COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL301337
Chemical Name: 2-({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-(3,5-di-tert-butyl-4-hydroxyphenyl)ethanone
Smiles: C=CCn1c(SCC(=O)c2cc(c(c(c2)C(C)(C)C)O)C(C)(C)C)nnc1COc1ccc(cc1)Cl

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Molecular Weight: 528.12
Empirical Formula: C28H34ClN3O3S

Available Amount: 0 mg

Lipinsky:
logP: 8.445
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 102
Number of rings: 3

     

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