In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2008 | 12 | Yes |
Popular Name: 4-Methyl-1-(3-pyrrolidinyl)piperidinedihydrochloride 4-Methyl-1-(3-pyrrolidinyl)piper…
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CAS Numbers: 1219957-30-8 , N/A
4-Methyl-1-(3-pyrrolidinyl)piperidine dihydrochloride
4-Methyl-1-(pyrrolidin-3-yl)piperidine dihydrochloride
None
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) | 1.40 | 5.35 | -105 | 3 | 2 | 2 | 21 | 170.3 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 3.93 | -30.64 | 2 | 2 | 1 | 16 | 169.292 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 3.18 | -36.65 | 2 | 2 | 1 | 20 | 169.292 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 1.77 | -1.3 | 1 | 2 | 0 | 15 | 168.284 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |