CFam Chemical Families Database
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You are searching for "CFAMM00407181" 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 CFAMM00407181
Family CFFBM11156 Histamine H3 receptor ligand SureCN5093846 family
Superfamily CFSBM5389 Histamine H3 receptor and Nitric oxide synthase, brain Binder Superfamily
Class CFCAD286 Class 286
External ID 18963908 External Source PubChem
PubChem CID 18963908 Functional Category Patent Compound
Molecule Name AGN-PC-0237XI
IUPAC Name 1-hydroxy-1-[2-[[1-oxo-2-(thiophen-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea
Synonyms 1-hydroxy-1-[2-[[1-oxo-2-(thiophen-2-ylmethyl)-3,4-dihydroisoquinolin-6-yl]oxy]ethyl]urea
InChi InChI=1S/C17H19N3O4S/c18-17(22)20(23)7-8-24-13-3-4-15-12(10-13)5-6-19(16(15)21)11-14-2-1-9-25-14/h1-4,9-10,23H,5-8,11H2,(H2,18,22)
InChiKey FKLFQWUFNTVNHC-UHFFFAOYSA-N
Formula C17H19N3O4S Molecular Weight 361.42
Cross Link
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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