COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK101173
Chemical Name: 2-{[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}acetohydrazide
Smiles: C=CCc1cccc(c1O)/C=N/NC(=O)CSc1nnc(n1CC)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 477.63
Empirical Formula: C26H31N5O2S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 8.081
Rotatable bonds: 9
H-donors: 2
H-acceptors: 2
PSA: 117
Number of rings: 3

     

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