SMILES:
Cc1c(Cl)ccc2c1CC(=O)N2Molecular Processing
Molecular formula
C9H8ClNO
Molecular weight
181.62
Exact mass
181.0294
XLogP
2.14
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
48.52
Supplementary Information
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