COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK904759
Chemical Name: (2E)-2-cyano-3-{3-[3-(dimethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}-N-(1,1-dioxidotetrahydrothiophen-3-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N(C)C)c1ccccc1)/C(=O)NC1CCS(=O)(=O)C1

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Molecular Weight: 539.64
Empirical Formula: C25H25N5O5S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 1.175
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 158
Number of rings: 4

     

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