| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2008 | 30 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.00 | 6.37 | -61.79 | 0 | 7 | -1 | 86 | 409.462 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 8.88 | -46.31 | 1 | 7 | 1 | 81 | 411.478 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 8.71 | -81.49 | 1 | 7 | 0 | 87 | 410.47 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.00 | 5.55 | -16.69 | 1 | 7 | 0 | 83 | 410.47 | 7 | ↓ |
