COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL234320
Chemical Name: (6E)-6-({1-[2-(4-chloro-3-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene)-5-imino-2-(pyridin-3-yl)-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)Cl)c1cccnc1

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Molecular Weight: 541.03
Empirical Formula: C28H21ClN6O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.392
Rotatable bonds: 6
H-donors: 1
H-acceptors: 2
PSA: 121
Number of rings: 6

     

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