CFam Chemical Families Database
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You are searching for "CFAMM00381316" 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 CFAMM00381316
Family CFFBM7574 Endothelin-1 receptor ligand SureCN8118632 family
Superfamily CFSBM4212 Integrin beta-3 and Integrin alpha-IIb Binder Superfamily 10
Class CFCID665 Class 2015
External ID 57162108 External Source PubChem
PubChem CID 57162108 Functional Category Patent Compound
Molecule Name AGN-PC-0BOM8Q
IUPAC Name 2-(3-hydroxy-5-pyridin-3-ylpentan-2-yl)oxy-6-(2-morpholin-4-ylethoxy)-3-phenylbenzonitrile
Synonyms 2-(3-hydroxy-5-pyridin-3-ylpentan-2-yl)oxy-6-(2-morpholin-4-ylethoxy)-3-phenylbenzonitrile
InChi InChI=1S/C29H33N3O4/c1-22(27(33)11-9-23-6-5-13-31-21-23)36-29-25(24-7-3-2-4-8-24)10-12-28(26(29)20-30)35-19-16-32-14-17-34-18-15-32/h2-8,10,12-13,21-22,27,33H,9,11,14-19H2,1H3
InChiKey AXLUUYVAHAISRL-UHFFFAOYSA-N
Formula C29H33N3O4 Molecular Weight 487.59
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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