BDBM50240453 (+/-)-2-methylbutanoate::2-methylbutanoate::2-methylbutyrate

SMILES CCC(C)C([O-])=O

InChI Key InChIKey=WLAMNBDJUVNPJU-UHFFFAOYSA-M

Data  2 KI  1 ITC

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50240453   

TargetSolute carrier family 22 member 20(Mus musculus)
University Of California

Curated by ChEMBL
LigandPNGBDBM50240453((+/-)-2-methylbutanoate | 2-methylbutanoate | 2-me...)
Affinity DataKi:  4.07E+4nMAssay Description:Inhibition of mouse Oat6-mediated [3H]ES uptake in Xenopus oocytes after 1 hrMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSolute carrier family 22 member 6(Mus musculus)
University Of California

Curated by ChEMBL
LigandPNGBDBM50240453((+/-)-2-methylbutanoate | 2-methylbutanoate | 2-me...)
Affinity DataKi:  9.20E+5nMAssay Description:Inhibition of mouse Oat1-mediated [3H]PAH uptake in Xenopus oocytes after 1 hrMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50240453   

HostPNGBDBM4((1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23...)
Nist

GuestPNGBDBM50240453((+/-)-2-methylbutanoate | 2-methylbutanoate | 2-me...)
ITC DataΔG°: -1.87kcal/mole −TΔS°: 1.12kcal/mole ΔH°: -2.99kcal/mole logk: 23.5
pH: 6.9 T: 25.00°C 
In DepthDetails Article