In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 17 | Yes |
Popular Name: 1-(2-(4-bromophenoxy)ethyl)-4-methylpiperazine 1-(2-(4-bromophenoxy)ethyl)-4-me…
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CAS Number: 401502-08-7
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) | 2.73 | 6.22 | -35.43 | 1 | 3 | 1 | 17 | 300.22 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 6.11 | -37.15 | 1 | 3 | 1 | 17 | 300.22 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.73 | 3.85 | -3.75 | 0 | 3 | 0 | 16 | 299.212 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 199 - 201 | Enamine Building Blocks |
MP | 199...201 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |