SMILES:
CCCCC(CC)Cn1sc2ccccc2c1=OMolecular Processing
Molecular formula
C15H21NOS
Molecular weight
263.41
Exact mass
263.1344
XLogP
4.28
TPSA
22
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
79.39
Supplementary Information
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