SMILES:
Cn1nnnc1C(=NOCc1cccc(N(CCC2CCCCC2)C(=O)OC(C)(C)C)n1)c1ccccc1Molecular Processing
Molecular formula
C28H37N7O3
Molecular weight
519.65
Exact mass
519.2958
XLogP
5.29
TPSA
107.62
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
9
Heavy atoms
38
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
144.68
Supplementary Information
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