| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 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) | 4.39 | 11.96 | -68.46 | 1 | 7 | 0 | 87 | 503.624 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.39 | 9.92 | -57.72 | 0 | 7 | -1 | 86 | 502.616 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.39 | 11.63 | -53.02 | 2 | 7 | 1 | 84 | 504.632 | 10 | ↓ |
