SMILES:
Cc1ccc(NC(=O)C#Cc2ccccc2)cc1Molecular Processing
Molecular formula
C16H13NO
Molecular weight
235.29
Exact mass
235.0997
XLogP
2.99
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
73.13
Supplementary Information
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