CFam Chemical Families Database
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You are searching for "CFAMM00443098" 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 CFAMM00443098
Family CFFBM17523 5-hydroxytryptamine receptor 1D and 5-hydroxytryptamine receptor 1A ligand 4-methyl-8-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one family
Superfamily CFSBM1192 5-hydroxytryptamine receptor 1A and 5-hydroxytryptamine receptor 1D Binder Superfamily 2
Class CFCID896 Class 2246
External ID CHEMBL511815 External Source CHEMBL
PubChem CID 44592294 Functional Category Bioactive
Molecule Name 4-methyl-8-[2-[(2R)-2-methyl-4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one
IUPAC Name 4-methyl-8-[2-[(2R)-2-methyl-4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one
Synonyms SureCN4174506
InChi InChI=1S/C26H30N4O2/c1-18-10-11-21-22(27-18)7-5-8-23(21)30-15-14-29(19(2)16-30)13-12-20-6-4-9-24-26(20)32-17-25(31)28(24)3/h4-11,19H,12-17H2,1-3H3/t19-/m1/s1
InChiKey WNZKLSJSPOZSAM-LJQANCHMSA-N
Formula C26H30N4O2 Molecular Weight 430.54
Cross Link CHEMBL511815
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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