| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 20 | 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) | 1.45 | 2.02 | -50.73 | 3 | 5 | 1 | 80 | 312.44 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 1.63 | -11.8 | 2 | 5 | 0 | 78 | 311.432 | 3 | ↓ |
