COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK822960
Chemical Name: (2Z)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[3-(naphthalen-2-yl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide
Smiles: N#C/C(=C/c1cn(nc1c1ccc2c(c1)cccc2)c1ccccc1)/C(=O)NC1CCS(=O)(=O)C1

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Molecular Weight: 482.56
Empirical Formula: C27H22N4O3S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 3.274
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 113
Number of rings: 5

     

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