| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 17 | Yes |
Popular Name: (2S)-3-[2-cyanoethyl(3-pyridylmethyl)amino]-2-methyl-propanenitrile (2S)-3-[2-cyanoethyl(3-pyridylme…
| 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) | 0.49 | 5.89 | -14.8 | 0 | 4 | 0 | 64 | 228.299 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.49 | 6.18 | -48.34 | 1 | 4 | 1 | 65 | 229.307 | 6 | ↓ |
