| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 13 | Yes |
Popular Name: [1-(5-bromothiophen-2-yl)ethyl](cyclopropylmethyl)amine [1-(5-bromothiophen-2-yl)ethyl](…
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CAS Number: 1178131-55-9
| 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) | 3.76 | 7.18 | -38.37 | 2 | 1 | 1 | 17 | 261.208 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.76 | 5.97 | -1.43 | 1 | 1 | 0 | 12 | 260.2 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
