COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK119580
Chemical Name: 1-(4-bromophenyl)-2-{[4-ethyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1c1cccc(c1)C

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Molecular Weight: 416.34
Empirical Formula: C19H18BrN3OS

Physical State: Dry powder
Available Amount: 200 mg

Lipinsky:
logP: 6.099
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 3

     

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