Name: 2-amino-3-(4-bromobenzoyl)benzeneacetic acid
SMILES:
Nc1c(CC(=O)O)cccc1C(=O)c1ccc(Br)cc1Molecular Processing
Molecular formula
C15H12BrNO3
Molecular weight
334.17
Exact mass
333.0001
XLogP
2.89
TPSA
80.39
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.067
Molar refractivity
79.77
Supplementary Information
Details werden geladen…
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