| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 12th, 2010 | 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) | 0.78 | -0.8 | -2.87 | 1 | 3 | 0 | 30 | 133.191 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.78 | 1.28 | -34.02 | 2 | 3 | 1 | 35 | 134.199 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0409025A2; EP0409025A3 | IBM Patent Data |
