| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2010 | 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) | 3.52 | 4.7 | -17.92 | 3 | 7 | 0 | 100 | 454.708 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.52 | 5.61 | -53.52 | 2 | 7 | -1 | 103 | 453.7 | 7 | ↓ |
