SMILES:
COc1ccc2c(c1)C(C)(C)c1sc3ccccc3c1C2=OMolecular Processing
Molecular formula
C19H16O2S
Molecular weight
308.4
Exact mass
308.0871
XLogP
4.78
TPSA
26.3
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
22
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
90.38
Supplementary Information
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