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Compound Detail

CHEMBL3307012

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O=C(O)C[n+]1cc2ccccc2c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3307012
Phase Preclinical
Structure Type MOL
InChI Key DRTAWFZWPJFFFR-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

238.3
MW (Da)
2.37
ALogP
1
HBA
1
HBD
41.2
PSA (Ų)
0.55
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H12NO2+
MW 238.27
Aromatic Rings 3
Heavy Atoms 18
NP-Likeness 0.14

Data from ChEMBL 36 via Core Engine