SMILES:
Cn1nnn(-c2cc(Nc3ncc(F)c(NC4CCN5CCCC5C4)n3)c(F)cc2C2CC2)c1=OMolecular Processing
Molecular formula
C23H27F2N9O
Molecular weight
483.53
Exact mass
483.2307
XLogP
2.69
TPSA
105.79
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
35
Rings
6
Aromatic rings
3
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
125.05
Supplementary Information
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