| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 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) | 0.33 | 3.68 | -132.23 | 1 | 5 | -2 | 100 | 222.196 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.33 | 2.56 | -50.4 | 2 | 5 | -1 | 98 | 223.204 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.33 | 2.56 | -60.69 | 2 | 5 | -1 | 98 | 223.204 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0379288A1; US4965372; US5036155; US5166400 | IBM Patent Data |
