e-Drug3D

1741

OLODATEROL

INN
OLODATEROL

cas 868049-49-4

CLASS

RESPIRATORY SYSTEM
SELECTIVE BETA-2 ADRENERGIC AGONISTS
BRONCHODILATOR TREATMENT (COPD)

ROUTE (list)

INHALATION

ATC code

R03AC19
R03AL06

PK parameters

F 30 PERCENT
Tmax 0.25 HOUR
VD 1110 LITER
Cl 52.3 LITER / HOUR
PPB 60 PERCENT
t1/2 45 HOUR

Solubility

SPARINGLY-SLIGHTLY SOLUBLE IN WATER

Target

TARGET BETA2 ADRENERGIC RECEPTOR

PDB
8JJL (CRYO-EM STRUCTURE OF THE BETA2-AR-MBRIL, 1B3 FAB, GLUE COMPLEX WITH A FULL AGONIST)

Ligand code = DZQ (link to the list of PDB complexes)

Download experimental 3D coordinates of DZQ with added hydrogens

DrugCentral

Beta-2 adrenergic receptor UNIPROT P07550 ADRB2

Download SDF file

2H-1,4-Benzoxazin-3(4H)-one, 6-hydroxy-8-[(1R)-1-hydroxy-2-[[2-(4-methoxyphenyl)-1,1-dimethylethyl]amino]ethyl]-

Formula:
C21H26N2O5

Calculated chemical properties:

MW 386.44
NB_atoms 28
XLogP 2.38
PSA 106.261
NB_HD 4
NB_HA 7
fsp3 0.38
Lipinski(0=no;1=yes) 1

FDA
NDA 203108 (label) INN (OLODATEROL HYDROCHLORIDE) STRIVERDI RESPIMAT (BOEHRINGER INGELHEIM) APPROVAL= AP YEAR= 2014 NEWMOLECULARENTITY
NDA 206756 (label) INN (OLODATEROL HYDROCHLORIDE ; TIOTROPIUM BROMIDE) STIOLTO RESPIMAT (BOEHRINGER INGELHEIM) APPROVAL= AP YEAR= 2015