In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 20 | Yes |
Popular Name: 1-[[(2S,5R)-2,5-dimethylmorpholin-4-yl]methyl]quinolin-4-one 1-[[(2S,5R)-2,5-dimethylmorpholi…
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) | 1.17 | 5.73 | -14.52 | 0 | 4 | 0 | 34 | 272.348 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.17 | 7.9 | -58.17 | 1 | 4 | 1 | 36 | 273.356 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.