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Compound Detail

CHEMBL395093

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Oc1cccc(/N=C/c2ccc3cccc(O)c3n2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL395093
Phase Preclinical
Structure Type MOL
InChI Key XUJZDCCCOFWSHI-LICLKQGHSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

264.3
MW (Da)
3.40
ALogP
4
HBA
2
HBD
65.7
PSA (Ų)
0.70
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H12N2O2
MW 264.28
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.56

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
17142046 10.1016/j.bmc.2006.11.020 No relevant target 1
17142046 10.1016/j.bmc.2006.11.020 Chlorella vulgaris 1
17142046 10.1016/j.bmc.2006.11.020 Unchecked 1

Data from ChEMBL 36 via Core Engine