Name: 6-mercapto-1-methyl-1,2,3,4-tetrahydroquinolin-2-one
SMILES:
CN1C(=O)CCc2cc(S)ccc21Molecular Processing
Molecular formula
C10H11NOS
Molecular weight
193.27
Exact mass
193.0561
XLogP
1.88
TPSA
20.31
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
55.43
Supplementary Information
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