SMILES:
O=C1Nc2ccccc2SC1c1cccs1Molecular Processing
Molecular formula
C12H9NOS2
Molecular weight
247.34
Exact mass
247.0126
XLogP
3.53
TPSA
29.1
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.083
Molar refractivity
67.99
Supplementary Information
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