SMILES:
COc1ccc(-c2nc(SCCCO)sc2-c2ccc(OC)cc2)cc1Molecular Processing
Molecular formula
C20H21NO3S2
Molecular weight
387.53
Exact mass
387.0963
XLogP
4.97
TPSA
51.58
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
26
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
0.25
Molar refractivity
108.52
Supplementary Information
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