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Compound Detail

CHEMBL5028711

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CCn1ccnc1-c1cc2ccc(OC)cc2o1

Basic Information

ChEMBL ID CHEMBL5028711
Phase Preclinical
Structure Type MOL
InChI Key VZNGNJCAVCHKEH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

242.3
MW (Da)
3.32
ALogP
4
HBA
0
HBD
40.2
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H14N2O2
MW 242.28
Aromatic Rings 3
Heavy Atoms 18
NP-Likeness -0.52

Data from ChEMBL 36 via Core Engine