SMILES:
Cc1ccc(CNC(=O)[C@H]2CCCO2)c(C)c1-c1nn(-c2ccc(C(F)(F)F)cc2)c(=O)[nH]1Molecular Processing
Molecular formula
C23H23F3N4O3
Molecular weight
460.46
Exact mass
460.1722
XLogP
3.66
TPSA
89.01
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
114.92
Supplementary Information
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