COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK727555
Chemical Name: (6Z)-2-(benzylsulfanyl)-6-({1-[2-(3,4-dimethylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C/c1cn(c2c1cccc2)CCOc1ccc(c(c1)C)C)SCc1ccccc1

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Molecular Weight: 565.72
Empirical Formula: C31H27N5O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.714
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 133
Number of rings: 6

     

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