TRAMETINIB DIMETHYL SULFOXIDE

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Synonyms
Status
Molecule Category Free-form
UNII BSB9VJ5TUT
EPA CompTox DTXSID30152223

Structure

InChI Key OQUFJVRYDFIQBW-UHFFFAOYSA-N
Smiles CC(=O)Nc1cccc(-n2c(=O)n(C3CC3)c(=O)c3c(Nc4ccc(I)cc4F)n(C)c(=O)c(C)c32)c1.C[S+](C)[O-]
InChI
InChI=1S/C26H23FIN5O4.C2H6OS/c1-13-22-21(23(31(3)24(13)35)30-20-10-7-15(28)11-19(20)27)25(36)33(17-8-9-17)26(37)32(22)18-6-4-5-16(12-18)29-14(2)34;1-4(2)3/h4-7,10-12,17,30H,8-9H2,1-3H3,(H,29,34);1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H29FIN5O5S
Molecular Weight 693.54

Pharmacology

Mechanism of Action Action Reference
Dual specificity mitogen-activated protein kinase kinase 1 inhibitor INHIBITOR FDA

Target Conservation

Protein: Dual specificity mitogen-activated protein kinase kinase 2
Description: Dual specificity mitogen-activated protein kinase kinase 2
Organism : Homo sapiens
P36507 ENSG00000126934
Protein: Dual specificity mitogen-activated protein kinase kinase 1
Description: Dual specificity mitogen-activated protein kinase kinase 1
Organism : Homo sapiens
Q02750 ENSG00000169032

Cross References

Resources Reference
ChEBI 75991
ChEMBL CHEMBL2105741
FDA SRS BSB9VJ5TUT
SureChEMBL SCHEMBL1516331
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