| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2005 | 28 | 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) | 4.68 | 4.03 | -124.74 | 1 | 6 | -2 | 104 | 395.484 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 5.93 | -49.94 | 2 | 6 | -1 | 101 | 396.492 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 5.4 | -54.48 | 2 | 6 | -1 | 101 | 396.492 | 3 | ↓ |
