SMILES:
CC(C)c1ccccc1OCC(=O)Nc1nc2ccccc2s1Molecular Processing
Molecular formula
C18H18N2O2S
Molecular weight
326.42
Exact mass
326.1089
XLogP
4.44
TPSA
51.22
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
23
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
0.222
Molar refractivity
94.28
Supplementary Information
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