| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2009 | 35 | 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) | 2.78 | 7.51 | -46.46 | 4 | 8 | 1 | 104 | 499.657 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 7.51 | -65.06 | 3 | 8 | 0 | 106 | 498.649 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 6.05 | -47.92 | 2 | 8 | -1 | 102 | 497.641 | 7 | ↓ |
