Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: N06AA14
UNII: Q7T0Y1109Z

Structure

InChI Key GWWLWDURRGNSRS-UHFFFAOYSA-N
Smile CN(C)CCC=C1c2ccccc2C(C)(C)c2ccccc21
InChI
InChI=1S/C21H25N/c1-21(2)19-13-7-5-10-17(19)16(12-9-15-22(3)4)18-11-6-8-14-20(18)21/h5-8,10-14H,9,15H2,1-4H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H25N
Molecular Weight 291.44
AlogP 4.71
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 3.0
Polar Surface Area 3.24
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 22.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135214
ChEMBL CHEMBL110094
DrugBank DB13384
DrugCentral 1675
EPA CompTox DTXSID4048274
FDA SRS Q7T0Y1109Z
PubChem 25382
SureChEMBL SCHEMBL48975
ZINC ZINC000001482101