| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 31 | 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) | 3.88 | 9.49 | -49.09 | 3 | 6 | 1 | 72 | 438.47 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.88 | 7.34 | -16.82 | 2 | 6 | 0 | 71 | 437.462 | 8 | ↓ |
