Compound Detail
CHEMBL1760552
BUFOBUTANOIC ACID Enter ChEMBL ID:
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Basic Information
| ChEMBL ID | CHEMBL1760552 |
| Name | BUFOBUTANOIC ACID |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | HGOQFBPGMIWJLR-UHFFFAOYSA-N |
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names
Molecular Properties
276.3
MW (Da)
1.40
ALogP
3
HBA
4
HBD
102.4
PSA (Ų)
0.64
QED
0
Ro5 Violations
6
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
EC50 1 meas. best 4.42
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Radical scavenging activity CHEMBL613712 | EC50 | 4.42 | 4.42 | 38300.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Radical scavenging activity | EC50 | = | 38300.0 | nM | 4.42 | Antioxidant activity assessed as DPPH radical scavenging activity by spectrophot... | 21377874 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 21377874 | 10.1016/j.bmcl.2011.02.028 | Radical scavenging activity | 1 |
| 21377874 | 10.1016/j.bmcl.2011.02.028 | Tyrosinase | 1 |
Data from ChEMBL 36 via Core Engine