| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 18 | Yes |
Popular Name: methyl (4-chlorophenyl)(piperazin-1-yl)acetate methyl (4-chlorophenyl)(piperazi…
Find On: PubMed — Wikipedia — Google
CAS Number: 1049606-14-5
| 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) | 1.76 | 5.22 | -45.08 | 2 | 4 | 1 | 46 | 269.752 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.76 | 3.82 | -5.35 | 1 | 4 | 0 | 42 | 268.744 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 5.79 | -32.61 | 2 | 4 | 1 | 43 | 269.752 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.76 | 7.2 | -119.08 | 3 | 4 | 2 | 47 | 270.76 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
