COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK661782
Chemical Name: (5E)-5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzylidene}-1-(4-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: CCOc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)c2ccc(cc2)C)cc(c1OCc1ccccc1Cl)Br

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Molecular Weight: 585.91
Empirical Formula: C27H22BrClN2O4S

Physical State: Dry powder
Available Amount: 490 mg

Lipinsky:
logP: 7.078
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 99
Number of rings: 4

     

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