In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 20 | Yes |
Popular Name: 3-[(3R)-3-methylmorpholin-4-yl]-N-(2-methylsulfanylphenyl)propanamide 3-[(3R)-3-methylmorpholin-4-yl]-…
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) | 1.98 | 4.41 | -8.55 | 1 | 4 | 0 | 42 | 294.42 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.98 | 6.6 | -39.78 | 2 | 4 | 1 | 43 | 295.428 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.