SMILES:
O=C1N=C(NC2CC3CCC2C3)SC12CCCCC2Molecular Processing
Molecular formula
C15H22N2OS
Molecular weight
278.42
Exact mass
278.1453
XLogP
3.1
TPSA
41.46
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.867
Molar refractivity
78.22
Supplementary Information
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