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Compound Detail

CHEMBL3546836

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COc1ccc(OC)c2c1c(OC)cc1c(=O)c(OCCOC(=O)CN)c(-c3cccc(F)c3)oc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3546836
Phase Preclinical
Structure Type MOL
InChI Key BZKLVKMFJCRZRN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

497.5
MW (Da)
3.66
ALogP
9
HBA
1
HBD
119.5
PSA (Ų)
0.21
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H24FNO8
MW 497.48
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness 0.08

Data from ChEMBL 36 via Core Engine