COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK241353
Chemical Name: 2-tert-butyl4-ethyl5-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(sc(c1C)C(=O)OC(C)(C)C)NC1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 450.54
Empirical Formula: C20H22N2O6S2

Physical State: Dry powder
Available Amount: 291 mg

Lipinsky:
logP: 6.324
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 139
Number of rings: 3

     

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