名称: compound
SMILES:
O=C(NCCc1cccc2ccc(O)cc12)C1CCC1Molecular Processing
Molecular formula
C17H19NO2
Molecular weight
269.34
Exact mass
269.1416
XLogP
3
TPSA
49.33
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.353
Molar refractivity
79.67
Supplementary Information
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