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Compound Detail

CHEMBL5181640

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NC(=O)Cc1cc(O)ccc1Oc1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5181640
Phase Preclinical
Structure Type MOL
InChI Key BNDYJZFMNUWZRJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

277.7
MW (Da)
2.87
ALogP
3
HBA
2
HBD
72.5
PSA (Ų)
0.90
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H12ClNO3
MW 277.71
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.40

Literature References

PubMed DOI Target Context # Activities
35500061 10.1021/acs.jmedchem.1c02177 Calcium/calmodulin-dependent protein kinase type II subunit alpha 2

Data from ChEMBL 36 via Core Engine