| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2008 | 18 | Yes |
Popular Name: 2-[4-(2-hydroxyethyl)piperazino]-1-(2-thienyl)-1-propanone 2-[4-(2-hydroxyethyl)piperazino]…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4506-87-0 , N/A , [4506-87-0]
2-(4-(2-Hydroxyethyl)piperazin-1-yl)-1-(thiophen-2-yl)propan-1-one
| 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) | 0.98 | 0.69 | -8.82 | 1 | 4 | 0 | 44 | 268.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 3.01 | -35.58 | 2 | 4 | 1 | 45 | 269.39 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 2.8 | -33.8 | 2 | 4 | 1 | 45 | 269.39 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.
