SMILES:
CCc1csc(-c2ccc(OCCCO)nc2)n1Molecular Processing
Molecular formula
C13H16N2O2S
Molecular weight
264.35
Exact mass
264.0932
XLogP
2.53
TPSA
55.24
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
18
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
0.385
Molar refractivity
71.92
Supplementary Information
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