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Compound Detail

CHEMBL5835833

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COCCOc1cc2ncnc(Oc3ccc(NC(=O)Nc4ccc(F)cc4F)c(F)c3)c2c2c1OCCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5835833
Phase Preclinical
Structure Type MOL
InChI Key KCIHMDUROACBFZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

542.5
MW (Da)
5.28
ALogP
8
HBA
2
HBD
113.1
PSA (Ų)
0.29
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H21F3N4O6
MW 542.47
Aromatic Rings 4
Heavy Atoms 39
NP-Likeness -1.25

Data from ChEMBL 36 via Core Engine