In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 22 | Yes |
Popular Name: 4,6-dimethyl-2-[4-(2-pyridyl)piperazin-1-yl]pyridine-3-carbonitrile 4,6-dimethyl-2-[4-(2-pyridyl)pip…
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) | 2.35 | 7.47 | -33.35 | 1 | 5 | 1 | 57 | 294.382 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.35 | 7.19 | -10.24 | 0 | 5 | 0 | 56 | 293.374 | 2 | ↓ |