In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 16 | Yes |
Popular Name: N,N-dimethyl-4-{[(2,2,2-trifluoroethyl)amino]methyl}aniline N,N-dimethyl-4-{[(2,2,2-trifluor…
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CAS Number: 1016811-90-7
None
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) | 2.52 | 6.08 | -45 | 2 | 2 | 1 | 20 | 233.257 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 4.67 | -4.69 | 1 | 2 | 0 | 15 | 232.249 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |