COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK109497
Chemical Name: 2-({2-bromo-4-[(E)-{(2E)-2-[(4-ethylphenyl)imino]-3-methyl-4-oxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}methyl)benzonitrile
Smiles: CCc1ccc(cc1)/N=C\1/S/C(=C/c2ccc(c(c2)Br)OCc2ccccc2C#N)/C(=O)N1C

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Molecular Weight: 532.46
Empirical Formula: C27H22BrN3O2S

Physical State: Dry powder
Available Amount: 440 mg

Lipinsky:
logP: 7.105
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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