CFam Chemical Families Database
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You are searching for "CFAMM00400073" in compound.

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CFAM Mol ID CFAMM00400073
Family CFFBM10168 Histamine H3 receptor ligand 1-[4-(1'-cyclobutylspiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl)oxypiperidin-1-yl]-2-methylpropan-1-one family
Superfamily CFSBM4840 Histamine H3 receptor Binder Superfamily 7
Class CFCAD142 Class 142
External ID CHEMBL2013051 External Source CHEMBL
PubChem CID 58199027 Functional Category Bioactive
Molecule Name 1-[4-(1'-cyclobutylspiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl)oxypiperidin-1-yl]ethanone
IUPAC Name 1-[4-(1'-cyclobutylspiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl)oxypiperidin-1-yl]ethanone
Synonyms AGN-PC-0CA1WD;SureCN11918518;1-[4-(1'-cyclobutylspiro[3,4-dihydrochromene-2,4'-piperidine]-6-yl)oxypiperidin-1-yl]ethanone
InChi InChI=1S/C24H34N2O3/c1-18(27)25-13-8-21(9-14-25)28-22-5-6-23-19(17-22)7-10-24(29-23)11-15-26(16-12-24)20-3-2-4-20/h5-6,17,20-21H,2-4,7-16H2,1H3
InChiKey RTNZBEUCZIJXRY-UHFFFAOYSA-N
Formula C24H34N2O3 Molecular Weight 398.54
Cross Link CHEMBL2013051
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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