SMILES:
C#Cc1cccc(Nc2nccc3c(Nc4ncccc4-c4ccncn4)c(C)ccc23)c1Molecular Processing
Molecular formula
C27H20N6
Molecular weight
428.5
Exact mass
428.1749
XLogP
5.86
TPSA
75.62
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
33
Rings
5
Aromatic rings
5
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.037
Molar refractivity
132.69
Supplementary Information
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