SMILES:
Cn1nc(Cl)c(Cl)c1SCCOMolecular Processing
Molecular formula
C6H8Cl2N2OS
Molecular weight
227.12
Exact mass
225.9734
XLogP
1.81
TPSA
38.05
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
51.04
Supplementary Information
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