Bioactive Compound Details

BioIDbio197171
NameNone
ChEMBL IDCHEMBL137100
Molecular FormulaC19H23N3O2
Molecular Weight325.41
Molecular Weight (Monoisotopic)325.179
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsOctanedioic acid phenylamide pyridin-2-ylamide
SmilesO=C(CCCCCCC(=O)Nc1ccccn1)Nc1ccccc1
InchiInChI=1S/C19H23N3O2/c23-18(21-16-10-4-3-5-11-16)13-6-1-2-7-14-19(24)22-17-12-8-9-15-20-17/h3-5,8-12,15H,1-2,6-7,13-14H2,(H,21,23)(H,20,22,24)
Inchi KeyQSUXHQUVCUHWJP-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets4.0
Bioactivities7.0
Np Likeness Score-1.18
Records Key['12', '8c', '75-2']
Records Name['Octanedioic acid phenylamide pyridin-2-ylamide', 'N1-phenyl-N8-(pyridin-2-yl)octanediamide', 'N1-phenyl-N8-(pyridin-2-yl)octanediamide']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure