SMILES:
CCCc1nc2c(C)cc(-c3coc(-c4ccccc4)n3)cc2n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1Molecular Processing
Molecular formula
C34H29N7O
Molecular weight
551.65
Exact mass
551.2434
XLogP
7.51
TPSA
98.31
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
42
Rings
7
Aromatic rings
7
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.147
Molar refractivity
163.55
Supplementary Information
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