SMILES:
Cc1cccc(C)c1Nc1c(-c2cccc(O)c2)nc2ccc([N+](=O)[O-])cn12Molecular Processing
Molecular formula
C21H18N4O3
Molecular weight
374.4
Exact mass
374.1379
XLogP
4.98
TPSA
92.7
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
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
108.15
Supplementary Information
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