COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382900
Chemical Name: (2Z,5Z)-2-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}imino)-5-(5-chloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-3-cyclohexyl-1,3-thiazolidin-4-one
Smiles: CCn1/c(=C\2/S/C(=N\CCCCOc3ccc(cc3C(CC)(C)C)C(CC)(C)C)/N(C2=O)C2CCCCC2)/sc2c1cc(Cl)cc2

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Molecular Weight: 682.43
Empirical Formula: C38H52ClN3O2S2

Physical State: Dry powder
Available Amount: 501 mg

Lipinsky:
logP: 9.6
Rotatable bonds: 12
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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