SMILES:
O=c1cc(SCc2ccc(Cl)cc2)cc[nH]1Molecular Processing
Molecular formula
C12H10ClNOS
Molecular weight
251.74
Exact mass
251.0172
XLogP
3.32
TPSA
32.86
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
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
0.083
Molar refractivity
68.08
Supplementary Information
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