| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 13 | No |
| 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) | 1.55 | 0.21 | -7.1 | 3 | 4 | 0 | 60 | 178.191 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 0.98 | -43.46 | 2 | 4 | -1 | 63 | 177.183 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0415102A1; EP0415102B1; US3975531; US5053511; US5179119; US5464846; US5621116; US5686626 | IBM Patent Data |
