| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2009 | 30 | 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) | 4.12 | 6.05 | -11.64 | 2 | 7 | 0 | 91 | 468.362 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 7.38 | -41.7 | 1 | 7 | -1 | 94 | 467.354 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.12 | 6.82 | -16.74 | 1 | 7 | 0 | 94 | 467.354 | 5 | ↓ |
