CFam Chemical Families Database
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You are searching for "CFAMM00407889" 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 CFAMM00407889
Family CFFBM11255 Muscarinic acetylcholine receptor M2 and Muscarinic acetylcholine receptor M4 ligand (1-cyclohexylpiperidin-4-yl)-[4-(4-methoxyphenyl)sulfonylphenyl]methanone family
Superfamily CFSID1929 D(3) dopamine receptor Ligand GR-218231 Superfamily
Class CFCID81 Class 1431
External ID CHEMBL92110 External Source CHEMBL
PubChem CID 9871136 Functional Category Bioactive
Molecule Name ethyl 4-[4-[4-(4-methoxyphenyl)sulfonylbenzoyl]piperidin-1-yl]piperidine-1-carboxylate
IUPAC Name ethyl 4-[4-[4-(4-methoxyphenyl)sulfonylbenzoyl]piperidin-1-yl]piperidine-1-carboxylate
Synonyms CHEBI:249341
InChi InChI=1S/C27H34N2O6S/c1-3-35-27(31)29-18-14-22(15-19-29)28-16-12-21(13-17-28)26(30)20-4-8-24(9-5-20)36(32,33)25-10-6-23(34-2)7-11-25/h4-11,21-22H,3,12-19H2,1-2H3
InChiKey YWVQHLDAZWKISG-UHFFFAOYSA-N
Formula C27H34N2O6S Molecular Weight 514.63
Cross Link CHEMBL92110
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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