In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 12th, 2010 | 18 | Yes |
Popular Name: 3-methyl-N-[2-oxo-2-(1-piperidyl)ethyl]isothiazole-4-carboxamide 3-methyl-N-[2-oxo-2-(1-piperidyl…
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) | 0.67 | 3.3 | -8.8 | 1 | 5 | 0 | 62 | 267.354 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.