CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00224497" 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 CFAMM00224497
Family CFFID997 Alpha-1A adrenergic receptor and Alpha-1D adrenergic receptor Ligand 4-methoxyamphetamine Family
Superfamily CFSID820 Alpha-1D adrenergic receptor and Alpha-1A adrenergic receptor Binder Superfamily
Class CFCCD413 Class 1226
External ID 14581319 External Source PubChem
PubChem CID 14581319 Functional Category Patent Compound
Molecule Name AGN-PC-001VZZ
IUPAC Name 1-(3-isothiocyanatopropyl)-4-methoxybenzene
Synonyms ZINC09246090;AKOS000343564;Benzene, 1-(3-isothiocyanatopropyl)-4-methoxy-
InChi InChI=1S/C11H13NOS/c1-13-11-6-4-10(5-7-11)3-2-8-12-9-14/h4-7H,2-3,8H2,1H3
InChiKey MMBGXXXYAGBNLL-UHFFFAOYSA-N
Formula C11H13NOS Molecular Weight 207.29
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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