COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK021421
Chemical Name: (6Z)-3-(benzylsulfanyl)-6-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3,5-dimethoxybenzylidene)-5-imino-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
Smiles: CCC(c1ccc(cc1)OCCOc1c(OC)cc(cc1OC)/C=C/1\C(=O)N=c2n(C1=N)c(SCc1ccccc1)ns2)C

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Molecular Weight: 630.79
Empirical Formula: C33H34N4O5S2

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 6.788
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 156
Number of rings: 5

     

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