| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 14 | Yes |
Popular Name: (2R,3S)-2-amino-N-(2-cyanoethyl)-N,3-dimethyl-pentanamide (2R,3S)-2-amino-N-(2-cyanoethyl)…
| 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) | -0.39 | 3.15 | -50.59 | 3 | 4 | 1 | 72 | 198.29 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.39 | 2.86 | -12.23 | 2 | 4 | 0 | 70 | 197.282 | 5 | ↓ |
