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Compound Detail

CHEMBL1625514

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O=C(C[n+]1cc2ccccc2c2ccccc21)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1625514
Phase Preclinical
Structure Type MOL
InChI Key UWIOKYAIGKSWAX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

298.4
MW (Da)
4.16
ALogP
1
HBA
0
HBD
20.9
PSA (Ų)
0.32
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 C21H16NO+
MW 298.37
Aromatic Rings 4
Heavy Atoms 23
NP-Likeness -0.29

Data from ChEMBL 36 via Core Engine