| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 25 | 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) | 3.67 | 6.19 | -43.12 | 1 | 5 | -1 | 78 | 463.276 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.67 | 6.96 | -88.96 | 0 | 5 | -2 | 81 | 462.268 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 8.14 | -10.15 | 2 | 5 | 0 | 75 | 464.284 | 2 | ↓ |
