BDBM51707 2-(7-hydroxy-2-keto-8-methyl-chromen-4-yl)acetic acid methyl ester::2-(7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)acetic acid methyl ester::MLS000582342::SMR000200882::cid_5513690::methyl (7-hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)acetate::methyl 2-(7-hydroxy-8-methyl-2-oxochromen-4-yl)acetate::methyl 2-(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)ethanoate
SMILES: COC(=O)Cc1cc(=O)oc2c(C)c(O)ccc12
InChI Key: InChIKey=WMUYFTOUXUEMBV-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
dTDP-4-dehydrorhamnose 3,5-epimerase RmlC (Mycobacterium tuberculosis H37Rv) | BDBM51707 (2-(7-hydroxy-2-keto-8-methyl-chromen-4-yl)acetic a...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | 1.53E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
PCMD Curated by PubChem BioAssay | Assay Description Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Michael McNeil, Colorado State Universi... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2TD9VRT | |||||||||||
More data for this Ligand-Target Pair |