| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 24th, 2010 | 22 | 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) | 5.05 | 9.96 | -39.55 | 1 | 2 | 1 | 14 | 339.286 | 4 | ↓ |
| Hi High (pH 8-9.5) | 5.05 | 7.41 | -4.46 | 0 | 2 | 0 | 12 | 338.278 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5998405; US6150376; WO2000007994A1 | IBM Patent Data |
