Name: compound 8
SMILES:
CCc1cccc2c3c([nH]c12)C(CC)(CC=O)OCC3Molecular Processing
Molecular formula
C17H21NO2
Molecular weight
271.36
Exact mass
271.1572
XLogP
3.5
TPSA
42.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
79.98
Supplementary Information
Details werden geladen…
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