CFam Chemical Families Database
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You are searching for "CFAMM00113802" in compound.

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CFAM Mol ID CFAMM00113802
Family CFFAD940 Prothrombin Inhibitor Ximelegatran Family
Superfamily CFSAD791 Prothrombin Inhibitor Ximelegatran Superfamily
Class CFCAD705 Class 705
External ID 19081204 External Source PubChem
PubChem CID 19081204 Functional Category Patent Compound
Molecule Name AGN-PC-023GQJ
IUPAC Name 3-amino-5-cyclohexyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one
Synonyms SureCN8534282;3-amino-5-cyclohexyl-1-(pyridin-2-ylmethyl)-3H-1,4-benzodiazepin-2-one
InChi InChI=1S/C21H24N4O/c22-20-21(26)25(14-16-10-6-7-13-23-16)18-12-5-4-11-17(18)19(24-20)15-8-2-1-3-9-15/h4-7,10-13,15,20H,1-3,8-9,14,22H2
InChiKey WVZYDYIADZPCQL-UHFFFAOYSA-N
Formula C21H24N4O Molecular Weight 348.44
Cross Link
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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