| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 18 | Yes |
Popular Name: (2S)-2-cyano-N-ethyl-3-methyl-N-(4-pyridylmethyl)butanamide (2S)-2-cyano-N-ethyl-3-methyl-N-…
| 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) | 2.18 | 6.79 | -10.55 | 0 | 4 | 0 | 57 | 245.326 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.18 | 7.25 | -35.9 | 1 | 4 | 1 | 58 | 246.334 | 5 | ↓ |
