SMILES:
Brc1ccc(CN2CCOC(c3ccccc3)C2)cc1Molecular Processing
Molecular formula
C17H18BrNO
Molecular weight
332.24
Exact mass
331.0572
XLogP
4.02
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
84.55
Supplementary Information
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