In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 21 | Yes |
Popular Name: 3-(3,3-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)propanamide 3-(3,3-dimethylmorpholin-4-yl)-N…
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) | 2.46 | 4.79 | -8.1 | 1 | 4 | 0 | 42 | 308.447 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.46 | 6.88 | -38.82 | 2 | 4 | 1 | 43 | 309.455 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.