SMILES:
CCc1cccc2c3c([nH]c12)C(CC)(CC(=O)O)OCC3Molecular Processing
Molecular formula
C17H21NO3
Molecular weight
287.36
Exact mass
287.1521
XLogP
3.38
TPSA
62.32
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.471
Molar refractivity
81.55
Supplementary Information
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