SMILES:
Brc1ccc(CN2CCNCC2)cc1BrMolecular Processing
Molecular formula
C11H14Br2N2
Molecular weight
334.05
Exact mass
331.9524
XLogP
2.62
TPSA
15.27
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
69.99
Supplementary Information
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