SMILES:
CCCN(CCC)CC(=O)N1c2cc(C)c(C)cc2-n2c(nn(CCCN(C)C)c2=O)-c2cccnc21Molecular Processing
Molecular formula
C28H39N7O2
Molecular weight
505.67
Exact mass
505.3165
XLogP
3.76
TPSA
79.5
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
147.87
Supplementary Information
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