| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2006 | 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) | 4.35 | 14.49 | -21.29 | 1 | 5 | 0 | 60 | 406.486 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.69 | 14.03 | -44.25 | 0 | 5 | -1 | 61 | 405.478 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.53 | 13.89 | -47.08 | 0 | 5 | -1 | 61 | 405.478 | 4 | ↓ |
