SMILES:
CC(C)(O)Cn1ccc(NC(=O)C(CC2CC3CCC2C3)N2CC(Oc3c(F)cccc3F)=CC2=O)n1Molecular Processing
Molecular formula
C27H32F2N4O4
Molecular weight
514.57
Exact mass
514.2392
XLogP
3.87
TPSA
96.69
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
37
Rings
5
Aromatic rings
2
Saturated rings
2
Aliphatic rings
3
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
131.28
Supplementary Information
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