COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085380
Chemical Name: (6Z)-6-{3-bromo-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}-2-cyclohexyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(cc(c1OCc1ccccc1F)Br)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C1CCCCC1

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Molecular Weight: 571.47
Empirical Formula: C26H24BrFN4O3S

Physical State: Dry powder
Available Amount: 294 mg

Lipinsky:
logP: 5.191
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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