SMILES:
CC(C)(CC(=O)c1ccc(-c2ccc(Nc3nccs3)cc2)cc1)C(=O)OMolecular Processing
Molecular formula
C21H20N2O3S
Molecular weight
380.47
Exact mass
380.1195
XLogP
5.24
TPSA
79.29
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
107.64
Supplementary Information
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