In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 31st, 2008 | 33 | Yes |
Popular Name: N-isobutyl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoline-4-carboxamide N-isobutyl-2-[4-[3-(trifluoromet…
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) | 5.39 | 9.92 | -12.63 | 1 | 5 | 0 | 48 | 456.512 | 6 | ↓ |