SMILES:
Cc1nc(C(=O)Nc2ccc(F)c(C3(C)N=C(N)OCC3(F)F)c2)c(C(F)(F)F)o1Molecular Processing
Molecular formula
C17H14F6N4O3
Molecular weight
436.31
Exact mass
436.097
XLogP
3.59
TPSA
102.74
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
90.47
Supplementary Information
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