COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK806738
Chemical Name: (2E)-1-[3-(prop-2-yn-1-ylsulfanyl)-4H-1,2,4-triazol-4-yl]-3-(thiophen-2-yl)prop-2-en-1-one
Smiles: C#CCSc1nncn1C(=O)/C=C/c1cccs1

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Molecular Weight: 275.36
Empirical Formula: C12H9N3OS2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.967
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 101
Number of rings: 2

     

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