CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00400355" 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 CFAMM00400355
Family CFFBM10198 Neuropeptide Y receptor type 5 ligand SureCN4170426 family
Superfamily CFSBM5098 Neuropeptide Y receptor type 5 and Caspase-7 Binder Superfamily
Class CFCBM1266 Class 4316
External ID 21473786 External Source PubChem
PubChem CID 21473786 Functional Category Patent Compound
Molecule Name SureCN8566860
IUPAC Name tert-butyl 4-[3-(2,4-diaminopyrrolo[3,2-d]pyrimidin-5-yl)butan-2-yl]benzoate
Synonyms AGN-PC-03BE69;tert-butyl 4-[3-(2,4-diaminopyrrolo[3,2-d]pyrimidin-5-yl)butan-2-yl]benzoate
InChi InChI=1S/C21H27N5O2/c1-12(14-6-8-15(9-7-14)19(27)28-21(3,4)5)13(2)26-11-10-16-17(26)18(22)25-20(23)24-16/h6-13H,1-5H3,(H4,22,23,24,25)
InChiKey YZDSPKCGFYOLCU-UHFFFAOYSA-N
Formula C21H27N5O2 Molecular Weight 381.47
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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