| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 12 | 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) | 0.34 | 1.09 | -46.15 | 4 | 3 | 1 | 56 | 182.272 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.34 | -0.61 | -5 | 3 | 3 | 0 | 51 | 181.264 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.34 | 1.55 | -89.83 | 5 | 3 | 2 | 57 | 183.28 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
