In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 33 | Yes |
Popular Name: ethyl-oxo-[4-(2-pyridyl)piperazine-1-carbonyl]BLAHone ethyl-oxo-[4-(2-pyridyl)piperazi…
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) | 2.63 | 9.33 | -63.29 | 1 | 7 | 1 | 75 | 461.567 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.63 | 9.05 | -35.95 | 0 | 7 | 0 | 74 | 460.559 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.