SMILES:
N#Cc1cc(Cl)cc(Oc2c(Br)ccc(C=O)c2F)c1Molecular Processing
Molecular formula
C14H6BrClFNO2
Molecular weight
354.56
Exact mass
352.9254
XLogP
4.72
TPSA
50.09
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
75.73
Supplementary Information
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