ABT-299
| SMILES | CC(=O)OC[n+]1cccc(c1)[C@H]1SCc2n1ccc2C(=O)c1cn(c2c1ccc(c2)c1ccc(cc1)F)C(=O)N(C)C.[Cl-] |
| InChIKey | NKIONDJYXPXFFL-JSSVAETHSA-M |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 618.2 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| PAF | PTAFR | Human | Platelet-activating factor | A | pKi | 9.5 | 9.5 | 9.5 | Guide to Pharmacology |
| PAF | PTAFR | Human | Platelet-activating factor | A | pKi | 9.01 | 9.01 | 9.01 | ChEMBL |
| PAF | PTAFR | Guinea pig | Platelet-activating factor | A | pKi | 8.42 | 8.42 | 8.42 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |