| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2009 | 30 | 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) | 3.17 | 8.23 | -53.45 | 2 | 6 | 1 | 57 | 447.909 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 6 | -16.44 | 1 | 6 | 0 | 56 | 446.901 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 8.23 | -47.69 | 2 | 6 | 1 | 57 | 447.909 | 6 | ↓ |
