| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 21st, 2014 | 18 | 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) | -2.35 | -1.5 | -70.11 | 5 | 8 | 1 | 121 | 252.254 | 2 | ↓ |
| Hi High (pH 8-9.5) | -2.35 | -1.76 | -20.78 | 4 | 8 | 0 | 119 | 251.246 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.