In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 29 | Yes |
Popular Name: 2-[[1-[(4-fluorophenyl)methyl]-4-piperidyl]methylamino]quinoline-4-carboxylic 2-[[1-[(4-fluorophenyl)methyl]-4…
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) | 4.31 | 12.22 | -102.77 | 3 | 5 | 1 | 71 | 394.47 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.31 | 11.78 | -81.17 | 2 | 5 | 0 | 69 | 393.462 | 6 | ↓ |