SMILES:
Cc1nc(-c2ccc(CCCl)cc2)cs1Molecular Processing
Molecular formula
C12H12ClNS
Molecular weight
237.75
Exact mass
237.0379
XLogP
3.9
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
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
0.25
Molar refractivity
66.71
Supplementary Information
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