COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK301991
Chemical Name: (2E)-1-(5-chlorothiophen-2-yl)-3-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)prop-2-en-1-one
Smiles: Clc1ccc(s1)C(=O)/C=C/c1c(C)nn(c1C)c1ccccc1

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Molecular Weight: 342.85
Empirical Formula: C18H15ClN2OS

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 5.279
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 63
Number of rings: 3

     

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