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Compound Detail

CHEMBL4301039

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CN(C/C=C/C=C/C=C/c1ccc(C(F)(F)F)cc1)Cc1ccc2c(c1)OCCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4301039
Phase Preclinical
Structure Type MOL
InChI Key OVGHVDBMUXRMSA-NYYLHBDNSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

415.4
MW (Da)
5.73
ALogP
3
HBA
0
HBD
21.7
PSA (Ų)
0.54
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 C24H24F3NO2
MW 415.45
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.52

Data from ChEMBL 36 via Core Engine