| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 30 | No |
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) | 3.38 | 11.65 | -72.31 | 2 | 8 | 1 | 99 | 426.522 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 9.6 | -17.56 | 1 | 8 | 0 | 98 | 425.514 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.38 | 11.79 | -70.22 | 2 | 8 | 1 | 99 | 426.522 | 4 | ↓ |
