SMILES:
N#Cc1ccc(N(CCBr)n2cnnc2)cc1Molecular Processing
Molecular formula
C11H10BrN5
Molecular weight
292.14
Exact mass
291.012
XLogP
1.81
TPSA
57.74
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
17
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
0.182
Molar refractivity
67.72
Supplementary Information
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