| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 14 | Yes |
Popular Name: Piperazine, 1-methyl-2-(phenylmethyl)-, (2S)- (9CI) Piperazine, 1-methyl-2-(phenylme…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1263481-99-7 , 290832-49-4
| 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) | 1.43 | 6.34 | -113.83 | 3 | 2 | 2 | 21 | 192.306 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.43 | 2.68 | -2.65 | 1 | 2 | 0 | 15 | 190.29 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 4.03 | -36.64 | 2 | 2 | 1 | 20 | 191.298 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | WO2000051984A1 | IBM Patent Data |
