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
IDOXURIDINE DISCONTINUED

IDOXURIDINE


ATC D06BB01
ATC J05AB02
ATC S01AD01

ANTIINFECTIVES
ANTIVIRAL AGENTS
NUCLEIC ACID SYNTHESIS INHIBITORS
INTERFER WITH DNA SYNTHESIS

OPHTHALMIC DNA

PDB 1KI7 (CRYSTAL STRUCTURE OF THYMIDINE KINASE FROM HERPES SIMPLEX VIRUS TYPE I COMPLEXED WITH 5-IODODEOXYURIDINE)

LIGAND CODE = ID2 (link to the list of PDB complexes)

Download experimental 3D coordinates of ID2 with added hydrogens

DNA INHIBITOR CHEMBL2366042 DNA HUMAN HERPESVIRUS 1EMA

ANSM (in French)

Inxight Drugs
Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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