| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 21 | Yes |
Popular Name: (2S)-2-cyano-N-[(1S)-2-(diethylamino)-1-methyl-ethyl]-3-phenyl-propanamide (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) | 2.49 | 9.07 | -39.01 | 2 | 4 | 1 | 57 | 288.415 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 7.07 | -26.02 | 1 | 4 | 0 | 64 | 287.407 | 8 | ↓ |
