In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 17 | Yes |
Popular Name: 5-(Aminomethyl)-N-cyclohexyl-N-ethyl-2-pyridinamine 5-(Aminomethyl)-N-cyclohexyl-N-e…
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CAS Numbers: 954273-18-8 , N/A , [954273-18-8]
5-(Aminomethyl)-N-cyclohexyl-N-ethylpyridin-2-amine
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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) | 2.61 | 6.55 | -105.9 | 4 | 3 | 2 | 45 | 235.375 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 6.78 | -3.71 | 2 | 3 | 0 | 42 | 233.359 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.61 | 6.1 | -48.01 | 3 | 3 | 1 | 44 | 234.367 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |