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Compound Detail

CHEMBL4596059

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Cc1c(C(=O)Nc2nc(C3CCC3)c(CCN3CCCCC3)s2)cnn1-c1ccc(F)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4596059
Phase Preclinical
Structure Type MOL
InChI Key AMCRGAFJVJDYAS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

467.6
MW (Da)
5.32
ALogP
6
HBA
1
HBD
63.0
PSA (Ų)
0.51
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H30FN5OS
MW 467.61
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -2.15

Data from ChEMBL 36 via Core Engine