SMILES:
NNC(=S)N1CCC(O)CC1Molecular Processing
Molecular formula
C6H13N3OS
Molecular weight
175.26
Exact mass
175.0779
XLogP
-0.81
TPSA
61.52
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
46.73
Supplementary Information
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