Bioactive Compound Details

BioIDbio3442
NameDILMAPIMOD TOSYLATE
ChEMBL IDCHEMBL2105674
Molecular FormulaC30H27F3N4O6S
Molecular Weight628.63
Molecular Weight (Monoisotopic)456.1409
TypeSmall molecule
Max PhaseUnknown
Target IDTar18
Target NameSerine/threonine-protein kinase cot (COT)
SynonymsDILMAPIMOD TOSILATE|DILMAPIMOD TOSYLATE|SB-681323-T
SmilesCc1cc(F)ccc1-c1nc(NC(CO)CO)nc2c1ccc(=O)n2-c1c(F)cccc1F.Cc1ccc(S(=O)(=O)O)cc1
InchiInChI=1S/C23H19F3N4O3.C7H8O3S/c1-12-9-13(24)5-6-15(12)20-16-7-8-19(33)30(21-17(25)3-2-4-18(21)26)22(16)29-23(28-20)27-14(10-31)11-32;1-6-2-4-7(5-3-6)11(8,9)10/h2-9,14,31-32H,10-11H2,1H3,(H,27,28,29);2-5H,1H3,(H,8,9,10)
Inchi KeyONQKJJNSLLVYHF-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
TargetsNone
BioactivitiesNone
Np Likeness Score-0.81
Records Key['DILMAPIMOD TOSYLATE']
Records Name['DILMAPIMOD TOSYLATE']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure