COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK967930
Chemical Name: 1-(4-bromophenyl)-2-({5-[(phenylsulfanyl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1CSc1ccccc1

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Molecular Weight: 460.42
Empirical Formula: C20H18BrN3OS2

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 5.958
Rotatable bonds: 7
H-donors: 0
H-acceptors: 1
PSA: 98
Number of rings: 3

     

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