COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130735
Chemical Name: 2-{[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-bromophenyl)ethanone
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1Cc1ccccc1

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Molecular Weight: 428.35
Empirical Formula: C20H18BrN3OS

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 5.535
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 3

     

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