| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2004 | 36 | 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) | 7.31 | 12.99 | -19.15 | 2 | 6 | 0 | 84 | 513.644 | 7 | ↓ |
| Hi High (pH 8-9.5) | 7.77 | 11.74 | -48.81 | 1 | 6 | -1 | 87 | 512.636 | 7 | ↓ |
