| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 26th, 2010 | 13 | Yes |
Popular Name: 2-Methyl-5-phenylpiperazine 2-Methyl-5-phenylpiperazine
Find On: PubMed — Wikipedia — Google
CAS Number: 904816-81-5
| 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) | 1.66 | 4.51 | -118.81 | 4 | 2 | 2 | 33 | 178.279 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 3.22 | -36.57 | 3 | 2 | 1 | 29 | 177.271 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 1.94 | -2.13 | 2 | 2 | 0 | 24 | 176.263 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.66 | 3.19 | -37.48 | 3 | 2 | 1 | 29 | 177.271 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0061673A1; US4456757; US4525589; US4560755 | IBM Patent Data |
