| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[(2-cyanophenyl)methyl]-N-ethyl-butanamide (2S)-2-amino-N-[(2-cyanophenyl)m…
| 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) | 0.89 | 5.13 | -42.2 | 3 | 4 | 1 | 72 | 246.334 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.89 | 4.82 | -6.64 | 2 | 4 | 0 | 70 | 245.326 | 5 | ↓ |
