| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 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) | 3.59 | 10.05 | -42.49 | 1 | 7 | 0 | 86 | 473.961 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 7.85 | -45.14 | 0 | 7 | -1 | 85 | 472.953 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.77 | 8.79 | -20.03 | 1 | 7 | 0 | 78 | 473.961 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.77 | 11.12 | -62.15 | 2 | 7 | 1 | 80 | 474.969 | 5 | ↓ |
