SMILES:
COc1cc(OCCCN2CCC(C(O)(c3ccc(F)cc3)c3ccc(F)cc3)CC2)ccc1C(C)=OMolecular Processing
Molecular formula
C30H33F2NO4
Molecular weight
509.59
Exact mass
509.2378
XLogP
5.59
TPSA
59
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.367
Molar refractivity
138.07
Supplementary Information
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