Name: 7α-(5-bromopentyl)-11β-fluoro-3-hydroxy-estra-1,3,5(10)-trien-17-one
SMILES:
C[C@]12C[C@H](F)[C@@H]3c4ccc(O)cc4C[C@@H](CCCCCBr)[C@H]3[C@@H]1CCC2=OMolecular Processing
Molecular formula
C23H30BrFO2
Molecular weight
437.39
Exact mass
436.1413
XLogP
5.95
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
27
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
6
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.696
Molar refractivity
109.14
Supplementary Information
Details werden geladen…
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