Name: 5-(3,5-dimethoxy-phenyl)-quinoline-8-carboxylic acid
SMILES:
COc1cc(OC)cc(-c2ccc(C(=O)O)c3ncccc23)c1Molecular Processing
Molecular formula
C18H15NO4
Molecular weight
309.32
Exact mass
309.1001
XLogP
3.62
TPSA
68.65
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
23
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
0.111
Molar refractivity
87.24
Supplementary Information
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