| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 13 | Yes |
Popular Name: 2-Amino-N-[2-(dimethylamino)ethyl]-3-methylbutanamide dihydrochloride 2-Amino-N-[2-(dimethylamino)ethy…
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CAS Numbers: 1236261-47-4 , N/A , [1236261-47-4]
2-Amino-N-(2-(dimethylamino)ethyl)-3-methylbutanamide dihydrochloride
| 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) | -0.57 | 1.38 | -94.74 | 5 | 4 | 2 | 61 | 189.303 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.57 | 1.1 | -43.16 | 4 | 4 | 1 | 60 | 188.295 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.57 | -1.43 | -10.05 | 3 | 4 | 0 | 58 | 187.287 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.57 | -1.15 | -44.45 | 4 | 4 | 1 | 60 | 188.295 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
