SMILES:
CCCOC(=NC#N)c1cncc(NC(C)C)c1Molecular Processing
Molecular formula
C13H18N4O
Molecular weight
246.31
Exact mass
246.1481
XLogP
2.56
TPSA
70.3
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
71.39
Supplementary Information
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