الاسم: compound
SMILES:
Brc1ccc2c(c1)c1cc(Br)ccc1n2CCCNc1ccccc1Molecular Processing
Molecular formula
C21H18Br2N2
Molecular weight
458.2
Exact mass
455.9837
XLogP
6.82
TPSA
16.96
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
5
Heavy atoms
25
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
114.39
Supplementary Information
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