| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2010 | 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) | 5.08 | 15.13 | -109.56 | 4 | 4 | 2 | 40 | 414.597 | 6 | ↓ |
| Hi High (pH 8-9.5) | 5.08 | 10.68 | -9.45 | 2 | 4 | 0 | 38 | 412.581 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.08 | 12.9 | -47.92 | 3 | 4 | 1 | 39 | 413.589 | 6 | ↓ |
