Bioactive Compound Details

BioIDbio2303
NameNone
ChEMBL IDCHEMBL591525
Molecular FormulaC23H28N4O2
Molecular Weight392.5
Molecular Weight (Monoisotopic)392.2212
TypeSmall molecule
Max Phase--
Target IDTar12
Target NameToll-like receptor 9 (TLR9)
Synonyms9-(3-Biphenyl)Triazolylnonahydroxamic Acid
SmilesO=C(CCCCCCCCn1cc(-c2cccc(-c3ccccc3)c2)nn1)NO
InchiInChI=1S/C23H28N4O2/c28-23(25-29)15-8-3-1-2-4-9-16-27-18-22(24-26-27)21-14-10-13-20(17-21)19-11-6-5-7-12-19/h5-7,10-14,17-18,29H,1-4,8-9,15-16H2,(H,25,28)
Inchi KeyRTJPNOWZBVXACQ-UHFFFAOYSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities8.0
Np Likeness Score-0.99
Records Key['43']
Records Name['9-(3-Biphenyl)triazolylnonahydroxamic acid']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure