COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL224663
Chemical Name: (6E)-6-({1-[4-(butan-2-yl)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}methylidene)-2-(ethylsulfanyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCSc1sc2=NC(=O)/C(=C/c3cc(n(c3C)c3ccc(cc3)C(CC)C)C)/C(=N)n2n1

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Molecular Weight: 465.64
Empirical Formula: C24H27N5OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.06
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 124
Number of rings: 4

     

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