| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 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) | 1.35 | 11.49 | -118.09 | 3 | 6 | 0 | 93 | 417.456 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 9.48 | -71.12 | 4 | 6 | 1 | 90 | 418.464 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -1.39 | 8.25 | -98.09 | 4 | 6 | 1 | 96 | 418.464 | 3 | ↓ |
