Name: 17-difluoromethylene-3-tetrahydropyranyloxy-estra-1,3,5(10),6-tetraene
SMILES:
C[C@]12CC[C@@H]3c4ccc(OC5CCCCO5)cc4C=C[C@H]3[C@@H]1CCC2=C(F)FMolecular Processing
Molecular formula
C24H28F2O2
Molecular weight
386.48
Exact mass
386.2057
XLogP
6.68
TPSA
18.46
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
28
Rings
5
Aromatic rings
1
Saturated rings
3
Aliphatic rings
4
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
105.23
Supplementary Information
Details werden geladen…
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