SMILES:
CC1CCc2c(N3CCC(Cc4ccccc4)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23Molecular Processing
Molecular formula
C26H27FN2O3
Molecular weight
434.51
Exact mass
434.2006
XLogP
4.81
TPSA
62.54
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
32
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
123.24
Supplementary Information
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