| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 30 | 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) | -5.41 | -4.76 | -155.15 | 12 | 15 | 0 | 281 | 433.422 | 14 | ↓ |
| Hi High (pH 8-9.5) | -5.37 | -5.09 | -116.97 | 11 | 15 | -1 | 277 | 432.414 | 15 | ↓ |
| Hi High (pH 8-9.5) | -5.41 | -5.04 | -116.38 | 11 | 15 | -1 | 280 | 432.414 | 14 | ↓ |
| Lo Low (pH 4.5-6) | -5.37 | -6.78 | -125.97 | 13 | 15 | 1 | 276 | 434.43 | 15 | ↓ |
| Lo Low (pH 4.5-6) | -5.41 | -6.71 | -125.96 | 13 | 15 | 1 | 279 | 434.43 | 14 | ↓ |
