SMILES:
COc1ccc(N=Nc2ccc(O)c(C(=O)NCc3nnn[nH]3)c2)cc1Molecular Processing
Molecular formula
C16H15N7O3
Molecular weight
353.34
Exact mass
353.1236
XLogP
2.26
TPSA
137.74
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
90.62
Supplementary Information
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