SMILES:
CCc1nc(C#N)c(C#N)nc1ClMolecular Processing
Molecular formula
C8H5ClN4
Molecular weight
192.61
Exact mass
192.0203
XLogP
1.44
TPSA
73.36
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
45.85
Supplementary Information
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