In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 38 | Yes |
Popular Name: benzyl-oxo-[4-(2-pyridyl)piperazine-1-carbonyl]BLAHone benzyl-oxo-[4-(2-pyridyl)piperaz…
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) | 3.65 | 12.26 | -67.56 | 1 | 7 | 1 | 75 | 523.638 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.65 | 11.99 | -33.42 | 0 | 7 | 0 | 74 | 522.63 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.