SMILES:
Clc1ncnc2ncccc12Molecular Processing
Molecular formula
C7H4ClN3
Molecular weight
165.58
Exact mass
165.0094
XLogP
1.68
TPSA
38.67
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
2
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
42.34
Supplementary Information
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