In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 14th, 2010 | 29 | Yes |
Popular Name: [2-(1-piperidyl)-3-pyridyl]-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]methanone [2-(1-piperidyl)-3-pyridyl]-[6-(…
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) | 4.59 | 10.61 | -11.15 | 0 | 5 | 0 | 46 | 405.42 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.59 | 11.07 | -42.38 | 1 | 5 | 1 | 47 | 406.428 | 4 | ↓ |