| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2010 | 28 | 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) | 3.78 | 11.9 | -14.83 | 0 | 5 | 0 | 41 | 394.906 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.78 | 13 | -54.41 | 1 | 5 | 1 | 42 | 395.914 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.78 | 13.47 | -109.75 | 2 | 5 | 2 | 43 | 396.922 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.78 | 12.1 | -34.85 | 1 | 5 | 1 | 42 | 395.914 | 4 | ↓ |
