| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2006 | 17 | No |
None
| 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) | 4.16 | 4.79 | -8.92 | 1 | 2 | 0 | 33 | 249.672 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.16 | 5.56 | -44.98 | 0 | 2 | -1 | 35 | 248.664 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 6.48 | -7.57 | 2 | 2 | 0 | 34 | 250.68 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 4.16 | 5.2 | -33.76 | 2 | 2 | 1 | 34 | 250.68 | 2 | ↓ |
