| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 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) | 4.52 | 10.81 | -57.8 | 0 | 7 | -1 | 92 | 485.56 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.52 | 10.04 | -14.12 | 1 | 7 | 0 | 89 | 486.568 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 4.52 | 10.52 | -43.44 | 2 | 7 | 1 | 90 | 487.576 | 11 | ↓ |
