| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 16 | Yes |
Popular Name: 2-(4-Methyl-piperazin-1-yl)-1-phenyl-ethylamine 2-(4-Methyl-piperazin-1-yl)-1-ph…
Find On: PubMed — Wikipedia — Google
CAS Number: 775349-54-7
2-(4-methylpiperazin-1-yl)-1-phenylethan-1-amine
| 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) | -0.65 | 4.73 | -101.58 | 4 | 3 | 2 | 35 | 221.348 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.65 | 1.43 | -2.74 | 2 | 3 | 0 | 32 | 219.332 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.65 | 3.86 | -32.29 | 3 | 3 | 1 | 34 | 220.34 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.65 | 2.26 | -43.7 | 3 | 3 | 1 | 34 | 220.34 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 58 - 60 | Enamine Building Blocks |
| MP | 58...60 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
