SMILES:
CC(C)(C)c1ccc(-c2ccc(C=CC(=O)O)s2)cc1Molecular Processing
Molecular formula
C17H18O2S
Molecular weight
286.4
Exact mass
286.1028
XLogP
4.81
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
85.12
Supplementary Information
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