| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 29th, 2009 | 21 | Yes |
Popular Name: 4-[2-[4-(2-pyridyl)piperazin-1-yl]ethyl]cyclohexanamine 4-[2-[4-(2-pyridyl)piperazin-1-y…
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) | 1.66 | 8.07 | -93.87 | 4 | 4 | 2 | 48 | 290.455 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 5.84 | -45.31 | 3 | 4 | 1 | 47 | 289.447 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | 8.38 | -155.53 | 5 | 4 | 3 | 49 | 291.463 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US5047406 | IBM Patent Data |
