Compound Detail
CHEMBL190
THEOPHYLLINE ANHYDROUS 💊 Approved Drug
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💊 Approved Drug
Basic Information
| ChEMBL ID | CHEMBL190 |
| Name | THEOPHYLLINE ANHYDROUS |
| Phase | Approved |
| Structure Type | MOL |
| InChI Key | ZFXYFBGIUFBOJW-UHFFFAOYSA-N |
| Therapeutic | ✓ Yes |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
180.2
MW (Da)
-1.04
ALogP
5
HBA
1
HBD
72.7
PSA (Ų)
0.56
QED
0
Ro5 Violations
0
Rot. Bonds
Drug Information
| Molecule Type | Protein |
| First Approval | 1940 |
| Availability | Prescription |
| Chirality | Achiral |
Activity Summary
IC50 1 meas. best 6.55
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 6.55 | 6.55 | 280.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 280.0 | nM | 6.55 | Inhibition of PDE1 (unknown origin) | 38614063 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 39026647 | 10.1039/d4md00244j | Albumin | 3 |
| 38614063 | 10.1016/j.ejmech.2024.116386 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine