SMILES:
COc1c(N2CCCC(N)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12Molecular Processing
Molecular formula
C19H22FN3O4
Molecular weight
375.4
Exact mass
375.1594
XLogP
2.11
TPSA
97.79
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
27
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
99.37
Supplementary Information
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