Trade Names
Synonyms
Status
Molecule Category Mixture
UNII 2U918O4BEV
EPA CompTox DTXSID10226234

Structure

InChI Key YZODJQFXMFEJRM-UHFFFAOYSA-N
Smiles CCCCCCc1ccc(O)cc1O.Nc1c2ccccc2nc2ccccc12
InChI
InChI=1S/C13H10N2.C12H18O2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h1-8H,(H2,14,15);7-9,13-14H,2-6H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H28N2O2
Molecular Weight 388.51

Pharmacology

EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 70.31-120.21

Cross References

Resources Reference
ChEMBL CHEMBL1201038
FDA SRS 2U918O4BEV
KEGG D04441
PubChem 24144
SureChEMBL SCHEMBL148836
ZINC ZINC01576892