| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 13 | Yes |
Popular Name: 4-(4-METHYL-1-PIPERAZINYL)BUTANOIC ACID 4-(4-METHYL-1-PIPERAZINYL)BUTANO…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 58077-68-2 , N/A
| 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) | 0.02 | 3.32 | -55.79 | 1 | 4 | 0 | 48 | 186.255 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.02 | 0.92 | -45.85 | 0 | 4 | -1 | 47 | 185.247 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.02 | 3.4 | -64.61 | 1 | 4 | 0 | 48 | 186.255 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0765160A1; US6096740 | IBM Patent Data |
