| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 14th, 2008 | 27 | 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) | 3.05 | 8.23 | -58.33 | 3 | 5 | 1 | 63 | 394.467 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 7.39 | -44.45 | 2 | 5 | 0 | 69 | 393.459 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.05 | 5.97 | -17.32 | 2 | 5 | 0 | 61 | 393.459 | 8 | ↓ |
