| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2010 | 31 | 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) | 3.47 | 4.09 | -56.13 | 2 | 8 | 1 | 95 | 464.951 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.47 | 2.6 | -45.73 | 1 | 8 | 0 | 97 | 463.943 | 7 | ↓ |
