| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-methyl-N-[(1S)-1-(5-methyl-2-thienyl)ethyl]butanediamide (2S)-2-amino-N-methyl-N-[(1S)-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) | 0.83 | 0.79 | -39.04 | 5 | 5 | 1 | 91 | 270.378 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.83 | 0.47 | -10.65 | 4 | 5 | 0 | 89 | 269.37 | 5 | ↓ |
