| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2008 | 17 | 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) | 2.75 | 1.04 | -13.98 | 1 | 3 | 0 | 42 | 226.279 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.75 | 0.68 | -27.2 | 2 | 3 | 1 | 43 | 227.287 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0815108A1; WO1996029329A1 | IBM Patent Data |
