| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 18 | 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) | 2.82 | 6.77 | -40.12 | 2 | 2 | 1 | 20 | 245.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 7.48 | -34.29 | 2 | 2 | 1 | 16 | 245.39 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 5.04 | -2 | 1 | 2 | 0 | 15 | 244.382 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.82 | 8.98 | -110.57 | 3 | 2 | 2 | 21 | 246.398 | 3 | ↓ |
