| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 32 | No |
None
| 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) | 5.77 | 13.83 | -101.6 | 0 | 7 | -2 | 108 | 469.95 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.77 | 11.02 | -92.53 | 1 | 7 | -1 | 110 | 470.958 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.77 | 12.45 | -102.18 | 1 | 7 | -1 | 110 | 470.958 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 5.77 | 14.14 | -75.33 | 1 | 7 | -1 | 110 | 470.958 | 6 | ↓ |
