CFam Chemical Families Database
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You are searching for "CFAMM00007041" in compound.

Total 1 results found.

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 CFAMM00007041
Family CFFAD24 Beta adrenergic receptor ligand monosubstituted indole derivative Pindolol family
Superfamily CFSAD24 Beta adrenergic receptor ligand monosubstituted indole derivative Pindolol Superfamily
Class CFCAD24 Class 24
External ID 252139 External Source PubChem
PubChem CID 252139 Functional Category Patent Compound
Molecule Name 5-BENZYLOXYINDOLE-3-ACETONITRILE
IUPAC Name 2-(5-phenylmethoxy-1H-indol-3-yl)acetonitrile
Synonyms 2436-15-9;[5-(benzyloxy)-1h-indol-3-yl]acetonitrile;2-[5-(benzyloxy)-1H-indol-3-yl]acetonitrile;SBB067120;5-Benzyloxy-3-indoleacetonitrile;2820-44-2;2-(5-(benzyloxy)-1H-indol-3-yl)acetonitrile;NSC73391;PubChem20626;AC1L5LCH
InChi InChI=1S/C17H14N2O/c18-9-8-14-11-19-17-7-6-15(10-16(14)17)20-12-13-4-2-1-3-5-13/h1-7,10-11,19H,8,12H2
InChiKey ADPRFNVFBYHCJQ-UHFFFAOYSA-N
Formula C17H14N2O Molecular Weight 262.31
Cross Link CHEMBL1288718
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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