COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807109
Chemical Name: 1-(4-chlorophenyl)-2-{[4-(4-methoxyphenyl)-5-(thiophen-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nnc1c1cccs1

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Molecular Weight: 441.96
Empirical Formula: C21H16ClN3O2S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.736
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 110
Number of rings: 4

     

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