SMILES:
CCC(CC)Nc1cc(C(=O)O)c(F)cc1C(N)=OMolecular Processing
Molecular formula
C13H17FN2O3
Molecular weight
268.29
Exact mass
268.1223
XLogP
2.22
TPSA
92.42
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
69.87
Supplementary Information
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