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Compound Detail

CHEMBL4598153

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COc1cc(OC)c(-c2cn3ccc(N4CCCC4)cc3n2)cc1C#N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4598153
Phase Preclinical
Structure Type MOL
InChI Key FAMHLBNOYPFNLY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
3.49
ALogP
6
HBA
0
HBD
62.8
PSA (Ų)
0.72
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20N4O2
MW 348.41
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.45

Data from ChEMBL 36 via Core Engine