trametinib

Ligand id: 6495

Name: trametinib

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 102.06
Molecular weight 615.08
XLogP 4.39
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (FDA (2013), EMA (2014))
IUPAC Name
N-[3-[3-cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-6,8-dimethyl-2,4,7-trioxopyrido[3,4-e]pyrimidin-1-yl]phenyl]acetamide
International Nonproprietary Names
INN number INN
9421 trametinib
Synonyms
GSK1120212 | GSK1120212B | GSK212 | JTP 74057 | Mekinist® | trametinib dimethyl sulfoxide
Database Links
CAS Registry No. 871700-17-3 (source: SciFinder)
ChEMBL Ligand CHEMBL2103875
DrugBank Ligand DB08911
GtoPdb PubChem SID 178103109
PubChem CID 11707110
Search Google for chemical match using the InChIKey LIRYPHYGHXZJBZ-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey LIRYPHYGHXZJBZ-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LIRYPHYGHXZJBZ
Wikipedia Trametinib
Comments
Trametinib is a Type-3 kinase inhibitor. Marketed formulations contain trametinib dimethyl sulfoxide (PubChem CID 50992434).