Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 9JX1L8VH4Z

Structure

InChI Key DJKNRCWSXSZACF-UHFFFAOYSA-N
Smile CC(=O)Nc1ccc(C(=O)NC(C)(C)C)cc1
InChI
InChI=1S/C13H18N2O2/c1-9(16)14-11-7-5-10(6-8-11)12(17)15-13(2,3)4/h5-8H,1-4H3,(H,14,16)(H,15,17)

Physicochemical Descriptors

Property Name Value
Molecular Formula C13H18N2O2
Molecular Weight 234.3
AlogP 2.17
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 58.2
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 17.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
HIV Infections 2 D015658 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL4297369
DrugBank DB12311
EPA CompTox DTXSID90171455
FDA SRS 9JX1L8VH4Z
PubChem 151118
SureChEMBL SCHEMBL154117
ZINC ZINC000000008596