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Compound Detail

CHEMBL154573

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O=C(O)C1Cc2cc(O)c(O)cc2CN1

Basic Information

ChEMBL ID CHEMBL154573
Phase Preclinical
Structure Type MOL
InChI Key UIPNPFUNPXYKGP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

209.2
MW (Da)
0.20
ALogP
4
HBA
4
HBD
89.8
PSA (Ų)
0.50
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H11NO4
MW 209.20
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness 1.06

Literature References

PubMed DOI Target Context # Activities
6325688 10.1021/jm00371a002 GABA-A receptor; anion channel 1

Data from ChEMBL 36 via Core Engine