| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 20th, 2010 | 19 | Yes |
Popular Name: 2-[4-[(1S)-2-cyano-1-methyl-ethyl]piperazin-1-yl]pyridine-4-carbonitrile 2-[4-[(1S)-2-cyano-1-methyl-ethy…
| 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) | 0.53 | 6.05 | -11.53 | 0 | 5 | 0 | 67 | 255.325 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.53 | 7.96 | -48.93 | 1 | 5 | 1 | 68 | 256.333 | 3 | ↓ |
