COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK813092
Chemical Name: (5Z)-3-(butan-2-yl)-5-{[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCCCOc1ccc(cc1)c1nn(cc1/C=C/1\SC(=S)N(C1=O)C(CC)C)c1ccccc1

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Molecular Weight: 491.68
Empirical Formula: C27H29N3O2S2

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 6.743
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 104
Number of rings: 4

     

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