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Compound Detail

CHEMBL3040343

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O=C(O)C[C@H](O)C[C@H](O)/C=C/c1c(Cl)cc(Cl)cc1-c1ccc(F)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3040343
Phase Preclinical
Structure Type MOL
InChI Key VFZYNIDSEIHLBG-XEVLESSRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

399.2
MW (Da)
4.40
ALogP
3
HBA
3
HBD
77.8
PSA (Ų)
0.65
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17Cl2FO4
MW 399.25
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness 0.18

Data from ChEMBL 36 via Core Engine