In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 19 | Yes |
Popular Name: (2R)-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclopentanone (2R)-2-[(4-pyrimidin-2-ylpiperaz…
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) | 1.09 | 7.53 | -9.86 | 0 | 5 | 0 | 49 | 260.341 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.09 | 9.55 | -37.45 | 1 | 5 | 1 | 51 | 261.349 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.