e-Drug3D

1179

METHACHOLINE

INN
METHACHOLINE

cas 55-92-5

CLASS

BRONCHOCONSTRICTOR AGENT
RESPIRATORY SYSTEM
CHOLINERGIC
INHALATION DIAGNOSTIC CHALLENGE (SUBJECT WITH ASTHM ARE MORE SENSITIVE THAN HEALTHY SUBJECTS)
MORE SLOWLY HYDROLYZED BY ACETYLCHOLINESTERASES THAN ACETYLCHOLINE
ACETYLCHOLINE ANALOG THAT INDUCES BRONCHOCONSTRICTION

ROUTE (list)

INHALATION

ATC code

V04CX03

PK parameters

Solubility

SOLUBLE IN WATER

Target

PDB
7ECQ (CRYSTAL STRUCTURE OF FAM3A)

Ligand code = J0R (link to the list of PDB complexes)

Download experimental 3D coordinates of J0R with added hydrogens

DrugCentral

Muscarinic acetylcholine receptor M3 UNIPROT P20309 CHRM3

Download SDF file

1-Propanaminium, 2-(acetyloxy)-N,N,N-trimethyl-

Formula:
C8H18NO2

Calculated chemical properties:

MW 160.23
NB_atoms 11
XLogP 0.64
PSA 23.339
NB_HD 0
NB_HA 2
fsp3 0.88
Lipinski(0=no;1=yes) 1

FDA
NDA 019193 (pdf not found) INN (METHACHOLINE CHLORIDE) PROVOCHOLINE (METHAPHARM) APPROVAL= AP YEAR= 1986