SMILES:
CC(=O)ON=C(Nc1ccc(F)c(Cl)c1)c1nonc1NMolecular Processing
Molecular formula
C11H9ClFN5O3
Molecular weight
313.68
Exact mass
313.0378
XLogP
1.78
TPSA
115.63
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
3
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
72.05
Supplementary Information
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