SMILES:
Cc1cc(OC(F)F)nc(N)n1Molecular Processing
Molecular formula
C6H7F2N3O
Molecular weight
175.14
Exact mass
175.0557
XLogP
0.97
TPSA
61.03
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
12
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
37.81
Supplementary Information
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