| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 23rd, 2009 | 28 | No |
| 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) | 5.40 | 9.37 | -12.39 | 1 | 5 | 0 | 65 | 382.456 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.40 | 10.04 | -46.56 | 0 | 5 | -1 | 68 | 381.448 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0292576A1; US5106871; US5234951 | IBM Patent Data |
