| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 17 | Yes |
Popular Name: 2-[[(1S)-2-(diethylamino)-1-methyl-ethyl]amino]pyridine-4-carbonitrile 2-[[(1S)-2-(diethylamino)-1-meth…
| 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) | 1.71 | 7.15 | -38.85 | 2 | 4 | 1 | 53 | 233.339 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 4.7 | -4.71 | 1 | 4 | 0 | 52 | 232.331 | 6 | ↓ |
