CFam Chemical Families Database
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You are searching for "CFAMM00215271" 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 CFAMM00215271
Family CFFID605 Histamine H3 receptor Ligand UCL-2138 Family
Superfamily CFSID497 Histamine H3 receptor and Sodium-dependent serotonin transporter Binder Superfamily
Class CFCAD280 Class 280
External ID 21297470 External Source PubChem
PubChem CID 21297470 Functional Category Patent Compound
Molecule Name AGN-PC-0388ZE
IUPAC Name 1-(3-isocyanatopropoxy)-2-(3-isocyanatopropyl)-4-methylbenzene
Synonyms 1-(3-isocyanatopropoxy)-2-(3-isocyanatopropyl)-4-methylbenzene
InChi InChI=1S/C15H18N2O3/c1-13-5-6-15(20-9-3-8-17-12-19)14(10-13)4-2-7-16-11-18/h5-6,10H,2-4,7-9H2,1H3
InChiKey YCKNSLOTSDWMRP-UHFFFAOYSA-N
Formula C15H18N2O3 Molecular Weight 274.32
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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