| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 36 | 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) | 3.92 | 8.74 | -61.58 | 0 | 7 | -1 | 82 | 485.56 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.92 | 11.01 | -68.77 | 1 | 7 | 0 | 83 | 486.568 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.92 | 10.25 | -48.39 | 2 | 7 | 1 | 81 | 487.576 | 7 | ↓ |
