COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL391586
Chemical Name: (2E)-1-(1-methyl-1H-pyrazol-4-yl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one
Smiles: Cn1ncc(c1)C(=O)/C=C/c1ccc(s1)C

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Molecular Weight: 232.31
Empirical Formula: C12H12N2OS

Physical State: Dry powder
Available Amount: 48 mg

Lipinsky:
logP: 2.658
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 63
Number of rings: 2

     

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