| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 31 | 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) | 4.34 | 9.4 | -35.81 | 6 | 7 | 1 | 118 | 456.876 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.34 | 9.46 | -14.12 | 5 | 7 | 0 | 117 | 455.868 | 5 | ↓ |
