名称: compound 0204
SMILES:
CC(=O)Oc1ccc2ncnc(Cl)c2c1Molecular Processing
Molecular formula
C10H7ClN2O2
Molecular weight
222.63
Exact mass
222.0196
XLogP
2.21
TPSA
52.08
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
55.86
Supplementary Information
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