SMILES:
O=C1NCc2c(Cl)ccc(-c3cc4ccccc4[nH]3)c21Molecular Processing
Molecular formula
C16H11ClN2O
Molecular weight
282.73
Exact mass
282.056
XLogP
3.73
TPSA
44.89
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.062
Molar refractivity
79.91
Supplementary Information
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