SMILES:
COCCn1ccc(NC(=O)c2nc(C)ccc2Nc2cncnc2)n1Molecular Processing
Molecular formula
C17H19N7O2
Molecular weight
353.39
Exact mass
353.16
XLogP
2.02
TPSA
106.85
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
96.34
Supplementary Information
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