SMILES:
CCCCC/C=C/CCC[n+]1cccc([C@@H]2CCCN2C)c1.[Br-]Molecular Processing
Molecular formula
C20H33BrN2
Molecular weight
381.4
Exact mass
380.1827
XLogP
1.66
TPSA
7.12
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
9
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
2
Fraction Csp3
0.65
Molar refractivity
93.76
Supplementary Information
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