SMILES:
Brc1cccc(Nc2ncnc3nc[nH]c23)c1Molecular Processing
Molecular formula
C11H8BrN5
Molecular weight
290.12
Exact mass
288.9963
XLogP
2.86
TPSA
66.49
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
17
Rings
3
Aromatic rings
3
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
69.11
Supplementary Information
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