| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2009 | 13 | 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) | -0.74 | -1.86 | -42.54 | 3 | 4 | 1 | 49 | 189.279 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.74 | 0.41 | -116.74 | 4 | 4 | 2 | 51 | 190.287 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0517877A1; US5821246; WO1992012137A1 | IBM Patent Data |
