SMILES:
CNC(=S)Nc1ccccc1Molecular Processing
Molecular formula
C8H10N2S
Molecular weight
166.25
Exact mass
166.0565
XLogP
1.6
TPSA
24.06
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
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
0.125
Molar refractivity
51.72
Supplementary Information
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