In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2011 | 19 | Yes |
Popular Name: 3-[(1-benzylpiperidin-4-yl)(methyl)amino]propan-1-ol 3-[(1-benzylpiperidin-4-yl)(meth…
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CAS Number: 778568-73-3
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) | 1.80 | 4.85 | -38.83 | 2 | 3 | 1 | 28 | 263.405 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 5.08 | -35.95 | 2 | 3 | 1 | 28 | 263.405 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.80 | 7.33 | -104.5 | 3 | 3 | 2 | 29 | 264.413 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |