SMILES:
NC1=Nc2ccc(Cl)c(Cl)c2CN1Molecular Processing
Molecular formula
C8H7Cl2N3
Molecular weight
216.07
Exact mass
215.0017
XLogP
2.04
TPSA
50.41
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
54.58
Supplementary Information
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