SMILES:
Cc1ccccc1-c1nc(-c2cccc(Cl)c2)nn1CMolecular Processing
Molecular formula
C16H14ClN3
Molecular weight
283.76
Exact mass
283.0876
XLogP
4.11
TPSA
30.71
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
81.62
Supplementary Information
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