COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381046
Chemical Name: (2Z,5Z)-2-[(4-bromophenyl)imino]-5-(5-chloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-3-(2-phenylethyl)-1,3-thiazolidin-4-one
Smiles: CCn1/c(=C\2/S/C(=N\c3ccc(cc3)Br)/N(C2=O)CCc2ccccc2)/sc2c1cc(Cl)cc2

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Molecular Weight: 570.96
Empirical Formula: C26H21BrClN3OS2

Physical State: Dry powder
Available Amount: 600 mg

Lipinsky:
logP: 6.76
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 86
Number of rings: 5

     

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