| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 26 | 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) | 6.22 | 8.01 | -8.09 | 2 | 5 | 0 | 78 | 448.729 | 1 | ↓ |
| Ref Reference (pH 7) | 6.22 | 7.71 | -8.25 | 2 | 5 | 0 | 78 | 448.729 | 1 | ↓ |
| Mid Mid (pH 6-8) | 7.14 | 3.92 | -100 | 0 | 5 | -2 | 84 | 446.713 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.68 | 5.91 | -42.74 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.68 | 6.06 | -37.83 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 7.14 | 4.42 | -98.11 | 0 | 5 | -2 | 84 | 446.713 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.68 | 6.41 | -40.71 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.68 | 5.78 | -38.13 | 1 | 5 | -1 | 81 | 447.721 | 1 | ↓ |
