| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2009 | 35 | 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) | 5.23 | 13.23 | -70.48 | 1 | 6 | 0 | 78 | 489.641 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.23 | 10.7 | -58.43 | 0 | 6 | -1 | 77 | 488.633 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 5.23 | 12.41 | -49.33 | 2 | 6 | 1 | 75 | 490.649 | 8 | ↓ |
