| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 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) | 2.82 | 5.73 | -41.1 | 3 | 3 | 1 | 46 | 260.357 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.82 | 4.31 | -5.56 | 2 | 3 | 0 | 41 | 259.349 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0400519A1 | IBM Patent Data |
| PUBCHEM_PATENT_ID | US6121328 | IBM Patent Data |
