| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 17th, 2010 | 31 | No |
None
| 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) | -2.46 | 1.35 | -77.94 | 4 | 11 | -1 | 171 | 450.449 | 8 | ↓ |
| Lo Low (pH 4.5-6) | -2.46 | 1.67 | -100.89 | 5 | 11 | 0 | 173 | 451.457 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4344944; US4415567 | IBM Patent Data |
