Name: 3-amino-6-bromo-5-trifluoromethyl-pyrazine-2-carboxylic acid
SMILES:
Nc1nc(C(F)(F)F)c(Br)nc1C(=O)OMolecular Processing
Molecular formula
C6H3BrF3N3O2
Molecular weight
286.01
Exact mass
284.9361
XLogP
1.54
TPSA
89.1
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
46.11
Supplementary Information
Details werden geladen…
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