名称: 2-acetyl-5-amino-1,2,3,4-tetrahydroisoquinoline
SMILES:
CC(=O)N1CCc2c(N)cccc2C1Molecular Processing
Molecular formula
C11H14N2O
Molecular weight
190.25
Exact mass
190.1106
XLogP
1.17
TPSA
46.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
55.65
Supplementary Information
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