| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 15th, 2010 | 34 | 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) | 5.38 | 10.51 | -15 | 2 | 7 | 0 | 88 | 463.578 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.15 | 10.84 | -57.94 | 0 | 7 | -1 | 87 | 462.57 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.15 | 10.85 | -51.8 | 0 | 7 | -1 | 87 | 462.57 | 9 | ↓ |
| Hi High (pH 8-9.5) | 5.38 | 11.5 | -44.67 | 1 | 7 | -1 | 91 | 462.57 | 9 | ↓ |
