Name: product
SMILES:
CC(=O)Nc1ccc(Sc2ccc(Br)cc2N)cc1Molecular Processing
Molecular formula
C14H13BrN2OS
Molecular weight
337.24
Exact mass
335.9932
XLogP
4.14
TPSA
55.12
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
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
0.071
Molar refractivity
83.42
Supplementary Information
Details werden geladen…
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