| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 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) | 3.94 | 8.92 | -54.54 | 0 | 5 | -1 | 70 | 437.324 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.38 | 7.89 | -24.27 | 1 | 5 | 0 | 67 | 438.332 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 8.85 | -14.52 | 0 | 5 | 0 | 64 | 438.332 | 5 | ↓ |
