الاسم: Compound ( 3 )
SMILES:
COc1c2cc3ccsc3c(OC)c2cc2ccsc12Molecular Processing
Molecular formula
C16H12O2S2
Molecular weight
300.4
Exact mass
300.0279
XLogP
5.29
TPSA
18.46
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
20
Rings
4
Aromatic rings
4
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
87.82
Supplementary Information
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