SMILES:
ClCc1ccc(Oc2nc3ccccc3s2)cc1Molecular Processing
Molecular formula
C14H10ClNOS
Molecular weight
275.76
Exact mass
275.0172
XLogP
4.83
TPSA
22.12
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
75.69
Supplementary Information
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