COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK031135
Chemical Name: (5Z)-2-(azepan-1-yl)-5-(4-tert-butylbenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CC(c1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCCCCC1)(C)C

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Molecular Weight: 342.51
Empirical Formula: C20H26N2OS

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: 5.204
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 57
Number of rings: 3

     

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