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Compound Detail

CHEMBL2219568

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CCCCCOc1ccccc1C(O)C/C=C\CCCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2219568
Phase Preclinical
Structure Type MOL
InChI Key LWLDVDBZBIULMW-XQRVVYSFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

320.4
MW (Da)
4.49
ALogP
3
HBA
2
HBD
66.8
PSA (Ų)
0.44
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H28O4
MW 320.43
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness 0.62

Data from ChEMBL 36 via Core Engine