In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2011 | 22 | Yes |
Popular Name: N-ethyl-N-(3-fluorophenyl)-3-methyl-isothiazolo[5,4-b]pyridine-5-carboxamide N-ethyl-N-(3-fluorophenyl)-3-met…
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) | 3.33 | 6.85 | -11.55 | 0 | 4 | 0 | 46 | 315.373 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.