SMILES:
COc1ccc(CSc2ccncc2)c2c1OCC2CMolecular Processing
Molecular formula
C16H17NO2S
Molecular weight
287.38
Exact mass
287.098
XLogP
3.88
TPSA
31.35
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
80.7
Supplementary Information
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