| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2011 | 24 | 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) | 1.39 | 3.62 | -41.11 | 3 | 4 | 1 | 48 | 339.406 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.39 | 1.89 | -9.44 | 2 | 4 | 0 | 47 | 338.398 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.39 | 5.92 | -106.77 | 4 | 4 | 2 | 49 | 340.414 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
