| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 17 | Yes |
Popular Name: 4-[(methylamino)methyl]-N-(2,2,2-trifluoroethyl)benzamide hydrochloride 4-[(methylamino)methyl]-N-(2,2,2…
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CAS Numbers: 1156895-87-2 , 1157585-08-4
| 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) | 1.62 | 3.96 | -49.62 | 3 | 3 | 1 | 46 | 247.24 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.62 | 2.47 | -8.05 | 2 | 3 | 0 | 41 | 246.232 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
