In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 25th, 2008 | 13 | Yes |
Popular Name: N-methyl-N-(1-methylpyrrolidin-3-yl)-beta-alanine N-methyl-N-(1-methylpyrrolidin-3…
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CAS Number: 915925-24-5
3-(Methyl(1-methylpyrrolidin-3-yl)amino)propanoic acid
N-methyl-N-(1-methyl-3-pyrrolidinyl)-beta-alanine hydrochloride
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) | 0.01 | 3.74 | -43.56 | 1 | 4 | 0 | 48 | 186.255 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 1.16 | -43.23 | 0 | 4 | -1 | 47 | 185.247 | 4 | ↓ |