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Compound Detail

CHEMBL5397672

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Nc1c(C(=O)c2ccc(O)cc2O)oc2c(O)cccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5397672
Phase Preclinical
Structure Type MOL
InChI Key LOBKHXRTDQKIPV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

285.2
MW (Da)
2.36
ALogP
6
HBA
4
HBD
116.9
PSA (Ų)
0.54
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H11NO5
MW 285.25
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness 0.54

Literature References

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

Data from ChEMBL 36 via Core Engine