In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2008 | 13 | Yes |
Popular Name: 2-(3,5-dimethylpiperidin-1-yl)-2-methylpropan-1-amine 2-(3,5-dimethylpiperidin-1-yl)-2…
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CAS Number: 1016686-67-1
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) | 1.58 | 5.01 | -115.07 | 4 | 2 | 2 | 32 | 186.343 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.58 | 4.65 | -26.45 | 3 | 2 | 1 | 30 | 185.335 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 3.51 | -42 | 3 | 2 | 1 | 31 | 185.335 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |