| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 24th, 2009 | 11 | 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) | 0.69 | 3.16 | -29.8 | 1 | 3 | 1 | 23 | 162.253 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.69 | 0.95 | -3.03 | 0 | 3 | 0 | 22 | 161.245 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0501693A1; EP0501693B1; US5362736 | IBM Patent Data |
