COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382234
Chemical Name: (2Z,5Z)-5-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)-3-(2-phenylethyl)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazolidin-4-one
Smiles: COc1ccc2c(c1)n(CC)/c(=C\1/S/C(=N\c3cccc(c3)C(F)(F)F)/N(C1=O)CCc1ccccc1)/s2

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Molecular Weight: 555.64
Empirical Formula: C28H24F3N3O2S2

Physical State: Dry powder
Available Amount: 431 mg

Lipinsky:
logP: 6.434
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 95
Number of rings: 5

     

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