COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK062645
Chemical Name: 3-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Smiles: COc1ccc(cc1)n1c(nnc1c1ccc(cc1)C(C)(C)C)SCc1cccc(c1)C(F)(F)F

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Molecular Weight: 497.58
Empirical Formula: C27H26F3N3OS

Physical State: Dry powder
Available Amount: 353 mg

Lipinsky:
logP: 9.006
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 65
Number of rings: 4

     

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