SMILES:
Cc1ccc(-c2ccc(C(C)N3CCC(CCCO)(c4ccc(F)cc4)OC3=O)cc2)c(C)n1Molecular Processing
Molecular formula
C28H31FN2O3
Molecular weight
462.57
Exact mass
462.2319
XLogP
6.08
TPSA
62.66
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
34
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
129.76
Supplementary Information
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