In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | Yes |
Popular Name: 2-{[1-(3-ethyl-1-benzofuran-2-yl)ethyl]amino}acetamide 2-{[1-(3-ethyl-1-benzofuran-2-yl…
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CAS Number: 926231-39-2
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) | 2.19 | 3.9 | -45.19 | 4 | 4 | 1 | 73 | 247.318 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.19 | 2.62 | -15.26 | 3 | 4 | 0 | 68 | 246.31 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |