SMILES:
Nc1ccc(Cl)cc1C(=O)c1cccnc1Molecular Processing
Molecular formula
C12H9ClN2O
Molecular weight
232.67
Exact mass
232.0403
XLogP
2.55
TPSA
55.98
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
63.53
Supplementary Information
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