SMILES:
COC(=O)N1CC2CN(c3ccc(N4CC(CNC(C)=O)OC4=O)cc3F)CC2C1Molecular Processing
Molecular formula
C20H25FN4O5
Molecular weight
420.44
Exact mass
420.1809
XLogP
1.42
TPSA
91.42
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
1
Saturated rings
3
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.55
Molar refractivity
105.87
Supplementary Information
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