| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2008 | 25 | 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) | 4.41 | 9.82 | -33.72 | 1 | 5 | 0 | 58 | 376.551 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.41 | 7.6 | -49.41 | 0 | 5 | -1 | 56 | 375.543 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 4.41 | 9.21 | -46.1 | 2 | 5 | 1 | 55 | 377.559 | 4 | ↓ |
