SMILES:
CSc1cc(Br)cnc1ClMolecular Processing
Molecular formula
C6H5BrClNS
Molecular weight
238.54
Exact mass
236.9015
XLogP
3.22
TPSA
12.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
48.73
Supplementary Information
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