SMILES:
COc1cc(C2CSC(=S)S2)cc(OC)c1OCMolecular Processing
Molecular formula
C12H14O3S3
Molecular weight
302.44
Exact mass
302.0105
XLogP
3.52
TPSA
27.69
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
81.49
Supplementary Information
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