| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 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 | 4.76 | -37.49 | 2 | 2 | 1 | 29 | 189.282 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 3.56 | -3.23 | 1 | 2 | 0 | 25 | 188.274 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 5.23 | -96.7 | 3 | 2 | 2 | 31 | 190.29 | 1 | ↓ |
