| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 14 | Yes |
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) | 3.23 | 8.23 | -28.82 | 1 | 1 | 1 | 4 | 192.326 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.23 | 7.09 | -1.57 | 0 | 1 | 0 | 3 | 191.318 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0479906A1; EP0634014A1; EP0634014B1; US5466579; US6019925; US6022693; WO1994018561A1 | IBM Patent Data |
