CFam Chemical Families Database
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You are searching for "CFAMM00492390" 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 CFAMM00492390
Family CFFBM30663 Neuronal acetylcholine receptor subunit alpha-4 and Neuronal acetylcholine receptor subunit beta-2 ligand 4-(1,3-benzodioxol-5-yl)-1,1-dimethylpiperazin-1-ium;iodide family
Superfamily CFSBM1768 Prelamin-A/C and DNA polymerase beta Binder Superfamily 4
Class CFCBM365 Class 3415
External ID CHEMBL129232 External Source CHEMBL
PubChem CID 11057543 Functional Category Bioactive
Molecule Name 4-(1,3-benzodioxol-5-yl)-1,1-dimethylpiperazin-1-ium;iodide
IUPAC Name 4-(1,3-benzodioxol-5-yl)-1,1-dimethylpiperazin-1-ium;iodide
Synonyms CHEBI:311923
InChi InChI=1S/C13H19N2O2.HI/c1-15(2)7-5-14(6-8-15)11-3-4-12-13(9-11)17-10-16-12;/h3-4,9H,5-8,10H2,1-2H3;1H/q+1;/p-1
InChiKey RHVRPXCNLMPAHC-UHFFFAOYSA-M
Formula C13H19N2O2.I Molecular Weight 362.21
Cross Link CHEMBL129232
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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