COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807070
Chemical Name: 2-{[5-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1c1ccc2c(c1)OCO2

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Molecular Weight: 479.94
Empirical Formula: C24H18ClN3O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.544
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 100
Number of rings: 5

     

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