| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2011 | 31 | No |
Popular Name: Prunin Prunin
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) | 0.33 | -5.07 | -14.28 | 6 | 10 | 0 | 166 | 434.397 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.33 | -4.08 | -61.34 | 5 | 10 | -1 | 169 | 433.389 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0065123A1; EP0416713A1; EP0416713B2; EP0719554A1; EP0742012A2; US3984394; US4031260; US4617293; US4971812; US5650433; WO1989000806A1; WO2000043490A2 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.