COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045533
Chemical Name: 4-[(5Z)-5-(3-bromobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]butanamide
Smiles: CCc1n[nH]/c(=N/C(=O)CCCN2C(=S)S/C(=C\c3cccc(c3)Br)/C2=O)/s1

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Molecular Weight: 497.46
Empirical Formula: C18H17BrN4O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.884
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 156
Number of rings: 3

     

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