| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2010 | 33 | 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) | 5.07 | 14.67 | -120.32 | 2 | 5 | 2 | 48 | 446.591 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.07 | 12.4 | -54.54 | 1 | 5 | 1 | 47 | 445.583 | 3 | ↓ |
| Hi High (pH 8-9.5) | 5.07 | 12.14 | -44.93 | 1 | 5 | 1 | 47 | 445.583 | 3 | ↓ |
