Cc1cc(-c2cnc3c(NCC(O)C(F)(F)F)cc(Oc4cccc(F)c4)nn23)ccc1C(=O)NC1CC1
SMILES: Cc1cc(-c2cnc3c(NCC(O)C(F)(F)F)cc(Oc4cccc(F)c4)nn23)ccc1C(=O)NC1CC1

Molecular Processing

Molecular formula
C26H23F4N5O3
Molecular weight
529.49
Exact mass
529.1737
XLogP
4.86
TPSA
100.78
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
38
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
130.67

Supplementary Information

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