SMILES:
CC12CC(F)C3C4CCC(=O)C=C4CC(CCCCCCl)C3C1CCC2=OMolecular Processing
Molecular formula
C23H32ClFO2
Molecular weight
394.96
Exact mass
394.2075
XLogP
5.67
TPSA
34.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
27
Rings
4
Aromatic rings
0
Saturated rings
3
Aliphatic rings
4
Stereo centers
7
Undefined stereo
7
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.826
Molar refractivity
105.44
Supplementary Information
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