BDBM60969 CA inhibitor, 1

SMILES Cc1c(CCO)sc[n+]1C

InChI Key InChIKey=VHDCMFVSARZDNW-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 60969   

TargetCarbonic anhydrase 6(Human)
Kirklareli University

LigandPNGBDBM60969(CA inhibitor, 1)
Affinity DataKi:  593nM ΔG°:  -8.49kcal/molepH: 7.5 T: 2°CAssay Description:Phenol red (at a concentration of 0.2 mM) has been used as indicator, working at the absorbance maximum of 557 nm, with 10 mM Tris-HCl (pH 7.5) as bu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/17/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
Kirklareli University

LigandPNGBDBM60969(CA inhibitor, 1)
Affinity DataKi:  784nM ΔG°:  -8.32kcal/molepH: 7.5 T: 2°CAssay Description:Phenol red (at a concentration of 0.2 mM) has been used as indicator, working at the absorbance maximum of 557 nm, with 10 mM Tris-HCl (pH 7.5) as bu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/17/2017
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Kirklareli University

LigandPNGBDBM60969(CA inhibitor, 1)
Affinity DataKi:  2.27E+3nM ΔG°:  -7.69kcal/molepH: 7.5 T: 2°CAssay Description:Phenol red (at a concentration of 0.2 mM) has been used as indicator, working at the absorbance maximum of 557 nm, with 10 mM Tris-HCl (pH 7.5) as bu...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/17/2017
Entry Details Article
PubMed