In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: 3-[ethyl-(6-methylpyrimidin-4-yl)amino]propanenitrile 3-[ethyl-(6-methylpyrimidin-4-yl…
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) | 0.51 | 7.15 | -9.65 | 0 | 4 | 0 | 53 | 190.25 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.51 | 7.58 | -36.58 | 1 | 4 | 1 | 54 | 191.258 | 4 | ↓ |