In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 27th, 2010 | 29 | Yes |
Popular Name: 1-[2-(3,4-dimethoxyanilino)-2-oxo-ethyl]-N-(3-methylisothiazol-5-yl)piperidine-4-carboxamide 1-[2-(3,4-dimethoxyanilino)-2-ox…
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) | 2.21 | 6.11 | -65.13 | 3 | 8 | 1 | 94 | 419.527 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.