| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2011 | 14 | Yes |
| 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) | 1.61 | 3.91 | -38.23 | 2 | 2 | 1 | 20 | 211.354 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 2.7 | -2.06 | 1 | 2 | 0 | 15 | 210.346 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 6.25 | -110.39 | 3 | 2 | 2 | 21 | 212.362 | 4 | ↓ |
