| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 28 | Yes |
| 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) | 1.74 | 5.81 | -28.74 | 1 | 8 | 0 | 88 | 401.492 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 5.1 | -56.94 | 0 | 8 | -1 | 94 | 400.484 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.74 | 7.96 | -67.95 | 2 | 8 | 1 | 89 | 402.5 | 5 | ↓ |
