Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN

Structure

InChI Key SNICXCGAKADSCV-UHFFFAOYSA-N
Smile CN1CCCC1c1cccnc1
InChI
InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H14N2
Molecular Weight 162.24
AlogP 1.85
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 1.0
Polar Surface Area 16.13
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 12.0

Cross References

Resources Reference
ChEBI 18723
ChEMBL CHEMBL440464
DrugBank DB00184
EPA CompTox DTXSID3048154
Human Metabolome Database HMDB14330
Guide to Pharmacology 3978
KEGG C16150
PharmGKB PA450626
PubChem 942
SureChEMBL SCHEMBL11976729