SMILES:
CCOC(=O)C1CCCc2sc(Br)nc21Molecular Processing
Molecular formula
C10H12BrNO2S
Molecular weight
290.18
Exact mass
288.9772
XLogP
2.89
TPSA
39.19
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
62.13
Supplementary Information
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