SMILES:
CCCCCC(=O)Sc1ccccn1Molecular Processing
Molecular formula
C11H15NOS
Molecular weight
209.31
Exact mass
209.0874
XLogP
3.28
TPSA
29.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
59.24
Supplementary Information
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