| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 41 | 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) | 8.45 | 16.19 | -12.91 | 2 | 6 | 0 | 65 | 591.583 | 9 | ↓ |
| Hi High (pH 8-9.5) | 8.56 | 14.63 | -55.28 | 1 | 6 | -1 | 71 | 590.575 | 9 | ↓ |
| Hi High (pH 8-9.5) | 8.56 | 14.59 | -56.41 | 1 | 6 | -1 | 71 | 590.575 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 8.45 | 16.98 | -27.23 | 3 | 6 | 0 | 66 | 592.591 | 9 | ↓ |
