COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130176
Chemical Name: 1-(4-bromophenyl)-2-{[5-(phenoxymethyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: C=CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1COc1ccccc1

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Molecular Weight: 444.35
Empirical Formula: C20H18BrN3O2S

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 5.387
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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