COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059881
Chemical Name: (6Z)-6-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCc1ccccc1Cl)Br)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC

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Molecular Weight: 547.86
Empirical Formula: C23H20BrClN4O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.737
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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