COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904184
Chemical Name: [(5Z)-4-oxo-5-({1-phenyl-3-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-3-yl]aceticacid
Smiles: OC(=O)CN1C(=S)S/C(=C\c2cn(nc2c2cccc(c2)S(=O)(=O)N2CCCC2)c2ccccc2)/C1=O

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Molecular Weight: 554.67
Empirical Formula: C25H22N4O5S3

Physical State: Dry powder
Available Amount: 399 mg

Lipinsky:
logP: 3.301
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 178
Number of rings: 5

     

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