| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2009 | 13 | Yes |
Popular Name: 1-Methyl-4-(3-pyrrolidinylmethyl)piperazinedihydrochloride 1-Methyl-4-(3-pyrrolidinylmethyl…
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CAS Numbers: 1219957-83-1 , N/A , [1219957-83-1]
1-Methyl-4-(3-pyrrolidinylmethyl)piperazine dihydrochloride
1-Methyl-4-(pyrrolidin-3-ylmethyl)piperazine dihydrochloride
| 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) | 0.52 | 3.12 | -81.6 | 3 | 3 | 2 | 24 | 185.315 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 2.93 | -98.63 | 3 | 3 | 2 | 24 | 185.315 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.52 | 0.74 | -37.85 | 2 | 3 | 1 | 23 | 184.307 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
