Cheminformatic Tools and Databases for Pharmacology

session 98679 - Total of 1 hits - Display   hits per page:

Add another drug(s) by one keyword:
Exemple: “nib“ and click on the Search button (do not press Enter on the keyboard)

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
DOLUTEGRAVIR

DOLUTEGRAVIR


ATC J05AX12
ATC J05AR21
ATC J05AR13
ATC J05AR25
ATC J05AR27

ANTIINFECTIVES
HIV-1 ANTIVIRAL AGENT
HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 (HIV-1) INTEGRASE STRAND TRANSFER INHIBITOR
P-GLYCOPROTEIN SUBSTRATE

ORAL

Cmax 9.9 MICROMOLAR

VD 17.4 LITER

PPB 98.9 PERCENT

Cl 1 LITER / HOUR

HT 14 HOUR

SOLUBILITY SLIGHTLY SOLUBLE IN WATER

HIV-1 INTEGRASE

PDB 3S3O (CRYSTAL STRUCTURE OF THE PROTOTYPE FOAMY VIRUS (PFV) N224H MUTANT INTASOME IN COMPLEX WITH MAGNESIUM AND DOLUTEGRAVIR (S/GSK1349572))

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

Download experimental 3D coordinates of DLU with added hydrogens

HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 INTEGRASE INHIBITOR CHEMBL3471 HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 INTEGRASE Q7ZJM1 INTEGRASE HUMAN IMMUNODEFICIENCY VIRUS 1 ENZYME HYDROLASEEMA

ANSM (in French)

Inxight Drugs
Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



Copyright © 2019 Université Côte d'Azur CNRS - All rights reserved
  | Contact |