CCOC(=O)CNc1ncc(F)cc1N
SMILES: CCOC(=O)CNc1ncc(F)cc1N

Molecular Processing

Molecular formula
C9H12FN3O2
Molecular weight
213.21
Exact mass
213.0914
XLogP
0.78
TPSA
77.24
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
15
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
0.333
Molar refractivity
53.73

Supplementary Information

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