Bioactive Compound Details

BioIDbio198069
NameMETHYL 3-METHOXY-2-(2-((1-METHYL-3-P-TOLYL-1H-PYRAZOL-5-YLOXY)METHYL)PHENYL)ACRYLATE
ChEMBL IDCHEMBL2285967
Molecular FormulaC23H24N2O4
Molecular Weight392.46
Molecular Weight (Monoisotopic)392.1736
TypeSmall molecule
Max Phase--
Target IDTar81
Target NameNone
SynonymsNone
SmilesCO/C=C(/C(=O)OC)c1ccccc1COc1cc(-c2ccc(C)cc2)nn1C
InchiInChI=1S/C23H24N2O4/c1-16-9-11-17(12-10-16)21-13-22(25(2)24-21)29-14-18-7-5-6-8-19(18)20(15-27-3)23(26)28-4/h5-13,15H,14H2,1-4H3/b20-15+
Inchi KeyWEPLRYQAAKQXOH-HMMYKYKNSA-N
Molecular SpeciesNEUTRAL
Targets5.0
Bioactivities12.0
Np Likeness Score-0.51
Records Key['12']
Records Name['methyl 3-methoxy-2-(2-((1-methyl-3-p-tolyl-1H-pyrazol-5-yloxy)methyl)phenyl)acrylate']
Withdrawn FlagFalse
Orphan-1

Molecular Structure

2D Molecular Structure