SMILES:
CC(C)C[C@H](NC(=O)c1cccc(C(O)c2ccc(F)cc2)n1)C(N)=OMolecular Processing
Molecular formula
C19H22FN3O3
Molecular weight
359.4
Exact mass
359.1645
XLogP
1.93
TPSA
105.31
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
94.6
Supplementary Information
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