CFam Chemical Families Database
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You are searching for "CFAMM00407553" 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 CFAMM00407553
Family CFFBM11211 C-C chemokine receptor type 5 ligand AC1MHRXO family
Superfamily CFSBM5413 C-C chemokine receptor type 5 Binder Superfamily 10
Class CFCID991 Class 2341
External ID CHEMBL2112559 External Source CHEMBL
PubChem CID 3010268 Functional Category Bioactive
Molecule Name (2R)-2-[(3S,4S)-3-[[4-(2-benzyl-1H-imidazol-5-yl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-3-cyclobutylpropanoic acid
IUPAC Name (2R)-2-[(3S,4S)-3-[[4-(2-benzyl-1H-imidazol-5-yl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-3-cyclobutylpropanoic acid
Synonyms (2R)-2-((3S,4S)-3-{[4-(2-Benzyl-1H-imidazol-5-yl)piperidin-1-yl]methyl}-4-phenylpyrrolidin-1-yl)-3-cyclobutylpropanoic acid;(2R)-2-[(3S,4S)-3-[[4-(2-benzyl-1H-imidazol-5-yl)piperidin-1-yl]methyl]-4-phenylpyrrolidin-1-yl]-3-cyclobutylpropanoic acid;AC1MHRY9
InChi InChI=1S/C33H42N4O2/c38-33(39)31(18-24-10-7-11-24)37-22-28(29(23-37)26-12-5-2-6-13-26)21-36-16-14-27(15-17-36)30-20-34-32(35-30)19-25-8-3-1-4-9-25/h1-6,8-9,12-13,20,24,27-29,31H,7,10-11,14-19,21-23H2,(H,34,35)(H,38,39)/t28-,29+,31+/m0/s1
InChiKey IBDZCUWDCUNLFP-ILJQZKEFSA-N
Formula C33H42N4O2 Molecular Weight 526.71
Cross Link CHEMBL2112559
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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