COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK002514
Chemical Name: (6Z)-3-(benzylsulfanyl)-6-{4-[(4-chlorobenzyl)oxy]-3-ethoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)Cl)/C=C/1\C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2

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Molecular Weight: 563.1
Empirical Formula: C28H23ClN4O3S2

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 6.262
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 137
Number of rings: 5

     

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