SMILES:
CC(Nc1cc(-c2cc3nccn3c(N3CC4CC3CN4Cc3ccccc3)n2)ccn1)c1ccccc1Molecular Processing
Molecular formula
C31H31N7
Molecular weight
501.64
Exact mass
501.2641
XLogP
5.43
TPSA
61.59
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
38
Rings
7
Aromatic rings
5
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.258
Molar refractivity
151.09
Supplementary Information
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