SMILES:
COc1ccc(N=Nc2ccc(O)c(C(=O)Nc3c(C)nc4ncnn4c3O)c2)cc1Molecular Processing
Molecular formula
C20H17N7O4
Molecular weight
419.4
Exact mass
419.1342
XLogP
3.52
TPSA
146.59
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
5
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
110.41
Supplementary Information
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