CFam Chemical Families Database
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You are searching for "CFAMM00439328" 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 CFAMM00439328
Family CFFBM16778 Sigma non-opioid intracellular receptor 1 ligand 2-[4-(4-cyclohexylpiperazin-1-yl)butylsulfanyl]-1,3-benzoxazole family
Superfamily CFSBM1720 Thyrotropin receptor and Huntingtin Binder Superfamily
Class CFCCD181 Class 994
External ID CHEMBL408003 External Source CHEMBL
PubChem CID 44457197 Functional Category Bioactive
Molecule Name 2-[4-(4-cyclohexylpiperazin-1-yl)butylsulfanyl]-1,3-benzoxazole
IUPAC Name 2-[4-(4-cyclohexylpiperazin-1-yl)butylsulfanyl]-1,3-benzoxazole
Synonyms AGN-PC-076GYK;SureCN12124516;2-[4-(4-cyclohexylpiperazin-1-yl)butylsulfanyl]-1,3-benzoxazole
InChi InChI=1S/C21H31N3OS/c1-2-8-18(9-3-1)24-15-13-23(14-16-24)12-6-7-17-26-21-22-19-10-4-5-11-20(19)25-21/h4-5,10-11,18H,1-3,6-9,12-17H2
InChiKey OUNADMZDANCSEJ-UHFFFAOYSA-N
Formula C21H31N3OS Molecular Weight 373.56
Cross Link CHEMBL408003
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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