| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 9th, 2011 | 40 | No |
Popular Name: Schaftoside Schaftoside
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) | -1.68 | -12.04 | -24.02 | 10 | 14 | 0 | 251 | 564.496 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.68 | -10.98 | -75.16 | 9 | 14 | -1 | 254 | 563.488 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.68 | -11.13 | -61.93 | 9 | 14 | -1 | 254 | 563.488 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1997039355A1 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.