pentanoic acid
| SMILES | CCCCC(=O)O |
| InChIKey | NQPDZGIKBAWPEJ-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 1 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 102.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | Yes |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| CCR2 | CCR2 | Human | Chemokine | A | pKi | 8.8 | 8.8 | 8.81 | ChEMBL |
| CCR2 | CCR2 | Human | Chemokine | A | pKi | 8.8 | 8.8 | 8.8 | Guide to Pharmacology |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| CCR5 | CCR5 | Human | Chemokine | A | pIC50 | 7.08 | 7.08 | 7.08 | Guide to Pharmacology |
| CCR2 | CCR2 | Human | Chemokine | A | pIC50 | 7.68 | 7.68 | 7.68 | ChEMBL |
| CCR2 | CCR2 | Human | Chemokine | A | pEC50 | 7.25 | 7.58 | 7.89 | ChEMBL |
| CCR5 | CCR5 | Human | Chemokine | A | pIC50 | 4.08 | 5.58 | 7.09 | ChEMBL |
| CCR5 | CCR5 | Human | Chemokine | A | pEC50 | 8.05 | 8.18 | 8.35 | ChEMBL |