COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037911
Chemical Name: [(4-chlorophenyl)sulfonyl][3-(3-ethyl-1H-imidazol-3-ium-1-yl)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]azanide
Smiles: CC[n+]1ccn(c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)Cl)C(=O)c2c(C1=O)cccc2

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Molecular Weight: 441.89
Empirical Formula: C21H16ClN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 85
Number of rings: 4

     

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