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Compound Detail

CHEMBL1207075

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Cc1c(/C=C/[C@@H](O)C[C@@H](O)CC(=O)O)c(-c2ccc(F)cc2)cn1C(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1207075
Phase Preclinical
Structure Type MOL
InChI Key HXBKHTSJLRQDIB-RKQNLGICSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

375.4
MW (Da)
3.78
ALogP
4
HBA
3
HBD
82.7
PSA (Ų)
0.66
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 C21H26FNO4
MW 375.44
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness 0.16

Data from ChEMBL 36 via Core Engine