| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 10 | No |
| 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) | 1.31 | 5.11 | -35 | 1 | 2 | 1 | 22 | 142.222 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.31 | 2.83 | -5.52 | 0 | 2 | 0 | 20 | 141.214 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0297496B1; EP0469428A1; US5245052; US5302730; US5358949; US5484954; US5610315 | IBM Patent Data |
