COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK821338
Chemical Name: (2E)-3-[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1ccc(c(c1)Cl)OC)c1ccccc1)/C(=O)NC1CCS(=O)(=O)C1

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Molecular Weight: 496.97
Empirical Formula: C24H21ClN4O4S

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 2.375
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 4

     

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