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Compound Detail

CHEMBL5028051

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Cc1nnn(C)c1-c1cnc2c3cc(F)c(C(C)(C)O)cc3n([C@H](c3ccccc3)C3CCOCC3)c2c1

Basic Information

ChEMBL ID CHEMBL5028051
Phase Preclinical
Structure Type MOL
InChI Key UJARZGSRRXPOTK-GDLZYMKVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

513.6
MW (Da)
5.68
ALogP
7
HBA
1
HBD
78.0
PSA (Ų)
0.33
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H32FN5O2
MW 513.62
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness -0.61

Data from ChEMBL 36 via Core Engine