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Comparison of AKT inhibitors studied to XL388
| BindingDBReactant_set_id | Weight | Predicted mTOR pIC50 | HB | AFFINITY [–kcal/mol] | b_1rotN | a_acc | a_don | SlogP | TPSA |
|---|---|---|---|---|---|---|---|---|---|
| 44988 | 559.701 | 9.749 | 4 | 9.8 | 6 | 7 | 1 | 6.001 | 111.53 |
| 329838 | 555.583 | 9.407 | 5 | 8.9 | 7 | 6 | 3 | 5.137 | 104.78 |
| 51061496 | 429.452 | 9.466 | 5 | 9.7 | 5 | 6 | 2 | 2.074 | 123.69 |
AKT inhibitors with better affinity and number of hydrogen bonds than XL388
