Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: M3WGS532VY

Structure

InChI Key BMEARIQHWSVDBS-SNVBAGLBSA-N
Smile CC(C)c1cccc([C@H](C)C2CC2)c1O
InChI
InChI=1S/C14H20O/c1-9(2)12-5-4-6-13(14(12)15)10(3)11-7-8-11/h4-6,9-11,15H,7-8H2,1-3H3/t10-/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H20O
Molecular Weight 204.31
AlogP 4.03
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 20.23
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 15.0

Cross References

Resources Reference
ChEMBL CHEMBL4094894
DrugBank DB16295
FDA SRS M3WGS532VY
Guide to Pharmacology 10812
SureChEMBL SCHEMBL17515121