N#Cc1cccc(Cn2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccc4ccc(C#N)cc4c3)c2=O)c1
SMILES: N#Cc1cccc(Cn2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccc4ccc(C#N)cc4c3)c2=O)c1

Molecular Processing

Molecular formula
C35H24N4O
Molecular weight
516.6
Exact mass
516.195
XLogP
6.98
TPSA
74.51
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
40
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.057
Molar refractivity
157.59

Supplementary Information

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