| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 12 | Yes |
Popular Name: (3R)-3-[[(2R)-2-cyanopropyl]-methyl-amino]butanenitrile (3R)-3-[[(2R)-2-cyanopropyl]-met…
| 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) | 0.66 | 3.79 | -10.54 | 0 | 3 | 0 | 51 | 165.24 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.66 | 5.8 | -45.94 | 1 | 3 | 1 | 52 | 166.248 | 4 | ↓ |
