SMILES:
O=C(Nc1nnn[nH]1)c1cncc(Cl)n1Molecular Processing
Molecular formula
C6H4ClN7O
Molecular weight
225.6
Exact mass
225.0166
XLogP
-0.1
TPSA
109.34
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0
Molar refractivity
49.17
Supplementary Information
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