이름: 2-(4-methoxylphenyl)quinazoline-4-carboxylic acid
SMILES:
COc1ccc(-c2nc(C(=O)O)c3ccccc3n2)cc1Molecular Processing
Molecular formula
C16H12N2O3
Molecular weight
280.28
Exact mass
280.0848
XLogP
3
TPSA
72.31
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
21
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
0.062
Molar refractivity
78.49
Supplementary Information
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