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Compound Detail

CHEMBL1730022

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Cn1c2ccccc2c2c(=O)oc3ccccc3c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1730022
Phase Preclinical
Structure Type MOL
InChI Key NPHMABSNHRNCIE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

249.3
MW (Da)
3.44
ALogP
3
HBA
0
HBD
35.1
PSA (Ų)
0.45
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H11NO2
MW 249.27
Aromatic Rings 4
Heavy Atoms 19
NP-Likeness -0.06

Data from ChEMBL 36 via Core Engine