| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 12 | Yes |
Popular Name: 3-(4-Ethyl-piperazin-1-yl)-propylamine 3-(4-Ethyl-piperazin-1-yl)-propy…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4524-96-3 , [4524-96-3]
1-Piperazinepropanamine, 4-ethyl- (9CI)
3-(4-ethyl-1-piperazinyl)-1-propanamine
| 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) | -0.31 | 1.51 | -88.54 | 4 | 3 | 2 | 35 | 173.304 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.31 | -0.88 | -44.13 | 3 | 3 | 1 | 34 | 172.296 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.31 | 1.5 | -104.42 | 4 | 3 | 2 | 35 | 173.304 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 136-137°/33 Torr | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
