N[C@H]1CCN(c2ccc(N3C[C@H](CN(C(=O)OCC(Cl)(Cl)Cl)c4ccon4)OC3=O)cc2F)C1
SMILES: N[C@H]1CCN(c2ccc(N3C[C@H](CN(C(=O)OCC(Cl)(Cl)Cl)c4ccon4)OC3=O)cc2F)C1

Molecular Processing

Molecular formula
C20H21Cl3FN5O5
Molecular weight
536.77
Exact mass
535.0592
XLogP
3.69
TPSA
114.37
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
14
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
124.31

Supplementary Information

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