COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK813469
Chemical Name: 11-{(5Z)-5-[(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}undecanoicacid
Smiles: OC(=O)CCCCCCCCCCN1C(=S)S/C(=C\c2cn(nc2c2ccccc2)c2ccccc2)/C1=O

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Molecular Weight: 547.74
Empirical Formula: C30H33N3O3S2

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 7.133
Rotatable bonds: 13
H-donors: 1
H-acceptors: 3
PSA: 132
Number of rings: 4

     

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