| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2006 | 36 | 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) | 3.17 | 8.37 | -64.8 | 1 | 8 | -1 | 108 | 488.516 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 8.54 | -18.82 | 2 | 8 | 0 | 106 | 489.524 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.58 | 8.9 | -19.15 | 1 | 8 | 0 | 102 | 489.524 | 9 | ↓ |
