COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK525740
Chemical Name: pentyl6-[(5E)-4-oxo-5-{4-oxo-3-[6-oxo-6-(pentyloxy)hexyl]-2-thioxo-1,3-thiazolidin-5-ylidene}-2-thioxo-1,3-thiazolidin-3-yl]hexanoate
Smiles: CCCCCOC(=O)CCCCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCCCC(=O)OCCCCC)/C1=O

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Molecular Weight: 630.92
Empirical Formula: C28H42N2O6S4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.435
Rotatable bonds: 22
H-donors: 0
H-acceptors: 6
PSA: 208
Number of rings: 2

     

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