| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 21 | 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) | 2.52 | 7.72 | -40.57 | 1 | 6 | 1 | 63 | 294.375 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.52 | 5.41 | -7.25 | 0 | 6 | 0 | 62 | 293.367 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 7.72 | -47.39 | 1 | 6 | 1 | 63 | 294.375 | 7 | ↓ |
