COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546983
Chemical Name: 2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl3-chloro-1-benzothiophene-2-carboxylate
Smiles: Cc1nn(c(c1)C)CCOC(=O)c1sc2c(c1Cl)cccc2

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Molecular Weight: 334.83
Empirical Formula: C16H15ClN2O2S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.747
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 72
Number of rings: 3

     

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