| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 8th, 2008 | 34 | 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) | 3.50 | 8.45 | -29.2 | 1 | 9 | 0 | 97 | 481.578 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 7.53 | -48.74 | 0 | 9 | -1 | 103 | 480.57 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.50 | 10.83 | -67.49 | 2 | 9 | 1 | 98 | 482.586 | 8 | ↓ |
