SMILES:
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1IMolecular Processing
Molecular formula
C15H11F3INO
Molecular weight
405.16
Exact mass
404.9837
XLogP
4.87
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
83.29
Supplementary Information
Details werden geladen…
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