CFam Chemical Families Database
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You are searching for "CFAMM00296752" in compound.

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CFAM Mol ID CFAMM00296752
Family CFFID3726 Amine oxidase [flavin-containing] A and Amine oxidase [flavin-containing] B Inhibitor N-methyl,n-(propargyl),n-(pyrrol-2-ylmethyl)amine Family
Superfamily CFSID2555 Amine oxidase [flavin-containing] A and Amine oxidase [flavin-containing] B Inhibitor N-methyl,n-(propargyl),n-(pyrrol-2-ylmethyl)amine Superfamily
Class CFCAD713 Class 713
External ID 53883958 External Source PubChem
PubChem CID 53883958 Functional Category Patent Compound
Molecule Name AGN-PC-0A01TF
IUPAC Name 2-cyanopropan-2-yl 1H-pyrrole-2-carbodithioate
Synonyms 2-cyanopropan-2-yl 1H-pyrrole-2-carbodithioate
InChi InChI=1S/C9H10N2S2/c1-9(2,6-10)13-8(12)7-4-3-5-11-7/h3-5,11H,1-2H3
InChiKey HLUODMDLINXNKK-UHFFFAOYSA-N
Formula C9H10N2S2 Molecular Weight 210.32
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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