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Compound Detail

CHEMBL571589

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COc1ccc(/N=C2\C(=O)Nc3ccc(C)cc32)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL571589
Phase Preclinical
Structure Type MOL
InChI Key KTQRVRPEWXKIPG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

266.3
MW (Da)
3.08
ALogP
3
HBA
1
HBD
50.7
PSA (Ų)
0.91
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 C16H14N2O2
MW 266.30
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.90

Literature References

PubMed DOI Target Context # Activities
19651509 10.1016/j.bmcl.2009.03.004 Transthyretin 3

Data from ChEMBL 36 via Core Engine