SMILES:
N[C@@H]1CS[C@@H](c2ccccc2)CN(CC2CC2)C1=OMolecular Processing
Molecular formula
C15H20N2OS
Molecular weight
276.4
Exact mass
276.1296
XLogP
2.04
TPSA
46.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
78.92
Supplementary Information
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