SMILES:
CCc1nnc(C)s1Molecular Processing
Molecular formula
C5H8N2S
Molecular weight
128.2
Exact mass
128.0408
XLogP
1.41
TPSA
25.78
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
8
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
0.6
Molar refractivity
34.02
Supplementary Information
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