| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 30 | Yes |
| 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) | 3.25 | 9.54 | -13.86 | 0 | 6 | 0 | 53 | 405.546 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 9.84 | -35.85 | 1 | 6 | 1 | 54 | 406.554 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.25 | 12.21 | -84.92 | 2 | 6 | 2 | 55 | 407.562 | 3 | ↓ |
