In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 14 | Yes |
Popular Name: (S)-2-Amino-N-methyl-N-pyridin-2-ylmethyl-propionamide (S)-2-Amino-N-methyl-N-pyridin-2…
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CAS Numbers: 1307550-01-1 , 1417789-31-1
(S)-2-Amino-N-methyl-N-(pyridin-2-ylmethyl)propanamide hydrochloride
(S)-2-Amino-N-methyl-N-pyridin-2-ylmethyl-propionamide hydrochloride
(S)-2-Amino-N-methyl-N-pyridin-2-ylmethyl-propionamidehydrochloride
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) | -0.90 | 1.76 | -43.58 | 3 | 4 | 1 | 61 | 194.258 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.90 | 1.45 | -13.43 | 2 | 4 | 0 | 59 | 193.25 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.90 | 2.19 | -89.77 | 4 | 4 | 2 | 62 | 195.266 | 3 | ↓ |