=C(CCCCCCO)Nc1cccc(c1)I a649eb720d933714e0957fe0b73ecae3 [0,1,0,0,0,1|2,0,0]=4 6316 B17R1.745 O=C(CCCCCCO)Nc1cccc(c1)O 24351b8fa4181a36ab9a3222e253b8dc [0,1,0,0,0,1|2,0,0]=4 6317 B17R1.745 O=C(CCCCCCO)Nc1cccc(c1)S a9aef5bbb79da5d5f159290a77e1e9c2 [0,1,0,0,0,1|2,0,0]=4 6318 B17R1.745 O=C(CCCCCCS)Nc1cccc(c1)Cl 8c809c39086123c6d7c5e179f8c88de2 [0,1,0,0,0,1|2,0,0]=4 6319 B17R1.745 O=C(CCCCCCS)Nc1cccc(c1)F 2bbb2d482acfc150e5001c31dc29f5a8 [0,1,0,0,0,1|2,0,0]=4 6320 B17R1.745 O=C(CCCCCCS)Nc1cccc(c1)I d1f7ed87b6347787fee7885ddb8677f4 [0,1,0,0,0,1|2,0,0]=4 6321 B17R1.745 O=C(CCCCCCS)Nc1cccc(c1)O 6f2a51077d672d636d541cbc7183b024 [0,1,0,0,0,1|2,0,0]=4 6322 B17R1.745 O=C(Cc1cccc(c1)Br)NCCCCCCl 1f54833551944c121b493044eed1fc7e [0,1,0,0,0,1|2,0,0]=4 6323 B17R1.745 O=C(Cc1cccc(c1)Br)NCCCCCO edde54f8f7ac5b22e055b4764bd2934c [0,1,0,0,0,1|2,0,0]=4 6324 B17R1.745 O=C(Cc1cccc(c1)Cl)NCCCCCCl 38460a1a536d96290813edea531b3b83 [0,1,0,0,0,1|2,0,0]=4 6325 B17R1.745 O=C(Cc1cccc(c1)Cl)NCCCCCO ee0c9d8c14a2aebd8d4cc1cf04825906 [0,1,0,0,0,1|2,0,0]=4 6326 B17R1.745 O=C(Cc1cccc(c1)F)NCCCCCCl 4a93e842a4a57ee17892b59c47286816 [0,1,0,0,0,1|2,0,0]=4 6327 B17R1.745 O=C(Cc1cccc(c1)F)NCCCCCO c38cefebe841b3c4014c4122c53f2cbf [0,1,0,0,0,1|2,0,0]=4 6328 B17R1.745 O=C(Cc1cccc(c1)I)NCCCCCCl 7849800fa4a530c0be8aa2a96d72abb4 [0,1,0,0,0,1|2,0,0]=4 6329 B17R1.745 O=C(Cc1cccc(c1)I)NCCCCCO 23f31810f8571724a88e79b3e8061297 [0,1,0,0,0,1|2,0,0]=4 6330 B17R1.745 O=C(Cc1cccc(c1)O)NCCCCCCl 6a048588ecc9af4c8ae268a038da8918 [0,1,0,0,0,1|2,0,0]=4 6331 B17R1.745 O=C(Cc1cccc(c1)O)NCCCCCO 6ceb1ba70d0dbb513973b0923ade9ade [0,1,0,0,0,1|2,0,0]=4 6332 B17R1.745 O=C(Cc1cccc(c1)S)NCCCCCCl 591139ffe5adfab9fd4d0c18d5e33cd7 [0,1,0,0,0,1|2,0,0]=4 6333 B17R1.745 O=C(Cc1cccc(c1)S)NCCCCCO d30abc54cd024812ab03a3ffc6b67961 [0,1,0,0,0,1|2,0,0]=4 6334 B17R1.745 O=C(NCCCCCO)Nc1cccc(c1)Cl c84f6ae86df16beb0cb501ca7d5458bd [0,1,0,0,0,1|2,0,0]=4 6335 B17R1.1226 CCC(C)CCCCC(=O)Nc1ccccc1 626185d5088e69a98a57ededf1682cdf [0,1,0,0,0,1|1,0,0]=3 6336 B17R1.1226 CCC(C)CCCCC(=O)Nc1ccccn1 1d20d1e60180fb13ad25bd27e765feba [0,1,0,0,0,1|2,0,0]=4 6337 B17R1.1226 CCC(C)CCCCC(=O)Nc1cccnc1 992bec808da144ae8408452a834cf895 [0,1,0,0,0,1|2,0,0]=4 6338 B17R1.1226 CCC(C)CCCCC(=O)Nc1ccncc1 38e01cbcfb7ae5723fb6cd3d48299ac9 [0,1,0,0,0,1|2,0,0]=4 6339 B17R1.1226 CCC(C)CCCOC(C)Cc1ccccc1 ad77b91a4b7dcb97fb75bff5bc737d29 [0,1,0,0,0,1|1,0,1]=4 6340 B17R1.1226 CCC(C)CCNCC(=O)Cc1ccccc1 e43d785166272e9e956ad9080c08d810 [0,1,0,0,0,1|2,0,0]=4 6341 B17R1.1226 CCC(C)CCNCC(=O)Nc1ccccc1 b73edb7d27e32e519731adf9d9e61d57 [0,1,0,0,0,1|2,0,0]=4 6342 B17R1.1226 CCC(C)CCNCC(=O)Oc1ccccc1 a9fa8cf64f49bfbf766fb5c329ce3cd6 [0,1,0,0,0,1|2,0,0]=4 6343 B17R1.1226 CCC(C)CCOCC(=O)Cc1ccccc1 aef6b7b6134e79da6eb439413a736485 [0,1,0,0,0,1|2,0,0]=4 6344 B17R1.1226 CCC(C)CCOCC(=O)Nc1ccccc1 fed923c52431c8c1e2d8532018f0ed50 [0,1,0,0,0,1|2,0,0]=4 6345 B17R1.1226 CCC(C)CCOCC(=O)Oc1ccccc1 98e1d3f640b710d9ca97b8a52bbe3c8a [0,1,0,0,0,1|2,0,0]=4 6346 B17R1.1226 CCC(C)CNCCC(=O)Nc1ccccc1 d5eab905e1c41598192d93137a523cbd [0,1,0,0,0,1|2,0,0]=4 6347 B17R1.1226 CCC(C)COCNC(=O)Cc1ccccc1 7c33c4a702f62de60148b60db478588c [0,1,0,0,0,1|2,0,0]=4 6348 B17R1.1226 CCC(C)NCCCC(=O)Nc1ccccc1 7707f624d039c84b0042d5f88a9cf575 [0,1,0,0,0,1|2,0,0]=4 6349 B17R1.1226 CCC(C)NCCNC(=O)Cc1ccccc1 404ab85b1f1f8e461584f85e052c9fe9 [0,1,0,0,0,1|2,0,0]=4 6350 B17R1.1226 CCC(C)OCCNC(=O)Cc1ccccc1 4c96f9e7c9830890c39c64c274ba685d [0,1,0,0,0,1|2,0,0]=4 6351 B17R1.1226 CCC(S)CCOCC(=O)Cc1ccccc1 06a901f8de129168f862854b784e2b39 [0,1,0,0,0,1|2,0,0]=4 6352 B17R1.1226 CCC(S)CCOCC(=O)Nc1ccccc1 20dcef79a565501af9449be961314759 [0,1,0,0,0,1|2,0,0]=4 6353 B17R1.1226 CCC(S)CCOCC(=O)Oc1ccccc1 29c55268757250a04eddbb1bf2732300 [0,1,0,0,0,1|2,0,0]=4 6354 B17R1.1226 CCN(C)CCCCC(=O)Nc1ccccc1 d8753ca49e8c93545cf9a6f50983a381 [0,1,0,0,0,1|2,0,0]=4 6355 B17R1.1226 CC[C@@H](C)CNCCC(=O)Nc1ccccc1 b0f1c316542a9c74ea94208b9c655f62 [0,1,0,0,0,1|2,0,0]=4 6356 B17R1.1226 CC[C@@H](C)COCNC(=O)Cc1ccccc1 f767524b9937d95bdc0ae7e4704a099a [0,1,0,0,0,1|2,0,0]=4 6357 B17R1.1226 CC[C@@H](C)NCCCC(=O)Nc1ccccc1 37c74ea4721082831c87951e27e04f1f [0,1,0,0,0,1|2,0,0]=4 6358 B17R1.1226 CC[C@@H](C)NCCNC(=O)Cc1ccccc1 ec7d773116e00264d2a48a16bfe2f8b0 [0,1,0,0,0,1|2,0,0]=4 6359 B17R1.1226 CC[C@@H](C)OCCNC(=O)Cc1ccccc1 94fa47539b2ba395501e90734bafd281 [0,1,0,0,0,1|2,0,0]=4 6360 B17R1.1226 CC[C@H](C)CCCCC(=O)Nc1ccccc1 8fde64c4232d820153c270df0b0ce625 [0,1,0,0,0,1|1,0,0]=3 6361 B17R1.1226 CC[C@H](C)CCCCC(=O)Nc1ccccn1 081c797f2b1d9ed6055333e79cad2a68 [0,1,0,0,0,1|2,0,0]=4 6362 B17R1.1226 CC[C@H](C)CCCCC(=O)Nc1cccnc1 1607484063be1d11b4aa014b5d230172 [0,1,0,0,0,1|2,0,0]=4 6363 B17R1.1226 CC[C@H](C)CCCCC(=O)Nc1ccncc1 16adf17cce5b3c401951d0108d38390e [0,1,0,0,0,1|2,0,0]=4 6364 B17R1.1226 CC[C@H](C)CCCOC(C)Cc1ccccc1 d4fb67288a8d488cada071adc8480ea1 [0,1,0,0,0,1|1,0,1]=4 6365 B17R1.1226 CC[C@H](C)CCOCC(=O)Cc1ccccc1 9a1f64b9b46bba8ea31754dc3c94f88a [0,1,0,0,0,1|2,0,0]=4 6366 B17R1.1226 CC[C@H](C)CCOCC(=O)Nc1ccccc1 6947826e60cf17135bba9586a3d9ae8e [0,1,0,0,0,1|2,0,0]=4 6367 B17R1.1226 CC[C@H](C)CCOCC(=O)Oc1ccccc1 6db7de9bb36cdbd246bd53147776ead1 [0,1,0,0,0,1|2,0,0]=4 6368 B17R1.1226 CC[C@H](C)CNCCC(=O)Nc1ccccc1 4779946c4dfadc13c71af1e4a7fe0edc [0,1,0,0,0,1|2,0,0]=4 6369 B17R1.1226 CC[C@H](C)COCNC(=O)Cc1ccccc1 a96af949fb99da219de846886787262a [0,1,0,0,0,1|2,0,0]=4 6370 B17R1.1226 CC[C@H](C)NCCCC(=O)Nc1ccccc1 1ea2472750eb3dad27a9fe2e733751ca [0,1,0,0,0,1|2,0,0]=4 6371 B17R1.1226 CC[C@H](C)NCCNC(=O)Cc1ccccc1 19f1b1c63c370a95598f0849d2e7c9d2 [0,1,0,0,0,1|2,0,0]=4 6372 B17R1.1226 CC[C@H](C)OCCNC(=O)Cc1ccccc1 da131fb1c6465e23253cc19489bd18cf [0,1,0,0,0,1|2,0,0]=4 6373 B17R1.1292 C#CCCCCCCC(=O)Nc1ccccc1 f6de7dd62eb34b20abf5a21d1a52a452 [0,1,0,0,0,1|1,0,1]=4 6374 B17R1.1292 C#CCCCCOCC(=O)Cc1ccccc1 53086bda32b66f0e925d1e6fb2c3601a [0,1,0,0,0,1|0,0,2]=4 6375 B17R1.1292 C#CCCCCOCC(=O)Nc1ccccc1 da862d5fe6e7de496f1bd4b370bae522 [0,1,0,0,0,1|0,0,2]=4 6376 B17R1.1292 C#CCCCCOCC(=O)Oc1ccccc1 13b723d981a80d13228f7b0e6314898d [0,1,0,0,0,1|0,0,2]=4 6377 B17R1.1292 C/C(=C\c1ccccc1)/COCCCCCF 2ead5be91423c15f876d589e1633e49d [0,1,0,0,0,1|2,0,0]=4 6378 B17R1.1292 C/C=C/CCCOCC(=O)Cc1ccccc1 dc23f699bb165fbed75b4f6c0d071830 [0,1,0,0,0,1|0,0,2]=4 6379 B17R1.1292 C/C=C/CCCOCC(=O)Nc1ccccc1 dc704a7a0217aae5d84fd61732c318f5 [0,1,0,0,0,1|0,0,2]=4 6380 B17R1.1292 C/C=C/CCCOCC(=O)Oc1ccccc1 3459a240e8a70f695fda1f6bbaa606df [0,1,0,0,0,1|0,0,2]=4 6381 B17R1.1292 C/C=C\CCCOCC(=O)Cc1ccccc1 7f3d7ecb9ff0d976d1ecfb9ecf627ad3 [0,1,0,0,0,1|0,0,2]=4 6382 B17R1.1292 C/C=C\CCCOCC(=O)Nc1ccccc1 ccbcb206bbd6f53c988edee5b4f647cf [0,1,0,0,0,1|0,0,2]=4 6383 B17R1.1292 C/C=C\CCCOCC(=O)Oc1ccccc1 324979329ad2cac2444a640be5460c16 [0,1,0,0,0,1|0,0,2]=4 6384 B17R1.1292 C=CCCCCCCC(=O)Nc1ccccc1 b6aca225ca5750b85b2465f9b74e20e4 [0,1,0,0,0,1|1,0,1]=4 6385 B17R1.1292 C=CCCCCCNC(=O)Nc1ccccc1 62e9c9ba253234c6cef4b66b4378b415 [0,1,0,0,0,1|1,0,1]=4 6386 B17R1.1292 C=CCCCCOCC(=O)Cc1ccccc1 6919cfd3c942b5ab88ed5c1391f9ab58 [0,1,0,0,0,1|0,0,2]=4 6387 B17R1.1292 C=CCCCCOCC(=O)Nc1ccccc1 bc0d88a9029d431fd0aebeca1f307322 [0,1,0,0,0,1|0,0,2]=4 6388 B17R1.1292 C=CCCCCOCC(=O)Oc1ccccc1 ab0a6af263a1f16ee0e770a0a8b2a20b [0,1,0,0,0,1|0,0,2]=4 6389 B17R1.1292 CC#CCCCOCC(=O)Cc1ccccc1 365eb9ad044abbf872ae321a3e207994 [0,1,0,0,0,1|0,0,2]=4 6390 B17R1.1292 CC#CCCCOCC(=O)Nc1ccccc1 9f6b64097eed691d5535aa0a632550e9 [0,1,0,0,0,1|0,0,2]=4 6391 B17R1.1292 CC#CCCCOCC(=O)Oc1ccccc1 be9c19da80b30a6ac9f29bbfb8f01e8f [0,1,0,0,0,1|0,0,2]=4 6392 B17R1.1292 CC(Cc1ccccc1)OCCCCCCF 3f2735bfd1040290755f18b7b0ba0f00 [0,1,0,0,0,1|1,0,1]=4 6393 B17R1.1292 CC/C=C/CCOCC(=O)Cc1ccccc1 0d9bfb1c2a021dd69d4df2cb288fe8ec [0,1,0,0,0,1|0,0,2]=4 6394 B17R1.1292 CC/C=C/CCOCC(=O)Nc1ccccc1 3c836a85bcf358c24c13a0355582a1bb [0,1,0,0,0,1|0,0,2]=4 6395 B17R1.1292 CC/C=C/CCOCC(=O)Oc1ccccc1 eab1503c59981ef5255697d31750005b [0,1,0,0,0,1|0,0,2]=4 6396 B17R1.1292 CC/C=C\CCOCC(=O)Cc1ccccc1 1ebd3ffb1e8b6b4eca95c650aed73608 [0,1,0,0,0,1|0,0,2]=4 6397 B17R1.1292 CC/C=C\CCOCC(=O)Nc1ccccc1 9bf6a5540b3194aeee4b232ab5977529 [0,1,0,0,0,1|0,0,2]=4 6398 B17R1.1292 CC/C=C\CCOCC(=O)Oc1ccccc1 796beea7e540ccbc9297d86ff8932071 [0,1,0,0,0,1|0,0,2]=4 6399 B17R1.1292 CC=CCCCOCC(=O)Cc1ccccc1 6cd88d4d55643f3f428a72cb0fc185ff [0,1,0,0,0,1|0,0,2]=4 6400 B17R1.1292 CC=CCCCOCC(=O)Nc1ccccc1 c77e021c51e21f7c2cafe647d5a53ad3 [0,1,0,0,0,1|0,0,2]=4 6401 B17R1.1292 CC=CCCCOCC(=O)Oc1ccccc1 daa9b4be2388828e713fd0b527b58718 [0,1,0,0,0,1|0,0,2]=4 6402 B17R1.1292 CCC#CCCOCC(=O)Cc1ccccc1 713538d297ef7864488788a5a83b14ab [0,1,0,0,0,1|0,0,2]=4 6403 B17R1.1292 CCC#CCCOCC(=O)Nc1ccccc1 d6773e8ef1bca9cf8ea3c42aa933721d [0,1,0,0,0,1|0,0,2]=4 6404 B17R1.1292 CCC/C=C/CCCC(=O)Nc1ccccc1 4ffcafca353b7a1cf8c307cf7788005e [0,1,0,0,0,1|1,0,1]=4 6405 B17R1.1292 CCC/C=C/COCC(=O)Cc1ccccc1 2ddd7191f93e2781edf1665f9a4fb4c8 [0,1,0,0,0,1|0,0,2]=4 6406 B17R1.1292 CCC/C=C/COCC(=O)Nc1ccccc1 68ac75b761abdb64416854c3cc0c0c3e [0,1,0,0,0,1|0,0,2]=4 6407 B17R1.1292 CCC/C=C/COCC(=O)Oc1ccccc1 d74c7731593f5f116362cc079fd3544c [0,1,0,0,0,1|0,0,2]=4 6408 B17R1.1292 CCC/C=C\COCC(=O)Cc1ccccc1 7fd39335eb2611d0e7b7ca0efb9e4e96 [0,1,0,0,0,1|0,0,2]=4 6409 B17R1.1292 CCC/C=C\COCC(=O)Nc1ccccc1 a09894d3131a043fa184c7f957c29392 [0,1,0,0,0,1|0,0,2]=4 6410 B17R1.1292 CCC/C=C\COCC(=O)Oc1ccccc1 f95fd21af86deb7040e91d81c54b9d10 [0,1,0,0,0,1|0,0,2]=4 6411 B17R1.1292 CCCC#CCOCC(=O)Cc1ccccc1 1f07dfc2eb6785f4a7640ce01e9ff30b [0,1,0,0,0,1|0,0,2]=4 6412 B17R1.1292 CCCC#CCOCC(=O)Nc1ccccc1 29ee06c7c5f900c435640ab78e00cf9b [0,1,0,0,0,1|0,0,2]=4 6413 B17R1.1292 CCCC#CCOCC(=O)Oc1ccccc1 82732db2c53b880e09b58adbf4b6d483 [0,1,0,0,0,1|0,0,2]=4 6414 B17R1.1292 CCCCC/C=C/CC(=O)Nc1ccccc1 42abd67b8148847f7e15758955dc43de [0,1,0,0,0,1|1,0,1]=4 6415 B17R1.1292 CCCCC=CCCC(=O)Nc1ccccc1 0feb42b7796f359f58354f94a0d47739 [0,1,0,0,0,1|1,0,1]=4 6416 B17R1.1292 CCCCCC/C=C/C(=O)Nc1ccccc1 60b611ad52415ec0e2e22a007602f9c2 [0,1,0,0,0,1|1,0,0]=3 6417 B17R1.1292 CCCCCC/C=C/C(=O)Nc1ccccn1 7304ea1017728437737990213d4ff677 [0,1,0,0,0,1|2,0,0]=4 6418 B17R1.1292 CCCCCC/C=C/C(=O)Nc1cccnc1 18598bb78451ccf7da10b8b0f32a35cd [0,1,0,0,0,1|2,0,0]=4 6419 B17R1.1292 CCCCCC/C=C/C(=O)Nc1ccncc1 de499de35dc8e36f1b45b948abc70541 [0,1,0,0,0,1|2,0,0]=4 6420 B17R1.1292 CCCCCCCCC(=O)Nc1ccccc1 291317a6821d6ae87fc6b5870fe38aca [0,1,0,0,0,1|1,0,0]=3 6421 B17R1.1292 CCCCCCCCC(=O)Nc1ccccn1 2d4724cac2c875872c46b9897f340f43 [0,1,0,0,0,1|2,0,0]=4 6422 B17R1.1292 CCCCCCCCC(=O)Nc1cccnc1 9030639f7b3068a551420944d4e752c2 [0,1,0,0,0,1|2,0,0]=4 6423 B17R1.1292 CCCCCCCCC(=O)Nc1ccncc1 137f1ce914f95cce1e6a76950b4357b5 [0,1,0,0,0,1|2,0,0]=4 6424 B17R1.1292 CCCCCCCNC(=O)Cc1ccccn1 db5bef827640330f7c3de03a313c727e [0,1,0,0,0,1|2,0,0]=4 6425 B17R1.1292 CCCCCCCNC(=O)Cc1cccnc1 24a12c4bbf00af9f8be7896b852c1cf2 [0,1,0,0,0,1|2,0,0]=4 6426 B17R1.1292 CCCCCCCNC(=O)Cc1ccncc1 9abd0ce524e05a8050962f55e19a4557 [0,1,0,0,0,1|2,0,0]=4 6427 B17R1.1292 CCCCCCCNC(=O)Nc1ccccn1 fb527fc1c24dabe11c76cb3f3c83cfa6 [0,1,0,0,0,1|2,0,0]=4 6428 B17R1.1292 CCCCCCCNC(=O)Nc1cccnc1 48b42a0c6b489d73dbee2c5a0eda1b68 [0,1,0,0,0,1|2,0,0]=4 6429 B17R1.1292 CCCCCCCNC(=O)Nc1ccncc1 b174bc2e4d99b1b1d8249f705951b54b [0,1,0,0,0,1|2,0,0]=4 6430 B17R1.1292 CCCCCCCNC(=S)Nc1ccccc1 e927164bb794c506226157bb2dac70eb [0,1,0,0,0,1|1,1,0]=4 6431 B17R1.1292 CCCCCCCOC(C)Cc1ccccc1 1614e6ac412ece6f1e5f78a4d5c71e46 [0,1,0,0,0,1|1,0,1]=4 6432 B17R1.1292 CCCCCCCO[C@@H](C)Cc1ccccc1 e100276f45c6936d76819b90c64a615d [0,1,0,0,0,1|1,0,1]=4 6433 B17R1.1292 CCCCCCCO[C@H](C)Cc1ccccc1 5471099f83e7cc31dcdccca76d71c2bf [0,1,0,0,0,1|1,0,1]=4 6434 B17R1.1292 CCCCCCNCC(=O)Cc1ccccc1 8fac9c7245c525f38cc19aa101641a2d [0,1,0,0,0,1|1,0,0]=3 6435 B17R1.1292 CCCCCCNCC(=O)Nc1ccccc1 44c511c16bef4a7111008b5d7fc46984 [0,1,0,0,0,1|1,0,0]=3 6436 B17R1.1292 CCCCCCNCC(=O)Nc1ccccn1 679b8fb923d548213700f1fed36fec17 [0,1,0,0,0,1|2,0,0]=4 6437 B17R1.1292 CCCCCCNCC(=O)Nc1ccncc1 77988795a986e93b73193a43835b698b [0,1,0,0,0,1|2,0,0]=4 6438 B17R1.1292 CCCCCCNCC(=O)Oc1ccccc1 e5425f75f03932b1f1bf78d6d2d3441e [0,1,0,0,0,1|1,0,0]=3 6439 B17R1.1292 CCCCCCOC/C(=C/c1ccccc1)/C f2593342597259dd9522fc2736153ea8 [0,1,0,0,0,1|1,0,0]=3 6440 B17R1.1292 CCCCCCOCC(=O)Cc1ccccc1 7000bbddfe865e81be8c20d725a0f33a [0,1,0,0,0,1|0,0,0]=2 6441 B17R1.1292 CCCCCCOCC(=O)Nc1ccccc1 3b60dd3c18d3235e17d5f94c21a485f0 [0,1,0,0,0,1|0,0,0]=2 6442 B17R1.1292 CCCCCCOCC(=O)Nc1ccccn1 b18dd01ccb7aefcc45e107c189c1df72 [0,1,0,0,0,1|1,0,0]=3 6443 B17R1.1292 CCCCCCOCC(=O)Nc1ccncc1 39b03e54c730e99ed19c72ec34393088 [0,1,0,0,0,1|1,0,0]=3 6444 B17R1.1292 CCCCCCOCC(=O)Nc1cnccn1 59da2975621eac58c6cf66fedd1a04ea [0,1,0,0,0,1|2,0,0]=4 6445 B17R1.1292 CCCCCCOCC(=O)Nc1ncccn1 137ee091d1407534a6b9dc57df5b93da [0,1,0,0,0,1|2,0,0]=4 6446 B17R1.1292 CCCCCCOCC(=O)Oc1ccccc1 805deb4412f74633e2ab8fa10a3bd824 [0,1,0,0,0,1|0,0,0]=2 6447 B17R1.1292 CCCCCCOCC(C)Cc1ccccc1 e283a14bce358317c8fbb6a64d41ccb6 [0,1,0,0,0,1|1,0,1]=4 6448 B17R1.1292 CCCCCCOCC(C)Oc1ccccc1 2255667d6072b7e0ae3e8b646207cee7 [0,1,0,0,0,1|1,0,1]=4 6449 B17R1.1292 CCCCCCOC[C@H](C)Oc1ccccc1 79879adef8100719c7b8ea9a90b5f89e [0,1,0,0,0,1|1,0,1]=4 6450 B17R1.1292 CCCCCNCCC(=O)Nc1ccccc1 e0acca7427e2ef791f1820fdb800640b [0,1,0,0,0,1|1,0,0]=3 6451 B17R1.1292 CCCCCNCCC(=O)Nc1ccccn1 29bce1a3c0ea79274ed8f4d3aed23c21 [0,1,0,0,0,1|2,0,0]=4 6452 B17R1.1292 CCCCCNCCC(=O)Nc1cccnc1 fd9f0bdbd35e728582e474e540db6021 [0,1,0,0,0,1|2,0,0]=4 6453 B17R1.1292 CCCCCOCCC(=O)Nc1cccnc1 720eaa24611d6fdc1f789bb29b9b2440 [0,1,0,0,0,1|2,0,0]=4 6454 B17R1.1292 CCCCCOCNC(=O)Cc1ccccc1 7c6babb6eb1b6192a437ede07340eb5b [0,1,0,0,0,1|1,0,0]=3 6455 B17R1.1292 CCCCNCCCC(=O)Nc1ccccc1 aa9b202e28a78d29cb3d75f5e83d08f8 [0,1,0,0,0,1|1,0,0]=3 6456 B17R1.1292 CCCCNCCNC(=O)Cc1ccccc1 d515f2054a93589f4b521f081ab03666 [0,1,0,0,0,1|1,0,0]=3 6457 B17R1.1292 CCCCNCCNC(=O)Nc1cccnc1 8b42633f88df4b7c3170779bbdfd87f5 [0,1,0,0,0,1|2,0,0]=4 6458 B17R1.1292 CCCCNCCNC(=O)Nc1ccncc1 93765a13e00013376d0bc046ffadc51a [0,1,0,0,0,1|2,0,0]=4 6459 B17R1.1292 CCCCOCCCC(=O)Nc1ccccc1 cdef75abafcf354d181f8780c52ac4ee [0,1,0,0,0,1|1,0,0]=3 6460 B17R1.1292 CCCCOCCNC(=O)Cc1ccccc1 21e3616e2498fd5fa58ae536af657ada [0,1,0,0,0,1|1,0,0]=3 6461 B17R1.1292 CCCCOCCNC(=O)Cc1ccccn1 571afca8c5b0ce2ca84c33a607826f78 [0,1,0,0,0,1|2,0,0]=4 6462 B17R1.1292 CCCCOCCNC(=O)Cc1cccnc1 0892c2a6c26bdc86d645396f3428a757 [0,1,0,0,0,1|2,0,0]=4 6463 B17R1.1292 CCCCOCCNC(=O)Cc1ccncc1 f2fbac076d5878f305b81892ef5807f8 [0,1,0,0,0,1|2,0,0]=4 6464 B17R1.1292 CCCCOCCNC(=O)Nc1ccccn1 6e5353f332c5218d33f0628290a6c855 [0,1,0,0,0,1|2,0,0]=4 6465 B17R1.1292 CCCCOCCNC(=O)Nc1cccnc1 3ffcdbecad011cdadf79fc6bbc853832 [0,1,0,0,0,1|2,0,0]=4 6466 B17R1.1292 CCCCOCCNC(=O)Nc1ccncc1 9d7841571ce6edd6f4a8687e952bf878 [0,1,0,0,0,1|2,0,0]=4 6467 B17R1.1292 CCCCOCCNC(=S)Nc1ccccc1 b0293f01e7b138af245195365fa6bb16 [0,1,0,0,0,1|1,1,0]=4 6468 B17R1.1292 CCCCOCCOC(C)Cc1ccccc1 52cdac14d9809136cdd7002ec8b1a2be [0,1,0,0,0,1|1,0,1]=4 6469 B17R1.1292 CCCCOCCO[C@@H](C)Cc1ccccc1 db84e48223b6e499db4554da1189b7c2 [0,1,0,0,0,1|1,0,1]=4 6470 B17R1.1292 CCCCOCCO[C@H](C)Cc1ccccc1 6405835d582ed53e936cd04df596e36c [0,1,0,0,0,1|1,0,1]=4 6471 B17R1.1292 CCCCOCOC/C(=C/c1ccccc1)/C 46d2251f8e299265ca2ddbbe6e9b6578 [0,1,0,0,0,1|2,0,0]=4 6472 B17R1.1292 CCCCOCOCC(=O)Nc1ccccc1 a943f375ba52afe4d6dbab9d89ed189b [0,1,0,0,0,1|1,0,0]=3 6473 B17R1.1292 CCCNCCCCC(=O)Nc1ccccc1 fd33c076dfd9ceb47d88efbffd62054e [0,1,0,0,0,1|1,0,0]=3 6474 B17R1.1292 CCCOCCCCC(=O)Nc1ccccc1 b324541942dccdd0a612927f6db05507 [0,1,0,0,0,1|1,0,0]=3 6475 B17R1.1292 CCCOCCCNC(=O)Cc1ccccn1 5a9b497d0f5cdf3324a93d529892963e [0,1,0,0,0,1|2,0,0]=4 6476 B17R1.1292 CCCOCCCNC(=O)Cc1cccnc1 19ac8eb9aec3d8f9e4db090e194a0e07 [0,1,0,0,0,1|2,0,0]=4 6477 B17R1.1292 CCCOCCCNC(=O)Cc1ccncc1 5c156ca35e4cd8b213e955486b38c46e [0,1,0,0,0,1|2,0,0]=4 6478 B17R1.1292 CCCOCCCNC(=O)Nc1ccccc1 e9eda47201054699b8193954f3d9dc11 [0,1,0,0,0,1|1,0,0]=3 6479 B17R1.1292 CCCOCCCNC(=O)Nc1ccccn1 7c59a65aabc5ffa3c4fceb5cec27f51d [0,1,0,0,0,1|2,0,0]=4 6480 B17R1.1292 CCCOCCCNC(=O)Nc1cccnc1 51e56a5e261eee8e2fa464978dd282c4 [0,1,0,0,0,1|2,0,0]=4 6481 B17R1.1292 CCCOCCCNC(=O)Nc1ccncc1 c48cf24bb4a798813063883f5dccbe2f [0,1,0,0,0,1|2,0,0]=4 6482 B17R1.1292 CCCOCCCNC(=S)Nc1ccccc1 8d49b64c515c97647c4ed085828b5fe4 [0,1,0,0,0,1|1,1,0]=4 6483 B17R1.1292 CCCOCCCOC(C)Cc1ccccc1 d325ca557903bca665111be43b4a2b71 [0,1,0,0,0,1|1,0,1]=4 6484 B17R1.1292 CCCOCCCO[C@@H](C)Cc1ccccc1 d2cc8fb2de4f8bab84cdc13ee44444e9 [0,1,0,0,0,1|1,0,1]=4 6485 B17R1.1292 CCCOCCCO[C@H](C)Cc1ccccc1 c3bbbc0ac119e06c3e2f883d378a5732 [0,1,0,0,0,1|1,0,1]=4 6486 B17R1.1292 CCCOCCNCC(=O)Cc1ccccc1 09a73cd942daafe1fa36615591f5c481 [0,1,0,0,0,1|2,0,0]=4 6487 B17R1.1292 CCCOCCNCC(=O)Nc1ccccc1 1689347b2b506f543956050cde11d83a [0,1,0,0,0,1|2,0,0]=4 6488 B17R1.1292 CCCOCCNCC(=O)Oc1ccccc1 b7df8a95c80ee696b0d594689a6538d2 [0,1,0,0,0,1|2,0,0]=4 6489 B17R1.1292 CCCOCCOC/C(=C/c1ccccc1)/C b835c31ba1b923f7496798c9fba982d1 [0,1,0,0,0,1|2,0,0]=4 6490 B17R1.1292 CCCOCCOCC(=O)Cc1ccccc1 155dd0f3f950f87fd99c552448d70f76 [0,1,0,0,0,1|1,0,0]=3 6491 B17R1.1292 CCCOCCOCC(=O)Nc1ccccc1 66570df827a89d37714903ec8b2adb07 [0,1,0,0,0,1|1,0,0]=3 6492 B17R1.1292 CCCOCCOCC(=O)Nc1ccccn1 22658a2b025abad1b9920049fe32d4ea [0,1,0,0,0,1|2,0,0]=4 6493 B17R1.1292 CCCOCCOCC(=O)Nc1ccncc1 830c2a0a7c412fa63296bc767a5fe2a1 [0,1,0,0,0,1|2,0,0]=4 6494 B17R1.1292 CCCOCCOCC(=O)Oc1ccccc1 e2019a2a9b80434433b536bb894bd287 [0,1,0,0,0,1|1,0,0]=3 6495 B17R1.1292 CCCSCCOCC(=O)Cc1ccccc1 3cb3246fe958125687f999c950165f62 [0,1,0,0,0,1|1,0,0]=3 6496 B17R1.1292 CCCSCCOCC(=O)Nc1ccccc1 68dfb53da404d0e6683636fc7c93656f [0,1,0,0,0,1|1,0,0]=3 6497 B17R1.1292 CCCSCCOCC(=O)Nc1ccccn1 c2059b86d3cc9dadf4f5d6e672c19766 [0,1,0,0,0,1|2,0,0]=4 6498 B17R1.1292 CCCSCCOCC(=O)Oc1ccccc1 aaeb2d7cebb110ec6f93afa07e1d6cbd [0,1,0,0,0,1|1,0,0]=3 6499 B17R1.1292 CCNCCCCCC(=O)Nc1ccccc1 a9ca6b6cdfee45ae38645e0dc45dfa83 [0,1,0,0,0,1|1,0,0]=3 6500 B17R1.1292 CCOCCCNCC(=O)Nc1ccccc1 de6202c2494bdd44add8f89ab6e75a9e [0,1,0,0,0,1|2,0,0]=4 6501 B17R1.1292 CCOCCCOC/C(=C/c1ccccc1)/C 813fb01d1cb7ae9c35d4b7015d2d61f8 [0,1,0,0,0,1|2,0,0]=4 6502 B17R1.1292 CCOCCCOCC(=O)Cc1ccccc1 3d606f59ce80dbbd2185dbad200c6297 [0,1,0,0,0,1|1,0,0]=3 6503 B17R1.1292 CCOCCCOCC(=O)Nc1ccccc1 c63bb0f074c0bcb78e8550755d608750 [0,1,0,0,0,1|1,0,0]=3 6504 B17R1.1292 CCOCCCOCC(=O)Nc1ccccn1 a00c57ad71e28c500feeba92e3cb0c30 [0,1,0,0,0,1|2,0,0]=4 6505 B17R1.1292 CCOCCCOCC(=O)Nc1ccncc1 19a41f34f66db7c26a4ef436ade12020 [0,1,0,0,0,1|2,0,0]=4 6506 B17R1.1292 CCOCCNCCC(=O)Nc1ccccc1 484a40b6825fc8ca446c5e3293ef3337 [0,1,0,0,0,1|2,0,0]=4 6507 B17R1.1292 CCOCCOCCC(=O)Nc1ccccc1 350d1da9c06bac9933881f9622ab6140 [0,1,0,0,0,1|2,0,0]=4 6508 B17R1.1292 CCOCCOCCC(=O)Oc1ccccc1 8d0906b3d99967a92006cff6738493a5 [0,1,0,0,0,1|2,0,0]=4 6509 B17R1.1292 CCOCCOCNC(=O)Cc1ccccc1 10aa15f52bca61d6bbed4967c387ec48 [0,1,0,0,0,1|2,0,0]=4 6510 B17R1.1292 CCOCNCCCC(=O)Nc1ccccc1 1b662f77b0f86d003777e552ed2c7779 [0,1,0,0,0,1|2,0,0]=4 6511 B17R1.1292 CCOCOCCNC(=O)Cc1ccccc1 e2422a9cb1855c221393e44970655253 [0,1,0,0,0,1|2,0,0]=4 6512 B17R1.1292 CCSCCCCNC(=O)Cc1ccccn1 3a252919d7abd3476fb372048fed7b78 [0,1,0,0,0,1|2,0,0]=4 6513 B17R1.1292 CCSCCCCNC(=O)Cc1cccnc1 1818e96ecc3c47f77d4411b95e5b4ca5 [0,1,0,0,0,1|2,0,0]=4 6514 B17R1.1292 CCSCCCCNC(=O)Cc1ccncc1 95b1d7d019e62122ef65a7e06bd06552 [0,1,0,0,0,1|2,0,0]=4 6515 B17R1.1292 CCSCCCCNC(=O)Nc1ccccn1 23e6010e9eb4f84deb36c2513fa3fd95 [0,1,0,0,0,1|2,0,0]=4 6516 B17R1.1292 CCSCCCCNC(=O)Nc1cccnc1 4688e87b0a61ad29b3d9bbfcf43c9192 [0,1,0,0,0,1|2,0,0]=4 6517 B17R1.1292 CCSCCCCNC(=O)Nc1ccncc1 e0584e2b61c390508d3c1ffafcbe64e7 [0,1,0,0,0,1|2,0,0]=4 6518 B17R1.1292 CCSCCCCNC(=S)Nc1ccccc1 07aec26f8f8a00c9eb8f9d8edb2e09b9 [0,1,0,0,0,1|1,1,0]=4 6519 B17R1.1292 CCSCCCNCC(=O)Nc1ccccc1 01503a3e6dcff40da9bb9ee044ae3e66 [0,1,0,0,0,1|2,0,0]=4 6520 B17R1.1292 CCSCCCOC/C(=C/c1ccccc1)/C 39db088e5cb6de8daa530ba7133b3967 [0,1,0,0,0,1|2,0,0]=4 6521 B17R1.1292 CCSCCCOCC(=O)Cc1ccccc1 6685595e12a4738bac9b44b0d6bdddf9 [0,1,0,0,0,1|1,0,0]=3 6522 B17R1.1292 CCSCCCOCC(=O)Nc1ccccc1 ea86369cc9b0ef348464836143772097 [0,1,0,0,0,1|1,0,0]=3 6523 B17R1.1292 CCSCCCOCC(=O)Nc1ccccn1 f74da73efcad947cea448843ec4335df [0,1,0,0,0,1|2,0,0]=4 6524 B17R1.1292 CCSCCCOCC(=O)Nc1ccncc1 5b806d8d84ef0fbf5ac6f3bb321a96d8 [0,1,0,0,0,1|2,0,0]=4 6525 B17R1.1292 CCSCCNCCC(=O)Nc1ccccc1 996a8e87b5cd2b07b3820bcf4acd695a [0,1,0,0,0,1|2,0,0]=4 6526 B17R1.1292 CCSCCOCNC(=O)Cc1ccccc1 b38585fd8cd570273c6b2c70e2ee687d [0,1,0,0,0,1|2,0,0]=4 6527 B17R1.1292 COCCCCCNC(=O)Cc1ccccn1 5e8f1d99c734103336b3a109167f1a62 [0,1,0,0,0,1|2,0,0]=4 6528 B17R1.1292 COCCCCCNC(=O)Cc1cccnc1 695a6660ddd26b06de6c92095794a6da [0,1,0,0,0,1|2,0,0]=4 6529 B17R1.1292 COCCCCCNC(=O)Cc1ccncc1 e30b7a88b6993cf2007ae9089f3e63a3 [0,1,0,0,0,1|2,0,0]=4 6530 B17R1.1292 COCCCCCNC(=O)Nc1ccccn1 b2acb929118a9cd348cb4047ec55e5cd [0,1,0,0,0,1|2,0,0]=4 6531 B17R1.1292 COCCCCCNC(=O)Nc1cccnc1 35210e999690fd85d93ef17fead02c07 [0,1,0,0,0,1|2,0,0]=4 6532 B17R1.1292 COCCCCCNC(=O)Nc1ccncc1 adaa4c65edefd821d2a333b67dd8afc2 [0,1,0,0,0,1|2,0,0]=4 6533 B17R1.1292 COCCCCCNC(=S)Nc1ccccc1 86356f01cc22caa9e03854dc00459abe [0,1,0,0,0,1|1,1,0]=4 6534 B17R1.1292 COCCCCCOC(C)Cc1ccccc1 4b5321eb0e7b85189981a9a100ee3ae8 [0,1,0,0,0,1|1,0,1]=4 6535 B17R1.1292 COCCCCCO[C@@H](C)Cc1ccccc1 ace18b7dfbfae1d19d1ac5f7dfbf29aa [0,1,0,0,0,1|1,0,1]=4 6536 B17R1.1292 COCCCCCO[C@H](C)Cc1ccccc1 20ea581d999bb54953b9d3f9518aca5d [0,1,0,0,0,1|1,0,1]=4 6537 B17R1.1292 COCCCCNCC(=O)Cc1ccccc1 01c1db06595a66e3788ccf0698091400 [0,1,0,0,0,1|2,0,0]=4 6538 B17R1.1292 COCCCCNCC(=O)Nc1ccccc1 4669fb08b37457ab4d4ce6922bac608d [0,1,0,0,0,1|2,0,0]=4 6539 B17R1.1292 COCCCCNCC(=O)Oc1ccccc1 7063233ff99c9c026bc8973073c23b5c [0,1,0,0,0,1|2,0,0]=4 6540 B17R1.1292 COCCCCOC/C(=C/c1ccccc1)/C c800c37aec1a8c3884dd663a8dc623b4 [0,1,0,0,0,1|2,0,0]=4 6541 B17R1.1292 COCCCCOCC(=O)Cc1ccccc1 aac6f8d8dc2cb773cb08b9b18abfca27 [0,1,0,0,0,1|1,0,0]=3 6542 B17R1.1292 COCCCCOCC(=O)Nc1ccccc1 4650670dbd23af13e487127fe7a9a4e8 [0,1,0,0,0,1|1,0,0]=3 6543 B17R1.1292 COCCCCOCC(=O)Nc1ccccn1 b91d38c2a0da7600d1d0a74eac9e33d0 [0,1,0,0,0,1|2,0,0]=4 6544 B17R1.1292 COCCCCOCC(=O)Oc1ccccc1 0e08bc6a0e8eeac7d73c3b57d3b540db [0,1,0,0,0,1|1,0,0]=3 6545 B17R1.1292 COCCCNCCC(=O)Nc1ccccc1 efa9618dee6e7de5760bdda799611df1 [0,1,0,0,0,1|2,0,0]=4 6546 B17R1.1292 COCCCOCNC(=O)Cc1ccccc1 f81dfcd3d6661b77b7ac3e256a0afc62 [0,1,0,0,0,1|2,0,0]=4 6547 B17R1.1292 COCCNCCCC(=O)Nc1ccccc1 f6e8223927c1865d6f10beb805b30352 [0,1,0,0,0,1|2,0,0]=4 6548 B17R1.1292 COCCNCCNC(=O)Cc1ccccc1 7d2e202a5e7f4614b967e05551a8aaf0 [0,1,0,0,0,1|2,0,0]=4 6549 B17R1.1292 COCCOCCCC(=O)Nc1ccccc1 9f33ad76547af308c6a94ec33d62deb0 [0,1,0,0,0,1|2,0,0]=4 6550 B17R1.1292 COCCOCCNC(=O)Cc1ccccc1 2781a5d890c4fba13adc420ba271d3c5 [0,1,0,0,0,1|2,0,0]=4 6551 B17R1.1292 COCCOCCNC(=O)Nc1ccccc1 f67e874d0ab73584a7fd9d688fcdb63c [0,1,0,0,0,1|2,0,0]=4 6552 B17R1.1292 COCCOCOCC(=O)Nc1ccccc1 447f2506f0882eb050a912b4c750898b [0,1,0,0,0,1|2,0,0]=4 6553 B17R1.1292 COCOCCCCC(=O)Nc1ccccc1 42e506341c6fc68b19e7927587a4ef19 [0,1,0,0,0,1|2,0,0]=4 6554 B17R1.1292 COCOCCOCC(=O)Nc1ccccc1 fb6b47dd679cf84c9a4b8ec56358384e [0,1,0,0,0,1|2,0,0]=4 6555 B17R1.1292 CSCCCCCCC(=O)Nc1ccccc1 b6e0c83006d59a41e681a4d047b29944 [0,1,0,0,0,1|1,0,0]=3 6556 B17R1.1292 CSCCCCCCC(=O)Nc1ccccn1 a2448823f49bf08171edc40c245647d4 [0,1,0,0,0,1|2,0,0]=4 6557 B17R1.1292 CSCCCCCCC(=O)Nc1cccnc1 eb519ccb34b972cb3c7d35751e348fa6 [0,1,0,0,0,1|2,0,0]=4 6558 B17R1.1292 CSCCCCCCC(=O)Nc1ccncc1 79c1171396c944367b47286cb6ff4816 [0,1,0,0,0,1|2,0,0]=4 6559 B17R1.1292 CSCCCCNCC(=O)Cc1ccccc1 16e6d350bcb1f31e0eb60f00c7e99636 [0,1,0,0,0,1|2,0,0]=4 6560 B17R1.1292 CSCCCCNCC(=O)Nc1ccccc1 4b670d91ea3047cb8b1f5d5f3b50076e [0,1,0,0,0,1|2,0,0]=4 6561 B17R1.1292 CSCCCCNCC(=O)Oc1ccccc1 86f0e6b53860a0f64e6152cc78182a7d [0,1,0,0,0,1|2,0,0]=4 6562 B17R1.1292 CSCCCCOCC(=O)Cc1ccccc1 4bff9872e544425f25ca1ad74b8c0229 [0,1,0,0,0,1|1,0,0]=3 6563 B17R1.1292 CSCCCCOCC(=O)Nc1ccccc1 31cb3857f4da39c4397b0058f25e8b0d [0,1,0,0,0,1|1,0,0]=3 6564 B17R1.1292 CSCCCCOCC(=O)Nc1ccccn1 16f18516dbe7b65f05dec475dbd6acc3 [0,1,0,0,0,1|2,0,0]=4 6565 B17R1.1292 CSCCCCOCC(=O)Nc1ccncc1 e303fa41d829369f0501d3c354cdd31f [0,1,0,0,0,1|2,0,0]=4 6566 B17R1.1292 CSCCCCOCC(=O)Oc1ccccc1 504d280c5cc2a92e6a54cbebf4421e9d [0,1,0,0,0,1|1,0,0]=3 6567 B17R1.1292 CSCCCOCNC(=O)Cc1ccccc1 09a60bc78b5cfeb97d0a314e74c838d7 [0,1,0,0,0,1|2,0,0]=4 6568 B17R1.1292 CSCCNCCCC(=O)Nc1ccccc1 beceb1a66aed9d5d29e541f59fb1effe [0,1,0,0,0,1|2,0,0]=4 6569 B17R1.1292 CSCCNCCNC(=O)Cc1ccccc1 bf3994e1d67352d14e5aa5b5b22b410f [0,1,0,0,0,1|2,0,0]=4 6570 B17R1.1292 CSCCOCCCC(=O)Nc1ccccc1 e6a0464fed099343a74951bb82417747 [0,1,0,0,0,1|2,0,0]=4 6571 B17R1.1292 CSCCOCCNC(=O)Cc1ccccc1 5bab54787e79ae00eb6ab3a4d112a2a9 [0,1,0,0,0,1|2,0,0]=4 6572 B17R1.1292 C[C@@H](Cc1ccccc1)OCCCCCCF 53fed46ee4e320dce995f5f1cf0e7b53 [0,1,0,0,0,1|1,0,1]=4 6573 B17R1.1292 C[C@H](Cc1ccccc1)OCCCCCCF 9fbd6f35a5bb2024db15301f4334dd07 [0,1,0,0,0,1|1,0,1]=4 6574 B17R1.1292 N#CCCCCOCC(=O)Cc1ccccc1 377d3e95c93acea4cc7520e20e232af5 [0,1,0,0,0,1|1,0,1]=4 6575 B17R1.1292 N#CCCCCOCC(=O)Nc1ccccc1 728053b5dd949f88c3e6de2c18fd168d [0,1,0,0,0,1|1,0,1]=4 6576 B17R1.1292 N#CCCCCOCC(=O)Oc1ccccc1 5ab604402473b38e7791b28b23c5be71 [0,1,0,0,0,1|1,0,1]=4 6577 B17R1.1292 NCCCCCCNC(=O)Nc1ccccn1 090bacaf52a60b2d4ef7d420fd42efb5 [0,1,0,0,0,1|2,0,0]=4 6578 B17R1.1292 NCCCCCCNC(=O)Nc1cccnc1 642752cb513b431ce72a20ff81ad3402 [0,1,0,0,0,1|2,0,0]=4 6579 B17R1.1292 NCCCCCCNC(=O)Nc1ccncc1 632dc313c611b8a3ed20aaa1fb9180f3 [0,1,0,0,0,1|2,0,0]=4 6580 B17R1.1292 NCCCCCCNC(=S)Nc1ccccc1 d460ae8789fbf61c2e63a32a34324ac5 [0,1,0,0,0,1|1,1,0]=4 6581 B17R1.1292 O=C(CCCCCCCF)Nc1ccccc1 e747219ab48cb318888b5cdb1825072a [0,1,0,0,0,1|1,0,0]=3 6582 B17R1.1292 O=C(CCCCCCCF)Nc1ccccn1 a94cc97bd8071f33c77ae1ff78127612 [0,1,0,0,0,1|2,0,0]=4 6583 B17R1.1292 O=C(CCCCCCCF)Nc1cccnc1 58d34348125ec057930bdbec11925d84 [0,1,0,0,0,1|2,0,0]=4 6584 B17R1.1292 O=C(CCCCCCCF)Nc1ccncc1 0895d7cc9537518715513d8b2cfd7a3f [0,1,0,0,0,1|2,0,0]=4 6585 B17R1.1292 O=C(CCCCCCCO)Nc1ccccc1 f0fda4cb5ac7fbaf4fea082fde6f204f [0,1,0,0,0,1|1,0,0]=3 6586 B17R1.1292 O=C(CCCCCCCO)Nc1ccccn1 0f1f93732380e60fee2161b13e134768 [0,1,0,0,0,1|2,0,0]=4 6587 B17R1.1292 O=C(CCCCCCCO)Nc1cccnc1 888b85efb93d780b022cbb12f084984b [0,1,0,0,0,1|2,0,0]=4 6588 B17R1.1292 O=C(CCCCCCCO)Nc1ccncc1 f648a87ed9b556e5a967707f0f0e71c3 [0,1,0,0,0,1|2,0,0]=4 6589 B17R1.1292 O=C(CCCCCCCS)Nc1ccccc1 f7abfa5b0c44e0aff01051341607ce4f [0,1,0,0,0,1|1,0,0]=3 6590 B17R1.1292 O=C(CCCCCCCS)Nc1ccccn1 c962eb68c09eac5467015d331b96f9da [0,1,0,0,0,1|2,0,0]=4 6591 B17R1.1292 O=C(CCCCCCCS)Nc1cccnc1 03758b12ded2239ca32f273493c73b0d [0,1,0,0,0,1|2,0,0]=4 6592 B17R1.1292 O=C(CCCCCCCS)Nc1ccncc1 fd177625dde5bfa34dd89ea19a91fa2e [0,1,0,0,0,1|2,0,0]=4 6593 B17R1.1292 O=C(CCCCCNCF)Nc1ccccc1 8ed107810ff592975884a86c4e059bbb [0,1,0,0,0,1|2,0,0]=4 6594 B17R1.1292 O=C(CCCCCNCO)Nc1ccccc1 1d6910720eac61a4770efd0c4e4a8c51 [0,1,0,0,0,1|2,0,0]=4 6595 B17R1.1292 O=C(CCCCNCCBr)Nc1ccccc1 a10b6a1e32b27ae0f2719115bd964d38 [0,1,0,0,0,1|2,0,0]=4 6596 B17R1.1292 O=C(CCCCNCCF)Nc1ccccc1 fb59afd1c7819d8b9f7d49cc539f7d59 [0,1,0,0,0,1|2,0,0]=4 6597 B17R1.1292 O=C(CCCCNCCI)Nc1ccccc1 344abd2c776e9fecccb519a3100b7f59 [0,1,0,0,0,1|2,0,0]=4 6598 B17R1.1292 O=C(CCCCNCCO)Nc1ccccc1 e12edd42263e8b740ece0e23c1edf61a [0,1,0,0,0,1|2,0,0]=4 6599 B17R1.1292 O=C(CCCCNCCS)Nc1ccccc1 4cf796f672c296758e9bc0a8cca1c81f [0,1,0,0,0,1|2,0,0]=4 6600 B17R1.1292 O=C(CCCCOCCF)Nc1ccccc1 1968b6ba00851e8b6cd1d0ac3309b88b [0,1,0,0,0,1|2,0,0]=4 6601 B17R1.1292 O=C(CCCCOCCS)Nc1ccccc1 fb5f79f104b04feba7652d218ce0f655 [0,1,0,0,0,1|2,0,0]=4 6602 B17R1.1292 O=C(CCCNCCCCl)Nc1ccccc1 823333d120e9588b50caa206907e97b4 [0,1,0,0,0,1|2,0,0]=4 6603 B17R1.1292 O=C(CCCNCCCF)Nc1ccccc1 b88e195e92e3f9286561b94d751ecc7d [0,1,0,0,0,1|2,0,0]=4 6604 B17R1.1292 O=C(CCCNCCCO)Nc1ccccc1 0a7215d042615f9ed0c61ad3cafb55cf [0,1,0,0,0,1|2,0,0]=4 6605 B17R1.1292 O=C(CCCNCCCS)Nc1ccccc1 e167df9f48fbf2d995faf73a5b79e2cc [0,1,0,0,0,1|2,0,0]=4 6606 B17R1.1292 O=C(CCCOCCCF)Nc1ccccc1 e27011e8281c27ed4a121c12654e5e7b [0,1,0,0,0,1|2,0,0]=4 6607 B17R1.1292 O=C(CCNCCCCCl)Nc1ccccc1 87d7f802b6498f7e9527299e37f8f5ed [0,1,0,0,0,1|2,0,0]=4 6608 B17R1.1292 O=C(CCNCCCCO)Nc1ccccc1 b06dd77b2aa4f82540dcc5e0b7fe330a [0,1,0,0,0,1|2,0,0]=4 6609 B17R1.1292 O=C(CCOCCCCF)Nc1ccccc1 7cb295af074540f56fda624703ebd670 [0,1,0,0,0,1|2,0,0]=4 6610 B17R1.1292 O=C(CCOCCCCS)Nc1ccccc1 ca22003bf8ea0d1410f5f57b5384939b [0,1,0,0,0,1|2,0,0]=4 6611 B17R1.1292 O=C(CNCCCCCCl)Cc1ccccc1 e80d040380f3c124d2352862db62f426 [0,1,0,0,0,1|2,0,0]=4 6612 B17R1.1292 O=C(CNCCCCCCl)Nc1ccccc1 c21c13eb1e5c5d0ae0d39af7523f5ccb [0,1,0,0,0,1|2,0,0]=4 6613 B17R1.1292 O=C(CNCCCCCCl)Oc1ccccc1 8e37f0df89d244fb8352ca441bb8f561 [0,1,0,0,0,1|2,0,0]=4 6614 B17R1.1292 O=C(CNCCCCCO)Cc1ccccc1 4627eaa604b305fd23289591a96b1903 [0,1,0,0,0,1|2,0,0]=4 6615 B17R1.1292 O=C(CNCCCCCO)Nc1ccccc1 7a05a2e72201f3043cc2354af5d5244a [0,1,0,0,0,1|2,0,0]=4 6616 B17R1.1292 O=C(CNCCCCCO)Oc1ccccc1 6d39b3c741f62edbecaf4cb03b344f10 [0,1,0,0,0,1|2,0,0]=4 6617 B17R1.1292 O=C(COCCCCCF)Nc1ccccc1 cf70c5a5b6c9a6573d82dc9341a98d4e [0,1,0,0,0,1|1,0,0]=3 6618 B17R1.1292 O=C(COCCOCCF)Cc1ccccc1 7ed492233752a44c108294e310e729ca [0,1,0,0,0,1|2,0,0]=4 6619 B17R1.1292 O=C(COCCOCCF)Nc1ccccc1 54edfaf91e7c92ce9552f0b24643091e [0,1,0,0,0,1|2,0,0]=4 6620 B17R1.1292 O=C(COCCOCCF)Oc1ccccc1 d00fd5b43b05334f9d823638efb1c682 [0,1,0,0,0,1|2,0,0]=4 6621 B17R1.1292 O=C(COCCOCCO)Nc1ccccc1 731af62b6cbab410059de0cb4e8b855e [0,1,0,0,0,1|2,0,0]=4 6622 B17R1.1292 O=C(COCCOCCS)Cc1ccccc1 4fadccf7ac92bb2970bdc23754bf33b7 [0,1,0,0,0,1|2,0,0]=4 6623 B17R1.1292 O=C(COCCOCCS)Nc1ccccc1 37e4897aace87ed7c7556b4de896f54c [0,1,0,0,0,1|2,0,0]=4 6624 B17R1.1292 O=C(COCCOCCS)Oc1ccccc1 8a67f2c9cca598a3ef15e5f00afba7f8 [0,1,0,0,0,1|2,0,0]=4 6625 B17R1.1292 O=C(Cc1ccccc1)NCCNCCCCl ea9a5c781d553a5a278ea26e305450cf [0,1,0,0,0,1|2,0,0]=4 6626 B17R1.1292 O=C(Cc1ccccc1)NCCNCCCO 64bc5a410752ce3528b53735f5706cca [0,1,0,0,0,1|2,0,0]=4 6627 B17R1.1292 O=C(Cc1ccccc1)NCCOCCCF ca84ac31304921cedf8292affba58481 [0,1,0,0,0,1|2,0,0]=4 6628 B17R1.1292 O=C(Cc1ccccc1)NCOCCCCF f14c879b4ec1e347cb6f26f000ea462f [0,1,0,0,0,1|2,0,0]=4 6629 B17R1.1292 O=C(Cc1ccccn1)NCCCCCCCl 748c8d8e66aed94a0aa2d7a3accdea4a [0,1,0,0,0,1|2,0,0]=4 6630 B17R1.1292 O=C(Cc1ccccn1)NCCCCCCO 3adac6c593a7e191a81c7f01fa6df5cc [0,1,0,0,0,1|2,0,0]=4 6631 B17R1.1292 O=C(Cc1cccnc1)NCCCCCCCl b5c045d01b244da65d8e4466ba8c1f60 [0,1,0,0,0,1|2,0,0]=4 6632 B17R1.1292 O=C(Cc1cccnc1)NCCCCCCO a4996a09fe68843d7771356eba5ad212 [0,1,0,0,0,1|2,0,0]=4 6633 B17R1.1292 O=C(Cc1ccncc1)NCCCCCCCl ee8f0d2f29a4b04fa7b8cdd0ee74f196 [0,1,0,0,0,1|2,0,0]=4 6634 B17R1.1292 O=C(Cc1ccncc1)NCCCCCCO 3ac098b1305b312cb2e22b872cc716e6 [0,1,0,0,0,1|2,0,0]=4 6635 B17R1.1292 O=C(NCCCCCCO)Nc1cccnc1 fee16ce2c9d139e9da416eeede0d4406 [0,1,0,0,0,1|2,0,0]=4 6636 B17R1.1292 O=C(NCCCCCCO)Nc1ccncc1 aa2e6a03b9b522f8687fe6d34d9f310f [0,1,0,0,0,1|2,0,0]=4 6637 B17R1.1292 O=CCCCCCCC(=O)Nc1ccccc1 cfb81f93d4802e8c2b87a3bfa5dcd875 [0,1,0,0,0,1|1,0,1]=4 6638 B17R1.1292 O=CCCCCOCC(=O)Cc1ccccc1 783957812d57535ccba82ab72f95027f [0,1,0,0,0,1|1,0,1]=4 6639 B17R1.1292 O=CCCCCOCC(=O)Nc1ccccc1 3aaa261c74487e9c70a5fb01a0cb34e7 [0,1,0,0,0,1|1,0,1]=4 6640 B17R1.1292 O=CCCCCOCC(=O)Oc1ccccc1 3b95936f0cb8f679eca6746a7a612df4 [0,1,0,0,0,1|1,0,1]=4 6641 B17R1.1292 OCCCCCCNC(=S)Nc1ccccc1 d0a5b07b771ef6fbcb42e5166ae44a19 [0,1,0,0,0,1|1,1,0]=4 6642 B17R1.1304 C=C(C(=O)NCCCCCC)c1ccccc1 3780a80c8f8de11323bd2b4d3c8b36f0 [0,1,0,0,0,1|1,0,0]=3 6643 B17R1.1304 C=C(C(=O)NCCCCCCl)c1ccccc1 e18064c5995b0bb4fb5ea68ef970b576 [0,1,0,0,0,1|2,0,0]=4 6644 B17R1.1304 C=C(C(=O)NCCCCCO)c1ccccc1 79b08d22a4c8288e8a1178706fcb3898 [0,1,0,0,0,1|2,0,0]=4 6645 B17R1.1304 C=C(C(=O)NCCCCOC)c1ccccc1 74177b7ddf8ececd8a9599edf06f0a06 [0,1,0,0,0,1|2,0,0]=4 6646 B17R1.1304 C=C(C(=O)NCCCCSC)c1ccccc1 9c01fafe0d2b101ec56b8044a2f27633 [0,1,0,0,0,1|2,0,0]=4 6647 B17R1.1304 C=C(C(=O)NCCCOCC)c1ccccc1 29733ab1d59f72d26c49c040fa14aacc [0,1,0,0,0,1|2,0,0]=4 6648 B17R1.1304 C=C(C(=O)NCCOCCC)c1ccccc1 4590b993e32813d44aafebb8131512ef [0,1,0,0,0,1|2,0,0]=4 6649 B17R1.1304 CC(C(=O)NCCCCCCl)c1ccccc1 e8b6a095a1ec41dd81fced1fe704ebf0 [0,1,0,0,0,1|2,0,0]=4 6650 B17R1.1304 CC(C(=O)NCCCCCO)c1ccccc1 ae46180aa011fd69ef6b0edf31d2b501 [0,1,0,0,0,1|2,0,0]=4 6651 B17R1.1304 CCCCC/C=C/C(=O)N(C)c1ccccc1 7efab5bf0897b3cb1da3d86994ca9189 [0,1,0,0,0,1|1,0,1]=4 6652 B17R1.1304 CCCCCCCC(=O)N(C)c1ccccn1 a7cb5ee09daec214c317370e8b9befb1 [0,1,0,0,0,1|2,0,0]=4 6653 B17R1.1304 CCCCCCCC(=O)N(C)c1cccnc1 d54aba658e9aa76796701a421949e458 [0,1,0,0,0,1|2,0,0]=4 6654 B17R1.1304 CCCCCCCC(=O)N(C)c1ccncc1 3298887751de35c5bef16a479428b9b9 [0,1,0,0,0,1|2,0,0]=4 6655 B17R1.1304 CCCCCCNC(=O)C(=O)c1ccccc1 076662c247fbde6daa86071740503e0a [0,1,0,0,0,1|1,0,0]=3 6656 B17R1.1304 CCCCCCNC(=O)C(=O)c1cccnc1 63b3f7614dc6d32a138770d3b74b995f [0,1,0,0,0,1|2,0,0]=4 6657 B17R1.1304 CCCCCCNC(=O)C(C)c1ccccc1 e6f52b997e2b20f0710b4f91c7fa3d51 [0,1,0,0,0,1|1,0,0]=3 6658 B17R1.1304 CCCCCCNC(=O)C(C)c1cccnc1 97a3a56c6399e5dcc5085826b080c452 [0,1,0,0,0,1|2,0,0]=4 6659 B17R1.1304 CCCCCCNC(=O)C(F)c1ccccc1 296c0fb084b17a2339fe1bac7a3edd04 [0,1,0,0,0,1|1,0,0]=3 6660 B17R1.1304 CCCCCCNC(=O)C(O)c1ccccc1 acaabc471b47cbd92e45b68758a8aa44 [0,1,0,0,0,1|1,0,0]=3 6661 B17R1.1304 CCCCCCNC(=O)C(O)c1cccnc1 ac46d419a76094d1aab396e2936c6844 [0,1,0,0,0,1|2,0,0]=4 6662 B17R1.1304 CCCCCCNC(=O)C(O)c1ccncc1 58c546e314b850c8e8d7d18cec56374a [0,1,0,0,0,1|2,0,0]=4 6663 B17R1.1304 CCCCCCNC(=O)N(C)c1ccccn1 66d3cfc7b788017dd566bb2102b3ea1f [0,1,0,0,0,1|2,0,0]=4 6664 B17R1.1304 CCCCCCNC(=O)N(C)c1cccnc1 64cd9da0f4835bc1b6caa9bce606ef9f [0,1,0,0,0,1|2,0,0]=4 6665 B17R1.1304 CCCCCCNC(=O)N(C)c1ccncc1 2a709ba169f5bac4f0d146774c4e5e0c [0,1,0,0,0,1|2,0,0]=4 6666 B17R1.1304 CCCCCCNC(=O)[C@@H](C)c1ccccc1 1e88cc7957498307ccccc84e583e743f [0,1,0,0,0,1|1,0,0]=3 6667 B17R1.1304 CCCCCCNC(=O)[C@@H](O)c1ccccc1 c4cac1aba921f244a0882abc91e6a5ac [0,1,0,0,0,1|1,0,0]=3 6668 B17R1.1304 CCCCCCNC(=O)[C@H](C)c1ccccc1 e92b10b07717cf66e07068708e92391f [0,1,0,0,0,1|1,0,0]=3 6669 B17R1.1304 CCCCCCNC(=O)[C@H](F)c1ccccc1 0b3523e01504c8a3ab3a2b9de2acf3d6 [0,1,0,0,0,1|1,0,0]=3 6670 B17R1.1304 CCCCCCNC(=O)[C@H](O)c1ccccc1 74719d467c794b9d34d64ac184a85fff [0,1,0,0,0,1|1,0,0]=3 6671 B17R1.1304 CCCOCCNC(=O)C(=O)c1ccccc1 3f33084568be61349d80778bf40fd35d [0,1,0,0,0,1|2,0,0]=4 6672 B17R1.1304 CCCOCCNC(=O)C(C)c1ccccc1 cd0e6ba36debca7da3394f57f4052f39 [0,1,0,0,0,1|2,0,0]=4 6673 B17R1.1304 CCCOCCNC(=O)C(F)c1ccccc1 5753bd0d4c33e2efc685b29e3363cf02 [0,1,0,0,0,1|2,0,0]=4 6674 B17R1.1304 CCCOCCNC(=O)C(O)c1ccccc1 9245e27ec9ed4d5e708797e45b8c20ca [0,1,0,0,0,1|2,0,0]=4 6675 B17R1.1304 CCCOCCNC(=O)[C@@H](C)c1ccccc1 0733eaf1a0097744d1b5d911281700af [0,1,0,0,0,1|2,0,0]=4 6676 B17R1.1304 CCCOCCNC(=O)[C@@H](O)c1ccccc1 b7129859f0f338cf43e516e3e9157b32 [0,1,0,0,0,1|2,0,0]=4 6677 B17R1.1304 CCCOCCNC(=O)[C@H](C)c1ccccc1 dec9e58ce2d1d9d9aa61cb7871b9cdea [0,1,0,0,0,1|2,0,0]=4 6678 B17R1.1304 CCCOCCNC(=O)[C@H](F)c1ccccc1 8175a7710a4df6c5e798b8ea55fbf537 [0,1,0,0,0,1|2,0,0]=4 6679 B17R1.1304 CCCOCCNC(=O)[C@H](O)c1ccccc1 d2b71911384c771628327dc6f489c934 [0,1,0,0,0,1|2,0,0]=4 6680 B17R1.1304 CCOCCCNC(=O)C(=O)c1ccccc1 67534b4223da9c5b95fc31bbea159580 [0,1,0,0,0,1|2,0,0]=4 6681 B17R1.1304 CCOCCCNC(=O)C(C)c1ccccc1 f496949e703086bef49f1446f48a3554 [0,1,0,0,0,1|2,0,0]=4 6682 B17R1.1304 CCOCCCNC(=O)C(F)c1ccccc1 9558375725bd75ca7a252842821f8c83 [0,1,0,0,0,1|2,0,0]=4 6683 B17R1.1304 CCOCCCNC(=O)C(O)c1ccccc1 12bdf7716e0466005455d2ad78c20b75 [0,1,0,0,0,1|2,0,0]=4 6684 B17R1.1304 CCOCCCNC(=O)[C@@H](C)c1ccccc1 9d3635e9a7329e37d122fd61a11b4382 [0,1,0,0,0,1|2,0,0]=4 6685 B17R1.1304 CCOCCCNC(=O)[C@@H](O)c1ccccc1 555d57fa92b0af4b0fc716c93625d7f8 [0,1,0,0,0,1|2,0,0]=4 6686 B17R1.1304 CCOCCCNC(=O)[C@H](C)c1ccccc1 c49bef40fa02057ee49d2fc379e9e5d1 [0,1,0,0,0,1|2,0,0]=4 6687 B17R1.1304 CCOCCCNC(=O)[C@H](F)c1ccccc1 2c7a58f1632f96359db4bfe43a2dc94c [0,1,0,0,0,1|2,0,0]=4 6688 B17R1.1304 CCOCCCNC(=O)[C@H](O)c1ccccc1 ae7380418fdfba7732bd20e17f8e7497 [0,1,0,0,0,1|2,0,0]=4 6689 B17R1.1304 COCCCCNC(=O)C(=O)c1ccccc1 d9682d0d4016125aa86def3539de9715 [0,1,0,0,0,1|2,0,0]=4 6690 B17R1.1304 COCCCCNC(=O)C(C)c1ccccc1 320bb38665febf225b5f81c1da0342be [0,1,0,0,0,1|2,0,0]=4 6691 B17R1.1304 COCCCCNC(=O)C(F)c1ccccc1 34aa78c9b183ed672e38fc3f5f732cd5 [0,1,0,0,0,1|2,0,0]=4 6692 B17R1.1304 COCCCCNC(=O)C(O)c1ccccc1 57e2da004baea2f66c5ebee88090e2a0 [0,1,0,0,0,1|2,0,0]=4 6693 B17R1.1304 COCCCCNC(=O)[C@@H](C)c1ccccc1 28d5cf9c5da053f97d85d4661b14c6cd [0,1,0,0,0,1|2,0,0]=4 6694 B17R1.1304 COCCCCNC(=O)[C@@H](O)c1ccccc1 e32f27300fc7bc1a7860165dd2f2b29a [0,1,0,0,0,1|2,0,0]=4 6695 B17R1.1304 COCCCCNC(=O)[C@H](C)c1ccccc1 9d043d52d0947c9e4cb216a080f31ca8 [0,1,0,0,0,1|2,0,0]=4 6696 B17R1.1304 COCCCCNC(=O)[C@H](F)c1ccccc1 776f0d657fcd5eca9b7cfcacfe54fb1e [0,1,0,0,0,1|2,0,0]=4 6697 B17R1.1304 COCCCCNC(=O)[C@H](O)c1ccccc1 c9186eb7a6b4af3f78ff8278a36ed713 [0,1,0,0,0,1|2,0,0]=4 6698 B17R1.1304 CSCCCCNC(=O)C(=O)c1ccccc1 7a27a9f7d18d65a85e2eb63b8d742bec [0,1,0,0,0,1|2,0,0]=4 6699 B17R1.1304 CSCCCCNC(=O)C(C)c1ccccc1 e7521fad8ca0fda1a4489d042e5c75b5 [0,1,0,0,0,1|2,0,0]=4 6700 B17R1.1304 CSCCCCNC(=O)C(F)c1ccccc1 c41578eecaad95e2c6c357dd2eb5d90e [0,1,0,0,0,1|2,0,0]=4 6701 B17R1.1304 CSCCCCNC(=O)C(O)c1ccccc1 0b125e671d998baa764120d02f1fdfcb [0,1,0,0,0,1|2,0,0]=4 6702 B17R1.1304 CSCCCCNC(=O)[C@@H](C)c1ccccc1 bfd8902a6904e92542c31a7b4dc23f9a [0,1,0,0,0,1|2,0,0]=4 6703 B17R1.1304 CSCCCCNC(=O)[C@@H](O)c1ccccc1 5b20a74eeec30f92a14ff11684c69699 [0,1,0,0,0,1|2,0,0]=4 6704 B17R1.1304 CSCCCCNC(=O)[C@H](C)c1ccccc1 7dac9322aff9493a6ff9d8f5e660f053 [0,1,0,0,0,1|2,0,0]=4 6705 B17R1.1304 CSCCCCNC(=O)[C@H](F)c1ccccc1 ce8771cf3e246cdcbaac29d203616e7c [0,1,0,0,0,1|2,0,0]=4 6706 B17R1.1304 CSCCCCNC(=O)[C@H](O)c1ccccc1 1083e439a28b880d20635596384b6a8f [0,1,0,0,0,1|2,0,0]=4 6707 B17R1.1304 C[C@@H](C(=O)NCCCCCCl)c1ccccc1 63e74615256b62c91ebe37e8c54a34e8 [0,1,0,0,0,1|2,0,0]=4 6708 B17R1.1304 C[C@@H](C(=O)NCCCCCO)c1ccccc1 0c25103a3955655b73e66645220b13a1 [0,1,0,0,0,1|2,0,0]=4 6709 B17R1.1304 C[C@H](C(=O)NCCCCCCl)c1ccccc1 0a6734e820912c9ee2051a94f09b7c7b [0,1,0,0,0,1|2,0,0]=4 6710 B17R1.1304 C[C@H](C(=O)NCCCCCO)c1ccccc1 469d7d4aa2761b013a0bb5fd42b329f9 [0,1,0,0,0,1|2,0,0]=4 6711 B17R1.1304 O=C(NCCCCCCl)C(=O)c1ccccc1 7c59c790c5aadd8c0b262f8730e6d87b [0,1,0,0,0,1|2,0,0]=4 6712 B17R1.1304 O=C(NCCCCCCl)C(F)c1ccccc1 365f7c955367f27721fa70348ae0769f [0,1,0,0,0,1|2,0,0]=4 6713 B17R1.1304 O=C(NCCCCCCl)C(O)c1ccccc1 292c71ebbaf920878bc79f33b74151bc [0,1,0,0,0,1|2,0,0]=4 6714 B17R1.1304 O=C(NCCCCCCl)[C@@H](O)c1ccccc1 382eb030d279373a530a3c564e56af74 [0,1,0,0,0,1|2,0,0]=4 6715 B17R1.1304 O=C(NCCCCCCl)[C@H](F)c1ccccc1 c30d17b6cffdfdf8aaecbe11e456ce23 [0,1,0,0,0,1|2,0,0]=4 6716 B17R1.1304 O=C(NCCCCCCl)[C@H](O)c1ccccc1 70f936fca45bd423a1d23d596795b167 [0,1,0,0,0,1|2,0,0]=4 6717 B17R1.1304 O=C(NCCCCCO)C(=O)c1ccccc1 77f7a3070f0073c308523a918bacde2c [0,1,0,0,0,1|2,0,0]=4 6718 B17R1.1304 O=C(NCCCCCO)C(F)c1ccccc1 3697074c0175c4eabb1c5df8305801a0 [0,1,0,0,0,1|2,0,0]=4 6719 B17R1.1304 O=C(NCCCCCO)C(O)c1ccccc1 edbfa599941d481010dbfdd29f852168 [0,1,0,0,0,1|2,0,0]=4 6720 B17R1.1304 O=C(NCCCCCO)[C@@H](O)c1ccccc1 58a391206f4e62d9b0ff46cd83565412 [0,1,0,0,0,1|2,0,0]=4 6721 B17R1.1304 O=C(NCCCCCO)[C@H](F)c1ccccc1 36aed5bbee91a8b237cf7ede60cefcd5 [0,1,0,0,0,1|2,0,0]=4 6722 B17R1.1304 O=C(NCCCCCO)[C@H](O)c1ccccc1 dbb323adb13652fd2b61ad85bcbb89a2 [0,1,0,0,0,1|2,0,0]=4 6723 B17R1.1325 CC(=O)CCCCCC(=O)Nc1ccccc1 5502eacfa2f212d8d652426ae1e2d80d [0,1,0,0,0,1|1,0,1]=4 6724 B17R1.1325 CC(C)CCCCCC(=O)Nc1ccccc1 b4c87695a1c283ea32618f663502ca58 [0,1,0,0,0,1|1,0,0]=3 6725 B17R1.1325 CC(C)CCCCCC(=O)Nc1ccccn1 a0020e69d6915bbeb8ba1be7c8732e9c [0,1,0,0,0,1|2,0,0]=4 6726 B17R1.1325 CC(C)CCCCCC(=O)Nc1cccnc1 e250f6a7720222c8803d0d7abfb47deb [0,1,0,0,0,1|2,0,0]=4 6727 B17R1.1325 CC(C)CCCCCC(=O)Nc1ccncc1 2120fa36241fbaab9dae5fc4a72b1e25 [0,1,0,0,0,1|2,0,0]=4 6728 B17R1.1325 CC(C)CCCCOC(C)Cc1ccccc1 da0aff70825a1c008dbba44c20c28c93 [0,1,0,0,0,1|1,0,1]=4 6729 B17R1.1325 CC(C)CCCCO[C@@H](C)Cc1ccccc1 ae74fafdca1ed904b635256d2ea7bb0e [0,1,0,0,0,1|1,0,1]=4 6730 B17R1.1325 CC(C)CCCCO[C@H](C)Cc1ccccc1 ec0f28b80c397dc1c20e0806c1fcc6c2 [0,1,0,0,0,1|1,0,1]=4 6731 B17R1.1325 CC(C)CCCNCC(=O)Cc1ccccc1 30a405f43fa71de3ae39e0693b45762e [0,1,0,0,0,1|2,0,0]=4 6732 B17R1.1325 CC(C)CCCNCC(=O)Nc1ccccc1 62cce1ba2bbece30606f2e312ae54853 [0,1,0,0,0,1|2,0,0]=4 6733 B17R1.1325 CC(C)CCCNCC(=O)Oc1ccccc1 9379a927dc9078b2530fc8f9f9afe1e5 [0,1,0,0,0,1|2,0,0]=4 6734 B17R1.1325 CC(C)CCCOCC(=O)Cc1ccccc1 1081060fad9be4298d76fd5c48788e07 [0,1,0,0,0,1|2,0,0]=4 6735 B17R1.1325 CC(C)CCCOCC(=O)Nc1ccccc1 563908bd253983ea286dbcbe0dab67a4 [0,1,0,0,0,1|2,0,0]=4 6736 B17R1.1325 CC(C)CCCOCC(=O)Oc1ccccc1 2d62bab68bbfa2e804f2ccba445648e5 [0,1,0,0,0,1|2,0,0]=4 6737 B17R1.1325 CC(C)CCNCCC(=O)Nc1ccccc1 786f970031639bf9b8a0f78519d29991 [0,1,0,0,0,1|2,0,0]=4 6738 B17R1.1325 CC(C)CCOCCC(=O)Oc1ccccc1 34199fe33c04aee827ccafb2a93fede4 [0,1,0,0,0,1|2,0,0]=4 6739 B17R1.1325 CC(C)CCOCNC(=O)Cc1ccccc1 4b7a973c3222d619ad98c543cb4c906b [0,1,0,0,0,1|2,0,0]=4 6740 B17R1.1325 CC(C)CNCCCC(=O)Nc1ccccc1 ac84b5d4ea32f454406e97b1a1ced97a [0,1,0,0,0,1|2,0,0]=4 6741 B17R1.1325 CC(C)CNCCNC(=O)Cc1ccccc1 259bb4d802a6f51a4e46e20a69c101e0 [0,1,0,0,0,1|2,0,0]=4 6742 B17R1.1325 CC(C)COCCCC(=O)Nc1ccccc1 92b6a7be67bec0635b84cb36010b63d1 [0,1,0,0,0,1|2,0,0]=4 6743 B17R1.1325 CC(C)COCCNC(=O)Cc1ccccc1 6ea74d1ffeb630549a4086c314727b39 [0,1,0,0,0,1|2,0,0]=4 6744 B17R1.1325 CC(F)COCCCC(=O)Nc1ccccc1 610a4388fc835ce2e64b48964f67eade [0,1,0,0,0,1|2,0,0]=4 6745 B17R1.1325 CC(F)COCCNC(=O)Cc1ccccc1 fbb4a90bfde9f271bc651dbcea5e65aa [0,1,0,0,0,1|2,0,0]=4 6746 B17R1.1325 CC(O)CCCCCC(=O)Nc1ccccc1 0ee77a86345d46d97e600e9ab92eb39a [0,1,0,0,0,1|1,0,0]=3 6747 B17R1.1325 CC(O)CCCCCC(=O)Nc1ccccn1 ce41b8ef21e6cbfa1c72c5ab03444d14 [0,1,0,0,0,1|2,0,0]=4 6748 B17R1.1325 CC(O)CCCCCC(=O)Nc1cccnc1 916ad711dfdd434ef2dde234cea6fa0b [0,1,0,0,0,1|2,0,0]=4 6749 B17R1.1325 CC(O)CCCCCC(=O)Nc1ccncc1 3c8f348ff29f666efdabb710b0900fac [0,1,0,0,0,1|2,0,0]=4 6750 B17R1.1325 CC(O)CCNCCC(=O)Nc1ccccc1 4363a7dcb100298393ee5ac469f5db1b [0,1,0,0,0,1|2,0,0]=4 6751 B17R1.1325 CC(O)CCNCCC(=O)Oc1ccccc1 dea308b2ead0881bcfb1d79c2568e320 [0,1,0,0,0,1|2,0,0]=4 6752 B17R1.1325 CC(O)CNCCCC(=O)Nc1ccccc1 e86ae9da5274bead3dbb7473115f3349 [0,1,0,0,0,1|2,0,0]=4 6753 B17R1.1325 CC(O)CNCCNC(=O)Cc1ccccc1 f8a20d918179c5ca33cd9b3c377eaaf9 [0,1,0,0,0,1|2,0,0]=4 6754 B17R1.1325 CC(S)COCCCC(=O)Nc1ccccc1 547d83858da930de3e6f0db5982b5e61 [0,1,0,0,0,1|2,0,0]=4 6755 B17R1.1325 CC(S)COCCNC(=O)Cc1ccccc1 d9342388a0ad8a1ba4eac64906f7eb0a [0,1,0,0,0,1|2,0,0]=4 6756 B17R1.1325 CN(C)CCCCCC(=O)Nc1ccccc1 9869f637d759df852899f52596f6877d [0,1,0,0,0,1|2,0,0]=4 6757 B17R1.1325 C[C@@H](F)COCCCC(=O)Nc1ccccc1 7e0fbbde535999132dfbac8748765211 [0,1,0,0,0,1|2,0,0]=4 6758 B17R1.1325 C[C@@H](F)COCCNC(=O)Cc1ccccc1 65bb0461700248d68f402162072a1780 [0,1,0,0,0,1|2,0,0]=4 6759 B17R1.1325 C[C@@H](O)CCNCCC(=O)Nc1ccccc1 33bd7658179ae12d46aa0307aa17616a [0,1,0,0,0,1|2,0,0]=4 6760 B17R1.1325 C[C@@H](O)CCNCCC(=O)Oc1ccccc1 21050efaba5e6baf7213c3f3ece59acb [0,1,0,0,0,1|2,0,0]=4 6761 B17R1.1325 C[C@@H](O)CNCCCC(=O)Nc1ccccc1 9652af5fdae427c5c8f722423895f778 [0,1,0,0,0,1|2,0,0]=4 6762 B17R1.1325 C[C@@H](O)CNCCNC(=O)Cc1ccccc1 afebd7d40e4d28e691e9bd3d0392eacf [0,1,0,0,0,1|2,0,0]=4 6763 B17R1.1325 C[C@H](F)COCCCC(=O)Nc1ccccc1 848287e136928fc23a28d2aa5525e26a [0,1,0,0,0,1|2,0,0]=4 6764 B17R1.1325 C[C@H](F)COCCNC(=O)Cc1ccccc1 ac4265b59f87d241c713fe9075d71a0d [0,1,0,0,0,1|2,0,0]=4 6765 B17R1.1325 C[C@H](O)CCNCCC(=O)Nc1ccccc1 09b83818a48edbec823730124eece549 [0,1,0,0,0,1|2,0,0]=4 6766 B17R1.1325 C[C@H](O)CCNCCC(=O)Oc1ccccc1 564fc02674207bfe736681c9d18c07d1 [0,1,0,0,0,1|2,0,0]=4 6767 B17R1.1325 C[C@H](O)CNCCCC(=O)Nc1ccccc1 3a1cfe32fbce21f848e723265704f6dc [0,1,0,0,0,1|2,0,0]=4 6768 B17R1.1325 C[C@H](O)CNCCNC(=O)Cc1ccccc1 d8e47ea5eb9dc5b568e8e94ccd266013 [0,1,0,0,0,1|2,0,0]=4 6769 B17R1.1325 O=C(CCCCCC(F)F)Nc1ccccc1 d5ff8592f33f4db10d307b973875fac7 [0,1,0,0,0,1|2,0,0]=4 6770 B17R1.1448 CCCCCCC(=O)C(=O)Nc1ccccn1 e188aafe01e91453263e9d9b41b06795 [0,1,0,0,0,1|2,0,0]=4 6771 B17R1.1448 CCCCCCC(=O)C(=O)Nc1cccnc1 de514dd7012493d7cae91887d895e6f7 [0,1,0,0,0,1|2,0,0]=4 6772 B17R1.1448 CCCCCCC(=O)C(=O)Nc1ccncc1 8cf0fe96328647626e8333fedf835d9e [0,1,0,0,0,1|2,0,0]=4 6773 B17R1.1448 CCCCCCC(O)C(=O)Nc1ccccn1 31fb70495747f3d4c8b81c46d9442094 [0,1,0,0,0,1|2,0,0]=4 6774 B17R1.1448 CCCCCCC(O)C(=O)Nc1cccnc1 371c5b28f947e0ea8bdbd8c8844ce3f2 [0,1,0,0,0,1|2,0,0]=4 6775 B17R1.1448 CCCCCCC(O)C(=O)Nc1ccncc1 e133edd88ae5c444bbc38553a081b637 [0,1,0,0,0,1|2,0,0]=4 6776 B17R1.1448 CCCCCCN(C)C(=O)Cc1ccccn1 6313da8072c948e44da210abe5c80b95 [0,1,0,0,0,1|2,0,0]=4 6777 B17R1.1448 CCCCCCN(C)C(=O)Cc1cccnc1 9675dc88bae7ea9a3b0208e93802dbe5 [0,1,0,0,0,1|2,0,0]=4 6778 B17R1.1448 CCCCCCN(C)C(=O)Cc1ccncc1 188f2060817d95c280a6ce94b792236b [0,1,0,0,0,1|2,0,0]=4 6779 B17R1.1448 CCCCCCN(C)C(=O)Nc1ccccc1 493cf37adfa9d7ac62752e9f25ee6d4b [0,1,0,0,0,1|1,0,0]=3 6780 B17R1.1448 CCCCCCN(C)C(=O)Nc1ccccn1 2e806c19336c35ce16100e7f92e38d6c [0,1,0,0,0,1|2,0,0]=4 6781 B17R1.1448 CCCCCCN(C)C(=O)Nc1cccnc1 a94c4e484ea695cf63c8623188baa657 [0,1,0,0,0,1|2,0,0]=4 6782 B17R1.1448 CCCCCCN(C)C(=O)Nc1ccncc1 74a7f8561f785f6cf93559d1e8bd16a8 [0,1,0,0,0,1|2,0,0]=4 6783 B17R1.1448 CCCCCCN(C)C(=S)Nc1ccccc1 715bb28a4c704648fa2d32647656102d [0,1,0,0,0,1|1,1,0]=4 6784 B17R1.1448 CCCCCNC(=O)C(=O)Cc1ccccc1 df5bba2d788fb513a35ac385d5c2c152 [0,1,0,0,0,1|2,0,0]=4 6785 B17R1.1448 CCCCCNC(=O)C(=O)Nc1ccccc1 86a51336c081c8147267460a779f7ce3 [0,1,0,0,0,1|2,0,0]=4 6786 B17R1.1448 CN(CCCCCO)C(=O)Nc1ccccc1 c99f937a2ac529dfebc84376f1930b96 [0,1,0,0,0,1|2,0,0]=4 6787 B17R1.1448 CNCCCCN(C)C(=O)Nc1ccccc1 5a6c19826455221b8fb123c401b0a2a9 [0,1,0,0,0,1|2,0,0]=4 6788 B17R1.1448 COCCCCN(C)C(=O)Nc1ccccc1 40c681eef68b871a04be46859977057a [0,1,0,0,0,1|2,0,0]=4 6789 B17R1.1561 CCCCC(C)CCC(=O)Nc1ccccn1 1e76806e77fd84febd175cbd49158c46 [0,1,0,0,0,1|2,0,0]=4 6790 B17R1.1561 CCCCC(C)CCC(=O)Nc1cccnc1 68027c57692d55bb19aa5344e4a6dc2d [0,1,0,0,0,1|2,0,0]=4 6791 B17R1.1561 CCCCC(C)NCC(=O)Cc1ccccc1 535c5f0c54c383bda7f771d5416ac4a0 [0,1,0,0,0,1|2,0,0]=4 6792 B17R1.1561 CCCCC(C)NCC(=O)Nc1ccccc1 6a798967d92ed17150496e58bdf820cd [0,1,0,0,0,1|2,0,0]=4 6793 B17R1.1561 CCCCC(C)NCC(=O)Oc1ccccc1 c23334eb6b6293f58a459ffe149f37d4 [0,1,0,0,0,1|2,0,0]=4 6794 B17R1.1561 CCCCC(C)OCC(=O)Cc1ccccc1 92390cef94253ff9a9a8b7f8caa9764b [0,1,0,0,0,1|2,0,0]=4 6795 B17R1.1561 CCCCC(C)OCC(=O)Nc1ccccc1 06e2422369687864e568d70401264c6b [0,1,0,0,0,1|2,0,0]=4 6796 B17R1.1561 CCCCC(C)OCC(=O)Oc1ccccc1 9610d0ddec814ac2d1d6b61532e0978b [0,1,0,0,0,1|2,0,0]=4 6797 B17R1.1561 CCCCC(O)CNC(=O)Cc1ccccn1 44ba1c5c33efa6e6b5fdde737e289d45 [0,1,0,0,0,1|2,0,0]=4 6798 B17R1.1561 CCCCC(O)CNC(=O)Cc1cccnc1 d550e47451b8a8ccef8eff579bc084ca [0,1,0,0,0,1|2,0,0]=4 6799 B17R1.1561 CCCCC(O)CNC(=O)Cc1ccncc1 6df409bb5d4f9aede92f095ae12c92a3 [0,1,0,0,0,1|2,0,0]=4 6800 B17R1.1561 CCCCC(O)CNC(=O)Nc1ccccc1 4258606c16c6f474d759e925f001d9e8 [0,1,0,0,0,1|1,0,0]=3 6801 B17R1.1561 CCCCC(O)CNC(=O)Nc1ccccn1 e2c7fecefdbf7da10ce4e8103bae9ed4 [0,1,0,0,0,1|2,0,0]=4 6802 B17R1.1561 CCCCC(O)CNC(=O)Nc1cccnc1 ab68894b9eccdc7406d9f3e5a03ee45a [0,1,0,0,0,1|2,0,0]=4 6803 B17R1.1561 CCCCC(O)CNC(=O)Nc1ccncc1 8e57254bd7b99028025d00bb4fdb2580 [0,1,0,0,0,1|2,0,0]=4 6804 B17R1.1561 CCCCC(O)CNC(=S)Nc1ccccc1 1863103644aec7c8ab62152e56e12da3 [0,1,0,0,0,1|1,1,0]=4 6805 B17R1.1561 CCCC[C@@H](C)NCC(=O)Cc1ccccc1 e704efcb363d2b24a7d2666a49ad5c1a [0,1,0,0,0,1|2,0,0]=4 6806 B17R1.1561 CCCC[C@@H](C)NCC(=O)Nc1ccccc1 ed4d7b0f196d2034a6fbeccfb9a53b41 [0,1,0,0,0,1|2,0,0]=4 6807 B17R1.1561 CCCC[C@@H](C)NCC(=O)Oc1ccccc1 2ef6fb0d725fd74bed6705079e6a29cd [0,1,0,0,0,1|2,0,0]=4 6808 B17R1.1561 CCCC[C@@H](C)OCC(=O)Cc1ccccc1 577bf93e74027c7e29211cb481d98dfe [0,1,0,0,0,1|2,0,0]=4 6809 B17R1.1561 CCCC[C@@H](C)OCC(=O)Nc1ccccc1 9dd7601dd9f78ed602101396974323de [0,1,0,0,0,1|2,0,0]=4 6810 B17R1.1561 CCCC[C@@H](C)OCC(=O)Oc1ccccc1 25642215a2e2c679b52d0e29d24d5598 [0,1,0,0,0,1|2,0,0]=4 6811 B17R1.1561 CCCC[C@H](C)OCC(=O)Cc1ccccc1 e0a4de3e694be966a2def4ee65ae3550 [0,1,0,0,0,1|2,0,0]=4 6812 B17R1.1561 CCCC[C@H](C)OCC(=O)Nc1ccccc1 23aaf4c2461dc6a6a1285c8d982a12f0 [0,1,0,0,0,1|2,0,0]=4 6813 B17R1.1561 CCCC[C@H](C)OCC(=O)Oc1ccccc1 a3de6a2ee1ffc775d59221adfc845f1a [0,1,0,0,0,1|2,0,0]=4 6814 B17R1.1561 CCOCC(O)CNC(=O)Nc1ccccc1 56ec43d2302a41d47b0cb86721ef578b [0,1,0,0,0,1|2,0,0]=4 6815 B17R1.1650 CCCC(=O)CCCC(=O)Nc1ccccc1 8269627a480d5b1c99251639832bcc19 [0,1,0,0,0,1|1,0,1]=4 6816 B17R1.1650 CCCC(C)CNCC(=O)Nc1ccccc1 6542fde7851192569d11a7ed77044d39 [0,1,0,0,0,1|2,0,0]=4 6817 B17R1.1650 CCCC(C)COCC(=O)Cc1ccccc1 ac57ae8104e8daff6a9ce791f312715b [0,1,0,0,0,1|2,0,0]=4 6818 B17R1.1650 CCCC(C)COCC(=O)Nc1ccccc1 f5ee042cc4093e595189d1a9f2211d8b [0,1,0,0,0,1|2,0,0]=4 6819 B17R1.1650 CCCC(C)COCC(=O)Oc1ccccc1 81c2281402414a9cb0132ebf0a4c2885 [0,1,0,0,0,1|2,0,0]=4 6820 B17R1.1650 CCCC(C)NCCC(=O)Nc1ccccc1 50be512e675c94bcc0eecebdcfa59461 [0,1,0,0,0,1|2,0,0]=4 6821 B17R1.1650 CCCC(C)OCNC(=O)Cc1ccccc1 0dfe31d539706f46a6d97bf8f2296cce [0,1,0,0,0,1|2,0,0]=4 6822 B17R1.1650 CCCC(O)CNCC(=O)Cc1ccccc1 d25cc1e8763af436281b66e4dd05cc35 [0,1,0,0,0,1|2,0,0]=4 6823 B17R1.1650 CCCC(O)CNCC(=O)Nc1ccccc1 7f7f3a61eb1adecd5136ab7addadd4ed [0,1,0,0,0,1|2,0,0]=4 6824 B17R1.1650 CCCC(O)CNCC(=O)Oc1ccccc1 94d0f6f6f43ae7fe12cf57383f0919ea [0,1,0,0,0,1|2,0,0]=4 6825 B17R1.1650 CCCN(C)CCCC(=O)Nc1ccccc1 c4e91651e673c83dadf1e82f14742f31 [0,1,0,0,0,1|2,0,0]=4 6826 B17R1.1650 CCCN(C)CCNC(=O)Cc1ccccc1 edef366eb01bcf43e59652ffbdf7758e [0,1,0,0,0,1|2,0,0]=4 6827 B17R1.1889 CCCCCC(C)NC(=O)Cc1ccccn1 3d158f30c8105f7a4bdfdbbf4c6a54fb [0,1,0,0,0,1|2,0,0]=4 6828 B17R1.1889 CCCCCC(C)NC(=O)Cc1cccnc1 3a9937e739fca04ee40ea7d2ec0fba29 [0,1,0,0,0,1|2,0,0]=4 6829 B17R1.1889 CCCCCC(C)NC(=O)Cc1ccncc1 804394ca2afdd51eff19f9be4c94d47d [0,1,0,0,0,1|2,0,0]=4 6830 B17R1.1889 CCCCCC(C)NC(=S)Nc1ccccc1 1cc2a4282603d89e623e7948d78f9f7c [0,1,0,0,0,1|1,1,0]=4 6831 B17R1.1889 CCCCCC(C)OC(C)Cc1ccccc1 7b0a3abb1999d583177fc540c012e27b [0,1,0,0,0,1|1,0,1]=4 6832 B17R1.1889 CCCCCC(O)CC(=O)Nc1ccccn1 48a37be214235b0c6db3ea101b20638a [0,1,0,0,0,1|2,0,0]=4 6833 B17R1.1889 CCCCCC(O)CC(=O)Nc1cccnc1 bde002dd7a7e2cf468e8a70ce4003444 [0,1,0,0,0,1|2,0,0]=4 6834 B17R1.1889 CCCCCC(O)CC(=O)Nc1ccncc1 76fe345279b21c343be70144bf42a01b [0,1,0,0,0,1|2,0,0]=4 6835 B17R1.1889 CCCCCN(C)CC(=O)Cc1ccccc1 16ec923dcd349ecb8505586562464c85 [0,1,0,0,0,1|2,0,0]=4 6836 B17R1.1889 CCCCCN(C)CC(=O)Nc1ccccc1 029c3755b727b3795b98b2201d73d0b5 [0,1,0,0,0,1|2,0,0]=4 6837 B17R1.1889 CCCCC[C@@H](C)OC(C)Cc1ccccc1 f5a0c7c7c7b116363f756568d48d3ea1 [0,1,0,0,0,1|1,0,1]=4 6838 B17R1.1889 CCCCC[C@@H](O)CC(=O)Nc1ccccn1 4a71a0ad9970126ced9013ec3537616b [0,1,0,0,0,1|2,0,0]=4 6839 B17R1.1889 CCCCC[C@@H](O)CC(=O)Nc1cccnc1 3f5b89ae636dbb6400c70dcff94c6214 [0,1,0,0,0,1|2,0,0]=4 6840 B17R1.1889 CCCCC[C@@H](O)CC(=O)Nc1ccncc1 34a31f92e4cca48a728388c90690d6d6 [0,1,0,0,0,1|2,0,0]=4 6841 B17R1.1889 CCCCC[C@H](C)NC(=O)Cc1ccccn1 6204eb5ac3bb736672a8b65cbd3affdf [0,1,0,0,0,1|2,0,0]=4 6842 B17R1.1889 CCCCC[C@H](C)NC(=O)Cc1cccnc1 331818b97bafdf8776a96f48562c1eda [0,1,0,0,0,1|2,0,0]=4 6843 B17R1.1889 CCCCC[C@H](C)NC(=O)Cc1ccncc1 1d20fb1b76989f596f2109c9d9b00c9b [0,1,0,0,0,1|2,0,0]=4 6844 B17R1.1889 CCCCC[C@H](C)NC(=S)Nc1ccccc1 9db91d2f107937a79da70407ff5c66e5 [0,1,0,0,0,1|1,1,0]=4 6845 B17R1.1889 CCCCC[C@H](C)OC(C)Cc1ccccc1 be1a535b30d87c66f136b2141db9763f [0,1,0,0,0,1|1,0,1]=4 6846 B17R1.1889 CCCCC[C@H](C)O[C@@H](C)Cc1ccccc1 0870e07fee8a58a0ad69b7d6391bc248 [0,1,0,0,0,1|1,0,1]=4 6847 B17R1.1889 CCCCC[C@H](C)O[C@H](C)Cc1ccccc1 9708cb95907fb739e2e9e60221718a6c [0,1,0,0,0,1|1,0,1]=4 6848 B17R1.1889 CCCCC[C@H](O)CC(=O)Nc1ccccn1 807571864bfa61be5edb0fad9b8c93a4 [0,1,0,0,0,1|2,0,0]=4 6849 B17R1.1889 CCCCC[C@H](O)CC(=O)Nc1cccnc1 6eb46a58a9c7e770eac9008047ecc6ba [0,1,0,0,0,1|2,0,0]=4 6850 B17R1.1889 CCCCC[C@H](O)CC(=O)Nc1ccncc1 b267ea7ee1f602dcfb33285666871ba4 [0,1,0,0,0,1|2,0,0]=4 6851 B17R1.1889 CCCCNC(C)CC(=O)Nc1ccccc1 622b240fd8c17d0f6086b994ba5b3534 [0,1,0,0,0,1|2,0,0]=4 6852 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1Br 93b22d25bb6cb79bb5e7cf6795909612 [0,1,0,0,0,1|1,0,1]=4 6853 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1C 812e6ffe869cd1c2491b84b1cd5f6360 [0,1,0,0,0,1|1,0,1]=4 6854 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1Cl 3b638dc143549f2a4a20e5a774681be0 [0,1,0,0,0,1|1,0,1]=4 6855 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1F 62222fa5c40fb30bf80bf8597f7c8b14 [0,1,0,0,0,1|1,0,1]=4 6856 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1I f432073bd745b83f95300de986625506 [0,1,0,0,0,1|1,0,1]=4 6857 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1O 5c4e48904036a734a7a9cc551f199a0c [0,1,0,0,0,1|1,0,1]=4 6858 B17R1.9274 CCCCC/C=C/C(=O)Nc1ccccc1S 2f4c6b2248735998e9a4a676d6e56c7f [0,1,0,0,0,1|1,0,1]=4 6859 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1Br 3d69742b2e6cf1f907b7157016967759 [0,1,0,0,0,1|1,0,1]=4 6860 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1C 8c4289757d3f628c64025d9069569b82 [0,1,0,0,0,1|1,0,1]=4 6861 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1Cl 709341f8c2c42259efc4c2ac0d2a117d [0,1,0,0,0,1|1,0,1]=4 6862 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1F a518b705e8e4fad371d01cf395ca8546 [0,1,0,0,0,1|1,0,1]=4 6863 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1I c47c1ef95a9510ad3efc34e6669ccf91 [0,1,0,0,0,1|1,0,1]=4 6864 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1O 47c56797452391a8daee8e5bd674cfb0 [0,1,0,0,0,1|1,0,1]=4 6865 B17R1.9274 CCCCCC#CC(=O)Nc1ccccc1S 38ff0566965d043004eb12ec582c4197 [0,1,0,0,0,1|1,0,1]=4 6866 B17R1.9274 CCCCCCCC(=O)Nc1cccc[n+]1[O-] d1a87464d9f32e72b701aeda1afd17b4 [0,1,0,0,0,1|2,0,0]=4 6867 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1Br 3ce6e9c4a2663dedbf5ac74b39e8f1f4 [0,1,0,0,0,1|1,0,0]=3 6868 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1C d8591e41a367520d5f969f23b14092ef [0,1,0,0,0,1|1,0,0]=3 6869 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1Cl 077b4ddb2eb727aa98e3497bdd12969b [0,1,0,0,0,1|1,0,0]=3 6870 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1F 8d438208c8846ff32e35d869c1c3ca05 [0,1,0,0,0,1|1,0,0]=3 6871 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1I 3ec737d9fdbd9368e500343e2da1d081 [0,1,0,0,0,1|1,0,0]=3 6872 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1O 5e6d2c7a322734c878d56fff0f9a5449 [0,1,0,0,0,1|1,0,0]=3 6873 B17R1.9274 CCCCCCCC(=O)Nc1ccccc1S ac6c1d96ecc9fc2e765875bb751214b3 [0,1,0,0,0,1|1,0,0]=3 6874 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1Br fa78bfd637fc2330c64367eceaaa2e60 [0,1,0,0,0,1|2,0,0]=4 6875 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1C 1b2cc083a6508f7d5f9d972f463614a9 [0,1,0,0,0,1|2,0,0]=4 6876 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1Cl ffe8febb2ef849d6a5ce2c2460411c99 [0,1,0,0,0,1|2,0,0]=4 6877 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1F e6feed15a223a09ce20c14803cc59cf8 [0,1,0,0,0,1|2,0,0]=4 6878 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1I d811d3188b33ba62166998c8f1b2216d [0,1,0,0,0,1|2,0,0]=4 6879 B17R1.9274 CCCCCCCC(=O)Nc1cccnc1O dfdfbc925d61e1d4e548ec2520259ef6 [0,1,0,0,0,1|2,0,0]=4 6880 B17R1.9274 CCCCCCCC(=O)Nc1ccncc1C cd14a41301ad262de69a5160afde61ea [0,1,0,0,0,1|2,0,0]=4 6881 B17R1.9274 CCCCCCCC(=O)Nc1ccncc1Cl cbdbc6f236bf9aaba35fa288c4d3122b [0,1,0,0,0,1|2,0,0]=4 6882 B17R1.9274 CCCCCCCC(=O)Nc1ccncc1F 130146cb159dfb1b6770d209ad5eef63 [0,1,0,0,0,1|2,0,0]=4 6883 B17R1.9274 CCCCCCCC(=O)Nc1ccncc1I c4c767efa5891b6ea88e8f518a0eb6af [0,1,0,0,0,1|2,0,0]=4 6884 B17R1.9274 CCCCCCCC(=O)Nc1cnccc1Br de97448cc5048316774d832bcedc368f [0,1,0,0,0,1|2,0,0]=4 6885 B17R1.9274 CCCCCCCC(=O)Nc1cnccc1C f78b86524f4c5793f23978be8cf94a46 [0,1,0,0,0,1|2,0,0]=4 6886 B17R1.9274 CCCCCCCC(=O)Nc1cnccc1F 72a043a678809d4ae805083d19a7eabb [0,1,0,0,0,1|2,0,0]=4 6887 B17R1.9274 CCCCCCCC(=O)Nc1cnccc1I be9a523f3957d987411768e86539e642 [0,1,0,0,0,1|2,0,0]=4 6888 B17R1.9274 CCCCCCCC(=O)Nc1cnccc1O b9ccc8684637536143b214b4410c0572 [0,1,0,0,0,1|2,0,0]=4 6889 B17R1.9274 CCCCCCCC(=O)Nc1cnccc1S e36d05a65b4cc9b449b051a9bc33f0fe [0,1,0,0,0,1|2,0,0]=4 6890 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1Br 4c2598fcf41971c26d3b8740b898e62d [0,1,0,0,0,1|2,0,0]=4 6891 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1C 380db432cbaba8e6fb7d30fe214fa245 [0,1,0,0,0,1|2,0,0]=4 6892 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1Cl ac0f74f7dea4127e45b7dd3ae136aad9 [0,1,0,0,0,1|2,0,0]=4 6893 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1F 53d34873b7a7229848ced8c8eeec44bb [0,1,0,0,0,1|2,0,0]=4 6894 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1I d42b4b18d28b3872e6f504b2677d7381 [0,1,0,0,0,1|2,0,0]=4 6895 B17R1.9274 CCCCCCCC(=O)Nc1ncccc1O fceb46a0ebbe008975b79846988489b2 [0,1,0,0,0,1|2,0,0]=4 6896 B17R1.9274 CCCCCCNC(=O)Cc1ccccc1Br 9807d3d3a8f61be5a23f4930c415e852 [0,1,0,0,0,1|1,0,0]=3 6897 B17R1.9274 CCCCCCNC(=O)Cc1ccccc1C 378c5c8954d8fceb6d8648390491e5ac [0,1,0,0,0,1|1,0,0]=3 6898 B17R1.9274 CCCCCCNC(=O)Cc1ccccc1Cl 355e0b594f443b87d810c0343add1bc0 [0,1,0,0,0,1|1,0,0]=3 6899 B17R1.9274 CCCCCCNC(=O)Cc1ccccc1F 2bccb8289f0fdc1c5bc2176c398bbb4b [0,1,0,0,0,1|1,0,0]=3 6900 B17R1.9274 CCCCCCNC(=O)Cc1ccccc1I a10b8bebb8b7227a2910d7ef8eb7e9c9 [0,1,0,0,0,1|1,0,0]=3 6901 B17R1.9274 CCCCCCNC(=O)Cc1ccccc1O b201bab869176a782b82b8eda99c32d1 [0,1,0,0,0,1|1,0,0]=3 6902 B17R1.9274 CCCCCCNC(=O)Cc1cccnc1Br 2be57abb00f07e319eb750fb60daf253 [0,1,0,0,0,1|2,0,0]=4 6903 B17R1.9274 CCCCCCNC(=O)Cc1cccnc1Cl e3b7c8d72fad66f9ad3469524a94599f [0,1,0,0,0,1|2,0,0]=4 6904 B17R1.9274 CCCCCCNC(=O)Cc1ccncc1Cl 5ab633a28dd4ccf16f855f08dd97e8d5 [0,1,0,0,0,1|2,0,0]=4 6905 B17R1.9274 CCCCCCNC(=O)Cc1ncccc1Br 4c76c2bb271f323050304a62eda4d4f9 [0,1,0,0,0,1|2,0,0]=4 6906 B17R1.9274 CCCCCCNC(=O)Cc1ncccc1Cl b741d0eac4db0cb9899cda23f1242a92 [0,1,0,0,0,1|2,0,0]=4 6907 B17R1.9274 CCCCCCNC(=O)Cc1ncccc1F 3bd78cce86829aae2752c9642c1e05e0 [0,1,0,0,0,1|2,0,0]=4 6908 B17R1.9274 CCCCCCNC(=O)Cc1ncccc1O 61c519bf48a6a7216d935ff54206d479 [0,1,0,0,0,1|2,0,0]=4 6909 B17R1.9274 CCCCCCNC(=O)Cn1ccccc1=O 847010b52f87efdeb85996b7dd686792 [0,1,0,0,0,1|2,0,0]=4 6910 B17R1.9274 CCCCCCNC(=O)Nc1cccc[n+]1[O-] 8940cde9f61b601af40d0b8efe9468da [0,1,0,0,0,1|2,0,0]=4 6911 B17R1.9274 CCCCCCNC(=O)Nc1ccccc1Cl 4556a21211cb6b3f11ec8b79f3d4d882 [0,1,0,0,0,1|1,0,0]=3 6912 B17R1.9274 CCCCCCNC(=O)Nc1ccccc1I 86ae48b7290aa3b1994268da6af21bfd [0,1,0,0,0,1|1,0,0]=3 6913 B17R1.9274 CCCCCCNC(=O)Nc1ccncc1Br 8f29a5239ceedb3955f24cd233dd804f [0,1,0,0,0,1|2,0,0]=4 6914 B17R1.9274 CCCCCCNC(=O)Nc1ccncc1Cl 3342cd3a04509b327766dcec1fe9b540 [0,1,0,0,0,1|2,0,0]=4 6915 B17R1.9274 CCCCCCNC(=O)Nc1ncccc1F 583cc901265493407701bb944e8839c0 [0,1,0,0,0,1|2,0,0]=4 6916 B17R1.9274 CCCCCCNC(=O)Nc1ncccc1I 8e3fba319e88adda12a503ad9701c67f [0,1,0,0,0,1|2,0,0]=4 6917 B17R1.9274 CCCCCCNC(=O)Nc1ncccc1O 990d8e1841e1859fbd7b18171d94efe8 [0,1,0,0,0,1|2,0,0]=4 6918 B17R1.9274 CCCCCCNC(=S)Nc1ccccc1C 7f8e1c01d63557b0adc4c70b755d107a [0,1,0,0,0,1|1,1,0]=4 6919 B17R1.9274 CCCCCCNC(=S)Nc1ccccc1Cl be0f1976e0175390032b0daf0b64b8fa [0,1,0,0,0,1|1,1,0]=4 6920 B17R1.9274 CCCCCCNC(=S)Nc1ccccc1F bc7a4316a2e2db26dda2c80630d8fdba [0,1,0,0,0,1|1,1,0]=4 6921 B17R1.9274 CCCCCCNC(=S)Nc1ccccc1I c4faddf2452fd75d7d37c49d06edacff [0,1,0,0,0,1|1,1,0]=4 6922 B17R1.9274 CCCCCCNC(=S)Nc1ccccc1N 885459d5a3fc835e3192c6058f96b086 [0,1,0,0,0,1|1,1,0]=4 6923 B17R1.9274 CCCCCCNC(=S)Nc1ccccc1O 2bfdc68bf418e4dc6f8ddf23349d80d0 [0,1,0,0,0,1|1,1,0]=4 6924 B17R1.9274 CCCCCNCC(=O)Cc1ccccc1C 80170853fd8c718e45d71daece5b9906 [0,1,0,0,0,1|2,0,0]=4 6925 B17R1.9274 CCCCCNCC(=O)Nc1ccccc1Cl a0fa9438429468a36cf20c1ef9e58412 [0,1,0,0,0,1|2,0,0]=4 6926 B17R1.9274 CCCCCNCC(=O)Nc1ccccc1F 954a759d479a2909f986f8628afe314c [0,1,0,0,0,1|2,0,0]=4 6927 B17R1.9274 CCCCCNCC(=O)Nc1ccccc1I 2b89d3fa3c6b6b2ba2a958d888b515ec [0,1,0,0,0,1|2,0,0]=4 6928 B17R1.9274 CCCCCOCC(=O)Nc1ccccc1C 81fa1dd05692ad28d4466f3adbb11dac [0,1,0,0,0,1|2,0,0]=4 6929 B17R1.9274 CCCCCOCC(=O)Nc1ccccc1Cl ddf757e4faae80457c7bd401815cefb6 [0,1,0,0,0,1|2,0,0]=4 6930 B17R1.9274 CCCCCOCC(=O)Nc1ccccc1F 2ce8176db4d9dd796568c927fef4817a [0,1,0,0,0,1|2,0,0]=4 6931 B17R1.9274 CCCCCOCC(=O)Nc1ccccc1I e330abf1721feaac0ccc90516f77081d [0,1,0,0,0,1|2,0,0]=4 6932 B17R1.9274 CCCCNCCC(=O)Nc1ccccc1C 3852b48101c0d558db629bf542b83034 [0,1,0,0,0,1|2,0,0]=4 6933 B17R1.9274 CCCCNCCC(=O)Nc1ccccc1F 7b99e421a8b18182d795b2b893d55f41 [0,1,0,0,0,1|2,0,0]=4 6934 B17R1.9274 CCCCOCCC(=O)Nc1ccccc1F d79fe84e468f9bcf583d6546c422d3f9 [0,1,0,0,0,1|2,0,0]=4 6935 B17R1.9274 CCCCOCCC(=O)Nc1ccccc1I d6e3fba4902d1f263e1a337234b14e90 [0,1,0,0,0,1|2,0,0]=4 6936 B17R1.9274 CCCCOCCC(=O)Nc1ccccc1O 33ed3241fd17c5db65c016b197330a06 [0,1,0,0,0,1|2,0,0]=4 6937 B17R1.9274 CCCOCCNC(=O)Cc1ccccc1Br e4ad251faaf9662b6e8f2231f488c7fd [0,1,0,0,0,1|2,0,0]=4 6938 B17R1.9274 CCCOCCNC(=O)Cc1ccccc1C 45fe61ed5b2032c7e66a218fd4b344cf [0,1,0,0,0,1|2,0,0]=4 6939 B17R1.9274 CCCOCCNC(=O)Cc1ccccc1Cl 37c587fc8e0416809392770b9b4470e3 [0,1,0,0,0,1|2,0,0]=4 6940 B17R1.9274 CCCOCCNC(=O)Cc1ccccc1F 52fb0eac00c7a6ed68ed8f8b4f490186 [0,1,0,0,0,1|2,0,0]=4 6941 B17R1.9274 CCCOCCNC(=O)Cc1ccccc1I 95efa86c7092ea50aa957d6535ff1231 [0,1,0,0,0,1|2,0,0]=4 6942 B17R1.9274 CCCOCCNC(=O)Cc1ccccc1O f75ba27ebcd968075934d8d36e753238 [0,1,0,0,0,1|2,0,0]=4 6943 B17R1.9274 CCCOCCNC(=O)Nc1ccccc1Cl 8dd8b6d38d47b773a36bcf93f44e5bbe [0,1,0,0,0,1|2,0,0]=4 6944 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1Br 7c9ae25142aa219d0a094a9a214576e7 [0,1,0,0,0,1|2,0,0]=4 6945 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1C 318c10f195d13213a64a34f032474768 [0,1,0,0,0,1|2,0,0]=4 6946 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1Cl 9076761d2f0f9ba1b0e9988363eec9d7 [0,1,0,0,0,1|2,0,0]=4 6947 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1F 22782c70a238738c7582d88bf000dd46 [0,1,0,0,0,1|2,0,0]=4 6948 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1I 5d4ea80326e6043241fc63eccc020acf [0,1,0,0,0,1|2,0,0]=4 6949 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1O 05c6b4d0d0cbef50a64d9f6ef704fde9 [0,1,0,0,0,1|2,0,0]=4 6950 B17R1.9274 CCOCCCCC(=O)Nc1ccccc1S b831e699bf726c8ddb543e4f76579a23 [0,1,0,0,0,1|2,0,0]=4 6951 B17R1.9274 CCOCCCNC(=O)Cc1ccccc1Br 65f6c6f367368bbe731c14ffa938f55e [0,1,0,0,0,1|2,0,0]=4 6952 B17R1.9274 CCOCCCNC(=O)Cc1ccccc1C ca9bcdb092ce5b3d0788dc8349ca4159 [0,1,0,0,0,1|2,0,0]=4 6953 B17R1.9274 CCOCCCNC(=O)Cc1ccccc1Cl 55409aae173fbbae3e7ebb7343bae4f7 [0,1,0,0,0,1|2,0,0]=4 6954 B17R1.9274 CCOCCCNC(=O)Cc1ccccc1F 81c2062d610512d84bccaa7886a8f2e4 [0,1,0,0,0,1|2,0,0]=4 6955 B17R1.9274 CCOCCCNC(=O)Cc1ccccc1I 886f90af468094fd2dc851b682c552d6 [0,1,0,0,0,1|2,0,0]=4 6956 B17R1.9274 CCOCCCNC(=O)Cc1ccccc1O 80f40e4bac221aba1c917200acbc55dd [0,1,0,0,0,1|2,0,0]=4 6957 B17R1.9274 CCOCCCNC(=O)Nc1ccccc1Cl a0f96a98f05c4b08f95f8ef08c255067 [0,1,0,0,0,1|2,0,0]=4 6958 B17R1.9274 CCOCCCNC(=O)Nc1ccccc1O 9c042f8a3e3ec826acadc63ba18829bd [0,1,0,0,0,1|2,0,0]=4 6959 B17R1.9274 COCCCCCC(=O)Nc1ccccc1Br a96e4755bd6d3521bce6ac0ea77d50ee [0,1,0,0,0,1|2,0,0]=4 6960 B17R1.9274 COCCCCCC(=O)Nc1ccccc1C a78e86ddd1491d285ad10660c2790e16 [0,1,0,0,0,1|2,0,0]=4 6961 B17R1.9274 COCCCCCC(=O)Nc1ccccc1Cl 990ce4afdabeae923d8e22e6aec0e167 [0,1,0,0,0,1|2,0,0]=4 6962 B17R1.9274 COCCCCCC(=O)Nc1ccccc1F 7b22c463c1f7aa9b405e708b5946eb52 [0,1,0,0,0,1|2,0,0]=4 6963 B17R1.9274 COCCCCCC(=O)Nc1ccccc1I fae78949eff75bfe4171185da7265252 [0,1,0,0,0,1|2,0,0]=4 6964 B17R1.9274 COCCCCCC(=O)Nc1ccccc1O fa622d53c4798e26b9a64866299bd098 [0,1,0,0,0,1|2,0,0]=4 6965 B17R1.9274 COCCCCCC(=O)Nc1ccccc1S 3e84d1629fed14f39ec8d8b7d66e77d6 [0,1,0,0,0,1|2,0,0]=4 6966 B17R1.9274 COCCCCNC(=O)Cc1ccccc1Br fa6491d6fa4fc48d4926e7dad9fb236b [0,1,0,0,0,1|2,0,0]=4 6967 B17R1.9274 COCCCCNC(=O)Cc1ccccc1C 67c7f7cbb464dc764b03d5323b968881 [0,1,0,0,0,1|2,0,0]=4 6968 B17R1.9274 COCCCCNC(=O)Cc1ccccc1Cl 36180129d91fd22ae52ca7f2beee0045 [0,1,0,0,0,1|2,0,0]=4 6969 B17R1.9274 COCCCCNC(=O)Cc1ccccc1F 95e6aaabfeec4e3f9e8244ddc541a8ac [0,1,0,0,0,1|2,0,0]=4 6970 B17R1.9274 COCCCCNC(=O)Cc1ccccc1I cbc85acb3c293ea21e9576310da6cdfc [0,1,0,0,0,1|2,0,0]=4 6971 B17R1.9274 COCCCCNC(=O)Cc1ccccc1O 4831d3226ac0656913a724fef93444a8 [0,1,0,0,0,1|2,0,0]=4 6972 B17R1.9274 COCCCCNC(=O)Nc1ccccc1Cl a9918a367a50144f33db330d04e963ee [0,1,0,0,0,1|2,0,0]=4 6973 B17R1.9274 CSCCCCNC(=O)Cc1ccccc1Br 530fb0b2babc096b879da72ce7004349 [0,1,0,0,0,1|2,0,0]=4 6974 B17R1.9274 CSCCCCNC(=O)Cc1ccccc1C debd2509c57fd69a5a1c208fc6fbf145 [0,1,0,0,0,1|2,0,0]=4 6975 B17R1.9274 CSCCCCNC(=O)Cc1ccccc1Cl f4cb22a7093ca91084c9ab1dabbf5181 [0,1,0,0,0,1|2,0,0]=4 6976 B17R1.9274 CSCCCCNC(=O)Cc1ccccc1F 74388727a7fc432fae098bcc1add562b [0,1,0,0,0,1|2,0,0]=4 6977 B17R1.9274 CSCCCCNC(=O)Cc1ccccc1I 482fbc0522c208662ec9c5417f01cdcc [0,1,0,0,0,1|2,0,0]=4 6978 B17R1.9274 CSCCCCNC(=O)Cc1ccccc1O badbbdf3c56adbf6128e06c255b6ab03 [0,1,0,0,0,1|2,0,0]=4 6979 B17R1.9274 CSCCCCNC(=O)Nc1ccccc1Cl dc447726a45dd63d5041f3c01e49089a [0,1,0,0,0,1|2,0,0]=4 6980 B17R1.9274 Cc1ccccc1CC(=O)NCCCCCCl 39c39e93d0130ac1d6ee0c231e7850e1 [0,1,0,0,0,1|2,0,0]=4 6981 B17R1.9274 Cc1ccccc1CC(=O)NCCCCCO dfae9d335b30bffe3ed016ecf7ec3231 [0,1,0,0,0,1|2,0,0]=4 6982 B17R1.9274 Cc1ccccc1NC(=O)CCCCCCF c50632e5ac48d6886f6bbd067bcab36b [0,1,0,0,0,1|2,0,0]=4 6983 B17R1.9274 Cc1ccccc1NC(=O)CCCCCCO 8fae4cd841443546bc39516a7dbad90b [0,1,0,0,0,1|2,0,0]=4 6984 B17R1.9274 Cc1ccccc1NC(=O)CCCCCCS a1f266037ee15a6f2ca561e24980e0e6 [0,1,0,0,0,1|2,0,0]=4 6985 B17R1.9274 NCCCCCNC(=O)Nc1ccccc1Cl a2a75f00da78ebf9ff921160123d8b45 [0,1,0,0,0,1|2,0,0]=4 6986 B17R1.9274 NCCCCCNC(=O)Nc1ccccc1I d5587cbdbef6e0f450f9dcf71d80d14e [0,1,0,0,0,1|2,0,0]=4 6987 B17R1.9274 NCCCCCNC(=O)Nc1ccccc1O ab5830b751465a692ea00e588dfbd122 [0,1,0,0,0,1|2,0,0]=4 6988 B17R1.9274 O=C(CCCCCCF)Nc1ccccc1Br 0d48661c7b1532fc187e90cf4aa80018 [0,1,0,0,0,1|2,0,0]=4 6989 B17R1.9274 O=C(CCCCCCF)Nc1ccccc1Cl 913094e2a48c5d90895cba5b621ccbac [0,1,0,0,0,1|2,0,0]=4 6990 B17R1.9274 O=C(CCCCCCF)Nc1ccccc1F 5f24fbb7a50fa5baa15c153388762d06 [0,1,0,0,0,1|2,0,0]=4 6991 B17R1.9274 O=C(CCCCCCF)Nc1ccccc1I 1a7f8a5816d8f165b8f078d4b872402e [0,1,0,0,0,1|2,0,0]=4 6992 B17R1.9274 O=C(CCCCCCF)Nc1ccccc1O 8dbcf98ff86df9bb37659ed4b655ab1f [0,1,0,0,0,1|2,0,0]=4 6993 B17R1.9274 O=C(CCCCCCF)Nc1ccccc1S 0981ed4b57a11f1d776fe0dd09dbdbe8 [0,1,0,0,0,1|2,0,0]=4 6994 B17R1.9274 O=C(CCCCCCO)Nc1ccccc1Br 30f4a7371dd92a8c9d0c8d20fcb143ed [0,1,0,0,0,1|2,0,0]=4 6995 B17R1.9274 O=C(CCCCCCO)Nc1ccccc1Cl cda4c3589b353eb04a9ce23ee92770ea [0,1,0,0,0,1|2,0,0]=4 6996 B17R1.9274 O=C(CCCCCCO)Nc1ccccc1F 461f8e70919c4ac8826d12b5c662dc2e [0,1,0,0,0,1|2,0,0]=4 6997 B17R1.9274 O=C(CCCCCCO)Nc1ccccc1I 20745bfa82a6ea6502a14d61ebef55a9 [0,1,0,0,0,1|2,0,0]=4 6998 B17R1.9274 O=C(CCCCCCO)Nc1ccccc1O f80962c32530ed0a3a1d078c0017f40d [0,1,0,0,0,1|2,0,0]=4 6999 B17R1.9274 O=C(CCCCCCO)Nc1ccccc1S d45325092e10aff9948f7100bd8f398f [0,1,0,0,0,1|2,0,0]=4 7000 B17R1.9274 O=C(CCCCCCS)Nc1ccccc1Br 35566b7d5260293826b16f10ec700c34 [0,1,0,0,0,1|2,0,0]=4 7001 B17R1.9274 O=C(CCCCCCS)Nc1ccccc1Cl 783ae20cef87bcd2d4442f0a83fc227e [0,1,0,0,0,1|2,0,0]=4 7002 B17R1.9274 O=C(CCCCCCS)Nc1ccccc1F 0a7a6b27b9abcaf57b21b923faa14018 [0,1,0,0,0,1|2,0,0]=4 7003 B17R1.9274 O=C(CCCCCCS)Nc1ccccc1I 5254cd2bb2be4bccdf485501b71678cf [0,1,0,0,0,1|2,0,0]=4 7004 B17R1.9274 O=C(CCCCCCS)Nc1ccccc1O b19ca153c5f85c2f4a2233d782d86c63 [0,1,0,0,0,1|2,0,0]=4 7005 B17R1.9274 O=C(CCCCCCS)Nc1ccccc1S b28ba3874508b9a1fe759c2fbbe35cd3 [0,1,0,0,0,1|2,0,0]=4 7006 B17R1.9274 O=C(Cc1ccccc1Br)NCCCCCCl e6e8f07e4affe7a5288133b1e9602ce1 [0,1,0,0,0,1|2,0,0]=4 7007 B17R1.9274 O=C(Cc1ccccc1Br)NCCCCCO ca013730dd49a475d9030bf1cef079f7 [0,1,0,0,0,1|2,0,0]=4 7008 B17R1.9274 O=C(Cc1ccccc1Cl)NCCCCCCl 970144f3aa5cc9a3af9bbd1a2b07e3d6 [0,1,0,0,0,1|2,0,0]=4 7009 B17R1.9274 O=C(Cc1ccccc1Cl)NCCCCCO 50c49ae8e9dba61ed6ca096b3c5552c5 [0,1,0,0,0,1|2,0,0]=4 7010 B17R1.9274 O=C(Cc1ccccc1F)NCCCCCCl b2493f4a0d25fc945aa7236b506e934b [0,1,0,0,0,1|2,0,0]=4 7011 B17R1.9274 O=C(Cc1ccccc1F)NCCCCCO 55dc2445591e49452dcaafea16381de8 [0,1,0,0,0,1|2,0,0]=4 7012 B17R1.9274 O=C(Cc1ccccc1I)NCCCCCCl 1212675e8580931478847f8ffb0b507d [0,1,0,0,0,1|2,0,0]=4 7013 B17R1.9274 O=C(Cc1ccccc1I)NCCCCCO e9f559c9b5824902f529adee3577ac9c [0,1,0,0,0,1|2,0,0]=4 7014 B17R1.9274 O=C(Cc1ccccc1O)NCCCCCCl d580177dc41833a3c8c323ed5f94e6cf [0,1,0,0,0,1|2,0,0]=4 7015 B17R1.9274 O=C(Cc1ccccc1O)NCCCCCO 1d753820ecaf3fff6a40e740d15e7e63 [0,1,0,0,0,1|2,0,0]=4 7016 B17R1.9274 O=C(NCCCCCO)Nc1ccccc1I 342639f5725a3cf8ae6de41d97e8feae [0,1,0,0,0,1|2,0,0]=4 7017 B17R1.24 CCCCCC(C)NC(=O)c1cc[n+](cc1)[O-] 5a665ce1d59b461cb2be53c50378518f [0,2,0,0,0,0|2,0,0]=4 7018 B17R1.24 CCCCCC(C)NC(=O)c1ccc(=O)oc1 c3db09f83caa017a2bce45c0f2ba7435 [0,2,0,0,0,0|2,0,0]=4 7019 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)Br 48ff94f56f190eb8bb185afa1d6bdced [0,2,0,0,0,0|1,0,0]=3 7020 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)C 06ebcddd0335e8c074ad6a14158e770e [0,2,0,0,0,0|1,0,0]=3 7021 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)Cl 386913996ea8aa1eb190760ebba2f3c0 [0,2,0,0,0,0|1,0,0]=3 7022 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)F 7c49bb7d968e4a0252ab98770369ac67 [0,2,0,0,0,0|1,0,0]=3 7023 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)I 1d651034903778ec7a1f306f74a55eea [0,2,0,0,0,0|1,0,0]=3 7024 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)O 86060f8db3cb3932af806f45b5c97347 [0,2,0,0,0,0|1,0,0]=3 7025 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cc1)S 2363da5503f39a2e8d2954d762c385a4 [0,2,0,0,0,0|1,0,0]=3 7026 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cn1)Br 19a2a32f80ea88e4cde4600b28bfcdaa [0,2,0,0,0,0|2,0,0]=4 7027 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cn1)C 72db21f79b411dcb5292a601b0082610 [0,2,0,0,0,0|2,0,0]=4 7028 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cn1)Cl e291daa5984f08a833a8a292fa52f9fc [0,2,0,0,0,0|2,0,0]=4 7029 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cn1)F ae1a41c46a3a9fa05a22dbcb37dfb10b [0,2,0,0,0,0|2,0,0]=4 7030 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cn1)I a56cfded5261777efb05f31dd92a9131 [0,2,0,0,0,0|2,0,0]=4 7031 B17R1.24 CCCCCC(C)NC(=O)c1ccc(cn1)O e3425fc5d60f18d368a174e10e139084 [0,2,0,0,0,0|2,0,0]=4 7032 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)Br 2f32eccc6f81dfc08ee431dd13d4fa00 [0,2,0,0,0,0|2,0,0]=4 7033 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)C cdb765e0f848e214705935e12851d6df [0,2,0,0,0,0|2,0,0]=4 7034 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)Cl 7f1c42cd382b9622840c58e16c275965 [0,2,0,0,0,0|2,0,0]=4 7035 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)F 48aefc1347dc5f7586b2c4387eceb218 [0,2,0,0,0,0|2,0,0]=4 7036 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)I 183dafdc63c3ebec3152831b35189904 [0,2,0,0,0,0|2,0,0]=4 7037 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)O 5b2acee3154c5ae9f8c889b76744ac69 [0,2,0,0,0,0|2,0,0]=4 7038 B17R1.24 CCCCCC(C)NC(=O)c1ccc(nc1)S 0e5606dfff161215ab8999ae342db8a6 [0,2,0,0,0,0|2,0,0]=4 7039 B17R1.24 CCCCCC(C)OC(C)c1ccc(cc1)F ea3f56b88ee94fa7786eec101fd13098 [0,2,0,0,0,0|1,0,1]=4 7040 B17R1.24 CCCCCN(C)CC(=O)c1ccc(cc1)C cf1ec4478484e4dca50a23d8ae80ad70 [0,2,0,0,0,0|2,0,0]=4 7041 B17R1.24 CCCCCN(C)CC(=O)c1ccc(cc1)Cl 80b7f32ac05d79aa54867e119c9c8136 [0,2,0,0,0,0|2,0,0]=4 7042 B17R1.24 CCCCCN(C)CC(=O)c1ccc(cc1)F ad93aeaf14004bfff6d5e9a94f0d4e5c [0,2,0,0,0,0|2,0,0]=4 7043 B17R1.24 CCCCCN(C)CC(=O)c1ccc(cc1)I 5010e518ce030764dd0c070c41ab2c89 [0,2,0,0,0,0|2,0,0]=4 7044 B17R1.24 CCCCC[C@@H](C)OC(C)c1ccc(cc1)F f0524d397a78b2aaec307a0d6c3038c7 [0,2,0,0,0,0|1,0,1]=4 7045 B17R1.24 CCCCC[C@H](C)NC(=O)c1cc[n+](cc1)[O-] e82402a0faa4e4c131e141ab6f11b72c [0,2,0,0,0,0|2,0,0]=4 7046 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(=O)oc1 9a98d2b2c306cecd28851a7b84ba3518 [0,2,0,0,0,0|2,0,0]=4 7047 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)Br 179bcf4800b3dbfa74d3b7dfab0dad6f [0,2,0,0,0,0|1,0,0]=3 7048 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)C 41d829fc67dcaeaedc15fa1f22667381 [0,2,0,0,0,0|1,0,0]=3 7049 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)Cl 604a38320459364908d596e8f7217ade [0,2,0,0,0,0|1,0,0]=3 7050 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)F 3655d75adc62f2a88c23cf37b4292bdf [0,2,0,0,0,0|1,0,0]=3 7051 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)I 934017ab8b268ebefb66f0d8e850280d [0,2,0,0,0,0|1,0,0]=3 7052 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)O 90ec70107688f5af0045a2535af887bd [0,2,0,0,0,0|1,0,0]=3 7053 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cc1)S 6f780ea5763e90b94975671b58e9ae66 [0,2,0,0,0,0|1,0,0]=3 7054 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cn1)Br 33e98b26fd22ccde912fd4a6b734db41 [0,2,0,0,0,0|2,0,0]=4 7055 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cn1)C 4a695c47441f3a432e4afa71aa4644e0 [0,2,0,0,0,0|2,0,0]=4 7056 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cn1)Cl b963d5440ef6dbd2be801483b6c0237f [0,2,0,0,0,0|2,0,0]=4 7057 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cn1)F 1bca760633ae2bf4887d0eb51c658c75 [0,2,0,0,0,0|2,0,0]=4 7058 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cn1)I a9f65b58f942e990bbcadc6daac336bc [0,2,0,0,0,0|2,0,0]=4 7059 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(cn1)O c9c1577fdc56e2a43c46018a916fa179 [0,2,0,0,0,0|2,0,0]=4 7060 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)Br 37b23bd85a6e2d086e0ad75f4fde1cdb [0,2,0,0,0,0|2,0,0]=4 7061 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)C 25f5779df6027be2cc34ceb1a2f773e9 [0,2,0,0,0,0|2,0,0]=4 7062 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)Cl f4c6c5494994ae59fb07f92b5b923a41 [0,2,0,0,0,0|2,0,0]=4 7063 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)F 58396e5e04ceb7bf1935c8f1c8d7374d [0,2,0,0,0,0|2,0,0]=4 7064 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)I b4001bea19185b11e04f096db311faf6 [0,2,0,0,0,0|2,0,0]=4 7065 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)O b4027f66b1820591e90a42b048f3313b [0,2,0,0,0,0|2,0,0]=4 7066 B17R1.24 CCCCC[C@H](C)NC(=O)c1ccc(nc1)S 4483b3beb7fa0c7d69b625fb9b8e6efb [0,2,0,0,0,0|2,0,0]=4 7067 B17R1.24 CCCCC[C@H](C)OC(C)c1ccc(cc1)Br 6aca9ae5bddf3e2038d60232894caa2e [0,2,0,0,0,0|1,0,1]=4 7068 B17R1.24 CCCCC[C@H](C)OC(C)c1ccc(cc1)F f45573e2f76cc1a44149840782445d85 [0,2,0,0,0,0|1,0,1]=4 7069 B17R1.24 CCCCC[C@H](C)O[C@@H](C)c1ccc(cc1)Br 9f89ac548f4d3e90c18f88fe7e7380a9 [0,2,0,0,0,0|1,0,1]=4 7070 B17R1.24 CCCCC[C@H](C)O[C@H](C)c1ccc(cc1)Br e435659fcd43280f913ce249174b56b0 [0,2,0,0,0,0|1,0,1]=4 7071 B17R1.25 CCCCCC(C)NC(=O)c1cc(=O)cco1 89a69a36bb400dd23baff7736955b72b [0,2,0,0,0,0|2,0,0]=4 7072 B17R1.25 CCCCCC(C)NC(=O)c1cc(ccn1)Br d715e135ed8cbe1c37f9b7b4bd8c1dda [0,2,0,0,0,0|2,0,0]=4 7073 B17R1.25 CCCCCC(C)NC(=O)c1cc(ccn1)C 741fc071f6ba3faf7fea10cb62b3be35 [0,2,0,0,0,0|2,0,0]=4 7074 B17R1.25 CCCCCC(C)NC(=O)c1cc(ccn1)Cl 9a42067becc00b1c2073ece4c68de02c [0,2,0,0,0,0|2,0,0]=4 7075 B17R1.25 CCCCCC(C)NC(=O)c1cc(ccn1)F 8b7fce3742597c9ff74debbf88174f3b [0,2,0,0,0,0|2,0,0]=4 7076 B17R1.25 CCCCCC(C)NC(=O)c1cc(ccn1)I c5e02d06bd9eb49539878e9439ace675 [0,2,0,0,0,0|2,0,0]=4 7077 B17R1.25 CCCCCC(C)NC(=O)c1cc(ccn1)O 6b5c98c7a40625b806bcac5fbf946097 [0,2,0,0,0,0|2,0,0]=4 7078 B17R1.25 CCCCCC(C)NC(=O)c1ccc[n+](c1)[O-] 700a1696b9b55f39b56dfa424ae2f790 [0,2,0,0,0,0|2,0,0]=4 7079 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)Br 73a1379050572df919119af87bf9ec1b [0,2,0,0,0,0|1,0,0]=3 7080 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)C 81d6b3609b308c3aed778c4a020cff7c [0,2,0,0,0,0|1,0,0]=3 7081 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)Cl 92c8524a08dddd55ae5b081f46cc7ba3 [0,2,0,0,0,0|1,0,0]=3 7082 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)F 2dbbabb09010ac40ceed629af91914ea [0,2,0,0,0,0|1,0,0]=3 7083 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)I 79f4c84d3bd9c08a6714da8ad2643a18 [0,2,0,0,0,0|1,0,0]=3 7084 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)O 577eb8236fbc15cf609933984e1ab39d [0,2,0,0,0,0|1,0,0]=3 7085 B17R1.25 CCCCCC(C)NC(=O)c1cccc(c1)S 66225ace9f4a25502b54f6a5d74a1ade [0,2,0,0,0,0|1,0,0]=3 7086 B17R1.25 CCCCCC(C)NC(=O)c1cccc(n1)Br 3d969f94b037d5e269a13f8073f70c49 [0,2,0,0,0,0|2,0,0]=4 7087 B17R1.25 CCCCCC(C)NC(=O)c1cccc(n1)C 9a4f6dc441882af3d6cfe2f45c2e0bfe [0,2,0,0,0,0|2,0,0]=4 7088 B17R1.25 CCCCCC(C)NC(=O)c1cccc(n1)Cl 704355b358c2eb15405d708a7a9a6440 [0,2,0,0,0,0|2,0,0]=4 7089 B17R1.25 CCCCCC(C)NC(=O)c1cccc(n1)F 4800a263383d929c80fb940faae5f52c [0,2,0,0,0,0|2,0,0]=4 7090 B17R1.25 CCCCCC(C)NC(=O)c1cccc(n1)I 1e194b3ee4c3181d33a128c37e9d2a65 [0,2,0,0,0,0|2,0,0]=4 7091 B17R1.25 CCCCCC(C)NC(=O)c1cccc(n1)O 0253e80afe7b506555729066afd37fdd [0,2,0,0,0,0|2,0,0]=4 7092 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)Br f4d09c633eec780f4eb05148af0970c6 [0,2,0,0,0,0|2,0,0]=4 7093 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)C 444c03baceb23343297984e9e9d8f290 [0,2,0,0,0,0|2,0,0]=4 7094 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)Cl e02346d1dac3b5c9bee16610f71af557 [0,2,0,0,0,0|2,0,0]=4 7095 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)F f88ad420343e5426547b83a32d74e97a [0,2,0,0,0,0|2,0,0]=4 7096 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)I 7c921789ac5a76dbbfe5d6aa371d6c5f [0,2,0,0,0,0|2,0,0]=4 7097 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)O 774777aaf0f7a6436c1ba021aca43269 [0,2,0,0,0,0|2,0,0]=4 7098 B17R1.25 CCCCCC(C)NC(=O)c1ccnc(c1)S f751a27803fc591dad457c20f9d1b313 [0,2,0,0,0,0|2,0,0]=4 7099 B17R1.25 CCCCCC(C)NC(=O)c1cncc(c1)Br dfcc6275bd0832b7ac4c22a289730b10 [0,2,0,0,0,0|2,0,0]=4 7100 B17R1.25 CCCCCC(C)NC(=O)c1cncc(c1)C ca5130d0234dce97b495cf658db8020d [0,2,0,0,0,0|2,0,0]=4 7101 B17R1.25 CCCCCC(C)NC(=O)c1cncc(c1)Cl ef5f1d9099870c690aab5a6723438aed [0,2,0,0,0,0|2,0,0]=4 7102 B17R1.25 CCCCCC(C)NC(=O)c1cncc(c1)F 3cc07fc77dbfd5ec3de66f11440ffab1 [0,2,0,0,0,0|2,0,0]=4 7103 B17R1.25 CCCCCC(C)NC(=O)c1cncc(c1)I 3f41348f8eb86584f68971c68671991f [0,2,0,0,0,0|2,0,0]=4 7104 B17R1.25 CCCCCC(C)NC(=O)c1cncc(c1)O 87e192e4af2026421bb35d0254dd5f26 [0,2,0,0,0,0|2,0,0]=4 7105 B17R1.25 CCCCCC(C)OC(C)c1cccc(c1)C 7195a576a755a0d8a1b854b27d73645f [0,2,0,0,0,0|1,0,1]=4 7106 B17R1.25 CCCCCC(C)OC(C)c1cccc(c1)F 7ca2008a8745bae8dcfe4094fbe5e953 [0,2,0,0,0,0|1,0,1]=4 7107 B17R1.25 CCCCCC(C)O[C@@H](C)c1cccc(c1)C df5b4b04092d829f6d0865181131c9dd [0,2,0,0,0,0|1,0,1]=4 7108 B17R1.25 CCCCCC(C)O[C@@H](C)c1cccc(c1)F a0cd028c13679f1486d2380fdc79efa3 [0,2,0,0,0,0|1,0,1]=4 7109 B17R1.25 CCCCCC(C)O[C@H](C)c1cccc(c1)C 0ebc4f3e1cee9ed724096fb5a3ab6409 [0,2,0,0,0,0|1,0,1]=4 7110 B17R1.25 CCCCCC(C)O[C@H](C)c1cccc(c1)F 85f1b328b22c7b7c61924b6c02072200 [0,2,0,0,0,0|1,0,1]=4 7111 B17R1.25 CCCCCN(C)CC(=O)c1cccc(c1)Cl acd504b421d15d88141661ce51ba0c85 [0,2,0,0,0,0|2,0,0]=4 7112 B17R1.25 CCCCCN(C)CC(=O)c1cccc(c1)F 31468a607b6beb5f340de9092c17b15f [0,2,0,0,0,0|2,0,0]=4 7113 B17R1.25 CCCCCN(C)CC(=O)c1cccc(c1)I 4fc8c2818c92bb5c4ad3106029a2ab18 [0,2,0,0,0,0|2,0,0]=4 7114 B17R1.25 CCCCC[C@@H](C)OC(C)c1cccc(c1)F 53a6bb3c8a0c884fa2906d26c5978918 [0,2,0,0,0,0|1,0,1]=4 7115 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(=O)cco1 139e341824261ac802af7f3ef9904d1a [0,2,0,0,0,0|2,0,0]=4 7116 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(ccn1)Br 61fb4bef582cc181173000b780fbe139 [0,2,0,0,0,0|2,0,0]=4 7117 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(ccn1)C 7e6e402425aa5e01ef6e5dc9ccef51b0 [0,2,0,0,0,0|2,0,0]=4 7118 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(ccn1)Cl 99bb0889dcdfab2429be9cb764bfb533 [0,2,0,0,0,0|2,0,0]=4 7119 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(ccn1)F dcbbd950056de0637c4e672102c70401 [0,2,0,0,0,0|2,0,0]=4 7120 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(ccn1)I e176dd3ab6e2f43338d4e47c0c55f1fa [0,2,0,0,0,0|2,0,0]=4 7121 B17R1.25 CCCCC[C@H](C)NC(=O)c1cc(ccn1)O 83d6ae595ff9df3cc3ab3be25b67b916 [0,2,0,0,0,0|2,0,0]=4 7122 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccc[n+](c1)[O-] f539a1dce7a37b0eed7e69c4b7927cef [0,2,0,0,0,0|2,0,0]=4 7123 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)Br 2a55ccaa703a1ea2571e7890b5fe887a [0,2,0,0,0,0|1,0,0]=3 7124 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)C a910dfb8836b72c26b4a231271fb5aab [0,2,0,0,0,0|1,0,0]=3 7125 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)Cl 684bd1a5687442a9680a4e3c85bb0e98 [0,2,0,0,0,0|1,0,0]=3 7126 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)F e2e37942f186b5d330334de1a2ffaae8 [0,2,0,0,0,0|1,0,0]=3 7127 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)I cc028e0e4c9bb8de0da05fb7b38b2817 [0,2,0,0,0,0|1,0,0]=3 7128 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)O 3abd00c62e08b174d990fafcb0601b69 [0,2,0,0,0,0|1,0,0]=3 7129 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(c1)S 428c476d0be8333264f4d386891b0b14 [0,2,0,0,0,0|1,0,0]=3 7130 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(n1)Br 5f29384a522bd7c53c8bca33f8183d6e [0,2,0,0,0,0|2,0,0]=4 7131 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(n1)C 21a80a0299f40b9fb97afb2c3eacb126 [0,2,0,0,0,0|2,0,0]=4 7132 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(n1)Cl 79d6fb5b8f2984afa6746ea5c847a2ba [0,2,0,0,0,0|2,0,0]=4 7133 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(n1)F 03e07ea62aa6b5ef7fac1a76fd298e02 [0,2,0,0,0,0|2,0,0]=4 7134 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(n1)I f1e4694c3ab46a5999bcf02c7bbd3b08 [0,2,0,0,0,0|2,0,0]=4 7135 B17R1.25 CCCCC[C@H](C)NC(=O)c1cccc(n1)O c096f84878acefb1abac758dee390847 [0,2,0,0,0,0|2,0,0]=4 7136 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)Br 852d743de33d2b5e7c8ed9f59eda7670 [0,2,0,0,0,0|2,0,0]=4 7137 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)C be1c60470f0ecc57c06f6833bf2c46cc [0,2,0,0,0,0|2,0,0]=4 7138 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)Cl c51f243af51535b6aed2f1102bd77e23 [0,2,0,0,0,0|2,0,0]=4 7139 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)F 21603874064cb32ef54a6be7ce066fb0 [0,2,0,0,0,0|2,0,0]=4 7140 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)I 8fcbb9136d7052902097df4be5a6cbd4 [0,2,0,0,0,0|2,0,0]=4 7141 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)O e8855960e06a26ae0514a668b3009a35 [0,2,0,0,0,0|2,0,0]=4 7142 B17R1.25 CCCCC[C@H](C)NC(=O)c1ccnc(c1)S 621983419828087819e4ba77f207b298 [0,2,0,0,0,0|2,0,0]=4 7143 B17R1.25 CCCCC[C@H](C)NC(=O)c1cncc(c1)Br 0a6d5a35b419f730cbda9d0246bff183 [0,2,0,0,0,0|2,0,0]=4 7144 B17R1.25 CCCCC[C@H](C)NC(=O)c1cncc(c1)C 787758d2062e080ce51d7c97d67f2471 [0,2,0,0,0,0|2,0,0]=4 7145 B17R1.25 CCCCC[C@H](C)NC(=O)c1cncc(c1)Cl fd74152e838ced5977f018df7b2cacde [0,2,0,0,0,0|2,0,0]=4 7146 B17R1.25 CCCCC[C@H](C)NC(=O)c1cncc(c1)F 9dd513f2932a0dcafaac757aa0be7acb [0,2,0,0,0,0|2,0,0]=4 7147 B17R1.25 CCCCC[C@H](C)NC(=O)c1cncc(c1)I b3606e53c4379e8c5c2d1aac7fbd05a2 [0,2,0,0,0,0|2,0,0]=4 7148 B17R1.25 CCCCC[C@H](C)NC(=O)c1cncc(c1)O f218c098b6396ef5e241dea465521ba0 [0,2,0,0,0,0|2,0,0]=4 7149 B17R1.25 CCCCC[C@H](C)OC(C)c1cccc(c1)Br 65c3c8f8e393c255b7d6701988d26ace [0,2,0,0,0,0|1,0,1]=4 7150 B17R1.25 CCCCC[C@H](C)OC(C)c1cccc(c1)C 9218e335a1038a213de74cd4611e1b90 [0,2,0,0,0,0|1,0,1]=4 7151 B17R1.25 CCCCC[C@H](C)OC(C)c1cccc(c1)Cl 6bad427de70f14df42ec311f0655921c [0,2,0,0,0,0|1,0,1]=4 7152 B17R1.25 CCCCC[C@H](C)OC(C)c1cccc(c1)F 9ae9d30bc5174f8422e71bebcad93d84 [0,2,0,0,0,0|1,0,1]=4 7153 B17R1.25 CCCCC[C@H](C)OC(C)c1cccc(c1)I 1940e9afaeb9a3864302a2f860413ce0 [0,2,0,0,0,0|1,0,1]=4 7154 B17R1.25 CCCCC[C@H](C)O[C@@H](C)c1cccc(c1)Br ed379e272e5731ba7cec8721acf89ac3 [0,2,0,0,0,0|1,0,1]=4 7155 B17R1.25 CCCCC[C@H](C)O[C@@H](C)c1cccc(c1)C 658489eb08f8d0049f72081c2b5e6a1b [0,2,0,0,0,0|1,0,1]=4 7156 B17R1.25 CCCCC[C@H](C)O[C@@H](C)c1cccc(c1)Cl b8f64f8b0fdf57d0276e20940b843dae [0,2,0,0,0,0|1,0,1]=4 7157 B17R1.25 CCCCC[C@H](C)O[C@@H](C)c1cccc(c1)F 780ae9d69be6a01fac2cf6d2331b9fcc [0,2,0,0,0,0|1,0,1]=4 7158 B17R1.25 CCCCC[C@H](C)O[C@H](C)c1cccc(c1)Br d44a1b08fb2dfd81ab29ca76246851f0 [0,2,0,0,0,0|1,0,1]=4 7159 B17R1.25 CCCCC[C@H](C)O[C@H](C)c1cccc(c1)C bda493a9519916dfdee8a881cf5613f9 [0,2,0,0,0,0|1,0,1]=4 7160 B17R1.25 CCCCC[C@H](C)O[C@H](C)c1cccc(c1)Cl fe928ee743e47ba707bbee1131410123 [0,2,0,0,0,0|1,0,1]=4 7161 B17R1.25 CCCCC[C@H](C)O[C@H](C)c1cccc(c1)F ca5899da619df64adb554b4b1a9873bc [0,2,0,0,0,0|1,0,1]=4 7162 B17R1.675 CC(C)CCCC(C)NC(=O)c1ccccc1 6031c2836283849cda33b1ff9a44df0c [0,2,0,0,0,0|1,0,0]=3 7163 B17R1.675 CC(C)CCCC(C)NC(=O)c1ccccn1 4c5a968d4ea51dd6e3a7d85a34d7bb08 [0,2,0,0,0,0|2,0,0]=4 7164 B17R1.675 CC(C)CCCC(C)NC(=O)c1cccnc1 0406e62e79c73252017fe53527732cb9 [0,2,0,0,0,0|2,0,0]=4 7165 B17R1.675 CC(C)CCCC(C)NC(=O)c1ccncc1 26bebfd571788055fb6c97f12bab27c6 [0,2,0,0,0,0|2,0,0]=4 7166 B17R1.724 CCCCCCC(C)NC(=O)c1ccccc1 dcaf0579ad6c5d621ba955a5755ac396 [0,2,0,0,0,0|1,0,0]=3 7167 B17R1.724 CCCCCCC(C)NC(=O)c1ccccn1 94be18bf2cb8c72068cd9446071698a2 [0,2,0,0,0,0|2,0,0]=4 7168 B17R1.724 CCCCCCC(C)NC(=O)c1cccnc1 d9ffc590b683edc97b2725d786f79bf6 [0,2,0,0,0,0|2,0,0]=4 7169 B17R1.724 CCCCCCC(C)NC(=O)c1ccncc1 6fe301929fb06b1a74c5255138b808df [0,2,0,0,0,0|2,0,0]=4 7170 B17R1.724 CCCCCCN(C)CC(=O)c1ccccn1 25313f1b5daaf7afa9b8978bcca9612a [0,2,0,0,0,0|2,0,0]=4 7171 B17R1.724 CCCCCCN(C)CC(=O)c1cccnc1 ed4c62c923715597490211d6cdb523cf [0,2,0,0,0,0|2,0,0]=4 7172 B17R1.724 CCCCCC[C@@H](C)NC(=O)c1ccccc1 8b9c7107b392e8e81adf1ef4c01d8066 [0,2,0,0,0,0|1,0,0]=3 7173 B17R1.724 CCCCCC[C@@H](C)NC(=O)c1ccccn1 a3149494487c7a281a93b807688f909c [0,2,0,0,0,0|2,0,0]=4 7174 B17R1.724 CCCCCC[C@@H](C)NC(=O)c1cccnc1 5207214e81e286b59f9d13baf8e8e522 [0,2,0,0,0,0|2,0,0]=4 7175 B17R1.724 CCCCCC[C@@H](C)NC(=O)c1ccncc1 60797f7f574d6edd17aceaff618a8899 [0,2,0,0,0,0|2,0,0]=4 7176 B17R1.724 CCCCCC[C@H](C)NC(=O)c1ccccc1 68f58efc21985ea9f2e4a1b3089c2b13 [0,2,0,0,0,0|1,0,0]=3 7177 B17R1.724 CCCCCC[C@H](C)NC(=O)c1ccccn1 79b894dcaaba008d4c9e5c6aaa81debc [0,2,0,0,0,0|2,0,0]=4 7178 B17R1.724 CCCCCC[C@H](C)NC(=O)c1cccnc1 19c9f55e3df8278213ae3c7c4090942b [0,2,0,0,0,0|2,0,0]=4 7179 B17R1.724 CCCCCC[C@H](C)NC(=O)c1ccncc1 efd379c41a0224c3b85979e836311869 [0,2,0,0,0,0|2,0,0]=4 7180 B17R1.724 CN(CCCCCO)CC(=O)c1ccccc1 a6e1a43c288c1a9108b838875b18abda [0,2,0,0,0,0|2,0,0]=4 7181 B17R1.1446 C=CC(CCCCC)OC(C)c1ccccc1 75af3dd356c3492c4bf2012df33741ba [0,2,0,0,0,0|1,0,1]=4 7182 B17R1.1446 C=CC(CCCCC)O[C@@H](C)c1ccccc1 364c0d137a9379d022d796484a2e75b7 [0,2,0,0,0,0|1,0,1]=4 7183 B17R1.1446 C=CC(CCCCC)O[C@H](C)c1ccccc1 46fbc21bda2bfe6c2d34d1756b6435e8 [0,2,0,0,0,0|1,0,1]=4 7184 B17R1.1446 C=C[C@H](CCCCC)OC(C)c1ccccc1 1636ab8c106630a6204554d923093787 [0,2,0,0,0,0|1,0,1]=4 7185 B17R1.1446 C=C[C@H](CCCCC)O[C@@H](C)c1ccccc1 7315985975038458bc5ed4fdd5bad907 [0,2,0,0,0,0|1,0,1]=4 7186 B17R1.1446 C=C[C@H](CCCCC)O[C@H](C)c1ccccc1 e5185bca2bef1dfacb392aa1ac2dec35 [0,2,0,0,0,0|1,0,1]=4 7187 B17R1.1446 CCCCCC(CC)OC(C)c1ccccc1 786b61a7862d0151f39db4c6feeafe7f [0,2,0,0,0,0|1,0,1]=4 7188 B17R1.1446 CCCCCC(CC)O[C@@H](C)c1ccccc1 4ee2ace0245b2686f9ac2bc62199630a [0,2,0,0,0,0|1,0,1]=4 7189 B17R1.1446 CCCCCC(CC)O[C@H](C)c1ccccc1 72a9e725dbdd93feeeb69a0f9272a618 [0,2,0,0,0,0|1,0,1]=4 7190 B17R1.1446 CCCCC[C@H](CC)OC(C)c1ccccc1 16fbd1888306183b3ec95d5a53c916ea [0,2,0,0,0,0|1,0,1]=4 7191 B17R1.1446 CCCCC[C@H](CC)O[C@@H](C)c1ccccc1 c6962bbd3548ef97cd4ec3e181c21fa4 [0,2,0,0,0,0|1,0,1]=4 7192 B17R1.1446 CCCCC[C@H](CC)O[C@H](C)c1ccccc1 2247ba0a77dcd214f9562dab97b515bb [0,2,0,0,0,0|1,0,1]=4 7193 B17R1.1477 CCCCCN(C)C(=O)C(=O)c1ccccc1 ea97ab78b1de85e39dee58b765a24f3d [0,2,0,0,0,0|2,0,0]=4 7194 B17R1.1538 CCCNC(=O)[C@@H](C)OC(=O)c1ccccc1 90adc7ac181712025d0e8530b3db472f [0,2,0,0,0,0|1,0,1]=4 7195 B17R1.5750 CCCCCC(C)NC(=O)c1cccc[n+]1[O-] b17b9f0338989c922d9f4ed0acfa7dc6 [0,2,0,0,0,0|2,0,0]=4 7196 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1Br ca9afc5bd3d1bb659d9980a954d0cb72 [0,2,0,0,0,0|1,0,0]=3 7197 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1C 9e365ca8c489922fc6a98967a0fdb105 [0,2,0,0,0,0|1,0,0]=3 7198 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1Cl 63661573276b0a7bc1fa1d6e337ff9c9 [0,2,0,0,0,0|1,0,0]=3 7199 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1F a210ce9beda2cedb68fd66db23fad532 [0,2,0,0,0,0|1,0,0]=3 7200 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1I c2a6ebb2d3d6da0f258d898fb9a6605f [0,2,0,0,0,0|1,0,0]=3 7201 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1O e663e79e60553dd06151b659c92f8a48 [0,2,0,0,0,0|1,0,0]=3 7202 B17R1.5750 CCCCCC(C)NC(=O)c1ccccc1S d3725c821478415afab72975bd54db35 [0,2,0,0,0,0|1,0,0]=3 7203 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1Br c70fce4d772f837104f30f7c68fcb3ec [0,2,0,0,0,0|2,0,0]=4 7204 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1C 6e33088d9a766f3d25650e9b7c65504b [0,2,0,0,0,0|2,0,0]=4 7205 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1Cl a60f3375abf5c2923e74fd323662397d [0,2,0,0,0,0|2,0,0]=4 7206 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1F 813206c7d3880e89196a47d6aa11d394 [0,2,0,0,0,0|2,0,0]=4 7207 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1I 4d123162dba18ed3ec740b468da98451 [0,2,0,0,0,0|2,0,0]=4 7208 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1O c18211eda1d2f4acac77c6db5e531968 [0,2,0,0,0,0|2,0,0]=4 7209 B17R1.5750 CCCCCC(C)NC(=O)c1cccnc1S 24a62ca8c7f6112509913f8ba76dbed0 [0,2,0,0,0,0|2,0,0]=4 7210 B17R1.5750 CCCCCC(C)NC(=O)c1ccncc1Br 01f46dd3f611fe1b871d764140249bbc [0,2,0,0,0,0|2,0,0]=4 7211 B17R1.5750 CCCCCC(C)NC(=O)c1ccncc1C cee4afce9acd2cd33945e9010f9ae881 [0,2,0,0,0,0|2,0,0]=4 7212 B17R1.5750 CCCCCC(C)NC(=O)c1ccncc1Cl 64a15659a6976d95bbf8d4698568a6ce [0,2,0,0,0,0|2,0,0]=4 7213 B17R1.5750 CCCCCC(C)NC(=O)c1ccncc1F 971871b417887b430be02a35b438adcb [0,2,0,0,0,0|2,0,0]=4 7214 B17R1.5750 CCCCCC(C)NC(=O)c1ccncc1I c84be23534c0dff952d2f9bc26695c4d [0,2,0,0,0,0|2,0,0]=4 7215 B17R1.5750 CCCCCC(C)NC(=O)c1ccncc1O bb41f699bd0936db30f54b27d67108af [0,2,0,0,0,0|2,0,0]=4 7216 B17R1.5750 CCCCCC(C)NC(=O)c1cnccc1Br dd7448dd962cf34ca612c14b5784deee [0,2,0,0,0,0|2,0,0]=4 7217 B17R1.5750 CCCCCC(C)NC(=O)c1cnccc1C 425e8012a3451a2a90bdf2a68b8e15f1 [0,2,0,0,0,0|2,0,0]=4 7218 B17R1.5750 CCCCCC(C)NC(=O)c1cnccc1Cl 43f0c582e4f13b420f50fc8edb2771d5 [0,2,0,0,0,0|2,0,0]=4 7219 B17R1.5750 CCCCCC(C)NC(=O)c1cnccc1F e80e0d4f69147c2d9d518775d15014c1 [0,2,0,0,0,0|2,0,0]=4 7220 B17R1.5750 CCCCCC(C)NC(=O)c1cnccc1O 176bf15c6aa886a7aecf94f31144d866 [0,2,0,0,0,0|2,0,0]=4 7221 B17R1.5750 CCCCCC(C)NC(=O)c1ncccc1Br c2e02e98cf943ccd5bcab725ec26bf8a [0,2,0,0,0,0|2,0,0]=4 7222 B17R1.5750 CCCCCC(C)NC(=O)c1ncccc1C f62baf39818270e699631f66e97092ad [0,2,0,0,0,0|2,0,0]=4 7223 B17R1.5750 CCCCCC(C)NC(=O)c1ncccc1Cl 34beb6063c3d781b32aa0e30432f9609 [0,2,0,0,0,0|2,0,0]=4 7224 B17R1.5750 CCCCCC(C)NC(=O)c1ncccc1F 39702a5f331730e2bcbb0926bf113628 [0,2,0,0,0,0|2,0,0]=4 7225 B17R1.5750 CCCCCC(C)NC(=O)c1ncccc1I c1546b5314cde5c8db0328708a53c7a8 [0,2,0,0,0,0|2,0,0]=4 7226 B17R1.5750 CCCCCC(C)NC(=O)c1ncccc1O ec7a60d3dc58fc145315073eae961496 [0,2,0,0,0,0|2,0,0]=4 7227 B17R1.5750 CCCCCN(C)CC(=O)c1ccccc1F 72fc714cf0070d1e814cfc6ebd67450c [0,2,0,0,0,0|2,0,0]=4 7228 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccc[n+]1[O-] e5bb633c71ac962166983b1f14ccd8cb [0,2,0,0,0,0|2,0,0]=4 7229 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1Br c0de9c28ef5ffb97c6c230814c939c30 [0,2,0,0,0,0|1,0,0]=3 7230 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1C a29cf4c5b396c2f5c8763d4e810f7fe2 [0,2,0,0,0,0|1,0,0]=3 7231 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1Cl 2f2108852bf9173f8d152d5ded2ddb70 [0,2,0,0,0,0|1,0,0]=3 7232 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1F f1cfa58e1c0d9ab6e07d04b40b626170 [0,2,0,0,0,0|1,0,0]=3 7233 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1I 4ffcf0ddc3799c6848b616dfb4478262 [0,2,0,0,0,0|1,0,0]=3 7234 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1O 46dcf45a87aae868ed03a9f93d0e9aab [0,2,0,0,0,0|1,0,0]=3 7235 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccccc1S 8b21a240cd55f14695c95a9933703cbb [0,2,0,0,0,0|1,0,0]=3 7236 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1Br af529cfb37fa492d3b9f32544aed89cb [0,2,0,0,0,0|2,0,0]=4 7237 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1C 5faa1eb546045864d64da74132abf4c9 [0,2,0,0,0,0|2,0,0]=4 7238 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1Cl 97779f8a7daaff3dfe2ab7f6747b9ddc [0,2,0,0,0,0|2,0,0]=4 7239 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1F be980f7011bd534ab26106b574054684 [0,2,0,0,0,0|2,0,0]=4 7240 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1I f41be93a040851380103d2adc1f22e11 [0,2,0,0,0,0|2,0,0]=4 7241 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1O bc31c251ab3e8f94954f89d672714609 [0,2,0,0,0,0|2,0,0]=4 7242 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cccnc1S 60229a26f27d8d6086497a330d7f58aa [0,2,0,0,0,0|2,0,0]=4 7243 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccncc1Br 25bf3689c291d12c920ed88938175032 [0,2,0,0,0,0|2,0,0]=4 7244 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccncc1C e3d5f82df7e47c0e9daaf67c1d6544c8 [0,2,0,0,0,0|2,0,0]=4 7245 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccncc1Cl 04586280919044b3a930a10d4843a4db [0,2,0,0,0,0|2,0,0]=4 7246 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccncc1F 8ab81c8edaa967c442cf8138b8fc0486 [0,2,0,0,0,0|2,0,0]=4 7247 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccncc1I b374cdda09519e85ebe8b25712b7bba9 [0,2,0,0,0,0|2,0,0]=4 7248 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ccncc1O eb0f17292f3087cb7628300fe43258f5 [0,2,0,0,0,0|2,0,0]=4 7249 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cnccc1Br 4e2be161b1ff9f810b5a287903220caa [0,2,0,0,0,0|2,0,0]=4 7250 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cnccc1C f3576ec43141ff4cd272f4bc3f7ebbda [0,2,0,0,0,0|2,0,0]=4 7251 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cnccc1Cl 3de7b79c39a9aaf47d57d8738f631ee8 [0,2,0,0,0,0|2,0,0]=4 7252 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cnccc1F 126fad9366e48b12b2657eb7eead0ef1 [0,2,0,0,0,0|2,0,0]=4 7253 B17R1.5750 CCCCC[C@H](C)NC(=O)c1cnccc1O ff2eb1d9bbf689807bb024d6fb81de46 [0,2,0,0,0,0|2,0,0]=4 7254 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ncccc1Br 2f48d0d6a3bf179a89436e32ecee933c [0,2,0,0,0,0|2,0,0]=4 7255 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ncccc1C 0a4fb4d78c126eb5f176d85b867a87bf [0,2,0,0,0,0|2,0,0]=4 7256 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ncccc1Cl 30cda24e9ac666b7d8049fa66917efcb [0,2,0,0,0,0|2,0,0]=4 7257 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ncccc1F 0f2156322a73cd21d494f5e3042e3ebe [0,2,0,0,0,0|2,0,0]=4 7258 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ncccc1I 043d0d1e59b40abf4b4f513d1ec96877 [0,2,0,0,0,0|2,0,0]=4 7259 B17R1.5750 CCCCC[C@H](C)NC(=O)c1ncccc1O 1bf29f4ab49c34b841a981d0f993e77f [0,2,0,0,0,0|2,0,0]=4 7260 B17R1.8949 C=CC(OC(C)CCCCC)c1ccccc1 a81cb397fb0813c7e3843c3703dbf562 [0,2,0,0,0,0|1,0,1]=4 7261 B17R1.8949 C=CC(O[C@@H](C)CCCCC)c1ccccc1 c46b7fc2696f827b73c2d1c385b8c20c [0,2,0,0,0,0|1,0,1]=4 7262 B17R1.8949 C=CC(O[C@H](C)CCCCC)c1ccccc1 f905f73e80008910c8824cfbea483dc8 [0,2,0,0,0,0|1,0,1]=4 7263 B17R1.8949 CCCCCC(C)NC(C=O)c1ccccc1 60447d5093fc1ee74e114b66cae3032d [0,2,0,0,0,0|1,0,1]=4 7264 B17R1.8949 CCCCCC(C)OC(C=O)c1ccccc1 83957e23031b5bbdd4f987bdc043197c [0,2,0,0,0,0|0,0,1]=3 7265 B17R1.8949 CCCCCC(C)OC(CC)c1ccccc1 0a0551245fa00ccad7bd0f7ef0cd3820 [0,2,0,0,0,0|1,0,1]=4 7266 B17R1.8949 CCCCC[C@@H](C)OC(C=O)c1ccccc1 22aa3c51496f76acddc621236487005a [0,2,0,0,0,0|0,0,1]=3 7267 B17R1.8949 CCCCC[C@@H](C)OC(CC)c1ccccc1 c94c4bdc9f369b6d218b583e450e4290 [0,2,0,0,0,0|1,0,1]=4 7268 B17R1.8949 CCCCC[C@H](C)NC(C=O)c1ccccc1 633c4e76a9b6fadb48680ea945da019e [0,2,0,0,0,0|1,0,1]=4 7269 B17R1.8949 CCCCC[C@H](C)OC(C=O)c1ccccc1 95081261f375eccdae9498bd7bea63fd [0,2,0,0,0,0|0,0,1]=3 7270 B17R1.8949 CCCCC[C@H](C)OC(CC)c1ccccc1 4a3297cc681c4bc89868f8b399221cba [0,2,0,0,0,0|1,0,1]=4 7271 B17R1.8949 CCCOCC(C)OC(C=O)c1ccccc1 3f3abfee5dd532d43963e4d445ae02f6 [0,2,0,0,0,0|1,0,1]=4 7272 B17R1.29547 CC(C)(CCCCO)NC(=O)c1ccccc1 dc72233d9db11bead8f28475d4708a43 [0,2,0,0,0,0|2,0,0]=4 7273 B17R1.29547 CCCOCC(C)(C)NC(=O)c1ccccc1 cdd018c20ceaeb18ec7f62969fcc761e [0,2,0,0,0,0|2,0,0]=4 7274 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)Br 8c6974904318103584cd3e3dd38479bf [0,2,0,0,0,0|1,0,1]=4 7275 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)C 12eb8b1fdd27f47f8bbf7b694049ec2f [0,2,0,0,0,0|1,0,1]=4 7276 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)Cl 12c3aae28b4ced3fd5a7391a928d65d2 [0,2,0,0,0,0|1,0,1]=4 7277 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)F 4cc7c8670f2fa670c7030e79ac0166e8 [0,2,0,0,0,0|1,0,1]=4 7278 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)I 75b23d55052e736c3dc6a0b6266cf5bb [0,2,0,0,0,0|1,0,1]=4 7279 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)O 35fd48183d688a89c305357817f7faef [0,2,0,0,0,0|1,0,1]=4 7280 B17R1.39 C#CCCCCCNC(=O)c1ccc(cc1)S 4e2666afa58d18b8717593f10f919c9a [0,2,0,0,0,0|1,0,1]=4 7281 B17R1.39 C#CCCCCOCC(=O)c1ccc(cc1)Br 05fb764c2d3df0a1d755816c2abb5954 [0,2,0,0,0,0|0,0,2]=4 7282 B17R1.39 C#CCCCCOCC(=O)c1ccc(cc1)C 9346b0edb77518331451e97df2d4edca [0,2,0,0,0,0|0,0,2]=4 7283 B17R1.39 C#CCCCCOCC(=O)c1ccc(cc1)Cl ed69d5def7e7fedb9f82bb59fefb5c26 [0,2,0,0,0,0|0,0,2]=4 7284 B17R1.39 C#CCCCCOCC(=O)c1ccc(cc1)F fa89e84f965bea169974d9a350f80cd4 [0,2,0,0,0,0|0,0,2]=4 7285 B17R1.39 C#CCCCCOCC(=O)c1ccc(cc1)I 8b48e80ce064fc70d08fc452fe1c70e7 [0,2,0,0,0,0|0,0,2]=4 7286 B17R1.39 C#CCCCNCOC(=O)c1ccc(cc1)F ef49a369c8903ef2c500a0277918075f [0,2,0,0,0,0|0,0,2]=4 7287 B17R1.39 C#CCCCOCOC(=O)c1ccc(cc1)F a5fa5c0284f903b95b0668d7f717acbc [0,2,0,0,0,0|0,0,2]=4 7288 B17R1.39 C#CCCOCCOC(=O)c1ccc(cc1)C 292c84e9de165bbc0547fca9f7c34f73 [0,2,0,0,0,0|0,0,2]=4 7289 B17R1.39 C/C=C/CCCOCC(=O)c1ccc(cc1)Br 59377a70592d297bbe8c99f706338e8f [0,2,0,0,0,0|0,0,2]=4 7290 B17R1.39 C/C=C/CCCOCC(=O)c1ccc(cc1)C 240fa30101afbd0648b22c22ca133e09 [0,2,0,0,0,0|0,0,2]=4 7291 B17R1.39 C/C=C/CCCOCC(=O)c1ccc(cc1)Cl 84884d0f91a07a712aa00fb6cda631e4 [0,2,0,0,0,0|0,0,2]=4 7292 B17R1.39 C/C=C/CCCOCC(=O)c1ccc(cc1)F a27781c27e19b284c2d182ee8017fd07 [0,2,0,0,0,0|0,0,2]=4 7293 B17R1.39 C/C=C/CCCOCC(=O)c1ccc(cc1)I 048ed5cfb2002911998eef66d3544039 [0,2,0,0,0,0|0,0,2]=4 7294 B17R1.39 C/C=C/CCOCOC(=O)c1ccc(cc1)F 3e33bcce319a0ef846e88db282d895d6 [0,2,0,0,0,0|0,0,2]=4 7295 B17R1.39 C/C=C/COCCOC(=O)c1ccc(cc1)C 568a94735eb4a251111cd09418c36f06 [0,2,0,0,0,0|0,0,2]=4 7296 B17R1.39 C/C=C\CCCOCC(=O)c1ccc(cc1)Br cef60c5ee597e0619be1b13710fe07ec [0,2,0,0,0,0|0,0,2]=4 7297 B17R1.39 C/C=C\CCCOCC(=O)c1ccc(cc1)C 3d135c570561fa5d93f957c2519737ef [0,2,0,0,0,0|0,0,2]=4 7298 B17R1.39 C/C=C\CCCOCC(=O)c1ccc(cc1)Cl 2e2e540546c26cf408da099812f62632 [0,2,0,0,0,0|0,0,2]=4 7299 B17R1.39 C/C=C\CCCOCC(=O)c1ccc(cc1)F 6eec9fe57cd4b3b8e702868615b9efe0 [0,2,0,0,0,0|0,0,2]=4 7300 B17R1.39 C/C=C\CCCOCC(=O)c1ccc(cc1)I bdf56d3901d5fc4541e39cdde68d9cdd [0,2,0,0,0,0|0,0,2]=4 7301 B17R1.39 C/C=C\COCCOC(=O)c1ccc(cc1)C 08446dc09cd577317b040bf6a78dda67 [0,2,0,0,0,0|0,0,2]=4 7302 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)Br 422504d0392ce9f7fade100405db5cf9 [0,2,0,0,0,0|1,0,1]=4 7303 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)C 2949a28dcf3be4f1d2c4750819488c85 [0,2,0,0,0,0|1,0,1]=4 7304 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)Cl 242b8fbb000019e698bbe76a3c9f0a4d [0,2,0,0,0,0|1,0,1]=4 7305 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)F cd18e92c242c18f2cce687112c1a5844 [0,2,0,0,0,0|1,0,1]=4 7306 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)I 3fe21bbeb3f11149d9436fa16894be3e [0,2,0,0,0,0|1,0,1]=4 7307 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)O 5c212b59ac0e4dc65b6f52cd7ccaa8cd [0,2,0,0,0,0|1,0,1]=4 7308 B17R1.39 C=CCCCCCNC(=O)c1ccc(cc1)S 844e573dcaa55f53fdf2de31dd37cc40 [0,2,0,0,0,0|1,0,1]=4 7309 B17R1.39 C=CCCCCOCC(=O)c1ccc(cc1)Br f161bb401ca44640780b09fd1ad1d388 [0,2,0,0,0,0|0,0,2]=4 7310 B17R1.39 C=CCCCCOCC(=O)c1ccc(cc1)C b6d8f80dcca5ed22031d6b2f5ab1b54d [0,2,0,0,0,0|0,0,2]=4 7311 B17R1.39 C=CCCCCOCC(=O)c1ccc(cc1)Cl 1d5f09fddf492b8f6e9a5c4c3c70f277 [0,2,0,0,0,0|0,0,2]=4 7312 B17R1.39 C=CCCCCOCC(=O)c1ccc(cc1)F 2edfec4a8b19c377a60dda4ad53dea60 [0,2,0,0,0,0|0,0,2]=4 7313 B17R1.39 C=CCCCCOCC(=O)c1ccc(cc1)I a39040c618c9072b02af904ce5d15f76 [0,2,0,0,0,0|0,0,2]=4 7314 B17R1.39 C=CCCCNCOC(=O)c1ccc(cc1)F ef643834451b0879da82fdd4a9485751 [0,2,0,0,0,0|0,0,2]=4 7315 B17R1.39 C=CCCCOCOC(=O)c1ccc(cc1)F c00b061788426e7218491020cf629ce0 [0,2,0,0,0,0|0,0,2]=4 7316 B17R1.39 C=CCCOCCOC(=O)c1ccc(cc1)C 25b1a9c394e68cc5d4be45d3948d3b3b [0,2,0,0,0,0|0,0,2]=4 7317 B17R1.39 CC#CCCCOCC(=O)c1ccc(cc1)Br 9d94214f9af31428b4743792c2b262de [0,2,0,0,0,0|0,0,2]=4 7318 B17R1.39 CC#CCCCOCC(=O)c1ccc(cc1)C 15a3728adf9df36bd668c667f1d44f90 [0,2,0,0,0,0|0,0,2]=4 7319 B17R1.39 CC#CCCCOCC(=O)c1ccc(cc1)Cl f8d94bf209bf42a148eb535a9bed7171 [0,2,0,0,0,0|0,0,2]=4 7320 B17R1.39 CC#CCCCOCC(=O)c1ccc(cc1)F 0562cc2bdfb755c544cad3ae6bf4d0ed [0,2,0,0,0,0|0,0,2]=4 7321 B17R1.39 CC#CCCCOCC(=O)c1ccc(cc1)I e10cd6e045bc9a4b6e6b351f2041f199 [0,2,0,0,0,0|0,0,2]=4 7322 B17R1.39 CC#CCCOCOC(=O)c1ccc(cc1)F d7df9e83cb2e4f26ea176cc586a0f321 [0,2,0,0,0,0|0,0,2]=4 7323 B17R1.39 CC(OCCCCCCF)c1ccc(cc1)Br dcb51ce9baed24b89a41d51af074fbf9 [0,2,0,0,0,0|1,0,1]=4 7324 B17R1.39 CC(OCCCCCCF)c1ccc(cc1)F 388ca8e7653719c5c8d759a3558a59e6 [0,2,0,0,0,0|1,0,1]=4 7325 B17R1.39 CC(OCCCCCCF)c1ccc(cc1)I 6e0a900c9a4a60e70e93fe639d1c1ec1 [0,2,0,0,0,0|1,0,1]=4 7326 B17R1.39 CC(OCCCCCCS)c1ccc(cc1)Br 7a86ff607f1d921c1b6754baa123c0c7 [0,2,0,0,0,0|1,0,1]=4 7327 B17R1.39 CC(OCCCCCCS)c1ccc(cc1)F 82edd760ef9fa5f899bfc5251213520e [0,2,0,0,0,0|1,0,1]=4 7328 B17R1.39 CC/C=C/CCOCC(=O)c1ccc(cc1)Br 4106ccb5728391453e1fa937c42a0e64 [0,2,0,0,0,0|0,0,2]=4 7329 B17R1.39 CC/C=C/CCOCC(=O)c1ccc(cc1)C 36db9a1cb0019ac4356f893402adfd7c [0,2,0,0,0,0|0,0,2]=4 7330 B17R1.39 CC/C=C/CCOCC(=O)c1ccc(cc1)Cl 863f2cd396ce2871f7f44d50c4f9f832 [0,2,0,0,0,0|0,0,2]=4 7331 B17R1.39 CC/C=C/CCOCC(=O)c1ccc(cc1)F ddf2bdcbda7facb626ef7fe91687db10 [0,2,0,0,0,0|0,0,2]=4 7332 B17R1.39 CC/C=C/CCOCC(=O)c1ccc(cc1)I 549d1e84c755de7013fecb04f0eb819d [0,2,0,0,0,0|0,0,2]=4 7333 B17R1.39 CC/C=C/COCOC(=O)c1ccc(cc1)F e896cfec62e240a05b511b39a5f3c402 [0,2,0,0,0,0|0,0,2]=4 7334 B17R1.39 CC/C=C\CCOCC(=O)c1ccc(cc1)Br 1e7011d5edb40155027e992058e15716 [0,2,0,0,0,0|0,0,2]=4 7335 B17R1.39 CC/C=C\CCOCC(=O)c1ccc(cc1)C d8bc430e4d5b15fdd737a55b98eee8d5 [0,2,0,0,0,0|0,0,2]=4 7336 B17R1.39 CC/C=C\CCOCC(=O)c1ccc(cc1)Cl 42799a2aae12d54aaf2ddd8aa37e23df [0,2,0,0,0,0|0,0,2]=4 7337 B17R1.39 CC/C=C\CCOCC(=O)c1ccc(cc1)F b0fe7c49b53c0b8677a5ee30ba0284d8 [0,2,0,0,0,0|0,0,2]=4 7338 B17R1.39 CC/C=C\CCOCC(=O)c1ccc(cc1)I 81ec85356ba1ec4de067bafdf042c78e [0,2,0,0,0,0|0,0,2]=4 7339 B17R1.39 CC/C=C\COCOC(=O)c1ccc(cc1)F 204caef7886d499f89eb6ad0dde9f084 [0,2,0,0,0,0|0,0,2]=4 7340 B17R1.39 CC=CCCCOCC(=O)c1ccc(cc1)Br 1cf079b5a1dc12f4fe9c8287fa1707f4 [0,2,0,0,0,0|0,0,2]=4 7341 B17R1.39 CC=CCCCOCC(=O)c1ccc(cc1)C 059ac764df9da739e22dfc8cecd6749f [0,2,0,0,0,0|0,0,2]=4 7342 B17R1.39 CC=CCCCOCC(=O)c1ccc(cc1)Cl 476ad44625b1f8a784ed76c8d46aff16 [0,2,0,0,0,0|0,0,2]=4 7343 B17R1.39 CC=CCCCOCC(=O)c1ccc(cc1)F 852c1455ffeb63f827db291adff577fd [0,2,0,0,0,0|0,0,2]=4 7344 B17R1.39 CC=CCCCOCC(=O)c1ccc(cc1)I bf84b27d8ee8843a03f72b09eba24206 [0,2,0,0,0,0|0,0,2]=4 7345 B17R1.39 CCC#CCCOCC(=O)c1ccc(cc1)Br 4ce92441723b5dfb65f4315efb8725fb [0,2,0,0,0,0|0,0,2]=4 7346 B17R1.39 CCC#CCCOCC(=O)c1ccc(cc1)C e0f912d7290754cc116525d4ca9bcc6f [0,2,0,0,0,0|0,0,2]=4 7347 B17R1.39 CCC#CCCOCC(=O)c1ccc(cc1)Cl 88cd96579a9631f3ab17f1261f7f7123 [0,2,0,0,0,0|0,0,2]=4 7348 B17R1.39 CCC#CCCOCC(=O)c1ccc(cc1)F c09c36d016a98ce0932c53cd38847f78 [0,2,0,0,0,0|0,0,2]=4 7349 B17R1.39 CCC#CCCOCC(=O)c1ccc(cc1)I ff9af2894048b5ffac5a3f8d22f0f314 [0,2,0,0,0,0|0,0,2]=4 7350 B17R1.39 CCC#CCOCOC(=O)c1ccc(cc1)F 7e3ebd2ee2ae28dab5b75b8989097b67 [0,2,0,0,0,0|0,0,2]=4 7351 B17R1.39 CCC/C=C/COCC(=O)c1ccc(cc1)Br 96c2d5a584c8d52b9d82334140688b1b [0,2,0,0,0,0|0,0,2]=4 7352 B17R1.39 CCC/C=C/COCC(=O)c1ccc(cc1)C 8bf8b6624c04feaaa6a527a91bd01c53 [0,2,0,0,0,0|0,0,2]=4 7353 B17R1.39 CCC/C=C/COCC(=O)c1ccc(cc1)Cl 116b9d7b95517478961edc796699d4df [0,2,0,0,0,0|0,0,2]=4 7354 B17R1.39 CCC/C=C/COCC(=O)c1ccc(cc1)F 669698e87e99cdf634c36f563850e196 [0,2,0,0,0,0|0,0,2]=4 7355 B17R1.39 CCC/C=C/COCC(=O)c1ccc(cc1)I 8e08eb865dc65184efad981b1585de84 [0,2,0,0,0,0|0,0,2]=4 7356 B17R1.39 CCC/C=C\COCC(=O)c1ccc(cc1)Br 0ceca26180e96c13441720dcd8e34670 [0,2,0,0,0,0|0,0,2]=4 7357 B17R1.39 CCC/C=C\COCC(=O)c1ccc(cc1)C 610bed1c175a7a2ef3b811c3c80343d2 [0,2,0,0,0,0|0,0,2]=4 7358 B17R1.39 CCC/C=C\COCC(=O)c1ccc(cc1)Cl 4ba2176f1eb76814e0d094821c16b861 [0,2,0,0,0,0|0,0,2]=4 7359 B17R1.39 CCC/C=C\COCC(=O)c1ccc(cc1)F 64e5d67f7a72a9848edcdb168ee96b0f [0,2,0,0,0,0|0,0,2]=4 7360 B17R1.39 CCC/C=C\COCC(=O)c1ccc(cc1)I 7b2cc7200a525a59784a0ae9f0500032 [0,2,0,0,0,0|0,0,2]=4 7361 B17R1.39 CCCC#CCOCC(=O)c1ccc(cc1)Br f2b0c7f2e9346518975ff4afc504b563 [0,2,0,0,0,0|0,0,2]=4 7362 B17R1.39 CCCC#CCOCC(=O)c1ccc(cc1)C 47179c549609c928d48ad39255507f55 [0,2,0,0,0,0|0,0,2]=4 7363 B17R1.39 CCCC#CCOCC(=O)c1ccc(cc1)Cl 8f92fd0ecd030e579c30eeecea07e2a2 [0,2,0,0,0,0|0,0,2]=4 7364 B17R1.39 CCCC#CCOCC(=O)c1ccc(cc1)F 185a539d7b26f6cfe3a12788987a88a7 [0,2,0,0,0,0|0,0,2]=4 7365 B17R1.39 CCCC#CCOCC(=O)c1ccc(cc1)I 3dd0e0a2a117952bf8151bdabc0d20e1 [0,2,0,0,0,0|0,0,2]=4 7366 B17R1.39 CCCCCCCNC(=O)c1cc[n+](cc1)[O-] a13ba3d0ef8e167173b239b96f3de662 [0,2,0,0,0,0|2,0,0]=4 7367 B17R1.39 CCCCCCCNC(=O)c1ccc(=O)oc1 abdd77b323def0e1fbd7b5b02f123119 [0,2,0,0,0,0|2,0,0]=4 7368 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)Br 345ce996716fe10ab090f06ca8e58231 [0,2,0,0,0,0|1,0,0]=3 7369 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)C 6c012f0fbf6242dbf4cd67596ef21e28 [0,2,0,0,0,0|1,0,0]=3 7370 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)Cl 054a8438516c69d2ade084923bd2b84b [0,2,0,0,0,0|1,0,0]=3 7371 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)F ba057dd587255406aa458a67f0ce5b05 [0,2,0,0,0,0|1,0,0]=3 7372 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)I 5de569083d5a4dfa3bd24767e3bb6c59 [0,2,0,0,0,0|1,0,0]=3 7373 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)O 8253dc78317022d7b604477942020acb [0,2,0,0,0,0|1,0,0]=3 7374 B17R1.39 CCCCCCCNC(=O)c1ccc(cc1)S a7cdfaaac1bb328fe6a091025a3a1d28 [0,2,0,0,0,0|1,0,0]=3 7375 B17R1.39 CCCCCCCNC(=O)c1ccc(cn1)Br b5b02365435aa7c22b95bdf299b6e55e [0,2,0,0,0,0|2,0,0]=4 7376 B17R1.39 CCCCCCCNC(=O)c1ccc(cn1)C 3d63eece67b724f44631f465a7bd10ab [0,2,0,0,0,0|2,0,0]=4 7377 B17R1.39 CCCCCCCNC(=O)c1ccc(cn1)Cl 130258ac501ba7df2352d4a541b071d0 [0,2,0,0,0,0|2,0,0]=4 7378 B17R1.39 CCCCCCCNC(=O)c1ccc(cn1)F 3996abb75303918e6b4ff41c679b4d90 [0,2,0,0,0,0|2,0,0]=4 7379 B17R1.39 CCCCCCCNC(=O)c1ccc(cn1)I d40972be1ef114e607f08f6508ecdf1a [0,2,0,0,0,0|2,0,0]=4 7380 B17R1.39 CCCCCCCNC(=O)c1ccc(cn1)O 063c3ca133c455a0cc080c44e4276f6a [0,2,0,0,0,0|2,0,0]=4 7381 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)Br 588f833dad9608cd358c060afe2bea03 [0,2,0,0,0,0|2,0,0]=4 7382 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)C 4e57b35031a35fdb54a5f5cbf24b5be7 [0,2,0,0,0,0|2,0,0]=4 7383 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)Cl af4380a3ad14fc657fe5aa4c5e988342 [0,2,0,0,0,0|2,0,0]=4 7384 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)F 4cbd1912d555445178c43fce7e9a9c2d [0,2,0,0,0,0|2,0,0]=4 7385 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)I d5ec4ed51c4399c4cf4ef8822addd98f [0,2,0,0,0,0|2,0,0]=4 7386 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)O 510f27797b3c80eee704539d2566eb6f [0,2,0,0,0,0|2,0,0]=4 7387 B17R1.39 CCCCCCCNC(=O)c1ccc(nc1)S 092dc1d1ba61d652860836fa891b75fa [0,2,0,0,0,0|2,0,0]=4 7388 B17R1.39 CCCCCCCOC(C)c1ccc(cc1)C 2330c67ca08f4ff89e4e1af2844ac879 [0,2,0,0,0,0|1,0,1]=4 7389 B17R1.39 CCCCCCCOC(C)c1ccc(cc1)F 24648ab15cf27fcf64e3560edce9ec54 [0,2,0,0,0,0|1,0,1]=4 7390 B17R1.39 CCCCCCCOC(C)c1ccc(cc1)I 8aee662d079519de3565a3f6cd20acb7 [0,2,0,0,0,0|1,0,1]=4 7391 B17R1.39 CCCCCCCO[C@@H](C)c1ccc(cc1)C 015f049ce2a4135f8a6f5941f39d703d [0,2,0,0,0,0|1,0,1]=4 7392 B17R1.39 CCCCCCCO[C@@H](C)c1ccc(cc1)F e5a746c99e380931def8d900364e4855 [0,2,0,0,0,0|1,0,1]=4 7393 B17R1.39 CCCCCCCO[C@@H](C)c1ccc(cc1)I 8824412e7cc324eb9e17577b6d9bd733 [0,2,0,0,0,0|1,0,1]=4 7394 B17R1.39 CCCCCCCO[C@H](C)c1ccc(cc1)C e9f1a42ea4ca7d02947225110516e3ac [0,2,0,0,0,0|1,0,1]=4 7395 B17R1.39 CCCCCCCO[C@H](C)c1ccc(cc1)F 247894bfb738857612e1e6de2ab9f1d7 [0,2,0,0,0,0|1,0,1]=4 7396 B17R1.39 CCCCCCCO[C@H](C)c1ccc(cc1)I 5adafb1f08a7a22ba81328e5d9259cb8 [0,2,0,0,0,0|1,0,1]=4 7397 B17R1.39 CCCCCCNCC(=O)c1ccc(cc1)Br de3be24bf46b19c73b6a028077943234 [0,2,0,0,0,0|1,0,0]=3 7398 B17R1.39 CCCCCCNCC(=O)c1ccc(cc1)C 1ca5ba399df1ac0802b6515e32ea929f [0,2,0,0,0,0|1,0,0]=3 7399 B17R1.39 CCCCCCNCC(=O)c1ccc(cc1)Cl d60a9be9c585b4401a3bf7226e8eda97 [0,2,0,0,0,0|1,0,0]=3 7400 B17R1.39 CCCCCCNCC(=O)c1ccc(cc1)F 5ea015276e0c5e552bc1b6578791e9b8 [0,2,0,0,0,0|1,0,0]=3 7401 B17R1.39 CCCCCCNCC(=O)c1ccc(cc1)I c32463f457b0a50c65d85073079c6b44 [0,2,0,0,0,0|1,0,0]=3 7402 B17R1.39 CCCCCCNCC(=O)c1ccc(cn1)Br aaba05c5998909b28c074941d074a6aa [0,2,0,0,0,0|2,0,0]=4 7403 B17R1.39 CCCCCCNCC(=O)c1ccc(cn1)C b086addcf54256f7b53f1ccde1af3990 [0,2,0,0,0,0|2,0,0]=4 7404 B17R1.39 CCCCCCNCC(=O)c1ccc(cn1)Cl 02d38ede7b7f7e8a9a5032172d9a2f9c [0,2,0,0,0,0|2,0,0]=4 7405 B17R1.39 CCCCCCNCC(=O)c1ccc(cn1)F 0ca003015d835e4d51c8c7ee3c3fda76 [0,2,0,0,0,0|2,0,0]=4 7406 B17R1.39 CCCCCCNCC(=O)c1ccc(nc1)C a80977832b8f2b80202a11c084bac501 [0,2,0,0,0,0|2,0,0]=4 7407 B17R1.39 CCCCCCNCC(=O)c1ccc(nc1)Cl 7af755106f7b4340d96c5982e494e1a9 [0,2,0,0,0,0|2,0,0]=4 7408 B17R1.39 CCCCCCOCC(=O)c1ccc(cc1)Br f37d0cbf039792146c330b5a7264d171 [0,2,0,0,0,0|0,0,0]=2 7409 B17R1.39 CCCCCCOCC(=O)c1ccc(cc1)C 70938728fe7b96c7a794fe855cf00538 [0,2,0,0,0,0|0,0,0]=2 7410 B17R1.39 CCCCCCOCC(=O)c1ccc(cc1)Cl 058f4e9dd571c1111c198b0887e270a1 [0,2,0,0,0,0|0,0,0]=2 7411 B17R1.39 CCCCCCOCC(=O)c1ccc(cc1)F 07428e570074bb9f8461c40f002d143e [0,2,0,0,0,0|0,0,0]=2 7412 B17R1.39 CCCCCCOCC(=O)c1ccc(cc1)I 7edc8b505ab9c67c49ef413c8ed123ef [0,2,0,0,0,0|0,0,0]=2 7413 B17R1.39 CCCCCCOCC(=O)c1ccc(cn1)Br 7582dac371a8bc4b1cc1b9889247b447 [0,2,0,0,0,0|1,0,0]=3 7414 B17R1.39 CCCCCCOCC(=O)c1ccc(cn1)Cl 67f9133d94fc26c7b0b3bab1aae1a508 [0,2,0,0,0,0|1,0,0]=3 7415 B17R1.39 CCCCCCOCC(=O)c1ccc(cn1)F 773baa6bd6d23bbe0281ce8057396feb [0,2,0,0,0,0|1,0,0]=3 7416 B17R1.39 CCCCCCOCC(=O)c1ccc(nc1)Br 8a3f079419036e45fa892d8a76022d59 [0,2,0,0,0,0|1,0,0]=3 7417 B17R1.39 CCCCCCOCC(=O)c1ccc(nc1)C 0fa498f4e642a014d660953dcb712900 [0,2,0,0,0,0|1,0,0]=3 7418 B17R1.39 CCCCCCOCC(=O)c1ccc(nc1)Cl 5251567b4f32b82c03588abaabcc0b50 [0,2,0,0,0,0|1,0,0]=3 7419 B17R1.39 CCCCCCOCC(=O)c1ccc(nn1)Cl 905f43c3a6a1fd59faad7821bdb2394e [0,2,0,0,0,0|2,0,0]=4 7420 B17R1.39 CCCCCCOCC(=O)c1cnc(nc1)Cl 08f30787a1df9257e9e538b698c8ab89 [0,2,0,0,0,0|2,0,0]=4 7421 B17R1.39 CCCCCCOCC(C)c1ccc(cc1)C b7ce8df335c237b1692d84530d0e67f9 [0,2,0,0,0,0|1,0,1]=4 7422 B17R1.39 CCCCCCOCC(C)c1ccc(cc1)F 9ab9ae4b36e7c55342a3da9ab5991538 [0,2,0,0,0,0|1,0,1]=4 7423 B17R1.39 CCCCCNCCC(=O)c1ccc(cc1)F b96ecc5f4886a337ed6ffca257ce1ca8 [0,2,0,0,0,0|1,0,0]=3 7424 B17R1.39 CCCCCNCOC(=O)c1ccc(cc1)F 80a4a60f12754f0daf52f0d4677673d4 [0,2,0,0,0,0|0,0,0]=2 7425 B17R1.39 CCCCCOCCC(=O)c1ccc(cc1)Cl 735614752e0ddf97f7085f571bf95dd8 [0,2,0,0,0,0|1,0,0]=3 7426 B17R1.39 CCCCCOCCC(=O)c1ccc(cc1)F 0eb658f36cf0511c61c3ac3c0820ff66 [0,2,0,0,0,0|1,0,0]=3 7427 B17R1.39 CCCCCOCOC(=O)c1ccc(cc1)F e9b3415709607183cf277bb17d11caa0 [0,2,0,0,0,0|0,0,0]=2 7428 B17R1.39 CCCCNCCCC(=O)c1ccc(cc1)C 8a8c171886e12c6d072f682cd3bc6188 [0,2,0,0,0,0|1,0,0]=3 7429 B17R1.39 CCCCNCCCC(=O)c1ccc(cc1)Cl 18869017c9c44dda9cc93cd56925cf8c [0,2,0,0,0,0|1,0,0]=3 7430 B17R1.39 CCCCNCCCC(=O)c1ccc(cc1)F ba5bb0f0d6cd03334205fa7f20b63cd0 [0,2,0,0,0,0|1,0,0]=3 7431 B17R1.39 CCCCNCCNC(=O)c1ccc(cn1)Cl e858e2041f7afcb1072db007c2af128f [0,2,0,0,0,0|2,0,0]=4 7432 B17R1.39 CCCCOCCCC(=O)c1ccc(cc1)Cl 37829ae7e8f282cbd15a7aad816a1732 [0,2,0,0,0,0|1,0,0]=3 7433 B17R1.39 CCCCOCCCC(=O)c1ccc(cc1)F 2e3e9f8b58c377970ee52fa037b49164 [0,2,0,0,0,0|1,0,0]=3 7434 B17R1.39 CCCCOCCNC(=O)c1cc[n+](cc1)[O-] 5d279cf293e72e27a36b26c3588379a7 [0,2,0,0,0,0|2,0,0]=4 7435 B17R1.39 CCCCOCCNC(=O)c1ccc(=O)oc1 92e2c057e1ba27770aed685978b8d1aa [0,2,0,0,0,0|2,0,0]=4 7436 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)Br c2831e98b6424f5f47142aec700d89bf [0,2,0,0,0,0|1,0,0]=3 7437 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)C f3d76aa0708ebb06e15d2f512f48af65 [0,2,0,0,0,0|1,0,0]=3 7438 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)Cl ac87acb6a1eddf32966ff1802c1d72c7 [0,2,0,0,0,0|1,0,0]=3 7439 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)F 6e27f3240bb847b53200c6f8c644704b [0,2,0,0,0,0|1,0,0]=3 7440 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)I dd065eef5b0856af0792d53e253365cb [0,2,0,0,0,0|1,0,0]=3 7441 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)O 500c01ea18c2a3310b8ad862d0df6131 [0,2,0,0,0,0|1,0,0]=3 7442 B17R1.39 CCCCOCCNC(=O)c1ccc(cc1)S c8cee3b6a8e7eeec4614b45cbde823e5 [0,2,0,0,0,0|1,0,0]=3 7443 B17R1.39 CCCCOCCNC(=O)c1ccc(cn1)Br 46a9f7527f68e4e666052a51f60450c8 [0,2,0,0,0,0|2,0,0]=4 7444 B17R1.39 CCCCOCCNC(=O)c1ccc(cn1)C 67921ddb145c6cb765f0dd877a27d1d2 [0,2,0,0,0,0|2,0,0]=4 7445 B17R1.39 CCCCOCCNC(=O)c1ccc(cn1)Cl f3bc8258a9629e053858f48a61ceddf5 [0,2,0,0,0,0|2,0,0]=4 7446 B17R1.39 CCCCOCCNC(=O)c1ccc(cn1)F 94d2781975d2b739c5030e176c166b6f [0,2,0,0,0,0|2,0,0]=4 7447 B17R1.39 CCCCOCCNC(=O)c1ccc(cn1)I c147ccd4201df1f4eda0cc3a42f9aad7 [0,2,0,0,0,0|2,0,0]=4 7448 B17R1.39 CCCCOCCNC(=O)c1ccc(cn1)O b8d4e56b1c73c6459db4a345862733ca [0,2,0,0,0,0|2,0,0]=4 7449 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)Br 0ea77a41438f86aa92d758314b8732bb [0,2,0,0,0,0|2,0,0]=4 7450 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)C 457956da78a57030bbf8ca274befdcb4 [0,2,0,0,0,0|2,0,0]=4 7451 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)Cl ee20ea3d37c43a9eb86ae833127eb676 [0,2,0,0,0,0|2,0,0]=4 7452 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)F 7f023b6ae57868d8d408fd079189edc1 [0,2,0,0,0,0|2,0,0]=4 7453 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)I 951d0623f5836aa8730c2c832e6be0f3 [0,2,0,0,0,0|2,0,0]=4 7454 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)O 81d4a437d870258e192273f56a95f5be [0,2,0,0,0,0|2,0,0]=4 7455 B17R1.39 CCCCOCCNC(=O)c1ccc(nc1)S 55e1f20bc1c4a6febc927b2d21516e56 [0,2,0,0,0,0|2,0,0]=4 7456 B17R1.39 CCCCOCCOC(=O)c1ccc(cc1)C 480ac572065e2182d4bd38a3877d9e7d [0,2,0,0,0,0|0,0,0]=2 7457 B17R1.39 CCCCOCCOC(C)c1ccc(cc1)Br e975cc0f1cb3e268c510fb55ee82e521 [0,2,0,0,0,0|1,0,1]=4 7458 B17R1.39 CCCCOCCOC(C)c1ccc(cc1)C a00f6916edd4a826330ff010765a0cac [0,2,0,0,0,0|1,0,1]=4 7459 B17R1.39 CCCCOCCOC(C)c1ccc(cc1)Cl 01b97ca3ae5f8d29444ccd1bbc9a8879 [0,2,0,0,0,0|1,0,1]=4 7460 B17R1.39 CCCCOCCOC(C)c1ccc(cc1)F dbb54f493e8d1815f9e9574e69d3c980 [0,2,0,0,0,0|1,0,1]=4 7461 B17R1.39 CCCCOCCOC(C)c1ccc(cc1)I f39cd27f61b24f7bf4f8074c9f330036 [0,2,0,0,0,0|1,0,1]=4 7462 B17R1.39 CCCCOCCO[C@@H](C)c1ccc(cc1)Br fcc7b2d763cc999a66e60418499ce5f8 [0,2,0,0,0,0|1,0,1]=4 7463 B17R1.39 CCCCOCCO[C@@H](C)c1ccc(cc1)C a06fe72b6cadd898eec3b7b6ee6c7e85 [0,2,0,0,0,0|1,0,1]=4 7464 B17R1.39 CCCCOCCO[C@@H](C)c1ccc(cc1)Cl 2c4395945e7590d2d4167fd587ee1888 [0,2,0,0,0,0|1,0,1]=4 7465 B17R1.39 CCCCOCCO[C@@H](C)c1ccc(cc1)F ac239abe706fa753cb9846cf3c0b7a89 [0,2,0,0,0,0|1,0,1]=4 7466 B17R1.39 CCCCOCCO[C@@H](C)c1ccc(cc1)I c992c985d6b6caa78686bd3be2856dbb [0,2,0,0,0,0|1,0,1]=4 7467 B17R1.39 CCCCOCCO[C@H](C)c1ccc(cc1)Br 8b7af5e5f608f911ee17580c72faf544 [0,2,0,0,0,0|1,0,1]=4 7468 B17R1.39 CCCCOCCO[C@H](C)c1ccc(cc1)C ad9bf905d85a600ab10843dedb847025 [0,2,0,0,0,0|1,0,1]=4 7469 B17R1.39 CCCCOCCO[C@H](C)c1ccc(cc1)Cl e84c825e64cf5e60bee778d45ca1027b [0,2,0,0,0,0|1,0,1]=4 7470 B17R1.39 CCCCOCCO[C@H](C)c1ccc(cc1)F 8943673d69a5bc0cfe4dae12e6e7bcbb [0,2,0,0,0,0|1,0,1]=4 7471 B17R1.39 CCCCOCCO[C@H](C)c1ccc(cc1)I 577f9981e6d86a1ab30e69f5956318ac [0,2,0,0,0,0|1,0,1]=4 7472 B17R1.39 CCCCOCNCC(=O)c1ccc(cc1)Br c1d5a0d3dbc7eb46854eef7f4e0bf468 [0,2,0,0,0,0|2,0,0]=4 7473 B17R1.39 CCCCOCNCC(=O)c1ccc(cc1)C 7f5c700d21e7843a5e47f9fd4fb3d6b2 [0,2,0,0,0,0|2,0,0]=4 7474 B17R1.39 CCCCOCNCC(=O)c1ccc(cc1)Cl 6a91f84d6f9444168f2da033d5d771ca [0,2,0,0,0,0|2,0,0]=4 7475 B17R1.39 CCCCOCOCC(=O)c1ccc(cc1)Br 79599646292d3212de43b812e4a9bce4 [0,2,0,0,0,0|1,0,0]=3 7476 B17R1.39 CCCCOCOCC(=O)c1ccc(cc1)C b98b8a54dc6e44de84a878296d7bfe3f [0,2,0,0,0,0|1,0,0]=3 7477 B17R1.39 CCCCOCOCC(=O)c1ccc(cc1)Cl a28b239db2ced7781414d7ff2e259c09 [0,2,0,0,0,0|1,0,0]=3 7478 B17R1.39 CCCCOCOCC(=O)c1ccc(cc1)F ea7f24578e61ae229f7a627557b8da2e [0,2,0,0,0,0|1,0,0]=3 7479 B17R1.39 CCCCOCOCC(=O)c1ccc(cc1)I 4ed474d5920adf84a063b8ff9390cfe8 [0,2,0,0,0,0|1,0,0]=3 7480 B17R1.39 CCCCSCCOC(C)c1ccc(cc1)F e8f8322cc03b8be2c4b8f85194558aca [0,2,0,0,0,0|1,0,1]=4 7481 B17R1.39 CCCOCCCNC(=O)c1cc[n+](cc1)[O-] 001950d349a50d3cd53e28b043c302ee [0,2,0,0,0,0|2,0,0]=4 7482 B17R1.39 CCCOCCCNC(=O)c1ccc(=O)oc1 5059245290c9891889afc0cdee7e01ca [0,2,0,0,0,0|2,0,0]=4 7483 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)Br 37405e21563820a1e927b5c66992cf5d [0,2,0,0,0,0|1,0,0]=3 7484 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)C 65c413a9e4eeba41a27dc55724fd6446 [0,2,0,0,0,0|1,0,0]=3 7485 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)Cl 67f4656916aa54bfac1e4c2904bc4a11 [0,2,0,0,0,0|1,0,0]=3 7486 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)F e03111fae7352a941ae3cfc5d7ba18b8 [0,2,0,0,0,0|1,0,0]=3 7487 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)I ae5e82ea95666553255f87f466762608 [0,2,0,0,0,0|1,0,0]=3 7488 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)O ccf7eb24888e4a63c4df433a27520113 [0,2,0,0,0,0|1,0,0]=3 7489 B17R1.39 CCCOCCCNC(=O)c1ccc(cc1)S 53cf4d14dc4970a0cb721f5c568d270e [0,2,0,0,0,0|1,0,0]=3 7490 B17R1.39 CCCOCCCNC(=O)c1ccc(cn1)Br 2befd17ba6d6d43d56d1dcc7ce66fbb2 [0,2,0,0,0,0|2,0,0]=4 7491 B17R1.39 CCCOCCCNC(=O)c1ccc(cn1)C 5a6687e7025b29e09f9a9b9b3689e430 [0,2,0,0,0,0|2,0,0]=4 7492 B17R1.39 CCCOCCCNC(=O)c1ccc(cn1)Cl 2943ec680074b4bf65ed80d3dfb49c9c [0,2,0,0,0,0|2,0,0]=4 7493 B17R1.39 CCCOCCCNC(=O)c1ccc(cn1)F ed07dd0070f339777466f401836bdc39 [0,2,0,0,0,0|2,0,0]=4 7494 B17R1.39 CCCOCCCNC(=O)c1ccc(cn1)I 919b067326828dc2ec2b13ec1278e851 [0,2,0,0,0,0|2,0,0]=4 7495 B17R1.39 CCCOCCCNC(=O)c1ccc(cn1)O 4b08c3516887b4d087522c0d87ac0f74 [0,2,0,0,0,0|2,0,0]=4 7496 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)Br a1a891237dd39ec7a19d138d2ac6907e [0,2,0,0,0,0|2,0,0]=4 7497 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)C c9a5b1cd2d738d48e4fa24eed81e2874 [0,2,0,0,0,0|2,0,0]=4 7498 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)Cl 3e433bb6290c966c2a8bdb61d25b618a [0,2,0,0,0,0|2,0,0]=4 7499 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)F 78b8700ac37a9f874eaa2676df92eace [0,2,0,0,0,0|2,0,0]=4 7500 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)I d6700e4c93cca6813e39efe5c2b6682c [0,2,0,0,0,0|2,0,0]=4 7501 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)O 48fc98f9a47b6bd80207eb146916faeb [0,2,0,0,0,0|2,0,0]=4 7502 B17R1.39 CCCOCCCNC(=O)c1ccc(nc1)S d24929395ee037de3480f045b4bcc93f [0,2,0,0,0,0|2,0,0]=4 7503 B17R1.39 CCCOCCCOC(C)c1ccc(cc1)Br a4adbc95b47f6ac8f4c0a020468e905d [0,2,0,0,0,0|1,0,1]=4 7504 B17R1.39 CCCOCCCOC(C)c1ccc(cc1)C 566de055b5f6cf95dacb1bb7e5874133 [0,2,0,0,0,0|1,0,1]=4 7505 B17R1.39 CCCOCCCOC(C)c1ccc(cc1)Cl 763c117b79d0cf0c69183a06fc1433b3 [0,2,0,0,0,0|1,0,1]=4 7506 B17R1.39 CCCOCCCOC(C)c1ccc(cc1)F 125c051da607b1a7ce88e5046e8f21b3 [0,2,0,0,0,0|1,0,1]=4 7507 B17R1.39 CCCOCCCOC(C)c1ccc(cc1)I f82391dcb0409250246e8fe7c851b02d [0,2,0,0,0,0|1,0,1]=4 7508 B17R1.39 CCCOCCCO[C@@H](C)c1ccc(cc1)Br 16b4505befa8a5eecf03a53d65b8039a [0,2,0,0,0,0|1,0,1]=4 7509 B17R1.39 CCCOCCCO[C@@H](C)c1ccc(cc1)C 47e8aa5cddd9b55faba1624cd830938d [0,2,0,0,0,0|1,0,1]=4 7510 B17R1.39 CCCOCCCO[C@@H](C)c1ccc(cc1)Cl 16978bf66034282176c94c17b61a1b7d [0,2,0,0,0,0|1,0,1]=4 7511 B17R1.39 CCCOCCCO[C@@H](C)c1ccc(cc1)F 827ceddcf947a4415c90e74f5c11d13a [0,2,0,0,0,0|1,0,1]=4 7512 B17R1.39 CCCOCCCO[C@@H](C)c1ccc(cc1)I 2719d2d3ba6b19225dfdb0ae3930a392 [0,2,0,0,0,0|1,0,1]=4 7513 B17R1.39 CCCOCCCO[C@H](C)c1ccc(cc1)Br 6c8ad88e0484da8db8743c95c8367762 [0,2,0,0,0,0|1,0,1]=4 7514 B17R1.39 CCCOCCCO[C@H](C)c1ccc(cc1)C 6c9eb533ef3174d48bbc87c002c44829 [0,2,0,0,0,0|1,0,1]=4 7515 B17R1.39 CCCOCCCO[C@H](C)c1ccc(cc1)Cl c55dcd8780ac3834a3005a02c391f63d [0,2,0,0,0,0|1,0,1]=4 7516 B17R1.39 CCCOCCCO[C@H](C)c1ccc(cc1)F 2db54982d81957236f9069511a836253 [0,2,0,0,0,0|1,0,1]=4 7517 B17R1.39 CCCOCCCO[C@H](C)c1ccc(cc1)I 51ac4986777f903390bf7748344baebb [0,2,0,0,0,0|1,0,1]=4 7518 B17R1.39 CCCOCCNCC(=O)c1ccc(cc1)Br 70295bb2420d157172de6b34fd193df6 [0,2,0,0,0,0|2,0,0]=4 7519 B17R1.39 CCCOCCNCC(=O)c1ccc(cc1)C 022dc2345bc6475b38423770fb4e170e [0,2,0,0,0,0|2,0,0]=4 7520 B17R1.39 CCCOCCNCC(=O)c1ccc(cc1)Cl 0116ce683253b7a8b259521a5d7b1825 [0,2,0,0,0,0|2,0,0]=4 7521 B17R1.39 CCCOCCNCC(=O)c1ccc(cc1)F a80c9070c7e4a937c921dacfaaced5be [0,2,0,0,0,0|2,0,0]=4 7522 B17R1.39 CCCOCCNCC(=O)c1ccc(cc1)I 5d8892884b532d86145387eb70560ff8 [0,2,0,0,0,0|2,0,0]=4 7523 B17R1.39 CCCOCCOCC(=O)c1ccc(cc1)Br 64e1054f9d3f209d1ad9bb9ae0247aba [0,2,0,0,0,0|1,0,0]=3 7524 B17R1.39 CCCOCCOCC(=O)c1ccc(cc1)C d5c1d11d0393061e4ae786046e2e73bd [0,2,0,0,0,0|1,0,0]=3 7525 B17R1.39 CCCOCCOCC(=O)c1ccc(cc1)Cl 618fc3f360b8a024d49e6ac867bcc7fd [0,2,0,0,0,0|1,0,0]=3 7526 B17R1.39 CCCOCCOCC(=O)c1ccc(cc1)F 95d1df1f3d0386cf91bb3ce68a508b7f [0,2,0,0,0,0|1,0,0]=3 7527 B17R1.39 CCCOCCOCC(=O)c1ccc(cc1)I be7dd685b267059cb8e4a0f671a375b9 [0,2,0,0,0,0|1,0,0]=3 7528 B17R1.39 CCCOCCOCC(=O)c1ccc(cn1)Br 6b36a66655c5dd5c605133565a1b18db [0,2,0,0,0,0|2,0,0]=4 7529 B17R1.39 CCCOCCOCC(=O)c1ccc(cn1)C 0d63735d41571f40dd2c85042dfa4a70 [0,2,0,0,0,0|2,0,0]=4 7530 B17R1.39 CCCOCCOCC(=O)c1ccc(cn1)Cl cbb84edb4cae1ac9557e95e121e6e840 [0,2,0,0,0,0|2,0,0]=4 7531 B17R1.39 CCCOCCOCC(=O)c1ccc(cn1)F d378b38b2817e8b03ece54393b368524 [0,2,0,0,0,0|2,0,0]=4 7532 B17R1.39 CCCOCCOCC(=O)c1ccc(nc1)Br 9a17eaa5e9ac6bfdf1f8d8e90469db76 [0,2,0,0,0,0|2,0,0]=4 7533 B17R1.39 CCCOCCOCC(=O)c1ccc(nc1)C 27e0d068828194cafc40d299f29ee8ad [0,2,0,0,0,0|2,0,0]=4 7534 B17R1.39 CCCOCCOCC(=O)c1ccc(nc1)Cl 81c639e6cfe5588680a40a5962e482e7 [0,2,0,0,0,0|2,0,0]=4 7535 B17R1.39 CCCSCCOCC(=O)c1ccc(cc1)Br 141896c6c21a656d808945812a55ce2c [0,2,0,0,0,0|1,0,0]=3 7536 B17R1.39 CCCSCCOCC(=O)c1ccc(cc1)C 24acc1b084cca560f2ad3e15e534d8f3 [0,2,0,0,0,0|1,0,0]=3 7537 B17R1.39 CCCSCCOCC(=O)c1ccc(cc1)Cl 86a2da78912de6230eaac4b7c233192d [0,2,0,0,0,0|1,0,0]=3 7538 B17R1.39 CCCSCCOCC(=O)c1ccc(cc1)F ad26bc4d7680c016bd3717897f273da5 [0,2,0,0,0,0|1,0,0]=3 7539 B17R1.39 CCCSCCOCC(=O)c1ccc(cc1)I 65576d712d10312d21f1ccf059b83afb [0,2,0,0,0,0|1,0,0]=3 7540 B17R1.39 CCCSCCOCC(=O)c1ccc(cn1)Br 504fddfc69fcd35c28eceb5b8d3b1ca8 [0,2,0,0,0,0|2,0,0]=4 7541 B17R1.39 CCCSCCOCC(=O)c1ccc(cn1)Cl c6eb63a7bfc919d626f6c33cddd0d100 [0,2,0,0,0,0|2,0,0]=4 7542 B17R1.39 CCCSCCOCC(=O)c1ccc(cn1)F 8dcfee995a49cc590f7f884722a5e45d [0,2,0,0,0,0|2,0,0]=4 7543 B17R1.39 CCCSCCOCC(=O)c1ccc(nc1)C f708275af00412b611e5e08a2a4bca09 [0,2,0,0,0,0|2,0,0]=4 7544 B17R1.39 CCCSCCOCC(=O)c1ccc(nc1)Cl 6124acd67e928f75e16a3bbabd3e338b [0,2,0,0,0,0|2,0,0]=4 7545 B17R1.39 CCOCCCNCC(=O)c1ccc(cc1)Br 90079b20e172e46242682e403a57ab6c [0,2,0,0,0,0|2,0,0]=4 7546 B17R1.39 CCOCCCNCC(=O)c1ccc(cc1)C ece4649db0e94edfcd8e96bc8117ead0 [0,2,0,0,0,0|2,0,0]=4 7547 B17R1.39 CCOCCCNCC(=O)c1ccc(cc1)Cl 0af7275a9949242a02ddaf51a973ed68 [0,2,0,0,0,0|2,0,0]=4 7548 B17R1.39 CCOCCCNCC(=O)c1ccc(cc1)F 49cadd8a7a9fc66c5d925da6fb90b783 [0,2,0,0,0,0|2,0,0]=4 7549 B17R1.39 CCOCCCNCC(=O)c1ccc(cc1)I 42afd653aa0ecb4990ccaf011baf464f [0,2,0,0,0,0|2,0,0]=4 7550 B17R1.39 CCOCCCOCC(=O)c1ccc(cc1)Br 2224e8d39a14accb04210c4e9d04e3e0 [0,2,0,0,0,0|1,0,0]=3 7551 B17R1.39 CCOCCCOCC(=O)c1ccc(cc1)C 5f2c6d6765708b9978c43fb3710f76c1 [0,2,0,0,0,0|1,0,0]=3 7552 B17R1.39 CCOCCCOCC(=O)c1ccc(cc1)Cl 67d80f1b3d9a7388898ba86942e74eb3 [0,2,0,0,0,0|1,0,0]=3 7553 B17R1.39 CCOCCCOCC(=O)c1ccc(cc1)F 911d0ff7490010bbcbb2c982471238ff [0,2,0,0,0,0|1,0,0]=3 7554 B17R1.39 CCOCCCOCC(=O)c1ccc(cc1)I 9f912f59c2ed0309259b8d517b45fa7a [0,2,0,0,0,0|1,0,0]=3 7555 B17R1.39 CCOCCCOCC(=O)c1ccc(cn1)Br 72127463768b39dff083399d7f917392 [0,2,0,0,0,0|2,0,0]=4 7556 B17R1.39 CCOCCCOCC(=O)c1ccc(cn1)C 81c1d9212806a3b70401d13592ef6b7d [0,2,0,0,0,0|2,0,0]=4 7557 B17R1.39 CCOCCCOCC(=O)c1ccc(cn1)Cl 0ccd6a63382e681bb5fc2fb6cedb92fa [0,2,0,0,0,0|2,0,0]=4 7558 B17R1.39 CCOCCCOCC(=O)c1ccc(cn1)F 6222de75a72521e46221eb54b82cd067 [0,2,0,0,0,0|2,0,0]=4 7559 B17R1.39 CCOCCCOCC(=O)c1ccc(nc1)C c374c40d360d9f45c5154ed1402cd8ab [0,2,0,0,0,0|2,0,0]=4 7560 B17R1.39 CCOCCCOCC(=O)c1ccc(nc1)Cl 53fc7bc185fe37802f16e4ab4dd6a3f2 [0,2,0,0,0,0|2,0,0]=4 7561 B17R1.39 CCOCCNCCC(=O)c1ccc(cc1)C ab66a11c2c98fd67e8ff76bc049b304a [0,2,0,0,0,0|2,0,0]=4 7562 B17R1.39 CCOCCNCCC(=O)c1ccc(cc1)F 27007331da48bfc4989ab61f46c05637 [0,2,0,0,0,0|2,0,0]=4 7563 B17R1.39 CCOCCNCOC(=O)c1ccc(cc1)F b5fe05fd54a9443ffae23bc47d990731 [0,2,0,0,0,0|1,0,0]=3 7564 B17R1.39 CCOCCOCCC(=O)c1ccc(cc1)C 6e1c3271d656ce3694fc7de871c046d9 [0,2,0,0,0,0|2,0,0]=4 7565 B17R1.39 CCOCCOCCC(=O)c1ccc(cc1)Cl 67232c969145eb9b34f3f553f535c8f3 [0,2,0,0,0,0|2,0,0]=4 7566 B17R1.39 CCOCCOCCC(=O)c1ccc(cc1)F 350feef072179fe2b8e8216a8636280e [0,2,0,0,0,0|2,0,0]=4 7567 B17R1.39 CCOCCOCOC(=O)c1ccc(cc1)F e2db7fb61b5769a78ffdbfaec89db291 [0,2,0,0,0,0|1,0,0]=3 7568 B17R1.39 CCOCOCCNC(=O)c1ccc(cc1)C e25c0b23bb514022fdfe71707524204e [0,2,0,0,0,0|2,0,0]=4 7569 B17R1.39 CCOCOCCOC(=O)c1ccc(cc1)C ee137303c47436a5eead4b763918c04e [0,2,0,0,0,0|1,0,0]=3 7570 B17R1.39 CCSCCCCNC(=O)c1cc[n+](cc1)[O-] f6eb1086e5a28e566d2abd7e81cea329 [0,2,0,0,0,0|2,0,0]=4 7571 B17R1.39 CCSCCCCNC(=O)c1ccc(=O)oc1 9953c4720f9ae0a11757bf1620613b3b [0,2,0,0,0,0|2,0,0]=4 7572 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)Br b85c02c84b209ea385e4073f817ca4e7 [0,2,0,0,0,0|1,0,0]=3 7573 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)C ebd093b883365a6fdf4c60e8dc198a99 [0,2,0,0,0,0|1,0,0]=3 7574 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)Cl 0542455ec994bdf726ac103567c98c71 [0,2,0,0,0,0|1,0,0]=3 7575 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)F 77e8952959c92fd17c57a00ee781dc2b [0,2,0,0,0,0|1,0,0]=3 7576 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)I de1e5918f1a96093c966fa499be64d6d [0,2,0,0,0,0|1,0,0]=3 7577 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)O d7f34bcee11104b344ee228f635a5eda [0,2,0,0,0,0|1,0,0]=3 7578 B17R1.39 CCSCCCCNC(=O)c1ccc(cc1)S 2eda6d53f03e398576e257ce68b4826f [0,2,0,0,0,0|1,0,0]=3 7579 B17R1.39 CCSCCCCNC(=O)c1ccc(cn1)Br 0718c3efb07b7d508f36b7e2377ff5d8 [0,2,0,0,0,0|2,0,0]=4 7580 B17R1.39 CCSCCCCNC(=O)c1ccc(cn1)C 2dea867aff93ca7563698d36c8e24366 [0,2,0,0,0,0|2,0,0]=4 7581 B17R1.39 CCSCCCCNC(=O)c1ccc(cn1)Cl 2279fed273cb12d59409d8c41289b6f4 [0,2,0,0,0,0|2,0,0]=4 7582 B17R1.39 CCSCCCCNC(=O)c1ccc(cn1)F 443b864011e4427aac68ba9bb9bc5d7f [0,2,0,0,0,0|2,0,0]=4 7583 B17R1.39 CCSCCCCNC(=O)c1ccc(cn1)I 8f97fbba5c63a10840650a8ff2267e2c [0,2,0,0,0,0|2,0,0]=4 7584 B17R1.39 CCSCCCCNC(=O)c1ccc(cn1)O 0a564bc7bd37979ca797ec8cf7dda09c [0,2,0,0,0,0|2,0,0]=4 7585 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)Br ee9669e1544ad1ac50c1ef44a58834dd [0,2,0,0,0,0|2,0,0]=4 7586 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)C 79448ffb8815e24ecdbbb8bbff451b7b [0,2,0,0,0,0|2,0,0]=4 7587 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)Cl 24186281834d0f7024ba142c68526578 [0,2,0,0,0,0|2,0,0]=4 7588 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)F 0e6ffd04356864c7aed3e12f1759b4c0 [0,2,0,0,0,0|2,0,0]=4 7589 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)I 1c13f91cd07340358ace14065b263ab1 [0,2,0,0,0,0|2,0,0]=4 7590 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)O 8591a8c1439a17b48dacc6b15654794a [0,2,0,0,0,0|2,0,0]=4 7591 B17R1.39 CCSCCCCNC(=O)c1ccc(nc1)S 636ed3bff5ab57e4fcbbdfe8e56a29e9 [0,2,0,0,0,0|2,0,0]=4 7592 B17R1.39 CCSCCCNCC(=O)c1ccc(cc1)Br 5c970d5f13579cbe7a01f16d1eec16be [0,2,0,0,0,0|2,0,0]=4 7593 B17R1.39 CCSCCCNCC(=O)c1ccc(cc1)C 8fa06e2b65ee037685542fb2765e52da [0,2,0,0,0,0|2,0,0]=4 7594 B17R1.39 CCSCCCNCC(=O)c1ccc(cc1)Cl b704984c1c4b3e9754800b72ef793e43 [0,2,0,0,0,0|2,0,0]=4 7595 B17R1.39 CCSCCCOCC(=O)c1ccc(cc1)Br 58e1073104e30239f84340a61ba51937 [0,2,0,0,0,0|1,0,0]=3 7596 B17R1.39 CCSCCCOCC(=O)c1ccc(cc1)C d909e9e28a69f4e0df663049a93bb452 [0,2,0,0,0,0|1,0,0]=3 7597 B17R1.39 CCSCCCOCC(=O)c1ccc(cc1)Cl 3052cf39e15513e231d35b0e29d52b4b [0,2,0,0,0,0|1,0,0]=3 7598 B17R1.39 CCSCCCOCC(=O)c1ccc(cc1)F c20cb204cd79e0c203f293eb6b37aeea [0,2,0,0,0,0|1,0,0]=3 7599 B17R1.39 CCSCCCOCC(=O)c1ccc(cc1)I f43ecf686c8646aba5ab98304ae7bce4 [0,2,0,0,0,0|1,0,0]=3 7600 B17R1.39 CCSCCCOCC(=O)c1ccc(cn1)Br 42d2a60ad62fc6fc49aa495e4172bad1 [0,2,0,0,0,0|2,0,0]=4 7601 B17R1.39 CCSCCCOCC(=O)c1ccc(cn1)Cl d12ccc030a7a07afc162b1ccad3d4515 [0,2,0,0,0,0|2,0,0]=4 7602 B17R1.39 CCSCCCOCC(=O)c1ccc(cn1)F c67a1894b355bfa2b7c8d1d82c42bb74 [0,2,0,0,0,0|2,0,0]=4 7603 B17R1.39 CCSCCCOCC(=O)c1ccc(nc1)C 8b05f38666ce20aa90419faa9779c87e [0,2,0,0,0,0|2,0,0]=4 7604 B17R1.39 CCSCCCOCC(=O)c1ccc(nc1)Cl fb6cd7c9b8975ab38ede136f96db9a3d [0,2,0,0,0,0|2,0,0]=4 7605 B17R1.39 CCSCCNCCC(=O)c1ccc(cc1)Br b54fa60badc8d623482e564a21156808 [0,2,0,0,0,0|2,0,0]=4 7606 B17R1.39 CCSCCNCCC(=O)c1ccc(cc1)C b25a3d7ad9c168216738af4fd46a3aa2 [0,2,0,0,0,0|2,0,0]=4 7607 B17R1.39 CCSCCNCCC(=O)c1ccc(cc1)F 228b82764addaa73cb995bee56ffd04f [0,2,0,0,0,0|2,0,0]=4 7608 B17R1.39 CCSCCNCOC(=O)c1ccc(cc1)F f0b5205cfa0ccabd76e54230f80345a9 [0,2,0,0,0,0|1,0,0]=3 7609 B17R1.39 CCSCCOCCC(=O)c1ccc(cc1)Br 73186b258607ebaf2876300b768dd1c1 [0,2,0,0,0,0|2,0,0]=4 7610 B17R1.39 CCSCCOCCC(=O)c1ccc(cc1)C 671fcd6acc7e3381be4fdb16ad64e470 [0,2,0,0,0,0|2,0,0]=4 7611 B17R1.39 CCSCCOCCC(=O)c1ccc(cc1)Cl 4bac30606c6b90f6da6dac2f76b192b1 [0,2,0,0,0,0|2,0,0]=4 7612 B17R1.39 CCSCCOCCC(=O)c1ccc(cc1)F c6b992545f64b74b002be6a0cf5a7017 [0,2,0,0,0,0|2,0,0]=4 7613 B17R1.39 CCSCCOCOC(=O)c1ccc(cc1)F c0d251b227ac9b1f9f0252b0685118e2 [0,2,0,0,0,0|1,0,0]=3 7614 B17R1.39 COCCCCCNC(=O)c1cc[n+](cc1)[O-] 9d56b3b0c48bb2ae24f66155aeaeffdc [0,2,0,0,0,0|2,0,0]=4 7615 B17R1.39 COCCCCCNC(=O)c1ccc(=O)oc1 b1f3511b5e7450689395df7d47c3fa36 [0,2,0,0,0,0|2,0,0]=4 7616 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)Br a6686dc1eb11bcf510debf9fc1fe5a04 [0,2,0,0,0,0|1,0,0]=3 7617 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)C 2ab23654904ce3ceae6124d2f4ab0eaf [0,2,0,0,0,0|1,0,0]=3 7618 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)Cl c05427a6464fc5394731ddf1ac4ed761 [0,2,0,0,0,0|1,0,0]=3 7619 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)F 0f53a300dce92f58451d1ea404e82325 [0,2,0,0,0,0|1,0,0]=3 7620 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)I f076c5c567969fe131e41d55a4024022 [0,2,0,0,0,0|1,0,0]=3 7621 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)O 0ab5ddfa1883b0df99b1a56f538d9d3b [0,2,0,0,0,0|1,0,0]=3 7622 B17R1.39 COCCCCCNC(=O)c1ccc(cc1)S 9723461ea999bc0c99f5146da2325d97 [0,2,0,0,0,0|1,0,0]=3 7623 B17R1.39 COCCCCCNC(=O)c1ccc(cn1)Br ca3d175282b81f8751049c94e89c3b50 [0,2,0,0,0,0|2,0,0]=4 7624 B17R1.39 COCCCCCNC(=O)c1ccc(cn1)C 65d4ef09b5903a0038989ace821a1b2b [0,2,0,0,0,0|2,0,0]=4 7625 B17R1.39 COCCCCCNC(=O)c1ccc(cn1)Cl 179cc1cb52ff3f4e516b80bc3b5f86a2 [0,2,0,0,0,0|2,0,0]=4 7626 B17R1.39 COCCCCCNC(=O)c1ccc(cn1)F b4735087a7175a51e82dff29ec89e553 [0,2,0,0,0,0|2,0,0]=4 7627 B17R1.39 COCCCCCNC(=O)c1ccc(cn1)I b7e943f96b2f842f54a7aaba24cac57f [0,2,0,0,0,0|2,0,0]=4 7628 B17R1.39 COCCCCCNC(=O)c1ccc(cn1)O 9ec3e2173d2a70e7cc36ca4037f8a669 [0,2,0,0,0,0|2,0,0]=4 7629 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)Br bda2251fbd8ba01eb1d3190879414d4e [0,2,0,0,0,0|2,0,0]=4 7630 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)C b0a64ea590bd3da3d60606a2a9abdfb2 [0,2,0,0,0,0|2,0,0]=4 7631 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)Cl 93ecbda9464d8486c1bd48ee46ae2fea [0,2,0,0,0,0|2,0,0]=4 7632 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)F e2824b9eb7e5856beb73a19a091d4a96 [0,2,0,0,0,0|2,0,0]=4 7633 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)I 9e31721bafd1275330aa92b63b8b7ebc [0,2,0,0,0,0|2,0,0]=4 7634 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)O f3dcaa2e8716320abbcded3bd0f84e66 [0,2,0,0,0,0|2,0,0]=4 7635 B17R1.39 COCCCCCNC(=O)c1ccc(nc1)S 6021957c5c74e154fe5dc1300515a98e [0,2,0,0,0,0|2,0,0]=4 7636 B17R1.39 COCCCCCOC(C)c1ccc(cc1)Br eb53477c2949ebad2e6d270c0f8b7593 [0,2,0,0,0,0|1,0,1]=4 7637 B17R1.39 COCCCCCOC(C)c1ccc(cc1)C c60fc30539263c19844d79e2f825c646 [0,2,0,0,0,0|1,0,1]=4 7638 B17R1.39 COCCCCCOC(C)c1ccc(cc1)F f4717baf58ed473b15eee41a0ed8d877 [0,2,0,0,0,0|1,0,1]=4 7639 B17R1.39 COCCCCCOC(C)c1ccc(cc1)I 314fd06c50f766b3670fb391608cc7c2 [0,2,0,0,0,0|1,0,1]=4 7640 B17R1.39 COCCCCCO[C@@H](C)c1ccc(cc1)Br 5a647b91602133ea089be772f30a5143 [0,2,0,0,0,0|1,0,1]=4 7641 B17R1.39 COCCCCCO[C@@H](C)c1ccc(cc1)C 6311ce5da6340d7c8db8bd6d3e94e16b [0,2,0,0,0,0|1,0,1]=4 7642 B17R1.39 COCCCCCO[C@@H](C)c1ccc(cc1)F 6ba86ab7337beaa688c7ce2d3d8a5559 [0,2,0,0,0,0|1,0,1]=4 7643 B17R1.39 COCCCCCO[C@@H](C)c1ccc(cc1)I e540d246c82b6a84386132327daaf024 [0,2,0,0,0,0|1,0,1]=4 7644 B17R1.39 COCCCCCO[C@H](C)c1ccc(cc1)Br 0e5f80db209e3bc9342cab003f5eea60 [0,2,0,0,0,0|1,0,1]=4 7645 B17R1.39 COCCCCCO[C@H](C)c1ccc(cc1)C 284f7346ff8cb9dc7325372678ac74c2 [0,2,0,0,0,0|1,0,1]=4 7646 B17R1.39 COCCCCCO[C@H](C)c1ccc(cc1)F d0bdeb28319376f2353a82744e31ceba [0,2,0,0,0,0|1,0,1]=4 7647 B17R1.39 COCCCCCO[C@H](C)c1ccc(cc1)I bf75674517bbc9c5133fd2406edb3c08 [0,2,0,0,0,0|1,0,1]=4 7648 B17R1.39 COCCCCNCC(=O)c1ccc(cc1)Br 6f850f16cb630f5d2071f59a38d2714c [0,2,0,0,0,0|2,0,0]=4 7649 B17R1.39 COCCCCNCC(=O)c1ccc(cc1)C a1a10c1512329dc35365638b988ae525 [0,2,0,0,0,0|2,0,0]=4 7650 B17R1.39 COCCCCNCC(=O)c1ccc(cc1)Cl 29b3779486c36e04c23a1b92436e8bd7 [0,2,0,0,0,0|2,0,0]=4 7651 B17R1.39 COCCCCNCC(=O)c1ccc(cc1)F 4d7b57f92e461025a2b823c06a6596f4 [0,2,0,0,0,0|2,0,0]=4 7652 B17R1.39 COCCCCNCC(=O)c1ccc(cc1)I f4276f130f42dcc1f66068cbffa62248 [0,2,0,0,0,0|2,0,0]=4 7653 B17R1.39 COCCCCOCC(=O)c1ccc(cc1)Br d3e14fceb5e48773011a39d952a66713 [0,2,0,0,0,0|1,0,0]=3 7654 B17R1.39 COCCCCOCC(=O)c1ccc(cc1)C cf530841186ade75959dae9e2b49f3b9 [0,2,0,0,0,0|1,0,0]=3 7655 B17R1.39 COCCCCOCC(=O)c1ccc(cc1)Cl ed42c572c204b40fcfd6f2849c0accf2 [0,2,0,0,0,0|1,0,0]=3 7656 B17R1.39 COCCCCOCC(=O)c1ccc(cc1)F 11e80a13ddfa9d7d2a929477769d244b [0,2,0,0,0,0|1,0,0]=3 7657 B17R1.39 COCCCCOCC(=O)c1ccc(cc1)I 92cd472081c24b3c1b657b7bc5ce3204 [0,2,0,0,0,0|1,0,0]=3 7658 B17R1.39 COCCCCOCC(=O)c1ccc(cn1)Br 85df60312d5d3c2e202b8fe1c0a553aa [0,2,0,0,0,0|2,0,0]=4 7659 B17R1.39 COCCCCOCC(=O)c1ccc(cn1)Cl 1b01c856ebb43befe4eb0e24619253b3 [0,2,0,0,0,0|2,0,0]=4 7660 B17R1.39 COCCCCOCC(=O)c1ccc(cn1)F 76906b55d3fe69829651f9125ac3dc03 [0,2,0,0,0,0|2,0,0]=4 7661 B17R1.39 COCCCCOCC(=O)c1ccc(nc1)Br e5111c5a7b7c120cd49ea1116eec63e7 [0,2,0,0,0,0|2,0,0]=4 7662 B17R1.39 COCCCCOCC(=O)c1ccc(nc1)C 2303b2d44243e3ca8fcc7534283d6020 [0,2,0,0,0,0|2,0,0]=4 7663 B17R1.39 COCCCCOCC(=O)c1ccc(nc1)Cl 50b4deafa4f568443cda604aa6e01fa7 [0,2,0,0,0,0|2,0,0]=4 7664 B17R1.39 COCCCNCCC(=O)c1ccc(cc1)F 0a5abd42f8b2bd938e0924f200060ca0 [0,2,0,0,0,0|2,0,0]=4 7665 B17R1.39 COCCCNCOC(=O)c1ccc(cc1)F 0827e1a8a573ae06863ccc440056034c [0,2,0,0,0,0|1,0,0]=3 7666 B17R1.39 COCCCOCCC(=O)c1ccc(cc1)Cl 880dffe2e911d56666dc94f3da937073 [0,2,0,0,0,0|2,0,0]=4 7667 B17R1.39 COCCCOCCC(=O)c1ccc(cc1)F 0e506d791e11857d3236d5aa295358df [0,2,0,0,0,0|2,0,0]=4 7668 B17R1.39 COCCCOCOC(=O)c1ccc(cc1)F 45a16a803f75418ad215f68e7105c525 [0,2,0,0,0,0|1,0,0]=3 7669 B17R1.39 COCCNCCCC(=O)c1ccc(cc1)C 6c939629c4aba0f5babc5f20faba3f52 [0,2,0,0,0,0|2,0,0]=4 7670 B17R1.39 COCCNCCCC(=O)c1ccc(cc1)Cl 574c0fe29a0bc6b0deb584512fa46ef1 [0,2,0,0,0,0|2,0,0]=4 7671 B17R1.39 COCCNCCCC(=O)c1ccc(cc1)F 87874f6db75e98ac6a10dd19d671bc30 [0,2,0,0,0,0|2,0,0]=4 7672 B17R1.39 COCCOCCCC(=O)c1ccc(cc1)C 81a74710511f80e654d71c6a9ab240a3 [0,2,0,0,0,0|2,0,0]=4 7673 B17R1.39 COCCOCCCC(=O)c1ccc(cc1)Cl 8d9768edfbd179b633e0c13be82466c5 [0,2,0,0,0,0|2,0,0]=4 7674 B17R1.39 COCCOCCCC(=O)c1ccc(cc1)F e685f231993f1c12f18f56153eb9f4ab [0,2,0,0,0,0|2,0,0]=4 7675 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)Br 7107953d56de68a3af71e2b3254918d5 [0,2,0,0,0,0|2,0,0]=4 7676 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)C 8e64befcc68c72a5d214521932fcca7d [0,2,0,0,0,0|2,0,0]=4 7677 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)Cl 8a820cf61e2f7ee084ea6d3bdeeb6884 [0,2,0,0,0,0|2,0,0]=4 7678 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)F 9e5a56400497733339e943f6af89e614 [0,2,0,0,0,0|2,0,0]=4 7679 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)I ba3e09c76f1d45256a72383d01a272e6 [0,2,0,0,0,0|2,0,0]=4 7680 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)O 2db3d056043e5ce610f6fdbd33b9a7f9 [0,2,0,0,0,0|2,0,0]=4 7681 B17R1.39 COCCOCCNC(=O)c1ccc(cc1)S 80abb9a77d09172dc73128fa30e2466b [0,2,0,0,0,0|2,0,0]=4 7682 B17R1.39 COCCOCCOC(=O)c1ccc(cc1)C 3337740ee1f1963a6744aa9d766fc7fc [0,2,0,0,0,0|1,0,0]=3 7683 B17R1.39 COCCOCOCC(=O)c1ccc(cc1)C 0c2dcf70da27d58e313a918db64f7396 [0,2,0,0,0,0|2,0,0]=4 7684 B17R1.39 COCCOCOCC(=O)c1ccc(cc1)Cl 1d015468a69ccb9f86e1275a09e131d7 [0,2,0,0,0,0|2,0,0]=4 7685 B17R1.39 COCCOCOCC(=O)c1ccc(cc1)F 29580a60dcb0c454ef697ae5a515bb24 [0,2,0,0,0,0|2,0,0]=4 7686 B17R1.39 COCCOCOCC(=O)c1ccc(cc1)I 591783c0941597e720f18bbad75ca56f [0,2,0,0,0,0|2,0,0]=4 7687 B17R1.39 COCOCCOCC(=O)c1ccc(cc1)Br 214657b71aa6a20363b081bf69182e2a [0,2,0,0,0,0|2,0,0]=4 7688 B17R1.39 COCOCCOCC(=O)c1ccc(cc1)C e10fd9816229c12d0515f7a5c261de44 [0,2,0,0,0,0|2,0,0]=4 7689 B17R1.39 COCOCCOCC(=O)c1ccc(cc1)Cl b0e616cfc4f2ea7d9b32d919c9ac97e6 [0,2,0,0,0,0|2,0,0]=4 7690 B17R1.39 COCOCCOCC(=O)c1ccc(cc1)F 444ce569e98705b5fc5fc12f8c6cff81 [0,2,0,0,0,0|2,0,0]=4 7691 B17R1.39 COCOCCOCC(=O)c1ccc(cc1)I 5d45aedb8b3622780444e86a3d1949b0 [0,2,0,0,0,0|2,0,0]=4 7692 B17R1.39 CSCCCCNCC(=O)c1ccc(cc1)Br 557504ab00290f27dc6cdaf1142f72cb [0,2,0,0,0,0|2,0,0]=4 7693 B17R1.39 CSCCCCNCC(=O)c1ccc(cc1)C 0388a16e56059041c6bd21499ad2433f [0,2,0,0,0,0|2,0,0]=4 7694 B17R1.39 CSCCCCNCC(=O)c1ccc(cc1)Cl cf02ab14c8e3820d1ff95bcdbcd938f0 [0,2,0,0,0,0|2,0,0]=4 7695 B17R1.39 CSCCCCNCC(=O)c1ccc(cc1)F 3a6461fcaf33bfde4446c5d41d43b152 [0,2,0,0,0,0|2,0,0]=4 7696 B17R1.39 CSCCCCNCC(=O)c1ccc(cc1)I 01f032d0dc588d092b4740eebb43f02f [0,2,0,0,0,0|2,0,0]=4 7697 B17R1.39 CSCCCCOCC(=O)c1ccc(cc1)Br 1220322e8d25d3d718cabe1517947bbc [0,2,0,0,0,0|1,0,0]=3 7698 B17R1.39 CSCCCCOCC(=O)c1ccc(cc1)C 69576a8289fc23b763dda199ab0f2627 [0,2,0,0,0,0|1,0,0]=3 7699 B17R1.39 CSCCCCOCC(=O)c1ccc(cc1)Cl c6427b3e58578346e62a39987bb74244 [0,2,0,0,0,0|1,0,0]=3 7700 B17R1.39 CSCCCCOCC(=O)c1ccc(cc1)F 4133ae0ba94365c3f747d44c8fa8a6f7 [0,2,0,0,0,0|1,0,0]=3 7701 B17R1.39 CSCCCCOCC(=O)c1ccc(cc1)I d28170b6b8704d92aa2b906996b30b0e [0,2,0,0,0,0|1,0,0]=3 7702 B17R1.39 CSCCCCOCC(=O)c1ccc(cn1)Br 4e34340b9b98563dbae890c23473a509 [0,2,0,0,0,0|2,0,0]=4 7703 B17R1.39 CSCCCCOCC(=O)c1ccc(cn1)Cl 701a2898fb40b20dd8687ecfbc0ace06 [0,2,0,0,0,0|2,0,0]=4 7704 B17R1.39 CSCCCCOCC(=O)c1ccc(cn1)F 2aed442844e4fcb9d754336db3999b2c [0,2,0,0,0,0|2,0,0]=4 7705 B17R1.39 CSCCCCOCC(=O)c1ccc(nc1)C eddf2a7ffd7783f7cde6fe7230de4fa2 [0,2,0,0,0,0|2,0,0]=4 7706 B17R1.39 CSCCCCOCC(=O)c1ccc(nc1)Cl 4448a084e694eddb497c6f91c5d035d5 [0,2,0,0,0,0|2,0,0]=4 7707 B17R1.39 CSCCCNCCC(=O)c1ccc(cc1)C 84947299ca41cd116061673383142b00 [0,2,0,0,0,0|2,0,0]=4 7708 B17R1.39 CSCCCNCCC(=O)c1ccc(cc1)F 9ea8c4cbc4c877f2586f0625d57bb379 [0,2,0,0,0,0|2,0,0]=4 7709 B17R1.39 CSCCCNCOC(=O)c1ccc(cc1)F 1f59cd1ad55024ccfcc7a8d34bf0a765 [0,2,0,0,0,0|1,0,0]=3 7710 B17R1.39 CSCCCOCCC(=O)c1ccc(cc1)Cl 1b935143d778de41d25f0f3af344015f [0,2,0,0,0,0|2,0,0]=4 7711 B17R1.39 CSCCCOCCC(=O)c1ccc(cc1)F 4e147949df4afdf8c8a8e084998652c9 [0,2,0,0,0,0|2,0,0]=4 7712 B17R1.39 CSCCCOCOC(=O)c1ccc(cc1)F 2951d8fd01ffec8fbc6a04fe2888e4ba [0,2,0,0,0,0|1,0,0]=3 7713 B17R1.39 CSCCNCCCC(=O)c1ccc(cc1)C 367aae6934cc282115f91419f8985dfa [0,2,0,0,0,0|2,0,0]=4 7714 B17R1.39 CSCCNCCCC(=O)c1ccc(cc1)Cl 349a52681b58a413aace43a15ad0bb89 [0,2,0,0,0,0|2,0,0]=4 7715 B17R1.39 CSCCNCCCC(=O)c1ccc(cc1)F c1edd88ede36d65e48afb3289089aa98 [0,2,0,0,0,0|2,0,0]=4 7716 B17R1.39 CSCCOCCCC(=O)c1ccc(cc1)Cl 2aecbab64592796581a4fc4c0c477192 [0,2,0,0,0,0|2,0,0]=4 7717 B17R1.39 CSCCOCCCC(=O)c1ccc(cc1)F d9083edaf432020d89643ac1e9a31d51 [0,2,0,0,0,0|2,0,0]=4 7718 B17R1.39 CSCCOCCNC(=O)c1ccc(cc1)Br d26c39d34fe8bd9fec505f2f6aa1f6f8 [0,2,0,0,0,0|2,0,0]=4 7719 B17R1.39 CSCCOCCNC(=O)c1ccc(cc1)C a68ffe33df3d0a8d21bfe742de95d040 [0,2,0,0,0,0|2,0,0]=4 7720 B17R1.39 CSCCOCCOC(=O)c1ccc(cc1)C 986e2bf94be4d929e336a2c6ee6d7ca2 [0,2,0,0,0,0|1,0,0]=3 7721 B17R1.39 C[C@@H](OCCCCCCF)c1ccc(cc1)F 9078697405f06c0f441415f40a81dc21 [0,2,0,0,0,0|1,0,1]=4 7722 B17R1.39 C[C@@H](OCCCCCCF)c1ccc(cc1)I bf51da2649863cd474c27a5c7fad0bf8 [0,2,0,0,0,0|1,0,1]=4 7723 B17R1.39 C[C@H](OCCCCCCF)c1ccc(cc1)F 23bf5d9d47008828921dcf5f373c36e6 [0,2,0,0,0,0|1,0,1]=4 7724 B17R1.39 C[C@H](OCCCCCCF)c1ccc(cc1)I 25e8e40ad2d7c8d4f3e48fefb5efb4ba [0,2,0,0,0,0|1,0,1]=4 7725 B17R1.39 Cc1ccc(cc1)C(=O)CCCNCCCCl d2e742f2e6456dc8b68141fcea8b7a09 [0,2,0,0,0,0|2,0,0]=4 7726 B17R1.39 Cc1ccc(cc1)C(=O)CCCNCCCO cb3b611186cae30ba169dbc23503c374 [0,2,0,0,0,0|2,0,0]=4 7727 B17R1.39 Cc1ccc(cc1)C(=O)CCCOCCCF 24d60fafb8a4b356c72e8a038bb40653 [0,2,0,0,0,0|2,0,0]=4 7728 B17R1.39 Cc1ccc(cc1)C(=O)CCNCCCCO 005e18ec2a36e7e18b19e10703cb4fbf [0,2,0,0,0,0|2,0,0]=4 7729 B17R1.39 Cc1ccc(cc1)C(=O)CCOCCCCF bc73ad996066c2bdb8723e3a6b73f604 [0,2,0,0,0,0|2,0,0]=4 7730 B17R1.39 Cc1ccc(cc1)C(=O)CNCCCCCCl 100a550b9ea6c34e1fdf97f6bbd61da0 [0,2,0,0,0,0|2,0,0]=4 7731 B17R1.39 Cc1ccc(cc1)C(=O)CNCCCCCF 1b7e42f544d055af4853eb7c07bc3003 [0,2,0,0,0,0|2,0,0]=4 7732 B17R1.39 Cc1ccc(cc1)C(=O)CNCCCCCO fdb7b28b047c5bea8d9aaf673101c4db [0,2,0,0,0,0|2,0,0]=4 7733 B17R1.39 Cc1ccc(cc1)C(=O)COCCCCC#N 34a05885d9aad8a136342fdcc984bd5c [0,2,0,0,0,0|1,0,1]=4 7734 B17R1.39 Cc1ccc(cc1)C(=O)COCCCCC=O ad8cb542f3acfcfbeb3accb642c8ef60 [0,2,0,0,0,0|1,0,1]=4 7735 B17R1.39 Cc1ccc(cc1)C(=O)COCCCCCF a644509f9b1fadccd0ad28ec2665ed7f [0,2,0,0,0,0|1,0,0]=3 7736 B17R1.39 Cc1ccc(cc1)C(=O)COCCOCCF bfdc90485a4be41baa761ce031284e4d [0,2,0,0,0,0|2,0,0]=4 7737 B17R1.39 Cc1ccc(cc1)C(=O)COCCOCCS 7c025b64a2ac98a99fd08dc698bccd0b [0,2,0,0,0,0|2,0,0]=4 7738 B17R1.39 Cc1ccc(cc1)C(=O)NCCCCCC#N d1b631a8898ea15ff00545a6d7eab568 [0,2,0,0,0,0|1,0,1]=4 7739 B17R1.39 Cc1ccc(cc1)C(=O)NCCCCCCCl 012d1ff9b9dc68d6b7c0175aa32366e5 [0,2,0,0,0,0|1,0,0]=3 7740 B17R1.39 Cc1ccc(cc1)C(=O)NCCCCCCO 18437345662e2b2fc66d781e1ccb3a5d [0,2,0,0,0,0|1,0,0]=3 7741 B17R1.39 Cc1ccc(cc1)C(=O)NCCCOCCO e282e683f41c555abc5c1d96e6b0164b [0,2,0,0,0,0|2,0,0]=4 7742 B17R1.39 Cc1ccc(cc1)C(=O)NCCOCCCF 31beb886e1ecefdb7bf6232b50611edf [0,2,0,0,0,0|2,0,0]=4 7743 B17R1.39 Cc1ccc(cc1)C(=O)NCCOCCCO ffd008c7c71ce3c0fc6d466614fab09a [0,2,0,0,0,0|2,0,0]=4 7744 B17R1.39 Cc1ccc(cc1)C(=O)NCCOCCCS 6337e6b93ec2ffb2c470aa603185f473 [0,2,0,0,0,0|2,0,0]=4 7745 B17R1.39 Cc1ccc(cc1)C(=O)OCCOCCC#N c3713dfb63691eabaebcaf524a8f73ed [0,2,0,0,0,0|1,0,1]=4 7746 B17R1.39 Cc1ccc(cc1)C(=O)OCCOCCC=O 9ad619093ed82e6f343e16962fe56cfb [0,2,0,0,0,0|1,0,1]=4 7747 B17R1.39 Cc1ccc(cc1)C(=O)OCCOCCCF 1797f8d1eb21890ad201ed3ea9cec2e0 [0,2,0,0,0,0|1,0,0]=3 7748 B17R1.39 Cc1ccc(cc1)C(=O)OCCOCCCS 517b1a725723613e9cb5793c3262813e [0,2,0,0,0,0|1,0,0]=3 7749 B17R1.39 Cc1ccc(cc1)C(C)OCCCCCCF abf2f1b80851c224ad96051b19ce46b7 [0,2,0,0,0,0|1,0,1]=4 7750 B17R1.39 Cc1ccc(cc1)[C@@H](C)OCCCCCCF ce72ac32f2ee035068a023972b8839ea [0,2,0,0,0,0|1,0,1]=4 7751 B17R1.39 Cc1ccc(cc1)[C@H](C)OCCCCCCF 93c85501b519834cdbce37fde7724654 [0,2,0,0,0,0|1,0,1]=4 7752 B17R1.39 Cc1ccc(cn1)C(=O)NCCCCCCCl 70ecb95cac65577fc735648f02a60541 [0,2,0,0,0,0|2,0,0]=4 7753 B17R1.39 Cc1ccc(cn1)C(=O)NCCCCCCO 7cef9c982b33b9772a050a1f32bed179 [0,2,0,0,0,0|2,0,0]=4 7754 B17R1.39 Cc1ccc(nc1)C(=O)NCCCCCCCl 3e7c3912562b6a3087ebd61d5224f802 [0,2,0,0,0,0|2,0,0]=4 7755 B17R1.39 Cc1ccc(nc1)C(=O)NCCCCCCO 805b579f42bdba27cec90bfa835e4e56 [0,2,0,0,0,0|2,0,0]=4 7756 B17R1.39 N#CCCCCCNC(=O)c1ccc(cc1)Br b5baadf8fd1a63065559baec5b9bd4ed [0,2,0,0,0,0|1,0,1]=4 7757 B17R1.39 N#CCCCCCNC(=O)c1ccc(cc1)Cl b891d74e603e59583451947a8c8e8ef6 [0,2,0,0,0,0|1,0,1]=4 7758 B17R1.39 N#CCCCCCNC(=O)c1ccc(cc1)F b0d6b1ab8280b6c1d9c7215e6911e73f [0,2,0,0,0,0|1,0,1]=4 7759 B17R1.39 N#CCCCCCNC(=O)c1ccc(cc1)I d9f4eade9f97ae3473a873f408c93156 [0,2,0,0,0,0|1,0,1]=4 7760 B17R1.39 N#CCCCCCNC(=O)c1ccc(cc1)O da1bb99edae8852088eb372cfb26ec18 [0,2,0,0,0,0|1,0,1]=4 7761 B17R1.39 N#CCCCCCNC(=O)c1ccc(cc1)S 9b126fff77ae37dab6e391874409243b [0,2,0,0,0,0|1,0,1]=4 7762 B17R1.39 N#CCCCCOCC(=O)c1ccc(cc1)Br f122f74512d2fd97f3c5893bccb4957e [0,2,0,0,0,0|1,0,1]=4 7763 B17R1.39 N#CCCCCOCC(=O)c1ccc(cc1)Cl 0a7cc4ab6824f431dbb05bbdde399304 [0,2,0,0,0,0|1,0,1]=4 7764 B17R1.39 N#CCCCCOCC(=O)c1ccc(cc1)F 1716a2bd597cbc12b4e3858a7bd8f7d6 [0,2,0,0,0,0|1,0,1]=4 7765 B17R1.39 N#CCCCCOCC(=O)c1ccc(cc1)I bdd098d0a7ba88a3a00cc9932a328f83 [0,2,0,0,0,0|1,0,1]=4 7766 B17R1.39 N#CCCCNCOC(=O)c1ccc(cc1)F f42dae2ab09bb542636c122ed7b2b8bb [0,2,0,0,0,0|1,0,1]=4 7767 B17R1.39 N#CCCCOCOC(=O)c1ccc(cc1)F 83911b5d1087e8dacebf00c0d81a9bb0 [0,2,0,0,0,0|1,0,1]=4 7768 B17R1.39 O=C(CCCCNCCBr)c1ccc(cc1)F 3066b8a2f32291ce4ee57fb40f247660 [0,2,0,0,0,0|2,0,0]=4 7769 B17R1.39 O=C(CCCCNCCF)c1ccc(cc1)F d156c142bb84373d152d4b713b1330e1 [0,2,0,0,0,0|2,0,0]=4 7770 B17R1.39 O=C(CCCCNCCI)c1ccc(cc1)F 04dc5faeea6e902e1d2263055d629000 [0,2,0,0,0,0|2,0,0]=4 7771 B17R1.39 O=C(CCCCNCCO)c1ccc(cc1)F cc3de784ae09b290adb525a66fb2330e [0,2,0,0,0,0|2,0,0]=4 7772 B17R1.39 O=C(CCCCNCCS)c1ccc(cc1)F 7f7fb4ae73b6d6c6012ac77cc1635b0f [0,2,0,0,0,0|2,0,0]=4 7773 B17R1.39 O=C(CCCCOCCS)c1ccc(cc1)F 3177a70769a89f380fc29089585ffa2a [0,2,0,0,0,0|2,0,0]=4 7774 B17R1.39 O=C(CCCNCCCCl)c1ccc(cc1)Cl ca2d123fa515097dc051324d9a01cc24 [0,2,0,0,0,0|2,0,0]=4 7775 B17R1.39 O=C(CCCNCCCCl)c1ccc(cc1)F b611b31ec5bf08bd2e887ac317ba05f8 [0,2,0,0,0,0|2,0,0]=4 7776 B17R1.39 O=C(CCCNCCCO)c1ccc(cc1)Cl 5c56e25408d46a6273a29741a5b88050 [0,2,0,0,0,0|2,0,0]=4 7777 B17R1.39 O=C(CCCNCCCO)c1ccc(cc1)F 76860aa0a138913d39e076511c962fdd [0,2,0,0,0,0|2,0,0]=4 7778 B17R1.39 O=C(CCCOCCCF)c1ccc(cc1)Cl 9a5b79dab714b7f23e478fa1acbbab77 [0,2,0,0,0,0|2,0,0]=4 7779 B17R1.39 O=C(CCCOCCCF)c1ccc(cc1)F b4fdb75b78fa4e94e75f87ea6bbe3959 [0,2,0,0,0,0|2,0,0]=4 7780 B17R1.39 O=C(CCCOCCCS)c1ccc(cc1)F d698a83cf559c6003d09989bc072182b [0,2,0,0,0,0|2,0,0]=4 7781 B17R1.39 O=C(CCNCCCCCl)c1ccc(cc1)Br c6c995803fac26de9c04e49aac089f22 [0,2,0,0,0,0|2,0,0]=4 7782 B17R1.39 O=C(CCNCCCCCl)c1ccc(cc1)F d174ece4cd5dc7df705c829c5c7c4b59 [0,2,0,0,0,0|2,0,0]=4 7783 B17R1.39 O=C(CCNCCCCO)c1ccc(cc1)Br 2c71671795b98b0a7d56381f06f7ff0c [0,2,0,0,0,0|2,0,0]=4 7784 B17R1.39 O=C(CCNCCCCO)c1ccc(cc1)F 08b51fe72975999c9ef222ed49d6be1d [0,2,0,0,0,0|2,0,0]=4 7785 B17R1.39 O=C(CCNCCCCS)c1ccc(cc1)Br f7af66f6918a67196e86fe31272d93fd [0,2,0,0,0,0|2,0,0]=4 7786 B17R1.39 O=C(CCNCCCCS)c1ccc(cc1)F 25ba0976607e66dab884d5e1ee5ea460 [0,2,0,0,0,0|2,0,0]=4 7787 B17R1.39 O=C(CCOCCCCF)c1ccc(cc1)Br c4b50e4dd258c7cb74ab8b976d8fc1f9 [0,2,0,0,0,0|2,0,0]=4 7788 B17R1.39 O=C(CCOCCCCF)c1ccc(cc1)Cl 8e64a5d0e06d824b020dbd1628b9ddb3 [0,2,0,0,0,0|2,0,0]=4 7789 B17R1.39 O=C(CCOCCCCF)c1ccc(cc1)F 8ed0be158793a94e33f2d27fb984d306 [0,2,0,0,0,0|2,0,0]=4 7790 B17R1.39 O=C(CCOCCCCS)c1ccc(cc1)Br c3caae8768a8102a9d35fe8995c592a9 [0,2,0,0,0,0|2,0,0]=4 7791 B17R1.39 O=C(CCOCCCCS)c1ccc(cc1)F 8dd8ebf69cb69c90dd6019ea15fddf44 [0,2,0,0,0,0|2,0,0]=4 7792 B17R1.39 O=C(CNCCCCCCl)c1ccc(cc1)Br cc76e8b604cc0ceeb19b269621fee473 [0,2,0,0,0,0|2,0,0]=4 7793 B17R1.39 O=C(CNCCCCCCl)c1ccc(cc1)Cl 5e9a96c1da426daef2bbf6abafeedb67 [0,2,0,0,0,0|2,0,0]=4 7794 B17R1.39 O=C(CNCCCCCCl)c1ccc(cc1)F 308817a37db204bb895f6593153c0a3d [0,2,0,0,0,0|2,0,0]=4 7795 B17R1.39 O=C(CNCCCCCCl)c1ccc(cc1)I ac85d2fa199ef95eafaf185440cf55e8 [0,2,0,0,0,0|2,0,0]=4 7796 B17R1.39 O=C(CNCCCCCF)c1ccc(cc1)Br 2789801716e1fe97afd3d39e1ab99b95 [0,2,0,0,0,0|2,0,0]=4 7797 B17R1.39 O=C(CNCCCCCF)c1ccc(cc1)Cl 9890287025ceb7188e64cf2ac16ae9b9 [0,2,0,0,0,0|2,0,0]=4 7798 B17R1.39 O=C(CNCCCCCO)c1ccc(cc1)Br c8b142ff5773d9b937f1820baff00290 [0,2,0,0,0,0|2,0,0]=4 7799 B17R1.39 O=C(CNCCCCCO)c1ccc(cc1)Cl 9943c1d7f64e3cee7f78bfa930bd6681 [0,2,0,0,0,0|2,0,0]=4 7800 B17R1.39 O=C(CNCCCCCO)c1ccc(cc1)F 55569c813ed23f41de7ad80474438e92 [0,2,0,0,0,0|2,0,0]=4 7801 B17R1.39 O=C(CNCCCCCO)c1ccc(cc1)I b441249aa0157d1d69b6616a96186db5 [0,2,0,0,0,0|2,0,0]=4 7802 B17R1.39 O=C(COCCCCCF)c1ccc(cc1)Br 1bdb80e1230efa315906f05540a3ad16 [0,2,0,0,0,0|1,0,0]=3 7803 B17R1.39 O=C(COCCCCCF)c1ccc(cc1)Cl 453e821b93c241d4ab5583bec987a0de [0,2,0,0,0,0|1,0,0]=3 7804 B17R1.39 O=C(COCCCCCF)c1ccc(cc1)F a70ac5b0b9dacea162b61070848b79b3 [0,2,0,0,0,0|1,0,0]=3 7805 B17R1.39 O=C(COCCCCCF)c1ccc(cc1)I f154e2694bab6995b9138612dc88374b [0,2,0,0,0,0|1,0,0]=3 7806 B17R1.39 O=C(COCCOCCF)c1ccc(cc1)Br 661e938e47ede84f3327dbe2243bc4a5 [0,2,0,0,0,0|2,0,0]=4 7807 B17R1.39 O=C(COCCOCCF)c1ccc(cc1)Cl 090170ddcfc3c4e4ac01f227ba0abe5d [0,2,0,0,0,0|2,0,0]=4 7808 B17R1.39 O=C(COCCOCCF)c1ccc(cc1)F aeab343e0c47f5266fbb440257ad6e74 [0,2,0,0,0,0|2,0,0]=4 7809 B17R1.39 O=C(COCCOCCF)c1ccc(cc1)I f5eb39b09b9227299a64518791ce427d [0,2,0,0,0,0|2,0,0]=4 7810 B17R1.39 O=C(COCCOCCS)c1ccc(cc1)Br 749cc03ca82a738d63af878138f0e2c4 [0,2,0,0,0,0|2,0,0]=4 7811 B17R1.39 O=C(COCCOCCS)c1ccc(cc1)Cl bafabbef6cdbe8ed7ccb749f9a6e6680 [0,2,0,0,0,0|2,0,0]=4 7812 B17R1.39 O=C(COCCOCCS)c1ccc(cc1)F 8b551430c7cee44276f25313d93b3b78 [0,2,0,0,0,0|2,0,0]=4 7813 B17R1.39 O=C(COCCOCCS)c1ccc(cc1)I 71a215e6f46f157d498c87119f7cadf2 [0,2,0,0,0,0|2,0,0]=4 7814 B17R1.39 O=C(NCCCCCCCl)c1cc[n+](cc1)[O-] 7133adb70c90d64f25f2a9f5a6e21360 [0,2,0,0,0,0|2,0,0]=4 7815 B17R1.39 O=C(NCCCCCCCl)c1ccc(=O)oc1 64599fd09a4d57f9147c54c666f5fd1d [0,2,0,0,0,0|2,0,0]=4 7816 B17R1.39 O=C(NCCCCCCCl)c1ccc(cc1)Br 915b9c7dcbcae9043ba3398c719151d7 [0,2,0,0,0,0|1,0,0]=3 7817 B17R1.39 O=C(NCCCCCCCl)c1ccc(cc1)Cl a8d512977e9dbe4feceece498bb61444 [0,2,0,0,0,0|1,0,0]=3 7818 B17R1.39 O=C(NCCCCCCCl)c1ccc(cc1)F f4439acf5644c3073aa966e099fc5805 [0,2,0,0,0,0|1,0,0]=3 7819 B17R1.39 O=C(NCCCCCCCl)c1ccc(cc1)I 504874ade60c7ee9552a6428bddb32d9 [0,2,0,0,0,0|1,0,0]=3 7820 B17R1.39 O=C(NCCCCCCCl)c1ccc(cc1)O 437d6e6b878aaf5d00a300c19200a0e4 [0,2,0,0,0,0|1,0,0]=3 7821 B17R1.39 O=C(NCCCCCCCl)c1ccc(cc1)S 27c508bca94b0240a48301951e7d2e95 [0,2,0,0,0,0|1,0,0]=3 7822 B17R1.39 O=C(NCCCCCCCl)c1ccc(cn1)Br ecf85b2c09a34ef8f27eb232c63dc42c [0,2,0,0,0,0|2,0,0]=4 7823 B17R1.39 O=C(NCCCCCCCl)c1ccc(cn1)Cl 468d68f0c0b65497b532be7f359bc734 [0,2,0,0,0,0|2,0,0]=4 7824 B17R1.39 O=C(NCCCCCCCl)c1ccc(cn1)F 87713042361c7670cb849c46c87aac6a [0,2,0,0,0,0|2,0,0]=4 7825 B17R1.39 O=C(NCCCCCCCl)c1ccc(cn1)I 78905cc852d2b497517e521ba3a9c328 [0,2,0,0,0,0|2,0,0]=4 7826 B17R1.39 O=C(NCCCCCCCl)c1ccc(cn1)O 967e786b0597902d79e7855be6c04618 [0,2,0,0,0,0|2,0,0]=4 7827 B17R1.39 O=C(NCCCCCCCl)c1ccc(nc1)Br 6a16be18b9ee80bc6235765d77303970 [0,2,0,0,0,0|2,0,0]=4 7828 B17R1.39 O=C(NCCCCCCCl)c1ccc(nc1)Cl 10262e2e3f42ccd58d1181e8cbe29b65 [0,2,0,0,0,0|2,0,0]=4 7829 B17R1.39 O=C(NCCCCCCCl)c1ccc(nc1)F 841d45d9c72bcefc382434a3ef2a33ed [0,2,0,0,0,0|2,0,0]=4 7830 B17R1.39 O=C(NCCCCCCCl)c1ccc(nc1)I b7791e90c0d88398c7a6ffad9b0cfd38 [0,2,0,0,0,0|2,0,0]=4 7831 B17R1.39 O=C(NCCCCCCCl)c1ccc(nc1)O 3838a61a1a6889187d32afdb3a5bc33a [0,2,0,0,0,0|2,0,0]=4 7832 B17R1.39 O=C(NCCCCCCCl)c1ccc(nc1)S 244cccf9695be9e3b59220c012811103 [0,2,0,0,0,0|2,0,0]=4 7833 B17R1.39 O=C(NCCCCCCO)c1cc[n+](cc1)[O-] 0b4412f6bdd8402e16dd8775ef894cbc [0,2,0,0,0,0|2,0,0]=4 7834 B17R1.39 O=C(NCCCCCCO)c1ccc(=O)oc1 0305fd276538528768b60ef7157ffd0a [0,2,0,0,0,0|2,0,0]=4 7835 B17R1.39 O=C(NCCCCCCO)c1ccc(cc1)Br 9d9c4f1d1d009abdfab0b77f3ef8774a [0,2,0,0,0,0|1,0,0]=3 7836 B17R1.39 O=C(NCCCCCCO)c1ccc(cc1)Cl db0a492ad1cd81718343b1118a2f1cef [0,2,0,0,0,0|1,0,0]=3 7837 B17R1.39 O=C(NCCCCCCO)c1ccc(cc1)F dba88a3fe41932f67d6acf94b850f969 [0,2,0,0,0,0|1,0,0]=3 7838 B17R1.39 O=C(NCCCCCCO)c1ccc(cc1)I c9919f3f541685a7391dbdb6f9fc58f3 [0,2,0,0,0,0|1,0,0]=3 7839 B17R1.39 O=C(NCCCCCCO)c1ccc(cc1)O 152fd8d22c0c2e4efc4d222e163afdff [0,2,0,0,0,0|1,0,0]=3 7840 B17R1.39 O=C(NCCCCCCO)c1ccc(cc1)S 6f876340cea5aa1ff4d8192a3ebce1b1 [0,2,0,0,0,0|1,0,0]=3 7841 B17R1.39 O=C(NCCCCCCO)c1ccc(cn1)Br 6140d2ffaa818224b628bd0449ca9a06 [0,2,0,0,0,0|2,0,0]=4 7842 B17R1.39 O=C(NCCCCCCO)c1ccc(cn1)Cl 49a32bb20dce66b4faf6044102d8affd [0,2,0,0,0,0|2,0,0]=4 7843 B17R1.39 O=C(NCCCCCCO)c1ccc(cn1)F 1eeec800730850e8583aaa0c12f924ae [0,2,0,0,0,0|2,0,0]=4 7844 B17R1.39 O=C(NCCCCCCO)c1ccc(cn1)I bfd0db9f5552fba1627e2ed8c5874209 [0,2,0,0,0,0|2,0,0]=4 7845 B17R1.39 O=C(NCCCCCCO)c1ccc(cn1)O 9464e5fa9ed4a40198e54b19c6c81f60 [0,2,0,0,0,0|2,0,0]=4 7846 B17R1.39 O=C(NCCCCCCO)c1ccc(nc1)Br 03580664785002a42ea390c3e07d5183 [0,2,0,0,0,0|2,0,0]=4 7847 B17R1.39 O=C(NCCCCCCO)c1ccc(nc1)Cl d08477c133490b310a3be629dca05ed2 [0,2,0,0,0,0|2,0,0]=4 7848 B17R1.39 O=C(NCCCCCCO)c1ccc(nc1)F 07deef78f460ddc07c33d9a1ea389147 [0,2,0,0,0,0|2,0,0]=4 7849 B17R1.39 O=C(NCCCCCCO)c1ccc(nc1)I 0c58a0bcaf84c41454107a8d52365b7c [0,2,0,0,0,0|2,0,0]=4 7850 B17R1.39 O=C(NCCCCCCO)c1ccc(nc1)O c45d687c907568a8196ef86aaf98b993 [0,2,0,0,0,0|2,0,0]=4 7851 B17R1.39 O=C(NCCCCCCO)c1ccc(nc1)S a2c2c843dc857d63cbdc26184f4f5d67 [0,2,0,0,0,0|2,0,0]=4 7852 B17R1.39 O=C(NCCCOCCO)c1ccc(cc1)Br 4a36729d5971125cf80caeef384c4cab [0,2,0,0,0,0|2,0,0]=4 7853 B17R1.39 O=C(NCCCOCCO)c1ccc(cc1)Cl dfc8288551429068c614f4f89f2b3f11 [0,2,0,0,0,0|2,0,0]=4 7854 B17R1.39 O=C(NCCCOCCO)c1ccc(cc1)F a62d221271fc298adc1ff953507254cc [0,2,0,0,0,0|2,0,0]=4 7855 B17R1.39 O=C(NCCCOCCO)c1ccc(cc1)I edc7aaa79d0abc2f833c85103cd9ee70 [0,2,0,0,0,0|2,0,0]=4 7856 B17R1.39 O=C(NCCCOCCO)c1ccc(cc1)O a20d960bcba6af67353118765c3f1a7d [0,2,0,0,0,0|2,0,0]=4 7857 B17R1.39 O=C(NCCCOCCO)c1ccc(cc1)S ea4d030a27ba49ace407a2b15d0c45be [0,2,0,0,0,0|2,0,0]=4 7858 B17R1.39 O=C(NCCOCCCF)c1ccc(cc1)Br 8dcf423b9f1174da815e37c4de8f2605 [0,2,0,0,0,0|2,0,0]=4 7859 B17R1.39 O=C(NCCOCCCO)c1ccc(cc1)Br f3413b4a49c7a8eb3c33819287facb61 [0,2,0,0,0,0|2,0,0]=4 7860 B17R1.39 O=C(NCCOCCCO)c1ccc(cc1)Cl dd8768fcb0e9e1adaf95cf85867e896a [0,2,0,0,0,0|2,0,0]=4 7861 B17R1.39 O=C(NCCOCCCO)c1ccc(cc1)F 7ef3b95c07eddc4c2bf360342a2427e0 [0,2,0,0,0,0|2,0,0]=4 7862 B17R1.39 O=C(NCCOCCCO)c1ccc(cc1)I 59535168bf16f76abab0d037e8115528 [0,2,0,0,0,0|2,0,0]=4 7863 B17R1.39 O=C(NCCOCCCO)c1ccc(cc1)O 194607e2c86f144684adcf08185a3d15 [0,2,0,0,0,0|2,0,0]=4 7864 B17R1.39 O=C(NCCOCCCO)c1ccc(cc1)S ae98f99c4f1708a6c6eccae0c7fb8fca [0,2,0,0,0,0|2,0,0]=4 7865 B17R1.39 O=C(NCCOCCCS)c1ccc(cc1)Br b42414032a0411bfff228869f5a74e60 [0,2,0,0,0,0|2,0,0]=4 7866 B17R1.39 O=C(OCNCCCCCl)c1ccc(cc1)F 0c86934dd94d43b7f4d9f20962d3e626 [0,2,0,0,0,0|1,0,0]=3 7867 B17R1.39 O=C(OCNCCCCO)c1ccc(cc1)F cb260f72b7559a71bbd2b2706c4d4eb8 [0,2,0,0,0,0|1,0,0]=3 7868 B17R1.39 O=C(OCNCCCCS)c1ccc(cc1)F 316c73425a476d97635dc649f225f529 [0,2,0,0,0,0|1,0,0]=3 7869 B17R1.39 O=C(OCOCCCCF)c1ccc(cc1)F bfbaea6d0e5c40214e6d5e6f92a81bef [0,2,0,0,0,0|1,0,0]=3 7870 B17R1.39 O=C(OCOCCCCS)c1ccc(cc1)F 774dd28112a9ec4e4a1d14f2aa572514 [0,2,0,0,0,0|1,0,0]=3 7871 B17R1.39 O=CCCCCOCC(=O)c1ccc(cc1)Br acc37a539846235ada676e83bba7d97f [0,2,0,0,0,0|1,0,1]=4 7872 B17R1.39 O=CCCCCOCC(=O)c1ccc(cc1)Cl 46902f5d5ad294432aa275a25cedc90d [0,2,0,0,0,0|1,0,1]=4 7873 B17R1.39 O=CCCCCOCC(=O)c1ccc(cc1)F 231a6ef01cb6afa4028d6a4deaad95fd [0,2,0,0,0,0|1,0,1]=4 7874 B17R1.39 O=CCCCCOCC(=O)c1ccc(cc1)I 872cd5d373ed4958fed5af40523f572c [0,2,0,0,0,0|1,0,1]=4 7875 B17R1.39 O=CCCCOCOC(=O)c1ccc(cc1)F 48aa4292809ceb3264b1ff6f1ff27b5e [0,2,0,0,0,0|1,0,1]=4 7876 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)Br 3eac4f87b6101f15750c04e00836efa4 [0,2,0,0,0,0|1,0,1]=4 7877 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)C ed16131172526bbd77048beb0d5579f9 [0,2,0,0,0,0|1,0,1]=4 7878 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)Cl 68aa60f1687b8599d90ebd4356c85747 [0,2,0,0,0,0|1,0,1]=4 7879 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)F 1af1a395eb3f37dfbb219f7bfc987c19 [0,2,0,0,0,0|1,0,1]=4 7880 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)I 5ee05895cc74115f4481e6e582d5eb65 [0,2,0,0,0,0|1,0,1]=4 7881 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)O c7bc58b38f0abc6d34a349d15301aa77 [0,2,0,0,0,0|1,0,1]=4 7882 B17R1.40 C#CCCCCCNC(=O)c1cccc(c1)S 934ae3390027af2de186913e360bc9a0 [0,2,0,0,0,0|1,0,1]=4 7883 B17R1.40 C#CCCCCOCC(=O)c1cccc(c1)Br cf7fb6fd13558cf7202dd8cbf3f809b4 [0,2,0,0,0,0|0,0,2]=4 7884 B17R1.40 C#CCCCCOCC(=O)c1cccc(c1)C b5d18fb016f6afef977c7568cf330c72 [0,2,0,0,0,0|0,0,2]=4 7885 B17R1.40 C#CCCCCOCC(=O)c1cccc(c1)Cl a2b10d2b059f95511a98057a96fa8f25 [0,2,0,0,0,0|0,0,2]=4 7886 B17R1.40 C#CCCCCOCC(=O)c1cccc(c1)F 919c6224033a61db0a0fdbb11aec7c75 [0,2,0,0,0,0|0,0,2]=4 7887 B17R1.40 C#CCCCCOCC(=O)c1cccc(c1)I 7d629cb248674e5b96173ecd993a1827 [0,2,0,0,0,0|0,0,2]=4 7888 B17R1.40 C/C=C/CCCOCC(=O)c1cccc(c1)Br c7b2c131bc28e5693875f5a0a3632739 [0,2,0,0,0,0|0,0,2]=4 7889 B17R1.40 C/C=C/CCCOCC(=O)c1cccc(c1)C 87a4911b924fad892dcf854d544ddee2 [0,2,0,0,0,0|0,0,2]=4 7890 B17R1.40 C/C=C/CCCOCC(=O)c1cccc(c1)Cl ee0fec84b60795ba4e78582b302e7ddf [0,2,0,0,0,0|0,0,2]=4 7891 B17R1.40 C/C=C/CCCOCC(=O)c1cccc(c1)F e5599c9fde7bc81fbc4fa58054e36f4e [0,2,0,0,0,0|0,0,2]=4 7892 B17R1.40 C/C=C/CCCOCC(=O)c1cccc(c1)I 2502c4a8e2a16ef1bea56d9f65d9ad09 [0,2,0,0,0,0|0,0,2]=4 7893 B17R1.40 C/C=C\CCCOCC(=O)c1cccc(c1)Br f5835977e62018f73775b3cb93c921b2 [0,2,0,0,0,0|0,0,2]=4 7894 B17R1.40 C/C=C\CCCOCC(=O)c1cccc(c1)C f997919b8cb04206a4c2b5f0f6bfbc48 [0,2,0,0,0,0|0,0,2]=4 7895 B17R1.40 C/C=C\CCCOCC(=O)c1cccc(c1)Cl 5f66a9acd7dccd15d679f517f928cc17 [0,2,0,0,0,0|0,0,2]=4 7896 B17R1.40 C/C=C\CCCOCC(=O)c1cccc(c1)F effbcf75cda8261d4f172951ae5b22ff [0,2,0,0,0,0|0,0,2]=4 7897 B17R1.40 C/C=C\CCCOCC(=O)c1cccc(c1)I 8814470a23c9f494c24febaa9de61ad0 [0,2,0,0,0,0|0,0,2]=4 7898 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)Br 801779cb997c77b47e95f28bc1b27355 [0,2,0,0,0,0|1,0,1]=4 7899 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)C 7acb14a612f6b776c6311cec68ae30e6 [0,2,0,0,0,0|1,0,1]=4 7900 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)Cl 5a8e2dca4dd9ce885e4111ce28752318 [0,2,0,0,0,0|1,0,1]=4 7901 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)F 11ed076b0d46cf86d2e3a83e90ab777f [0,2,0,0,0,0|1,0,1]=4 7902 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)I 46204fc425cc796665a0ee13fb101756 [0,2,0,0,0,0|1,0,1]=4 7903 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)O 77b8216dbf7446cd67b08dc58c981b85 [0,2,0,0,0,0|1,0,1]=4 7904 B17R1.40 C=CCCCCCNC(=O)c1cccc(c1)S 5997401f2a7324a8c87e250a07080759 [0,2,0,0,0,0|1,0,1]=4 7905 B17R1.40 C=CCCCCOCC(=O)c1cccc(c1)Br 95a8abba70ca45e7685aa8e7462f4052 [0,2,0,0,0,0|0,0,2]=4 7906 B17R1.40 C=CCCCCOCC(=O)c1cccc(c1)C b5f3e05c51fe20dc6ac91adbdedaf864 [0,2,0,0,0,0|0,0,2]=4 7907 B17R1.40 C=CCCCCOCC(=O)c1cccc(c1)Cl 584090e522f913f73e6bb9041a1908a4 [0,2,0,0,0,0|0,0,2]=4 7908 B17R1.40 C=CCCCCOCC(=O)c1cccc(c1)F 934fbed68e3ea10c5d2d6817ea1cb96c [0,2,0,0,0,0|0,0,2]=4 7909 B17R1.40 C=CCCCCOCC(=O)c1cccc(c1)I 3f9351b028022540062b08241bc81eaa [0,2,0,0,0,0|0,0,2]=4 7910 B17R1.40 CC#CCCCOCC(=O)c1cccc(c1)Br 070ff9ea08d699ec1926b8908fa828f2 [0,2,0,0,0,0|0,0,2]=4 7911 B17R1.40 CC#CCCCOCC(=O)c1cccc(c1)C 1e6b3c63a6f4ead896b93a2368ddd309 [0,2,0,0,0,0|0,0,2]=4 7912 B17R1.40 CC#CCCCOCC(=O)c1cccc(c1)Cl 9de641b4173abe43f3911361f7108dcc [0,2,0,0,0,0|0,0,2]=4 7913 B17R1.40 CC#CCCCOCC(=O)c1cccc(c1)F bd029492d7ce8ba71d6300af3b7f4be3 [0,2,0,0,0,0|0,0,2]=4 7914 B17R1.40 CC#CCCCOCC(=O)c1cccc(c1)I bb62d6dd41a629a134e149c39c0bdd13 [0,2,0,0,0,0|0,0,2]=4 7915 B17R1.40 CC(OCCCCCCF)c1cccc(c1)Br 7b040051f5056f2ac03a2e70ca18b8b9 [0,2,0,0,0,0|1,0,1]=4 7916 B17R1.40 CC(OCCCCCCF)c1cccc(c1)Cl 18521da154f8f832e8e4dd2bda046f9e [0,2,0,0,0,0|1,0,1]=4 7917 B17R1.40 CC(OCCCCCCF)c1cccc(c1)F d32b20228ee44c1a0c44b288b9d33686 [0,2,0,0,0,0|1,0,1]=4 7918 B17R1.40 CC(OCCCCCCF)c1cccc(c1)I dd24659752c4f7c66ea5be8b6c25e01d [0,2,0,0,0,0|1,0,1]=4 7919 B17R1.40 CC(OCCCCCCS)c1cccc(c1)Br f6fa614420a94744a025baed3993b06b [0,2,0,0,0,0|1,0,1]=4 7920 B17R1.40 CC(OCCCCCCS)c1cccc(c1)Cl 9cea4e6b9d33323c41acb20341c314ee [0,2,0,0,0,0|1,0,1]=4 7921 B17R1.40 CC(OCCCCCCS)c1cccc(c1)F fdd00f23b247a4e4f5048cc30166b842 [0,2,0,0,0,0|1,0,1]=4 7922 B17R1.40 CC/C=C/CCOCC(=O)c1cccc(c1)Br 3b1ad98ab8d8de2bc3dc73abccbde2e1 [0,2,0,0,0,0|0,0,2]=4 7923 B17R1.40 CC/C=C/CCOCC(=O)c1cccc(c1)C b858c29e0cc9f91ac588f357402644e6 [0,2,0,0,0,0|0,0,2]=4 7924 B17R1.40 CC/C=C/CCOCC(=O)c1cccc(c1)Cl 986f8352901771e22ba88266f8da9ff1 [0,2,0,0,0,0|0,0,2]=4 7925 B17R1.40 CC/C=C/CCOCC(=O)c1cccc(c1)F 6f4f74a0ef6795ad2de4f8887896ab62 [0,2,0,0,0,0|0,0,2]=4 7926 B17R1.40 CC/C=C/CCOCC(=O)c1cccc(c1)I 4b618f1f9bb41d1b32368935564305ad [0,2,0,0,0,0|0,0,2]=4 7927 B17R1.40 CC/C=C\CCOCC(=O)c1cccc(c1)Br 8582559e75a438d316f456fe652dd230 [0,2,0,0,0,0|0,0,2]=4 7928 B17R1.40 CC/C=C\CCOCC(=O)c1cccc(c1)C 35a3a71fa10106ea9434f776983ccaf0 [0,2,0,0,0,0|0,0,2]=4 7929 B17R1.40 CC/C=C\CCOCC(=O)c1cccc(c1)Cl 04371a92abd23608002557588c34e28b [0,2,0,0,0,0|0,0,2]=4 7930 B17R1.40 CC/C=C\CCOCC(=O)c1cccc(c1)F 4be57331c48ee39eb1f95ece43619f2c [0,2,0,0,0,0|0,0,2]=4 7931 B17R1.40 CC/C=C\CCOCC(=O)c1cccc(c1)I 0fd898d6d1ef4470b77d91d3840d0c33 [0,2,0,0,0,0|0,0,2]=4 7932 B17R1.40 CC=CCCCOCC(=O)c1cccc(c1)Br d75b943947a4aec93b88ee016434f0b1 [0,2,0,0,0,0|0,0,2]=4 7933 B17R1.40 CC=CCCCOCC(=O)c1cccc(c1)C d23e789e125d9a5f493c75b2790baa01 [0,2,0,0,0,0|0,0,2]=4 7934 B17R1.40 CC=CCCCOCC(=O)c1cccc(c1)Cl 339146187332c93bc060a6d7977b6d7b [0,2,0,0,0,0|0,0,2]=4 7935 B17R1.40 CC=CCCCOCC(=O)c1cccc(c1)F efbb66c1e84b20fbd4d192abcf7e930a [0,2,0,0,0,0|0,0,2]=4 7936 B17R1.40 CC=CCCCOCC(=O)c1cccc(c1)I acfac7504e8d70665daed66e8380b949 [0,2,0,0,0,0|0,0,2]=4 7937 B17R1.40 CCC#CCCOCC(=O)c1cccc(c1)C f728f8c6e9bbe828c1b48a1b6556d208 [0,2,0,0,0,0|0,0,2]=4 7938 B17R1.40 CCC#CCCOCC(=O)c1cccc(c1)Cl 4f2bdce5323627d05df3e53684e780fa [0,2,0,0,0,0|0,0,2]=4 7939 B17R1.40 CCC#CCCOCC(=O)c1cccc(c1)F 25b84bb104657596ae2f5e151792460d [0,2,0,0,0,0|0,0,2]=4 7940 B17R1.40 CCC#CCCOCC(=O)c1cccc(c1)I ec6fcddc6d6eef5485263bfa7399df51 [0,2,0,0,0,0|0,0,2]=4 7941 B17R1.40 CCC/C=C/COCC(=O)c1cccc(c1)Br 8c11f06e1d56f9b1ed33d4d7e0d61578 [0,2,0,0,0,0|0,0,2]=4 7942 B17R1.40 CCC/C=C/COCC(=O)c1cccc(c1)C 133c0c08fad281792e63f00a298667fe [0,2,0,0,0,0|0,0,2]=4 7943 B17R1.40 CCC/C=C/COCC(=O)c1cccc(c1)Cl 5d1bee51fda3f91893cb2941bc86f067 [0,2,0,0,0,0|0,0,2]=4 7944 B17R1.40 CCC/C=C/COCC(=O)c1cccc(c1)F 81cfda91477ff6e489a194792e49ca6b [0,2,0,0,0,0|0,0,2]=4 7945 B17R1.40 CCC/C=C/COCC(=O)c1cccc(c1)I 3fcea7f636e011a3278dc0848d9c0c4c [0,2,0,0,0,0|0,0,2]=4 7946 B17R1.40 CCC/C=C\COCC(=O)c1cccc(c1)Br 97ce62c1ef69b49d882b0a0a8a91242e [0,2,0,0,0,0|0,0,2]=4 7947 B17R1.40 CCC/C=C\COCC(=O)c1cccc(c1)C ab4e9231c63fa5357a335480d1dc5eb7 [0,2,0,0,0,0|0,0,2]=4 7948 B17R1.40 CCC/C=C\COCC(=O)c1cccc(c1)Cl cf47f47cc80fb9faad9318a3c2062304 [0,2,0,0,0,0|0,0,2]=4 7949 B17R1.40 CCC/C=C\COCC(=O)c1cccc(c1)F 991852283e4eb676d1cce0d24192214c [0,2,0,0,0,0|0,0,2]=4 7950 B17R1.40 CCC/C=C\COCC(=O)c1cccc(c1)I d9fd3d2533cac8995aa753d33d64eb94 [0,2,0,0,0,0|0,0,2]=4 7951 B17R1.40 CCCC#CCOCC(=O)c1cccc(c1)C 9f83516ad551effb6082a601a82bf51d [0,2,0,0,0,0|0,0,2]=4 7952 B17R1.40 CCCC#CCOCC(=O)c1cccc(c1)Cl a68c37924156240b4ce87ccde9bc0946 [0,2,0,0,0,0|0,0,2]=4 7953 B17R1.40 CCCC#CCOCC(=O)c1cccc(c1)F a0723c651effa8124bcac9b282650f18 [0,2,0,0,0,0|0,0,2]=4 7954 B17R1.40 CCCC#CCOCC(=O)c1cccc(c1)I 8bef3a6af7025f16c079cb2fc4e65a7f [0,2,0,0,0,0|0,0,2]=4 7955 B17R1.40 CCCCCCCNC(=O)c1cc(=O)cco1 1008597c66ab36ffd8d44008c468cbac [0,2,0,0,0,0|2,0,0]=4 7956 B17R1.40 CCCCCCCNC(=O)c1cc(ccn1)Br 0ccf64352ac368aaff6a07a348a5152d [0,2,0,0,0,0|2,0,0]=4 7957 B17R1.40 CCCCCCCNC(=O)c1cc(ccn1)C 900d0c3f93419553bd91cd1cedc4e4e0 [0,2,0,0,0,0|2,0,0]=4 7958 B17R1.40 CCCCCCCNC(=O)c1cc(ccn1)Cl fc315c00fa431bfd5b8de5ff8e61db97 [0,2,0,0,0,0|2,0,0]=4 7959 B17R1.40 CCCCCCCNC(=O)c1cc(ccn1)F 911e286f2574a30c17ef3c6685a85c29 [0,2,0,0,0,0|2,0,0]=4 7960 B17R1.40 CCCCCCCNC(=O)c1cc(ccn1)I 712c86f2491aeff16cb7d41ad5fb0920 [0,2,0,0,0,0|2,0,0]=4 7961 B17R1.40 CCCCCCCNC(=O)c1cc(ccn1)O 60c6d6c9d724a11c1388d0cae87bc537 [0,2,0,0,0,0|2,0,0]=4 7962 B17R1.40 CCCCCCCNC(=O)c1ccc[n+](c1)[O-] 7773a2b3a463cec44b4a9d13b64068db [0,2,0,0,0,0|2,0,0]=4 7963 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)Br 277eeb66dc35a8e162f4b575292b3061 [0,2,0,0,0,0|1,0,0]=3 7964 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)C 04377afcf6a3f58d8e1e2ce5b7c4d7e8 [0,2,0,0,0,0|1,0,0]=3 7965 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)Cl d312c05bba92a34f6aa70f4fabce8b5a [0,2,0,0,0,0|1,0,0]=3 7966 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)F bea5e799e51f4554329071303e2e9e0b [0,2,0,0,0,0|1,0,0]=3 7967 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)I dce5a757c7d2a9103b5c054761ef84dc [0,2,0,0,0,0|1,0,0]=3 7968 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)O 3d024371b3a19edd82f1b929fb79957c [0,2,0,0,0,0|1,0,0]=3 7969 B17R1.40 CCCCCCCNC(=O)c1cccc(c1)S 841bb9b5e3ae81053f3062d65ae6c576 [0,2,0,0,0,0|1,0,0]=3 7970 B17R1.40 CCCCCCCNC(=O)c1cccc(n1)Br 40241c45514d2c489795295984bb8b45 [0,2,0,0,0,0|2,0,0]=4 7971 B17R1.40 CCCCCCCNC(=O)c1cccc(n1)C 7f8cb6e3a0bcc583eae2e4f62bc77b39 [0,2,0,0,0,0|2,0,0]=4 7972 B17R1.40 CCCCCCCNC(=O)c1cccc(n1)Cl e4c59d366ee957a5e495caf4c89ce379 [0,2,0,0,0,0|2,0,0]=4 7973 B17R1.40 CCCCCCCNC(=O)c1cccc(n1)F 5eb0a958fae51277ae86907715d0aac9 [0,2,0,0,0,0|2,0,0]=4 7974 B17R1.40 CCCCCCCNC(=O)c1cccc(n1)I 35956d43fcee492d30d8dae403ab928c [0,2,0,0,0,0|2,0,0]=4 7975 B17R1.40 CCCCCCCNC(=O)c1cccc(n1)O fe04f5d92524409c4f80a423e6066625 [0,2,0,0,0,0|2,0,0]=4 7976 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)Br f447a5b99281d2fe4fda0e3685da2925 [0,2,0,0,0,0|2,0,0]=4 7977 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)C f6e3c8543b9d92e6d9ae32a76d5c7b4b [0,2,0,0,0,0|2,0,0]=4 7978 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)Cl 406394656c26bdaea74bd5cd3694aa10 [0,2,0,0,0,0|2,0,0]=4 7979 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)F 59a1f9ce11ccfb39c0bff9607cd8cf91 [0,2,0,0,0,0|2,0,0]=4 7980 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)I c2c8ec6f3d5c756362b32626b9037404 [0,2,0,0,0,0|2,0,0]=4 7981 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)O 3d3ca95bd7c5c03d5f3a37dff6ee12c1 [0,2,0,0,0,0|2,0,0]=4 7982 B17R1.40 CCCCCCCNC(=O)c1ccnc(c1)S 7e4af011bad8f241b453cbe6151a87aa [0,2,0,0,0,0|2,0,0]=4 7983 B17R1.40 CCCCCCCNC(=O)c1cncc(c1)Br 12a6212dcd21a970f135fe4f2898f1e7 [0,2,0,0,0,0|2,0,0]=4 7984 B17R1.40 CCCCCCCNC(=O)c1cncc(c1)C 2347c20a925f423c19905e787c5b2fd3 [0,2,0,0,0,0|2,0,0]=4 7985 B17R1.40 CCCCCCCNC(=O)c1cncc(c1)Cl 3b1282341508944be02c13efb3c8335c [0,2,0,0,0,0|2,0,0]=4 7986 B17R1.40 CCCCCCCNC(=O)c1cncc(c1)F 91aab3510228f8ae370fa3dbbd714e58 [0,2,0,0,0,0|2,0,0]=4 7987 B17R1.40 CCCCCCCNC(=O)c1cncc(c1)I 44b156e1f76e9e6f636d383ac4e69f95 [0,2,0,0,0,0|2,0,0]=4 7988 B17R1.40 CCCCCCCNC(=O)c1cncc(c1)O 71053d8dfda5960c402ae29abb8a991e [0,2,0,0,0,0|2,0,0]=4 7989 B17R1.40 CCCCCCCOC(C)c1cccc(c1)Br d9aa79bd5e23bba4909562059f849ebd [0,2,0,0,0,0|1,0,1]=4 7990 B17R1.40 CCCCCCCOC(C)c1cccc(c1)C e5d619c3b318e4f5c1f909163cfce2ed [0,2,0,0,0,0|1,0,1]=4 7991 B17R1.40 CCCCCCCOC(C)c1cccc(c1)Cl 183c58e23e6c36a59b736f8948c8988f [0,2,0,0,0,0|1,0,1]=4 7992 B17R1.40 CCCCCCCOC(C)c1cccc(c1)F 4c37f16e684e87b2485deb4c4605c86f [0,2,0,0,0,0|1,0,1]=4 7993 B17R1.40 CCCCCCCOC(C)c1cccc(c1)I d29f51edbc9577fedb6ebcfd4eb987e2 [0,2,0,0,0,0|1,0,1]=4 7994 B17R1.40 CCCCCCCO[C@@H](C)c1cccc(c1)Br ab75c2c3abd90117fd10f22bdfd697d3 [0,2,0,0,0,0|1,0,1]=4 7995 B17R1.40 CCCCCCCO[C@@H](C)c1cccc(c1)C 8902d8158bdf3900719d394e471094e6 [0,2,0,0,0,0|1,0,1]=4 7996 B17R1.40 CCCCCCCO[C@@H](C)c1cccc(c1)Cl 1fb3e47bac6c623ae952a78c797f9fcf [0,2,0,0,0,0|1,0,1]=4 7997 B17R1.40 CCCCCCCO[C@@H](C)c1cccc(c1)F cb9bd9b14c8fc64af9e24f2c3de6510d [0,2,0,0,0,0|1,0,1]=4 7998 B17R1.40 CCCCCCCO[C@H](C)c1cccc(c1)Br f27649802488608adff62cb4259e8b08 [0,2,0,0,0,0|1,0,1]=4 7999 B17R1.40 CCCCCCCO[C@H](C)c1cccc(c1)C ffb02a8288169a2a461c2ea9f7e4cadf [0,2,0,0,0,0|1,0,1]=4 8000 B17R1.40 CCCCCCCO[C@H](C)c1cccc(c1)Cl 0262747077b63a69b5abd13f9cefdcb6 [0,2,0,0,0,0|1,0,1]=4 8001 B17R1.40 CCCCCCCO[C@H](C)c1cccc(c1)F 0453ac9859d77a4976cb05b96da673b5 [0,2,0,0,0,0|1,0,1]=4 8002 B17R1.40 CCCCCCNCC(=O)c1cc(ccn1)Cl f9467c25054497f89f9c6089d8e946f2 [0,2,0,0,0,0|2,0,0]=4 8003 B17R1.40 CCCCCCNCC(=O)c1cccc(c1)Br 27dfce5f3473cfe991c2940b3f15f5fe [0,2,0,0,0,0|1,0,0]=3 8004 B17R1.40 CCCCCCNCC(=O)c1cccc(c1)C 9c0bbad5f96ce4a7bd191d01c58265b2 [0,2,0,0,0,0|1,0,0]=3 8005 B17R1.40 CCCCCCNCC(=O)c1cccc(c1)Cl 6cf70b3966a4e3a274a9fcaae4dda335 [0,2,0,0,0,0|1,0,0]=3 8006 B17R1.40 CCCCCCNCC(=O)c1cccc(c1)F 2b3d96d89a8be7adc92fa93d8c21567f [0,2,0,0,0,0|1,0,0]=3 8007 B17R1.40 CCCCCCNCC(=O)c1cccc(c1)I 61f07fff00093c3d4bd14206627bae55 [0,2,0,0,0,0|1,0,0]=3 8008 B17R1.40 CCCCCCNCC(=O)c1cccc(n1)Br 25eb56a0500c08e1a012f8bb041c5744 [0,2,0,0,0,0|2,0,0]=4 8009 B17R1.40 CCCCCCNCC(=O)c1cccc(n1)C 505335baf6086b1b9dd7e1b44a0f65af [0,2,0,0,0,0|2,0,0]=4 8010 B17R1.40 CCCCCCNCC(=O)c1ccnc(c1)Cl f5efe7dbc8c7a8c983392e9f9bc82f6c [0,2,0,0,0,0|2,0,0]=4 8011 B17R1.40 CCCCCCNCC(=O)c1ccnc(c1)F 2b57c3fba103de4445c4038790f8d284 [0,2,0,0,0,0|2,0,0]=4 8012 B17R1.40 CCCCCCOCC(=O)c1cc(ccn1)Cl fdde2e37b04d995f2450ddea3e7ff482 [0,2,0,0,0,0|1,0,0]=3 8013 B17R1.40 CCCCCCOCC(=O)c1cccc(c1)Br 884a7dcba5b6279c583fcf98fe615926 [0,2,0,0,0,0|0,0,0]=2 8014 B17R1.40 CCCCCCOCC(=O)c1cccc(c1)C 863de790848673c56d5699d39ae0f8be [0,2,0,0,0,0|0,0,0]=2 8015 B17R1.40 CCCCCCOCC(=O)c1cccc(c1)Cl d180c80535ee724b21fac2885a902dd2 [0,2,0,0,0,0|0,0,0]=2 8016 B17R1.40 CCCCCCOCC(=O)c1cccc(c1)F 5e10df6c471cfe511ec0250bd2096596 [0,2,0,0,0,0|0,0,0]=2 8017 B17R1.40 CCCCCCOCC(=O)c1cccc(c1)I d093830d2d493fb3924aca963cc6d077 [0,2,0,0,0,0|0,0,0]=2 8018 B17R1.40 CCCCCCOCC(=O)c1cccc(n1)Br 5deb84379339538ae1ea5812f3e7a77f [0,2,0,0,0,0|1,0,0]=3 8019 B17R1.40 CCCCCCOCC(=O)c1cccc(n1)C 2c3ba67d88d024e6add2095f0e8b21a3 [0,2,0,0,0,0|1,0,0]=3 8020 B17R1.40 CCCCCCOCC(=O)c1ccnc(c1)Cl 56adf6e6fe9bae62bcef9de755a6b435 [0,2,0,0,0,0|1,0,0]=3 8021 B17R1.40 CCCCCCOCC(=O)c1ccnc(c1)F c98ec40db6d531b02156ba69398052ec [0,2,0,0,0,0|1,0,0]=3 8022 B17R1.40 CCCCCOCNC(=O)c1cccc(c1)C 0c9e959e2ffcb1c7f46aa070c8b16ca5 [0,2,0,0,0,0|1,0,0]=3 8023 B17R1.40 CCCCNCCCC(=O)c1cccc(c1)C 778b50204b7683ebedc32ba5726a864d [0,2,0,0,0,0|1,0,0]=3 8024 B17R1.40 CCCCNCCCC(=O)c1cccc(c1)F 6a72939cdbf791038d178a5ab4976b7f [0,2,0,0,0,0|1,0,0]=3 8025 B17R1.40 CCCCOCCCC(=O)c1cccc(c1)F 16fe6bdef7509c1475b659e1aba72e66 [0,2,0,0,0,0|1,0,0]=3 8026 B17R1.40 CCCCOCCNC(=O)c1cc(=O)cco1 711c2dee2c04929b28b86c85d14fc161 [0,2,0,0,0,0|2,0,0]=4 8027 B17R1.40 CCCCOCCNC(=O)c1cc(ccn1)Br afeefae5544b6d358a915386d591ba07 [0,2,0,0,0,0|2,0,0]=4 8028 B17R1.40 CCCCOCCNC(=O)c1cc(ccn1)C 1d313cfd0e151f68852b85acf80a2c5c [0,2,0,0,0,0|2,0,0]=4 8029 B17R1.40 CCCCOCCNC(=O)c1cc(ccn1)Cl 96e62e37a012ea7791702b43ecb24455 [0,2,0,0,0,0|2,0,0]=4 8030 B17R1.40 CCCCOCCNC(=O)c1cc(ccn1)F f022728518cdaf0d681bb0cfd57cc844 [0,2,0,0,0,0|2,0,0]=4 8031 B17R1.40 CCCCOCCNC(=O)c1cc(ccn1)I 8d5b4dd6df8f1820b48990a2e4c1cff4 [0,2,0,0,0,0|2,0,0]=4 8032 B17R1.40 CCCCOCCNC(=O)c1cc(ccn1)O 797d6b3539d303b1f303fb50a31ca665 [0,2,0,0,0,0|2,0,0]=4 8033 B17R1.40 CCCCOCCNC(=O)c1ccc[n+](c1)[O-] e3e1493bd0f7c930b563ee20cca997e6 [0,2,0,0,0,0|2,0,0]=4 8034 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)Br 56f79216161d8d1d219fafd6da6cb889 [0,2,0,0,0,0|1,0,0]=3 8035 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)C d43bdfe92ca5b1a2c33d9a082c3f3c1a [0,2,0,0,0,0|1,0,0]=3 8036 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)Cl 348bc1cba95406b31f4b3944ab518c41 [0,2,0,0,0,0|1,0,0]=3 8037 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)F 13cc946c4abbf784391ef85e11cdfec6 [0,2,0,0,0,0|1,0,0]=3 8038 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)I 9dd5bacda230d91f29be8a024ed9e342 [0,2,0,0,0,0|1,0,0]=3 8039 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)O 4be0be2fefdddd690ec2c949bac6bebb [0,2,0,0,0,0|1,0,0]=3 8040 B17R1.40 CCCCOCCNC(=O)c1cccc(c1)S 7bbc0b64949a89fb42724c842459eb6d [0,2,0,0,0,0|1,0,0]=3 8041 B17R1.40 CCCCOCCNC(=O)c1cccc(n1)Br c05b4866d503781fc2a32ce4f84e5102 [0,2,0,0,0,0|2,0,0]=4 8042 B17R1.40 CCCCOCCNC(=O)c1cccc(n1)C 1d688c5e7983f51e548c9d2a8843d75b [0,2,0,0,0,0|2,0,0]=4 8043 B17R1.40 CCCCOCCNC(=O)c1cccc(n1)Cl 316a40d8764a0d448470c84f858dabf1 [0,2,0,0,0,0|2,0,0]=4 8044 B17R1.40 CCCCOCCNC(=O)c1cccc(n1)F d39739223c509b6ff46eec9802c5e871 [0,2,0,0,0,0|2,0,0]=4 8045 B17R1.40 CCCCOCCNC(=O)c1cccc(n1)I 3982186d895a495a5a16b50ac29e4e0b [0,2,0,0,0,0|2,0,0]=4 8046 B17R1.40 CCCCOCCNC(=O)c1cccc(n1)O d666e9197bafa4b3de3a09968f23a5b3 [0,2,0,0,0,0|2,0,0]=4 8047 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)Br dcd1f9bbc406f1dc8e6fe56aa1d89878 [0,2,0,0,0,0|2,0,0]=4 8048 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)C 38a0d1ad3f8cf43621ff5a998f4d9900 [0,2,0,0,0,0|2,0,0]=4 8049 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)Cl 257c4cb741f985b3bd3052b72b918a0d [0,2,0,0,0,0|2,0,0]=4 8050 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)F de1c140ae9622dfbe7e71fdaba23a138 [0,2,0,0,0,0|2,0,0]=4 8051 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)I de6eb606d65d4e855de45395578e6de0 [0,2,0,0,0,0|2,0,0]=4 8052 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)O 62eacf9cb9226008fd15d2c9431393ac [0,2,0,0,0,0|2,0,0]=4 8053 B17R1.40 CCCCOCCNC(=O)c1ccnc(c1)S 7c0bb07d6c866210daaef589d9134da7 [0,2,0,0,0,0|2,0,0]=4 8054 B17R1.40 CCCCOCCNC(=O)c1cncc(c1)Br 741af7d2e7053295c80db06b56b7e6cb [0,2,0,0,0,0|2,0,0]=4 8055 B17R1.40 CCCCOCCNC(=O)c1cncc(c1)C 23b275cffd63b9434678550b340b1d38 [0,2,0,0,0,0|2,0,0]=4 8056 B17R1.40 CCCCOCCNC(=O)c1cncc(c1)Cl 063aae9fc0d8ce24e7ab88759d2262bf [0,2,0,0,0,0|2,0,0]=4 8057 B17R1.40 CCCCOCCNC(=O)c1cncc(c1)F c3bd5f3ed02deeb0fc9e9dc11bfcffe3 [0,2,0,0,0,0|2,0,0]=4 8058 B17R1.40 CCCCOCCNC(=O)c1cncc(c1)I 5f5b8ad16190d2b0b408096617884b13 [0,2,0,0,0,0|2,0,0]=4 8059 B17R1.40 CCCCOCCNC(=O)c1cncc(c1)O ad1f688eb3a36abe1a094167963471e2 [0,2,0,0,0,0|2,0,0]=4 8060 B17R1.40 CCCCOCCOC(C)c1cccc(c1)Br ed6517e040b568840128946330352657 [0,2,0,0,0,0|1,0,1]=4 8061 B17R1.40 CCCCOCCOC(C)c1cccc(c1)C e41399601d708fb0453d06b03eaec681 [0,2,0,0,0,0|1,0,1]=4 8062 B17R1.40 CCCCOCCOC(C)c1cccc(c1)Cl 18b3de1b012329b28a38ae448322f975 [0,2,0,0,0,0|1,0,1]=4 8063 B17R1.40 CCCCOCCOC(C)c1cccc(c1)F 24760261acaf9e4028a93a150125a49e [0,2,0,0,0,0|1,0,1]=4 8064 B17R1.40 CCCCOCCOC(C)c1cccc(c1)I 2768f033ef02add740654b0fc475be32 [0,2,0,0,0,0|1,0,1]=4 8065 B17R1.40 CCCCOCCO[C@@H](C)c1cccc(c1)Br 3d588105ba9bceb4401db016ceeda590 [0,2,0,0,0,0|1,0,1]=4 8066 B17R1.40 CCCCOCCO[C@@H](C)c1cccc(c1)C 906ab8e6cadc933f76697128df20e6e3 [0,2,0,0,0,0|1,0,1]=4 8067 B17R1.40 CCCCOCCO[C@@H](C)c1cccc(c1)Cl ab9284b82ffff817acc597925ad75580 [0,2,0,0,0,0|1,0,1]=4 8068 B17R1.40 CCCCOCCO[C@@H](C)c1cccc(c1)F d1bf7e55ee394144f435f9250a797dfc [0,2,0,0,0,0|1,0,1]=4 8069 B17R1.40 CCCCOCCO[C@H](C)c1cccc(c1)Br 934698314a8f6338905c447668827bfc [0,2,0,0,0,0|1,0,1]=4 8070 B17R1.40 CCCCOCCO[C@H](C)c1cccc(c1)C d58d415893301265bf640899e9c1ac1d [0,2,0,0,0,0|1,0,1]=4 8071 B17R1.40 CCCCOCCO[C@H](C)c1cccc(c1)Cl f5507ef4c4643db05d5687bef8638c6c [0,2,0,0,0,0|1,0,1]=4 8072 B17R1.40 CCCCOCCO[C@H](C)c1cccc(c1)F 98d4aac11fdb373653a3d3c582abdd9d [0,2,0,0,0,0|1,0,1]=4 8073 B17R1.40 CCCCOCOCC(=O)c1cccc(c1)Br 3b3f2f597149ee050d45badd5c8917d9 [0,2,0,0,0,0|1,0,0]=3 8074 B17R1.40 CCCCOCOCC(=O)c1cccc(c1)Cl 0a869c61d94d0dd54457f40fec5714a7 [0,2,0,0,0,0|1,0,0]=3 8075 B17R1.40 CCCCOCOCC(=O)c1cccc(c1)F dbc8f19cf65616c3b347ddd48d2e324b [0,2,0,0,0,0|1,0,0]=3 8076 B17R1.40 CCCCSCCOC(C)c1cccc(c1)Cl 280d3a2dcb85c87e24d4199ac0048901 [0,2,0,0,0,0|1,0,1]=4 8077 B17R1.40 CCCCSCCOC(C)c1cccc(c1)F 4064db7f10ba74f6ac4becf9d32ee6cf [0,2,0,0,0,0|1,0,1]=4 8078 B17R1.40 CCCNCCCNC(=O)c1cccc(c1)Br c073bb75dc8f63f33c5c6865fc6f0683 [0,2,0,0,0,0|1,0,0]=3 8079 B17R1.40 CCCOCCCNC(=O)c1cc(=O)cco1 e8f520ab4f99df3ab9ca1583e2e14a46 [0,2,0,0,0,0|2,0,0]=4 8080 B17R1.40 CCCOCCCNC(=O)c1cc(ccn1)Br 7dd1709c6c0bef10f752e5037bb6f992 [0,2,0,0,0,0|2,0,0]=4 8081 B17R1.40 CCCOCCCNC(=O)c1cc(ccn1)C 74de242f2712a3beea273ef5c0fc8d05 [0,2,0,0,0,0|2,0,0]=4 8082 B17R1.40 CCCOCCCNC(=O)c1cc(ccn1)Cl ce36e3394d6d88ce315279cac795efb9 [0,2,0,0,0,0|2,0,0]=4 8083 B17R1.40 CCCOCCCNC(=O)c1cc(ccn1)F 5e43aa00dac227b945bff4a45d38ceaf [0,2,0,0,0,0|2,0,0]=4 8084 B17R1.40 CCCOCCCNC(=O)c1cc(ccn1)I 9ce729de74be4fb3e371291338f14eda [0,2,0,0,0,0|2,0,0]=4 8085 B17R1.40 CCCOCCCNC(=O)c1cc(ccn1)O 8c383a77cab69f7bf884040bf1b7e88a [0,2,0,0,0,0|2,0,0]=4 8086 B17R1.40 CCCOCCCNC(=O)c1ccc[n+](c1)[O-] 20fa62796abcdec9cad2fc31d077adf9 [0,2,0,0,0,0|2,0,0]=4 8087 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)Br d97d8de122e1c5415444f59f522ae241 [0,2,0,0,0,0|1,0,0]=3 8088 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)C 44dc46ba8ef46b83b77a47444799e85f [0,2,0,0,0,0|1,0,0]=3 8089 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)Cl ba780f1cbf34d58cec17641ec8db9f2f [0,2,0,0,0,0|1,0,0]=3 8090 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)F 9a4f0f7a0f675b4cab012581cd6b7856 [0,2,0,0,0,0|1,0,0]=3 8091 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)I a78dc7ca9a842155d37cc459e94ad434 [0,2,0,0,0,0|1,0,0]=3 8092 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)O c76b80b12ca146635e9f28b72602c53e [0,2,0,0,0,0|1,0,0]=3 8093 B17R1.40 CCCOCCCNC(=O)c1cccc(c1)S c00623d7ef44290a0b10019eed8a52fe [0,2,0,0,0,0|1,0,0]=3 8094 B17R1.40 CCCOCCCNC(=O)c1cccc(n1)Br f8c0452b6f666210e5f6384ee65e3ab3 [0,2,0,0,0,0|2,0,0]=4 8095 B17R1.40 CCCOCCCNC(=O)c1cccc(n1)C fef74bc5c015df463e6cded53bd0b51b [0,2,0,0,0,0|2,0,0]=4 8096 B17R1.40 CCCOCCCNC(=O)c1cccc(n1)Cl 43ef63b68776720fc79ad39fdd38557f [0,2,0,0,0,0|2,0,0]=4 8097 B17R1.40 CCCOCCCNC(=O)c1cccc(n1)F a8e55c6adb1bff3c52335bf610f9f57f [0,2,0,0,0,0|2,0,0]=4 8098 B17R1.40 CCCOCCCNC(=O)c1cccc(n1)I 35cf0ffcc5f52e32308465fc63fe52e7 [0,2,0,0,0,0|2,0,0]=4 8099 B17R1.40 CCCOCCCNC(=O)c1cccc(n1)O 74efcba04d39be519f4b38bd6ca977de [0,2,0,0,0,0|2,0,0]=4 8100 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)Br 7bda9c58cfc74f19042c9cc1aaf09a98 [0,2,0,0,0,0|2,0,0]=4 8101 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)C 7fb946931230e16c13b27d93c9885d51 [0,2,0,0,0,0|2,0,0]=4 8102 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)Cl 45ae1b3aee89d1ecb9748a0084f214b7 [0,2,0,0,0,0|2,0,0]=4 8103 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)F 065d98a65973037728417f4a35f61f62 [0,2,0,0,0,0|2,0,0]=4 8104 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)I 97b0938005c5851784d3f1ead8f9d653 [0,2,0,0,0,0|2,0,0]=4 8105 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)O b3c014ee34ad8dc7cd3944319e57931c [0,2,0,0,0,0|2,0,0]=4 8106 B17R1.40 CCCOCCCNC(=O)c1ccnc(c1)S 2199867b2bf829a33e0906b1a6054c0f [0,2,0,0,0,0|2,0,0]=4 8107 B17R1.40 CCCOCCCNC(=O)c1cncc(c1)Br 31b1e7782a46d46e8be8d9b6b7ccf373 [0,2,0,0,0,0|2,0,0]=4 8108 B17R1.40 CCCOCCCNC(=O)c1cncc(c1)C edd43e213c05a91035698b8da4e78b38 [0,2,0,0,0,0|2,0,0]=4 8109 B17R1.40 CCCOCCCNC(=O)c1cncc(c1)Cl 90c22bb694250ec69791b97e7e729971 [0,2,0,0,0,0|2,0,0]=4 8110 B17R1.40 CCCOCCCNC(=O)c1cncc(c1)F 20da9d65d7980faa1776ccc96cc00ae1 [0,2,0,0,0,0|2,0,0]=4 8111 B17R1.40 CCCOCCCNC(=O)c1cncc(c1)I e62f6ab305caf5afc988ed9414e28f24 [0,2,0,0,0,0|2,0,0]=4 8112 B17R1.40 CCCOCCCNC(=O)c1cncc(c1)O 42ed895ce3270fc350f558f2ff3ea200 [0,2,0,0,0,0|2,0,0]=4 8113 B17R1.40 CCCOCCCOC(C)c1cccc(c1)Br ad1a052afc656e493b45c76c5d3c94f1 [0,2,0,0,0,0|1,0,1]=4 8114 B17R1.40 CCCOCCCOC(C)c1cccc(c1)C 00bce9efd34bd789e55c0728210cc479 [0,2,0,0,0,0|1,0,1]=4 8115 B17R1.40 CCCOCCCOC(C)c1cccc(c1)Cl 0b0fff93efa6ace426c8d50d2dcf931e [0,2,0,0,0,0|1,0,1]=4 8116 B17R1.40 CCCOCCCOC(C)c1cccc(c1)F 8af7826df13e64aad50756cba608e6d9 [0,2,0,0,0,0|1,0,1]=4 8117 B17R1.40 CCCOCCCOC(C)c1cccc(c1)I 5d20b4476b04cb3f9817ac2fc185ad1e [0,2,0,0,0,0|1,0,1]=4 8118 B17R1.40 CCCOCCCO[C@@H](C)c1cccc(c1)Br a3699a97baaafab38e79817311217c3b [0,2,0,0,0,0|1,0,1]=4 8119 B17R1.40 CCCOCCCO[C@@H](C)c1cccc(c1)C 10ff6069abda3276bb940c813927ca8c [0,2,0,0,0,0|1,0,1]=4 8120 B17R1.40 CCCOCCCO[C@@H](C)c1cccc(c1)Cl 24c3a24510b592ddb3b715681a967354 [0,2,0,0,0,0|1,0,1]=4 8121 B17R1.40 CCCOCCCO[C@@H](C)c1cccc(c1)F 0a83d1206a1d9cbbf032dd45af1bb1a1 [0,2,0,0,0,0|1,0,1]=4 8122 B17R1.40 CCCOCCCO[C@H](C)c1cccc(c1)Br 48f455d4938f070d139e2ddaf0fa4594 [0,2,0,0,0,0|1,0,1]=4 8123 B17R1.40 CCCOCCCO[C@H](C)c1cccc(c1)C ba1c64b5a11d2cbe5d22eb70e1c6c798 [0,2,0,0,0,0|1,0,1]=4 8124 B17R1.40 CCCOCCCO[C@H](C)c1cccc(c1)Cl 2d5747ecf0e34e6020e3c9e6606c17a8 [0,2,0,0,0,0|1,0,1]=4 8125 B17R1.40 CCCOCCCO[C@H](C)c1cccc(c1)F 9e85cc3de5c685a83eb2a7b32c0ff059 [0,2,0,0,0,0|1,0,1]=4 8126 B17R1.40 CCCOCCNCC(=O)c1cccc(c1)Br 3ccbadf0b4228838cbc6da3157d6ab3b [0,2,0,0,0,0|2,0,0]=4 8127 B17R1.40 CCCOCCNCC(=O)c1cccc(c1)C ae340bb7c50e3d5dce1369721356ca2b [0,2,0,0,0,0|2,0,0]=4 8128 B17R1.40 CCCOCCNCC(=O)c1cccc(c1)Cl 66fa6d9db5bbcf3013b56f3cec85e2a9 [0,2,0,0,0,0|2,0,0]=4 8129 B17R1.40 CCCOCCNCC(=O)c1cccc(c1)F 86e9f31828ed34d36cde1feff0414751 [0,2,0,0,0,0|2,0,0]=4 8130 B17R1.40 CCCOCCNCC(=O)c1cccc(c1)I da62096426d26f3346bd2f6d2398c034 [0,2,0,0,0,0|2,0,0]=4 8131 B17R1.40 CCCOCCOCC(=O)c1cc(ccn1)Cl d720421ccca749b4ded49399f2fc0b5d [0,2,0,0,0,0|2,0,0]=4 8132 B17R1.40 CCCOCCOCC(=O)c1cccc(c1)Br c2f811f4b9ca04695de6b62938b972a9 [0,2,0,0,0,0|1,0,0]=3 8133 B17R1.40 CCCOCCOCC(=O)c1cccc(c1)C f5859754247ae36510c40b769f071586 [0,2,0,0,0,0|1,0,0]=3 8134 B17R1.40 CCCOCCOCC(=O)c1cccc(c1)Cl 0a229613b8b00f473f1452d8f36a78ff [0,2,0,0,0,0|1,0,0]=3 8135 B17R1.40 CCCOCCOCC(=O)c1cccc(c1)F 5156a64b0386adbbbb0238f9b8937de3 [0,2,0,0,0,0|1,0,0]=3 8136 B17R1.40 CCCOCCOCC(=O)c1cccc(c1)I b738645e5423ce470f17e4731316dbbd [0,2,0,0,0,0|1,0,0]=3 8137 B17R1.40 CCCOCCOCC(=O)c1cccc(n1)Br 0b81cff5af54230c47fa7260da2c76ba [0,2,0,0,0,0|2,0,0]=4 8138 B17R1.40 CCCOCCOCC(=O)c1cccc(n1)C bc94f6528a692eb9cfda6ebf2e97b016 [0,2,0,0,0,0|2,0,0]=4 8139 B17R1.40 CCCOCCOCC(=O)c1ccnc(c1)Cl a309bd6a4ffbdc1ab3ea74c858bbd070 [0,2,0,0,0,0|2,0,0]=4 8140 B17R1.40 CCCOCCOCC(=O)c1ccnc(c1)F a73c7b530290603ddadf3c15a312ae7c [0,2,0,0,0,0|2,0,0]=4 8141 B17R1.40 CCCSCCOCC(=O)c1cc(ccn1)Cl 055cbbad86798a956adcf6e5a5500f8d [0,2,0,0,0,0|2,0,0]=4 8142 B17R1.40 CCCSCCOCC(=O)c1cccc(c1)Br 9036037f11e9efb63bb322647e783d2d [0,2,0,0,0,0|1,0,0]=3 8143 B17R1.40 CCCSCCOCC(=O)c1cccc(c1)C d5b3a9cbe23b127996959d2f6a51ae5a [0,2,0,0,0,0|1,0,0]=3 8144 B17R1.40 CCCSCCOCC(=O)c1cccc(c1)Cl 0de0ae5599b325bf60d7ae5797f2ae34 [0,2,0,0,0,0|1,0,0]=3 8145 B17R1.40 CCCSCCOCC(=O)c1cccc(c1)F e26018e1926b46c09c60c0681d4e4ec3 [0,2,0,0,0,0|1,0,0]=3 8146 B17R1.40 CCCSCCOCC(=O)c1cccc(c1)I d228f123dd4ee56c0fe1ef5fac3ba66d [0,2,0,0,0,0|1,0,0]=3 8147 B17R1.40 CCCSCCOCC(=O)c1cccc(n1)Br 4488e922389cf169d49b2426f2832388 [0,2,0,0,0,0|2,0,0]=4 8148 B17R1.40 CCCSCCOCC(=O)c1cccc(n1)C e81157c7643f0c7a6b5d69e7f729bfe3 [0,2,0,0,0,0|2,0,0]=4 8149 B17R1.40 CCCSCCOCC(=O)c1ccnc(c1)Cl 0bfab34d853c8e7217bbcc4772d9045e [0,2,0,0,0,0|2,0,0]=4 8150 B17R1.40 CCCSCCOCC(=O)c1ccnc(c1)F b32b7c762c3231ed1d6804f7367e36dd [0,2,0,0,0,0|2,0,0]=4 8151 B17R1.40 CCOCCCNCC(=O)c1cccc(c1)Br db968443e2937809fb34cd65444ed7af [0,2,0,0,0,0|2,0,0]=4 8152 B17R1.40 CCOCCCNCC(=O)c1cccc(c1)C 84897d5a4f8ecd49f3dd43386d631d7c [0,2,0,0,0,0|2,0,0]=4 8153 B17R1.40 CCOCCCNCC(=O)c1cccc(c1)Cl 0c57f97a5dcdb71b8dcab86836d18199 [0,2,0,0,0,0|2,0,0]=4 8154 B17R1.40 CCOCCCNCC(=O)c1cccc(c1)F 3dfb61deeda178b3b7712e3b3ac7a022 [0,2,0,0,0,0|2,0,0]=4 8155 B17R1.40 CCOCCCNCC(=O)c1cccc(c1)I 157464864ece7e83ada7576292aaa6fb [0,2,0,0,0,0|2,0,0]=4 8156 B17R1.40 CCOCCCOCC(=O)c1cc(ccn1)Cl 05c422715d9125e6c45de415cc1143d3 [0,2,0,0,0,0|2,0,0]=4 8157 B17R1.40 CCOCCCOCC(=O)c1cccc(c1)Br e97d9b70563c0d623c5f23741f0c4299 [0,2,0,0,0,0|1,0,0]=3 8158 B17R1.40 CCOCCCOCC(=O)c1cccc(c1)C 3c2ab8545fc7464aad5964c0dab2525c [0,2,0,0,0,0|1,0,0]=3 8159 B17R1.40 CCOCCCOCC(=O)c1cccc(c1)Cl e0ab5bac6641540e731a686600a94439 [0,2,0,0,0,0|1,0,0]=3 8160 B17R1.40 CCOCCCOCC(=O)c1cccc(c1)F a5af2e94555e94181e4e2657f2c5dc82 [0,2,0,0,0,0|1,0,0]=3 8161 B17R1.40 CCOCCCOCC(=O)c1cccc(c1)I c4514ba23b201159377dd4521d396b94 [0,2,0,0,0,0|1,0,0]=3 8162 B17R1.40 CCOCCCOCC(=O)c1cccc(n1)Br 069d57cb72e3502558039ef4af1e8f8a [0,2,0,0,0,0|2,0,0]=4 8163 B17R1.40 CCOCCCOCC(=O)c1cccc(n1)C 9e94a1a123f623a2a5bf913bd95651cd [0,2,0,0,0,0|2,0,0]=4 8164 B17R1.40 CCOCCCOCC(=O)c1ccnc(c1)Cl 08f87dacf267b4eeda90b71c80a8c55a [0,2,0,0,0,0|2,0,0]=4 8165 B17R1.40 CCOCCCOCC(=O)c1ccnc(c1)F df88f2c289ddee7d687f53ed2f824701 [0,2,0,0,0,0|2,0,0]=4 8166 B17R1.40 CCOCCOCNC(=O)c1cccc(c1)C eea18d4bb5f6ee399d3846563146116a [0,2,0,0,0,0|2,0,0]=4 8167 B17R1.40 CCOCOCCNC(=O)c1cccc(c1)Br c224ed747594595022b62bc35d277de8 [0,2,0,0,0,0|2,0,0]=4 8168 B17R1.40 CCOCOCCNC(=O)c1cccc(c1)C 8f5f969d1de7f0d029a684297a5ed454 [0,2,0,0,0,0|2,0,0]=4 8169 B17R1.40 CCOCOCCNC(=O)c1cccc(c1)Cl 791d3af679dcb071764575a0ea3b3100 [0,2,0,0,0,0|2,0,0]=4 8170 B17R1.40 CCSCCCCNC(=O)c1cc(=O)cco1 eb2737ce995ae1818f6713643db7fb5b [0,2,0,0,0,0|2,0,0]=4 8171 B17R1.40 CCSCCCCNC(=O)c1cc(ccn1)Br 9f162450d61183e614e1fd8cdc9b7677 [0,2,0,0,0,0|2,0,0]=4 8172 B17R1.40 CCSCCCCNC(=O)c1cc(ccn1)C fd6569efaf54eab5ae850a6cf2e7f26b [0,2,0,0,0,0|2,0,0]=4 8173 B17R1.40 CCSCCCCNC(=O)c1cc(ccn1)Cl 051860d534b14470885e06a55fd62ee5 [0,2,0,0,0,0|2,0,0]=4 8174 B17R1.40 CCSCCCCNC(=O)c1cc(ccn1)F ea6e4a0f9f958388e502a4e11c2be5b3 [0,2,0,0,0,0|2,0,0]=4 8175 B17R1.40 CCSCCCCNC(=O)c1cc(ccn1)I 0f4a1dd3cc206ac3dbfed91e1b32d03d [0,2,0,0,0,0|2,0,0]=4 8176 B17R1.40 CCSCCCCNC(=O)c1cc(ccn1)O 80b17e71a60d4f148b12d6f24a8fdc43 [0,2,0,0,0,0|2,0,0]=4 8177 B17R1.40 CCSCCCCNC(=O)c1ccc[n+](c1)[O-] 699515f197eb07db7b1e386dcc7ac752 [0,2,0,0,0,0|2,0,0]=4 8178 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)Br be29e2648c787a57eeda9c6facd563ed [0,2,0,0,0,0|1,0,0]=3 8179 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)C b377dbca4d4f85f44218e36a81539c3c [0,2,0,0,0,0|1,0,0]=3 8180 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)Cl 8f7c84ff35af6628b7e8359f15e6b2d5 [0,2,0,0,0,0|1,0,0]=3 8181 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)F dcc6ff15294b112827f3d6f03d2c63ac [0,2,0,0,0,0|1,0,0]=3 8182 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)I 4e505123f46c6b2d4715742bdcea4b39 [0,2,0,0,0,0|1,0,0]=3 8183 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)O 60ad809886b50b2a5d6dd3b8e705e696 [0,2,0,0,0,0|1,0,0]=3 8184 B17R1.40 CCSCCCCNC(=O)c1cccc(c1)S 0debdb9cbd5078999b2993ca83e3381d [0,2,0,0,0,0|1,0,0]=3 8185 B17R1.40 CCSCCCCNC(=O)c1cccc(n1)Br 60850071f9532e8b4425c198b47bb7fa [0,2,0,0,0,0|2,0,0]=4 8186 B17R1.40 CCSCCCCNC(=O)c1cccc(n1)C b28d2b63df23695c891ec21fb84c787c [0,2,0,0,0,0|2,0,0]=4 8187 B17R1.40 CCSCCCCNC(=O)c1cccc(n1)Cl 479f2dc40ec12aa6a5ffafa0a692ee30 [0,2,0,0,0,0|2,0,0]=4 8188 B17R1.40 CCSCCCCNC(=O)c1cccc(n1)F 5862c76f07f12a177b5d4f45b2503b29 [0,2,0,0,0,0|2,0,0]=4 8189 B17R1.40 CCSCCCCNC(=O)c1cccc(n1)I 53bf965eec4f30afe45cf49cdecf29cd [0,2,0,0,0,0|2,0,0]=4 8190 B17R1.40 CCSCCCCNC(=O)c1cccc(n1)O 9c6179de63d62cbf00855d5e03752204 [0,2,0,0,0,0|2,0,0]=4 8191 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)Br e0e93056bd3912fc747f49d70e499731 [0,2,0,0,0,0|2,0,0]=4 8192 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)C d16a8179e32365fdd0dcee64bd569f4c [0,2,0,0,0,0|2,0,0]=4 8193 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)Cl e28da60e22c85ea775eb060c96937b73 [0,2,0,0,0,0|2,0,0]=4 8194 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)F e3d6906a83f142d993c214c7232de393 [0,2,0,0,0,0|2,0,0]=4 8195 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)I e9fd14724eecc1afab079a0aa46b8b1f [0,2,0,0,0,0|2,0,0]=4 8196 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)O 162969c4c7330cf070c58775368e6434 [0,2,0,0,0,0|2,0,0]=4 8197 B17R1.40 CCSCCCCNC(=O)c1ccnc(c1)S 82f640f34452ce6a903150336f3d89f4 [0,2,0,0,0,0|2,0,0]=4 8198 B17R1.40 CCSCCCCNC(=O)c1cncc(c1)Br 87dd11e98f15f5f1826197844eb5b399 [0,2,0,0,0,0|2,0,0]=4 8199 B17R1.40 CCSCCCCNC(=O)c1cncc(c1)C 64149f8a5fc664da2b48f1b9ce3fa795 [0,2,0,0,0,0|2,0,0]=4 8200 B17R1.40 CCSCCCCNC(=O)c1cncc(c1)Cl 67e96b77c540757796a7622749c7732d [0,2,0,0,0,0|2,0,0]=4 8201 B17R1.40 CCSCCCCNC(=O)c1cncc(c1)F e724e95f2b7048c4006c036dadb763c0 [0,2,0,0,0,0|2,0,0]=4 8202 B17R1.40 CCSCCCCNC(=O)c1cncc(c1)I f3f76745179f91eb28335185f10d7b17 [0,2,0,0,0,0|2,0,0]=4 8203 B17R1.40 CCSCCCCNC(=O)c1cncc(c1)O d364f30f89d3f168cd80156ec52b40d4 [0,2,0,0,0,0|2,0,0]=4 8204 B17R1.40 CCSCCCOCC(=O)c1cc(ccn1)Cl 9e698dd02673232138452283b8b45137 [0,2,0,0,0,0|2,0,0]=4 8205 B17R1.40 CCSCCCOCC(=O)c1cccc(c1)Br 100d7d3701c40f141ddbc4acff6c82fe [0,2,0,0,0,0|1,0,0]=3 8206 B17R1.40 CCSCCCOCC(=O)c1cccc(c1)C 6d5cf0ed719fb8e507960a8714946289 [0,2,0,0,0,0|1,0,0]=3 8207 B17R1.40 CCSCCCOCC(=O)c1cccc(c1)Cl 8c02dae47d8398de0e2dbc3aa87cbae0 [0,2,0,0,0,0|1,0,0]=3 8208 B17R1.40 CCSCCCOCC(=O)c1cccc(c1)F 60ca6e14f44e54e6732f0a62a4a06d78 [0,2,0,0,0,0|1,0,0]=3 8209 B17R1.40 CCSCCCOCC(=O)c1cccc(c1)I 42651ebfbaf8433ca1333d491bd7d83e [0,2,0,0,0,0|1,0,0]=3 8210 B17R1.40 CCSCCCOCC(=O)c1cccc(n1)Br d64ba6970c769ec36f6e7e3cb2280e5c [0,2,0,0,0,0|2,0,0]=4 8211 B17R1.40 CCSCCCOCC(=O)c1cccc(n1)C 4d07266cac1efdbea58ad0b539c40ad5 [0,2,0,0,0,0|2,0,0]=4 8212 B17R1.40 CCSCCCOCC(=O)c1ccnc(c1)Cl 2e8804754c8ed90958ca1c83cc97833a [0,2,0,0,0,0|2,0,0]=4 8213 B17R1.40 CCSCCCOCC(=O)c1ccnc(c1)F d2fd317b76b56b7fdadcc67862389e1c [0,2,0,0,0,0|2,0,0]=4 8214 B17R1.40 CCSCCOCNC(=O)c1cccc(c1)C 3d634d9886d1938c06ffa690502a83a9 [0,2,0,0,0,0|2,0,0]=4 8215 B17R1.40 COCCCCCNC(=O)c1cc(=O)cco1 9efbe6427ca6e79ba7a873768a033c02 [0,2,0,0,0,0|2,0,0]=4 8216 B17R1.40 COCCCCCNC(=O)c1cc(ccn1)Br 0004c3d39253fa84e2aedbdd4c68f510 [0,2,0,0,0,0|2,0,0]=4 8217 B17R1.40 COCCCCCNC(=O)c1cc(ccn1)C 137169983913035bc0c7f97ca205ee87 [0,2,0,0,0,0|2,0,0]=4 8218 B17R1.40 COCCCCCNC(=O)c1cc(ccn1)Cl 3dc528ff42e50db304b4738dcfac8449 [0,2,0,0,0,0|2,0,0]=4 8219 B17R1.40 COCCCCCNC(=O)c1cc(ccn1)F e4558f5a8a08d851a41230e8a800c434 [0,2,0,0,0,0|2,0,0]=4 8220 B17R1.40 COCCCCCNC(=O)c1cc(ccn1)I 2e923e957635193e79c77cfaa3ff04df [0,2,0,0,0,0|2,0,0]=4 8221 B17R1.40 COCCCCCNC(=O)c1cc(ccn1)O feb745cb50dd59f2345f8750b925b894 [0,2,0,0,0,0|2,0,0]=4 8222 B17R1.40 COCCCCCNC(=O)c1ccc[n+](c1)[O-] 469f4dd248195b0050cc57151cde47e9 [0,2,0,0,0,0|2,0,0]=4 8223 B17R1.40 COCCCCCNC(=O)c1cccc(c1)Br 2df7a50ccce6faff911a12b8a35de552 [0,2,0,0,0,0|1,0,0]=3 8224 B17R1.40 COCCCCCNC(=O)c1cccc(c1)C a125e92dd3de49d7d7f392a0901fe836 [0,2,0,0,0,0|1,0,0]=3 8225 B17R1.40 COCCCCCNC(=O)c1cccc(c1)Cl a4aa47ccfb8418e879224b44e1e3c5fc [0,2,0,0,0,0|1,0,0]=3 8226 B17R1.40 COCCCCCNC(=O)c1cccc(c1)F 0f413ca60616eedc60bb2bb5939245f1 [0,2,0,0,0,0|1,0,0]=3 8227 B17R1.40 COCCCCCNC(=O)c1cccc(c1)I 76eafd84d3c79ae891c6196b2f26ae81 [0,2,0,0,0,0|1,0,0]=3 8228 B17R1.40 COCCCCCNC(=O)c1cccc(c1)O dbc85b8b73064e1aba351a7bd15a7bbb [0,2,0,0,0,0|1,0,0]=3 8229 B17R1.40 COCCCCCNC(=O)c1cccc(c1)S a470b017ecd5f28a7ce1a06322bfc489 [0,2,0,0,0,0|1,0,0]=3 8230 B17R1.40 COCCCCCNC(=O)c1cccc(n1)Br 8c1d2cd8b818c6da08f49d9e3baff60d [0,2,0,0,0,0|2,0,0]=4 8231 B17R1.40 COCCCCCNC(=O)c1cccc(n1)C f7b6f22329ae4bd3795132f8387c9c05 [0,2,0,0,0,0|2,0,0]=4 8232 B17R1.40 COCCCCCNC(=O)c1cccc(n1)Cl 3d8192ee6095a87baff741a8f8a55bdb [0,2,0,0,0,0|2,0,0]=4 8233 B17R1.40 COCCCCCNC(=O)c1cccc(n1)F 3115350500e586e1b47365a756565f5f [0,2,0,0,0,0|2,0,0]=4 8234 B17R1.40 COCCCCCNC(=O)c1cccc(n1)I d670cadea2fa7d0e8e00906cc732f0c0 [0,2,0,0,0,0|2,0,0]=4 8235 B17R1.40 COCCCCCNC(=O)c1cccc(n1)O 8910c71f7422fba13a8f4893acd69b61 [0,2,0,0,0,0|2,0,0]=4 8236 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)Br c6e3a80f689b58ec1be65ae8e6ff6bcf [0,2,0,0,0,0|2,0,0]=4 8237 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)C 21d0750be102b9d6f4ea52427657fcab [0,2,0,0,0,0|2,0,0]=4 8238 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)Cl 0107c9e861811226fe75ea89e6c05b53 [0,2,0,0,0,0|2,0,0]=4 8239 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)F b0044a412d263d86cc9dbb1eacf4cb78 [0,2,0,0,0,0|2,0,0]=4 8240 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)I 8b7a84a5c795a10593575d6337ae228a [0,2,0,0,0,0|2,0,0]=4 8241 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)O 5ee4c286b4131571cb73fafb101313f4 [0,2,0,0,0,0|2,0,0]=4 8242 B17R1.40 COCCCCCNC(=O)c1ccnc(c1)S 161ee0d4d778a30643af30c662bf8aa4 [0,2,0,0,0,0|2,0,0]=4 8243 B17R1.40 COCCCCCNC(=O)c1cncc(c1)Br 7c3708f6fef03d8db489489fdb7653bd [0,2,0,0,0,0|2,0,0]=4 8244 B17R1.40 COCCCCCNC(=O)c1cncc(c1)C ccd64ab70a17bec6247da5c1e1c70f09 [0,2,0,0,0,0|2,0,0]=4 8245 B17R1.40 COCCCCCNC(=O)c1cncc(c1)Cl 444ca81336fc4f2e3ff5719362f9b693 [0,2,0,0,0,0|2,0,0]=4 8246 B17R1.40 COCCCCCNC(=O)c1cncc(c1)F 68dcc1399a846b311b4b9c330084e033 [0,2,0,0,0,0|2,0,0]=4 8247 B17R1.40 COCCCCCNC(=O)c1cncc(c1)I e95c4c8ad5e3cd18e75f6649dcd0fc4c [0,2,0,0,0,0|2,0,0]=4 8248 B17R1.40 COCCCCCNC(=O)c1cncc(c1)O ffcda1e80e2155831282b7ec63c16217 [0,2,0,0,0,0|2,0,0]=4 8249 B17R1.40 COCCCCCOC(C)c1cccc(c1)Br 318623549e7b60642dc8b3afa6cc7a27 [0,2,0,0,0,0|1,0,1]=4 8250 B17R1.40 COCCCCCOC(C)c1cccc(c1)C 4c2a3869dd283bb0b570ea465b97647c [0,2,0,0,0,0|1,0,1]=4 8251 B17R1.40 COCCCCCOC(C)c1cccc(c1)Cl 90bb2fa60cf105ec097fdb1bfc70f40d [0,2,0,0,0,0|1,0,1]=4 8252 B17R1.40 COCCCCCOC(C)c1cccc(c1)F 5577b268d3177c3a18bb5501deb7017a [0,2,0,0,0,0|1,0,1]=4 8253 B17R1.40 COCCCCCOC(C)c1cccc(c1)I 04fcf9faf128ebabde04745f2ce10863 [0,2,0,0,0,0|1,0,1]=4 8254 B17R1.40 COCCCCCO[C@@H](C)c1cccc(c1)Br d92e9a73b4aa7a4f2149f15c78b7fc0c [0,2,0,0,0,0|1,0,1]=4 8255 B17R1.40 COCCCCCO[C@@H](C)c1cccc(c1)C 6711e81a855d88b84541aded97fa55cd [0,2,0,0,0,0|1,0,1]=4 8256 B17R1.40 COCCCCCO[C@@H](C)c1cccc(c1)Cl a454e43f41cba8826d128affd6bad310 [0,2,0,0,0,0|1,0,1]=4 8257 B17R1.40 COCCCCCO[C@@H](C)c1cccc(c1)F 470302064b3e7bddf4e55bd671ca6a80 [0,2,0,0,0,0|1,0,1]=4 8258 B17R1.40 COCCCCCO[C@H](C)c1cccc(c1)Br aaded63db1adf92c616a4cab1b0163da [0,2,0,0,0,0|1,0,1]=4 8259 B17R1.40 COCCCCCO[C@H](C)c1cccc(c1)C caf89dd63d9b7a7753bb155d9946ebde [0,2,0,0,0,0|1,0,1]=4 8260 B17R1.40 COCCCCCO[C@H](C)c1cccc(c1)Cl 6b4e97a914eded8b41b5b0e970d50309 [0,2,0,0,0,0|1,0,1]=4 8261 B17R1.40 COCCCCCO[C@H](C)c1cccc(c1)F 8a95b31bbd87f7076f0169117f6e9510 [0,2,0,0,0,0|1,0,1]=4 8262 B17R1.40 COCCCCNCC(=O)c1cccc(c1)Br d8d92dfcfaef3850023cddaca6dd8e38 [0,2,0,0,0,0|2,0,0]=4 8263 B17R1.40 COCCCCNCC(=O)c1cccc(c1)C bc13ed963cf338123c8a42d6f7923e38 [0,2,0,0,0,0|2,0,0]=4 8264 B17R1.40 COCCCCNCC(=O)c1cccc(c1)Cl fad74b6992695639b6f052c1263c1db7 [0,2,0,0,0,0|2,0,0]=4 8265 B17R1.40 COCCCCNCC(=O)c1cccc(c1)F 7f14982a8d2e905ce1f820658ea66598 [0,2,0,0,0,0|2,0,0]=4 8266 B17R1.40 COCCCCNCC(=O)c1cccc(c1)I 3d9203874b53c2f844c19f764a3235c8 [0,2,0,0,0,0|2,0,0]=4 8267 B17R1.40 COCCCCOCC(=O)c1cc(ccn1)Cl e69312e69fbfb2eae1dfe03bd8d4dc5a [0,2,0,0,0,0|2,0,0]=4 8268 B17R1.40 COCCCCOCC(=O)c1cccc(c1)Br 3e9ca90c5a3eb98ac27a269e861bb34d [0,2,0,0,0,0|1,0,0]=3 8269 B17R1.40 COCCCCOCC(=O)c1cccc(c1)C 3b4009e23ed33cc6b8f4f40bf9accab4 [0,2,0,0,0,0|1,0,0]=3 8270 B17R1.40 COCCCCOCC(=O)c1cccc(c1)Cl 20cabc0036d88faa61dd029c7de97a35 [0,2,0,0,0,0|1,0,0]=3 8271 B17R1.40 COCCCCOCC(=O)c1cccc(c1)F c55eed10ab71d17a476aa30b365b2bb0 [0,2,0,0,0,0|1,0,0]=3 8272 B17R1.40 COCCCCOCC(=O)c1cccc(c1)I c1c2672c8da418f79969feea527160bc [0,2,0,0,0,0|1,0,0]=3 8273 B17R1.40 COCCCCOCC(=O)c1cccc(n1)Br 9c6446e7478aa73eafadb7e34bd16f67 [0,2,0,0,0,0|2,0,0]=4 8274 B17R1.40 COCCCCOCC(=O)c1cccc(n1)C 380d4fa22138193e0acd168127b0ae21 [0,2,0,0,0,0|2,0,0]=4 8275 B17R1.40 COCCCCOCC(=O)c1ccnc(c1)Cl 9228fb922889aee9db6370f18d9e8906 [0,2,0,0,0,0|2,0,0]=4 8276 B17R1.40 COCCCCOCC(=O)c1ccnc(c1)F dc65656f00f9f938693a194432a8b90c [0,2,0,0,0,0|2,0,0]=4 8277 B17R1.40 COCCCOCNC(=O)c1cccc(c1)C 58fccc946249e35c33660e3cd3975f11 [0,2,0,0,0,0|2,0,0]=4 8278 B17R1.40 COCCNCCCC(=O)c1cccc(c1)F ddc33e96396864e354caab81133a594a [0,2,0,0,0,0|2,0,0]=4 8279 B17R1.40 COCCOCCCC(=O)c1cccc(c1)C 7125bed37ff18d32ab2abfa419b72485 [0,2,0,0,0,0|2,0,0]=4 8280 B17R1.40 COCCOCCCC(=O)c1cccc(c1)F 0026f3b881af2000241ecb636695dae8 [0,2,0,0,0,0|2,0,0]=4 8281 B17R1.40 COCCOCCNC(=O)c1cccc(c1)Br db5cd878b12ade29b5fbdabc5dbc1532 [0,2,0,0,0,0|2,0,0]=4 8282 B17R1.40 COCCOCCNC(=O)c1cccc(c1)C 8f2d9b973535751a063652354d334a88 [0,2,0,0,0,0|2,0,0]=4 8283 B17R1.40 COCCOCCNC(=O)c1cccc(c1)Cl 110c39ccc2b08df06b32a759627e6b7a [0,2,0,0,0,0|2,0,0]=4 8284 B17R1.40 COCCOCCNC(=O)c1cccc(c1)F e013c262d5a8943f76beb50e42a099b3 [0,2,0,0,0,0|2,0,0]=4 8285 B17R1.40 COCCOCCNC(=O)c1cccc(c1)I 36b5ca9aa942503e2764448241561509 [0,2,0,0,0,0|2,0,0]=4 8286 B17R1.40 COCCOCCNC(=O)c1cccc(c1)O 8f9922df11ec00f9e53c4d8a8e064d2a [0,2,0,0,0,0|2,0,0]=4 8287 B17R1.40 COCCOCCNC(=O)c1cccc(c1)S cf2c78baea0835f046d1435c65748c34 [0,2,0,0,0,0|2,0,0]=4 8288 B17R1.40 COCCOCOCC(=O)c1cccc(c1)Br ee1a4ba65b7c3074ffa28cb7b7d4a9d7 [0,2,0,0,0,0|2,0,0]=4 8289 B17R1.40 COCCOCOCC(=O)c1cccc(c1)Cl 453ce7b774f407ce143404b6b52066e0 [0,2,0,0,0,0|2,0,0]=4 8290 B17R1.40 COCCOCOCC(=O)c1cccc(c1)F bdefe2fe11d0d04b49f19041ed80a9a2 [0,2,0,0,0,0|2,0,0]=4 8291 B17R1.40 COCNCCCNC(=O)c1cccc(c1)Br 3cf75bc91b8342f746c3abe7c71f4e6d [0,2,0,0,0,0|2,0,0]=4 8292 B17R1.40 COCOCCOCC(=O)c1cccc(c1)Br a519281066bed05d48000bafe3da72e1 [0,2,0,0,0,0|2,0,0]=4 8293 B17R1.40 COCOCCOCC(=O)c1cccc(c1)Cl 433d308ccc26a35d75ce565a43ad4095 [0,2,0,0,0,0|2,0,0]=4 8294 B17R1.40 COCOCCOCC(=O)c1cccc(c1)F bb6a87e96df548fd8db568136ef40566 [0,2,0,0,0,0|2,0,0]=4 8295 B17R1.40 CSCCCCNCC(=O)c1cccc(c1)Br 943c90893473d71124edc73e6b1d3cfc [0,2,0,0,0,0|2,0,0]=4 8296 B17R1.40 CSCCCCNCC(=O)c1cccc(c1)C c1dfff985540f59d3189abd35b196707 [0,2,0,0,0,0|2,0,0]=4 8297 B17R1.40 CSCCCCNCC(=O)c1cccc(c1)Cl cec7c55f851e6d47411a307c0d6d9907 [0,2,0,0,0,0|2,0,0]=4 8298 B17R1.40 CSCCCCNCC(=O)c1cccc(c1)F 5f23a0d158a750b8bdbcb6862f67a254 [0,2,0,0,0,0|2,0,0]=4 8299 B17R1.40 CSCCCCNCC(=O)c1cccc(c1)I 8acbd8191d023e8bb87d13e32ded09c6 [0,2,0,0,0,0|2,0,0]=4 8300 B17R1.40 CSCCCCOCC(=O)c1cc(ccn1)Cl 01754a67e337a99b833dfb900f10b5b9 [0,2,0,0,0,0|2,0,0]=4 8301 B17R1.40 CSCCCCOCC(=O)c1cccc(c1)Br 53c81a52738f69d09c616b179cc73a0e [0,2,0,0,0,0|1,0,0]=3 8302 B17R1.40 CSCCCCOCC(=O)c1cccc(c1)C 58dee42655ce9ec88e497e7988fe2ee8 [0,2,0,0,0,0|1,0,0]=3 8303 B17R1.40 CSCCCCOCC(=O)c1cccc(c1)Cl aa003b55a1349312e57e0dfa6634b34c [0,2,0,0,0,0|1,0,0]=3 8304 B17R1.40 CSCCCCOCC(=O)c1cccc(c1)F 3e585f4cb747e7a213b0bb3d8f071941 [0,2,0,0,0,0|1,0,0]=3 8305 B17R1.40 CSCCCCOCC(=O)c1cccc(c1)I b11d05125cc79651ac88789875272608 [0,2,0,0,0,0|1,0,0]=3 8306 B17R1.40 CSCCCCOCC(=O)c1cccc(n1)Br 264b907ed68ce0a9454dbc769d2c564e [0,2,0,0,0,0|2,0,0]=4 8307 B17R1.40 CSCCCCOCC(=O)c1cccc(n1)C f19d82ebcedce691956fe7bafedacd19 [0,2,0,0,0,0|2,0,0]=4 8308 B17R1.40 CSCCCCOCC(=O)c1ccnc(c1)Cl b5fd6db544819d6f74243948509e0b4b [0,2,0,0,0,0|2,0,0]=4 8309 B17R1.40 CSCCCCOCC(=O)c1ccnc(c1)F f4b1c146dd367e554de43d62433fe3d6 [0,2,0,0,0,0|2,0,0]=4 8310 B17R1.40 CSCCCOCNC(=O)c1cccc(c1)C 30ad8daef18885565a9054b33f208435 [0,2,0,0,0,0|2,0,0]=4 8311 B17R1.40 CSCCNCCCC(=O)c1cccc(c1)C 67e34476a004ee28c3dd3eed86e0a27c [0,2,0,0,0,0|2,0,0]=4 8312 B17R1.40 CSCCNCCCC(=O)c1cccc(c1)F d2664779ef42ca8716bdf63d8f6c8f95 [0,2,0,0,0,0|2,0,0]=4 8313 B17R1.40 CSCCOCCCC(=O)c1cccc(c1)F ee64470ff6d2ef4c6bf033a9c7d38132 [0,2,0,0,0,0|2,0,0]=4 8314 B17R1.40 CSCCOCCNC(=O)c1cccc(c1)Br 4e9f63e2462e384417862e938e05938a [0,2,0,0,0,0|2,0,0]=4 8315 B17R1.40 CSCCOCCNC(=O)c1cccc(c1)C 92196a98b13c51dfc7be84adfd9cd229 [0,2,0,0,0,0|2,0,0]=4 8316 B17R1.40 CSCCOCCNC(=O)c1cccc(c1)Cl 9b32decdcaf92ddee6a2283fad0be106 [0,2,0,0,0,0|2,0,0]=4 8317 B17R1.40 CSCNCCCNC(=O)c1cccc(c1)Br bcdcd1fdffb215b03a95739b2f1737ee [0,2,0,0,0,0|2,0,0]=4 8318 B17R1.40 C[C@@H](OCCCCCCF)c1cccc(c1)Br 51ef67d01bbf95531b1c6b1bc0319cc9 [0,2,0,0,0,0|1,0,1]=4 8319 B17R1.40 C[C@@H](OCCCCCCF)c1cccc(c1)Cl bdd402073b98636cf454fdfc1acc7c26 [0,2,0,0,0,0|1,0,1]=4 8320 B17R1.40 C[C@@H](OCCCCCCF)c1cccc(c1)F 457f0af63c8d872631bf22bc716c2d96 [0,2,0,0,0,0|1,0,1]=4 8321 B17R1.40 C[C@H](OCCCCCCF)c1cccc(c1)Br 147772f3201e4d36e9366837d33ed72e [0,2,0,0,0,0|1,0,1]=4 8322 B17R1.40 C[C@H](OCCCCCCF)c1cccc(c1)Cl b5864d632443065c75c6ce18823f0f39 [0,2,0,0,0,0|1,0,1]=4 8323 B17R1.40 C[C@H](OCCCCCCF)c1cccc(c1)F da5106d25bc873c4a0de5009f67ce01c [0,2,0,0,0,0|1,0,1]=4 8324 B17R1.40 Cc1cc(ccn1)C(=O)NCCCCCCCl 51a9ebe8c32b0e2f2fb7ffb5e7ed75bf [0,2,0,0,0,0|2,0,0]=4 8325 B17R1.40 Cc1cc(ccn1)C(=O)NCCCCCCO 8ae950e1e7485536bc96db116d75e5f3 [0,2,0,0,0,0|2,0,0]=4 8326 B17R1.40 Cc1cccc(c1)C(=O)CCCNCCCCl 897a0aa8c0b4a2f8671181cba76a9c5b [0,2,0,0,0,0|2,0,0]=4 8327 B17R1.40 Cc1cccc(c1)C(=O)CCCNCCCO 00832151ebe042efa77a22fc8828d835 [0,2,0,0,0,0|2,0,0]=4 8328 B17R1.40 Cc1cccc(c1)C(=O)CCCOCCCF 012f30e438a23f8de7408e3a6b1602b3 [0,2,0,0,0,0|2,0,0]=4 8329 B17R1.40 Cc1cccc(c1)C(=O)CNCCCCCCl 6cefba5ca6bd12a5ea85d9ca745ce0c5 [0,2,0,0,0,0|2,0,0]=4 8330 B17R1.40 Cc1cccc(c1)C(=O)CNCCCCCO d16a84315713ab6ada4385c6ec8011d7 [0,2,0,0,0,0|2,0,0]=4 8331 B17R1.40 Cc1cccc(c1)C(=O)COCCCCC#N a69aca992fd3121c106ec1c14331760b [0,2,0,0,0,0|1,0,1]=4 8332 B17R1.40 Cc1cccc(c1)C(=O)COCCCCC=O 188bef844eee9f45578265d7b3d12a81 [0,2,0,0,0,0|1,0,1]=4 8333 B17R1.40 Cc1cccc(c1)C(=O)COCCOCCF 73e7a138a9ef94f72ffb27376df834ac [0,2,0,0,0,0|2,0,0]=4 8334 B17R1.40 Cc1cccc(c1)C(=O)COCCOCCS ea0ef638e9c6f6f8fbc791ecb40e8c45 [0,2,0,0,0,0|2,0,0]=4 8335 B17R1.40 Cc1cccc(c1)C(=O)NCCCCCC#N 72660afadb09056e812b57b71e6444d9 [0,2,0,0,0,0|1,0,1]=4 8336 B17R1.40 Cc1cccc(c1)C(=O)NCCCCCCCl b27b22d9f4b7d9e74eaa38fb2959b1f3 [0,2,0,0,0,0|1,0,0]=3 8337 B17R1.40 Cc1cccc(c1)C(=O)NCCCCCCO 2229d2e43a1a088cef3366c70e458408 [0,2,0,0,0,0|1,0,0]=3 8338 B17R1.40 Cc1cccc(c1)C(=O)NCCCOCCO 888e44513fec8de683dd6efa53d3dc4e [0,2,0,0,0,0|2,0,0]=4 8339 B17R1.40 Cc1cccc(c1)C(=O)NCCOCCCF dbfcaf28e936e1fe794fd535a2593163 [0,2,0,0,0,0|2,0,0]=4 8340 B17R1.40 Cc1cccc(c1)C(=O)NCCOCCCO ab80a8da0d0d4d0578f16b731c5e9887 [0,2,0,0,0,0|2,0,0]=4 8341 B17R1.40 Cc1cccc(c1)C(=O)NCCOCCCS 1f5561599f1e44725ccf38c8175cd3f0 [0,2,0,0,0,0|2,0,0]=4 8342 B17R1.40 Cc1cccc(c1)C(=O)NCOCCCCF 428cea64464c9eeea22090238d1cb229 [0,2,0,0,0,0|2,0,0]=4 8343 B17R1.40 Cc1cccc(c1)C(C)OCCCCCCF 3b8f528b9840f175f887bb96a63effd3 [0,2,0,0,0,0|1,0,1]=4 8344 B17R1.40 Cc1cccc(c1)[C@@H](C)OCCCCCCF d23c6f118e7c52c131490a4715db0471 [0,2,0,0,0,0|1,0,1]=4 8345 B17R1.40 Cc1cccc(c1)[C@H](C)OCCCCCCF 865b7abff6d0852da73ea509b7bd62f2 [0,2,0,0,0,0|1,0,1]=4 8346 B17R1.40 Cc1cccc(n1)C(=O)NCCCCCCCl 52e423159cecfc17a1b0103cea0b1f4d [0,2,0,0,0,0|2,0,0]=4 8347 B17R1.40 Cc1cccc(n1)C(=O)NCCCCCCO 936fd8987ab6fa3105f5846892dfe16c [0,2,0,0,0,0|2,0,0]=4 8348 B17R1.40 Cc1ccnc(c1)C(=O)NCCCCCCCl 6871f48455b59c0e0ee4d7b8da6ceb87 [0,2,0,0,0,0|2,0,0]=4 8349 B17R1.40 Cc1ccnc(c1)C(=O)NCCCCCCO 2d5735168e239ed16c36e7c33920474e [0,2,0,0,0,0|2,0,0]=4 8350 B17R1.40 Cc1cncc(c1)C(=O)NCCCCCCCl a4d884e8f1588ef42d88d9ab1d086f6f [0,2,0,0,0,0|2,0,0]=4 8351 B17R1.40 Cc1cncc(c1)C(=O)NCCCCCCO a21413f9a735f5a03f0d523b657b15ea [0,2,0,0,0,0|2,0,0]=4 8352 B17R1.40 N#CCCCCCNC(=O)c1cccc(c1)Br cdfa161eb43b4b2e230f9666f10a2b49 [0,2,0,0,0,0|1,0,1]=4 8353 B17R1.40 N#CCCCCCNC(=O)c1cccc(c1)Cl 07a3e295ee6cd0b83ffa55b5d8115ba7 [0,2,0,0,0,0|1,0,1]=4 8354 B17R1.40 N#CCCCCCNC(=O)c1cccc(c1)F aefbad21128530d2745cb0fd8c9880c4 [0,2,0,0,0,0|1,0,1]=4 8355 B17R1.40 N#CCCCCCNC(=O)c1cccc(c1)I f29f4b51b228a43a256a2731616e371a [0,2,0,0,0,0|1,0,1]=4 8356 B17R1.40 N#CCCCCCNC(=O)c1cccc(c1)O 39ba02130263d89ab2fe7ce2ad4180ee [0,2,0,0,0,0|1,0,1]=4 8357 B17R1.40 N#CCCCCCNC(=O)c1cccc(c1)S e266099047ea239221ddd6e219f95550 [0,2,0,0,0,0|1,0,1]=4 8358 B17R1.40 N#CCCCCOCC(=O)c1cccc(c1)Br 234c6899ba358434257bfdb610f9c738 [0,2,0,0,0,0|1,0,1]=4 8359 B17R1.40 N#CCCCCOCC(=O)c1cccc(c1)Cl 3ea7d4adabbeab23eed4ca0c93ee2eea [0,2,0,0,0,0|1,0,1]=4 8360 B17R1.40 N#CCCCCOCC(=O)c1cccc(c1)F 4c1f03dbec2df4410230ac267af12cf9 [0,2,0,0,0,0|1,0,1]=4 8361 B17R1.40 N#CCCCCOCC(=O)c1cccc(c1)I 6a6035df6ff64266be2b734eb2245f5c [0,2,0,0,0,0|1,0,1]=4 8362 B17R1.40 O=C(CCCNCCCCl)c1cccc(c1)F 5c83094e99ee7bf42dccb4c65fc8bc3b [0,2,0,0,0,0|2,0,0]=4 8363 B17R1.40 O=C(CCCNCCCO)c1cccc(c1)F 61adfe3eea5f4365df74ed4f0beee530 [0,2,0,0,0,0|2,0,0]=4 8364 B17R1.40 O=C(CCCOCCCF)c1cccc(c1)F 131310b40216742e4536778cecbf077f [0,2,0,0,0,0|2,0,0]=4 8365 B17R1.40 O=C(CNCCCCCCl)c1cccc(c1)Br 274199a028d2f5567902a6c52a26924f [0,2,0,0,0,0|2,0,0]=4 8366 B17R1.40 O=C(CNCCCCCCl)c1cccc(c1)Cl 82dcaad21ef62ed5eaeeedbabe68b1d9 [0,2,0,0,0,0|2,0,0]=4 8367 B17R1.40 O=C(CNCCCCCCl)c1cccc(c1)F 4cd34b2b5c6110c3d1cfe484c3fd17ce [0,2,0,0,0,0|2,0,0]=4 8368 B17R1.40 O=C(CNCCCCCCl)c1cccc(c1)I e8b5ae3932e6bea88111bf1c4c140751 [0,2,0,0,0,0|2,0,0]=4 8369 B17R1.40 O=C(CNCCCCCO)c1cccc(c1)Br 6ada6cb223b0f89c9166851e1e8ac337 [0,2,0,0,0,0|2,0,0]=4 8370 B17R1.40 O=C(CNCCCCCO)c1cccc(c1)Cl 409be0c234404620a7ea3085ed777a8f [0,2,0,0,0,0|2,0,0]=4 8371 B17R1.40 O=C(CNCCCCCO)c1cccc(c1)F 7d612a6b63d41250b44067cdd367f4e2 [0,2,0,0,0,0|2,0,0]=4 8372 B17R1.40 O=C(CNCCCCCO)c1cccc(c1)I 89665ceb49c6229e4b0c7ed3401241ad [0,2,0,0,0,0|2,0,0]=4 8373 B17R1.40 O=C(COCCCCCF)c1cccc(c1)Br 24670f2c1d9704ccef93c725f39c71ce [0,2,0,0,0,0|1,0,0]=3 8374 B17R1.40 O=C(COCCCCCF)c1cccc(c1)Cl 2b7527fa0ab208e116599305311f4f0e [0,2,0,0,0,0|1,0,0]=3 8375 B17R1.40 O=C(COCCCCCF)c1cccc(c1)F f9df679da4c206423374dd3b5ed5f724 [0,2,0,0,0,0|1,0,0]=3 8376 B17R1.40 O=C(COCCOCCF)c1cccc(c1)Br b5b0c4d78562f47bbe63fce0ff62535b [0,2,0,0,0,0|2,0,0]=4 8377 B17R1.40 O=C(COCCOCCF)c1cccc(c1)Cl 8c5455c3b6216858ae5287528bec354e [0,2,0,0,0,0|2,0,0]=4 8378 B17R1.40 O=C(COCCOCCF)c1cccc(c1)F d5ec9f4cc9a3bf677d545a0273ef075d [0,2,0,0,0,0|2,0,0]=4 8379 B17R1.40 O=C(COCCOCCF)c1cccc(c1)I 6bfe31cb23b2a191d5928a4f456abb97 [0,2,0,0,0,0|2,0,0]=4 8380 B17R1.40 O=C(COCCOCCS)c1cccc(c1)Br 6ede0ba36f2c289f1e3665a3a8849986 [0,2,0,0,0,0|2,0,0]=4 8381 B17R1.40 O=C(COCCOCCS)c1cccc(c1)Cl 9810e9894fcf957ff51f1065caad48bc [0,2,0,0,0,0|2,0,0]=4 8382 B17R1.40 O=C(COCCOCCS)c1cccc(c1)F 3d30900419c6fa496afd9139a9f60002 [0,2,0,0,0,0|2,0,0]=4 8383 B17R1.40 O=C(COCCOCCS)c1cccc(c1)I 6a6f4b59ebf29039002086b05eeff7d6 [0,2,0,0,0,0|2,0,0]=4 8384 B17R1.40 O=C(NCCCCCCCl)c1cc(=O)cco1 9ffae15bebe2982343ee19118059d786 [0,2,0,0,0,0|2,0,0]=4 8385 B17R1.40 O=C(NCCCCCCCl)c1cc(ccn1)Br d60d8bca134399f51b86d7bcdc4e22b0 [0,2,0,0,0,0|2,0,0]=4 8386 B17R1.40 O=C(NCCCCCCCl)c1cc(ccn1)Cl 3e5d3c87f10832538b57efd487146b91 [0,2,0,0,0,0|2,0,0]=4 8387 B17R1.40 O=C(NCCCCCCCl)c1cc(ccn1)F f2438cb70ed6c540aad4036af9c013a3 [0,2,0,0,0,0|2,0,0]=4 8388 B17R1.40 O=C(NCCCCCCCl)c1cc(ccn1)I a6856a5361021d5173198bf474b4f54d [0,2,0,0,0,0|2,0,0]=4 8389 B17R1.40 O=C(NCCCCCCCl)c1cc(ccn1)O 09b90e64feee6e955348f6cad04667a7 [0,2,0,0,0,0|2,0,0]=4 8390 B17R1.40 O=C(NCCCCCCCl)c1ccc[n+](c1)[O-] 72f9fcb32eda41b970b9127dd8b8f3e4 [0,2,0,0,0,0|2,0,0]=4 8391 B17R1.40 O=C(NCCCCCCCl)c1cccc(c1)Br 710356a09d02e5f0bd66f6e1714150ae [0,2,0,0,0,0|1,0,0]=3 8392 B17R1.40 O=C(NCCCCCCCl)c1cccc(c1)Cl 58f9f85d22363f6b091f8327e44e7016 [0,2,0,0,0,0|1,0,0]=3 8393 B17R1.40 O=C(NCCCCCCCl)c1cccc(c1)F 952e4e5006ef0feb74cdf786b4b5fb4f [0,2,0,0,0,0|1,0,0]=3 8394 B17R1.40 O=C(NCCCCCCCl)c1cccc(c1)I fb80d38f80ce70ca4855517e62f45dfa [0,2,0,0,0,0|1,0,0]=3 8395 B17R1.40 O=C(NCCCCCCCl)c1cccc(c1)O a47d290a5a68763ebc3667f228cbd58e [0,2,0,0,0,0|1,0,0]=3 8396 B17R1.40 O=C(NCCCCCCCl)c1cccc(c1)S 17b0f98222050a6e8894539c85ea2491 [0,2,0,0,0,0|1,0,0]=3 8397 B17R1.40 O=C(NCCCCCCCl)c1cccc(n1)Br 0cf4cfe37dcdccb855a7a7952cd50e9b [0,2,0,0,0,0|2,0,0]=4 8398 B17R1.40 O=C(NCCCCCCCl)c1cccc(n1)Cl 653889215642ca238cf4ba3b41241b00 [0,2,0,0,0,0|2,0,0]=4 8399 B17R1.40 O=C(NCCCCCCCl)c1cccc(n1)F ec629110a2a7665c9ec451ddab3c4837 [0,2,0,0,0,0|2,0,0]=4 8400 B17R1.40 O=C(NCCCCCCCl)c1cccc(n1)I c2416e6ceb450eba004a6a21fd2628cc [0,2,0,0,0,0|2,0,0]=4 8401 B17R1.40 O=C(NCCCCCCCl)c1cccc(n1)O 93c6923bcd3bdd2c816bcc9bf442a1f3 [0,2,0,0,0,0|2,0,0]=4 8402 B17R1.40 O=C(NCCCCCCCl)c1ccnc(c1)Br 6a8f335ba0ad2e1cd1f3ad60951451d6 [0,2,0,0,0,0|2,0,0]=4 8403 B17R1.40 O=C(NCCCCCCCl)c1ccnc(c1)Cl bbed93e7c31b9f65f9d889cee9d7a8da [0,2,0,0,0,0|2,0,0]=4 8404 B17R1.40 O=C(NCCCCCCCl)c1ccnc(c1)F 8a1efa9769e21aab2b7ac573c2e1ea3b [0,2,0,0,0,0|2,0,0]=4 8405 B17R1.40 O=C(NCCCCCCCl)c1ccnc(c1)I b1aadd3a90019cfd08598d77a304427a [0,2,0,0,0,0|2,0,0]=4 8406 B17R1.40 O=C(NCCCCCCCl)c1ccnc(c1)O 407811da787a7ce7433a88717eac7ebc [0,2,0,0,0,0|2,0,0]=4 8407 B17R1.40 O=C(NCCCCCCCl)c1ccnc(c1)S e77dc2071658bd1415da3330f1c96bc1 [0,2,0,0,0,0|2,0,0]=4 8408 B17R1.40 O=C(NCCCCCCCl)c1cncc(c1)Br b1050cc5b3c5d66ed0a1104b601e7a0e [0,2,0,0,0,0|2,0,0]=4 8409 B17R1.40 O=C(NCCCCCCCl)c1cncc(c1)Cl f639a496850ce55831536b14399b5b67 [0,2,0,0,0,0|2,0,0]=4 8410 B17R1.40 O=C(NCCCCCCCl)c1cncc(c1)F d4e1d9b105ddb77cab52399d69c96417 [0,2,0,0,0,0|2,0,0]=4 8411 B17R1.40 O=C(NCCCCCCCl)c1cncc(c1)I afbd95317157f873ce9343e5051cc38f [0,2,0,0,0,0|2,0,0]=4 8412 B17R1.40 O=C(NCCCCCCCl)c1cncc(c1)O 9586d2e1f4f9edba9e5e27837f7b83e6 [0,2,0,0,0,0|2,0,0]=4 8413 B17R1.40 O=C(NCCCCCCO)c1cc(=O)cco1 0d81e50d3c681bcd3c21639943371384 [0,2,0,0,0,0|2,0,0]=4 8414 B17R1.40 O=C(NCCCCCCO)c1cc(ccn1)Br cf8a6fdf1e461eff24efff11b23eb54a [0,2,0,0,0,0|2,0,0]=4 8415 B17R1.40 O=C(NCCCCCCO)c1cc(ccn1)Cl 03527913ed19a42f8b33d30eee21c19f [0,2,0,0,0,0|2,0,0]=4 8416 B17R1.40 O=C(NCCCCCCO)c1cc(ccn1)F 16f34dff9891c42ba0c2231f4f680513 [0,2,0,0,0,0|2,0,0]=4 8417 B17R1.40 O=C(NCCCCCCO)c1cc(ccn1)I 47b7cfe5ba82f080015917b041c7a63e [0,2,0,0,0,0|2,0,0]=4 8418 B17R1.40 O=C(NCCCCCCO)c1cc(ccn1)O 49d2ac5fb22ff7625da8d3132c203371 [0,2,0,0,0,0|2,0,0]=4 8419 B17R1.40 O=C(NCCCCCCO)c1ccc[n+](c1)[O-] 246565bd2328c22be5bd3dc6dbd22a2a [0,2,0,0,0,0|2,0,0]=4 8420 B17R1.40 O=C(NCCCCCCO)c1cccc(c1)Br 71a9e94bf75a92a97778b098a4ffe5bf [0,2,0,0,0,0|1,0,0]=3 8421 B17R1.40 O=C(NCCCCCCO)c1cccc(c1)Cl f7632b3e00e147a7be3ec70a0917e0bf [0,2,0,0,0,0|1,0,0]=3 8422 B17R1.40 O=C(NCCCCCCO)c1cccc(c1)F 48fc549e9dd309d318c6f0d916790a90 [0,2,0,0,0,0|1,0,0]=3 8423 B17R1.40 O=C(NCCCCCCO)c1cccc(c1)I 71354a3414389a4375ea6ddf92acd760 [0,2,0,0,0,0|1,0,0]=3 8424 B17R1.40 O=C(NCCCCCCO)c1cccc(c1)O 9dd851306c82eed44c61a0906a759301 [0,2,0,0,0,0|1,0,0]=3 8425 B17R1.40 O=C(NCCCCCCO)c1cccc(c1)S 2ed7e63e543b3d96646ed2015b43272a [0,2,0,0,0,0|1,0,0]=3 8426 B17R1.40 O=C(NCCCCCCO)c1cccc(n1)Br 04eaed3a9d56a4ceea20d2edc3d89ef8 [0,2,0,0,0,0|2,0,0]=4 8427 B17R1.40 O=C(NCCCCCCO)c1cccc(n1)Cl ae74780e9a4863522a219dbcd0986095 [0,2,0,0,0,0|2,0,0]=4 8428 B17R1.40 O=C(NCCCCCCO)c1cccc(n1)F 9ed94ac9944ebf48143060525dc0dfa3 [0,2,0,0,0,0|2,0,0]=4 8429 B17R1.40 O=C(NCCCCCCO)c1cccc(n1)I 126b2f346d7dcea6aeec0d1dec4cd8ea [0,2,0,0,0,0|2,0,0]=4 8430 B17R1.40 O=C(NCCCCCCO)c1cccc(n1)O 7229295bbb140579ca9408e5f4a8f18c [0,2,0,0,0,0|2,0,0]=4 8431 B17R1.40 O=C(NCCCCCCO)c1ccnc(c1)Br efaaa66396dab013a1ca86e312e13b79 [0,2,0,0,0,0|2,0,0]=4 8432 B17R1.40 O=C(NCCCCCCO)c1ccnc(c1)Cl e66c5b7c7f51dbe82d4cbcd92208d504 [0,2,0,0,0,0|2,0,0]=4 8433 B17R1.40 O=C(NCCCCCCO)c1ccnc(c1)F 78d572c15d9aa5706829cc22ab76c417 [0,2,0,0,0,0|2,0,0]=4 8434 B17R1.40 O=C(NCCCCCCO)c1ccnc(c1)I 9886475972a897576123a3500c83c6fd [0,2,0,0,0,0|2,0,0]=4 8435 B17R1.40 O=C(NCCCCCCO)c1ccnc(c1)O b4b7143a9698203f9dd3eae0e903c608 [0,2,0,0,0,0|2,0,0]=4 8436 B17R1.40 O=C(NCCCCCCO)c1ccnc(c1)S 7eb0df3358c708d7ecba75609e411349 [0,2,0,0,0,0|2,0,0]=4 8437 B17R1.40 O=C(NCCCCCCO)c1cncc(c1)Br 2414cee280dfd73c6ef339e2fdcd7bca [0,2,0,0,0,0|2,0,0]=4 8438 B17R1.40 O=C(NCCCCCCO)c1cncc(c1)Cl 75d3bc3e592b68e89640bf65ebb9fe44 [0,2,0,0,0,0|2,0,0]=4 8439 B17R1.40 O=C(NCCCCCCO)c1cncc(c1)F bba69dab8de6288782d8308817d54da9 [0,2,0,0,0,0|2,0,0]=4 8440 B17R1.40 O=C(NCCCCCCO)c1cncc(c1)I 6bfe8432412be1e9e029640a38ae5888 [0,2,0,0,0,0|2,0,0]=4 8441 B17R1.40 O=C(NCCCCCCO)c1cncc(c1)O 8787e14e9d0797f9b7c0b8515a0773f0 [0,2,0,0,0,0|2,0,0]=4 8442 B17R1.40 O=C(NCCCNCCF)c1cccc(c1)Br f5e92fc5225b00aff75ee27272506eb5 [0,2,0,0,0,0|2,0,0]=4 8443 B17R1.40 O=C(NCCCNCCO)c1cccc(c1)Br 39c0f7b430097cd9aad16a17ee971d36 [0,2,0,0,0,0|2,0,0]=4 8444 B17R1.40 O=C(NCCCNCCS)c1cccc(c1)Br 099a9e9c82aafedaca587b6634e5a0a5 [0,2,0,0,0,0|2,0,0]=4 8445 B17R1.40 O=C(NCCCOCCO)c1cccc(c1)Br 6ed549dec1f9f67d0ad888c911584726 [0,2,0,0,0,0|2,0,0]=4 8446 B17R1.40 O=C(NCCCOCCO)c1cccc(c1)Cl afa12047c6f27290989c446d77867e8b [0,2,0,0,0,0|2,0,0]=4 8447 B17R1.40 O=C(NCCCOCCO)c1cccc(c1)F 5e8bea02ae906bf631f46247e44ac085 [0,2,0,0,0,0|2,0,0]=4 8448 B17R1.40 O=C(NCCCOCCO)c1cccc(c1)I 99fdd6d645c7a8f76fc47838065d432b [0,2,0,0,0,0|2,0,0]=4 8449 B17R1.40 O=C(NCCCOCCO)c1cccc(c1)O 74cc66547ba51698a6d829b58edb94b2 [0,2,0,0,0,0|2,0,0]=4 8450 B17R1.40 O=C(NCCCOCCO)c1cccc(c1)S ddad96459615bcaa7ca8e8e53e4beebc [0,2,0,0,0,0|2,0,0]=4 8451 B17R1.40 O=C(NCCOCCCF)c1cccc(c1)Br 5de2dd823c39b4b83793045a3dab489f [0,2,0,0,0,0|2,0,0]=4 8452 B17R1.40 O=C(NCCOCCCF)c1cccc(c1)Cl aa1ab844ddac9235574eb2b9c1b2153f [0,2,0,0,0,0|2,0,0]=4 8453 B17R1.40 O=C(NCCOCCCO)c1cccc(c1)Br 7ea0dd9c3a7078bf52fa9a942f8263e8 [0,2,0,0,0,0|2,0,0]=4 8454 B17R1.40 O=C(NCCOCCCO)c1cccc(c1)Cl 5c2c46a3a40d84b99dc7ee2d5fbafbfc [0,2,0,0,0,0|2,0,0]=4 8455 B17R1.40 O=C(NCCOCCCO)c1cccc(c1)F c41e9e15eafdbeb6d9b533f92c54b453 [0,2,0,0,0,0|2,0,0]=4 8456 B17R1.40 O=C(NCCOCCCO)c1cccc(c1)I ae4985b468eaa9ca7771b7b4fa85a6eb [0,2,0,0,0,0|2,0,0]=4 8457 B17R1.40 O=C(NCCOCCCO)c1cccc(c1)O c17fad40adc629f081e1e942f3a7534d [0,2,0,0,0,0|2,0,0]=4 8458 B17R1.40 O=C(NCCOCCCO)c1cccc(c1)S a4c329889c772b77a7610a2fa46e5937 [0,2,0,0,0,0|2,0,0]=4 8459 B17R1.40 O=C(NCCOCCCS)c1cccc(c1)Br 0cebefef113f0b7f0a140d4cf40ba052 [0,2,0,0,0,0|2,0,0]=4 8460 B17R1.40 O=C(NCCOCCCS)c1cccc(c1)Cl 14b157857111f5268398ad8afaee2ed3 [0,2,0,0,0,0|2,0,0]=4 8461 B17R1.40 O=CCCCCOCC(=O)c1cccc(c1)Br a93ae20bf874143785fae6614a29ea26 [0,2,0,0,0,0|1,0,1]=4 8462 B17R1.40 O=CCCCCOCC(=O)c1cccc(c1)Cl bdf285f96047ca223b004b7880ee41c8 [0,2,0,0,0,0|1,0,1]=4 8463 B17R1.40 O=CCCCCOCC(=O)c1cccc(c1)F f1ad960fba5df28dce315709032d02fc [0,2,0,0,0,0|1,0,1]=4 8464 B17R1.40 O=CCCCCOCC(=O)c1cccc(c1)I 0af13e3f020048331297ce39eddd1bc2 [0,2,0,0,0,0|1,0,1]=4 8465 B17R1.679 C/C(=C/COCCOC(=O)c1ccccc1)/Cl 91ef2581d34c8c5dd26da8a768f7f666 [0,2,0,0,0,0|0,0,2]=4 8466 B17R1.679 C/C(=C/COCCOC(=O)c1ccccc1)/I c1120ff074203fd6a14d6364eb6285fd [0,2,0,0,0,0|0,0,2]=4 8467 B17R1.679 C/C(=C\COCCOC(=O)c1ccccc1)/Cl 0c45200a5d77a49300fa8692d2600d2b [0,2,0,0,0,0|0,0,2]=4 8468 B17R1.679 C=C(Br)CCOCCOC(=O)c1ccccc1 d2a23a9542151155cf3eda6880e5696a [0,2,0,0,0,0|0,0,2]=4 8469 B17R1.679 C=C(C)CCCOCCC(=O)c1ccccc1 367ea89eae63b4ecc1561369b523a1c8 [0,2,0,0,0,0|1,0,1]=4 8470 B17R1.679 C=C(C)CCCOCNC(=O)c1ccccc1 0a69bc8fd6d930b7a7863e286dd7b65d [0,2,0,0,0,0|1,0,1]=4 8471 B17R1.679 C=C(C)CCNCCOC(=O)c1ccccc1 a269579b8d25d82c80094c714b23d161 [0,2,0,0,0,0|0,0,1]=3 8472 B17R1.679 C=C(C)CCOCCCC(=O)c1ccccc1 e829fab4ca29df844443ed0b749923fc [0,2,0,0,0,0|1,0,1]=4 8473 B17R1.679 C=C(C)CCOCCNC(=O)c1ccccc1 da5793b0769355b2e0a3d679bf7e4b76 [0,2,0,0,0,0|1,0,1]=4 8474 B17R1.679 C=C(C)CCOCCOC(=O)c1ccccc1 2e5191f057cf4549bba5578db06834a0 [0,2,0,0,0,0|0,0,1]=3 8475 B17R1.679 C=C(C)CCOCCOC(=O)c1cccnc1 a9bfd91f7bb848d09de017a0ee6e5e9f [0,2,0,0,0,0|1,0,1]=4 8476 B17R1.679 C=C(C)CNCCCOC(=O)c1ccccc1 66d3c302575df7d19e5b3c7516d299f4 [0,2,0,0,0,0|0,0,1]=3 8477 B17R1.679 C=C(C)COCCCNC(=O)c1ccccc1 e18410868b1e1dc07aa8a5d2be964cb7 [0,2,0,0,0,0|1,0,1]=4 8478 B17R1.679 C=C(C)COCCOCC(=O)c1ccccc1 c20113c29b0d8ea2874a2a916b9bc4d9 [0,2,0,0,0,0|1,0,1]=4 8479 B17R1.679 C=C(COCCCCC(=O)C)c1ccccc1 d6e491c3fbe84ca694b3db15d22564ca [0,2,0,0,0,0|1,0,1]=4 8480 B17R1.679 C=C(COCCCCC(C)C)c1ccccc1 47651011613ba16024fd5087729e621e [0,2,0,0,0,0|1,0,0]=3 8481 B17R1.679 C=C(COCCCCC(C)C)c1ccccn1 96d0ecc983fe7debcf3124c556779605 [0,2,0,0,0,0|2,0,0]=4 8482 B17R1.679 C=C(COCCCCN(C)C)c1ccccc1 323bff186e03b1b0f3c4d65cf7940a3a [0,2,0,0,0,0|2,0,0]=4 8483 B17R1.679 C=C(COCCCOC(C)C)c1ccccc1 0734ccdd2a86cbe655db404cc5aed6a6 [0,2,0,0,0,0|2,0,0]=4 8484 B17R1.679 C=C(COCCCSC(C)C)c1ccccc1 1dee885271ddf6dd5eb50d89637ff3f5 [0,2,0,0,0,0|2,0,0]=4 8485 B17R1.679 C=C(COCCOCC(C)C)c1ccccc1 e3df4ac7ae13861482a44563f889070c [0,2,0,0,0,0|2,0,0]=4 8486 B17R1.679 C=C(COCCSCC(C)C)c1ccccc1 5aa259748d696eff057cab6389d21e79 [0,2,0,0,0,0|2,0,0]=4 8487 B17R1.679 CC(=CCNCCOC(=O)c1ccccc1)C f7cd7bf4ee7df5cc2605ed3d1c22a5a6 [0,2,0,0,0,0|0,0,2]=4 8488 B17R1.679 CC(=CCOCCOC(=O)c1ccccc1)C e3843fafbadeef6c054908cbb2267c5c [0,2,0,0,0,0|0,0,2]=4 8489 B17R1.679 CC(=CCOCCOC(=O)c1ccccc1)Cl d2bc19f98bd1ddb2f819b489a0b75343 [0,2,0,0,0,0|0,0,2]=4 8490 B17R1.679 CC(=CCOCCOC(=O)c1ccccc1)I b5ba26e685ca228f410e01446b987838 [0,2,0,0,0,0|0,0,2]=4 8491 B17R1.679 CC(=O)CCCCCOC(C)c1ccccc1 05608aa37b3183ae5966c5004c412a81 [0,2,0,0,0,0|1,0,1]=4 8492 B17R1.679 CC(=O)CCCCCO[C@@H](C)c1ccccc1 12272887949d623134a1d54f85cce280 [0,2,0,0,0,0|1,0,1]=4 8493 B17R1.679 CC(=O)CCCCCO[C@H](C)c1ccccc1 7f515d8f3491b1702105d427f14b7552 [0,2,0,0,0,0|1,0,1]=4 8494 B17R1.679 CC(=O)CCCCNCC(=O)c1ccccc1 9dc10dfdb8f7432e63a87e5c6b0b142d [0,2,0,0,0,0|1,0,1]=4 8495 B17R1.679 CC(=O)CCCCOCC(=O)c1ccccc1 5c45b249d64d91d5350b235e0c016039 [0,2,0,0,0,0|0,0,1]=3 8496 B17R1.679 CC(=O)CCCCOCC(=O)c1ccccn1 30309cf2954e3bd5f349c5409dea54eb [0,2,0,0,0,0|1,0,1]=4 8497 B17R1.679 CC(=O)CCCCOCC(=O)c1cccnc1 49adc673014f44cb4d507a1cd594b467 [0,2,0,0,0,0|1,0,1]=4 8498 B17R1.679 CC(=O)CCCOCCC(=O)c1ccccc1 b0458630ccd5e2105ab545b150a63c50 [0,2,0,0,0,0|1,0,1]=4 8499 B17R1.679 CC(=O)CCCOCNC(=O)c1ccccc1 93af41e80d58913d2cc7668393a89560 [0,2,0,0,0,0|1,0,1]=4 8500 B17R1.679 CC(=O)CCCOCOC(=O)c1ccccc1 a90fece9bd265b363b6d2b9089627e03 [0,2,0,0,0,0|0,0,1]=3 8501 B17R1.679 CC(=O)CCOCCCC(=O)c1ccccc1 b5fd8116e4b8e9e1b3cfbe52b450a797 [0,2,0,0,0,0|1,0,1]=4 8502 B17R1.679 CC(=O)CCOCCNC(=O)c1ccccc1 cc46908640fd3acf320831dfe97d536d [0,2,0,0,0,0|1,0,1]=4 8503 B17R1.679 CC(=O)CCOCCOC(=O)c1ccccc1 4e199569a05b254776c100c8f5ace5a2 [0,2,0,0,0,0|0,0,1]=3 8504 B17R1.679 CC(=O)CCOCCOC(=O)c1cccnc1 1a790aef7c0c156b142be156b4074406 [0,2,0,0,0,0|1,0,1]=4 8505 B17R1.679 CC(=O)NCCCCNC(=O)c1ccccc1 72765e49529a30269ada18de63ab3fbf [0,2,0,0,0,0|1,0,1]=4 8506 B17R1.679 CC(=O)NCCCOCC(=O)c1ccccc1 35e4e27c193a4c9a4393bed6105c8baf [0,2,0,0,0,0|1,0,1]=4 8507 B17R1.679 CC(=O)NCCNCOC(=O)c1ccccc1 1e55c211a6fe25f3afe4c23e3e83066f [0,2,0,0,0,0|1,0,1]=4 8508 B17R1.679 CC(=O)NCCOCOC(=O)c1ccccc1 d2455590d69980c3f2d4a921d98f498f [0,2,0,0,0,0|1,0,1]=4 8509 B17R1.679 CC(=O)NCOCCOC(=O)c1ccccc1 2cfed3c9a879cb22f393143dd8cd543d [0,2,0,0,0,0|1,0,1]=4 8510 B17R1.679 CC(=O)OCCCOCC(=O)c1ccccc1 db9f39c9449d005bdc5208032d281de6 [0,2,0,0,0,0|1,0,1]=4 8511 B17R1.679 CC(=O)OCCOCOC(=O)c1ccccc1 3ef14b572847630a78a135ddb27775b0 [0,2,0,0,0,0|1,0,1]=4 8512 B17R1.679 CC(=O)OCOCCOC(=O)c1ccccc1 fc34edf44986ca3682c0b8456d6357a8 [0,2,0,0,0,0|1,0,1]=4 8513 B17R1.679 CC(=O)SCCCOCC(=O)c1ccccc1 bb7e8915f83ab6f4b8e2490d03e0f953 [0,2,0,0,0,0|1,0,1]=4 8514 B17R1.679 CC(=S)OCCCOCC(=O)c1ccccc1 2069378ed52902b913088c05e9e23d10 [0,2,0,0,0,0|1,0,1]=4 8515 B17R1.679 CC(C)CCCCCNC(=O)c1ccccc1 dfabf308aa173df3850d38f37c9d95c0 [0,2,0,0,0,0|1,0,0]=3 8516 B17R1.679 CC(C)CCCCCNC(=O)c1ccccn1 ec1131c04fe5c413d0a15dfb1fbd642b [0,2,0,0,0,0|2,0,0]=4 8517 B17R1.679 CC(C)CCCCCNC(=O)c1cccnc1 e37e211840ad7e2e09b92402debf9aad [0,2,0,0,0,0|2,0,0]=4 8518 B17R1.679 CC(C)CCCCCNC(=O)c1ccncc1 2142f61829358ee4b5b4f348791e7032 [0,2,0,0,0,0|2,0,0]=4 8519 B17R1.679 CC(C)CCCCCOC(C)c1ccccc1 46a3006fec0c81ab1b77f7f6976b3e2d [0,2,0,0,0,0|1,0,1]=4 8520 B17R1.679 CC(C)CCCCCO[C@@H](C)c1ccccc1 2af0082405a2df5b52734db965eaa06c [0,2,0,0,0,0|1,0,1]=4 8521 B17R1.679 CC(C)CCCCCO[C@H](C)c1ccccc1 2d0aa1a0cab3ff02e6571b165fb5610b [0,2,0,0,0,0|1,0,1]=4 8522 B17R1.679 CC(C)CCCCNCC(=O)c1ccccc1 84a12c765e3889bcad23e2d57e9362b4 [0,2,0,0,0,0|1,0,0]=3 8523 B17R1.679 CC(C)CCCCOCC(=O)c1ccccc1 464ee2a4de8aa56bc41836a1279f7d30 [0,2,0,0,0,0|0,0,0]=2 8524 B17R1.679 CC(C)CCCCOCC(=O)c1ccccn1 44177b81a348db4d94212bc28bd8b718 [0,2,0,0,0,0|1,0,0]=3 8525 B17R1.679 CC(C)CCCCOCC(=O)c1cccnc1 ac2305c5b7bf9095a4c35a9074acc696 [0,2,0,0,0,0|1,0,0]=3 8526 B17R1.679 CC(C)CCCCOCC(=O)c1ccncn1 b04d701c8576a720b9ca55103dbfab75 [0,2,0,0,0,0|2,0,0]=4 8527 B17R1.679 CC(C)CCCCOCC(=O)c1cnccn1 c5d4deb55a3520ca12a312e65afe09f2 [0,2,0,0,0,0|2,0,0]=4 8528 B17R1.679 CC(C)CCCCOCC(C)c1ccccc1 6d4d69a832aed0d6a60aa08a5a7d84df [0,2,0,0,0,0|1,0,1]=4 8529 B17R1.679 CC(C)CCCCOCC(F)c1ccccc1 a35b1eb13e31d0e3bf585f54f1ef72b3 [0,2,0,0,0,0|1,0,1]=4 8530 B17R1.679 CC(C)CCCCOC[C@@H](C)c1ccccc1 2d8e3b8e010c1ada0be13f34df40fd46 [0,2,0,0,0,0|1,0,1]=4 8531 B17R1.679 CC(C)CCCCOC[C@H](C)c1ccccc1 1c52106411ed693d8b37be26372fa6ec [0,2,0,0,0,0|1,0,1]=4 8532 B17R1.679 CC(C)CCCNCOC(=O)c1ccccc1 a377df1829388ba00045568f91551b06 [0,2,0,0,0,0|0,0,0]=2 8533 B17R1.679 CC(C)CCCOCCC(=O)c1ccccc1 b2715aa9313e42b19f001acfa40ec615 [0,2,0,0,0,0|1,0,0]=3 8534 B17R1.679 CC(C)CCCOCCS(=O)c1ccccc1 1dffdd84ac3696e50561426fadf435f9 [0,2,0,0,0,0|2,0,0]=4 8535 B17R1.679 CC(C)CCCOCNC(=O)c1ccccc1 c6863aa2ab3bae67a691a72f59e91d07 [0,2,0,0,0,0|1,0,0]=3 8536 B17R1.679 CC(C)CCCOCNC(=O)c1cccnc1 a3c0d50f840ab28ab85b12ed67ed47e3 [0,2,0,0,0,0|2,0,0]=4 8537 B17R1.679 CC(C)CCCOCOC(=O)c1ccccc1 c1a8ba32dc01f5e8fa3ecffe6fbe3f9c [0,2,0,0,0,0|0,0,0]=2 8538 B17R1.679 CC(C)CCNCCNC(=O)c1ccccc1 2c14b475a3d24557e91a9ba349827b62 [0,2,0,0,0,0|1,0,0]=3 8539 B17R1.679 CC(C)CCNCCNC(=O)c1ccccn1 0ed027462ea631c3f2a69f736a12d1fb [0,2,0,0,0,0|2,0,0]=4 8540 B17R1.679 CC(C)CCNCCNC(=O)c1ccncc1 1795bf59fbdf17d6f67573e6f6b296c0 [0,2,0,0,0,0|2,0,0]=4 8541 B17R1.679 CC(C)CCNCCOC(=O)c1ccccc1 36df250e17a559f876e09211d5e0c37b [0,2,0,0,0,0|0,0,0]=2 8542 B17R1.679 CC(C)CCOCCCC(=O)c1ccccc1 3c0c0723d0b859033c2142ab4fba9f70 [0,2,0,0,0,0|1,0,0]=3 8543 B17R1.679 CC(C)CCOCCCC(=O)c1cccnc1 6ddec98aedd846274ad4e1a0c903c07b [0,2,0,0,0,0|2,0,0]=4 8544 B17R1.679 CC(C)CCOCCNC(=O)c1ccccc1 9f1136b4bae43ba976146a05f0ed3598 [0,2,0,0,0,0|1,0,0]=3 8545 B17R1.679 CC(C)CCOCCNC(=O)c1ccccn1 cb79ba22bf5880ada690f8cbd0a39614 [0,2,0,0,0,0|2,0,0]=4 8546 B17R1.679 CC(C)CCOCCNC(=O)c1cccnc1 2da83a9e0e418d5b0f0b8cdf3d25f7a6 [0,2,0,0,0,0|2,0,0]=4 8547 B17R1.679 CC(C)CCOCCNC(=O)c1ccncc1 f638466c2b7f34fc0d8eef2324eff627 [0,2,0,0,0,0|2,0,0]=4 8548 B17R1.679 CC(C)CCOCCOC(=O)c1ccccc1 462eeb2096f601cc95c3111528deee8b [0,2,0,0,0,0|0,0,0]=2 8549 B17R1.679 CC(C)CCOCCOC(=O)c1cccnc1 2bdc2b544bf6db8f1ee1fd3353bb78bc [0,2,0,0,0,0|1,0,0]=3 8550 B17R1.679 CC(C)COCCCNC(=O)c1ccccc1 dcc0135aa1e47e090c5f83902a11c2e3 [0,2,0,0,0,0|1,0,0]=3 8551 B17R1.679 CC(C)COCCCNC(=O)c1ccccn1 76b0ff5175de403aa3e294b569fe6973 [0,2,0,0,0,0|2,0,0]=4 8552 B17R1.679 CC(C)COCCCNC(=O)c1cccnc1 b06c7c162c546de17190d26c968c314a [0,2,0,0,0,0|2,0,0]=4 8553 B17R1.679 CC(C)COCCCNC(=O)c1ccncc1 82a91f2c7875b676dc8735fd40c12a1b [0,2,0,0,0,0|2,0,0]=4 8554 B17R1.679 CC(C)COCCNCC(=O)c1ccccc1 ec7735fa4009fe22c18d7432ae94476f [0,2,0,0,0,0|2,0,0]=4 8555 B17R1.679 CC(C)COCCOCC(=O)c1ccccc1 43dd419d3b5bee846d81134669e82d0c [0,2,0,0,0,0|1,0,0]=3 8556 B17R1.679 CC(C)COCCOCC(=O)c1ccccn1 88da3a38a8766e93ccc2e603e41ee8e8 [0,2,0,0,0,0|2,0,0]=4 8557 B17R1.679 CC(C)COCCOCC(=O)c1cccnc1 766afd9f0147d3f0c517d16802efb1d4 [0,2,0,0,0,0|2,0,0]=4 8558 B17R1.679 CC(C)COCCOCS(=O)c1ccccc1 b67bfdb86b56fc9714f94b72e276b7a2 [0,2,0,0,0,0|2,0,0]=4 8559 B17R1.679 CC(C)CSCCOCC(=O)c1ccccc1 44dbd01cccb36818aaafa790683c570b [0,2,0,0,0,0|1,0,0]=3 8560 B17R1.679 CC(C)CSCCOCC(=O)c1ccccn1 ba6391194cdd089b497d42230fcaae1d [0,2,0,0,0,0|2,0,0]=4 8561 B17R1.679 CC(C)CSCCOCC(=O)c1cccnc1 dfc702df137eb85dc34d15709469943f [0,2,0,0,0,0|2,0,0]=4 8562 B17R1.679 CC(C)OCCCCOC(=O)c1ccccc1 bfaca328217b1698c48c2b5f2594a933 [0,2,0,0,0,0|0,0,0]=2 8563 B17R1.679 CC(C)OCCCNCC(=O)c1ccccc1 65f1dd5c1d1973072a302797f8e4b33d [0,2,0,0,0,0|2,0,0]=4 8564 B17R1.679 CC(C)OCCCOCC(=O)c1ccccc1 de61aae92656cd3659c69802f84917d7 [0,2,0,0,0,0|1,0,0]=3 8565 B17R1.679 CC(C)OCCCOCC(=O)c1ccccn1 c0fd8af327e6558527da0efd87ac5843 [0,2,0,0,0,0|2,0,0]=4 8566 B17R1.679 CC(C)OCCCOCC(=O)c1cccnc1 e7cc5c1ee0282b223591e4744b3258be [0,2,0,0,0,0|2,0,0]=4 8567 B17R1.679 CC(C)OCCNCOC(=O)c1ccccc1 efc23785908f4e01adb72db9016d8409 [0,2,0,0,0,0|1,0,0]=3 8568 B17R1.679 CC(C)OCCOCCC(=O)c1ccccc1 3252b8a6d3b7c5e61df43c783d06c43b [0,2,0,0,0,0|2,0,0]=4 8569 B17R1.679 CC(C)OCCOCNC(=O)c1ccccc1 cbe1a265056246a6f07407281d15bdfd [0,2,0,0,0,0|2,0,0]=4 8570 B17R1.679 CC(C)OCCOCOC(=O)c1ccccc1 44a66c66a96d367448757f1059edd4e6 [0,2,0,0,0,0|1,0,0]=3 8571 B17R1.679 CC(C)OCOCCCC(=O)c1ccccc1 36a17870651387a66a17cdffceb64b67 [0,2,0,0,0,0|2,0,0]=4 8572 B17R1.679 CC(C)OCOCCNC(=O)c1ccccc1 3551ed7125ebc00cfbb44b8cbfb6d835 [0,2,0,0,0,0|2,0,0]=4 8573 B17R1.679 CC(C)OCOCCOC(=O)c1ccccc1 7a6da8db52b59e071f6cf5c08472fa36 [0,2,0,0,0,0|1,0,0]=3 8574 B17R1.679 CC(C)OCOCCOC(=O)c1cccnc1 ddf95a262dd504ae4e4fae6955d72a1a [0,2,0,0,0,0|2,0,0]=4 8575 B17R1.679 CC(C)SCCCNCC(=O)c1ccccc1 308abeca457ed7307a259f557d483db3 [0,2,0,0,0,0|2,0,0]=4 8576 B17R1.679 CC(C)SCCCOCC(=O)c1ccccc1 6d3cc6403e2cd0e0f3083e94be7ede0c [0,2,0,0,0,0|1,0,0]=3 8577 B17R1.679 CC(C)SCCCOCC(=O)c1ccccn1 29591c3ac29ce5f6bfbb3f4e6e1f2969 [0,2,0,0,0,0|2,0,0]=4 8578 B17R1.679 CC(C)SCCCOCC(=O)c1cccnc1 f78fcd14d03da35fb7831a4c925fe2ea [0,2,0,0,0,0|2,0,0]=4 8579 B17R1.679 CC(C)SCCOCCC(=O)c1ccccc1 c04fb911f7ef6cb38da7192cc9196782 [0,2,0,0,0,0|2,0,0]=4 8580 B17R1.679 CC(C)SCCOCNC(=O)c1ccccc1 19e4236f9b9652de3f83d920d8dfc1c9 [0,2,0,0,0,0|2,0,0]=4 8581 B17R1.679 CC(C)SCCOCOC(=O)c1ccccc1 687f949f41d2244951f5b0d7a553bf36 [0,2,0,0,0,0|1,0,0]=3 8582 B17R1.679 CC(O)CCCCNCC(=O)c1ccccc1 b9495d9d1424847b1e072f303e0aa0fd [0,2,0,0,0,0|1,0,0]=3 8583 B17R1.679 CC(O)CCNCCNC(=O)c1ccccc1 800922bb71c79d1b06b15a6af95fa941 [0,2,0,0,0,0|1,0,0]=3 8584 B17R1.679 CC(O)CCNCCNC(=O)c1ccccn1 3e04acd826529445850e66a994b07ab4 [0,2,0,0,0,0|2,0,0]=4 8585 B17R1.679 CC(O)CCNCCNC(=O)c1ccncc1 86213f44a7216aeb84549dba7b514919 [0,2,0,0,0,0|2,0,0]=4 8586 B17R1.679 CC(O)CCNCCOC(=O)c1ccccc1 9c49f416bef16c76450776a16ff9016a [0,2,0,0,0,0|0,0,0]=2 8587 B17R1.679 CC(OCCCCCC(F)F)c1ccccc1 e1f184275c8346fd60e9a47ae68783a8 [0,2,0,0,0,0|1,0,1]=4 8588 B17R1.679 CN(C)CCCCCNC(=O)c1ccccc1 f737a40b446578dc159f75c4697e6e3e [0,2,0,0,0,0|1,0,0]=3 8589 B17R1.679 CN(C)CCCCCNC(=O)c1ccccn1 b3d030c652c7ed31573dba930fa42c8a [0,2,0,0,0,0|2,0,0]=4 8590 B17R1.679 CN(C)CCCCCNC(=O)c1cccnc1 dc2800df41772320e3bfa548ff0d80c3 [0,2,0,0,0,0|2,0,0]=4 8591 B17R1.679 CN(C)CCCCCNC(=O)c1ccncc1 aef675b59fa5310bc6ac33a59f5d9211 [0,2,0,0,0,0|2,0,0]=4 8592 B17R1.679 CN(C)CCCCNCC(=O)c1ccccc1 d388ecc5884f118b14b25790bb88fc92 [0,2,0,0,0,0|2,0,0]=4 8593 B17R1.679 CN(C)CCCCOCC(=O)c1ccccc1 0f67be53eaf7a62512a3900d6e2cc404 [0,2,0,0,0,0|1,0,0]=3 8594 B17R1.679 CN(C)CCCCOCC(=O)c1ccccn1 1d3e105478359fe969ee33590fc9b8c0 [0,2,0,0,0,0|2,0,0]=4 8595 B17R1.679 CN(C)CCCCOCC(=O)c1cccnc1 86718548a17d04910125d4902c1f7b2f [0,2,0,0,0,0|2,0,0]=4 8596 B17R1.679 CN(C)CCCNCOC(=O)c1ccccc1 b20ee5388277addb9437c6e0abdde7be [0,2,0,0,0,0|1,0,0]=3 8597 B17R1.679 CN(C)CCCOCCC(=O)c1ccccc1 a7599b4e519fa3ef1945aef795052494 [0,2,0,0,0,0|2,0,0]=4 8598 B17R1.679 CN(C)CCCOCNC(=O)c1ccccc1 91f473b76ae2a690cbeffcaf181524f3 [0,2,0,0,0,0|2,0,0]=4 8599 B17R1.679 CN(C)CCCOCOC(=O)c1ccccc1 c7354c6b603fdb8ddd2c4d45bde11d22 [0,2,0,0,0,0|1,0,0]=3 8600 B17R1.679 CN(C)CCNCCOC(=O)c1ccccc1 2a314a96206694f46aa16c8f226b3dec [0,2,0,0,0,0|1,0,0]=3 8601 B17R1.679 CN(C)CCOCCCC(=O)c1ccccc1 a7b538c33b0e493da7c9858f39d1a833 [0,2,0,0,0,0|2,0,0]=4 8602 B17R1.679 CN(C)CCOCCNC(=O)c1ccccc1 462f9ffb519e889fd69cb7885545aad3 [0,2,0,0,0,0|2,0,0]=4 8603 B17R1.679 CN(C)CCOCCOC(=O)c1ccccc1 2a034b0eaa595937e86ccfd66f30d2b1 [0,2,0,0,0,0|1,0,0]=3 8604 B17R1.679 CN(C)CCOCCOC(=O)c1cccnc1 428cc6c21752eee9571211d95bef7ffc [0,2,0,0,0,0|2,0,0]=4 8605 B17R1.679 CN(C)COCCCNC(=O)c1ccccc1 8e9bdb61a390772f4b590e178983e784 [0,2,0,0,0,0|2,0,0]=4 8606 B17R1.679 CS(=O)CCCNCOC(=O)c1ccccc1 b39667b0d10fd894c56322788d5ed8ef [0,2,0,0,0,0|1,0,0]=3 8607 B17R1.679 CS(=O)CCNCCOC(=O)c1ccccc1 a9c85083feb5aed510aec96ee62db957 [0,2,0,0,0,0|1,0,0]=3 8608 B17R1.679 CS(=O)CCOCCCC(=O)c1ccccc1 1d8f49e0d77d0fbc0e01677dcf191f72 [0,2,0,0,0,0|2,0,0]=4 8609 B17R1.679 CS(=O)CCOCCNC(=O)c1ccccc1 4ec1f4ac3115ab8a347d6aeb84e80745 [0,2,0,0,0,0|2,0,0]=4 8610 B17R1.679 CS(=O)CCOCCOC(=O)c1ccccc1 6063398b5eebabb714b5d248c31059f1 [0,2,0,0,0,0|1,0,0]=3 8611 B17R1.679 CS(=O)CCOCCOC(=O)c1cccnc1 c003ead32bbebfd3843f536338982659 [0,2,0,0,0,0|2,0,0]=4 8612 B17R1.679 C[C@@H](O)CCCCNCC(=O)c1ccccc1 302066a0fe9a51f93605a36395f4617b [0,2,0,0,0,0|1,0,0]=3 8613 B17R1.679 C[C@@H](O)CCNCCNC(=O)c1ccccc1 046220b7633b48f0c22381b60cb70c40 [0,2,0,0,0,0|1,0,0]=3 8614 B17R1.679 C[C@@H](O)CCNCCNC(=O)c1ccccn1 7d651c65e0c0c626ac8d4a5aa0335d04 [0,2,0,0,0,0|2,0,0]=4 8615 B17R1.679 C[C@@H](O)CCNCCOC(=O)c1ccccc1 00eac11de55782764d41896395a71763 [0,2,0,0,0,0|0,0,0]=2 8616 B17R1.679 C[C@@H](OCCCCCC(F)F)c1ccccc1 8935856e6ccff9a0390469a20ec69f7b [0,2,0,0,0,0|1,0,1]=4 8617 B17R1.679 C[C@H](O)CCNCCNC(=O)c1ccccc1 bbca3555ab6a3ee59811e894c925f981 [0,2,0,0,0,0|1,0,0]=3 8618 B17R1.679 C[C@H](O)CCNCCNC(=O)c1ccccn1 72ea76ea789e48454a38a3e4bbce8fd4 [0,2,0,0,0,0|2,0,0]=4 8619 B17R1.679 C[C@H](O)CCNCCOC(=O)c1ccccc1 23b32fe6843321c3010e2894c6d8efdc [0,2,0,0,0,0|0,0,0]=2 8620 B17R1.679 C[C@H](OCCCCCC(F)F)c1ccccc1 67259572b3866c58b2ca743d95f8777f [0,2,0,0,0,0|1,0,1]=4 8621 B17R1.679 NC(=O)CCCCCNC(=O)c1ccccc1 a01d378b972f57764fc8a34a5caeb26c [0,2,0,0,0,0|1,0,1]=4 8622 B17R1.679 NC(=O)CCCCOCC(=O)c1ccccc1 595d9978510bd68277d850d6a7d2edf0 [0,2,0,0,0,0|1,0,1]=4 8623 B17R1.679 NC(=O)CCCNCOC(=O)c1ccccc1 22ccb3e7957d8de153caed4490edae60 [0,2,0,0,0,0|1,0,1]=4 8624 B17R1.679 NC(=O)CCCOCOC(=O)c1ccccc1 fd849138937f7a91bb9a461ceea77449 [0,2,0,0,0,0|1,0,1]=4 8625 B17R1.679 NC(=O)CCNCCOC(=O)c1ccccc1 744afddf7644dbe37e1553e57af4688a [0,2,0,0,0,0|1,0,1]=4 8626 B17R1.679 NC(=O)CCOCCOC(=O)c1ccccc1 0fc010b6027acfb95aed2dc678ffbf3a [0,2,0,0,0,0|1,0,1]=4 8627 B17R1.679 NC(=O)CNCCCOC(=O)c1ccccc1 25959728e0238d268f44ef255232c234 [0,2,0,0,0,0|1,0,1]=4 8628 B17R1.679 NC(=S)CCNCCOC(=O)c1ccccc1 c31ec173ba6af6660c8a3498b812037c [0,2,0,0,0,0|1,0,1]=4 8629 B17R1.679 O=C(CNCCCCC(F)F)c1ccccc1 61ee43b5e69a0fac1156eb371ac3f2f2 [0,2,0,0,0,0|2,0,0]=4 8630 B17R1.679 O=C(COCCCC[N+](=O)[O-])c1ccccc1 e64e40f6bd3d7ef3705c6a7134157f68 [0,2,0,0,0,0|2,0,0]=4 8631 B17R1.679 O=C(COCCOCC(F)F)c1ccccc1 b538f7dc6be99827d858777ea37d73db [0,2,0,0,0,0|2,0,0]=4 8632 B17R1.679 O=C(NCCCCOC(F)F)c1ccccc1 0f9f6f81b5cd2b2d6344ac9661836502 [0,2,0,0,0,0|2,0,0]=4 8633 B17R1.679 O=C(NCCCOCC(F)F)c1ccccc1 cf9f5247a898681b844ca3d44ef05b88 [0,2,0,0,0,0|2,0,0]=4 8634 B17R1.679 O=C(NCCNCCC(F)F)c1ccccc1 665b871f99302ae83e9e7c140c8bcef1 [0,2,0,0,0,0|2,0,0]=4 8635 B17R1.679 O=C(NCCOCCC(F)F)c1ccccc1 63cf76f3685ed417ecd8ce4f6d1cdb18 [0,2,0,0,0,0|2,0,0]=4 8636 B17R1.679 O=C(O)CCCCOCC(=O)c1ccccc1 a477ccf26074f068e0cfffa7f28b1ce4 [0,2,0,0,0,0|1,0,1]=4 8637 B17R1.679 O=C(O)CCCNCOC(=O)c1ccccc1 962350608c7aa6c19078d077899b6d30 [0,2,0,0,0,0|1,0,1]=4 8638 B17R1.679 O=C(O)CCNCCOC(=O)c1ccccc1 e968d701fc794c39f51c2e337e1b7454 [0,2,0,0,0,0|1,0,1]=4 8639 B17R1.679 O=C(O)CCOCCOC(=O)c1ccccc1 52fe00c77af0f7ad7bc71cc320157afa [0,2,0,0,0,0|1,0,1]=4 8640 B17R1.679 O=C(OCCNCCC(F)F)c1ccccc1 8f6512fd2df458f42c22b401752d7b24 [0,2,0,0,0,0|1,0,0]=3 8641 B17R1.679 O=C(OCCNCCS(=O)O)c1ccccc1 238b21a9d79d440c7a7251f238397e6e [0,2,0,0,0,0|2,0,0]=4 8642 B17R1.679 O=C(OCCOCCC(F)F)c1ccccc1 7bf336f5787738f9b2715e99afe7a781 [0,2,0,0,0,0|1,0,0]=3 8643 B17R1.679 O=C(OCCOCC[N+](=O)[O-])c1ccccc1 2396cce09099ae3e3351b34eb6dd9a3e [0,2,0,0,0,0|2,0,0]=4 8644 B17R1.679 O=C(OCNCCOC(F)F)c1ccccc1 2cf4912279c2b4bd85a26692842c290a [0,2,0,0,0,0|2,0,0]=4 8645 B17R1.679 O=C(OCOCCC[N+](=O)[O-])c1ccccc1 f5a4f3610ef3e5dc3a30c3f08c0e9ebe [0,2,0,0,0,0|2,0,0]=4 8646 B17R1.679 O=C(OCOCCOC(F)F)c1ccccc1 18c148765f8ed077bbe53e30a74669f7 [0,2,0,0,0,0|2,0,0]=4 8647 B17R1.754 C#CCCCCCCNC(=O)c1ccccc1 4bb2be1602c01892bb8c3c37feed3eb8 [0,2,0,0,0,0|1,0,0]=3 8648 B17R1.754 C#CCCCCCCNC(=O)c1ccccn1 bcae0eff426aa2b60634c8e250adb69d [0,2,0,0,0,0|2,0,0]=4 8649 B17R1.754 C#CCCCCCCNC(=O)c1cccnc1 87d4b137bc1a704b1ceb4b08e1035ae3 [0,2,0,0,0,0|2,0,0]=4 8650 B17R1.754 C#CCCCCCCNC(=O)c1ccncc1 621a2f53514148befb33b3cd07bbbe3a [0,2,0,0,0,0|2,0,0]=4 8651 B17R1.754 C#CCCCCCCOC(C)c1ccccc1 eb977f5b44103d099617b028d4e84455 [0,2,0,0,0,0|1,0,1]=4 8652 B17R1.754 C#CCCCCCCO[C@@H](C)c1ccccc1 f37bf876ca0e4b98cc8ae2f0eeeea5fe [0,2,0,0,0,0|1,0,1]=4 8653 B17R1.754 C#CCCCCCCO[C@H](C)c1ccccc1 2e3004fd39267d579dcff63197db9b9c [0,2,0,0,0,0|1,0,1]=4 8654 B17R1.754 C#CCCCCCNCC(=O)c1ccccc1 042b36199940e36d42c042631e6c2d69 [0,2,0,0,0,0|1,0,1]=4 8655 B17R1.754 C#CCCCCCOCC(=C)c1ccccc1 5133a4db9e88013aec6a107ad17b43db [0,2,0,0,0,0|1,0,1]=4 8656 B17R1.754 C#CCCCCCOCC(=O)c1ccccc1 fc37fcc194d80ad1a586fa00d8f8b42d [0,2,0,0,0,0|0,0,1]=3 8657 B17R1.754 C#CCCCCCOCC(=O)c1ccccn1 ecd9f4812a78cc5c57fd2b27f7cf0173 [0,2,0,0,0,0|1,0,1]=4 8658 B17R1.754 C#CCCCCCOCC(=O)c1cccnc1 3ed0b9a22656d4b33d6d616cab5bc0fd [0,2,0,0,0,0|1,0,1]=4 8659 B17R1.754 C#CCCCCNCOC(=O)c1ccccc1 a7fe96fef96c6eb8ebdf8843b446b50d [0,2,0,0,0,0|0,0,1]=3 8660 B17R1.754 C#CCCCCOCCC(=O)c1ccccc1 8cd707f1e376abe5e8525be2c0e250e6 [0,2,0,0,0,0|0,0,2]=4 8661 B17R1.754 C#CCCCCOCNC(=O)c1ccccc1 5f63005618f3093ea588a9f196fb3289 [0,2,0,0,0,0|0,0,2]=4 8662 B17R1.754 C#CCCCCOCOC(=O)c1ccccc1 288209e72dd28594caec86b9a00b5b7a [0,2,0,0,0,0|0,0,1]=3 8663 B17R1.754 C#CCCCNCCOC(=O)c1ccccc1 eb4edf3f5b49d28fc01627c35d81b002 [0,2,0,0,0,0|0,0,1]=3 8664 B17R1.754 C#CCCCOCCCC(=O)c1ccccc1 1714e0ddaf62a84e52281e6116b90da0 [0,2,0,0,0,0|1,0,1]=4 8665 B17R1.754 C#CCCCOCCNC(=O)c1ccccc1 15cd46968703908a0b84d2ebb672c9fd [0,2,0,0,0,0|1,0,1]=4 8666 B17R1.754 C#CCCCOCCOC(=O)c1ccccc1 9c25feb427c57966483bc3d2d8e6be61 [0,2,0,0,0,0|0,0,1]=3 8667 B17R1.754 C#CCCCOCCOC(=O)c1cccnc1 6d54ac11568751acd934582d1f7f3a7c [0,2,0,0,0,0|1,0,1]=4 8668 B17R1.754 C#CCCOCCCNC(=O)c1ccccc1 36385ce0457e8ca953896b5cd1973675 [0,2,0,0,0,0|1,0,1]=4 8669 B17R1.754 C#CCNCCCCOC(=O)c1ccccc1 3bfebcd69e27b8db17238d916df480ff [0,2,0,0,0,0|0,0,1]=3 8670 B17R1.754 C#CCOCCCCOC(=O)c1ccccc1 029e1e34368fc17a442dc6e50cb21587 [0,2,0,0,0,0|0,0,1]=3 8671 B17R1.754 C#CCOCCCOCC(=O)c1ccccc1 7da95e39f38d11063cf323a236aa373d [0,2,0,0,0,0|0,0,2]=4 8672 B17R1.754 C#CCOCCNCOC(=O)c1ccccc1 eda450beedf42e024a1604589d10f0fa [0,2,0,0,0,0|0,0,2]=4 8673 B17R1.754 C#CCOCCOCOC(=O)c1ccccc1 35530a2f4178d04d40ef88adcafaa94f [0,2,0,0,0,0|0,0,2]=4 8674 B17R1.754 C/C=C/CCCOCCC(=O)c1ccccc1 ba0a2461819e14aa00de9312e8e6a45b [0,2,0,0,0,0|0,0,2]=4 8675 B17R1.754 C/C=C/CCCOCOC(=O)c1ccccc1 0a0906a4b51a6a5219118fbc54e64c4e [0,2,0,0,0,0|0,0,1]=3 8676 B17R1.754 C/C=C/CCOCCCC(=O)c1ccccc1 c172b111f22787662a51806d0320fc0e [0,2,0,0,0,0|1,0,1]=4 8677 B17R1.754 C/C=C/CCOCCNC(=O)c1ccccc1 c1972c99adb7b4e8559f81a50d786b35 [0,2,0,0,0,0|1,0,1]=4 8678 B17R1.754 C/C=C/CCOCCOC(=O)c1ccccc1 ed8d782b2345355087840f12b4a72854 [0,2,0,0,0,0|0,0,1]=3 8679 B17R1.754 C/C=C/COCCCCC(=O)c1ccccc1 a1ae0cba91b8a7ef5948e1b863ee5b66 [0,2,0,0,0,0|1,0,1]=4 8680 B17R1.754 C/C=C/COCCCNC(=O)c1ccccc1 9a4d1945de896d227920e84c2a400412 [0,2,0,0,0,0|1,0,1]=4 8681 B17R1.754 C/C=C/COCCCOC(=O)c1ccccc1 edcc3048bca3f23f2db07c7aaa2f396c [0,2,0,0,0,0|0,0,1]=3 8682 B17R1.754 C/C=C\CCCOCCC(=O)c1ccccc1 a21c14ef62ce21f5058c2202cd462af2 [0,2,0,0,0,0|0,0,2]=4 8683 B17R1.754 C/C=C\CCCOCNC(=O)c1ccccc1 a054399d623b6716b4db1c2c7ffb2bd4 [0,2,0,0,0,0|0,0,2]=4 8684 B17R1.754 C/C=C\CCCOCOC(=O)c1ccccc1 44f9cb7035fe6998f9f28038201961f3 [0,2,0,0,0,0|0,0,1]=3 8685 B17R1.754 C/C=C\COCCCCC(=O)c1ccccc1 d6d82374496a26b73bfa7ee444b09caa [0,2,0,0,0,0|1,0,1]=4 8686 B17R1.754 C/C=C\COCCCNC(=O)c1ccccc1 d125ac695386e99e87a4abd8527ead71 [0,2,0,0,0,0|1,0,1]=4 8687 B17R1.754 C/C=C\COCCCOC(=O)c1ccccc1 64a981bbb810d38635db86b892a09aed [0,2,0,0,0,0|0,0,1]=3 8688 B17R1.754 C=C(CCOCCCCCC)c1ccncc1 6d5cdf15481c6f868ed7e9c9987d2058 [0,2,0,0,0,0|2,0,0]=4 8689 B17R1.754 C=C(CNCCCCCCCl)c1ccccc1 5450d3f72866e6952d589d74bf8f4054 [0,2,0,0,0,0|2,0,0]=4 8690 B17R1.754 C=C(CNCCCCCCO)c1ccccc1 2152312e96187bc89854c8b723726d3b [0,2,0,0,0,0|2,0,0]=4 8691 B17R1.754 C=C(COC/C=C/CCCC)c1ccccc1 e472227bf664a242aad6d1b38845a489 [0,2,0,0,0,0|1,0,1]=4 8692 B17R1.754 C=C(COC/C=C\CCCC)c1ccccc1 ad5acd8830e2b76140824176d57707a5 [0,2,0,0,0,0|1,0,1]=4 8693 B17R1.754 C=C(COCC/C=C\CCC)c1ccccc1 b01113d21b81f6b234f4a09d0b6f00f7 [0,2,0,0,0,0|1,0,1]=4 8694 B17R1.754 C=C(COCCC#CCCC)c1ccccc1 7efaa3ac2059f11d71a74d25626b9a36 [0,2,0,0,0,0|1,0,1]=4 8695 B17R1.754 C=C(COCCC/C=C\CC)c1ccccc1 095181ca09e64888f81cf0d8f753485e [0,2,0,0,0,0|1,0,1]=4 8696 B17R1.754 C=C(COCCCCCC#N)c1ccccc1 90f3d910cfe5a7fe2f5a8e9680a51fbd [0,2,0,0,0,0|1,0,1]=4 8697 B17R1.754 C=C(COCCCCCC=O)c1ccccc1 763e74a73a3873db9b915cea742aadc5 [0,2,0,0,0,0|1,0,1]=4 8698 B17R1.754 C=C(COCCCCCCC)c1ccccc1 e5d220466ec6204fe136f1f7e74021e0 [0,2,0,0,0,0|1,0,0]=3 8699 B17R1.754 C=C(COCCCCCCC)c1ccccn1 90da55a68c131d3a85249429efc26b04 [0,2,0,0,0,0|2,0,0]=4 8700 B17R1.754 C=C(COCCCCCCF)c1ccccc1 2818b2305bb61b6a01090e697e6413f7 [0,2,0,0,0,0|1,0,0]=3 8701 B17R1.754 C=C(COCCCCCCF)c1ccccn1 fe5013425413dd34653d5f6d6e577f0d [0,2,0,0,0,0|2,0,0]=4 8702 B17R1.754 C=C(COCCCCCCS)c1ccccc1 f90855328b8bddb6d89c27c321c5d5d1 [0,2,0,0,0,0|1,0,0]=3 8703 B17R1.754 C=C(COCCCCCOC)c1ccccc1 e3b2e32eb662050d6545f2e0dd3289e4 [0,2,0,0,0,0|1,0,0]=3 8704 B17R1.754 C=C(COCCCCCOC)c1ccccn1 824cd5ba04ff43599c1e752f2e5303ff [0,2,0,0,0,0|2,0,0]=4 8705 B17R1.754 C=C(COCCCOCCC)c1ccccc1 4f4f9a1b3071971e0c2c0b5fdf864503 [0,2,0,0,0,0|1,0,0]=3 8706 B17R1.754 C=C(COCCCOCCC)c1ccccn1 85fb7ace6d830b103d0494fb505d241c [0,2,0,0,0,0|2,0,0]=4 8707 B17R1.754 C=C(COCCOCCCC)c1ccccc1 0b8f4d429298ffc445c3a1bd538db26e [0,2,0,0,0,0|1,0,0]=3 8708 B17R1.754 C=C(COCCOCCCC)c1ccccn1 fb17af265b944adf7be1562b54702c07 [0,2,0,0,0,0|2,0,0]=4 8709 B17R1.754 C=C(COCCOCCOC)c1ccccc1 7530e9f7bcbcf3faaa35da9a3a0ef204 [0,2,0,0,0,0|2,0,0]=4 8710 B17R1.754 C=C(COCCSCCCC)c1ccccc1 fcbe6b03dee4b2f48273dcc53ee5abe4 [0,2,0,0,0,0|1,0,0]=3 8711 B17R1.754 C=C=CCCOCCOC(=O)c1ccccc1 3b206211b754dff20367d0e94ea193f0 [0,2,0,0,0,0|0,0,2]=4 8712 B17R1.754 C=CCCCCCCOC(C)c1ccccc1 4539034193edf930d6fd79b7c61c6512 [0,2,0,0,0,0|1,0,1]=4 8713 B17R1.754 C=CCCCCCCO[C@@H](C)c1ccccc1 e3a76be66f365452e78658eb283f349e [0,2,0,0,0,0|1,0,1]=4 8714 B17R1.754 C=CCCCCCCO[C@H](C)c1ccccc1 d11cfb958001205966cc20fffa48052b [0,2,0,0,0,0|1,0,1]=4 8715 B17R1.754 C=CCCCCCNCC(=O)c1ccccc1 e163678a6c7e35edde6018da194b6762 [0,2,0,0,0,0|1,0,1]=4 8716 B17R1.754 C=CCCCCCOCC(=C)c1ccccc1 9a84a00f89bbc9892ceb23efb1212f2f [0,2,0,0,0,0|1,0,1]=4 8717 B17R1.754 C=CCCCCCOCC(=O)c1ccccc1 ac3f1d659be58f3d33de8fee42084451 [0,2,0,0,0,0|0,0,1]=3 8718 B17R1.754 C=CCCCCCOCC(=O)c1ccccn1 fc89e711e2955128e1dff625fd097bac [0,2,0,0,0,0|1,0,1]=4 8719 B17R1.754 C=CCCCCCOCC(=O)c1cccnc1 75e68bb0408e69cb6db8484e1af287f8 [0,2,0,0,0,0|1,0,1]=4 8720 B17R1.754 C=CCCCCCOCS(=O)c1ccccc1 12bab1637162cd5fbf0bf08871bf6fd0 [0,2,0,0,0,0|1,0,1]=4 8721 B17R1.754 C=CCCCCNCCC(=O)c1ccccc1 78e1c04712c039552c43c9e12ce83c52 [0,2,0,0,0,0|1,0,1]=4 8722 B17R1.754 C=CCCCCNCOC(=O)c1ccccc1 f9f2fa4cd529aba9a37dd4e53472cf03 [0,2,0,0,0,0|0,0,1]=3 8723 B17R1.754 C=CCCCCOCCC(=O)c1ccccc1 53b45981cd52e619fdbd089b51a1f31d [0,2,0,0,0,0|0,0,2]=4 8724 B17R1.754 C=CCCCCOCNC(=O)c1ccccc1 a9fdeab34a1ebba11744eabb97acc4a1 [0,2,0,0,0,0|0,0,2]=4 8725 B17R1.754 C=CCCCCOCOC(=O)c1ccccc1 77f5100ff799454cc4a7977f264c60ea [0,2,0,0,0,0|0,0,1]=3 8726 B17R1.754 C=CCCCNCCCC(=O)c1ccccc1 d8755fc8b3578d874b14e2ae2124d54d [0,2,0,0,0,0|1,0,1]=4 8727 B17R1.754 C=CCCCNCCNC(=O)c1ccccc1 3a28668c905f9b2945a2c489939e3945 [0,2,0,0,0,0|1,0,1]=4 8728 B17R1.754 C=CCCCNCCOC(=O)c1ccccc1 8e48d3abd3fe4e44e1ad188a849ac700 [0,2,0,0,0,0|0,0,1]=3 8729 B17R1.754 C=CCCCOCCCC(=O)c1ccccc1 a8af588acd6ea36d1c206ddc0df03c27 [0,2,0,0,0,0|1,0,1]=4 8730 B17R1.754 C=CCCCOCCNC(=O)c1ccccc1 4e54fdf100e3f73a40cecd84d7660bae [0,2,0,0,0,0|1,0,1]=4 8731 B17R1.754 C=CCCCOCCOC(=O)c1ccccc1 0261fa180454b4d1575ce42d8ba8a835 [0,2,0,0,0,0|0,0,1]=3 8732 B17R1.754 C=CCCCOCCOC(=O)c1cccnc1 74e43e5f822fcf00c3004efc6ab4b412 [0,2,0,0,0,0|1,0,1]=4 8733 B17R1.754 C=CCCNCCCCC(=O)c1ccccc1 b021039826dc207915779e1d8dbf619a [0,2,0,0,0,0|1,0,1]=4 8734 B17R1.754 C=CCCNCCCOC(=O)c1ccccc1 fe20297f3bac966dd09f1e7044aedd18 [0,2,0,0,0,0|0,0,1]=3 8735 B17R1.754 C=CCCOCCCCC(=O)c1ccccc1 9daecdbdf72e8a547362e4baa983a5c7 [0,2,0,0,0,0|1,0,1]=4 8736 B17R1.754 C=CCCOCCCNC(=O)c1ccccc1 e36a53e9e94f6229e735a5a93f029cfd [0,2,0,0,0,0|1,0,1]=4 8737 B17R1.754 C=CCCOCCCOC(=O)c1ccccc1 7af4c28ed06165f374f6adfd0a160a7c [0,2,0,0,0,0|0,0,1]=3 8738 B17R1.754 C=CCOCCOCOC(=O)c1ccccc1 5fa45002cedc1ab7c285d024d7c2f57e [0,2,0,0,0,0|0,0,2]=4 8739 B17R1.754 C=COCCCCOCC(=O)c1ccccc1 52829930b318ad919e6e55c0e8d90545 [0,2,0,0,0,0|0,0,2]=4 8740 B17R1.754 C=COCCCNCOC(=O)c1ccccc1 4ef771b2152a437f8bb5706f1c53a91c [0,2,0,0,0,0|0,0,2]=4 8741 B17R1.754 C=COCCNCCOC(=O)c1ccccc1 0f4f0f2e8f3321e0dc710cc793205f7e [0,2,0,0,0,0|0,0,2]=4 8742 B17R1.754 C=COCCOCCOC(=O)c1ccccc1 63d78161453864d08ff3f7b56ce6a511 [0,2,0,0,0,0|0,0,2]=4 8743 B17R1.754 CC#CCCCOCCC(=O)c1ccccc1 4ff841dc49a5fd6785b42ae157bf1d59 [0,2,0,0,0,0|0,0,2]=4 8744 B17R1.754 CC#CCCCOCNC(=O)c1ccccc1 e0f70254a3b34338094a00900f73b261 [0,2,0,0,0,0|0,0,2]=4 8745 B17R1.754 CC#CCCCOCOC(=O)c1ccccc1 d782f5f42400fd4693eb85cef66ffc71 [0,2,0,0,0,0|0,0,1]=3 8746 B17R1.754 CC#CCCOCCNC(=O)c1ccccc1 800d5a666368b39a068bb46544297456 [0,2,0,0,0,0|1,0,1]=4 8747 B17R1.754 CC#CCCOCCOC(=O)c1ccccc1 845037cc267cd6b1770f641b8c4ef178 [0,2,0,0,0,0|0,0,1]=3 8748 B17R1.754 CC#CCOCCCNC(=O)c1ccccc1 172929150598b65fb37d10ec8023012e [0,2,0,0,0,0|1,0,1]=4 8749 B17R1.754 CC(COCCCCCCF)c1ccccc1 73acdc68906eec843fe42ede951da13e [0,2,0,0,0,0|1,0,1]=4 8750 B17R1.754 CC(COCCCCCCS)c1ccccc1 cfa50d26730e42c1ef61346cbe60d1e1 [0,2,0,0,0,0|1,0,1]=4 8751 B17R1.754 CC(OCCCCCCC#N)c1ccccc1 bafbbc98f96f6c164da8075ebb493c0c [0,2,0,0,0,0|1,0,1]=4 8752 B17R1.754 CC(OCCCCCCC=O)c1ccccc1 090b167f43d720823d34248186cc4a21 [0,2,0,0,0,0|1,0,1]=4 8753 B17R1.754 CC/C=C/CCOCCC(=O)c1ccccc1 a49181605fb807ed4728282ae7962a46 [0,2,0,0,0,0|0,0,2]=4 8754 B17R1.754 CC/C=C/CCOCOC(=O)c1ccccc1 545e428c03397ad227c14e1e4090fff7 [0,2,0,0,0,0|0,0,1]=3 8755 B17R1.754 CC/C=C/COCCCC(=O)c1ccccc1 96d222a730ce9d7196e27d5a68d217fa [0,2,0,0,0,0|1,0,1]=4 8756 B17R1.754 CC/C=C/COCCNC(=O)c1ccccc1 2945e4c414c9c186e70bc71950827cb1 [0,2,0,0,0,0|1,0,1]=4 8757 B17R1.754 CC/C=C/COCCOC(=O)c1ccccc1 1255ce039c873feab13cbe9ed85fa12c [0,2,0,0,0,0|0,0,1]=3 8758 B17R1.754 CC/C=C/COCCOC(=O)c1cccnc1 bfcb61ddd54f08808cc86ec229c559e9 [0,2,0,0,0,0|1,0,1]=4 8759 B17R1.754 CC/C=C\CCCCOC(C)c1ccccc1 0d417cbb53cb543cd8b1ebe1361d1710 [0,2,0,0,0,0|1,0,1]=4 8760 B17R1.754 CC/C=C\CCCCO[C@@H](C)c1ccccc1 9ba54e88f382f2a8da6514291ae9f142 [0,2,0,0,0,0|1,0,1]=4 8761 B17R1.754 CC/C=C\CCCCO[C@H](C)c1ccccc1 d4393af5ee3f65bcfb77ee130dff854d [0,2,0,0,0,0|1,0,1]=4 8762 B17R1.754 CC/C=C\CCCOCC(=O)c1ccccc1 141c887b4da7756d646cce071f5a2fb1 [0,2,0,0,0,0|0,0,1]=3 8763 B17R1.754 CC/C=C\CCCOCC(=O)c1ccccn1 690c493cf9231224847e8b02798c00dd [0,2,0,0,0,0|1,0,1]=4 8764 B17R1.754 CC/C=C\CCCOCC(=O)c1cccnc1 3138b0dabf4dd865f21ec2c29b161afd [0,2,0,0,0,0|1,0,1]=4 8765 B17R1.754 CC/C=C\CCCOCS(=O)c1ccccc1 ceb22ff92e75907b7efd2c5ca3f85ffb [0,2,0,0,0,0|1,0,1]=4 8766 B17R1.754 CC/C=C\CCOCCC(=O)c1ccccc1 7641e798eeb497f1253fbb61fbfb34d5 [0,2,0,0,0,0|0,0,2]=4 8767 B17R1.754 CC/C=C\CCOCNC(=O)c1ccccc1 d7c7cb2d576a2408c82489c8cdea3804 [0,2,0,0,0,0|0,0,2]=4 8768 B17R1.754 CC/C=C\CCOCOC(=O)c1ccccc1 864adc290c3ef1b7cccd0ad80766ebad [0,2,0,0,0,0|0,0,1]=3 8769 B17R1.754 CC/C=C\COCCCC(=O)c1ccccc1 3014c491ade7e5530b433589f5ef31ad [0,2,0,0,0,0|1,0,1]=4 8770 B17R1.754 CC/C=C\COCCNC(=O)c1ccccc1 2acee8bd990f00d16aa5a7e3c3cd4937 [0,2,0,0,0,0|1,0,1]=4 8771 B17R1.754 CC/C=C\COCCOC(=O)c1ccccc1 7f264538fb647a16a97aec5f4b6b1d22 [0,2,0,0,0,0|0,0,1]=3 8772 B17R1.754 CC=C=CCCOCOC(=O)c1ccccc1 226177b44e921ea80886ae472280fcd4 [0,2,0,0,0,0|0,0,2]=4 8773 B17R1.754 CC=CCCCOCCC(=O)c1ccccc1 22fd6ba7e4b8b5fbedab504120b78ecb [0,2,0,0,0,0|0,0,2]=4 8774 B17R1.754 CC=CCCCOCOC(=O)c1ccccc1 ca916bd88e8a13fcab3e54101b458f3c [0,2,0,0,0,0|0,0,1]=3 8775 B17R1.754 CC=CCNCCCCC(=O)c1ccccc1 34ed2cb90eaa4f9ea6dfa54aedaa4173 [0,2,0,0,0,0|1,0,1]=4 8776 B17R1.754 CC=CCNCCCOC(=O)c1ccccc1 77258f75a7b797221ababa36991edb12 [0,2,0,0,0,0|0,0,1]=3 8777 B17R1.754 CC=CCOCCCCC(=O)c1ccccc1 fdb8b853516ce3e8b4538369eae0f548 [0,2,0,0,0,0|1,0,1]=4 8778 B17R1.754 CC=CCOCCCOC(=O)c1ccccc1 1eb08df1a1bb85c3e7e2c1d5af5bc644 [0,2,0,0,0,0|0,0,1]=3 8779 B17R1.754 CCC#CCCOCOC(=O)c1ccccc1 e9da5995a1d388bd7a2d82687f904e3f [0,2,0,0,0,0|0,0,1]=3 8780 B17R1.754 CCC#CCOCCNC(=O)c1ccccc1 95dbb39174b96c2651a9778385fae6e9 [0,2,0,0,0,0|1,0,1]=4 8781 B17R1.754 CCC#CCOCCOC(=O)c1ccccc1 11d5027c767824d26cc5e4eb72172655 [0,2,0,0,0,0|0,0,1]=3 8782 B17R1.754 CCC#CCOCCOC(=O)c1cccnc1 3bc10c310ae7437bf6ffa4346ecae82b [0,2,0,0,0,0|1,0,1]=4 8783 B17R1.754 CCC/C=C/CCCOC(C)c1ccccc1 f567c9b83e01e0df6129f57341c3f499 [0,2,0,0,0,0|1,0,1]=4 8784 B17R1.754 CCC/C=C/CCCO[C@@H](C)c1ccccc1 c87310445c63b390d944bcd5ae24be58 [0,2,0,0,0,0|1,0,1]=4 8785 B17R1.754 CCC/C=C/CCCO[C@H](C)c1ccccc1 10b59998752548d9cfe84f5d37d10c7a [0,2,0,0,0,0|1,0,1]=4 8786 B17R1.754 CCC/C=C/COCCC(=O)c1ccccc1 8336b2ed1017c686e5fd8a2ecbea5e45 [0,2,0,0,0,0|0,0,2]=4 8787 B17R1.754 CCC/C=C/COCNC(=O)c1ccccc1 f057459ff3438db621c8aaf0af7081bf [0,2,0,0,0,0|0,0,2]=4 8788 B17R1.754 CCC/C=C/COCOC(=O)c1ccccc1 2fa5a8716753af12816a1944eaf943a6 [0,2,0,0,0,0|0,0,1]=3 8789 B17R1.754 CCC/C=C\CCCOC(C)c1ccccc1 c80b86a4663204099d0e7fa8c74debbb [0,2,0,0,0,0|1,0,1]=4 8790 B17R1.754 CCC/C=C\CCCO[C@@H](C)c1ccccc1 7300be962bc3d82e3f9fdd1d15e4c682 [0,2,0,0,0,0|1,0,1]=4 8791 B17R1.754 CCC/C=C\CCCO[C@H](C)c1ccccc1 1a959852715e05f255eb6cb2507f8a21 [0,2,0,0,0,0|1,0,1]=4 8792 B17R1.754 CCC/C=C\CCOCC(=O)c1ccccc1 0b36845ef282dc69d7651127c7ce6967 [0,2,0,0,0,0|0,0,1]=3 8793 B17R1.754 CCC/C=C\CCOCC(=O)c1ccccn1 fe5e066c9b8b01000104b71386d7960b [0,2,0,0,0,0|1,0,1]=4 8794 B17R1.754 CCC/C=C\CCOCC(=O)c1cccnc1 cdfa223074709832fcd86057e7036b86 [0,2,0,0,0,0|1,0,1]=4 8795 B17R1.754 CCC/C=C\CCOCS(=O)c1ccccc1 aaf416ed263af214d79ad2fbf6bc5764 [0,2,0,0,0,0|1,0,1]=4 8796 B17R1.754 CCC/C=C\COCCC(=O)c1ccccc1 ac8043aac754f3ef0d96af970fdce23a [0,2,0,0,0,0|0,0,2]=4 8797 B17R1.754 CCC/C=C\COCNC(=O)c1ccccc1 eb3ab8044ca5e5e8f49ed00133e73754 [0,2,0,0,0,0|0,0,2]=4 8798 B17R1.754 CCC/C=C\COCOC(=O)c1ccccc1 727fcef509f3f4753d10bc6da04fde60 [0,2,0,0,0,0|0,0,1]=3 8799 B17R1.754 CCCC#CCCOCC(=O)c1ccccc1 b8bdc8cd0d06f2df6ac74af639091168 [0,2,0,0,0,0|0,0,1]=3 8800 B17R1.754 CCCC#CCCOCC(=O)c1ccccn1 4949377dc7e929de2c4c31a3ff695d4f [0,2,0,0,0,0|1,0,1]=4 8801 B17R1.754 CCCC#CCCOCC(=O)c1cccnc1 b41ba6ddb594e06d5beb0793261ff6d1 [0,2,0,0,0,0|1,0,1]=4 8802 B17R1.754 CCCC#CCOCOC(=O)c1ccccc1 3b0c4678ccd1b86e4c7b053f1fbe9cc6 [0,2,0,0,0,0|0,0,1]=3 8803 B17R1.754 CCCC/C=C/CNCC(=O)c1ccccc1 21f0d3437583634c406a0790131c4a70 [0,2,0,0,0,0|1,0,1]=4 8804 B17R1.754 CCCC/C=C/COCC(=O)c1ccccc1 bedf3ad2826af3dd4e3448ba38351b87 [0,2,0,0,0,0|0,0,1]=3 8805 B17R1.754 CCCC/C=C/COCC(=O)c1ccccn1 f375301e4495b24b162f57898ad40131 [0,2,0,0,0,0|1,0,1]=4 8806 B17R1.754 CCCC/C=C/COCC(=O)c1cccnc1 7db57b296ff1244f73a2b993770ad3c0 [0,2,0,0,0,0|1,0,1]=4 8807 B17R1.754 CCCC/C=C/COCS(=O)c1ccccc1 8b6e21d507d931de1bc58c06e045e05f [0,2,0,0,0,0|1,0,1]=4 8808 B17R1.754 CCCC/C=C\CNCC(=O)c1ccccc1 02c35951bdf9c4189455cbb61c9eca6f [0,2,0,0,0,0|1,0,1]=4 8809 B17R1.754 CCCC/C=C\COCC(=O)c1ccccc1 4d1c4cc64f49d04e415744771acc5d3f [0,2,0,0,0,0|0,0,1]=3 8810 B17R1.754 CCCC/C=C\COCC(=O)c1ccccn1 781ba6968363c4cf17fac752040657a4 [0,2,0,0,0,0|1,0,1]=4 8811 B17R1.754 CCCC/C=C\COCC(=O)c1cccnc1 fb0c9c807da2cbc0bfe3046a740df668 [0,2,0,0,0,0|1,0,1]=4 8812 B17R1.754 CCCCC#CCOCC(=O)c1ccccc1 6dfa99d6dba921a48e792c2e7809887a [0,2,0,0,0,0|0,0,1]=3 8813 B17R1.754 CCCCC#CCOCC(=O)c1ccccn1 d857f5bd80f634d6aa3c747018f3f528 [0,2,0,0,0,0|1,0,1]=4 8814 B17R1.754 CCCCC#CCOCC(=O)c1cccnc1 601dd7f8c53ba03a2b7da4f8666917bd [0,2,0,0,0,0|1,0,1]=4 8815 B17R1.754 CCCCCCCCNC(=O)c1ccccc1 6657c29f46a66b4dbda36f758588cca7 [0,2,0,0,0,0|1,0,0]=3 8816 B17R1.754 CCCCCCCCNC(=O)c1ccccn1 753bc22e70bb2fa3b33181a7cbf3b0f4 [0,2,0,0,0,0|2,0,0]=4 8817 B17R1.754 CCCCCCCCNC(=O)c1cccnc1 e3f33b0cf113024cffa0fb79937acf55 [0,2,0,0,0,0|2,0,0]=4 8818 B17R1.754 CCCCCCCCNC(=O)c1ccncc1 5423cfd4279be822eb9c952cc24bb123 [0,2,0,0,0,0|2,0,0]=4 8819 B17R1.754 CCCCCCCCOC(C)c1ccccc1 fbd30343a7bb8ae32edcc13f25a0bb73 [0,2,0,0,0,0|1,0,1]=4 8820 B17R1.754 CCCCCCCCO[C@@H](C)c1ccccc1 0cea884adc8c45b40e7102fad4b99556 [0,2,0,0,0,0|1,0,1]=4 8821 B17R1.754 CCCCCCCCO[C@H](C)c1ccccc1 e86ef1d4d4f6debbe561e72e009ae0f3 [0,2,0,0,0,0|1,0,1]=4 8822 B17R1.754 CCCCCCCNCC(=O)c1ccccc1 01f0525c061fec90eba849e99ddc348b [0,2,0,0,0,0|1,0,0]=3 8823 B17R1.754 CCCCCCCNCC(=O)c1ccccn1 1a0622aca9d5f9366c436369b8a6c168 [0,2,0,0,0,0|2,0,0]=4 8824 B17R1.754 CCCCCCCNCC(=O)c1cccnc1 d18713b538fed2f14056936ac283d834 [0,2,0,0,0,0|2,0,0]=4 8825 B17R1.754 CCCCCCCOCC(=O)c1ccccc1 fdd1a68d23de4c09c11fc67d35a95e03 [0,2,0,0,0,0|0,0,0]=2 8826 B17R1.754 CCCCCCCOCC(=O)c1ccccn1 a3288f87715f5754a346f2adbb84687d [0,2,0,0,0,0|1,0,0]=3 8827 B17R1.754 CCCCCCCOCC(=O)c1cccnc1 de143d38bcf7051e47c5094b7a015020 [0,2,0,0,0,0|1,0,0]=3 8828 B17R1.754 CCCCCCCOCC(=O)c1ccncn1 99ca41cdf6c4dac66bb7c2093178b7af [0,2,0,0,0,0|2,0,0]=4 8829 B17R1.754 CCCCCCCOCC(=O)c1cnccn1 fcd24b923af7396bdecc2488c533bea7 [0,2,0,0,0,0|2,0,0]=4 8830 B17R1.754 CCCCCCCOCC(C)c1ccccc1 0bb8fb21dbea408368c208aa58139904 [0,2,0,0,0,0|1,0,1]=4 8831 B17R1.754 CCCCCCCOCC(F)c1ccccc1 a117dc123a578049b5082063648d8d5c [0,2,0,0,0,0|1,0,1]=4 8832 B17R1.754 CCCCCCCOC[C@@H](C)c1ccccc1 35562bd6eabc19dac28524fb0717a6e1 [0,2,0,0,0,0|1,0,1]=4 8833 B17R1.754 CCCCCCCOC[C@H](C)c1ccccc1 a480116e94ac083b4c5b2e46c96222cf [0,2,0,0,0,0|1,0,1]=4 8834 B17R1.754 CCCCCCNCOC(=O)c1ccccc1 5a3ed074ac2bbe513400e6a5bdaf4ee7 [0,2,0,0,0,0|0,0,0]=2 8835 B17R1.754 CCCCCCOC/C=C(\C)/c1ccccn1 ae959971ec1c6ee8703634880c482b82 [0,2,0,0,0,0|2,0,0]=4 8836 B17R1.754 CCCCCCOCCC(=O)c1ccccc1 df020e2ae8af9bd9ed7f5fa6cb5e8402 [0,2,0,0,0,0|0,0,0]=2 8837 B17R1.754 CCCCCCOCCC(C)c1ccccc1 113b579f2a2c1838ae7bad4676adce13 [0,2,0,0,0,0|1,0,1]=4 8838 B17R1.754 CCCCCCOCCN(C)c1ccccc1 2f1a81b6610794cdf47354e3f58b333c [0,2,0,0,0,0|2,0,0]=4 8839 B17R1.754 CCCCCCOCCS(=O)c1ccccc1 753abb01b781dfad797e2ede0ae6ad7d [0,2,0,0,0,0|1,0,0]=3 8840 B17R1.754 CCCCCCOCNC(=O)c1ccccc1 bb4a4d692a5deb4d153fc73a0bed0f6f [0,2,0,0,0,0|0,0,0]=2 8841 B17R1.754 CCCCCCOCNC(=O)c1cccnc1 26ff25297d754aa6ea15272fd82c3629 [0,2,0,0,0,0|1,0,0]=3 8842 B17R1.754 CCCCCCOCOC(=O)c1ccccc1 8c7715d31bb9c372522aa8a46af3ac8a [0,2,0,0,0,0|0,0,0]=2 8843 B17R1.754 CCCCCNCCNC(=O)c1ccccc1 471f8d4dd687d598e35792b74c8671be [0,2,0,0,0,0|1,0,0]=3 8844 B17R1.754 CCCCCNCCNC(=O)c1ccccn1 81fb0f140c4be7a5565cf46e50412bbe [0,2,0,0,0,0|2,0,0]=4 8845 B17R1.754 CCCCCNCCNC(=O)c1ccncc1 66cc0bc452ca97bac4d06d71a79e915d [0,2,0,0,0,0|2,0,0]=4 8846 B17R1.754 CCCCCNCCOC(=O)c1ccccc1 6c724bdf4ad3d823effaeea249c398ac [0,2,0,0,0,0|0,0,0]=2 8847 B17R1.754 CCCCCOCCCC(=O)c1ccccc1 751c769ac93c6e4b5935b3d7b375dd92 [0,2,0,0,0,0|1,0,0]=3 8848 B17R1.754 CCCCCOCCCC(=O)c1cccnc1 2bded9627c2bf6c748c3b91e9bf43e0d [0,2,0,0,0,0|2,0,0]=4 8849 B17R1.754 CCCCCOCCNC(=O)c1ccccc1 93d5fc6c23f02fdc515dbd24c309d8b8 [0,2,0,0,0,0|1,0,0]=3 8850 B17R1.754 CCCCCOCCNC(=O)c1ccccn1 3649003a90a3c8031acaa021987a16ff [0,2,0,0,0,0|2,0,0]=4 8851 B17R1.754 CCCCCOCCNC(=O)c1cccnc1 82ab6fc911ce718c019c6c0625560abf [0,2,0,0,0,0|2,0,0]=4 8852 B17R1.754 CCCCCOCCNC(=O)c1ccncc1 df5acd0f857a6949830501bda773dadf [0,2,0,0,0,0|2,0,0]=4 8853 B17R1.754 CCCCCOCCOC(=O)c1ccccc1 64985f627a645d4b0791c0b52fce5812 [0,2,0,0,0,0|0,0,0]=2 8854 B17R1.754 CCCCCOCCOC(=O)c1cccnc1 a232fe46f5f25afd07163ddc532bf135 [0,2,0,0,0,0|1,0,0]=3 8855 B17R1.754 CCCCNCCCOC(=O)c1ccccc1 14b979fe4bacc22915266785d7ea88aa [0,2,0,0,0,0|0,0,0]=2 8856 B17R1.754 CCCCOCCCNC(=O)c1ccccc1 9423e22153886a170e7fe3379f94657d [0,2,0,0,0,0|1,0,0]=3 8857 B17R1.754 CCCCOCCCNC(=O)c1ccccn1 e081c11adb399e71676800a0af8fff72 [0,2,0,0,0,0|2,0,0]=4 8858 B17R1.754 CCCCOCCCNC(=O)c1cccnc1 006176ffd8ad48f031178ce05878cdfb [0,2,0,0,0,0|2,0,0]=4 8859 B17R1.754 CCCCOCCCNC(=O)c1ccncc1 dab6d7521dab702f434284f2872b7b72 [0,2,0,0,0,0|2,0,0]=4 8860 B17R1.754 CCCCOCCNCC(=O)c1ccccc1 a9020d356b3c2f949c2231a641c59298 [0,2,0,0,0,0|1,0,0]=3 8861 B17R1.754 CCCCOCCNCC(=O)c1ccccn1 d2fb18203e5af0e35de42cebc06ee41a [0,2,0,0,0,0|2,0,0]=4 8862 B17R1.754 CCCCOCCNCC(=O)c1cccnc1 cf3d6dc9df05b036cf915e846135b544 [0,2,0,0,0,0|2,0,0]=4 8863 B17R1.754 CCCCOCCOCC(=O)c1ccccc1 b278538dcf750c8251ee49a11d6f958f [0,2,0,0,0,0|0,0,0]=2 8864 B17R1.754 CCCCOCCOCC(=O)c1ccccn1 001de42022a569b35ecc720c3f93fc78 [0,2,0,0,0,0|1,0,0]=3 8865 B17R1.754 CCCCOCCOCC(=O)c1cccnc1 5f8033bd9782ce688d54fb9428bbc107 [0,2,0,0,0,0|1,0,0]=3 8866 B17R1.754 CCCCOCCOCC(=O)c1ccncn1 1a4545af97a49df35d2f37a2f4b48ef0 [0,2,0,0,0,0|2,0,0]=4 8867 B17R1.754 CCCCOCCOCC(=O)c1cnccn1 8dc66b0047ec76085adc2ce11fbeae0c [0,2,0,0,0,0|2,0,0]=4 8868 B17R1.754 CCCCOCCOCC(C)c1ccccc1 16157b6c72a9291d22180b63975e2e52 [0,2,0,0,0,0|1,0,1]=4 8869 B17R1.754 CCCCOCCOCC(F)c1ccccc1 2313c339a8c50886f9ff6fe918c96869 [0,2,0,0,0,0|1,0,1]=4 8870 B17R1.754 CCCCOCCOC[C@@H](C)c1ccccc1 61347c2f550f44ee1264ea340881a703 [0,2,0,0,0,0|1,0,1]=4 8871 B17R1.754 CCCCOCCOC[C@H](C)c1ccccc1 64ebc538492b95349b2824ebb3dbb570 [0,2,0,0,0,0|1,0,1]=4 8872 B17R1.754 CCCCOCOCCC(=O)c1ccccc1 99be1af757e8145750514b66adfdda3a [0,2,0,0,0,0|1,0,0]=3 8873 B17R1.754 CCCCOCOCNC(=O)c1ccccc1 daf6b6968680cb1df1a73f7b248f357c [0,2,0,0,0,0|1,0,0]=3 8874 B17R1.754 CCCCOCOCNC(=O)c1cccnc1 a05aa19ad6437dcfc49a7e8b1e51e4b8 [0,2,0,0,0,0|2,0,0]=4 8875 B17R1.754 CCCCSCCOCC(=O)c1ccccc1 53731abcfd68bd27583c75a8952cb2ce [0,2,0,0,0,0|0,0,0]=2 8876 B17R1.754 CCCCSCCOCC(=O)c1ccccn1 7d28440f076d1c0d321ac9b0c69f537a [0,2,0,0,0,0|1,0,0]=3 8877 B17R1.754 CCCCSCCOCC(=O)c1cccnc1 b0a23720c60e795d6c71ff898ff1e918 [0,2,0,0,0,0|1,0,0]=3 8878 B17R1.754 CCCCSCCOCC(=O)c1ccncn1 56f83dfc89dad9375303f2ccb641a87a [0,2,0,0,0,0|2,0,0]=4 8879 B17R1.754 CCCCSCCOCC(=O)c1cnccn1 e4a16c85a40b5cba4bad6401f52020bc [0,2,0,0,0,0|2,0,0]=4 8880 B17R1.754 CCCCSCCOCC(C)c1ccccc1 2773c9f7fa83879e30ab0c31026f1971 [0,2,0,0,0,0|1,0,1]=4 8881 B17R1.754 CCCCSCCOC[C@@H](C)c1ccccc1 d146e19478f55edee52c2e41b42b7171 [0,2,0,0,0,0|1,0,1]=4 8882 B17R1.754 CCCNCCCCOC(=O)c1ccccc1 965f4b74a430dfe80b9e1ae24412587f [0,2,0,0,0,0|0,0,0]=2 8883 B17R1.754 CCCOCCCCOC(=O)c1ccccc1 2152976f93afe9d2e10bce0d9d7da8e5 [0,2,0,0,0,0|0,0,0]=2 8884 B17R1.754 CCCOCCCNCC(=O)c1ccccc1 8ae502e5f09775ae60568badc364a64f [0,2,0,0,0,0|1,0,0]=3 8885 B17R1.754 CCCOCCCNCC(=O)c1ccccn1 9ec43f74509c2488e35881021c05c3a2 [0,2,0,0,0,0|2,0,0]=4 8886 B17R1.754 CCCOCCCNCC(=O)c1cccnc1 d2bd469b35090bc364e198de8ce7471f [0,2,0,0,0,0|2,0,0]=4 8887 B17R1.754 CCCOCCCOCC(=O)c1ccccc1 943598b7482a9487f3a83aa84dc32210 [0,2,0,0,0,0|0,0,0]=2 8888 B17R1.754 CCCOCCCOCC(=O)c1ccccn1 3f8358cf389f8b044e6597cfc6e70f7b [0,2,0,0,0,0|1,0,0]=3 8889 B17R1.754 CCCOCCCOCC(=O)c1cccnc1 0e468c7890048ab82f2c36c77cb7bba6 [0,2,0,0,0,0|1,0,0]=3 8890 B17R1.754 CCCOCCCOCC(C)c1ccccc1 53d97974f9115775e68fb3acb54f466f [0,2,0,0,0,0|1,0,1]=4 8891 B17R1.754 CCCOCCCOC[C@@H](C)c1ccccc1 e7f1c59983f71241e44e49956b369827 [0,2,0,0,0,0|1,0,1]=4 8892 B17R1.754 CCCOCCCOC[C@H](C)c1ccccc1 5c2ae71a7932ad92458a1406ebcb2cd1 [0,2,0,0,0,0|1,0,1]=4 8893 B17R1.754 CCCOCCNCOC(=O)c1ccccc1 053e3b6efb4c2b069d9b37b09c37ed3b [0,2,0,0,0,0|0,0,0]=2 8894 B17R1.754 CCCOCCOCCC(=O)c1ccccc1 0a0177f768d4281d8d8d482030ba06fe [0,2,0,0,0,0|1,0,0]=3 8895 B17R1.754 CCCOCCOCCS(=O)c1ccccc1 efb689f61e0560e15f9a605ff004656a [0,2,0,0,0,0|2,0,0]=4 8896 B17R1.754 CCCOCCOCNC(=O)c1ccccc1 defc42f15e9873c7da1685a40d0338b6 [0,2,0,0,0,0|1,0,0]=3 8897 B17R1.754 CCCOCCOCNC(=O)c1cccnc1 640c4c634c5ff6b35785f31dc9a303b4 [0,2,0,0,0,0|2,0,0]=4 8898 B17R1.754 CCCOCCOCOC(=O)c1ccccc1 3be9b628fb5d2f4bed774e159a47e6d5 [0,2,0,0,0,0|0,0,0]=2 8899 B17R1.754 CCCSCCCCNC(=O)c1ccccc1 a089179fb0e38735a029debd9e897ceb [0,2,0,0,0,0|1,0,0]=3 8900 B17R1.754 CCCSCCCCNC(=O)c1ccccn1 5bb3c8ebbe233eddfbe7a393f42cbca6 [0,2,0,0,0,0|2,0,0]=4 8901 B17R1.754 CCCSCCCCNC(=O)c1cccnc1 0b882c347943369d2be7de092b2a1082 [0,2,0,0,0,0|2,0,0]=4 8902 B17R1.754 CCCSCCCCNC(=O)c1ccncc1 065c7e9cd5ae1861abe21e914e266956 [0,2,0,0,0,0|2,0,0]=4 8903 B17R1.754 CCCSCCOCOC(=O)c1ccccc1 9b57deb0f3aa78d4f2cb832a3a66ebae [0,2,0,0,0,0|0,0,0]=2 8904 B17R1.754 CCOCCCOCCC(=O)c1ccccc1 b1342bd0e2723f608d4568c5862e0e8b [0,2,0,0,0,0|1,0,0]=3 8905 B17R1.754 CCOCCCOCCS(=O)c1ccccc1 e1fb20dd899f1b03b9288b93e130fd7e [0,2,0,0,0,0|2,0,0]=4 8906 B17R1.754 CCOCCCOCNC(=O)c1ccccc1 45013fa565b96ef912ce6986183e2f1e [0,2,0,0,0,0|1,0,0]=3 8907 B17R1.754 CCOCCCOCNC(=O)c1cccnc1 7f9fcecc3efc18d50e9288f22ca791f6 [0,2,0,0,0,0|2,0,0]=4 8908 B17R1.754 CCOCCCOCOC(=O)c1ccccc1 442cd5193175f8459b47394c90cccde9 [0,2,0,0,0,0|0,0,0]=2 8909 B17R1.754 CCOCCNCCNC(=O)c1ccccn1 273fb70cbc5856ea1a24879a6069b823 [0,2,0,0,0,0|2,0,0]=4 8910 B17R1.754 CCOCCNCCNC(=O)c1ccncc1 942d2362b0bca80d885d454572af63e1 [0,2,0,0,0,0|2,0,0]=4 8911 B17R1.754 CCOCCNCCOC(=O)c1ccccc1 6673c400143065211425464d56071f25 [0,2,0,0,0,0|0,0,0]=2 8912 B17R1.754 CCOCCOCCCC(=O)c1ccccc1 4728928f7a8e2eaf44b6cbaeeb9776bc [0,2,0,0,0,0|1,0,0]=3 8913 B17R1.754 CCOCCOCCCC(=O)c1cccnc1 106ea637a8f73bf3ab69f399a7f33de4 [0,2,0,0,0,0|2,0,0]=4 8914 B17R1.754 CCOCCOCCCS(=O)c1ccccc1 622a831df66a8c751e634a10493b02fa [0,2,0,0,0,0|2,0,0]=4 8915 B17R1.754 CCOCCOCCNC(=O)c1ccccc1 ed0f62867b0a6884a01483f2ff39c3de [0,2,0,0,0,0|1,0,0]=3 8916 B17R1.754 CCOCCOCCNC(=O)c1ccccn1 cc7af0d1a290a7ebb0d79225217a7e1d [0,2,0,0,0,0|2,0,0]=4 8917 B17R1.754 CCOCCOCCNC(=O)c1cccnc1 a210433dfa8cf46219d88a6ff2c51fee [0,2,0,0,0,0|2,0,0]=4 8918 B17R1.754 CCOCCOCCNC(=O)c1ccncc1 511a46046d00c332299f47ceddd37897 [0,2,0,0,0,0|2,0,0]=4 8919 B17R1.754 CCOCCOCCOC(=O)c1ccccc1 4d77aa9572ce087825820a16db527948 [0,2,0,0,0,0|0,0,0]=2 8920 B17R1.754 CCOCCOCCOC(=O)c1cccnc1 3a088dec8457c5049543af7432fa9bc3 [0,2,0,0,0,0|1,0,0]=3 8921 B17R1.754 CCOCCOCCOC(C)c1ccccc1 29c6c6041bdc0bc8dda7c97b404ca505 [0,2,0,0,0,0|1,0,1]=4 8922 B17R1.754 CCOCCOCCO[C@@H](C)c1ccccc1 29ccb5c7008a5f1040c57f55e7f6c3c7 [0,2,0,0,0,0|1,0,1]=4 8923 B17R1.754 CCOCCOCCO[C@H](C)c1ccccc1 1660771f6c17b1b0769e32102af9876c [0,2,0,0,0,0|1,0,1]=4 8924 B17R1.754 CCOCOCCCNC(=O)c1ccccc1 0dd4891de3857c3a900c6f001fe04402 [0,2,0,0,0,0|1,0,0]=3 8925 B17R1.754 CCSCCCCNCC(=O)c1ccccc1 4c0d5318e4e9f4b09aa54c2b7b0da9c3 [0,2,0,0,0,0|1,0,0]=3 8926 B17R1.754 CCSCCCCNCC(=O)c1ccccn1 b97c33209eab0096475c1830c78a7b4a [0,2,0,0,0,0|2,0,0]=4 8927 B17R1.754 CCSCCCCNCC(=O)c1cccnc1 a0dc50000adfeaaff49cdc458c99d8a1 [0,2,0,0,0,0|2,0,0]=4 8928 B17R1.754 CCSCCCOCCC(=O)c1ccccc1 7cd8216a713b7ca2159b5f111803169f [0,2,0,0,0,0|1,0,0]=3 8929 B17R1.754 CCSCCCOCNC(=O)c1ccccc1 0c3beae133c156a4d0d684df6fe467cf [0,2,0,0,0,0|1,0,0]=3 8930 B17R1.754 CCSCCCOCNC(=O)c1cccnc1 30fb40f1a96b45acb9a5770f703196bc [0,2,0,0,0,0|2,0,0]=4 8931 B17R1.754 CCSCCCOCOC(=O)c1ccccc1 e433f991692acea73080f9ae64734d91 [0,2,0,0,0,0|0,0,0]=2 8932 B17R1.754 CCSCCNCCNC(=O)c1ccccc1 79f5464d09379fc5c7c79aff2b48a935 [0,2,0,0,0,0|1,0,0]=3 8933 B17R1.754 CCSCCNCCNC(=O)c1ccccn1 451db21ccd77239f45f8d02677e25333 [0,2,0,0,0,0|2,0,0]=4 8934 B17R1.754 CCSCCNCCNC(=O)c1ccncc1 3b7dedd41f31aeb5a1610d2c22b7123a [0,2,0,0,0,0|2,0,0]=4 8935 B17R1.754 CCSCCNCCOC(=O)c1ccccc1 63da9596168cef4c920d051ebc1fa0d7 [0,2,0,0,0,0|0,0,0]=2 8936 B17R1.754 CCSCCOCCCC(=O)c1ccccc1 2aff31e9b1644637ca018c2fac6f8322 [0,2,0,0,0,0|1,0,0]=3 8937 B17R1.754 CCSCCOCCCC(=O)c1cccnc1 2598ecff058f8901939036bae5f919ea [0,2,0,0,0,0|2,0,0]=4 8938 B17R1.754 CCSCCOCCNC(=O)c1ccccc1 20631cc453445ecaccac546164f03e30 [0,2,0,0,0,0|1,0,0]=3 8939 B17R1.754 CCSCCOCCNC(=O)c1ccccn1 69fd0d03984494b1ef3eb2a277efca3e [0,2,0,0,0,0|2,0,0]=4 8940 B17R1.754 CCSCCOCCNC(=O)c1cccnc1 b92ed5928057b5d98348fe3a43ab7b09 [0,2,0,0,0,0|2,0,0]=4 8941 B17R1.754 CCSCCOCCNC(=O)c1ccncc1 f45d068ceaf9a3b4f33a19fba83c1d2e [0,2,0,0,0,0|2,0,0]=4 8942 B17R1.754 CCSCCOCCOC(=O)c1ccccc1 1298dd6cb3b756639162589cf8210e48 [0,2,0,0,0,0|0,0,0]=2 8943 B17R1.754 CCSCCOCCOC(=O)c1cccnc1 79ef7e8e66db0e7f08250937626ecba5 [0,2,0,0,0,0|1,0,0]=3 8944 B17R1.754 COCCCCCCOC(C)c1ccccc1 a0f4ee6fd42f7697793431d4e680ee7e [0,2,0,0,0,0|1,0,1]=4 8945 B17R1.754 COCCCCCCO[C@@H](C)c1ccccc1 a1bdf0ebf60bcfa197bd95f4fd692cfd [0,2,0,0,0,0|1,0,1]=4 8946 B17R1.754 COCCCCCCO[C@H](C)c1ccccc1 e6acef6bc48fff75a967ed9ff0b0bb18 [0,2,0,0,0,0|1,0,1]=4 8947 B17R1.754 COCCCCCNCC(=O)c1ccccc1 dc94319196986499a9ff0da2c07d3a9c [0,2,0,0,0,0|1,0,0]=3 8948 B17R1.754 COCCCCCNCC(=O)c1ccccn1 a74b86226df0fe4120e32f5f5ae69d0d [0,2,0,0,0,0|2,0,0]=4 8949 B17R1.754 COCCCCCNCC(=O)c1cccnc1 52b7246029b721beb02affc36d770c99 [0,2,0,0,0,0|2,0,0]=4 8950 B17R1.754 COCCCCCOCC(=O)c1ccccc1 bb27b431018ea60fd9a7a5b0ae9b6546 [0,2,0,0,0,0|0,0,0]=2 8951 B17R1.754 COCCCCCOCC(=O)c1ccccn1 ea2166bd92e8707d062629b866d70efd [0,2,0,0,0,0|1,0,0]=3 8952 B17R1.754 COCCCCCOCC(=O)c1cccnc1 54f09fa1bb509158f46152b2058f9292 [0,2,0,0,0,0|1,0,0]=3 8953 B17R1.754 COCCCCCOCC(C)c1ccccc1 e577aaae08b8477e6e51d50fa2f53bfb [0,2,0,0,0,0|1,0,1]=4 8954 B17R1.754 COCCCCCOC[C@@H](C)c1ccccc1 3fbd2324e7053aa944d7296f2656dae0 [0,2,0,0,0,0|1,0,1]=4 8955 B17R1.754 COCCCCCOC[C@H](C)c1ccccc1 67f623e18bab3b72a207701b37efa335 [0,2,0,0,0,0|1,0,1]=4 8956 B17R1.754 COCCCCNCOC(=O)c1ccccc1 0eaf068d55dba76b0770e2bda5382bc4 [0,2,0,0,0,0|0,0,0]=2 8957 B17R1.754 COCCCCOCCC(=O)c1ccccc1 c840dcd7abd03d7e8e89bbf0193b7544 [0,2,0,0,0,0|1,0,0]=3 8958 B17R1.754 COCCCCOCCS(=O)c1ccccc1 8c0fe0f818f3cb132e904b0e36d6fa78 [0,2,0,0,0,0|2,0,0]=4 8959 B17R1.754 COCCCCOCNC(=O)c1ccccc1 3c5cc71803477f78f5cd0336ba809b72 [0,2,0,0,0,0|1,0,0]=3 8960 B17R1.754 COCCCCOCNC(=O)c1cccnc1 c0d46b05b019483b88747e249af8b223 [0,2,0,0,0,0|2,0,0]=4 8961 B17R1.754 COCCCCOCOC(=O)c1ccccc1 387418bfd2b57e591f0583db67368c76 [0,2,0,0,0,0|0,0,0]=2 8962 B17R1.754 COCCCNCCNC(=O)c1ccccn1 998d218b77772aa6534b67fde19e1bbe [0,2,0,0,0,0|2,0,0]=4 8963 B17R1.754 COCCCNCCNC(=O)c1ccncc1 483a547bacd2f5eecc823cb04e59168e [0,2,0,0,0,0|2,0,0]=4 8964 B17R1.754 COCCCNCCOC(=O)c1ccccc1 2c7f7a2bf3400e7339a4c399f600d2de [0,2,0,0,0,0|0,0,0]=2 8965 B17R1.754 COCCCOCCCC(=O)c1ccccc1 603bfb16780726104224a47b68d5ab04 [0,2,0,0,0,0|1,0,0]=3 8966 B17R1.754 COCCCOCCCC(=O)c1cccnc1 17f7d309825211d5549a99f9adac8ea4 [0,2,0,0,0,0|2,0,0]=4 8967 B17R1.754 COCCCOCCCS(=O)c1ccccc1 232083edf78e49b883c6ee30f54077b8 [0,2,0,0,0,0|2,0,0]=4 8968 B17R1.754 COCCCOCCNC(=O)c1ccccc1 c5f10b973c753f5f72bd3b65a2b6067b [0,2,0,0,0,0|1,0,0]=3 8969 B17R1.754 COCCCOCCNC(=O)c1ccccn1 76ad851ce90e9398ddc537b3813d9ad8 [0,2,0,0,0,0|2,0,0]=4 8970 B17R1.754 COCCCOCCNC(=O)c1cccnc1 d1f71dd7fd9592836e9c4a6a5f1ac6bb [0,2,0,0,0,0|2,0,0]=4 8971 B17R1.754 COCCCOCCNC(=O)c1ccncc1 a4ef1ad81213d8f31495178ebe2b7aa6 [0,2,0,0,0,0|2,0,0]=4 8972 B17R1.754 COCCCOCCOC(=O)c1ccccc1 481a1f6f76b1746ef6b06c437aaf58e5 [0,2,0,0,0,0|0,0,0]=2 8973 B17R1.754 COCCCOCCOC(=O)c1cccnc1 616024e3ccf9090248b481a6127598f6 [0,2,0,0,0,0|1,0,0]=3 8974 B17R1.754 COCCOCCCNC(=O)c1ccccc1 32d148644c911b5f92c234ce715e77a1 [0,2,0,0,0,0|1,0,0]=3 8975 B17R1.754 COCCOCCCNC(=O)c1ccccn1 1e3c81bc5034edfae43bc24ee7614b92 [0,2,0,0,0,0|2,0,0]=4 8976 B17R1.754 COCCOCCCNC(=O)c1cccnc1 e6b0f0a60c9b67df33bd4a48b6bf1e0c [0,2,0,0,0,0|2,0,0]=4 8977 B17R1.754 COCCOCCCNC(=O)c1ccncc1 5369a03a3b0bc532c30c5f7659b71a68 [0,2,0,0,0,0|2,0,0]=4 8978 B17R1.754 COCCOCCCOC(=O)c1ccccc1 18843290689860facbf672e76d52716e [0,2,0,0,0,0|0,0,0]=2 8979 B17R1.754 COCCOCCCOC(C)c1ccccc1 5c1e4a2be232c7ca44f20b278182a817 [0,2,0,0,0,0|1,0,1]=4 8980 B17R1.754 COCCOCCCO[C@@H](C)c1ccccc1 74bc1f15366a109335632e2618276845 [0,2,0,0,0,0|1,0,1]=4 8981 B17R1.754 COCCOCCCO[C@H](C)c1ccccc1 680f513a7d4cabadf6cf27841fc397a0 [0,2,0,0,0,0|1,0,1]=4 8982 B17R1.754 COCCOCCNCC(=O)c1ccccc1 c90492f74bf77a5165b351e20c911a16 [0,2,0,0,0,0|2,0,0]=4 8983 B17R1.754 COCCOCCOCC(=O)c1ccccc1 e8f83e75eb270ce9d31947285d99baf2 [0,2,0,0,0,0|1,0,0]=3 8984 B17R1.754 COCCOCCOCC(=O)c1ccccn1 d6fadbca087964c956d33407cf58ead1 [0,2,0,0,0,0|2,0,0]=4 8985 B17R1.754 COCCOCCOCC(=O)c1cccnc1 c05d44120c16ec0360fa3246168a8b41 [0,2,0,0,0,0|2,0,0]=4 8986 B17R1.754 COCCOCCOCS(=O)c1ccccc1 fbad8613d8317e0dcecaaa504cfc06a8 [0,2,0,0,0,0|2,0,0]=4 8987 B17R1.754 COCCOCOCCC(=O)c1ccccc1 ccaa87710093d09bc3a4dce1e5655600 [0,2,0,0,0,0|2,0,0]=4 8988 B17R1.754 COCCOCOCNC(=O)c1ccccc1 81b3fedb18ffb998aca52dfbb46fcdfd [0,2,0,0,0,0|2,0,0]=4 8989 B17R1.754 COCOCCCCOC(=O)c1ccccc1 e5115f6887609f518e10f804c6a84226 [0,2,0,0,0,0|0,0,0]=2 8990 B17R1.754 COCOCCOCCC(=O)c1ccccc1 d963550926b99f6d0837163fe6a3be4c [0,2,0,0,0,0|2,0,0]=4 8991 B17R1.754 COCOCCOCNC(=O)c1ccccc1 ce7922a5fe54cfa8bb5621b855c4776b [0,2,0,0,0,0|2,0,0]=4 8992 B17R1.754 CSCCCCNCOC(=O)c1ccccc1 09845552815f4af406c330aca151e86f [0,2,0,0,0,0|0,0,0]=2 8993 B17R1.754 CSCCCCOCOC(=O)c1ccccc1 f9deb493baa830f220be6270604b41b2 [0,2,0,0,0,0|0,0,0]=2 8994 B17R1.754 CSCCCNCCNC(=O)c1ccccn1 15a12b25a4dd32a54c4e5f12a115d0f9 [0,2,0,0,0,0|2,0,0]=4 8995 B17R1.754 CSCCCNCCNC(=O)c1ccncc1 7bb212c2bcf9f9281c151739ac77e000 [0,2,0,0,0,0|2,0,0]=4 8996 B17R1.754 CSCCCNCCOC(=O)c1ccccc1 07b7ac684c6d2bd4b7c4902564e838c0 [0,2,0,0,0,0|0,0,0]=2 8997 B17R1.754 CSCCCOCCCC(=O)c1ccccc1 e6b3dd3281682566304311629f6b5f15 [0,2,0,0,0,0|1,0,0]=3 8998 B17R1.754 CSCCCOCCCC(=O)c1cccnc1 ff26631c99546c0d74b7fe5eec162958 [0,2,0,0,0,0|2,0,0]=4 8999 B17R1.754 CSCCCOCCNC(=O)c1ccccc1 f662571cf2b33c5238b9e52c9eb2320d [0,2,0,0,0,0|1,0,0]=3 9000 B17R1.754 CSCCCOCCNC(=O)c1ccccn1 3087741c4a9934e4b5760c43826cd1ba [0,2,0,0,0,0|2,0,0]=4 9001 B17R1.754 CSCCCOCCNC(=O)c1cccnc1 f8e97d0d7596ac23604c6c4c16191a6b [0,2,0,0,0,0|2,0,0]=4 9002 B17R1.754 CSCCCOCCNC(=O)c1ccncc1 10ebd926b7716175b990b0df5063eee4 [0,2,0,0,0,0|2,0,0]=4 9003 B17R1.754 CSCCCOCCOC(=O)c1ccccc1 7802aefe1ca23e57d64fe316570cf8ef [0,2,0,0,0,0|0,0,0]=2 9004 B17R1.754 CSCCCOCCOC(=O)c1cccnc1 cf266aba54dc82dbf94772cfcabaafc6 [0,2,0,0,0,0|1,0,0]=3 9005 B17R1.754 CSCCOCCCNC(=O)c1ccccc1 b8a0198064a1f75aacd2d91ce77434a5 [0,2,0,0,0,0|1,0,0]=3 9006 B17R1.754 CSCCOCCCNC(=O)c1ccccn1 d0d7e62266b4f2d99ae167ef84e1c2c1 [0,2,0,0,0,0|2,0,0]=4 9007 B17R1.754 CSCCOCCCNC(=O)c1cccnc1 38cedf1599c566ca161103b62bee4b5a [0,2,0,0,0,0|2,0,0]=4 9008 B17R1.754 CSCCOCCCNC(=O)c1ccncc1 6067b739669c88365eae86d8b6f0bca5 [0,2,0,0,0,0|2,0,0]=4 9009 B17R1.754 C[C@@H](COCCCCCCF)c1ccccc1 d4ff91994567c727244be74d231ce920 [0,2,0,0,0,0|1,0,1]=4 9010 B17R1.754 C[C@@H](OCCCCCCC#N)c1ccccc1 1c007fce30b2d015b3c1a8c6316b3381 [0,2,0,0,0,0|1,0,1]=4 9011 B17R1.754 C[C@@H](OCCCCCCC=O)c1ccccc1 61233585374e204071c6f0bf636b568c [0,2,0,0,0,0|1,0,1]=4 9012 B17R1.754 C[C@H](COCCCCCCF)c1ccccc1 2f26f793dd340ad216b30959fd5e4a79 [0,2,0,0,0,0|1,0,1]=4 9013 B17R1.754 C[C@H](COCCCCCCS)c1ccccc1 55dec55c93d7388bab87010fa5c4ea2d [0,2,0,0,0,0|1,0,1]=4 9014 B17R1.754 C[C@H](OCCCCCCC#N)c1ccccc1 d16e947ec2c68e78f4a06c14e1fd7f41 [0,2,0,0,0,0|1,0,1]=4 9015 B17R1.754 C[C@H](OCCCCCCC=O)c1ccccc1 9e2ad57ebb5bb854d49af1932d97c0cf [0,2,0,0,0,0|1,0,1]=4 9016 B17R1.754 FC(COCCCCCCS)c1ccccc1 42a343c51cb00ceda28e192d5e748e38 [0,2,0,0,0,0|1,0,1]=4 9017 B17R1.754 FCCCCCCOCC(F)c1ccccc1 7d373df5752de940932a48d3dd2f38c1 [0,2,0,0,0,0|1,0,1]=4 9018 B17R1.754 N#CCCCCCNCC(=O)c1ccccc1 e8436aae3b64e8c3cea6c0c89e2ff059 [0,2,0,0,0,0|1,0,1]=4 9019 B17R1.754 N#CCCCCCOCC(=O)c1ccccc1 e00733305419ca03f75ae6b740e54cc1 [0,2,0,0,0,0|0,0,1]=3 9020 B17R1.754 N#CCCCCCOCC(=O)c1ccccn1 310e0045b9ce7f55b4eebbbca286bce4 [0,2,0,0,0,0|1,0,1]=4 9021 B17R1.754 N#CCCCCCOCC(=O)c1cccnc1 90679176596d220f7a243f7878fec6ef [0,2,0,0,0,0|1,0,1]=4 9022 B17R1.754 N#CCCCCNCOC(=O)c1ccccc1 4538635a303d5abad5915d9bbe1d9280 [0,2,0,0,0,0|0,0,1]=3 9023 B17R1.754 N#CCCCCOCCC(=O)c1ccccc1 7d6f0947a8f8ee3f992f6d2d53353c18 [0,2,0,0,0,0|1,0,1]=4 9024 B17R1.754 N#CCCCCOCNC(=O)c1ccccc1 e1dba899a41b28eda40423175d4d0f64 [0,2,0,0,0,0|1,0,1]=4 9025 B17R1.754 N#CCCCCOCOC(=O)c1ccccc1 39658f2b9bfe6061c89afff41072d9ac [0,2,0,0,0,0|0,0,1]=3 9026 B17R1.754 N#CCCCNCCOC(=O)c1ccccc1 312a070fb5c7a878f111f8e59969cb70 [0,2,0,0,0,0|0,0,1]=3 9027 B17R1.754 N#CCCCOCCCC(=O)c1ccccc1 883207ecc043e3887ea0a46340cbab3c [0,2,0,0,0,0|1,0,1]=4 9028 B17R1.754 N#CCCCOCCNC(=O)c1ccccc1 f36f8aa3605cbe0f71296f792640f457 [0,2,0,0,0,0|1,0,1]=4 9029 B17R1.754 N#CCCCOCCOC(=O)c1ccccc1 08fd45ec30945dcc6350816d51b53921 [0,2,0,0,0,0|0,0,1]=3 9030 B17R1.754 N#CCCCOCCOC(=O)c1cccnc1 5d20fc23afac1d7a1dd84201d6d638e9 [0,2,0,0,0,0|1,0,1]=4 9031 B17R1.754 N#CCCOCCCNC(=O)c1ccccc1 63759ee6ac4bf6479467a79c8bc1da5c [0,2,0,0,0,0|1,0,1]=4 9032 B17R1.754 N#CCCOCCOCC(=O)c1ccccc1 9ccb8cdc6f19f1c5d93d43a65fed6863 [0,2,0,0,0,0|1,0,1]=4 9033 B17R1.754 N#CCNCCCCOC(=O)c1ccccc1 99f56a63bc226f810f3f54b2957ecc3a [0,2,0,0,0,0|0,0,1]=3 9034 B17R1.754 N#CCOCCCCOC(=O)c1ccccc1 2120de36a713d76b266fea45fc97e3e0 [0,2,0,0,0,0|0,0,1]=3 9035 B17R1.754 N#CCOCCCOCC(=O)c1ccccc1 cf67141fb5fcf031e963a6cbec2c7455 [0,2,0,0,0,0|1,0,1]=4 9036 B17R1.754 N#CNCCOCCOC(=O)c1ccccc1 d564c479f6a25948213bf0878011451b [0,2,0,0,0,0|1,0,1]=4 9037 B17R1.754 O=C(CCCOCCCCF)c1ccccc1 2630a321472ae3ed28502e684c61057c [0,2,0,0,0,0|1,0,0]=3 9038 B17R1.754 O=C(CCCOCCCCF)c1cccnc1 cdf7688bdb949f8aca767f88c3a50fe5 [0,2,0,0,0,0|2,0,0]=4 9039 B17R1.754 O=C(CCOCCCCCF)c1ccccc1 e6ecf7967b430d60b581ae159ab09bb8 [0,2,0,0,0,0|1,0,0]=3 9040 B17R1.754 O=C(CCOCCOCCF)c1ccccc1 449a4717d4f16423b53a91ab77b322b3 [0,2,0,0,0,0|2,0,0]=4 9041 B17R1.754 O=C(CCOCCOCCS)c1ccccc1 ea1f5d48596191d23f5f1d30f33f9d0b [0,2,0,0,0,0|2,0,0]=4 9042 B17R1.754 O=C(CNCCCCCCCl)c1ccccc1 649837378149e98bb718b35808f756e2 [0,2,0,0,0,0|1,0,0]=3 9043 B17R1.754 O=C(CNCCCCCCCl)c1ccccn1 39a3386023ce8121d61b55e024d0982e [0,2,0,0,0,0|2,0,0]=4 9044 B17R1.754 O=C(CNCCCCCCCl)c1cccnc1 3c100f280d1c214f4ee6d1ed94718c59 [0,2,0,0,0,0|2,0,0]=4 9045 B17R1.754 O=C(CNCCCCCCF)c1ccccc1 3a7a1e78c5e6f7450e307be852e4c3af [0,2,0,0,0,0|1,0,0]=3 9046 B17R1.754 O=C(CNCCCCCCO)c1ccccc1 39e25a3624687d399190e7e64fde6251 [0,2,0,0,0,0|1,0,0]=3 9047 B17R1.754 O=C(CNCCCCCCO)c1ccccn1 ff9ec7047603274a6e32e12684862625 [0,2,0,0,0,0|2,0,0]=4 9048 B17R1.754 O=C(CNCCCCCCO)c1cccnc1 2947ed9306d068cb9844ed333297777c [0,2,0,0,0,0|2,0,0]=4 9049 B17R1.754 O=C(CNCCCOCCO)c1ccccc1 695f9b3f6f1d2845c23f829b52f06f02 [0,2,0,0,0,0|2,0,0]=4 9050 B17R1.754 O=C(CNCCOCCCO)c1ccccc1 2029e3fbb0424e12225f9e35dc1d1dbf [0,2,0,0,0,0|2,0,0]=4 9051 B17R1.754 O=C(COCCCCCCF)c1ccccc1 0b53a7ff382c43cf77a3a2687dfd9a11 [0,2,0,0,0,0|0,0,0]=2 9052 B17R1.754 O=C(COCCCCCCF)c1ccccn1 4dd60248c4e3ca19887fc07a22042790 [0,2,0,0,0,0|1,0,0]=3 9053 B17R1.754 O=C(COCCCCCCF)c1cccnc1 8d6e004ed7fe7080fa5051e72a0ba470 [0,2,0,0,0,0|1,0,0]=3 9054 B17R1.754 O=C(COCCCCCCF)c1ccncn1 8ac5d2a94f5f886df2aad2288f998ac6 [0,2,0,0,0,0|2,0,0]=4 9055 B17R1.754 O=C(COCCCCCCF)c1cnccn1 2e4cfe429c8e5507898d5db2de76f62e [0,2,0,0,0,0|2,0,0]=4 9056 B17R1.754 O=C(COCCCCCCS)c1ccccc1 a2d0ba9e828490400e9020837508d127 [0,2,0,0,0,0|0,0,0]=2 9057 B17R1.754 O=C(COCCCCCCS)c1ccccn1 ca08c7ca0bedf181867f4d6e67b25e44 [0,2,0,0,0,0|1,0,0]=3 9058 B17R1.754 O=C(COCCCCCCS)c1cccnc1 9d296d3e2a3de853cbb90bb70d227604 [0,2,0,0,0,0|1,0,0]=3 9059 B17R1.754 O=C(COCCCCCCS)c1ccncn1 25b7bd8d2d37c767fa00ec0a2399dac3 [0,2,0,0,0,0|2,0,0]=4 9060 B17R1.754 O=C(COCCCCCCS)c1cnccn1 0e60df503f74873a27b10eb7604e91bd [0,2,0,0,0,0|2,0,0]=4 9061 B17R1.754 O=C(NCCCCCCCO)c1ccccc1 b73a9434091c693aff693f937979b7e2 [0,2,0,0,0,0|1,0,0]=3 9062 B17R1.754 O=C(NCCCCCCCO)c1ccccn1 711499927a1e09a4713b9613ca4e3352 [0,2,0,0,0,0|2,0,0]=4 9063 B17R1.754 O=C(NCCCCCCCO)c1cccnc1 26a0380963b8e58f36b87bc3830fe3e5 [0,2,0,0,0,0|2,0,0]=4 9064 B17R1.754 O=C(NCCCCCCCO)c1ccncc1 d3d1f58cea16e280ca7160199e0b41c8 [0,2,0,0,0,0|2,0,0]=4 9065 B17R1.754 O=C(NCCCCSCCO)c1ccccc1 99a26571de665620345d34bb79164de5 [0,2,0,0,0,0|1,0,0]=3 9066 B17R1.754 O=C(NCCCCSCCO)c1ccccn1 544040830d079ce8271cd118c8dc8178 [0,2,0,0,0,0|2,0,0]=4 9067 B17R1.754 O=C(NCCCCSCCO)c1cccnc1 aee8f3b2d11ab5983e8fb67225d3717c [0,2,0,0,0,0|2,0,0]=4 9068 B17R1.754 O=C(NCCCCSCCO)c1ccncc1 bdbf16e16a4f9e8972832e9150f0dfad [0,2,0,0,0,0|2,0,0]=4 9069 B17R1.754 O=C(NCCCOCCCF)c1ccccc1 d8cafc18a5ec133bb8897a9d443b14eb [0,2,0,0,0,0|1,0,0]=3 9070 B17R1.754 O=C(NCCCOCCCO)c1ccccc1 6127cf2e6169cb89f07ae561504c9c2a [0,2,0,0,0,0|1,0,0]=3 9071 B17R1.754 O=C(NCCCOCCCO)c1ccccn1 eb406ac78fcd4bcfeafebaf83959fbd9 [0,2,0,0,0,0|2,0,0]=4 9072 B17R1.754 O=C(NCCCOCCCO)c1cccnc1 632f7ff615fd18ae91bed7e0150d9d18 [0,2,0,0,0,0|2,0,0]=4 9073 B17R1.754 O=C(NCCCOCCCO)c1ccncc1 2d4c378e5207283b285b124e9c6b4d11 [0,2,0,0,0,0|2,0,0]=4 9074 B17R1.754 O=C(NCCCOCCCS)c1ccccc1 fb213ddf52aa8809193dc3c741522123 [0,2,0,0,0,0|1,0,0]=3 9075 B17R1.754 O=C(NCCNCCCCCl)c1ccccc1 65da8cd6d33b9fbf0afe4979a6ec35e4 [0,2,0,0,0,0|1,0,0]=3 9076 B17R1.754 O=C(NCCNCCCCCl)c1ccccn1 ebf01445d4b2a8dd3ca6c3b8e56902d5 [0,2,0,0,0,0|2,0,0]=4 9077 B17R1.754 O=C(NCCNCCCCF)c1ccncc1 4f05ddac13ee1564f237af4cf351405f [0,2,0,0,0,0|2,0,0]=4 9078 B17R1.754 O=C(NCCNCCCCO)c1ccccn1 478b964f43c376cd430cbba0b7e63141 [0,2,0,0,0,0|2,0,0]=4 9079 B17R1.754 O=C(NCCNCCCCO)c1ccncc1 ff8e30cd192d79b7d0dad73f30e61425 [0,2,0,0,0,0|2,0,0]=4 9080 B17R1.754 O=C(NCCNCCCCS)c1ccccn1 0a189ce9d771c02089639a4cb45679ef [0,2,0,0,0,0|2,0,0]=4 9081 B17R1.754 O=C(NCCOCCCCF)c1ccccc1 a1e3626467ca8f1cb3903650f56826a1 [0,2,0,0,0,0|1,0,0]=3 9082 B17R1.754 O=C(NCCOCCCCF)c1ccccn1 21b5cf63e8e411b022074d237bb9d0e3 [0,2,0,0,0,0|2,0,0]=4 9083 B17R1.754 O=C(NCCOCCCCF)c1cccnc1 599e2e208d9450791720163e9317ae6d [0,2,0,0,0,0|2,0,0]=4 9084 B17R1.754 O=C(NCCOCCCCF)c1ccncc1 4fb29dab059f5a665a038d3756b2b97c [0,2,0,0,0,0|2,0,0]=4 9085 B17R1.754 O=C(NCCOCCCCS)c1ccccn1 a54dc0b998b21b9f91d633ea4ca2a44e [0,2,0,0,0,0|2,0,0]=4 9086 B17R1.754 O=C(NCOCCCCCF)c1ccccc1 dd2cb718afc21ba13a291e4afc5ea090 [0,2,0,0,0,0|1,0,0]=3 9087 B17R1.754 O=C(NCOCCCCCF)c1cccnc1 0be5023c28e29bca5636e678725f373b [0,2,0,0,0,0|2,0,0]=4 9088 B17R1.754 O=C(OCCCCNCCBr)c1ccccc1 accd1e0ee27d9923fc563eb2da3ada21 [0,2,0,0,0,0|0,0,0]=2 9089 B17R1.754 O=C(OCCCCNCCF)c1ccccc1 65443496e9c79c4ac4506390cf4fa460 [0,2,0,0,0,0|0,0,0]=2 9090 B17R1.754 O=C(OCCCCNCCI)c1ccccc1 033e6793d6a3ecf385b52155045380fa [0,2,0,0,0,0|0,0,0]=2 9091 B17R1.754 O=C(OCCCCNCCO)c1ccccc1 3633e1cb439f04d107a3c988811b2d01 [0,2,0,0,0,0|0,0,0]=2 9092 B17R1.754 O=C(OCCCCNCCS)c1ccccc1 a03142084e86f0ee7c1471cabf5813fd [0,2,0,0,0,0|0,0,0]=2 9093 B17R1.754 O=C(OCCCCOCCF)c1ccccc1 7d96e16ac567abe2fea47e8a51083017 [0,2,0,0,0,0|0,0,0]=2 9094 B17R1.754 O=C(OCCCCOCCS)c1ccccc1 4b9f0482d7120a4577817d109085cb67 [0,2,0,0,0,0|0,0,0]=2 9095 B17R1.754 O=C(OCCCNCCCCl)c1ccccc1 0772db2dba7e35b89a2f0bb2bc26b050 [0,2,0,0,0,0|0,0,0]=2 9096 B17R1.754 O=C(OCCCOC/C=C/Cl)c1ccccc1 63609e50fffff1540df87dbf3b9a9a01 [0,2,0,0,0,0|0,0,2]=4 9097 B17R1.754 O=C(OCCCOCC=CCl)c1ccccc1 66bf929251c7e04df8df0c5af3c35cfd [0,2,0,0,0,0|0,0,2]=4 9098 B17R1.754 O=C(OCCCOCCCF)c1ccccc1 61ae3437f398613b634e769a947f12cb [0,2,0,0,0,0|0,0,0]=2 9099 B17R1.754 O=C(OCCNCC#CCO)c1ccccc1 3fe562907a018d4468fe56b9cec690c3 [0,2,0,0,0,0|0,0,2]=4 9100 B17R1.754 O=C(OCCNCCCCCl)c1ccccc1 96d35ce64510029265f89fe0a46ba5aa [0,2,0,0,0,0|0,0,0]=2 9101 B17R1.754 O=C(OCCNCCCCO)c1ccccc1 4a09ccf265d030b67ad4200fd03aea92 [0,2,0,0,0,0|0,0,0]=2 9102 B17R1.754 O=C(OCCNCCCCS)c1ccccc1 5f908cd6b5e6572ae0f50ae749d28d81 [0,2,0,0,0,0|0,0,0]=2 9103 B17R1.754 O=C(OCCOCCCCF)c1ccccc1 59220f75613f38279634597265c08094 [0,2,0,0,0,0|0,0,0]=2 9104 B17R1.754 O=C(OCCOCCCCF)c1cccnc1 5d5c95935105159ab2afe584bc3632f3 [0,2,0,0,0,0|1,0,0]=3 9105 B17R1.754 O=C(OCCOCCCCS)c1ccccc1 3262f6fe8c6d703c890fb78b6f9d07a2 [0,2,0,0,0,0|0,0,0]=2 9106 B17R1.754 O=C(OCCOCCOCF)c1ccccc1 89e89057115a8b834f23bee86baa6095 [0,2,0,0,0,0|1,0,0]=3 9107 B17R1.754 O=C(OCNCCCCCCl)c1ccccc1 629f341ee72b001279724024ce5edf1a [0,2,0,0,0,0|0,0,0]=2 9108 B17R1.754 O=C(OCNCCCCCO)c1ccccc1 eb51e4ce0adec4316b27fabffe116d3a [0,2,0,0,0,0|0,0,0]=2 9109 B17R1.754 O=C(OCNCCOCCO)c1ccccc1 0708cd8bf1f27b522b6827daf4ac84cc [0,2,0,0,0,0|1,0,0]=3 9110 B17R1.754 O=C(OCNCCOCCS)c1ccccc1 fc821ed6139cc76482fd129bbf78604f [0,2,0,0,0,0|1,0,0]=3 9111 B17R1.754 O=C(OCNCCSCCO)c1ccccc1 7f601ae14df55aaa40e4a7352ead8a74 [0,2,0,0,0,0|1,0,0]=3 9112 B17R1.754 O=C(OCOCCOCCF)c1ccccc1 deaf5cb896aef2ef1537ccee07ced1d6 [0,2,0,0,0,0|1,0,0]=3 9113 B17R1.754 O=C(OCOCCOCCS)c1ccccc1 f3a83f9a55dd0349c8c4781bc9c5cb0d [0,2,0,0,0,0|1,0,0]=3 9114 B17R1.754 O=CCCCCCNCC(=O)c1ccccc1 88321fbe0b8b02e0aa7989c53acae178 [0,2,0,0,0,0|1,0,1]=4 9115 B17R1.754 O=CCCCCCOCC(=O)c1ccccc1 7f7436b6bcecbd7806c9f3b59a880606 [0,2,0,0,0,0|0,0,1]=3 9116 B17R1.754 O=CCCCCCOCC(=O)c1ccccn1 e8e9b294de99f96ec14aee9403801691 [0,2,0,0,0,0|1,0,1]=4 9117 B17R1.754 O=CCCCCCOCC(=O)c1cccnc1 31630ceaaeafd1a8a1e1c94526d69104 [0,2,0,0,0,0|1,0,1]=4 9118 B17R1.754 O=CCCCCOCCC(=O)c1ccccc1 ad09dd146aef76552f2277f5b08fadfa [0,2,0,0,0,0|1,0,1]=4 9119 B17R1.754 O=CCCCCOCNC(=O)c1ccccc1 fa71e7c75fcaf10e36511b43d576e994 [0,2,0,0,0,0|1,0,1]=4 9120 B17R1.754 O=CCCCCOCOC(=O)c1ccccc1 cce0932feab84fd0597e89010cdc9359 [0,2,0,0,0,0|0,0,1]=3 9121 B17R1.754 O=CCCCOCCCC(=O)c1ccccc1 3daa0bd8bcfee4f4051e74d9a946858f [0,2,0,0,0,0|1,0,1]=4 9122 B17R1.754 O=CCCCOCCNC(=O)c1ccccc1 8bcdc82a35ac2e3c886b7755fa9623e4 [0,2,0,0,0,0|1,0,1]=4 9123 B17R1.754 O=CCCCOCCOC(=O)c1ccccc1 61adfe8975db65cba6bcedaceb1f7123 [0,2,0,0,0,0|0,0,1]=3 9124 B17R1.754 O=CCCCOCCOC(=O)c1cccnc1 73ba126077fc294ae69ac89982562174 [0,2,0,0,0,0|1,0,1]=4 9125 B17R1.754 O=CCCOCCCCC(=O)c1ccccc1 3992cee2b72661a41552433207fe204d [0,2,0,0,0,0|1,0,1]=4 9126 B17R1.754 O=CCCOCCCNC(=O)c1ccccc1 9fb82fa90ff410ec581acf958fb64fb7 [0,2,0,0,0,0|1,0,1]=4 9127 B17R1.754 O=CCCOCCCOC(=O)c1ccccc1 9c2e9b7b635ea5a8604daff1a8697aec [0,2,0,0,0,0|0,0,1]=3 9128 B17R1.754 O=CCOCCOCOC(=O)c1ccccc1 6702ad598d764d218a8bb1c44eea11e1 [0,2,0,0,0,0|1,0,1]=4 9129 B17R1.754 O=CNCCOCCOC(=O)c1ccccc1 ba2de97323148eb0ccaabbeabc7b0a46 [0,2,0,0,0,0|1,0,1]=4 9130 B17R1.754 O=COCCOCCOC(=O)c1ccccc1 acf1f931921d62c230485c4359a58441 [0,2,0,0,0,0|1,0,1]=4 9131 B17R1.754 O=S(CCOCCCCCF)c1ccccc1 f26097ca0b3379b6accb99e6382fb4eb [0,2,0,0,0,0|2,0,0]=4 9132 B17R1.754 O=S(COCCCCCCF)c1ccccc1 d634cd4422056ff9a07637a31e50faae [0,2,0,0,0,0|1,0,0]=3 9133 B17R1.956 C/C=C/C(C)OCCOC(=O)c1ccccc1 6c62618bfac3b5915d963a8da807b5fd [0,2,0,0,0,0|0,0,2]=4 9134 B17R1.956 C=C(COCCC(C)CCC)c1ccccc1 1f5361a1477d3090e98e0b2226a0baaf [0,2,0,0,0,0|1,0,0]=3 9135 B17R1.956 C=C(COCCC(S)CCC)c1ccccc1 8c07ed6c8f02fbc13d39669626998ed0 [0,2,0,0,0,0|1,0,0]=3 9136 B17R1.956 C=CCC(C)COCOC(=O)c1ccccc1 34fa8198fd7f928cff37b5064cff02b8 [0,2,0,0,0,0|0,0,2]=4 9137 B17R1.956 C=CCC(C)OCCOC(=O)c1ccccc1 2b1b21a63aac87a832f0bcfcb2b2d0b1 [0,2,0,0,0,0|0,0,2]=4 9138 B17R1.956 C=CCC(O)CNCOC(=O)c1ccccc1 bdd3ae394f5d4c3932731289d9c292d1 [0,2,0,0,0,0|0,0,2]=4 9139 B17R1.956 C=CCN(C)CCCOC(=O)c1ccccc1 4c4454ea9be6f3a1d02a0168b6a026d2 [0,2,0,0,0,0|0,0,2]=4 9140 B17R1.956 C=CC[C@@H](C)OCCOC(=O)c1ccccc1 cf071bb6f4f75e6ebe159c6ffff09f8f [0,2,0,0,0,0|0,0,2]=4 9141 B17R1.956 C=CC[C@H](C)OCCOC(=O)c1ccccc1 923f412766687ac45b684e1635a121c4 [0,2,0,0,0,0|0,0,2]=4 9142 B17R1.956 CC(CC#N)NCCOC(=O)c1ccccc1 6b575fb1839f8cc79bc61a50b143ce06 [0,2,0,0,0,0|1,0,1]=4 9143 B17R1.956 CC(CC#N)OCCOC(=O)c1ccccc1 7e3ee8dad9c3d102f961a1af9931fdd0 [0,2,0,0,0,0|1,0,1]=4 9144 B17R1.956 CC(CCO)CNCOC(=O)c1ccccc1 5b226f9cbb03089f1e4767901e669475 [0,2,0,0,0,0|1,0,0]=3 9145 B17R1.956 CC(CCO)NCCNC(=O)c1ccccc1 f55d8098ae5ca3cb2c779e1f66555031 [0,2,0,0,0,0|2,0,0]=4 9146 B17R1.956 CC(CCO)NCCOC(=O)c1ccccc1 794cf06625cef6b1ad24dbd94b9b2aa9 [0,2,0,0,0,0|1,0,0]=3 9147 B17R1.956 CC=CC(C)OCCOC(=O)c1ccccc1 66d82829fa2a0ca29616e3601de30b5f [0,2,0,0,0,0|0,0,2]=4 9148 B17R1.956 CCCC(=O)COCCC(=O)c1ccccc1 0af5b70f0a13a2e9b55316ccbc62a56e [0,2,0,0,0,0|1,0,1]=4 9149 B17R1.956 CCCC(=O)COCNC(=O)c1ccccc1 6b7a0d821cb21f1b40ba0b66ce6c3859 [0,2,0,0,0,0|1,0,1]=4 9150 B17R1.956 CCCC(=O)OCOCC(=O)c1ccccc1 3c1308b61bac93033ae79824b22e4d56 [0,2,0,0,0,0|1,0,1]=4 9151 B17R1.956 CCCC(=S)OCCNC(=O)c1ccccc1 94b488bcaaf4e12e049c87d62ac43fde [0,2,0,0,0,0|1,0,1]=4 9152 B17R1.956 CCCC(=S)OCCOC(=O)c1ccccc1 c13ca2006557a9827736e24ff8448cde [0,2,0,0,0,0|0,0,1]=3 9153 B17R1.956 CCCC(C)CCOCC(=O)c1ccccc1 ad52b99e1492326f546bb27a04f469fc [0,2,0,0,0,0|0,0,0]=2 9154 B17R1.956 CCCC(C)CCOCC(=O)c1ccccn1 ee47d281209ae40c3abac3df48c0518e [0,2,0,0,0,0|1,0,0]=3 9155 B17R1.956 CCCC(C)CCOCC(=O)c1cccnc1 05a4ee1e7793e3ea5766ea6ca94df02f [0,2,0,0,0,0|1,0,0]=3 9156 B17R1.956 CCCC(C)CCOCC(=O)c1ccncn1 48e96e6747a93492d453c85a971da462 [0,2,0,0,0,0|2,0,0]=4 9157 B17R1.956 CCCC(C)CCOCC(=O)c1cnccn1 ad180e6bc35da2f79c4e657fa05b6edf [0,2,0,0,0,0|2,0,0]=4 9158 B17R1.956 CCCC(C)CCOCC(C)c1ccccc1 958590a53f9ac33e3df0f9be8782b730 [0,2,0,0,0,0|1,0,1]=4 9159 B17R1.956 CCCC(C)CCOCC(F)c1ccccc1 2155d0dd5d47bd00584f32d9ac4ca0b2 [0,2,0,0,0,0|1,0,1]=4 9160 B17R1.956 CCCC(C)CCOC[C@@H](C)c1ccccc1 83c699b32f5f644d10725b10fa0d4d23 [0,2,0,0,0,0|1,0,1]=4 9161 B17R1.956 CCCC(C)COCCC(=O)c1ccccc1 50c3dea795f22a7b6a720e0a906449a9 [0,2,0,0,0,0|1,0,0]=3 9162 B17R1.956 CCCC(C)COCNC(=O)c1ccccc1 6fb5f739ebf357353f86e1d9729eb445 [0,2,0,0,0,0|1,0,0]=3 9163 B17R1.956 CCCC(C)COCNC(=O)c1cccnc1 c5f17c852519f9714233cd3c655634d1 [0,2,0,0,0,0|2,0,0]=4 9164 B17R1.956 CCCC(C)COCOC(=O)c1ccccc1 9072cd12dc9ecfabbf8d47aa8dc40726 [0,2,0,0,0,0|0,0,0]=2 9165 B17R1.956 CCCC(C)NCCNC(=O)c1ccccc1 b56127fb61c9c6e4d5da9454636476fd [0,2,0,0,0,0|1,0,0]=3 9166 B17R1.956 CCCC(C)NCCNC(=O)c1ccccn1 9cde1b814ac3834385fb12711be5570f [0,2,0,0,0,0|2,0,0]=4 9167 B17R1.956 CCCC(C)NCCNC(=O)c1ccncc1 eb6a1c9e97f29dad6b7635a2b04bcc71 [0,2,0,0,0,0|2,0,0]=4 9168 B17R1.956 CCCC(C)NCCOC(=O)c1ccccc1 53529eaca87fcda1de6ee9deac0ed6f6 [0,2,0,0,0,0|0,0,0]=2 9169 B17R1.956 CCCC(C)OCCCC(=O)c1ccccc1 90855bfc91d0638965727b4a1d2ed40e [0,2,0,0,0,0|1,0,0]=3 9170 B17R1.956 CCCC(C)OCCCC(=O)c1cccnc1 d1aee9c747920da827477e04133f9cf8 [0,2,0,0,0,0|2,0,0]=4 9171 B17R1.956 CCCC(C)OCCNC(=O)c1ccccc1 7593992ad2bc259761c21c1ce3ffce8a [0,2,0,0,0,0|1,0,0]=3 9172 B17R1.956 CCCC(C)OCCNC(=O)c1ccccn1 1a0ccbc49d89b34098c58063b0f06133 [0,2,0,0,0,0|2,0,0]=4 9173 B17R1.956 CCCC(C)OCCNC(=O)c1cccnc1 7bac08ce53020f9799b245397775936b [0,2,0,0,0,0|2,0,0]=4 9174 B17R1.956 CCCC(C)OCCNC(=O)c1ccncc1 1b216c251a8d2f15ec2abc0c289e08bb [0,2,0,0,0,0|2,0,0]=4 9175 B17R1.956 CCCC(C)OCCOC(=O)c1ccccc1 06645cbd7c169016594bdbbdb7a3d982 [0,2,0,0,0,0|0,0,0]=2 9176 B17R1.956 CCCC(C)OCCOC(=O)c1cccnc1 6f46affc0949ba6cc61fbbda1e7ef1c5 [0,2,0,0,0,0|1,0,0]=3 9177 B17R1.956 CCCC(O)CNCOC(=O)c1ccccc1 37c0aa21bab999314e58952b32e615cb [0,2,0,0,0,0|0,0,0]=2 9178 B17R1.956 CCCC(S)CCOCC(=O)c1ccccc1 1d266735c700acdee7d7d047574e69d8 [0,2,0,0,0,0|0,0,0]=2 9179 B17R1.956 CCCC(S)CCOCC(=O)c1ccccn1 4fb9dd591ddf42013dd9f95d3764ec9e [0,2,0,0,0,0|1,0,0]=3 9180 B17R1.956 CCCC(S)CCOCC(=O)c1cccnc1 4fc15a47bbc64014b2f4878f482149ea [0,2,0,0,0,0|1,0,0]=3 9181 B17R1.956 CCCC(S)CCOCC(=O)c1ccncn1 ca4ee4543039828a82a1389bf5b36e1e [0,2,0,0,0,0|2,0,0]=4 9182 B17R1.956 CCCC(S)CCOCC(=O)c1cnccn1 73d5680e18c164008e35f2d08c96a338 [0,2,0,0,0,0|2,0,0]=4 9183 B17R1.956 CCCC(S)CCOCC(C)c1ccccc1 214e221a3f66c828bc5331d16aaf88e4 [0,2,0,0,0,0|1,0,1]=4 9184 B17R1.956 CCCC(S)CCOCC(F)c1ccccc1 8523f3220a4fe77d7b7e484b6ffef4c8 [0,2,0,0,0,0|1,0,1]=4 9185 B17R1.956 CCCC(S)CCOC[C@@H](C)c1ccccc1 9be0a8a9170f17f1c71697d60398eb2b [0,2,0,0,0,0|1,0,1]=4 9186 B17R1.956 CCCN(C)CCCNC(=O)c1ccccn1 5b4914398c9633a603cefd81dabf9dd8 [0,2,0,0,0,0|2,0,0]=4 9187 B17R1.956 CCC[C@@H](C)OCCNC(=O)c1ccccn1 deb21dd845dead2e373b849dc446ce97 [0,2,0,0,0,0|2,0,0]=4 9188 B17R1.956 CCC[C@@H](C)OCCOC(=O)c1ccccc1 e68e431d0ece563a92b1fdb8d2b8a08e [0,2,0,0,0,0|0,0,0]=2 9189 B17R1.956 CCC[C@H](C)NCCNC(=O)c1ccccc1 35e2dfa532dd2fd14bb01fc9c059d1f8 [0,2,0,0,0,0|1,0,0]=3 9190 B17R1.956 CCC[C@H](C)NCCNC(=O)c1ccccn1 abc716a6d915f90b0a45f06e2ebd5c57 [0,2,0,0,0,0|2,0,0]=4 9191 B17R1.956 CCC[C@H](C)NCCOC(=O)c1ccccc1 dcff29ab7357a43febf2201bcd77c7d2 [0,2,0,0,0,0|0,0,0]=2 9192 B17R1.956 CCC[C@H](C)OCCNC(=O)c1ccccn1 c706548e8c83e18a6419c0a20433e911 [0,2,0,0,0,0|2,0,0]=4 9193 B17R1.956 CCC[C@H](C)OCCOC(=O)c1ccccc1 632a5f034ad9af8d424b1452932234fa [0,2,0,0,0,0|0,0,0]=2 9194 B17R1.956 CCNC(=O)CCOCC(=O)c1ccccc1 39469d05696d29f56d92a363c6071465 [0,2,0,0,0,0|1,0,1]=4 9195 B17R1.956 CCNC(=O)CNCOC(=O)c1ccccc1 20c11e7068b276077f19d4aa54263ba0 [0,2,0,0,0,0|1,0,1]=4 9196 B17R1.956 CCNC(=O)COCOC(=O)c1ccccc1 0850179732e8f4d4c941333d7eae4471 [0,2,0,0,0,0|1,0,1]=4 9197 B17R1.956 CCOC(=O)CCCNC(=O)c1ccccc1 628370f52521c2bef53797088e1d5be1 [0,2,0,0,0,0|1,0,1]=4 9198 B17R1.956 CCOC(=O)CCOCC(=O)c1ccccc1 b13c74f9b82fbd74373ce7d698880a3e [0,2,0,0,0,0|1,0,1]=4 9199 B17R1.956 CCOC(=O)CNCOC(=O)c1ccccc1 7cf73343633212dc2509838f0ec19fc8 [0,2,0,0,0,0|1,0,1]=4 9200 B17R1.956 CCOC(=O)COCOC(=O)c1ccccc1 448045b007ea7b05706c893e1d141310 [0,2,0,0,0,0|1,0,1]=4 9201 B17R1.956 CCOC(C)CNCOC(=O)c1ccccc1 a75dac8e8aa074d47735a32b6233935d [0,2,0,0,0,0|1,0,0]=3 9202 B17R1.956 CCOC(C)COCOC(=O)c1ccccc1 f1f3c2d81d6a7e724f4ba9f2c50737f1 [0,2,0,0,0,0|1,0,0]=3 9203 B17R1.956 CN(CC#N)CCCOC(=O)c1ccccc1 055522163dbd051ed0aa6cfa320c13cc [0,2,0,0,0,0|1,0,1]=4 9204 B17R1.956 CN(CCO)CCCNC(=O)c1ccccc1 db28e947ccda3527a41cccc2b61bb769 [0,2,0,0,0,0|2,0,0]=4 9205 B17R1.956 COCC(C)COCOC(=O)c1ccccc1 e3e30925606b6f97f70efdfede12ec89 [0,2,0,0,0,0|1,0,0]=3 9206 B17R1.956 COCC(C)NCCNC(=O)c1ccccc1 1dd30b5d0d4f6f39d4a9b416bc2e1419 [0,2,0,0,0,0|2,0,0]=4 9207 B17R1.956 COCC(C)NCCOC(=O)c1ccccc1 2f8848128d873b39551eeb0d1c511e3e [0,2,0,0,0,0|1,0,0]=3 9208 B17R1.956 COCC(C)OCCCC(=O)c1ccccc1 c6e70a533d24554c6364de3413235ed0 [0,2,0,0,0,0|2,0,0]=4 9209 B17R1.956 COCC(C)OCCNC(=O)c1ccccc1 0d7806bb82279001ee9c589aedbb48b1 [0,2,0,0,0,0|2,0,0]=4 9210 B17R1.956 COCC(C)OCCOC(=O)c1ccccc1 6f616fa78fb03c9fadec6b9f2410d0af [0,2,0,0,0,0|1,0,0]=3 9211 B17R1.956 COCC(C)OCCOC(=O)c1cccnc1 4c3648bef1d801ed7c6f4f3eefc4083e [0,2,0,0,0,0|2,0,0]=4 9212 B17R1.956 COCC(O)CNCOC(=O)c1ccccc1 f7ff92c5f1711b323a8700cd7269c69a [0,2,0,0,0,0|1,0,0]=3 9213 B17R1.956 COC[C@@H](C)NCCNC(=O)c1ccccc1 4d7630140ee550bf046eb1d911da37ec [0,2,0,0,0,0|2,0,0]=4 9214 B17R1.956 COC[C@@H](C)NCCOC(=O)c1ccccc1 abc7ec0f29ff2201cb5023d2ce6a273f [0,2,0,0,0,0|1,0,0]=3 9215 B17R1.956 COC[C@@H](C)OCCOC(=O)c1ccccc1 fcae7b9a023f435f08f1640bf9f8b880 [0,2,0,0,0,0|1,0,0]=3 9216 B17R1.956 COC[C@@H](O)CNCOC(=O)c1ccccc1 bdae3ada010658a9c49a92db5239e03c [0,2,0,0,0,0|1,0,0]=3 9217 B17R1.956 COC[C@H](C)COCOC(=O)c1ccccc1 5699ffa333d7ed21ac2ba1fd15fc38d7 [0,2,0,0,0,0|1,0,0]=3 9218 B17R1.956 COC[C@H](C)NCCNC(=O)c1ccccc1 cd1f4b52212a80f13b467ddf13c2252b [0,2,0,0,0,0|2,0,0]=4 9219 B17R1.956 COC[C@H](C)NCCOC(=O)c1ccccc1 d7f4eb335a27f25d0c1f85f8692409e4 [0,2,0,0,0,0|1,0,0]=3 9220 B17R1.956 COC[C@H](C)OCCOC(=O)c1ccccc1 74d6826f0fd607d29b6943ed2eea877e [0,2,0,0,0,0|1,0,0]=3 9221 B17R1.956 CSCC(C)OCCNC(=O)c1ccccc1 1aae216cad89821a10e3e4f0aa039082 [0,2,0,0,0,0|2,0,0]=4 9222 B17R1.956 CSCC(C)OCCOC(=O)c1ccccc1 68929f65748432097081827aca578d62 [0,2,0,0,0,0|1,0,0]=3 9223 B17R1.956 C[C@@H](CCO)NCCNC(=O)c1ccccc1 1d3abd354f6b059cd58bb2b8c2c1265d [0,2,0,0,0,0|2,0,0]=4 9224 B17R1.956 C[C@@H](CCO)NCCOC(=O)c1ccccc1 6909acdba8738cf5f95c87f41506bee1 [0,2,0,0,0,0|1,0,0]=3 9225 B17R1.956 C[C@H](CCO)NCCNC(=O)c1ccccc1 f46ae11455394a41b7cabd21d5818361 [0,2,0,0,0,0|2,0,0]=4 9226 B17R1.956 C[C@H](CCO)NCCOC(=O)c1ccccc1 a3692fc9df9257e82b0d2608be5e8a33 [0,2,0,0,0,0|1,0,0]=3 9227 B17R1.956 O=C(CCOC[C@@H](O)CCO)c1ccccc1 cd64edc13ceb0eb26583bed12239e7fd [0,2,0,0,0,0|2,0,0]=4 9228 B17R1.956 O=C(NCOC[C@@H](O)CCO)c1ccccc1 fcdbb831b99cf4a14669748852958395 [0,2,0,0,0,0|2,0,0]=4 9229 B17R1.1224 C#CC(C)NCCCCC(=O)c1ccccc1 ed70fb8896e0a3ede0d67d798cc46725 [0,2,0,0,0,0|2,0,0]=4 9230 B17R1.1224 C#CC(C)NCCCOC(=O)c1ccccc1 8e119b9c7e70961736f07c0e0ae99c2a [0,2,0,0,0,0|1,0,0]=3 9231 B17R1.1224 C#CC(C)OCCCNC(=O)c1ccccc1 33fba56bf39719de1ce9e8cfd5cdda75 [0,2,0,0,0,0|2,0,0]=4 9232 B17R1.1224 C#C[C@@H](C)NCCCCC(=O)c1ccccc1 e528adb4bc4cb10a83f05bbfe62e992f [0,2,0,0,0,0|2,0,0]=4 9233 B17R1.1224 C#C[C@@H](C)NCCCOC(=O)c1ccccc1 07b12362b840a5ae7ec065899da5eb81 [0,2,0,0,0,0|1,0,0]=3 9234 B17R1.1224 C#C[C@H](C)NCCCCC(=O)c1ccccc1 f909004d8a5cd6cf814d4a0cfb861f8f [0,2,0,0,0,0|2,0,0]=4 9235 B17R1.1224 C#C[C@H](C)NCCCOC(=O)c1ccccc1 8667d082479a43c34f8c90957eb4037e [0,2,0,0,0,0|1,0,0]=3 9236 B17R1.1224 C/C(=C\I)/COCCOC(=O)c1ccccc1 4527f3955bbb71bfe9ccd7f27b45b30c [0,2,0,0,0,0|1,0,1]=4 9237 B17R1.1224 C=C(CC)COCCCC(=O)c1ccccc1 3a6e059225fbe1ce471af7830ec08094 [0,2,0,0,0,0|1,0,1]=4 9238 B17R1.1224 C=C(CC)COCCNC(=O)c1ccccc1 7c1d7f27f433d53b7f0098a414e08f6e [0,2,0,0,0,0|1,0,1]=4 9239 B17R1.1224 C=C(CC)COCCOC(=O)c1ccccc1 7b645c1039510830bcb48526d9efb8e0 [0,2,0,0,0,0|0,0,1]=3 9240 B17R1.1224 C=C(CC)COCCOC(=O)c1cccnc1 d93d5a8c1e94e8323ed94321eed53671 [0,2,0,0,0,0|1,0,1]=4 9241 B17R1.1224 C=C(COCCCC(C)CC)c1ccccc1 ded0ee0365bf22e489c03a94672baf42 [0,2,0,0,0,0|1,0,0]=3 9242 B17R1.1224 C=C(COCCCN(C)CC)c1ccccc1 4429a0bbe92a2784856a268601baa37b [0,2,0,0,0,0|2,0,0]=4 9243 B17R1.1224 C=C(COCCC[C@@H](C)CC)c1ccccc1 73d619786146e8338eb029c69ade8655 [0,2,0,0,0,0|1,0,0]=3 9244 B17R1.1224 C=C(COCCOC(=O)c1ccccc1)OC 29a242007931f43bbf4b930afd8a24c1 [0,2,0,0,0,0|1,0,1]=4 9245 B17R1.1224 C=CC(C)COCCCC(=O)c1ccccc1 f73b7bfef0982626c4f9e4ebb19f6853 [0,2,0,0,0,0|2,0,0]=4 9246 B17R1.1224 C=CC(C)COCCNC(=O)c1ccccc1 23a3540f8e134017b26f64cb5285b08c [0,2,0,0,0,0|2,0,0]=4 9247 B17R1.1224 C=CC(C)COCCOC(=O)c1ccccc1 20e867fc058471951b9077e0c64b8318 [0,2,0,0,0,0|1,0,0]=3 9248 B17R1.1224 C=CC(C)NCCCCC(=O)c1ccccc1 1f29a42f402bb36eaaed22a52f3b11b6 [0,2,0,0,0,0|2,0,0]=4 9249 B17R1.1224 C=CC(C)NCCCOC(=O)c1ccccc1 ddb48b337367cfc667952f9ad55ebb10 [0,2,0,0,0,0|1,0,0]=3 9250 B17R1.1224 C=CC(C)OCCCNC(=O)c1ccccc1 41ea5e953cf8453ce2b2445ae0b31733 [0,2,0,0,0,0|2,0,0]=4 9251 B17R1.1224 C=CC(C)OCCCOC(=O)c1ccccc1 80bc579d8ec9a7ff292c2bf657b7b96b [0,2,0,0,0,0|1,0,0]=3 9252 B17R1.1224 C=CC(O)CNCCOC(=O)c1ccccc1 a7482fcf6a5773ae4b9003014f58f12e [0,2,0,0,0,0|0,0,2]=4 9253 B17R1.1224 C=C[C@H](C)OCCCOC(=O)c1ccccc1 18d52984b773797bc66b93c92b395ef9 [0,2,0,0,0,0|1,0,0]=3 9254 B17R1.1224 CC(=CI)COCCOC(=O)c1ccccc1 7070559b5f6af109aa47288e089cf521 [0,2,0,0,0,0|1,0,1]=4 9255 B17R1.1224 CC(C#N)CNCCNC(=O)c1ccccc1 f145c945c1f2185c5746afe237c891ce [0,2,0,0,0,0|2,0,0]=4 9256 B17R1.1224 CC(C#N)CNCCOC(=O)c1ccccc1 8289e60bb86a499d7d267578cb03a57a [0,2,0,0,0,0|1,0,0]=3 9257 B17R1.1224 CC(C#N)COCCCC(=O)c1ccccc1 b5cc413e3f19a486dd3021b4617d4948 [0,2,0,0,0,0|2,0,0]=4 9258 B17R1.1224 CC(C#N)COCCNC(=O)c1ccccc1 d9cb45bc2aa2d0d9dedf3b521996a513 [0,2,0,0,0,0|2,0,0]=4 9259 B17R1.1224 CC(C#N)COCCOC(=O)c1ccccc1 c4ab63f8d67db75ce9fc66dd74ed2591 [0,2,0,0,0,0|1,0,0]=3 9260 B17R1.1224 CC(C#N)COCCOC(=O)c1cccnc1 12918bd42d6747228cd87603eac8e893 [0,2,0,0,0,0|2,0,0]=4 9261 B17R1.1224 CC(C#N)NCCCOC(=O)c1ccccc1 da6d4032cd672b2e0eeb47cdc319835a [0,2,0,0,0,0|1,0,0]=3 9262 B17R1.1224 CC(C#N)OCCCNC(=O)c1ccccc1 c1225c0320069d9d13b331aa4b6c3c2c [0,2,0,0,0,0|2,0,0]=4 9263 B17R1.1224 CC(C=O)OCCCNC(=O)c1ccccc1 ef84487dd989c914dc6b6b3f0cccbcda [0,2,0,0,0,0|2,0,0]=4 9264 B17R1.1224 CC(C=O)OCCCOC(=O)c1ccccc1 27f967f96716cbce7c59f39969e922d6 [0,2,0,0,0,0|1,0,0]=3 9265 B17R1.1224 CC(CO)CCCNCC(=O)c1ccccc1 78709c97a46125665029b756f3122b17 [0,2,0,0,0,0|2,0,0]=4 9266 B17R1.1224 CC(CO)CCNCOC(=O)c1ccccc1 1cdfd295f26d7c9b2ac13b5ec89d02b1 [0,2,0,0,0,0|1,0,0]=3 9267 B17R1.1224 CC(CO)CNCCNC(=O)c1ccccc1 10ac9e6b720babc856206967e6576f84 [0,2,0,0,0,0|2,0,0]=4 9268 B17R1.1224 CC(CO)CNCCOC(=O)c1ccccc1 b5304dd38dcca01a2c5b50c1f3fa1ef1 [0,2,0,0,0,0|1,0,0]=3 9269 B17R1.1224 CC(CO)NCCCOC(=O)c1ccccc1 256db657ba218b31351a83980aee9ec4 [0,2,0,0,0,0|1,0,0]=3 9270 B17R1.1224 CCC(=O)COCCCC(=O)c1ccccc1 685b32140f22d8a31be6db8fd9307c87 [0,2,0,0,0,0|1,0,1]=4 9271 B17R1.1224 CCC(=O)COCCNC(=O)c1ccccc1 c2eb892b8537d2f12d1a7ecf17c32c23 [0,2,0,0,0,0|1,0,1]=4 9272 B17R1.1224 CCC(=O)COCCOC(=O)c1ccccc1 8fc3aae1f7f483a1c285392b94726713 [0,2,0,0,0,0|0,0,1]=3 9273 B17R1.1224 CCC(=O)COCCOC(=O)c1cccnc1 4418eafd8f833f9da1c2dd0c96747b17 [0,2,0,0,0,0|1,0,1]=4 9274 B17R1.1224 CCC(=O)NCCOCC(=O)c1ccccc1 b81953931eeee78776c1e147a37e33d5 [0,2,0,0,0,0|1,0,1]=4 9275 B17R1.1224 CCC(=O)OCCOCC(=O)c1ccccc1 339ef2796e6f4479d2459e94ddddc1ef [0,2,0,0,0,0|1,0,1]=4 9276 B17R1.1224 CCC(C)CCCOCC(=O)c1ccccc1 e9b17314b5a4970371baa379a5430e7e [0,2,0,0,0,0|0,0,0]=2 9277 B17R1.1224 CCC(C)CCCOCC(=O)c1ccccn1 452295e6b3ba33ffcb5cd96b2ad80a8f [0,2,0,0,0,0|1,0,0]=3 9278 B17R1.1224 CCC(C)CCCOCC(=O)c1cccnc1 f9934b9bdc4906f8fd2fe200009ba732 [0,2,0,0,0,0|1,0,0]=3 9279 B17R1.1224 CCC(C)CCCOCC(=O)c1ccncn1 63a54362cc649c9c5f2e73e895903938 [0,2,0,0,0,0|2,0,0]=4 9280 B17R1.1224 CCC(C)CCCOCC(=O)c1cnccn1 457485a8b2ab7f3cf6992e5829e2ccaa [0,2,0,0,0,0|2,0,0]=4 9281 B17R1.1224 CCC(C)CCCOCC(C)c1ccccc1 0d8ba2eae0da51b45f0c65d049ba9c30 [0,2,0,0,0,0|1,0,1]=4 9282 B17R1.1224 CCC(C)CCCOCC(F)c1ccccc1 93161c1cac4733a41afdf69f6a688b23 [0,2,0,0,0,0|1,0,1]=4 9283 B17R1.1224 CCC(C)CCCOC[C@@H](C)c1ccccc1 d3a7bc07cb19d1105b841e56e3813fe0 [0,2,0,0,0,0|1,0,1]=4 9284 B17R1.1224 CCC(C)CCNCOC(=O)c1ccccc1 d0e344842fcd7dd0f0557720af4e80c9 [0,2,0,0,0,0|0,0,0]=2 9285 B17R1.1224 CCC(C)CCOCCC(=O)c1ccccc1 e6c7c082b2da6341459d82d8952b372a [0,2,0,0,0,0|1,0,0]=3 9286 B17R1.1224 CCC(C)CCOCCS(=O)c1ccccc1 e33ddd4f2f9d3853b1fd9ba1b084035c [0,2,0,0,0,0|2,0,0]=4 9287 B17R1.1224 CCC(C)CCOCNC(=O)c1ccccc1 92b67cb9c9ce4a0b474a342caa1cac91 [0,2,0,0,0,0|1,0,0]=3 9288 B17R1.1224 CCC(C)CCOCNC(=O)c1cccnc1 3b011bfd7427732f5079051270a0e54b [0,2,0,0,0,0|2,0,0]=4 9289 B17R1.1224 CCC(C)CCOCOC(=O)c1ccccc1 70af6d227888b7884daa979095869398 [0,2,0,0,0,0|0,0,0]=2 9290 B17R1.1224 CCC(C)CNCCNC(=O)c1ccccn1 bbf62c83faa3518ffc74e80db1e326c1 [0,2,0,0,0,0|2,0,0]=4 9291 B17R1.1224 CCC(C)CNCCNC(=O)c1ccncc1 0a1b949bd6815d390f6ff453d4f4a65b [0,2,0,0,0,0|2,0,0]=4 9292 B17R1.1224 CCC(C)CNCCOC(=O)c1ccccc1 b53311c0aa47cd857232faec3080a72e [0,2,0,0,0,0|0,0,0]=2 9293 B17R1.1224 CCC(C)COCCCC(=O)c1ccccc1 efeebd6581ff70248f975dc4dcee2a35 [0,2,0,0,0,0|1,0,0]=3 9294 B17R1.1224 CCC(C)COCCCC(=O)c1cccnc1 8240003b1387f1806d41f5cfa9f99be2 [0,2,0,0,0,0|2,0,0]=4 9295 B17R1.1224 CCC(C)COCCNC(=O)c1ccccc1 d5705c1a2ec42b4b90ad545c77c2aa2e [0,2,0,0,0,0|1,0,0]=3 9296 B17R1.1224 CCC(C)COCCNC(=O)c1ccccn1 5adc3e0167492e8e39a743881ff4abaf [0,2,0,0,0,0|2,0,0]=4 9297 B17R1.1224 CCC(C)COCCNC(=O)c1cccnc1 6f8a84b8e59654b945fb0474f889cb4a [0,2,0,0,0,0|2,0,0]=4 9298 B17R1.1224 CCC(C)COCCNC(=O)c1ccncc1 08ccbb6a21191192ea900becfa581381 [0,2,0,0,0,0|2,0,0]=4 9299 B17R1.1224 CCC(C)COCCOC(=O)c1ccccc1 04ee1a597482e67c87ff548f6bff068c [0,2,0,0,0,0|0,0,0]=2 9300 B17R1.1224 CCC(C)COCCOC(=O)c1cccnc1 733a527cfade35b6adaf4d2663d85727 [0,2,0,0,0,0|1,0,0]=3 9301 B17R1.1224 CCC(C)OCCCNC(=O)c1ccccc1 2eda12475c68a43dae6881721b53356b [0,2,0,0,0,0|1,0,0]=3 9302 B17R1.1224 CCC(O)CNCCNC(=O)c1ccccc1 78cfbb614e837127dd9e760c4c0fbf4a [0,2,0,0,0,0|1,0,0]=3 9303 B17R1.1224 CCC(O)CNCCNC(=O)c1ccccn1 c0b126fbc2cffee91abb417656516319 [0,2,0,0,0,0|2,0,0]=4 9304 B17R1.1224 CCC(O)CNCCNC(=O)c1ccncc1 5056a3c9be594947da08347baa772082 [0,2,0,0,0,0|2,0,0]=4 9305 B17R1.1224 CCC(O)CNCCOC(=O)c1ccccc1 02a3a8e38141b79607c54141d7686758 [0,2,0,0,0,0|0,0,0]=2 9306 B17R1.1224 CCC(S)CCOCOC(=O)c1ccccc1 5e4f9052c36565ea277c774fd57d68c1 [0,2,0,0,0,0|0,0,0]=2 9307 B17R1.1224 CCN(C)CCCCOC(=O)c1ccccc1 499b2b7e9512e8d0785e43b74ac8b80f [0,2,0,0,0,0|0,0,0]=2 9308 B17R1.1224 CCN(C)CCCNCC(=O)c1ccccc1 6d2a69167787406848b689123c0b9b9f [0,2,0,0,0,0|2,0,0]=4 9309 B17R1.1224 CCN(C)CCCOCC(=O)c1ccccc1 df507d5467909f5d46341ee20cb0568f [0,2,0,0,0,0|1,0,0]=3 9310 B17R1.1224 CCN(C)CCCOCC(=O)c1ccccn1 9ccaf26eec7cab5b7dd58dc1e54ac695 [0,2,0,0,0,0|2,0,0]=4 9311 B17R1.1224 CCN(C)CCCOCC(=O)c1cccnc1 1997c5ba2f437c7c82dd2993d1c0a90c [0,2,0,0,0,0|2,0,0]=4 9312 B17R1.1224 CCS(=O)CCOCCC(=O)c1ccccc1 82c050410b025c4f9231f97af9e29358 [0,2,0,0,0,0|2,0,0]=4 9313 B17R1.1224 CCS(=O)CCOCNC(=O)c1ccccc1 9959cf580b3f989986e24cf451328112 [0,2,0,0,0,0|2,0,0]=4 9314 B17R1.1224 CC[C@@H](C)CNCCNC(=O)c1ccncc1 adfd3aa256664dcc08c33dc5192a51cb [0,2,0,0,0,0|2,0,0]=4 9315 B17R1.1224 CC[C@@H](C)COCCCC(=O)c1ccccc1 309a2ce47c2edbbb04099e532f3cd4d8 [0,2,0,0,0,0|1,0,0]=3 9316 B17R1.1224 CC[C@@H](C)COCCCC(=O)c1cccnc1 35bae794f03a75598e54e2dbb669ff9f [0,2,0,0,0,0|2,0,0]=4 9317 B17R1.1224 CC[C@@H](C)COCCNC(=O)c1ccccc1 a5c304ede7d7bdf74fed69ca06452c91 [0,2,0,0,0,0|1,0,0]=3 9318 B17R1.1224 CC[C@@H](C)COCCNC(=O)c1ccccn1 02fd8628ed0ba336802832e95833e43b [0,2,0,0,0,0|2,0,0]=4 9319 B17R1.1224 CC[C@@H](C)COCCNC(=O)c1cccnc1 4253a61621991265f700cf121a759f63 [0,2,0,0,0,0|2,0,0]=4 9320 B17R1.1224 CC[C@@H](C)COCCNC(=O)c1ccncc1 203c63d8c780e4c35584976a9bc73187 [0,2,0,0,0,0|2,0,0]=4 9321 B17R1.1224 CC[C@@H](C)COCCOC(=O)c1ccccc1 2ca22fdb804dd38f09fac8cce237e8f0 [0,2,0,0,0,0|0,0,0]=2 9322 B17R1.1224 CC[C@@H](C)COCCOC(=O)c1cccnc1 a0925cc85039557861e1205eceb7f869 [0,2,0,0,0,0|1,0,0]=3 9323 B17R1.1224 CC[C@@H](O)CNCCNC(=O)c1ccccc1 62c7a9ac28d24db073782860d3cf4d46 [0,2,0,0,0,0|1,0,0]=3 9324 B17R1.1224 CC[C@@H](O)CNCCNC(=O)c1ccccn1 c2133a76c6c1c79cf2300d85c2da71d0 [0,2,0,0,0,0|2,0,0]=4 9325 B17R1.1224 CC[C@@H](O)CNCCOC(=O)c1ccccc1 bdee41a62e592d8eb5ab1f10fdaa8456 [0,2,0,0,0,0|0,0,0]=2 9326 B17R1.1224 CC[C@H](C)CCCOCC(=O)c1ccccc1 e3844aa0770618a78ee98b1d49540f47 [0,2,0,0,0,0|0,0,0]=2 9327 B17R1.1224 CC[C@H](C)CCCOCC(=O)c1ccccn1 a9f4309c4815d477d709b1b382bbfe22 [0,2,0,0,0,0|1,0,0]=3 9328 B17R1.1224 CC[C@H](C)CCCOCC(=O)c1cccnc1 3131a6daed4ed437f6cef7eabfe45df6 [0,2,0,0,0,0|1,0,0]=3 9329 B17R1.1224 CC[C@H](C)CCCOCC(=O)c1ccncn1 ff5fb0cf81c8b0e824c990d536f85467 [0,2,0,0,0,0|2,0,0]=4 9330 B17R1.1224 CC[C@H](C)CCCOCC(=O)c1cnccn1 0e8b09b9c68c64d7d383ece8f6ae82f1 [0,2,0,0,0,0|2,0,0]=4 9331 B17R1.1224 CC[C@H](C)CCCOCC(C)c1ccccc1 8c689571ca2dda916ef4db3fa2fbdb8e [0,2,0,0,0,0|1,0,1]=4 9332 B17R1.1224 CC[C@H](C)CCCOCC(F)c1ccccc1 2987f7543cf04dd314cd1f0f5d575271 [0,2,0,0,0,0|1,0,1]=4 9333 B17R1.1224 CC[C@H](C)CCCOC[C@@H](C)c1ccccc1 badd8eef5ae70472d0b1965272e007ac [0,2,0,0,0,0|1,0,1]=4 9334 B17R1.1224 CC[C@H](C)CCOCOC(=O)c1ccccc1 22c04c46d9ea21cf48c134f0982aa424 [0,2,0,0,0,0|0,0,0]=2 9335 B17R1.1224 CC[C@H](C)CNCCNC(=O)c1ccccn1 29d730707b8431f1accdf43bbcd56794 [0,2,0,0,0,0|2,0,0]=4 9336 B17R1.1224 CC[C@H](C)CNCCNC(=O)c1ccncc1 95793b591252dc4458768615daeaadb5 [0,2,0,0,0,0|2,0,0]=4 9337 B17R1.1224 CC[C@H](C)CNCCOC(=O)c1ccccc1 18757a82d4cdc8dfdfd56f89af6896c2 [0,2,0,0,0,0|0,0,0]=2 9338 B17R1.1224 CC[C@H](C)COCCCC(=O)c1ccccc1 205209826fdf6578f9d18c6f319d2bee [0,2,0,0,0,0|1,0,0]=3 9339 B17R1.1224 CC[C@H](C)COCCCC(=O)c1cccnc1 24523b4f65dfe2cc55d2f14d976ce52c [0,2,0,0,0,0|2,0,0]=4 9340 B17R1.1224 CC[C@H](C)COCCNC(=O)c1ccccc1 1548f3ac7af8ce6807cbcd4adf7e2a73 [0,2,0,0,0,0|1,0,0]=3 9341 B17R1.1224 CC[C@H](C)COCCNC(=O)c1ccccn1 25b62798a554909643c7b6dcbe107672 [0,2,0,0,0,0|2,0,0]=4 9342 B17R1.1224 CC[C@H](C)COCCNC(=O)c1cccnc1 04bc420ec604e8147d564a3ae5145257 [0,2,0,0,0,0|2,0,0]=4 9343 B17R1.1224 CC[C@H](C)COCCNC(=O)c1ccncc1 7e75a4cb749c9ba7a7f3b35a3296fa42 [0,2,0,0,0,0|2,0,0]=4 9344 B17R1.1224 CC[C@H](C)COCCOC(=O)c1ccccc1 aef7fd74c0a6e81b0c1522d867b63b4f [0,2,0,0,0,0|0,0,0]=2 9345 B17R1.1224 CC[C@H](C)COCCOC(=O)c1cccnc1 8a96ab33bb34ef7d6a306f4bdfd4fc36 [0,2,0,0,0,0|1,0,0]=3 9346 B17R1.1224 CN(C#N)CCOCOC(=O)c1ccccc1 237e2a3760f594990d05d3068e00723b [0,2,0,0,0,0|2,0,0]=4 9347 B17R1.1224 CN(C=O)CCOCOC(=O)c1ccccc1 d58c10c4e7284df1805b47983e74ae76 [0,2,0,0,0,0|2,0,0]=4 9348 B17R1.1224 CNC(=O)CCCOCC(=O)c1ccccc1 f728ad77490ef8230ba788b3cf5cb62b [0,2,0,0,0,0|1,0,1]=4 9349 B17R1.1224 CNC(=O)CCNCOC(=O)c1ccccc1 46ceff4788698bf33063519513b25310 [0,2,0,0,0,0|1,0,1]=4 9350 B17R1.1224 CNC(=O)CCOCOC(=O)c1ccccc1 5f976f401d05af784afe25fc5bebb7da [0,2,0,0,0,0|1,0,1]=4 9351 B17R1.1224 CNC(=O)CNCCOC(=O)c1ccccc1 58f94a59e7576c3e5f59a2022095daec [0,2,0,0,0,0|1,0,1]=4 9352 B17R1.1224 CNC(=O)COCCOC(=O)c1ccccc1 279922cb97ac2a5e4a94ef764294823b [0,2,0,0,0,0|1,0,1]=4 9353 B17R1.1224 COC(=O)CCCCNC(=O)c1ccccc1 bfeb29273447b0bc5fadb33cd0129389 [0,2,0,0,0,0|1,0,1]=4 9354 B17R1.1224 COC(=O)CCCOCC(=O)c1ccccc1 16152e717c1e01a6ebc9a9a670896d4c [0,2,0,0,0,0|1,0,1]=4 9355 B17R1.1224 COC(=O)CCNCOC(=O)c1ccccc1 5312e54909478f0bb7a44a019ff8533c [0,2,0,0,0,0|1,0,1]=4 9356 B17R1.1224 COC(=O)CCOCOC(=O)c1ccccc1 58891e5c1db12fc382c6555161d38056 [0,2,0,0,0,0|1,0,1]=4 9357 B17R1.1224 COC(=O)CNCCOC(=O)c1ccccc1 6e7b11721857a22b52717478cb5866dc [0,2,0,0,0,0|1,0,1]=4 9358 B17R1.1224 COC(=O)COCCOC(=O)c1ccccc1 53fa1d1a1123988901874b4ca977ccbc [0,2,0,0,0,0|1,0,1]=4 9359 B17R1.1224 COC(C)CCOCOC(=O)c1ccccc1 9504049855d493d115d93e80af5eaf5b [0,2,0,0,0,0|1,0,0]=3 9360 B17R1.1224 COC(C)COCCCC(=O)c1ccccc1 fee2e66225b7bce9557ac10ab884810c [0,2,0,0,0,0|2,0,0]=4 9361 B17R1.1224 COC(C)COCCNC(=O)c1ccccc1 957f572072f3d73c13fe26e634710282 [0,2,0,0,0,0|2,0,0]=4 9362 B17R1.1224 COC(C)COCCOC(=O)c1ccccc1 8fd21e55802a0443c0e59676a76a63e8 [0,2,0,0,0,0|1,0,0]=3 9363 B17R1.1224 COC(C)COCCOC(=O)c1cccnc1 e7dd16f363f37208e81db8d812003a96 [0,2,0,0,0,0|2,0,0]=4 9364 B17R1.1224 CO[C@@H](C)CNCCOC(=O)c1ccccc1 73d37673bf5beed1bfedcf8dacff995c [0,2,0,0,0,0|1,0,0]=3 9365 B17R1.1224 CO[C@@H](C)COCCCC(=O)c1ccccc1 0d548ab2f55c0cf689b891a7eebc9e73 [0,2,0,0,0,0|2,0,0]=4 9366 B17R1.1224 CO[C@@H](C)COCCNC(=O)c1ccccc1 c397ead7242cbbc915eb572194edbfd9 [0,2,0,0,0,0|2,0,0]=4 9367 B17R1.1224 CO[C@@H](C)COCCOC(=O)c1ccccc1 bf0d260707b2dad7e66a8d0dd20c21ec [0,2,0,0,0,0|1,0,0]=3 9368 B17R1.1224 CO[C@@H](C)COCCOC(=O)c1cccnc1 bed4eb06bf1a76808fa3aad5964144d2 [0,2,0,0,0,0|2,0,0]=4 9369 B17R1.1224 CO[C@H](C)CNCCOC(=O)c1ccccc1 1f0fbcabfcbb325f908d32912296a007 [0,2,0,0,0,0|1,0,0]=3 9370 B17R1.1224 CO[C@H](C)COCCCC(=O)c1ccccc1 6d0fe216b0959b41353b91b9092a5332 [0,2,0,0,0,0|2,0,0]=4 9371 B17R1.1224 CO[C@H](C)COCCNC(=O)c1ccccc1 b36096c3319d0302b93e1493f2f62d54 [0,2,0,0,0,0|2,0,0]=4 9372 B17R1.1224 CO[C@H](C)COCCOC(=O)c1ccccc1 ab6e3bb3df86253328790e867737979f [0,2,0,0,0,0|1,0,0]=3 9373 B17R1.1224 CO[C@H](C)COCCOC(=O)c1cccnc1 8ba7c395d9dbb46232e78d9989dcf0ec [0,2,0,0,0,0|2,0,0]=4 9374 B17R1.1224 C[C@@H](CO)CCNCOC(=O)c1ccccc1 f43e4fc64cee2e033401c733dac3f508 [0,2,0,0,0,0|1,0,0]=3 9375 B17R1.1224 C[C@@H](CO)NCCCOC(=O)c1ccccc1 866f7f1ebfe8b7cf8ed354b12b2ad083 [0,2,0,0,0,0|1,0,0]=3 9376 B17R1.1224 C[C@H](C=O)OCCCNC(=O)c1ccccc1 d3e5775f9f2c3bdd3e080ae3b8755b09 [0,2,0,0,0,0|2,0,0]=4 9377 B17R1.1224 C[C@H](CO)CNCCNC(=O)c1ccccc1 7228c639ba73f78ee4b1eaf8c3f28fd5 [0,2,0,0,0,0|2,0,0]=4 9378 B17R1.1224 C[C@H](CO)CNCCOC(=O)c1ccccc1 b4efc91c029bc5715b6832ba97acf949 [0,2,0,0,0,0|1,0,0]=3 9379 B17R1.1224 C[C@H](CO)NCCCOC(=O)c1ccccc1 aeb92fed13f9c0f447dd39c50b68eec5 [0,2,0,0,0,0|1,0,0]=3 9380 B17R1.1224 O=C(CCCNCC(F)CO)c1ccccc1 6497dd8e67e16aec16ed821a1c182f5a [0,2,0,0,0,0|2,0,0]=4 9381 B17R1.1224 O=C(CCCNC[C@@H](F)CO)c1ccccc1 0857d0c3a065c6d81c3b91bb1cf11a74 [0,2,0,0,0,0|2,0,0]=4 9382 B17R1.1224 O=C(CCCNC[C@H](F)CO)c1ccccc1 bf763871d6e6b8eef7769703d757e7e3 [0,2,0,0,0,0|2,0,0]=4 9383 B17R1.1224 O=C(CCCOCC(O)CO)c1ccccc1 c3f0b1d7d60c0bcd56a9c22cf77353c0 [0,2,0,0,0,0|2,0,0]=4 9384 B17R1.1224 O=C(CCCOC[C@@H](O)CO)c1ccccc1 9947458f0ea124a2a1e2a0c629bebb1e [0,2,0,0,0,0|2,0,0]=4 9385 B17R1.1224 O=C(CCCOC[C@H](O)CO)c1ccccc1 a693cb7ed2784c0236deeee01b5c8549 [0,2,0,0,0,0|2,0,0]=4 9386 B17R1.1224 O=C(NCCNCC(Br)CBr)c1ccccc1 1344f6864c3b6ccdde3a1523560dbadc [0,2,0,0,0,0|2,0,0]=4 9387 B17R1.1224 O=C(NCCNCC(F)CO)c1ccccc1 8fb863b709a72f097b7596d5184a89e4 [0,2,0,0,0,0|2,0,0]=4 9388 B17R1.1224 O=C(NCCNCC(O)CO)c1ccccc1 a2e505a52ebe7de38cb775c1b8cd6c08 [0,2,0,0,0,0|2,0,0]=4 9389 B17R1.1224 O=C(NCCNC[C@@H](F)CO)c1ccccc1 ddf010a394412a2358b2eb1ad634be84 [0,2,0,0,0,0|2,0,0]=4 9390 B17R1.1224 O=C(NCCNC[C@@H](O)CO)c1ccccc1 8ff2bbf87e4aee6da431e9d4ee3c7beb [0,2,0,0,0,0|2,0,0]=4 9391 B17R1.1224 O=C(NCCNC[C@H](F)CO)c1ccccc1 fa88db86295de7164c0a3ee3f127c189 [0,2,0,0,0,0|2,0,0]=4 9392 B17R1.1224 O=C(NCCNC[C@H](O)CO)c1ccccc1 bcfce2e1771debe06dbed6224c0da97b [0,2,0,0,0,0|2,0,0]=4 9393 B17R1.1224 O=C(NCCOCC(Cl)CCl)c1ccccc1 52f0e61284321e7b20f74c63c67929f9 [0,2,0,0,0,0|2,0,0]=4 9394 B17R1.1224 O=C(NCCOCC(O)CO)c1ccccc1 a3436e633448b82dff53ab06b0233098 [0,2,0,0,0,0|2,0,0]=4 9395 B17R1.1224 O=C(NCCOC[C@@H](O)CO)c1ccccc1 45b311d7400d70ba8a0339322987b868 [0,2,0,0,0,0|2,0,0]=4 9396 B17R1.1224 O=C(NCCOC[C@H](O)CO)c1ccccc1 a5169d2440adb48c8119b39263e44c5d [0,2,0,0,0,0|2,0,0]=4 9397 B17R1.1224 O=C(OCCNCC(Br)CBr)c1ccccc1 e35d884c507288a4eb4890ade7d77973 [0,2,0,0,0,0|1,0,0]=3 9398 B17R1.1224 O=C(OCCNCC(F)CO)c1ccccc1 07dfdb17d2a2adcfdafe5f0a7f6be9f8 [0,2,0,0,0,0|1,0,0]=3 9399 B17R1.1224 O=C(OCCNCC(O)CO)c1ccccc1 ef6cbe6af6ce12dae88269b33f558180 [0,2,0,0,0,0|1,0,0]=3 9400 B17R1.1224 O=C(OCCNC[C@@H](F)CO)c1ccccc1 41003c406b73ce4c5f9aa4c90df9d099 [0,2,0,0,0,0|1,0,0]=3 9401 B17R1.1224 O=C(OCCNC[C@@H](O)CO)c1ccccc1 0e7522384a9ae5827bf7866324ad0ac4 [0,2,0,0,0,0|1,0,0]=3 9402 B17R1.1224 O=C(OCCNC[C@H](F)CO)c1ccccc1 c9f7d291100a57c72febdb9ee3f69cb2 [0,2,0,0,0,0|1,0,0]=3 9403 B17R1.1224 O=C(OCCNC[C@H](O)CO)c1ccccc1 e62add80f7342ebc6ee82edf3710273f [0,2,0,0,0,0|1,0,0]=3 9404 B17R1.1224 O=C(OCCOCC(Br)CBr)c1ccccc1 ea46a7a6e1725f50c312ff9f95fc1115 [0,2,0,0,0,0|1,0,0]=3 9405 B17R1.1224 O=C(OCCOCC(Cl)CCl)c1ccccc1 10be62f9786e9239ac956e9211951091 [0,2,0,0,0,0|1,0,0]=3 9406 B17R1.1224 O=C(OCCOCC(O)CO)c1ccccc1 a23cd814921d7b1902875d056f445caf [0,2,0,0,0,0|1,0,0]=3 9407 B17R1.1224 O=C(OCCOCC(O)CO)c1cccnc1 327315c13729bcb9cd9f6ad997f34585 [0,2,0,0,0,0|2,0,0]=4 9408 B17R1.1224 O=C(OCCOCC(S)CS)c1ccccc1 8ecbb8c6b1599348540b3982e857ee21 [0,2,0,0,0,0|1,0,0]=3 9409 B17R1.1224 O=C(OCCOC[C@@H](O)CO)c1ccccc1 8ec6bc32653fd777245cfadfb257fd0e [0,2,0,0,0,0|1,0,0]=3 9410 B17R1.1224 O=C(OCCOC[C@@H](O)CO)c1cccnc1 5800dae09f129b43c8c9b25a04118db2 [0,2,0,0,0,0|2,0,0]=4 9411 B17R1.1224 O=C(OCCOC[C@H](O)CO)c1ccccc1 e888cec610482ea4516f8c311d45ba41 [0,2,0,0,0,0|1,0,0]=3 9412 B17R1.1224 O=C(OCCOC[C@H](O)CO)c1cccnc1 6ee17aec9e747516aa460d21b32b7149 [0,2,0,0,0,0|2,0,0]=4 9413 B17R1.1224 O=C(OCNCCC(O)CO)c1ccccc1 e9b1ef5cc8aa659bfabdf7c71c63b154 [0,2,0,0,0,0|1,0,0]=3 9414 B17R1.1240 C#CC(OCCCCCCC)c1ccccc1 c3ed160fe0348bbbf7a2b7a326e4bf56 [0,2,0,0,0,0|1,0,1]=4 9415 B17R1.1240 C#CC(OCCCCCCF)c1ccccc1 c40455e5a02ee7438df572ff7cf08533 [0,2,0,0,0,0|1,0,1]=4 9416 B17R1.1240 C#CC(OCCCCCOC)c1ccccc1 515b77dca03e7bfdffef39d51c037eeb [0,2,0,0,0,0|1,0,1]=4 9417 B17R1.1240 C#CC(OCCCOCCC)c1ccccc1 cdaeda2160e33c4ba6a1a416e06a0d78 [0,2,0,0,0,0|1,0,1]=4 9418 B17R1.1240 C#CC(OCCOCCCC)c1ccccc1 318783c7492a484e89de8eb7e237d3a1 [0,2,0,0,0,0|1,0,1]=4 9419 B17R1.1240 C#CCCCCO/C=C(\C=O)/c1ccccc1 00a6341bfa6c909a46dfd6d5808d685c [0,2,0,0,0,0|0,0,2]=4 9420 B17R1.1240 C#C[C@@H](OCCCCCCC)c1ccccc1 ed97a93dac1d26dbd1eacc17961496bd [0,2,0,0,0,0|1,0,1]=4 9421 B17R1.1240 C#C[C@@H](OCCCCCCF)c1ccccc1 f70c04909f825941100fe40d1f89c68a [0,2,0,0,0,0|1,0,1]=4 9422 B17R1.1240 C#C[C@@H](OCCCCCOC)c1ccccc1 ebe99a37cf0da20641ac8825522d9036 [0,2,0,0,0,0|1,0,1]=4 9423 B17R1.1240 C#C[C@@H](OCCCOCCC)c1ccccc1 113b7499c55b3cf1f7756cf047ed7973 [0,2,0,0,0,0|1,0,1]=4 9424 B17R1.1240 C#C[C@@H](OCCOCCCC)c1ccccc1 0251f4f51e006ff2023be8719261c68b [0,2,0,0,0,0|1,0,1]=4 9425 B17R1.1240 C#C[C@H](OCCCCCCC)c1ccccc1 106ee61efaabda4d09757f4c2b3e320f [0,2,0,0,0,0|1,0,1]=4 9426 B17R1.1240 C#C[C@H](OCCCCCCF)c1ccccc1 d19e9889a78ce672e5ce6d38dff9bcad [0,2,0,0,0,0|1,0,1]=4 9427 B17R1.1240 C#C[C@H](OCCCCCOC)c1ccccc1 93bb05be1376e334bc102259366197a3 [0,2,0,0,0,0|1,0,1]=4 9428 B17R1.1240 C#C[C@H](OCCCOCCC)c1ccccc1 b9051c3a646f78dd498c4a4e70f979d1 [0,2,0,0,0,0|1,0,1]=4 9429 B17R1.1240 C#C[C@H](OCCOCCCC)c1ccccc1 81f39ee6605720a39483c49c92099b5f [0,2,0,0,0,0|1,0,1]=4 9430 B17R1.1240 C/C=C\CCCO/C=C(\C=O)/c1ccccc1 5e0fa457996b2d569754ccf5e16dff3a [0,2,0,0,0,0|0,0,2]=4 9431 B17R1.1240 C=CC(OCCCCCCC)c1ccccc1 239609681863b37ed7797c7dee386f04 [0,2,0,0,0,0|1,0,1]=4 9432 B17R1.1240 C=CC(OCCCCCCF)c1ccccc1 9645e483484a25b244a49ee1a09f7da4 [0,2,0,0,0,0|1,0,1]=4 9433 B17R1.1240 C=CC(OCCCCCCS)c1ccccc1 db3b476a7fd91c8f1535343fea54f430 [0,2,0,0,0,0|1,0,1]=4 9434 B17R1.1240 C=CC(OCCCCCOC)c1ccccc1 9f11f04e4c2ca3c0da03758e1b62dbc5 [0,2,0,0,0,0|1,0,1]=4 9435 B17R1.1240 C=CC(OCCCOCCC)c1ccccc1 18980fc05876d895745f2b95dbeb2856 [0,2,0,0,0,0|1,0,1]=4 9436 B17R1.1240 C=CC(OCCOCCCC)c1ccccc1 7e988069cf37852804c4bf9a087bd221 [0,2,0,0,0,0|1,0,1]=4 9437 B17R1.1240 C=CC(OCCSCCCC)c1ccccc1 b2c0e70d131e2b3f1731aeafcd5b096d [0,2,0,0,0,0|1,0,1]=4 9438 B17R1.1240 C=CCCCCCOC(C=O)c1ccccc1 3520ea8ae5a968406d34f2f7e4dfd732 [0,2,0,0,0,0|0,0,2]=4 9439 B17R1.1240 C=CCCCCO/C=C(\C=O)/c1ccccc1 e6327ad77be55e4aa5ecd70f251c3561 [0,2,0,0,0,0|0,0,2]=4 9440 B17R1.1240 CC#CCCCO/C=C(\C=O)/c1ccccc1 ad6540e1512e243294d9ecc857a84848 [0,2,0,0,0,0|0,0,2]=4 9441 B17R1.1240 CC/C=C\CCCOC(C=O)c1ccccc1 2dbd76ce990a1299459501163b3577bb [0,2,0,0,0,0|0,0,2]=4 9442 B17R1.1240 CC/C=C\CCO/C=C(\C=O)/c1ccccc1 71b245b1755c1427ea497254399360b0 [0,2,0,0,0,0|0,0,2]=4 9443 B17R1.1240 CCC(OCCCCCCF)c1ccccc1 268299c3d403ac08938a7d39645a4084 [0,2,0,0,0,0|1,0,1]=4 9444 B17R1.1240 CCC(OCCCCCCS)c1ccccc1 511f0973500187c7e5fd57ae0d868e9b [0,2,0,0,0,0|1,0,1]=4 9445 B17R1.1240 CCC(OCCCCCOC)c1ccccc1 9e6990d825da66189ba7862ecaf62198 [0,2,0,0,0,0|1,0,1]=4 9446 B17R1.1240 CCC/C=C/CO/C=C(\C=O)/c1ccccc1 ce99dff5b1964f045cc9d5ad0d158331 [0,2,0,0,0,0|0,0,2]=4 9447 B17R1.1240 CCC/C=C\CO/C=C(\C=O)/c1ccccc1 17cccaf1e680c0e2421a38a48bddf2ee [0,2,0,0,0,0|0,0,2]=4 9448 B17R1.1240 CCCCCCCCN(C=O)c1ccccc1 060d9df9efbebad5ab528e03dc513ea4 [0,2,0,0,0,0|2,0,0]=4 9449 B17R1.1240 CCCCCCCNC(C=O)c1ccccc1 fcd80e4c978640dd660060a0ca3f3eba [0,2,0,0,0,0|1,0,1]=4 9450 B17R1.1240 CCCCCCCOC(C#N)c1ccccc1 d74bb67d67be93ac2a40bdf70c261a7f [0,2,0,0,0,0|1,0,1]=4 9451 B17R1.1240 CCCCCCCOC(CC)c1ccccc1 7cb02eff334862118419a59df4451109 [0,2,0,0,0,0|1,0,1]=4 9452 B17R1.1240 CCCCCCCOC(CF)c1ccccc1 fb01053955bbf570d6f8b5c447fb2e1d [0,2,0,0,0,0|1,0,1]=4 9453 B17R1.1240 CCCCCCCO[C@@H](C#N)c1ccccc1 8b446ca3b4d33b32bd10b1168bdb137f [0,2,0,0,0,0|1,0,1]=4 9454 B17R1.1240 CCCCCCCO[C@@H](CC)c1ccccc1 03b8721d6db73650e87eb9ed7bf7b2c6 [0,2,0,0,0,0|1,0,1]=4 9455 B17R1.1240 CCCCCCCO[C@H](CC)c1ccccc1 268dbeba1f0df5ff9e24647f4b6ea23a [0,2,0,0,0,0|1,0,1]=4 9456 B17R1.1240 CCCCCCCO[C@H](CF)c1ccccc1 14b0cff37f10593048b0677d51aad5c7 [0,2,0,0,0,0|1,0,1]=4 9457 B17R1.1240 CCCCCCO/C=C(\C=O)/c1ccccc1 eb8322c4695c1684328e892e34916543 [0,2,0,0,0,0|0,0,0]=2 9458 B17R1.1240 CCCCCCO/C=C(\C=O)/c1ccccn1 ee76466f0c97d9ed18c35a0dccc4cc17 [0,2,0,0,0,0|1,0,0]=3 9459 B17R1.1240 CCCCCCO/C=C(\C=O)/c1ccncc1 831fb898a90af3862cf052920c0d8e99 [0,2,0,0,0,0|1,0,0]=3 9460 B17R1.1240 CCCCCCO/C=C(\C=O)/c1ccncn1 c9b710a556362420329063e88954cb65 [0,2,0,0,0,0|2,0,0]=4 9461 B17R1.1240 CCCCCCO/C=C(\C=O)/c1cnccn1 f0a855db63a122d1cc168d195560b92d [0,2,0,0,0,0|2,0,0]=4 9462 B17R1.1240 CCCCCCOC=C(C#N)c1ccccc1 25ac7223fca4c595a9b0e6587a1f8855 [0,2,0,0,0,0|1,0,0]=3 9463 B17R1.1240 CCCCCCOCC(C#N)c1ccccc1 c37e0da49110837ff43e5c0c82495515 [0,2,0,0,0,0|1,0,1]=4 9464 B17R1.1240 CCCCCCOCC(CC)c1ccccc1 ad7550b55491ab063caaa4c40ffc2306 [0,2,0,0,0,0|1,0,1]=4 9465 B17R1.1240 CCCCCCOCC(OC)c1ccccc1 d7d0cab03b80e1753925888d39fcf702 [0,2,0,0,0,0|0,0,2]=4 9466 B17R1.1240 CCCCCCOC[C@H](OC)c1ccccc1 4a900af0e9e3b0a2538b6619ac4eb077 [0,2,0,0,0,0|0,0,2]=4 9467 B17R1.1240 CCCCOCCNC(C=O)c1ccccc1 fecca9967130414aa2a36b1067830b83 [0,2,0,0,0,0|1,0,1]=4 9468 B17R1.1240 CCCCOCCOC(C#N)c1ccccc1 c47342ea45a75c2527d5c26c354bce39 [0,2,0,0,0,0|1,0,1]=4 9469 B17R1.1240 CCCCOCCOC(C=O)c1ccccc1 ad4c9618ba3d97d163843fa19606d44e [0,2,0,0,0,0|0,0,1]=3 9470 B17R1.1240 CCCCOCCOC(CC)c1ccccc1 a35791970c8e85f888156dbd333d8ade [0,2,0,0,0,0|1,0,1]=4 9471 B17R1.1240 CCCCOCCOC(CF)c1ccccc1 69c0abcd0afbe4bb4bce52078e76e501 [0,2,0,0,0,0|1,0,1]=4 9472 B17R1.1240 CCCCOCCOC(CS)c1ccccc1 a5ae4b1b95eb4a51088c1a5d2fcb7345 [0,2,0,0,0,0|0,1,1]=4 9473 B17R1.1240 CCCCOCCO[C@@H](C#N)c1ccccc1 d4b4d2697b4bb7c1d6abcde713999949 [0,2,0,0,0,0|1,0,1]=4 9474 B17R1.1240 CCCCOCCO[C@@H](CC)c1ccccc1 2ddd79630dd03ff653dc5da1e6efa99d [0,2,0,0,0,0|1,0,1]=4 9475 B17R1.1240 CCCCOCCO[C@H](CC)c1ccccc1 41cfad50a407909948b9c4c0ebf73aaa [0,2,0,0,0,0|1,0,1]=4 9476 B17R1.1240 CCCCOCCO[C@H](CF)c1ccccc1 d1d8f91ca08e6541eda7d53554dfa7a2 [0,2,0,0,0,0|1,0,1]=4 9477 B17R1.1240 CCCCOCO/C=C(\C=O)/c1ccccc1 4f3d44c70dc3d6f3a0dd1c9709e128ed [0,2,0,0,0,0|1,0,0]=3 9478 B17R1.1240 CCCCOCO/C=C(\C=O)/c1ccccn1 a7201321e310cb15b4aa602b79da52ec [0,2,0,0,0,0|2,0,0]=4 9479 B17R1.1240 CCCCOCO/C=C(\C=O)/c1ccncc1 cfe85acb8921d48dc3a95ee2f19b889c [0,2,0,0,0,0|2,0,0]=4 9480 B17R1.1240 CCCCOCOC=C(C#N)c1ccccc1 afee5502e9813ae47a296108c43110b0 [0,2,0,0,0,0|2,0,0]=4 9481 B17R1.1240 CCCCSCCOC(CC)c1ccccc1 af0c75d79c379b5058a3470e547ee0df [0,2,0,0,0,0|1,0,1]=4 9482 B17R1.1240 CCCOCCCNC(C=O)c1ccccc1 79413f35a1fd3e3634c5922ae62d75de [0,2,0,0,0,0|1,0,1]=4 9483 B17R1.1240 CCCOCCCOC(C#N)c1ccccc1 cfa5653d999efbb95fa2beb0b2be3f82 [0,2,0,0,0,0|1,0,1]=4 9484 B17R1.1240 CCCOCCCOC(CC)c1ccccc1 de96c15067fbd0a22cc482f19f61b426 [0,2,0,0,0,0|1,0,1]=4 9485 B17R1.1240 CCCOCCCOC(CF)c1ccccc1 f9233dd42eb1fdfccd6892cbd814c45d [0,2,0,0,0,0|1,0,1]=4 9486 B17R1.1240 CCCOCCCO[C@@H](C#N)c1ccccc1 54a77a5b677d839903c6da0fb272e211 [0,2,0,0,0,0|1,0,1]=4 9487 B17R1.1240 CCCOCCCO[C@@H](CC)c1ccccc1 89623cbcd871f713689dd01069491a5a [0,2,0,0,0,0|1,0,1]=4 9488 B17R1.1240 CCCOCCCO[C@H](CC)c1ccccc1 df5ea6775d38b1ced7820c43183d58ea [0,2,0,0,0,0|1,0,1]=4 9489 B17R1.1240 CCCOCCCO[C@H](CF)c1ccccc1 6cb10068701aafcbc082834aac6d0923 [0,2,0,0,0,0|1,0,1]=4 9490 B17R1.1240 CCCOCCO/C=C(\C=O)/c1ccccc1 79f9cad7e08694bde64904d18d86a246 [0,2,0,0,0,0|1,0,0]=3 9491 B17R1.1240 CCCOCCO/C=C(\C=O)/c1ccccn1 39b74aecb512b1c3532aae5ba6c875e1 [0,2,0,0,0,0|2,0,0]=4 9492 B17R1.1240 CCCOCCO/C=C(\C=O)/c1ccncc1 6bcb9e5952db7d5bf008441b4b8e70d1 [0,2,0,0,0,0|2,0,0]=4 9493 B17R1.1240 CCCOCCOC=C(C#N)c1ccccc1 92a431fed655a01e56d765718116a3fe [0,2,0,0,0,0|2,0,0]=4 9494 B17R1.1240 CCOCCCO/C=C(\C=O)/c1ccccc1 d59b124a88a4aacb916bdd2a87356a2a [0,2,0,0,0,0|1,0,0]=3 9495 B17R1.1240 CCOCCCO/C=C(\C=O)/c1ccccn1 0a74d3add5f8424cac9e82b1bbda033d [0,2,0,0,0,0|2,0,0]=4 9496 B17R1.1240 CCOCCCO/C=C(\C=O)/c1ccncc1 e115738423076527e724b8189a106f3d [0,2,0,0,0,0|2,0,0]=4 9497 B17R1.1240 CCOCCCOC=C(C#N)c1ccccc1 06e549822a50eec2d88a41b855bc6372 [0,2,0,0,0,0|2,0,0]=4 9498 B17R1.1240 CCSCCCCNC(C=O)c1ccccc1 fb49eb67920271f80d521650981d2bd6 [0,2,0,0,0,0|1,0,1]=4 9499 B17R1.1240 CCSCCCO/C=C(\C=O)/c1ccccc1 83fa5a353e16de375dcd7499c3bdcc26 [0,2,0,0,0,0|1,0,0]=3 9500 B17R1.1240 CCSCCCO/C=C(\C=O)/c1ccccn1 1ace56492b86628701afc25ca81c8dbb [0,2,0,0,0,0|2,0,0]=4 9501 B17R1.1240 CCSCCCO/C=C(\C=O)/c1ccncc1 9c6c599b61782fdb16e7a8157f0e6ae6 [0,2,0,0,0,0|2,0,0]=4 9502 B17R1.1240 CCSCCCOC=C(C#N)c1ccccc1 77e9e0d4181fcdfdafbd10700900390c [0,2,0,0,0,0|2,0,0]=4 9503 B17R1.1240 CC[C@@H](OCCCCCCF)c1ccccc1 c31eeb220e1541e657c3cc9418844bbd [0,2,0,0,0,0|1,0,1]=4 9504 B17R1.1240 CC[C@@H](OCCCCCOC)c1ccccc1 b73b977bec092d801f78dd08e71eca73 [0,2,0,0,0,0|1,0,1]=4 9505 B17R1.1240 CC[C@H](OCCCCCCF)c1ccccc1 c9a1d44f910b325b93ec24563fa7b502 [0,2,0,0,0,0|1,0,1]=4 9506 B17R1.1240 CC[C@H](OCCCCCOC)c1ccccc1 002ec4d5362a3a215645032c704638bf [0,2,0,0,0,0|1,0,1]=4 9507 B17R1.1240 COCCCCCNC(C=O)c1ccccc1 b9b62d067e22496bced7bba27716d5d2 [0,2,0,0,0,0|1,0,1]=4 9508 B17R1.1240 COCCCCCOC(C#N)c1ccccc1 087eb6f24d226a04bb652a78693970c2 [0,2,0,0,0,0|1,0,1]=4 9509 B17R1.1240 COCCCCCOC(CF)c1ccccc1 b15045c1c65441a7b4c76823d5627642 [0,2,0,0,0,0|1,0,1]=4 9510 B17R1.1240 COCCCCCOC(CS)c1ccccc1 4961454b3813d02a52db5488f04a7767 [0,2,0,0,0,0|0,1,1]=4 9511 B17R1.1240 COCCCCCO[C@@H](C#N)c1ccccc1 4dd59037a49a77d05f91065df57aa708 [0,2,0,0,0,0|1,0,1]=4 9512 B17R1.1240 COCCCCCO[C@H](CF)c1ccccc1 fd634b4015e69228d517b2cc4d506275 [0,2,0,0,0,0|1,0,1]=4 9513 B17R1.1240 COCCCCO/C=C(\C=O)/c1ccccc1 5a33c28868027885787143c6bdad5ba7 [0,2,0,0,0,0|1,0,0]=3 9514 B17R1.1240 COCCCCO/C=C(\C=O)/c1ccccn1 c66a851075f79aaf413cfc24167bfe7a [0,2,0,0,0,0|2,0,0]=4 9515 B17R1.1240 COCCCCO/C=C(\C=O)/c1ccncc1 5b5f3aabb15c911e7b93bdd605211c34 [0,2,0,0,0,0|2,0,0]=4 9516 B17R1.1240 COCCCCOC=C(C#N)c1ccccc1 b3f4835989426af3774aa713a6b5bfb6 [0,2,0,0,0,0|2,0,0]=4 9517 B17R1.1240 COCCOCCOC(C=O)c1ccccc1 3346d02cbed6a09749adb2412aff271b [0,2,0,0,0,0|1,0,1]=4 9518 B17R1.1240 COCCOCO/C=C(\C=O)/c1ccccc1 42f1a952be030d0aff424d1e81b436bc [0,2,0,0,0,0|2,0,0]=4 9519 B17R1.1240 COCOCCO/C=C(\C=O)/c1ccccc1 4bdb9ee80c3639a885962576e35fc398 [0,2,0,0,0,0|2,0,0]=4 9520 B17R1.1240 FCCCCCCOC(CF)c1ccccc1 8e747b7657466adf5ca2c7c37d333eb5 [0,2,0,0,0,0|1,0,1]=4 9521 B17R1.1240 FCCCCCCO[C@H](CF)c1ccccc1 40b963c9fc6084b05340d5c106338d66 [0,2,0,0,0,0|1,0,1]=4 9522 B17R1.1240 N#CC(=COCCCCCF)c1ccccc1 f95ceae73c8dac17d693bd2ba00485b0 [0,2,0,0,0,0|2,0,0]=4 9523 B17R1.1240 N#CC(OCCCCCCF)c1ccccc1 1ba0851d195f34f4fcd4edc06fc46b5d [0,2,0,0,0,0|1,0,1]=4 9524 B17R1.1240 N#CCCCCCOC(C=O)c1ccccc1 3f41a303c18399f36bdfeba8d87f958a [0,2,0,0,0,0|0,0,2]=4 9525 B17R1.1240 N#CCCCCO/C=C(\C=O)/c1ccccc1 8b7b7fa565643d714a1e83150f85adfa [0,2,0,0,0,0|1,0,1]=4 9526 B17R1.1240 N#C[C@H](OCCCCCCF)c1ccccc1 5c218fca1663a3350ebe5c905d4b2b72 [0,2,0,0,0,0|1,0,1]=4 9527 B17R1.1240 O=C/C(=C\OCCCCCF)/c1ccccc1 9237e9ea9921f6b2cca3995e7ac53dac [0,2,0,0,0,0|1,0,0]=3 9528 B17R1.1240 O=C/C(=C\OCCCCCF)/c1ccccn1 bf3136f94bf4a05ded12c64bc7d3c5d0 [0,2,0,0,0,0|2,0,0]=4 9529 B17R1.1240 O=C/C(=C\OCCCCCF)/c1ccncc1 ab4b5b503f4b91113c40f9364cee8577 [0,2,0,0,0,0|2,0,0]=4 9530 B17R1.1240 O=CC(NCCCCCCCl)c1ccccc1 00479bd3b7fc11c927867e14ec3d7b36 [0,2,0,0,0,0|1,0,1]=4 9531 B17R1.1240 O=CC(NCCCCCCO)c1ccccc1 e1472eff002ce14441892d7ca27b39d2 [0,2,0,0,0,0|1,0,1]=4 9532 B17R1.1240 O=CC(OCCCCCCF)c1ccccc1 507abe139323817b87f037cf31393ff4 [0,2,0,0,0,0|0,0,1]=3 9533 B17R1.1240 O=CCCCCO/C=C(\C=O)/c1ccccc1 89bef0dc9c673042403209ebb9007543 [0,2,0,0,0,0|1,0,1]=4 9534 B17R1.1299 C=C(COC(C)CCCCC)c1ccccn1 f565e6ffd3b9896e57a3fcf0b2929ca7 [0,2,0,0,0,0|2,0,0]=4 9535 B17R1.1299 C=C(CO[C@@H](C)CCCCC)c1ccccn1 bc5bc5700b3b295e89ba4a6c35224031 [0,2,0,0,0,0|2,0,0]=4 9536 B17R1.1299 C=CCCCN(C)COC(=O)c1ccccc1 5011bda354c0f5e670718e204b09a0bd [0,2,0,0,0,0|0,0,2]=4 9537 B17R1.1299 C=CCCC[C@H](C)OCC(=O)c1ccccc1 8871eca1571eaab508b448a41adad3c6 [0,2,0,0,0,0|0,0,2]=4 9538 B17R1.1299 CC(CCCCO)NCC(=O)c1ccccc1 83473b068b219721ab38800dbc965225 [0,2,0,0,0,0|2,0,0]=4 9539 B17R1.1299 CC(CNC(=O)c1ccccc1)OCCCF 46d4b0ef8a1ec9892f185b87f760cd90 [0,2,0,0,0,0|2,0,0]=4 9540 B17R1.1299 CC(CNC(=O)c1ccccc1)OCCCS ddb619e7143d4fa737fb2e61398a362a [0,2,0,0,0,0|2,0,0]=4 9541 B17R1.1299 CCCCCC(=O)NCC(=O)c1ccccc1 6bea998f8082d543528713564881ffc3 [0,2,0,0,0,0|1,0,1]=4 9542 B17R1.1299 CCCCCC(C)NCC(=O)c1ccccc1 c2193d43bfa9a4cc6cdcdbd4ed147663 [0,2,0,0,0,0|1,0,0]=3 9543 B17R1.1299 CCCCCC(C)NCC(=O)c1ccccn1 8762596b048df27744516a73323c4584 [0,2,0,0,0,0|2,0,0]=4 9544 B17R1.1299 CCCCCC(C)NCC(=O)c1cccnc1 8572050c78d663b84d2deee5c7cd9970 [0,2,0,0,0,0|2,0,0]=4 9545 B17R1.1299 CCCCCC(C)OCC(=O)c1ccccc1 fe327de2adc58d0a839c00b569a624b0 [0,2,0,0,0,0|0,0,0]=2 9546 B17R1.1299 CCCCCC(C)OCC(=O)c1ccccn1 9d6417c0925825417ad9476d8e0b8d61 [0,2,0,0,0,0|1,0,0]=3 9547 B17R1.1299 CCCCCC(C)OCC(=O)c1cccnc1 c76538ffcbba92b57114e4200a6f4240 [0,2,0,0,0,0|1,0,0]=3 9548 B17R1.1299 CCCCCC(C)OCC(=O)c1ccncn1 9cdfc21e1c90b1ba6d9e85d4cf76fe73 [0,2,0,0,0,0|2,0,0]=4 9549 B17R1.1299 CCCCCC(C)OCC(=O)c1cnccn1 e8cf716525de82c914ee421a7c8cedca [0,2,0,0,0,0|2,0,0]=4 9550 B17R1.1299 CCCCCC(C)OCC(C)c1ccccc1 7c09e375dff49984db3ba8425c5ea37a [0,2,0,0,0,0|1,0,1]=4 9551 B17R1.1299 CCCCCC(C)OC[C@@H](C)c1ccccc1 08e5aece29678d014cdd1d9a886a95f7 [0,2,0,0,0,0|1,0,1]=4 9552 B17R1.1299 CCCCC[C@@H](C)OCC(=O)c1ccccn1 03ec961639c73aa9681cfbdc04833ca7 [0,2,0,0,0,0|1,0,0]=3 9553 B17R1.1299 CCCCC[C@@H](C)OCC(=O)c1cccnc1 6229a6d6e6d701acc22fa6880f60bd25 [0,2,0,0,0,0|1,0,0]=3 9554 B17R1.1299 CCCCC[C@@H](C)OCC(=O)c1ccncn1 374d55d1eacab7a6258532fccebeb9a1 [0,2,0,0,0,0|2,0,0]=4 9555 B17R1.1299 CCCCC[C@@H](C)OCC(=O)c1cnccn1 e85936132046443d2d025cbff9f74421 [0,2,0,0,0,0|2,0,0]=4 9556 B17R1.1299 CCCCC[C@@H](C)OCC(C)c1ccccc1 701f3dd08183f13b029371767e4388d1 [0,2,0,0,0,0|1,0,1]=4 9557 B17R1.1299 CCCCC[C@@H](C)OC[C@@H](C)c1ccccc1 8ab79d2bcefb3224ad29fe63e4b42b52 [0,2,0,0,0,0|1,0,1]=4 9558 B17R1.1299 CCCCC[C@H](C)NCC(=O)c1ccccc1 c0f528e32a768773feb449c8164152fb [0,2,0,0,0,0|1,0,0]=3 9559 B17R1.1299 CCCCC[C@H](C)NCC(=O)c1ccccn1 19a17eb0ad971b1880b2dcdfee6ea3df [0,2,0,0,0,0|2,0,0]=4 9560 B17R1.1299 CCCCC[C@H](C)NCC(=O)c1cccnc1 36580b0c2202486d6ffae7db395974bd [0,2,0,0,0,0|2,0,0]=4 9561 B17R1.1299 CCCCC[C@H](C)OCC(=O)c1ccccc1 aab2f1844048014238fcd2688c81f8e3 [0,2,0,0,0,0|0,0,0]=2 9562 B17R1.1299 CCCCC[C@H](C)OCC(=O)c1ccccn1 8c6f9e119eea59cfe5a904677423987c [0,2,0,0,0,0|1,0,0]=3 9563 B17R1.1299 CCCCC[C@H](C)OCC(=O)c1cccnc1 12ae7e6f77a703e0c36dc51824b4af37 [0,2,0,0,0,0|1,0,0]=3 9564 B17R1.1299 CCCCC[C@H](C)OCC(=O)c1ccncn1 f117a721a6827c23c917fede32904173 [0,2,0,0,0,0|2,0,0]=4 9565 B17R1.1299 CCCCC[C@H](C)OCC(=O)c1cnccn1 5b4e141e9f461ba313b77355d7fa261e [0,2,0,0,0,0|2,0,0]=4 9566 B17R1.1299 CCCCC[C@H](C)OCC(C)c1ccccc1 70d43dd33733d1f2df567356ce3cd828 [0,2,0,0,0,0|1,0,1]=4 9567 B17R1.1299 CCCCC[C@H](C)OC[C@@H](C)c1ccccc1 829c61d342305fe4766476d5ffa4aa7a [0,2,0,0,0,0|1,0,1]=4 9568 B17R1.1299 CCCCNC(=O)CCC(=O)c1ccccc1 11d33016d2d02bf5b7bef907f938ad49 [0,2,0,0,0,0|1,0,1]=4 9569 B17R1.1299 CCCCNC(=O)CNC(=O)c1ccccc1 fc9900d1e760f581ed4ded0d4fbf3410 [0,2,0,0,0,0|1,0,1]=4 9570 B17R1.1299 CCCCOC(C)CNC(=O)c1ccccc1 80fbd580767555e88ebd1a3766cc2014 [0,2,0,0,0,0|1,0,0]=3 9571 B17R1.1299 CCCOCC(C)OCC(=O)c1ccccn1 2aa3fa8a8f3a4ca5e41618ec058c55cf [0,2,0,0,0,0|2,0,0]=4 9572 B17R1.1299 CCCOCC(C)OCC(=O)c1cccnc1 69826627b507df3b87a0b28c633b146d [0,2,0,0,0,0|2,0,0]=4 9573 B17R1.1299 CCOCOC(C)CNC(=O)c1ccccc1 1a5c80e7702717b2a82d6a9f8f20a146 [0,2,0,0,0,0|2,0,0]=4 9574 B17R1.1299 CN(CCCCO)COC(=O)c1ccccc1 b23f486dc90867e1a2528100d90b182b [0,2,0,0,0,0|1,0,0]=3 9575 B17R1.1299 COCCOC(C)CNC(=O)c1ccccc1 5558460a2d445cbf4b3edcd924621a47 [0,2,0,0,0,0|2,0,0]=4 9576 B17R1.1299 CSCCOC(C)CNC(=O)c1ccccc1 7dd5f85e141e44d8987aa39356d84f09 [0,2,0,0,0,0|2,0,0]=4 9577 B17R1.1433 CC(C)(OCCCCCCF)c1ccccc1 18520951c480f0a6e9be0b1ba134bf5c [0,2,0,0,0,0|1,0,1]=4 9578 B17R1.1433 CCCCCCCOC(C)(C)c1ccccc1 c40ccaf43507774419c6a2a0f9bc6e52 [0,2,0,0,0,0|1,0,1]=4 9579 B17R1.1433 CCCCCCNCS(=O)(=O)c1ccccc1 185e891bcb3b056901837ecd72ec4748 [0,2,0,0,0,0|2,0,0]=4 9580 B17R1.1433 CCCCCCOCC(C)(C)c1ccccc1 0a19f40a230a1734288b1f4bef493886 [0,2,0,0,0,0|1,0,1]=4 9581 B17R1.1433 CCCCCCOCC(F)(F)c1ccccc1 eed707d89ab4bfca511b0a86dd3953f5 [0,2,0,0,0,0|1,0,1]=4 9582 B17R1.1433 CCCCCCOCS(=O)(=O)c1ccccc1 2283152374ef403dac5025c7bec2e7a8 [0,2,0,0,0,0|1,0,0]=3 9583 B17R1.1433 CCCCCNCCS(=O)(=O)c1ccccc1 f54469c7012173900ad22a73449a2fe4 [0,2,0,0,0,0|2,0,0]=4 9584 B17R1.1433 CCCCCOCCS(=O)(=O)c1ccccc1 893b3155321125ddf3cc5ff52b8a3c8b [0,2,0,0,0,0|2,0,0]=4 9585 B17R1.1433 CCCCNCCCS(=O)(=O)c1ccccc1 62ff52b7a41cb0693d8019dc4662896b [0,2,0,0,0,0|2,0,0]=4 9586 B17R1.1433 CCCCNCCNS(=O)(=O)c1ccccc1 f2b48e6cb75039b7c4608b264ad469e8 [0,2,0,0,0,0|2,0,0]=4 9587 B17R1.1433 CCCCNCCOS(=O)(=O)c1ccccc1 83adb08a8c5cd698a6505f81dc1f159b [0,2,0,0,0,0|1,0,0]=3 9588 B17R1.1433 CCCCOCCCS(=O)(=O)c1ccccc1 5d127aa176fa4db108e6ab006f042f73 [0,2,0,0,0,0|2,0,0]=4 9589 B17R1.1433 CCCCOCCNS(=O)(=O)c1ccccc1 c513def897af520d82316013a5d96d5a [0,2,0,0,0,0|2,0,0]=4 9590 B17R1.1433 CCCCOCCOC(C)(C)c1ccccc1 ed0f5f86159d0caae5232765f873d9cf [0,2,0,0,0,0|1,0,1]=4 9591 B17R1.1433 CCCCOCCOS(=O)(=O)c1ccccc1 7202bfbcc4ff3e2f73d01ef606dae017 [0,2,0,0,0,0|1,0,0]=3 9592 B17R1.1433 CCCOCCCOC(C)(C)c1ccccc1 061285d8bea237cf0f725ea940d19003 [0,2,0,0,0,0|1,0,1]=4 9593 B17R1.1433 CCCOCCOCS(=O)(=O)c1ccccc1 61d9d2ac952d91dc6df877c3ff32b25c [0,2,0,0,0,0|2,0,0]=4 9594 B17R1.1433 CCCSCCOCS(=O)(=O)c1ccccc1 d852b8d505617e4392af9cbb41474658 [0,2,0,0,0,0|2,0,0]=4 9595 B17R1.1433 CCOCCCOCS(=O)(=O)c1ccccc1 2647932a38985d30632025a5935a1237 [0,2,0,0,0,0|2,0,0]=4 9596 B17R1.1433 CCOCOCCOS(=O)(=O)c1ccccc1 ca8c3416d45d99f8b84ba1175ce42e7f [0,2,0,0,0,0|2,0,0]=4 9597 B17R1.1433 CCSCCCOCS(=O)(=O)c1ccccc1 08801bbc0085f70244ba3af9a0899d64 [0,2,0,0,0,0|2,0,0]=4 9598 B17R1.1433 COCCCCCOC(C)(C)c1ccccc1 09ef59fe75ffb91b13cbc923f6043e9a [0,2,0,0,0,0|1,0,1]=4 9599 B17R1.1433 COCCCCOCS(=O)(=O)c1ccccc1 86f544de40f17f6f62d47e8a123605a2 [0,2,0,0,0,0|2,0,0]=4 9600 B17R1.1433 COCCNCCOS(=O)(=O)c1ccccc1 8373a902c5bd0633ac6445ca56124db5 [0,2,0,0,0,0|2,0,0]=4 9601 B17R1.1433 COCCOCCOS(=O)(=O)c1ccccc1 72cf66e7036ae3b6ed51793daa3d66a0 [0,2,0,0,0,0|2,0,0]=4 9602 B17R1.1433 CSCCCCOCS(=O)(=O)c1ccccc1 9c28a3db0dbccc7d3b7873388b3a3596 [0,2,0,0,0,0|2,0,0]=4 9603 B17R1.1433 CSCCNCCOS(=O)(=O)c1ccccc1 66973e5e56abc51822faf80a16043052 [0,2,0,0,0,0|2,0,0]=4 9604 B17R1.1433 CSCCOCCOS(=O)(=O)c1ccccc1 1c88aebf9336dd6938a05a2cbc1fc883 [0,2,0,0,0,0|2,0,0]=4 9605 B17R1.1433 O=S(=O)(OCCNCCCCl)c1ccccc1 52d5279095f3ebb91b1b54588971278b [0,2,0,0,0,0|2,0,0]=4 9606 B17R1.1433 O=S(=O)(OCCNCCCO)c1ccccc1 cfa162cd6927d8adfdf1c44bfd0f6ea6 [0,2,0,0,0,0|2,0,0]=4 9607 B17R1.1433 O=S(=O)(OCCOCCCF)c1ccccc1 f537c7a43b2b904ad3a25d2fefa6e6fd [0,2,0,0,0,0|2,0,0]=4 9608 B17R1.1433 O=S(=O)(OCCOCCCS)c1ccccc1 8bc9b1e9e3e6238f98c0c010030ca076 [0,2,0,0,0,0|2,0,0]=4 9609 B17R1.1556 C#CCCN(C)CCOC(=O)c1ccccc1 f94c19a0513c65265ef2a1b007a2e6c7 [0,2,0,0,0,0|0,0,2]=4 9610 B17R1.1556 C=C(COCC(C)CCCC)c1ccccc1 8367ebc56a7defb401e90e20fbc82072 [0,2,0,0,0,0|1,0,0]=3 9611 B17R1.1556 C=CCCC(C)OCOC(=O)c1ccccc1 2e6adc5871965b1038bfa36ba749ad57 [0,2,0,0,0,0|0,0,2]=4 9612 B17R1.1556 C=CCCN(C)CCOC(=O)c1ccccc1 dc18c9f651de67fd22917e4caced76a1 [0,2,0,0,0,0|0,0,2]=4 9613 B17R1.1556 C=CCC[C@@H](C)OCOC(=O)c1ccccc1 7fd43d969c073bded6f7c1cb1292e49c [0,2,0,0,0,0|0,0,2]=4 9614 B17R1.1556 CC(CCCO)NCOC(=O)c1ccccc1 c439e4d7830ec7253e7625260d2b93e7 [0,2,0,0,0,0|1,0,0]=3 9615 B17R1.1556 CCCCC(C)COCC(=O)c1ccccn1 cd0be040008d1c06639a6cb09b598a58 [0,2,0,0,0,0|1,0,0]=3 9616 B17R1.1556 CCCCC(C)COCC(=O)c1cccnc1 65f3eb3e52a986ac055bc9d0c0d276cd [0,2,0,0,0,0|1,0,0]=3 9617 B17R1.1556 CCCCC(C)COCC(=O)c1ccncn1 dfe8651214abd4bbadb233980dcda2f2 [0,2,0,0,0,0|2,0,0]=4 9618 B17R1.1556 CCCCC(C)COCC(=O)c1cnccn1 6ce2ec42f5841730ba3279ae72630824 [0,2,0,0,0,0|2,0,0]=4 9619 B17R1.1556 CCCCC(C)COCC(C)c1ccccc1 124feb77f8ea22dd651078b40d91e4b9 [0,2,0,0,0,0|1,0,1]=4 9620 B17R1.1556 CCCCC(C)COC[C@@H](C)c1ccccc1 6c21c8ff58b4082c46d4fa5251a1c871 [0,2,0,0,0,0|1,0,1]=4 9621 B17R1.1556 CCCCC(C)NCOC(=O)c1ccccc1 9c775882a460579817638f79ff8dd678 [0,2,0,0,0,0|0,0,0]=2 9622 B17R1.1556 CCCCC(C)OCCC(=O)c1ccccc1 5c75249ea7ef96c36f571e71a0f2ffad [0,2,0,0,0,0|1,0,0]=3 9623 B17R1.1556 CCCCC(C)OCNC(=O)c1ccccc1 e9bf868934ea9cb15297aa7d81918f16 [0,2,0,0,0,0|1,0,0]=3 9624 B17R1.1556 CCCCC(C)OCNC(=O)c1cccnc1 46fa0f7021138dd4af881bd7ec82beaa [0,2,0,0,0,0|2,0,0]=4 9625 B17R1.1556 CCCCC(O)CNCC(=O)c1ccccc1 ffde6971ea4892fe0336d199b2f34cc5 [0,2,0,0,0,0|1,0,0]=3 9626 B17R1.1556 CCCCC(O)CNCC(=O)c1ccccn1 3d9507078f38ba4842e0c1b74d40a3a2 [0,2,0,0,0,0|2,0,0]=4 9627 B17R1.1556 CCCCC(O)CNCC(=O)c1cccnc1 dec6feca154189d588298bff23ea9125 [0,2,0,0,0,0|2,0,0]=4 9628 B17R1.1556 CCCCN(C)CCNC(=O)c1ccccc1 72eee510cbab7f89e4dd9f26ec2e6ded [0,2,0,0,0,0|1,0,0]=3 9629 B17R1.1556 CCCCN(C)CCNC(=O)c1ccccn1 e85bfc4cc9d7852b93f97ff5e737c7a8 [0,2,0,0,0,0|2,0,0]=4 9630 B17R1.1556 CCCCN(C)CCNC(=O)c1cccnc1 f249e70ea157935414f39dd8eb77bd7e [0,2,0,0,0,0|2,0,0]=4 9631 B17R1.1556 CCCCN(C)CCNC(=O)c1ccncc1 482cbb6bfcf8ab1d9b6fed9a6253f5b7 [0,2,0,0,0,0|2,0,0]=4 9632 B17R1.1556 CCCCN(C)CCOC(=O)c1ccccc1 acf7ab39455a025d9f54286186b2ab01 [0,2,0,0,0,0|0,0,0]=2 9633 B17R1.1556 CCCC[C@@H](C)NCOC(=O)c1ccccc1 cfd22b7bc387add1e888bb7ee6aa7852 [0,2,0,0,0,0|0,0,0]=2 9634 B17R1.1556 CCCNC(=O)CCCC(=O)c1ccccc1 0667ece753f89ca2d0069e90ad257dfa [0,2,0,0,0,0|1,0,1]=4 9635 B17R1.1556 CCCNC(=O)CCNC(=O)c1ccccc1 1de3f5201fa11dc57b5a6171ef160f58 [0,2,0,0,0,0|1,0,1]=4 9636 B17R1.1556 CCCNC(=O)COCC(=O)c1ccccc1 e0788039be8a8268818e16b4a6f4c487 [0,2,0,0,0,0|1,0,1]=4 9637 B17R1.1556 CCCOC(=O)COCC(=O)c1ccccc1 375fa1f43d89cb468fef8bc6a7478485 [0,2,0,0,0,0|1,0,1]=4 9638 B17R1.1556 CCOCC(C)COCC(=O)c1ccccn1 ed6360f5e659dd5a1002171baccc246d [0,2,0,0,0,0|2,0,0]=4 9639 B17R1.1556 CCOCC(C)COCC(=O)c1cccnc1 2614e037242559b364d49c11a4c125ac [0,2,0,0,0,0|2,0,0]=4 9640 B17R1.1556 CCOCC(O)CNCC(=O)c1ccccc1 35aac94516c4d66a53f1569379f42077 [0,2,0,0,0,0|2,0,0]=4 9641 B17R1.1556 CN(CCC#N)CCOC(=O)c1ccccc1 98190cd8767be93b65f80ca7ccc7ab10 [0,2,0,0,0,0|1,0,1]=4 9642 B17R1.1556 CN(CCCO)CCOC(=O)c1ccccc1 d394a093772f7c7d20a88fc5c9bb890f [0,2,0,0,0,0|1,0,0]=3 9643 B17R1.1556 CN(CCON)CCOC(=O)c1ccccc1 433fdbab2ed93eaec13e579f2ea54a90 [0,2,0,0,0,0|2,0,0]=4 9644 B17R1.1556 COCCC(C)OCOC(=O)c1ccccc1 fe6317300cd9edc3b4ca27065fd9331c [0,2,0,0,0,0|1,0,0]=3 9645 B17R1.1556 COCCN(C)CCOC(=O)c1ccccc1 21d964fc5511a4dcef24d6f00d87f783 [0,2,0,0,0,0|1,0,0]=3 9646 B17R1.1556 COCO[C@H](C)COCC(=O)c1ccccc1 6ee5ece804c09e3f65d4254b35962f60 [0,2,0,0,0,0|2,0,0]=4 9647 B17R1.1556 CSCCC(=O)COCC(=O)c1ccccc1 1d9c719a69cc8bd965fa42f295417e77 [0,2,0,0,0,0|1,0,1]=4 9648 B17R1.1556 CSCCC(C)OCOC(=O)c1ccccc1 4435ee48180368c106df433b318f3d85 [0,2,0,0,0,0|1,0,0]=3 9649 B17R1.1556 CSCCN(C)CCOC(=O)c1ccccc1 577cab778801a86dceaf61e4bf429a33 [0,2,0,0,0,0|1,0,0]=3 9650 B17R1.1556 C[C@H](CCCO)CNCC(=O)c1ccccc1 10e44cb83070c8b8644ca7281c732ea7 [0,2,0,0,0,0|2,0,0]=4 9651 B17R1.1556 C[C@H](CCCO)NCOC(=O)c1ccccc1 3b000ae29c93ad858a478f086138819e [0,2,0,0,0,0|1,0,0]=3 9652 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1Br b174c161b5f5c7d768a5ff202985e1f1 [0,2,0,0,0,0|1,0,1]=4 9653 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1C a195366af1d1b6bdf6e424fc3352c45e [0,2,0,0,0,0|1,0,1]=4 9654 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1Cl 20af0e254645764f90a683f0efa85383 [0,2,0,0,0,0|1,0,1]=4 9655 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1F ff8bf9caab06c1b8d355a676aa7281f3 [0,2,0,0,0,0|1,0,1]=4 9656 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1I adcc8bd4d04187cde0a153b733333275 [0,2,0,0,0,0|1,0,1]=4 9657 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1O ea55ab0babf57fc8679bd4a252695e18 [0,2,0,0,0,0|1,0,1]=4 9658 B17R1.6947 C#CCCCCCNC(=O)c1ccccc1S 99e92b7995d2fecaa630dbdc9eec5812 [0,2,0,0,0,0|1,0,1]=4 9659 B17R1.6947 C#CCCCCOCC(=O)c1ccccc1Br 0cee7d9d31ae6207e33761359d27c6a7 [0,2,0,0,0,0|0,0,2]=4 9660 B17R1.6947 C#CCCCCOCC(=O)c1ccccc1C e77004cb8cf4b778594bdbe1d0db4e4f [0,2,0,0,0,0|0,0,2]=4 9661 B17R1.6947 C#CCCCCOCC(=O)c1ccccc1Cl ba75c326d40697bccf215693a9b6eefc [0,2,0,0,0,0|0,0,2]=4 9662 B17R1.6947 C#CCCCCOCC(=O)c1ccccc1F a25ccdea496df73d68fe59fc52d08cb2 [0,2,0,0,0,0|0,0,2]=4 9663 B17R1.6947 C#CCCCCOCC(=O)c1ccccc1I 7fcf8e701a8698f22370ce47f80fcf0e [0,2,0,0,0,0|0,0,2]=4 9664 B17R1.6947 C/C=C/CCCOCC(=O)c1ccccc1Br cd5f4c9923fa9f48925364612efc97e1 [0,2,0,0,0,0|0,0,2]=4 9665 B17R1.6947 C/C=C/CCCOCC(=O)c1ccccc1C e228940a4224bd04cedf592f8cfe491a [0,2,0,0,0,0|0,0,2]=4 9666 B17R1.6947 C/C=C/CCCOCC(=O)c1ccccc1Cl 6b922dc534ef6bd10216b38a44ca9b30 [0,2,0,0,0,0|0,0,2]=4 9667 B17R1.6947 C/C=C/CCCOCC(=O)c1ccccc1F d2be3b05828d0bc7a8e13cdd4240a142 [0,2,0,0,0,0|0,0,2]=4 9668 B17R1.6947 C/C=C/CCCOCC(=O)c1ccccc1I 3792aae85caf8e3a44f68cb5d1cddf22 [0,2,0,0,0,0|0,0,2]=4 9669 B17R1.6947 C/C=C\CCCOCC(=O)c1ccccc1Br 3de9204a38799e09fadc38bf841c3383 [0,2,0,0,0,0|0,0,2]=4 9670 B17R1.6947 C/C=C\CCCOCC(=O)c1ccccc1C b2c16ee319ba84f563a4e67b2b459976 [0,2,0,0,0,0|0,0,2]=4 9671 B17R1.6947 C/C=C\CCCOCC(=O)c1ccccc1Cl d32a6c05fa62f1ac75b9ba39a5938b4a [0,2,0,0,0,0|0,0,2]=4 9672 B17R1.6947 C/C=C\CCCOCC(=O)c1ccccc1F 38d4ba4acc0163446fec5b04b5c90070 [0,2,0,0,0,0|0,0,2]=4 9673 B17R1.6947 C/C=C\CCCOCC(=O)c1ccccc1I f0ca72dc5a3684f1d26073786de5765d [0,2,0,0,0,0|0,0,2]=4 9674 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1Br e12e0b1fd9ac7d5b07d3dde699f3b7c8 [0,2,0,0,0,0|1,0,1]=4 9675 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1C 802cac8ea48e2b1dfcb6c8e7c38a1181 [0,2,0,0,0,0|1,0,1]=4 9676 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1Cl 635808145843133f3c8f5fb727fa4628 [0,2,0,0,0,0|1,0,1]=4 9677 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1F a2555e163bc9df1e88571198176346e7 [0,2,0,0,0,0|1,0,1]=4 9678 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1I b02ed67cb671bba0379d9ff2768c7960 [0,2,0,0,0,0|1,0,1]=4 9679 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1O dc3eae247de85aee26b06eb70bd73eba [0,2,0,0,0,0|1,0,1]=4 9680 B17R1.6947 C=CCCCCCNC(=O)c1ccccc1S 801995dbb6a9ce467c807f5db4bae7c0 [0,2,0,0,0,0|1,0,1]=4 9681 B17R1.6947 C=CCCCCOCC(=O)c1ccccc1Br 5dbccf2c680bec53cb663b419c566ab3 [0,2,0,0,0,0|0,0,2]=4 9682 B17R1.6947 C=CCCCCOCC(=O)c1ccccc1C 227872e30ac27141239cd6b294067de1 [0,2,0,0,0,0|0,0,2]=4 9683 B17R1.6947 C=CCCCCOCC(=O)c1ccccc1Cl e2b6e7c1ebfc112f7181815c2221e8b3 [0,2,0,0,0,0|0,0,2]=4 9684 B17R1.6947 C=CCCCCOCC(=O)c1ccccc1F 001a49b183a3e35674d180d31f8ae8dd [0,2,0,0,0,0|0,0,2]=4 9685 B17R1.6947 C=CCCCCOCC(=O)c1ccccc1I 2c5a0a93ecb267ff3f1bf55594327532 [0,2,0,0,0,0|0,0,2]=4 9686 B17R1.6947 CC#CCCCOCC(=O)c1ccccc1Br 1b62fcd8518d8113a803c382b0318aff [0,2,0,0,0,0|0,0,2]=4 9687 B17R1.6947 CC#CCCCOCC(=O)c1ccccc1C 1ae9ae76cfc1f45321b4625cd497a005 [0,2,0,0,0,0|0,0,2]=4 9688 B17R1.6947 CC#CCCCOCC(=O)c1ccccc1Cl 881b0da762130e629f639dc10b7dba8a [0,2,0,0,0,0|0,0,2]=4 9689 B17R1.6947 CC#CCCCOCC(=O)c1ccccc1F e981ab0809778345f38f457b5145834e [0,2,0,0,0,0|0,0,2]=4 9690 B17R1.6947 CC#CCCCOCC(=O)c1ccccc1I eb09d2c8fef5acb662be3f3cfcda2bf1 [0,2,0,0,0,0|0,0,2]=4 9691 B17R1.6947 CC/C=C/CCOCC(=O)c1ccccc1Br 3f57940640c439e79b223e3e4b54c313 [0,2,0,0,0,0|0,0,2]=4 9692 B17R1.6947 CC/C=C/CCOCC(=O)c1ccccc1C 97c665406d23689edb845187b6708e3b [0,2,0,0,0,0|0,0,2]=4 9693 B17R1.6947 CC/C=C/CCOCC(=O)c1ccccc1Cl 7a250e40a361eb6b7030695e9cf45226 [0,2,0,0,0,0|0,0,2]=4 9694 B17R1.6947 CC/C=C/CCOCC(=O)c1ccccc1F 041096413828fa50753a1e8697fca5ee [0,2,0,0,0,0|0,0,2]=4 9695 B17R1.6947 CC/C=C/CCOCC(=O)c1ccccc1I c2d7840a3959175ee9802cdf4748a050 [0,2,0,0,0,0|0,0,2]=4 9696 B17R1.6947 CC/C=C\CCOCC(=O)c1ccccc1Br ecc236b7de351c9955106c167a8db0e6 [0,2,0,0,0,0|0,0,2]=4 9697 B17R1.6947 CC/C=C\CCOCC(=O)c1ccccc1C b826a6eb765162be29f67d60be72ceeb [0,2,0,0,0,0|0,0,2]=4 9698 B17R1.6947 CC/C=C\CCOCC(=O)c1ccccc1Cl 6e3aba35842bb036105a95aff4773dab [0,2,0,0,0,0|0,0,2]=4 9699 B17R1.6947 CC/C=C\CCOCC(=O)c1ccccc1F b79fb3fffda618c5e2830dd830918ddb [0,2,0,0,0,0|0,0,2]=4 9700 B17R1.6947 CC/C=C\CCOCC(=O)c1ccccc1I cd59167c9fbed324d7bdf6c38a5765bf [0,2,0,0,0,0|0,0,2]=4 9701 B17R1.6947 CC=CCCCOCC(=O)c1ccccc1Br 692884a62c3ccb1497a883a5e0b83a00 [0,2,0,0,0,0|0,0,2]=4 9702 B17R1.6947 CC=CCCCOCC(=O)c1ccccc1C 5db3a5c291c653b1387b4a26f39e584b [0,2,0,0,0,0|0,0,2]=4 9703 B17R1.6947 CC=CCCCOCC(=O)c1ccccc1Cl ec8688302ea81da7fce618fb8bd29379 [0,2,0,0,0,0|0,0,2]=4 9704 B17R1.6947 CC=CCCCOCC(=O)c1ccccc1F 422cb83b07130ce52c2f96be898d144e [0,2,0,0,0,0|0,0,2]=4 9705 B17R1.6947 CC=CCCCOCC(=O)c1ccccc1I 8f00c695b4f0f149adf03a3ac3047f09 [0,2,0,0,0,0|0,0,2]=4 9706 B17R1.6947 CCC#CCCOCC(=O)c1ccccc1C ec06822c4108d02835cce6455cf8ccb8 [0,2,0,0,0,0|0,0,2]=4 9707 B17R1.6947 CCC#CCCOCC(=O)c1ccccc1F a88b8dfe2b507ab5f8abc52e802f6bce [0,2,0,0,0,0|0,0,2]=4 9708 B17R1.6947 CCC#CCCOCC(=O)c1ccccc1I fa8b2bddf171f8a1ab1e3763a5f48e54 [0,2,0,0,0,0|0,0,2]=4 9709 B17R1.6947 CCC/C=C/COCC(=O)c1ccccc1Br 15253976837a219c4042fe16ed56b25f [0,2,0,0,0,0|0,0,2]=4 9710 B17R1.6947 CCC/C=C/COCC(=O)c1ccccc1C c86953afa21658deee32f2289e208439 [0,2,0,0,0,0|0,0,2]=4 9711 B17R1.6947 CCC/C=C/COCC(=O)c1ccccc1Cl b3be3e803eeba6d7abba82034de42a46 [0,2,0,0,0,0|0,0,2]=4 9712 B17R1.6947 CCC/C=C/COCC(=O)c1ccccc1F b2b9789a7daf2800a08f3a6f76ce47af [0,2,0,0,0,0|0,0,2]=4 9713 B17R1.6947 CCC/C=C/COCC(=O)c1ccccc1I dd4420d7025f97afd126da8614e3eab8 [0,2,0,0,0,0|0,0,2]=4 9714 B17R1.6947 CCC/C=C\COCC(=O)c1ccccc1Br aae79a301829193d5eb863b1daa47fe8 [0,2,0,0,0,0|0,0,2]=4 9715 B17R1.6947 CCC/C=C\COCC(=O)c1ccccc1C 874300ec2adef56c55a46d1ec2144ba3 [0,2,0,0,0,0|0,0,2]=4 9716 B17R1.6947 CCC/C=C\COCC(=O)c1ccccc1Cl 5dd536f33a242ac3ec73b2bbc573b99d [0,2,0,0,0,0|0,0,2]=4 9717 B17R1.6947 CCC/C=C\COCC(=O)c1ccccc1F 0d3041258a09e521e8ec2c6008db8945 [0,2,0,0,0,0|0,0,2]=4 9718 B17R1.6947 CCC/C=C\COCC(=O)c1ccccc1I eeac558c8791afe6a471b506e2ae09a1 [0,2,0,0,0,0|0,0,2]=4 9719 B17R1.6947 CCCC#CCOCC(=O)c1ccccc1C 7aaeb01b61503329eef98e5950cc6339 [0,2,0,0,0,0|0,0,2]=4 9720 B17R1.6947 CCCC#CCOCC(=O)c1ccccc1F 7d78ca93bb72386961bc940d6dc7f614 [0,2,0,0,0,0|0,0,2]=4 9721 B17R1.6947 CCCC#CCOCC(=O)c1ccccc1I a829e39944ffef12c0be19f1929c3fc4 [0,2,0,0,0,0|0,0,2]=4 9722 B17R1.6947 CCCCCCCNC(=O)c1cccc[n+]1[O-] f86403a1135904bdfd473cc762a6c563 [0,2,0,0,0,0|2,0,0]=4 9723 B17R1.6947 CCCCCCCNC(=O)c1ccccc1Br 7fa9267df6996e05aea5cbd9d4a47b6f [0,2,0,0,0,0|1,0,0]=3 9724 B17R1.6947 CCCCCCCNC(=O)c1ccccc1C 5df1d95b65efb4d8bcbc59f6dc8c7e5a [0,2,0,0,0,0|1,0,0]=3 9725 B17R1.6947 CCCCCCCNC(=O)c1ccccc1Cl 82fcab1fee689943f69dfc73687f7295 [0,2,0,0,0,0|1,0,0]=3 9726 B17R1.6947 CCCCCCCNC(=O)c1ccccc1F 372511f357604b0fe7aea56171675559 [0,2,0,0,0,0|1,0,0]=3 9727 B17R1.6947 CCCCCCCNC(=O)c1ccccc1I 328420ab145afd789cc1e75f8ee36bd9 [0,2,0,0,0,0|1,0,0]=3 9728 B17R1.6947 CCCCCCCNC(=O)c1ccccc1O e148328fe49a7d8d5d907996eb1fdd8a [0,2,0,0,0,0|1,0,0]=3 9729 B17R1.6947 CCCCCCCNC(=O)c1ccccc1S 1675de78b30bb6a1efeea48d21c8a7cd [0,2,0,0,0,0|1,0,0]=3 9730 B17R1.6947 CCCCCCCNC(=O)c1cccnc1Br 685f2deec5c134f400c20c2d6d15e07c [0,2,0,0,0,0|2,0,0]=4 9731 B17R1.6947 CCCCCCCNC(=O)c1cccnc1C 0296f3a7ad29c53da8d9cca2be246ca8 [0,2,0,0,0,0|2,0,0]=4 9732 B17R1.6947 CCCCCCCNC(=O)c1cccnc1Cl ff798e9e139994849b00e593f75fb646 [0,2,0,0,0,0|2,0,0]=4 9733 B17R1.6947 CCCCCCCNC(=O)c1cccnc1F a53beefc4746bf190d2934f1f47f3c7a [0,2,0,0,0,0|2,0,0]=4 9734 B17R1.6947 CCCCCCCNC(=O)c1cccnc1I ee1229615b67cb58b8c28c5ac39c31ed [0,2,0,0,0,0|2,0,0]=4 9735 B17R1.6947 CCCCCCCNC(=O)c1cccnc1O 33f3a3e1b66fb9149c61519225e48e33 [0,2,0,0,0,0|2,0,0]=4 9736 B17R1.6947 CCCCCCCNC(=O)c1cccnc1S 50dea75b9cffcd223f30a7abb5e1dd82 [0,2,0,0,0,0|2,0,0]=4 9737 B17R1.6947 CCCCCCCNC(=O)c1ccncc1Br 09569467d9c899d0149db56446fa8bce [0,2,0,0,0,0|2,0,0]=4 9738 B17R1.6947 CCCCCCCNC(=O)c1ccncc1C 921dd9bd6f7767b4efc7695d8b311bee [0,2,0,0,0,0|2,0,0]=4 9739 B17R1.6947 CCCCCCCNC(=O)c1ccncc1Cl 0940ddd5284f1ff627bc17f97e0b1c01 [0,2,0,0,0,0|2,0,0]=4 9740 B17R1.6947 CCCCCCCNC(=O)c1ccncc1F c5dd160f94e248dac225473ef8dfd1bc [0,2,0,0,0,0|2,0,0]=4 9741 B17R1.6947 CCCCCCCNC(=O)c1ccncc1I 944dcb1335e2e2bd383b5e45e75b893d [0,2,0,0,0,0|2,0,0]=4 9742 B17R1.6947 CCCCCCCNC(=O)c1ccncc1O 47a9c4ae3125f7cd34e21ec38a46afe9 [0,2,0,0,0,0|2,0,0]=4 9743 B17R1.6947 CCCCCCCNC(=O)c1cnccc1Br dbf2cc0eafadf6b23b04762c900de9bb [0,2,0,0,0,0|2,0,0]=4 9744 B17R1.6947 CCCCCCCNC(=O)c1cnccc1C 0c762ff755ad64ae8721fa9504e0637f [0,2,0,0,0,0|2,0,0]=4 9745 B17R1.6947 CCCCCCCNC(=O)c1cnccc1Cl 8bf0c6d41166d45852011f81d8351ef7 [0,2,0,0,0,0|2,0,0]=4 9746 B17R1.6947 CCCCCCCNC(=O)c1cnccc1F 32d2bc4225ce83c829e245a3ae7153e6 [0,2,0,0,0,0|2,0,0]=4 9747 B17R1.6947 CCCCCCCNC(=O)c1cnccc1O a15287db5926de5fe862ec80ccfbe6ca [0,2,0,0,0,0|2,0,0]=4 9748 B17R1.6947 CCCCCCCNC(=O)c1ncccc1Br d2bc51a0a88f5bbbec63f4d580fcd0da [0,2,0,0,0,0|2,0,0]=4 9749 B17R1.6947 CCCCCCCNC(=O)c1ncccc1C 3c3a4f49d04e59637fde743e7e47576c [0,2,0,0,0,0|2,0,0]=4 9750 B17R1.6947 CCCCCCCNC(=O)c1ncccc1Cl eb15597c650f025a209fffa000816d55 [0,2,0,0,0,0|2,0,0]=4 9751 B17R1.6947 CCCCCCCNC(=O)c1ncccc1F 0835a943442d9a8bc43857e4da9f09e2 [0,2,0,0,0,0|2,0,0]=4 9752 B17R1.6947 CCCCCCCNC(=O)c1ncccc1I f3e4d61af3a46e2ae4900fd5f31ab319 [0,2,0,0,0,0|2,0,0]=4 9753 B17R1.6947 CCCCCCCNC(=O)c1ncccc1O 1429f567fd0b108493fda557f15bab01 [0,2,0,0,0,0|2,0,0]=4 9754 B17R1.6947 CCCCCCCOC(C)c1ccccc1F 0907ed219b6dd95a5701fa08b72ae0c6 [0,2,0,0,0,0|1,0,1]=4 9755 B17R1.6947 CCCCCCCO[C@@H](C)c1ccccc1F 5288868db13815600cfd702caf3a8f03 [0,2,0,0,0,0|1,0,1]=4 9756 B17R1.6947 CCCCCCCO[C@H](C)c1ccccc1F b6e1c1ae0b2cfe2bb29d726c0afe697b [0,2,0,0,0,0|1,0,1]=4 9757 B17R1.6947 CCCCCCNCC(=O)c1ccccc1C 579b8742ab6b80ef24706eaa333dff79 [0,2,0,0,0,0|1,0,0]=3 9758 B17R1.6947 CCCCCCNCC(=O)c1ccccc1Cl 255d8e8ba7fe46e1ef23e77c2a33ae88 [0,2,0,0,0,0|1,0,0]=3 9759 B17R1.6947 CCCCCCNCC(=O)c1ccccc1F b59c65b2c3ba22a6fedca250f2b906c0 [0,2,0,0,0,0|1,0,0]=3 9760 B17R1.6947 CCCCCCNCC(=O)c1ccccc1I a368d1201f42c8eb18877839d6039f7a [0,2,0,0,0,0|1,0,0]=3 9761 B17R1.6947 CCCCCCNCC(=O)c1cccnc1Cl 94930a0c403fce03735b660a257e3ee2 [0,2,0,0,0,0|2,0,0]=4 9762 B17R1.6947 CCCCCCNCC(=O)c1ncccc1C f298fc5d47ee8ecd3c3fec7ee97ab42c [0,2,0,0,0,0|2,0,0]=4 9763 B17R1.6947 CCCCCCNCC(=O)c1ncccc1F 6da8297fd66c53095e44118d5424d75a [0,2,0,0,0,0|2,0,0]=4 9764 B17R1.6947 CCCCCCOCC(=O)c1ccccc1C 623b2dc94d959ba687891caace756938 [0,2,0,0,0,0|0,0,0]=2 9765 B17R1.6947 CCCCCCOCC(=O)c1ccccc1Cl d8243207d6241ba86fa16643fc58d8a1 [0,2,0,0,0,0|0,0,0]=2 9766 B17R1.6947 CCCCCCOCC(=O)c1ccccc1F 3783dc54075c19d8349d580dc9d896e3 [0,2,0,0,0,0|0,0,0]=2 9767 B17R1.6947 CCCCCCOCC(=O)c1ccccc1I 84a6ec1d90bcf626e02777671981158b [0,2,0,0,0,0|0,0,0]=2 9768 B17R1.6947 CCCCCCOCC(=O)c1cccnc1Cl 454492e4820dc6b9a570e80feacd0832 [0,2,0,0,0,0|1,0,0]=3 9769 B17R1.6947 CCCCCCOCC(=O)c1ncccc1F f7a0cc46806a2f63dd58d8de2b176cba [0,2,0,0,0,0|1,0,0]=3 9770 B17R1.6947 CCCCNCCCC(=O)c1ccccc1F c247bdccbaea3fbf105506832178c8a7 [0,2,0,0,0,0|1,0,0]=3 9771 B17R1.6947 CCCCNCCNC(=O)c1ccccc1Cl 2f4ac0c3e4d1ec463c1d32dd99eafc93 [0,2,0,0,0,0|1,0,0]=3 9772 B17R1.6947 CCCCNCCNC(=O)c1ccccc1F 20417e96adf57a9ceac2a1a9769825a7 [0,2,0,0,0,0|1,0,0]=3 9773 B17R1.6947 CCCCNCCNC(=O)c1ccccc1I d297b6ff01b5a9fb63e3454eed8e85d4 [0,2,0,0,0,0|1,0,0]=3 9774 B17R1.6947 CCCCOCCNC(=O)c1cccc[n+]1[O-] 3c139e1aa3b09690eef6beb8fd8bb02a [0,2,0,0,0,0|2,0,0]=4 9775 B17R1.6947 CCCCOCCNC(=O)c1ccccc1Br ad1769debda4fee90e34327015a0f9b4 [0,2,0,0,0,0|1,0,0]=3 9776 B17R1.6947 CCCCOCCNC(=O)c1ccccc1C 83d562e0a8d20a026c209521fe758e1e [0,2,0,0,0,0|1,0,0]=3 9777 B17R1.6947 CCCCOCCNC(=O)c1ccccc1Cl 54ae26142934c5cda0876c956d0383a2 [0,2,0,0,0,0|1,0,0]=3 9778 B17R1.6947 CCCCOCCNC(=O)c1ccccc1F ffc01a6019bab7761c389e922346256a [0,2,0,0,0,0|1,0,0]=3 9779 B17R1.6947 CCCCOCCNC(=O)c1ccccc1I 871ab184a14e8a8a788ede31411ec9cd [0,2,0,0,0,0|1,0,0]=3 9780 B17R1.6947 CCCCOCCNC(=O)c1ccccc1O 10396645fd953cabe2c21b001887db2e [0,2,0,0,0,0|1,0,0]=3 9781 B17R1.6947 CCCCOCCNC(=O)c1ccccc1S c93b59dea63115394a772a92d744f63d [0,2,0,0,0,0|1,0,0]=3 9782 B17R1.6947 CCCCOCCNC(=O)c1cccnc1Br 830c65deff45abdc59a96b87f836ddbb [0,2,0,0,0,0|2,0,0]=4 9783 B17R1.6947 CCCCOCCNC(=O)c1cccnc1C 43eb0c29c6c165b865996880c7eec95d [0,2,0,0,0,0|2,0,0]=4 9784 B17R1.6947 CCCCOCCNC(=O)c1cccnc1Cl 0fed3ec1a5053f8856a0e477704c1369 [0,2,0,0,0,0|2,0,0]=4 9785 B17R1.6947 CCCCOCCNC(=O)c1cccnc1F 20daa49c1e9b95f7aaf8b57248533792 [0,2,0,0,0,0|2,0,0]=4 9786 B17R1.6947 CCCCOCCNC(=O)c1cccnc1I 3c296c16d6117872f047b9ee8c00a2bd [0,2,0,0,0,0|2,0,0]=4 9787 B17R1.6947 CCCCOCCNC(=O)c1cccnc1O 2b7cee6616af60b43f619f3dc155cb48 [0,2,0,0,0,0|2,0,0]=4 9788 B17R1.6947 CCCCOCCNC(=O)c1cccnc1S aa55c0e2de664c1616914c31a09a58ca [0,2,0,0,0,0|2,0,0]=4 9789 B17R1.6947 CCCCOCCNC(=O)c1ccncc1Br 41adefbf354e010002309a21a474500f [0,2,0,0,0,0|2,0,0]=4 9790 B17R1.6947 CCCCOCCNC(=O)c1ccncc1C 009998ab1394d7648d5623a07b6727c9 [0,2,0,0,0,0|2,0,0]=4 9791 B17R1.6947 CCCCOCCNC(=O)c1ccncc1Cl 0e3e198914f108038278696bc6287992 [0,2,0,0,0,0|2,0,0]=4 9792 B17R1.6947 CCCCOCCNC(=O)c1ccncc1F 6a44e9c5ea34961176c092ce71112a70 [0,2,0,0,0,0|2,0,0]=4 9793 B17R1.6947 CCCCOCCNC(=O)c1ccncc1I 088c50a7fa1662acf0e907b2920952aa [0,2,0,0,0,0|2,0,0]=4 9794 B17R1.6947 CCCCOCCNC(=O)c1ccncc1O 3e70e2bb2400edb21a89023fb31b3965 [0,2,0,0,0,0|2,0,0]=4 9795 B17R1.6947 CCCCOCCNC(=O)c1cnccc1Br 1e8df27288af91fcff476061434129fa [0,2,0,0,0,0|2,0,0]=4 9796 B17R1.6947 CCCCOCCNC(=O)c1cnccc1C 152056e7aeba1015b7994aded8feb544 [0,2,0,0,0,0|2,0,0]=4 9797 B17R1.6947 CCCCOCCNC(=O)c1cnccc1Cl de3047a5a9b7e776f1620979eb0d61b6 [0,2,0,0,0,0|2,0,0]=4 9798 B17R1.6947 CCCCOCCNC(=O)c1cnccc1F a8b661bd6dfb8df6fa760f36093ae35f [0,2,0,0,0,0|2,0,0]=4 9799 B17R1.6947 CCCCOCCNC(=O)c1cnccc1O e932bd7361ce07c4afc7d51ea8d91e36 [0,2,0,0,0,0|2,0,0]=4 9800 B17R1.6947 CCCCOCCNC(=O)c1ncccc1Br 2a7923c3b3a703beff2eeda531ad2df9 [0,2,0,0,0,0|2,0,0]=4 9801 B17R1.6947 CCCCOCCNC(=O)c1ncccc1C b1f3247f0d17bbd8c99ccf823c8fda7e [0,2,0,0,0,0|2,0,0]=4 9802 B17R1.6947 CCCCOCCNC(=O)c1ncccc1Cl e28cba70255cafcf88fcc718b1b31d90 [0,2,0,0,0,0|2,0,0]=4 9803 B17R1.6947 CCCCOCCNC(=O)c1ncccc1F 2f4ae8c8a84ec66fe4a8325f7f8d8d3b [0,2,0,0,0,0|2,0,0]=4 9804 B17R1.6947 CCCCOCCNC(=O)c1ncccc1I d118dfd318f343b316ad24e7bb6fd813 [0,2,0,0,0,0|2,0,0]=4 9805 B17R1.6947 CCCCOCCNC(=O)c1ncccc1O 40560d7650f805d2c93fae6108f2331d [0,2,0,0,0,0|2,0,0]=4 9806 B17R1.6947 CCCCOCCOC(C)c1ccccc1Br 26d674de606143b742069ef6e8e690a5 [0,2,0,0,0,0|1,0,1]=4 9807 B17R1.6947 CCCCOCCOC(C)c1ccccc1C 79513e6eeb4555b7701b7e01b4d1efbe [0,2,0,0,0,0|1,0,1]=4 9808 B17R1.6947 CCCCOCCOC(C)c1ccccc1Cl 7aae018a5cbf90d1bf58bb317a72aa26 [0,2,0,0,0,0|1,0,1]=4 9809 B17R1.6947 CCCCOCCOC(C)c1ccccc1F 7fdd324494d408d1586fd8350b6146b7 [0,2,0,0,0,0|1,0,1]=4 9810 B17R1.6947 CCCCOCCOC(C)c1ccccc1I a71d9e40069c82666e66cb7a746280c1 [0,2,0,0,0,0|1,0,1]=4 9811 B17R1.6947 CCCCOCCO[C@@H](C)c1ccccc1Br 1825e83a53b38f069ce32951372a9fd5 [0,2,0,0,0,0|1,0,1]=4 9812 B17R1.6947 CCCCOCCO[C@@H](C)c1ccccc1C 4967a6346ee64b2fd43c41cbbf1391b1 [0,2,0,0,0,0|1,0,1]=4 9813 B17R1.6947 CCCCOCCO[C@@H](C)c1ccccc1Cl 022e51693736831a113b876c50c4fe08 [0,2,0,0,0,0|1,0,1]=4 9814 B17R1.6947 CCCCOCCO[C@@H](C)c1ccccc1F 8a5cd5b1e6c47135f49a680150e84d05 [0,2,0,0,0,0|1,0,1]=4 9815 B17R1.6947 CCCCOCCO[C@H](C)c1ccccc1Br bd41da62d1780ddad139ed79f458a3d4 [0,2,0,0,0,0|1,0,1]=4 9816 B17R1.6947 CCCCOCCO[C@H](C)c1ccccc1Cl 7382f2902a186d2ee8691250cb0b337e [0,2,0,0,0,0|1,0,1]=4 9817 B17R1.6947 CCCCOCCO[C@H](C)c1ccccc1F b0379bc86213c7dc99704c1ca47aedfa [0,2,0,0,0,0|1,0,1]=4 9818 B17R1.6947 CCCCOCOCC(=O)c1ccccc1Cl fde904ae86588c91775d5ff4a61b4168 [0,2,0,0,0,0|1,0,0]=3 9819 B17R1.6947 CCCCOCOCC(=O)c1ccccc1F 1f6f049cb5e90e8f72e1b148b8e2c003 [0,2,0,0,0,0|1,0,0]=3 9820 B17R1.6947 CCCOCCCNC(=O)c1cccc[n+]1[O-] 03b70cafa38b0ec9be8b3aa1d29960b3 [0,2,0,0,0,0|2,0,0]=4 9821 B17R1.6947 CCCOCCCNC(=O)c1ccccc1Br 546ca21f431a1fe229d29189f3a4e90c [0,2,0,0,0,0|1,0,0]=3 9822 B17R1.6947 CCCOCCCNC(=O)c1ccccc1C affc6af751b1a13aa0750e7b457a520a [0,2,0,0,0,0|1,0,0]=3 9823 B17R1.6947 CCCOCCCNC(=O)c1ccccc1Cl 3b60ac8c231d42f383551d69a128a8b9 [0,2,0,0,0,0|1,0,0]=3 9824 B17R1.6947 CCCOCCCNC(=O)c1ccccc1F 979d545c3b4bca8506a05d6ea8b3d030 [0,2,0,0,0,0|1,0,0]=3 9825 B17R1.6947 CCCOCCCNC(=O)c1ccccc1I 1dfe926a382410d230ebd0596a7f50c8 [0,2,0,0,0,0|1,0,0]=3 9826 B17R1.6947 CCCOCCCNC(=O)c1ccccc1O 46cc4cfa6ef4b3693266b37b0f307961 [0,2,0,0,0,0|1,0,0]=3 9827 B17R1.6947 CCCOCCCNC(=O)c1ccccc1S 5b8ec9dde1da1da62c15a215c20217cf [0,2,0,0,0,0|1,0,0]=3 9828 B17R1.6947 CCCOCCCNC(=O)c1cccnc1Br 6812667b0afae16426a24dedcc827b7c [0,2,0,0,0,0|2,0,0]=4 9829 B17R1.6947 CCCOCCCNC(=O)c1cccnc1C a39a95dda7c0898f568c50e9d4213e24 [0,2,0,0,0,0|2,0,0]=4 9830 B17R1.6947 CCCOCCCNC(=O)c1cccnc1Cl 1873c787f3f4f6e2e0b0e5eada91c950 [0,2,0,0,0,0|2,0,0]=4 9831 B17R1.6947 CCCOCCCNC(=O)c1cccnc1F e083f2680b1a787ebe9c65ac01fd8bc7 [0,2,0,0,0,0|2,0,0]=4 9832 B17R1.6947 CCCOCCCNC(=O)c1cccnc1I 63ec864d5d4b26f139c3b4b0c10c7292 [0,2,0,0,0,0|2,0,0]=4 9833 B17R1.6947 CCCOCCCNC(=O)c1cccnc1O 47a685b7d43cf228ef21b7b1abd4fae6 [0,2,0,0,0,0|2,0,0]=4 9834 B17R1.6947 CCCOCCCNC(=O)c1cccnc1S fbbae09e01c251f6b87897c2d4915b0c [0,2,0,0,0,0|2,0,0]=4 9835 B17R1.6947 CCCOCCCNC(=O)c1ccncc1Br 5743c24426aa391f321295df68b9c303 [0,2,0,0,0,0|2,0,0]=4 9836 B17R1.6947 CCCOCCCNC(=O)c1ccncc1C d5eb8f01c906caf89ad8a09cb28a4161 [0,2,0,0,0,0|2,0,0]=4 9837 B17R1.6947 CCCOCCCNC(=O)c1ccncc1Cl 295d094315cbf355897bba2eeabb6fa8 [0,2,0,0,0,0|2,0,0]=4 9838 B17R1.6947 CCCOCCCNC(=O)c1ccncc1F 04a06ac7c905cfb260575d08a145075f [0,2,0,0,0,0|2,0,0]=4 9839 B17R1.6947 CCCOCCCNC(=O)c1ccncc1I 0ba2661b7d097d4dded1d988a425e7a6 [0,2,0,0,0,0|2,0,0]=4 9840 B17R1.6947 CCCOCCCNC(=O)c1ccncc1O 9ab6d432969f637eff273ff5637eadf9 [0,2,0,0,0,0|2,0,0]=4 9841 B17R1.6947 CCCOCCCNC(=O)c1cnccc1Br c06460bf2b5de0d8b554ecebdf9697f5 [0,2,0,0,0,0|2,0,0]=4 9842 B17R1.6947 CCCOCCCNC(=O)c1cnccc1C af9b0d180af2749d07542607b48b74ce [0,2,0,0,0,0|2,0,0]=4 9843 B17R1.6947 CCCOCCCNC(=O)c1cnccc1Cl 78d0982750db35f4e07ca1548e864442 [0,2,0,0,0,0|2,0,0]=4 9844 B17R1.6947 CCCOCCCNC(=O)c1cnccc1F 3c358e76a6573060148e9821332f3b2d [0,2,0,0,0,0|2,0,0]=4 9845 B17R1.6947 CCCOCCCNC(=O)c1cnccc1O 5f768ec71d9d6bd4ea8a3f3d4f4e921e [0,2,0,0,0,0|2,0,0]=4 9846 B17R1.6947 CCCOCCCNC(=O)c1ncccc1Br 788d7fbd9a8b6d35ba3826d9bb8a118e [0,2,0,0,0,0|2,0,0]=4 9847 B17R1.6947 CCCOCCCNC(=O)c1ncccc1C 03610b78a0bc09d840027d1686873397 [0,2,0,0,0,0|2,0,0]=4 9848 B17R1.6947 CCCOCCCNC(=O)c1ncccc1Cl 56bed3eb79009586da11e176251d3d5d [0,2,0,0,0,0|2,0,0]=4 9849 B17R1.6947 CCCOCCCNC(=O)c1ncccc1F 148890ad18fb34ca761efd51ad21f576 [0,2,0,0,0,0|2,0,0]=4 9850 B17R1.6947 CCCOCCCNC(=O)c1ncccc1I ee42305b0195ff26010a6778fd5d9c82 [0,2,0,0,0,0|2,0,0]=4 9851 B17R1.6947 CCCOCCCNC(=O)c1ncccc1O d591723bdcccde3d384452bb35490177 [0,2,0,0,0,0|2,0,0]=4 9852 B17R1.6947 CCCOCCCOC(C)c1ccccc1C 79fe04299305449b142fa2970b9ac099 [0,2,0,0,0,0|1,0,1]=4 9853 B17R1.6947 CCCOCCCOC(C)c1ccccc1Cl 4c4fe251108ebf4adca364fee1c12237 [0,2,0,0,0,0|1,0,1]=4 9854 B17R1.6947 CCCOCCCOC(C)c1ccccc1F bb5a3a59b16b732db98d77cb1b693795 [0,2,0,0,0,0|1,0,1]=4 9855 B17R1.6947 CCCOCCCOC(C)c1ccccc1I 2dab0773da1aa955c3791cff83e98840 [0,2,0,0,0,0|1,0,1]=4 9856 B17R1.6947 CCCOCCCO[C@@H](C)c1ccccc1C 672ab0977276f49c1e3ab28e64ae5d2e [0,2,0,0,0,0|1,0,1]=4 9857 B17R1.6947 CCCOCCCO[C@@H](C)c1ccccc1Cl 42d600cf6ff49f8bf821cc9fb7bf7e98 [0,2,0,0,0,0|1,0,1]=4 9858 B17R1.6947 CCCOCCCO[C@@H](C)c1ccccc1F a4c62308433ab4471c340650080491e0 [0,2,0,0,0,0|1,0,1]=4 9859 B17R1.6947 CCCOCCCO[C@H](C)c1ccccc1Cl a620d1cb25e66c25a6806e501247bb3f [0,2,0,0,0,0|1,0,1]=4 9860 B17R1.6947 CCCOCCCO[C@H](C)c1ccccc1F 64d0a8b1ee46de049a0f4e88db52195d [0,2,0,0,0,0|1,0,1]=4 9861 B17R1.6947 CCCOCCNCC(=O)c1ccccc1C 482e3f5bdd7dcd16bdae734f66b2add7 [0,2,0,0,0,0|2,0,0]=4 9862 B17R1.6947 CCCOCCNCC(=O)c1ccccc1Cl 6483a93d9a40f886e2c648b7c9c2fe14 [0,2,0,0,0,0|2,0,0]=4 9863 B17R1.6947 CCCOCCNCC(=O)c1ccccc1F 3b7a2c094496f764a553a668fb3e3cf8 [0,2,0,0,0,0|2,0,0]=4 9864 B17R1.6947 CCCOCCNCC(=O)c1ccccc1I 74e37d1e9e55e3fc06fbdb96b897962b [0,2,0,0,0,0|2,0,0]=4 9865 B17R1.6947 CCCOCCOCC(=O)c1ccccc1Br 86f633250f2084da1cca5472ee8db43e [0,2,0,0,0,0|1,0,0]=3 9866 B17R1.6947 CCCOCCOCC(=O)c1ccccc1C 263c60f77e999779d20b23b589242e03 [0,2,0,0,0,0|1,0,0]=3 9867 B17R1.6947 CCCOCCOCC(=O)c1ccccc1Cl 780c3b5c1be9d94cda985cd87a968429 [0,2,0,0,0,0|1,0,0]=3 9868 B17R1.6947 CCCOCCOCC(=O)c1ccccc1F a0308c4287f02f80265e746aaa3adc18 [0,2,0,0,0,0|1,0,0]=3 9869 B17R1.6947 CCCOCCOCC(=O)c1ccccc1I b67993a4d15f090aa0321d14c4b8ee0c [0,2,0,0,0,0|1,0,0]=3 9870 B17R1.6947 CCCOCCOCC(=O)c1cccnc1Cl 45bf7960b00d538e6e12b7f5580334a9 [0,2,0,0,0,0|2,0,0]=4 9871 B17R1.6947 CCCOCCOCC(=O)c1ncccc1C bd30fa0aff9056f546ea87f0373f372c [0,2,0,0,0,0|2,0,0]=4 9872 B17R1.6947 CCCOCCOCC(=O)c1ncccc1F 51f507e38c0b45297c74b7854b20ddea [0,2,0,0,0,0|2,0,0]=4 9873 B17R1.6947 CCCSCCOCC(=O)c1ccccc1C 8b0fe54dffba44e73a64e245755ed31c [0,2,0,0,0,0|1,0,0]=3 9874 B17R1.6947 CCCSCCOCC(=O)c1ccccc1Cl fae4aac282539f813fb6f6573ef76e1c [0,2,0,0,0,0|1,0,0]=3 9875 B17R1.6947 CCCSCCOCC(=O)c1ccccc1F 50dbf448bd3158f4758a2060732390c9 [0,2,0,0,0,0|1,0,0]=3 9876 B17R1.6947 CCCSCCOCC(=O)c1ccccc1I e93a72b1c15874bd02cfebebc7923175 [0,2,0,0,0,0|1,0,0]=3 9877 B17R1.6947 CCCSCCOCC(=O)c1cccnc1Cl 774019ab3246470c4c16f3e4190456e0 [0,2,0,0,0,0|2,0,0]=4 9878 B17R1.6947 CCCSCCOCC(=O)c1ncccc1F 0e5c16aecfacc9175a493e992771ac8f [0,2,0,0,0,0|2,0,0]=4 9879 B17R1.6947 CCOCCCNCC(=O)c1ccccc1I 673e8c1e8b73433d93e2c876c9d2f357 [0,2,0,0,0,0|2,0,0]=4 9880 B17R1.6947 CCOCCCOCC(=O)c1ccccc1Br d424d34dab8e3dbfe31c9aa670e98b29 [0,2,0,0,0,0|1,0,0]=3 9881 B17R1.6947 CCOCCCOCC(=O)c1ccccc1Cl 62a802502a78d0fb0fde405136b88a5d [0,2,0,0,0,0|1,0,0]=3 9882 B17R1.6947 CCOCCCOCC(=O)c1ccccc1F 62896ffde20b66aac5095719ed1fdfbb [0,2,0,0,0,0|1,0,0]=3 9883 B17R1.6947 CCOCCCOCC(=O)c1cccnc1Cl 9a474eb2dc2f0c9899070b1dce086e07 [0,2,0,0,0,0|2,0,0]=4 9884 B17R1.6947 CCOCCCOCC(=O)c1ncccc1F 0bdea023b4319f2a90208374193f5df9 [0,2,0,0,0,0|2,0,0]=4 9885 B17R1.6947 CCOCCOCCC(=O)c1ccccc1F 02c3f3092b84df7196d88b48b547e743 [0,2,0,0,0,0|2,0,0]=4 9886 B17R1.6947 CCOCNCCNC(=O)c1ccccc1Cl efe3676cfff4b926e730536170e24be0 [0,2,0,0,0,0|2,0,0]=4 9887 B17R1.6947 CCOCNCCNC(=O)c1ccccc1F 46370df192d4966c059487740c565d4d [0,2,0,0,0,0|2,0,0]=4 9888 B17R1.6947 CCSCCCCNC(=O)c1cccc[n+]1[O-] b32193b5d19baf8e78f5fb3e37494ba2 [0,2,0,0,0,0|2,0,0]=4 9889 B17R1.6947 CCSCCCCNC(=O)c1ccccc1Br 3e7f97dc2ae96dbf89cbb967b9524cf3 [0,2,0,0,0,0|1,0,0]=3 9890 B17R1.6947 CCSCCCCNC(=O)c1ccccc1C 12f8f27d93ace1e43cd163b42428c764 [0,2,0,0,0,0|1,0,0]=3 9891 B17R1.6947 CCSCCCCNC(=O)c1ccccc1Cl 1de578d03eee914d3a9ccd1e9e1e6234 [0,2,0,0,0,0|1,0,0]=3 9892 B17R1.6947 CCSCCCCNC(=O)c1ccccc1F 5dcc89e30ba5b084977dba0e1691fbc0 [0,2,0,0,0,0|1,0,0]=3 9893 B17R1.6947 CCSCCCCNC(=O)c1ccccc1I 24756b7eb83fa68e09e165fbac22655c [0,2,0,0,0,0|1,0,0]=3 9894 B17R1.6947 CCSCCCCNC(=O)c1ccccc1O e6290af86061dbea1cb0882ca084de78 [0,2,0,0,0,0|1,0,0]=3 9895 B17R1.6947 CCSCCCCNC(=O)c1ccccc1S de6cdbed889505d731c87f2be25a6621 [0,2,0,0,0,0|1,0,0]=3 9896 B17R1.6947 CCSCCCCNC(=O)c1cccnc1Br 221cd42857215857d2b408d0e3f3f03c [0,2,0,0,0,0|2,0,0]=4 9897 B17R1.6947 CCSCCCCNC(=O)c1cccnc1C c242f1bf3988a4d10d092ae382c86b28 [0,2,0,0,0,0|2,0,0]=4 9898 B17R1.6947 CCSCCCCNC(=O)c1cccnc1Cl 67d9c335781d78d9b4344ce1bd701b9b [0,2,0,0,0,0|2,0,0]=4 9899 B17R1.6947 CCSCCCCNC(=O)c1cccnc1F 094293c4c4f5abfa34817b7bf20f5187 [0,2,0,0,0,0|2,0,0]=4 9900 B17R1.6947 CCSCCCCNC(=O)c1cccnc1I 3a02c37426a370f2c64492ef11fbc469 [0,2,0,0,0,0|2,0,0]=4 9901 B17R1.6947 CCSCCCCNC(=O)c1cccnc1O 58862abeaaebd8bd1f96ef955dcf8f7d [0,2,0,0,0,0|2,0,0]=4 9902 B17R1.6947 CCSCCCCNC(=O)c1cccnc1S 57b3ad4b98516b402fae67dbdf583457 [0,2,0,0,0,0|2,0,0]=4 9903 B17R1.6947 CCSCCCCNC(=O)c1ccncc1Br 54f6e414cc7f6bd7f4486d3d5b3c39ff [0,2,0,0,0,0|2,0,0]=4 9904 B17R1.6947 CCSCCCCNC(=O)c1ccncc1C 29388ce60ac6376ea9e8036406fa7277 [0,2,0,0,0,0|2,0,0]=4 9905 B17R1.6947 CCSCCCCNC(=O)c1ccncc1Cl f933a2a8b84834cc4409869549c851ee [0,2,0,0,0,0|2,0,0]=4 9906 B17R1.6947 CCSCCCCNC(=O)c1ccncc1F 1fa9468b90dd43ad08516c56132d3337 [0,2,0,0,0,0|2,0,0]=4 9907 B17R1.6947 CCSCCCCNC(=O)c1ccncc1I 37a9a17588d08e64d94e81ba3e18cd6e [0,2,0,0,0,0|2,0,0]=4 9908 B17R1.6947 CCSCCCCNC(=O)c1ccncc1O 52c8034765a17bf095e42d1f8b36f0d4 [0,2,0,0,0,0|2,0,0]=4 9909 B17R1.6947 CCSCCCCNC(=O)c1cnccc1Br b70f3470b32996faedaff28919e7b80c [0,2,0,0,0,0|2,0,0]=4 9910 B17R1.6947 CCSCCCCNC(=O)c1cnccc1C 0d9a701e1af33a6c6147a91bfcc2797b [0,2,0,0,0,0|2,0,0]=4 9911 B17R1.6947 CCSCCCCNC(=O)c1cnccc1Cl 7c0e9eb3cbd991ba1406a4a3ff56a67c [0,2,0,0,0,0|2,0,0]=4 9912 B17R1.6947 CCSCCCCNC(=O)c1cnccc1F 501010fa18f83a1e3ae14622980bb5d5 [0,2,0,0,0,0|2,0,0]=4 9913 B17R1.6947 CCSCCCCNC(=O)c1cnccc1O f5d48dafc8ea2424dec34695a45f714a [0,2,0,0,0,0|2,0,0]=4 9914 B17R1.6947 CCSCCCCNC(=O)c1ncccc1Br f877d5839bad5d89bef376d09fe596ca [0,2,0,0,0,0|2,0,0]=4 9915 B17R1.6947 CCSCCCCNC(=O)c1ncccc1C 649d9af9bdba7303601410c233828c97 [0,2,0,0,0,0|2,0,0]=4 9916 B17R1.6947 CCSCCCCNC(=O)c1ncccc1Cl b6666bd2b0d1e12abc8535516a37fe3f [0,2,0,0,0,0|2,0,0]=4 9917 B17R1.6947 CCSCCCCNC(=O)c1ncccc1F 133d56642bf51d69e945f6703e0d9937 [0,2,0,0,0,0|2,0,0]=4 9918 B17R1.6947 CCSCCCCNC(=O)c1ncccc1I 50bcf795384745a4a5c064c49a4cd925 [0,2,0,0,0,0|2,0,0]=4 9919 B17R1.6947 CCSCCCCNC(=O)c1ncccc1O a3c8a6c48a2cdc028d65b5311dc91c22 [0,2,0,0,0,0|2,0,0]=4 9920 B17R1.6947 CCSCCCOCC(=O)c1ccccc1C 38b00accff4a36cbd39221bb6e061710 [0,2,0,0,0,0|1,0,0]=3 9921 B17R1.6947 CCSCCCOCC(=O)c1ccccc1Cl c7b0d568f2cfacd49e51dbdb4e3b3e11 [0,2,0,0,0,0|1,0,0]=3 9922 B17R1.6947 CCSCCCOCC(=O)c1ccccc1F de80667e810884dbde1bebcdf1c8a6e8 [0,2,0,0,0,0|1,0,0]=3 9923 B17R1.6947 CCSCCCOCC(=O)c1ccccc1I 427f845d09ae40deb46b5f4eeee20cca [0,2,0,0,0,0|1,0,0]=3 9924 B17R1.6947 CCSCCCOCC(=O)c1cccnc1Cl ea5540c56713acf5ae8536df88f96509 [0,2,0,0,0,0|2,0,0]=4 9925 B17R1.6947 CCSCCCOCC(=O)c1ncccc1F aeb7b1f73a9c7a690c691589c21720b2 [0,2,0,0,0,0|2,0,0]=4 9926 B17R1.6947 CCSCCNCCC(=O)c1ccccc1F f7f5e72b144dae2c4c94d84c9b7f6ebe [0,2,0,0,0,0|2,0,0]=4 9927 B17R1.6947 COCCCCCNC(=O)c1cccc[n+]1[O-] ffc36e612d3083a434e498510aee6d48 [0,2,0,0,0,0|2,0,0]=4 9928 B17R1.6947 COCCCCCNC(=O)c1ccccc1Br 8cfbd5a120f754016cf1b094c2cc4a14 [0,2,0,0,0,0|1,0,0]=3 9929 B17R1.6947 COCCCCCNC(=O)c1ccccc1C d792dce049b73aae2bbf73b215a2c448 [0,2,0,0,0,0|1,0,0]=3 9930 B17R1.6947 COCCCCCNC(=O)c1ccccc1Cl 7c74b288bf681a6f6e441336fd0b3dd5 [0,2,0,0,0,0|1,0,0]=3 9931 B17R1.6947 COCCCCCNC(=O)c1ccccc1F 881ed8749805cd097f6372b382210665 [0,2,0,0,0,0|1,0,0]=3 9932 B17R1.6947 COCCCCCNC(=O)c1ccccc1I ad97c01850fbdff51205613863de745e [0,2,0,0,0,0|1,0,0]=3 9933 B17R1.6947 COCCCCCNC(=O)c1ccccc1O 362c5f5c9cfdf45be3a4afc15c6f2af8 [0,2,0,0,0,0|1,0,0]=3 9934 B17R1.6947 COCCCCCNC(=O)c1ccccc1S 1358d247a6186f20843b450723ea0dc7 [0,2,0,0,0,0|1,0,0]=3 9935 B17R1.6947 COCCCCCNC(=O)c1cccnc1Br 1369f45cdcc17ea6613eccf44a5860ae [0,2,0,0,0,0|2,0,0]=4 9936 B17R1.6947 COCCCCCNC(=O)c1cccnc1C ca6b88a78c8e4c08aaad17a74504a43a [0,2,0,0,0,0|2,0,0]=4 9937 B17R1.6947 COCCCCCNC(=O)c1cccnc1Cl 54ad6bce764df32de33951332af794dd [0,2,0,0,0,0|2,0,0]=4 9938 B17R1.6947 COCCCCCNC(=O)c1cccnc1F aec319a56f9f15db9315cc37a57e9c98 [0,2,0,0,0,0|2,0,0]=4 9939 B17R1.6947 COCCCCCNC(=O)c1cccnc1I 266c1f6745c842fa1e30643431df5ece [0,2,0,0,0,0|2,0,0]=4 9940 B17R1.6947 COCCCCCNC(=O)c1cccnc1O 84919005cb3385b8b2635a34b9affa12 [0,2,0,0,0,0|2,0,0]=4 9941 B17R1.6947 COCCCCCNC(=O)c1cccnc1S 3fa143101de32ae1aa9129d8f57f01fb [0,2,0,0,0,0|2,0,0]=4 9942 B17R1.6947 COCCCCCNC(=O)c1ccncc1Br d6e26f4a1af6d3caa9802fe97d110661 [0,2,0,0,0,0|2,0,0]=4 9943 B17R1.6947 COCCCCCNC(=O)c1ccncc1C 411e90b7ba4d76a4e3c69617ec415f24 [0,2,0,0,0,0|2,0,0]=4 9944 B17R1.6947 COCCCCCNC(=O)c1ccncc1Cl e2f48251e77bcef1d6dc7a43e09cd634 [0,2,0,0,0,0|2,0,0]=4 9945 B17R1.6947 COCCCCCNC(=O)c1ccncc1F 38684380457af6c0324eb684fb698bff [0,2,0,0,0,0|2,0,0]=4 9946 B17R1.6947 COCCCCCNC(=O)c1ccncc1I b24ecdc93c2d3c375f509cb32ada856a [0,2,0,0,0,0|2,0,0]=4 9947 B17R1.6947 COCCCCCNC(=O)c1ccncc1O 737451e059bdeefab70f93e163949165 [0,2,0,0,0,0|2,0,0]=4 9948 B17R1.6947 COCCCCCNC(=O)c1cnccc1Br ac57fba05618d2486af6976628fca5d4 [0,2,0,0,0,0|2,0,0]=4 9949 B17R1.6947 COCCCCCNC(=O)c1cnccc1C 7480481350912193699189aa701b4750 [0,2,0,0,0,0|2,0,0]=4 9950 B17R1.6947 COCCCCCNC(=O)c1cnccc1Cl 77ee2ada1b0c4d1a1969fff5631c4de0 [0,2,0,0,0,0|2,0,0]=4 9951 B17R1.6947 COCCCCCNC(=O)c1cnccc1F 4d2584e1ca6c0309c74db1b84603878d [0,2,0,0,0,0|2,0,0]=4 9952 B17R1.6947 COCCCCCNC(=O)c1cnccc1O bb4226a7144d53d750aa3aade39bc305 [0,2,0,0,0,0|2,0,0]=4 9953 B17R1.6947 COCCCCCNC(=O)c1ncccc1Br a87a839e1d9d5366f902157927b1ec0b [0,2,0,0,0,0|2,0,0]=4 9954 B17R1.6947 COCCCCCNC(=O)c1ncccc1C 4567bcb5502e89cd56fe18c5712ead3e [0,2,0,0,0,0|2,0,0]=4 9955 B17R1.6947 COCCCCCNC(=O)c1ncccc1Cl eb8a7f8191a41cc744f480ac1222c3c7 [0,2,0,0,0,0|2,0,0]=4 9956 B17R1.6947 COCCCCCNC(=O)c1ncccc1F 35cc1a54046d8df6a27fc36980cc9a61 [0,2,0,0,0,0|2,0,0]=4 9957 B17R1.6947 COCCCCCNC(=O)c1ncccc1I 4d53a5416c39009a39f24bf719238c84 [0,2,0,0,0,0|2,0,0]=4 9958 B17R1.6947 COCCCCCNC(=O)c1ncccc1O 88eff55377f57a319391745f13b48022 [0,2,0,0,0,0|2,0,0]=4 9959 B17R1.6947 COCCCCCOC(C)c1ccccc1Cl 0079c1fa14841c10b7b151e64568bf59 [0,2,0,0,0,0|1,0,1]=4 9960 B17R1.6947 COCCCCCOC(C)c1ccccc1F 2265015b6159f3b2ecb6c362e5156225 [0,2,0,0,0,0|1,0,1]=4 9961 B17R1.6947 COCCCCCO[C@@H](C)c1ccccc1Cl 75127ab10192233d6ce51f818fd69c3a [0,2,0,0,0,0|1,0,1]=4 9962 B17R1.6947 COCCCCCO[C@@H](C)c1ccccc1F 7fcd38d236e72dca2bfc4c8045422df5 [0,2,0,0,0,0|1,0,1]=4 9963 B17R1.6947 COCCCCCO[C@H](C)c1ccccc1Cl c78eb79ba1d0529a6c94e206332c7ded [0,2,0,0,0,0|1,0,1]=4 9964 B17R1.6947 COCCCCCO[C@H](C)c1ccccc1F 60d2dfb711d015eee6eed23cc551308e [0,2,0,0,0,0|1,0,1]=4 9965 B17R1.6947 COCCCCNCC(=O)c1ccccc1C ced6c7efc2f0f61e3fa387fd2ef9607e [0,2,0,0,0,0|2,0,0]=4 9966 B17R1.6947 COCCCCNCC(=O)c1ccccc1Cl ff821d23159c996bca780d7419f06d83 [0,2,0,0,0,0|2,0,0]=4 9967 B17R1.6947 COCCCCNCC(=O)c1ccccc1F 8843babdfa28a7724215878d76c78311 [0,2,0,0,0,0|2,0,0]=4 9968 B17R1.6947 COCCCCNCC(=O)c1ccccc1I 3b425b55efe4e196cab35271d807fe74 [0,2,0,0,0,0|2,0,0]=4 9969 B17R1.6947 COCCCCOCC(=O)c1ccccc1Br 08c9a50b62e41ee1b43cad772e3d2d54 [0,2,0,0,0,0|1,0,0]=3 9970 B17R1.6947 COCCCCOCC(=O)c1ccccc1C 2b9a5dfaf81abb263a0eeb7bc7e3aa98 [0,2,0,0,0,0|1,0,0]=3 9971 B17R1.6947 COCCCCOCC(=O)c1ccccc1Cl 5e0c97e7111f08ff344a245dca86e85e [0,2,0,0,0,0|1,0,0]=3 9972 B17R1.6947 COCCCCOCC(=O)c1ccccc1F 78b881dfdd2d717abe85c259bcc3d3a9 [0,2,0,0,0,0|1,0,0]=3 9973 B17R1.6947 COCCCCOCC(=O)c1ccccc1I 8a8f6636d6a5c9fd2a241715252fdf7d [0,2,0,0,0,0|1,0,0]=3 9974 B17R1.6947 COCCCCOCC(=O)c1cccnc1Cl 7b30adbb3f772ec330d58f6850bbe270 [0,2,0,0,0,0|2,0,0]=4 9975 B17R1.6947 COCCCCOCC(=O)c1ncccc1F 320395246483b21e1e55ef5e51cd4e9f [0,2,0,0,0,0|2,0,0]=4 9976 B17R1.6947 COCCNCCCC(=O)c1ccccc1F 4ca207805b0dfd599fc4cedb0393c3f2 [0,2,0,0,0,0|2,0,0]=4 9977 B17R1.6947 COCCNCCNC(=O)c1ccccc1Cl 5f8709fd8b7b47d63025cb88e3455de9 [0,2,0,0,0,0|2,0,0]=4 9978 B17R1.6947 COCCNCCNC(=O)c1ccccc1F 6a444a52187bf6d293a04f8c240bb95d [0,2,0,0,0,0|2,0,0]=4 9979 B17R1.6947 COCCNCCNC(=O)c1ccccc1I 6ff2d1b6790bc244cb04bdfcac6d3317 [0,2,0,0,0,0|2,0,0]=4 9980 B17R1.6947 COCCOCCCC(=O)c1ccccc1F 69fc39e10fea79065093aaa0f02eaa40 [0,2,0,0,0,0|2,0,0]=4 9981 B17R1.6947 COCCOCCNC(=O)c1ccccc1Br 44d9b3ceffb7afa381842993627c72d5 [0,2,0,0,0,0|2,0,0]=4 9982 B17R1.6947 COCCOCCNC(=O)c1ccccc1C c7394b2e3296f972be23c1714ecab0a7 [0,2,0,0,0,0|2,0,0]=4 9983 B17R1.6947 COCCOCCNC(=O)c1ccccc1Cl c32b19e33b3066a77e4e6b27b9d205e1 [0,2,0,0,0,0|2,0,0]=4 9984 B17R1.6947 COCCOCCNC(=O)c1ccccc1F f56a1a8a7bcc7a02b4896639392e7666 [0,2,0,0,0,0|2,0,0]=4 9985 B17R1.6947 COCCOCCNC(=O)c1ccccc1I e12ec3b0eaaf76a433baff395cf08130 [0,2,0,0,0,0|2,0,0]=4 9986 B17R1.6947 COCCOCCNC(=O)c1ccccc1O d78217abc543e2b9da95402073002e41 [0,2,0,0,0,0|2,0,0]=4 9987 B17R1.6947 COCCOCCNC(=O)c1ccccc1S 5dc6b8fe1923c0c22e70c7523b5b4aff [0,2,0,0,0,0|2,0,0]=4 9988 B17R1.6947 COCCOCOCC(=O)c1ccccc1Cl 078b0c91abb840be164f739f0c8ff2d2 [0,2,0,0,0,0|2,0,0]=4 9989 B17R1.6947 COCCOCOCC(=O)c1ccccc1F 77d69029c6b6aa4f0b145cf0f918f63a [0,2,0,0,0,0|2,0,0]=4 9990 B17R1.6947 COCOCCOCC(=O)c1ccccc1Br 0e0f1af752b4b06ebd2638a70e4a57b2 [0,2,0,0,0,0|2,0,0]=4 9991 B17R1.6947 COCOCCOCC(=O)c1ccccc1Cl faaa297f7a3d4b508a5df958ff8fb106 [0,2,0,0,0,0|2,0,0]=4 9992 B17R1.6947 COCOCCOCC(=O)c1ccccc1F f8edb00b1c4a797730b993d28191036a [0,2,0,0,0,0|2,0,0]=4 9993 B17R1.6947 CSCCCCNCC(=O)c1ccccc1C 927663f355fdc93fb74e1bab8b890698 [0,2,0,0,0,0|2,0,0]=4 9994 B17R1.6947 CSCCCCNCC(=O)c1ccccc1Cl 6f1fff1a5eacb9f22e2ee9950a2ab47b [0,2,0,0,0,0|2,0,0]=4 9995 B17R1.6947 CSCCCCNCC(=O)c1ccccc1F c26ddb1d467780e1b53c0bcb90b92eb3 [0,2,0,0,0,0|2,0,0]=4 9996 B17R1.6947 CSCCCCNCC(=O)c1ccccc1I 78a17437d31cde8e4083729c228cfe7c [0,2,0,0,0,0|2,0,0]=4 9997 B17R1.6947 CSCCCCOCC(=O)c1ccccc1C 3bfe5c74023b1f43c6509a89f66e9fd2 [0,2,0,0,0,0|1,0,0]=3 9998 B17R1.6947 CSCCCCOCC(=O)c1ccccc1Cl 92f1362f1340aaae06857e5431dd90e4 [0,2,0,0,0,0|1,0,0]=3 9999 B17R1.6947 CSCCCCOCC(=O)c1ccccc1F e7fa65f9b3de26854c3a456751e52f6a [0,2,0,0,0,0|1,0,0]=3 10000 B17R1.6947 CSCCCCOCC(=O)c1ccccc1I 25e6b61606e925a89c7dc0c341b5984b [0,2,0,0,0,0|1,0,0]=3 10001 B17R1.6947 CSCCCCOCC(=O)c1cccnc1Cl 8ea01d7e221053319c1f91d9c4880324 [0,2,0,0,0,0|2,0,0]=4 10002 B17R1.6947 CSCCCCOCC(=O)c1ncccc1C e3a75133e20bacb225f60d2a90334555 [0,2,0,0,0,0|2,0,0]=4 10003 B17R1.6947 CSCCCCOCC(=O)c1ncccc1F 14134f7568df1560baa3de502b277cf8 [0,2,0,0,0,0|2,0,0]=4 10004 B17R1.6947 CSCCNCCCC(=O)c1ccccc1F 22f6c17099ef1243d1df680528cb2f15 [0,2,0,0,0,0|2,0,0]=4 10005 B17R1.6947 CSCCNCCNC(=O)c1ccccc1Cl d7697d8475806d91fac38de36537fce0 [0,2,0,0,0,0|2,0,0]=4 10006 B17R1.6947 CSCCNCCNC(=O)c1ccccc1F 772adad648fcc1289099baf0528d59d3 [0,2,0,0,0,0|2,0,0]=4 10007 B17R1.6947 CSCCNCCNC(=O)c1ccccc1I e02dd4c9d440201fbe090ff6f28304ef [0,2,0,0,0,0|2,0,0]=4 10008 B17R1.6947 CSCCOCCCC(=O)c1ccccc1F 38a4dc03c203c229d350d4e6c947eb4b [0,2,0,0,0,0|2,0,0]=4 10009 B17R1.6947 CSCCOCCNC(=O)c1ccccc1Br 6065aa6bc8a3b5b21b0ce3a5bf95800f [0,2,0,0,0,0|2,0,0]=4 10010 B17R1.6947 Cc1ccccc1C(=O)CNCCCCCCl 79b37d3305cb6fe3b362636bbe0ef44a [0,2,0,0,0,0|2,0,0]=4 10011 B17R1.6947 Cc1ccccc1C(=O)CNCCCCCO 8adcce1a9ddebd91092a6bb9e38ae564 [0,2,0,0,0,0|2,0,0]=4 10012 B17R1.6947 Cc1ccccc1C(=O)COCCCCC#N 27e5acdd668c040181f4f7ab124b762e [0,2,0,0,0,0|1,0,1]=4 10013 B17R1.6947 Cc1ccccc1C(=O)COCCCCC=O 23db5b803131f9aa3690e41f85fa6ba1 [0,2,0,0,0,0|1,0,1]=4 10014 B17R1.6947 Cc1ccccc1C(=O)COCCOCCF e47bb2ce4eb7183058d9c6989bf22cfc [0,2,0,0,0,0|2,0,0]=4 10015 B17R1.6947 Cc1ccccc1C(=O)COCCOCCS b632e6ce91cab2b4c0394f463001c4ef [0,2,0,0,0,0|2,0,0]=4 10016 B17R1.6947 Cc1ccccc1C(=O)NCCCCCC#N c092ade645dddd174d07d8ccf7a1ca00 [0,2,0,0,0,0|1,0,1]=4 10017 B17R1.6947 Cc1ccccc1C(=O)NCCCCCCCl b058b6ca4f28a85d9a1129672a8745c1 [0,2,0,0,0,0|1,0,0]=3 10018 B17R1.6947 Cc1ccccc1C(=O)NCCCCCCO 35aaca91c1ecfb7e0c78bafb9cf5f073 [0,2,0,0,0,0|1,0,0]=3 10019 B17R1.6947 Cc1ccccc1C(=O)NCCCOCCO 9bcf7474b0aa2e441625001a509168b7 [0,2,0,0,0,0|2,0,0]=4 10020 B17R1.6947 Cc1ccccc1C(=O)NCCOCCCO 0a744cd84964fb44ffe63bccfaed77d2 [0,2,0,0,0,0|2,0,0]=4 10021 B17R1.6947 Cc1cccnc1C(=O)NCCCCCCCl b6caef341278ecc166db546e25a14ea2 [0,2,0,0,0,0|2,0,0]=4 10022 B17R1.6947 Cc1cccnc1C(=O)NCCCCCCO 1b624244a3b598fb1cf4b29a8d4609b4 [0,2,0,0,0,0|2,0,0]=4 10023 B17R1.6947 Cc1ccncc1C(=O)NCCCCCCCl 3cacbfeab93daae47109e1809b19f0b5 [0,2,0,0,0,0|2,0,0]=4 10024 B17R1.6947 Cc1ccncc1C(=O)NCCCCCCO 78decfb04634151b2a4c123b4018bd04 [0,2,0,0,0,0|2,0,0]=4 10025 B17R1.6947 Cc1cnccc1C(=O)NCCCCCCCl bfe6e7fd53a450f6c37987e703fdb150 [0,2,0,0,0,0|2,0,0]=4 10026 B17R1.6947 Cc1cnccc1C(=O)NCCCCCCO 76a88957409492cbab4dddad5b4a2409 [0,2,0,0,0,0|2,0,0]=4 10027 B17R1.6947 Cc1ncccc1C(=O)NCCCCCCCl e9a8b31bd74e93d0e07c2031bb1ee296 [0,2,0,0,0,0|2,0,0]=4 10028 B17R1.6947 Cc1ncccc1C(=O)NCCCCCCO d10ed4df3f9c7cef04336451930ec93f [0,2,0,0,0,0|2,0,0]=4 10029 B17R1.6947 N#CCCCCCNC(=O)c1ccccc1Br ac62e1cc4f0a5cc378c0e46229452436 [0,2,0,0,0,0|1,0,1]=4 10030 B17R1.6947 N#CCCCCCNC(=O)c1ccccc1Cl abbc61177872c03ff3890e7826ace722 [0,2,0,0,0,0|1,0,1]=4 10031 B17R1.6947 N#CCCCCCNC(=O)c1ccccc1F d7e5affe27a8cd8239071d120bb36a62 [0,2,0,0,0,0|1,0,1]=4 10032 B17R1.6947 N#CCCCCCNC(=O)c1ccccc1I 85d9123c44fe9ce5f4659c518df279d8 [0,2,0,0,0,0|1,0,1]=4 10033 B17R1.6947 N#CCCCCCNC(=O)c1ccccc1O 0077164737970767c4496fede0809373 [0,2,0,0,0,0|1,0,1]=4 10034 B17R1.6947 N#CCCCCCNC(=O)c1ccccc1S fd5bef91b0e4ce926a5ed6687c19f4be [0,2,0,0,0,0|1,0,1]=4 10035 B17R1.6947 N#CCCCCOCC(=O)c1ccccc1Cl 72ff37245f0a9db56860e78b269351ba [0,2,0,0,0,0|1,0,1]=4 10036 B17R1.6947 N#CCCCCOCC(=O)c1ccccc1F 069116ba3b186c7a730ba301071383d7 [0,2,0,0,0,0|1,0,1]=4 10037 B17R1.6947 N#CCCCCOCC(=O)c1ccccc1I b657e8b590bf7ada82090331a8055d5f [0,2,0,0,0,0|1,0,1]=4 10038 B17R1.6947 O=C(CCCNCCCCl)c1ccccc1F 4a5c68776f125fbf50f82436b5399936 [0,2,0,0,0,0|2,0,0]=4 10039 B17R1.6947 O=C(CCCNCCCO)c1ccccc1F 1f095b6a62a55358a1b8f37b4b6a0e1c [0,2,0,0,0,0|2,0,0]=4 10040 B17R1.6947 O=C(CCCOCCCF)c1ccccc1F 74b36c469ec595dcd8348f5df8d67dc0 [0,2,0,0,0,0|2,0,0]=4 10041 B17R1.6947 O=C(CCNCCCCCl)c1ccccc1F b81845815bc2951638aff4bf17151eb9 [0,2,0,0,0,0|2,0,0]=4 10042 B17R1.6947 O=C(CCNCCCCO)c1ccccc1F a69eca4ff9faf00c252980c7d632cf86 [0,2,0,0,0,0|2,0,0]=4 10043 B17R1.6947 O=C(CCNCCCCS)c1ccccc1F f9a5959589ca2de5111aed24986b6b84 [0,2,0,0,0,0|2,0,0]=4 10044 B17R1.6947 O=C(CNCCCCCCl)c1ccccc1Br 7f524dde8634ed778bfa0809abd06c31 [0,2,0,0,0,0|2,0,0]=4 10045 B17R1.6947 O=C(CNCCCCCCl)c1ccccc1Cl b163b78773458eed16d440a3e57e9865 [0,2,0,0,0,0|2,0,0]=4 10046 B17R1.6947 O=C(CNCCCCCCl)c1ccccc1F 4e4bdaa574770c829024eb12cb1c8c14 [0,2,0,0,0,0|2,0,0]=4 10047 B17R1.6947 O=C(CNCCCCCCl)c1ccccc1I cd08321315558ea29fdf8f9968ce3474 [0,2,0,0,0,0|2,0,0]=4 10048 B17R1.6947 O=C(CNCCCCCO)c1ccccc1Br 3a400d01e9d1c3ca0802ebf4b27566db [0,2,0,0,0,0|2,0,0]=4 10049 B17R1.6947 O=C(CNCCCCCO)c1ccccc1Cl d05bbd1c9a4797e85296e5f49a7f80c3 [0,2,0,0,0,0|2,0,0]=4 10050 B17R1.6947 O=C(CNCCCCCO)c1ccccc1F ac00a61e538bcf475277b4949553dbea [0,2,0,0,0,0|2,0,0]=4 10051 B17R1.6947 O=C(CNCCCCCO)c1ccccc1I f2bbeea888efb56ab687100035075f43 [0,2,0,0,0,0|2,0,0]=4 10052 B17R1.6947 O=C(COCCCCCF)c1ccccc1Cl c9d3975d89e83ef0c786345e6c85f6b8 [0,2,0,0,0,0|1,0,0]=3 10053 B17R1.6947 O=C(COCCCCCF)c1ccccc1F 1a558250d0424be1f5fd22a35ef4a1d6 [0,2,0,0,0,0|1,0,0]=3 10054 B17R1.6947 O=C(COCCOCCF)c1ccccc1Cl da7e544077f1e8f83d74b2ce360d576d [0,2,0,0,0,0|2,0,0]=4 10055 B17R1.6947 O=C(COCCOCCF)c1ccccc1F e61260cc88e6d9ffdceb6085447902ab [0,2,0,0,0,0|2,0,0]=4 10056 B17R1.6947 O=C(COCCOCCF)c1ccccc1I 9c23ae9572f481b88d4155f473ee63e5 [0,2,0,0,0,0|2,0,0]=4 10057 B17R1.6947 O=C(COCCOCCS)c1ccccc1Br b27a406d163e39b7c8a6b15b4fa1ec0f [0,2,0,0,0,0|2,0,0]=4 10058 B17R1.6947 O=C(COCCOCCS)c1ccccc1Cl 7c9db782e5c5a051c78f35ff39b6b711 [0,2,0,0,0,0|2,0,0]=4 10059 B17R1.6947 O=C(COCCOCCS)c1ccccc1F 24428e905feeeba7fc28ccb9f92d0ac8 [0,2,0,0,0,0|2,0,0]=4 10060 B17R1.6947 O=C(COCCOCCS)c1ccccc1I 3dd033b230ab0adee11f5e93d8b57f49 [0,2,0,0,0,0|2,0,0]=4 10061 B17R1.6947 O=C(NCCCCCCCl)c1cccc[n+]1[O-] 1d9733af2cd43bf47ed6f7edd5add06e [0,2,0,0,0,0|2,0,0]=4 10062 B17R1.6947 O=C(NCCCCCCCl)c1ccccc1Br 99bc49daa8563dca3e4ad8577057c7a6 [0,2,0,0,0,0|1,0,0]=3 10063 B17R1.6947 O=C(NCCCCCCCl)c1ccccc1Cl 2b3c2d71bdd20c6759a2ca9e85fa56ef [0,2,0,0,0,0|1,0,0]=3 10064 B17R1.6947 O=C(NCCCCCCCl)c1ccccc1F 0a582337d19899d6bcaa3e74b0bdfe14 [0,2,0,0,0,0|1,0,0]=3 10065 B17R1.6947 O=C(NCCCCCCCl)c1ccccc1I b7a5b4ec38594a607985e72d02c3c4c8 [0,2,0,0,0,0|1,0,0]=3 10066 B17R1.6947 O=C(NCCCCCCCl)c1ccccc1O c2d9ac7072b59e9a4505c3839c28be41 [0,2,0,0,0,0|1,0,0]=3 10067 B17R1.6947 O=C(NCCCCCCCl)c1ccccc1S ed6d11be891bf2b95aa1efe79946b2ac [0,2,0,0,0,0|1,0,0]=3 10068 B17R1.6947 O=C(NCCCCCCCl)c1cccnc1Br 259f2512ca6752f9db5f4b3003ee51b3 [0,2,0,0,0,0|2,0,0]=4 10069 B17R1.6947 O=C(NCCCCCCCl)c1cccnc1Cl 2b9c9f53759c5af8d54c1d506999d6da [0,2,0,0,0,0|2,0,0]=4 10070 B17R1.6947 O=C(NCCCCCCCl)c1cccnc1F 5dbd1b02e91b133f7e3a63ebd078f991 [0,2,0,0,0,0|2,0,0]=4 10071 B17R1.6947 O=C(NCCCCCCCl)c1cccnc1I c65f9967308e4c1a7e0db28ae1b12a7c [0,2,0,0,0,0|2,0,0]=4 10072 B17R1.6947 O=C(NCCCCCCCl)c1cccnc1O a40f56a147832999573e9a3103a2afe9 [0,2,0,0,0,0|2,0,0]=4 10073 B17R1.6947 O=C(NCCCCCCCl)c1cccnc1S 0fd269adb0c5f4dab8f8ce17d46844ad [0,2,0,0,0,0|2,0,0]=4 10074 B17R1.6947 O=C(NCCCCCCCl)c1ccncc1Br 8ef17d1a107328413146ff6c741a4f37 [0,2,0,0,0,0|2,0,0]=4 10075 B17R1.6947 O=C(NCCCCCCCl)c1ccncc1Cl b011e8bd817d71a54a639e4571b82445 [0,2,0,0,0,0|2,0,0]=4 10076 B17R1.6947 O=C(NCCCCCCCl)c1ccncc1F 7cf25a21788f243c4e664075e3dee530 [0,2,0,0,0,0|2,0,0]=4 10077 B17R1.6947 O=C(NCCCCCCCl)c1ccncc1I 205a9f6963e8577b374e28509ecbf511 [0,2,0,0,0,0|2,0,0]=4 10078 B17R1.6947 O=C(NCCCCCCCl)c1ccncc1O f66b7819dccec818d358fc3ed9fa520f [0,2,0,0,0,0|2,0,0]=4 10079 B17R1.6947 O=C(NCCCCCCCl)c1cnccc1Br 41cfc8cdb2a8927889217b4888ee6cf4 [0,2,0,0,0,0|2,0,0]=4 10080 B17R1.6947 O=C(NCCCCCCCl)c1cnccc1Cl a62d3e800633f0b9b89ff84e37785884 [0,2,0,0,0,0|2,0,0]=4 10081 B17R1.6947 O=C(NCCCCCCCl)c1cnccc1F 17cc3f7dc0a1baf42727bfe62a2fd2a7 [0,2,0,0,0,0|2,0,0]=4 10082 B17R1.6947 O=C(NCCCCCCCl)c1cnccc1O f34ebb6e86af4a6c24e428189e2f746c [0,2,0,0,0,0|2,0,0]=4 10083 B17R1.6947 O=C(NCCCCCCCl)c1ncccc1Br 0946f88061235755e3900a5b67438768 [0,2,0,0,0,0|2,0,0]=4 10084 B17R1.6947 O=C(NCCCCCCCl)c1ncccc1Cl 477553662faeab761c4a4cbf03af85b6 [0,2,0,0,0,0|2,0,0]=4 10085 B17R1.6947 O=C(NCCCCCCCl)c1ncccc1F c11eb00bb5b8bae23df9b309d597527f [0,2,0,0,0,0|2,0,0]=4 10086 B17R1.6947 O=C(NCCCCCCCl)c1ncccc1I deebd7a1dea7e43dae7db0cb4fe1c804 [0,2,0,0,0,0|2,0,0]=4 10087 B17R1.6947 O=C(NCCCCCCCl)c1ncccc1O 7c37ada777336b14c8c2bb650e58939f [0,2,0,0,0,0|2,0,0]=4 10088 B17R1.6947 O=C(NCCCCCCO)c1cccc[n+]1[O-] 5d18f56c8bbb9606145d9fe3fc1572d9 [0,2,0,0,0,0|2,0,0]=4 10089 B17R1.6947 O=C(NCCCCCCO)c1ccccc1Br 50b5eab79d0226eeee10d0c21b17c5e1 [0,2,0,0,0,0|1,0,0]=3 10090 B17R1.6947 O=C(NCCCCCCO)c1ccccc1Cl 27868e08ea7ad053a172075d96a35035 [0,2,0,0,0,0|1,0,0]=3 10091 B17R1.6947 O=C(NCCCCCCO)c1ccccc1F 1603d722bf199796989a8de44d11003c [0,2,0,0,0,0|1,0,0]=3 10092 B17R1.6947 O=C(NCCCCCCO)c1ccccc1I c46c7dad332d949e24b355d9c231e3b7 [0,2,0,0,0,0|1,0,0]=3 10093 B17R1.6947 O=C(NCCCCCCO)c1ccccc1O 953410ab17578d0abc106b13885e3b18 [0,2,0,0,0,0|1,0,0]=3 10094 B17R1.6947 O=C(NCCCCCCO)c1ccccc1S 0db78bef5da098fa25c9cacefdbd5d70 [0,2,0,0,0,0|1,0,0]=3 10095 B17R1.6947 O=C(NCCCCCCO)c1cccnc1Br 5b583f0ee3e983ecb30664d6c561d3c8 [0,2,0,0,0,0|2,0,0]=4 10096 B17R1.6947 O=C(NCCCCCCO)c1cccnc1Cl 54b02b15f4c5390adaba59af010d0d99 [0,2,0,0,0,0|2,0,0]=4 10097 B17R1.6947 O=C(NCCCCCCO)c1cccnc1F 653a0aba2219c6953a650901f19b7e72 [0,2,0,0,0,0|2,0,0]=4 10098 B17R1.6947 O=C(NCCCCCCO)c1cccnc1I 7a5537a9ada44edd21998beed7aecb38 [0,2,0,0,0,0|2,0,0]=4 10099 B17R1.6947 O=C(NCCCCCCO)c1cccnc1O 35b2adf565e39d4c8ec4641003ca7686 [0,2,0,0,0,0|2,0,0]=4 10100 B17R1.6947 O=C(NCCCCCCO)c1cccnc1S d0541882cd7359310e5f709bb48c7cd8 [0,2,0,0,0,0|2,0,0]=4 10101 B17R1.6947 O=C(NCCCCCCO)c1ccncc1Br da281afd2c4f89fcec34ac6c7900c6c5 [0,2,0,0,0,0|2,0,0]=4 10102 B17R1.6947 O=C(NCCCCCCO)c1ccncc1Cl 6f1192bf37a76922a55fcf4f99a3a1ab [0,2,0,0,0,0|2,0,0]=4 10103 B17R1.6947 O=C(NCCCCCCO)c1ccncc1F 65bde589285cd0284fb331528176b189 [0,2,0,0,0,0|2,0,0]=4 10104 B17R1.6947 O=C(NCCCCCCO)c1ccncc1I 07396203f8e776394e8e8ae1371f7ea1 [0,2,0,0,0,0|2,0,0]=4 10105 B17R1.6947 O=C(NCCCCCCO)c1ccncc1O 0fb8ef583fc0adbdf7c9ee5afd056782 [0,2,0,0,0,0|2,0,0]=4 10106 B17R1.6947 O=C(NCCCCCCO)c1cnccc1Br 29cab0806b81edb878fa2f9d311b59d1 [0,2,0,0,0,0|2,0,0]=4 10107 B17R1.6947 O=C(NCCCCCCO)c1cnccc1Cl 23ac7107c8cfb0d10e7a44896f7d8e83 [0,2,0,0,0,0|2,0,0]=4 10108 B17R1.6947 O=C(NCCCCCCO)c1cnccc1F 319640e75c7f29d6deba07cadff1fc99 [0,2,0,0,0,0|2,0,0]=4 10109 B17R1.6947 O=C(NCCCCCCO)c1cnccc1O 4b0b73b59ef6503b1003a42aa3da851d [0,2,0,0,0,0|2,0,0]=4 10110 B17R1.6947 O=C(NCCCCCCO)c1ncccc1Br 559c6109651c7df9f0c21d49cd1af59a [0,2,0,0,0,0|2,0,0]=4 10111 B17R1.6947 O=C(NCCCCCCO)c1ncccc1Cl 8f07e3e0e3f4a2a94c9c24be5666c52b [0,2,0,0,0,0|2,0,0]=4 10112 B17R1.6947 O=C(NCCCCCCO)c1ncccc1F adcafa6fc1b191ec96d792a0deee5607 [0,2,0,0,0,0|2,0,0]=4 10113 B17R1.6947 O=C(NCCCCCCO)c1ncccc1I fc094e53e5d897ebbb9d21f08a6ebacb [0,2,0,0,0,0|2,0,0]=4 10114 B17R1.6947 O=C(NCCCCCCO)c1ncccc1O faea7b53174f9d53aa9554048ff26ee5 [0,2,0,0,0,0|2,0,0]=4 10115 B17R1.6947 O=C(NCCCOCCO)c1ccccc1Br 3351040c89717bcf56ff56e1d98a47d9 [0,2,0,0,0,0|2,0,0]=4 10116 B17R1.6947 O=C(NCCCOCCO)c1ccccc1Cl 2068cf03c917707ddf5e67559255a8e6 [0,2,0,0,0,0|2,0,0]=4 10117 B17R1.6947 O=C(NCCCOCCO)c1ccccc1F ff25c56c73e7c19085f94b2998bf5c6d [0,2,0,0,0,0|2,0,0]=4 10118 B17R1.6947 O=C(NCCCOCCO)c1ccccc1I 785f18df28021ceb2c9c773b168fad17 [0,2,0,0,0,0|2,0,0]=4 10119 B17R1.6947 O=C(NCCCOCCO)c1ccccc1O d67c7f4f0d47c3685769767a8b28190e [0,2,0,0,0,0|2,0,0]=4 10120 B17R1.6947 O=C(NCCCOCCO)c1ccccc1S 4bc3cee2d053072d26aabcfcf6da0311 [0,2,0,0,0,0|2,0,0]=4 10121 B17R1.6947 O=C(NCCNCCCF)c1ccccc1Cl 4093aef8a723396ac91f80a7bc2f167e [0,2,0,0,0,0|2,0,0]=4 10122 B17R1.6947 O=C(NCCNCCCF)c1ccccc1F 99fc29e40941d87abb825a93514d98e0 [0,2,0,0,0,0|2,0,0]=4 10123 B17R1.6947 O=C(NCCNCCCF)c1ccccc1I a1460730700fb6110da7cd934a46a831 [0,2,0,0,0,0|2,0,0]=4 10124 B17R1.6947 O=C(NCCNCCCO)c1ccccc1Cl 74cdb597fe318db9ad93d30ddbeb775a [0,2,0,0,0,0|2,0,0]=4 10125 B17R1.6947 O=C(NCCNCCCO)c1ccccc1F eaa1c0d1ba08f0a3d214573af4a6e838 [0,2,0,0,0,0|2,0,0]=4 10126 B17R1.6947 O=C(NCCNCCCO)c1ccccc1I 319d51dbd5a80dd2c1137d9aa0f76f76 [0,2,0,0,0,0|2,0,0]=4 10127 B17R1.6947 O=C(NCCNCCCS)c1ccccc1Cl 2f3d04b19d1fd6fe0d7e15a4c3bb1191 [0,2,0,0,0,0|2,0,0]=4 10128 B17R1.6947 O=C(NCCNCCCS)c1ccccc1F e5f31303b260258a308641dfcc172a9f [0,2,0,0,0,0|2,0,0]=4 10129 B17R1.6947 O=C(NCCNCCCS)c1ccccc1I 5a8a4039e2a5c5f5625a5d2611dbc76c [0,2,0,0,0,0|2,0,0]=4 10130 B17R1.6947 O=C(NCCOCCCF)c1ccccc1Br bac937e1cd1316d2f8b9d182a2a04fad [0,2,0,0,0,0|2,0,0]=4 10131 B17R1.6947 O=C(NCCOCCCO)c1ccccc1Br 9283a52683fbd5fa06ea4ff6c448677a [0,2,0,0,0,0|2,0,0]=4 10132 B17R1.6947 O=C(NCCOCCCO)c1ccccc1Cl 30fb133fd56529823327cda6eb01997c [0,2,0,0,0,0|2,0,0]=4 10133 B17R1.6947 O=C(NCCOCCCO)c1ccccc1F 536b8032014b1d82b601749348409835 [0,2,0,0,0,0|2,0,0]=4 10134 B17R1.6947 O=C(NCCOCCCO)c1ccccc1I 25aeefe123c19cb8850fdda83866be32 [0,2,0,0,0,0|2,0,0]=4 10135 B17R1.6947 O=C(NCCOCCCO)c1ccccc1O 3df83da3573b77d285dba29931f8cd08 [0,2,0,0,0,0|2,0,0]=4 10136 B17R1.6947 O=C(NCCOCCCO)c1ccccc1S e1a554d21624c5e65d260655e1f7e4cf [0,2,0,0,0,0|2,0,0]=4 10137 B17R1.6947 O=CCCCCOCC(=O)c1ccccc1Br b09668388330996a1064bf8195eeecac [0,2,0,0,0,0|1,0,1]=4 10138 B17R1.6947 O=CCCCCOCC(=O)c1ccccc1Cl 59093650f3865e5e98fb81a7ed77febe [0,2,0,0,0,0|1,0,1]=4 10139 B17R1.6947 O=CCCCCOCC(=O)c1ccccc1F 15c954b4c22d161d02d2129c7c9fddf3 [0,2,0,0,0,0|1,0,1]=4 10140 B17R1.6947 O=CCCCCOCC(=O)c1ccccc1I 30458602f0326d36e47781d8bdc26341 [0,2,0,0,0,0|1,0,1]=4 10141 B17R1.710 C#CC(OCCCCCC)c1ccc(cc1)C 13cb45a8132a432870d915258e35ede8 [0,2,0,0,0,0|1,0,1]=4 10142 B17R1.710 C=CC(OCCCCCC)c1ccc(cc1)Br d39ef473469cb298b96bf55bf43c23cd [0,2,0,0,0,0|1,0,1]=4 10143 B17R1.710 C=CC(OCCCCCC)c1ccc(cc1)C d0084a87570c14dd38177c7b4d3f872a [0,2,0,0,0,0|1,0,1]=4 10144 B17R1.710 C=CC(OCCCCCC)c1ccc(cc1)Cl 158fb5c76407800628201aae0a362b7f [0,2,0,0,0,0|1,0,1]=4 10145 B17R1.710 C=CC(OCCCCCC)c1ccc(cc1)F 2944cf454c3f5760d51a7e407fac82f6 [0,2,0,0,0,0|1,0,1]=4 10146 B17R1.710 CCCCCCOC(CC)c1ccc(cc1)Br c86efe9c4fb128702a6cb8cd69c08c79 [0,2,0,0,0,0|1,0,1]=4 10147 B17R1.710 CCCCCCOC(CC)c1ccc(cc1)C 22ec6f8175fbdd90ad23310411aea123 [0,2,0,0,0,0|1,0,1]=4 10148 B17R1.710 CCCCCCOC(CC)c1ccc(cc1)F c2738b1522e5990004637ba427185cca [0,2,0,0,0,0|1,0,1]=4 10149 B17R1.710 CCCCCCOC(CC)c1ccc(cc1)I 5073dcf11a3887cae5d1ec438d0232df [0,2,0,0,0,0|1,0,1]=4 10150 B17R1.710 CCCCCCO[C@@H](C#N)c1ccc(cc1)C c63d0538a0b5c854fec25faf82c13386 [0,2,0,0,0,0|1,0,1]=4 10151 B17R1.710 CCCCCCO[C@@H](CC)c1ccc(cc1)F 8f1f27ab29b0092b69f4af9ab7ba0aa5 [0,2,0,0,0,0|1,0,1]=4 10152 B17R1.748 CCCCC(C)COC(C)c1ccc(cc1)F 2012ceb8934cf7e23e2f98070039923d [0,2,0,0,0,0|1,0,1]=4 10153 B17R1.748 CCCCC(C)NCC(=O)c1ccc(cc1)Br bb062f7afe13e71c1f1bf78cb76c959a [0,2,0,0,0,0|2,0,0]=4 10154 B17R1.748 CCCCC(C)NCC(=O)c1ccc(cc1)C 128a2faa44d1d80d373e09b5352e491b [0,2,0,0,0,0|2,0,0]=4 10155 B17R1.748 CCCCC(C)NCC(=O)c1ccc(cc1)Cl 64c7960e5f13134ae2efaf4a5645cbf7 [0,2,0,0,0,0|2,0,0]=4 10156 B17R1.748 CCCCC(C)NCC(=O)c1ccc(cc1)F 533617b81caa513b0cc914bc08dcec8b [0,2,0,0,0,0|2,0,0]=4 10157 B17R1.748 CCCCC(C)OCC(=O)c1ccc(cc1)Br ea8fe94d0537a7574b0ca5ef41f40fd6 [0,2,0,0,0,0|2,0,0]=4 10158 B17R1.748 CCCCC(C)OCC(=O)c1ccc(cc1)C 412a75abc7b334200c79bedda6bbbd3a [0,2,0,0,0,0|2,0,0]=4 10159 B17R1.748 CCCCC(C)OCC(=O)c1ccc(cc1)Cl 676d1295e7d65b587798e00d10683f3e [0,2,0,0,0,0|2,0,0]=4 10160 B17R1.748 CCCCC(C)OCC(=O)c1ccc(cc1)F a14898da539d68224c31bba643af870f [0,2,0,0,0,0|2,0,0]=4 10161 B17R1.748 CCCCC(C)OCC(=O)c1ccc(cc1)I 8158dc686d478aca742fabfa85cacd6c [0,2,0,0,0,0|2,0,0]=4 10162 B17R1.748 CCCCC(O)CNC(=O)c1cc[n+](cc1)[O-] f21056cdff24e388121a404ef2f16122 [0,2,0,0,0,0|2,0,0]=4 10163 B17R1.748 CCCCC(O)CNC(=O)c1ccc(=O)oc1 25fd0af158adc9616d1dcf1ab9584654 [0,2,0,0,0,0|2,0,0]=4 10164 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)Br c85a03a3253d0e627a9aed97a3af61f5 [0,2,0,0,0,0|1,0,0]=3 10165 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)C 6c5664e4bf372dfaf33a08c9cb8a01f7 [0,2,0,0,0,0|1,0,0]=3 10166 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)Cl 6e983766b01921fd89566fd7574483ff [0,2,0,0,0,0|1,0,0]=3 10167 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)F 12c80faa25e880a1277ef93fb0e08795 [0,2,0,0,0,0|1,0,0]=3 10168 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)I 90465902c316545a7e8c405aa9599004 [0,2,0,0,0,0|1,0,0]=3 10169 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)O 06bdf4e957874d691d5179947108874f [0,2,0,0,0,0|1,0,0]=3 10170 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cc1)S e2eb859f2b255fdc87dcd4fe7b493b9d [0,2,0,0,0,0|1,0,0]=3 10171 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cn1)Br ca1cf232eff06794c904e006e1d7f86d [0,2,0,0,0,0|2,0,0]=4 10172 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cn1)C 1fcf8097fff95088fd4b463498125cf2 [0,2,0,0,0,0|2,0,0]=4 10173 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cn1)Cl 5c679f500fb67453088eb27e00bffa47 [0,2,0,0,0,0|2,0,0]=4 10174 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cn1)F 0fd3f89971ca229a19feca65427b1ec8 [0,2,0,0,0,0|2,0,0]=4 10175 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cn1)I 05073e0cc95b7fb1c369c101c151b97e [0,2,0,0,0,0|2,0,0]=4 10176 B17R1.748 CCCCC(O)CNC(=O)c1ccc(cn1)O c1e8dea40367e250ae7fe7d4deb47316 [0,2,0,0,0,0|2,0,0]=4 10177 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)Br 4437078991f315440a207781563b3963 [0,2,0,0,0,0|2,0,0]=4 10178 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)C 29ea1c9e90ff0584d8976d56d801049b [0,2,0,0,0,0|2,0,0]=4 10179 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)Cl 9930054a0038133acdb10a6cc395d6a4 [0,2,0,0,0,0|2,0,0]=4 10180 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)F 4bdb2cfa160b48e6d556a19807e3ac03 [0,2,0,0,0,0|2,0,0]=4 10181 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)I 463d3ea2f4896f7079eaf734985ae8a1 [0,2,0,0,0,0|2,0,0]=4 10182 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)O 8a74163eabb82e73f3f0711b914f1782 [0,2,0,0,0,0|2,0,0]=4 10183 B17R1.748 CCCCC(O)CNC(=O)c1ccc(nc1)S bb33f3738425a71bcf7b7a41431940a0 [0,2,0,0,0,0|2,0,0]=4 10184 B17R1.748 CCCCN(C)CCC(=O)c1ccc(cc1)F a8e3f536c25379424f2360f4b1ace87d [0,2,0,0,0,0|2,0,0]=4 10185 B17R1.748 CCCCN(C)COC(=O)c1ccc(cc1)F 8c378551258793c3f1fdf5a9d141d846 [0,2,0,0,0,0|1,0,0]=3 10186 B17R1.748 CCCC[C@@H](C)NCC(=O)c1ccc(cc1)C 2f525567788f6ba6926cd1acc63def46 [0,2,0,0,0,0|2,0,0]=4 10187 B17R1.748 CCCC[C@@H](C)NCC(=O)c1ccc(cc1)Cl 60bcc9096145d6a4553bcefeb01bfb23 [0,2,0,0,0,0|2,0,0]=4 10188 B17R1.748 CCCC[C@@H](C)NCC(=O)c1ccc(cc1)F a2f2e0b87846964a4e679a7b0e921e12 [0,2,0,0,0,0|2,0,0]=4 10189 B17R1.748 CCCC[C@@H](C)OCC(=O)c1ccc(cc1)C 08da3526fd3539a02d11bb3f86907ea7 [0,2,0,0,0,0|2,0,0]=4 10190 B17R1.748 CCCC[C@@H](C)OCC(=O)c1ccc(cc1)Cl 5bfb3639882b54e025e2838851aa3fcb [0,2,0,0,0,0|2,0,0]=4 10191 B17R1.748 CCCC[C@@H](C)OCC(=O)c1ccc(cc1)F 1fb9681409f95e9817527bcdb2f61c14 [0,2,0,0,0,0|2,0,0]=4 10192 B17R1.748 CCCC[C@@H](C)OCC(=O)c1ccc(cc1)I 7bee38d4e12efb881a63c1a76d7a65cf [0,2,0,0,0,0|2,0,0]=4 10193 B17R1.748 CCCC[C@H](C)OCC(=O)c1ccc(cc1)C 0f3e877f8dca80ef0de12398d541f35b [0,2,0,0,0,0|2,0,0]=4 10194 B17R1.748 CCCC[C@H](C)OCC(=O)c1ccc(cc1)Cl 8531cf13d1e21aea9673f4c07256c326 [0,2,0,0,0,0|2,0,0]=4 10195 B17R1.748 CCCC[C@H](C)OCC(=O)c1ccc(cc1)F 8683cc3148be8d139baa7f240c240e1c [0,2,0,0,0,0|2,0,0]=4 10196 B17R1.748 CCCC[C@H](C)OCC(=O)c1ccc(cc1)I def3076e9bff7f48134e10eecb3173d9 [0,2,0,0,0,0|2,0,0]=4 10197 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)Br 7ae6e4176f35f57ab46b87fe78b67090 [0,2,0,0,0,0|2,0,0]=4 10198 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)C 5a9d872b705925748bf4c3b69d5eb136 [0,2,0,0,0,0|2,0,0]=4 10199 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)Cl fda26cdd6e43330a4d498769bd34b701 [0,2,0,0,0,0|2,0,0]=4 10200 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)F fa386a3bf84b6874582922553dded1cd [0,2,0,0,0,0|2,0,0]=4 10201 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)I 8c2686fb10aadac097daa5765efd420f [0,2,0,0,0,0|2,0,0]=4 10202 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)O 828035becd715dab87bd4ff821d97ebc [0,2,0,0,0,0|2,0,0]=4 10203 B17R1.748 CCOCC(O)CNC(=O)c1ccc(cc1)S 4fd495dfe8910f4a5a2ca5d29d2c567c [0,2,0,0,0,0|2,0,0]=4 10204 B17R1.748 CN(CCCO)COC(=O)c1ccc(cc1)F 6adf981d333fc5aa4c318b4856601155 [0,2,0,0,0,0|2,0,0]=4 10205 B17R1.748 COCCN(C)COC(=O)c1ccc(cc1)F 81499588c3545c52a020101e16876029 [0,2,0,0,0,0|2,0,0]=4 10206 B17R1.748 C[C@H](CCCO)CNC(=O)c1ccc(cc1)Br acf934f1f780ccf87e2141172e50197f [0,2,0,0,0,0|2,0,0]=4 10207 B17R1.748 C[C@H](CCCO)CNC(=O)c1ccc(cc1)Cl b4292bff772bf00464000ebe28cb2d47 [0,2,0,0,0,0|2,0,0]=4 10208 B17R1.748 C[C@H](CCCO)CNC(=O)c1ccc(cc1)F 14c4f04e8a6c759ea2e343a0ec330985 [0,2,0,0,0,0|2,0,0]=4 10209 B17R1.748 C[C@H](CCCO)CNC(=O)c1ccc(cc1)I a434c519b76497fe370d7c0d77c45b7c [0,2,0,0,0,0|2,0,0]=4 10210 B17R1.748 C[C@H](CCCO)CNC(=O)c1ccc(cc1)O 329b863bf22142d136b29a0ebc29ae92 [0,2,0,0,0,0|2,0,0]=4 10211 B17R1.748 C[C@H](CCCO)CNC(=O)c1ccc(cc1)S 7849862de357e92d3bfb9fec24918c97 [0,2,0,0,0,0|2,0,0]=4 10212 B17R1.748 Cc1ccc(cc1)C(=O)NC[C@H](C)CCCO 7462b9de3018e45c12f042a440658532 [0,2,0,0,0,0|2,0,0]=4 10213 B17R1.751 C=C(OCCCCC)C(=O)c1ccc(cc1)Cl 32ae0cb6f0696c299f73a1c8bdddf835 [0,2,0,0,0,0|2,0,0]=4 10214 B17R1.751 CCCCCCN(C)C(=O)c1cc[n+](cc1)[O-] 945e6dfd147e8e0d91e49f0613a56009 [0,2,0,0,0,0|2,0,0]=4 10215 B17R1.751 CCCCCCN(C)C(=O)c1ccc(=O)oc1 5252ec9615970f2d20d37d42d68c9227 [0,2,0,0,0,0|2,0,0]=4 10216 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)Br df387aca3ed128104dceb3fee81ae730 [0,2,0,0,0,0|1,0,0]=3 10217 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)C 72f6600d391460369544a845789ece08 [0,2,0,0,0,0|1,0,0]=3 10218 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)Cl 9a1c26e831abd61a33cc364fd3027cd8 [0,2,0,0,0,0|1,0,0]=3 10219 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)F dc78f256c75d4bb6841f407dc9038c7b [0,2,0,0,0,0|1,0,0]=3 10220 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)I 622c5b71904ef2be9017b44967fa6708 [0,2,0,0,0,0|1,0,0]=3 10221 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)O d555a3025aa3dd4cacf01d7fc7a49764 [0,2,0,0,0,0|1,0,0]=3 10222 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cc1)S 5308503afae01f7519f67f5cdb280b3a [0,2,0,0,0,0|1,0,0]=3 10223 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cn1)Br d578e644d27bcd7eaaf5f65ac23aa199 [0,2,0,0,0,0|2,0,0]=4 10224 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cn1)C 9c02e4dce7f1b0df10c100f6dae27f11 [0,2,0,0,0,0|2,0,0]=4 10225 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cn1)Cl 1bde74f145a336a9b8454e1b9bf95ce6 [0,2,0,0,0,0|2,0,0]=4 10226 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cn1)F 74e6b3c8a5a6932842d59e2ee0f78126 [0,2,0,0,0,0|2,0,0]=4 10227 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cn1)I 16b7a8db8c0485042f4b56f9e1fd12f9 [0,2,0,0,0,0|2,0,0]=4 10228 B17R1.751 CCCCCCN(C)C(=O)c1ccc(cn1)O a8de67be8aaf2fe6f8615afb939cb90c [0,2,0,0,0,0|2,0,0]=4 10229 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)Br 19df37fd6a0fd552d925157a74d76bd4 [0,2,0,0,0,0|2,0,0]=4 10230 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)C 74fc2618065f1658327efb89e8cc2e40 [0,2,0,0,0,0|2,0,0]=4 10231 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)Cl d6c152c2baea453134cd64e8fb53632d [0,2,0,0,0,0|2,0,0]=4 10232 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)F 4d9ce07a143b04bd14e2b7d3c71cda90 [0,2,0,0,0,0|2,0,0]=4 10233 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)I 62c9ae516a64f2c13a94f5ec7e525d6f [0,2,0,0,0,0|2,0,0]=4 10234 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)O 80ee98d221c25b5d98b79889a820ebd1 [0,2,0,0,0,0|2,0,0]=4 10235 B17R1.751 CCCCCCN(C)C(=O)c1ccc(nc1)S 0ccc33565aed5611f1eb849958b6ed7d [0,2,0,0,0,0|2,0,0]=4 10236 B17R1.751 CCCCCNC(=O)C(=O)c1ccc(cc1)Br c22615e95d90033bd6e09fd101a281d3 [0,2,0,0,0,0|2,0,0]=4 10237 B17R1.751 CCCCCNC(=O)C(=O)c1ccc(cc1)C 183d9d8de61719607a60a5eb68cbb5d2 [0,2,0,0,0,0|2,0,0]=4 10238 B17R1.751 CCCCCNC(=O)C(=O)c1ccc(cc1)Cl bcc0dfeec28e172544ed9ac5248e08e9 [0,2,0,0,0,0|2,0,0]=4 10239 B17R1.751 CCCCCNC(=O)C(=O)c1ccc(cc1)F 5b5ea8180aa1a207956c8fabc759e3eb [0,2,0,0,0,0|2,0,0]=4 10240 B17R1.751 CCCCCNC(=O)C(=O)c1ccc(cc1)I 68582f36ecae5a8930575f1bc9b82d78 [0,2,0,0,0,0|2,0,0]=4 10241 B17R1.751 CCCCCNC(=O)C(=O)c1ccc(cc1)O 6a17ed0227384a63fb886ea4e3986764 [0,2,0,0,0,0|2,0,0]=4 10242 B17R1.751 CCCCCNC(C)C(=O)c1ccc(cc1)C df23e85be2f020e6f5fc40dd6a64fa9e [0,2,0,0,0,0|2,0,0]=4 10243 B17R1.751 CCCCCNC(C)C(=O)c1ccc(cc1)Cl cfcc0453c13e1f8609397020d6141166 [0,2,0,0,0,0|2,0,0]=4 10244 B17R1.751 CCCCCNC(C)C(=O)c1ccc(cc1)F b3c8f3cb11456cf58c61c9850e523788 [0,2,0,0,0,0|2,0,0]=4 10245 B17R1.751 CCCCOCC(=O)C(=O)c1ccc(cc1)C ad204f0fcd8f7c3e1bd882a265445ebc [0,2,0,0,0,0|2,0,0]=4 10246 B17R1.751 CN(CCCCCO)C(=O)c1ccc(cc1)Br 5b2d65e3bb6d1513a4201f7974a1cf29 [0,2,0,0,0,0|2,0,0]=4 10247 B17R1.751 CN(CCCCCO)C(=O)c1ccc(cc1)Cl ab7e98b401ae571b0e09c65220ba6a6a [0,2,0,0,0,0|2,0,0]=4 10248 B17R1.751 CN(CCCCCO)C(=O)c1ccc(cc1)F 14d234cb32a8f7ba83eded32533be46b [0,2,0,0,0,0|2,0,0]=4 10249 B17R1.751 CN(CCCCCO)C(=O)c1ccc(cc1)I d829f9decb36e4c0c78b126b569f37f4 [0,2,0,0,0,0|2,0,0]=4 10250 B17R1.751 CN(CCCCCO)C(=O)c1ccc(cc1)O 768dd695631f5f6e57946f2de8690040 [0,2,0,0,0,0|2,0,0]=4 10251 B17R1.751 CN(CCCCCO)C(=O)c1ccc(cc1)S b156aa2ce77d64bb1266de3f42afdef2 [0,2,0,0,0,0|2,0,0]=4 10252 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)Br 31f3f9cbcb8ced1e98ec8b4e084e3b68 [0,2,0,0,0,0|2,0,0]=4 10253 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)C b28efa99a88317e93e7c8d5aab393672 [0,2,0,0,0,0|2,0,0]=4 10254 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)Cl 160c27fb097ca5ee3d4be4ac451a6e49 [0,2,0,0,0,0|2,0,0]=4 10255 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)F 8bdcd1ec8ceda0cefd9d4084c1ccd98b [0,2,0,0,0,0|2,0,0]=4 10256 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)I bb2c7c3718af6ed52dfe03e5fe49b7c9 [0,2,0,0,0,0|2,0,0]=4 10257 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)O c4a0f0696b4dea8d84b979ca53b2d444 [0,2,0,0,0,0|2,0,0]=4 10258 B17R1.751 COCCCCN(C)C(=O)c1ccc(cc1)S 7c8e27296f7adb656e1e1c0d7157757a [0,2,0,0,0,0|2,0,0]=4 10259 B17R1.751 Cc1ccc(cc1)C(=O)N(C)CCCCCO 5917ed85b4f116a1f00a6e37dca9ce43 [0,2,0,0,0,0|2,0,0]=4 10260 B17R1.968 CCCC(=S)OCOC(=O)c1ccc(cc1)F 7b87cfa5edb04114c31a73a2799b26b6 [0,2,0,0,0,0|1,0,1]=4 10261 B17R1.968 CCCC(C)CCOC(C)c1ccc(cc1)F af895996c95b09ba0c42a1fbaad7765f [0,2,0,0,0,0|1,0,1]=4 10262 B17R1.968 CCCC(C)CNCC(=O)c1ccc(cc1)Br 93d3ab8151c9be6cb0c63e4ad97b81a2 [0,2,0,0,0,0|2,0,0]=4 10263 B17R1.968 CCCC(C)CNCC(=O)c1ccc(cc1)C 95fb35464336084ff5c6df07b5b12988 [0,2,0,0,0,0|2,0,0]=4 10264 B17R1.968 CCCC(C)CNCC(=O)c1ccc(cc1)Cl ef9c7892d8020449d068539475561ab6 [0,2,0,0,0,0|2,0,0]=4 10265 B17R1.968 CCCC(C)COCC(=O)c1ccc(cc1)Br e4f2a8df0f4a40680102e3ad16a27bf8 [0,2,0,0,0,0|2,0,0]=4 10266 B17R1.968 CCCC(C)COCC(=O)c1ccc(cc1)C 6ac30a0c1e485be30bda336c6cf40195 [0,2,0,0,0,0|2,0,0]=4 10267 B17R1.968 CCCC(C)COCC(=O)c1ccc(cc1)Cl 8675fdd66dc9b53a0fd9c0eb4637b8a9 [0,2,0,0,0,0|2,0,0]=4 10268 B17R1.968 CCCC(C)COCC(=O)c1ccc(cc1)F 02e9d7d41a75156e5a264f194bf63630 [0,2,0,0,0,0|2,0,0]=4 10269 B17R1.968 CCCC(C)COCC(=O)c1ccc(cc1)I feb2307d1393d17ddb5818dafa0e993b [0,2,0,0,0,0|2,0,0]=4 10270 B17R1.968 CCCC(C)NCCC(=O)c1ccc(cc1)F fe04d2b0af8310fee86103c3380dd1ed [0,2,0,0,0,0|2,0,0]=4 10271 B17R1.968 CCCC(C)OCCC(=O)c1ccc(cc1)Cl 208f703479b217a996d43d4da5a5ce88 [0,2,0,0,0,0|2,0,0]=4 10272 B17R1.968 CCCC(C)OCCC(=O)c1ccc(cc1)F 00d9d27f965a59ad3b97bcf67be1fd03 [0,2,0,0,0,0|2,0,0]=4 10273 B17R1.968 CCCC(O)CNCC(=O)c1ccc(cc1)Br 887fa654f3dd785401830354d84d17d6 [0,2,0,0,0,0|2,0,0]=4 10274 B17R1.968 CCCC(O)CNCC(=O)c1ccc(cc1)C 7f36767550cbdd8b46363969f45fd458 [0,2,0,0,0,0|2,0,0]=4 10275 B17R1.968 CCCC(O)CNCC(=O)c1ccc(cc1)Cl 5a77d618d2f8653b5b027c3299d75cd4 [0,2,0,0,0,0|2,0,0]=4 10276 B17R1.968 CCCC(O)CNCC(=O)c1ccc(cc1)F 050d507fa553823efd56e04cdbb24e49 [0,2,0,0,0,0|2,0,0]=4 10277 B17R1.968 CCCC(O)CNCC(=O)c1ccc(cc1)I 074fc39f681a754507309dbb4c299602 [0,2,0,0,0,0|2,0,0]=4 10278 B17R1.968 CCCC(S)CCOC(C)c1ccc(cc1)Br 8dfe705881b67350d6e2f4e5050d4680 [0,2,0,0,0,0|1,0,1]=4 10279 B17R1.968 CCCC(S)CCOC(C)c1ccc(cc1)Cl f3d877be862d9e945677c7ae572dc584 [0,2,0,0,0,0|1,0,1]=4 10280 B17R1.968 CCCC(S)CCOC(C)c1ccc(cc1)F 5e06f3d25dfe9a281fd8a97b0a89b3ee [0,2,0,0,0,0|1,0,1]=4 10281 B17R1.968 CCCN(C)CCCC(=O)c1ccc(cc1)C 31ec66103bafa893eb71b1218cd85b08 [0,2,0,0,0,0|2,0,0]=4 10282 B17R1.968 CCCN(C)CCCC(=O)c1ccc(cc1)Cl 9516114ef2ad78dd4326a8302ef9247d [0,2,0,0,0,0|2,0,0]=4 10283 B17R1.968 CCCN(C)CCCC(=O)c1ccc(cc1)F b404f4a10fa70ab34c362a3c451a50dd [0,2,0,0,0,0|2,0,0]=4 10284 B17R1.968 CCC[C@@H](C)OCCC(=O)c1ccc(cc1)F 75be1304e8c89152b074a258a640b21a [0,2,0,0,0,0|2,0,0]=4 10285 B17R1.968 CCC[C@H](C)NCCC(=O)c1ccc(cc1)F 394c576ff8f7ce6d9674bcb95997a084 [0,2,0,0,0,0|2,0,0]=4 10286 B17R1.968 CCC[C@H](C)OCCC(=O)c1ccc(cc1)F d9186862a0f32c450c8b256a9b89a9c0 [0,2,0,0,0,0|2,0,0]=4 10287 B17R1.1059 C=C(C)CCNCOC(=O)c1ccc(cc1)F ba05beff57d3fef078a60e40a15e1c35 [0,2,0,0,0,0|1,0,1]=4 10288 B17R1.1059 C=C(C)CCOCOC(=O)c1ccc(cc1)F 4e140b29f2c28123cb248d766031674a [0,2,0,0,0,0|1,0,1]=4 10289 B17R1.1059 C=C(C)COCCOC(=O)c1ccc(cc1)C 7993468ad774c82b9f063b6bab20b54c [0,2,0,0,0,0|1,0,1]=4 10290 B17R1.1059 CC(=O)CCOCOC(=O)c1ccc(cc1)F 337e3ab35c9157cb98b9a02b1d249249 [0,2,0,0,0,0|1,0,1]=4 10291 B17R1.1059 CC(C)CCCCOC(C)c1ccc(cc1)Br 73556d5581e6e5837422e1736e99a2de [0,2,0,0,0,0|1,0,1]=4 10292 B17R1.1059 CC(C)CCCCOC(C)c1ccc(cc1)Cl a5065109d3e2df6ccb646259bd2427c2 [0,2,0,0,0,0|1,0,1]=4 10293 B17R1.1059 CC(C)CCCCOC(C)c1ccc(cc1)F 3903db5dee41858e3b5e1996e927366f [0,2,0,0,0,0|1,0,1]=4 10294 B17R1.1059 CC(C)CCCCOC(C)c1ccc(cc1)I f248f986afb0ab5b81a294d4c6f28852 [0,2,0,0,0,0|1,0,1]=4 10295 B17R1.1059 CC(C)CCCCO[C@@H](C)c1ccc(cc1)Br b814b4b807022b3dd73c18dc7d2c8a2f [0,2,0,0,0,0|1,0,1]=4 10296 B17R1.1059 CC(C)CCCCO[C@@H](C)c1ccc(cc1)Cl 9310609227790eff2f758d5e1d70faf7 [0,2,0,0,0,0|1,0,1]=4 10297 B17R1.1059 CC(C)CCCCO[C@@H](C)c1ccc(cc1)F af25918822066f82b9e56bce48306abe [0,2,0,0,0,0|1,0,1]=4 10298 B17R1.1059 CC(C)CCCCO[C@@H](C)c1ccc(cc1)I 965050ea8731371c0b97cd61b5362160 [0,2,0,0,0,0|1,0,1]=4 10299 B17R1.1059 CC(C)CCCCO[C@H](C)c1ccc(cc1)Br 2dcbe92a2f1d0f908bb7e323e74a67d5 [0,2,0,0,0,0|1,0,1]=4 10300 B17R1.1059 CC(C)CCCCO[C@H](C)c1ccc(cc1)Cl 60febebc48e63bf442b4654848740af5 [0,2,0,0,0,0|1,0,1]=4 10301 B17R1.1059 CC(C)CCCCO[C@H](C)c1ccc(cc1)F 64af237d4d059099e5c84dc0073ea2a0 [0,2,0,0,0,0|1,0,1]=4 10302 B17R1.1059 CC(C)CCCCO[C@H](C)c1ccc(cc1)I 16f4a3c0d3fb3c668707c1389e5ba8f6 [0,2,0,0,0,0|1,0,1]=4 10303 B17R1.1059 CC(C)CCCNCC(=O)c1ccc(cc1)Br dfda4475cdce86f5c97c039ea1cb549d [0,2,0,0,0,0|2,0,0]=4 10304 B17R1.1059 CC(C)CCCNCC(=O)c1ccc(cc1)Cl 07396ab84b1e43c3a9ff1f8896fc7ce9 [0,2,0,0,0,0|2,0,0]=4 10305 B17R1.1059 CC(C)CCCNCC(=O)c1ccc(cc1)F 43cb62e1ee6a7084393799c53c120483 [0,2,0,0,0,0|2,0,0]=4 10306 B17R1.1059 CC(C)CCCNCC(=O)c1ccc(cc1)I 79ea40e924cc898421028a1a2f59f441 [0,2,0,0,0,0|2,0,0]=4 10307 B17R1.1059 CC(C)CCCOCC(=O)c1ccc(cc1)Br c9263454cd80ca4661210fe88cc81045 [0,2,0,0,0,0|2,0,0]=4 10308 B17R1.1059 CC(C)CCCOCC(=O)c1ccc(cc1)Cl 5b090e387b1f811355eb1cd764caa54b [0,2,0,0,0,0|2,0,0]=4 10309 B17R1.1059 CC(C)CCCOCC(=O)c1ccc(cc1)F 5ff7b83f07382865e058485a44f25dbf [0,2,0,0,0,0|2,0,0]=4 10310 B17R1.1059 CC(C)CCCOCC(=O)c1ccc(cc1)I 2e41cf30b28880e3e4ad98ddd0595fb2 [0,2,0,0,0,0|2,0,0]=4 10311 B17R1.1059 CC(C)CCNCCC(=O)c1ccc(cc1)F 50feffced77b9636af65b031f57202bb [0,2,0,0,0,0|2,0,0]=4 10312 B17R1.1059 CC(C)CCNCOC(=O)c1ccc(cc1)F dae7213fcceb03e193174b103ff6dc19 [0,2,0,0,0,0|1,0,0]=3 10313 B17R1.1059 CC(C)CCOCCC(=O)c1ccc(cc1)Cl f71025a80f2d461e07cd41464446bf4a [0,2,0,0,0,0|2,0,0]=4 10314 B17R1.1059 CC(C)CCOCCC(=O)c1ccc(cc1)F ad5ea9458dc215dbb4a17015860f2150 [0,2,0,0,0,0|2,0,0]=4 10315 B17R1.1059 CC(C)CCOCOC(=O)c1ccc(cc1)F 5a55b55908b8bd70a38c2dae39c1d0c1 [0,2,0,0,0,0|1,0,0]=3 10316 B17R1.1059 CC(C)CNCCCC(=O)c1ccc(cc1)Cl 741cc9cadafccef88ed9220f5539486d [0,2,0,0,0,0|2,0,0]=4 10317 B17R1.1059 CC(C)CNCCCC(=O)c1ccc(cc1)F 46ebc96ae3468fa7742460be23b13033 [0,2,0,0,0,0|2,0,0]=4 10318 B17R1.1059 CC(C)COCCCC(=O)c1ccc(cc1)F 3a174375f5e5c6b96da4a5bf0a6840d9 [0,2,0,0,0,0|2,0,0]=4 10319 B17R1.1059 CC(C)COCCNC(=O)c1ccc(cc1)Br 3454eb2069ba31c3a47ff3995cd9a94f [0,2,0,0,0,0|2,0,0]=4 10320 B17R1.1059 CC(C)OCCCNC(=O)c1ccc(cc1)Br ef63fb639dcfcfd69e9914f25b5af38a [0,2,0,0,0,0|2,0,0]=4 10321 B17R1.1059 CC(C)OCCCNC(=O)c1ccc(cc1)Cl 49d6c13b3f567ae37898666480abe2b3 [0,2,0,0,0,0|2,0,0]=4 10322 B17R1.1059 CC(C)OCCCNC(=O)c1ccc(cc1)F f07710fd46a8a1ca7c4f8e5bec79d0c3 [0,2,0,0,0,0|2,0,0]=4 10323 B17R1.1059 CC(C)OCCCNC(=O)c1ccc(cc1)I e0362fa3a6561528c85c3dfe718effec [0,2,0,0,0,0|2,0,0]=4 10324 B17R1.1059 CC(C)OCCCNC(=O)c1ccc(cc1)O c603fabdc6e0e562b363a6ced23d0d0e [0,2,0,0,0,0|2,0,0]=4 10325 B17R1.1059 CC(C)OCCCNC(=O)c1ccc(cc1)S e90045d07398ed833fab6be1ad2a576f [0,2,0,0,0,0|2,0,0]=4 10326 B17R1.1059 CC(C)SCCCNC(=O)c1ccc(cc1)Br 5fae6cef59940ee39a18df70eb04309e [0,2,0,0,0,0|2,0,0]=4 10327 B17R1.1059 CC(C)SCCCNC(=O)c1ccc(cc1)Cl a534864aa4d408cfadc5d7bd37de9cab [0,2,0,0,0,0|2,0,0]=4 10328 B17R1.1059 CC(C)SCCCNC(=O)c1ccc(cc1)F 66619705d597354763dc32187c8a09b5 [0,2,0,0,0,0|2,0,0]=4 10329 B17R1.1059 CC(C)SCCCNC(=O)c1ccc(cc1)I 562d875279d3fdbb5409f6091336c76a [0,2,0,0,0,0|2,0,0]=4 10330 B17R1.1059 CC(C)SCCCNC(=O)c1ccc(cc1)O d01eb4820bff844b295d3939b573d292 [0,2,0,0,0,0|2,0,0]=4 10331 B17R1.1059 CC(C)SCCCNC(=O)c1ccc(cc1)S c4c23ea19e766830e02d566110542ebd [0,2,0,0,0,0|2,0,0]=4 10332 B17R1.1059 CC(F)COCCCC(=O)c1ccc(cc1)F 90787c7f28ebe91a95a4c8474e85cff8 [0,2,0,0,0,0|2,0,0]=4 10333 B17R1.1059 CC(O)CCCNCC(=O)c1ccc(cc1)Br 4ce50767b7933f27bc9ade5523294133 [0,2,0,0,0,0|2,0,0]=4 10334 B17R1.1059 CC(O)CCCNCC(=O)c1ccc(cc1)Cl 3d8392ab2b6529c189bd3c9cda8d0177 [0,2,0,0,0,0|2,0,0]=4 10335 B17R1.1059 CC(O)CCNCCC(=O)c1ccc(cc1)F 182044d9e10f5e3d9a565c20774fc08d [0,2,0,0,0,0|2,0,0]=4 10336 B17R1.1059 CC(O)CCNCOC(=O)c1ccc(cc1)F ec53c7db1fdd836cfcf16b6496729e4b [0,2,0,0,0,0|1,0,0]=3 10337 B17R1.1059 CC(O)CNCCCC(=O)c1ccc(cc1)F fcf2fed949f9582f0048cf8219a65dd2 [0,2,0,0,0,0|2,0,0]=4 10338 B17R1.1059 CC(S)COCCCC(=O)c1ccc(cc1)F f677eb885621fe22e08610b9d9986c98 [0,2,0,0,0,0|2,0,0]=4 10339 B17R1.1059 CN(C)CCCCNC(=O)c1ccc(cc1)Br f2a76461069a4c9bcba88e45b616acf2 [0,2,0,0,0,0|2,0,0]=4 10340 B17R1.1059 CN(C)CCCCNC(=O)c1ccc(cc1)Cl f83b2ff692a5b1ad979a743eaa8ab84d [0,2,0,0,0,0|2,0,0]=4 10341 B17R1.1059 CN(C)CCCCNC(=O)c1ccc(cc1)F 5eb07822b74f7c423f79c6d3143445e3 [0,2,0,0,0,0|2,0,0]=4 10342 B17R1.1059 CN(C)CCCCNC(=O)c1ccc(cc1)I d3c1ba8c985529791138532940f7b8ad [0,2,0,0,0,0|2,0,0]=4 10343 B17R1.1059 CN(C)CCCCNC(=O)c1ccc(cc1)O 9f4387b8a52a337e9f46298e89a863e8 [0,2,0,0,0,0|2,0,0]=4 10344 B17R1.1059 CN(C)CCCCNC(=O)c1ccc(cc1)S d1ac0f1af660407400ab0cc1ff58fd18 [0,2,0,0,0,0|2,0,0]=4 10345 B17R1.1059 CN(C)CCNCOC(=O)c1ccc(cc1)F b6546c6fc1d16a4df010a6492042698b [0,2,0,0,0,0|2,0,0]=4 10346 B17R1.1059 CN(C)CCOCOC(=O)c1ccc(cc1)F 7fc8d8f03bf8ffa69aa2ed65e7afd651 [0,2,0,0,0,0|2,0,0]=4 10347 B17R1.1059 CS(=O)CCNCOC(=O)c1ccc(cc1)F ce2b3e1e537f426001f39fa03f098b60 [0,2,0,0,0,0|2,0,0]=4 10348 B17R1.1059 CS(=O)CCOCOC(=O)c1ccc(cc1)F c920b1ebb41fd66342556b6b21d6fa9b [0,2,0,0,0,0|2,0,0]=4 10349 B17R1.1059 C[C@@H](F)COCCCC(=O)c1ccc(cc1)F 28b5ac3f6c1e7b3200f814e6aeeca47e [0,2,0,0,0,0|2,0,0]=4 10350 B17R1.1059 C[C@@H](O)CCNCCC(=O)c1ccc(cc1)F c22d28226846bb51c4df5ce31bb79b2b [0,2,0,0,0,0|2,0,0]=4 10351 B17R1.1059 C[C@@H](O)CCNCOC(=O)c1ccc(cc1)F 4fae482ce5ba6c8165d1e5e1e09aa2dd [0,2,0,0,0,0|1,0,0]=3 10352 B17R1.1059 C[C@@H](O)CNCCCC(=O)c1ccc(cc1)F bcd4b8cde5340377bc442fa3e8d220fe [0,2,0,0,0,0|2,0,0]=4 10353 B17R1.1059 C[C@H](F)COCCCC(=O)c1ccc(cc1)F 3cc3c364490c7cb4c64cd7181c28fc30 [0,2,0,0,0,0|2,0,0]=4 10354 B17R1.1059 C[C@H](O)CCNCCC(=O)c1ccc(cc1)F 3ced1de5d8aa1c3eb0fe8e2fb2a6c6aa [0,2,0,0,0,0|2,0,0]=4 10355 B17R1.1059 C[C@H](O)CCNCOC(=O)c1ccc(cc1)F c5769d2d626296832ab0c45441f5b884 [0,2,0,0,0,0|1,0,0]=3 10356 B17R1.1059 C[C@H](O)CNCCCC(=O)c1ccc(cc1)F ed9ac4e16f7890ae2b1e42f3793e4da9 [0,2,0,0,0,0|2,0,0]=4 10357 B17R1.1059 Cc1ccc(cc1)C(=O)CCCNCC(C)C fae50a5ae1601e7162e1d49d3b455583 [0,2,0,0,0,0|2,0,0]=4 10358 B17R1.1059 Cc1ccc(cc1)C(=O)CCCNCC(C)O d2424435b4ba1085a368e379c4415a8f [0,2,0,0,0,0|2,0,0]=4 10359 B17R1.1059 Cc1ccc(cc1)C(=O)CCCNC[C@@H](C)O 9a40eded4b0b559d8451375abe71dadd [0,2,0,0,0,0|2,0,0]=4 10360 B17R1.1059 Cc1ccc(cc1)C(=O)CCCNC[C@H](C)O dfd391514b14cbeb3eb15cfdffa9b39a [0,2,0,0,0,0|2,0,0]=4 10361 B17R1.1059 Cc1ccc(cc1)C(=O)CCNCCC(C)O 6664633b0e6afd6d04bd55efed43794a [0,2,0,0,0,0|2,0,0]=4 10362 B17R1.1059 Cc1ccc(cc1)C(=O)CCNCC[C@@H](C)O b02b52d9c44c0f50532e32a0dd6f21ed [0,2,0,0,0,0|2,0,0]=4 10363 B17R1.1059 Cc1ccc(cc1)C(=O)CCNCC[C@H](C)O 1344a33d2be8f5cc625861f8bfad4ef2 [0,2,0,0,0,0|2,0,0]=4 10364 B17R1.1059 Cc1ccc(cc1)C(=O)CCOCCC(C)C 33e3960ad4f830e220b6d0a762d783e5 [0,2,0,0,0,0|2,0,0]=4 10365 B17R1.1059 Cc1ccc(cc1)C(=O)CNCCCC(C)C 98cf49bb4c8df24bc118f72c5978def7 [0,2,0,0,0,0|2,0,0]=4 10366 B17R1.1059 Cc1ccc(cc1)C(=O)CNCCCC(C)O 2e051f69555f866ab26ed60184487128 [0,2,0,0,0,0|2,0,0]=4 10367 B17R1.1059 Cc1ccc(cc1)C(=O)COCCCC(C)C c99f29f97e22031a017ff05d9370f270 [0,2,0,0,0,0|2,0,0]=4 10368 B17R1.1059 Cc1ccc(cc1)C(=O)NCCCCC(F)F 789424fbc8697a1c349dadb19e035321 [0,2,0,0,0,0|2,0,0]=4 10369 B17R1.1059 Cc1ccc(cc1)C(=O)NCCCCN(C)C f7ccc2857709a5d524a5ba284a687a6d [0,2,0,0,0,0|2,0,0]=4 10370 B17R1.1059 Cc1ccc(cc1)C(=O)NCCCOC(C)C aeb254b022a6359babb13c77255ad4d1 [0,2,0,0,0,0|2,0,0]=4 10371 B17R1.1059 Cc1ccc(cc1)C(=O)NCCCSC(C)C a76bfc7eb3484e800739ae70b191e31b [0,2,0,0,0,0|2,0,0]=4 10372 B17R1.1059 Cc1ccc(cc1)C(=O)NCCOCC(C)C c8608ffa6bbc288888a64293e3be4739 [0,2,0,0,0,0|2,0,0]=4 10373 B17R1.1059 Cc1ccc(cc1)C(=O)OCCOCC(C)C 149f493199c8af2bbbc92bef6489a8c2 [0,2,0,0,0,0|1,0,0]=3 10374 B17R1.1059 Cc1ccc(cc1)C(=O)OCCOCC(F)F 41ea05eb608ef0903b3fb5e48f321cd6 [0,2,0,0,0,0|2,0,0]=4 10375 B17R1.1059 Cc1ccc(cc1)C(=O)OCCOCN(C)C e055f3cd648ad82d4b44fc28cae30e34 [0,2,0,0,0,0|2,0,0]=4 10376 B17R1.1059 Cc1ccc(cc1)C(C)OCCCCC(C)C c039d7f51f9e5ba536333562a9d64cbc [0,2,0,0,0,0|1,0,1]=4 10377 B17R1.1059 Cc1ccc(cc1)[C@@H](C)OCCCCC(C)C c3a12c91ff992bb39a081e2ad97e1a5f [0,2,0,0,0,0|1,0,1]=4 10378 B17R1.1059 Cc1ccc(cc1)[C@H](C)OCCCCC(C)C 35a4695cb56837037513553bfb9eef6d [0,2,0,0,0,0|1,0,1]=4 10379 B17R1.1059 O=C(NCCCCC(F)F)c1ccc(cc1)Br 991ce26f7bda73ab840cedcd11412b22 [0,2,0,0,0,0|2,0,0]=4 10380 B17R1.1059 O=C(NCCCCC(F)F)c1ccc(cc1)Cl 1888d4d61503d31f7814f7f0baeef433 [0,2,0,0,0,0|2,0,0]=4 10381 B17R1.1059 O=C(NCCCCC(F)F)c1ccc(cc1)F 240c6b88768f3190e7dfae1a72d59a48 [0,2,0,0,0,0|2,0,0]=4 10382 B17R1.1059 O=C(NCCCCC(F)F)c1ccc(cc1)I 96256fe45ad787b4cb58ec7d2bb9040c [0,2,0,0,0,0|2,0,0]=4 10383 B17R1.1059 O=C(NCCCCC(F)F)c1ccc(cc1)O 07b58ca6dfbaf2556284df47ab46f243 [0,2,0,0,0,0|2,0,0]=4 10384 B17R1.1059 O=C(NCCCCC(F)F)c1ccc(cc1)S 6fe7c415085d35e8d3db7f42fb948d2b [0,2,0,0,0,0|2,0,0]=4 10385 B17R1.1059 O=C(OCNCCC(F)F)c1ccc(cc1)F 80ecd70b7c82399463f1571fbb8c40e2 [0,2,0,0,0,0|2,0,0]=4 10386 B17R1.1059 O=C(OCOCCC(F)F)c1ccc(cc1)F 50ec39f9d746c97152ecb164bb54da93 [0,2,0,0,0,0|2,0,0]=4 10387 B17R1.1185 CC(CO)CCCNC(=O)c1ccc(cc1)Br c3aa33dc16c8633b4da49d93b6a2bc67 [0,2,0,0,0,0|2,0,0]=4 10388 B17R1.1185 CC(CO)CCCNC(=O)c1ccc(cc1)Cl 9abdec257d78da26e078f3175d2cd386 [0,2,0,0,0,0|2,0,0]=4 10389 B17R1.1185 CC(CO)CCCNC(=O)c1ccc(cc1)F cc0d4dce8fedb70851c8f3bda73c2013 [0,2,0,0,0,0|2,0,0]=4 10390 B17R1.1185 CC(CO)CCCNC(=O)c1ccc(cc1)I ec20d2c229594340e2485ef57b06331f [0,2,0,0,0,0|2,0,0]=4 10391 B17R1.1185 CC(CO)CCCNC(=O)c1ccc(cc1)O 51ee025b5a0db42a9b0b23b62b59e309 [0,2,0,0,0,0|2,0,0]=4 10392 B17R1.1185 CC(CO)CCCNC(=O)c1ccc(cc1)S 1d15b1b856aff7fb7d6815aacbdd8cea [0,2,0,0,0,0|2,0,0]=4 10393 B17R1.1185 CC(CO)CNCOC(=O)c1ccc(cc1)F bfd89b533cf2c3b29774d45d7effe534 [0,2,0,0,0,0|2,0,0]=4 10394 B17R1.1185 CCC(=O)COCOC(=O)c1ccc(cc1)F 81eeb114d76c4c3edc31a010a05f6cd9 [0,2,0,0,0,0|1,0,1]=4 10395 B17R1.1185 CCC(C)CCCOC(C)c1ccc(cc1)F 443e6f6a22321acd6188f57dc3013c43 [0,2,0,0,0,0|1,0,1]=4 10396 B17R1.1185 CCC(C)CCNCC(=O)c1ccc(cc1)Br d351aa738fc6ae8555b40103db396cb2 [0,2,0,0,0,0|2,0,0]=4 10397 B17R1.1185 CCC(C)CCNCC(=O)c1ccc(cc1)C a77566fcb3d1c33c5e50b246e9f5ad7e [0,2,0,0,0,0|2,0,0]=4 10398 B17R1.1185 CCC(C)CCNCC(=O)c1ccc(cc1)Cl 3f8e1e6b7c960f11a0b73c3d34e97f79 [0,2,0,0,0,0|2,0,0]=4 10399 B17R1.1185 CCC(C)CCNCC(=O)c1ccc(cc1)F c315ada1fda15435adcc28fcc7c97163 [0,2,0,0,0,0|2,0,0]=4 10400 B17R1.1185 CCC(C)CCNCC(=O)c1ccc(cc1)I b83f617ed9d7fc2cfdaa5d50c24eaebf [0,2,0,0,0,0|2,0,0]=4 10401 B17R1.1185 CCC(C)CCOCC(=O)c1ccc(cc1)Br 07c722e5eb7a03188eb52b62e39bce4a [0,2,0,0,0,0|2,0,0]=4 10402 B17R1.1185 CCC(C)CCOCC(=O)c1ccc(cc1)C ba7b723285c76ac1aa29b3d35b1bbe24 [0,2,0,0,0,0|2,0,0]=4 10403 B17R1.1185 CCC(C)CCOCC(=O)c1ccc(cc1)Cl b76ab749e2b2da7ac8e6741586e33c90 [0,2,0,0,0,0|2,0,0]=4 10404 B17R1.1185 CCC(C)CCOCC(=O)c1ccc(cc1)F 24519aa3e1cfbb11663870dba71639e8 [0,2,0,0,0,0|2,0,0]=4 10405 B17R1.1185 CCC(C)CCOCC(=O)c1ccc(cc1)I aeffa7874ae96ae57d61d4db0ba0bde9 [0,2,0,0,0,0|2,0,0]=4 10406 B17R1.1185 CCC(C)CNCCC(=O)c1ccc(cc1)C 6f642ef5d5abf63f3eff174f78665e74 [0,2,0,0,0,0|2,0,0]=4 10407 B17R1.1185 CCC(C)CNCCC(=O)c1ccc(cc1)F eae7f3ae73bffdcbd4dbebb899c0ee13 [0,2,0,0,0,0|2,0,0]=4 10408 B17R1.1185 CCC(C)CNCOC(=O)c1ccc(cc1)F fe7fb6749825aca76c8c794e38d9a57b [0,2,0,0,0,0|1,0,0]=3 10409 B17R1.1185 CCC(C)COCCC(=O)c1ccc(cc1)C f72d9328006638189678417c71912027 [0,2,0,0,0,0|2,0,0]=4 10410 B17R1.1185 CCC(C)COCCC(=O)c1ccc(cc1)Cl 63ac988e58c251d127191af7bb19add7 [0,2,0,0,0,0|2,0,0]=4 10411 B17R1.1185 CCC(C)COCCC(=O)c1ccc(cc1)F 967561e9316d18bf2c6d931870dedf4b [0,2,0,0,0,0|2,0,0]=4 10412 B17R1.1185 CCC(C)COCOC(=O)c1ccc(cc1)F 44c79d846b69c6673c43e60a8d54f48d [0,2,0,0,0,0|1,0,0]=3 10413 B17R1.1185 CCC(C)NCCCC(=O)c1ccc(cc1)C c990ea7adb95177c7fbf56d4c2c29558 [0,2,0,0,0,0|2,0,0]=4 10414 B17R1.1185 CCC(C)NCCCC(=O)c1ccc(cc1)Cl 0098adf9d03297a611451c93d27d393f [0,2,0,0,0,0|2,0,0]=4 10415 B17R1.1185 CCC(C)NCCCC(=O)c1ccc(cc1)F 60c7efd01122944195f8e19f4dfdca21 [0,2,0,0,0,0|2,0,0]=4 10416 B17R1.1185 CCC(C)OCCCC(=O)c1ccc(cc1)F 5933921c8684b7f89c5ac8a51640da94 [0,2,0,0,0,0|2,0,0]=4 10417 B17R1.1185 CCC(C)OCCNC(=O)c1ccc(cc1)Br d390d8c2fa24af7be3322c7888d58a97 [0,2,0,0,0,0|2,0,0]=4 10418 B17R1.1185 CCC(C)OCCNC(=O)c1ccc(cc1)C 76b90631af5cd271dfb3c6d811d57e66 [0,2,0,0,0,0|2,0,0]=4 10419 B17R1.1185 CCC(C)OCCOC(=O)c1ccc(cc1)C 5ab1dc69fd69a81c548a6919bf4b9968 [0,2,0,0,0,0|1,0,0]=3 10420 B17R1.1185 CCC(O)CNCCC(=O)c1ccc(cc1)C 5955cff32daa46e64f33ed21f5ab28f4 [0,2,0,0,0,0|2,0,0]=4 10421 B17R1.1185 CCC(O)CNCCC(=O)c1ccc(cc1)F 9a27bef4d822f6d1d322c78886beeb1b [0,2,0,0,0,0|2,0,0]=4 10422 B17R1.1185 CCC(O)CNCOC(=O)c1ccc(cc1)F 309484f7940edcaf2aa14885ef26ef73 [0,2,0,0,0,0|1,0,0]=3 10423 B17R1.1185 CCC(S)CCOCC(=O)c1ccc(cc1)Br b8994336cfa3519362a8bee078b33993 [0,2,0,0,0,0|2,0,0]=4 10424 B17R1.1185 CCC(S)CCOCC(=O)c1ccc(cc1)C 60fe4bc1e1a280622663c1d6d4aaa8e7 [0,2,0,0,0,0|2,0,0]=4 10425 B17R1.1185 CCC(S)CCOCC(=O)c1ccc(cc1)Cl e37964a1b2d097457fd5876ea97e5fe9 [0,2,0,0,0,0|2,0,0]=4 10426 B17R1.1185 CCC(S)CCOCC(=O)c1ccc(cc1)F 43de8abf6d60d1a532ec163cd43b402f [0,2,0,0,0,0|2,0,0]=4 10427 B17R1.1185 CCC(S)CCOCC(=O)c1ccc(cc1)I 3c8f9af45a075c300e2d4707bd8f4aad [0,2,0,0,0,0|2,0,0]=4 10428 B17R1.1185 CCN(C)CCCCC(=O)c1ccc(cc1)F 30f159d4923145251085e0c4fcf94634 [0,2,0,0,0,0|2,0,0]=4 10429 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)Br bf62e6c1863037a9a8143814bde79def [0,2,0,0,0,0|2,0,0]=4 10430 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)C a31a43faa91d7ce0b7a18046f95e1cae [0,2,0,0,0,0|2,0,0]=4 10431 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)Cl 3bb25952cd17f3e90eaf6f76293aa5fb [0,2,0,0,0,0|2,0,0]=4 10432 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)F c4758670c0b67bdd7e203057749252c3 [0,2,0,0,0,0|2,0,0]=4 10433 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)I adcfd42323bc3b68d506961d00d39945 [0,2,0,0,0,0|2,0,0]=4 10434 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)O 8e35700326b7ee65ce751e6ae7722f1d [0,2,0,0,0,0|2,0,0]=4 10435 B17R1.1185 CCN(C)CCCNC(=O)c1ccc(cc1)S 74de755110c308bdd99f6f45a97bd587 [0,2,0,0,0,0|2,0,0]=4 10436 B17R1.1185 CC[C@@H](C)COCCC(=O)c1ccc(cc1)C b9dc7d6119eedc925e35eb86a8edd1f1 [0,2,0,0,0,0|2,0,0]=4 10437 B17R1.1185 CC[C@@H](C)COCCC(=O)c1ccc(cc1)Cl ad724512842eb77bc388ab6995131298 [0,2,0,0,0,0|2,0,0]=4 10438 B17R1.1185 CC[C@@H](C)COCCC(=O)c1ccc(cc1)F bd0acb7ece2e9df89982e0f2f6f5d2f4 [0,2,0,0,0,0|2,0,0]=4 10439 B17R1.1185 CC[C@@H](C)COCOC(=O)c1ccc(cc1)F 5a200de7e73179f466ed638a929bf2eb [0,2,0,0,0,0|1,0,0]=3 10440 B17R1.1185 CC[C@@H](C)NCCCC(=O)c1ccc(cc1)C b4373c96a5f28cd70ab63f1880b68d87 [0,2,0,0,0,0|2,0,0]=4 10441 B17R1.1185 CC[C@@H](C)NCCCC(=O)c1ccc(cc1)Cl 4fbd7b9db6611d5948dd743a4ad54582 [0,2,0,0,0,0|2,0,0]=4 10442 B17R1.1185 CC[C@@H](C)NCCCC(=O)c1ccc(cc1)F a53f0ffaf981bdeb3012b01262fe1a9c [0,2,0,0,0,0|2,0,0]=4 10443 B17R1.1185 CC[C@@H](C)OCCCC(=O)c1ccc(cc1)F 23456e7aec6192047a0a50bb256ab39c [0,2,0,0,0,0|2,0,0]=4 10444 B17R1.1185 CC[C@@H](O)CNCCC(=O)c1ccc(cc1)C 8dd331d15005577a8d9231acde4fe37b [0,2,0,0,0,0|2,0,0]=4 10445 B17R1.1185 CC[C@@H](O)CNCCC(=O)c1ccc(cc1)F 7759503ce4dbee834ef79166e8da9ecf [0,2,0,0,0,0|2,0,0]=4 10446 B17R1.1185 CC[C@@H](O)CNCOC(=O)c1ccc(cc1)F 6f13476b4aedade5d29dd8fd71cf7cac [0,2,0,0,0,0|1,0,0]=3 10447 B17R1.1185 CC[C@H](C)CCCOC(C)c1ccc(cc1)F 4bcd3661cbefe5366f7aca1db3347097 [0,2,0,0,0,0|1,0,1]=4 10448 B17R1.1185 CC[C@H](C)CCOCC(=O)c1ccc(cc1)Br e3c04ca67fd4dc14653d878606d80371 [0,2,0,0,0,0|2,0,0]=4 10449 B17R1.1185 CC[C@H](C)CCOCC(=O)c1ccc(cc1)C 226872c411818a4e496cca478f53b961 [0,2,0,0,0,0|2,0,0]=4 10450 B17R1.1185 CC[C@H](C)CCOCC(=O)c1ccc(cc1)Cl 26749a062ae2e3c4c5d2ecb1560a8487 [0,2,0,0,0,0|2,0,0]=4 10451 B17R1.1185 CC[C@H](C)CCOCC(=O)c1ccc(cc1)F 4b5bf87782d6413d7a9e6d261025e8a1 [0,2,0,0,0,0|2,0,0]=4 10452 B17R1.1185 CC[C@H](C)CCOCC(=O)c1ccc(cc1)I 5f360fb45773d44eef88614ab59e5672 [0,2,0,0,0,0|2,0,0]=4 10453 B17R1.1185 CC[C@H](C)CNCCC(=O)c1ccc(cc1)C 90d0406c46eef7b025a293339f914abc [0,2,0,0,0,0|2,0,0]=4 10454 B17R1.1185 CC[C@H](C)CNCCC(=O)c1ccc(cc1)F 1826788665a39eeba529cc7c119ac1b2 [0,2,0,0,0,0|2,0,0]=4 10455 B17R1.1185 CC[C@H](C)CNCOC(=O)c1ccc(cc1)F b234b2f224a2085779fe454766050600 [0,2,0,0,0,0|1,0,0]=3 10456 B17R1.1185 CC[C@H](C)COCCC(=O)c1ccc(cc1)C f831cf5666c976285fd27fdd41942566 [0,2,0,0,0,0|2,0,0]=4 10457 B17R1.1185 CC[C@H](C)COCCC(=O)c1ccc(cc1)Cl 00eb6996f3b737130a2c5244418c2331 [0,2,0,0,0,0|2,0,0]=4 10458 B17R1.1185 CC[C@H](C)COCCC(=O)c1ccc(cc1)F b93f2b505b0c723db4f56c2b05674850 [0,2,0,0,0,0|2,0,0]=4 10459 B17R1.1185 CC[C@H](C)COCOC(=O)c1ccc(cc1)F a821c49c1d7c0b07b7f803549470d896 [0,2,0,0,0,0|1,0,0]=3 10460 B17R1.1185 CC[C@H](C)NCCCC(=O)c1ccc(cc1)C 7a6f66a3187b702440a802f1bb463461 [0,2,0,0,0,0|2,0,0]=4 10461 B17R1.1185 CC[C@H](C)NCCCC(=O)c1ccc(cc1)Cl e08864ccc3266cbdb12210ccc24f28f5 [0,2,0,0,0,0|2,0,0]=4 10462 B17R1.1185 CC[C@H](C)NCCCC(=O)c1ccc(cc1)F 112d7efa8840b6be9f9d897220ceddd7 [0,2,0,0,0,0|2,0,0]=4 10463 B17R1.1185 CC[C@H](C)OCCCC(=O)c1ccc(cc1)F a0efa0b4f23d2244a0124475442d7cf8 [0,2,0,0,0,0|2,0,0]=4 10464 B17R1.1185 COC(C)COCOC(=O)c1ccc(cc1)F bac3955ebe2f8515f50c2a79dbf8fa74 [0,2,0,0,0,0|2,0,0]=4 10465 B17R1.1185 CO[C@@H](C)CNCOC(=O)c1ccc(cc1)F a6fff43f08ac62bab37d060b53db9286 [0,2,0,0,0,0|2,0,0]=4 10466 B17R1.1185 CO[C@@H](C)COCOC(=O)c1ccc(cc1)F e85ca8fdd113c599029abed49c9bacc1 [0,2,0,0,0,0|2,0,0]=4 10467 B17R1.1185 CO[C@H](C)CNCOC(=O)c1ccc(cc1)F 8282fb1a6dc1a78cb9efa2e8e8c56f71 [0,2,0,0,0,0|2,0,0]=4 10468 B17R1.1185 CO[C@H](C)COCOC(=O)c1ccc(cc1)F 5493edf4c442e94c6bf56bd1b3bec2d3 [0,2,0,0,0,0|2,0,0]=4 10469 B17R1.1185 C[C@H](CO)CNCOC(=O)c1ccc(cc1)F 1e248b4df84d6385e3c9cdc7dbfc4cbf [0,2,0,0,0,0|2,0,0]=4 10470 B17R1.1185 Cc1ccc(cc1)C(=O)NCCCC(C)CO fca9f06159007e646e0b7e13b8c6f96c [0,2,0,0,0,0|2,0,0]=4 10471 B17R1.1185 O=C(OCNCC(Br)CBr)c1ccc(cc1)F 66bd337c7133dd317f98ba1fe3920084 [0,2,0,0,0,0|2,0,0]=4 10472 B17R1.1185 O=C(OCNCC(F)CO)c1ccc(cc1)F a83395fe7ac20f40c94159a8fd55da67 [0,2,0,0,0,0|2,0,0]=4 10473 B17R1.1185 O=C(OCNCC(O)CO)c1ccc(cc1)F b6179e1df9dbd29d72fbd95ff7a8364b [0,2,0,0,0,0|2,0,0]=4 10474 B17R1.1185 O=C(OCNC[C@@H](F)CO)c1ccc(cc1)F 56d02b79981999560368d530f8a89c91 [0,2,0,0,0,0|2,0,0]=4 10475 B17R1.1185 O=C(OCNC[C@@H](O)CO)c1ccc(cc1)F 27424d62bf6a5a3289823a319cf71ba1 [0,2,0,0,0,0|2,0,0]=4 10476 B17R1.1185 O=C(OCNC[C@H](F)CO)c1ccc(cc1)F 4d720e5216b3f840ae0c56cd79ea7ec7 [0,2,0,0,0,0|2,0,0]=4 10477 B17R1.1185 O=C(OCNC[C@H](O)CO)c1ccc(cc1)F 85cb17ef66cd0d88201595bc269d7141 [0,2,0,0,0,0|2,0,0]=4 10478 B17R1.1185 O=C(OCOCC(Br)CBr)c1ccc(cc1)F 18ab9d4afe1d9ef6b241d61a931d17bc [0,2,0,0,0,0|2,0,0]=4 10479 B17R1.1185 O=C(OCOCC(Cl)CCl)c1ccc(cc1)F b8caaa599558dd564248ad0ee865758a [0,2,0,0,0,0|2,0,0]=4 10480 B17R1.1185 O=C(OCOCC(S)CS)c1ccc(cc1)F 7fe467701dd46b819ba211fbf8c4ea9a [0,2,0,0,0,0|2,0,0]=4 10481 B17R1.1246 CCCCCCOC(C)(C)c1ccc(cc1)Br 0ca97c33fafd0e47dd3032954cf157dc [0,2,0,0,0,0|1,0,1]=4 10482 B17R1.1246 CCCCCCOC(C)(C)c1ccc(cc1)C f92ee357d14e413e86a293b4ff888498 [0,2,0,0,0,0|1,0,1]=4 10483 B17R1.1246 CCCCCCOC(C)(C)c1ccc(cc1)Cl 4a01e4e657d380903f67c9a67020996a [0,2,0,0,0,0|1,0,1]=4 10484 B17R1.1246 CCCCCCOC(C)(C)c1ccc(cc1)F f7586e22fc8a49f093fbb5cc5fda2430 [0,2,0,0,0,0|1,0,1]=4 10485 B17R1.1246 CCCCCCOC(C)(C)c1ccc(cc1)I 6e734ce54e02bcc7426ab28cfbf90607 [0,2,0,0,0,0|1,0,1]=4 10486 B17R1.1246 CCCNCCOS(=O)(=O)c1ccc(cc1)C 385ec1f15afb10fea68e9f4a791d2c6f [0,2,0,0,0,0|2,0,0]=4 10487 B17R1.1246 CCCOCCOS(=O)(=O)c1ccc(cc1)C 41e01052926cdcd7862db0d01fc36b15 [0,2,0,0,0,0|2,0,0]=4 10488 B17R1.1246 CCOCCCOS(=O)(=O)c1ccc(cc1)C d26271b82342a13c334c2dade8076488 [0,2,0,0,0,0|2,0,0]=4 10489 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCCCCC 5bd465314b56385720a8e576154be953 [0,2,0,0,0,0|1,0,0]=3 10490 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCCCCCl 200a43902f489c2e4b1a6f599bad0ded [0,2,0,0,0,0|2,0,0]=4 10491 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCCCCO 5b2f64d0bfcbe6af6d30e7ed30e411fb [0,2,0,0,0,0|2,0,0]=4 10492 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCCCOC cb80665936fb926acd0fdec46acd3904 [0,2,0,0,0,0|2,0,0]=4 10493 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCCCSC 96dcc767017399cd0c69480980936f10 [0,2,0,0,0,0|2,0,0]=4 10494 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCCOCC ab6236c7eff642a865e76f0629ed79bb [0,2,0,0,0,0|2,0,0]=4 10495 B17R1.9256 C#Cc1ccc(cc1)C(=O)NCCOCCC ec995fe4e64606176fbf3b50addfc5cb [0,2,0,0,0,0|2,0,0]=4 10496 B17R1.9256 C#Cc1ccc(cn1)C(=O)NCCCCCC 074e448110f34837da727bca895c3692 [0,2,0,0,0,0|2,0,0]=4 10497 B17R1.9256 C#Cc1ccc(nc1)C(=O)NCCCCCC bb5fbe4d94bc815c4eee3f99e5a7310a [0,2,0,0,0,0|2,0,0]=4 10498 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCCCCC 3f1f77b91a07e07f51bfe150d72301ec [0,2,0,0,0,0|1,0,0]=3 10499 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCCCCCl b8a68bd501d75880954513c8404fa97a [0,2,0,0,0,0|2,0,0]=4 10500 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCCCCO 5eb9434e79805b003da8315a2120c8e2 [0,2,0,0,0,0|2,0,0]=4 10501 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCCCOC 30dac05111d37e905d9bccde64d66bfe [0,2,0,0,0,0|2,0,0]=4 10502 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCCCSC 304fecce37ed5379c8c5442983f20bb5 [0,2,0,0,0,0|2,0,0]=4 10503 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCCOCC 613b2e36db7006e09b39cc213e1a0e7e [0,2,0,0,0,0|2,0,0]=4 10504 B17R1.9256 C=Cc1ccc(cc1)C(=O)NCCOCCC 33f7a79a6f6b8be9f5458848a0139ec4 [0,2,0,0,0,0|2,0,0]=4 10505 B17R1.9256 C=Cc1ccc(cn1)C(=O)NCCCCCC c7386c7f63c3706d9c5c261323dcdc02 [0,2,0,0,0,0|2,0,0]=4 10506 B17R1.9256 C=Cc1ccc(nc1)C(=O)NCCCCCC ea75c37c985617d6a7ca3fb26b94137f [0,2,0,0,0,0|2,0,0]=4 10507 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)C#N 55214d3a81671a285513386a3844ac7f [0,2,0,0,0,0|1,0,0]=3 10508 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)C=O 8508cf38bf94393ed07a40c641fdcd25 [0,2,0,0,0,0|1,0,0]=3 10509 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)CC 1aee0d3ca390c353aee019779a0d1061 [0,2,0,0,0,0|1,0,0]=3 10510 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)CF fbe6a4755778cdfa4096bbbd202dab8b [0,2,0,0,0,0|1,0,0]=3 10511 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)CO 503b0dc4157a9c83ec3625a450cf8169 [0,2,0,0,0,0|1,0,0]=3 10512 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)CS 85498209e44b1702e94e2cf755da3433 [0,2,0,0,0,0|1,0,0]=3 10513 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)NO 9fac9a0fa5bd5b8266889477ace00913 [0,2,0,0,0,0|1,0,0]=3 10514 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)OC e43a5324754da55ef2d2706fd785e90c [0,2,0,0,0,0|1,0,0]=3 10515 B17R1.9256 CCCCCCNC(=O)c1ccc(cc1)SC 7f30b5d95f8cbbdd7038d84cf70d0bac [0,2,0,0,0,0|1,0,0]=3 10516 B17R1.9256 CCCCCCNC(=O)c1ccc(cn1)C#N 6f5f8b05e8916797fa5e17bf6104b89e [0,2,0,0,0,0|2,0,0]=4 10517 B17R1.9256 CCCCCCNC(=O)c1ccc(cn1)C=O 6d3615d7afd1dd17d1830a277df28c5c [0,2,0,0,0,0|2,0,0]=4 10518 B17R1.9256 CCCCCCNC(=O)c1ccc(cn1)CC ebb48354765f0da4da8a3d8fac8e0cba [0,2,0,0,0,0|2,0,0]=4 10519 B17R1.9256 CCCCCCNC(=O)c1ccc(cn1)CO 6f314b9dad03cf7466ac424b6d7a891b [0,2,0,0,0,0|2,0,0]=4 10520 B17R1.9256 CCCCCCNC(=O)c1ccc(cn1)OC ab017b32207d0b8c12754e20b61ee410 [0,2,0,0,0,0|2,0,0]=4 10521 B17R1.9256 CCCCCCNC(=O)c1ccc(cn1)SC 202f391899aae8370baf62f6cab0fb91 [0,2,0,0,0,0|2,0,0]=4 10522 B17R1.9256 CCCCCCNC(=O)c1ccc(nc1)C#N 613f9129f33bb9f1ad6249182da96d44 [0,2,0,0,0,0|2,0,0]=4 10523 B17R1.9256 CCCCCCNC(=O)c1ccc(nc1)C=O 1ddba2f5a4997f2a236eb37282dfb4ea [0,2,0,0,0,0|2,0,0]=4 10524 B17R1.9256 CCCCCCNC(=O)c1ccc(nc1)CC c6ea3a86cfdbe2d300a2b398a4719c62 [0,2,0,0,0,0|2,0,0]=4 10525 B17R1.9256 CCCCCCNC(=O)c1ccc(nc1)CO c9d914f57f02c7796781ff34b9eb6303 [0,2,0,0,0,0|2,0,0]=4 10526 B17R1.9256 CCCCCCNC(=O)c1ccc(nc1)OC d9bacf1f3ba990fe94d5f6c9e4ba55d9 [0,2,0,0,0,0|2,0,0]=4 10527 B17R1.9256 CCCCCCNC(=O)c1ccc(nc1)SC 7721e6c2b69204cd49874c31d2becc2f [0,2,0,0,0,0|2,0,0]=4 10528 B17R1.9256 CCCCCCOC(C)c1ccc(cc1)C=O d6e920709273a6ab564b299277c12ae7 [0,2,0,0,0,0|1,0,1]=4 10529 B17R1.9256 CCCCCCOC(C)c1ccc(cc1)OC 8270428575cc266b2e06beeeb3bda9c5 [0,2,0,0,0,0|1,0,1]=4 10530 B17R1.9256 CCCCCCO[C@@H](C)c1ccc(cc1)OC ce54f3a783ae6edc6d1a73a0f2813e06 [0,2,0,0,0,0|1,0,1]=4 10531 B17R1.9256 CCCCCCO[C@H](C)c1ccc(cc1)OC 9d8a101bcdd6839adde0e4e9869fbf50 [0,2,0,0,0,0|1,0,1]=4 10532 B17R1.9256 CCCCCNCC(=O)c1ccc(cc1)C#N 1d31fb315d39c311f00fdb84b2a67b16 [0,2,0,0,0,0|2,0,0]=4 10533 B17R1.9256 CCCCCNCC(=O)c1ccc(cc1)CC 8dc4070baea9cb538b791a47700d170b [0,2,0,0,0,0|2,0,0]=4 10534 B17R1.9256 CCCCCNCC(=O)c1ccc(cc1)CF 5c2bc887fe27086b7f5177b5658da0a8 [0,2,0,0,0,0|2,0,0]=4 10535 B17R1.9256 CCCCCNCC(=O)c1ccc(cc1)OC 886627516cf82418d3fac6892ad78e13 [0,2,0,0,0,0|2,0,0]=4 10536 B17R1.9256 CCCCCNCC(=O)c1ccc(cc1)SC 9e963f7c788e3c6811148707075706f5 [0,2,0,0,0,0|2,0,0]=4 10537 B17R1.9256 CCCCCOCC(=O)c1ccc(cc1)C#N 1bcb81a648707cc0d96447c5dc4b488a [0,2,0,0,0,0|2,0,0]=4 10538 B17R1.9256 CCCCCOCC(=O)c1ccc(cc1)CC 2b455b9c42c37e40acf918fde98b0d73 [0,2,0,0,0,0|2,0,0]=4 10539 B17R1.9256 CCCCCOCC(=O)c1ccc(cc1)CF aeb2975f223712f76c7e18fd872e69e8 [0,2,0,0,0,0|2,0,0]=4 10540 B17R1.9256 CCCCCOCC(=O)c1ccc(cc1)OC 4666d68c951eb9f03601bab978c965e0 [0,2,0,0,0,0|2,0,0]=4 10541 B17R1.9256 CCCCCOCC(=O)c1ccc(cc1)SC e2127bb6dd4fd4d2eadd19e6148568ab [0,2,0,0,0,0|2,0,0]=4 10542 B17R1.9256 CCCCNCCC(=O)c1ccc(cc1)OC a9ca66a7d6cd8f16b80b910498f8f702 [0,2,0,0,0,0|2,0,0]=4 10543 B17R1.9256 CCCNCCCC(=O)c1ccc(cc1)OC d6c3d2bc7e93a98fa91ff467e7c29432 [0,2,0,0,0,0|2,0,0]=4 10544 B17R1.9256 CCCNCCNC(=O)c1ccc(cc1)OC f6b9e31e74781b127dbc3912a3b0b54e [0,2,0,0,0,0|2,0,0]=4 10545 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)C#N d41147a64c679fec8f444cc85115e8e2 [0,2,0,0,0,0|2,0,0]=4 10546 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)C=O 95ea58e0f7ad3dfce51376e8374cd68b [0,2,0,0,0,0|2,0,0]=4 10547 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)CC dc2699c3263c8cdebb9f4778d4a884ea [0,2,0,0,0,0|2,0,0]=4 10548 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)CF f1c0042e2b387b78e6d3527954aff592 [0,2,0,0,0,0|2,0,0]=4 10549 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)CO 4bbf7869e7d499418a0027c237c5bf7f [0,2,0,0,0,0|2,0,0]=4 10550 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)CS 9ef441c88d08a5ce4cba8fe12551c00f [0,2,0,0,0,0|2,0,0]=4 10551 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)NO 18f0b842b8523fcd58f0ea6df63a668e [0,2,0,0,0,0|2,0,0]=4 10552 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)OC 9614993dd82a024eb86699a665bbe335 [0,2,0,0,0,0|2,0,0]=4 10553 B17R1.9256 CCCOCCNC(=O)c1ccc(cc1)SC e42b9ef1bcb23c12d1788098455db9a9 [0,2,0,0,0,0|2,0,0]=4 10554 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)C#N 68b28ef5ce8088520eeca90a8d0880dd [0,2,0,0,0,0|2,0,0]=4 10555 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)C=O 12b3ad646f7e65a5f1460b9fbaf67ae3 [0,2,0,0,0,0|2,0,0]=4 10556 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)CC ff454bcacf33fb03ab291dc360047b33 [0,2,0,0,0,0|2,0,0]=4 10557 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)CF cbed85f57febd447ea70da50d3a36ef5 [0,2,0,0,0,0|2,0,0]=4 10558 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)CO 966ad840d9202d66bb4c15fcd3b73e91 [0,2,0,0,0,0|2,0,0]=4 10559 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)CS 8649cb87e9b8e3ae1399d74e4d8e9e42 [0,2,0,0,0,0|2,0,0]=4 10560 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)NO 62795bbfabc67775d0d70e90580fe79f [0,2,0,0,0,0|2,0,0]=4 10561 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)OC a54da37bfbcb1c204984f6109226f1f4 [0,2,0,0,0,0|2,0,0]=4 10562 B17R1.9256 CCOCCCNC(=O)c1ccc(cc1)SC e3b5d99b68fed1f2882eb6e1261a232e [0,2,0,0,0,0|2,0,0]=4 10563 B17R1.9256 CCc1ccc(cc1)C(=O)NCCCCCCl 97bcfb0e1870adf3cb832ec62840ab24 [0,2,0,0,0,0|2,0,0]=4 10564 B17R1.9256 CCc1ccc(cc1)C(=O)NCCCCCO ed3ac34de29e292146ce1d6cf69b7119 [0,2,0,0,0,0|2,0,0]=4 10565 B17R1.9256 CCc1ccc(cc1)C(=O)NCCCCOC a6382b7752fe2f70f715bf3610c0c388 [0,2,0,0,0,0|2,0,0]=4 10566 B17R1.9256 CCc1ccc(cc1)C(=O)NCCCCSC 821f4b1504c2e1604af77f41bc341142 [0,2,0,0,0,0|2,0,0]=4 10567 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)C#N 38d70c579e45819d3f5c247905129aed [0,2,0,0,0,0|2,0,0]=4 10568 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)C=O 31d8cc41ab21a64060d90b2f8478c421 [0,2,0,0,0,0|2,0,0]=4 10569 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)CF a4044c19a5053bf843b80d8111ff5386 [0,2,0,0,0,0|2,0,0]=4 10570 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)CO 449afb2c29aff3d58d10440592d1be07 [0,2,0,0,0,0|2,0,0]=4 10571 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)CS cf5ca13ac7a6ef00bb49b6a740e947e6 [0,2,0,0,0,0|2,0,0]=4 10572 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)NO 31867c39a33c3999e78d790c42a0a2f3 [0,2,0,0,0,0|2,0,0]=4 10573 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)OC 5ad6babbb5db423dbc4e344dc38e5f88 [0,2,0,0,0,0|2,0,0]=4 10574 B17R1.9256 COCCCCNC(=O)c1ccc(cc1)SC ccda907e0dc77b36b2e014621c3edfc0 [0,2,0,0,0,0|2,0,0]=4 10575 B17R1.9256 COc1ccc(cc1)C(=O)NCCCCCCl 4cdac7683ed3078e70d4bd3777890dfc [0,2,0,0,0,0|2,0,0]=4 10576 B17R1.9256 COc1ccc(cc1)C(=O)NCCCCCO 99dba213dfcb9e032c4fd86351bfce2f [0,2,0,0,0,0|2,0,0]=4 10577 B17R1.9256 COc1ccc(cc1)C(=O)NCCCCSC 2d2283686b34ffde0740ddef47c8ca02 [0,2,0,0,0,0|2,0,0]=4 10578 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)C#N 5a120c1bb7238859c5b7b7d299aff285 [0,2,0,0,0,0|2,0,0]=4 10579 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)C=O ac169b258e65bd6a6b6a5263e471e61a [0,2,0,0,0,0|2,0,0]=4 10580 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)CF c58325ca260e7c91f8e6012d9d5bb688 [0,2,0,0,0,0|2,0,0]=4 10581 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)CO 3671275077f6572dabd5596ed71dbae2 [0,2,0,0,0,0|2,0,0]=4 10582 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)CS 0f217315bffa7f081a8e5b0f9f866111 [0,2,0,0,0,0|2,0,0]=4 10583 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)NO 521bcc73b57d3a41e80aba3c7105b0a2 [0,2,0,0,0,0|2,0,0]=4 10584 B17R1.9256 CSCCCCNC(=O)c1ccc(cc1)SC f66207c1898c0ebf6e3e9b4da3c65351 [0,2,0,0,0,0|2,0,0]=4 10585 B17R1.9256 CSc1ccc(cc1)C(=O)NCCCCCCl 19fa5945436e719c79525bf04e3aa183 [0,2,0,0,0,0|2,0,0]=4 10586 B17R1.9256 CSc1ccc(cc1)C(=O)NCCCCCO 026db5966da36eacfec935926d7ae635 [0,2,0,0,0,0|2,0,0]=4 10587 B17R1.9256 N#Cc1ccc(cc1)C(=O)NCCCCCCl 7a35c57e87a3e3969ca3e1a9fa0c3bfa [0,2,0,0,0,0|2,0,0]=4 10588 B17R1.9256 N#Cc1ccc(cc1)C(=O)NCCCCCO 5a7140ca2d142d1cbe1fe7efab5e95af [0,2,0,0,0,0|2,0,0]=4 10589 B17R1.9256 O=C(NCCCCCCl)c1ccc(cc1)CF 1fa6996338fd734a417fe9221ef26894 [0,2,0,0,0,0|2,0,0]=4 10590 B17R1.9256 O=C(NCCCCCCl)c1ccc(cc1)CO 8c5e5810caf290f94b15e9a43a9d7e00 [0,2,0,0,0,0|2,0,0]=4 10591 B17R1.9256 O=C(NCCCCCCl)c1ccc(cc1)CS 4a4dc0855ac293221d70c1c50312e61e [0,2,0,0,0,0|2,0,0]=4 10592 B17R1.9256 O=C(NCCCCCCl)c1ccc(cc1)NO c077593eaa7cd78d19409cedcdedadb9 [0,2,0,0,0,0|2,0,0]=4 10593 B17R1.9256 O=C(NCCCCCO)c1ccc(cc1)CF 61b086034748925ec277431a13bd5162 [0,2,0,0,0,0|2,0,0]=4 10594 B17R1.9256 O=C(NCCCCCO)c1ccc(cc1)CO 27115ca6710bf75b899262a93f6189b0 [0,2,0,0,0,0|2,0,0]=4 10595 B17R1.9256 O=C(NCCCCCO)c1ccc(cc1)CS 516c19f2125b20dcb1674de2d55fabb9 [0,2,0,0,0,0|2,0,0]=4 10596 B17R1.9256 O=C(NCCCCCO)c1ccc(cc1)NO a5868df1abcd00a7c9d2e031327e41e3 [0,2,0,0,0,0|2,0,0]=4 10597 B17R1.9256 O=Cc1ccc(cc1)C(=O)NCCCCCCl a7c470d275bd355337e056e099b0ba7d [0,2,0,0,0,0|2,0,0]=4 10598 B17R1.9256 O=Cc1ccc(cc1)C(=O)NCCCCCO 4667d4e065c3969fb8eef5ac7bc6a02d [0,2,0,0,0,0|2,0,0]=4 10599 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)Br)C 264a4904135e43fde75f9b6e3b823b47 [0,2,0,0,0,0|2,0,0]=4 10600 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)Br)Cl 2f04df653e1a7b15f416d28366de52b8 [0,2,0,0,0,0|2,0,0]=4 10601 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)Br)F baf19fe95e6405fb56d477f6646c2070 [0,2,0,0,0,0|2,0,0]=4 10602 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)C)Br 6a505f8c518abb09f265cc20d366856d [0,2,0,0,0,0|2,0,0]=4 10603 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)C)Cl ea94fae35ab989e7a3f4cb5944b258bb [0,2,0,0,0,0|2,0,0]=4 10604 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)C)F fe57d0ae8ab3a5f5a2f7b0ec900fb604 [0,2,0,0,0,0|2,0,0]=4 10605 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)Cl)Br b7b5aa3b6c80b13d834d71039b4a9e29 [0,2,0,0,0,0|2,0,0]=4 10606 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)Cl)C f224a9f9bf628bb1da88208f9d9aab72 [0,2,0,0,0,0|2,0,0]=4 10607 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)Cl)Cl 3330d82a1cb6f495133308142a50d896 [0,2,0,0,0,0|2,0,0]=4 10608 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)F)Br efbf2109666f2ab61cc875ca8a84e162 [0,2,0,0,0,0|2,0,0]=4 10609 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)F)C 2e39a59ae4d506c8d1db8f766169df24 [0,2,0,0,0,0|2,0,0]=4 10610 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)F)Cl db6fab771ab8e583f1db7a294907e366 [0,2,0,0,0,0|2,0,0]=4 10611 B17R1.9269 CCCCCCNC(=O)c1cc(c(cn1)O)Cl 70f110891cd38e097492130abead8026 [0,2,0,0,0,0|2,0,0]=4 10612 B17R1.9269 CCCCCCNC(=O)c1ccc(=O)n(c1)C 7fe299dc5ac0d4e328deeeaa20903a31 [0,2,0,0,0,0|2,0,0]=4 10613 B17R1.9269 CCCCCCNC(=O)c1ccc(c(=O)o1)O 54b4372259fc18343c8db27b53b18890 [0,2,0,0,0,0|2,0,0]=4 10614 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Br)Br 5bdfe31de73dd79db16ae39fdfb8ed1b [0,2,0,0,0,0|1,0,0]=3 10615 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Br)C df0327233f3d6e3cad4795b0818aac43 [0,2,0,0,0,0|1,0,0]=3 10616 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Br)Cl fc7eccdbbb5f9cbb158121cfb66cea26 [0,2,0,0,0,0|1,0,0]=3 10617 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Br)F f8ee1ea72296feecdcea71cfe5433f41 [0,2,0,0,0,0|1,0,0]=3 10618 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Br)I d148ce7accb6df7a30ba3c1b8215dad1 [0,2,0,0,0,0|1,0,0]=3 10619 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)C)Br bbfb6555e670e494af349e86ed4717ad [0,2,0,0,0,0|1,0,0]=3 10620 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)C)C a853c2c243e45a4786df583f12e34540 [0,2,0,0,0,0|1,0,0]=3 10621 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)C)Cl 7f87aefeedc6c4f911df2eda48f447dc [0,2,0,0,0,0|1,0,0]=3 10622 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)C)F 80afe7b25b01860eea9b57b33aad2b96 [0,2,0,0,0,0|1,0,0]=3 10623 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)C)I fff45e4ae55f5bcc953212abddbfa1b7 [0,2,0,0,0,0|1,0,0]=3 10624 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)C)O 2430820553e21905a99926b0ebc64ac1 [0,2,0,0,0,0|1,0,0]=3 10625 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)Br 23ae5fcbf440e2681f8adf33f4251521 [0,2,0,0,0,0|1,0,0]=3 10626 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)C 31fa7c9304eedf31218cca3abd5a25c4 [0,2,0,0,0,0|1,0,0]=3 10627 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)Cl 832313faf8b5bd80dd2380b57b677790 [0,2,0,0,0,0|1,0,0]=3 10628 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)F 0da8a1fb2c7e424e74dc8859a623c014 [0,2,0,0,0,0|1,0,0]=3 10629 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)I cc4ab397abd8428b1b417beb19b13d7b [0,2,0,0,0,0|1,0,0]=3 10630 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)O 710633ce39ff65c2f411ce76ded26b0b [0,2,0,0,0,0|1,0,0]=3 10631 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)Cl)S fe75aa6ff9b2bae674887d00e0529e19 [0,2,0,0,0,0|1,0,0]=3 10632 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)Br 0dfc094e452fda5f3769e76f4127886e [0,2,0,0,0,0|1,0,0]=3 10633 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)C 80b5d322c595cfc612f98855b1fa0883 [0,2,0,0,0,0|1,0,0]=3 10634 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)Cl e9aa4ffb64301e665a3c2e2978edc9f9 [0,2,0,0,0,0|1,0,0]=3 10635 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)F 612855a851269f1ed76ff64d80402333 [0,2,0,0,0,0|1,0,0]=3 10636 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)I 4f75c799199b900382ccde1af8b7194c [0,2,0,0,0,0|1,0,0]=3 10637 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)O 860bfb9a83e57edaeff566b4399bb85b [0,2,0,0,0,0|1,0,0]=3 10638 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)F)S c0aa988290d808f645c42ce7f30eb3a3 [0,2,0,0,0,0|1,0,0]=3 10639 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)I)Br 76aa601ae75a62efa639e091bd57c74e [0,2,0,0,0,0|1,0,0]=3 10640 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)I)C d18ad3dd9a2bfa36ab47c6b8779dd917 [0,2,0,0,0,0|1,0,0]=3 10641 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)I)Cl 823bd8a7275dbb0b1da5232a7409ded9 [0,2,0,0,0,0|1,0,0]=3 10642 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)I)F dbbf56368cb36f470d49b035db9173c1 [0,2,0,0,0,0|1,0,0]=3 10643 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)I)I cec57e32565a3791dcd387a008b74bf3 [0,2,0,0,0,0|1,0,0]=3 10644 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)I)O ef82a4f570ef3d54eebf7aaa332b7566 [0,2,0,0,0,0|1,0,0]=3 10645 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)O)Br 86f4be2c39bdfede270591e3cd78f10e [0,2,0,0,0,0|1,0,0]=3 10646 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)O)C 530a62be9702666514730ab7b666e882 [0,2,0,0,0,0|1,0,0]=3 10647 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)O)Cl ba84d253681ad2a4d38273ecae352e99 [0,2,0,0,0,0|1,0,0]=3 10648 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)O)F 6d53da108707c7019ba01f6367edc0db [0,2,0,0,0,0|1,0,0]=3 10649 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)O)I 3c01ddbe71d9df2fb38fa2d39f1c05b2 [0,2,0,0,0,0|1,0,0]=3 10650 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)O)O adb84c2efcf448498992bfd3cec2e779 [0,2,0,0,0,0|1,0,0]=3 10651 B17R1.9269 CCCCCCNC(=O)c1ccc(c(c1)S)C 4cff21717f2b2b407d949f898547eff4 [0,2,0,0,0,0|1,0,0]=3 10652 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Br)Br cace755cf45bff5800f3255794a98f17 [0,2,0,0,0,0|2,0,0]=4 10653 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Br)C 73da1ce5136122bc9384bf1cb479c7f4 [0,2,0,0,0,0|2,0,0]=4 10654 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Br)Cl 60ce33ed8e26d74c0ddd132342709405 [0,2,0,0,0,0|2,0,0]=4 10655 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Br)F 4d9ea0ca41c502008e08f8ce7e5ca4f4 [0,2,0,0,0,0|2,0,0]=4 10656 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)C)Br 9424bcf512aaa1b619f0874865d55879 [0,2,0,0,0,0|2,0,0]=4 10657 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)C)C 90865a283ea7f59f1edbf04f3ae40737 [0,2,0,0,0,0|2,0,0]=4 10658 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)C)Cl 55e2b82922d342d7d39d770fa3ecbace [0,2,0,0,0,0|2,0,0]=4 10659 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)C)F 0518c976437b3863525861cad84c64c5 [0,2,0,0,0,0|2,0,0]=4 10660 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)C)O 20f5f2ddf9e03a715a4070a72a1b5c53 [0,2,0,0,0,0|2,0,0]=4 10661 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Cl)Br 997f0231ba2d6ed38f4dc907e44e9d31 [0,2,0,0,0,0|2,0,0]=4 10662 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Cl)C a7a92b2e384bb7db942da1897e1f700a [0,2,0,0,0,0|2,0,0]=4 10663 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Cl)Cl 5a3617e83ef77aee6b387d52db897e7b [0,2,0,0,0,0|2,0,0]=4 10664 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)Cl)F 23181bd124a13c399b70d23e1643122e [0,2,0,0,0,0|2,0,0]=4 10665 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)F)Br 040e253b17fe964e383d5e61aeb8abdb [0,2,0,0,0,0|2,0,0]=4 10666 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)F)C 93e52757ca06e88b8d4eaeb15dd5c2d4 [0,2,0,0,0,0|2,0,0]=4 10667 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)F)Cl 4fedfa4044f29a3ec351ca7cab2ce3d8 [0,2,0,0,0,0|2,0,0]=4 10668 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)F)F 9977bf7168ddc6ae6196f75bd2d0315a [0,2,0,0,0,0|2,0,0]=4 10669 B17R1.9269 CCCCCCNC(=O)c1ccc(c(n1)O)Br 347751bde184de2be6a9b927c14a7cf2 [0,2,0,0,0,0|2,0,0]=4 10670 B17R1.9269 CCCCCCNC(=O)c1ccn(c(=O)c1)C 0c360c2af9cd8b6420dfa026bb2b1deb [0,2,0,0,0,0|2,0,0]=4 10671 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Br)Br 6266646eac73d7212fbaf34439249d9a [0,2,0,0,0,0|2,0,0]=4 10672 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Br)C 17c756ab46366aadb4e43f4728ecddbc [0,2,0,0,0,0|2,0,0]=4 10673 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Br)Cl b4d19dcc814f0127bef95cc823ceab2d [0,2,0,0,0,0|2,0,0]=4 10674 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Br)F 177334fbe3b5399247a0d5d779ed7c6e [0,2,0,0,0,0|2,0,0]=4 10675 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Br)I a63417d769dea2a28fe106464b23c5da [0,2,0,0,0,0|2,0,0]=4 10676 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Br)O 6b06906d35bfdf3dee066746e2514de1 [0,2,0,0,0,0|2,0,0]=4 10677 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)C)Br 1ecb3a5689603325258bab8dbfe16832 [0,2,0,0,0,0|2,0,0]=4 10678 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)C)C 16d5789333a01308f151960dd7c1ff1d [0,2,0,0,0,0|2,0,0]=4 10679 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)C)Cl 7071ced5ba78240f0a4e90e29139e064 [0,2,0,0,0,0|2,0,0]=4 10680 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)C)F 7523c2fa07de5056110459efb64e5926 [0,2,0,0,0,0|2,0,0]=4 10681 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)C)O 7e13f5303da5ab6109147ffff3cdfd03 [0,2,0,0,0,0|2,0,0]=4 10682 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Cl)Br 9f79f0a81be55b212821119b150031ad [0,2,0,0,0,0|2,0,0]=4 10683 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Cl)C 513fd386f964de7195f5a441dc9c4dc5 [0,2,0,0,0,0|2,0,0]=4 10684 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Cl)Cl de1691bb00674b576415f950eff0afbe [0,2,0,0,0,0|2,0,0]=4 10685 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Cl)F cdb4c32de690618c368ef634659f15cf [0,2,0,0,0,0|2,0,0]=4 10686 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)Cl)O ea9e8dcf6fe16bb6ec560f7e57a9cb4c [0,2,0,0,0,0|2,0,0]=4 10687 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)F)Br c81e028857f4ef5f468ecb8c36777346 [0,2,0,0,0,0|2,0,0]=4 10688 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)F)C c4d86c45cbf472b4c14202cb1b5cb6e2 [0,2,0,0,0,0|2,0,0]=4 10689 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)F)Cl 5299b77a81f44184586407a81f91e810 [0,2,0,0,0,0|2,0,0]=4 10690 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)F)F 429e6877beefe00884298b348e93d76a [0,2,0,0,0,0|2,0,0]=4 10691 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)F)O 215451ae505b43b9e69b6a30cf5b3751 [0,2,0,0,0,0|2,0,0]=4 10692 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)I)Cl b453e5006608695fd7b3ad8843818fc0 [0,2,0,0,0,0|2,0,0]=4 10693 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)I)F aed0d07661c348abf6c871bcf3b09aa7 [0,2,0,0,0,0|2,0,0]=4 10694 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)O)Cl e5c6c826668c37d802d1a68588ba47f6 [0,2,0,0,0,0|2,0,0]=4 10695 B17R1.9269 CCCCCCNC(=O)c1cnc(c(c1)O)I 93c34c9fd15ed10ea7d5a8580e39c4c0 [0,2,0,0,0,0|2,0,0]=4 10696 B17R1.9269 CCCCCCNC(=O)c1coc(=O)c(c1)Br 03f695c4e432d9e2ef70572389e415ce [0,2,0,0,0,0|2,0,0]=4 10697 B17R1.9269 CCCCCCOC(C)c1ccc(c(c1)C)C 46935d2b1ff7785263845b32775f4b23 [0,2,0,0,0,0|1,0,1]=4 10698 B17R1.9269 CCCCCCOC(C)c1ccc(c(c1)C)F 1afd568379c819074b0c6f01d0261ea8 [0,2,0,0,0,0|1,0,1]=4 10699 B17R1.9269 CCCCCCOC(C)c1ccc(c(c1)Cl)Cl f66933f52d753560ea29b7d95cb75ae5 [0,2,0,0,0,0|1,0,1]=4 10700 B17R1.9269 CCCCCCOC(C)c1ccc(c(c1)Cl)F 44acf599d230ee63e55178d814ba87cc [0,2,0,0,0,0|1,0,1]=4 10701 B17R1.9269 CCCCCCOC(C)c1ccc(c(c1)F)Cl 9e1650c2bd9e275291f1c10580bd1e1f [0,2,0,0,0,0|1,0,1]=4 10702 B17R1.9269 CCCCCCOC(C)c1ccc(c(c1)F)F f776c5d7d11b78b92ad33c807d074923 [0,2,0,0,0,0|1,0,1]=4 10703 B17R1.9269 CCCCCCO[C@@H](C)c1ccc(c(c1)F)F 3513f25665ba60c03cc735bc8baf0050 [0,2,0,0,0,0|1,0,1]=4 10704 B17R1.9269 CCCCCCO[C@H](C)c1ccc(c(c1)F)F 6b6bcc1e8905dd0bd133adaa2f4bc35a [0,2,0,0,0,0|1,0,1]=4 10705 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)C)C 27c09c26e0b846c045f91bbbd82b9a07 [0,2,0,0,0,0|2,0,0]=4 10706 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)C)Cl b42dd72a8bcaebd70f758898d67c9af6 [0,2,0,0,0,0|2,0,0]=4 10707 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)C)F fd546f5d7c6709c54638ba6adbf8ebc4 [0,2,0,0,0,0|2,0,0]=4 10708 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)Cl)Cl 2c6e910ef25dc11b33140e4d47e9ac9f [0,2,0,0,0,0|2,0,0]=4 10709 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)Cl)F 6b4d957f0e025c93c05867da6b0913dd [0,2,0,0,0,0|2,0,0]=4 10710 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)Cl)I 204c9ffae464a6ae26b9885260e8b5dc [0,2,0,0,0,0|2,0,0]=4 10711 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)F)C 140a53f3c3ead102f17680e2a0301358 [0,2,0,0,0,0|2,0,0]=4 10712 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)F)Cl a2b971e5300629c39eeee35295115a2f [0,2,0,0,0,0|2,0,0]=4 10713 B17R1.9269 CCCCCNCC(=O)c1ccc(c(c1)F)F f19598a1fd11f20a12587ac68770aaea [0,2,0,0,0,0|2,0,0]=4 10714 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)C)C 07a5c28ebcf123648eb48b7958668351 [0,2,0,0,0,0|2,0,0]=4 10715 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)C)Cl 92e0dc798969e90808b78293347516a6 [0,2,0,0,0,0|2,0,0]=4 10716 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)C)F 4e3c4669238d976b8b28898e10843d6d [0,2,0,0,0,0|2,0,0]=4 10717 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)Cl)Cl 157cb78a1fcb7b06258054af4dabaa84 [0,2,0,0,0,0|2,0,0]=4 10718 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)Cl)F e378905a5a7bd1106ee26156a37f022d [0,2,0,0,0,0|2,0,0]=4 10719 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)Cl)I b8db5a2fc91c6e921af6be616d9bf062 [0,2,0,0,0,0|2,0,0]=4 10720 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)F)C e19051239b0e49c18a41f952f5605b5c [0,2,0,0,0,0|2,0,0]=4 10721 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)F)Cl ff9527c41c7274ce14c8856e51d66e0f [0,2,0,0,0,0|2,0,0]=4 10722 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)F)F 5f947c5b87353b24ff808b94841aa712 [0,2,0,0,0,0|2,0,0]=4 10723 B17R1.9269 CCCCCOCC(=O)c1ccc(c(c1)O)O 5ebc0e8a01f74b477fc19d1505c63de2 [0,2,0,0,0,0|2,0,0]=4 10724 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Br)Br 512a0b2ca48e6744657ea6f32f60954a [0,2,0,0,0,0|2,0,0]=4 10725 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Br)C ab4ff5d5f2478db489983129ba02ae7c [0,2,0,0,0,0|2,0,0]=4 10726 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Br)Cl 666dcc19b101712320ccb72100599198 [0,2,0,0,0,0|2,0,0]=4 10727 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Br)F 734913ea551bce7f06ac342ab09bbc51 [0,2,0,0,0,0|2,0,0]=4 10728 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Br)I b74685796e64bb5ff5cad765e1461696 [0,2,0,0,0,0|2,0,0]=4 10729 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Br)O e300426df042075e076f9c42457458c7 [0,2,0,0,0,0|2,0,0]=4 10730 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)C)Br b298cec3a43a96276844f905fe83cd5f [0,2,0,0,0,0|2,0,0]=4 10731 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)C)C a8003535c0a4aba6e2865ee9f0672b60 [0,2,0,0,0,0|2,0,0]=4 10732 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)C)Cl 876f71729f7b8ac59c21e13a33c3a736 [0,2,0,0,0,0|2,0,0]=4 10733 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)C)F 68fa7838cc89e68971781e04926e7984 [0,2,0,0,0,0|2,0,0]=4 10734 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)C)I 2c7954e97dbda25a1023a9ab4de844df [0,2,0,0,0,0|2,0,0]=4 10735 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)C)O b55dd77bb3fd352aaa3a28d2482c45b2 [0,2,0,0,0,0|2,0,0]=4 10736 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)Br d2a4633f4e6fd13c53c31476b0be4a11 [0,2,0,0,0,0|2,0,0]=4 10737 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)C 44129201bca6351b007db3402c901b3d [0,2,0,0,0,0|2,0,0]=4 10738 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)Cl f56feedb23b06d16dfb014f2b7c99220 [0,2,0,0,0,0|2,0,0]=4 10739 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)F e1e8900c3e98b872f4b8513c660cb297 [0,2,0,0,0,0|2,0,0]=4 10740 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)I 38a57cd0cbe7e18c8f63114250616f56 [0,2,0,0,0,0|2,0,0]=4 10741 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)O 9c44ee105caa9dee3e4bc0c25121843d [0,2,0,0,0,0|2,0,0]=4 10742 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)Cl)S bb799df52430175f54c880910cfa0866 [0,2,0,0,0,0|2,0,0]=4 10743 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)Br 071daff9271ba7f0e196627038a5cf8e [0,2,0,0,0,0|2,0,0]=4 10744 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)C da03ebe8d4df8c6412be6a66d86eea3b [0,2,0,0,0,0|2,0,0]=4 10745 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)Cl ab900f8c07081100d8d1b24043bea95c [0,2,0,0,0,0|2,0,0]=4 10746 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)F 72455c34d49249b24ab3a29db7847a67 [0,2,0,0,0,0|2,0,0]=4 10747 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)I 9c461c12016b674ba6331f4c2c5c423d [0,2,0,0,0,0|2,0,0]=4 10748 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)O add7820a555300d3f0a032b8ab941e48 [0,2,0,0,0,0|2,0,0]=4 10749 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)F)S b30c532abb849ba99008cc1ecfde2483 [0,2,0,0,0,0|2,0,0]=4 10750 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)I)Br 0031fb82eed675266cb77dff3c2d0484 [0,2,0,0,0,0|2,0,0]=4 10751 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)I)C 7e8c3fda0dcd15c9c5626db73353fd6f [0,2,0,0,0,0|2,0,0]=4 10752 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)I)Cl 078117ac88971b943b32366510b2d254 [0,2,0,0,0,0|2,0,0]=4 10753 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)I)F df7fc2579773b1afcfb24133d8ac8e4d [0,2,0,0,0,0|2,0,0]=4 10754 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)I)I 434c6f2868618a6a6386a328408f8b40 [0,2,0,0,0,0|2,0,0]=4 10755 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)I)O 488af5fdbc57f1e6d8fb67b4cef3ec42 [0,2,0,0,0,0|2,0,0]=4 10756 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)O)Br 54cd4af19e2a889dc905f1503472cbbc [0,2,0,0,0,0|2,0,0]=4 10757 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)O)C db35df550db03080b07a4da2fee46117 [0,2,0,0,0,0|2,0,0]=4 10758 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)O)Cl c71b58df6fc7327a420ad496cf451b0c [0,2,0,0,0,0|2,0,0]=4 10759 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)O)F 80259122f6ec781a729d49b616f0ad49 [0,2,0,0,0,0|2,0,0]=4 10760 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)O)I a6d0b113bb76fc15f0d261b95ce2a0a7 [0,2,0,0,0,0|2,0,0]=4 10761 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)O)O b608c72e5371a6a5ae5ab440c5ae0a70 [0,2,0,0,0,0|2,0,0]=4 10762 B17R1.9269 CCCOCCNC(=O)c1ccc(c(c1)S)C 75867da8343b5bf3080e1f4b4d01cbb9 [0,2,0,0,0,0|2,0,0]=4 10763 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Br)Br 909ce4e0a53d2741e2c7417c94c2c88b [0,2,0,0,0,0|2,0,0]=4 10764 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Br)C 2b97c120718ddbffce2a2a67701bada5 [0,2,0,0,0,0|2,0,0]=4 10765 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Br)Cl 80e8b37e2a92fa88b3c4b17d4f1f106b [0,2,0,0,0,0|2,0,0]=4 10766 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Br)F 857cb639bd677f4ba661b64e6a7e0ad5 [0,2,0,0,0,0|2,0,0]=4 10767 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Br)I bd0161cf61881b5e453b26bbe784024e [0,2,0,0,0,0|2,0,0]=4 10768 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Br)O 4858c77dffb324b9fc97b45d0418370a [0,2,0,0,0,0|2,0,0]=4 10769 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)C)Br 109d975fd6aea8dfed464e2bccd93acf [0,2,0,0,0,0|2,0,0]=4 10770 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)C)C c62e005b68961e8b6b105313eb71c178 [0,2,0,0,0,0|2,0,0]=4 10771 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)C)Cl e2973f248a8b91e7ae6eb3d85f22d18f [0,2,0,0,0,0|2,0,0]=4 10772 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)C)F 90c16e78b09bf861705154d641c89ef5 [0,2,0,0,0,0|2,0,0]=4 10773 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)C)I b6c34b13e940cff18cf1c4a1efe2c3c8 [0,2,0,0,0,0|2,0,0]=4 10774 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)C)O b20bf64fef99c59cab5b55057f627633 [0,2,0,0,0,0|2,0,0]=4 10775 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)Br 4a9b04774c19ffc7b00079a878e0a29f [0,2,0,0,0,0|2,0,0]=4 10776 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)C 50ada0291394ce71a458f9f5961e178b [0,2,0,0,0,0|2,0,0]=4 10777 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)Cl e59efa5b33cefb7d511a2198619820a4 [0,2,0,0,0,0|2,0,0]=4 10778 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)F d2cd2283ddc8d970569f6f538e79feb3 [0,2,0,0,0,0|2,0,0]=4 10779 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)I c65890c4f0ccb2287a34082ee5f6e4c8 [0,2,0,0,0,0|2,0,0]=4 10780 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)O 8bf81b9965acad2b543d58528425935a [0,2,0,0,0,0|2,0,0]=4 10781 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)Cl)S f5d4dcfee8039d9c74ef73f06b1ab794 [0,2,0,0,0,0|2,0,0]=4 10782 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)Br 3b99a7b5540c22c1ac05ccee935f5a59 [0,2,0,0,0,0|2,0,0]=4 10783 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)C 0229841b8a32e6cb87f653e749423826 [0,2,0,0,0,0|2,0,0]=4 10784 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)Cl 70738c6ed8e188f6392cb656428671bb [0,2,0,0,0,0|2,0,0]=4 10785 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)F 6b66a7fe354cc059675c99760d08c8fb [0,2,0,0,0,0|2,0,0]=4 10786 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)I 7d76752c3b425f96b19923c41589ebd2 [0,2,0,0,0,0|2,0,0]=4 10787 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)O 08d7e144f8b93293958fff1f45b95966 [0,2,0,0,0,0|2,0,0]=4 10788 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)F)S 6d131e7f6d7544efdb0e8ecdae944b68 [0,2,0,0,0,0|2,0,0]=4 10789 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)I)Br 9c68055da6c18c4db80f60c667243721 [0,2,0,0,0,0|2,0,0]=4 10790 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)I)C 2a5d8ec251f203445f524c1cf8b12cdf [0,2,0,0,0,0|2,0,0]=4 10791 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)I)Cl 8080b72464a1e9615c71d5fcf901c23c [0,2,0,0,0,0|2,0,0]=4 10792 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)I)F 1bd953ba5b9b97a6ddc7cf4fb17bf79c [0,2,0,0,0,0|2,0,0]=4 10793 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)I)I 75731b323f7a94fd9b16c672a11f4acc [0,2,0,0,0,0|2,0,0]=4 10794 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)I)O 9b1da7c4134fc93153d6c7345a3bf8c8 [0,2,0,0,0,0|2,0,0]=4 10795 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)O)Br d0a0b0fa8f23f0a59744d05a2332ac50 [0,2,0,0,0,0|2,0,0]=4 10796 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)O)C 3368b05fe2c078181267b9457f2e5f66 [0,2,0,0,0,0|2,0,0]=4 10797 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)O)Cl 904bdce6dcc1374f0f41f0014ba74820 [0,2,0,0,0,0|2,0,0]=4 10798 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)O)F 69654eeeceda10795bd143c58037fed0 [0,2,0,0,0,0|2,0,0]=4 10799 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)O)I c0c50cfaa3b0e0d8177e8be4a5d38ea7 [0,2,0,0,0,0|2,0,0]=4 10800 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)O)O 5012bf98517cf9296920ba51d4dc2290 [0,2,0,0,0,0|2,0,0]=4 10801 B17R1.9269 CCOCCCNC(=O)c1ccc(c(c1)S)C 5ad946df69c55932a91a58fea75a268e [0,2,0,0,0,0|2,0,0]=4 10802 B17R1.9269 CCOCCCOC(=O)c1ccc(c(c1)F)F 667ad15293a0932734852aacd26d6270 [0,2,0,0,0,0|1,0,0]=3 10803 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Br)Br dd8c49a7e1d12e2f48acfc23f86fda53 [0,2,0,0,0,0|2,0,0]=4 10804 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Br)C 2e6e008d872bab68868249eb995bf761 [0,2,0,0,0,0|2,0,0]=4 10805 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Br)Cl e47424f519a5fb782ed056427a0c9985 [0,2,0,0,0,0|2,0,0]=4 10806 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Br)F ebf9ee95f53fd5a7819508f3aea4aa4e [0,2,0,0,0,0|2,0,0]=4 10807 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Br)I 7da2150238c708a044f53159743d4a83 [0,2,0,0,0,0|2,0,0]=4 10808 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Br)O 80d94102723fbcbca990e3916f310cd1 [0,2,0,0,0,0|2,0,0]=4 10809 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)C)Br aa06d248c5739bbeed65858eab868d5c [0,2,0,0,0,0|2,0,0]=4 10810 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)C)C 25580f39ed83e64018a4d0bb59b1cdba [0,2,0,0,0,0|2,0,0]=4 10811 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)C)Cl 7a4e9918a173e223f72b6f304b6b67c8 [0,2,0,0,0,0|2,0,0]=4 10812 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)C)F b28998349e848ba11f2655995ac84e1c [0,2,0,0,0,0|2,0,0]=4 10813 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)C)I afbe9ccbe73dca36fbfd0288692c2b81 [0,2,0,0,0,0|2,0,0]=4 10814 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)C)O d164f9f8053425dd9854e5863e060e29 [0,2,0,0,0,0|2,0,0]=4 10815 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)Br 47227f279a23621746073aad445fec42 [0,2,0,0,0,0|2,0,0]=4 10816 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)C 254ef5ab982eb88e730beb367d4f18b3 [0,2,0,0,0,0|2,0,0]=4 10817 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)Cl 3f8a365ba0f3c08d3590cfb39cc64433 [0,2,0,0,0,0|2,0,0]=4 10818 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)F 9cea1c99bb4ed555d20de1548a254b4a [0,2,0,0,0,0|2,0,0]=4 10819 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)I 6445a7d1e62d90e564ae0332df017279 [0,2,0,0,0,0|2,0,0]=4 10820 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)O 33f09b73c96c00dac212dcbb85cd7b12 [0,2,0,0,0,0|2,0,0]=4 10821 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)Cl)S b4e024753567e2ddfd3e32dde110d6f5 [0,2,0,0,0,0|2,0,0]=4 10822 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)Br 05dedfa20a2a9441673459bdc53be4a9 [0,2,0,0,0,0|2,0,0]=4 10823 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)C a1847112c8936bd1979d433c99c4fbd5 [0,2,0,0,0,0|2,0,0]=4 10824 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)Cl be8defe0e53e451ecf036f7d1707ee97 [0,2,0,0,0,0|2,0,0]=4 10825 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)F 99c9a530d5f751302850abe338aa78ec [0,2,0,0,0,0|2,0,0]=4 10826 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)I ae0d42b2c8eb3af6cf9d627dacb4ffe2 [0,2,0,0,0,0|2,0,0]=4 10827 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)O a92b99cf6c660734937c509cdf11ef7b [0,2,0,0,0,0|2,0,0]=4 10828 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)F)S 2e52c770354b4afe4cf266993cb5badb [0,2,0,0,0,0|2,0,0]=4 10829 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)I)Br aaa83dbe1da1b4f74868006ba71b1ffb [0,2,0,0,0,0|2,0,0]=4 10830 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)I)C 36d1f7a38191291cb4c646125316212b [0,2,0,0,0,0|2,0,0]=4 10831 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)I)Cl 02fc6310019ad46215a67c05fcdc75a7 [0,2,0,0,0,0|2,0,0]=4 10832 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)I)F 58db76221bb64ee2b59088a99efd37da [0,2,0,0,0,0|2,0,0]=4 10833 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)I)I 8e831773b668dfe7238e44eb145a8b51 [0,2,0,0,0,0|2,0,0]=4 10834 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)I)O 88d2a4b1c82eab8efaac89db32ba4b60 [0,2,0,0,0,0|2,0,0]=4 10835 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)O)Br 6c1cac2eb62aff50bbdefff729fbf768 [0,2,0,0,0,0|2,0,0]=4 10836 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)O)C 1bb10fbf28043a4fb75ab5a262f4ab76 [0,2,0,0,0,0|2,0,0]=4 10837 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)O)Cl 12186d4c7172a9b9c977d0f4ba820c2c [0,2,0,0,0,0|2,0,0]=4 10838 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)O)F e35d1c6f8215ed63e91347bb4a107433 [0,2,0,0,0,0|2,0,0]=4 10839 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)O)I 011a4720d7bd5483624237122d0c62de [0,2,0,0,0,0|2,0,0]=4 10840 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)O)O 7ad79c34386159cf9a931bb3a972d18d [0,2,0,0,0,0|2,0,0]=4 10841 B17R1.9269 COCCCCNC(=O)c1ccc(c(c1)S)C 9205c73de0e260a26009abe50e0af653 [0,2,0,0,0,0|2,0,0]=4 10842 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Br)Br 6659d015d02c15ce3718d5b7cc088efa [0,2,0,0,0,0|2,0,0]=4 10843 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Br)C 37d44c347637166678e1f46e2731ad9a [0,2,0,0,0,0|2,0,0]=4 10844 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Br)Cl 11c63ac1ea66a64e4a8860c5e8368df3 [0,2,0,0,0,0|2,0,0]=4 10845 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Br)F eb580418a47e1df86c13daa3d8f6230b [0,2,0,0,0,0|2,0,0]=4 10846 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Br)I 4e3b5a1bb42736260b69345ba122432a [0,2,0,0,0,0|2,0,0]=4 10847 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Br)O 28010b56a077393125cb972d195a47cb [0,2,0,0,0,0|2,0,0]=4 10848 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)C)Br c335d244b930bd141b1453639e818baf [0,2,0,0,0,0|2,0,0]=4 10849 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)C)C ab85eea91f96cffabecca7753dbce0c4 [0,2,0,0,0,0|2,0,0]=4 10850 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)C)Cl 61bc0738b265b78c77e03f069cbdf4f6 [0,2,0,0,0,0|2,0,0]=4 10851 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)C)F 3638e35d612249bb5de7043cbd2957e0 [0,2,0,0,0,0|2,0,0]=4 10852 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)C)I 523d469df267303e2de89ecfa88e3c4c [0,2,0,0,0,0|2,0,0]=4 10853 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)C)O 4c66c8782d96fa623b53566757e16de1 [0,2,0,0,0,0|2,0,0]=4 10854 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)Br 82847b73b483cbe7f8d14969a806c8c6 [0,2,0,0,0,0|2,0,0]=4 10855 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)C 26224494433b43fa3053dc3631e399ae [0,2,0,0,0,0|2,0,0]=4 10856 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)Cl cb7af3966e46cb15b967172105aa0dcd [0,2,0,0,0,0|2,0,0]=4 10857 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)F fd8a7832a6191b1f0ebe4e5d0427eb47 [0,2,0,0,0,0|2,0,0]=4 10858 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)I 76ef2b958827e884c823202881b78a3d [0,2,0,0,0,0|2,0,0]=4 10859 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)O 78416e5aa0fbc1ada40e320dd3ea2361 [0,2,0,0,0,0|2,0,0]=4 10860 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)Cl)S 8ab5e67286a68249858704443a5fc80b [0,2,0,0,0,0|2,0,0]=4 10861 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)Br 76e9bab324656d323c4e4549ce28d970 [0,2,0,0,0,0|2,0,0]=4 10862 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)C 8868e4574865a68ba0cebe9a13cd7fd6 [0,2,0,0,0,0|2,0,0]=4 10863 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)Cl 959bb819b16bae375af7f5a4619ae4b9 [0,2,0,0,0,0|2,0,0]=4 10864 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)F 9c84346282c1d63e162becf268c0b940 [0,2,0,0,0,0|2,0,0]=4 10865 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)I a2591cb5051e83fda47580b4e2ba890b [0,2,0,0,0,0|2,0,0]=4 10866 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)O ae94f656a951f5ded7f08ebad0909a16 [0,2,0,0,0,0|2,0,0]=4 10867 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)F)S 433f54cde894cba5949a73d1ea965636 [0,2,0,0,0,0|2,0,0]=4 10868 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)I)Br 57961da46c72fe2cffd90f7a67ef8d69 [0,2,0,0,0,0|2,0,0]=4 10869 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)I)C 7d8e02285df0ef3bf97600d087b13536 [0,2,0,0,0,0|2,0,0]=4 10870 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)I)Cl da14b2ba36023790dc3ee878d78a3c4e [0,2,0,0,0,0|2,0,0]=4 10871 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)I)F 2f07db159afed9d79aaa7caa3af96d71 [0,2,0,0,0,0|2,0,0]=4 10872 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)I)I 3d5068d4c69be699668ce365cec61bef [0,2,0,0,0,0|2,0,0]=4 10873 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)I)O fbaa4b16e0f974c773c0c81f87702583 [0,2,0,0,0,0|2,0,0]=4 10874 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)O)Br da313ee4c46347a21175f6b09b159f7e [0,2,0,0,0,0|2,0,0]=4 10875 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)O)C 9c7fd9c19c43e13c2eae52042ac91b73 [0,2,0,0,0,0|2,0,0]=4 10876 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)O)Cl 4c8ad90cf1741b8ad6bc6a00186a7883 [0,2,0,0,0,0|2,0,0]=4 10877 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)O)F 1560d33f211293d81e3d1de3e89e89f8 [0,2,0,0,0,0|2,0,0]=4 10878 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)O)I f94f6b0e1e1380065a6a4605508fbf18 [0,2,0,0,0,0|2,0,0]=4 10879 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)O)O 9853101f0eee1b364e8bc357eb6d6630 [0,2,0,0,0,0|2,0,0]=4 10880 B17R1.9269 CSCCCCNC(=O)c1ccc(c(c1)S)C 90999fcd2ab5450cc833e5a949f10497 [0,2,0,0,0,0|2,0,0]=4 10881 B17R1.9269 Cc1cc(ccc1Br)C(=O)NCCCCCCl 3d18e2d8c72142f9cb40a1534f19c7b4 [0,2,0,0,0,0|2,0,0]=4 10882 B17R1.9269 Cc1cc(ccc1Br)C(=O)NCCCCCO 73180372ab99b8c6b51afa3886af3844 [0,2,0,0,0,0|2,0,0]=4 10883 B17R1.9269 Cc1cc(ccc1Cl)C(=O)NCCCCCCl e121f65572d3431a2b5a5d2696c8e1a9 [0,2,0,0,0,0|2,0,0]=4 10884 B17R1.9269 Cc1cc(ccc1Cl)C(=O)NCCCCCO ad77f23bca41d6adc69c14cd060d13b8 [0,2,0,0,0,0|2,0,0]=4 10885 B17R1.9269 Cc1cc(ccc1F)C(=O)NCCCCCCl 49a0fba7eabae22a7c512a56cb8b01bd [0,2,0,0,0,0|2,0,0]=4 10886 B17R1.9269 Cc1cc(ccc1F)C(=O)NCCCCCO 6d79cd3c534674bb6b925eb8257adc9d [0,2,0,0,0,0|2,0,0]=4 10887 B17R1.9269 Cc1cc(ccc1I)C(=O)NCCCCCCl 0e4f433ab16db484cfc8d77ec30f4eb6 [0,2,0,0,0,0|2,0,0]=4 10888 B17R1.9269 Cc1cc(ccc1I)C(=O)NCCCCCO a2afd50a9f34926b485d77eaf907c27e [0,2,0,0,0,0|2,0,0]=4 10889 B17R1.9269 Cc1cc(ccc1O)C(=O)NCCCCCCl bc65075592917fdbcda8eb0927cb8a13 [0,2,0,0,0,0|2,0,0]=4 10890 B17R1.9269 Cc1cc(ccc1O)C(=O)NCCCCCO 25d02f9757beff848496a6e442e0c9b0 [0,2,0,0,0,0|2,0,0]=4 10891 B17R1.9269 Cc1ccc(cc1Br)C(=O)NCCCCCCl ec28ee6880687664584099c8d739d143 [0,2,0,0,0,0|2,0,0]=4 10892 B17R1.9269 Cc1ccc(cc1Br)C(=O)NCCCCCO 446f1dd58608f5bd23c213e2f1dd7594 [0,2,0,0,0,0|2,0,0]=4 10893 B17R1.9269 Cc1ccc(cc1C)C(=O)NCCCCCCl 149c84ae627108b3bd02513b7e9044c6 [0,2,0,0,0,0|2,0,0]=4 10894 B17R1.9269 Cc1ccc(cc1C)C(=O)NCCCCCO 6675d52e1e8e2b4f3e5ab31c7e00f2a6 [0,2,0,0,0,0|2,0,0]=4 10895 B17R1.9269 Cc1ccc(cc1Cl)C(=O)NCCCCCCl f3cea2f5c7277e827680fd8bf0e5d36e [0,2,0,0,0,0|2,0,0]=4 10896 B17R1.9269 Cc1ccc(cc1Cl)C(=O)NCCCCCO 753348ddb62b6800c561e23267d3eee8 [0,2,0,0,0,0|2,0,0]=4 10897 B17R1.9269 Cc1ccc(cc1F)C(=O)NCCCCCCl 1f6ed37a7a724ee7a22720527fb26710 [0,2,0,0,0,0|2,0,0]=4 10898 B17R1.9269 Cc1ccc(cc1F)C(=O)NCCCCCO 626524c0fe663d5e2048a5548a2bbf7c [0,2,0,0,0,0|2,0,0]=4 10899 B17R1.9269 Cc1ccc(cc1I)C(=O)NCCCCCCl 7536e55a13fc560b304d2102428a5af1 [0,2,0,0,0,0|2,0,0]=4 10900 B17R1.9269 Cc1ccc(cc1I)C(=O)NCCCCCO 537b2ab483a94c4e8c787c0b03336ea9 [0,2,0,0,0,0|2,0,0]=4 10901 B17R1.9269 Cc1ccc(cc1O)C(=O)NCCCCCCl 09629f8f5c8583ece32127dc6697b2fe [0,2,0,0,0,0|2,0,0]=4 10902 B17R1.9269 Cc1ccc(cc1O)C(=O)NCCCCCO bb30ce3fb64fa6c1913707496bf7e573 [0,2,0,0,0,0|2,0,0]=4 10903 B17R1.9269 Cc1ccc(cc1S)C(=O)NCCCCCCl 005e6d7e0e8e5d5afdbd4436958fa665 [0,2,0,0,0,0|2,0,0]=4 10904 B17R1.9269 Cc1ccc(cc1S)C(=O)NCCCCCO 83fe598740a9b3e1efdb85ca37aed6c1 [0,2,0,0,0,0|2,0,0]=4 10905 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Br)Br 88ad30eaf2f9b781cded5a16e7a23c14 [0,2,0,0,0,0|2,0,0]=4 10906 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Br)Cl 17fea262b7279815c307f4043ae7d39e [0,2,0,0,0,0|2,0,0]=4 10907 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Br)F ad19c469893b2ddca700bbee2c346844 [0,2,0,0,0,0|2,0,0]=4 10908 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Br)I 699defc5d58f930ac6245a565e58bbe4 [0,2,0,0,0,0|2,0,0]=4 10909 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Br)O 24e8c7c89c952d4d76ecc1e4abfc5b68 [0,2,0,0,0,0|2,0,0]=4 10910 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Cl)Br f35466fd8ea2bd2a4b6865f4806a8cf8 [0,2,0,0,0,0|2,0,0]=4 10911 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Cl)Cl b9dd3132972e09c44325ed3bdd84fd4b [0,2,0,0,0,0|2,0,0]=4 10912 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Cl)F 974b60b5f1d4a069ae1d84b1c906b1ed [0,2,0,0,0,0|2,0,0]=4 10913 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Cl)I b4087e3f87ca7355b04eefbc636eb0c6 [0,2,0,0,0,0|2,0,0]=4 10914 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Cl)O 3026744c5ef3acab1d918f3686c30cfa [0,2,0,0,0,0|2,0,0]=4 10915 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)Cl)S f19d43ef288ac1a2d6828a3695880181 [0,2,0,0,0,0|2,0,0]=4 10916 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)F)Br 4bef50be7407bd486013acc03e0448cb [0,2,0,0,0,0|2,0,0]=4 10917 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)F)Cl 662cb5adf535cd10d32b72d96b54ce1f [0,2,0,0,0,0|2,0,0]=4 10918 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)F)F 5f28fdc663edf3d55cfba0b7371ca322 [0,2,0,0,0,0|2,0,0]=4 10919 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)F)I 3db589b1ec364e070948c2c1b266c8bc [0,2,0,0,0,0|2,0,0]=4 10920 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)F)O 7c2a9a0ddcdb207179042366c6692c45 [0,2,0,0,0,0|2,0,0]=4 10921 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)F)S 0a8ad9cb5978764084eaf0c92975351a [0,2,0,0,0,0|2,0,0]=4 10922 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)I)Br a93e7b31e5f323762fd5f684924878c5 [0,2,0,0,0,0|2,0,0]=4 10923 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)I)Cl e04f3d8dba1ebdf847ceb6137dde2e45 [0,2,0,0,0,0|2,0,0]=4 10924 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)I)F 7e8011833ed7b5a6f8f6e61c7801dd0c [0,2,0,0,0,0|2,0,0]=4 10925 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)I)I d38ae70853809740d2e5a2067f6b1910 [0,2,0,0,0,0|2,0,0]=4 10926 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)I)O 83d6ccefd729938196f12408f40d144c [0,2,0,0,0,0|2,0,0]=4 10927 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)O)Br cc29c128095bdb7c291dfd152fe65a7f [0,2,0,0,0,0|2,0,0]=4 10928 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)O)Cl 7a1a35940818c23e86e962ff876d2cfd [0,2,0,0,0,0|2,0,0]=4 10929 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)O)F 9d88ab302bad03dcb44c48146fbbca93 [0,2,0,0,0,0|2,0,0]=4 10930 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)O)I 9305edf45472c2956565362bfc7d4106 [0,2,0,0,0,0|2,0,0]=4 10931 B17R1.9269 O=C(NCCCCCCl)c1ccc(c(c1)O)O 0d78d0621f03b3b84ab77dc2bf7312ea [0,2,0,0,0,0|2,0,0]=4 10932 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Br)Br 99171ef36f5a293674aa33e8c5f6f206 [0,2,0,0,0,0|2,0,0]=4 10933 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Br)Cl cc0a30ca185aef0b762579be77590341 [0,2,0,0,0,0|2,0,0]=4 10934 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Br)F 3fd8174d4d9e0c2359d307bd1b3b8aff [0,2,0,0,0,0|2,0,0]=4 10935 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Br)I 9c073c2ffaea4552ddd0ddeb50a7def0 [0,2,0,0,0,0|2,0,0]=4 10936 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Br)O a7d1ae448390ad4c81502174e52ad08a [0,2,0,0,0,0|2,0,0]=4 10937 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Cl)Br a9dfaeb28f480ac21a33d7e9938fb422 [0,2,0,0,0,0|2,0,0]=4 10938 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Cl)Cl f5bbe9c27a91894b160d040d9191c4b9 [0,2,0,0,0,0|2,0,0]=4 10939 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Cl)F fd1f79990ae12136adb4d1b0a8b6538e [0,2,0,0,0,0|2,0,0]=4 10940 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Cl)I b30395ddd44c3f6c280cffab7a2292a5 [0,2,0,0,0,0|2,0,0]=4 10941 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Cl)O 2f159475bb5b8d968598ec4c7b7f97da [0,2,0,0,0,0|2,0,0]=4 10942 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)Cl)S 384ec751d24089a907925fbfd748cccf [0,2,0,0,0,0|2,0,0]=4 10943 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)F)Br b6553a4a4978e5e7a5d57a18e1816cf7 [0,2,0,0,0,0|2,0,0]=4 10944 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)F)Cl 9282d6ae50ff9790ce224df07da6886a [0,2,0,0,0,0|2,0,0]=4 10945 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)F)F cfcb6767e8258ed42764671f2236d98b [0,2,0,0,0,0|2,0,0]=4 10946 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)F)I 399e7db7426fff90912672879a9fa8ae [0,2,0,0,0,0|2,0,0]=4 10947 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)F)O e1a55aae7e79a4f3eb8d1283545eced6 [0,2,0,0,0,0|2,0,0]=4 10948 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)F)S 3d1020f71d933c209f00e804fa4e15a4 [0,2,0,0,0,0|2,0,0]=4 10949 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)I)Br 6ed854f2d01819c502992962547d8be9 [0,2,0,0,0,0|2,0,0]=4 10950 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)I)Cl 235b6b10ea95790de53ccd1b8ea28724 [0,2,0,0,0,0|2,0,0]=4 10951 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)I)F a143a9a7c1d10611e835110d086abf02 [0,2,0,0,0,0|2,0,0]=4 10952 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)I)I 00622514c66838473d5ff5a0f4db5247 [0,2,0,0,0,0|2,0,0]=4 10953 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)I)O 365f6f6c794ab3789269925823ff9064 [0,2,0,0,0,0|2,0,0]=4 10954 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)O)Br e78ec2562b4f706420a5a278aab4e3c0 [0,2,0,0,0,0|2,0,0]=4 10955 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)O)Cl e7832507d9b86de2103c9fdb1d75b5d1 [0,2,0,0,0,0|2,0,0]=4 10956 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)O)F 54ac32e7f4c52858682425f28deac333 [0,2,0,0,0,0|2,0,0]=4 10957 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)O)I 4aaca3a0ddd6033b2fcc1b13b5017e8f [0,2,0,0,0,0|2,0,0]=4 10958 B17R1.9269 O=C(NCCCCCO)c1ccc(c(c1)O)O 0f9d9ec339183dd90cd4041135ff96de [0,2,0,0,0,0|2,0,0]=4 10959 B17R1.9269 O=C(OCCCOCF)c1ccc(c(c1)F)F 551388318aba8f0dcf99da424bab2782 [0,2,0,0,0,0|2,0,0]=4 10960 B17R1.66846 CCCCCCNC(=O)c1ccc(=O)oc1C b300039530844415ed27c791e81b7621 [0,2,0,0,0,0|2,0,0]=4 10961 B17R1.66846 CCCCCCNC(=O)c1ccc(c[n+]1[O-])C 12264b52c4f40109c7ba1fb479dd6282 [0,2,0,0,0,0|2,0,0]=4 10962 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Br)Br 93429ffb1802ecb76995b7e4347750fd [0,2,0,0,0,0|1,0,0]=3 10963 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Br)C f443fcbead2ce31463969c535f944230 [0,2,0,0,0,0|1,0,0]=3 10964 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Br)Cl 4edf3a0a99409d19a636e985e12b2b75 [0,2,0,0,0,0|1,0,0]=3 10965 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Br)F 35e58a5d367b042085007c5810568eab [0,2,0,0,0,0|1,0,0]=3 10966 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Br)I 17d34d0b7ed240232a950bf855599d7a [0,2,0,0,0,0|1,0,0]=3 10967 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Br)O 52039c0d005862654ab8cb1e079a3b8a [0,2,0,0,0,0|1,0,0]=3 10968 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1C)Br b2e0fc9deba04d02793f91807920bad5 [0,2,0,0,0,0|1,0,0]=3 10969 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1C)C 1a5b2e596da6165d3a771399dccce051 [0,2,0,0,0,0|1,0,0]=3 10970 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1C)Cl 89d23a1e6fdae2807c33270c7a7cdaeb [0,2,0,0,0,0|1,0,0]=3 10971 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1C)F 634c740f0ff12c6d4eec9a51b44a4866 [0,2,0,0,0,0|1,0,0]=3 10972 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1C)I 17c88c8de4f3efc7b8c80b17ae0ec6ab [0,2,0,0,0,0|1,0,0]=3 10973 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1C)O 1411954089c0ec422d9b72d2964ca627 [0,2,0,0,0,0|1,0,0]=3 10974 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Cl)Br f61146855bf3beb912d55eb72763191d [0,2,0,0,0,0|1,0,0]=3 10975 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Cl)C affb78e2455f9ca6964f9141fb2e7401 [0,2,0,0,0,0|1,0,0]=3 10976 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Cl)Cl 3fa67bb4e8020afc09b424613c6b2af8 [0,2,0,0,0,0|1,0,0]=3 10977 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Cl)F f02ed925512d4213a1ff87be245f6c9d [0,2,0,0,0,0|1,0,0]=3 10978 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Cl)I 0a4e1da9218507f5392973736bdf7a23 [0,2,0,0,0,0|1,0,0]=3 10979 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1Cl)O 080c8703643e402775177e640695688a [0,2,0,0,0,0|1,0,0]=3 10980 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)Br 554690910bf644f4c062c3ab93baf393 [0,2,0,0,0,0|1,0,0]=3 10981 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)C bf8ebf75816284bae7834a9152ed76b7 [0,2,0,0,0,0|1,0,0]=3 10982 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)Cl 539fb13c69da57966285c7c2bc2fb590 [0,2,0,0,0,0|1,0,0]=3 10983 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)F 1cb2327739f24990ce82f121a30c772a [0,2,0,0,0,0|1,0,0]=3 10984 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)I 4463a20367c4ba368369087ec3e532da [0,2,0,0,0,0|1,0,0]=3 10985 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)O d84159f1dad48e3957145430b8d01cdb [0,2,0,0,0,0|1,0,0]=3 10986 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1F)S 5500af4848ef2c9a267655d49b14b3c1 [0,2,0,0,0,0|1,0,0]=3 10987 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1I)Br 0890d355a0a58642ab5ad0eec93fb6d0 [0,2,0,0,0,0|1,0,0]=3 10988 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1I)C cc4752c89f056faaea18d1490536ed75 [0,2,0,0,0,0|1,0,0]=3 10989 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1I)Cl b4616a96d973c78d0be5429d2aa68ec1 [0,2,0,0,0,0|1,0,0]=3 10990 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1I)F 3f3ff0d2b5c83ca64beb49eaffb2e40d [0,2,0,0,0,0|1,0,0]=3 10991 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1O)C 487d94b97629048261ebd60db93e1f67 [0,2,0,0,0,0|1,0,0]=3 10992 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1O)Cl 26800b90843ead2294d272bb7f1ce8c3 [0,2,0,0,0,0|1,0,0]=3 10993 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1O)I a7959572a7cf045998353b2bfc737a3f [0,2,0,0,0,0|1,0,0]=3 10994 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1O)O 612ab958054f0000ff929445ba72c1d9 [0,2,0,0,0,0|1,0,0]=3 10995 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1S)Br 08600100a368c950607a17ca5a7f0991 [0,2,0,0,0,0|1,0,0]=3 10996 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1S)Cl 5194558087279a3021b657a7ca45efd3 [0,2,0,0,0,0|1,0,0]=3 10997 B17R1.66846 CCCCCCNC(=O)c1ccc(cc1S)F 31a7dad78ac2993191c57e93971f5f0c [0,2,0,0,0,0|1,0,0]=3 10998 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Br)Br f0f2272c0b6265e48ed1e06c833a18db [0,2,0,0,0,0|2,0,0]=4 10999 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Br)C 9cbfc81f7203334cac6ef93a075378ce [0,2,0,0,0,0|2,0,0]=4 11000 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Br)Cl a5a1e66cf4d47757a1f5c9dc93cb1108 [0,2,0,0,0,0|2,0,0]=4 11001 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Br)F 036c5f9ef1524f015eaa3a59ae412574 [0,2,0,0,0,0|2,0,0]=4 11002 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1C)Br 06bb3d7d50ef5b29e60785c957ea4990 [0,2,0,0,0,0|2,0,0]=4 11003 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1C)C 25e414e9a0362a2a00cfa72836db5f6f [0,2,0,0,0,0|2,0,0]=4 11004 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1C)Cl eeef03cdecb5dc6e4809b3e4886bf2c3 [0,2,0,0,0,0|2,0,0]=4 11005 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1C)F 47857a6fc578f83711e3412ccf80b87e [0,2,0,0,0,0|2,0,0]=4 11006 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1C)O 83afcd9cf3c8725ec28bcc2ee0e948cb [0,2,0,0,0,0|2,0,0]=4 11007 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Cl)Br 4f2640e12051a612fc95e39f481b3792 [0,2,0,0,0,0|2,0,0]=4 11008 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Cl)C a5ff0a5af259b8aeab0f95b29c969807 [0,2,0,0,0,0|2,0,0]=4 11009 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Cl)Cl 19c4c42de82f86d74f9a39f11033a37b [0,2,0,0,0,0|2,0,0]=4 11010 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Cl)F afbad6b37ad1268b8310ddc272ed1537 [0,2,0,0,0,0|2,0,0]=4 11011 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1Cl)O 146ecbbca2f39ef0fe8d84857d5180ed [0,2,0,0,0,0|2,0,0]=4 11012 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1F)Br a983501ea6e904f3d304809363c0dd31 [0,2,0,0,0,0|2,0,0]=4 11013 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1F)C 4f9748193efb109d4c8734614cb257c9 [0,2,0,0,0,0|2,0,0]=4 11014 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1F)Cl ddd63cda0374c4031115149a24ea20bf [0,2,0,0,0,0|2,0,0]=4 11015 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1F)F 99f307c8e7cbb97ba36087a4f37f6bc3 [0,2,0,0,0,0|2,0,0]=4 11016 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1O)Br 0e8bf1b46e4b419abb49ba1be04382fe [0,2,0,0,0,0|2,0,0]=4 11017 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1O)C 714247eefa5c7d0b02975d47a3142954 [0,2,0,0,0,0|2,0,0]=4 11018 B17R1.66846 CCCCCCNC(=O)c1ccc(nc1O)Cl 869ff01826b238103c0a8ceea2833d60 [0,2,0,0,0,0|2,0,0]=4 11019 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Br)Br b00b6036bed73a77c48c1c9fd994cda2 [0,2,0,0,0,0|2,0,0]=4 11020 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Br)C aa51ed2e1dda4e730c2b5e249d62a81e [0,2,0,0,0,0|2,0,0]=4 11021 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Br)Cl 5848168603efab1b493fc8a101369858 [0,2,0,0,0,0|2,0,0]=4 11022 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Br)F ecf222d26f960439a859a4728a62146c [0,2,0,0,0,0|2,0,0]=4 11023 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Br)O 490fb87e1f963c27a79db85629e2b058 [0,2,0,0,0,0|2,0,0]=4 11024 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1C)Br 43b7b4b30649659e06bf486538f13687 [0,2,0,0,0,0|2,0,0]=4 11025 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1C)C 090b5d05b88b3d458e47936a8c91db6b [0,2,0,0,0,0|2,0,0]=4 11026 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1C)Cl e2d7c13d327d910e79a826d7d9d9cb38 [0,2,0,0,0,0|2,0,0]=4 11027 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1C)F 8aa30c0c0b536ebc89c4a12b1021641c [0,2,0,0,0,0|2,0,0]=4 11028 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1C)O 089e4c9024d6437a6b8d31a47ecc3275 [0,2,0,0,0,0|2,0,0]=4 11029 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Cl)Br 274b072a37872338c917767ccd91623d [0,2,0,0,0,0|2,0,0]=4 11030 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Cl)C 38bee99c290734abc3d6eb6382592bb1 [0,2,0,0,0,0|2,0,0]=4 11031 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Cl)Cl b3194e461322bb4f1043f6216c126bcb [0,2,0,0,0,0|2,0,0]=4 11032 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1Cl)O 167d571fcbcd23a05f6aec3eff952c6a [0,2,0,0,0,0|2,0,0]=4 11033 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1F)Br 34f81315e488c99de9a2b7f5a053c9cb [0,2,0,0,0,0|2,0,0]=4 11034 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1F)Cl 1cf9c065e648701b6a0a6f822f338fe2 [0,2,0,0,0,0|2,0,0]=4 11035 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1F)F 34e4e187d9001b9c7f6276e4623650d1 [0,2,0,0,0,0|2,0,0]=4 11036 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1I)Br 3a69994b29cdeec087398c91ad37635e [0,2,0,0,0,0|2,0,0]=4 11037 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1I)Cl eb75f303d4441089efb20c3fe6fdd875 [0,2,0,0,0,0|2,0,0]=4 11038 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1O)Cl 1e76a84b03ec55051d2b0a6c2db53961 [0,2,0,0,0,0|2,0,0]=4 11039 B17R1.66846 CCCCCCNC(=O)c1cnc(cc1O)O eb8ebc5f3f2b21d61d7127a8b36a46ab [0,2,0,0,0,0|2,0,0]=4 11040 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Br)Br 2b2e9fa9934da9830c374b5576deacd9 [0,2,0,0,0,0|2,0,0]=4 11041 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Br)C 250e15c6b3886a644df99bc9c941660e [0,2,0,0,0,0|2,0,0]=4 11042 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Br)Cl af17e82e9708bc06958774088388e849 [0,2,0,0,0,0|2,0,0]=4 11043 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Br)F 232e260adfc1f18f19fa04615f999812 [0,2,0,0,0,0|2,0,0]=4 11044 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1C)Br 32fb0d1c6408be8c1525cfe57c235f80 [0,2,0,0,0,0|2,0,0]=4 11045 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1C)C ee193056d91dee9177d4724646620667 [0,2,0,0,0,0|2,0,0]=4 11046 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1C)Cl 3ed3e675f124164c6655408f95d779b2 [0,2,0,0,0,0|2,0,0]=4 11047 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1C)F 819883a24c58ef771c64c9aaf01c3793 [0,2,0,0,0,0|2,0,0]=4 11048 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Cl)Br 5f8aa24401179e06b9b0bdb1b3bca97f [0,2,0,0,0,0|2,0,0]=4 11049 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Cl)Cl 1d3f1ff41bda05a350c42b28bc9e0f3d [0,2,0,0,0,0|2,0,0]=4 11050 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1Cl)F a233e0e402c730c010c6c23b4f9ca59e [0,2,0,0,0,0|2,0,0]=4 11051 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1F)Br 41c340bf58b89d7140ab859ebdd1d2b4 [0,2,0,0,0,0|2,0,0]=4 11052 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1F)C db71ee4c7485ea293330304b14aea4fc [0,2,0,0,0,0|2,0,0]=4 11053 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1F)Cl 26bae543ffc6ed289f709db1d818b9c7 [0,2,0,0,0,0|2,0,0]=4 11054 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1F)F 0c68711ef851418f5a4ee1bc64620f0b [0,2,0,0,0,0|2,0,0]=4 11055 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1F)O de273140b828de27db76bbe3d6299eb2 [0,2,0,0,0,0|2,0,0]=4 11056 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1O)Br 4cbc2d06c657f47dc421545299bf03cd [0,2,0,0,0,0|2,0,0]=4 11057 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1O)C 7fa5bea99cc49e7e2ed71096d3b53bdd [0,2,0,0,0,0|2,0,0]=4 11058 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1O)Cl 31ed53c23b82c9ea2a9f8d5aec30b01f [0,2,0,0,0,0|2,0,0]=4 11059 B17R1.66846 CCCCCCNC(=O)c1ncc(cc1O)F c5ec6c1bd5fd9e84223c2721705f49e0 [0,2,0,0,0,0|2,0,0]=4 11060 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1C)C 516e6d6337c0122f02de2fb322a7f151 [0,2,0,0,0,0|2,0,0]=4 11061 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1C)Cl cae7076e9cd8e92306cb33be89e35ed2 [0,2,0,0,0,0|2,0,0]=4 11062 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1Cl)Cl c9d326063576ef8178fae84ad923d881 [0,2,0,0,0,0|2,0,0]=4 11063 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1Cl)F cd868395d2b15477b003aa9b3ce3cf66 [0,2,0,0,0,0|2,0,0]=4 11064 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1F)Br 4c72d5cfa4f4734485da947273ca8713 [0,2,0,0,0,0|2,0,0]=4 11065 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1F)Cl dd63b143e0e4a716ff800b7c186cdf0d [0,2,0,0,0,0|2,0,0]=4 11066 B17R1.66846 CCCCCNCC(=O)c1ccc(cc1F)F 34c015ffae373ff28c8bdd5fe3e7a1f0 [0,2,0,0,0,0|2,0,0]=4 11067 B17R1.66846 CCCCCOCC(=O)c1ccc(cc1C)Cl c3853f9d748d65f9c0b7b6c302df99d9 [0,2,0,0,0,0|2,0,0]=4 11068 B17R1.66846 CCCCCOCC(=O)c1ccc(cc1Cl)Cl 2704575e1ca66deb366cfba18e2cedc2 [0,2,0,0,0,0|2,0,0]=4 11069 B17R1.66846 CCCCCOCC(=O)c1ccc(cc1Cl)F 8ed5fdbc7eb391cf82fcd92bb751f6a2 [0,2,0,0,0,0|2,0,0]=4 11070 B17R1.66846 CCCCCOCC(=O)c1ccc(cc1F)Cl ec22a8c9a37b06ca9133ff6d764d4d3b [0,2,0,0,0,0|2,0,0]=4 11071 B17R1.66846 CCCCCOCC(=O)c1ccc(cc1F)F 0efeb4712ace74dbdeebd434a2b3eddd [0,2,0,0,0,0|2,0,0]=4 11072 B17R1.66846 CCCCCOCC(=O)c1ccc(cc1O)O 606732a5a6ddfa9c46e322b2a223c650 [0,2,0,0,0,0|2,0,0]=4 11073 B17R1.66846 CCCCNCOC(=O)c1ccc(cc1Cl)Cl 29de116299d825131c8d5bd8a7eef1b7 [0,2,0,0,0,0|1,0,0]=3 11074 B17R1.66846 CCCCOCOC(=O)c1ccc(cc1Cl)Cl 0dbbdf5f5ad9817e7b9706102efc58ee [0,2,0,0,0,0|1,0,0]=3 11075 B17R1.66846 CCCNCCCC(=O)c1ccc(cc1F)F e7fc651b7dc1650d232295246d09d45a [0,2,0,0,0,0|2,0,0]=4 11076 B17R1.66846 CCCOCCCC(=O)c1ccc(cc1F)F 3f388c041d5d564c48b112de3f3ec321 [0,2,0,0,0,0|2,0,0]=4 11077 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Br)Br b01358bba7e6e6bc9ab9ff87be03c5b3 [0,2,0,0,0,0|2,0,0]=4 11078 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Br)C 94179ba8c6011ac82c2aad4679c0b3de [0,2,0,0,0,0|2,0,0]=4 11079 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Br)Cl 5d5f04aeba60ec2a343a5c609b5186de [0,2,0,0,0,0|2,0,0]=4 11080 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Br)F 2816978e17c3ca6d8e3f778224aa5126 [0,2,0,0,0,0|2,0,0]=4 11081 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Br)I a1e8269e9dac269dae929a4b1d39fc49 [0,2,0,0,0,0|2,0,0]=4 11082 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Br)O 6ae90b2ec776704c5efcf1446e542d1a [0,2,0,0,0,0|2,0,0]=4 11083 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1C)Br 3b3fde788660d080c65a16366800ef0b [0,2,0,0,0,0|2,0,0]=4 11084 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1C)C d9bd2fd1e1ac070e64f692c93ea1660d [0,2,0,0,0,0|2,0,0]=4 11085 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1C)Cl 48f31cc18e653c56e9b4bd74d5cedf9f [0,2,0,0,0,0|2,0,0]=4 11086 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1C)F b8456ed73c6d78428b8319d6d67a00e2 [0,2,0,0,0,0|2,0,0]=4 11087 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1C)I 9e963049948e962f5bd908663447b07f [0,2,0,0,0,0|2,0,0]=4 11088 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1C)O 2dd2bc3ba3521118f4d5a6b26599ac46 [0,2,0,0,0,0|2,0,0]=4 11089 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Cl)Br 19c9b57fe723c1d0157358f77f78ee9f [0,2,0,0,0,0|2,0,0]=4 11090 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Cl)C a19e2c5279acbb7098703ecc521c43be [0,2,0,0,0,0|2,0,0]=4 11091 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Cl)Cl 2a6075c962fb20733f48b77c3679e01d [0,2,0,0,0,0|2,0,0]=4 11092 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Cl)F 8b2c21140e9914f6d4e244850de220d3 [0,2,0,0,0,0|2,0,0]=4 11093 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Cl)I fd965a38d784fb7fa971e4eb6cfdf47d [0,2,0,0,0,0|2,0,0]=4 11094 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1Cl)O 737056771cbfbce992ec56b2c89ca687 [0,2,0,0,0,0|2,0,0]=4 11095 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)Br fd466afec3cc2eeb8adfe338143e3926 [0,2,0,0,0,0|2,0,0]=4 11096 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)C 249472713882d548d1286042470ea3a3 [0,2,0,0,0,0|2,0,0]=4 11097 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)Cl c5eedcd64e42673fcdabdde651c21d07 [0,2,0,0,0,0|2,0,0]=4 11098 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)F 0c96edbb9dc861a8d5d8065d45a0b550 [0,2,0,0,0,0|2,0,0]=4 11099 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)I 5c59366db6182ab2f428d5a10e488648 [0,2,0,0,0,0|2,0,0]=4 11100 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)O 43b213e1c6361f51484c48abe12a6799 [0,2,0,0,0,0|2,0,0]=4 11101 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1F)S 0c5f5891f1a0d959c710f0f785e43351 [0,2,0,0,0,0|2,0,0]=4 11102 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1I)Br adba406f025e46188d18d4fbbc03e7ac [0,2,0,0,0,0|2,0,0]=4 11103 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1I)C 57dc6d642ea478b49a8f69d18569035f [0,2,0,0,0,0|2,0,0]=4 11104 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1I)Cl 51cdea97232f9a0303f2bf868ab194e8 [0,2,0,0,0,0|2,0,0]=4 11105 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1I)F 3f04a8f92ecfaedf1dab0feb3edcc3c1 [0,2,0,0,0,0|2,0,0]=4 11106 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1O)Br 790d6ef52301dcb8153f39cfdfeba944 [0,2,0,0,0,0|2,0,0]=4 11107 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1O)C 9455a72d06da9366a5040df8e51ab72b [0,2,0,0,0,0|2,0,0]=4 11108 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1O)Cl 39ee0324c35c3191923edf8d5a5cea73 [0,2,0,0,0,0|2,0,0]=4 11109 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1O)F 3d99bfd64f4e6178f038790e2f8a4950 [0,2,0,0,0,0|2,0,0]=4 11110 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1O)I 9762ccfd25fc96f081dc0dceb68dc6e6 [0,2,0,0,0,0|2,0,0]=4 11111 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1O)O 029184aee724aa48ad27bf789b838d7e [0,2,0,0,0,0|2,0,0]=4 11112 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1S)Br aa49f4fd24ecaf646d9673b7d14396f3 [0,2,0,0,0,0|2,0,0]=4 11113 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1S)Cl 7b8326ed41242b447f0c926886406df8 [0,2,0,0,0,0|2,0,0]=4 11114 B17R1.66846 CCCOCCNC(=O)c1ccc(cc1S)F a884f145c0af5a916645ad93b3de27fb [0,2,0,0,0,0|2,0,0]=4 11115 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Br)Br a4cb823657964d48a448467a51114591 [0,2,0,0,0,0|2,0,0]=4 11116 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Br)C 8267c9e94810291feb3bea32f772e473 [0,2,0,0,0,0|2,0,0]=4 11117 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Br)Cl 61c0a227aad4e0d6baf3ca3aea53e2c3 [0,2,0,0,0,0|2,0,0]=4 11118 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Br)F 65b38ef00ae9c3251cdfa0fb7a74a967 [0,2,0,0,0,0|2,0,0]=4 11119 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Br)I 283def08f2ba2b0daa2b7afdcee86e55 [0,2,0,0,0,0|2,0,0]=4 11120 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Br)O 4bde2c8303a1fa1166334b729e74d9e9 [0,2,0,0,0,0|2,0,0]=4 11121 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1C)Br 724e359fd73fd6d92fc48c9167e72fd6 [0,2,0,0,0,0|2,0,0]=4 11122 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1C)C ef1ffc2960e9766e0d78ad5f06b4f2c1 [0,2,0,0,0,0|2,0,0]=4 11123 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1C)Cl 7e2752644e5b569aa0bf2875a656bd18 [0,2,0,0,0,0|2,0,0]=4 11124 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1C)F 15d956de5124db610503592822849bc7 [0,2,0,0,0,0|2,0,0]=4 11125 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1C)I 8dd597a967ed4ee0b4368a250176c1cc [0,2,0,0,0,0|2,0,0]=4 11126 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1C)O 4ac8f8ff0fae7e376c20b6a5411b968c [0,2,0,0,0,0|2,0,0]=4 11127 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Cl)Br 2dec59bcc5780805f69f6614cfa5736c [0,2,0,0,0,0|2,0,0]=4 11128 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Cl)C 1339c6a8db00f5e19d1321e5b85d32a6 [0,2,0,0,0,0|2,0,0]=4 11129 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Cl)Cl d34c487f74dba6c7c5904d1343ecc9db [0,2,0,0,0,0|2,0,0]=4 11130 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Cl)F cda60f43c5273006f3e6615f482cc459 [0,2,0,0,0,0|2,0,0]=4 11131 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Cl)I 3d03663c88fa31c68def0e3c1f8e378e [0,2,0,0,0,0|2,0,0]=4 11132 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1Cl)O 5ee28e7de740dae8169bfead42119d7a [0,2,0,0,0,0|2,0,0]=4 11133 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)Br b6dea4b120ef80ce081884d5497ff16a [0,2,0,0,0,0|2,0,0]=4 11134 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)C b6e9c28b2e4af455ce368eb195723fc2 [0,2,0,0,0,0|2,0,0]=4 11135 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)Cl 07d63543cfcf4a33b550687da9e7f923 [0,2,0,0,0,0|2,0,0]=4 11136 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)F b1dd614a1b60952e48ad617af0b7f103 [0,2,0,0,0,0|2,0,0]=4 11137 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)I 561d8bb1d5c11fcd991df142fd4a275c [0,2,0,0,0,0|2,0,0]=4 11138 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)O 8c266be74de61b9a71c6de3e19dbb0c9 [0,2,0,0,0,0|2,0,0]=4 11139 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1F)S aab7755ede35f6b8db994d240c171e19 [0,2,0,0,0,0|2,0,0]=4 11140 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1I)Br 16118aa5d468c92fcb10eacd09334da8 [0,2,0,0,0,0|2,0,0]=4 11141 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1I)C 960f251e150af84e257d5cc593b6ae65 [0,2,0,0,0,0|2,0,0]=4 11142 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1I)Cl 9532ced21bc19e66bc71c7b3145e4845 [0,2,0,0,0,0|2,0,0]=4 11143 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1I)F 94f78e5d9c76bd8bfaf57e8652ac64bf [0,2,0,0,0,0|2,0,0]=4 11144 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1O)Br 621f39e29341a90512cc0dc85a4bbb67 [0,2,0,0,0,0|2,0,0]=4 11145 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1O)C 5ed333a5ba7f505d1d263ab369161b72 [0,2,0,0,0,0|2,0,0]=4 11146 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1O)Cl b6ad5a57ed39445e545dd16c2d96d5b6 [0,2,0,0,0,0|2,0,0]=4 11147 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1O)F 31d667a27dfe498aec521edf6f7d7c98 [0,2,0,0,0,0|2,0,0]=4 11148 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1O)I b5fbbfa0cf4abb6477b3904dc1ece58b [0,2,0,0,0,0|2,0,0]=4 11149 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1O)O 5008f2fc18bf4aa2b1c2c70d7e21fd5a [0,2,0,0,0,0|2,0,0]=4 11150 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1S)Br c58b2759e2c174ddc7f089ca0a612a2c [0,2,0,0,0,0|2,0,0]=4 11151 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1S)Cl 80734f77549267ddf584ec4324d2349d [0,2,0,0,0,0|2,0,0]=4 11152 B17R1.66846 CCOCCCNC(=O)c1ccc(cc1S)F 891c3306b2695f41d4bc635c581d41bc [0,2,0,0,0,0|2,0,0]=4 11153 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Br)Br a3d2607ad3a1a8c4aed763f683398b23 [0,2,0,0,0,0|2,0,0]=4 11154 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Br)C 8d9c4e238f18a9e69097fd27b607c3f3 [0,2,0,0,0,0|2,0,0]=4 11155 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Br)Cl 42f4ca9557a45e42b7adad3810f7e4d8 [0,2,0,0,0,0|2,0,0]=4 11156 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Br)F c7734e0fbbe52e7c90f9be4e292743c3 [0,2,0,0,0,0|2,0,0]=4 11157 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Br)I 6462810b783cf9cb8abeb094a05856d2 [0,2,0,0,0,0|2,0,0]=4 11158 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Br)O 9e86f8bffc2f51d949b12151dbb9d033 [0,2,0,0,0,0|2,0,0]=4 11159 B17R1.66846 COCCCCNC(=O)c1ccc(cc1C)Br 52a932f0c6d4f3725d9901d5a91361c0 [0,2,0,0,0,0|2,0,0]=4 11160 B17R1.66846 COCCCCNC(=O)c1ccc(cc1C)C 5dd0c52786279b4042fb8b01bc7110c7 [0,2,0,0,0,0|2,0,0]=4 11161 B17R1.66846 COCCCCNC(=O)c1ccc(cc1C)Cl 2bf8553a88a41c0c19e431764c3c7705 [0,2,0,0,0,0|2,0,0]=4 11162 B17R1.66846 COCCCCNC(=O)c1ccc(cc1C)F 1df0b434f8ce48294792b46a21e26036 [0,2,0,0,0,0|2,0,0]=4 11163 B17R1.66846 COCCCCNC(=O)c1ccc(cc1C)I db4a58e6f339af7658005f374eeda8d6 [0,2,0,0,0,0|2,0,0]=4 11164 B17R1.66846 COCCCCNC(=O)c1ccc(cc1C)O dd5aa99b391da9699ee5c56a596fd6a3 [0,2,0,0,0,0|2,0,0]=4 11165 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Cl)Br bba9bb69bc4af6d979f5a5f7da9b37f0 [0,2,0,0,0,0|2,0,0]=4 11166 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Cl)C 29c97b10bca43c18844a7b2893bf2fa2 [0,2,0,0,0,0|2,0,0]=4 11167 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Cl)Cl 5f95bd4189e65d0310b93a2ccbb2773d [0,2,0,0,0,0|2,0,0]=4 11168 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Cl)F be121f8b5babbd8f4b70adc404922172 [0,2,0,0,0,0|2,0,0]=4 11169 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Cl)I 8259b32b67360ee3359e2dbdbace592b [0,2,0,0,0,0|2,0,0]=4 11170 B17R1.66846 COCCCCNC(=O)c1ccc(cc1Cl)O 229f4391b7e425ac43153e3b45e5d71e [0,2,0,0,0,0|2,0,0]=4 11171 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)Br ca576298f793d2561ad4cc3aa468c3a8 [0,2,0,0,0,0|2,0,0]=4 11172 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)C 92a79e564b8dd170db04e3f996d6455a [0,2,0,0,0,0|2,0,0]=4 11173 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)Cl fcef6b941929763920237f0d5f2babd6 [0,2,0,0,0,0|2,0,0]=4 11174 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)F abe89c2029e5b713bbf44aff3723f389 [0,2,0,0,0,0|2,0,0]=4 11175 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)I 6815e4cd08ec7250fea8a76580471413 [0,2,0,0,0,0|2,0,0]=4 11176 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)O 40060d04bc2991c594b712bf0a7a3692 [0,2,0,0,0,0|2,0,0]=4 11177 B17R1.66846 COCCCCNC(=O)c1ccc(cc1F)S d96cebced37359ecc4e69551f4bb4569 [0,2,0,0,0,0|2,0,0]=4 11178 B17R1.66846 COCCCCNC(=O)c1ccc(cc1I)Br 987258c8f67662f289617dc5661ff0d7 [0,2,0,0,0,0|2,0,0]=4 11179 B17R1.66846 COCCCCNC(=O)c1ccc(cc1I)C 35a5139c0c98782d684a082c1d58a7d8 [0,2,0,0,0,0|2,0,0]=4 11180 B17R1.66846 COCCCCNC(=O)c1ccc(cc1I)Cl 18ff9a5ac5e4e261f2c6e5abdb5f3ae7 [0,2,0,0,0,0|2,0,0]=4 11181 B17R1.66846 COCCCCNC(=O)c1ccc(cc1I)F e435a59cf48b611f60601d5b33c53776 [0,2,0,0,0,0|2,0,0]=4 11182 B17R1.66846 COCCCCNC(=O)c1ccc(cc1O)Br 64f9b5a5f6c393a4d542856b46d59d87 [0,2,0,0,0,0|2,0,0]=4 11183 B17R1.66846 COCCCCNC(=O)c1ccc(cc1O)C 8d463d00bfea2f637ace1de62edc429d [0,2,0,0,0,0|2,0,0]=4 11184 B17R1.66846 COCCCCNC(=O)c1ccc(cc1O)Cl be8fe7a753b0db8ff011f8231e98d263 [0,2,0,0,0,0|2,0,0]=4 11185 B17R1.66846 COCCCCNC(=O)c1ccc(cc1O)F dd9b9959eb25275df9f50e958004088a [0,2,0,0,0,0|2,0,0]=4 11186 B17R1.66846 COCCCCNC(=O)c1ccc(cc1O)I ff6667a47fccbbddefdea6f2eda161d2 [0,2,0,0,0,0|2,0,0]=4 11187 B17R1.66846 COCCCCNC(=O)c1ccc(cc1O)O 07f7f9a0e570dbc4cd3d0a9ce070340a [0,2,0,0,0,0|2,0,0]=4 11188 B17R1.66846 COCCCCNC(=O)c1ccc(cc1S)Br 01f0b8197ad468935aa618f077c32bbe [0,2,0,0,0,0|2,0,0]=4 11189 B17R1.66846 COCCCCNC(=O)c1ccc(cc1S)Cl 340f791b64753d5916d486eec7ab40bc [0,2,0,0,0,0|2,0,0]=4 11190 B17R1.66846 COCCCCNC(=O)c1ccc(cc1S)F 89d0c4cf93d3f7e91a95263fd5092f6e [0,2,0,0,0,0|2,0,0]=4 11191 B17R1.66846 COCCNCOC(=O)c1ccc(cc1Cl)Cl 179982cc8291d7ec49eb7eec06b94b37 [0,2,0,0,0,0|2,0,0]=4 11192 B17R1.66846 COCCOCOC(=O)c1ccc(cc1Cl)Cl ba3a071d55dae0121f78fe82bac29ffa [0,2,0,0,0,0|2,0,0]=4 11193 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Br)Br 697dcbe7814a4ccf0af489c5616bd5e9 [0,2,0,0,0,0|2,0,0]=4 11194 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Br)C 073f7aa86fd593fa7f9516cf749590d8 [0,2,0,0,0,0|2,0,0]=4 11195 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Br)Cl 8b335c485dbca1b3986c0fc687b0ea4b [0,2,0,0,0,0|2,0,0]=4 11196 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Br)F b520063541f35a4cb13e1e7f47b2411b [0,2,0,0,0,0|2,0,0]=4 11197 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Br)I 23520ac6d060e061a5f5fd9fc2182d73 [0,2,0,0,0,0|2,0,0]=4 11198 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Br)O f0bf9d276397e202f20b20b6e32a495d [0,2,0,0,0,0|2,0,0]=4 11199 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1C)Br e0d8a57269c779f908c38530088ea233 [0,2,0,0,0,0|2,0,0]=4 11200 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1C)C c271fc95f5d1077cd65ed782ab7f7746 [0,2,0,0,0,0|2,0,0]=4 11201 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1C)Cl 866b37342971dbc43a508db34a6b541a [0,2,0,0,0,0|2,0,0]=4 11202 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1C)F cde436f1d037b571e7d6ca6e5ed37a6c [0,2,0,0,0,0|2,0,0]=4 11203 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1C)I 3e6aecf4762e514f94c2af0d25f0897c [0,2,0,0,0,0|2,0,0]=4 11204 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1C)O 6e5406e33299d9fd2a376c97f39812da [0,2,0,0,0,0|2,0,0]=4 11205 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Cl)Br 8ec1b5596b77e11cc6cc9a1f23ba8a91 [0,2,0,0,0,0|2,0,0]=4 11206 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Cl)C 615e29781692d891235fc1eae0e65f3e [0,2,0,0,0,0|2,0,0]=4 11207 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Cl)Cl 3458295cd7da618e8318cc6bc4d8c6f0 [0,2,0,0,0,0|2,0,0]=4 11208 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Cl)F 9b65dcb19686d56a443a15450c8270de [0,2,0,0,0,0|2,0,0]=4 11209 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Cl)I 895778e58738a346b2672ada249d8a04 [0,2,0,0,0,0|2,0,0]=4 11210 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1Cl)O 2052d3c628b90eb950e9c6994ee8f4fd [0,2,0,0,0,0|2,0,0]=4 11211 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)Br a1e23ce06003f8e74131bd14b8a25b79 [0,2,0,0,0,0|2,0,0]=4 11212 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)C e80a0197b3f373cf5ecbcfd7a0a1db18 [0,2,0,0,0,0|2,0,0]=4 11213 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)Cl db4f3417031e8e5a5893c110daaef891 [0,2,0,0,0,0|2,0,0]=4 11214 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)F b2b88476b234cbc956f57a07f103dacf [0,2,0,0,0,0|2,0,0]=4 11215 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)I 227da54b10004e77dee0bb0442d394a6 [0,2,0,0,0,0|2,0,0]=4 11216 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)O a7cee7326e460bbe8fcef4de65c20876 [0,2,0,0,0,0|2,0,0]=4 11217 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1F)S ba7cb78a1835d75086dc980a473af459 [0,2,0,0,0,0|2,0,0]=4 11218 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1I)Br 7c1b7e9a70ff553b923480a9859b848f [0,2,0,0,0,0|2,0,0]=4 11219 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1I)C 2ac6aecfd6ac96316b9e64e6deaac4ce [0,2,0,0,0,0|2,0,0]=4 11220 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1I)Cl 501c1a68ad834041bbf20d47f0c5b7e4 [0,2,0,0,0,0|2,0,0]=4 11221 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1I)F 3e37dad5c38f58d9a12dcab1d8ccacdf [0,2,0,0,0,0|2,0,0]=4 11222 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1O)Br 2391acf46b85d4a66961595eca4b7c7a [0,2,0,0,0,0|2,0,0]=4 11223 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1O)C c779f6e34f6742bdf1c896c1242a2621 [0,2,0,0,0,0|2,0,0]=4 11224 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1O)Cl e27cdcc080e949395d4880bd329603db [0,2,0,0,0,0|2,0,0]=4 11225 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1O)F 41bb49dc26a995369fb2c17b367aa574 [0,2,0,0,0,0|2,0,0]=4 11226 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1O)I 71890f7a22d0580d0b8672511fdfe879 [0,2,0,0,0,0|2,0,0]=4 11227 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1O)O 7370661b1863bff2b4e06bef2bf19b0b [0,2,0,0,0,0|2,0,0]=4 11228 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1S)Br 31a82917005188ee3627579d8f862cea [0,2,0,0,0,0|2,0,0]=4 11229 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1S)Cl 27996efddb542d2284faa7fffd7eba68 [0,2,0,0,0,0|2,0,0]=4 11230 B17R1.66846 CSCCCCNC(=O)c1ccc(cc1S)F 86e1c769fb5f158b27579b96d73f189e [0,2,0,0,0,0|2,0,0]=4 11231 B17R1.66846 CSCCNCOC(=O)c1ccc(cc1Cl)Cl 867e6a1a3b6423345b855b9c701a651d [0,2,0,0,0,0|2,0,0]=4 11232 B17R1.66846 CSCCOCOC(=O)c1ccc(cc1Cl)Cl a0d356a72353045116b6fb3162606efc [0,2,0,0,0,0|2,0,0]=4 11233 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCCl)Br 67a40d924c40dd0f1a09c6441ab8c5d2 [0,2,0,0,0,0|2,0,0]=4 11234 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCCl)Cl a97c9d6339488e15f1671907f5a6b907 [0,2,0,0,0,0|2,0,0]=4 11235 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCCl)F 8be6fc0d1412316318d6d73f75b7ea36 [0,2,0,0,0,0|2,0,0]=4 11236 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCCl)I 9b7d14e5c9c167aeaf1165a3869becca [0,2,0,0,0,0|2,0,0]=4 11237 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCCl)O 46d15c7fed73d598bdc75aaa0e3b1101 [0,2,0,0,0,0|2,0,0]=4 11238 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCO)Br b9edb0316558c0dac917bec1a51c37e9 [0,2,0,0,0,0|2,0,0]=4 11239 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCO)Cl e1ad37c3dc012ec502dc8666b83d6915 [0,2,0,0,0,0|2,0,0]=4 11240 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCO)F 812aabd47b326173464995b1760c595e [0,2,0,0,0,0|2,0,0]=4 11241 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCO)I 679ffbc52376f301b7e5005c68f55e3d [0,2,0,0,0,0|2,0,0]=4 11242 B17R1.66846 Cc1cc(ccc1C(=O)NCCCCCO)O 7fa66fdbbaf538fe655f3d19da7cf7a8 [0,2,0,0,0,0|2,0,0]=4 11243 B17R1.66846 Cc1ccc(c(c1)Br)C(=O)NCCCCCCl 41e8b83ae2c1f1e1fb770b848101a8a3 [0,2,0,0,0,0|2,0,0]=4 11244 B17R1.66846 Cc1ccc(c(c1)Br)C(=O)NCCCCCO bd4fb32213e2d67be992a92bc659b635 [0,2,0,0,0,0|2,0,0]=4 11245 B17R1.66846 Cc1ccc(c(c1)C)C(=O)NCCCCCCl 6ff3576a5471609618a10447d3bdec61 [0,2,0,0,0,0|2,0,0]=4 11246 B17R1.66846 Cc1ccc(c(c1)C)C(=O)NCCCCCO cf53a103f5477aad8649aa2c57280b16 [0,2,0,0,0,0|2,0,0]=4 11247 B17R1.66846 Cc1ccc(c(c1)Cl)C(=O)NCCCCCCl ea41ffcdd9b6334c4000e115c1004ef0 [0,2,0,0,0,0|2,0,0]=4 11248 B17R1.66846 Cc1ccc(c(c1)Cl)C(=O)NCCCCCO 55c1b838809c10d8b6a2399ab1a8dd63 [0,2,0,0,0,0|2,0,0]=4 11249 B17R1.66846 Cc1ccc(c(c1)F)C(=O)NCCCCCCl c3d7e061830e7df42ce71e74b2571c7f [0,2,0,0,0,0|2,0,0]=4 11250 B17R1.66846 Cc1ccc(c(c1)F)C(=O)NCCCCCO 935608ce3e64715b3a5d6335f4d273eb [0,2,0,0,0,0|2,0,0]=4 11251 B17R1.66846 Cc1ccc(c(c1)I)C(=O)NCCCCCCl db9656e98acb5c31c4095746c3153171 [0,2,0,0,0,0|2,0,0]=4 11252 B17R1.66846 Cc1ccc(c(c1)I)C(=O)NCCCCCO d9b8b2b261afb4f3fcc6001a928142a1 [0,2,0,0,0,0|2,0,0]=4 11253 B17R1.66846 Cc1ccc(c(c1)O)C(=O)NCCCCCCl 7b1dde6b82225a6e035afbb5120a5e0f [0,2,0,0,0,0|2,0,0]=4 11254 B17R1.66846 Cc1ccc(c(c1)O)C(=O)NCCCCCO 496c1e2bb41f5a3c30e8c33aa2fb4f7a [0,2,0,0,0,0|2,0,0]=4 11255 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Br)Br 838e2918978c8b25f0ff2b882edcb48b [0,2,0,0,0,0|2,0,0]=4 11256 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Br)Cl d7c7272e0c956efeb86ea9919e41852b [0,2,0,0,0,0|2,0,0]=4 11257 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Br)F d38baa804291237bdc0b5a45b919fca2 [0,2,0,0,0,0|2,0,0]=4 11258 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Br)I 083edfee8dbc95e3100eb67f62c38f13 [0,2,0,0,0,0|2,0,0]=4 11259 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Br)O e7e207f2a48bdff2e18aac4711a84086 [0,2,0,0,0,0|2,0,0]=4 11260 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Cl)Br f76e9c9142532df31297278a76b62393 [0,2,0,0,0,0|2,0,0]=4 11261 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Cl)Cl 5a4a151a320d40495004b2c2510a20fb [0,2,0,0,0,0|2,0,0]=4 11262 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Cl)F 02763f5acfde308d96cc1894c2ec6b24 [0,2,0,0,0,0|2,0,0]=4 11263 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Cl)I 49b0d1ec43da0ba3474b0fc318578650 [0,2,0,0,0,0|2,0,0]=4 11264 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1Cl)O 80fa3336a273a71da46bf2228a705957 [0,2,0,0,0,0|2,0,0]=4 11265 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1F)Br f417e8d8ce6dd3f91fbe4ef4713dafc3 [0,2,0,0,0,0|2,0,0]=4 11266 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1F)Cl 044be57e9989ad7143af064656968355 [0,2,0,0,0,0|2,0,0]=4 11267 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1F)F 67f36a90e06e95734882da2ab9d6526b [0,2,0,0,0,0|2,0,0]=4 11268 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1F)I 27a88b52d16a6ab84843aad4f85bbf28 [0,2,0,0,0,0|2,0,0]=4 11269 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1F)O 2505941691c2cf7018e0ba4b0f0ca264 [0,2,0,0,0,0|2,0,0]=4 11270 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1F)S 0ebb0bb2c1b84968742a59da0fe2d11a [0,2,0,0,0,0|2,0,0]=4 11271 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1I)Br ae6e21440447d2e25c7ad9336ac581ac [0,2,0,0,0,0|2,0,0]=4 11272 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1I)Cl 4fe3e6fab58d2c088720d257ecc63b34 [0,2,0,0,0,0|2,0,0]=4 11273 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1I)F 955b87f5c58517ae3c7811d7e97cb589 [0,2,0,0,0,0|2,0,0]=4 11274 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1O)Br 30c8186316a4aae8b41add94e140c39d [0,2,0,0,0,0|2,0,0]=4 11275 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1O)Cl 648048d93ed9b5d142595507618b0e14 [0,2,0,0,0,0|2,0,0]=4 11276 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1O)F 73610a66591dc61764d61c4f94d170cf [0,2,0,0,0,0|2,0,0]=4 11277 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1O)I c8233ad5c3151c260fed8918641d72f1 [0,2,0,0,0,0|2,0,0]=4 11278 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1O)O 79d3d993d48dbc8f6df7fb6fe432f3f4 [0,2,0,0,0,0|2,0,0]=4 11279 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1S)Br 4735f14a788718aaa2c528ca63fdaa25 [0,2,0,0,0,0|2,0,0]=4 11280 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1S)Cl dd136a7bbd1e5a51ea00c35e307f9571 [0,2,0,0,0,0|2,0,0]=4 11281 B17R1.66846 O=C(NCCCCCCl)c1ccc(cc1S)F 6bece996fd0902648bd64a01da897810 [0,2,0,0,0,0|2,0,0]=4 11282 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Br)Br 1a3884e8e04214b4833ef96174b824a1 [0,2,0,0,0,0|2,0,0]=4 11283 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Br)Cl 2ecfb4604ce2957653b98d0cf02c580e [0,2,0,0,0,0|2,0,0]=4 11284 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Br)F 86312e0a8e65f47c4e3e1f5ec1eeaa1e [0,2,0,0,0,0|2,0,0]=4 11285 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Br)I 33ed06b75b520f5b361588161e7e86e1 [0,2,0,0,0,0|2,0,0]=4 11286 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Br)O 1b3749c5c55a0bdad6b8120988228cb6 [0,2,0,0,0,0|2,0,0]=4 11287 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Cl)Br bb5ead29374f04136bc576b379b96ba6 [0,2,0,0,0,0|2,0,0]=4 11288 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Cl)Cl df0f7491ba78ce0eed339ed136c298cf [0,2,0,0,0,0|2,0,0]=4 11289 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Cl)F 438ac34816cd9348a47bc823144afe1c [0,2,0,0,0,0|2,0,0]=4 11290 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Cl)I 1aff7100dfe930bea506a28883f1d118 [0,2,0,0,0,0|2,0,0]=4 11291 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1Cl)O 7b6238836ed4bef3a986c2927f00f0ec [0,2,0,0,0,0|2,0,0]=4 11292 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1F)Br eae36b9bb66a08e1edd918059e5615e3 [0,2,0,0,0,0|2,0,0]=4 11293 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1F)Cl 4f0b635a3e6656cd79e890bea444761d [0,2,0,0,0,0|2,0,0]=4 11294 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1F)F f967305ab327bb8df2af00d5b95dceba [0,2,0,0,0,0|2,0,0]=4 11295 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1F)I ceadf3c2b95a122cb56d318c25eb1d36 [0,2,0,0,0,0|2,0,0]=4 11296 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1F)O 8c2ca74b905988deb7daed19b7f982e0 [0,2,0,0,0,0|2,0,0]=4 11297 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1F)S d70bc606831095e4c7cf6e0aa8209b2c [0,2,0,0,0,0|2,0,0]=4 11298 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1I)Br 247d811646563448886a537aa59e87cc [0,2,0,0,0,0|2,0,0]=4 11299 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1I)Cl d129b783dc339574ba41b143770c3d66 [0,2,0,0,0,0|2,0,0]=4 11300 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1I)F 150036ce74e448d07970e2c9b2085ad7 [0,2,0,0,0,0|2,0,0]=4 11301 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1O)Br 0c8c08b5930fa2f66a3f6a1aab32f339 [0,2,0,0,0,0|2,0,0]=4 11302 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1O)Cl f1195fe0eef6f86a4eb9fb33e11a73df [0,2,0,0,0,0|2,0,0]=4 11303 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1O)F 6cba7c3579625fe9a71646fb717f2675 [0,2,0,0,0,0|2,0,0]=4 11304 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1O)I 2701e942d3871eab68bfcb08e89d5b0b [0,2,0,0,0,0|2,0,0]=4 11305 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1O)O 6bed531e15baac12b6d2b52ee5686cee [0,2,0,0,0,0|2,0,0]=4 11306 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1S)Br 9a94495dda1af13c32b9d76672c2334d [0,2,0,0,0,0|2,0,0]=4 11307 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1S)Cl d17c00bfd429f302275f5e3079d0711b [0,2,0,0,0,0|2,0,0]=4 11308 B17R1.66846 O=C(NCCCCCO)c1ccc(cc1S)F 0b120ea68fea9f244a63507807382311 [0,2,0,0,0,0|2,0,0]=4 11309 B17R1.66846 O=C(OCNCCCCl)c1ccc(cc1Cl)Cl 01d74bf98cb2ae7bc3e40dc432c169a3 [0,2,0,0,0,0|2,0,0]=4 11310 B17R1.66846 O=C(OCNCCCO)c1ccc(cc1Cl)Cl 55b0300ab9846275c8bb5d370db40643 [0,2,0,0,0,0|2,0,0]=4 11311 B17R1.66846 O=C(OCOCCCF)c1ccc(cc1Cl)Cl e596439bb654e1c90cbffba5e10cc528 [0,2,0,0,0,0|2,0,0]=4 11312 B17R1.66846 O=C(OCOCCCS)c1ccc(cc1Cl)Cl 20491225e4b84e0707ce0bcc0f775679 [0,2,0,0,0,0|2,0,0]=4 11313 B17R1.54 CCCCCCNC(=O)c1cccc(=O)n1C 8253e71909028fe387260559544a8a30 [0,2,0,0,0,0|2,0,0]=4 11314 B17R1.54 CCCCCCNC(=O)c1cccc(=O)n1O 60f99ae1084f6ac926a634de5e651863 [0,2,0,0,0,0|2,0,0]=4 11315 B17R1.54 CCCCCCNC(=O)c1cccc(=S)n1O 359439b49b403ae609854888a5002846 [0,2,0,0,0,0|2,0,0]=4 11316 B17R1.54 CCCCCCNC(=O)c1cccc([n+]1[O-])Cl c6ac586d90ed396970823eadef9a4a7e [0,2,0,0,0,0|2,0,0]=4 11317 B17R1.54 CCCCCCNC(=O)c1cccc(c1Br)Br 6e9024bacc2c9009398b8720013343d2 [0,2,0,0,0,0|1,0,0]=3 11318 B17R1.54 CCCCCCNC(=O)c1cccc(c1Br)C 09ba16c4f3a7506edc9228c54a7d0fa2 [0,2,0,0,0,0|1,0,0]=3 11319 B17R1.54 CCCCCCNC(=O)c1cccc(c1Br)Cl 92671a0aa2d1ebabb8c7fd34fd3e41f1 [0,2,0,0,0,0|1,0,0]=3 11320 B17R1.54 CCCCCCNC(=O)c1cccc(c1Br)F fcc990d7d766025610138560f746a280 [0,2,0,0,0,0|1,0,0]=3 11321 B17R1.54 CCCCCCNC(=O)c1cccc(c1Br)I 273d226e431ed536a23f49ba63b3ae84 [0,2,0,0,0,0|1,0,0]=3 11322 B17R1.54 CCCCCCNC(=O)c1cccc(c1Br)O 8951143116557240e2372bed223aa3f5 [0,2,0,0,0,0|1,0,0]=3 11323 B17R1.54 CCCCCCNC(=O)c1cccc(c1C)Br 49c9abb66f158ebcb248f0e2bbda2f71 [0,2,0,0,0,0|1,0,0]=3 11324 B17R1.54 CCCCCCNC(=O)c1cccc(c1C)C de80c788877ebfaa5e19028f49e5116b [0,2,0,0,0,0|1,0,0]=3 11325 B17R1.54 CCCCCCNC(=O)c1cccc(c1C)Cl a34a9cb09eb197efe0bd7fe6292a1d20 [0,2,0,0,0,0|1,0,0]=3 11326 B17R1.54 CCCCCCNC(=O)c1cccc(c1C)F 3b28a36969aad81ff928ba39c8ba9900 [0,2,0,0,0,0|1,0,0]=3 11327 B17R1.54 CCCCCCNC(=O)c1cccc(c1C)I 8009bdbbdfe824823dd70ec52376673e [0,2,0,0,0,0|1,0,0]=3 11328 B17R1.54 CCCCCCNC(=O)c1cccc(c1C)O c8cc2d74835fff21b9a280b0666fadf9 [0,2,0,0,0,0|1,0,0]=3 11329 B17R1.54 CCCCCCNC(=O)c1cccc(c1Cl)Br a184ce0c112208a238a4c6d2adee1954 [0,2,0,0,0,0|1,0,0]=3 11330 B17R1.54 CCCCCCNC(=O)c1cccc(c1Cl)C 7e385b93f3f857f44a49433d5dfc5008 [0,2,0,0,0,0|1,0,0]=3 11331 B17R1.54 CCCCCCNC(=O)c1cccc(c1Cl)Cl c544d8fb714c46553c48e0f27259bac5 [0,2,0,0,0,0|1,0,0]=3 11332 B17R1.54 CCCCCCNC(=O)c1cccc(c1Cl)F b993a19b07769444ae9fc05fc9a1ed62 [0,2,0,0,0,0|1,0,0]=3 11333 B17R1.54 CCCCCCNC(=O)c1cccc(c1Cl)I f4f621d0ba60f99cd629e45f57e8e47c [0,2,0,0,0,0|1,0,0]=3 11334 B17R1.54 CCCCCCNC(=O)c1cccc(c1Cl)O 0c9297a88bbe59ecc0c54a7b626c2643 [0,2,0,0,0,0|1,0,0]=3 11335 B17R1.54 CCCCCCNC(=O)c1cccc(c1F)Br 705c1211954225ef24669b7aef594eef [0,2,0,0,0,0|1,0,0]=3 11336 B17R1.54 CCCCCCNC(=O)c1cccc(c1F)C a83e673ba216d51efa66635b3400a6d5 [0,2,0,0,0,0|1,0,0]=3 11337 B17R1.54 CCCCCCNC(=O)c1cccc(c1F)Cl 0abd38836687be99b63876a2200e8099 [0,2,0,0,0,0|1,0,0]=3 11338 B17R1.54 CCCCCCNC(=O)c1cccc(c1F)F fe73c3b835b53be8c93801601babf17f [0,2,0,0,0,0|1,0,0]=3 11339 B17R1.54 CCCCCCNC(=O)c1cccc(c1F)I 32ac46a9455150c117de83e57053a2c2 [0,2,0,0,0,0|1,0,0]=3 11340 B17R1.54 CCCCCCNC(=O)c1cccc(c1F)O ee3e170e693477ab6b9332eeefc09a23 [0,2,0,0,0,0|1,0,0]=3 11341 B17R1.54 CCCCCCNC(=O)c1cccc(c1I)Br 7289b98d3d10d3d8c6455c0b2a36eacf [0,2,0,0,0,0|1,0,0]=3 11342 B17R1.54 CCCCCCNC(=O)c1cccc(c1I)C 20c4deeab7620238c2d8b79023a6fb5f [0,2,0,0,0,0|1,0,0]=3 11343 B17R1.54 CCCCCCNC(=O)c1cccc(c1I)Cl ade41c681ba7f437186a6dba43e1a7ef [0,2,0,0,0,0|1,0,0]=3 11344 B17R1.54 CCCCCCNC(=O)c1cccc(c1I)F 62ea9fd66a3a6515e5f8adc31c534175 [0,2,0,0,0,0|1,0,0]=3 11345 B17R1.54 CCCCCCNC(=O)c1cccc(c1I)O b102518b355353f081afe4dd4fd70c61 [0,2,0,0,0,0|1,0,0]=3 11346 B17R1.54 CCCCCCNC(=O)c1cccc(c1O)Br b63c4678331e7acefb4bab3c86c74a4c [0,2,0,0,0,0|1,0,0]=3 11347 B17R1.54 CCCCCCNC(=O)c1cccc(c1O)C b2b958692cf92328b09adefeecbdac38 [0,2,0,0,0,0|1,0,0]=3 11348 B17R1.54 CCCCCCNC(=O)c1cccc(c1O)Cl 8d609c9309cd02c1eac75de6eee7f5ec [0,2,0,0,0,0|1,0,0]=3 11349 B17R1.54 CCCCCCNC(=O)c1cccc(c1O)F 8ed44c975d321c3b28746886660ebfa8 [0,2,0,0,0,0|1,0,0]=3 11350 B17R1.54 CCCCCCNC(=O)c1cccc(c1O)O eda1d2c02bb9e753d5674b2b329356e6 [0,2,0,0,0,0|1,0,0]=3 11351 B17R1.54 CCCCCCNC(=O)c1cccn(c1=O)C 5c6d82df080dff42e40324986685834d [0,2,0,0,0,0|2,0,0]=4 11352 B17R1.54 CCCCCCNC(=O)c1cccn(c1=O)O 833c6bd155135548c71c0dc38f65c909 [0,2,0,0,0,0|2,0,0]=4 11353 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Br)Br 0fa779b7f78b15c16ee865af1d45748f [0,2,0,0,0,0|2,0,0]=4 11354 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Br)C 99bba27d469f1cb8f4e27079e5b8ba0e [0,2,0,0,0,0|2,0,0]=4 11355 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Br)Cl 970cb1a82b5863387cb7ec256f0b2abd [0,2,0,0,0,0|2,0,0]=4 11356 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Br)F 9769d2805a0ad79a773d86ac060ba6c2 [0,2,0,0,0,0|2,0,0]=4 11357 B17R1.54 CCCCCCNC(=O)c1ccnc(c1C)Br 22bc098c7a4eacd5a4806afea7887ae2 [0,2,0,0,0,0|2,0,0]=4 11358 B17R1.54 CCCCCCNC(=O)c1ccnc(c1C)C f8f746134c8a7fb75b56c505866bfb2f [0,2,0,0,0,0|2,0,0]=4 11359 B17R1.54 CCCCCCNC(=O)c1ccnc(c1C)Cl 1bcc670b06b218537e9ea4090d867ca6 [0,2,0,0,0,0|2,0,0]=4 11360 B17R1.54 CCCCCCNC(=O)c1ccnc(c1C)F 9ab06a76761c70f3ed324de7af6980ee [0,2,0,0,0,0|2,0,0]=4 11361 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Cl)Br df8ea570495cd2f72f5d7643ff80ddd7 [0,2,0,0,0,0|2,0,0]=4 11362 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Cl)Cl 670fbc35dfd9ac56be3873aba5dbb2ab [0,2,0,0,0,0|2,0,0]=4 11363 B17R1.54 CCCCCCNC(=O)c1ccnc(c1Cl)F e4c2a866f61166d9f74cf0fa91a25382 [0,2,0,0,0,0|2,0,0]=4 11364 B17R1.54 CCCCCCNC(=O)c1ccnc(c1F)Br f736d330f3640c7fc2ea62e5914c012a [0,2,0,0,0,0|2,0,0]=4 11365 B17R1.54 CCCCCCNC(=O)c1ccnc(c1F)C 7389b6d272822cac0a7063ee137440ab [0,2,0,0,0,0|2,0,0]=4 11366 B17R1.54 CCCCCCNC(=O)c1ccnc(c1F)F 3a7e15a0f7553f82af57359b87197460 [0,2,0,0,0,0|2,0,0]=4 11367 B17R1.54 CCCCCCNC(=O)c1ccnc(c1F)I 95e215decf5693e7dfca717ed92c65a8 [0,2,0,0,0,0|2,0,0]=4 11368 B17R1.54 CCCCCCNC(=O)c1ccnc(c1I)Br 93c4c87c478df5e0268b6fa424d20027 [0,2,0,0,0,0|2,0,0]=4 11369 B17R1.54 CCCCCCNC(=O)c1ccnc(c1I)Cl c198163ad59262b3e8aea7e6bafd2a61 [0,2,0,0,0,0|2,0,0]=4 11370 B17R1.54 CCCCCCNC(=O)c1ccnc(c1O)Cl 153517936417fe6b9d3f84f5b009dd44 [0,2,0,0,0,0|2,0,0]=4 11371 B17R1.54 CCCCCCNC(=O)c1ccnc(c1O)F 22ff51023e1352efbe7fa9b7bd1959a5 [0,2,0,0,0,0|2,0,0]=4 11372 B17R1.54 CCCCCCNC(=O)c1cncc(c1Br)Br c5a4b7473eb6385a18d0e570e340977e [0,2,0,0,0,0|2,0,0]=4 11373 B17R1.54 CCCCCCNC(=O)c1cncc(c1C)Br 15770f33c2cdfe83e6bd277f5907d4c0 [0,2,0,0,0,0|2,0,0]=4 11374 B17R1.54 CCCCCCNC(=O)c1cncc(c1C)C 8813f84e25175932fe091081cd259f77 [0,2,0,0,0,0|2,0,0]=4 11375 B17R1.54 CCCCCCNC(=O)c1cncc(c1C)Cl 1d6755940e33e1a3d2d293934f33db55 [0,2,0,0,0,0|2,0,0]=4 11376 B17R1.54 CCCCCCNC(=O)c1cncc(c1C)F 17bd4312938cd6f99e530fd6f3610578 [0,2,0,0,0,0|2,0,0]=4 11377 B17R1.54 CCCCCCNC(=O)c1cncc(c1Cl)Br 78b5dd754a465f81ef44099d35615b70 [0,2,0,0,0,0|2,0,0]=4 11378 B17R1.54 CCCCCCNC(=O)c1cncc(c1Cl)Cl 48b17110f1ba727c92884d4830144cda [0,2,0,0,0,0|2,0,0]=4 11379 B17R1.54 CCCCCCNC(=O)c1cncc(c1Cl)F 9ebb86d49ca23d6ec04d80f3d6ae3393 [0,2,0,0,0,0|2,0,0]=4 11380 B17R1.54 CCCCCCNC(=O)c1cncc(c1F)Br d9cdb7402a922186cfaa9cdb572b0103 [0,2,0,0,0,0|2,0,0]=4 11381 B17R1.54 CCCCCCNC(=O)c1cncc(c1I)Br fbef92883fa17afa1408a8393b20ae63 [0,2,0,0,0,0|2,0,0]=4 11382 B17R1.54 CCCCCCNC(=O)c1cncc(c1O)Br 6afded060d6a2f884a6ccd1c0589f96e [0,2,0,0,0,0|2,0,0]=4 11383 B17R1.54 CCCCCCNC(=O)c1nccc(c1Br)C ee2af85dc75d61a998f118ac674f2184 [0,2,0,0,0,0|2,0,0]=4 11384 B17R1.54 CCCCCCNC(=O)c1nccc(c1Br)Cl 0ff1b7b7f17312a7ab21eb37c7cdee45 [0,2,0,0,0,0|2,0,0]=4 11385 B17R1.54 CCCCCCNC(=O)c1nccc(c1C)Br 9f7e40b17e22c78407b018c9f13f90aa [0,2,0,0,0,0|2,0,0]=4 11386 B17R1.54 CCCCCCNC(=O)c1nccc(c1C)Cl d7eda02a42d9cf0e09232f330b811be8 [0,2,0,0,0,0|2,0,0]=4 11387 B17R1.54 CCCCCCNC(=O)c1nccc(c1Cl)C bbdf13d83575433f28a736f529ba115b [0,2,0,0,0,0|2,0,0]=4 11388 B17R1.54 CCCCCCNC(=O)c1nccc(c1Cl)Cl 28e58b4249d1a51102b65ab48e83182d [0,2,0,0,0,0|2,0,0]=4 11389 B17R1.54 CCCCCCNC(=O)c1nccc(c1Cl)F 8857156f48f5165420a865557debd35e [0,2,0,0,0,0|2,0,0]=4 11390 B17R1.54 CCCCCCNC(=O)c1nccc(c1F)Br ccfe42a21394da2ee165bbd5d2a84ea9 [0,2,0,0,0,0|2,0,0]=4 11391 B17R1.54 CCCCCCNC(=O)c1nccc(c1F)Cl 729308508c0e96582636154e64859481 [0,2,0,0,0,0|2,0,0]=4 11392 B17R1.54 CCCCCCNC(=O)c1nccc(c1F)I 08683de071954799ed51eb3aca39e054 [0,2,0,0,0,0|2,0,0]=4 11393 B17R1.54 CCCCCCNC(=O)c1nccc(c1O)C 9b812236e66f2eac987993e2ae529203 [0,2,0,0,0,0|2,0,0]=4 11394 B17R1.54 CCCCCCNC(=O)c1nccc(c1O)Cl 81fae6057cdc50508b30f552873be180 [0,2,0,0,0,0|2,0,0]=4 11395 B17R1.54 CCCCCCNC(=O)c1nccc(c1O)F 9f0fe8d16cf2d1f0c8db355d61d33011 [0,2,0,0,0,0|2,0,0]=4 11396 B17R1.54 CCCCCCOC(C)c1cccc(c1C)Cl 23f2dc73fee992fdeb9e0d5935bc3237 [0,2,0,0,0,0|1,0,1]=4 11397 B17R1.54 CCCCCNCC(=O)c1cccc(c1C)C d110bf5839e7f30e18681c25f2c759c2 [0,2,0,0,0,0|2,0,0]=4 11398 B17R1.54 CCCCCNCC(=O)c1cccc(c1C)I f02adb8260adc62380fb7906c717def5 [0,2,0,0,0,0|2,0,0]=4 11399 B17R1.54 CCCCCNCC(=O)c1cccc(c1Cl)F 83254a490c68b1e824fae3dc45f8f337 [0,2,0,0,0,0|2,0,0]=4 11400 B17R1.54 CCCCCNCC(=O)c1cccc(c1F)Br 2f6f95ee48e2601e8e235f98ad382523 [0,2,0,0,0,0|2,0,0]=4 11401 B17R1.54 CCCCCNCC(=O)c1cccc(c1F)Cl fb1cf4bdfe9e0d8255a82063fc07cd79 [0,2,0,0,0,0|2,0,0]=4 11402 B17R1.54 CCCCCNCC(=O)c1cccc(c1F)F 77695aaf2664c564847508c471fd4ea7 [0,2,0,0,0,0|2,0,0]=4 11403 B17R1.54 CCCCCOCC(=O)c1cccc(c1Cl)F e9ecbdf2983c80c5e20a031ccc9f4f1f [0,2,0,0,0,0|2,0,0]=4 11404 B17R1.54 CCCCCOCC(=O)c1cccc(c1F)Br f41325c85fab1fc37a25b6fb6e7632b1 [0,2,0,0,0,0|2,0,0]=4 11405 B17R1.54 CCCCCOCC(=O)c1cccc(c1F)Cl 01429410182ba50c575e341a4578220a [0,2,0,0,0,0|2,0,0]=4 11406 B17R1.54 CCCCCOCC(=O)c1cccc(c1F)F d08191483c55b43da2fbb75586315b28 [0,2,0,0,0,0|2,0,0]=4 11407 B17R1.54 CCCOCCNC(=O)c1cccc(c1Br)Br a5fb38a984738dcbb3eae75c927dbc2e [0,2,0,0,0,0|2,0,0]=4 11408 B17R1.54 CCCOCCNC(=O)c1cccc(c1Br)C 89cba6b69b4893a99e497d4d9c12bfa9 [0,2,0,0,0,0|2,0,0]=4 11409 B17R1.54 CCCOCCNC(=O)c1cccc(c1Br)Cl 9cef32edd54be1c7ee35d44dcceec586 [0,2,0,0,0,0|2,0,0]=4 11410 B17R1.54 CCCOCCNC(=O)c1cccc(c1Br)F e1c2de450661ca546aa33c23c28720cc [0,2,0,0,0,0|2,0,0]=4 11411 B17R1.54 CCCOCCNC(=O)c1cccc(c1Br)I 096f9f131730e3e4692abdfbe4631796 [0,2,0,0,0,0|2,0,0]=4 11412 B17R1.54 CCCOCCNC(=O)c1cccc(c1Br)O e6e65189ff29614636dbcb877e4489ec [0,2,0,0,0,0|2,0,0]=4 11413 B17R1.54 CCCOCCNC(=O)c1cccc(c1C)Br 2b82c76aacd520c95b250587d70a6415 [0,2,0,0,0,0|2,0,0]=4 11414 B17R1.54 CCCOCCNC(=O)c1cccc(c1C)C 45a2d9227c3e9ab1c0f0db74010f7bee [0,2,0,0,0,0|2,0,0]=4 11415 B17R1.54 CCCOCCNC(=O)c1cccc(c1C)Cl 093d9d6130a6f37290d20b9efd41519b [0,2,0,0,0,0|2,0,0]=4 11416 B17R1.54 CCCOCCNC(=O)c1cccc(c1C)F 6d203ec8024891afe867d0d51f79012a [0,2,0,0,0,0|2,0,0]=4 11417 B17R1.54 CCCOCCNC(=O)c1cccc(c1C)I f0435ab28df3a8891d490d12d4eb9a97 [0,2,0,0,0,0|2,0,0]=4 11418 B17R1.54 CCCOCCNC(=O)c1cccc(c1C)O 25c51cdb59400b035ae5e532ace0576a [0,2,0,0,0,0|2,0,0]=4 11419 B17R1.54 CCCOCCNC(=O)c1cccc(c1Cl)Br 233526e1de29f2b4800bbe6aabc2a8d9 [0,2,0,0,0,0|2,0,0]=4 11420 B17R1.54 CCCOCCNC(=O)c1cccc(c1Cl)C 76832fcea2be6860750a08021c6eecda [0,2,0,0,0,0|2,0,0]=4 11421 B17R1.54 CCCOCCNC(=O)c1cccc(c1Cl)Cl f3a26bc54f9fe6c77fec58517169b9ed [0,2,0,0,0,0|2,0,0]=4 11422 B17R1.54 CCCOCCNC(=O)c1cccc(c1Cl)F 9bd0b76dcfa814058d8b888cdf562156 [0,2,0,0,0,0|2,0,0]=4 11423 B17R1.54 CCCOCCNC(=O)c1cccc(c1Cl)I cac19a866efa778524c07f46422a91d1 [0,2,0,0,0,0|2,0,0]=4 11424 B17R1.54 CCCOCCNC(=O)c1cccc(c1Cl)O c12b194e8e943ccac6841c85a97a2069 [0,2,0,0,0,0|2,0,0]=4 11425 B17R1.54 CCCOCCNC(=O)c1cccc(c1F)Br edfaa183289de2d1f44a6ce23cd1c618 [0,2,0,0,0,0|2,0,0]=4 11426 B17R1.54 CCCOCCNC(=O)c1cccc(c1F)C aad74b3a2f70090f39f4db9d50912f49 [0,2,0,0,0,0|2,0,0]=4 11427 B17R1.54 CCCOCCNC(=O)c1cccc(c1F)Cl f9b311b81a1e8a3813408182880d2e25 [0,2,0,0,0,0|2,0,0]=4 11428 B17R1.54 CCCOCCNC(=O)c1cccc(c1F)F 5a2b363aa962d275e36df290ab8efc0e [0,2,0,0,0,0|2,0,0]=4 11429 B17R1.54 CCCOCCNC(=O)c1cccc(c1F)I d8855024910724b64319824dd56fb27d [0,2,0,0,0,0|2,0,0]=4 11430 B17R1.54 CCCOCCNC(=O)c1cccc(c1F)O 7706c91fb9949523cf3a97c5ae89b8de [0,2,0,0,0,0|2,0,0]=4 11431 B17R1.54 CCCOCCNC(=O)c1cccc(c1I)Br 2a0c451e0cb1d25222279708bd856dee [0,2,0,0,0,0|2,0,0]=4 11432 B17R1.54 CCCOCCNC(=O)c1cccc(c1I)C 3d48055c0359e64a8eb0b24f2e09efd6 [0,2,0,0,0,0|2,0,0]=4 11433 B17R1.54 CCCOCCNC(=O)c1cccc(c1I)Cl 3e44d28321c7dd70247e67ae1e22418e [0,2,0,0,0,0|2,0,0]=4 11434 B17R1.54 CCCOCCNC(=O)c1cccc(c1I)F ee44dd969ae257c08f0880e0749bbafe [0,2,0,0,0,0|2,0,0]=4 11435 B17R1.54 CCCOCCNC(=O)c1cccc(c1I)O af944f380aa8f63914fa269c30d94db6 [0,2,0,0,0,0|2,0,0]=4 11436 B17R1.54 CCCOCCNC(=O)c1cccc(c1O)Br 6f49174746bd8ad294c55b94a331bea3 [0,2,0,0,0,0|2,0,0]=4 11437 B17R1.54 CCCOCCNC(=O)c1cccc(c1O)C 65f0974a0cf6e22d5042ae666ccd3202 [0,2,0,0,0,0|2,0,0]=4 11438 B17R1.54 CCCOCCNC(=O)c1cccc(c1O)Cl 8a514408d336267beb9d8a708a50d9f8 [0,2,0,0,0,0|2,0,0]=4 11439 B17R1.54 CCCOCCNC(=O)c1cccc(c1O)F 95bbd91ff137a08873046ded57baff9b [0,2,0,0,0,0|2,0,0]=4 11440 B17R1.54 CCCOCCNC(=O)c1cccc(c1O)O dddbb942b343563e1050152d48f20c78 [0,2,0,0,0,0|2,0,0]=4 11441 B17R1.54 CCOCCCNC(=O)c1cccc(c1Br)Br 5e6f974630fb9c4454e5f5e7108f3c85 [0,2,0,0,0,0|2,0,0]=4 11442 B17R1.54 CCOCCCNC(=O)c1cccc(c1Br)C 3def399c2a50260e77e08cfdcd3d4448 [0,2,0,0,0,0|2,0,0]=4 11443 B17R1.54 CCOCCCNC(=O)c1cccc(c1Br)Cl 01e02e94265684a40ddf96caa242ea35 [0,2,0,0,0,0|2,0,0]=4 11444 B17R1.54 CCOCCCNC(=O)c1cccc(c1Br)F efd7c0c72f98f2a2fedf379ca9cec60b [0,2,0,0,0,0|2,0,0]=4 11445 B17R1.54 CCOCCCNC(=O)c1cccc(c1Br)I 8e40740bc82cb7c7009dd76608340344 [0,2,0,0,0,0|2,0,0]=4 11446 B17R1.54 CCOCCCNC(=O)c1cccc(c1Br)O 5d71778dcafa8ca0888df3340d71817c [0,2,0,0,0,0|2,0,0]=4 11447 B17R1.54 CCOCCCNC(=O)c1cccc(c1C)Br b561bdedc240cf5a1c6e79e690ca8de0 [0,2,0,0,0,0|2,0,0]=4 11448 B17R1.54 CCOCCCNC(=O)c1cccc(c1C)C 656a0f2398a9fcc1aad65c64befd03e7 [0,2,0,0,0,0|2,0,0]=4 11449 B17R1.54 CCOCCCNC(=O)c1cccc(c1C)Cl 373d54ca04b6e9e127b80b818e6b551f [0,2,0,0,0,0|2,0,0]=4 11450 B17R1.54 CCOCCCNC(=O)c1cccc(c1C)F 444eedf3c7cd3bc1ec98e4b5e958fb70 [0,2,0,0,0,0|2,0,0]=4 11451 B17R1.54 CCOCCCNC(=O)c1cccc(c1C)I 56ed0843cffa8105d4411d5a9dc68f09 [0,2,0,0,0,0|2,0,0]=4 11452 B17R1.54 CCOCCCNC(=O)c1cccc(c1C)O e4170af614d04c593e408241675bb207 [0,2,0,0,0,0|2,0,0]=4 11453 B17R1.54 CCOCCCNC(=O)c1cccc(c1Cl)Br 6f2935bbc1b90d89b841fcf41fc1c68a [0,2,0,0,0,0|2,0,0]=4 11454 B17R1.54 CCOCCCNC(=O)c1cccc(c1Cl)C 14f17cf69577617133bcee39d3b2c4c2 [0,2,0,0,0,0|2,0,0]=4 11455 B17R1.54 CCOCCCNC(=O)c1cccc(c1Cl)Cl 2b629c2ccdd2d1e1b5b3a41f43206f39 [0,2,0,0,0,0|2,0,0]=4 11456 B17R1.54 CCOCCCNC(=O)c1cccc(c1Cl)F 684ad8871338ce3fde74dd1560d733d1 [0,2,0,0,0,0|2,0,0]=4 11457 B17R1.54 CCOCCCNC(=O)c1cccc(c1Cl)I dbf7d4adbec212262598d7b64196b975 [0,2,0,0,0,0|2,0,0]=4 11458 B17R1.54 CCOCCCNC(=O)c1cccc(c1Cl)O 7559b9a249700e9fa277ce8dfaa14688 [0,2,0,0,0,0|2,0,0]=4 11459 B17R1.54 CCOCCCNC(=O)c1cccc(c1F)Br 4d753e3b684404925b2d19fc0e49b310 [0,2,0,0,0,0|2,0,0]=4 11460 B17R1.54 CCOCCCNC(=O)c1cccc(c1F)C 146be2d924bf7af25aa37a6862905ffa [0,2,0,0,0,0|2,0,0]=4 11461 B17R1.54 CCOCCCNC(=O)c1cccc(c1F)Cl 38088eb9e628f49d6859fcab6758bb7c [0,2,0,0,0,0|2,0,0]=4 11462 B17R1.54 CCOCCCNC(=O)c1cccc(c1F)F dcf0590262e1274f1502cb228d655d52 [0,2,0,0,0,0|2,0,0]=4 11463 B17R1.54 CCOCCCNC(=O)c1cccc(c1F)I 8370e63bd7d5c9c1fb2bb7debb284303 [0,2,0,0,0,0|2,0,0]=4 11464 B17R1.54 CCOCCCNC(=O)c1cccc(c1F)O 844c95ebd29d58c0c33376436aad6589 [0,2,0,0,0,0|2,0,0]=4 11465 B17R1.54 CCOCCCNC(=O)c1cccc(c1I)Br 6cef0ae7c60eda8efcb7f260bb873eba [0,2,0,0,0,0|2,0,0]=4 11466 B17R1.54 CCOCCCNC(=O)c1cccc(c1I)C d93bb10002243a640d2a52764379e9ef [0,2,0,0,0,0|2,0,0]=4 11467 B17R1.54 CCOCCCNC(=O)c1cccc(c1I)Cl 6cd9224a7aa7080d5b0e3c91ed34401b [0,2,0,0,0,0|2,0,0]=4 11468 B17R1.54 CCOCCCNC(=O)c1cccc(c1I)F 072fa0db3afff38e7b1e7fdc304e4b7c [0,2,0,0,0,0|2,0,0]=4 11469 B17R1.54 CCOCCCNC(=O)c1cccc(c1I)O b89af79fcd1b2941d185df758f5b2844 [0,2,0,0,0,0|2,0,0]=4 11470 B17R1.54 CCOCCCNC(=O)c1cccc(c1O)Br c08a4be9f751bcd614bb8d189803fb34 [0,2,0,0,0,0|2,0,0]=4 11471 B17R1.54 CCOCCCNC(=O)c1cccc(c1O)C 92892d224eaab9967b4d3d5a90b05e1c [0,2,0,0,0,0|2,0,0]=4 11472 B17R1.54 CCOCCCNC(=O)c1cccc(c1O)Cl 98105f66019924c6eb84e692bec6ed01 [0,2,0,0,0,0|2,0,0]=4 11473 B17R1.54 CCOCCCNC(=O)c1cccc(c1O)F fc54828b625489ff53c26570cf7f7d7d [0,2,0,0,0,0|2,0,0]=4 11474 B17R1.54 CCOCCCNC(=O)c1cccc(c1O)O eedb8f4423a546b813f870a5284b6599 [0,2,0,0,0,0|2,0,0]=4 11475 B17R1.54 COCCCCNC(=O)c1cccc(c1Br)Br 0e7020747dce3bd0a43126964439bea9 [0,2,0,0,0,0|2,0,0]=4 11476 B17R1.54 COCCCCNC(=O)c1cccc(c1Br)C 050c8946256c37517c83e03ac0ed0f20 [0,2,0,0,0,0|2,0,0]=4 11477 B17R1.54 COCCCCNC(=O)c1cccc(c1Br)Cl f4264f00e09c84e67e671f131d1c1fdd [0,2,0,0,0,0|2,0,0]=4 11478 B17R1.54 COCCCCNC(=O)c1cccc(c1Br)F 05784c7022f301ac29598f79b82e8138 [0,2,0,0,0,0|2,0,0]=4 11479 B17R1.54 COCCCCNC(=O)c1cccc(c1Br)I 018d3134fbed449a2108e277f79c49e7 [0,2,0,0,0,0|2,0,0]=4 11480 B17R1.54 COCCCCNC(=O)c1cccc(c1Br)O 6651ee79c27cbed32fbe4b22ed2d1f05 [0,2,0,0,0,0|2,0,0]=4 11481 B17R1.54 COCCCCNC(=O)c1cccc(c1C)Br 72a8cc5c80824596cf3e22b03e57f6c5 [0,2,0,0,0,0|2,0,0]=4 11482 B17R1.54 COCCCCNC(=O)c1cccc(c1C)C 3bd3fc73e14b54b50c3b26d61612751f [0,2,0,0,0,0|2,0,0]=4 11483 B17R1.54 COCCCCNC(=O)c1cccc(c1C)Cl 8f721f66a8176f66e3220e5090aad0dc [0,2,0,0,0,0|2,0,0]=4 11484 B17R1.54 COCCCCNC(=O)c1cccc(c1C)F 04bca67af71ca8b486b0ba29208a3dbf [0,2,0,0,0,0|2,0,0]=4 11485 B17R1.54 COCCCCNC(=O)c1cccc(c1C)I e39682398dd4d2f5d33a01ddf03e5589 [0,2,0,0,0,0|2,0,0]=4 11486 B17R1.54 COCCCCNC(=O)c1cccc(c1C)O 4a73ded4d7f01e418cfe83a9d594ec90 [0,2,0,0,0,0|2,0,0]=4 11487 B17R1.54 COCCCCNC(=O)c1cccc(c1Cl)Br 15571991fbc2b24b8b509506d069acc0 [0,2,0,0,0,0|2,0,0]=4 11488 B17R1.54 COCCCCNC(=O)c1cccc(c1Cl)C 61106c3a85058f19b0b616ae59a2dfa0 [0,2,0,0,0,0|2,0,0]=4 11489 B17R1.54 COCCCCNC(=O)c1cccc(c1Cl)Cl e072efa73e7d5660e937a9c2a9065e37 [0,2,0,0,0,0|2,0,0]=4 11490 B17R1.54 COCCCCNC(=O)c1cccc(c1Cl)F 6decb46fe762c96208df28e9021fbe9f [0,2,0,0,0,0|2,0,0]=4 11491 B17R1.54 COCCCCNC(=O)c1cccc(c1Cl)I 4c4a15bbf44ecdf97578189e7f5c866c [0,2,0,0,0,0|2,0,0]=4 11492 B17R1.54 COCCCCNC(=O)c1cccc(c1Cl)O 2382d964334b956a05f5c5d7efe77be6 [0,2,0,0,0,0|2,0,0]=4 11493 B17R1.54 COCCCCNC(=O)c1cccc(c1F)Br 26f2a495bcda84a0c84db11e8b13201a [0,2,0,0,0,0|2,0,0]=4 11494 B17R1.54 COCCCCNC(=O)c1cccc(c1F)C 9d9b8ae5cb23ddee3227ffa9943575c8 [0,2,0,0,0,0|2,0,0]=4 11495 B17R1.54 COCCCCNC(=O)c1cccc(c1F)Cl de8b4dd4d66450f0d3c5c08f9eff1854 [0,2,0,0,0,0|2,0,0]=4 11496 B17R1.54 COCCCCNC(=O)c1cccc(c1F)F 259ed02654a863f7770f58162f6f2369 [0,2,0,0,0,0|2,0,0]=4 11497 B17R1.54 COCCCCNC(=O)c1cccc(c1F)I fd55d1be435ce77e413c8f19f5e583ef [0,2,0,0,0,0|2,0,0]=4 11498 B17R1.54 COCCCCNC(=O)c1cccc(c1F)O 1fda74abfa931b06ec81851ad4a3cc73 [0,2,0,0,0,0|2,0,0]=4 11499 B17R1.54 COCCCCNC(=O)c1cccc(c1I)Br e514957658253312af55bbb5b98fd4e0 [0,2,0,0,0,0|2,0,0]=4 11500 B17R1.54 COCCCCNC(=O)c1cccc(c1I)C 9c204fa635a537a74f013f3ee62b4172 [0,2,0,0,0,0|2,0,0]=4 11501 B17R1.54 COCCCCNC(=O)c1cccc(c1I)Cl a183fdf42282a10b6ac22166b7f6ef1d [0,2,0,0,0,0|2,0,0]=4 11502 B17R1.54 COCCCCNC(=O)c1cccc(c1I)F b68e9eae5760510adce1d4738aa84af9 [0,2,0,0,0,0|2,0,0]=4 11503 B17R1.54 COCCCCNC(=O)c1cccc(c1I)O e1e75ed856e0b1a19bf6694be2d5c20a [0,2,0,0,0,0|2,0,0]=4 11504 B17R1.54 COCCCCNC(=O)c1cccc(c1O)Br 55dcb257794b86e9738573bf264912a6 [0,2,0,0,0,0|2,0,0]=4 11505 B17R1.54 COCCCCNC(=O)c1cccc(c1O)C e7be9404df394fa0018cb1b848473b6b [0,2,0,0,0,0|2,0,0]=4 11506 B17R1.54 COCCCCNC(=O)c1cccc(c1O)Cl 5f25ed620d7c5a015d7472d9d13a3d02 [0,2,0,0,0,0|2,0,0]=4 11507 B17R1.54 COCCCCNC(=O)c1cccc(c1O)F b0118e39987f2c6f89a2b39fbeb30246 [0,2,0,0,0,0|2,0,0]=4 11508 B17R1.54 COCCCCNC(=O)c1cccc(c1O)O 99740b17da70287dcd5da7181b962b10 [0,2,0,0,0,0|2,0,0]=4 11509 B17R1.54 CSCCCCNC(=O)c1cccc(c1Br)Br 169a9be4999b01064111e53649873d3c [0,2,0,0,0,0|2,0,0]=4 11510 B17R1.54 CSCCCCNC(=O)c1cccc(c1Br)C bcd4902fdfa645338ca7bb87ea02b290 [0,2,0,0,0,0|2,0,0]=4 11511 B17R1.54 CSCCCCNC(=O)c1cccc(c1Br)Cl 019d622620d6b76c7b24e64ce0b854e1 [0,2,0,0,0,0|2,0,0]=4 11512 B17R1.54 CSCCCCNC(=O)c1cccc(c1Br)F d439be05c3e78ebd2b1979fb5997900d [0,2,0,0,0,0|2,0,0]=4 11513 B17R1.54 CSCCCCNC(=O)c1cccc(c1Br)I a407e211978d23381fb63a7313380649 [0,2,0,0,0,0|2,0,0]=4 11514 B17R1.54 CSCCCCNC(=O)c1cccc(c1Br)O ad8a5b8f1279a44304ce2a098fd7505f [0,2,0,0,0,0|2,0,0]=4 11515 B17R1.54 CSCCCCNC(=O)c1cccc(c1C)Br 880e38a125250ad65016ad8e2f11de76 [0,2,0,0,0,0|2,0,0]=4 11516 B17R1.54 CSCCCCNC(=O)c1cccc(c1C)C 62ca4cccf4e616dbb804fea6c7f2dd1e [0,2,0,0,0,0|2,0,0]=4 11517 B17R1.54 CSCCCCNC(=O)c1cccc(c1C)Cl dcf0fa86788d96582a72fa361f15a60f [0,2,0,0,0,0|2,0,0]=4 11518 B17R1.54 CSCCCCNC(=O)c1cccc(c1C)F 5d432b47fb84299e6ee44fa323f17859 [0,2,0,0,0,0|2,0,0]=4 11519 B17R1.54 CSCCCCNC(=O)c1cccc(c1C)I 88c8240e8db97890d594ad247f1d44cb [0,2,0,0,0,0|2,0,0]=4 11520 B17R1.54 CSCCCCNC(=O)c1cccc(c1C)O 04327616d972885c1f65199701eb2db2 [0,2,0,0,0,0|2,0,0]=4 11521 B17R1.54 CSCCCCNC(=O)c1cccc(c1Cl)Br e9730a310cd63c6453d7398c6d0de611 [0,2,0,0,0,0|2,0,0]=4 11522 B17R1.54 CSCCCCNC(=O)c1cccc(c1Cl)C 8eda35acb484dba4c7097dc5508c96f9 [0,2,0,0,0,0|2,0,0]=4 11523 B17R1.54 CSCCCCNC(=O)c1cccc(c1Cl)Cl ab4749ae926d987d441924a7c1af12d8 [0,2,0,0,0,0|2,0,0]=4 11524 B17R1.54 CSCCCCNC(=O)c1cccc(c1Cl)F bffe9a03080f19d416b82dc82b799e9d [0,2,0,0,0,0|2,0,0]=4 11525 B17R1.54 CSCCCCNC(=O)c1cccc(c1Cl)I f6cf84d9d69a744e8926f506a5a69dd5 [0,2,0,0,0,0|2,0,0]=4 11526 B17R1.54 CSCCCCNC(=O)c1cccc(c1Cl)O 694b174533f0822723bc76957fabe2f7 [0,2,0,0,0,0|2,0,0]=4 11527 B17R1.54 CSCCCCNC(=O)c1cccc(c1F)Br 0eab9c99b042ef1f905eb7a455d8e2b9 [0,2,0,0,0,0|2,0,0]=4 11528 B17R1.54 CSCCCCNC(=O)c1cccc(c1F)C b83fde4e248e9ed49291b962f0bd4c43 [0,2,0,0,0,0|2,0,0]=4 11529 B17R1.54 CSCCCCNC(=O)c1cccc(c1F)Cl 27b543f4305d843ac1ccb25543f9082e [0,2,0,0,0,0|2,0,0]=4 11530 B17R1.54 CSCCCCNC(=O)c1cccc(c1F)F a1a6721cb98a7e31e5c0cb8d05cba06f [0,2,0,0,0,0|2,0,0]=4 11531 B17R1.54 CSCCCCNC(=O)c1cccc(c1F)I 0ddb5314158a5cfcf51b1ebf3e48782c [0,2,0,0,0,0|2,0,0]=4 11532 B17R1.54 CSCCCCNC(=O)c1cccc(c1F)O 7dce4599c1fc59f7dc2ccf00eab5e41b [0,2,0,0,0,0|2,0,0]=4 11533 B17R1.54 CSCCCCNC(=O)c1cccc(c1I)Br cae015fa8ea5660faefb1b543ebacff4 [0,2,0,0,0,0|2,0,0]=4 11534 B17R1.54 CSCCCCNC(=O)c1cccc(c1I)C 1a7cb990a1eb3f7b3238f6733bf94170 [0,2,0,0,0,0|2,0,0]=4 11535 B17R1.54 CSCCCCNC(=O)c1cccc(c1I)Cl 35b24a8ba2a0d823b64caf37d8ea5813 [0,2,0,0,0,0|2,0,0]=4 11536 B17R1.54 CSCCCCNC(=O)c1cccc(c1I)F 2f1569207980bf57e6cd60aa87898753 [0,2,0,0,0,0|2,0,0]=4 11537 B17R1.54 CSCCCCNC(=O)c1cccc(c1I)O 62f42c68cad275805327e47c539a5e47 [0,2,0,0,0,0|2,0,0]=4 11538 B17R1.54 CSCCCCNC(=O)c1cccc(c1O)Br 769190b94f05f85c5ab09ff9741d14b8 [0,2,0,0,0,0|2,0,0]=4 11539 B17R1.54 CSCCCCNC(=O)c1cccc(c1O)C 23c4f6175307a957954af0a8b88d1b11 [0,2,0,0,0,0|2,0,0]=4 11540 B17R1.54 CSCCCCNC(=O)c1cccc(c1O)Cl d8ba99016b3b5a7bc2677ed11c3d84c0 [0,2,0,0,0,0|2,0,0]=4 11541 B17R1.54 CSCCCCNC(=O)c1cccc(c1O)F 55f051942c82d6f7323e68010fc1dc2a [0,2,0,0,0,0|2,0,0]=4 11542 B17R1.54 CSCCCCNC(=O)c1cccc(c1O)O f1be13a31076a5dc7488c38c1da96de7 [0,2,0,0,0,0|2,0,0]=4 11543 B17R1.54 Cc1c(cccc1C(=O)NCCCCCCl)Br d74df66635aff6b3b2e5846c032c3bdb [0,2,0,0,0,0|2,0,0]=4 11544 B17R1.54 Cc1c(cccc1C(=O)NCCCCCCl)Cl f3797ca094b295da089b2674bd976167 [0,2,0,0,0,0|2,0,0]=4 11545 B17R1.54 Cc1c(cccc1C(=O)NCCCCCCl)F c5198d95e4c9cce899110ede6ea3d546 [0,2,0,0,0,0|2,0,0]=4 11546 B17R1.54 Cc1c(cccc1C(=O)NCCCCCCl)I 245f8e11f76585bf5134093387d2650e [0,2,0,0,0,0|2,0,0]=4 11547 B17R1.54 Cc1c(cccc1C(=O)NCCCCCCl)O c79452c40b2d18124c31a90e1098ed06 [0,2,0,0,0,0|2,0,0]=4 11548 B17R1.54 Cc1c(cccc1C(=O)NCCCCCO)Br fd219627cf1f1acfa94f9b6b722a960d [0,2,0,0,0,0|2,0,0]=4 11549 B17R1.54 Cc1c(cccc1C(=O)NCCCCCO)Cl 3c79638f7e5905cd48083f880bc935b0 [0,2,0,0,0,0|2,0,0]=4 11550 B17R1.54 Cc1c(cccc1C(=O)NCCCCCO)F d33958e348074a800186cd5518267354 [0,2,0,0,0,0|2,0,0]=4 11551 B17R1.54 Cc1c(cccc1C(=O)NCCCCCO)I fe373fd68e8ced1d2e21f0a7026e83ea [0,2,0,0,0,0|2,0,0]=4 11552 B17R1.54 Cc1c(cccc1C(=O)NCCCCCO)O 438bd93a1be20df4fa0bd32c5af20738 [0,2,0,0,0,0|2,0,0]=4 11553 B17R1.54 Cc1cccc(c1Br)C(=O)NCCCCCCl 6547029d4899a36ad67de4b79c01b2d9 [0,2,0,0,0,0|2,0,0]=4 11554 B17R1.54 Cc1cccc(c1Br)C(=O)NCCCCCO b70e9b2e4090447d5b17ba9107f5e90e [0,2,0,0,0,0|2,0,0]=4 11555 B17R1.54 Cc1cccc(c1C)C(=O)NCCCCCCl 3d3db76377e3c44a5c00abd3f99b4dba [0,2,0,0,0,0|2,0,0]=4 11556 B17R1.54 Cc1cccc(c1C)C(=O)NCCCCCO f645ad88a102e567d28d5af3b7e5ec24 [0,2,0,0,0,0|2,0,0]=4 11557 B17R1.54 Cc1cccc(c1Cl)C(=O)NCCCCCCl adfbc66417b9bb9feea68b5051fb89a7 [0,2,0,0,0,0|2,0,0]=4 11558 B17R1.54 Cc1cccc(c1Cl)C(=O)NCCCCCO 1756a251cd7e60fabddb8077300d24a9 [0,2,0,0,0,0|2,0,0]=4 11559 B17R1.54 Cc1cccc(c1F)C(=O)NCCCCCCl 9bad13f6284f7fa96302fe973f0708c0 [0,2,0,0,0,0|2,0,0]=4 11560 B17R1.54 Cc1cccc(c1F)C(=O)NCCCCCO 458fe54354f691e318c918d6600fa837 [0,2,0,0,0,0|2,0,0]=4 11561 B17R1.54 Cc1cccc(c1I)C(=O)NCCCCCCl a44184e7c4362042589d7723665dd8cc [0,2,0,0,0,0|2,0,0]=4 11562 B17R1.54 Cc1cccc(c1I)C(=O)NCCCCCO 907c5a1b040f4811fa1d8c7d56936bb7 [0,2,0,0,0,0|2,0,0]=4 11563 B17R1.54 Cc1cccc(c1O)C(=O)NCCCCCCl 7161f3d2ba970dbe8844ed0227e85e45 [0,2,0,0,0,0|2,0,0]=4 11564 B17R1.54 Cc1cccc(c1O)C(=O)NCCCCCO ee5a00389bbd80d9474bb3c84e18bb35 [0,2,0,0,0,0|2,0,0]=4 11565 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Br)Br f01339b1c12b8c235e61fc6cb4cd1307 [0,2,0,0,0,0|2,0,0]=4 11566 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Br)Cl d24ef3ec74da0e81e5bdb3e88050d381 [0,2,0,0,0,0|2,0,0]=4 11567 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Br)F 85729f426777ff77edc64bef18b92b04 [0,2,0,0,0,0|2,0,0]=4 11568 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Br)I c556dedd17148b00221911a50a3f36a2 [0,2,0,0,0,0|2,0,0]=4 11569 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Br)O 774d3d6381d3f3457d37f9ae6bbbf3f1 [0,2,0,0,0,0|2,0,0]=4 11570 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Cl)Br bd9b2642b4b8393439598efdc28dfc72 [0,2,0,0,0,0|2,0,0]=4 11571 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Cl)Cl 2bbd1640a5eaf49da6a74aa156102ca0 [0,2,0,0,0,0|2,0,0]=4 11572 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Cl)F adb3df3153758c84ebe0abf98dd1af5a [0,2,0,0,0,0|2,0,0]=4 11573 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Cl)I 62184271353ce6326b432828f4a82875 [0,2,0,0,0,0|2,0,0]=4 11574 B17R1.54 O=C(NCCCCCCl)c1cccc(c1Cl)O 43e8691ccaa2588eae7171ee59eb608f [0,2,0,0,0,0|2,0,0]=4 11575 B17R1.54 O=C(NCCCCCCl)c1cccc(c1F)Br cbacd3c3e779b553eae5274e4c5959aa [0,2,0,0,0,0|2,0,0]=4 11576 B17R1.54 O=C(NCCCCCCl)c1cccc(c1F)Cl 61a5ef42953c99b2e0580a8ded0b9773 [0,2,0,0,0,0|2,0,0]=4 11577 B17R1.54 O=C(NCCCCCCl)c1cccc(c1F)F ca52824b747a08d659f1c143e415512f [0,2,0,0,0,0|2,0,0]=4 11578 B17R1.54 O=C(NCCCCCCl)c1cccc(c1F)I ade277e25ddc0f017e1ca9ebdc2757dd [0,2,0,0,0,0|2,0,0]=4 11579 B17R1.54 O=C(NCCCCCCl)c1cccc(c1F)O 0976f5974bec0d5f252a732ffaf4b228 [0,2,0,0,0,0|2,0,0]=4 11580 B17R1.54 O=C(NCCCCCCl)c1cccc(c1I)Br 3af372d6b40e1a4a0a540f282ce0f19d [0,2,0,0,0,0|2,0,0]=4 11581 B17R1.54 O=C(NCCCCCCl)c1cccc(c1I)Cl 24b558c815d57513bc0cf07fb8a61677 [0,2,0,0,0,0|2,0,0]=4 11582 B17R1.54 O=C(NCCCCCCl)c1cccc(c1I)F 6adab0b6a5be1baeb240f10910294a80 [0,2,0,0,0,0|2,0,0]=4 11583 B17R1.54 O=C(NCCCCCCl)c1cccc(c1I)O 20925df27afe462a30fd5d25339c4d43 [0,2,0,0,0,0|2,0,0]=4 11584 B17R1.54 O=C(NCCCCCCl)c1cccc(c1O)Br 4fbdb6379bde506939445f75de209f9a [0,2,0,0,0,0|2,0,0]=4 11585 B17R1.54 O=C(NCCCCCCl)c1cccc(c1O)Cl 99e22431191bf4ad0483b358d58ef439 [0,2,0,0,0,0|2,0,0]=4 11586 B17R1.54 O=C(NCCCCCCl)c1cccc(c1O)F 33321cffed2d273e9d921c0c5ea9bb83 [0,2,0,0,0,0|2,0,0]=4 11587 B17R1.54 O=C(NCCCCCCl)c1cccc(c1O)O 3b37b450f18d30c53626b66c2d0e2556 [0,2,0,0,0,0|2,0,0]=4 11588 B17R1.54 O=C(NCCCCCO)c1cccc(c1Br)Br 468737e91aec7b4fc35888b4b4c50c6c [0,2,0,0,0,0|2,0,0]=4 11589 B17R1.54 O=C(NCCCCCO)c1cccc(c1Br)Cl c308767a3c8788abfa37849eefd44c31 [0,2,0,0,0,0|2,0,0]=4 11590 B17R1.54 O=C(NCCCCCO)c1cccc(c1Br)F 18c864bbd85ff418c430d8e17ca30554 [0,2,0,0,0,0|2,0,0]=4 11591 B17R1.54 O=C(NCCCCCO)c1cccc(c1Br)I afcf4a683cbce151cfa9a9d52d4e62c0 [0,2,0,0,0,0|2,0,0]=4 11592 B17R1.54 O=C(NCCCCCO)c1cccc(c1Br)O c069bca5f9e683e02b7553060d84ff15 [0,2,0,0,0,0|2,0,0]=4 11593 B17R1.54 O=C(NCCCCCO)c1cccc(c1Cl)Br b77a711e03c8099f845f06e29c13a4de [0,2,0,0,0,0|2,0,0]=4 11594 B17R1.54 O=C(NCCCCCO)c1cccc(c1Cl)Cl f69caf2c26fd78cce564ab5cb1eee4ed [0,2,0,0,0,0|2,0,0]=4 11595 B17R1.54 O=C(NCCCCCO)c1cccc(c1Cl)F fa01ecda244e4edc85815b913448079b [0,2,0,0,0,0|2,0,0]=4 11596 B17R1.54 O=C(NCCCCCO)c1cccc(c1Cl)I c853dff337194d69fbdc303d429f1e88 [0,2,0,0,0,0|2,0,0]=4 11597 B17R1.54 O=C(NCCCCCO)c1cccc(c1Cl)O 4007423734c5e8c07caf25f414acdbb8 [0,2,0,0,0,0|2,0,0]=4 11598 B17R1.54 O=C(NCCCCCO)c1cccc(c1F)Br cb55911f8bc1527aff3c9b9b6d1ddaf8 [0,2,0,0,0,0|2,0,0]=4 11599 B17R1.54 O=C(NCCCCCO)c1cccc(c1F)Cl 54a2faa4058ff8fc8c74886933dabd37 [0,2,0,0,0,0|2,0,0]=4 11600 B17R1.54 O=C(NCCCCCO)c1cccc(c1F)F a0b53ba42a742316710314164f5e1b8f [0,2,0,0,0,0|2,0,0]=4 11601 B17R1.54 O=C(NCCCCCO)c1cccc(c1F)I aa310881a2339f66ad0b9eedb59f6d6d [0,2,0,0,0,0|2,0,0]=4 11602 B17R1.54 O=C(NCCCCCO)c1cccc(c1F)O b3bfec63987137f7aedb7d2668dfc50f [0,2,0,0,0,0|2,0,0]=4 11603 B17R1.54 O=C(NCCCCCO)c1cccc(c1I)Br 41440c012710236a0dfd0ebfcc69c085 [0,2,0,0,0,0|2,0,0]=4 11604 B17R1.54 O=C(NCCCCCO)c1cccc(c1I)Cl b2755ace7e97f365e94a1a51e81ec08f [0,2,0,0,0,0|2,0,0]=4 11605 B17R1.54 O=C(NCCCCCO)c1cccc(c1I)F 8bc5f72c974fec4bbb43681b86a7cf00 [0,2,0,0,0,0|2,0,0]=4 11606 B17R1.54 O=C(NCCCCCO)c1cccc(c1I)O c34de0280027e4d947f6f45074b286ba [0,2,0,0,0,0|2,0,0]=4 11607 B17R1.54 O=C(NCCCCCO)c1cccc(c1O)Br 81857380fb8d08166b29f5875ba144a1 [0,2,0,0,0,0|2,0,0]=4 11608 B17R1.54 O=C(NCCCCCO)c1cccc(c1O)Cl 38f5d9bbc883f911ff343916d99bfaea [0,2,0,0,0,0|2,0,0]=4 11609 B17R1.54 O=C(NCCCCCO)c1cccc(c1O)F 74b60e983ca5c295422d1a3e63111cb2 [0,2,0,0,0,0|2,0,0]=4 11610 B17R1.54 O=C(NCCCCCO)c1cccc(c1O)O ae066abc34bb1d6a344dfc8d7694e0ec [0,2,0,0,0,0|2,0,0]=4 11611 B17R1.711 C#CC(OCCCCCC)c1cccc(c1)Br 221419eae4bb4af807517585149673b1 [0,2,0,0,0,0|1,0,1]=4 11612 B17R1.711 C#CC(OCCCCCC)c1cccc(c1)C 6d20834152cd84fc6461cbe214072328 [0,2,0,0,0,0|1,0,1]=4 11613 B17R1.711 C#CC(OCCCCCC)c1cccc(c1)Cl cff921c30b3394f5a1fbcde8a323e15f [0,2,0,0,0,0|1,0,1]=4 11614 B17R1.711 C#CC(OCCCCCC)c1cccc(c1)F 44f99ae49edc35b19cfb27c51935c576 [0,2,0,0,0,0|1,0,1]=4 11615 B17R1.711 C=CC(OCCCCCC)c1cccc(c1)Cl a611d3b32b5431297f2593957b6653b8 [0,2,0,0,0,0|1,0,1]=4 11616 B17R1.711 C=CC(OCCCCCC)c1cccc(c1)F 9dac580dda572d68775e52763e069202 [0,2,0,0,0,0|1,0,1]=4 11617 B17R1.711 CCCCCCOC(CC)c1cccc(c1)Br 5fbeae89ae0aa4a2ace31ee24c335796 [0,2,0,0,0,0|1,0,1]=4 11618 B17R1.711 CCCCCCOC(CC)c1cccc(c1)Cl 1d2474b5773d2fc1137e52f59298cd68 [0,2,0,0,0,0|1,0,1]=4 11619 B17R1.711 CCCCCCOC(CC)c1cccc(c1)F 46b0087fe81d374d452e922835a0b4b4 [0,2,0,0,0,0|1,0,1]=4 11620 B17R1.711 CCCCCCOC(CC)c1cccc(c1)I 6faf5316fc30eb10046e0a740c989089 [0,2,0,0,0,0|1,0,1]=4 11621 B17R1.749 CCCCC(C)COC(C)c1cccc(c1)Cl c71ef967a4df76a79ddf6add13ca4d1f [0,2,0,0,0,0|1,0,1]=4 11622 B17R1.749 CCCCC(C)COC(C)c1cccc(c1)F 78868b91778bfefd5789f5f59b85a051 [0,2,0,0,0,0|1,0,1]=4 11623 B17R1.749 CCCCC(C)NCC(=O)c1cccc(c1)C 3b7bdba480c1ea1446b2d52a3b3c98c5 [0,2,0,0,0,0|2,0,0]=4 11624 B17R1.749 CCCCC(C)NCC(=O)c1cccc(c1)Cl df1053913762ced851c85dff4ffa5cc1 [0,2,0,0,0,0|2,0,0]=4 11625 B17R1.749 CCCCC(C)NCC(=O)c1cccc(c1)F 96fe8d5090dd2973d1b3801a5d416f19 [0,2,0,0,0,0|2,0,0]=4 11626 B17R1.749 CCCCC(C)NCC(=O)c1cccc(c1)I c7dd9350741ee371c16a611a8201bbbc [0,2,0,0,0,0|2,0,0]=4 11627 B17R1.749 CCCCC(C)OCC(=O)c1cccc(c1)Br f44a396e2841700530da7039b85c178b [0,2,0,0,0,0|2,0,0]=4 11628 B17R1.749 CCCCC(C)OCC(=O)c1cccc(c1)C 72c6a7ac1d2780a11dae4cfda688dfd8 [0,2,0,0,0,0|2,0,0]=4 11629 B17R1.749 CCCCC(C)OCC(=O)c1cccc(c1)Cl f38136609932db3ec532c79e75de6ed6 [0,2,0,0,0,0|2,0,0]=4 11630 B17R1.749 CCCCC(C)OCC(=O)c1cccc(c1)F 35fe3c9524dc717595b8fdd591b0886b [0,2,0,0,0,0|2,0,0]=4 11631 B17R1.749 CCCCC(C)OCC(=O)c1cccc(c1)I e25aa80c6871156a18134dfe4c2f9ae2 [0,2,0,0,0,0|2,0,0]=4 11632 B17R1.749 CCCCC(O)CNC(=O)c1cc(=O)cco1 bdc72457998e3dafb3b8d8e9ff0a6348 [0,2,0,0,0,0|2,0,0]=4 11633 B17R1.749 CCCCC(O)CNC(=O)c1cc(ccn1)Br e1193816715c1fa89aad9a4af53efd0e [0,2,0,0,0,0|2,0,0]=4 11634 B17R1.749 CCCCC(O)CNC(=O)c1cc(ccn1)C 509ca7a757fe5d5bc2c05a842aa4e76e [0,2,0,0,0,0|2,0,0]=4 11635 B17R1.749 CCCCC(O)CNC(=O)c1cc(ccn1)Cl fc63fb76b35e4de54c96356cb12dcd63 [0,2,0,0,0,0|2,0,0]=4 11636 B17R1.749 CCCCC(O)CNC(=O)c1cc(ccn1)F e8c06ab8b280b2b8d250b25026fc3b05 [0,2,0,0,0,0|2,0,0]=4 11637 B17R1.749 CCCCC(O)CNC(=O)c1cc(ccn1)I cd3cd2bbca6506410dd9ea01a0f60fa9 [0,2,0,0,0,0|2,0,0]=4 11638 B17R1.749 CCCCC(O)CNC(=O)c1cc(ccn1)O d94dcaf54d80f12ad94eb36074373f77 [0,2,0,0,0,0|2,0,0]=4 11639 B17R1.749 CCCCC(O)CNC(=O)c1ccc[n+](c1)[O-] 39f59093a65106dd5f695dd02df1040c [0,2,0,0,0,0|2,0,0]=4 11640 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)Br 1bebafae728d74763f296325ccc808a4 [0,2,0,0,0,0|1,0,0]=3 11641 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)C a3657c488da23644277d55264ccabae4 [0,2,0,0,0,0|1,0,0]=3 11642 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)Cl cabd5b381cca93c5cbf00bff92c0a7b9 [0,2,0,0,0,0|1,0,0]=3 11643 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)F baa78cb9368f3ab64864fcba2d05cf38 [0,2,0,0,0,0|1,0,0]=3 11644 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)I 8f9e3eb7fac5f6f0225efdd96bc692ee [0,2,0,0,0,0|1,0,0]=3 11645 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)O 79792744dca4f26c1428d947372dfde9 [0,2,0,0,0,0|1,0,0]=3 11646 B17R1.749 CCCCC(O)CNC(=O)c1cccc(c1)S 30d4242aa546ce9c589893ae186ae6a9 [0,2,0,0,0,0|1,0,0]=3 11647 B17R1.749 CCCCC(O)CNC(=O)c1cccc(n1)Br 848d64545b6cb765acfa81c12d3849df [0,2,0,0,0,0|2,0,0]=4 11648 B17R1.749 CCCCC(O)CNC(=O)c1cccc(n1)C 5428025006b80b41f49289f6709931e4 [0,2,0,0,0,0|2,0,0]=4 11649 B17R1.749 CCCCC(O)CNC(=O)c1cccc(n1)Cl 47f4f2013160c825cc1a1f1ffa02ec69 [0,2,0,0,0,0|2,0,0]=4 11650 B17R1.749 CCCCC(O)CNC(=O)c1cccc(n1)F cef791e07877c3d2b6d80ec235a2a19e [0,2,0,0,0,0|2,0,0]=4 11651 B17R1.749 CCCCC(O)CNC(=O)c1cccc(n1)I df42aac50d98bcd322a11b59a199aab6 [0,2,0,0,0,0|2,0,0]=4 11652 B17R1.749 CCCCC(O)CNC(=O)c1cccc(n1)O 93dac590e7466a74774d9055aee51677 [0,2,0,0,0,0|2,0,0]=4 11653 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)Br 1652c318cd227227f3fe13d3249ce80c [0,2,0,0,0,0|2,0,0]=4 11654 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)C 2e008ba755e29f0cfa19df43feb5bf9f [0,2,0,0,0,0|2,0,0]=4 11655 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)Cl a82ea5bdb5f46404c136a348ee06ebcd [0,2,0,0,0,0|2,0,0]=4 11656 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)F 18c172d65d59c066ef32b4161ab91568 [0,2,0,0,0,0|2,0,0]=4 11657 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)I d3acc486d54b2befa52a27ba2a8de39a [0,2,0,0,0,0|2,0,0]=4 11658 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)O 45d0af7711cf44fb2060e3eec5bd3069 [0,2,0,0,0,0|2,0,0]=4 11659 B17R1.749 CCCCC(O)CNC(=O)c1ccnc(c1)S e958cc53c4309ed925b8fff9d0596e3e [0,2,0,0,0,0|2,0,0]=4 11660 B17R1.749 CCCCC(O)CNC(=O)c1cncc(c1)Br 29b8ce37b745a8b33ae70b5b66c8b5bf [0,2,0,0,0,0|2,0,0]=4 11661 B17R1.749 CCCCC(O)CNC(=O)c1cncc(c1)C 1ff14d4025a9e4ab665c90b73b2016c7 [0,2,0,0,0,0|2,0,0]=4 11662 B17R1.749 CCCCC(O)CNC(=O)c1cncc(c1)Cl 2443da3006760ddb197e611953cf733c [0,2,0,0,0,0|2,0,0]=4 11663 B17R1.749 CCCCC(O)CNC(=O)c1cncc(c1)F f27510f349b4abce47cc5c043d251062 [0,2,0,0,0,0|2,0,0]=4 11664 B17R1.749 CCCCC(O)CNC(=O)c1cncc(c1)I 61d7d4f2b68f5b47bc35f95bfe546697 [0,2,0,0,0,0|2,0,0]=4 11665 B17R1.749 CCCCC(O)CNC(=O)c1cncc(c1)O 18c2cf53fe1c67c5cc15b1042faebbee [0,2,0,0,0,0|2,0,0]=4 11666 B17R1.749 CCCC[C@@H](C)NCC(=O)c1cccc(c1)C 19a8623aac3a29336e73bc88f78a4934 [0,2,0,0,0,0|2,0,0]=4 11667 B17R1.749 CCCC[C@@H](C)NCC(=O)c1cccc(c1)Cl b948f07ede548c5cce95784e310862ec [0,2,0,0,0,0|2,0,0]=4 11668 B17R1.749 CCCC[C@@H](C)NCC(=O)c1cccc(c1)F d8f0f0f6c9deffd389b940fb360d0da1 [0,2,0,0,0,0|2,0,0]=4 11669 B17R1.749 CCCC[C@@H](C)NCC(=O)c1cccc(c1)I fb50bf2107dad151c9cc3600918c6f50 [0,2,0,0,0,0|2,0,0]=4 11670 B17R1.749 CCCC[C@@H](C)OCC(=O)c1cccc(c1)C aa774b70718e75b1c7a3a4336eee8a61 [0,2,0,0,0,0|2,0,0]=4 11671 B17R1.749 CCCC[C@@H](C)OCC(=O)c1cccc(c1)Cl 45419ff39acff3d382572ccaa865543a [0,2,0,0,0,0|2,0,0]=4 11672 B17R1.749 CCCC[C@@H](C)OCC(=O)c1cccc(c1)F e059b69ec7e3515e69bc4a178c9fd746 [0,2,0,0,0,0|2,0,0]=4 11673 B17R1.749 CCCC[C@@H](C)OCC(=O)c1cccc(c1)I c69c32483367cff100e886419f7a3d59 [0,2,0,0,0,0|2,0,0]=4 11674 B17R1.749 CCCC[C@H](C)OCC(=O)c1cccc(c1)C 3e1704701d7aba7bf5ce3e0f9aa92acd [0,2,0,0,0,0|2,0,0]=4 11675 B17R1.749 CCCC[C@H](C)OCC(=O)c1cccc(c1)Cl bca83a4326ee3ff1d80e2c7fb73e295e [0,2,0,0,0,0|2,0,0]=4 11676 B17R1.749 CCCC[C@H](C)OCC(=O)c1cccc(c1)F ada725776e7b3b68032d3c66e82a2af0 [0,2,0,0,0,0|2,0,0]=4 11677 B17R1.749 CCCC[C@H](C)OCC(=O)c1cccc(c1)I ea4a86ca4196201123f44c2f91a574ee [0,2,0,0,0,0|2,0,0]=4 11678 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)Br bb289da474f34a4434be13244906540c [0,2,0,0,0,0|2,0,0]=4 11679 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)C 1b66d97ef3839e2085d9ad26859667da [0,2,0,0,0,0|2,0,0]=4 11680 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)Cl 5f6ee820b3483cabb271d5517ce3e8af [0,2,0,0,0,0|2,0,0]=4 11681 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)F a256de62540b2de2ad915abebeeb6a57 [0,2,0,0,0,0|2,0,0]=4 11682 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)I 911fc40eb4ab7559857370099137c1fc [0,2,0,0,0,0|2,0,0]=4 11683 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)O a2f62f12e3ac0a42eb9822822245585c [0,2,0,0,0,0|2,0,0]=4 11684 B17R1.749 CCOCC(O)CNC(=O)c1cccc(c1)S 8df5c85129d16f57e6fc663d09ccf578 [0,2,0,0,0,0|2,0,0]=4 11685 B17R1.749 C[C@H](CCCO)CNC(=O)c1cccc(c1)Br 1fe8bf5dde7e1c3c4755ea163c2b1e2e [0,2,0,0,0,0|2,0,0]=4 11686 B17R1.749 C[C@H](CCCO)CNC(=O)c1cccc(c1)Cl 147223d7df275cd5051973ca385cabb9 [0,2,0,0,0,0|2,0,0]=4 11687 B17R1.749 C[C@H](CCCO)CNC(=O)c1cccc(c1)F 9ca2c1283ba8579293d540ce0a487291 [0,2,0,0,0,0|2,0,0]=4 11688 B17R1.749 C[C@H](CCCO)CNC(=O)c1cccc(c1)I f8766db5f383cf7af07a8b3dc28f2384 [0,2,0,0,0,0|2,0,0]=4 11689 B17R1.749 C[C@H](CCCO)CNC(=O)c1cccc(c1)O 26448ad5b113a19b71ffd3cdf1e40dfb [0,2,0,0,0,0|2,0,0]=4 11690 B17R1.749 C[C@H](CCCO)CNC(=O)c1cccc(c1)S 53ba5424d87df5b90d0e553799da006d [0,2,0,0,0,0|2,0,0]=4 11691 B17R1.749 Cc1cccc(c1)C(=O)NC[C@H](C)CCCO eac4d872e864124e4d7151eae0e00ee4 [0,2,0,0,0,0|2,0,0]=4 11692 B17R1.752 CCCCCCN(C)C(=O)c1cc(=O)cco1 002c4c48c8c69d70d3506946eebb6338 [0,2,0,0,0,0|2,0,0]=4 11693 B17R1.752 CCCCCCN(C)C(=O)c1cc(ccn1)Br 2f2d22204a4ec7340e1fd7666db44d82 [0,2,0,0,0,0|2,0,0]=4 11694 B17R1.752 CCCCCCN(C)C(=O)c1cc(ccn1)C 42513d6581cee4b18bf7726e9a98d457 [0,2,0,0,0,0|2,0,0]=4 11695 B17R1.752 CCCCCCN(C)C(=O)c1cc(ccn1)Cl 97895adc2f450ad76ce77d0d1a77fcd2 [0,2,0,0,0,0|2,0,0]=4 11696 B17R1.752 CCCCCCN(C)C(=O)c1cc(ccn1)F d2bd8556091e200c586214369d6caf6a [0,2,0,0,0,0|2,0,0]=4 11697 B17R1.752 CCCCCCN(C)C(=O)c1cc(ccn1)I f7fbb7fccccacb1433d9693788eb90c7 [0,2,0,0,0,0|2,0,0]=4 11698 B17R1.752 CCCCCCN(C)C(=O)c1cc(ccn1)O 9f041e47e3d87671936d00ee19cd11e1 [0,2,0,0,0,0|2,0,0]=4 11699 B17R1.752 CCCCCCN(C)C(=O)c1ccc[n+](c1)[O-] 66b03958bb39e22d6487d7795eaa6dd6 [0,2,0,0,0,0|2,0,0]=4 11700 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)Br 0c06cfae2443d263bcf05701de880099 [0,2,0,0,0,0|1,0,0]=3 11701 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)C a700edc0c357224c72ade68285e18974 [0,2,0,0,0,0|1,0,0]=3 11702 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)Cl 91eb8fb681b42d02442cd11f78cd61be [0,2,0,0,0,0|1,0,0]=3 11703 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)F 3f20c168e68161f2a5ec4722005e5ce5 [0,2,0,0,0,0|1,0,0]=3 11704 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)I e19787f07a2bbc695e34d109409e63e0 [0,2,0,0,0,0|1,0,0]=3 11705 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)O ed94db541301646d603cf523c67f3621 [0,2,0,0,0,0|1,0,0]=3 11706 B17R1.752 CCCCCCN(C)C(=O)c1cccc(c1)S 69262487d908dcfc9a2ceab95adfaab4 [0,2,0,0,0,0|1,0,0]=3 11707 B17R1.752 CCCCCCN(C)C(=O)c1cccc(n1)Br 2ebbcb2a7cc897b5011bda15185a8bc3 [0,2,0,0,0,0|2,0,0]=4 11708 B17R1.752 CCCCCCN(C)C(=O)c1cccc(n1)C 73c2feb618d92d95920755d9e3a926bd [0,2,0,0,0,0|2,0,0]=4 11709 B17R1.752 CCCCCCN(C)C(=O)c1cccc(n1)Cl ca19d31d006ca0e78e633edb201be9eb [0,2,0,0,0,0|2,0,0]=4 11710 B17R1.752 CCCCCCN(C)C(=O)c1cccc(n1)F d72b936cd813b80b6a1dd7a46a157dc7 [0,2,0,0,0,0|2,0,0]=4 11711 B17R1.752 CCCCCCN(C)C(=O)c1cccc(n1)I e247c515ed3a296e26cfca8479d146f6 [0,2,0,0,0,0|2,0,0]=4 11712 B17R1.752 CCCCCCN(C)C(=O)c1cccc(n1)O 80dd50a658c7ac875d28d5fcb7c037a0 [0,2,0,0,0,0|2,0,0]=4 11713 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)Br 92a14b101b715e863aecb46b2f0ffb4f [0,2,0,0,0,0|2,0,0]=4 11714 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)C de7f7e816b3ce54a0a2324c5cd3bbefe [0,2,0,0,0,0|2,0,0]=4 11715 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)Cl 4f624e616aa41089624ab826c3c6412a [0,2,0,0,0,0|2,0,0]=4 11716 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)F 4463b62e81f40004d5fb20656190fc0a [0,2,0,0,0,0|2,0,0]=4 11717 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)I f7e43e4f047a558f258ff71482dca3de [0,2,0,0,0,0|2,0,0]=4 11718 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)O 4bc3323c5aefda0f1c0a6fd10483de71 [0,2,0,0,0,0|2,0,0]=4 11719 B17R1.752 CCCCCCN(C)C(=O)c1ccnc(c1)S 35b68f15835358ecebaae9ddc44c4470 [0,2,0,0,0,0|2,0,0]=4 11720 B17R1.752 CCCCCCN(C)C(=O)c1cncc(c1)Br 7c19e1b7bf899ca800a5ce718e8bfd03 [0,2,0,0,0,0|2,0,0]=4 11721 B17R1.752 CCCCCCN(C)C(=O)c1cncc(c1)C 56920ff141464f96bf8e7cfa625d2021 [0,2,0,0,0,0|2,0,0]=4 11722 B17R1.752 CCCCCCN(C)C(=O)c1cncc(c1)Cl 04b44287cd4dcbcd33c15ec084f6d68f [0,2,0,0,0,0|2,0,0]=4 11723 B17R1.752 CCCCCCN(C)C(=O)c1cncc(c1)F 7d6e2339c976237a87717730b07184ac [0,2,0,0,0,0|2,0,0]=4 11724 B17R1.752 CCCCCCN(C)C(=O)c1cncc(c1)I 4265df3aeba2bb385252d126498570c5 [0,2,0,0,0,0|2,0,0]=4 11725 B17R1.752 CCCCCCN(C)C(=O)c1cncc(c1)O 0f7f67b63e95841fa2f109292d038bbf [0,2,0,0,0,0|2,0,0]=4 11726 B17R1.752 CCCCCNC(=O)C(=O)c1cccc(c1)Br 214d4a3c00fb187286ccd422b2d17df8 [0,2,0,0,0,0|2,0,0]=4 11727 B17R1.752 CCCCCNC(=O)C(=O)c1cccc(c1)C e49d3a048961094f03f271dfa0fec60b [0,2,0,0,0,0|2,0,0]=4 11728 B17R1.752 CCCCCNC(=O)C(=O)c1cccc(c1)Cl 6b047672626e5ac0fc6819043fc581a4 [0,2,0,0,0,0|2,0,0]=4 11729 B17R1.752 CCCCCNC(=O)C(=O)c1cccc(c1)F b1715460d405fc34646b6d27fc74f9e5 [0,2,0,0,0,0|2,0,0]=4 11730 B17R1.752 CCCCCNC(=O)C(=O)c1cccc(c1)I 806fac005eb799a33f8980951058ac20 [0,2,0,0,0,0|2,0,0]=4 11731 B17R1.752 CCCCCNC(C)C(=O)c1cccc(c1)C 65c04e6b1c20e5c4ca6cef29c991fdea [0,2,0,0,0,0|2,0,0]=4 11732 B17R1.752 CCCCCNC(C)C(=O)c1cccc(c1)Cl 0718e2a0bc852144d2e43383c74a2a06 [0,2,0,0,0,0|2,0,0]=4 11733 B17R1.752 CCCCCNC(C)C(=O)c1cccc(c1)F 5b70cbbfb8281243d02f9b36bccb4125 [0,2,0,0,0,0|2,0,0]=4 11734 B17R1.752 CCCCCOC(C)C(=O)c1cccc(c1)Cl af73bc6163adcfd4cea17ef3d3fd1b83 [0,2,0,0,0,0|2,0,0]=4 11735 B17R1.752 CN(CCCCCO)C(=O)c1cccc(c1)Br 8c90a70b669fdef6c4e9212bdd795c45 [0,2,0,0,0,0|2,0,0]=4 11736 B17R1.752 CN(CCCCCO)C(=O)c1cccc(c1)Cl eac9fb327d0c0bfbe87021675dd20d39 [0,2,0,0,0,0|2,0,0]=4 11737 B17R1.752 CN(CCCCCO)C(=O)c1cccc(c1)F c4b4af2e868f424a8288dd838a3e9c5a [0,2,0,0,0,0|2,0,0]=4 11738 B17R1.752 CN(CCCCCO)C(=O)c1cccc(c1)I 2b6bf974862b8acf7b96d34312555b81 [0,2,0,0,0,0|2,0,0]=4 11739 B17R1.752 CN(CCCCCO)C(=O)c1cccc(c1)O 78925f03cff7ce5258c2fbba78ae73db [0,2,0,0,0,0|2,0,0]=4 11740 B17R1.752 CN(CCCCCO)C(=O)c1cccc(c1)S 2e845630e9096c1c8c3c674fd54c2e55 [0,2,0,0,0,0|2,0,0]=4 11741 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)Br 8c9a8020f370a0e9ae31779b9ef34a60 [0,2,0,0,0,0|2,0,0]=4 11742 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)C 4b60280c7d3a9d38dbc3c5d2bacb7a59 [0,2,0,0,0,0|2,0,0]=4 11743 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)Cl df1b219e4333d572c43ec1bcca668a72 [0,2,0,0,0,0|2,0,0]=4 11744 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)F 25c3073cebb43c75a5eb4c6c1fbd4e9f [0,2,0,0,0,0|2,0,0]=4 11745 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)I 2d5af7a8358d7c086600fa0498b988e7 [0,2,0,0,0,0|2,0,0]=4 11746 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)O c67ea670f247346f0915a0eac55246ac [0,2,0,0,0,0|2,0,0]=4 11747 B17R1.752 COCCCCN(C)C(=O)c1cccc(c1)S dcad1f6bff779398ad764af8c30df94d [0,2,0,0,0,0|2,0,0]=4 11748 B17R1.752 Cc1cccc(c1)C(=O)N(C)CCCCCO 07c44fecdcd6e53b660448921f418a73 [0,2,0,0,0,0|2,0,0]=4 11749 B17R1.969 CCCC(C)CCOC(C)c1cccc(c1)Cl 1810887fd92de9295f94f28314f0f3c3 [0,2,0,0,0,0|1,0,1]=4 11750 B17R1.969 CCCC(C)CCOC(C)c1cccc(c1)F 757d52880f9870dee2844dfbd820fc62 [0,2,0,0,0,0|1,0,1]=4 11751 B17R1.969 CCCC(C)COCC(=O)c1cccc(c1)Br cfa49d69ddb55ab6344597daa1fcc0ad [0,2,0,0,0,0|2,0,0]=4 11752 B17R1.969 CCCC(C)COCC(=O)c1cccc(c1)C 9ee14e1e3f5533f045d29d1d161dff2e [0,2,0,0,0,0|2,0,0]=4 11753 B17R1.969 CCCC(C)COCC(=O)c1cccc(c1)Cl 072207514095202c741dca350acaf52c [0,2,0,0,0,0|2,0,0]=4 11754 B17R1.969 CCCC(C)COCC(=O)c1cccc(c1)F 01d61394dca6a0b5e6150b1be6801247 [0,2,0,0,0,0|2,0,0]=4 11755 B17R1.969 CCCC(C)COCC(=O)c1cccc(c1)I ce54fcd1c3b4afc9c7ccd9914448dac6 [0,2,0,0,0,0|2,0,0]=4 11756 B17R1.969 CCCC(C)OCNC(=O)c1cccc(c1)C 29159200dd849caad19a39ccae3a99fb [0,2,0,0,0,0|2,0,0]=4 11757 B17R1.969 CCCC(O)CNCC(=O)c1cccc(c1)Br 746c4d59dc027c3bfced31a11c2f127b [0,2,0,0,0,0|2,0,0]=4 11758 B17R1.969 CCCC(O)CNCC(=O)c1cccc(c1)C b5df987de3785c97d0f9fc8cefe8ffed [0,2,0,0,0,0|2,0,0]=4 11759 B17R1.969 CCCC(O)CNCC(=O)c1cccc(c1)Cl 980ebb3e341a9547e7dea4eab2948486 [0,2,0,0,0,0|2,0,0]=4 11760 B17R1.969 CCCC(O)CNCC(=O)c1cccc(c1)F 135ddecca26162234cca76827e52913d [0,2,0,0,0,0|2,0,0]=4 11761 B17R1.969 CCCC(O)CNCC(=O)c1cccc(c1)I e67b44c1a07ba72d5fe4a9df3c6d7770 [0,2,0,0,0,0|2,0,0]=4 11762 B17R1.969 CCCC(S)CCOC(C)c1cccc(c1)Br 89f393fc79c16e77ecd2e7b87c8924c2 [0,2,0,0,0,0|1,0,1]=4 11763 B17R1.969 CCCC(S)CCOC(C)c1cccc(c1)Cl 6158c0581b472305d956edc91c3e5dec [0,2,0,0,0,0|1,0,1]=4 11764 B17R1.969 CCCC(S)CCOC(C)c1cccc(c1)F 4969a80107b18de758bd836e225f22c7 [0,2,0,0,0,0|1,0,1]=4 11765 B17R1.969 CCCN(C)CCCC(=O)c1cccc(c1)C 06cf4cbd98a9e7a9fef273b7978e8206 [0,2,0,0,0,0|2,0,0]=4 11766 B17R1.969 CCCN(C)CCCC(=O)c1cccc(c1)F b8e665d3a1b7d0c2e77d613f932bc69e [0,2,0,0,0,0|2,0,0]=4 11767 B17R1.1186 CC(CO)CCCNC(=O)c1cccc(c1)Br 98663b5923815e8c64fbae3ab32ee2dd [0,2,0,0,0,0|2,0,0]=4 11768 B17R1.1186 CC(CO)CCCNC(=O)c1cccc(c1)Cl 254e231439c46db60d1ee4fd27f50880 [0,2,0,0,0,0|2,0,0]=4 11769 B17R1.1186 CC(CO)CCCNC(=O)c1cccc(c1)F a80e18b2c4fd4dbd65a35bc3180b07c9 [0,2,0,0,0,0|2,0,0]=4 11770 B17R1.1186 CC(CO)CCCNC(=O)c1cccc(c1)I d9b1e5f7237671a71e42254ec3ab8335 [0,2,0,0,0,0|2,0,0]=4 11771 B17R1.1186 CC(CO)CCCNC(=O)c1cccc(c1)O 41df7673d62fe66b97919d6e1a266bfe [0,2,0,0,0,0|2,0,0]=4 11772 B17R1.1186 CC(CO)CCCNC(=O)c1cccc(c1)S 71ff86ae62c378f311ca59b69cc28924 [0,2,0,0,0,0|2,0,0]=4 11773 B17R1.1186 CCC(C)CCCOC(C)c1cccc(c1)Cl 32303bd34dc9c393b869693520582a92 [0,2,0,0,0,0|1,0,1]=4 11774 B17R1.1186 CCC(C)CCCOC(C)c1cccc(c1)F fa605f73efd253e357049d8bd89551f9 [0,2,0,0,0,0|1,0,1]=4 11775 B17R1.1186 CCC(C)CCNCC(=O)c1cccc(c1)Br 07913b27737c13e5d342577278397252 [0,2,0,0,0,0|2,0,0]=4 11776 B17R1.1186 CCC(C)CCNCC(=O)c1cccc(c1)C 39dc9d18374037cb8460152cb085fe6e [0,2,0,0,0,0|2,0,0]=4 11777 B17R1.1186 CCC(C)CCNCC(=O)c1cccc(c1)Cl 89403efe8d05429281e269e81d1ad2c9 [0,2,0,0,0,0|2,0,0]=4 11778 B17R1.1186 CCC(C)CCNCC(=O)c1cccc(c1)F 58b0017578b2317b3c898cf6ea4c3f5f [0,2,0,0,0,0|2,0,0]=4 11779 B17R1.1186 CCC(C)CCNCC(=O)c1cccc(c1)I ffc82b364ea9d9658f15c38632cc917f [0,2,0,0,0,0|2,0,0]=4 11780 B17R1.1186 CCC(C)CCOCC(=O)c1cccc(c1)Br 346ef677d3bae5d70331ca4ee8d18475 [0,2,0,0,0,0|2,0,0]=4 11781 B17R1.1186 CCC(C)CCOCC(=O)c1cccc(c1)C 1f128b4c7fe274d3e74fa8edd10b8dae [0,2,0,0,0,0|2,0,0]=4 11782 B17R1.1186 CCC(C)CCOCC(=O)c1cccc(c1)Cl 673f3251fca8842b353096ad25a7943e [0,2,0,0,0,0|2,0,0]=4 11783 B17R1.1186 CCC(C)CCOCC(=O)c1cccc(c1)F 1383c11a69b80c39aab9231d7a3b37ef [0,2,0,0,0,0|2,0,0]=4 11784 B17R1.1186 CCC(C)CCOCC(=O)c1cccc(c1)I 209d044319e420437ba22c7d7097fe9c [0,2,0,0,0,0|2,0,0]=4 11785 B17R1.1186 CCC(C)COCNC(=O)c1cccc(c1)C c2c44ce4103c0a235dce9d901b8e3333 [0,2,0,0,0,0|2,0,0]=4 11786 B17R1.1186 CCC(C)NCCCC(=O)c1cccc(c1)C f45642a865e2449ef7265e7b246e95fa [0,2,0,0,0,0|2,0,0]=4 11787 B17R1.1186 CCC(C)NCCCC(=O)c1cccc(c1)F 8953dfc1bcba413e68b700d57b85b526 [0,2,0,0,0,0|2,0,0]=4 11788 B17R1.1186 CCC(C)OCCCC(=O)c1cccc(c1)F 5531c337faf968dc5165f5192008c837 [0,2,0,0,0,0|2,0,0]=4 11789 B17R1.1186 CCC(C)OCCNC(=O)c1cccc(c1)Br e815acaf5e597100de6aab1e5b9c91f4 [0,2,0,0,0,0|2,0,0]=4 11790 B17R1.1186 CCC(C)OCCNC(=O)c1cccc(c1)C 1d25bbf80aea0bc5cc285e2616423fed [0,2,0,0,0,0|2,0,0]=4 11791 B17R1.1186 CCC(C)OCCNC(=O)c1cccc(c1)Cl b47b31b402bae32820243d6c3c7dfa64 [0,2,0,0,0,0|2,0,0]=4 11792 B17R1.1186 CCC(S)CCOCC(=O)c1cccc(c1)Br 6313d9c4ffc13628c7f83c29c0abedbc [0,2,0,0,0,0|2,0,0]=4 11793 B17R1.1186 CCC(S)CCOCC(=O)c1cccc(c1)C 40452d2561df31b5fdcbe288c69c4e39 [0,2,0,0,0,0|2,0,0]=4 11794 B17R1.1186 CCC(S)CCOCC(=O)c1cccc(c1)Cl e6de4e752c84fd5a01b5156923897d18 [0,2,0,0,0,0|2,0,0]=4 11795 B17R1.1186 CCC(S)CCOCC(=O)c1cccc(c1)F c5e26cb34f07fef619f670895578d1d9 [0,2,0,0,0,0|2,0,0]=4 11796 B17R1.1186 CCC(S)CCOCC(=O)c1cccc(c1)I d8d3159c823d635c9cacdc9d201648f6 [0,2,0,0,0,0|2,0,0]=4 11797 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)Br 21372fc50f1323db5524b7447ddd876f [0,2,0,0,0,0|2,0,0]=4 11798 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)C 7e36b4c740b152f752bc8073889bbc61 [0,2,0,0,0,0|2,0,0]=4 11799 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)Cl 03178ba2d71efb9d81d37c78927b3ce8 [0,2,0,0,0,0|2,0,0]=4 11800 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)F e5b1bbd946f585697596fd91105153e1 [0,2,0,0,0,0|2,0,0]=4 11801 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)I b2952bb96259dc8503a9986d31b99877 [0,2,0,0,0,0|2,0,0]=4 11802 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)O aef09835505b615070b682f0874b152b [0,2,0,0,0,0|2,0,0]=4 11803 B17R1.1186 CCN(C)CCCNC(=O)c1cccc(c1)S bc72d01b46e29aa2764513173022512f [0,2,0,0,0,0|2,0,0]=4 11804 B17R1.1186 CC[C@@H](C)COCNC(=O)c1cccc(c1)C c30a351f38648ef985fdf2acdc9dea41 [0,2,0,0,0,0|2,0,0]=4 11805 B17R1.1186 CC[C@@H](C)NCCCC(=O)c1cccc(c1)C 669a89db347e57e3e229c8ebd7f7beea [0,2,0,0,0,0|2,0,0]=4 11806 B17R1.1186 CC[C@@H](C)NCCCC(=O)c1cccc(c1)F 984f099c425e77d1c3f61a344286f59a [0,2,0,0,0,0|2,0,0]=4 11807 B17R1.1186 CC[C@@H](C)OCCCC(=O)c1cccc(c1)F cd3c44a132a124c4c87c641bb5a6a669 [0,2,0,0,0,0|2,0,0]=4 11808 B17R1.1186 CC[C@H](C)CCCOC(C)c1cccc(c1)Cl e5053c4e7a5225742c874ec5847ec2f0 [0,2,0,0,0,0|1,0,1]=4 11809 B17R1.1186 CC[C@H](C)CCCOC(C)c1cccc(c1)F 287f6f0024623956df2814fb331df156 [0,2,0,0,0,0|1,0,1]=4 11810 B17R1.1186 CC[C@H](C)CCOCC(=O)c1cccc(c1)Br 8c9fa5d0d1db70f2bffaf7edd706ddcc [0,2,0,0,0,0|2,0,0]=4 11811 B17R1.1186 CC[C@H](C)CCOCC(=O)c1cccc(c1)C 6101eb634a5e29b13f9c676b887539ba [0,2,0,0,0,0|2,0,0]=4 11812 B17R1.1186 CC[C@H](C)CCOCC(=O)c1cccc(c1)Cl 2afb58b68d592972036c0b824bd8b64f [0,2,0,0,0,0|2,0,0]=4 11813 B17R1.1186 CC[C@H](C)CCOCC(=O)c1cccc(c1)F 76abd162dba00f445b86904dee042516 [0,2,0,0,0,0|2,0,0]=4 11814 B17R1.1186 CC[C@H](C)CCOCC(=O)c1cccc(c1)I de19c328645253e0932faef20d071091 [0,2,0,0,0,0|2,0,0]=4 11815 B17R1.1186 CC[C@H](C)COCNC(=O)c1cccc(c1)C d0ff438d253d323d25f486b09a4afea4 [0,2,0,0,0,0|2,0,0]=4 11816 B17R1.1186 CC[C@H](C)NCCCC(=O)c1cccc(c1)C 1932876ca9000d593c739692e03fa853 [0,2,0,0,0,0|2,0,0]=4 11817 B17R1.1186 CC[C@H](C)NCCCC(=O)c1cccc(c1)F e20e6d945a0b7976fef292e6bfbb741d [0,2,0,0,0,0|2,0,0]=4 11818 B17R1.1186 CC[C@H](C)OCCCC(=O)c1cccc(c1)F 0f7c1b40e9c7e3fc7966f3f410e0c22c [0,2,0,0,0,0|2,0,0]=4 11819 B17R1.1186 Cc1cccc(c1)C(=O)NCCCC(C)CO 66930cb2e9d04771097e0605c85b9d7c [0,2,0,0,0,0|2,0,0]=4 11820 B17R1.1247 CCCCCCOC(C)(C)c1cccc(c1)Br c1f86d529b4471f9e5d58584b8bb01c1 [0,2,0,0,0,0|1,0,1]=4 11821 B17R1.1247 CCCCCCOC(C)(C)c1cccc(c1)C e45211546a8ea86d8cef447b7ef9efb3 [0,2,0,0,0,0|1,0,1]=4 11822 B17R1.1247 CCCCCCOC(C)(C)c1cccc(c1)Cl 2cc9c08ff01f10b3d113908035896355 [0,2,0,0,0,0|1,0,1]=4 11823 B17R1.1247 CCCCCCOC(C)(C)c1cccc(c1)F c2c564ec61b1bb4a90709af8cc72cf03 [0,2,0,0,0,0|1,0,1]=4 11824 B17R1.1247 CCCCCCOC(C)(C)c1cccc(c1)I 5d82196fd06a1e83aca26e6b7841aca0 [0,2,0,0,0,0|1,0,1]=4 11825 B17R1.9248 CCCCCCNC(=O)c1cc(=O)ccn1C d505f3271f03988f3aa3f90fb473d85d [0,2,0,0,0,0|2,0,0]=4 11826 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Br)Br fff041fc9e7f8d857db3deff79e9aa83 [0,2,0,0,0,0|1,0,0]=3 11827 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Br)C 3bb0e9303f0f3a2bfcccbe4146e82b8d [0,2,0,0,0,0|1,0,0]=3 11828 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Br)Cl 84e406c321a62be6a8199f251feadabe [0,2,0,0,0,0|1,0,0]=3 11829 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Br)F 84a9eed3805c2367bdc3b3e6117a2aa8 [0,2,0,0,0,0|1,0,0]=3 11830 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Br)I 9b0006ad8556b88320c2da2ca676ab9b [0,2,0,0,0,0|1,0,0]=3 11831 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Br)O 152ba9d9d4d79645e3963ad081697b02 [0,2,0,0,0,0|1,0,0]=3 11832 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)Br 44d5e2db8b54145eafaf4e4436740495 [0,2,0,0,0,0|1,0,0]=3 11833 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)C 25cc33eb9bad759f7ff116136bcb362f [0,2,0,0,0,0|1,0,0]=3 11834 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)Cl 3f8b18aea77bc8bcb977cc178ba3b5e2 [0,2,0,0,0,0|1,0,0]=3 11835 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)F 1d6da6c88f0d33bcd86798425987515f [0,2,0,0,0,0|1,0,0]=3 11836 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)I 05ff27a7c36f7bd287b87fbf24ce1fca [0,2,0,0,0,0|1,0,0]=3 11837 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)O 1df43b786a54aab1d018e4a0e0464c03 [0,2,0,0,0,0|1,0,0]=3 11838 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1C)S 1d189587417478217a2334f0bf7c2a9f [0,2,0,0,0,0|1,0,0]=3 11839 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Cl)Br 78e27ff85571d931c81bf955d1e97673 [0,2,0,0,0,0|1,0,0]=3 11840 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Cl)C 3b67e4ddec5c21795674734de77a1d6a [0,2,0,0,0,0|1,0,0]=3 11841 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Cl)Cl 43a75545a2441ff24fb7120d7b4e777a [0,2,0,0,0,0|1,0,0]=3 11842 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Cl)F 657fedb4b661407d91653f21d89977b7 [0,2,0,0,0,0|1,0,0]=3 11843 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Cl)I cc13ec79fd0b6fcbdbefe0d0e86129f2 [0,2,0,0,0,0|1,0,0]=3 11844 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1Cl)O de8acb0b807c22e2f28a8efa3876bd9f [0,2,0,0,0,0|1,0,0]=3 11845 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1F)Br d0be629b4803bb4800343a6f0eae5949 [0,2,0,0,0,0|1,0,0]=3 11846 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1F)C ac48c625c62cc4fd5fff1d3a3ffc989e [0,2,0,0,0,0|1,0,0]=3 11847 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1F)Cl 77e13baffff0c127e16efb10a5b59d65 [0,2,0,0,0,0|1,0,0]=3 11848 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1F)F 85b8250750836d4532cf8f9cfbe4d220 [0,2,0,0,0,0|1,0,0]=3 11849 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1F)I b0e7ab1abe3b52af116096c9ddc0eb9b [0,2,0,0,0,0|1,0,0]=3 11850 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1F)O e64c4b3bb6eba0a216fbe19c94ab7dc7 [0,2,0,0,0,0|1,0,0]=3 11851 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1I)Br d836f81aa8ce7e00f429e991a4e357dc [0,2,0,0,0,0|1,0,0]=3 11852 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1I)C fdf1f3a9f2ed0a687060946254928a1e [0,2,0,0,0,0|1,0,0]=3 11853 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1I)Cl 21a91c9080d96ffe737c3c738d073233 [0,2,0,0,0,0|1,0,0]=3 11854 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1I)F bf6f1f9044917fdf17e97c3e58d95556 [0,2,0,0,0,0|1,0,0]=3 11855 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1I)I 694845e15d6d67c06e7f5efa254fb240 [0,2,0,0,0,0|1,0,0]=3 11856 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1I)O 02b11acca4df1a8814e9ecf57d05288a [0,2,0,0,0,0|1,0,0]=3 11857 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1O)Br 6c1fae1f14ccaa7d5069dc948af63214 [0,2,0,0,0,0|1,0,0]=3 11858 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1O)C a126a1a722ba731e11044b70337dfd0b [0,2,0,0,0,0|1,0,0]=3 11859 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1O)Cl 1a5def1c8c2c211b75fb2a2680742010 [0,2,0,0,0,0|1,0,0]=3 11860 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1O)I 97b18d2e92f2bd680e63c48848c9837c [0,2,0,0,0,0|1,0,0]=3 11861 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1O)O ee7d299ddc60ff95575f01702ec03c06 [0,2,0,0,0,0|1,0,0]=3 11862 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1S)Br 320179b90ac480b8887d772ced908268 [0,2,0,0,0,0|1,0,0]=3 11863 B17R1.9248 CCCCCCNC(=O)c1cc(ccc1S)F 8f0ef640cacdbbb7f4204cfecfa14b6d [0,2,0,0,0,0|1,0,0]=3 11864 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Br)Br 5b5ac36fb3ccd7c37b471700570cf415 [0,2,0,0,0,0|2,0,0]=4 11865 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Br)C 64b191dadc0b9563594f7903fc5fbe28 [0,2,0,0,0,0|2,0,0]=4 11866 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Br)Cl f66e32ecfa7ed566226bfb6bfa5a3347 [0,2,0,0,0,0|2,0,0]=4 11867 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Br)F c011166f5a022474d752e54e0a172544 [0,2,0,0,0,0|2,0,0]=4 11868 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Br)I bb40c0a2d9e7032ef32ffe6dd625b5d0 [0,2,0,0,0,0|2,0,0]=4 11869 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1C)Br 5afaeebae0a0ffc4355ea9483f0d8ccd [0,2,0,0,0,0|2,0,0]=4 11870 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1C)Cl d4da95144fd3b815919ba0c4b9f6942d [0,2,0,0,0,0|2,0,0]=4 11871 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1C)F c752b4c5d8b06ac7e8ad395a4792efff [0,2,0,0,0,0|2,0,0]=4 11872 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1C)I c42b4fbe30af39e575c1e44e2a5b4f7e [0,2,0,0,0,0|2,0,0]=4 11873 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1C)O fdab9074f9b158edc812fc7d0aee4378 [0,2,0,0,0,0|2,0,0]=4 11874 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Cl)Br a9fb4d290e9a1762bd1d42046e1c25c0 [0,2,0,0,0,0|2,0,0]=4 11875 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Cl)C b1617ef462ef5b38ac78352c2a6b6b97 [0,2,0,0,0,0|2,0,0]=4 11876 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Cl)Cl 7f8f2043d7d11177bb070837d67b20ac [0,2,0,0,0,0|2,0,0]=4 11877 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Cl)F 27dc828db3b60add1139610f989e9815 [0,2,0,0,0,0|2,0,0]=4 11878 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Cl)I 1362d18a8961b5edc9f7c0b522985ebe [0,2,0,0,0,0|2,0,0]=4 11879 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1Cl)O 3153298f9e90b20c1abe57312426b32c [0,2,0,0,0,0|2,0,0]=4 11880 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1F)Br 3b48d6b65bd2bb2a66f88d8371f90c8e [0,2,0,0,0,0|2,0,0]=4 11881 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1F)C abd9155661f8c88c38e436d080b21fae [0,2,0,0,0,0|2,0,0]=4 11882 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1F)Cl 462bdd364e8851d04e0a662801af6beb [0,2,0,0,0,0|2,0,0]=4 11883 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1F)F 533f8a633646d0b96657c7ae6c2edcda [0,2,0,0,0,0|2,0,0]=4 11884 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1F)I 9b2407fe9df6066721af7f4f92634439 [0,2,0,0,0,0|2,0,0]=4 11885 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1O)C 8ba5995c48b1b3f4c56d9e5325aa8f8d [0,2,0,0,0,0|2,0,0]=4 11886 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1O)Cl a5e6a2a2f4f9aea0a82f2c68d1fda29c [0,2,0,0,0,0|2,0,0]=4 11887 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1O)F 44a9f51e5e38e8eec7f915c0645fea11 [0,2,0,0,0,0|2,0,0]=4 11888 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1O)I 6b451b391b1c96474d804bcdf91ca4e8 [0,2,0,0,0,0|2,0,0]=4 11889 B17R1.9248 CCCCCCNC(=O)c1cc(cnc1S)Br a6c4a53cca64be27fed060139e8b0a0a [0,2,0,0,0,0|2,0,0]=4 11890 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Br)Br b96cc419b46bedda9bde9ad2e57f906e [0,2,0,0,0,0|2,0,0]=4 11891 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Br)C 7d0e12d5c671e5e5ba48ab4034a27d0b [0,2,0,0,0,0|2,0,0]=4 11892 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Br)Cl 39e86ab7d2c31e0acc4ced3254d42780 [0,2,0,0,0,0|2,0,0]=4 11893 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Br)F d499c07db645898bddab9bc11e3dba0e [0,2,0,0,0,0|2,0,0]=4 11894 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Br)I 6938cc56432ed6fbc0627b17e43afb04 [0,2,0,0,0,0|2,0,0]=4 11895 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Br)O 7c45bf8462c296c4abef725ed3853911 [0,2,0,0,0,0|2,0,0]=4 11896 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1C)Br 5e8eb46212fc109dbdd437d9dc147924 [0,2,0,0,0,0|2,0,0]=4 11897 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1C)C 5208fccc91798262df4e53d05e95349d [0,2,0,0,0,0|2,0,0]=4 11898 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1C)Cl 83f81a30461da9827fe5f590ce7cbddc [0,2,0,0,0,0|2,0,0]=4 11899 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1C)F 891e29b111db4d62bfca518c17a6e5f3 [0,2,0,0,0,0|2,0,0]=4 11900 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Cl)Br feed4d9d0535147b701fe8501a07be6a [0,2,0,0,0,0|2,0,0]=4 11901 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Cl)C ac5c62bb1d9210552090a0ed4d6624cc [0,2,0,0,0,0|2,0,0]=4 11902 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Cl)Cl 7b1f5ac64b8e89e756a83bb308d55afa [0,2,0,0,0,0|2,0,0]=4 11903 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1Cl)F 4acd86bbbdc95bf3ea164329415d8588 [0,2,0,0,0,0|2,0,0]=4 11904 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1F)Br 371078a851bd8e1df7ebb2b068c430d4 [0,2,0,0,0,0|2,0,0]=4 11905 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1F)C 4fd5481b8dcc583b2fa6813e9d8a21d7 [0,2,0,0,0,0|2,0,0]=4 11906 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1F)Cl 25a89ff47f1da5809b9cee912a98a403 [0,2,0,0,0,0|2,0,0]=4 11907 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1F)F 659ff2b5fd782d87315eedaf4bfdef14 [0,2,0,0,0,0|2,0,0]=4 11908 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1O)Br 192f5b430678c43bfb143cb41e01851c [0,2,0,0,0,0|2,0,0]=4 11909 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1O)C 0b2979baba29565bdb415f66fb8aa320 [0,2,0,0,0,0|2,0,0]=4 11910 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1O)Cl 055c5b996c1aa4659d9548d3105d2893 [0,2,0,0,0,0|2,0,0]=4 11911 B17R1.9248 CCCCCCNC(=O)c1cc(ncc1O)F cff2fc21a4d51547802e44302e12c791 [0,2,0,0,0,0|2,0,0]=4 11912 B17R1.9248 CCCCCCNC(=O)c1cn(ccc1=O)C 4b56dcd7e90db053a3e77658b0125cf8 [0,2,0,0,0,0|2,0,0]=4 11913 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Br)Br 04cdab201750292f663213f1ec225c95 [0,2,0,0,0,0|2,0,0]=4 11914 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Br)C d01c63490a028ebf894e3872e68e6456 [0,2,0,0,0,0|2,0,0]=4 11915 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Br)Cl 315adc38c039874d205bdff6e3eeff1b [0,2,0,0,0,0|2,0,0]=4 11916 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Br)F e60a796360160c62a14c25d572dc7920 [0,2,0,0,0,0|2,0,0]=4 11917 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Br)O 37988ffc25ba3de2a4ac2f60f1ca4239 [0,2,0,0,0,0|2,0,0]=4 11918 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1C)Br 71c145a0bd6d9933ee886c1f4633513f [0,2,0,0,0,0|2,0,0]=4 11919 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1C)C 714b93d61a59b6028fb368f2289b5b3c [0,2,0,0,0,0|2,0,0]=4 11920 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1C)Cl 8c967875c53f1d2b8d495ec5910cb345 [0,2,0,0,0,0|2,0,0]=4 11921 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1C)F 80f044898983be086603af3f44296c08 [0,2,0,0,0,0|2,0,0]=4 11922 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1C)O e58f4977776ffeafc0051d2b7731faab [0,2,0,0,0,0|2,0,0]=4 11923 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Cl)Br 56fd3980a9076be6dbefe4220c66deda [0,2,0,0,0,0|2,0,0]=4 11924 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Cl)C 5d927bcabfe936f751854491a5d4b215 [0,2,0,0,0,0|2,0,0]=4 11925 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Cl)Cl a0bf9a07bebe9dbb7eae124c59d43aeb [0,2,0,0,0,0|2,0,0]=4 11926 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1Cl)O 47aa7a5e4d971e284cd17067e2dc476b [0,2,0,0,0,0|2,0,0]=4 11927 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1F)Br 00b7ad9b7ed1e70c356eaea86dd99f96 [0,2,0,0,0,0|2,0,0]=4 11928 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1F)C 0ba00d6c3df92e5d1275bdafc36c333a [0,2,0,0,0,0|2,0,0]=4 11929 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1F)Cl 3c97b56b7d7d8a398d0d87d9192fa762 [0,2,0,0,0,0|2,0,0]=4 11930 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1F)F 4a1d232cbdbf1e651148896ed228be86 [0,2,0,0,0,0|2,0,0]=4 11931 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1F)O f0fe9cb2438309bd0cc9e9adfd210233 [0,2,0,0,0,0|2,0,0]=4 11932 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1O)Br 79ca3f8a38deb43e1f3ab384357edfb8 [0,2,0,0,0,0|2,0,0]=4 11933 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1O)C fa9fd82af718ac5b6d5e636591e1485f [0,2,0,0,0,0|2,0,0]=4 11934 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1O)Cl 6d616a3062bc1c470136abcfc8c26a26 [0,2,0,0,0,0|2,0,0]=4 11935 B17R1.9248 CCCCCCNC(=O)c1nc(ccc1O)F 29adae5fc4cdbb3517de4ec5a519c195 [0,2,0,0,0,0|2,0,0]=4 11936 B17R1.9248 CCCCCCOC(C)c1cc(ccc1F)I c798701448e03663cc0db69540a059f0 [0,2,0,0,0,0|1,0,1]=4 11937 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1Br)Cl ddf63e1f6bf7f26a76de46b0c626afb6 [0,2,0,0,0,0|2,0,0]=4 11938 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1C)Cl 4967fdebbb66e86c89fb1dba50c008fc [0,2,0,0,0,0|2,0,0]=4 11939 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1C)F 00a08c5b0057ac9c6387fb279821319e [0,2,0,0,0,0|2,0,0]=4 11940 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1Cl)Cl 89e7cb52530f58a7b30256f7ff35009e [0,2,0,0,0,0|2,0,0]=4 11941 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1Cl)F 512e42651bef6fc94cc91c12dd16720e [0,2,0,0,0,0|2,0,0]=4 11942 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1F)Br beb4e8a43d4c442ec2da6de6b6444152 [0,2,0,0,0,0|2,0,0]=4 11943 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1F)C 212aa2c58968fd1f5938455c9c8a3edd [0,2,0,0,0,0|2,0,0]=4 11944 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1F)Cl c3bb3dc8b100d51e110980c370ccf6d1 [0,2,0,0,0,0|2,0,0]=4 11945 B17R1.9248 CCCCCNCC(=O)c1cc(ccc1F)F 78fc21ae8d1b632f4d016dc24c2aff72 [0,2,0,0,0,0|2,0,0]=4 11946 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1Br)Cl 6da1791d14f73426c7e9010d6968677f [0,2,0,0,0,0|2,0,0]=4 11947 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1Br)F b5070a2eab986fd5c250a612bf9a444d [0,2,0,0,0,0|2,0,0]=4 11948 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1C)F e8af4daec697ddbf5b794f022aa1e6c6 [0,2,0,0,0,0|2,0,0]=4 11949 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1Cl)Cl 33cb59f778866218e07388522fb8e4c5 [0,2,0,0,0,0|2,0,0]=4 11950 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1Cl)F b37b3254152f7368f1da4b16a6b07d56 [0,2,0,0,0,0|2,0,0]=4 11951 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1F)Br 88a9cb70d50ae29589d66dbcaa3b72c5 [0,2,0,0,0,0|2,0,0]=4 11952 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1F)Cl 1922ceb2cb8b689dd16bb5fd0071926b [0,2,0,0,0,0|2,0,0]=4 11953 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1F)F 4a4b7b25f03670a6c996cd801e513023 [0,2,0,0,0,0|2,0,0]=4 11954 B17R1.9248 CCCCCOCC(=O)c1cc(ccc1O)O d3e0144a179b40ac5086c4e752108914 [0,2,0,0,0,0|2,0,0]=4 11955 B17R1.9248 CCCNCCCC(=O)c1cc(ccc1F)F 3044d9efe221f11de81d1e93dca4d0e0 [0,2,0,0,0,0|2,0,0]=4 11956 B17R1.9248 CCCOCCCC(=O)c1cc(ccc1F)F ee1cccada4c8ea6c2d5d6e4dcd632876 [0,2,0,0,0,0|2,0,0]=4 11957 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Br)Br 759a2781115b8b85538a55184bb22442 [0,2,0,0,0,0|2,0,0]=4 11958 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Br)C 39b07a898907b4100a2cbd5d057d3cdf [0,2,0,0,0,0|2,0,0]=4 11959 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Br)Cl f5cfc8ae181eb753ec52543cf89a60eb [0,2,0,0,0,0|2,0,0]=4 11960 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Br)F bca9bcfe44243cd2affb5d17c2b15290 [0,2,0,0,0,0|2,0,0]=4 11961 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Br)I 469e85a4cc6c51a656569d8eea0f5147 [0,2,0,0,0,0|2,0,0]=4 11962 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Br)O 6ac1af65aeaae8ed69be552ebb7b49ff [0,2,0,0,0,0|2,0,0]=4 11963 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)Br ec96abdfb75551d082f5da2c368bc774 [0,2,0,0,0,0|2,0,0]=4 11964 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)C 30886efd1b75086d34c85fc5e57cf2e0 [0,2,0,0,0,0|2,0,0]=4 11965 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)Cl b3eacc26bf7dc904fa28c7c801f400fc [0,2,0,0,0,0|2,0,0]=4 11966 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)F 0c46e2e73cb542ba08642e6fdd52bd1c [0,2,0,0,0,0|2,0,0]=4 11967 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)I 5d53cd7d6fda0bf5e08aca98660c162c [0,2,0,0,0,0|2,0,0]=4 11968 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)O 0b3a5f76018b4afeae3406f2f4ff4e07 [0,2,0,0,0,0|2,0,0]=4 11969 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1C)S 63e72e3a10431e02ce7a07f1be966db3 [0,2,0,0,0,0|2,0,0]=4 11970 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Cl)Br 8d895448141432a45f0d72c7711ff90c [0,2,0,0,0,0|2,0,0]=4 11971 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Cl)C 4c57772f333773e0a8106a10b6d65730 [0,2,0,0,0,0|2,0,0]=4 11972 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Cl)Cl 9bd8198504828d010233e2795c518a13 [0,2,0,0,0,0|2,0,0]=4 11973 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Cl)F 082c5651d0d09a3587cd612541f4bde8 [0,2,0,0,0,0|2,0,0]=4 11974 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Cl)I eb8b3973b7884a6fe0a1874f77b50b8b [0,2,0,0,0,0|2,0,0]=4 11975 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1Cl)O 1efa95d06fe1f6383295d2e166c6b68d [0,2,0,0,0,0|2,0,0]=4 11976 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1F)Br 30a883ddc9735ce4fd9952fd0811a1aa [0,2,0,0,0,0|2,0,0]=4 11977 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1F)C f0b37e10fee1c8b175bca60d8bdb56d7 [0,2,0,0,0,0|2,0,0]=4 11978 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1F)Cl c9a7267552459a20ab346db8195894ef [0,2,0,0,0,0|2,0,0]=4 11979 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1F)F 4fb2547ec29b4332a326ac74783c7b63 [0,2,0,0,0,0|2,0,0]=4 11980 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1F)I 5f39247d60c8d1d6ec87ca3bf3781fdd [0,2,0,0,0,0|2,0,0]=4 11981 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1F)O ba87801efe9ae498b7eaa0262ce9c110 [0,2,0,0,0,0|2,0,0]=4 11982 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1I)Br 054eacfa2f8f8c83bdcb04304052e43a [0,2,0,0,0,0|2,0,0]=4 11983 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1I)C e895aab44f651ca554857b30be6347d6 [0,2,0,0,0,0|2,0,0]=4 11984 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1I)Cl 633ff385d070d742aadb0bc1baeddd39 [0,2,0,0,0,0|2,0,0]=4 11985 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1I)F f096fca5aa1e3c993a3b16b416fec7df [0,2,0,0,0,0|2,0,0]=4 11986 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1I)I 576e7b1911c9f613ca02d06be51cfaae [0,2,0,0,0,0|2,0,0]=4 11987 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1I)O 1aaf612373a6a1744a122a48350535c2 [0,2,0,0,0,0|2,0,0]=4 11988 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1O)Br 6d15e25280208a2ccec5e8c38800e19d [0,2,0,0,0,0|2,0,0]=4 11989 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1O)C 5f375b054ac7d1c1097f73f515b8f080 [0,2,0,0,0,0|2,0,0]=4 11990 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1O)Cl bd605cec961b8a6019889d5a052659bc [0,2,0,0,0,0|2,0,0]=4 11991 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1O)F 79048c24fab375210c82a074bddb8df6 [0,2,0,0,0,0|2,0,0]=4 11992 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1O)I 843c870567ee444db365ab804e43856c [0,2,0,0,0,0|2,0,0]=4 11993 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1O)O 575bc464d28acc2820f721137cd30c13 [0,2,0,0,0,0|2,0,0]=4 11994 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1S)Br 0527c422cec859a3006742513735f5d4 [0,2,0,0,0,0|2,0,0]=4 11995 B17R1.9248 CCCOCCNC(=O)c1cc(ccc1S)F ff6b6d1eef9ed33bb4cdb6824b82303f [0,2,0,0,0,0|2,0,0]=4 11996 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Br)Br f0cb8626f4e88e1fea008c553c737fa4 [0,2,0,0,0,0|2,0,0]=4 11997 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Br)C eb76757681ec486917106b0ab2d5e839 [0,2,0,0,0,0|2,0,0]=4 11998 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Br)Cl cafc08d12b1e56633e6c0ac767cf5fac [0,2,0,0,0,0|2,0,0]=4 11999 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Br)F 8325251d1ca8fa535475e53aab18fdec [0,2,0,0,0,0|2,0,0]=4 12000 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Br)I 7781053d0fb0a48e90250d9a570e6782 [0,2,0,0,0,0|2,0,0]=4 12001 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Br)O ceaf81fd807d53fee423f42f76eaf5ac [0,2,0,0,0,0|2,0,0]=4 12002 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)Br 36c029617fb68d52809c61358d82bdf4 [0,2,0,0,0,0|2,0,0]=4 12003 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)C 2486db8ad7a8cbe0a6f332a0bcb1e61b [0,2,0,0,0,0|2,0,0]=4 12004 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)Cl a49ab1bd367f48592471b3aaf9c3f090 [0,2,0,0,0,0|2,0,0]=4 12005 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)F 452a807f1bd61ec87109adf14ad7639f [0,2,0,0,0,0|2,0,0]=4 12006 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)I 4a4889444b4e40af3c2a6427764c7fec [0,2,0,0,0,0|2,0,0]=4 12007 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)O fde01a051258d9120044d220f9a5e5fc [0,2,0,0,0,0|2,0,0]=4 12008 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1C)S db5365311f29b8cd69ba5612fcb0c9ed [0,2,0,0,0,0|2,0,0]=4 12009 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Cl)Br 465a6dd1599fd2d64b79583bdf3a5ae9 [0,2,0,0,0,0|2,0,0]=4 12010 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Cl)C 055f91369bc546a3893b4a1000d32de7 [0,2,0,0,0,0|2,0,0]=4 12011 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Cl)Cl 7287799989a8453895e60a87aeb1efa1 [0,2,0,0,0,0|2,0,0]=4 12012 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Cl)F abe33df57c9b7bef80c2d025d3fef623 [0,2,0,0,0,0|2,0,0]=4 12013 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Cl)I 1939eec5ff46a2e66d58f38527e1ea04 [0,2,0,0,0,0|2,0,0]=4 12014 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1Cl)O 2aa5a22eac80777f8398eca3b7d15f17 [0,2,0,0,0,0|2,0,0]=4 12015 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1F)Br 02e5154358641fe0a7479c5e101ee22b [0,2,0,0,0,0|2,0,0]=4 12016 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1F)C a1c577b3abae91b326dc7647d3d9a1f9 [0,2,0,0,0,0|2,0,0]=4 12017 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1F)Cl 2e5fea46e197ae86c1a854fb1cb716a0 [0,2,0,0,0,0|2,0,0]=4 12018 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1F)F da83c532e76ebe8bbf49b6a0a86408eb [0,2,0,0,0,0|2,0,0]=4 12019 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1F)I f416214927a910576af903a87d69aef7 [0,2,0,0,0,0|2,0,0]=4 12020 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1F)O ca69c9bcfddace720ddeac3520456517 [0,2,0,0,0,0|2,0,0]=4 12021 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1I)Br cdaa7e4519cecd717e1cf528dbf7ce80 [0,2,0,0,0,0|2,0,0]=4 12022 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1I)C e88a005340ef2a4db90eba20559ce221 [0,2,0,0,0,0|2,0,0]=4 12023 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1I)Cl 754d13fb7fae6acab8d090fb380e04dc [0,2,0,0,0,0|2,0,0]=4 12024 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1I)F 76541a711c8371a0b62e5469a0ce6412 [0,2,0,0,0,0|2,0,0]=4 12025 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1I)I 851387e2a26583c36d48a7bca40da689 [0,2,0,0,0,0|2,0,0]=4 12026 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1I)O 10d326b1c83b7784587dc3f8f14d0142 [0,2,0,0,0,0|2,0,0]=4 12027 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1O)Br 64b1f801294ac8769639aca5437af47f [0,2,0,0,0,0|2,0,0]=4 12028 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1O)C eb17b34f7d7679d19161b71a4042cf33 [0,2,0,0,0,0|2,0,0]=4 12029 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1O)Cl bb1dbc7e36d7acd9a6791e3cd3ded23f [0,2,0,0,0,0|2,0,0]=4 12030 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1O)F fba053eb5995b588e682e774c7ded204 [0,2,0,0,0,0|2,0,0]=4 12031 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1O)I d9c022e1cd6595e78bbea4dc310fb94b [0,2,0,0,0,0|2,0,0]=4 12032 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1O)O 53588b168f5159798866ce18c1eb4352 [0,2,0,0,0,0|2,0,0]=4 12033 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1S)Br c40f7ecf2a1814f7842ad68e1b9149ab [0,2,0,0,0,0|2,0,0]=4 12034 B17R1.9248 CCOCCCNC(=O)c1cc(ccc1S)F 13cb153a2be1e64d85ba091cdf1be933 [0,2,0,0,0,0|2,0,0]=4 12035 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Br)Br eecfaf6b2db016f852df646f16be41a4 [0,2,0,0,0,0|2,0,0]=4 12036 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Br)C 636849b0d2a4c728219850e72634d2ea [0,2,0,0,0,0|2,0,0]=4 12037 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Br)Cl 037ffc4a02a9c48b7fb84c9bf49791fe [0,2,0,0,0,0|2,0,0]=4 12038 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Br)F 371d3bca57e2a8399b1ad7411fc8e90e [0,2,0,0,0,0|2,0,0]=4 12039 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Br)I 63e826e7ce6f158ebf6b35e2c2b0a8b8 [0,2,0,0,0,0|2,0,0]=4 12040 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Br)O d527df036cf3e5f8f8585e618ca0b944 [0,2,0,0,0,0|2,0,0]=4 12041 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)Br 136658b89d901c860ed06b6a634af299 [0,2,0,0,0,0|2,0,0]=4 12042 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)C 5e7cfbfbb79d9a64bdd853f845003a5f [0,2,0,0,0,0|2,0,0]=4 12043 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)Cl e4636d45951718087bf202a709cca6ba [0,2,0,0,0,0|2,0,0]=4 12044 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)F 07c9da97a7fc7092c87381754762fbfa [0,2,0,0,0,0|2,0,0]=4 12045 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)I 3f9c93fd1dda3a1dca88fa8f67eb5baf [0,2,0,0,0,0|2,0,0]=4 12046 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)O 32bd3d364773b684679e4842b117e45b [0,2,0,0,0,0|2,0,0]=4 12047 B17R1.9248 COCCCCNC(=O)c1cc(ccc1C)S 1047804399fcf98b16b5d4103f40b07d [0,2,0,0,0,0|2,0,0]=4 12048 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Cl)Br 635c9cef88ac14087dc25e344cbae6e5 [0,2,0,0,0,0|2,0,0]=4 12049 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Cl)C 4fc488982be6371ea2b143696e1ab1b7 [0,2,0,0,0,0|2,0,0]=4 12050 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Cl)Cl a2ae7065587a6d941fdf0ba50142ad0a [0,2,0,0,0,0|2,0,0]=4 12051 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Cl)F 2d500d7eadcbfb8acd88008fba6f2d80 [0,2,0,0,0,0|2,0,0]=4 12052 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Cl)I 51de6cc8a7d830d243f0cc57ec997a29 [0,2,0,0,0,0|2,0,0]=4 12053 B17R1.9248 COCCCCNC(=O)c1cc(ccc1Cl)O 9a46e1c5556a4a21b0117bb8e532e605 [0,2,0,0,0,0|2,0,0]=4 12054 B17R1.9248 COCCCCNC(=O)c1cc(ccc1F)Br 681a16520f5e4ec893e75bd049a706bd [0,2,0,0,0,0|2,0,0]=4 12055 B17R1.9248 COCCCCNC(=O)c1cc(ccc1F)C 7f30ca1c757aaedc0c5621deec91f933 [0,2,0,0,0,0|2,0,0]=4 12056 B17R1.9248 COCCCCNC(=O)c1cc(ccc1F)Cl e3a5b417baec7514f0ebc4194e673e27 [0,2,0,0,0,0|2,0,0]=4 12057 B17R1.9248 COCCCCNC(=O)c1cc(ccc1F)F ca1d5159cf3a600205cc39097a1a81ca [0,2,0,0,0,0|2,0,0]=4 12058 B17R1.9248 COCCCCNC(=O)c1cc(ccc1F)I 2475ccaea764c484d0b5303150212dc0 [0,2,0,0,0,0|2,0,0]=4 12059 B17R1.9248 COCCCCNC(=O)c1cc(ccc1F)O 44896ac8c64aaffb60c7478f2986c2d0 [0,2,0,0,0,0|2,0,0]=4 12060 B17R1.9248 COCCCCNC(=O)c1cc(ccc1I)Br e5c0edeb2d9b7f3285bc77ca4a28ecd2 [0,2,0,0,0,0|2,0,0]=4 12061 B17R1.9248 COCCCCNC(=O)c1cc(ccc1I)C aee68f62ada61fbec5fd3b4213c77945 [0,2,0,0,0,0|2,0,0]=4 12062 B17R1.9248 COCCCCNC(=O)c1cc(ccc1I)Cl 88cf0218df3d2fee26f09a8e86f95979 [0,2,0,0,0,0|2,0,0]=4 12063 B17R1.9248 COCCCCNC(=O)c1cc(ccc1I)F fb5daf762f078a01877a5070b622c964 [0,2,0,0,0,0|2,0,0]=4 12064 B17R1.9248 COCCCCNC(=O)c1cc(ccc1I)I 654d292eca4d705762a1f4bef8e82675 [0,2,0,0,0,0|2,0,0]=4 12065 B17R1.9248 COCCCCNC(=O)c1cc(ccc1I)O 74e82b95b17114c049fca2802819e0e9 [0,2,0,0,0,0|2,0,0]=4 12066 B17R1.9248 COCCCCNC(=O)c1cc(ccc1O)Br c3d8651ce64373f40b90c433ab478ccf [0,2,0,0,0,0|2,0,0]=4 12067 B17R1.9248 COCCCCNC(=O)c1cc(ccc1O)C 34d8d1791c8b0650f4bdb68e33b9f90a [0,2,0,0,0,0|2,0,0]=4 12068 B17R1.9248 COCCCCNC(=O)c1cc(ccc1O)Cl 6a406d7bb200ba7d62a8b8431c00d862 [0,2,0,0,0,0|2,0,0]=4 12069 B17R1.9248 COCCCCNC(=O)c1cc(ccc1O)F b3d21c0aec108f6c99a3fae3ec1ba59b [0,2,0,0,0,0|2,0,0]=4 12070 B17R1.9248 COCCCCNC(=O)c1cc(ccc1O)I d4e8eb7e37342a7c6e1ec1573fc50142 [0,2,0,0,0,0|2,0,0]=4 12071 B17R1.9248 COCCCCNC(=O)c1cc(ccc1O)O c56ac005ef03d6b1475fa5a60f7869ee [0,2,0,0,0,0|2,0,0]=4 12072 B17R1.9248 COCCCCNC(=O)c1cc(ccc1S)Br b28244ae02a3cfa02c0cea519fa67516 [0,2,0,0,0,0|2,0,0]=4 12073 B17R1.9248 COCCCCNC(=O)c1cc(ccc1S)F c838d3a504e201a43b29b9f83a20d7c5 [0,2,0,0,0,0|2,0,0]=4 12074 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Br)Br 93f527bd5e405ff3f5f13b181e3efbdf [0,2,0,0,0,0|2,0,0]=4 12075 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Br)C aaa4f4216f10e08a99a1a82551929bd7 [0,2,0,0,0,0|2,0,0]=4 12076 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Br)Cl 8a977edebc1585809180ce276c71aded [0,2,0,0,0,0|2,0,0]=4 12077 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Br)F 2a4c2f70cf3a1eb2b0bde0372d4868b2 [0,2,0,0,0,0|2,0,0]=4 12078 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Br)I 1821051cecca3ede431461167ca1732e [0,2,0,0,0,0|2,0,0]=4 12079 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Br)O 1f058bff6c97e79d622afded838e40aa [0,2,0,0,0,0|2,0,0]=4 12080 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)Br ea74377fcb764d11091513f68b35b141 [0,2,0,0,0,0|2,0,0]=4 12081 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)C b08c36a023c0c0b4ccbcbb5a328b9cda [0,2,0,0,0,0|2,0,0]=4 12082 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)Cl 3651939b718f5dfe5c60383e7be3cae0 [0,2,0,0,0,0|2,0,0]=4 12083 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)F 358adae492b67d342eeb3a29d3020232 [0,2,0,0,0,0|2,0,0]=4 12084 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)I 6337850a4a3b61d5b65c5eaa2585d59c [0,2,0,0,0,0|2,0,0]=4 12085 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)O ba3fe349a802bdb043247427c3376313 [0,2,0,0,0,0|2,0,0]=4 12086 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1C)S 66bf6c9e988e88834e6941f50228d308 [0,2,0,0,0,0|2,0,0]=4 12087 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Cl)Br 9cb44f38f3f5e4c879488b918ae9e29d [0,2,0,0,0,0|2,0,0]=4 12088 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Cl)C 5012c62363a3307c990469dd653f7c60 [0,2,0,0,0,0|2,0,0]=4 12089 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Cl)Cl 0819b758c037eb6e71bc5f999f636956 [0,2,0,0,0,0|2,0,0]=4 12090 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Cl)F 089c3f622e3ef8bc21333dae4dcb5ba0 [0,2,0,0,0,0|2,0,0]=4 12091 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Cl)I 77f23c77fc0e5b2a2ac3e3bcff15b66b [0,2,0,0,0,0|2,0,0]=4 12092 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1Cl)O ea3fd1bc94ebfe34a6b85bf3a1c8a097 [0,2,0,0,0,0|2,0,0]=4 12093 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1F)Br b707a0109f90f84afda3734860e1bdaa [0,2,0,0,0,0|2,0,0]=4 12094 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1F)C 77c078fb92a36b2baff56bfa92b7ab9c [0,2,0,0,0,0|2,0,0]=4 12095 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1F)Cl 25d57304b03df2f0582f544677d13861 [0,2,0,0,0,0|2,0,0]=4 12096 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1F)F c246e56d89afa2e0bf81aba574563c64 [0,2,0,0,0,0|2,0,0]=4 12097 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1F)I 7ca9375be8286a9cce8236201d0cdbd3 [0,2,0,0,0,0|2,0,0]=4 12098 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1F)O 0fbac89bc9feb52d5c922a23d8d48fe8 [0,2,0,0,0,0|2,0,0]=4 12099 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1I)Br f91265a3080c09bdceeaf88857c9d758 [0,2,0,0,0,0|2,0,0]=4 12100 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1I)C f60c94ac3b4ae2e87bdba8f5f41b2f6c [0,2,0,0,0,0|2,0,0]=4 12101 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1I)Cl 020e53e1a0e87f20c3df3561b3772680 [0,2,0,0,0,0|2,0,0]=4 12102 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1I)F bc2856dbb4d8b151f175503c13044c1d [0,2,0,0,0,0|2,0,0]=4 12103 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1I)I 74f793c5adc1919fb381ac8bd17dea3a [0,2,0,0,0,0|2,0,0]=4 12104 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1I)O 8299f8b27e842fa7df4faf5428ff880e [0,2,0,0,0,0|2,0,0]=4 12105 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1O)Br 0a88bdc8ce8ed35052dde75d8d4fd4d3 [0,2,0,0,0,0|2,0,0]=4 12106 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1O)C 00f2b3e8f953821a69acb4090d205347 [0,2,0,0,0,0|2,0,0]=4 12107 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1O)Cl e05c69d17cfd3441b73c55269b62bc16 [0,2,0,0,0,0|2,0,0]=4 12108 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1O)F 00ddc8805deedc6f7602bb99af255945 [0,2,0,0,0,0|2,0,0]=4 12109 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1O)I 98b5a7787bf5a0f4907432545e78db75 [0,2,0,0,0,0|2,0,0]=4 12110 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1O)O 5905f47e67f270a23bc7b6e063d45c58 [0,2,0,0,0,0|2,0,0]=4 12111 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1S)Br a266adc1abe9819868b5569f3c0634b4 [0,2,0,0,0,0|2,0,0]=4 12112 B17R1.9248 CSCCCCNC(=O)c1cc(ccc1S)F 296a94a0411c494d74a97a3ad9e0d776 [0,2,0,0,0,0|2,0,0]=4 12113 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCCl)Br dd6a3da0fa5b7de2679fd643801d25e4 [0,2,0,0,0,0|2,0,0]=4 12114 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCCl)C 6d5a822262d8093be3df374af4710bf3 [0,2,0,0,0,0|2,0,0]=4 12115 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCCl)Cl 59ab3137ee3b583a685a8bd73640b4e9 [0,2,0,0,0,0|2,0,0]=4 12116 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCCl)F 85f1e469bc1194cec0fda27b09c79e97 [0,2,0,0,0,0|2,0,0]=4 12117 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCCl)I 6314b1192625be1046168e49c83c5edb [0,2,0,0,0,0|2,0,0]=4 12118 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCCl)O ad8e3fb8cd6a05d88e7937a92703f004 [0,2,0,0,0,0|2,0,0]=4 12119 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCO)Br 7753ac054455cde0210e58eabdcef3a0 [0,2,0,0,0,0|2,0,0]=4 12120 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCO)C f9dc9c3a78f69c70e3771f50ca80ed2a [0,2,0,0,0,0|2,0,0]=4 12121 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCO)Cl aa50b6e4a7598d8eb2a9cca176c00a82 [0,2,0,0,0,0|2,0,0]=4 12122 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCO)F 088ef1df377478ba7b1b59e96722e7b5 [0,2,0,0,0,0|2,0,0]=4 12123 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCO)I 135a2df2aa61c6697d77868387fa0581 [0,2,0,0,0,0|2,0,0]=4 12124 B17R1.9248 Cc1ccc(c(c1)C(=O)NCCCCCO)O 00a6362de30a3579fe6815fef271d72a [0,2,0,0,0,0|2,0,0]=4 12125 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCCl)Br 3113c63976568252a47291b57686ce45 [0,2,0,0,0,0|2,0,0]=4 12126 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCCl)Cl fe5a6f24322c8901b7f2501ff8d51108 [0,2,0,0,0,0|2,0,0]=4 12127 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCCl)F 610209ee149343a36468a544a8f25ce3 [0,2,0,0,0,0|2,0,0]=4 12128 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCCl)I 5f706e954e77cff1cec018616ef2b69c [0,2,0,0,0,0|2,0,0]=4 12129 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCCl)O 4104bcaf0ede6f88851bfd0f0fb6fe89 [0,2,0,0,0,0|2,0,0]=4 12130 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCCl)S 55312db174ca67b3600129c70d39072f [0,2,0,0,0,0|2,0,0]=4 12131 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCO)Br e437d19c363100a6c3f6ddebd3046a01 [0,2,0,0,0,0|2,0,0]=4 12132 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCO)Cl 0be43e201950ed632ab99d31830836f0 [0,2,0,0,0,0|2,0,0]=4 12133 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCO)F 88bb77ef296c43d1d22cd47a7df19508 [0,2,0,0,0,0|2,0,0]=4 12134 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCO)I 3ffa4508d89b0f74e4e99a40f5ba67a2 [0,2,0,0,0,0|2,0,0]=4 12135 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCO)O 3f049198cb6b724fb0806adcebfcd077 [0,2,0,0,0,0|2,0,0]=4 12136 B17R1.9248 Cc1ccc(cc1C(=O)NCCCCCO)S 403ad025028b56331ce55fde61adf385 [0,2,0,0,0,0|2,0,0]=4 12137 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Br)Br 3c94ce8c12841e11271b14627c7b9595 [0,2,0,0,0,0|2,0,0]=4 12138 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Br)Cl f1f7fcec06e93c8a663f2923e7cea20b [0,2,0,0,0,0|2,0,0]=4 12139 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Br)F 2e68ba318dc9d1ca011597f7ccfed430 [0,2,0,0,0,0|2,0,0]=4 12140 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Br)I a9492a839c3b03310f1241fe0cbda17a [0,2,0,0,0,0|2,0,0]=4 12141 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Br)O ca887a6d2742adf606dceb4b50dbd1f5 [0,2,0,0,0,0|2,0,0]=4 12142 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Cl)Br b4f915e0a5cad8e387072b6f2163e86e [0,2,0,0,0,0|2,0,0]=4 12143 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Cl)Cl 139ae45f3dacf9c1a7c0c313a2a16dfb [0,2,0,0,0,0|2,0,0]=4 12144 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Cl)F 6a1261ab5d48d2d81a4562875f27294e [0,2,0,0,0,0|2,0,0]=4 12145 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Cl)I 62ac8796c6456250a91ac8e000e12e93 [0,2,0,0,0,0|2,0,0]=4 12146 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1Cl)O 399215223db7921eb0f823b30c35f77f [0,2,0,0,0,0|2,0,0]=4 12147 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1F)Br ba1f691900c5fc21609ee0882a067e1d [0,2,0,0,0,0|2,0,0]=4 12148 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1F)Cl d910e0b544f35943f59f1d7bf8d12f28 [0,2,0,0,0,0|2,0,0]=4 12149 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1F)F 2e6c76915395c7f23a96969521694298 [0,2,0,0,0,0|2,0,0]=4 12150 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1F)I e945b4e3e57db27cc39b09e334317a6d [0,2,0,0,0,0|2,0,0]=4 12151 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1F)O 3c9ec1a418723be3cb77b1947d222353 [0,2,0,0,0,0|2,0,0]=4 12152 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1I)Br 3c9bd8d9adb56a587ada1283f48fb369 [0,2,0,0,0,0|2,0,0]=4 12153 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1I)Cl d8aab7b4f7f9b56c232065551057aae1 [0,2,0,0,0,0|2,0,0]=4 12154 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1I)F 9932b297bd5748d8975e685c9f7b38c4 [0,2,0,0,0,0|2,0,0]=4 12155 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1I)I 2c1b46b95c897c067d34f3f97a0fe57a [0,2,0,0,0,0|2,0,0]=4 12156 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1I)O 7467c9f006f877e30e8d9ba9837a728e [0,2,0,0,0,0|2,0,0]=4 12157 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1O)Br 40084af1bbfd2240a138567349b5dcd0 [0,2,0,0,0,0|2,0,0]=4 12158 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1O)Cl e36482d85836ad3c0410f2a5d7a8c05a [0,2,0,0,0,0|2,0,0]=4 12159 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1O)F 6d695dc39847a791214f374434583a7e [0,2,0,0,0,0|2,0,0]=4 12160 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1O)I f3ff4415b771230a906aa2ada8548c88 [0,2,0,0,0,0|2,0,0]=4 12161 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1O)O 86164d32d9e29b6d6b9c716fac6b03b2 [0,2,0,0,0,0|2,0,0]=4 12162 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1S)Br 95eeafaeeacded45f134418ed4ff644a [0,2,0,0,0,0|2,0,0]=4 12163 B17R1.9248 O=C(NCCCCCCl)c1cc(ccc1S)F bcfaf50064540eb1f5f8eedf8a8586ae [0,2,0,0,0,0|2,0,0]=4 12164 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Br)Br fab5c3a13bc1c437e455451242c1b672 [0,2,0,0,0,0|2,0,0]=4 12165 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Br)Cl 30343234ca20d63c0d47c0570ed5f4f7 [0,2,0,0,0,0|2,0,0]=4 12166 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Br)F a20ba6d5e63c2af2e55e58bfc49be238 [0,2,0,0,0,0|2,0,0]=4 12167 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Br)I a51abea47aa6e248286133904338134b [0,2,0,0,0,0|2,0,0]=4 12168 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Br)O f6019ca92ecbef1bc10d3d43d78ca380 [0,2,0,0,0,0|2,0,0]=4 12169 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Cl)Br 5b3ebbe394d56290acfeb6acdf52865e [0,2,0,0,0,0|2,0,0]=4 12170 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Cl)Cl 90682687b2049a29e6b5116cd811873c [0,2,0,0,0,0|2,0,0]=4 12171 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Cl)F 0f167933565b9ded5609c5d65892a7ee [0,2,0,0,0,0|2,0,0]=4 12172 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Cl)I 28fd0cafa18d3e19057e7d98a0e5b80b [0,2,0,0,0,0|2,0,0]=4 12173 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1Cl)O 557876c952ad63bbb4c6423cccdf383c [0,2,0,0,0,0|2,0,0]=4 12174 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1F)Br 63b62effa005b83b550fbeea4fedc774 [0,2,0,0,0,0|2,0,0]=4 12175 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1F)Cl aa7c73e40365b312441d349b8e5a2390 [0,2,0,0,0,0|2,0,0]=4 12176 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1F)F 42b16ed5bb0ad3f70c64cb6de598b78c [0,2,0,0,0,0|2,0,0]=4 12177 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1F)I 08b5e43b689d1cbe869f08314e1c7850 [0,2,0,0,0,0|2,0,0]=4 12178 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1F)O 728202e90ccc2f5c781c5459811aedb5 [0,2,0,0,0,0|2,0,0]=4 12179 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1I)Br 72e229d0112cb9e5319e32c075531da4 [0,2,0,0,0,0|2,0,0]=4 12180 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1I)Cl ce5149303fb3f296b88a63bd21530415 [0,2,0,0,0,0|2,0,0]=4 12181 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1I)F 770213cfcbbc65e138849066daed5605 [0,2,0,0,0,0|2,0,0]=4 12182 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1I)I f4006d0546d14ec99b52432adf8c30af [0,2,0,0,0,0|2,0,0]=4 12183 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1I)O 2bd776ed97cab2fa7967f7eaf92edc69 [0,2,0,0,0,0|2,0,0]=4 12184 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1O)Br f536b0b8ed5ea682c77010edf0eba6ad [0,2,0,0,0,0|2,0,0]=4 12185 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1O)Cl a866350704e7a529747fef2072284fce [0,2,0,0,0,0|2,0,0]=4 12186 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1O)F efc29d21c1d1796fc59220486c835b2f [0,2,0,0,0,0|2,0,0]=4 12187 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1O)I 88bdfcae1777766d3f12de9b92dd4ba0 [0,2,0,0,0,0|2,0,0]=4 12188 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1O)O e0de6d1a95e64f907ae39a137019d838 [0,2,0,0,0,0|2,0,0]=4 12189 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1S)Br a3a01bcbd8d02c1106ba4cf08db3dd5b [0,2,0,0,0,0|2,0,0]=4 12190 B17R1.9248 O=C(NCCCCCO)c1cc(ccc1S)F cc863deedefa6b9cba99e5cfcc48ec8e [0,2,0,0,0,0|2,0,0]=4 12191 B17R1.9253 CCCCCCNC(=O)c1cc(=O)cc(o1)C 9461feae765d1906341a953b2473a23e [0,2,0,0,0,0|2,0,0]=4 12192 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Br)Br 5c84d584cde2eb447629789e86eadb02 [0,2,0,0,0,0|1,0,0]=3 12193 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Br)C 6b8d3203258d6302bd55ca352fe9d8ae [0,2,0,0,0,0|1,0,0]=3 12194 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Br)Cl c45fb7db33653ac463b7936fdd77f3e6 [0,2,0,0,0,0|1,0,0]=3 12195 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Br)F ba247cb524468273c0902dec4dd37d0d [0,2,0,0,0,0|1,0,0]=3 12196 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Br)O 3dab9e973c7e6a0334618e8d0aa59509 [0,2,0,0,0,0|1,0,0]=3 12197 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)C)C ad6e347a501625f95cf4e65dbe97ab1d [0,2,0,0,0,0|1,0,0]=3 12198 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Cl)C b7af8f47e0780dc6dc917484ae2f544c [0,2,0,0,0,0|1,0,0]=3 12199 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Cl)Cl c6f2e4051f833653e4f86597f16b4006 [0,2,0,0,0,0|1,0,0]=3 12200 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Cl)F a87137a116e99cbd65e829b4d1f5f376 [0,2,0,0,0,0|1,0,0]=3 12201 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)Cl)O 1ff4b5c95a962bf78f881ae7a76e60d1 [0,2,0,0,0,0|1,0,0]=3 12202 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)F)C 30ee9139538fc856ed9374d9ce8d77d0 [0,2,0,0,0,0|1,0,0]=3 12203 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)F)F 62d0236e87b5e03d7793cbfbe8cd6f2d [0,2,0,0,0,0|1,0,0]=3 12204 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)F)O 28f27f63a8ad011378218d52cd85119f [0,2,0,0,0,0|1,0,0]=3 12205 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)I)Br 21e35c75f6661ca3d2a84a3376e2bfc7 [0,2,0,0,0,0|1,0,0]=3 12206 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)I)C fe3dcf37b3bdaf4d013b7465f8339dd9 [0,2,0,0,0,0|1,0,0]=3 12207 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)I)Cl c4ecded775310863c84dfc75310c087d [0,2,0,0,0,0|1,0,0]=3 12208 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)I)F 764fd57a4b00efa27147c2c8f8675e04 [0,2,0,0,0,0|1,0,0]=3 12209 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)I)I 1247f4c2ec53645954a52e7008d21f46 [0,2,0,0,0,0|1,0,0]=3 12210 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)I)O f4226c3eefc0ffa6eea59fbbaca97a3e [0,2,0,0,0,0|1,0,0]=3 12211 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)O)C 93224dfb9fb20f55b1565258e44b00c9 [0,2,0,0,0,0|1,0,0]=3 12212 B17R1.9253 CCCCCCNC(=O)c1cc(cc(c1)O)O ef5019353b49a91c29663fc1df4bf1bd [0,2,0,0,0,0|1,0,0]=3 12213 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Br)Br 99b4056a79c92c029e243e36621fb258 [0,2,0,0,0,0|2,0,0]=4 12214 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Br)C be4877431b335e557f556de7c092868d [0,2,0,0,0,0|2,0,0]=4 12215 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Br)Cl 323de64443eaefc3bf001d15c28d71fb [0,2,0,0,0,0|2,0,0]=4 12216 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Br)O 6a2c7aba22f82c2b314f5136a7f1f99a [0,2,0,0,0,0|2,0,0]=4 12217 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)C)Br f9ee874c3f993d5e3e6ca952a377faa6 [0,2,0,0,0,0|2,0,0]=4 12218 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)C)C d856668fd4c9cbc154e1faec611f3937 [0,2,0,0,0,0|2,0,0]=4 12219 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)C)Cl 86d32645f904b75f074dd05798a64250 [0,2,0,0,0,0|2,0,0]=4 12220 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)C)F 239052e4537e1c54293f4a5b76bf99e2 [0,2,0,0,0,0|2,0,0]=4 12221 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)C)O a983ee0646680b520746bf61992f0418 [0,2,0,0,0,0|2,0,0]=4 12222 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Cl)Br 3781e8dabe149da3db2ce020fedfd2f5 [0,2,0,0,0,0|2,0,0]=4 12223 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Cl)C 5e8b25dc4558645824d40fa29d132d2a [0,2,0,0,0,0|2,0,0]=4 12224 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Cl)Cl 0d466c16f4bc8bf145d2c4f852904459 [0,2,0,0,0,0|2,0,0]=4 12225 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)Cl)F 1a89418cb4257736e5aa0cbe84abd2c7 [0,2,0,0,0,0|2,0,0]=4 12226 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)F)C 8cfbfe4fada91352b0ef9a94fbb1d736 [0,2,0,0,0,0|2,0,0]=4 12227 B17R1.9253 CCCCCCNC(=O)c1cc(cc(n1)O)Cl 1ebbadacd7addd4193ef0c48bfeae208 [0,2,0,0,0,0|2,0,0]=4 12228 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Br)Br 58ce591c870cd84861135dffc0fe3e43 [0,2,0,0,0,0|2,0,0]=4 12229 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Br)C fc7b9ba74fa3eed95069b7f65d6b0131 [0,2,0,0,0,0|2,0,0]=4 12230 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Br)Cl 414ec7d462b1f5708d814f833e0fdf92 [0,2,0,0,0,0|2,0,0]=4 12231 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Br)F cf12faa5ebaec739f48eb3ed94bf0bed [0,2,0,0,0,0|2,0,0]=4 12232 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)C)C aca38c1d2cd3d31ec01450114fafdd38 [0,2,0,0,0,0|2,0,0]=4 12233 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Cl)C 31b63d937831c0afcfe2aaba805ad489 [0,2,0,0,0,0|2,0,0]=4 12234 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Cl)Cl 4de60209e803c50957263d6a84d7026e [0,2,0,0,0,0|2,0,0]=4 12235 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)Cl)O c7735a11e2aeaca5b4f3d57397f6bfd8 [0,2,0,0,0,0|2,0,0]=4 12236 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)F)F f2e712cafe86466ac15376ce91b7f7a3 [0,2,0,0,0,0|2,0,0]=4 12237 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)O)C fbe5132c3a55ff679a0c7a080dda775c [0,2,0,0,0,0|2,0,0]=4 12238 B17R1.9253 CCCCCCNC(=O)c1cc(nc(c1)O)O 37db8be37eafe2dd16117b6f1a745dcf [0,2,0,0,0,0|2,0,0]=4 12239 B17R1.9253 CCCCCCOC(C)c1cc(cc(c1)Br)C 62d5697961a580e5c884c7fd455926bc [0,2,0,0,0,0|1,0,1]=4 12240 B17R1.9253 CCCCCCOC(C)c1cc(cc(c1)C)C 475363cf3f8f134ad10585504faca132 [0,2,0,0,0,0|1,0,1]=4 12241 B17R1.9253 CCCCCCOC(C)c1cc(cc(c1)F)C c8abd7220607526a4d22d9da2fce8f6f [0,2,0,0,0,0|1,0,1]=4 12242 B17R1.9253 CCCCCCOC(C)c1cc(cc(c1)F)F 90d60e58b14a78dc4452e72188bae78a [0,2,0,0,0,0|1,0,1]=4 12243 B17R1.9253 CCCCCCO[C@@H](C)c1cc(cc(c1)F)F 33d53f1bf434c3ab46c6b530f60e486e [0,2,0,0,0,0|1,0,1]=4 12244 B17R1.9253 CCCCCCO[C@H](C)c1cc(cc(c1)F)F fdecc5ed5aca0945f771edcc2ac8a26d [0,2,0,0,0,0|1,0,1]=4 12245 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)Br)C 69046fe90f61afcaf5a257e099a434b7 [0,2,0,0,0,0|2,0,0]=4 12246 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)Br)Cl e227c364501dabdf87b8891505d9a2f2 [0,2,0,0,0,0|2,0,0]=4 12247 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)Br)F 6fd3039a84d9b337a476d179afd39c90 [0,2,0,0,0,0|2,0,0]=4 12248 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)Cl)Cl 56a42088c137c4d6a59daafacf2eeb3b [0,2,0,0,0,0|2,0,0]=4 12249 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)Cl)F 34c76908ebf17b031ce79cb725c5418a [0,2,0,0,0,0|2,0,0]=4 12250 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)F)C 07de932858b8a1a5f0c9fe53586e40ce [0,2,0,0,0,0|2,0,0]=4 12251 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)F)F c49666c1f2b24fc1149e9769e1a9ca87 [0,2,0,0,0,0|2,0,0]=4 12252 B17R1.9253 CCCCCNCC(=O)c1cc(cc(c1)I)Cl 19d35ba2a52c759900db611e5eda68cc [0,2,0,0,0,0|2,0,0]=4 12253 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)Br)C 6f3dba6e2af325af487097a9d65c76a6 [0,2,0,0,0,0|2,0,0]=4 12254 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)Cl)Cl 252d71c0ceb99a14614dd2ca50a1cb8b [0,2,0,0,0,0|2,0,0]=4 12255 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)Cl)F b934fc31bea9f842612d18fba12d84ff [0,2,0,0,0,0|2,0,0]=4 12256 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)F)C f1c5a755bd1cae49db8dec83a156da02 [0,2,0,0,0,0|2,0,0]=4 12257 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)F)F c397c9f32db12bd7dc9fb39151f0ab94 [0,2,0,0,0,0|2,0,0]=4 12258 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)I)Cl 2f384e5d9fcecc33337b47d14679f5f8 [0,2,0,0,0,0|2,0,0]=4 12259 B17R1.9253 CCCCCOCC(=O)c1cc(cc(c1)O)O 267e0ea9f06abb5939c86dcaa522212c [0,2,0,0,0,0|2,0,0]=4 12260 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Br)Br 00ca0d6b417fc18bc690cc6f1c9c9b11 [0,2,0,0,0,0|2,0,0]=4 12261 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Br)C d822c7ff8092cfd77e796fb65ccc1990 [0,2,0,0,0,0|2,0,0]=4 12262 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Br)Cl 367cffaee0cf239f65d4a94ca1f1b6f8 [0,2,0,0,0,0|2,0,0]=4 12263 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Br)F d502d752a7c3c5fe3137a1771a09a1fb [0,2,0,0,0,0|2,0,0]=4 12264 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Br)O 6bb69ce694524cb4c738ddd3fba94cce [0,2,0,0,0,0|2,0,0]=4 12265 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)C)C 5bd3cf21f8503bd77d90b38e184e0a86 [0,2,0,0,0,0|2,0,0]=4 12266 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Cl)C d98bcb4f29e1b57ae395744c7ff6555a [0,2,0,0,0,0|2,0,0]=4 12267 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Cl)Cl d60930eac9fe94a84e44c8f9774f49b4 [0,2,0,0,0,0|2,0,0]=4 12268 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Cl)F bf5de4dbfd5cd26888563f168603aadd [0,2,0,0,0,0|2,0,0]=4 12269 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)Cl)O 3c58a10904125de4d1789c40d1cbd878 [0,2,0,0,0,0|2,0,0]=4 12270 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)F)C 5bdcc4c113c73bf8793fb06d75b39ac3 [0,2,0,0,0,0|2,0,0]=4 12271 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)F)F 0b6699829e5e12fef0522db6a994a922 [0,2,0,0,0,0|2,0,0]=4 12272 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)F)O 8cde4e5021379f5694a3c8eacaaf1651 [0,2,0,0,0,0|2,0,0]=4 12273 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)I)Br 99618586491085288c359a15d0fccf67 [0,2,0,0,0,0|2,0,0]=4 12274 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)I)C f67c09ce11a914a459ad5004e0334a02 [0,2,0,0,0,0|2,0,0]=4 12275 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)I)Cl b44d82b835237b3f9df9b5327e432003 [0,2,0,0,0,0|2,0,0]=4 12276 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)I)F 0ebf64bb989afb5eaceddff3245cb600 [0,2,0,0,0,0|2,0,0]=4 12277 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)I)I 18ec2f352924345c71de4779f60989cb [0,2,0,0,0,0|2,0,0]=4 12278 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)I)O ab0beae6537fad937f268b26b2baf66b [0,2,0,0,0,0|2,0,0]=4 12279 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)O)C 5922738bc579d2b9e018b5f604b12a0c [0,2,0,0,0,0|2,0,0]=4 12280 B17R1.9253 CCCOCCNC(=O)c1cc(cc(c1)O)O 05e435e94b3abc38d8296a13629c564a [0,2,0,0,0,0|2,0,0]=4 12281 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Br)Br b3ef06af4d036b4a637fed44b48c8171 [0,2,0,0,0,0|2,0,0]=4 12282 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Br)C df7fceedb5cd530aa4fb10d8bdba51a1 [0,2,0,0,0,0|2,0,0]=4 12283 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Br)Cl 73251042b85b440266d51df7ce09f256 [0,2,0,0,0,0|2,0,0]=4 12284 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Br)F 03f92277334ed5858368fc2e3ae049f7 [0,2,0,0,0,0|2,0,0]=4 12285 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Br)O 34bedb99f1b9d6fc292b290c48c71aee [0,2,0,0,0,0|2,0,0]=4 12286 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)C)C 7dc9dcd84cb54d4d4e67fc93874170cb [0,2,0,0,0,0|2,0,0]=4 12287 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Cl)C 4a1d53bd32ad1714cc2fcd5fbc637040 [0,2,0,0,0,0|2,0,0]=4 12288 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Cl)Cl 986377116931e01bbfcd5d5edc6e692c [0,2,0,0,0,0|2,0,0]=4 12289 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Cl)F 0f0f9d5c7dbe792de62cb65a13630826 [0,2,0,0,0,0|2,0,0]=4 12290 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)Cl)O 9b0be103bf946616ec91c136cb07c59a [0,2,0,0,0,0|2,0,0]=4 12291 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)F)C 19bf494d3026822be2a0cd4fb7d729a3 [0,2,0,0,0,0|2,0,0]=4 12292 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)F)F 40406ba5a02dcb2405c166e888569b98 [0,2,0,0,0,0|2,0,0]=4 12293 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)F)O 470c67e04b448ea09abf9f4714f489a3 [0,2,0,0,0,0|2,0,0]=4 12294 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)I)Br e31e33a30000bc5ca23b36b3f90e20b7 [0,2,0,0,0,0|2,0,0]=4 12295 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)I)C 4d1d7fbe343a5938bbb800c1a9c7d8f2 [0,2,0,0,0,0|2,0,0]=4 12296 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)I)Cl 68cd6be04dea33e5f8fb1c48e38a0a83 [0,2,0,0,0,0|2,0,0]=4 12297 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)I)F 4b3a192bad1d7787b4a938c427fb04d6 [0,2,0,0,0,0|2,0,0]=4 12298 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)I)I b8af5b3432b6bc7a0fd8668cac090da0 [0,2,0,0,0,0|2,0,0]=4 12299 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)I)O 715444d757d78063fecbdb8839a5e8b0 [0,2,0,0,0,0|2,0,0]=4 12300 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)O)C 6e116d049d5af446f1098bc7bb35d06c [0,2,0,0,0,0|2,0,0]=4 12301 B17R1.9253 CCOCCCNC(=O)c1cc(cc(c1)O)O fabe0a52fbd365923c3601f1467b3606 [0,2,0,0,0,0|2,0,0]=4 12302 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Br)Br 882e222ecfcf8843a5e9e71e5f47cc83 [0,2,0,0,0,0|2,0,0]=4 12303 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Br)C 4472279a7d0c80fba952c697bbb38c03 [0,2,0,0,0,0|2,0,0]=4 12304 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Br)Cl 8a5fbf1675ac632d9ae1b91d7f9aafc8 [0,2,0,0,0,0|2,0,0]=4 12305 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Br)F 4c05119b836090a7efc4bc66e2400bfc [0,2,0,0,0,0|2,0,0]=4 12306 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Br)O 5718b7c51e5a1c4ddcd1ffd9c50431e3 [0,2,0,0,0,0|2,0,0]=4 12307 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)C)C e16bfad94ab5da3f8fe292201919962c [0,2,0,0,0,0|2,0,0]=4 12308 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Cl)C 252c740ec6ea31bab22a8f1bef6f871c [0,2,0,0,0,0|2,0,0]=4 12309 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Cl)Cl 9affc370e23f4c368b374061df217e87 [0,2,0,0,0,0|2,0,0]=4 12310 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Cl)F 8aa9ed8647add6284359f465abe80edc [0,2,0,0,0,0|2,0,0]=4 12311 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)Cl)O 4d3f0147c68d57ec5d5f6c1a091e6034 [0,2,0,0,0,0|2,0,0]=4 12312 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)F)C 566b1227b7dca18625ea13fd80754961 [0,2,0,0,0,0|2,0,0]=4 12313 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)F)F dacbf845606078fd6bd4d07a92ab7fae [0,2,0,0,0,0|2,0,0]=4 12314 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)F)O 510c343f3bb44951d120bc3a98cb2c99 [0,2,0,0,0,0|2,0,0]=4 12315 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)I)Br d3de4ed3815ce3e203bc4b545c88050a [0,2,0,0,0,0|2,0,0]=4 12316 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)I)C 3385f4ee1e46aa7792d4f2955a189e84 [0,2,0,0,0,0|2,0,0]=4 12317 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)I)Cl 073590966ad17f4fdb13f61daac460a6 [0,2,0,0,0,0|2,0,0]=4 12318 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)I)F e62696781ff514418f8eacf263767b3d [0,2,0,0,0,0|2,0,0]=4 12319 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)I)I 8ea7d9b26ff121d1cbf99a8c8f3c2e40 [0,2,0,0,0,0|2,0,0]=4 12320 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)I)O 1d698aa0a3eacfc3f738fe5c138ab115 [0,2,0,0,0,0|2,0,0]=4 12321 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)O)C 3522c24607b5e26e39bed2657097cb1f [0,2,0,0,0,0|2,0,0]=4 12322 B17R1.9253 COCCCCNC(=O)c1cc(cc(c1)O)O 6b840aac15c9c74fbd5cb40a6e202794 [0,2,0,0,0,0|2,0,0]=4 12323 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Br)Br f414307edc6acf1d5fe8ec2331266493 [0,2,0,0,0,0|2,0,0]=4 12324 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Br)C ee12bd1acb0df363aa24636cae4a4e75 [0,2,0,0,0,0|2,0,0]=4 12325 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Br)Cl 6460e79282df17bdfe463b6ff01dd964 [0,2,0,0,0,0|2,0,0]=4 12326 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Br)F 3f767c5eb257f5e87db793bf894d8f24 [0,2,0,0,0,0|2,0,0]=4 12327 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Br)O 565ab6d71e1a3b06279b710c7993687b [0,2,0,0,0,0|2,0,0]=4 12328 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)C)C 9dbf9896e3f371323e6aa02991d1157a [0,2,0,0,0,0|2,0,0]=4 12329 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Cl)C 6b6f9a4272ae73c01826849eefb4244f [0,2,0,0,0,0|2,0,0]=4 12330 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Cl)Cl 47db0dbd94e4b5fa4b889b370231477c [0,2,0,0,0,0|2,0,0]=4 12331 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Cl)F 496e8f72be143dd7db40e34d8e569c46 [0,2,0,0,0,0|2,0,0]=4 12332 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)Cl)O f32e7d57f4e88013ec410ea277e280ca [0,2,0,0,0,0|2,0,0]=4 12333 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)F)C e22c6c60f0f2e0faeb09d472583b7511 [0,2,0,0,0,0|2,0,0]=4 12334 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)F)F a0dbefdb08417ebcd57b39f7ee4d6597 [0,2,0,0,0,0|2,0,0]=4 12335 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)F)O 28c1d12d829fad3705f2f8a6239e858e [0,2,0,0,0,0|2,0,0]=4 12336 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)I)Br 86d68a42d203115bfa1b543bc1eb9ea2 [0,2,0,0,0,0|2,0,0]=4 12337 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)I)C 0fb7986866aefa37cbdc695433db4e82 [0,2,0,0,0,0|2,0,0]=4 12338 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)I)Cl 1999b20c4a894c5d00dc2abf2ef100ba [0,2,0,0,0,0|2,0,0]=4 12339 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)I)F 9fb4acabe6294755fa81a1d4daf8e472 [0,2,0,0,0,0|2,0,0]=4 12340 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)I)I 852ad78025aa771241e77d1c56bc44f5 [0,2,0,0,0,0|2,0,0]=4 12341 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)I)O 27e3eccd1bbf10d358d9c9e47448c9e3 [0,2,0,0,0,0|2,0,0]=4 12342 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)O)C d69e9ba3e088e50a2856b0c143142959 [0,2,0,0,0,0|2,0,0]=4 12343 B17R1.9253 CSCCCCNC(=O)c1cc(cc(c1)O)O 97c84cdd54138f9d36c2fe41c97d2860 [0,2,0,0,0,0|2,0,0]=4 12344 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCCl)Br 18ff511c421c166961937d56a221d701 [0,2,0,0,0,0|2,0,0]=4 12345 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCCl)C a988aba667424989ee8339cad50eb3ae [0,2,0,0,0,0|2,0,0]=4 12346 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCCl)Cl 8e4f532fe467ac9952d1fa8cff73d992 [0,2,0,0,0,0|2,0,0]=4 12347 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCCl)F c8d2533fdd980280d4cdd85f6f1814c6 [0,2,0,0,0,0|2,0,0]=4 12348 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCCl)I 30ea14059a31f657b2920890c9c565a4 [0,2,0,0,0,0|2,0,0]=4 12349 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCCl)O b96cfd4ac087b2232ca15f472c68f320 [0,2,0,0,0,0|2,0,0]=4 12350 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCO)Br 8ed4916a7785393b40f4954b937a5aa9 [0,2,0,0,0,0|2,0,0]=4 12351 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCO)C 4a1f32ab2ce2a57b5af04bc383c0e885 [0,2,0,0,0,0|2,0,0]=4 12352 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCO)Cl 38852ff4452f3657a0dc85be4b7ec04c [0,2,0,0,0,0|2,0,0]=4 12353 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCO)F ea99fb91e4ca155c85389d09dc1a79f9 [0,2,0,0,0,0|2,0,0]=4 12354 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCO)I 7364c74a6b339bcf446814c9c24a3f33 [0,2,0,0,0,0|2,0,0]=4 12355 B17R1.9253 Cc1cc(cc(c1)C(=O)NCCCCCO)O 394d0e006ff579144cdfed71b363286b [0,2,0,0,0,0|2,0,0]=4 12356 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Br)Br 0a9d591bd7b5ae49fbb67ab920f6758d [0,2,0,0,0,0|2,0,0]=4 12357 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Br)Cl 6b46a451875f3c7ae026068bf9ce0d01 [0,2,0,0,0,0|2,0,0]=4 12358 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Br)F c2ac100b27c186dc7cfe0dcd4ecb7637 [0,2,0,0,0,0|2,0,0]=4 12359 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Br)O 916fbaf8fc9be5c5e6265ddc7ee735b9 [0,2,0,0,0,0|2,0,0]=4 12360 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Cl)Cl bb243b1074344a8de7f6770592b81bea [0,2,0,0,0,0|2,0,0]=4 12361 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Cl)F d856232413b4380fd2f433f6b74d6ffd [0,2,0,0,0,0|2,0,0]=4 12362 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)Cl)O f8f537e431eecfcc005c720a8dbdc175 [0,2,0,0,0,0|2,0,0]=4 12363 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)F)F db13243a178e648e97b46d01d5cc4d54 [0,2,0,0,0,0|2,0,0]=4 12364 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)F)O 79d64249b4280675a02db0387998b7f7 [0,2,0,0,0,0|2,0,0]=4 12365 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)I)Br 74ad503a6b73434d22b52a15b09faeb4 [0,2,0,0,0,0|2,0,0]=4 12366 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)I)Cl 4d5ed88ff53ef13cc853956926c864f9 [0,2,0,0,0,0|2,0,0]=4 12367 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)I)F 11cc5a19d58b0e5b855830185bfd0001 [0,2,0,0,0,0|2,0,0]=4 12368 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)I)I 68573d22bb0b192cd9a30fa84d562458 [0,2,0,0,0,0|2,0,0]=4 12369 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)I)O 6db9170a2a0d60daf63df3f1d0abce4c [0,2,0,0,0,0|2,0,0]=4 12370 B17R1.9253 O=C(NCCCCCCl)c1cc(cc(c1)O)O e33e931bb9f779358bb3b0ac509f6282 [0,2,0,0,0,0|2,0,0]=4 12371 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Br)Br d597deb7f7951302acd716b1123e93ae [0,2,0,0,0,0|2,0,0]=4 12372 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Br)Cl c58029886b07c9e9b099f2279d40061f [0,2,0,0,0,0|2,0,0]=4 12373 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Br)F ac1e85f429165781dd6e25ae48d6ff09 [0,2,0,0,0,0|2,0,0]=4 12374 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Br)O 3d0e96f9ed6c80c5853ee7679248a5ba [0,2,0,0,0,0|2,0,0]=4 12375 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Cl)Cl 82a8a965959ce01c7d64334537925520 [0,2,0,0,0,0|2,0,0]=4 12376 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Cl)F 3d52bc17da76b5dbf61fb85bb4ee17fc [0,2,0,0,0,0|2,0,0]=4 12377 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)Cl)O d12adb44e14f478b0871351255d8a702 [0,2,0,0,0,0|2,0,0]=4 12378 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)F)F ee4f4f4ef37e9d96d62dd6a403891c25 [0,2,0,0,0,0|2,0,0]=4 12379 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)F)O 907eb9801d62f602e15a67b3ee08c639 [0,2,0,0,0,0|2,0,0]=4 12380 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)I)Br 5756ba0628fb460e782f2d91923ab281 [0,2,0,0,0,0|2,0,0]=4 12381 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)I)Cl 9b682ce6b977f6fb051ad6abaeeddb06 [0,2,0,0,0,0|2,0,0]=4 12382 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)I)F 61fd4b5a934ec27d7cba967805e06ebc [0,2,0,0,0,0|2,0,0]=4 12383 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)I)I bada256f4969ffead101c3d651bb35ac [0,2,0,0,0,0|2,0,0]=4 12384 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)I)O 1b4551f52c175d77a44b1ae87365763d [0,2,0,0,0,0|2,0,0]=4 12385 B17R1.9253 O=C(NCCCCCO)c1cc(cc(c1)O)O 553c5cbd9a592237a340b09685545dfa [0,2,0,0,0,0|2,0,0]=4 12386 B17R1.9264 C#Cc1cc(ccn1)C(=O)NCCCCCC e8b1135bdabd86407e965d9463821d34 [0,2,0,0,0,0|2,0,0]=4 12387 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCCCCC 96b5d7285376dfe068dba64d0a17ad12 [0,2,0,0,0,0|1,0,0]=3 12388 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCCCCCl 05b71367b4b0bab9f72c3b5fe9135fb5 [0,2,0,0,0,0|2,0,0]=4 12389 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCCCCO 15ffe73e9825e15b9ddc8fcca37d9e3c [0,2,0,0,0,0|2,0,0]=4 12390 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCCCOC d3c36441fa7c001da61f3cceb52a330b [0,2,0,0,0,0|2,0,0]=4 12391 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCCCSC c18e601a6f1a8d71dfdb8006b1c3119d [0,2,0,0,0,0|2,0,0]=4 12392 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCCOCC ee8e0dd772d03334d6fc70dd43d2ba55 [0,2,0,0,0,0|2,0,0]=4 12393 B17R1.9264 C#Cc1cccc(c1)C(=O)NCCOCCC b3a644256c26cd97ec38c253ea095fac [0,2,0,0,0,0|2,0,0]=4 12394 B17R1.9264 C#Cc1ccnc(c1)C(=O)NCCCCCC f65fa90def6d342cee5333b073846751 [0,2,0,0,0,0|2,0,0]=4 12395 B17R1.9264 C#Cc1cncc(c1)C(=O)NCCCCCC 3ecce14f62e47fcce51912b8d187dece [0,2,0,0,0,0|2,0,0]=4 12396 B17R1.9264 C=Cc1cc(ccn1)C(=O)NCCCCCC 4c381e492b738783f44015d6c8b38615 [0,2,0,0,0,0|2,0,0]=4 12397 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCCCCC 6f89e698a71c338089bbb33dff168a81 [0,2,0,0,0,0|1,0,0]=3 12398 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCCCCCl 0a3912bd72c973cd577fa060a7045074 [0,2,0,0,0,0|2,0,0]=4 12399 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCCCCO 5e6e1913c2ff384c3df67735414149f0 [0,2,0,0,0,0|2,0,0]=4 12400 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCCCOC e7c3df9ead3e122724d90a99a7486180 [0,2,0,0,0,0|2,0,0]=4 12401 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCCCSC 763b4dd46d0a05290e3bad8b10052ef9 [0,2,0,0,0,0|2,0,0]=4 12402 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCCOCC c29fed4c6433450f54aae007ded81d5c [0,2,0,0,0,0|2,0,0]=4 12403 B17R1.9264 C=Cc1cccc(c1)C(=O)NCCOCCC fb80bb42e60d9bc11b50248e50ad54ad [0,2,0,0,0,0|2,0,0]=4 12404 B17R1.9264 CCCCCCNC(=O)c1cc(ccn1)C#N 20eeb2cfcfb509e9d01307aee024d3d3 [0,2,0,0,0,0|2,0,0]=4 12405 B17R1.9264 CCCCCCNC(=O)c1cc(ccn1)C=O f1c03838e6bb19f87301be44312e260f [0,2,0,0,0,0|2,0,0]=4 12406 B17R1.9264 CCCCCCNC(=O)c1cc(ccn1)CC f190fcc065f9a4c0f3ab0a4f22efc9d7 [0,2,0,0,0,0|2,0,0]=4 12407 B17R1.9264 CCCCCCNC(=O)c1cc(ccn1)CO 5a89ee94aea45005edbaaff3d428a982 [0,2,0,0,0,0|2,0,0]=4 12408 B17R1.9264 CCCCCCNC(=O)c1cc(ccn1)OC 77423a78ba494b3552cb694ea42a8f11 [0,2,0,0,0,0|2,0,0]=4 12409 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)C#N 05962f1bf1ff0474d7fc65f14805f73a [0,2,0,0,0,0|1,0,0]=3 12410 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)C=O 768bb576a2015c42a8dd8fe68fe565c4 [0,2,0,0,0,0|1,0,0]=3 12411 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)CC bc3fca984239199322a8c7fb1d740cec [0,2,0,0,0,0|1,0,0]=3 12412 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)CO 4af388147258a6255726bdc1c997403c [0,2,0,0,0,0|1,0,0]=3 12413 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)CS 8a76a4da21ac43e260d86be0a4d093e6 [0,2,0,0,0,0|1,0,0]=3 12414 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)OC 6d83f630d5e70ba3f73ded1314ac92e5 [0,2,0,0,0,0|1,0,0]=3 12415 B17R1.9264 CCCCCCNC(=O)c1cccc(c1)SC db28b02aac0fcca098dfdb4513820690 [0,2,0,0,0,0|1,0,0]=3 12416 B17R1.9264 CCCCCCNC(=O)c1cccc(n1)C#N 16c4bf4364c6051df72abd52343cd18e [0,2,0,0,0,0|2,0,0]=4 12417 B17R1.9264 CCCCCCNC(=O)c1cccc(n1)C=O 8fe245e2e930f7c9eaff3346c40b4281 [0,2,0,0,0,0|2,0,0]=4 12418 B17R1.9264 CCCCCCNC(=O)c1cccc(n1)CC 32a4aab2750593c82e596e88746da4aa [0,2,0,0,0,0|2,0,0]=4 12419 B17R1.9264 CCCCCCNC(=O)c1cccc(n1)CO 4c7b8a09de669f0f0084820535a874f2 [0,2,0,0,0,0|2,0,0]=4 12420 B17R1.9264 CCCCCCNC(=O)c1cccc(n1)OC e5278767e54602ce0189f104c41143a2 [0,2,0,0,0,0|2,0,0]=4 12421 B17R1.9264 CCCCCCNC(=O)c1cccc(n1)SC 3114db4014f3709f1f73e05d0fbf2c39 [0,2,0,0,0,0|2,0,0]=4 12422 B17R1.9264 CCCCCCNC(=O)c1ccnc(c1)C#N d258a3e44934cf95a9cc307961f162c8 [0,2,0,0,0,0|2,0,0]=4 12423 B17R1.9264 CCCCCCNC(=O)c1ccnc(c1)C=O b345e0d8e85d9fa4f88f670aa4e830d9 [0,2,0,0,0,0|2,0,0]=4 12424 B17R1.9264 CCCCCCNC(=O)c1ccnc(c1)CC 912e39b103cfe64c46b3baaf341993f1 [0,2,0,0,0,0|2,0,0]=4 12425 B17R1.9264 CCCCCCNC(=O)c1ccnc(c1)CO 3fb57949c716651f345dbd90428b0a82 [0,2,0,0,0,0|2,0,0]=4 12426 B17R1.9264 CCCCCCNC(=O)c1ccnc(c1)OC b2648e800158dc9d6fb67c49b56c1f2f [0,2,0,0,0,0|2,0,0]=4 12427 B17R1.9264 CCCCCCNC(=O)c1ccnc(c1)SC 303c18ea4aabd4408fa6342b1ab0ab58 [0,2,0,0,0,0|2,0,0]=4 12428 B17R1.9264 CCCCCCNC(=O)c1cncc(c1)C#N e0ff010d4f782f1eaa11c29f1c2092b7 [0,2,0,0,0,0|2,0,0]=4 12429 B17R1.9264 CCCCCCNC(=O)c1cncc(c1)C=O cfee6710450efc7d7df78e45e68a17a1 [0,2,0,0,0,0|2,0,0]=4 12430 B17R1.9264 CCCCCCNC(=O)c1cncc(c1)CC c8dfcb7f3600bf798e4772f29fae60c1 [0,2,0,0,0,0|2,0,0]=4 12431 B17R1.9264 CCCCCCNC(=O)c1cncc(c1)CO f192b8e3fb53cb8ec202f5d8ba7e0148 [0,2,0,0,0,0|2,0,0]=4 12432 B17R1.9264 CCCCCCNC(=O)c1cncc(c1)OC ed43d82c62da6a608a3fb5737381f471 [0,2,0,0,0,0|2,0,0]=4 12433 B17R1.9264 CCCCCCNC(=O)c1cncc(c1)SC c3b4f0ddc674b378aca93e62852baeca [0,2,0,0,0,0|2,0,0]=4 12434 B17R1.9264 CCCCCCOC(C)c1cccc(c1)C#N 240469cbc6128b2e0e88963cb2d5b91c [0,2,0,0,0,0|1,0,1]=4 12435 B17R1.9264 CCCCCCOC(C)c1cccc(c1)C=O 4a47251a0dd2ac383913b22279f36aa6 [0,2,0,0,0,0|1,0,1]=4 12436 B17R1.9264 CCCCCCOC(C)c1cccc(c1)CC 90092ac0de0c300d9a1b41f00542f380 [0,2,0,0,0,0|1,0,1]=4 12437 B17R1.9264 CCCCCCOC(C)c1cccc(c1)OC 59832de74f1e1585853f87d411463dfa [0,2,0,0,0,0|1,0,1]=4 12438 B17R1.9264 CCCCCCOC(C)c1cccc(c1)SC ab64832f0a33f8c117273ee645b9feee [0,2,0,0,0,0|1,0,1]=4 12439 B17R1.9264 CCCCCCO[C@@H](C)c1cccc(c1)OC bc490d374f1b47f154dcadf1a4d898b9 [0,2,0,0,0,0|1,0,1]=4 12440 B17R1.9264 CCCCCCO[C@@H](C)c1cccc(c1)SC f50efb1feec4b73065b3c2009947766a [0,2,0,0,0,0|1,0,1]=4 12441 B17R1.9264 CCCCCCO[C@H](C)c1cccc(c1)OC 40dca25ac0c4f1c3b13645a4490e46e7 [0,2,0,0,0,0|1,0,1]=4 12442 B17R1.9264 CCCCCNCC(=O)c1cccc(c1)C#N f007cf9929e13c556742c25d76ac2433 [0,2,0,0,0,0|2,0,0]=4 12443 B17R1.9264 CCCCCNCC(=O)c1cccc(c1)CC b6f9749c243098e813b24548033363b3 [0,2,0,0,0,0|2,0,0]=4 12444 B17R1.9264 CCCCCNCC(=O)c1cccc(c1)OC 8cdd012a9d468f0749cfd2e2f01bb7e0 [0,2,0,0,0,0|2,0,0]=4 12445 B17R1.9264 CCCCCOCC(=O)c1cccc(c1)C#N cd332a14ae9a4edae5500dbc76a514b8 [0,2,0,0,0,0|2,0,0]=4 12446 B17R1.9264 CCCCCOCC(=O)c1cccc(c1)CC 476ebef6e41323694d33c37457bb701e [0,2,0,0,0,0|2,0,0]=4 12447 B17R1.9264 CCCCCOCC(=O)c1cccc(c1)OC 6f6d8c8de7313fc53f02cd9b517d8a7d [0,2,0,0,0,0|2,0,0]=4 12448 B17R1.9264 CCCNCCNC(=O)c1cccc(c1)C#N 6cba017ee4f0e32c2e673da2698acec7 [0,2,0,0,0,0|2,0,0]=4 12449 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)C#N dcfdc3fc2a581487d21acab48f085720 [0,2,0,0,0,0|2,0,0]=4 12450 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)C=O 1b9eb96768110423c35730cecf711f79 [0,2,0,0,0,0|2,0,0]=4 12451 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)CC 34601de21076f50ca91414cf95a16d4f [0,2,0,0,0,0|2,0,0]=4 12452 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)CO 5929843b99ea6864d1890255844005a7 [0,2,0,0,0,0|2,0,0]=4 12453 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)CS a7e92b7d7a65a97fa4e6e680e9acadb6 [0,2,0,0,0,0|2,0,0]=4 12454 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)OC 1c9d7466399d1020cceb515d1a8eb6cb [0,2,0,0,0,0|2,0,0]=4 12455 B17R1.9264 CCCOCCNC(=O)c1cccc(c1)SC a3d04606f77406a05b29147646f0896d [0,2,0,0,0,0|2,0,0]=4 12456 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)C#N e93ac12b0d40ddd9b59d6dda8080dd29 [0,2,0,0,0,0|2,0,0]=4 12457 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)C=O 5adaed1f6e230ea295251a5384694d19 [0,2,0,0,0,0|2,0,0]=4 12458 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)CC cbb7d027860724eb9fe47824a5088565 [0,2,0,0,0,0|2,0,0]=4 12459 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)CO e14d8a866125087e0d129fc91f104366 [0,2,0,0,0,0|2,0,0]=4 12460 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)CS 418a6b68f1c6df225ae7dfaf8d3abdea [0,2,0,0,0,0|2,0,0]=4 12461 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)OC 3886d3b3dca5a99b29bfa33d9fba99d7 [0,2,0,0,0,0|2,0,0]=4 12462 B17R1.9264 CCOCCCNC(=O)c1cccc(c1)SC c241728acde78d18b0b086be2a1f96ac [0,2,0,0,0,0|2,0,0]=4 12463 B17R1.9264 CCc1cccc(c1)C(=O)NCCCCCCl 0432de7379838345c1618db9ef33a86b [0,2,0,0,0,0|2,0,0]=4 12464 B17R1.9264 CCc1cccc(c1)C(=O)NCCCCCO 0ed1e20f8c7bebac403fc97b5785b41c [0,2,0,0,0,0|2,0,0]=4 12465 B17R1.9264 CCc1cccc(c1)C(=O)NCCCCOC 25c0b8d04e2a367967ff44e4ed3e3861 [0,2,0,0,0,0|2,0,0]=4 12466 B17R1.9264 CCc1cccc(c1)C(=O)NCCCCSC 02b4087f1cce8220e01109a82f53a060 [0,2,0,0,0,0|2,0,0]=4 12467 B17R1.9264 COCCCCNC(=O)c1cccc(c1)C#N 9c3cf91fb2fef7355722044028d83659 [0,2,0,0,0,0|2,0,0]=4 12468 B17R1.9264 COCCCCNC(=O)c1cccc(c1)C=O 30d55cb0613d54c63738e5c15d738d62 [0,2,0,0,0,0|2,0,0]=4 12469 B17R1.9264 COCCCCNC(=O)c1cccc(c1)CO 50161f3576f0f79fb1b6e467254298c2 [0,2,0,0,0,0|2,0,0]=4 12470 B17R1.9264 COCCCCNC(=O)c1cccc(c1)CS e689828d59d5fab5ec053deb0317d4ee [0,2,0,0,0,0|2,0,0]=4 12471 B17R1.9264 COCCCCNC(=O)c1cccc(c1)OC 36ec0dd7dc8e8a5855d6c11dea4a9434 [0,2,0,0,0,0|2,0,0]=4 12472 B17R1.9264 COCCCCNC(=O)c1cccc(c1)SC 00b6407060838f52f7cd98d4478ab41a [0,2,0,0,0,0|2,0,0]=4 12473 B17R1.9264 COc1cccc(c1)C(=O)NCCCCCCl c4e9fc4b310d09430674fe3b05583184 [0,2,0,0,0,0|2,0,0]=4 12474 B17R1.9264 COc1cccc(c1)C(=O)NCCCCCO 8aa6b33e1e656b82c1de231da953023c [0,2,0,0,0,0|2,0,0]=4 12475 B17R1.9264 COc1cccc(c1)C(=O)NCCCCSC 9ba4e005ddffcae4513d22bc98271083 [0,2,0,0,0,0|2,0,0]=4 12476 B17R1.9264 CSCCCCNC(=O)c1cccc(c1)C#N ac4806bac16f8275ea46f066c7d569ea [0,2,0,0,0,0|2,0,0]=4 12477 B17R1.9264 CSCCCCNC(=O)c1cccc(c1)C=O 1124c4a122d448d4ff38a914f19df85e [0,2,0,0,0,0|2,0,0]=4 12478 B17R1.9264 CSCCCCNC(=O)c1cccc(c1)CO 7830d2555862fe2f2394936afa3bc91b [0,2,0,0,0,0|2,0,0]=4 12479 B17R1.9264 CSCCCCNC(=O)c1cccc(c1)CS 30d23731df48bfa02312d8cb6afffae3 [0,2,0,0,0,0|2,0,0]=4 12480 B17R1.9264 CSCCCCNC(=O)c1cccc(c1)SC c989577a483018e0bd0426555df8ea9e [0,2,0,0,0,0|2,0,0]=4 12481 B17R1.9264 CSc1cccc(c1)C(=O)NCCCCCCl 4cd729300f3d8773654bf40fe38538e2 [0,2,0,0,0,0|2,0,0]=4 12482 B17R1.9264 CSc1cccc(c1)C(=O)NCCCCCO b1099e4cd43591c798472b52c2236f27 [0,2,0,0,0,0|2,0,0]=4 12483 B17R1.9264 N#Cc1cccc(c1)C(=O)NCCCCCCl f54fd71317f10a688526944f381d53a3 [0,2,0,0,0,0|2,0,0]=4 12484 B17R1.9264 N#Cc1cccc(c1)C(=O)NCCCCCO 0101efa4ac0d68f449f8811fb114af92 [0,2,0,0,0,0|2,0,0]=4 12485 B17R1.9264 O=C(NCCCCCCl)c1cccc(c1)CO 32f373ecd4b325017a28596dbef02e98 [0,2,0,0,0,0|2,0,0]=4 12486 B17R1.9264 O=C(NCCCCCCl)c1cccc(c1)CS 637b40fe945d5e42e70287e5d3b55446 [0,2,0,0,0,0|2,0,0]=4 12487 B17R1.9264 O=C(NCCCCCO)c1cccc(c1)CO 74c6144e1532a5b5d71391e05ce4d64e [0,2,0,0,0,0|2,0,0]=4 12488 B17R1.9264 O=C(NCCCCCO)c1cccc(c1)CS 0ff284752c99ad7a772a0bec84459e85 [0,2,0,0,0,0|2,0,0]=4 12489 B17R1.9264 O=Cc1cccc(c1)C(=O)NCCCCCCl ee33dcac2ae00b3c4b7ab374eeed1b28 [0,2,0,0,0,0|2,0,0]=4 12490 B17R1.9264 O=Cc1cccc(c1)C(=O)NCCCCCO e8fc6aa78d299ed0aefae026ed4d3fbe [0,2,0,0,0,0|2,0,0]=4 12491 B17R1.14339 CC(C)CCCCOC(C)c1cccc(c1)Br 1dcb114f52ec973a33e34616a1542d74 [0,2,0,0,0,0|1,0,1]=4 12492 B17R1.14339 CC(C)CCCCOC(C)c1cccc(c1)Cl 7066bc856e5009b78107da745db05537 [0,2,0,0,0,0|1,0,1]=4 12493 B17R1.14339 CC(C)CCCCOC(C)c1cccc(c1)F a9004208ba37deced2de8da2109eea24 [0,2,0,0,0,0|1,0,1]=4 12494 B17R1.14339 CC(C)CCCCOC(C)c1cccc(c1)I c468cb7f346c936c103e2ba6767fbd28 [0,2,0,0,0,0|1,0,1]=4 12495 B17R1.14339 CC(C)CCCCO[C@@H](C)c1cccc(c1)Br a10153c1326ea390e88ea7dc546919d3 [0,2,0,0,0,0|1,0,1]=4 12496 B17R1.14339 CC(C)CCCCO[C@@H](C)c1cccc(c1)Cl 78e9b60c80a40c22b3c30290648c7aab [0,2,0,0,0,0|1,0,1]=4 12497 B17R1.14339 CC(C)CCCCO[C@@H](C)c1cccc(c1)F a097a5654287dc35cdad35de996db889 [0,2,0,0,0,0|1,0,1]=4 12498 B17R1.14339 CC(C)CCCCO[C@H](C)c1cccc(c1)Br a8474950ee25ba963934af4d99ef902e [0,2,0,0,0,0|1,0,1]=4 12499 B17R1.14339 CC(C)CCCCO[C@H](C)c1cccc(c1)Cl 0a8f2fba25e44170f3b791bd0dd2a712 [0,2,0,0,0,0|1,0,1]=4 12500 B17R1.14339 CC(C)CCCCO[C@H](C)c1cccc(c1)F df54cf60a64007e217558f6fd89aacb6 [0,2,0,0,0,0|1,0,1]=4 12501 B17R1.14339 CC(C)CCCNCC(=O)c1cccc(c1)Br 4fb9745ce0a0245cf54b8db452cb9d9a [0,2,0,0,0,0|2,0,0]=4 12502 B17R1.14339 CC(C)CCCNCC(=O)c1cccc(c1)Cl 56d1ad60a259355085d6fc2efce4a790 [0,2,0,0,0,0|2,0,0]=4 12503 B17R1.14339 CC(C)CCCNCC(=O)c1cccc(c1)F 30bac84209001b0e0be13acd1dc241ae [0,2,0,0,0,0|2,0,0]=4 12504 B17R1.14339 CC(C)CCCNCC(=O)c1cccc(c1)I 7daf6edfa1ecc69661eb75d8d8e37a21 [0,2,0,0,0,0|2,0,0]=4 12505 B17R1.14339 CC(C)CCCOCC(=O)c1cccc(c1)Br 15e2b97b57d3239fb5d6873d960d5e61 [0,2,0,0,0,0|2,0,0]=4 12506 B17R1.14339 CC(C)CCCOCC(=O)c1cccc(c1)Cl 26ed9aea1947dca22c3ecff776f1127e [0,2,0,0,0,0|2,0,0]=4 12507 B17R1.14339 CC(C)CCCOCC(=O)c1cccc(c1)F 9fc515f93d78551f4f0f40b0dd653f82 [0,2,0,0,0,0|2,0,0]=4 12508 B17R1.14339 CC(C)CCCOCC(=O)c1cccc(c1)I 15e8b2d45c91b6954c07086eba9566fb [0,2,0,0,0,0|2,0,0]=4 12509 B17R1.14339 CC(C)CNCCCC(=O)c1cccc(c1)F 3d3e2380604f2fcff5938039fd4fc4e0 [0,2,0,0,0,0|2,0,0]=4 12510 B17R1.14339 CC(C)COCCCC(=O)c1cccc(c1)F b6246c51ff527a9440c7d79dbf130a42 [0,2,0,0,0,0|2,0,0]=4 12511 B17R1.14339 CC(C)COCCNC(=O)c1cccc(c1)Br 8093c8f8f55ed6e5d875f21dcd82019c [0,2,0,0,0,0|2,0,0]=4 12512 B17R1.14339 CC(C)COCCNC(=O)c1cccc(c1)Cl 694782ed803b4feee67318dc7874ac02 [0,2,0,0,0,0|2,0,0]=4 12513 B17R1.14339 CC(C)NCCCNC(=O)c1cccc(c1)Br d7cec6479ab61b482a5e576ae31e9a32 [0,2,0,0,0,0|2,0,0]=4 12514 B17R1.14339 CC(C)OCCCNC(=O)c1cccc(c1)Br 195747d8cfc0610d79a641716f2872db [0,2,0,0,0,0|2,0,0]=4 12515 B17R1.14339 CC(C)OCCCNC(=O)c1cccc(c1)Cl 6c8842554dca927c518e09e4eb16ce1a [0,2,0,0,0,0|2,0,0]=4 12516 B17R1.14339 CC(C)OCCCNC(=O)c1cccc(c1)F ca68afecae588900233d27619000388f [0,2,0,0,0,0|2,0,0]=4 12517 B17R1.14339 CC(C)OCCCNC(=O)c1cccc(c1)I c5eb07935531f3ef0f42be611d082652 [0,2,0,0,0,0|2,0,0]=4 12518 B17R1.14339 CC(C)OCCCNC(=O)c1cccc(c1)O c6b7c53f44e17bb983ab8829ac0dc02a [0,2,0,0,0,0|2,0,0]=4 12519 B17R1.14339 CC(C)OCCCNC(=O)c1cccc(c1)S 82a3005845f6937975c113b00029d4d4 [0,2,0,0,0,0|2,0,0]=4 12520 B17R1.14339 CC(C)SCCCNC(=O)c1cccc(c1)Br 483d908ce08f2bc54c45373421a44c57 [0,2,0,0,0,0|2,0,0]=4 12521 B17R1.14339 CC(C)SCCCNC(=O)c1cccc(c1)Cl 0bab1127ace3fe997e79c5c6e63d660c [0,2,0,0,0,0|2,0,0]=4 12522 B17R1.14339 CC(C)SCCCNC(=O)c1cccc(c1)F 632084d8120b937d4d30ab4f7106b555 [0,2,0,0,0,0|2,0,0]=4 12523 B17R1.14339 CC(C)SCCCNC(=O)c1cccc(c1)I d3435ebacb9269d11d43c84b1488551e [0,2,0,0,0,0|2,0,0]=4 12524 B17R1.14339 CC(C)SCCCNC(=O)c1cccc(c1)O 1d0ac370ef7ae313e1edf7b3a0d59b36 [0,2,0,0,0,0|2,0,0]=4 12525 B17R1.14339 CC(C)SCCCNC(=O)c1cccc(c1)S 3805a9a4482360f4d336d0c900a595e6 [0,2,0,0,0,0|2,0,0]=4 12526 B17R1.14339 CC(F)COCCCC(=O)c1cccc(c1)F 5896ab6d4204441ebda8dfaa836403dc [0,2,0,0,0,0|2,0,0]=4 12527 B17R1.14339 CC(O)CNCCCC(=O)c1cccc(c1)F b516ce50e3b54e66f84cde2f58fb064b [0,2,0,0,0,0|2,0,0]=4 12528 B17R1.14339 CC(S)COCCCC(=O)c1cccc(c1)F b2b56c22fce5dc20e57b5aa9e379875f [0,2,0,0,0,0|2,0,0]=4 12529 B17R1.14339 CN(C)CCCCNC(=O)c1cccc(c1)Br 1f70dcd355a8c8defcb83e5e166bc38b [0,2,0,0,0,0|2,0,0]=4 12530 B17R1.14339 CN(C)CCCCNC(=O)c1cccc(c1)Cl 7cdc278b8efed74e45c2a86e318eeb0b [0,2,0,0,0,0|2,0,0]=4 12531 B17R1.14339 CN(C)CCCCNC(=O)c1cccc(c1)F 2bdf58b949a50eb21a199749e240555e [0,2,0,0,0,0|2,0,0]=4 12532 B17R1.14339 CN(C)CCCCNC(=O)c1cccc(c1)I d2ed7ea18b87ea0e1a2954fb74548eea [0,2,0,0,0,0|2,0,0]=4 12533 B17R1.14339 CN(C)CCCCNC(=O)c1cccc(c1)O 7512b63c54f76c7344b1c79d5e273b85 [0,2,0,0,0,0|2,0,0]=4 12534 B17R1.14339 CN(C)CCCCNC(=O)c1cccc(c1)S 4895d5fbe8ee013c95606f4e8debe036 [0,2,0,0,0,0|2,0,0]=4 12535 B17R1.14339 C[C@@H](F)COCCCC(=O)c1cccc(c1)F d94cb8766e4921893e10b98c933da9fa [0,2,0,0,0,0|2,0,0]=4 12536 B17R1.14339 C[C@@H](O)CNCCCC(=O)c1cccc(c1)F bbda16c9f71b2abcb88ff84d89753809 [0,2,0,0,0,0|2,0,0]=4 12537 B17R1.14339 C[C@H](F)COCCCC(=O)c1cccc(c1)F 294e1fb4bc2d3ec5c157052c9e1f532b [0,2,0,0,0,0|2,0,0]=4 12538 B17R1.14339 C[C@H](O)CNCCCC(=O)c1cccc(c1)F 08ac332ad1770081fa83e2a818957c0f [0,2,0,0,0,0|2,0,0]=4 12539 B17R1.14339 Cc1cccc(c1)C(=O)CCCNCC(C)C c4002fcc48233080a0ecb610b6c1a06d [0,2,0,0,0,0|2,0,0]=4 12540 B17R1.14339 Cc1cccc(c1)C(=O)CCCNCC(C)O 5de82bf13409adb952fb6702ce51a987 [0,2,0,0,0,0|2,0,0]=4 12541 B17R1.14339 Cc1cccc(c1)C(=O)CCCNC[C@@H](C)O f3546e5f1a8fc2910b8aa2e0b2dc2cd4 [0,2,0,0,0,0|2,0,0]=4 12542 B17R1.14339 Cc1cccc(c1)C(=O)CCCNC[C@H](C)O 82e217174e0ddfce7112cb79ab361899 [0,2,0,0,0,0|2,0,0]=4 12543 B17R1.14339 Cc1cccc(c1)C(=O)CNCCCC(C)C 0d235036ee5f24ef57ceca1097d82681 [0,2,0,0,0,0|2,0,0]=4 12544 B17R1.14339 Cc1cccc(c1)C(=O)COCCCC(C)C 9f29913ba62a8a67a50b53e6296df646 [0,2,0,0,0,0|2,0,0]=4 12545 B17R1.14339 Cc1cccc(c1)C(=O)NCCCCC(F)F 430114bc72d225cedf9056dea7842aca [0,2,0,0,0,0|2,0,0]=4 12546 B17R1.14339 Cc1cccc(c1)C(=O)NCCCCN(C)C 770016722cd7ba3b3fc3b056c7591bcd [0,2,0,0,0,0|2,0,0]=4 12547 B17R1.14339 Cc1cccc(c1)C(=O)NCCCOC(C)C f3a016b202f2ca1ef17f67cbce2b149b [0,2,0,0,0,0|2,0,0]=4 12548 B17R1.14339 Cc1cccc(c1)C(=O)NCCCSC(C)C 141a9168575af750510e9977aa4e3195 [0,2,0,0,0,0|2,0,0]=4 12549 B17R1.14339 Cc1cccc(c1)C(=O)NCCOCC(C)C dc0221adb3951ac51770adf4192199ee [0,2,0,0,0,0|2,0,0]=4 12550 B17R1.14339 Cc1cccc(c1)C(=O)NCOCCC(C)C 97a75e8afaa6362e82553ad3c9724bc4 [0,2,0,0,0,0|2,0,0]=4 12551 B17R1.14339 Cc1cccc(c1)C(C)OCCCCC(C)C 14c75e7d9cfa9c2f5a7335a527a6cdfd [0,2,0,0,0,0|1,0,1]=4 12552 B17R1.14339 Cc1cccc(c1)[C@@H](C)OCCCCC(C)C 0ac073546cc5eafc380a7b5a3dd2becd [0,2,0,0,0,0|1,0,1]=4 12553 B17R1.14339 Cc1cccc(c1)[C@H](C)OCCCCC(C)C b509dc7ed06d07e2103f868b3befd81a [0,2,0,0,0,0|1,0,1]=4 12554 B17R1.14339 O=C(NCCCCC(F)F)c1cccc(c1)Br a013bfc0ce55db588034571ba848e94c [0,2,0,0,0,0|2,0,0]=4 12555 B17R1.14339 O=C(NCCCCC(F)F)c1cccc(c1)Cl d41915eb18951f9e705b1adee51ae163 [0,2,0,0,0,0|2,0,0]=4 12556 B17R1.14339 O=C(NCCCCC(F)F)c1cccc(c1)F 4b8ab4f0a8ddb9910331216501a9457f [0,2,0,0,0,0|2,0,0]=4 12557 B17R1.14339 O=C(NCCCCC(F)F)c1cccc(c1)I f7a540b51db1a8f62c48deb9f7269e00 [0,2,0,0,0,0|2,0,0]=4 12558 B17R1.14339 O=C(NCCCCC(F)F)c1cccc(c1)O fbc83f98d333f21ad5989ba3a8c0137a [0,2,0,0,0,0|2,0,0]=4 12559 B17R1.14339 O=C(NCCCCC(F)F)c1cccc(c1)S ffb0304736e38ffcc1785591f05dc6c1 [0,2,0,0,0,0|2,0,0]=4 12560 B17R1.1327 CC(C)CCC(C)COC(C)c1ccccc1 bf5a499d6e64cf03c964e7b0086bda86 [0,2,0,0,0,0|1,0,1]=4 12561 B17R1.1327 CC(C)CCC(C)CO[C@@H](C)c1ccccc1 2a672440636e56799c51e76f39354ec8 [0,2,0,0,0,0|1,0,1]=4 12562 B17R1.1327 CC(C)CCC(C)CO[C@H](C)c1ccccc1 1c4d7f45a81c8f9661e8a0760e6e0fd8 [0,2,0,0,0,0|1,0,1]=4 12563 B17R1.1327 CC(C)CCC(C)NCC(=O)c1ccccc1 b3a739f1119841c893d715068f28897a [0,2,0,0,0,0|2,0,0]=4 12564 B17R1.1327 CC(C)CCC(C)OCC(=O)c1ccccc1 c18ae2788ce5121e6e40f631ff83775e [0,2,0,0,0,0|2,0,0]=4 12565 B17R1.1327 CC(C)CCN(C)COC(=O)c1ccccc1 005b1cdc0aa0d826b21a78aaeea14289 [0,2,0,0,0,0|1,0,0]=3 12566 B17R1.1327 CC(C)COC(C)CNC(=O)c1ccccc1 f74586f8f274a9a7c7aa60b9533f2154 [0,2,0,0,0,0|2,0,0]=4 12567 B17R1.1327 CC(C)OCC(O)CNC(=O)c1ccccc1 1cccc1ba5f00cd895ebf4feb2d036337 [0,2,0,0,0,0|2,0,0]=4 12568 B17R1.1327 CC(O)CCN(C)COC(=O)c1ccccc1 7c1982200c5965d6699628a15731ff5b [0,2,0,0,0,0|1,0,0]=3 12569 B17R1.1327 CN(C)CCN(C)COC(=O)c1ccccc1 dd47664f8cf20c661282285137251cbf [0,2,0,0,0,0|2,0,0]=4 12570 B17R1.1327 CN(CCC(F)F)COC(=O)c1ccccc1 fdfbbd97117cf9c20072d9d037fa143b [0,2,0,0,0,0|2,0,0]=4 12571 B17R1.1329 CC(C)CCCNC(=O)C(=O)c1ccccc1 6454e92dfbdb88cc2a7ac08b7a3452d8 [0,2,0,0,0,0|2,0,0]=4 12572 B17R1.2579 C#CC(OCCCCC(C)C)c1ccccc1 b92c2af61bffad4d0ef271abdb564632 [0,2,0,0,0,0|1,0,1]=4 12573 B17R1.2579 C#C[C@@H](OCCCCC(C)C)c1ccccc1 2481a6145e8dbd31c88e39d79d0b4996 [0,2,0,0,0,0|1,0,1]=4 12574 B17R1.2579 C#C[C@H](OCCCCC(C)C)c1ccccc1 85c6393cfee8253c878692219b21faa2 [0,2,0,0,0,0|1,0,1]=4 12575 B17R1.2579 C=CC(OCCCCC(C)C)c1ccccc1 b7a7424d24ba866a83311428e1b902f9 [0,2,0,0,0,0|1,0,1]=4 12576 B17R1.2579 CC(C)CCCCOC(C#N)c1ccccc1 09d06e9aca73abc1cddae9acc1b25de8 [0,2,0,0,0,0|1,0,1]=4 12577 B17R1.2579 CC(C)CCCCOC(CF)c1ccccc1 afbffd2adba5810a5fd5e8430da7a7e9 [0,2,0,0,0,0|1,0,1]=4 12578 B17R1.2579 CC(C)CCCCOC(CS)c1ccccc1 20a24faac22b99ac03813a719ccb1c89 [0,2,0,0,0,0|0,1,1]=4 12579 B17R1.2579 CC(C)CCCCO[C@@H](C#N)c1ccccc1 a2587f80da953ce32d1c0caba01b055a [0,2,0,0,0,0|1,0,1]=4 12580 B17R1.2579 CC(C)CCCCO[C@H](CF)c1ccccc1 8bd0e59ab96de3290d477ed6f30a93ba [0,2,0,0,0,0|1,0,1]=4 12581 B17R1.2579 CC(C)CCCO/C=C(\C=O)/c1ccccc1 272c09ae10a91448829a9d543edaa8bb [0,2,0,0,0,0|2,0,0]=4 12582 B17R1.2579 CC(C)COCCOC(C=O)c1ccccc1 db2750b5de92b35727675832d9b1b8a5 [0,2,0,0,0,0|1,0,1]=4 12583 B17R1.2579 CCC(OCCCCC(C)C)c1ccccc1 42a3e77dd75c07df7ad7999acb1469b7 [0,2,0,0,0,0|1,0,1]=4 12584 B17R1.2579 CC[C@@H](OCCCCC(C)C)c1ccccc1 1fb9d8f0bf7554edf2543c2cae907188 [0,2,0,0,0,0|1,0,1]=4 12585 B17R1.2579 CC[C@H](OCCCCC(C)C)c1ccccc1 d07b1ea86a9bcc9af8e05ea2fbb94d51 [0,2,0,0,0,0|1,0,1]=4 12586 B17R1.2579 CN(C)CCCCOC(C=O)c1ccccc1 52b84ec371af283a528b7dcc8291d193 [0,2,0,0,0,0|1,0,1]=4 12587 B17R1.4483 CC(=O)C(C)COCOC(=O)c1ccccc1 e57d61bf357d1c18eb5dc23bc3d1e9af [0,2,0,0,0,0|1,0,1]=4 12588 B17R1.4483 CC(=O)C(C)OCCOC(=O)c1ccccc1 1ae89db521514e9d4ef40f65081c9c60 [0,2,0,0,0,0|1,0,1]=4 12589 B17R1.4483 CC(C)C(C)CCOCC(=O)c1ccccc1 ba48db538e5daf84dbe65115425c107f [0,2,0,0,0,0|2,0,0]=4 12590 B17R1.4483 CC(C)C(C)COCCC(=O)c1ccccc1 a08a071488df2d9db09d186c1340a59f [0,2,0,0,0,0|2,0,0]=4 12591 B17R1.4483 CC(C)C(C)COCNC(=O)c1ccccc1 96761786f1dbcc5539ef656ae7d50cab [0,2,0,0,0,0|2,0,0]=4 12592 B17R1.4483 CC(C)C(C)COCOC(=O)c1ccccc1 5a626ec86f7ca5b7ff3303086c700690 [0,2,0,0,0,0|1,0,0]=3 12593 B17R1.4483 CC(C)C(C)NCCOC(=O)c1ccccc1 fb91b91f2d66e36d10962d32df0a4fb0 [0,2,0,0,0,0|1,0,0]=3 12594 B17R1.4483 CC(C)C(C)OCCCC(=O)c1ccccc1 8062d92e585563b49c31a40a9bd1c192 [0,2,0,0,0,0|2,0,0]=4 12595 B17R1.4483 CC(C)C(C)OCCNC(=O)c1ccccc1 2e87fc3b4cb8e5aaf5b2e445383c5d7a [0,2,0,0,0,0|2,0,0]=4 12596 B17R1.4483 CC(C)C(C)OCCOC(=O)c1ccccc1 4c95ee2d510b696c265824cb2201dba0 [0,2,0,0,0,0|1,0,0]=3 12597 B17R1.4483 CC(C)C(C)OCCOC(=O)c1cccnc1 741049b98b1e86aeb0b2c4b5a5993aeb [0,2,0,0,0,0|2,0,0]=4 12598 B17R1.4483 CC(C)C(O)CNCOC(=O)c1ccccc1 3e91fe6e71e5587f81b3dd84160149d3 [0,2,0,0,0,0|1,0,0]=3 12599 B17R1.4483 CC(C)[C@@H](C)NCCOC(=O)c1ccccc1 eb9ce2f2c1a6b05f68c4ecd0721e0b00 [0,2,0,0,0,0|1,0,0]=3 12600 B17R1.4483 CC(C)[C@@H](C)OCCOC(=O)c1ccccc1 95dfa232ae90969fe2502143ecbd62bd [0,2,0,0,0,0|1,0,0]=3 12601 B17R1.4483 CC(C)[C@H](C)NCCOC(=O)c1ccccc1 bf20c9bf00f27400acbf6330dace59ac [0,2,0,0,0,0|1,0,0]=3 12602 B17R1.4483 CC(C)[C@H](C)OCCOC(=O)c1ccccc1 0d2c6a361a31bf3f9d1e03d80d98cacd [0,2,0,0,0,0|1,0,0]=3 12603 B17R1.4483 CC(CNCOC(=O)c1ccccc1)N(C)C a123fe33f134d5be8ddb127aa50fa612 [0,2,0,0,0,0|2,0,0]=4 12604 B17R1.4483 CC(COCOC(=O)c1ccccc1)N(C)C df53d2ae681f13e38e3c6efb6e94a23c [0,2,0,0,0,0|2,0,0]=4 12605 B17R1.4483 CC(O)C(C)NCCNC(=O)c1ccccc1 4b9fd4ea75bac66ca328169a78f9487c [0,2,0,0,0,0|2,0,0]=4 12606 B17R1.4483 CC(O)C(C)NCCOC(=O)c1ccccc1 a75a36c21afa46f4540d0a5c15a468b5 [0,2,0,0,0,0|1,0,0]=3 12607 B17R1.4483 CC(OCCOC(=O)c1ccccc1)C(F)F 81b5fd14999508f2a523c204b944ab70 [0,2,0,0,0,0|2,0,0]=4 12608 B17R1.4483 C[C@@H](COCOC(=O)c1ccccc1)N(C)C 6fcfc8dc179e9a6d1ce79d61f362f3be [0,2,0,0,0,0|2,0,0]=4 12609 B17R1.4483 C[C@@H](NCCOC(=O)c1ccccc1)C(F)F 56608ab929d656bab0e688318c8390cd [0,2,0,0,0,0|2,0,0]=4 12610 B17R1.4483 C[C@H](COCOC(=O)c1ccccc1)N(C)C 183d666cce6c892dcdae532995be219a [0,2,0,0,0,0|2,0,0]=4 12611 B17R1.4483 C[C@H](NCCOC(=O)c1ccccc1)C(F)F 58325f4f893d1806f1e30efb96f9afdf [0,2,0,0,0,0|2,0,0]=4 12612 B17R1.4483 O=C(OCNCC(O)C(F)F)c1ccccc1 faf5aef7523dd70bd2b937b3a718d181 [0,2,0,0,0,0|2,0,0]=4 12613 B17R1.8305 CC(C)CC(C)COCC(=O)c1ccccc1 390296675f938b8ec705997bceb9034f [0,2,0,0,0,0|2,0,0]=4 12614 B17R1.8305 CC(C)CC(C)NCOC(=O)c1ccccc1 e775dc968228e971874139dbe1125f9d [0,2,0,0,0,0|1,0,0]=3 12615 B17R1.8305 CC(C)CC(C)OCCC(=O)c1ccccc1 19bd55ef4f084937cb1645c6810ba255 [0,2,0,0,0,0|2,0,0]=4 12616 B17R1.8305 CC(C)CC(C)OCNC(=O)c1ccccc1 59b2b79e6ab530a5251392da005b388a [0,2,0,0,0,0|2,0,0]=4 12617 B17R1.8305 CC(C)CC(C)OCOC(=O)c1ccccc1 f5efaa18c400ef9d89acaab7ab87d65b [0,2,0,0,0,0|1,0,0]=3 12618 B17R1.8305 CC(C)CC(O)CNCC(=O)c1ccccc1 ffab36e2eb7a52a380c6fca59f7d5249 [0,2,0,0,0,0|2,0,0]=4 12619 B17R1.8305 CC(C)CN(C)CCCC(=O)c1ccccc1 6771beee10375bf60def0011174fb841 [0,2,0,0,0,0|2,0,0]=4 12620 B17R1.8305 CC(C)CN(C)CCNC(=O)c1ccccc1 3c732a4401bb5b77230c6de6835bd374 [0,2,0,0,0,0|2,0,0]=4 12621 B17R1.8305 CC(C)CN(C)CCOC(=O)c1ccccc1 2c4ae0fc8605e52484a6d17261ecc68c [0,2,0,0,0,0|1,0,0]=3 12622 B17R1.8305 CC(C)C[C@@H](C)OCOC(=O)c1ccccc1 b265cc0243ec53a9c6bc0498a29a88b0 [0,2,0,0,0,0|1,0,0]=3 12623 B17R1.8305 CC(C)C[C@H](C)OCOC(=O)c1ccccc1 90e5e51ea750fb2d76f62eecad797dbd [0,2,0,0,0,0|1,0,0]=3 12624 B17R1.8305 CC(CN(C)C)NCOC(=O)c1ccccc1 3c2203164a8243bb15830a26786871bc [0,2,0,0,0,0|2,0,0]=4 12625 B17R1.8305 CC(CN(C)C)OCOC(=O)c1ccccc1 4ad06a99f3ef3e1bfa14a331d977bd21 [0,2,0,0,0,0|2,0,0]=4 12626 B17R1.8305 CC(O)CC(C)NCOC(=O)c1ccccc1 b2f731aa8e9139ac869a64a0f5618fd3 [0,2,0,0,0,0|1,0,0]=3 12627 B17R1.8305 CC(O)CN(C)CCCC(=O)c1ccccc1 e4efb02adfd0a91260680d2cd3341764 [0,2,0,0,0,0|2,0,0]=4 12628 B17R1.8305 CC(O)CN(C)CCOC(=O)c1ccccc1 51677ac493035d83850cfae61ad4e718 [0,2,0,0,0,0|1,0,0]=3 12629 B17R1.8305 CN(CCOC(=O)c1ccccc1)CC(F)F a822f45ad5490d07410a345a4f9f5a41 [0,2,0,0,0,0|2,0,0]=4 12630 B17R1.8305 C[C@@H](CN(C)C)NCOC(=O)c1ccccc1 06b1b1ba737e622d05d87f21f73a2ee0 [0,2,0,0,0,0|2,0,0]=4 12631 B17R1.8305 C[C@@H](CN(C)C)OCOC(=O)c1ccccc1 5ddc6094a7ef3eca3081e960da349c76 [0,2,0,0,0,0|2,0,0]=4 12632 B17R1.8305 C[C@H](CN(C)C)NCOC(=O)c1ccccc1 8d028c6507d5736940c3ed44dde2e135 [0,2,0,0,0,0|2,0,0]=4 12633 B17R1.8305 C[C@H](CN(C)C)OCOC(=O)c1ccccc1 e9b707d6bfdf806f3a555a823323e958 [0,2,0,0,0,0|2,0,0]=4 12634 B17R1.8305 C[C@H](O)CN(C)CCCC(=O)c1ccccc1 e00bbc97f36dc8e5b17276d7a38b3f37 [0,2,0,0,0,0|2,0,0]=4 12635 B17R1.8305 C[C@H](O)CN(C)CCOC(=O)c1ccccc1 0e2be36caf55b4d1415b3d24c5790194 [0,2,0,0,0,0|1,0,0]=3 12636 B17R1.9281 CC(C)CCCCOC(C)(C)c1ccccc1 ed836fbc9c2947f4c4fdd7d02d8b253b [0,2,0,0,0,0|1,0,1]=4 12637 B17R1.9281 CC(C)CNCCOS(=O)(=O)c1ccccc1 b5ccb607792698bbb9145a282feca430 [0,2,0,0,0,0|2,0,0]=4 12638 B17R1.9281 CC(C)COCCOS(=O)(=O)c1ccccc1 c0d37ce9922c4fa6679b72be7c451499 [0,2,0,0,0,0|2,0,0]=4 12639 B17R1.9281 CC(F)COCCOS(=O)(=O)c1ccccc1 2518501054f3cc31cfca20e5735011ec [0,2,0,0,0,0|2,0,0]=4 12640 B17R1.9281 CC(O)CNCCOS(=O)(=O)c1ccccc1 6e80af2036a25308d585c1492765123f [0,2,0,0,0,0|2,0,0]=4 12641 B17R1.9281 CC(S)COCCOS(=O)(=O)c1ccccc1 2b67d0d1a36f1ffaa51cebe8996442ad [0,2,0,0,0,0|2,0,0]=4 12642 B17R1.9281 C[C@@H](F)COCCOS(=O)(=O)c1ccccc1 b07034fd47886def2bef189eae92a2f4 [0,2,0,0,0,0|2,0,0]=4 12643 B17R1.9281 C[C@@H](O)CNCCOS(=O)(=O)c1ccccc1 e936a50116666b97ab4baf74e464ea40 [0,2,0,0,0,0|2,0,0]=4 12644 B17R1.9281 C[C@H](F)COCCOS(=O)(=O)c1ccccc1 1baac86ba629cd0f32282905ce9f0ecb [0,2,0,0,0,0|2,0,0]=4 12645 B17R1.9281 C[C@H](O)CNCCOS(=O)(=O)c1ccccc1 dc5a4f536063a1d3d3df92d8635e0346 [0,2,0,0,0,0|2,0,0]=4 12646 B17R1.13883 CC(C)CCCCOC(C)c1ccccc1Cl c817c82aece64b5ffd0e8753da8a0849 [0,2,0,0,0,0|1,0,1]=4 12647 B17R1.13883 CC(C)CCCCOC(C)c1ccccc1F 801d46a3684d06d24af613a0f2f491bc [0,2,0,0,0,0|1,0,1]=4 12648 B17R1.13883 CC(C)CCCCOC(C)c1ccccc1I ffc819720b783380e26c9493fa116982 [0,2,0,0,0,0|1,0,1]=4 12649 B17R1.13883 CC(C)CCCCO[C@@H](C)c1ccccc1Cl 1e2e87584c6485620cde596dd748cc59 [0,2,0,0,0,0|1,0,1]=4 12650 B17R1.13883 CC(C)CCCCO[C@@H](C)c1ccccc1F dbb19c0467400e481e85a1ad44895d57 [0,2,0,0,0,0|1,0,1]=4 12651 B17R1.13883 CC(C)CCCCO[C@H](C)c1ccccc1Cl 2a39ecf94bf238fa17be95ce7c4a4b20 [0,2,0,0,0,0|1,0,1]=4 12652 B17R1.13883 CC(C)CCCCO[C@H](C)c1ccccc1F 3b75bacb15f40722fb3fdd3b56fd9de6 [0,2,0,0,0,0|1,0,1]=4 12653 B17R1.13883 CC(C)CCCNCC(=O)c1ccccc1Cl 0f33a68660026d249a74d27728748d5f [0,2,0,0,0,0|2,0,0]=4 12654 B17R1.13883 CC(C)CCCNCC(=O)c1ccccc1F 175f9dfd52b2185e2e9842a6472fa5a9 [0,2,0,0,0,0|2,0,0]=4 12655 B17R1.13883 CC(C)CCCNCC(=O)c1ccccc1I 6f206ca1861171d6861ce13438257328 [0,2,0,0,0,0|2,0,0]=4 12656 B17R1.13883 CC(C)CCCOCC(=O)c1ccccc1Br ba56bdea619eae695aa5c167d43473e2 [0,2,0,0,0,0|2,0,0]=4 12657 B17R1.13883 CC(C)CCCOCC(=O)c1ccccc1Cl 4f8bcc94ad64e3f3ceda754747674d0f [0,2,0,0,0,0|2,0,0]=4 12658 B17R1.13883 CC(C)CCCOCC(=O)c1ccccc1F 92719e96989a0255400c2b2dd5fe0811 [0,2,0,0,0,0|2,0,0]=4 12659 B17R1.13883 CC(C)CCCOCC(=O)c1ccccc1I 930b4ad897ac496681f8e85e566e2787 [0,2,0,0,0,0|2,0,0]=4 12660 B17R1.13883 CC(C)CCNCCC(=O)c1ccccc1F 289d73c8fa62f0609a72ab7df7105047 [0,2,0,0,0,0|2,0,0]=4 12661 B17R1.13883 CC(C)CCOCCC(=O)c1ccccc1F a40de615da223c794e36ee18f420aa10 [0,2,0,0,0,0|2,0,0]=4 12662 B17R1.13883 CC(C)CNCCCC(=O)c1ccccc1F b04fb1e8dbb1d95caab7c32f7ea73143 [0,2,0,0,0,0|2,0,0]=4 12663 B17R1.13883 CC(C)CNCCNC(=O)c1ccccc1Cl 0a6e65b2a346abc819c81f2470cacd46 [0,2,0,0,0,0|2,0,0]=4 12664 B17R1.13883 CC(C)CNCCNC(=O)c1ccccc1F 991e4f095ab5dd0f0cd242c3d1cb930b [0,2,0,0,0,0|2,0,0]=4 12665 B17R1.13883 CC(C)CNCCNC(=O)c1ccccc1I 5f09fe622d21f3255c0908ea22efcfab [0,2,0,0,0,0|2,0,0]=4 12666 B17R1.13883 CC(C)COCCCC(=O)c1ccccc1F 3e22570a0f888bd8b77b6da8a9c503f1 [0,2,0,0,0,0|2,0,0]=4 12667 B17R1.13883 CC(C)COCCNC(=O)c1ccccc1Br 1e132e32b36ad67f37ffd7b4547be698 [0,2,0,0,0,0|2,0,0]=4 12668 B17R1.13883 CC(C)OCCCNC(=O)c1ccccc1Br e3e972faef6648a954b3833e94168a02 [0,2,0,0,0,0|2,0,0]=4 12669 B17R1.13883 CC(C)OCCCNC(=O)c1ccccc1Cl f3a1540618ad82b6fa1881a91c410bf1 [0,2,0,0,0,0|2,0,0]=4 12670 B17R1.13883 CC(C)OCCCNC(=O)c1ccccc1F c5dfc36f8f62d608723ecc9c6bc48efc [0,2,0,0,0,0|2,0,0]=4 12671 B17R1.13883 CC(C)OCCCNC(=O)c1ccccc1I 7bb3acae01ea9e57bfa2a307012601e2 [0,2,0,0,0,0|2,0,0]=4 12672 B17R1.13883 CC(C)OCCCNC(=O)c1ccccc1O 56ae32f7d95faff9665fc1ce1e72a963 [0,2,0,0,0,0|2,0,0]=4 12673 B17R1.13883 CC(C)OCCCNC(=O)c1ccccc1S 197b1a2a0d6df37bc84884ae325780df [0,2,0,0,0,0|2,0,0]=4 12674 B17R1.13883 CC(C)SCCCNC(=O)c1ccccc1Br 9672ac4c8bf22d3e6d529bc56291572c [0,2,0,0,0,0|2,0,0]=4 12675 B17R1.13883 CC(C)SCCCNC(=O)c1ccccc1Cl 76a6b9037c71274bbf6b3b4804cd92c4 [0,2,0,0,0,0|2,0,0]=4 12676 B17R1.13883 CC(C)SCCCNC(=O)c1ccccc1F 94e2b4b58c3290655a2d3e25539a8385 [0,2,0,0,0,0|2,0,0]=4 12677 B17R1.13883 CC(C)SCCCNC(=O)c1ccccc1I 803f4df1ad7532b9d23070388e8bdc64 [0,2,0,0,0,0|2,0,0]=4 12678 B17R1.13883 CC(C)SCCCNC(=O)c1ccccc1O 433fb2fc37d4ab2a4bc9751e8abb1324 [0,2,0,0,0,0|2,0,0]=4 12679 B17R1.13883 CC(C)SCCCNC(=O)c1ccccc1S 2bfa3f265d173763493d5a41eb335313 [0,2,0,0,0,0|2,0,0]=4 12680 B17R1.13883 CC(F)COCCCC(=O)c1ccccc1F 67da338bab05b028df95100334228286 [0,2,0,0,0,0|2,0,0]=4 12681 B17R1.13883 CC(O)CCNCCC(=O)c1ccccc1F a993501d59bb85229c7d0b41bb532fa9 [0,2,0,0,0,0|2,0,0]=4 12682 B17R1.13883 CC(O)CNCCCC(=O)c1ccccc1F 6f9743e3f66b75c57b17c1bd7c449dc6 [0,2,0,0,0,0|2,0,0]=4 12683 B17R1.13883 CC(O)CNCCNC(=O)c1ccccc1Cl 74731bee30f4beea931b700c29fa0ebf [0,2,0,0,0,0|2,0,0]=4 12684 B17R1.13883 CC(O)CNCCNC(=O)c1ccccc1F b131e1f922111bb060831c019ad36613 [0,2,0,0,0,0|2,0,0]=4 12685 B17R1.13883 CC(O)CNCCNC(=O)c1ccccc1I 7f3acbd5346a9cf9898957070bea9e96 [0,2,0,0,0,0|2,0,0]=4 12686 B17R1.13883 CN(C)CCCCNC(=O)c1ccccc1Br 2aea8caf0f5815d0f006b236f3b0f33c [0,2,0,0,0,0|2,0,0]=4 12687 B17R1.13883 CN(C)CCCCNC(=O)c1ccccc1Cl 8463e60a9c2d916f17b774742a786559 [0,2,0,0,0,0|2,0,0]=4 12688 B17R1.13883 CN(C)CCCCNC(=O)c1ccccc1F bdcb1414236371736b272b0f2184e58e [0,2,0,0,0,0|2,0,0]=4 12689 B17R1.13883 CN(C)CCCCNC(=O)c1ccccc1I 5713be3b8ffcda3b58ff84944c10713f [0,2,0,0,0,0|2,0,0]=4 12690 B17R1.13883 CN(C)CCCCNC(=O)c1ccccc1O 6219abe79d91c8c12e6509167b01621e [0,2,0,0,0,0|2,0,0]=4 12691 B17R1.13883 CN(C)CCCCNC(=O)c1ccccc1S 227623a6f767f1706f9c335a2d5337b9 [0,2,0,0,0,0|2,0,0]=4 12692 B17R1.13883 C[C@@H](F)COCCCC(=O)c1ccccc1F 463636fc516bb5c58e43137538ea0d75 [0,2,0,0,0,0|2,0,0]=4 12693 B17R1.13883 C[C@@H](O)CCNCCC(=O)c1ccccc1F d1477ad71a290a17e390879ca78a8740 [0,2,0,0,0,0|2,0,0]=4 12694 B17R1.13883 C[C@@H](O)CNCCCC(=O)c1ccccc1F c1d99515fcd301508b28b7dd97d9f4c2 [0,2,0,0,0,0|2,0,0]=4 12695 B17R1.13883 C[C@@H](O)CNCCNC(=O)c1ccccc1Cl 6ac985539ca4765443755268bbeceea8 [0,2,0,0,0,0|2,0,0]=4 12696 B17R1.13883 C[C@@H](O)CNCCNC(=O)c1ccccc1F 02a144c545056b93e09ef63cfbf2888d [0,2,0,0,0,0|2,0,0]=4 12697 B17R1.13883 C[C@@H](O)CNCCNC(=O)c1ccccc1I 91f54be1b617e7e0a103aa8a51a00437 [0,2,0,0,0,0|2,0,0]=4 12698 B17R1.13883 C[C@H](F)COCCCC(=O)c1ccccc1F 652ff02eb37c1ed9ad0ea734812dc99c [0,2,0,0,0,0|2,0,0]=4 12699 B17R1.13883 C[C@H](O)CCNCCC(=O)c1ccccc1F ce71c340fdc6b716c366b47a6d12744a [0,2,0,0,0,0|2,0,0]=4 12700 B17R1.13883 C[C@H](O)CNCCCC(=O)c1ccccc1F 56179395f894e1ffc9366b530d8cbc73 [0,2,0,0,0,0|2,0,0]=4 12701 B17R1.13883 C[C@H](O)CNCCNC(=O)c1ccccc1Cl 7ccbdc25238735e12c6f67590551c8f4 [0,2,0,0,0,0|2,0,0]=4 12702 B17R1.13883 C[C@H](O)CNCCNC(=O)c1ccccc1F e8c7b0e6e4b361a4935f233c938fce33 [0,2,0,0,0,0|2,0,0]=4 12703 B17R1.13883 C[C@H](O)CNCCNC(=O)c1ccccc1I 92f567022d48c592eeb8a866b9397b10 [0,2,0,0,0,0|2,0,0]=4 12704 B17R1.13883 Cc1ccccc1C(=O)CNCCCC(C)C 0bf7b3e51ebd471785ba1e8ebe974736 [0,2,0,0,0,0|2,0,0]=4 12705 B17R1.13883 Cc1ccccc1C(=O)COCCCC(C)C 7e07800059b629fcd4234d27defdd55e [0,2,0,0,0,0|2,0,0]=4 12706 B17R1.13883 Cc1ccccc1C(=O)NCCCCC(F)F 34f303289a15d230e467839fd1e243ca [0,2,0,0,0,0|2,0,0]=4 12707 B17R1.13883 Cc1ccccc1C(=O)NCCCCN(C)C 9ece9f37887e6f2b7e8fdde368624a31 [0,2,0,0,0,0|2,0,0]=4 12708 B17R1.13883 Cc1ccccc1C(=O)NCCCOC(C)C 0c14d0f6a14637450d8acd74c1be72fd [0,2,0,0,0,0|2,0,0]=4 12709 B17R1.13883 Cc1ccccc1C(=O)NCCCSC(C)C a4863a5d40191ea2b9dd7f2d2fa6b7e5 [0,2,0,0,0,0|2,0,0]=4 12710 B17R1.13883 Cc1ccccc1C(C)OCCCCC(C)C d2c704e8a090bb2f43dc0e02ab316387 [0,2,0,0,0,0|1,0,1]=4 12711 B17R1.13883 Cc1ccccc1[C@H](C)OCCCCC(C)C cb2269a1a6d1584be5c4b54a504d0b59 [0,2,0,0,0,0|1,0,1]=4 12712 B17R1.13883 O=C(NCCCCC(F)F)c1ccccc1Br b83f955fdb37e804341940ba7906a094 [0,2,0,0,0,0|2,0,0]=4 12713 B17R1.13883 O=C(NCCCCC(F)F)c1ccccc1Cl e59dae0a6ff220cdcdebee3e95363b56 [0,2,0,0,0,0|2,0,0]=4 12714 B17R1.13883 O=C(NCCCCC(F)F)c1ccccc1F 52903139cc600c31115985198b897ab3 [0,2,0,0,0,0|2,0,0]=4 12715 B17R1.13883 O=C(NCCCCC(F)F)c1ccccc1I 0576d8e4a63b054dff55ea46b952af54 [0,2,0,0,0,0|2,0,0]=4 12716 B17R1.13883 O=C(NCCCCC(F)F)c1ccccc1O 14bc874181c2eff18d671548bac2db61 [0,2,0,0,0,0|2,0,0]=4 12717 B17R1.13883 O=C(NCCCCC(F)F)c1ccccc1S a6ae431ceb450309f7a4780e63582c3e [0,2,0,0,0,0|2,0,0]=4 12718 B17R1.16645 CC(C)(Br)COCCNC(=O)c1ccccc1 f59d77c9d77a678b1f2828c6f0360986 [0,2,0,0,0,0|2,0,0]=4 12719 B17R1.16645 CC(C)(Br)COCCOC(=O)c1ccccc1 8e2f362c5a1c9229bec4c379c4abdbb8 [0,2,0,0,0,0|1,0,0]=3 12720 B17R1.16645 CC(C)(C)CCCNCC(=O)c1ccccc1 03c7fe81d452bc352d35d5a031df9a0d [0,2,0,0,0,0|2,0,0]=4 12721 B17R1.16645 CC(C)(C)CCCOCC(=O)c1ccccc1 0ec9a73f55554ddac91fbdd4c4bcee28 [0,2,0,0,0,0|2,0,0]=4 12722 B17R1.16645 CC(C)(C)CCNCCC(=O)c1ccccc1 3641e4b724a267cf39d60075f6af854f [0,2,0,0,0,0|2,0,0]=4 12723 B17R1.16645 CC(C)(C)CCNCOC(=O)c1ccccc1 8122e4023a95bfa051223eac839308da [0,2,0,0,0,0|1,0,0]=3 12724 B17R1.16645 CC(C)(C)CCOCCC(=O)c1ccccc1 10376d32cfa305bbc32a8658ecf7281f [0,2,0,0,0,0|2,0,0]=4 12725 B17R1.16645 CC(C)(C)CCOCNC(=O)c1ccccc1 38dad5a8f655d4aeed6bdf7e8439b6fa [0,2,0,0,0,0|2,0,0]=4 12726 B17R1.16645 CC(C)(C)CCOCOC(=O)c1ccccc1 f26f6f9c2e83710b500cd6a1c9edde0f [0,2,0,0,0,0|1,0,0]=3 12727 B17R1.16645 CC(C)(C)CNCCNC(=O)c1ccccc1 a8d71a22e68f67c0debdab22a3e90ae8 [0,2,0,0,0,0|2,0,0]=4 12728 B17R1.16645 CC(C)(C)CNCCOC(=O)c1ccccc1 eb94b96c63f2b5c54d301b72df0b60a2 [0,2,0,0,0,0|1,0,0]=3 12729 B17R1.16645 CC(C)(C)COCCCC(=O)c1ccccc1 af9ec8b9aa77ece3cdbe32f3a2712a86 [0,2,0,0,0,0|2,0,0]=4 12730 B17R1.16645 CC(C)(C)COCCNC(=O)c1ccccc1 65d5bfc1e8935204df381b06dafc3b9e [0,2,0,0,0,0|2,0,0]=4 12731 B17R1.16645 CC(C)(C)COCCOC(=O)c1ccccc1 7629dafce85005b744c3965d065da880 [0,2,0,0,0,0|1,0,0]=3 12732 B17R1.16645 CC(C)(C)COCCOC(=O)c1cccnc1 fb799a2c06a0e6c2a901df9508ef1053 [0,2,0,0,0,0|2,0,0]=4 12733 B17R1.16645 CC(C)(C)NCCCOC(=O)c1ccccc1 c00ee6f24a60e47b01f61953342cd7db [0,2,0,0,0,0|1,0,0]=3 12734 B17R1.16645 CC(C)(C)OCCCNC(=O)c1ccccc1 92e7240e04ded4dadacc98e788c823e0 [0,2,0,0,0,0|2,0,0]=4 12735 B17R1.16645 CC(C)(F)CCNCCC(=O)c1ccccc1 bcc907074ecc9bdd1eb568dacc41ca55 [0,2,0,0,0,0|2,0,0]=4 12736 B17R1.16645 CC(C)(F)CCNCOC(=O)c1ccccc1 a7ad924116a0d9a6aaad4ed5fe948521 [0,2,0,0,0,0|1,0,0]=3 12737 B17R1.16645 CC(C)(F)COCCCC(=O)c1ccccc1 0678a2961eba59966c29315b5485ae64 [0,2,0,0,0,0|2,0,0]=4 12738 B17R1.16645 CC(C)(F)COCCNC(=O)c1ccccc1 8b2de1420aa2dcfac41bb0a06e97919c [0,2,0,0,0,0|2,0,0]=4 12739 B17R1.16645 CC(C)(F)COCCOC(=O)c1ccccc1 d4f8296a46e7d5bf0692382ca3a5dcd9 [0,2,0,0,0,0|1,0,0]=3 12740 B17R1.16645 CC(C)(F)COCCOC(=O)c1cccnc1 141ed77a4430b536dbbe225ac226d7f4 [0,2,0,0,0,0|2,0,0]=4 12741 B17R1.16645 CC(C)(O)CCCNCC(=O)c1ccccc1 0d2e6b4d5f6d68f8a77e9f9c6102d8bc [0,2,0,0,0,0|2,0,0]=4 12742 B17R1.16645 CC(C)(O)CCCOCC(=O)c1ccccc1 157ddbda71da594d18ccb29f4b97aa48 [0,2,0,0,0,0|2,0,0]=4 12743 B17R1.16645 CC(C)(O)CCNCCC(=O)c1ccccc1 44b6e1fd2ba8b6905345299bf678cfc0 [0,2,0,0,0,0|2,0,0]=4 12744 B17R1.16645 CC(C)(O)CCNCOC(=O)c1ccccc1 6bddb218cb1e025958ce5f9250fc746d [0,2,0,0,0,0|1,0,0]=3 12745 B17R1.16645 CC(C)(O)CCOCCC(=O)c1ccccc1 f1dab979ecc7d4b33cee8ada83be6a1a [0,2,0,0,0,0|2,0,0]=4 12746 B17R1.16645 CC(C)(O)CCOCNC(=O)c1ccccc1 db4fd55ccee7ac1ed94bb9a1f4a8fff7 [0,2,0,0,0,0|2,0,0]=4 12747 B17R1.16645 CC(C)(O)CNCCNC(=O)c1ccccc1 51f070ca57d73f8196ffaba7e0a197a0 [0,2,0,0,0,0|2,0,0]=4 12748 B17R1.16645 CC(C)(O)CNCCOC(=O)c1ccccc1 43c764756045c6e16a01fb8084b3568b [0,2,0,0,0,0|1,0,0]=3 12749 B17R1.16645 CC(C)(O)COCCCC(=O)c1ccccc1 4435b5b4c1977fa8a56c73be97e9e380 [0,2,0,0,0,0|2,0,0]=4 12750 B17R1.16645 CC(C)(O)COCCNC(=O)c1ccccc1 bd0456f46a2366d3c3f7c4b032b91fbc [0,2,0,0,0,0|2,0,0]=4 12751 B17R1.16645 CC(C)(O)COCCOC(=O)c1ccccc1 a5359640ae28fded7af9accf5fc48748 [0,2,0,0,0,0|1,0,0]=3 12752 B17R1.16645 CC(C)(O)COCCOC(=O)c1cccnc1 b5ae559bf559a963cd479e4c60834331 [0,2,0,0,0,0|2,0,0]=4 12753 B17R1.16645 CC(C)(S)CCOCCC(=O)c1ccccc1 f95cd9aa8d59aca4bceab6cbe51f7978 [0,2,0,0,0,0|2,0,0]=4 12754 B17R1.16645 CC(C)(S)CCOCOC(=O)c1ccccc1 68ede531b3d7cf704a10579ec4af9268 [0,2,0,0,0,0|1,0,0]=3 12755 B17R1.16645 CC(C)(S)COCCNC(=O)c1ccccc1 2d59ccf49b60264f165c64367e311237 [0,2,0,0,0,0|2,0,0]=4 12756 B17R1.16645 CC(C)(S)COCCOC(=O)c1ccccc1 725017e828d0e7c70bc6f3c49942c0cc [0,2,0,0,0,0|1,0,0]=3 12757 B17R1.16645 CC(F)(F)CCCNCC(=O)c1ccccc1 2ee1cee0a607bb94e1dba0e4c9894202 [0,2,0,0,0,0|2,0,0]=4 12758 B17R1.16645 CC(F)(F)CCCOCC(=O)c1ccccc1 ee2d1e9892af28f3a544fbd77ad888a5 [0,2,0,0,0,0|2,0,0]=4 12759 B17R1.16645 CC(F)(F)CCOCCC(=O)c1ccccc1 d55cf4a2e610b6d283a162460724ec51 [0,2,0,0,0,0|2,0,0]=4 12760 B17R1.16645 CC(F)(F)CCOCNC(=O)c1ccccc1 cd6001411722ffcbb0e54968966f03a0 [0,2,0,0,0,0|2,0,0]=4 12761 B17R1.16645 CC(F)(F)CCOCOC(=O)c1ccccc1 62a637b2f4f538c0efb80ae01f91b9fb [0,2,0,0,0,0|1,0,0]=3 12762 B17R1.16645 CC(F)(F)CNCCNC(=O)c1ccccc1 10843276b171abc8b0638690a7b30d62 [0,2,0,0,0,0|2,0,0]=4 12763 B17R1.16645 CC(F)(F)CNCCOC(=O)c1ccccc1 ac7d9358d69fe625bcdd72549a357006 [0,2,0,0,0,0|1,0,0]=3 12764 B17R1.16645 CC(F)(F)COCCCC(=O)c1ccccc1 57f875d53ae1fae86ea26c0317c7a67e [0,2,0,0,0,0|2,0,0]=4 12765 B17R1.16645 CC(F)(F)COCCNC(=O)c1ccccc1 32561a297c4cd5c3580b8d91b626ec55 [0,2,0,0,0,0|2,0,0]=4 12766 B17R1.16645 CC(F)(F)COCCOC(=O)c1ccccc1 aaff5ab0ca4917ddc79604e07c7bc645 [0,2,0,0,0,0|1,0,0]=3 12767 B17R1.16645 CC(F)(F)COCCOC(=O)c1cccnc1 2570670329dfee122e1326e9a8daf85f [0,2,0,0,0,0|2,0,0]=4 12768 B17R1.16645 CS(=N)(=O)CCOCOC(=O)c1ccccc1 ac3380d4f08326889a9396c3886ac09b [0,2,0,0,0,0|2,0,0]=4 12769 B17R1.16645 CS(=O)(=O)CCCCNC(=O)c1ccccc1 b8d70559cebb6e05dad20946749ad9e5 [0,2,0,0,0,0|2,0,0]=4 12770 B17R1.16645 CS(=O)(=O)CCNCOC(=O)c1ccccc1 cef5657313de05dd27399c512055ce62 [0,2,0,0,0,0|2,0,0]=4 12771 B17R1.16645 CS(=O)(=O)CCOCOC(=O)c1ccccc1 94e4976010ca9b8678efa2224e8b97b6 [0,2,0,0,0,0|2,0,0]=4 12772 B17R1.16645 CS(=O)(=O)COCCOC(=O)c1ccccc1 bb480861e21f8443160a8026fc75255f [0,2,0,0,0,0|2,0,0]=4 12773 B17R1.16645 O=C(NCCCCC(F)(F)F)c1ccccc1 4a7265c6ced4fcbb441ca177d33dacc4 [0,2,0,0,0,0|2,0,0]=4 12774 B17R1.16645 O=C(OCCNCC(F)(F)F)c1ccccc1 a1ca849dcedcd9be08a7e085714b8353 [0,2,0,0,0,0|2,0,0]=4 12775 B17R1.16645 O=C(OCCOCC(F)(F)Br)c1ccccc1 43e056f93b83d4b0b5ff7dbdd1d5a717 [0,2,0,0,0,0|2,0,0]=4 12776 B17R1.16645 O=C(OCCOCC(F)(F)Cl)c1ccccc1 0d38d4d4da99df59aa34eef3ba9a35a1 [0,2,0,0,0,0|2,0,0]=4 12777 B17R1.16645 O=C(OCCOCC(F)(F)F)c1ccccc1 86490765b0f26f92a838d3a8c3209bb4 [0,2,0,0,0,0|2,0,0]=4 12778 B17R1.16645 O=C(OCNCCC(F)(F)F)c1ccccc1 9c4058ec62983322517549d7db0ae568 [0,2,0,0,0,0|2,0,0]=4 12779 B17R1.16645 O=C(OCOCCC(F)(F)F)c1ccccc1 28c960a59be5d620fa660f148121be0a [0,2,0,0,0,0|2,0,0]=4 12780 B17R1.929 C=CC(OCCC(C)CCC)c1ccccc1 3fde86c8028e8a4939d8bc7a32edbe9a [0,2,0,0,0,0|1,0,1]=4 12781 B17R1.929 C=CC(OCCC(S)CCC)c1ccccc1 b4d039e747c6227bd1df0e780ac7a20b [0,2,0,0,0,0|1,0,1]=4 12782 B17R1.929 CCCC(C)CCOC(CC)c1ccccc1 cb9e0f16d5e9e95c2d14691691c692ac [0,2,0,0,0,0|1,0,1]=4 12783 B17R1.929 CCCC(C)CO/C=C(\C=O)/c1ccccc1 4d72222fe71816928b4ce4ad3bd71cb2 [0,2,0,0,0,0|2,0,0]=4 12784 B17R1.929 CCCC(S)CCOC(CC)c1ccccc1 393734873bc9331cdad4ef1dde26c50e [0,2,0,0,0,0|1,0,1]=4 12785 B17R1.1153 C=CC(OCCCC(C)CC)c1ccccc1 f75e964235f858ce6f621d9d94b55bce [0,2,0,0,0,0|1,0,1]=4 12786 B17R1.1153 C=CC(OCCC[C@@H](C)CC)c1ccccc1 1cc190da9ba88b05cc33e5d904ce1618 [0,2,0,0,0,0|1,0,1]=4 12787 B17R1.1153 CCC(C)CCCOC(CC)c1ccccc1 dbe23e678275b1e863b0ca1bd8c31320 [0,2,0,0,0,0|1,0,1]=4 12788 B17R1.1153 CCC(C)CCO/C=C(\C=O)/c1ccccc1 8f3cb99dc4263fafb55b1c4eb5c7bbba [0,2,0,0,0,0|2,0,0]=4 12789 B17R1.1153 CCC(OCCC[C@@H](C)CC)c1ccccc1 04787088c7a4a110653998a745e76c7e [0,2,0,0,0,0|1,0,1]=4 12790 B17R1.5080 CCCCCCN(C)C(C=O)c1ccccc1 441fc06977bb2266da616ee4ed79d73d [0,2,0,0,0,0|1,0,1]=4 12791 B17R1.5194 C#CCC(OCCCCCC)c1ccccc1 1593f6a263897c49727a3a3ef1cc8c9a [0,2,0,0,0,0|1,0,1]=4 12792 B17R1.5194 C=CCC(OCCCCCC)c1ccccc1 0ebca22bbff522f98da109c6f0acdd56 [0,2,0,0,0,0|1,0,1]=4 12793 B17R1.5194 CCCCCCOC(CC#N)c1ccccc1 c4f2ae2294cfc79633d529d280067635 [0,2,0,0,0,0|1,0,1]=4 12794 B17R1.5194 CCCCCCOC(CCC)c1ccccc1 e66e6918af54a33067d225d2b02e5d24 [0,2,0,0,0,0|1,0,1]=4 12795 B17R1.5194 CCCCCCO[C@@H](CCC)c1ccccc1 08fdf9b6e0a75d87f12fef95bc20e016 [0,2,0,0,0,0|1,0,1]=4 12796 B17R1.5194 CCCCCCO[C@H](CCC)c1ccccc1 95df56edc0ce4ae9271257f9dc55c752 [0,2,0,0,0,0|1,0,1]=4 12797 B17R1.5198 C#CC(C)(OCCCCCC)c1ccccc1 537a8db345037778acf3da139150e837 [0,2,0,0,0,0|1,0,1]=4 12798 B17R1.5198 CC(C=O)(OCCCCCF)c1ccccc1 36463ce4164ecd153acf21835acced61 [0,2,0,0,0,0|1,0,1]=4 12799 B17R1.5198 CCCCCCOC(C)(C=O)c1ccccc1 bfc36fd3e532a2e40986096766582c89 [0,2,0,0,0,0|0,0,1]=3 12800 B17R1.5198 CCCCCCOC(C)(CC)c1ccccc1 a1e03a88a1c8b7199eec4f1f7d752449 [0,2,0,0,0,0|1,0,1]=4 12801 B17R1.5198 CCCCCCO[C@@](C)(CC)c1ccccc1 2d7a935a6ea4a3271dffff5f0705fd0a [0,2,0,0,0,0|1,0,1]=4 12802 B17R1.5198 CCCCCCO[C@](C)(CC)c1ccccc1 f460167d9e7f6e5466d644de851d0d51 [0,2,0,0,0,0|1,0,1]=4 12803 B17R1.5198 CCCCOCOC(C)(C=O)c1ccccc1 f7c1f8717c84d9a85b62e744edab5b68 [0,2,0,0,0,0|1,0,1]=4 12804 B17R1.5198 CCCOCCOC(C)(C=O)c1ccccc1 1e61d4aff72bc49acc1ab8ddee54068d [0,2,0,0,0,0|1,0,1]=4 12805 B17R1.5198 CCOCCCOC(C)(C=O)c1ccccc1 2a8bcfa62dabe4aff37eb3992e41e3e7 [0,2,0,0,0,0|1,0,1]=4 12806 B17R1.5198 CCSCCCOC(C)(C=O)c1ccccc1 02a87707662fb4ca641412f6ac053842 [0,2,0,0,0,0|1,0,1]=4 12807 B17R1.5198 COCCCCOC(C)(C=O)c1ccccc1 390b0e882d2496a66c995284f9b248f0 [0,2,0,0,0,0|1,0,1]=4 12808 B17R1.5201 CCCCCCNC(C(=O)C)c1ccccc1 4ab4752b809967e468aa8b4855cc88f0 [0,2,0,0,0,0|1,0,1]=4 12809 B17R1.5201 CCCCCCNC(C(=O)N)c1ccccc1 e03c41b7dba052ad6b4b55a5cc1ddd0c [0,2,0,0,0,0|1,0,1]=4 12810 B17R1.5201 CCCCCCNC(C(=O)O)c1ccccc1 5e4d4e2aaa406bf7c8a90908be149eb9 [0,2,0,0,0,0|1,0,1]=4 12811 B17R1.5201 CCCCCCN[C@@H](C(=O)N)c1ccccc1 716eef1ec9057e3fb3cff2da14ea986c [0,2,0,0,0,0|1,0,1]=4 12812 B17R1.5201 CCCCCCN[C@@H](C(=O)O)c1ccccc1 147868783174213daf72648af9d6d0e4 [0,2,0,0,0,0|1,0,1]=4 12813 B17R1.5201 CCCCCCN[C@H](C(=O)N)c1ccccc1 4842817f51d274af81e236265d05415e [0,2,0,0,0,0|1,0,1]=4 12814 B17R1.5201 CCCCCCN[C@H](C(=O)O)c1ccccc1 a0f649da27e6101a3bca6b09b685d2eb [0,2,0,0,0,0|1,0,1]=4 12815 B17R1.5201 CCCCCCOC(C(=O)C)c1ccccc1 3283622c1a3cf546bafd8795988509fb [0,2,0,0,0,0|0,0,1]=3 12816 B17R1.5201 CCCCCCOC(C(=O)N)c1ccccc1 df448167df3bb327896875257cc64823 [0,2,0,0,0,0|0,0,1]=3 12817 B17R1.5201 CCCCCCOC(C(=O)O)c1ccccc1 30105052335a0e5d1d398936d892e008 [0,2,0,0,0,0|0,0,1]=3 12818 B17R1.5201 CCCCCCOC(C(=O)O)c1cccnc1 079b35cecccb8823959ee901b4b7f52f [0,2,0,0,0,0|1,0,1]=4 12819 B17R1.5201 CCCCCCOC(C(=O)O)c1ccncc1 ebf0c291fab838e8a3e62f6c7e386936 [0,2,0,0,0,0|1,0,1]=4 12820 B17R1.5201 CCCCCCO[C@@H](C(=O)N)c1ccccc1 7fbd19415e70bd5b17b7163faf88f939 [0,2,0,0,0,0|0,0,1]=3 12821 B17R1.5201 CCCCCCO[C@@H](C(=O)O)c1ccccc1 80d01de33f0d62215c1e043f1f052b95 [0,2,0,0,0,0|0,0,1]=3 12822 B17R1.5201 CCCCCCO[C@H](C(=O)N)c1ccccc1 7ce8e39d6f8b544a3e8be39ff29daa2f [0,2,0,0,0,0|0,0,1]=3 12823 B17R1.5201 CCCCCCO[C@H](C(=O)O)c1ccccc1 f3d45c81a49626069b1e72cf144834f6 [0,2,0,0,0,0|0,0,1]=3 12824 B17R1.5201 CCCCOCOC(C(=O)C)c1ccccc1 77170ec5331cbbdef289d29cf744ba36 [0,2,0,0,0,0|1,0,1]=4 12825 B17R1.5201 CCCCOCOC(C(=O)N)c1ccccc1 f4abdabf1dc4234cd38defe2c8c14ca6 [0,2,0,0,0,0|1,0,1]=4 12826 B17R1.5201 CCCCOCOC(C(=O)O)c1ccccc1 fe12eda7c3a18666ac04b2be646ad7b8 [0,2,0,0,0,0|1,0,1]=4 12827 B17R1.5201 CCCCOCO[C@@H](C(=O)N)c1ccccc1 5699c9da771e3e6485a34f20ec4c574d [0,2,0,0,0,0|1,0,1]=4 12828 B17R1.5201 CCCCOCO[C@@H](C(=O)O)c1ccccc1 8f2dd9a410ed88436809c527c7a17c4d [0,2,0,0,0,0|1,0,1]=4 12829 B17R1.5201 CCCCOCO[C@H](C(=O)N)c1ccccc1 d804663fc6f7c9b599b4db96a9613136 [0,2,0,0,0,0|1,0,1]=4 12830 B17R1.5201 CCCCOCO[C@H](C(=O)O)c1ccccc1 610ccc854edcc9a7a10d1103c1194c0e [0,2,0,0,0,0|1,0,1]=4 12831 B17R1.5201 CCCOCCOC(C(=O)C)c1ccccc1 db0164db3c4946bd8166d6b949c58fe9 [0,2,0,0,0,0|1,0,1]=4 12832 B17R1.5201 CCCOCCOC(C(=O)N)c1ccccc1 55c5fef1abf755c9716b06ee44e1e0c6 [0,2,0,0,0,0|1,0,1]=4 12833 B17R1.5201 CCCOCCOC(C(=O)O)c1ccccc1 1f68a62fdac5a1443069754ca52afc21 [0,2,0,0,0,0|1,0,1]=4 12834 B17R1.5201 CCCOCCO[C@@H](C(=O)N)c1ccccc1 21458c2b29e78d03b2cab4d18909136c [0,2,0,0,0,0|1,0,1]=4 12835 B17R1.5201 CCCOCCO[C@@H](C(=O)O)c1ccccc1 cf43d0adda46d942431322dd5ab1d677 [0,2,0,0,0,0|1,0,1]=4 12836 B17R1.5201 CCCOCCO[C@H](C(=O)N)c1ccccc1 accd3a4bbae85b5dcdcf89ff5c38f5b5 [0,2,0,0,0,0|1,0,1]=4 12837 B17R1.5201 CCCOCCO[C@H](C(=O)O)c1ccccc1 f8b69eff2c66238795ac1188ac8e05dd [0,2,0,0,0,0|1,0,1]=4 12838 B17R1.5201 CCOCCCOC(C(=O)C)c1ccccc1 44514968d6bf21cbb41459bb765f2529 [0,2,0,0,0,0|1,0,1]=4 12839 B17R1.5201 CCOCCCOC(C(=O)N)c1ccccc1 d283e49bfa615a722c9c160fc253234d [0,2,0,0,0,0|1,0,1]=4 12840 B17R1.5201 CCOCCCOC(C(=O)O)c1ccccc1 3d8cbcfa7f6645785b9062d714061357 [0,2,0,0,0,0|1,0,1]=4 12841 B17R1.5201 CCOCCCO[C@@H](C(=O)N)c1ccccc1 fae5d6c01988cc67be827aecbdffa6bd [0,2,0,0,0,0|1,0,1]=4 12842 B17R1.5201 CCOCCCO[C@@H](C(=O)O)c1ccccc1 93abddb8d4aeb97b768cc64127ff1280 [0,2,0,0,0,0|1,0,1]=4 12843 B17R1.5201 CCOCCCO[C@H](C(=O)N)c1ccccc1 7b85226e1ce631187be8e65b50d0fcdd [0,2,0,0,0,0|1,0,1]=4 12844 B17R1.5201 CCOCCCO[C@H](C(=O)O)c1ccccc1 9e0c87dc7c14596a0adfb38420972c91 [0,2,0,0,0,0|1,0,1]=4 12845 B17R1.5201 CCSCCCOC(C(=O)O)c1ccccc1 3cef8cf7d20c06e27de386f80987352b [0,2,0,0,0,0|1,0,1]=4 12846 B17R1.5201 CCSCCCO[C@@H](C(=O)O)c1ccccc1 541c8281ea1dfed44c5cea82028b8389 [0,2,0,0,0,0|1,0,1]=4 12847 B17R1.5201 CCSCCCO[C@H](C(=O)O)c1ccccc1 5094689b4193312684cb64bbd31591db [0,2,0,0,0,0|1,0,1]=4 12848 B17R1.5201 COCCCCOC(C(=O)C)c1ccccc1 958ae6ccf5364242aaf2c7d66ef05a2d [0,2,0,0,0,0|1,0,1]=4 12849 B17R1.5201 COCCCCOC(C(=O)N)c1ccccc1 e9fed30d7e78df6f3751441c1602f0e2 [0,2,0,0,0,0|1,0,1]=4 12850 B17R1.5201 COCCCCOC(C(=O)O)c1ccccc1 b4c6e5af34ef5b1ac87184af8820a6d5 [0,2,0,0,0,0|1,0,1]=4 12851 B17R1.5201 COCCCCO[C@@H](C(=O)N)c1ccccc1 af4d3e479a847f0afc2cdc6f988b351f [0,2,0,0,0,0|1,0,1]=4 12852 B17R1.5201 COCCCCO[C@@H](C(=O)O)c1ccccc1 18fa890479f449943e691f76d8d7a035 [0,2,0,0,0,0|1,0,1]=4 12853 B17R1.5201 COCCCCO[C@H](C(=O)N)c1ccccc1 ea49c3844e46f0b3023cf81354cc480a [0,2,0,0,0,0|1,0,1]=4 12854 B17R1.5201 COCCCCO[C@H](C(=O)O)c1ccccc1 318d118987991c0df109dfdc93a5d72d [0,2,0,0,0,0|1,0,1]=4 12855 B17R1.5201 NC(=O)C(OCCCCCF)c1ccccc1 b77e89f98bddb26fcef2444aea44fa7f [0,2,0,0,0,0|1,0,1]=4 12856 B17R1.5201 NC(=O)[C@@H](OCCCCCF)c1ccccc1 b8a5ea5521b41f082848115fc847da3e [0,2,0,0,0,0|1,0,1]=4 12857 B17R1.5201 NC(=O)[C@H](OCCCCCF)c1ccccc1 bab787a1a5d9af154da4752e028f3a11 [0,2,0,0,0,0|1,0,1]=4 12858 B17R1.5201 O=C(O)C(OCCCCCF)c1ccccc1 8b37ad07775e5eb19b5105c26fc7843f [0,2,0,0,0,0|1,0,1]=4 12859 B17R1.5201 O=C(O)[C@@H](OCCCCCF)c1ccccc1 ed383977890828c0d054ae6291c6dfe9 [0,2,0,0,0,0|1,0,1]=4 12860 B17R1.5201 O=C(O)[C@H](OCCCCCF)c1ccccc1 04cf873924b0ed2a8a5a42024fede4f2 [0,2,0,0,0,0|1,0,1]=4 12861 B17R1.9312 C=CC(OCC(C)CCCC)c1ccccc1 0f22c5dbf0bbd834ca6c399c5f1d0290 [0,2,0,0,0,0|1,0,1]=4 12862 B17R1.9312 CCCCC(C)COC(CC)c1ccccc1 89cdbd9373ac896a7637d774b8d3bc2b [0,2,0,0,0,0|1,0,1]=4 12863 B17R1.9312 CCCCC(C)O/C=C(\C=O)/c1ccccc1 4dc98c74fe7e3596823dc9330ec66e4d [0,2,0,0,0,0|2,0,0]=4 12864 B17R1.9312 CCCCC(O)CNC(C=O)c1ccccc1 351c717226fc1501e0a2efec7d8ee80f [0,2,0,0,0,0|1,0,1]=4 12865 B17R1.16908 C#CC(OCCCCCC)c1ccccc1F 20e988dd6254af4fd26a343d09614ac3 [0,2,0,0,0,0|1,0,1]=4 12866 B17R1.16908 C=CC(OCCCCCC)c1ccccc1C 78ac3ae49c891f3a8eb4ea1fb9732db5 [0,2,0,0,0,0|1,0,1]=4 12867 B17R1.16908 C=CC(OCCCCCC)c1ccccc1Cl f7b3921e2e75d8d63610199ca14eee62 [0,2,0,0,0,0|1,0,1]=4 12868 B17R1.16908 C=CC(OCCCCCC)c1ccccc1F 517b4940fdc09d4f03fd6fb8aecce529 [0,2,0,0,0,0|1,0,1]=4 12869 B17R1.16908 CCCCCCOC(C#N)c1ccccc1Cl 12e97dab60be5717f01ff3765420af8b [0,2,0,0,0,0|1,0,1]=4 12870 B17R1.16908 CCCCCCOC(CC)c1ccccc1Cl fc5376b97d9d23573f55543dd05e1834 [0,2,0,0,0,0|1,0,1]=4 12871 B17R1.16908 CCCCCCOC(CC)c1ccccc1F d78e9781e8fda559f211620098af6893 [0,2,0,0,0,0|1,0,1]=4 12872 B17R1.16908 CCCCCCOC(CC)c1ccccc1I 494ba42c14b05fec574ec64c8d7ad6d7 [0,2,0,0,0,0|1,0,1]=4 12873 B17R1.971 CC(CCO)N(C)COC(=O)c1ccccc1 03e1b18291fef05ba36264bcb046933d [0,2,0,0,0,0|2,0,0]=4 12874 B17R1.971 C[C@@H](CCO)N(C)COC(=O)c1ccccc1 dc6eddbf5906e7d688202c81d2ac96d2 [0,2,0,0,0,0|2,0,0]=4 12875 B17R1.1231 CC(CO)CN(C)COC(=O)c1ccccc1 83ca6cc582563704e37e0f419a747c28 [0,2,0,0,0,0|2,0,0]=4 12876 B17R1.1231 CCC(C)CC(C)NCC(=O)c1ccccc1 5f88497b8cbec6d787c0398045b67a03 [0,2,0,0,0,0|2,0,0]=4 12877 B17R1.1231 CCC(C)OC(C)CNC(=O)c1ccccc1 2dfef69eb72dbb2e657266af6d74f35c [0,2,0,0,0,0|2,0,0]=4 12878 B17R1.1231 CCC(O)CN(C)COC(=O)c1ccccc1 e0588482879ab050873c77a570337436 [0,2,0,0,0,0|1,0,0]=3 12879 B17R1.1231 CCN(C)CC(C)CNC(=O)c1ccccc1 3a72d2ba830de9c3bcc8726b41ad3781 [0,2,0,0,0,0|2,0,0]=4 12880 B17R1.1231 CN(COC(=O)c1ccccc1)CC(O)CO 04170b0f38d4ecda29659fcb284268dc [0,2,0,0,0,0|2,0,0]=4 12881 B17R1.1541 CCCCC(C)NC(=O)C(=O)c1ccccc1 970a6dac695c01eab7fb1ad1a3755106 [0,2,0,0,0,0|2,0,0]=4 12882 B17R1.1541 CCCC[C@@H](C)NC(=O)C(=O)c1ccccc1 b3f99b33413e2218e383929b07ca76bb [0,2,0,0,0,0|2,0,0]=4 12883 B17R1.1541 CCSCC(O)CN(C)C(=O)c1ccccc1 bd2a599e0a1f05fc55f50d28a9491ecf [0,2,0,0,0,0|2,0,0]=4 12884 B17R1.1541 CSCCC(O)CN(C)C(=O)c1ccccc1 f9874f297863d2f358222bde6511c089 [0,2,0,0,0,0|2,0,0]=4 12885 B17R1.4951 C#CC(CCCC)OCC(=O)c1ccccc1 67506ceaf7bc555cdae19328bce4dd80 [0,2,0,0,0,0|2,0,0]=4 12886 B17R1.4951 C=CC(CCCC)OCC(=O)c1ccccc1 c9fd58cba45ed6cfb1c86a994a18e293 [0,2,0,0,0,0|2,0,0]=4 12887 B17R1.4951 CCCCC(CC)CNC(=O)c1ccccc1 1b1532627cf9e97829f9a65965531f6c [0,2,0,0,0,0|1,0,0]=3 12888 B17R1.4951 CCCCC(CC)CNC(=O)c1ccccn1 8525e9fdcc89f4f246b9c024e4c87af7 [0,2,0,0,0,0|2,0,0]=4 12889 B17R1.4951 CCCCC(CC)CNC(=O)c1cccnc1 6adad6ec469ab989fc3fe9e6123db4df [0,2,0,0,0,0|2,0,0]=4 12890 B17R1.4951 CCCCC(CC)CNC(=O)c1ccncc1 7db1de485b3c07e077202c985be521ff [0,2,0,0,0,0|2,0,0]=4 12891 B17R1.4951 CCCCC(CC)COC(C)c1ccccc1 4fd92a77b6491029a818decb47b857be [0,2,0,0,0,0|1,0,1]=4 12892 B17R1.4951 CCCCC(CC)CO[C@@H](C)c1ccccc1 d8331332ee440f8798b5f1319ff7f3d2 [0,2,0,0,0,0|1,0,1]=4 12893 B17R1.4951 CCCCC(CC)CO[C@H](C)c1ccccc1 3144d519f34633bf01460af75b648e92 [0,2,0,0,0,0|1,0,1]=4 12894 B17R1.4951 CCCCC(CC)NCC(=O)c1ccccc1 b5b78e89b319487d2ec37f0af6163715 [0,2,0,0,0,0|2,0,0]=4 12895 B17R1.4951 CCCCC(CC)OCC(=O)c1ccccc1 cb97dff41f65de63cb0271813090987a [0,2,0,0,0,0|2,0,0]=4 12896 B17R1.4951 CCCCC(CO)NCC(=O)c1ccccc1 60686deeebd9908e9794b8551cc259df [0,2,0,0,0,0|2,0,0]=4 12897 B17R1.4951 CCCCN(CC)COC(=O)c1ccccc1 3646d9e187309fc2ff37bcea0df7e88d [0,2,0,0,0,0|1,0,0]=3 12898 B17R1.4951 CCCC[C@@H](CC)COC(C)c1ccccc1 1eb59198eb08d4c3b652b65ee073e04d [0,2,0,0,0,0|1,0,1]=4 12899 B17R1.4951 CCCC[C@@H](CC)CO[C@@H](C)c1ccccc1 67d0b556469cd2e089f3ece38c986b92 [0,2,0,0,0,0|1,0,1]=4 12900 B17R1.4951 CCCC[C@@H](CC)CO[C@H](C)c1ccccc1 641ad3a58659f220e0271f44278a92a4 [0,2,0,0,0,0|1,0,1]=4 12901 B17R1.4951 CCCC[C@@H](CO)NCC(=O)c1ccccc1 3d8a3a7f68d766bc4e62774fbae3ddf6 [0,2,0,0,0,0|2,0,0]=4 12902 B17R1.4951 CCCC[C@H](CO)NCC(=O)c1ccccc1 197c089b3558605d31233225c7877f1e [0,2,0,0,0,0|2,0,0]=4 12903 B17R1.4951 CCN(CCCO)COC(=O)c1ccccc1 42b05d8d9eb1026a891196bc489c0ad5 [0,2,0,0,0,0|2,0,0]=4 12904 B17R1.4951 CCN(CCOC)COC(=O)c1ccccc1 302e98e5e1ab85f348df31d192f50d01 [0,2,0,0,0,0|2,0,0]=4 12905 B17R1.4951 CSCCC(CO)CNC(=O)c1ccccc1 e659055953cf5eb8bef6f5f31de01aee [0,2,0,0,0,0|2,0,0]=4 12906 B17R1.9325 CCOCC(C)(C)CNC(=O)c1ccccc1 5ef2246c21636ada488631c97ff11a7c [0,2,0,0,0,0|2,0,0]=4 12907 B17R1.18156 CCCCC(C)NCC(=O)c1ccccc1F 3a81dc1c72224896b26ab62a696027d5 [0,2,0,0,0,0|2,0,0]=4 12908 B17R1.18156 CCCCC(C)OCC(=O)c1ccccc1Cl 9cb40ddd2aa75700f64dd41545a4295a [0,2,0,0,0,0|2,0,0]=4 12909 B17R1.18156 CCCCC(C)OCC(=O)c1ccccc1F b0a53f5de33deda0a221cb42fa8774bc [0,2,0,0,0,0|2,0,0]=4 12910 B17R1.18156 CCCCC(O)CNC(=O)c1cccc[n+]1[O-] 8487987571b5a03aa5e5db100bfe3a39 [0,2,0,0,0,0|2,0,0]=4 12911 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1Br 34c069f8227109101e67be4ded49355c [0,2,0,0,0,0|1,0,0]=3 12912 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1C 86b3a3b424c106f823c1ee294b6d9bdd [0,2,0,0,0,0|1,0,0]=3 12913 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1Cl 67e3120273fdadce4116d8d9556d6400 [0,2,0,0,0,0|1,0,0]=3 12914 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1F 3b45b45c749e6c88b21c07d2e33e5ce9 [0,2,0,0,0,0|1,0,0]=3 12915 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1I 3c921a1a3ef3bf74bd8dd20eb44b2ad4 [0,2,0,0,0,0|1,0,0]=3 12916 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1O df0335b57f944b57763e6ec3320a680a [0,2,0,0,0,0|1,0,0]=3 12917 B17R1.18156 CCCCC(O)CNC(=O)c1ccccc1S 106f4dd40e6a58b1f643805b378ae717 [0,2,0,0,0,0|1,0,0]=3 12918 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1Br e5bd60359c2e1f73e2ce15e76913fe0a [0,2,0,0,0,0|2,0,0]=4 12919 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1C 6c04348feda886e28db9808df5ada8cc [0,2,0,0,0,0|2,0,0]=4 12920 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1Cl ac41b0e6105e2769589ff2e9bd63958e [0,2,0,0,0,0|2,0,0]=4 12921 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1F 4c6d037514a68e61007bbfe6002bdf8b [0,2,0,0,0,0|2,0,0]=4 12922 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1I 1c6c2029aa4d05122dbe33875fcaab59 [0,2,0,0,0,0|2,0,0]=4 12923 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1O 38120f113a5178bcf24ab4d9040d83d7 [0,2,0,0,0,0|2,0,0]=4 12924 B17R1.18156 CCCCC(O)CNC(=O)c1cccnc1S 939f280323375eba9166f656591bd91b [0,2,0,0,0,0|2,0,0]=4 12925 B17R1.18156 CCCCC(O)CNC(=O)c1ccncc1Br 58b60d9218031576f246977754173ce1 [0,2,0,0,0,0|2,0,0]=4 12926 B17R1.18156 CCCCC(O)CNC(=O)c1ccncc1C d706b063d09abde0fecba0d826f82cea [0,2,0,0,0,0|2,0,0]=4 12927 B17R1.18156 CCCCC(O)CNC(=O)c1ccncc1Cl 6461598f36b5a9ea68e46a54487d0dde [0,2,0,0,0,0|2,0,0]=4 12928 B17R1.18156 CCCCC(O)CNC(=O)c1ccncc1F 6a8985601979ca99511c03461683f973 [0,2,0,0,0,0|2,0,0]=4 12929 B17R1.18156 CCCCC(O)CNC(=O)c1ccncc1I 1876d858678b22d02a60607f3af811e3 [0,2,0,0,0,0|2,0,0]=4 12930 B17R1.18156 CCCCC(O)CNC(=O)c1ccncc1O f7e0607a97ec48dab6f64e279a2092d0 [0,2,0,0,0,0|2,0,0]=4 12931 B17R1.18156 CCCCC(O)CNC(=O)c1cnccc1Br f3979bbfecc5d6daa14ffc01269cc443 [0,2,0,0,0,0|2,0,0]=4 12932 B17R1.18156 CCCCC(O)CNC(=O)c1cnccc1C 45bbe4a45fd3751f32211818158891f4 [0,2,0,0,0,0|2,0,0]=4 12933 B17R1.18156 CCCCC(O)CNC(=O)c1cnccc1Cl d035450e1f48631299e108efba414759 [0,2,0,0,0,0|2,0,0]=4 12934 B17R1.18156 CCCCC(O)CNC(=O)c1cnccc1F 02208a73fc5be71ee6b9177f34032893 [0,2,0,0,0,0|2,0,0]=4 12935 B17R1.18156 CCCCC(O)CNC(=O)c1cnccc1O 30c089a85d3279116d1de789c9cb404c [0,2,0,0,0,0|2,0,0]=4 12936 B17R1.18156 CCCCC(O)CNC(=O)c1ncccc1Br e9eb5674c326b30ebaa29382d930c8cb [0,2,0,0,0,0|2,0,0]=4 12937 B17R1.18156 CCCCC(O)CNC(=O)c1ncccc1C 46033592df2a1b25cf644e4f1655cd8f [0,2,0,0,0,0|2,0,0]=4 12938 B17R1.18156 CCCCC(O)CNC(=O)c1ncccc1Cl 7a37909cb80e8a4041515c53f6332fdf [0,2,0,0,0,0|2,0,0]=4 12939 B17R1.18156 CCCCC(O)CNC(=O)c1ncccc1F e5ab574741c505165a18728dc25ed032 [0,2,0,0,0,0|2,0,0]=4 12940 B17R1.18156 CCCCC(O)CNC(=O)c1ncccc1I 6462b84af7962941bf46663315b086de [0,2,0,0,0,0|2,0,0]=4 12941 B17R1.18156 CCCCC(O)CNC(=O)c1ncccc1O 1b53dd4da88ee8c7376df20018325260 [0,2,0,0,0,0|2,0,0]=4 12942 B17R1.18156 CCCCN(C)CCC(=O)c1ccccc1F 052e07b7fcd37983eaf0bfc59d77eb7b [0,2,0,0,0,0|2,0,0]=4 12943 B17R1.18156 CCCC[C@@H](C)NCC(=O)c1ccccc1F 78d421301d00eccef7470d559acafa6b [0,2,0,0,0,0|2,0,0]=4 12944 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1Br 3e5559d6cb31fa9529dc43ab86fd8c9d [0,2,0,0,0,0|2,0,0]=4 12945 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1C b98a069420349d4e466d7c38033300a5 [0,2,0,0,0,0|2,0,0]=4 12946 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1Cl 70f67d9c2cb99a41297703469cea9b6c [0,2,0,0,0,0|2,0,0]=4 12947 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1F 6200c5dfb39e5605b48664d4c4032fe8 [0,2,0,0,0,0|2,0,0]=4 12948 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1I 8a06d0a5ff6945a739d00a05d206d880 [0,2,0,0,0,0|2,0,0]=4 12949 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1O 1aed52a66ec423da78f091110dc75a68 [0,2,0,0,0,0|2,0,0]=4 12950 B17R1.18156 CCOCC(O)CNC(=O)c1ccccc1S 624774d4e3b569ce6d296410f7c1c78a [0,2,0,0,0,0|2,0,0]=4 12951 B17R1.18156 C[C@H](CCCO)CNC(=O)c1ccccc1Br 309a81573d55b7dfb2ae71dc1851ccd3 [0,2,0,0,0,0|2,0,0]=4 12952 B17R1.18156 C[C@H](CCCO)CNC(=O)c1ccccc1Cl 241d3ee3619373acfaf0932003b9b89a [0,2,0,0,0,0|2,0,0]=4 12953 B17R1.18156 C[C@H](CCCO)CNC(=O)c1ccccc1F 8605c092e3a2427cde3dc97aa51fe7c5 [0,2,0,0,0,0|2,0,0]=4 12954 B17R1.18156 C[C@H](CCCO)CNC(=O)c1ccccc1I a255d59a44df74aa42e2ed4d01ffc259 [0,2,0,0,0,0|2,0,0]=4 12955 B17R1.18156 C[C@H](CCCO)CNC(=O)c1ccccc1O 1b1f1cf2a20142d76a15b29057ba6322 [0,2,0,0,0,0|2,0,0]=4 12956 B17R1.18156 C[C@H](CCCO)CNC(=O)c1ccccc1S fb01350afb1953cf8e5a044a03af3760 [0,2,0,0,0,0|2,0,0]=4 12957 B17R1.18156 Cc1ccccc1C(=O)NC[C@H](C)CCCO 1f4eb21a761d735ec33887e870e01d2c [0,2,0,0,0,0|2,0,0]=4 12958 B17R1.1235 CCC(C)CCNC(=O)C(=O)c1ccccc1 21e68d8eac5b6cecd150c96d693ef5b9 [0,2,0,0,0,0|2,0,0]=4 12959 B17R1.1637 CCCC(O)CNC(=O)C(=O)c1ccccc1 a29542eefedd21bc743107ed34c205a6 [0,2,0,0,0,0|2,0,0]=4 12960 B17R1.18291 CCCCCCN(C)C(=O)c1cccc[n+]1[O-] 2b0c3886d0ec57c6d7d318613158ba67 [0,2,0,0,0,0|2,0,0]=4 12961 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1Br ac2c45f9ba0e98bc7830ab10128a8db0 [0,2,0,0,0,0|1,0,0]=3 12962 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1C 583b9deb88172506d687800a29e152d4 [0,2,0,0,0,0|1,0,0]=3 12963 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1Cl c01462f051bf2fe74726ef3ab533f6fe [0,2,0,0,0,0|1,0,0]=3 12964 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1F 4943dbee07d6feb300c266fbd095f59a [0,2,0,0,0,0|1,0,0]=3 12965 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1I 47463cea8e687e3e986a843e4090d380 [0,2,0,0,0,0|1,0,0]=3 12966 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1O 87f009e519a2ca5eeb73de568791e236 [0,2,0,0,0,0|1,0,0]=3 12967 B17R1.18291 CCCCCCN(C)C(=O)c1ccccc1S 0b23d929ca199e1a9db8e4e6d93fb919 [0,2,0,0,0,0|1,0,0]=3 12968 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1Br b33e1fc57a5b844f64385356a77e65e8 [0,2,0,0,0,0|2,0,0]=4 12969 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1C 0eb70b8d268da18986f255a13ec654ab [0,2,0,0,0,0|2,0,0]=4 12970 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1Cl 58259f880b349da65a6ac0ff28b3be1d [0,2,0,0,0,0|2,0,0]=4 12971 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1F f88df559ebf3b05ed67a4f7abf8a2561 [0,2,0,0,0,0|2,0,0]=4 12972 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1I 4bd3815c0e921181bbc4d90225505b3f [0,2,0,0,0,0|2,0,0]=4 12973 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1O bccf9cbe28b5993fcdcb27ba612c42f0 [0,2,0,0,0,0|2,0,0]=4 12974 B17R1.18291 CCCCCCN(C)C(=O)c1cccnc1S 8166d94978d142143e7adcb92dd4a602 [0,2,0,0,0,0|2,0,0]=4 12975 B17R1.18291 CCCCCCN(C)C(=O)c1ccncc1Br c83cfac8f45bcf432ad8791da93cb578 [0,2,0,0,0,0|2,0,0]=4 12976 B17R1.18291 CCCCCCN(C)C(=O)c1ccncc1C 2f1b9f8b46eb53cf8ddf094140caea6d [0,2,0,0,0,0|2,0,0]=4 12977 B17R1.18291 CCCCCCN(C)C(=O)c1ccncc1Cl 7795ff4435be120d6faeb20de547df53 [0,2,0,0,0,0|2,0,0]=4 12978 B17R1.18291 CCCCCCN(C)C(=O)c1ccncc1F 94c4ce9fff09cffd8cb1f0fcd5acb8b8 [0,2,0,0,0,0|2,0,0]=4 12979 B17R1.18291 CCCCCCN(C)C(=O)c1ccncc1I 8dc0a2f9dc732fe797dd6644ea960c72 [0,2,0,0,0,0|2,0,0]=4 12980 B17R1.18291 CCCCCCN(C)C(=O)c1ccncc1O 1cb0b789b68b592c6c824daa27a09fd3 [0,2,0,0,0,0|2,0,0]=4 12981 B17R1.18291 CCCCCCN(C)C(=O)c1cnccc1Br 43b0ba3bec8d5b719363691b42e4911b [0,2,0,0,0,0|2,0,0]=4 12982 B17R1.18291 CCCCCCN(C)C(=O)c1cnccc1C 91d77e1aa6f7cbfee2410b9d007bc6b1 [0,2,0,0,0,0|2,0,0]=4 12983 B17R1.18291 CCCCCCN(C)C(=O)c1cnccc1Cl 90c1bfe090e2153657bc8dbf69b89edd [0,2,0,0,0,0|2,0,0]=4 12984 B17R1.18291 CCCCCCN(C)C(=O)c1cnccc1F 64acc3d8f6040a5f182369d486a36f16 [0,2,0,0,0,0|2,0,0]=4 12985 B17R1.18291 CCCCCCN(C)C(=O)c1cnccc1O 40a0ee9353781d98e9a5e64e6cf7cda5 [0,2,0,0,0,0|2,0,0]=4 12986 B17R1.18291 CCCCCCN(C)C(=O)c1ncccc1Br 19d3aa2df056334155d28682b74c0749 [0,2,0,0,0,0|2,0,0]=4 12987 B17R1.18291 CCCCCCN(C)C(=O)c1ncccc1C 8a058491c0006eae96b943e2ffcccd3f [0,2,0,0,0,0|2,0,0]=4 12988 B17R1.18291 CCCCCCN(C)C(=O)c1ncccc1Cl 49a31a716188d8842412826191e353f6 [0,2,0,0,0,0|2,0,0]=4 12989 B17R1.18291 CCCCCCN(C)C(=O)c1ncccc1F 76f630457c7ce52f3e81d0eda736492a [0,2,0,0,0,0|2,0,0]=4 12990 B17R1.18291 CCCCCCN(C)C(=O)c1ncccc1I fd9fc0288de1ab40b744a5fad3df31cd [0,2,0,0,0,0|2,0,0]=4 12991 B17R1.18291 CCCCCCN(C)C(=O)c1ncccc1O d47593aad536b9093604447739dacdc8 [0,2,0,0,0,0|2,0,0]=4 12992 B17R1.18291 CCCCCNC(=O)C(=O)c1ccccc1Br 30bd14311d866786d6687398d10b741c [0,2,0,0,0,0|2,0,0]=4 12993 B17R1.18291 CCCCCNC(=O)C(=O)c1ccccc1C 26a7f8b8bf9c046e168437171fd95daf [0,2,0,0,0,0|2,0,0]=4 12994 B17R1.18291 CCCCCNC(=O)C(=O)c1ccccc1Cl 7246623578d0c08db43924166ca16cc3 [0,2,0,0,0,0|2,0,0]=4 12995 B17R1.18291 CCCCCNC(=O)C(=O)c1ccccc1F 3628d75da7652021e37d228420c20d3b [0,2,0,0,0,0|2,0,0]=4 12996 B17R1.18291 CCCCCNC(C)C(=O)c1ccccc1F aab438636c9f2d70dfecd2f32729bdaf [0,2,0,0,0,0|2,0,0]=4 12997 B17R1.18291 CN(CCCCCO)C(=O)c1ccccc1Br c5815bcc1c1cfb81ffb21cbb616d488f [0,2,0,0,0,0|2,0,0]=4 12998 B17R1.18291 CN(CCCCCO)C(=O)c1ccccc1Cl 3dcc029f16241f4eb195a2f716fc67ad [0,2,0,0,0,0|2,0,0]=4 12999 B17R1.18291 CN(CCCCCO)C(=O)c1ccccc1F 7c547022e40b665c39425e34bebec3c0 [0,2,0,0,0,0|2,0,0]=4 13000 B17R1.18291 CN(CCCCCO)C(=O)c1ccccc1I 9746785367cc823a0b572a650780830f [0,2,0,0,0,0|2,0,0]=4 13001 B17R1.18291 CN(CCCCCO)C(=O)c1ccccc1O c8183496f276d929da6e5eccac083a0b [0,2,0,0,0,0|2,0,0]=4 13002 B17R1.18291 CN(CCCCCO)C(=O)c1ccccc1S 2dd38971398a1b112251fe377891c13d [0,2,0,0,0,0|2,0,0]=4 13003 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1Br 8cfc1e6c8a47b5b3545bc3e7f6b6c788 [0,2,0,0,0,0|2,0,0]=4 13004 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1C 72832a5f1c3527c4d354d36a6fcb5c52 [0,2,0,0,0,0|2,0,0]=4 13005 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1Cl 21b2aa74e4981a1801dba393d1c52812 [0,2,0,0,0,0|2,0,0]=4 13006 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1F a84e1eb265f72536ebcbb5c23b673aa6 [0,2,0,0,0,0|2,0,0]=4 13007 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1I 522463e22806ed6c3665799f492f8e03 [0,2,0,0,0,0|2,0,0]=4 13008 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1O cdc6f513d97beb793a753cd76177ae69 [0,2,0,0,0,0|2,0,0]=4 13009 B17R1.18291 COCCCCN(C)C(=O)c1ccccc1S e0868b626ab43c0b80270bc5fa42d058 [0,2,0,0,0,0|2,0,0]=4 13010 B17R1.18291 Cc1ccccc1C(=O)N(C)CCCCCO 7083a9faece80fcc8443f8cf4c2934de [0,2,0,0,0,0|2,0,0]=4 13011 B17R1.140 C#CC(CCC)OCOC(=O)c1ccccc1 562555c25a30e7f12a40c33fa7793899 [0,2,0,0,0,0|1,0,0]=3 13012 B17R1.140 C=CC(CCC)OCOC(=O)c1ccccc1 07324ad005a4fb94d16a120c19b533b9 [0,2,0,0,0,0|1,0,0]=3 13013 B17R1.140 CCC(COC)NCOC(=O)c1ccccc1 0b79feca779cd02b6d2f2d7982b71987 [0,2,0,0,0,0|2,0,0]=4 13014 B17R1.140 CCC(COC)OCOC(=O)c1ccccc1 4b55802f59cac748a66823983a6ed674 [0,2,0,0,0,0|2,0,0]=4 13015 B17R1.140 CCC(CSC)OCOC(=O)c1ccccc1 7948842286c0df9be5557e19c86a5a96 [0,2,0,0,0,0|2,0,0]=4 13016 B17R1.140 CCCC(C#N)OCOC(=O)c1ccccc1 243acfb914d542cfbe4a9d5c6a118016 [0,2,0,0,0,0|1,0,0]=3 13017 B17R1.140 CCCC(CC)COCC(=O)c1ccccc1 6cdb3d82bd229f29744d1bf0147e8a86 [0,2,0,0,0,0|2,0,0]=4 13018 B17R1.140 CCCC(CC)OCCC(=O)c1ccccc1 5840898665632f455919796ae8874f7e [0,2,0,0,0,0|2,0,0]=4 13019 B17R1.140 CCCC(CC)OCNC(=O)c1ccccc1 ca8f9d905452a4b22a2a572957b303f2 [0,2,0,0,0,0|2,0,0]=4 13020 B17R1.140 CCCC(CC)OCOC(=O)c1ccccc1 e786b009fa271569d2c60f0264d1bbee [0,2,0,0,0,0|1,0,0]=3 13021 B17R1.140 CCCC(CO)NCOC(=O)c1ccccc1 78e9d3a7e1c0e898b8b766e3c604f34d [0,2,0,0,0,0|1,0,0]=3 13022 B17R1.140 CCC[C@@H](CC)OCOC(=O)c1ccccc1 e1d808f1b344595ef052ef533896b960 [0,2,0,0,0,0|1,0,0]=3 13023 B17R1.140 CCC[C@@H](CO)NCOC(=O)c1ccccc1 d4ab5cb8c24ade2bebf21f6e6f179351 [0,2,0,0,0,0|1,0,0]=3 13024 B17R1.140 CCC[C@H](CO)NCOC(=O)c1ccccc1 6ee15910980cb9ec736195517e358120 [0,2,0,0,0,0|1,0,0]=3 13025 B17R1.140 CCN(CCCl)CCOC(=O)c1ccccc1 bf23b60a1e6892867aa58c2abc8aa462 [0,2,0,0,0,0|2,0,0]=4 13026 B17R1.140 COCC(CO)NCOC(=O)c1ccccc1 79dc843995130ac2623f08512e5231f6 [0,2,0,0,0,0|2,0,0]=4 13027 B17R1.140 CSCC(CO)NCOC(=O)c1ccccc1 e5bea060bf15adce9beeb708d34a926b [0,2,0,0,0,0|2,0,0]=4 13028 B17R1.140 O=C(OCCN(CO)CCO)c1ccccc1 e8e3daecc7381b315a791c8cb1b1229e [0,2,0,0,0,0|2,0,0]=4 13029 B17R1.140 O=C(OCNC(CO)CCO)c1ccccc1 93b63b59b7128c54a7d2754b6e60bc0e [0,2,0,0,0,0|2,0,0]=4 13030 B17R1.140 O=C(OCN[C@@H](CO)CCO)c1ccccc1 d07138717631365a03ba3b4bf631ee7b [0,2,0,0,0,0|2,0,0]=4 13031 B17R1.140 O=C(OCOC(CBr)CCBr)c1ccccc1 9c62f2abd6ac12d8b9eb1e399f9dcfe4 [0,2,0,0,0,0|2,0,0]=4 13032 B17R1.140 O=C(OCOC(CCl)CCCl)c1ccccc1 220cb5ef8ad49d8eca698b3cf20a0555 [0,2,0,0,0,0|2,0,0]=4 13033 B17R1.924 CCCN(C)CCOS(=O)(=O)c1ccccc1 5bcbc297f05c01804172a19d8fce2168 [0,2,0,0,0,0|2,0,0]=4 13034 B17R1.1779 CC(CO)N(C)CCOC(=O)c1ccccc1 c471bc797e182d14a1dbfefa482853e5 [0,2,0,0,0,0|2,0,0]=4 13035 B17R1.1779 CCC(C)C(C)NCOC(=O)c1ccccc1 abfa3ebd3499d65fc951a1205e1b6f58 [0,2,0,0,0,0|1,0,0]=3 13036 B17R1.1779 CCC(C)N(C)CCNC(=O)c1ccccc1 400f94839ec9648601d1bd858a5992f8 [0,2,0,0,0,0|2,0,0]=4 13037 B17R1.1779 CCC(C)N(C)CCOC(=O)c1ccccc1 8c7f2d48fc515818c8390763e902e29d [0,2,0,0,0,0|1,0,0]=3 13038 B17R1.1779 CCC(S)C(C)COCC(=O)c1ccccc1 32f82aa7eef1dfa12a4c6a3dbd52d86c [0,2,0,0,0,0|2,0,0]=4 13039 B17R1.1779 CCN(C)C(C)CCNC(=O)c1ccccc1 08a96c5bb33ea47a51e73a7d8865de16 [0,2,0,0,0,0|2,0,0]=4 13040 B17R1.1779 COC(C)C(C)OCOC(=O)c1ccccc1 f68c4e65c926b460ae33625a2b553a5e [0,2,0,0,0,0|2,0,0]=4 13041 B17R1.1779 C[C@@H](CO)N(C)CCOC(=O)c1ccccc1 6c9221463e9ffa832b6b0d26d2de832a [0,2,0,0,0,0|2,0,0]=4 13042 B17R1.1779 C[C@H](CO)N(C)CCOC(=O)c1ccccc1 f8d0298b896070cb1dbbcbde15349967 [0,2,0,0,0,0|2,0,0]=4 13043 B17R1.4241 CC(C)(CCO)NCOC(=O)c1ccccc1 5a1563dd7d869cb2355cb59f4f6d7ad2 [0,2,0,0,0,0|2,0,0]=4 13044 B17R1.4241 CCCC(C)(O)CNCC(=O)c1ccccc1 86a7c9e3071d64059a125a295b41c9ea [0,2,0,0,0,0|2,0,0]=4 13045 B17R1.4241 COCC(C)(C)NCOC(=O)c1ccccc1 ac0b1dc25325dee18102221f863d266b [0,2,0,0,0,0|2,0,0]=4 13046 B17R1.4241 CSCC(C)(C)NCOC(=O)c1ccccc1 477485968f3eb2378e6ca8779907569f [0,2,0,0,0,0|2,0,0]=4 13047 B17R1.21452 CCCC(C)COCC(=O)c1ccccc1Br 1bc8def5bc24d53b5437b1d2b500ed3d [0,2,0,0,0,0|2,0,0]=4 13048 B17R1.21452 CCCC(C)COCC(=O)c1ccccc1C 59d287ddc6f41b761f1a27074ebc485d [0,2,0,0,0,0|2,0,0]=4 13049 B17R1.21452 CCCC(C)COCC(=O)c1ccccc1Cl feb27c70de27730f40715745420173a4 [0,2,0,0,0,0|2,0,0]=4 13050 B17R1.21452 CCCC(C)COCC(=O)c1ccccc1F faf8a16d4837a3a99eb1826b2713975d [0,2,0,0,0,0|2,0,0]=4 13051 B17R1.21452 CCCC(C)COCC(=O)c1ccccc1I 044e4f1501c75b95456aa1965d3a9102 [0,2,0,0,0,0|2,0,0]=4 13052 B17R1.21452 CCCC(O)CNCC(=O)c1ccccc1C 7f10adeca848e3327b3dc70af580b8c2 [0,2,0,0,0,0|2,0,0]=4 13053 B17R1.21452 CCCC(O)CNCC(=O)c1ccccc1Cl 1fd6a13262a48213daa1e94d8530d3de [0,2,0,0,0,0|2,0,0]=4 13054 B17R1.21452 CCCC(O)CNCC(=O)c1ccccc1F d90610881362be0de878cf789808790a [0,2,0,0,0,0|2,0,0]=4 13055 B17R1.21452 CCCC(O)CNCC(=O)c1ccccc1I 250d3afcaa82060e096abfa8100d78ca [0,2,0,0,0,0|2,0,0]=4 13056 B17R1.21452 CCCC(S)CCOC(C)c1ccccc1Cl 8f8f39aeee67efa27d353b970ccec134 [0,2,0,0,0,0|1,0,1]=4 13057 B17R1.21452 CCCN(C)CCCC(=O)c1ccccc1F f6d346827f8442983e2c4bd4cf91308e [0,2,0,0,0,0|2,0,0]=4 13058 B17R1.396 CC(C)(CF)CNCOC(=O)c1ccccc1 83730e6b1ed36f9b6716072cdf708fc4 [0,2,0,0,0,0|2,0,0]=4 13059 B17R1.396 CC(C)(CF)COCOC(=O)c1ccccc1 2c06801b3ed7482c16993c26dc0c97c4 [0,2,0,0,0,0|2,0,0]=4 13060 B17R1.396 CC(C)(CF)NCCOC(=O)c1ccccc1 cfa6626912828cd8b27a512cea1e8644 [0,2,0,0,0,0|2,0,0]=4 13061 B17R1.396 CC(C)(CO)CCCNC(=O)c1ccccc1 56b2a929a67f8b41ef934c3132639bb0 [0,2,0,0,0,0|2,0,0]=4 13062 B17R1.396 CC(C)(CO)CNCOC(=O)c1ccccc1 0642d899aeac6fc5ed29e7f2275c3f97 [0,2,0,0,0,0|2,0,0]=4 13063 B17R1.396 CC(C)(CO)NCCOC(=O)c1ccccc1 b18f7a7e486c0ec5baa906990137482d [0,2,0,0,0,0|2,0,0]=4 13064 B17R1.396 CCC(C)(C)CCNCC(=O)c1ccccc1 99b811bd6b3e3c22ae5208b5a59b7ddd [0,2,0,0,0,0|2,0,0]=4 13065 B17R1.396 CCC(C)(C)CCOCC(=O)c1ccccc1 d83f56942e1a0f6bb9587f3447943065 [0,2,0,0,0,0|2,0,0]=4 13066 B17R1.396 CCC(C)(C)CNCOC(=O)c1ccccc1 2a8a87b4e22bdc17b13df3fbcf45927c [0,2,0,0,0,0|1,0,0]=3 13067 B17R1.396 CCC(C)(O)CNCOC(=O)c1ccccc1 e65e234b03e89214678cc2c157a5e9e2 [0,2,0,0,0,0|1,0,0]=3 13068 B17R1.396 CCC(F)(F)COCOC(=O)c1ccccc1 a2996111cfb1869ff642d4115e5e8411 [0,2,0,0,0,0|1,0,0]=3 13069 B17R1.396 COC(C)(C)CNCOC(=O)c1ccccc1 bb5cfeb3281f2c5ab3a8379a92ca4196 [0,2,0,0,0,0|2,0,0]=4 13070 B17R1.396 COC(C)(C)COCOC(=O)c1ccccc1 9b8db12c7fcdd9057b14bb9b5a94daf7 [0,2,0,0,0,0|2,0,0]=4 13071 B17R1.396 O=C(OCNCC(F)(F)CO)c1ccccc1 9b737a07174e30a3110eab0a94ab522d [0,2,0,0,0,0|2,0,0]=4 13072 B17R1.618 C#CC(CC)OCCNC(=O)c1ccccc1 a78cec421d18961afc2735632a0ea1c7 [0,2,0,0,0,0|2,0,0]=4 13073 B17R1.618 C#CC(CC)OCCOC(=O)c1ccccc1 dc1ffd2b65925d22aad8c2c72489b11f [0,2,0,0,0,0|1,0,0]=3 13074 B17R1.618 C=CC(CC)OCCNC(=O)c1ccccc1 aca3a5e004a83f8c41913171ebcf3fc2 [0,2,0,0,0,0|2,0,0]=4 13075 B17R1.618 C=CC(CC)OCCOC(=O)c1ccccc1 673a6acd143af5056384c12e14feb193 [0,2,0,0,0,0|1,0,0]=3 13076 B17R1.618 C=C[C@@H](CO)NCCOC(=O)c1ccccc1 79844b665f881ad10a03fea1e7bc5230 [0,2,0,0,0,0|2,0,0]=4 13077 B17R1.618 CCC(C#N)OCCOC(=O)c1ccccc1 c58c375ff8d679381c18f3e0ed1ad329 [0,2,0,0,0,0|1,0,0]=3 13078 B17R1.618 CCC(C=O)OCCCC(=O)c1ccccc1 e65d65a59ff39c3a10c27c1c014e4923 [0,2,0,0,0,0|2,0,0]=4 13079 B17R1.618 CCC(C=O)OCCNC(=O)c1ccccc1 b1ba0f34a0b9e2b8358b4d653558e0d2 [0,2,0,0,0,0|2,0,0]=4 13080 B17R1.618 CCC(C=O)OCCOC(=O)c1ccccc1 b0d294391810b3c1d8e425d549986c25 [0,2,0,0,0,0|1,0,0]=3 13081 B17R1.618 CCC(C=O)OCCOC(=O)c1cccnc1 d86ee1ff3823a09202ecbd931ae26205 [0,2,0,0,0,0|2,0,0]=4 13082 B17R1.618 CCC(CC)CCNCC(=O)c1ccccc1 1f749005c9e819861dbd399c2b6421fb [0,2,0,0,0,0|2,0,0]=4 13083 B17R1.618 CCC(CC)CNCOC(=O)c1ccccc1 74e8aece67dc0c3c343f760f96ca9d97 [0,2,0,0,0,0|1,0,0]=3 13084 B17R1.618 CCC(CC)COCCC(=O)c1ccccc1 3fa3a38171609abe8bcbb00fbee90c21 [0,2,0,0,0,0|2,0,0]=4 13085 B17R1.618 CCC(CC)COCNC(=O)c1ccccc1 4d1e8aeb9daa78f9ebc8134defa201c0 [0,2,0,0,0,0|2,0,0]=4 13086 B17R1.618 CCC(CC)COCOC(=O)c1ccccc1 eb805ddb75a39a84b3d6b388b49c0e8d [0,2,0,0,0,0|1,0,0]=3 13087 B17R1.618 CCC(CC)NCCNC(=O)c1ccccc1 5f20ca1cb62b3e23cf20ba04eea53e88 [0,2,0,0,0,0|2,0,0]=4 13088 B17R1.618 CCC(CC)NCCOC(=O)c1ccccc1 948ef3b2603ff94065791b205cd10b7f [0,2,0,0,0,0|1,0,0]=3 13089 B17R1.618 CCC(CC)OCCCC(=O)c1ccccc1 d12597b7dd60feaf5aa6ccb941289622 [0,2,0,0,0,0|2,0,0]=4 13090 B17R1.618 CCC(CC)OCCNC(=O)c1ccccc1 db0a1d508bbaa1ccd8d6de968ab3f3de [0,2,0,0,0,0|2,0,0]=4 13091 B17R1.618 CCC(CC)OCCOC(=O)c1ccccc1 948204746ea79a47ee5018dd6f3fd9f4 [0,2,0,0,0,0|1,0,0]=3 13092 B17R1.618 CCC(CC)OCCOC(=O)c1cccnc1 22283336ca37c4bb9184196b694d99ff [0,2,0,0,0,0|2,0,0]=4 13093 B17R1.618 CCC(CO)CNCCC(=O)c1ccccc1 02cb5e2f285d7db06c33d25b1b5313c1 [0,2,0,0,0,0|2,0,0]=4 13094 B17R1.618 CCC(CO)CNCOC(=O)c1ccccc1 17203c01b2400bae530b0546bbfad874 [0,2,0,0,0,0|1,0,0]=3 13095 B17R1.618 CCC(CO)NCCOC(=O)c1ccccc1 011c402b4ecc77f696b6fc7018c508ae [0,2,0,0,0,0|1,0,0]=3 13096 B17R1.618 CCC(COCOC(=O)c1ccccc1)OC f1f83895e15c5cfcd5bb1c4e5368f2f1 [0,2,0,0,0,0|1,0,0]=3 13097 B17R1.618 CCN(CC)CCCNC(=O)c1ccccc1 7ea6f680596afe0c9c339705c206781f [0,2,0,0,0,0|2,0,0]=4 13098 B17R1.618 CCN(CC)COCOC(=O)c1ccccc1 b62a270a516844db99fd3e458a7123c1 [0,2,0,0,0,0|2,0,0]=4 13099 B17R1.618 CC[C@@H](CO)NCCOC(=O)c1ccccc1 674f3db91dd4a4804780b7a2aa9634cb [0,2,0,0,0,0|1,0,0]=3 13100 B17R1.618 CC[C@H](CO)NCCOC(=O)c1ccccc1 d5768038c308c6c823a18d741f4b7f8c [0,2,0,0,0,0|1,0,0]=3 13101 B17R1.618 COC(CCCNC(=O)c1ccccc1)OC 306c04d8f113286c02d092a936df563d [0,2,0,0,0,0|2,0,0]=4 13102 B17R1.618 COC(CNCOC(=O)c1ccccc1)OC c7862a9fdc851baa77da946bce358969 [0,2,0,0,0,0|2,0,0]=4 13103 B17R1.618 COC(COCOC(=O)c1ccccc1)OC 500ed678f78ec4062b40bfe49b868436 [0,2,0,0,0,0|2,0,0]=4 13104 B17R1.618 CO[C@@H](CO)CNCOC(=O)c1ccccc1 d66775c0d1524780376b1c1107d58e57 [0,2,0,0,0,0|2,0,0]=4 13105 B17R1.618 O=C(OCCNC(CO)CO)c1ccccc1 d12c04e7332fa1efc24e425d00b34da6 [0,2,0,0,0,0|2,0,0]=4 13106 B17R1.618 O=C(OCCOC(CBr)CBr)c1ccccc1 7d5ad0e19d0d682cc12bac5f3f7582ba [0,2,0,0,0,0|2,0,0]=4 13107 B17R1.618 O=C(OCCOC(CCl)CBr)c1ccccc1 982c4bcdd86554519a886230e35ee15d [0,2,0,0,0,0|2,0,0]=4 13108 B17R1.618 O=C(OCCOC(CCl)CCl)c1ccccc1 2bc9f0521ce85cbb7fa8f587f6432e40 [0,2,0,0,0,0|2,0,0]=4 13109 B17R1.618 O=C(OCCOC(CF)CF)c1ccccc1 2b92b15ec4a849b0b24a4a08d717ad29 [0,2,0,0,0,0|2,0,0]=4 13110 B17R1.618 O=C(OCCOC(CO)CO)c1ccccc1 ec1846c1381153bb79cbe7956bad7eb1 [0,2,0,0,0,0|2,0,0]=4 13111 B17R1.618 O=C(OCCO[C@@H](CCl)CI)c1ccccc1 604834fac432bd0da7ad6d33c003741e [0,2,0,0,0,0|2,0,0]=4 13112 B17R1.618 O=C(OCCO[C@H](CCl)CI)c1ccccc1 0281364f9b54912c44d9aba597852152 [0,2,0,0,0,0|2,0,0]=4 13113 B17R1.618 O=C(OCNCC(CO)CO)c1ccccc1 0ce8aadf398526f0b988d9f4cf66109e [0,2,0,0,0,0|2,0,0]=4 13114 B17R1.618 O=C(OCOCC(CBr)CBr)c1ccccc1 c744e66219e0ac8654e989fa885e818b [0,2,0,0,0,0|2,0,0]=4 13115 B17R1.4778 CCC(C)NCCOS(=O)(=O)c1ccccc1 2983201b61db1620e06a0d97d0798fde [0,2,0,0,0,0|2,0,0]=4 13116 B17R1.4778 CCC(C)OCCOS(=O)(=O)c1ccccc1 49ecfb780d519df10a06e075a3d5f25a [0,2,0,0,0,0|2,0,0]=4 13117 B17R1.4778 CC[C@@H](C)NCCOS(=O)(=O)c1ccccc1 2c2170ad06f3900fb3024c5f7cab4d8b [0,2,0,0,0,0|2,0,0]=4 13118 B17R1.4778 CC[C@@H](C)OCCOS(=O)(=O)c1ccccc1 9d2a539b0c3107839afecee2ef4464ef [0,2,0,0,0,0|2,0,0]=4 13119 B17R1.4778 CC[C@H](C)NCCOS(=O)(=O)c1ccccc1 f47db96baf8cf3980dd52730722d49b5 [0,2,0,0,0,0|2,0,0]=4 13120 B17R1.4778 CC[C@H](C)OCCOS(=O)(=O)c1ccccc1 86d23f3f54529125bdd02be0208e0c68 [0,2,0,0,0,0|2,0,0]=4 13121 B17R1.24240 CC(CO)CCCNC(=O)c1ccccc1Br e1804762c4427c4006f25ba1235272db [0,2,0,0,0,0|2,0,0]=4 13122 B17R1.24240 CC(CO)CCCNC(=O)c1ccccc1Cl 227b7ae6fa4442a68d3f0d7f92b1c07a [0,2,0,0,0,0|2,0,0]=4 13123 B17R1.24240 CC(CO)CCCNC(=O)c1ccccc1F 634ecf079553a595bc7f5d9114506f02 [0,2,0,0,0,0|2,0,0]=4 13124 B17R1.24240 CC(CO)CCCNC(=O)c1ccccc1I 9fcdbde293486c79724832eb2f69e06d [0,2,0,0,0,0|2,0,0]=4 13125 B17R1.24240 CC(CO)CCCNC(=O)c1ccccc1O 4611cff433205488ff48e100e3925715 [0,2,0,0,0,0|2,0,0]=4 13126 B17R1.24240 CC(CO)CCCNC(=O)c1ccccc1S ff25a674a797fa2f8a26a981903a2dca [0,2,0,0,0,0|2,0,0]=4 13127 B17R1.24240 CCC(C)CCNCC(=O)c1ccccc1C 040caa1d8c9a6d716123b415234d2f61 [0,2,0,0,0,0|2,0,0]=4 13128 B17R1.24240 CCC(C)CCNCC(=O)c1ccccc1Cl 8c218af035271cd185a71a3d2b8b8074 [0,2,0,0,0,0|2,0,0]=4 13129 B17R1.24240 CCC(C)CCNCC(=O)c1ccccc1F bc9c51fdefdf1f105b1ede4c61e76b9b [0,2,0,0,0,0|2,0,0]=4 13130 B17R1.24240 CCC(C)CCNCC(=O)c1ccccc1I 4870a56bd528e9a30e81579e8981e1cc [0,2,0,0,0,0|2,0,0]=4 13131 B17R1.24240 CCC(C)CCOCC(=O)c1ccccc1C fb8926d71a203e0e5575c0d2e71d1e3d [0,2,0,0,0,0|2,0,0]=4 13132 B17R1.24240 CCC(C)CCOCC(=O)c1ccccc1Cl 2261085ce759d297c41218c734ba5745 [0,2,0,0,0,0|2,0,0]=4 13133 B17R1.24240 CCC(C)CCOCC(=O)c1ccccc1F 5a713df31f7a61307eb7c090ff54ce70 [0,2,0,0,0,0|2,0,0]=4 13134 B17R1.24240 CCC(C)CCOCC(=O)c1ccccc1I c1a90a9d66a0d32918c51aa2585e8413 [0,2,0,0,0,0|2,0,0]=4 13135 B17R1.24240 CCC(C)COCCC(=O)c1ccccc1F 57193aad1f3480facea2f66246610c7f [0,2,0,0,0,0|2,0,0]=4 13136 B17R1.24240 CCC(C)NCCCC(=O)c1ccccc1F a92fd857aa2ffd244cfe310f565cef4b [0,2,0,0,0,0|2,0,0]=4 13137 B17R1.24240 CCC(C)NCCNC(=O)c1ccccc1Cl b20575a6b969f50fa82ae59b19472131 [0,2,0,0,0,0|2,0,0]=4 13138 B17R1.24240 CCC(C)NCCNC(=O)c1ccccc1F 62579ea2b3b48f45124c53c1c7c17805 [0,2,0,0,0,0|2,0,0]=4 13139 B17R1.24240 CCC(C)NCCNC(=O)c1ccccc1I 65d03c04c5c9e139a449a778fd97ed91 [0,2,0,0,0,0|2,0,0]=4 13140 B17R1.24240 CCC(C)OCCCC(=O)c1ccccc1F 2eac1ef136b71592ab70abbbd6b1eb1d [0,2,0,0,0,0|2,0,0]=4 13141 B17R1.24240 CCC(C)OCCNC(=O)c1ccccc1Br 91f49b68802ce91bd000c54c5ece7dc8 [0,2,0,0,0,0|2,0,0]=4 13142 B17R1.24240 CCC(O)CNCCC(=O)c1ccccc1F 3a1715be41df7e73ef7f611280df068b [0,2,0,0,0,0|2,0,0]=4 13143 B17R1.24240 CCC(S)CCOCC(=O)c1ccccc1Br ddb0c5766e7cb89a5250aaf29f2bc63d [0,2,0,0,0,0|2,0,0]=4 13144 B17R1.24240 CCC(S)CCOCC(=O)c1ccccc1C 2d093c6b0093557ab817a2f97daa144a [0,2,0,0,0,0|2,0,0]=4 13145 B17R1.24240 CCC(S)CCOCC(=O)c1ccccc1Cl 8f08f5c16a8cdbdbf38e4385699c8ebd [0,2,0,0,0,0|2,0,0]=4 13146 B17R1.24240 CCC(S)CCOCC(=O)c1ccccc1F 4556bd3b46730110718f8a6348fd0c51 [0,2,0,0,0,0|2,0,0]=4 13147 B17R1.24240 CCC(S)CCOCC(=O)c1ccccc1I 6329bacb7e9bcaa6fc710de8dfe4f299 [0,2,0,0,0,0|2,0,0]=4 13148 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1Br 4432a7f11d0683577cc3358dd3a3aba8 [0,2,0,0,0,0|2,0,0]=4 13149 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1C 81e8e8831180274b22a90363e7bb2c05 [0,2,0,0,0,0|2,0,0]=4 13150 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1Cl 030f95a507d63edaa8bc946173b62a52 [0,2,0,0,0,0|2,0,0]=4 13151 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1F bec5c947c57ca45231fdef06b7377986 [0,2,0,0,0,0|2,0,0]=4 13152 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1I b8e3f8498c3a42b5ea5e7b0cf62c4ff3 [0,2,0,0,0,0|2,0,0]=4 13153 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1O a372de2d1fef5613ad75eacb6234ad72 [0,2,0,0,0,0|2,0,0]=4 13154 B17R1.24240 CCN(C)CCCNC(=O)c1ccccc1S d158cf4b31ccca2f1cc95c19a8104b0d [0,2,0,0,0,0|2,0,0]=4 13155 B17R1.24240 CC[C@@H](C)COCCC(=O)c1ccccc1F 2bbef9a2ba6b3dbd08ae35b42d7ecdd7 [0,2,0,0,0,0|2,0,0]=4 13156 B17R1.24240 CC[C@@H](C)NCCCC(=O)c1ccccc1F c914fbc1ba25a928826aef862a9ccb5b [0,2,0,0,0,0|2,0,0]=4 13157 B17R1.24240 CC[C@@H](C)OCCCC(=O)c1ccccc1F 737495bee5ff8b93dd1cc265ed39ffa3 [0,2,0,0,0,0|2,0,0]=4 13158 B17R1.24240 CC[C@@H](O)CNCCC(=O)c1ccccc1F d5786dd710d955ab38c486bf94efaf31 [0,2,0,0,0,0|2,0,0]=4 13159 B17R1.24240 CC[C@H](C)CCOCC(=O)c1ccccc1C aa924e1e29ba16453c9dd37be5e6cedb [0,2,0,0,0,0|2,0,0]=4 13160 B17R1.24240 CC[C@H](C)CCOCC(=O)c1ccccc1Cl 1668efa46f876b28e4287d2ae948b2e2 [0,2,0,0,0,0|2,0,0]=4 13161 B17R1.24240 CC[C@H](C)CCOCC(=O)c1ccccc1F 1809aeb084302fe25525ce529886608c [0,2,0,0,0,0|2,0,0]=4 13162 B17R1.24240 CC[C@H](C)CCOCC(=O)c1ccccc1I d6f67db92878809427195e2467adceb6 [0,2,0,0,0,0|2,0,0]=4 13163 B17R1.24240 CC[C@H](C)COCCC(=O)c1ccccc1F d52f9f86f0afb2ab77f9a641762ae8b0 [0,2,0,0,0,0|2,0,0]=4 13164 B17R1.24240 CC[C@H](C)NCCCC(=O)c1ccccc1F 598caacd1580dd06ac2b722f75b67aa1 [0,2,0,0,0,0|2,0,0]=4 13165 B17R1.24240 CC[C@H](C)OCCCC(=O)c1ccccc1F dc3f17da36c7e057743148d2070bff4e [0,2,0,0,0,0|2,0,0]=4 13166 B17R1.24240 Cc1ccccc1C(=O)NCCCC(C)CO 82f735f4d6d5ec6fffb424e2f02d10fa [0,2,0,0,0,0|2,0,0]=4 13167 B17R1.25170 CCCCCCOC(C)(C)c1ccccc1C e8089d51ce18605f3bd7b9a5e02d5815 [0,2,0,0,0,0|1,0,1]=4 13168 B17R1.25170 CCCCCCOC(C)(C)c1ccccc1Cl 4258060e100c240dff03524bd718b2f1 [0,2,0,0,0,0|1,0,1]=4 13169 B17R1.25170 CCCCCCOC(C)(C)c1ccccc1F 53a6c809f372df7849caaa80d65632fb [0,2,0,0,0,0|1,0,1]=4 13170 B17R1.25170 CCCCCCOC(C)(C)c1ccccc1I dedf1dbd0106e070bacf4b53dec8bb89 [0,2,0,0,0,0|1,0,1]=4 13171 B17R1.9267 C#Cc1ccccc1C(=O)NCCCCCC b83139b6c290da7a3f55f2b61c6ad103 [0,2,0,0,0,0|1,0,0]=3 13172 B17R1.9267 C#Cc1ccccc1C(=O)NCCCCCCl ee33a1b51a9cfd6b56f392ae1a1d0184 [0,2,0,0,0,0|2,0,0]=4 13173 B17R1.9267 C#Cc1ccccc1C(=O)NCCCCCO 198c8e64398f28bdc7498394e8a7e4b0 [0,2,0,0,0,0|2,0,0]=4 13174 B17R1.9267 C#Cc1ccccc1C(=O)NCCCCOC 5552828f9361b176c7eb078bfe19c1eb [0,2,0,0,0,0|2,0,0]=4 13175 B17R1.9267 C#Cc1ccccc1C(=O)NCCCCSC ec7e358242edb6ca066d61a2745cce40 [0,2,0,0,0,0|2,0,0]=4 13176 B17R1.9267 C#Cc1ccccc1C(=O)NCCCOCC 241c064105aa2859b2a4860cedb23397 [0,2,0,0,0,0|2,0,0]=4 13177 B17R1.9267 C#Cc1ccccc1C(=O)NCCOCCC d33e60780903053bb0dcefc720b04aa8 [0,2,0,0,0,0|2,0,0]=4 13178 B17R1.9267 C=Cc1ccccc1C(=O)NCCCCCC 182a03a3facb68498a81933cac5616bc [0,2,0,0,0,0|1,0,0]=3 13179 B17R1.9267 C=Cc1ccccc1C(=O)NCCCCCCl 596b7e42f984438ab1698cd7cfccc55c [0,2,0,0,0,0|2,0,0]=4 13180 B17R1.9267 C=Cc1ccccc1C(=O)NCCCCCO 1b3e6dac4b344318827a394b1df3e809 [0,2,0,0,0,0|2,0,0]=4 13181 B17R1.9267 C=Cc1ccccc1C(=O)NCCCCOC b8a53a223a40cd9716f3b274a75928fc [0,2,0,0,0,0|2,0,0]=4 13182 B17R1.9267 C=Cc1ccccc1C(=O)NCCCCSC 4c242d5c6b30b61883c5e1d03d58adda [0,2,0,0,0,0|2,0,0]=4 13183 B17R1.9267 C=Cc1ccccc1C(=O)NCCCOCC 613dd82dc625eb4787cbc52eed5aa66c [0,2,0,0,0,0|2,0,0]=4 13184 B17R1.9267 C=Cc1ccccc1C(=O)NCCOCCC 8f335ac41ff214ab839a26cab3adca2b [0,2,0,0,0,0|2,0,0]=4 13185 B17R1.9267 CCCCCCNC(=O)c1ccccc1C#N b984708d3327ea36f755e4459a499be7 [0,2,0,0,0,0|1,0,0]=3 13186 B17R1.9267 CCCCCCNC(=O)c1ccccc1C=O b20d6ee3c62e79cdd0f2dc92d0b3056d [0,2,0,0,0,0|1,0,0]=3 13187 B17R1.9267 CCCCCCNC(=O)c1ccccc1CC 438808f9ba13bb8b2e2fb2b06b5ca542 [0,2,0,0,0,0|1,0,0]=3 13188 B17R1.9267 CCCCCCNC(=O)c1ccccc1CO 20bd5df176f5857db9836603c148e10e [0,2,0,0,0,0|1,0,0]=3 13189 B17R1.9267 CCCCCCNC(=O)c1ccccc1OC 8d16610d51244c251b89a75f6fff7aa3 [0,2,0,0,0,0|1,0,0]=3 13190 B17R1.9267 CCCCCCNC(=O)c1ccccc1SC 9787b8c35c124f20add85c239a1f4ac6 [0,2,0,0,0,0|1,0,0]=3 13191 B17R1.9267 CCCCCCNC(=O)c1cccnc1C#N 578a8a565a925534ec9743f841cf3b74 [0,2,0,0,0,0|2,0,0]=4 13192 B17R1.9267 CCCCCCNC(=O)c1cccnc1C=O f52ef244daa1e80549d911036909bbc6 [0,2,0,0,0,0|2,0,0]=4 13193 B17R1.9267 CCCCCCNC(=O)c1cccnc1CC 598e5db7742df295a2fa878dcae50197 [0,2,0,0,0,0|2,0,0]=4 13194 B17R1.9267 CCCCCCNC(=O)c1cccnc1OC bb2fe3a164df06ac14390ea9db938214 [0,2,0,0,0,0|2,0,0]=4 13195 B17R1.9267 CCCCCCNC(=O)c1cccnc1SC 9d6f4f6ba4898dfcc7d20c5ad43aba45 [0,2,0,0,0,0|2,0,0]=4 13196 B17R1.9267 CCCCCCNC(=O)c1ccncc1C#N c6e416009b062999829f4d0eb1a50ee5 [0,2,0,0,0,0|2,0,0]=4 13197 B17R1.9267 CCCCCCNC(=O)c1ccncc1CC a6b1f33133a0a2edb7f0d5440dd258b8 [0,2,0,0,0,0|2,0,0]=4 13198 B17R1.9267 CCCCCCNC(=O)c1ccncc1OC fbe4da014d76c0d94726bf0a7bac9d29 [0,2,0,0,0,0|2,0,0]=4 13199 B17R1.9267 CCCCCCNC(=O)c1cnccc1C#N 73f30a50760a62f9e0ca156ccf12268d [0,2,0,0,0,0|2,0,0]=4 13200 B17R1.9267 CCCCCCNC(=O)c1cnccc1CC e6ef76c9e2e96197467fde98b8d9359f [0,2,0,0,0,0|2,0,0]=4 13201 B17R1.9267 CCCCCCNC(=O)c1cnccc1OC ca20689278ac8654f026f8e1e4fb404b [0,2,0,0,0,0|2,0,0]=4 13202 B17R1.9267 CCCCCCNC(=O)c1ncccc1C#N c8a1757ca7c814e893a75a2d1f7b484e [0,2,0,0,0,0|2,0,0]=4 13203 B17R1.9267 CCCCCCNC(=O)c1ncccc1OC 24a6fc01d31c8880a4f74b8ecd071e36 [0,2,0,0,0,0|2,0,0]=4 13204 B17R1.9267 CCCCCCNC(=O)c1ncccc1SC c494878ae2b9d67e0aa5516fc33109c8 [0,2,0,0,0,0|2,0,0]=4 13205 B17R1.9267 CCCCCNCC(=O)c1ccccc1C#N 41a6e0bb9672407e2ee1d8b63f1527a9 [0,2,0,0,0,0|2,0,0]=4 13206 B17R1.9267 CCCCCNCC(=O)c1ccccc1OC 1ae4ce0352fdc8d89824e3ff925606be [0,2,0,0,0,0|2,0,0]=4 13207 B17R1.9267 CCCCCOCC(=O)c1ccccc1C#N 061ed7da3127734afb077bac1a11165a [0,2,0,0,0,0|2,0,0]=4 13208 B17R1.9267 CCCCCOCC(=O)c1ccccc1OC cc35c952ab6b12c6e5f599ce19b861d8 [0,2,0,0,0,0|2,0,0]=4 13209 B17R1.9267 CCCNCCNC(=O)c1ccccc1OC 3eb697c7c739fb0e930ed31c9af0e835 [0,2,0,0,0,0|2,0,0]=4 13210 B17R1.9267 CCCOCCNC(=O)c1ccccc1C#N 09f40e81fe47aa41b34415cecf5d9b86 [0,2,0,0,0,0|2,0,0]=4 13211 B17R1.9267 CCCOCCNC(=O)c1ccccc1C=O 67bb7b27767c6d60a96d76229abf4cc5 [0,2,0,0,0,0|2,0,0]=4 13212 B17R1.9267 CCCOCCNC(=O)c1ccccc1CC eeb4627247863d938ae7a8b9fee3d895 [0,2,0,0,0,0|2,0,0]=4 13213 B17R1.9267 CCCOCCNC(=O)c1ccccc1CO f2e5a0d3617cc11552339c24d41f2c18 [0,2,0,0,0,0|2,0,0]=4 13214 B17R1.9267 CCCOCCNC(=O)c1ccccc1OC e8c1621648d2090cb38b680641039f0e [0,2,0,0,0,0|2,0,0]=4 13215 B17R1.9267 CCCOCCNC(=O)c1ccccc1SC 2b8c3b433a4100633264c92b75c9a6a8 [0,2,0,0,0,0|2,0,0]=4 13216 B17R1.9267 CCOCCCNC(=O)c1ccccc1C#N 1c87e4b1ddb1a98be9634a7d83e221de [0,2,0,0,0,0|2,0,0]=4 13217 B17R1.9267 CCOCCCNC(=O)c1ccccc1C=O 73e9d20ffe70ce7ef38aaf0c018d7a7c [0,2,0,0,0,0|2,0,0]=4 13218 B17R1.9267 CCOCCCNC(=O)c1ccccc1CC 5be7f865540eb12723fb01acd9ae9383 [0,2,0,0,0,0|2,0,0]=4 13219 B17R1.9267 CCOCCCNC(=O)c1ccccc1CO f41c54e53969647027970db51314391c [0,2,0,0,0,0|2,0,0]=4 13220 B17R1.9267 CCOCCCNC(=O)c1ccccc1OC d231e347f1d16e68fb14d2ccaacfb054 [0,2,0,0,0,0|2,0,0]=4 13221 B17R1.9267 CCOCCCNC(=O)c1ccccc1SC eb17819c375cb399d6bde1f9ce3f450e [0,2,0,0,0,0|2,0,0]=4 13222 B17R1.9267 CCc1ccccc1C(=O)NCCCCCCl 91fc75bc0e4c641af65fa251c064bc76 [0,2,0,0,0,0|2,0,0]=4 13223 B17R1.9267 CCc1ccccc1C(=O)NCCCCCO 4819f3a9b73505342213dc0f04bc028a [0,2,0,0,0,0|2,0,0]=4 13224 B17R1.9267 CCc1ccccc1C(=O)NCCCCOC ce683083e97f059dad2eae0ee6ef8374 [0,2,0,0,0,0|2,0,0]=4 13225 B17R1.9267 CCc1ccccc1C(=O)NCCCCSC 748cd8768d5d24ff8afed2fdd568d69e [0,2,0,0,0,0|2,0,0]=4 13226 B17R1.9267 COCCCCNC(=O)c1ccccc1C#N 55f26e61d7f2f4d58fbe4186ab3b5b3a [0,2,0,0,0,0|2,0,0]=4 13227 B17R1.9267 COCCCCNC(=O)c1ccccc1C=O 7c6956a7fa80a3ca49f0f53a97ca9b17 [0,2,0,0,0,0|2,0,0]=4 13228 B17R1.9267 COCCCCNC(=O)c1ccccc1CO e35d66003a7eed9d5fc4b659944ac76b [0,2,0,0,0,0|2,0,0]=4 13229 B17R1.9267 COCCCCNC(=O)c1ccccc1OC 2d62300d9cd054fe0f9e1c9f4e4e3411 [0,2,0,0,0,0|2,0,0]=4 13230 B17R1.9267 COCCCCNC(=O)c1ccccc1SC 4ddcd24e0fe1f5b51e7db9c398f1fb62 [0,2,0,0,0,0|2,0,0]=4 13231 B17R1.9267 COc1ccccc1C(=O)NCCCCCCl c7ac6dd80e4cdda7d646c415816561e5 [0,2,0,0,0,0|2,0,0]=4 13232 B17R1.9267 COc1ccccc1C(=O)NCCCCCO e1d4dda615e3030fca948d95d65ea6aa [0,2,0,0,0,0|2,0,0]=4 13233 B17R1.9267 COc1ccccc1C(=O)NCCCCSC 454ed75864f084882135d70fe68dba7d [0,2,0,0,0,0|2,0,0]=4 13234 B17R1.9267 CSCCCCNC(=O)c1ccccc1C#N 319165f03082bff3d99a887863713580 [0,2,0,0,0,0|2,0,0]=4 13235 B17R1.9267 CSCCCCNC(=O)c1ccccc1C=O 513255da31c9beb61ae88191114fe7fd [0,2,0,0,0,0|2,0,0]=4 13236 B17R1.9267 CSCCCCNC(=O)c1ccccc1CO 7d3454677d8015ecb90a3379a67118b5 [0,2,0,0,0,0|2,0,0]=4 13237 B17R1.9267 CSCCCCNC(=O)c1ccccc1SC 9b090098ac6f698227fef2f92b06413e [0,2,0,0,0,0|2,0,0]=4 13238 B17R1.9267 CSc1ccccc1C(=O)NCCCCCCl 7f4206c98f49ea538ae4437ba0c6fe12 [0,2,0,0,0,0|2,0,0]=4 13239 B17R1.9267 CSc1ccccc1C(=O)NCCCCCO aa37189c7ba392691bfd11ac0438e205 [0,2,0,0,0,0|2,0,0]=4 13240 B17R1.9267 N#Cc1ccccc1C(=O)NCCCCCCl 2b8a95b12a902519778a078d93a2c09c [0,2,0,0,0,0|2,0,0]=4 13241 B17R1.9267 N#Cc1ccccc1C(=O)NCCCCCO 533165ea39ea92c2f57c376d1ba88855 [0,2,0,0,0,0|2,0,0]=4 13242 B17R1.9267 O=C(NCCCCCCl)c1ccccc1CO 926eadf20b3e8f9bd5be4b9082d8a84a [0,2,0,0,0,0|2,0,0]=4 13243 B17R1.9267 O=C(NCCCCCO)c1ccccc1CO 5f828269e01dbfec5c8c8ff758c7d48e [0,2,0,0,0,0|2,0,0]=4 13244 B17R1.9267 O=Cc1ccccc1C(=O)NCCCCCCl 84b5fd3c01ba3a23467f1e5c7e38f0dd [0,2,0,0,0,0|2,0,0]=4 13245 B17R1.9267 O=Cc1ccccc1C(=O)NCCCCCO 540cca8f6b6c541bdb4a71a023f3dba0 [0,2,0,0,0,0|2,0,0]=4 13246 B17R1.269097 CCCCCCNC(=O)c1c(ccc[n+]1[O-])C c5e3c3f09d87ba2f4994ba13ac9745e6 [0,2,0,0,0,0|2,0,0]=4 13247 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Br)Br 625eaa7de54dff0e5e86b5cf1c0bb139 [0,2,0,0,0,0|1,0,0]=3 13248 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Br)C bc7976f3adf4e2c6f589e6f1627dec2d [0,2,0,0,0,0|1,0,0]=3 13249 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Br)Cl 68a64205c834dbf9a08b14c9aae5a6ee [0,2,0,0,0,0|1,0,0]=3 13250 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Br)F e09b89c6195ce1f1afa08bac6aa15a96 [0,2,0,0,0,0|1,0,0]=3 13251 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Br)O 9eec8abcf1a0a50ef3dd57faab7d88aa [0,2,0,0,0,0|1,0,0]=3 13252 B17R1.269097 CCCCCCNC(=O)c1c(cccc1C)C 874edc4a2c0703485dbf4114faf7fd2f [0,2,0,0,0,0|1,0,0]=3 13253 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Cl)C 79e802863bd2708e7c699dd73e32db73 [0,2,0,0,0,0|1,0,0]=3 13254 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Cl)Cl 303a08d971a28d11535b65af4ae1d2ef [0,2,0,0,0,0|1,0,0]=3 13255 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Cl)F e5e9f71e240ae49743ce7ac21fcb10fa [0,2,0,0,0,0|1,0,0]=3 13256 B17R1.269097 CCCCCCNC(=O)c1c(cccc1Cl)O ede4092eb23b8667348ad40e2fa3f280 [0,2,0,0,0,0|1,0,0]=3 13257 B17R1.269097 CCCCCCNC(=O)c1c(cccc1F)C a36a1575ff103709cd4156f8516278dc [0,2,0,0,0,0|1,0,0]=3 13258 B17R1.269097 CCCCCCNC(=O)c1c(cccc1F)F aed9291e88d0aed96c464fa4287e3850 [0,2,0,0,0,0|1,0,0]=3 13259 B17R1.269097 CCCCCCNC(=O)c1c(cccc1F)O 12f6427f11d095b76a4e2ef7eb3d3ee6 [0,2,0,0,0,0|1,0,0]=3 13260 B17R1.269097 CCCCCCNC(=O)c1c(cccc1I)Br afc98fc87061c6dd942eee4a18dd6c61 [0,2,0,0,0,0|1,0,0]=3 13261 B17R1.269097 CCCCCCNC(=O)c1c(cccc1I)C 91e647f0e3bf6e08ca1ffc11b5483af0 [0,2,0,0,0,0|1,0,0]=3 13262 B17R1.269097 CCCCCCNC(=O)c1c(cccc1I)Cl eaa7afafc84a4df6516fa75a40ec82b6 [0,2,0,0,0,0|1,0,0]=3 13263 B17R1.269097 CCCCCCNC(=O)c1c(cccc1I)F 2cf5bd1494c3c3b3d771b29b46013761 [0,2,0,0,0,0|1,0,0]=3 13264 B17R1.269097 CCCCCCNC(=O)c1c(cccc1I)I 62b3f51a01253cc7700b9711e6e513bc [0,2,0,0,0,0|1,0,0]=3 13265 B17R1.269097 CCCCCCNC(=O)c1c(cccc1I)O 1a84224a0dab296c5e8a6f879d4e6100 [0,2,0,0,0,0|1,0,0]=3 13266 B17R1.269097 CCCCCCNC(=O)c1c(cccc1O)C 5fc5eae459b30ba3b4c731fdf10a5954 [0,2,0,0,0,0|1,0,0]=3 13267 B17R1.269097 CCCCCCNC(=O)c1c(cccc1O)O 290625d724fdd0af1570ce60e617be10 [0,2,0,0,0,0|1,0,0]=3 13268 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Br)Br 74099f6a4745a23bf36383725860a357 [0,2,0,0,0,0|2,0,0]=4 13269 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Br)C 7b258ea0f8b3d8106e5f606095b85cbc [0,2,0,0,0,0|2,0,0]=4 13270 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Br)Cl 3175fb4c7598b1a3be438ba502cfdd2a [0,2,0,0,0,0|2,0,0]=4 13271 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Br)F 6d89432a3b09c7df68f692aff651e36c [0,2,0,0,0,0|2,0,0]=4 13272 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Br)O b2b869c54e0daa4404b5c7665d4827a6 [0,2,0,0,0,0|2,0,0]=4 13273 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1C)Br 8352172d78fbe18c066b9d94d119fcba [0,2,0,0,0,0|2,0,0]=4 13274 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1C)C ef943de999d881ea145669c0c4f4878a [0,2,0,0,0,0|2,0,0]=4 13275 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1C)O ef4245b248ebdec48e6e6968f6cf8905 [0,2,0,0,0,0|2,0,0]=4 13276 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Cl)Br b4811b2985a875f8000ca52af5d64de0 [0,2,0,0,0,0|2,0,0]=4 13277 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Cl)C 66de8029bebd1751d63538a58ff0de4a [0,2,0,0,0,0|2,0,0]=4 13278 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Cl)Cl 4beb4aa46f1ad3440c1d78dfa305add7 [0,2,0,0,0,0|2,0,0]=4 13279 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Cl)F a76bee1d899bf36f3cee75395bf6e674 [0,2,0,0,0,0|2,0,0]=4 13280 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1Cl)I 3337b2cc3f5c5a3edb7325a8031495f6 [0,2,0,0,0,0|2,0,0]=4 13281 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1F)Br cdfac8cb0ba835c9819648a1bdae94af [0,2,0,0,0,0|2,0,0]=4 13282 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1F)C bf4685c49a02ce291bf500a0a798bfa2 [0,2,0,0,0,0|2,0,0]=4 13283 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1F)Cl 3516ff9c02433423d7c4f608b0b9acd1 [0,2,0,0,0,0|2,0,0]=4 13284 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1F)F 626d1b1b09fee9de76048912df97177b [0,2,0,0,0,0|2,0,0]=4 13285 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1F)I f31d552ecca766f60424de161ebfc997 [0,2,0,0,0,0|2,0,0]=4 13286 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1I)Cl 5edb1321a6433b0862045a90f579baf6 [0,2,0,0,0,0|2,0,0]=4 13287 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1O)C 5b2ffafade28e890f3a04a4b5df439fa [0,2,0,0,0,0|2,0,0]=4 13288 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1O)Cl 09be79bde76c96991f1e8a4f876f965f [0,2,0,0,0,0|2,0,0]=4 13289 B17R1.269097 CCCCCCNC(=O)c1c(ccnc1O)F 71e8176f57bd3da0d1521e0b9b471500 [0,2,0,0,0,0|2,0,0]=4 13290 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Br)Br 5baf1e273bbd90180ae4fcd32b12db71 [0,2,0,0,0,0|2,0,0]=4 13291 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Br)C d4336d4dcdd15f708533bd6883815ac0 [0,2,0,0,0,0|2,0,0]=4 13292 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Br)Cl 5b126acb79ff8aad8c463ccea6336f96 [0,2,0,0,0,0|2,0,0]=4 13293 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Br)F ed3ce7188b357e9f10a80cd687d1394a [0,2,0,0,0,0|2,0,0]=4 13294 B17R1.269097 CCCCCCNC(=O)c1c(cncc1C)C ac9e61ec108369026ed2c15243a213bb [0,2,0,0,0,0|2,0,0]=4 13295 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Cl)C 11a54de32fac5332d43344bbf7ad3601 [0,2,0,0,0,0|2,0,0]=4 13296 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Cl)Cl 9fb895f7d312993625d9e630d5bbcf5d [0,2,0,0,0,0|2,0,0]=4 13297 B17R1.269097 CCCCCCNC(=O)c1c(cncc1Cl)F 968f380df673eb6f7f7722e9ef8835f9 [0,2,0,0,0,0|2,0,0]=4 13298 B17R1.269097 CCCCCCNC(=O)c1c(cncc1F)C a7aff4799d47839ebfc46882ca562ec8 [0,2,0,0,0,0|2,0,0]=4 13299 B17R1.269097 CCCCCCNC(=O)c1c(cncc1F)F 1a258ac067a39b61ec13724c76c13161 [0,2,0,0,0,0|2,0,0]=4 13300 B17R1.269097 CCCCCCNC(=O)c1c(cncc1I)Br 0d732357820b49e3de28a27e34c79f12 [0,2,0,0,0,0|2,0,0]=4 13301 B17R1.269097 CCCCCCOC(C)c1c(cccc1C)C 3766a5cda5f89769c21ff4e14f94c5c0 [0,2,0,0,0,0|1,0,1]=4 13302 B17R1.269097 CCCCCCOC(C)c1c(cccc1Cl)C bafbf0eb65650877395f6279647788fd [0,2,0,0,0,0|1,0,1]=4 13303 B17R1.269097 CCCCCCOC(C)c1c(cccc1Cl)Cl 355c4619395a95d2cc6ad0e25406edfc [0,2,0,0,0,0|1,0,1]=4 13304 B17R1.269097 CCCCCCOC(C)c1c(cccc1Cl)F 5aca787327c11c57698c4702ba7ae960 [0,2,0,0,0,0|1,0,1]=4 13305 B17R1.269097 CCCCCCOC(C)c1c(cccc1F)F 189bebbfd41a2a4e85b0888319add637 [0,2,0,0,0,0|1,0,1]=4 13306 B17R1.269097 CCCCCCO[C@@H](C)c1c(cccc1Cl)Cl e3b39dd11067f20fb99e896ec6ac411a [0,2,0,0,0,0|1,0,1]=4 13307 B17R1.269097 CCCCCCO[C@@H](C)c1c(cccc1F)F b65b937e4962358d813b46ea9798a59f [0,2,0,0,0,0|1,0,1]=4 13308 B17R1.269097 CCCCCCO[C@H](C)c1c(cccc1Cl)Cl ff97c63779a6e8ffb40b734ffd2c588a [0,2,0,0,0,0|1,0,1]=4 13309 B17R1.269097 CCCCCCO[C@H](C)c1c(cccc1Cl)F d221b479a58bebd966ddf1495fb15ed3 [0,2,0,0,0,0|1,0,1]=4 13310 B17R1.269097 CCCCCNCC(=O)c1c(cccc1Cl)Cl f8c2b39536ace1dac5d12be49032f0db [0,2,0,0,0,0|2,0,0]=4 13311 B17R1.269097 CCCCCNCC(=O)c1c(cccc1F)F d041519760575ba1155340e19a539523 [0,2,0,0,0,0|2,0,0]=4 13312 B17R1.269097 CCCCCOCC(=O)c1c(cccc1F)F 7980a02bf75dca00441fe342712e82b1 [0,2,0,0,0,0|2,0,0]=4 13313 B17R1.269097 CCCCCOCC(=O)c1c(cccc1O)O 3cd1ee9e8538f3cf671b024799f09238 [0,2,0,0,0,0|2,0,0]=4 13314 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Br)Br 7a94d5333443e8c53a890032ce66b7f6 [0,2,0,0,0,0|2,0,0]=4 13315 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Br)C 9543d5677d67ef99f2b39749c1a2d9a6 [0,2,0,0,0,0|2,0,0]=4 13316 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Br)Cl 121348c2c9059801204972607d81bcbd [0,2,0,0,0,0|2,0,0]=4 13317 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Br)F 27413f0033360b069a66ba95de57bbf3 [0,2,0,0,0,0|2,0,0]=4 13318 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Br)O fce5d35f0d18b96991df18cf15dc0d91 [0,2,0,0,0,0|2,0,0]=4 13319 B17R1.269097 CCCOCCNC(=O)c1c(cccc1C)C c3c4bdcc20d4ede7de58e3d64ea1c943 [0,2,0,0,0,0|2,0,0]=4 13320 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Cl)C c49bd3ff3acd2c52b60ed2f5afed0a15 [0,2,0,0,0,0|2,0,0]=4 13321 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Cl)Cl dbdd802533f80080480cefc8a63cb843 [0,2,0,0,0,0|2,0,0]=4 13322 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Cl)F f878e6681a38170e39e985845f705d98 [0,2,0,0,0,0|2,0,0]=4 13323 B17R1.269097 CCCOCCNC(=O)c1c(cccc1Cl)O 73fac53673cfb53123b51b57c6e41079 [0,2,0,0,0,0|2,0,0]=4 13324 B17R1.269097 CCCOCCNC(=O)c1c(cccc1F)C fdb12787e035613a85835697ce427d46 [0,2,0,0,0,0|2,0,0]=4 13325 B17R1.269097 CCCOCCNC(=O)c1c(cccc1F)F 89bf571ba7280025fd2938dae1d7c500 [0,2,0,0,0,0|2,0,0]=4 13326 B17R1.269097 CCCOCCNC(=O)c1c(cccc1F)O ffdeacfbf130dc941d34efebca152ed9 [0,2,0,0,0,0|2,0,0]=4 13327 B17R1.269097 CCCOCCNC(=O)c1c(cccc1I)Br 6cdc9c172b90964cb6605a50f5030605 [0,2,0,0,0,0|2,0,0]=4 13328 B17R1.269097 CCCOCCNC(=O)c1c(cccc1I)C d8c48f232ab1f0ef56502cac24a2b21e [0,2,0,0,0,0|2,0,0]=4 13329 B17R1.269097 CCCOCCNC(=O)c1c(cccc1I)Cl df1d5ddf56a976b0ad59a5d1b5d7cad6 [0,2,0,0,0,0|2,0,0]=4 13330 B17R1.269097 CCCOCCNC(=O)c1c(cccc1I)F 4ba806a0dbadcadff01490054819f4ba [0,2,0,0,0,0|2,0,0]=4 13331 B17R1.269097 CCCOCCNC(=O)c1c(cccc1I)I 75dc29e3edc607a19f6fd169384f47e0 [0,2,0,0,0,0|2,0,0]=4 13332 B17R1.269097 CCCOCCNC(=O)c1c(cccc1I)O 5299422426ea99aa1d9ed1ec19c12c47 [0,2,0,0,0,0|2,0,0]=4 13333 B17R1.269097 CCCOCCNC(=O)c1c(cccc1O)C c676c9c3078269541db0a8c382b198ce [0,2,0,0,0,0|2,0,0]=4 13334 B17R1.269097 CCCOCCNC(=O)c1c(cccc1O)O e380c664cc6ea6374482d4364ce00676 [0,2,0,0,0,0|2,0,0]=4 13335 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Br)Br c190cdb7af19e120f3096f67e27def99 [0,2,0,0,0,0|2,0,0]=4 13336 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Br)C 8f7d1bb6eb394690a703df02b7f9d2f3 [0,2,0,0,0,0|2,0,0]=4 13337 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Br)Cl c4d5318256899773d4366173288d42ae [0,2,0,0,0,0|2,0,0]=4 13338 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Br)F f73babc48b3993096dd2af3016af3038 [0,2,0,0,0,0|2,0,0]=4 13339 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Br)O 456cb9db2bf21df3a3f362d58ed3c8bd [0,2,0,0,0,0|2,0,0]=4 13340 B17R1.269097 CCOCCCNC(=O)c1c(cccc1C)C 07f7ec8e53a1d020a259e35721d057af [0,2,0,0,0,0|2,0,0]=4 13341 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Cl)C 795183cfb06efebff2d0e60e86de8409 [0,2,0,0,0,0|2,0,0]=4 13342 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Cl)Cl 4393f0b6920d2ee4bfb7cd0003cc2bdb [0,2,0,0,0,0|2,0,0]=4 13343 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Cl)F e79cdf563cbdcedb5e982fe8c0720ec6 [0,2,0,0,0,0|2,0,0]=4 13344 B17R1.269097 CCOCCCNC(=O)c1c(cccc1Cl)O aaa564b3cb6e0c99f71b06de208d4507 [0,2,0,0,0,0|2,0,0]=4 13345 B17R1.269097 CCOCCCNC(=O)c1c(cccc1F)C 19cf22b6bcb32af0567930e6c40fe54b [0,2,0,0,0,0|2,0,0]=4 13346 B17R1.269097 CCOCCCNC(=O)c1c(cccc1F)F 62474156e448ea59591ac430d5b9b5e9 [0,2,0,0,0,0|2,0,0]=4 13347 B17R1.269097 CCOCCCNC(=O)c1c(cccc1F)O 2bd3db73c555a8e4a7b603b61eafb9d7 [0,2,0,0,0,0|2,0,0]=4 13348 B17R1.269097 CCOCCCNC(=O)c1c(cccc1I)Br adec9c0b41338e56d7673415af111e58 [0,2,0,0,0,0|2,0,0]=4 13349 B17R1.269097 CCOCCCNC(=O)c1c(cccc1I)C 747ec9d12502e7151ff348d5fd80883b [0,2,0,0,0,0|2,0,0]=4 13350 B17R1.269097 CCOCCCNC(=O)c1c(cccc1I)Cl 7f25c876af390b793f764981ead5f127 [0,2,0,0,0,0|2,0,0]=4 13351 B17R1.269097 CCOCCCNC(=O)c1c(cccc1I)F b00b5cb4da699a65f3366a30bcd19abe [0,2,0,0,0,0|2,0,0]=4 13352 B17R1.269097 CCOCCCNC(=O)c1c(cccc1I)I 6035aee6f9ef6fdc7915f059084bfbdc [0,2,0,0,0,0|2,0,0]=4 13353 B17R1.269097 CCOCCCNC(=O)c1c(cccc1I)O 1aa07cc412294b445daae4cd428ba93e [0,2,0,0,0,0|2,0,0]=4 13354 B17R1.269097 CCOCCCNC(=O)c1c(cccc1O)C efc078b6025a99c797218e7c1b0d9885 [0,2,0,0,0,0|2,0,0]=4 13355 B17R1.269097 CCOCCCNC(=O)c1c(cccc1O)O 0701a17112bafe12e41cd15b9e517235 [0,2,0,0,0,0|2,0,0]=4 13356 B17R1.269097 COCCCCNC(=O)c1c(cccc1Br)Br e7287f8d662216e199cacc4e6a66ef9a [0,2,0,0,0,0|2,0,0]=4 13357 B17R1.269097 COCCCCNC(=O)c1c(cccc1Br)C 40939648cc4a4dc267efecbe38b98e7a [0,2,0,0,0,0|2,0,0]=4 13358 B17R1.269097 COCCCCNC(=O)c1c(cccc1Br)Cl 3eb47159aad1311a1c96ced565285bbe [0,2,0,0,0,0|2,0,0]=4 13359 B17R1.269097 COCCCCNC(=O)c1c(cccc1Br)F 366d99d0178f7e2ab897f4eec5bb92a1 [0,2,0,0,0,0|2,0,0]=4 13360 B17R1.269097 COCCCCNC(=O)c1c(cccc1Br)O 385dc97594a2abd38d0af84e24faafe6 [0,2,0,0,0,0|2,0,0]=4 13361 B17R1.269097 COCCCCNC(=O)c1c(cccc1C)C a045f33fca9f385a7fa1efcaa9756fcf [0,2,0,0,0,0|2,0,0]=4 13362 B17R1.269097 COCCCCNC(=O)c1c(cccc1Cl)C d5a9aa782a9cb8f5d179c10bfe18e9ce [0,2,0,0,0,0|2,0,0]=4 13363 B17R1.269097 COCCCCNC(=O)c1c(cccc1Cl)Cl 1cfc8ad0c979b765b3686e963982c461 [0,2,0,0,0,0|2,0,0]=4 13364 B17R1.269097 COCCCCNC(=O)c1c(cccc1Cl)F ececc8e0fd8f12f89f40cf1bf3fcde75 [0,2,0,0,0,0|2,0,0]=4 13365 B17R1.269097 COCCCCNC(=O)c1c(cccc1Cl)O 184de6a3bfcb6a61e44b802fb7795169 [0,2,0,0,0,0|2,0,0]=4 13366 B17R1.269097 COCCCCNC(=O)c1c(cccc1F)C cf8bd49a862cdc71443903aa07276cdb [0,2,0,0,0,0|2,0,0]=4 13367 B17R1.269097 COCCCCNC(=O)c1c(cccc1F)F 71cbdf0adb9f78e06c3aca145564cca4 [0,2,0,0,0,0|2,0,0]=4 13368 B17R1.269097 COCCCCNC(=O)c1c(cccc1F)O 3c43b2b41f81106da8a0284f38f00852 [0,2,0,0,0,0|2,0,0]=4 13369 B17R1.269097 COCCCCNC(=O)c1c(cccc1I)Br d55a11b31c19849fe8700eabda48a782 [0,2,0,0,0,0|2,0,0]=4 13370 B17R1.269097 COCCCCNC(=O)c1c(cccc1I)C befb0b4df4f7350ec3ddc79b8339ab82 [0,2,0,0,0,0|2,0,0]=4 13371 B17R1.269097 COCCCCNC(=O)c1c(cccc1I)Cl a92ea8b20f1029a96c7c1cbeb386eb14 [0,2,0,0,0,0|2,0,0]=4 13372 B17R1.269097 COCCCCNC(=O)c1c(cccc1I)F 25cff2667a0a206ab673d270a99eb050 [0,2,0,0,0,0|2,0,0]=4 13373 B17R1.269097 COCCCCNC(=O)c1c(cccc1I)I 2b6019cadb7b7cb9d186764065a74a7c [0,2,0,0,0,0|2,0,0]=4 13374 B17R1.269097 COCCCCNC(=O)c1c(cccc1I)O 0867fc8520fba9cac74aa77e8b10d5ef [0,2,0,0,0,0|2,0,0]=4 13375 B17R1.269097 COCCCCNC(=O)c1c(cccc1O)C 268fcb8d6ca9202e62e23f037fc8b7d7 [0,2,0,0,0,0|2,0,0]=4 13376 B17R1.269097 COCCCCNC(=O)c1c(cccc1O)O a387c399bb50b30b97bbd0cbb9249c76 [0,2,0,0,0,0|2,0,0]=4 13377 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Br)Br 3b3fb89565fce84cd7e3795677f90cda [0,2,0,0,0,0|2,0,0]=4 13378 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Br)C 0b928b1c29f6d9a97e8e2c2daba8ef31 [0,2,0,0,0,0|2,0,0]=4 13379 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Br)Cl 7c930b999280e44fc8e056b9942d1706 [0,2,0,0,0,0|2,0,0]=4 13380 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Br)F c23dee60c08b2b360403d3e399d9511a [0,2,0,0,0,0|2,0,0]=4 13381 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Br)O c25b284172ffea8fde7b0ff65ab1eded [0,2,0,0,0,0|2,0,0]=4 13382 B17R1.269097 CSCCCCNC(=O)c1c(cccc1C)C 66df55b78120a4a57d2a44e5794cac01 [0,2,0,0,0,0|2,0,0]=4 13383 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Cl)C 9fce574545e201ebfdc1d4ec23bcd42f [0,2,0,0,0,0|2,0,0]=4 13384 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Cl)Cl 4015bc86924aa03a742cd381829fa6ca [0,2,0,0,0,0|2,0,0]=4 13385 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Cl)F 88036eb7426b9ad3533355640d36df64 [0,2,0,0,0,0|2,0,0]=4 13386 B17R1.269097 CSCCCCNC(=O)c1c(cccc1Cl)O 7b083edbe087aea37f0d400c7dd4ce0a [0,2,0,0,0,0|2,0,0]=4 13387 B17R1.269097 CSCCCCNC(=O)c1c(cccc1F)C 9ebc0815523f80dcaaac5805faa8ca55 [0,2,0,0,0,0|2,0,0]=4 13388 B17R1.269097 CSCCCCNC(=O)c1c(cccc1F)F 0caed412a161ab474809c54d0f4d0f67 [0,2,0,0,0,0|2,0,0]=4 13389 B17R1.269097 CSCCCCNC(=O)c1c(cccc1F)O 8907631c9cab9e28787084535894ec57 [0,2,0,0,0,0|2,0,0]=4 13390 B17R1.269097 CSCCCCNC(=O)c1c(cccc1I)Br 02d981df814e217d3340f146e7688501 [0,2,0,0,0,0|2,0,0]=4 13391 B17R1.269097 CSCCCCNC(=O)c1c(cccc1I)C 545a8b5978d47b5ab3f3b4f26dee3c9e [0,2,0,0,0,0|2,0,0]=4 13392 B17R1.269097 CSCCCCNC(=O)c1c(cccc1I)Cl 88201e169f034149d4dcc4fa39c5da19 [0,2,0,0,0,0|2,0,0]=4 13393 B17R1.269097 CSCCCCNC(=O)c1c(cccc1I)F 38ef663135c1ab488ca7b4051396d97b [0,2,0,0,0,0|2,0,0]=4 13394 B17R1.269097 CSCCCCNC(=O)c1c(cccc1I)I ed4a7af9247c2b05f40bf0b196d9fb64 [0,2,0,0,0,0|2,0,0]=4 13395 B17R1.269097 CSCCCCNC(=O)c1c(cccc1I)O 81fbcbf3b5df4c32758b1ce3ee81d40e [0,2,0,0,0,0|2,0,0]=4 13396 B17R1.269097 CSCCCCNC(=O)c1c(cccc1O)C 976d6aea872b04f37fcaf43916a1140a [0,2,0,0,0,0|2,0,0]=4 13397 B17R1.269097 CSCCCCNC(=O)c1c(cccc1O)O 61a876888cb07b53ea2c797e29fd3350 [0,2,0,0,0,0|2,0,0]=4 13398 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCCl)Br 2e039f93466cbbb5d6e0c717676974c6 [0,2,0,0,0,0|2,0,0]=4 13399 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCCl)C e2fa17f2886fd45bd82848cac83d4a56 [0,2,0,0,0,0|2,0,0]=4 13400 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCCl)Cl 7e1066950227d4c499f3871bad052f95 [0,2,0,0,0,0|2,0,0]=4 13401 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCCl)F e110df66e62478774cdc436c727df967 [0,2,0,0,0,0|2,0,0]=4 13402 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCCl)I 9033146a1ebb71b1c91a163ec6867d4f [0,2,0,0,0,0|2,0,0]=4 13403 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCCl)O f1f137c5dd8860c9b1c3af03a528cc97 [0,2,0,0,0,0|2,0,0]=4 13404 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCO)Br 94a161b732e1c80190ca2f13ff221d39 [0,2,0,0,0,0|2,0,0]=4 13405 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCO)C eb9c8ba5b3d248bb3ae859382bf640b5 [0,2,0,0,0,0|2,0,0]=4 13406 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCO)Cl 3170a2ebb84f05722e25b7cfaf50633d [0,2,0,0,0,0|2,0,0]=4 13407 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCO)F eeb4760c046c3e00183dedac1fc4e95c [0,2,0,0,0,0|2,0,0]=4 13408 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCO)I 62e417b9cd071d239af4479f15ce7619 [0,2,0,0,0,0|2,0,0]=4 13409 B17R1.269097 Cc1cccc(c1C(=O)NCCCCCO)O 86e7d3a9755d35ef9192d6c29645b097 [0,2,0,0,0,0|2,0,0]=4 13410 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Br)Br 667a7b6983bcf7472963ad43e4133c9e [0,2,0,0,0,0|2,0,0]=4 13411 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Br)Cl acfd4c92880e37d04679ca3fd159867f [0,2,0,0,0,0|2,0,0]=4 13412 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Br)F 880e0803aa04cf59fdb0f743f20e0e16 [0,2,0,0,0,0|2,0,0]=4 13413 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Br)O 21583c8dd4e6773115e8529c466420a2 [0,2,0,0,0,0|2,0,0]=4 13414 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Cl)Cl ed43cd1ce80cf1d00a78b5784549e5de [0,2,0,0,0,0|2,0,0]=4 13415 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Cl)F 90fe72a337a418e9b19f37c1762347f7 [0,2,0,0,0,0|2,0,0]=4 13416 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1Cl)O da8e4191ba53140ff4c07be6f4bb311e [0,2,0,0,0,0|2,0,0]=4 13417 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1F)F faecf508231cc27b594d67fd05b92069 [0,2,0,0,0,0|2,0,0]=4 13418 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1F)O 9577e755016a70ff337b3dc1abf490f9 [0,2,0,0,0,0|2,0,0]=4 13419 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1I)Br 676b323386ca00700b530b8386f50c5c [0,2,0,0,0,0|2,0,0]=4 13420 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1I)Cl 8efce121743c692853657953d1df23d0 [0,2,0,0,0,0|2,0,0]=4 13421 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1I)F 272989a0662ce853fdf7074d74d56def [0,2,0,0,0,0|2,0,0]=4 13422 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1I)I dffb9adf373dd8bec4378412b57def6a [0,2,0,0,0,0|2,0,0]=4 13423 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1I)O 6bd940cac53f7bc357d19548fa05fa1c [0,2,0,0,0,0|2,0,0]=4 13424 B17R1.269097 O=C(NCCCCCCl)c1c(cccc1O)O ee2080ba646abfdda20f0eeb04000df6 [0,2,0,0,0,0|2,0,0]=4 13425 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Br)Br 495dea85d4ba8380622a040dc4638b42 [0,2,0,0,0,0|2,0,0]=4 13426 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Br)Cl 2fce939187f197468277607ecd7d89a3 [0,2,0,0,0,0|2,0,0]=4 13427 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Br)F 4d85435dd7af915cacd5fa68632c19f7 [0,2,0,0,0,0|2,0,0]=4 13428 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Br)O edfcea7efd5f278c5198f3512a69c987 [0,2,0,0,0,0|2,0,0]=4 13429 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Cl)Cl 0219e4d86cd9e512993b0d4dde6edf75 [0,2,0,0,0,0|2,0,0]=4 13430 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Cl)F 6089893f6ca553b09b0025c7913f1f95 [0,2,0,0,0,0|2,0,0]=4 13431 B17R1.269097 O=C(NCCCCCO)c1c(cccc1Cl)O 6a24a3cab3b6c64935fd14bed8ed12a6 [0,2,0,0,0,0|2,0,0]=4 13432 B17R1.269097 O=C(NCCCCCO)c1c(cccc1F)F 3a3567c0132a64085f5ef0ee611ebd01 [0,2,0,0,0,0|2,0,0]=4 13433 B17R1.269097 O=C(NCCCCCO)c1c(cccc1F)O fc97a5880743b16252c6c7c3356298ac [0,2,0,0,0,0|2,0,0]=4 13434 B17R1.269097 O=C(NCCCCCO)c1c(cccc1I)Br b94cb38f9e7213f9cc45ab477c6a3190 [0,2,0,0,0,0|2,0,0]=4 13435 B17R1.269097 O=C(NCCCCCO)c1c(cccc1I)Cl 8381240f387c33581c7299673b8f1f42 [0,2,0,0,0,0|2,0,0]=4 13436 B17R1.269097 O=C(NCCCCCO)c1c(cccc1I)F 900ca22e163e8ac933c8bc0357c39af6 [0,2,0,0,0,0|2,0,0]=4 13437 B17R1.269097 O=C(NCCCCCO)c1c(cccc1I)I e5c2911a88e407a993870a9f3411f703 [0,2,0,0,0,0|2,0,0]=4 13438 B17R1.269097 O=C(NCCCCCO)c1c(cccc1I)O f70f313610554c5147818bddbf00777d [0,2,0,0,0,0|2,0,0]=4 13439 B17R1.269097 O=C(NCCCCCO)c1c(cccc1O)O 6353c64631f07d68b30d39dc02da04bf [0,2,0,0,0,0|2,0,0]=4 13440 B15R1.1045 C=Cc1ccccc1NCCCCCC ce640f6c124f953e2a81b1e22399e170 [0,0,1,1,0,0|2,0,0]=4 13441 B15R1.1045 C=Cc1ccccc1OCCCCCC 4cb7b1f754af12ba5fdbcc72c68911b8 [0,0,1,1,0,0|1,0,0]=3 13442 B15R1.1045 C=Cc1ccccc1OCCCCCF 8dfabf17ea294da89acffe726a02781a [0,0,1,1,0,0|2,0,0]=4 13443 B15R1.1045 C=Cc1ccccc1OCCCCOC 4823582b7eadfdeeb3d2261b48db3973 [0,0,1,1,0,0|2,0,0]=4 13444 B15R1.1045 C=Cc1ccccc1OCCCOCC 8c10b2b35f6d0dbbe5132e0034c34cca [0,0,1,1,0,0|2,0,0]=4 13445 B15R1.1045 C=Cc1ccccc1OCCCSCC 5e468530fbcaa67d6216a9e68c212932 [0,0,1,1,0,0|2,0,0]=4 13446 B15R1.1045 C=Cc1ccccc1OCCOCCC 1ce5829b989198e5dfce4dd28cfa80e1 [0,0,1,1,0,0|2,0,0]=4 13447 B15R1.1045 C=Cc1ccccc1OCOCCCC ef495c752cc5f1acdefdf68f73e4b3e2 [0,0,1,1,0,0|2,0,0]=4 13448 B15R1.1045 C=Cc1cccnc1NCCCCCC 1bc59408d589cb908524bf40ae03d508 [0,0,1,1,0,0|2,0,0]=4 13449 B15R1.1045 CCCCCCOc1ccccc1C=O 022de25521d4b34f0c24a46ff9f4bf2a [0,0,1,1,0,0|2,0,0]=4 13450 B15R1.12031 C=Cc1cccc(c1)NCCCCCC 97c5bbd5a2b147e487a52042bd57a752 [0,0,1,1,0,0|2,0,0]=4 13451 B15R1.12031 C=Cc1cccc(c1)OCCCCCC 2fd8dd0aab40cc95bce938ecb7a0aed8 [0,0,1,1,0,0|1,0,0]=3 13452 B15R1.12031 C=Cc1cccc(c1)OCCCCCF 62dc9b183f3d3644dff8c537d2ea6174 [0,0,1,1,0,0|2,0,0]=4 13453 B15R1.12031 C=Cc1cccc(c1)OCCCCOC f343ffbbb57868d8ad4496db85040cb7 [0,0,1,1,0,0|2,0,0]=4 13454 B15R1.12031 C=Cc1cccc(c1)OCCCOCC 765da1783a137fd85da740fbaaa3b54f [0,0,1,1,0,0|2,0,0]=4 13455 B15R1.12031 C=Cc1cccc(c1)OCCCSCC 77a4bbf8e6288a22f6ff14bca1682a29 [0,0,1,1,0,0|2,0,0]=4 13456 B15R1.12031 C=Cc1cccc(c1)OCCOCCC 376a8b65a098b3d6321969b5d3c1e4b1 [0,0,1,1,0,0|2,0,0]=4 13457 B15R1.12031 C=Cc1cccc(c1)OCOCCCC 3c298f40b661186268a18f974959fec1 [0,0,1,1,0,0|2,0,0]=4 13458 B15R1.12031 C=Cc1cccc(n1)NCCCCCC 32a12619719dda73efdd0ee148d12708 [0,0,1,1,0,0|2,0,0]=4 13459 B15R1.12031 CCCCCCOc1cccc(c1)C=O 0bb02d8e390dbf1b94c1e122710cd74b [0,0,1,1,0,0|2,0,0]=4 13460 B15R1.52 CCCCCCOc1cccccc1=O b920615f9457b740bfdca7ed0a2182e7 [0,0,1,1,0,0|2,0,0]=4 13461 B15R2.66 CCOC1C=C(CC1)c2ccccc2 41a91691fdfa3010da7a71ea04300ae1 [1,0,0,1,0,0|2,0,0]=4 13462 B15R2.395 CC1CCCN1C(=O)c2ccccc2 66a397ec7831edc8e0bf898d3201d07e [1,0,0,1,0,0|1,0,0]=3 13463 B15R2.395 CC1CCCN1C(=O)c2ccccn2 a885c96a53d03011e54f73cfc3b02053 [1,0,0,1,0,0|2,0,0]=4 13464 B15R2.395 CC1CCCN1C(=O)c2cccnc2 e401de10b72004c4e9c434129ad187d4 [1,0,0,1,0,0|2,0,0]=4 13465 B15R2.395 CC1CCCN1C(=O)c2ccncc2 ca6c4842e9c0abb00fc7d1d6e6368039 [1,0,0,1,0,0|2,0,0]=4 13466 B15R2.395 CC1SCCN1C(=O)c2ccccc2 df4d297fc856f754de4f2d095250615a [1,0,0,1,0,0|2,0,0]=4 13467 B15R2.395 C[C@@H]1CCCN1C(=O)c2ccccc2 da6c389466f636b4a6995013c7b137cf [1,0,0,1,0,0|1,0,0]=3 13468 B15R2.395 C[C@@H]1CCCN1C(=O)c2ccccn2 18463eb226da104852a2313ea95584f3 [1,0,0,1,0,0|2,0,0]=4 13469 B15R2.395 C[C@@H]1CCCN1C(=O)c2cccnc2 635873ec707c6e678c56cff934d7b9b8 [1,0,0,1,0,0|2,0,0]=4 13470 B15R2.395 C[C@@H]1CCCN1C(=O)c2ccncc2 c0d4e700d4e3760c8ec426ade64c6b1b [1,0,0,1,0,0|2,0,0]=4 13471 B15R2.395 C[C@H]1CCCN1C(=O)c2ccccc2 45bf730c3266e3770679bb12a3bb8578 [1,0,0,1,0,0|1,0,0]=3 13472 B15R2.395 C[C@H]1CCCN1C(=O)c2ccccn2 5f15045367d925a9a2833bbbaba5de59 [1,0,0,1,0,0|2,0,0]=4 13473 B15R2.395 C[C@H]1CCCN1C(=O)c2cccnc2 fc58dc41a8b1d5fec7d150d3412ab086 [1,0,0,1,0,0|2,0,0]=4 13474 B15R2.395 C[C@H]1CCCN1C(=O)c2ccncc2 823b8da25e76eea926bf3f4563193f59 [1,0,0,1,0,0|2,0,0]=4 13475 B15R2.395 O=C(c1ccccc1)N2CCCC2O dbc1e1b814b2a6805f9db53530dba395 [1,0,0,1,0,0|2,0,0]=4 13476 B15R2.1040 C=C(CNC1CC1C)c2ccccc2 4cd2ca9473c25dac6ec25df9d6fff02c [1,0,0,1,0,0|2,0,0]=4 13477 B15R2.1040 CC1CC1NCC(=O)c2ccccc2 eec54a6ee624f448de10b6fc244c2012 [1,0,0,1,0,0|1,0,0]=3 13478 B15R2.1040 CC1CC1NCC(=O)c2ccccn2 d2e1ddeff8c5b170a37fa863e6d35281 [1,0,0,1,0,0|2,0,0]=4 13479 B15R2.1040 CC1CC1NCC(=O)c2cccnc2 496fc8bf9d9e8fff457a8f90f9b6698e [1,0,0,1,0,0|2,0,0]=4 13480 B15R2.1040 CC1CC1NCS(=O)c2ccccc2 c6fffa7c8bf086179d629e854a7012d4 [1,0,0,1,0,0|2,0,0]=4 13481 B15R2.1040 O=C(CN[C@@H]1C[C@H]1F)c2ccccc2 ab3c5b3e6b47ccd83929a9219c35a7be [1,0,0,1,0,0|2,0,0]=4 13482 B15R2.1040 O=C(CN[C@H]1C[C@@H]1F)c2ccccc2 2bf7750b9ca0a77c918a07109666bfec [1,0,0,1,0,0|2,0,0]=4 13483 B15R2.1040 O=C(CN[C@H]1C[C@H]1F)c2ccccc2 4400a2376f00088cd09dd6c347d6153a [1,0,0,1,0,0|2,0,0]=4 13484 B15R2.1130 CC1OCC1NC(=O)c2ccccc2 6b37551c867c3b8f9fdd7bfb762f46a4 [1,0,0,1,0,0|2,0,0]=4 13485 B15R2.1130 C[C@@H]1CC[C@@H]1NC(=O)c2ccccc2 aab393df5cea8bc061329f691f04ebd8 [1,0,0,1,0,0|1,0,0]=3 13486 B15R2.1130 C[C@@H]1CC[C@@H]1NC(=O)c2ccccn2 17152fc5d18184d0976db028e5715ef8 [1,0,0,1,0,0|2,0,0]=4 13487 B15R2.1130 C[C@@H]1CC[C@@H]1NC(=O)c2cccnc2 759fba9e03d3c2b20ae95c29660d6df8 [1,0,0,1,0,0|2,0,0]=4 13488 B15R2.1130 C[C@@H]1CC[C@@H]1NC(=O)c2ccncc2 c2e0c92e30aaa3445b11631c4bd70263 [1,0,0,1,0,0|2,0,0]=4 13489 B15R2.1130 C[C@@H]1CC[C@H]1NC(=O)c2ccccc2 161e1b50f2d6865dc2c9e6398d2eca03 [1,0,0,1,0,0|1,0,0]=3 13490 B15R2.1130 C[C@@H]1CC[C@H]1NC(=O)c2ccccn2 058882dd748e183f84972c5b258965c9 [1,0,0,1,0,0|2,0,0]=4 13491 B15R2.1130 C[C@@H]1CC[C@H]1NC(=O)c2cccnc2 bb365a5ba08e0b55f899d5b090be05de [1,0,0,1,0,0|2,0,0]=4 13492 B15R2.1130 C[C@@H]1CC[C@H]1NC(=O)c2ccncc2 03b8982f7091d249e6dee4bd3bb952e0 [1,0,0,1,0,0|2,0,0]=4 13493 B15R2.1130 O=C(NC1CCC1F)c2ccccc2 f0195c374ef349b73fcc0b4aca3ea7db [1,0,0,1,0,0|2,0,0]=4 13494 B15R2.1130 O=C(NC1CCC1O)c2ccccc2 feccb63a70572b7436bad5ceeb3aa4d1 [1,0,0,1,0,0|2,0,0]=4 13495 B15R2.1130 O=C(N[C@@H]1CC[C@@H]1O)c2ccccc2 15dbe12d5b70a8d9c2e90013f35b961f [1,0,0,1,0,0|2,0,0]=4 13496 B15R2.1130 O=C(N[C@@H]1CC[C@H]1O)c2ccccc2 9a2be90316c0c0ed114ff1b7841310d6 [1,0,0,1,0,0|2,0,0]=4 13497 B15R2.1130 O=C(N[C@H]1CC[C@@H]1O)c2ccccc2 ea98fb28155c3ee06c3d2ab812018db5 [1,0,0,1,0,0|2,0,0]=4 13498 B15R2.1130 O=C(N[C@H]1CC[C@H]1O)c2ccccc2 02e60f2c2fb27191725ca151ceb7977c [1,0,0,1,0,0|2,0,0]=4 13499 B15R2.1259 CC(OC1CCCC1)c2ccccc2 4bec984729db109b5cbaef7ec055a7f0 [1,0,0,1,0,0|1,0,1]=4 13500 B15R2.1259 CN(CC1CCCC1)c2ccccc2 33b4f0bc1c2db11b6512c2cf9b33c4a3 [1,0,0,1,0,0|2,0,0]=4 13501 B15R2.1259 C[C@@H](OC1CCCC1)c2ccccc2 16b1b8f8b22a0a471e199338189528eb [1,0,0,1,0,0|1,0,1]=4 13502 B15R2.1259 C[C@H](OC1CCCC1)c2ccccc2 5efced3e805305fb971d01a2acc076c8 [1,0,0,1,0,0|1,0,1]=4 13503 B15R2.1259 O=C(CN1CCSC1)c2ccccc2 f3b7efea220eef27d44bb0cbf8d5f963 [1,0,0,1,0,0|2,0,0]=4 13504 B15R2.1259 O=C(NC1CCCC1)c2ccccc2 d92bd312496f16ca8ebd4f65e8ca9148 [1,0,0,1,0,0|1,0,0]=3 13505 B15R2.1259 O=C(NC1CCCC1)c2ccccn2 31027d40cf558b4cc054588070c640ea [1,0,0,1,0,0|2,0,0]=4 13506 B15R2.1259 O=C(NC1CCCC1)c2cccnc2 148d79318700f96b9c84f9a54f686a93 [1,0,0,1,0,0|2,0,0]=4 13507 B15R2.1259 O=C(NC1CCCC1)c2ccncc2 6e03eca8a6cbccc76fbeb82fc5aab74a [1,0,0,1,0,0|2,0,0]=4 13508 B15R2.1259 O=C(NC1CCOC1)c2ccccc2 11a71388218a87946e3546d301f94479 [1,0,0,1,0,0|2,0,0]=4 13509 B15R2.1259 O=C(NC1CCSC1)c2ccccc2 6d0ee297c7002aea700e2b875eb11162 [1,0,0,1,0,0|2,0,0]=4 13510 B15R2.1259 O=C(N[C@@H]1CCOC1)c2ccccc2 802bfe7f88f43b0c5ebd4e289f31aa22 [1,0,0,1,0,0|2,0,0]=4 13511 B15R2.1259 O=C(N[C@H]1CCOC1)c2ccccc2 a9cc3b85fd5b47178fb80561dd0c71f2 [1,0,0,1,0,0|2,0,0]=4 13512 B15R2.1428 CCCNC1CC(=O)c2c1cccc2 cc976429003899b9b6c742df70d63c67 [1,0,0,1,0,0|1,0,0]=3 13513 B15R2.1428 CCCNC1NC(=O)c2c1cccc2 9e087b48e14017d9d2e14c6a709f83b5 [1,0,0,1,0,0|2,0,0]=4 13514 B15R2.1428 CCCNC1OC(=O)c2c1cccc2 8b65019b0bf5693fe8a815f8e660bd32 [1,0,0,1,0,0|1,0,0]=3 13515 B15R2.1428 CCCOC1CC(=O)c2c1cccc2 de18e3923e889f4db670af8baf38bfbc [1,0,0,1,0,0|1,0,0]=3 13516 B15R2.1428 CCCOC1OC(=O)c2c1cccc2 5931b5cf70ae4dea41bd2a102102ecef [1,0,0,1,0,0|1,0,0]=3 13517 B15R2.1428 CCCOC1OC(=O)c2c1cncc2 7bf4b18c85bc37f0b0182e114ca1c099 [1,0,0,1,0,0|2,0,0]=4 13518 B15R2.1428 COCOC1CC(=O)c2c1cccc2 a24d260b6cddc4ce56b4b843c78c4acc [1,0,0,1,0,0|2,0,0]=4 13519 B15R2.1428 COCOC1OC(=O)c2c1cccc2 27f176facbf03bb3d104d154126f6b68 [1,0,0,1,0,0|2,0,0]=4 13520 B15R2.1428 CSCOC1CC(=O)c2c1cccc2 10903ed4830b675e74bb0f54b14219fc [1,0,0,1,0,0|2,0,0]=4 13521 B15R2.1428 CSCOC1OC(=O)c2c1cccc2 a08bf54d7d8240d81cee309702359801 [1,0,0,1,0,0|2,0,0]=4 13522 B15R2.1428 O=C1CC(c2c1cccc2)NCCBr 8827b94a6c6e3d02fdf97901f97d942b [1,0,0,1,0,0|2,0,0]=4 13523 B15R2.1428 O=C1CC(c2c1cccc2)NCCF 78f7385bd73f8bb8ea0881537fcf04d8 [1,0,0,1,0,0|2,0,0]=4 13524 B15R2.1428 O=C1CC(c2c1cccc2)NCCI 7eb993f31ed19f0e77e8748eeecc6e84 [1,0,0,1,0,0|2,0,0]=4 13525 B15R2.1428 O=C1CC(c2c1cccc2)NCCO ed188775fce929cc8a8e1ca444442007 [1,0,0,1,0,0|2,0,0]=4 13526 B15R2.1428 O=C1CC(c2c1cccc2)NCCS 8115dac6255357e1450ab62da631bdbf [1,0,0,1,0,0|2,0,0]=4 13527 B15R2.1428 O=C1CC(c2c1cccc2)OCCF a5a954fecaf6713cb59da9953704e7ed [1,0,0,1,0,0|2,0,0]=4 13528 B15R2.1428 O=C1CC(c2c1cccc2)OCCS d727505323a0d4c0d54264b042ef87e0 [1,0,0,1,0,0|2,0,0]=4 13529 B15R2.1428 O=C1OC(c2c1cccc2)NCCI a561a358fffe2a08daa0b52d71146472 [1,0,0,1,0,0|2,0,0]=4 13530 B15R2.1428 O=C1OC(c2c1cccc2)NCCO 174f5f67317038c0e4a054b32e1d2f1c [1,0,0,1,0,0|2,0,0]=4 13531 B15R2.1428 O=C1OC(c2c1cccc2)OCCF 63db51a88d42ef8daed62041ee42c8e4 [1,0,0,1,0,0|2,0,0]=4 13532 B15R2.1428 O=C1OC(c2c1cccc2)OCCS 22f20a57c46045ac888d6510aa166da3 [1,0,0,1,0,0|2,0,0]=4 13533 B15R2.1710 CO[C@H]1C[C@H]1NC(=O)c2ccccc2 3f94878fcecec3cacd7c27fca01c3a4a [1,0,0,1,0,0|2,0,0]=4 13534 B15R2.1710 O=C(N[C@@H]1C[C@H]1CO)c2ccccc2 020b07ad313be3bfa8da24200d1dac99 [1,0,0,1,0,0|2,0,0]=4 13535 B15R2.1710 O=C(N[C@H]1C[C@@H]1CO)c2ccccc2 57d8f2d7f2c3444ec6f5481986675ce4 [1,0,0,1,0,0|2,0,0]=4 13536 B15R2.1710 O=C(N[C@H]1C[C@H]1CO)c2ccccc2 00d63402a93764614313807d3659e77f [1,0,0,1,0,0|2,0,0]=4 13537 B15R2.2059 CCC1CCN1C(=O)c2ccccc2 1a5ce8e2dded024dc5ef95dcf4cb05a7 [1,0,0,1,0,0|1,0,0]=3 13538 B15R2.2059 CCC1CCN1C(=O)c2ccccn2 f1672367e12f2adea6100223fdd5b8e5 [1,0,0,1,0,0|2,0,0]=4 13539 B15R2.2059 CCC1CCN1C(=O)c2cccnc2 c936b70a8c9c3cc6b8c8e4ed43ecd641 [1,0,0,1,0,0|2,0,0]=4 13540 B15R2.2059 CCC1CCN1C(=O)c2ccncc2 565617f5d2c2b58bd1ed2d6916cc94f5 [1,0,0,1,0,0|2,0,0]=4 13541 B15R2.2059 O=C(c1ccccc1)N2CCC2CO c62ea4e5ca0bdb05d3e91e882d73203e [1,0,0,1,0,0|2,0,0]=4 13542 B15R2.2059 O=C(c1ccccc1)N2CC[C@@H]2CO 82b92a23a22ada5ce40c2db5c0209428 [1,0,0,1,0,0|2,0,0]=4 13543 B15R2.2059 O=C(c1ccccc1)N2CC[C@H]2CO 0f06273dc4cb6f682245845f1f860856 [1,0,0,1,0,0|2,0,0]=4 13544 B15R2.2226 O=C(c1ccccc1)N2CCCOC2 bf202688bd46f2d1ec837684ca8445c3 [1,0,0,1,0,0|2,0,0]=4 13545 B15R2.2226 O=C(c1ccccc1)N2CCCSC2 8ea73acd7997661786019598600575ff [1,0,0,1,0,0|2,0,0]=4 13546 B15R2.2226 O=C(c1ccccc1)N2CCOCC2 12472e5e635b0bcf3885c78840614a30 [1,0,0,1,0,0|2,0,0]=4 13547 B15R2.2226 O=C(c1ccccc1)N2CCSCC2 0ae672b61a00a5fbd189abd9312d4dae [1,0,0,1,0,0|2,0,0]=4 13548 B15R2.4382 CCCN1CCC(=O)c2c1cccc2 d4f5c2094d44a3a3ddb089d2bcf9388e [1,0,0,1,0,0|1,0,0]=3 13549 B15R2.4382 CCCN1CCC(=O)c2c1ccnc2 5e2925afcb1ea7504177f75969440b88 [1,0,0,1,0,0|2,0,0]=4 13550 B15R2.4382 CCCN1CCC(=O)c2c1nccc2 b0f34840b20a4fa1486768cd32e7f1c6 [1,0,0,1,0,0|2,0,0]=4 13551 B15R2.4382 CCOC1CCC(=O)c2c1cccc2 08b988740801b82296ef267033b2ad38 [1,0,0,1,0,0|1,0,0]=3 13552 B15R2.4382 COCN1CCC(=O)c2c1cccc2 897e532ddfc0689108325733a06164b6 [1,0,0,1,0,0|2,0,0]=4 13553 B15R2.4382 CSCN1CCC(=O)c2c1cccc2 4ae05575b21250c422bf82364230fde9 [1,0,0,1,0,0|2,0,0]=4 13554 B15R2.4382 O=C1CCC(c2c1cccc2)OCF d6ced992383aec427429878921b9805c [1,0,0,1,0,0|2,0,0]=4 13555 B15R2.4382 O=C1CCN(c2c1cccc2)CCO 2e6b5f0a65d13ef3d6f830e4d81b4480 [1,0,0,1,0,0|2,0,0]=4 13556 B15R2.4382 O=C1CCN(c2c1cccc2)CCS 9ae9589a06cb3f62cd83345a7394744d [1,0,0,1,0,0|2,0,0]=4 13557 B15R2.4804 CCN1CCNC(=O)c2c1cccc2 6228a17aa0b2552ad78a0f241d67689b [1,0,0,1,0,0|2,0,0]=4 13558 B15R2.4804 O=C1CCCN(c2c1cccc2)CF 7b7d9121e549f3d11614ad79d15e8624 [1,0,0,1,0,0|2,0,0]=4 13559 B15R2.4804 O=C1CCCN(c2c1cccc2)CO 23b69e3dc37928afcc06c711d277484b [1,0,0,1,0,0|2,0,0]=4 13560 B15R2.16439 C=C(CNC1CCC1)c2ccccc2 69b08c516b62f367a9c539f27b79d502 [1,0,0,1,0,0|2,0,0]=4 13561 B15R2.16439 C=C(COC1CCC1)c2ccccc2 549adcbfc050b42e0cb145eb34b8818c [1,0,0,1,0,0|2,0,0]=4 13562 B15R2.16439 CC(OCC1CCC1)c2ccccc2 e9270b92eba200846f1302de065a4d09 [1,0,0,1,0,0|1,0,1]=4 13563 B15R2.16439 CN(CCC1CCC1)c2ccccc2 ad45f581a3e00bb2df6140cb8f13abbe [1,0,0,1,0,0|2,0,0]=4 13564 B15R2.16439 C[C@@H](OCC1CCC1)c2ccccc2 739e789e9ee21c54deecbedc2d12273e [1,0,0,1,0,0|1,0,1]=4 13565 B15R2.16439 C[C@H](OCC1CCC1)c2ccccc2 fe17f25de3c0fd226c063757e972c1d6 [1,0,0,1,0,0|1,0,1]=4 13566 B15R2.16439 O=C(CNC1CCC1)c2ccccc2 9ab6d2cff4ad16f3d7776c9442a6c592 [1,0,0,1,0,0|1,0,0]=3 13567 B15R2.16439 O=C(CNC1CCC1)c2ccccn2 9d3398f20099840006cc26af30d16738 [1,0,0,1,0,0|2,0,0]=4 13568 B15R2.16439 O=C(CNC1CCC1)c2cccnc2 55df81e0940d9f7813cce8a45f54a535 [1,0,0,1,0,0|2,0,0]=4 13569 B15R2.16439 O=C(CNC1COC1)c2ccccc2 0d8740193bda60f0b8f20498aec976c0 [1,0,0,1,0,0|2,0,0]=4 13570 B15R2.16439 O=C(COC1CCC1)c2ccccc2 10d26e8bacb5474cd01b48c21e95770b [1,0,0,1,0,0|1,0,0]=3 13571 B15R2.16439 O=C(COC1CCC1)c2ccccn2 52cb1258499d5543363dc1d259876c15 [1,0,0,1,0,0|2,0,0]=4 13572 B15R2.16439 O=C(COC1CCC1)c2cccnc2 abb26b961688ca8a0c1f08a3a5b16a41 [1,0,0,1,0,0|2,0,0]=4 13573 B15R2.16439 O=C(COC1COC1)c2ccccc2 bd4fdc6ff745f71da5d1ef1bacb1cf52 [1,0,0,1,0,0|2,0,0]=4 13574 B15R2.16439 O=C(COC1CSC1)c2ccccc2 900685b9e33335f478b4216c3d3bdcfb [1,0,0,1,0,0|2,0,0]=4 13575 B15R2.16439 O=C(NCC1CCC1)c2ccccc2 d37d0aceb29b63b9ca873cb308f233b7 [1,0,0,1,0,0|1,0,0]=3 13576 B15R2.16439 O=C(NCC1CCC1)c2ccccn2 bb1798f94a8d309789e3f3f6b53a8cc8 [1,0,0,1,0,0|2,0,0]=4 13577 B15R2.16439 O=C(NCC1CCC1)c2cccnc2 06250cc06d63e4bb4cdf8ec6ca3f7865 [1,0,0,1,0,0|2,0,0]=4 13578 B15R2.16439 O=C(NCC1CCC1)c2ccncc2 4709a92b4c4697b03c5a62d08ee4b794 [1,0,0,1,0,0|2,0,0]=4 13579 B15R2.16439 O=C(NCC1CCO1)c2ccccc2 c4c8045e74af3fb3b5a2e2d6b7c42f25 [1,0,0,1,0,0|2,0,0]=4 13580 B15R2.16439 O=C(NCC1COC1)c2ccccc2 b72b98308ca97ac8fe699286526e36b7 [1,0,0,1,0,0|2,0,0]=4 13581 B15R2.16439 O=C(NC[C@@H]1CCO1)c2ccccc2 c284ff6f4142de5ad9eabb2468ca3320 [1,0,0,1,0,0|2,0,0]=4 13582 B15R2.16439 O=C(NC[C@H]1CCO1)c2ccccc2 b4fa221b97c3201f7d5500c884d8884d [1,0,0,1,0,0|2,0,0]=4 13583 B15R2.16439 O=C(OCN1CCC1)c2ccccc2 8b1e4caf49f24a4db0fa98f1849ae15d [1,0,0,1,0,0|1,0,0]=3 13584 B15R2.16439 O=S(CNC1CCC1)c2ccccc2 b05f8a0ee8ab7eeae2d43356bb6d3a0c [1,0,0,1,0,0|2,0,0]=4 13585 B15R2.16439 O=S(COC1CCC1)c2ccccc2 023f1c6455101b86be05366e39cdfc5c [1,0,0,1,0,0|2,0,0]=4 13586 B15R2.16442 C=C(CNCC1CC1)c2ccccc2 57c7f8579a892113003d23b3db332ab5 [1,0,0,1,0,0|2,0,0]=4 13587 B15R2.16442 C=C(COCC1CC1)c2ccccc2 f45bd69758af5caf932dd62da30dcf48 [1,0,0,1,0,0|2,0,0]=4 13588 B15R2.16442 CC(OCCC1CC1)c2ccccc2 668eb70f3228fc27b8e3fcd886631acf [1,0,0,1,0,0|1,0,1]=4 13589 B15R2.16442 C[C@@H](OCCC1CC1)c2ccccc2 6f19d2a8e33c16baf6664fb33d0ccfb9 [1,0,0,1,0,0|1,0,1]=4 13590 B15R2.16442 C[C@H](OCCC1CC1)c2ccccc2 75766ea2ed890ca75f551ce3840e6197 [1,0,0,1,0,0|1,0,1]=4 13591 B15R2.16442 O=C(CCOC1CC1)c2ccccc2 e01471c9d8c160fc68a1f69f053bc058 [1,0,0,1,0,0|1,0,0]=3 13592 B15R2.16442 O=C(CNCC1CC1)c2ccccc2 2d243eb68705bc745e146a0b975a15c0 [1,0,0,1,0,0|1,0,0]=3 13593 B15R2.16442 O=C(CNCC1CC1)c2ccccn2 890c05265630b7c60ff7acc80402617d [1,0,0,1,0,0|2,0,0]=4 13594 B15R2.16442 O=C(CNCC1CC1)c2cccnc2 c91ceeab19771dd550a861e8185bc0c4 [1,0,0,1,0,0|2,0,0]=4 13595 B15R2.16442 O=C(COCC1CC1)c2ccccc2 2de320d4169f1e90ea11a98b26ca47a9 [1,0,0,1,0,0|1,0,0]=3 13596 B15R2.16442 O=C(COCC1CC1)c2ccccn2 b5302485c0a0f89d7c161cdc6addc697 [1,0,0,1,0,0|2,0,0]=4 13597 B15R2.16442 O=C(COCC1CC1)c2cccnc2 5daa7a52b20e85a5810361b41950e0fb [1,0,0,1,0,0|2,0,0]=4 13598 B15R2.16442 O=C(NCCC1CC1)c2ccccc2 aee5626e42b68f60b556474359b64ec8 [1,0,0,1,0,0|1,0,0]=3 13599 B15R2.16442 O=C(NCCC1CC1)c2ccccn2 3aa88516d6b1164f733c04ed707bb6d2 [1,0,0,1,0,0|2,0,0]=4 13600 B15R2.16442 O=C(NCCC1CC1)c2cccnc2 5a2f0a3a50295fa764d79bd45bdc5931 [1,0,0,1,0,0|2,0,0]=4 13601 B15R2.16442 O=C(NCCC1CC1)c2ccncc2 2a3580646508a83b793f97069a3d9b24 [1,0,0,1,0,0|2,0,0]=4 13602 B15R2.16442 O=C(NCCN1CC1)c2ccccc2 e8beece54937ca802143b15ca1f60306 [1,0,0,1,0,0|2,0,0]=4 13603 B15R2.16442 O=C(NCOC1CC1)c2ccccc2 14a6bb52b9b2e83febaad349a41349c8 [1,0,0,1,0,0|2,0,0]=4 13604 B15R2.16442 O=C(OCNC1CC1)c2ccccc2 f61827f04d4104668868ef51e901a188 [1,0,0,1,0,0|1,0,0]=3 13605 B15R2.16442 O=C(OCOC1CC1)c2ccccc2 2c31d004f59da40b052fe1a80dbd7490 [1,0,0,1,0,0|1,0,0]=3 13606 B15R2.16442 O=S(CCOC1CC1)c2ccccc2 65201120e6cb302390dbec30457d780a [1,0,0,1,0,0|2,0,0]=4 13607 B15R2.71393 CCCCCOC1Cc2c1cccc2 2a7db79c4e8f48702460980f7198a3d7 [1,0,0,1,0,0|1,0,1]=4 13608 B15R2.38 CC1CCCCC1Nc2ccccc2 d88110b6b761065d9f7a177c37a4b4b5 [1,0,0,1,0,0|2,0,0]=4 13609 B15R2.38 CC1CCCCN1Cc2ccccc2 e41bcc800e73b33160dcabfadce72824 [1,0,0,1,0,0|1,0,1]=4 13610 B15R2.38 C[C@@H]1CCCCN1Cc2ccccc2 277b3dc8dab490d22eb4e0f92fd77ee2 [1,0,0,1,0,0|1,0,1]=4 13611 B15R2.38 C[C@@H]1CCCC[C@@H]1Nc2ccccc2 3287c19ae1e49e431607c5499a7cfc54 [1,0,0,1,0,0|2,0,0]=4 13612 B15R2.38 C[C@@H]1CCCC[C@H]1Nc2ccccc2 5c7d153eb3b92baff6deb127d1c3822e [1,0,0,1,0,0|2,0,0]=4 13613 B15R2.38 C[C@H]1CCCCN1Cc2ccccc2 f0ad16d1bdd72ad355877b5beacbef9d [1,0,0,1,0,0|1,0,1]=4 13614 B15R2.38 C[C@H]1CCCC[C@@H]1Nc2ccccc2 aa04b1178dccff660df3ccedaa88f445 [1,0,0,1,0,0|2,0,0]=4 13615 B15R2.38 C[C@H]1CCCC[C@H]1Nc2ccccc2 14dc17340be00f8792dcd48d72ba02bb [1,0,0,1,0,0|2,0,0]=4 13616 B15R2.55 CC1CCCC1OCc2ccccc2 4b3bc353dfe79cc74208b2e107213741 [1,0,0,1,0,0|0,0,1]=3 13617 B15R2.55 CC1CCCC1OCc2ccccn2 b97bd6692e3094df6fd10908747ffa58 [1,0,0,1,0,0|1,0,1]=4 13618 B15R2.55 CC1CCCC1OCc2cccnc2 cb414e54be1d1260dcfaefdbe880e20b [1,0,0,1,0,0|1,0,1]=4 13619 B15R2.55 CC1COCC1OCc2ccccc2 09d48fd152ca7345b1f99f15262d6db3 [1,0,0,1,0,0|1,0,1]=4 13620 B15R2.55 C[C@@H]1CCC[C@@H]1OCc2ccccc2 98b01880f3f37d388011083e5f85845a [1,0,0,1,0,0|0,0,1]=3 13621 B15R2.55 C[C@@H]1CCC[C@@H]1OCc2ccccn2 0e0342699eb31c039f50e4eb89151cf4 [1,0,0,1,0,0|1,0,1]=4 13622 B15R2.55 C[C@@H]1CCC[C@@H]1OCc2cccnc2 4d15808e432b2e1eb2bf87ebc2bf7eea [1,0,0,1,0,0|1,0,1]=4 13623 B15R2.55 C[C@@H]1CCC[C@H]1OCc2ccccc2 fd68ad2a36ce10e31209c2ee59763ff0 [1,0,0,1,0,0|0,0,1]=3 13624 B15R2.55 C[C@@H]1CCC[C@H]1OCc2ccccn2 d8e21c5dd0edd8a8f3eb921d930b7d6f [1,0,0,1,0,0|1,0,1]=4 13625 B15R2.55 C[C@@H]1CCC[C@H]1OCc2cccnc2 d36a3269e1e3a1ae7a9cfff18b611f7f [1,0,0,1,0,0|1,0,1]=4 13626 B15R2.55 C[C@@H]1COC[C@@H]1OCc2ccccc2 9f1b1ad2625fb2813c85295e813efe55 [1,0,0,1,0,0|1,0,1]=4 13627 B15R2.55 C[C@H]1CCC[C@@H]1OCc2ccccc2 85353a9b8f6bd9bdf6920e2c327f75a2 [1,0,0,1,0,0|0,0,1]=3 13628 B15R2.55 C[C@H]1CCC[C@@H]1OCc2ccccn2 ec2a700ab69a6ec69161af1b51fc0c23 [1,0,0,1,0,0|1,0,1]=4 13629 B15R2.55 C[C@H]1CCC[C@@H]1OCc2cccnc2 e809e0c2f9a48b44cf4668d369c79eb7 [1,0,0,1,0,0|1,0,1]=4 13630 B15R2.55 C[C@H]1CCC[C@H]1OCc2ccccc2 bbf26738bdb97d230015ff9195281b9f [1,0,0,1,0,0|0,0,1]=3 13631 B15R2.55 C[C@H]1CCC[C@H]1OCc2ccccn2 418d957a5b46c4e24ceee2baea3ac368 [1,0,0,1,0,0|1,0,1]=4 13632 B15R2.55 C[C@H]1CCC[C@H]1OCc2cccnc2 4e939e184e50e8aac7d719c810189fb4 [1,0,0,1,0,0|1,0,1]=4 13633 B15R2.55 C[C@H]1COC[C@@H]1OCc2ccccc2 ce091795b5400dd4bf6719daf97e20dd [1,0,0,1,0,0|1,0,1]=4 13634 B15R2.55 C[C@H]1COC[C@H]1OCc2ccccc2 0d2853227968308f10bd400c97cf181b [1,0,0,1,0,0|1,0,1]=4 13635 B15R2.55 F[C@@H]1CCC[C@H]1OCc2ccccc2 c734f1812ed9aac981274700486ed9d9 [1,0,0,1,0,0|1,0,1]=4 13636 B15R2.118 CCC1CCCN1Cc2ccccc2 37ea9639a0175c2632c6e21315241e6b [1,0,0,1,0,0|1,0,1]=4 13637 B15R2.118 CC[C@@H]1CCCN1Cc2ccccc2 8a7764adc2de9b237ee32554d5fa16bf [1,0,0,1,0,0|1,0,1]=4 13638 B15R2.118 CC[C@@H]1CCC[C@H]1Nc2ccccc2 9636b3c40c04c6b10a65fc162c1bfaef [1,0,0,1,0,0|2,0,0]=4 13639 B15R2.342 CN1CCC1COCc2ccccc2 dd88d51ed6405f1c32f970a4f77b78d5 [1,0,0,1,0,0|1,0,1]=4 13640 B15R2.342 CN1CC[C@@H]1COCc2ccccc2 6fe4bd8f848be3874fd75cc21103b78c [1,0,0,1,0,0|1,0,1]=4 13641 B15R2.342 CN1CC[C@H]1COCc2ccccc2 bd859e840f2540fda336b49952fb5547 [1,0,0,1,0,0|1,0,1]=4 13642 B15R2.342 FC1CCC1COCc2ccccc2 b411108f8acc527bc78808c012dd7e07 [1,0,0,1,0,0|1,0,1]=4 13643 B15R2.492 CC1CC1NC/C=C/c2ccccc2 5db39989fffad055693eb8337f2712eb [1,0,0,1,0,0|2,0,0]=4 13644 B15R2.492 CC1CC1NCC=Cc2ccccc2 0a1d984abb6bc2e16ee8f22eabc403e4 [1,0,0,1,0,0|2,0,0]=4 13645 B15R2.492 CC1CC1NCOCc2ccccc2 3bc06b2c204ae2b6bf955707a4a11d11 [1,0,0,1,0,0|1,0,1]=4 13646 B15R2.2167 c1ccc(cc1)CN2CCCCCC2 bccd57c54171a601bad0685c08627ec8 [1,0,0,1,0,0|1,0,1]=4 13647 B15R2.2195 c1cc(ccn1)COC2CCCCC2 f8a5f1049a2b4d22fe3e544a532289a8 [1,0,0,1,0,0|1,0,1]=4 13648 B15R2.2195 c1ccc(cc1)CNC2CCCCC2 235ca1dba6e0d56f2bfcc075b722a6e9 [1,0,0,1,0,0|1,0,1]=4 13649 B15R2.2195 c1ccc(cc1)COC2CCCCC2 36802415e59d1587d95a536e2071a78a [1,0,0,1,0,0|0,0,1]=3 13650 B15R2.2195 c1ccc(cc1)COC2CCCCO2 f70f80781770bfbe73d69ab168788cc7 [1,0,0,1,0,0|1,0,1]=4 13651 B15R2.2195 c1ccc(cc1)COC2CCCOC2 e3d313684d5f50ae98c43fd979ca6528 [1,0,0,1,0,0|1,0,1]=4 13652 B15R2.2195 c1ccc(cc1)COC2CCCSC2 bdc9df37205be893dd8d3d8dd0ddc4a8 [1,0,0,1,0,0|1,0,1]=4 13653 B15R2.2195 c1ccc(cc1)COC2CCOCC2 44eac354c263640ce4985d654417fd4a [1,0,0,1,0,0|1,0,1]=4 13654 B15R2.2195 c1ccc(cc1)COC2CCSCC2 9195cabd2431a27ac118e875ae0287b0 [1,0,0,1,0,0|1,0,1]=4 13655 B15R2.2195 c1ccc(cc1)CO[C@@H]2CCCOC2 4312517b8d6b59eab811de5fa600bf94 [1,0,0,1,0,0|1,0,1]=4 13656 B15R2.2195 c1ccc(cc1)CO[C@H]2CCCOC2 5959c463c7c0211e4e73e274a5177438 [1,0,0,1,0,0|1,0,1]=4 13657 B15R2.2195 c1ccc(cc1)NCC2CCCCC2 05b0222890f80c78aaeb52439b7a87a9 [1,0,0,1,0,0|2,0,0]=4 13658 B15R2.2195 c1ccc(nc1)COC2CCCCC2 ea89988b13f386e1d6dc26d675d10349 [1,0,0,1,0,0|1,0,1]=4 13659 B15R2.2195 c1cncc(c1)COC2CCCCC2 ec23d4ee05b0b1d6f6d4f5dc5e34922b [1,0,0,1,0,0|1,0,1]=4 13660 B15R2.2196 c1cc(ccn1)COCC2CCCC2 7a6ba157da72d163cd02cd595d51af9e [1,0,0,1,0,0|1,0,1]=4 13661 B15R2.2196 c1ccc(cc1)CNCC2CCCC2 bee265b5ae3e5bff211a37df6433f9a2 [1,0,0,1,0,0|1,0,1]=4 13662 B15R2.2196 c1ccc(cc1)COCC2CCCC2 3e43bec4922ed6ac17faaf4c33860570 [1,0,0,1,0,0|0,0,1]=3 13663 B15R2.2196 c1ccc(cc1)COCC2CCCO2 222aa3052f1c1273b3616a1f5b962cb6 [1,0,0,1,0,0|1,0,1]=4 13664 B15R2.2196 c1ccc(cc1)COCC2CCCS2 f2f2031563d2eea91aa10ac7b2b81521 [1,0,0,1,0,0|1,0,1]=4 13665 B15R2.2196 c1ccc(cc1)COCC2CCOC2 1d3410f19f5ff5aa7ab96a1c90f2b514 [1,0,0,1,0,0|1,0,1]=4 13666 B15R2.2196 c1ccc(cc1)COCN2CCCC2 6a54ee2bf8e0d081d4e8dc0c407f3abf [1,0,0,1,0,0|1,0,1]=4 13667 B15R2.2196 c1ccc(cc1)COC[C@@H]2CCCO2 19ab92dbb1ad7602372f89abdbc352e6 [1,0,0,1,0,0|1,0,1]=4 13668 B15R2.2196 c1ccc(cc1)COC[C@@H]2CCOC2 3a318ba9ac4fe7e21beb653d03c219e2 [1,0,0,1,0,0|1,0,1]=4 13669 B15R2.2196 c1ccc(cc1)COC[C@H]2CCCO2 dcd5dea16345e0416d620170c2b3ffd8 [1,0,0,1,0,0|1,0,1]=4 13670 B15R2.2196 c1ccc(cc1)COC[C@H]2CCOC2 ffa2d36c1210291e6935d002ba697b22 [1,0,0,1,0,0|1,0,1]=4 13671 B15R2.2196 c1ccc(cc1)NCCC2CCCC2 a18484f2ad4bbd7f7ac20c1e1b49c58a [1,0,0,1,0,0|2,0,0]=4 13672 B15R2.2196 c1ccc(nc1)COCC2CCCC2 0da9bc44a56509fd1c985da9af1e384c [1,0,0,1,0,0|1,0,1]=4 13673 B15R2.2196 c1cncc(c1)COCC2CCCC2 aeea86e2b25b9b31a6a6a9097f3151a0 [1,0,0,1,0,0|1,0,1]=4 13674 B15R2.4226 C(=C/c1ccccc1)\CCNC2CC2 8283111449dedc814c5d74117df82e25 [1,0,0,1,0,0|2,0,0]=4 13675 B15R2.4226 C(=C/c1ccccc1)\CNCC2CC2 ef82408e467d44cb1b8849fcb6551242 [1,0,0,1,0,0|2,0,0]=4 13676 B15R2.4226 C(=C/c1ccccc1)\COCC2CC2 51bf27f3c7b4993635a31b58c9609a81 [1,0,0,1,0,0|2,0,0]=4 13677 B15R2.4226 C(=C\c1ccccc1)\COCC2CC2 d9a1be48e2368edd92c80b2f4ed4b7df [1,0,0,1,0,0|2,0,0]=4 13678 B15R2.4226 C(=Cc1ccccc1)CNCC2CC2 d6bc6a9008c58cf55394521e4859ff9f [1,0,0,1,0,0|2,0,0]=4 13679 B15R2.4226 C(=Cc1ccccc1)COCC2CC2 5b142ed68ef0d9e8402453bd25b3f844 [1,0,0,1,0,0|2,0,0]=4 13680 B15R2.4226 c1ccc(cc1)COCCCC2CC2 e544e13c3c8bcb73aef5c5626c691be0 [1,0,0,1,0,0|0,0,1]=3 13681 B15R2.4226 c1ccc(cc1)COCCNC2CC2 e6ec40a0682d90dbbde5bb8a8a0bd0d0 [1,0,0,1,0,0|1,0,1]=4 13682 B15R2.4226 c1ccc(cc1)COCCOC2CC2 76b21ef160484ecfebebbf99cdb84a4b [1,0,0,1,0,0|1,0,1]=4 13683 B15R2.4226 c1ccc(cc1)COCNCC2CC2 2727f810db1b79f7c49f5d118182b1e9 [1,0,0,1,0,0|1,0,1]=4 13684 B15R2.4226 c1ccc(nc1)COCCCC2CC2 ad28a12e8c3af926f8c5593d6004449d [1,0,0,1,0,0|1,0,1]=4 13685 B15R2.4226 c1cncc(c1)COCCCC2CC2 a8e74e2b593147a59cd4ac010c8ed03c [1,0,0,1,0,0|1,0,1]=4 13686 B15R2.18471 CCCNC1COCc2c1cccc2 39c496502e1bebaf681948f6440b91d7 [1,0,0,1,0,0|1,0,1]=4 13687 B15R2.18471 CCCOC1COCc2c1cccc2 5729e6e832fc7bfeb4020e461f8909c9 [1,0,0,1,0,0|1,0,1]=4 13688 B15R2.27836 C(=C/c1ccccc1)\CNC2CCC2 3b9f5cc2ebeb643eb5d97a909791cdc1 [1,0,0,1,0,0|2,0,0]=4 13689 B15R2.27836 C(=C/c1ccccc1)\COC2CCC2 227bb69b51c1cf731a2f179bbd5c411c [1,0,0,1,0,0|2,0,0]=4 13690 B15R2.27836 C(=C\c1ccccc1)\COC2CCC2 003be558c1a38372afd5363a74bce3a4 [1,0,0,1,0,0|2,0,0]=4 13691 B15R2.27836 C(=Cc1ccccc1)CNC2CCC2 ae336e9dfbb76f32fec9586712bfa34a [1,0,0,1,0,0|2,0,0]=4 13692 B15R2.27836 C(=Cc1ccccc1)COC2CCC2 d7db97365424145f70f829f6f3441495 [1,0,0,1,0,0|2,0,0]=4 13693 B15R2.27836 c1cc(ccn1)COCCC2CCC2 f8eac41b4129e1248c8479c913ae096b [1,0,0,1,0,0|1,0,1]=4 13694 B15R2.27836 c1ccc(cc1)CNCCC2CCC2 7282fe64d09a0ce656a247ef9752bb26 [1,0,0,1,0,0|1,0,1]=4 13695 B15R2.27836 c1ccc(cc1)COCCC2CCC2 697064e8232314328b67ef6652e56863 [1,0,0,1,0,0|0,0,1]=3 13696 B15R2.27836 c1ccc(cc1)COCCC2CCO2 2b792523c75a1674b1463512457fbe21 [1,0,0,1,0,0|1,0,1]=4 13697 B15R2.27836 c1ccc(cc1)COCCC2COC2 9e4884ff7fcd0acdaf89fee1fea629a5 [1,0,0,1,0,0|1,0,1]=4 13698 B15R2.27836 c1ccc(cc1)COCCN2CCC2 5a0eb267aa3fa6d11583a85c43dde9d6 [1,0,0,1,0,0|1,0,1]=4 13699 B15R2.27836 c1ccc(cc1)COCC[C@@H]2CCO2 13c083fce7b6b0b70433f1d252270353 [1,0,0,1,0,0|1,0,1]=4 13700 B15R2.27836 c1ccc(cc1)COCC[C@H]2CCO2 e1a88b996f12b55621470e8a7f54649c [1,0,0,1,0,0|1,0,1]=4 13701 B15R2.27836 c1ccc(cc1)COCNC2CCC2 84e921c6964241a177dbc5d96e6dca05 [1,0,0,1,0,0|1,0,1]=4 13702 B15R2.27836 c1ccc(cc1)COCOC2CCC2 944608cd75aaf54a6f9cbcb750d53ee5 [1,0,0,1,0,0|1,0,1]=4 13703 B15R2.27836 c1ccc(nc1)COCCC2CCC2 763cf2045946c5f1aeb379337cca680b [1,0,0,1,0,0|1,0,1]=4 13704 B15R2.27836 c1cncc(c1)COCCC2CCC2 96e5d420b57ca62400851c667a1bbe79 [1,0,0,1,0,0|1,0,1]=4 13705 B15R2.55017 CCCN1CCOCc2c1cccc2 42712bd80579f712eb3985143902fc18 [1,0,0,1,0,0|1,0,1]=4 13706 B15R2.358 CC1CCCCN1C(=O)c2ccco2 1d0eeb2796d239bdcbf73e43df90ee89 [0,0,0,1,1,0|2,0,0]=4 13707 B15R2.358 CC1CCCCN1C(=O)c2cccs2 b532e56489299eae24cb6cf2947fe781 [0,0,0,1,1,0|2,0,0]=4 13708 B15R2.358 CC1CCCCN1C(=O)c2ccoc2 32c515b70102b3a6ae118a615241a65d [0,0,0,1,1,0|2,0,0]=4 13709 B15R2.358 CC1CCCCN1C(=O)c2ccsc2 18e7b3ab4e5a01766aa848fc00046bae [0,0,0,1,1,0|2,0,0]=4 13710 B15R2.358 C[C@@H]1CCCCN1C(=O)c2ccco2 f1859351b8782527931ce21af27a9497 [0,0,0,1,1,0|2,0,0]=4 13711 B15R2.358 C[C@@H]1CCCCN1C(=O)c2cccs2 ae29ce9551d4daccc6e24255546c843a [0,0,0,1,1,0|2,0,0]=4 13712 B15R2.358 C[C@@H]1CCCCN1C(=O)c2ccoc2 20456c0614e0bf556c7830b4a0172a4a [0,0,0,1,1,0|2,0,0]=4 13713 B15R2.358 C[C@@H]1CCCCN1C(=O)c2ccsc2 cc1962e826a7190a71fa8cd0c1985849 [0,0,0,1,1,0|2,0,0]=4 13714 B15R2.358 C[C@H]1CCCCN1C(=O)c2ccco2 7338c6c806cbec5e5598219dafc25202 [0,0,0,1,1,0|2,0,0]=4 13715 B15R2.358 C[C@H]1CCCCN1C(=O)c2cccs2 c379adb9364a67522e16f4a6cb8cfd65 [0,0,0,1,1,0|2,0,0]=4 13716 B15R2.358 C[C@H]1CCCCN1C(=O)c2ccoc2 2a58869ff8c6b72a0c9d438cdfef2675 [0,0,0,1,1,0|2,0,0]=4 13717 B15R2.358 C[C@H]1CCCCN1C(=O)c2ccsc2 0cce364af9ef258079f210ff72065c17 [0,0,0,1,1,0|2,0,0]=4 13718 B15R2.1258 O=C(NCCC1CCC1)c2ccco2 8d7f06b85046220179d71a1b3c21c7d0 [0,0,0,1,1,0|2,0,0]=4 13719 B15R2.1258 O=C(NCCC1CCC1)c2cccs2 e9957d7060fe66a547c587aa9d6cc5e6 [0,0,0,1,1,0|2,0,0]=4 13720 B15R2.1258 O=C(NCCC1CCC1)c2ccoc2 216020504a2663f1a2de7d64b685b992 [0,0,0,1,1,0|2,0,0]=4 13721 B15R2.1258 O=C(NCCC1CCC1)c2ccsc2 ca7de2015cd4bffe84d9029b0dae7c1d [0,0,0,1,1,0|2,0,0]=4 13722 B15R2.2166 O=C(c1ccco1)N2CCCCCC2 6d3c3ce4880a1db359625df3ec13d067 [0,0,0,1,1,0|2,0,0]=4 13723 B15R2.2166 O=C(c1cccs1)N2CCCCCC2 ad5d1593fd46e227d22e61e4705463c1 [0,0,0,1,1,0|2,0,0]=4 13724 B15R2.2166 O=C(c1ccoc1)N2CCCCCC2 ee2752a4a900cd522d2fe660efe2b463 [0,0,0,1,1,0|2,0,0]=4 13725 B15R2.2166 O=C(c1ccsc1)N2CCCCCC2 e848eb474e077332da1550a504d5c7d3 [0,0,0,1,1,0|2,0,0]=4 13726 B15R2.2325 CCC1CCCN1C(=O)c2ccco2 11efa2de54c810fab9c69372dff28a9b [0,0,0,1,1,0|2,0,0]=4 13727 B15R2.2325 CCC1CCCN1C(=O)c2cccs2 3634b489161cf3a4a4c97fa058404e33 [0,0,0,1,1,0|2,0,0]=4 13728 B15R2.2325 CCC1CCCN1C(=O)c2ccoc2 92892ea9e94d29da078fd212e55df01e [0,0,0,1,1,0|2,0,0]=4 13729 B15R2.2325 CCC1CCCN1C(=O)c2ccsc2 00945ab83cc3017c666b7ae1d943145f [0,0,0,1,1,0|2,0,0]=4 13730 B15R2.2325 CC[C@@H]1CCCN1C(=O)c2ccco2 4763fd63d2a12f7acdc3726ffa4b79bf [0,0,0,1,1,0|2,0,0]=4 13731 B15R2.2325 CC[C@@H]1CCCN1C(=O)c2cccs2 63efa245d5649b1738b46b793b94f87c [0,0,0,1,1,0|2,0,0]=4 13732 B15R2.2325 CC[C@@H]1CCCN1C(=O)c2ccoc2 afd1782eb98552c4c67121f45ed117db [0,0,0,1,1,0|2,0,0]=4 13733 B15R2.2325 CC[C@@H]1CCCN1C(=O)c2ccsc2 df790e199e33fb55ff5ba6dc14f971f8 [0,0,0,1,1,0|2,0,0]=4 13734 B15R2.3989 O=C(NCC1CCCC1)c2ccco2 b2f046f8ca25d9867ba099564b022fd6 [0,0,0,1,1,0|2,0,0]=4 13735 B15R2.3989 O=C(NCC1CCCC1)c2cccs2 f9ba81ee1bc3215d6b1247c42a5d9851 [0,0,0,1,1,0|2,0,0]=4 13736 B15R2.3989 O=C(NCC1CCCC1)c2ccoc2 71a8a8bc8a575ea15a2408b51d6c2cbc [0,0,0,1,1,0|2,0,0]=4 13737 B15R2.3989 O=C(NCC1CCCC1)c2ccsc2 e04d9d022402dff3aac57ba88bb44cd6 [0,0,0,1,1,0|2,0,0]=4 13738 B17R2.143 O=C(C=C1CCCCC1)Nc2ccccc2 8ffff0589f382b2758851fc343aa4985 [0,0,0,1,0,1|1,0,1]=4 13739 B17R2.143 O=C(CC1CCCCC1)Nc2ccccn2 09efbf2d109bf75b0eabd945dc0e4529 [0,0,0,1,0,1|2,0,0]=4 13740 B17R2.974 O=C(NCC1CC1CO)Nc2ccccc2 1562145a11fd385c24b0571ffcdc4c44 [0,0,0,1,0,1|2,0,0]=4 13741 B17R2.1874 CCC1CCN1CC(=O)Cc2ccccc2 95cd5d96dbbc9acacfe987549d9ca933 [0,0,0,1,0,1|2,0,0]=4 13742 B17R2.1874 CCC1CCN1CC(=O)Nc2ccccc2 b590c74c7f1cc93e6b81f39140502304 [0,0,0,1,0,1|2,0,0]=4 13743 B17R2.1874 CCC1CCN1CC(=O)Oc2ccccc2 6b238dcbcfb0cca9050a40167a192823 [0,0,0,1,0,1|2,0,0]=4 13744 B17R2.1874 COC1CCC1NC(=O)Nc2ccccc2 f0cc4b1b6897a492a4b010e752e27b77 [0,0,0,1,0,1|2,0,0]=4 13745 B17R2.1874 CO[C@@H]1CC[C@@H]1NC(=O)Nc2ccccc2 d8264f2709a043cca821e4dd28980494 [0,0,0,1,0,1|2,0,0]=4 13746 B17R2.1874 CO[C@@H]1CC[C@H]1NC(=O)Nc2ccccc2 5ed0afd72bdeef25872e0941df801df7 [0,0,0,1,0,1|2,0,0]=4 13747 B17R2.1874 CO[C@H]1CC[C@@H]1NC(=O)Nc2ccccc2 3daecc4c34bebbc2cfc1278dcf7f2af2 [0,0,0,1,0,1|2,0,0]=4 13748 B17R2.1874 CO[C@H]1CC[C@H]1NC(=O)Nc2ccccc2 752add4b0834fb5091b55add81665619 [0,0,0,1,0,1|2,0,0]=4 13749 B17R2.1994 CCCCCCOC1CC1c2ccccc2 9b4055bbc27f04b8c744363975ba4710 [0,0,0,1,0,1|1,0,1]=4 13750 B17R2.1994 CCCCCCO[C@@H]1C[C@H]1c2ccccc2 160d738d68a54dde832a54caf0f5e7c3 [0,0,0,1,0,1|1,0,1]=4 13751 B17R2.2569 CCCCCCNc1cc2ccccc2[nH]1 c236c02e204acba1398c48468ff28eec [0,0,0,1,0,1|2,0,0]=4 13752 B17R2.2569 CCCCCCNc1cc2ccccc2o1 b7c7c50f963b6efbff665e7cf0d62100 [0,0,0,1,0,1|1,0,1]=4 13753 B17R2.2569 CCCCCCNc1cc2ccccc2s1 0508af0a72738c78db05ab4dfc23d040 [0,0,0,1,0,1|1,1,0]=4 13754 B17R2.2569 CCCCCCNc1nc2ccccc2[nH]1 ae0d4af04cb645312c565b1a5b94940e [0,0,0,1,0,1|2,0,0]=4 13755 B17R2.2569 CCCCCCNc1nc2ccccc2o1 3ec6d9e3b6bfcc507bc6ba63194255e7 [0,0,0,1,0,1|1,0,1]=4 13756 B17R2.2569 CCCCCCNc1nc2ccccc2s1 e5a030e25b482a9c6d1f80a91a2d3bae [0,0,0,1,0,1|1,1,0]=4 13757 B17R2.2569 CCCCCCOC1Cc2ccccc2C1 74a0641e64e9bdd2bc00af7eeb51ad3a [0,0,0,1,0,1|1,0,1]=4 13758 B17R2.2569 CCCCCCOc1cc2ccccc2[nH]1 790a86f3619172094303e2fe5f3597f0 [0,0,0,1,0,1|1,0,0]=3 13759 B17R2.2569 CCCCCCOc1cc2ccccc2s1 b54ce6dfe206084a097b643bf5762752 [0,0,0,1,0,1|0,1,0]=3 13760 B17R2.2569 CCCCCCOc1cc2ccccn2n1 6bf8f366f65ce6bd52a0c40e41afa725 [0,0,0,1,0,1|2,0,0]=4 13761 B17R2.2569 CCCCCCOc1cc2cccnc2[nH]1 b17ad0cdc0a273fb06f380b1c118d56d [0,0,0,1,0,1|2,0,0]=4 13762 B17R2.2569 CCCCCCOc1cn2ccccc2n1 1f0f94aa22e729ee6861307c4dbdfc03 [0,0,0,1,0,1|2,0,0]=4 13763 B17R2.2569 CCCCCCOc1nc2ccccc2[nH]1 e07ecfbec8400f83aa7173e815abe009 [0,0,0,1,0,1|1,0,0]=3 13764 B17R2.2569 CCCCCCOc1nc2ccccc2s1 7bcaff92d9a87483de3f9f862d41233c [0,0,0,1,0,1|0,1,0]=3 13765 B17R2.2569 CCCCOCOc1cc2ccccc2[nH]1 811435fe2cd79b6494964af668e7cd47 [0,0,0,1,0,1|2,0,0]=4 13766 B17R2.2569 CCCCOCOc1cc2ccccc2s1 19501afbe1805c52e65b5e409e74ef85 [0,0,0,1,0,1|1,1,0]=4 13767 B17R2.2569 CCCCOCOc1nc2ccccc2[nH]1 2c3ec17cc3bb81e4c85b0fdb4a76660b [0,0,0,1,0,1|2,0,0]=4 13768 B17R2.2569 CCCCOCOc1nc2ccccc2s1 d7c378617a3a405f1d0bbce98fa3ec29 [0,0,0,1,0,1|1,1,0]=4 13769 B17R2.2569 CCCOCCOc1cc2ccccc2[nH]1 8184ee5c1c048d4c6eec42f211b7880a [0,0,0,1,0,1|2,0,0]=4 13770 B17R2.2569 CCCOCCOc1cc2ccccc2s1 3e41fcc8e98402e680c83398e0485674 [0,0,0,1,0,1|1,1,0]=4 13771 B17R2.2569 CCCOCCOc1nc2ccccc2[nH]1 fb304bbd328ad4c757511cee364a90d9 [0,0,0,1,0,1|2,0,0]=4 13772 B17R2.2569 CCCOCCOc1nc2ccccc2s1 c90744df12cb12307efbe3f53232e830 [0,0,0,1,0,1|1,1,0]=4 13773 B17R2.2569 CCOCCCOc1cc2ccccc2[nH]1 c043678c4cc748d9ca4d3e42055107cb [0,0,0,1,0,1|2,0,0]=4 13774 B17R2.2569 CCOCCCOc1cc2ccccc2s1 3c8f2cc7585a078f973b76590a0c58e5 [0,0,0,1,0,1|1,1,0]=4 13775 B17R2.2569 CCOCCCOc1nc2ccccc2[nH]1 38e491c70a8a94dc3b225d379aa9a95b [0,0,0,1,0,1|2,0,0]=4 13776 B17R2.2569 CCOCCCOc1nc2ccccc2s1 40759fb59bf9d93971d9c1c9d1bcb068 [0,0,0,1,0,1|1,1,0]=4 13777 B17R2.2569 CCSCCCOc1cc2ccccc2[nH]1 579a4b7dd01f4077ab12e45cc8a371c0 [0,0,0,1,0,1|2,0,0]=4 13778 B17R2.2569 CCSCCCOc1cc2ccccc2s1 ae6c02081d265d2cabfa297e6ef12bd1 [0,0,0,1,0,1|1,1,0]=4 13779 B17R2.2569 CCSCCCOc1nc2ccccc2[nH]1 f586d6f2ed2a9839fdb3d493da61b7e1 [0,0,0,1,0,1|2,0,0]=4 13780 B17R2.2569 CCSCCCOc1nc2ccccc2s1 0914b0b9a147505bbfa82829e924b9eb [0,0,0,1,0,1|1,1,0]=4 13781 B17R2.2569 COCCCCOc1cc2ccccc2[nH]1 29e30594fe3ab82ec7cfdaf871821d23 [0,0,0,1,0,1|2,0,0]=4 13782 B17R2.2569 COCCCCOc1cc2ccccc2s1 3fb2686add393566519f117f54143c17 [0,0,0,1,0,1|1,1,0]=4 13783 B17R2.2569 COCCCCOc1nc2ccccc2[nH]1 34c8d473bfd4daae53af39bf651e09ed [0,0,0,1,0,1|2,0,0]=4 13784 B17R2.2569 COCCCCOc1nc2ccccc2s1 8bfab56ca2d989d9da6e475f35f4e235 [0,0,0,1,0,1|1,1,0]=4 13785 B17R2.2569 FCCCCCOc1cc2ccccc2[nH]1 5554d9a35d50f7383e436f411ff8f3bd [0,0,0,1,0,1|2,0,0]=4 13786 B17R2.2569 FCCCCCOc1cc2ccccc2s1 ead55864072435fa0d13820d4f4b3acb [0,0,0,1,0,1|1,1,0]=4 13787 B17R2.2569 FCCCCCOc1nc2ccccc2[nH]1 b2b8115af1a5bb98ddefeb46e488b635 [0,0,0,1,0,1|2,0,0]=4 13788 B17R2.2569 FCCCCCOc1nc2ccccc2s1 f72e6d982564abf862eb18c8898d8922 [0,0,0,1,0,1|1,1,0]=4 13789 B17R2.2825 CCC1CCCN1C(=O)Cc2ccccn2 c02c507b5f3c5dcfa1e3a26f9bf16ab6 [0,0,0,1,0,1|2,0,0]=4 13790 B17R2.2825 CCC1CCCN1C(=O)Cc2cccnc2 dcc7d40e1c9f254fc05699f2d6f7a2da [0,0,0,1,0,1|2,0,0]=4 13791 B17R2.2825 CCC1CCCN1C(=O)Cc2ccncc2 a927aefa6f164f4048f9a392bc4d0f32 [0,0,0,1,0,1|2,0,0]=4 13792 B17R2.2825 CCC1CCCN1C(=O)Nc2ccccc2 f6b0671d6cfa3a049079ab1abfec8453 [0,0,0,1,0,1|1,0,0]=3 13793 B17R2.2825 CCC1CCCN1C(=O)Nc2ccccn2 655b78acd26d7eb57243de625f23f7ba [0,0,0,1,0,1|2,0,0]=4 13794 B17R2.2825 CCC1CCCN1C(=O)Nc2cccnc2 5d6687d8313ddf5e25a3c882924baf13 [0,0,0,1,0,1|2,0,0]=4 13795 B17R2.2825 CCC1CCCN1C(=O)Nc2ccncc2 4c2a65238827cab303efe6079d220eca [0,0,0,1,0,1|2,0,0]=4 13796 B17R2.2825 CCC1CCCN1C(=S)Nc2ccccc2 8372a3040ea7d2f4a68b5d6ef6c7842b [0,0,0,1,0,1|1,1,0]=4 13797 B17R2.2825 CCN1CCCC1C(=O)Nc2ccccc2 775c9f5e25a411e12f2f451cb7e2ba78 [0,0,0,1,0,1|2,0,0]=4 13798 B17R2.2825 CCN1CCC[C@@H]1C(=O)Nc2ccccc2 b8f31bc4d46a0d425db967800a947787 [0,0,0,1,0,1|2,0,0]=4 13799 B17R2.2825 CCN1CCC[C@H]1C(=O)Nc2ccccc2 03faad9def6551e584223d188866c161 [0,0,0,1,0,1|2,0,0]=4 13800 B17R2.2825 CC[C@@H]1CCCN1C(=O)Cc2ccccn2 63c0c1552b4719c92cf048a6484a66a0 [0,0,0,1,0,1|2,0,0]=4 13801 B17R2.2825 CC[C@@H]1CCCN1C(=O)Cc2cccnc2 b24ec281430b25316046a7d7aaf478be [0,0,0,1,0,1|2,0,0]=4 13802 B17R2.2825 CC[C@@H]1CCCN1C(=O)Cc2ccncc2 4850b03989a1f8de2d104fe2fe5ae1a5 [0,0,0,1,0,1|2,0,0]=4 13803 B17R2.2825 CC[C@@H]1CCCN1C(=O)Nc2ccccc2 e1f8eb04c22213ea57b74be4eb39420a [0,0,0,1,0,1|1,0,0]=3 13804 B17R2.2825 CC[C@@H]1CCCN1C(=O)Nc2ccccn2 b9b75bf360039dfbcc304269af89a53a [0,0,0,1,0,1|2,0,0]=4 13805 B17R2.2825 CC[C@@H]1CCCN1C(=O)Nc2cccnc2 6f1bfd7b1ad1a3f0b83f698a2bbb53a2 [0,0,0,1,0,1|2,0,0]=4 13806 B17R2.2825 CC[C@@H]1CCCN1C(=O)Nc2ccncc2 891c79faca858d28ea66dfa905495841 [0,0,0,1,0,1|2,0,0]=4 13807 B17R2.2825 CC[C@@H]1CCCN1C(=S)Nc2ccccc2 2a826663d87a9a3f0519625f465bea7c [0,0,0,1,0,1|1,1,0]=4 13808 B17R2.3417 CC1CCCCN1C(=O)Cc2ccccn2 53fdd40e2b51f08d251638e6ae552c5d [0,0,0,1,0,1|2,0,0]=4 13809 B17R2.3417 CC1CCCCN1C(=O)Cc2cccnc2 2ab85e39df14b785bad61f1dd7592f4b [0,0,0,1,0,1|2,0,0]=4 13810 B17R2.3417 CC1CCCCN1C(=O)Cc2ccncc2 b12194fd427812088b2ea33b70326b95 [0,0,0,1,0,1|2,0,0]=4 13811 B17R2.3417 CC1CCCCN1C(=O)Nc2cccnc2 b8a22b5597f2f0f2beab0444c019dc91 [0,0,0,1,0,1|2,0,0]=4 13812 B17R2.3417 CC1CCCCN1C(=O)Nc2ccncc2 060908d69dd51f545708efdcabcfe7de [0,0,0,1,0,1|2,0,0]=4 13813 B17R2.3417 CC1CCCCN1C(=S)Nc2ccccc2 ec7dbfa39423e52bba62e58b62521707 [0,0,0,1,0,1|1,1,0]=4 13814 B17R2.3417 C[C@@H]1CCCCN1C(=O)Cc2ccccn2 181a2a63655538aafaaf2446112a1da4 [0,0,0,1,0,1|2,0,0]=4 13815 B17R2.3417 C[C@@H]1CCCCN1C(=O)Cc2cccnc2 b086a2220ab7f415dba758f9cc645e82 [0,0,0,1,0,1|2,0,0]=4 13816 B17R2.3417 C[C@@H]1CCCCN1C(=O)Cc2ccncc2 89e22632cca5f7f58e3dfa1c150a08b3 [0,0,0,1,0,1|2,0,0]=4 13817 B17R2.3417 C[C@@H]1CCCCN1C(=O)Nc2cccnc2 a0bd8cb581b2d86ab1858f7409ff220e [0,0,0,1,0,1|2,0,0]=4 13818 B17R2.3417 C[C@@H]1CCCCN1C(=O)Nc2ccncc2 5ca353ce0cd2c56e8b4f685ce706ad05 [0,0,0,1,0,1|2,0,0]=4 13819 B17R2.3417 C[C@@H]1CCCCN1C(=S)Nc2ccccc2 3816a0eb6aa9068c61523871b686292f [0,0,0,1,0,1|1,1,0]=4 13820 B17R2.3417 C[C@H]1CCCCN1C(=O)Cc2ccccn2 1272cc56016aefa73837a054884d2190 [0,0,0,1,0,1|2,0,0]=4 13821 B17R2.3417 C[C@H]1CCCCN1C(=O)Cc2cccnc2 83bbdaf0d8a58fe401a8f0b022174767 [0,0,0,1,0,1|2,0,0]=4 13822 B17R2.3417 C[C@H]1CCCCN1C(=O)Cc2ccncc2 6b05343429766d211df1e1a524a43b3c [0,0,0,1,0,1|2,0,0]=4 13823 B17R2.3417 C[C@H]1CCCCN1C(=O)Nc2cccnc2 b2ce85eac48617d182710d0e6d2f66d5 [0,0,0,1,0,1|2,0,0]=4 13824 B17R2.3417 C[C@H]1CCCCN1C(=O)Nc2ccncc2 8bc1557ad68854b3f494f8a8267b412b [0,0,0,1,0,1|2,0,0]=4 13825 B17R2.3417 C[C@H]1CCCCN1C(=S)Nc2ccccc2 346f8e062bd808cf53b80d62bee5a539 [0,0,0,1,0,1|1,1,0]=4 13826 B17R2.3512 CC1CCCN1CC(=O)Cc2ccccc2 b4b9fc41469777d6fcc4cf9b1fc0deb5 [0,0,0,1,0,1|2,0,0]=4 13827 B17R2.3512 CC1CCCN1CC(=O)Nc2ccccc2 d1536ba27a72cae469a4a91ac84c9649 [0,0,0,1,0,1|2,0,0]=4 13828 B17R2.3512 CC1CCCN1CC(=O)Oc2ccccc2 a12111393b87442c32e6ac1f42e9b04b [0,0,0,1,0,1|2,0,0]=4 13829 B17R2.3512 C[C@@H]1CCCN1CC(=O)Cc2ccccc2 23e4f0152ac4df714a5f9a6999ae13f0 [0,0,0,1,0,1|2,0,0]=4 13830 B17R2.3512 C[C@@H]1CCCN1CC(=O)Nc2ccccc2 7cfa2e1305b7d06a7c79191a042eb27d [0,0,0,1,0,1|2,0,0]=4 13831 B17R2.3512 C[C@@H]1CCCN1CC(=O)Oc2ccccc2 c52912d54f5974039c56a82f15b035d3 [0,0,0,1,0,1|2,0,0]=4 13832 B17R2.3512 C[C@H]1CCCN1CC(=O)Cc2ccccc2 0adfcc5164b66307cba93f5ee8b9d188 [0,0,0,1,0,1|2,0,0]=4 13833 B17R2.3512 C[C@H]1CCCN1CC(=O)Nc2ccccc2 39bded1561c6bde9feca0f836fc39cb6 [0,0,0,1,0,1|2,0,0]=4 13834 B17R2.3512 C[C@H]1CCCN1CC(=O)Oc2ccccc2 9189adb1cca8fbc1d04cf92d85b94a58 [0,0,0,1,0,1|2,0,0]=4 13835 B17R2.3851 CC1CC1COCC(=O)Cc2ccccc2 d60517c971e15d7b719c3f5ea0556038 [0,0,0,1,0,1|2,0,0]=4 13836 B17R2.3851 CC1CC1COCC(=O)Nc2ccccc2 6813da715f86980f54c6e347c9c61aac [0,0,0,1,0,1|2,0,0]=4 13837 B17R2.3851 CC1CC1COCC(=O)Oc2ccccc2 7e1efb6d03d46c846278cc39d1bdbbda [0,0,0,1,0,1|2,0,0]=4 13838 B17R2.3851 CC1CC1NCCC(=O)Nc2ccccc2 42d18238d1d9bb191b57f9a732b535e0 [0,0,0,1,0,1|2,0,0]=4 13839 B17R2.3851 C[C@@H]1C[C@H]1COCC(=O)Cc2ccccc2 b2072ed6c1771cee0e66540b991d3a54 [0,0,0,1,0,1|2,0,0]=4 13840 B17R2.3851 C[C@@H]1C[C@H]1COCC(=O)Nc2ccccc2 9a5aa14776ec776d548be4390cf66a78 [0,0,0,1,0,1|2,0,0]=4 13841 B17R2.3851 C[C@@H]1C[C@H]1COCC(=O)Oc2ccccc2 db3d24eb57e3fa65ebada338d6be4220 [0,0,0,1,0,1|2,0,0]=4 13842 B17R2.3851 C[C@H]1C[C@@H]1COCC(=O)Cc2ccccc2 9c5d7d10987642c50f573d062722d62f [0,0,0,1,0,1|2,0,0]=4 13843 B17R2.3851 C[C@H]1C[C@@H]1COCC(=O)Nc2ccccc2 321f0e05b2075512d412d25a5f49e851 [0,0,0,1,0,1|2,0,0]=4 13844 B17R2.3851 C[C@H]1C[C@@H]1COCC(=O)Oc2ccccc2 4ca51b54827d9b2f0a807283632e6f29 [0,0,0,1,0,1|2,0,0]=4 13845 B17R2.3851 C[C@H]1C[C@H]1COCC(=O)Cc2ccccc2 66af7083647cca6903ad83659c473af9 [0,0,0,1,0,1|2,0,0]=4 13846 B17R2.3851 C[C@H]1C[C@H]1COCC(=O)Nc2ccccc2 10d971ce1eb0bc7fdbb71c0544bfa9cd [0,0,0,1,0,1|2,0,0]=4 13847 B17R2.3851 C[C@H]1C[C@H]1COCC(=O)Oc2ccccc2 6aba9efeae43eba21e019dd6d6471c24 [0,0,0,1,0,1|2,0,0]=4 13848 B17R2.4072 CCCN1CCNC(=O)C1c2ccccc2 5e29dd7c3758ae7c601e2ccb4b8de6f2 [0,0,0,1,0,1|2,0,0]=4 13849 B17R2.4072 CCCN1CCNC(=O)[C@@H]1c2ccccc2 bc8aed7916532cd1e9e92cfae104cfc8 [0,0,0,1,0,1|2,0,0]=4 13850 B17R2.4072 CCCN1CCNC(=O)[C@H]1c2ccccc2 5a6ed20f2e3c06555c377213f1f13bb4 [0,0,0,1,0,1|2,0,0]=4 13851 B17R2.5327 CN1CCC1CNC(=O)Nc2ccccc2 2355dec25f368a2dfacd2e1dc3e9b260 [0,0,0,1,0,1|2,0,0]=4 13852 B17R2.5327 C[C@@H]1CC[C@@H]1NCC(=O)Cc2ccccc2 27c6f53b5f229d56b3df99ee43e86365 [0,0,0,1,0,1|2,0,0]=4 13853 B17R2.5327 C[C@@H]1CC[C@@H]1NCC(=O)Nc2ccccc2 de49a1d3d6f2ecd7914e585db269a7e1 [0,0,0,1,0,1|2,0,0]=4 13854 B17R2.5327 C[C@@H]1CC[C@@H]1NCC(=O)Oc2ccccc2 90d264f71ab8416d670fdd7b4eccc5ed [0,0,0,1,0,1|2,0,0]=4 13855 B17R2.5327 C[C@@H]1CC[C@H]1NCC(=O)Cc2ccccc2 55b7d7b083231b31644477b984a06494 [0,0,0,1,0,1|2,0,0]=4 13856 B17R2.5327 C[C@@H]1CC[C@H]1NCC(=O)Nc2ccccc2 9f7b427a2c5d78afc1c0fa8c86e19f7e [0,0,0,1,0,1|2,0,0]=4 13857 B17R2.5327 C[C@@H]1CC[C@H]1NCC(=O)Oc2ccccc2 7144079b993b22570e1a07717638bf24 [0,0,0,1,0,1|2,0,0]=4 13858 B17R2.5718 CC(Cc1ccccc1)OCCC2CCC2 153facfb9cac785d35dc462626ae5fe5 [0,0,0,1,0,1|1,0,1]=4 13859 B17R2.5718 C[C@@H](Cc1ccccc1)OCCC2CCC2 09b9903f9ee81ab2db25ca6e74647274 [0,0,0,1,0,1|1,0,1]=4 13860 B17R2.5718 C[C@H](Cc1ccccc1)OCCC2CCC2 04dd253037f5a4e6623f9bf466390b48 [0,0,0,1,0,1|1,0,1]=4 13861 B17R2.5718 O=C(CCCN1CCC1)Nc2ccccc2 ffdc370c7cd00d42858925352219938e [0,0,0,1,0,1|2,0,0]=4 13862 B17R2.5718 O=C(CCOC1CCC1)Nc2ccccc2 8b05bb93c51da580f37841b401fd60f0 [0,0,0,1,0,1|2,0,0]=4 13863 B17R2.5718 O=C(CCOC1CCC1)Oc2ccccc2 4c07e6070294dd50c368d7c0fea21f1a [0,0,0,1,0,1|2,0,0]=4 13864 B17R2.5718 O=C(CNCC1CCC1)Cc2ccccc2 617a0ab572687cbeba55bce3827f0ca7 [0,0,0,1,0,1|2,0,0]=4 13865 B17R2.5718 O=C(CNCC1CCC1)Nc2ccccc2 16e3ae631efe5b8731f96e0fed6590a5 [0,0,0,1,0,1|2,0,0]=4 13866 B17R2.5718 O=C(CNCC1CCC1)Oc2ccccc2 8346648eaa927606ae9c08073fe1f296 [0,0,0,1,0,1|2,0,0]=4 13867 B17R2.5718 O=C(COCC1CCC1)Cc2ccccc2 a9502ea7b66ba80a192b14eb04362e07 [0,0,0,1,0,1|2,0,0]=4 13868 B17R2.5718 O=C(COCC1CCC1)Nc2ccccc2 2fe687f6467e03a6e5cffddd1faa4e9a [0,0,0,1,0,1|2,0,0]=4 13869 B17R2.5718 O=C(COCC1CCC1)Oc2ccccc2 9dd1fc3863d4593b9491867e262ac0ac [0,0,0,1,0,1|2,0,0]=4 13870 B17R2.5718 O=C(Cc1ccccc1)NCCN2CCC2 635e32eb16b7c88e849713381390e512 [0,0,0,1,0,1|2,0,0]=4 13871 B17R2.5718 O=C(Cc1ccccc1)NCOC2CCC2 8cb7dff121dba939546f196455f53412 [0,0,0,1,0,1|2,0,0]=4 13872 B17R2.5718 O=C(Cc1ccccn1)NCCC2CCC2 b90e3b9705e8ec4743e153332907badf [0,0,0,1,0,1|2,0,0]=4 13873 B17R2.5718 O=C(Cc1cccnc1)NCCC2CCC2 633f86e20f9e7c00662f30704a5cccc7 [0,0,0,1,0,1|2,0,0]=4 13874 B17R2.5718 O=C(Cc1ccncc1)NCCC2CCC2 e2caa34bfbd0334147951adeaf3a3d89 [0,0,0,1,0,1|2,0,0]=4 13875 B17R2.5718 O=C(NCCC1CCC1)Nc2ccccn2 38b4025110ef86c0d445d5cf4ce934b4 [0,0,0,1,0,1|2,0,0]=4 13876 B17R2.5718 O=C(NCCC1CCC1)Nc2cccnc2 bc15e8e4c0810ff51982785bc3997a7c [0,0,0,1,0,1|2,0,0]=4 13877 B17R2.5718 O=C(NCCC1CCC1)Nc2ccncc2 255eeb15b0205c17f2be06f78e89ef71 [0,0,0,1,0,1|2,0,0]=4 13878 B17R2.5718 O=C(NCCC1CCO1)Nc2ccccc2 76b6c0673b36476d226288493bf386ef [0,0,0,1,0,1|2,0,0]=4 13879 B17R2.5718 O=C(NCCC1COC1)Nc2ccccc2 db404d639817e34e586ad8fe87776eac [0,0,0,1,0,1|2,0,0]=4 13880 B17R2.5718 O=C(NCCN1CCC1)Nc2ccccc2 903263370380ab5c634cd9845905cc36 [0,0,0,1,0,1|2,0,0]=4 13881 B17R2.5718 O=C(NCC[C@@H]1CCO1)Nc2ccccc2 aa025b28f51f7f6249f800b2eb6100cf [0,0,0,1,0,1|2,0,0]=4 13882 B17R2.5718 S=C(NCCC1CCC1)Nc2ccccc2 2f053908505cc3f6bf922e9bada9a579 [0,0,0,1,0,1|1,1,0]=4 13883 B17R2.8341 CC(Cc1ccccc1)OCC2CCCC2 1b91cdb9a5628211902fa21c299cb919 [0,0,0,1,0,1|1,0,1]=4 13884 B17R2.8341 C[C@@H](Cc1ccccc1)OCC2CCCC2 af871860895a25d4260dd03052b918f9 [0,0,0,1,0,1|1,0,1]=4 13885 B17R2.8341 C[C@H](Cc1ccccc1)OCC2CCCC2 dd2845a923bb87109771e74985a943f7 [0,0,0,1,0,1|1,0,1]=4 13886 B17R2.8341 O=C(/C=C/C1CCCC1)Nc2ccccc2 f2257037a5fb93d142144211ac1aa1ca [0,0,0,1,0,1|1,0,1]=4 13887 B17R2.8341 O=C(CCC1CCCO1)Nc2ccccc2 7f5541baf4fb2a59c9657487c54d68e5 [0,0,0,1,0,1|2,0,0]=4 13888 B17R2.8341 O=C(CNC1CCCC1)Cc2ccccc2 37acf231e517e3c5d4a03dcdd14b1949 [0,0,0,1,0,1|2,0,0]=4 13889 B17R2.8341 O=C(CNC1CCCC1)Nc2ccccc2 7eab0b21d34efe28223b9ff8c987e829 [0,0,0,1,0,1|2,0,0]=4 13890 B17R2.8341 O=C(COC1CCCC1)Cc2ccccc2 77977ba1e10b80d57582064547cc5508 [0,0,0,1,0,1|2,0,0]=4 13891 B17R2.8341 O=C(COC1CCCC1)Nc2ccccc2 411f3a2e5fe6364dfc912601bbf55409 [0,0,0,1,0,1|2,0,0]=4 13892 B17R2.8341 O=C(COC1CCCC1)Oc2ccccc2 501b854001c44cf6f45f0802ce8c1928 [0,0,0,1,0,1|2,0,0]=4 13893 B17R2.8341 O=C(Cc1ccccn1)NCC2CCCC2 0fa5b6362d47a4a7b772ea69b89c7df8 [0,0,0,1,0,1|2,0,0]=4 13894 B17R2.8341 O=C(Cc1cccnc1)NCC2CCCC2 c00d48ff3d3c9317cf94a59f99230cf1 [0,0,0,1,0,1|2,0,0]=4 13895 B17R2.8341 O=C(Cc1ccncc1)NCC2CCCC2 2f7823f54ac5a7e64fdfabd3f0c24c63 [0,0,0,1,0,1|2,0,0]=4 13896 B17R2.8341 O=C(NCC1CCCC1)Nc2ccccc2 de3f597a4e7c75ca47b680419b27fa5b [0,0,0,1,0,1|1,0,0]=3 13897 B17R2.8341 O=C(NCC1CCCC1)Nc2ccccn2 8880101c6e0c27d8410ad6f3a3b1279c [0,0,0,1,0,1|2,0,0]=4 13898 B17R2.8341 O=C(NCC1CCCC1)Nc2cccnc2 a46165204c49ebfbf650c8e46a696c08 [0,0,0,1,0,1|2,0,0]=4 13899 B17R2.8341 O=C(NCC1CCCC1)Nc2ccncc2 2ce7e9071b7fb03c104c4cf6cf1ed9a8 [0,0,0,1,0,1|2,0,0]=4 13900 B17R2.8341 O=C(NCC1CCCO1)Nc2ccccc2 8e87f1713447b0065f95c282b14bf2a8 [0,0,0,1,0,1|2,0,0]=4 13901 B17R2.8341 O=C(NCC1CCOC1)Nc2ccccc2 ced5e6a2f18d736b49dbd802aadc704b [0,0,0,1,0,1|2,0,0]=4 13902 B17R2.8341 O=C(NC[C@@H]1CCCO1)Nc2ccccc2 a9df470ae916263c20692aada7359c37 [0,0,0,1,0,1|2,0,0]=4 13903 B17R2.8341 O=C(NC[C@@H]1CCOC1)Nc2ccccc2 b59c5026256c8fe8771570288a57d1ea [0,0,0,1,0,1|2,0,0]=4 13904 B17R2.8341 O=C(NC[C@H]1CCCO1)Nc2ccccc2 49a4b15931f879fe61138b7a46f3935e [0,0,0,1,0,1|2,0,0]=4 13905 B17R2.8341 O=C(NC[C@H]1CCOC1)Nc2ccccc2 907c6a899147c0d597add3091bd4e21d [0,0,0,1,0,1|2,0,0]=4 13906 B17R2.8341 S=C(NCC1CCCC1)Nc2ccccc2 f40d55de86a35001ca0fb4f4cc036490 [0,0,0,1,0,1|1,1,0]=4 13907 B17R2.12128 CCCCCN1CC(=O)Nc2c1cccc2 92122e31771094ab4db880332914e104 [0,0,0,1,0,1|2,0,0]=4 13908 B17R2.12128 CCCCCN1CC(=O)Oc2c1cccc2 a45d5a1d326d11ca4f5c6c3e3379cd32 [0,0,0,1,0,1|2,0,0]=4 13909 B17R2.12128 CCCOCC1CC(=O)Nc2c1cccc2 62453769cc6ee1b03145ef72d526c4d2 [0,0,0,1,0,1|2,0,0]=4 13910 B17R2.17872 O=C(CCCCC1CC1)Nc2ccccc2 a4ab29bd8d9c4e44163c36804698c100 [0,0,0,1,0,1|1,0,0]=3 13911 B17R2.17872 O=C(CCCCC1CC1)Nc2ccccn2 98365effb09ab326efc634819cd6e7ce [0,0,0,1,0,1|2,0,0]=4 13912 B17R2.17872 O=C(CCCCC1CC1)Nc2cccnc2 4e16abdf7f143e9d081604711df69cfa [0,0,0,1,0,1|2,0,0]=4 13913 B17R2.17872 O=C(CCCNC1CC1)Nc2ccccc2 34ad36c616ce7f9d259e28cf6acdbbf7 [0,0,0,1,0,1|2,0,0]=4 13914 B17R2.17872 O=C(CCCOC1CC1)Nc2ccccc2 dc9c5686a4f05d753dccccb2e2e9ac13 [0,0,0,1,0,1|2,0,0]=4 13915 B17R2.17872 O=C(CCNCC1CC1)Nc2ccccc2 1e20aeb5c1b3860900d6c7594369b88a [0,0,0,1,0,1|2,0,0]=4 13916 B17R2.17872 O=C(CCOCC1CC1)Nc2ccccc2 4eb38159c300cf5ced8bee5e4da5620a [0,0,0,1,0,1|2,0,0]=4 13917 B17R2.17872 O=C(CNCCC1CC1)Cc2ccccc2 33dce2563523f48521c21a3ef83515cd [0,0,0,1,0,1|2,0,0]=4 13918 B17R2.17872 O=C(CNCCC1CC1)Nc2ccccc2 d25cfd979be035c52f4bf860aa51f4a6 [0,0,0,1,0,1|2,0,0]=4 13919 B17R2.17872 O=C(CNCCC1CC1)Oc2ccccc2 28953e354c2acbd813ba5203014a2a4c [0,0,0,1,0,1|2,0,0]=4 13920 B17R2.17872 O=C(COCCC1CC1)Cc2ccccc2 54ac1f55cdcbe854e3aaf96e02247ff0 [0,0,0,1,0,1|2,0,0]=4 13921 B17R2.17872 O=C(COCCC1CC1)Nc2ccccc2 8a9f3f143cf9fc0eef6d4748df981e20 [0,0,0,1,0,1|2,0,0]=4 13922 B17R2.17872 O=C(COCCC1CC1)Oc2ccccc2 5a2f1bc456942110d14cbd76ea4a1272 [0,0,0,1,0,1|2,0,0]=4 13923 B17R2.17872 O=C(Cc1ccccc1)NCCNC2CC2 61e043e4fafc899f026f284aa4a21c58 [0,0,0,1,0,1|2,0,0]=4 13924 B17R2.17872 O=C(Cc1ccccc1)NCCOC2CC2 5f5b6c735c7152fa969462d440e58eed [0,0,0,1,0,1|2,0,0]=4 13925 B17R2.17872 O=C(Cc1ccccc1)NCOCC2CC2 b01e6578cc91194dd5121b22313a69d3 [0,0,0,1,0,1|2,0,0]=4 13926 B17R2.17872 O=C(NCCOC1CC1)Nc2ccccc2 48aedf69ccb923052cdd040b03d39be3 [0,0,0,1,0,1|2,0,0]=4 13927 B17R2.19036 CCCCCNC1C(=O)Nc2c1cccc2 e2d7200f6d36482c504e5801d698ee19 [0,0,0,1,0,1|2,0,0]=4 13928 B17R2.19036 CCCCNCC1C(=O)Nc2c1cccc2 241bad36ccfae8d76d32599f0c4a34ea [0,0,0,1,0,1|2,0,0]=4 13929 B17R2.19036 CCCCOCn1c(=O)sc2c1cccc2 366b485ebbca791f417d7da2d1e212b9 [0,0,0,1,0,1|2,0,0]=4 13930 B17R2.19036 CCCNCCn1c(=O)[nH]c2c1cccc2 3e1dcbc40b2224f3843180f9af7cbd78 [0,0,0,1,0,1|2,0,0]=4 13931 B17R2.19036 CCCOCCC1C(=O)Nc2c1cccc2 584d3db6bbb83ec80338230de2fc3bea [0,0,0,1,0,1|2,0,0]=4 13932 B17R2.19036 CCCOCCn1c(=O)[nH]c2c1cccc2 a36138a1da326293afdbc289432a9480 [0,0,0,1,0,1|2,0,0]=4 13933 B17R2.19036 CCOCCCn1c(=O)[nH]c2c1cccc2 cf954484090fed2a7c7526e3a0aec869 [0,0,0,1,0,1|2,0,0]=4 13934 B17R2.45575 O=C(Cc1ccccn1)N2CCCCCC2 81842116641dbc1695178c706f985349 [0,0,0,1,0,1|2,0,0]=4 13935 B17R2.45575 O=C(Cc1cccnc1)N2CCCCCC2 88a4022e4659916747fe963e79753733 [0,0,0,1,0,1|2,0,0]=4 13936 B17R2.45575 O=C(Cc1ccncc1)N2CCCCCC2 7f8a180474716236fbcde44d5f902580 [0,0,0,1,0,1|2,0,0]=4 13937 B17R2.45575 O=C(Nc1ccccc1)N2CCCCCC2 20ce26a0b5f51b8cad003d79c236c2c7 [0,0,0,1,0,1|1,0,0]=3 13938 B17R2.45575 O=C(Nc1ccccc1)N2CCCNCC2 1751055a911abf32b5f54715396718b4 [0,0,0,1,0,1|2,0,0]=4 13939 B17R2.45575 O=C(Nc1ccccc1)N2CCCOCC2 4f1db03bf9470d9cf0f457248b3a1b2c [0,0,0,1,0,1|2,0,0]=4 13940 B17R2.45575 O=C(Nc1ccccn1)N2CCCCCC2 ee2647f7ecf3d61aa1bdbf9ce7d7c042 [0,0,0,1,0,1|2,0,0]=4 13941 B17R2.45575 O=C(Nc1cccnc1)N2CCCCCC2 98fe0d22dd9ecf2c2e0dab0e44f78e6f [0,0,0,1,0,1|2,0,0]=4 13942 B17R2.45575 O=C(Nc1ccncc1)N2CCCCCC2 ca6d777f07afb2c842594a231bb038f3 [0,0,0,1,0,1|2,0,0]=4 13943 B17R2.45575 S=C(Nc1ccccc1)N2CCCCCC2 7a57c1721f4391ca1a83e5dea150c981 [0,0,0,1,0,1|1,1,0]=4 13944 B17R2.59646 CCCCN1CCC(=O)Nc2c1cccc2 cc3018c09269231eea501793fd81fd7d [0,0,0,1,0,1|2,0,0]=4 13945 B17R2.268 CCCCOC1C=C(CC1)c2ccccc2 94ce34c30cd5c26a656f948174af653d [0,1,0,1,0,0|2,0,0]=4 13946 B17R2.2519 CCC1CCN(C1)CC(=O)c2ccccc2 3fb14e4f51b2f1213c3b2124b8bc4b4c [0,1,0,1,0,0|2,0,0]=4 13947 B17R2.2519 CCN1CCC(C1)NC(=O)c2ccccc2 5d30887df9031006e945054097ddc67c [0,1,0,1,0,0|2,0,0]=4 13948 B17R2.2519 CCN1CC[C@@H](C1)NC(=O)c2ccccc2 936bfe3415556ad18fcffe1e80d22c79 [0,1,0,1,0,0|2,0,0]=4 13949 B17R2.2519 CCN1CC[C@H](C1)NC(=O)c2ccccc2 009bfe41121970af9eade3011e2f1a18 [0,1,0,1,0,0|2,0,0]=4 13950 B17R2.2519 CO[C@H]1CC[C@H](C1)NC(=O)c2ccccc2 42356ef7b375832f062ee80d247ca2f0 [0,1,0,1,0,0|2,0,0]=4 13951 B17R2.2519 O=C(NC1CCC(C1)CO)c2ccccc2 b8a7ef8f16d1bd2bc30344188e0ff9ce [0,1,0,1,0,0|2,0,0]=4 13952 B17R2.2519 O=C(N[C@@H]1CC[C@@H](C1)CO)c2ccccc2 c3554150cfed9f833fe80a2051dd6339 [0,1,0,1,0,0|2,0,0]=4 13953 B17R2.2519 O=C(N[C@@H]1CC[C@H](C1)CO)c2ccccc2 5b5e1c68a88cabdda9a763a62c0642c7 [0,1,0,1,0,0|2,0,0]=4 13954 B17R2.2519 O=C(N[C@H]1CC[C@@H](C1)CO)c2ccccc2 5d41dfdbaeb9f6bd581ff023db5abe01 [0,1,0,1,0,0|2,0,0]=4 13955 B17R2.2519 O=C(N[C@H]1CC[C@H](C1)CO)c2ccccc2 c7c8f3916cd23e6db29c294fbc1ebf5c [0,1,0,1,0,0|2,0,0]=4 13956 B17R2.4458 CCCC1CN(C1)CC(=O)c2ccccc2 31e682a0fd690b102f4e746196fd8883 [0,1,0,1,0,0|2,0,0]=4 13957 B17R2.4458 COCC1CC(C1)NC(=O)c2ccccc2 4d1620c5805e7496d7b90109ae5f36cd [0,1,0,1,0,0|2,0,0]=4 13958 B17R2.4993 CC1CCCCCN1C(=O)c2ccccc2 4013c0d0cc2f2cee8ffd36863af50645 [0,1,0,1,0,0|1,0,0]=3 13959 B17R2.4993 CC1CCCCCN1C(=O)c2ccccn2 64b9b0e2eb137f1227d4a8ad9a12151b [0,1,0,1,0,0|2,0,0]=4 13960 B17R2.4993 CC1CCCCCN1C(=O)c2cccnc2 f66f670df2a3dedd2d769704d4232cd3 [0,1,0,1,0,0|2,0,0]=4 13961 B17R2.4993 CC1CCCCCN1C(=O)c2ccncc2 1ec617e2d31974574278b8e725a98b14 [0,1,0,1,0,0|2,0,0]=4 13962 B17R2.4993 CC1CCOCCN1C(=O)c2ccccc2 9e2b2d6e8734a00b4cce405cee4c47ac [0,1,0,1,0,0|1,0,0]=3 13963 B17R2.4993 CC1CCOCCN1C(=O)c2ccccn2 ed9c2b6db9310056b71b4780330780f1 [0,1,0,1,0,0|2,0,0]=4 13964 B17R2.4993 CC1CCOCCN1C(=O)c2cccnc2 461d5534b7a42d333f39f7a2a64b0ddb [0,1,0,1,0,0|2,0,0]=4 13965 B17R2.4993 CC1CCOCCN1C(=O)c2ccncc2 9152d7f7e764d24a2496685d49bb6945 [0,1,0,1,0,0|2,0,0]=4 13966 B17R2.4993 CC1CCSCCN1C(=O)c2ccccc2 633f0d0530acd38e1bd8e970c1769b5b [0,1,0,1,0,0|1,0,0]=3 13967 B17R2.4993 CC1CCSCCN1C(=O)c2ccccn2 62ddcc21f2123e48c7511a7554d2bb29 [0,1,0,1,0,0|2,0,0]=4 13968 B17R2.4993 CC1CCSCCN1C(=O)c2cccnc2 c17bfa7fedf126413bfe7690007b6b65 [0,1,0,1,0,0|2,0,0]=4 13969 B17R2.4993 CC1CCSCCN1C(=O)c2ccncc2 14f535526aaa56750b46073079b7966c [0,1,0,1,0,0|2,0,0]=4 13970 B17R2.4993 CC1COCCCN1C(=O)c2ccccc2 eda4e3cb28c22af6f8a268630a5f57d1 [0,1,0,1,0,0|1,0,0]=3 13971 B17R2.4993 CC1COCCCN1C(=O)c2ccccn2 2da14f8895e0d5cc8d2d892da77add30 [0,1,0,1,0,0|2,0,0]=4 13972 B17R2.4993 CC1COCCCN1C(=O)c2cccnc2 83a647d878b597caf42529a656e565c6 [0,1,0,1,0,0|2,0,0]=4 13973 B17R2.4993 CC1COCCCN1C(=O)c2ccncc2 4f969079de7c79fc0c6855d8dfb4958f [0,1,0,1,0,0|2,0,0]=4 13974 B17R2.5268 CC1CCCC(N1C(=O)c2ccccc2)C aa8cb8f99383198e843c2abfbd53568f [0,1,0,1,0,0|1,0,0]=3 13975 B17R2.5268 CC1CCCC(N1C(=O)c2ccccn2)C 1c1172f61992bcabfc7204a4871e21de [0,1,0,1,0,0|2,0,0]=4 13976 B17R2.5268 CC1CCCC(N1C(=O)c2cccnc2)C 213cff6625f1285a4a7b81c1fbe010a0 [0,1,0,1,0,0|2,0,0]=4 13977 B17R2.5268 CC1CCCC(N1C(=O)c2ccncc2)C 591671d34c14c26a3d7da08c3b498e41 [0,1,0,1,0,0|2,0,0]=4 13978 B17R2.5268 CC1COCC(N1C(=O)c2ccccc2)C 3629b8995df53b305a8265ca62612de5 [0,1,0,1,0,0|2,0,0]=4 13979 B17R2.5268 C[C@@H]1CCC[C@@H](N1C(=O)c2ccccc2)C fe600a5c5d4fc2234c73cf3d12d6f1fe [0,1,0,1,0,0|1,0,0]=3 13980 B17R2.5268 C[C@@H]1CCC[C@@H](N1C(=O)c2ccccn2)C 5f9980c1e0313791b34585242a943ce8 [0,1,0,1,0,0|2,0,0]=4 13981 B17R2.5268 C[C@@H]1CCC[C@@H](N1C(=O)c2cccnc2)C 645d1cc31c896aa8458235ca7f4c8126 [0,1,0,1,0,0|2,0,0]=4 13982 B17R2.5268 C[C@@H]1CCC[C@@H](N1C(=O)c2ccncc2)C bc4b5c6487da3220de0efd0e362827d0 [0,1,0,1,0,0|2,0,0]=4 13983 B17R2.5268 C[C@@H]1CCC[C@H](N1C(=O)c2ccccc2)C 77abc3c697967fc666ce4dbd560184c3 [0,1,0,1,0,0|1,0,0]=3 13984 B17R2.5268 C[C@@H]1CCC[C@H](N1C(=O)c2ccccn2)C 7da84294aeb5d4a64cf977fcd01f1234 [0,1,0,1,0,0|2,0,0]=4 13985 B17R2.5268 C[C@@H]1CCC[C@H](N1C(=O)c2cccnc2)C d2f3bee750f376bd16079990a20b9285 [0,1,0,1,0,0|2,0,0]=4 13986 B17R2.5268 C[C@@H]1CCC[C@H](N1C(=O)c2ccncc2)C 50b64b91ffe57749414251766be5397d [0,1,0,1,0,0|2,0,0]=4 13987 B17R2.5268 C[C@@H]1COC[C@@H](N1C(=O)c2ccccc2)C 7f4601711262da1e956d0f62af09b71e [0,1,0,1,0,0|2,0,0]=4 13988 B17R2.5268 C[C@@H]1COC[C@H](N1C(=O)c2ccccc2)C 6264840399de22e80d62f50084733db5 [0,1,0,1,0,0|2,0,0]=4 13989 B17R2.5268 C[C@H]1CCC[C@@H](N1C(=O)c2ccccc2)C 1c42d6732f4d959c16e59975ba7325bd [0,1,0,1,0,0|1,0,0]=3 13990 B17R2.5268 C[C@H]1CCC[C@@H](N1C(=O)c2ccccn2)C 6c8b085f433e7b2ad3f35b63ae9fb512 [0,1,0,1,0,0|2,0,0]=4 13991 B17R2.5268 C[C@H]1CCC[C@@H](N1C(=O)c2cccnc2)C 5e78db97501efed4eb20a4338ef61d13 [0,1,0,1,0,0|2,0,0]=4 13992 B17R2.5268 C[C@H]1CCC[C@@H](N1C(=O)c2ccncc2)C 4872946e617032bacc1f7511445b8cfb [0,1,0,1,0,0|2,0,0]=4 13993 B17R2.5268 C[C@H]1COC[C@@H](N1C(=O)c2ccccc2)C 6bb1c53d5898f73b54d2b1992c2b08dd [0,1,0,1,0,0|2,0,0]=4 13994 B17R2.5293 CC1CC(CCO1)NC(=O)c2ccccc2 059f7ccac05568d4b7d4e5475110f642 [0,1,0,1,0,0|2,0,0]=4 13995 B17R2.5293 CC1CCCC(C1)NC(=O)c2ccccc2 da86250a6b54215a1eb6af0388398b3d [0,1,0,1,0,0|1,0,0]=3 13996 B17R2.5293 CC1CCCC(C1)NC(=O)c2ccccn2 2666a9fefc1f5cd1c76d0e46164e58a6 [0,1,0,1,0,0|2,0,0]=4 13997 B17R2.5293 CC1CCCC(C1)NC(=O)c2cccnc2 1390848ff4820ed4a1521fd19ac0c357 [0,1,0,1,0,0|2,0,0]=4 13998 B17R2.5293 CC1CCCC(C1)NC(=O)c2ccncc2 14f5fb57c97fd392c9ba18cebe7d9bf7 [0,1,0,1,0,0|2,0,0]=4 13999 B17R2.5293 CC1CCCN(C1)CC(=O)c2ccccc2 f1a12e8674e483b2b8795392a74c4cc3 [0,1,0,1,0,0|2,0,0]=4 14000 B17R2.5293 CN1CCCC(C1)NC(=O)c2ccccc2 04bd67a5ba3dc49edb5a8ef71a7efc8f [0,1,0,1,0,0|2,0,0]=4 14001 B17R2.5293 CN1CCC[C@@H](C1)NC(=O)c2ccccc2 edd5e4968a14866118e2260510590f09 [0,1,0,1,0,0|2,0,0]=4 14002 B17R2.5293 CN1CCC[C@H](C1)NC(=O)c2ccccc2 8bfadbdd276637c245936392901eab99 [0,1,0,1,0,0|2,0,0]=4 14003 B17R2.5293 C[C@@H]1CCCN(C1)CC(=O)c2ccccc2 46c651704b40ec73c50f456afae079dd [0,1,0,1,0,0|2,0,0]=4 14004 B17R2.5293 C[C@@H]1CCC[C@H](C1)NC(=O)c2ccccc2 44992c6fa12e2b49b1ac3e4cdf2859ea [0,1,0,1,0,0|1,0,0]=3 14005 B17R2.5293 C[C@@H]1CCC[C@H](C1)NC(=O)c2ccccn2 832f64beccf0428e3539a6c6ed082553 [0,1,0,1,0,0|2,0,0]=4 14006 B17R2.5293 C[C@@H]1CCC[C@H](C1)NC(=O)c2cccnc2 7877b5d9a8142550c57738142f09a8f4 [0,1,0,1,0,0|2,0,0]=4 14007 B17R2.5293 C[C@@H]1CCC[C@H](C1)NC(=O)c2ccncc2 99eabb1d4a3f10a6d6d4628825c7b6f4 [0,1,0,1,0,0|2,0,0]=4 14008 B17R2.5293 C[C@@H]1C[C@@H](CCO1)NC(=O)c2ccccc2 e76081080ec73e45c86787bdff8fd17f [0,1,0,1,0,0|2,0,0]=4 14009 B17R2.5293 C[C@@H]1C[C@H](CCO1)NC(=O)c2ccccc2 c6fa57f7f9685d733f6d76a3aa2ec688 [0,1,0,1,0,0|2,0,0]=4 14010 B17R2.5293 C[C@H]1CCCN(C1)CC(=O)c2ccccc2 0e717b855de9b7b22a8d620402d82458 [0,1,0,1,0,0|2,0,0]=4 14011 B17R2.5293 C[C@H]1C[C@@H](CCO1)NC(=O)c2ccccc2 8aeb105aff40178832732bc5568fb1fe [0,1,0,1,0,0|2,0,0]=4 14012 B17R2.5293 C[C@H]1C[C@H](CCO1)NC(=O)c2ccccc2 dc757bee88382995509294acaa9a645a [0,1,0,1,0,0|2,0,0]=4 14013 B17R2.5293 O=C(CN1CCCC(C1)F)c2ccccc2 25cb1bc2c2c4dd50b54860ea94f9ce4b [0,1,0,1,0,0|2,0,0]=4 14014 B17R2.5293 O=C(CN1CCCC(C1)O)c2ccccc2 f8a59bcf9b89bc410634a7b63a426327 [0,1,0,1,0,0|2,0,0]=4 14015 B17R2.5293 O=C(CN1CCC[C@@H](C1)F)c2ccccc2 cc55ba2eb2f4c29cf0ce16912a747c80 [0,1,0,1,0,0|2,0,0]=4 14016 B17R2.5293 O=C(CN1CCC[C@@H](C1)O)c2ccccc2 e5126234ac2441596ebd3a9a0a343335 [0,1,0,1,0,0|2,0,0]=4 14017 B17R2.5293 O=C(CN1CCC[C@H](C1)F)c2ccccc2 3df06fce3b2592e994b6bc57b94dd2bd [0,1,0,1,0,0|2,0,0]=4 14018 B17R2.5293 O=C(CN1CCC[C@H](C1)O)c2ccccc2 e444a7e9189aecfad76009da99125544 [0,1,0,1,0,0|2,0,0]=4 14019 B17R2.5293 O=C(NC1CCCC(C1)O)c2ccccc2 cffd89b2a7a6a971ad5fcbf87ae5de7f [0,1,0,1,0,0|1,0,0]=3 14020 B17R2.5293 O=C(NC1CCCC(C1)O)c2ccccn2 b997ddaf8031197c2ba7c171dedb5426 [0,1,0,1,0,0|2,0,0]=4 14021 B17R2.5293 O=C(NC1CCCC(C1)O)c2cccnc2 10ee4c25bcfee6c6bd1ab08baebc9461 [0,1,0,1,0,0|2,0,0]=4 14022 B17R2.5293 O=C(NC1CCCC(C1)O)c2ccncc2 a2c3f8ca66bd6e04dd37a076705de386 [0,1,0,1,0,0|2,0,0]=4 14023 B17R2.5293 O=C(NC1COCC(C1)O)c2ccccc2 872763111eeb8327cfdd5f97883380ae [0,1,0,1,0,0|2,0,0]=4 14024 B17R2.5293 O=C(N[C@@H]1CCC[C@@H](C1)O)c2ccccc2 59317e64bf7d323c0936e89c4587a407 [0,1,0,1,0,0|1,0,0]=3 14025 B17R2.5293 O=C(N[C@@H]1CCC[C@@H](C1)O)c2ccccn2 6de64594308e923e3381811561044f0c [0,1,0,1,0,0|2,0,0]=4 14026 B17R2.5293 O=C(N[C@@H]1CCC[C@@H](C1)O)c2cccnc2 0c45f216421b655161090e5e6c9d049b [0,1,0,1,0,0|2,0,0]=4 14027 B17R2.5293 O=C(N[C@@H]1CCC[C@@H](C1)O)c2ccncc2 aa28c08808bc39d75869021438eaad36 [0,1,0,1,0,0|2,0,0]=4 14028 B17R2.5293 O=C(N[C@@H]1CCC[C@H](C1)O)c2ccccc2 bb77aebae4cad25a1129bc6e728f589f [0,1,0,1,0,0|1,0,0]=3 14029 B17R2.5293 O=C(N[C@@H]1CCC[C@H](C1)O)c2ccccn2 6dd34ff11289e0795e19691fba8c5cb3 [0,1,0,1,0,0|2,0,0]=4 14030 B17R2.5293 O=C(N[C@@H]1CCC[C@H](C1)O)c2cccnc2 04250b1195964bc7df3f8b6860340446 [0,1,0,1,0,0|2,0,0]=4 14031 B17R2.5293 O=C(N[C@@H]1CCC[C@H](C1)O)c2ccncc2 f0225f45a5f5433142f0fe1528ba4543 [0,1,0,1,0,0|2,0,0]=4 14032 B17R2.5293 O=C(N[C@@H]1COC[C@@H](C1)O)c2ccccc2 2f7d3f8544d8a21e6f2249c75b23de07 [0,1,0,1,0,0|2,0,0]=4 14033 B17R2.5293 O=C(N[C@H]1CCC[C@@H](C1)O)c2ccccc2 cf7ba343c1f958dc92fad814a03ede5c [0,1,0,1,0,0|1,0,0]=3 14034 B17R2.5293 O=C(N[C@H]1CCC[C@@H](C1)O)c2ccccn2 bc172cb3874e2a9c8b124d1e61c9823e [0,1,0,1,0,0|2,0,0]=4 14035 B17R2.5293 O=C(N[C@H]1CCC[C@@H](C1)O)c2cccnc2 a7f62a2ada3241f00f8434eb4435875c [0,1,0,1,0,0|2,0,0]=4 14036 B17R2.5293 O=C(N[C@H]1CCC[C@@H](C1)O)c2ccncc2 d681ab67eb0060639a6eba3daeaa3400 [0,1,0,1,0,0|2,0,0]=4 14037 B17R2.5293 O=C(N[C@H]1CCC[C@H](C1)O)c2ccccc2 f7f9ccf31c1a9d4e8379faf23213a2e9 [0,1,0,1,0,0|1,0,0]=3 14038 B17R2.5293 O=C(N[C@H]1CCC[C@H](C1)O)c2ccccn2 979c937267418806b025317b2b0489c6 [0,1,0,1,0,0|2,0,0]=4 14039 B17R2.5293 O=C(N[C@H]1CCC[C@H](C1)O)c2cccnc2 be9090a81de0ba9c6616433037c42f25 [0,1,0,1,0,0|2,0,0]=4 14040 B17R2.5293 O=C(N[C@H]1CCC[C@H](C1)O)c2ccncc2 4c18d20b112a171320e531f4e5fb0833 [0,1,0,1,0,0|2,0,0]=4 14041 B17R2.5293 O=C(N[C@H]1COC[C@H](C1)O)c2ccccc2 2c56226e0370121202245463c3928dc7 [0,1,0,1,0,0|2,0,0]=4 14042 B17R2.12072 CCCCOc1cc2ccccc2c(=O)o1 72592b3b3362e5eb6d0bd39ef6cfb45d [0,1,0,1,0,0|1,0,1]=4 14043 B17R2.18474 CC(NC(=O)c1ccccc1)C2CCCC2 7de56e350dfe73c96f7ebb8046906cf9 [0,1,0,1,0,0|1,0,0]=3 14044 B17R2.18474 CC(NC(=O)c1ccccc1)C2CCCO2 f84aa09ebec3ef9daf8bf5ad535f6dce [0,1,0,1,0,0|2,0,0]=4 14045 B17R2.18474 CC(NC(=O)c1ccccn1)C2CCCC2 d2229c2a10576ff45e8d28442a7cf2dc [0,1,0,1,0,0|2,0,0]=4 14046 B17R2.18474 CC(NC(=O)c1cccnc1)C2CCCC2 bf9f177013c4d5f7a6acce32b3dccec3 [0,1,0,1,0,0|2,0,0]=4 14047 B17R2.18474 CC(NC(=O)c1ccncc1)C2CCCC2 d2f379093dc5c6efcd745f70992a166d [0,1,0,1,0,0|2,0,0]=4 14048 B17R2.18474 CN(CC(=O)c1ccccc1)C2CCCC2 730bccd6fdd278261e1c7dc9212322db [0,1,0,1,0,0|2,0,0]=4 14049 B17R2.18474 C[C@@H](NC(=O)c1ccccc1)C2CCOC2 73f2d2a6e29c37897974f21f03ab121d [0,1,0,1,0,0|2,0,0]=4 14050 B17R2.18474 C[C@H](NC(=O)c1ccccc1)[C@@H]2CCCO2 50fe59a9b2845b4fd7b259c8b6424556 [0,1,0,1,0,0|2,0,0]=4 14051 B17R2.45538 C=C(CN1CCCCCC1)c2ccccc2 6e8d0202c6ae7cfb42fe9e87076879af [0,1,0,1,0,0|2,0,0]=4 14052 B17R2.45538 O=C(CN1CCCCCC1)c2ccccc2 533e2066983c59ae0d2fa7ec87814552 [0,1,0,1,0,0|1,0,0]=3 14053 B17R2.45538 O=C(CN1CCCCCC1)c2ccccn2 08e385e39ad6c0a2e2bf340fe2263ea3 [0,1,0,1,0,0|2,0,0]=4 14054 B17R2.45538 O=C(CN1CCCCCC1)c2cccnc2 afa24639ca46abadffed3b551641f712 [0,1,0,1,0,0|2,0,0]=4 14055 B17R2.45538 O=C(CN1CCCOCC1)c2ccccc2 946a928a2bb2d5374e052f593cea024d [0,1,0,1,0,0|2,0,0]=4 14056 B17R2.45538 O=C(NC1CCC=CCC1)c2ccccc2 91f328d427797550b6abb614d16f1382 [0,1,0,1,0,0|1,0,1]=4 14057 B17R2.45538 O=C(NC1CCCCCC1)c2ccccc2 b970ba9175a620f2a44700a2dfd6495b [0,1,0,1,0,0|1,0,0]=3 14058 B17R2.45538 O=C(NC1CCCCCC1)c2ccccn2 a16eafd8903888cb4c1aac39ee78f392 [0,1,0,1,0,0|2,0,0]=4 14059 B17R2.45538 O=C(NC1CCCCCC1)c2cccnc2 a34b6a845ccd2d1ea7f4af1c4d56b557 [0,1,0,1,0,0|2,0,0]=4 14060 B17R2.45538 O=C(NC1CCCCCC1)c2ccncc2 da4a1df8808c1bcc26d225d9f11b4455 [0,1,0,1,0,0|2,0,0]=4 14061 B17R2.45538 O=C(NC1CCCOCC1)c2ccccc2 adc82d7ea806b77489517821da349a81 [0,1,0,1,0,0|1,0,0]=3 14062 B17R2.45538 O=C(NC1CCCOCC1)c2ccccn2 3fe552af9da3273e40bd0d4f8695815f [0,1,0,1,0,0|2,0,0]=4 14063 B17R2.45538 O=C(NC1CCCOCC1)c2cccnc2 ac806ced19b21fa663f9819d2dc2006e [0,1,0,1,0,0|2,0,0]=4 14064 B17R2.45538 O=C(NC1CCCOCC1)c2ccncc2 2879eb6035f2a50b78d86502e3066f83 [0,1,0,1,0,0|2,0,0]=4 14065 B17R2.45649 CN(CC(=O)c1ccccc1)CC2CCC2 4bc29d84137463976b7e7d8015df07cf [0,1,0,1,0,0|2,0,0]=4 14066 B17R2.75994 CCCCCC(C)OC1Cc2c1cccc2 65925281c708d7700fe837519e7206cf [0,1,0,1,0,0|1,0,1]=4 14067 B17R2.75994 CCCCC[C@H](C)OC1Cc2c1cccc2 a16b1d3b1bdd41b532cdf2c9051361f4 [0,1,0,1,0,0|1,0,1]=4 14068 B17R2.295454 CC1(CCCCC1)NC(=O)c2ccccc2 87d0aa8383d78f89f5e0c352276d494b [0,1,0,1,0,0|1,0,0]=3 14069 B17R2.295454 CC1(CCCCC1)NC(=O)c2ccccn2 52dca3a79965a56e8b35f0fd57b952d0 [0,1,0,1,0,0|2,0,0]=4 14070 B17R2.295454 CC1(CCCCC1)NC(=O)c2cccnc2 496b76f1a90315f88a97502a970158ed [0,1,0,1,0,0|2,0,0]=4 14071 B17R2.295454 CC1(CCCCC1)NC(=O)c2ccncc2 5324991ce6cc90670292982a6a742ae1 [0,1,0,1,0,0|2,0,0]=4 14072 B17R2.295454 CC1(CCOCC1)NC(=O)c2ccccc2 dd3d0ee867e9e4f8c9f9b80c258e96bc [0,1,0,1,0,0|2,0,0]=4 14073 B17R2.238 CCCCN1CCOC(C1)c2ccccc2 5d88171836872ec8ab2b0b93a3ee5fc6 [0,1,0,1,0,0|1,0,1]=4 14074 B17R2.238 CCCCN1CCO[C@@H](C1)c2ccccc2 8f972719048b9f34d74c53795349cf11 [0,1,0,1,0,0|1,0,1]=4 14075 B17R2.238 CCCCN1CCO[C@H](C1)c2ccccc2 81a4ad88aea977ca81de6610dfc1d650 [0,1,0,1,0,0|1,0,1]=4 14076 B17R2.238 CCCNC1CCOC(C1)c2ccccc2 3e934464461496942f6a0025c84a975b [0,1,0,1,0,0|1,0,1]=4 14077 B17R2.238 CCCOC1CCOC(C1)c2ccccc2 e18927386e2ad7f1f98d7ebe5db7ba74 [0,1,0,1,0,0|1,0,1]=4 14078 B17R2.971 C#C[C@H]1C[C@H]1COCC(=O)c2ccccc2 638bfeb7716889bca2bf43b39ca06b09 [0,1,0,1,0,0|0,0,2]=4 14079 B17R2.971 CO[C@H]1C[C@H]1NCOC(=O)c2ccccc2 a17f60fc4c446271cfad6b1e35078f28 [0,1,0,1,0,0|1,0,0]=3 14080 B17R2.971 N#CC1CC1COCC(=O)c2ccccc2 03531526d22cc105f674a3d4db867760 [0,1,0,1,0,0|1,0,1]=4 14081 B17R2.971 O=C(CNCC1CC1CO)c2ccccc2 690f66a1bde340d5e78e22899d05f07b [0,1,0,1,0,0|2,0,0]=4 14082 B17R2.971 O=C(OCN[C@@H]1C[C@H]1CO)c2ccccc2 87b85425c6d57e65445b27796f8d06f5 [0,1,0,1,0,0|1,0,0]=3 14083 B17R2.971 O=C(OCN[C@H]1C[C@@H]1CO)c2ccccc2 4576df23c97eeae10170ddead5405152 [0,1,0,1,0,0|1,0,0]=3 14084 B17R2.971 O=C(OCN[C@H]1C[C@H]1CO)c2ccccc2 a91576eb346634cfbe975fea41f47152 [0,1,0,1,0,0|1,0,0]=3 14085 B17R2.1066 C#CC1CCCCN1C(=O)c2ccccc2 0e07d48c9e17100684ee19058f0ea201 [0,1,0,1,0,0|1,0,1]=4 14086 B17R2.1066 CCC1CCCCN1C(=O)c2ccccc2 2f2f7dcccafb27fcd57e8b02932951cd [0,1,0,1,0,0|1,0,0]=3 14087 B17R2.1066 CCC1CCCCN1C(=O)c2ccccn2 7eeed51dd7448280ce4696b0bdfc8dae [0,1,0,1,0,0|2,0,0]=4 14088 B17R2.1066 CCC1CCCCN1C(=O)c2cccnc2 99b17881b5e851674eb8a75923d1cc02 [0,1,0,1,0,0|2,0,0]=4 14089 B17R2.1066 CCC1CCCCN1C(=O)c2ccncc2 3ea02087d6f80fe9ec1cba442c69be45 [0,1,0,1,0,0|2,0,0]=4 14090 B17R2.1066 CCC1COCCN1C(=O)c2ccccc2 64f33bfc267d690a8d7c8441a80c2cb6 [0,1,0,1,0,0|1,0,0]=3 14091 B17R2.1066 CCC1COCCN1C(=O)c2ccccn2 c7f6a82ff0c207ce5aabdbcf8ab3567f [0,1,0,1,0,0|2,0,0]=4 14092 B17R2.1066 CCC1COCCN1C(=O)c2cccnc2 a5a8b94b5014a2ece65934cd92940415 [0,1,0,1,0,0|2,0,0]=4 14093 B17R2.1066 CCC1COCCN1C(=O)c2ccncc2 bb32d12cd041ecf88c06eecdb5285eb3 [0,1,0,1,0,0|2,0,0]=4 14094 B17R2.1066 CC[C@@H]1CCCCN1C(=O)c2ccccc2 91eca7542e05ee8662e59415a8e6f10c [0,1,0,1,0,0|1,0,0]=3 14095 B17R2.1066 CC[C@@H]1CCCCN1C(=O)c2ccccn2 8002889f3b08de4013a464edf0bcdeac [0,1,0,1,0,0|2,0,0]=4 14096 B17R2.1066 CC[C@@H]1CCCCN1C(=O)c2cccnc2 0c72473bef0194afdcbb7d91a7ba96fc [0,1,0,1,0,0|2,0,0]=4 14097 B17R2.1066 CC[C@@H]1CCCCN1C(=O)c2ccncc2 b8e72eebb029682fada7fb212d5065b0 [0,1,0,1,0,0|2,0,0]=4 14098 B17R2.1066 CC[C@@H]1COCCN1C(=O)c2ccccc2 a407090663e0af3b1a7a495ed1c0ac88 [0,1,0,1,0,0|1,0,0]=3 14099 B17R2.1066 CC[C@@H]1COCCN1C(=O)c2ccccn2 bbbf0a8ee81559b5195383a5441f3a55 [0,1,0,1,0,0|2,0,0]=4 14100 B17R2.1066 CC[C@@H]1COCCN1C(=O)c2cccnc2 6d78309349e938fec4a6bdc1ad58fb4e [0,1,0,1,0,0|2,0,0]=4 14101 B17R2.1066 CC[C@@H]1COCCN1C(=O)c2ccncc2 5fcdd5280b04a777d3b8d0bb0fc1244a [0,1,0,1,0,0|2,0,0]=4 14102 B17R2.1066 CC[C@H]1CCCCN1C(=O)c2ccccc2 33787bae1b6b802358019bbb0ad201f2 [0,1,0,1,0,0|1,0,0]=3 14103 B17R2.1066 CC[C@H]1CCCCN1C(=O)c2ccccn2 53c66f21a4c57d0eaa905300798ed2c2 [0,1,0,1,0,0|2,0,0]=4 14104 B17R2.1066 CC[C@H]1CCCCN1C(=O)c2cccnc2 fadd89f51d8f409fa00496f98de00db4 [0,1,0,1,0,0|2,0,0]=4 14105 B17R2.1066 CC[C@H]1CCCCN1C(=O)c2ccncc2 eed6eace699d4de840ae4af216a367e8 [0,1,0,1,0,0|2,0,0]=4 14106 B17R2.1066 CC[C@H]1COCCN1C(=O)c2ccccc2 5e81c0e83e69efbfa57798526bccf2da [0,1,0,1,0,0|1,0,0]=3 14107 B17R2.1066 CC[C@H]1COCCN1C(=O)c2ccccn2 cca4c33d945e39524c278c82f39fb06d [0,1,0,1,0,0|2,0,0]=4 14108 B17R2.1066 CC[C@H]1COCCN1C(=O)c2cccnc2 387ba6aefa2377f7395e8e4ea4d7edd5 [0,1,0,1,0,0|2,0,0]=4 14109 B17R2.1066 CC[C@H]1COCCN1C(=O)c2ccncc2 d16e532a13bab37822bfdcc2e5700edf [0,1,0,1,0,0|2,0,0]=4 14110 B17R2.1066 N#CC1CCCCN1C(=O)c2ccccc2 e94dd99c421d54901d74266b7604017a [0,1,0,1,0,0|1,0,1]=4 14111 B17R2.1066 N#C[C@@H]1CCCCN1C(=O)c2ccccc2 eed6d1d95721f86625392e3d1dc6a2b4 [0,1,0,1,0,0|1,0,1]=4 14112 B17R2.1066 N#C[C@H]1CCCCN1C(=O)c2ccccc2 8f99217e1ff74ca2b532913ecf1dc1c6 [0,1,0,1,0,0|1,0,1]=4 14113 B17R2.1066 O=C(c1ccccc1)N2CCCCC2CO cfd0a7d33468fe7d0fdc51703f9b117d [0,1,0,1,0,0|1,0,0]=3 14114 B17R2.1066 O=C(c1ccccc1)N2CCCC[C@@H]2CO 8307619e505cb7bcf2bc95f794146767 [0,1,0,1,0,0|1,0,0]=3 14115 B17R2.1066 O=C(c1ccccc1)N2CCCC[C@H]2CO 700c61bcc1c34bd9212d36eb3797cb01 [0,1,0,1,0,0|1,0,0]=3 14116 B17R2.1066 O=C(c1ccccc1)N2CCOCC2CO c6eaae085a38ebc422fd9fb73ce755f6 [0,1,0,1,0,0|2,0,0]=4 14117 B17R2.1066 O=C(c1ccccc1)N2CCOC[C@@H]2CO 584c34a6515aa540eea48fa2bb79f829 [0,1,0,1,0,0|2,0,0]=4 14118 B17R2.1066 O=C(c1ccccc1)N2CCOC[C@H]2CO 330fc7526fb3b2502e09ac4a26009365 [0,1,0,1,0,0|2,0,0]=4 14119 B17R2.1066 O=C(c1ccccn1)N2CCCCC2CO 32142de7db468d52682178f2ae220002 [0,1,0,1,0,0|2,0,0]=4 14120 B17R2.1066 O=C(c1ccccn1)N2CCCC[C@@H]2CO 96454036fcc137429b24054cc9bff738 [0,1,0,1,0,0|2,0,0]=4 14121 B17R2.1066 O=C(c1ccccn1)N2CCCC[C@H]2CO 4971e2a40f6ab3b66b14a2a3333631d3 [0,1,0,1,0,0|2,0,0]=4 14122 B17R2.1066 O=C(c1cccnc1)N2CCCCC2CO 0fc12cbca9c9385ee71638fe1981be97 [0,1,0,1,0,0|2,0,0]=4 14123 B17R2.1066 O=C(c1cccnc1)N2CCCC[C@@H]2CO f0f88a67e684652c3730ffbc8adbde6a [0,1,0,1,0,0|2,0,0]=4 14124 B17R2.1066 O=C(c1cccnc1)N2CCCC[C@H]2CO 01f3db1cf0c451d1700b608d532e6124 [0,1,0,1,0,0|2,0,0]=4 14125 B17R2.1066 O=C(c1ccncc1)N2CCCCC2CO dec8b160e625d42f6cc2baaaf0a7f713 [0,1,0,1,0,0|2,0,0]=4 14126 B17R2.1066 O=C(c1ccncc1)N2CCCC[C@@H]2CO b7d34e5434e8f426c68cdd30f415787c [0,1,0,1,0,0|2,0,0]=4 14127 B17R2.1066 O=C(c1ccncc1)N2CCCC[C@H]2CO b952687f0b9da0c1eff5722654f510ea [0,1,0,1,0,0|2,0,0]=4 14128 B17R2.1066 O=CC1CCCCN1C(=O)c2ccccc2 93074721304c5f959893da20684e86a6 [0,1,0,1,0,0|1,0,1]=4 14129 B17R2.1886 CCC1CCN1COC(=O)c2ccccc2 4cd31c9c74e7d24616c315efa52b0ac6 [0,1,0,1,0,0|0,0,0]=2 14130 B17R2.1886 COC1CCC1NCC(=O)c2ccccc2 022736882f122ebca8c02a3efccdd101 [0,1,0,1,0,0|2,0,0]=4 14131 B17R2.1886 CO[C@@H]1CC[C@@H]1NCC(=O)c2ccccc2 d0629970e345a7422a372937c45c2bc6 [0,1,0,1,0,0|2,0,0]=4 14132 B17R2.1886 CO[C@@H]1CC[C@H]1NCC(=O)c2ccccc2 4cf95b754fdba08c18539ad45764d804 [0,1,0,1,0,0|2,0,0]=4 14133 B17R2.1886 CO[C@H]1CC[C@@H]1NCC(=O)c2ccccc2 b6612ddb16f44220f7b43c79c1ecfd60 [0,1,0,1,0,0|2,0,0]=4 14134 B17R2.1886 CO[C@H]1CC[C@H]1NCC(=O)c2ccccc2 7c0fc4e4a67483fe8a5a177d715492b3 [0,1,0,1,0,0|2,0,0]=4 14135 B17R2.1886 O=C(OCN1CCC1CO)c2ccccc2 45aa227f72b5715827005d75a3e99922 [0,1,0,1,0,0|1,0,0]=3 14136 B17R2.1886 O=C(OCN1CC[C@@H]1CO)c2ccccc2 bc8a6120628fa2c4db9f8334ee19a809 [0,1,0,1,0,0|1,0,0]=3 14137 B17R2.1886 O=C(OCN1CC[C@H]1CO)c2ccccc2 e493376c39a527ef386e7c12f56ff2f6 [0,1,0,1,0,0|1,0,0]=3 14138 B17R2.2264 O=C(c1ccccc1)N2CCCCCCC2 2f5123d9f8582fad6e960dd65e3f63e9 [0,1,0,1,0,0|1,0,0]=3 14139 B17R2.2264 O=C(c1ccccn1)N2CCCCCCC2 5e8abfcab0d69371a3e8094f8eac8062 [0,1,0,1,0,0|2,0,0]=4 14140 B17R2.2264 O=C(c1cccnc1)N2CCCCCCC2 467574ccbf8122329f42983725ac5162 [0,1,0,1,0,0|2,0,0]=4 14141 B17R2.2264 O=C(c1ccncc1)N2CCCCCCC2 3531df9d67de737a776de0f7152e8f99 [0,1,0,1,0,0|2,0,0]=4 14142 B17R2.2342 C=C(COC1CCCCC1)c2ccccc2 ca0f7ed19c5f8d0ff8b620f9b795434e [0,1,0,1,0,0|1,0,0]=3 14143 B17R2.2342 C=C(COC1CCCCC1)c2ccccn2 456fd6c7e364484014128498d3fb54e0 [0,1,0,1,0,0|2,0,0]=4 14144 B17R2.2342 C=C(COC1CCCCO1)c2ccccc2 2989049e42f8911e1e908174d3228675 [0,1,0,1,0,0|2,0,0]=4 14145 B17R2.2342 C=C(COC1CCCSC1)c2ccccc2 76600147bf8b0781930cb6c88e107034 [0,1,0,1,0,0|2,0,0]=4 14146 B17R2.2342 C=C(COC1CCOCC1)c2ccccc2 aca61af04ead8bf63c14997a77ca2269 [0,1,0,1,0,0|2,0,0]=4 14147 B17R2.2342 C=C(COC1CCSCC1)c2ccccc2 3b6255cb78b71b630f1607671ddc1315 [0,1,0,1,0,0|2,0,0]=4 14148 B17R2.2342 CC(COC1CCCCC1)c2ccccc2 33f01b7a56147d6d735a673c3a8114bf [0,1,0,1,0,0|1,0,1]=4 14149 B17R2.2342 CC(OCC1CCCCC1)c2ccccc2 a2fd7fcb522ab97fb0e809fdf37dc59a [0,1,0,1,0,0|1,0,1]=4 14150 B17R2.2342 CC(OCC1CCCCO1)c2ccccc2 06aacc6a284b0ae6d7d806914051fb8c [0,1,0,1,0,0|1,0,1]=4 14151 B17R2.2342 CC(OCC1CCOCC1)c2ccccc2 7ffafd2b8cc55480e53c8e59498da819 [0,1,0,1,0,0|1,0,1]=4 14152 B17R2.2342 CC(OCC1CCSCC1)c2ccccc2 d504bed680f820069674fa99be5e13ea [0,1,0,1,0,0|1,0,1]=4 14153 B17R2.2342 CN(COC1CCCCC1)c2ccccc2 e96247cd21f4c13ea1b750b4c5feadd1 [0,1,0,1,0,0|2,0,0]=4 14154 B17R2.2342 C[C@@H](COC1CCCCC1)c2ccccc2 0b32c747f438274c65c226e5cec147a8 [0,1,0,1,0,0|1,0,1]=4 14155 B17R2.2342 C[C@@H](OCC1CCCCC1)c2ccccc2 00845ec3c7b56231a3dd67422f65ebcf [0,1,0,1,0,0|1,0,1]=4 14156 B17R2.2342 C[C@@H](OCC1CCCCO1)c2ccccc2 a695bf889c1cb1aab55db2e178b02968 [0,1,0,1,0,0|1,0,1]=4 14157 B17R2.2342 C[C@@H](OCC1CCOCC1)c2ccccc2 8e15e7bb0a76441632ab929fbf02b1f8 [0,1,0,1,0,0|1,0,1]=4 14158 B17R2.2342 C[C@@H](OCC1CCSCC1)c2ccccc2 179a4d3df20a8d98f3b6c1007fa800ab [0,1,0,1,0,0|1,0,1]=4 14159 B17R2.2342 C[C@H](COC1CCCCC1)c2ccccc2 6b594a19fa698f40d535353d5817dfab [0,1,0,1,0,0|1,0,1]=4 14160 B17R2.2342 C[C@H](OCC1CCCCC1)c2ccccc2 3ac129f54ebfb97a6687a3fa928af1b1 [0,1,0,1,0,0|1,0,1]=4 14161 B17R2.2342 C[C@H](OCC1CCCCO1)c2ccccc2 6a9145524310cf031e21533c57929f5d [0,1,0,1,0,0|1,0,1]=4 14162 B17R2.2342 C[C@H](OCC1CCOCC1)c2ccccc2 4859e74f55117e34f2ac97ae73b661d0 [0,1,0,1,0,0|1,0,1]=4 14163 B17R2.2342 C[C@H](OCC1CCSCC1)c2ccccc2 33d3152606f76f75f0e3e3a5cd8dde1a [0,1,0,1,0,0|1,0,1]=4 14164 B17R2.2342 FC(COC1CCCCC1)c2ccccc2 05ced3c19d347e98f43c50807e6e0d8c [0,1,0,1,0,0|1,0,1]=4 14165 B17R2.2342 O=C(CCN1CCSCC1)c2ccccc2 8bcd05dc30f6c6ec1f31dc399aed14a7 [0,1,0,1,0,0|2,0,0]=4 14166 B17R2.2342 O=C(CNC1CCCCC1)c2ccccc2 27c9fbd4683de62956fb39706fc96966 [0,1,0,1,0,0|1,0,0]=3 14167 B17R2.2342 O=C(CNC1CCCCO1)c2ccccc2 861f6f1880787d99c86791c7522f1d4c [0,1,0,1,0,0|2,0,0]=4 14168 B17R2.2342 O=C(CNC1CCCOC1)c2ccccc2 92279e4d6883019e11f5ff0b6909b732 [0,1,0,1,0,0|2,0,0]=4 14169 B17R2.2342 O=C(CNC1CCOCC1)c2ccccc2 cd62d4f9bd494c1b439d2c545d4d95ad [0,1,0,1,0,0|2,0,0]=4 14170 B17R2.2342 O=C(CNC1CCSCC1)c2ccccc2 a2b18e1b32aeaee0c985e892d499ab4a [0,1,0,1,0,0|2,0,0]=4 14171 B17R2.2342 O=C(CN[C@@H]1CCCOC1)c2ccccc2 873e7d9118316d159a1abdccc7de5824 [0,1,0,1,0,0|2,0,0]=4 14172 B17R2.2342 O=C(CN[C@H]1CCCOC1)c2ccccc2 e0b87729c34089eff710fe9612584171 [0,1,0,1,0,0|2,0,0]=4 14173 B17R2.2342 O=C(COC1C=CCCC1)c2ccccc2 f89abb21e7dc113b301aa3a651e3d243 [0,1,0,1,0,0|0,0,2]=4 14174 B17R2.2342 O=C(COC1CC=CCC1)c2ccccc2 bb1b490e1d2b34e697613c434d0a69f5 [0,1,0,1,0,0|0,0,2]=4 14175 B17R2.2342 O=C(COC1CCCCC1)c2ccccc2 35132a6f943220512204215b4b22fc56 [0,1,0,1,0,0|0,0,0]=2 14176 B17R2.2342 O=C(COC1CCCCC1)c2ccccn2 41a7f5bd508533d583e679c09387146b [0,1,0,1,0,0|1,0,0]=3 14177 B17R2.2342 O=C(COC1CCCCC1)c2cccnc2 805ed74366c1369040d5f9cecb4a3b98 [0,1,0,1,0,0|1,0,0]=3 14178 B17R2.2342 O=C(COC1CCCCC1)c2ccncn2 406ac1c155fecbe4c620f51e2ab3f9aa [0,1,0,1,0,0|2,0,0]=4 14179 B17R2.2342 O=C(COC1CCCCC1)c2cnccn2 f5c727e94381fc731fa2d29ad7bcfbf1 [0,1,0,1,0,0|2,0,0]=4 14180 B17R2.2342 O=C(COC1CCCCO1)c2ccccc2 77cb2893ab38878b1cf4747173a10211 [0,1,0,1,0,0|1,0,0]=3 14181 B17R2.2342 O=C(COC1CCCCO1)c2ccccn2 45081d595761d8f924fe92ea3c219650 [0,1,0,1,0,0|2,0,0]=4 14182 B17R2.2342 O=C(COC1CCCCO1)c2cccnc2 1e971a90bdcfd9741986eff65a9c829f [0,1,0,1,0,0|2,0,0]=4 14183 B17R2.2342 O=C(COC1CCCOC1)c2ccccc2 8700495501f78212fadb5e6c64344df3 [0,1,0,1,0,0|1,0,0]=3 14184 B17R2.2342 O=C(COC1CCCOC1)c2ccccn2 25b8eea233f1d48b4b08fbfa291917b6 [0,1,0,1,0,0|2,0,0]=4 14185 B17R2.2342 O=C(COC1CCCOC1)c2cccnc2 998963c57222780652909af241bcd854 [0,1,0,1,0,0|2,0,0]=4 14186 B17R2.2342 O=C(COC1CCCSC1)c2ccccc2 4029f030cd4f5b4dace9fd3ec4cee062 [0,1,0,1,0,0|1,0,0]=3 14187 B17R2.2342 O=C(COC1CCCSC1)c2ccccn2 7150d8d623535103a72e03da7e138c62 [0,1,0,1,0,0|2,0,0]=4 14188 B17R2.2342 O=C(COC1CCCSC1)c2cccnc2 5dedd76ac2c77037f2da1eede493f929 [0,1,0,1,0,0|2,0,0]=4 14189 B17R2.2342 O=C(COC1CCOCC1)c2ccccc2 592439f460aaac8fc7dbca7027604073 [0,1,0,1,0,0|1,0,0]=3 14190 B17R2.2342 O=C(COC1CCOCC1)c2ccccn2 6d60e0507d8c4c587a3f9dc3be0613b1 [0,1,0,1,0,0|2,0,0]=4 14191 B17R2.2342 O=C(COC1CCOCC1)c2cccnc2 cdca4b8569ce80bfe1b52bef295ec420 [0,1,0,1,0,0|2,0,0]=4 14192 B17R2.2342 O=C(COC1CCSCC1)c2ccccc2 9c49385c9d7f8925df4353274133d7a3 [0,1,0,1,0,0|1,0,0]=3 14193 B17R2.2342 O=C(COC1CCSCC1)c2ccccn2 7a45071a85010db531a2d9b38d5ba9aa [0,1,0,1,0,0|2,0,0]=4 14194 B17R2.2342 O=C(COC1CCSCC1)c2cccnc2 2bf27cc6ddcb8b78323574ab4500239f [0,1,0,1,0,0|2,0,0]=4 14195 B17R2.2342 O=C(CO[C@@H]1CCCOC1)c2ccccc2 913627986504f0ed7b63b0e27920226d [0,1,0,1,0,0|1,0,0]=3 14196 B17R2.2342 O=C(CO[C@@H]1CCCOC1)c2ccccn2 646cc47f70ec1622e461600cacdb9795 [0,1,0,1,0,0|2,0,0]=4 14197 B17R2.2342 O=C(CO[C@@H]1CCCOC1)c2cccnc2 6444b2bd032cf50502822210d22ffa86 [0,1,0,1,0,0|2,0,0]=4 14198 B17R2.2342 O=C(CO[C@H]1CCCOC1)c2ccccc2 bd211e7adfc98d10e3913d5f038d1af8 [0,1,0,1,0,0|1,0,0]=3 14199 B17R2.2342 O=C(CO[C@H]1CCCOC1)c2ccccn2 8f92e0a6fe4287c5e88e9c9d96016e57 [0,1,0,1,0,0|2,0,0]=4 14200 B17R2.2342 O=C(CO[C@H]1CCCOC1)c2cccnc2 e677d291f1b46cc31ed3f86836888e62 [0,1,0,1,0,0|2,0,0]=4 14201 B17R2.2342 O=C(NCC1=CCCCC1)c2ccccc2 aa6f79906692e3ff48f315cb80fae3f6 [0,1,0,1,0,0|1,0,1]=4 14202 B17R2.2342 O=C(NCC1CC=CCC1)c2ccccc2 d13118f170fb5f113bb57473a0f667af [0,1,0,1,0,0|1,0,1]=4 14203 B17R2.2342 O=C(NCC1CCCCC1)c2ccccc2 589d3ae0ec34579f9b3a6ee5deafbe8d [0,1,0,1,0,0|1,0,0]=3 14204 B17R2.2342 O=C(NCC1CCCCC1)c2ccccn2 5823639cd0c3a33b97fdec3e60331870 [0,1,0,1,0,0|2,0,0]=4 14205 B17R2.2342 O=C(NCC1CCCCC1)c2cccnc2 a649aa17efecc1890fafc384cf4f45c3 [0,1,0,1,0,0|2,0,0]=4 14206 B17R2.2342 O=C(NCC1CCCCC1)c2ccncc2 140c56c1e91b432ff820d04577e4e615 [0,1,0,1,0,0|2,0,0]=4 14207 B17R2.2342 O=C(NCC1CCCCO1)c2ccccc2 14723d01db7342351cef60dcc309cc66 [0,1,0,1,0,0|1,0,0]=3 14208 B17R2.2342 O=C(NCC1CCCCO1)c2ccccn2 f2190d8b39ffa42b15e3f2ff5c236e15 [0,1,0,1,0,0|2,0,0]=4 14209 B17R2.2342 O=C(NCC1CCCCO1)c2cccnc2 057129461f1668dad9357bb724f117d2 [0,1,0,1,0,0|2,0,0]=4 14210 B17R2.2342 O=C(NCC1CCCCO1)c2ccncc2 0b1a773dafdf30822ca33595a57b2a58 [0,1,0,1,0,0|2,0,0]=4 14211 B17R2.2342 O=C(NCC1CCCOC1)c2ccccc2 4dbd72871f1259aabad04c04c77df8cf [0,1,0,1,0,0|1,0,0]=3 14212 B17R2.2342 O=C(NCC1CCCOC1)c2ccccn2 5025e61ebb1a65bf97206b1864a83bf7 [0,1,0,1,0,0|2,0,0]=4 14213 B17R2.2342 O=C(NCC1CCCOC1)c2cccnc2 632bae9c51c39916b94737f9f8076f55 [0,1,0,1,0,0|2,0,0]=4 14214 B17R2.2342 O=C(NCC1CCCOC1)c2ccncc2 b5acfc583a3071fc3871ddf907f458af [0,1,0,1,0,0|2,0,0]=4 14215 B17R2.2342 O=C(NCC1CCOCC1)c2ccccc2 deb5c5f006c1893953a97fb6ecaab6dd [0,1,0,1,0,0|1,0,0]=3 14216 B17R2.2342 O=C(NCC1CCOCC1)c2ccccn2 1aba89cac676749e5bf27bd393511627 [0,1,0,1,0,0|2,0,0]=4 14217 B17R2.2342 O=C(NCC1CCOCC1)c2cccnc2 2f77e7f7037398e14b4558dee4e95299 [0,1,0,1,0,0|2,0,0]=4 14218 B17R2.2342 O=C(NCC1CCOCC1)c2ccncc2 eb53b4d4c734e3b0937457d2cb50ed7f [0,1,0,1,0,0|2,0,0]=4 14219 B17R2.2342 O=C(NCC1CCSCC1)c2ccccc2 04de42963ceb5de276bf8f40b1b9c75b [0,1,0,1,0,0|1,0,0]=3 14220 B17R2.2342 O=C(NCC1CCSCC1)c2ccccn2 7c659b17e697a1e7ffb458302df6321f [0,1,0,1,0,0|2,0,0]=4 14221 B17R2.2342 O=C(NCC1CCSCC1)c2cccnc2 df5a636a854dbc6e4154fcfe76048dcb [0,1,0,1,0,0|2,0,0]=4 14222 B17R2.2342 O=C(NCC1CCSCC1)c2ccncc2 188c9ea091f21cbaac006b674bfc626f [0,1,0,1,0,0|2,0,0]=4 14223 B17R2.2342 O=C(NCC1COCCO1)c2ccccc2 ac8edd571a86532b399ee0709f275298 [0,1,0,1,0,0|2,0,0]=4 14224 B17R2.2342 O=C(NC[C@@H]1CCCOC1)c2ccccc2 3d0de9d7ab26ef0e95d8f04885db4c19 [0,1,0,1,0,0|1,0,0]=3 14225 B17R2.2342 O=C(NC[C@@H]1CCCOC1)c2ccccn2 2865862ac01292e8aff53fb6cb754103 [0,1,0,1,0,0|2,0,0]=4 14226 B17R2.2342 O=C(NC[C@@H]1CCCOC1)c2cccnc2 eb511b7fd0c852c6ac081a6ed6d260cc [0,1,0,1,0,0|2,0,0]=4 14227 B17R2.2342 O=C(NC[C@@H]1CCCOC1)c2ccncc2 6556e8afad7cb0a14a9b4f93aee6f014 [0,1,0,1,0,0|2,0,0]=4 14228 B17R2.2342 O=C(NC[C@H]1CCCOC1)c2ccccc2 8e4804939a16dbcd5af53d1339f7ff4e [0,1,0,1,0,0|1,0,0]=3 14229 B17R2.2342 O=C(NC[C@H]1CCCOC1)c2ccccn2 d0bb13a26c2e006e5a2e259c470d2fd9 [0,1,0,1,0,0|2,0,0]=4 14230 B17R2.2342 O=C(NC[C@H]1CCCOC1)c2cccnc2 c42fd8f8bd352c9a4a1e601393bedf11 [0,1,0,1,0,0|2,0,0]=4 14231 B17R2.2342 O=C(NC[C@H]1CCCOC1)c2ccncc2 e335ce69af40bcea28974da41140ed98 [0,1,0,1,0,0|2,0,0]=4 14232 B17R2.2342 O=C(NC[C@H]1COCCO1)c2ccccc2 66710372db2f265aa1c458fada138bfc [0,1,0,1,0,0|2,0,0]=4 14233 B17R2.2342 O=C(OCN1CC=CCC1)c2ccccc2 1ba68261c80f4cec40b113d29719aced [0,1,0,1,0,0|0,0,2]=4 14234 B17R2.2342 O=C(OCN1CCCOC1)c2ccccc2 0782579c744e949083b548a00060db91 [0,1,0,1,0,0|1,0,0]=3 14235 B17R2.2342 O=C(OCN1CCCSC1)c2ccccc2 8cfd99101bfedeaf783d678681914def [0,1,0,1,0,0|1,0,0]=3 14236 B17R2.2342 O=C(OCN1CCOCC1)c2ccccc2 d66b7466abb2bd5f412915919eecfae4 [0,1,0,1,0,0|1,0,0]=3 14237 B17R2.2342 O=C(OCN1CCSCC1)c2ccccc2 bcf0231329baf4593e1831212c73c8b8 [0,1,0,1,0,0|1,0,0]=3 14238 B17R2.2342 O=S(COC1CCCCC1)c2ccccc2 a3c6e98d5424ee5b462dab63f12bc663 [0,1,0,1,0,0|1,0,0]=3 14239 B17R2.2342 O=S(COC1CCCCO1)c2ccccc2 412228698415d736144c42b279115026 [0,1,0,1,0,0|2,0,0]=4 14240 B17R2.2342 O=S(COC1CCOCC1)c2ccccc2 c3b90e8ee53dd0b849b6471610e1f604 [0,1,0,1,0,0|2,0,0]=4 14241 B17R2.2342 O=S(COC1CCSCC1)c2ccccc2 ac9a54f73e87b38180b96fbfe3374981 [0,1,0,1,0,0|2,0,0]=4 14242 B17R2.2845 C=C(CN1CCCC1CC)c2ccccc2 493e5082f18364ef83fb3747de9fc971 [0,1,0,1,0,0|2,0,0]=4 14243 B17R2.2845 C=C(CN1CCC[C@H]1CC)c2ccccc2 39a794409ede2cd4942a5ac646d240b8 [0,1,0,1,0,0|2,0,0]=4 14244 B17R2.2845 CCC1CCCN1CC(=O)c2ccccc2 b5d78f50e9ee45411565a49dfe3cce7c [0,1,0,1,0,0|1,0,0]=3 14245 B17R2.2845 CCC1CCCN1CC(=O)c2ccccn2 f0ebb04fae31b530f854644a44ae7bc4 [0,1,0,1,0,0|2,0,0]=4 14246 B17R2.2845 CCC1CCCN1CC(=O)c2cccnc2 6fb3023db91b71c3d9773d2ea305d516 [0,1,0,1,0,0|2,0,0]=4 14247 B17R2.2845 CCC1CCCN1CS(=O)c2ccccc2 1926d54ab513c4922c0c7edae758b32d [0,1,0,1,0,0|2,0,0]=4 14248 B17R2.2845 CC[C@@H]1CCCN1CC(=O)c2ccccc2 f2601b9a305dc1b533025b96a1dd0df5 [0,1,0,1,0,0|1,0,0]=3 14249 B17R2.2845 CC[C@@H]1CCCN1CC(=O)c2ccccn2 639b3a7d37eccc2a9d9c4bd5e51a32ce [0,1,0,1,0,0|2,0,0]=4 14250 B17R2.2845 CC[C@@H]1CCCN1CC(=O)c2cccnc2 f054c36ca0d15561ced79b0d5e4dd629 [0,1,0,1,0,0|2,0,0]=4 14251 B17R2.2845 CC[C@@H]1CCCN1CS(=O)c2ccccc2 d7fbb58fca34d342161415c262e346a3 [0,1,0,1,0,0|2,0,0]=4 14252 B17R2.2845 CC[C@@H]1CCC[C@H]1NC(=O)c2ccccc2 9da203f02deb9e93315b8de4743ad134 [0,1,0,1,0,0|1,0,0]=3 14253 B17R2.2845 CC[C@@H]1CCC[C@H]1NC(=O)c2ccccn2 cbc579dd0f756baa3e73e1d01d90f413 [0,1,0,1,0,0|2,0,0]=4 14254 B17R2.2845 CC[C@@H]1CCC[C@H]1NC(=O)c2cccnc2 3ba9ed391f88e89396e08694ed7d0785 [0,1,0,1,0,0|2,0,0]=4 14255 B17R2.2845 CC[C@@H]1CCC[C@H]1NC(=O)c2ccncc2 df563edbda47b22de949b9d2c5e5462d [0,1,0,1,0,0|2,0,0]=4 14256 B17R2.2845 COC1CCCC1NC(=O)c2ccccc2 4d254779b62556a9d478bb177137168f [0,1,0,1,0,0|1,0,0]=3 14257 B17R2.2845 COC1CCCC1NC(=O)c2ccccn2 dae61e6a57308e6cb24acd63d997d9b3 [0,1,0,1,0,0|2,0,0]=4 14258 B17R2.2845 COC1CCCC1NC(=O)c2cccnc2 1a4e8a57758abcff1842ee79b4dd2d54 [0,1,0,1,0,0|2,0,0]=4 14259 B17R2.2845 COC1CCCC1NC(=O)c2ccncc2 c786c17767747a91b08d8f66d3c0f1f2 [0,1,0,1,0,0|2,0,0]=4 14260 B17R2.2845 COC1CCCN1CC(=O)c2ccccc2 8c137b75c4b9bae44d6d8035b80c46aa [0,1,0,1,0,0|2,0,0]=4 14261 B17R2.2845 COC1COCC1NC(=O)c2ccccc2 76ef0e13091fff2f910543a83d1bd1f1 [0,1,0,1,0,0|2,0,0]=4 14262 B17R2.2845 CO[C@@H]1CCC[C@@H]1NC(=O)c2ccccc2 e6fdc7c5ea9019acc11029cece7dfe10 [0,1,0,1,0,0|1,0,0]=3 14263 B17R2.2845 CO[C@@H]1CCC[C@@H]1NC(=O)c2ccccn2 978294ea95743f80cc278030d54873e8 [0,1,0,1,0,0|2,0,0]=4 14264 B17R2.2845 CO[C@@H]1CCC[C@@H]1NC(=O)c2cccnc2 c164d9bbe3a64bab1fcd86fa9a45a759 [0,1,0,1,0,0|2,0,0]=4 14265 B17R2.2845 CO[C@@H]1CCC[C@@H]1NC(=O)c2ccncc2 1ddfe82258399a763e68f1c2b3d5aa1f [0,1,0,1,0,0|2,0,0]=4 14266 B17R2.2845 CO[C@@H]1CCC[C@H]1NC(=O)c2ccccc2 9760413a7e87739f4c50e5cef49599c0 [0,1,0,1,0,0|1,0,0]=3 14267 B17R2.2845 CO[C@@H]1CCC[C@H]1NC(=O)c2ccccn2 16ebe8132c5a1c46d38de3a6f38e60f2 [0,1,0,1,0,0|2,0,0]=4 14268 B17R2.2845 CO[C@@H]1CCC[C@H]1NC(=O)c2cccnc2 80e3295680937c1a2943b74e82d79038 [0,1,0,1,0,0|2,0,0]=4 14269 B17R2.2845 CO[C@@H]1CCC[C@H]1NC(=O)c2ccncc2 b217cc05470456264cb105bccc69858f [0,1,0,1,0,0|2,0,0]=4 14270 B17R2.2845 CO[C@@H]1COC[C@@H]1NC(=O)c2ccccc2 c9e0ec63c6b4aa402bf0488f0d0f5424 [0,1,0,1,0,0|2,0,0]=4 14271 B17R2.2845 CO[C@@H]1COC[C@H]1NC(=O)c2ccccc2 fdcb96820c8212ce7ed56be8b0a62169 [0,1,0,1,0,0|2,0,0]=4 14272 B17R2.2845 CO[C@H]1CCC[C@@H]1NC(=O)c2ccccc2 ccd8be91dac41d8ff480d271ae5ec42f [0,1,0,1,0,0|1,0,0]=3 14273 B17R2.2845 CO[C@H]1CCC[C@@H]1NC(=O)c2ccccn2 d935453856fe6d469c0cbd95a2e658df [0,1,0,1,0,0|2,0,0]=4 14274 B17R2.2845 CO[C@H]1CCC[C@@H]1NC(=O)c2cccnc2 57549a902009bfada1424838a6599976 [0,1,0,1,0,0|2,0,0]=4 14275 B17R2.2845 CO[C@H]1CCC[C@@H]1NC(=O)c2ccncc2 a61d2ce9f2ee40974f9c0e0f125072c7 [0,1,0,1,0,0|2,0,0]=4 14276 B17R2.2845 CO[C@H]1COC[C@@H]1NC(=O)c2ccccc2 0eb69b1a76915e65d97c682bf9cebd74 [0,1,0,1,0,0|2,0,0]=4 14277 B17R2.2845 CO[C@H]1COC[C@H]1NC(=O)c2ccccc2 cbc9038cf015e6ac8a8e592cf42ec574 [0,1,0,1,0,0|2,0,0]=4 14278 B17R2.2845 N#C[C@@H]1CCC[C@@H]1NC(=O)c2ccccc2 0a10f1f5ab1ae6933637606e665f82bc [0,1,0,1,0,0|1,0,1]=4 14279 B17R2.2845 O=C(CN1CCCC1CO)c2ccccc2 77a98bbcafad08ebf76402743ee6ab65 [0,1,0,1,0,0|2,0,0]=4 14280 B17R2.2845 O=C(CN1CCC[C@@H]1CF)c2ccccc2 96b6a2688dc07fa88c33761801b1d37c [0,1,0,1,0,0|2,0,0]=4 14281 B17R2.2845 O=C(CN1CCC[C@@H]1CO)c2ccccc2 efd8efb5b705093c91437be1229c0404 [0,1,0,1,0,0|2,0,0]=4 14282 B17R2.2845 O=C(CN1CCC[C@H]1CF)c2ccccc2 5a2644c8edb32095fc70bedb5a8b481c [0,1,0,1,0,0|2,0,0]=4 14283 B17R2.2845 O=C(CN1CCC[C@H]1CO)c2ccccc2 f0dde6bf4e5f72c8a57efdcb4457581b [0,1,0,1,0,0|2,0,0]=4 14284 B17R2.2845 O=C(NC1COCC1CO)c2ccccc2 bb7fda41a30d310df5c9336425c7458b [0,1,0,1,0,0|2,0,0]=4 14285 B17R2.2845 O=C(N[C@@H]1COC[C@H]1CO)c2ccccc2 e44e8cda7125dd3751479332bd90dd65 [0,1,0,1,0,0|2,0,0]=4 14286 B17R2.2845 O=C(N[C@H]1CCC[C@H]1CO)c2ccccc2 2d40ec43c2e6178a2130f0928db156d7 [0,1,0,1,0,0|1,0,0]=3 14287 B17R2.2845 O=C(N[C@H]1CCC[C@H]1CO)c2ccccn2 e18de2106b6e5e33a72d149a778b4f55 [0,1,0,1,0,0|2,0,0]=4 14288 B17R2.2845 O=C(N[C@H]1CCC[C@H]1CO)c2cccnc2 03d29491baaa36fe4417fa036c1c68cf [0,1,0,1,0,0|2,0,0]=4 14289 B17R2.2845 O=C(N[C@H]1CCC[C@H]1CO)c2ccncc2 e06f93b9e02c955b7bc4383b3349dd76 [0,1,0,1,0,0|2,0,0]=4 14290 B17R2.2845 O=C(N[C@H]1CSC[C@@H]1CO)c2ccccc2 6674119eb478f38baf961a34c9ae03e1 [0,1,0,1,0,0|2,0,0]=4 14291 B17R2.3426 CC(OC1CCCCC1F)c2ccccc2 8c8e272f6828ca970328d03de9adb418 [0,1,0,1,0,0|1,0,1]=4 14292 B17R2.3426 CC(O[C@H]1CCCC[C@H]1C)c2ccccc2 c9067b7e9c16a31b1e0d544e1ab3d9b7 [0,1,0,1,0,0|1,0,1]=4 14293 B17R2.3426 CC1CCCCC1NC(=O)c2ccccc2 80055ad29690086c09b992e85df38c7c [0,1,0,1,0,0|1,0,0]=3 14294 B17R2.3426 CC1CCCCC1NC(=O)c2ccccn2 e4014d2e816314834f134e1cfc41fda2 [0,1,0,1,0,0|2,0,0]=4 14295 B17R2.3426 CC1CCCCC1NC(=O)c2cccnc2 eaaee83f22014e234b08de02c412706c [0,1,0,1,0,0|2,0,0]=4 14296 B17R2.3426 CC1CCCCC1NC(=O)c2ccncc2 909fa675ac449b97ddd5c7b257873598 [0,1,0,1,0,0|2,0,0]=4 14297 B17R2.3426 CC1CCCCN1CC(=O)c2ccccc2 633835595a1d5c554b878ec233565247 [0,1,0,1,0,0|1,0,0]=3 14298 B17R2.3426 CC1CCCCN1CC(=O)c2ccccn2 3bfddae1a6e8f5cd3cf1a77f87d5a875 [0,1,0,1,0,0|2,0,0]=4 14299 B17R2.3426 CC1CCCCN1CC(=O)c2cccnc2 47ebbaf0ec5f31b169a1d8210992184a [0,1,0,1,0,0|2,0,0]=4 14300 B17R2.3426 CC1COCCC1NC(=O)c2ccccc2 6bc77f1dc13044c1f2872e7a94d49f5f [0,1,0,1,0,0|1,0,0]=3 14301 B17R2.3426 CC1COCCC1NC(=O)c2ccccn2 9837a133359344c85be61654892cc587 [0,1,0,1,0,0|2,0,0]=4 14302 B17R2.3426 CC1COCCC1NC(=O)c2cccnc2 01dda4edec46afc4b81709d0807a14ba [0,1,0,1,0,0|2,0,0]=4 14303 B17R2.3426 CC1COCCC1NC(=O)c2ccncc2 de354a40c712e4a042af5bbfe1c6d959 [0,1,0,1,0,0|2,0,0]=4 14304 B17R2.3426 CC1COCCN1CC(=O)c2ccccc2 5d615e2079159791bb1b3211c4fffbf9 [0,1,0,1,0,0|2,0,0]=4 14305 B17R2.3426 C[C@@H](OC1CCCCC1F)c2ccccc2 5fb5932de0247c902471235fb1d24ed2 [0,1,0,1,0,0|1,0,1]=4 14306 B17R2.3426 C[C@@H]1CCCCN1CC(=O)c2ccccc2 be5e6959e3b222e0d662b40f7cd943e2 [0,1,0,1,0,0|1,0,0]=3 14307 B17R2.3426 C[C@@H]1CCCCN1CC(=O)c2ccccn2 c27b31273e371d957b00c78789b34012 [0,1,0,1,0,0|2,0,0]=4 14308 B17R2.3426 C[C@@H]1CCCCN1CC(=O)c2cccnc2 a08707cc2db8327c8d54bc296759a40c [0,1,0,1,0,0|2,0,0]=4 14309 B17R2.3426 C[C@@H]1CCCC[C@@H]1NC(=O)c2ccccc2 5e4298dd03483a0a0e7d83ef1f5043aa [0,1,0,1,0,0|1,0,0]=3 14310 B17R2.3426 C[C@@H]1CCCC[C@@H]1NC(=O)c2ccccn2 b5f887543f927347ac0e43ec90748306 [0,1,0,1,0,0|2,0,0]=4 14311 B17R2.3426 C[C@@H]1CCCC[C@@H]1NC(=O)c2cccnc2 66025721f2da3e57d8281b34a1ea0102 [0,1,0,1,0,0|2,0,0]=4 14312 B17R2.3426 C[C@@H]1CCCC[C@@H]1NC(=O)c2ccncc2 b76c1a4a7ae7ae56808acb2466eb36ed [0,1,0,1,0,0|2,0,0]=4 14313 B17R2.3426 C[C@@H]1CCCC[C@@H]1O[C@H](C)c2ccccc2 4d05529c6a066dfe88d1cfa1832f608b [0,1,0,1,0,0|1,0,1]=4 14314 B17R2.3426 C[C@@H]1CCCC[C@H]1NC(=O)c2ccccc2 96f51691affb8f37252cca93162bf8b0 [0,1,0,1,0,0|1,0,0]=3 14315 B17R2.3426 C[C@@H]1CCCC[C@H]1NC(=O)c2ccccn2 18a78089e5a202910b6ffc59d2e2301b [0,1,0,1,0,0|2,0,0]=4 14316 B17R2.3426 C[C@@H]1CCCC[C@H]1NC(=O)c2cccnc2 bf9f6a2168a7880055b1c51b03f80450 [0,1,0,1,0,0|2,0,0]=4 14317 B17R2.3426 C[C@@H]1CCCC[C@H]1NC(=O)c2ccncc2 794bec6d3cd136c009ee5893d3573b9c [0,1,0,1,0,0|2,0,0]=4 14318 B17R2.3426 C[C@@H]1COCCN1CC(=O)c2ccccc2 ec5df794c08c56fc2a5e6991363f771a [0,1,0,1,0,0|2,0,0]=4 14319 B17R2.3426 C[C@@H]1COCC[C@@H]1NC(=O)c2ccccc2 93fc00a9ae3d2eaa0e2182056f369cb4 [0,1,0,1,0,0|1,0,0]=3 14320 B17R2.3426 C[C@@H]1COCC[C@@H]1NC(=O)c2ccccn2 b862af1039204d8ff4a747c68434ede4 [0,1,0,1,0,0|2,0,0]=4 14321 B17R2.3426 C[C@@H]1COCC[C@@H]1NC(=O)c2cccnc2 1c8d0be2807b0856a600748553caa9b3 [0,1,0,1,0,0|2,0,0]=4 14322 B17R2.3426 C[C@@H]1COCC[C@@H]1NC(=O)c2ccncc2 b66b0432c9c0747edbd78ecc0d9f7fb1 [0,1,0,1,0,0|2,0,0]=4 14323 B17R2.3426 C[C@H](OC1CCCCC1F)c2ccccc2 4fea2e1a5a2bf6f6fff97072bc476259 [0,1,0,1,0,0|1,0,1]=4 14324 B17R2.3426 C[C@H](O[C@H]1CCCC[C@H]1C)c2ccccc2 d2e52b69edc580a332ff05f3c637bca9 [0,1,0,1,0,0|1,0,1]=4 14325 B17R2.3426 C[C@H]1CCCCN1CC(=O)c2ccccc2 d4f119df30963a9bd1060cfa327fd88e [0,1,0,1,0,0|1,0,0]=3 14326 B17R2.3426 C[C@H]1CCCCN1CC(=O)c2ccccn2 8eb921b451e89f25a8eb5ec3a1f8bdca [0,1,0,1,0,0|2,0,0]=4 14327 B17R2.3426 C[C@H]1CCCCN1CC(=O)c2cccnc2 68e4ee679657d11575dbb7d910db3a36 [0,1,0,1,0,0|2,0,0]=4 14328 B17R2.3426 C[C@H]1CCCC[C@@H]1NC(=O)c2ccccc2 a7184d9b63ac637034f8799e14aa857a [0,1,0,1,0,0|1,0,0]=3 14329 B17R2.3426 C[C@H]1CCCC[C@@H]1NC(=O)c2ccccn2 62bde3da21c73ac1aaf6236d1eb90525 [0,1,0,1,0,0|2,0,0]=4 14330 B17R2.3426 C[C@H]1CCCC[C@@H]1NC(=O)c2cccnc2 66696aceb6f7564ab2a1c5bc06cc8ad9 [0,1,0,1,0,0|2,0,0]=4 14331 B17R2.3426 C[C@H]1CCCC[C@@H]1NC(=O)c2ccncc2 a0c0013c60549850bc68441e81b1b2b9 [0,1,0,1,0,0|2,0,0]=4 14332 B17R2.3426 C[C@H]1CCCC[C@H]1NC(=O)c2ccccc2 6211fbd6777860167c3bca9e183be3ce [0,1,0,1,0,0|1,0,0]=3 14333 B17R2.3426 C[C@H]1CCCC[C@H]1NC(=O)c2ccccn2 1709d6c7f8228d0cbec7af6cc56d4d60 [0,1,0,1,0,0|2,0,0]=4 14334 B17R2.3426 C[C@H]1CCCC[C@H]1NC(=O)c2cccnc2 e660c22a3dbb8b35c86af85891daf3da [0,1,0,1,0,0|2,0,0]=4 14335 B17R2.3426 C[C@H]1CCCC[C@H]1NC(=O)c2ccncc2 e6020f3b89e0b782489bb29a2ffc74a8 [0,1,0,1,0,0|2,0,0]=4 14336 B17R2.3426 C[C@H]1COCCN1CC(=O)c2ccccc2 8784fae8f8ff9292fa7bba234d96ef6e [0,1,0,1,0,0|2,0,0]=4 14337 B17R2.3426 C[C@H]1COCC[C@H]1NC(=O)c2ccccc2 a1efea0d0e13415359c5cf65490b9b3b [0,1,0,1,0,0|1,0,0]=3 14338 B17R2.3426 C[C@H]1COCC[C@H]1NC(=O)c2ccccn2 ff3e01556145c04a871293338e17a0d9 [0,1,0,1,0,0|2,0,0]=4 14339 B17R2.3426 C[C@H]1COCC[C@H]1NC(=O)c2cccnc2 201d601574e8932d3ff2400d4e8c2af8 [0,1,0,1,0,0|2,0,0]=4 14340 B17R2.3426 C[C@H]1COCC[C@H]1NC(=O)c2ccncc2 437294afeb2488ceed2a7ffb368afc52 [0,1,0,1,0,0|2,0,0]=4 14341 B17R2.3426 O=C(NC1CCCCC1O)c2ccccc2 f3eb470739a958aa203ededdf83acc30 [0,1,0,1,0,0|1,0,0]=3 14342 B17R2.3426 O=C(NC1CCCCC1O)c2ccccn2 59a708b0b08e7b7c7e5f02a9de900b8a [0,1,0,1,0,0|2,0,0]=4 14343 B17R2.3426 O=C(NC1CCCCC1O)c2cccnc2 bfd87c99fd724251b1a54dc2b6c8ddc3 [0,1,0,1,0,0|2,0,0]=4 14344 B17R2.3426 O=C(NC1CCCCC1O)c2ccncc2 66182a9902df4ff0bac366123e72d3a3 [0,1,0,1,0,0|2,0,0]=4 14345 B17R2.3426 O=C(NC1CCOCC1O)c2ccccc2 853124e65726536562fa90c23bc29135 [0,1,0,1,0,0|2,0,0]=4 14346 B17R2.3426 O=C(N[C@@H]1CCCC[C@H]1O)c2ccccc2 f0e6944dca5f306126614c4e80fccc04 [0,1,0,1,0,0|1,0,0]=3 14347 B17R2.3426 O=C(N[C@@H]1CCCC[C@H]1O)c2ccccn2 749457d88b71513df28b54874df34d33 [0,1,0,1,0,0|2,0,0]=4 14348 B17R2.3426 O=C(N[C@@H]1CCCC[C@H]1O)c2cccnc2 558081ae04d6d53a587f947aa658cec7 [0,1,0,1,0,0|2,0,0]=4 14349 B17R2.3426 O=C(N[C@@H]1CCCC[C@H]1O)c2ccncc2 d2797497fe44c06ced51b884297cdb9e [0,1,0,1,0,0|2,0,0]=4 14350 B17R2.3426 O=C(N[C@@H]1CCOC[C@@H]1O)c2ccccc2 d6ff0b878c4be8f1525795b414111a51 [0,1,0,1,0,0|2,0,0]=4 14351 B17R2.3426 O=C(N[C@@H]1CCOC[C@H]1F)c2ccccc2 29a9c9b1fb9e121190e3183cde3521cd [0,1,0,1,0,0|2,0,0]=4 14352 B17R2.3426 O=C(N[C@@H]1CCOC[C@H]1O)c2ccccc2 a25176949622bb01796d8dd7d1aeefe9 [0,1,0,1,0,0|2,0,0]=4 14353 B17R2.3426 O=C(N[C@@H]1COCC[C@@H]1O)c2ccccc2 ff6b88630861e3292416e613d07cdf1c [0,1,0,1,0,0|2,0,0]=4 14354 B17R2.3426 O=C(N[C@@H]1COCC[C@H]1O)c2ccccc2 04973d05cc5fb63da16a3ea8451c4c29 [0,1,0,1,0,0|2,0,0]=4 14355 B17R2.3426 O=C(N[C@H]1CCCC[C@@H]1O)c2ccccc2 b1db7a5126ce2533d83c47dee908ff03 [0,1,0,1,0,0|1,0,0]=3 14356 B17R2.3426 O=C(N[C@H]1CCCC[C@@H]1O)c2ccccn2 bdb674f2c2e3880bfcd04a49289637ec [0,1,0,1,0,0|2,0,0]=4 14357 B17R2.3426 O=C(N[C@H]1CCCC[C@@H]1O)c2cccnc2 bfb234777fef94b6fb300b29d0990503 [0,1,0,1,0,0|2,0,0]=4 14358 B17R2.3426 O=C(N[C@H]1CCCC[C@@H]1O)c2ccncc2 e67c43627db567e894585da0b22420aa [0,1,0,1,0,0|2,0,0]=4 14359 B17R2.3426 O=C(N[C@H]1CCCC[C@H]1O)c2ccccc2 f8c2fbaa79bc4cf2f12d56e3a3c406ea [0,1,0,1,0,0|1,0,0]=3 14360 B17R2.3426 O=C(N[C@H]1CCCC[C@H]1O)c2ccccn2 86f5021ba92e8c696f002a8da405559e [0,1,0,1,0,0|2,0,0]=4 14361 B17R2.3426 O=C(N[C@H]1CCCC[C@H]1O)c2cccnc2 ebce6a735d899164861d3635e7f9518b [0,1,0,1,0,0|2,0,0]=4 14362 B17R2.3426 O=C(N[C@H]1CCCC[C@H]1O)c2ccncc2 66f9aa68b98911f130a7f957580c2a4b [0,1,0,1,0,0|2,0,0]=4 14363 B17R2.3426 O=C(N[C@H]1CCOC[C@@H]1F)c2ccccc2 9edb775e54778207eed071164848e25f [0,1,0,1,0,0|2,0,0]=4 14364 B17R2.3426 O=C(N[C@H]1CCOC[C@@H]1O)c2ccccc2 1131a87ca52f5f385754fc510e045592 [0,1,0,1,0,0|2,0,0]=4 14365 B17R2.3426 O=C(N[C@H]1CCOC[C@H]1O)c2ccccc2 c299116640d05041cb4e4642c5e05e8f [0,1,0,1,0,0|2,0,0]=4 14366 B17R2.3426 O=C(N[C@H]1COCC[C@@H]1O)c2ccccc2 d0772ac54cee3f03ca525c8370d4155f [0,1,0,1,0,0|2,0,0]=4 14367 B17R2.3426 O=C(N[C@H]1COCC[C@H]1O)c2ccccc2 696e9d7405c4ba5b46ed06548ab33805 [0,1,0,1,0,0|2,0,0]=4 14368 B17R2.3519 C=C(COC1CCCC1C)c2ccccc2 ed25fa8f76e65860ed4fd406eb2156ea [0,1,0,1,0,0|1,0,0]=3 14369 B17R2.3519 C=C(COC1COCC1C)c2ccccc2 d22542f0d0145dd4fefcf0a63c789dd6 [0,1,0,1,0,0|2,0,0]=4 14370 B17R2.3519 C=C(CO[C@@H]1CCC[C@@H]1C)c2ccccc2 3fa96bef97db63b5874c2a33fb066b98 [0,1,0,1,0,0|1,0,0]=3 14371 B17R2.3519 C=C(CO[C@@H]1CCC[C@H]1C)c2ccccc2 fae937da2668e40a66b1ff592da963ff [0,1,0,1,0,0|1,0,0]=3 14372 B17R2.3519 C=C(CO[C@@H]1CCC[C@H]1F)c2ccccc2 319ee9d4e8aba62102b7eb0efed9d5d5 [0,1,0,1,0,0|2,0,0]=4 14373 B17R2.3519 C=C(CO[C@@H]1COC[C@@H]1C)c2ccccc2 e5e932293e59924c8c18694ed429e981 [0,1,0,1,0,0|2,0,0]=4 14374 B17R2.3519 C=C(CO[C@H]1CCC[C@@H]1C)c2ccccc2 34173cb23cb4c7d70e49390cb58dabe9 [0,1,0,1,0,0|1,0,0]=3 14375 B17R2.3519 C=C(CO[C@H]1CCC[C@H]1C)c2ccccc2 42ca2a587986aa4ddc2257d38b0fd9e7 [0,1,0,1,0,0|1,0,0]=3 14376 B17R2.3519 C=C(CO[C@H]1COC[C@@H]1C)c2ccccc2 26a69914610ce96938d19f7a8d3410d2 [0,1,0,1,0,0|2,0,0]=4 14377 B17R2.3519 C=C(CO[C@H]1COC[C@H]1C)c2ccccc2 842d6b1b230c45e626f81ddd1da55477 [0,1,0,1,0,0|2,0,0]=4 14378 B17R2.3519 CC(COC1CCCC1C)c2ccccc2 19ec624d9df7de0fae66690b43028f39 [0,1,0,1,0,0|1,0,1]=4 14379 B17R2.3519 CC(CO[C@@H]1CCC[C@@H]1C)c2ccccc2 b32d9e2e581f062b91b305e12138ca50 [0,1,0,1,0,0|1,0,1]=4 14380 B17R2.3519 CC(CO[C@@H]1CCC[C@H]1C)c2ccccc2 04f1db8de2e55262ea6e4ca80ca65adf [0,1,0,1,0,0|1,0,1]=4 14381 B17R2.3519 CC(CO[C@H]1CCC[C@@H]1C)c2ccccc2 63fc26fc4ba8b49dfa1914129a68ffcc [0,1,0,1,0,0|1,0,1]=4 14382 B17R2.3519 CC(CO[C@H]1CCC[C@H]1C)c2ccccc2 1868719635fd1ebcf972f7f9f4170388 [0,1,0,1,0,0|1,0,1]=4 14383 B17R2.3519 CC(OCC1COCC1C)c2ccccc2 1109314c6a8a38dd5e2770c9c9d6fd12 [0,1,0,1,0,0|1,0,1]=4 14384 B17R2.3519 CC1CCCC1OCC(=O)c2ccccc2 194876553d8a74ab8727746fc4550f61 [0,1,0,1,0,0|0,0,0]=2 14385 B17R2.3519 CC1CCCC1OCC(=O)c2ccccn2 13002b1594ee3c8883a61de702c9c9c3 [0,1,0,1,0,0|1,0,0]=3 14386 B17R2.3519 CC1CCCC1OCC(=O)c2cccnc2 3abe5c8594723d313c0c5865e8184f43 [0,1,0,1,0,0|1,0,0]=3 14387 B17R2.3519 CC1CCCC1OCC(=O)c2ccncn2 f4cd2b6ddbc18c9b2f223501b74dbdb0 [0,1,0,1,0,0|2,0,0]=4 14388 B17R2.3519 CC1CCCC1OCC(=O)c2cnccn2 51b39816eda2d76b0c30b66755fada62 [0,1,0,1,0,0|2,0,0]=4 14389 B17R2.3519 CC1CCCC1OCC(F)c2ccccc2 ffe0feee091c5dcd78f41747860a1ad3 [0,1,0,1,0,0|1,0,1]=4 14390 B17R2.3519 CC1CCCC1OCS(=O)c2ccccc2 14cf169ed73e88e61098653f48ace83a [0,1,0,1,0,0|1,0,0]=3 14391 B17R2.3519 CC1CCCC1OC[C@@H](C)c2ccccc2 5205bbb2087c3e10844a88e3fe223c9a [0,1,0,1,0,0|1,0,1]=4 14392 B17R2.3519 CC1CCCN1COC(=O)c2ccccc2 2652b091ae4061bc97e3e79e5ff765f1 [0,1,0,1,0,0|0,0,0]=2 14393 B17R2.3519 CC1COCC1CO[C@@H](C)c2ccccc2 59375372cbb24b5e5959c328d8cf6351 [0,1,0,1,0,0|1,0,1]=4 14394 B17R2.3519 CC1COCC1CO[C@H](C)c2ccccc2 2131c7df8bf2bd05e55fb3e75765fa07 [0,1,0,1,0,0|1,0,1]=4 14395 B17R2.3519 CC1COCC1OCC(=O)c2ccccc2 02e603ad526709854fc1e1bce38b3e09 [0,1,0,1,0,0|1,0,0]=3 14396 B17R2.3519 CC1COCC1OCC(=O)c2ccccn2 b960b98b398c0a7a155d00cd862f636a [0,1,0,1,0,0|2,0,0]=4 14397 B17R2.3519 CC1COCC1OCC(=O)c2cccnc2 0515962110b213b979b3f5985ca96dd3 [0,1,0,1,0,0|2,0,0]=4 14398 B17R2.3519 CC1COCC1OCS(=O)c2ccccc2 591623e688a179c89755e9312b981aaa [0,1,0,1,0,0|2,0,0]=4 14399 B17R2.3519 CC1SCCN1COC(=O)c2ccccc2 bf7496f796ffeb780e1e2e5a414fd274 [0,1,0,1,0,0|1,0,0]=3 14400 B17R2.3519 CN1CCCC1CNC(=O)c2ccccc2 15cbbf7c95465bc01595e81d8683b7a3 [0,1,0,1,0,0|1,0,0]=3 14401 B17R2.3519 CN1CCCC1CNC(=O)c2ccccn2 dd64abf5d5a7522ddf6974657f699a7f [0,1,0,1,0,0|2,0,0]=4 14402 B17R2.3519 CN1CCCC1CNC(=O)c2cccnc2 7abd8eec08380c7ea86e6cb5ee1a5d9d [0,1,0,1,0,0|2,0,0]=4 14403 B17R2.3519 CN1CCCC1CNC(=O)c2ccncc2 1c594a15a4b6838b3fe9878b78cebcef [0,1,0,1,0,0|2,0,0]=4 14404 B17R2.3519 CN1CCC[C@@H]1CNC(=O)c2ccccc2 42e0c626f4c450495a23ed263caa3704 [0,1,0,1,0,0|1,0,0]=3 14405 B17R2.3519 CN1CCC[C@@H]1CNC(=O)c2ccccn2 c1216407a4c2baa545345b3caea6a0a3 [0,1,0,1,0,0|2,0,0]=4 14406 B17R2.3519 CN1CCC[C@@H]1CNC(=O)c2cccnc2 3f5a1c550ed322ca08b4c697157e6ff2 [0,1,0,1,0,0|2,0,0]=4 14407 B17R2.3519 CN1CCC[C@@H]1CNC(=O)c2ccncc2 333f839d10392571d200c4957a3d935d [0,1,0,1,0,0|2,0,0]=4 14408 B17R2.3519 CN1CCC[C@H]1CNC(=O)c2ccccc2 07958055360752bc5315032bdce01801 [0,1,0,1,0,0|1,0,0]=3 14409 B17R2.3519 CN1CCC[C@H]1CNC(=O)c2ccccn2 744a801a417641e14dfa5fcf38202b1e [0,1,0,1,0,0|2,0,0]=4 14410 B17R2.3519 CN1CCC[C@H]1CNC(=O)c2cccnc2 a4923cf9861b09d954b0c60a960ebf1a [0,1,0,1,0,0|2,0,0]=4 14411 B17R2.3519 CN1CCC[C@H]1CNC(=O)c2ccncc2 bc1a98b8bebc1c18a28757e8040eddbe [0,1,0,1,0,0|2,0,0]=4 14412 B17R2.3519 C[C@@H]1CCCN1COC(=O)c2ccccc2 cb72a144d73fbcf83e86243b2af197aa [0,1,0,1,0,0|0,0,0]=2 14413 B17R2.3519 C[C@@H]1CCC[C@@H]1OCC(=O)c2ccccc2 c413b462841fb297a6383c99aba4e6fb [0,1,0,1,0,0|0,0,0]=2 14414 B17R2.3519 C[C@@H]1CCC[C@@H]1OCC(=O)c2ccccn2 f070b893869508db00a2609cf5ed5152 [0,1,0,1,0,0|1,0,0]=3 14415 B17R2.3519 C[C@@H]1CCC[C@@H]1OCC(=O)c2cccnc2 838ea8ee5287e7a64fb7d522b7becd50 [0,1,0,1,0,0|1,0,0]=3 14416 B17R2.3519 C[C@@H]1CCC[C@@H]1OCC(=O)c2ccncn2 2dcff855cf26d4c571def031d2069ca6 [0,1,0,1,0,0|2,0,0]=4 14417 B17R2.3519 C[C@@H]1CCC[C@@H]1OCC(=O)c2cnccn2 210760de2f326a2281090213d22e7e32 [0,1,0,1,0,0|2,0,0]=4 14418 B17R2.3519 C[C@@H]1CCC[C@@H]1OCC(F)c2ccccc2 eecb0e5a4204a3594ab4b1e544190aa3 [0,1,0,1,0,0|1,0,1]=4 14419 B17R2.3519 C[C@@H]1CCC[C@@H]1OCS(=O)c2ccccc2 2c00cee298d2e510b48c33b5ea222459 [0,1,0,1,0,0|1,0,0]=3 14420 B17R2.3519 C[C@@H]1CCC[C@H]1OCC(=O)c2ccccc2 11ad40b3726881e576252efadb8df9a3 [0,1,0,1,0,0|0,0,0]=2 14421 B17R2.3519 C[C@@H]1CCC[C@H]1OCC(=O)c2ccccn2 6bf4f84573c845510b7609660928a72c [0,1,0,1,0,0|1,0,0]=3 14422 B17R2.3519 C[C@@H]1CCC[C@H]1OCC(=O)c2cccnc2 2f7d0c5705b4610b8d240d576b097ff1 [0,1,0,1,0,0|1,0,0]=3 14423 B17R2.3519 C[C@@H]1CCC[C@H]1OCC(=O)c2ccncn2 45619974dcfd91a56a5411fa8dff01f2 [0,1,0,1,0,0|2,0,0]=4 14424 B17R2.3519 C[C@@H]1CCC[C@H]1OCC(=O)c2cnccn2 270a329790eae22d23bb2a1c16fb0223 [0,1,0,1,0,0|2,0,0]=4 14425 B17R2.3519 C[C@@H]1CCC[C@H]1OCC(F)c2ccccc2 078c4ee2fc73dca2c14886c7db485919 [0,1,0,1,0,0|1,0,1]=4 14426 B17R2.3519 C[C@@H]1CCC[C@H]1OCS(=O)c2ccccc2 f1ae79ab02d886721c73eeab65d4a247 [0,1,0,1,0,0|1,0,0]=3 14427 B17R2.3519 C[C@@H]1COC[C@@H]1OCC(=O)c2ccccc2 4279caf9687bab6cd93a9cf607eb49fb [0,1,0,1,0,0|1,0,0]=3 14428 B17R2.3519 C[C@@H]1COC[C@@H]1OCC(=O)c2ccccn2 8b742ca15679b8fdb01ea9e99c2c1f2e [0,1,0,1,0,0|2,0,0]=4 14429 B17R2.3519 C[C@@H]1COC[C@@H]1OCC(=O)c2cccnc2 5ea881c3507a13b8d8511d7a8032b7e2 [0,1,0,1,0,0|2,0,0]=4 14430 B17R2.3519 C[C@@H]1COC[C@@H]1OCS(=O)c2ccccc2 02d0aa7f804f071576c1f86686b813dd [0,1,0,1,0,0|2,0,0]=4 14431 B17R2.3519 C[C@H](CO[C@@H]1CCC[C@@H]1C)c2ccccc2 f65e6274aeae2ed4387eedf8b689953e [0,1,0,1,0,0|1,0,1]=4 14432 B17R2.3519 C[C@H](CO[C@@H]1CCC[C@H]1C)c2ccccc2 84be8ed2da85508b62e8e0c3086ebdad [0,1,0,1,0,0|1,0,1]=4 14433 B17R2.3519 C[C@H](CO[C@H]1CCC[C@@H]1C)c2ccccc2 e70cc8d6878ccf912782202aab135f73 [0,1,0,1,0,0|1,0,1]=4 14434 B17R2.3519 C[C@H](CO[C@H]1CCC[C@H]1C)c2ccccc2 0e251fea4610112fa41606a21ed86d4c [0,1,0,1,0,0|1,0,1]=4 14435 B17R2.3519 C[C@H]1CCCN1COC(=O)c2ccccc2 bfa0da9117b94b06867143f4c858a106 [0,1,0,1,0,0|0,0,0]=2 14436 B17R2.3519 C[C@H]1CCC[C@@H]1OCC(=O)c2ccccc2 b85b8eaad5f089f8b06eef3466de6709 [0,1,0,1,0,0|0,0,0]=2 14437 B17R2.3519 C[C@H]1CCC[C@@H]1OCC(=O)c2ccccn2 ff07ebdbe55b0f85c387704ae130edb2 [0,1,0,1,0,0|1,0,0]=3 14438 B17R2.3519 C[C@H]1CCC[C@@H]1OCC(=O)c2cccnc2 4d03af5b2da3fb97b9de97a1404446cf [0,1,0,1,0,0|1,0,0]=3 14439 B17R2.3519 C[C@H]1CCC[C@@H]1OCC(=O)c2ccncn2 63f79c9cf6a368518b2ab9bbc60fff58 [0,1,0,1,0,0|2,0,0]=4 14440 B17R2.3519 C[C@H]1CCC[C@@H]1OCC(=O)c2cnccn2 63a01d71a5cf6178f1e819fed7530e25 [0,1,0,1,0,0|2,0,0]=4 14441 B17R2.3519 C[C@H]1CCC[C@@H]1OCC(F)c2ccccc2 d3bdf7a6dd9521596f1383747b6de022 [0,1,0,1,0,0|1,0,1]=4 14442 B17R2.3519 C[C@H]1CCC[C@@H]1OCS(=O)c2ccccc2 88963c91ccbea1426fb0245f2c8ab920 [0,1,0,1,0,0|1,0,0]=3 14443 B17R2.3519 C[C@H]1CCC[C@H]1OCC(=O)c2ccccc2 12a2f64bc155a48cc93608d6b13b675c [0,1,0,1,0,0|0,0,0]=2 14444 B17R2.3519 C[C@H]1CCC[C@H]1OCC(=O)c2ccccn2 7037265908b0f6bc77279a0c07deb639 [0,1,0,1,0,0|1,0,0]=3 14445 B17R2.3519 C[C@H]1CCC[C@H]1OCC(=O)c2cccnc2 a4bddcc7ad58c700cb0b89bb4097b8f0 [0,1,0,1,0,0|1,0,0]=3 14446 B17R2.3519 C[C@H]1CCC[C@H]1OCC(=O)c2ccncn2 76d6df0e0852139ca79663e446358a7c [0,1,0,1,0,0|2,0,0]=4 14447 B17R2.3519 C[C@H]1CCC[C@H]1OCC(=O)c2cnccn2 9ae46ca9554bed21e5d70baff2f38155 [0,1,0,1,0,0|2,0,0]=4 14448 B17R2.3519 C[C@H]1CCC[C@H]1OCC(F)c2ccccc2 98094e41c4df5fef31b326232edc0894 [0,1,0,1,0,0|1,0,1]=4 14449 B17R2.3519 C[C@H]1CCC[C@H]1OCS(=O)c2ccccc2 d31f79393bffcfd530a36ba4a527c775 [0,1,0,1,0,0|1,0,0]=3 14450 B17R2.3519 C[C@H]1COC[C@@H]1OCC(=O)c2ccccc2 b81a8da39bb0e21efc40e7c5bf70e8a8 [0,1,0,1,0,0|1,0,0]=3 14451 B17R2.3519 C[C@H]1COC[C@@H]1OCC(=O)c2ccccn2 d7ef1c398e4739480a39a0fb11255e10 [0,1,0,1,0,0|2,0,0]=4 14452 B17R2.3519 C[C@H]1COC[C@@H]1OCC(=O)c2cccnc2 c730cc5d49b2d74f26b478d60f858763 [0,1,0,1,0,0|2,0,0]=4 14453 B17R2.3519 C[C@H]1COC[C@@H]1OCS(=O)c2ccccc2 546c92ca775782b7e06d7585d8db2b5c [0,1,0,1,0,0|2,0,0]=4 14454 B17R2.3519 C[C@H]1COC[C@H]1OCC(=O)c2ccccc2 e5f24a29f276f935042bc250344759c2 [0,1,0,1,0,0|1,0,0]=3 14455 B17R2.3519 C[C@H]1COC[C@H]1OCC(=O)c2ccccn2 20a91ef410476ce094eded2abe8b8a85 [0,1,0,1,0,0|2,0,0]=4 14456 B17R2.3519 C[C@H]1COC[C@H]1OCC(=O)c2cccnc2 c61e30496f2b27a872c9ab5c09835152 [0,1,0,1,0,0|2,0,0]=4 14457 B17R2.3519 C[C@H]1COC[C@H]1OCS(=O)c2ccccc2 ef775cebdb80afe301c25fa6c272fd92 [0,1,0,1,0,0|2,0,0]=4 14458 B17R2.3519 O=C(CNC1CCCC1O)c2ccccc2 2ea2f47ab958f5f4ce636018b82723ce [0,1,0,1,0,0|2,0,0]=4 14459 B17R2.3519 O=C(CN[C@@H]1CCC[C@@H]1O)c2ccccc2 d76be6fc4e06fa09c5ffa781048d53e2 [0,1,0,1,0,0|2,0,0]=4 14460 B17R2.3519 O=C(CN[C@@H]1CCC[C@H]1O)c2ccccc2 d018adcec4e5272c40deb318158adf1e [0,1,0,1,0,0|2,0,0]=4 14461 B17R2.3519 O=C(CN[C@H]1CCC[C@@H]1O)c2ccccc2 78c0264b87764a3a49bc937bebed21e4 [0,1,0,1,0,0|2,0,0]=4 14462 B17R2.3519 O=C(CN[C@H]1CCC[C@H]1O)c2ccccc2 b16d47543c24ab4d4fb710faeb9a3169 [0,1,0,1,0,0|2,0,0]=4 14463 B17R2.3519 O=C(COC1CCCC1=O)c2ccccc2 2bdc31b4ab6c033ed7fdabb0e153c223 [0,1,0,1,0,0|1,0,1]=4 14464 B17R2.3519 O=C(COC1COCC1F)c2ccccc2 2daeae2b32710cd6beee7c6861aea55d [0,1,0,1,0,0|2,0,0]=4 14465 B17R2.3519 O=C(CO[C@@H]1CCC[C@H]1F)c2ccccc2 c384c3296138810d091967eb4d896abc [0,1,0,1,0,0|1,0,0]=3 14466 B17R2.3519 O=C(CO[C@@H]1CCC[C@H]1F)c2ccccn2 97eaaec3af290c4b2239a3a0addbf418 [0,1,0,1,0,0|2,0,0]=4 14467 B17R2.3519 O=C(CO[C@@H]1CCC[C@H]1F)c2cccnc2 b428e322549c6b715e75ae739061fd7b [0,1,0,1,0,0|2,0,0]=4 14468 B17R2.3519 O=C(CO[C@@H]1COC[C@H]1F)c2ccccc2 c083d97beaa9b2aaab9e10d7a3b1ae70 [0,1,0,1,0,0|2,0,0]=4 14469 B17R2.3519 O=C(CO[C@H]1COC[C@H]1F)c2ccccc2 db189fb78a087c460568c4911a59c5bb [0,1,0,1,0,0|2,0,0]=4 14470 B17R2.3519 O=C(NCC1CCCC1O)c2ccccc2 6f121ffd02fcdea0946d12b62ba2c4b6 [0,1,0,1,0,0|1,0,0]=3 14471 B17R2.3519 O=C(NCC1CCCC1O)c2ccccn2 bb403b8d0f6c985cba1d6e486d57caa8 [0,1,0,1,0,0|2,0,0]=4 14472 B17R2.3519 O=C(NCC1CCCC1O)c2cccnc2 a065b189e429b08963e8975552871cb1 [0,1,0,1,0,0|2,0,0]=4 14473 B17R2.3519 O=C(NCC1CCCC1O)c2ccncc2 6eb182014ea5cf79a6038268b81e2980 [0,1,0,1,0,0|2,0,0]=4 14474 B17R2.3519 O=C(NC[C@@H]1COC[C@@H]1O)c2ccccc2 6e737133a4af04b02567a7a6e616f7aa [0,1,0,1,0,0|2,0,0]=4 14475 B17R2.3519 O=C(OCN1CCCC1O)c2ccccc2 dd4aa4abec57d641cc151f41e77b34d9 [0,1,0,1,0,0|1,0,0]=3 14476 B17R2.3519 O=S(CO[C@@H]1CCC[C@H]1F)c2ccccc2 88b134e90d44d836fb6f6434a75df8fa [0,1,0,1,0,0|2,0,0]=4 14477 B17R2.3856 C=C1CC1COCOC(=O)c2ccccc2 e5eec4728b7950c143958e2b565916c6 [0,1,0,1,0,0|0,0,2]=4 14478 B17R2.3856 CC1CC1COCOC(=O)c2ccccc2 246021229acf19e9546af58b264a691b [0,1,0,1,0,0|0,0,0]=2 14479 B17R2.3856 CC1CC1NCCNC(=O)c2ccccc2 23c0dc6dbe213383d4a017019e936c74 [0,1,0,1,0,0|1,0,0]=3 14480 B17R2.3856 CC1CC1NCCNC(=O)c2ccccn2 0efce0bfdc9174bf27907a8d5321b288 [0,1,0,1,0,0|2,0,0]=4 14481 B17R2.3856 CC1CC1NCCOC(=O)c2ccccc2 b3e6920ad6c05a87a9dc585f75495d68 [0,1,0,1,0,0|0,0,0]=2 14482 B17R2.3856 C[C@@H]1C[C@H]1COCOC(=O)c2ccccc2 b52cbabeffeb099816efcbd999e51047 [0,1,0,1,0,0|0,0,0]=2 14483 B17R2.3856 C[C@H]1C[C@@H]1COCOC(=O)c2ccccc2 6585a4c06198e5b9746e88a06612b324 [0,1,0,1,0,0|0,0,0]=2 14484 B17R2.3856 C[C@H]1C[C@H]1COCOC(=O)c2ccccc2 a37498cdc88d24d88b813207eaee2881 [0,1,0,1,0,0|0,0,0]=2 14485 B17R2.3856 O=C(NCCN[C@@H]1C[C@H]1F)c2ccccc2 0d236c6aa9a06cddb1df7cabf1d8f048 [0,1,0,1,0,0|2,0,0]=4 14486 B17R2.3856 O=C(NCCN[C@H]1C[C@@H]1F)c2ccccc2 95df99d145dcad63fecf4a17bd474eaa [0,1,0,1,0,0|2,0,0]=4 14487 B17R2.3856 O=C(NCCN[C@H]1C[C@H]1F)c2ccccc2 ac035ddb9290f6e0ac83242789b8ab66 [0,1,0,1,0,0|2,0,0]=4 14488 B17R2.3856 O=C(OCCN[C@@H]1C[C@H]1F)c2ccccc2 0de5e18024080a9440597eb575c75513 [0,1,0,1,0,0|1,0,0]=3 14489 B17R2.3856 O=C(OCCN[C@H]1C[C@@H]1F)c2ccccc2 b896c70060d1ce526d76ee3570b8471f [0,1,0,1,0,0|1,0,0]=3 14490 B17R2.3856 O=C(OCCN[C@H]1C[C@H]1F)c2ccccc2 e550db580a366e78d5b4d22735afb2fa [0,1,0,1,0,0|1,0,0]=3 14491 B17R2.3856 O=C(OCOC[C@@H]1C[C@@H]1F)c2ccccc2 83b8108c4fa7238d062adb0c1caaabfc [0,1,0,1,0,0|1,0,0]=3 14492 B17R2.3856 O=C(OCOC[C@@H]1C[C@H]1F)c2ccccc2 fc2888f5a672dc8a0d9e71034e188432 [0,1,0,1,0,0|1,0,0]=3 14493 B17R2.3856 O=C(OCOC[C@H]1C[C@@H]1F)c2ccccc2 5e7e2854869c2881b48160b5247fb76e [0,1,0,1,0,0|1,0,0]=3 14494 B17R2.3856 O=C(OCOC[C@H]1C[C@H]1F)c2ccccc2 da690d7b14b6b3e4b74581d877eefc54 [0,1,0,1,0,0|1,0,0]=3 14495 B17R2.4082 CCCC1C=CCN1C(=O)c2ccccc2 1e8d08246c73f76a9d21b79ec177974f [0,1,0,1,0,0|1,0,1]=4 14496 B17R2.4082 CCCC1SCCN1C(=O)c2ccccc2 24414bfcab319e756396e17b259a2539 [0,1,0,1,0,0|1,0,0]=3 14497 B17R2.4082 CCCC1SCCN1C(=O)c2ccccn2 8254644efc4ec01bf7628ab4d6b0c127 [0,1,0,1,0,0|2,0,0]=4 14498 B17R2.4082 CCCC1SCCN1C(=O)c2cccnc2 4575f2817b5f61b1c4ed098af133724a [0,1,0,1,0,0|2,0,0]=4 14499 B17R2.4082 CCCC1SCCN1C(=O)c2ccncc2 4ac471ab8fb60d3dea06fe65626efd17 [0,1,0,1,0,0|2,0,0]=4 14500 B17R2.4082 COCC1CCCN1C(=O)c2ccccc2 f7a721ccdf4a875b4a746c1bd0d816f3 [0,1,0,1,0,0|1,0,0]=3 14501 B17R2.4082 COCC1CCCN1C(=O)c2ccccn2 c36eeaace5a95865ccc38a8bca66061d [0,1,0,1,0,0|2,0,0]=4 14502 B17R2.4082 COCC1CCCN1C(=O)c2cccnc2 e3f55989107a2c1c9f96a9f47122b1b7 [0,1,0,1,0,0|2,0,0]=4 14503 B17R2.4082 COCC1CCCN1C(=O)c2ccncc2 c4b3ac97976975be59f1e133befbd791 [0,1,0,1,0,0|2,0,0]=4 14504 B17R2.4082 COC[C@@H]1CCCN1C(=O)c2ccccc2 a3efb9966fca021bb8a921dc811a6db0 [0,1,0,1,0,0|1,0,0]=3 14505 B17R2.4082 COC[C@@H]1CCCN1C(=O)c2ccccn2 5cb79dcea951dbc8a7d955d6924fb0a8 [0,1,0,1,0,0|2,0,0]=4 14506 B17R2.4082 COC[C@@H]1CCCN1C(=O)c2cccnc2 8f9ad4e9531c3a6457e5a3dbb2ae7b2d [0,1,0,1,0,0|2,0,0]=4 14507 B17R2.4082 COC[C@@H]1CCCN1C(=O)c2ccncc2 3d5beeebd29271d24c6de70c1b13a8d1 [0,1,0,1,0,0|2,0,0]=4 14508 B17R2.4082 COC[C@H]1CCCN1C(=O)c2ccccc2 71df814e6434679684dc5121aa5528f0 [0,1,0,1,0,0|1,0,0]=3 14509 B17R2.4082 COC[C@H]1CCCN1C(=O)c2ccccn2 f3e2c00240de0e91b5a234e598c95eed [0,1,0,1,0,0|2,0,0]=4 14510 B17R2.4082 COC[C@H]1CCCN1C(=O)c2cccnc2 9428cf46fe6ffd6d863bc8346061e8bc [0,1,0,1,0,0|2,0,0]=4 14511 B17R2.4082 COC[C@H]1CCCN1C(=O)c2ccncc2 a767ae5af46539aebb30fa60c22e04d4 [0,1,0,1,0,0|2,0,0]=4 14512 B17R2.4082 CSCC1CCCN1C(=O)c2ccccc2 6deb2eb70610ede8d7f9a8ecfac7605c [0,1,0,1,0,0|1,0,0]=3 14513 B17R2.4082 CSCC1CCCN1C(=O)c2ccccn2 7f11db7505ff7582ebe68ed87bbe051f [0,1,0,1,0,0|2,0,0]=4 14514 B17R2.4082 CSCC1CCCN1C(=O)c2cccnc2 aff71d99de68a66e6b713b413a1359d1 [0,1,0,1,0,0|2,0,0]=4 14515 B17R2.4082 CSCC1CCCN1C(=O)c2ccncc2 b707ecbb62973aebd5c27a7c0af40ea5 [0,1,0,1,0,0|2,0,0]=4 14516 B17R2.4082 O=C(c1ccccc1)N2CCCC2CCO 561d36ce639c72756fc379543d274c43 [0,1,0,1,0,0|1,0,0]=3 14517 B17R2.4082 O=C(c1ccccc1)N2CCC[C@@H]2CCO 904487240f49b2f2df9382ad90743506 [0,1,0,1,0,0|1,0,0]=3 14518 B17R2.4082 O=C(c1ccccn1)N2CCCC2CCO f5727b5eca530599098987b6196fdde3 [0,1,0,1,0,0|2,0,0]=4 14519 B17R2.4082 O=C(c1ccccn1)N2CCC[C@@H]2CCO effd41329df17ae5df837776060efdbc [0,1,0,1,0,0|2,0,0]=4 14520 B17R2.4082 O=C(c1cccnc1)N2CCCC2CCO 4787accece6ac206ab2247b4312521d2 [0,1,0,1,0,0|2,0,0]=4 14521 B17R2.4082 O=C(c1cccnc1)N2CCC[C@@H]2CCO 2a8f91bbc9b0baa8755a089c7eb859f4 [0,1,0,1,0,0|2,0,0]=4 14522 B17R2.4082 O=C(c1ccncc1)N2CCCC2CCO 943b7d91f0cf3c8c623e1652f554d305 [0,1,0,1,0,0|2,0,0]=4 14523 B17R2.4082 O=C(c1ccncc1)N2CCC[C@@H]2CCO 58174fea0af191dee5c0e1f213f397c8 [0,1,0,1,0,0|2,0,0]=4 14524 B17R2.4184 COCC1CCN1CC(=O)c2ccccc2 6bc038056ef28c15d54c9a9e4c8639d8 [0,1,0,1,0,0|2,0,0]=4 14525 B17R2.4184 COC[C@@H]1CCN1CC(=O)c2ccccc2 8dfa10e6c3c6c39fa41af2e88ff326ae [0,1,0,1,0,0|2,0,0]=4 14526 B17R2.4184 COC[C@H]1CCN1CC(=O)c2ccccc2 1cd9cb346b67747c991c4cb1d89fef90 [0,1,0,1,0,0|2,0,0]=4 14527 B17R2.4184 O=C(CN1CCC1CCO)c2ccccc2 35087f44eff3051039a7c517c7d81a2c [0,1,0,1,0,0|2,0,0]=4 14528 B17R2.4651 COC[C@@H]1C[C@@H]1NCC(=O)c2ccccc2 47bcfd4413aced3b79576c77b4764312 [0,1,0,1,0,0|2,0,0]=4 14529 B17R2.4651 COC[C@H]1C[C@@H]1NCC(=O)c2ccccc2 7b5ddfffe103ca8850fda991f0480627 [0,1,0,1,0,0|2,0,0]=4 14530 B17R2.5326 C=C(COCC1CCC1F)c2ccccc2 5f14100d127a784dd3e2eebb9fd49e16 [0,1,0,1,0,0|2,0,0]=4 14531 B17R2.5326 C=C(COCC1CCN1C)c2ccccc2 4ec85b9949f5dafd232751e6da368d3d [0,1,0,1,0,0|2,0,0]=4 14532 B17R2.5326 C=C(COC[C@@H]1CCN1C)c2ccccc2 f16a14e6eace40108a82c991b81755e8 [0,1,0,1,0,0|2,0,0]=4 14533 B17R2.5326 C=C(COC[C@H]1CCN1C)c2ccccc2 57d9a73cf26ae6cdfd3557fa8c01efb0 [0,1,0,1,0,0|2,0,0]=4 14534 B17R2.5326 CC1OCC1NCOC(=O)c2ccccc2 26d1a4d99fda3fea98a5f7c00e92e269 [0,1,0,1,0,0|1,0,0]=3 14535 B17R2.5326 CC1OCC1OCCC(=O)c2ccccc2 be0f7c880b13d716d66cfcaf4730d2db [0,1,0,1,0,0|2,0,0]=4 14536 B17R2.5326 CC1OCC1OCOC(=O)c2ccccc2 84c24da6417d9b2e34e3446ff9f1f2b6 [0,1,0,1,0,0|1,0,0]=3 14537 B17R2.5326 CN1CCC1CNCC(=O)c2ccccc2 5d65cd28b5fb1373226de3ce13627daa [0,1,0,1,0,0|2,0,0]=4 14538 B17R2.5326 CN1CCC1COCC(=O)c2ccccc2 9c308ebc832a8ddb7c1eb248ab09328a [0,1,0,1,0,0|1,0,0]=3 14539 B17R2.5326 CN1CCC1COCC(=O)c2ccccn2 c10c7dc8f7021b3e07f8e318be796a12 [0,1,0,1,0,0|2,0,0]=4 14540 B17R2.5326 CN1CCC1COCC(=O)c2cccnc2 c3085e0aa76fd08e4d990132ad79e626 [0,1,0,1,0,0|2,0,0]=4 14541 B17R2.5326 CN1CC[C@@H]1COCC(=O)c2ccccc2 257dd955cca6675b0a20b5e93a1b0e18 [0,1,0,1,0,0|1,0,0]=3 14542 B17R2.5326 CN1CC[C@@H]1COCC(=O)c2ccccn2 4f85920d0ed850516dc222b0ae5998f1 [0,1,0,1,0,0|2,0,0]=4 14543 B17R2.5326 CN1CC[C@@H]1COCC(=O)c2cccnc2 365ff057a1f1cf3a543ec9f007586671 [0,1,0,1,0,0|2,0,0]=4 14544 B17R2.5326 CN1CC[C@H]1COCC(=O)c2ccccc2 3112b7ed6fcc6673de371b3100a0b079 [0,1,0,1,0,0|1,0,0]=3 14545 B17R2.5326 CN1CC[C@H]1COCC(=O)c2ccccn2 3287462fcb2306685657d63777e49181 [0,1,0,1,0,0|2,0,0]=4 14546 B17R2.5326 CN1CC[C@H]1COCC(=O)c2cccnc2 dc756e685a534d4324165bb742ce2d8d [0,1,0,1,0,0|2,0,0]=4 14547 B17R2.5326 C[C@@H]1CC[C@@H]1NCOC(=O)c2ccccc2 997dbfea752a749496a48955567e8f43 [0,1,0,1,0,0|0,0,0]=2 14548 B17R2.5326 C[C@@H]1CC[C@H]1NCOC(=O)c2ccccc2 a70ec996639686e4ef04b0bf109015c3 [0,1,0,1,0,0|0,0,0]=2 14549 B17R2.5326 O=C(COCC1CCC1=O)c2ccccc2 6644de2b22d16df7093f290f76c2f2fa [0,1,0,1,0,0|1,0,1]=4 14550 B17R2.5326 O=C(COCC1CCC1F)c2ccccc2 678559bcd762992b0ef59ac6f1cde8be [0,1,0,1,0,0|1,0,0]=3 14551 B17R2.5326 O=C(COCC1CCC1F)c2ccccn2 7dc06ec1ba7a237334a761502c008983 [0,1,0,1,0,0|2,0,0]=4 14552 B17R2.5326 O=C(COCC1CCC1F)c2cccnc2 c401c4b7464b401f398566639040aa25 [0,1,0,1,0,0|2,0,0]=4 14553 B17R2.5326 O=C(OCNC1CCC1F)c2ccccc2 1a73fcbfbd5dd2ec7493a2e61d484a8f [0,1,0,1,0,0|1,0,0]=3 14554 B17R2.5326 O=C(OCNC1CCC1O)c2ccccc2 54fbc23a0cf5b2d08727a41b58ec8ad9 [0,1,0,1,0,0|1,0,0]=3 14555 B17R2.5326 O=C(OCN[C@@H]1CC[C@@H]1O)c2ccccc2 472655f88d95d96c00710c9207bbc39f [0,1,0,1,0,0|1,0,0]=3 14556 B17R2.5326 O=C(OCN[C@@H]1CC[C@H]1O)c2ccccc2 90e2ca0ec1b8b69b883515702704e2fa [0,1,0,1,0,0|1,0,0]=3 14557 B17R2.5326 O=C(OCN[C@H]1CC[C@@H]1O)c2ccccc2 78ac3cc939fe867c86e607249fa6d34b [0,1,0,1,0,0|1,0,0]=3 14558 B17R2.5326 O=C(OCN[C@H]1CC[C@H]1O)c2ccccc2 dedbf1fb8423c479905f0844fc38a05d [0,1,0,1,0,0|1,0,0]=3 14559 B17R2.5326 O=C(OCOC1CCC1=O)c2ccccc2 692e3c20cd7459a9f6745fec69b17b19 [0,1,0,1,0,0|1,0,1]=4 14560 B17R2.5716 C=C(COCCCC1CC1)c2ccccc2 053727914ef581d49a3e02eb2afb6aaf [0,1,0,1,0,0|1,0,0]=3 14561 B17R2.5716 C=C(COCCOC1CC1)c2ccccc2 4adf50f1ca923104b5394f39a8d881eb [0,1,0,1,0,0|2,0,0]=4 14562 B17R2.5716 CC(COCCCC1CC1)c2ccccc2 2f04599ba2e39f02793d641fdaa798dc [0,1,0,1,0,0|1,0,1]=4 14563 B17R2.5716 C[C@H](COCCCC1CC1)c2ccccc2 aafbe3c65f1766faf1a1d6b050dab783 [0,1,0,1,0,0|1,0,1]=4 14564 B17R2.5716 FC(COCCCC1CC1)c2ccccc2 cdfce48f384e090e11a012704de95bde [0,1,0,1,0,0|1,0,1]=4 14565 B17R2.5716 O=C(CCCCOC1CC1)c2ccccc2 94b89b5ef54db6e225436bc9a7a79273 [0,1,0,1,0,0|1,0,0]=3 14566 B17R2.5716 O=C(CCCOCC1CC1)c2ccccc2 7feec25e520149616874a22481fa852e [0,1,0,1,0,0|1,0,0]=3 14567 B17R2.5716 O=C(CCCOCC1CC1)c2cccnc2 8a0ecd11fb00857992dcba46ac22b4ea [0,1,0,1,0,0|2,0,0]=4 14568 B17R2.5716 O=C(CCOCCC1CC1)c2ccccc2 84575e9bb3a6d182dd760f7a1a07381b [0,1,0,1,0,0|1,0,0]=3 14569 B17R2.5716 O=C(CNCCOC1CC1)c2ccccc2 7fd1d1ce558d30488c6ff4723341e1f3 [0,1,0,1,0,0|2,0,0]=4 14570 B17R2.5716 O=C(COC/C=C/C1CC1)c2ccccc2 f2edf9cff9c892a7d2440bb0bc5050ca [0,1,0,1,0,0|0,0,2]=4 14571 B17R2.5716 O=C(COCC#CC1CC1)c2ccccc2 7b3f08ab1ced1df432b30dd0d2f6c53c [0,1,0,1,0,0|0,0,2]=4 14572 B17R2.5716 O=C(COCCCC1CC1)c2ccccc2 74b677c846d5d9756b4d85390405f308 [0,1,0,1,0,0|0,0,0]=2 14573 B17R2.5716 O=C(COCCCC1CC1)c2ccccn2 e3de5e92d95f20304c332fdcb06b8a8d [0,1,0,1,0,0|1,0,0]=3 14574 B17R2.5716 O=C(COCCCC1CC1)c2cccnc2 ffc1a6751f83888d0757baa956bee5fd [0,1,0,1,0,0|1,0,0]=3 14575 B17R2.5716 O=C(COCCCC1CC1)c2ccncn2 976bcf2a3270599620c806c45977d0ed [0,1,0,1,0,0|2,0,0]=4 14576 B17R2.5716 O=C(COCCCC1CC1)c2cnccn2 5885eea01c718082ccac6d32fe91bd5d [0,1,0,1,0,0|2,0,0]=4 14577 B17R2.5716 O=C(COCCOC1CC1)c2ccccc2 0199d54295f13f3eb6d3971e3cfcfd76 [0,1,0,1,0,0|1,0,0]=3 14578 B17R2.5716 O=C(COCCOC1CC1)c2ccccn2 901a0fbede5889fd6da4ae59285c81df [0,1,0,1,0,0|2,0,0]=4 14579 B17R2.5716 O=C(COCCOC1CC1)c2cccnc2 afda61aa8325a393e8e834972773ed50 [0,1,0,1,0,0|2,0,0]=4 14580 B17R2.5716 O=C(NCCCOC1CC1)c2ccccc2 f5b36758f72b4d3ab65494a5bf77a859 [0,1,0,1,0,0|1,0,0]=3 14581 B17R2.5716 O=C(NCCNCC1CC1)c2ccccc2 dabe7b86c3288b2629eaf214ca4ac978 [0,1,0,1,0,0|1,0,0]=3 14582 B17R2.5716 O=C(NCCNCC1CC1)c2ccccn2 3a8d3146b00e64be989a3b5719271576 [0,1,0,1,0,0|2,0,0]=4 14583 B17R2.5716 O=C(NCCNCC1CC1)c2ccncc2 a27f9aaa6c9bfd9d6aa330a5530e4b07 [0,1,0,1,0,0|2,0,0]=4 14584 B17R2.5716 O=C(NCCOCC1CC1)c2ccccc2 f29294f9a4c3b5df0bc68089563b76f9 [0,1,0,1,0,0|1,0,0]=3 14585 B17R2.5716 O=C(NCCOCC1CC1)c2ccccn2 e813875049529e36d7767cbfe9138b5e [0,1,0,1,0,0|2,0,0]=4 14586 B17R2.5716 O=C(NCCOCC1CC1)c2cccnc2 31464da20da56c5fcdcf649beca239da [0,1,0,1,0,0|2,0,0]=4 14587 B17R2.5716 O=C(NCCOCC1CC1)c2ccncc2 6c7c666aaee8de2891d687be6d689a49 [0,1,0,1,0,0|2,0,0]=4 14588 B17R2.5716 O=C(NCCSCC1CC1)c2ccccc2 0b7c76882f0fb5e3a847b3607f20d031 [0,1,0,1,0,0|1,0,0]=3 14589 B17R2.5716 O=C(NCCSCC1CC1)c2ccccn2 f886778a57344232fc51975f26ff3fe2 [0,1,0,1,0,0|2,0,0]=4 14590 B17R2.5716 O=C(NCCSCC1CC1)c2cccnc2 71702f24a10f9795ae8caeaffb046c3d [0,1,0,1,0,0|2,0,0]=4 14591 B17R2.5716 O=C(NCCSCC1CC1)c2ccncc2 4ab6eeb124f50278416d230d58cfc587 [0,1,0,1,0,0|2,0,0]=4 14592 B17R2.5716 O=C(NCOCCC1CC1)c2ccccc2 3c3d7c2e5b28392cf214b7e096ac3c8a [0,1,0,1,0,0|1,0,0]=3 14593 B17R2.5716 O=C(NCOCCC1CC1)c2cccnc2 e077880940da7d2f97cc95180929b99c [0,1,0,1,0,0|2,0,0]=4 14594 B17R2.5716 O=C(OCCCNC1CC1)c2ccccc2 e8789b9924730fc39616033b5357a756 [0,1,0,1,0,0|0,0,0]=2 14595 B17R2.5716 O=C(OCCCOC1CC1)c2ccccc2 9d320f084bc1d08686266257a5ec92a4 [0,1,0,1,0,0|0,0,0]=2 14596 B17R2.5716 O=C(OCCNCC1CC1)c2ccccc2 dab78cca0527e5072a147179f226ebdb [0,1,0,1,0,0|0,0,0]=2 14597 B17R2.5716 O=C(OCCOCC1CC1)c2ccccc2 7a7b31541e1c36751c150290262c8b46 [0,1,0,1,0,0|0,0,0]=2 14598 B17R2.5716 O=C(OCCOCC1CC1)c2cccnc2 9835fecc10a14d7f8d9f9ba5e50b8336 [0,1,0,1,0,0|1,0,0]=3 14599 B17R2.5716 O=C(OCNCCC1CC1)c2ccccc2 34b8342835820235b8f46504f2a69402 [0,1,0,1,0,0|0,0,0]=2 14600 B17R2.5716 O=C(OCNCCN1CC1)c2ccccc2 4cd0bcd7d80b916ccfb131bdb09f16dd [0,1,0,1,0,0|1,0,0]=3 14601 B17R2.5716 O=C(OCOCCC1CC1)c2ccccc2 530cdbfd260f5d110050babe95df070a [0,1,0,1,0,0|0,0,0]=2 14602 B17R2.5716 O=C(OCOCCN1CC1)c2ccccc2 3a1c78f225ba8fee66cc31b160565527 [0,1,0,1,0,0|1,0,0]=3 14603 B17R2.5716 O=S(CCOCCC1CC1)c2ccccc2 ad78fa913be003f3cfc5d931bab01c23 [0,1,0,1,0,0|2,0,0]=4 14604 B17R2.5716 O=S(COCCOC1CC1)c2ccccc2 f66137c8489944ef44e011890dcdfee3 [0,1,0,1,0,0|2,0,0]=4 14605 B17R2.5721 C=C(COCCC1CCC1)c2ccccc2 533f13f2a8224d1487ea38b7557a2ddb [0,1,0,1,0,0|1,0,0]=3 14606 B17R2.5721 C=C(COCCC1CCC1)c2ccccn2 582d95f569a23fcf9574d79c2b11b90c [0,1,0,1,0,0|2,0,0]=4 14607 B17R2.5721 C=C(COCCC1CCO1)c2ccccc2 21f21eedf25c8d15677ca1b821127285 [0,1,0,1,0,0|2,0,0]=4 14608 B17R2.5721 C=C(COCCC1COC1)c2ccccc2 775f93df7a9ce833d8ba44dbac6f1ab2 [0,1,0,1,0,0|2,0,0]=4 14609 B17R2.5721 C=C(COCCN1CCC1)c2ccccc2 f1874457bd705cb029b94122c42c78de [0,1,0,1,0,0|2,0,0]=4 14610 B17R2.5721 C=C(COCC[C@@H]1CCO1)c2ccccc2 ae6048ac84814e2f11d4620af01e1286 [0,1,0,1,0,0|2,0,0]=4 14611 B17R2.5721 C=C(COCC[C@H]1CCO1)c2ccccc2 e9a089325ac65028722a2d6a90099ac7 [0,1,0,1,0,0|2,0,0]=4 14612 B17R2.5721 CC(COCCC1CCC1)c2ccccc2 30bc561a27fd2fd57b00625adbd08089 [0,1,0,1,0,0|1,0,1]=4 14613 B17R2.5721 CC(OCCOC1CCC1)c2ccccc2 134cdb6fb3a5c438f754194507cc0b3c [0,1,0,1,0,0|1,0,1]=4 14614 B17R2.5721 C[C@@H](COCCC1CCC1)c2ccccc2 932ceb0b8cbcc9236c84c9baf3383ccd [0,1,0,1,0,0|1,0,1]=4 14615 B17R2.5721 C[C@@H](OCCOC1CCC1)c2ccccc2 20dc277b3f8d846e33aac10b98839025 [0,1,0,1,0,0|1,0,1]=4 14616 B17R2.5721 C[C@H](COCCC1CCC1)c2ccccc2 851d0ab0fa99bcd5438e93d28e2a0e20 [0,1,0,1,0,0|1,0,1]=4 14617 B17R2.5721 C[C@H](OCCOC1CCC1)c2ccccc2 3735c1d09519d04b49aa90ae44be0865 [0,1,0,1,0,0|1,0,1]=4 14618 B17R2.5721 FC(COCCC1CCC1)c2ccccc2 a04a80d3855b2196d45429e8030b0472 [0,1,0,1,0,0|1,0,1]=4 14619 B17R2.5721 O=C(CCCOC1CCC1)c2ccccc2 c2fce519b2d3c2cdf6f3fcad648d6c67 [0,1,0,1,0,0|1,0,0]=3 14620 B17R2.5721 O=C(CCCOC1CCC1)c2cccnc2 1a9f769399d4da38a620e997d44cafb6 [0,1,0,1,0,0|2,0,0]=4 14621 B17R2.5721 O=C(CCNCC1CCO1)c2ccccc2 f5ebbd0b28a0df9b83499c47a1464971 [0,1,0,1,0,0|2,0,0]=4 14622 B17R2.5721 O=C(CCNCC1COC1)c2ccccc2 f9053ac8ac65f6555d48c14151cc4ea9 [0,1,0,1,0,0|2,0,0]=4 14623 B17R2.5721 O=C(CCNC[C@@H]1CCO1)c2ccccc2 6c9c530ce96b5c05cfd2a9bc3872d40c [0,1,0,1,0,0|2,0,0]=4 14624 B17R2.5721 O=C(CCNC[C@H]1CCO1)c2ccccc2 8089cfba62807d43cfe0f5406fffe4db [0,1,0,1,0,0|2,0,0]=4 14625 B17R2.5721 O=C(CCOCC1CCC1)c2ccccc2 0b5212d10c6e56396c30ca74d8a29612 [0,1,0,1,0,0|1,0,0]=3 14626 B17R2.5721 O=C(CCOCC1CCO1)c2ccccc2 4ff208800c4435616a57d094be516a90 [0,1,0,1,0,0|2,0,0]=4 14627 B17R2.5721 O=C(CCOCC1COC1)c2ccccc2 913b7c7fd2efcc856b488a320f3c0be6 [0,1,0,1,0,0|2,0,0]=4 14628 B17R2.5721 O=C(CCOC[C@@H]1CCO1)c2ccccc2 39c21613fef4af5e4c559d392e246d2f [0,1,0,1,0,0|2,0,0]=4 14629 B17R2.5721 O=C(CCOC[C@H]1CCO1)c2ccccc2 0339a21af4ebf2bf1fd4349805fb08c0 [0,1,0,1,0,0|2,0,0]=4 14630 B17R2.5721 O=C(CNCCC1CCC1)c2ccccc2 2697fcd1922779854fae155734ad3f8e [0,1,0,1,0,0|1,0,0]=3 14631 B17R2.5721 O=C(CNCCC1CCC1)c2ccccn2 366ca6e1a8b04622db052e327ac5761d [0,1,0,1,0,0|2,0,0]=4 14632 B17R2.5721 O=C(CNCCC1CCC1)c2cccnc2 28e08d916cc204ec1d669dea046b8520 [0,1,0,1,0,0|2,0,0]=4 14633 B17R2.5721 O=C(CNCCC1CCO1)c2ccccc2 0647bf508f918219bb671edda2f54fa8 [0,1,0,1,0,0|2,0,0]=4 14634 B17R2.5721 O=C(CNCCC1COC1)c2ccccc2 2b01e2c745d58dd9860d38c5041fcd12 [0,1,0,1,0,0|2,0,0]=4 14635 B17R2.5721 O=C(CNCCN1CCC1)c2ccccc2 da5f343d2423a0e739ea38bad9dc87a2 [0,1,0,1,0,0|2,0,0]=4 14636 B17R2.5721 O=C(CNCC[C@@H]1CCO1)c2ccccc2 6e2495d60ee4b02a20eaa2b027e091a1 [0,1,0,1,0,0|2,0,0]=4 14637 B17R2.5721 O=C(COCCC1CCC1)c2ccccc2 8d4dcda72be9f3851b5492947f44f3d8 [0,1,0,1,0,0|0,0,0]=2 14638 B17R2.5721 O=C(COCCC1CCC1)c2ccccn2 165d319d0b226b19f9fc3c70b8c00c37 [0,1,0,1,0,0|1,0,0]=3 14639 B17R2.5721 O=C(COCCC1CCC1)c2cccnc2 b418186011f4d5a247b59a701bba1169 [0,1,0,1,0,0|1,0,0]=3 14640 B17R2.5721 O=C(COCCC1CCC1)c2ccncn2 33810a26d468c79cd976b05fd87e2b50 [0,1,0,1,0,0|2,0,0]=4 14641 B17R2.5721 O=C(COCCC1CCC1)c2cnccn2 0434ca2d0b296b9aeac32c3da6c8529f [0,1,0,1,0,0|2,0,0]=4 14642 B17R2.5721 O=C(COCCC1CCO1)c2ccccc2 cfd4af1299f39ba2a6ccf7e94bbffa29 [0,1,0,1,0,0|1,0,0]=3 14643 B17R2.5721 O=C(COCCC1CCO1)c2ccccn2 1bfaee9e28a854ad46c0f2d192871903 [0,1,0,1,0,0|2,0,0]=4 14644 B17R2.5721 O=C(COCCC1CCO1)c2cccnc2 63c804fa46d7803b11e10298fb1fb4bc [0,1,0,1,0,0|2,0,0]=4 14645 B17R2.5721 O=C(COCCC1COC1)c2ccccc2 12666c692d3af97bd3ef1ec56eb21cca [0,1,0,1,0,0|1,0,0]=3 14646 B17R2.5721 O=C(COCCC1COC1)c2ccccn2 1ae65230da462f7ac8d1c5a3b9d560a4 [0,1,0,1,0,0|2,0,0]=4 14647 B17R2.5721 O=C(COCCC1COC1)c2cccnc2 3f1fa9dfb0076007f8c4204e8218717e [0,1,0,1,0,0|2,0,0]=4 14648 B17R2.5721 O=C(COCCN1CCC1)c2ccccc2 5eeff8c76d21235280e0d12e752dfd81 [0,1,0,1,0,0|1,0,0]=3 14649 B17R2.5721 O=C(COCCN1CCC1)c2ccccn2 5796f0042e8307dc2a1c6eb2280dec62 [0,1,0,1,0,0|2,0,0]=4 14650 B17R2.5721 O=C(COCCN1CCC1)c2cccnc2 de6abd35e507988fce077e54aa247d85 [0,1,0,1,0,0|2,0,0]=4 14651 B17R2.5721 O=C(COCC[C@@H]1CCO1)c2ccccc2 46932e186d07017c15a539cf476c6779 [0,1,0,1,0,0|1,0,0]=3 14652 B17R2.5721 O=C(COCC[C@@H]1CCO1)c2ccccn2 8d37d7f9a54614012dc4e01804c4cc10 [0,1,0,1,0,0|2,0,0]=4 14653 B17R2.5721 O=C(COCC[C@@H]1CCO1)c2cccnc2 90c56e646ee2784c6c7a1a876bca71d1 [0,1,0,1,0,0|2,0,0]=4 14654 B17R2.5721 O=C(COCC[C@H]1CCO1)c2ccccc2 7ff6dbebee2aea537d10feb2569b40a8 [0,1,0,1,0,0|1,0,0]=3 14655 B17R2.5721 O=C(COCC[C@H]1CCO1)c2ccccn2 e7ba86add3472dfd41f45fd44df41885 [0,1,0,1,0,0|2,0,0]=4 14656 B17R2.5721 O=C(COCC[C@H]1CCO1)c2cccnc2 2ea128357618b1b0ae4f2c4d0dcc3fc6 [0,1,0,1,0,0|2,0,0]=4 14657 B17R2.5721 O=C(NCCCN1CCC1)c2ccccc2 100e62b5de52ae71dd1a87fad220329a [0,1,0,1,0,0|1,0,0]=3 14658 B17R2.5721 O=C(NCCCN1CCC1)c2ccccn2 d813afc03da653c740692eeaeb3decc0 [0,1,0,1,0,0|2,0,0]=4 14659 B17R2.5721 O=C(NCCCN1CCC1)c2cccnc2 eefabc24ef162af3d03ce1e3f6736764 [0,1,0,1,0,0|2,0,0]=4 14660 B17R2.5721 O=C(NCCCN1CCC1)c2ccncc2 02729915ffba815443aab91af1bec774 [0,1,0,1,0,0|2,0,0]=4 14661 B17R2.5721 O=C(NCCNC1CCC1)c2ccccc2 31c0a4e66485f4d7f46b8b2dfd28c3c1 [0,1,0,1,0,0|1,0,0]=3 14662 B17R2.5721 O=C(NCCNC1CCC1)c2ccccn2 692f8a5c80d55d4cf297f1d4a80559d2 [0,1,0,1,0,0|2,0,0]=4 14663 B17R2.5721 O=C(NCCNC1CCC1)c2ccncc2 722cead1658ea6c73446e046274980ea [0,1,0,1,0,0|2,0,0]=4 14664 B17R2.5721 O=C(NCCOC1CCC1)c2ccccc2 ab0aebd4e6ba0569f15498ed31363dec [0,1,0,1,0,0|1,0,0]=3 14665 B17R2.5721 O=C(NCCOC1CCC1)c2ccccn2 8c2aabd773215c809d630cb89c6b1a99 [0,1,0,1,0,0|2,0,0]=4 14666 B17R2.5721 O=C(NCCOC1CCC1)c2cccnc2 693d541a50678e3cf94a91f0afe19066 [0,1,0,1,0,0|2,0,0]=4 14667 B17R2.5721 O=C(NCCOC1CCC1)c2ccncc2 9e70dd176d404b96d81218049bd358b0 [0,1,0,1,0,0|2,0,0]=4 14668 B17R2.5721 O=C(NCCOC1COC1)c2ccccc2 e484fc4d11262a9791e2fcde2dd37de3 [0,1,0,1,0,0|2,0,0]=4 14669 B17R2.5721 O=C(NCCOC1CSC1)c2ccccc2 d8fd6b55e4a579fd5c62dae33bb2b0cc [0,1,0,1,0,0|2,0,0]=4 14670 B17R2.5721 O=C(NCOCC1CCC1)c2ccccc2 f746d8da4028267ece7067ce949af745 [0,1,0,1,0,0|1,0,0]=3 14671 B17R2.5721 O=C(NCOCC1CCC1)c2cccnc2 a63b1fb7763fe9331daaec95daea0c20 [0,1,0,1,0,0|2,0,0]=4 14672 B17R2.5721 O=C(NCOCC1CCO1)c2ccccc2 a472aebf0d4dcb5fae96b13c862f1499 [0,1,0,1,0,0|2,0,0]=4 14673 B17R2.5721 O=C(NCOCC1COC1)c2ccccc2 c239bc5881346c2a348a22bd7db202b9 [0,1,0,1,0,0|2,0,0]=4 14674 B17R2.5721 O=C(NCOC[C@@H]1CCO1)c2ccccc2 6cafd0b69cbb12518408bb1395149ecb [0,1,0,1,0,0|2,0,0]=4 14675 B17R2.5721 O=C(NCOC[C@H]1CCO1)c2ccccc2 01fdaeae4af036cc16f567af5fd5f9e9 [0,1,0,1,0,0|2,0,0]=4 14676 B17R2.5721 O=C(OCCNC1CCC1)c2ccccc2 ba1c3c6bb4102f6eb120d30c165a7f6d [0,1,0,1,0,0|0,0,0]=2 14677 B17R2.5721 O=C(OCCNC1COC1)c2ccccc2 8ee81150e050f14fd2cbc52e33f97b2d [0,1,0,1,0,0|1,0,0]=3 14678 B17R2.5721 O=C(OCCOC1CCC1)c2ccccc2 71c4f3c8be302e0249b13bb37ebe2799 [0,1,0,1,0,0|0,0,0]=2 14679 B17R2.5721 O=C(OCCOC1CCC1)c2cccnc2 5783d6a647334a6508d3879b83103484 [0,1,0,1,0,0|1,0,0]=3 14680 B17R2.5721 O=C(OCCOC1COC1)c2ccccc2 e28c0ad0a05bb5a472809a89f7ebcb0d [0,1,0,1,0,0|1,0,0]=3 14681 B17R2.5721 O=C(OCCOC1COC1)c2cccnc2 b6936864d59921fb5177763d38c090e1 [0,1,0,1,0,0|2,0,0]=4 14682 B17R2.5721 O=C(OCCOC1CSC1)c2ccccc2 0bbd1b0952285a3cf4d6799d340fb551 [0,1,0,1,0,0|1,0,0]=3 14683 B17R2.5721 O=C(OCNCC1CCC1)c2ccccc2 b09b25b9367e244a5aebbf825af922e5 [0,1,0,1,0,0|0,0,0]=2 14684 B17R2.5721 O=C(OCNCC1CCO1)c2ccccc2 eabbc8fba27c44218112b84582b54994 [0,1,0,1,0,0|1,0,0]=3 14685 B17R2.5721 O=C(OCNCC1COC1)c2ccccc2 701bc343c392d77504c6c97397c93de9 [0,1,0,1,0,0|1,0,0]=3 14686 B17R2.5721 O=C(OCNC[C@@H]1CCO1)c2ccccc2 c0f1e910618c638c83d2cb2cc3871d73 [0,1,0,1,0,0|1,0,0]=3 14687 B17R2.5721 O=C(OCNC[C@H]1CCO1)c2ccccc2 cd8f46511bae071950871b188c70bbe2 [0,1,0,1,0,0|1,0,0]=3 14688 B17R2.5721 O=C(OCOCC1CCC1)c2ccccc2 633ec47d04bc0115310d9085819fab2c [0,1,0,1,0,0|0,0,0]=2 14689 B17R2.5721 O=C(OCOCC1CCO1)c2ccccc2 2fed5a9b131992705d6266f716c61e4d [0,1,0,1,0,0|1,0,0]=3 14690 B17R2.5721 O=C(OCOCC1COC1)c2ccccc2 f8f872fd2dabef99da7dd2b369e9ba0c [0,1,0,1,0,0|1,0,0]=3 14691 B17R2.5721 O=C(OCOCC1CSC1)c2ccccc2 d85e6e6bfb4ddef06ab3dcb4e210f5c7 [0,1,0,1,0,0|1,0,0]=3 14692 B17R2.5721 O=C(OCOC[C@@H]1CCO1)c2ccccc2 8e9ec648671af91112041549114aa0c3 [0,1,0,1,0,0|1,0,0]=3 14693 B17R2.5721 O=C(OCOC[C@H]1CCO1)c2ccccc2 b4d0e8a77fad3476f06c593656809144 [0,1,0,1,0,0|1,0,0]=3 14694 B17R2.5721 O=S(CCCOC1CCC1)c2ccccc2 86564fd1b8e655941a0b37e07fa95f9d [0,1,0,1,0,0|2,0,0]=4 14695 B17R2.5721 O=S(CCOCC1CCC1)c2ccccc2 580eaa24a16332c0f90a3ad9ba6b7d5f [0,1,0,1,0,0|2,0,0]=4 14696 B17R2.5721 O=S(COCCC1CCO1)c2ccccc2 51139a7d02faf180bddd5c5585612548 [0,1,0,1,0,0|2,0,0]=4 14697 B17R2.5721 O=S(COCC[C@@H]1CCO1)c2ccccc2 180f8d04c9bfbc07cdb312bbfe1abc20 [0,1,0,1,0,0|2,0,0]=4 14698 B17R2.5721 O=S(COCC[C@H]1CCO1)c2ccccc2 b431fba63f0360a5606054d7a7634aab [0,1,0,1,0,0|2,0,0]=4 14699 B17R2.12118 CCCCCN1CCC(=O)c2c1ccnc2 9bcc8c45bdce95a4dad0f9735d5dea0a [0,1,0,1,0,0|2,0,0]=4 14700 B17R2.12118 CCCCCN1CCC(=O)c2c1nccc2 c5c992118834902afb21217df0309fe7 [0,1,0,1,0,0|2,0,0]=4 14701 B17R2.12118 CCCCOC1CCC(=O)c2c1cccc2 47b35490ce5b206d93083f552b43780d [0,1,0,1,0,0|1,0,0]=3 14702 B17R2.12118 CCOCCN1CCC(=O)c2c1cccc2 38c7d411be6ad2976420b4ef26f621ce [0,1,0,1,0,0|2,0,0]=4 14703 B17R2.12118 CCOCOC1CCC(=O)c2c1cccc2 446ab9a766d0f13c3673759e3e8db8b3 [0,1,0,1,0,0|2,0,0]=4 14704 B17R2.12118 COCCCN1CCC(=O)c2c1cccc2 0793f7ddb9b21b1977b0f3cf4fdc341e [0,1,0,1,0,0|2,0,0]=4 14705 B17R2.12118 COCCOC1CCC(=O)c2c1cccc2 685c2876617b1c3bd06eaf5ba7a1df38 [0,1,0,1,0,0|2,0,0]=4 14706 B17R2.12118 CSCCCN1CCC(=O)c2c1cccc2 eca0ca0c4c45594fa8f4ee931381c0b5 [0,1,0,1,0,0|2,0,0]=4 14707 B17R2.12118 CSCCOC1CCC(=O)c2c1cccc2 a2d6f8e38db55f5897a8afbd5c869570 [0,1,0,1,0,0|2,0,0]=4 14708 B17R2.12118 O=C1CCC(c2c1cccc2)NCCCO 4e4ef891757cc9ccea71b4b076cd690e [0,1,0,1,0,0|2,0,0]=4 14709 B17R2.12118 O=C1CCC(c2c1cccc2)OCCCF 8bf4f3b405d0afba96abd73bab1f0476 [0,1,0,1,0,0|2,0,0]=4 14710 B17R2.12118 O=C1CCC(c2c1cccc2)OCCCS 014bfa77dfaf9504ea612d1407398677 [0,1,0,1,0,0|2,0,0]=4 14711 B17R2.12118 O=C1CCN(c2c1cccc2)CCCCO a7d3ec615812caf721f76868824bf167 [0,1,0,1,0,0|2,0,0]=4 14712 B17R2.19030 C#CCCCOC1OC(=O)c2c1cccc2 b07fc5b32199e2e0f3487990fc2761d0 [0,1,0,1,0,0|0,0,2]=4 14713 B17R2.19030 C/C=C/CCOC1OC(=O)c2c1cccc2 8c426f048219201853ebe7591497fc89 [0,1,0,1,0,0|0,0,2]=4 14714 B17R2.19030 C=CCCCNC1OC(=O)c2c1cccc2 c10d7217240fd68d21ad78d302c2fd0d [0,1,0,1,0,0|0,0,2]=4 14715 B17R2.19030 C=CCCCOC1OC(=O)c2c1cccc2 2b0589749cd590a6f336fc0721695340 [0,1,0,1,0,0|0,0,2]=4 14716 B17R2.19030 CC#CCCOC1OC(=O)c2c1cccc2 71b0d5122575894d4ac4b60ddab929f7 [0,1,0,1,0,0|0,0,2]=4 14717 B17R2.19030 CC/C=C/COC1OC(=O)c2c1cccc2 9a2df110f8395b326f33dc68cea74f07 [0,1,0,1,0,0|0,0,2]=4 14718 B17R2.19030 CC/C=C\COC1OC(=O)c2c1cccc2 575344f827a5b893aaabf53f8029cb9b [0,1,0,1,0,0|0,0,2]=4 14719 B17R2.19030 CCCCCNC1CC(=O)c2c1cccc2 fc8800fafe1ac66d4c7df6a7b6a3f818 [0,1,0,1,0,0|1,0,0]=3 14720 B17R2.19030 CCCCCNC1NC(=O)c2c1cccc2 c014ed954a280cfedd76aeb3870a97d6 [0,1,0,1,0,0|1,0,0]=3 14721 B17R2.19030 CCCCCOC1CC(=O)c2c1cccc2 7f62a8959a48d0c975f6a3c89eaeefa8 [0,1,0,1,0,0|1,0,0]=3 14722 B17R2.19030 CCCCCOC1OC(=O)c2c1cccc2 d937d1dd4556d3b5891eac56a41a6f7a [0,1,0,1,0,0|0,0,0]=2 14723 B17R2.19030 CCCCCOC1OC(=O)c2c1cncc2 3b5f147bfd1d8d57ce5877d966202e7f [0,1,0,1,0,0|1,0,0]=3 14724 B17R2.19030 CCOCCNC1CC(=O)c2c1cccc2 d759533a959daa9e2aa3f3d4309ad4b1 [0,1,0,1,0,0|2,0,0]=4 14725 B17R2.19030 CCOCCNC1NC(=O)c2c1cccc2 e0631a98983feca0360dccd60b3b7fe6 [0,1,0,1,0,0|2,0,0]=4 14726 B17R2.19030 CCOCCOC1CC(=O)c2c1cccc2 88f890ca655ca647952ace9a7ff15343 [0,1,0,1,0,0|2,0,0]=4 14727 B17R2.19030 CCOCCOC1OC(=O)c2c1cccc2 ba17d0b939f64c5e2f9fab313ab70a30 [0,1,0,1,0,0|1,0,0]=3 14728 B17R2.19030 CCOCCOC1OC(=O)c2c1cncc2 5fda85da64992da2f5baa93861d24a9a [0,1,0,1,0,0|2,0,0]=4 14729 B17R2.19030 CCSCCNC1CC(=O)c2c1cccc2 36ee8c1eeed376e1c050afc5fffb4eae [0,1,0,1,0,0|2,0,0]=4 14730 B17R2.19030 CCSCCNC1NC(=O)c2c1cccc2 4833d195a3322cb617c2d71b83488d5c [0,1,0,1,0,0|2,0,0]=4 14731 B17R2.19030 CCSCCOC1CC(=O)c2c1cccc2 8a025a804cad5ef61c301511720a29d8 [0,1,0,1,0,0|2,0,0]=4 14732 B17R2.19030 CCSCCOC1OC(=O)c2c1cncc2 0f198ace57ba3d444ac1a539c44cfbdd [0,1,0,1,0,0|2,0,0]=4 14733 B17R2.19030 COCCCNC1CC(=O)c2c1cccc2 c5c14670e849cf687140e71b07b21acf [0,1,0,1,0,0|2,0,0]=4 14734 B17R2.19030 COCCCNC1NC(=O)c2c1cccc2 6da7be5d16a16bea6c236ba6686d368f [0,1,0,1,0,0|2,0,0]=4 14735 B17R2.19030 COCCCOC1CC(=O)c2c1cccc2 f973dc157eaf93d58e68dbe9304a815c [0,1,0,1,0,0|2,0,0]=4 14736 B17R2.19030 COCCCOC1OC(=O)c2c1cccc2 41e48bf30b2b88e800dee51e6a8a249d [0,1,0,1,0,0|1,0,0]=3 14737 B17R2.19030 COCCCOC1OC(=O)c2c1cncc2 d002788ee8d3a3fd7602d40fae1886cd [0,1,0,1,0,0|2,0,0]=4 14738 B17R2.19030 CSCCCNC1CC(=O)c2c1cccc2 d1b722ad273a8965d12a3e1d98fc475e [0,1,0,1,0,0|2,0,0]=4 14739 B17R2.19030 CSCCCNC1NC(=O)c2c1cccc2 84cc54c3e930da46e09f01489a47358a [0,1,0,1,0,0|2,0,0]=4 14740 B17R2.19030 CSCCCOC1CC(=O)c2c1cccc2 fc408e5d7f50b65f426d8f9f31642dad [0,1,0,1,0,0|2,0,0]=4 14741 B17R2.19030 CSCCCOC1OC(=O)c2c1cccc2 20031ddcf353a7064fa0b3d3657a89d0 [0,1,0,1,0,0|1,0,0]=3 14742 B17R2.19030 CSCCCOC1OC(=O)c2c1cncc2 09e46d6698817cc3d1e3dc959fd063c5 [0,1,0,1,0,0|2,0,0]=4 14743 B17R2.19030 N#CCCCNC1OC(=O)c2c1cccc2 6a3f7748ef96dd8cdbe67b6dbf74c3e3 [0,1,0,1,0,0|1,0,1]=4 14744 B17R2.19030 N#CCCCOC1OC(=O)c2c1cccc2 9e651ce1ce3433c6028596959435be97 [0,1,0,1,0,0|1,0,1]=4 14745 B17R2.19030 O=C1CC(c2c1cccc2)NCCCCCl d3a94034f90d524a951af80c0da880a9 [0,1,0,1,0,0|2,0,0]=4 14746 B17R2.19030 O=C1CC(c2c1cccc2)NCCCCO a1be111b382aa5739bd15f2a8261f29b [0,1,0,1,0,0|2,0,0]=4 14747 B17R2.19030 O=C1CC(c2c1cccc2)NCCCCS b8dbd92c20bf4a5d8cfc5b90158068a2 [0,1,0,1,0,0|2,0,0]=4 14748 B17R2.19030 O=C1CC(c2c1cccc2)OCCCCF 26cd30902b2c3e13985cbb2d69c81de0 [0,1,0,1,0,0|2,0,0]=4 14749 B17R2.19030 O=C1NC(c2c1cccc2)NCCCCF c6b0df3aa9b33625ae7a2c37c19ca604 [0,1,0,1,0,0|2,0,0]=4 14750 B17R2.19030 O=C1NC(c2c1cccc2)NCCCCO 00534bf0afdf5bf0aa61193a30d00d97 [0,1,0,1,0,0|2,0,0]=4 14751 B17R2.19030 O=C1OC(c2c1cccc2)NCCCCO d4e88dd88a0f18bdaa76f2999fab73d5 [0,1,0,1,0,0|1,0,0]=3 14752 B17R2.19030 O=C1OC(c2c1cccc2)OCCCCF 190122e47b369b30cbd2cda26567e021 [0,1,0,1,0,0|1,0,0]=3 14753 B17R2.19030 O=C1OC(c2c1ccnc2)OCCCCF 4cd5f6878f89f12f3b953ef8c7793442 [0,1,0,1,0,0|2,0,0]=4 14754 B17R2.19030 O=CCCCOC1OC(=O)c2c1cccc2 123fbed6d0e17c47e8f6de719dab6f97 [0,1,0,1,0,0|1,0,1]=4 14755 B17R2.45544 C=C(CNCC1CCCC1)c2ccccc2 77510aaea06927173f2087e8035770db [0,1,0,1,0,0|2,0,0]=4 14756 B17R2.45544 C=C(COCC1CCCC1)c2ccccc2 271e49835344c5fb57ff97932babf02e [0,1,0,1,0,0|1,0,0]=3 14757 B17R2.45544 C=C(COCC1CCCC1)c2ccccn2 85d89c553ad6d1f99f543a5c330770ce [0,1,0,1,0,0|2,0,0]=4 14758 B17R2.45544 C=C(COCC1CCCO1)c2ccccc2 1d0d5896de23437d47fd838b5cc9fe21 [0,1,0,1,0,0|2,0,0]=4 14759 B17R2.45544 C=C(COCC1CCCS1)c2ccccc2 d4126d02c5f84e8f5fa3b8064366e312 [0,1,0,1,0,0|2,0,0]=4 14760 B17R2.45544 C=C(COCC1CCOC1)c2ccccc2 cb9dbdc8bd173aefb43490c1ec5c4107 [0,1,0,1,0,0|2,0,0]=4 14761 B17R2.45544 C=C(COCN1CCCC1)c2ccccc2 6715175d5b274afbe0857324dca2df17 [0,1,0,1,0,0|2,0,0]=4 14762 B17R2.45544 C=C(COC[C@@H]1CCCO1)c2ccccc2 4b601e59e0cc69ee5ff00cec746f7d71 [0,1,0,1,0,0|2,0,0]=4 14763 B17R2.45544 C=C(COC[C@@H]1CCOC1)c2ccccc2 95811fec9d9d428c40c12bbb312e2a8e [0,1,0,1,0,0|2,0,0]=4 14764 B17R2.45544 C=C(COC[C@H]1CCCO1)c2ccccc2 e76060604f877f46ae41371729f00b0f [0,1,0,1,0,0|2,0,0]=4 14765 B17R2.45544 C=C(COC[C@H]1CCOC1)c2ccccc2 3d4382f0586462ca912cceff96d0dfa5 [0,1,0,1,0,0|2,0,0]=4 14766 B17R2.45544 CC(COCC1CCCC1)c2ccccc2 b5b556f41795ef11de33028a70ba7bee [0,1,0,1,0,0|1,0,1]=4 14767 B17R2.45544 CC(OCCC1CCCC1)c2ccccc2 937624e317a38999c934ad2e9dd4e7e3 [0,1,0,1,0,0|1,0,1]=4 14768 B17R2.45544 CC(OCCC1CCCO1)c2ccccc2 00bd6f0e9e9f64ec339d235873aeea94 [0,1,0,1,0,0|1,0,1]=4 14769 B17R2.45544 CC(OCCN1CCCC1)c2ccccc2 c6b5109bcc3a6f1abe55f45db6a9972f [0,1,0,1,0,0|1,0,1]=4 14770 B17R2.45544 C[C@@H](COCC1CCCC1)c2ccccc2 8ed49ee7636928905af3ca0adedda07c [0,1,0,1,0,0|1,0,1]=4 14771 B17R2.45544 C[C@@H](OCCC1CCCC1)c2ccccc2 4cb70a3d58b0b25cbe2c186d6e8bf5df [0,1,0,1,0,0|1,0,1]=4 14772 B17R2.45544 C[C@@H](OCCC1CCCO1)c2ccccc2 c85f5dc56bfc25ae82e0ab4324c48065 [0,1,0,1,0,0|1,0,1]=4 14773 B17R2.45544 C[C@@H](OCCN1CCCC1)c2ccccc2 5ac7d1b501925dec3f9797b046f4d3bb [0,1,0,1,0,0|1,0,1]=4 14774 B17R2.45544 C[C@H](COCC1CCCC1)c2ccccc2 be3191d74e78df4a21dc07805db56b40 [0,1,0,1,0,0|1,0,1]=4 14775 B17R2.45544 C[C@H](OCCC1CCCC1)c2ccccc2 0d08c7acbe85e455e8fb35cb164510cc [0,1,0,1,0,0|1,0,1]=4 14776 B17R2.45544 C[C@H](OCCC1CCCO1)c2ccccc2 f1d6457dfd9b2108cd2b25edf673e010 [0,1,0,1,0,0|1,0,1]=4 14777 B17R2.45544 C[C@H](OCCN1CCCC1)c2ccccc2 c86fc5f15621447e9fe5c592bd050afe [0,1,0,1,0,0|1,0,1]=4 14778 B17R2.45544 FC(COCC1CCCC1)c2ccccc2 66fcbd6f0803f70b8a160cebf641eeb0 [0,1,0,1,0,0|1,0,1]=4 14779 B17R2.45544 O=C(CCCN1CCSC1)c2ccccc2 04ea74e93d4604ea5eca72996600e745 [0,1,0,1,0,0|2,0,0]=4 14780 B17R2.45544 O=C(CCOC1CCCC1)c2ccccc2 019a2036e35240ae81833286f6639419 [0,1,0,1,0,0|1,0,0]=3 14781 B17R2.45544 O=C(CCOC1CCOC1)c2ccccc2 e8998f5b0e6bb1adf8e0dfef717d922d [0,1,0,1,0,0|2,0,0]=4 14782 B17R2.45544 O=C(CCO[C@@H]1CCOC1)c2ccccc2 8a8c125f5d1b0df93e1320cee6c27464 [0,1,0,1,0,0|2,0,0]=4 14783 B17R2.45544 O=C(CCO[C@H]1CCOC1)c2ccccc2 d6f2d5c076444b2348c70a5821555baf [0,1,0,1,0,0|2,0,0]=4 14784 B17R2.45544 O=C(CNCC1CCCC1)c2ccccc2 24a720c08eaf7b98e979ff2655b4727a [0,1,0,1,0,0|1,0,0]=3 14785 B17R2.45544 O=C(CNCC1CCCC1)c2ccccn2 fcdc4b5b71750bb6fbeb591c2d416d96 [0,1,0,1,0,0|2,0,0]=4 14786 B17R2.45544 O=C(CNCC1CCCC1)c2cccnc2 0f4bbe70fb0ae5b26a03420e4bf67717 [0,1,0,1,0,0|2,0,0]=4 14787 B17R2.45544 O=C(CNCC1CCCO1)c2ccccc2 24c911d13edb50b707f29c4f3ece5b6f [0,1,0,1,0,0|2,0,0]=4 14788 B17R2.45544 O=C(CNCC1CCOC1)c2ccccc2 ec8e1b3b428032cfce83311d3fdbb858 [0,1,0,1,0,0|2,0,0]=4 14789 B17R2.45544 O=C(CNC[C@@H]1CCCO1)c2ccccc2 4b78d5df827efdac4fb16afe69d0414a [0,1,0,1,0,0|2,0,0]=4 14790 B17R2.45544 O=C(CNC[C@@H]1CCOC1)c2ccccc2 1d226ed4ce0c2a906337089d0de35b58 [0,1,0,1,0,0|2,0,0]=4 14791 B17R2.45544 O=C(CNC[C@H]1CCCO1)c2ccccc2 36a5a4114dfd6847e080fe625c354c12 [0,1,0,1,0,0|2,0,0]=4 14792 B17R2.45544 O=C(CNC[C@H]1CCOC1)c2ccccc2 11653783e25626d0ceddba8c03ae9f33 [0,1,0,1,0,0|2,0,0]=4 14793 B17R2.45544 O=C(COCC1C=CCC1)c2ccccc2 a6034bdba399dab48299fdad90f0986c [0,1,0,1,0,0|0,0,2]=4 14794 B17R2.45544 O=C(COCC1CC=CC1)c2ccccc2 aa08cfd77117f15cb1a3c890e3219090 [0,1,0,1,0,0|0,0,2]=4 14795 B17R2.45544 O=C(COCC1CCCC1)c2ccccc2 148e392893c07a32aa32232691a04973 [0,1,0,1,0,0|0,0,0]=2 14796 B17R2.45544 O=C(COCC1CCCC1)c2ccccn2 e15716c9b7d7b198d4301cd468d7ff06 [0,1,0,1,0,0|1,0,0]=3 14797 B17R2.45544 O=C(COCC1CCCC1)c2cccnc2 34cf9809f098fd2a308228dd03531f30 [0,1,0,1,0,0|1,0,0]=3 14798 B17R2.45544 O=C(COCC1CCCC1)c2ccncn2 c83a0f3a67e02db90948e2235f37438c [0,1,0,1,0,0|2,0,0]=4 14799 B17R2.45544 O=C(COCC1CCCC1)c2cnccn2 af288eaa7b5294893562530cc92430c8 [0,1,0,1,0,0|2,0,0]=4 14800 B17R2.45544 O=C(COCC1CCCO1)c2ccccc2 85d30548d2023ccff57d2220e1dc0200 [0,1,0,1,0,0|1,0,0]=3 14801 B17R2.45544 O=C(COCC1CCCO1)c2ccccn2 83d66e9a88420ea0650210dcee982a65 [0,1,0,1,0,0|2,0,0]=4 14802 B17R2.45544 O=C(COCC1CCCO1)c2cccnc2 c43f0af5e3985a04448a84cec79bc930 [0,1,0,1,0,0|2,0,0]=4 14803 B17R2.45544 O=C(COCC1CCCS1)c2ccccc2 cc8df3362ac45aab150aff210340098f [0,1,0,1,0,0|1,0,0]=3 14804 B17R2.45544 O=C(COCC1CCCS1)c2ccccn2 08bc4ad6cd99cfa2ae6027adfe1f6d3f [0,1,0,1,0,0|2,0,0]=4 14805 B17R2.45544 O=C(COCC1CCCS1)c2cccnc2 66db252ac3c679128d635565a11f24b7 [0,1,0,1,0,0|2,0,0]=4 14806 B17R2.45544 O=C(COCC1CCOC1)c2ccccc2 d0183521771682fb24d04f9a3ee660da [0,1,0,1,0,0|1,0,0]=3 14807 B17R2.45544 O=C(COCC1CCOC1)c2ccccn2 febebb903a0f779d0a1797b6d714f996 [0,1,0,1,0,0|2,0,0]=4 14808 B17R2.45544 O=C(COCC1CCOC1)c2cccnc2 bdc3228315b28387830b01b0707ada07 [0,1,0,1,0,0|2,0,0]=4 14809 B17R2.45544 O=C(COCN1CCCC1)c2ccccc2 8422b9654b1a8e26c3b4c7509bbb0157 [0,1,0,1,0,0|1,0,0]=3 14810 B17R2.45544 O=C(COCN1CCCC1)c2ccccn2 2395283e5f6eeecbbd834097e6f0bfc0 [0,1,0,1,0,0|2,0,0]=4 14811 B17R2.45544 O=C(COCN1CCCC1)c2cccnc2 1d0af5b89a38e26b4a24010d4b74c75c [0,1,0,1,0,0|2,0,0]=4 14812 B17R2.45544 O=C(COC[C@@H]1CCCO1)c2ccccc2 9fdc0ee026509354453490c66859647a [0,1,0,1,0,0|1,0,0]=3 14813 B17R2.45544 O=C(COC[C@@H]1CCCO1)c2ccccn2 4e042e4978d1d28c1054d95a0eb658c4 [0,1,0,1,0,0|2,0,0]=4 14814 B17R2.45544 O=C(COC[C@@H]1CCCO1)c2cccnc2 4a14c485854123a9490c8d0842852455 [0,1,0,1,0,0|2,0,0]=4 14815 B17R2.45544 O=C(COC[C@@H]1CCOC1)c2ccccc2 90182e8be164a7cd8f796d813936b915 [0,1,0,1,0,0|1,0,0]=3 14816 B17R2.45544 O=C(COC[C@@H]1CCOC1)c2ccccn2 91c08b35ad1dab26318b31cc29c61307 [0,1,0,1,0,0|2,0,0]=4 14817 B17R2.45544 O=C(COC[C@@H]1CCOC1)c2cccnc2 f46494b4f5225c8928b4dd1257ea7862 [0,1,0,1,0,0|2,0,0]=4 14818 B17R2.45544 O=C(COC[C@H]1CCCO1)c2ccccc2 a2f4291dd4c36affd91a4d07046fc625 [0,1,0,1,0,0|1,0,0]=3 14819 B17R2.45544 O=C(COC[C@H]1CCCO1)c2ccccn2 d712e585080731806b6c087a1d9605e8 [0,1,0,1,0,0|2,0,0]=4 14820 B17R2.45544 O=C(COC[C@H]1CCCO1)c2cccnc2 29af040b444bed2f9122d2ac49c33ab4 [0,1,0,1,0,0|2,0,0]=4 14821 B17R2.45544 O=C(COC[C@H]1CCOC1)c2ccccc2 27831da8e16d7e11a687723560cc0ca5 [0,1,0,1,0,0|1,0,0]=3 14822 B17R2.45544 O=C(COC[C@H]1CCOC1)c2ccccn2 b876b9433df00b4e8a5520153491a7c9 [0,1,0,1,0,0|2,0,0]=4 14823 B17R2.45544 O=C(COC[C@H]1CCOC1)c2cccnc2 6f0d097d129166947a27f403f83cc17a [0,1,0,1,0,0|2,0,0]=4 14824 B17R2.45544 O=C(NCCC1CCCC1)c2ccccc2 37337fd4fca4b513084b492947796c02 [0,1,0,1,0,0|1,0,0]=3 14825 B17R2.45544 O=C(NCCC1CCCC1)c2ccccn2 1909c89751bd5e11d5c890b5b7cf75e9 [0,1,0,1,0,0|2,0,0]=4 14826 B17R2.45544 O=C(NCCC1CCCC1)c2cccnc2 c18a70b8b022465613b6c4898f992fb4 [0,1,0,1,0,0|2,0,0]=4 14827 B17R2.45544 O=C(NCCC1CCCC1)c2ccncc2 f82808b14a470108e9d3cfbe282aef3d [0,1,0,1,0,0|2,0,0]=4 14828 B17R2.45544 O=C(NCCC1CCCO1)c2ccccc2 dfdaefc608877209f876e16501364e34 [0,1,0,1,0,0|1,0,0]=3 14829 B17R2.45544 O=C(NCCC1CCCO1)c2ccccn2 5ea191bcb50f26533930e86a85abf1f2 [0,1,0,1,0,0|2,0,0]=4 14830 B17R2.45544 O=C(NCCC1CCCO1)c2cccnc2 37d710753a7b93e35922bf8e89d9209e [0,1,0,1,0,0|2,0,0]=4 14831 B17R2.45544 O=C(NCCC1CCCO1)c2ccncc2 2f4ba4c2c0508921da8e2deaf62d5bd2 [0,1,0,1,0,0|2,0,0]=4 14832 B17R2.45544 O=C(NCCC1CCOC1)c2ccccc2 082f08549371092591b84d4bc991ac75 [0,1,0,1,0,0|1,0,0]=3 14833 B17R2.45544 O=C(NCCC1CCOC1)c2ccccn2 ac37a778061ed7d8331346c7507426e6 [0,1,0,1,0,0|2,0,0]=4 14834 B17R2.45544 O=C(NCCC1CCOC1)c2cccnc2 4be5b89b3b4cacbd86763cdb6c017c95 [0,1,0,1,0,0|2,0,0]=4 14835 B17R2.45544 O=C(NCCC1CCOC1)c2ccncc2 68f8c2a761a495fb6dc35b7e8a100736 [0,1,0,1,0,0|2,0,0]=4 14836 B17R2.45544 O=C(NCCN1CCCC1)c2ccccc2 1c640aaebcfa6fb38ee7481607e50e4c [0,1,0,1,0,0|1,0,0]=3 14837 B17R2.45544 O=C(NCCN1CCCC1)c2ccccn2 5b6d1f2737ba11b9d183e949b818c080 [0,1,0,1,0,0|2,0,0]=4 14838 B17R2.45544 O=C(NCCN1CCCC1)c2cccnc2 7ccaf037fdd155ca1c00a95cb9a778bd [0,1,0,1,0,0|2,0,0]=4 14839 B17R2.45544 O=C(NCCN1CCCC1)c2ccncc2 24c856fc0247016ea669928988e84078 [0,1,0,1,0,0|2,0,0]=4 14840 B17R2.45544 O=C(NCCN1CCSC1)c2ccccc2 f3d3f4c3496b5b4208b2375325ae682f [0,1,0,1,0,0|2,0,0]=4 14841 B17R2.45544 O=C(NCOC1CCCC1)c2ccccc2 4c38352c716c99aa8667b87bb1e49cd4 [0,1,0,1,0,0|1,0,0]=3 14842 B17R2.45544 O=C(NCOC1CCCC1)c2cccnc2 ebbaa9802aaad85285e0f44e9465c636 [0,1,0,1,0,0|2,0,0]=4 14843 B17R2.45544 O=C(NCOC1CCOC1)c2ccccc2 f507c9a45d0672bcbdc493028b31b231 [0,1,0,1,0,0|2,0,0]=4 14844 B17R2.45544 O=C(NCO[C@@H]1CCOC1)c2ccccc2 d1594f1f6def739c6d7867f7214381bc [0,1,0,1,0,0|2,0,0]=4 14845 B17R2.45544 O=C(NCO[C@H]1CCOC1)c2ccccc2 eb5ed8dc6b3881ac798ef8bee6c67370 [0,1,0,1,0,0|2,0,0]=4 14846 B17R2.45544 O=C(OCCN1CC=CC1)c2ccccc2 ead1d71404086482708462bdce5cccdd [0,1,0,1,0,0|0,0,2]=4 14847 B17R2.45544 O=C(OCCN1CCSC1)c2ccccc2 670bab86d2a8d46eae3d58ce6384f711 [0,1,0,1,0,0|1,0,0]=3 14848 B17R2.45544 O=C(OCNC1CC=CC1)c2ccccc2 df22cddd74e682a28e5c6735fa2ad893 [0,1,0,1,0,0|0,0,2]=4 14849 B17R2.45544 O=C(OCNC1CCCC1)c2ccccc2 fa5b5f2d309f58b321372e31a1e95a7c [0,1,0,1,0,0|0,0,0]=2 14850 B17R2.45544 O=C(OCNC1CCOC1)c2ccccc2 0ae34dd4c6b65d47ab715c5220ce3d2c [0,1,0,1,0,0|1,0,0]=3 14851 B17R2.45544 O=C(OCNC1CCSC1)c2ccccc2 4cd2327c130d86cf77e05a4cb8327bb4 [0,1,0,1,0,0|1,0,0]=3 14852 B17R2.45544 O=C(OCN[C@@H]1CCOC1)c2ccccc2 5a01d0224fddc8e4284f65f60de897eb [0,1,0,1,0,0|1,0,0]=3 14853 B17R2.45544 O=C(OCN[C@H]1CCOC1)c2ccccc2 4c7b39edf45fec512482ffce03a63c82 [0,1,0,1,0,0|1,0,0]=3 14854 B17R2.45544 O=C(OCOC1C=CCC1)c2ccccc2 819b49d36ab615a91de6b304db5bb06d [0,1,0,1,0,0|0,0,2]=4 14855 B17R2.45544 O=C(OCOC1CC=CC1)c2ccccc2 b6c8d2e227656677375e744b2d2c0521 [0,1,0,1,0,0|0,0,2]=4 14856 B17R2.45544 O=C(OCOC1CCCC1)c2ccccc2 beb893ab5b11a66b04347d91d555f6d7 [0,1,0,1,0,0|0,0,0]=2 14857 B17R2.45544 O=C(OCOC1CCCO1)c2ccccc2 4ecbd9df7108cf80263450b611095ac6 [0,1,0,1,0,0|1,0,0]=3 14858 B17R2.45544 O=C(OCOC1CCOC1)c2ccccc2 1828f7c18f72f0ed72e1713de04eb617 [0,1,0,1,0,0|1,0,0]=3 14859 B17R2.45544 O=C(OCOC1CCSC1)c2ccccc2 d5b21e39dceaba0ad831b30bbcd70c14 [0,1,0,1,0,0|1,0,0]=3 14860 B17R2.45544 O=C(OCO[C@@H]1CCOC1)c2ccccc2 5233c082ff7bd3b6cf182292867b6c04 [0,1,0,1,0,0|1,0,0]=3 14861 B17R2.45544 O=C(OCO[C@@H]1CCSC1)c2ccccc2 2fd72a32241b500f8e0443a939e2a8fe [0,1,0,1,0,0|1,0,0]=3 14862 B17R2.45544 O=C(OCO[C@H]1CCOC1)c2ccccc2 0050005a3402248ca35657289c0e1eed [0,1,0,1,0,0|1,0,0]=3 14863 B17R2.45544 O=C(OCO[C@H]1CCSC1)c2ccccc2 2e9a0204d872dd3e410e4c2d02073210 [0,1,0,1,0,0|1,0,0]=3 14864 B17R2.45544 O=S(CCOC1CCCC1)c2ccccc2 04c350a60eee94be57091ed1d0edb180 [0,1,0,1,0,0|2,0,0]=4 14865 B17R2.45544 O=S(CNCC1CCCC1)c2ccccc2 343fe0bb622acfc5f65aaba829a9a8ef [0,1,0,1,0,0|2,0,0]=4 14866 B17R2.45544 O=S(COCC1CCCC1)c2ccccc2 6bc662e78811011e24512e12410b14b3 [0,1,0,1,0,0|1,0,0]=3 14867 B17R2.59637 CCCCN1CCCC(=O)c2c1cccc2 793a59d940847f4912c23513a6d74a24 [0,1,0,1,0,0|1,0,0]=3 14868 B17R2.59637 CCCCN1CCNC(=O)c2c1cccc2 9fceaff4cb8a3f5102532ec751a05559 [0,1,0,1,0,0|1,0,0]=3 14869 B17R2.59637 CCCO[C@@H]1CCCC(=O)c2c1nccc2 cb860db8f7ddea8e221e47ac150113d0 [0,1,0,1,0,0|2,0,0]=4 14870 B17R2.59637 CCCO[C@H]1CCCC(=O)c2c1nccc2 c4ff70980bd39a6d5c99b7377d4bd8f0 [0,1,0,1,0,0|2,0,0]=4 14871 B17R2.59637 COCCN1CCCC(=O)c2c1cccc2 9612e5b3c967c5e7f130b075d91ffcc1 [0,1,0,1,0,0|2,0,0]=4 14872 B17R2.59637 COCCN1CCNC(=O)c2c1cccc2 3b779900f1861d52c9c6b8ac256bf525 [0,1,0,1,0,0|2,0,0]=4 14873 B17R2.59637 CSCCN1CCCC(=O)c2c1cccc2 a6ceb4c3bb403aca6be8c340559bb0ed [0,1,0,1,0,0|2,0,0]=4 14874 B17R2.59637 CSCCN1CCNC(=O)c2c1cccc2 80a0ba89a6a21ef67b6f6cf0ab36a7dc [0,1,0,1,0,0|2,0,0]=4 14875 B17R2.59637 O=C1CCCN(c2c1cccc2)CCCO 741ec17d962b80e95ec56e65d6fe3f46 [0,1,0,1,0,0|2,0,0]=4 14876 B17R2.59637 O=C1CCCN(c2c1cccc2)CCCS 01e6ebc809cbda2743bba42309ab4f3e [0,1,0,1,0,0|2,0,0]=4 14877 B17R2.59637 O=C1NCCN(c2c1cccc2)CCCF 642b226c1f2058facc59c64598a45a62 [0,1,0,1,0,0|2,0,0]=4 14878 B17R2.59637 O=C1NCCN(c2c1cccc2)CCCO 2d8b88162ed15e55893edcec4dfb4d1d [0,1,0,1,0,0|2,0,0]=4 14879 B17R2.59637 O=C1NCCN(c2c1cccc2)CCCS e883bd1665f7844311831291d01df9f8 [0,1,0,1,0,0|2,0,0]=4 14880 B17R2.435890 CCCCCCCOC1Cc2c1cccc2 f62577d35fd0be591867e0eb4b22a215 [0,1,0,1,0,0|1,0,1]=4 14881 B17R2.435890 CCCCCCOCC1Cc2c1cccc2 df691d9161eb82750dee2256b746c295 [0,1,0,1,0,0|1,0,1]=4 14882 B17R2.435890 CCCCOCCOC1Cc2c1cccc2 bdd0a0ecb45e013a328bb2fcd35e2cac [0,1,0,1,0,0|1,0,1]=4 14883 B17R2.435890 CCCOCCCOC1Cc2c1cccc2 b6c5b9456bab59d25f798763ab1c5781 [0,1,0,1,0,0|1,0,1]=4 14884 B17R2.435890 COCCCCCOC1Cc2c1cccc2 49a3f5b2d167a85e485cf33490544311 [0,1,0,1,0,0|1,0,1]=4 14885 B17R2.435890 FCCCCCCOC1Cc2c1cccc2 057da82de87def7515c8224716e69f21 [0,1,0,1,0,0|1,0,1]=4 14886 B17R2.192 CC(OC1CCCCC1)c2ccc(cc2)Br ec0520c06d02e9985d75af76363d7e89 [0,1,0,1,0,0|1,0,1]=4 14887 B17R2.192 CC(OC1CCCCC1)c2ccc(cc2)F fb2d7490a74c0668539eb40742cea4f2 [0,1,0,1,0,0|1,0,1]=4 14888 B17R2.192 Cc1ccc(cc1)C(=O)NC2CCCOC2 c07186b5efb2bb08496403664de8f55b [0,1,0,1,0,0|2,0,0]=4 14889 B17R2.192 Cc1ccc(cc1)C(=O)NC2CCOCC2 0c92aac04652dd5e8ec00d375c64f34f [0,1,0,1,0,0|2,0,0]=4 14890 B17R2.192 Cc1ccc(cc1)C(=O)NC2CCSCC2 b31a24f61137460c9a2a70612fc3db6b [0,1,0,1,0,0|2,0,0]=4 14891 B17R2.192 Cc1ccc(cc1)C(=O)N[C@@H]2CCCOC2 713e321ebb38f25e44ce3ebe4da9f964 [0,1,0,1,0,0|2,0,0]=4 14892 B17R2.192 Cc1ccc(cc1)C(=O)N[C@H]2CCCOC2 40e7f5b6e7c9b76542ffc7cb9b1e7dd5 [0,1,0,1,0,0|2,0,0]=4 14893 B17R2.192 O=C(NC1CCCOC1)c2ccc(cc2)Br 4b8987f3ecb516afc5575a00f01bce55 [0,1,0,1,0,0|2,0,0]=4 14894 B17R2.192 O=C(NC1CCCOC1)c2ccc(cc2)Cl 7c174e13dc318d56bb7aba2f1dbf1e17 [0,1,0,1,0,0|2,0,0]=4 14895 B17R2.192 O=C(NC1CCCOC1)c2ccc(cc2)F 4c36f97c5ca39e91b330bcf6e1f6c024 [0,1,0,1,0,0|2,0,0]=4 14896 B17R2.192 O=C(NC1CCCOC1)c2ccc(cc2)I 62c0409a8697f46494d0d53dbff217dd [0,1,0,1,0,0|2,0,0]=4 14897 B17R2.192 O=C(NC1CCCOC1)c2ccc(cc2)O 2d5ecd4f9578033901472f037dfc7b33 [0,1,0,1,0,0|2,0,0]=4 14898 B17R2.192 O=C(NC1CCCOC1)c2ccc(cc2)S f8978114db57a658bef018c614e43290 [0,1,0,1,0,0|2,0,0]=4 14899 B17R2.192 O=C(NC1CCOCC1)c2ccc(cc2)Br 8e69dc8b1f1798b5d1730ff80217a385 [0,1,0,1,0,0|2,0,0]=4 14900 B17R2.192 O=C(NC1CCOCC1)c2ccc(cc2)Cl 793719f7b24fd7943945b20632dc762f [0,1,0,1,0,0|2,0,0]=4 14901 B17R2.192 O=C(NC1CCOCC1)c2ccc(cc2)F 442f0b458f80f60c7da0e00b6f8edb6e [0,1,0,1,0,0|2,0,0]=4 14902 B17R2.192 O=C(NC1CCOCC1)c2ccc(cc2)I 2703d9ad36091ee8bd45a225a65b4a89 [0,1,0,1,0,0|2,0,0]=4 14903 B17R2.192 O=C(NC1CCOCC1)c2ccc(cc2)O 6a83896bbbac7a4277821c209ed13c3b [0,1,0,1,0,0|2,0,0]=4 14904 B17R2.192 O=C(NC1CCOCC1)c2ccc(cc2)S 1f7728e101174ee343f73a6056333a06 [0,1,0,1,0,0|2,0,0]=4 14905 B17R2.192 O=C(NC1CCSCC1)c2ccc(cc2)F 0296e1caeba9fa6dcad24df00f10d4eb [0,1,0,1,0,0|2,0,0]=4 14906 B17R2.192 O=C(NC1CCSCC1)c2ccc(cc2)I 9fca2a311da581cbdfd5fed3c37b2b0b [0,1,0,1,0,0|2,0,0]=4 14907 B17R2.192 O=C(NC1CCSCC1)c2ccc(cc2)O 988338637a88faf8e5907d93eb08229c [0,1,0,1,0,0|2,0,0]=4 14908 B17R2.192 O=C(NC1CCSCC1)c2ccc(cc2)S f4f6059c67cc34515070ed1c83aa079d [0,1,0,1,0,0|2,0,0]=4 14909 B17R2.192 O=C(N[C@@H]1CCCOC1)c2ccc(cc2)Br 9289f8822bad9adde11d70fc0c3c49e9 [0,1,0,1,0,0|2,0,0]=4 14910 B17R2.192 O=C(N[C@@H]1CCCOC1)c2ccc(cc2)Cl 98d4778c5143152240855a783c9ddfaa [0,1,0,1,0,0|2,0,0]=4 14911 B17R2.192 O=C(N[C@@H]1CCCOC1)c2ccc(cc2)F 2a7ad41c12f9d15d17539d1f21ffce17 [0,1,0,1,0,0|2,0,0]=4 14912 B17R2.192 O=C(N[C@@H]1CCCOC1)c2ccc(cc2)I 715fd17189e903ba54a189176597aceb [0,1,0,1,0,0|2,0,0]=4 14913 B17R2.192 O=C(N[C@@H]1CCCOC1)c2ccc(cc2)O 24c8835c033df3b42f30ffca0b38982d [0,1,0,1,0,0|2,0,0]=4 14914 B17R2.192 O=C(N[C@@H]1CCCOC1)c2ccc(cc2)S 241f2b6a375b3baeac0d5ef27a0ef998 [0,1,0,1,0,0|2,0,0]=4 14915 B17R2.192 O=C(N[C@H]1CCCOC1)c2ccc(cc2)Br 3d0c434f45e15bac5431fa6409a0d172 [0,1,0,1,0,0|2,0,0]=4 14916 B17R2.192 O=C(N[C@H]1CCCOC1)c2ccc(cc2)Cl 01fc9b5e1776efdc0194e28f2abd6c2d [0,1,0,1,0,0|2,0,0]=4 14917 B17R2.192 O=C(N[C@H]1CCCOC1)c2ccc(cc2)F fefeefb94b9173b534ede2fd89451490 [0,1,0,1,0,0|2,0,0]=4 14918 B17R2.192 O=C(N[C@H]1CCCOC1)c2ccc(cc2)I 8e8e24fdce79712e4ea77daa9cb16b44 [0,1,0,1,0,0|2,0,0]=4 14919 B17R2.192 O=C(N[C@H]1CCCOC1)c2ccc(cc2)O c7ad73a9c6e69fd290d301005c5148a2 [0,1,0,1,0,0|2,0,0]=4 14920 B17R2.192 O=C(N[C@H]1CCCOC1)c2ccc(cc2)S c6f34d7cff4f8542aea97ab3f22084e3 [0,1,0,1,0,0|2,0,0]=4 14921 B17R2.263 Cc1ccc(cc1)C(=O)NCC2CC2CO 8214b54b7b3bd6d57f58f613405de9c1 [0,1,0,1,0,0|2,0,0]=4 14922 B17R2.263 O=C(NCC1CC1CO)c2ccc(cc2)Br 63414fb4541a3a84ac5185117ac5a57d [0,1,0,1,0,0|2,0,0]=4 14923 B17R2.263 O=C(NCC1CC1CO)c2ccc(cc2)Cl d87e20a7e1d0c7d22b691946e2bd7c44 [0,1,0,1,0,0|2,0,0]=4 14924 B17R2.263 O=C(NCC1CC1CO)c2ccc(cc2)F ef50dd7e48ef824e068a6df93fd67299 [0,1,0,1,0,0|2,0,0]=4 14925 B17R2.263 O=C(NCC1CC1CO)c2ccc(cc2)I f5e33a3d201b3a62f02de82089ef90e4 [0,1,0,1,0,0|2,0,0]=4 14926 B17R2.263 O=C(NCC1CC1CO)c2ccc(cc2)O a9ce773fe16012d0852b675a058f8c83 [0,1,0,1,0,0|2,0,0]=4 14927 B17R2.263 O=C(NCC1CC1CO)c2ccc(cc2)S eb3d73637c04be1a69b9072fd029c01a [0,1,0,1,0,0|2,0,0]=4 14928 B17R2.378 CN1CCC1CNC(=O)c2ccc(cc2)Br b8a930fe77dae7ad99030b2b6f1affb2 [0,1,0,1,0,0|2,0,0]=4 14929 B17R2.378 CN1CCC1CNC(=O)c2ccc(cc2)Cl ec28e8317c155e61735e2c9216efecd3 [0,1,0,1,0,0|2,0,0]=4 14930 B17R2.378 CN1CCC1CNC(=O)c2ccc(cc2)F c0f60dda606f5dae9087f8f7c03a0c9a [0,1,0,1,0,0|2,0,0]=4 14931 B17R2.378 CN1CCC1CNC(=O)c2ccc(cc2)I 24746dd170635549c8d66a5715d3ed35 [0,1,0,1,0,0|2,0,0]=4 14932 B17R2.378 CN1CCC1CNC(=O)c2ccc(cc2)O f8f3bfa5825ac3a71f5db18285b460f8 [0,1,0,1,0,0|2,0,0]=4 14933 B17R2.378 CN1CCC1CNC(=O)c2ccc(cc2)S 70e64e28c27d56a925f741f979ee8ce5 [0,1,0,1,0,0|2,0,0]=4 14934 B17R2.378 C[C@@H]1CC[C@@H]1NCC(=O)c2ccc(cc2)Br 8336c7982121d44044e6f4f401419c07 [0,1,0,1,0,0|2,0,0]=4 14935 B17R2.378 C[C@@H]1CC[C@@H]1NCC(=O)c2ccc(cc2)Cl 0dc68303085be04ee2710e998fab29eb [0,1,0,1,0,0|2,0,0]=4 14936 B17R2.378 C[C@@H]1CC[C@@H]1NCC(=O)c2ccc(cc2)F 14ca02a58e956ba5b8e5171382dcc838 [0,1,0,1,0,0|2,0,0]=4 14937 B17R2.378 C[C@@H]1CC[C@@H]1NCC(=O)c2ccc(cc2)I 784572698fc9df5ab173907af7ce5c42 [0,1,0,1,0,0|2,0,0]=4 14938 B17R2.378 C[C@@H]1CC[C@H]1NCC(=O)c2ccc(cc2)Br c08cac46365a88978090b97405765ed8 [0,1,0,1,0,0|2,0,0]=4 14939 B17R2.378 C[C@@H]1CC[C@H]1NCC(=O)c2ccc(cc2)Cl 9a79b4f96728f0f9e80c0be8ceb1f823 [0,1,0,1,0,0|2,0,0]=4 14940 B17R2.378 C[C@@H]1CC[C@H]1NCC(=O)c2ccc(cc2)F 2be5f58811ef42893e64338967e54305 [0,1,0,1,0,0|2,0,0]=4 14941 B17R2.378 C[C@@H]1CC[C@H]1NCC(=O)c2ccc(cc2)I c7b8f3d95afd134f241eff8d6e35ff18 [0,1,0,1,0,0|2,0,0]=4 14942 B17R2.378 Cc1ccc(cc1)C(=O)CN[C@@H]2CC[C@H]2C 36364a6e1289dd23f183f0e563b9f3fe [0,1,0,1,0,0|2,0,0]=4 14943 B17R2.378 Cc1ccc(cc1)C(=O)CN[C@H]2CC[C@H]2C 86d630330d8a09ff5f0a33dce0677beb [0,1,0,1,0,0|2,0,0]=4 14944 B17R2.378 Cc1ccc(cc1)C(=O)NCC2CCN2C 78331200ac13c013a597cf224133bdbb [0,1,0,1,0,0|2,0,0]=4 14945 B17R2.381 CC1CCCCN1C(=O)c2cc[n+](cc2)[O-] 99198bf5ba623046e9a67c683f5e7b13 [0,1,0,1,0,0|2,0,0]=4 14946 B17R2.381 CC1CCCCN1C(=O)c2ccc(=O)oc2 125ac492417b9979059f4bd32793f294 [0,1,0,1,0,0|2,0,0]=4 14947 B17R2.381 CC1CCCCN1C(=O)c2ccc(cc2)Br 24604a40238ef98bf1bbec660b8bbcc0 [0,1,0,1,0,0|1,0,0]=3 14948 B17R2.381 CC1CCCCN1C(=O)c2ccc(cc2)Cl f4f0947c310e89c37f814336e8ba4069 [0,1,0,1,0,0|1,0,0]=3 14949 B17R2.381 CC1CCCCN1C(=O)c2ccc(cc2)F cbb49ff6dfb191a0e9be5131fca9322d [0,1,0,1,0,0|1,0,0]=3 14950 B17R2.381 CC1CCCCN1C(=O)c2ccc(cc2)I 29cda11c943f7f2698f2c3e7e928405e [0,1,0,1,0,0|1,0,0]=3 14951 B17R2.381 CC1CCCCN1C(=O)c2ccc(cc2)O c1f9db4bacc94f85d4b2286c40dd14ed [0,1,0,1,0,0|1,0,0]=3 14952 B17R2.381 CC1CCCCN1C(=O)c2ccc(cc2)S 0a56759d988e091d88dde635f034032d [0,1,0,1,0,0|1,0,0]=3 14953 B17R2.381 CC1CCCCN1C(=O)c2ccc(cn2)Br 368a69039918a5a6200c8d8b6bb0ed97 [0,1,0,1,0,0|2,0,0]=4 14954 B17R2.381 CC1CCCCN1C(=O)c2ccc(cn2)Cl 0c995950f9fe44c32111a77d006be1a6 [0,1,0,1,0,0|2,0,0]=4 14955 B17R2.381 CC1CCCCN1C(=O)c2ccc(cn2)F e53b12771036473463f75fc816b55d53 [0,1,0,1,0,0|2,0,0]=4 14956 B17R2.381 CC1CCCCN1C(=O)c2ccc(cn2)I eb77e1303b0418a66c128445bcea5012 [0,1,0,1,0,0|2,0,0]=4 14957 B17R2.381 CC1CCCCN1C(=O)c2ccc(cn2)O 9ed5397bc8ce4d4b691fbad128c9e4ee [0,1,0,1,0,0|2,0,0]=4 14958 B17R2.381 CC1CCCCN1C(=O)c2ccc(nc2)Br 9537e325fb7a340223a8d0818eacdc71 [0,1,0,1,0,0|2,0,0]=4 14959 B17R2.381 CC1CCCCN1C(=O)c2ccc(nc2)Cl 8b05e87b4e021a220de7d6ddacda1f22 [0,1,0,1,0,0|2,0,0]=4 14960 B17R2.381 CC1CCCCN1C(=O)c2ccc(nc2)F c7029abd116ef13e32377b7021dd004e [0,1,0,1,0,0|2,0,0]=4 14961 B17R2.381 CC1CCCCN1C(=O)c2ccc(nc2)I 7600c9de1bf7fb628879903ae5b06af9 [0,1,0,1,0,0|2,0,0]=4 14962 B17R2.381 CC1CCCCN1C(=O)c2ccc(nc2)O 2cba73cbd0c6ccf6094bad7db12ea60d [0,1,0,1,0,0|2,0,0]=4 14963 B17R2.381 CC1CCCCN1C(=O)c2ccc(nc2)S 616c660dd951a7a81f1e55211c92108e [0,1,0,1,0,0|2,0,0]=4 14964 B17R2.381 CC1COCCN1C(=O)c2ccc(cc2)Br 3d7e664c0dc3bfe99c53acacb4d8a47f [0,1,0,1,0,0|2,0,0]=4 14965 B17R2.381 CC1COCCN1C(=O)c2ccc(cc2)Cl e39465695de6c30bba2397a57f6b14c4 [0,1,0,1,0,0|2,0,0]=4 14966 B17R2.381 CC1COCCN1C(=O)c2ccc(cc2)F 2f67669ac8b7f986afa21cda784641bf [0,1,0,1,0,0|2,0,0]=4 14967 B17R2.381 CC1COCCN1C(=O)c2ccc(cc2)I 6f11362b9203eb4793364e76cdd3b042 [0,1,0,1,0,0|2,0,0]=4 14968 B17R2.381 CC1COCCN1C(=O)c2ccc(cc2)O eaed089eaca0d8db162f6371342b18f3 [0,1,0,1,0,0|2,0,0]=4 14969 B17R2.381 CC1COCCN1C(=O)c2ccc(cc2)S 5ac8c3cc03b02a9556582990d203fd62 [0,1,0,1,0,0|2,0,0]=4 14970 B17R2.381 C[C@@H]1CCCCN1C(=O)c2cc[n+](cc2)[O-] 86e5c7d630343211f9811ea7240736ea [0,1,0,1,0,0|2,0,0]=4 14971 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(=O)oc2 c1446949369a2744449654ceb885c5b7 [0,1,0,1,0,0|2,0,0]=4 14972 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cc2)Br 6d904fa634e8dd05f13c47a143ea8532 [0,1,0,1,0,0|1,0,0]=3 14973 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cc2)Cl 2993573d7d930592674c9a19cf7b4405 [0,1,0,1,0,0|1,0,0]=3 14974 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cc2)F e77e590bcc7560266e0003015acfb7ef [0,1,0,1,0,0|1,0,0]=3 14975 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cc2)I 7f3254eddd46e5995fdd72ae3843d9d5 [0,1,0,1,0,0|1,0,0]=3 14976 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cc2)O 74a1c9b3891a046f11309ff8b88dc2c5 [0,1,0,1,0,0|1,0,0]=3 14977 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cc2)S d4e391ba24015a873f653815554e0480 [0,1,0,1,0,0|1,0,0]=3 14978 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cn2)Br d889b3cb944782a2b7dc5138c34e6db9 [0,1,0,1,0,0|2,0,0]=4 14979 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cn2)Cl 19c60c2527d99799daa02caa407c173e [0,1,0,1,0,0|2,0,0]=4 14980 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cn2)F aa2ebe660a0d78cd831189cf2a001e33 [0,1,0,1,0,0|2,0,0]=4 14981 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cn2)I eacc211675ede1b98a47b45fd160c3ec [0,1,0,1,0,0|2,0,0]=4 14982 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(cn2)O d92feff01a3f2373a9f5f3cec6e45fa0 [0,1,0,1,0,0|2,0,0]=4 14983 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(nc2)Br 60775e48ec325b3258bbf10c486654c0 [0,1,0,1,0,0|2,0,0]=4 14984 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(nc2)Cl 50f5856975e123695dafa848e214b749 [0,1,0,1,0,0|2,0,0]=4 14985 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(nc2)F 41399867fb4b76ac9e2dca27d70f4866 [0,1,0,1,0,0|2,0,0]=4 14986 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(nc2)I 064eee747aed7ed16b3988601864cdfe [0,1,0,1,0,0|2,0,0]=4 14987 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(nc2)O 709a2931d3eef739b5641d0f5b25a10e [0,1,0,1,0,0|2,0,0]=4 14988 B17R2.381 C[C@@H]1CCCCN1C(=O)c2ccc(nc2)S eb52a3659d4070ea3236a03d33f4b127 [0,1,0,1,0,0|2,0,0]=4 14989 B17R2.381 C[C@@H]1COCCN1C(=O)c2ccc(cc2)Br 9a6b9ba77d9c382a8723e2a1a4fc0b2b [0,1,0,1,0,0|2,0,0]=4 14990 B17R2.381 C[C@@H]1COCCN1C(=O)c2ccc(cc2)Cl b73fce43561633d2c47b3435559d74b6 [0,1,0,1,0,0|2,0,0]=4 14991 B17R2.381 C[C@@H]1COCCN1C(=O)c2ccc(cc2)F 1720759a1208e6153118ce032d977e0a [0,1,0,1,0,0|2,0,0]=4 14992 B17R2.381 C[C@@H]1COCCN1C(=O)c2ccc(cc2)I 2406a740f7f384e43403b4be1556cb98 [0,1,0,1,0,0|2,0,0]=4 14993 B17R2.381 C[C@@H]1COCCN1C(=O)c2ccc(cc2)O 25fa3d995dac74e7ab84dc436745798f [0,1,0,1,0,0|2,0,0]=4 14994 B17R2.381 C[C@@H]1COCCN1C(=O)c2ccc(cc2)S a94c47e27085eb300dd08df3dc63df43 [0,1,0,1,0,0|2,0,0]=4 14995 B17R2.381 C[C@H]1CCCCN1C(=O)c2cc[n+](cc2)[O-] 208a8561110fd419f25e7fa559c573f2 [0,1,0,1,0,0|2,0,0]=4 14996 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(=O)oc2 bb064fcd4bb9c38303899d455e25ed0c [0,1,0,1,0,0|2,0,0]=4 14997 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cc2)Br b04f218820ac6bc39eb09ed88435b084 [0,1,0,1,0,0|1,0,0]=3 14998 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cc2)Cl 2a9f7e395088a6d05d4516f6fc50ade6 [0,1,0,1,0,0|1,0,0]=3 14999 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cc2)F 41138249209be42fb42d12e2c0134dd8 [0,1,0,1,0,0|1,0,0]=3 15000 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cc2)I 4363bdda540ac9ddd36c037d2c996929 [0,1,0,1,0,0|1,0,0]=3 15001 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cc2)O 95703e4dc07ea33948742d2d620a79eb [0,1,0,1,0,0|1,0,0]=3 15002 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cc2)S 73d59f46e8901acd91dff6f92e893de8 [0,1,0,1,0,0|1,0,0]=3 15003 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cn2)Br a847b2369295c076cc3a16cc685758b2 [0,1,0,1,0,0|2,0,0]=4 15004 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cn2)Cl d0686e64ed5ec1867eab8159655cc7fe [0,1,0,1,0,0|2,0,0]=4 15005 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cn2)F 008717e71de8273791d34a76e84e8918 [0,1,0,1,0,0|2,0,0]=4 15006 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cn2)I 3208ed00dd24c9f28e5bee52293218a3 [0,1,0,1,0,0|2,0,0]=4 15007 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(cn2)O dbd0723fc99219e46f29cbc82624007c [0,1,0,1,0,0|2,0,0]=4 15008 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(nc2)Br a1cf401a28318ff7af1dd25dcc2eec6c [0,1,0,1,0,0|2,0,0]=4 15009 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(nc2)Cl fe5cbf6e2901478fd10d43320721d282 [0,1,0,1,0,0|2,0,0]=4 15010 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(nc2)F df6c84c7bf89381d0d2c30cac2372adf [0,1,0,1,0,0|2,0,0]=4 15011 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(nc2)I cc886314f065c1ae6b47a7092897d419 [0,1,0,1,0,0|2,0,0]=4 15012 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(nc2)O df047aebebfc702b6dfdaeabdb4a2def [0,1,0,1,0,0|2,0,0]=4 15013 B17R2.381 C[C@H]1CCCCN1C(=O)c2ccc(nc2)S d64e9e28a377992d2c02cb03218c6752 [0,1,0,1,0,0|2,0,0]=4 15014 B17R2.381 C[C@H]1COCCN1C(=O)c2ccc(cc2)Br c7371946cf81cfe5a135706e3511c7e3 [0,1,0,1,0,0|2,0,0]=4 15015 B17R2.381 C[C@H]1COCCN1C(=O)c2ccc(cc2)Cl 3ee4f73cd3f66576ee958a49f796bfdd [0,1,0,1,0,0|2,0,0]=4 15016 B17R2.381 C[C@H]1COCCN1C(=O)c2ccc(cc2)F c8f7ff7afc4491c8c4efe7ef9bd37903 [0,1,0,1,0,0|2,0,0]=4 15017 B17R2.381 C[C@H]1COCCN1C(=O)c2ccc(cc2)I 51be193bf4f8a8928b19a1a05444a913 [0,1,0,1,0,0|2,0,0]=4 15018 B17R2.381 C[C@H]1COCCN1C(=O)c2ccc(cc2)O 5cb7f73a1f3dbffc7b4bb54cc5b52f1f [0,1,0,1,0,0|2,0,0]=4 15019 B17R2.381 C[C@H]1COCCN1C(=O)c2ccc(cc2)S a4284a40ce39f85b992b129f2d47dcbf [0,1,0,1,0,0|2,0,0]=4 15020 B17R2.381 Cc1ccc(cc1)C(=O)N2CCCCC2C 99cff450462b6e89b04bca1b41bd92d5 [0,1,0,1,0,0|1,0,0]=3 15021 B17R2.381 Cc1ccc(cc1)C(=O)N2CCCC[C@@H]2C 6b07c4e4b0038a1ca730d6e71d53bf55 [0,1,0,1,0,0|1,0,0]=3 15022 B17R2.381 Cc1ccc(cc1)C(=O)N2CCCC[C@H]2C 991e52b4a1acb8a48419396d28d9b265 [0,1,0,1,0,0|1,0,0]=3 15023 B17R2.381 Cc1ccc(cc1)C(=O)N2CCOCC2C 3cdf30b2f74faf36e08d6e80d60a5165 [0,1,0,1,0,0|2,0,0]=4 15024 B17R2.381 Cc1ccc(cc1)C(=O)N2CCOC[C@@H]2C 14b148a9248267f1933635adf49cb0e8 [0,1,0,1,0,0|2,0,0]=4 15025 B17R2.381 Cc1ccc(cc1)C(=O)N2CCOC[C@H]2C 022840b88219daca918be2f252126f4b [0,1,0,1,0,0|2,0,0]=4 15026 B17R2.381 Cc1ccc(cn1)C(=O)N2CCCCC2C d15dfd244b048445c56a426de2386f95 [0,1,0,1,0,0|2,0,0]=4 15027 B17R2.381 Cc1ccc(cn1)C(=O)N2CCCC[C@@H]2C bd48421a606972dd38d2aa906824e367 [0,1,0,1,0,0|2,0,0]=4 15028 B17R2.381 Cc1ccc(cn1)C(=O)N2CCCC[C@H]2C c786724ef3539ce03c8304c73b734452 [0,1,0,1,0,0|2,0,0]=4 15029 B17R2.381 Cc1ccc(nc1)C(=O)N2CCCCC2C 73e0e20817b6c7255097de6a7312cdd9 [0,1,0,1,0,0|2,0,0]=4 15030 B17R2.381 Cc1ccc(nc1)C(=O)N2CCCC[C@@H]2C eaf119df855ee9a381f662ec77cf0d95 [0,1,0,1,0,0|2,0,0]=4 15031 B17R2.381 Cc1ccc(nc1)C(=O)N2CCCC[C@H]2C 7697764ee667d4abcea17d0a1bfb69dd [0,1,0,1,0,0|2,0,0]=4 15032 B17R2.382 CC1CC1COCC(=O)c2ccc(cc2)Br 5d4f9838035c6d00c1464f55550dd75a [0,1,0,1,0,0|2,0,0]=4 15033 B17R2.382 CC1CC1COCC(=O)c2ccc(cc2)Cl 5ea6e6166cafaaca9ede7e711fc91fbd [0,1,0,1,0,0|2,0,0]=4 15034 B17R2.382 CC1CC1COCC(=O)c2ccc(cc2)F 2f222b6d244c89f6843100a67082cbc0 [0,1,0,1,0,0|2,0,0]=4 15035 B17R2.382 CC1CC1COCC(=O)c2ccc(cc2)I 48a0fc300e8eb70b6f2e8d3b7e37b1e3 [0,1,0,1,0,0|2,0,0]=4 15036 B17R2.382 CC1CC1NCCC(=O)c2ccc(cc2)Br 693284047ceed5b70d199b5b57fdd8f8 [0,1,0,1,0,0|2,0,0]=4 15037 B17R2.382 CC1CC1NCCC(=O)c2ccc(cc2)F a437f5697591bef1b86a58ebf4ba4cd8 [0,1,0,1,0,0|2,0,0]=4 15038 B17R2.382 CC1CC1NCOC(=O)c2ccc(cc2)F 41387567f1be1be4d1c9eda6f7d5bf9d [0,1,0,1,0,0|1,0,0]=3 15039 B17R2.382 C[C@@H]1C[C@H]1COCC(=O)c2ccc(cc2)Br 217af85b93860ce5eae7eb2647345d2c [0,1,0,1,0,0|2,0,0]=4 15040 B17R2.382 C[C@@H]1C[C@H]1COCC(=O)c2ccc(cc2)Cl f8f65318dde6841d0c66753f2a88aefd [0,1,0,1,0,0|2,0,0]=4 15041 B17R2.382 C[C@@H]1C[C@H]1COCC(=O)c2ccc(cc2)F f7070df7aa50f50ce08049b67010ae22 [0,1,0,1,0,0|2,0,0]=4 15042 B17R2.382 C[C@@H]1C[C@H]1COCC(=O)c2ccc(cc2)I ca28c7992cb47c961f7fb98d4fe4d1ce [0,1,0,1,0,0|2,0,0]=4 15043 B17R2.382 C[C@H]1C[C@@H]1COCC(=O)c2ccc(cc2)Br cc95837eac20eea41d4afb366af35ca2 [0,1,0,1,0,0|2,0,0]=4 15044 B17R2.382 C[C@H]1C[C@@H]1COCC(=O)c2ccc(cc2)Cl 1b7a1f81a9c18c9bb59b18bd551e799f [0,1,0,1,0,0|2,0,0]=4 15045 B17R2.382 C[C@H]1C[C@@H]1COCC(=O)c2ccc(cc2)F 10ae7df5729bd711624afef4a414ee6f [0,1,0,1,0,0|2,0,0]=4 15046 B17R2.382 C[C@H]1C[C@@H]1COCC(=O)c2ccc(cc2)I a4ad01e7c37622914cf4f2458fbf92c5 [0,1,0,1,0,0|2,0,0]=4 15047 B17R2.382 C[C@H]1C[C@H]1COCC(=O)c2ccc(cc2)Br c1bad15400b4ff365228bc6044d207d0 [0,1,0,1,0,0|2,0,0]=4 15048 B17R2.382 C[C@H]1C[C@H]1COCC(=O)c2ccc(cc2)Cl 5e1f5786d1f6346774e2018e50ed0fb5 [0,1,0,1,0,0|2,0,0]=4 15049 B17R2.382 C[C@H]1C[C@H]1COCC(=O)c2ccc(cc2)F ab2b9eb7068b8bfc471c6227df3d2c87 [0,1,0,1,0,0|2,0,0]=4 15050 B17R2.382 C[C@H]1C[C@H]1COCC(=O)c2ccc(cc2)I ff17ce883aa9e1e486df0ca6ee7022c2 [0,1,0,1,0,0|2,0,0]=4 15051 B17R2.382 Cc1ccc(cc1)C(=O)CCNC2CC2C ac16e12a677ac6054585d1523ffc3a23 [0,1,0,1,0,0|2,0,0]=4 15052 B17R2.382 Cc1ccc(cc1)C(=O)COCC2CC2C d47ebc42fdc2baf5762b4ce6365a2c05 [0,1,0,1,0,0|2,0,0]=4 15053 B17R2.382 Cc1ccc(cc1)C(=O)COC[C@@H]2C[C@@H]2C 2ef66eb3f2a70a86fc1cd5fbe5e6d5d8 [0,1,0,1,0,0|2,0,0]=4 15054 B17R2.382 Cc1ccc(cc1)C(=O)COC[C@@H]2C[C@H]2C 015577147cb163154dab1b4f3b30bcfc [0,1,0,1,0,0|2,0,0]=4 15055 B17R2.382 Cc1ccc(cc1)C(=O)COC[C@H]2C[C@@H]2C 3195047cb2679546521f7542389fc43e [0,1,0,1,0,0|2,0,0]=4 15056 B17R2.382 O=C(OCN[C@@H]1C[C@H]1F)c2ccc(cc2)F 25d642da318a489743e928e85552ccd2 [0,1,0,1,0,0|2,0,0]=4 15057 B17R2.382 O=C(OCN[C@H]1C[C@@H]1F)c2ccc(cc2)F 51512981a71b656dd859a157fa4e3513 [0,1,0,1,0,0|2,0,0]=4 15058 B17R2.382 O=C(OCN[C@H]1C[C@H]1F)c2ccc(cc2)F 8af8be1bc80396fe1a8426ca67508d65 [0,1,0,1,0,0|2,0,0]=4 15059 B17R2.384 CC(OC1CCCC1C)c2ccc(cc2)Br 27729500724d0fe4d4570ac5e3eba7e3 [0,1,0,1,0,0|1,0,1]=4 15060 B17R2.384 CC(OC1CCCC1C)c2ccc(cc2)F 8382bfe062d87dad37a96f66120f608c [0,1,0,1,0,0|1,0,1]=4 15061 B17R2.384 CC(O[C@@H]1CCC[C@@H]1C)c2ccc(cc2)Br c1b556d9c04903c280e0c3a2b6497227 [0,1,0,1,0,0|1,0,1]=4 15062 B17R2.384 CC(O[C@@H]1CCC[C@@H]1C)c2ccc(cc2)F 78665056294e919866e459f39007e4c2 [0,1,0,1,0,0|1,0,1]=4 15063 B17R2.384 CC(O[C@@H]1CCC[C@H]1C)c2ccc(cc2)Br 79e01dcee7e2dcc7174599efdb45fa24 [0,1,0,1,0,0|1,0,1]=4 15064 B17R2.384 CC(O[C@@H]1CCC[C@H]1C)c2ccc(cc2)F 9519590e0330b95cb1e06b0418a8db6b [0,1,0,1,0,0|1,0,1]=4 15065 B17R2.384 CC(O[C@H]1CCC[C@@H]1C)c2ccc(cc2)Br e282854066cebb67763f4b61cefba7b4 [0,1,0,1,0,0|1,0,1]=4 15066 B17R2.384 CC(O[C@H]1CCC[C@@H]1C)c2ccc(cc2)F b766c4bc39e46131fd55274fe4c34752 [0,1,0,1,0,0|1,0,1]=4 15067 B17R2.384 CC(O[C@H]1CCC[C@H]1C)c2ccc(cc2)Br d23c3d9c9681030bd1f2054a8f6092b7 [0,1,0,1,0,0|1,0,1]=4 15068 B17R2.384 CC(O[C@H]1CCC[C@H]1C)c2ccc(cc2)F 2223e72747833ab9a550d486ecbde208 [0,1,0,1,0,0|1,0,1]=4 15069 B17R2.384 CC1CCCN1CC(=O)c2ccc(cc2)Br c28d7f66921153adeb7de3292b724453 [0,1,0,1,0,0|2,0,0]=4 15070 B17R2.384 CC1CCCN1CC(=O)c2ccc(cc2)Cl def202567c0243fdfb53dc1d746adeed [0,1,0,1,0,0|2,0,0]=4 15071 B17R2.384 CC1CCCN1CC(=O)c2ccc(cc2)F 78a621d8578e2284eb904a2cbcd0e414 [0,1,0,1,0,0|2,0,0]=4 15072 B17R2.384 CC1CCCN1CC(=O)c2ccc(cc2)I c766654c7bd0da5c9bdc2b88d205d86d [0,1,0,1,0,0|2,0,0]=4 15073 B17R2.384 C[C@@H]1CCCN1CC(=O)c2ccc(cc2)Br 035dae45527ccee93d23d55495d21159 [0,1,0,1,0,0|2,0,0]=4 15074 B17R2.384 C[C@@H]1CCCN1CC(=O)c2ccc(cc2)Cl d4e2ef883fac605f0f546e457e9a9187 [0,1,0,1,0,0|2,0,0]=4 15075 B17R2.384 C[C@@H]1CCCN1CC(=O)c2ccc(cc2)F d2b72cb0d6dc800d25820394991e306b [0,1,0,1,0,0|2,0,0]=4 15076 B17R2.384 C[C@@H]1CCCN1CC(=O)c2ccc(cc2)I 3d41bde0a19bed75e1d6b74c973e99ac [0,1,0,1,0,0|2,0,0]=4 15077 B17R2.384 C[C@H]1CCCN1CC(=O)c2ccc(cc2)Br 1391277e6e564b041b4a57741836d15e [0,1,0,1,0,0|2,0,0]=4 15078 B17R2.384 C[C@H]1CCCN1CC(=O)c2ccc(cc2)Cl 3ce8d82a9de8361a4ae3c5a75c055c69 [0,1,0,1,0,0|2,0,0]=4 15079 B17R2.384 C[C@H]1CCCN1CC(=O)c2ccc(cc2)F b4d4539891f0797949a4a7740081dc9b [0,1,0,1,0,0|2,0,0]=4 15080 B17R2.384 C[C@H]1CCCN1CC(=O)c2ccc(cc2)I f5fae7a91fa4871542de612f9c55780f [0,1,0,1,0,0|2,0,0]=4 15081 B17R2.384 Cc1ccc(cc1)C(=O)CN2CCCC2C c7c482d01f703dc124586f3e91654d29 [0,1,0,1,0,0|2,0,0]=4 15082 B17R2.384 Cc1ccc(cc1)C(=O)CN2CCC[C@@H]2C c1f551dc24aa6c513c15c07476cfe969 [0,1,0,1,0,0|2,0,0]=4 15083 B17R2.384 Cc1ccc(cc1)C(=O)CN2CCC[C@H]2C 8c792d0292c475344ae23435628808df [0,1,0,1,0,0|2,0,0]=4 15084 B17R2.384 Cc1ccc(cc1)C(=O)NC2CCCC2O 6056e85c07e933c3d7a03112d7a71b7d [0,1,0,1,0,0|2,0,0]=4 15085 B17R2.384 Cc1ccc(cc1)C(=O)N[C@@H]2CCC[C@@H]2O 52cbb12d9e9e6b4cabfd11dc60c88049 [0,1,0,1,0,0|2,0,0]=4 15086 B17R2.384 Cc1ccc(cc1)C(=O)N[C@@H]2CCC[C@H]2O 75c0f67b5449cce88d1a05a0464f61a0 [0,1,0,1,0,0|2,0,0]=4 15087 B17R2.384 Cc1ccc(cc1)C(=O)N[C@H]2CCC[C@@H]2O a2ded778c440551dda74f2de1239d19f [0,1,0,1,0,0|2,0,0]=4 15088 B17R2.384 Cc1ccc(cc1)C(=O)N[C@H]2CCC[C@H]2O 9d8b047b8e003ea881703ae171e58dd2 [0,1,0,1,0,0|2,0,0]=4 15089 B17R2.384 Cc1ccc(cc1)C(C)OC2CCCC2C dc497eebf7a1f254df314faf6190c110 [0,1,0,1,0,0|1,0,1]=4 15090 B17R2.384 Cc1ccc(cc1)C(C)O[C@@H]2CCC[C@@H]2C 57c7cee483fd42b2af5548fec9075d1a [0,1,0,1,0,0|1,0,1]=4 15091 B17R2.384 Cc1ccc(cc1)C(C)O[C@@H]2CCC[C@H]2C ec2b0da58270f30e3ac4a92695fcec6e [0,1,0,1,0,0|1,0,1]=4 15092 B17R2.384 Cc1ccc(cc1)C(C)O[C@H]2CCC[C@@H]2C d2d06569aff14d76e52d23f4b9f27ad4 [0,1,0,1,0,0|1,0,1]=4 15093 B17R2.384 Cc1ccc(cc1)C(C)O[C@H]2CCC[C@H]2C 04f20d90cd551dbff08a2ddffa366ab4 [0,1,0,1,0,0|1,0,1]=4 15094 B17R2.384 O=C(NC1CCCC1O)c2ccc(cc2)Br ec9b70d60f3daa8f1ae7ce7c63248046 [0,1,0,1,0,0|2,0,0]=4 15095 B17R2.384 O=C(NC1CCCC1O)c2ccc(cc2)Cl 03551cf05bd9ff4c1a03f0a0c73ec205 [0,1,0,1,0,0|2,0,0]=4 15096 B17R2.384 O=C(NC1CCCC1O)c2ccc(cc2)F 4cfcb3ef3b1c081fb8e9fa0fdbf9fa8a [0,1,0,1,0,0|2,0,0]=4 15097 B17R2.384 O=C(NC1CCCC1O)c2ccc(cc2)I 5e7eb3fa7a2b033f4e2c15328f0812f4 [0,1,0,1,0,0|2,0,0]=4 15098 B17R2.384 O=C(NC1CCCC1O)c2ccc(cc2)O c19fe31c91a047d5d4ff49c82f51c8b4 [0,1,0,1,0,0|2,0,0]=4 15099 B17R2.384 O=C(NC1CCCC1O)c2ccc(cc2)S 2cbbccde84cac80c82f59d3062a2acef [0,1,0,1,0,0|2,0,0]=4 15100 B17R2.384 O=C(N[C@@H]1CCC[C@@H]1O)c2ccc(cc2)Br a4a9ab1fdf30a7d3e254ee269b5f8503 [0,1,0,1,0,0|2,0,0]=4 15101 B17R2.384 O=C(N[C@@H]1CCC[C@@H]1O)c2ccc(cc2)Cl 50f278f559059d13a86bd5aeae035d06 [0,1,0,1,0,0|2,0,0]=4 15102 B17R2.384 O=C(N[C@@H]1CCC[C@@H]1O)c2ccc(cc2)F 0d7ec4040c9805c9e7fbf60a83205ee2 [0,1,0,1,0,0|2,0,0]=4 15103 B17R2.384 O=C(N[C@@H]1CCC[C@@H]1O)c2ccc(cc2)I d86bb322f91f056a0aea81ce80b9e055 [0,1,0,1,0,0|2,0,0]=4 15104 B17R2.384 O=C(N[C@@H]1CCC[C@@H]1O)c2ccc(cc2)O 6646db44790db2279de3112943df22f1 [0,1,0,1,0,0|2,0,0]=4 15105 B17R2.384 O=C(N[C@@H]1CCC[C@@H]1O)c2ccc(cc2)S 3f9f92c5c63d6a0740412eec2d235ca1 [0,1,0,1,0,0|2,0,0]=4 15106 B17R2.384 O=C(N[C@@H]1CCC[C@H]1O)c2ccc(cc2)Br c66e5991864e72f871f43b0ddb433a22 [0,1,0,1,0,0|2,0,0]=4 15107 B17R2.384 O=C(N[C@@H]1CCC[C@H]1O)c2ccc(cc2)Cl a730fbc2fcee2804a7c48278c91d3edb [0,1,0,1,0,0|2,0,0]=4 15108 B17R2.384 O=C(N[C@@H]1CCC[C@H]1O)c2ccc(cc2)F 195c7d31ed34ab1740e83b1065160cf8 [0,1,0,1,0,0|2,0,0]=4 15109 B17R2.384 O=C(N[C@@H]1CCC[C@H]1O)c2ccc(cc2)I a54a7cac6a42c3afb4dcb5db20c7c94f [0,1,0,1,0,0|2,0,0]=4 15110 B17R2.384 O=C(N[C@@H]1CCC[C@H]1O)c2ccc(cc2)O 4ce51c54b16e20aaa71e792382a311c1 [0,1,0,1,0,0|2,0,0]=4 15111 B17R2.384 O=C(N[C@@H]1CCC[C@H]1O)c2ccc(cc2)S 27107798d6caf96375ec6d31fb6fbaec [0,1,0,1,0,0|2,0,0]=4 15112 B17R2.384 O=C(N[C@H]1CCC[C@@H]1O)c2ccc(cc2)Br e5ac477bc9177b4e20de0acc5e5cb198 [0,1,0,1,0,0|2,0,0]=4 15113 B17R2.384 O=C(N[C@H]1CCC[C@@H]1O)c2ccc(cc2)Cl 2672ed69acd7677e4fe265aefa050a02 [0,1,0,1,0,0|2,0,0]=4 15114 B17R2.384 O=C(N[C@H]1CCC[C@@H]1O)c2ccc(cc2)F cc3747718b8666e64923f2a232c4eafa [0,1,0,1,0,0|2,0,0]=4 15115 B17R2.384 O=C(N[C@H]1CCC[C@@H]1O)c2ccc(cc2)I 3189da8dc048dd05e4025238694d278c [0,1,0,1,0,0|2,0,0]=4 15116 B17R2.384 O=C(N[C@H]1CCC[C@@H]1O)c2ccc(cc2)O ad54ebdc8aa68ad9f340fbefc6ff3594 [0,1,0,1,0,0|2,0,0]=4 15117 B17R2.384 O=C(N[C@H]1CCC[C@@H]1O)c2ccc(cc2)S e950f11a1490c756e547ec212f49e7b8 [0,1,0,1,0,0|2,0,0]=4 15118 B17R2.384 O=C(N[C@H]1CCC[C@H]1O)c2ccc(cc2)Br cfdd127f4c6756565cf53c43f754dfd2 [0,1,0,1,0,0|2,0,0]=4 15119 B17R2.384 O=C(N[C@H]1CCC[C@H]1O)c2ccc(cc2)Cl f00e6dc1122f5647b2793b8859c2bd4f [0,1,0,1,0,0|2,0,0]=4 15120 B17R2.384 O=C(N[C@H]1CCC[C@H]1O)c2ccc(cc2)F 5a89632c27d7fe98f47a36f15e7d9295 [0,1,0,1,0,0|2,0,0]=4 15121 B17R2.384 O=C(N[C@H]1CCC[C@H]1O)c2ccc(cc2)I 7e053ff97bfc2766429d0ee0d337d487 [0,1,0,1,0,0|2,0,0]=4 15122 B17R2.384 O=C(N[C@H]1CCC[C@H]1O)c2ccc(cc2)O f2b61ae25358b99ea45ec17dbb43e7a6 [0,1,0,1,0,0|2,0,0]=4 15123 B17R2.384 O=C(N[C@H]1CCC[C@H]1O)c2ccc(cc2)S d8e9d963bfe7a90467795b118d2092ca [0,1,0,1,0,0|2,0,0]=4 15124 B17R2.1135 CCC1CCN1CC(=O)c2ccc(cc2)Br d85716ea869a3fb78ac8cc5957efd756 [0,1,0,1,0,0|2,0,0]=4 15125 B17R2.1135 CCC1CCN1CC(=O)c2ccc(cc2)C 22a336125e306f3e54261b2141d24d0e [0,1,0,1,0,0|2,0,0]=4 15126 B17R2.1135 CCC1CCN1CC(=O)c2ccc(cc2)Cl bb4ee7df8ca18af5537bfa8074679778 [0,1,0,1,0,0|2,0,0]=4 15127 B17R2.1135 CCC1CCN1CC(=O)c2ccc(cc2)F 048667c5770fbe430760f77b35b05deb [0,1,0,1,0,0|2,0,0]=4 15128 B17R2.1135 CCC1CCN1CC(=O)c2ccc(cc2)I 2868f6521d54bee8bc51f65f49ed108d [0,1,0,1,0,0|2,0,0]=4 15129 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)Br 73cbf659ca9edb04fa3280fd191c7c77 [0,1,0,1,0,0|2,0,0]=4 15130 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)C f47a23317f2b34699487d9022b87fe91 [0,1,0,1,0,0|2,0,0]=4 15131 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)Cl 8aa856640cc8c9c0ba41cb5f4685b65f [0,1,0,1,0,0|2,0,0]=4 15132 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)F 7a34dbc00106a612aa025d88efd7a561 [0,1,0,1,0,0|2,0,0]=4 15133 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)I b1613793a49a97950111f4aab457e28e [0,1,0,1,0,0|2,0,0]=4 15134 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)O 35128efba8719ea033fceb0835c16530 [0,1,0,1,0,0|2,0,0]=4 15135 B17R2.1135 COC1CCC1NC(=O)c2ccc(cc2)S 4fcede94048df0bcd27041ead0b15690 [0,1,0,1,0,0|2,0,0]=4 15136 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)Br b6eb439d781d79515f52f1063597ac41 [0,1,0,1,0,0|2,0,0]=4 15137 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)C b3907ffae9f98d220c71f670ccae1733 [0,1,0,1,0,0|2,0,0]=4 15138 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)Cl 370d08cb39075327ed79d8c88c9efaed [0,1,0,1,0,0|2,0,0]=4 15139 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)F d6493a4fb90298d45c9977274232ebe6 [0,1,0,1,0,0|2,0,0]=4 15140 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)I 76947cee97ec6c92da034dda37cca47f [0,1,0,1,0,0|2,0,0]=4 15141 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)O 492f0b479ebea6de2950276c606b725e [0,1,0,1,0,0|2,0,0]=4 15142 B17R2.1135 CO[C@@H]1CC[C@@H]1NC(=O)c2ccc(cc2)S 936a7463748326e1243e01fad63f1a00 [0,1,0,1,0,0|2,0,0]=4 15143 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)Br 0b88c87b96610b2577d2bd07772e271c [0,1,0,1,0,0|2,0,0]=4 15144 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)C 76743c36a616cfea6479c6a02dcb2902 [0,1,0,1,0,0|2,0,0]=4 15145 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)Cl c92ac38dbbdb2ff9a8237fd5b486e04d [0,1,0,1,0,0|2,0,0]=4 15146 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)F d3cb143a6bf4f9608ac58b18b5e7778b [0,1,0,1,0,0|2,0,0]=4 15147 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)I 24b9953e5389aedb46870463f09f722c [0,1,0,1,0,0|2,0,0]=4 15148 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)O d64d624d30699ee9b04ddf9a92ce6ec4 [0,1,0,1,0,0|2,0,0]=4 15149 B17R2.1135 CO[C@@H]1CC[C@H]1NC(=O)c2ccc(cc2)S aa13806e5c0f96ed77ac65e0bec5c04f [0,1,0,1,0,0|2,0,0]=4 15150 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)Br 945d9637dcbdbc096277fbf7391cfefb [0,1,0,1,0,0|2,0,0]=4 15151 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)C 4125566b7a7b27514cba8dc3fd74ba93 [0,1,0,1,0,0|2,0,0]=4 15152 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)Cl d8891a88497b7adffe4b4f7860f85bda [0,1,0,1,0,0|2,0,0]=4 15153 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)F 73af41dc1f656da634fb7ba8fa22e0a8 [0,1,0,1,0,0|2,0,0]=4 15154 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)I b7fd6ba36c0a3373a4b8a71e61bb4a4f [0,1,0,1,0,0|2,0,0]=4 15155 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)O 2a1ee14ded6ca1784afaf8b246d9ca81 [0,1,0,1,0,0|2,0,0]=4 15156 B17R2.1135 CO[C@H]1CC[C@@H]1NC(=O)c2ccc(cc2)S b324ab823a25ddc557fc32d472543913 [0,1,0,1,0,0|2,0,0]=4 15157 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)Br 699d84713fc1d87d69c4411fe094d51c [0,1,0,1,0,0|2,0,0]=4 15158 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)C 4d68fa05eb67062de128116ea78e20da [0,1,0,1,0,0|2,0,0]=4 15159 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)Cl c09ee4061da44b59cc9310b45c2fc0c3 [0,1,0,1,0,0|2,0,0]=4 15160 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)F 422973784df56dc4727a4eb5e457790c [0,1,0,1,0,0|2,0,0]=4 15161 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)I 7a447d763656125f39d11f138f8305cc [0,1,0,1,0,0|2,0,0]=4 15162 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)O 4a9be247fdc779fbfc95e9a52f13e115 [0,1,0,1,0,0|2,0,0]=4 15163 B17R2.1135 CO[C@H]1CC[C@H]1NC(=O)c2ccc(cc2)S 58fd54ff14bebeb20a9603ddcf4473dc [0,1,0,1,0,0|2,0,0]=4 15164 B17R2.3190 CCC1CCCN1C(=O)c2cc[n+](cc2)[O-] a60ba291513cbb8c6bfdc3ac766c71c8 [0,1,0,1,0,0|2,0,0]=4 15165 B17R2.3190 CCC1CCCN1C(=O)c2ccc(=O)oc2 330d141b7f46d68aeffb6f351f8558a1 [0,1,0,1,0,0|2,0,0]=4 15166 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)Br 4f49cd4aadc07c0d94eeff9978bda759 [0,1,0,1,0,0|1,0,0]=3 15167 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)C 0ea874619f403950bf3a04fb2fa23e41 [0,1,0,1,0,0|1,0,0]=3 15168 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)Cl 8ea879378b3da55174645d6cf62f7b59 [0,1,0,1,0,0|1,0,0]=3 15169 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)F d70792c518c0ff532c559fa7508acbad [0,1,0,1,0,0|1,0,0]=3 15170 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)I 0f8a4687ec9909169b1a6f68a7ca928d [0,1,0,1,0,0|1,0,0]=3 15171 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)O f02879ef16be440c32339d445cff5030 [0,1,0,1,0,0|1,0,0]=3 15172 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cc2)S 83f8ca5eb0cc5113e7122d408cc415d4 [0,1,0,1,0,0|1,0,0]=3 15173 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cn2)Br aa6dfa5b4131d0ef83abbba7b488716f [0,1,0,1,0,0|2,0,0]=4 15174 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cn2)C c39880f686fe8a23c0cd79404b2c55ed [0,1,0,1,0,0|2,0,0]=4 15175 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cn2)Cl 0253ba3f6ec54afde983ea44647f20ae [0,1,0,1,0,0|2,0,0]=4 15176 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cn2)F 3a70d9ce4d0e689330b49bc79cacecd1 [0,1,0,1,0,0|2,0,0]=4 15177 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cn2)I 8a51009620d1fd3b1b0f3cd6ad4be782 [0,1,0,1,0,0|2,0,0]=4 15178 B17R2.3190 CCC1CCCN1C(=O)c2ccc(cn2)O d63ede2a266b682ded07083bb547d19a [0,1,0,1,0,0|2,0,0]=4 15179 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)Br 0c009c55deba2c435bbc18392824d900 [0,1,0,1,0,0|2,0,0]=4 15180 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)C 01df4145d183fc0540b112c9fa2ae798 [0,1,0,1,0,0|2,0,0]=4 15181 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)Cl 98e7d7ca6cc9083c77e3bd628e060cc4 [0,1,0,1,0,0|2,0,0]=4 15182 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)F 6bc0e6819c331b16f1abc9c01a37e41f [0,1,0,1,0,0|2,0,0]=4 15183 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)I ded2ca1e7f847168123ef7b72b9a4743 [0,1,0,1,0,0|2,0,0]=4 15184 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)O 7e082a7b8c6c14fca1fa5e48b552bbcc [0,1,0,1,0,0|2,0,0]=4 15185 B17R2.3190 CCC1CCCN1C(=O)c2ccc(nc2)S 05e64dfc6fd574ff8e2a46944d83fabc [0,1,0,1,0,0|2,0,0]=4 15186 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2cc[n+](cc2)[O-] d7a1a3b6337f110ce8aac8c79d18c467 [0,1,0,1,0,0|2,0,0]=4 15187 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(=O)oc2 2b7e390b2ee7bb9965ca94e934c96f61 [0,1,0,1,0,0|2,0,0]=4 15188 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)Br b85b0f5bb360cd869fc3a5a92ce4a07d [0,1,0,1,0,0|1,0,0]=3 15189 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)C 771e18779f2905d3aa565627ffb3d70a [0,1,0,1,0,0|1,0,0]=3 15190 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)Cl 186a8b09f924cfa52e6db878c778abac [0,1,0,1,0,0|1,0,0]=3 15191 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)F beaa0a1069e390b5cbab1d919da701c8 [0,1,0,1,0,0|1,0,0]=3 15192 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)I 3aeca496ea71d1c7770e36b6e3531cbf [0,1,0,1,0,0|1,0,0]=3 15193 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)O 9c8f481409ae646504d44d05ae2971a5 [0,1,0,1,0,0|1,0,0]=3 15194 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cc2)S bc05434266cd7c8d9dc4cf48c072f551 [0,1,0,1,0,0|1,0,0]=3 15195 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cn2)Br fa3c5cd3bda72fe229533af920fc30bd [0,1,0,1,0,0|2,0,0]=4 15196 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cn2)C f2b51f671f94c25906caf4ce9b694ca7 [0,1,0,1,0,0|2,0,0]=4 15197 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cn2)Cl 7a1b514f249134811909d477f81dc833 [0,1,0,1,0,0|2,0,0]=4 15198 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cn2)F 6fa271813000774868cc5b0312fa63a4 [0,1,0,1,0,0|2,0,0]=4 15199 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cn2)I 179df8343b4b3a7b6f698934c4304c92 [0,1,0,1,0,0|2,0,0]=4 15200 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(cn2)O a8ec5155487695d21ba6d9ec7929fcef [0,1,0,1,0,0|2,0,0]=4 15201 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)Br eb99e3c0d805c95974aba37afaae6d68 [0,1,0,1,0,0|2,0,0]=4 15202 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)C b8f3329265aeb20e5b7b534148f9ef50 [0,1,0,1,0,0|2,0,0]=4 15203 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)Cl 75c0eed9c807ba7df4d69411b2e44549 [0,1,0,1,0,0|2,0,0]=4 15204 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)F 8c4435ffbdfe64401d6be7684abe1334 [0,1,0,1,0,0|2,0,0]=4 15205 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)I bb9ad53413b158e1878769457a4f4b33 [0,1,0,1,0,0|2,0,0]=4 15206 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)O 980d8245f33229b433666a3864d5ef5d [0,1,0,1,0,0|2,0,0]=4 15207 B17R2.3190 CC[C@@H]1CCCN1C(=O)c2ccc(nc2)S 9a4971176323bb70a0bae5cdb9d7843e [0,1,0,1,0,0|2,0,0]=4 15208 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)Br 60b266b5afe37863b062533c096c6ad5 [0,1,0,1,0,0|2,0,0]=4 15209 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)C 75233f4eb22c8ea94a40e9f4a5d96488 [0,1,0,1,0,0|2,0,0]=4 15210 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)Cl 02aff0ed9dca368b14dc382b4c91f767 [0,1,0,1,0,0|2,0,0]=4 15211 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)F f58fcbdfa5dbaa6821b180cefcf873b8 [0,1,0,1,0,0|2,0,0]=4 15212 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)I 6d0f2f1d4d6bfe1b50ddab813512784b [0,1,0,1,0,0|2,0,0]=4 15213 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)O f3144e14f5f2380994ea089060edb05c [0,1,0,1,0,0|2,0,0]=4 15214 B17R2.3190 COC1CCCN1C(=O)c2ccc(cc2)S 505ff4161466927277c61657f913f955 [0,1,0,1,0,0|2,0,0]=4 15215 B17R2.3190 Cc1ccc(cc1)C(=O)N2CCCC2CO 112766337f7da40fd149d784b89948dc [0,1,0,1,0,0|2,0,0]=4 15216 B17R2.3190 Cc1ccc(cc1)C(=O)N2CCC[C@@H]2CF f3855d7856be4a2d3e42cd06443108ef [0,1,0,1,0,0|2,0,0]=4 15217 B17R2.3190 Cc1ccc(cc1)C(=O)N2CCC[C@@H]2CO 8419628f77e7f6a40686ee5d44697a84 [0,1,0,1,0,0|2,0,0]=4 15218 B17R2.3190 Cc1ccc(cc1)C(=O)N2CCC[C@H]2CF c1bfab0027ddff4c4ef345e054c393b2 [0,1,0,1,0,0|2,0,0]=4 15219 B17R2.3190 Cc1ccc(cc1)C(=O)N2CCC[C@H]2CO 523fe96eafb3a128c0ce81f246ac6245 [0,1,0,1,0,0|2,0,0]=4 15220 B17R2.3190 O=C(c1ccc(cc1)Br)N2CCCC2CO eb8dc7a1a15a74013e62e4f3b65b1d6a [0,1,0,1,0,0|2,0,0]=4 15221 B17R2.3190 O=C(c1ccc(cc1)Br)N2CCC[C@@H]2CF fc1d9380e363c51cefeb6abb88ba5b40 [0,1,0,1,0,0|2,0,0]=4 15222 B17R2.3190 O=C(c1ccc(cc1)Br)N2CCC[C@@H]2CO 26e69edb3eee79b8e2cd267cf3c32660 [0,1,0,1,0,0|2,0,0]=4 15223 B17R2.3190 O=C(c1ccc(cc1)Br)N2CCC[C@H]2CF b874c402b59d2709f7234f68109653d3 [0,1,0,1,0,0|2,0,0]=4 15224 B17R2.3190 O=C(c1ccc(cc1)Br)N2CCC[C@H]2CO 8646d661ef18caf03a1cec6db2926569 [0,1,0,1,0,0|2,0,0]=4 15225 B17R2.3190 O=C(c1ccc(cc1)Cl)N2CCCC2CO 6724250387aedadcbe7e6062208b0482 [0,1,0,1,0,0|2,0,0]=4 15226 B17R2.3190 O=C(c1ccc(cc1)Cl)N2CCC[C@@H]2CF 899125fd1fdb5e17fbf202636f1e68c2 [0,1,0,1,0,0|2,0,0]=4 15227 B17R2.3190 O=C(c1ccc(cc1)Cl)N2CCC[C@@H]2CO b26939927a33952ef5a8f99648a8813f [0,1,0,1,0,0|2,0,0]=4 15228 B17R2.3190 O=C(c1ccc(cc1)Cl)N2CCC[C@H]2CF b78649e2439034bc612c4e84b1bee24c [0,1,0,1,0,0|2,0,0]=4 15229 B17R2.3190 O=C(c1ccc(cc1)Cl)N2CCC[C@H]2CO 392800a40fe9d64132a0933d31d8d4e6 [0,1,0,1,0,0|2,0,0]=4 15230 B17R2.3190 O=C(c1ccc(cc1)F)N2CCCC2CO dcaee7c0a63255fa0f8990959061e92c [0,1,0,1,0,0|2,0,0]=4 15231 B17R2.3190 O=C(c1ccc(cc1)F)N2CCC[C@@H]2CF e43ac5743746d326f90074d5c67dc4e4 [0,1,0,1,0,0|2,0,0]=4 15232 B17R2.3190 O=C(c1ccc(cc1)F)N2CCC[C@@H]2CO 5bd687d758552fde06b9cbc32873867e [0,1,0,1,0,0|2,0,0]=4 15233 B17R2.3190 O=C(c1ccc(cc1)F)N2CCC[C@H]2CF 43f822ce1d43cc945f4531780c1192f7 [0,1,0,1,0,0|2,0,0]=4 15234 B17R2.3190 O=C(c1ccc(cc1)F)N2CCC[C@H]2CO 5f5b957a31aa98e98750b9c0a140ca78 [0,1,0,1,0,0|2,0,0]=4 15235 B17R2.3190 O=C(c1ccc(cc1)I)N2CCCC2CO fbd60f7691bd78d0916207138b796c89 [0,1,0,1,0,0|2,0,0]=4 15236 B17R2.3190 O=C(c1ccc(cc1)I)N2CCC[C@@H]2CF 3ee371e2c4a59038e23cbb91dd82eb11 [0,1,0,1,0,0|2,0,0]=4 15237 B17R2.3190 O=C(c1ccc(cc1)I)N2CCC[C@@H]2CO 28931915c4b9e3445ff078ba2b696d23 [0,1,0,1,0,0|2,0,0]=4 15238 B17R2.3190 O=C(c1ccc(cc1)I)N2CCC[C@H]2CF 9241a0eac83170d441334f3f64f2a39e [0,1,0,1,0,0|2,0,0]=4 15239 B17R2.3190 O=C(c1ccc(cc1)I)N2CCC[C@H]2CO 3fc1cf014e5bc3e5b86ad998b8273552 [0,1,0,1,0,0|2,0,0]=4 15240 B17R2.3190 O=C(c1ccc(cc1)O)N2CCCC2CO 41ab01ae630bf899d9352bfc2f40f651 [0,1,0,1,0,0|2,0,0]=4 15241 B17R2.3190 O=C(c1ccc(cc1)O)N2CCC[C@@H]2CF 0e8647057afd221b99a908a1a8d730c3 [0,1,0,1,0,0|2,0,0]=4 15242 B17R2.3190 O=C(c1ccc(cc1)O)N2CCC[C@@H]2CO 889e3c99a1509624ab44a42fa873b472 [0,1,0,1,0,0|2,0,0]=4 15243 B17R2.3190 O=C(c1ccc(cc1)O)N2CCC[C@H]2CF 42451e677d40745dacd6cebedfab020a [0,1,0,1,0,0|2,0,0]=4 15244 B17R2.3190 O=C(c1ccc(cc1)O)N2CCC[C@H]2CO 30610c50a8cbb3012e7e65e4f66db245 [0,1,0,1,0,0|2,0,0]=4 15245 B17R2.3190 O=C(c1ccc(cc1)S)N2CCCC2CO 1879e3c2f12a8e4d7756c1b3c2673a5f [0,1,0,1,0,0|2,0,0]=4 15246 B17R2.3190 O=C(c1ccc(cc1)S)N2CCC[C@@H]2CF ec85ad9183dc51846c9026236a283d1e [0,1,0,1,0,0|2,0,0]=4 15247 B17R2.3190 O=C(c1ccc(cc1)S)N2CCC[C@@H]2CO 91002dbe18306161114b46e0fb9822cf [0,1,0,1,0,0|2,0,0]=4 15248 B17R2.3190 O=C(c1ccc(cc1)S)N2CCC[C@H]2CF 49f818cc6a81ed91f099fc584e3eda16 [0,1,0,1,0,0|2,0,0]=4 15249 B17R2.3190 O=C(c1ccc(cc1)S)N2CCC[C@H]2CO 0a73d7b4f523f931af696f3dec4ad444 [0,1,0,1,0,0|2,0,0]=4 15250 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)Br 8646d51ba6fe2fd83441b956d2a9c342 [0,1,0,1,0,0|2,0,0]=4 15251 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)C 7757b642c7f6f4f27feab5b0ee491944 [0,1,0,1,0,0|2,0,0]=4 15252 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)Cl 110d6509a43af6f7ed6e6e507dcec19d [0,1,0,1,0,0|2,0,0]=4 15253 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)F 5e14f95209f0b232111aca84e6ba60d1 [0,1,0,1,0,0|2,0,0]=4 15254 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)I 8866ece8f9a840ad00c06d1037ce0e6f [0,1,0,1,0,0|2,0,0]=4 15255 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)O 95995e68070f02685671568b567a4e96 [0,1,0,1,0,0|2,0,0]=4 15256 B17R2.3194 COCC1CCN1C(=O)c2ccc(cc2)S ef4d105b45e7f7371023f0c3874a22d5 [0,1,0,1,0,0|2,0,0]=4 15257 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)Br 732a04a0c74b8de75a63aea7e9f23470 [0,1,0,1,0,0|2,0,0]=4 15258 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)C 9ca19348ed5a8628ad1c97ec84b231a3 [0,1,0,1,0,0|2,0,0]=4 15259 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)Cl 08edc872134d96a146814459676b819c [0,1,0,1,0,0|2,0,0]=4 15260 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)F a3028986f82593e7c8255b52e4685525 [0,1,0,1,0,0|2,0,0]=4 15261 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)I f86645de1d5cbebef429e2b1eec3f438 [0,1,0,1,0,0|2,0,0]=4 15262 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)O f303de8713ea8bcedd6ecbf90c803bd5 [0,1,0,1,0,0|2,0,0]=4 15263 B17R2.3194 COC[C@@H]1CCN1C(=O)c2ccc(cc2)S 89f27236a15ed1c78aa27749dae790b5 [0,1,0,1,0,0|2,0,0]=4 15264 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)Br 13ac51d46b0d7244914d326945a0e647 [0,1,0,1,0,0|2,0,0]=4 15265 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)C c539bd13006dfea22a5da19704608f80 [0,1,0,1,0,0|2,0,0]=4 15266 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)Cl 866fe1ea70addb51baa1a4c670a1e073 [0,1,0,1,0,0|2,0,0]=4 15267 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)F 79eccf1e187845f0e6b7d8144dbd247f [0,1,0,1,0,0|2,0,0]=4 15268 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)I 90fadbf969e9cb4257735266b07baf2b [0,1,0,1,0,0|2,0,0]=4 15269 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)O a9154ad69f46fa3451b3490783c7e83c [0,1,0,1,0,0|2,0,0]=4 15270 B17R2.3194 COC[C@H]1CCN1C(=O)c2ccc(cc2)S 581f5307bf4bd957c881623291ba03a5 [0,1,0,1,0,0|2,0,0]=4 15271 B17R2.3194 Cc1ccc(cc1)C(=O)N2CCC2CCO 891a4c4cea78d628b8b01b153dcac3de [0,1,0,1,0,0|2,0,0]=4 15272 B17R2.3194 O=C(c1ccc(cc1)Br)N2CCC2CCO b98cc477e067335c446b75f717b3601b [0,1,0,1,0,0|2,0,0]=4 15273 B17R2.3194 O=C(c1ccc(cc1)Cl)N2CCC2CCO 2519903e5a6819621f1eeede42b4921f [0,1,0,1,0,0|2,0,0]=4 15274 B17R2.3194 O=C(c1ccc(cc1)F)N2CCC2CCO a46271f541f1390dd2972e1f1cfa078e [0,1,0,1,0,0|2,0,0]=4 15275 B17R2.3194 O=C(c1ccc(cc1)I)N2CCC2CCO bd32410ec36341cac2ef9024ce18d542 [0,1,0,1,0,0|2,0,0]=4 15276 B17R2.3194 O=C(c1ccc(cc1)O)N2CCC2CCO a048c4694077a7aeaa29aebb4e203df2 [0,1,0,1,0,0|2,0,0]=4 15277 B17R2.3194 O=C(c1ccc(cc1)S)N2CCC2CCO 4fb38d60ca4bd1b11e4837dc7ec2cd08 [0,1,0,1,0,0|2,0,0]=4 15278 B17R2.3283 CC(OCC1CCCC1)c2ccc(cc2)Br 1e77e92b9af05245e0bab0814991739b [0,1,0,1,0,0|1,0,1]=4 15279 B17R2.3283 CC(OCC1CCCC1)c2ccc(cc2)F b3e59e3907c40545969265855bd79525 [0,1,0,1,0,0|1,0,1]=4 15280 B17R2.3283 CC(OCC1CCCC1)c2ccc(cc2)I c29b42f31059ab10a9ebc9438fb365e4 [0,1,0,1,0,0|1,0,1]=4 15281 B17R2.3283 C[C@@H](OCC1CCCC1)c2ccc(cc2)Br 7b6f9b82fda27def43738a916081aef4 [0,1,0,1,0,0|1,0,1]=4 15282 B17R2.3283 C[C@@H](OCC1CCCC1)c2ccc(cc2)F cc66680c86b4062268d9f0b77f80967c [0,1,0,1,0,0|1,0,1]=4 15283 B17R2.3283 C[C@@H](OCC1CCCC1)c2ccc(cc2)I 2c72ec214ce233808cd4307df1db7e71 [0,1,0,1,0,0|1,0,1]=4 15284 B17R2.3283 C[C@H](OCC1CCCC1)c2ccc(cc2)Br 9e0bce9f99c89c1020125fd7f1c2eac5 [0,1,0,1,0,0|1,0,1]=4 15285 B17R2.3283 C[C@H](OCC1CCCC1)c2ccc(cc2)F 82fe17c4a5ed4d0dab5ebc40d03dfda5 [0,1,0,1,0,0|1,0,1]=4 15286 B17R2.3283 C[C@H](OCC1CCCC1)c2ccc(cc2)I d86cc80b818f1d8100f6c3bffe87d3f1 [0,1,0,1,0,0|1,0,1]=4 15287 B17R2.3283 Cc1ccc(cc1)C(=O)CNC2CCCC2 564c6d0b1a94b454874eef475b0b0f6e [0,1,0,1,0,0|2,0,0]=4 15288 B17R2.3283 Cc1ccc(cc1)C(=O)COC2CCCC2 c92131846c3ed01a5bfeef26c8640fc4 [0,1,0,1,0,0|2,0,0]=4 15289 B17R2.3283 Cc1ccc(cc1)C(=O)NCC2CCCC2 93c0da1495a8df5aaed8f6a2753bb078 [0,1,0,1,0,0|1,0,0]=3 15290 B17R2.3283 Cc1ccc(cc1)C(=O)NCC2CCCO2 af92fdfc946057ce398b5063642eebc7 [0,1,0,1,0,0|2,0,0]=4 15291 B17R2.3283 Cc1ccc(cc1)C(=O)NCC2CCOC2 08c44bcdf9838243e01c16005e7b392c [0,1,0,1,0,0|2,0,0]=4 15292 B17R2.3283 Cc1ccc(cc1)C(=O)NC[C@@H]2CCCO2 26593b945fa2c9526e17666fe26b2194 [0,1,0,1,0,0|2,0,0]=4 15293 B17R2.3283 Cc1ccc(cc1)C(=O)NC[C@@H]2CCOC2 6499cb3e275c99f53c80a3fe920684dd [0,1,0,1,0,0|2,0,0]=4 15294 B17R2.3283 Cc1ccc(cc1)C(=O)NC[C@H]2CCCO2 ce4090bcb7046b837f7a3268089a98e7 [0,1,0,1,0,0|2,0,0]=4 15295 B17R2.3283 Cc1ccc(cc1)C(=O)NC[C@H]2CCOC2 4aa3a54ebd6b4fd4b31bd57559e25be6 [0,1,0,1,0,0|2,0,0]=4 15296 B17R2.3283 Cc1ccc(cc1)C(C)OCC2CCCC2 204f803115430328652fea15f06e3e5c [0,1,0,1,0,0|1,0,1]=4 15297 B17R2.3283 Cc1ccc(cc1)[C@@H](C)OCC2CCCC2 411b3759d8ff1d48131e759e5ba03de3 [0,1,0,1,0,0|1,0,1]=4 15298 B17R2.3283 Cc1ccc(cc1)[C@H](C)OCC2CCCC2 d4f32704337150174d8aceb043d0bff2 [0,1,0,1,0,0|1,0,1]=4 15299 B17R2.3283 Cc1ccc(cn1)C(=O)NCC2CCCC2 5e19981e82680765829b530ed8b7525f [0,1,0,1,0,0|2,0,0]=4 15300 B17R2.3283 Cc1ccc(nc1)C(=O)NCC2CCCC2 ad586f48220efb7e715b7957ac51aa7b [0,1,0,1,0,0|2,0,0]=4 15301 B17R2.3283 O=C(CNC1CCCC1)c2ccc(cc2)Br a0ace66d3689d3b98c2d21e772f8d0eb [0,1,0,1,0,0|2,0,0]=4 15302 B17R2.3283 O=C(CNC1CCCC1)c2ccc(cc2)Cl 041c9de936d9e41acdfd9c1e835db60f [0,1,0,1,0,0|2,0,0]=4 15303 B17R2.3283 O=C(CNC1CCCC1)c2ccc(cc2)F 9a10bd06b0e728b0e4fef7d810db7640 [0,1,0,1,0,0|2,0,0]=4 15304 B17R2.3283 O=C(CNC1CCCC1)c2ccc(cc2)I e9d80e850877fb9eb78dcb9287525464 [0,1,0,1,0,0|2,0,0]=4 15305 B17R2.3283 O=C(COC1CCCC1)c2ccc(cc2)Br 7fac7183926dbeebf5d552dff4ddb837 [0,1,0,1,0,0|2,0,0]=4 15306 B17R2.3283 O=C(COC1CCCC1)c2ccc(cc2)Cl 6970478c76542e3ba67794c20a400060 [0,1,0,1,0,0|2,0,0]=4 15307 B17R2.3283 O=C(COC1CCCC1)c2ccc(cc2)F 3f7ded0e0e5a792c32a862b43366fe7d [0,1,0,1,0,0|2,0,0]=4 15308 B17R2.3283 O=C(COC1CCCC1)c2ccc(cc2)I 789351529c930942bc33a9b59a3a0ab8 [0,1,0,1,0,0|2,0,0]=4 15309 B17R2.3283 O=C(NCC1CCCC1)c2cc[n+](cc2)[O-] 134f42272ef15288ad4a5046d8f638fd [0,1,0,1,0,0|2,0,0]=4 15310 B17R2.3283 O=C(NCC1CCCC1)c2ccc(=O)oc2 7247a4ae93f891d76468190e529c1df8 [0,1,0,1,0,0|2,0,0]=4 15311 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cc2)Br 183506c156e403f1fb28f4820bc4e18f [0,1,0,1,0,0|1,0,0]=3 15312 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cc2)Cl 8ce13fefc748819fa4ab41a8051e677a [0,1,0,1,0,0|1,0,0]=3 15313 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cc2)F 44111105a3f55eb482ca71d17ec55cdc [0,1,0,1,0,0|1,0,0]=3 15314 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cc2)I 03cfc658c55260d967a730328f8a6967 [0,1,0,1,0,0|1,0,0]=3 15315 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cc2)O df598f93e78c75492aa2768cad875a59 [0,1,0,1,0,0|1,0,0]=3 15316 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cc2)S c4f824d35db8f6508a9c9759b9455353 [0,1,0,1,0,0|1,0,0]=3 15317 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cn2)Br e216a90162c4850c21dbb938c8fbbc5e [0,1,0,1,0,0|2,0,0]=4 15318 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cn2)Cl 580b4fcec63731acce9b04b9a3ae6a37 [0,1,0,1,0,0|2,0,0]=4 15319 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cn2)F 766b46feb36cd09f4996df1d747c0f4d [0,1,0,1,0,0|2,0,0]=4 15320 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cn2)I dc0084a4b0d1a2d2f726f39b41e0165f [0,1,0,1,0,0|2,0,0]=4 15321 B17R2.3283 O=C(NCC1CCCC1)c2ccc(cn2)O 2f62ee586656faf09e7b5016685bfc9b [0,1,0,1,0,0|2,0,0]=4 15322 B17R2.3283 O=C(NCC1CCCC1)c2ccc(nc2)Br 85bd15ce771519d9eddc3d8b37af929c [0,1,0,1,0,0|2,0,0]=4 15323 B17R2.3283 O=C(NCC1CCCC1)c2ccc(nc2)Cl d4de5c1a47cc680f9a64bfdfaacafd8e [0,1,0,1,0,0|2,0,0]=4 15324 B17R2.3283 O=C(NCC1CCCC1)c2ccc(nc2)F 0629f8e533c2b971f8c13eacf23a241c [0,1,0,1,0,0|2,0,0]=4 15325 B17R2.3283 O=C(NCC1CCCC1)c2ccc(nc2)I 4199b832e8d6cec7122263290073ab56 [0,1,0,1,0,0|2,0,0]=4 15326 B17R2.3283 O=C(NCC1CCCC1)c2ccc(nc2)O e48602915c8a06c9d3a2e85e54819977 [0,1,0,1,0,0|2,0,0]=4 15327 B17R2.3283 O=C(NCC1CCCC1)c2ccc(nc2)S 81926d274b7d4d83a5b4e52d9ae3956f [0,1,0,1,0,0|2,0,0]=4 15328 B17R2.3283 O=C(NCC1CCCO1)c2ccc(cc2)Br 9b78411a44c00a786164cbc0a12f8925 [0,1,0,1,0,0|2,0,0]=4 15329 B17R2.3283 O=C(NCC1CCCO1)c2ccc(cc2)Cl 0189aa8a4becea136ce1324fa3bec49f [0,1,0,1,0,0|2,0,0]=4 15330 B17R2.3283 O=C(NCC1CCCO1)c2ccc(cc2)F d82b5df811ce3ac682116c8174fa69b8 [0,1,0,1,0,0|2,0,0]=4 15331 B17R2.3283 O=C(NCC1CCCO1)c2ccc(cc2)I fc1e40d2c2b3654cfe5ba7a157b9100b [0,1,0,1,0,0|2,0,0]=4 15332 B17R2.3283 O=C(NCC1CCCO1)c2ccc(cc2)O 67b8c00bdefa07b6f342d4b3fc25730b [0,1,0,1,0,0|2,0,0]=4 15333 B17R2.3283 O=C(NCC1CCCO1)c2ccc(cc2)S d8b618d61f3fdd0dcdbcb7861da326e4 [0,1,0,1,0,0|2,0,0]=4 15334 B17R2.3283 O=C(NCC1CCOC1)c2ccc(cc2)Br 160f3dbaab3923280b5fc333e68296fd [0,1,0,1,0,0|2,0,0]=4 15335 B17R2.3283 O=C(NCC1CCOC1)c2ccc(cc2)Cl 5a66b5399ab2fd39f5855f47686fb6ee [0,1,0,1,0,0|2,0,0]=4 15336 B17R2.3283 O=C(NCC1CCOC1)c2ccc(cc2)F 0817bc93afa94dd8270ffc64d3bef5cd [0,1,0,1,0,0|2,0,0]=4 15337 B17R2.3283 O=C(NCC1CCOC1)c2ccc(cc2)I 289c34899305f9c6cc89594164e17e08 [0,1,0,1,0,0|2,0,0]=4 15338 B17R2.3283 O=C(NCC1CCOC1)c2ccc(cc2)O d8cbf134b0a76489241b73c0e662f058 [0,1,0,1,0,0|2,0,0]=4 15339 B17R2.3283 O=C(NCC1CCOC1)c2ccc(cc2)S 8060c04391de1ebbef695b80ad5a18ce [0,1,0,1,0,0|2,0,0]=4 15340 B17R2.3283 O=C(NC[C@@H]1CCCO1)c2ccc(cc2)Br 2afe2f033cf067b972167eb7f9959bbc [0,1,0,1,0,0|2,0,0]=4 15341 B17R2.3283 O=C(NC[C@@H]1CCCO1)c2ccc(cc2)Cl 5c45c22f293140fef8c69760c3dd8edd [0,1,0,1,0,0|2,0,0]=4 15342 B17R2.3283 O=C(NC[C@@H]1CCCO1)c2ccc(cc2)F 03f37a4be4ac440d949ae9635d8b6770 [0,1,0,1,0,0|2,0,0]=4 15343 B17R2.3283 O=C(NC[C@@H]1CCCO1)c2ccc(cc2)I 6f612b885342d7ac04be6c8a7090d287 [0,1,0,1,0,0|2,0,0]=4 15344 B17R2.3283 O=C(NC[C@@H]1CCCO1)c2ccc(cc2)O ae9dd711aa608a27d457db011bce2620 [0,1,0,1,0,0|2,0,0]=4 15345 B17R2.3283 O=C(NC[C@@H]1CCCO1)c2ccc(cc2)S 71e6d9177fe59f262eda6ff96a05f470 [0,1,0,1,0,0|2,0,0]=4 15346 B17R2.3283 O=C(NC[C@@H]1CCOC1)c2ccc(cc2)Br 8d479a0bb4deed09addc207ee84ff3cc [0,1,0,1,0,0|2,0,0]=4 15347 B17R2.3283 O=C(NC[C@@H]1CCOC1)c2ccc(cc2)Cl 072cfc427a22abae44e92d6b634d9e7b [0,1,0,1,0,0|2,0,0]=4 15348 B17R2.3283 O=C(NC[C@@H]1CCOC1)c2ccc(cc2)F 566965cf4eb135706234bf1ac4ac400a [0,1,0,1,0,0|2,0,0]=4 15349 B17R2.3283 O=C(NC[C@@H]1CCOC1)c2ccc(cc2)I c6fe0407856ad8b897e1da81cda422fd [0,1,0,1,0,0|2,0,0]=4 15350 B17R2.3283 O=C(NC[C@@H]1CCOC1)c2ccc(cc2)O f02c0cae3530077fa2c5314c39581199 [0,1,0,1,0,0|2,0,0]=4 15351 B17R2.3283 O=C(NC[C@@H]1CCOC1)c2ccc(cc2)S 7384757d6304d067325f6fd7ff20e44e [0,1,0,1,0,0|2,0,0]=4 15352 B17R2.3283 O=C(NC[C@H]1CCCO1)c2ccc(cc2)Br f0bbc6231da6a874e8b6ffb364f42ad5 [0,1,0,1,0,0|2,0,0]=4 15353 B17R2.3283 O=C(NC[C@H]1CCCO1)c2ccc(cc2)Cl 04467aa4e6722f26c5c9aaea21005678 [0,1,0,1,0,0|2,0,0]=4 15354 B17R2.3283 O=C(NC[C@H]1CCCO1)c2ccc(cc2)F fc5ef0b590ea5c7ee3fdd7eb003fb62a [0,1,0,1,0,0|2,0,0]=4 15355 B17R2.3283 O=C(NC[C@H]1CCCO1)c2ccc(cc2)I 6428e109ff089b10cd31feeb3fe32083 [0,1,0,1,0,0|2,0,0]=4 15356 B17R2.3283 O=C(NC[C@H]1CCCO1)c2ccc(cc2)O f7818ace8612ae70cbc7136820c490a3 [0,1,0,1,0,0|2,0,0]=4 15357 B17R2.3283 O=C(NC[C@H]1CCCO1)c2ccc(cc2)S 86f8187929d38a197d432c201531ed50 [0,1,0,1,0,0|2,0,0]=4 15358 B17R2.3283 O=C(NC[C@H]1CCOC1)c2ccc(cc2)Br 52eb85c6279905eda2cdab1a6f7a41fa [0,1,0,1,0,0|2,0,0]=4 15359 B17R2.3283 O=C(NC[C@H]1CCOC1)c2ccc(cc2)Cl 71bd5b81b3ada571f92634319dc3bd24 [0,1,0,1,0,0|2,0,0]=4 15360 B17R2.3283 O=C(NC[C@H]1CCOC1)c2ccc(cc2)F 114de5abd1332a8d9e876c8cf5cc9214 [0,1,0,1,0,0|2,0,0]=4 15361 B17R2.3283 O=C(NC[C@H]1CCOC1)c2ccc(cc2)I 085e79c05da31f215478c4e6ce4960b3 [0,1,0,1,0,0|2,0,0]=4 15362 B17R2.3283 O=C(NC[C@H]1CCOC1)c2ccc(cc2)O 529c112fd4832daae25e790befc3a273 [0,1,0,1,0,0|2,0,0]=4 15363 B17R2.3283 O=C(NC[C@H]1CCOC1)c2ccc(cc2)S 60fd85e245333e08b4b82684b830abf9 [0,1,0,1,0,0|2,0,0]=4 15364 B17R2.3283 O=C(OCN1CCSC1)c2ccc(cc2)F e1d2d090b5810e34e48baac365a2d55f [0,1,0,1,0,0|2,0,0]=4 15365 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)Br 3cc73a119207b81e3cd33846eebd17d2 [0,1,0,1,0,0|2,0,0]=4 15366 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)C 4cf2a80cba7faddc002c3c26db512d2b [0,1,0,1,0,0|2,0,0]=4 15367 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)Cl 7556ebe9d9051ab041ea5fda8d59a2f0 [0,1,0,1,0,0|2,0,0]=4 15368 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)F 713c489270e5fdc9bc530e4e36b5bb33 [0,1,0,1,0,0|2,0,0]=4 15369 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)I d2ed518ebfe5fe027d2c0f442c2ad125 [0,1,0,1,0,0|2,0,0]=4 15370 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)O f3af9d8a1278ada9fae9d0bc5c0efc8f [0,1,0,1,0,0|2,0,0]=4 15371 B17R2.4139 COC[C@@H]1C[C@@H]1NC(=O)c2ccc(cc2)S 0ffbb15f4bf5e9056638340f918e51e1 [0,1,0,1,0,0|2,0,0]=4 15372 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)Br c66d45f21c767242b23e8b9f5d83a181 [0,1,0,1,0,0|2,0,0]=4 15373 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)C d896c01bbeb208bdccc9e38783d3151a [0,1,0,1,0,0|2,0,0]=4 15374 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)Cl 5fc7377fe0d58bb0057292be85fb5a26 [0,1,0,1,0,0|2,0,0]=4 15375 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)F 544fec3f94c9a187e849fbc53557b36e [0,1,0,1,0,0|2,0,0]=4 15376 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)I e2f643587fe09273b52aeb782e84770e [0,1,0,1,0,0|2,0,0]=4 15377 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)O 43ed06cb2e512cad752e0de389eed400 [0,1,0,1,0,0|2,0,0]=4 15378 B17R2.4139 COC[C@H]1C[C@@H]1NC(=O)c2ccc(cc2)S ac0b2f49698acaa784c09dc3fe047f30 [0,1,0,1,0,0|2,0,0]=4 15379 B17R2.56621 Cc1ccc(cc1)C(=O)N2CCCCCC2 d0600279a54a96f9dabfa3d8e29474a5 [0,1,0,1,0,0|1,0,0]=3 15380 B17R2.56621 Cc1ccc(cc1)C(=O)N2CCCOCC2 ad4b6cebbbbc5af60a7cf5b06ebd0202 [0,1,0,1,0,0|2,0,0]=4 15381 B17R2.56621 Cc1ccc(cn1)C(=O)N2CCCCCC2 f34420a747e2c036feaf88d9a544ee81 [0,1,0,1,0,0|2,0,0]=4 15382 B17R2.56621 Cc1ccc(nc1)C(=O)N2CCCCCC2 c6a4d2c37b50c9093773c5b2de477556 [0,1,0,1,0,0|2,0,0]=4 15383 B17R2.56621 O=C(c1cc[n+](cc1)[O-])N2CCCCCC2 31c9bb0212378a93d8ae695c230b3c04 [0,1,0,1,0,0|2,0,0]=4 15384 B17R2.56621 O=C(c1ccc(=O)oc1)N2CCCCCC2 691e23d5ceb32586258f6bb4bf124a17 [0,1,0,1,0,0|2,0,0]=4 15385 B17R2.56621 O=C(c1ccc(cc1)Br)N2CCCCCC2 835c002944ba045fe9c3ce2496aa1052 [0,1,0,1,0,0|1,0,0]=3 15386 B17R2.56621 O=C(c1ccc(cc1)Br)N2CCCOCC2 c9c277265848a5729fb3162d9fe3760d [0,1,0,1,0,0|2,0,0]=4 15387 B17R2.56621 O=C(c1ccc(cc1)Cl)N2CCCCCC2 58d9074d23eac5cc82b5a751517086c0 [0,1,0,1,0,0|1,0,0]=3 15388 B17R2.56621 O=C(c1ccc(cc1)Cl)N2CCCOCC2 7b565a36b0bfa4a39a3425eb687b547b [0,1,0,1,0,0|2,0,0]=4 15389 B17R2.56621 O=C(c1ccc(cc1)F)N2CCCCCC2 65bd5a91fb635cb570b2cf0a55551560 [0,1,0,1,0,0|1,0,0]=3 15390 B17R2.56621 O=C(c1ccc(cc1)F)N2CCCOCC2 302b994331e0e6d0d5684cbe8fc49cbe [0,1,0,1,0,0|2,0,0]=4 15391 B17R2.56621 O=C(c1ccc(cc1)I)N2CCCCCC2 48d0e006645ba838079dce3c9f5b4a1f [0,1,0,1,0,0|1,0,0]=3 15392 B17R2.56621 O=C(c1ccc(cc1)I)N2CCCOCC2 110bf48742421389df9bcc4ae7f81e8b [0,1,0,1,0,0|2,0,0]=4 15393 B17R2.56621 O=C(c1ccc(cc1)O)N2CCCCCC2 ef4b5a08e8d0b5174b7b845ab28ec59b [0,1,0,1,0,0|1,0,0]=3 15394 B17R2.56621 O=C(c1ccc(cc1)O)N2CCCOCC2 c1be54e750311d02523fb71ddc3024b4 [0,1,0,1,0,0|2,0,0]=4 15395 B17R2.56621 O=C(c1ccc(cc1)S)N2CCCCCC2 7f27fc6bc628c0acae5c798461cfedc0 [0,1,0,1,0,0|1,0,0]=3 15396 B17R2.56621 O=C(c1ccc(cc1)S)N2CCCOCC2 e0ec87959b720a175742d1fb36f36e89 [0,1,0,1,0,0|2,0,0]=4 15397 B17R2.56621 O=C(c1ccc(cn1)Br)N2CCCCCC2 07bee2ebe74f82a5d8eb62bc8bce17de [0,1,0,1,0,0|2,0,0]=4 15398 B17R2.56621 O=C(c1ccc(cn1)Cl)N2CCCCCC2 aed967bf484afaf24759b4a47bfcdd85 [0,1,0,1,0,0|2,0,0]=4 15399 B17R2.56621 O=C(c1ccc(cn1)F)N2CCCCCC2 b72bff5c022c1b8163ebf0595e8b3bd3 [0,1,0,1,0,0|2,0,0]=4 15400 B17R2.56621 O=C(c1ccc(cn1)I)N2CCCCCC2 fe27fa8de8a6195ade4fdf86887346ee [0,1,0,1,0,0|2,0,0]=4 15401 B17R2.56621 O=C(c1ccc(cn1)O)N2CCCCCC2 8746831b34e8fc792ef6e14db84f51b7 [0,1,0,1,0,0|2,0,0]=4 15402 B17R2.56621 O=C(c1ccc(nc1)Br)N2CCCCCC2 a0a1826d593f671f4e1e705966b36e75 [0,1,0,1,0,0|2,0,0]=4 15403 B17R2.56621 O=C(c1ccc(nc1)Cl)N2CCCCCC2 3b5ba57c0367ddbfe4b4ed9f558da113 [0,1,0,1,0,0|2,0,0]=4 15404 B17R2.56621 O=C(c1ccc(nc1)F)N2CCCCCC2 8a445794fe7609541acebe2939ae249f [0,1,0,1,0,0|2,0,0]=4 15405 B17R2.56621 O=C(c1ccc(nc1)I)N2CCCCCC2 4fc99fb9a31853ab231317f997113001 [0,1,0,1,0,0|2,0,0]=4 15406 B17R2.56621 O=C(c1ccc(nc1)O)N2CCCCCC2 2672c3e205fe7eb5edc4a0437d5dcdfa [0,1,0,1,0,0|2,0,0]=4 15407 B17R2.56621 O=C(c1ccc(nc1)S)N2CCCCCC2 33fc2db36da0aae6f392a0474ca7a025 [0,1,0,1,0,0|2,0,0]=4 15408 B17R2.56628 CC(OCCCC1CC1)c2ccc(cc2)F c2e5d614b9a500d4dce9f35bb8cdff86 [0,1,0,1,0,0|1,0,1]=4 15409 B17R2.56628 Cc1ccc(cc1)C(=O)CCCNC2CC2 ea49a19fa20df8f235b85b00935ccbbe [0,1,0,1,0,0|2,0,0]=4 15410 B17R2.56628 Cc1ccc(cc1)C(=O)CCCOC2CC2 674d1f224c014d6450cddb6c49b6dad5 [0,1,0,1,0,0|2,0,0]=4 15411 B17R2.56628 Cc1ccc(cc1)C(=O)CCNCC2CC2 be8acd477b86802d990637f5ebdf89f7 [0,1,0,1,0,0|2,0,0]=4 15412 B17R2.56628 Cc1ccc(cc1)C(=O)CCOCC2CC2 97b4de7895af17b91bab693fae1e1d53 [0,1,0,1,0,0|2,0,0]=4 15413 B17R2.56628 Cc1ccc(cc1)C(=O)CNCCC2CC2 6c50ef238b4f6d18989d30c1c15d9ab4 [0,1,0,1,0,0|2,0,0]=4 15414 B17R2.56628 Cc1ccc(cc1)C(=O)COCCC2CC2 e5ee2c469cfdbccc3d66c9aafa277bd9 [0,1,0,1,0,0|2,0,0]=4 15415 B17R2.56628 Cc1ccc(cc1)C(=O)NCCOC2CC2 1fd2ba779d7b07315b71f28645ae05a5 [0,1,0,1,0,0|2,0,0]=4 15416 B17R2.56628 Cc1ccc(cc1)C(=O)OCCOC2CC2 b7695c7c6387120ce32fb2971597e761 [0,1,0,1,0,0|1,0,0]=3 15417 B17R2.56628 O=C(CCCNC1CC1)c2ccc(cc2)Cl 62de58fcf0a4b660705bd8472a42ef39 [0,1,0,1,0,0|2,0,0]=4 15418 B17R2.56628 O=C(CCCNC1CC1)c2ccc(cc2)F aeb62228714a7f34c63d03391e7ef8a8 [0,1,0,1,0,0|2,0,0]=4 15419 B17R2.56628 O=C(CCCOC1CC1)c2ccc(cc2)Br cf26089672fded3c7250ee66c5bf6179 [0,1,0,1,0,0|2,0,0]=4 15420 B17R2.56628 O=C(CCCOC1CC1)c2ccc(cc2)Cl 707087788133c991ee785e9ebcd84d99 [0,1,0,1,0,0|2,0,0]=4 15421 B17R2.56628 O=C(CCCOC1CC1)c2ccc(cc2)F c06723fa269c3480d712054f2eb1d9b6 [0,1,0,1,0,0|2,0,0]=4 15422 B17R2.56628 O=C(CCNCC1CC1)c2ccc(cc2)Br d351f04193c85a08aab6516a36e142aa [0,1,0,1,0,0|2,0,0]=4 15423 B17R2.56628 O=C(CCNCC1CC1)c2ccc(cc2)Cl 8268f202dc98dc6f6287c27a8a7ec420 [0,1,0,1,0,0|2,0,0]=4 15424 B17R2.56628 O=C(CCNCC1CC1)c2ccc(cc2)F 652745e190679ea00696c52178b27f86 [0,1,0,1,0,0|2,0,0]=4 15425 B17R2.56628 O=C(CCOCC1CC1)c2ccc(cc2)Br ef3e12982f181a17a2c652a2e57ff53c [0,1,0,1,0,0|2,0,0]=4 15426 B17R2.56628 O=C(CCOCC1CC1)c2ccc(cc2)Cl a074b8e662d073e9749669a3edef1097 [0,1,0,1,0,0|2,0,0]=4 15427 B17R2.56628 O=C(CCOCC1CC1)c2ccc(cc2)F c23eabedf5a3c25cede4aa860b01c8eb [0,1,0,1,0,0|2,0,0]=4 15428 B17R2.56628 O=C(CNCCC1CC1)c2ccc(cc2)Br a76c50c5f6d54218b3e987c60d0e072e [0,1,0,1,0,0|2,0,0]=4 15429 B17R2.56628 O=C(CNCCC1CC1)c2ccc(cc2)Cl ce5f21614e9f99e0c371e9ad954eac42 [0,1,0,1,0,0|2,0,0]=4 15430 B17R2.56628 O=C(CNCCC1CC1)c2ccc(cc2)F 1d3750f8de2efffeae44bfbc4d41329a [0,1,0,1,0,0|2,0,0]=4 15431 B17R2.56628 O=C(CNCCC1CC1)c2ccc(cc2)I ae10c8908d08339b7e04ee7dc12c768a [0,1,0,1,0,0|2,0,0]=4 15432 B17R2.56628 O=C(COCCC1CC1)c2ccc(cc2)Br 709d399e3d2d2686550f7e2ade1d3c04 [0,1,0,1,0,0|2,0,0]=4 15433 B17R2.56628 O=C(COCCC1CC1)c2ccc(cc2)Cl 94ee84f01e3e7a4353aab5761c5e6bb7 [0,1,0,1,0,0|2,0,0]=4 15434 B17R2.56628 O=C(COCCC1CC1)c2ccc(cc2)F b716a42c9dced89e304e56bee1a6c6fb [0,1,0,1,0,0|2,0,0]=4 15435 B17R2.56628 O=C(COCCC1CC1)c2ccc(cc2)I 68f43324338622c119520ecb81b1ee89 [0,1,0,1,0,0|2,0,0]=4 15436 B17R2.56628 O=C(NCCOC1CC1)c2ccc(cc2)Br df2f3c78a0310e5c31e8f2f87f9e4cd1 [0,1,0,1,0,0|2,0,0]=4 15437 B17R2.56628 O=C(NCCOC1CC1)c2ccc(cc2)Cl 128169c79ff7027a372a22dd2916c934 [0,1,0,1,0,0|2,0,0]=4 15438 B17R2.56628 O=C(NCCOC1CC1)c2ccc(cc2)F d91de387bb596d7de3a9171181a7596b [0,1,0,1,0,0|2,0,0]=4 15439 B17R2.56628 O=C(NCCOC1CC1)c2ccc(cc2)I 38111551ba9be958b6fd90ed866c88fa [0,1,0,1,0,0|2,0,0]=4 15440 B17R2.56628 O=C(NCCOC1CC1)c2ccc(cc2)O ac72b4fc84ec71b9984134d05d251793 [0,1,0,1,0,0|2,0,0]=4 15441 B17R2.56628 O=C(NCCOC1CC1)c2ccc(cc2)S efb965488552af3ef7923d79e4e2fa3e [0,1,0,1,0,0|2,0,0]=4 15442 B17R2.56628 O=C(OCNCC1CC1)c2ccc(cc2)F 02bb24bbdc7c82ac73ee950a8e81449b [0,1,0,1,0,0|1,0,0]=3 15443 B17R2.56628 O=C(OCOCC1CC1)c2ccc(cc2)F a0a1044637caa15e2a6bc797a2c38586 [0,1,0,1,0,0|1,0,0]=3 15444 B17R2.56639 CC(OCCC1CCC1)c2ccc(cc2)Br 5b8b47b18fc2e9fd4ad22c78dfb2b6bf [0,1,0,1,0,0|1,0,1]=4 15445 B17R2.56639 CC(OCCC1CCC1)c2ccc(cc2)Cl 5f2fed8f411ff29da84292d4c980c625 [0,1,0,1,0,0|1,0,1]=4 15446 B17R2.56639 CC(OCCC1CCC1)c2ccc(cc2)F 3066d1b45890f214b75c43ceb666d202 [0,1,0,1,0,0|1,0,1]=4 15447 B17R2.56639 CC(OCCC1CCC1)c2ccc(cc2)I c359c88142dda292d16bafbd79c9646b [0,1,0,1,0,0|1,0,1]=4 15448 B17R2.56639 C[C@@H](OCCC1CCC1)c2ccc(cc2)Br 8a07502da5c13bcf5946f9ffc7809f31 [0,1,0,1,0,0|1,0,1]=4 15449 B17R2.56639 C[C@@H](OCCC1CCC1)c2ccc(cc2)Cl 32e62b43bab0795abaf7ec613e91accd [0,1,0,1,0,0|1,0,1]=4 15450 B17R2.56639 C[C@@H](OCCC1CCC1)c2ccc(cc2)F 1aa419a51ff1e4ed14311b01db0834f1 [0,1,0,1,0,0|1,0,1]=4 15451 B17R2.56639 C[C@@H](OCCC1CCC1)c2ccc(cc2)I 5cf1733a94ab5d1e258f7ac609aba8ec [0,1,0,1,0,0|1,0,1]=4 15452 B17R2.56639 C[C@H](OCCC1CCC1)c2ccc(cc2)Br 4745f41825b8bdbfd3837d2d51268b32 [0,1,0,1,0,0|1,0,1]=4 15453 B17R2.56639 C[C@H](OCCC1CCC1)c2ccc(cc2)Cl 1a709a176a467c697e4ce04ef833554b [0,1,0,1,0,0|1,0,1]=4 15454 B17R2.56639 C[C@H](OCCC1CCC1)c2ccc(cc2)F fc4d52b88fe4e83c8c564983a9256f8c [0,1,0,1,0,0|1,0,1]=4 15455 B17R2.56639 C[C@H](OCCC1CCC1)c2ccc(cc2)I 6f299572a9a0474871c57fab1e2b2832 [0,1,0,1,0,0|1,0,1]=4 15456 B17R2.56639 Cc1ccc(cc1)C(=O)CCNC2CCC2 1c5b36520602c38dc88a2e54bc0151bc [0,1,0,1,0,0|2,0,0]=4 15457 B17R2.56639 Cc1ccc(cc1)C(=O)CCOC2CCC2 a7ee7e4cb1bed94a1dab33705e5443ac [0,1,0,1,0,0|2,0,0]=4 15458 B17R2.56639 Cc1ccc(cc1)C(=O)CNCC2CCC2 88aa39c43a07f26f0f8143642c85bcd8 [0,1,0,1,0,0|2,0,0]=4 15459 B17R2.56639 Cc1ccc(cc1)C(=O)COCC2CCC2 e7f2c69bdd95db93df7eccd082fee6df [0,1,0,1,0,0|2,0,0]=4 15460 B17R2.56639 Cc1ccc(cc1)C(=O)NCCC2CCC2 9ef7ed14698c512bab3895c872b07f74 [0,1,0,1,0,0|1,0,0]=3 15461 B17R2.56639 Cc1ccc(cc1)C(=O)NCCC2CCO2 9c325cf35bfc7f694fc644dd7c40a0a7 [0,1,0,1,0,0|2,0,0]=4 15462 B17R2.56639 Cc1ccc(cc1)C(=O)NCCC2COC2 c9d1347d77583c0bd774390f2f7c709f [0,1,0,1,0,0|2,0,0]=4 15463 B17R2.56639 Cc1ccc(cc1)C(=O)NCCN2CCC2 1edd1e34f93b249059c53d68a63b23a6 [0,1,0,1,0,0|2,0,0]=4 15464 B17R2.56639 Cc1ccc(cc1)C(=O)NCC[C@@H]2CCO2 f286ed2d806cf6b85b16520d97f25f7b [0,1,0,1,0,0|2,0,0]=4 15465 B17R2.56639 Cc1ccc(cc1)C(C)OCCC2CCC2 ca2d7e848fc2ac9dff002f3800cbca4b [0,1,0,1,0,0|1,0,1]=4 15466 B17R2.56639 Cc1ccc(cc1)[C@@H](C)OCCC2CCC2 0eefc6d5762ac9402956c7fd5e8b2808 [0,1,0,1,0,0|1,0,1]=4 15467 B17R2.56639 Cc1ccc(cc1)[C@H](C)OCCC2CCC2 bf73b071291c8593535cb9845f930448 [0,1,0,1,0,0|1,0,1]=4 15468 B17R2.56639 Cc1ccc(cn1)C(=O)NCCC2CCC2 5f6661828e95df7bee2e8cdff6970776 [0,1,0,1,0,0|2,0,0]=4 15469 B17R2.56639 Cc1ccc(nc1)C(=O)NCCC2CCC2 14860b6a91dbcd6947d3f525082227c9 [0,1,0,1,0,0|2,0,0]=4 15470 B17R2.56639 O=C(CCCN1CCC1)c2ccc(cc2)F 4fb8369f426486defaca5141318ca032 [0,1,0,1,0,0|2,0,0]=4 15471 B17R2.56639 O=C(CCNC1CCC1)c2ccc(cc2)Br cd94128f372ff1844048006018061d9e [0,1,0,1,0,0|2,0,0]=4 15472 B17R2.56639 O=C(CCNC1CCC1)c2ccc(cc2)F fa09b3fc77539b17ea6398d7d819aca8 [0,1,0,1,0,0|2,0,0]=4 15473 B17R2.56639 O=C(CCOC1CCC1)c2ccc(cc2)Br 9f77a94c336f8e418cf3673eac9cbe48 [0,1,0,1,0,0|2,0,0]=4 15474 B17R2.56639 O=C(CCOC1CCC1)c2ccc(cc2)Cl 651a648ad865fca139469b05316391b6 [0,1,0,1,0,0|2,0,0]=4 15475 B17R2.56639 O=C(CCOC1CCC1)c2ccc(cc2)F f28b7a85556ee004d3928cb82bf7e213 [0,1,0,1,0,0|2,0,0]=4 15476 B17R2.56639 O=C(CNCC1CCC1)c2ccc(cc2)Br 96877db79a80e40fcd35d92919fa99d6 [0,1,0,1,0,0|2,0,0]=4 15477 B17R2.56639 O=C(CNCC1CCC1)c2ccc(cc2)Cl ed05b55a0c5ca5818f683d661f5bf098 [0,1,0,1,0,0|2,0,0]=4 15478 B17R2.56639 O=C(CNCC1CCC1)c2ccc(cc2)F 8eae5c31e2d88a0be5fdf2141bda94f8 [0,1,0,1,0,0|2,0,0]=4 15479 B17R2.56639 O=C(CNCC1CCC1)c2ccc(cc2)I 0c7c98cf636966a1880d4356fad03823 [0,1,0,1,0,0|2,0,0]=4 15480 B17R2.56639 O=C(COCC1CCC1)c2ccc(cc2)Br c3c1b57a62ae7e1c0c9e2550fc462f3e [0,1,0,1,0,0|2,0,0]=4 15481 B17R2.56639 O=C(COCC1CCC1)c2ccc(cc2)Cl 4ad952bc55258e7031f6eefe15e37a6f [0,1,0,1,0,0|2,0,0]=4 15482 B17R2.56639 O=C(COCC1CCC1)c2ccc(cc2)F caa33b3633a6712ed5b1680cb2aa3c00 [0,1,0,1,0,0|2,0,0]=4 15483 B17R2.56639 O=C(COCC1CCC1)c2ccc(cc2)I b648e84f7f97f1edd73c61ac134da21f [0,1,0,1,0,0|2,0,0]=4 15484 B17R2.56639 O=C(NCCC1CCC1)c2cc[n+](cc2)[O-] 97630f61f3450392b24cb8e044fc59cb [0,1,0,1,0,0|2,0,0]=4 15485 B17R2.56639 O=C(NCCC1CCC1)c2ccc(=O)oc2 8595209c68717a38af30d2034fca8f1d [0,1,0,1,0,0|2,0,0]=4 15486 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cc2)Br b2e52c1d310c07e0400895c31c91e048 [0,1,0,1,0,0|1,0,0]=3 15487 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cc2)Cl 34279b0d5d94f5fc9f9c2d20620ad6ad [0,1,0,1,0,0|1,0,0]=3 15488 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cc2)F 0e3137a871025d874c983cad4a827078 [0,1,0,1,0,0|1,0,0]=3 15489 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cc2)I bd3d71cfdb15dabed9e46d93868a3c9c [0,1,0,1,0,0|1,0,0]=3 15490 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cc2)O 1aa17109217ffd2c0db4ae5c63b5e009 [0,1,0,1,0,0|1,0,0]=3 15491 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cc2)S 48b8fd0eb4b3c8259df7199f81d98e3b [0,1,0,1,0,0|1,0,0]=3 15492 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cn2)Br 27e64097883269c397b06dffd12b24b1 [0,1,0,1,0,0|2,0,0]=4 15493 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cn2)Cl 74446f1b7b12850a4f3142f5484099cc [0,1,0,1,0,0|2,0,0]=4 15494 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cn2)F f62cf102a46642dec184179b0f27850a [0,1,0,1,0,0|2,0,0]=4 15495 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cn2)I f3705c6d68c282e663bca49c75d82a8f [0,1,0,1,0,0|2,0,0]=4 15496 B17R2.56639 O=C(NCCC1CCC1)c2ccc(cn2)O 865cc6b5a90b72281371d9b01f3351d3 [0,1,0,1,0,0|2,0,0]=4 15497 B17R2.56639 O=C(NCCC1CCC1)c2ccc(nc2)Br 8f62aea3d8835a3407253a137823860f [0,1,0,1,0,0|2,0,0]=4 15498 B17R2.56639 O=C(NCCC1CCC1)c2ccc(nc2)Cl 0f214045f13fb25be9f0a74359ca5e14 [0,1,0,1,0,0|2,0,0]=4 15499 B17R2.56639 O=C(NCCC1CCC1)c2ccc(nc2)F da5d4299106dd6e0da7bda17370a46be [0,1,0,1,0,0|2,0,0]=4 15500 B17R2.56639 O=C(NCCC1CCC1)c2ccc(nc2)I b82f55b38a4219cbb37bf5660f515e6d [0,1,0,1,0,0|2,0,0]=4 15501 B17R2.56639 O=C(NCCC1CCC1)c2ccc(nc2)O 781f918769bcaac077bb01ac2bf6406e [0,1,0,1,0,0|2,0,0]=4 15502 B17R2.56639 O=C(NCCC1CCC1)c2ccc(nc2)S f9cdcd71b4398692f040f350b0f2b817 [0,1,0,1,0,0|2,0,0]=4 15503 B17R2.56639 O=C(NCCC1CCO1)c2ccc(cc2)Br dc8e3efe6759853c81f7ce81d5ef4442 [0,1,0,1,0,0|2,0,0]=4 15504 B17R2.56639 O=C(NCCC1CCO1)c2ccc(cc2)Cl 24ce1a9534d7f2ebc831f3a89715a312 [0,1,0,1,0,0|2,0,0]=4 15505 B17R2.56639 O=C(NCCC1CCO1)c2ccc(cc2)F ac8e6c843d3b7643d99a2ec6c71b24bb [0,1,0,1,0,0|2,0,0]=4 15506 B17R2.56639 O=C(NCCC1CCO1)c2ccc(cc2)I 00387635b2cdd7b67b7829865ce0f353 [0,1,0,1,0,0|2,0,0]=4 15507 B17R2.56639 O=C(NCCC1CCO1)c2ccc(cc2)O e7015a61dbaad6bc856c3798ce719936 [0,1,0,1,0,0|2,0,0]=4 15508 B17R2.56639 O=C(NCCC1CCO1)c2ccc(cc2)S d6b98260190c1a3e1bcc04cbffcf67c1 [0,1,0,1,0,0|2,0,0]=4 15509 B17R2.56639 O=C(NCCC1COC1)c2ccc(cc2)Br 5cb8fc157dcebd0778db51305309d6aa [0,1,0,1,0,0|2,0,0]=4 15510 B17R2.56639 O=C(NCCC1COC1)c2ccc(cc2)Cl 012e631efbba269b370a58079e374472 [0,1,0,1,0,0|2,0,0]=4 15511 B17R2.56639 O=C(NCCC1COC1)c2ccc(cc2)F 4d337c27335a93555f6d9962f30c5d1f [0,1,0,1,0,0|2,0,0]=4 15512 B17R2.56639 O=C(NCCC1COC1)c2ccc(cc2)I 75f215bdff926658ce80d24b04724bab [0,1,0,1,0,0|2,0,0]=4 15513 B17R2.56639 O=C(NCCC1COC1)c2ccc(cc2)O 0f42d81c097c4b886cee399317ce42a2 [0,1,0,1,0,0|2,0,0]=4 15514 B17R2.56639 O=C(NCCC1COC1)c2ccc(cc2)S d5a18decc278692553b9bce3ea822584 [0,1,0,1,0,0|2,0,0]=4 15515 B17R2.56639 O=C(NCCN1CCC1)c2ccc(cc2)Br fe1ed52457163e747babf992900d4032 [0,1,0,1,0,0|2,0,0]=4 15516 B17R2.56639 O=C(NCCN1CCC1)c2ccc(cc2)Cl e4dd814fc2613105bb083ce3ed55064b [0,1,0,1,0,0|2,0,0]=4 15517 B17R2.56639 O=C(NCCN1CCC1)c2ccc(cc2)F b74f0e98ea18a6430ad418b101ad1300 [0,1,0,1,0,0|2,0,0]=4 15518 B17R2.56639 O=C(NCCN1CCC1)c2ccc(cc2)I a120f586f6ce8f3163855707e8a0e53c [0,1,0,1,0,0|2,0,0]=4 15519 B17R2.56639 O=C(NCCN1CCC1)c2ccc(cc2)O 49b87222bbde36a746fdf4e41619f388 [0,1,0,1,0,0|2,0,0]=4 15520 B17R2.56639 O=C(NCCN1CCC1)c2ccc(cc2)S dddfa6a6eab65228a5e0863b2e1b75a5 [0,1,0,1,0,0|2,0,0]=4 15521 B17R2.56639 O=C(NCC[C@@H]1CCO1)c2ccc(cc2)Br 54db27482150c10994b10e2f2ae71f5e [0,1,0,1,0,0|2,0,0]=4 15522 B17R2.56639 O=C(NCC[C@@H]1CCO1)c2ccc(cc2)Cl 7ec8b796035e4dc77a4a96fc79ccb85c [0,1,0,1,0,0|2,0,0]=4 15523 B17R2.56639 O=C(NCC[C@@H]1CCO1)c2ccc(cc2)F b00f58763a7d7da5cf09143e1e94545c [0,1,0,1,0,0|2,0,0]=4 15524 B17R2.56639 O=C(NCC[C@@H]1CCO1)c2ccc(cc2)I 9541f1d3757f6de6ddccadd5f46263da [0,1,0,1,0,0|2,0,0]=4 15525 B17R2.56639 O=C(NCC[C@@H]1CCO1)c2ccc(cc2)O 44a003c39974c63dd11539940f321d68 [0,1,0,1,0,0|2,0,0]=4 15526 B17R2.56639 O=C(NCC[C@@H]1CCO1)c2ccc(cc2)S 96a1f4be5e871e9f4418add28ca0e63e [0,1,0,1,0,0|2,0,0]=4 15527 B17R2.56639 O=C(OCNC1CCC1)c2ccc(cc2)F cb5d739acb9e1ace32ff4d31efc63e1e [0,1,0,1,0,0|1,0,0]=3 15528 B17R2.56639 O=C(OCNC1COC1)c2ccc(cc2)F b84922f65828303b2d260b63b3cdc84d [0,1,0,1,0,0|2,0,0]=4 15529 B17R2.56639 O=C(OCOC1CCC1)c2ccc(cc2)F d26e1c3be6c6e7c45c1ff4021cf0716c [0,1,0,1,0,0|1,0,0]=3 15530 B17R2.56639 O=C(OCOC1COC1)c2ccc(cc2)F 0145770046012923f04ca6a533cc39ff [0,1,0,1,0,0|2,0,0]=4 15531 B17R2.56639 O=C(OCOC1CSC1)c2ccc(cc2)F 53c0d69ee8928b4940ce68bc07545c15 [0,1,0,1,0,0|2,0,0]=4 15532 B17R2.345884 CCCCN1CCC(=O)c2c1cc(cc2)Br 640c73fc460fb4ad46688e96833a21c5 [0,1,0,1,0,0|2,0,0]=4 15533 B17R2.345884 CCCCN1CCC(=O)c2c1cc(cc2)C f308d85fa3212688a7b0c44d7817e138 [0,1,0,1,0,0|2,0,0]=4 15534 B17R2.345884 CCCCN1CCC(=O)c2c1cc(cc2)Cl d5069fe0480cbbe06931fab173b97459 [0,1,0,1,0,0|2,0,0]=4 15535 B17R2.345884 CCCCN1CCC(=O)c2c1cc(cc2)F cd4925e53439047fa0edf1be9606c6fe [0,1,0,1,0,0|2,0,0]=4 15536 B17R2.533492 CCCN1CCNC(=O)c2c1cc(cc2)Br 000474ee6ecc94c8ef53ccb37ba7d964 [0,1,0,1,0,0|2,0,0]=4 15537 B17R2.982539 CCCCOC1NC(=O)c2c1cc(cc2)Br 1e684c7fe4b7ded1f3fe1eb00d4c6030 [0,1,0,1,0,0|2,0,0]=4 15538 B17R2.982539 CCCCOC1OC(=O)c2c1cc(cc2)Br a2eae69800aff46e9ea0d6502bd71a02 [0,1,0,1,0,0|1,0,0]=3 15539 B17R2.982539 COCCOC1OC(=O)c2c1cc(cc2)Br c4c6a019eede917f9a5980d02bcbf97e [0,1,0,1,0,0|2,0,0]=4 15540 B17R2.982539 CSCCOC1OC(=O)c2c1cc(cc2)Br 28f865c55e8b4d263520d7fc1f83f9b1 [0,1,0,1,0,0|2,0,0]=4 15541 B17R2.982539 O=C1OC(c2c1ccc(c2)Br)OCCCF 8737ac906281ab3aa8e4c586db82df74 [0,1,0,1,0,0|2,0,0]=4 15542 B17R2.982539 O=C1OC(c2c1ccc(c2)Br)OCCCS ef15ef502e4e55143d01b76730e05531 [0,1,0,1,0,0|2,0,0]=4 15543 B17R2.973 Cc1cccc(c1)C(=O)NCC2CC2CO 4bcf0ab8c874355c5f14fbeb8f4407ab [0,1,0,1,0,0|2,0,0]=4 15544 B17R2.973 O=C(NCC1CC1CO)c2cccc(c2)Br c4a7f05d7b0135fcf557fc38947c93f0 [0,1,0,1,0,0|2,0,0]=4 15545 B17R2.973 O=C(NCC1CC1CO)c2cccc(c2)Cl 5e78f4d6a5860cc5e5bee92a9d2e9c99 [0,1,0,1,0,0|2,0,0]=4 15546 B17R2.973 O=C(NCC1CC1CO)c2cccc(c2)F 9f652d8dceb79ebec3359974fa03a95c [0,1,0,1,0,0|2,0,0]=4 15547 B17R2.973 O=C(NCC1CC1CO)c2cccc(c2)I bc92899e2015cccd86bb379a123d2954 [0,1,0,1,0,0|2,0,0]=4 15548 B17R2.973 O=C(NCC1CC1CO)c2cccc(c2)O f6163bac7ed6dbe62c57b853b476b9aa [0,1,0,1,0,0|2,0,0]=4 15549 B17R2.973 O=C(NCC1CC1CO)c2cccc(c2)S 26890f099cf96ef77cda5ace98090217 [0,1,0,1,0,0|2,0,0]=4 15550 B17R2.1873 CCC1CCN1CC(=O)c2cccc(c2)Br 00d06549a6baba77b3a3197c5c6a0f10 [0,1,0,1,0,0|2,0,0]=4 15551 B17R2.1873 CCC1CCN1CC(=O)c2cccc(c2)C b32650d239c86862a1b15eaa31971fc7 [0,1,0,1,0,0|2,0,0]=4 15552 B17R2.1873 CCC1CCN1CC(=O)c2cccc(c2)Cl c777fff9dff3bde46ca5945776224fc4 [0,1,0,1,0,0|2,0,0]=4 15553 B17R2.1873 CCC1CCN1CC(=O)c2cccc(c2)F 7a8ff0af53b98647658b9910a088d889 [0,1,0,1,0,0|2,0,0]=4 15554 B17R2.1873 CCC1CCN1CC(=O)c2cccc(c2)I c53040a7c82a4b5eca875af3c8f8016d [0,1,0,1,0,0|2,0,0]=4 15555 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)Br 957b968c1e65ce0afedad3df4823d514 [0,1,0,1,0,0|2,0,0]=4 15556 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)C 6bf2e64e62f468f52237243d4dffdead [0,1,0,1,0,0|2,0,0]=4 15557 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)Cl 0a9b027955ac8f7a211a45f1e3cf3886 [0,1,0,1,0,0|2,0,0]=4 15558 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)F ce831d3b5392dde4db8b424a2d65d894 [0,1,0,1,0,0|2,0,0]=4 15559 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)I 3b61051fb7ad76f17671e0e323cabd20 [0,1,0,1,0,0|2,0,0]=4 15560 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)O ac38bd5b8bd0e17f2fcec607d817fb30 [0,1,0,1,0,0|2,0,0]=4 15561 B17R2.1873 COC1CCC1NC(=O)c2cccc(c2)S 162b841cf85996ccc4d46a63500dccd8 [0,1,0,1,0,0|2,0,0]=4 15562 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)Br 1d895d9214cdbccc2d08df4230618ec2 [0,1,0,1,0,0|2,0,0]=4 15563 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)C 0c9aff228b4d118e52c36c8a39b91e47 [0,1,0,1,0,0|2,0,0]=4 15564 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)Cl 3927416b657ea3bdcd2ac19f1f26877b [0,1,0,1,0,0|2,0,0]=4 15565 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)F 730be0989b1f941940ba43c122ff899a [0,1,0,1,0,0|2,0,0]=4 15566 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)I 85343991639a624698e636e2c98f12b0 [0,1,0,1,0,0|2,0,0]=4 15567 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)O 31cafc300f4a90331d045e2a34a4e681 [0,1,0,1,0,0|2,0,0]=4 15568 B17R2.1873 CO[C@@H]1CC[C@@H]1NC(=O)c2cccc(c2)S a8f212f1a8693213e3cac79e75c9d542 [0,1,0,1,0,0|2,0,0]=4 15569 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)Br cc08b5022de72d6b483782437b2bb458 [0,1,0,1,0,0|2,0,0]=4 15570 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)C 2fc3370d2bdd4bac57ae6618927bb484 [0,1,0,1,0,0|2,0,0]=4 15571 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)Cl 84f0390ebad82c90af88ae568c2cf08e [0,1,0,1,0,0|2,0,0]=4 15572 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)F 1566a6d7cb3cac62fe96a5031199ab48 [0,1,0,1,0,0|2,0,0]=4 15573 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)I ea2edf1720bd5c4ae6a20b9b860aad1b [0,1,0,1,0,0|2,0,0]=4 15574 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)O 98345d6545ed59333c87f4d650af675b [0,1,0,1,0,0|2,0,0]=4 15575 B17R2.1873 CO[C@@H]1CC[C@H]1NC(=O)c2cccc(c2)S 842e145a50b6a63a73c39e9b7deafde7 [0,1,0,1,0,0|2,0,0]=4 15576 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)Br 96867fa73b12828f8124737b06207067 [0,1,0,1,0,0|2,0,0]=4 15577 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)C 9647478e571363d2b662afef0d156543 [0,1,0,1,0,0|2,0,0]=4 15578 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)Cl 9c37d0d51f1ce21fcec6952093638e06 [0,1,0,1,0,0|2,0,0]=4 15579 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)F 66d115a3a831d918c5be44dcf71161ca [0,1,0,1,0,0|2,0,0]=4 15580 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)I 172e91cf252091a545bcf0c167ab4e97 [0,1,0,1,0,0|2,0,0]=4 15581 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)O 08ee229d95ea618a0d0626c42253bb1c [0,1,0,1,0,0|2,0,0]=4 15582 B17R2.1873 CO[C@H]1CC[C@@H]1NC(=O)c2cccc(c2)S d51a9789dda75a994a70cea2d348ceb4 [0,1,0,1,0,0|2,0,0]=4 15583 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)Br f0cc671f111358c9f0a8d0a44fee5302 [0,1,0,1,0,0|2,0,0]=4 15584 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)C e81107979d5b18736285f536dd3e9ad4 [0,1,0,1,0,0|2,0,0]=4 15585 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)Cl d77321791575712ff3647b33701696e3 [0,1,0,1,0,0|2,0,0]=4 15586 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)F e5d12bb3939a81257ae39c27be3d1125 [0,1,0,1,0,0|2,0,0]=4 15587 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)I ffd2058689a4399f67b1f48446835c08 [0,1,0,1,0,0|2,0,0]=4 15588 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)O 83e09d1cb509362996ea5d18a36b17bc [0,1,0,1,0,0|2,0,0]=4 15589 B17R2.1873 CO[C@H]1CC[C@H]1NC(=O)c2cccc(c2)S c62aac3594f0bb9b3bb66f582710134c [0,1,0,1,0,0|2,0,0]=4 15590 B17R2.2824 CCC1CCCN1C(=O)c2cc(=O)cco2 b6989ebc0d1283ee7b072164d9733b09 [0,1,0,1,0,0|2,0,0]=4 15591 B17R2.2824 CCC1CCCN1C(=O)c2cc(ccn2)Br b75a9756fc08f6d049cc5e0bc4c1f710 [0,1,0,1,0,0|2,0,0]=4 15592 B17R2.2824 CCC1CCCN1C(=O)c2cc(ccn2)C 57e361662d193c2c5633960f9276530d [0,1,0,1,0,0|2,0,0]=4 15593 B17R2.2824 CCC1CCCN1C(=O)c2cc(ccn2)Cl 268390a5837ba523fe67d6504544d659 [0,1,0,1,0,0|2,0,0]=4 15594 B17R2.2824 CCC1CCCN1C(=O)c2cc(ccn2)F f825c198a58d7461ae586053c532b2ff [0,1,0,1,0,0|2,0,0]=4 15595 B17R2.2824 CCC1CCCN1C(=O)c2cc(ccn2)I 0bd7d382c59beb7d2bda0976b8ba5825 [0,1,0,1,0,0|2,0,0]=4 15596 B17R2.2824 CCC1CCCN1C(=O)c2cc(ccn2)O 831108e8d162abecccf3e9181c58a68f [0,1,0,1,0,0|2,0,0]=4 15597 B17R2.2824 CCC1CCCN1C(=O)c2ccc[n+](c2)[O-] a7e44d1f8a2fe0fc60d8d2b811f93030 [0,1,0,1,0,0|2,0,0]=4 15598 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)Br af7b9ff3e8cf9e1b13932bc688546c59 [0,1,0,1,0,0|1,0,0]=3 15599 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)C f43b8370f3b2fdeaa7fe54943b251467 [0,1,0,1,0,0|1,0,0]=3 15600 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)Cl 88357ca7d13d85f30d8c42647a6842d6 [0,1,0,1,0,0|1,0,0]=3 15601 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)F 2bcf1fc44700d36d5fde34924d6f2f76 [0,1,0,1,0,0|1,0,0]=3 15602 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)I 68d9f0066b846301f8bc3b2dd58548db [0,1,0,1,0,0|1,0,0]=3 15603 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)O 498951296c803464baa276ba65db75e7 [0,1,0,1,0,0|1,0,0]=3 15604 B17R2.2824 CCC1CCCN1C(=O)c2cccc(c2)S 69b0fdd180cce73e15d1133d1c2fe65a [0,1,0,1,0,0|1,0,0]=3 15605 B17R2.2824 CCC1CCCN1C(=O)c2cccc(n2)Br ab60884dc410357bf0e8b3f3ed799d6e [0,1,0,1,0,0|2,0,0]=4 15606 B17R2.2824 CCC1CCCN1C(=O)c2cccc(n2)C 13f4e2a63422fd53ddb15f23abb701e9 [0,1,0,1,0,0|2,0,0]=4 15607 B17R2.2824 CCC1CCCN1C(=O)c2cccc(n2)Cl b17bb1c14077f41aaa8c55ade84aff4e [0,1,0,1,0,0|2,0,0]=4 15608 B17R2.2824 CCC1CCCN1C(=O)c2cccc(n2)F d1adfedf0021080407a7debccf6bf0a1 [0,1,0,1,0,0|2,0,0]=4 15609 B17R2.2824 CCC1CCCN1C(=O)c2cccc(n2)I 4c04cc8a8577a371c59cebc5df5177b6 [0,1,0,1,0,0|2,0,0]=4 15610 B17R2.2824 CCC1CCCN1C(=O)c2cccc(n2)O 8e99748ef7b3a3aa659c56c1ea299d0c [0,1,0,1,0,0|2,0,0]=4 15611 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)Br b460291efb5c6da7eaa4f8041fc4c5da [0,1,0,1,0,0|2,0,0]=4 15612 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)C 11fb7805458acf1314d4f4dd2c088f3b [0,1,0,1,0,0|2,0,0]=4 15613 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)Cl 2a8490bd9963690032850d8f0c0da1a7 [0,1,0,1,0,0|2,0,0]=4 15614 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)F 37eb64e186855d9271d6a033fb193690 [0,1,0,1,0,0|2,0,0]=4 15615 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)I 98c2a76ed2bbbcffa03aebbf84f73fa0 [0,1,0,1,0,0|2,0,0]=4 15616 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)O 60319391bcb244ac591892f0d9098e88 [0,1,0,1,0,0|2,0,0]=4 15617 B17R2.2824 CCC1CCCN1C(=O)c2ccnc(c2)S efb65de46332c5606278f370298ee387 [0,1,0,1,0,0|2,0,0]=4 15618 B17R2.2824 CCC1CCCN1C(=O)c2cncc(c2)Br ac868a38e4ef2db0eb5a7bfe945fab6d [0,1,0,1,0,0|2,0,0]=4 15619 B17R2.2824 CCC1CCCN1C(=O)c2cncc(c2)C 349aae2b43e136517a85fa69b655a01d [0,1,0,1,0,0|2,0,0]=4 15620 B17R2.2824 CCC1CCCN1C(=O)c2cncc(c2)Cl ab79eabb3398f3eea7ba8236b4fe09a1 [0,1,0,1,0,0|2,0,0]=4 15621 B17R2.2824 CCC1CCCN1C(=O)c2cncc(c2)F 196243bf46a2a05bf1611f186aacbe67 [0,1,0,1,0,0|2,0,0]=4 15622 B17R2.2824 CCC1CCCN1C(=O)c2cncc(c2)I 675ffd95ef68721eab04b2f5bf8c2d3d [0,1,0,1,0,0|2,0,0]=4 15623 B17R2.2824 CCC1CCCN1C(=O)c2cncc(c2)O 2b356cc0604ca6c6a15a4db6e05305c5 [0,1,0,1,0,0|2,0,0]=4 15624 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(=O)cco2 4171c6b7165679c8a7dd22fb9a287fd8 [0,1,0,1,0,0|2,0,0]=4 15625 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(ccn2)Br 13112f08e2310fa72d48188b37dd4782 [0,1,0,1,0,0|2,0,0]=4 15626 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(ccn2)C c80cd1f3621b3508847982d962ccbf61 [0,1,0,1,0,0|2,0,0]=4 15627 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(ccn2)Cl a1143324d86c4845bf99b61a146a750a [0,1,0,1,0,0|2,0,0]=4 15628 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(ccn2)F a513f32236c8b152db18547a547e0dee [0,1,0,1,0,0|2,0,0]=4 15629 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(ccn2)I 3568e276710f2d1445567496c661e804 [0,1,0,1,0,0|2,0,0]=4 15630 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cc(ccn2)O 4389305b8b7b62825b50c3c4c4889850 [0,1,0,1,0,0|2,0,0]=4 15631 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccc[n+](c2)[O-] 626d31dab513600f216beaf17b3dfe2e [0,1,0,1,0,0|2,0,0]=4 15632 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)Br 481144681843d2129d295668a15dad42 [0,1,0,1,0,0|1,0,0]=3 15633 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)C 2c402e5b1324cca5ec708f9869368a05 [0,1,0,1,0,0|1,0,0]=3 15634 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)Cl d5f2a8e1e1a4aab369365608dd0963e0 [0,1,0,1,0,0|1,0,0]=3 15635 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)F dbafb28acd8ba6ce61e29666a7fbb42e [0,1,0,1,0,0|1,0,0]=3 15636 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)I 21b48db82cc02a592eda7c4823049803 [0,1,0,1,0,0|1,0,0]=3 15637 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)O aadc5ab7050b52911a5da83635370ce3 [0,1,0,1,0,0|1,0,0]=3 15638 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(c2)S 9b2d5c78d4f2a626db7986e9507edf31 [0,1,0,1,0,0|1,0,0]=3 15639 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(n2)Br 699365c8e67954421a9955b75acdf200 [0,1,0,1,0,0|2,0,0]=4 15640 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(n2)C a8f8ebac505d0ee66d6796549fbc8295 [0,1,0,1,0,0|2,0,0]=4 15641 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(n2)Cl ab9ce03d150f36d81985b11a2a357292 [0,1,0,1,0,0|2,0,0]=4 15642 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(n2)F 4eeba885bf8f8958d10f7406caaf1dc0 [0,1,0,1,0,0|2,0,0]=4 15643 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(n2)I 6c2765d2658c554d8abbcc8885069de6 [0,1,0,1,0,0|2,0,0]=4 15644 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cccc(n2)O 051afad3c890791381ad80f2c473ac7c [0,1,0,1,0,0|2,0,0]=4 15645 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)Br 3ded0a6adceade691808194a8e27e1a0 [0,1,0,1,0,0|2,0,0]=4 15646 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)C 3da3bf18b1a4b68e0e944c8f2f9b0a29 [0,1,0,1,0,0|2,0,0]=4 15647 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)Cl a57ac541c620974de0b6e7e2c03ced5b [0,1,0,1,0,0|2,0,0]=4 15648 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)F 747181d8ec9a6b035aff21a7781743aa [0,1,0,1,0,0|2,0,0]=4 15649 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)I 161e3bbff0d2ba373dd1b83a5a3dae7c [0,1,0,1,0,0|2,0,0]=4 15650 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)O d9d57af7321031e15a6abe976d365e8b [0,1,0,1,0,0|2,0,0]=4 15651 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2ccnc(c2)S 2912d5864a44f4688e59e4decdcebc68 [0,1,0,1,0,0|2,0,0]=4 15652 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cncc(c2)Br 5a053afcda33062e2fb089629fba85ca [0,1,0,1,0,0|2,0,0]=4 15653 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cncc(c2)C 0e26cdf0e49d79c35aa5266d436d06f8 [0,1,0,1,0,0|2,0,0]=4 15654 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cncc(c2)Cl 324bcf48d0933c8a231fce5d50b2eab1 [0,1,0,1,0,0|2,0,0]=4 15655 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cncc(c2)F 3b9e9746f02c593de590215e3fd2ce02 [0,1,0,1,0,0|2,0,0]=4 15656 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cncc(c2)I 7825b7851aabda6d50872e955bb24364 [0,1,0,1,0,0|2,0,0]=4 15657 B17R2.2824 CC[C@@H]1CCCN1C(=O)c2cncc(c2)O 9578c71289ae1cdf657e3a8b6cac4cfb [0,1,0,1,0,0|2,0,0]=4 15658 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)Br 9aa00b3bb455278144cb2b45ff2646ff [0,1,0,1,0,0|2,0,0]=4 15659 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)C efbc7e15aa727eae707ba5d5b4e07c2e [0,1,0,1,0,0|2,0,0]=4 15660 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)Cl 8942c0dfde54f29501d79ad099dfbb69 [0,1,0,1,0,0|2,0,0]=4 15661 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)F 3773502d379b82097ffb950db5d99c88 [0,1,0,1,0,0|2,0,0]=4 15662 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)I ade1e42eacf69d17e181bbd933f20cdf [0,1,0,1,0,0|2,0,0]=4 15663 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)O 41f0ddce126d6c84da82ee21a3a9101d [0,1,0,1,0,0|2,0,0]=4 15664 B17R2.2824 COC1CCCN1C(=O)c2cccc(c2)S f50366864280afc79f47f96d18f075b6 [0,1,0,1,0,0|2,0,0]=4 15665 B17R2.2824 Cc1cccc(c1)C(=O)N2CCCC2CO 5ccff6e72d83663d2fadcad0a9da03a8 [0,1,0,1,0,0|2,0,0]=4 15666 B17R2.2824 Cc1cccc(c1)C(=O)N2CCC[C@@H]2CF 223873598c3bd7f9af10db7210550ccd [0,1,0,1,0,0|2,0,0]=4 15667 B17R2.2824 Cc1cccc(c1)C(=O)N2CCC[C@@H]2CO fef0283e32ffc83127c96e734be7f07b [0,1,0,1,0,0|2,0,0]=4 15668 B17R2.2824 Cc1cccc(c1)C(=O)N2CCC[C@H]2CF f791ce81866da68b8f1b1ba587244369 [0,1,0,1,0,0|2,0,0]=4 15669 B17R2.2824 Cc1cccc(c1)C(=O)N2CCC[C@H]2CO b9463d2d1ea0981b9d9ebbcbd5d414ee [0,1,0,1,0,0|2,0,0]=4 15670 B17R2.2824 O=C(c1cccc(c1)Br)N2CCCC2CO 4918a5522548979634cf6d8eda5291f9 [0,1,0,1,0,0|2,0,0]=4 15671 B17R2.2824 O=C(c1cccc(c1)Br)N2CCC[C@@H]2CF 57318b222ae7d7090a513cf086596e29 [0,1,0,1,0,0|2,0,0]=4 15672 B17R2.2824 O=C(c1cccc(c1)Br)N2CCC[C@@H]2CO 68a59bdb7dfa9b74093987ddeb8b5648 [0,1,0,1,0,0|2,0,0]=4 15673 B17R2.2824 O=C(c1cccc(c1)Br)N2CCC[C@H]2CF 75b748566b6fcdc756a94e584bf541fe [0,1,0,1,0,0|2,0,0]=4 15674 B17R2.2824 O=C(c1cccc(c1)Br)N2CCC[C@H]2CO a2b101cf585732dd21904e6820785b4a [0,1,0,1,0,0|2,0,0]=4 15675 B17R2.2824 O=C(c1cccc(c1)Cl)N2CCCC2CO c4632bfc46ccc592d3ef4acab5ab7379 [0,1,0,1,0,0|2,0,0]=4 15676 B17R2.2824 O=C(c1cccc(c1)Cl)N2CCC[C@@H]2CF 80cfa516a6fda2b86a73e0f7ccd7fef2 [0,1,0,1,0,0|2,0,0]=4 15677 B17R2.2824 O=C(c1cccc(c1)Cl)N2CCC[C@@H]2CO d7ea4118794a80dc438cdbbc71ed49ff [0,1,0,1,0,0|2,0,0]=4 15678 B17R2.2824 O=C(c1cccc(c1)Cl)N2CCC[C@H]2CF 38fa064f5882a5380417ea16be7b6d7b [0,1,0,1,0,0|2,0,0]=4 15679 B17R2.2824 O=C(c1cccc(c1)Cl)N2CCC[C@H]2CO 98dfb9f156c9355a7596359c19141d63 [0,1,0,1,0,0|2,0,0]=4 15680 B17R2.2824 O=C(c1cccc(c1)F)N2CCCC2CO d26f99baca9a83f3f506de20aba57a05 [0,1,0,1,0,0|2,0,0]=4 15681 B17R2.2824 O=C(c1cccc(c1)F)N2CCC[C@@H]2CF 168f18df83123f272beca1e51e52b898 [0,1,0,1,0,0|2,0,0]=4 15682 B17R2.2824 O=C(c1cccc(c1)F)N2CCC[C@@H]2CO ddd8b028fad1a03d5869b6d5c0fd367f [0,1,0,1,0,0|2,0,0]=4 15683 B17R2.2824 O=C(c1cccc(c1)F)N2CCC[C@H]2CF c168c5e3ca54ea43a23228fe23192d59 [0,1,0,1,0,0|2,0,0]=4 15684 B17R2.2824 O=C(c1cccc(c1)F)N2CCC[C@H]2CO c6b18ba88e1c0220c7aace2f62100813 [0,1,0,1,0,0|2,0,0]=4 15685 B17R2.2824 O=C(c1cccc(c1)I)N2CCCC2CO 33ecb72359a9a2b7c9b370c4825f8e45 [0,1,0,1,0,0|2,0,0]=4 15686 B17R2.2824 O=C(c1cccc(c1)I)N2CCC[C@@H]2CF 38d1da576869767570bdb240c5a945da [0,1,0,1,0,0|2,0,0]=4 15687 B17R2.2824 O=C(c1cccc(c1)I)N2CCC[C@@H]2CO b535cbc73e18ca3d550c69ba54c523a6 [0,1,0,1,0,0|2,0,0]=4 15688 B17R2.2824 O=C(c1cccc(c1)I)N2CCC[C@H]2CF 36bac586b24a34ee0c9b51c304366c29 [0,1,0,1,0,0|2,0,0]=4 15689 B17R2.2824 O=C(c1cccc(c1)I)N2CCC[C@H]2CO caad79bd58e7ee4f02ad1fdf68896122 [0,1,0,1,0,0|2,0,0]=4 15690 B17R2.2824 O=C(c1cccc(c1)O)N2CCCC2CO 4f83a291576c4d0cffc2131fb4644b70 [0,1,0,1,0,0|2,0,0]=4 15691 B17R2.2824 O=C(c1cccc(c1)O)N2CCC[C@@H]2CF b1391ebb9892a007bb7336aa84f8fe69 [0,1,0,1,0,0|2,0,0]=4 15692 B17R2.2824 O=C(c1cccc(c1)O)N2CCC[C@@H]2CO ffe9540ebef6cbc74fa543e34696ae67 [0,1,0,1,0,0|2,0,0]=4 15693 B17R2.2824 O=C(c1cccc(c1)O)N2CCC[C@H]2CF 23f2038df4665b8ce06c4c517803b983 [0,1,0,1,0,0|2,0,0]=4 15694 B17R2.2824 O=C(c1cccc(c1)O)N2CCC[C@H]2CO 69ee9cb78546d21114ff73c462626308 [0,1,0,1,0,0|2,0,0]=4 15695 B17R2.2824 O=C(c1cccc(c1)S)N2CCCC2CO 586174d4a3386205d7a8e80472c5f995 [0,1,0,1,0,0|2,0,0]=4 15696 B17R2.2824 O=C(c1cccc(c1)S)N2CCC[C@@H]2CF d18023c423784b2fbc564c5c6674b012 [0,1,0,1,0,0|2,0,0]=4 15697 B17R2.2824 O=C(c1cccc(c1)S)N2CCC[C@@H]2CO ece725ea5afd36eb1ac5ba0c159193f4 [0,1,0,1,0,0|2,0,0]=4 15698 B17R2.2824 O=C(c1cccc(c1)S)N2CCC[C@H]2CF afb85d87974adbbd5f19070dbe87708f [0,1,0,1,0,0|2,0,0]=4 15699 B17R2.2824 O=C(c1cccc(c1)S)N2CCC[C@H]2CO 90ea5a48e14975aa5fbae48d8a3bfa87 [0,1,0,1,0,0|2,0,0]=4 15700 B17R2.3378 CC(OCC1CCCC1)c2cccc(c2)Br 5d3f1284e7667b3b39541f9f4b1625ab [0,1,0,1,0,0|1,0,1]=4 15701 B17R2.3378 CC(OCC1CCCC1)c2cccc(c2)Cl 6c7af3aab2b12bcf916c31778a1dff90 [0,1,0,1,0,0|1,0,1]=4 15702 B17R2.3378 CC(OCC1CCCC1)c2cccc(c2)F 5e5bfc4a04b3565c23273b642e65fac2 [0,1,0,1,0,0|1,0,1]=4 15703 B17R2.3378 CC(OCC1CCCC1)c2cccc(c2)I aea4986a8fd8cd275cd11156ca88e4ce [0,1,0,1,0,0|1,0,1]=4 15704 B17R2.3378 C[C@@H](OCC1CCCC1)c2cccc(c2)Br fd0d81aea596426620199e720614e3cf [0,1,0,1,0,0|1,0,1]=4 15705 B17R2.3378 C[C@@H](OCC1CCCC1)c2cccc(c2)Cl ed3621505113f26bc90216e595bf3328 [0,1,0,1,0,0|1,0,1]=4 15706 B17R2.3378 C[C@@H](OCC1CCCC1)c2cccc(c2)F 86462b20ce0a81011f082cc14b74b360 [0,1,0,1,0,0|1,0,1]=4 15707 B17R2.3378 C[C@H](OCC1CCCC1)c2cccc(c2)Br 8c5343db5d81ba189e40e319a83231cf [0,1,0,1,0,0|1,0,1]=4 15708 B17R2.3378 C[C@H](OCC1CCCC1)c2cccc(c2)Cl f72fefbd8f24e53e2d98bb74d7bc5821 [0,1,0,1,0,0|1,0,1]=4 15709 B17R2.3378 C[C@H](OCC1CCCC1)c2cccc(c2)F 1006e3aec2405c369d603e06f3be8db0 [0,1,0,1,0,0|1,0,1]=4 15710 B17R2.3378 Cc1cc(ccn1)C(=O)NCC2CCCC2 6b8c8cb2cf41a87fe8fc17c359fa8957 [0,1,0,1,0,0|2,0,0]=4 15711 B17R2.3378 Cc1cccc(c1)C(=O)CNC2CCCC2 5609b97c001d09721d24aacdbf83192a [0,1,0,1,0,0|2,0,0]=4 15712 B17R2.3378 Cc1cccc(c1)C(=O)COC2CCCC2 c416d0a7ff3ebac09fb3c51e82c8e8d0 [0,1,0,1,0,0|2,0,0]=4 15713 B17R2.3378 Cc1cccc(c1)C(=O)NCC2CCCC2 5e6fc7f2bda94733f6a4babb04076e12 [0,1,0,1,0,0|1,0,0]=3 15714 B17R2.3378 Cc1cccc(c1)C(=O)NCC2CCCO2 718df1784f2306557e9c84887e7a797f [0,1,0,1,0,0|2,0,0]=4 15715 B17R2.3378 Cc1cccc(c1)C(=O)NCC2CCOC2 6c019dee0cf346f4030ef8091a35de26 [0,1,0,1,0,0|2,0,0]=4 15716 B17R2.3378 Cc1cccc(c1)C(=O)NC[C@@H]2CCCO2 f4aa38f9e75cd888f985a80fcd4830d0 [0,1,0,1,0,0|2,0,0]=4 15717 B17R2.3378 Cc1cccc(c1)C(=O)NC[C@@H]2CCOC2 98a7e803f8db213f20b4549b90258a92 [0,1,0,1,0,0|2,0,0]=4 15718 B17R2.3378 Cc1cccc(c1)C(=O)NC[C@H]2CCCO2 b60d39826526d65e5a19bfe758f8d79b [0,1,0,1,0,0|2,0,0]=4 15719 B17R2.3378 Cc1cccc(c1)C(=O)NC[C@H]2CCOC2 dffb5d07b3c183916d08a34241470e92 [0,1,0,1,0,0|2,0,0]=4 15720 B17R2.3378 Cc1cccc(c1)C(C)OCC2CCCC2 6ee388d8f10de447b55045ca4084c468 [0,1,0,1,0,0|1,0,1]=4 15721 B17R2.3378 Cc1cccc(c1)[C@@H](C)OCC2CCCC2 b2c72ba18ba5617b39980679a8dc2a6a [0,1,0,1,0,0|1,0,1]=4 15722 B17R2.3378 Cc1cccc(c1)[C@H](C)OCC2CCCC2 d99c17ee5ace8cf94f5abe5cc2cd5cf5 [0,1,0,1,0,0|1,0,1]=4 15723 B17R2.3378 Cc1cccc(n1)C(=O)NCC2CCCC2 1993656bde010112e02664a5df15cac0 [0,1,0,1,0,0|2,0,0]=4 15724 B17R2.3378 Cc1ccnc(c1)C(=O)NCC2CCCC2 d58f08dd619784407dd016f312e231fc [0,1,0,1,0,0|2,0,0]=4 15725 B17R2.3378 Cc1cncc(c1)C(=O)NCC2CCCC2 613c5867a8d1aae88ae3fbd4421d0152 [0,1,0,1,0,0|2,0,0]=4 15726 B17R2.3378 O=C(CNC1CCCC1)c2cccc(c2)Br c6a44b3d3ff1c08753c02aeecc7764e4 [0,1,0,1,0,0|2,0,0]=4 15727 B17R2.3378 O=C(CNC1CCCC1)c2cccc(c2)Cl 78b09188e8189238b3889c2d2cccd20e [0,1,0,1,0,0|2,0,0]=4 15728 B17R2.3378 O=C(CNC1CCCC1)c2cccc(c2)F ef04e068c23fa7bce2d5e0307d040a65 [0,1,0,1,0,0|2,0,0]=4 15729 B17R2.3378 O=C(CNC1CCCC1)c2cccc(c2)I 8ca4212534c5982c8a9636c1856eb65c [0,1,0,1,0,0|2,0,0]=4 15730 B17R2.3378 O=C(COC1CCCC1)c2cccc(c2)Br 4a098190b0b4fd5b5af34afb97b2e0b4 [0,1,0,1,0,0|2,0,0]=4 15731 B17R2.3378 O=C(COC1CCCC1)c2cccc(c2)Cl 87c32ccc28e631763495452a6f33eb4f [0,1,0,1,0,0|2,0,0]=4 15732 B17R2.3378 O=C(COC1CCCC1)c2cccc(c2)F 43836983ea3c1eebe991d68255cc827c [0,1,0,1,0,0|2,0,0]=4 15733 B17R2.3378 O=C(COC1CCCC1)c2cccc(c2)I fc26099109e336413805974dd2e5e6af [0,1,0,1,0,0|2,0,0]=4 15734 B17R2.3378 O=C(NCC1CCCC1)c2cc(=O)cco2 90a51378e1b0636e14e429c092113290 [0,1,0,1,0,0|2,0,0]=4 15735 B17R2.3378 O=C(NCC1CCCC1)c2cc(ccn2)Br 954fbc0c53e5c3a6ead5e3d5a5ee5882 [0,1,0,1,0,0|2,0,0]=4 15736 B17R2.3378 O=C(NCC1CCCC1)c2cc(ccn2)Cl 26dd01f4e2fdafac3ecd69050b348867 [0,1,0,1,0,0|2,0,0]=4 15737 B17R2.3378 O=C(NCC1CCCC1)c2cc(ccn2)F 54d958c60c1c6c76b943ca4ac03ca094 [0,1,0,1,0,0|2,0,0]=4 15738 B17R2.3378 O=C(NCC1CCCC1)c2cc(ccn2)I 4f2a34e899f902a31dd48cc14d087864 [0,1,0,1,0,0|2,0,0]=4 15739 B17R2.3378 O=C(NCC1CCCC1)c2cc(ccn2)O a7ac46f3f5374e0f0b626dc7d40e748f [0,1,0,1,0,0|2,0,0]=4 15740 B17R2.3378 O=C(NCC1CCCC1)c2ccc[n+](c2)[O-] 00626454f609e78d0ad4a09f5184336b [0,1,0,1,0,0|2,0,0]=4 15741 B17R2.3378 O=C(NCC1CCCC1)c2cccc(c2)Br 67d90407ea8a5d1b65b9e0726d4e8e06 [0,1,0,1,0,0|1,0,0]=3 15742 B17R2.3378 O=C(NCC1CCCC1)c2cccc(c2)Cl ec8386cbfee66539edebebadfdbc4b4c [0,1,0,1,0,0|1,0,0]=3 15743 B17R2.3378 O=C(NCC1CCCC1)c2cccc(c2)F b323c86bbb46ef4e8e9b41c8d1937a92 [0,1,0,1,0,0|1,0,0]=3 15744 B17R2.3378 O=C(NCC1CCCC1)c2cccc(c2)I d1ec2f36a93a586d4ebc35e78fc29237 [0,1,0,1,0,0|1,0,0]=3 15745 B17R2.3378 O=C(NCC1CCCC1)c2cccc(c2)O 118a2573bab3ed5b53f9164c77806a73 [0,1,0,1,0,0|1,0,0]=3 15746 B17R2.3378 O=C(NCC1CCCC1)c2cccc(c2)S 23e5ac47f2bc09ec9e8bf9ef5bb1add7 [0,1,0,1,0,0|1,0,0]=3 15747 B17R2.3378 O=C(NCC1CCCC1)c2cccc(n2)Br 6920dde0c5e1e883c1a5cd7babd3b774 [0,1,0,1,0,0|2,0,0]=4 15748 B17R2.3378 O=C(NCC1CCCC1)c2cccc(n2)Cl 9233c03dc025fc480f21eefbaefc17cd [0,1,0,1,0,0|2,0,0]=4 15749 B17R2.3378 O=C(NCC1CCCC1)c2cccc(n2)F b022319424c52735cefe64fc4d347fd1 [0,1,0,1,0,0|2,0,0]=4 15750 B17R2.3378 O=C(NCC1CCCC1)c2cccc(n2)I 07507626cde3c0995283ac1b670e5395 [0,1,0,1,0,0|2,0,0]=4 15751 B17R2.3378 O=C(NCC1CCCC1)c2cccc(n2)O 24d916e6148164bce0397597edd6bba6 [0,1,0,1,0,0|2,0,0]=4 15752 B17R2.3378 O=C(NCC1CCCC1)c2ccnc(c2)Br 6d6c2f905fbc2e22a514b9a232c1bd83 [0,1,0,1,0,0|2,0,0]=4 15753 B17R2.3378 O=C(NCC1CCCC1)c2ccnc(c2)Cl 571e0d1cba7b57ee14287a050b987df6 [0,1,0,1,0,0|2,0,0]=4 15754 B17R2.3378 O=C(NCC1CCCC1)c2ccnc(c2)F c15f48779b7b08134062555e12fea418 [0,1,0,1,0,0|2,0,0]=4 15755 B17R2.3378 O=C(NCC1CCCC1)c2ccnc(c2)I f3a4e0e6962e46a791426dce6c438cde [0,1,0,1,0,0|2,0,0]=4 15756 B17R2.3378 O=C(NCC1CCCC1)c2ccnc(c2)O 5abc22d378a70abe1253d26e435b239b [0,1,0,1,0,0|2,0,0]=4 15757 B17R2.3378 O=C(NCC1CCCC1)c2ccnc(c2)S 2430d10f529ddaff8fff1bde91c82b4e [0,1,0,1,0,0|2,0,0]=4 15758 B17R2.3378 O=C(NCC1CCCC1)c2cncc(c2)Br c984673964b4f1e835539bbd6583fe5e [0,1,0,1,0,0|2,0,0]=4 15759 B17R2.3378 O=C(NCC1CCCC1)c2cncc(c2)Cl 57e0992c4584d20f1b6c455191d28656 [0,1,0,1,0,0|2,0,0]=4 15760 B17R2.3378 O=C(NCC1CCCC1)c2cncc(c2)F 168db04d08c3fa4f4b46c58037f001c7 [0,1,0,1,0,0|2,0,0]=4 15761 B17R2.3378 O=C(NCC1CCCC1)c2cncc(c2)I edda66178511c001c284aeca737cbbfe [0,1,0,1,0,0|2,0,0]=4 15762 B17R2.3378 O=C(NCC1CCCC1)c2cncc(c2)O b8f9acd5df6161fa3ed18304601c5729 [0,1,0,1,0,0|2,0,0]=4 15763 B17R2.3378 O=C(NCC1CCCO1)c2cccc(c2)Br 8e0409e891a33326373376a563dac099 [0,1,0,1,0,0|2,0,0]=4 15764 B17R2.3378 O=C(NCC1CCCO1)c2cccc(c2)Cl 05551e5d70cd919ac988ff5c47dd63ea [0,1,0,1,0,0|2,0,0]=4 15765 B17R2.3378 O=C(NCC1CCCO1)c2cccc(c2)F e1d06cbdf7ff7b4c571f5d44b818a327 [0,1,0,1,0,0|2,0,0]=4 15766 B17R2.3378 O=C(NCC1CCCO1)c2cccc(c2)I b698d4064d4e9a0a477d6cb1d421fd45 [0,1,0,1,0,0|2,0,0]=4 15767 B17R2.3378 O=C(NCC1CCCO1)c2cccc(c2)O 387dc9dfc8ea1b6549f6de2b907c86df [0,1,0,1,0,0|2,0,0]=4 15768 B17R2.3378 O=C(NCC1CCCO1)c2cccc(c2)S 6a976424050cd6d58ef54ca1d9098d46 [0,1,0,1,0,0|2,0,0]=4 15769 B17R2.3378 O=C(NCC1CCOC1)c2cccc(c2)Br 4817ae6ad74eb2da29098ee59abb66ec [0,1,0,1,0,0|2,0,0]=4 15770 B17R2.3378 O=C(NCC1CCOC1)c2cccc(c2)Cl 5d54fc5b85b94178e32969a9fa8c77dd [0,1,0,1,0,0|2,0,0]=4 15771 B17R2.3378 O=C(NCC1CCOC1)c2cccc(c2)F ded33244344e8d6ad1e12b380c4485c0 [0,1,0,1,0,0|2,0,0]=4 15772 B17R2.3378 O=C(NCC1CCOC1)c2cccc(c2)I 4a0d94ff129b01d9d5a17bc28d19a335 [0,1,0,1,0,0|2,0,0]=4 15773 B17R2.3378 O=C(NCC1CCOC1)c2cccc(c2)O 945093d1da15724710984d740f8b1f99 [0,1,0,1,0,0|2,0,0]=4 15774 B17R2.3378 O=C(NCC1CCOC1)c2cccc(c2)S 0e7ae5dd87127f0d8d518d333c09cb82 [0,1,0,1,0,0|2,0,0]=4 15775 B17R2.3378 O=C(NC[C@@H]1CCCO1)c2cccc(c2)Br f45cbcad8aa5c882a0f0c997e3488be5 [0,1,0,1,0,0|2,0,0]=4 15776 B17R2.3378 O=C(NC[C@@H]1CCCO1)c2cccc(c2)Cl b1091382353e0b43b7c9ddd58668ed2f [0,1,0,1,0,0|2,0,0]=4 15777 B17R2.3378 O=C(NC[C@@H]1CCCO1)c2cccc(c2)F 6fba3a3f4e621fe19247cff3f4f08776 [0,1,0,1,0,0|2,0,0]=4 15778 B17R2.3378 O=C(NC[C@@H]1CCCO1)c2cccc(c2)I 51af944d88a0d3983839ba5b54868703 [0,1,0,1,0,0|2,0,0]=4 15779 B17R2.3378 O=C(NC[C@@H]1CCCO1)c2cccc(c2)O 6b29ed14ddbff6bd6dd401ef035991c4 [0,1,0,1,0,0|2,0,0]=4 15780 B17R2.3378 O=C(NC[C@@H]1CCCO1)c2cccc(c2)S ea370896db1475c276426df4f54ca8c8 [0,1,0,1,0,0|2,0,0]=4 15781 B17R2.3378 O=C(NC[C@@H]1CCOC1)c2cccc(c2)Br 5793fc8ca7ce3b7d388cf174bda6f144 [0,1,0,1,0,0|2,0,0]=4 15782 B17R2.3378 O=C(NC[C@@H]1CCOC1)c2cccc(c2)Cl 38ac894a59b8011711a92eb2593bdbfd [0,1,0,1,0,0|2,0,0]=4 15783 B17R2.3378 O=C(NC[C@@H]1CCOC1)c2cccc(c2)F d4e208a8dc823d083b417bcba65a9aee [0,1,0,1,0,0|2,0,0]=4 15784 B17R2.3378 O=C(NC[C@@H]1CCOC1)c2cccc(c2)I 8a2595ea90a7e691efd664ce3610ae3f [0,1,0,1,0,0|2,0,0]=4 15785 B17R2.3378 O=C(NC[C@@H]1CCOC1)c2cccc(c2)O d1f158bc670de49ea5ef255644cc9e52 [0,1,0,1,0,0|2,0,0]=4 15786 B17R2.3378 O=C(NC[C@@H]1CCOC1)c2cccc(c2)S fbcdcf0c2cdce60909b533b14e62f9da [0,1,0,1,0,0|2,0,0]=4 15787 B17R2.3378 O=C(NC[C@H]1CCCO1)c2cccc(c2)Br b1138725fc36c5f81867db2273220929 [0,1,0,1,0,0|2,0,0]=4 15788 B17R2.3378 O=C(NC[C@H]1CCCO1)c2cccc(c2)Cl db65cdb5d9d4b0de9848044039c5d457 [0,1,0,1,0,0|2,0,0]=4 15789 B17R2.3378 O=C(NC[C@H]1CCCO1)c2cccc(c2)F 63f59022a20d12abe88bff125299cb52 [0,1,0,1,0,0|2,0,0]=4 15790 B17R2.3378 O=C(NC[C@H]1CCCO1)c2cccc(c2)I 36b248a79f802fb6b2f38a5b07683ff3 [0,1,0,1,0,0|2,0,0]=4 15791 B17R2.3378 O=C(NC[C@H]1CCCO1)c2cccc(c2)O d4cdcc67a52c870be9da960ea1d66aab [0,1,0,1,0,0|2,0,0]=4 15792 B17R2.3378 O=C(NC[C@H]1CCCO1)c2cccc(c2)S 92f2cc2b05864da2d30a050c8d72e366 [0,1,0,1,0,0|2,0,0]=4 15793 B17R2.3378 O=C(NC[C@H]1CCOC1)c2cccc(c2)Br 7563ab5259cf44c7254a6348603ced8c [0,1,0,1,0,0|2,0,0]=4 15794 B17R2.3378 O=C(NC[C@H]1CCOC1)c2cccc(c2)Cl afbe2d2c74496499012b6b5e67e3393d [0,1,0,1,0,0|2,0,0]=4 15795 B17R2.3378 O=C(NC[C@H]1CCOC1)c2cccc(c2)F 509f67878fb7b5701bd737ac4c3c4fe2 [0,1,0,1,0,0|2,0,0]=4 15796 B17R2.3378 O=C(NC[C@H]1CCOC1)c2cccc(c2)I d69b2004babb5c6320eee4dc824e69be [0,1,0,1,0,0|2,0,0]=4 15797 B17R2.3378 O=C(NC[C@H]1CCOC1)c2cccc(c2)O a3fc18de4f5f452a99258834456c266e [0,1,0,1,0,0|2,0,0]=4 15798 B17R2.3378 O=C(NC[C@H]1CCOC1)c2cccc(c2)S 0337714309a6d38c287e473c26a4224c [0,1,0,1,0,0|2,0,0]=4 15799 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)Br f11f872491ea02d600bb08446db18fd7 [0,1,0,1,0,0|2,0,0]=4 15800 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)C 9fe0aec9ee3e5c22fca97b24a0c5c03b [0,1,0,1,0,0|2,0,0]=4 15801 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)Cl 3c8c513e5c90cc3d222ee846b51826e4 [0,1,0,1,0,0|2,0,0]=4 15802 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)F fb25ce5c36a1fcbba1bf9f14529f519f [0,1,0,1,0,0|2,0,0]=4 15803 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)I a8bd104d88adab9139e37fead7719853 [0,1,0,1,0,0|2,0,0]=4 15804 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)O 5ee3750749a3b6e42cedf9e3ba388781 [0,1,0,1,0,0|2,0,0]=4 15805 B17R2.4161 COCC1CCN1C(=O)c2cccc(c2)S db75859f9791a186868e526576644767 [0,1,0,1,0,0|2,0,0]=4 15806 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)Br 71073b0f445db5052f273e892d55e8ad [0,1,0,1,0,0|2,0,0]=4 15807 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)C 43a1558a8bffa107c01985717ec33472 [0,1,0,1,0,0|2,0,0]=4 15808 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)Cl b1b9ebda30ceadd8b0fb0ede3a7a8e90 [0,1,0,1,0,0|2,0,0]=4 15809 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)F 98ce3a3d966c68aeadc4f75146057a64 [0,1,0,1,0,0|2,0,0]=4 15810 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)I 8ad1e83d724c65af568c60bc14538bb1 [0,1,0,1,0,0|2,0,0]=4 15811 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)O fe4ba39183c0f8c11d64eba485ac6a4d [0,1,0,1,0,0|2,0,0]=4 15812 B17R2.4161 COC[C@@H]1CCN1C(=O)c2cccc(c2)S f96020c1e988cf917f5a9e2b3204fe37 [0,1,0,1,0,0|2,0,0]=4 15813 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)Br 375162ebb2ae7c050f2dc1cf2c0da5f0 [0,1,0,1,0,0|2,0,0]=4 15814 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)C af732fccce6062c6515914ca50ce01d2 [0,1,0,1,0,0|2,0,0]=4 15815 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)Cl 81a1477c4787abbf157d0bcbca2e5504 [0,1,0,1,0,0|2,0,0]=4 15816 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)F 008493444a1888ac51fe89b691cbbec0 [0,1,0,1,0,0|2,0,0]=4 15817 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)I c57eecd8a2f098b98ae80a3c21e5abc0 [0,1,0,1,0,0|2,0,0]=4 15818 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)O cc37aa17f57c587f722922e268c8888a [0,1,0,1,0,0|2,0,0]=4 15819 B17R2.4161 COC[C@H]1CCN1C(=O)c2cccc(c2)S d3e48327647e7d98ad390da674624778 [0,1,0,1,0,0|2,0,0]=4 15820 B17R2.4161 Cc1cccc(c1)C(=O)N2CCC2CCO da2ff223703f7c98a8aa3272e38c0a48 [0,1,0,1,0,0|2,0,0]=4 15821 B17R2.4161 O=C(c1cccc(c1)Br)N2CCC2CCO 2e518f43b1a12192772a636688829947 [0,1,0,1,0,0|2,0,0]=4 15822 B17R2.4161 O=C(c1cccc(c1)Cl)N2CCC2CCO 4587fe0db5ca72191d3e168e43670184 [0,1,0,1,0,0|2,0,0]=4 15823 B17R2.4161 O=C(c1cccc(c1)F)N2CCC2CCO b4583b3e40f2cf67dbadf3b295bf00ac [0,1,0,1,0,0|2,0,0]=4 15824 B17R2.4161 O=C(c1cccc(c1)I)N2CCC2CCO 8d3c42a67def7851d5424ecf91710b92 [0,1,0,1,0,0|2,0,0]=4 15825 B17R2.4161 O=C(c1cccc(c1)O)N2CCC2CCO 2b47395b3b1f59bbb2a4dc6018b5c5e1 [0,1,0,1,0,0|2,0,0]=4 15826 B17R2.4161 O=C(c1cccc(c1)S)N2CCC2CCO 8030d6b0ffeaafe6226fac1fb6af5dc9 [0,1,0,1,0,0|2,0,0]=4 15827 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)Br 89a2ec136e051eabbfd6888b9b1ca8e1 [0,1,0,1,0,0|2,0,0]=4 15828 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)C 731ed3d0f9f0e872918c0ec1bc246fdd [0,1,0,1,0,0|2,0,0]=4 15829 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)Cl e0586a4f001efb33cc612715919ee16a [0,1,0,1,0,0|2,0,0]=4 15830 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)F 2437b0f4228ea6db4e02956b84262bea [0,1,0,1,0,0|2,0,0]=4 15831 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)I 1ce4a7fc60a51de7a059e16cccd67e77 [0,1,0,1,0,0|2,0,0]=4 15832 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)O 3b05fcd48659c27497cde8b5d9b200d8 [0,1,0,1,0,0|2,0,0]=4 15833 B17R2.4638 COC[C@@H]1C[C@@H]1NC(=O)c2cccc(c2)S 86d00b88e259c4725a03312961f7663d [0,1,0,1,0,0|2,0,0]=4 15834 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)Br d96558cde6b892c9c94b02e95f7643e5 [0,1,0,1,0,0|2,0,0]=4 15835 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)C 63e7a0033837d3054d8ef0a73f79b0b9 [0,1,0,1,0,0|2,0,0]=4 15836 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)Cl 712f7d61252456fdff7ea7a200727aee [0,1,0,1,0,0|2,0,0]=4 15837 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)F 72923a0da741d145e86682b127875caf [0,1,0,1,0,0|2,0,0]=4 15838 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)I 433c716a9b9a3996240097065973458f [0,1,0,1,0,0|2,0,0]=4 15839 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)O b0b98f9a4b199762902981c292dfb2c8 [0,1,0,1,0,0|2,0,0]=4 15840 B17R2.4638 COC[C@H]1C[C@@H]1NC(=O)c2cccc(c2)S 45dc73ff82990f581780ef941b7fdeaa [0,1,0,1,0,0|2,0,0]=4 15841 B17R2.5273 CC(OC1CCCCC1)c2cccc(c2)Cl 809e63bd124e7a95bdc019116d7b41cb [0,1,0,1,0,0|1,0,1]=4 15842 B17R2.5273 CC(OC1CCCCC1)c2cccc(c2)F ed853649223425d5610f23a4f807d57b [0,1,0,1,0,0|1,0,1]=4 15843 B17R2.5273 CC(OC1CCCCC1)c2cccc(c2)I 7c9ec1c62c0de0f3cf87a834173d42f7 [0,1,0,1,0,0|1,0,1]=4 15844 B17R2.5273 C[C@@H](OC1CCCCC1)c2cccc(c2)Cl 905267fc88adbbed42354778747d2c90 [0,1,0,1,0,0|1,0,1]=4 15845 B17R2.5273 C[C@@H](OC1CCCCC1)c2cccc(c2)F 09157d27ab620855e136d11a64927970 [0,1,0,1,0,0|1,0,1]=4 15846 B17R2.5273 C[C@H](OC1CCCCC1)c2cccc(c2)Cl 851f37d4036a158de50410f3e5d056cc [0,1,0,1,0,0|1,0,1]=4 15847 B17R2.5273 C[C@H](OC1CCCCC1)c2cccc(c2)F 64e040e0e5e97562fef95405a7082485 [0,1,0,1,0,0|1,0,1]=4 15848 B17R2.5273 Cc1cccc(c1)C(=O)NC2CCCOC2 8887be4e44f0af91c3cc38b8acb1efd2 [0,1,0,1,0,0|2,0,0]=4 15849 B17R2.5273 Cc1cccc(c1)C(=O)NC2CCOCC2 cb79a64cdb4b8ec457403be5e672d07c [0,1,0,1,0,0|2,0,0]=4 15850 B17R2.5273 Cc1cccc(c1)C(=O)NC2CCSCC2 2990a333478a3e7f1bc00da0ea71bee7 [0,1,0,1,0,0|2,0,0]=4 15851 B17R2.5273 Cc1cccc(c1)C(=O)N[C@@H]2CCCOC2 3d98fa9283888bb8aef00ffafc0593c1 [0,1,0,1,0,0|2,0,0]=4 15852 B17R2.5273 Cc1cccc(c1)C(=O)N[C@H]2CCCOC2 42ee21c5c7354d535ea6b6a39e69ba41 [0,1,0,1,0,0|2,0,0]=4 15853 B17R2.5273 Cc1cccc(c1)C(C)OC2CCCCC2 f5aecb44bdfc5aa6f0d561eeb0e9bb56 [0,1,0,1,0,0|1,0,1]=4 15854 B17R2.5273 Cc1cccc(c1)[C@@H](C)OC2CCCCC2 cae217021c590069fc20fadeb08d0b8d [0,1,0,1,0,0|1,0,1]=4 15855 B17R2.5273 Cc1cccc(c1)[C@H](C)OC2CCCCC2 2fbbe13f236507d119504c044ad60bee [0,1,0,1,0,0|1,0,1]=4 15856 B17R2.5273 O=C(NC1CCCOC1)c2cccc(c2)Br 868e76537ec83fb5a836bae46e74de37 [0,1,0,1,0,0|2,0,0]=4 15857 B17R2.5273 O=C(NC1CCCOC1)c2cccc(c2)Cl 27246a944dcdc6e98951f24d183b2664 [0,1,0,1,0,0|2,0,0]=4 15858 B17R2.5273 O=C(NC1CCCOC1)c2cccc(c2)F 6d4945266c4c7746cf0c2988e4254df3 [0,1,0,1,0,0|2,0,0]=4 15859 B17R2.5273 O=C(NC1CCCOC1)c2cccc(c2)I 286bf0c029ec03e23c15c7a0dffe75c4 [0,1,0,1,0,0|2,0,0]=4 15860 B17R2.5273 O=C(NC1CCCOC1)c2cccc(c2)O 65b563ef38d30d378a73f23bce66ae1e [0,1,0,1,0,0|2,0,0]=4 15861 B17R2.5273 O=C(NC1CCCOC1)c2cccc(c2)S db54177744454f728af8a73b00ca2352 [0,1,0,1,0,0|2,0,0]=4 15862 B17R2.5273 O=C(NC1CCOCC1)c2cccc(c2)Br 64c2093005db0e48f92366340e0e1670 [0,1,0,1,0,0|2,0,0]=4 15863 B17R2.5273 O=C(NC1CCOCC1)c2cccc(c2)Cl 3e2db50cc118e700150b884ed5ec4b63 [0,1,0,1,0,0|2,0,0]=4 15864 B17R2.5273 O=C(NC1CCOCC1)c2cccc(c2)F 25f8e18c33df9581fcb0cecf2805ba1d [0,1,0,1,0,0|2,0,0]=4 15865 B17R2.5273 O=C(NC1CCOCC1)c2cccc(c2)I 658a15630ee986da910cccd182a76f76 [0,1,0,1,0,0|2,0,0]=4 15866 B17R2.5273 O=C(NC1CCOCC1)c2cccc(c2)O c14c35c7c96a1ad0157d9151b559bcc6 [0,1,0,1,0,0|2,0,0]=4 15867 B17R2.5273 O=C(NC1CCOCC1)c2cccc(c2)S 8025553cd0b712cb5837771b2b320d36 [0,1,0,1,0,0|2,0,0]=4 15868 B17R2.5273 O=C(NC1CCSCC1)c2cccc(c2)Br 2707bd939c12af797d2b44015034e051 [0,1,0,1,0,0|2,0,0]=4 15869 B17R2.5273 O=C(NC1CCSCC1)c2cccc(c2)Cl 62b754f624fb3978234c3747cefaf564 [0,1,0,1,0,0|2,0,0]=4 15870 B17R2.5273 O=C(NC1CCSCC1)c2cccc(c2)F 88bad1435eb52dd6a9bbb82a83933027 [0,1,0,1,0,0|2,0,0]=4 15871 B17R2.5273 O=C(NC1CCSCC1)c2cccc(c2)I d73288744f55c389bf956a7521cfc7b8 [0,1,0,1,0,0|2,0,0]=4 15872 B17R2.5273 O=C(NC1CCSCC1)c2cccc(c2)O a76b768e08e21d41429597a2592ae9b5 [0,1,0,1,0,0|2,0,0]=4 15873 B17R2.5273 O=C(NC1CCSCC1)c2cccc(c2)S dc61aec85ea23620e754789e7b39d77f [0,1,0,1,0,0|2,0,0]=4 15874 B17R2.5273 O=C(N[C@@H]1CCCOC1)c2cccc(c2)Br fa021495bf12f45dada3dc43bd15d848 [0,1,0,1,0,0|2,0,0]=4 15875 B17R2.5273 O=C(N[C@@H]1CCCOC1)c2cccc(c2)Cl cac985d11a7c58e498a2d0b8fd5ed1cc [0,1,0,1,0,0|2,0,0]=4 15876 B17R2.5273 O=C(N[C@@H]1CCCOC1)c2cccc(c2)F 6278c4540b5dc226c7c0c511448724a4 [0,1,0,1,0,0|2,0,0]=4 15877 B17R2.5273 O=C(N[C@@H]1CCCOC1)c2cccc(c2)I 9d063b12670dc21ab847fcfb60e9ab64 [0,1,0,1,0,0|2,0,0]=4 15878 B17R2.5273 O=C(N[C@@H]1CCCOC1)c2cccc(c2)O c17e7ecc6682f9937ba12e45d7e6a91c [0,1,0,1,0,0|2,0,0]=4 15879 B17R2.5273 O=C(N[C@@H]1CCCOC1)c2cccc(c2)S 6d89dd55f67828879a5c73bc545ee9bf [0,1,0,1,0,0|2,0,0]=4 15880 B17R2.5273 O=C(N[C@H]1CCCOC1)c2cccc(c2)Br 86065a0fbf29908219d0fc934c62c45a [0,1,0,1,0,0|2,0,0]=4 15881 B17R2.5273 O=C(N[C@H]1CCCOC1)c2cccc(c2)Cl 6b6f40abf4a5467ed86793d4b79ba823 [0,1,0,1,0,0|2,0,0]=4 15882 B17R2.5273 O=C(N[C@H]1CCCOC1)c2cccc(c2)F 54945836121c4e868259257235974e19 [0,1,0,1,0,0|2,0,0]=4 15883 B17R2.5273 O=C(N[C@H]1CCCOC1)c2cccc(c2)I 90bb7fd0805c09f4bccbdbe21cb8049c [0,1,0,1,0,0|2,0,0]=4 15884 B17R2.5273 O=C(N[C@H]1CCCOC1)c2cccc(c2)O a3027a90f6d8828153eb01437479fa2a [0,1,0,1,0,0|2,0,0]=4 15885 B17R2.5273 O=C(N[C@H]1CCCOC1)c2cccc(c2)S 80d9f9e6cccd94c84db26a52a90b5be4 [0,1,0,1,0,0|2,0,0]=4 15886 B17R2.19639 CN1CCC1CNC(=O)c2cccc(c2)Br 8d4ec1ef3dc6857939d810b8d7170a21 [0,1,0,1,0,0|2,0,0]=4 15887 B17R2.19639 CN1CCC1CNC(=O)c2cccc(c2)Cl cddb336e08ba0bae341e0dd4a655cde3 [0,1,0,1,0,0|2,0,0]=4 15888 B17R2.19639 CN1CCC1CNC(=O)c2cccc(c2)F 59a70dfc4cc9720c15882c672e2df484 [0,1,0,1,0,0|2,0,0]=4 15889 B17R2.19639 CN1CCC1CNC(=O)c2cccc(c2)I 4d1344463758879655541943fb54ea06 [0,1,0,1,0,0|2,0,0]=4 15890 B17R2.19639 CN1CCC1CNC(=O)c2cccc(c2)O 9ea14b0d6fa2aaa20e190ea5dec480e3 [0,1,0,1,0,0|2,0,0]=4 15891 B17R2.19639 CN1CCC1CNC(=O)c2cccc(c2)S 18de2aa1da3cf41924981fb4942104f5 [0,1,0,1,0,0|2,0,0]=4 15892 B17R2.19639 C[C@@H]1CC[C@@H]1NCC(=O)c2cccc(c2)Br bb41d259d954fa36076c13d00e022f8a [0,1,0,1,0,0|2,0,0]=4 15893 B17R2.19639 C[C@@H]1CC[C@@H]1NCC(=O)c2cccc(c2)Cl 6ac50ac95a9157096e88e735ff7af290 [0,1,0,1,0,0|2,0,0]=4 15894 B17R2.19639 C[C@@H]1CC[C@@H]1NCC(=O)c2cccc(c2)F 20fc145cbb111a4f8e2c5abb47737343 [0,1,0,1,0,0|2,0,0]=4 15895 B17R2.19639 C[C@@H]1CC[C@@H]1NCC(=O)c2cccc(c2)I ffe3c2cd2eafb582a569d8b94f080bcd [0,1,0,1,0,0|2,0,0]=4 15896 B17R2.19639 C[C@@H]1CC[C@H]1NCC(=O)c2cccc(c2)Br 285c831073f150202bc8bd9f5cd06c1d [0,1,0,1,0,0|2,0,0]=4 15897 B17R2.19639 C[C@@H]1CC[C@H]1NCC(=O)c2cccc(c2)Cl eec53d29daea1d85da2fd3855788ffb3 [0,1,0,1,0,0|2,0,0]=4 15898 B17R2.19639 C[C@@H]1CC[C@H]1NCC(=O)c2cccc(c2)F 15a9c7fd1ef4733d9258136f5754de10 [0,1,0,1,0,0|2,0,0]=4 15899 B17R2.19639 C[C@@H]1CC[C@H]1NCC(=O)c2cccc(c2)I c2491b4bfc7360910eb24eeca29563f1 [0,1,0,1,0,0|2,0,0]=4 15900 B17R2.19639 Cc1cccc(c1)C(=O)CN[C@@H]2CC[C@H]2C c646fa294b1332aef6ee4446ab856b74 [0,1,0,1,0,0|2,0,0]=4 15901 B17R2.19639 Cc1cccc(c1)C(=O)CN[C@H]2CC[C@H]2C 59e5dd17489da51b57afad9e5e68eb58 [0,1,0,1,0,0|2,0,0]=4 15902 B17R2.19639 Cc1cccc(c1)C(=O)NCC2CCN2C 2fb2b21fd40395b760adf7b53dcb85eb [0,1,0,1,0,0|2,0,0]=4 15903 B17R2.41752 CC1CCCCN1C(=O)c2cc(=O)cco2 54308bcf266ea3d518bfc70a35b207e8 [0,1,0,1,0,0|2,0,0]=4 15904 B17R2.41752 CC1CCCCN1C(=O)c2cc(ccn2)Br ddbe19f86eefef61e227a5a69bcd548b [0,1,0,1,0,0|2,0,0]=4 15905 B17R2.41752 CC1CCCCN1C(=O)c2cc(ccn2)Cl 8443de36de35a9406a7137e239af0d73 [0,1,0,1,0,0|2,0,0]=4 15906 B17R2.41752 CC1CCCCN1C(=O)c2cc(ccn2)F 8b1abb9055db3001a45e7e0b662a986b [0,1,0,1,0,0|2,0,0]=4 15907 B17R2.41752 CC1CCCCN1C(=O)c2cc(ccn2)I ec1e46febfb2bd907de7f22bc974ad5f [0,1,0,1,0,0|2,0,0]=4 15908 B17R2.41752 CC1CCCCN1C(=O)c2cc(ccn2)O 13b66140a9b128fef5ef61ab780b868d [0,1,0,1,0,0|2,0,0]=4 15909 B17R2.41752 CC1CCCCN1C(=O)c2ccc[n+](c2)[O-] 5e51db4f7b61e79e6e68af8485e68501 [0,1,0,1,0,0|2,0,0]=4 15910 B17R2.41752 CC1CCCCN1C(=O)c2cccc(c2)Br 3f7d5b3f2ee709df987fdac4310cc85b [0,1,0,1,0,0|1,0,0]=3 15911 B17R2.41752 CC1CCCCN1C(=O)c2cccc(c2)Cl 87c48fd43e5c416d96a08683a332f18f [0,1,0,1,0,0|1,0,0]=3 15912 B17R2.41752 CC1CCCCN1C(=O)c2cccc(c2)F 2bbd02d1e734b2c46fd1c73ddb649c9e [0,1,0,1,0,0|1,0,0]=3 15913 B17R2.41752 CC1CCCCN1C(=O)c2cccc(c2)I b8511b55a912dd863dc11888c30718bd [0,1,0,1,0,0|1,0,0]=3 15914 B17R2.41752 CC1CCCCN1C(=O)c2cccc(c2)O d77a7d8c23b4040297b3d9f16b6c7f3b [0,1,0,1,0,0|1,0,0]=3 15915 B17R2.41752 CC1CCCCN1C(=O)c2cccc(c2)S b5c43804469823ccf180af610a7268fb [0,1,0,1,0,0|1,0,0]=3 15916 B17R2.41752 CC1CCCCN1C(=O)c2cccc(n2)Br 25c4d10849fc484d420ad4368bc07f64 [0,1,0,1,0,0|2,0,0]=4 15917 B17R2.41752 CC1CCCCN1C(=O)c2cccc(n2)Cl bd52237712f29bfc3fba0543006ca8b2 [0,1,0,1,0,0|2,0,0]=4 15918 B17R2.41752 CC1CCCCN1C(=O)c2cccc(n2)F e023ccf24be81a235ff614ea10a361d0 [0,1,0,1,0,0|2,0,0]=4 15919 B17R2.41752 CC1CCCCN1C(=O)c2cccc(n2)I 2d0925b2bc6b1a143a0f0aa6bb5c259a [0,1,0,1,0,0|2,0,0]=4 15920 B17R2.41752 CC1CCCCN1C(=O)c2cccc(n2)O 414469e57a3f3c78385bfe21370e05fd [0,1,0,1,0,0|2,0,0]=4 15921 B17R2.41752 CC1CCCCN1C(=O)c2ccnc(c2)Br c22715120889d45583097ee4aedcf067 [0,1,0,1,0,0|2,0,0]=4 15922 B17R2.41752 CC1CCCCN1C(=O)c2ccnc(c2)Cl f21aa34bd548095a3b4b2eecf297b5d0 [0,1,0,1,0,0|2,0,0]=4 15923 B17R2.41752 CC1CCCCN1C(=O)c2ccnc(c2)F 86b5c6057e5c4c6da049045735fb835e [0,1,0,1,0,0|2,0,0]=4 15924 B17R2.41752 CC1CCCCN1C(=O)c2ccnc(c2)I fe0fe0010a1bb342c4a9c803550c168a [0,1,0,1,0,0|2,0,0]=4 15925 B17R2.41752 CC1CCCCN1C(=O)c2ccnc(c2)O 085db0a43b7a54cc97563ce206c08e89 [0,1,0,1,0,0|2,0,0]=4 15926 B17R2.41752 CC1CCCCN1C(=O)c2ccnc(c2)S 7e2706e98bab581bcc96cdbd9d36ffe9 [0,1,0,1,0,0|2,0,0]=4 15927 B17R2.41752 CC1CCCCN1C(=O)c2cncc(c2)Br 7937fe5a88456e3b3922b70c8599d704 [0,1,0,1,0,0|2,0,0]=4 15928 B17R2.41752 CC1CCCCN1C(=O)c2cncc(c2)Cl d221d82e321459fb38aad4f834e317dd [0,1,0,1,0,0|2,0,0]=4 15929 B17R2.41752 CC1CCCCN1C(=O)c2cncc(c2)F ab8424f4ce2ded00bd3db84b15de5aa0 [0,1,0,1,0,0|2,0,0]=4 15930 B17R2.41752 CC1CCCCN1C(=O)c2cncc(c2)I 70ba0b496d876aaec481bb38209d686a [0,1,0,1,0,0|2,0,0]=4 15931 B17R2.41752 CC1CCCCN1C(=O)c2cncc(c2)O d910d9bbf77da49d55c7e6806c1cf5e3 [0,1,0,1,0,0|2,0,0]=4 15932 B17R2.41752 CC1COCCN1C(=O)c2cccc(c2)Br 82ffd020b9cde8125c3961881f3cbb0a [0,1,0,1,0,0|2,0,0]=4 15933 B17R2.41752 CC1COCCN1C(=O)c2cccc(c2)Cl a80974a19c27695fd37aef58c4bcff42 [0,1,0,1,0,0|2,0,0]=4 15934 B17R2.41752 CC1COCCN1C(=O)c2cccc(c2)F 0825f32f0b490e379fd59785089aba97 [0,1,0,1,0,0|2,0,0]=4 15935 B17R2.41752 CC1COCCN1C(=O)c2cccc(c2)I d9c2adf2bb2479092032be1119b6f8c3 [0,1,0,1,0,0|2,0,0]=4 15936 B17R2.41752 CC1COCCN1C(=O)c2cccc(c2)O 9430f394ddaf2ad13b3a814a50dd4786 [0,1,0,1,0,0|2,0,0]=4 15937 B17R2.41752 CC1COCCN1C(=O)c2cccc(c2)S b9863ccdc2a752d0a37e490ea68e928e [0,1,0,1,0,0|2,0,0]=4 15938 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cc(=O)cco2 87438b1736a26adeeb640feb466c2bdb [0,1,0,1,0,0|2,0,0]=4 15939 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cc(ccn2)Br c39beb0b9665785c67f61ce36ac79172 [0,1,0,1,0,0|2,0,0]=4 15940 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cc(ccn2)Cl a5cd0615a1d80743f3cc72a2c573af37 [0,1,0,1,0,0|2,0,0]=4 15941 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cc(ccn2)F 3d121f3629e02fbf1a5f7f187d9ffae0 [0,1,0,1,0,0|2,0,0]=4 15942 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cc(ccn2)I 0bf486e835a225c7315990fcc179d297 [0,1,0,1,0,0|2,0,0]=4 15943 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cc(ccn2)O b82d20f6a0e1426d4ba28fedfad4300a [0,1,0,1,0,0|2,0,0]=4 15944 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccc[n+](c2)[O-] d19a9b1fec972605342a7b153e8d401b [0,1,0,1,0,0|2,0,0]=4 15945 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(c2)Br c688b6abf32a39fd4a5fcf8d00723330 [0,1,0,1,0,0|1,0,0]=3 15946 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(c2)Cl 23e7c1742a64f88cd385256eb3ca3c6a [0,1,0,1,0,0|1,0,0]=3 15947 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(c2)F aba99268132a42c01d15fe93c79da893 [0,1,0,1,0,0|1,0,0]=3 15948 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(c2)I 989dafecfc5849901c2fec4d6fb0f46f [0,1,0,1,0,0|1,0,0]=3 15949 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(c2)O 13acbd9f43058014a629c64855d2e3f2 [0,1,0,1,0,0|1,0,0]=3 15950 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(c2)S 20a8286bbe8e11246a4a32d981346201 [0,1,0,1,0,0|1,0,0]=3 15951 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(n2)Br c37ac9b2ae328dc54e3429879af9f049 [0,1,0,1,0,0|2,0,0]=4 15952 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(n2)Cl a53badb443488da14bfef599ef7909f8 [0,1,0,1,0,0|2,0,0]=4 15953 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(n2)F 797cb61d5c1a4bb624f3bcc2f3efeff3 [0,1,0,1,0,0|2,0,0]=4 15954 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(n2)I ac62a6f79b758d2ba4d65db3efbdb12b [0,1,0,1,0,0|2,0,0]=4 15955 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cccc(n2)O adfba9c719e2b7ebc7d66e1f9b8a4bf6 [0,1,0,1,0,0|2,0,0]=4 15956 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccnc(c2)Br 4b1bc51a3090175a45600e82e13dd547 [0,1,0,1,0,0|2,0,0]=4 15957 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccnc(c2)Cl 3d63b7ead0586fe4f86878979aafc771 [0,1,0,1,0,0|2,0,0]=4 15958 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccnc(c2)F 2282151e57194d6a6914bc9f8cd51b6b [0,1,0,1,0,0|2,0,0]=4 15959 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccnc(c2)I d61f719d1f8d51decde0a71623de2eea [0,1,0,1,0,0|2,0,0]=4 15960 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccnc(c2)O c20d35daeb5efd3c97b083ed721a126c [0,1,0,1,0,0|2,0,0]=4 15961 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2ccnc(c2)S 272ff6c4d1cc4aef5984a1cde4445ce9 [0,1,0,1,0,0|2,0,0]=4 15962 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cncc(c2)Br 355233dff0d88db299c86603dc76d155 [0,1,0,1,0,0|2,0,0]=4 15963 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cncc(c2)Cl 82f9146cff862c62d5c0fcbfeb5185c1 [0,1,0,1,0,0|2,0,0]=4 15964 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cncc(c2)F dbe1848ccff3f4dcc6e2cc7330a0102d [0,1,0,1,0,0|2,0,0]=4 15965 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cncc(c2)I a2bb40afe8bc97ccdf6b72ebd10ce026 [0,1,0,1,0,0|2,0,0]=4 15966 B17R2.41752 C[C@@H]1CCCCN1C(=O)c2cncc(c2)O 53d431825311359a35f014f4ccf372e8 [0,1,0,1,0,0|2,0,0]=4 15967 B17R2.41752 C[C@@H]1COCCN1C(=O)c2cccc(c2)Br 6922f9a0d0a1d5fab8ed9f8830f9608a [0,1,0,1,0,0|2,0,0]=4 15968 B17R2.41752 C[C@@H]1COCCN1C(=O)c2cccc(c2)Cl d28117a848e4c156e68b6de07812d62b [0,1,0,1,0,0|2,0,0]=4 15969 B17R2.41752 C[C@@H]1COCCN1C(=O)c2cccc(c2)F b2074972d32f9d3819ecddba520088a3 [0,1,0,1,0,0|2,0,0]=4 15970 B17R2.41752 C[C@@H]1COCCN1C(=O)c2cccc(c2)I b4bd4741ad888eb3aa23a2ea67f14c35 [0,1,0,1,0,0|2,0,0]=4 15971 B17R2.41752 C[C@@H]1COCCN1C(=O)c2cccc(c2)O a6d3b9f752a434803423384fdd32f4ac [0,1,0,1,0,0|2,0,0]=4 15972 B17R2.41752 C[C@@H]1COCCN1C(=O)c2cccc(c2)S d12c982f5a3e79cbd0706707576418bb [0,1,0,1,0,0|2,0,0]=4 15973 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cc(=O)cco2 36826991396ea0ee22eaffaf3479a2a9 [0,1,0,1,0,0|2,0,0]=4 15974 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cc(ccn2)Br 40d8bb8ca2d005931bd20461d94bfe76 [0,1,0,1,0,0|2,0,0]=4 15975 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cc(ccn2)Cl 69fc8e9b61e1c2a34f3ee7c818c5c6e5 [0,1,0,1,0,0|2,0,0]=4 15976 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cc(ccn2)F 1bc2421a78db94bab0156cafd9ce3826 [0,1,0,1,0,0|2,0,0]=4 15977 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cc(ccn2)I eb99c2bb7de4bfb676e06263a27f95f7 [0,1,0,1,0,0|2,0,0]=4 15978 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cc(ccn2)O 24dd782a4ea351c0a2e97b5730487d64 [0,1,0,1,0,0|2,0,0]=4 15979 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccc[n+](c2)[O-] dd6607350951137d1db4074216bfd9a0 [0,1,0,1,0,0|2,0,0]=4 15980 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(c2)Br b41da555781afa0da54b0a9ba1614b6a [0,1,0,1,0,0|1,0,0]=3 15981 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(c2)Cl 4b5239be88e8384e91c6d5d665ba4641 [0,1,0,1,0,0|1,0,0]=3 15982 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(c2)F 5e47b7de318b2b5c763ceabc2a7a392f [0,1,0,1,0,0|1,0,0]=3 15983 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(c2)I e2df915a0195f2fef6646f5d5f87e90a [0,1,0,1,0,0|1,0,0]=3 15984 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(c2)O 3bf698c05acf7064387cfeefaa0f09b9 [0,1,0,1,0,0|1,0,0]=3 15985 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(c2)S a27549e5d4acbaecf0137a0dbe7b0232 [0,1,0,1,0,0|1,0,0]=3 15986 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(n2)Br 2ad3673e0c2c7e86fd69ff27b3c8b5aa [0,1,0,1,0,0|2,0,0]=4 15987 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(n2)Cl da62261b23465e3a41a1b6f15654f5f6 [0,1,0,1,0,0|2,0,0]=4 15988 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(n2)F ae12832797255da4c62201f266596582 [0,1,0,1,0,0|2,0,0]=4 15989 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(n2)I d59af53a4492fec634bbaeb83607ab40 [0,1,0,1,0,0|2,0,0]=4 15990 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cccc(n2)O e7704e8408dbcbc2979f723b3b225870 [0,1,0,1,0,0|2,0,0]=4 15991 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccnc(c2)Br 724d6a7b60d7fd4e975260db25ab608e [0,1,0,1,0,0|2,0,0]=4 15992 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccnc(c2)Cl 493a81a3e70a5872cda3433c346e73ae [0,1,0,1,0,0|2,0,0]=4 15993 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccnc(c2)F 6658515075cab3701efa37d55dee4db1 [0,1,0,1,0,0|2,0,0]=4 15994 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccnc(c2)I c455bfd3997c2212a74d48e8f09965f1 [0,1,0,1,0,0|2,0,0]=4 15995 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccnc(c2)O 8913cd44e1f9e2a4d5177787d575c791 [0,1,0,1,0,0|2,0,0]=4 15996 B17R2.41752 C[C@H]1CCCCN1C(=O)c2ccnc(c2)S 7a44c4adcc95caeb760a31654596ab88 [0,1,0,1,0,0|2,0,0]=4 15997 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cncc(c2)Br 0e54abbd71934bc998c5d724bd10f39e [0,1,0,1,0,0|2,0,0]=4 15998 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cncc(c2)Cl f231f2301fa2deb960d11f55c599c528 [0,1,0,1,0,0|2,0,0]=4 15999 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cncc(c2)F dc8e10309de1e8e17ca83337afd03b57 [0,1,0,1,0,0|2,0,0]=4 16000 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cncc(c2)I 0a0d6ab64ae6854b3d73263833add7bb [0,1,0,1,0,0|2,0,0]=4 16001 B17R2.41752 C[C@H]1CCCCN1C(=O)c2cncc(c2)O dee279eb11fdeffe689ccb191174600e [0,1,0,1,0,0|2,0,0]=4 16002 B17R2.41752 C[C@H]1COCCN1C(=O)c2cccc(c2)Br 2b0289c26e852cff61356c68d1397fbf [0,1,0,1,0,0|2,0,0]=4 16003 B17R2.41752 C[C@H]1COCCN1C(=O)c2cccc(c2)Cl c1236205111ce00ddc90a7e7299e9453 [0,1,0,1,0,0|2,0,0]=4 16004 B17R2.41752 C[C@H]1COCCN1C(=O)c2cccc(c2)F 6d190d180d060892c6562043d1d2b6d2 [0,1,0,1,0,0|2,0,0]=4 16005 B17R2.41752 C[C@H]1COCCN1C(=O)c2cccc(c2)I 221716ed40a6136011914464261c09a5 [0,1,0,1,0,0|2,0,0]=4 16006 B17R2.41752 C[C@H]1COCCN1C(=O)c2cccc(c2)O 2e26668539065b2313c57589a5aec52c [0,1,0,1,0,0|2,0,0]=4 16007 B17R2.41752 C[C@H]1COCCN1C(=O)c2cccc(c2)S a3afab576c821cb8123fc977acf10937 [0,1,0,1,0,0|2,0,0]=4 16008 B17R2.41752 Cc1cc(ccn1)C(=O)N2CCCCC2C 6b2ab6559aaa468f0c7fe91980629d9c [0,1,0,1,0,0|2,0,0]=4 16009 B17R2.41752 Cc1cc(ccn1)C(=O)N2CCCC[C@@H]2C 7d64e44c7511b0c5d6a30516c6fac985 [0,1,0,1,0,0|2,0,0]=4 16010 B17R2.41752 Cc1cc(ccn1)C(=O)N2CCCC[C@H]2C b2a485afdb95b0dcca48f54206e4e9e5 [0,1,0,1,0,0|2,0,0]=4 16011 B17R2.41752 Cc1cccc(c1)C(=O)N2CCCCC2C d2cbbe2dd278a45c4ae5fd050cd2b49b [0,1,0,1,0,0|1,0,0]=3 16012 B17R2.41752 Cc1cccc(c1)C(=O)N2CCCC[C@@H]2C 372707a4372a4d45de95880d44535073 [0,1,0,1,0,0|1,0,0]=3 16013 B17R2.41752 Cc1cccc(c1)C(=O)N2CCCC[C@H]2C b350c0e9e150e5125b61d37da0e08ab5 [0,1,0,1,0,0|1,0,0]=3 16014 B17R2.41752 Cc1cccc(c1)C(=O)N2CCOCC2C f3dd21806c7e2889979ffd7b4d15aac5 [0,1,0,1,0,0|2,0,0]=4 16015 B17R2.41752 Cc1cccc(c1)C(=O)N2CCOC[C@@H]2C 149e40fb5adb19207560b7a56aa74800 [0,1,0,1,0,0|2,0,0]=4 16016 B17R2.41752 Cc1cccc(c1)C(=O)N2CCOC[C@H]2C 69f22937f72d53ba65b33e85174241c4 [0,1,0,1,0,0|2,0,0]=4 16017 B17R2.41752 Cc1cccc(n1)C(=O)N2CCCCC2C 87848468915ea3fe91cb208bd9b4a9a6 [0,1,0,1,0,0|2,0,0]=4 16018 B17R2.41752 Cc1cccc(n1)C(=O)N2CCCC[C@@H]2C aa1f25a3c9fde31306a18fac2c819ee6 [0,1,0,1,0,0|2,0,0]=4 16019 B17R2.41752 Cc1cccc(n1)C(=O)N2CCCC[C@H]2C 718a20fb3eb0a6fdcf6ef9ece447e45c [0,1,0,1,0,0|2,0,0]=4 16020 B17R2.41752 Cc1ccnc(c1)C(=O)N2CCCCC2C 5234637b67da1a3a6261111dd3b4b4ab [0,1,0,1,0,0|2,0,0]=4 16021 B17R2.41752 Cc1ccnc(c1)C(=O)N2CCCC[C@@H]2C 0a927231f60b49f0ca9952972becfabf [0,1,0,1,0,0|2,0,0]=4 16022 B17R2.41752 Cc1ccnc(c1)C(=O)N2CCCC[C@H]2C e29a96a2725d75ad528195394fedea2e [0,1,0,1,0,0|2,0,0]=4 16023 B17R2.41752 Cc1cncc(c1)C(=O)N2CCCCC2C 2cb28a301798b2efb16b8906a43825ac [0,1,0,1,0,0|2,0,0]=4 16024 B17R2.41752 Cc1cncc(c1)C(=O)N2CCCC[C@@H]2C c1cbae8e70786be4464a33ab030343f1 [0,1,0,1,0,0|2,0,0]=4 16025 B17R2.41752 Cc1cncc(c1)C(=O)N2CCCC[C@H]2C 7878a2d937cae0c6a9dd8e1e4b93c8e6 [0,1,0,1,0,0|2,0,0]=4 16026 B17R2.41753 CC1CC1COCC(=O)c2cccc(c2)Br 8686eb88f35186e4b2e65258f4c794e9 [0,1,0,1,0,0|2,0,0]=4 16027 B17R2.41753 CC1CC1COCC(=O)c2cccc(c2)Cl f1f576f7de1cb0ef735388ef4813f6d4 [0,1,0,1,0,0|2,0,0]=4 16028 B17R2.41753 CC1CC1COCC(=O)c2cccc(c2)F 76e387cbfae3e244264f0cb63aa19bd4 [0,1,0,1,0,0|2,0,0]=4 16029 B17R2.41753 CC1CC1COCC(=O)c2cccc(c2)I 699066313c6722d4bbea3ee6576d92bf [0,1,0,1,0,0|2,0,0]=4 16030 B17R2.41753 C[C@@H]1C[C@H]1COCC(=O)c2cccc(c2)Br 21e84d01f9c9622019a21c9d60336279 [0,1,0,1,0,0|2,0,0]=4 16031 B17R2.41753 C[C@@H]1C[C@H]1COCC(=O)c2cccc(c2)Cl dd60b4db8eb8862b39f3f8086102171b [0,1,0,1,0,0|2,0,0]=4 16032 B17R2.41753 C[C@@H]1C[C@H]1COCC(=O)c2cccc(c2)F 795a7dcb8f6969c55cc7b2d653deea24 [0,1,0,1,0,0|2,0,0]=4 16033 B17R2.41753 C[C@@H]1C[C@H]1COCC(=O)c2cccc(c2)I 740eaf705fd0b2713c0fcb17f0451ae1 [0,1,0,1,0,0|2,0,0]=4 16034 B17R2.41753 C[C@H]1C[C@@H]1COCC(=O)c2cccc(c2)Br bdc9ddd3059057dc83f120f7304c693c [0,1,0,1,0,0|2,0,0]=4 16035 B17R2.41753 C[C@H]1C[C@@H]1COCC(=O)c2cccc(c2)Cl c491df6fcead7486a0bd15969c1c40c2 [0,1,0,1,0,0|2,0,0]=4 16036 B17R2.41753 C[C@H]1C[C@@H]1COCC(=O)c2cccc(c2)F 16794e70a1e250a3e031c1c69accceb3 [0,1,0,1,0,0|2,0,0]=4 16037 B17R2.41753 C[C@H]1C[C@@H]1COCC(=O)c2cccc(c2)I 234f95158c946f7adba74945e111ac97 [0,1,0,1,0,0|2,0,0]=4 16038 B17R2.41753 C[C@H]1C[C@H]1COCC(=O)c2cccc(c2)Br 73940d7ea17b0c69ad654418bc6af7e8 [0,1,0,1,0,0|2,0,0]=4 16039 B17R2.41753 C[C@H]1C[C@H]1COCC(=O)c2cccc(c2)Cl 833d9a9aa08b5b6451709444bb3d0ecb [0,1,0,1,0,0|2,0,0]=4 16040 B17R2.41753 C[C@H]1C[C@H]1COCC(=O)c2cccc(c2)F 068a3d9b4913d94372674cf372fe0e63 [0,1,0,1,0,0|2,0,0]=4 16041 B17R2.41753 C[C@H]1C[C@H]1COCC(=O)c2cccc(c2)I 134b8bce81fe2208dfc2a719dd94cd1a [0,1,0,1,0,0|2,0,0]=4 16042 B17R2.41753 Cc1cccc(c1)C(=O)COCC2CC2C 00c47fe152dcb580ef75fc65818d5323 [0,1,0,1,0,0|2,0,0]=4 16043 B17R2.41753 Cc1cccc(c1)C(=O)COC[C@@H]2C[C@@H]2C 3689be01f1af3d191825f36895bce98d [0,1,0,1,0,0|2,0,0]=4 16044 B17R2.41753 Cc1cccc(c1)C(=O)COC[C@@H]2C[C@H]2C 0c8cbe1a2aedee9ba0d21757f3ed149d [0,1,0,1,0,0|2,0,0]=4 16045 B17R2.41753 Cc1cccc(c1)C(=O)COC[C@H]2C[C@@H]2C 6b685685647ad5715d1516f46da07d2a [0,1,0,1,0,0|2,0,0]=4 16046 B17R2.41755 CC(OC1CCCC1C)c2cccc(c2)Cl a5b1f173fabeb612a89f6736c75de178 [0,1,0,1,0,0|1,0,1]=4 16047 B17R2.41755 CC(O[C@@H]1CCC[C@@H]1C)c2cccc(c2)Cl dbb53fe5ffb2d600f1707d0cea7b27d7 [0,1,0,1,0,0|1,0,1]=4 16048 B17R2.41755 CC(O[C@@H]1CCC[C@H]1C)c2cccc(c2)Cl a796594ecd840eba45514cd2c27b4787 [0,1,0,1,0,0|1,0,1]=4 16049 B17R2.41755 CC(O[C@H]1CCC[C@@H]1C)c2cccc(c2)Cl 368a3fe8836265d818b794cc7b2a6eb5 [0,1,0,1,0,0|1,0,1]=4 16050 B17R2.41755 CC(O[C@H]1CCC[C@H]1C)c2cccc(c2)Cl 15020b5d269f54c548628ff2d542f989 [0,1,0,1,0,0|1,0,1]=4 16051 B17R2.41755 CC1CCCN1CC(=O)c2cccc(c2)Br 50d3cc144b1f5245dec89de3bc1f3c5d [0,1,0,1,0,0|2,0,0]=4 16052 B17R2.41755 CC1CCCN1CC(=O)c2cccc(c2)Cl 2e59a7b9233bad195c6a165fd7502cf0 [0,1,0,1,0,0|2,0,0]=4 16053 B17R2.41755 CC1CCCN1CC(=O)c2cccc(c2)F e6287344e043bca9accc30bcb29bb385 [0,1,0,1,0,0|2,0,0]=4 16054 B17R2.41755 CC1CCCN1CC(=O)c2cccc(c2)I bdc906299139942ab9e32e987e1bc02a [0,1,0,1,0,0|2,0,0]=4 16055 B17R2.41755 C[C@@H]1CCCN1CC(=O)c2cccc(c2)Br 0ded301a7a03aa63758dff982ef64f97 [0,1,0,1,0,0|2,0,0]=4 16056 B17R2.41755 C[C@@H]1CCCN1CC(=O)c2cccc(c2)Cl bec05b8a980362d99069397606dff6ed [0,1,0,1,0,0|2,0,0]=4 16057 B17R2.41755 C[C@@H]1CCCN1CC(=O)c2cccc(c2)F 2c08f4d8fb034b2933c39d1251ac6b39 [0,1,0,1,0,0|2,0,0]=4 16058 B17R2.41755 C[C@@H]1CCCN1CC(=O)c2cccc(c2)I 51ed5ffdf2f5e0a787ea8d5b8994d74c [0,1,0,1,0,0|2,0,0]=4 16059 B17R2.41755 C[C@H]1CCCN1CC(=O)c2cccc(c2)Br 106bd4dec652ba256107ebbe11687dfc [0,1,0,1,0,0|2,0,0]=4 16060 B17R2.41755 C[C@H]1CCCN1CC(=O)c2cccc(c2)Cl 7f853587729bc364ad00229f73ffb311 [0,1,0,1,0,0|2,0,0]=4 16061 B17R2.41755 C[C@H]1CCCN1CC(=O)c2cccc(c2)F fda0be9e5755d4b1bfb2dc4a97f5a3b3 [0,1,0,1,0,0|2,0,0]=4 16062 B17R2.41755 C[C@H]1CCCN1CC(=O)c2cccc(c2)I 785402e82f96fca4b4f1945d1f35c171 [0,1,0,1,0,0|2,0,0]=4 16063 B17R2.41755 Cc1cccc(c1)C(=O)CN2CCCC2C e24f8a3087f2eb4ad530b465ef986483 [0,1,0,1,0,0|2,0,0]=4 16064 B17R2.41755 Cc1cccc(c1)C(=O)CN2CCC[C@@H]2C e573e3fd831c300771b69911b0416a29 [0,1,0,1,0,0|2,0,0]=4 16065 B17R2.41755 Cc1cccc(c1)C(=O)CN2CCC[C@H]2C ef1af0ba59735982579eff6b0c457401 [0,1,0,1,0,0|2,0,0]=4 16066 B17R2.41755 Cc1cccc(c1)C(=O)NC2CCCC2O e156656012f772dc7d25327051bf1c20 [0,1,0,1,0,0|2,0,0]=4 16067 B17R2.41755 Cc1cccc(c1)C(=O)N[C@@H]2CCC[C@@H]2O 32059750153ce15f3e8b69774314f0f7 [0,1,0,1,0,0|2,0,0]=4 16068 B17R2.41755 Cc1cccc(c1)C(=O)N[C@@H]2CCC[C@H]2O 069cec039d1ef69ffb0405ce7cf8167a [0,1,0,1,0,0|2,0,0]=4 16069 B17R2.41755 Cc1cccc(c1)C(=O)N[C@H]2CCC[C@@H]2O f41c4f8e4f66b067168653483fabf1be [0,1,0,1,0,0|2,0,0]=4 16070 B17R2.41755 Cc1cccc(c1)C(=O)N[C@H]2CCC[C@H]2O 2cb72f285c997a73c814891b37126eb5 [0,1,0,1,0,0|2,0,0]=4 16071 B17R2.41755 O=C(NC1CCCC1O)c2cccc(c2)Br 01ac50690785f192f0f02c20f87792fb [0,1,0,1,0,0|2,0,0]=4 16072 B17R2.41755 O=C(NC1CCCC1O)c2cccc(c2)Cl 6d0e3976d5bde9cd09b3c2ea3e55df7e [0,1,0,1,0,0|2,0,0]=4 16073 B17R2.41755 O=C(NC1CCCC1O)c2cccc(c2)F 73d9b8acbb6a531326b4e92bc13d545e [0,1,0,1,0,0|2,0,0]=4 16074 B17R2.41755 O=C(NC1CCCC1O)c2cccc(c2)I f9d48c682d30e852e8bb5030425d653c [0,1,0,1,0,0|2,0,0]=4 16075 B17R2.41755 O=C(NC1CCCC1O)c2cccc(c2)O c569f872130b00b1f11db33efc486c37 [0,1,0,1,0,0|2,0,0]=4 16076 B17R2.41755 O=C(NC1CCCC1O)c2cccc(c2)S 9ceb9fa0f429799d7dd29d58d4d2415c [0,1,0,1,0,0|2,0,0]=4 16077 B17R2.41755 O=C(N[C@@H]1CCC[C@@H]1O)c2cccc(c2)Br 19f129690582bedb7d388570c2c2ab2f [0,1,0,1,0,0|2,0,0]=4 16078 B17R2.41755 O=C(N[C@@H]1CCC[C@@H]1O)c2cccc(c2)Cl 1d399384b0e674447e9e1f4bed14862f [0,1,0,1,0,0|2,0,0]=4 16079 B17R2.41755 O=C(N[C@@H]1CCC[C@@H]1O)c2cccc(c2)F a0a511a059a5dc932d3a95ac6636d837 [0,1,0,1,0,0|2,0,0]=4 16080 B17R2.41755 O=C(N[C@@H]1CCC[C@@H]1O)c2cccc(c2)I 859d6c1a8b51b72782d2ac9367840131 [0,1,0,1,0,0|2,0,0]=4 16081 B17R2.41755 O=C(N[C@@H]1CCC[C@@H]1O)c2cccc(c2)O e2a38430e086af70c85a01dbd7e37ce2 [0,1,0,1,0,0|2,0,0]=4 16082 B17R2.41755 O=C(N[C@@H]1CCC[C@@H]1O)c2cccc(c2)S f8b7c0062cd879eb56fb81bd403ff325 [0,1,0,1,0,0|2,0,0]=4 16083 B17R2.41755 O=C(N[C@@H]1CCC[C@H]1O)c2cccc(c2)Br 617bf79f6fff302910a6d8418fa3ef7c [0,1,0,1,0,0|2,0,0]=4 16084 B17R2.41755 O=C(N[C@@H]1CCC[C@H]1O)c2cccc(c2)Cl a0f12293074262d885dd8777b69a152b [0,1,0,1,0,0|2,0,0]=4 16085 B17R2.41755 O=C(N[C@@H]1CCC[C@H]1O)c2cccc(c2)F 7078ee82614fee28d539be5c1796d265 [0,1,0,1,0,0|2,0,0]=4 16086 B17R2.41755 O=C(N[C@@H]1CCC[C@H]1O)c2cccc(c2)I 123da34378c39f19d974e2d8efeb5607 [0,1,0,1,0,0|2,0,0]=4 16087 B17R2.41755 O=C(N[C@@H]1CCC[C@H]1O)c2cccc(c2)O 60ca7d4b275fd83569d9ea9d279e6070 [0,1,0,1,0,0|2,0,0]=4 16088 B17R2.41755 O=C(N[C@@H]1CCC[C@H]1O)c2cccc(c2)S 0a5414246a8a3b55472ab1b14a39e20b [0,1,0,1,0,0|2,0,0]=4 16089 B17R2.41755 O=C(N[C@H]1CCC[C@@H]1O)c2cccc(c2)Br 1d0d167f6dd70cfa64d04cfd6c57af67 [0,1,0,1,0,0|2,0,0]=4 16090 B17R2.41755 O=C(N[C@H]1CCC[C@@H]1O)c2cccc(c2)Cl ff0e3d2c14ca426ca75f4af0d35cd844 [0,1,0,1,0,0|2,0,0]=4 16091 B17R2.41755 O=C(N[C@H]1CCC[C@@H]1O)c2cccc(c2)F a1632b3426be7acd32db8f97a00baf70 [0,1,0,1,0,0|2,0,0]=4 16092 B17R2.41755 O=C(N[C@H]1CCC[C@@H]1O)c2cccc(c2)I 062beef53b620834eea0dac2735aa64a [0,1,0,1,0,0|2,0,0]=4 16093 B17R2.41755 O=C(N[C@H]1CCC[C@@H]1O)c2cccc(c2)O 531b226525abfd8dc93e3990a8a6c73d [0,1,0,1,0,0|2,0,0]=4 16094 B17R2.41755 O=C(N[C@H]1CCC[C@@H]1O)c2cccc(c2)S 2f5d62b8b4cc75ca4181be4651fa56dd [0,1,0,1,0,0|2,0,0]=4 16095 B17R2.41755 O=C(N[C@H]1CCC[C@H]1O)c2cccc(c2)Br 4236fde94a9bae6f06d06752352378b5 [0,1,0,1,0,0|2,0,0]=4 16096 B17R2.41755 O=C(N[C@H]1CCC[C@H]1O)c2cccc(c2)Cl 3071409ef1ab78fb2e3829e39fc31ef1 [0,1,0,1,0,0|2,0,0]=4 16097 B17R2.41755 O=C(N[C@H]1CCC[C@H]1O)c2cccc(c2)F 69a7563bed7e4ccd763c8603a352d98d [0,1,0,1,0,0|2,0,0]=4 16098 B17R2.41755 O=C(N[C@H]1CCC[C@H]1O)c2cccc(c2)I 08b6793145260c18f1d7f6cd5097fe36 [0,1,0,1,0,0|2,0,0]=4 16099 B17R2.41755 O=C(N[C@H]1CCC[C@H]1O)c2cccc(c2)O 17af8685b9c0f4099611b73d2e0bf1cd [0,1,0,1,0,0|2,0,0]=4 16100 B17R2.41755 O=C(N[C@H]1CCC[C@H]1O)c2cccc(c2)S f30575f9273900aa7e59461bd898db92 [0,1,0,1,0,0|2,0,0]=4 16101 B17R2.56129 CCCCN1CCC(=O)c2c1ccc(c2)Br b21dd20531b32f9bbc0996b5f1c36204 [0,1,0,1,0,0|2,0,0]=4 16102 B17R2.56129 CCCCN1CCC(=O)c2c1ccc(c2)C 2da94413ed4d21547d01d926741ded66 [0,1,0,1,0,0|2,0,0]=4 16103 B17R2.56129 CCCCN1CCC(=O)c2c1ccc(c2)Cl c6ccd344158e269b9c4578a5f129633b [0,1,0,1,0,0|2,0,0]=4 16104 B17R2.56129 CCCCN1CCC(=O)c2c1ccc(c2)F e90ba0fae1b83d41ff8cfdbe5a1aba3c [0,1,0,1,0,0|2,0,0]=4 16105 B17R2.56129 CCCCN1CCC(=O)c2c1ccc(c2)I 6a7f5d7bed54f605e324fe3bad533fc2 [0,1,0,1,0,0|2,0,0]=4 16106 B17R2.90438 CCCN1CCCC(=O)c2c1ccc(c2)Br 462d97e4df89874cb0b0e36a6a80a34f [0,1,0,1,0,0|2,0,0]=4 16107 B17R2.90438 CCCN1CCCC(=O)c2c1ccc(c2)C f74ceb8d848d5c62a45699c97e0a3308 [0,1,0,1,0,0|2,0,0]=4 16108 B17R2.90438 CCCN1CCCC(=O)c2c1ccc(c2)Cl 15dd583ae9d3f2f86b262f0419dfc65a [0,1,0,1,0,0|2,0,0]=4 16109 B17R2.273415 Cc1cc(ccn1)C(=O)N2CCCCCC2 fe77bb3268038e972b672fb6147a8869 [0,1,0,1,0,0|2,0,0]=4 16110 B17R2.273415 Cc1cccc(c1)C(=O)N2CCCCCC2 0fc0f1fe712d8177f51dd9a5ad2970da [0,1,0,1,0,0|1,0,0]=3 16111 B17R2.273415 Cc1cccc(c1)C(=O)N2CCCOCC2 93a173c712b7ebea51846e453d77a3d5 [0,1,0,1,0,0|2,0,0]=4 16112 B17R2.273415 Cc1cccc(n1)C(=O)N2CCCCCC2 f077289e4ef67f8ce38572c3acae911c [0,1,0,1,0,0|2,0,0]=4 16113 B17R2.273415 Cc1ccnc(c1)C(=O)N2CCCCCC2 c320a9367bb0361391f997c065b83cf0 [0,1,0,1,0,0|2,0,0]=4 16114 B17R2.273415 Cc1cncc(c1)C(=O)N2CCCCCC2 94e9f7e6622bf5303dfda3ccab9dda44 [0,1,0,1,0,0|2,0,0]=4 16115 B17R2.273415 O=C(c1cc(=O)cco1)N2CCCCCC2 0dc1f92fce362050939a128e9f927061 [0,1,0,1,0,0|2,0,0]=4 16116 B17R2.273415 O=C(c1cc(ccn1)Br)N2CCCCCC2 3c627f9acbe965d180296deef87d761a [0,1,0,1,0,0|2,0,0]=4 16117 B17R2.273415 O=C(c1cc(ccn1)Cl)N2CCCCCC2 555917001bb143c50d4a918385a6d42a [0,1,0,1,0,0|2,0,0]=4 16118 B17R2.273415 O=C(c1cc(ccn1)F)N2CCCCCC2 742552aa19ea31da6d27671bc83844a4 [0,1,0,1,0,0|2,0,0]=4 16119 B17R2.273415 O=C(c1cc(ccn1)I)N2CCCCCC2 d2b64cd150aaf1e7e1ea9037240d593a [0,1,0,1,0,0|2,0,0]=4 16120 B17R2.273415 O=C(c1cc(ccn1)O)N2CCCCCC2 0be606b79d40890a73ac3769eb9fde37 [0,1,0,1,0,0|2,0,0]=4 16121 B17R2.273415 O=C(c1ccc[n+](c1)[O-])N2CCCCCC2 846dc5e5cb798aa5ff080a2f18b7b0c8 [0,1,0,1,0,0|2,0,0]=4 16122 B17R2.273415 O=C(c1cccc(c1)Br)N2CCCCCC2 cafbd292b173e900012ffdbfd8561793 [0,1,0,1,0,0|1,0,0]=3 16123 B17R2.273415 O=C(c1cccc(c1)Br)N2CCCOCC2 daa0f57c06a58344dde8fa1ccf1caef1 [0,1,0,1,0,0|2,0,0]=4 16124 B17R2.273415 O=C(c1cccc(c1)Cl)N2CCCCCC2 8c80b16aaab53aaae9348251a5796e63 [0,1,0,1,0,0|1,0,0]=3 16125 B17R2.273415 O=C(c1cccc(c1)Cl)N2CCCOCC2 d8c444daf826853d8f948ff59ecae90d [0,1,0,1,0,0|2,0,0]=4 16126 B17R2.273415 O=C(c1cccc(c1)F)N2CCCCCC2 fcec026285ca09a1364dbf171fcddcab [0,1,0,1,0,0|1,0,0]=3 16127 B17R2.273415 O=C(c1cccc(c1)F)N2CCCOCC2 42f8b09edcc421d78d375dc3d97eaf12 [0,1,0,1,0,0|2,0,0]=4 16128 B17R2.273415 O=C(c1cccc(c1)I)N2CCCCCC2 588b1c1b854e78ebf386123690af1616 [0,1,0,1,0,0|1,0,0]=3 16129 B17R2.273415 O=C(c1cccc(c1)I)N2CCCOCC2 f45b1734bee1deaf5b9226dc432f87d7 [0,1,0,1,0,0|2,0,0]=4 16130 B17R2.273415 O=C(c1cccc(c1)O)N2CCCCCC2 93b1bd9251f50612011a13915cc0cb74 [0,1,0,1,0,0|1,0,0]=3 16131 B17R2.273415 O=C(c1cccc(c1)O)N2CCCOCC2 7bc3397fd536bfcf7ea125129428bbaa [0,1,0,1,0,0|2,0,0]=4 16132 B17R2.273415 O=C(c1cccc(c1)S)N2CCCCCC2 e5e1468c568c51762e4bfd7aaa52d87d [0,1,0,1,0,0|1,0,0]=3 16133 B17R2.273415 O=C(c1cccc(c1)S)N2CCCOCC2 c89a88ede2f26754bfea77fe1a435e1d [0,1,0,1,0,0|2,0,0]=4 16134 B17R2.273415 O=C(c1cccc(n1)Br)N2CCCCCC2 ad53b4c30bf580b52bf3a8b6c6725171 [0,1,0,1,0,0|2,0,0]=4 16135 B17R2.273415 O=C(c1cccc(n1)Cl)N2CCCCCC2 f9dadc2ef80b4c1279584b0f59bbcf22 [0,1,0,1,0,0|2,0,0]=4 16136 B17R2.273415 O=C(c1cccc(n1)F)N2CCCCCC2 2dd1503e249e10420caa9d92e3c610a2 [0,1,0,1,0,0|2,0,0]=4 16137 B17R2.273415 O=C(c1cccc(n1)I)N2CCCCCC2 366b09f890b90e32a05812a9fe3a3264 [0,1,0,1,0,0|2,0,0]=4 16138 B17R2.273415 O=C(c1cccc(n1)O)N2CCCCCC2 62a53155bf86ea781045718d89189dab [0,1,0,1,0,0|2,0,0]=4 16139 B17R2.273415 O=C(c1ccnc(c1)Br)N2CCCCCC2 66c20204b8a28391a752f66c30cbc80b [0,1,0,1,0,0|2,0,0]=4 16140 B17R2.273415 O=C(c1ccnc(c1)Cl)N2CCCCCC2 adf66f47ef0d1038e5642a4b3076073d [0,1,0,1,0,0|2,0,0]=4 16141 B17R2.273415 O=C(c1ccnc(c1)F)N2CCCCCC2 d2ab4dcb66ec30ddc55f6e1f553404b1 [0,1,0,1,0,0|2,0,0]=4 16142 B17R2.273415 O=C(c1ccnc(c1)I)N2CCCCCC2 1bcee3f3ad2699c9586f59e5aecddb44 [0,1,0,1,0,0|2,0,0]=4 16143 B17R2.273415 O=C(c1ccnc(c1)O)N2CCCCCC2 b47c76d5bf2d3fbfcd826b02f07c129b [0,1,0,1,0,0|2,0,0]=4 16144 B17R2.273415 O=C(c1ccnc(c1)S)N2CCCCCC2 b28d5343ff3500e07ff9abf22fb4c470 [0,1,0,1,0,0|2,0,0]=4 16145 B17R2.273415 O=C(c1cncc(c1)Br)N2CCCCCC2 2c8c3b7d9bdf37e25e6e92241e8351e7 [0,1,0,1,0,0|2,0,0]=4 16146 B17R2.273415 O=C(c1cncc(c1)Cl)N2CCCCCC2 7237bd8fdae99867fd5ab6d01239d6cc [0,1,0,1,0,0|2,0,0]=4 16147 B17R2.273415 O=C(c1cncc(c1)F)N2CCCCCC2 2743fc5774d3a4660d59767f1fe747f5 [0,1,0,1,0,0|2,0,0]=4 16148 B17R2.273415 O=C(c1cncc(c1)I)N2CCCCCC2 2bfb6e4a9131cc4e0428ef325616b7c5 [0,1,0,1,0,0|2,0,0]=4 16149 B17R2.273415 O=C(c1cncc(c1)O)N2CCCCCC2 4596866673a0562201e7e513833a6656 [0,1,0,1,0,0|2,0,0]=4 16150 B17R2.273421 CC(OCCCC1CC1)c2cccc(c2)Cl e6e86f265e470637e347979fff981352 [0,1,0,1,0,0|1,0,1]=4 16151 B17R2.273421 CC(OCCCC1CC1)c2cccc(c2)F 23d4efc2b04914c68dcd4adf8154eb13 [0,1,0,1,0,0|1,0,1]=4 16152 B17R2.273421 Cc1cccc(c1)C(=O)CCCOC2CC2 e4783ada68ff2a9cd40e873467ab7f60 [0,1,0,1,0,0|2,0,0]=4 16153 B17R2.273421 Cc1cccc(c1)C(=O)CNCCC2CC2 eaf454dd2bda88e35ac893de0cfea84f [0,1,0,1,0,0|2,0,0]=4 16154 B17R2.273421 Cc1cccc(c1)C(=O)COCCC2CC2 fd12ae2039e688dbc44f9ef3d64b98f7 [0,1,0,1,0,0|2,0,0]=4 16155 B17R2.273421 Cc1cccc(c1)C(=O)NCCOC2CC2 2819a41db18665ea7d32a51cb9c5b78a [0,1,0,1,0,0|2,0,0]=4 16156 B17R2.273421 Cc1cccc(c1)C(=O)NCOCC2CC2 28fa9ae0dc853a1637f181de172c43e5 [0,1,0,1,0,0|2,0,0]=4 16157 B17R2.273421 O=C(CCCNC1CC1)c2cccc(c2)F f3f5436f2f986480cf506e59560a6949 [0,1,0,1,0,0|2,0,0]=4 16158 B17R2.273421 O=C(CCCOC1CC1)c2cccc(c2)F f978c6543290ed3e764dd81a84853a0b [0,1,0,1,0,0|2,0,0]=4 16159 B17R2.273421 O=C(CNCCC1CC1)c2cccc(c2)Br 1ee85c9d1389f6ff5f55c67d47a3c957 [0,1,0,1,0,0|2,0,0]=4 16160 B17R2.273421 O=C(CNCCC1CC1)c2cccc(c2)Cl 814a57e578f691ec08a6f635f6d3156b [0,1,0,1,0,0|2,0,0]=4 16161 B17R2.273421 O=C(CNCCC1CC1)c2cccc(c2)F 7a18756bffa1775eaa6e5b155e065f3c [0,1,0,1,0,0|2,0,0]=4 16162 B17R2.273421 O=C(CNCCC1CC1)c2cccc(c2)I 88470c526655bb721a2043be9f9c73fb [0,1,0,1,0,0|2,0,0]=4 16163 B17R2.273421 O=C(COCCC1CC1)c2cccc(c2)Br f58dd232d6d4e721a8b9dade2300cb95 [0,1,0,1,0,0|2,0,0]=4 16164 B17R2.273421 O=C(COCCC1CC1)c2cccc(c2)Cl 980df66defdde889e6e5f01766b18cc0 [0,1,0,1,0,0|2,0,0]=4 16165 B17R2.273421 O=C(COCCC1CC1)c2cccc(c2)F ee03362d9d81cd6c1d12e8187918025a [0,1,0,1,0,0|2,0,0]=4 16166 B17R2.273421 O=C(COCCC1CC1)c2cccc(c2)I 7217b4d1a91933840ef3c2c41ec783a6 [0,1,0,1,0,0|2,0,0]=4 16167 B17R2.273421 O=C(NCCOC1CC1)c2cccc(c2)Br dbd7b91857fa3045e0023df6ea48cff6 [0,1,0,1,0,0|2,0,0]=4 16168 B17R2.273421 O=C(NCCOC1CC1)c2cccc(c2)Cl a44dd2928a32b89ab100932998a618b1 [0,1,0,1,0,0|2,0,0]=4 16169 B17R2.273421 O=C(NCCOC1CC1)c2cccc(c2)F 2b4f5424e819b74dbc9332624f6a5a07 [0,1,0,1,0,0|2,0,0]=4 16170 B17R2.273421 O=C(NCCOC1CC1)c2cccc(c2)I 23b54c1ad465401a86df450c7df1ad8b [0,1,0,1,0,0|2,0,0]=4 16171 B17R2.273421 O=C(NCCOC1CC1)c2cccc(c2)O ef48aeaf5f5443fb71fd59a0c3db37c2 [0,1,0,1,0,0|2,0,0]=4 16172 B17R2.273421 O=C(NCCOC1CC1)c2cccc(c2)S d10cf796d93b44598ca21775cc6258ca [0,1,0,1,0,0|2,0,0]=4 16173 B17R2.273432 CC(OCCC1CCC1)c2cccc(c2)Br 5ddcadea55832ca4f15277174b586a13 [0,1,0,1,0,0|1,0,1]=4 16174 B17R2.273432 CC(OCCC1CCC1)c2cccc(c2)Cl 77bf3503c48c465b390491fa4028f57b [0,1,0,1,0,0|1,0,1]=4 16175 B17R2.273432 CC(OCCC1CCC1)c2cccc(c2)F 37f1e2dfcbc5174f0074efdc1b840853 [0,1,0,1,0,0|1,0,1]=4 16176 B17R2.273432 CC(OCCC1CCC1)c2cccc(c2)I 36e1db2ee760f54e4be4b619cf398c3e [0,1,0,1,0,0|1,0,1]=4 16177 B17R2.273432 C[C@@H](OCCC1CCC1)c2cccc(c2)Br 530ba11d0c337113429e854405adbe63 [0,1,0,1,0,0|1,0,1]=4 16178 B17R2.273432 C[C@@H](OCCC1CCC1)c2cccc(c2)Cl 42b85e81d047b4623baae2da4d1d1319 [0,1,0,1,0,0|1,0,1]=4 16179 B17R2.273432 C[C@@H](OCCC1CCC1)c2cccc(c2)F 2baa6fa108fc516e2558cf8765a4b80b [0,1,0,1,0,0|1,0,1]=4 16180 B17R2.273432 C[C@H](OCCC1CCC1)c2cccc(c2)Br d6d6d78078c29f3b3778ea30b2cc0236 [0,1,0,1,0,0|1,0,1]=4 16181 B17R2.273432 C[C@H](OCCC1CCC1)c2cccc(c2)Cl c3910192adeba9f5783bb81f05c00597 [0,1,0,1,0,0|1,0,1]=4 16182 B17R2.273432 C[C@H](OCCC1CCC1)c2cccc(c2)F 1c6d215950443cd18b0c8547ef2d31d9 [0,1,0,1,0,0|1,0,1]=4 16183 B17R2.273432 Cc1cc(ccn1)C(=O)NCCC2CCC2 f825b97aeb666dd28f353e4abdbbb9ed [0,1,0,1,0,0|2,0,0]=4 16184 B17R2.273432 Cc1cccc(c1)C(=O)CNCC2CCC2 f2fa20278bd59dcd4d46a34e5da852f7 [0,1,0,1,0,0|2,0,0]=4 16185 B17R2.273432 Cc1cccc(c1)C(=O)COCC2CCC2 dc9939442cd75eb4367adc39483488f9 [0,1,0,1,0,0|2,0,0]=4 16186 B17R2.273432 Cc1cccc(c1)C(=O)NCCC2CCC2 95311ab1cd868c7ab7eb29e5f82fcb8e [0,1,0,1,0,0|1,0,0]=3 16187 B17R2.273432 Cc1cccc(c1)C(=O)NCCC2CCO2 8bb4de5b3ee2cd421fc8b32dea32b27f [0,1,0,1,0,0|2,0,0]=4 16188 B17R2.273432 Cc1cccc(c1)C(=O)NCCC2COC2 473f0948537b62ce07eb9f6e75ec4cb2 [0,1,0,1,0,0|2,0,0]=4 16189 B17R2.273432 Cc1cccc(c1)C(=O)NCCN2CCC2 fed9644e2b4e95786995721a61c40cc1 [0,1,0,1,0,0|2,0,0]=4 16190 B17R2.273432 Cc1cccc(c1)C(=O)NCC[C@@H]2CCO2 56d538fc9edde2fbba7429519e988982 [0,1,0,1,0,0|2,0,0]=4 16191 B17R2.273432 Cc1cccc(c1)C(=O)NCOC2CCC2 1685cdeade91b73ce91247038c47a170 [0,1,0,1,0,0|2,0,0]=4 16192 B17R2.273432 Cc1cccc(c1)C(C)OCCC2CCC2 34855646ee4d70be984cd0447b8ca449 [0,1,0,1,0,0|1,0,1]=4 16193 B17R2.273432 Cc1cccc(c1)[C@@H](C)OCCC2CCC2 989b840f9f516e52b0e0ecadfbddbe2e [0,1,0,1,0,0|1,0,1]=4 16194 B17R2.273432 Cc1cccc(c1)[C@H](C)OCCC2CCC2 3bccff12daebe34ea4f992787337a6b6 [0,1,0,1,0,0|1,0,1]=4 16195 B17R2.273432 Cc1cccc(n1)C(=O)NCCC2CCC2 2254e4d6c8baaabaeb9526cc33efc1b3 [0,1,0,1,0,0|2,0,0]=4 16196 B17R2.273432 Cc1ccnc(c1)C(=O)NCCC2CCC2 dcbcba484ceab258aae2d43a10639f3b [0,1,0,1,0,0|2,0,0]=4 16197 B17R2.273432 Cc1cncc(c1)C(=O)NCCC2CCC2 943dcb6ae2611a6b68a8450ed909a19c [0,1,0,1,0,0|2,0,0]=4 16198 B17R2.273432 O=C(CCCN1CCC1)c2cccc(c2)F 55c85a2b797e6ea208dfd42ca8d07a51 [0,1,0,1,0,0|2,0,0]=4 16199 B17R2.273432 O=C(CNCC1CCC1)c2cccc(c2)Br 3d9861f830cd9ac4468e8b7782dfb4c2 [0,1,0,1,0,0|2,0,0]=4 16200 B17R2.273432 O=C(CNCC1CCC1)c2cccc(c2)Cl cc507fa576d24b64c3c9444c29a78131 [0,1,0,1,0,0|2,0,0]=4 16201 B17R2.273432 O=C(CNCC1CCC1)c2cccc(c2)F 1fa97407b9641bf1b44f4edb362f2abf [0,1,0,1,0,0|2,0,0]=4 16202 B17R2.273432 O=C(CNCC1CCC1)c2cccc(c2)I 555bd6c009f49affd120d19a7f5622dd [0,1,0,1,0,0|2,0,0]=4 16203 B17R2.273432 O=C(COCC1CCC1)c2cccc(c2)Br cb4287608eb95371e2d86f9bafd899f5 [0,1,0,1,0,0|2,0,0]=4 16204 B17R2.273432 O=C(COCC1CCC1)c2cccc(c2)Cl 809487f348955d2b7b6ed55bfb047989 [0,1,0,1,0,0|2,0,0]=4 16205 B17R2.273432 O=C(COCC1CCC1)c2cccc(c2)F 0a5791cc35c96cec80ac945684732f29 [0,1,0,1,0,0|2,0,0]=4 16206 B17R2.273432 O=C(COCC1CCC1)c2cccc(c2)I 510fbd8cb8ac62af611984d6677d3124 [0,1,0,1,0,0|2,0,0]=4 16207 B17R2.273432 O=C(NCCC1CCC1)c2cc(=O)cco2 9b08990c5f03d4b15447f87602a7a335 [0,1,0,1,0,0|2,0,0]=4 16208 B17R2.273432 O=C(NCCC1CCC1)c2cc(ccn2)Br f258ba244bc050d733ee680742ba4173 [0,1,0,1,0,0|2,0,0]=4 16209 B17R2.273432 O=C(NCCC1CCC1)c2cc(ccn2)Cl 382c9594345ab7be133cac1610616f44 [0,1,0,1,0,0|2,0,0]=4 16210 B17R2.273432 O=C(NCCC1CCC1)c2cc(ccn2)F eb8bdba7e6d73fe50c0e8f88dc75f95c [0,1,0,1,0,0|2,0,0]=4 16211 B17R2.273432 O=C(NCCC1CCC1)c2cc(ccn2)I 6ffd527dcd279fa94b2b9a3b047e7bdf [0,1,0,1,0,0|2,0,0]=4 16212 B17R2.273432 O=C(NCCC1CCC1)c2cc(ccn2)O 9eacb4f238e8cca5c3b34e9baf90bb10 [0,1,0,1,0,0|2,0,0]=4 16213 B17R2.273432 O=C(NCCC1CCC1)c2ccc[n+](c2)[O-] 1f52f56f57f7d4c316c9ee7ebdb07109 [0,1,0,1,0,0|2,0,0]=4 16214 B17R2.273432 O=C(NCCC1CCC1)c2cccc(c2)Br 6b8edbe745c2649fe4465a41852556b0 [0,1,0,1,0,0|1,0,0]=3 16215 B17R2.273432 O=C(NCCC1CCC1)c2cccc(c2)Cl b65c074ea865a4a55d243b8d8decfc95 [0,1,0,1,0,0|1,0,0]=3 16216 B17R2.273432 O=C(NCCC1CCC1)c2cccc(c2)F 316dd6a6b30d4eefc19de26025bef8a9 [0,1,0,1,0,0|1,0,0]=3 16217 B17R2.273432 O=C(NCCC1CCC1)c2cccc(c2)I 08d3968db66b8dc04c58215a29129695 [0,1,0,1,0,0|1,0,0]=3 16218 B17R2.273432 O=C(NCCC1CCC1)c2cccc(c2)O 500dbb55fcdbfe7bc937732c2b168d7f [0,1,0,1,0,0|1,0,0]=3 16219 B17R2.273432 O=C(NCCC1CCC1)c2cccc(c2)S f39f0bd30a3ceac650dcf24dfe5ecbd5 [0,1,0,1,0,0|1,0,0]=3 16220 B17R2.273432 O=C(NCCC1CCC1)c2cccc(n2)Br b2573aeb4f899628cc6f23a887c209a8 [0,1,0,1,0,0|2,0,0]=4 16221 B17R2.273432 O=C(NCCC1CCC1)c2cccc(n2)Cl 9a069724312e7e0b64e13ba83449529f [0,1,0,1,0,0|2,0,0]=4 16222 B17R2.273432 O=C(NCCC1CCC1)c2cccc(n2)F 2f543d3fea7ca3c0500e8d94261cd619 [0,1,0,1,0,0|2,0,0]=4 16223 B17R2.273432 O=C(NCCC1CCC1)c2cccc(n2)I 3c90cfbd6fcf49678a808be5b9607b6e [0,1,0,1,0,0|2,0,0]=4 16224 B17R2.273432 O=C(NCCC1CCC1)c2cccc(n2)O a8185a13f8a977ae8b247951e4824a13 [0,1,0,1,0,0|2,0,0]=4 16225 B17R2.273432 O=C(NCCC1CCC1)c2ccnc(c2)Br 9ce5d252f0953b3ab1216bdbc0710a95 [0,1,0,1,0,0|2,0,0]=4 16226 B17R2.273432 O=C(NCCC1CCC1)c2ccnc(c2)Cl 64cc19c8efc9cdaa6a2d8aefb1ecb4ab [0,1,0,1,0,0|2,0,0]=4 16227 B17R2.273432 O=C(NCCC1CCC1)c2ccnc(c2)F 064c4840525510fdbe91ee91372f2461 [0,1,0,1,0,0|2,0,0]=4 16228 B17R2.273432 O=C(NCCC1CCC1)c2ccnc(c2)I 27665464599394c0c66085d5fff81d41 [0,1,0,1,0,0|2,0,0]=4 16229 B17R2.273432 O=C(NCCC1CCC1)c2ccnc(c2)O fe7e23daafacc463693333defe0284d5 [0,1,0,1,0,0|2,0,0]=4 16230 B17R2.273432 O=C(NCCC1CCC1)c2ccnc(c2)S 22a43e08ba9ff168661efe2ea9eaf5ac [0,1,0,1,0,0|2,0,0]=4 16231 B17R2.273432 O=C(NCCC1CCC1)c2cncc(c2)Br 296392e6a394da1ee03a3af0c7c562b7 [0,1,0,1,0,0|2,0,0]=4 16232 B17R2.273432 O=C(NCCC1CCC1)c2cncc(c2)Cl 85e32b5cb098bdf6166fa3d404846faf [0,1,0,1,0,0|2,0,0]=4 16233 B17R2.273432 O=C(NCCC1CCC1)c2cncc(c2)F 823dde3aedc02db15a32b2fbda27ecee [0,1,0,1,0,0|2,0,0]=4 16234 B17R2.273432 O=C(NCCC1CCC1)c2cncc(c2)I ceb3e921a3e09a6f074802482582fa4b [0,1,0,1,0,0|2,0,0]=4 16235 B17R2.273432 O=C(NCCC1CCC1)c2cncc(c2)O 4035483fbc0f3f9e6f6ff158b226200b [0,1,0,1,0,0|2,0,0]=4 16236 B17R2.273432 O=C(NCCC1CCO1)c2cccc(c2)Br 1d9dfe75e7fc4f319ebbd496507773ef [0,1,0,1,0,0|2,0,0]=4 16237 B17R2.273432 O=C(NCCC1CCO1)c2cccc(c2)Cl 03dfefd10c2bcc2967864018810288c8 [0,1,0,1,0,0|2,0,0]=4 16238 B17R2.273432 O=C(NCCC1CCO1)c2cccc(c2)F 38f2ae99c65379048a7ff1a03c83d2cc [0,1,0,1,0,0|2,0,0]=4 16239 B17R2.273432 O=C(NCCC1CCO1)c2cccc(c2)I e44b1062c1f5c36d8386849f70221364 [0,1,0,1,0,0|2,0,0]=4 16240 B17R2.273432 O=C(NCCC1CCO1)c2cccc(c2)O d1f6d5f1605a1bf49a1011dec87449e9 [0,1,0,1,0,0|2,0,0]=4 16241 B17R2.273432 O=C(NCCC1CCO1)c2cccc(c2)S 5e444eda0702da96c0b8eb2b09c43c5c [0,1,0,1,0,0|2,0,0]=4 16242 B17R2.273432 O=C(NCCC1COC1)c2cccc(c2)Br 77f8663a98f691d5a47a59c04ce3f699 [0,1,0,1,0,0|2,0,0]=4 16243 B17R2.273432 O=C(NCCC1COC1)c2cccc(c2)Cl 3ad4bc9ec7c760bd02e6e08c554aaf5f [0,1,0,1,0,0|2,0,0]=4 16244 B17R2.273432 O=C(NCCC1COC1)c2cccc(c2)F 0dbbd624ee48ee4411b02bcc388bb128 [0,1,0,1,0,0|2,0,0]=4 16245 B17R2.273432 O=C(NCCC1COC1)c2cccc(c2)I 93352273a3b0763594debc2373b2ab34 [0,1,0,1,0,0|2,0,0]=4 16246 B17R2.273432 O=C(NCCC1COC1)c2cccc(c2)O acb94b568dc186ebf71d8b93a5889b67 [0,1,0,1,0,0|2,0,0]=4 16247 B17R2.273432 O=C(NCCC1COC1)c2cccc(c2)S e7aae8b364be2ffb07df95731c715e50 [0,1,0,1,0,0|2,0,0]=4 16248 B17R2.273432 O=C(NCCN1CCC1)c2cccc(c2)Br 51f88c22578bbf4510ec5a9e67cf03e3 [0,1,0,1,0,0|2,0,0]=4 16249 B17R2.273432 O=C(NCCN1CCC1)c2cccc(c2)Cl 59c328183074c9771be334d4bff1f876 [0,1,0,1,0,0|2,0,0]=4 16250 B17R2.273432 O=C(NCCN1CCC1)c2cccc(c2)F 50ceabcdc4a7d49ed74d4e46d23b7312 [0,1,0,1,0,0|2,0,0]=4 16251 B17R2.273432 O=C(NCCN1CCC1)c2cccc(c2)I 809ad71ef6ab6ce0c5f14b94154df476 [0,1,0,1,0,0|2,0,0]=4 16252 B17R2.273432 O=C(NCCN1CCC1)c2cccc(c2)O 43b39de80c2818052f922bd950fb3cd7 [0,1,0,1,0,0|2,0,0]=4 16253 B17R2.273432 O=C(NCCN1CCC1)c2cccc(c2)S d3abe2201d83fa5f18581e6284034f40 [0,1,0,1,0,0|2,0,0]=4 16254 B17R2.273432 O=C(NCC[C@@H]1CCO1)c2cccc(c2)Br e9b83d8d4e6564ce03c77461554ca290 [0,1,0,1,0,0|2,0,0]=4 16255 B17R2.273432 O=C(NCC[C@@H]1CCO1)c2cccc(c2)Cl 033e9c63b9eb539da1ea80be7e4a00d0 [0,1,0,1,0,0|2,0,0]=4 16256 B17R2.273432 O=C(NCC[C@@H]1CCO1)c2cccc(c2)F 59f08839b9439819920cbb68548a4e57 [0,1,0,1,0,0|2,0,0]=4 16257 B17R2.273432 O=C(NCC[C@@H]1CCO1)c2cccc(c2)I 9c2949b23d730fed295410b68b743058 [0,1,0,1,0,0|2,0,0]=4 16258 B17R2.273432 O=C(NCC[C@@H]1CCO1)c2cccc(c2)O 09130516a14ba9448f2d327e87c8a8b6 [0,1,0,1,0,0|2,0,0]=4 16259 B17R2.273432 O=C(NCC[C@@H]1CCO1)c2cccc(c2)S 747b9956cb383a07d96e32384363f901 [0,1,0,1,0,0|2,0,0]=4 16260 B17R2.299256 CCCCOC1OC(=O)c2c1ccc(c2)Br 7f4d629f2331dfbbc2909995d7d9620b [0,1,0,1,0,0|1,0,0]=3 16261 B17R2.299256 COCCOC1OC(=O)c2c1ccc(c2)Br 59c45074102b7d6a387bbdebe73d7489 [0,1,0,1,0,0|2,0,0]=4 16262 B17R2.299256 CSCCOC1OC(=O)c2c1ccc(c2)Br 7e0e3216d946bad6b62add88f675b88c [0,1,0,1,0,0|2,0,0]=4 16263 B17R2.299256 O=C1OC(c2c1cc(cc2)Br)OCCCF 431f2590439fb80aa86dd5f2cf936bbf [0,1,0,1,0,0|2,0,0]=4 16264 B17R2.299256 O=C1OC(c2c1cc(cc2)Br)OCCCS 254cd071fa39a78ac14370430f5e7068 [0,1,0,1,0,0|2,0,0]=4 16265 B17R2.345881 CCCCN1CCC(=O)c2c1c(ccc2)C 8d1beb68db8513adf2e5c04b814355b7 [0,1,0,1,0,0|2,0,0]=4 16266 B17R2.345881 CCCCN1CCC(=O)c2c1c(ccc2)F 0602eb2f58f486333b506c5e32626ee1 [0,1,0,1,0,0|2,0,0]=4 16267 B17R2.345881 CCCCN1CCC(=O)c2c1c(ccc2)I 92795fbd39a26a413ec708a0dfe8dd9a [0,1,0,1,0,0|2,0,0]=4 16268 B17R2.368118 CCCCCCO[C@@H]1Cc2c1cc(cc2)Br c06a10a40ce573978cecd9e586b8ba8f [0,1,0,1,0,0|1,0,1]=4 16269 B17R2.3241 CC1CCC(C1)NCC(=O)c2ccccc2 356e8f0a350aca2e9ff4ca24cad3f77c [0,1,0,1,0,0|2,0,0]=4 16270 B17R2.3241 CC1CCC(C1)OCC(=O)c2ccccc2 899bbfb459709b4e8517151bacb10ecc [0,1,0,1,0,0|2,0,0]=4 16271 B17R2.3241 CC1CCN(C1)CCC(=O)c2ccccc2 056f11495fddfb2b83bc1d7cf97a0bb9 [0,1,0,1,0,0|2,0,0]=4 16272 B17R2.3241 CC1CCN(C1)COC(=O)c2ccccc2 c0cec25eddca891193e26c266772b31b [0,1,0,1,0,0|1,0,0]=3 16273 B17R2.3241 CN1CCC(C1)CNC(=O)c2ccccc2 8b00b47ada4ebf325e8165e7be8e0ce7 [0,1,0,1,0,0|2,0,0]=4 16274 B17R2.3241 CN1CCN(C1)COC(=O)c2ccccc2 789a2410cd7ff29dd709455440609321 [0,1,0,1,0,0|2,0,0]=4 16275 B17R2.3241 CN1CC[C@@H](C1)CNC(=O)c2ccccc2 e2edd752c0975cd2cc51cc1eb7f15c14 [0,1,0,1,0,0|2,0,0]=4 16276 B17R2.3241 CN1CC[C@H](C1)CNC(=O)c2ccccc2 58abb9bbb58d723a49e3c0920c2a98de [0,1,0,1,0,0|2,0,0]=4 16277 B17R2.3241 O=C(CNC1CCC(C1)O)c2ccccc2 7192b96ecee2aa89621887d633f4ef45 [0,1,0,1,0,0|2,0,0]=4 16278 B17R2.3241 O=C(CN[C@@H]1CC[C@@H](C1)O)c2ccccc2 6266fc9d3df49756c1c0035825720cc6 [0,1,0,1,0,0|2,0,0]=4 16279 B17R2.3241 O=C(CN[C@@H]1CC[C@H](C1)O)c2ccccc2 8ca2160070b41a2d9c506a7767f40cf1 [0,1,0,1,0,0|2,0,0]=4 16280 B17R2.3241 O=C(CN[C@H]1CC[C@@H](C1)O)c2ccccc2 c851e7ca7df64cdf98752f17b061a538 [0,1,0,1,0,0|2,0,0]=4 16281 B17R2.3241 O=C(CN[C@H]1CC[C@H](C1)O)c2ccccc2 55352276d37046d20d211aedbfb17f63 [0,1,0,1,0,0|2,0,0]=4 16282 B17R2.3241 O=C(NCC1CCC(C1)O)c2ccccc2 7544a7d1f6b1abf72e576c021a138421 [0,1,0,1,0,0|1,0,0]=3 16283 B17R2.3241 O=C(NCC1CCC(C1)O)c2ccccn2 16da6e3fea7bcb134c996fcea1b60c6e [0,1,0,1,0,0|2,0,0]=4 16284 B17R2.3241 O=C(NCC1CCC(C1)O)c2cccnc2 a200391d5db3456c6cc0f0b9f8e6639b [0,1,0,1,0,0|2,0,0]=4 16285 B17R2.3241 O=C(NCC1CCC(C1)O)c2ccncc2 1bc1b3ddea4bce8dd98ba985080ca7e4 [0,1,0,1,0,0|2,0,0]=4 16286 B17R2.3241 O=C(OCN1CCC(C1)F)c2ccccc2 0bfc3e88b92dd757eb73474aeb1550c5 [0,1,0,1,0,0|1,0,0]=3 16287 B17R2.3241 O=C(OCN1CCC(C1)O)c2ccccc2 e1779fce0b25b7af86d3961eb1b5e7af [0,1,0,1,0,0|1,0,0]=3 16288 B17R2.3241 O=C(OCN1CC[C@@H](C1)F)c2ccccc2 542b3c52730d5f08c39ca1709cc395ce [0,1,0,1,0,0|1,0,0]=3 16289 B17R2.3241 O=C(OCN1CC[C@@H](C1)O)c2ccccc2 ec7139413faf6af458964f248ac53e2c [0,1,0,1,0,0|1,0,0]=3 16290 B17R2.3241 O=C(OCN1CC[C@H](C1)F)c2ccccc2 e7bb6082876a850b17402110fa9284d1 [0,1,0,1,0,0|1,0,0]=3 16291 B17R2.3241 O=C(OCN1CC[C@H](C1)O)c2ccccc2 cedc10ea8221a4b5076cd2958cac88e6 [0,1,0,1,0,0|1,0,0]=3 16292 B17R2.5223 CC1CC(C1)CNCC(=O)c2ccccc2 bdfb44099df361fd6f83705415d04ef2 [0,1,0,1,0,0|2,0,0]=4 16293 B17R2.5223 CC1CC(C1)COCC(=O)c2ccccc2 ca1fae7867c78d692fddfbaec555dfdc [0,1,0,1,0,0|2,0,0]=4 16294 B17R2.5223 CC1CC(C1)OCOC(=O)c2ccccc2 d63b5acf8e600551daf8b09c316b8158 [0,1,0,1,0,0|1,0,0]=3 16295 B17R2.5223 CN1CC(C1)CCNC(=O)c2ccccc2 0e1382488cbe88bd6be6c58c1050c1db [0,1,0,1,0,0|2,0,0]=4 16296 B17R2.5223 CN1CC(C1)NCOC(=O)c2ccccc2 10da171388c9f4d0a148f7a74e8feff7 [0,1,0,1,0,0|2,0,0]=4 16297 B17R2.5223 CN1CC(C1)OCOC(=O)c2ccccc2 0fdc713a756e5d7e43323181ee807bf5 [0,1,0,1,0,0|2,0,0]=4 16298 B17R2.5223 C[C@H]1C[C@@H](C1)COCC(=O)c2ccccc2 707a2bb42ebe3211d744c5c236ca9338 [0,1,0,1,0,0|2,0,0]=4 16299 B17R2.5223 O=C(CNCC1CC(C1)O)c2ccccc2 c08016cdafb9d18e90f42e7317f0eb3a [0,1,0,1,0,0|2,0,0]=4 16300 B17R2.5223 O=C(CNC[C@H]1C[C@@H](C1)O)c2ccccc2 3ba23f0acba3db580d7eb345b4433302 [0,1,0,1,0,0|2,0,0]=4 16301 B17R2.5223 O=C(CNC[C@H]1C[C@H](C1)F)c2ccccc2 06f677adfd2fad31b8022bbd9b232425 [0,1,0,1,0,0|2,0,0]=4 16302 B17R2.5223 O=C(CNC[C@H]1C[C@H](C1)O)c2ccccc2 7dae9a40734e6e631dababd82a67a4d0 [0,1,0,1,0,0|2,0,0]=4 16303 B17R2.5223 O=C(COCC1CC(C1)F)c2ccccc2 5f43f7e79dd53389b029038ea27c000d [0,1,0,1,0,0|2,0,0]=4 16304 B17R2.5223 O=C(COC[C@H]1C[C@H](C1)F)c2ccccc2 a39cc23842500869d5d30579e5f3fddb [0,1,0,1,0,0|2,0,0]=4 16305 B17R2.5223 O=C(NCCN1CC(C1)F)c2ccccc2 e6bd16f88d6e8c6053423cdb541cf451 [0,1,0,1,0,0|2,0,0]=4 16306 B17R2.5223 O=C(NCCN1CC(C1)O)c2ccccc2 04f6d23907151274fc9cf557bb1e4475 [0,1,0,1,0,0|2,0,0]=4 16307 B17R2.5223 O=C(OCCN1CC(C1)F)c2ccccc2 9374dfafca72192b1af36e583b31e697 [0,1,0,1,0,0|1,0,0]=3 16308 B17R2.5223 O=C(OCCN1CC(C1)O)c2ccccc2 8b542f7e8947f1894e0e5d832708a736 [0,1,0,1,0,0|1,0,0]=3 16309 B17R2.5223 O=C(OCNC1CC(C1)F)c2ccccc2 700bcf4e4afc29020c54d4f8f65a87f5 [0,1,0,1,0,0|1,0,0]=3 16310 B17R2.5223 O=C(OCNC1CC(C1)O)c2ccccc2 b0dffdc954e8443ebb32890e4e06072b [0,1,0,1,0,0|1,0,0]=3 16311 B17R2.5223 O=C(OCN[C@H]1C[C@@H](C1)F)c2ccccc2 04b6a06d3ecb940f18c1815aa076b688 [0,1,0,1,0,0|1,0,0]=3 16312 B17R2.5223 O=C(OCN[C@H]1C[C@@H](C1)O)c2ccccc2 60bcc99f7d6e32c961b596f958c753ab [0,1,0,1,0,0|1,0,0]=3 16313 B17R2.5223 O=C(OCN[C@H]1C[C@H](C1)F)c2ccccc2 a7af9c1f272f57ffdc4b0d0f9f03d642 [0,1,0,1,0,0|1,0,0]=3 16314 B17R2.5223 O=C(OCN[C@H]1C[C@H](C1)O)c2ccccc2 80c1860719eb641130a1b03138eceff6 [0,1,0,1,0,0|1,0,0]=3 16315 B17R2.5223 O=C(OCOC1CC(C1)F)c2ccccc2 452d6a12402b89b1660187ee2177a31b [0,1,0,1,0,0|1,0,0]=3 16316 B17R2.5223 O=C(OCO[C@H]1C[C@@H](C1)F)c2ccccc2 89611b3ca83e6add81a18ede9a538f8c [0,1,0,1,0,0|1,0,0]=3 16317 B17R2.5223 O=C(OCO[C@H]1C[C@H](C1)F)c2ccccc2 b06cd0871a326a9416372a3d77557f0b [0,1,0,1,0,0|1,0,0]=3 16318 B17R2.5223 O=C1CC(C1)OCOC(=O)c2ccccc2 915bfe19e02ff81e4e8c38ff3e49e302 [0,1,0,1,0,0|1,0,1]=4 16319 B17R2.5697 CC(C)C1CCCN1C(=O)c2ccccc2 8d56567acaa5e8f5032892cf7d8f46d9 [0,1,0,1,0,0|1,0,0]=3 16320 B17R2.5697 CC(C)C1CCCN1C(=O)c2ccccn2 55e878801b1c733f42eba0a68aa4a920 [0,1,0,1,0,0|2,0,0]=4 16321 B17R2.5697 CC(C)C1CCCN1C(=O)c2cccnc2 adfc9b2e4ccba6ea48855f6c17762cf6 [0,1,0,1,0,0|2,0,0]=4 16322 B17R2.5697 CC(C)C1CCCN1C(=O)c2ccncc2 17c086c4a2322481158beea5c6cf7da5 [0,1,0,1,0,0|2,0,0]=4 16323 B17R2.5697 CC(C)[C@@H]1CCCN1C(=O)c2ccccc2 32d966e95f632e0cf22c9186b2f5c85e [0,1,0,1,0,0|1,0,0]=3 16324 B17R2.5697 CC(C)[C@@H]1CCCN1C(=O)c2ccccn2 44be2c3578b9a835c8f40abbb1bb98cb [0,1,0,1,0,0|2,0,0]=4 16325 B17R2.5697 CC(C)[C@@H]1CCCN1C(=O)c2cccnc2 bcb3bc515d152c6fed886b879e86dad7 [0,1,0,1,0,0|2,0,0]=4 16326 B17R2.5697 CC(C)[C@@H]1CCCN1C(=O)c2ccncc2 a47cda0afecd6f0ba7a62672b6a07537 [0,1,0,1,0,0|2,0,0]=4 16327 B17R2.5697 CC(O)C1CCCN1C(=O)c2ccccc2 1d11b93020d67fa3fb46d13c13537550 [0,1,0,1,0,0|1,0,0]=3 16328 B17R2.5697 CC(O)C1CCCN1C(=O)c2ccccn2 53e89c9d460389e4ecb6052f760518ac [0,1,0,1,0,0|2,0,0]=4 16329 B17R2.5697 CC(O)C1CCCN1C(=O)c2cccnc2 d41c3de798c3fb389df3ae495b75f30b [0,1,0,1,0,0|2,0,0]=4 16330 B17R2.5697 CC(O)C1CCCN1C(=O)c2ccncc2 8f40d9138f5f8a2d936cfb8cde10d4cd [0,1,0,1,0,0|2,0,0]=4 16331 B17R2.5697 CC(O)[C@H]1CCCN1C(=O)c2ccccc2 a5bc581bed03b5c4aeebb3448963971e [0,1,0,1,0,0|1,0,0]=3 16332 B17R2.5697 CC(O)[C@H]1CCCN1C(=O)c2ccccn2 feb14c40e4b37e03e72f456d08ca284c [0,1,0,1,0,0|2,0,0]=4 16333 B17R2.5697 CC(O)[C@H]1CCCN1C(=O)c2cccnc2 cd1bdb8e58743ff3475184c62057ef89 [0,1,0,1,0,0|2,0,0]=4 16334 B17R2.5697 CC(O)[C@H]1CCCN1C(=O)c2ccncc2 43e99384923d96a80f0c8c8b09411cc8 [0,1,0,1,0,0|2,0,0]=4 16335 B17R2.5697 C[C@H](O)[C@@H]1CCCN1C(=O)c2ccccc2 ab2e2f04c6328b72c0fff7df0e7d447b [0,1,0,1,0,0|1,0,0]=3 16336 B17R2.5697 C[C@H](O)[C@@H]1CCCN1C(=O)c2ccccn2 0dc6c9e035c3740794b149a83d16f2ed [0,1,0,1,0,0|2,0,0]=4 16337 B17R2.5697 C[C@H](O)[C@@H]1CCCN1C(=O)c2cccnc2 a44c06565fa45be213a4ea7ded834cd0 [0,1,0,1,0,0|2,0,0]=4 16338 B17R2.5697 C[C@H](O)[C@@H]1CCCN1C(=O)c2ccncc2 500479361c8a60dce647dd5e6d070277 [0,1,0,1,0,0|2,0,0]=4 16339 B17R2.5697 O=C(c1ccccc1)N2CCCC2C(F)F 8083ad104f3ace9f702354b5304b43c4 [0,1,0,1,0,0|2,0,0]=4 16340 B17R2.5697 O=C(c1ccccc1)N2CCC[C@@H]2C(F)F 49635968f33de5798cedd99d2a287ee9 [0,1,0,1,0,0|2,0,0]=4 16341 B17R2.5697 O=C(c1ccccc1)N2CCC[C@H]2C(F)F 9790e2d3daf8ffbe1cd672be40d4e1ef [0,1,0,1,0,0|2,0,0]=4 16342 B17R2.5730 CC1(CCCC1NC(=O)c2ccccc2)C 09302bd7a90d09f8f3fc6345a71099ca [0,1,0,1,0,0|1,0,0]=3 16343 B17R2.5730 CC1(CCCC1NC(=O)c2ccccc2)O 28deb7bf2eacbcb7233d8a11a8e5ae95 [0,1,0,1,0,0|1,0,0]=3 16344 B17R2.5730 CC1(CCCC1NC(=O)c2ccccn2)C 06386b31c10126bac40669a15cc62275 [0,1,0,1,0,0|2,0,0]=4 16345 B17R2.5730 CC1(CCCC1NC(=O)c2ccccn2)O d15bdcfbdd91bf5de287ed72ac37c70e [0,1,0,1,0,0|2,0,0]=4 16346 B17R2.5730 CC1(CCCC1NC(=O)c2cccnc2)C 07501db59ab15f2f3897a949772d847c [0,1,0,1,0,0|2,0,0]=4 16347 B17R2.5730 CC1(CCCC1NC(=O)c2cccnc2)O 4ea4a832365718bfca6e06aec2f6018c [0,1,0,1,0,0|2,0,0]=4 16348 B17R2.5730 CC1(CCCC1NC(=O)c2ccncc2)C 74a79cd2436edbc7e25a622cfeaec91b [0,1,0,1,0,0|2,0,0]=4 16349 B17R2.5730 CC1(CCCC1NC(=O)c2ccncc2)O 3e2ac53781b012c11352ab49a19b6f80 [0,1,0,1,0,0|2,0,0]=4 16350 B17R2.5730 CC1(CCCN1CC(=O)c2ccccc2)C 6765c01b9194b8f28d692a9e6eb3e19a [0,1,0,1,0,0|2,0,0]=4 16351 B17R2.5730 CC1(OCCC1NC(=O)c2ccccc2)C 76d05b83117ea82709ce69ff77b2b4e8 [0,1,0,1,0,0|2,0,0]=4 16352 B17R2.5730 C[C@@]1(CCC[C@@H]1NC(=O)c2ccccc2)O 93687d90a3867ff007685dbdc2947353 [0,1,0,1,0,0|1,0,0]=3 16353 B17R2.5730 C[C@@]1(CCC[C@@H]1NC(=O)c2ccccn2)O fe164a9b1ffae486a408cd4b74840200 [0,1,0,1,0,0|2,0,0]=4 16354 B17R2.5730 C[C@@]1(CCC[C@@H]1NC(=O)c2cccnc2)O a926e4565daaf7784c724a6e315f8b61 [0,1,0,1,0,0|2,0,0]=4 16355 B17R2.5730 C[C@@]1(CCC[C@@H]1NC(=O)c2ccncc2)O 09d3f8cbd04d6ca46f470489157c0c2f [0,1,0,1,0,0|2,0,0]=4 16356 B17R2.5730 C[C@]1(CCC[C@H]1NC(=O)c2ccccc2)O 9fb0bb7be5593673eb32b4dee5419c92 [0,1,0,1,0,0|1,0,0]=3 16357 B17R2.5730 C[C@]1(CCC[C@H]1NC(=O)c2ccccn2)O c63140b32701c52f05c642229ea3542c [0,1,0,1,0,0|2,0,0]=4 16358 B17R2.5730 C[C@]1(CCC[C@H]1NC(=O)c2cccnc2)O 1d4f042bee8a1b8dcdd7daa71f3a9543 [0,1,0,1,0,0|2,0,0]=4 16359 B17R2.5730 C[C@]1(CCC[C@H]1NC(=O)c2ccncc2)O c0b9a0c4dd6b5fcae4d751cb09f33ca6 [0,1,0,1,0,0|2,0,0]=4 16360 B17R2.5730 O=C(NC1CCCC1(F)F)c2ccccc2 b9720e2f7eb0cd7555b87d953b9b08b3 [0,1,0,1,0,0|2,0,0]=4 16361 B17R2.10202 CC1(CCCCN1C(=O)c2ccccc2)C 4ed347e33530c52c4dd603bbd9a63a18 [0,1,0,1,0,0|1,0,0]=3 16362 B17R2.10202 CC1(CCCCN1C(=O)c2ccccn2)C 2f76afce554aa6ebd4bef957bc5da9b0 [0,1,0,1,0,0|2,0,0]=4 16363 B17R2.10202 CC1(CCCCN1C(=O)c2cccnc2)C e6288137663b9ae0f5334ceaa8d5816e [0,1,0,1,0,0|2,0,0]=4 16364 B17R2.10202 CC1(CCCCN1C(=O)c2ccncc2)C 7b4fc813e1760844e38f409c2896d507 [0,1,0,1,0,0|2,0,0]=4 16365 B17R2.10202 CC1(COCCN1C(=O)c2ccccc2)C 7522bb2e3304f526f08eb916682227cc [0,1,0,1,0,0|2,0,0]=4 16366 B17R2.19949 CC1CN(CCCO1)C(=O)c2ccccc2 df12b694b33e04be5f38c7370b57ddcb [0,1,0,1,0,0|2,0,0]=4 16367 B17R2.19949 O=C(c1ccccc1)N2CCCCC(C2)O 8778a2cdb65de7711df41cee7873ad13 [0,1,0,1,0,0|1,0,0]=3 16368 B17R2.19949 O=C(c1ccccc1)N2CCCC[C@H](C2)O cc9b80e591697b89a89e2c37bc273334 [0,1,0,1,0,0|1,0,0]=3 16369 B17R2.19949 O=C(c1ccccc1)N2CCOCC(C2)F 3fe4d0a817892c96dbe64eb046b91eb6 [0,1,0,1,0,0|2,0,0]=4 16370 B17R2.19949 O=C(c1ccccc1)N2CCOCC(C2)O fca447009bf8607dc397ebf9c554a0e8 [0,1,0,1,0,0|2,0,0]=4 16371 B17R2.19949 O=C(c1ccccc1)N2CCOC[C@@H](C2)F 721b42c9def7f30360ab26ba6a259371 [0,1,0,1,0,0|2,0,0]=4 16372 B17R2.19949 O=C(c1ccccc1)N2CCOC[C@@H](C2)O ab95158855e26398a529ebdad004127d [0,1,0,1,0,0|2,0,0]=4 16373 B17R2.19949 O=C(c1ccccc1)N2CCOC[C@H](C2)F 84d86ea7715056ad60149fc164a38123 [0,1,0,1,0,0|2,0,0]=4 16374 B17R2.19949 O=C(c1ccccc1)N2CCOC[C@H](C2)O 6a29549a4f7432a28521f2abcb5e01d1 [0,1,0,1,0,0|2,0,0]=4 16375 B17R2.19949 O=C(c1ccccn1)N2CCCCC(C2)O 3eb7e12d2169148fa226dc15fa9f588f [0,1,0,1,0,0|2,0,0]=4 16376 B17R2.19949 O=C(c1ccccn1)N2CCCC[C@H](C2)O 702cb40403f2b9861ae15a1721f3b444 [0,1,0,1,0,0|2,0,0]=4 16377 B17R2.19949 O=C(c1cccnc1)N2CCCCC(C2)O 18bac20b3d7b9d9698777051b2746f4f [0,1,0,1,0,0|2,0,0]=4 16378 B17R2.19949 O=C(c1cccnc1)N2CCCC[C@H](C2)O c6a09fc947a1a2c9eaa1ffa999a32dda [0,1,0,1,0,0|2,0,0]=4 16379 B17R2.19949 O=C(c1ccncc1)N2CCCCC(C2)O f7e522b09c66af89299ef8e30965bbb9 [0,1,0,1,0,0|2,0,0]=4 16380 B17R2.19949 O=C(c1ccncc1)N2CCCC[C@H](C2)O c551889989157d8a30d95f0c910d2ec7 [0,1,0,1,0,0|2,0,0]=4 16381 B17R2.39629 CC(C)CCN1CCC(=O)c2c1cccc2 363cfe5dceb9cfa34734ef85ce470852 [0,1,0,1,0,0|2,0,0]=4 16382 B17R2.39629 CC(C)COC1CCC(=O)c2c1cccc2 301ef0a23c73639927d8c9a74d557438 [0,1,0,1,0,0|2,0,0]=4 16383 B17R2.39629 CC(O)CCN1CCC(=O)c2c1cccc2 e0f671f45bb7c7a7cc50cd14510bd2fd [0,1,0,1,0,0|2,0,0]=4 16384 B17R2.45185 CC(C)C1OCC1NC(=O)c2ccccc2 4d9d20b76ebcd22c3606955190266640 [0,1,0,1,0,0|2,0,0]=4 16385 B17R2.45185 CC(C)[C@H]1OC[C@H]1NC(=O)c2ccccc2 3ff26228db375fa5e0efe6ac17999e45 [0,1,0,1,0,0|2,0,0]=4 16386 B17R2.45554 CC1(CCC1OCC(=O)c2ccccc2)C b59a45ff99eb7f049e0fd02bb8967252 [0,1,0,1,0,0|2,0,0]=4 16387 B17R2.45554 CC1(COC1CNC(=O)c2ccccc2)C 8df554488a32a9f9dccd6ba40b7147f3 [0,1,0,1,0,0|2,0,0]=4 16388 B17R2.45569 CC1(CC1COCC(=O)c2ccccc2)C aa425ec9dd6c2cae78c4a4802b8d5a7e [0,1,0,1,0,0|2,0,0]=4 16389 B17R2.45569 CC1(CC1NCOC(=O)c2ccccc2)C e7a7401069063b86d9644da3b7518186 [0,1,0,1,0,0|1,0,0]=3 16390 B17R2.45569 CC1(CC1OCCC(=O)c2ccccc2)C bad879aa75d5a32808bac12824f92517 [0,1,0,1,0,0|2,0,0]=4 16391 B17R2.45569 CC1(CC1OCNC(=O)c2ccccc2)C 9e7aed8268b3795640e64463d1732ff4 [0,1,0,1,0,0|2,0,0]=4 16392 B17R2.45569 CC1(CN1CCNC(=O)c2ccccc2)C 501d6158e3a27c2744729f4f4857eecf [0,1,0,1,0,0|2,0,0]=4 16393 B17R2.45569 CC1(CN1CCOC(=O)c2ccccc2)C 2f1061b800a3f914b17706c62182ec39 [0,1,0,1,0,0|1,0,0]=3 16394 B17R2.45569 CC1(C[C@@H]1CNCC(=O)c2ccccc2)C d3cfa2d6940c964658318d1d44710941 [0,1,0,1,0,0|2,0,0]=4 16395 B17R2.45569 CC1(C[C@@H]1COCC(=O)c2ccccc2)C 9e54a27b925e90a0aeb41b808ea453e3 [0,1,0,1,0,0|2,0,0]=4 16396 B17R2.45569 CC1(C[C@@H]1NCOC(=O)c2ccccc2)C b3e23cac4e459412948da24fad7f9b10 [0,1,0,1,0,0|1,0,0]=3 16397 B17R2.45569 CC1(C[C@H]1CNCC(=O)c2ccccc2)C 5218bd54ff83123d8572cf32cb17e710 [0,1,0,1,0,0|2,0,0]=4 16398 B17R2.45569 CC1(C[C@H]1COCC(=O)c2ccccc2)C dcba0250ef3773d111e0d4f2b900fdb9 [0,1,0,1,0,0|2,0,0]=4 16399 B17R2.45569 CC1(C[C@H]1NCOC(=O)c2ccccc2)C 77badaf55fb22036d211c550e1019cbc [0,1,0,1,0,0|1,0,0]=3 16400 B17R2.45569 O=C(OCNC1CC1(F)F)c2ccccc2 e1d5a066d8cc93e78bc135772c1116f0 [0,1,0,1,0,0|2,0,0]=4 16401 B17R2.45569 O=C(OCOC1CC1(F)F)c2ccccc2 4871c15e9651f8f9d2377e14f3296622 [0,1,0,1,0,0|2,0,0]=4 16402 B17R2.78537 C=C(C)CCOC1OC(=O)c2c1cccc2 0e5a591cb555ed2dde352cb275683b67 [0,1,0,1,0,0|1,0,1]=4 16403 B17R2.78537 CC(=O)CCOC1OC(=O)c2c1cccc2 3b06c39df0c2eada919283e56dc61d8d [0,1,0,1,0,0|1,0,1]=4 16404 B17R2.78537 CC(C)CCNC1CC(=O)c2c1cccc2 b1d5ef95be4d3dc8ca366fca2619d5bb [0,1,0,1,0,0|2,0,0]=4 16405 B17R2.78537 CC(C)CCNC1NC(=O)c2c1cccc2 4e341a1f2c08c3d588087456d1d82daa [0,1,0,1,0,0|2,0,0]=4 16406 B17R2.78537 CC(C)CCOC1CC(=O)c2c1cccc2 f8efe2b17d3e1b97f6c51f877989650b [0,1,0,1,0,0|2,0,0]=4 16407 B17R2.78537 CC(C)CCOC1OC(=O)c2c1cccc2 475bd7a2be69c8f30efe436ac9be005d [0,1,0,1,0,0|1,0,0]=3 16408 B17R2.78537 CC(C)CCOC1OC(=O)c2c1cncc2 b03ca35002b2968f7eec2268f2df1fc0 [0,1,0,1,0,0|2,0,0]=4 16409 B17R2.78537 CC(C)OCOC1OC(=O)c2c1cccc2 9a9a0de8b1d680ce64cbae44382e1845 [0,1,0,1,0,0|2,0,0]=4 16410 B17R2.78537 CC(O)CCNC1CC(=O)c2c1cccc2 f5a3fd53ea4c7d02e4f699028f60957d [0,1,0,1,0,0|2,0,0]=4 16411 B17R2.78537 CC(O)CCNC1NC(=O)c2c1cccc2 a3c70e41126098829522ebc9405368c8 [0,1,0,1,0,0|2,0,0]=4 16412 B17R2.78537 CC(O)CCNC1OC(=O)c2c1cccc2 731422596430d050cbd7d551778f3b74 [0,1,0,1,0,0|1,0,0]=3 16413 B17R2.78537 CN(C)CCOC1OC(=O)c2c1cccc2 a4f1d1c91cf88869a6bdcaf7b55725c4 [0,1,0,1,0,0|2,0,0]=4 16414 B17R2.78537 CS(=O)CCNC1OC(=O)c2c1cccc2 c0fba18d6b20d12c5d35dff612fcc29a [0,1,0,1,0,0|2,0,0]=4 16415 B17R2.78537 CS(=O)CCOC1OC(=O)c2c1cccc2 c0bed1b7e9c5cfc34c2e35a5ac3ebaa7 [0,1,0,1,0,0|2,0,0]=4 16416 B17R2.78537 C[C@@H](O)CCNC1CC(=O)c2c1cccc2 ba6a7cb069fd25c5a1a2b1037cc5aa65 [0,1,0,1,0,0|2,0,0]=4 16417 B17R2.78537 C[C@@H](O)CCNC1OC(=O)c2c1cccc2 98676f7491b266b1f64d847df892373c [0,1,0,1,0,0|1,0,0]=3 16418 B17R2.78537 C[C@H](O)CCNC1CC(=O)c2c1cccc2 43c0fd8cc2422fbb6c02ed078a1aa0fa [0,1,0,1,0,0|2,0,0]=4 16419 B17R2.78537 C[C@H](O)CCNC1OC(=O)c2c1cccc2 e77de79c929816f1a0838a9c28b4cc6a [0,1,0,1,0,0|1,0,0]=3 16420 B17R2.278127 CC(C)CN1CCCC(=O)c2c1cccc2 5ffdcf39ae5c6156cb90088f6bf400dd [0,1,0,1,0,0|2,0,0]=4 16421 B17R2.278127 CC(C)CN1CCNC(=O)c2c1cccc2 7edd483f916145630e9721f79e7035c1 [0,1,0,1,0,0|2,0,0]=4 16422 B17R2.278127 CC(O)CN1CCCC(=O)c2c1cccc2 fb0c7715c5eb8ca11367baa980d95dba [0,1,0,1,0,0|2,0,0]=4 16423 B17R2.278127 CC(O)CN1CCNC(=O)c2c1cccc2 45bcd5406508cd1491ca5b1a00d28c6b [0,1,0,1,0,0|2,0,0]=4 16424 B17R2.278127 C[C@@H](O)CN1CCNC(=O)c2c1cccc2 97dd77a8c3afe56c6492ca13ecdeb79f [0,1,0,1,0,0|2,0,0]=4 16425 B17R2.278127 C[C@H](O)CN1CCCC(=O)c2c1cccc2 77ca3a3fb011c3a0a0673cc5569bcac6 [0,1,0,1,0,0|2,0,0]=4 16426 B17R2.278127 C[C@H](O)CN1CCNC(=O)c2c1cccc2 dd405e19e995199562db01f09d738f59 [0,1,0,1,0,0|2,0,0]=4 16427 B17R2.290613 CC(C)CCCCOC1Cc2c1cccc2 fe54b09f7dec2ccffecd355d7c33af3a [0,1,0,1,0,0|1,0,1]=4 16428 B17R2.3 CCCCCCNc1c[nH]c2c1cccc2 42cc5895d5b7e76589ab99d405e46837 [0,1,0,1,0,0|2,0,0]=4 16429 B17R2.3 CCCCCCNc1coc2c1cccc2 0b498e0abb8e0d3c8707f1a7aeeba743 [0,1,0,1,0,0|1,0,1]=4 16430 B17R2.3 CCCCCCNc1csc2c1cccc2 5c2be24ce255d57f3580376efcf03be2 [0,1,0,1,0,0|1,1,0]=4 16431 B17R2.3 CCCCCCNc1n[nH]c2c1cccc2 c568fc228001a44493d913037f3cb9b2 [0,1,0,1,0,0|2,0,0]=4 16432 B17R2.3 CCCCCCNc1noc2c1cccc2 4368082dc42a4bda449249472b28f631 [0,1,0,1,0,0|1,0,1]=4 16433 B17R2.3 CCCCCCNc1nsc2c1cccc2 12d4ae5153988fa6646bf36485096f2a [0,1,0,1,0,0|1,1,0]=4 16434 B17R2.3 CCCCCCNc1snc2c1cccc2 615111a41eb1b7682c88209fc8cc6495 [0,1,0,1,0,0|1,1,0]=4 16435 B17R2.3 CCCCCCOC1CCc2c1cccc2 4900dba22130dda139ae1c33f6599c31 [0,1,0,1,0,0|1,0,1]=4 16436 B17R2.3 CCCCCCOC1COc2c1cccc2 53433f051377f53eb8adbab6e9e7fd53 [0,1,0,1,0,0|0,0,2]=4 16437 B17R2.3 CCCCCCO[C@@H]1CCc2c1cccc2 e6bd931ced4ad63c78e1b4e0673efadc [0,1,0,1,0,0|1,0,1]=4 16438 B17R2.3 CCCCCCO[C@H]1CCc2c1cccc2 3dce72dbff1ca8f476ca710e25214922 [0,1,0,1,0,0|1,0,1]=4 16439 B17R2.3 CCCCCCOc1c[nH]c2c1cccc2 1462f4bc153ec41f9ac06afed14ee157 [0,1,0,1,0,0|1,0,0]=3 16440 B17R2.3 CCCCCCOc1coc2c1cccc2 93a76f304540f761726b9fe0c3aee240 [0,1,0,1,0,0|0,0,1]=3 16441 B17R2.3 CCCCCCOc1csc2c1cccc2 d8a8273726a3f0ce6c01aa3d7a2f9110 [0,1,0,1,0,0|0,1,0]=3 16442 B17R2.3 CCCCCCOc1n[nH]c2c1cncc2 4be2d7f4f038a9f6e877385e42f0ca03 [0,1,0,1,0,0|2,0,0]=4 16443 B17R2.3 CCCCCCOc1noc2c1cccc2 b30b217291890c7ecc0d9afbb2fe9e50 [0,1,0,1,0,0|0,0,1]=3 16444 B17R2.3 CCCCCCOc1noc2c1cccn2 e9d03416b927961ecc0e2b14efd4a194 [0,1,0,1,0,0|1,0,1]=4 16445 B17R2.3 CCCCCCOc1noc2c1ccnc2 75a7cfd08138f454800035bf9392d6f4 [0,1,0,1,0,0|1,0,1]=4 16446 B17R2.3 CCCCCCOc1nsc2c1cccn2 2b5fd6bc12cd2fca3f05b0811e0dae23 [0,1,0,1,0,0|1,1,0]=4 16447 B17R2.3 CCCCCCOn1ncc2c1cccc2 a9be32d3dc98c592cc91da1755d2df0e [0,1,0,1,0,0|2,0,0]=4 16448 B17R2.3 CCCCOCOc1c[nH]c2c1cccc2 54b86e3487e2b78010340d2db3121604 [0,1,0,1,0,0|2,0,0]=4 16449 B17R2.3 CCCCOCOc1coc2c1cccc2 add177ff99bfc0ed52b5eb538c25adb8 [0,1,0,1,0,0|1,0,1]=4 16450 B17R2.3 CCCCOCOc1csc2c1cccc2 efded6671980ef3054528049de4b74c2 [0,1,0,1,0,0|1,1,0]=4 16451 B17R2.3 CCCCOCOc1noc2c1cccc2 b0475393a0f317fe00136573e648ae88 [0,1,0,1,0,0|1,0,1]=4 16452 B17R2.3 CCCOCCOc1c[nH]c2c1cccc2 1b86fbe4d1bf56f862f9029c2ac35fdb [0,1,0,1,0,0|2,0,0]=4 16453 B17R2.3 CCCOCCOc1coc2c1cccc2 32acd396918e396870d727bc574fb623 [0,1,0,1,0,0|1,0,1]=4 16454 B17R2.3 CCCOCCOc1csc2c1cccc2 9048d52888071ec680ed16f3b5f6f3f2 [0,1,0,1,0,0|1,1,0]=4 16455 B17R2.3 CCCOCCOc1noc2c1cccc2 b3893f8e6015e3631a8c9143570ea69c [0,1,0,1,0,0|1,0,1]=4 16456 B17R2.3 CCOCCCOc1c[nH]c2c1cccc2 b755a1c963844508edbba5a204f0d314 [0,1,0,1,0,0|2,0,0]=4 16457 B17R2.3 CCOCCCOc1coc2c1cccc2 adb538b03d0b5bc2916816937ca1c3ef [0,1,0,1,0,0|1,0,1]=4 16458 B17R2.3 CCOCCCOc1csc2c1cccc2 6b452d83ae48387d71d985a5a291aea6 [0,1,0,1,0,0|1,1,0]=4 16459 B17R2.3 CCOCCCOc1noc2c1cccc2 893c1635c4358f2d763ccf3b73d60fb5 [0,1,0,1,0,0|1,0,1]=4 16460 B17R2.3 CCSCCCOc1c[nH]c2c1cccc2 a00535fca82b255d5e5ae17263cfc61d [0,1,0,1,0,0|2,0,0]=4 16461 B17R2.3 CCSCCCOc1coc2c1cccc2 a5ca86b1c8dc2be32e74540003cce691 [0,1,0,1,0,0|1,0,1]=4 16462 B17R2.3 CCSCCCOc1csc2c1cccc2 0cb9d3d87a3b89cb6577651b0e5c42c1 [0,1,0,1,0,0|1,1,0]=4 16463 B17R2.3 CCSCCCOc1noc2c1cccc2 e9305a522169d987e6de31e9bd43568f [0,1,0,1,0,0|1,0,1]=4 16464 B17R2.3 COCCCCOc1c[nH]c2c1cccc2 50f2d6ddc55dfd2fd59afada976e0ec4 [0,1,0,1,0,0|2,0,0]=4 16465 B17R2.3 COCCCCOc1coc2c1cccc2 50dd5d040c7ae42e12e3fc68bce0f9f0 [0,1,0,1,0,0|1,0,1]=4 16466 B17R2.3 COCCCCOc1csc2c1cccc2 64002d63c625a69700e092db828f3819 [0,1,0,1,0,0|1,1,0]=4 16467 B17R2.3 COCCCCOc1noc2c1cccc2 55e23f003bd3353d9bb8a1ce342b4d2f [0,1,0,1,0,0|1,0,1]=4 16468 B17R2.3 FCCCCCOc1c[nH]c2c1cccc2 0ddf6db6ab9c2c0d53414038dc5e81cc [0,1,0,1,0,0|2,0,0]=4 16469 B17R2.3 FCCCCCOc1coc2c1cccc2 e3f0eef0e8a8bf16793acdad3263efc9 [0,1,0,1,0,0|1,0,1]=4 16470 B17R2.3 FCCCCCOc1csc2c1cccc2 f9223616c66f6eea058382d19d71a308 [0,1,0,1,0,0|1,1,0]=4 16471 B17R2.3 FCCCCCOc1noc2c1cccc2 4b048a04757f35ff45d69e65d41bbdb9 [0,1,0,1,0,0|1,0,1]=4 16472 B17R2.162 C#CC(OC1CCCCC1)c2ccccc2 a5f1eddda8fc5a00ec877213bc373998 [0,1,0,1,0,0|1,0,1]=4 16473 B17R2.162 C#C[C@@H](OC1CCCCC1)c2ccccc2 819054678b406f0731fd2a8c64974757 [0,1,0,1,0,0|1,0,1]=4 16474 B17R2.162 C#C[C@H](OC1CCCCC1)c2ccccc2 0164f6f1aab816ed2ada4d385fbe635f [0,1,0,1,0,0|1,0,1]=4 16475 B17R2.162 C=CC(OC1CCCCC1)c2ccccc2 f3db2fb87f05a6afab0696dcb1c0846d [0,1,0,1,0,0|1,0,1]=4 16476 B17R2.162 CCC(OC1CCCCC1)c2ccccc2 8cd4c23701f50acba887d5e41455f33f [0,1,0,1,0,0|1,0,1]=4 16477 B17R2.162 O=CC(OC1CCCCC1)c2ccccc2 01783127ce78b52047dc6eacec80cbe7 [0,1,0,1,0,0|0,0,1]=3 16478 B17R2.162 O=CC(OC1CCCCO1)c2ccccc2 11054caf5bae97b73b7e1a5dba612412 [0,1,0,1,0,0|1,0,1]=4 16479 B17R2.162 O=CC(OC1CCCOC1)c2ccccc2 cf39fc277d6fa3f6ae03c73e65321045 [0,1,0,1,0,0|1,0,1]=4 16480 B17R2.162 O=CC(OC1CCCSC1)c2ccccc2 314cef2f7d134989ddb08e34803501d4 [0,1,0,1,0,0|1,0,1]=4 16481 B17R2.162 O=CC(OC1CCOCC1)c2ccccc2 21b19009a0c9298867509d759bfc92b2 [0,1,0,1,0,0|1,0,1]=4 16482 B17R2.162 O=CC(OC1CCSCC1)c2ccccc2 23c4f0f8b51b24a26337d425df5e47e5 [0,1,0,1,0,0|1,0,1]=4 16483 B17R2.162 O=CC(O[C@@H]1CCCOC1)c2ccccc2 9b2b6ff48e5d471d181b4840c40c83c4 [0,1,0,1,0,0|1,0,1]=4 16484 B17R2.162 O=CC(O[C@H]1CCCOC1)c2ccccc2 04d001383336426cbc937d46a8e02e07 [0,1,0,1,0,0|1,0,1]=4 16485 B17R2.2270 C=CC(OCCCC1CC1)c2ccccc2 78be6909fb98733fbb60a7d984f50eec [0,1,0,1,0,0|1,0,1]=4 16486 B17R2.2270 CCC(OCCCC1CC1)c2ccccc2 71d1a1bbc45dd41fce20b766fc80728b [0,1,0,1,0,0|1,0,1]=4 16487 B17R2.2270 O=C/C(=C\OCCC1CC1)/c2ccccc2 2ccb932fb7aac2a7f3abc5229dba7fe8 [0,1,0,1,0,0|2,0,0]=4 16488 B17R2.2274 CC1CCCCN1C(C=O)c2ccccc2 c6a1dcc0075f177537d9b29fe1b49a49 [0,1,0,1,0,0|1,0,1]=4 16489 B17R2.2274 C[C@@H]1CCCCN1C(C=O)c2ccccc2 2cc44b9f9e7452315725251a08a9737e [0,1,0,1,0,0|1,0,1]=4 16490 B17R2.2274 C[C@H]1CCCCN1C(C=O)c2ccccc2 a3ac46dcad8a91d6d1be7b810181e550 [0,1,0,1,0,0|1,0,1]=4 16491 B17R2.2289 C#CC(OCCC1CCC1)c2ccccc2 6673c45399556c64b0c0c130b9ff3579 [0,1,0,1,0,0|1,0,1]=4 16492 B17R2.2289 C#C[C@@H](OCCC1CCC1)c2ccccc2 da75905ab94f37334e3a6d6886e29922 [0,1,0,1,0,0|1,0,1]=4 16493 B17R2.2289 C#C[C@H](OCCC1CCC1)c2ccccc2 3b03982ecfb26e24db472db10015d73f [0,1,0,1,0,0|1,0,1]=4 16494 B17R2.2289 C=CC(OCCC1CCC1)c2ccccc2 9c95d1bf40f02b496b38b5a495de7d62 [0,1,0,1,0,0|1,0,1]=4 16495 B17R2.2289 CCC(OCCC1CCC1)c2ccccc2 b41592955612832e9eeb3c674a7d37fb [0,1,0,1,0,0|1,0,1]=4 16496 B17R2.2289 CC[C@@H](OCCC1CCC1)c2ccccc2 22897865358432fc87ef29c9b22f1bee [0,1,0,1,0,0|1,0,1]=4 16497 B17R2.2289 CC[C@H](OCCC1CCC1)c2ccccc2 565aa8494306807460958d69f23b5803 [0,1,0,1,0,0|1,0,1]=4 16498 B17R2.2289 FCC(OCCC1CCC1)c2ccccc2 158dd22e6b60d183c80f0de71225e7ec [0,1,0,1,0,0|1,0,1]=4 16499 B17R2.2289 FC[C@@H](OCCC1CCC1)c2ccccc2 a61f1429b7e81a1952afabe1b8d3db6e [0,1,0,1,0,0|1,0,1]=4 16500 B17R2.2289 N#CC(OCCC1CCC1)c2ccccc2 b3db1ba246d950b62f8a0df49b772988 [0,1,0,1,0,0|1,0,1]=4 16501 B17R2.2289 N#C[C@H](OCCC1CCC1)c2ccccc2 a3a472e8c6b4208daa31aef583b29518 [0,1,0,1,0,0|1,0,1]=4 16502 B17R2.2289 O=C/C(=C\OCC1CCC1)/c2ccccc2 4fea3785b958e3ebc9b2a9cd4f38f537 [0,1,0,1,0,0|2,0,0]=4 16503 B17R2.2289 O=CC(NCCC1CCC1)c2ccccc2 4075478d7879e70fde0a2b89cdd0eac9 [0,1,0,1,0,0|1,0,1]=4 16504 B17R2.2289 O=CC(OCCC1CCO1)c2ccccc2 7c9779cd070de588c9f964b2cfea9dd0 [0,1,0,1,0,0|1,0,1]=4 16505 B17R2.2289 O=CC(OCCC1COC1)c2ccccc2 b366efcf4abec7d18b1b64d9baace3c9 [0,1,0,1,0,0|1,0,1]=4 16506 B17R2.2289 O=CC(OCC[C@@H]1CCO1)c2ccccc2 58c7db0ff88cb4c2b4c4ffcf88cf3fd9 [0,1,0,1,0,0|1,0,1]=4 16507 B17R2.2289 O=CC(OCC[C@H]1CCO1)c2ccccc2 6a7a3e8e2810f9aa5fd9bc50e44afc21 [0,1,0,1,0,0|1,0,1]=4 16508 B17R2.6057 C=CC(OC1CCCC1C)c2ccccc2 7af52706a2ab98272b02abfc507c71c9 [0,1,0,1,0,0|1,0,1]=4 16509 B17R2.6057 C=CC(O[C@@H]1CCC[C@@H]1C)c2ccccc2 7b66a3e02071ca568de42027076ec951 [0,1,0,1,0,0|1,0,1]=4 16510 B17R2.6057 C=CC(O[C@@H]1CCC[C@H]1C)c2ccccc2 33f042c4893a1c9f33ee6855da6fa6c4 [0,1,0,1,0,0|1,0,1]=4 16511 B17R2.6057 C=CC(O[C@H]1CCC[C@@H]1C)c2ccccc2 479fd59379d0435a2e504628c91f6307 [0,1,0,1,0,0|1,0,1]=4 16512 B17R2.6057 C=CC(O[C@H]1CCC[C@H]1C)c2ccccc2 ab9073ba84363e6a6eb9214365de1798 [0,1,0,1,0,0|1,0,1]=4 16513 B17R2.6057 CC1CCCC1OC(C=O)c2ccccc2 4226219a9ecc8868d7400b0ca471f978 [0,1,0,1,0,0|0,0,1]=3 16514 B17R2.6057 CC1COCC1OC(C=O)c2ccccc2 15eba9f2887e3b348949b79e50830eab [0,1,0,1,0,0|1,0,1]=4 16515 B17R2.6057 CCC(OC1CCCC1C)c2ccccc2 bc6f01efdc316dec04d66e089d5ea47a [0,1,0,1,0,0|1,0,1]=4 16516 B17R2.6057 CCC(O[C@@H]1CCC[C@@H]1C)c2ccccc2 eee09e0ca81036e8d2b62579db84e591 [0,1,0,1,0,0|1,0,1]=4 16517 B17R2.6057 CCC(O[C@@H]1CCC[C@H]1C)c2ccccc2 f09cd1d83c2049530e132d1aba20179c [0,1,0,1,0,0|1,0,1]=4 16518 B17R2.6057 CCC(O[C@H]1CCC[C@@H]1C)c2ccccc2 ed40b21aad1af6dceac881cc30753756 [0,1,0,1,0,0|1,0,1]=4 16519 B17R2.6057 CCC(O[C@H]1CCC[C@H]1C)c2ccccc2 5d865f60217179c62e3dc66e45ba7199 [0,1,0,1,0,0|1,0,1]=4 16520 B17R2.6057 C[C@@H]1CCC[C@@H]1OC(C=O)c2ccccc2 43a7157177f8d37f014514ca8485485b [0,1,0,1,0,0|0,0,1]=3 16521 B17R2.6057 C[C@@H]1CCC[C@H]1OC(C=O)c2ccccc2 8dc8283095f57ac4d084aedbed2ad2cf [0,1,0,1,0,0|0,0,1]=3 16522 B17R2.6057 C[C@@H]1COC[C@@H]1OC(C=O)c2ccccc2 44a2bc3141fc1cbd2d37effc7df4dfe9 [0,1,0,1,0,0|1,0,1]=4 16523 B17R2.6057 C[C@H]1CCC[C@@H]1OC(C=O)c2ccccc2 ed273ea3cf99c9100d261c0507a9180f [0,1,0,1,0,0|0,0,1]=3 16524 B17R2.6057 C[C@H]1CCC[C@H]1OC(C=O)c2ccccc2 88e6dbe22790897f4c1e4f913bef69a8 [0,1,0,1,0,0|0,0,1]=3 16525 B17R2.6057 C[C@H]1COC[C@@H]1OC(C=O)c2ccccc2 62684d9b4751439f4b4046abd083e99c [0,1,0,1,0,0|1,0,1]=4 16526 B17R2.6057 C[C@H]1COC[C@H]1OC(C=O)c2ccccc2 ad66072531b537ef4a1648ea931f1226 [0,1,0,1,0,0|1,0,1]=4 16527 B17R2.6057 O=CC(O[C@@H]1CCC[C@H]1F)c2ccccc2 4690dab0c25416d37c7542abf1d7ffb9 [0,1,0,1,0,0|1,0,1]=4 16528 B17R2.10180 O=CC(c1ccccc1)N2CCCCCC2 fc64368c6d9f07fff31f26fc3d885d11 [0,1,0,1,0,0|1,0,1]=4 16529 B17R2.13557 CCC1CCCN1C(C=O)c2ccccc2 44d2a0e54452669be074a5a1f64a5ab8 [0,1,0,1,0,0|1,0,1]=4 16530 B17R2.13557 CC[C@@H]1CCCN1C(C=O)c2ccccc2 8f47c9a79dc6b8bc3734b09f8391d530 [0,1,0,1,0,0|1,0,1]=4 16531 B17R2.17880 C#CC(OCC1CCCC1)c2ccccc2 40b8b1eb94bbd460db179dc9fe0c5b64 [0,1,0,1,0,0|1,0,1]=4 16532 B17R2.17880 C#C[C@@H](OCC1CCCC1)c2ccccc2 b310afcc345db2814e16d042ddeea475 [0,1,0,1,0,0|1,0,1]=4 16533 B17R2.17880 C#C[C@H](OCC1CCCC1)c2ccccc2 48f1e419c96c1cd0344f6aec6c8d3204 [0,1,0,1,0,0|1,0,1]=4 16534 B17R2.17880 C=CC(OCC1CCCC1)c2ccccc2 5d1d323161f0bd25ba21b489a395d2c5 [0,1,0,1,0,0|1,0,1]=4 16535 B17R2.17880 CCC(OCC1CCCC1)c2ccccc2 dd80dc25dae3840212f58bce37cca4b7 [0,1,0,1,0,0|1,0,1]=4 16536 B17R2.17880 CC[C@@H](OCC1CCCC1)c2ccccc2 e0d85536e9e8710b6ea2956ebc6b5bbf [0,1,0,1,0,0|1,0,1]=4 16537 B17R2.17880 CC[C@H](OCC1CCCC1)c2ccccc2 40755b30b7bf8a30d058b2dcbb868bd4 [0,1,0,1,0,0|1,0,1]=4 16538 B17R2.17880 FCC(OCC1CCCC1)c2ccccc2 000d0361d61b2fed2fe9ac94afcca21d [0,1,0,1,0,0|1,0,1]=4 16539 B17R2.17880 FC[C@@H](OCC1CCCC1)c2ccccc2 e57616e432a46fc47b705a58ecb1b96d [0,1,0,1,0,0|1,0,1]=4 16540 B17R2.17880 N#CC(OCC1CCCC1)c2ccccc2 3491e328e2a1390d0bca7be3937e3797 [0,1,0,1,0,0|1,0,1]=4 16541 B17R2.17880 N#C[C@H](OCC1CCCC1)c2ccccc2 cc88304a633606b0f46fec90159cb57f [0,1,0,1,0,0|1,0,1]=4 16542 B17R2.17880 O=C/C(=C\OC1CCCC1)/c2ccccc2 b474e41ec0304a6a99ac8206127baec6 [0,1,0,1,0,0|2,0,0]=4 16543 B17R2.17880 O=CC(NCC1CCCC1)c2ccccc2 66f5f7b68b64367e91ca2b712895bbc8 [0,1,0,1,0,0|1,0,1]=4 16544 B17R2.17880 SCC(OCC1CCCC1)c2ccccc2 bb1bd34a2426dd408a2ed77f7269d484 [0,1,0,1,0,0|0,1,1]=4 16545 B17R2.1689 CCC1CN(C1)COC(=O)c2ccccc2 a3d2961e059a66d59105ec98e04caa43 [0,1,0,1,0,0|1,0,0]=3 16546 B17R2.1689 CCN1CC(C1)CNC(=O)c2ccccc2 958a7b0b18beeec4190b763a5778d467 [0,1,0,1,0,0|2,0,0]=4 16547 B17R2.1689 COC1CC(C1)CNC(=O)c2ccccc2 f9220135a7688cec2903dc9143a529e7 [0,1,0,1,0,0|2,0,0]=4 16548 B17R2.1689 COC1CN(C1)COC(=O)c2ccccc2 c7472cdc44db33f118e5db405c01dfc7 [0,1,0,1,0,0|2,0,0]=4 16549 B17R2.1689 CSC1CN(C1)COC(=O)c2ccccc2 317e0df336218e1c7cb3b46bbfe5e0d9 [0,1,0,1,0,0|2,0,0]=4 16550 B17R2.1689 O=C(OCN1CC(C1)CF)c2ccccc2 38fd7730209dcb8b7a469cd184d1ebb0 [0,1,0,1,0,0|2,0,0]=4 16551 B17R2.1689 O=C(OCN1CC(C1)CO)c2ccccc2 fb75748fedc50fc4c9764ecb613280e2 [0,1,0,1,0,0|2,0,0]=4 16552 B17R2.2594 O=C(c1ccccc1)N2CC(CC2CO)O 96d9c36f20e8a5c606c4c29b99cd60b8 [0,1,0,1,0,0|2,0,0]=4 16553 B17R2.5356 CC1CCC(CN1C(=O)c2ccccc2)O d4565219db4fef6d6522bbb6f597d6a2 [0,1,0,1,0,0|1,0,0]=3 16554 B17R2.5356 CC1CCC(CN1C(=O)c2ccccn2)O b6c0116e2b730a7b37fbe992702096d7 [0,1,0,1,0,0|2,0,0]=4 16555 B17R2.5356 CC1CCC(CN1C(=O)c2cccnc2)O c98e0118c117a0652cd646cf4f2971a5 [0,1,0,1,0,0|2,0,0]=4 16556 B17R2.5356 CC1CCC(CN1C(=O)c2ccncc2)O be947518ba2eb078cd203cf8038ee559 [0,1,0,1,0,0|2,0,0]=4 16557 B17R2.5356 CC1CN(C(CO1)C)C(=O)c2ccccc2 63b708824f2855c1c873b0b43af4290a [0,1,0,1,0,0|2,0,0]=4 16558 B17R2.5356 C[C@@H]1CC[C@H](CN1C(=O)c2ccccc2)O 567db62a1f48d60e90a0a52326596347 [0,1,0,1,0,0|1,0,0]=3 16559 B17R2.5356 C[C@@H]1CC[C@H](CN1C(=O)c2ccccn2)O d43854792bd3815b7d9de89634bac392 [0,1,0,1,0,0|2,0,0]=4 16560 B17R2.5356 C[C@@H]1CC[C@H](CN1C(=O)c2cccnc2)O 467e410069f1dfaec8c65b2995bf6f4b [0,1,0,1,0,0|2,0,0]=4 16561 B17R2.5356 C[C@@H]1CC[C@H](CN1C(=O)c2ccncc2)O bf398212933085edf8eff0fb50260ca0 [0,1,0,1,0,0|2,0,0]=4 16562 B17R2.5356 C[C@@H]1CN([C@@H](CO1)C)C(=O)c2ccccc2 d557f999bcbd5898a80368725fcc5e87 [0,1,0,1,0,0|2,0,0]=4 16563 B17R2.5356 C[C@@H]1CN([C@H](CO1)C)C(=O)c2ccccc2 3ffa31bd800e06f7025ee39f84e950a0 [0,1,0,1,0,0|2,0,0]=4 16564 B17R2.5356 C[C@@H]1CO[C@H](CN1C(=O)c2ccccc2)C 276dfe9cd4a8b072860369eab495de81 [0,1,0,1,0,0|2,0,0]=4 16565 B17R2.5356 C[C@H]1CN([C@H](CO1)C)C(=O)c2ccccc2 4d72de02858b6be994d2f4cc815506d7 [0,1,0,1,0,0|2,0,0]=4 16566 B17R2.6560 CCCCN1CC(C1)C(=O)c2ccccc2 662be1d1e216ed75c4babf263f470fc2 [0,1,0,1,0,0|2,0,0]=4 16567 B17R2.6560 CCCNC1CN(C1)C(=O)c2ccccc2 156e8fe0bd2a680c23e316ee20eef50e [0,1,0,1,0,0|2,0,0]=4 16568 B17R2.6560 CCCOC1CN(C1)C(=O)c2ccccc2 b462e5f6936ecc83187b1819001dd68b [0,1,0,1,0,0|2,0,0]=4 16569 B17R2.6560 COCCC1CN(C1)C(=O)c2ccccc2 e056f4f11848a12c07658f05c9e3e056 [0,1,0,1,0,0|2,0,0]=4 16570 B17R2.8659 CC1CCC(N1CC(=O)c2ccccc2)C 326793daad897ba8e4c16b42ab4150dc [0,1,0,1,0,0|2,0,0]=4 16571 B17R2.8659 C[C@@H]1CC[C@@H](N1CC(=O)c2ccccc2)C 808bd23b0121dcb3819fa4ee0b1cc44e [0,1,0,1,0,0|2,0,0]=4 16572 B17R2.8659 C[C@@H]1CC[C@H](N1CC(=O)c2ccccc2)C f3dca946a903d820e99ba27f141a7923 [0,1,0,1,0,0|2,0,0]=4 16573 B17R2.8659 C[C@H]1CC[C@@H](N1CC(=O)c2ccccc2)C 25acd02d6ada9a09a4c2df6b2c2437cf [0,1,0,1,0,0|2,0,0]=4 16574 B17R2.45541 CC(OCC(=O)c1ccccc1)C2CCC2 36b348204b00b9adf45612a1dbe5c570 [0,1,0,1,0,0|2,0,0]=4 16575 B17R2.45541 CN(COC(=O)c1ccccc1)C2CCC2 3713f32865e3d7bdf159717f22a5b467 [0,1,0,1,0,0|1,0,0]=3 16576 B17R2.45541 CN(COC(=O)c1ccccc1)C2COC2 c754f50a075d90316c54c437017830e0 [0,1,0,1,0,0|2,0,0]=4 16577 B17R2.45541 C[C@H](OCC(=O)c1ccccc1)C2CCC2 ecfe9a35bfae4b886fe1cf75f89e7e02 [0,1,0,1,0,0|2,0,0]=4 16578 B17R2.159317 CCCNC(=O)C1OC(=O)c2c1cccc2 3044df9d1b2a6a54461d2afcc8e8b48c [0,1,0,1,0,0|1,0,1]=4 16579 B17R2.294939 CC(CC1CC1)OCC(=O)c2ccccc2 b8e83f0393991aed99ed9faa7ffd01c2 [0,1,0,1,0,0|2,0,0]=4 16580 B17R2.294939 CC(CNC(=O)c1ccccc1)OC2CC2 6bc8930650737c5ebb6de83fdb0456d5 [0,1,0,1,0,0|2,0,0]=4 16581 B17R2.294939 CN(COC(=O)c1ccccc1)CC2CC2 a9c7a50d7ce45f1a2f36bfb3e0b85d54 [0,1,0,1,0,0|1,0,0]=3 16582 B17R2.295596 CC(OCC1(CCCC1)C)c2ccccc2 77866e3c27b41ee11a92b2ffb0cf9114 [0,1,0,1,0,0|1,0,1]=4 16583 B17R2.295596 CC1(CCCC1)CNC(=O)c2ccccc2 8c94cfb1eaff436b821df34038a67e11 [0,1,0,1,0,0|1,0,0]=3 16584 B17R2.295596 CC1(CCCC1)CNC(=O)c2ccccn2 b5c2a82c5415419ba43aca92acb0a7f7 [0,1,0,1,0,0|2,0,0]=4 16585 B17R2.295596 CC1(CCCC1)CNC(=O)c2cccnc2 3c900a4cc4ca69a379e99f382bfc047f [0,1,0,1,0,0|2,0,0]=4 16586 B17R2.295596 CC1(CCCC1)CNC(=O)c2ccncc2 1401e5e6f007ce819bcc911a22e07b18 [0,1,0,1,0,0|2,0,0]=4 16587 B17R2.295596 CC1(CCCC1)NCC(=O)c2ccccc2 6dbec9690aff07c623a34449341c436a [0,1,0,1,0,0|2,0,0]=4 16588 B17R2.295596 CC1(CCCO1)CNC(=O)c2ccccc2 8aec916974a30c373574ee6d348218a1 [0,1,0,1,0,0|2,0,0]=4 16589 B17R2.295596 CC1(CCOC1)CNC(=O)c2ccccc2 dcad667e3df1b8bce61b814092497b8d [0,1,0,1,0,0|2,0,0]=4 16590 B17R2.295596 C[C@@H](OCC1(CCCC1)C)c2ccccc2 ffadd23bc58400f9df9b79d1e753e27d [0,1,0,1,0,0|1,0,1]=4 16591 B17R2.295596 C[C@H](OCC1(CCCC1)C)c2ccccc2 d901b4bf85ec3b781967020be12c513f [0,1,0,1,0,0|1,0,1]=4 16592 B17R2.295596 O=C(NCC1(CCCC1)F)c2ccccc2 6f287b59f95d9a99d21ad49fb7ab7735 [0,1,0,1,0,0|1,0,0]=3 16593 B17R2.295596 O=C(NCC1(CCCC1)F)c2ccccn2 9dd4a8ee0a416194f475ded1a143d88d [0,1,0,1,0,0|2,0,0]=4 16594 B17R2.295596 O=C(NCC1(CCCC1)F)c2cccnc2 d580f9a69771b66912a35a449efee3e2 [0,1,0,1,0,0|2,0,0]=4 16595 B17R2.295596 O=C(NCC1(CCCC1)F)c2ccncc2 df510dda3d3fc954dd2d3085adf041d4 [0,1,0,1,0,0|2,0,0]=4 16596 B17R2.295596 O=C(NCC1(CCCC1)O)c2ccccc2 790c7024d4ef0fd81bb77675989a53c4 [0,1,0,1,0,0|1,0,0]=3 16597 B17R2.295596 O=C(NCC1(CCCC1)O)c2ccccn2 7f11b0a7b1d21c7479681b48fce41cd1 [0,1,0,1,0,0|2,0,0]=4 16598 B17R2.295596 O=C(NCC1(CCCC1)O)c2cccnc2 ded6febe0cef7ab8f79deea6a5f57d83 [0,1,0,1,0,0|2,0,0]=4 16599 B17R2.295596 O=C(NCC1(CCCC1)O)c2ccncc2 c9b63f1e470f5ee5df2264f72ac1d5e4 [0,1,0,1,0,0|2,0,0]=4 16600 B17R2.295596 O=C(NCC1(CCOC1)O)c2ccccc2 652ae47d510e1595c2561741ef249d1d [0,1,0,1,0,0|2,0,0]=4 16601 B17R2.1797 CCC1CCCN(C1)C(=O)c2ccccc2 3a7eb5e40b1104bed7b3463a2e04de52 [0,1,0,1,0,0|1,0,0]=3 16602 B17R2.1797 CCC1CCCN(C1)C(=O)c2ccccn2 20728e5c9bb9bcf36d2ca3fae04acaaa [0,1,0,1,0,0|2,0,0]=4 16603 B17R2.1797 CCC1CCCN(C1)C(=O)c2cccnc2 5c34967869539572137e9067b7249eef [0,1,0,1,0,0|2,0,0]=4 16604 B17R2.1797 CCC1CCCN(C1)C(=O)c2ccncc2 ead281f39a758293487e5715b2b3d8a9 [0,1,0,1,0,0|2,0,0]=4 16605 B17R2.1797 CCC1CN(CCO1)C(=O)c2ccccc2 799d0c1ccd574ed1fbdb128a3e27577f [0,1,0,1,0,0|2,0,0]=4 16606 B17R2.1797 CC[C@@H]1CN(CCO1)C(=O)c2ccccc2 fde8650eae69af87235b1fe2ddbd7939 [0,1,0,1,0,0|2,0,0]=4 16607 B17R2.1797 CC[C@H]1CN(CCO1)C(=O)c2ccccc2 e6b2cfa5c38c23fbf3695daaff512765 [0,1,0,1,0,0|2,0,0]=4 16608 B17R2.1797 COC1CCCN(C1)C(=O)c2ccccc2 b2c63eab387fd0fb2ce2425eec3c0dd3 [0,1,0,1,0,0|2,0,0]=4 16609 B17R2.1797 CO[C@@H]1CCCN(C1)C(=O)c2ccccc2 f2783a6abc241ce108445f533174746e [0,1,0,1,0,0|2,0,0]=4 16610 B17R2.1797 CO[C@H]1CCCN(C1)C(=O)c2ccccc2 107c2eda8b04fc3678194cf040593591 [0,1,0,1,0,0|2,0,0]=4 16611 B17R2.1797 O=C(c1ccccc1)N2CCCC(C2)CO 5faabda399016bd90826e712af6d8d40 [0,1,0,1,0,0|2,0,0]=4 16612 B17R2.1797 O=C(c1ccccc1)N2CCC[C@@H](C2)CO d69a30acd568ed245eadfa5b73c6eb72 [0,1,0,1,0,0|2,0,0]=4 16613 B17R2.1797 O=C(c1ccccc1)N2CCC[C@H](C2)CO 238893ed5cdc60a21bd5be47a4ccc95a [0,1,0,1,0,0|2,0,0]=4 16614 B17R2.1882 CCC1CCN1C(=O)C(=O)c2ccccc2 0c7806deb178f55f1a0fbe3a769b4966 [0,1,0,1,0,0|2,0,0]=4 16615 B17R2.3299 CCCCCNC1Cc2ccccc2C1=O c11207c17c40ac91cc81d280c8cca478 [0,1,0,1,0,0|2,0,0]=4 16616 B17R2.3299 CCCNCCN1Cc2ccccc2C1=O 7e6bc784fadb68881fe033aa94c45288 [0,1,0,1,0,0|2,0,0]=4 16617 B17R2.3299 CCCOCCN1Cc2ccccc2C1=O 3b39ab0efaac3f1cdffd4bdbc17154d5 [0,1,0,1,0,0|2,0,0]=4 16618 B17R2.3299 CCNCCCN1Cc2ccccc2C1=O 6ea1b0c918afc3ed5c64997cd1878216 [0,1,0,1,0,0|2,0,0]=4 16619 B17R2.3517 CC1CCCN1C(=O)C(=O)c2ccccc2 1bf4e006eac2c5773175609d34a7ad8a [0,1,0,1,0,0|2,0,0]=4 16620 B17R2.3517 CN(C(=O)c1ccccc1)[C@@H]2CCC[C@@H]2O 82225301e5abdd7b2a1e8aea7e785298 [0,1,0,1,0,0|2,0,0]=4 16621 B17R2.3517 CN(C(=O)c1ccccc1)[C@@H]2CCC[C@H]2O 40f67233fd433ad01bf2b16b561b08cc [0,1,0,1,0,0|2,0,0]=4 16622 B17R2.3517 CN(C(=O)c1ccccc1)[C@H]2CCC[C@H]2O 30cd72475a90aecd62e2809e834aae4f [0,1,0,1,0,0|2,0,0]=4 16623 B17R2.3517 C[C@@H]1CCCN1C(=O)C(=O)c2ccccc2 5eddae091e6ab1a719c4c84a683e6802 [0,1,0,1,0,0|2,0,0]=4 16624 B17R2.3517 C[C@H]1CCCN1C(=O)C(=O)c2ccccc2 10ba7c8fce26a7f4bd02874fedac60df [0,1,0,1,0,0|2,0,0]=4 16625 B17R2.4553 CCCC1CCN(C1)C(=O)c2ccccc2 6b3e11717ed4ae4aa9e6252526262fd5 [0,1,0,1,0,0|1,0,0]=3 16626 B17R2.4553 CCCC1CCN(C1)C(=O)c2ccccn2 98d783efe9a314398a80cb35de915139 [0,1,0,1,0,0|2,0,0]=4 16627 B17R2.4553 CCCC1CCN(C1)C(=O)c2cccnc2 93d9411b69c8c1ca90bdd2363031e508 [0,1,0,1,0,0|2,0,0]=4 16628 B17R2.4553 CCCC1CCN(C1)C(=O)c2ccncc2 07e045df48970116d84605579bb1bede [0,1,0,1,0,0|2,0,0]=4 16629 B17R2.4553 CCCN1CCC(C1)C(=O)c2ccccc2 d68e7d667b6f76212841ec069ad1fa53 [0,1,0,1,0,0|2,0,0]=4 16630 B17R2.4553 CCNC1CCN(C1)C(=O)c2ccccc2 cc8a87840c726aac72fd613ecb9dc943 [0,1,0,1,0,0|2,0,0]=4 16631 B17R2.4553 CCO[C@@H]1CCN(C1)C(=O)c2ccccc2 807c7babb45dd8f297fcab25d0430b20 [0,1,0,1,0,0|2,0,0]=4 16632 B17R2.4553 CCO[C@H]1CCN(C1)C(=O)c2ccccc2 ff63d63cbf82a1291196f1f8aa47c4d5 [0,1,0,1,0,0|2,0,0]=4 16633 B17R2.4553 COCC1CCN(C1)C(=O)c2ccccc2 36bc20561819ca8725b31cf62801d715 [0,1,0,1,0,0|2,0,0]=4 16634 B17R2.4553 COC[C@@H]1CCN(C1)C(=O)c2ccccc2 d0337da18461b9a0e3354f79e655066e [0,1,0,1,0,0|2,0,0]=4 16635 B17R2.4553 COC[C@H]1CCN(C1)C(=O)c2ccccc2 02c840e4f4c0836658675f2fc3ebe700 [0,1,0,1,0,0|2,0,0]=4 16636 B17R2.4553 O=C(c1ccccc1)N2CCC(C2)CCO 6c66320423f74efbcdd6c68581d4309b [0,1,0,1,0,0|2,0,0]=4 16637 B17R2.4888 C[C@@H]1CC[C@@H]1NC(=O)C(=O)c2ccccc2 baf5c5b992bd7f39d74311d4c81d7627 [0,1,0,1,0,0|2,0,0]=4 16638 B17R2.4888 C[C@@H]1CC[C@H]1NC(=O)C(=O)c2ccccc2 4b65c4d438132cffdbd3adc9dd08b037 [0,1,0,1,0,0|2,0,0]=4 16639 B17R2.5724 CN(CC1CCCC1)C(=O)c2ccccc2 162a16f87db7fdbe95e1580649dbcdb7 [0,1,0,1,0,0|1,0,0]=3 16640 B17R2.5724 CN(CC1CCCC1)C(=O)c2ccccn2 b38ba5015ed9e16f4346ad556da9cda3 [0,1,0,1,0,0|2,0,0]=4 16641 B17R2.5724 CN(CC1CCCC1)C(=O)c2cccnc2 e5b7d932ca5bbd3d11c0c9dac70dfe56 [0,1,0,1,0,0|2,0,0]=4 16642 B17R2.5724 CN(CC1CCCC1)C(=O)c2ccncc2 f7f75bd670302c501f8609c1bbce7de0 [0,1,0,1,0,0|2,0,0]=4 16643 B17R2.5724 CN(CC1CCCO1)C(=O)c2ccccc2 2bd1c2cf45318d9dac2f713f05f8f2f6 [0,1,0,1,0,0|2,0,0]=4 16644 B17R2.5724 CN(CC1CCOC1)C(=O)c2ccccc2 c7f38c9c7cc7af9d65421081c71fd01b [0,1,0,1,0,0|2,0,0]=4 16645 B17R2.5724 O=C(NC1CCCC1)C(=O)c2ccccc2 4ef95eaade247ceb5c91a8d745e8d306 [0,1,0,1,0,0|2,0,0]=4 16646 B17R2.10205 CN(C(=O)c1ccccc1)C2CCCCC2 a6df87723e0337da8e662be6531ced3b [0,1,0,1,0,0|1,0,0]=3 16647 B17R2.10205 CN(C(=O)c1ccccc1)C2CCCOC2 4b385c383cb95bb142fb2ef2aa72bb64 [0,1,0,1,0,0|2,0,0]=4 16648 B17R2.10205 CN(C(=O)c1ccccc1)C2CCOCC2 011f747012c544d2688da5733393736e [0,1,0,1,0,0|2,0,0]=4 16649 B17R2.10205 CN(C(=O)c1ccccc1)C2CCSCC2 04d09ca07d51055c4dfcfa649199201f [0,1,0,1,0,0|2,0,0]=4 16650 B17R2.10205 CN(C(=O)c1ccccn1)C2CCCCC2 d0ee7281e5c27161f17543ff5812f6b5 [0,1,0,1,0,0|2,0,0]=4 16651 B17R2.10205 CN(C(=O)c1cccnc1)C2CCCCC2 87b891baf32a650e65925ffc645b6b33 [0,1,0,1,0,0|2,0,0]=4 16652 B17R2.10205 CN(C(=O)c1ccncc1)C2CCCCC2 124dce370d0e04af748b33f8d79b4c9f [0,1,0,1,0,0|2,0,0]=4 16653 B17R2.45548 CN(CCC1CCC1)C(=O)c2ccccc2 37f226292692633c2f257f92ba9aef07 [0,1,0,1,0,0|1,0,0]=3 16654 B17R2.45548 CN(CCC1CCC1)C(=O)c2ccccn2 a7cf2dcbafb2074497f0e72ffd141b9b [0,1,0,1,0,0|2,0,0]=4 16655 B17R2.45548 CN(CCC1CCC1)C(=O)c2cccnc2 6253468c33585b0875b49861c66f6f4b [0,1,0,1,0,0|2,0,0]=4 16656 B17R2.45548 CN(CCC1CCC1)C(=O)c2ccncc2 3e83be7a4085e13ba9519679022c89f8 [0,1,0,1,0,0|2,0,0]=4 16657 B17R2.45548 CN(CCC1COC1)C(=O)c2ccccc2 eb13a23d626f7c615f8ba7d449496201 [0,1,0,1,0,0|2,0,0]=4 16658 B17R2.45548 O=C(NCC1CCC1)C(=O)c2ccccc2 fb7216a98ea731f1b920fbe5256fa729 [0,1,0,1,0,0|2,0,0]=4 16659 B17R2.45562 O=C(NCCC1CC1)C(=O)c2ccccc2 b27b2d4fe599bf9a7f1d5cf1a300d36a [0,1,0,1,0,0|2,0,0]=4 16660 B17R2.85802 CCCCOC1c2ccccc2C(=O)N1C 76a2d8824d81a7dd6482eb8752808c3b [0,1,0,1,0,0|2,0,0]=4 16661 B17R2.3346 C[C@@H]1C[C@@H](CN1CC(=O)c2ccccc2)O 46a67d69ba1e312628f26b9243c718e2 [0,1,0,1,0,0|2,0,0]=4 16662 B17R2.3346 C[C@@H]1C[C@H](CN1CC(=O)c2ccccc2)O ac817d05d233b0023cb68b84600e1b7a [0,1,0,1,0,0|2,0,0]=4 16663 B17R2.3346 C[C@H]1C[C@@H](CN1CC(=O)c2ccccc2)O 4b0907e1a29298ebe036873c3ecf1e38 [0,1,0,1,0,0|2,0,0]=4 16664 B17R2.3346 C[C@H]1C[C@H](CN1CC(=O)c2ccccc2)O 99d3ca1ce2d4cbb54292b68ac6051c72 [0,1,0,1,0,0|2,0,0]=4 16665 B17R2.4015 CC1CC(N1COC(=O)c2ccccc2)C 23ad8f1fdc3f5dc427e834abd63d4500 [0,1,0,1,0,0|1,0,0]=3 16666 B17R2.4015 C[C@@H]1C[C@@H](N1COC(=O)c2ccccc2)C 473c278cca535e02108ab8242fe41662 [0,1,0,1,0,0|1,0,0]=3 16667 B17R2.4015 C[C@@H]1C[C@H](N1COC(=O)c2ccccc2)C ae29a5112f25f5700468db102a87ce32 [0,1,0,1,0,0|1,0,0]=3 16668 B17R2.4015 C[C@H]1C[C@@H](N1COC(=O)c2ccccc2)C bdb66904fba75458f7abb97ecdb51717 [0,1,0,1,0,0|1,0,0]=3 16669 B17R2.5362 CC1CC(CCN1C(=O)c2ccccc2)O 537b29cd07d411875e5800ec04f147de [0,1,0,1,0,0|1,0,0]=3 16670 B17R2.5362 CC1CC(CCN1C(=O)c2ccccn2)O d125c701ce5b3b65c6d10cebbc0330e6 [0,1,0,1,0,0|2,0,0]=4 16671 B17R2.5362 CC1CC(CCN1C(=O)c2cccnc2)O 3459130da5213dc7138945ba1d30b7ac [0,1,0,1,0,0|2,0,0]=4 16672 B17R2.5362 CC1CC(CCN1C(=O)c2ccncc2)O 1086bbb9b8d7fbda7668b32d4c4da909 [0,1,0,1,0,0|2,0,0]=4 16673 B17R2.5362 CC1CCN(C(C1)C)C(=O)c2ccccc2 bed0e35c7fe4e1cefbaa40d9fa03cd90 [0,1,0,1,0,0|1,0,0]=3 16674 B17R2.5362 CC1CCN(C(C1)C)C(=O)c2ccccn2 a9552f2e4745917286b07ef2c2bc4f5a [0,1,0,1,0,0|2,0,0]=4 16675 B17R2.5362 CC1CCN(C(C1)C)C(=O)c2cccnc2 13d0dadabf7e220bd2a829fac61f0eac [0,1,0,1,0,0|2,0,0]=4 16676 B17R2.5362 CC1CCN(C(C1)C)C(=O)c2ccncc2 22eebd852cd672069aedf048133c92fe [0,1,0,1,0,0|2,0,0]=4 16677 B17R2.5362 CC1CN(CCN1C(=O)c2ccccc2)C 6c561c8ccb3499f4a1452c60ad5ad26a [0,1,0,1,0,0|2,0,0]=4 16678 B17R2.5362 C[C@@H]1CCN([C@@H](C1)C)C(=O)c2ccccc2 1268e0d50cbcae06dddd9a6be36af5db [0,1,0,1,0,0|1,0,0]=3 16679 B17R2.5362 C[C@@H]1CCN([C@@H](C1)C)C(=O)c2ccccn2 3ed7a84cbea24da6f0191de00c812a25 [0,1,0,1,0,0|2,0,0]=4 16680 B17R2.5362 C[C@@H]1CCN([C@@H](C1)C)C(=O)c2cccnc2 e66fdfd92e218b3a50a25a4be84cdb5e [0,1,0,1,0,0|2,0,0]=4 16681 B17R2.5362 C[C@@H]1CCN([C@@H](C1)C)C(=O)c2ccncc2 84c5f596b862468c4ca00e400cc27ad9 [0,1,0,1,0,0|2,0,0]=4 16682 B17R2.5362 C[C@@H]1CN(CCN1C(=O)c2ccccc2)C 8ae4853636b5c46fb4e812602af88afb [0,1,0,1,0,0|2,0,0]=4 16683 B17R2.5362 C[C@@H]1C[C@@H](CCN1C(=O)c2ccccc2)O b0b1dc6ef54f66a3eba67a229cd8b925 [0,1,0,1,0,0|1,0,0]=3 16684 B17R2.5362 C[C@@H]1C[C@@H](CCN1C(=O)c2ccccn2)O fbe06e94e1487646be447b964eb7462f [0,1,0,1,0,0|2,0,0]=4 16685 B17R2.5362 C[C@@H]1C[C@@H](CCN1C(=O)c2cccnc2)O eddf5ffb34f86cde0ac9aaf36b2efedc [0,1,0,1,0,0|2,0,0]=4 16686 B17R2.5362 C[C@@H]1C[C@@H](CCN1C(=O)c2ccncc2)O 0929eaa310514f6d499b62263edcd0df [0,1,0,1,0,0|2,0,0]=4 16687 B17R2.5362 C[C@@H]1C[C@H](CCN1C(=O)c2ccccc2)O a2b8144d29c0ee2b59b9b0d43d867198 [0,1,0,1,0,0|1,0,0]=3 16688 B17R2.5362 C[C@@H]1C[C@H](CCN1C(=O)c2ccccn2)O ee1b168bda7712a462423803d712d8f9 [0,1,0,1,0,0|2,0,0]=4 16689 B17R2.5362 C[C@@H]1C[C@H](CCN1C(=O)c2cccnc2)O bd69f1dd286131bc150d213e6c7ae180 [0,1,0,1,0,0|2,0,0]=4 16690 B17R2.5362 C[C@@H]1C[C@H](CCN1C(=O)c2ccncc2)O 44b31a6255806102b139fe013ca042d9 [0,1,0,1,0,0|2,0,0]=4 16691 B17R2.5362 C[C@H]1CCN([C@H](C1)C)C(=O)c2ccccc2 b5ac6cd086d3daa7623e8b2b8be76598 [0,1,0,1,0,0|1,0,0]=3 16692 B17R2.5362 C[C@H]1CCN([C@H](C1)C)C(=O)c2ccccn2 c22fa72a36aa31ac1a2c7cf4f656ebf2 [0,1,0,1,0,0|2,0,0]=4 16693 B17R2.5362 C[C@H]1CCN([C@H](C1)C)C(=O)c2cccnc2 ec04d3420101d8ed9675067717697a61 [0,1,0,1,0,0|2,0,0]=4 16694 B17R2.5362 C[C@H]1CCN([C@H](C1)C)C(=O)c2ccncc2 9b0a625d65ed1c3a835f359dc18e08c1 [0,1,0,1,0,0|2,0,0]=4 16695 B17R2.5362 C[C@H]1CN(CCN1C(=O)c2ccccc2)C 2c588ae357c04492546fcfbc72c51934 [0,1,0,1,0,0|2,0,0]=4 16696 B17R2.24146 CC1CCCN(CC1)C(=O)c2ccccc2 33eeb64c5739a9b80773dcd8723ad536 [0,1,0,1,0,0|1,0,0]=3 16697 B17R2.24146 CC1CCCN(CC1)C(=O)c2ccccn2 9db60c519647af6160af392e95378fc3 [0,1,0,1,0,0|2,0,0]=4 16698 B17R2.24146 CC1CCCN(CC1)C(=O)c2cccnc2 3aa97739d3c73c4e30a78a4acb802c14 [0,1,0,1,0,0|2,0,0]=4 16699 B17R2.24146 CC1CCCN(CC1)C(=O)c2ccncc2 7e7d9fab217ea71c81cfd3d37a95a5e9 [0,1,0,1,0,0|2,0,0]=4 16700 B17R2.24146 CN1CCCN(CC1)C(=O)c2ccccc2 a27f3f6a4e93f421b11932545fc81b91 [0,1,0,1,0,0|2,0,0]=4 16701 B17R2.24146 O=C(c1ccccc1)N2CCCC(CC2)F 2e24ebcab164c4aa4e9d5797bf8fc86d [0,1,0,1,0,0|1,0,0]=3 16702 B17R2.24146 O=C(c1ccccc1)N2CCCC(CC2)O 970b253db53ca35974dbfda8c5491846 [0,1,0,1,0,0|1,0,0]=3 16703 B17R2.24146 O=C(c1ccccc1)N2CCC[C@@H](CC2)O 7cfe97665de83cf7a2d7e86c3d52af0d [0,1,0,1,0,0|1,0,0]=3 16704 B17R2.24146 O=C(c1ccccc1)N2CCC[C@H](CC2)O 5c5f4b8037624670ccb9c3641522d048 [0,1,0,1,0,0|1,0,0]=3 16705 B17R2.24146 O=C(c1ccccn1)N2CCCC(CC2)F 61066ba09386db2131a0ad976392083d [0,1,0,1,0,0|2,0,0]=4 16706 B17R2.24146 O=C(c1ccccn1)N2CCCC(CC2)O 87cbba8e425d4abb65ffb9dae662065b [0,1,0,1,0,0|2,0,0]=4 16707 B17R2.24146 O=C(c1ccccn1)N2CCC[C@@H](CC2)O 7c85bfa91f460021ece32fb36b8a8d98 [0,1,0,1,0,0|2,0,0]=4 16708 B17R2.24146 O=C(c1ccccn1)N2CCC[C@H](CC2)O 8cc91cce1f942f376bcd9544eb2c7507 [0,1,0,1,0,0|2,0,0]=4 16709 B17R2.24146 O=C(c1cccnc1)N2CCCC(CC2)F aff6fd86bff23417dde3ff6085a766e3 [0,1,0,1,0,0|2,0,0]=4 16710 B17R2.24146 O=C(c1cccnc1)N2CCCC(CC2)O 2e73a464e5e0e471310f6c2239b32f03 [0,1,0,1,0,0|2,0,0]=4 16711 B17R2.24146 O=C(c1cccnc1)N2CCC[C@@H](CC2)O 1f377372614f7b2b6e07b0a93e678920 [0,1,0,1,0,0|2,0,0]=4 16712 B17R2.24146 O=C(c1cccnc1)N2CCC[C@H](CC2)O 72f7d85134c63fa0c5feb389835237a2 [0,1,0,1,0,0|2,0,0]=4 16713 B17R2.24146 O=C(c1ccncc1)N2CCCC(CC2)F fb7645061039aa4f15d7fe2434e9179d [0,1,0,1,0,0|2,0,0]=4 16714 B17R2.24146 O=C(c1ccncc1)N2CCCC(CC2)O 0109bd1d88b0dff6afe5deedc749e59e [0,1,0,1,0,0|2,0,0]=4 16715 B17R2.24146 O=C(c1ccncc1)N2CCC[C@@H](CC2)O 1da782b0c688196820fc0ab35b900729 [0,1,0,1,0,0|2,0,0]=4 16716 B17R2.24146 O=C(c1ccncc1)N2CCC[C@H](CC2)O 003a8d3c4a5355554489e8b98b29bd7e [0,1,0,1,0,0|2,0,0]=4 16717 B17R2.24146 O=C1CCCN(CC1)C(=O)c2ccccc2 0e7349a9dd9b50a0598c369f3facfad8 [0,1,0,1,0,0|1,0,1]=4 16718 B17R2.49523 CCCC(=S)OC1OC(=O)c2c1cccc2 39c4d5b6a2ca53ac1c962112ba9a4347 [0,1,0,1,0,0|1,0,1]=4 16719 B17R2.49523 CCCC(C)NC1CC(=O)c2c1cccc2 dcd86e5d065efc94528b1f5adcabced9 [0,1,0,1,0,0|2,0,0]=4 16720 B17R2.49523 CCCC(C)NC1NC(=O)c2c1cccc2 029e759a7aead6c3c227f1d442006ed5 [0,1,0,1,0,0|2,0,0]=4 16721 B17R2.49523 CCCC(C)OC1CC(=O)c2c1cccc2 7cfe2192ea76b4ae5367c676b0a00d82 [0,1,0,1,0,0|2,0,0]=4 16722 B17R2.49523 CCCC(C)OC1OC(=O)c2c1cccc2 542f619bb74a6b19f347d381a2618d30 [0,1,0,1,0,0|1,0,0]=3 16723 B17R2.49523 CCCC(C)OC1OC(=O)c2c1cncc2 44dc0bc2f0ed88aa6e6d3753edebbd87 [0,1,0,1,0,0|2,0,0]=4 16724 B17R2.49523 CCC[C@H](C)NC1CC(=O)c2c1cccc2 8cba5f7264ce1df4bb4059120c770f31 [0,1,0,1,0,0|2,0,0]=4 16725 B17R2.49523 COCC(C)OC1OC(=O)c2c1cccc2 b649d4af8d47a2bbe93de70cfea6ddd1 [0,1,0,1,0,0|2,0,0]=4 16726 B17R2.295060 CC1(CCC1)CNCC(=O)c2ccccc2 edfd877173ec77c9c32f6a57266b77ef [0,1,0,1,0,0|2,0,0]=4 16727 B17R2.295060 CC1(CCC1)COCC(=O)c2ccccc2 e67b8a4c40dbf98395182dc08833fe13 [0,1,0,1,0,0|2,0,0]=4 16728 B17R2.295060 CC1(CCC1)NCCC(=O)c2ccccc2 de6c49f4e59272b0b081e894693b1bcf [0,1,0,1,0,0|2,0,0]=4 16729 B17R2.295060 CC1(CCC1)NCOC(=O)c2ccccc2 fba9d7c00178495a46df8d0354701b1e [0,1,0,1,0,0|1,0,0]=3 16730 B17R2.295060 CC1(COC1)NCOC(=O)c2ccccc2 80125b06b65c8f7618c97af095b93525 [0,1,0,1,0,0|2,0,0]=4 16731 B17R2.295060 CC1(CSC1)NCOC(=O)c2ccccc2 6aa3896b69ef8efd999e5e0d1bdfe8c1 [0,1,0,1,0,0|2,0,0]=4 16732 B17R2.295060 O=C(CNCC1(CCC1)O)c2ccccc2 00a2c39510c542a9f5d1a4f8388fcb5d [0,1,0,1,0,0|2,0,0]=4 16733 B17R2.295060 O=C(COCC1(CCC1)F)c2ccccc2 65f55e3acf40f173bc5d4c7dcdcf867a [0,1,0,1,0,0|2,0,0]=4 16734 B17R2.295060 O=C(NCCC1(CCC1)O)c2ccccc2 b79c9fa640c4fb85aac375fea416c83d [0,1,0,1,0,0|1,0,0]=3 16735 B17R2.295060 O=C(NCCC1(CCC1)O)c2ccccn2 c2c48f96a492d8d50fa8310a2fc6f73b [0,1,0,1,0,0|2,0,0]=4 16736 B17R2.295060 O=C(NCCC1(CCC1)O)c2cccnc2 80fe98694319effd6010d5e8c3068161 [0,1,0,1,0,0|2,0,0]=4 16737 B17R2.295060 O=C(NCCC1(CCC1)O)c2ccncc2 ff1cc9841e41d43b354c18115e727f0d [0,1,0,1,0,0|2,0,0]=4 16738 B17R2.295060 O=C(NCCC1(COC1)O)c2ccccc2 9b1e96a51590aaa34f8c2303b2b17ea5 [0,1,0,1,0,0|2,0,0]=4 16739 B17R2.295162 CC(COCC(=O)c1ccccc1)C2CC2 fb8c36de4d89294e4aa2052924ecb810 [0,1,0,1,0,0|2,0,0]=4 16740 B17R2.295162 CC(OCCC(=O)c1ccccc1)C2CC2 b0ee0acba6b80c3b5bffbaa9631efb88 [0,1,0,1,0,0|2,0,0]=4 16741 B17R2.295162 CC(OCNC(=O)c1ccccc1)C2CC2 816ab559aa25707aeba9197d62a29e7e [0,1,0,1,0,0|2,0,0]=4 16742 B17R2.295162 CC(OCOC(=O)c1ccccc1)C2CC2 950c53f850e17b8152571d6618c810fb [0,1,0,1,0,0|1,0,0]=3 16743 B17R2.295162 CN(CCOC(=O)c1ccccc1)C2CC2 58d681bc3b9db42b7b1e27ddf587f598 [0,1,0,1,0,0|1,0,0]=3 16744 B17R2.295162 C[C@@H](NCOC(=O)c1ccccc1)C2CC2 b27d998fb9c3c4c7c6892785468356aa [0,1,0,1,0,0|1,0,0]=3 16745 B17R2.295162 C[C@@H](OCOC(=O)c1ccccc1)C2CC2 2b2e01dde4188dda170eca85bef8c3d7 [0,1,0,1,0,0|1,0,0]=3 16746 B17R2.295162 C[C@H](NCOC(=O)c1ccccc1)C2CC2 2819e6a4e65317ea6dc83065db241093 [0,1,0,1,0,0|1,0,0]=3 16747 B17R2.295162 C[C@H](OCOC(=O)c1ccccc1)C2CC2 955898a9aab434cff7a6029bd358c302 [0,1,0,1,0,0|1,0,0]=3 16748 B17R2.295162 O=C(CNCC(O)C1CC1)c2ccccc2 a92d7c4106a4266934654ed3ac70118f [0,1,0,1,0,0|2,0,0]=4 16749 B17R2.324325 CCCC(S)CCOC1Cc2c1cccc2 ee11f77d6bf23ad69b03c4960a464e79 [0,1,0,1,0,0|1,0,1]=4 16750 B17R2.209 CC1CCC(CC1)NC(=O)c2ccccc2 435a150bdc69abc18807aebb226f5163 [0,1,0,1,0,0|1,0,0]=3 16751 B17R2.209 CC1CCC(CC1)NC(=O)c2ccccn2 442bc75511e813624e48b61181a31dae [0,1,0,1,0,0|2,0,0]=4 16752 B17R2.209 CC1CCC(CC1)NC(=O)c2cccnc2 1a1f78fa0933ad7e593ef792dedf74f2 [0,1,0,1,0,0|2,0,0]=4 16753 B17R2.209 CC1CCC(CC1)NC(=O)c2ccncc2 3eee6ebb87845ae65d45cb1c4820505d [0,1,0,1,0,0|2,0,0]=4 16754 B17R2.209 CC1CCC(CC1)OC(C)c2ccccc2 b2a68201a19d363b2191033267555883 [0,1,0,1,0,0|1,0,1]=4 16755 B17R2.209 CC1CCC(CC1)O[C@@H](C)c2ccccc2 6380722acc5449f39657c846c4d4b01c [0,1,0,1,0,0|1,0,1]=4 16756 B17R2.209 CC1CCC(CC1)O[C@H](C)c2ccccc2 396b72b6c1afe3148588776d54050c9b [0,1,0,1,0,0|1,0,1]=4 16757 B17R2.209 CC1CCN(CC1)CC(=O)c2ccccc2 2e74efd78e3fdb7d9eb185fe670482c7 [0,1,0,1,0,0|2,0,0]=4 16758 B17R2.209 CN1CCC(CC1)NC(=O)c2ccccc2 6bbc6a306e5f44ff0a1d86ae21b00890 [0,1,0,1,0,0|2,0,0]=4 16759 B17R2.209 C[C@H]1CC[C@@H](CC1)NC(=O)c2ccccc2 80765c9d43667b4fa5b22378281462b6 [0,1,0,1,0,0|1,0,0]=3 16760 B17R2.209 C[C@H]1CC[C@@H](CC1)NC(=O)c2ccccn2 19fa6b075a99916c08b88db64a0c27c6 [0,1,0,1,0,0|2,0,0]=4 16761 B17R2.209 C[C@H]1CC[C@@H](CC1)NC(=O)c2cccnc2 4287302a968eb24f9d83c3822318cb80 [0,1,0,1,0,0|2,0,0]=4 16762 B17R2.209 C[C@H]1CC[C@@H](CC1)NC(=O)c2ccncc2 cc36ace8d41578b689d10b5e161e1e5e [0,1,0,1,0,0|2,0,0]=4 16763 B17R2.209 C[C@H]1CC[C@H](CC1)NC(=O)c2ccccc2 d6c941084eb02dbe24a42a3059940866 [0,1,0,1,0,0|1,0,0]=3 16764 B17R2.209 C[C@H]1CC[C@H](CC1)NC(=O)c2ccccn2 fb92ceecbf698f6a1b9b9fb64691e70d [0,1,0,1,0,0|2,0,0]=4 16765 B17R2.209 C[C@H]1CC[C@H](CC1)NC(=O)c2cccnc2 5c894baf80e453b76b78d06ce8cd7ab2 [0,1,0,1,0,0|2,0,0]=4 16766 B17R2.209 C[C@H]1CC[C@H](CC1)NC(=O)c2ccncc2 8da229302ec8363445dc215e3e53cc57 [0,1,0,1,0,0|2,0,0]=4 16767 B17R2.209 O=C(CN1CCC(CC1)Cl)c2ccccc2 a96be0f58f432b35d39dadee1cab4541 [0,1,0,1,0,0|2,0,0]=4 16768 B17R2.209 O=C(CN1CCC(CC1)F)c2ccccc2 1b1c3c701c323b41fa459fde5cb0adc3 [0,1,0,1,0,0|2,0,0]=4 16769 B17R2.209 O=C(CN1CCC(CC1)I)c2ccccc2 185a47092fe6a587120eb6a6a26fe386 [0,1,0,1,0,0|2,0,0]=4 16770 B17R2.209 O=C(CN1CCC(CC1)O)c2ccccc2 3057218cda7098e9021e2265301c9b6b [0,1,0,1,0,0|2,0,0]=4 16771 B17R2.209 O=C(NC1CCC(CC1)Cl)c2ccccc2 a2e9681c80fb22810cdfb0a469abd8e8 [0,1,0,1,0,0|1,0,0]=3 16772 B17R2.209 O=C(NC1CCC(CC1)Cl)c2ccccn2 c7fd45b45bdac6bb7d4847c39cd58426 [0,1,0,1,0,0|2,0,0]=4 16773 B17R2.209 O=C(NC1CCC(CC1)Cl)c2cccnc2 048848c27b3f7f7e250e1063af1b159f [0,1,0,1,0,0|2,0,0]=4 16774 B17R2.209 O=C(NC1CCC(CC1)Cl)c2ccncc2 0da400174856991f547ec616a1aa1636 [0,1,0,1,0,0|2,0,0]=4 16775 B17R2.209 O=C(NC1CCC(CC1)O)c2ccccc2 4b1a57685e7234d94918a6f7bd9d87ac [0,1,0,1,0,0|1,0,0]=3 16776 B17R2.209 O=C(NC1CCC(CC1)O)c2ccccn2 1df18b4911adb57bb3536e03341b1e85 [0,1,0,1,0,0|2,0,0]=4 16777 B17R2.209 O=C(NC1CCC(CC1)O)c2cccnc2 e2f0eeec903a6d619a2f1d847a78c80f [0,1,0,1,0,0|2,0,0]=4 16778 B17R2.209 O=C(NC1CCC(CC1)O)c2ccncc2 7daefb24e5ef0b554d91bca47bed78bd [0,1,0,1,0,0|2,0,0]=4 16779 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)Cl)c2ccccc2 3790776b3ed756fd39cf2adbe9b38fb0 [0,1,0,1,0,0|1,0,0]=3 16780 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)Cl)c2ccccn2 e8e3e178fd1ee98e2bca6f1e1ced6300 [0,1,0,1,0,0|2,0,0]=4 16781 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)Cl)c2cccnc2 e8d2d6b055b03cb8bf9327775878513e [0,1,0,1,0,0|2,0,0]=4 16782 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)Cl)c2ccncc2 0fefd5456c0f5a097f146f231fbc268b [0,1,0,1,0,0|2,0,0]=4 16783 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)O)c2ccccc2 db99208a8d12c54b7499b6c18b1c4103 [0,1,0,1,0,0|1,0,0]=3 16784 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)O)c2ccccn2 94d74851f408af8280c5e355be51d5b9 [0,1,0,1,0,0|2,0,0]=4 16785 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)O)c2cccnc2 488e27aa85b4eca80352119e829706b1 [0,1,0,1,0,0|2,0,0]=4 16786 B17R2.209 O=C(N[C@H]1CC[C@@H](CC1)O)c2ccncc2 01aeae936bfe784b9f2aada686506b07 [0,1,0,1,0,0|2,0,0]=4 16787 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)Cl)c2ccccc2 60e48c7624948f6785515f7ac95322e0 [0,1,0,1,0,0|1,0,0]=3 16788 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)Cl)c2ccccn2 26633e444f40ad3a4eca9126e168862a [0,1,0,1,0,0|2,0,0]=4 16789 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)Cl)c2cccnc2 b596ce77cf1f5ba9d73bedc34d75704c [0,1,0,1,0,0|2,0,0]=4 16790 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)Cl)c2ccncc2 42e1c2083f88b9906d600e4107982700 [0,1,0,1,0,0|2,0,0]=4 16791 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)O)c2ccccc2 f838a3ea2209a451b95ee6183f4a426b [0,1,0,1,0,0|1,0,0]=3 16792 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)O)c2ccccn2 fc57d203a56a8276546e6e0e9ab088c0 [0,1,0,1,0,0|2,0,0]=4 16793 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)O)c2cccnc2 2699e549c25b123dc7a39abd58eb92c3 [0,1,0,1,0,0|2,0,0]=4 16794 B17R2.209 O=C(N[C@H]1CC[C@H](CC1)O)c2ccncc2 d53220fe26de2683d0f4c45aaea8aff5 [0,1,0,1,0,0|2,0,0]=4 16795 B17R2.5305 CC1C(CCCN1C(=O)c2ccccc2)O db8e95090bb0cd356289c13b96c87b1b [0,1,0,1,0,0|1,0,0]=3 16796 B17R2.5305 CC1C(CCCN1C(=O)c2ccccn2)O a8dc8fc611f27f40dd366ea271a77112 [0,1,0,1,0,0|2,0,0]=4 16797 B17R2.5305 CC1C(CCCN1C(=O)c2cccnc2)O 067b822e6ea24d124fd88a868bb87b5c [0,1,0,1,0,0|2,0,0]=4 16798 B17R2.5305 CC1C(CCCN1C(=O)c2ccncc2)O 26bad9396494a51b739b847a0f371189 [0,1,0,1,0,0|2,0,0]=4 16799 B17R2.5305 CC1OCCN(C1C)C(=O)c2ccccc2 17dd77f3c7f2278a24057e960e7199fa [0,1,0,1,0,0|2,0,0]=4 16800 B17R2.5305 C[C@@H]1[C@H](CCCN1C(=O)c2ccccc2)O a444418e65e97e656497e18e6bc9a6dd [0,1,0,1,0,0|1,0,0]=3 16801 B17R2.5305 C[C@@H]1[C@H](CCCN1C(=O)c2ccccn2)O 1446a64f9ccac2a834060c1737bdeba4 [0,1,0,1,0,0|2,0,0]=4 16802 B17R2.5305 C[C@@H]1[C@H](CCCN1C(=O)c2cccnc2)O d5e5f75ee0a96e9334082ce57d66d22a [0,1,0,1,0,0|2,0,0]=4 16803 B17R2.5305 C[C@@H]1[C@H](CCCN1C(=O)c2ccncc2)O 482aef3cc0e20a6f15e80cb2546a5037 [0,1,0,1,0,0|2,0,0]=4 16804 B17R2.5305 C[C@H]1[C@@H](CCCN1C(=O)c2ccccc2)O a95f37e56a1adb26888d65b9c7154644 [0,1,0,1,0,0|1,0,0]=3 16805 B17R2.5305 C[C@H]1[C@@H](CCCN1C(=O)c2ccccn2)O 0b059db447420815e4449465e78e91ff [0,1,0,1,0,0|2,0,0]=4 16806 B17R2.5305 C[C@H]1[C@@H](CCCN1C(=O)c2cccnc2)O fe0eacf5c6415a22f1a7f53d32be372a [0,1,0,1,0,0|2,0,0]=4 16807 B17R2.5305 C[C@H]1[C@@H](CCCN1C(=O)c2ccncc2)O b2d0ca3797724d1bebfb31a7eadab9ae [0,1,0,1,0,0|2,0,0]=4 16808 B17R2.8653 CC1C(CCN1CC(=O)c2ccccc2)O b1c5d317e55593e70c1640afd2ef8d21 [0,1,0,1,0,0|2,0,0]=4 16809 B17R2.8653 C[C@@H]1[C@@H](CCN1CC(=O)c2ccccc2)O ce8c949b7cd0363fa10265ea55327bb1 [0,1,0,1,0,0|2,0,0]=4 16810 B17R2.8653 C[C@H]1[C@H](CCN1CC(=O)c2ccccc2)O f299f78a6b3611b5b8184dad38941062 [0,1,0,1,0,0|2,0,0]=4 16811 B17R2.12736 CC1(CCCN1C(=O)c2ccccc2)CO e241a181ba00af6352d3d9ab802aacdb [0,1,0,1,0,0|2,0,0]=4 16812 B17R2.58062 CCC(C)N1CCNC(=O)c2c1cccc2 210da686397063e664cd7e2ca0d1a4d7 [0,1,0,1,0,0|2,0,0]=4 16813 B17R2.87547 C=C(CC)COC1OC(=O)c2c1cccc2 932771adb9c0573d9b4f5f75e7162481 [0,1,0,1,0,0|1,0,1]=4 16814 B17R2.87547 CC(CO)CNC1OC(=O)c2c1cccc2 827e6b6e5acd12fb19df012b28f56f49 [0,1,0,1,0,0|2,0,0]=4 16815 B17R2.87547 CCC(=O)COC1OC(=O)c2c1cccc2 c8d990f538808628cbee8263dbe2f0a1 [0,1,0,1,0,0|1,0,1]=4 16816 B17R2.87547 CCC(C)CNC1CC(=O)c2c1cccc2 33685b90fa2c9cd67ab8ac1032743ee6 [0,1,0,1,0,0|2,0,0]=4 16817 B17R2.87547 CCC(C)CNC1NC(=O)c2c1cccc2 49eccfe03511ffb978ed0117d104c153 [0,1,0,1,0,0|2,0,0]=4 16818 B17R2.87547 CCC(C)COC1CC(=O)c2c1cccc2 bb5c49123460e0f873ba6fbaee095e6c [0,1,0,1,0,0|2,0,0]=4 16819 B17R2.87547 CCC(C)COC1OC(=O)c2c1cccc2 e2ad6b096294aa9ebb8d0dcfe011de79 [0,1,0,1,0,0|1,0,0]=3 16820 B17R2.87547 CCC(C)COC1OC(=O)c2c1cncc2 71536104e6ffb247f1da05d0992ac463 [0,1,0,1,0,0|2,0,0]=4 16821 B17R2.87547 CCC(O)CNC1CC(=O)c2c1cccc2 d103863b393987175dd0d893c8e674e7 [0,1,0,1,0,0|2,0,0]=4 16822 B17R2.87547 CCC(O)CNC1NC(=O)c2c1cccc2 6d3f39fea47b78410f7ec87fd47287a8 [0,1,0,1,0,0|2,0,0]=4 16823 B17R2.87547 CC[C@@H](C)CNC1NC(=O)c2c1cccc2 9a246dc9512636570f475cc40361efed [0,1,0,1,0,0|2,0,0]=4 16824 B17R2.87547 CC[C@@H](C)COC1CC(=O)c2c1cccc2 a84a442f011b9f2d8df676dfb2f6af2c [0,1,0,1,0,0|2,0,0]=4 16825 B17R2.87547 CC[C@@H](C)COC1OC(=O)c2c1cccc2 691a17283b0da84f6cd24e06dd18cb2e [0,1,0,1,0,0|1,0,0]=3 16826 B17R2.87547 CC[C@@H](C)COC1OC(=O)c2c1cncc2 6ff4f2c01a39afe1f94e8ccde24ade1d [0,1,0,1,0,0|2,0,0]=4 16827 B17R2.87547 CC[C@@H](O)CNC1CC(=O)c2c1cccc2 26b3870f5e394bacab24dc756a1afdd5 [0,1,0,1,0,0|2,0,0]=4 16828 B17R2.87547 CC[C@H](C)CNC1CC(=O)c2c1cccc2 bff578f92258cf392caf1425c4df50c7 [0,1,0,1,0,0|2,0,0]=4 16829 B17R2.87547 CC[C@H](C)CNC1NC(=O)c2c1cccc2 98b95bab178e3293399c158fc741028e [0,1,0,1,0,0|2,0,0]=4 16830 B17R2.87547 CC[C@H](C)COC1CC(=O)c2c1cccc2 9c2969a14214c4e8c0799f3c31ef081e [0,1,0,1,0,0|2,0,0]=4 16831 B17R2.87547 CC[C@H](C)COC1OC(=O)c2c1cccc2 c6d265f03c0cf6b059dd2242944fbc94 [0,1,0,1,0,0|1,0,0]=3 16832 B17R2.87547 CC[C@H](C)COC1OC(=O)c2c1cncc2 5b18b714552e08502d12d47bd9e08a43 [0,1,0,1,0,0|2,0,0]=4 16833 B17R2.87547 COC(C)COC1OC(=O)c2c1cccc2 556a020f88547198ac222d1188defc2f [0,1,0,1,0,0|2,0,0]=4 16834 B17R2.87547 CO[C@@H](C)COC1OC(=O)c2c1cccc2 14655060d5f269946b7bce34e34c1558 [0,1,0,1,0,0|2,0,0]=4 16835 B17R2.87547 CO[C@H](C)COC1OC(=O)c2c1cccc2 c15ca52a676e7b44a428e8779329ccb5 [0,1,0,1,0,0|2,0,0]=4 16836 B17R2.87547 C[C@H](CO)CNC1OC(=O)c2c1cccc2 97c7edc06377eee48174c7f04843990a [0,1,0,1,0,0|2,0,0]=4 16837 B17R2.87547 O=C1OC(c2c1cccc2)NCC(F)CO 216acaf3c8dad628564aacb52b4132cc [0,1,0,1,0,0|2,0,0]=4 16838 B17R2.87547 O=C1OC(c2c1cccc2)NCC(O)CO 236d97e8f0e4721ab5d5c75409d1bd2d [0,1,0,1,0,0|2,0,0]=4 16839 B17R2.87547 O=C1OC(c2c1cccc2)NC[C@@H](F)CO 95d1fed86f0308043fd81c79f2f48fe3 [0,1,0,1,0,0|2,0,0]=4 16840 B17R2.87547 O=C1OC(c2c1cccc2)NC[C@@H](O)CO cf3c15619a47b910ada3f9b43896c9ff [0,1,0,1,0,0|2,0,0]=4 16841 B17R2.87547 O=C1OC(c2c1cccc2)NC[C@H](F)CO abbe2cbc9a7f038c45ca713d187e21c4 [0,1,0,1,0,0|2,0,0]=4 16842 B17R2.87547 O=C1OC(c2c1cccc2)NC[C@H](O)CO e650449ac0b653949c63a8a3af549677 [0,1,0,1,0,0|2,0,0]=4 16843 B17R2.87547 O=C1OC(c2c1cccc2)OCC(O)CO 810c6a7a95a8e23066f349797a0292cc [0,1,0,1,0,0|2,0,0]=4 16844 B17R2.87547 O=C1OC(c2c1cccc2)OC[C@@H](O)CO bf9f29f8e61ca775bb67a0a100d47a92 [0,1,0,1,0,0|2,0,0]=4 16845 B17R2.87547 O=C1OC(c2c1cccc2)OC[C@H](O)CO 4c1be7715aaac55bbf23d072f2ff2b58 [0,1,0,1,0,0|2,0,0]=4 16846 B17R2.294952 CC1(CC1)CCOCC(=O)c2ccccc2 bd725b67404749ae317f5a6927a854e3 [0,1,0,1,0,0|2,0,0]=4 16847 B17R2.294952 CC1(CC1)COCCC(=O)c2ccccc2 50c232fc0dc3f9dc067a56657265b3b1 [0,1,0,1,0,0|2,0,0]=4 16848 B17R2.294952 CC1(CC1)COCNC(=O)c2ccccc2 781fc27c09d83f10f971df38b40d26f6 [0,1,0,1,0,0|2,0,0]=4 16849 B17R2.294952 CC1(CC1)COCOC(=O)c2ccccc2 9f8501237c0c2f7879d1261650d9bc83 [0,1,0,1,0,0|1,0,0]=3 16850 B17R2.294952 CC1(CC1)NCCCC(=O)c2ccccc2 28c62e6b438609180e1e87ad2ee7dc5a [0,1,0,1,0,0|2,0,0]=4 16851 B17R2.294952 CC1(CC1)NCCNC(=O)c2ccccc2 72dd24b67b745a7acfe6ae366fa2ca0e [0,1,0,1,0,0|2,0,0]=4 16852 B17R2.294952 CC1(CC1)NCCOC(=O)c2ccccc2 9c66a979fc3a2145c4a6c6c1a390fc38 [0,1,0,1,0,0|1,0,0]=3 16853 B17R2.294952 O=C(CCNCC1(CC1)F)c2ccccc2 1ff286644714465f856a1f73ec7e3389 [0,1,0,1,0,0|2,0,0]=4 16854 B17R2.294952 O=C(CCOCC1(CC1)Cl)c2ccccc2 8e6732ad7905efbe0f542fd949b984b4 [0,1,0,1,0,0|2,0,0]=4 16855 B17R2.294952 O=C(CCOCC1(CC1)F)c2ccccc2 098790a1e47b6ec080f97ce4cb569c97 [0,1,0,1,0,0|2,0,0]=4 16856 B17R2.294952 O=C(NCOCC1(CC1)F)c2ccccc2 00ef6d2910e52d6031d448732348a20b [0,1,0,1,0,0|2,0,0]=4 16857 B17R2.294952 O=C(OCNCC1(CC1)F)c2ccccc2 69fb39b27d4b1e3145add79422bb723f [0,1,0,1,0,0|1,0,0]=3 16858 B17R2.294952 O=C(OCNCC1(CC1)O)c2ccccc2 87411f41a1c7294ba70ba9cecdb6b2ce [0,1,0,1,0,0|1,0,0]=3 16859 B17R2.294952 O=C(OCOCC1(CC1)Br)c2ccccc2 742a2ee6d709ca908fdfe028c58f487a [0,1,0,1,0,0|1,0,0]=3 16860 B17R2.294952 O=C(OCOCC1(CC1)Cl)c2ccccc2 ad7c763190929d64bea1b6759b3426eb [0,1,0,1,0,0|1,0,0]=3 16861 B17R2.294952 O=C(OCOCC1(CC1)F)c2ccccc2 a58d90189af498a25e9f4a2776b88df5 [0,1,0,1,0,0|1,0,0]=3 16862 B17R2.451963 CCC(C)CN1CCC(=O)c2c1cccc2 08031b1f0a8119f50742b56d53c2db97 [0,1,0,1,0,0|2,0,0]=4 16863 B17R2.451963 CCC(C)OC1CCC(=O)c2c1cccc2 e9cd696b4e544fb9f850be703b8600fa [0,1,0,1,0,0|2,0,0]=4 16864 B17R2.451963 CC[C@H](C)CN1CCC(=O)c2c1cccc2 4db582fe74985bf136dc055478905ace [0,1,0,1,0,0|2,0,0]=4 16865 B17R2.20255 O=S(=O)(OCCNC1CC1)c2ccccc2 e8188ad3b2932009f39aab6a93491ce5 [0,1,0,1,0,0|2,0,0]=4 16866 B17R2.20255 O=S(=O)(OCCOC1CC1)c2ccccc2 5414b0b5a6f515dc0ab136ade602f810 [0,1,0,1,0,0|2,0,0]=4 16867 B17R2.20268 CC(C)(OCCC1CCC1)c2ccccc2 1b948d18b6df32c443b4cd0dfa50ac48 [0,1,0,1,0,0|1,0,1]=4 16868 B17R2.20268 O=S(=O)(OCCN1CCC1)c2ccccc2 d7fad92c5ffc76ec4723530a0ad04bd3 [0,1,0,1,0,0|2,0,0]=4 16869 B17R2.154272 CC(C)(OCC1CCCC1)c2ccccc2 f00e0194928b8b4312f7f089891531ec [0,1,0,1,0,0|1,0,1]=4 16870 B17R2.3950 CC(OCC1CCCC1)c2ccccc2Cl a3eab1de23ac38991261e4922d4af8e3 [0,1,0,1,0,0|1,0,1]=4 16871 B17R2.3950 CC(OCC1CCCC1)c2ccccc2F 6ff9e2745d3b6f63c3d51b8f3733996c [0,1,0,1,0,0|1,0,1]=4 16872 B17R2.3950 CC(OCC1CCCC1)c2ccccc2I 11220a234ee6b719389ca2b074050437 [0,1,0,1,0,0|1,0,1]=4 16873 B17R2.3950 C[C@@H](OCC1CCCC1)c2ccccc2Cl 4393c867883cd9f18c190e15dd7e8ecb [0,1,0,1,0,0|1,0,1]=4 16874 B17R2.3950 C[C@@H](OCC1CCCC1)c2ccccc2F 1b27becc00b4947f593aa31381afbb19 [0,1,0,1,0,0|1,0,1]=4 16875 B17R2.3950 C[C@H](OCC1CCCC1)c2ccccc2Cl 36df2dca67f1ae8f3570570fea752340 [0,1,0,1,0,0|1,0,1]=4 16876 B17R2.3950 C[C@H](OCC1CCCC1)c2ccccc2F 384ac7c74a49f4416f88111fed1e5038 [0,1,0,1,0,0|1,0,1]=4 16877 B17R2.3950 Cc1ccccc1C(=O)CNC2CCCC2 b38bbb8e5ae44dc3ef4e47dc8fa45a0a [0,1,0,1,0,0|2,0,0]=4 16878 B17R2.3950 Cc1ccccc1C(=O)COC2CCCC2 e90696e9db347a912584916e09f8cfe2 [0,1,0,1,0,0|2,0,0]=4 16879 B17R2.3950 Cc1ccccc1C(=O)NCC2CCCC2 13889d2f80f1b397bc68c92e65055582 [0,1,0,1,0,0|1,0,0]=3 16880 B17R2.3950 Cc1ccccc1C(=O)NCC2CCCO2 8efcfd27709696d6b69884624622058c [0,1,0,1,0,0|2,0,0]=4 16881 B17R2.3950 Cc1ccccc1C(=O)NCC2CCOC2 5a564a1a248ca35abd5af51382abd9a4 [0,1,0,1,0,0|2,0,0]=4 16882 B17R2.3950 Cc1ccccc1C(=O)NC[C@@H]2CCCO2 ffaec29712d373ce05181c5a6369b3a5 [0,1,0,1,0,0|2,0,0]=4 16883 B17R2.3950 Cc1ccccc1C(=O)NC[C@@H]2CCOC2 12a22219e15654819549698b1906f421 [0,1,0,1,0,0|2,0,0]=4 16884 B17R2.3950 Cc1ccccc1C(=O)NC[C@H]2CCCO2 b87d8c5eebb750b1926294375bffc740 [0,1,0,1,0,0|2,0,0]=4 16885 B17R2.3950 Cc1ccccc1C(=O)NC[C@H]2CCOC2 4d95e6f5a9697cc77285891a8c6c2b40 [0,1,0,1,0,0|2,0,0]=4 16886 B17R2.3950 Cc1cccnc1C(=O)NCC2CCCC2 e8ebd67f54c46f734aac78868b2c7b49 [0,1,0,1,0,0|2,0,0]=4 16887 B17R2.3950 Cc1ccncc1C(=O)NCC2CCCC2 cf9455452f25cd1ed0ff9ef13840ea74 [0,1,0,1,0,0|2,0,0]=4 16888 B17R2.3950 Cc1cnccc1C(=O)NCC2CCCC2 a613b24e8dbce5d08b1912e34245c741 [0,1,0,1,0,0|2,0,0]=4 16889 B17R2.3950 Cc1ncccc1C(=O)NCC2CCCC2 f9495ef439eb70acc6e4a3d13f63c2ea [0,1,0,1,0,0|2,0,0]=4 16890 B17R2.3950 O=C(CNC1CCCC1)c2ccccc2Cl ff7c60b8e71cb56239f2e46bd69769ee [0,1,0,1,0,0|2,0,0]=4 16891 B17R2.3950 O=C(CNC1CCCC1)c2ccccc2F 6b41b73fe61e5e7be2d8e270bebb907b [0,1,0,1,0,0|2,0,0]=4 16892 B17R2.3950 O=C(CNC1CCCC1)c2ccccc2I 035e969786d7b667f1aa02937e04596a [0,1,0,1,0,0|2,0,0]=4 16893 B17R2.3950 O=C(COC1CCCC1)c2ccccc2Br 4b7cca258635621b976c7f74c0930602 [0,1,0,1,0,0|2,0,0]=4 16894 B17R2.3950 O=C(COC1CCCC1)c2ccccc2Cl bd0bce20a5b52801afd80bacc49647e1 [0,1,0,1,0,0|2,0,0]=4 16895 B17R2.3950 O=C(COC1CCCC1)c2ccccc2F 67a3da31cf448c6af1dea5fd0938bb22 [0,1,0,1,0,0|2,0,0]=4 16896 B17R2.3950 O=C(COC1CCCC1)c2ccccc2I bffac4adca430c7d7da3ebfc1db5ed54 [0,1,0,1,0,0|2,0,0]=4 16897 B17R2.3950 O=C(NCC1CCCC1)c2cccc[n+]2[O-] e0823acae83374755776577d733d9829 [0,1,0,1,0,0|2,0,0]=4 16898 B17R2.3950 O=C(NCC1CCCC1)c2ccccc2Br 2c6b50931f278789c97898701e6c787d [0,1,0,1,0,0|1,0,0]=3 16899 B17R2.3950 O=C(NCC1CCCC1)c2ccccc2Cl 9904d83812cc64f288136c03434404e4 [0,1,0,1,0,0|1,0,0]=3 16900 B17R2.3950 O=C(NCC1CCCC1)c2ccccc2F 8e304a4eaa2867f0091539c0f71f1cdb [0,1,0,1,0,0|1,0,0]=3 16901 B17R2.3950 O=C(NCC1CCCC1)c2ccccc2I f095c395928d62f0bf9c309714f3b3d5 [0,1,0,1,0,0|1,0,0]=3 16902 B17R2.3950 O=C(NCC1CCCC1)c2ccccc2O c20e344d5c139fa7ebb9a57ff4da0e0c [0,1,0,1,0,0|1,0,0]=3 16903 B17R2.3950 O=C(NCC1CCCC1)c2ccccc2S a63b8dc60f4b4f16d31b78983f9736ce [0,1,0,1,0,0|1,0,0]=3 16904 B17R2.3950 O=C(NCC1CCCC1)c2cccnc2Br f25004734561545eea5e09b9a35ed2b6 [0,1,0,1,0,0|2,0,0]=4 16905 B17R2.3950 O=C(NCC1CCCC1)c2cccnc2Cl 91441ae168f82b02c3e84499554c97cf [0,1,0,1,0,0|2,0,0]=4 16906 B17R2.3950 O=C(NCC1CCCC1)c2cccnc2F 479aed9bcaaf63c824691c18e5a8b61e [0,1,0,1,0,0|2,0,0]=4 16907 B17R2.3950 O=C(NCC1CCCC1)c2cccnc2I 19b710fdc0f3ee8dcb9f5ead470fdd16 [0,1,0,1,0,0|2,0,0]=4 16908 B17R2.3950 O=C(NCC1CCCC1)c2cccnc2O a0be71d836d4c224cab3f5219b716863 [0,1,0,1,0,0|2,0,0]=4 16909 B17R2.3950 O=C(NCC1CCCC1)c2cccnc2S 26593fe84232a49132b69cf4918a7e2c [0,1,0,1,0,0|2,0,0]=4 16910 B17R2.3950 O=C(NCC1CCCC1)c2ccncc2Br b6f2c7dd02e72477806569ebe383417c [0,1,0,1,0,0|2,0,0]=4 16911 B17R2.3950 O=C(NCC1CCCC1)c2ccncc2Cl 146d84024b0e1cb2660f5fb88ff3bfb2 [0,1,0,1,0,0|2,0,0]=4 16912 B17R2.3950 O=C(NCC1CCCC1)c2ccncc2F ef8036b1f44ac3818f551e38da662011 [0,1,0,1,0,0|2,0,0]=4 16913 B17R2.3950 O=C(NCC1CCCC1)c2ccncc2I d9b46eab7858b3fd266c47eeaf80a6d3 [0,1,0,1,0,0|2,0,0]=4 16914 B17R2.3950 O=C(NCC1CCCC1)c2ccncc2O e68e188c23d0ef77e2a9e2793208ffd3 [0,1,0,1,0,0|2,0,0]=4 16915 B17R2.3950 O=C(NCC1CCCC1)c2cnccc2Br 380fd3acb1648eecb2f3dbecbfe4ae29 [0,1,0,1,0,0|2,0,0]=4 16916 B17R2.3950 O=C(NCC1CCCC1)c2cnccc2Cl e29034d73a1cd6e55d2d7b9179687d57 [0,1,0,1,0,0|2,0,0]=4 16917 B17R2.3950 O=C(NCC1CCCC1)c2cnccc2F 766cdd18bb02ce5f8f1eabbd15dfb4a4 [0,1,0,1,0,0|2,0,0]=4 16918 B17R2.3950 O=C(NCC1CCCC1)c2cnccc2O fe14a526645a3b808de477462c2590e3 [0,1,0,1,0,0|2,0,0]=4 16919 B17R2.3950 O=C(NCC1CCCC1)c2ncccc2Br 41549b432cbe108f7afc696a18838b92 [0,1,0,1,0,0|2,0,0]=4 16920 B17R2.3950 O=C(NCC1CCCC1)c2ncccc2Cl 06e1853014dd883d5748d75d6ab84f12 [0,1,0,1,0,0|2,0,0]=4 16921 B17R2.3950 O=C(NCC1CCCC1)c2ncccc2F bbfd8feef0f5f4fd4e4e1a7245a5631b [0,1,0,1,0,0|2,0,0]=4 16922 B17R2.3950 O=C(NCC1CCCC1)c2ncccc2I 074622af699194a60a2c70bc043fd199 [0,1,0,1,0,0|2,0,0]=4 16923 B17R2.3950 O=C(NCC1CCCC1)c2ncccc2O 2c0493a3531cbfc451ee0c196ea98fe1 [0,1,0,1,0,0|2,0,0]=4 16924 B17R2.3950 O=C(NCC1CCCO1)c2ccccc2Br 9160dbcb706837ae6e5e37ee2087c4e2 [0,1,0,1,0,0|2,0,0]=4 16925 B17R2.3950 O=C(NCC1CCCO1)c2ccccc2Cl 8e18f9f61b2a1070bd5c3456ee074cfb [0,1,0,1,0,0|2,0,0]=4 16926 B17R2.3950 O=C(NCC1CCCO1)c2ccccc2F 5cc7a42dbcc9a1170da81893c4dcf892 [0,1,0,1,0,0|2,0,0]=4 16927 B17R2.3950 O=C(NCC1CCCO1)c2ccccc2I 120f3e4e7075a4eedf44f8fbbaf437a0 [0,1,0,1,0,0|2,0,0]=4 16928 B17R2.3950 O=C(NCC1CCCO1)c2ccccc2O e4256bfef74bcf55c86cd6b31cf85611 [0,1,0,1,0,0|2,0,0]=4 16929 B17R2.3950 O=C(NCC1CCCO1)c2ccccc2S 705b1c33693acfd8854e971a2f54c34c [0,1,0,1,0,0|2,0,0]=4 16930 B17R2.3950 O=C(NCC1CCOC1)c2ccccc2Br 166284f60d7186e75e9295686489e353 [0,1,0,1,0,0|2,0,0]=4 16931 B17R2.3950 O=C(NCC1CCOC1)c2ccccc2Cl e159484b12ed196382ff64f2a60a4dbc [0,1,0,1,0,0|2,0,0]=4 16932 B17R2.3950 O=C(NCC1CCOC1)c2ccccc2F 8002194215a80b46913e1d81f6ba8bbd [0,1,0,1,0,0|2,0,0]=4 16933 B17R2.3950 O=C(NCC1CCOC1)c2ccccc2I 18f78f0ee78ef0178bb75af7cdc1c798 [0,1,0,1,0,0|2,0,0]=4 16934 B17R2.3950 O=C(NCC1CCOC1)c2ccccc2O 8b76f89a3491fd04ef558128e75b11d4 [0,1,0,1,0,0|2,0,0]=4 16935 B17R2.3950 O=C(NCC1CCOC1)c2ccccc2S b5bbe4ffa2f66f9a34ed51cd20cb58d8 [0,1,0,1,0,0|2,0,0]=4 16936 B17R2.3950 O=C(NC[C@@H]1CCCO1)c2ccccc2Br a41fe7fcc48106c6e48b9d1f325e6cc3 [0,1,0,1,0,0|2,0,0]=4 16937 B17R2.3950 O=C(NC[C@@H]1CCCO1)c2ccccc2Cl 52e6cdf0868438ac70442b7df1b9a0bb [0,1,0,1,0,0|2,0,0]=4 16938 B17R2.3950 O=C(NC[C@@H]1CCCO1)c2ccccc2F b33079c21664415dfbdc827b85a2a030 [0,1,0,1,0,0|2,0,0]=4 16939 B17R2.3950 O=C(NC[C@@H]1CCCO1)c2ccccc2I 1c00c08d2133df71ae4314f6508a16e8 [0,1,0,1,0,0|2,0,0]=4 16940 B17R2.3950 O=C(NC[C@@H]1CCCO1)c2ccccc2O a89a22bad1bcb3102dbbb93550bf0396 [0,1,0,1,0,0|2,0,0]=4 16941 B17R2.3950 O=C(NC[C@@H]1CCCO1)c2ccccc2S 8682191446f315d09bb3d2666f5a9867 [0,1,0,1,0,0|2,0,0]=4 16942 B17R2.3950 O=C(NC[C@@H]1CCOC1)c2ccccc2Br f5a3473c975cc1e9d7af9eaf8fcef59c [0,1,0,1,0,0|2,0,0]=4 16943 B17R2.3950 O=C(NC[C@@H]1CCOC1)c2ccccc2Cl 46761857f17d35d5b06aac770e32019e [0,1,0,1,0,0|2,0,0]=4 16944 B17R2.3950 O=C(NC[C@@H]1CCOC1)c2ccccc2F 058e6c7a3f4cb505a9f45aa0af9d9a64 [0,1,0,1,0,0|2,0,0]=4 16945 B17R2.3950 O=C(NC[C@@H]1CCOC1)c2ccccc2I 3ad77cef70abb0609e29c6adc75854ac [0,1,0,1,0,0|2,0,0]=4 16946 B17R2.3950 O=C(NC[C@@H]1CCOC1)c2ccccc2O a97bf8d0dc988759808657a7c217c28b [0,1,0,1,0,0|2,0,0]=4 16947 B17R2.3950 O=C(NC[C@@H]1CCOC1)c2ccccc2S 97e3656ce829856e0aa75315fe4585bf [0,1,0,1,0,0|2,0,0]=4 16948 B17R2.3950 O=C(NC[C@H]1CCCO1)c2ccccc2Br 88d93143ee1f50ab546977033083abe6 [0,1,0,1,0,0|2,0,0]=4 16949 B17R2.3950 O=C(NC[C@H]1CCCO1)c2ccccc2Cl 3c461b2cb9be486b8d773bfb37e616ab [0,1,0,1,0,0|2,0,0]=4 16950 B17R2.3950 O=C(NC[C@H]1CCCO1)c2ccccc2F 3d8c731a0fdacde1bd4e2eb6bb9ec347 [0,1,0,1,0,0|2,0,0]=4 16951 B17R2.3950 O=C(NC[C@H]1CCCO1)c2ccccc2I a534e59bc4eabcc5a931341806ece5c0 [0,1,0,1,0,0|2,0,0]=4 16952 B17R2.3950 O=C(NC[C@H]1CCCO1)c2ccccc2O 5011f10c9cdb4767f7bf31211c0556f8 [0,1,0,1,0,0|2,0,0]=4 16953 B17R2.3950 O=C(NC[C@H]1CCCO1)c2ccccc2S bff421cbca4a8294d3faced433ea173e [0,1,0,1,0,0|2,0,0]=4 16954 B17R2.3950 O=C(NC[C@H]1CCOC1)c2ccccc2Br c999d8beb374b93cca427915894be3ef [0,1,0,1,0,0|2,0,0]=4 16955 B17R2.3950 O=C(NC[C@H]1CCOC1)c2ccccc2Cl 81f53957513c47a75de0ed49bb919c32 [0,1,0,1,0,0|2,0,0]=4 16956 B17R2.3950 O=C(NC[C@H]1CCOC1)c2ccccc2F c1d4028f6028b02f2496e048e4b0da13 [0,1,0,1,0,0|2,0,0]=4 16957 B17R2.3950 O=C(NC[C@H]1CCOC1)c2ccccc2I 9924e2138bd99933734da4e855fd9d2c [0,1,0,1,0,0|2,0,0]=4 16958 B17R2.3950 O=C(NC[C@H]1CCOC1)c2ccccc2O de9ff341a6e51ea56c7bd76c46866f5e [0,1,0,1,0,0|2,0,0]=4 16959 B17R2.3950 O=C(NC[C@H]1CCOC1)c2ccccc2S 3ccfec67c2b88583f801fe9d58188825 [0,1,0,1,0,0|2,0,0]=4 16960 B17R2.13374 CCC1CCCN1C(=O)c2cccc[n+]2[O-] df77fc199983c35ace415870fa5f9305 [0,1,0,1,0,0|2,0,0]=4 16961 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2Br d6db11e2b94f25636c242f89755427cf [0,1,0,1,0,0|1,0,0]=3 16962 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2C 08ed20c1b0f285d8bc6c67c3363098d8 [0,1,0,1,0,0|1,0,0]=3 16963 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2Cl 720fa71ffd50bfc9f52c800d3e2d1a39 [0,1,0,1,0,0|1,0,0]=3 16964 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2F e72d6c90cf7ebd5f61ff296ff39f09a8 [0,1,0,1,0,0|1,0,0]=3 16965 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2I 9950fdc44796913f5864268f23917d3c [0,1,0,1,0,0|1,0,0]=3 16966 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2O c70615b688c73cd53a328bd4fa924fd9 [0,1,0,1,0,0|1,0,0]=3 16967 B17R2.13374 CCC1CCCN1C(=O)c2ccccc2S 08a315b2d9d9811c52145652e75b7215 [0,1,0,1,0,0|1,0,0]=3 16968 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2Br d4ae868c8b119460b0c0d9531cf4c3e3 [0,1,0,1,0,0|2,0,0]=4 16969 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2C 68f4886ec2f626632512ca6f89e1b047 [0,1,0,1,0,0|2,0,0]=4 16970 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2Cl 1b89f4900c27e95a6e4dcd9e46c3e448 [0,1,0,1,0,0|2,0,0]=4 16971 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2F dc9eacb3fbe07c7497ca75cf42b6ddce [0,1,0,1,0,0|2,0,0]=4 16972 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2I 3d328f53a19add26dde08a9e19d15375 [0,1,0,1,0,0|2,0,0]=4 16973 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2O 495c4644a0bd45dc4b795364bb88eeba [0,1,0,1,0,0|2,0,0]=4 16974 B17R2.13374 CCC1CCCN1C(=O)c2cccnc2S 8cf9099f3fa0f7c28b5fc27d5efe1385 [0,1,0,1,0,0|2,0,0]=4 16975 B17R2.13374 CCC1CCCN1C(=O)c2ccncc2Br 9e9288538047c69a99cd4cd0fc90e7e4 [0,1,0,1,0,0|2,0,0]=4 16976 B17R2.13374 CCC1CCCN1C(=O)c2ccncc2C e5556194fbfcd3c4f949aa6d8b7c1920 [0,1,0,1,0,0|2,0,0]=4 16977 B17R2.13374 CCC1CCCN1C(=O)c2ccncc2Cl e26b5e48c89402d68d6da5e9c86fa178 [0,1,0,1,0,0|2,0,0]=4 16978 B17R2.13374 CCC1CCCN1C(=O)c2ccncc2F 46fc38688418a7a987fc4dbb7dc3180c [0,1,0,1,0,0|2,0,0]=4 16979 B17R2.13374 CCC1CCCN1C(=O)c2ccncc2I 7ea9a51475b100fed1c6673a3a0100cc [0,1,0,1,0,0|2,0,0]=4 16980 B17R2.13374 CCC1CCCN1C(=O)c2ccncc2O 74823b504abfdf5ee5469e9edc2dbcf4 [0,1,0,1,0,0|2,0,0]=4 16981 B17R2.13374 CCC1CCCN1C(=O)c2cnccc2Br b5cd6e2bfc16a03c5ad268ba5b34642e [0,1,0,1,0,0|2,0,0]=4 16982 B17R2.13374 CCC1CCCN1C(=O)c2cnccc2C d8ce3aa03e1b0f6f52a72008d181835d [0,1,0,1,0,0|2,0,0]=4 16983 B17R2.13374 CCC1CCCN1C(=O)c2cnccc2Cl 6952fd3bab08262ad3d83c4060501212 [0,1,0,1,0,0|2,0,0]=4 16984 B17R2.13374 CCC1CCCN1C(=O)c2cnccc2F 2bfc70a3327df6c90d9435d9f9c84c76 [0,1,0,1,0,0|2,0,0]=4 16985 B17R2.13374 CCC1CCCN1C(=O)c2cnccc2O bef24954bedb41df5073f53bd740bebe [0,1,0,1,0,0|2,0,0]=4 16986 B17R2.13374 CCC1CCCN1C(=O)c2ncccc2Br f02a5193210bd740e01a5abf725ddf76 [0,1,0,1,0,0|2,0,0]=4 16987 B17R2.13374 CCC1CCCN1C(=O)c2ncccc2C 1309895f844844463f2b398f75f1adcc [0,1,0,1,0,0|2,0,0]=4 16988 B17R2.13374 CCC1CCCN1C(=O)c2ncccc2Cl f297f97c1299d1e4dc277f2c7a6157d8 [0,1,0,1,0,0|2,0,0]=4 16989 B17R2.13374 CCC1CCCN1C(=O)c2ncccc2F 0980d0691434e8e76b5390c8f1f775ca [0,1,0,1,0,0|2,0,0]=4 16990 B17R2.13374 CCC1CCCN1C(=O)c2ncccc2I 02fada30f059f68aca4cc2974a038ccc [0,1,0,1,0,0|2,0,0]=4 16991 B17R2.13374 CCC1CCCN1C(=O)c2ncccc2O 64969c31c9d93eb368a3654db911a85b [0,1,0,1,0,0|2,0,0]=4 16992 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccc[n+]2[O-] 0664364f9f357a9133b92c5a50f446e6 [0,1,0,1,0,0|2,0,0]=4 16993 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2Br 351c53f44ba169b3306781ae1d2c021d [0,1,0,1,0,0|1,0,0]=3 16994 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2C ceec5a2cd1174e371641122ba0665f0d [0,1,0,1,0,0|1,0,0]=3 16995 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2Cl 15d1e01c805adc548d228ad8c27c4791 [0,1,0,1,0,0|1,0,0]=3 16996 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2F b5a17d58bec1b2dc94b775ad504396c7 [0,1,0,1,0,0|1,0,0]=3 16997 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2I 84481f74381a07807fe86bdbfc2642ca [0,1,0,1,0,0|1,0,0]=3 16998 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2O e45e77a89304d5c0e0861b66439cdb3a [0,1,0,1,0,0|1,0,0]=3 16999 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccccc2S c25a4d495b4f581f2fd628590871d06d [0,1,0,1,0,0|1,0,0]=3 17000 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2Br 2918c4cf88dcaee7970d1a5e499e9f0e [0,1,0,1,0,0|2,0,0]=4 17001 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2C af054719f4f85b2624d3246352c1e206 [0,1,0,1,0,0|2,0,0]=4 17002 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2Cl 87d38aa6dd08fd1e1e9bcc7d529d3c99 [0,1,0,1,0,0|2,0,0]=4 17003 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2F 290b689c21578fac61204f1f0c06f1cd [0,1,0,1,0,0|2,0,0]=4 17004 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2I bd1cebb3ad6acf5c258fcf70557ed545 [0,1,0,1,0,0|2,0,0]=4 17005 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2O 96ad7f376456394a0621d9a2f4cf5ce7 [0,1,0,1,0,0|2,0,0]=4 17006 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cccnc2S 4b2384583772334281944ad75375e8d5 [0,1,0,1,0,0|2,0,0]=4 17007 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccncc2Br c4a02a4b14080e2c65f7d618849d0c49 [0,1,0,1,0,0|2,0,0]=4 17008 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccncc2C b6b12931deb088ce0255afe0744fc6f6 [0,1,0,1,0,0|2,0,0]=4 17009 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccncc2Cl e2be304b5fbea9c2a639e28d76e2a05e [0,1,0,1,0,0|2,0,0]=4 17010 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccncc2F 64de590e84aacc9cdae29ee47c3804ae [0,1,0,1,0,0|2,0,0]=4 17011 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccncc2I 030fcc6116d7d5842e8ac464f9bf72ff [0,1,0,1,0,0|2,0,0]=4 17012 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ccncc2O de2a09fbe33c70de3e1b845e4e150098 [0,1,0,1,0,0|2,0,0]=4 17013 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cnccc2Br 4b4067d8f671648dbb5a721b1e8db7cd [0,1,0,1,0,0|2,0,0]=4 17014 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cnccc2C 0556da6ef054e63ef53002aa7292e019 [0,1,0,1,0,0|2,0,0]=4 17015 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cnccc2Cl 40ffaa1ea66038bf2cfe969366062bff [0,1,0,1,0,0|2,0,0]=4 17016 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cnccc2F 86df450c2c3284f3f64db34d17467b37 [0,1,0,1,0,0|2,0,0]=4 17017 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2cnccc2O 574cad39649c233257f10c730b8756ea [0,1,0,1,0,0|2,0,0]=4 17018 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ncccc2Br d255bfb7e471c9d63a7e4b44a50d437f [0,1,0,1,0,0|2,0,0]=4 17019 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ncccc2C e28252e3617cc1acb35d8b3932d6a7be [0,1,0,1,0,0|2,0,0]=4 17020 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ncccc2Cl ded0abe62fbb2f86f83908dfbc723127 [0,1,0,1,0,0|2,0,0]=4 17021 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ncccc2F 496185f79f5cac66bd9dc7dfea335458 [0,1,0,1,0,0|2,0,0]=4 17022 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ncccc2I c72c5710442bf23ea7261141ad1684cd [0,1,0,1,0,0|2,0,0]=4 17023 B17R2.13374 CC[C@@H]1CCCN1C(=O)c2ncccc2O d120c5593f274e293c9ee008d834da00 [0,1,0,1,0,0|2,0,0]=4 17024 B17R2.13374 COC1CCCN1C(=O)c2ccccc2Br 422dee3dead6a20476921f9a36029305 [0,1,0,1,0,0|2,0,0]=4 17025 B17R2.13374 COC1CCCN1C(=O)c2ccccc2C 278ef6d5c1a84fc61d4b449522520152 [0,1,0,1,0,0|2,0,0]=4 17026 B17R2.13374 COC1CCCN1C(=O)c2ccccc2Cl f60d135a951fc58f3b5ec23093df2fa7 [0,1,0,1,0,0|2,0,0]=4 17027 B17R2.13374 COC1CCCN1C(=O)c2ccccc2F 9a5d5dd4cdf400c7088157641ae50c91 [0,1,0,1,0,0|2,0,0]=4 17028 B17R2.13374 COC1CCCN1C(=O)c2ccccc2I 5a9495a43ad73db32cd88941fc0b8afa [0,1,0,1,0,0|2,0,0]=4 17029 B17R2.13374 COC1CCCN1C(=O)c2ccccc2O 0a63d3d9466b5b8fb0304dd32e66308b [0,1,0,1,0,0|2,0,0]=4 17030 B17R2.13374 COC1CCCN1C(=O)c2ccccc2S e1bea5859d7aeb364147efb43ec1eb0a [0,1,0,1,0,0|2,0,0]=4 17031 B17R2.13374 Cc1ccccc1C(=O)N2CCCC2CO 38f16cc9ca3905a45c013661d4aae43d [0,1,0,1,0,0|2,0,0]=4 17032 B17R2.13374 Cc1ccccc1C(=O)N2CCC[C@@H]2CF 43eb25dea96a06cfde8309f9fe42690b [0,1,0,1,0,0|2,0,0]=4 17033 B17R2.13374 Cc1ccccc1C(=O)N2CCC[C@@H]2CO f8b31c7dde0b4fa8290ab88b404f1ecd [0,1,0,1,0,0|2,0,0]=4 17034 B17R2.13374 Cc1ccccc1C(=O)N2CCC[C@H]2CF e255f42f412c7d8729b1805b11dfb06a [0,1,0,1,0,0|2,0,0]=4 17035 B17R2.13374 Cc1ccccc1C(=O)N2CCC[C@H]2CO 7e59d7595d83aa0e248feff700693cf2 [0,1,0,1,0,0|2,0,0]=4 17036 B17R2.13374 O=C(c1ccccc1Br)N2CCCC2CO 6c513cfbb79adf8ef157a2c4a6c54879 [0,1,0,1,0,0|2,0,0]=4 17037 B17R2.13374 O=C(c1ccccc1Br)N2CCC[C@@H]2CF 1be934af5b0debf1db29e2f6aecd6a5d [0,1,0,1,0,0|2,0,0]=4 17038 B17R2.13374 O=C(c1ccccc1Br)N2CCC[C@@H]2CO 617db6a5454c2eefb3d7db01bea4441d [0,1,0,1,0,0|2,0,0]=4 17039 B17R2.13374 O=C(c1ccccc1Br)N2CCC[C@H]2CF 2861af5d59ef7ede81bb3f7039c7ae9e [0,1,0,1,0,0|2,0,0]=4 17040 B17R2.13374 O=C(c1ccccc1Br)N2CCC[C@H]2CO df38625c52f0e3c7f21f018e4d887db9 [0,1,0,1,0,0|2,0,0]=4 17041 B17R2.13374 O=C(c1ccccc1Cl)N2CCCC2CO c262ca623174edb63fd054a42d342285 [0,1,0,1,0,0|2,0,0]=4 17042 B17R2.13374 O=C(c1ccccc1Cl)N2CCC[C@@H]2CF 41c6efdf7f7161108552bbbbe5a7ff32 [0,1,0,1,0,0|2,0,0]=4 17043 B17R2.13374 O=C(c1ccccc1Cl)N2CCC[C@@H]2CO 71eb8df9bbb3e25111afc1522ee33eac [0,1,0,1,0,0|2,0,0]=4 17044 B17R2.13374 O=C(c1ccccc1Cl)N2CCC[C@H]2CF f29021dd8b55e43fff390b95a3ddb267 [0,1,0,1,0,0|2,0,0]=4 17045 B17R2.13374 O=C(c1ccccc1Cl)N2CCC[C@H]2CO cf463708ec6f27a29dc042d47dee6cbf [0,1,0,1,0,0|2,0,0]=4 17046 B17R2.13374 O=C(c1ccccc1F)N2CCCC2CO 265e9f25f2628e14aeaf0e705f1d7983 [0,1,0,1,0,0|2,0,0]=4 17047 B17R2.13374 O=C(c1ccccc1F)N2CCC[C@@H]2CF f4f54c80fc83c159c57cf306c106cf8d [0,1,0,1,0,0|2,0,0]=4 17048 B17R2.13374 O=C(c1ccccc1F)N2CCC[C@@H]2CO 917971edacc02bf46f693129fa3b2651 [0,1,0,1,0,0|2,0,0]=4 17049 B17R2.13374 O=C(c1ccccc1F)N2CCC[C@H]2CF bc1fe11ce6cb2d55f9ee693622094926 [0,1,0,1,0,0|2,0,0]=4 17050 B17R2.13374 O=C(c1ccccc1F)N2CCC[C@H]2CO bf2cfca5dda2fad8a07e698c6b53b2e5 [0,1,0,1,0,0|2,0,0]=4 17051 B17R2.13374 O=C(c1ccccc1I)N2CCCC2CO 9d6c13089ff3028886b00b7ec84f3510 [0,1,0,1,0,0|2,0,0]=4 17052 B17R2.13374 O=C(c1ccccc1I)N2CCC[C@@H]2CF 77b75e3abd59a701af5d9231ba4b68cc [0,1,0,1,0,0|2,0,0]=4 17053 B17R2.13374 O=C(c1ccccc1I)N2CCC[C@@H]2CO 83ecdf51df1d1b3fb245c1a3532ce6b4 [0,1,0,1,0,0|2,0,0]=4 17054 B17R2.13374 O=C(c1ccccc1I)N2CCC[C@H]2CF faa571775d438aa620ce72edcce219c8 [0,1,0,1,0,0|2,0,0]=4 17055 B17R2.13374 O=C(c1ccccc1I)N2CCC[C@H]2CO fdb82ef6ffcceca73df48c713371ccb5 [0,1,0,1,0,0|2,0,0]=4 17056 B17R2.13374 O=C(c1ccccc1O)N2CCCC2CO e143117f3140833ce0ff931d0db7ae14 [0,1,0,1,0,0|2,0,0]=4 17057 B17R2.13374 O=C(c1ccccc1O)N2CCC[C@@H]2CF 1849c1451ff0127aac5d593868a74554 [0,1,0,1,0,0|2,0,0]=4 17058 B17R2.13374 O=C(c1ccccc1O)N2CCC[C@@H]2CO 6f089ed35d16a8144eb8c17522438247 [0,1,0,1,0,0|2,0,0]=4 17059 B17R2.13374 O=C(c1ccccc1O)N2CCC[C@H]2CF c438a7750c1a4a8ec201e582257dfc21 [0,1,0,1,0,0|2,0,0]=4 17060 B17R2.13374 O=C(c1ccccc1O)N2CCC[C@H]2CO 334f9e272682b71e50a153cf0d93b337 [0,1,0,1,0,0|2,0,0]=4 17061 B17R2.13374 O=C(c1ccccc1S)N2CCCC2CO b2a848b2fa12d7d185a9aeb97dae14c9 [0,1,0,1,0,0|2,0,0]=4 17062 B17R2.13374 O=C(c1ccccc1S)N2CCC[C@@H]2CF 6e37b892f0b240347df2170928bf7708 [0,1,0,1,0,0|2,0,0]=4 17063 B17R2.13374 O=C(c1ccccc1S)N2CCC[C@@H]2CO f98724376657c13dd80d15dc5bb18ca0 [0,1,0,1,0,0|2,0,0]=4 17064 B17R2.13374 O=C(c1ccccc1S)N2CCC[C@H]2CF ce3a85eb916e0ad75d9488f68b74b3c0 [0,1,0,1,0,0|2,0,0]=4 17065 B17R2.13374 O=C(c1ccccc1S)N2CCC[C@H]2CO 2b0690a55a5207bc0b60bb73cda61b88 [0,1,0,1,0,0|2,0,0]=4 17066 B17R2.20511 CC1CCCCN1C(=O)c2cccc[n+]2[O-] a61ebc0eb488b2af712da0f4e21c1c8b [0,1,0,1,0,0|2,0,0]=4 17067 B17R2.20511 CC1CCCCN1C(=O)c2ccccc2Br 9ced678fd34bb89cb49864b975e75a3c [0,1,0,1,0,0|1,0,0]=3 17068 B17R2.20511 CC1CCCCN1C(=O)c2ccccc2Cl 5fbc0dfdb7a57da77a673103ba6a5089 [0,1,0,1,0,0|1,0,0]=3 17069 B17R2.20511 CC1CCCCN1C(=O)c2ccccc2F 2db9c81b3132738c234e0523fb9b46d2 [0,1,0,1,0,0|1,0,0]=3 17070 B17R2.20511 CC1CCCCN1C(=O)c2ccccc2I 6ffa34b0b0f578134092050c6cecc21b [0,1,0,1,0,0|1,0,0]=3 17071 B17R2.20511 CC1CCCCN1C(=O)c2ccccc2O e95c822e63390595d3c691ab0d84ba6d [0,1,0,1,0,0|1,0,0]=3 17072 B17R2.20511 CC1CCCCN1C(=O)c2ccccc2S e26cc9d4f4442e5460f5a71ce885ed32 [0,1,0,1,0,0|1,0,0]=3 17073 B17R2.20511 CC1CCCCN1C(=O)c2cccnc2Br 25c07d77fe7911a1da043a1c0d84db5e [0,1,0,1,0,0|2,0,0]=4 17074 B17R2.20511 CC1CCCCN1C(=O)c2cccnc2Cl 88b936f4d9441961b9c02cca01f99642 [0,1,0,1,0,0|2,0,0]=4 17075 B17R2.20511 CC1CCCCN1C(=O)c2cccnc2F 609201823fd342c76df5dc8b4b6b5e3c [0,1,0,1,0,0|2,0,0]=4 17076 B17R2.20511 CC1CCCCN1C(=O)c2cccnc2I c53064f43c35169a6dbf704eef3d7466 [0,1,0,1,0,0|2,0,0]=4 17077 B17R2.20511 CC1CCCCN1C(=O)c2cccnc2O 23745b79bc79d0101c21a3dbc822dc21 [0,1,0,1,0,0|2,0,0]=4 17078 B17R2.20511 CC1CCCCN1C(=O)c2cccnc2S 90d47950babbee04dca7bd7c864da10f [0,1,0,1,0,0|2,0,0]=4 17079 B17R2.20511 CC1CCCCN1C(=O)c2ccncc2Br abd340b3d5290dccce450b9d04879d94 [0,1,0,1,0,0|2,0,0]=4 17080 B17R2.20511 CC1CCCCN1C(=O)c2ccncc2Cl 8b615704f0da000eeba65478d20d6210 [0,1,0,1,0,0|2,0,0]=4 17081 B17R2.20511 CC1CCCCN1C(=O)c2ccncc2F cbbe269b99ef2733ba4366b0352cc63a [0,1,0,1,0,0|2,0,0]=4 17082 B17R2.20511 CC1CCCCN1C(=O)c2ccncc2I 5e13416ad77a83fb35f66b3e6003c3b7 [0,1,0,1,0,0|2,0,0]=4 17083 B17R2.20511 CC1CCCCN1C(=O)c2ccncc2O 8ce010f1993c8d7e53bf36bb89085b07 [0,1,0,1,0,0|2,0,0]=4 17084 B17R2.20511 CC1CCCCN1C(=O)c2cnccc2Br 52faf93034d714e09b62986b72fa5f6b [0,1,0,1,0,0|2,0,0]=4 17085 B17R2.20511 CC1CCCCN1C(=O)c2cnccc2Cl 203b5dcca492b399a81c2895bb271be6 [0,1,0,1,0,0|2,0,0]=4 17086 B17R2.20511 CC1CCCCN1C(=O)c2cnccc2F e44c6497fa03f12badf2b0b163d83ec3 [0,1,0,1,0,0|2,0,0]=4 17087 B17R2.20511 CC1CCCCN1C(=O)c2cnccc2O d9c5b72767c4b3a9a8dd3ca4614d27e4 [0,1,0,1,0,0|2,0,0]=4 17088 B17R2.20511 CC1CCCCN1C(=O)c2ncccc2Br cb97459c154057c809f5ef190359191d [0,1,0,1,0,0|2,0,0]=4 17089 B17R2.20511 CC1CCCCN1C(=O)c2ncccc2Cl fd42f5a92dee8773e95e368b01189495 [0,1,0,1,0,0|2,0,0]=4 17090 B17R2.20511 CC1CCCCN1C(=O)c2ncccc2F 9f5f39039dc87bd4a6ec95e43687896b [0,1,0,1,0,0|2,0,0]=4 17091 B17R2.20511 CC1CCCCN1C(=O)c2ncccc2I 71b0f0b266eef2eb52543fe646f6c44e [0,1,0,1,0,0|2,0,0]=4 17092 B17R2.20511 CC1CCCCN1C(=O)c2ncccc2O 8f737deef855a50eead1a2175301a44b [0,1,0,1,0,0|2,0,0]=4 17093 B17R2.20511 CC1COCCN1C(=O)c2ccccc2Br 44651a102c3dc76cfeeb3acf15c21424 [0,1,0,1,0,0|2,0,0]=4 17094 B17R2.20511 CC1COCCN1C(=O)c2ccccc2Cl 4a49bf4183d2664e824f6e20b34a3774 [0,1,0,1,0,0|2,0,0]=4 17095 B17R2.20511 CC1COCCN1C(=O)c2ccccc2F eec715047242563d25bf6da3558789aa [0,1,0,1,0,0|2,0,0]=4 17096 B17R2.20511 CC1COCCN1C(=O)c2ccccc2I 480a77912923acda0e7107eb6a480bfd [0,1,0,1,0,0|2,0,0]=4 17097 B17R2.20511 CC1COCCN1C(=O)c2ccccc2S 14f8d923df399e81a794cb8410a44709 [0,1,0,1,0,0|2,0,0]=4 17098 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccc[n+]2[O-] 2895c8981de59715693d10706221c974 [0,1,0,1,0,0|2,0,0]=4 17099 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccccc2Br 12d6f6e529bb339b43206329ab1d0d2a [0,1,0,1,0,0|1,0,0]=3 17100 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccccc2Cl 16ed72f401d6907b1fa49026391bf264 [0,1,0,1,0,0|1,0,0]=3 17101 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccccc2F 7593e5315acfd4c145c04d04a08762d6 [0,1,0,1,0,0|1,0,0]=3 17102 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccccc2I 27063837af9035fad5abead64561b142 [0,1,0,1,0,0|1,0,0]=3 17103 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccccc2O 0cc85e27d7d4a7599f28e42ec81f144c [0,1,0,1,0,0|1,0,0]=3 17104 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccccc2S f0f5371f05120e669b65e95627be006e [0,1,0,1,0,0|1,0,0]=3 17105 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccnc2Br b33bfe1108b635072c1af7a6db827a3c [0,1,0,1,0,0|2,0,0]=4 17106 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccnc2Cl 771488b16436363157a06c021db50738 [0,1,0,1,0,0|2,0,0]=4 17107 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccnc2F c2e49e90c71638318686814776cc455e [0,1,0,1,0,0|2,0,0]=4 17108 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccnc2I 5a178c79a5091ad0a96ef429b9d31e9e [0,1,0,1,0,0|2,0,0]=4 17109 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccnc2O 06d8bbc642b19042a93c74959db6f97e [0,1,0,1,0,0|2,0,0]=4 17110 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cccnc2S ee0f53ea8e52dc829ade21129371d0f3 [0,1,0,1,0,0|2,0,0]=4 17111 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccncc2Br 381f52b9cc28dbe3dd05758a727dbacc [0,1,0,1,0,0|2,0,0]=4 17112 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccncc2Cl 2d9da22da97922833e31dc1079dee154 [0,1,0,1,0,0|2,0,0]=4 17113 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccncc2F d69f01fd258966ffd7bbda0b4373825a [0,1,0,1,0,0|2,0,0]=4 17114 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccncc2I da2231b3d112834042f8257bc57d95b9 [0,1,0,1,0,0|2,0,0]=4 17115 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ccncc2O e97d93568d13691de990a2f33a7bb907 [0,1,0,1,0,0|2,0,0]=4 17116 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cnccc2Br 7c423f2f4efab72bce21096d86eba684 [0,1,0,1,0,0|2,0,0]=4 17117 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cnccc2Cl 53e6d87b9e5cf5875c3baad8601bd267 [0,1,0,1,0,0|2,0,0]=4 17118 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cnccc2F d6aed63255b327bc12a4425d04638f4a [0,1,0,1,0,0|2,0,0]=4 17119 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2cnccc2O 035345feafa1e225194fd70a2ad87bea [0,1,0,1,0,0|2,0,0]=4 17120 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ncccc2Br d06e0c9fc22b25f5550681110cb19d98 [0,1,0,1,0,0|2,0,0]=4 17121 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ncccc2Cl aaa04616f668b93fa7a4a72fce7b407a [0,1,0,1,0,0|2,0,0]=4 17122 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ncccc2F 3fa123eb7629449dd5a6ab9bbd804e9e [0,1,0,1,0,0|2,0,0]=4 17123 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ncccc2I b25b8dda06f0f817224d9c8bc0653103 [0,1,0,1,0,0|2,0,0]=4 17124 B17R2.20511 C[C@@H]1CCCCN1C(=O)c2ncccc2O 15a068556357239958022b3a03eff9e5 [0,1,0,1,0,0|2,0,0]=4 17125 B17R2.20511 C[C@@H]1COCCN1C(=O)c2ccccc2Br 7e272d18cb92bc6872ac2b04c5ef6108 [0,1,0,1,0,0|2,0,0]=4 17126 B17R2.20511 C[C@@H]1COCCN1C(=O)c2ccccc2Cl 1da113950113f35f465a206b8fcbe776 [0,1,0,1,0,0|2,0,0]=4 17127 B17R2.20511 C[C@@H]1COCCN1C(=O)c2ccccc2F 173b48b6324d8e7c07a34cded5cffbf9 [0,1,0,1,0,0|2,0,0]=4 17128 B17R2.20511 C[C@@H]1COCCN1C(=O)c2ccccc2I 664ea36c1892b4f9d65a4ea183b81719 [0,1,0,1,0,0|2,0,0]=4 17129 B17R2.20511 C[C@@H]1COCCN1C(=O)c2ccccc2S f0d101b7cc4914aad962bab1aa47bea0 [0,1,0,1,0,0|2,0,0]=4 17130 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccc[n+]2[O-] f2443ecf089394b07373638f0fffeb46 [0,1,0,1,0,0|2,0,0]=4 17131 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccccc2Br 8f1c853f0d8013e134be458530276a2d [0,1,0,1,0,0|1,0,0]=3 17132 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccccc2Cl 329e7461b7655e946fa2673e8b3e4bb4 [0,1,0,1,0,0|1,0,0]=3 17133 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccccc2F e8d029e16916c110c23b7a0e0b334962 [0,1,0,1,0,0|1,0,0]=3 17134 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccccc2I 429ea3a1917eff66b5f7504e7b7ca979 [0,1,0,1,0,0|1,0,0]=3 17135 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccccc2O 261bb0bc361c11992f9acf9a2519005d [0,1,0,1,0,0|1,0,0]=3 17136 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccccc2S e6ead27e54031efd2fc8b279ffdd52a1 [0,1,0,1,0,0|1,0,0]=3 17137 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccnc2Br 8a813e82242354af75eb5b68fc245a15 [0,1,0,1,0,0|2,0,0]=4 17138 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccnc2Cl 3d5dca4a0dfeaae18227813c27227087 [0,1,0,1,0,0|2,0,0]=4 17139 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccnc2F 52c7ba16373b7ba0135e144c6fbaacbf [0,1,0,1,0,0|2,0,0]=4 17140 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccnc2I ca2f8aa67337da41456609fa7b995519 [0,1,0,1,0,0|2,0,0]=4 17141 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccnc2O 11910613c1939486f524e9b7e61386a2 [0,1,0,1,0,0|2,0,0]=4 17142 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cccnc2S 5df22980035a829c56a8b7130a855715 [0,1,0,1,0,0|2,0,0]=4 17143 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccncc2Br 23838f5ec9a5d4d9849fe4d7280bda15 [0,1,0,1,0,0|2,0,0]=4 17144 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccncc2Cl d6ed5a89c8a12fefa5c26aa3320a7741 [0,1,0,1,0,0|2,0,0]=4 17145 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccncc2F 4f870cd92c4f01bab4781963822df7cc [0,1,0,1,0,0|2,0,0]=4 17146 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccncc2I 594c7660c0847f9f3a083a94c677c2a0 [0,1,0,1,0,0|2,0,0]=4 17147 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ccncc2O afb864483603ead470f27e7e7895ea68 [0,1,0,1,0,0|2,0,0]=4 17148 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cnccc2Br 27b9e85c0e7c827858b515f26a04b7cb [0,1,0,1,0,0|2,0,0]=4 17149 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cnccc2Cl 63734b1df930f3073d4e8eb16e1734cd [0,1,0,1,0,0|2,0,0]=4 17150 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cnccc2F d112319021fe9ec66fb4c8e183ed0791 [0,1,0,1,0,0|2,0,0]=4 17151 B17R2.20511 C[C@H]1CCCCN1C(=O)c2cnccc2O 7dfe83653f8905bed70d21493d0eaa5b [0,1,0,1,0,0|2,0,0]=4 17152 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ncccc2Br 977e2593784c8dc41dbbcd7e4423f173 [0,1,0,1,0,0|2,0,0]=4 17153 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ncccc2Cl db2a50346b84726a7dcdde4c40661fe6 [0,1,0,1,0,0|2,0,0]=4 17154 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ncccc2F 7b62dd240249ac14715e0eede5804787 [0,1,0,1,0,0|2,0,0]=4 17155 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ncccc2I 87dff79d5cb26c8cc7ba81a32c6cecb5 [0,1,0,1,0,0|2,0,0]=4 17156 B17R2.20511 C[C@H]1CCCCN1C(=O)c2ncccc2O 9c1fcc47a66cd8f7a18df62ff891ec96 [0,1,0,1,0,0|2,0,0]=4 17157 B17R2.20511 C[C@H]1COCCN1C(=O)c2ccccc2Br a7d7d6de2168d1a01c68f662a0fb8ed2 [0,1,0,1,0,0|2,0,0]=4 17158 B17R2.20511 C[C@H]1COCCN1C(=O)c2ccccc2Cl f08494ec3cf3467724a64ae09e1f69ee [0,1,0,1,0,0|2,0,0]=4 17159 B17R2.20511 C[C@H]1COCCN1C(=O)c2ccccc2F b33438c5ff6fff701c33ebb1c647d471 [0,1,0,1,0,0|2,0,0]=4 17160 B17R2.20511 C[C@H]1COCCN1C(=O)c2ccccc2I d0175aacc55ef07937faf7b148744472 [0,1,0,1,0,0|2,0,0]=4 17161 B17R2.20511 C[C@H]1COCCN1C(=O)c2ccccc2S dc1b9caf3702cd4c3993d882782e99c3 [0,1,0,1,0,0|2,0,0]=4 17162 B17R2.20511 Cc1ccccc1C(=O)N2CCCCC2C 9dbf11c96fe0b110cbb09d8a3027d30d [0,1,0,1,0,0|1,0,0]=3 17163 B17R2.20511 Cc1ccccc1C(=O)N2CCCC[C@@H]2C cb1cde230a47ef3317de39c8d8d1233a [0,1,0,1,0,0|1,0,0]=3 17164 B17R2.20511 Cc1ccccc1C(=O)N2CCCC[C@H]2C 91f2324f75dc7f818538d5863eca1423 [0,1,0,1,0,0|1,0,0]=3 17165 B17R2.20511 Cc1ccccc1C(=O)N2CCOCC2C de4200cbc71e10a47f20220b7de64d26 [0,1,0,1,0,0|2,0,0]=4 17166 B17R2.20511 Cc1ccccc1C(=O)N2CCOC[C@@H]2C 18991cbcc9cf82f2512b87711721bdc8 [0,1,0,1,0,0|2,0,0]=4 17167 B17R2.20511 Cc1ccccc1C(=O)N2CCOC[C@H]2C b2a9d9d76956fe91d82f24998803f253 [0,1,0,1,0,0|2,0,0]=4 17168 B17R2.20511 Cc1cccnc1C(=O)N2CCCCC2C abb27eadf2e2771c4df429e3a4c47aec [0,1,0,1,0,0|2,0,0]=4 17169 B17R2.20511 Cc1cccnc1C(=O)N2CCCC[C@@H]2C da3633185d123a591e75b293ca414f6f [0,1,0,1,0,0|2,0,0]=4 17170 B17R2.20511 Cc1cccnc1C(=O)N2CCCC[C@H]2C 79774f73aaca0c5b1a77a2c94af1c308 [0,1,0,1,0,0|2,0,0]=4 17171 B17R2.20511 Cc1ccncc1C(=O)N2CCCCC2C 1eef22cd0dfe79373de4375f6f7260cc [0,1,0,1,0,0|2,0,0]=4 17172 B17R2.20511 Cc1ccncc1C(=O)N2CCCC[C@@H]2C 65900e7cdf37d1fe8f598ac2e8b56498 [0,1,0,1,0,0|2,0,0]=4 17173 B17R2.20511 Cc1ccncc1C(=O)N2CCCC[C@H]2C 3ba6bea4c61695fb8c92982832e8c01b [0,1,0,1,0,0|2,0,0]=4 17174 B17R2.20511 Cc1cnccc1C(=O)N2CCCCC2C 2786215b0b740a0baf7e9f3a0d73096d [0,1,0,1,0,0|2,0,0]=4 17175 B17R2.20511 Cc1cnccc1C(=O)N2CCCC[C@@H]2C 7f5df14b0b9ae6edd32502555d488093 [0,1,0,1,0,0|2,0,0]=4 17176 B17R2.20511 Cc1cnccc1C(=O)N2CCCC[C@H]2C e41271636a7197b545e2d7b829c3d3dc [0,1,0,1,0,0|2,0,0]=4 17177 B17R2.20511 Cc1ncccc1C(=O)N2CCCCC2C 51e12729d2f534c05de50016e78541e7 [0,1,0,1,0,0|2,0,0]=4 17178 B17R2.20511 Cc1ncccc1C(=O)N2CCCC[C@@H]2C f11e4d51cc991711ed8ca4fb1324ddef [0,1,0,1,0,0|2,0,0]=4 17179 B17R2.20511 Cc1ncccc1C(=O)N2CCCC[C@H]2C 3469713397af088bf922ba084d65dd0e [0,1,0,1,0,0|2,0,0]=4 17180 B17R2.24377 CN1CCC1CNC(=O)c2ccccc2Br 3abb196d105353bbcec057c4551cce9a [0,1,0,1,0,0|2,0,0]=4 17181 B17R2.24377 CN1CCC1CNC(=O)c2ccccc2Cl 58f31e743953f84ce1fa5b5b37321eee [0,1,0,1,0,0|2,0,0]=4 17182 B17R2.24377 CN1CCC1CNC(=O)c2ccccc2F c68d13accaccad87635bb54d35e3eb11 [0,1,0,1,0,0|2,0,0]=4 17183 B17R2.24377 CN1CCC1CNC(=O)c2ccccc2I 11cdb893ee20fc861a8d43cca962bfea [0,1,0,1,0,0|2,0,0]=4 17184 B17R2.24377 CN1CCC1CNC(=O)c2ccccc2O 43ee53231b703c6214a4d1ebac32b2fa [0,1,0,1,0,0|2,0,0]=4 17185 B17R2.24377 CN1CCC1CNC(=O)c2ccccc2S 552fd3d039ff21e8f428b233b14771cf [0,1,0,1,0,0|2,0,0]=4 17186 B17R2.24377 C[C@@H]1CC[C@@H]1NCC(=O)c2ccccc2Br cab15c6d0b8f87c3a392ac7d0b6f4c91 [0,1,0,1,0,0|2,0,0]=4 17187 B17R2.24377 C[C@@H]1CC[C@@H]1NCC(=O)c2ccccc2Cl 4954cfc2f771289248a69c0ee9c405bf [0,1,0,1,0,0|2,0,0]=4 17188 B17R2.24377 C[C@@H]1CC[C@@H]1NCC(=O)c2ccccc2F 5e801a053a80b599b66c1ae38ba0a55b [0,1,0,1,0,0|2,0,0]=4 17189 B17R2.24377 C[C@@H]1CC[C@@H]1NCC(=O)c2ccccc2I a7e6ccf88bd12570e42a12fb996ce3a1 [0,1,0,1,0,0|2,0,0]=4 17190 B17R2.24377 C[C@@H]1CC[C@H]1NCC(=O)c2ccccc2Br 023aefbdba6214650572a2f3e123a38a [0,1,0,1,0,0|2,0,0]=4 17191 B17R2.24377 C[C@@H]1CC[C@H]1NCC(=O)c2ccccc2Cl 255649ea3febe52547637616f780b8ce [0,1,0,1,0,0|2,0,0]=4 17192 B17R2.24377 C[C@@H]1CC[C@H]1NCC(=O)c2ccccc2F 533c965d40392aab16cba61754b5a9da [0,1,0,1,0,0|2,0,0]=4 17193 B17R2.24377 C[C@@H]1CC[C@H]1NCC(=O)c2ccccc2I b035137a05a3f8a56d16499b7877a984 [0,1,0,1,0,0|2,0,0]=4 17194 B17R2.24377 Cc1ccccc1C(=O)CN[C@@H]2CC[C@H]2C 56c87b5f4586c7b9ed536c251fdeb4da [0,1,0,1,0,0|2,0,0]=4 17195 B17R2.24377 Cc1ccccc1C(=O)CN[C@H]2CC[C@H]2C fb41bad1280292e77cd1222fddce3ca1 [0,1,0,1,0,0|2,0,0]=4 17196 B17R2.24377 Cc1ccccc1C(=O)NCC2CCN2C 17d77d70f8cfaf8acf67698f68dae8de [0,1,0,1,0,0|2,0,0]=4 17197 B17R2.28161 COCC1CCN1C(=O)c2ccccc2Br 6ae99144fd46eccf546b77eb8f95bf69 [0,1,0,1,0,0|2,0,0]=4 17198 B17R2.28161 COCC1CCN1C(=O)c2ccccc2C f66f91234b6765f7d0c2ffdf3506941e [0,1,0,1,0,0|2,0,0]=4 17199 B17R2.28161 COCC1CCN1C(=O)c2ccccc2Cl d6cca8402c9234e51623b66bb9d0dfd8 [0,1,0,1,0,0|2,0,0]=4 17200 B17R2.28161 COCC1CCN1C(=O)c2ccccc2F 08b953e7fb1c8f999f5bed54c05a593d [0,1,0,1,0,0|2,0,0]=4 17201 B17R2.28161 COCC1CCN1C(=O)c2ccccc2I d865834cab10069fdd7da61eef847227 [0,1,0,1,0,0|2,0,0]=4 17202 B17R2.28161 COCC1CCN1C(=O)c2ccccc2O b5f774de7d30d75a44e61eaf33e23440 [0,1,0,1,0,0|2,0,0]=4 17203 B17R2.28161 COCC1CCN1C(=O)c2ccccc2S 9531d1e2740cb925df552c9bfab9d0ff [0,1,0,1,0,0|2,0,0]=4 17204 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2Br 8e42ac108a5359bec99256826a630376 [0,1,0,1,0,0|2,0,0]=4 17205 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2C 9c11290d40ac8f0293c1bd05c989772f [0,1,0,1,0,0|2,0,0]=4 17206 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2Cl d936a9480fb4a72f6b4a47e04d3cf5a5 [0,1,0,1,0,0|2,0,0]=4 17207 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2F d467966efa947eb65d2d62f81553c926 [0,1,0,1,0,0|2,0,0]=4 17208 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2I 002f0c0890e2407b17425e6b043edc76 [0,1,0,1,0,0|2,0,0]=4 17209 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2O 3a2311b560b2fae9f23d126613c568e1 [0,1,0,1,0,0|2,0,0]=4 17210 B17R2.28161 COC[C@@H]1CCN1C(=O)c2ccccc2S e9cce6ba9501a30681be5f83c47c70cb [0,1,0,1,0,0|2,0,0]=4 17211 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2Br 486cedb10a1fc62dd8f6533eaa220cb7 [0,1,0,1,0,0|2,0,0]=4 17212 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2C 805000ebcc72ec98c144cc77eb9fcac0 [0,1,0,1,0,0|2,0,0]=4 17213 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2Cl b345d5fe0bca6dabb9dcc2a7ce851b8b [0,1,0,1,0,0|2,0,0]=4 17214 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2F 339ce4e41fc8254a18bfbee2bb401f69 [0,1,0,1,0,0|2,0,0]=4 17215 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2I 80730b76e154974681a2e951e91a5201 [0,1,0,1,0,0|2,0,0]=4 17216 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2O bcd813340843798101fd9ad35d405b46 [0,1,0,1,0,0|2,0,0]=4 17217 B17R2.28161 COC[C@H]1CCN1C(=O)c2ccccc2S 41fedbcf25e055383c12c001d481ec61 [0,1,0,1,0,0|2,0,0]=4 17218 B17R2.28161 Cc1ccccc1C(=O)N2CCC2CCO a31e05935959407eee7c11a277358242 [0,1,0,1,0,0|2,0,0]=4 17219 B17R2.28161 O=C(c1ccccc1Br)N2CCC2CCO 384a34aac4c86fecc7c441d00716874b [0,1,0,1,0,0|2,0,0]=4 17220 B17R2.28161 O=C(c1ccccc1Cl)N2CCC2CCO da448acfcf82f6e12075059c8cdaa23f [0,1,0,1,0,0|2,0,0]=4 17221 B17R2.28161 O=C(c1ccccc1F)N2CCC2CCO 907d047ff3d67ec1abf688ab27710011 [0,1,0,1,0,0|2,0,0]=4 17222 B17R2.28161 O=C(c1ccccc1I)N2CCC2CCO 109630a19fb85d42e7d216a70466c572 [0,1,0,1,0,0|2,0,0]=4 17223 B17R2.28161 O=C(c1ccccc1O)N2CCC2CCO f4657ae3f97c416f1b4db5404680975d [0,1,0,1,0,0|2,0,0]=4 17224 B17R2.28161 O=C(c1ccccc1S)N2CCC2CCO 0cfd127a2e1eae7542ad0497970978ab [0,1,0,1,0,0|2,0,0]=4 17225 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2Br 0c6494592cfdc0cab55576b8fc804c31 [0,1,0,1,0,0|2,0,0]=4 17226 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2C 1d640ae216450963556b7ee528ac6803 [0,1,0,1,0,0|2,0,0]=4 17227 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2Cl f08ad7703f953d187db95674efbeac17 [0,1,0,1,0,0|2,0,0]=4 17228 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2F 1e87b6718b5ed81ccaf3e3577f327e7a [0,1,0,1,0,0|2,0,0]=4 17229 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2I 467181e623ea9c6318611b0aac2b185a [0,1,0,1,0,0|2,0,0]=4 17230 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2O 1cb1c049a343878c116d55a22580933e [0,1,0,1,0,0|2,0,0]=4 17231 B17R2.33653 COC[C@@H]1C[C@@H]1NC(=O)c2ccccc2S 8d6fb71d108200115b70f3a0ee60a558 [0,1,0,1,0,0|2,0,0]=4 17232 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2Br 70471f44c10ae22aef733a6e40082df7 [0,1,0,1,0,0|2,0,0]=4 17233 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2C 4246fa0cdcbd3f93b58169e2ca8eed47 [0,1,0,1,0,0|2,0,0]=4 17234 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2Cl e1b6148a26747a5ade07ee29b94d699c [0,1,0,1,0,0|2,0,0]=4 17235 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2F 39636b8aaa7ec319caf0ac777cd52a96 [0,1,0,1,0,0|2,0,0]=4 17236 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2I bf08557b74c4707c8a8a3b2d99aed7d2 [0,1,0,1,0,0|2,0,0]=4 17237 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2O 74445f1af37eace1c46e1ef4cbf3eea0 [0,1,0,1,0,0|2,0,0]=4 17238 B17R2.33653 COC[C@H]1C[C@@H]1NC(=O)c2ccccc2S f60a0b3c2393aed2929586e4ea80eab7 [0,1,0,1,0,0|2,0,0]=4 17239 B17R2.37118 CC(OC1CCCC1C)c2ccccc2Cl a940db5c2165ec6a09dba4f8996506cc [0,1,0,1,0,0|1,0,1]=4 17240 B17R2.37118 CC(O[C@@H]1CCC[C@@H]1C)c2ccccc2Cl 4a79e441ff223f4e0897216f887fc51e [0,1,0,1,0,0|1,0,1]=4 17241 B17R2.37118 CC(O[C@@H]1CCC[C@H]1C)c2ccccc2Cl abfe14888fd103bd55fe6badb064ef96 [0,1,0,1,0,0|1,0,1]=4 17242 B17R2.37118 CC(O[C@H]1CCC[C@@H]1C)c2ccccc2Cl 61d86bdf7d1c9656f9a623915c39c6ea [0,1,0,1,0,0|1,0,1]=4 17243 B17R2.37118 CC(O[C@H]1CCC[C@H]1C)c2ccccc2Cl 7a3b9056c8fb2296af74cf64b20560a4 [0,1,0,1,0,0|1,0,1]=4 17244 B17R2.37118 CC1CCCN1CC(=O)c2ccccc2Cl cbf42e7d1595f8348397432a45b88ca5 [0,1,0,1,0,0|2,0,0]=4 17245 B17R2.37118 CC1CCCN1CC(=O)c2ccccc2F c86b3ad4db25be2a52fcf5cbfa2ccce7 [0,1,0,1,0,0|2,0,0]=4 17246 B17R2.37118 CC1CCCN1CC(=O)c2ccccc2I cde4de3004c736f4b097f4e36d2f9af6 [0,1,0,1,0,0|2,0,0]=4 17247 B17R2.37118 C[C@@H]1CCCN1CC(=O)c2ccccc2Cl 4e6680a365208cd84cee43f117372504 [0,1,0,1,0,0|2,0,0]=4 17248 B17R2.37118 C[C@@H]1CCCN1CC(=O)c2ccccc2F 4172e366d316a721f104056cca90a5c3 [0,1,0,1,0,0|2,0,0]=4 17249 B17R2.37118 C[C@@H]1CCCN1CC(=O)c2ccccc2I 90c3edc64fcfb3e40b497b1fb68d0a7f [0,1,0,1,0,0|2,0,0]=4 17250 B17R2.37118 C[C@H]1CCCN1CC(=O)c2ccccc2Cl 9e1a0a027faa120ef268874577dc6a90 [0,1,0,1,0,0|2,0,0]=4 17251 B17R2.37118 C[C@H]1CCCN1CC(=O)c2ccccc2F 454e04dada95d49b965becc692235fdc [0,1,0,1,0,0|2,0,0]=4 17252 B17R2.37118 C[C@H]1CCCN1CC(=O)c2ccccc2I 909114db555156133bab9e02039ddc42 [0,1,0,1,0,0|2,0,0]=4 17253 B17R2.37118 Cc1ccccc1C(=O)CN2CCCC2C 89526e95f69f1c0c85e4c12e8466a34b [0,1,0,1,0,0|2,0,0]=4 17254 B17R2.37118 Cc1ccccc1C(=O)CN2CCC[C@@H]2C 6ccd5e247af7c75da639173329370c0c [0,1,0,1,0,0|2,0,0]=4 17255 B17R2.37118 Cc1ccccc1C(=O)CN2CCC[C@H]2C 2db0f4c4bfe4280cbead77ad6ac5b3fc [0,1,0,1,0,0|2,0,0]=4 17256 B17R2.37118 O=C(NC1CCCC1O)c2ccccc2Br 6ad81caac799323941f1e477d96284e3 [0,1,0,1,0,0|2,0,0]=4 17257 B17R2.37118 O=C(NC1CCCC1O)c2ccccc2F e4d117a60117629bc1e880651bb3970c [0,1,0,1,0,0|2,0,0]=4 17258 B17R2.37118 O=C(NC1CCCC1O)c2ccccc2I 5ef5600685cff1f45130a80897849ff0 [0,1,0,1,0,0|2,0,0]=4 17259 B17R2.37118 O=C(NC1CCCC1O)c2ccccc2S 259b4124dc67e7cfc8dfe642d43a0499 [0,1,0,1,0,0|2,0,0]=4 17260 B17R2.37118 O=C(N[C@@H]1CCC[C@@H]1O)c2ccccc2Br 867b3d087a68efecc32eac3a9ff1beb2 [0,1,0,1,0,0|2,0,0]=4 17261 B17R2.37118 O=C(N[C@@H]1CCC[C@@H]1O)c2ccccc2F d2fe412c8493745170bf748134b9828b [0,1,0,1,0,0|2,0,0]=4 17262 B17R2.37118 O=C(N[C@@H]1CCC[C@@H]1O)c2ccccc2I 135022057bbd0ecb60d39f862a95c9ba [0,1,0,1,0,0|2,0,0]=4 17263 B17R2.37118 O=C(N[C@@H]1CCC[C@@H]1O)c2ccccc2S 2c6b246dd9a5a526e6a21f906d6a6d1b [0,1,0,1,0,0|2,0,0]=4 17264 B17R2.37118 O=C(N[C@@H]1CCC[C@H]1O)c2ccccc2Br 791872ce145ab86f8b40afe471ba6d20 [0,1,0,1,0,0|2,0,0]=4 17265 B17R2.37118 O=C(N[C@@H]1CCC[C@H]1O)c2ccccc2F f3c4ec9f2f8ca3c9a5d87f97ce17e4a3 [0,1,0,1,0,0|2,0,0]=4 17266 B17R2.37118 O=C(N[C@@H]1CCC[C@H]1O)c2ccccc2I 85d9c98d5051e406d7fc2b3fa0b2df5b [0,1,0,1,0,0|2,0,0]=4 17267 B17R2.37118 O=C(N[C@@H]1CCC[C@H]1O)c2ccccc2S 30f0e91274a3ab059e4fd4335deccace [0,1,0,1,0,0|2,0,0]=4 17268 B17R2.37118 O=C(N[C@H]1CCC[C@@H]1O)c2ccccc2Br 1f3df68d349c1db0949d4982f85ad008 [0,1,0,1,0,0|2,0,0]=4 17269 B17R2.37118 O=C(N[C@H]1CCC[C@@H]1O)c2ccccc2F 8fb321cb29b8460f545f7c07b00e20b8 [0,1,0,1,0,0|2,0,0]=4 17270 B17R2.37118 O=C(N[C@H]1CCC[C@@H]1O)c2ccccc2I d961c2aacd7dbaf4257427eebcf41e4a [0,1,0,1,0,0|2,0,0]=4 17271 B17R2.37118 O=C(N[C@H]1CCC[C@@H]1O)c2ccccc2S 0247f478be9596a3876f5a66ce7ec099 [0,1,0,1,0,0|2,0,0]=4 17272 B17R2.37118 O=C(N[C@H]1CCC[C@H]1O)c2ccccc2Br c507d0fd1bc2784d4526158b2ea30b1a [0,1,0,1,0,0|2,0,0]=4 17273 B17R2.37118 O=C(N[C@H]1CCC[C@H]1O)c2ccccc2F 734a91c72f682d4062907b97f5f02943 [0,1,0,1,0,0|2,0,0]=4 17274 B17R2.37118 O=C(N[C@H]1CCC[C@H]1O)c2ccccc2I 512715151e6516e237ab2d84ade71dc8 [0,1,0,1,0,0|2,0,0]=4 17275 B17R2.37118 O=C(N[C@H]1CCC[C@H]1O)c2ccccc2S feabed6d5395515f501e9bdc5264ca4e [0,1,0,1,0,0|2,0,0]=4 17276 B17R2.37133 CC1CC1COCC(=O)c2ccccc2Br 5002d470058cb96ef7dbc46bf35567f3 [0,1,0,1,0,0|2,0,0]=4 17277 B17R2.37133 CC1CC1COCC(=O)c2ccccc2Cl 93426d6bbfce0d481408e5c22afc32bb [0,1,0,1,0,0|2,0,0]=4 17278 B17R2.37133 CC1CC1COCC(=O)c2ccccc2F 7a0211b2c1ca76200246335cb588f6e3 [0,1,0,1,0,0|2,0,0]=4 17279 B17R2.37133 CC1CC1COCC(=O)c2ccccc2I f4f28fb59e38ce599cb67e54b505fbd9 [0,1,0,1,0,0|2,0,0]=4 17280 B17R2.37133 CC1CC1NCCC(=O)c2ccccc2F c761f1c8b32b115d00b13a432705647c [0,1,0,1,0,0|2,0,0]=4 17281 B17R2.37133 C[C@@H]1C[C@H]1COCC(=O)c2ccccc2Br fa6c566e3b66f9250700194def1067e1 [0,1,0,1,0,0|2,0,0]=4 17282 B17R2.37133 C[C@@H]1C[C@H]1COCC(=O)c2ccccc2Cl 9bc0e265fbecddec80c0bb223d9f2cbc [0,1,0,1,0,0|2,0,0]=4 17283 B17R2.37133 C[C@@H]1C[C@H]1COCC(=O)c2ccccc2F 0b7773ae20715ca9791698711b7eeb26 [0,1,0,1,0,0|2,0,0]=4 17284 B17R2.37133 C[C@@H]1C[C@H]1COCC(=O)c2ccccc2I 1177ccb025c4bda61ab41778030833bc [0,1,0,1,0,0|2,0,0]=4 17285 B17R2.37133 C[C@H]1C[C@@H]1COCC(=O)c2ccccc2Br 54fed59bdb8877c6d5012553c0ff483a [0,1,0,1,0,0|2,0,0]=4 17286 B17R2.37133 C[C@H]1C[C@@H]1COCC(=O)c2ccccc2Cl 422e216aceff5f97968955cc14634987 [0,1,0,1,0,0|2,0,0]=4 17287 B17R2.37133 C[C@H]1C[C@@H]1COCC(=O)c2ccccc2F 39e12c68ef09edff161c886f80d2b937 [0,1,0,1,0,0|2,0,0]=4 17288 B17R2.37133 C[C@H]1C[C@@H]1COCC(=O)c2ccccc2I b1eb7abccfd7b26ed723cd8a60204f17 [0,1,0,1,0,0|2,0,0]=4 17289 B17R2.37133 C[C@H]1C[C@H]1COCC(=O)c2ccccc2Br 9907e247db86b6c74a3dd3af7bf8f814 [0,1,0,1,0,0|2,0,0]=4 17290 B17R2.37133 C[C@H]1C[C@H]1COCC(=O)c2ccccc2Cl a3555746db68be6cd2af4ba5cf59a59a [0,1,0,1,0,0|2,0,0]=4 17291 B17R2.37133 C[C@H]1C[C@H]1COCC(=O)c2ccccc2F aa84cb01c0b1c9615ab5cf79ba2677ae [0,1,0,1,0,0|2,0,0]=4 17292 B17R2.37133 C[C@H]1C[C@H]1COCC(=O)c2ccccc2I 7b4d0e3b3c20aebfb82b7b854e5bf754 [0,1,0,1,0,0|2,0,0]=4 17293 B17R2.37133 Cc1ccccc1C(=O)COCC2CC2C 51e499200fb625b58edd2cd40194559b [0,1,0,1,0,0|2,0,0]=4 17294 B17R2.37133 Cc1ccccc1C(=O)COC[C@@H]2C[C@@H]2C 593c442eecc33ce03bf28bf389412a77 [0,1,0,1,0,0|2,0,0]=4 17295 B17R2.37133 Cc1ccccc1C(=O)COC[C@@H]2C[C@H]2C 352874dbd343e2ae69d6b5934d6184ab [0,1,0,1,0,0|2,0,0]=4 17296 B17R2.37133 Cc1ccccc1C(=O)COC[C@H]2C[C@@H]2C 97804a815cc349ff2ba4d52ccf55c4a3 [0,1,0,1,0,0|2,0,0]=4 17297 B17R2.56128 CCCCN1CCC(=O)c2c1cccc2C 0894087452312603dec5432896700e68 [0,1,0,1,0,0|2,0,0]=4 17298 B17R2.56128 CCCCN1CCC(=O)c2c1cccc2Cl 31582e8f494fd5bab3caf24addf5cfb0 [0,1,0,1,0,0|2,0,0]=4 17299 B17R2.56128 CCCCN1CCC(=O)c2c1cccc2F feeb9d698a8412e3c3a83f575ce0622b [0,1,0,1,0,0|2,0,0]=4 17300 B17R2.61775 Cc1ccccc1C(=O)NCC2CC2CO 9ddb3541ac0ff5661c69c1c44d4f6b04 [0,1,0,1,0,0|2,0,0]=4 17301 B17R2.61775 O=C(NCC1CC1CO)c2ccccc2Br a3f54e2d65735ddb8f6bede116ed40d7 [0,1,0,1,0,0|2,0,0]=4 17302 B17R2.61775 O=C(NCC1CC1CO)c2ccccc2Cl 94537d39269cf4d3e000708907bff0d4 [0,1,0,1,0,0|2,0,0]=4 17303 B17R2.61775 O=C(NCC1CC1CO)c2ccccc2F 69f5b66ab5f5a935caa450b92c95d94d [0,1,0,1,0,0|2,0,0]=4 17304 B17R2.61775 O=C(NCC1CC1CO)c2ccccc2I 179a30f27eeff512fa087e51aeb6c353 [0,1,0,1,0,0|2,0,0]=4 17305 B17R2.61775 O=C(NCC1CC1CO)c2ccccc2O 3381ff689d6e54c3ba75a4b9fd09c447 [0,1,0,1,0,0|2,0,0]=4 17306 B17R2.61775 O=C(NCC1CC1CO)c2ccccc2S a38bfec531c7742db445b187527864d1 [0,1,0,1,0,0|2,0,0]=4 17307 B17R2.71591 CCC1CCN1CC(=O)c2ccccc2Br 9c027a5ca3c6460fc99ef3f6eda91456 [0,1,0,1,0,0|2,0,0]=4 17308 B17R2.71591 CCC1CCN1CC(=O)c2ccccc2C 55773219bd51aece1b294bcb448dc707 [0,1,0,1,0,0|2,0,0]=4 17309 B17R2.71591 CCC1CCN1CC(=O)c2ccccc2Cl 26f7a7bfe6435898ebc7068a6af0b86a [0,1,0,1,0,0|2,0,0]=4 17310 B17R2.71591 CCC1CCN1CC(=O)c2ccccc2F 6d6be27e3a8cecc0c491cca374771c91 [0,1,0,1,0,0|2,0,0]=4 17311 B17R2.71591 CCC1CCN1CC(=O)c2ccccc2I eb9bc4cffa8b94092afdcec1b4e90bd0 [0,1,0,1,0,0|2,0,0]=4 17312 B17R2.71591 COC1CCC1NC(=O)c2ccccc2Br 729738d0978b13bbc7864d84b7de8766 [0,1,0,1,0,0|2,0,0]=4 17313 B17R2.71591 COC1CCC1NC(=O)c2ccccc2C d4c385c0a4f4788f5fe81c449e3eed92 [0,1,0,1,0,0|2,0,0]=4 17314 B17R2.71591 COC1CCC1NC(=O)c2ccccc2Cl 4a7e2dbc6e64793362cb5043ecc0e0b3 [0,1,0,1,0,0|2,0,0]=4 17315 B17R2.71591 COC1CCC1NC(=O)c2ccccc2F 08c09df6a6b89881d2074f065766cbc6 [0,1,0,1,0,0|2,0,0]=4 17316 B17R2.71591 COC1CCC1NC(=O)c2ccccc2I bcdfaf56b0ce03c8c916f9161626f980 [0,1,0,1,0,0|2,0,0]=4 17317 B17R2.71591 COC1CCC1NC(=O)c2ccccc2O 85c022702cc742e69818fc466d2f7a48 [0,1,0,1,0,0|2,0,0]=4 17318 B17R2.71591 COC1CCC1NC(=O)c2ccccc2S 809f17d20dc0cf69152a86beeca8896f [0,1,0,1,0,0|2,0,0]=4 17319 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2Br 3bddfadb143fc5d82a0c858869208202 [0,1,0,1,0,0|2,0,0]=4 17320 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2C c61b4ba8a8cab9965f602fd05cacefb4 [0,1,0,1,0,0|2,0,0]=4 17321 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2Cl a4b970413345e2872adf5983d834f496 [0,1,0,1,0,0|2,0,0]=4 17322 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2F cc4abf101223848ab8bee7bdb7e5d19c [0,1,0,1,0,0|2,0,0]=4 17323 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2I 384ac4a83e9cca952b02a731803b1fb1 [0,1,0,1,0,0|2,0,0]=4 17324 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2O 2ea01381b1feaf3e247b05711160d9e8 [0,1,0,1,0,0|2,0,0]=4 17325 B17R2.71591 CO[C@@H]1CC[C@@H]1NC(=O)c2ccccc2S 2e99c2796ef271dfaff473bc67c4427d [0,1,0,1,0,0|2,0,0]=4 17326 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2Br f586cf526aeecd472ebd9c7f2d80dd66 [0,1,0,1,0,0|2,0,0]=4 17327 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2C e4ef016d9af517abc809380401a95cc2 [0,1,0,1,0,0|2,0,0]=4 17328 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2Cl cf44301ad57820d88ec2c23ea51ceaf8 [0,1,0,1,0,0|2,0,0]=4 17329 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2F e4788aa2d5eb45a9c8114e50305e4a20 [0,1,0,1,0,0|2,0,0]=4 17330 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2I 036711a240d2a8cfcf8bc953474631e8 [0,1,0,1,0,0|2,0,0]=4 17331 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2O 50e78451dcdcabb758480786ad615bc7 [0,1,0,1,0,0|2,0,0]=4 17332 B17R2.71591 CO[C@@H]1CC[C@H]1NC(=O)c2ccccc2S 911cd0af2fcf957a10723950dfd929b3 [0,1,0,1,0,0|2,0,0]=4 17333 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2Br 4824487bfbfae6f6ecbdda941bb9bec5 [0,1,0,1,0,0|2,0,0]=4 17334 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2C 1a73f7db2540249d5c9bf5809ddb7248 [0,1,0,1,0,0|2,0,0]=4 17335 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2Cl 5d882fa7742566c6015a6b391f187e1e [0,1,0,1,0,0|2,0,0]=4 17336 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2F c731cd07b0dc256d99219bbec8671f5d [0,1,0,1,0,0|2,0,0]=4 17337 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2I c572c3a518308f0f93a61a2a1271d4a0 [0,1,0,1,0,0|2,0,0]=4 17338 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2O 563ca1a265a5373e08a7d19cffeca2b3 [0,1,0,1,0,0|2,0,0]=4 17339 B17R2.71591 CO[C@H]1CC[C@@H]1NC(=O)c2ccccc2S 82acbe6f1e7a7144bb1f59e2346762c5 [0,1,0,1,0,0|2,0,0]=4 17340 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2Br a59f53b93faa19f0d6db39143c2b4aba [0,1,0,1,0,0|2,0,0]=4 17341 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2C 560bb89d70294954da3f7069182b327e [0,1,0,1,0,0|2,0,0]=4 17342 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2Cl 95d36a2f2bb258d032855150bb03f39e [0,1,0,1,0,0|2,0,0]=4 17343 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2F 4e1afd3ef8c8bed67fed1f19bc361192 [0,1,0,1,0,0|2,0,0]=4 17344 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2I e3f99b627521c58012d246b2e2d4c9da [0,1,0,1,0,0|2,0,0]=4 17345 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2O a5f6a2fcfcaa30d8adadfd610fcfa7a6 [0,1,0,1,0,0|2,0,0]=4 17346 B17R2.71591 CO[C@H]1CC[C@H]1NC(=O)c2ccccc2S 90d8c88c977c06718338f355b8916201 [0,1,0,1,0,0|2,0,0]=4 17347 B17R2.251941 Cc1ccccc1C(=O)CNCCC2CC2 a64defb484ff801330dd445221c729f4 [0,1,0,1,0,0|2,0,0]=4 17348 B17R2.251941 Cc1ccccc1C(=O)COCCC2CC2 7571b86a8a8e09a1907dddd67e551c24 [0,1,0,1,0,0|2,0,0]=4 17349 B17R2.251941 Cc1ccccc1C(=O)NCCOC2CC2 9bb393ee9cea03c600f95013429d10df [0,1,0,1,0,0|2,0,0]=4 17350 B17R2.251941 O=C(CCCNC1CC1)c2ccccc2F 175b1d6964ba920eeb11648e032330a3 [0,1,0,1,0,0|2,0,0]=4 17351 B17R2.251941 O=C(CCCOC1CC1)c2ccccc2F 129f9d048adeee3fbdf9a44597d52744 [0,1,0,1,0,0|2,0,0]=4 17352 B17R2.251941 O=C(CCNCC1CC1)c2ccccc2F 9907d5e68a9bc2662d53faf46ef00304 [0,1,0,1,0,0|2,0,0]=4 17353 B17R2.251941 O=C(CNCCC1CC1)c2ccccc2Br 3a4ae311f717a28ea27a4a9ce6d0fa1f [0,1,0,1,0,0|2,0,0]=4 17354 B17R2.251941 O=C(CNCCC1CC1)c2ccccc2Cl 0429a47f25baee11a7b0c4c6f017c5c2 [0,1,0,1,0,0|2,0,0]=4 17355 B17R2.251941 O=C(CNCCC1CC1)c2ccccc2F c8fca2d7a73ef8224d7c7bc6457b1983 [0,1,0,1,0,0|2,0,0]=4 17356 B17R2.251941 O=C(CNCCC1CC1)c2ccccc2I 406a990d8981e44951efc6bebe8cb58c [0,1,0,1,0,0|2,0,0]=4 17357 B17R2.251941 O=C(COCCC1CC1)c2ccccc2Br 0fe09fdc17e59c2d0c496a04eedc51a8 [0,1,0,1,0,0|2,0,0]=4 17358 B17R2.251941 O=C(COCCC1CC1)c2ccccc2Cl bbae882e93fd5da22600f2ac517201ff [0,1,0,1,0,0|2,0,0]=4 17359 B17R2.251941 O=C(COCCC1CC1)c2ccccc2F b1a300e7ff2243497b0284ba47309db6 [0,1,0,1,0,0|2,0,0]=4 17360 B17R2.251941 O=C(COCCC1CC1)c2ccccc2I 2d434338fff6dcff6262b1103557cb43 [0,1,0,1,0,0|2,0,0]=4 17361 B17R2.251941 O=C(NCCOC1CC1)c2ccccc2Br 70c6f1d55db9353df6a0304b70164991 [0,1,0,1,0,0|2,0,0]=4 17362 B17R2.251941 O=C(NCCOC1CC1)c2ccccc2Cl 0a962a529994513be9be90cc67cf151d [0,1,0,1,0,0|2,0,0]=4 17363 B17R2.251941 O=C(NCCOC1CC1)c2ccccc2F 2b7ccaa144e33776fe360f9ba11d2a19 [0,1,0,1,0,0|2,0,0]=4 17364 B17R2.251941 O=C(NCCOC1CC1)c2ccccc2I 64d568527e32abb4d1949e6cbf050ecd [0,1,0,1,0,0|2,0,0]=4 17365 B17R2.251941 O=C(NCCOC1CC1)c2ccccc2O 26b134f7d6166a7c2b5f91ffffaa8dd3 [0,1,0,1,0,0|2,0,0]=4 17366 B17R2.251941 O=C(NCCOC1CC1)c2ccccc2S 1b9e0d285fe6ff5c4328eb801f70c1ea [0,1,0,1,0,0|2,0,0]=4 17367 B17R2.251954 CC(OCCC1CCC1)c2ccccc2Cl 47f032e847f288b68e7e96f0ed650f38 [0,1,0,1,0,0|1,0,1]=4 17368 B17R2.251954 CC(OCCC1CCC1)c2ccccc2I 3a95ba577a02ebe186eb209e75a8e318 [0,1,0,1,0,0|1,0,1]=4 17369 B17R2.251954 C[C@@H](OCCC1CCC1)c2ccccc2Cl eb672230c706350f767d7e56e5ea23b8 [0,1,0,1,0,0|1,0,1]=4 17370 B17R2.251954 C[C@H](OCCC1CCC1)c2ccccc2Cl edb4ac693921a44ac1f9f2382e1e12b7 [0,1,0,1,0,0|1,0,1]=4 17371 B17R2.251954 Cc1ccccc1C(=O)CNCC2CCC2 1287bdb7f676b3ddf4f85afedc5d8f98 [0,1,0,1,0,0|2,0,0]=4 17372 B17R2.251954 Cc1ccccc1C(=O)COCC2CCC2 6f9c3a3f2aca3031b1c9957c9d55ebb0 [0,1,0,1,0,0|2,0,0]=4 17373 B17R2.251954 Cc1ccccc1C(=O)NCCC2CCC2 b0dbb5d1bae90207f276fada334702c7 [0,1,0,1,0,0|1,0,0]=3 17374 B17R2.251954 Cc1ccccc1C(=O)NCCC2CCO2 3f9db2f4e7f43b73ff9023ea59349729 [0,1,0,1,0,0|2,0,0]=4 17375 B17R2.251954 Cc1ccccc1C(=O)NCCC2COC2 2e4eee0dd15735ffe355c60bde6b91fa [0,1,0,1,0,0|2,0,0]=4 17376 B17R2.251954 Cc1ccccc1C(=O)NCCN2CCC2 b50b7d0c2e96fa38dbd177b2db72e969 [0,1,0,1,0,0|2,0,0]=4 17377 B17R2.251954 Cc1ccccc1C(=O)NCC[C@@H]2CCO2 4359c06b6297e781a58b9a8fb5096ccc [0,1,0,1,0,0|2,0,0]=4 17378 B17R2.251954 Cc1cccnc1C(=O)NCCC2CCC2 15f3d293095be21377bb920de8fca9dd [0,1,0,1,0,0|2,0,0]=4 17379 B17R2.251954 Cc1ccncc1C(=O)NCCC2CCC2 b6677dcd38d1b5b7a25a680259dee9d9 [0,1,0,1,0,0|2,0,0]=4 17380 B17R2.251954 Cc1cnccc1C(=O)NCCC2CCC2 91f5f7af2e514bfecad8f52ece31fbfb [0,1,0,1,0,0|2,0,0]=4 17381 B17R2.251954 Cc1ncccc1C(=O)NCCC2CCC2 549530e597da42c1374797132d982b61 [0,1,0,1,0,0|2,0,0]=4 17382 B17R2.251954 O=C(CCCN1CCC1)c2ccccc2F 4ec90ec401e8309b4065228179ab5eec [0,1,0,1,0,0|2,0,0]=4 17383 B17R2.251954 O=C(CCOC1CCC1)c2ccccc2F 8de52d3b517405d5c5c47bd79b3b6ed7 [0,1,0,1,0,0|2,0,0]=4 17384 B17R2.251954 O=C(CNCC1CCC1)c2ccccc2Cl ec26afe73ac9c3c21bcb2e1b472fcc44 [0,1,0,1,0,0|2,0,0]=4 17385 B17R2.251954 O=C(CNCC1CCC1)c2ccccc2F 761ed82e36a14a2daa1c999e4ccfd833 [0,1,0,1,0,0|2,0,0]=4 17386 B17R2.251954 O=C(CNCC1CCC1)c2ccccc2I b53268d4caf3a3983837598bc7d270d3 [0,1,0,1,0,0|2,0,0]=4 17387 B17R2.251954 O=C(COCC1CCC1)c2ccccc2Br d314a5db3c63b7ba3c9c24f8e3097425 [0,1,0,1,0,0|2,0,0]=4 17388 B17R2.251954 O=C(COCC1CCC1)c2ccccc2Cl a3e8889c06e6f09c8994d6f13fc6e016 [0,1,0,1,0,0|2,0,0]=4 17389 B17R2.251954 O=C(COCC1CCC1)c2ccccc2F 946d67dfb1edd013147830e0ea22e02f [0,1,0,1,0,0|2,0,0]=4 17390 B17R2.251954 O=C(COCC1CCC1)c2ccccc2I ff0fce4e1cc549bd8151ccaa2b794654 [0,1,0,1,0,0|2,0,0]=4 17391 B17R2.251954 O=C(NCCC1CCC1)c2cccc[n+]2[O-] 265f9d28632edc8d0fe4dd12e73a29f9 [0,1,0,1,0,0|2,0,0]=4 17392 B17R2.251954 O=C(NCCC1CCC1)c2ccccc2Br ca9fb6346f5f1aaecd39b186c214179f [0,1,0,1,0,0|1,0,0]=3 17393 B17R2.251954 O=C(NCCC1CCC1)c2ccccc2Cl ffdf4d4f52954137b7a8949fea13da79 [0,1,0,1,0,0|1,0,0]=3 17394 B17R2.251954 O=C(NCCC1CCC1)c2ccccc2F 46f5db664dff15a60eb0f624e66003f5 [0,1,0,1,0,0|1,0,0]=3 17395 B17R2.251954 O=C(NCCC1CCC1)c2ccccc2I 564f3a2918eed02b2db4e46fe339175c [0,1,0,1,0,0|1,0,0]=3 17396 B17R2.251954 O=C(NCCC1CCC1)c2ccccc2O 3b29aac2a256be77e816505975f66f48 [0,1,0,1,0,0|1,0,0]=3 17397 B17R2.251954 O=C(NCCC1CCC1)c2ccccc2S f9b55722bb7d2962f8f2843f5fe0a190 [0,1,0,1,0,0|1,0,0]=3 17398 B17R2.251954 O=C(NCCC1CCC1)c2cccnc2Br a7bccdc964c19d7b2c9e57e5f380ea6f [0,1,0,1,0,0|2,0,0]=4 17399 B17R2.251954 O=C(NCCC1CCC1)c2cccnc2Cl 7da8c68340b8b2ac7506d8f54a9bbd85 [0,1,0,1,0,0|2,0,0]=4 17400 B17R2.251954 O=C(NCCC1CCC1)c2cccnc2F 19547934df385cd12b0109d6b8a8c4f2 [0,1,0,1,0,0|2,0,0]=4 17401 B17R2.251954 O=C(NCCC1CCC1)c2cccnc2I 1b440070bf0a97c8e149416781432de0 [0,1,0,1,0,0|2,0,0]=4 17402 B17R2.251954 O=C(NCCC1CCC1)c2cccnc2O b50f0cbe9062bde03c2e71eddfe0b36a [0,1,0,1,0,0|2,0,0]=4 17403 B17R2.251954 O=C(NCCC1CCC1)c2cccnc2S 3d3f74fb71f56692c57123f19a49a632 [0,1,0,1,0,0|2,0,0]=4 17404 B17R2.251954 O=C(NCCC1CCC1)c2ccncc2Br da1a067a769f76e38d69a14882973b93 [0,1,0,1,0,0|2,0,0]=4 17405 B17R2.251954 O=C(NCCC1CCC1)c2ccncc2Cl cdc9f45965088e5f86555265744e4aaa [0,1,0,1,0,0|2,0,0]=4 17406 B17R2.251954 O=C(NCCC1CCC1)c2ccncc2F 9f8f9872c465ed2f0cd2b6fb551a61d6 [0,1,0,1,0,0|2,0,0]=4 17407 B17R2.251954 O=C(NCCC1CCC1)c2ccncc2I 4118b65fa54c69af8b5a5e109ace8122 [0,1,0,1,0,0|2,0,0]=4 17408 B17R2.251954 O=C(NCCC1CCC1)c2ccncc2O 8bfeee95db56b5e7313d6ae745af1898 [0,1,0,1,0,0|2,0,0]=4 17409 B17R2.251954 O=C(NCCC1CCC1)c2cnccc2Br c0a5a3d642617e2e485ad5c15bbf04f2 [0,1,0,1,0,0|2,0,0]=4 17410 B17R2.251954 O=C(NCCC1CCC1)c2cnccc2Cl 535d0047cb601f0a32ab588e35937aa9 [0,1,0,1,0,0|2,0,0]=4 17411 B17R2.251954 O=C(NCCC1CCC1)c2cnccc2F 50eb23bfa0b09bf6531adf6d809fb136 [0,1,0,1,0,0|2,0,0]=4 17412 B17R2.251954 O=C(NCCC1CCC1)c2cnccc2O 7b5352c53c6ce2d025116d746891ddbb [0,1,0,1,0,0|2,0,0]=4 17413 B17R2.251954 O=C(NCCC1CCC1)c2ncccc2Br df00a671bef9bcece31a89fde6a6f849 [0,1,0,1,0,0|2,0,0]=4 17414 B17R2.251954 O=C(NCCC1CCC1)c2ncccc2Cl 3b02f3282480c35d1d6438359b76dc67 [0,1,0,1,0,0|2,0,0]=4 17415 B17R2.251954 O=C(NCCC1CCC1)c2ncccc2F 5dcd01456ad2b64a951af982db860438 [0,1,0,1,0,0|2,0,0]=4 17416 B17R2.251954 O=C(NCCC1CCC1)c2ncccc2I 7b68feebe12f37c7971a720a0c6672dc [0,1,0,1,0,0|2,0,0]=4 17417 B17R2.251954 O=C(NCCC1CCC1)c2ncccc2O e6a442a69fadc70eb54f5b24e24109bd [0,1,0,1,0,0|2,0,0]=4 17418 B17R2.251954 O=C(NCCC1CCO1)c2ccccc2Br c44d134f16b1eb9066dc885d4f2e0ce7 [0,1,0,1,0,0|2,0,0]=4 17419 B17R2.251954 O=C(NCCC1CCO1)c2ccccc2Cl 9a37bb91038e748369145b870c27c436 [0,1,0,1,0,0|2,0,0]=4 17420 B17R2.251954 O=C(NCCC1CCO1)c2ccccc2F a55b926f706b6dd7c4077e6f260105cf [0,1,0,1,0,0|2,0,0]=4 17421 B17R2.251954 O=C(NCCC1CCO1)c2ccccc2I 102149572e60ce0f01b01d1a11f44584 [0,1,0,1,0,0|2,0,0]=4 17422 B17R2.251954 O=C(NCCC1CCO1)c2ccccc2O 0f647e6174f0848ea408dc8aefca6a03 [0,1,0,1,0,0|2,0,0]=4 17423 B17R2.251954 O=C(NCCC1CCO1)c2ccccc2S dba632c9e08bf6b94bb85efff3643317 [0,1,0,1,0,0|2,0,0]=4 17424 B17R2.251954 O=C(NCCC1COC1)c2ccccc2Br 5c8dbd7d846841721d89567beb9f2ca3 [0,1,0,1,0,0|2,0,0]=4 17425 B17R2.251954 O=C(NCCC1COC1)c2ccccc2Cl 3652a669fb6d7d9ea8d1499b62f04353 [0,1,0,1,0,0|2,0,0]=4 17426 B17R2.251954 O=C(NCCC1COC1)c2ccccc2F aafa4c136b8d5fb1f2d3d0cfe5385389 [0,1,0,1,0,0|2,0,0]=4 17427 B17R2.251954 O=C(NCCC1COC1)c2ccccc2I c99545120c3ed491f1b64e9751257c3a [0,1,0,1,0,0|2,0,0]=4 17428 B17R2.251954 O=C(NCCC1COC1)c2ccccc2O 8314b8ca6cc25d30f80ac96927aad080 [0,1,0,1,0,0|2,0,0]=4 17429 B17R2.251954 O=C(NCCC1COC1)c2ccccc2S e5c531b2ca8820788cf3406cb5fc7cc1 [0,1,0,1,0,0|2,0,0]=4 17430 B17R2.251954 O=C(NCCN1CCC1)c2ccccc2Br 19e7ea030654a31733575453e473be8a [0,1,0,1,0,0|2,0,0]=4 17431 B17R2.251954 O=C(NCCN1CCC1)c2ccccc2Cl 1e691088dfab269e3b006d2979d07b32 [0,1,0,1,0,0|2,0,0]=4 17432 B17R2.251954 O=C(NCCN1CCC1)c2ccccc2F 0486285238e5d6403b1e79cffeec0280 [0,1,0,1,0,0|2,0,0]=4 17433 B17R2.251954 O=C(NCCN1CCC1)c2ccccc2I 6e3645a9620e29d4058acb633bd391a4 [0,1,0,1,0,0|2,0,0]=4 17434 B17R2.251954 O=C(NCCN1CCC1)c2ccccc2O 5c00fca68754cc60da391f51e3c5d483 [0,1,0,1,0,0|2,0,0]=4 17435 B17R2.251954 O=C(NCCN1CCC1)c2ccccc2S 4797023097e16f754857a9f6f8e65804 [0,1,0,1,0,0|2,0,0]=4 17436 B17R2.251954 O=C(NCC[C@@H]1CCO1)c2ccccc2Br 328735bc019b25866a60af11de90298a [0,1,0,1,0,0|2,0,0]=4 17437 B17R2.251954 O=C(NCC[C@@H]1CCO1)c2ccccc2Cl b294148a080f723b323f87c2eca982f7 [0,1,0,1,0,0|2,0,0]=4 17438 B17R2.251954 O=C(NCC[C@@H]1CCO1)c2ccccc2F d5abfa3112870f95c7a7417e939d011b [0,1,0,1,0,0|2,0,0]=4 17439 B17R2.251954 O=C(NCC[C@@H]1CCO1)c2ccccc2I 7f808d06758ba6c737567a80e8b75933 [0,1,0,1,0,0|2,0,0]=4 17440 B17R2.251954 O=C(NCC[C@@H]1CCO1)c2ccccc2O c44850b80559fff6647d12f3388735d8 [0,1,0,1,0,0|2,0,0]=4 17441 B17R2.251954 O=C(NCC[C@@H]1CCO1)c2ccccc2S c82ee1e347c54fa74bd8d45aac5f1995 [0,1,0,1,0,0|2,0,0]=4 17442 B17R2.299255 CCCCOC1NC(=O)c2c1cccc2Br 997ee5643770f3a0b3d30e21f9f2966f [0,1,0,1,0,0|2,0,0]=4 17443 B17R2.299255 CCCCOC1OC(=O)c2c1cccc2Cl 1bbebf6f13aa2f28a11bc390d84c811f [0,1,0,1,0,0|1,0,0]=3 17444 B17R2.299255 CCOCOC1OC(=O)c2c1cccc2Cl 5892a5274185ce359355ad6b11add796 [0,1,0,1,0,0|2,0,0]=4 17445 B17R2.299255 COCCOC1OC(=O)c2c1cccc2Cl bd6a62215ddd19d7d07ee2264f53aefb [0,1,0,1,0,0|2,0,0]=4 17446 B17R2.299255 CSCCOC1OC(=O)c2c1cccc2Cl b3fefb40637771afbcf050ce173f9ca4 [0,1,0,1,0,0|2,0,0]=4 17447 B17R2.299255 O=C1OC(c2c1c(ccc2)Cl)OCCCF 94e611a7ab2d727f7c50269f7c1550c7 [0,1,0,1,0,0|2,0,0]=4 17448 B17R2.299255 O=C1OC(c2c1c(ccc2)Cl)OCCCS 4e8d9df5f5332a022fd8283d69de67b7 [0,1,0,1,0,0|2,0,0]=4 17449 B17R3.1939 c1ccc2c(c1)CC2OC3CCCCC3 3ce82e67321e616c559c541045fae7c5 [0,0,0,2,0,0|1,0,1]=4 17450 B17R3.9638 O=C(c1ccccc1)N2C3C2CCCC3 d694b897f0c276544be153b27b5e0435 [0,0,0,2,0,0|1,0,0]=3 17451 B17R3.9638 O=C(c1ccccn1)N2C3C2CCCC3 cc2af21e8113b1ac15d2f642e28843a0 [0,0,0,2,0,0|2,0,0]=4 17452 B17R3.9638 O=C(c1cccnc1)N2C3C2CCCC3 1e02b077b6094e950d0675910b0d1ed3 [0,0,0,2,0,0|2,0,0]=4 17453 B17R3.9638 O=C(c1ccncc1)N2C3C2CCCC3 f87074a6556c79800f136c76963af79a [0,0,0,2,0,0|2,0,0]=4 17454 B17R3.67215 O=C(CN1C2C1CCC2)c3ccccc3 dd867c9741fa9b747ad511b4fa2e2553 [0,0,0,2,0,0|2,0,0]=4 17455 B17R3.67268 O=C(CN1CCC2C1C2)c3ccccc3 486bba9ee442233e70998d5bb5994112 [0,0,0,2,0,0|2,0,0]=4 17456 B17R3.67305 O=C(CN1CC2CC2C1)c3ccccc3 1643b5618eae0479709d962a4319d7ba [0,0,0,2,0,0|2,0,0]=4 17457 B17R3.128636 O=C(c1ccccc1)N2C3COCC2C3 2af512d5b933b817337e83128696411f [0,0,0,2,0,0|2,0,0]=4 17458 B17R3.128644 O=C(c1ccccc1)N2C3CCC2CC3 f70c0645af1b6b21522aad04ee07cf86 [0,0,0,2,0,0|1,0,0]=3 17459 B17R3.128644 O=C(c1ccccc1)N2[C@H]3CC[C@@H]2CC3 63ba35e034b432cbdd07c8cc5b7bd57f [0,0,0,2,0,0|1,0,0]=3 17460 B17R3.128644 O=C(c1ccccn1)N2C3CCC2CC3 e3a35dd5ae568d4d7a3a86a1a051bf6f [0,0,0,2,0,0|2,0,0]=4 17461 B17R3.128644 O=C(c1ccccn1)N2[C@H]3CC[C@@H]2CC3 7af67c0580b1f67e8e706a995b29ce81 [0,0,0,2,0,0|2,0,0]=4 17462 B17R3.128644 O=C(c1cccnc1)N2C3CCC2CC3 f54ae1a763f41d0aec208cbec8a48832 [0,0,0,2,0,0|2,0,0]=4 17463 B17R3.128644 O=C(c1cccnc1)N2[C@H]3CC[C@@H]2CC3 0644b073043f4d2b2db07022d1957a6d [0,0,0,2,0,0|2,0,0]=4 17464 B17R3.128644 O=C(c1ccncc1)N2C3CCC2CC3 3486c6d3b69501e3387357961cbd0d6e [0,0,0,2,0,0|2,0,0]=4 17465 B17R3.128644 O=C(c1ccncc1)N2[C@H]3CC[C@@H]2CC3 fece1a85ad1c7a28915c03fb64ec3682 [0,0,0,2,0,0|2,0,0]=4 17466 B17R3.9641 O=C(c1ccccc1)N2CC3CCC3C2 a3d7f1852406aaeca599eb994392c7e4 [0,0,0,2,0,0|1,0,0]=3 17467 B17R3.9641 O=C(c1ccccn1)N2CC3CCC3C2 8f099beb10871adccd6c092cc45fbaf7 [0,0,0,2,0,0|2,0,0]=4 17468 B17R3.9641 O=C(c1cccnc1)N2CC3CCC3C2 0208b3c914047f8b0b233bc8994f2d44 [0,0,0,2,0,0|2,0,0]=4 17469 B17R3.9641 O=C(c1ccncc1)N2CC3CCC3C2 f6329106c529d095af6a6e853f3a84dd [0,0,0,2,0,0|2,0,0]=4 17470 B17R3.1967 c1ccc2c(c1)CC2OCCC3CCC3 9cd738803c42b4b4378ee6027bb66893 [0,0,0,2,0,0|1,0,1]=4 17471 B17R3.56142 O=C1CCC(c2c1cccc2)N3CCC3 176f4e651b8fbf1c41bf13d7680e9ddc [0,0,0,2,0,0|2,0,0]=4 17472 B17R3.67284 O=C(CN1CC2CC1C2)c3ccccc3 d9ffadf81238c883f1896ffbb17080e1 [0,0,0,2,0,0|2,0,0]=4 17473 B17R3.102389 O=C1CC(c2c1cccc2)NC3CCC3 c6f3c12dcd59731b1a2fb34317b9b8fe [0,0,0,2,0,0|2,0,0]=4 17474 B17R3.102389 O=C1CC(c2c1cccc2)OC3CCC3 29dd99a58d8e7ce2adc7de9a7d90a2cb [0,0,0,2,0,0|2,0,0]=4 17475 B17R3.102389 O=C1NC(c2c1cccc2)NC3CCC3 26d6726adc8f7a04c78d8b40841de6f3 [0,0,0,2,0,0|2,0,0]=4 17476 B17R3.102389 O=C1OC(c2c1cccc2)OC3CCC3 01544b043c96dfe9afdc725628195736 [0,0,0,2,0,0|1,0,0]=3 17477 B17R3.102389 O=C1OC(c2c1cccc2)OC3COC3 be3c11c4e3a069bc41dda1aa79760f04 [0,0,0,2,0,0|2,0,0]=4 17478 B17R3.102389 O=C1OC(c2c1cccc2)OC3CSC3 42fcf8defc44aa3a055d422e2088573d [0,0,0,2,0,0|2,0,0]=4 17479 B17R3.102389 O=C1OC(c2c1ccnc2)OC3CCC3 5f1abc2d0a2e3a39e9719bb10121d759 [0,0,0,2,0,0|2,0,0]=4 17480 B17R3.1872917 O=C(c1ccccc1)N2CCC23COC3 13fcedb7d9226a3c8e42aeb0e7d9a80f [0,0,0,2,0,0|2,0,0]=4 17481 B17R3.9642 O=C(c1ccccc1)N2CCC3CC3C2 a87cd5beaab9ee6b09fe16de84801157 [0,0,0,2,0,0|1,0,0]=3 17482 B17R3.9642 O=C(c1ccccn1)N2CCC3CC3C2 e04388b9f88aac954c14c4d5acb3b8df [0,0,0,2,0,0|2,0,0]=4 17483 B17R3.9642 O=C(c1cccnc1)N2CCC3CC3C2 cfb38b744a809690ad69f18fc009c8e2 [0,0,0,2,0,0|2,0,0]=4 17484 B17R3.9642 O=C(c1ccncc1)N2CCC3CC3C2 028dbd2509043d6f53b165b67aed6b0d [0,0,0,2,0,0|2,0,0]=4 17485 B17R3.484677 CC(OCC1CC12CC2)c3ccccc3 6d3793ad6cd9f866af0a4bf0ca518c24 [0,0,0,2,0,0|1,0,1]=4 17486 B17R3.484677 C[C@@H](OCC1CC12CC2)c3ccccc3 d43229488b4ca9e3c1a0256503f56b2f [0,0,0,2,0,0|1,0,1]=4 17487 B17R3.484677 C[C@H](OCC1CC12CC2)c3ccccc3 97caf1556de35cb585c072ff9ffa53b0 [0,0,0,2,0,0|1,0,1]=4 17488 B17R3.9643 O=C(c1ccccc1)N2CC3C2CCC3 3e0425696a2b0775f37dfe6912a450ba [0,0,0,2,0,0|1,0,0]=3 17489 B17R3.9643 O=C(c1ccccc1)N2C[C@H]3[C@@H]2CCC3 6b9e76105fc35f6429acc234f02f3e9b [0,0,0,2,0,0|1,0,0]=3 17490 B17R3.9643 O=C(c1ccccn1)N2CC3C2CCC3 352ab0e8ee2f8ff421e38eab87170548 [0,0,0,2,0,0|2,0,0]=4 17491 B17R3.9643 O=C(c1ccccn1)N2C[C@H]3[C@@H]2CCC3 73ebc54433673ffd0754bec762cbfb9e [0,0,0,2,0,0|2,0,0]=4 17492 B17R3.9643 O=C(c1cccnc1)N2CC3C2CCC3 c2e15bf89723a42b54ddf12740695a4a [0,0,0,2,0,0|2,0,0]=4 17493 B17R3.9643 O=C(c1cccnc1)N2C[C@H]3[C@@H]2CCC3 f38f263e720f00460f76fc1deb198a53 [0,0,0,2,0,0|2,0,0]=4 17494 B17R3.9643 O=C(c1ccncc1)N2CC3C2CCC3 3bdf6227087c089261237fb2cce7a950 [0,0,0,2,0,0|2,0,0]=4 17495 B17R3.9643 O=C(c1ccncc1)N2C[C@H]3[C@@H]2CCC3 da67a8ec7e63b6c7c5c97dacfc87f8b8 [0,0,0,2,0,0|2,0,0]=4 17496 B17R3.128640 O=C(c1ccccc1)N2CCOC3C2C3 43d61f6b31d90a27bedc024e85f51af7 [0,0,0,2,0,0|2,0,0]=4 17497 B17R3.128648 O=C(c1ccccc1)N2CC3CC2CO3 58ec296041a80c91b518d8b075aff0be [0,0,0,2,0,0|2,0,0]=4 17498 B17R3.128648 O=C(c1ccccc1)N2CC3CCC2C3 76b9c6683401bcd7ec71e3787b9beae7 [0,0,0,2,0,0|1,0,0]=3 17499 B17R3.128648 O=C(c1ccccc1)N2C[C@@H]3CC[C@H]2C3 326b3e817b8e30441292b945a824694f [0,0,0,2,0,0|1,0,0]=3 17500 B17R3.128648 O=C(c1ccccc1)N2C[C@@H]3C[C@H]2CO3 e0cf2f524c10c3328159b32ba43172b9 [0,0,0,2,0,0|2,0,0]=4 17501 B17R3.128648 O=C(c1ccccc1)N2C[C@H]3CC[C@@H]2C3 3645a363559d79bd4e71891fedae1feb [0,0,0,2,0,0|1,0,0]=3 17502 B17R3.128648 O=C(c1ccccc1)N2C[C@H]3C[C@@H]2CO3 b4bf1c211447e5417d1fd1a78ef0f30b [0,0,0,2,0,0|2,0,0]=4 17503 B17R3.128648 O=C(c1ccccn1)N2CC3CCC2C3 d33bf0dd990f913c0dba4de44af72787 [0,0,0,2,0,0|2,0,0]=4 17504 B17R3.128648 O=C(c1ccccn1)N2C[C@@H]3CC[C@H]2C3 8a16357119f21c1656b329cc0b42bfdf [0,0,0,2,0,0|2,0,0]=4 17505 B17R3.128648 O=C(c1ccccn1)N2C[C@H]3CC[C@@H]2C3 b0a4a93763ce1c569eae8284d0b1bc77 [0,0,0,2,0,0|2,0,0]=4 17506 B17R3.128648 O=C(c1cccnc1)N2CC3CCC2C3 d92cfabcc3f85e2ec55387f9ead87724 [0,0,0,2,0,0|2,0,0]=4 17507 B17R3.128648 O=C(c1cccnc1)N2C[C@@H]3CC[C@H]2C3 984253cb5a8e914d0ffbac673c2559ab [0,0,0,2,0,0|2,0,0]=4 17508 B17R3.128648 O=C(c1cccnc1)N2C[C@H]3CC[C@@H]2C3 e1bd79a8a7361f301ff671e0e482d99f [0,0,0,2,0,0|2,0,0]=4 17509 B17R3.128648 O=C(c1ccncc1)N2CC3CCC2C3 15ae57da685840174de4d873969c2047 [0,0,0,2,0,0|2,0,0]=4 17510 B17R3.128648 O=C(c1ccncc1)N2C[C@@H]3CC[C@H]2C3 720059adfbeeca432d440b7074a2eb0f [0,0,0,2,0,0|2,0,0]=4 17511 B17R3.128648 O=C(c1ccncc1)N2C[C@H]3CC[C@@H]2C3 6c4dcfd2a42dc02868d732ede5d02f2e [0,0,0,2,0,0|2,0,0]=4 17512 B17R3.4699 CC1CCCC1OC2Cc3c2cccc3 7b44bd2db9dd4f4282c4151f364d0bbd [0,0,0,2,0,0|1,0,1]=4 17513 B17R3.4699 C[C@@H]1CCC[C@@H]1OC2Cc3c2cccc3 04ce36a99120c29b91bde6518dc5a583 [0,0,0,2,0,0|1,0,1]=4 17514 B17R3.4699 C[C@@H]1CCC[C@H]1OC2Cc3c2cccc3 a49afd3d70f34c64b755aa4b90c8a9c4 [0,0,0,2,0,0|1,0,1]=4 17515 B17R3.4699 C[C@H]1CCC[C@@H]1OC2Cc3c2cccc3 bac056796d660a9795df56bb75e12303 [0,0,0,2,0,0|1,0,1]=4 17516 B17R3.4699 C[C@H]1CCC[C@H]1OC2Cc3c2cccc3 100df8638f99c234671396061501038e [0,0,0,2,0,0|1,0,1]=4 17517 B17R3.102388 CC1CC1NC2CC(=O)c3c2cccc3 a6e27d32e2ff593b9a5d82517e8c39a6 [0,0,0,2,0,0|2,0,0]=4 17518 B17R3.102388 CC1CC1NC2OC(=O)c3c2cccc3 f1b156777db69b80c641485c088060e2 [0,0,0,2,0,0|1,0,0]=3 17519 B17R3.102388 O=C1OC(c2c1cccc2)N[C@@H]3C[C@H]3F 1201204520d9f6b92062ffe93e257770 [0,0,0,2,0,0|2,0,0]=4 17520 B17R3.102388 O=C1OC(c2c1cccc2)N[C@H]3C[C@@H]3F 5ee6ca5daca6ce187bc5a30b4e40e3ef [0,0,0,2,0,0|2,0,0]=4 17521 B17R3.102388 O=C1OC(c2c1cccc2)N[C@H]3C[C@H]3F f02a95b44669e53031f99fc06a53c6d2 [0,0,0,2,0,0|2,0,0]=4 17522 B17R3.1898 c1ccc2c(c1)CC2OCC3CCCC3 003b1e1acd4c78fd076401f67826d872 [0,0,0,2,0,0|1,0,1]=4 17523 B17R3.7829 O=C1OC(c2c1cccc2)N3CCSC3 a0f6e64fceada8f8774a8d09480c381b [0,0,0,2,0,0|2,0,0]=4 17524 B17R3.102390 O=C1CC(c2c1cccc2)NCC3CC3 dab8646e541ed95f2a00b868f3c282f9 [0,0,0,2,0,0|2,0,0]=4 17525 B17R3.102390 O=C1CC(c2c1cccc2)OCC3CC3 481a120079440c39da4c32b24b81f264 [0,0,0,2,0,0|2,0,0]=4 17526 B17R3.102390 O=C1NC(c2c1cccc2)NCC3CC3 1f09fa04c772cd6ac0426ad9fb399a40 [0,0,0,2,0,0|2,0,0]=4 17527 B17R3.102390 O=C1OC(c2c1cccc2)NCC3CC3 423e5d41e9a528d42822c3071cb4d6af [0,0,0,2,0,0|1,0,0]=3 17528 B17R3.102390 O=C1OC(c2c1cccc2)OCC3CC3 104f95f01b37de9ad3bcd300bf68852a [0,0,0,2,0,0|1,0,0]=3 17529 B17R3.102390 O=C1OC(c2c1ccnc2)OCC3CC3 3aa26021e7e45c9015b7226c456323da [0,0,0,2,0,0|2,0,0]=4 17530 B17R3.56143 O=C1CCC(c2c1cccc2)OC3CC3 73b95bdf49730262e2935c13104bccc5 [0,0,0,2,0,0|2,0,0]=4 17531 B17R3.56143 O=C1CCN(c2c1cccc2)CC3CC3 ad2d8995a45d742c1010e463c630d9de [0,0,0,2,0,0|2,0,0]=4 17532 B13R1.48 CCCCCNC(=O)c1ccco1 6dc310eccc36aa6ca724e7c169385495 [1,0,0,0,1,0|2,0,0]=4 17533 B13R1.48 CCCCCNC(=O)c1cccs1 818bb5a784d69e642678986799491313 [1,0,0,0,1,0|2,0,0]=4 17534 B13R1.48 CCCCCNC(=O)c1ccoc1 8d70c42b891070735242f0e05e59f0cc [1,0,0,0,1,0|2,0,0]=4 17535 B13R1.48 CCCCCNC(=O)c1ccsc1 e418c0b47cb485ebab0a5bc9ca122eff [1,0,0,0,1,0|2,0,0]=4 17536 B13R1.48 CCCCNCC(=O)c1ccc[nH]1 f4dce0db06529bc0573be8c3285b7212 [1,0,0,0,1,0|2,0,0]=4 17537 B13R1.48 CCCCNCC(=O)c1ccco1 f498e31f4a3ef1585ac107fb53e6f643 [1,0,0,0,1,0|2,0,0]=4 17538 B13R1.48 CCCCNCC(=O)c1cccs1 96ea0819c814cb640fabf9d8e18e74a3 [1,0,0,0,1,0|2,0,0]=4 17539 B13R1.48 CCCCNCC(=O)c1ccsc1 7efee4d3f3a69e8605d237b5a9814703 [1,0,0,0,1,0|2,0,0]=4 17540 B13R1.48 CCCCOCC(=O)c1ccco1 c937ec2ab7e7e1d7c0e9ac9f961dfd86 [1,0,0,0,1,0|2,0,0]=4 17541 B13R1.48 CCCCOCC(=O)c1cccs1 ffa086712c87a3f5d847a7ab769f94f1 [1,0,0,0,1,0|2,0,0]=4 17542 B13R1.48 CCCCOCC(=O)c1ccsc1 e606959b4313281c0d87577da5cb801c [1,0,0,0,1,0|2,0,0]=4 17543 B13R1.48 CCCNCCC(=O)c1cccs1 b5bd84530ebdd1a74f68243805f64df7 [1,0,0,0,1,0|2,0,0]=4 17544 B13R1.119 CCCCCCOCc1cc[nH]c1 6deb242260c798493b3a81e03ef84cc0 [1,0,0,0,1,0|1,0,1]=4 17545 B13R1.119 CCCCCCOCc1ccc[nH]1 3111c36a3f1f10165ce4a756151b04fe [1,0,0,0,1,0|1,0,1]=4 17546 B13R1.119 CCCCCCOCc1ccco1 66099577a7dfad5eafbed3dc6f1dd4d0 [1,0,0,0,1,0|1,0,1]=4 17547 B13R1.119 CCCCCCOCc1cccs1 51885c5908059d2951d9d1dc44d4422a [1,0,0,0,1,0|1,0,1]=4 17548 B13R1.119 CCCCCCOCc1ccsc1 044eb8da84def5498d84d675189c8d85 [1,0,0,0,1,0|1,0,1]=4 17549 B17R1.1287 CCCCC/C=C/C(=O)NCc1ccccc1 4407041b4ada6a0c495d21aaeab632ed [0,0,0,0,0,2|1,0,1]=4 17550 B17R1.1287 CCCCCC#CC(=O)NCc1ccccc1 2c47c74316759229b221728c512d7cee [0,0,0,0,0,2|1,0,1]=4 17551 B17R1.1287 CCCCCCCC(=O)NCc1ccccc1 03f2a13d7b58bed1ac851b3d18f5ddf1 [0,0,0,0,0,2|1,0,0]=3 17552 B17R1.1287 CCCCCCCC(=O)NCc1ccccn1 fb9a22ce42685e640c15e8102488ea4d [0,0,0,0,0,2|2,0,0]=4 17553 B17R1.1287 CCCCCCCC(=O)NCc1cccnc1 270b67aad91419b338c59890e0088b3d [0,0,0,0,0,2|2,0,0]=4 17554 B17R1.1287 CCCCCCCC(=O)NCc1ccncc1 7101569e4f5f6d4ccaf3b9a4f1faea2a [0,0,0,0,0,2|2,0,0]=4 17555 B17R1.1287 CCCCCCNC(=O)/C=C/c1ccccc1 1bf64b82c3ec484048d0f5cad7b349a9 [0,0,0,0,0,2|1,0,0]=3 17556 B17R1.1287 CCCCCCNC(=O)/C=C/c1ccccn1 a8cc019e9fc957feb1366d90d88bf099 [0,0,0,0,0,2|2,0,0]=4 17557 B17R1.1287 CCCCCCNC(=O)/C=C/c1cccnc1 be744dabd9c86db7101dbafcf64468a2 [0,0,0,0,0,2|2,0,0]=4 17558 B17R1.1287 CCCCCCNC(=O)/C=C/c1ccncc1 c5eb368fdb7e246343dcaa6e3e3d115a [0,0,0,0,0,2|2,0,0]=4 17559 B17R1.1287 CCCCCCNC(=O)C#Cc1ccccc1 01e6e2e3a1a721f44b87e588733a81b9 [0,0,0,0,0,2|1,0,0]=3 17560 B17R1.1287 CCCCCCNC(=O)C#Cc1ccccn1 da9b4acd491b3cdd045d3a9fe9a4ce1e [0,0,0,0,0,2|2,0,0]=4 17561 B17R1.1287 CCCCCCNC(=O)C#Cc1cccnc1 b9bf9a6a68622663ded0c2a3aedfb1f8 [0,0,0,0,0,2|2,0,0]=4 17562 B17R1.1287 CCCCCCNC(=O)C#Cc1ccncc1 1e0585d974ebd65a198e50940a3eb18a [0,0,0,0,0,2|2,0,0]=4 17563 B17R1.1287 CCCCCCNC(=O)C=Cc1ccccc1 0601bcb3d7aabb6d29f93302d5f06a6c [0,0,0,0,0,2|1,0,0]=3 17564 B17R1.1287 CCCCCCNC(=O)C=Cc1ccccn1 2695d47234c807e029415e4f8959d900 [0,0,0,0,0,2|2,0,0]=4 17565 B17R1.1287 CCCCCCNC(=O)C=Cc1cccnc1 3f3fce6643fd4b40a7ed69a00a5e391e [0,0,0,0,0,2|2,0,0]=4 17566 B17R1.1287 CCCCCCNC(=O)C=Cc1ccncc1 e64449d1ff2919b2d61d3e1634d3482c [0,0,0,0,0,2|2,0,0]=4 17567 B17R1.1287 CCCCCCNC(=O)CCc1ccccc1 23ee8715978b6657acb00f88239f6821 [0,0,0,0,0,2|1,0,0]=3 17568 B17R1.1287 CCCCCCNC(=O)CCc1ccccn1 d5e05bcca52f211bdcd9964fab8ccac1 [0,0,0,0,0,2|2,0,0]=4 17569 B17R1.1287 CCCCCCNC(=O)CCc1cccnc1 9673500ee469974ba876e2f26e325f00 [0,0,0,0,0,2|2,0,0]=4 17570 B17R1.1287 CCCCCCNC(=O)CCc1ccncc1 6cc3275a4d472d72bac05914c9e4ec44 [0,0,0,0,0,2|2,0,0]=4 17571 B17R1.1287 CCCCCCNC(=O)CNc1ccccc1 cffe56d3768e87cd6ad402912d618766 [0,0,0,0,0,2|1,0,0]=3 17572 B17R1.1287 CCCCCCNC(=O)CNc1ccccn1 2f16b21e029f68b0c09e0043fee93609 [0,0,0,0,0,2|2,0,0]=4 17573 B17R1.1287 CCCCCCNC(=O)CNc1cccnc1 e65e5869e50b0f260512a253038eaae6 [0,0,0,0,0,2|2,0,0]=4 17574 B17R1.1287 CCCCCCNC(=O)CNc1ccncc1 6ddc3c5b980353651b3b9f861b8321f3 [0,0,0,0,0,2|2,0,0]=4 17575 B17R1.1287 CCCCCCNC(=O)COc1ccccc1 3e879ec321072c03c25f38e24c514e14 [0,0,0,0,0,2|1,0,0]=3 17576 B17R1.1287 CCCCCCNC(=O)COc1ccccn1 539625cb3b22cf48fb640983fde9b589 [0,0,0,0,0,2|2,0,0]=4 17577 B17R1.1287 CCCCCCNC(=O)COc1cccnc1 0f587c342d03b5006adfe9c253822367 [0,0,0,0,0,2|2,0,0]=4 17578 B17R1.1287 CCCCCCNC(=O)COc1ccncc1 41dabdd5fe3051e5779607b5e06df345 [0,0,0,0,0,2|2,0,0]=4 17579 B17R1.1287 CCCCCCNC(=O)CSc1ccccc1 af7c846f3d5b8d8da131f0a46e14505a [0,0,0,0,0,2|1,0,0]=3 17580 B17R1.1287 CCCCCCNC(=O)CSc1ccccn1 7885c624b0b63229227a8a5c092b85a9 [0,0,0,0,0,2|2,0,0]=4 17581 B17R1.1287 CCCCCCNC(=O)CSc1ccncc1 2c1735442931d55e7f80146a98a5afcc [0,0,0,0,0,2|2,0,0]=4 17582 B17R1.1287 CCCCCCNC(=O)NCc1ccccc1 e648943aae21871bde24bb4232c95c66 [0,0,0,0,0,2|1,0,0]=3 17583 B17R1.1287 CCCCCCNC(=O)NCc1ccccn1 36e12accffc166352144b87c7a6b20c0 [0,0,0,0,0,2|2,0,0]=4 17584 B17R1.1287 CCCCCCNC(=O)NCc1cccnc1 9a4b2b3fb1f305cde3aee61f9fb02cc9 [0,0,0,0,0,2|2,0,0]=4 17585 B17R1.1287 CCCCCCNC(=O)NCc1ccncc1 34f03a9cfcb9ad46fc2fd9f3c0536f26 [0,0,0,0,0,2|2,0,0]=4 17586 B17R1.1287 CCCCCCNC(=S)NCc1ccccc1 01c3cdea011f40f88ddb03ff59270529 [0,0,0,0,0,2|1,1,0]=4 17587 B17R1.1287 CCCCCCOC(C)C#Cc1ccccc1 0ae70c09da07d0204ec193598acbdb8d [0,0,0,0,0,2|1,0,1]=4 17588 B17R1.1287 CCCCCCOC(C)CCc1ccccc1 92e53fa8eebe0d65b62e4e6e4102e716 [0,0,0,0,0,2|1,0,1]=4 17589 B17R1.1287 CCCCCCOC(C)COc1ccccc1 9c08fe58d0a7862c3e8098f75643fec7 [0,0,0,0,0,2|1,0,1]=4 17590 B17R1.1287 CCCCCCO[C@@H](C)/C=C/c1ccccc1 e78c2ab42781a8c5266f0561f5852841 [0,0,0,0,0,2|1,0,1]=4 17591 B17R1.1287 CCCCCCO[C@@H](C)CCc1ccccc1 1eb520e63afd7860053344346a58b77d [0,0,0,0,0,2|1,0,1]=4 17592 B17R1.1287 CCCCCCO[C@H](C)/C=C/c1ccccc1 add703722ca6668c73dc7861e60196ab [0,0,0,0,0,2|1,0,1]=4 17593 B17R1.1287 CCCCCCO[C@H](C)CCc1ccccc1 7040bb5fd9c2665273a18de49bb057cb [0,0,0,0,0,2|1,0,1]=4 17594 B17R1.1287 CCCCCNCC(=O)NCc1ccccc1 e68c1372ad8752d4158077728a8ca6c9 [0,0,0,0,0,2|2,0,0]=4 17595 B17R1.1287 CCCCCNCC(=O)OCc1ccccc1 16a11fe1357310db7fe08248cd8f2e59 [0,0,0,0,0,2|2,0,0]=4 17596 B17R1.1287 CCCCCNCC(=O)SCc1ccccc1 2aef7bf85ae117a23207a93da5a63eab [0,0,0,0,0,2|2,0,0]=4 17597 B17R1.1287 CCCCCOCC(=O)NCc1ccccc1 df65f0aea49992c36839ca0659e73f7c [0,0,0,0,0,2|2,0,0]=4 17598 B17R1.1287 CCCCCOCC(=O)OCc1ccccc1 8c0719786b3f9d40a532699b1a4e2e8e [0,0,0,0,0,2|2,0,0]=4 17599 B17R1.1287 CCCCNCCC(=O)NCc1ccccc1 56fcac9b8294d0db578a827318ef0d55 [0,0,0,0,0,2|2,0,0]=4 17600 B17R1.1287 CCCCNCCC(=O)OCc1ccccc1 718f3eadbc3ac3d637e76c88ce93c880 [0,0,0,0,0,2|2,0,0]=4 17601 B17R1.1287 CCCCOCCC(=O)NCc1ccccc1 a88a9f985e3740473f0c6c81de1f053f [0,0,0,0,0,2|2,0,0]=4 17602 B17R1.1287 CCCCOCCC(=O)OCc1ccccc1 1fc1922b521e9108cd45e95f0178e290 [0,0,0,0,0,2|2,0,0]=4 17603 B17R1.1287 CCCNCCCC(=O)OCc1ccccc1 4e260a2ee16448297ee2182f18ba76fc [0,0,0,0,0,2|2,0,0]=4 17604 B17R1.1287 CCCOCCCC(=O)OCc1ccccc1 85e5de1ef934e10d6946165cff3b6bd2 [0,0,0,0,0,2|2,0,0]=4 17605 B17R1.1287 CCCOCCNC(=O)/C=C/c1ccccc1 fd4b6212e872a9f4db601cf8ebc8064d [0,0,0,0,0,2|2,0,0]=4 17606 B17R1.1287 CCCOCCNC(=O)C#Cc1ccccc1 a761cf170e2a76415c2cbf96272e90bf [0,0,0,0,0,2|2,0,0]=4 17607 B17R1.1287 CCCOCCNC(=O)C=Cc1ccccc1 969c4a6e8c10402a873a3054f70d2de5 [0,0,0,0,0,2|2,0,0]=4 17608 B17R1.1287 CCCOCCNC(=O)CCc1ccccc1 29a73691be89d7cb035785cb73e459f7 [0,0,0,0,0,2|2,0,0]=4 17609 B17R1.1287 CCCOCCNC(=O)COc1ccccc1 e7a81d39ed987bfb31eaf378f76f1df7 [0,0,0,0,0,2|2,0,0]=4 17610 B17R1.1287 CCCOCCNC(=O)CSc1ccccc1 115645fced89cbc3bc45b8fb0507ac66 [0,0,0,0,0,2|2,0,0]=4 17611 B17R1.1287 CCCOCCNC(=O)NCc1ccccc1 d00fb3d0276e9b0d09f9474db4d566b0 [0,0,0,0,0,2|2,0,0]=4 17612 B17R1.1287 CCNCCCCC(=O)OCc1ccccc1 90911cbffe71b8b24da50d885f2db640 [0,0,0,0,0,2|2,0,0]=4 17613 B17R1.1287 CCOCCCCC(=O)NCc1ccccc1 efa6ea55fabaa847b6a6e577e6921d3b [0,0,0,0,0,2|2,0,0]=4 17614 B17R1.1287 CCOCCCCC(=O)OCc1ccccc1 7fdf4bd6ba5070b5d8276fb024619a17 [0,0,0,0,0,2|2,0,0]=4 17615 B17R1.1287 CCOCCCNC(=O)/C=C/c1ccccc1 e8c2d0346ca7eaed56cf43edf779f1f1 [0,0,0,0,0,2|2,0,0]=4 17616 B17R1.1287 CCOCCCNC(=O)C#Cc1ccccc1 1a3b686ce2309d7519b4c2f3e1a8196c [0,0,0,0,0,2|2,0,0]=4 17617 B17R1.1287 CCOCCCNC(=O)C=Cc1ccccc1 412be3ae1e9bbcf3ed0f011f0c03cdac [0,0,0,0,0,2|2,0,0]=4 17618 B17R1.1287 CCOCCCNC(=O)CCc1ccccc1 90afec78b178aa13e9d0c1e9f104ef40 [0,0,0,0,0,2|2,0,0]=4 17619 B17R1.1287 CCOCCCNC(=O)COc1ccccc1 33f5abed219770e9d258c1c23ea81866 [0,0,0,0,0,2|2,0,0]=4 17620 B17R1.1287 CCOCCCNC(=O)CSc1ccccc1 76e95124818e772e4b89f77702ef8653 [0,0,0,0,0,2|2,0,0]=4 17621 B17R1.1287 CCOCCCNC(=O)NCc1ccccc1 cdb199f73f5e1a12114f6359232f8c69 [0,0,0,0,0,2|2,0,0]=4 17622 B17R1.1287 COCCCCCC(=O)NCc1ccccc1 7b4783726d20b157820dccfbf17841a8 [0,0,0,0,0,2|2,0,0]=4 17623 B17R1.1287 COCCCCNC(=O)/C=C/c1ccccc1 3b904ba2865554fcea71db6451bc08f2 [0,0,0,0,0,2|2,0,0]=4 17624 B17R1.1287 COCCCCNC(=O)C#Cc1ccccc1 ca2c139e2d19fef816807f17630349c4 [0,0,0,0,0,2|2,0,0]=4 17625 B17R1.1287 COCCCCNC(=O)C=Cc1ccccc1 c14dfb3c9c3b519799aa6770743e0505 [0,0,0,0,0,2|2,0,0]=4 17626 B17R1.1287 COCCCCNC(=O)CCc1ccccc1 3a4e544c37340e2e50fa0982f1039867 [0,0,0,0,0,2|2,0,0]=4 17627 B17R1.1287 COCCCCNC(=O)COc1ccccc1 68e6411a3f2f126d0e1dec241d765fd8 [0,0,0,0,0,2|2,0,0]=4 17628 B17R1.1287 COCCCCNC(=O)CSc1ccccc1 bf8334ddca05c8b633f2fb88616d74f5 [0,0,0,0,0,2|2,0,0]=4 17629 B17R1.1287 COCCCCNC(=O)NCc1ccccc1 fa2155c0aae29a25baa941653c0d3990 [0,0,0,0,0,2|2,0,0]=4 17630 B17R1.1287 CSCCCCNC(=O)/C=C/c1ccccc1 420c7d3f6ca57a91d2b9363deaefa844 [0,0,0,0,0,2|2,0,0]=4 17631 B17R1.1287 CSCCCCNC(=O)C#Cc1ccccc1 df74cf8526cbd7dd3d9f289059d4e9b6 [0,0,0,0,0,2|2,0,0]=4 17632 B17R1.1287 CSCCCCNC(=O)C=Cc1ccccc1 b52c08bebbe41c9e48c28b614c443b2e [0,0,0,0,0,2|2,0,0]=4 17633 B17R1.1287 CSCCCCNC(=O)CCc1ccccc1 2a5cf6579f0a8815646e5c71cadf33cb [0,0,0,0,0,2|2,0,0]=4 17634 B17R1.1287 CSCCCCNC(=O)COc1ccccc1 c68803ad188fac907e4f9786126835f3 [0,0,0,0,0,2|2,0,0]=4 17635 B17R1.1287 CSCCCCNC(=O)CSc1ccccc1 a08b67ee4926f9addeaba5fbfdd8065b [0,0,0,0,0,2|2,0,0]=4 17636 B17R1.1287 CSCCCCNC(=O)NCc1ccccc1 af774f73a9b5ace07b0c0cd70d3d51e5 [0,0,0,0,0,2|2,0,0]=4 17637 B17R1.1287 NCCCCCNC(=O)NCc1ccccc1 86a3d118d2cf63066d15bc74a6b8dc00 [0,0,0,0,0,2|2,0,0]=4 17638 B17R1.1287 O=C(/C=C/c1ccccc1)NCCCCCCl 9ff500fb6c72c464e466bbc136678503 [0,0,0,0,0,2|2,0,0]=4 17639 B17R1.1287 O=C(/C=C/c1ccccc1)NCCCCCO b53f25f7568db5bdff4293bf04e17e9b [0,0,0,0,0,2|2,0,0]=4 17640 B17R1.1287 O=C(C#Cc1ccccc1)NCCCCCCl 592826e80eedefb244953be3c66f65f1 [0,0,0,0,0,2|2,0,0]=4 17641 B17R1.1287 O=C(C#Cc1ccccc1)NCCCCCO 1cbdf5281c9b5bdcde7c525c2702c482 [0,0,0,0,0,2|2,0,0]=4 17642 B17R1.1287 O=C(C=Cc1ccccc1)NCCCCCCl 150cec5cff299eba0618a4be0961b1ee [0,0,0,0,0,2|2,0,0]=4 17643 B17R1.1287 O=C(C=Cc1ccccc1)NCCCCCO 6e25272e678e5613f71a84bbe364759b [0,0,0,0,0,2|2,0,0]=4 17644 B17R1.1287 O=C(CCCCCCF)NCc1ccccc1 968ca0bae4655271cc8b6d330cd5fa91 [0,0,0,0,0,2|2,0,0]=4 17645 B17R1.1287 O=C(CCCCCCO)NCc1ccccc1 917a178bc550fd77a425999d19151ab7 [0,0,0,0,0,2|2,0,0]=4 17646 B17R1.1287 O=C(CCCCCCS)NCc1ccccc1 77d9ed671c350f595044544fb786fd4b [0,0,0,0,0,2|2,0,0]=4 17647 B17R1.1287 O=C(CCc1ccccc1)NCCCCCCl 5a4dd9ecaa0b6be00d706559e808310e [0,0,0,0,0,2|2,0,0]=4 17648 B17R1.1287 O=C(CCc1ccccc1)NCCCCCO 9ab5c48e58f6471ebed7e92261164465 [0,0,0,0,0,2|2,0,0]=4 17649 B17R1.1287 O=C(COc1ccccc1)NCCCCCCl 4cce8f8d17c8c7dfb3c1011e9b4151e2 [0,0,0,0,0,2|2,0,0]=4 17650 B17R1.1287 O=C(COc1ccccc1)NCCCCCO 96f45bea9b71b3a80df7d3404fd7150d [0,0,0,0,0,2|2,0,0]=4 17651 B17R1.1287 O=C(CSc1ccccc1)NCCCCCCl 5dc68cbb9cc490e9f3d8dc909c26f3ce [0,0,0,0,0,2|2,0,0]=4 17652 B17R1.1287 O=C(CSc1ccccc1)NCCCCCO dc6ab031a33810e927b8103c1dabb661 [0,0,0,0,0,2|2,0,0]=4 17653 B17R1.1287 O=C(NCCCCCO)NCc1ccccc1 3975b6b461ccdd3785b50c31a0054d94 [0,0,0,0,0,2|2,0,0]=4 17654 B17R1.66797 CCCCCCNC(=O)/C/1=C/C=C\C=C/C=C1 73c3a902c38f80d89956435f7a626471 [0,0,0,0,0,2|1,0,0]=3 17655 B17R1.66797 CCCOCCNC(=O)/C/1=C/C=C\C=C/C=C1 59d71ca302241458fdb5f8e037f1ab7e [0,0,0,0,0,2|2,0,0]=4 17656 B17R1.66797 CCOCCCNC(=O)/C/1=C/C=C\C=C/C=C1 1b97e38f76d2e087a4708eb74677e855 [0,0,0,0,0,2|2,0,0]=4 17657 B17R1.66797 COCCCCNC(=O)/C/1=C/C=C\C=C/C=C1 073aa742914a2d2fb6e742675c406315 [0,0,0,0,0,2|2,0,0]=4 17658 B17R1.66797 CSCCCCNC(=O)/C/1=C/C=C\C=C/C=C1 d05af4593f5f836149bb2e7c9e8e4ded [0,0,0,0,0,2|2,0,0]=4 17659 B17R1.66797 O=C(NCCCCCCl)/C/1=C/C=C\C=C/C=C1 fcc860b30853670e0a7bb32c3eabf3b6 [0,0,0,0,0,2|2,0,0]=4 17660 B17R1.66797 O=C(NCCCCCO)/C/1=C/C=C\C=C/C=C1 d5c12ec1346c91c5cf8123b94b55d91c [0,0,0,0,0,2|2,0,0]=4