| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 31 | 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) | 3.60 | 9.6 | -20.51 | 1 | 9 | 0 | 104 | 458.569 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.78 | 8.4 | -51.42 | 0 | 9 | -1 | 110 | 457.561 | 7 | ↓ |
