| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 28 | Yes |
Popular Name: (1S)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-1-[(3R)-3-methyl-2H-1,4-benzodioxin-3-yl]ethanol (1S)-2-[4-(2-methoxyphenyl)piper…
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) | 2.89 | 5.43 | -8.45 | 1 | 6 | 0 | 54 | 384.476 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.89 | 7.69 | -41.64 | 2 | 6 | 1 | 56 | 385.484 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4948797 | IBM Patent Data |
