SMILES:
COc1ccc2c3c([nH]c2c1)C1(C)CCC(=O)N1CC3Molecular Processing
Molecular formula
C16H18N2O2
Molecular weight
270.33
Exact mass
270.1368
XLogP
2.57
TPSA
45.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
76.85
Supplementary Information
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