COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806794
Chemical Name: (2E)-3-(4-methoxyphenyl)-1-{3-[(2-oxo-2-phenylethyl)sulfanyl]-4H-1,2,4-triazol-4-yl}prop-2-en-1-one
Smiles: COc1ccc(cc1)/C=C/C(=O)n1cnnc1SCC(=O)c1ccccc1

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Molecular Weight: 379.44
Empirical Formula: C20H17N3O3S

Physical State: Dry powder
Available Amount: 289 mg

Lipinsky:
logP: 4.193
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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