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Compound Detail

CHEMBL484604

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O=C(CCc1nnn2c1ncc1cc(O)ccc12)Nc1ccccc1C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL484604
Phase Preclinical
Structure Type MOL
InChI Key QULPVSFZSUEJGQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

377.4
MW (Da)
2.25
ALogP
7
HBA
3
HBD
129.7
PSA (Ų)
0.49
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H15N5O4
MW 377.36
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.14

Literature References

PubMed DOI Target Context # Activities
19309152 10.1021/jm900151e Hydroxycarboxylic acid receptor 2 2
19309152 10.1021/jm900151e Adipocyte 1

Data from ChEMBL 36 via Core Engine