COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK139964
Chemical Name: 1-(4-bromophenyl)-2-({5-[(2-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: CCn1c(SCC(=O)c2ccc(cc2)Br)nnc1COc1ccccc1Cl

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Molecular Weight: 466.79
Empirical Formula: C19H17BrClN3O2S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 5.612
Rotatable bonds: 7
H-donors: 0
H-acceptors: 2
PSA: 82
Number of rings: 3

     

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