SMILES:
COc1ccc(-c2ccc(N3CC(CNC(C)=O)OC3=O)cc2F)cn1Molecular Processing
Molecular formula
C18H18FN3O4
Molecular weight
359.36
Exact mass
359.1281
XLogP
2.36
TPSA
80.76
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
92.48
Supplementary Information
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