In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 17 | No |
Popular Name: N'-hydroxy-3-(piperidin-1-ylmethyl)benzene-1-carboximidamide N'-hydroxy-3-(piperidin-1-ylmeth…
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CAS Number: 1016857-30-9
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) | 0.94 | 5.14 | -37.95 | 4 | 4 | 1 | 63 | 234.323 | 3 | ↓ |
Ref Reference (pH 7) | 1.07 | 4.97 | -86.73 | 5 | 4 | 2 | 62 | 235.331 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 6 | -55.08 | 4 | 4 | 1 | 65 | 234.323 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 153 - 155 | Enamine Building Blocks |
MP | 153...155 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |