COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK703272
Chemical Name: (5Z)-5-({1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-3-(propan-2-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: C=CCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(C)C)c1ccccc1

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Saltdata: 1/3CH3COOH
Molecular Weight: 461.61
Empirical Formula: C25H23N3O2S2

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 5.423
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 104
Number of rings: 4

     

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