| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 17 | Yes |
Popular Name: (2S)-2-amino-N-[(1R)-1-(4-methylsulfanylphenyl)ethyl]butanamide (2S)-2-amino-N-[(1R)-1-(4-methyl…
| 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) | 1.55 | 4.28 | -43.55 | 4 | 3 | 1 | 57 | 253.391 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 3.99 | -6.56 | 3 | 3 | 0 | 55 | 252.383 | 5 | ↓ |
