In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: 2-(3,3-dimethylmorpholin-4-yl)-1-(4-methylsulfanylphenyl)ethanone 2-(3,3-dimethylmorpholin-4-yl)-1…
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) | 2.58 | 5.69 | -7.32 | 0 | 3 | 0 | 30 | 279.405 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.58 | 7.73 | -36.49 | 1 | 3 | 1 | 31 | 280.413 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.