COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK836634
Chemical Name: (2E)-3-phenyl-1-[3-(prop-2-yn-1-ylsulfanyl)-4H-1,2,4-triazol-4-yl]prop-2-en-1-one
Smiles: C#CCSc1nncn1C(=O)/C=C/c1ccccc1

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Molecular Weight: 269.33
Empirical Formula: C14H11N3OS

Physical State: Dry powder
Available Amount: 339 mg

Lipinsky:
logP: 3.152
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 73
Number of rings: 2

     

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