Cc1cn(CC2CCCCC2)c(=O)n(CCCN2CCN(c3ccccc3OCC(F)(F)F)CC2)c1=O
SMILES: Cc1cn(CC2CCCCC2)c(=O)n(CCCN2CCN(c3ccccc3OCC(F)(F)F)CC2)c1=O

Molecular Processing

Molecular formula
C27H37F3N4O3
Molecular weight
522.61
Exact mass
522.2818
XLogP
4.05
TPSA
59.71
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.63
Molar refractivity
137.54

Supplementary Information

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