COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK381797
Chemical Name: (2Z,5Z)-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-{[3-(trifluoromethyl)phenyl]imino}-1,3-thiazolidin-4-one
Smiles: CCCCN1/C(=N/c2cccc(c2)C(F)(F)F)/S/C(=c/2\sc3c(n2C)cc(cc3)Cl)/C1=O

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Molecular Weight: 497.99
Empirical Formula: C22H19ClF3N3OS2

Physical State: Dry powder
Available Amount: 526 mg

Lipinsky:
logP: 5.984
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 86
Number of rings: 4

     

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