SMILES:
Cc1ccc(CCN=C(NC#N)c2ccccn2)cc1Molecular Processing
Molecular formula
C16H16N4
Molecular weight
264.33
Exact mass
264.1375
XLogP
2.45
TPSA
61.07
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
79.27
Supplementary Information
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