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Compound Detail

CHEMBL1208061

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COc1ccc(Oc2ccc(F)cc2)cc1CCCC(P(=O)(O)O)S(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208061
Phase Preclinical
Structure Type MOL
InChI Key RCEOJTHKSXBGNA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

434.4
MW (Da)
3.34
ALogP
5
HBA
3
HBD
130.4
PSA (Ų)
0.40
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 C17H20FO8PS
MW 434.38
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.19

Data from ChEMBL 36 via Core Engine