CFam Chemical Families Database
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You are searching for "CFAMM00309642" 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 CFAMM00309642
Family CFFBM263 C-C chemokine receptor type 5 ligand AC1LAJBP family
Superfamily CFSBM162 5-hydroxytryptamine receptor 6 and Cytochrome P450 3A4 Binder Superfamily
Class CFCCD54 Class 867
External ID CHEMBL326111 External Source CHEMBL
PubChem CID 489307 Functional Category Bioactive
Molecule Name AC1LAJBM
IUPAC Name N-[4-[4-hydroxy-4-(3-phenylpropyl)piperidin-1-yl]-2-phenylbutyl]-N-methyl-5-pyridin-2-ylthiophene-2-sulfonamide
Synonyms CHEBI:274393;2-Thiophenesulfonamide, N-[4-[4-hydroxy-4-(3-phenylpropyl)-1-piperidinyl]-2-phenylbutyl]-N-methyl-5-(2-pyridinyl)-;N-[4-[4-hydroxy-4-(3-phenylpropyl)piperidin-1-yl]-2-phenylbutyl]-N-methyl-5-pyridin-2-ylthiophene-2-sulfonamide
InChi InChI=1S/C34H41N3O3S2/c1-36(42(39,40)33-18-17-32(41-33)31-16-8-9-23-35-31)27-30(29-14-6-3-7-15-29)19-24-37-25-21-34(38,22-26-37)20-10-13-28-11-4-2-5-12-28/h2-9,11-12,14-18,23,30,38H,10,13,19-22,24-27H2,1H3
InChiKey CPCUDQSFKDHFRK-UHFFFAOYSA-N
Formula C34H41N3O3S2 Molecular Weight 603.84
Cross Link CHEMBL326111
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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