| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 15 | Yes |
Popular Name: [(4-bromothiophen-2-yl)methyl][1-(thiophen-2-yl)ethyl]amine [(4-bromothiophen-2-yl)methyl][1…
Find On: PubMed — Wikipedia — Google
CAS Number: 1040018-08-3
| 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) | 3.99 | 7.69 | -40.77 | 2 | 1 | 1 | 17 | 303.27 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.99 | 6.37 | -3.11 | 1 | 1 | 0 | 12 | 302.262 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
