BDBM50426401 CHEMBL2326715

SMILES CNc1nc(Nc2cnn(C)c2Cl)ncc1C(F)(F)F

InChI Key InChIKey=QSRNIRWKKRHBNL-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50426401   

TargetCytochrome P450 1A2(Human)
Genentech

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50426401BDBM50426401(CHEMBL2326715)
Affinity DataIC50: 5.80E+3nMAssay Description:Reversible inhibition of CYP1A2 (unknown origin) using phenacetin as substrate by LC-MS/MS analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2013
Entry Details Article
PubMed