CFam Chemical Families Database
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You are searching for "CFAMM00435635" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00435635
Family CFFBM15698 Coagulation factor X inhibitor 3-Oxybenzamide 48 family
Superfamily CFSBM4797 C-C chemokine receptor type 5 and Coagulation factor X Binder Superfamily
Class CFCID302 Class 1652
External ID CHEMBL366158 External Source CHEMBL
PubChem CID 23646476 Functional Category Bioactive
Molecule Name 3-Oxybenzamide 55
IUPAC Name [2-bromo-3-[2-(2,4-dichlorophenyl)ethoxy]-5-[(1-pyridin-4-ylpiperidin-4-yl)methylcarbamoyl]phenyl] acetate
Synonyms AGN-PC-046QJU;[2-bromo-3-[2-(2,4-dichlorophenyl)ethoxy]-5-[(1-pyridin-4-ylpiperidin-4-yl)methylcarbamoyl]phenyl] acetate
InChi InChI=1S/C28H28BrCl2N3O4/c1-18(35)38-26-15-21(14-25(27(26)29)37-13-8-20-2-3-22(30)16-24(20)31)28(36)33-17-19-6-11-34(12-7-19)23-4-9-32-10-5-23/h2-5,9-10,14-16,19H,6-8,11-13,17H2,1H3,(H,33,36)
InChiKey AFXSBHYPZXEQNT-UHFFFAOYSA-N
Formula C28H28BrCl2N3O4 Molecular Weight 621.35
Cross Link CHEMBL366158
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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