| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 31 | 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) | 2.01 | 6.25 | -58.49 | 0 | 7 | -1 | 86 | 460.963 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 7.96 | -43.97 | 2 | 7 | 1 | 84 | 462.979 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | -2.61 | -48.79 | 1 | 7 | 1 | 81 | 462.979 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.01 | 8.6 | -72.28 | 1 | 7 | 0 | 87 | 461.971 | 6 | ↓ |
