COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL225046
Chemical Name: (6E)-2-(2-cyclohexylethyl)-6-(3,5-dichloro-4-hydroxybenzylidene)-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\c1cc(Cl)c(c(c1)Cl)O)CCC1CCCCC1

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Molecular Weight: 451.38
Empirical Formula: C20H20Cl2N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.575
Rotatable bonds: 4
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 4

     

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