Bioactive Compound Details

BioIDbio199815
NameMIRAMISTIN
ChEMBL IDCHEMBL4650346
Molecular FormulaC26H47ClN2O
Molecular Weight439.13
Molecular Weight (Monoisotopic)403.3683
TypeSmall molecule
Max PhasePhase 2
Target IDTar81
Target NameNone
SynonymsDT 2 (SURFACTANT)|MIRAMISTIN|MYRAMISTIN
SmilesCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)Cc1ccccc1.[Cl-]
InchiInChI=1S/C26H46N2O.ClH/c1-4-5-6-7-8-9-10-11-12-13-17-21-26(29)27-22-18-23-28(2,3)24-25-19-15-14-16-20-25;/h14-16,19-20H,4-13,17-18,21-24H2,1-3H3;1H
Inchi KeyJQQZCIIDNVIQKO-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets25.0
Bioactivities67.0
Np Likeness Score-0.13
Records Key['MIRAMISTIN', 'Miramistin', 'Miramistin']
Records Name['MIRAMISTIN', 'Miramistin', 'Miramistin']
Withdrawn FlagFalse
Orphan0

Molecular Structure

2D Molecular Structure