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Compound Detail

CHEMBL173439

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CC(=O)Oc1ccccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL173439
Phase Preclinical
Structure Type MOL
InChI Key LSFYCRUFNRBZNC-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

152.2
MW (Da)
1.32
ALogP
3
HBA
1
HBD
46.5
PSA (Ų)
0.49
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H8O3
MW 152.15
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness 0.90

Activity Summary

Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
11958996 10.1016/s0960-894x(02)00053-7 Unchecked 2
10417314 10.1042/0264-6021:3410529 Monocarboxylate transporter 1 1
10417314 10.1042/0264-6021:3410529 Monocarboxylate transporter 2 1

Data from ChEMBL 36 via Core Engine