| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 16 | Yes |
Popular Name: (2S)-2-cyano-N-[(1S)-2-(diethylamino)-1-methyl-ethyl]butanamide (2S)-2-cyano-N-[(1S)-2-(diethyla…
| 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) | 1.56 | 6.11 | -37.64 | 2 | 4 | 1 | 57 | 226.344 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.75 | 4.11 | -27.15 | 1 | 4 | 0 | 64 | 225.336 | 7 | ↓ |
