| 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) | 3.48 | 9.2 | -44.66 | 2 | 5 | 1 | 50 | 462.014 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.48 | 6.66 | -11.52 | 1 | 5 | 0 | 48 | 461.006 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.48 | 11.42 | -105.61 | 3 | 5 | 2 | 51 | 463.022 | 10 | ↓ |
