SMILES:
Nc1nc2ccc(OCc3c(Cl)cccc3Cl)cc2s1Molecular Processing
Molecular formula
C14H10Cl2N2OS
Molecular weight
325.22
Exact mass
323.9891
XLogP
4.76
TPSA
48.14
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
84.83
Supplementary Information
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