| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2010 | 38 | No |
| 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) | 6.46 | 8.68 | -21.54 | 4 | 8 | 0 | 123 | 502.53 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.46 | 9.44 | -65.29 | 3 | 8 | -1 | 126 | 501.522 | 6 | ↓ |
| Hi High (pH 8-9.5) | 6.46 | 9.46 | -56.85 | 3 | 8 | -1 | 126 | 501.522 | 6 | ↓ |
