SMILES:
O=C(Cl)c1ccnc(Cl)c1Molecular Processing
Molecular formula
C6H3Cl2NO
Molecular weight
176
Exact mass
174.9592
XLogP
2.11
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.43
Supplementary Information
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