SMILES:
Cc1cccc(COc2cccc(OCCc3ccccn3)c2)c1C(=O)OMolecular Processing
Molecular formula
C22H21NO4
Molecular weight
363.41
Exact mass
363.1471
XLogP
4.29
TPSA
68.65
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
102.35
Supplementary Information
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