In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2009 | 16 | Yes |
Popular Name: 2-amino-1-[4-(hydroxymethyl)piperidin-1-yl]-4-methylpentan-1-one 2-amino-1-[4-(hydroxymethyl)pipe…
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CAS Number: 1218123-62-6
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) | 0.32 | 0.98 | -44.28 | 4 | 4 | 1 | 68 | 229.344 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.32 | 0.69 | -7.77 | 3 | 4 | 0 | 67 | 228.336 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |