| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 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) | 1.73 | 7.83 | -60.98 | 2 | 8 | 0 | 102 | 420.469 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.73 | 5.31 | -49.35 | 1 | 8 | -1 | 101 | 419.461 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.73 | 6.69 | -56.81 | 3 | 8 | 1 | 100 | 421.477 | 6 | ↓ |
