MetaADEDB 2.0 @ LMMD
(E)-3-((((6-(2-carboxyethenyl)-5-((8-(4-methoxyphenyl)octyl)oxy)-2-pyridinyl)methyl)thio)methyl)benzoic acid
(QQUXZUFSDIOIFJ-HTXNQAPBSA-N)
Structure
SMILES
COc1ccc(cc1)CCCCCCCCOc1ccc(nc1/C=C/C(=O)O)CSCc1cccc(c1)C(=O)O
Molecular Formula:
C32H37NO6S
Molecular Weight:
563.704
Log P:
7.2817
Hydrogen Bond Acceptor:
8
Hydrogen Bond Donor:
2
TPSA:
131.25
CAS Number(s):
N/A
Synonym(s)
1.
(E)-3-((((6-(2-carboxyethenyl)-5-((8-(4-methoxyphenyl)octyl)oxy)-2-pyridinyl)methyl)thio)methyl)benzoic acid
2.
SB 201993
3.
SB-201993
External Link(s)
MeSHC083427
PubChem Compound6435820
BindingDB50037385
CHEMBLCHEMBL422598
Therapeutic Target DatabaseD0B6JV
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Inflammation10477044CTD
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