| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2009 | 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) | 6.02 | 7.64 | -53.58 | 1 | 7 | -1 | 115 | 410.475 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.56 | 10.41 | -35.54 | 1 | 7 | -1 | 115 | 410.475 | 6 | ↓ |
| Mid Mid (pH 6-8) | 5.56 | 9.63 | -20.32 | 2 | 7 | 0 | 112 | 411.483 | 6 | ↓ |
