| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2009 | 36 | 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) | 3.99 | 9.47 | -100.89 | 5 | 6 | 2 | 74 | 487.644 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 6.93 | -52.35 | 4 | 6 | 1 | 73 | 486.636 | 5 | ↓ |
