Название: (3S,8aR)-3-(3,4,5-trifluorophenyl)-2,3,6,8a-tetrahydro-1H-indolizin-5-one
SMILES:
O=C1CC=C[C@H]2CC[C@@H](c3cc(F)c(F)c(F)c3)N12Molecular Processing
Molecular formula
C14H12F3NO
Molecular weight
267.25
Exact mass
267.0871
XLogP
3.1
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
62.68
Supplementary Information
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