BDBM50089553 CHEMBL32687::N-((E)-6,6-Dimethyl-hept-2-en-4-ynyl)-N-(2-oxo-1,2,3,4-tetrahydro-quinolin-5-yl)-methanesulfonamide
SMILES: CC(C)(C)C#C\C=C\CN(c1cccc2NC(=O)CCc12)S(C)(=O)=O
InChI Key: InChIKey=YWYGUVKRRZDZDD-FNORWQNLSA-N
Data: 1 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Chitin synthase (Candida albicans) | BDBM50089553 (CHEMBL32687 | N-((E)-6,6-Dimethyl-hept-2-en-4-ynyl...) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 391 | n/a | n/a | n/a | n/a | n/a | n/a |
Nippon Roche Research Center Curated by ChEMBL | Assay Description Inhibitory of Candida albicans chitin synthase 1 | Bioorg Med Chem Lett 10: 1459-62 (2000) BindingDB Entry DOI: 10.7270/Q2R210MK | |||||||||||
More data for this Ligand-Target Pair |