SMILES:
COc1nc(N)nc(OC(F)(F)F)n1Molecular Processing
Molecular formula
C5H5F3N4O2
Molecular weight
210.11
Exact mass
210.0365
XLogP
0.36
TPSA
83.15
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
37.47
Supplementary Information
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