SMILES:
Cn1nccc1Nc1cc(Cl)ccn1Molecular Processing
Molecular formula
C9H9ClN4
Molecular weight
208.65
Exact mass
208.0516
XLogP
2.21
TPSA
42.74
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
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
0.111
Molar refractivity
55.74
Supplementary Information
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