SMILES:
CCCCCCc1csc2c(CCCCCC)c(C(=O)O)sc12Molecular Processing
Molecular formula
C19H28O2S2
Molecular weight
352.56
Exact mass
352.1531
XLogP
6.91
TPSA
37.3
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
11
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.632
Molar refractivity
102.35
Supplementary Information
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