SMILES:
COCC(C)OC1CCN(C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)CC1Molecular Processing
Molecular formula
C25H28FN3O4
Molecular weight
453.51
Exact mass
453.2064
XLogP
3.31
TPSA
84.52
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
122.92
Supplementary Information
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