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Compound Detail

CHEMBL1205856

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Cc1c(/C=C/[C@@H](O)C[C@@H](O)CC(=O)O)c(-c2ccc(F)cc2)c(C)n1-c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1205856
Phase Preclinical
Structure Type MOL
InChI Key WNFLCKCKUBDEAY-ITWZMISCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

423.5
MW (Da)
4.50
ALogP
4
HBA
3
HBD
82.7
PSA (Ų)
0.50
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 C25H26FNO4
MW 423.48
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness 0.02

Data from ChEMBL 36 via Core Engine