| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2008 | 32 | 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) | 4.23 | 14.26 | -16.46 | 1 | 9 | 0 | 119 | 451.508 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.41 | 13.98 | -42.31 | 0 | 9 | -1 | 120 | 450.5 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 9.38 | -11.27 | 1 | 6 | 0 | 68 | 410.514 | 8 | ↓ |
