| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2009 | 23 | 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) | 4.77 | 11.28 | -35.13 | 1 | 3 | 1 | 23 | 324.529 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.77 | 9 | -2.39 | 0 | 3 | 0 | 22 | 323.521 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5010101; US5177103; US5376660; US5447927; US5571930 | IBM Patent Data |
