Synonyms:
Status: Approved (1982)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 765C9332T4

Structure

InChI Key HPBNRIOWIXYZFK-UHFFFAOYSA-N
Smile N=C(N)NCC1COC2(CCCCC2)O1
InChI
InChI=1S/C10H19N3O2/c11-9(12)13-6-8-7-14-10(15-8)4-2-1-3-5-10/h8H,1-7H2,(H4,11,12,13)

Physicochemical Descriptors

Property Name Value
Molecular Formula C10H19N3O2
Molecular Weight 213.28
AlogP 0.55
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 2.0
Polar Surface Area 80.36
Molecular species BASE
Aromatic Rings 0.0
Heavy Atoms 15.0

Cross References

Resources Reference
ChEBI 5555
ChEMBL CHEMBL1037
DrugBank DB00226
DrugCentral 1339
EPA CompTox DTXSID2048533
FDA SRS 765C9332T4
Human Metabolome Database HMDB0014371
Guide to Pharmacology 7193
KEGG C07035
PharmGKB PA164745308
PubChem 38521
SureChEMBL SCHEMBL180963