| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 27 | Yes |
Popular Name: 5-[2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-3-phenyl-1,2,4-oxadiazole 5-[2-[2-(4-methylpiperazin-1-yl)…
| 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) | 3.66 | 8.73 | -39.36 | 1 | 6 | 1 | 56 | 365.457 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 6.36 | -13.12 | 0 | 6 | 0 | 55 | 364.449 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0934288A1 | IBM Patent Data |
