| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2010 | 20 | Yes |
Popular Name: (2S)-N-butyl-2-[(3-cyanophenyl)methyl-methyl-amino]propanamide (2S)-N-butyl-2-[(3-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) | 2.35 | 7.96 | -43.23 | 2 | 4 | 1 | 57 | 274.388 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 5.71 | -11.41 | 1 | 4 | 0 | 56 | 273.38 | 7 | ↓ |
