N#Cc1ccc(Oc2ccc(C=O)cc2)s1
SMILES: N#Cc1ccc(Oc2ccc(C=O)cc2)s1

Molecular Processing

Molecular formula
C12H7NO2S
Molecular weight
229.26
Exact mass
229.0197
XLogP
3.22
TPSA
50.09
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
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
60.94

Supplementary Information

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