0 B17R2.86762 C#CCCNc1ncnc2c1c(n[nH]2)SC 0855e5c6806c21f94a237c260d8d90d7 [0,0,0,0,0,0|2,0,1]=3 1 B17R2.86762 C/C=C/CNc1ncnc2c1c(n[nH]2)SC 38c905af6831b9f8bf135301a24d0d13 [0,0,0,0,0,0|2,0,2]=4 2 B17R2.86762 C/C=C\CNc1ncnc2c1c(n[nH]2)SC e9343b83c6b518c52b60019bedcc31a2 [0,0,0,0,0,0|2,0,2]=4 3 B17R2.86762 C=CCCNc1ncnc2c1c(c[nH]2)CC af2fbed7dc8a7b00bf25056de90e5f94 [0,0,0,0,0,0|2,0,1]=3 4 B17R2.86762 C=CCCNc1ncnc2c1c(c[nH]2)CO 06d49d98a85b736d8d70b5a055a97c99 [0,0,0,0,0,0|3,0,1]=4 5 B17R2.86762 C=CCCNc1ncnc2c1c(c[nH]2)SC 8c3d0ab0282ee79ee72b71c76ea37ca8 [0,0,0,0,0,0|1,0,1]=2 6 B17R2.86762 C=CCCNc1ncnc2c1c(n[nH]2)SC 66fe5bc550f7add831a33ed07689a8e7 [0,0,0,0,0,0|2,0,1]=3 7 B17R2.86762 CC=CCNc1ncnc2c1c(c[nH]2)CC 5510779752ab4b845c6e2d4854bb64b4 [0,0,0,0,0,0|2,0,2]=4 8 B17R2.86762 CC=CCNc1ncnc2c1c(c[nH]2)SC 2a9f0ccf3633c70803625c02b711f230 [0,0,0,0,0,0|1,0,2]=3 9 B17R2.86762 CCCCNc1ccnc2c1c(c[nH]2)C=O d9b52e6aee6352ec650df3c0a101e489 [0,0,0,0,0,0|4,0,0]=4 10 B17R2.86762 CCCCNc1nccc2c1c(c[nH]2)C=O 9bfb73a19d1d565d148c302e4ac87815 [0,0,0,0,0,0|4,0,0]=4 11 B17R2.86762 CCCCNc1ncnc2c1c(c[nH]2)CC 0604614866b8c14eb501c47c3444b42c [0,0,0,0,0,0|2,0,0]=2 12 B17R2.86762 CCCCNc1ncnc2c1c(n[nH]2)C#N 1b29c785d30f621adda6fc7ce6c982c6 [0,0,0,0,0,0|4,0,0]=4 13 B17R2.86762 CCCCNc1ncnc2c1c(n[nH]2)SC 96b49dbb5c8914dc5946aa553afc1f29 [0,0,0,0,0,0|2,0,0]=2 14 B17R2.86762 CCOCNc1ncnc2c1c(n[nH]2)SC 20d6a05972f9f7be58c6431ced6ae31c [0,0,0,0,0,0|3,0,0]=3 15 B17R2.86762 CCc1c[nH]c2c1c(ncn2)NCCCCl 9f1f65c0dd2dca27887bf1495b866a57 [0,0,0,0,0,0|2,0,0]=2 16 B17R2.86762 CCc1c[nH]c2c1c(ncn2)NCCCO fda4d860842091450dbeea43713038a7 [0,0,0,0,0,0|1,0,0]=1 17 B17R2.86762 CCc1c[nH]c2c1c(ncn2)NCCOC 1e04ab23b1ea845a686a6e9fa351de41 [0,0,0,0,0,0|3,0,0]=3 18 B17R2.86762 CCc1c[nH]c2c1c(ncn2)NCCON 85e5f11975be1a78e27329bac5d68e72 [0,0,0,0,0,0|3,0,0]=3 19 B17R2.86762 CCc1c[nH]c2c1c(ncn2)NCCSC 049a1b6bae5a3bd4aa08460b88a80ba0 [0,0,0,0,0,0|3,0,0]=3 20 B17R2.86762 COCCNc1ncnc2c1c(c[nH]2)CO 5365ccb3cb574ab73e96a5cba49f68c9 [0,0,0,0,0,0|4,0,0]=4 21 B17R2.86762 COCCNc1ncnc2c1c(c[nH]2)SC aa47512411083a966546f32a3e374723 [0,0,0,0,0,0|2,0,0]=2 22 B17R2.86762 COCCNc1ncnc2c1c(n[nH]2)SC 16464c913e78c7a33b035e2bdd6bb36d [0,0,0,0,0,0|3,0,0]=3 23 B17R2.86762 CSCCNc1ncnc2c1c(n[nH]2)SC b83eec92debc436bca69ce3e8de784ee [0,0,0,0,0,0|3,0,0]=3 24 B17R2.86762 CSc1c[nH]c2c1c(ncn2)NCCCCl 4460317ef26f53994f6c99e97f768d2b [0,0,0,0,0,0|1,0,0]=1 25 B17R2.86762 CSc1c[nH]c2c1c(ncn2)NCCCO 3f7d3a6d840ec5973b9ed8f16a866ea1 [0,0,0,0,0,0|0,0,0]=0 26 B17R2.86762 CSc1c[nH]c2c1c(ncn2)NCCON a072429ff9a1564fcb50af9643423ffd [0,0,0,0,0,0|2,0,0]=2 27 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NC/C=C/Cl a80616ac971dc8e2a0b2db1714a6ea88 [0,0,0,0,0,0|2,0,2]=4 28 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NC/C=C\Cl 3aa4daafef2a4cb167e8ca82c6c4672a [0,0,0,0,0,0|2,0,2]=4 29 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NC/C=C\O 6a5641454abf558d2e37acffd410dbca [0,0,0,0,0,0|1,0,2]=3 30 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NCCC#N 11c8c705cf78a024f0140033322128d9 [0,0,0,0,0,0|2,0,1]=3 31 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NCCC=O a9850c9eaafaf1e4ba699725aeb5f8ff [0,0,0,0,0,0|1,0,2]=3 32 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NCCCF e7ae7a679edf431c2a2b35027f49cf76 [0,0,0,0,0,0|2,0,0]=2 33 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NCCCO 47f21d5ad170f3cb8dc641ff0d5c9d2e [0,0,0,0,0,0|1,0,0]=1 34 B17R2.86762 CSc1n[nH]c2c1c(ncn2)NCCCS 19999537a4de8d87fc4517918d768a77 [0,0,0,0,0,0|1,1,0]=2 35 B17R2.86762 N#Cc1c[nH]c2c1c(ccc2)NCCCO c70295c5c3f7c47e87d1f24880d529de [0,0,0,0,0,0|4,0,0]=4 36 B17R2.86762 N#Cc1c[nH]c2c1c(ccn2)NCCCCl 4782183544184330d8c4229797e575ad [0,0,0,0,0,0|4,0,0]=4 37 B17R2.86762 N#Cc1c[nH]c2c1c(ncn2)NCCON 1d52405120f3f669a88af4bccdad90dd [0,0,0,0,0,0|4,0,0]=4 38 B17R2.86762 N#Cc1ccn2c1c(ncn2)NCCCO d9f5ded56119f7e34ac1c78cc316a89f [0,0,0,0,0,0|4,0,0]=4 39 B17R2.86762 N#Cc1n[nH]c2c1c(ncn2)NCCCF 6d73e168785cb912506394b32fedc4f7 [0,0,0,0,0,0|4,0,0]=4 40 B17R2.86762 N#Cc1n[nH]c2c1c(ncn2)NCCCO 1052379ae857419ea9e2494699760a2e [0,0,0,0,0,0|3,0,0]=3 41 B17R2.86762 N#Cc1n[nH]c2c1c(ncn2)NCCCS f09d99ebc8db57620a785403eae945ae [0,0,0,0,0,0|3,1,0]=4 42 B17R2.86762 NOCCNc1ncnc2c1c(c[nH]2)C=O f8a3b702e1924b000b0815abb84c891e [0,0,0,0,0,0|4,0,0]=4 43 B17R2.86762 NOCCNc1ncnc2c1c(c[nH]2)CO 21dd8faf25d9a51544e0a832dbdd64b2 [0,0,0,0,0,0|4,0,0]=4 44 B17R2.86762 O=Cc1c[nH]c2c1c(ccc2)NCCCO 1ba10ddb036c80805083a40e39397761 [0,0,0,0,0,0|4,0,0]=4 45 B17R2.86762 O=Cc1c[nH]c2c1c(ccn2)NCCCCl cba3dc0455e49176d6f674de5f8a41c8 [0,0,0,0,0,0|4,0,0]=4 46 B17R2.86762 O=Cc1c[nH]c2c1c(ccn2)NCCCO fc7f1ae1900cefdc9869fce9d86264e0 [0,0,0,0,0,0|3,0,0]=3 47 B17R2.86762 O=Cc1c[nH]c2c1c(ncc2)NCCCCl 54d810cf0530d8c6efc28f010b6758ae [0,0,0,0,0,0|4,0,0]=4 48 B17R2.86762 O=Cc1c[nH]c2c1c(ncc2)NCCCO acd7498523dd3c53d2b750a1c0a36377 [0,0,0,0,0,0|3,0,0]=3 49 B17R2.86762 O=Cc1c[nH]c2c1c(ncn2)NCCCCl 6e093ecf3b6c26491cb247784b956e2f [0,0,0,0,0,0|3,0,0]=3 50 B17R2.86762 OCc1c[nH]c2c1c(ncn2)NCCCCl 4243c17308ae42247253f1605d96cc24 [0,0,0,0,0,0|3,0,0]=3 51 B16R2.6353 C#CCCNc1ccnc2c1c(c[nH]2)C 6227c3c3bea56cf4e2871638b86686ef [1,0,0,0,0,0|2,0,1]=4 52 B16R2.6353 C#CCCNc1ncnc2c1c(c[nH]2)Br 2666bdcf6dec3f87c1ca106d673d6459 [1,0,0,0,0,0|2,0,1]=4 53 B16R2.6353 C#CCCNc1ncnc2c1c(c[nH]2)C c8b5a63b90f583e98c995af8233a4e60 [1,0,0,0,0,0|1,0,1]=3 54 B16R2.6353 C#CCCNc1ncnc2c1c(c[nH]2)Cl 88c7b5f6ccea1fa060cd41e3f97dd9aa [1,0,0,0,0,0|2,0,1]=4 55 B16R2.6353 C#CCCNc1ncnc2c1c(c[nH]2)F 47166c6d6879feb96cc7708c51fb2b6f [1,0,0,0,0,0|2,0,1]=4 56 B16R2.6353 C#CCCNc1ncnc2c1c(c[nH]2)I ad4e0a6659ebc3eccc33905cc0853263 [1,0,0,0,0,0|2,0,1]=4 57 B16R2.6353 C#CCCNc1ncnc2c1c(co2)C 9b6c9871108b944bc32231e26391a44f [1,0,0,0,0,0|2,0,1]=4 58 B16R2.6353 C#CCCNc1ncnc2c1c(n[nH]2)C 1ea5ef4aa4f19ee31d5c333424f0fc6f [1,0,0,0,0,0|2,0,1]=4 59 B16R2.6353 C/C=C/CNc1ncnc2c1c(c[nH]2)C 97880ac124565385f9743035d4e146bf [1,0,0,0,0,0|1,0,2]=4 60 B16R2.6353 C/C=C\CNc1ncnc2c1c(c[nH]2)C e475f014784abfc359a243da76e9d0ac [1,0,0,0,0,0|1,0,2]=4 61 B16R2.6353 C=CCCNc1ccnc2c1c(c[nH]2)C 9cd7087dd6ba99fc210b4cbdd474f50a [1,0,0,0,0,0|2,0,1]=4 62 B16R2.6353 C=CCCNc1ncnc2c1c(c[nH]2)Br b723e2e756104ecf17d64da9fdf42514 [1,0,0,0,0,0|2,0,1]=4 63 B16R2.6353 C=CCCNc1ncnc2c1c(c[nH]2)C 7552faaba756b549f04063926cc17ffd [1,0,0,0,0,0|1,0,1]=3 64 B16R2.6353 C=CCCNc1ncnc2c1c(c[nH]2)Cl b83b2f801ebc8053638f4af5629318f7 [1,0,0,0,0,0|2,0,1]=4 65 B16R2.6353 C=CCCNc1ncnc2c1c(c[nH]2)F d654a618723fc144901f2274ae9bc9c9 [1,0,0,0,0,0|2,0,1]=4 66 B16R2.6353 C=CCCNc1ncnc2c1c(c[nH]2)I c5ceb1884307dd3cb646ca5609a43ecf [1,0,0,0,0,0|2,0,1]=4 67 B16R2.6353 C=CCCNc1ncnc2c1c(co2)C 947f0ae491bc89bb137dd32d36db8d58 [1,0,0,0,0,0|2,0,1]=4 68 B16R2.6353 C=CCCNc1ncnc2c1c(cs2)C ca33af3924b558b752ed44c16e81c387 [1,0,0,0,0,0|2,0,1]=4 69 B16R2.6353 C=CCCNc1ncnc2c1c(n[nH]2)C e020547ce464c4a675df638279c8b5b9 [1,0,0,0,0,0|2,0,1]=4 70 B16R2.6353 CC=CCNc1ncnc2c1c(c[nH]2)C 78f79c985448e5a00e37f51b3cb30690 [1,0,0,0,0,0|1,0,2]=4 71 B16R2.6353 CCCCNc1cccc2c1c(c[nH]2)C 26bc36392bf61c34837a623044fc8c0d [1,0,0,0,0,0|3,0,0]=4 72 B16R2.6353 CCCCNc1ccnc2c1c(c[nH]2)Br 9111fb352d94cc1ef3e1ff17ee5580c8 [1,0,0,0,0,0|3,0,0]=4 73 B16R2.6353 CCCCNc1ccnc2c1c(c[nH]2)C eb4a15feae0c095f8d74bf947e1638f9 [1,0,0,0,0,0|2,0,0]=3 74 B16R2.6353 CCCCNc1ccnc2c1c(c[nH]2)F 81a3b3899cc5ab8959cc838fa3a8a74e [1,0,0,0,0,0|3,0,0]=4 75 B16R2.6353 CCCCNc1ccnc2c1c(n[nH]2)C 933b58d30f44feacfae2d16641e10935 [1,0,0,0,0,0|3,0,0]=4 76 B16R2.6353 CCCCNc1nccc2c1c(c[nH]2)Br 649cb21512ee5bb067b7311cae9525cc [1,0,0,0,0,0|3,0,0]=4 77 B16R2.6353 CCCCNc1ncnc2c1c(c[nH]2)Br 0643c76ae5e88fa77f9253578116fb85 [1,0,0,0,0,0|2,0,0]=3 78 B16R2.6353 CCCCNc1ncnc2c1c(c[nH]2)C f868c43a4b394645d9aee08e5fcd352c [1,0,0,0,0,0|1,0,0]=2 79 B16R2.6353 CCCCNc1ncnc2c1c(c[nH]2)Cl 5d97c3f51329dae1631af356df7c255f [1,0,0,0,0,0|2,0,0]=3 80 B16R2.6353 CCCCNc1ncnc2c1c(c[nH]2)F 6a1e1baac02cec99eb8b419c12d3e15b [1,0,0,0,0,0|2,0,0]=3 81 B16R2.6353 CCCCNc1ncnc2c1c(c[nH]2)I 279a8f46737e2427f12b2e3a281ed46c [1,0,0,0,0,0|2,0,0]=3 82 B16R2.6353 CCCCNc1ncnc2c1c(co2)C 381adcb101e1ae77a3e4e5078bd48647 [1,0,0,0,0,0|2,0,0]=3 83 B16R2.6353 CCCCNc1ncnc2c1c(cs2)Br b91bb4d1d5758020ab644db225732fe6 [1,0,0,0,0,0|3,0,0]=4 84 B16R2.6353 CCCCNc1ncnc2c1c(n[nH]2)Br 9624256d19a5299a408dffa3a8151376 [1,0,0,0,0,0|3,0,0]=4 85 B16R2.6353 CCCCNc1ncnc2c1c(n[nH]2)C 7696a9b7ef8f54d9adbe29e18ade9145 [1,0,0,0,0,0|2,0,0]=3 86 B16R2.6353 CCCCNc1ncnc2c1c(n[nH]2)Cl df3e2e26755dd0a66ef87553119fe2a7 [1,0,0,0,0,0|3,0,0]=4 87 B16R2.6353 CCCCNc1ncnc2c1c(n[nH]2)I a34bfbc89de953c75166c0e9f3fc6bae [1,0,0,0,0,0|3,0,0]=4 88 B16R2.6353 CCCCNc1ncnc2c1c(no2)C 3e6e64cf7f000ef6c932efa91acd0aab [1,0,0,0,0,0|3,0,0]=4 89 B16R2.6353 CCCCNc1ncnc2c1n(cn2)C ef0a2ae292d33be53a94fcea098ccaa2 [1,0,0,0,0,0|2,0,1]=4 90 B16R2.6353 CCCCOc1ncnc2c1c(c[nH]2)Cl fba2163c2f5bc0e50469de1896fec99f [1,0,0,0,0,0|3,0,0]=4 91 B16R2.6353 CCCCOc1ncnc2c1c(n[nH]2)C bb38c23bcf00151afbc86fde3c0c8639 [1,0,0,0,0,0|3,0,0]=4 92 B16R2.6353 CCOCNc1ccnc2c1c(c[nH]2)C 23a696c64f583bb4468f10a28e8ba565 [1,0,0,0,0,0|3,0,0]=4 93 B16R2.6353 CCOCNc1ncnc2c1c(c[nH]2)Br 3dc944d908ae94c2a9e101a182d031ed [1,0,0,0,0,0|3,0,0]=4 94 B16R2.6353 CCOCNc1ncnc2c1c(c[nH]2)C f42ef58a6fdc480602bfa42ff56a8bdb [1,0,0,0,0,0|2,0,0]=3 95 B16R2.6353 CCOCNc1ncnc2c1c(c[nH]2)Cl a08f91ba0e3004bd9a49fe36d4efa2b3 [1,0,0,0,0,0|3,0,0]=4 96 B16R2.6353 CCOCNc1ncnc2c1c(c[nH]2)F 4e4c358465d551452105426060d5459e [1,0,0,0,0,0|3,0,0]=4 97 B16R2.6353 CCOCNc1ncnc2c1c(c[nH]2)I 85f9817c9b2f1c50e0b834b2ee80a8a3 [1,0,0,0,0,0|3,0,0]=4 98 B16R2.6353 CCOCNc1ncnc2c1c(co2)C e7960d27e77675d16225e7d98e640e42 [1,0,0,0,0,0|3,0,0]=4 99 B16R2.6353 CCOCNc1ncnc2c1c(n[nH]2)C 4b718f507515c9926ed9e67b9eb71108 [1,0,0,0,0,0|3,0,0]=4 100 B16R2.6353 COCCNc1ccnc2c1c(c[nH]2)C 433945ac444684ed3989b3cca3aa2f52 [1,0,0,0,0,0|3,0,0]=4 101 B16R2.6353 COCCNc1ncnc2c1c(c[nH]2)Br ad036a2ed0dbff477ab0b460a5c208dd [1,0,0,0,0,0|3,0,0]=4 102 B16R2.6353 COCCNc1ncnc2c1c(c[nH]2)C 1f06b434cdd03f13435d5428470452bd [1,0,0,0,0,0|2,0,0]=3 103 B16R2.6353 COCCNc1ncnc2c1c(c[nH]2)Cl 2a3febad6b91f0e5cd728048ef19e504 [1,0,0,0,0,0|3,0,0]=4 104 B16R2.6353 COCCNc1ncnc2c1c(c[nH]2)F ef8ddbf85bf458b00eb7289dc3ead9b3 [1,0,0,0,0,0|3,0,0]=4 105 B16R2.6353 COCCNc1ncnc2c1c(c[nH]2)I 876249e4dba138f81953b8e55caa36c0 [1,0,0,0,0,0|3,0,0]=4 106 B16R2.6353 COCCNc1ncnc2c1c(co2)C 2cbd08c4e94caa53153f28ada0cc6736 [1,0,0,0,0,0|3,0,0]=4 107 B16R2.6353 COCCNc1ncnc2c1c(n[nH]2)C 9b79b9d7a3388fec68e6100c3c9a6d55 [1,0,0,0,0,0|3,0,0]=4 108 B16R2.6353 CSCCNc1ccnc2c1c(c[nH]2)C 84cba29c7ae95381af5bead85dda14f7 [1,0,0,0,0,0|3,0,0]=4 109 B16R2.6353 CSCCNc1ncnc2c1c(c[nH]2)Br 446f45a41d98fd280978fb7eb9ecd011 [1,0,0,0,0,0|3,0,0]=4 110 B16R2.6353 CSCCNc1ncnc2c1c(c[nH]2)C 19ce8425f97bb90500bbe977550c5bb1 [1,0,0,0,0,0|2,0,0]=3 111 B16R2.6353 CSCCNc1ncnc2c1c(c[nH]2)Cl bc1298feb2ceaabecb83199b2b4e0953 [1,0,0,0,0,0|3,0,0]=4 112 B16R2.6353 CSCCNc1ncnc2c1c(c[nH]2)F 79abb51666382ce6cb0d90fad0656ec8 [1,0,0,0,0,0|3,0,0]=4 113 B16R2.6353 CSCCNc1ncnc2c1c(c[nH]2)I 0bac98873134a402ae27300daed16ac9 [1,0,0,0,0,0|3,0,0]=4 114 B16R2.6353 CSCCNc1ncnc2c1c(co2)C e1a04e295b79e437d663f3e01d3da36b [1,0,0,0,0,0|3,0,0]=4 115 B16R2.6353 CSCCNc1ncnc2c1c(n[nH]2)C 9ec996be03ccd3df4c746884cbfb7e2f [1,0,0,0,0,0|3,0,0]=4 116 B16R2.6353 C[C@@H]1CCc2c1c(ncn2)NCCCO 272d9556d23b56c99690e28c4b16a730 [1,0,0,0,0,0|1,0,2]=4 117 B16R2.6353 Cc1c[nH]c2c1c(ccc2)NCCCCl 8ac146ae29a5ea7831e15d1717561200 [1,0,0,0,0,0|3,0,0]=4 118 B16R2.6353 Cc1c[nH]c2c1c(ccc2)NCCCF 255cacf70818a608ef97ff2059a58c6f [1,0,0,0,0,0|3,0,0]=4 119 B16R2.6353 Cc1c[nH]c2c1c(ccc2)NCCCO e07cb3b484682f5b0d570228b5fd9e38 [1,0,0,0,0,0|2,0,0]=3 120 B16R2.6353 Cc1c[nH]c2c1c(ccc2)NCCCS 0329a38e233db19a7c04d2da9e41da9f [1,0,0,0,0,0|2,1,0]=4 121 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NC/C=C\O 99e892405f93eb254c0d43b791d56ca1 [1,0,0,0,0,0|1,0,2]=4 122 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCC#N 6f1e7c91d617df4e7fe665277b1323f5 [1,0,0,0,0,0|2,0,1]=4 123 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCC=O cef765cc34d24a53ee53b1d0c8b67ee4 [1,0,0,0,0,0|1,0,2]=4 124 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCCCl 7adc9ea646ea4335ede7dc6bce3c604f [1,0,0,0,0,0|2,0,0]=3 125 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCCF 16b5ca60a03d26ec62224658fce4b195 [1,0,0,0,0,0|2,0,0]=3 126 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCCO 51a2e0a6a75c083daa6ab459e4650405 [1,0,0,0,0,0|1,0,0]=2 127 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCCS 433eb838b49999acd7017397ba25ed0c [1,0,0,0,0,0|1,1,0]=3 128 B16R2.6353 Cc1c[nH]c2c1c(ccn2)NCCON a7e602a6460e9b6181566105c2a1bdbd [1,0,0,0,0,0|3,0,0]=4 129 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NC/C=C/Cl f4d59d7d665fb5b415b0bdb73c46f902 [1,0,0,0,0,0|1,0,2]=4 130 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NC/C=C\Cl 6af363cffc6b59254f96518eb642e165 [1,0,0,0,0,0|1,0,2]=4 131 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NC/C=C\O 684d05de18dd5e7a552b2fe081021c6a [1,0,0,0,0,0|0,0,2]=3 132 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCC#N 57e0230e982f97761fdcce77265b6753 [1,0,0,0,0,0|1,0,1]=3 133 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCC=O e32027cf8d0890b17f612552d47c7241 [1,0,0,0,0,0|0,0,2]=3 134 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCCCl d145bb76c65cec97acca567938f3fd08 [1,0,0,0,0,0|1,0,0]=2 135 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCCF 2c61ec3a596781c48f001e57f6b8226b [1,0,0,0,0,0|1,0,0]=2 136 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCCO 2c8293544054763e1781c913a490a820 [1,0,0,0,0,0|0,0,0]=1 137 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCCS 2f91309c7b491c83127de8ae57797377 [1,0,0,0,0,0|0,1,0]=2 138 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCCON 5ffdd7e527ed81dd531adc58f527ad93 [1,0,0,0,0,0|2,0,0]=3 139 B16R2.6353 Cc1c[nH]c2c1c(ncn2)NCSC#N dac1998c3fbbacbf0626a8d7080d873f [1,0,0,0,0,0|2,0,1]=4 140 B16R2.6353 Cc1ccn2c1c(ncc2)NCCCO e6520ae7709ff1f83cb01f5002e493df [1,0,0,0,0,0|3,0,0]=4 141 B16R2.6353 Cc1ccn2c1c(ncn2)NCCCCl b6cb19cc9e91717851a612c259c5a869 [1,0,0,0,0,0|3,0,0]=4 142 B16R2.6353 Cc1ccn2c1c(ncn2)NCCCO 225fe0d5dbb0ad2796b50dad205ae67f [1,0,0,0,0,0|2,0,0]=3 143 B16R2.6353 Cc1cnn2c1c(ncc2)NCCCO ad7717c67b88ded7f66d4939363d4ab0 [1,0,0,0,0,0|2,0,1]=4 144 B16R2.6353 Cc1coc2c1c(ncn2)NC/C=C\O 7228fc1c41f48b08c57e2104cb46dfb3 [1,0,0,0,0,0|1,0,2]=4 145 B16R2.6353 Cc1coc2c1c(ncn2)NCCC#N 25a89ada60efcb0399dd0f6f94786f7f [1,0,0,0,0,0|2,0,1]=4 146 B16R2.6353 Cc1coc2c1c(ncn2)NCCC=O 3b5d57b62a04f54d911b5c61de15bf0a [1,0,0,0,0,0|1,0,2]=4 147 B16R2.6353 Cc1coc2c1c(ncn2)NCCCF d2803cba472e7c877696e99efa0a59c2 [1,0,0,0,0,0|2,0,0]=3 148 B16R2.6353 Cc1coc2c1c(ncn2)NCCCO 7107327356307d39112f1e3cfac218c5 [1,0,0,0,0,0|1,0,0]=2 149 B16R2.6353 Cc1coc2c1c(ncn2)NCCCS dc5f488ab8587a85b5900930821aad60 [1,0,0,0,0,0|1,1,0]=3 150 B16R2.6353 Cc1coc2c1c(ncn2)NCCON 216acb27f0f4ba290dd58ed746f96bea [1,0,0,0,0,0|3,0,0]=4 151 B16R2.6353 Cc1csc2c1c(ncn2)NCCON 7e120382ae96a92a988a40143d8d5023 [1,0,0,0,0,0|3,0,0]=4 152 B16R2.6353 Cc1n[nH]c2c1c(ccn2)NCCCF fb7d8755734a55d244d24dce59d0dc76 [1,0,0,0,0,0|3,0,0]=4 153 B16R2.6353 Cc1n[nH]c2c1c(ccn2)NCCCO e24a32cd73e538a9c7b3de51d682e923 [1,0,0,0,0,0|2,0,0]=3 154 B16R2.6353 Cc1n[nH]c2c1c(ccn2)NCCCS dd7069420eff9a208993dd1b92415b92 [1,0,0,0,0,0|2,1,0]=4 155 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NC/C=C\O 52fdcdc5585eb1db237c76adae2c3743 [1,0,0,0,0,0|1,0,2]=4 156 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NCCC#N 3766f88bb13875ee6ed04a72fcdbcaed [1,0,0,0,0,0|2,0,1]=4 157 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NCCC=O c4b04587702ee451bb60440026bd215a [1,0,0,0,0,0|1,0,2]=4 158 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NCCCF fd2c9c84557dbd9e6b039f3f916c4284 [1,0,0,0,0,0|2,0,0]=3 159 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NCCCO c8030798ffc489e68589e0c9e58abba5 [1,0,0,0,0,0|1,0,0]=2 160 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NCCCS d362356b523ae22683eadaa7e6e42879 [1,0,0,0,0,0|1,1,0]=3 161 B16R2.6353 Cc1n[nH]c2c1c(ncn2)NCCON 5ee654c215d2ad62426d2b6d1ee0e3e9 [1,0,0,0,0,0|3,0,0]=4 162 B16R2.6353 Cc1n[nH]c2c1c(ncn2)OCCCF a3ea508b589b59d63bdf66c2dc4a5278 [1,0,0,0,0,0|3,0,0]=4 163 B16R2.6353 Cc1n[nH]c2c1c(ncn2)OCCCS 41093e02d8fc8ab0131502196d65253b [1,0,0,0,0,0|2,1,0]=4 164 B16R2.6353 Cc1noc2c1c(ncn2)NCCCF 2c672184716d58ceb7d7cefe62edea6a [1,0,0,0,0,0|3,0,0]=4 165 B16R2.6353 Cc1noc2c1c(ncn2)NCCCO 5532a0ec40e023b4dd37fe599179f8fb [1,0,0,0,0,0|2,0,0]=3 166 B16R2.6353 Cc1noc2c1c(ncn2)NCCCS 81ffa9df18f802e10c915d186f45cc20 [1,0,0,0,0,0|2,1,0]=4 167 B16R2.6353 Cn1ccc2c1c(ccn2)NCCCO 5be1fa64c6dc8c40277fc50733207ce7 [1,0,0,0,0,0|3,0,0]=4 168 B16R2.6353 Cn1cnc2c1c(ccn2)NCCCO 94518e2ba95c623a5d50261fa9d287b2 [1,0,0,0,0,0|2,0,1]=4 169 B16R2.6353 Cn1cnc2c1c(ncn2)NCCCF b2c18822b8dafef434aa9bfa55eb209a [1,0,0,0,0,0|2,0,1]=4 170 B16R2.6353 Cn1cnc2c1c(ncn2)NCCCO 153869bb778be741ea41852330d28cba [1,0,0,0,0,0|1,0,1]=3 171 B16R2.6353 Cn1cnc2c1c(ncn2)NCCCS feaba6a1d67c634ae25d27c474399881 [1,0,0,0,0,0|1,1,1]=4 172 B16R2.6353 FCCCNc1ccnc2c1c(c[nH]2)Br 498a39f0b93317d0647dbc02896330a1 [1,0,0,0,0,0|3,0,0]=4 173 B16R2.6353 FCCCNc1nccc2c1c(c[nH]2)Br d04d1776a5f3b84c86cc960b7382b4b5 [1,0,0,0,0,0|3,0,0]=4 174 B16R2.6353 FCCCNc1ncnc2c1c(c[nH]2)Br f2830f48c0e1def18fee969549b8c80d [1,0,0,0,0,0|2,0,0]=3 175 B16R2.6353 FCCCNc1ncnc2c1c(c[nH]2)Cl 033bac009485ddd5ef8f3d4e3db08735 [1,0,0,0,0,0|2,0,0]=3 176 B16R2.6353 FCCCNc1ncnc2c1c(c[nH]2)F 1b3da067c6a9624f573671405f2bf73d [1,0,0,0,0,0|2,0,0]=3 177 B16R2.6353 FCCCNc1ncnc2c1c(c[nH]2)I e0052fa16f26f8a86b9aa35d1a61f10f [1,0,0,0,0,0|2,0,0]=3 178 B16R2.6353 FCCCNc1ncnc2c1c(cs2)Br 487709bf9ae709fdae88099091ccade3 [1,0,0,0,0,0|3,0,0]=4 179 B16R2.6353 FCCCNc1ncnc2c1c(n[nH]2)Br c91a184f29448bbc7322c4ad52a33c0a [1,0,0,0,0,0|3,0,0]=4 180 B16R2.6353 FCCCNc1ncnc2c1c(n[nH]2)Cl 851d2e2afd5c7c442fb6059b94111c9a [1,0,0,0,0,0|3,0,0]=4 181 B16R2.6353 FCCCNc1ncnc2c1c(n[nH]2)I 6b63e047639438865d7b6ef9f4775bab [1,0,0,0,0,0|3,0,0]=4 182 B16R2.6353 FCCCOc1ncnc2c1c(c[nH]2)Cl 52718af37cfef8afee04d5602b44ae90 [1,0,0,0,0,0|3,0,0]=4 183 B16R2.6353 Fc1c[nH]c2c1c(ccn2)NCCCCl 4fde3579e4ef2e91a9539a9533325aed [1,0,0,0,0,0|3,0,0]=4 184 B16R2.6353 Fc1c[nH]c2c1c(ncn2)NCCCS 3ddf9384f4d00c68d43d76f84f5b088c [1,0,0,0,0,0|1,1,0]=3 185 B16R2.6353 N#CCCNc1ncnc2c1c(c[nH]2)Br d3f5b4c4ec69f4f7632b3ac0d5bc0676 [1,0,0,0,0,0|2,0,1]=4 186 B16R2.6353 N#CCCNc1ncnc2c1c(c[nH]2)Cl c9de851d065abf1f401e85c7197ac04a [1,0,0,0,0,0|2,0,1]=4 187 B16R2.6353 N#CCCNc1ncnc2c1c(c[nH]2)F e1dc8ebd1cfb19d90fd0a620bf552d49 [1,0,0,0,0,0|2,0,1]=4 188 B16R2.6353 N#CCCNc1ncnc2c1c(c[nH]2)I 18bac7241f9f3e17aaa390f595ab92b1 [1,0,0,0,0,0|2,0,1]=4 189 B16R2.6353 NOCCNc1ncnc2c1c(c[nH]2)F d4535c411551e4356c8578a980010a7a [1,0,0,0,0,0|3,0,0]=4 190 B16R2.6353 O/C=C\CNc1ncnc2c1c(c[nH]2)Br f629a6bb9740aade9caefbed0732e69d [1,0,0,0,0,0|1,0,2]=4 191 B16R2.6353 O/C=C\CNc1ncnc2c1c(c[nH]2)Cl fa355d86193b80f74e88696dc2998b9a [1,0,0,0,0,0|1,0,2]=4 192 B16R2.6353 O/C=C\CNc1ncnc2c1c(c[nH]2)F 81a6600af1e0a62e8dcf03363a4a6848 [1,0,0,0,0,0|1,0,2]=4 193 B16R2.6353 O/C=C\CNc1ncnc2c1c(c[nH]2)I fe634c5401595cd0843499213fb36669 [1,0,0,0,0,0|1,0,2]=4 194 B16R2.6353 O=CCCNc1ncnc2c1c(c[nH]2)Br 8f156f264c4a8fc6d754b0e45a6cf0a1 [1,0,0,0,0,0|1,0,2]=4 195 B16R2.6353 O=CCCNc1ncnc2c1c(c[nH]2)Cl a5eb79a1bb42c130fe4ac38c7cd1c6a6 [1,0,0,0,0,0|1,0,2]=4 196 B16R2.6353 O=CCCNc1ncnc2c1c(c[nH]2)F 1e90a5438ec9a6abf159ec66227ce13f [1,0,0,0,0,0|1,0,2]=4 197 B16R2.6353 O=CCCNc1ncnc2c1c(c[nH]2)I ec12354b04a2221e692b7270762404ce [1,0,0,0,0,0|1,0,2]=4 198 B16R2.6353 OCCCNc1ccnc2c1c(c[nH]2)Br 244420353b0229069b9792a0e0002f87 [1,0,0,0,0,0|2,0,0]=3 199 B16R2.6353 OCCCNc1ccnc2c1c(c[nH]2)F db3cfa4ad588cfed2ec30409ab29a70f [1,0,0,0,0,0|2,0,0]=3 200 B16R2.6353 OCCCNc1nccc2c1c(c[nH]2)Br 818ab85e23a963be347f4b7f180e4ee4 [1,0,0,0,0,0|2,0,0]=3 201 B16R2.6353 OCCCNc1nccc2c1c(co2)Br 95e1a27a1e131850e45e0cbe60b1a6b4 [1,0,0,0,0,0|3,0,0]=4 202 B16R2.6353 OCCCNc1nccc2c1c(cs2)Br e3fd7ec5667407e97e18932035c8bb54 [1,0,0,0,0,0|3,0,0]=4 203 B16R2.6353 OCCCNc1nccc2c1c(n[nH]2)I 3bff429d0b01980813335cea7538f550 [1,0,0,0,0,0|3,0,0]=4 204 B16R2.6353 OCCCNc1ncnc2c1c(c[nH]2)Br 945817810dcd270e5090915d796e864d [1,0,0,0,0,0|1,0,0]=2 205 B16R2.6353 OCCCNc1ncnc2c1c(c[nH]2)Cl 09764ab9635d76e8710d152a5bcf4fed [1,0,0,0,0,0|1,0,0]=2 206 B16R2.6353 OCCCNc1ncnc2c1c(c[nH]2)F 260b4f8c6ab2d5180ac75d3cbaa3749f [1,0,0,0,0,0|1,0,0]=2 207 B16R2.6353 OCCCNc1ncnc2c1c(c[nH]2)I 10e82ffa74ae22bb561e1ffd8913bbdf [1,0,0,0,0,0|1,0,0]=2 208 B16R2.6353 OCCCNc1ncnc2c1c(cs2)Br f503139a15f82f7e81b5a3c4b151a6a4 [1,0,0,0,0,0|2,0,0]=3 209 B16R2.6353 OCCCNc1ncnc2c1c(n[nH]2)Br 6e3c51d58fdebcb2136c0650b9927701 [1,0,0,0,0,0|2,0,0]=3 210 B16R2.6353 OCCCNc1ncnc2c1c(n[nH]2)Cl 0db95395d71429bc5130f8c5cf92f46a [1,0,0,0,0,0|2,0,0]=3 211 B16R2.6353 OCCCNc1ncnc2c1c(n[nH]2)I 53438f5e9235e893eddc302e3e5a3c31 [1,0,0,0,0,0|2,0,0]=3 212 B16R2.6353 OCCCNc1ncnn2c1c(cc2)Br 3a4ed81f316d6ecbbbbad4c1e8b085c5 [1,0,0,0,0,0|3,0,0]=4 213 B16R2.6353 SCCCNc1ccnc2c1c(c[nH]2)Br 2a9cf7b51e9656a46153095b4bfc9e6e [1,0,0,0,0,0|2,1,0]=4 214 B16R2.6353 SCCCNc1nccc2c1c(c[nH]2)Br 8c953cf8b8e2f713b1895f8fce4018e8 [1,0,0,0,0,0|2,1,0]=4 215 B16R2.6353 SCCCNc1ncnc2c1c(c[nH]2)Br b5083b1db2201c2c6e0d07c415a697ea [1,0,0,0,0,0|1,1,0]=3 216 B16R2.6353 SCCCNc1ncnc2c1c(c[nH]2)Cl 29fa13c70dc023a7015a5cb77669ebd6 [1,0,0,0,0,0|1,1,0]=3 217 B16R2.6353 SCCCNc1ncnc2c1c(c[nH]2)I c409161a77e45a5b9f436d90edf09ca4 [1,0,0,0,0,0|1,1,0]=3 218 B16R2.6353 SCCCNc1ncnc2c1c(cs2)Br 5e5608fe456aded9b70f0b96bb1feff7 [1,0,0,0,0,0|2,1,0]=4 219 B16R2.6353 SCCCNc1ncnc2c1c(n[nH]2)Br 2b6adb38c44a0775381e28b98076c9dc [1,0,0,0,0,0|2,1,0]=4 220 B16R2.6353 SCCCNc1ncnc2c1c(n[nH]2)Cl 5acc96c33377a1d310e2b3648de13db4 [1,0,0,0,0,0|2,1,0]=4 221 B16R2.6353 SCCCNc1ncnc2c1c(n[nH]2)I 2da5f3a2981ddc70c9dd0b37304e5224 [1,0,0,0,0,0|2,1,0]=4 222 B16R2.6353 SCCCOc1ncnc2c1c(c[nH]2)Cl b2e71188f027ff2805253a72bdd778ea [1,0,0,0,0,0|2,1,0]=4 223 B16R2.32148 C#CCNc1ncnc2c1c(n[nH]2)SC 0644aec2df9a0224af2bab8b50ecd8be [1,0,0,0,0,0|1,0,2]=4 224 B16R2.32148 C=CCNc1ncnc2c1c(n[nH]2)SC 57bfac483dd710db52a01e161b700337 [1,0,0,0,0,0|1,0,2]=4 225 B16R2.32148 CCCNc1ccnc2c1c(c[nH]2)C=O 441cdc18640df10bc4da5bb203d03681 [1,0,0,0,0,0|3,0,0]=4 226 B16R2.32148 CCCNc1nccc2c1c(c[nH]2)C=O cbfe869b5ebdb619226549d5ef828726 [1,0,0,0,0,0|3,0,0]=4 227 B16R2.32148 CCCNc1ncnc2c1c(c[nH]2)CC 8339829540ae976e6721e3476720371d [1,0,0,0,0,0|1,0,0]=2 228 B16R2.32148 CCCNc1ncnc2c1c(n[nH]2)C#N 75219fa6b2784a92e4b4e65c8c407104 [1,0,0,0,0,0|3,0,0]=4 229 B16R2.32148 CCCNc1ncnc2c1c(n[nH]2)SC ac013c904f63627c9944089da17c9fce [1,0,0,0,0,0|1,0,0]=2 230 B16R2.32148 CCc1c[nH]c2c1c(ncn2)NCC#N ece2056106b2278649983f8e13129782 [1,0,0,0,0,0|2,0,1]=4 231 B16R2.32148 CCc1c[nH]c2c1c(ncn2)NCCBr 5cfd8311c010ddace13d95fc4db62c62 [1,0,0,0,0,0|2,0,0]=3 232 B16R2.32148 CCc1c[nH]c2c1c(ncn2)NCCF 5f96cb90de06ffff8cb8f5c77580a44d [1,0,0,0,0,0|2,0,0]=3 233 B16R2.32148 CCc1c[nH]c2c1c(ncn2)NCCI 3c6d32205d26ec56147a5c9164068410 [1,0,0,0,0,0|2,0,0]=3 234 B16R2.32148 CCc1c[nH]c2c1c(ncn2)NCCO 2092781d09216275cb47f9c11af2a8b7 [1,0,0,0,0,0|1,0,0]=2 235 B16R2.32148 CCc1c[nH]c2c1c(ncn2)NCCS 606f89d71f51c7d00500833e4ab1ce18 [1,0,0,0,0,0|1,1,0]=3 236 B16R2.32148 COCNc1ncnc2c1c(n[nH]2)SC 7e2a4dc8895807c1686dddb0530a5c2d [1,0,0,0,0,0|2,0,0]=3 237 B16R2.32148 CSCNc1ncnc2c1c(n[nH]2)SC b1b8ccf916f9dab2c3e667dc5aa77726 [1,0,0,0,0,0|2,0,0]=3 238 B16R2.32148 CSc1c[nH]c2c1c(ncn2)NCCBr c7dfbc03ce3808614c181f44252a27c5 [1,0,0,0,0,0|1,0,0]=2 239 B16R2.32148 CSc1c[nH]c2c1c(ncn2)NCCF 24e3411aa0e09df11e7053dfcbe25a48 [1,0,0,0,0,0|1,0,0]=2 240 B16R2.32148 CSc1c[nH]c2c1c(ncn2)NCCO f3709c1d8f8b566fd657ab71f5f11096 [1,0,0,0,0,0|0,0,0]=1 241 B16R2.32148 CSc1c[nH]c2c1c(ncn2)NCCS 77b22327df16a52cabe48db055432cfa [1,0,0,0,0,0|0,1,0]=2 242 B16R2.32148 CSc1n[nH]c2c1c(ncn2)NCC#N a1a8fcf4c16c53be4e8cc97c714e14ee [1,0,0,0,0,0|2,0,1]=4 243 B16R2.32148 CSc1n[nH]c2c1c(ncn2)NCC=O 54392c27659a0c159d8b05ba49747abd [1,0,0,0,0,0|1,0,2]=4 244 B16R2.32148 CSc1n[nH]c2c1c(ncn2)NCCF ab0d955e202f95fcb2640934443d66f3 [1,0,0,0,0,0|2,0,0]=3 245 B16R2.32148 CSc1n[nH]c2c1c(ncn2)NCCO 6d1482fdf0cf6ab0a8b983ace650f5e7 [1,0,0,0,0,0|1,0,0]=2 246 B16R2.32148 CSc1n[nH]c2c1c(ncn2)NCCS 1713464fed0db1d34ce31abeeb1d8165 [1,0,0,0,0,0|1,1,0]=3 247 B16R2.32148 N#Cc1n[nH]c2c1c(ncn2)NCCO 04259cdfe5e2673531fa04888877681a [1,0,0,0,0,0|3,0,0]=4 248 B16R2.32148 O=Cc1c[nH]c2c1c(ccn2)NCCO f2130fef060c2974db8641abbfecb2fd [1,0,0,0,0,0|3,0,0]=4 249 B16R2.32148 O=Cc1c[nH]c2c1c(ncc2)NCCO b9b6fd275d69553299536718786be94e [1,0,0,0,0,0|3,0,0]=4 250 B18R2.145788 OCCCNc1cccc2c1c(c[nH]2)CCO b64efac2f2e06e47888adb8d4d1f9737 [0,1,0,0,0,0|3,0,0]=4 251 B18R2.145789 C=CCCNc1ncnc2c1c(c[nH]2)C(=O)C 72a6ec52692d2be69faee8ae9dbba3f1 [0,1,0,0,0,0|2,0,1]=4 252 B18R2.145789 C=CCCNc1ncnc2c1c(c[nH]2)S(=O)C 32dd649fc183ec18a1772b319d4dbfda [0,1,0,0,0,0|1,0,2]=4 253 B18R2.145789 CC(=O)c1c[nH]c2c1c(ccc2)NCCCO dce369aba3ca0bd64adcba6c247f9029 [0,1,0,0,0,0|3,0,0]=4 254 B18R2.145789 CC(=O)c1c[nH]c2c1c(ccn2)NCCCCl 5b68c08712c95d53d8d7c7836f79b62d [0,1,0,0,0,0|3,0,0]=4 255 B18R2.145789 CC(=O)c1c[nH]c2c1c(ccn2)NCCCO b9f9be768e5259c99ab1a6c927daefc3 [0,1,0,0,0,0|2,0,0]=3 256 B18R2.145789 CC(=O)c1c[nH]c2c1c(ncn2)NCCC#N 48edcce8470330854ee176d6458f3217 [0,1,0,0,0,0|2,0,1]=4 257 B18R2.145789 CC(=O)c1c[nH]c2c1c(ncn2)NCCCCl 2034bdbb80999233ca3d7b8e2a98fde7 [0,1,0,0,0,0|2,0,0]=3 258 B18R2.145789 CC(=O)c1c[nH]c2c1c(ncn2)NCCCO 530e495ab05fb67ed897afbd88609715 [0,1,0,0,0,0|1,0,0]=2 259 B18R2.145789 CC(=O)c1c[nH]c2c1c(ncn2)NCCON 810d410b7ab2d2bcc79051adc4aa489c [0,1,0,0,0,0|3,0,0]=4 260 B18R2.145789 CC(C)c1ccn2c1c(ncn2)NCCCO 081172dcc3bc1a6f8ccfd81d056a38db [0,1,0,0,0,0|3,0,0]=4 261 B18R2.145789 CC(C)c1n[nH]c2c1c(ncn2)NCCCF b05756dea8195ddbf20c63acb9a042aa [0,1,0,0,0,0|3,0,0]=4 262 B18R2.145789 CC(C)c1n[nH]c2c1c(ncn2)NCCCO 6a1a2365abe1d4e259ca7f61f672de85 [0,1,0,0,0,0|2,0,0]=3 263 B18R2.145789 CC(C)c1n[nH]c2c1c(ncn2)NCCCS d5c05095d7a14e2d356e6fbacec9a2e7 [0,1,0,0,0,0|2,1,0]=4 264 B18R2.145789 CCCCNc1ccnc2c1c(c[nH]2)C(=O)C 6f3e6bc3da3331acf274cda980ab45da [0,1,0,0,0,0|3,0,0]=4 265 B18R2.145789 CCCCNc1ncnc2c1c(c[nH]2)C(=O)C 52830fd7828b16f70c6297e1e3656a5d [0,1,0,0,0,0|2,0,0]=3 266 B18R2.145789 CCCCNc1ncnc2c1c(c[nH]2)C(=O)N 9da9114e67bfae5217eb285979d1c563 [0,1,0,0,0,0|3,0,0]=4 267 B18R2.145789 CCCCNc1ncnc2c1c(c[nH]2)C(=O)O e26e76d2866d40db690bf6a60a94e2a5 [0,1,0,0,0,0|3,0,0]=4 268 B18R2.145789 CCCCNc1ncnc2c1c(n[nH]2)C(C)C be5b317c2d9b37bc1d69d95f40d08e24 [0,1,0,0,0,0|3,0,0]=4 269 B18R2.145789 COCCNc1ncnc2c1c(c[nH]2)C(=O)C d815f937e2c913392c35da5bd50bb0d4 [0,1,0,0,0,0|3,0,0]=4 270 B18R2.145789 COCCNc1ncnc2c1c(c[nH]2)S(=O)C 81f20a060a505a226652fbdb7a25b1ad [0,1,0,0,0,0|2,0,1]=4 271 B18R2.145789 CS(=O)c1c[nH]c2c1c(ncn2)NCCCO 6b8a86dd8bdc4f1007ddf2185e734453 [0,1,0,0,0,0|0,0,1]=2 272 B18R2.145789 CS(=O)c1c[nH]c2c1c(ncn2)NCCON af83c4fdc53812d67cf52c632e97ffd4 [0,1,0,0,0,0|2,0,1]=4 273 B18R2.145789 CSCCNc1ncnc2c1c(c[nH]2)C(=O)C bab31b7f7108ad1c349ae28fd197680c [0,1,0,0,0,0|3,0,0]=4 274 B18R2.145789 CSCCNc1ncnc2c1c(c[nH]2)S(=O)C 1d4ba7231a345fb0ffd026a99c90e5a2 [0,1,0,0,0,0|2,0,1]=4 275 B18R2.145789 NC(=O)c1c[nH]c2c1c(ncn2)NCCCCl d0d6b4878c1e7cc0649ce33194f1495c [0,1,0,0,0,0|3,0,0]=4 276 B18R2.145789 NC(=O)c1c[nH]c2c1c(ncn2)NCCCO 13581bd875920504017fdc85193b2f6d [0,1,0,0,0,0|2,0,0]=3 277 B18R2.145789 O=C(O)c1c[nH]c2c1c(ncn2)NCCCF cb8454c0e71ea2970864f223490189d4 [0,1,0,0,0,0|3,0,0]=4 278 B18R2.145789 O=C(O)c1c[nH]c2c1c(ncn2)NCCCO 58832b69ce05ed7f34f0149d413c188d [0,1,0,0,0,0|2,0,0]=3 279 B18R2.145789 O=C(O)c1c[nH]c2c1c(ncn2)NCCCS b2a530a079a452bafbfb50425756d03d [0,1,0,0,0,0|2,1,0]=4 280 B18R2.145792 CCCCNc1ncnc2c1c(c([nH]2)Br)C#N 0e8d4746445ac2ebe203a5e9b2131110 [0,1,0,0,0,0|3,0,0]=4 281 B18R2.145792 N#Cc1c([nH]c2c1c(ncn2)NCCCF)Br b80716db9ab0f02bbc2f2fcd63b697dd [0,1,0,0,0,0|3,0,0]=4 282 B18R2.145792 N#Cc1c([nH]c2c1c(ncn2)NCCCO)Br ac6d5258f1030695b77dd99a282dc11b [0,1,0,0,0,0|2,0,0]=3 283 B18R2.145792 N#Cc1c([nH]c2c1c(ncn2)NCCCS)Br f85eecca77424f50bd9892de08190a16 [0,1,0,0,0,0|2,1,0]=4 284 B18R2.145795 Cn1cc(c2c1ccnc2NCCCO)C=O a0ca1c24bb7927a0fc18793a9bbfb46b [0,1,0,0,0,0|3,0,0]=4 285 B18R2.268093 C#CCCCNc1ncnc2c1c(n[nH]2)SC 2b444d66b855b0e2c81107755b904fac [0,1,0,0,0,0|2,0,0]=3 286 B18R2.268093 C=CCCCNc1ncnc2c1c(c[nH]2)CC f112c6c64fc9a78f2773d7e4d3cd7bc3 [0,1,0,0,0,0|2,0,0]=3 287 B18R2.268093 C=CCCCNc1ncnc2c1c(c[nH]2)CO c33b358270ddc76e5541ad830e2e0ae3 [0,1,0,0,0,0|3,0,0]=4 288 B18R2.268093 C=CCCCNc1ncnc2c1c(c[nH]2)SC ea213091ec50b0cbeeb8f97a698d5d9b [0,1,0,0,0,0|1,0,0]=2 289 B18R2.268093 C=CCCCNc1ncnc2c1c(n[nH]2)SC 8abd5a8cee1a7d5f620b8ade1ce966f2 [0,1,0,0,0,0|2,0,0]=3 290 B18R2.268093 C=COCCNc1ncnc2c1c(c[nH]2)CC 98b28f77c04b20d3c24c36703a144a0d [0,1,0,0,0,0|2,0,1]=4 291 B18R2.268093 C=COCCNc1ncnc2c1c(c[nH]2)SC ee7a6f54f498e257cd836ef0abb6221c [0,1,0,0,0,0|1,0,1]=3 292 B18R2.268093 CC/C=C/CNc1ncnc2c1c(n[nH]2)SC 262852482fa382635da7dec3ccb67e18 [0,1,0,0,0,0|2,0,1]=4 293 B18R2.268093 CCCCCNc1ncnc2c1c(c[nH]2)CC dd65a413354b7d576332ad1509f9d803 [0,1,0,0,0,0|2,0,0]=3 294 B18R2.268093 CCCCCNc1ncnc2c1c(n[nH]2)SC 8869bb7c2e6e36500b4675ee99c4316a [0,1,0,0,0,0|2,0,0]=3 295 B18R2.268093 CCOCCNc1ncnc2c1c(c[nH]2)CC 5e5e19e0edd6c70e69400c39a2f2f560 [0,1,0,0,0,0|2,0,0]=3 296 B18R2.268093 CCOCCNc1ncnc2c1c(c[nH]2)CO e0d6af3b233084a20826dcf049a65b2b [0,1,0,0,0,0|3,0,0]=4 297 B18R2.268093 CCOCCNc1ncnc2c1c(c[nH]2)SC 456bfbceb7c9f616bfd5e108adbbdde4 [0,1,0,0,0,0|1,0,0]=2 298 B18R2.268093 CCOCCNc1ncnc2c1c(n[nH]2)SC ab7ce1751aa7d43276a40ae5a4d42e60 [0,1,0,0,0,0|2,0,0]=3 299 B18R2.268093 CCSCCNc1ncnc2c1c(c[nH]2)CC 0a70f7d5b5efb8f5e60d274d284ba154 [0,1,0,0,0,0|2,0,0]=3 300 B18R2.268093 CCSCCNc1ncnc2c1c(n[nH]2)SC 16a332974f036d3e59fca34320354e30 [0,1,0,0,0,0|2,0,0]=3 301 B18R2.268093 CCc1c[nH]c2c1c(ncn2)NCC#CCO 28517590c1049c656ca161268cf5e0e8 [0,1,0,0,0,0|1,0,1]=3 302 B18R2.268093 CCc1c[nH]c2c1c(ncn2)NCCCCCl de3fe8009d20551658cb2292fcef0fa6 [0,1,0,0,0,0|2,0,0]=3 303 B18R2.268093 CCc1c[nH]c2c1c(ncn2)NCCCCO 4a93ba9d8a489c0bea2ab1e118997765 [0,1,0,0,0,0|1,0,0]=2 304 B18R2.268093 CCc1c[nH]c2c1c(ncn2)NCCCCS cf8699c263defddfa0085166dc53a7b4 [0,1,0,0,0,0|1,1,0]=3 305 B18R2.268093 CCc1c[nH]c2c1c(ncn2)NCCCOC 0b3aab3229a6f5447d2be202fb2575cc [0,1,0,0,0,0|1,0,0]=2 306 B18R2.268093 CCc1c[nH]c2c1c(ncn2)NCCCSC a3437dd7897ca1f999ed16d4dfa1f08d [0,1,0,0,0,0|1,1,0]=3 307 B18R2.268093 COCCCNc1ccnc2c1c(c[nH]2)C=O 052cdfd0b7c09ed33b4072eb4bc0a39a [0,1,0,0,0,0|3,0,0]=4 308 B18R2.268093 COCCCNc1nccc2c1c(c[nH]2)C=O 428df8f66a5d544adf324b486133a609 [0,1,0,0,0,0|3,0,0]=4 309 B18R2.268093 COCCCNc1ncnc2c1c(n[nH]2)C#N f90def3d401c2efdb44ca93a422af9cd [0,1,0,0,0,0|3,0,0]=4 310 B18R2.268093 COCCCNc1ncnc2c1c(n[nH]2)SC 0bdaa2ce200438c44908b8fb4b4dd2a1 [0,1,0,0,0,0|1,0,0]=2 311 B18R2.268093 CSCCCNc1ncnc2c1c(c[nH]2)CO 4b02a874fec197954dfe0075d5fb95fb [0,1,0,0,0,0|2,1,0]=4 312 B18R2.268093 CSCCCNc1ncnc2c1c(n[nH]2)SC 6d91f94af08f61946da3d10ccaf49ef0 [0,1,0,0,0,0|1,1,0]=3 313 B18R2.268093 CSc1c[nH]c2c1c(ncn2)NCC#CCO 180d4cfcd471043e1371aa7cba3223e3 [0,1,0,0,0,0|0,0,1]=2 314 B18R2.268093 CSc1c[nH]c2c1c(ncn2)NCCCCCl 8f7618720d0f138bf47df84dfabea153 [0,1,0,0,0,0|1,0,0]=2 315 B18R2.268093 CSc1c[nH]c2c1c(ncn2)NCCCCO 48f8261eb43f88251685633a12217440 [0,1,0,0,0,0|0,0,0]=1 316 B18R2.268093 CSc1n[nH]c2c1c(ncn2)NCCCC#N 59e50e372d1bd87b9f5763045a3e7210 [0,1,0,0,0,0|2,0,0]=3 317 B18R2.268093 CSc1n[nH]c2c1c(ncn2)NCCCC=O 170ce5f56043c9b1d174607ff98ed78b [0,1,0,0,0,0|1,0,1]=3 318 B18R2.268093 CSc1n[nH]c2c1c(ncn2)NCCCCF e1adf982f500a450488c700e8f2622ed [0,1,0,0,0,0|2,0,0]=3 319 B18R2.268093 CSc1n[nH]c2c1c(ncn2)NCCCCO d597149f7d00fa5725185d75fcb84cb7 [0,1,0,0,0,0|1,0,0]=2 320 B18R2.268093 N#Cc1n[nH]c2c1c(ncn2)NCCCCO c0784205400676e67cc756c8f4b33576 [0,1,0,0,0,0|3,0,0]=4 321 B18R2.268093 O=Cc1c[nH]c2c1c(ccn2)NCCCCO a712c305b6b91a20ee737d8fa3142b1f [0,1,0,0,0,0|3,0,0]=4 322 B18R2.268093 O=Cc1c[nH]c2c1c(ncc2)NCCCCO d8f19076c4648308c9227c1e075704fa [0,1,0,0,0,0|3,0,0]=4 323 B18R2.268093 O=Cc1c[nH]c2c1c(ncn2)NCCCCCl a1d5371a6fc48632ae47e85a417b97bb [0,1,0,0,0,0|3,0,0]=4 324 B18R2.268093 OCCCCNc1ncnc2c1c(c[nH]2)CO 42f270b6021c3747183cc6952a71cbc1 [0,1,0,0,0,0|2,0,0]=3 325 B18R2.268093 OCc1c[nH]c2c1c(ncn2)NCCCCCl d99dd4311f4da7dab62e29a0c53dfe4d [0,1,0,0,0,0|3,0,0]=4 326 B18R2.622812 CC(CCO)Nc1ccnc2c1c(c[nH]2)C=O d5461a383517d513f74061193abb8c4c [0,1,0,0,0,0|3,0,0]=4 327 B18R2.622812 CC(CCO)Nc1nccc2c1c(c[nH]2)C=O a56b094a7397f2b0cc65765ab52ea18b [0,1,0,0,0,0|3,0,0]=4 328 B18R2.622812 CCCC(C)Nc1ncnc2c1c(c[nH]2)CC bd5a5ae7c91a0f53b108c615640e475e [0,1,0,0,0,0|2,0,0]=3 329 B18R2.622812 CCCC(C)Nc1ncnc2c1c(n[nH]2)SC 0b5b929a2c9ab823c39f25fbe4dd7023 [0,1,0,0,0,0|2,0,0]=3 330 B18R2.622812 CCC[C@H](C)Nc1ncnc2c1c(c[nH]2)CC 5a8ccb2cece69aee838b730ea323f313 [0,1,0,0,0,0|2,0,0]=3 331 B18R2.622812 CCc1c[nH]c2c1c(ncn2)NC(C)CCO 9767231be87d14fb6458ae72aee1f75e [0,1,0,0,0,0|1,0,0]=2 332 B18R2.622812 CCc1c[nH]c2c1c(ncn2)NC(C)COC d27bd9ee19c23228732d910722d7b475 [0,1,0,0,0,0|3,0,0]=4 333 B18R2.622812 CCc1c[nH]c2c1c(ncn2)N[C@@H](C)CCO b8ee42304d69b8dec1224acb29f2f70d [0,1,0,0,0,0|1,0,0]=2 334 B18R2.622812 CCc1c[nH]c2c1c(ncn2)N[C@@H](C)COC 411594045e3deefbebcaeb376549ae5e [0,1,0,0,0,0|3,0,0]=4 335 B18R2.622812 CCc1c[nH]c2c1c(ncn2)N[C@H](C)CCO 27b6e26e0eb5900a439339600de12ec4 [0,1,0,0,0,0|1,0,0]=2 336 B18R2.622812 CCc1c[nH]c2c1c(ncn2)N[C@H](C)COC 81ebde53e52ccce5b967c987f90e24ff [0,1,0,0,0,0|3,0,0]=4 337 B18R2.622812 COCC(C)Nc1ncnc2c1c(n[nH]2)SC 0414d97d84ff77b3446ba4f4faef2efa [0,1,0,0,0,0|3,0,0]=4 338 B18R2.622812 CSc1n[nH]c2c1c(ncn2)NC(C)CC#N 42910b10e1c4a3f9c45c48e66af72f4b [0,1,0,0,0,0|2,0,1]=4 339 B18R2.622812 C[C@@H](CCO)Nc1ccnc2c1c(c[nH]2)C=O 487828a88fa21037c76ec6f46db4a6c0 [0,1,0,0,0,0|3,0,0]=4 340 B18R2.622812 C[C@@H](CCO)Nc1nccc2c1c(c[nH]2)C=O 3575da6bef80805cb505ec36afdaef83 [0,1,0,0,0,0|3,0,0]=4 341 B18R2.622812 C[C@H](CCO)Nc1ccnc2c1c(c[nH]2)C=O 7e1d39b8bec29342e469d5c3f83d49e5 [0,1,0,0,0,0|3,0,0]=4 342 B18R2.622812 C[C@H](CCO)Nc1nccc2c1c(c[nH]2)C=O e5ca9e1c34cab9198319ce5c0b96272a [0,1,0,0,0,0|3,0,0]=4 343 B18R2.859145 C=C(C)CCNc1ncnc2c1c(c[nH]2)CC 2204550ee3dddad34bfc6834a1927403 [0,1,0,0,0,0|2,0,1]=4 344 B18R2.859145 C=C(C)CCNc1ncnc2c1c(n[nH]2)SC 87f3e4849c09e4d1012201b0e8c0a088 [0,1,0,0,0,0|2,0,1]=4 345 B18R2.859145 CC(O)CCNc1ccnc2c1c(c[nH]2)C=O 270642d6d262ffd7add55e3c024b73d2 [0,1,0,0,0,0|3,0,0]=4 346 B18R2.859145 CC(O)CCNc1nccc2c1c(c[nH]2)C=O 121b158851a4327cd35565fd57ce69ac [0,1,0,0,0,0|3,0,0]=4 347 B18R2.859145 CC(O)CCNc1ncnc2c1c(n[nH]2)C#N 2a7e219af94833c77ed93701bf851a01 [0,1,0,0,0,0|3,0,0]=4 348 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCC(=O)N a476a5e6a82fb8fe8934d42fc3f5dbbc [0,1,0,0,0,0|1,0,2]=4 349 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCC(=O)O 8f3b95caa16d65133dc17cd1be448bb6 [0,1,0,0,0,0|1,0,1]=3 350 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCC(=S)N d65c4384a1b38613a4779fbd516e6df4 [0,1,0,0,0,0|1,1,1]=4 351 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCC(C)C 28d3a5815a4f5caeade0d921c084836c [0,1,0,0,0,0|2,0,0]=3 352 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCC(C)O 1a8b1c53b1ac11a234b51120505c7148 [0,1,0,0,0,0|1,0,0]=2 353 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCC(F)F 7a81accd94d3dfd906a197cc998e26d6 [0,1,0,0,0,0|2,0,0]=3 354 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCN(C)C 9b7d1bfb667f15a40cf31de7bb939589 [0,1,0,0,0,0|3,0,0]=4 355 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCS(=O)C 4c5976c67c55206cfbe68dbe4f3face6 [0,1,0,0,0,0|2,0,1]=4 356 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCCS(=O)O 750ba39dc9a1c19ec9f9c9144fbfa1ba [0,1,0,0,0,0|2,0,0]=3 357 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCC[C@@H](C)O 63620235355bb1a46dacccde76565823 [0,1,0,0,0,0|1,0,0]=2 358 B18R2.859145 CCc1c[nH]c2c1c(ncn2)NCC[C@H](C)O edd53ab0cb1a6735cca5fa0c1f07f287 [0,1,0,0,0,0|1,0,0]=2 359 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCC=C(C)C 31d67373aab263fa296460194c2e287f [0,1,0,0,0,0|1,0,2]=4 360 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCCC(=O)N 10ef24d6149b5711a37199dad961760d [0,1,0,0,0,0|0,0,2]=3 361 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCCC(=S)N e8bce466bf90e2476e7b015082e5898e [0,1,0,0,0,0|0,1,1]=3 362 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCCC(C)O b892ef525cecd8600d4b003ff76a16ef [0,1,0,0,0,0|0,0,0]=1 363 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCCC(F)F fc19733bd65d624921d935c6b91a2288 [0,1,0,0,0,0|1,0,0]=2 364 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCCS(=O)C 5c9b996ba52544bcd220b622b80e7545 [0,1,0,0,0,0|1,0,1]=3 365 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCCS(=O)O 90a6adcc4e5147fd58c478254bd17b38 [0,1,0,0,0,0|1,0,0]=2 366 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCC[C@@H](C)O 9536a275ed7694c5de6efdf7f5bd2dc0 [0,1,0,0,0,0|0,0,0]=1 367 B18R2.859145 CSc1c[nH]c2c1c(ncn2)NCC[C@H](C)O 605234905780dd3030e5d1719c0ebc97 [0,1,0,0,0,0|0,0,0]=1 368 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCC(=O)C 2580244fea6118ce67c76d300174e1e6 [0,1,0,0,0,0|1,0,2]=4 369 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCC(=O)N e23d65a59da1d021fc80c45aaa57ab53 [0,1,0,0,0,0|1,0,2]=4 370 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCC(=O)O c52d6953eef664b673d8c5283e2ecf3b [0,1,0,0,0,0|1,0,1]=3 371 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCC(C)C d896eac01d63c6da9797030ce2566d69 [0,1,0,0,0,0|2,0,0]=3 372 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCC(C)O 84f8464239c14b3062a3a06cdd5afbb9 [0,1,0,0,0,0|1,0,0]=2 373 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCN(C)C 069e9380963eaccd462529762659a32c [0,1,0,0,0,0|3,0,0]=4 374 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCCS(=O)C a81ace8f9addaf86fb300afaa1f60714 [0,1,0,0,0,0|2,0,1]=4 375 B18R2.859145 CSc1n[nH]c2c1c(ncn2)NCOC(C)C 40ded4568919e1b91589d617f9565643 [0,1,0,0,0,0|3,0,0]=4 376 B18R2.859145 C[C@@H](O)CCNc1ccnc2c1c(c[nH]2)C=O cadfb2ee3ae64c11c52b9306f0a14354 [0,1,0,0,0,0|3,0,0]=4 377 B18R2.859145 C[C@@H](O)CCNc1nccc2c1c(c[nH]2)C=O 144814ade7ea66c1241bd80d5f4ade3e [0,1,0,0,0,0|3,0,0]=4 378 B18R2.859145 C[C@H](O)CCNc1ccnc2c1c(c[nH]2)C=O b67659197f415ade78afd8b907240765 [0,1,0,0,0,0|3,0,0]=4 379 B18R2.859145 C[C@H](O)CCNc1nccc2c1c(c[nH]2)C=O 4ed3a49a1145967902938c4509001838 [0,1,0,0,0,0|3,0,0]=4 380 B18R2.859145 O=Cc1c[nH]c2c1c(ncn2)NCCS(=O)O 9f7c73614746eded18ccacea1951d225 [0,1,0,0,0,0|3,0,0]=4 381 B18R2.859145 O=S(O)CCNc1ncnc2c1c(c[nH]2)CO b3a61fe636d6fe84abea1aa300ebb48f [0,1,0,0,0,0|3,0,0]=4 382 B18R2.859145 OCc1c[nH]c2c1c(ncn2)NCCC(F)F 207b02cf5d963967f440d258d6df599a [0,1,0,0,0,0|3,0,0]=4 383 B18R2.859146 C=C(CC)CNc1ncnc2c1c(n[nH]2)SC 4beb7a47eed228feb96ab75b556e5786 [0,1,0,0,0,0|2,0,1]=4 384 B18R2.859146 C=C(CO)CNc1ncnc2c1c(n[nH]2)SC 49355f39503b9130119707d231862965 [0,1,0,0,0,0|1,0,1]=3 385 B18R2.859146 C=CC(O)CNc1ncnc2c1c(c[nH]2)CC cadc965c72cd37b4d158affa94af836f [0,1,0,0,0,0|2,0,1]=4 386 B18R2.859146 C=CC(O)CNc1ncnc2c1c(c[nH]2)SC e8fd42f05836489e2720d39c70939eba [0,1,0,0,0,0|1,0,1]=3 387 B18R2.859146 CC(CO)CNc1ccnc2c1c(c[nH]2)C=O e9e36603c776678fc4b8743fe6030669 [0,1,0,0,0,0|3,0,0]=4 388 B18R2.859146 CC(CO)CNc1nccc2c1c(c[nH]2)C=O a0273dfab836115b988cdbba081e8959 [0,1,0,0,0,0|3,0,0]=4 389 B18R2.859146 CC(CO)CNc1ncnc2c1c(n[nH]2)C#N cb542053fa1da1e006a0ed3a3e7f1530 [0,1,0,0,0,0|3,0,0]=4 390 B18R2.859146 CCC(=O)CNc1ncnc2c1c(n[nH]2)SC 9f9afc7c628af00d4af9cf8965e14ea0 [0,1,0,0,0,0|2,0,1]=4 391 B18R2.859146 CCC(C)CNc1ncnc2c1c(n[nH]2)SC 7d201c98d7cc233c51c2e07f7e93317a [0,1,0,0,0,0|2,0,0]=3 392 B18R2.859146 CCC(O)CNc1ncnc2c1c(n[nH]2)SC c9427139ac57b45f343aa13c3f7d65c2 [0,1,0,0,0,0|2,0,0]=3 393 B18R2.859146 CC[C@@H](C)CNc1ncnc2c1c(n[nH]2)SC 12cf53146b051a0a1215851574a40b92 [0,1,0,0,0,0|2,0,0]=3 394 B18R2.859146 CC[C@H](C)CNc1ncnc2c1c(n[nH]2)SC cc977f2fac93d605264e12dc4d72db57 [0,1,0,0,0,0|2,0,0]=3 395 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(=O)NO 5b5c822dc2fa0932a44126c3430c38b4 [0,1,0,0,0,0|2,0,1]=4 396 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(Br)CBr 0c798b861bd5fe482e4ee171345338ad [0,1,0,0,0,0|2,0,0]=3 397 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(C)C#N 30d751d2a334d59afd166c78ee9a3abb [0,1,0,0,0,0|2,0,1]=4 398 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(C)CC c618e97c6874b62307ace186b5a3cfa7 [0,1,0,0,0,0|2,0,0]=3 399 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(C)CO 0c668454a08e01e4b5afb208da07f38d [0,1,0,0,0,0|1,0,0]=2 400 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(F)CO 342dc041681cc0500b6851ef77adcaa6 [0,1,0,0,0,0|1,0,0]=2 401 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(O)CC b76f8b45f897d3a3a7471d58cfa2c3a0 [0,1,0,0,0,0|2,0,0]=3 402 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NCC(O)CO 62766c3dc8aa17546489f1157cf22d54 [0,1,0,0,0,0|1,0,0]=2 403 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@@H](C)CC 3fbae3c9412331b9312bb17cde3e586f [0,1,0,0,0,0|2,0,0]=3 404 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@@H](C)OC 24ad66d156b7e7518929da3be4c76e73 [0,1,0,0,0,0|3,0,0]=4 405 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@@H](F)CO 45feca2b36099bd9166dae692935bf98 [0,1,0,0,0,0|1,0,0]=2 406 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@@H](O)CO 5df3744b6395df0ee8c9bd0aa15bb1e0 [0,1,0,0,0,0|1,0,0]=2 407 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@H](C)CO 5a0708ff19a89c44c86dc4e90eedaf9b [0,1,0,0,0,0|1,0,0]=2 408 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@H](C)OC 7cd12beb228f52e5d0b8d17de48a0eef [0,1,0,0,0,0|3,0,0]=4 409 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@H](F)CO c2caa9e12ab1a870f7bf6213924c624d [0,1,0,0,0,0|1,0,0]=2 410 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@H](O)CC d446acaf5e71e4d7e8fe4c9df9d575cb [0,1,0,0,0,0|2,0,0]=3 411 B18R2.859146 CCc1c[nH]c2c1c(ncn2)NC[C@H](O)CO d33d3b676272451b700ea843f3915beb [0,1,0,0,0,0|1,0,0]=2 412 B18R2.859146 CNC(=O)CNc1ncnc2c1c(c[nH]2)SC 650576340426637c75502a334ace2ac2 [0,1,0,0,0,0|2,0,1]=4 413 B18R2.859146 COC(=O)CNc1ncnc2c1c(c[nH]2)SC 0008ef27038af13849adacb160ad4e1d [0,1,0,0,0,0|2,0,1]=4 414 B18R2.859146 COC(C)CNc1ncnc2c1c(n[nH]2)SC 155fb8736badda3ec6d82578a2deaa9e [0,1,0,0,0,0|3,0,0]=4 415 B18R2.859146 CO[C@@H](C)CNc1ncnc2c1c(n[nH]2)SC 8b722f0bd919e4fa32b9827221b10527 [0,1,0,0,0,0|3,0,0]=4 416 B18R2.859146 CO[C@H](C)CNc1ncnc2c1c(n[nH]2)SC fe8e4b1f8c3b698a959564509cd8758e [0,1,0,0,0,0|3,0,0]=4 417 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NCC(=O)NO 027b2c79be6ca19982c870cc3b80d452 [0,1,0,0,0,0|1,0,1]=3 418 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NCC(F)CO 830cec2f4cdc5a5258b5a697dec49420 [0,1,0,0,0,0|0,0,0]=1 419 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NCC(O)CO 493d18c42de7a97f08ae6f7ff0382cac [0,1,0,0,0,0|0,0,0]=1 420 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NC[C@@H](F)CO 0fd5eef018689686a2f8cb31d90e2dd3 [0,1,0,0,0,0|0,0,0]=1 421 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NC[C@@H](O)CO ca2f91d0064fd9cfc0db2166dfa5f416 [0,1,0,0,0,0|0,0,0]=1 422 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NC[C@H](F)CO f57129d7782a5a9e4b8939d9e56bda24 [0,1,0,0,0,0|0,0,0]=1 423 B18R2.859146 CSc1c[nH]c2c1c(ncn2)NC[C@H](O)CO 87c31f151d9269d1882887e69b6b1c87 [0,1,0,0,0,0|0,0,0]=1 424 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NCC(=O)CO 67d1802e0a23084917bbd9b4c02098b2 [0,1,0,0,0,0|1,0,1]=3 425 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NCC(C)C#N 65efa58603803d330f97d146b298a78a [0,1,0,0,0,0|2,0,1]=4 426 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NCC(C)CO c2cdeaafe26d42e8c03c7b5fd4d19ce0 [0,1,0,0,0,0|1,0,0]=2 427 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NCC(O)CF 7c078fe3da29fc420e9b28d2c9bad10b [0,1,0,0,0,0|2,0,0]=3 428 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NCC(O)CO 9d3258f741d77e49eba66f10fb3137ae [0,1,0,0,0,0|1,0,0]=2 429 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NC[C@@H](C)CO 29bdaf862e915777b6ff41293cd90463 [0,1,0,0,0,0|1,0,0]=2 430 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NC[C@@H](O)CO 9a0c96a3877653226ec286355c6f6dcb [0,1,0,0,0,0|1,0,0]=2 431 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NC[C@H](C)CO 04877db65167e5b2cb3bb54616372416 [0,1,0,0,0,0|1,0,0]=2 432 B18R2.859146 CSc1n[nH]c2c1c(ncn2)NC[C@H](O)CO 10082e848e1b1e43228ccce5f84f2f22 [0,1,0,0,0,0|1,0,0]=2 433 B18R2.859146 C[C@@H](CO)CNc1ncnc2c1c(n[nH]2)C#N 5836a547896b2f67ccf43f970237b478 [0,1,0,0,0,0|3,0,0]=4 434 B18R2.859146 C[C@H](CO)CNc1ccnc2c1c(c[nH]2)C=O 1b70bf04e989d2646320c73ddde49518 [0,1,0,0,0,0|3,0,0]=4 435 B18R2.859146 C[C@H](CO)CNc1nccc2c1c(c[nH]2)C=O bd4421d05323278547a6ffe3fa2f0cc5 [0,1,0,0,0,0|3,0,0]=4 436 B18R2.859146 C[C@H](CO)CNc1ncnc2c1c(n[nH]2)C#N b0120b48c31d36ff7706bf3ee4b92caa [0,1,0,0,0,0|3,0,0]=4 437 B18R2.859146 N#Cc1c[nH]c2c1c(ccn2)NCC(F)CO 862444909108003b47b69710480e3c19 [0,1,0,0,0,0|3,0,0]=4 438 B18R2.859146 N#Cc1c[nH]c2c1c(ccn2)NC[C@@H](F)CO fb9aff1eaf43e242ede6ccb0ae29f313 [0,1,0,0,0,0|3,0,0]=4 439 B18R2.859146 N#Cc1c[nH]c2c1c(ccn2)NC[C@H](F)CO 099554f32e9345be3eee1d0b52b4445d [0,1,0,0,0,0|3,0,0]=4 440 B18R2.859146 N#Cc1c[nH]c2c1c(ncc2)NCC(F)CO 38f5dc261fe2c017d13954db496c12e5 [0,1,0,0,0,0|3,0,0]=4 441 B18R2.859146 N#Cc1c[nH]c2c1c(ncc2)NC[C@@H](F)CO 0f6b1773a7e2baabaa0ee033adf2d5a0 [0,1,0,0,0,0|3,0,0]=4 442 B18R2.859146 N#Cc1c[nH]c2c1c(ncc2)NC[C@H](F)CO 62a6e363ff331eff6ff291d4bb344348 [0,1,0,0,0,0|3,0,0]=4 443 B18R2.859146 N#Cc1n[nH]c2c1c(ncn2)NCC(O)CO 3e636d560e6ae96d59fda157d9f32cc1 [0,1,0,0,0,0|3,0,0]=4 444 B18R2.859146 N#Cc1n[nH]c2c1c(ncn2)NC[C@@H](O)CO 0b94da25d35d58d339f4049294f6815d [0,1,0,0,0,0|3,0,0]=4 445 B18R2.859146 N#Cc1n[nH]c2c1c(ncn2)NC[C@H](O)CO 623ccefb89627e0d60ffdb3ca6475604 [0,1,0,0,0,0|3,0,0]=4 446 B18R2.859146 O=Cc1c[nH]c2c1c(ccn2)NCC(F)CO 3e8f8b210d2642587f601c88d2a0f1b9 [0,1,0,0,0,0|3,0,0]=4 447 B18R2.859146 O=Cc1c[nH]c2c1c(ccn2)NC[C@@H](F)CO 7719aea9798d5a3039b451752113fe4c [0,1,0,0,0,0|3,0,0]=4 448 B18R2.859146 O=Cc1c[nH]c2c1c(ccn2)NC[C@H](F)CO 665691b018d85af97c3d4b785b4228d7 [0,1,0,0,0,0|3,0,0]=4 449 B18R2.859146 O=Cc1c[nH]c2c1c(ncc2)NCC(F)CO 7ee6992ef484ef58dddea339f728b59f [0,1,0,0,0,0|3,0,0]=4 450 B18R2.859146 O=Cc1c[nH]c2c1c(ncc2)NCC(O)CO 24230de317e4ef3532a19d1129172a03 [0,1,0,0,0,0|3,0,0]=4 451 B18R2.859146 O=Cc1c[nH]c2c1c(ncc2)NC[C@@H](F)CO c573b37e93fe3b0b0587da5ec5b16e23 [0,1,0,0,0,0|3,0,0]=4 452 B18R2.859146 O=Cc1c[nH]c2c1c(ncc2)NC[C@@H](O)CO fc5df5afdfdb89c786cd850d305668a0 [0,1,0,0,0,0|3,0,0]=4 453 B18R2.859146 O=Cc1c[nH]c2c1c(ncc2)NC[C@H](F)CO 88fcbb065204c6febfabc031d643b4a0 [0,1,0,0,0,0|3,0,0]=4 454 B18R2.859146 O=Cc1c[nH]c2c1c(ncc2)NC[C@H](O)CO eb984a8a83e5216008bb8b0fd3b8e23f [0,1,0,0,0,0|3,0,0]=4 455 B18R2.859146 O=Cc1c[nH]c2c1c(ncn2)NCC(Br)CBr 32d3138bc0fc72b29bddfccc5f6c5b3d [0,1,0,0,0,0|3,0,0]=4 456 B18R2.859146 O=Cc1c[nH]c2c1c(ncn2)NCC(F)CO d41299bd31ebeb4823d676b0bbbb070f [0,1,0,0,0,0|2,0,0]=3 457 B18R2.859146 O=Cc1c[nH]c2c1c(ncn2)NC[C@@H](F)CO 859349c5545826643aa598ce6a2245f9 [0,1,0,0,0,0|2,0,0]=3 458 B18R2.859146 O=Cc1c[nH]c2c1c(ncn2)NC[C@H](F)CO 17d4271a0efb46928a36388a2db61bdd [0,1,0,0,0,0|2,0,0]=3 459 B18R2.859146 OCc1c[nH]c2c1c(ncn2)NCC(F)CO d9d53f5832e82ed75a28144d33848e96 [0,1,0,0,0,0|2,0,0]=3 460 B18R2.859146 OCc1c[nH]c2c1c(ncn2)NCC(O)CO f03b7811461f8095183c2ac92432f49b [0,1,0,0,0,0|2,0,0]=3 461 B18R2.859146 OCc1c[nH]c2c1c(ncn2)NC[C@@H](F)CO b12e8ffa8bf094b3accef17f368969b1 [0,1,0,0,0,0|2,0,0]=3 462 B18R2.859146 OCc1c[nH]c2c1c(ncn2)NC[C@@H](O)CO eb560cae3f83cb99bed195b037cf0b9e [0,1,0,0,0,0|2,0,0]=3 463 B18R2.859146 OCc1c[nH]c2c1c(ncn2)NC[C@H](F)CO 9f64cdea90225114521578cb434f88b6 [0,1,0,0,0,0|2,0,0]=3 464 B18R2.859146 OCc1c[nH]c2c1c(ncn2)NC[C@H](O)CO f5b6fa6b6aa631c4787f832ea538b1df [0,1,0,0,0,0|2,0,0]=3 465 B18R2.886424 C=CCCN(C)c1ncnc2c1c(c[nH]2)CC 081c4bd8aa966bcae7ea037daa934602 [0,1,0,0,0,0|2,0,1]=4 466 B18R2.886424 C=CCCN(C)c1ncnc2c1c(c[nH]2)SC dfdfdd0a10638c5007fc0e3addb5087b [0,1,0,0,0,0|1,0,1]=3 467 B18R2.886424 CCCCN(C)c1ncnc2c1c(c[nH]2)CC c9ce13d85918b9842c94a1840f5c19c4 [0,1,0,0,0,0|2,0,0]=3 468 B18R2.886424 CCc1c[nH]c2c1c(ncn2)N(C)CCCO a954c7e483c275a2f8b45c44e30648e9 [0,1,0,0,0,0|1,0,0]=2 469 B18R2.886424 CCc1c[nH]c2c1c(ncn2)N(C)CCOC dfc2c95068c3d4f85ce5237c56980f1e [0,1,0,0,0,0|3,0,0]=4 470 B18R2.886424 CCc1c[nH]c2c1c(ncn2)N(C)CCON cf849a8bd815fad317b0958d09858da3 [0,1,0,0,0,0|3,0,0]=4 471 B18R2.886424 CCc1c[nH]c2c1c(ncn2)N(C)CCSC 9df459a9a4b3031ec47e3539bbca3870 [0,1,0,0,0,0|3,0,0]=4 472 B18R2.886424 CN(CCCO)c1ccnc2c1c(c[nH]2)C=O e0215410fc30e4b5807144698d1f4f7a [0,1,0,0,0,0|3,0,0]=4 473 B18R2.886424 CSc1c[nH]c2c1c(ncn2)N(C)CCON ba455bd3dc3f4945585b62a9c0f13f7b [0,1,0,0,0,0|2,0,0]=3 474 B16R1.60099 COC(=O)c1c(ncnc1NCCCO)Cl 396e891bfe70249144eaeb8b979440cb [0,0,1,0,0,0|2,1,0]=4 475 B18R3.1381233 CSc1n[nH]c2c1c(ncn2)NC3CCC3 5240830a619086ab47ca5b0c81c99e43 [0,0,0,1,0,0|2,0,0]=3 476 B18R3.1381236 CCc1c[nH]c2c1c(ncn2)NCC3CC3 cb3f649f0ceac64c822f25ceac425d22 [0,0,0,1,0,0|2,0,0]=3 477 B18R3.1381236 CSc1c[nH]c2c1c(ncn2)NCC3CC3 32f2a91e29c78044a50e01d63f2af19d [0,0,0,1,0,0|1,0,0]=2 478 B18R3.1381236 CSc1n[nH]c2c1c(ncn2)NCC3CC3 d3c38e5b73c414cd0725bf124385bd1f [0,0,0,1,0,0|2,0,0]=3 479 B18R3.1381236 O=Cc1c[nH]c2c1c(ncn2)NCC3CC3 289d1ccc3fed97ab4fcb78e2f05d6adb [0,0,0,1,0,0|3,0,0]=4 480 B18R3.1381236 OCc1c[nH]c2c1c(ncn2)NCC3CC3 2aa4eea4212eab9ebcffd5f5056a4322 [0,0,0,1,0,0|3,0,0]=4 481 B18R2.2430639 CCCCNc1ncnc2c1c(ccc2)OC 5748a3908f810a2e637af66338dacb8a [0,0,0,0,0,1|2,1,0]=4 482 B18R2.2430639 COc1cccc2c1c(ccn2)NCCCO 651c9a9f1da9100410f0090092da8576 [0,0,0,0,0,1|2,1,0]=4 483 B18R2.2430639 COc1cccc2c1c(ncc2)NCCCO 34d9ca6b75a003ac473334126d7c8399 [0,0,0,0,0,1|2,1,0]=4 484 B18R2.2430639 COc1cccc2c1c(ncn2)NCCCF 8c613251e1de02fcf49007ad9c2d746e [0,0,0,0,0,1|2,1,0]=4 485 B18R2.2430639 COc1cccc2c1c(ncn2)NCCCO 6e4bdb63733feaa72b42fd6bf8d5a082 [0,0,0,0,0,1|1,1,0]=3 486 B18R2.2430639 COc1cccc2c1c(ncn2)NCCCS ab989c1d01b4cfffac74d0f76aef80c8 [0,0,0,0,0,1|1,2,0]=4 487 B18R2.2430639 CSc1cccc2c1c(ccc2)NCCCO b6520be47d51aaaa6fa5d054154f5e67 [0,0,0,0,0,1|3,0,0]=4 488 B18R2.2430643 CCCCNc1ncnc2c1cc(cc2)OC 3b1c1bf791414fcaa2773084a2ab2db7 [0,0,0,0,0,1|2,1,0]=4 489 B18R2.2430643 CCc1ccc2nccc(c2c1)NCCCO e069ec96cf4d97503a90c6b7e0521b8f [0,0,0,0,0,1|3,0,0]=4 490 B18R2.2430643 COc1ccc2ccnc(c2c1)NCCCO 67902c14a89c56a1f1f745038172446d [0,0,0,0,0,1|2,1,0]=4 491 B18R2.2430643 COc1ccc2nccc(c2c1)NCCCO 408d5379efd43f8681e8609e90dda28e [0,0,0,0,0,1|2,1,0]=4 492 B18R2.2430643 COc1ccc2nccc(c2n1)NCCCO 6c01dfef8b367ebcf4821b13d39469ab [0,0,0,0,0,1|2,1,0]=4 493 B18R2.2430643 COc1ccc2ncnc(c2c1)NCCCF dd13e492a3ac06e306dc10f9a1525c17 [0,0,0,0,0,1|2,1,0]=4 494 B18R2.2430643 COc1ccc2ncnc(c2c1)NCCCO 198b00f7a75a8ffa074c6268dd45a359 [0,0,0,0,0,1|1,1,0]=3 495 B18R2.2430643 COc1ccc2ncnc(c2c1)NCCCS 98b76d413debe8d69e7625f8f0476f1a [0,0,0,0,0,1|1,2,0]=4 496 B18R2.2430643 COc1cnc2ccnc(c2c1)NCCCO 3dce7a52215d5fbdc5ecf4f1f7037d2d [0,0,0,0,0,1|1,1,1]=4 497 B18R2.2430643 CSc1ncc2ccnc(c2n1)NCCCO fae443c0c73d66939ccdc4925b13e2f9 [0,0,0,0,0,1|3,0,0]=4 498 B18R2.2430643 N#Cc1ccc2ncnc(c2c1)NCCCO 9c042a9cf091572f1b6a223d4cb186b6 [0,0,0,0,0,1|3,0,0]=4 499 B15R2.1454 C#CCNc1ncnc2c1c(c[nH]2)C eb0ce3aac0552fdc40e8bd107f8ec285 [2,0,0,0,0,0|0,0,2]=4 500 B15R2.1454 C=CCNc1ncnc2c1c(c[nH]2)C 8c6f9577995acd5772b97ff26f417344 [2,0,0,0,0,0|0,0,2]=4 501 B15R2.1454 CCCNc1cccc2c1c(c[nH]2)C 01ab02104a2477a365a940fdcf26b507 [2,0,0,0,0,0|2,0,0]=4 502 B15R2.1454 CCCNc1ccnc2c1c(c[nH]2)Br a92b05a4a60bbe39da417541836ed441 [2,0,0,0,0,0|2,0,0]=4 503 B15R2.1454 CCCNc1ccnc2c1c(c[nH]2)C f96c1517a47cd8aab37baf33ee33e659 [2,0,0,0,0,0|1,0,0]=3 504 B15R2.1454 CCCNc1ccnc2c1c(n[nH]2)C ecd520de7efec23448091c3efa5286e4 [2,0,0,0,0,0|2,0,0]=4 505 B15R2.1454 CCCNc1nccc2c1c(c[nH]2)Br 4ce2f863a8644865724b4032a972e50a [2,0,0,0,0,0|2,0,0]=4 506 B15R2.1454 CCCNc1ncnc2c1c(c[nH]2)Br 428f84fcfdaabc543270aace78f08a41 [2,0,0,0,0,0|1,0,0]=3 507 B15R2.1454 CCCNc1ncnc2c1c(c[nH]2)C b93e2e6aa8591f18e0907d09a7fbd053 [2,0,0,0,0,0|0,0,0]=2 508 B15R2.1454 CCCNc1ncnc2c1c(c[nH]2)Cl 8ac5f03894c6135a0afd47879a60611c [2,0,0,0,0,0|1,0,0]=3 509 B15R2.1454 CCCNc1ncnc2c1c(c[nH]2)F 223915af272369990fc8767da779134d [2,0,0,0,0,0|1,0,0]=3 510 B15R2.1454 CCCNc1ncnc2c1c(c[nH]2)I 93450b5f6ea6bd43a495bfb431de7a04 [2,0,0,0,0,0|1,0,0]=3 511 B15R2.1454 CCCNc1ncnc2c1c(co2)C af8fe87d15c5dce1add2c79d276a8ce9 [2,0,0,0,0,0|1,0,0]=3 512 B15R2.1454 CCCNc1ncnc2c1c(cs2)Br 30b75d8ad653a4e42d17bbc5eafc3c0d [2,0,0,0,0,0|2,0,0]=4 513 B15R2.1454 CCCNc1ncnc2c1c(n[nH]2)Br ba74549e515e47f2806487673a4a25f7 [2,0,0,0,0,0|2,0,0]=4 514 B15R2.1454 CCCNc1ncnc2c1c(n[nH]2)C 8dbd2b17654f43ef33155d80dde366c7 [2,0,0,0,0,0|1,0,0]=3 515 B15R2.1454 CCCNc1ncnc2c1c(n[nH]2)Cl 366d1a2e4b081f382b3162f1f4a294f3 [2,0,0,0,0,0|2,0,0]=4 516 B15R2.1454 CCCNc1ncnc2c1c(n[nH]2)I eea010de44b10c8d6c42dfbe551c5c21 [2,0,0,0,0,0|2,0,0]=4 517 B15R2.1454 CCCNc1ncnc2c1c(no2)C 7b01765f8391ee9328cb1e114b43bcdd [2,0,0,0,0,0|2,0,0]=4 518 B15R2.1454 CCCNc1ncnc2c1n(cn2)C 2892ac8b382a26dbb081d5054732fcb2 [2,0,0,0,0,0|1,0,1]=4 519 B15R2.1454 CCCNc1ncnn2c1c(cc2)C a0378d51691981430f0376c7ca1fc3ee [2,0,0,0,0,0|2,0,0]=4 520 B15R2.1454 CCCOc1ncnc2c1c(c[nH]2)Cl dc2a06b29089addcd038c743a049b189 [2,0,0,0,0,0|2,0,0]=4 521 B15R2.1454 CCCOc1ncnc2c1c(n[nH]2)C 0ac7711e10d05770d6f260bfcbcaeb67 [2,0,0,0,0,0|2,0,0]=4 522 B15R2.1454 COCNc1ccnc2c1c(c[nH]2)C 5b3a84f56e85f85335f6132adc96669b [2,0,0,0,0,0|2,0,0]=4 523 B15R2.1454 COCNc1ncnc2c1c(c[nH]2)Br 526caaeb109bb13d63b6ed6ae14baffb [2,0,0,0,0,0|2,0,0]=4 524 B15R2.1454 COCNc1ncnc2c1c(c[nH]2)C 83a75755086687798d757ea1fc3081aa [2,0,0,0,0,0|1,0,0]=3 525 B15R2.1454 COCNc1ncnc2c1c(c[nH]2)Cl dbdc67c14b5d4322222c26fe0949fea2 [2,0,0,0,0,0|2,0,0]=4 526 B15R2.1454 COCNc1ncnc2c1c(c[nH]2)F 7654f83cc4822c2b774e168a2a661ce0 [2,0,0,0,0,0|2,0,0]=4 527 B15R2.1454 COCNc1ncnc2c1c(c[nH]2)I 65649f3f26a150a321101f252a180a4c [2,0,0,0,0,0|2,0,0]=4 528 B15R2.1454 COCNc1ncnc2c1c(co2)C 6b031327a943d200e81c9c441117abfc [2,0,0,0,0,0|2,0,0]=4 529 B15R2.1454 COCNc1ncnc2c1c(n[nH]2)C 2e6172bdb48e217307298afa7d3f80b4 [2,0,0,0,0,0|2,0,0]=4 530 B15R2.1454 CSCNc1ccnc2c1c(c[nH]2)C 114c6dc7b9da758bc44a1991cb699244 [2,0,0,0,0,0|2,0,0]=4 531 B15R2.1454 CSCNc1ncnc2c1c(c[nH]2)Br bf0a48ef585c59337e6e80df340b71c6 [2,0,0,0,0,0|2,0,0]=4 532 B15R2.1454 CSCNc1ncnc2c1c(c[nH]2)C 84d6bb8d4ac3a86c8750bc378f2c1b71 [2,0,0,0,0,0|1,0,0]=3 533 B15R2.1454 CSCNc1ncnc2c1c(c[nH]2)Cl 6ded7a81714ec3a44c03b306f467f09c [2,0,0,0,0,0|2,0,0]=4 534 B15R2.1454 CSCNc1ncnc2c1c(c[nH]2)F e56a55f036dcaa2125c4e3c86bdbd1ab [2,0,0,0,0,0|2,0,0]=4 535 B15R2.1454 CSCNc1ncnc2c1c(c[nH]2)I 5c9bba8202625a1aed0532a01ee5b69e [2,0,0,0,0,0|2,0,0]=4 536 B15R2.1454 CSCNc1ncnc2c1c(co2)C 3ca3f0d4194754d8b42723ec82637295 [2,0,0,0,0,0|2,0,0]=4 537 B15R2.1454 CSCNc1ncnc2c1c(n[nH]2)C 62664382fe9e3ae4afe43cd8ee1e4030 [2,0,0,0,0,0|2,0,0]=4 538 B15R2.1454 Cc1c[nH]c2c1c(ccc2)NCCO d2dcde34c20aebba7d929991370ce007 [2,0,0,0,0,0|2,0,0]=4 539 B15R2.1454 Cc1c[nH]c2c1c(ccn2)NCCF 81eefc1dbd2b78f5bbacd6871de593f7 [2,0,0,0,0,0|2,0,0]=4 540 B15R2.1454 Cc1c[nH]c2c1c(ccn2)NCCO ccd6297b0f647ef7b77488fb0264d284 [2,0,0,0,0,0|1,0,0]=3 541 B15R2.1454 Cc1c[nH]c2c1c(ccn2)NCCS 738660f1a278662af0bafc8ef772198c [2,0,0,0,0,0|1,1,0]=4 542 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCC#N 00fafcd6d2a69e0665a837b284882a08 [2,0,0,0,0,0|1,0,1]=4 543 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCC=O 98b786e8e3d87e8851854d4eb580f2ae [2,0,0,0,0,0|0,0,2]=4 544 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCCBr 79e3376fbb5078d7427b2982a2778784 [2,0,0,0,0,0|1,0,0]=3 545 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCCF f22175a303986bb44ec556d6702f773f [2,0,0,0,0,0|1,0,0]=3 546 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCCI 7b05850d07427316e86e8b7b8ee9ee8b [2,0,0,0,0,0|1,0,0]=3 547 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCCO 31a13b18c78250d7916be395b353944b [2,0,0,0,0,0|0,0,0]=2 548 B15R2.1454 Cc1c[nH]c2c1c(ncn2)NCCS f3b3aa2e6a68ef3e5b5f481baf5cd7d1 [2,0,0,0,0,0|0,1,0]=3 549 B15R2.1454 Cc1ccn2c1c(ncn2)NCCO 5356cd467946421aa9abce3276362c2e [2,0,0,0,0,0|2,0,0]=4 550 B15R2.1454 Cc1coc2c1c(ncn2)NCCF 45c720d764e0dcb3238eb5541955e54c [2,0,0,0,0,0|2,0,0]=4 551 B15R2.1454 Cc1coc2c1c(ncn2)NCCO ea7c4cf0bdd93383dc87c27015d42e33 [2,0,0,0,0,0|1,0,0]=3 552 B15R2.1454 Cc1coc2c1c(ncn2)NCCS 2cd9e1758299930e1726caad1c766901 [2,0,0,0,0,0|1,1,0]=4 553 B15R2.1454 Cc1n[nH]c2c1c(ccn2)NCCO 698fe293de02e403a77a82e687511053 [2,0,0,0,0,0|2,0,0]=4 554 B15R2.1454 Cc1n[nH]c2c1c(ncn2)NCCF 832820a805b404c85fed4a76bdab13f8 [2,0,0,0,0,0|2,0,0]=4 555 B15R2.1454 Cc1n[nH]c2c1c(ncn2)NCCO 9b946ff41ef03e4ac8fba1d2bd871756 [2,0,0,0,0,0|1,0,0]=3 556 B15R2.1454 Cc1n[nH]c2c1c(ncn2)NCCS 270aaa29250c5420eb4b1d10eb3e9927 [2,0,0,0,0,0|1,1,0]=4 557 B15R2.1454 Cc1noc2c1c(ncn2)NCCO 56c0ebdf9c019b10c0c9a4bd5e7bf89d [2,0,0,0,0,0|2,0,0]=4 558 B15R2.1454 Cn1cnc2c1c(ncn2)NCCO c555a79db052a048a2e0cb40accf1342 [2,0,0,0,0,0|1,0,1]=4 559 B15R2.1454 FCCNc1ncnc2c1c(c[nH]2)Br b33d8b03db1b6d8350b638bbe49b01dc [2,0,0,0,0,0|2,0,0]=4 560 B15R2.1454 FCCNc1ncnc2c1c(c[nH]2)Cl 1ac41d7d89f46a12635bb7cbe3f371db [2,0,0,0,0,0|2,0,0]=4 561 B15R2.1454 FCCNc1ncnc2c1c(c[nH]2)F cde429df56a0e7f25f06ed69cb6c38a3 [2,0,0,0,0,0|2,0,0]=4 562 B15R2.1454 FCCNc1ncnc2c1c(c[nH]2)I 032f81aa2ddcd3c3a4b1cd6e40321136 [2,0,0,0,0,0|2,0,0]=4 563 B15R2.1454 Fc1c[nH]c2c1c(ncn2)NCCS 4b97a44e238132d901c0dad84d93352a [2,0,0,0,0,0|1,1,0]=4 564 B15R2.1454 OCCNc1ccnc2c1c(c[nH]2)Br 620db78b1ae4c03a8234caef717201b3 [2,0,0,0,0,0|2,0,0]=4 565 B15R2.1454 OCCNc1ccnc2c1c(c[nH]2)F 5d0843b429c14454322bde048d87265e [2,0,0,0,0,0|2,0,0]=4 566 B15R2.1454 OCCNc1nccc2c1c(c[nH]2)Br 9d1fd676d978366856b20b5147654287 [2,0,0,0,0,0|2,0,0]=4 567 B15R2.1454 OCCNc1ncnc2c1c(c[nH]2)Br 8b39c0c9beb4976d6501f06a4a28d806 [2,0,0,0,0,0|1,0,0]=3 568 B15R2.1454 OCCNc1ncnc2c1c(c[nH]2)Cl ea5556033293e07163b10554aacb30fb [2,0,0,0,0,0|1,0,0]=3 569 B15R2.1454 OCCNc1ncnc2c1c(c[nH]2)F 388ef59e4bf3158c3f10b694fafa244a [2,0,0,0,0,0|1,0,0]=3 570 B15R2.1454 OCCNc1ncnc2c1c(c[nH]2)I eeee8c7dac6d6fcb2fae4754809ee2d5 [2,0,0,0,0,0|1,0,0]=3 571 B15R2.1454 OCCNc1ncnc2c1c(cs2)Br 331cef7e041059a89d96d174e4e1cc04 [2,0,0,0,0,0|2,0,0]=4 572 B15R2.1454 OCCNc1ncnc2c1c(n[nH]2)Br 6963c44bdbc86650bc485cb4c0c3f703 [2,0,0,0,0,0|2,0,0]=4 573 B15R2.1454 OCCNc1ncnc2c1c(n[nH]2)Cl 77fe907fb03897e3bc5cb43d557316ae [2,0,0,0,0,0|2,0,0]=4 574 B15R2.1454 OCCNc1ncnc2c1c(n[nH]2)I 18ecff87fc97abce0d3900280ea8bd8b [2,0,0,0,0,0|2,0,0]=4 575 B15R2.1454 SCCNc1ncnc2c1c(c[nH]2)Br bd8034bf15b2584be67d6cfc0a0abe10 [2,0,0,0,0,0|1,1,0]=4 576 B15R2.1454 SCCNc1ncnc2c1c(c[nH]2)Cl d88a13c6602bb5e8cd3f9cee1b8424c3 [2,0,0,0,0,0|1,1,0]=4 577 B15R2.1454 SCCNc1ncnc2c1c(c[nH]2)I 7f3ece1c45fb434d425dd849a20bc6fb [2,0,0,0,0,0|1,1,0]=4 578 B15R2.4278 C#CCCNc1ncnc2c1cc[nH]2 3e9d1768a3200915bee16b2fd056860e [2,0,0,0,0,0|1,0,1]=4 579 B15R2.4278 C=CCCNc1ncnc2c1cc[nH]2 21ff42b966c814cd1c4284481aff35f5 [2,0,0,0,0,0|1,0,1]=4 580 B15R2.4278 CCCCNc1ccnc2c1cc[nH]2 93c4d2ccef4e0898e788769a5bc1bba2 [2,0,0,0,0,0|2,0,0]=4 581 B15R2.4278 CCCCNc1nccc2c1cc[nH]2 7ce3828587a37c0051a606c97433b4f6 [2,0,0,0,0,0|2,0,0]=4 582 B15R2.4278 CCCCNc1ncnc2c1cc[nH]2 e13901a97ac5da0e0bb29fa0381fa799 [2,0,0,0,0,0|1,0,0]=3 583 B15R2.4278 CCCCNc1ncnc2c1cco2 b74f222c7c436688f7902f6932d1ac20 [2,0,0,0,0,0|2,0,0]=4 584 B15R2.4278 CCCCNc1ncnc2c1ccs2 bb6093f32c23999b4ac3765241dc8900 [2,0,0,0,0,0|2,0,0]=4 585 B15R2.4278 CCCCNc1ncnc2c1cn[nH]2 46783cdb919210a41e1d98da48ff0c86 [2,0,0,0,0,0|2,0,0]=4 586 B15R2.4278 CCCCNc1ncnc2c1nc[nH]2 4faebf42b086f6fb737c01157032767b [2,0,0,0,0,0|2,0,0]=4 587 B15R2.4278 CCCCOc1ncnc2c1cc[nH]2 69c26f5f229473e995080f127814da4e [2,0,0,0,0,0|2,0,0]=4 588 B15R2.4278 CCOCNc1ncnc2c1cc[nH]2 cb5d75dc99c20ab9b0bc676cf7040274 [2,0,0,0,0,0|2,0,0]=4 589 B15R2.4278 COCCNc1ncnc2c1cc[nH]2 a4249f6e4ce918304fda5670977dc96c [2,0,0,0,0,0|2,0,0]=4 590 B15R2.4278 CSCCNc1ncnc2c1cc[nH]2 45546de91f9d6b75417f800cea7051e9 [2,0,0,0,0,0|2,0,0]=4 591 B15R2.4278 ClCCCNc1ccnc2c1cc[nH]2 28c66ec34c8ee66f1fdedf7fb934ff18 [2,0,0,0,0,0|2,0,0]=4 592 B15R2.4278 ClCCCNc1nccc2c1cc[nH]2 a6d7b6cc13e0d9287127281fc5c62249 [2,0,0,0,0,0|2,0,0]=4 593 B15R2.4278 ClCCCNc1ncnc2c1cc[nH]2 71a9bf066d5698b6f86d0578a8983b21 [2,0,0,0,0,0|1,0,0]=3 594 B15R2.4278 ClCCCNc1ncnc2c1ccs2 99110b009379b123892bfd09fd1bd0f7 [2,0,0,0,0,0|2,0,0]=4 595 B15R2.4278 ClCCCNc1ncnc2c1cn[nH]2 ca768660307128e0b9dc884d2a3d9ee8 [2,0,0,0,0,0|2,0,0]=4 596 B15R2.4278 FCCCNc1ccnc2c1cc[nH]2 de362cacf72dcd604dc6826b1cdc7187 [2,0,0,0,0,0|2,0,0]=4 597 B15R2.4278 FCCCNc1nccc2c1cc[nH]2 ea1e9bea3b37a07b610d0158ba371e52 [2,0,0,0,0,0|2,0,0]=4 598 B15R2.4278 FCCCNc1ncnc2c1cc[nH]2 172b114e6074c110a9fb0c432e5de421 [2,0,0,0,0,0|1,0,0]=3 599 B15R2.4278 FCCCNc1ncnc2c1cco2 296f68b02d746fdf6844a53e5bb4c886 [2,0,0,0,0,0|2,0,0]=4 600 B15R2.4278 FCCCNc1ncnc2c1ccs2 1fb97388f1e10bbef7d5d9e414628824 [2,0,0,0,0,0|2,0,0]=4 601 B15R2.4278 FCCCNc1ncnc2c1cn[nH]2 12b1a9752961f04847cfd2721f3dc7e1 [2,0,0,0,0,0|2,0,0]=4 602 B15R2.4278 FCCCNc1ncnc2c1nc[nH]2 ee62ad609b0c34dfd5533e52e71ee890 [2,0,0,0,0,0|2,0,0]=4 603 B15R2.4278 FCCCOc1ncnc2c1cc[nH]2 4609f7a4e2a3183bc13bf9f9ed86e187 [2,0,0,0,0,0|2,0,0]=4 604 B15R2.4278 N#CCCNc1ncnc2c1cc[nH]2 dd8f2f90d577097528f9ab311badbf80 [2,0,0,0,0,0|1,0,1]=4 605 B15R2.4278 NOCCNc1ncnc2c1cc[nH]2 176017de81294a1506806ad94f16576f [2,0,0,0,0,0|2,0,0]=4 606 B15R2.4278 O/C=C\CNc1ncnc2c1cc[nH]2 582c64b2247f4ae04895d1597f51bef3 [2,0,0,0,0,0|0,0,2]=4 607 B15R2.4278 O=CCCNc1ncnc2c1cc[nH]2 1f8253e456f91948cc661eecc61a84cf [2,0,0,0,0,0|0,0,2]=4 608 B15R2.4278 OCCCNc1cccc2c1cc[nH]2 a318cb34cbada0de5790c5a0938ef617 [2,0,0,0,0,0|2,0,0]=4 609 B15R2.4278 OCCCNc1ccnc2c1cc[nH]2 04015105e9e61a3f4bf93cab6d12243d [2,0,0,0,0,0|1,0,0]=3 610 B15R2.4278 OCCCNc1ccnc2c1cn[nH]2 a4a70fa843e6c8c85938eb185d611d0b [2,0,0,0,0,0|2,0,0]=4 611 B15R2.4278 OCCCNc1ccnc2c1nc[nH]2 eb745ec57d6707334c4e3c2cf73faee3 [2,0,0,0,0,0|2,0,0]=4 612 B15R2.4278 OCCCNc1nccc2c1cc[nH]2 e89c90633dc1c7a85b80148485fdd84f [2,0,0,0,0,0|1,0,0]=3 613 B15R2.4278 OCCCNc1nccc2c1cco2 c33ab80a94cf91839d67e555dd5d8c40 [2,0,0,0,0,0|2,0,0]=4 614 B15R2.4278 OCCCNc1nccc2c1ccs2 607ab70a554a8596f323fdfca4c6ccb6 [2,0,0,0,0,0|2,0,0]=4 615 B15R2.4278 OCCCNc1nccc2c1cn[nH]2 3bfcedfa93a7e7e98d6db335b66b7cb6 [2,0,0,0,0,0|2,0,0]=4 616 B15R2.4278 OCCCNc1ncnc2c1CCN2 ad8aadce2ac8c4556490ff4bfe2f3839 [2,0,0,0,0,0|0,0,2]=4 617 B15R2.4278 OCCCNc1ncnc2c1[nH]cc2 6a64d305005c38a06f461698ac1cf140 [2,0,0,0,0,0|2,0,0]=4 618 B15R2.4278 OCCCNc1ncnc2c1cc[nH]2 51353ec3e9356020aa8892ce0fa04116 [2,0,0,0,0,0|0,0,0]=2 619 B15R2.4278 OCCCNc1ncnc2c1cco2 05f06e1b0bcad7ce95e28cb661e96484 [2,0,0,0,0,0|1,0,0]=3 620 B15R2.4278 OCCCNc1ncnc2c1ccs2 3e218a514beee159c8802333a56ca4a7 [2,0,0,0,0,0|1,0,0]=3 621 B15R2.4278 OCCCNc1ncnc2c1cn[nH]2 05bb43a673180db7ba4cf3ba0bf4a759 [2,0,0,0,0,0|1,0,0]=3 622 B15R2.4278 OCCCNc1ncnc2c1nc[nH]2 e44682919274c515eda5a79530820906 [2,0,0,0,0,0|1,0,0]=3 623 B15R2.4278 OCCCNc1ncnc2c1ncs2 a5325279bf7a81281cb3d4f9ebf54c9f [2,0,0,0,0,0|2,0,0]=4 624 B15R2.4278 OCCCNc1ncnc2c1nn[nH]2 eef3de9a43a6238801600180a1f0b1f8 [2,0,0,0,0,0|2,0,0]=4 625 B15R2.4278 OCCCNc1ncnc2c1scc2 eb27035f099160ef7880feb858b30c50 [2,0,0,0,0,0|2,0,0]=4 626 B15R2.4278 OCCCNc1ncnn2c1ccc2 ea63b541675ec7820d18856abbf82fb2 [2,0,0,0,0,0|2,0,0]=4 627 B15R2.4278 SCCCNc1ccnc2c1cc[nH]2 665e5566030db66e5fb05737b83b8b03 [2,0,0,0,0,0|1,1,0]=4 628 B15R2.4278 SCCCNc1nccc2c1cc[nH]2 af494ad3bf96b240bfd09d65ea21fe90 [2,0,0,0,0,0|1,1,0]=4 629 B15R2.4278 SCCCNc1ncnc2c1cc[nH]2 00a0b67b2a2ca720c3dd68da01c02e83 [2,0,0,0,0,0|0,1,0]=3 630 B15R2.4278 SCCCNc1ncnc2c1cco2 348702d4019f7ac7bb4890f8b7a5ef28 [2,0,0,0,0,0|1,1,0]=4 631 B15R2.4278 SCCCNc1ncnc2c1ccs2 9421662232a00e49ff0af22c6de3e896 [2,0,0,0,0,0|1,1,0]=4 632 B15R2.4278 SCCCNc1ncnc2c1cn[nH]2 b0250703ca771e6ba38387176b8b794f [2,0,0,0,0,0|1,1,0]=4 633 B15R2.4278 SCCCNc1ncnc2c1nc[nH]2 368c561451fecb195c40dbd8e67aa7c3 [2,0,0,0,0,0|1,1,0]=4 634 B15R2.4278 SCCCOc1ncnc2c1cc[nH]2 2bb52d9a503a8e0cf2d5a69ca22249f1 [2,0,0,0,0,0|1,1,0]=4 635 B15R2.11987 CCNc1ncnc2c1c(n[nH]2)SC 9b543765ec004ef68e68e965d4c21912 [2,0,0,0,0,0|1,0,0]=3 636 B15R2.11987 CSc1n[nH]c2c1c(ncn2)NCF 51b9d5baa9b881d283a56e6211e89fb2 [2,0,0,0,0,0|2,0,0]=4 637 B15R2.11987 CSc1n[nH]c2c1c(ncn2)NCO 90708a827ba35f4e87382e5aa89bbb49 [2,0,0,0,0,0|1,0,0]=3 638 B17R2.19054 C#CCCCNc1ccnc2c1c(c[nH]2)C 2072035d46ecb40a7329ffb7cbc91b28 [1,1,0,0,0,0|2,0,0]=4 639 B17R2.19054 C#CCCCNc1ncnc2c1c(c[nH]2)Br 9ae6368a41cd4ce98e0a8113b81a0e92 [1,1,0,0,0,0|2,0,0]=4 640 B17R2.19054 C#CCCCNc1ncnc2c1c(c[nH]2)C 349e5fb861ded734c141a7220767dafd [1,1,0,0,0,0|1,0,0]=3 641 B17R2.19054 C#CCCCNc1ncnc2c1c(c[nH]2)Cl 2217e4245cd1be9cde6f5efb4a867d11 [1,1,0,0,0,0|2,0,0]=4 642 B17R2.19054 C#CCCCNc1ncnc2c1c(c[nH]2)F adf5018c6d7dba6f7202c5049caa2639 [1,1,0,0,0,0|2,0,0]=4 643 B17R2.19054 C#CCCCNc1ncnc2c1c(c[nH]2)I 52dff9c70ae232234425a7573f7fa819 [1,1,0,0,0,0|2,0,0]=4 644 B17R2.19054 C#CCCCNc1ncnc2c1c(co2)C 8bf953fd335b019c50335ef7952ed313 [1,1,0,0,0,0|2,0,0]=4 645 B17R2.19054 C#CCCCNc1ncnc2c1c(n[nH]2)C 837a015e7ac7f183935b93a91e7305b6 [1,1,0,0,0,0|2,0,0]=4 646 B17R2.19054 C=CCCCNc1ccnc2c1c(c[nH]2)C a027ef61d985b3d5fb9cea0ce6d49fcb [1,1,0,0,0,0|2,0,0]=4 647 B17R2.19054 C=CCCCNc1ncnc2c1c(c[nH]2)Br bed23ac5a32b0e0d2629ebdbaac5dff5 [1,1,0,0,0,0|2,0,0]=4 648 B17R2.19054 C=CCCCNc1ncnc2c1c(c[nH]2)C 462c81ba595c2e46fc3dfdb9517e6a3e [1,1,0,0,0,0|1,0,0]=3 649 B17R2.19054 C=CCCCNc1ncnc2c1c(c[nH]2)Cl ab15eaf22b36bff7ef5426d3c76f8154 [1,1,0,0,0,0|2,0,0]=4 650 B17R2.19054 C=CCCCNc1ncnc2c1c(c[nH]2)F 10b82f1810ec14fefb0c4e336e7aa91f [1,1,0,0,0,0|2,0,0]=4 651 B17R2.19054 C=CCCCNc1ncnc2c1c(c[nH]2)I 2a9d87cfc0e85f4accf9d0e9b6e9df7e [1,1,0,0,0,0|2,0,0]=4 652 B17R2.19054 C=CCCCNc1ncnc2c1c(co2)C e673af02ef3f7a0e0959e19d7a48f19f [1,1,0,0,0,0|2,0,0]=4 653 B17R2.19054 C=CCCCNc1ncnc2c1c(cs2)C 665eb4a83c8a63d0e6cec0189187631c [1,1,0,0,0,0|2,0,0]=4 654 B17R2.19054 C=CCCCNc1ncnc2c1c(n[nH]2)C 5dc9ac7c9b5dc312a230ec762b8bfd36 [1,1,0,0,0,0|2,0,0]=4 655 B17R2.19054 C=COCCNc1ncnc2c1c(c[nH]2)C a12e8717fc9861e135d351de43d92316 [1,1,0,0,0,0|1,0,1]=4 656 B17R2.19054 CC/C=C/CNc1ncnc2c1c(c[nH]2)C dd2342d2e540d539115e9a719672beca [1,1,0,0,0,0|1,0,1]=4 657 B17R2.19054 CCC#CCNc1ncnc2c1c(c[nH]2)C 37b1b0badce128eb410a8dc62f9f7443 [1,1,0,0,0,0|1,0,1]=4 658 B17R2.19054 CCCCCNc1ccnc2c1c(c[nH]2)C abc6e89964283db6664a53430e889995 [1,1,0,0,0,0|2,0,0]=4 659 B17R2.19054 CCCCCNc1ncnc2c1c(c[nH]2)Br afb2c5720636eeb1f422fd5b807f2a09 [1,1,0,0,0,0|2,0,0]=4 660 B17R2.19054 CCCCCNc1ncnc2c1c(c[nH]2)C 6eb0c41db0374131d892205bfc790599 [1,1,0,0,0,0|1,0,0]=3 661 B17R2.19054 CCCCCNc1ncnc2c1c(c[nH]2)Cl f8e92f450ddfdb1f83afe612d2c60fc0 [1,1,0,0,0,0|2,0,0]=4 662 B17R2.19054 CCCCCNc1ncnc2c1c(c[nH]2)F 541da703170616f1303e0798ca42d8a0 [1,1,0,0,0,0|2,0,0]=4 663 B17R2.19054 CCCCCNc1ncnc2c1c(c[nH]2)I bcf49541521a4c6c03266e4289716fb0 [1,1,0,0,0,0|2,0,0]=4 664 B17R2.19054 CCCCCNc1ncnc2c1c(co2)C a7ff00e43b6bd96e991b6243059f69c6 [1,1,0,0,0,0|2,0,0]=4 665 B17R2.19054 CCCCCNc1ncnc2c1c(n[nH]2)C c6f2a84ef0b72e67c5ac95101992654a [1,1,0,0,0,0|2,0,0]=4 666 B17R2.19054 CCOCCNc1ccnc2c1c(c[nH]2)C dd5d4e4339b123c0de4b2eb80889e8c0 [1,1,0,0,0,0|2,0,0]=4 667 B17R2.19054 CCOCCNc1ncnc2c1c(c[nH]2)Br 6552e8d89834c77c024927f2fc9d6540 [1,1,0,0,0,0|2,0,0]=4 668 B17R2.19054 CCOCCNc1ncnc2c1c(c[nH]2)C 522bbf0685d664e536df5eeaeda59d67 [1,1,0,0,0,0|1,0,0]=3 669 B17R2.19054 CCOCCNc1ncnc2c1c(c[nH]2)Cl f89ba55efec706dc5ea91adb5d0b932c [1,1,0,0,0,0|2,0,0]=4 670 B17R2.19054 CCOCCNc1ncnc2c1c(c[nH]2)F 9eb85fdc5875c220f569f3a215246a25 [1,1,0,0,0,0|2,0,0]=4 671 B17R2.19054 CCOCCNc1ncnc2c1c(c[nH]2)I 7fbd0c5c6a86dd4e1af7fa75345cc433 [1,1,0,0,0,0|2,0,0]=4 672 B17R2.19054 CCOCCNc1ncnc2c1c(co2)C 3bab0add61d24d71dbd5ae96bd5e2471 [1,1,0,0,0,0|2,0,0]=4 673 B17R2.19054 CCOCCNc1ncnc2c1c(cs2)C cefe5bb0d92a44bf61f158d81d7d91f8 [1,1,0,0,0,0|2,0,0]=4 674 B17R2.19054 CCOCCNc1ncnc2c1c(n[nH]2)C fd701bb068b6d81d03ac71d411c3ff2a [1,1,0,0,0,0|2,0,0]=4 675 B17R2.19054 CCSCCNc1ccnc2c1c(c[nH]2)C a3d30ddd59fa0b84498b323f1aa12aa2 [1,1,0,0,0,0|2,0,0]=4 676 B17R2.19054 CCSCCNc1ncnc2c1c(c[nH]2)Br e659202d51dd4588eb8db0cf7dea0a89 [1,1,0,0,0,0|2,0,0]=4 677 B17R2.19054 CCSCCNc1ncnc2c1c(c[nH]2)C a27b9d5504c0e3f794be95312fa8ab47 [1,1,0,0,0,0|1,0,0]=3 678 B17R2.19054 CCSCCNc1ncnc2c1c(c[nH]2)Cl 0daf98513b157ba5ca660b0c4819e4f2 [1,1,0,0,0,0|2,0,0]=4 679 B17R2.19054 CCSCCNc1ncnc2c1c(c[nH]2)F 0a60b12fdfad2dcf137ee222bf69a10a [1,1,0,0,0,0|2,0,0]=4 680 B17R2.19054 CCSCCNc1ncnc2c1c(c[nH]2)I dc4ae85bc4614823d14875494a3eb1dc [1,1,0,0,0,0|2,0,0]=4 681 B17R2.19054 CCSCCNc1ncnc2c1c(co2)C 499c5ead7470f21b147cffe12131dcdb [1,1,0,0,0,0|2,0,0]=4 682 B17R2.19054 CCSCCNc1ncnc2c1c(n[nH]2)C 4fa79e9d3ff3285608ce2d069d0fb72c [1,1,0,0,0,0|2,0,0]=4 683 B17R2.19054 COCCCNc1cccc2c1c(c[nH]2)C f123352e9faa92dba2e2040d7662479e [1,1,0,0,0,0|2,0,0]=4 684 B17R2.19054 COCCCNc1ccnc2c1c(c[nH]2)Br abe0f0c1eccfb16398594e591556c64e [1,1,0,0,0,0|2,0,0]=4 685 B17R2.19054 COCCCNc1ccnc2c1c(c[nH]2)C 0aefa9776fefbc8487741d54862045bb [1,1,0,0,0,0|1,0,0]=3 686 B17R2.19054 COCCCNc1ccnc2c1c(c[nH]2)F 97164f80746ae493382232497e4b58e5 [1,1,0,0,0,0|2,0,0]=4 687 B17R2.19054 COCCCNc1ccnc2c1c(n[nH]2)C afaeb3e0e65b35af3c3306753d1fc119 [1,1,0,0,0,0|2,0,0]=4 688 B17R2.19054 COCCCNc1nccc2c1c(c[nH]2)Br 1aa66d474d88ac1fecb63676e0392571 [1,1,0,0,0,0|2,0,0]=4 689 B17R2.19054 COCCCNc1ncnc2c1c(c[nH]2)Br 157502df6cc39ef72f9c71ef4370a6c9 [1,1,0,0,0,0|1,0,0]=3 690 B17R2.19054 COCCCNc1ncnc2c1c(c[nH]2)C b9e7de39b638a0352157104ed06f72ac [1,1,0,0,0,0|0,0,0]=2 691 B17R2.19054 COCCCNc1ncnc2c1c(c[nH]2)Cl ffdc04d1edce3ff88cc8f2787a5738ae [1,1,0,0,0,0|1,0,0]=3 692 B17R2.19054 COCCCNc1ncnc2c1c(c[nH]2)F cb397bd00f9658917e8fe08784ca4913 [1,1,0,0,0,0|1,0,0]=3 693 B17R2.19054 COCCCNc1ncnc2c1c(c[nH]2)I 3ea89321d28c3f92045eb4c083cdebc4 [1,1,0,0,0,0|1,0,0]=3 694 B17R2.19054 COCCCNc1ncnc2c1c(co2)C 3048e17ed3d3ba6a953f0263ba45fe3f [1,1,0,0,0,0|1,0,0]=3 695 B17R2.19054 COCCCNc1ncnc2c1c(cs2)Br cf72206a99bf71b0105fc138cfa91a0b [1,1,0,0,0,0|2,0,0]=4 696 B17R2.19054 COCCCNc1ncnc2c1c(n[nH]2)Br c1e15568efbe1f505f17b69939bc761a [1,1,0,0,0,0|2,0,0]=4 697 B17R2.19054 COCCCNc1ncnc2c1c(n[nH]2)C 85364f5df4962d940f136d5ab1085587 [1,1,0,0,0,0|1,0,0]=3 698 B17R2.19054 COCCCNc1ncnc2c1c(n[nH]2)Cl 6be0cdbbbc0efccfb1119784074776f0 [1,1,0,0,0,0|2,0,0]=4 699 B17R2.19054 COCCCNc1ncnc2c1c(n[nH]2)I a679382ba55702b0a3a665f5e78b77c9 [1,1,0,0,0,0|2,0,0]=4 700 B17R2.19054 COCCCNc1ncnc2c1c(no2)C 7a6387c701ef3f46f42c1b7d487c57f2 [1,1,0,0,0,0|2,0,0]=4 701 B17R2.19054 COCCCNc1ncnc2c1n(cn2)C c51962328aab9d8b541e27865c677c3a [1,1,0,0,0,0|1,0,1]=4 702 B17R2.19054 COCCCNc1ncnn2c1c(cc2)C 5bb479f61d102f254cc015578a0e14a7 [1,1,0,0,0,0|2,0,0]=4 703 B17R2.19054 COCCCOc1ncnc2c1c(c[nH]2)Cl 87cd12ebfa6205f68dd38eb364ebc074 [1,1,0,0,0,0|2,0,0]=4 704 B17R2.19054 COCCCOc1ncnc2c1c(n[nH]2)C e6f73a77ff809818d2f4162ff9087e54 [1,1,0,0,0,0|2,0,0]=4 705 B17R2.19054 CSCCCNc1ccnc2c1c(c[nH]2)C 37ac24fb0c1080975b5204fa5f23e1e6 [1,1,0,0,0,0|1,1,0]=4 706 B17R2.19054 CSCCCNc1ncnc2c1c(c[nH]2)Br 225d63fb0f7658d80e72ce1dca1db32b [1,1,0,0,0,0|1,1,0]=4 707 B17R2.19054 CSCCCNc1ncnc2c1c(c[nH]2)C aad7d32ed39d1a881b7a2abb3db63790 [1,1,0,0,0,0|0,1,0]=3 708 B17R2.19054 CSCCCNc1ncnc2c1c(c[nH]2)Cl 90c6776d91774e984363879f37ed3b0b [1,1,0,0,0,0|1,1,0]=4 709 B17R2.19054 CSCCCNc1ncnc2c1c(c[nH]2)F 2966e8a53c296836726a949f468e358d [1,1,0,0,0,0|1,1,0]=4 710 B17R2.19054 CSCCCNc1ncnc2c1c(c[nH]2)I 4bbc65d0df74bc8c8f5f3239cbc1fc36 [1,1,0,0,0,0|1,1,0]=4 711 B17R2.19054 CSCCCNc1ncnc2c1c(co2)C f926b7c683843ce90cae0fcb90e32136 [1,1,0,0,0,0|1,1,0]=4 712 B17R2.19054 CSCCCNc1ncnc2c1c(n[nH]2)C 19d7827a2c382b6063b61669200bcad0 [1,1,0,0,0,0|1,1,0]=4 713 B17R2.19054 Cc1c[nH]c2c1c(ccc2)NCCCCO 96dec6f0ba6665b2bdfbf49bc1068c65 [1,1,0,0,0,0|2,0,0]=4 714 B17R2.19054 Cc1c[nH]c2c1c(ccn2)NCCCC#N 41863e25840439c962494a1b952ea0f4 [1,1,0,0,0,0|2,0,0]=4 715 B17R2.19054 Cc1c[nH]c2c1c(ccn2)NCCCC=O 7c49a4630632ad09420ff68c53766b5e [1,1,0,0,0,0|1,0,1]=4 716 B17R2.19054 Cc1c[nH]c2c1c(ccn2)NCCCCCl f63075006eb830a1ceecee05160b18be [1,1,0,0,0,0|2,0,0]=4 717 B17R2.19054 Cc1c[nH]c2c1c(ccn2)NCCCCF 3f3f1c211b26d0989a19d40f5d07de68 [1,1,0,0,0,0|2,0,0]=4 718 B17R2.19054 Cc1c[nH]c2c1c(ccn2)NCCCCO 5d45cf6b4b5e7afcde8ef4757b5af870 [1,1,0,0,0,0|1,0,0]=3 719 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCC#CCO 7db59aa140b3f2328b40e901f11d2d3d [1,1,0,0,0,0|0,0,1]=3 720 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCCCC#N 477abfd1b760d2c40363c551be8169f3 [1,1,0,0,0,0|1,0,0]=3 721 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCCCC=O 626cd17930fe00d019103a1ade52f26c [1,1,0,0,0,0|0,0,1]=3 722 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCCCCCl 77467ae41aede8365817d57ecc0d799e [1,1,0,0,0,0|1,0,0]=3 723 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCCCCF cb7e83ed08d7f13ae5e1f97593648241 [1,1,0,0,0,0|1,0,0]=3 724 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCCCCO 5c0e15e4d5e8ce09a48f4e7b0341f6e5 [1,1,0,0,0,0|0,0,0]=2 725 B17R2.19054 Cc1c[nH]c2c1c(ncn2)NCCCCS d238b12b9662feef8c19b1127ca50142 [1,1,0,0,0,0|0,1,0]=3 726 B17R2.19054 Cc1ccn2c1c(ncn2)NCCCCO a63830485f7a87ceaef4866b30e39aab [1,1,0,0,0,0|2,0,0]=4 727 B17R2.19054 Cc1coc2c1c(ncn2)NCCCC#N dcd37ad8ad395ee52e623e6c2a128296 [1,1,0,0,0,0|2,0,0]=4 728 B17R2.19054 Cc1coc2c1c(ncn2)NCCCC=O bfbe350508cd8333efe3daf7c4ff8126 [1,1,0,0,0,0|1,0,1]=4 729 B17R2.19054 Cc1coc2c1c(ncn2)NCCCCF 66a2b4a76ad380f833930c8ccbcf7e2e [1,1,0,0,0,0|2,0,0]=4 730 B17R2.19054 Cc1coc2c1c(ncn2)NCCCCO da89888e956d4b7e2d51483a28477890 [1,1,0,0,0,0|1,0,0]=3 731 B17R2.19054 Cc1n[nH]c2c1c(ccn2)NCCCCO 9dbe9e14743596b9f6be5909257f4fff [1,1,0,0,0,0|2,0,0]=4 732 B17R2.19054 Cc1n[nH]c2c1c(ncn2)NCCCC#N 796a9dc29e8c77b73edb9af0fef563bc [1,1,0,0,0,0|2,0,0]=4 733 B17R2.19054 Cc1n[nH]c2c1c(ncn2)NCCCC=O 47bcfcf7c0fae8f760c2812cc05f995e [1,1,0,0,0,0|1,0,1]=4 734 B17R2.19054 Cc1n[nH]c2c1c(ncn2)NCCCCF 35aac4e399ea36b29686b6280b73cbdc [1,1,0,0,0,0|2,0,0]=4 735 B17R2.19054 Cc1n[nH]c2c1c(ncn2)NCCCCO 1be9af8caada662ddedb9be865ee4648 [1,1,0,0,0,0|1,0,0]=3 736 B17R2.19054 Cc1noc2c1c(ncn2)NCCCCO aa00529b5f750cc5a95a4382e9c9535f [1,1,0,0,0,0|2,0,0]=4 737 B17R2.19054 Cn1ccc2c1c(ncn2)NCCCCO ebdc12918745d1e4dce72bbccc907945 [1,1,0,0,0,0|2,0,0]=4 738 B17R2.19054 Cn1cnc2c1c(ncn2)NCCCCO 5e817ca76ba8f421e369adf86f6f6a8c [1,1,0,0,0,0|1,0,1]=4 739 B17R2.19054 FCCCCNc1ncnc2c1c(c[nH]2)Br a7559a2da71f5e8572384d6a1e8bc7b7 [1,1,0,0,0,0|2,0,0]=4 740 B17R2.19054 FCCCCNc1ncnc2c1c(c[nH]2)Cl a23d314aaf16bb38973aedafcedfd66c [1,1,0,0,0,0|2,0,0]=4 741 B17R2.19054 FCCCCNc1ncnc2c1c(c[nH]2)F 7c0e1c1a5f79026b2210649a04fcee78 [1,1,0,0,0,0|2,0,0]=4 742 B17R2.19054 FCCCCNc1ncnc2c1c(c[nH]2)I 9c3a9ee3957fb61a7caf51b4e3942192 [1,1,0,0,0,0|2,0,0]=4 743 B17R2.19054 N#CCCCNc1ncnc2c1c(c[nH]2)Br 1fe0ca24e982f13f4eb88962d10fd9aa [1,1,0,0,0,0|2,0,0]=4 744 B17R2.19054 N#CCCCNc1ncnc2c1c(c[nH]2)Cl 04f8f23dd1f49b78309a7bf203d8b4f9 [1,1,0,0,0,0|2,0,0]=4 745 B17R2.19054 N#CCCCNc1ncnc2c1c(c[nH]2)F fd37148cfa76403312ad5fa0917d83bf [1,1,0,0,0,0|2,0,0]=4 746 B17R2.19054 N#CCCCNc1ncnc2c1c(c[nH]2)I 57d98b7712f2086b3bcb1820823065db [1,1,0,0,0,0|2,0,0]=4 747 B17R2.19054 O=CCCCNc1ncnc2c1c(c[nH]2)Br d3acb255e5092100665bfb4aebf968f2 [1,1,0,0,0,0|1,0,1]=4 748 B17R2.19054 O=CCCCNc1ncnc2c1c(c[nH]2)Cl 9648217fc189d450a6980c232a7c8c5a [1,1,0,0,0,0|1,0,1]=4 749 B17R2.19054 O=CCCCNc1ncnc2c1c(c[nH]2)F 038ca768cf21b8bf53fa6cdaff6a1165 [1,1,0,0,0,0|1,0,1]=4 750 B17R2.19054 O=CCCCNc1ncnc2c1c(c[nH]2)I 7e38053f9b686955171bf88280139a6e [1,1,0,0,0,0|1,0,1]=4 751 B17R2.19054 OCC#CCNc1ncnc2c1c(c[nH]2)I a9f329b6ea2b6e5a0466166b8d277771 [1,1,0,0,0,0|1,0,1]=4 752 B17R2.19054 OCCCCNc1ccnc2c1c(c[nH]2)Br 5f99b4a5c97c85e57edfcabf52c36670 [1,1,0,0,0,0|2,0,0]=4 753 B17R2.19054 OCCCCNc1ccnc2c1c(c[nH]2)F a23805907d9edc2abadbc9ee61005dc7 [1,1,0,0,0,0|2,0,0]=4 754 B17R2.19054 OCCCCNc1nccc2c1c(c[nH]2)Br bf5d2f6212cea3a76db34495e83c68bd [1,1,0,0,0,0|2,0,0]=4 755 B17R2.19054 OCCCCNc1ncnc2c1c(c[nH]2)Br cc8e471e09122024b44ed07122e7049c [1,1,0,0,0,0|1,0,0]=3 756 B17R2.19054 OCCCCNc1ncnc2c1c(c[nH]2)Cl cb4920fbc59b021ffbd0c6ac00753726 [1,1,0,0,0,0|1,0,0]=3 757 B17R2.19054 OCCCCNc1ncnc2c1c(c[nH]2)F ca2b76f4a5e463d830a2f52e1a2d3d17 [1,1,0,0,0,0|1,0,0]=3 758 B17R2.19054 OCCCCNc1ncnc2c1c(c[nH]2)I 854116672a670aca7830101f47bb9a2f [1,1,0,0,0,0|1,0,0]=3 759 B17R2.19054 OCCCCNc1ncnc2c1c(cs2)Br 1ef606be791647901232cb7dbec6fac5 [1,1,0,0,0,0|2,0,0]=4 760 B17R2.19054 OCCCCNc1ncnc2c1c(n[nH]2)Br 4794c6457904c3d843ef2e1702785a77 [1,1,0,0,0,0|2,0,0]=4 761 B17R2.19054 OCCCCNc1ncnc2c1c(n[nH]2)Cl 1cc371dd0cd3bbf89b728799ddbd6653 [1,1,0,0,0,0|2,0,0]=4 762 B17R2.19054 OCCCCNc1ncnc2c1c(n[nH]2)I 9529b835c6429190617325f6f945a45f [1,1,0,0,0,0|2,0,0]=4 763 B17R2.49547 CC(CCO)Nc1ccnc2c1c(c[nH]2)Br 66cbee0ac52fe6eadbb12c17623b7bda [1,1,0,0,0,0|2,0,0]=4 764 B17R2.49547 CC(CCO)Nc1ccnc2c1c(c[nH]2)F 0ffcc4ff2a941425ad8d35c9a2673acf [1,1,0,0,0,0|2,0,0]=4 765 B17R2.49547 CC(CCO)Nc1nccc2c1c(c[nH]2)Br efe6c21c1f9f1dc0632c450146380b46 [1,1,0,0,0,0|2,0,0]=4 766 B17R2.49547 CC(CCO)Nc1ncnc2c1c(c[nH]2)Cl fb184dbeb9c363bdea2b866f384d673e [1,1,0,0,0,0|1,0,0]=3 767 B17R2.49547 CC(CCO)Nc1ncnc2c1c(c[nH]2)F 25c9d73aa0b5dc9dddcdae1158ac1e38 [1,1,0,0,0,0|1,0,0]=3 768 B17R2.49547 CC(CCO)Nc1ncnc2c1c(c[nH]2)I 760ff9e06b18b0b6adeb13709b9af24e [1,1,0,0,0,0|1,0,0]=3 769 B17R2.49547 CCCC(C)Nc1ccnc2c1c(c[nH]2)C 4717a537a8958e948e4796a4dfccf827 [1,1,0,0,0,0|2,0,0]=4 770 B17R2.49547 CCCC(C)Nc1ncnc2c1c(c[nH]2)Br 86e64dc73a5947c1ab064697d38d739b [1,1,0,0,0,0|2,0,0]=4 771 B17R2.49547 CCCC(C)Nc1ncnc2c1c(c[nH]2)C 8c3d777591dff115d9d8d6c429e28dee [1,1,0,0,0,0|1,0,0]=3 772 B17R2.49547 CCCC(C)Nc1ncnc2c1c(c[nH]2)Cl 9396948cc9c1a1957f536e946bb298ba [1,1,0,0,0,0|2,0,0]=4 773 B17R2.49547 CCCC(C)Nc1ncnc2c1c(c[nH]2)F 0134112f13cf28bdbcf2504b259e618d [1,1,0,0,0,0|2,0,0]=4 774 B17R2.49547 CCCC(C)Nc1ncnc2c1c(c[nH]2)I a110d8f87d71af68ccc0f5f00e3d20a4 [1,1,0,0,0,0|2,0,0]=4 775 B17R2.49547 CCCC(C)Nc1ncnc2c1c(co2)C 30b7de3b6c0f5b01c2b5130f06b2752e [1,1,0,0,0,0|2,0,0]=4 776 B17R2.49547 CCCC(C)Nc1ncnc2c1c(n[nH]2)C d83ed9a05a7f4b033756600a826195c0 [1,1,0,0,0,0|2,0,0]=4 777 B17R2.49547 COCC(C)Nc1ncnc2c1c(c[nH]2)C fc487f060baf9dd8247b70a2b45827c3 [1,1,0,0,0,0|2,0,0]=4 778 B17R2.49547 C[C@@H](CCO)Nc1ccnc2c1c(c[nH]2)F c96e56bd9105fbf3bad219cc01ed7c2a [1,1,0,0,0,0|2,0,0]=4 779 B17R2.49547 C[C@H](CCO)Nc1ccnc2c1c(c[nH]2)F 776929df4105ef690477e038f4481c35 [1,1,0,0,0,0|2,0,0]=4 780 B17R2.49547 Cc1c[nH]c2c1c(ccn2)NC(C)CCO 6bb45e1284ce2096cc2d71605ac42bc0 [1,1,0,0,0,0|1,0,0]=3 781 B17R2.49547 Cc1c[nH]c2c1c(ncn2)NC(C)CC#N 079cf2c9f619e930cd95ecb9a6c70f21 [1,1,0,0,0,0|1,0,1]=4 782 B17R2.49547 Cc1c[nH]c2c1c(ncn2)NC(C)CCO cdd0fdcdab7ab2a224aa56858117781c [1,1,0,0,0,0|0,0,0]=2 783 B17R2.49547 Cc1coc2c1c(ncn2)NC(C)CCO 042b536b2b718570463a9d952e481e71 [1,1,0,0,0,0|1,0,0]=3 784 B17R2.49547 Cc1n[nH]c2c1c(ccn2)NC(C)CCO 3d87bcbb534a14ac622b35b835638da2 [1,1,0,0,0,0|2,0,0]=4 785 B17R2.49547 Cc1n[nH]c2c1c(ncn2)NC(C)CCO a7ad9f04362075e85751cce1e4656208 [1,1,0,0,0,0|1,0,0]=3 786 B17R2.57658 C=C(CC)CNc1ncnc2c1c(c[nH]2)C b9e32a1f786a7a963ccfc2df2d6f1397 [1,1,0,0,0,0|1,0,1]=4 787 B17R2.57658 C=C(CO)CNc1ccnc2c1c(c[nH]2)C d640e4e61298cba5d0212d417afd923c [1,1,0,0,0,0|1,0,1]=4 788 B17R2.57658 C=C(CO)CNc1ncnc2c1c(c[nH]2)Br e8f2ea41b47081fa7a0e70737586e0a5 [1,1,0,0,0,0|1,0,1]=4 789 B17R2.57658 C=C(CO)CNc1ncnc2c1c(c[nH]2)C 87127eba75eceed15b44f2b630d33956 [1,1,0,0,0,0|0,0,1]=3 790 B17R2.57658 C=C(CO)CNc1ncnc2c1c(c[nH]2)Cl ddb473bb278e682d1869af6b4f0a00ce [1,1,0,0,0,0|1,0,1]=4 791 B17R2.57658 C=C(CO)CNc1ncnc2c1c(c[nH]2)F 1bb6ba493bb4dc2e1ddb4d30f005fba9 [1,1,0,0,0,0|1,0,1]=4 792 B17R2.57658 C=C(CO)CNc1ncnc2c1c(c[nH]2)I 3a2db1d31acde5142d17774e3041db8d [1,1,0,0,0,0|1,0,1]=4 793 B17R2.57658 C=C(CO)CNc1ncnc2c1c(co2)C a0bcdedf32bf1378738d837fb05cfc13 [1,1,0,0,0,0|1,0,1]=4 794 B17R2.57658 C=C(CO)CNc1ncnc2c1c(n[nH]2)C 043ae47e208bb529aa84bdfdfc929e2b [1,1,0,0,0,0|1,0,1]=4 795 B17R2.57658 C=CC(O)CNc1ncnc2c1c(c[nH]2)C 7c25f7f51c6bcf8edc1d00aba0e9f868 [1,1,0,0,0,0|1,0,1]=4 796 B17R2.57658 CC(CO)CNc1ccnc2c1c(c[nH]2)Br f2cdb95ce0c6bddfa337f2a04cc17511 [1,1,0,0,0,0|2,0,0]=4 797 B17R2.57658 CC(CO)CNc1nccc2c1c(c[nH]2)Br db5d4f3725da767620f11d63627d97e2 [1,1,0,0,0,0|2,0,0]=4 798 B17R2.57658 CC(CO)CNc1ncnc2c1c(c[nH]2)Br 2e24b3dfd9cf6671b602243b9420f14e [1,1,0,0,0,0|1,0,0]=3 799 B17R2.57658 CC(CO)CNc1ncnc2c1c(c[nH]2)Cl 0d800847a4a7f8bfe472e1bf52f88f16 [1,1,0,0,0,0|1,0,0]=3 800 B17R2.57658 CC(CO)CNc1ncnc2c1c(c[nH]2)F d2a168fa6d08dec07bd9d0dedb6bff9d [1,1,0,0,0,0|1,0,0]=3 801 B17R2.57658 CC(CO)CNc1ncnc2c1c(c[nH]2)I 53abf69027aea2aa2db8ec90d6ddcab6 [1,1,0,0,0,0|1,0,0]=3 802 B17R2.57658 CC(CO)CNc1ncnc2c1c(cs2)Br 63c5f52cc347b649284d8ca60296463b [1,1,0,0,0,0|2,0,0]=4 803 B17R2.57658 CC(CO)CNc1ncnc2c1c(n[nH]2)Br ec495671ba4ecca9b3d7d6cf21a0fcfe [1,1,0,0,0,0|2,0,0]=4 804 B17R2.57658 CC(CO)CNc1ncnc2c1c(n[nH]2)Cl 0d9036d4533f964bc5cdb82ff37d0381 [1,1,0,0,0,0|2,0,0]=4 805 B17R2.57658 CC(CO)CNc1ncnc2c1c(n[nH]2)I fd1c52419a3c9ad524568de640a33887 [1,1,0,0,0,0|2,0,0]=4 806 B17R2.57658 CC(CO)CNc1ncnc2c1n(cn2)C 3c9925fccc372ce7dc23528670f63177 [1,1,0,0,0,0|1,0,1]=4 807 B17R2.57658 CCC(=O)CNc1ncnc2c1c(c[nH]2)C ebc0efbec971c69ae457498641607323 [1,1,0,0,0,0|1,0,1]=4 808 B17R2.57658 CCC(C)CNc1ccnc2c1c(c[nH]2)C 6230859f14f7cbb15f710b859f9b0805 [1,1,0,0,0,0|2,0,0]=4 809 B17R2.57658 CCC(C)CNc1ncnc2c1c(c[nH]2)Br 48bc8ae8c5da97b1409ab0a4d629f86a [1,1,0,0,0,0|2,0,0]=4 810 B17R2.57658 CCC(C)CNc1ncnc2c1c(c[nH]2)C 9ed979f9f1d7b3e716722f5a8d20fcf3 [1,1,0,0,0,0|1,0,0]=3 811 B17R2.57658 CCC(C)CNc1ncnc2c1c(c[nH]2)Cl d80491a8a2444215bc1975cf83dfe723 [1,1,0,0,0,0|2,0,0]=4 812 B17R2.57658 CCC(C)CNc1ncnc2c1c(c[nH]2)F fe492a90cf5c99a6eafcf93dad6c82d1 [1,1,0,0,0,0|2,0,0]=4 813 B17R2.57658 CCC(C)CNc1ncnc2c1c(c[nH]2)I 8db97de910dbac1bac6f8c27c511e862 [1,1,0,0,0,0|2,0,0]=4 814 B17R2.57658 CCC(C)CNc1ncnc2c1c(co2)C e2f630739bbfdd45eaf8a0e1041005dc [1,1,0,0,0,0|2,0,0]=4 815 B17R2.57658 CCC(C)CNc1ncnc2c1c(n[nH]2)C ecb412ef9e03f7ad27fce8652f897c7f [1,1,0,0,0,0|2,0,0]=4 816 B17R2.57658 CCC(O)CNc1ccnc2c1c(c[nH]2)C 0da125ee2a8f1209d7b7386e3e8eb596 [1,1,0,0,0,0|2,0,0]=4 817 B17R2.57658 CCC(O)CNc1ncnc2c1c(c[nH]2)Br 8ab7a8862c86c1b6380c0ad60a55d034 [1,1,0,0,0,0|2,0,0]=4 818 B17R2.57658 CCC(O)CNc1ncnc2c1c(c[nH]2)C f1ab3758387d2650c8814eab18451cf5 [1,1,0,0,0,0|1,0,0]=3 819 B17R2.57658 CCC(O)CNc1ncnc2c1c(c[nH]2)Cl 81b621da1343537316473d8ad7054d67 [1,1,0,0,0,0|2,0,0]=4 820 B17R2.57658 CCC(O)CNc1ncnc2c1c(c[nH]2)F 00f56a8c7d05f13ccbaf97b61be0fbc7 [1,1,0,0,0,0|2,0,0]=4 821 B17R2.57658 CCC(O)CNc1ncnc2c1c(c[nH]2)I 04e6ec8c9afe694e3398c849cf595555 [1,1,0,0,0,0|2,0,0]=4 822 B17R2.57658 CCC(O)CNc1ncnc2c1c(co2)C 2c5d7f8004c323b6aea0ceb8581dab56 [1,1,0,0,0,0|2,0,0]=4 823 B17R2.57658 CCC(O)CNc1ncnc2c1c(n[nH]2)C bd27e5ab68bc5b2f05bf38fea5702297 [1,1,0,0,0,0|2,0,0]=4 824 B17R2.57658 CC[C@@H](C)CNc1ccnc2c1c(c[nH]2)C d1a940fe8eb39206b74a6dfbbb25956d [1,1,0,0,0,0|2,0,0]=4 825 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(c[nH]2)Br 40f214d95e34a5641f49509a448c3433 [1,1,0,0,0,0|2,0,0]=4 826 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(c[nH]2)C d21211898cd26af07ee6370832a47c6e [1,1,0,0,0,0|1,0,0]=3 827 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(c[nH]2)Cl d117f318c44ad28fc8ba811daa808bb5 [1,1,0,0,0,0|2,0,0]=4 828 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(c[nH]2)F 01565d7faa58eba640e4f1fb74e05e2a [1,1,0,0,0,0|2,0,0]=4 829 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(c[nH]2)I 38b7744abab4665a546c5bad24827483 [1,1,0,0,0,0|2,0,0]=4 830 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(co2)C 0fa9ae636d48c81181e3aa74d215525e [1,1,0,0,0,0|2,0,0]=4 831 B17R2.57658 CC[C@@H](C)CNc1ncnc2c1c(n[nH]2)C ffda6b69e21a85514abc03a4776a5853 [1,1,0,0,0,0|2,0,0]=4 832 B17R2.57658 CC[C@@H](O)CNc1ncnc2c1c(c[nH]2)C 6e3762cb629f81886566a74949690143 [1,1,0,0,0,0|1,0,0]=3 833 B17R2.57658 CC[C@H](C)CNc1ccnc2c1c(c[nH]2)C d36daa9be1fc7674f2044c78b3c80fad [1,1,0,0,0,0|2,0,0]=4 834 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)Br d488f2ccdd0fa1e573b7cc32fc45873f [1,1,0,0,0,0|2,0,0]=4 835 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)C 242fcd586ad20ec27f4b471588b75b98 [1,1,0,0,0,0|1,0,0]=3 836 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)Cl c5db618aee77f8bbdf10d2b7d5ec008d [1,1,0,0,0,0|2,0,0]=4 837 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)F 129f4299b4aea377edf457866299cd0b [1,1,0,0,0,0|2,0,0]=4 838 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)I 8b466191ebb0ff7d42436410b20fd6ac [1,1,0,0,0,0|2,0,0]=4 839 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(co2)C 261f93603a3da5b3aeaef78d41e1720c [1,1,0,0,0,0|2,0,0]=4 840 B17R2.57658 CC[C@H](C)CNc1ncnc2c1c(n[nH]2)C c997e990c52a1f36a5c0174a6740dbdc [1,1,0,0,0,0|2,0,0]=4 841 B17R2.57658 COC(C)CNc1ncnc2c1c(c[nH]2)C 0c1a3729d9097b1b0fa132b0fa70310b [1,1,0,0,0,0|2,0,0]=4 842 B17R2.57658 CO[C@@H](C)CNc1ncnc2c1c(c[nH]2)C 26531a71a21255f2f0c75e99cd3602d0 [1,1,0,0,0,0|2,0,0]=4 843 B17R2.57658 CO[C@H](C)CNc1ncnc2c1c(c[nH]2)C 9fde9fad4b90a3122ccbc572588a5d34 [1,1,0,0,0,0|2,0,0]=4 844 B17R2.57658 C[C@@H](CO)CNc1ccnc2c1c(c[nH]2)Br 59173e2ad3397c6bdde81570c206154a [1,1,0,0,0,0|2,0,0]=4 845 B17R2.57658 C[C@@H](CO)CNc1nccc2c1c(c[nH]2)Br 0812bf9c2232ea42c8bbe246c67118fd [1,1,0,0,0,0|2,0,0]=4 846 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(c[nH]2)Br 99834ecd214d5d0ee605950ad0a51e11 [1,1,0,0,0,0|1,0,0]=3 847 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(c[nH]2)Cl 4439cc3d28132db2627d9b3ac1c573f4 [1,1,0,0,0,0|1,0,0]=3 848 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(c[nH]2)F d049b6e8f0429418693278a12dfaef32 [1,1,0,0,0,0|1,0,0]=3 849 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(c[nH]2)I 302dbcca9756af1258dd19258e3cf545 [1,1,0,0,0,0|1,0,0]=3 850 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(cs2)Br 654bc56c03e49627fd9ee7847dbf5e9f [1,1,0,0,0,0|2,0,0]=4 851 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(n[nH]2)Br f304c9c1e08954f398e550f5d9f5ebe3 [1,1,0,0,0,0|2,0,0]=4 852 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(n[nH]2)Cl 46772adb2d46c384da1cedc4a8022de5 [1,1,0,0,0,0|2,0,0]=4 853 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1c(n[nH]2)I 30024721108c9e01b826d5a721bd5614 [1,1,0,0,0,0|2,0,0]=4 854 B17R2.57658 C[C@@H](CO)CNc1ncnc2c1n(cn2)C eee51fe6213dfee09c4736d401646899 [1,1,0,0,0,0|1,0,1]=4 855 B17R2.57658 C[C@H](CO)CNc1ccnc2c1c(c[nH]2)Br 95639deec060217a9e86405605afa644 [1,1,0,0,0,0|2,0,0]=4 856 B17R2.57658 C[C@H](CO)CNc1nccc2c1c(c[nH]2)Br d5f827c00b5aeb7ba39f542372cd27f6 [1,1,0,0,0,0|2,0,0]=4 857 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)Br 8ff3e8a7258fd58a2fe6c67e20121ab9 [1,1,0,0,0,0|1,0,0]=3 858 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)Cl 5878239720d8b2041f4d4f87d7cc2f9c [1,1,0,0,0,0|1,0,0]=3 859 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)F 10ab8bdd545e7be3927cfd1fd0a71d3e [1,1,0,0,0,0|1,0,0]=3 860 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)I 7ac35e9c706e779c4e43bb2b0eda4d97 [1,1,0,0,0,0|1,0,0]=3 861 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(cs2)Br 2065fe96c54ea8600bac31620fb2a1e6 [1,1,0,0,0,0|2,0,0]=4 862 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(n[nH]2)Br b87f1aa76deedb755d8e75184173bb53 [1,1,0,0,0,0|2,0,0]=4 863 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(n[nH]2)Cl 0baac163ee187df9bd80fe337554625e [1,1,0,0,0,0|2,0,0]=4 864 B17R2.57658 C[C@H](CO)CNc1ncnc2c1c(n[nH]2)I 20e0dbc10a3eece036969bb403bac73b [1,1,0,0,0,0|2,0,0]=4 865 B17R2.57658 C[C@H](CO)CNc1ncnc2c1n(cn2)C 8a279064767668fbdfb9d2ba0cea1e19 [1,1,0,0,0,0|1,0,1]=4 866 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NCC(C)CO ed5a617f5b4216040b8dc44b2f7a41f6 [1,1,0,0,0,0|2,0,0]=4 867 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NCC(F)CO b05e14b68d76d3ca14107473f77e6679 [1,1,0,0,0,0|2,0,0]=4 868 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NCC(O)CO e51e195dcada885b1922f4d597b492a6 [1,1,0,0,0,0|2,0,0]=4 869 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NC[C@@H](C)CO c539399f036617d9abab8238ee5f6662 [1,1,0,0,0,0|2,0,0]=4 870 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NC[C@@H](F)CO 4212e4aaaea4c89474a20f792b8beecd [1,1,0,0,0,0|2,0,0]=4 871 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NC[C@@H](O)CO f12b2703dab61ab38de0113ffa423ae8 [1,1,0,0,0,0|2,0,0]=4 872 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NC[C@H](C)CO 5142a8f154a91c439c51be2a738d83ed [1,1,0,0,0,0|2,0,0]=4 873 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NC[C@H](F)CO c5c09be3b8088a731811631262d80ac5 [1,1,0,0,0,0|2,0,0]=4 874 B17R2.57658 Cc1c[nH]c2c1c(ccc2)NC[C@H](O)CO 4c4dff4a99f00dcb4d359a25348bbe59 [1,1,0,0,0,0|2,0,0]=4 875 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NCC(=O)CO 1ed9040d0dbe8ab08bc9758f408e91dc [1,1,0,0,0,0|1,0,1]=4 876 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NCC(C)CO 8932eee5c34cf76cb3d21eb6dd66f8d0 [1,1,0,0,0,0|1,0,0]=3 877 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NCC(F)CO a8eb64a4b155010909839197834fe2bd [1,1,0,0,0,0|1,0,0]=3 878 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NCC(O)CF 319db72ca2fc9c85ef342ab983a4bcc1 [1,1,0,0,0,0|2,0,0]=4 879 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NCC(O)CO 1f763967ff7ae0f2af50aa32fc61eb0d [1,1,0,0,0,0|1,0,0]=3 880 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NC[C@@H](C)CO af01d06caa874d3872f6cfa4126c852f [1,1,0,0,0,0|1,0,0]=3 881 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NC[C@@H](F)CO a652d7ff8a6b425846126a8fd727f087 [1,1,0,0,0,0|1,0,0]=3 882 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NC[C@@H](O)CO 034b9b0fa7ba636065cbfd75d7b55c80 [1,1,0,0,0,0|1,0,0]=3 883 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NC[C@H](C)CO e3671e5ed1d2e604918aad9b2914a937 [1,1,0,0,0,0|1,0,0]=3 884 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NC[C@H](F)CO 053525fca446df1fd653b8e23177e009 [1,1,0,0,0,0|1,0,0]=3 885 B17R2.57658 Cc1c[nH]c2c1c(ccn2)NC[C@H](O)CO fb0aad7800529e7fb0cbc5db3020f6a3 [1,1,0,0,0,0|1,0,0]=3 886 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(=O)CO 43761aadc5dfa74160862ca891a70d93 [1,1,0,0,0,0|0,0,1]=3 887 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(=O)NO 75066a61633b11d41d2984d23fabffc4 [1,1,0,0,0,0|1,0,1]=4 888 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(Br)CBr 7af28958a0eb8aedf2f05c07f9e1345a [1,1,0,0,0,0|1,0,0]=3 889 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(C)C#N 19073ad33356b9402e9dde38f27b34fe [1,1,0,0,0,0|1,0,1]=4 890 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(C)CO d46340af99e6d5a203537ca5de124ff0 [1,1,0,0,0,0|0,0,0]=2 891 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(F)CO acae8f02316731efd9f4969363ac5b20 [1,1,0,0,0,0|0,0,0]=2 892 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(O)CF b9b5f12e47a3beb70a1ccdb7dbd97e4d [1,1,0,0,0,0|1,0,0]=3 893 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NCC(O)CO 14a6e853bf1ca2c91396f91ce28b9231 [1,1,0,0,0,0|0,0,0]=2 894 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NC[C@@H](C)CO 3cfaf7edc541994095fb13a76f9c7fed [1,1,0,0,0,0|0,0,0]=2 895 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NC[C@@H](F)CO 9e84103d40c782a219130a6312c6d6ab [1,1,0,0,0,0|0,0,0]=2 896 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NC[C@@H](O)CO 24cb542f58ec286aefe11411132fcd5a [1,1,0,0,0,0|0,0,0]=2 897 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NC[C@H](C)CO a8a544b39088bd07e2349a6c4154504a [1,1,0,0,0,0|0,0,0]=2 898 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NC[C@H](F)CO a8f5c904f6687296535908f9606356a9 [1,1,0,0,0,0|0,0,0]=2 899 B17R2.57658 Cc1c[nH]c2c1c(ncn2)NC[C@H](O)CO 2fdf5f01908220ba689fbf2ad776be39 [1,1,0,0,0,0|0,0,0]=2 900 B17R2.57658 Cc1ccn2c1c(ncn2)NCC(C)CO 5a7137c40d1c87d9ce0d107b863792eb [1,1,0,0,0,0|2,0,0]=4 901 B17R2.57658 Cc1ccn2c1c(ncn2)NCC(F)CO 49b6a6123409dc9fb8dfc37fdb86bf03 [1,1,0,0,0,0|2,0,0]=4 902 B17R2.57658 Cc1ccn2c1c(ncn2)NCC(O)CO 16cdd7344f60238d6415aeca81cd1282 [1,1,0,0,0,0|2,0,0]=4 903 B17R2.57658 Cc1ccn2c1c(ncn2)NC[C@@H](F)CO 905daf19fd3e983fad6f3e958a752e55 [1,1,0,0,0,0|2,0,0]=4 904 B17R2.57658 Cc1ccn2c1c(ncn2)NC[C@@H](O)CO 8ac9309e40a151e2ba5568987d7adc5a [1,1,0,0,0,0|2,0,0]=4 905 B17R2.57658 Cc1ccn2c1c(ncn2)NC[C@H](C)CO 2c63c706e21c0186b150f852d5b80509 [1,1,0,0,0,0|2,0,0]=4 906 B17R2.57658 Cc1ccn2c1c(ncn2)NC[C@H](F)CO 10b2a0fcdebfa8e2a5db38bfb525ed23 [1,1,0,0,0,0|2,0,0]=4 907 B17R2.57658 Cc1ccn2c1c(ncn2)NC[C@H](O)CO 3f243d1033b829e30625f0fdbadcd8ee [1,1,0,0,0,0|2,0,0]=4 908 B17R2.57658 Cc1coc2c1c(ncn2)NCC(=O)CO fd61efe69086b8ac089efbe9ece65833 [1,1,0,0,0,0|1,0,1]=4 909 B17R2.57658 Cc1coc2c1c(ncn2)NCC(C)CO 0e71eee010af72bf20f17a75ba24e145 [1,1,0,0,0,0|1,0,0]=3 910 B17R2.57658 Cc1coc2c1c(ncn2)NCC(O)CF fcdfae70f68c343720e5b37fe06c8d6b [1,1,0,0,0,0|2,0,0]=4 911 B17R2.57658 Cc1coc2c1c(ncn2)NCC(O)CO a64dca9f2525a50f5ee04129f829bf43 [1,1,0,0,0,0|1,0,0]=3 912 B17R2.57658 Cc1coc2c1c(ncn2)NC[C@@H](C)CO ef6566d582b6233eae58fa2586d42891 [1,1,0,0,0,0|1,0,0]=3 913 B17R2.57658 Cc1coc2c1c(ncn2)NC[C@@H](O)CO c675e2e36345a68a12bedeba6594f2eb [1,1,0,0,0,0|1,0,0]=3 914 B17R2.57658 Cc1coc2c1c(ncn2)NC[C@H](C)CO 47cfd5a4e3e59ed1eb050db522d9d37a [1,1,0,0,0,0|1,0,0]=3 915 B17R2.57658 Cc1coc2c1c(ncn2)NC[C@H](O)CO 93759215bc115dc9acd28f82f5f82fa1 [1,1,0,0,0,0|1,0,0]=3 916 B17R2.57658 Cc1csc2c1c(ncn2)NCC(F)CO cac748492f9cb44013c008317c77678f [1,1,0,0,0,0|1,0,0]=3 917 B17R2.57658 Cc1csc2c1c(ncn2)NC[C@@H](F)CO 567b92aee0e7ff59d2ad04921bd02f48 [1,1,0,0,0,0|1,0,0]=3 918 B17R2.57658 Cc1csc2c1c(ncn2)NC[C@H](F)CO abe66bf0ab5d6848f1c0101c3132218d [1,1,0,0,0,0|1,0,0]=3 919 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NCC(C)CO bde8983eb3c4becd64620c5dac341242 [1,1,0,0,0,0|2,0,0]=4 920 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NCC(F)CO dab71dfa9d91e6531d9b5476e1fc9c83 [1,1,0,0,0,0|2,0,0]=4 921 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NCC(O)CO d66433c50098b2cef26773a60108a522 [1,1,0,0,0,0|2,0,0]=4 922 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NC[C@@H](C)CO ce3e40208a0d99e1654dff43b6b7a29e [1,1,0,0,0,0|2,0,0]=4 923 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NC[C@@H](F)CO 0cd7b70dbd5491eeabbe39e667af9abe [1,1,0,0,0,0|2,0,0]=4 924 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NC[C@@H](O)CO c1ae3ed755fc7ec4cd48f03bf7b7b083 [1,1,0,0,0,0|2,0,0]=4 925 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NC[C@H](C)CO 734213f21588601e3e0ae9bb3473df4b [1,1,0,0,0,0|2,0,0]=4 926 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NC[C@H](F)CO e5192009fbbd0e6d6502d30ea9ca5f73 [1,1,0,0,0,0|2,0,0]=4 927 B17R2.57658 Cc1n[nH]c2c1c(ccn2)NC[C@H](O)CO 9fbc5387a44892130a7b52ee412ecf4f [1,1,0,0,0,0|2,0,0]=4 928 B17R2.57658 Cc1n[nH]c2c1c(ncc2)NCC(F)CO 7bc0f25300756597438046e6d04f266e [1,1,0,0,0,0|2,0,0]=4 929 B17R2.57658 Cc1n[nH]c2c1c(ncc2)NC[C@@H](F)CO 42b1235f15086543ecde328afb994c20 [1,1,0,0,0,0|2,0,0]=4 930 B17R2.57658 Cc1n[nH]c2c1c(ncc2)NC[C@H](F)CO b96bfa4ed3cfce0d96910698df78699f [1,1,0,0,0,0|2,0,0]=4 931 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NCC(=O)CO eb76ad5ad0492a0908af56fc03b09e81 [1,1,0,0,0,0|1,0,1]=4 932 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NCC(C)CO 2f9e2daf88aef9663fcc0be43aed353a [1,1,0,0,0,0|1,0,0]=3 933 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NCC(F)CO cc6ea6e7fd44ed22cad82364fe53941f [1,1,0,0,0,0|1,0,0]=3 934 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NCC(O)CF fcd4e0126b8813019c32e40d0fed884c [1,1,0,0,0,0|2,0,0]=4 935 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NCC(O)CO f9f7e0108607b286f7a6789c52592b3f [1,1,0,0,0,0|1,0,0]=3 936 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NC[C@@H](C)CO ea71dad62d0e5cb043089b91922538b6 [1,1,0,0,0,0|1,0,0]=3 937 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NC[C@@H](F)CO 32cb99ecfdaf62b774b5da7f12d7274e [1,1,0,0,0,0|1,0,0]=3 938 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NC[C@@H](O)CO d9fc3dc8d264836d606f74e70af23e3d [1,1,0,0,0,0|1,0,0]=3 939 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NC[C@H](C)CO 3f5167ab52024398ac5bf36b50a1951f [1,1,0,0,0,0|1,0,0]=3 940 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NC[C@H](F)CO d1d2987ce051b5c6c69e412669345bc4 [1,1,0,0,0,0|1,0,0]=3 941 B17R2.57658 Cc1n[nH]c2c1c(ncn2)NC[C@H](O)CO 698ba7619af16ddfc4a6cca428a7dbdb [1,1,0,0,0,0|1,0,0]=3 942 B17R2.57658 Cc1n[nH]c2c1c(ncn2)OCC(O)CO a0f709e05e74feba46580a1cefb12ab0 [1,1,0,0,0,0|2,0,0]=4 943 B17R2.57658 Cc1n[nH]c2c1c(ncn2)OC[C@@H](O)CO f6571c27028bc068d52f64d4deb5c788 [1,1,0,0,0,0|2,0,0]=4 944 B17R2.57658 Cc1n[nH]c2c1c(ncn2)OC[C@H](O)CO 463ea19b5e590b0926701a96d1b78569 [1,1,0,0,0,0|2,0,0]=4 945 B17R2.57658 Cc1noc2c1c(ncn2)NCC(C)CO 853bb00f968de3330f9f309bbe5d6d47 [1,1,0,0,0,0|2,0,0]=4 946 B17R2.57658 Cc1noc2c1c(ncn2)NCC(O)CO 03f93b1fef8638142ac8c90bebdb5763 [1,1,0,0,0,0|2,0,0]=4 947 B17R2.57658 Cc1noc2c1c(ncn2)NC[C@@H](C)CO 0951f80232c888603dc3cdac5a89a70a [1,1,0,0,0,0|2,0,0]=4 948 B17R2.57658 Cc1noc2c1c(ncn2)NC[C@@H](O)CO 75f1fda1cca61637b434a8aef6a62226 [1,1,0,0,0,0|2,0,0]=4 949 B17R2.57658 Cc1noc2c1c(ncn2)NC[C@H](C)CO b491d6b3e5ec4aa5ce226f2314b921c5 [1,1,0,0,0,0|2,0,0]=4 950 B17R2.57658 Cc1noc2c1c(ncn2)NC[C@H](O)CO c03828614e08937aef61cc2e83eaee54 [1,1,0,0,0,0|2,0,0]=4 951 B17R2.57658 Cn1ccc2c1c(ncn2)NCC(F)CO 4fc70b26d4fff6f6e42a913c21b6833c [1,1,0,0,0,0|2,0,0]=4 952 B17R2.57658 Cn1ccc2c1c(ncn2)NC[C@@H](F)CO 00f98bf20a78c1b0bbdb0078d548f57c [1,1,0,0,0,0|2,0,0]=4 953 B17R2.57658 Cn1ccc2c1c(ncn2)NC[C@H](F)CO 0ef605a7f98dca5f11ebebf255d4fe8d [1,1,0,0,0,0|2,0,0]=4 954 B17R2.57658 Cn1cnc2c1c(ncn2)NCC(F)CO c3d18df90db009969cc9b76ad3ea79a3 [1,1,0,0,0,0|1,0,1]=4 955 B17R2.57658 Cn1cnc2c1c(ncn2)NCC(O)CO dae1ddbb0d2659e4a275e333724ebd3b [1,1,0,0,0,0|1,0,1]=4 956 B17R2.57658 Cn1cnc2c1c(ncn2)NC[C@@H](F)CO 97fbd99418377f4de98c2fed9227f993 [1,1,0,0,0,0|1,0,1]=4 957 B17R2.57658 Cn1cnc2c1c(ncn2)NC[C@@H](O)CO 56469dd39956ba4f5ef2928b5829a50b [1,1,0,0,0,0|1,0,1]=4 958 B17R2.57658 Cn1cnc2c1c(ncn2)NC[C@H](F)CO 3258d1a692c748e79d135366ae030a5a [1,1,0,0,0,0|1,0,1]=4 959 B17R2.57658 Cn1cnc2c1c(ncn2)NC[C@H](O)CO bf63b026027d1d229f72abdb1bd8687e [1,1,0,0,0,0|1,0,1]=4 960 B17R2.57658 O=C(CO)CNc1ncnc2c1c(c[nH]2)Br 1ae8aeff6ee1371f702a8cbead216b04 [1,1,0,0,0,0|1,0,1]=4 961 B17R2.57658 O=C(CO)CNc1ncnc2c1c(c[nH]2)Cl deb5fb9536bf9a6fe9d52dfa1f6068a4 [1,1,0,0,0,0|1,0,1]=4 962 B17R2.57658 O=C(CO)CNc1ncnc2c1c(c[nH]2)F b7d948087033616b3d67e75787da47bb [1,1,0,0,0,0|1,0,1]=4 963 B17R2.57658 O=C(CO)CNc1ncnc2c1c(c[nH]2)I 9b771fb7a2ef9e26fbc1fa1b503d3c21 [1,1,0,0,0,0|1,0,1]=4 964 B17R2.57658 OC(CF)CNc1ncnc2c1c(c[nH]2)Br 8d2bdbaebc7e3440f8634c98f859d4ad [1,1,0,0,0,0|2,0,0]=4 965 B17R2.57658 OC(CF)CNc1ncnc2c1c(c[nH]2)Cl 302e52bcf25066bc725cf8b4192a608e [1,1,0,0,0,0|2,0,0]=4 966 B17R2.57658 OC(CF)CNc1ncnc2c1c(c[nH]2)F aee5049033479bb78e70cbcccac5f683 [1,1,0,0,0,0|2,0,0]=4 967 B17R2.57658 OC(CF)CNc1ncnc2c1c(c[nH]2)I 58d310394b0b3d6841e69e39a879a60d [1,1,0,0,0,0|2,0,0]=4 968 B17R2.57658 OCC(F)CNc1ccnc2c1c(c[nH]2)F 4b8582ebae49adc8feaeee66a0f77d3f [1,1,0,0,0,0|2,0,0]=4 969 B17R2.57658 OCC(F)CNc1ncnc2c1c(c[nH]2)F 20d3900839ab594f0c9ebf518f0d48af [1,1,0,0,0,0|1,0,0]=3 970 B17R2.57658 OCC(O)CNc1ccnc2c1c(c[nH]2)Br 4e1af415105c04eb00b956b9c94ee1b4 [1,1,0,0,0,0|2,0,0]=4 971 B17R2.57658 OCC(O)CNc1nccc2c1c(c[nH]2)Br e982b19c7d51872a8b1f225aa615301b [1,1,0,0,0,0|2,0,0]=4 972 B17R2.57658 OCC(O)CNc1ncnc2c1c(c[nH]2)Br 6901e015ee7ddcef57ec154a9ebdc2fb [1,1,0,0,0,0|1,0,0]=3 973 B17R2.57658 OCC(O)CNc1ncnc2c1c(c[nH]2)Cl c7613af5b83bcbdccfc96f08bcdd8818 [1,1,0,0,0,0|1,0,0]=3 974 B17R2.57658 OCC(O)CNc1ncnc2c1c(c[nH]2)F ae87208b64b26392d6e2e382c39e039b [1,1,0,0,0,0|1,0,0]=3 975 B17R2.57658 OCC(O)CNc1ncnc2c1c(c[nH]2)I 4cf0dcc4f63a8d3ab2d1df480b3b170c [1,1,0,0,0,0|1,0,0]=3 976 B17R2.57658 OCC(O)CNc1ncnc2c1c(cs2)Br 08a0e56cdb6f7b1be90074a70d50f711 [1,1,0,0,0,0|2,0,0]=4 977 B17R2.57658 OCC(O)CNc1ncnc2c1c(n[nH]2)Br bfc018ee16da2fdf72d858f40e2fe54e [1,1,0,0,0,0|2,0,0]=4 978 B17R2.57658 OCC(O)CNc1ncnc2c1c(n[nH]2)Cl 41e5b532c6a37772a743971e9029fcb8 [1,1,0,0,0,0|2,0,0]=4 979 B17R2.57658 OCC(O)CNc1ncnc2c1c(n[nH]2)I e1e6eea3194d3ec3e5285d69f956af6e [1,1,0,0,0,0|2,0,0]=4 980 B17R2.57658 OCC(O)COc1ncnc2c1c(c[nH]2)Cl 06755a8e93099ea9824d29d0172378cd [1,1,0,0,0,0|2,0,0]=4 981 B17R2.57658 OC[C@@H](F)CNc1ccnc2c1c(c[nH]2)F 2607ae08488aacc4cf1975280dd36fcd [1,1,0,0,0,0|2,0,0]=4 982 B17R2.57658 OC[C@@H](F)CNc1ncnc2c1c(c[nH]2)F e9f4a4e98c5828349875f9ed178762dc [1,1,0,0,0,0|1,0,0]=3 983 B17R2.57658 OC[C@@H](O)CNc1ccnc2c1c(c[nH]2)Br 3e1ee3b5209182e9fd7519e709f1d91d [1,1,0,0,0,0|2,0,0]=4 984 B17R2.57658 OC[C@@H](O)CNc1nccc2c1c(c[nH]2)Br 7f874eaaf2a0a6d0ce69a02fc66193d4 [1,1,0,0,0,0|2,0,0]=4 985 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(c[nH]2)Br 9a94209f7d3f1c62ac0cad9174153a49 [1,1,0,0,0,0|1,0,0]=3 986 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(c[nH]2)Cl bd888bc1ef373f344c16a6f88788bedf [1,1,0,0,0,0|1,0,0]=3 987 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(c[nH]2)F f9eda4fa9fbd84f03719f38690f45ad2 [1,1,0,0,0,0|1,0,0]=3 988 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(c[nH]2)I d52f51c50bde48ab646f66a1f8bf93c4 [1,1,0,0,0,0|1,0,0]=3 989 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(cs2)Br 9370e02ad6925d986e6afcfc56757691 [1,1,0,0,0,0|2,0,0]=4 990 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(n[nH]2)Br a5dc216f7e084048b60d1355e1397eef [1,1,0,0,0,0|2,0,0]=4 991 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(n[nH]2)Cl 3e7ec26f739d721cf19ae6390aab5c0f [1,1,0,0,0,0|2,0,0]=4 992 B17R2.57658 OC[C@@H](O)CNc1ncnc2c1c(n[nH]2)I e41028fb78276b317509afa279df70cd [1,1,0,0,0,0|2,0,0]=4 993 B17R2.57658 OC[C@@H](O)COc1ncnc2c1c(c[nH]2)Cl a78c359c654552dac6add767b25379c6 [1,1,0,0,0,0|2,0,0]=4 994 B17R2.57658 OC[C@H](F)CNc1ccnc2c1c(c[nH]2)F 0e49ccee838a77aef3e7c10721adc554 [1,1,0,0,0,0|2,0,0]=4 995 B17R2.57658 OC[C@H](F)CNc1ncnc2c1c(c[nH]2)F 007d30a0800026ca5f95ac4362ab09d1 [1,1,0,0,0,0|1,0,0]=3 996 B17R2.57658 OC[C@H](O)CNc1ccnc2c1c(c[nH]2)Br b90e5b5e69f0b1ad68b198dc7587057d [1,1,0,0,0,0|2,0,0]=4 997 B17R2.57658 OC[C@H](O)CNc1nccc2c1c(c[nH]2)Br e4447bfaf9b00af3131b55deadf04c81 [1,1,0,0,0,0|2,0,0]=4 998 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(c[nH]2)Br 49151f66ef4b0493271df09e16982ed4 [1,1,0,0,0,0|1,0,0]=3 999 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(c[nH]2)Cl f8af7defcc3737bb39fcac9337c29685 [1,1,0,0,0,0|1,0,0]=3 1000 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(c[nH]2)F bfc0b3ed8a6a6b0b4ce38df21be771b4 [1,1,0,0,0,0|1,0,0]=3 1001 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(c[nH]2)I 26ebd93753c1d57ab77fec9d2dcabf0b [1,1,0,0,0,0|1,0,0]=3 1002 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(cs2)Br 10a26fa5677d473bb9de5a37178088a8 [1,1,0,0,0,0|2,0,0]=4 1003 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(n[nH]2)Br 88775a8e0b42adc124030bfc56e2c03f [1,1,0,0,0,0|2,0,0]=4 1004 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(n[nH]2)Cl 7be9b342697ca9cc2669c4047f3e9807 [1,1,0,0,0,0|2,0,0]=4 1005 B17R2.57658 OC[C@H](O)CNc1ncnc2c1c(n[nH]2)I 227b8445fae691d4e2b4a67689f7d302 [1,1,0,0,0,0|2,0,0]=4 1006 B17R2.57658 OC[C@H](O)COc1ncnc2c1c(c[nH]2)Cl 66ed85ecac9ed33ff03cb1dd9d3254cb [1,1,0,0,0,0|2,0,0]=4 1007 B17R2.74647 C=CCCN(C)c1ncnc2c1c(c[nH]2)C 99196236dc90291459310ff4265f3cf7 [1,1,0,0,0,0|1,0,1]=4 1008 B17R2.74647 CCCCN(C)c1ccnc2c1c(c[nH]2)C 203e0cff3a040d1773ff56aa0237038b [1,1,0,0,0,0|2,0,0]=4 1009 B17R2.74647 CN(CCCO)c1ccnc2c1c(c[nH]2)F 6ac2c41002c92d6708f309d6b8c2e241 [1,1,0,0,0,0|2,0,0]=4 1010 B17R2.74647 CN(CCCO)c1ncnc2c1n(cc2)C e19c842556762bfc30935166411dbdb6 [1,1,0,0,0,0|2,0,0]=4 1011 B17R2.74647 COCCN(C)c1ncnc2c1c(c[nH]2)C b0c5ce524a3c80f6ad9be6bf5a70021e [1,1,0,0,0,0|2,0,0]=4 1012 B17R2.74647 Cc1c[nH]c2c1c(ccc2)N(C)CCCO f57afbd74c338585a8d26ec4d03f4b43 [1,1,0,0,0,0|2,0,0]=4 1013 B17R2.74647 Cc1c[nH]c2c1c(ccn2)N(C)CCCO a988163773949287df56ac0ebc3a7b58 [1,1,0,0,0,0|1,0,0]=3 1014 B17R2.74647 Cc1c[nH]c2c1c(ncn2)N(C)CCON 7301c6b4a640db245ca9d31862181441 [1,1,0,0,0,0|2,0,0]=4 1015 B17R2.74647 Cc1ccn2c1c(ncn2)N(C)CCCO a52a6b7c10e5062f4d571a8238b7092a [1,1,0,0,0,0|2,0,0]=4 1016 B17R2.86763 CCCCNc1ncnc2c1c(c(o2)C)C 78591004b5d7a4782f1117eed5fc1832 [1,1,0,0,0,0|2,0,0]=4 1017 B17R2.86763 CCCCNc1ncnc2c1c(c(s2)C)C 24d8ba874745ee5edee99178395cde62 [1,1,0,0,0,0|2,0,0]=4 1018 B17R2.86763 Cc1[nH]c2nccc(c2c1C)NCCCCl 60c106c3fd68336133f2cd55336f86ff [1,1,0,0,0,0|2,0,0]=4 1019 B17R2.86763 Cc1oc2ncnc(c2c1C)NCCCF 6be7e645e1aa9f52696659c5f163b19f [1,1,0,0,0,0|2,0,0]=4 1020 B17R2.86763 Cc1oc2ncnc(c2c1C)NCCCO 28f15f522f54920600edf9a07876c1cd [1,1,0,0,0,0|1,0,0]=3 1021 B17R2.86763 Cc1oc2ncnc(c2c1C)NCCCS c4a9fd18fbd15e6704b9f4a85e238726 [1,1,0,0,0,0|1,1,0]=4 1022 B17R2.86763 Cc1sc2ncnc(c2c1C)NCCCF f2a6e6629697fb4a91714cdf8962b82b [1,1,0,0,0,0|2,0,0]=4 1023 B17R2.86763 Cc1sc2ncnc(c2c1C)NCCCO 3d3f5a52b0670a115f5a3015abfe85cf [1,1,0,0,0,0|1,0,0]=3 1024 B17R2.86763 Cc1sc2ncnc(c2c1C)NCCCS df5c050a77f04d09ad4987e28ee8be89 [1,1,0,0,0,0|1,1,0]=4 1025 B17R2.86763 Cn1c(=O)[nH]c2c1c(ncn2)NCCCCl d636d2df3926700591e3816c64f38f92 [1,1,0,0,0,0|2,0,0]=4 1026 B17R2.86763 Cn1c(=O)[nH]c2c1c(ncn2)NCCCO c947db43fc56fc2f36a3308a3004b877 [1,1,0,0,0,0|1,0,0]=3 1027 B17R2.86764 CCCCNc1ncnc2c1c(cn2C)Br d53a751613ad662acc40a6db60f5b806 [1,1,0,0,0,0|2,0,0]=4 1028 B17R2.86764 CCCCNc1ncnc2c1c(cn2C)I 38a889a485af2604aeb7b94adc082b3c [1,1,0,0,0,0|2,0,0]=4 1029 B17R2.86764 Cc1nn(c2c1c(ncn2)NCCCCl)C f80193436d98af94bac8c34993a5004b [1,1,0,0,0,0|2,0,0]=4 1030 B17R2.86764 Cn1cc(c2c1ncnc2NCCCF)Br 321e250360cfab946c9dacf4236f937b [1,1,0,0,0,0|2,0,0]=4 1031 B17R2.86764 Cn1cc(c2c1ncnc2NCCCF)I e5763187bc0853cb7093cc2eecbe8b2c [1,1,0,0,0,0|2,0,0]=4 1032 B17R2.86764 Cn1cc(c2c1ncnc2NCCCO)Br 8839611958e004c629e494f9d2c81c08 [1,1,0,0,0,0|1,0,0]=3 1033 B17R2.86764 Cn1cc(c2c1ncnc2NCCCO)I bef00d922aeadf287c8f9d98acfeb91b [1,1,0,0,0,0|1,0,0]=3 1034 B17R2.86764 Cn1cc(c2c1ncnc2NCCCS)Br 541e225c4f56a61486a8b50b1f787df0 [1,1,0,0,0,0|1,1,0]=4 1035 B17R2.86764 Cn1cc(c2c1ncnc2NCCCS)I 24b8eb1f085458c1f3c2e5de938ad3d9 [1,1,0,0,0,0|1,1,0]=4 1036 B17R2.86764 Cn1nc(c2c1ncnc2NCCCO)I 5af22a22806b5f0f35de536785a5c395 [1,1,0,0,0,0|2,0,0]=4 1037 B17R2.103670 C=CCCNc1nc(nc2c1c(c[nH]2)C)C a079b3c174f3a4a64d8d1cea0f36fb2d [1,1,0,0,0,0|1,0,1]=4 1038 B17R2.103670 COCCNc1nc(nc2c1c(c[nH]2)C)C 811ea47e899339503fc171a4e7fe6a17 [1,1,0,0,0,0|2,0,0]=4 1039 B17R2.103670 Cc1nc(c2c(c[nH]c2n1)C)NCCCCl 02277c34ae7587c7db995b71a4809249 [1,1,0,0,0,0|1,0,0]=3 1040 B17R2.103670 Cc1nc(c2c(c[nH]c2n1)C)NCCCO 38423f732364446cca1c23c931e9857f [1,1,0,0,0,0|0,0,0]=2 1041 B17R2.103670 Cc1nc(c2c(c[nH]c2n1)C)NCCON a7d2cf34a9b6ae395241f459cdd6ce78 [1,1,0,0,0,0|2,0,0]=4 1042 B17R2.103670 Cn1ccc2c1c(nc(n2)Cl)NCCCO bde10482fa0a78146cff37bbb4c52a5f [1,1,0,0,0,0|2,0,0]=4 1043 B17R2.103670 OCCCNc1nc(nc2c1c(n[nH]2)I)Cl 8d3849081750a44686b1fe611777f946 [1,1,0,0,0,0|2,0,0]=4 1044 B17R2.184950 C=C(C)CCNc1ncnc2c1c(c[nH]2)C 19b86ac56935d475790e3efb0a303f3c [1,1,0,0,0,0|1,0,1]=4 1045 B17R2.184950 CC(=O)CCNc1ncnc2c1c(c[nH]2)C 9f79a91f4a1a7b0321817b261b562ae0 [1,1,0,0,0,0|0,0,2]=4 1046 B17R2.184950 CC(C)CCNc1ncnc2c1c(c[nH]2)Br 33c2708d281795ba18fc49c232fdce06 [1,1,0,0,0,0|2,0,0]=4 1047 B17R2.184950 CC(C)CCNc1ncnc2c1c(c[nH]2)Cl 51f5694597a2b7a8d074ed7f170f210f [1,1,0,0,0,0|2,0,0]=4 1048 B17R2.184950 CC(C)CCNc1ncnc2c1c(c[nH]2)F 1cfb8317bad8a69cc277a79e40b3e236 [1,1,0,0,0,0|2,0,0]=4 1049 B17R2.184950 CC(C)CCNc1ncnc2c1c(c[nH]2)I c4cb4e7502c5615be1ef6b9ccd6a7ab5 [1,1,0,0,0,0|2,0,0]=4 1050 B17R2.184950 CC(O)CCNc1ccnc2c1c(c[nH]2)Br bfb5a4fa2147d02f1941be50805d3815 [1,1,0,0,0,0|2,0,0]=4 1051 B17R2.184950 CC(O)CCNc1ccnc2c1c(c[nH]2)F dbf4a340eb06a8b1721934bab029fb99 [1,1,0,0,0,0|2,0,0]=4 1052 B17R2.184950 CC(O)CCNc1nccc2c1c(c[nH]2)Br 67d635b9cb1da53aaebf76dff588128d [1,1,0,0,0,0|2,0,0]=4 1053 B17R2.184950 CC(O)CCNc1ncnc2c1c(c[nH]2)Br 994e7ff0516b56ef44d5b1b211092c5e [1,1,0,0,0,0|1,0,0]=3 1054 B17R2.184950 CC(O)CCNc1ncnc2c1c(c[nH]2)Cl 2c06e87a6a0f15c8cfe9b24c28935f38 [1,1,0,0,0,0|1,0,0]=3 1055 B17R2.184950 CC(O)CCNc1ncnc2c1c(c[nH]2)F 1fc5baf6c00d1aa184fc9ac53601f09d [1,1,0,0,0,0|1,0,0]=3 1056 B17R2.184950 CC(O)CCNc1ncnc2c1c(c[nH]2)I b100dbcbdb14ab2f660050aee570c5ae [1,1,0,0,0,0|1,0,0]=3 1057 B17R2.184950 CC(O)CCNc1ncnc2c1c(cs2)Br e74eb38b00d3d9648788b9e76274d7f8 [1,1,0,0,0,0|2,0,0]=4 1058 B17R2.184950 CC(O)CCNc1ncnc2c1c(n[nH]2)Br 5eb8bb854731b68a23996e120408339a [1,1,0,0,0,0|2,0,0]=4 1059 B17R2.184950 CC(O)CCNc1ncnc2c1c(n[nH]2)Cl 9ba018dcad2dfaea94ee806e62438215 [1,1,0,0,0,0|2,0,0]=4 1060 B17R2.184950 CC(O)CCNc1ncnc2c1c(n[nH]2)I 799277f40e6645e8424510244709f8f7 [1,1,0,0,0,0|2,0,0]=4 1061 B17R2.184950 CC(O)CCNc1ncnc2c1n(cc2)C 1bb0dbcee922114c52dd4eec4fc195a1 [1,1,0,0,0,0|2,0,0]=4 1062 B17R2.184950 CC(O)CCNc1ncnc2c1n(cn2)C 61ce2ee513216a44df41c45464065029 [1,1,0,0,0,0|1,0,1]=4 1063 B17R2.184950 C[C@@H](O)CCNc1ccnc2c1c(c[nH]2)F 9de3b65bb2fba73a4adb028ca718aa54 [1,1,0,0,0,0|2,0,0]=4 1064 B17R2.184950 C[C@@H](O)CCNc1ncnc2c1n(cc2)C c7ac4c353212a0e7bb75ec9e493bd263 [1,1,0,0,0,0|2,0,0]=4 1065 B17R2.184950 C[C@H](O)CCNc1ccnc2c1c(c[nH]2)F 2ebc1dbb318bea1d41cd6c028c82f950 [1,1,0,0,0,0|2,0,0]=4 1066 B17R2.184950 C[C@H](O)CCNc1ncnc2c1n(cc2)C deadd6d4facdc80a7c420bc5e601bc62 [1,1,0,0,0,0|2,0,0]=4 1067 B17R2.184950 Cc1c[nH]c2c1c(ccc2)NCCC(C)O 2408a36cd8658c9c397f44663dcccfec [1,1,0,0,0,0|2,0,0]=4 1068 B17R2.184950 Cc1c[nH]c2c1c(ccn2)NCCC(=O)O e447b2e92376ff01868fe7e75ff3651c [1,1,0,0,0,0|1,0,1]=4 1069 B17R2.184950 Cc1c[nH]c2c1c(ccn2)NCCC(C)C dad327978944b8e95fd8ea9d6e11cb61 [1,1,0,0,0,0|2,0,0]=4 1070 B17R2.184950 Cc1c[nH]c2c1c(ccn2)NCCC(C)O f811a3a2de4f07fe3eba544922b1d979 [1,1,0,0,0,0|1,0,0]=3 1071 B17R2.184950 Cc1c[nH]c2c1c(ccn2)NCC[C@@H](C)O db0b0c47b383c404c9d73b9a27cbe236 [1,1,0,0,0,0|1,0,0]=3 1072 B17R2.184950 Cc1c[nH]c2c1c(ccn2)NCC[C@H](C)O 6237ffef4ee4d76fbc4f627318d2f235 [1,1,0,0,0,0|1,0,0]=3 1073 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCC(=O)N 097d16c8f1eba9a17f0458e7d98d61da [1,1,0,0,0,0|0,0,2]=4 1074 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCC(=O)O fd44c7a4c1e1489826e27f4b4dff3875 [1,1,0,0,0,0|0,0,1]=3 1075 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCC(=S)N 8cf2062cd427b9bac0cefa10ee47c121 [1,1,0,0,0,0|0,1,1]=4 1076 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCC(C)C 331251d975a1b2a5aa27e4e3a4f3a0ab [1,1,0,0,0,0|1,0,0]=3 1077 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCC(C)O bff77b63925ddf7875a2adfc8d1d3198 [1,1,0,0,0,0|0,0,0]=2 1078 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCC(F)F 6608528121bbbae5fd5a27c3e8f85701 [1,1,0,0,0,0|1,0,0]=3 1079 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCN(C)C 93f7133112a6e5a7bdb2376515926b2b [1,1,0,0,0,0|2,0,0]=4 1080 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCS(=O)C 759340d7261ef2e202b224b75488ab5c [1,1,0,0,0,0|1,0,1]=4 1081 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCCS(=O)O 10182205e5b29557dffee858ca93917a [1,1,0,0,0,0|1,0,0]=3 1082 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCC[C@@H](C)O 359e954617f6c9f617029a552cf5a0a6 [1,1,0,0,0,0|0,0,0]=2 1083 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCC[C@H](C)O 6c9aec4c93a97d7092e6dfd0810070de [1,1,0,0,0,0|0,0,0]=2 1084 B17R2.184950 Cc1c[nH]c2c1c(ncn2)NCOC(C)C 257000299a7b81ddc973c8394a241b41 [1,1,0,0,0,0|2,0,0]=4 1085 B17R2.184950 Cc1ccn2c1c(ncn2)NCCC(C)O dc034bd6d61208e4b37c83a22ba60555 [1,1,0,0,0,0|2,0,0]=4 1086 B17R2.184950 Cc1ccn2c1c(ncn2)NCC[C@@H](C)O 4caf86a8720704546e4121b9f240c90e [1,1,0,0,0,0|2,0,0]=4 1087 B17R2.184950 Cc1ccn2c1c(ncn2)NCC[C@H](C)O 6d197d89fd4d42b39ce414868583c327 [1,1,0,0,0,0|2,0,0]=4 1088 B17R2.184950 Cc1coc2c1c(ncn2)NCCC(=O)O 5bdd521c58af19f64870bfa40f118a71 [1,1,0,0,0,0|1,0,1]=4 1089 B17R2.184950 Cc1coc2c1c(ncn2)NCCC(C)C a0063b745b3924654a075457d7c20d1f [1,1,0,0,0,0|2,0,0]=4 1090 B17R2.184950 Cc1coc2c1c(ncn2)NCCC(C)O 82a2d513761efaa67f78ec3988f25b1e [1,1,0,0,0,0|1,0,0]=3 1091 B17R2.184950 Cc1n[nH]c2c1c(ccn2)NCCC(C)O 220e77335bd99799ae2f5a69dd636cd3 [1,1,0,0,0,0|2,0,0]=4 1092 B17R2.184950 Cc1n[nH]c2c1c(ncn2)NCCC(=O)O bac04a8159befa628460c693cdf525b9 [1,1,0,0,0,0|1,0,1]=4 1093 B17R2.184950 Cc1n[nH]c2c1c(ncn2)NCCC(C)C 50a943a2901983464311ff11e05f6cd3 [1,1,0,0,0,0|2,0,0]=4 1094 B17R2.184950 Cc1n[nH]c2c1c(ncn2)NCCC(C)O 15b8e0b9f9ea76a9eefb713a8e837821 [1,1,0,0,0,0|1,0,0]=3 1095 B17R2.184950 Cc1noc2c1c(ncn2)NCCC(C)O 1217e80ba3030b7eb505847d2fc7a050 [1,1,0,0,0,0|2,0,0]=4 1096 B17R2.184950 O=C(O)CCNc1ncnc2c1c(c[nH]2)Cl 21e8f15a8a3ab1a66c40950e421a5084 [1,1,0,0,0,0|1,0,1]=4 1097 B17R2.184950 O=C(O)CCNc1ncnc2c1c(c[nH]2)F 5665ea41a14284e9c8edccdd6f968537 [1,1,0,0,0,0|1,0,1]=4 1098 B17R2.184950 O=C(O)CCNc1ncnc2c1c(c[nH]2)I 50051b184ea7fb483e101d3ebd121984 [1,1,0,0,0,0|1,0,1]=4 1099 B17R2.54545 CC(=O)c1c[nH]c2c1c(ccn2)NCCO 040f3d73224f3495a5c54874d4783b1f [1,1,0,0,0,0|2,0,0]=4 1100 B17R2.54545 CC(=O)c1c[nH]c2c1c(ncn2)NCCBr bd243bd0db310ec1e27c7586f46da1dc [1,1,0,0,0,0|2,0,0]=4 1101 B17R2.54545 CC(=O)c1c[nH]c2c1c(ncn2)NCCF 05ecdb87ce6ee063945f4a08eab8aeb8 [1,1,0,0,0,0|2,0,0]=4 1102 B17R2.54545 CC(=O)c1c[nH]c2c1c(ncn2)NCCI d6b9b3bde93f63bd23d2de1d301f6422 [1,1,0,0,0,0|2,0,0]=4 1103 B17R2.54545 CC(=O)c1c[nH]c2c1c(ncn2)NCCO 09af4e000c78f5ab2df499d5f3de237a [1,1,0,0,0,0|1,0,0]=3 1104 B17R2.54545 CC(=O)c1c[nH]c2c1c(ncn2)NCCS de83bfaa723db01bb8d5b601848385c4 [1,1,0,0,0,0|1,1,0]=4 1105 B17R2.54545 CC(C)c1n[nH]c2c1c(ncn2)NCCO 5cca9cf01742c35a3ba6d9a6c77a3fcd [1,1,0,0,0,0|2,0,0]=4 1106 B17R2.54545 CCCNc1ccnc2c1c(c[nH]2)C(=O)C 75370ef2bbf66ff91c0df5212a53822e [1,1,0,0,0,0|2,0,0]=4 1107 B17R2.54545 CCCNc1ncnc2c1c(c[nH]2)C(=O)C 906bc8b6c39081e8f1c81cc5895c9550 [1,1,0,0,0,0|1,0,0]=3 1108 B17R2.54545 CCCNc1ncnc2c1c(c[nH]2)C(=O)N faec5731c6be97ce6c20419de94f978a [1,1,0,0,0,0|2,0,0]=4 1109 B17R2.54545 CCCNc1ncnc2c1c(c[nH]2)C(=O)O a156153552a6a0e249e48478d418e503 [1,1,0,0,0,0|2,0,0]=4 1110 B17R2.54545 CCCNc1ncnc2c1c(n[nH]2)C(C)C f4bd3f842ac142bd22a1047769c9eea4 [1,1,0,0,0,0|2,0,0]=4 1111 B17R2.54545 CS(=O)c1c[nH]c2c1c(ncn2)NCCBr 207542b917cdd5a9263037557dc55b5f [1,1,0,0,0,0|1,0,1]=4 1112 B17R2.54545 CS(=O)c1c[nH]c2c1c(ncn2)NCCO ebb2d6bcaaac41626a4e797ebb159693 [1,1,0,0,0,0|0,0,1]=3 1113 B17R2.54545 CS(=O)c1c[nH]c2c1c(ncn2)NCCS 954a694f8a814dc8f2f8cef66567c30d [1,1,0,0,0,0|0,1,1]=4 1114 B17R2.54545 NC(=O)c1c[nH]c2c1c(ncn2)NCCO f8ff20469d5406c108d0977a5c813dcc [1,1,0,0,0,0|2,0,0]=4 1115 B17R2.54545 O=C(O)c1c[nH]c2c1c(ncn2)NCCO 50bca469319d0b1e3e379bd99cd9741f [1,1,0,0,0,0|2,0,0]=4 1116 B17R2.54548 CCCNc1ncnc2c1c(c([nH]2)Br)C#N 4e63195e6ff75b562abce491f6f5b9a6 [1,1,0,0,0,0|2,0,0]=4 1117 B17R2.54548 N#Cc1c([nH]c2c1c(ncn2)NCCO)Br 469922b6b680eee36df2156f779cd15e [1,1,0,0,0,0|2,0,0]=4 1118 B17R2.325128 C=CCN(C)c1ncnc2c1c(c[nH]2)SC 4c4218fe16fb6e8b4c5771728714ffcd [1,1,0,0,0,0|0,0,2]=4 1119 B17R2.325128 CCCN(C)c1ncnc2c1c(c[nH]2)CC b6cc3a8369f86f460fc1a8230ca215a8 [1,1,0,0,0,0|1,0,0]=3 1120 B17R2.325128 CCc1c[nH]c2c1c(ncn2)N(C)CCO 935a4d2f30934de03fe46ec967b743ec [1,1,0,0,0,0|1,0,0]=3 1121 B17R2.429189 C=C(Br)CNc1ncnc2c1c(c[nH]2)SC 7f9fcc2063eb6849b11daec1020613a9 [1,1,0,0,0,0|0,0,2]=4 1122 B17R2.429189 C=C(C)CNc1ncnc2c1c(c[nH]2)CC 89a945fecbf815eaf191c13c81e5b52a [1,1,0,0,0,0|1,0,1]=4 1123 B17R2.429189 C=C(C)CNc1ncnc2c1c(c[nH]2)SC 6c0f4e53e124984d6811f2a6a5ce04b7 [1,1,0,0,0,0|0,0,1]=3 1124 B17R2.429189 C=C(C)CNc1ncnc2c1c(n[nH]2)SC 82b2f6cdbd109ef4f223dbb5c9b8298a [1,1,0,0,0,0|1,0,1]=4 1125 B17R2.429189 CCc1c[nH]c2c1c(ncn2)NCC(=O)C bfdc3b2fa7e4aa636f341325cecf0797 [1,1,0,0,0,0|1,0,1]=4 1126 B17R2.429189 CCc1c[nH]c2c1c(ncn2)NCC(C)C f4535ec33466ed111841c3624baacd1c [1,1,0,0,0,0|1,0,0]=3 1127 B17R2.429189 CCc1c[nH]c2c1c(ncn2)NCC(C)O bd7ef9754f51a95af2294e31c2574af6 [1,1,0,0,0,0|1,0,0]=3 1128 B17R2.429189 CCc1c[nH]c2c1c(ncn2)NCC(F)F 461051d9fb629b1dcb05a2d61fc57827 [1,1,0,0,0,0|2,0,0]=4 1129 B17R2.429189 CCc1c[nH]c2c1c(ncn2)NC[C@@H](C)O 4f3f6f26db56a8d6a2dc2ba9f8a21117 [1,1,0,0,0,0|1,0,0]=3 1130 B17R2.429189 CCc1c[nH]c2c1c(ncn2)NC[C@H](C)O faf845ec2bdeba032171d7460bd5038b [1,1,0,0,0,0|1,0,0]=3 1131 B17R2.429189 CSc1c[nH]c2c1c(ncn2)NCC(=O)C 71359ce3e7257544cc46e8802b59a418 [1,1,0,0,0,0|0,0,1]=3 1132 B17R2.429189 CSc1c[nH]c2c1c(ncn2)NCC(=O)N b935cafc877502d68c27c501376b0507 [1,1,0,0,0,0|0,0,2]=4 1133 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NCC(=O)O 23d2cb806db250492668260eab30e618 [1,1,0,0,0,0|1,0,1]=4 1134 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NCC(C)C f6ac08b43bfe69a0f0d8a76277609052 [1,1,0,0,0,0|1,0,0]=3 1135 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NCC(C)O 3ab2ccacfb40157b495f7e4d03c1e645 [1,1,0,0,0,0|1,0,0]=3 1136 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NCC(F)F ccb30f1a4f34e7a2cfbbb9f10fb5f108 [1,1,0,0,0,0|2,0,0]=4 1137 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NCN(C)C 4b474b563e044a36211586645bb4c1a1 [1,1,0,0,0,0|2,0,0]=4 1138 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NC[C@@H](C)O cd6fd0272c2a40c54ac48313e5866d36 [1,1,0,0,0,0|1,0,0]=3 1139 B17R2.429189 CSc1n[nH]c2c1c(ncn2)NC[C@H](C)O b68fb7dd758c484c7171791354400583 [1,1,0,0,0,0|1,0,0]=3 1140 B17R2.429383 C=CC(C)Nc1ncnc2c1c(c[nH]2)SC 7bbf6501661b9b582f6aadbabd390559 [1,1,0,0,0,0|0,0,2]=4 1141 B17R2.429383 CCC(C)Nc1ncnc2c1c(n[nH]2)SC 2bccd4356af099c61082c69b97613477 [1,1,0,0,0,0|1,0,0]=3 1142 B17R2.429383 CCc1c[nH]c2c1c(ncn2)NC(C)CO 703592d4e72f1f86571297c84def4589 [1,1,0,0,0,0|1,0,0]=3 1143 B17R2.429383 CCc1c[nH]c2c1c(ncn2)N[C@@H](C)CO 4efb74130d7049ca5c018ee938e2a0c1 [1,1,0,0,0,0|1,0,0]=3 1144 B17R2.429383 CCc1c[nH]c2c1c(ncn2)N[C@H](C)CO 0594081c7ce99d598563f6d315e830e3 [1,1,0,0,0,0|1,0,0]=3 1145 B17R2.429383 CSc1n[nH]c2c1c(ncn2)NC(C)CO 65fc19ee4d83d9fb8d04ee9c23f032a0 [1,1,0,0,0,0|1,0,0]=3 1146 B17R2.429383 CSc1n[nH]c2c1c(ncn2)N[C@@H](C)CO 86cad7d19be63ac2be94a35740a530c2 [1,1,0,0,0,0|1,0,0]=3 1147 B17R2.429383 CSc1n[nH]c2c1c(ncn2)N[C@H](C)CO b27067b0977d7f81fbae36e8a0e6b7b4 [1,1,0,0,0,0|1,0,0]=3 1148 B19R2.1452608 COc1cccc2c1c(ncn2)NCCC(C)O c138e48ab996a35de8ae81e209320008 [0,1,0,0,0,1|1,1,0]=4 1149 B19R2.1452609 COc1cccc2c1c(ncn2)NCC(C)CO 326d045afcff04fc908797a897856cbe [0,1,0,0,0,1|1,1,0]=4 1150 B19R2.1452609 COc1cccc2c1c(ncn2)NCC(O)CO 7d62a2cccdbf1542df4c6836b693671d [0,1,0,0,0,1|1,1,0]=4 1151 B19R2.1452609 COc1cccc2c1c(ncn2)NC[C@@H](C)CO 4abb9566d0351523d2ed11ec7065281c [0,1,0,0,0,1|1,1,0]=4 1152 B19R2.1452609 COc1cccc2c1c(ncn2)NC[C@@H](O)CO b29595578b31f0ba5bce1002e7c93757 [0,1,0,0,0,1|1,1,0]=4 1153 B19R2.1452609 COc1cccc2c1c(ncn2)NC[C@H](C)CO 358b4e23d37da8d31ec848062025f040 [0,1,0,0,0,1|1,1,0]=4 1154 B19R2.1452609 COc1cccc2c1c(ncn2)NC[C@H](O)CO 96a6070cf959cfd22abbdc544f4a3a14 [0,1,0,0,0,1|1,1,0]=4 1155 B19R2.4427897 COCCCNc1ncnc2c1c(ccc2)OC d6e93bbd7c8bf6f8197f8b65abddd246 [0,1,0,0,0,1|1,1,0]=4 1156 B19R2.4427897 COc1cccc2c1c(ncn2)NCCCCO 2a1f321ce24ae42fd4ba4351bc26337d [0,1,0,0,0,1|1,1,0]=4 1157 B19R2.6643611 COc1cccc2c1c(ncn2)NC(C)CCO 8defa7b72383b03d9a1d3934c2b5a97e [0,1,0,0,0,1|1,1,0]=4 1158 B19R2.27143 COc1ccc2ncnc(c2c1)NCCC(C)O d02564aaad4e70a1748e33e85c86d3c7 [0,1,0,0,0,1|1,1,0]=4 1159 B19R2.27144 COc1ccc2ncnc(c2c1)NCC(C)CO 8281fc81fbf9bb1ecbb5e10a9dce60cb [0,1,0,0,0,1|1,1,0]=4 1160 B19R2.27144 COc1ccc2ncnc(c2c1)NCC(O)CO e223ff32f026b2cf3c22f5850c0c890c [0,1,0,0,0,1|1,1,0]=4 1161 B19R2.27144 COc1ccc2ncnc(c2c1)NC[C@@H](C)CO c02e4c92d3c36902d0ab5872f04829e2 [0,1,0,0,0,1|1,1,0]=4 1162 B19R2.27144 COc1ccc2ncnc(c2c1)NC[C@@H](O)CO a82b4b6004af74da37f9dbdacaf6a8c1 [0,1,0,0,0,1|1,1,0]=4 1163 B19R2.27144 COc1ccc2ncnc(c2c1)NC[C@H](C)CO 3099ebad3c3789dc5e80a5ace5749fd2 [0,1,0,0,0,1|1,1,0]=4 1164 B19R2.27144 COc1ccc2ncnc(c2c1)NC[C@H](O)CO 212005a3eb17e1baac91106b2c9774f1 [0,1,0,0,0,1|1,1,0]=4 1165 B19R2.27144 CSc1ncc2ncnc(c2n1)NCC(F)CO 834b083777ba9a920782a7472195d0c4 [0,1,0,0,0,1|2,0,0]=4 1166 B19R2.27144 CSc1ncc2ncnc(c2n1)NC[C@@H](F)CO 29c7c1bd17872e4a63c13e94cae31a80 [0,1,0,0,0,1|2,0,0]=4 1167 B19R2.27144 CSc1ncc2ncnc(c2n1)NC[C@H](F)CO 2744e3d04184fbe75c8d8b454fc32f1b [0,1,0,0,0,1|2,0,0]=4 1168 B19R2.3693220 COc1ccc2nc(nc(c2c1)NCCCO)Cl 4a3aa1fe7147f72a5cad7d57cbf3e347 [0,1,0,0,0,1|1,1,0]=4 1169 B19R2.4427901 COCCCNc1ncnc2c1cc(cc2)OC 6b59c5b051be24441e58f0c98719c57e [0,1,0,0,0,1|1,1,0]=4 1170 B19R2.4427901 COc1ccc2ncnc(c2c1)NCCCCO 73faba10e9d668f3735de71f453e3330 [0,1,0,0,0,1|1,1,0]=4 1171 B19R2.6643615 COc1ccc2ncnc(c2c1)NC(C)CCO 36c73f8a08262fa803a03da8952318a6 [0,1,0,0,0,1|1,1,0]=4 1172 B19R2.241077 CCCCNc1ncnc2c1c(c[nH]2)C(=O)OC e33dd702d64394e3b9cf451e44e3b10c [0,2,0,0,0,0|1,1,0]=4 1173 B19R2.241077 COC(=O)c1c[nH]c2c1c(ccn2)NCCCO 16fd7a328c578f6ddc38f8a9792c0f54 [0,2,0,0,0,0|1,1,0]=4 1174 B19R2.241077 COC(=O)c1c[nH]c2c1c(ncn2)NCCCCl cf5e05f5f41e188289989e037e883afb [0,2,0,0,0,0|1,1,0]=4 1175 B19R2.241077 COC(=O)c1c[nH]c2c1c(ncn2)NCCCO 3b52bd1864b55cfc7e4a738f6c086ef0 [0,2,0,0,0,0|0,1,0]=3 1176 B19R2.473887 C=CCCCNc1ncnc2c1c(c[nH]2)C(=O)C b594417ba2047470458cdb02da7a84f5 [0,2,0,0,0,0|2,0,0]=4 1177 B19R2.473887 C=CCCCNc1ncnc2c1c(c[nH]2)S(=O)C 8b2f0a926daa89de127b34462d6468bc [0,2,0,0,0,0|1,0,1]=4 1178 B19R2.473887 CC(=O)c1c[nH]c2c1c(ccn2)NCCCCO f01198cef9aa6ea4228781cf1c602b20 [0,2,0,0,0,0|2,0,0]=4 1179 B19R2.473887 CC(=O)c1c[nH]c2c1c(ncn2)NCC#CCO e100abf1254716dd2ec8b44e71fc0279 [0,2,0,0,0,0|1,0,1]=4 1180 B19R2.473887 CC(=O)c1c[nH]c2c1c(ncn2)NCCCC#N 901b06a921b4bedf49541ef1160c13b1 [0,2,0,0,0,0|2,0,0]=4 1181 B19R2.473887 CC(=O)c1c[nH]c2c1c(ncn2)NCCCCCl d48a4731f987c5a53c535c123288c110 [0,2,0,0,0,0|2,0,0]=4 1182 B19R2.473887 CC(=O)c1c[nH]c2c1c(ncn2)NCCCCO c137f035b348251691e610778ff69c51 [0,2,0,0,0,0|1,0,0]=3 1183 B19R2.473887 CC(=O)c1c[nH]c2c1c(ncn2)NCCCCS 867285fe89423d3c149a77601d8448bb [0,2,0,0,0,0|1,1,0]=4 1184 B19R2.473887 CC(C)c1n[nH]c2c1c(ncn2)NCCCCO 9040a2af2068884884b6c994f35876f9 [0,2,0,0,0,0|2,0,0]=4 1185 B19R2.473887 CCCCCNc1ncnc2c1c(c[nH]2)C(=O)C 9b7d95b731f45be51798731f33a77ed5 [0,2,0,0,0,0|2,0,0]=4 1186 B19R2.473887 CCOCCNc1ncnc2c1c(c[nH]2)C(=O)C 15a1c279ce5d5003c250e831146c1736 [0,2,0,0,0,0|2,0,0]=4 1187 B19R2.473887 CCOCCNc1ncnc2c1c(c[nH]2)S(=O)C 343182ca8864f7308a89d990ef8711dd [0,2,0,0,0,0|1,0,1]=4 1188 B19R2.473887 CCSCCNc1ncnc2c1c(c[nH]2)C(=O)C b9f36e56aebfc13e7561b2fb4cf9407b [0,2,0,0,0,0|2,0,0]=4 1189 B19R2.473887 COCCCNc1ccnc2c1c(c[nH]2)C(=O)C 30de67ed02183fca4c5418fdae3256d5 [0,2,0,0,0,0|2,0,0]=4 1190 B19R2.473887 COCCCNc1ncnc2c1c(c[nH]2)C(=O)C 510f3c8928a61d486dcf32262c711444 [0,2,0,0,0,0|1,0,0]=3 1191 B19R2.473887 COCCCNc1ncnc2c1c(c[nH]2)C(=O)N ef28ada1adedfb38b38aa599141f8d77 [0,2,0,0,0,0|2,0,0]=4 1192 B19R2.473887 COCCCNc1ncnc2c1c(c[nH]2)C(=O)O 76f6aa301454201c2ad8743f03cc3407 [0,2,0,0,0,0|2,0,0]=4 1193 B19R2.473887 COCCCNc1ncnc2c1c(n[nH]2)C(C)C a75ef05744f1ddfff8ad9e19f8e4645e [0,2,0,0,0,0|2,0,0]=4 1194 B19R2.473887 CS(=O)c1c[nH]c2c1c(ncn2)NCC#CCO bcd53b48fba8686382056625fd57dc2c [0,2,0,0,0,0|0,0,2]=4 1195 B19R2.473887 CS(=O)c1c[nH]c2c1c(ncn2)NCCCCCl 9e13423f511f91d2fe3c4b08acfc8be7 [0,2,0,0,0,0|1,0,1]=4 1196 B19R2.473887 CS(=O)c1c[nH]c2c1c(ncn2)NCCCCO 426e9670a7f7650befdfe25349583512 [0,2,0,0,0,0|0,0,1]=3 1197 B19R2.473887 CS(=O)c1c[nH]c2c1c(ncn2)NCCCCS 7641108386964bee640b8c92c8306931 [0,2,0,0,0,0|0,1,1]=4 1198 B19R2.473887 CSCCCNc1ncnc2c1c(c[nH]2)C(=O)C 14c2792125e72eec90c248f966706c95 [0,2,0,0,0,0|1,1,0]=4 1199 B19R2.473887 CSCCCNc1ncnc2c1c(c[nH]2)S(=O)C b217a0eb5c292d0c48afa14a659ad928 [0,2,0,0,0,0|0,1,1]=4 1200 B19R2.473887 NC(=O)c1c[nH]c2c1c(ncn2)NCCCCO 10f00c4428042fa4408773f942bf143b [0,2,0,0,0,0|2,0,0]=4 1201 B19R2.473887 O=C(O)c1c[nH]c2c1c(ncn2)NCCCCO 7ef39c1dfc38c0a82405767371349092 [0,2,0,0,0,0|2,0,0]=4 1202 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ccn2)NCCC(C)O da3f8d501f72ebb5fba13a51b271a2f9 [0,2,0,0,0,0|2,0,0]=4 1203 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ccn2)NCC[C@@H](C)O 8c9e6ebbe20bf9a7826dac1f11f12da8 [0,2,0,0,0,0|2,0,0]=4 1204 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ccn2)NCC[C@H](C)O d2cc347dcde6d2e25fba414d2be8261a [0,2,0,0,0,0|2,0,0]=4 1205 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCCC(=O)O 8e1c6bd2e272b1c078438ade0c77b717 [0,2,0,0,0,0|1,0,1]=4 1206 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCCC(C)C 0abff03bd28026344fc0f30ac172fcb8 [0,2,0,0,0,0|2,0,0]=4 1207 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCCC(C)O 34bf8926fc988a3553f1ef83ffa37375 [0,2,0,0,0,0|1,0,0]=3 1208 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCCC(F)F a39e13f5e0ee69157911c2ce11e1a673 [0,2,0,0,0,0|2,0,0]=4 1209 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCCS(=O)O d4cf3f89f8c635692ec21c6dfbd711a2 [0,2,0,0,0,0|2,0,0]=4 1210 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCC[C@@H](C)O bf4d78a9e34155018307e6a8eddca0ed [0,2,0,0,0,0|1,0,0]=3 1211 B19R2.1024036 CC(=O)c1c[nH]c2c1c(ncn2)NCC[C@H](C)O a91f80fc81856a70a47ae618dfb922f9 [0,2,0,0,0,0|1,0,0]=3 1212 B19R2.1024036 CC(O)CCNc1ncnc2c1c(c[nH]2)C(=O)N 9b6fe65ba7a8243aeb0149b0d773a0a9 [0,2,0,0,0,0|2,0,0]=4 1213 B19R2.1024036 CC(O)CCNc1ncnc2c1c(c[nH]2)C(=O)O 171ff83a15a86abdc36fe43887e2f8b8 [0,2,0,0,0,0|2,0,0]=4 1214 B19R2.1024036 CC(O)CCNc1ncnc2c1c(c[nH]2)S(=O)C 0933473249108621a2d7f877d0cfaf0a [0,2,0,0,0,0|0,0,1]=3 1215 B19R2.1024036 CC(O)CCNc1ncnc2c1c(n[nH]2)C(C)C 63fe0fae248aff04a98a84fd81d330d5 [0,2,0,0,0,0|2,0,0]=4 1216 B19R2.1024036 CS(=O)c1c[nH]c2c1c(ncn2)NCCC(F)F a029e6655821c2a1a86b1e4f2d77160d [0,2,0,0,0,0|1,0,1]=4 1217 B19R2.1024036 CS(=O)c1c[nH]c2c1c(ncn2)NCCS(=O)O 72dc52be6f826f1db81478b64362ef9d [0,2,0,0,0,0|1,0,1]=4 1218 B19R2.1024036 C[C@@H](O)CCNc1ncnc2c1c(c[nH]2)C(=O)N 84e8e637a85c11b03cbabdddc16a9d66 [0,2,0,0,0,0|2,0,0]=4 1219 B19R2.1024036 C[C@@H](O)CCNc1ncnc2c1c(c[nH]2)S(=O)C 31e3f13fbe04b2516df0a31c2d79eb61 [0,2,0,0,0,0|0,0,1]=3 1220 B19R2.1024036 C[C@H](O)CCNc1ncnc2c1c(c[nH]2)C(=O)N 49a3255a4529567a75f3b4811b8bd837 [0,2,0,0,0,0|2,0,0]=4 1221 B19R2.1024036 C[C@H](O)CCNc1ncnc2c1c(c[nH]2)S(=O)C 8a48ddcf2aa9ddb35c0c1e3ab3dcf8c6 [0,2,0,0,0,0|0,0,1]=3 1222 B19R2.1150019 CC(=O)c1c[nH]c2c1c(ccn2)NC(C)CCO 1b9d21a1df5d785bedf0a0f17b119ca7 [0,2,0,0,0,0|2,0,0]=4 1223 B19R2.1150019 CC(=O)c1c[nH]c2c1c(ccn2)N[C@@H](C)CCO f28babe7145ab6be6945b7086d7a9c68 [0,2,0,0,0,0|2,0,0]=4 1224 B19R2.1150019 CC(=O)c1c[nH]c2c1c(ccn2)N[C@H](C)CCO 7aae73702c4f677d3cde4ec43c6cf1b3 [0,2,0,0,0,0|2,0,0]=4 1225 B19R2.1150019 CC(=O)c1c[nH]c2c1c(ncn2)NC(C)CCO 34c33e19f5faef304e71466d59f8635f [0,2,0,0,0,0|1,0,0]=3 1226 B19R2.1150019 CC(=O)c1c[nH]c2c1c(ncn2)N[C@@H](C)CCO ac3019b5046932c620882e8ea4a1b6ef [0,2,0,0,0,0|1,0,0]=3 1227 B19R2.1150019 CC(=O)c1c[nH]c2c1c(ncn2)N[C@H](C)CCO e954675082e0a5299aa02c645b256918 [0,2,0,0,0,0|1,0,0]=3 1228 B19R2.1150019 CC(CCO)Nc1ncnc2c1c(c[nH]2)C(=O)O fa3f7c4947b89b2c160999e411bff9c5 [0,2,0,0,0,0|2,0,0]=4 1229 B19R2.1150019 CC(CCO)Nc1ncnc2c1c(c[nH]2)S(=O)C 179a678be2011351125823fc01a502db [0,2,0,0,0,0|0,0,1]=3 1230 B19R2.1150019 CCCC(C)Nc1ncnc2c1c(c[nH]2)C(=O)C e777de98c38083a610a902e07ba32a57 [0,2,0,0,0,0|2,0,0]=4 1231 B19R2.1150019 CCC[C@H](C)Nc1ncnc2c1c(c[nH]2)C(=O)C b12573a87940e8186d1c14f92a29dfa7 [0,2,0,0,0,0|2,0,0]=4 1232 B19R2.1150019 C[C@@H](CCO)Nc1ncnc2c1c(c[nH]2)S(=O)C b7ce38174234b78304103f6472fdf997 [0,2,0,0,0,0|0,0,1]=3 1233 B19R2.1150019 C[C@H](CCO)Nc1ncnc2c1c(c[nH]2)S(=O)C 5fb87a9d7fcebc3415c68a365d6eb47a [0,2,0,0,0,0|0,0,1]=3 1234 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NCC(C)CO 6ddab0c92fd50881a4cb31ce037f1d9d [0,2,0,0,0,0|2,0,0]=4 1235 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NCC(F)CO cc5f20b97cb5a532a162778d9548e8b1 [0,2,0,0,0,0|2,0,0]=4 1236 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NCC(O)CO 4b25b0cb3e64f57c89a3485f70d6d63b [0,2,0,0,0,0|2,0,0]=4 1237 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NC[C@@H](F)CO 62dbfc27ca74eea3518273878df04996 [0,2,0,0,0,0|2,0,0]=4 1238 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NC[C@@H](O)CO 7b0fed963ba69b56c50eb0c905cc608e [0,2,0,0,0,0|2,0,0]=4 1239 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NC[C@H](C)CO 489869ec28dc7cbc71dd6acabcb7da9e [0,2,0,0,0,0|2,0,0]=4 1240 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NC[C@H](F)CO 1662826211ab17e0149076b4c03eb80d [0,2,0,0,0,0|2,0,0]=4 1241 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ccn2)NC[C@H](O)CO 41a4dc26099b86b69a7e480ce33c6236 [0,2,0,0,0,0|2,0,0]=4 1242 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NCC(Br)CBr 3a32681342bd38dda4a8e84d6f89091d [0,2,0,0,0,0|2,0,0]=4 1243 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NCC(C)CO 3f02eb84c3658049c540ef507e426b0c [0,2,0,0,0,0|1,0,0]=3 1244 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NCC(F)CO 7ed98f7cfb21b0c38bf69721a2456d50 [0,2,0,0,0,0|1,0,0]=3 1245 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NCC(O)CO f92fd98aa2162115ed4c9d2b8ddd74bc [0,2,0,0,0,0|1,0,0]=3 1246 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NC[C@@H](F)CO 19f284cdc3cb2384b1696d99fd74b2a1 [0,2,0,0,0,0|1,0,0]=3 1247 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NC[C@@H](O)CO 9200decbf0e61485e64a6aa2d6c99195 [0,2,0,0,0,0|1,0,0]=3 1248 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NC[C@H](C)CO 72bd99cbb993de49dc8738c64dfec256 [0,2,0,0,0,0|1,0,0]=3 1249 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NC[C@H](F)CO 7f9b465260b12651eba54cded917c244 [0,2,0,0,0,0|1,0,0]=3 1250 B19R2.1311368 CC(=O)c1c[nH]c2c1c(ncn2)NC[C@H](O)CO 37c4c762bb7a16508a5fa0cf7c2297cc [0,2,0,0,0,0|1,0,0]=3 1251 B19R2.1311368 CC(C)c1n[nH]c2c1c(ncn2)NCC(O)CO 7b6a04d28c4ef61acfa36255eb71cc8e [0,2,0,0,0,0|2,0,0]=4 1252 B19R2.1311368 CC(C)c1n[nH]c2c1c(ncn2)NC[C@@H](C)CO ba4797506f9458ad3699050c738b99eb [0,2,0,0,0,0|2,0,0]=4 1253 B19R2.1311368 CC(C)c1n[nH]c2c1c(ncn2)NC[C@@H](O)CO 7f911d987b445dc93841e57d275e524a [0,2,0,0,0,0|2,0,0]=4 1254 B19R2.1311368 CC(C)c1n[nH]c2c1c(ncn2)NC[C@H](C)CO f18a43886da647e5880ad9c31de359c5 [0,2,0,0,0,0|2,0,0]=4 1255 B19R2.1311368 CC(C)c1n[nH]c2c1c(ncn2)NC[C@H](O)CO b4bfec0e72afd65c5055380d609d7c58 [0,2,0,0,0,0|2,0,0]=4 1256 B19R2.1311368 CC(CO)CNc1ncnc2c1c(c[nH]2)C(=O)N 11740892edaa7c3b2ffbcad1f21c16bd [0,2,0,0,0,0|2,0,0]=4 1257 B19R2.1311368 CC(CO)CNc1ncnc2c1c(c[nH]2)C(=O)O b4d19c3fdc552a4970128ce5c44182e9 [0,2,0,0,0,0|2,0,0]=4 1258 B19R2.1311368 CC(CO)CNc1ncnc2c1c(c[nH]2)S(=O)C fbbb858a6798985813c2834c9e3c74b6 [0,2,0,0,0,0|0,0,1]=3 1259 B19R2.1311368 CC(CO)CNc1ncnc2c1c(n[nH]2)C(C)C e7cd30de1ae0f0f79e9b85708cb76f82 [0,2,0,0,0,0|2,0,0]=4 1260 B19R2.1311368 CCC(C)CNc1ncnc2c1c(c[nH]2)C(=O)C 6ef51b2d2b91d17778a55bc61a12af63 [0,2,0,0,0,0|2,0,0]=4 1261 B19R2.1311368 CCC(C)CNc1ncnc2c1c(c[nH]2)S(=O)C 06522a8b2d33c838fb3699e4cb3de2ad [0,2,0,0,0,0|1,0,1]=4 1262 B19R2.1311368 CCC(O)CNc1ncnc2c1c(c[nH]2)C(=O)C d7e1a4d251c70b146ff1cf883d23fdb9 [0,2,0,0,0,0|2,0,0]=4 1263 B19R2.1311368 CCC(O)CNc1ncnc2c1c(c[nH]2)S(=O)C 38c57f1ba969557eb79d92ba1c188bc8 [0,2,0,0,0,0|1,0,1]=4 1264 B19R2.1311368 CC[C@@H](O)CNc1ncnc2c1c(c[nH]2)C(=O)C 2a11e10ed3d1a9879cf2b586dbe8cf06 [0,2,0,0,0,0|2,0,0]=4 1265 B19R2.1311368 CC[C@@H](O)CNc1ncnc2c1c(c[nH]2)S(=O)C a54467c0d92b5b6fd0d1cc0ef21c90f7 [0,2,0,0,0,0|1,0,1]=4 1266 B19R2.1311368 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)C(=O)C d7faec3a6a24128511c8e615e47ad007 [0,2,0,0,0,0|2,0,0]=4 1267 B19R2.1311368 CC[C@H](C)CNc1ncnc2c1c(c[nH]2)S(=O)C 4230a7903e05f89540264a8104405e3d [0,2,0,0,0,0|1,0,1]=4 1268 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NCC(Br)CBr b40302d531119d06292b51d4f3e2254e [0,2,0,0,0,0|1,0,1]=4 1269 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NCC(F)CO 02ff6f54f6fb21ba74f74dc1ae66d4ce [0,2,0,0,0,0|0,0,1]=3 1270 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NCC(O)CO 60005ce5dc0a0e2260c8252a0bbf2c59 [0,2,0,0,0,0|0,0,1]=3 1271 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NC[C@@H](F)CO 3e44baea4893bfbdc36ce6252f2864b3 [0,2,0,0,0,0|0,0,1]=3 1272 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NC[C@@H](O)CO 640e841fc400505e6bfd1511e5361e22 [0,2,0,0,0,0|0,0,1]=3 1273 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NC[C@H](F)CO 86ec83f4aef803d06053d9e373eb5725 [0,2,0,0,0,0|0,0,1]=3 1274 B19R2.1311368 CS(=O)c1c[nH]c2c1c(ncn2)NC[C@H](O)CO db76b30dc27c659e243588273a73e0de [0,2,0,0,0,0|0,0,1]=3 1275 B19R2.1311368 C[C@@H](CO)CNc1ncnc2c1c(c[nH]2)C(=O)O d7b91ea2ecd0b5335c6730b96a350a1f [0,2,0,0,0,0|2,0,0]=4 1276 B19R2.1311368 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)C(=O)N eb35991d066fd893996b34443122fa89 [0,2,0,0,0,0|2,0,0]=4 1277 B19R2.1311368 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)C(=O)O e3599fb404178c0ce051546265df4aaf [0,2,0,0,0,0|2,0,0]=4 1278 B19R2.1311368 C[C@H](CO)CNc1ncnc2c1c(c[nH]2)S(=O)C a48ccbf187608b12ea4994898159b563 [0,2,0,0,0,0|0,0,1]=3 1279 B19R2.1311368 NC(=O)c1c[nH]c2c1c(ncn2)NCC(F)CO 9949a53269cc016a72621fbe7e298658 [0,2,0,0,0,0|2,0,0]=4 1280 B19R2.1311368 NC(=O)c1c[nH]c2c1c(ncn2)NCC(O)CO 2b6c71fd1352abfaae1664a83cb0e6eb [0,2,0,0,0,0|2,0,0]=4 1281 B19R2.1311368 NC(=O)c1c[nH]c2c1c(ncn2)NC[C@@H](F)CO e4ad34ce8269603d09fc0a507f8f4d89 [0,2,0,0,0,0|2,0,0]=4 1282 B19R2.1311368 NC(=O)c1c[nH]c2c1c(ncn2)NC[C@@H](O)CO 78a26fb10d6d92dbc773a8efd8793d79 [0,2,0,0,0,0|2,0,0]=4 1283 B19R2.1311368 NC(=O)c1c[nH]c2c1c(ncn2)NC[C@H](F)CO 19754c9f4fed8379f5e59dcde7380dae [0,2,0,0,0,0|2,0,0]=4 1284 B19R2.1311368 NC(=O)c1c[nH]c2c1c(ncn2)NC[C@H](O)CO 5faafcce6670e4292a3e1d472416dd91 [0,2,0,0,0,0|2,0,0]=4 1285 B19R2.1311368 O=C(O)c1c[nH]c2c1c(ncn2)NCC(F)CO 8a939c4b309f54cb9d6a8a260adbb23f [0,2,0,0,0,0|2,0,0]=4 1286 B19R2.1311368 O=C(O)c1c[nH]c2c1c(ncn2)NCC(O)CO 0a5685c6179ea130b9bd8f8c452cad79 [0,2,0,0,0,0|2,0,0]=4 1287 B19R2.1311368 O=C(O)c1c[nH]c2c1c(ncn2)NC[C@@H](F)CO bcf9631a288a6b6496987ae809a3d146 [0,2,0,0,0,0|2,0,0]=4 1288 B19R2.1311368 O=C(O)c1c[nH]c2c1c(ncn2)NC[C@@H](O)CO 56e9320df8f9710f586f40dad0b97dbc [0,2,0,0,0,0|2,0,0]=4 1289 B19R2.1311368 O=C(O)c1c[nH]c2c1c(ncn2)NC[C@H](F)CO 8c656a489e2b53c8c08c2e69de19c27d [0,2,0,0,0,0|2,0,0]=4 1290 B19R2.1311368 O=C(O)c1c[nH]c2c1c(ncn2)NC[C@H](O)CO 24a9f9fd0647a7ebaddaf5172122407b [0,2,0,0,0,0|2,0,0]=4 1291 B19R2.1311368 O=[N+]([O-])c1c[nH]c2c1c(ncn2)NCC(F)CO 181ff704fd32f3e908de4ac99183654a [0,2,0,0,0,0|2,0,0]=4 1292 B19R2.1311368 O=[N+]([O-])c1c[nH]c2c1c(ncn2)NC[C@@H](F)CO cd224ab2252a3df626219ca0f6301cdd [0,2,0,0,0,0|2,0,0]=4 1293 B19R2.1311368 O=[N+]([O-])c1c[nH]c2c1c(ncn2)NC[C@H](F)CO 6610c3d64acb69d08fa84fbc23d0417b [0,2,0,0,0,0|2,0,0]=4 1294 B19R2.1311368 OCC(F)CNc1ncnc2c1c(c[nH]2)C(F)F 7db8116150c9326084137bf405b1e5e7 [0,2,0,0,0,0|2,0,0]=4 1295 B19R2.1311368 OC[C@@H](F)CNc1ncnc2c1c(c[nH]2)C(F)F f5c1a1504bf96a6fc1ba34a734725c57 [0,2,0,0,0,0|2,0,0]=4 1296 B19R2.1311368 OC[C@H](F)CNc1ncnc2c1c(c[nH]2)C(F)F 8b06076599231c0b96b1c04e9d39eed0 [0,2,0,0,0,0|2,0,0]=4 1297 B19R2.1687651 CC(=O)c1c[nH]c2c1c(ccn2)N(C)CCCO 652e72c54be13fce600c8fc561bfd7ca [0,2,0,0,0,0|2,0,0]=4 1298 B19R2.1687651 CC(=O)c1c[nH]c2c1c(ncn2)N(C)CCCO 0362d662b65d4e5d9498877d57caa270 [0,2,0,0,0,0|1,0,0]=3 1299 B19R2.1687651 CCCCN(C)c1ncnc2c1c(c[nH]2)C(=O)C 8a288b8b3e00a6ab59809af1e220f7f6 [0,2,0,0,0,0|2,0,0]=4 1300 B19R2.473890 COCCCNc1ncnc2c1c(c([nH]2)Br)C#N 31d31d878cf28c41759818c3a45d7a16 [0,2,0,0,0,0|2,0,0]=4 1301 B19R2.473890 N#Cc1c([nH]c2c1c(ncn2)NCCCCO)Br 61aa2f2e3c79f6db4e0bcef2cd765740 [0,2,0,0,0,0|2,0,0]=4 1302 B19R2.1150022 CC(CCO)Nc1ncnc2c1c(c([nH]2)Br)C#N 1d7afec57185aa09898348ff188bb8d5 [0,2,0,0,0,0|2,0,0]=4 1303 B19R2.4167089 CC(CO)CNc1ncnc2c1c(c([nH]2)Br)C#N f9838a383defa964b2adf8d5a91f12b8 [0,2,0,0,0,0|2,0,0]=4 1304 B19R2.4167089 CCc1c(sc2c1c(ncn2)NCC(F)CO)C 5a9ebbc9ed1847ad92bf75557711a828 [0,2,0,0,0,0|2,0,0]=4 1305 B19R2.4167089 CCc1c(sc2c1c(ncn2)NC[C@@H](F)CO)C a9704d5e33a27673816dad3888ee8b68 [0,2,0,0,0,0|2,0,0]=4 1306 B19R2.4167089 CCc1c(sc2c1c(ncn2)NC[C@H](F)CO)C dbf709f474e27510995f6ac4b694d0d7 [0,2,0,0,0,0|2,0,0]=4 1307 B19R2.4167089 C[C@@H](CO)CNc1ncnc2c1c(c([nH]2)Br)C#N 5d9acd85e26d4ecb84ef19de4e539e1a [0,2,0,0,0,0|2,0,0]=4 1308 B19R2.4167089 C[C@H](CO)CNc1ncnc2c1c(c([nH]2)Br)C#N 6e5778177c1a8fef29591b5a04cea5ca [0,2,0,0,0,0|2,0,0]=4 1309 B19R2.4167089 N#Cc1c([nH]c2c1c(ncn2)NCC(O)CO)Br ba2a5397ab9693286c19819bd3dfd825 [0,2,0,0,0,0|2,0,0]=4 1310 B19R2.4167089 N#Cc1c([nH]c2c1c(ncn2)NC[C@@H](O)CO)Br 797ac7c665a24ef0a1bd6a3af8666986 [0,2,0,0,0,0|2,0,0]=4 1311 B19R2.4167089 N#Cc1c([nH]c2c1c(ncn2)NC[C@H](O)CO)Br 80893a08f6bb0bd9552d3cd14b84c722 [0,2,0,0,0,0|2,0,0]=4 1312 B19R2.4167109 CC(O)CCNc1ncnc2c1c(c([nH]2)Br)C#N 7e7d84e1410fb461057fa384c2c4aa7f [0,2,0,0,0,0|2,0,0]=4 1313 B19R2.279206 C#CCCCCNc1ncnc2c1c(n[nH]2)SC 6019b97450afebf5849c9e718f6b3f84 [0,2,0,0,0,0|2,0,0]=4 1314 B19R2.279206 C#CCOCCNc1ncnc2c1c(n[nH]2)SC 6c082122fcc5e06f9587e575dca9f318 [0,2,0,0,0,0|2,0,0]=4 1315 B19R2.279206 C/C=C\CCCNc1ncnc2c1c(n[nH]2)SC e2a6faa0476643e526f849d4baa68f80 [0,2,0,0,0,0|2,0,0]=4 1316 B19R2.279206 C=C/C=C/CCNc1ncnc2c1c(c[nH]2)SC 7d46def9d70f67f0ba9665b88589b2e6 [0,2,0,0,0,0|1,0,1]=4 1317 B19R2.279206 C=CCCCCNc1ncnc2c1c(c[nH]2)CC 067a858642c2fe0c53d9ce60a6a4c119 [0,2,0,0,0,0|2,0,0]=4 1318 B19R2.279206 C=CCCCCNc1ncnc2c1c(c[nH]2)SC ed2a5e48cb0118bcf76f01dbf9353a62 [0,2,0,0,0,0|1,0,0]=3 1319 B19R2.279206 C=CCCCCNc1ncnc2c1c(n[nH]2)SC dd6bb57370ec42a1cfac7fe039e83d3a [0,2,0,0,0,0|2,0,0]=4 1320 B19R2.279206 C=CCOCCNc1ncnc2c1c(n[nH]2)SC 2324ff2c80d228b8b0dedb68beedbb78 [0,2,0,0,0,0|2,0,0]=4 1321 B19R2.279206 C=COCCCNc1ncnc2c1c(c[nH]2)C=O 21ee5a3f8189bb436929ae7791a28b1f [0,2,0,0,0,0|2,0,0]=4 1322 B19R2.279206 C=COCCCNc1ncnc2c1c(c[nH]2)CC bd67cf9b7b1cd7ce91b1aa4a9210cd55 [0,2,0,0,0,0|1,0,0]=3 1323 B19R2.279206 C=COCCCNc1ncnc2c1c(c[nH]2)CO ff31890d8bc68590bee53f2b5f688833 [0,2,0,0,0,0|2,0,0]=4 1324 B19R2.279206 C=COCCCNc1ncnc2c1c(c[nH]2)SC 35a36011c288f16b78ad3e04cf0c1f54 [0,2,0,0,0,0|0,0,0]=2 1325 B19R2.279206 CC/C=C\CCNc1ncnc2c1c(n[nH]2)SC 701773dca63d344105214584ec838219 [0,2,0,0,0,0|2,0,0]=4 1326 B19R2.279206 CCC/C=C/CNc1ncnc2c1c(n[nH]2)SC d05904f76180d65d52aaad8db23196fc [0,2,0,0,0,0|2,0,0]=4 1327 B19R2.279206 CCC/C=C\CNc1ncnc2c1c(n[nH]2)SC a5f953638fc17fe267dd4d06602a07ea [0,2,0,0,0,0|2,0,0]=4 1328 B19R2.279206 CCCCCCNc1ncnc2c1c(c[nH]2)CC 94b2820ef68720e1a36734ec1973707b [0,2,0,0,0,0|2,0,0]=4 1329 B19R2.279206 CCCCCCNc1ncnc2c1c(n[nH]2)SC 1de00c9929991b84aee9bf031273fda7 [0,2,0,0,0,0|2,0,0]=4 1330 B19R2.279206 CCCCOCNc1ncnc2c1c(n[nH]2)SC 908aa911a7d35ad34886e2c624b6c420 [0,2,0,0,0,0|2,0,0]=4 1331 B19R2.279206 CCCOCCNc1ncnc2c1c(c[nH]2)CC d0ccb6524c476ee349512a7f3d41abc3 [0,2,0,0,0,0|2,0,0]=4 1332 B19R2.279206 CCCOCCNc1ncnc2c1c(c[nH]2)SC de8e5b18e40bc5cf593fd9d6e81ca078 [0,2,0,0,0,0|1,0,0]=3 1333 B19R2.279206 CCCOCCNc1ncnc2c1c(n[nH]2)SC 75fd616f270af0284ab623edd81ca2cd [0,2,0,0,0,0|2,0,0]=4 1334 B19R2.279206 CCOCCCNc1ncnc2c1c(n[nH]2)SC 3875bcd18f2258077fcfb2d479387d7c [0,2,0,0,0,0|1,0,0]=3 1335 B19R2.279206 CCSCCCNc1ncnc2c1c(n[nH]2)SC c79ab84216b54276344d8763a8cb4a29 [0,2,0,0,0,0|1,1,0]=4 1336 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCCCCCl 0d961d96993d5b234cfb875a4d4543ac [0,2,0,0,0,0|2,0,0]=4 1337 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCCCCO d638208a8e4739562f5aebd5d44a3ce1 [0,2,0,0,0,0|1,0,0]=3 1338 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCCCOC fd59844ea21b87c5ed995254cd5d79f2 [0,2,0,0,0,0|1,0,0]=3 1339 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCCCSC ab176b8835d8392beb1d32c6d623a896 [0,2,0,0,0,0|1,1,0]=4 1340 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCOCCO 00da756c98f8d84454598c179780e548 [0,2,0,0,0,0|1,0,0]=3 1341 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCOCCS 40beb613f225d4ab80e8709908f3ba85 [0,2,0,0,0,0|1,1,0]=4 1342 B19R2.279206 CCc1c[nH]c2c1c(ncn2)NCCSCCO 40378c4e873eff9357081be39cd3f39e [0,2,0,0,0,0|1,0,0]=3 1343 B19R2.279206 COCC#CCNc1ncnc2c1c(n[nH]2)SC bf28b9db5b6d4760e7926abf3ce62373 [0,2,0,0,0,0|1,0,1]=4 1344 B19R2.279206 COCCCCNc1ncnc2c1c(c[nH]2)C=O 4cbc795f9c17f98f714568047690aa4b [0,2,0,0,0,0|2,0,0]=4 1345 B19R2.279206 COCCCCNc1ncnc2c1c(c[nH]2)SC a980574d75c54a74aa05b4a9a2fc8a34 [0,2,0,0,0,0|0,0,0]=2 1346 B19R2.279206 COCCCCNc1ncnc2c1c(n[nH]2)SC 43c56b9b661af9aa3d1880e1b793692c [0,2,0,0,0,0|1,0,0]=3 1347 B19R2.279206 COCCOCNc1ncnc2c1c(n[nH]2)SC 375e90ada95c2cf828861088bc0e3671 [0,2,0,0,0,0|1,0,0]=3 1348 B19R2.279206 COCOCCNc1ncnc2c1c(n[nH]2)SC 2d68098f287315ed3a017c2beb929e9f [0,2,0,0,0,0|1,0,0]=3 1349 B19R2.279206 CSc1c[nH]c2c1c(ncn2)NCCCCCCl 63ae93efd04e3370f4fd558697005708 [0,2,0,0,0,0|1,0,0]=3 1350 B19R2.279206 CSc1c[nH]c2c1c(ncn2)NCCCCCO b37311972ede760decd34d2010d6f8ee [0,2,0,0,0,0|0,0,0]=2 1351 B19R2.279206 CSc1c[nH]c2c1c(ncn2)NCCOCCO 9c03dd90f194821aa60f120679f88c77 [0,2,0,0,0,0|0,0,0]=2 1352 B19R2.279206 CSc1c[nH]c2c1c(ncn2)NCCOCCS 2e99444e08d35923d8f23e434516f7b5 [0,2,0,0,0,0|0,1,0]=3 1353 B19R2.279206 CSc1c[nH]c2c1c(ncn2)NCCSCCO f7bf900914eb9cf7e966e7aef3a96930 [0,2,0,0,0,0|0,0,0]=2 1354 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCCCC#N 06b111a1acdbd48e3af3607a0462ec82 [0,2,0,0,0,0|2,0,0]=4 1355 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCCCC=O 3b2113a809ad037ce821b9353809ece4 [0,2,0,0,0,0|1,0,1]=4 1356 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCCCCF 5cbd60aacf20cfa860e556e5424462ee [0,2,0,0,0,0|2,0,0]=4 1357 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCCCCO d5884e2ea723584069ee9e4cf5673910 [0,2,0,0,0,0|1,0,0]=3 1358 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCCCON 4298264ddbfee6a4fdcd83a64c3ad74a [0,2,0,0,0,0|1,0,0]=3 1359 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCOCC#N 2bf25c692ae501b90e26845823d19092 [0,2,0,0,0,0|2,0,0]=4 1360 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCOCC=O bade10ca0d0b464f2b3b9d55ca430319 [0,2,0,0,0,0|1,0,1]=4 1361 B19R2.279206 CSc1n[nH]c2c1c(ncn2)NCCOCCO 44d3932df124da6e3f6af47518a464f1 [0,2,0,0,0,0|1,0,0]=3 1362 B19R2.279206 O=Cc1c[nH]c2c1c(ncn2)NCCCCCO 3804146c439fadabe0578255c5fdb9f8 [0,2,0,0,0,0|2,0,0]=4 1363 B19R2.279206 OCCCCCNc1ncnc2c1c(c[nH]2)CO f19d2f2154a63e04815b349dafde1ab1 [0,2,0,0,0,0|2,0,0]=4 1364 B19R2.279206 OCCOCCNc1ncnc2c1c(c[nH]2)CO e8327298ae22208aae126ce113c7f275 [0,2,0,0,0,0|2,0,0]=4 1365 B19R2.1629750 C=C(C)CCCNc1ncnc2c1c(n[nH]2)SC bf7344dceac42e5573281077ec8a253d [0,2,0,0,0,0|2,0,0]=4 1366 B19R2.1629750 CCc1c[nH]c2c1c(ncn2)NCCCC(=O)N 2e22e36ee92b4ef296e47bde7b419b44 [0,2,0,0,0,0|1,0,1]=4 1367 B19R2.1629750 CCc1c[nH]c2c1c(ncn2)NCCCC(C)C 20fb81b2c9b24b7cb60a2ae7ce5c1bc1 [0,2,0,0,0,0|2,0,0]=4 1368 B19R2.1629750 CCc1c[nH]c2c1c(ncn2)NCCCN(C)C 8dd1534bdb8fc196edcb54f53a3021f6 [0,2,0,0,0,0|2,0,0]=4 1369 B19R2.1629750 CCc1c[nH]c2c1c(ncn2)NCCCS(=O)C 5a5f53e5c8f24a111b142c97273afeaf [0,2,0,0,0,0|1,0,1]=4 1370 B19R2.1629750 CCc1c[nH]c2c1c(ncn2)NCCOC(C)C c7fce90d5dac5fc354600bc864615616 [0,2,0,0,0,0|2,0,0]=4 1371 B19R2.1629750 CCc1c[nH]c2c1c(ncn2)NCCOC(F)F 7465d6f666c6aab84a3df4bd03ffb88f [0,2,0,0,0,0|2,0,0]=4 1372 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NC/C=C/C(=O)O afb43dc295789bc4a891242c23c720a9 [0,2,0,0,0,0|0,0,2]=4 1373 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCC#CC(=O)O 888b1651b0a5818e0c1f20ee8bf31cb2 [0,2,0,0,0,0|0,0,2]=4 1374 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCC=CC(=O)O 446ef45f2c85a3603f75c10c722bd671 [0,2,0,0,0,0|0,0,2]=4 1375 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCCCC(=O)N 4338f94779cd60ec134aa9fa07c886a6 [0,2,0,0,0,0|0,0,1]=3 1376 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCCCS(=O)C dcd210acce554e55f0d2748a1bdbc6f4 [0,2,0,0,0,0|0,0,1]=3 1377 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCCNC(=O)C 0679c9d473ac7f54a486fc6cb33ebf0d [0,2,0,0,0,0|0,0,2]=4 1378 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCCNC(=S)N c1518b3e83fccbe3b0e0e5444c14c9b6 [0,2,0,0,0,0|0,1,1]=4 1379 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCCOC(C)C aea71b0459fd4b827e84120f41abdda8 [0,2,0,0,0,0|1,0,0]=3 1380 B19R2.1629750 CSc1c[nH]c2c1c(ncn2)NCCOC(F)F f4be4ce24e1f04208615a6b36f1ea67f [0,2,0,0,0,0|1,0,0]=3 1381 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCCC(=O)C 07f38fbdf5e622d487331e3679e9b855 [0,2,0,0,0,0|1,0,1]=4 1382 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCCC(=O)N 2460e06292ece1742acaced1653e8ecb [0,2,0,0,0,0|1,0,1]=4 1383 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCCC(=O)O f5f4c3e5b7bb528b0197b89fcea23394 [0,2,0,0,0,0|1,0,0]=3 1384 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCCC(C)C 970fae187a7eaf4c8a95a1c5b32018cb [0,2,0,0,0,0|2,0,0]=4 1385 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCCC(C)O 076a5fc22e3eaa09b09950349eeac145 [0,2,0,0,0,0|1,0,0]=3 1386 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCCN(C)C c54606ecec3c41bfc2ea77ac070cdbac [0,2,0,0,0,0|2,0,0]=4 1387 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCOC(C)C 1bce02e8eac61820e481e6cb9810e40f [0,2,0,0,0,0|2,0,0]=4 1388 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCOC(F)F cd96acbce6ad07ff238a22cb282031be [0,2,0,0,0,0|2,0,0]=4 1389 B19R2.1629750 CSc1n[nH]c2c1c(ncn2)NCCSC(C)C 03ad77c52910a3d33dda12a09e337183 [0,2,0,0,0,0|2,0,0]=4 1390 B19R2.1679633 C=CCCC(C)Nc1ncnc2c1c(n[nH]2)SC 97f775e14e1fc4216062e470f3ff6993 [0,2,0,0,0,0|2,0,0]=4 1391 B19R2.1679633 CCCCC(C)Nc1ncnc2c1c(c[nH]2)CC 4322b5585dc15797e0570f2dc0c77ab9 [0,2,0,0,0,0|2,0,0]=4 1392 B19R2.1679633 CCCCC(C)Nc1ncnc2c1c(n[nH]2)SC b359b760395d3afaf4198621c767ae97 [0,2,0,0,0,0|2,0,0]=4 1393 B19R2.1679633 CCCC[C@@H](C)Nc1ncnc2c1c(c[nH]2)CC e5fb2259a3a120ad4a8024a88f3d46bd [0,2,0,0,0,0|2,0,0]=4 1394 B19R2.1679633 CCc1c[nH]c2c1c(ncn2)NC(C)CCCO 914bd362fad5ae491ad6d14472d9ba42 [0,2,0,0,0,0|1,0,0]=3 1395 B19R2.1679633 CCc1c[nH]c2c1c(ncn2)N[C@H](C)CCCO 6b4833e4f8c9e3bdbeefacd4f151b128 [0,2,0,0,0,0|1,0,0]=3 1396 B19R2.1679633 CSc1n[nH]c2c1c(ncn2)NC(=S)NCCO 3db7ba4eeb2b0eefa0e39b44ddd0ebf4 [0,2,0,0,0,0|1,0,1]=4 1397 B19R2.1679633 CSc1n[nH]c2c1c(ncn2)NC(C)CCC#N 328a84e4243ed3583a9b648f7c0b65be [0,2,0,0,0,0|2,0,0]=4 1398 B19R2.1700360 C=CCC(C)CNc1ncnc2c1c(n[nH]2)SC 087a7041452b7227e336eba2999bc430 [0,2,0,0,0,0|2,0,0]=4 1399 B19R2.1700360 C=CCC(O)CNc1ncnc2c1c(c[nH]2)CC 7b259d1b14c9ea52fb295ea115024c1c [0,2,0,0,0,0|2,0,0]=4 1400 B19R2.1700360 C=CCC(O)CNc1ncnc2c1c(c[nH]2)SC 0bd30708e72279dabd542b71cbf879e9 [0,2,0,0,0,0|1,0,0]=3 1401 B19R2.1700360 CC(CCO)CNc1ncnc2c1c(c[nH]2)C=O 684b67d2a00d00bd435fa8491112cb3e [0,2,0,0,0,0|2,0,0]=4 1402 B19R2.1700360 CCCC(=O)CNc1ncnc2c1c(n[nH]2)SC 9c54a2ddc80f2d66f9ed21f8413f063c [0,2,0,0,0,0|2,0,0]=4 1403 B19R2.1700360 CCCC(C)CNc1ncnc2c1c(n[nH]2)SC cb5eb2a004e027c85ae0332cc3b42530 [0,2,0,0,0,0|2,0,0]=4 1404 B19R2.1700360 CCCC(O)CNc1ncnc2c1c(c[nH]2)CC e965277cef38646884695a73cb0bcf8e [0,2,0,0,0,0|2,0,0]=4 1405 B19R2.1700360 CCNC(=O)CNc1ncnc2c1c(c[nH]2)SC ddaf5ce9752c3afe40793f12f92ae358 [0,2,0,0,0,0|1,0,1]=4 1406 B19R2.1700360 CCOC(=O)CNc1ncnc2c1c(c[nH]2)SC 0a7120dceb77e2c75d62e162b582103b [0,2,0,0,0,0|1,0,1]=4 1407 B19R2.1700360 CCOC(C)CNc1ncnc2c1c(c[nH]2)CC 591c7ed5c2f5994076ef15e65cc9a282 [0,2,0,0,0,0|2,0,0]=4 1408 B19R2.1700360 CCc1c[nH]c2c1c(ncn2)NCC(C)CCO 17fdf274fa1f216dbf3b4e8ef1ecee7b [0,2,0,0,0,0|1,0,0]=3 1409 B19R2.1700360 CCc1c[nH]c2c1c(ncn2)NCC(O)COC accb53c079dcb1460b77373ce5500cb3 [0,2,0,0,0,0|1,0,0]=3 1410 B19R2.1700360 CCc1c[nH]c2c1c(ncn2)NC[C@H](O)COC e1a16c5822410a3ca238d59ae7b53da2 [0,2,0,0,0,0|1,0,0]=3 1411 B19R2.1700360 COCC(=O)CNc1ncnc2c1c(n[nH]2)SC 5356d3d654159862a9251ce84d0244bd [0,2,0,0,0,0|1,0,1]=4 1412 B19R2.1700360 COCC(O)CNc1ncnc2c1c(c[nH]2)CO f67b2707ab0d50c979680b4abfe0a6ea [0,2,0,0,0,0|2,0,0]=4 1413 B19R2.1700360 COCC(O)CNc1ncnc2c1c(c[nH]2)SC b0877a930cf42beb80eae55fb6d881de [0,2,0,0,0,0|0,0,0]=2 1414 B19R2.1700360 COCC(O)CNc1ncnc2c1c(n[nH]2)SC 3c1811cd016389f27a33b0f1dcae2157 [0,2,0,0,0,0|1,0,0]=3 1415 B19R2.1700360 COC[C@@H](O)CNc1ncnc2c1c(c[nH]2)CO f047218b884c88f377e817e19ce661a9 [0,2,0,0,0,0|2,0,0]=4 1416 B19R2.1700360 COC[C@@H](O)CNc1ncnc2c1c(c[nH]2)SC a4b529b4772b64320e4e8cc2cb084fe2 [0,2,0,0,0,0|0,0,0]=2 1417 B19R2.1700360 CSc1n[nH]c2c1c(ncn2)NCC(=O)NCO 0bcdb005886e532d5d81d87135647383 [0,2,0,0,0,0|1,0,1]=4 1418 B19R2.1700360 CSc1n[nH]c2c1c(ncn2)NCC(O)CC#N d05b16a32441af649e53ebca067bcbb9 [0,2,0,0,0,0|2,0,0]=4 1419 B19R2.1700360 CSc1n[nH]c2c1c(ncn2)NC[C@@H](O)CC#N b31a0bf9920e7af5645c07edd177a789 [0,2,0,0,0,0|2,0,0]=4 1420 B19R2.1700360 CSc1n[nH]c2c1c(ncn2)NC[C@H](O)CC#N 0e23ea6efc1bef11b95f69cb7b73b1b5 [0,2,0,0,0,0|2,0,0]=4 1421 B19R2.1766455 C=CCCCN(C)c1ncnc2c1c(c[nH]2)CC 3480a3b407e5da30a893f80e6fea9951 [0,2,0,0,0,0|2,0,0]=4 1422 B19R2.1766455 C=CCCCN(C)c1ncnc2c1c(c[nH]2)SC 43cdd71ad2ae90d3e887ae979e03ba51 [0,2,0,0,0,0|1,0,0]=3 1423 B19R2.1766455 CCCCCN(C)c1ncnc2c1c(c[nH]2)CC 13e4c68c3531672383cd16d492c4e7b5 [0,2,0,0,0,0|2,0,0]=4 1424 B19R2.1766455 CCOCCN(C)c1ncnc2c1c(c[nH]2)CC c466a105cab28490f907d36e71bc79df [0,2,0,0,0,0|2,0,0]=4 1425 B19R2.1766455 CCOCCN(C)c1ncnc2c1c(c[nH]2)SC db3b3f14fde63ae9c16b0790105915ac [0,2,0,0,0,0|1,0,0]=3 1426 B19R2.1766455 CCc1c[nH]c2c1c(ncn2)N(C)CC#CCO c4e58d8ddefb0451590b07ba6ab8f995 [0,2,0,0,0,0|1,0,1]=4 1427 B19R2.1766455 CCc1c[nH]c2c1c(ncn2)N(C)CCCCO 19a4460ad6153ccb08afe763bec6bbf6 [0,2,0,0,0,0|1,0,0]=3 1428 B19R2.1766455 CCc1c[nH]c2c1c(ncn2)N(C)CCCOC dc2eb2564e8011702f6f764c017b7ee7 [0,2,0,0,0,0|1,0,0]=3 1429 B19R2.1766455 CSc1c[nH]c2c1c(ncn2)N(C)CC#CCO e12a19426e809a626e585be2a6ef2f67 [0,2,0,0,0,0|0,0,1]=3 1430 B19R2.1766455 CSc1c[nH]c2c1c(ncn2)N(C)CCCCO f08f5c07274334f47699e7fbc1ad0639 [0,2,0,0,0,0|0,0,0]=2 1431 B19R2.2694573 CCC(C)CCNc1ncnc2c1c(n[nH]2)SC a79e7e2c990ac63d6797f0d64356a312 [0,2,0,0,0,0|2,0,0]=4 1432 B19R2.2694573 CCS(=O)CCNc1ncnc2c1c(n[nH]2)SC 4eba186f2476dfdfd8fe872e1ac60f8b [0,2,0,0,0,0|2,0,0]=4 1433 B19R2.2694573 CCc1c[nH]c2c1c(ncn2)NCCC(=O)NO 9479db51f6602d4b7dc6d6f8f0316d75 [0,2,0,0,0,0|1,0,1]=4 1434 B19R2.2694573 CCc1c[nH]c2c1c(ncn2)NCCC(=O)OC 79693b760922f1db1ce759013902cf49 [0,2,0,0,0,0|1,0,1]=4 1435 B19R2.2694573 CCc1c[nH]c2c1c(ncn2)NCCC(C)CC 9a241f77c42ba1ac11dd91afeaad5795 [0,2,0,0,0,0|2,0,0]=4 1436 B19R2.2694573 CCc1c[nH]c2c1c(ncn2)NCCC(C)CO 60c57a83f0fab349db6490b11c14e608 [0,2,0,0,0,0|1,0,0]=3 1437 B19R2.2694573 CCc1c[nH]c2c1c(ncn2)NCCC(O)CO 7b10627eb8a1e6f7fc00c2f1781638db [0,2,0,0,0,0|1,0,0]=3 1438 B19R2.2694573 CCc1c[nH]c2c1c(ncn2)NCC[C@@H](C)CO a45347b552eedc6f539cb5b8b61ab1a5 [0,2,0,0,0,0|1,0,0]=3 1439 B19R2.2694573 CNC(=O)CCNc1ncnc2c1c(c[nH]2)SC c4c036acd660e5c99f738bbb283fc1bc [0,2,0,0,0,0|0,0,2]=4 1440 B19R2.2694573 COC(=O)CCNc1ncnc2c1c(c[nH]2)SC 10f736f001e999b58aee69340838a600 [0,2,0,0,0,0|0,0,1]=3 1441 B19R2.2694573 COC(=O)CCNc1ncnc2c1c(n[nH]2)SC 5f1cdd557a55a9f12ebf9d96017df7f8 [0,2,0,0,0,0|1,0,1]=4 1442 B19R2.2694573 CSc1c[nH]c2c1c(ncn2)NCCC(=O)NO 1718d2bef42cf6be81ca15a9973a4c74 [0,2,0,0,0,0|0,0,1]=3 1443 B19R2.2694573 CSc1c[nH]c2c1c(ncn2)NCCC(O)CO bc454bc289fc609e04f2e271b45ecdf5 [0,2,0,0,0,0|0,0,0]=2 1444 B19R2.2694573 CSc1n[nH]c2c1c(ncn2)NCCC(C)CO f3ee675e3ae8e6ad03f5ef6e41d70277 [0,2,0,0,0,0|1,0,0]=3 1445 B19R2.2694573 OCc1c[nH]c2c1c(ncn2)NCCC(O)CO 5ec5bed9a3ef16e55a6089da2592325b [0,2,0,0,0,0|2,0,0]=4 1446 B19R2.527572 CCCC(CC)Nc1ncnc2c1c(n[nH]2)SC 8c66cc96f9fa1fd00bba4e58db84838d [0,2,0,0,0,0|2,0,0]=4 1447 B19R2.527572 CCCC(CO)Nc1ncnc2c1c(c[nH]2)CC 42618910b81bfaae04e832aec3594956 [0,2,0,0,0,0|2,0,0]=4 1448 B19R2.527572 CCC[C@@H](CO)Nc1ncnc2c1c(c[nH]2)CC d8c6ee352a0421ec23f32e58c71b69d8 [0,2,0,0,0,0|2,0,0]=4 1449 B19R2.527572 CCC[C@H](CO)Nc1ncnc2c1c(c[nH]2)CC 40462c26ce44ec3757b3583a1da6c949 [0,2,0,0,0,0|2,0,0]=4 1450 B19R2.527572 CCc1c[nH]c2c1c(ncn2)NC(CO)CCO 20786659c4f7272f5e0b0ac74f0e32ca [0,2,0,0,0,0|1,0,0]=3 1451 B19R2.527572 CCc1c[nH]c2c1c(ncn2)N[C@@H](CO)CCO 5150958759d90e44e69718bcbdface3e [0,2,0,0,0,0|1,0,0]=3 1452 B19R2.1629749 CCc1c[nH]c2c1c(ncn2)NC(C)C(C)CC 469758a1e01124cef0a5c1a97a1a5831 [0,2,0,0,0,0|2,0,0]=4 1453 B19R2.2694607 CCc1c[nH]c2c1c(ncn2)NC(C)CC(=O)O 55f3f58ea7e630436498e7e9072fea72 [0,2,0,0,0,0|1,0,1]=4 1454 B19R2.2694607 CCc1c[nH]c2c1c(ncn2)NC(C)CC(C)C f36c5751f48bcfba46c278c637a38a95 [0,2,0,0,0,0|2,0,0]=4 1455 B19R2.2694607 CCc1c[nH]c2c1c(ncn2)NC(C)CC(C)O 5f3ab33cb042d034ff08f57bd3f50bdc [0,2,0,0,0,0|1,0,0]=3 1456 B19R2.2694607 CCc1c[nH]c2c1c(ncn2)N[C@@H](C)CC(=O)O 4a0adc5771794341ddb98d16e7a023c2 [0,2,0,0,0,0|1,0,1]=4 1457 B19R2.2694607 CCc1c[nH]c2c1c(ncn2)N[C@H](C)CC(=O)O 418166e42eb188b140a75341d152c0f0 [0,2,0,0,0,0|1,0,1]=4 1458 B19R2.2694607 CSc1c[nH]c2c1c(ncn2)NC(C)CC(=O)O 07d8eb9b396116fdbe76ef9a09bb52a0 [0,2,0,0,0,0|0,0,1]=3 1459 B19R2.2694607 CSc1c[nH]c2c1c(ncn2)N[C@@H](C)CC(=O)O cf31a85cf98140e2a875a12634fbfaee [0,2,0,0,0,0|0,0,1]=3 1460 B19R2.2694607 CSc1c[nH]c2c1c(ncn2)N[C@H](C)CC(=O)O 015144b04ac732dca54fb3b2e1c55356 [0,2,0,0,0,0|0,0,1]=3 1461 B19R2.2694607 CSc1n[nH]c2c1c(ncn2)NC(C)CC(C)C 6754a0c15569fd3fc0512fa644f25ad8 [0,2,0,0,0,0|2,0,0]=4 1462 B19R2.3341880 CCc1c[nH]c2c1c(ncn2)NC(C)(C)CCO 6e0e92f05309303048ad7de71b2e3125 [0,2,0,0,0,0|1,0,0]=3 1463 B19R2.3473268 CC(CCO)N(C)c1ncnc2c1c(c[nH]2)C=O 9dc84991625bd5e136d39d1b706041dc [0,2,0,0,0,0|2,0,0]=4 1464 B19R2.3473268 CC(CCO)N(C)c1ncnc2c1c(c[nH]2)CO 0b0b7ff22fe0a6f9009ff216e26b4550 [0,2,0,0,0,0|2,0,0]=4 1465 B19R2.3473268 CCc1c[nH]c2c1c(ncn2)N(C)C(C)CCO 0021859b27285ae851516ed2af32a9a2 [0,2,0,0,0,0|1,0,0]=3 1466 B19R2.3473268 CCc1c[nH]c2c1c(ncn2)N(C)[C@@H](C)CCO 10dfcdf8ced39488edf24b6ab0c54f3a [0,2,0,0,0,0|1,0,0]=3 1467 B19R2.3473268 CSc1c[nH]c2c1c(ncn2)N(C)C(C)CCO f4c65c08e0ba50ad52ef02bd6abf38a7 [0,2,0,0,0,0|0,0,0]=2 1468 B19R2.3473268 CSc1c[nH]c2c1c(ncn2)N(C)[C@@H](C)CCO 871c588c0a8145807927d0b268e0f009 [0,2,0,0,0,0|0,0,0]=2 1469 B19R2.3473268 C[C@@H](CCO)N(C)c1ncnc2c1c(c[nH]2)C=O 6acafbe198ac44b3fa517cf499952dee [0,2,0,0,0,0|2,0,0]=4 1470 B19R2.3473268 C[C@@H](CCO)N(C)c1ncnc2c1c(c[nH]2)CO 9390c4675d6e7a0e9a71364557130822 [0,2,0,0,0,0|2,0,0]=4 1471 B19R2.1629747 CC(C)(O)CCNc1ncnc2c1c(c[nH]2)CO 038442598a96b013cbbbeaee3b498d03 [0,2,0,0,0,0|2,0,0]=4 1472 B19R2.1629747 CCc1c[nH]c2c1c(ncn2)NCCC(C)(C)C 76736503020addec8377b48a5137b94a [0,2,0,0,0,0|2,0,0]=4 1473 B19R2.1629747 CCc1c[nH]c2c1c(ncn2)NCCC(C)(C)F 0f5fc1dd8ba76c1f74d7963852d640f8 [0,2,0,0,0,0|2,0,0]=4 1474 B19R2.1629747 CCc1c[nH]c2c1c(ncn2)NCCC(C)(C)O 352e53a03f34257606401feaa0ceee1f [0,2,0,0,0,0|1,0,0]=3 1475 B19R2.1629747 CCc1c[nH]c2c1c(ncn2)NCCC(F)(F)F d1e3a3941ccb8cc3f420d61f67354d42 [0,2,0,0,0,0|2,0,0]=4 1476 B19R2.1629747 CCc1c[nH]c2c1c(ncn2)NCCS(=O)(=O)O bc5f14f71f3c3a87267bae9c0dda20fb [0,2,0,0,0,0|2,0,0]=4 1477 B19R2.1629747 CSc1c[nH]c2c1c(ncn2)NCCC(C)(C)O 234d33d9b378ae904dbe197a98d1f940 [0,2,0,0,0,0|0,0,0]=2 1478 B19R2.1629747 CSc1c[nH]c2c1c(ncn2)NCCC(F)(F)F 9b7284649273e767c0fc4e32f89a412b [0,2,0,0,0,0|1,0,0]=3 1479 B19R2.1629747 CSc1c[nH]c2c1c(ncn2)NCCS(=O)(=O)C facee1f3979392a8c10d26af94239d77 [0,2,0,0,0,0|1,0,1]=4 1480 B19R2.1629747 CSc1c[nH]c2c1c(ncn2)NCCS(=O)(=O)N 8e1bfaea43bb91be5fc8f9df661879ac [0,2,0,0,0,0|1,0,1]=4 1481 B19R2.1629747 CSc1c[nH]c2c1c(ncn2)NCCS(=O)(=O)O 618f3240f0ac1001a14f51840c058c72 [0,2,0,0,0,0|1,0,0]=3 1482 B19R2.1629747 CSc1n[nH]c2c1c(ncn2)NCCC(C)(C)C a75617ad69d8e9a2fb1e6a79e7faaad0 [0,2,0,0,0,0|2,0,0]=4 1483 B19R2.1629747 CSc1n[nH]c2c1c(ncn2)NCCC(C)(C)O a84f3977ce5f50335bd931e6316c9fd3 [0,2,0,0,0,0|1,0,0]=3 1484 B19R2.1629747 CSc1n[nH]c2c1c(ncn2)NCCC(C)(F)F 4c798721d99fc74f702493320d3e3442 [0,2,0,0,0,0|2,0,0]=4 1485 B19R2.1629747 CSc1n[nH]c2c1c(ncn2)NCCC(F)(F)F 2cf02f2c3ee90ae193a9c5ba9d0fe82b [0,2,0,0,0,0|2,0,0]=4 1486 B19R2.1629747 CSc1n[nH]c2c1c(ncn2)NCCS(=O)(=O)O c7c716d0b73480c83cd5477bf13242be [0,2,0,0,0,0|2,0,0]=4 1487 B19R2.1629751 CCc1c[nH]c2c1c(ncn2)N(C)CCC(=O)O fec4a53b1bb77ed127308cd320d16c6c [0,2,0,0,0,0|1,0,1]=4 1488 B19R2.1629751 CCc1c[nH]c2c1c(ncn2)N(C)CCC(C)C 502473c896fb4c7b60f35ffccb2b09f0 [0,2,0,0,0,0|2,0,0]=4 1489 B19R2.1629751 CCc1c[nH]c2c1c(ncn2)N(C)CCC(C)O 8ed80cdc3dc9c73f85ce527fc6cd3d16 [0,2,0,0,0,0|1,0,0]=3 1490 B19R2.1629751 CCc1c[nH]c2c1c(ncn2)N(C)CCC(F)F 36cc85d7cf9706a090cc28603367fe97 [0,2,0,0,0,0|2,0,0]=4 1491 B19R2.1629751 CSc1c[nH]c2c1c(ncn2)N(C)CCC(=O)N c050ab5c912d9639c5c5c94309c1dc27 [0,2,0,0,0,0|0,0,2]=4 1492 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NCC(C)C(=O)O 45bb3cec4e8935488c00846f63b7541b [0,2,0,0,0,0|1,0,1]=4 1493 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NCC(F)C(=O)O 984d3fb27e31885d12236a68e7f6ae20 [0,2,0,0,0,0|1,0,1]=4 1494 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NCC(O)C(=O)O a016cb02593bc3d64d1f283a50668666 [0,2,0,0,0,0|1,0,1]=4 1495 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NCC(O)C(C)C 45df747dcd06aebda196523f2400bd5d [0,2,0,0,0,0|2,0,0]=4 1496 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NCC(O)C(F)F eaa5915b14fe954604f9a896e64798c8 [0,2,0,0,0,0|2,0,0]=4 1497 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NC[C@@H](C)C(=O)O 11644e3bed38c0fd7fc5d8b00c240969 [0,2,0,0,0,0|1,0,1]=4 1498 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NC[C@@H](O)C(=O)O 05b9645e679c8532bba91f81eb3d018a [0,2,0,0,0,0|1,0,1]=4 1499 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NC[C@H](C)C(=O)O e3c6df3af6b8e25892d78945a95ccbf7 [0,2,0,0,0,0|1,0,1]=4 1500 B19R2.2694574 CCc1c[nH]c2c1c(ncn2)NC[C@H](O)C(=O)O 1d8fa9203302534612543f2ed249d844 [0,2,0,0,0,0|1,0,1]=4 1501 B19R2.2694574 CSc1c[nH]c2c1c(ncn2)NCC(O)C(=O)O 5339148da7c07147ec0554e10e90a9b5 [0,2,0,0,0,0|0,0,1]=3 1502 B19R2.2694574 CSc1c[nH]c2c1c(ncn2)NCC(O)C(F)F c7a9815a406ba9e5a4a4ed97d3f60c0c [0,2,0,0,0,0|1,0,0]=3 1503 B19R2.2694574 CSc1c[nH]c2c1c(ncn2)NC[C@@H](O)C(=O)O 79f05e2b5ff921ba19998abe40d2ab6a [0,2,0,0,0,0|0,0,1]=3 1504 B19R2.2694574 CSc1c[nH]c2c1c(ncn2)NC[C@H](O)C(=O)O d1fcf4cc8eca2299e7243cf75bbcc086 [0,2,0,0,0,0|0,0,1]=3 1505 B19R2.2694574 CSc1n[nH]c2c1c(ncn2)NCC(C)C(=O)O 63466de7a77e075490b53ccb9f6daac6 [0,2,0,0,0,0|1,0,1]=4 1506 B19R2.2694574 CSc1n[nH]c2c1c(ncn2)NCC(C)C(C)C 2863d56f1584ec87ef22788872885e87 [0,2,0,0,0,0|2,0,0]=4 1507 B19R2.2694574 CSc1n[nH]c2c1c(ncn2)NCC(O)C(=O)O fcb9268483cc1e0aa84358bf02badc32 [0,2,0,0,0,0|1,0,1]=4 1508 B19R2.2694574 CSc1n[nH]c2c1c(ncn2)NCC(O)C(F)F 9f7efce9e9e0a6a7da87ba09fa72bfa7 [0,2,0,0,0,0|2,0,0]=4 1509 B19R2.2694574 CSc1n[nH]c2c1c(ncn2)NC[C@H](O)C(=O)O 1731afd5e6330ac38a71535d42b3784b [0,2,0,0,0,0|1,0,1]=4 1510 B19R2.2694584 CCc1c[nH]c2c1c(ncn2)N(C)CC(C)CO f3b1c0160909a1f5a307da2670c6037e [0,2,0,0,0,0|1,0,0]=3 1511 B19R2.2694584 CCc1c[nH]c2c1c(ncn2)N(C)CC(O)CC c0b92806e5b2c98d5bf8402be069d001 [0,2,0,0,0,0|2,0,0]=4 1512 B19R2.2694584 CCc1c[nH]c2c1c(ncn2)N(C)CC(O)CO 541466d904a7f8248c508757134107a8 [0,2,0,0,0,0|1,0,0]=3 1513 B19R2.2694608 CCC(CC)CNc1ncnc2c1c(n[nH]2)SC 5a289d84e116188023c562ace7630dda [0,2,0,0,0,0|2,0,0]=4 1514 B19R2.2694608 CCC(CO)CNc1ncnc2c1c(c[nH]2)C=O ebf3504432a73d6da922cff1f72d255e [0,2,0,0,0,0|2,0,0]=4 1515 B19R2.2694608 CCC(CO)CNc1ncnc2c1c(c[nH]2)CO 5a714759ec712faf22ae5a3635c49c1e [0,2,0,0,0,0|2,0,0]=4 1516 B19R2.2694608 CCC(CO)CNc1ncnc2c1c(c[nH]2)SC 98528c9812dff870bf0e1e1ae2729140 [0,2,0,0,0,0|0,0,0]=2 1517 B19R2.2694608 CCC(CO)CNc1ncnc2c1c(n[nH]2)SC afe263a244ff0b8a69f99142efc5a0bc [0,2,0,0,0,0|1,0,0]=3 1518 B19R2.2694608 CCc1c[nH]c2c1c(ncn2)NCC(CC)CC 881fc05c370988442797a535edb8dc04 [0,2,0,0,0,0|2,0,0]=4 1519 B19R2.2694608 CCc1c[nH]c2c1c(ncn2)NCC(CC)CO 1f4ee5944a163581fa4f60bb2162f524 [0,2,0,0,0,0|1,0,0]=3 1520 B19R2.2694608 CCc1c[nH]c2c1c(ncn2)NCC(CO)CO 7102add944f225dc2a92fa188a84dd35 [0,2,0,0,0,0|1,0,0]=3 1521 B19R2.2694608 CCc1c[nH]c2c1c(ncn2)NC[C@H](CO)OC 269fed15bff7c6744b72cf6eddc04602 [0,2,0,0,0,0|1,0,0]=3 1522 B19R2.2694608 CO[C@@H](CO)CNc1ncnc2c1c(c[nH]2)C=O c21ddfca7c340e588a27f531f884b0c0 [0,2,0,0,0,0|2,0,0]=4 1523 B19R2.2694608 CO[C@@H](CO)CNc1ncnc2c1c(c[nH]2)SC 003e769d8d4987d1419726f21218c342 [0,2,0,0,0,0|0,0,0]=2 1524 B19R2.2694608 CSc1c[nH]c2c1c(ncn2)NCC(CO)CO 0c74d1a82e714655e831d47718808245 [0,2,0,0,0,0|0,0,0]=2 1525 B19R2.2694608 OCc1c[nH]c2c1c(ncn2)NCC(CO)CO 3c82b2faa1ba5f0ba76b9c448ab68329 [0,2,0,0,0,0|2,0,0]=4 1526 B19R2.7572209 CCc1c[nH]c2c1c(ncn2)NCC(C)(C)CC e2263d873cd0f18fb393254dc8f0c59c [0,2,0,0,0,0|2,0,0]=4 1527 B19R2.7572209 CCc1c[nH]c2c1c(ncn2)NCC(C)(C)CF ca67c7992779ccff657e7839cd8063bb [0,2,0,0,0,0|2,0,0]=4 1528 B19R2.7572209 CCc1c[nH]c2c1c(ncn2)NCC(C)(C)CO 79d40fe2adac06365942a884a8ffe921 [0,2,0,0,0,0|1,0,0]=3 1529 B19R2.7572209 CCc1c[nH]c2c1c(ncn2)NCC(C)(O)CC c90b09caa3828f943e7e796bf7858494 [0,2,0,0,0,0|2,0,0]=4 1530 B19R2.7572209 CCc1c[nH]c2c1c(ncn2)NCC(F)(F)CO 30b907cf7f7adc940f5d107749af254a [0,2,0,0,0,0|1,0,0]=3 1531 B19R2.7572209 CSc1c[nH]c2c1c(ncn2)NCC(C)(C)CF b0bb2bfdfa48db75557f19f0ded40eaa [0,2,0,0,0,0|1,0,0]=3 1532 B19R2.7572209 CSc1c[nH]c2c1c(ncn2)NCC(F)(F)CO ddca4526db2973faa9d9b2d2638bf64a [0,2,0,0,0,0|0,0,0]=2 1533 B19R2.7572209 CSc1n[nH]c2c1c(ncn2)NCC(C)(C)CO 3271e21ff9056a5daec43f158b9e0d44 [0,2,0,0,0,0|1,0,0]=3 1534 B19R2.3208500 CCCCN(CC)c1ncnc2c1c(c[nH]2)CC 91b8b95d708cff626c2aac6192cb6259 [0,2,0,0,0,0|2,0,0]=4 1535 B19R2.3208500 CCCCN(CC)c1ncnc2c1c(c[nH]2)SC baeacdd6ecfb1e6ae69602c4f82075b5 [0,2,0,0,0,0|1,0,0]=3 1536 B19R2.3208500 CCN(CCCO)c1ncnc2c1c(c[nH]2)CO b1974b18af9c8694cf8c100e36c6acb4 [0,2,0,0,0,0|2,0,0]=4 1537 B19R2.3208500 CCN(CCCO)c1ncnc2c1c(c[nH]2)SC 324775278617e1b6d66f8a6535b461af [0,2,0,0,0,0|0,0,0]=2 1538 B19R2.3208500 CCN(CCOC)c1ncnc2c1c(c[nH]2)SC 267b67fb78dc12ac4d8f8d4e2b013e93 [0,2,0,0,0,0|2,0,0]=4 1539 B19R2.3208500 CCc1c[nH]c2c1c(ncn2)N(CC)CCCO f946a4a20f386821ec87736168b31835 [0,2,0,0,0,0|1,0,0]=3 1540 B17R2.270 OCCCNc1cc(ncn1)n2cccn2 d5bc9c945b1dfaa353d00cc41ddee693 [0,0,1,1,0,0|2,0,0]=4 1541 B17R2.270 OCCCNc1cc(ncn1)n2ccnc2 5328aec37e57d1b378fc596ed0c2dd1c [0,0,1,1,0,0|1,0,1]=4 1542 B17R2.86719 CSc1nc2ncnc(n2n1)NCCCO c7834a942718983eeb40a8f7c6068256 [0,0,1,1,0,0|2,0,0]=4 1543 B17R2.86756 Cc1ccc2ncnc(c2c1)NCCCO bffe1197a877ea3b6cc58e10c79923e9 [0,0,1,1,0,0|2,0,0]=4 1544 B17R2.12097 CCCCNc1nc(c2[nH]cnc2n1)SC 7e911ecb290735e72a2434fc7dbd356d [0,0,1,1,0,0|2,0,0]=4 1545 B17R2.12097 CSc1nc(nc2c1[nH]cn2)NCCCF 87f932df774cc1e4009ec0e8dc3d14b2 [0,0,1,1,0,0|2,0,0]=4 1546 B17R2.12097 CSc1nc(nc2c1[nH]cn2)NCCCO 3ed132d96e9292850ceeb8bb0d130d97 [0,0,1,1,0,0|1,0,0]=3 1547 B17R2.12097 CSc1nc(nc2c1[nH]cn2)NCCCS 847e6ac82929007fc4d38ef2191ef651 [0,0,1,1,0,0|1,1,0]=4 1548 B17R3.274313 Cc1c[nH]c2c1c(ccn2)NC3CCC3 7cd5be17dca701673d87404956c187fb [1,0,0,1,0,0|2,0,0]=4 1549 B17R3.274313 Cc1c[nH]c2c1c(ncn2)NC3CCC3 cad01777c977bde059b46be7a61cab6c [1,0,0,1,0,0|1,0,0]=3 1550 B17R3.274313 Cc1c[nH]c2c1c(ncn2)NC3COC3 6ec869ae8a1f884a4af43bd3ea418625 [1,0,0,1,0,0|2,0,0]=4 1551 B17R3.274313 Cc1n[nH]c2c1c(ncn2)NC3CCC3 aa795ec5a41cb302ee8c8bd0ebcc25f5 [1,0,0,1,0,0|2,0,0]=4 1552 B17R3.274313 Clc1c[nH]c2c1c(ncn2)NC3CCC3 9cc996351698a93aa5d1ef52c17a7e7f [1,0,0,1,0,0|2,0,0]=4 1553 B17R3.274313 Fc1c[nH]c2c1c(ncn2)NC3CCC3 be48022654dd5d44f683147a73b59001 [1,0,0,1,0,0|2,0,0]=4 1554 B17R3.274313 Ic1c[nH]c2c1c(ncn2)NC3CCC3 f17da09bafe508d4615429e00b43e65d [1,0,0,1,0,0|2,0,0]=4 1555 B17R3.274315 Brc1c[nH]c2c1c(ncn2)NCC3CC3 c2276e157dde7d88f5e5b27b7aba0cf6 [1,0,0,1,0,0|2,0,0]=4 1556 B17R3.274315 Cc1c[nH]c2c1c(ccn2)NCC3CC3 9f49021bfe2260cead84babcdf9f6322 [1,0,0,1,0,0|2,0,0]=4 1557 B17R3.274315 Cc1c[nH]c2c1c(ncn2)NCC3CC3 ee95d025d677b58b68f3d8a0f80f3460 [1,0,0,1,0,0|1,0,0]=3 1558 B17R3.274315 Cc1coc2c1c(ncn2)NCC3CC3 df5c63478474aa4288aefaf09c372f04 [1,0,0,1,0,0|2,0,0]=4 1559 B17R3.274315 Cc1n[nH]c2c1c(ncn2)NCC3CC3 42e01c227bec00e97dd4580e172fb90c [1,0,0,1,0,0|2,0,0]=4 1560 B17R3.274315 Clc1c[nH]c2c1c(ncn2)NCC3CC3 fcfe9e7217db0c86c7b978c8f8a6c4cc [1,0,0,1,0,0|2,0,0]=4 1561 B17R3.274315 Fc1c[nH]c2c1c(ncn2)NCC3CC3 b25f95f85635cf168dfeb5ea9d29a0ac [1,0,0,1,0,0|2,0,0]=4 1562 B17R3.274315 Ic1c[nH]c2c1c(ncn2)NCC3CC3 f8f3a03b3bca2f65752d9601a609b9d8 [1,0,0,1,0,0|2,0,0]=4 1563 B19R3.1770214 OCCCNc1ncnc2c1c3c(s2)CCC3 5bdf15d410581b36e26b1229805587f0 [0,1,0,1,0,0|2,0,0]=4 1564 B19R3.1770534 OCCCNc1ncnc2c1c(cs2)C3CC3 dbb1c5a8a263b615cd7be6a86fdc78d7 [0,1,0,1,0,0|2,0,0]=4 1565 B19R3.1703882 CC(=O)c1c[nH]c2c1c(ncn2)NC3CC3C 85f27041cca4073978f2141ec312ab19 [0,1,0,1,0,0|2,0,0]=4 1566 B19R3.1703882 CC(=O)c1c[nH]c2c1c(ncn2)N[C@@H]3C[C@H]3F ccfb235774e23c412f9bfe489e1dbcb9 [0,1,0,1,0,0|2,0,0]=4 1567 B19R3.1703882 CC(=O)c1c[nH]c2c1c(ncn2)N[C@H]3C[C@@H]3F 58be9a8d8e5f7e864d8a45cdbfed45e7 [0,1,0,1,0,0|2,0,0]=4 1568 B19R3.1703882 CC(=O)c1c[nH]c2c1c(ncn2)N[C@H]3C[C@H]3F 73c05a38b429b356bc176f0957f451c5 [0,1,0,1,0,0|2,0,0]=4 1569 B19R3.10688882 CC(=O)c1c[nH]c2c1c(ncn2)NC3CCC3 e61ba2a4450d115597625a2f4f0be67a [0,1,0,1,0,0|2,0,0]=4 1570 B19R3.10688883 CC(=O)c1c[nH]c2c1c(ncn2)NCC3CC3 d27260473951c58f2900a41045475133 [0,1,0,1,0,0|2,0,0]=4 1571 B19R3.10688883 CS(=O)c1c[nH]c2c1c(ncn2)NCC3CC3 ce5364d59e8bc6f4dff96d43d2e6ba64 [0,1,0,1,0,0|1,0,1]=4 1572 B19R3.1521754 CCc1c[nH]c2c1c(ncn2)NC3CCSC3 b7b3a04e78a27b2630a7c2328e551cf4 [0,1,0,1,0,0|1,1,0]=4 1573 B19R3.1521754 CSc1n[nH]c2c1c(ncn2)NC3CCCC3 517756feb6e4d6189b528652b19b96c5 [0,1,0,1,0,0|2,0,0]=4 1574 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)NC3CCC3F 9a896b7502bba4b3548be00d3a2a9422 [0,1,0,1,0,0|2,0,0]=4 1575 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)NC3CCC3O 12b9a3c3660f5e670d5fea95b7fb9a01 [0,1,0,1,0,0|1,0,0]=3 1576 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)NC3COC3C 342546d0cb30a200eeff8500929a0655 [0,1,0,1,0,0|2,0,0]=4 1577 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)N[C@@H]3CC[C@@H]3O a5d1e4297558d9301710c39ca6576821 [0,1,0,1,0,0|1,0,0]=3 1578 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)N[C@@H]3CC[C@H]3O ec58be7d12d6eef24c80569adb18e7a6 [0,1,0,1,0,0|1,0,0]=3 1579 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)N[C@H]3CC[C@@H]3O 57686325cc18dbf8bac263e09b7412dd [0,1,0,1,0,0|1,0,0]=3 1580 B19R3.3575139 CCc1c[nH]c2c1c(ncn2)N[C@H]3CC[C@H]3O 4a84f01f0cbacf6bf572f673b8a482af [0,1,0,1,0,0|1,0,0]=3 1581 B19R3.3575139 CSc1c[nH]c2c1c(ncn2)N[C@H]3CNC3=O fb0023919ce362beab8524c744e98459 [0,1,0,1,0,0|0,0,2]=4 1582 B19R3.3575139 CSc1n[nH]c2c1c(ncn2)NC3CCC3=O 1338c51eb8e8aae45d97cf1ce4994d01 [0,1,0,1,0,0|1,0,1]=4 1583 B19R3.3575141 CCc1c[nH]c2c1c(ncn2)N[C@@H]3C[C@@H]3OC e061ce2c2980fabef3ad6317475d771b [0,1,0,1,0,0|1,0,0]=3 1584 B19R3.3575141 CCc1c[nH]c2c1c(ncn2)N[C@@H]3C[C@H]3CO 3cc005630d3da2bc7df53737e6c4ecee [0,1,0,1,0,0|1,0,0]=3 1585 B19R3.3575141 CCc1c[nH]c2c1c(ncn2)N[C@H]3C[C@@H]3CO 9efb2c5883b890095aa5273f25cd4662 [0,1,0,1,0,0|1,0,0]=3 1586 B19R3.3575141 CCc1c[nH]c2c1c(ncn2)N[C@H]3C[C@H]3CO 687b1d6e087ce93b63e99b71bac3f378 [0,1,0,1,0,0|1,0,0]=3 1587 B19R3.3575141 CSc1n[nH]c2c1c(ncn2)NC3CC3C=O 37ca39d59231ce0792fb68b8628be4ed [0,1,0,1,0,0|1,0,1]=4 1588 B19R3.3575143 CCc1c[nH]c2c1c(ncn2)NCCC3CC3 cf6e1de34599932c403fceb40d746bf3 [0,1,0,1,0,0|2,0,0]=4 1589 B19R3.3575143 CCc1c[nH]c2c1c(ncn2)NCCN3CC3 1016ffe608967d46c9ed4188af278899 [0,1,0,1,0,0|2,0,0]=4 1590 B19R3.3575143 CSc1c[nH]c2c1c(ncn2)NCCN3CC3 204a64a24ad30c37e5745d83b9629c71 [0,1,0,1,0,0|1,0,0]=3 1591 B19R3.3575143 CSc1n[nH]c2c1c(ncn2)NCCC3CC3 e0b133f16b644c891374b31493adb61c [0,1,0,1,0,0|2,0,0]=4 1592 B19R3.3575148 CCc1c[nH]c2c1c(ncn2)NCC3CCC3 8527aed2a84bcb39739287a4e44898e3 [0,1,0,1,0,0|2,0,0]=4 1593 B19R3.3575148 CCc1c[nH]c2c1c(ncn2)NCC3CCO3 7fd5fa51ac7e435cc5f8492e23d975bb [0,1,0,1,0,0|1,0,0]=3 1594 B19R3.3575148 CCc1c[nH]c2c1c(ncn2)NCC3COC3 0fbc5190ea8dac1253c1a947bb419f76 [0,1,0,1,0,0|1,0,0]=3 1595 B19R3.3575148 CCc1c[nH]c2c1c(ncn2)NC[C@@H]3CCO3 c9ffb2d767912b69424df336090fa235 [0,1,0,1,0,0|1,0,0]=3 1596 B19R3.3575148 CCc1c[nH]c2c1c(ncn2)NC[C@H]3CCO3 b2c269259b1d11fa9115571df3b25a4a [0,1,0,1,0,0|1,0,0]=3 1597 B19R3.3575148 CSc1c[nH]c2c1c(ncn2)NCC3COC3 f7db9e8fddc276550f837aa034409975 [0,1,0,1,0,0|0,0,0]=2 1598 B19R3.3575148 CSc1n[nH]c2c1c(ncn2)NCC3CCC3 74e8308bb25e6ea638f380bf2292573d [0,1,0,1,0,0|2,0,0]=4 1599 B19R3.3575148 CSc1n[nH]c2c1c(ncn2)NCC3CCO3 26de1fd6dc44478dbd8468e7cc61b6b2 [0,1,0,1,0,0|1,0,0]=3 1600 B19R3.3575148 CSc1n[nH]c2c1c(ncn2)NCC3COC3 ab6ef6aaac77b20dc1badfa478e0d238 [0,1,0,1,0,0|1,0,0]=3 1601 B19R3.3575148 CSc1n[nH]c2c1c(ncn2)NC[C@@H]3CCO3 d09b7f7a1169616fe8328ffbaa8569bd [0,1,0,1,0,0|1,0,0]=3 1602 B19R3.3575148 CSc1n[nH]c2c1c(ncn2)NC[C@H]3CCO3 2ad097d0861a740d199ed353562d16a9 [0,1,0,1,0,0|1,0,0]=3 1603 B19R3.3575148 O=Cc1c[nH]c2c1c(ncn2)NCC3CCO3 6f3e17d2d9a5a7418e73dbc4846feed2 [0,1,0,1,0,0|2,0,0]=4 1604 B19R3.3575148 O=Cc1c[nH]c2c1c(ncn2)NCC3COC3 e004e3a3bf3fd0eae81e463fa255ffa3 [0,1,0,1,0,0|2,0,0]=4 1605 B19R3.3575148 O=Cc1c[nH]c2c1c(ncn2)NC[C@@H]3CCO3 f6e765c9965a2a7ff593c6542b23409d [0,1,0,1,0,0|2,0,0]=4 1606 B19R3.3575148 O=Cc1c[nH]c2c1c(ncn2)NC[C@H]3CCO3 8b72aa4b5dd2e6c239d88e4e1658f5f7 [0,1,0,1,0,0|2,0,0]=4 1607 B19R3.3575148 OCc1c[nH]c2c1c(ncn2)NCC3CCO3 d98d454ebd5bf4ef9362d8f59b733f41 [0,1,0,1,0,0|2,0,0]=4 1608 B19R3.3575148 OCc1c[nH]c2c1c(ncn2)NCC3COC3 cbf46216c9f977b842c7dae2ea210480 [0,1,0,1,0,0|2,0,0]=4 1609 B19R3.3575148 OCc1c[nH]c2c1c(ncn2)NC[C@@H]3CCO3 2a1056f104af600feeb20634db294acb [0,1,0,1,0,0|2,0,0]=4 1610 B19R3.3575148 OCc1c[nH]c2c1c(ncn2)NC[C@H]3CCO3 4d911200fef755db3cf2bd449ec140c5 [0,1,0,1,0,0|2,0,0]=4 1611 B19R3.3575144 CCc1c[nH]c2c1c(ncn2)N[C@@H](C)C3CC3 486f442cfe7590aed9b9f6b3a3c35088 [0,1,0,1,0,0|2,0,0]=4 1612 B19R3.3575144 CCc1c[nH]c2c1c(ncn2)N[C@H](C)C3CC3 1c871ee50bbcd20121ecd22b050b7ac5 [0,1,0,1,0,0|2,0,0]=4 1613 B19R3.3575144 CSc1c[nH]c2c1c(ncn2)N[C@@H](C)C3CC3 27b5306bcebf8249b97031c50eaae5b7 [0,1,0,1,0,0|1,0,0]=3 1614 B19R3.3575144 CSc1c[nH]c2c1c(ncn2)N[C@H](C)C3CC3 7933580649016b035303ede95232a148 [0,1,0,1,0,0|1,0,0]=3 1615 B19R3.3575144 CSc1n[nH]c2c1c(ncn2)NC(C)C3CC3 1959467a5602367a223ac14bdb281e43 [0,1,0,1,0,0|2,0,0]=4 1616 B19R3.3580088 CCc1c[nH]c2c1c(ncn2)NC3CC3(C)C 1a991e677bf49fd11541a12dd458bbfa [0,1,0,1,0,0|2,0,0]=4 1617 B19R3.3580088 CCc1c[nH]c2c1c(ncn2)NC3CC3(F)F f50f8945810ecff92037814f5beb0eb6 [0,1,0,1,0,0|2,0,0]=4 1618 B19R3.3580088 CCc1c[nH]c2c1c(ncn2)N[C@@H]3CC3(C)C 6dcc8a0ea1e27b41c003914ed6e7fcc4 [0,1,0,1,0,0|2,0,0]=4 1619 B19R3.3580088 CCc1c[nH]c2c1c(ncn2)N[C@H]3CC3(C)C d3dc8af38b19f9a2441e3fff9188d19c [0,1,0,1,0,0|2,0,0]=4 1620 B19R3.3580088 CSc1n[nH]c2c1c(ncn2)NC3CC3(C)C 8cfaaa10b77d61f924f898f24f114aea [0,1,0,1,0,0|2,0,0]=4 1621 B19R3.3580088 CSc1n[nH]c2c1c(ncn2)NC3CC3(F)F 45c68d548bfb6a281d8aceb2a738e017 [0,1,0,1,0,0|2,0,0]=4 1622 B19R3.3580087 CCc1c[nH]c2c1c(ncn2)NCC3(CC3)O f3b7d04de0c975c78a42fff3ce733baa [0,1,0,1,0,0|2,0,0]=4 1623 B19R3.3580087 CSc1n[nH]c2c1c(ncn2)NCC3(CC3)C 699a2451cc44b673d9dd6c0aca5e84fd [0,1,0,1,0,0|2,0,0]=4 1624 B19R3.3580087 CSc1n[nH]c2c1c(ncn2)NCC3(CC3)F 1b297c3ed35eb76c60c65c146cae8f1f [0,1,0,1,0,0|2,0,0]=4 1625 B19R3.3575115 CCc1c[nH]c2c1c(ncn2)N(C)CC3CC3 9043a49edbc962136f82fe23da88da2d [0,1,0,1,0,0|2,0,0]=4 1626 B17R2.342031 CCCNc1ncnc2c1c(ccc2)OC dd1b66e29bbccf4662d6d12af89dcea3 [1,0,0,0,0,1|1,1,0]=4 1627 B17R2.342031 COc1cccc2c1c(ncn2)NCCO fe1f14be0bc5411fda40d688f6cba449 [1,0,0,0,0,1|1,1,0]=4 1628 B17R2.342035 CCCNc1ncnc2c1cc(cc2)OC 83548237bb5f4424f699bf5c33cc6d74 [1,0,0,0,0,1|1,1,0]=4 1629 B17R2.342035 COc1ccc2ncnc(c2c1)NCCO 556d03e5b7d6a471f85e65c782bcd6cd [1,0,0,0,0,1|1,1,0]=4 1630 B17R2.298733 CCCCNc1ccc2[nH]cc(c2c1)SC 81380b0c2ae487d72e208736d0d8bbde [0,0,0,0,1,1|2,0,0]=4 1631 B17R2.298733 COc1n[nH]c2c1cc(cn2)NCCCO 5b9ee298476afa7df0d79c0d138c1dc9 [0,0,0,0,1,1|1,1,0]=4 1632 B17R2.298733 CSc1c[nH]c2c1cc(cc2)NCCCF 16a19b1c20c71d4d2c7f418dbd9efe94 [0,0,0,0,1,1|2,0,0]=4 1633 B17R2.298733 CSc1c[nH]c2c1cc(cc2)NCCCO ce173af182218a4423534d1db464379e [0,0,0,0,1,1|1,0,0]=3 1634 B17R2.298733 CSc1c[nH]c2c1cc(cc2)NCCCS ac52452146e1edc70240b22a5536532e [0,0,0,0,1,1|1,1,0]=4