SMILES:
CN1CCN(C2=Nc3cc(Br)ccc3-n3ccc4cc(Br)cc2c43)CC1Molecular Processing
Molecular formula
C20H18Br2N4
Molecular weight
474.2
Exact mass
471.9898
XLogP
4.79
TPSA
23.77
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
26
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
113.94
Supplementary Information
Details werden geladen…
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