SMILES:
Clc1ccc(OCCSc2nc3ccccc3[nH]2)cc1Molecular Processing
Molecular formula
C15H13ClN2OS
Molecular weight
304.8
Exact mass
304.0437
XLogP
4.39
TPSA
37.91
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.133
Molar refractivity
83.76
Supplementary Information
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