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Compound Detail

CHEMBL1187112

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CNc1ccc(/C=C/c2cc3cc(O)ccc3o2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187112
Phase Preclinical
Structure Type MOL
InChI Key IBFRFRIPKLYZJP-XBXARRHUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

265.3
MW (Da)
4.35
ALogP
3
HBA
2
HBD
45.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15NO2
MW 265.31
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness 0.45

Data from ChEMBL 36 via Core Engine