SMILES:
CNCCCSCc1ccccn1Molecular Processing
Molecular formula
C10H16N2S
Molecular weight
196.32
Exact mass
196.1034
XLogP
1.92
TPSA
24.92
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
58.94
Supplementary Information
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