SMILES:
Cc1c(C(=O)O)cnn1-c1ccc(Cl)cc1Molecular Processing
Molecular formula
C11H9ClN2O2
Molecular weight
236.66
Exact mass
236.0353
XLogP
2.53
TPSA
55.12
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
16
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
0.091
Molar refractivity
60.27
Supplementary Information
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