이름: 8-fluoro-1-ethyl-1,2,3,4-tetrahydro-isoquinoline
SMILES:
CCC1NCCc2cccc(F)c21Molecular Processing
Molecular formula
C11H14FN
Molecular weight
179.24
Exact mass
179.111
XLogP
2.42
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
51.14
Supplementary Information
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