ABT-491
| SMILES | C#Cc1cccc2c1c(cn2C(=O)N(C)C)C(=O)c1ccc(c(c1)F)Cn1c(C)nc2c1ccnc2 |
| InChIKey | GDLNHSUSOZEAOR-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 479.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
| Structure pdb | 5ZKQ |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| PAF | PTAFR | Human | Platelet-activating factor | A | pKi | 9.2 | 9.2 | 9.2 | Guide to Pharmacology |
| PAF | PTAFR | Human | Platelet-activating factor | A | pKi | 9.24 | 9.24 | 9.24 | ChEMBL |
| PAF | PTAFR | Guinea pig | Platelet-activating factor | A | pKi | 8.74 | 8.87 | 9.0 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |