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Compound Detail

CHEMBL1208063

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O=P(O)(O)C(CCCc1cc(Oc2ccc(F)cc2)ccc1F)S(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208063
Phase Preclinical
Structure Type MOL
InChI Key GNVJUODFQNFGPT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

422.3
MW (Da)
3.47
ALogP
4
HBA
3
HBD
121.1
PSA (Ų)
0.44
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H17F2O7PS
MW 422.34
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.51

Data from ChEMBL 36 via Core Engine