COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046235
Chemical Name: 4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(2Z)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: O=C(/N=c\1/[nH]nc(s1)C)CCCN1C(=S)S/C(=C\c2ccccc2Cl)/C1=O

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Molecular Weight: 438.98
Empirical Formula: C17H15ClN4O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.898
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 156
Number of rings: 3

     

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