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Compound Detail

CHEMBL3794130

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Oc1cc(O)c2c(c1)O[C@]1(c3ccc(O)c(O)c3)O[C@@H]1[C@H]2c1c(O)cc(O)c2c1O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3794130
Phase Preclinical
Structure Type MOL
InChI Key MSVVDBMAVSBGAQ-SDFSDHECSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

576.5
MW (Da)
3.14
ALogP
12
HBA
9
HBD
213.1
PSA (Ų)
0.13
QED
3
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C30H24O12
MW 576.51
Aromatic Rings 4
Heavy Atoms 42
NP-Likeness 2.08

Literature References

PubMed DOI Target Context # Activities
26978121 10.1016/j.ejmech.2015.12.002 3',5'-cyclic-AMP phosphodiesterase 4D 1

Data from ChEMBL 36 via Core Engine