| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2011 | 13 | Yes |
Popular Name: (R)-Methyl 2-amino-3-(pyridin-2-yl)propanoate dihydrochloride (R)-Methyl 2-amino-3-(pyridin-2-…
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CAS Numbers: 163513-22-2 , [163513-22-2]
| 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) | -0.33 | 2.67 | -6.73 | 2 | 4 | 0 | 65 | 180.207 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.33 | 3.01 | -34.8 | 3 | 4 | 1 | 67 | 181.215 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.33 | 2.42 | -33.72 | 3 | 4 | 1 | 66 | 181.215 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.