| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2004 | 33 | 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) | 5.31 | 16.26 | -22.01 | 1 | 6 | 0 | 72 | 463.875 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.32 | 16.97 | -44.98 | 1 | 6 | -1 | 73 | 462.867 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.32 | 17.26 | -15.75 | 2 | 6 | 0 | 75 | 463.875 | 4 | ↓ |
