CFam Chemical Families Database
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You are searching for "CFAMM00112536" 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 CFAMM00112536
Family CFFAD909 Nicotinic acetylcholine receptor Ligand Benztropine Mesylate Family
Superfamily CFSAD765 Nicotinic acetylcholine receptor Ligand Benztropine Mesylate Superfamily
Class CFCAD682 Class 682
External ID CHEMBL141251 External Source CHEMBL
PubChem CID 10600218 Functional Category Bioactive
Molecule Name SureCN4189557
IUPAC Name N-[[(2S)-1-[2-[bis(4-fluorophenyl)methoxy]ethyl]pyrrolidin-2-yl]methyl]-3-phenylpropan-1-amine
Synonyms CHEBI:336816
InChi InChI=1S/C29H34F2N2O/c30-26-14-10-24(11-15-26)29(25-12-16-27(31)17-13-25)34-21-20-33-19-5-9-28(33)22-32-18-4-8-23-6-2-1-3-7-23/h1-3,6-7,10-17,28-29,32H,4-5,8-9,18-22H2/t28-/m0/s1
InChiKey RNMMMKSJGRTVQB-NDEPHWFRSA-N
Formula C29H34F2N2O Molecular Weight 464.59
Cross Link CHEMBL141251
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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