| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 8th, 2010 | 15 | 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) | 1.51 | 3.04 | -38.74 | 4 | 2 | 1 | 48 | 202.277 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.51 | 2.82 | -5.78 | 3 | 2 | 0 | 46 | 201.269 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0593559A1; US5472978; WO1993001169A2 | IBM Patent Data |
