SMILES:
CCCCCCN(Cc1ccc(C#Cc2ccc(CCCC)cc2)cc1)c1ccc(F)c(C(=O)OC)c1Molecular Processing
Molecular formula
C33H38FNO2
Molecular weight
499.67
Exact mass
499.2887
XLogP
7.94
TPSA
29.54
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
12
Heavy atoms
37
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
150.41
Supplementary Information
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