| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2010 | 34 | 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) | 9.56 | 18.19 | -13.12 | 2 | 4 | 0 | 75 | 474.726 | 22 | ↓ |
| Hi High (pH 8-9.5) | 9.56 | 20.22 | -136.83 | 0 | 4 | -2 | 80 | 472.71 | 22 | ↓ |
| Mid Mid (pH 6-8) | 9.56 | 19.2 | -52.65 | 1 | 4 | -1 | 77 | 473.718 | 22 | ↓ |
