| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 31 | Yes |
None
| 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) | 2.88 | 7.06 | -13.4 | 2 | 7 | 0 | 91 | 412.449 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.88 | 7.82 | -52.94 | 1 | 7 | -1 | 94 | 411.441 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.88 | 7.87 | -40.94 | 3 | 7 | 1 | 93 | 413.457 | 5 | ↓ |
