| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 36 | No |
| 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) | 5.07 | 12.23 | -53.32 | 0 | 9 | -1 | 128 | 500.512 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.07 | 12.11 | -14.84 | 1 | 9 | 0 | 126 | 501.52 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.49 | 0.02 | -14.89 | 0 | 9 | 0 | 122 | 501.52 | 6 | ↓ |
