COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375511
Chemical Name: 3-(4-chlorophenyl)-4-(4-ethoxyphenyl)-5-[(naphthalen-2-ylmethyl)sulfanyl]-4H-1,2,4-triazole
Smiles: CCOc1ccc(cc1)n1c(SCc2ccc3c(c2)cccc3)nnc1c1ccc(cc1)Cl

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Molecular Weight: 472.01
Empirical Formula: C27H22ClN3OS

Physical State: Dry powder
Available Amount: 667 mg

Lipinsky:
logP: 9.272
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 65
Number of rings: 5

     

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