COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149931
Chemical Name: N-[(2E,5E)-4-hydroxy-5-(2-hydroxy-5-nitrobenzylidene)-1,3-thiazol-2(5H)-ylidene]-1-phenylmethanesulfonamide
Smiles: OC1=N/C(=N\S(=O)(=O)Cc2ccccc2)/S/C/1=C/c1cc(ccc1O)[N+](=O)[O-]

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Molecular Weight: 419.44
Empirical Formula: C17H13N3O6S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.385
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 178
Number of rings: 3

     

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