Cheminformatic Tools and Databases for Pharmacology

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1 INNClassRoute (list)PK parameters= Cmax; Tmax; F: bioavailability; t1/2: half-life; VD: volume of distribution; Cl: clearance; PPB: plasma protein binding;(EQN means that value was calculated using VD=(Cl*t1/2)/0.693)Primary Target and PDB code of Protein-Drug complexTargets from DrugCentral Links
TYLOXAPOL DISCONTINUED

TYLOXAPOL


ATC R05CA01

RESPIRATORY SYSTEM
DETERGENTS
SURFACE-ACTIVE AGENTS
EXPECTORANT
PREVENTS THE CATABOLISM OF TRIGLYCERIDES-RICH LIPOPROTEINS BY SERUM LIPASES AND ALLOWS A TIME-DEPENDENT AND LINEAR INCREASE IN PLASMA TRIGLYCERIDES LEVELS

INTRATRACHEAL

PDB 4MGA (CRYSTAL STRUCTURE OF HERA-LBD (Y537S) IN COMPLEX WITH 4-TERT-OCTYLPHENOL)

LIGAND CODE = 27L (link to the list of PDB complexes)

Download experimental 3D coordinates of 27L with added hydrogens

SURFACTANT AGENTANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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