SMILES:
O=C1N(Cc2ccc(C(F)(F)F)o2)c2c(F)cccc2C1(CO)c1cc2c(cc1O)OCO2Molecular Processing
Molecular formula
C22H15F4NO6
Molecular weight
465.36
Exact mass
465.0836
XLogP
3.7
TPSA
92.37
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.227
Molar refractivity
103.4
Supplementary Information
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