名称: solution
SMILES:
CC(=O)c1c(Cl)nc2ccccn12Molecular Processing
Molecular formula
C9H7ClN2O
Molecular weight
194.62
Exact mass
194.0247
XLogP
2.19
TPSA
34.37
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
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
0.111
Molar refractivity
50.21
Supplementary Information
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