| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 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) | 4.88 | 9.59 | -11.75 | 2 | 5 | 0 | 59 | 448.876 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.95 | 8.39 | -34.32 | 3 | 5 | 1 | 64 | 449.884 | 5 | ↓ |
| Mid Mid (pH 6-8) | 5.06 | 10.14 | -31.35 | 3 | 5 | 1 | 64 | 449.884 | 5 | ↓ |
