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
CLIOQUINOL DISCONTINUED

CLIOQUINOL


ATC D08AH30
ATC D09AA10
ATC G01AC02
ATC P01AA02
ATC S02AA05
ATC P01AA52

ANTIINFECTIVE
ANTIAMEBIC
ANTIFUNGAL
METAL CHELATOR

TOPICAL

PDB 3KCX (FACTOR INHIBITING HIF-1 ALPHA IN COMPLEX WITH CLIOQUINOL)

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

Download experimental 3D coordinates of CQL with added hydrogens

ZINC CHELATING AGENT CHEMBL2363056 ZINCANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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