| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2011 | 28 | 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) | 5.08 | 9.95 | -112.01 | 2 | 6 | -2 | 121 | 398.54 | 20 | ↓ |
| Lo Low (pH 4.5-6) | 5.08 | 7.94 | -47.54 | 3 | 6 | -1 | 118 | 399.548 | 20 | ↓ |
| Lo Low (pH 4.5-6) | 5.08 | 5.98 | -9.79 | 4 | 6 | 0 | 115 | 400.556 | 20 | ↓ |
