BDBM36185 3-methoxyphenylacetate

SMILES COc1cccc(CC([O-])=O)c1

InChI Key InChIKey=LEGPZHPSIPPYIO-UHFFFAOYSA-M

Data  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 -- ITC Data from BindingDB

Found 1 hit for monomerid = 36185   

HostPNGBDBM11(beta-cyclodextrin | betadex)
Nist

GuestPNGBDBM36185(3-methoxyphenylacetate)
ITC DataΔG°: -2.15kcal/mole −TΔS°: 0.769kcal/mole ΔH°: -2.93kcal/mole logk: 38
pH: 6.9 T: 25.00°C 
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