| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 31 | 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) | -0.52 | -9.04 | -20 | 8 | 12 | 0 | 211 | 438.341 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | -8.12 | -50.27 | 7 | 12 | -1 | 213 | 437.333 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | -8.12 | -52.85 | 7 | 12 | -1 | 213 | 437.333 | 3 | ↓ |
