| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 25th, 2010 | 29 | 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) | 8.54 | 13.85 | -47.87 | 1 | 5 | -1 | 86 | 424.627 | 18 | ↓ |
| Hi High (pH 8-9.5) | 8.54 | 13.9 | -118.88 | 0 | 5 | -2 | 88 | 423.619 | 18 | ↓ |
