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Compound Detail

CHEMBL2365279

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CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H]2CC(F)(F)CN2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCC(F)(F)CC1

Basic Information

ChEMBL ID CHEMBL2365279
Phase Preclinical
Structure Type MOL
InChI Key IXDGXZUXUMFSFB-JFJSIVICSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

597.6
MW (Da)
2.46
ALogP
6
HBA
3
HBD
103.0
PSA (Ų)
0.42
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H39F4N5O4
MW 597.65
Aromatic Rings 1
Heavy Atoms 42
NP-Likeness -0.23

Data from ChEMBL 36 via Core Engine