CFam Chemical Families Database
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You are searching for "CFAMM00374304" in compound.

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CFAM Mol ID CFAMM00374304
Family CFFBM6684 Acetylcholinesterase inhibitor AC1MIM21 family
Superfamily CFSBM36 Acetylcholinesterase Binder Superfamily 2
Class CFCCD39 Class 852
External ID CHEMBL407491 External Source CHEMBL
PubChem CID 833346 Functional Category Bioactive
Molecule Name AN-329/41561658
IUPAC Name N-(azepane-1-carbothioyl)-4-tert-butylbenzamide
Synonyms ZINC00358804;AC1LH73H;MLS001124909;ARONIS006115;REGID_for_CID_833346;MolPort-000-322-130;HMS2973P05;STK120438;AKOS000495489
InChi InChI=1S/C18H26N2OS/c1-18(2,3)15-10-8-14(9-11-15)16(21)19-17(22)20-12-6-4-5-7-13-20/h8-11H,4-7,12-13H2,1-3H3,(H,19,21,22)
InChiKey HFOYLHJEUBNVOH-UHFFFAOYSA-N
Formula C18H26N2OS Molecular Weight 318.48
Cross Link CHEMBL407491
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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