SMILES:
Cc1nc(OCCCc2ccccn2)c([N+](=O)[O-])c(N2CCc3ccccc3CC2)n1Molecular Processing
Molecular formula
C23H25N5O3
Molecular weight
419.49
Exact mass
419.1957
XLogP
3.71
TPSA
94.28
H-bond donors
0
H-bond acceptors
7
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
8
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
117.54
Supplementary Information
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