SMILES:
Clc1ccc2c(c1)CNc1ccccc1O2Molecular Processing
Molecular formula
C13H10ClNO
Molecular weight
231.68
Exact mass
231.0451
XLogP
4.06
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
65.29
Supplementary Information
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