e-Drug3D
247
THIOPENTAL
DISCONTINUED
INN
THIOPENTAL
cas 76-75-5
CLASS
NERVOUS SYSTEM
ANESTHETIC
GABA MODULATORS
HYPNOTICS AND SEDATIVES
ROUTE (list)
RECTAL
PK parameters
VD 78 LITER (65 KILOGRAM)
Cl 32 LITER / HOUR (65 KILOGRAM)
PPB 80 PERCENT
t1/2 5.5 HOUR
TARGET GAMMA-AMINOBUTYRIC-ACID RECEPTOR
PDB
5L4E (X-RAY STRUCTURE OF THE 2-22' LOCALLY-CLOSED MUTANT OF GLIC IN COMPLEX WITH THIOPENTAL)
Ligand code = EDP (link to the list of PDB complexes)
Download experimental 3D coordinates of EDP with added hydrogens
GABA-A receptor alpha-1,beta-2,gamma-2 UNIPROT P14867 GABRA1
Formula:
C11H18N2O2S
Calculated chemical properties:
MW 242.34
NB_atoms 16
XLogP 1.35
PSA 57.406
NB_HD 2
NB_HA 4
fsp3 0.73
Lipinski(0=no;1=yes) 1
NB_atoms 16
XLogP 1.35
PSA 57.406
NB_HD 2
NB_HA 4
fsp3 0.73
Lipinski(0=no;1=yes) 1
FDA
NDA 011679 (pdf not found) INN (THIOPENTAL SODIUM) PENTOTHAL (ABBOTT) APPROVAL= AP YEAR= 1959 NEWMOLECULARENTITY DISCONTINUED
NDA 011679 (pdf not found) INN (THIOPENTAL SODIUM) PENTOTHAL (ABBOTT) APPROVAL= AP YEAR= 1959 NEWMOLECULARENTITY DISCONTINUED