Cheminformatic Tools and Databases for Pharmacology

session 30428 - 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
AMIODARONE

AMIODARONE


ATC C01BD01

CARDIOVASCULAR
ANTIARRHYTHMIC III

ORAL INJECTION

Cmax 40 NANOMOLAR

Tmax 5 HOUR

F 50 PERCENT

VD 3900 LITER (65 KILOGRAM)

PPB 96 PERCENT

Cl 21.4 LITER / HOUR (65 KILOGRAM)

HT 1392 HOUR

SOLUBILITY SLIGHTLY SOLUBLE IN WATER

SODIUM CHANNEL
POTASSIUM CHANNEL

PDB 4O8Z (CRYSTAL STRUCTURE OF HUMAN SIRT3 IN COMPLEX WITH COMPOUND (2-BUTYLBENZOFURAN-3-YL)(4-(2-(DIETHYLAMINO)ETHOXY)-3,5-DIIODOPHENYL)METHANONE)

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

Download experimental 3D coordinates of BBI with added hydrogens

ALPHA-2A ADRENERGIC RECEPTOR P08913 ALPHA-2A ADRENERGIC RECEPTOR HOMO SAPIENS MEMBRANE RECEPTOR 7TM1 SMALLMOL MONOAMINE RECEPTOR ADRENERGIC RECEPTORANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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