| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 9th, 2006 | 16 | 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) | 2.23 | 1.23 | -9.96 | 2 | 6 | 0 | 95 | 219.2 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 3.57 | -44.4 | 1 | 6 | -1 | 98 | 218.192 | 2 | ↓ |
