In vitro data and calculated physical properties of isoindolin-1-ones 1.
| Compound | IC50 (μM) | Resistance indices | Molecular weight (g mol−1) | Log P | HBD | HBA | |
|---|---|---|---|---|---|---|---|
| 3D7 | FCR3 | ||||||
| 1a | 8.18 | 5.98 | 0.73 | 279.38 | 3.81 | 0 | 1 |
| 1b | 32.60 | 26.90 | 0.83 | 327.42 | 4.34 | 0 | 1 |
| 1c | 15.90 | 27.53 | 1.73 | 313.39 | 4.03 | 0 | 1 |
| 1d | 15.89 | 7.48 | 0.47 | 347.84 | 4.59 | 0 | 1 |
| 1e | 8.73 | 10.45 | 1.20 | 331.38 | 4.36 | 0 | 2 |
| 1f | 13.85 | 4.21 | 0.30 | 381.39 | 5.07 | 0 | 4 |
| 1g | 8.25 | 6.77 | 0.82 | 327.42 | 4.40 | 0 | 1 |
| 1h | 12.28 | 14.38 | 1.17 | 343.42 | 4.03 | 0 | 2 |
| 1i | 27.58 | 28.23 | 1.02 | 343.42 | 4.07 | 0 | 2 |
| 1j | 34.80 | 30.37 | 0.87 | 343.42 | 4.01 | 0 | 2 |
| 1k | 13.08 | 5.22 | 0.40 | 303.35 | 3.35 | 0 | 2 |
| 1l | 9.50 | 6.19 | 0.65 | 319.42 | 4.04 | 0 | 1 |
| 1m | 33.96 | 9.31 | 0.27 | 293.40 | 4.17 | 0 | 1 |
| CQ | 0.01 | 0.11 | 11 | 319.87 | 4.15 | 1 | 2 |