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Compound Detail

CHEMBL5281157

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N#Cc1ccc(Oc2ccc3c(c2)COC3O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5281157
Phase Preclinical
Structure Type MOL
InChI Key JSMNHFCYNIMYQK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

253.3
MW (Da)
2.87
ALogP
4
HBA
1
HBD
62.5
PSA (Ų)
0.89
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H11NO3
MW 253.26
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.07

Literature References

PubMed DOI Target Context # Activities
34875836 10.1021/acs.jmedchem.1c01691 3',5'-cyclic-AMP phosphodiesterase 4B 1

Data from ChEMBL 36 via Core Engine