SMILES:
CNC(=O)c1ccc2c(c1)OC(c1ccccc1)(c1ccccc1)O2Molecular Processing
Molecular formula
C21H17NO3
Molecular weight
331.37
Exact mass
331.1208
XLogP
3.72
TPSA
47.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.095
Molar refractivity
94.75
Supplementary Information
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