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Compound Detail

CHEMBL4596571

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CCCN(CCCCNC(=O)c1cc2ccccc2[nH]1)CC1CC1c1ccc(F)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596571
Phase Preclinical
Structure Type MOL
InChI Key HKDMXVFAYYQTRF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

421.6
MW (Da)
5.33
ALogP
2
HBA
2
HBD
48.1
PSA (Ų)
0.41
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H32FN3O
MW 421.56
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -0.95

Data from ChEMBL 36 via Core Engine