| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 25th, 2008 | 27 | 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) | 4.63 | 9.12 | -9.12 | 1 | 5 | 0 | 59 | 448.133 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.81 | 7.61 | -32.34 | 0 | 5 | -1 | 65 | 447.125 | 4 | ↓ |
