CFam Chemical Families Database
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You are searching for "CFAMM00445597" 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 CFAMM00445597
Family CFFBM18039 Matrix metalloproteinase-9 and 72 kDa type IV collagenase inhibitor (2R)-2-[2-[2-[4-(2,5-dioxopyrrolidin-1-yl)phenyl]sulfonylhydrazinyl]-2-oxoethyl]-N-[(2S)-3-(1H-indol-3-yl)-1-(methylamino)-1-oxopropan-2-yl]-4-methylpentanamide family
Superfamily CFSBM739 Prelamin-A/C and Cyclin-dependent kinase 2 Binder Superfamily 2
Class CFCAD8 Class 8
External ID CHEMBL509346 External Source CHEMBL
PubChem CID 44563492 Functional Category Bioactive
Molecule Name (E)-2-[2-[2-[4-(4-bromophenyl)phenyl]sulfonylhydrazinyl]-2-oxoethyl]-N-[(2S)-1-(methylamino)-1-oxo-3-(2-phenyl-1H-indol-3-yl)propan-2-yl]-5-phenylpent-2-enamide
IUPAC Name (E)-2-[2-[2-[4-(4-bromophenyl)phenyl]sulfonylhydrazinyl]-2-oxoethyl]-N-[(2S)-1-(methylamino)-1-oxo-3-(2-phenyl-1H-indol-3-yl)propan-2-yl]-5-phenylpent-2-enamide
Synonyms CHEBI:553893
InChi InChI=1S/C43H40BrN5O5S/c1-45-43(52)39(28-37-36-17-8-9-18-38(36)46-41(37)32-14-6-3-7-15-32)47-42(51)33(16-10-13-29-11-4-2-5-12-29)27-40(50)48-49-55(53,54)35-25-21-31(22-26-35)30-19-23-34(44)24-20-30/h2-9,11-12,14-26,39,46,49H,10,13,27-28H2,1H3,(H,45,52)(H,47,51)(H,48,50)/b33-16+/t39-/m0/s1
Formula C43H40BrN5O5S Molecular Weight 818.78
Cross Link CHEMBL509346

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).

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National University of Singapore, Singapore

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