SMILES:
C#Cc1ccc(-c2ccc(Cl)cc2)cn1Molecular Processing
Molecular formula
C13H8ClN
Molecular weight
213.67
Exact mass
213.0345
XLogP
3.38
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
15
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
Molar refractivity
62.62
Supplementary Information
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