Compound Detail
CHEMBL132689
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
Basic Information
| ChEMBL ID | CHEMBL132689 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | DTTHOWQLCVTQCM-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
1
PK Parameters
9
Publications
0
Known Names
Molecular Properties
382.4
MW (Da)
3.77
ALogP
6
HBA
1
HBD
71.4
PSA (Ų)
0.57
QED
0
Ro5 Violations
2
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 1 meas. best 8.97
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| cGMP-specific 3',5'-cyclic phosphodiesterase CHEMBL1827 | Ki | 8.97 | 8.97 | 1.1 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| F | 12.0 | % | Rattus norvegicus |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| cGMP-specific 3',5'-cyclic phosphodiesterase | Ki | = | 1.08 | nM | 8.97 | Phosphodiesterase 5 activity of human corpus cavernosum | 12213052 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 15771456 | 10.1021/jm0401098 | Unchecked | 6 |
| 15771456 | 10.1021/jm0401098 | cGMP-specific 3',5'-cyclic phosphodiesterase | 2 |
| 12213052 | 10.1021/jm025545d | cGMP-specific 3',5'-cyclic phosphodiesterase | 1 |
| 12213052 | 10.1021/jm025545d | Phosphodiesterase, PDE1/PDE5 | 1 |
| 12213052 | 10.1021/jm025545d | Phosphodiesterase 2 and 5 (PDE2 and PDE5) | 1 |
| 12213052 | 10.1021/jm025545d | Phosphodiesterase 3 and 5 (PDE3 and PDE5) | 1 |
| 12213052 | 10.1021/jm025545d | Phosphodiesterase 4 and 5 (PDE4 and PDE5) | 1 |
| 12213052 | 10.1021/jm025545d | Unchecked | 1 |
| 15771456 | 10.1021/jm0401098 | ADMET | 1 |
Data from ChEMBL 36 via Core Engine