SMILES:
Cc1nc(OCCCc2ccccc2)c([N+](=O)[O-])c(N2CCc3ccccc3CC2)n1Molecular Processing
Molecular formula
C24H26N4O3
Molecular weight
418.5
Exact mass
418.2005
XLogP
4.31
TPSA
81.39
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
119.74
Supplementary Information
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