| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (2S)-3-[ethyl-(6-isopropylpyrimidin-4-yl)amino]-2-methyl-propanenitrile (2S)-3-[ethyl-(6-isopropylpyrimi…
| 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) | 2.64 | 8.81 | -8.74 | 0 | 4 | 0 | 53 | 232.331 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.64 | 9.47 | -34.37 | 1 | 4 | 1 | 54 | 233.339 | 5 | ↓ |
