In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 2nd, 2010 | 24 | Yes |
Popular Name: [4-hydroxy-8-(trifluoromethyl)-3-quinolyl]-(4-methyl-1-piperidyl)methanone [4-hydroxy-8-(trifluoromethyl)-3…
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) | 1.60 | 8.19 | -17.46 | 1 | 4 | 0 | 53 | 338.329 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.90 | 6.77 | -48.25 | 0 | 4 | -1 | 56 | 337.321 | 2 | ↓ |