In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 12 | Yes |
Popular Name: N-Methyl-N-(3-pyrrolidinylmethyl)-1-butanamine dihydrochloride N-Methyl-N-(3-pyrrolidinylmethyl…
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CAS Numbers: 1219964-16-5 , N/A , [1219964-16-5]
METHYLPYRROLIDINYLMETHYLBUTANAMINEDIHYDROCHLORID
N-Methyl-N-(3-pyrrolidinylmethyl)-1-butanaminedihydrochloride
N-Methyl-N-(pyrrolidin-3-ylmethyl)butan-1-amine 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) | 2.07 | 5.81 | -97 | 3 | 2 | 2 | 21 | 172.316 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.07 | 4.38 | -33.97 | 2 | 2 | 1 | 16 | 171.308 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |