In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 20 | Yes |
Popular Name: 4,6-dimethyl-2-[4-(2-methylprop-2-enyl)piperazin-1-yl]pyridine-3-carbonitrile 4,6-dimethyl-2-[4-(2-methylprop-…
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) | 2.75 | 8.35 | -35.91 | 1 | 4 | 1 | 44 | 271.388 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.75 | 5.97 | -6.87 | 0 | 4 | 0 | 43 | 270.38 | 3 | ↓ |