SMILES:
COc1cc(F)c(N2CCC(C=CCc3ccccc3)CC2)cc1FMolecular Processing
Molecular formula
C21H23F2NO
Molecular weight
343.42
Exact mass
343.1748
XLogP
4.99
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
97.13
Supplementary Information
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