SMILES:
O=C(CCCOc1ccccc1Cl)Nc1cscc1C(=O)OMolecular Processing
Molecular formula
C15H14ClNO4S
Molecular weight
339.8
Exact mass
339.0332
XLogP
3.9
TPSA
75.63
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
86.09
Supplementary Information
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