| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 14 | Yes |
Popular Name: MFCD13561611 MFCD13561611
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1220030-35-2 , N/A
METHYLPIPERIDINYLETHYLBUTANAMINEDIHYDROCHLORID
N-Methyl-N-(2-(piperidin-2-yl)ethyl)butan-1-amine dihydrochloride
N-Methyl-N-[2-(2-piperidinyl)ethyl]-1-butanamine dihydrochloride
N-Methyl-N-[2-(2-piperidinyl)ethyl]-1-butanaminedihydrochloride
| 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) | 2.73 | 7.54 | -107.41 | 3 | 2 | 2 | 21 | 200.37 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.73 | 6.35 | -32.94 | 2 | 2 | 1 | 16 | 199.362 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
