| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2009 | 38 | Yes |
| 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) | 4.17 | 7.69 | -50.99 | 5 | 8 | 1 | 125 | 529.69 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.17 | 7.31 | -14.12 | 4 | 8 | 0 | 123 | 528.682 | 7 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 8.07 | -96.01 | 6 | 8 | 2 | 126 | 530.698 | 7 | ↓ |
