SMILES:
Cc1ccc2[nH]c(S)nc2c1Molecular Processing
Molecular formula
C8H8N2S
Molecular weight
164.23
Exact mass
164.0408
XLogP
2.16
TPSA
28.68
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
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
48.08
Supplementary Information
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