SMILES:
O=C1N(Cc2ccc(C(F)(F)F)o2)c2ccccc2C1(O)c1cc2c(cc1O)OC(F)(F)O2Molecular Processing
Molecular formula
C21H12F5NO6
Molecular weight
469.32
Exact mass
469.0585
XLogP
4.11
TPSA
92.37
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
98.65
Supplementary Information
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