SMILES:
O=c1c(CCc2ccncc2)cc2cccnc2n1-c1cccc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C21H16N4O3
Molecular weight
372.38
Exact mass
372.1222
XLogP
3.47
TPSA
90.92
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
105.64
Supplementary Information
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