| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 35 | 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) | 4.29 | 12.02 | -74.23 | 1 | 7 | 0 | 83 | 478.589 | 13 | ↓ |
| Hi High (pH 8-9.5) | 4.29 | 9.72 | -57.6 | 0 | 7 | -1 | 82 | 477.581 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 4.29 | 11.21 | -55.39 | 2 | 7 | 1 | 81 | 479.597 | 13 | ↓ |
