SMILES:
CCOC(=O)c1cccc2nc(Br)sc12Molecular Processing
Molecular formula
C10H8BrNO2S
Molecular weight
286.15
Exact mass
284.9459
XLogP
3.24
TPSA
39.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
63.28
Supplementary Information
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