| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 30th, 2008 | 29 | 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) | 4.65 | 8.36 | -16.41 | 2 | 7 | 0 | 92 | 405.483 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.65 | 9.13 | -54.58 | 1 | 7 | -1 | 95 | 404.475 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.65 | 9.04 | -59.72 | 1 | 7 | -1 | 95 | 404.475 | 4 | ↓ |
