| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2009 | 16 | Yes |
None
| 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) | 2.20 | 3.71 | -4.03 | 0 | 3 | 0 | 22 | 221.3 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.20 | 5.79 | -35.43 | 1 | 3 | 1 | 23 | 222.308 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5489682; US5491233; WO1995002567A1 | IBM Patent Data |
