| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 17th, 2009 | 9 | 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) | 0.63 | -0.22 | -34.83 | 4 | 3 | 1 | 60 | 131.199 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.63 | -1.25 | -6.07 | 3 | 3 | 0 | 55 | 130.191 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0220939A1; US4797394; US4868296 | IBM Patent Data |
