الاسم: ( 2 )
SMILES:
OCC=CCSc1cc2ccccc2n1-c1ccccc1Molecular Processing
Molecular formula
C18H17NOS
Molecular weight
295.41
Exact mass
295.1031
XLogP
4.27
TPSA
25.16
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
90.22
Supplementary Information
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