CFam Chemical Families Database
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You are searching for "CFAMM00255002" in compound.

Total 1 results found.

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 CFAMM00255002
Family CFFID1949 Disintegrin and metalloproteinase domain-containing protein 17 and Collagenase 3 Inhibitor TMI-05 Family
Superfamily CFSID1472 Disintegrin and metalloproteinase domain-containing protein 17 and Collagenase 3 Inhibitor TMI-05 Superfamily
Class CFCID953 Class 2303
External ID CHEMBL178732 External Source CHEMBL
PubChem CID 44390299 Functional Category Bioactive
Molecule Name AGN-PC-075CTB
IUPAC Name 4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-1-propanoyl-1,4-diazepane-5-carboxamide
Synonyms CHEBI:402264;4-(4-but-2-ynoxyphenyl)sulfonyl-N-hydroxy-1-propanoyl-1,4-diazepane-5-carboxamide
InChi InChI=1S/C19H25N3O6S/c1-3-5-14-28-15-6-8-16(9-7-15)29(26,27)22-13-12-21(18(23)4-2)11-10-17(22)19(24)20-25/h6-9,17,25H,4,10-14H2,1-2H3,(H,20,24)
InChiKey ROWNCZWVCCMTQI-UHFFFAOYSA-N
Formula C19H25N3O6S Molecular Weight 423.48
Cross Link CHEMBL178732
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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