| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2009 | 15 | Yes |
Popular Name: [(4-bromothiophen-2-yl)methyl][(5-bromothiophen-2-yl)methyl]amine [(4-bromothiophen-2-yl)methyl][(…
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CAS Number: 1178307-90-8
| 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) | 4.36 | 7.83 | -48.14 | 2 | 1 | 1 | 17 | 368.139 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.36 | 6.48 | -3.91 | 1 | 1 | 0 | 12 | 367.131 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
