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Compound Detail

CHEMBL284081

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COc1ccc(C2CNC(=O)C2)cc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL284081
Phase Preclinical
Structure Type MOL
InChI Key PAIFAXUSHBVXHY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

207.2
MW (Da)
1.00
ALogP
3
HBA
2
HBD
58.6
PSA (Ų)
0.76
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 C11H13NO3
MW 207.23
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness 1.06

Literature References

PubMed DOI Target Context # Activities
2544722 10.1021/jm00127a009 Phosphodiesterase 1 1
2544722 10.1021/jm00127a009 cGMP-specific 3',5'-cyclic phosphodiesterase 1
2544722 10.1021/jm00127a009 Phosphodiesterase 4 1

Data from ChEMBL 36 via Core Engine