| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 16 | Yes |
Popular Name: (S)-2-Amino-N-methyl-N-(4-methylsulfanyl-benzyl)-propionamide (S)-2-Amino-N-methyl-N-(4-methyl…
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CAS Number: 1304396-72-2
| 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) | 0.70 | 4.51 | -43.57 | 3 | 3 | 1 | 48 | 239.364 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.70 | 4.18 | -10.63 | 2 | 3 | 0 | 46 | 238.356 | 4 | ↓ |
