Bioactive Compound Details

BioIDbio198335
NameNone
ChEMBL IDCHEMBL254552
Molecular FormulaC28H26N2O8
Molecular Weight518.52
Molecular Weight (Monoisotopic)518.1689
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
Synonyms2-((4-Hydroxyphenoxy)Carbonyl)Acetic Acid
SmilesCc1oc(-c2ccccc2)nc1CC(O)Oc1ccc(CN(CC(=O)O)C(=O)Oc2ccc(O)cc2)cc1
InchiInChI=1S/C28H26N2O8/c1-18-24(29-27(36-18)20-5-3-2-4-6-20)15-26(34)37-22-11-7-19(8-12-22)16-30(17-25(32)33)28(35)38-23-13-9-21(31)10-14-23/h2-14,26,31,34H,15-17H2,1H3,(H,32,33)
Inchi KeyHLEBRMGWUUFGIB-UHFFFAOYSA-N
Molecular SpeciesACID
Targets1.0
Bioactivities1.0
Np Likeness Score-0.67
Records Key['M2, 8-Hydroxy-O-demethyl muraglitazar']
Records Name['2-((4-hydroxyphenoxy)carbonyl)acetic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure