COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK379842
Chemical Name: (2Z,5Z)-3-benzyl-5-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(2-methyl-5-nitrophenyl)imino]-1,3-thiazolidin-4-one
Smiles: CCn1/c(=C\2/S/C(=N\c3cc(ccc3C)[N+](=O)[O-])/N(C2=O)Cc2ccccc2)/sc2c1cccc2

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Molecular Weight: 502.62
Empirical Formula: C26H22N4O3S2

Physical State: Dry powder
Available Amount: 610 mg

Lipinsky:
logP: 5.157
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 132
Number of rings: 5

     

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