| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 30 | 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) | 2.53 | 13.33 | -104.79 | 2 | 8 | 2 | 67 | 418.586 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 10.99 | -14.92 | 0 | 8 | 0 | 65 | 416.57 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 13.13 | -46.57 | 1 | 8 | 1 | 66 | 417.578 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 11.19 | -38.39 | 1 | 8 | 1 | 66 | 417.578 | 5 | ↓ |
