SMILES:
Cc1ccc(CC2CN(CC#CCO)CCN2C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1CMolecular Processing
Molecular formula
C26H26F6N2O2
Molecular weight
512.49
Exact mass
512.1898
XLogP
4.71
TPSA
43.78
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.423
Molar refractivity
122.19
Supplementary Information
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