COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823014
Chemical Name: (5Z)-3-hexyl-5-({1-phenyl-3-[4-(piperidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)S(=O)(=O)N2CCCCC2)c2ccccc2)/C1=O

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Molecular Weight: 594.82
Empirical Formula: C30H34N4O3S3

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 6.605
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 141
Number of rings: 5

     

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