COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL286961
Chemical Name: (5E)-5-(4-tert-butylbenzylidene)-3-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-2-thioxo-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccc(cc2)C(C)(C)C)/C(=O)N1NC1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 457.6
Empirical Formula: C21H19N3O3S3

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.973
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 136
Number of rings: 4

     

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