COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822722
Chemical Name: (2Z)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[1-phenyl-3-(4-propoxyphenyl)-1H-pyrazol-4-yl]prop-2-enamide
Smiles: CCCOc1ccc(cc1)c1nn(cc1/C=C(\C(=O)NC1CCS(=O)(=O)C1)/C#N)c1ccccc1

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Molecular Weight: 490.58
Empirical Formula: C26H26N4O4S

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 2.922
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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