In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 12 | Yes |
Popular Name: 1,1-Dimethyl-2-(3-methyl-piperidin-1-yl)-ethylamine 1,1-Dimethyl-2-(3-methyl-piperid…
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CAS Numbers: 876717-35-0 , 876717-38-3
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) | 1.71 | 4.92 | -110.52 | 4 | 2 | 2 | 32 | 172.316 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.71 | 4.97 | -27.32 | 3 | 2 | 1 | 30 | 171.308 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |