| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 24 | Yes |
Popular Name: Ethyl 2-((2-aminoethoxy)methyl)-4-(2-chlorophenyl)-6-methylnicotinate Ethyl 2-((2-aminoethoxy)methyl)-…
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CAS Numbers: 113994-36-8 , [113994-36-8]
2-((2-Aminoethoxy)methyl)-4-(2-chlorophenyl)-6-methyl-3-pyridinecarboxylic acid ethyl ester
| 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) | 2.87 | 6.84 | -45.68 | 3 | 5 | 1 | 76 | 349.838 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 6.39 | -11.37 | 2 | 5 | 0 | 74 | 348.83 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
