| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 10 | 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) | -0.26 | 2.45 | -92.18 | 5 | 3 | 2 | 58 | 141.218 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.26 | 1.98 | -44.95 | 4 | 3 | 1 | 56 | 140.21 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.26 | 1.95 | -48.48 | 4 | 3 | 1 | 56 | 140.21 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5559113; US5708171 | IBM Patent Data |
