SMILES:
CC(C)N1CCC(Oc2ccc3c(c2)cc(C(=O)N2CCC(F)(F)CC2)n3-c2ccc(F)c(C#N)c2)CC1Molecular Processing
Molecular formula
C29H31F3N4O2
Molecular weight
524.59
Exact mass
524.2399
XLogP
5.76
TPSA
61.5
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
38
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.448
Molar refractivity
138.39
Supplementary Information
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