AM-211

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: SZB129M7SZ

Structure
InChI Key OPXIRFWNLBDKQB-UHFFFAOYSA-N
Smile CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(CC(=O)O)ccc1OC)C(=O)NCc1ccccc1
InChI
InChI=1S/C27H27F3N2O4/c1-3-32(26(35)31-16-18-7-5-4-6-8-18)17-20-15-21(27(28,29)30)10-11-22(20)23-13-19(14-25(33)34)9-12-24(23)36-2/h4-13,15H,3,14,16-17H2,1-2H3,(H,31,35)(H,33,34)

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H27F3N2O4
Molecular Weight 500.52
AlogP 5.74
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 9.0
Polar Surface Area 78.87
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 36.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST G protein-coupled receptor 44 antagonist Other
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Lipid-like ligand receptor (family A GPCR) Prostanoid receptor
- 3-5 - - -

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2181753
EPA CompTox DTXSID80151807
FDA SRS SZB129M7SZ
PubChem 44158492
SureChEMBL SCHEMBL138450
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