CFam Chemical Families Database
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You are searching for "CFAMM00271749" 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 CFAMM00271749
Family CFFID2606 Macrophage migration inhibitory factor Inhibitor 3-benzyl-5-methylbenzo[d]oxazol-2(3h)-one Family
Superfamily CFSCD350 D(2) dopamine receptor and 5-hydroxytryptamine receptor 1A Binder Superfamily
Class CFCCD256 Class 1069
External ID CHEMBL1223863 External Source CHEMBL
PubChem CID 42598357 Functional Category Bioactive
Molecule Name 3-[1-(4-ethoxy-1-methylcyclohexyl)piperidin-4-yl]-2-oxo-1,3-benzoxazole-5-carbonitrile
IUPAC Name 3-[1-(4-ethoxy-1-methylcyclohexyl)piperidin-4-yl]-2-oxo-1,3-benzoxazole-5-carbonitrile
Synonyms SureCN3005276;SureCN3005281;AGN-PC-068N93;3-[1-(4-ethoxy-1-methylcyclohexyl)piperidin-4-yl]-2-oxo-1,3-benzoxazole-5-carbonitrile
InChi InChI=1S/C22H29N3O3/c1-3-27-18-6-10-22(2,11-7-18)24-12-8-17(9-13-24)25-19-14-16(15-23)4-5-20(19)28-21(25)26/h4-5,14,17-18H,3,6-13H2,1-2H3/t18-,22-
InChiKey APAQNVIEKCXJMH-LBZQVFOQSA-N
Formula C22H29N3O3 Molecular Weight 383.48
Cross Link CHEMBL1223863
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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