| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 19 | 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) | 2.73 | 4.39 | -57.98 | 3 | 4 | 1 | 55 | 258.297 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 2.97 | -9.4 | 2 | 4 | 0 | 51 | 257.289 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 4.91 | -41.86 | 2 | 4 | 0 | 58 | 257.289 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
