COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK071714
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-ethoxy-2-hydroxyphenyl)methylidene]acetohydrazide
Smiles: CCOc1cccc(c1O)/C=N/NC(=O)CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 529.66
Empirical Formula: C29H31N5O3S

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 9.129
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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