CFam Chemical Families Database
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You are searching for "CFAMM00387804" in compound.

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CFAM Mol ID CFAMM00387804
Family CFFBM8423 72 kDa type IV collagenase and Matrix metalloproteinase-9 inhibitor 5-(4-methylpiperazin-1-yl)-5-(4-phenoxyphenyl)-1,3-diazinane-2,4,6-trione family
Superfamily CFSBM4513 Matrix metalloproteinase-9 and 72 kDa type IV collagenase Binder Superfamily 7
Class CFCID107 Class 1457
External ID CHEMBL2063427 External Source CHEMBL
PubChem CID 56964015 Functional Category Bioactive
Molecule Name 2-[1-[2,4,6-trioxo-5-(4-phenoxyphenyl)-1,3-diazinan-5-yl]piperidin-4-yl]ethyl nitrate
IUPAC Name 2-[1-[2,4,6-trioxo-5-(4-phenoxyphenyl)-1,3-diazinan-5-yl]piperidin-4-yl]ethyl nitrate
Synonyms AGN-PC-0BL6UD;2-[1-[2,4,6-trioxo-5-(4-phenoxyphenyl)-1,3-diazinan-5-yl]piperidin-4-yl]ethyl nitrate
InChi InChI=1S/C23H24N4O7/c28-20-23(21(29)25-22(30)24-20,26-13-10-16(11-14-26)12-15-33-27(31)32)17-6-8-19(9-7-17)34-18-4-2-1-3-5-18/h1-9,16H,10-15H2,(H2,24,25,28,29,30)
InChiKey SOYSLGSCAATJQA-UHFFFAOYSA-N
Formula C23H24N4O7 Molecular Weight 468.46
Cross Link CHEMBL2063427
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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