COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK445808
Chemical Name: 4-(4-butylphenyl)-5-{[(2-chloro-4-fluorobenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Smiles: CCCCc1ccc(cc1)n1c(CSCc2ccc(cc2Cl)F)nnc1S

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Molecular Weight: 421.99
Empirical Formula: C20H21ClFN3S2

Physical State: Dry powder
Available Amount: 565 mg

Lipinsky:
logP: 7.49
Rotatable bonds: 7
H-donors: 0
H-acceptors: 0
PSA: 94
Number of rings: 3

     

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