COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK706681
Chemical Name: 2-[(5Z)-5-({3-[4-(butylsulfanyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonicacid
Smiles: CCCCSc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCS(=O)(=O)O)c1ccccc1

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Molecular Weight: 559.76
Empirical Formula: C25H25N3O4S4

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 4.204
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 183
Number of rings: 4

     

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