SMILES:
COC(=O)c1ccc(C=CC(C2CCCCC2)n2c(-c3ccc(OC)nc3OC)nc3cc(F)c(F)cc32)cc1Molecular Processing
Molecular formula
C31H31F2N3O4
Molecular weight
547.6
Exact mass
547.2283
XLogP
7.02
TPSA
75.47
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
40
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.323
Molar refractivity
148.41
Supplementary Information
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