| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 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) | 2.54 | 8.83 | -60.24 | 0 | 7 | -1 | 92 | 416.409 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.54 | 0.51 | -14.12 | 1 | 7 | 0 | 89 | 417.417 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 0.4 | -13.04 | 0 | 7 | 0 | 86 | 417.417 | 5 | ↓ |
