CFam Chemical Families Database
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You are searching for "CFAMM00433865" in compound.

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CFAM Mol ID CFAMM00433865
Family CFFBM15401 Matrix metalloproteinase-9 and Neutrophil collagenase inhibitor (2R)-N-[(2S)-1-(1,3-benzodioxol-5-ylmethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-N'-hydroxy-2-(2-methylpropyl)butanediamide family
Superfamily CFSBM2190 Inositol monophosphatase 1 and Cruzipain Binder Superfamily
Class CFCID923 Class 2273
External ID ZINC20763335 External Source ZINC
PubChem CID 29148410 Functional Category Natural Product
Molecule Name (S)-methyl 2-(2-(6,7-dimethoxy-4-oxoquinazolin-3(4H)-yl)acetamido)-3-(1H-indol-3-yl)propanoate
IUPAC Name methyl (2S)-2-[[2-(6,7-dimethoxy-4-oxoquinazolin-3-yl)acetyl]amino]-3-(1H-indol-3-yl)propanoate
Synonyms MolPort-008-347-132;ZINC20763335;MCULE-9754510301
InChi InChI=1S/C24H24N4O6/c1-32-20-9-16-18(10-21(20)33-2)26-13-28(23(16)30)12-22(29)27-19(24(31)34-3)8-14-11-25-17-7-5-4-6-15(14)17/h4-7,9-11,13,19,25H,8,12H2,1-3H3,(H,27,29)/t19-/m0/s1
InChiKey XBRFHJQYMWKYRC-IBGZPJMESA-N
Formula C24H24N4O6 Molecular Weight 464.47
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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