| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 16th, 2008 | 29 | 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) | 2.96 | 8.17 | -60.04 | 0 | 6 | -1 | 79 | 398.41 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | 7.6 | -12.45 | 1 | 6 | 0 | 76 | 399.418 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.38 | 8.02 | -14.06 | 0 | 6 | 0 | 73 | 399.418 | 7 | ↓ |
