Bioactive Compound Details

BioIDbio3513
NameN PHTHALOYL-L-THREONINE
ChEMBL IDCHEMBL2289111
Molecular FormulaC12H11NO5
Molecular Weight249.22
Molecular Weight (Monoisotopic)249.0637
TypeSmall molecule
Max Phase--
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsNone
SmilesC[C@@H](O)[C@@H](C(=O)O)N1C(=O)c2ccccc2C1=O
InchiInChI=1S/C12H11NO5/c1-6(14)9(12(17)18)13-10(15)7-4-2-3-5-8(7)11(13)16/h2-6,9,14H,1H3,(H,17,18)/t6-,9+/m1/s1
Inchi KeyYDKPWVQMYIKVHO-MUWHJKNJSA-N
Molecular SpeciesACID
Targets4.0
Bioactivities13.0
Np Likeness Score-0.18
Records Key['5a, P-Thr']
Records Name['N phthaloyl-L-threonine']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure