In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 6th, 2006 | 13 | Yes |
Popular Name: (2S)-2-amino-3-(3-methylpyridin-2-yl)propanoic acid (2S)-2-amino-3-(3-methylpyridin-…
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CAS Numbers: 1269959-97-8 , 603941-01-1
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) | -1.61 | 1.86 | -34.13 | 3 | 4 | 0 | 81 | 180.207 | 3 | ↓ |
Lo Low (pH 4.5-6) | -1.61 | 2.16 | -80.89 | 4 | 4 | 1 | 82 | 181.215 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |