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
SOTORASIB

SOTORASIB


ATC L01XX73

ANTINEOPLASTIC
TREATMENT OF METASTATIC NON-SMALL CELL LUNG CANCER (NSCLC)
INHIBITOR OF THE RAS GTPASE FAMILY
COVALENT DRUG

ORAL

Tmax 1 HOUR

VD 211 LITER

PPB 89 PERCENT

Cl 26.2 LITER / HOUR

HT 5 HOUR

SOLUBILITY 0.03 MILLIGRAM PER MILLILITER

KRAS(G12C)

Unknown - more at DrugCentralANSM (in French)

Dailymed
Drugs.com

SIDER side effects

Chemical Probes Portal

ChEMBL
BindingDB
DrugBank



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