| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2011 | 20 | 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) | 1.38 | 8.03 | -38.96 | 1 | 4 | 1 | 34 | 301.476 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 5.85 | -10.3 | 0 | 4 | 0 | 33 | 300.468 | 6 | ↓ |
