General Information of Drug (ID: DMXR527)

Drug Name
N-acetyloxyethyl-exo-THPO
Synonyms N-acetyloxyethyl-exo-THPO; GTPL5420; 3-[(3-hydroxy-4,5,6,7-tetrahydro-1,2-benzoxazol-4-yl)amino]propyl acetate
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Drug Type
Small molecular drug
Structure
3D MOL is unavailable 2D MOL
Chemical Identifiers
Formula
C12H18N2O4
Canonical SMILES
CC(=O)OCCCNC1CCCC2=C1C(=O)NO2
InChI
1S/C12H18N2O4/c1-8(15)17-7-3-6-13-9-4-2-5-10-11(9)12(16)14-18-10/h9,13H,2-7H2,1H3,(H,14,16)
InChIKey
BQHOBAROVZNICB-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
73755118
TTD ID
D04TVP

References

1 URL: http://www.guidetopharmacology.org Nucleic Acids Res. 2015 Oct 12. pii: gkv1037. The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands. (Ligand id: 5420).