| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 25 | 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) | 3.52 | 6.65 | -10.75 | 2 | 6 | 0 | 84 | 422.304 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.52 | 6.11 | -16.48 | 2 | 6 | 0 | 84 | 422.304 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.98 | 4.71 | -43.63 | 1 | 6 | -1 | 87 | 421.296 | 5 | ↓ |
