| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 32 | 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) | 3.59 | 7.53 | -51.02 | 3 | 6 | 1 | 67 | 461.026 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 6.58 | -11.36 | 2 | 6 | 0 | 63 | 460.018 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.59 | 9.66 | -131.61 | 4 | 6 | 2 | 69 | 462.034 | 10 | ↓ |
