| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 29 | 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) | 1.96 | 5.68 | -42.66 | 0 | 7 | -1 | 86 | 395.435 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 7.56 | -44.47 | 2 | 7 | 1 | 84 | 397.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.38 | 7.96 | -46.56 | 1 | 7 | 1 | 81 | 397.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 8.01 | -52.47 | 1 | 7 | 0 | 87 | 396.443 | 6 | ↓ |
