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Ligand

NameMLS001206870
Molecular formulaC19H13NO7
IUPAC name[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-oxochromene-3-carboxylate
Molecular weight367.313
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP3.8
Synonyms2-Oxo-2H-chromene-3-carboxylic acid 2-methoxy-4-(2-nitro-vinyl)-phenyl ester
CHEMBL1333737
STK852366
[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2-oxochromene-3-carboxylate
BDBM67326
[ Show all ]
Inchi KeyAIAOTAFSXSSCRY-CMDGGOBGSA-N
Inchi IDInChI=1S/C19H13NO7/c1-25-17-10-12(8-9-20(23)24)6-7-16(17)27-19(22)14-11-13-4-2-3-5-15(13)26-18(14)21/h2-11H,1H3/b9-8+
PubChem CID1183382
ChEMBLCHEMBL1333737
IUPHARN/A
BindingDB67326
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
6044Apelin receptorP35414APLNRHomo sapiens (Human)380
6043Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359

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