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Compound Detail

CHEMBL4596627

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C#CCOc1ccc(/C=N/Nc2c3c(nc4ccccc24)CCCC3)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596627
Phase Preclinical
Structure Type MOL
InChI Key CAUGRGPIGSATHE-LFVJCYFKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

355.4
MW (Da)
4.57
ALogP
4
HBA
1
HBD
46.5
PSA (Ų)
0.41
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H21N3O
MW 355.44
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.37

Data from ChEMBL 36 via Core Engine