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
SULFABENZAMIDE DISCONTINUED

SULFABENZAMIDE

ANTIINFECTIVES
ANTIBACTERIAL
ANTIBIOTIC

VAGINAL

PDB 3RCF (HUMAN CYCLOPHILIN D COMPLEXED WITH N-[(4-AMINOPHENYL)SULFONYL]BENZAMIDE)

LIGAND CODE = BS4 (link to the list of PDB complexes)

Download experimental 3D coordinates of BS4 with added hydrogens

Unknown

more at DrugCentral

EMA

ANSM (in French)

Inxight Drugs
Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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