CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00433734" 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 CFAMM00433734
Family CFFBM15376 Muscarinic acetylcholine receptor M2 and Muscarinic acetylcholine receptor M3 ligand ethyl 4-[4-[1-[4-(4-methoxyphenyl)sulfonylphenyl]ethenyl]piperidin-1-yl]piperidine-1-carboxylate family
Superfamily CFSID1929 D(3) dopamine receptor Ligand GR-218231 Superfamily
Class CFCID81 Class 1431
External ID CHEMBL94247 External Source CHEMBL
PubChem CID 15453419 Functional Category Bioactive
Molecule Name AGN-PC-00PA9E
IUPAC Name ethyl 4-[4-[2-[4-(4-methoxyphenyl)sulfonylphenyl]-1,3-dithiolan-2-yl]piperidin-1-yl]piperidine-1-carboxylate
Synonyms CHEBI:248868;ethyl 4-[4-[2-[4-(4-methoxyphenyl)sulfonylphenyl]-1,3-dithiolan-2-yl]piperidin-1-yl]piperidine-1-carboxylate
InChi InChI=1S/C29H38N2O5S3/c1-3-36-28(32)31-18-14-24(15-19-31)30-16-12-23(13-17-30)29(37-20-21-38-29)22-4-8-26(9-5-22)39(33,34)27-10-6-25(35-2)7-11-27/h4-11,23-24H,3,12-21H2,1-2H3
Formula C29H38N2O5S3 Molecular Weight 590.82
Cross Link CHEMBL94247

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).

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National University of Singapore, Singapore

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