In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 33 | Yes |
Popular Name: 2-(4-fluorophenyl)-N-[1-[2-oxo-2-(propylamino)ethyl]-4-piperidyl]quinoline-4-carboxamide 2-(4-fluorophenyl)-N-[1-[2-oxo-2…
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) | 4.33 | 10.25 | -54.65 | 3 | 6 | 1 | 76 | 449.55 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 8.05 | -17.57 | 2 | 6 | 0 | 74 | 448.542 | 7 | ↓ |