Name: (R)-3-(5-(cyclohexylmethoxy)thiophen-2-yl)-3-hydroxypropanenitrile
SMILES:
N#CC[C@@H](O)c1ccc(OCC2CCCCC2)s1Molecular Processing
Molecular formula
C14H19NO2S
Molecular weight
265.38
Exact mass
265.1136
XLogP
3.65
TPSA
53.25
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
71.58
Supplementary Information
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