COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK906523
Chemical Name: 2-[(5Z)-4-oxo-5-{[1-phenyl-3-(3-propoxyphenyl)-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonicacid
Smiles: CCCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCS(=O)(=O)O)c1ccccc1

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Saltdata: 1/3CH3COOH
Molecular Weight: 529.66
Empirical Formula: C24H23N3O5S3

Physical State: Dry powder
Available Amount: 403 mg

Lipinsky:
logP: 2.952
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 167
Number of rings: 4

     

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