Bioactive Compound Details

BioIDbio199203
NameNone
ChEMBL IDCHEMBL343377
Molecular FormulaC17H21N3O2S
Molecular Weight331.44
Molecular Weight (Monoisotopic)331.1354
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsOctanedioic acid phenylamide thiazol-2-ylamide
SmilesO=C(CCCCCCC(=O)Nc1nccs1)Nc1ccccc1
InchiInChI=1S/C17H21N3O2S/c21-15(19-14-8-4-3-5-9-14)10-6-1-2-7-11-16(22)20-17-18-12-13-23-17/h3-5,8-9,12-13H,1-2,6-7,10-11H2,(H,19,21)(H,18,20,22)
Inchi KeyRFEFMPTWMIKCRC-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets1.0
Bioactivities2.0
Np Likeness Score-1.51
Records Key['13']
Records Name['Octanedioic acid phenylamide thiazol-2-ylamide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure