| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2005 | 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) | 3.50 | -3.23 | -24.92 | 4 | 7 | 0 | 107 | 477.652 | 12 | ↓ |
| Hi High (pH 8-9.5) | 3.69 | -2.66 | -77.44 | 3 | 7 | -1 | 113 | 476.644 | 12 | ↓ |
