| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 11 | Yes |
Popular Name: [(4-bromothiophen-2-yl)methyl](propan-2-yl)amine [(4-bromothiophen-2-yl)methyl](p…
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CAS Number: 1040312-54-6
| 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) | 2.81 | 5.56 | -38.13 | 2 | 1 | 1 | 17 | 235.17 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.81 | 4.27 | -1.83 | 1 | 1 | 0 | 12 | 234.162 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
