COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822939
Chemical Name: 2-[(5Z)-5-({3-[4-(morpholin-4-ylsulfonyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonicacid
Smiles: S=C1S/C(=C\c2cn(nc2c2ccc(cc2)S(=O)(=O)N2CCOCC2)c2ccccc2)/C(=O)N1CCS(=O)(=O)O

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Saltdata: 1/5CH3COOH
Molecular Weight: 620.75
Empirical Formula: C25H24N4O7S4

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 0.862
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 213
Number of rings: 5

     

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