SMILES:
N#Cc1ccc(OCc2ccccc2)c(O)c1Molecular Processing
Molecular formula
C14H11NO2
Molecular weight
225.25
Exact mass
225.079
XLogP
2.84
TPSA
53.25
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
63.6
Supplementary Information
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