Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: A03AD30
UNII: P3P08Y1XJ4

Structure

InChI Key MYCMTMIGRXJNSO-UHFFFAOYSA-N
Smile CCc1cc2cc(OC)c(OC)cc2c(Cc2ccccc2)n1
InChI
InChI=1S/C20H21NO2/c1-4-16-11-15-12-19(22-2)20(23-3)13-17(15)18(21-16)10-14-8-6-5-7-9-14/h5-9,11-13H,4,10H2,1-3H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H21NO2
Molecular Weight 307.39
AlogP 4.41
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 31.35
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 23.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Ischemia 2 D007511 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 10539-19-2
ChEBI 135307
ChEMBL CHEMBL2105060
DrugBank DB12251
DrugCentral 1853
EPA CompTox DTXSID6057613
FDA SRS P3P08Y1XJ4
PubChem 70882
SureChEMBL SCHEMBL26554
ZINC ZINC000000001754