SMILES:
Cc1cc(C)n(-c2ccc(Cl)nn2)n1Molecular Processing
Molecular formula
C9H9ClN4
Molecular weight
208.65
Exact mass
208.0516
XLogP
1.93
TPSA
43.6
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
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
0.222
Molar refractivity
53.64
Supplementary Information
Details werden geladen…
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