COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382390
Chemical Name: (2Z,5Z)-2-[(3-bromophenyl)imino]-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-3-(2-phenylethyl)-1,3-thiazolidin-4-one
Smiles: COc1ccc2c(c1)n(C)/c(=C\1/S/C(=N\c3cccc(c3)Br)/N(C1=O)CCc1ccccc1)/s2

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Molecular Weight: 552.52
Empirical Formula: C26H22BrN3O2S2

Physical State: Dry powder
Available Amount: 592 mg

Lipinsky:
logP: 5.425
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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