SCH-900271

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: G2283XQ6VJ

Structure
InChI Key ARJKMWXLIHZLQZ-UHFFFAOYSA-N
Smile CC1(CCCc2cc(=O)oc3[nH]c(=O)[nH]c(=O)c23)CC1
InChI
InChI=1S/C14H16N2O4/c1-14(5-6-14)4-2-3-8-7-9(17)20-12-10(8)11(18)15-13(19)16-12/h7H,2-6H2,1H3,(H2,15,16,18,19)

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H16N2O4
Molecular Weight 276.29
AlogP 1.29
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 95.93
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Hydroxycarboxylic acid receptor 2 agonist PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Carboxylic acid receptor Hydroxycarboxylic acid receptor
2 - - - -

Cross References

Resources Reference
ChEMBL CHEMBL2036958
DrugBank DB12433
EPA CompTox DTXSID00238609
FDA SRS G2283XQ6VJ
Guide to Pharmacology 8469
PubChem 56950369
SureChEMBL SCHEMBL12602910
ZINC ZINC000096902468
CONTENTS