Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL319809

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CCc1nc(-c2cc(OCC3CC3)cc(OCC3CC3)c2)c2cc(OCCO)c(OCCO)cc2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL319809
Phase Preclinical
Structure Type MOL
InChI Key DGJDWDMMBWQWCH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

494.6
MW (Da)
4.18
ALogP
8
HBA
2
HBD
103.2
PSA (Ų)
0.34
QED
0
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H34N2O6
MW 494.59
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -0.53

Literature References

PubMed DOI Target Context # Activities
9873643 10.1016/s0960-894x(98)00508-3 Phosphodiesterase 3 1
9873643 10.1016/s0960-894x(98)00508-3 3',5'-cyclic-AMP phosphodiesterase 4A 1
9873643 10.1016/s0960-894x(98)00508-3 3',5'-cyclic-AMP phosphodiesterase 4B 1
9873643 10.1016/s0960-894x(98)00508-3 3',5'-cyclic-AMP phosphodiesterase 4D 1

Data from ChEMBL 36 via Core Engine