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Compound Detail

CHEMBL5423130

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Cc1c(C(=O)c2ccc(O)cc2O)oc2c(O)cccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5423130
Phase Preclinical
Structure Type MOL
InChI Key PMYCATMCPYRMPW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

284.3
MW (Da)
3.09
ALogP
5
HBA
3
HBD
90.9
PSA (Ų)
0.63
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H12O5
MW 284.27
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness 0.36

Literature References

PubMed DOI Target Context # Activities
36462443 10.1016/j.ejmech.2022.114972 Tyrosinase 1

Data from ChEMBL 36 via Core Engine