| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 11th, 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) | 3.24 | 9.74 | -72.51 | 1 | 6 | 0 | 74 | 414.527 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.24 | 7.2 | -56.62 | 0 | 6 | -1 | 73 | 413.519 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.24 | 8.92 | -53.36 | 2 | 6 | 1 | 71 | 415.535 | 9 | ↓ |
