COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK278694
Chemical Name: 2-{[5-benzyl-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-bromophenyl)ethanone
Smiles: CC(Cn1c(SCC(=O)c2ccc(cc2)Br)nnc1Cc1ccccc1)C

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Molecular Weight: 444.4
Empirical Formula: C21H22BrN3OS

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 6.105
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 3

     

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