| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 10 | 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) | 0.37 | 1.25 | -33.33 | 3 | 3 | 1 | 48 | 143.21 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.37 | -1.11 | -9.86 | 2 | 3 | 0 | 46 | 142.202 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5814630; US5821246; WO1996015118A1; WO1997030034A1; WO1997030044A1 | IBM Patent Data |
