In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 3rd, 2008 | 15 | No |
Popular Name: ethyl 5-oxo-1,2,3,5-tetrahydroimidazo[1,2-a]pyridine-8-carboxylate ethyl 5-oxo-1,2,3,5-tetrahydroim…
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CAS Numbers: 439118-88-4 , [439118-88-4]
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) | 1.28 | 4.4 | -12.37 | 1 | 5 | 0 | 68 | 208.217 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.28 | 3.37 | -36 | 0 | 5 | -1 | 67 | 207.209 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 3.18 | -35.02 | 2 | 5 | 1 | 65 | 209.225 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.