| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2010 | 30 | 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) | 4.12 | 9.46 | -53.77 | 2 | 9 | 1 | 108 | 420.534 | 11 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 7.18 | -23.25 | 1 | 9 | 0 | 107 | 419.526 | 11 | ↓ |
