COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL380750
Chemical Name: 8-{4-[(E)-{3-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene}methyl]-2-methoxyphenoxy}-7-(2,4-dichlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cc(ccc1Oc1nc2c(n1Cc1ccc(cc1Cl)Cl)c(=O)n(c(=O)n2C)C)/C=C\1/SC(=O)N(C1=O)Cc1cc2OCOc2cc1Cl

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Molecular Weight: 757.01
Empirical Formula: C33H24Cl3N5O8S

Physical State: Dry powder
Available Amount: 870 mg

Lipinsky:
logP: 7.718
Rotatable bonds: 8
H-donors: 0
H-acceptors: 8
PSA: 158
Number of rings: 7

     

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