Cheminformatic Tools and Databases for Pharmacology

session 20621 - Total of 1 hits - Display   hits per page:

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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
ISONIAZID

ISONIAZID


ATC J04AC01
ATC J04AC51
ATC J04AM08
ATC J04AM03
ATC J04AM02
ATC J04AM07
ATC J04AM05
ATC J04AM06
ATC J04AM01
ATC J04AM04

ANTIINFECTIVES
TUBERCULOSTATIC
ANTIFUNGAL
ANTIBIOTIC
ANTIBACTERIAL
ANTITUBERCULAR
FATTY ACID SYNTHESIS INHIBITORS

ORAL INJECTION

Cmax 22.5 MICROMOLAR

Tmax 1.5 HOUR

F 100 PERCENT

VD 53.3 LITER (65 KILOGRAM)

PPB 0 PERCENT

Cl 24.02 LITER / HOUR

HT 2.8 HOUR

SOLUBILITY FREELY SOLUBLE IN WATER

CATALASE PEROXIDASE (KATG)

PDB 4PAE (CRYSTAL STRUCTURE OF CATALASE-PEROXIDASE (KATG) W78F MUTANT FROM SYNECHOCOCCUS ELONGATUS PCC7942)

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

Download experimental 3D coordinates of NIZ with added hydrogens

ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHIBITOR CHEMBL1849 ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE P9WGR1 ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADH] MYCOBACTERIUM TUBERCULOSIS ENZYME REDUCTASEANSM (in French)

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