| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 19 | Yes |
Popular Name: 1-amino-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol 1-amino-3-[4-(2-methoxyphenyl)pi…
| 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) | 0.10 | -1.27 | -52.54 | 4 | 5 | 1 | 64 | 266.365 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.10 | -1.65 | -7.51 | 3 | 5 | 0 | 62 | 265.357 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.10 | 1.12 | -111.26 | 5 | 5 | 2 | 65 | 267.373 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5932584 | IBM Patent Data |
