SMILES:
CCOC(=O)C(C)(C)Oc1ccc2[nH]c(C)c(-c3ccc(C)cc3)c2c1Molecular Processing
Molecular formula
C22H25NO3
Molecular weight
351.45
Exact mass
351.1834
XLogP
5.17
TPSA
51.32
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
104.55
Supplementary Information
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