| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2007 | 28 | 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) | 3.65 | 9.75 | -16.39 | 1 | 7 | 0 | 84 | 417.922 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.11 | 8.63 | -47.25 | 0 | 7 | -1 | 87 | 416.914 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.65 | 9.16 | -15.75 | 1 | 7 | 0 | 84 | 417.922 | 4 | ↓ |
