COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL307210
Chemical Name: 1-[1-(3,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-ylsulfanyl)ethanone
Smiles: O=C(c1cc(n(c1C)c1ccc(c(c1)C)C)C)CSc1nnc2n1c1ccccc1s2

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Molecular Weight: 446.6
Empirical Formula: C24H22N4OS2

Available Amount: 0 mg

Lipinsky:
logP: 7.289
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 105
Number of rings: 5

     

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