| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 34 | 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) | 5.42 | 13.88 | -48.96 | 1 | 6 | 0 | 74 | 529.475 | 12 | ↓ |
| Hi High (pH 8-9.5) | 5.42 | 11.58 | -40.25 | 0 | 6 | -1 | 73 | 528.467 | 12 | ↓ |
| Lo Low (pH 4.5-6) | 5.42 | 12.76 | -49.97 | 2 | 6 | 1 | 71 | 530.483 | 12 | ↓ |
