이름: solution
SMILES:
Cc1c[nH]c(=O)c2c(Br)csc12Molecular Processing
Molecular formula
C8H6BrNOS
Molecular weight
244.11
Exact mass
242.9353
XLogP
2.66
TPSA
32.86
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
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
0.125
Molar refractivity
54.88
Supplementary Information
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