In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 20 | Yes |
Popular Name: 3-ethoxy-4-(pyridin-3-ylmethoxy)benzoic acid 3-ethoxy-4-(pyridin-3-ylmethoxy)…
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CAS Number: 926259-71-4
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) | 2.23 | 6.48 | -52.03 | 0 | 5 | -1 | 71 | 272.28 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.23 | 6.92 | -75.14 | 1 | 5 | 0 | 73 | 273.288 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 185 - 187 | Enamine Building Blocks |
MP | 185...187 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |