| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 13th, 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) | 2.05 | 6.41 | -79.64 | 2 | 7 | 0 | 94 | 414.433 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 3.87 | -60.66 | 1 | 7 | -1 | 93 | 413.425 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.05 | 5.59 | -63.4 | 3 | 7 | 1 | 92 | 415.441 | 7 | ↓ |
