SMILES:
Brc1ccc(S[C@@H]2CCOC2)cc1Molecular Processing
Molecular formula
C10H11BrOS
Molecular weight
259.17
Exact mass
257.9714
XLogP
3.33
TPSA
9.23
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
59.22
Supplementary Information
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