| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 28 | 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) | -0.19 | 0.24 | -25.82 | 5 | 11 | 0 | 163 | 387.352 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.27 | -1.56 | -76.17 | 4 | 11 | -1 | 166 | 386.344 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0506830A1; EP0962463A1; WO1991009033A1 | IBM Patent Data |
