Название: product
SMILES:
CNC1CCc2ccc(Cl)cc2C(=O)C1.ClMolecular Processing
Molecular formula
C12H15Cl2NO
Molecular weight
260.16
Exact mass
259.0531
XLogP
2.87
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.417
Molar refractivity
68.82
Supplementary Information
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