In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2008 | 25 | Yes |
Popular Name: (4-pyrimidin-2-ylpiperazin-1-yl)-(2-pyrrolidin-1-yl-3-pyridyl)methanone (4-pyrimidin-2-ylpiperazin-1-yl)…
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) | 0.76 | 10.54 | -11.94 | 0 | 7 | 0 | 65 | 338.415 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.76 | 10.5 | -37.9 | 1 | 7 | 1 | 67 | 339.423 | 3 | ↓ |