SMILES:
CC(=O)NC(C)Cc1ccc(C#Cc2ccc(Cl)cc2)cc1Molecular Processing
Molecular formula
C19H18ClNO
Molecular weight
311.81
Exact mass
311.1077
XLogP
3.81
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
3
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
90.86
Supplementary Information
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