BDBM50157478 CHEMBL180388::CHEMBL180503::Dimethylamino-acetic acid (R)-7-acetylamino-1,3-dimethoxy-10-methylsulfanyl-9-oxo-5,6,7,9-tetrahydro-benzo[a]heptalen-2-yl ester; compound with 2,3-dihydroxy-succinic acid

SMILES COc1cc2CC[C@H](NC(C)=O)c3cc(=O)c(SC)ccc3-c2c(OC)c1OC(=O)CN(C)C

InChI Key InChIKey=YAIQQNSPNATXDZ-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50157478   

TargetTubulin beta-1 chain(Human)
University of North Carolina

Curated by ChEMBL
LigandPNGBDBM50157478(CHEMBL180503 | CHEMBL180388 | Dimethylamino-acetic...)
Affinity DataIC50: 3.80E+3nMAssay Description:Inhibitory concentration against tubulin assemblyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetTubulin beta-1 chain(Human)
University of North Carolina

Curated by ChEMBL
LigandPNGBDBM50157478(CHEMBL180503 | CHEMBL180388 | Dimethylamino-acetic...)
Affinity DataIC50: 8.70E+3nMAssay Description:Inhibitory concentration against tubulin assemblyMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed