COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK703085
Chemical Name: (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-({1-phenyl-3-[4-(propan-2-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1OC)CCN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OC(C)C)c2ccccc2)/C1=O

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Molecular Weight: 585.75
Empirical Formula: C32H31N3O4S2

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 6.547
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 123
Number of rings: 5

     

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