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Compound Detail

CHEMBL5498922

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Cc1n(C(C)C)c2c([n+]1C)C(=O)c1cc3ccccc3cc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498922
Phase Preclinical
Structure Type MOL
InChI Key ZMTNXSOGFDFQBA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

319.4
MW (Da)
3.13
ALogP
3
HBA
0
HBD
43.0
PSA (Ų)
0.51
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H19N2O2+
MW 319.38
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.11

Data from ChEMBL 36 via Core Engine