In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 15th, 2010 | 16 | Yes |
Popular Name: 1-methyl-4-[2-(1-methylpiperidin-4-yl)ethyl]piperazine 1-methyl-4-[2-(1-methylpiperidin…
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CAS Number: 1208678-08-3
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) | 1.49 | 6.67 | -75.72 | 2 | 3 | 2 | 12 | 227.396 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 4.29 | -33.59 | 1 | 3 | 1 | 11 | 226.388 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.49 | 6.56 | -85.22 | 2 | 3 | 2 | 12 | 227.396 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |