In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2011 | 17 | Yes |
Popular Name: 4-{4-[(dimethylamino)methyl]piperidin-1-yl}aniline 4-{4-[(dimethylamino)methyl]pipe…
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CAS Number: 1224932-55-1
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) | 1.92 | 7.35 | -89.51 | 4 | 3 | 2 | 35 | 235.375 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 6.69 | -37.37 | 3 | 3 | 1 | 34 | 234.367 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |