SMILES:
BrCCOc1ccc(-n2ccnc2)cc1Molecular Processing
Molecular formula
C11H11BrN2O
Molecular weight
267.13
Exact mass
266.0055
XLogP
2.65
TPSA
27.05
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.182
Molar refractivity
62.85
Supplementary Information
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