SMILES:
Cc1ccc(CSc2nc3cscc3[nH]2)nc1Molecular Processing
Molecular formula
C12H11N3S2
Molecular weight
261.38
Exact mass
261.0394
XLogP
3.62
TPSA
41.57
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
72.51
Supplementary Information
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