SMILES:
O=c1c2ccc(Cl)cc2cc2n1CCCS2Molecular Processing
Molecular formula
C12H10ClNOS
Molecular weight
251.74
Exact mass
251.0172
XLogP
3.15
TPSA
22
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
68.56
Supplementary Information
Récupération des détails…
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