| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2006 | 22 | 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) | 2.27 | 9.58 | -18.02 | 1 | 6 | 0 | 73 | 316.386 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.45 | 9.31 | -44.65 | 0 | 6 | -1 | 75 | 315.378 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.62 | 9.51 | -26.36 | 2 | 6 | 1 | 78 | 317.394 | 3 | ↓ |
